smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name O=C(Nc1c([O-])cccc1F)c1ccc(Cl)c(Cl)c1 ZINC000078807075 185113307 /nfs/dbraw/zinc/11/33/07/185113307.db2.gz USLUUMNSZZQRGW-UHFFFAOYSA-N -1 1 300.116 4.090 20 0 DIADMM Cc1ccc(C)c(CSc2nc(-c3ccccc3)cc(=O)[n-]2)c1 ZINC000005154837 181210924 /nfs/dbraw/zinc/21/09/24/181210924.db2.gz ZRDHXTNITJHCOF-UHFFFAOYSA-N -1 1 322.433 4.346 20 0 DIADMM O=C(Nc1ncc(C2CCCCC2)s1)c1ccccc1[O-] ZINC000064564415 184299930 /nfs/dbraw/zinc/29/99/30/184299930.db2.gz ASTGEKDDALXRED-UHFFFAOYSA-N -1 1 302.399 4.149 20 0 DIADMM CCc1nc(S[C@H](C)c2ccc(F)c(F)c2)[n-]c(=O)c1C ZINC000570816030 332822412 /nfs/dbraw/zinc/82/24/12/332822412.db2.gz GYAPRMPXIRJKMF-SECBINFHSA-N -1 1 310.369 4.185 20 0 DIADMM CC[C@H](C)c1ccc(S(=O)(=O)[N-]c2ccc(C)nc2C)cc1 ZINC000530800591 331626856 /nfs/dbraw/zinc/62/68/56/331626856.db2.gz ROSTUUOPXNJBJI-LBPRGKRZSA-N -1 1 318.442 4.013 20 0 DIADMM C[C@H](Sc1nc(C(F)F)cc(=O)[n-]1)c1ccc(F)c(F)c1 ZINC000558463929 331909460 /nfs/dbraw/zinc/90/94/60/331909460.db2.gz LVQDYMUYARGADA-LURJTMIESA-N -1 1 318.295 4.251 20 0 DIADMM O=C(Nc1ccc([O-])c(Cl)c1)[C@@H]1CCCc2sccc21 ZINC000130050271 332022061 /nfs/dbraw/zinc/02/20/61/332022061.db2.gz FPXVICNXITYSSS-LLVKDONJSA-N -1 1 307.802 4.166 20 0 DIADMM Cc1ccc(F)c(CN[C@H](C(=O)[O-])c2ccc(Cl)c(C)c2)c1 ZINC000426782720 332152782 /nfs/dbraw/zinc/15/27/82/332152782.db2.gz HOMNDEBUQUVMQE-INIZCTEOSA-N -1 1 321.779 4.011 20 0 DIADMM CCC[C@H](C)C[C@H](NCc1ccc(-c2ccccc2)o1)C(=O)[O-] ZINC000426794870 332154520 /nfs/dbraw/zinc/15/45/20/332154520.db2.gz VYBOBGOSXFBOJQ-YOEHRIQHSA-N -1 1 315.413 4.316 20 0 DIADMM Cc1cc([C@@H](NCc2ccccc2Cl)C(=O)[O-])ccc1Cl ZINC000426800291 332155122 /nfs/dbraw/zinc/15/51/22/332155122.db2.gz NWOLGWYEGPBWNZ-OAHLLOKOSA-N -1 1 324.207 4.217 20 0 DIADMM Cc1cc([C@H](NCc2ccccc2Cl)C(=O)[O-])ccc1Cl ZINC000426800290 332155192 /nfs/dbraw/zinc/15/51/92/332155192.db2.gz NWOLGWYEGPBWNZ-HNNXBMFYSA-N -1 1 324.207 4.217 20 0 DIADMM O=C([O-])C[C@@H](NCc1ccccc1Cl)c1cccc(Cl)c1 ZINC000426819876 332157643 /nfs/dbraw/zinc/15/76/43/332157643.db2.gz WTVSGUUPBNHXNK-OAHLLOKOSA-N -1 1 324.207 4.299 20 0 DIADMM CC[C@@H](C)Oc1ccc(NC(=O)c2c(F)ccc([O-])c2F)cc1 ZINC000569649378 332653803 /nfs/dbraw/zinc/65/38/03/332653803.db2.gz LNSGTAJFLUOXRO-SNVBAGLBSA-N -1 1 321.323 4.100 20 0 DIADMM O=C(Nc1ccccc1Cc1ccccc1)c1ccc([O-])cc1F ZINC000181851742 333035144 /nfs/dbraw/zinc/03/51/44/333035144.db2.gz SWKDLTKXJCIBEQ-UHFFFAOYSA-N -1 1 321.351 4.374 20 0 DIADMM Cc1ccc(F)cc1[N-]S(=O)(=O)c1ccccc1C(C)(C)C ZINC000460431086 333085428 /nfs/dbraw/zinc/08/54/28/333085428.db2.gz YAKLMJPYYXJCLJ-UHFFFAOYSA-N -1 1 321.417 4.232 20 0 DIADMM O=c1cc(C(F)F)nc(SC[C@@H]2C[C@H]2c2ccccc2)[n-]1 ZINC000460861874 333173523 /nfs/dbraw/zinc/17/35/23/333173523.db2.gz OHLUYXAXMZKBMQ-QWRGUYRKSA-N -1 1 308.353 4.016 20 0 DIADMM CC(C)Oc1c(Cl)cccc1NC(=O)c1ccc([O-])cc1F ZINC000181985158 333174180 /nfs/dbraw/zinc/17/41/80/333174180.db2.gz UVALZAYDTLFVOI-UHFFFAOYSA-N -1 1 323.751 4.224 20 0 DIADMM Cc1cccc(CN(C)C(=O)c2cc3ccccc3cc2[O-])c1 ZINC000390691446 333315366 /nfs/dbraw/zinc/31/53/66/333315366.db2.gz PVOIYXADBPPHAD-UHFFFAOYSA-N -1 1 305.377 4.126 20 0 DIADMM Cc1cnc(SCc2ccc(OC(C)C)c(Cl)c2)[n-]c1=O ZINC000563438473 333605855 /nfs/dbraw/zinc/60/58/55/333605855.db2.gz GMPZTKCNBAYCLC-UHFFFAOYSA-N -1 1 324.833 4.224 20 0 DIADMM Cc1ccccc1[C@@H](C)N(C)C(=O)c1ccc(Cl)cc1[O-] ZINC000436758614 333997812 /nfs/dbraw/zinc/99/78/12/333997812.db2.gz ZWEKVEFUVRZZFR-GFCCVEGCSA-N -1 1 303.789 4.187 20 0 DIADMM Cc1nc(NC(=O)c2ccc([O-])cc2F)ccc1-c1ccccc1 ZINC000436928564 334017617 /nfs/dbraw/zinc/01/76/17/334017617.db2.gz RNMKTKLCGMWGJC-UHFFFAOYSA-N -1 1 322.339 4.154 20 0 DIADMM Cc1oc([C@H](C)N(C)Cc2cccc(Cl)c2)cc1C(=O)[O-] ZINC000571650001 334030370 /nfs/dbraw/zinc/03/03/70/334030370.db2.gz ZVWWTUPPSXNXTG-JTQLQIEISA-N -1 1 307.777 4.133 20 0 DIADMM C[C@@H](Cc1ccc(Cl)cc1)C(=O)Nc1ccc(F)cc1[O-] ZINC000534493650 334277576 /nfs/dbraw/zinc/27/75/76/334277576.db2.gz HTIZGYZIQBXWSS-JTQLQIEISA-N -1 1 307.752 4.002 20 0 DIADMM Cc1ccc(S(=O)(=O)[N-]c2ccc(Cl)cc2)cc1Cl ZINC000048652555 334291000 /nfs/dbraw/zinc/29/10/00/334291000.db2.gz SSVMYMCNJJPFSB-UHFFFAOYSA-N -1 1 316.209 4.103 20 0 DIADMM CC(C)(C)c1ncc(C(=O)Nc2ccc([O-])c(Cl)c2)s1 ZINC000111667909 334352940 /nfs/dbraw/zinc/35/29/40/334352940.db2.gz SASFVAQDZIXJIA-UHFFFAOYSA-N -1 1 310.806 4.052 20 0 DIADMM O=C(CCc1ccc(Cl)s1)Nc1ccc([O-])c(Cl)c1 ZINC000111668754 334352980 /nfs/dbraw/zinc/35/29/80/334352980.db2.gz SAUPQZHLAFMGOM-UHFFFAOYSA-N -1 1 316.209 4.332 20 0 DIADMM CCc1ccc(NC(=O)c2cc(Cl)c([O-])c(OC)c2)cc1C ZINC000443121335 338445159 /nfs/dbraw/zinc/44/51/59/338445159.db2.gz CMGGTHWQXFJKIL-UHFFFAOYSA-N -1 1 319.788 4.177 20 0 DIADMM O=C(Nc1ccc(F)cc1[O-])[C@@H]1C[C@H]1c1c(F)cccc1Cl ZINC000532012883 334373929 /nfs/dbraw/zinc/37/39/29/334373929.db2.gz MPZQNLAETATVPN-NXEZZACHSA-N -1 1 323.726 4.066 20 0 DIADMM COc1cc(-c2nc([C@H]3CCC[C@@H](C)C3)no2)cc(Cl)c1[O-] ZINC000443224748 338448158 /nfs/dbraw/zinc/44/81/58/338448158.db2.gz PDPYQMKBKBKVQX-ZJUUUORDSA-N -1 1 322.792 4.398 20 0 DIADMM COc1cc(-c2nc([C@H]3CCCC[C@H]3C)no2)cc(Cl)c1[O-] ZINC000443201993 338447071 /nfs/dbraw/zinc/44/70/71/338447071.db2.gz WGMSENXNXIGOLF-KOLCDFICSA-N -1 1 322.792 4.398 20 0 DIADMM Cc1cnc(-c2nc(=O)c3c(CC(C)C)csc3[n-]2)s1 ZINC000416413905 334666966 /nfs/dbraw/zinc/66/69/66/334666966.db2.gz QJJCKYQAQKOTFH-UHFFFAOYSA-N -1 1 305.428 4.027 20 0 DIADMM CC[C@H](C)Cc1c(C)sc2nc(-c3coc(C)n3)[n-]c(=O)c12 ZINC000345210151 335307977 /nfs/dbraw/zinc/30/79/77/335307977.db2.gz QKXMFVJYCPDWFG-QMMMGPOBSA-N -1 1 317.414 4.257 20 0 DIADMM Cc1ccsc1[C@H]1C[C@H]1c1nc(-c2ccc([O-])cc2F)no1 ZINC000445464872 338495458 /nfs/dbraw/zinc/49/54/58/338495458.db2.gz VXADHQUPMJPZRO-NWDGAFQWSA-N -1 1 316.357 4.222 20 0 DIADMM [O-]c1ccc(-c2noc(/C=C\c3ccc4[nH]ccc4c3)n2)cc1F ZINC000445470543 338495814 /nfs/dbraw/zinc/49/58/14/338495814.db2.gz FEKDMGNFAIFWBU-KXFIGUGUSA-N -1 1 321.311 4.233 20 0 DIADMM CCSc1ccc(-c2nc(-c3ccc([O-])c(F)c3)no2)cc1 ZINC000445482556 338496443 /nfs/dbraw/zinc/49/64/43/338496443.db2.gz SKTAMFBUECSSNL-UHFFFAOYSA-N -1 1 316.357 4.360 20 0 DIADMM Cc1ccc(CCCc2nc(-c3ccc([O-])c(F)c3)no2)s1 ZINC000445483378 338496460 /nfs/dbraw/zinc/49/64/60/338496460.db2.gz VNUSFPHUWQRBKC-UHFFFAOYSA-N -1 1 318.373 4.127 20 0 DIADMM CC(C)c1cccc(O[C@H](C)C(=O)Nc2ccc(F)cc2[O-])c1 ZINC000532266770 335927499 /nfs/dbraw/zinc/92/74/99/335927499.db2.gz ZZQOARBLMAHDSS-GFCCVEGCSA-N -1 1 317.360 4.061 20 0 DIADMM C[C@@H]1CN(Cc2cccc([O-])c2Cl)C[C@H](c2ccsc2)O1 ZINC000351686358 336058213 /nfs/dbraw/zinc/05/82/13/336058213.db2.gz QSNSDIHPZXDNFL-IAQYHMDHSA-N -1 1 323.845 4.069 20 0 DIADMM COc1ccc(-c2nc(-c3ccc4ccccc4c3)no2)c([O-])c1 ZINC000324799492 336258646 /nfs/dbraw/zinc/25/86/46/336258646.db2.gz MPWRSJNNOILPBH-UHFFFAOYSA-N -1 1 318.332 4.271 20 0 DIADMM COc1ccc(-c2nc(-c3cccc4ccccc43)no2)c([O-])c1 ZINC000324825216 336260834 /nfs/dbraw/zinc/26/08/34/336260834.db2.gz TXUKAVXQTHYLSV-UHFFFAOYSA-N -1 1 318.332 4.271 20 0 DIADMM [O-]c1c(-c2nc(CCc3ccccc3)no2)ccc2ccccc21 ZINC000324914466 336274386 /nfs/dbraw/zinc/27/43/86/336274386.db2.gz KCFVXKJNDOBJMZ-UHFFFAOYSA-N -1 1 316.360 4.381 20 0 DIADMM C[C@H](C1CC1)n1cc([N-]c2nc(-c3ccccc3)ns2)cn1 ZINC000302487762 336359751 /nfs/dbraw/zinc/35/97/51/336359751.db2.gz YUOLUVKKPQRLSS-LLVKDONJSA-N -1 1 311.414 4.116 20 0 DIADMM O=C(c1ccc2ccccc2c1[O-])N1CCC2(CCCC2)CC1 ZINC000389946222 336927736 /nfs/dbraw/zinc/92/77/36/336927736.db2.gz MODYSKSMGBQBDY-UHFFFAOYSA-N -1 1 309.409 4.342 20 0 DIADMM CC(C)c1ccc(S(=O)(=O)[N-]c2ccc3cc[nH]c3c2)cc1 ZINC000193483756 337008393 /nfs/dbraw/zinc/00/83/93/337008393.db2.gz XJTIXOVWTNYPTP-UHFFFAOYSA-N -1 1 314.410 4.092 20 0 DIADMM [O-]c1ccc(-c2noc(-c3cc4cc(F)ccc4o3)n2)cc1F ZINC000583003727 337227629 /nfs/dbraw/zinc/22/76/29/337227629.db2.gz RXMMSWGFRLTITD-UHFFFAOYSA-N -1 1 314.247 4.134 20 0 DIADMM CCc1nc2c(s1)[C@H]([N@@H+](C)Cc1cc(O)cc(F)c1)CCC2 ZINC000186250791 337254984 /nfs/dbraw/zinc/25/49/84/337254984.db2.gz IGVUTDMDRDEFPC-OAHLLOKOSA-N -1 1 320.433 4.060 20 0 DIADMM O=C(Nc1ccc([O-])c(Cl)c1)Nc1cccc2cccnc21 ZINC000192175556 337303632 /nfs/dbraw/zinc/30/36/32/337303632.db2.gz SOXWHMCFGRXOAV-UHFFFAOYSA-N -1 1 313.744 4.238 20 0 DIADMM CCc1cccnc1-c1noc(-c2ccc3ccccc3c2[O-])n1 ZINC000325520373 337733158 /nfs/dbraw/zinc/73/31/58/337733158.db2.gz DCFAENOFQGJLEI-UHFFFAOYSA-N -1 1 317.348 4.220 20 0 DIADMM CC1(c2nc(-c3ccc([O-])c(F)c3)no2)CCC(F)(F)CC1 ZINC000528169206 337791757 /nfs/dbraw/zinc/79/17/57/337791757.db2.gz JGKSAECEEUCYSJ-UHFFFAOYSA-N -1 1 312.291 4.048 20 0 DIADMM C[C@@H](c1ccsc1)c1nc(-c2ccc([O-])cc2Cl)no1 ZINC000445443162 337835731 /nfs/dbraw/zinc/83/57/31/337835731.db2.gz BGRHSWHHCLTFER-QMMMGPOBSA-N -1 1 306.774 4.309 20 0 DIADMM CC(=O)c1ccc(-c2nc(-c3ccc([O-])cc3Cl)no2)s1 ZINC000445443695 337837676 /nfs/dbraw/zinc/83/76/76/337837676.db2.gz HLJGXUYDUJQQEX-UHFFFAOYSA-N -1 1 320.757 4.027 20 0 DIADMM CCOc1ccccc1-c1nc(-c2ccc([O-])cc2Cl)no1 ZINC000445447550 337846694 /nfs/dbraw/zinc/84/66/94/337846694.db2.gz SRUJQEGSDYVGOG-UHFFFAOYSA-N -1 1 316.744 4.161 20 0 DIADMM C[C@@H]1CCN(C(=O)c2ccc(Cl)cc2[O-])[C@@H]2CCCC[C@@H]12 ZINC000537645173 337952577 /nfs/dbraw/zinc/95/25/77/337952577.db2.gz GWNIVNHZSRDZCO-OSAQELSMSA-N -1 1 307.821 4.086 20 0 DIADMM C[C@H](c1cccs1)c1nc(-c2ccc([O-])cc2Cl)no1 ZINC000445450254 337956348 /nfs/dbraw/zinc/95/63/48/337956348.db2.gz XKJFDTRGNBTEKX-MRVPVSSYSA-N -1 1 306.774 4.309 20 0 DIADMM CC(C)(Cc1nc(-c2ccc([O-])cc2F)no1)c1ccccc1 ZINC000445452141 338016627 /nfs/dbraw/zinc/01/66/27/338016627.db2.gz AHIVYIVJOAZKAZ-UHFFFAOYSA-N -1 1 312.344 4.102 20 0 DIADMM CC[C@@H](C)c1cc(-c2nc(-c3ccc([O-])cc3Cl)no2)on1 ZINC000445453021 338016874 /nfs/dbraw/zinc/01/68/74/338016874.db2.gz UYXGHUMCRNGDDN-MRVPVSSYSA-N -1 1 319.748 4.264 20 0 DIADMM C[C@H](Sc1ccccc1)c1nc(-c2ccc([O-])cc2F)no1 ZINC000445454531 338017181 /nfs/dbraw/zinc/01/71/81/338017181.db2.gz GNEPJVSGVUKMNF-JTQLQIEISA-N -1 1 316.357 4.435 20 0 DIADMM [O-]c1ccc(-c2noc([C@H]3CCCc4sccc43)n2)c(F)c1 ZINC000445456405 338017441 /nfs/dbraw/zinc/01/74/41/338017441.db2.gz ODJYQIYQDPEZBP-NSHDSACASA-N -1 1 316.357 4.111 20 0 DIADMM [O-]c1ccc(-c2noc([C@@H]3CCCc4sccc43)n2)c(F)c1 ZINC000445456401 338017447 /nfs/dbraw/zinc/01/74/47/338017447.db2.gz ODJYQIYQDPEZBP-LLVKDONJSA-N -1 1 316.357 4.111 20 0 DIADMM Cc1ccc(/C=C\Cc2nc(-c3ccc([O-])cc3F)no2)cc1 ZINC000445459321 338018410 /nfs/dbraw/zinc/01/84/10/338018410.db2.gz ZPIUESLVOPJWGA-IHWYPQMZSA-N -1 1 310.328 4.146 20 0 DIADMM Cc1ccc(C(F)(F)c2nc(-c3ccc([O-])cc3F)no2)cc1 ZINC000445460017 338018691 /nfs/dbraw/zinc/01/86/91/338018691.db2.gz LQNSLPPOONUTLC-UHFFFAOYSA-N -1 1 320.270 4.030 20 0 DIADMM [O-]c1ccc(-c2noc(-c3ccc(F)c(Cl)c3)n2)c(F)c1 ZINC000445460780 338020715 /nfs/dbraw/zinc/02/07/15/338020715.db2.gz SSARKQWUYQMPEW-UHFFFAOYSA-N -1 1 308.671 4.041 20 0 DIADMM C[C@@H](Cc1nc(-c2ccc([O-])cc2F)no1)c1ccccc1F ZINC000445460665 338020815 /nfs/dbraw/zinc/02/08/15/338020815.db2.gz SOEAQOXAHCPJDR-JTQLQIEISA-N -1 1 316.307 4.067 20 0 DIADMM C/C(=C\c1nc(-c2ccc([O-])cc2F)no1)c1ccc(F)cc1 ZINC000445462176 338024447 /nfs/dbraw/zinc/02/44/47/338024447.db2.gz CYYDVHUBGDHQAP-CSKARUKUSA-N -1 1 314.291 4.281 20 0 DIADMM Cc1cccc([C@H](NCc2cccc(Cl)c2F)C(=O)[O-])c1C ZINC000426730219 338039570 /nfs/dbraw/zinc/03/95/70/338039570.db2.gz KGXHIODNAGQXQH-INIZCTEOSA-N -1 1 321.779 4.011 20 0 DIADMM C[C@@H](C(=O)[O-])[C@H](NCc1cc(Cl)ccc1F)c1ccccc1 ZINC000426749626 338040633 /nfs/dbraw/zinc/04/06/33/338040633.db2.gz HHFYJCHUSOORPZ-BZNIZROVSA-N -1 1 321.779 4.031 20 0 DIADMM Cc1cc(C)cc([C@@H](NCc2ccc(F)cc2Cl)C(=O)[O-])c1 ZINC000426754056 338040766 /nfs/dbraw/zinc/04/07/66/338040766.db2.gz NFITZFRADRVASO-MRXNPFEDSA-N -1 1 321.779 4.011 20 0 DIADMM C[C@H](C(=O)[O-])[C@@H](NCc1ccc(F)cc1Cl)c1ccccc1 ZINC000426758009 338041101 /nfs/dbraw/zinc/04/11/01/338041101.db2.gz GJNALKCUEVPOAD-MEDUHNTESA-N -1 1 321.779 4.031 20 0 DIADMM CCN(C(=O)c1ccc(Cl)cc1[O-])[C@H](C)c1ccc(F)cc1 ZINC000436490901 338273967 /nfs/dbraw/zinc/27/39/67/338273967.db2.gz PRHJVXJGBSXMPA-LLVKDONJSA-N -1 1 321.779 4.408 20 0 DIADMM [O-]c1ccc(-c2noc(-c3cc(F)ccc3Cl)n2)cc1F ZINC000436520457 338274765 /nfs/dbraw/zinc/27/47/65/338274765.db2.gz GGUQCFXWAWEWDX-UHFFFAOYSA-N -1 1 308.671 4.041 20 0 DIADMM O=C(c1ccc(Cl)cc1[O-])N1CCC[C@H]1c1ccsc1 ZINC000436525583 338275117 /nfs/dbraw/zinc/27/51/17/338275117.db2.gz GTNWOZIZCYLKQS-ZDUSSCGKSA-N -1 1 307.802 4.084 20 0 DIADMM Cc1ccc(C[C@H](C)N(C)C(=O)c2ccc(Cl)cc2[O-])cc1 ZINC000436526956 338275224 /nfs/dbraw/zinc/27/52/24/338275224.db2.gz FZMYEOOCTJWNEC-ZDUSSCGKSA-N -1 1 317.816 4.057 20 0 DIADMM CC(C)N(Cc1ccco1)C(=O)c1ccc2ccccc2c1[O-] ZINC000436529158 338275335 /nfs/dbraw/zinc/27/53/35/338275335.db2.gz ALZGOVVAKJBXIV-UHFFFAOYSA-N -1 1 309.365 4.189 20 0 DIADMM O=C(c1ccccc1[O-])N1CC2(CCCC2)c2c1cccc2F ZINC000436541892 338276159 /nfs/dbraw/zinc/27/61/59/338276159.db2.gz AFKBIUDFBFCGHI-UHFFFAOYSA-N -1 1 311.356 4.004 20 0 DIADMM CC(C)[C@@H](c1ccccc1)N(C)C(=O)c1cc(F)ccc1[O-] ZINC000436545520 338276267 /nfs/dbraw/zinc/27/62/67/338276267.db2.gz HILZQSXMSLGAIH-KRWDZBQOSA-N -1 1 301.361 4.001 20 0 DIADMM O=C(c1cc(F)ccc1[O-])N1CCC[C@H]1c1ccccc1Cl ZINC000436565217 338277186 /nfs/dbraw/zinc/27/71/86/338277186.db2.gz UDUHZRLJRYSATH-HNNXBMFYSA-N -1 1 319.763 4.162 20 0 DIADMM Cc1ccc([C@@H]2C[C@H](C)CCN2C(=O)c2cc(F)ccc2[O-])o1 ZINC000436576385 338278060 /nfs/dbraw/zinc/27/80/60/338278060.db2.gz QZQHIOQQRCVDGP-ABAIWWIYSA-N -1 1 317.360 4.046 20 0 DIADMM O=C(c1ccc2ccccc2c1[O-])N1CC[C@@H]1Cc1ccccc1 ZINC000436581115 338278155 /nfs/dbraw/zinc/27/81/55/338278155.db2.gz YRLNGQXCAGOUCF-QGZVFWFLSA-N -1 1 317.388 4.003 20 0 DIADMM Cc1cc(N2CCCC[C@@H]2C)ccc1NC(=O)c1ccccc1[O-] ZINC000436584205 338278389 /nfs/dbraw/zinc/27/83/89/338278389.db2.gz GTACOKGVGPMJFW-HNNXBMFYSA-N -1 1 324.424 4.332 20 0 DIADMM CC[C@H](Cc1ccccc1)N(CC)C(=O)c1cc(F)ccc1[O-] ZINC000436583424 338278463 /nfs/dbraw/zinc/27/84/63/338278463.db2.gz KFWQLFUWCHDGAM-MRXNPFEDSA-N -1 1 315.388 4.015 20 0 DIADMM O=C(c1ccc(Cl)cc1[O-])N1CC[C@@H]1c1ccc(Cl)cc1 ZINC000436589431 338278725 /nfs/dbraw/zinc/27/87/25/338278725.db2.gz KPLPCHARJWIYRI-CQSZACIVSA-N -1 1 322.191 4.286 20 0 DIADMM CCOC(=O)c1sc(/C=C\c2ccc([O-])c(Cl)c2)nc1C ZINC000436614359 338280143 /nfs/dbraw/zinc/28/01/43/338280143.db2.gz WTECWFFVIYMBHQ-ALCCZGGFSA-N -1 1 323.801 4.158 20 0 DIADMM CN(CCCc1ccccc1)C(=O)c1ccc2ccccc2c1[O-] ZINC000436730724 338284395 /nfs/dbraw/zinc/28/43/95/338284395.db2.gz MKSLSXZDFRLFDW-UHFFFAOYSA-N -1 1 319.404 4.250 20 0 DIADMM Cc1cc(F)ccc1CN(C)C(=O)c1cc2ccccc2cc1[O-] ZINC000436728395 338284478 /nfs/dbraw/zinc/28/44/78/338284478.db2.gz LBPYAFFJRAFLEB-UHFFFAOYSA-N -1 1 323.367 4.265 20 0 DIADMM C[C@H](CN(C)C(=O)c1ccc2ccccc2c1[O-])c1ccccc1 ZINC000436743141 338284998 /nfs/dbraw/zinc/28/49/98/338284998.db2.gz WYCXVTMMHHUZEA-OAHLLOKOSA-N -1 1 319.404 4.421 20 0 DIADMM CC[C@H]1CCCCCN1C(=O)c1ccc(C(F)(F)F)cc1[O-] ZINC000436750210 338285301 /nfs/dbraw/zinc/28/53/01/338285301.db2.gz FAYRGDBQBUNFDG-LBPRGKRZSA-N -1 1 315.335 4.206 20 0 DIADMM CC(C)c1ccc(C(=O)Nc2nc(C3CC3)cs2)c([O-])c1 ZINC000436762341 338286186 /nfs/dbraw/zinc/28/61/86/338286186.db2.gz QWQSZYLEAXNMSO-UHFFFAOYSA-N -1 1 302.399 4.102 20 0 DIADMM CC(C)[C@H]1N(C(=O)c2ccc3ccccc3c2[O-])CC12CCC2 ZINC000436824544 338288884 /nfs/dbraw/zinc/28/88/84/338288884.db2.gz BUSYBOLPZNJRRN-GOSISDBHSA-N -1 1 309.409 4.196 20 0 DIADMM CC(C)c1ccc2c(c1)[C@@H](NC(=O)c1ccc([O-])cc1F)CC2 ZINC000436837576 338289334 /nfs/dbraw/zinc/28/93/34/338289334.db2.gz PICFEEOAVWVNKW-SFHVURJKSA-N -1 1 313.372 4.072 20 0 DIADMM CC1(C)CN(C(=O)c2cc(Cl)ccc2[O-])[C@H]1c1cccs1 ZINC000436849396 338289768 /nfs/dbraw/zinc/28/97/68/338289768.db2.gz ZJPTVQLWSJSOJY-AWEZNQCLSA-N -1 1 321.829 4.330 20 0 DIADMM CC[C@H]1CCCC[C@@H]1OCc1nc(-c2ccc([O-])c(F)c2)no1 ZINC000436870857 338290795 /nfs/dbraw/zinc/29/07/95/338290795.db2.gz GKNFQUPXLBQMHO-NHYWBVRUSA-N -1 1 320.364 4.067 20 0 DIADMM [O-]c1ccc(-c2noc(-c3coc4cc(F)ccc34)n2)cc1F ZINC000436871692 338290877 /nfs/dbraw/zinc/29/08/77/338290877.db2.gz HSADAGWVFKIPQR-UHFFFAOYSA-N -1 1 314.247 4.134 20 0 DIADMM C[C@H]1[C@H](c2nc(-c3ccc([O-])c(F)c3)no2)[C@H]1c1ccccc1 ZINC000436875233 338291069 /nfs/dbraw/zinc/29/10/69/338291069.db2.gz UBGRKOZHWIGLBP-GTTSAUCSSA-N -1 1 310.328 4.098 20 0 DIADMM CCOc1cc(-c2noc(-c3coc(C)c3)n2)cc(Cl)c1[O-] ZINC000436875849 338291122 /nfs/dbraw/zinc/29/11/22/338291122.db2.gz FSSHAQGIOKEYPT-UHFFFAOYSA-N -1 1 320.732 4.063 20 0 DIADMM CCc1ccc(C(=O)N(C)c2ccc(OC(C)C)cc2)c([O-])c1 ZINC000436877981 338291212 /nfs/dbraw/zinc/29/12/12/338291212.db2.gz AKWVSLZSCYNQJI-UHFFFAOYSA-N -1 1 313.397 4.018 20 0 DIADMM Cc1cccc([C@H]2CCCN2C(=O)c2ccc([O-])cc2F)c1C ZINC000436877573 338291237 /nfs/dbraw/zinc/29/12/37/338291237.db2.gz ASWITKYAASVPPZ-GOSISDBHSA-N -1 1 313.372 4.125 20 0 DIADMM [O-]c1ccc(-c2noc(-c3sccc3C3CC3)n2)c(F)c1 ZINC000436877250 338291305 /nfs/dbraw/zinc/29/13/05/338291305.db2.gz FKXYRWQBFBXOBX-UHFFFAOYSA-N -1 1 302.330 4.187 20 0 DIADMM CC(C)(C)[C@H](NC(=O)c1ccc([O-])cc1F)c1ccccc1 ZINC000436881055 338291569 /nfs/dbraw/zinc/29/15/69/338291569.db2.gz QRAIDINGKFGDHJ-MRXNPFEDSA-N -1 1 301.361 4.049 20 0 DIADMM Cc1c(Cl)cccc1-c1nc(-c2ccc([O-])cc2F)no1 ZINC000436881096 338291651 /nfs/dbraw/zinc/29/16/51/338291651.db2.gz VMKIYJBEHCXVPD-UHFFFAOYSA-N -1 1 304.708 4.210 20 0 DIADMM COc1cccc([C@@H](C)NC(=O)c2ccc3ccccc3c2[O-])c1 ZINC000436905503 338292899 /nfs/dbraw/zinc/29/28/99/338292899.db2.gz AHBCRYOZFRRQTO-CYBMUJFWSA-N -1 1 321.376 4.045 20 0 DIADMM Cc1csc(-c2noc(-c3ccc4ccccc4c3[O-])n2)n1 ZINC000436926872 338293759 /nfs/dbraw/zinc/29/37/59/338293759.db2.gz LUBRGGHESOXJIS-UHFFFAOYSA-N -1 1 309.350 4.027 20 0 DIADMM CC(F)(F)c1ccc(-c2noc(-c3cc(F)ccc3[O-])n2)cc1 ZINC000436957542 338295813 /nfs/dbraw/zinc/29/58/13/338295813.db2.gz WJGOJPGXJDESJM-UHFFFAOYSA-N -1 1 320.270 4.360 20 0 DIADMM CC[C@@H](CC(F)(F)F)NC(=O)c1cc2ccccc2cc1[O-] ZINC000436976970 338296479 /nfs/dbraw/zinc/29/64/79/338296479.db2.gz CIIIJKPHQUYAAG-LBPRGKRZSA-N -1 1 311.303 4.006 20 0 DIADMM O=C([N-]c1ccsc1Cl)c1c(F)c(F)cc(F)c1F ZINC000438553494 338347909 /nfs/dbraw/zinc/34/79/09/338347909.db2.gz OWBLKEHETCGHSD-UHFFFAOYSA-N -1 1 309.671 4.210 20 0 DIADMM Cc1c(F)cccc1S(=O)(=O)[N-]c1ccccc1C(C)C ZINC000438801199 338352316 /nfs/dbraw/zinc/35/23/16/338352316.db2.gz KKRDVBUQGOODEL-UHFFFAOYSA-N -1 1 307.390 4.058 20 0 DIADMM O=C([O-])c1ccc2nc(/C=C/c3ccc(O)c(Cl)c3)oc2c1 ZINC000439267614 338365549 /nfs/dbraw/zinc/36/55/49/338365549.db2.gz CZIXOWXFXMJDKP-QHHAFSJGSA-N -1 1 315.712 4.055 20 0 DIADMM C[C@@]1(C(=O)Nc2ccc([O-])c(Cl)c2)CCCc2ccccc21 ZINC000440940718 338400099 /nfs/dbraw/zinc/40/00/99/338400099.db2.gz AEHRJTINPZPKCE-GOSISDBHSA-N -1 1 315.800 4.278 20 0 DIADMM CCCc1cc(=O)[nH]c(C(=Cc2cccc([O-])c2Cl)CC)n1 ZINC000453025903 338786680 /nfs/dbraw/zinc/78/66/80/338786680.db2.gz MKKDEHKWSCQLQD-PKNBQFBNSA-N -1 1 318.804 4.444 20 0 DIADMM CC(C)(C)c1ccc(C(=O)Nc2ccc([O-])c(F)c2F)s1 ZINC000456778709 338940171 /nfs/dbraw/zinc/94/01/71/338940171.db2.gz HOSSFPBQRUAMHO-UHFFFAOYSA-N -1 1 311.353 4.282 20 0 DIADMM Cc1ccc(CCCCC(=O)Nc2ccc([O-])c(F)c2F)cc1 ZINC000456780425 338940367 /nfs/dbraw/zinc/94/03/67/338940367.db2.gz CHTMISDADMYMDM-UHFFFAOYSA-N -1 1 319.351 4.330 20 0 DIADMM CCC(CC)(C(=O)Nc1ccc([O-])c(F)c1F)c1ccccc1 ZINC000456789675 338940813 /nfs/dbraw/zinc/94/08/13/338940813.db2.gz VDFUEYIBPZJLAJ-UHFFFAOYSA-N -1 1 319.351 4.367 20 0 DIADMM CC[C@@H](C)[C@H](C(=O)Nc1ccc([O-])c(F)c1F)c1ccccc1 ZINC000456797280 338941199 /nfs/dbraw/zinc/94/11/99/338941199.db2.gz ZVFFSFKWYWNUGF-ABAIWWIYSA-N -1 1 319.351 4.439 20 0 DIADMM Cc1c(F)cccc1[N-]S(=O)(=O)c1ccc(CC(C)C)cc1 ZINC000467082371 339225928 /nfs/dbraw/zinc/22/59/28/339225928.db2.gz SLCBFEPTRPGJPL-UHFFFAOYSA-N -1 1 321.417 4.133 20 0 DIADMM Cc1cccc(CSc2nc(-c3ccccc3)c(C)c(=O)[n-]2)n1 ZINC000467205981 339228168 /nfs/dbraw/zinc/22/81/68/339228168.db2.gz IMHQFUIZXKHCJZ-UHFFFAOYSA-N -1 1 323.421 4.153 20 0 DIADMM Cc1ccc2oc(-c3nc4cc(Cl)ccc4c(=O)[n-]3)cc2c1 ZINC000478204561 339510220 /nfs/dbraw/zinc/51/02/20/339510220.db2.gz GBPSHFKTMBXFJB-UHFFFAOYSA-N -1 1 310.740 4.298 20 0 DIADMM CCC(C)(C)c1ccc(CS(=O)(=O)c2ccc([O-])cc2)cc1 ZINC000506926068 340203804 /nfs/dbraw/zinc/20/38/04/340203804.db2.gz CLZBTDFIDCQQMB-UHFFFAOYSA-N -1 1 318.438 4.054 20 0 DIADMM C[C@@H]1CN(Cc2cccc([O-])c2Cl)C[C@@H](c2ccccc2)O1 ZINC000507783898 340231381 /nfs/dbraw/zinc/23/13/81/340231381.db2.gz HHTTZIOMMUZNHW-DYVFJYSZSA-N -1 1 317.816 4.008 20 0 DIADMM CCCCc1ccc(NC(=O)c2c(F)ccc([O-])c2F)cc1 ZINC000507950143 340236433 /nfs/dbraw/zinc/23/64/33/340236433.db2.gz JYCGEFVCFVXMMJ-UHFFFAOYSA-N -1 1 305.324 4.265 20 0 DIADMM C[C@@H]1CN(Cc2cccc([O-])c2Cl)[C@H](c2ccccc2)CO1 ZINC000508750294 340252320 /nfs/dbraw/zinc/25/23/20/340252320.db2.gz YVGIPOIZYJFAAN-CJNGLKHVSA-N -1 1 317.816 4.008 20 0 DIADMM Cc1cc2c([n-]c([C@@H](F)c3ccc(Cl)cc3)nc2=O)s1 ZINC000509074507 340260446 /nfs/dbraw/zinc/26/04/46/340260446.db2.gz LFAWENBIGKSUHE-NSHDSACASA-N -1 1 308.765 4.418 20 0 DIADMM CCCc1nc(C(=O)[N-]c2cc(Cl)ccc2SC)co1 ZINC000509597426 340274322 /nfs/dbraw/zinc/27/43/22/340274322.db2.gz AKSPEZGGBUBVSR-UHFFFAOYSA-N -1 1 310.806 4.255 20 0 DIADMM CCCc1cc(=O)[n-]c(SCc2csc(C(C)(C)C)n2)n1 ZINC000510135504 340290125 /nfs/dbraw/zinc/29/01/25/340290125.db2.gz OBDSXPUSWZMHNL-UHFFFAOYSA-N -1 1 323.487 4.181 20 0 DIADMM CN(Cc1cc(F)c(F)c(F)c1)Cc1cccc([O-])c1Cl ZINC000512005628 340345152 /nfs/dbraw/zinc/34/51/52/340345152.db2.gz HWMJGTZTMAFZTN-UHFFFAOYSA-N -1 1 315.722 4.095 20 0 DIADMM C[C@@H](CCOc1ccccc1)C(=O)Nc1ccc([O-])c(Cl)c1 ZINC000174737939 340395482 /nfs/dbraw/zinc/39/54/82/340395482.db2.gz ZDHNGCXJNWSZDP-LBPRGKRZSA-N -1 1 319.788 4.089 20 0 DIADMM CCc1nc(S[C@H](C)c2nc3ccccc3o2)[n-]c(=O)c1C ZINC000522015168 340562566 /nfs/dbraw/zinc/56/25/66/340562566.db2.gz SRPJIWBBDYZHLV-SNVBAGLBSA-N -1 1 315.398 4.048 20 0 DIADMM [O-]c1cccc(CNc2ccccc2Br)c1Cl ZINC000328483062 340785353 /nfs/dbraw/zinc/78/53/53/340785353.db2.gz QIOBUNKZFJNMTM-UHFFFAOYSA-N -1 1 312.594 4.420 20 0 DIADMM CC[C@@H](C(=O)Nc1ccc([O-])c(Cl)c1)c1ccc(F)cc1 ZINC000127775786 340856207 /nfs/dbraw/zinc/85/62/07/340856207.db2.gz YAXQWOOIJKRCRY-CYBMUJFWSA-N -1 1 307.752 4.317 20 0 DIADMM Cc1cc(C)cc(CCC(=O)Nc2ccc([O-])c(Cl)c2)c1 ZINC000542817266 341021965 /nfs/dbraw/zinc/02/19/65/341021965.db2.gz VYFKVUJFQHSKNN-UHFFFAOYSA-N -1 1 303.789 4.234 20 0 DIADMM O=C(Nc1ccc([O-])c(Cl)c1)c1cc(C2CCCCC2)[nH]n1 ZINC000542817503 341021983 /nfs/dbraw/zinc/02/19/83/341021983.db2.gz OAADABBGOONJPO-UHFFFAOYSA-N -1 1 319.792 4.069 20 0 DIADMM O=C(/C=C/SCc1ccco1)Nc1ccc([O-])c(Cl)c1 ZINC000132126927 341116864 /nfs/dbraw/zinc/11/68/64/341116864.db2.gz XDXUQNKJPUSFMV-FNORWQNLSA-N -1 1 309.774 4.024 20 0 DIADMM CCOc1cc(C(=O)Nc2cc(C)cc(F)c2)cc(Cl)c1[O-] ZINC000545845673 341143154 /nfs/dbraw/zinc/14/31/54/341143154.db2.gz FQEQYLJNAXRLMQ-UHFFFAOYSA-N -1 1 323.751 4.144 20 0 DIADMM C[C@H](c1ccccc1Cl)N(C)C(=O)c1cc(F)ccc1[O-] ZINC000132892353 341148615 /nfs/dbraw/zinc/14/86/15/341148615.db2.gz RFOQWNDJSADXGA-SNVBAGLBSA-N -1 1 307.752 4.018 20 0 DIADMM CC[C@H](C)C[C@H](C)Nc1ccc(-c2nc(C)c(C)c(=O)[n-]2)cn1 ZINC000566389027 341556304 /nfs/dbraw/zinc/55/63/04/341556304.db2.gz ZYVITHWIQCJKLS-RYUDHWBXSA-N -1 1 314.433 4.098 20 0 DIADMM CCc1nc(S[C@H](C)c2ccc(F)cc2F)[n-]c(=O)c1C ZINC000566498700 341560152 /nfs/dbraw/zinc/56/01/52/341560152.db2.gz LKCUYQKQCQCXBB-SECBINFHSA-N -1 1 310.369 4.185 20 0 DIADMM Cc1ccsc1CCCC(=O)Nc1ccc([O-])c(Cl)c1 ZINC000153640264 341576192 /nfs/dbraw/zinc/57/61/92/341576192.db2.gz WLCSZTLRPYZDPL-UHFFFAOYSA-N -1 1 309.818 4.377 20 0 DIADMM [O-]c1ccc(-c2noc(-c3cccc4[nH]ccc43)n2)c(Cl)c1 ZINC000569071781 341689878 /nfs/dbraw/zinc/68/98/78/341689878.db2.gz KRITYKJONLQNGS-UHFFFAOYSA-N -1 1 311.728 4.244 20 0 DIADMM Cc1ccc(CN[C@H]2C[C@@H](C(=O)[O-])c3ccccc32)c(Cl)c1 ZINC000573729517 341737457 /nfs/dbraw/zinc/73/74/57/341737457.db2.gz WHHRLHVNFNYQDU-WBVHZDCISA-N -1 1 315.800 4.051 20 0 DIADMM Cc1nn(-c2ccccc2)cc1NCc1cccc([O-])c1Cl ZINC000339345746 527564448 /nfs/dbraw/zinc/56/44/48/527564448.db2.gz RGLHCSTZKFINAQ-UHFFFAOYSA-N -1 1 313.788 4.152 20 0 DIADMM O=C(Nc1ccc([O-])c(Cl)c1)c1ccc(C(F)(F)F)cc1 ZINC000067739052 1035595588 /nfs/dbraw/zinc/59/55/88/1035595588.db2.gz YJZINFAWLPGQEO-UHFFFAOYSA-N -1 1 315.678 4.317 20 0 DIADMM CC[C@@H](C)c1ccc(S(=O)(=O)[N-]c2ncccc2Cl)cc1 ZINC000180193900 1036051299 /nfs/dbraw/zinc/05/12/99/1036051299.db2.gz RCQRNWMTCHXZDH-LLVKDONJSA-N -1 1 324.833 4.049 20 0 DIADMM Cc1cccc(Nc2ccc(F)c(Br)c2[O-])c1F ZINC001210037830 1036358589 /nfs/dbraw/zinc/35/85/89/1036358589.db2.gz QOPHGLSZXISARF-UHFFFAOYSA-N -1 1 314.129 4.485 20 0 DIADMM O=C(Nc1nc(C2CCCCC2)cs1)c1cc(F)ccc1[O-] ZINC001648804946 1036404580 /nfs/dbraw/zinc/40/45/80/1036404580.db2.gz SMFIQCARUSBMKT-UHFFFAOYSA-N -1 1 320.389 4.288 20 0 DIADMM CC(C)(C)c1ccc(/C=C/C(=O)Nc2cccc(F)c2[O-])cc1 ZINC001648850798 1036639866 /nfs/dbraw/zinc/63/98/66/1036639866.db2.gz MTKBFKDWWPTGRR-FMIVXFBMSA-N -1 1 313.372 4.481 20 0 DIADMM [O-]c1cc(Cl)c(Nc2ccc(CO)c(F)c2)cc1Cl ZINC001210485582 1036735547 /nfs/dbraw/zinc/73/55/47/1036735547.db2.gz TVLOGTPUSSJOQC-UHFFFAOYSA-N -1 1 302.132 4.074 20 0 DIADMM Nc1c(F)cc(Nc2ccc(Cl)c(Cl)c2[O-])cc1F ZINC001210911117 1037039143 /nfs/dbraw/zinc/03/91/43/1037039143.db2.gz OEVAIXWWSZGYMP-UHFFFAOYSA-N -1 1 305.111 4.303 20 0 DIADMM CCc1ccccc1[N-]S(=O)(=O)c1ccc(Cl)cc1C ZINC000048653419 1037041101 /nfs/dbraw/zinc/04/11/01/1037041101.db2.gz BBOHPHQSZNUEOK-UHFFFAOYSA-N -1 1 309.818 4.012 20 0 DIADMM Cc1cn2cccc(Nc3cc(Cl)c([O-])c(Cl)c3)c2n1 ZINC001210924882 1037055250 /nfs/dbraw/zinc/05/52/50/1037055250.db2.gz VSHWBOLGQTZUIP-UHFFFAOYSA-N -1 1 308.168 4.399 20 0 DIADMM O=C(Nc1ccc(-c2ccco2)cc1F)c1ccc([O-])c(F)c1 ZINC000683886798 1037066929 /nfs/dbraw/zinc/06/69/29/1037066929.db2.gz CWOGXBRGGPXNSG-UHFFFAOYSA-N -1 1 315.275 4.183 20 0 DIADMM CC(C)c1ccc(OCCC(=O)Nc2c([O-])cccc2F)cc1 ZINC000089541336 1037088245 /nfs/dbraw/zinc/08/82/45/1037088245.db2.gz RXPBFZNZXHCBAZ-UHFFFAOYSA-N -1 1 317.360 4.062 20 0 DIADMM CCc1ccc2nc(-c3oc4ccccc4c3C)[n-]c(=O)c2c1 ZINC000060797458 1037553453 /nfs/dbraw/zinc/55/34/53/1037553453.db2.gz MCWJFXXLTLSCKE-UHFFFAOYSA-N -1 1 304.349 4.207 20 0 DIADMM CCCC[C@@H](CC)CC(=O)Nc1ccc(-c2cc(=O)[nH][n-]2)cc1 ZINC000605021605 1038478590 /nfs/dbraw/zinc/47/85/90/1038478590.db2.gz DEMXYFILTWYRNJ-CYBMUJFWSA-N -1 1 315.417 4.327 20 0 DIADMM O=C([O-])CC[C@@H]1CCCN(Cc2cc(Cl)ccc2Cl)C1 ZINC000087761521 1038501564 /nfs/dbraw/zinc/50/15/64/1038501564.db2.gz UPUJHXAQGFPRBM-NSHDSACASA-N -1 1 316.228 4.070 20 0 DIADMM CCc1cccc(CC)c1S(=O)(=O)[N-]c1cc(F)ccc1C ZINC000605493146 1038530169 /nfs/dbraw/zinc/53/01/69/1038530169.db2.gz WKEZMHSMTPUYNF-UHFFFAOYSA-N -1 1 321.417 4.060 20 0 DIADMM Cc1cccc(C)c1CSc1nc(C(F)(F)F)cc(=O)[n-]1 ZINC000606152770 1038566959 /nfs/dbraw/zinc/56/69/59/1038566959.db2.gz BSHQFUSCYQMCRR-UHFFFAOYSA-N -1 1 314.332 4.110 20 0 DIADMM CN(CCc1cccs1)Cc1ccc(Cl)c([O-])c1Cl ZINC001232631641 1038614157 /nfs/dbraw/zinc/61/41/57/1038614157.db2.gz OMFHLAGKALZSRS-UHFFFAOYSA-N -1 1 316.253 4.435 20 0 DIADMM Cc1ccc(F)cc1NC(=O)c1ccc(C(F)(F)F)c([O-])c1 ZINC000684869137 1038666007 /nfs/dbraw/zinc/66/60/07/1038666007.db2.gz MICFQLAUUPJUML-UHFFFAOYSA-N -1 1 313.250 4.111 20 0 DIADMM O=C(Nc1cccc(Cl)c1)c1ccc(C(F)(F)F)c([O-])c1 ZINC000684869323 1038666475 /nfs/dbraw/zinc/66/64/75/1038666475.db2.gz RDBNEUYBBYALNZ-UHFFFAOYSA-N -1 1 315.678 4.317 20 0 DIADMM CCN(Cc1ccccc1)C(=O)c1ccc(C(F)(F)F)c([O-])c1 ZINC000684870879 1038667439 /nfs/dbraw/zinc/66/74/39/1038667439.db2.gz NZZYNGUMUNVGPM-UHFFFAOYSA-N -1 1 323.314 4.073 20 0 DIADMM CCCCCN(C(=O)c1ccc(C(F)(F)F)c([O-])c1)C(C)C ZINC000684872683 1038668940 /nfs/dbraw/zinc/66/89/40/1038668940.db2.gz IFZRQIPMEYOHEZ-UHFFFAOYSA-N -1 1 317.351 4.452 20 0 DIADMM CC(C)[C@@H](Cc1ccccc1)C(=O)Nc1ccc([O-])c(F)c1F ZINC000456788192 1039077434 /nfs/dbraw/zinc/07/74/34/1039077434.db2.gz REQRYPWTGZFROC-CYBMUJFWSA-N -1 1 319.351 4.124 20 0 DIADMM Cc1ccsc1CCCC(=O)Nc1ccc([O-])c(F)c1F ZINC000456783862 1039078070 /nfs/dbraw/zinc/07/80/70/1039078070.db2.gz LRSKZFDIRCWJHL-UHFFFAOYSA-N -1 1 311.353 4.002 20 0 DIADMM O=C(Nc1ccc([O-])c(F)c1F)[C@@H]1CC[C@H]2CCCC[C@H]2C1 ZINC000456789106 1039078864 /nfs/dbraw/zinc/07/88/64/1039078864.db2.gz SQDNIDJKNPKNMS-GRYCIOLGSA-N -1 1 309.356 4.215 20 0 DIADMM C[C@H](c1ccc(Cl)c(Cl)c1)N1CC[C@H](C(=O)[O-])[C@H](C)C1 ZINC000380191066 1039335415 /nfs/dbraw/zinc/33/54/15/1039335415.db2.gz DRVTUJAIHFVPSD-FOGDFJRCSA-N -1 1 316.228 4.097 20 0 DIADMM O=C(Nc1ccc([O-])c(F)c1F)c1c(Cl)cccc1Cl ZINC001140652416 1039437244 /nfs/dbraw/zinc/43/72/44/1039437244.db2.gz KYIRANKTILZWJR-UHFFFAOYSA-N -1 1 318.106 4.230 20 0 DIADMM CSc1cccc([N-]S(=O)(=O)c2cc(C)ccc2C)c1C ZINC000540289673 1039471944 /nfs/dbraw/zinc/47/19/44/1039471944.db2.gz NCTRQIJXKMMURN-UHFFFAOYSA-N -1 1 321.467 4.135 20 0 DIADMM CC(C)[C@@H]1CCC[C@H](NC(=O)c2c(F)ccc([O-])c2F)CC1 ZINC000584081120 1039597263 /nfs/dbraw/zinc/59/72/63/1039597263.db2.gz IOAXBVACGUVOGX-NEPJUHHUSA-N -1 1 311.372 4.005 20 0 DIADMM C[C@@H]1CC[C@H](C(=O)[O-])N1Cc1ccc(-c2ccccc2Cl)o1 ZINC000650794219 1039598126 /nfs/dbraw/zinc/59/81/26/1039598126.db2.gz WWGPOMMICSGTEJ-IAQYHMDHSA-N -1 1 319.788 4.038 20 0 DIADMM Cc1cnc(S[C@H](C)c2ccc(C(F)(F)F)cc2)[n-]c1=O ZINC000584183316 1039629844 /nfs/dbraw/zinc/62/98/44/1039629844.db2.gz DHURZDKYWJCFFW-SECBINFHSA-N -1 1 314.332 4.363 20 0 DIADMM O=C(Nc1ccc(F)cc1[O-])c1ccc(-c2cccs2)o1 ZINC000542168337 1039808157 /nfs/dbraw/zinc/80/81/57/1039808157.db2.gz NKGDSOBELHWZMR-UHFFFAOYSA-N -1 1 303.314 4.105 20 0 DIADMM Cc1ncccc1CSc1nc(-c2ccccc2)c(C)c(=O)[n-]1 ZINC000685568533 1040135933 /nfs/dbraw/zinc/13/59/33/1040135933.db2.gz HHOXUHVXAYYASB-UHFFFAOYSA-N -1 1 323.421 4.153 20 0 DIADMM CCO[C@H](C(=O)Nc1cc(Cl)c([O-])c2ccccc12)C(C)C ZINC000628233825 1040240229 /nfs/dbraw/zinc/24/02/29/1040240229.db2.gz XLLARCHZPVFQPR-INIZCTEOSA-N -1 1 321.804 4.198 20 0 DIADMM [O-]c1ccc(-c2nc(CSc3ccc(F)cc3)no2)c(F)c1 ZINC000318393683 1040606979 /nfs/dbraw/zinc/60/69/79/1040606979.db2.gz HFSGXBLCWXVOAP-UHFFFAOYSA-N -1 1 320.320 4.013 20 0 DIADMM CC[C@H](NCc1cscn1)c1ccc(Cl)c(Cl)c1[O-] ZINC000155500584 1040741974 /nfs/dbraw/zinc/74/19/74/1040741974.db2.gz YUXBJOBFUIHOAY-NSHDSACASA-N -1 1 317.241 4.396 20 0 DIADMM C[C@]1(F)CCCN(Cc2cc(Cl)c([O-])c(Cl)c2)CC1 ZINC001140830582 1041110236 /nfs/dbraw/zinc/11/02/36/1041110236.db2.gz ZEMUGNKNMCTBNV-AWEZNQCLSA-N -1 1 306.208 4.413 20 0 DIADMM O=c1cc(C(F)F)nc(SCCSC2CCCCC2)[n-]1 ZINC000809986272 1041287891 /nfs/dbraw/zinc/28/78/91/1041287891.db2.gz ASNHWDGDRZCIDK-UHFFFAOYSA-N -1 1 320.430 4.278 20 0 DIADMM C[C@@H](CC(=O)Nc1ccc(-c2cc(=O)[nH][n-]2)cc1)CC(C)(C)C ZINC000613668361 1041418265 /nfs/dbraw/zinc/41/82/65/1041418265.db2.gz LPVKCMFXTRRPHP-LBPRGKRZSA-N -1 1 315.417 4.183 20 0 DIADMM COc1cc(NCc2cccc([O-])c2Cl)ccc1OC(C)C ZINC000815134060 1041924085 /nfs/dbraw/zinc/92/40/85/1041924085.db2.gz HQCIKLSFJMOBAH-UHFFFAOYSA-N -1 1 321.804 4.454 20 0 DIADMM C[C@@H](c1cccs1)N(C)Cc1c(Cl)cccc1C(=O)[O-] ZINC000652392838 1042035110 /nfs/dbraw/zinc/03/51/10/1042035110.db2.gz CUNYQLSDNOXZFQ-JTQLQIEISA-N -1 1 309.818 4.293 20 0 DIADMM CCc1ccc([C@@H]2CCCN2[C@H](C)c2cc(C(=O)[O-])c(C)o2)o1 ZINC000652416593 1042043186 /nfs/dbraw/zinc/04/31/86/1042043186.db2.gz UQTHBLMNHHHFEB-ABAIWWIYSA-N -1 1 317.385 4.340 20 0 DIADMM COc1c(F)cc(Nc2cc([O-])c(Cl)cc2F)cc1F ZINC001211682632 1042053032 /nfs/dbraw/zinc/05/30/32/1042053032.db2.gz LWZUVPPNDSDPIJ-UHFFFAOYSA-N -1 1 303.667 4.215 20 0 DIADMM O=C([O-])c1cc(Nc2cccc3[nH]ncc32)c(Cl)cc1Cl ZINC001159574611 1042089130 /nfs/dbraw/zinc/08/91/30/1042089130.db2.gz IPCNZDBECQHKHY-UHFFFAOYSA-N -1 1 322.151 4.312 20 0 DIADMM CC[C@@H](C(=O)[N-]OCCC1CC1)c1cccc(C(F)(F)F)c1 ZINC000817437836 1042110365 /nfs/dbraw/zinc/11/03/65/1042110365.db2.gz SAQBAASBDSEZCF-CQSZACIVSA-N -1 1 315.335 4.047 20 0 DIADMM Cc1ccc([C@@H](NC(=O)c2c([O-])cccc2Cl)C2CC2)cc1 ZINC001135984511 1042121701 /nfs/dbraw/zinc/12/17/01/1042121701.db2.gz CRVKJQJZBXCKOE-QGZVFWFLSA-N -1 1 315.800 4.235 20 0 DIADMM CC(C)[C@@H](NC(=O)c1c([O-])cccc1Cl)c1ccccc1 ZINC001135977874 1042121933 /nfs/dbraw/zinc/12/19/33/1042121933.db2.gz BEZFHRTWAFXREE-MRXNPFEDSA-N -1 1 303.789 4.173 20 0 DIADMM CSc1ccccc1[N-]C(=O)c1ncc(C(F)(F)F)s1 ZINC001135999314 1042124161 /nfs/dbraw/zinc/12/41/61/1042124161.db2.gz HQCJMNABUHGMFQ-UHFFFAOYSA-N -1 1 318.345 4.136 20 0 DIADMM CCCCCC[C@@H](C)NC(=O)c1ccc(C(F)(F)F)cc1[O-] ZINC001136023439 1042125258 /nfs/dbraw/zinc/12/52/58/1042125258.db2.gz YEVFPBAIMYPTBU-LLVKDONJSA-N -1 1 317.351 4.500 20 0 DIADMM CC(C)[C@H](CNC(=O)c1cc(Cl)ccc1[O-])c1ccccc1 ZINC001136188090 1042171058 /nfs/dbraw/zinc/17/10/58/1042171058.db2.gz WQQHQXYCYWVOOZ-INIZCTEOSA-N -1 1 317.816 4.215 20 0 DIADMM CC[C@H](CC(=O)Nc1ccc(-c2cc(=O)[nH][n-]2)cc1)C(C)(C)C ZINC001136190604 1042173203 /nfs/dbraw/zinc/17/32/03/1042173203.db2.gz KFOXVDMYHIUHOX-CYBMUJFWSA-N -1 1 315.417 4.183 20 0 DIADMM O=C(NCc1cc2ccccc2o1)c1ccc2ccccc2c1[O-] ZINC001136257652 1042193829 /nfs/dbraw/zinc/19/38/29/1042193829.db2.gz RAALNJGOAJAUSG-UHFFFAOYSA-N -1 1 317.344 4.222 20 0 DIADMM CCC1CCC(N(C(=O)c2cccc([O-])c2F)C2CC2)CC1 ZINC001136427450 1042245880 /nfs/dbraw/zinc/24/58/80/1042245880.db2.gz NLBVCZPDCVTIKZ-UHFFFAOYSA-N -1 1 305.393 4.105 20 0 DIADMM Cc1noc(-c2ccccc2)c1[N-]C(=O)c1csc(Cl)n1 ZINC000821676182 1042262613 /nfs/dbraw/zinc/26/26/13/1042262613.db2.gz HPUGPVFHQSDWMQ-UHFFFAOYSA-N -1 1 319.773 4.012 20 0 DIADMM CC(C)(C)[C@@H]1CCCC[C@@H]1CNC(=O)c1ccc(F)c([O-])c1 ZINC001136512871 1042268081 /nfs/dbraw/zinc/26/80/81/1042268081.db2.gz KRLWDEAINRQIGV-ZIAGYGMSSA-N -1 1 307.409 4.114 20 0 DIADMM Cc1ccccc1[C@@H](NC(=O)c1cc(Cl)ccc1[O-])C(C)C ZINC001136736961 1042331380 /nfs/dbraw/zinc/33/13/80/1042331380.db2.gz UKSZPLHDVSDKHV-KRWDZBQOSA-N -1 1 317.816 4.481 20 0 DIADMM CCOc1cc(F)c(F)cc1Nc1cc(F)c([O-])cc1F ZINC001211807390 1042456440 /nfs/dbraw/zinc/45/64/40/1042456440.db2.gz GFSDAFYOFDWJSM-UHFFFAOYSA-N -1 1 301.239 4.091 20 0 DIADMM Cc1c(Cl)cc(Nc2cc(N)ccc2F)c([O-])c1Cl ZINC001211837717 1042523140 /nfs/dbraw/zinc/52/31/40/1042523140.db2.gz VPYFRNJFXILREO-UHFFFAOYSA-N -1 1 301.148 4.472 20 0 DIADMM Cc1ccccc1-c1csc(NC(=O)c2ccccc2[O-])n1 ZINC000031790643 1042754701 /nfs/dbraw/zinc/75/47/01/1042754701.db2.gz NARFCDQIPVTVSV-UHFFFAOYSA-N -1 1 310.378 4.076 20 0 DIADMM Cc1cc(-c2ccccc2)ccc1[N-]S(=O)(=O)c1ccccc1 ZINC000514539627 1042785585 /nfs/dbraw/zinc/78/55/85/1042785585.db2.gz HOTRLDBSQPGWBH-UHFFFAOYSA-N -1 1 323.417 4.463 20 0 DIADMM C[C@@H](Sc1nc(C(F)F)cc(=O)[n-]1)c1ccc(F)cc1F ZINC000514972787 1042803405 /nfs/dbraw/zinc/80/34/05/1042803405.db2.gz SPFLRNOXEJVZPJ-ZCFIWIBFSA-N -1 1 318.295 4.251 20 0 DIADMM Cc1ccc(F)cc1S(=O)(=O)[N-]c1cccc2ccccc21 ZINC000515620143 1042828937 /nfs/dbraw/zinc/82/89/37/1042828937.db2.gz JNMUFMFZIXUCCK-UHFFFAOYSA-N -1 1 315.369 4.088 20 0 DIADMM CCCC[C@H](C(=O)[O-])N1CCC[C@@H]1c1nc2ccccc2s1 ZINC000516976009 1042861622 /nfs/dbraw/zinc/86/16/22/1042861622.db2.gz REJNDUPWRTXULG-ZIAGYGMSSA-N -1 1 318.442 4.077 20 0 DIADMM CCCC[C@@H](C(=O)[O-])N1CCC[C@@H]1c1nc2ccccc2s1 ZINC000516976007 1042862273 /nfs/dbraw/zinc/86/22/73/1042862273.db2.gz REJNDUPWRTXULG-KGLIPLIRSA-N -1 1 318.442 4.077 20 0 DIADMM Cc1nc([C@H]2CCCN2Cc2cccc([O-])c2Cl)cs1 ZINC000294493454 1042908477 /nfs/dbraw/zinc/90/84/77/1042908477.db2.gz BGFOVCXXDMKFIY-CYBMUJFWSA-N -1 1 308.834 4.148 20 0 DIADMM CCN(Cc1cccc(F)c1)[C@@H](C)c1cc(C)c(C(=O)[O-])o1 ZINC000519712844 1043001062 /nfs/dbraw/zinc/00/10/62/1043001062.db2.gz WXZDPGBLPNNIFI-LBPRGKRZSA-N -1 1 305.349 4.008 20 0 DIADMM CC[C@@H](Oc1ccccc1C)C(=O)Nc1ccc([O-])c(Cl)c1 ZINC000440940727 1043014605 /nfs/dbraw/zinc/01/46/05/1043014605.db2.gz AHCCRHRKYQHGJN-OAHLLOKOSA-N -1 1 319.788 4.150 20 0 DIADMM Cc1cc([C@H](C)N(C)Cc2cc3ccccc3o2)oc1C(=O)[O-] ZINC000520241569 1043026634 /nfs/dbraw/zinc/02/66/34/1043026634.db2.gz AHTCPDVKLXNXGP-LBPRGKRZSA-N -1 1 313.353 4.225 20 0 DIADMM CCc1nc(SCCCSC(C)(C)C)[n-]c(=O)c1C ZINC000865370690 1043086472 /nfs/dbraw/zinc/08/64/72/1043086472.db2.gz ODVMRTBUNYKFPL-UHFFFAOYSA-N -1 1 300.493 4.067 20 0 DIADMM Cc1nc(SCCOC2CCCCCC2)[n-]c(=O)c1C1CC1 ZINC000865373344 1043088974 /nfs/dbraw/zinc/08/89/74/1043088974.db2.gz PXKXELOJWLUEEI-UHFFFAOYSA-N -1 1 322.474 4.200 20 0 DIADMM CC(C)c1ccc([C@@H](CC(=O)[O-])NCc2ccc(Cl)o2)cc1 ZINC000417569727 1043217977 /nfs/dbraw/zinc/21/79/77/1043217977.db2.gz LYZKZJBCLOFVKM-OAHLLOKOSA-N -1 1 321.804 4.362 20 0 DIADMM CC(C)c1cc(C(=O)N=S2(=O)CCCC2)c([O-])c(C(C)C)c1 ZINC000925931977 1043494714 /nfs/dbraw/zinc/49/47/14/1043494714.db2.gz VGVNEHPRKUOJLT-UHFFFAOYSA-N -1 1 323.458 4.041 20 0 DIADMM CCc1cccc(NCc2cc(=O)oc3cc([O-])c(CC)cc23)c1 ZINC000007241081 1043517610 /nfs/dbraw/zinc/51/76/10/1043517610.db2.gz FLHUGUNTVUEVSX-UHFFFAOYSA-N -1 1 323.392 4.236 20 0 DIADMM Cc1nc(SC[C@H]2CC(C)(C)OC2(C)C)[n-]c(=O)c1C1CC1 ZINC000882277390 1044162853 /nfs/dbraw/zinc/16/28/53/1044162853.db2.gz INCXKNHTVVVCRI-GFCCVEGCSA-N -1 1 322.474 4.054 20 0 DIADMM C[C@H](Sc1nc(C(F)F)cc(=O)[n-]1)c1cc(F)ccc1F ZINC000562906618 1044178179 /nfs/dbraw/zinc/17/81/79/1044178179.db2.gz VVBUCWROGZVIBF-LURJTMIESA-N -1 1 318.295 4.251 20 0 DIADMM C[C@H](CSc1nc(C(F)(F)F)cc(=O)[n-]1)c1ccccc1 ZINC000522830829 1044215910 /nfs/dbraw/zinc/21/59/10/1044215910.db2.gz ZRHOPBYCVYNLHF-SECBINFHSA-N -1 1 314.332 4.097 20 0 DIADMM CCc1nc(S[C@@H]2CCCc3ccccc32)[n-]c(=O)c1C ZINC000564227625 1044361447 /nfs/dbraw/zinc/36/14/47/1044361447.db2.gz QXVIGYYSFNRBQM-OAHLLOKOSA-N -1 1 300.427 4.223 20 0 DIADMM CCSCc1ccc(C(=O)Nc2c([O-])cccc2F)cc1 ZINC000609851110 1044402656 /nfs/dbraw/zinc/40/26/56/1044402656.db2.gz BLBWRFIUXHULAB-UHFFFAOYSA-N -1 1 305.374 4.037 20 0 DIADMM C[C@H](c1ccc(Cl)cc1Cl)N1CC[C@@H](C)[C@@H](C(=O)[O-])C1 ZINC000566067928 1044473170 /nfs/dbraw/zinc/47/31/70/1044473170.db2.gz JGOITUXCMRJYBC-BREBYQMCSA-N -1 1 316.228 4.097 20 0 DIADMM CC[C@@H](C)C[C@@H](C)Nc1ccc(-c2nc(C)c(C)c(=O)[n-]2)cn1 ZINC000566389028 1044487411 /nfs/dbraw/zinc/48/74/11/1044487411.db2.gz ZYVITHWIQCJKLS-VXGBXAGGSA-N -1 1 314.433 4.098 20 0 DIADMM CC(C)Cn1ncc([N-]c2nc3cc(F)ccc3o2)c1C1CC1 ZINC000566700335 1044508795 /nfs/dbraw/zinc/50/87/95/1044508795.db2.gz XWALMULHTJAVLC-UHFFFAOYSA-N -1 1 314.364 4.440 20 0 DIADMM CCSc1cccc(C(=O)Nc2ccc([O-])c(Cl)c2)c1 ZINC000134406505 1044527079 /nfs/dbraw/zinc/52/70/79/1044527079.db2.gz QFSLQFCRDIEMQH-UHFFFAOYSA-N -1 1 307.802 4.410 20 0 DIADMM CC(C)[C@@H](NC(=O)c1ccc(Cl)cc1[O-])c1ccc(F)cc1 ZINC001626143267 1044539506 /nfs/dbraw/zinc/53/95/06/1044539506.db2.gz CHSAJCIXSKDZHJ-MRXNPFEDSA-N -1 1 321.779 4.312 20 0 DIADMM Cc1nc(C(C)C)ccc1C(=O)Nc1cc(F)c([O-])cc1Cl ZINC000885677940 1044584054 /nfs/dbraw/zinc/58/40/54/1044584054.db2.gz DRVKOKQRGCBNJH-UHFFFAOYSA-N -1 1 322.767 4.264 20 0 DIADMM Cc1cc(C(=O)Nc2cc(F)c([O-])cc2Cl)c(C)n1C(C)C ZINC000885674819 1044584108 /nfs/dbraw/zinc/58/41/08/1044584108.db2.gz WDMVNSXUALHPNW-UHFFFAOYSA-N -1 1 324.783 4.436 20 0 DIADMM CC(=O)CCCCCCC(=O)Nc1cc(F)c([O-])cc1Cl ZINC000885676101 1044584454 /nfs/dbraw/zinc/58/44/54/1044584454.db2.gz ISVVPVPSDWHYCZ-UHFFFAOYSA-N -1 1 315.772 4.053 20 0 DIADMM O=c1cc(C(F)F)nc(SCc2cccc(C(F)F)c2)[n-]1 ZINC000567797422 1044586046 /nfs/dbraw/zinc/58/60/46/1044586046.db2.gz WOLKWCOUDSETKZ-UHFFFAOYSA-N -1 1 318.295 4.350 20 0 DIADMM C[C@@H](c1cc(Cl)ccc1Cl)N1CC[C@@H](C)[C@@H](C(=O)[O-])C1 ZINC000567856533 1044587806 /nfs/dbraw/zinc/58/78/06/1044587806.db2.gz LYPYORBNWHQBLQ-NRUUGDAUSA-N -1 1 316.228 4.097 20 0 DIADMM CC(C)[C@H]1CN(C(=O)c2c(F)ccc([O-])c2F)c2ccccc21 ZINC000568815253 1044651934 /nfs/dbraw/zinc/65/19/34/1044651934.db2.gz OOEMDZYZMIEWIR-GFCCVEGCSA-N -1 1 317.335 4.070 20 0 DIADMM Cc1ccc([N-]S(=O)(=O)c2cccc(C(F)F)c2)c(C)c1 ZINC000780362841 1044662264 /nfs/dbraw/zinc/66/22/64/1044662264.db2.gz HEXRUZXOJFJCPE-UHFFFAOYSA-N -1 1 311.353 4.042 20 0 DIADMM CCCC1(c2nc(-c3cc(Cl)c([O-])c(OCC)c3)no2)CC1 ZINC000445407620 1044715482 /nfs/dbraw/zinc/71/54/82/1044715482.db2.gz QBGWOEGRKRAXDR-UHFFFAOYSA-N -1 1 322.792 4.326 20 0 DIADMM [O-]c1ccc(-c2noc(Cc3ccc(Cl)cc3)n2)c(Cl)c1 ZINC000445449869 1044718415 /nfs/dbraw/zinc/71/84/15/1044718415.db2.gz QDELTEBFGUVULE-UHFFFAOYSA-N -1 1 321.163 4.340 20 0 DIADMM C[C@@H](Oc1ccccc1)c1nc(-c2ccc([O-])cc2Cl)no1 ZINC000445448653 1044718478 /nfs/dbraw/zinc/71/84/78/1044718478.db2.gz WNOURAVIMPZNHS-SNVBAGLBSA-N -1 1 316.744 4.236 20 0 DIADMM C/C(=C\c1nc(-c2ccc([O-])c(F)c2)no1)c1cccc(F)c1 ZINC000445479418 1044729204 /nfs/dbraw/zinc/72/92/04/1044729204.db2.gz HPGUMSXFWUZBQO-JXMROGBWSA-N -1 1 314.291 4.281 20 0 DIADMM Cc1ccsc1[C@H]1C[C@H]1c1nc(-c2ccc([O-])c(F)c2)no1 ZINC000445481230 1044729283 /nfs/dbraw/zinc/72/92/83/1044729283.db2.gz LYQJFQWFBIZDOF-WDEREUQCSA-N -1 1 316.357 4.222 20 0 DIADMM [O-]c1ccc(-c2noc(-c3ccc(C(F)F)cc3)n2)cc1F ZINC000445477715 1044730228 /nfs/dbraw/zinc/73/02/28/1044730228.db2.gz PCAPSHGYQZIJMU-UHFFFAOYSA-N -1 1 306.243 4.186 20 0 DIADMM [O-]c1ccc(-c2noc(CC/C=C/c3ccccc3)n2)cc1F ZINC000445481436 1044730455 /nfs/dbraw/zinc/73/04/55/1044730455.db2.gz PDTWBXXYGJNKJL-XBXARRHUSA-N -1 1 310.328 4.227 20 0 DIADMM C[C@H](c1ccc(Cl)s1)c1nc(-c2ccc([O-])c(F)c2)no1 ZINC000445479369 1044731018 /nfs/dbraw/zinc/73/10/18/1044731018.db2.gz VSVVFGLLZFNLEF-SSDOTTSWSA-N -1 1 324.764 4.448 20 0 DIADMM Cc1cccc(-c2nc(-c3ccc([O-])c(F)c3)no2)c1Cl ZINC000445478319 1044731215 /nfs/dbraw/zinc/73/12/15/1044731215.db2.gz GNGOCUJJMGTSMI-UHFFFAOYSA-N -1 1 304.708 4.210 20 0 DIADMM [O-]c1ccc(-c2noc([C@H]3CCCc4ccccc43)n2)cc1F ZINC000445484179 1044731623 /nfs/dbraw/zinc/73/16/23/1044731623.db2.gz XUJHURIYLVLQDE-AWEZNQCLSA-N -1 1 310.328 4.050 20 0 DIADMM [O-]c1ccc(-c2noc(Cc3cccc4ccccc43)n2)cc1F ZINC000445484534 1044733135 /nfs/dbraw/zinc/73/31/35/1044733135.db2.gz XFXVUXWWWSRAJZ-UHFFFAOYSA-N -1 1 320.323 4.325 20 0 DIADMM Cc1ccc(Cl)cc1-c1nc(-c2ccc([O-])c(F)c2)no1 ZINC000445476677 1044734340 /nfs/dbraw/zinc/73/43/40/1044734340.db2.gz GWIURZZIULKXTF-UHFFFAOYSA-N -1 1 304.708 4.210 20 0 DIADMM CC(C)(c1noc(-c2cc(F)ccc2[O-])n1)c1cccc(F)c1 ZINC000445622039 1044777653 /nfs/dbraw/zinc/77/76/53/1044777653.db2.gz YVGNSUWUGMRDAG-UHFFFAOYSA-N -1 1 316.307 4.046 20 0 DIADMM CCc1nc(S[C@@H](C)c2ccc(F)c(F)c2)[n-]c(=O)c1C ZINC000570816031 1044783967 /nfs/dbraw/zinc/78/39/67/1044783967.db2.gz GYAPRMPXIRJKMF-VIFPVBQESA-N -1 1 310.369 4.185 20 0 DIADMM CC(C)(Cc1ccccc1)c1noc(-c2cc(F)ccc2[O-])n1 ZINC000445798795 1044830093 /nfs/dbraw/zinc/83/00/93/1044830093.db2.gz KBVPOBDOAVNMRV-UHFFFAOYSA-N -1 1 312.344 4.102 20 0 DIADMM Cc1cc(NC(=O)c2c(F)ccc([O-])c2F)ccc1OC(C)C ZINC000574438537 1044954455 /nfs/dbraw/zinc/95/44/55/1044954455.db2.gz IMDIFQVHVMJLBI-UHFFFAOYSA-N -1 1 321.323 4.018 20 0 DIADMM Cc1nc(SCCCSCC(C)C)[n-]c(=O)c1C1CC1 ZINC000601087363 1045185785 /nfs/dbraw/zinc/18/57/85/1045185785.db2.gz GZQQDZMCFKLKKM-UHFFFAOYSA-N -1 1 312.504 4.239 20 0 DIADMM Cc1ccc(OCCCC(=O)Nc2ccc([O-])c(Cl)c2)cc1 ZINC000601052617 1045180208 /nfs/dbraw/zinc/18/02/08/1045180208.db2.gz HJOHTRNENFLMJJ-UHFFFAOYSA-N -1 1 319.788 4.152 20 0 DIADMM CCC[C@@H](C)N(C)Cc1csc(-c2cccc(C(=O)[O-])c2)n1 ZINC000578242294 1045222854 /nfs/dbraw/zinc/22/28/54/1045222854.db2.gz RBIBSJSORVWGMB-GFCCVEGCSA-N -1 1 318.442 4.129 20 0 DIADMM O=C(Nc1csc2ccccc12)c1c(F)ccc([O-])c1F ZINC000579163443 1045298330 /nfs/dbraw/zinc/29/83/30/1045298330.db2.gz LLTSXGHXCFQZHN-UHFFFAOYSA-N -1 1 305.305 4.137 20 0 DIADMM COC1(C(=O)Nc2cc(Cl)c([O-])c3ccccc23)CCCC1 ZINC000529539067 1045490566 /nfs/dbraw/zinc/49/05/66/1045490566.db2.gz ORQYSHHTXDUTCE-UHFFFAOYSA-N -1 1 319.788 4.097 20 0 DIADMM CCc1noc(C)c1[N-]C(=O)c1ccc(Oc2ccccc2)o1 ZINC000120999604 1045501859 /nfs/dbraw/zinc/50/18/59/1045501859.db2.gz WRHRULOBECRPST-UHFFFAOYSA-N -1 1 312.325 4.183 20 0 DIADMM COCCC[C@@H](C)C(=O)Nc1cc(Cl)c([O-])c2ccccc12 ZINC000628233111 1045548426 /nfs/dbraw/zinc/54/84/26/1045548426.db2.gz GZTZPIQITKZVMW-LLVKDONJSA-N -1 1 321.804 4.200 20 0 DIADMM COC[C@@H](C)[C@H](C)C(=O)Nc1cc(Cl)c([O-])c2ccccc12 ZINC000628233618 1045552118 /nfs/dbraw/zinc/55/21/18/1045552118.db2.gz MLOGPJRFWGDZGB-MNOVXSKESA-N -1 1 321.804 4.056 20 0 DIADMM CC(C)(C)OCc1ccccc1C(=O)Nc1cccc(F)c1[O-] ZINC000530004541 1045578177 /nfs/dbraw/zinc/57/81/77/1045578177.db2.gz DHBMBLFIFXGRRH-UHFFFAOYSA-N -1 1 317.360 4.099 20 0 DIADMM Cc1nc2cc(NCc3c([O-])ccc(Cl)c3F)ccc2o1 ZINC000190814725 1045613900 /nfs/dbraw/zinc/61/39/00/1045613900.db2.gz CQEDUNABPNUAOK-UHFFFAOYSA-N -1 1 306.724 4.246 20 0 DIADMM C[C@@H]1CC(C(=O)[O-])C[C@@H](C)N1Cc1ccc(Cl)c(Cl)c1 ZINC000530175053 1045615315 /nfs/dbraw/zinc/61/53/15/1045615315.db2.gz CNDHZTOGVXEJKW-NXEZZACHSA-N -1 1 316.228 4.067 20 0 DIADMM CC(=O)CCCCCSc1nc(-c2ccccc2)cc(=O)[n-]1 ZINC000901617378 1045778776 /nfs/dbraw/zinc/77/87/76/1045778776.db2.gz WDYPXHIYXCJJBW-UHFFFAOYSA-N -1 1 316.426 4.091 20 0 DIADMM CC[C@@H](C)C[C@@H](NCc1ccc(-c2ccc(C)cc2)o1)C(=O)[O-] ZINC000901670620 1045790726 /nfs/dbraw/zinc/79/07/26/1045790726.db2.gz CFRIJLGFVCNKFO-CXAGYDPISA-N -1 1 315.413 4.234 20 0 DIADMM CSc1ccccc1CSc1nc(C)c(C2CC2)c(=O)[n-]1 ZINC000631024470 1045797847 /nfs/dbraw/zinc/79/78/47/1045797847.db2.gz UUQNDRJUENJLEE-UHFFFAOYSA-N -1 1 318.467 4.382 20 0 DIADMM Cc1nc(S[C@@H]2CCc3ccc(F)cc32)[n-]c(=O)c1C1CC1 ZINC000631024752 1045798282 /nfs/dbraw/zinc/79/82/82/1045798282.db2.gz ZGPAMRZYECQECJ-CQSZACIVSA-N -1 1 316.401 4.287 20 0 DIADMM Cc1nc(SCCCCOC(C)(C)C)[n-]c(=O)c1C1CC1 ZINC000631023119 1045798400 /nfs/dbraw/zinc/79/84/00/1045798400.db2.gz IIGAWYYHGPMXLJ-UHFFFAOYSA-N -1 1 310.463 4.055 20 0 DIADMM Cc1nc(SCCCc2ccsc2)[n-]c(=O)c1C1CC1 ZINC000631024524 1045798566 /nfs/dbraw/zinc/79/85/66/1045798566.db2.gz VEPZZLQPFRYBJW-UHFFFAOYSA-N -1 1 306.456 4.154 20 0 DIADMM CCCCC[C@H](NCc1cc2cccc(CC)c2o1)C(=O)[O-] ZINC000901723381 1045798615 /nfs/dbraw/zinc/79/86/15/1045798615.db2.gz WQPFFAMDNZSXAW-INIZCTEOSA-N -1 1 303.402 4.118 20 0 DIADMM Cc1ccc(F)cc1CSc1nc(C)c(C2CC2)c(=O)[n-]1 ZINC000631024029 1045798856 /nfs/dbraw/zinc/79/88/56/1045798856.db2.gz JKWFHGNAIFVRLI-UHFFFAOYSA-N -1 1 304.390 4.108 20 0 DIADMM CC(C)C(=O)c1ccc([C@H](C)C(=O)[N-]OC2CCCCC2)cc1 ZINC000801955874 1045862252 /nfs/dbraw/zinc/86/22/52/1045862252.db2.gz XPIOFFQIEVYYLQ-AWEZNQCLSA-N -1 1 317.429 4.009 20 0 DIADMM Cc1cc(CNC/C=C/c2c(C)cc(C)cc2C)oc1C(=O)[O-] ZINC000901939549 1045873379 /nfs/dbraw/zinc/87/33/79/1045873379.db2.gz UTLDPPVIEXTCIA-AATRIKPKSA-N -1 1 313.397 4.014 20 0 DIADMM Cc1ccc(NC(=O)Nc2cc(F)c([O-])cc2F)cc1Cl ZINC001202807301 1045894661 /nfs/dbraw/zinc/89/46/61/1045894661.db2.gz HDEATCCWUYXCED-UHFFFAOYSA-N -1 1 312.703 4.276 20 0 DIADMM CCC[C@H](NCc1cc(C(=O)[O-])c(CC)o1)c1ccccc1 ZINC000902072928 1045905825 /nfs/dbraw/zinc/90/58/25/1045905825.db2.gz VZXMHCSJTRCZRP-INIZCTEOSA-N -1 1 301.386 4.171 20 0 DIADMM C[C@@H]1C[C@H]1c1ccc(CNCc2ccc(C(=O)[O-])c(Cl)c2)o1 ZINC000902107973 1045913435 /nfs/dbraw/zinc/91/34/35/1045913435.db2.gz IDCBRPACRPONJK-QMTHXVAHSA-N -1 1 319.788 4.044 20 0 DIADMM CC[C@H](NCc1cc(C(=O)[O-])c(C)o1)c1cccc(Cl)c1 ZINC000902107446 1045914485 /nfs/dbraw/zinc/91/44/85/1045914485.db2.gz CBJQIIZSSHHYRO-HNNXBMFYSA-N -1 1 307.777 4.181 20 0 DIADMM CC(C)Oc1ccccc1[C@H](C)NCc1csc(C(=O)[O-])c1 ZINC000902115806 1045915733 /nfs/dbraw/zinc/91/57/33/1045915733.db2.gz DLDWXXJAPHJHNJ-LBPRGKRZSA-N -1 1 319.426 4.084 20 0 DIADMM C[C@H](C(=O)[N-]OCc1ccc(F)cc1)c1ccc2ccccc2c1 ZINC000754714248 1045918087 /nfs/dbraw/zinc/91/80/87/1045918087.db2.gz OIWXJQVOWQYCNK-AWEZNQCLSA-N -1 1 323.367 4.330 20 0 DIADMM O=C(Nc1ccc([O-])c(Cl)c1)c1cc(-c2ccccc2)ccn1 ZINC001137674356 1045928999 /nfs/dbraw/zinc/92/89/99/1045928999.db2.gz QGALRXSZUFDMJS-UHFFFAOYSA-N -1 1 324.767 4.360 20 0 DIADMM O=C(Nc1ccc([O-])c(Cl)c1)[C@@H]1CC[C@H]1c1ccc(F)cc1 ZINC001137674424 1045930572 /nfs/dbraw/zinc/93/05/72/1045930572.db2.gz TXOQFGUUPPJRBV-UONOGXRCSA-N -1 1 319.763 4.317 20 0 DIADMM CCc1oc(CN[C@@H](CC)c2ccc(C)cc2)cc1C(=O)[O-] ZINC000902214365 1045943897 /nfs/dbraw/zinc/94/38/97/1045943897.db2.gz QNXBBYGRHXJHCR-INIZCTEOSA-N -1 1 301.386 4.090 20 0 DIADMM CC(C)Sc1ccc([C@H](C)NCc2cc(C(=O)[O-])co2)cc1 ZINC000902222245 1045950306 /nfs/dbraw/zinc/95/03/06/1045950306.db2.gz XWAORCKPPNRABP-LBPRGKRZSA-N -1 1 319.426 4.329 20 0 DIADMM CCc1oc(CN(C)C/C(C)=C\c2ccccc2)cc1C(=O)[O-] ZINC000902271086 1045961938 /nfs/dbraw/zinc/96/19/38/1045961938.db2.gz IUZOPTXPMSNIGS-UVTDQMKNSA-N -1 1 313.397 4.076 20 0 DIADMM CC[C@@H](CC(F)(F)F)c1nc(-c2ccc([O-])cc2F)no1 ZINC000453168565 1045965742 /nfs/dbraw/zinc/96/57/42/1045965742.db2.gz CIYHFHNWBCOBLA-ZETCQYMHSA-N -1 1 304.243 4.027 20 0 DIADMM Cc1cc(Br)c([O-])c(NC(=O)/C=C2/CC[C@@H](C)C2)c1 ZINC001137838848 1045981551 /nfs/dbraw/zinc/98/15/51/1045981551.db2.gz XHCIATQQNHVHTF-LZUGORFDSA-N -1 1 324.218 4.148 20 0 DIADMM CC(C)(C)C(F)(F)CN[C@H]1CCC[C@@H](CCCC(=O)[O-])C1 ZINC000902470949 1046002737 /nfs/dbraw/zinc/00/27/37/1046002737.db2.gz VQZINYJEUVOUEN-STQMWFEESA-N -1 1 305.409 4.071 20 0 DIADMM CCc1oc(CN(Cc2cccs2)C(C)C)cc1C(=O)[O-] ZINC000902511226 1046009536 /nfs/dbraw/zinc/00/95/36/1046009536.db2.gz HCPUGGGUFHXYIL-UHFFFAOYSA-N -1 1 307.415 4.012 20 0 DIADMM CCc1ccc([C@@H](C)NC(=O)c2cc(Cl)ccc2[O-])cc1 ZINC001137971611 1046040895 /nfs/dbraw/zinc/04/08/95/1046040895.db2.gz AICHJWGZRWONCN-LLVKDONJSA-N -1 1 303.789 4.099 20 0 DIADMM CC(C)C[C@H](C(=O)Nc1nc(Cl)ccc1[O-])c1ccccc1 ZINC001161179790 1046109252 /nfs/dbraw/zinc/10/92/52/1046109252.db2.gz TYQJDIOHNSFQAY-ZDUSSCGKSA-N -1 1 318.804 4.209 20 0 DIADMM CC[C@]1(C(=O)[O-])CCC[N@@H+](Cc2cc(Cl)cc(Cl)c2)C1 ZINC000086784073 1046165237 /nfs/dbraw/zinc/16/52/37/1046165237.db2.gz WCNUUFSDNHIRKA-HNNXBMFYSA-N -1 1 316.228 4.070 20 0 DIADMM O=C([O-])CC[C@@H]1CCC[N@@H+](Cc2cccc(Cl)c2Cl)C1 ZINC000086809481 1046165582 /nfs/dbraw/zinc/16/55/82/1046165582.db2.gz UDCTYTMFSIZFKR-NSHDSACASA-N -1 1 316.228 4.070 20 0 DIADMM O=C([O-])CC[C@@H]1CCCN(Cc2cccc(Cl)c2Cl)C1 ZINC000086809481 1046165588 /nfs/dbraw/zinc/16/55/88/1046165588.db2.gz UDCTYTMFSIZFKR-NSHDSACASA-N -1 1 316.228 4.070 20 0 DIADMM Cc1ccc(NC(=O)Nc2cc([O-])c(Cl)cc2F)cc1C ZINC001202826751 1046174535 /nfs/dbraw/zinc/17/45/35/1046174535.db2.gz MDQGRPLAUKXLKL-UHFFFAOYSA-N -1 1 308.740 4.446 20 0 DIADMM O=S(=O)([N-]c1ccc(C2CC2)cc1)c1cccc(C(F)F)c1 ZINC000780397053 1046227599 /nfs/dbraw/zinc/22/75/99/1046227599.db2.gz HZDMBCAYZFXLJE-UHFFFAOYSA-N -1 1 323.364 4.302 20 0 DIADMM CSc1ccc([C@@H](C)NC(=O)c2cc(Cl)ccc2[O-])cc1 ZINC001138768609 1046290509 /nfs/dbraw/zinc/29/05/09/1046290509.db2.gz CEKXLODULAULPF-SNVBAGLBSA-N -1 1 321.829 4.259 20 0 DIADMM C[C@@H](C(=O)[O-])N(C)Cc1ccc(-c2ccc(C(C)(C)C)cc2)o1 ZINC000263417973 1046317586 /nfs/dbraw/zinc/31/75/86/1046317586.db2.gz NXBLSJSQVKOZIS-ZDUSSCGKSA-N -1 1 315.413 4.149 20 0 DIADMM CCC(=O)c1cc(C(=O)Nc2ccc([O-])c(Cl)c2)ccc1F ZINC000780992232 1046416797 /nfs/dbraw/zinc/41/67/97/1046416797.db2.gz ONOPLGLVICZFCH-UHFFFAOYSA-N -1 1 321.735 4.030 20 0 DIADMM C[C@@H](Cc1ccccc1Cl)C(=O)Nc1c([O-])cccc1F ZINC000677204109 1046473559 /nfs/dbraw/zinc/47/35/59/1046473559.db2.gz DCRIPGHLJWTWGS-JTQLQIEISA-N -1 1 307.752 4.002 20 0 DIADMM [O-]c1cc(Nc2ccc(CO)c(Cl)c2)c(F)cc1Cl ZINC001212892677 1046488940 /nfs/dbraw/zinc/48/89/40/1046488940.db2.gz PKGLBMPGIDSSGR-UHFFFAOYSA-N -1 1 302.132 4.074 20 0 DIADMM O=S(=O)([N-]c1ccccc1)c1ccc2c(c1)Cc1ccccc1-2 ZINC000642315496 1046596946 /nfs/dbraw/zinc/59/69/46/1046596946.db2.gz QADJFZONQZZKKE-UHFFFAOYSA-N -1 1 321.401 4.059 20 0 DIADMM O=C([O-])c1ccccc1CN1CCC[C@H]1c1ccc(F)cc1F ZINC001140502966 1046755568 /nfs/dbraw/zinc/75/55/68/1046755568.db2.gz JFDZTEFUJXBWQB-KRWDZBQOSA-N -1 1 317.335 4.000 20 0 DIADMM CC(C)(C)Oc1ccncc1NCc1cccc([O-])c1Cl ZINC000645170978 1046773104 /nfs/dbraw/zinc/77/31/04/1046773104.db2.gz QKRVHJWGCWHNDA-UHFFFAOYSA-N -1 1 306.793 4.230 20 0 DIADMM Cc1ccc(-n2cccn2)cc1NCc1cccc([O-])c1Cl ZINC000645177000 1046775263 /nfs/dbraw/zinc/77/52/63/1046775263.db2.gz XNFCEMHXFYOVRH-UHFFFAOYSA-N -1 1 313.788 4.152 20 0 DIADMM Cn1ncc(NCc2cccc([O-])c2Cl)c1-c1ccccc1 ZINC000645181213 1046775772 /nfs/dbraw/zinc/77/57/72/1046775772.db2.gz LERWGJFXHICCLH-UHFFFAOYSA-N -1 1 313.788 4.058 20 0 DIADMM CCN(Cc1cccc(Cl)c1)Cc1ccc([O-])c(F)c1F ZINC001140892202 1046944740 /nfs/dbraw/zinc/94/47/40/1046944740.db2.gz FHEOSZVONPXCCA-UHFFFAOYSA-N -1 1 311.759 4.346 20 0 DIADMM [O-]c1c(F)cc(CN2CCC[C@H]2c2ccc(F)cc2)cc1F ZINC001140987764 1046970612 /nfs/dbraw/zinc/97/06/12/1046970612.db2.gz CNKIOVHRIMOTKR-INIZCTEOSA-N -1 1 307.315 4.147 20 0 DIADMM C[C@@H](C(=O)[N-]OCc1ccccc1)c1ccc(C(F)(F)F)cc1 ZINC000798846387 1046976723 /nfs/dbraw/zinc/97/67/23/1046976723.db2.gz VUZMZNVXFMRJNW-GFCCVEGCSA-N -1 1 323.314 4.057 20 0 DIADMM Cc1cc(C)c(NC(=O)c2cc3ccccc3cc2[O-])cc1O ZINC000680822392 1047048926 /nfs/dbraw/zinc/04/89/26/1047048926.db2.gz GCZNRCJRISZAMB-UHFFFAOYSA-N -1 1 307.349 4.120 20 0 DIADMM C[C@H](c1cccc(Cl)c1)N(C)C(=O)c1ccc([O-])c(F)c1 ZINC000681017298 1047081640 /nfs/dbraw/zinc/08/16/40/1047081640.db2.gz PGKDYOFBBHHHTA-SNVBAGLBSA-N -1 1 307.752 4.018 20 0 DIADMM C[C@H](NC(=O)c1ccc([O-])c(F)c1)c1cccc2ccccc21 ZINC000681015882 1047081807 /nfs/dbraw/zinc/08/18/07/1047081807.db2.gz IWQFSBTXGRWVHN-LBPRGKRZSA-N -1 1 309.340 4.176 20 0 DIADMM CC[C@@H](NC(=O)c1ccc([O-])c(F)c1)c1ccc(Cl)cc1 ZINC000681015594 1047083337 /nfs/dbraw/zinc/08/33/37/1047083337.db2.gz HGXBXZGMTGTHLQ-CQSZACIVSA-N -1 1 307.752 4.066 20 0 DIADMM CC[C@@H](c1ccccc1)N(CC)C(=O)c1ccc([O-])c(F)c1 ZINC000681034761 1047084677 /nfs/dbraw/zinc/08/46/77/1047084677.db2.gz DGYZCYBHFKPNJS-INIZCTEOSA-N -1 1 301.361 4.145 20 0 DIADMM Cc1c(=O)[n-]c(S[C@@H](C)c2ccncc2)nc1-c1ccccc1 ZINC000681023334 1047084772 /nfs/dbraw/zinc/08/47/72/1047084772.db2.gz HHHBYOIRZMGTJR-ZDUSSCGKSA-N -1 1 323.421 4.406 20 0 DIADMM O=C(c1ccc([O-])c(F)c1)N1CCCCC[C@@H]1c1ccccc1 ZINC000681019184 1047085604 /nfs/dbraw/zinc/08/56/04/1047085604.db2.gz SPHLFOGKIGJNQN-QGZVFWFLSA-N -1 1 313.372 4.289 20 0 DIADMM CC(C)[C@H](c1ccccc1)N(C)C(=O)c1ccc([O-])c(F)c1 ZINC000681047515 1047086892 /nfs/dbraw/zinc/08/68/92/1047086892.db2.gz ZLRMWGSFPCETLR-QGZVFWFLSA-N -1 1 301.361 4.001 20 0 DIADMM CC(C)c1ccc(C[C@H](C)NC(=O)c2ccc([O-])c(F)c2)cc1 ZINC000681066084 1047089864 /nfs/dbraw/zinc/08/98/64/1047089864.db2.gz LYRWIJFMALMCJE-ZDUSSCGKSA-N -1 1 315.388 4.016 20 0 DIADMM O=C(N[C@H](CC1CCC1)c1ccccc1)c1ccc([O-])c(F)c1 ZINC000681064758 1047090468 /nfs/dbraw/zinc/09/04/68/1047090468.db2.gz NXTABUMFUSSYOU-QGZVFWFLSA-N -1 1 313.372 4.193 20 0 DIADMM CC[C@@H](CN(CC)C(=O)c1ccc([O-])c(F)c1)c1ccccc1 ZINC000681492506 1047126233 /nfs/dbraw/zinc/12/62/33/1047126233.db2.gz QLTONUKJANFMIM-AWEZNQCLSA-N -1 1 315.388 4.187 20 0 DIADMM O=C(Nc1cc2c(cn1)CCCC2)c1cc2ccccc2cc1[O-] ZINC001141442630 1047133806 /nfs/dbraw/zinc/13/38/06/1047133806.db2.gz PGYUIXHBGCBZGS-UHFFFAOYSA-N -1 1 318.376 4.072 20 0 DIADMM CC(C)N(CCc1ccccc1)C(=O)c1c([O-])cccc1Cl ZINC001116447118 1047142157 /nfs/dbraw/zinc/14/21/57/1047142157.db2.gz VSGYNIQCJCICCK-UHFFFAOYSA-N -1 1 317.816 4.139 20 0 DIADMM CC(C)N(CCc1ccccc1)C(=O)c1ccc(Cl)cc1[O-] ZINC001116447482 1047143358 /nfs/dbraw/zinc/14/33/58/1047143358.db2.gz JVSSECPGIOJWBS-UHFFFAOYSA-N -1 1 317.816 4.139 20 0 DIADMM CCOc1cc(-c2noc(/C=C(\C)C3CC3)n2)cc(Cl)c1[O-] ZINC000445420194 1047148401 /nfs/dbraw/zinc/14/84/01/1047148401.db2.gz ASMUTTXFCINUEY-RMKNXTFCSA-N -1 1 320.776 4.308 20 0 DIADMM C[C@@H]1CCN(C(=O)c2cc(Cl)ccc2[O-])[C@@H]2CCCC[C@@H]12 ZINC001141567132 1047194400 /nfs/dbraw/zinc/19/44/00/1047194400.db2.gz GNRKBSFAHHSYRY-OSAQELSMSA-N -1 1 307.821 4.086 20 0 DIADMM O=C(Nc1ccc([O-])c(Cl)c1)Nc1cc(F)cc(Cl)c1 ZINC000476136803 1047234776 /nfs/dbraw/zinc/23/47/76/1047234776.db2.gz GMYXWFRHIWAIKK-UHFFFAOYSA-N -1 1 315.131 4.482 20 0 DIADMM CCCOc1ccc(NC(=O)c2cc(F)ccc2[O-])cc1Cl ZINC001141929989 1047310652 /nfs/dbraw/zinc/31/06/52/1047310652.db2.gz UIHGCMYQNJBNLB-UHFFFAOYSA-N -1 1 323.751 4.226 20 0 DIADMM O=C([N-][C@H](CCc1ccccc1)c1ccccc1)C(F)(F)F ZINC000725887560 1047323751 /nfs/dbraw/zinc/32/37/51/1047323751.db2.gz OLELFLLNTDCDOX-OAHLLOKOSA-N -1 1 307.315 4.039 20 0 DIADMM O=C(Nc1ccc2c(c1)CCCCC2)c1c(F)ccc([O-])c1F ZINC000652873389 1047373703 /nfs/dbraw/zinc/37/37/03/1047373703.db2.gz SAJMUBRHOZMHAX-UHFFFAOYSA-N -1 1 317.335 4.192 20 0 DIADMM O=C(/C=C/c1ccccc1)Nc1cccc(C(F)(F)F)c1[O-] ZINC001142870154 1047506965 /nfs/dbraw/zinc/50/69/65/1047506965.db2.gz ZLQHJSXTVRUASH-MDZDMXLPSA-N -1 1 307.271 4.063 20 0 DIADMM Cc1ccccc1[C@@H](NC(=O)c1c([O-])cccc1F)C(C)(C)C ZINC001149184046 1047556087 /nfs/dbraw/zinc/55/60/87/1047556087.db2.gz VXAZPMNDJLDHKJ-QGZVFWFLSA-N -1 1 315.388 4.357 20 0 DIADMM Cc1ccccc1[C@@H](C)N(C)C(=O)c1cc(Cl)ccc1[O-] ZINC001149916705 1047572475 /nfs/dbraw/zinc/57/24/75/1047572475.db2.gz MEGRRTSGAJWXHD-GFCCVEGCSA-N -1 1 303.789 4.187 20 0 DIADMM O=C(NCC1CCC2(CC2)CC1)c1cc2ccccc2cc1[O-] ZINC001149948484 1047572531 /nfs/dbraw/zinc/57/25/31/1047572531.db2.gz JCLVBVFJOHHDJU-UHFFFAOYSA-N -1 1 309.409 4.246 20 0 DIADMM CCSc1ccccc1CC(=O)Nc1ccc([O-])c(Cl)c1 ZINC001151582958 1047598802 /nfs/dbraw/zinc/59/88/02/1047598802.db2.gz PPMCCYDIAWQXBY-UHFFFAOYSA-N -1 1 321.829 4.339 20 0 DIADMM C/C(=C\c1cccc(Cl)c1)C(=O)Nc1cccc(F)c1[O-] ZINC001151771849 1047601734 /nfs/dbraw/zinc/60/17/34/1047601734.db2.gz NIWKVYMHRWARRR-CSKARUKUSA-N -1 1 305.736 4.227 20 0 DIADMM CCC(C)(C)c1ccc(CNC(=O)c2c([O-])cccc2F)cc1 ZINC001151891319 1047603317 /nfs/dbraw/zinc/60/33/17/1047603317.db2.gz DQBXNCMOEYWRDJ-UHFFFAOYSA-N -1 1 315.388 4.149 20 0 DIADMM C[C@@]1(NC(=O)c2ccc(Cl)cc2[O-])CCCc2ccccc21 ZINC001152106160 1047606973 /nfs/dbraw/zinc/60/69/73/1047606973.db2.gz GDFHEQQXSFBOTN-GOSISDBHSA-N -1 1 315.800 4.027 20 0 DIADMM CCc1nccc(C)c1NC(=O)c1c([O-])ccc2ccccc21 ZINC001153499329 1047626291 /nfs/dbraw/zinc/62/62/91/1047626291.db2.gz RNOAWHKZRUUXSH-UHFFFAOYSA-N -1 1 306.365 4.064 20 0 DIADMM Cc1ccc(CN(C)C(=O)c2c([O-])ccc3ccccc32)cc1C ZINC001153504760 1047626925 /nfs/dbraw/zinc/62/69/25/1047626925.db2.gz IBALKQHMXSWFQN-UHFFFAOYSA-N -1 1 319.404 4.434 20 0 DIADMM C=Cc1ccc(NC(=O)c2c(O)cc3ccccc3c2[O-])cc1 ZINC001154027810 1047637991 /nfs/dbraw/zinc/63/79/91/1047637991.db2.gz CGLPRFQXNJOJFZ-UHFFFAOYSA-N -1 1 305.333 4.146 20 0 DIADMM CC(C)[C@H](CC1CCCCC1)C(=O)[N-]Oc1ccccc1F ZINC001154215592 1047643202 /nfs/dbraw/zinc/64/32/02/1047643202.db2.gz JRICMGVKVRUBES-HNNXBMFYSA-N -1 1 307.409 4.478 20 0 DIADMM CC(C)[C@@H]1CCC[C@@H](NC(=O)c2c([O-])cccc2Cl)CC1 ZINC001154882745 1047660859 /nfs/dbraw/zinc/66/08/59/1047660859.db2.gz DEKVWRIUFPYPQY-CHWSQXEVSA-N -1 1 309.837 4.380 20 0 DIADMM CC(C)(C)[C@H]1CN(C(=O)c2cccc([O-])c2F)c2ccccc21 ZINC001156190945 1047705059 /nfs/dbraw/zinc/70/50/59/1047705059.db2.gz NZMXHBTVAKXHPW-AWEZNQCLSA-N -1 1 313.372 4.321 20 0 DIADMM CC(C)c1ccc(NC(=O)c2ccc(C(F)(F)F)cc2[O-])cn1 ZINC001156364905 1047708759 /nfs/dbraw/zinc/70/87/59/1047708759.db2.gz PNEDDZDPFLMHGS-UHFFFAOYSA-N -1 1 324.302 4.182 20 0 DIADMM [O-]c1cc(Nc2cc(F)nc(C(F)(F)F)c2)c(F)cc1Cl ZINC001213008728 1047743768 /nfs/dbraw/zinc/74/37/68/1047743768.db2.gz ABYUKQVSWSCWOK-UHFFFAOYSA-N -1 1 324.636 4.481 20 0 DIADMM O=C(Nc1ccc([O-])c(F)c1F)[C@@H]1C[C@H]1c1ccc(Cl)cc1 ZINC001157811331 1047755781 /nfs/dbraw/zinc/75/57/81/1047755781.db2.gz AWLYFJSNDBYJGD-WDEREUQCSA-N -1 1 323.726 4.066 20 0 DIADMM CCSCc1ccccc1C(=O)Nc1ccc([O-])c(F)c1F ZINC001157811879 1047756160 /nfs/dbraw/zinc/75/61/60/1047756160.db2.gz WUNRAXJHVRJQNG-UHFFFAOYSA-N -1 1 323.364 4.176 20 0 DIADMM CC1(C)CC(C(=O)Nc2ccc([O-])c(F)c2F)CC(C)(C)C1 ZINC001157811818 1047756615 /nfs/dbraw/zinc/75/66/15/1047756615.db2.gz UCPOSBYFMCTVLJ-UHFFFAOYSA-N -1 1 311.372 4.461 20 0 DIADMM O=C(Nc1cc(F)c([O-])cc1Cl)c1c(F)cccc1Cl ZINC001157893363 1047762549 /nfs/dbraw/zinc/76/25/49/1047762549.db2.gz IORWSTRMRFMKEC-UHFFFAOYSA-N -1 1 318.106 4.230 20 0 DIADMM C[C@H]1[C@@H](c2ccccc2)[C@H]1C(=O)Nc1cc(F)c([O-])cc1Cl ZINC001157899242 1047763369 /nfs/dbraw/zinc/76/33/69/1047763369.db2.gz DBFHZXIWFSALEX-RWJJJZRFSA-N -1 1 319.763 4.173 20 0 DIADMM CCc1ccc(NC(=O)c2cc3ccccc3cc2[O-])cc1OC ZINC001158274316 1047773285 /nfs/dbraw/zinc/77/32/85/1047773285.db2.gz WWNSBDSJTAENAH-UHFFFAOYSA-N -1 1 321.376 4.369 20 0 DIADMM Cc1ccc2oc(-c3nc4ccc(Cl)cc4c(=O)[n-]3)cc2c1 ZINC000478231924 1047774840 /nfs/dbraw/zinc/77/48/40/1047774840.db2.gz QMPZZIGAOKAFLQ-UHFFFAOYSA-N -1 1 310.740 4.298 20 0 DIADMM CCC[C@H](NC(=O)c1ccc2ccc(O)cc2c1[O-])C(C)(C)C ZINC001158430114 1047779157 /nfs/dbraw/zinc/77/91/57/1047779157.db2.gz ZKRPDNRQJIUIBT-INIZCTEOSA-N -1 1 315.413 4.196 20 0 DIADMM CSc1ccc([O-])c(C(=O)Nc2ccc(C(C)(C)C)nc2)c1 ZINC001158448627 1047780349 /nfs/dbraw/zinc/78/03/49/1047780349.db2.gz UXNWYYSPCPXNFQ-UHFFFAOYSA-N -1 1 316.426 4.059 20 0 DIADMM CC[C@H]1c2ccccc2CN1C(=O)c1c([O-])cccc1Cl ZINC001158652110 1047792679 /nfs/dbraw/zinc/79/26/79/1047792679.db2.gz HQCFOKCMLDUUES-AWEZNQCLSA-N -1 1 301.773 4.153 20 0 DIADMM O=C(Nc1cccnc1C1CC1)c1ccc2ccccc2c1[O-] ZINC001158724334 1047795306 /nfs/dbraw/zinc/79/53/06/1047795306.db2.gz KUCKLGBCYVOMAU-UHFFFAOYSA-N -1 1 304.349 4.070 20 0 DIADMM COc1cc(Nc2cc(Cl)c([O-])cc2Cl)ccc1O ZINC001174543854 1047869754 /nfs/dbraw/zinc/86/97/54/1047869754.db2.gz AJAPLGWOGCHMIK-UHFFFAOYSA-N -1 1 300.141 4.157 20 0 DIADMM CCC(CC)Oc1ccc(C(=O)Nc2ccc(F)cc2[O-])cc1 ZINC001183054575 1047883834 /nfs/dbraw/zinc/88/38/34/1047883834.db2.gz NVOMBAIBBHEOQZ-UHFFFAOYSA-N -1 1 317.360 4.351 20 0 DIADMM [O-]c1ccc(CNc2cccc(C3CCOCC3)c2)c(F)c1F ZINC001183205669 1047909427 /nfs/dbraw/zinc/90/94/27/1047909427.db2.gz LPWQZXPNZLRZHF-UHFFFAOYSA-N -1 1 319.351 4.177 20 0 DIADMM Cc1ccc(NC(=S)Nc2c(F)cc([O-])cc2F)c(C)c1 ZINC001197996135 1047917642 /nfs/dbraw/zinc/91/76/42/1047917642.db2.gz MCMYGCNDYWNHIE-UHFFFAOYSA-N -1 1 308.353 4.096 20 0 DIADMM CCO[C@H](C)n1cc(Nc2cc(Cl)cc(Cl)c2[O-])cn1 ZINC001174698312 1047944002 /nfs/dbraw/zinc/94/40/02/1047944002.db2.gz GOTKTQNXLXNNCS-MRVPVSSYSA-N -1 1 316.188 4.194 20 0 DIADMM Cc1cccc(C)c1NC(=S)Nc1ccc([O-])c(F)c1F ZINC001198349696 1047952073 /nfs/dbraw/zinc/95/20/73/1047952073.db2.gz BVJMSCPTIDIQFD-UHFFFAOYSA-N -1 1 308.353 4.096 20 0 DIADMM COc1ccc(C(F)(F)F)cc1Nc1cc(F)c([O-])cc1F ZINC001174779189 1047973007 /nfs/dbraw/zinc/97/30/07/1047973007.db2.gz ZVLLHORSJNTBNM-UHFFFAOYSA-N -1 1 319.229 4.441 20 0 DIADMM [O-]c1cc(Nc2ccc(OC(F)(F)F)c(F)c2)cc(F)c1F ZINC001213020974 1047986489 /nfs/dbraw/zinc/98/64/89/1047986489.db2.gz HVCXDYXWFXYYRT-UHFFFAOYSA-N -1 1 323.192 4.452 20 0 DIADMM [O-]c1cc(F)c(Nc2ccc(OC(F)(F)F)c(F)c2)cc1F ZINC001213021081 1047996946 /nfs/dbraw/zinc/99/69/46/1047996946.db2.gz NZJLKDAOVWBCTA-UHFFFAOYSA-N -1 1 323.192 4.452 20 0 DIADMM Cc1cc(C)c([N-]S(=O)(=O)c2ccc3occc3c2)cc1C ZINC001198869518 1048014678 /nfs/dbraw/zinc/01/46/78/1048014678.db2.gz WHXFPUZAJAIVHF-UHFFFAOYSA-N -1 1 315.394 4.159 20 0 DIADMM [O-]c1c(Cl)cc(Br)cc1Nc1cccc(O)c1 ZINC001174893993 1048014958 /nfs/dbraw/zinc/01/49/58/1048014958.db2.gz BYPLVZDTMSSQRF-UHFFFAOYSA-N -1 1 314.566 4.257 20 0 DIADMM CC1(CNC(=O)c2ccc(C(F)(F)F)c([O-])c2)CCCCC1 ZINC001160484496 1048055178 /nfs/dbraw/zinc/05/51/78/1048055178.db2.gz QLVMFLKCGWVPEK-UHFFFAOYSA-N -1 1 315.335 4.111 20 0 DIADMM [O-]c1c(Cl)nccc1Nc1cc(F)cc(C(F)(F)F)c1 ZINC001175061280 1048090223 /nfs/dbraw/zinc/09/02/23/1048090223.db2.gz MVVSXDKSIXQOHK-UHFFFAOYSA-N -1 1 306.646 4.342 20 0 DIADMM O=C(Nc1cc([O-])c(F)cc1F)c1cc2c(cccc2F)s1 ZINC001160910093 1048096071 /nfs/dbraw/zinc/09/60/71/1048096071.db2.gz TVJHIHIIHKLCTQ-UHFFFAOYSA-N -1 1 323.295 4.277 20 0 DIADMM C/C(=C/C(=O)Nc1cc([O-])c(F)cc1F)c1ccccc1C ZINC001160917906 1048096540 /nfs/dbraw/zinc/09/65/40/1048096540.db2.gz VTEBCVUUKVCFGU-XFFZJAGNSA-N -1 1 303.308 4.021 20 0 DIADMM O=C(Nc1cc([O-])c(F)cc1F)c1ccc(Cl)c2occc21 ZINC001160925248 1048096727 /nfs/dbraw/zinc/09/67/27/1048096727.db2.gz RRDLTLISDVUQPH-UHFFFAOYSA-N -1 1 323.682 4.322 20 0 DIADMM CC(C)Sc1ccccc1C(=O)Nc1cc([O-])c(F)cc1F ZINC001160915942 1048097022 /nfs/dbraw/zinc/09/70/22/1048097022.db2.gz ABJGKZKNXVHAGP-UHFFFAOYSA-N -1 1 323.364 4.423 20 0 DIADMM CCc1oc2ccccc2c1CC(=O)Nc1ccc(F)cc1[O-] ZINC001161045822 1048104331 /nfs/dbraw/zinc/10/43/31/1048104331.db2.gz DVKBFGJCBCOWLZ-UHFFFAOYSA-N -1 1 313.328 4.021 20 0 DIADMM [O-]c1c(Cl)cc(Br)cc1Nc1ccc(O)cc1 ZINC001175047339 1048109019 /nfs/dbraw/zinc/10/90/19/1048109019.db2.gz LKDICIHYUIMGQB-UHFFFAOYSA-N -1 1 314.566 4.257 20 0 DIADMM [O-]c1c(Cl)cc(Cl)cc1Nc1cc(CO)ccc1F ZINC001175131899 1048156367 /nfs/dbraw/zinc/15/63/67/1048156367.db2.gz QTNOYUQCUDTUBQ-UHFFFAOYSA-N -1 1 302.132 4.074 20 0 DIADMM CC(=O)c1ccccc1Nc1ccc(F)c(Br)c1[O-] ZINC001175180026 1048185942 /nfs/dbraw/zinc/18/59/42/1048185942.db2.gz HZEXQAXIBVATNL-UHFFFAOYSA-N -1 1 324.149 4.240 20 0 DIADMM CCc1ccccc1NC(=S)Nc1cc(F)c([O-])c(F)c1 ZINC001201147123 1048201424 /nfs/dbraw/zinc/20/14/24/1048201424.db2.gz QYTHBRFZGKSWCU-UHFFFAOYSA-N -1 1 308.353 4.042 20 0 DIADMM CCOc1cc([N-]c2nnc(C(C)(C)C)s2)c(Cl)cn1 ZINC001250210049 1048228553 /nfs/dbraw/zinc/22/85/53/1048228553.db2.gz JETJADFHDZKRQM-UHFFFAOYSA-N -1 1 312.826 4.026 20 0 DIADMM O=C(Nc1cccc([O-])c1Cl)Nc1c(F)cc(F)cc1F ZINC001186057231 1048261108 /nfs/dbraw/zinc/26/11/08/1048261108.db2.gz PFQDSDQXTRIRGH-UHFFFAOYSA-N -1 1 316.666 4.107 20 0 DIADMM O=C(Nc1ccc(Cl)cc1[O-])Nc1c(F)cc(F)cc1F ZINC001186057607 1048262253 /nfs/dbraw/zinc/26/22/53/1048262253.db2.gz TUMWDLLUZMTQLP-UHFFFAOYSA-N -1 1 316.666 4.107 20 0 DIADMM CC(C)Cc1ccc([C@H](C)NC(=O)c2ccc([O-])c(F)c2)cc1 ZINC001186242319 1048275318 /nfs/dbraw/zinc/27/53/18/1048275318.db2.gz HPNNSBXXMSMMDF-ZDUSSCGKSA-N -1 1 315.388 4.221 20 0 DIADMM Cn1ncc2cc(Nc3cc(Cl)cc(Cl)c3[O-])ccc21 ZINC001175421459 1048301801 /nfs/dbraw/zinc/30/18/01/1048301801.db2.gz XXLSWAYBEPUMSE-UHFFFAOYSA-N -1 1 308.168 4.329 20 0 DIADMM Cn1ncc2c1cccc2Nc1cc(Cl)cc(Cl)c1[O-] ZINC001175436897 1048306213 /nfs/dbraw/zinc/30/62/13/1048306213.db2.gz MYTLIWKDWDXUBY-UHFFFAOYSA-N -1 1 308.168 4.329 20 0 DIADMM CCCC[C@H]1CCC[C@H]1[N-]S(=O)(=O)c1cc2ccccc2o1 ZINC001186540781 1048316310 /nfs/dbraw/zinc/31/63/10/1048316310.db2.gz LTINPXZHVRCJCM-DZGCQCFKSA-N -1 1 321.442 4.070 20 0 DIADMM C[S@@](=O)c1ccc(Nc2cc(Cl)c([O-])cc2Cl)cc1 ZINC001175484954 1048322727 /nfs/dbraw/zinc/32/27/27/1048322727.db2.gz SAJRDBCUVRUVEE-LJQANCHMSA-N -1 1 316.209 4.180 20 0 DIADMM Brc1cccc2nc([N-]c3cncs3)sc21 ZINC001175495579 1048329358 /nfs/dbraw/zinc/32/93/58/1048329358.db2.gz LCBGFNFZONXHPH-UHFFFAOYSA-N -1 1 312.217 4.259 20 0 DIADMM O=C(Nc1cccc([O-])c1Cl)NC12CC3CC(CC(C3)C1)C2 ZINC001186677933 1048334977 /nfs/dbraw/zinc/33/49/77/1048334977.db2.gz VLCBTTYOFLLKLX-UHFFFAOYSA-N -1 1 320.820 4.136 20 0 DIADMM CSc1ccccc1NC(=O)Nc1ccc([O-])c(F)c1F ZINC001186747936 1048339565 /nfs/dbraw/zinc/33/95/65/1048339565.db2.gz XWUKWNJIPHALKF-UHFFFAOYSA-N -1 1 310.325 4.036 20 0 DIADMM O=C(NCC1CCCCC1)Nc1cccc(C(F)(F)F)c1[O-] ZINC001186882715 1048353460 /nfs/dbraw/zinc/35/34/60/1048353460.db2.gz BQYCFFRGMHVHMH-UHFFFAOYSA-N -1 1 316.323 4.113 20 0 DIADMM Cn1cc2c(cccc2Nc2cc(Cl)cc(Cl)c2[O-])n1 ZINC001175593442 1048363158 /nfs/dbraw/zinc/36/31/58/1048363158.db2.gz KATQVZZGSWLFTQ-UHFFFAOYSA-N -1 1 308.168 4.329 20 0 DIADMM Cn1cc2ccc(Nc3cc(Cl)cc(Cl)c3[O-])cc2n1 ZINC001175615464 1048397124 /nfs/dbraw/zinc/39/71/24/1048397124.db2.gz YQQBLJWZIPAHCL-UHFFFAOYSA-N -1 1 308.168 4.329 20 0 DIADMM Cn1cc2ccc(Nc3ccc(Cl)c(Cl)c3[O-])cc2n1 ZINC001175618640 1048397195 /nfs/dbraw/zinc/39/71/95/1048397195.db2.gz RPKMMSRQQUKFTP-UHFFFAOYSA-N -1 1 308.168 4.329 20 0 DIADMM O=C(Nc1ccccc1F)Nc1cccc(C(F)(F)F)c1[O-] ZINC001202000674 1048426309 /nfs/dbraw/zinc/42/63/09/1048426309.db2.gz JWMNIZDWZBYCCO-UHFFFAOYSA-N -1 1 314.238 4.194 20 0 DIADMM CC[C@H](C)c1ccc(NC(=O)c2ncc(C(F)(F)F)[n-]2)cc1 ZINC001188278728 1048495909 /nfs/dbraw/zinc/49/59/09/1048495909.db2.gz UPPYRYOKWPPOTI-VIFPVBQESA-N -1 1 311.307 4.194 20 0 DIADMM CC[C@H](C)c1ccc(NC(=O)c2nc(C(F)(F)F)c[n-]2)cc1 ZINC001188278728 1048495919 /nfs/dbraw/zinc/49/59/19/1048495919.db2.gz UPPYRYOKWPPOTI-VIFPVBQESA-N -1 1 311.307 4.194 20 0 DIADMM CC[C@@H](C)c1ccc(NC(=O)c2ncc(C(F)(F)F)[n-]2)cc1 ZINC001188278727 1048496743 /nfs/dbraw/zinc/49/67/43/1048496743.db2.gz UPPYRYOKWPPOTI-SECBINFHSA-N -1 1 311.307 4.194 20 0 DIADMM CC[C@@H](C)c1ccc(NC(=O)c2nc(C(F)(F)F)c[n-]2)cc1 ZINC001188278727 1048496750 /nfs/dbraw/zinc/49/67/50/1048496750.db2.gz UPPYRYOKWPPOTI-SECBINFHSA-N -1 1 311.307 4.194 20 0 DIADMM [O-]c1c(Cl)cc(Br)cc1Nc1cscn1 ZINC001175946206 1048523623 /nfs/dbraw/zinc/52/36/23/1048523623.db2.gz UGSXSWRGSWQKEU-UHFFFAOYSA-N -1 1 305.584 4.008 20 0 DIADMM O=C(Nc1ccc(C(F)(F)F)cc1)Nc1c([O-])cccc1F ZINC001202411578 1048543522 /nfs/dbraw/zinc/54/35/22/1048543522.db2.gz USZPFVDDISMSMK-UHFFFAOYSA-N -1 1 314.238 4.194 20 0 DIADMM Cc1ccc(Cl)cc1NC(=O)Nc1cc(F)c([O-])c(F)c1 ZINC001188728650 1048549320 /nfs/dbraw/zinc/54/93/20/1048549320.db2.gz KRNIMTLUIUHUCM-UHFFFAOYSA-N -1 1 312.703 4.276 20 0 DIADMM Cc1ccc(Cl)cc1NC(=O)Nc1c(F)cc([O-])cc1F ZINC001188735604 1048550253 /nfs/dbraw/zinc/55/02/53/1048550253.db2.gz KGNPTAMPUVOOSD-UHFFFAOYSA-N -1 1 312.703 4.276 20 0 DIADMM Cc1ccc(NC(=O)Nc2cccc(C(F)(F)F)c2[O-])cc1 ZINC001202434763 1048552603 /nfs/dbraw/zinc/55/26/03/1048552603.db2.gz RSVCNXVAWZHASQ-UHFFFAOYSA-N -1 1 310.275 4.363 20 0 DIADMM COc1cccc2[nH]c(Nc3cc([O-])c(Cl)cc3F)cc21 ZINC001176063890 1048557769 /nfs/dbraw/zinc/55/77/69/1048557769.db2.gz KKNNHCXCHOGSFP-UHFFFAOYSA-N -1 1 306.724 4.418 20 0 DIADMM Cc1ccc2ccc(F)c(Nc3cc([O-])c(F)c(F)c3)c2n1 ZINC001176116009 1048571684 /nfs/dbraw/zinc/57/16/84/1048571684.db2.gz CFLBAUZREALJAH-UHFFFAOYSA-N -1 1 304.271 4.410 20 0 DIADMM Cc1c(F)cccc1NC(=O)Nc1cc([O-])c(Cl)cc1F ZINC001189051445 1048585734 /nfs/dbraw/zinc/58/57/34/1048585734.db2.gz JOAYFXNJFHLNKA-UHFFFAOYSA-N -1 1 312.703 4.276 20 0 DIADMM COc1ccc(Nc2ccc(F)c(F)c2[O-])c(C(F)(F)F)c1 ZINC001213051033 1048619024 /nfs/dbraw/zinc/61/90/24/1048619024.db2.gz ZSXNFHDPVDPKGZ-UHFFFAOYSA-N -1 1 319.229 4.441 20 0 DIADMM COc1ccc(Nc2cc(Cl)c(C)c(Cl)c2[O-])cc1O ZINC001176259189 1048625148 /nfs/dbraw/zinc/62/51/48/1048625148.db2.gz FTCFCQHAMKKJNI-UHFFFAOYSA-N -1 1 314.168 4.465 20 0 DIADMM Cc1cnc(SCCCc2cccc3ccccc32)[n-]c1=O ZINC001189399194 1048625403 /nfs/dbraw/zinc/62/54/03/1048625403.db2.gz GLFALFNPBNGLHX-UHFFFAOYSA-N -1 1 310.422 4.369 20 0 DIADMM CCc1ccc2ccccc2c1CSc1ncc(C)c(=O)[n-]1 ZINC001189399329 1048625426 /nfs/dbraw/zinc/62/54/26/1048625426.db2.gz LPJWEKCYYIZCSD-UHFFFAOYSA-N -1 1 310.422 4.499 20 0 DIADMM CCc1nc(SCc2ccc3ccccc3c2)[n-]c(=O)c1C ZINC001189496268 1048631080 /nfs/dbraw/zinc/63/10/80/1048631080.db2.gz ZOVBGHPBOQBMOV-UHFFFAOYSA-N -1 1 310.422 4.499 20 0 DIADMM O=C(Nc1cccc(F)c1[O-])c1cc2c(s1)CCCCC2 ZINC001151771375 1048635772 /nfs/dbraw/zinc/63/57/72/1048635772.db2.gz HYWFFRDRRLFNBA-UHFFFAOYSA-N -1 1 305.374 4.114 20 0 DIADMM CC(C)(C)c1ccccc1NC(=O)Nc1c([O-])cccc1F ZINC001189591272 1048640384 /nfs/dbraw/zinc/64/03/84/1048640384.db2.gz POKAENLWMUNWTQ-UHFFFAOYSA-N -1 1 302.349 4.473 20 0 DIADMM CCCc1cc(=O)[n-]c(SCCc2ccc(CC)cc2)n1 ZINC001164552422 1048640676 /nfs/dbraw/zinc/64/06/76/1048640676.db2.gz WDOAWWHIHVHVKT-UHFFFAOYSA-N -1 1 302.443 4.032 20 0 DIADMM CCCc1cc(=O)[n-]c(SCc2ccc(F)cc2Cl)n1 ZINC001164551439 1048640872 /nfs/dbraw/zinc/64/08/72/1048640872.db2.gz KDUAHDVUIRLMLW-UHFFFAOYSA-N -1 1 312.797 4.220 20 0 DIADMM CCCc1cc(=O)[n-]c(S[C@@H]2CCc3ccc(F)cc32)n1 ZINC001164551061 1048641078 /nfs/dbraw/zinc/64/10/78/1048641078.db2.gz GCYGNEJKFMUTLX-CQSZACIVSA-N -1 1 304.390 4.053 20 0 DIADMM CC(C)Oc1cc(Nc2cc([O-])c(Cl)cc2F)c(F)cn1 ZINC001176482914 1048694289 /nfs/dbraw/zinc/69/42/89/1048694289.db2.gz KHZRJZYNHMEQDI-UHFFFAOYSA-N -1 1 314.719 4.250 20 0 DIADMM O=c1cc(-c2ccccc2)nc(SC/C(Cl)=C\Cl)[n-]1 ZINC001190201363 1048708198 /nfs/dbraw/zinc/70/81/98/1048708198.db2.gz OPCCORLKBVRXLC-JXMROGBWSA-N -1 1 313.209 4.260 20 0 DIADMM CC1(C)CC(CNC(=O)c2c([O-])cccc2F)CC(C)(C)C1 ZINC001165785362 1048715932 /nfs/dbraw/zinc/71/59/32/1048715932.db2.gz NWQJKBNZQHOXOT-UHFFFAOYSA-N -1 1 307.409 4.114 20 0 DIADMM COC(=O)c1c[n-]c(S[C@@H](C)c2ccc(C(C)(C)C)cc2)n1 ZINC001166030958 1048730064 /nfs/dbraw/zinc/73/00/64/1048730064.db2.gz YGUADJMAKRZIFU-NSHDSACASA-N -1 1 318.442 4.347 20 0 DIADMM Cc1cccc(C)c1[C@H]1CCCN1C(=O)c1cccc([O-])c1F ZINC001166233615 1048741194 /nfs/dbraw/zinc/74/11/94/1048741194.db2.gz ZNPQTXYUANXKKF-OAHLLOKOSA-N -1 1 313.372 4.125 20 0 DIADMM CCC(C)(C)c1ccc(CSc2ncc(C)c(=O)[n-]2)cc1 ZINC001166227733 1048741488 /nfs/dbraw/zinc/74/14/88/1048741488.db2.gz SOORFUWUHQIXJT-UHFFFAOYSA-N -1 1 302.443 4.471 20 0 DIADMM [O-]c1c(F)cc(F)c(Nc2ccnc(Cl)c2Cl)c1F ZINC001176663470 1048753516 /nfs/dbraw/zinc/75/35/16/1048753516.db2.gz FZTLNOCNDDVZAB-UHFFFAOYSA-N -1 1 309.074 4.255 20 0 DIADMM [O-]c1c(F)cc(F)c(Nc2cnc3cc(F)ccc3c2)c1F ZINC001176664187 1048751993 /nfs/dbraw/zinc/75/19/93/1048751993.db2.gz QNIXDILXXKGSEG-UHFFFAOYSA-N -1 1 308.234 4.240 20 0 DIADMM Cc1cc(OC(F)F)ccc1Nc1c(F)cc(F)c([O-])c1F ZINC001176671780 1048754344 /nfs/dbraw/zinc/75/43/44/1048754344.db2.gz OSCSREAWJFUPRC-UHFFFAOYSA-N -1 1 319.229 4.463 20 0 DIADMM COc1c(Cl)cccc1Nc1c(F)cc(F)c([O-])c1F ZINC001176669887 1048754921 /nfs/dbraw/zinc/75/49/21/1048754921.db2.gz OFWGKJQLTSUKDW-UHFFFAOYSA-N -1 1 303.667 4.215 20 0 DIADMM [O-]c1c(F)cc(F)c(Nc2cccc3ccc(O)cc32)c1F ZINC001176672358 1048756014 /nfs/dbraw/zinc/75/60/14/1048756014.db2.gz HMBKGANCJWIIIS-UHFFFAOYSA-N -1 1 305.255 4.412 20 0 DIADMM Cc1c(Cl)cc(N)cc1Nc1c(F)cc(F)c([O-])c1F ZINC001176670831 1048756273 /nfs/dbraw/zinc/75/62/73/1048756273.db2.gz MTJUZXGIMLPORY-UHFFFAOYSA-N -1 1 302.683 4.097 20 0 DIADMM Cc1ccc2cc(Nc3c(F)cc(F)c([O-])c3F)ccc2n1 ZINC001176671463 1048756573 /nfs/dbraw/zinc/75/65/73/1048756573.db2.gz DTGGCPZQYRNHJX-UHFFFAOYSA-N -1 1 304.271 4.410 20 0 DIADMM CSc1ccc(Nc2c(F)cc(F)c([O-])c2F)c(F)c1 ZINC001176674880 1048757096 /nfs/dbraw/zinc/75/70/96/1048757096.db2.gz ZWKYQYDJDBKXDT-UHFFFAOYSA-N -1 1 303.280 4.414 20 0 DIADMM COc1ccc(Nc2c(F)cc(F)c([O-])c2F)c2ccncc12 ZINC001176674854 1048757995 /nfs/dbraw/zinc/75/79/95/1048757995.db2.gz YNMAKQKQPRGLBV-UHFFFAOYSA-N -1 1 320.270 4.110 20 0 DIADMM Cc1[nH]c2ccc(C(=O)Nc3ccc([O-])c(Cl)c3)cc2c1C ZINC000111667399 1048927358 /nfs/dbraw/zinc/92/73/58/1048927358.db2.gz LYNZBJQNBMDVKY-UHFFFAOYSA-N -1 1 314.772 4.396 20 0 DIADMM Cc1cccc([C@@H](CC(=O)[O-])NCc2ccsc2Cl)c1 ZINC000904044485 1048961990 /nfs/dbraw/zinc/96/19/90/1048961990.db2.gz BANVMWSMKOSIGS-CYBMUJFWSA-N -1 1 309.818 4.016 20 0 DIADMM Cc1cccc([C@@H](CC(=O)[O-])NCc2sccc2Cl)c1 ZINC000904044457 1048962186 /nfs/dbraw/zinc/96/21/86/1048962186.db2.gz AJRIJPYTUOZVBF-CYBMUJFWSA-N -1 1 309.818 4.016 20 0 DIADMM CCCOc1ccc(Nc2cc(F)c([O-])c(F)c2)c(F)c1F ZINC001203696882 1048968616 /nfs/dbraw/zinc/96/86/16/1048968616.db2.gz NIPSVONDURGLMI-UHFFFAOYSA-N -1 1 315.266 4.481 20 0 DIADMM CC(C)c1ccc([C@H](N[C@H](C)C(=O)[O-])c2cccs2)cc1 ZINC000904204816 1049001925 /nfs/dbraw/zinc/00/19/25/1049001925.db2.gz ZMEKOEPKDJUUKF-WBMJQRKESA-N -1 1 303.427 4.024 20 0 DIADMM COc1cccc(C)c1NC(=O)Nc1ccc([O-])c(Cl)c1 ZINC000194976135 1049004520 /nfs/dbraw/zinc/00/45/20/1049004520.db2.gz NXDFALMDOXFDCG-UHFFFAOYSA-N -1 1 306.749 4.007 20 0 DIADMM CC(C)c1ccccc1NC(=O)Nc1cc(F)cc(F)c1[O-] ZINC001192260510 1049068726 /nfs/dbraw/zinc/06/87/26/1049068726.db2.gz MCIGTIZHTKEXIF-UHFFFAOYSA-N -1 1 306.312 4.438 20 0 DIADMM CC(C)c1ccccc1NC(=O)Nc1c(F)cc([O-])cc1F ZINC001192260599 1049070038 /nfs/dbraw/zinc/07/00/38/1049070038.db2.gz XQBOPHBOUMGKSQ-UHFFFAOYSA-N -1 1 306.312 4.438 20 0 DIADMM CC(C)(C)c1ccc(C(=O)Nc2nc(C3CC3)cs2)c([O-])c1 ZINC001192315163 1049075257 /nfs/dbraw/zinc/07/52/57/1049075257.db2.gz YJCMCYXVIOEZOQ-UHFFFAOYSA-N -1 1 316.426 4.276 20 0 DIADMM CC(C)(C)c1ccc(C(=O)Nc2ccc(C(F)F)nc2)c([O-])c1 ZINC001192313317 1049075795 /nfs/dbraw/zinc/07/57/95/1049075795.db2.gz ADZNXTBGSZVVRY-UHFFFAOYSA-N -1 1 320.339 4.275 20 0 DIADMM CCc1nccc(C)c1NC(=O)c1ccc(C(C)(C)C)cc1[O-] ZINC001192313625 1049076733 /nfs/dbraw/zinc/07/67/33/1049076733.db2.gz FNABBBWUHDLHCM-UHFFFAOYSA-N -1 1 312.413 4.208 20 0 DIADMM O=C([O-])c1ccc(C[N@H+]2CCC[C@H]2c2ccc(Cl)s2)cc1 ZINC001204155367 1049097575 /nfs/dbraw/zinc/09/75/75/1049097575.db2.gz LBXYRZPZGAYWAU-ZDUSSCGKSA-N -1 1 321.829 4.437 20 0 DIADMM O=C([O-])c1ccc(CN2CCC[C@H]2c2ccc(Cl)s2)cc1 ZINC001204155367 1049097588 /nfs/dbraw/zinc/09/75/88/1049097588.db2.gz LBXYRZPZGAYWAU-ZDUSSCGKSA-N -1 1 321.829 4.437 20 0 DIADMM CC[C@H](C)c1ccc(NC(=O)c2c(F)ccc([O-])c2F)cc1 ZINC001192520618 1049112737 /nfs/dbraw/zinc/11/27/37/1049112737.db2.gz QKSQWHFJGHWXMR-JTQLQIEISA-N -1 1 305.324 4.436 20 0 DIADMM Cc1cc(C)cc(CCC(=O)Nc2cc(F)c([O-])cc2Cl)c1 ZINC001179660077 1049188553 /nfs/dbraw/zinc/18/85/53/1049188553.db2.gz LBFWJPCKPSWPEI-UHFFFAOYSA-N -1 1 321.779 4.373 20 0 DIADMM C[C@H](C(=O)Nc1cc(F)c([O-])cc1Cl)c1ccccc1F ZINC001179655990 1049188896 /nfs/dbraw/zinc/18/88/96/1049188896.db2.gz LSDDTSKGICZGLY-QMMMGPOBSA-N -1 1 311.715 4.066 20 0 DIADMM CC(C)c1scnc1C(=O)Nc1cc(F)c([O-])cc1Cl ZINC001179659866 1049188995 /nfs/dbraw/zinc/18/89/95/1049188995.db2.gz IAWXXZNELHVIHD-UHFFFAOYSA-N -1 1 314.769 4.017 20 0 DIADMM Cc1ccccc1C[C@@H](C)C(=O)Nc1cc(F)c([O-])cc1Cl ZINC001179660574 1049189089 /nfs/dbraw/zinc/18/90/89/1049189089.db2.gz XHKHMDYTOCZJJT-LLVKDONJSA-N -1 1 321.779 4.310 20 0 DIADMM Cc1ccc2nc(-c3ccc(OC(C)(C)C)cc3)[n-]c(=O)c2c1 ZINC000485354786 1049228490 /nfs/dbraw/zinc/22/84/90/1049228490.db2.gz WESLGFQUKVTXOA-UHFFFAOYSA-N -1 1 308.381 4.076 20 0 DIADMM O=C(c1cc2ccccc2cc1[O-])N1CCC[C@H]1C1CCCC1 ZINC000195535396 1049236556 /nfs/dbraw/zinc/23/65/56/1049236556.db2.gz JFOJQBJFABDJAA-SFHVURJKSA-N -1 1 309.409 4.340 20 0 DIADMM O=c1nc(N[C@H]2CCCC[C@@H]2Cc2ccccc2)cc(Cl)[n-]1 ZINC000858389644 1049250734 /nfs/dbraw/zinc/25/07/34/1049250734.db2.gz JWMWOTJYAYEZDD-KGLIPLIRSA-N -1 1 317.820 4.049 20 0 DIADMM O=c1nc(N[C@@H]2CCCC[C@H]2Cc2ccccc2)cc(Cl)[n-]1 ZINC000858389645 1049251042 /nfs/dbraw/zinc/25/10/42/1049251042.db2.gz JWMWOTJYAYEZDD-UONOGXRCSA-N -1 1 317.820 4.049 20 0 DIADMM O=c1nc(N[C@@H]2CC[C@@H](c3ccc(Cl)cc3)C2)cc(Cl)[n-]1 ZINC000858567632 1049276600 /nfs/dbraw/zinc/27/66/00/1049276600.db2.gz HJUNSXUNWCWSKG-ZYHUDNBSSA-N -1 1 324.211 4.237 20 0 DIADMM CCCC[C@@H](CC)COC(=O)Nc1cc(F)c([O-])cc1F ZINC001193969523 1049287840 /nfs/dbraw/zinc/28/78/40/1049287840.db2.gz YXBZGKMJPVUBKJ-SNVBAGLBSA-N -1 1 301.333 4.435 20 0 DIADMM O=C(c1ccc2ccccc2c1[O-])N1CC=C(c2ccccc2)C1 ZINC000436958022 1049287946 /nfs/dbraw/zinc/28/79/46/1049287946.db2.gz CGPSMCSMNDOFHW-UHFFFAOYSA-N -1 1 315.372 4.085 20 0 DIADMM CCCC[C@@H](CC)COC(=O)Nc1c(F)cc([O-])cc1F ZINC001193968143 1049288408 /nfs/dbraw/zinc/28/84/08/1049288408.db2.gz MULSABAIOQPIIX-SNVBAGLBSA-N -1 1 301.333 4.435 20 0 DIADMM O=c1nc(NCCCCCCc2ccccc2)cc(Cl)[n-]1 ZINC000858683009 1049288765 /nfs/dbraw/zinc/28/87/65/1049288765.db2.gz ZZNMJRXSAZPSSX-UHFFFAOYSA-N -1 1 305.809 4.051 20 0 DIADMM C[C@H](c1ccc(F)c(F)c1)N(C)Cc1ccc([O-])c(F)c1F ZINC001180523229 1049371750 /nfs/dbraw/zinc/37/17/50/1049371750.db2.gz QWISGJVFHKUCIC-SECBINFHSA-N -1 1 313.294 4.142 20 0 DIADMM Cc1cccc(C)c1S(=O)(=O)[N-]c1cccc(C(F)F)c1 ZINC001194633961 1049401732 /nfs/dbraw/zinc/40/17/32/1049401732.db2.gz HULPDAZSBGPXCU-UHFFFAOYSA-N -1 1 311.353 4.042 20 0 DIADMM O=C(c1ccc(Cl)cc1[O-])N1CCC[C@H](C2CCCC2)C1 ZINC001181054979 1049431599 /nfs/dbraw/zinc/43/15/99/1049431599.db2.gz YWTUFUBUCOYTQG-ZDUSSCGKSA-N -1 1 307.821 4.088 20 0 DIADMM CC(C)Oc1cccc(NC(=O)Nc2ccc([O-])c(Cl)c2)c1 ZINC001205437747 1049471246 /nfs/dbraw/zinc/47/12/46/1049471246.db2.gz JXKGFNOUJFOEEG-UHFFFAOYSA-N -1 1 320.776 4.477 20 0 DIADMM CC1(OCC(=O)Nc2cc(Cl)c([O-])c3ccccc23)CCC1 ZINC000862294442 1049486653 /nfs/dbraw/zinc/48/66/53/1049486653.db2.gz JKHYSTAMGRRDKC-UHFFFAOYSA-N -1 1 319.788 4.097 20 0 DIADMM C=Cc1cccc([N-]S(=O)(=O)c2cccc(C(C)C)c2)c1 ZINC001195159925 1049489463 /nfs/dbraw/zinc/48/94/63/1049489463.db2.gz WYMBLTXQGQDQFZ-UHFFFAOYSA-N -1 1 301.411 4.254 20 0 DIADMM CC1(C(=O)Nc2cccc([O-])c2Br)CCCCC1 ZINC000908708679 1049499792 /nfs/dbraw/zinc/49/97/92/1049499792.db2.gz ABDZPYKYXQGPNC-UHFFFAOYSA-N -1 1 312.207 4.064 20 0 DIADMM CC1=CC[C@](C)(C(=O)Nc2cccc([O-])c2Br)CC1 ZINC000908710495 1049501758 /nfs/dbraw/zinc/50/17/58/1049501758.db2.gz KNVWAOXJBYZZSC-HNNXBMFYSA-N -1 1 324.218 4.230 20 0 DIADMM [O-]c1cc(F)c(Nc2ccc(C(F)(F)F)nc2)cc1Cl ZINC001250020318 1049510630 /nfs/dbraw/zinc/51/06/30/1049510630.db2.gz KCJQLUKSBZNJHJ-UHFFFAOYSA-N -1 1 306.646 4.342 20 0 DIADMM CC[C@@H](C)c1ccc(NC(=O)c2cc([O-])cnc2Cl)cc1 ZINC001195298126 1049512738 /nfs/dbraw/zinc/51/27/38/1049512738.db2.gz XYEBKNFPXISLDQ-SNVBAGLBSA-N -1 1 304.777 4.206 20 0 DIADMM CC[C@H](C)c1ccc(NC(=O)c2cc([O-])cnc2Cl)cc1 ZINC001195298125 1049513007 /nfs/dbraw/zinc/51/30/07/1049513007.db2.gz XYEBKNFPXISLDQ-JTQLQIEISA-N -1 1 304.777 4.206 20 0 DIADMM O=C(Nc1cccc(C(F)(F)F)c1[O-])[C@@H]1CCc2ccccc21 ZINC001181761803 1049515592 /nfs/dbraw/zinc/51/55/92/1049515592.db2.gz VATDEBFNLGYFMJ-GFCCVEGCSA-N -1 1 321.298 4.080 20 0 DIADMM CCOC(=O)NC(=S)[N-]c1ccc2c(c1)oc1ccccc12 ZINC001195485118 1049535548 /nfs/dbraw/zinc/53/55/48/1049535548.db2.gz YGZVLQBFBLGCRT-UHFFFAOYSA-N -1 1 314.366 4.029 20 0 DIADMM C[C@H](NCc1ccc([O-])c(F)c1F)c1ccc(F)cc1Cl ZINC001182007857 1049563104 /nfs/dbraw/zinc/56/31/04/1049563104.db2.gz MBFSHSIOWWHNRW-QMMMGPOBSA-N -1 1 315.722 4.314 20 0 DIADMM CCCCC[C@@H](C)NC(=O)c1c([O-])cnc2ccc(Cl)cc21 ZINC001182091519 1049574279 /nfs/dbraw/zinc/57/42/79/1049574279.db2.gz MNDNCIZCAGFWGG-LLVKDONJSA-N -1 1 320.820 4.292 20 0 DIADMM Cc1ccc(CCCC(=O)Nc2cc([O-])c(F)cc2F)s1 ZINC000909981223 1049574877 /nfs/dbraw/zinc/57/48/77/1049574877.db2.gz AYNCPTIFTPFLSX-UHFFFAOYSA-N -1 1 311.353 4.002 20 0 DIADMM O=S(=O)([N-]c1ccccc1)c1ccc2cc(Cl)ccc2c1 ZINC001196411618 1049655110 /nfs/dbraw/zinc/65/51/10/1049655110.db2.gz CCEOOWXXORKOGS-UHFFFAOYSA-N -1 1 317.797 4.294 20 0 DIADMM Cc1cccc(NC(=S)Nc2cc(F)c([O-])c(F)c2)c1C ZINC001196418136 1049656121 /nfs/dbraw/zinc/65/61/21/1049656121.db2.gz OSFVFJYORMOKSA-UHFFFAOYSA-N -1 1 308.353 4.096 20 0 DIADMM Cc1cccc(NC(=S)Nc2cc(F)cc(F)c2[O-])c1C ZINC001196425854 1049657327 /nfs/dbraw/zinc/65/73/27/1049657327.db2.gz QKVXYYNRTUJTTE-UHFFFAOYSA-N -1 1 308.353 4.096 20 0 DIADMM CCOc1cc(F)c(Nc2ccnc(Cl)c2[O-])cc1Cl ZINC001250067726 1049687792 /nfs/dbraw/zinc/68/77/92/1049687792.db2.gz OSNOMTQEHFMJNX-UHFFFAOYSA-N -1 1 317.147 4.375 20 0 DIADMM CCCN(Cc1ccccc1F)Cc1ccc([O-])c(F)c1F ZINC001206689360 1049779681 /nfs/dbraw/zinc/77/96/81/1049779681.db2.gz WXVVSYATIOFJLQ-UHFFFAOYSA-N -1 1 309.331 4.222 20 0 DIADMM CC1(C)C=Cc2cccc(NCc3ccc([O-])c(F)c3F)c2O1 ZINC001206856184 1049814129 /nfs/dbraw/zinc/81/41/29/1049814129.db2.gz MUWPOOMHQCCGFL-UHFFFAOYSA-N -1 1 317.335 4.467 20 0 DIADMM [O-]c1cc(NC2=CCN(c3ccccc3)CC2)c(F)cc1Cl ZINC001209057454 1050032173 /nfs/dbraw/zinc/03/21/73/1050032173.db2.gz MDSMFIMFMSEVGR-UHFFFAOYSA-N -1 1 318.779 4.391 20 0 DIADMM CCCOc1ccc(Nc2cc3ccc([O-])cc3oc2=O)cc1 ZINC001209864764 1050097323 /nfs/dbraw/zinc/09/73/23/1050097323.db2.gz HFRDIONEJUYCOI-UHFFFAOYSA-N -1 1 311.337 4.031 20 0 DIADMM CC(C)(C)c1nnc([N-]c2ccc(C(F)(F)F)c(F)c2)o1 ZINC001209911867 1050104860 /nfs/dbraw/zinc/10/48/60/1050104860.db2.gz SWMJWNGFEKALLA-UHFFFAOYSA-N -1 1 303.259 4.269 20 0 DIADMM CC(C)Oc1ccccc1Nc1ccc(-n2ccc(=O)[n-]2)cc1 ZINC001210024446 1050124568 /nfs/dbraw/zinc/12/45/68/1050124568.db2.gz RBCSGZJILOJSLA-UHFFFAOYSA-N -1 1 309.369 4.109 20 0 DIADMM Cc1c(Cl)cc(Nc2cc(F)ccc2CO)c([O-])c1Cl ZINC001210184170 1050149860 /nfs/dbraw/zinc/14/98/60/1050149860.db2.gz SUFRBMXWBGNVCF-UHFFFAOYSA-N -1 1 316.159 4.382 20 0 DIADMM C[C@@H](Cc1ccc(F)cc1)c1nc(-c2ccc([O-])cc2F)no1 ZINC000771199781 1050224492 /nfs/dbraw/zinc/22/44/92/1050224492.db2.gz NNHBNSHXOIBMRM-JTQLQIEISA-N -1 1 316.307 4.067 20 0 DIADMM CC[C@H](NC(=O)c1cccc([O-])c1F)C(C)(C)c1ccccc1 ZINC001136921652 1050232132 /nfs/dbraw/zinc/23/21/32/1050232132.db2.gz KAMQGHJHBGYVEG-INIZCTEOSA-N -1 1 315.388 4.018 20 0 DIADMM [O-]c1ccc(Cl)c(Nc2ccc3ncncc3c2)c1Cl ZINC001210459481 1050254461 /nfs/dbraw/zinc/25/44/61/1050254461.db2.gz MTRQKXDNDHUTCA-UHFFFAOYSA-N -1 1 306.152 4.386 20 0 DIADMM C[C@H]1C[C@@H](c2ccccc2)CN1C(=O)c1c([O-])cccc1Cl ZINC000734555353 1050287344 /nfs/dbraw/zinc/28/73/44/1050287344.db2.gz PYDJKHGCLPGCCF-GXTWGEPZSA-N -1 1 315.800 4.064 20 0 DIADMM CN(C)C(=O)Nc1ccc(Nc2cc([O-])c(Cl)cc2F)cc1 ZINC001210635630 1050322440 /nfs/dbraw/zinc/32/24/40/1050322440.db2.gz YSUJKHSATRAQHR-UHFFFAOYSA-N -1 1 323.755 4.022 20 0 DIADMM [O-]c1ccc(Cl)c(Nc2cnc(C(F)(F)F)nc2)c1Cl ZINC001210671985 1050333724 /nfs/dbraw/zinc/33/37/24/1050333724.db2.gz SWYNKXSKPXDYAR-UHFFFAOYSA-N -1 1 324.089 4.251 20 0 DIADMM O=c1ccn(-c2ccc(Nc3cc4cc(F)ccc4o3)cc2)[n-]1 ZINC001210730450 1050352248 /nfs/dbraw/zinc/35/22/48/1050352248.db2.gz FKGFTMMPQSCDQU-UHFFFAOYSA-N -1 1 309.300 4.207 20 0 DIADMM [O-]c1c(F)c(F)ccc1Nc1ccc(OCC(F)(F)F)cc1 ZINC001210746330 1050361096 /nfs/dbraw/zinc/36/10/96/1050361096.db2.gz KAOWCEHPKVDFFS-UHFFFAOYSA-N -1 1 319.229 4.355 20 0 DIADMM CCOC(=O)c1nc(C2CC2)oc1[N-]c1ccc2ccccc2n1 ZINC001210813797 1050376816 /nfs/dbraw/zinc/37/68/16/1050376816.db2.gz NLATUBORRQKBHU-UHFFFAOYSA-N -1 1 323.352 4.021 20 0 DIADMM COc1ccc(C(F)(F)F)c(-c2cccc([O-])c2Cl)n1 ZINC001242798781 1050409460 /nfs/dbraw/zinc/40/94/60/1050409460.db2.gz ZQFYLHVJLUQBKB-UHFFFAOYSA-N -1 1 303.667 4.135 20 0 DIADMM COc1ncc(Nc2cc(Cl)c([O-])c(Cl)c2)cc1Cl ZINC001210927276 1050418573 /nfs/dbraw/zinc/41/85/73/1050418573.db2.gz SXUKPIOIPBTPDN-UHFFFAOYSA-N -1 1 319.575 4.500 20 0 DIADMM [O-]c1c(Cl)cc(Br)cc1Nc1nccs1 ZINC001210996180 1050441434 /nfs/dbraw/zinc/44/14/34/1050441434.db2.gz HWHVUEOUNCSFJO-UHFFFAOYSA-N -1 1 305.584 4.008 20 0 DIADMM Nc1cc(-c2cc(Cl)c([O-])c(Cl)c2)ncc1C(F)(F)F ZINC001242851376 1050478875 /nfs/dbraw/zinc/47/88/75/1050478875.db2.gz JZGJOPLTEHATES-UHFFFAOYSA-N -1 1 323.101 4.362 20 0 DIADMM CC(C)[C@H](NC(=O)c1cc2ccccc2cc1[O-])c1ccccn1 ZINC000736506746 1050478928 /nfs/dbraw/zinc/47/89/28/1050478928.db2.gz CODOJXODIFETTL-IBGZPJMESA-N -1 1 320.392 4.068 20 0 DIADMM [O-]c1cc(F)c(-c2cc(F)c(OC(F)F)c(F)c2)cc1F ZINC001211350090 1050554736 /nfs/dbraw/zinc/55/47/36/1050554736.db2.gz KXCXDDLKFHCGFY-UHFFFAOYSA-N -1 1 308.177 4.217 20 0 DIADMM [O-]c1cc(F)c(-c2ccnc3[nH]cc(C(F)(F)F)c32)cc1F ZINC001211352054 1050555032 /nfs/dbraw/zinc/55/50/32/1050555032.db2.gz HIGWQYLOGTVGDQ-UHFFFAOYSA-N -1 1 314.213 4.233 20 0 DIADMM CSc1ncc2cc(-c3cc(F)c([O-])cc3F)ccc2n1 ZINC001211350863 1050555350 /nfs/dbraw/zinc/55/53/50/1050555350.db2.gz WGHFQNYMNPNIKF-UHFFFAOYSA-N -1 1 304.321 4.003 20 0 DIADMM CCOc1ccc2cc(-c3cc(F)c([O-])cc3F)cnc2c1 ZINC001211359774 1050556223 /nfs/dbraw/zinc/55/62/23/1050556223.db2.gz LNUIBLCENDUFGV-UHFFFAOYSA-N -1 1 301.292 4.284 20 0 DIADMM [O-]c1cc(Cl)c(Nc2cccc(CO)c2F)cc1Cl ZINC001211440065 1050568951 /nfs/dbraw/zinc/56/89/51/1050568951.db2.gz UUBUSVXTXZSKJI-UHFFFAOYSA-N -1 1 302.132 4.074 20 0 DIADMM COc1cccc([C@H]2CCCN2Cc2cc(F)c([O-])cc2F)c1 ZINC001144657901 1050641495 /nfs/dbraw/zinc/64/14/95/1050641495.db2.gz MLMUYYXJTSXKPJ-QGZVFWFLSA-N -1 1 319.351 4.016 20 0 DIADMM CCOc1ccc(OCC)c(Nc2cc(F)c([O-])c(F)c2)c1 ZINC001213379290 1050643797 /nfs/dbraw/zinc/64/37/97/1050643797.db2.gz LOCNZPKPOOJBKS-UHFFFAOYSA-N -1 1 309.312 4.211 20 0 DIADMM Nc1cc(Cl)cc(Cl)c1Nc1cc(F)c([O-])c(F)c1 ZINC001213384474 1050643959 /nfs/dbraw/zinc/64/39/59/1050643959.db2.gz NZVHDBURZVWDEP-UHFFFAOYSA-N -1 1 305.111 4.303 20 0 DIADMM COc1ccccc1[C@H]1CCCN1Cc1cc(F)c([O-])cc1F ZINC001144667074 1050646922 /nfs/dbraw/zinc/64/69/22/1050646922.db2.gz RDJIUHIHZLAKKB-MRXNPFEDSA-N -1 1 319.351 4.016 20 0 DIADMM O=C([O-])c1ccsc1CN1CCC[C@@H]1c1cc(F)ccc1F ZINC001144677760 1050650499 /nfs/dbraw/zinc/65/04/99/1050650499.db2.gz BGROFEVKMVFKAK-CQSZACIVSA-N -1 1 323.364 4.062 20 0 DIADMM O=c1ccn(-c2ccc(Nc3ccc(C4CC4)cc3F)cc2)[n-]1 ZINC001213464323 1050662014 /nfs/dbraw/zinc/66/20/14/1050662014.db2.gz IALOBZRMYKAUSY-UHFFFAOYSA-N -1 1 309.344 4.338 20 0 DIADMM Cc1cncc(Nc2ccc(F)c(Br)c2[O-])c1C ZINC001213533996 1050682185 /nfs/dbraw/zinc/68/21/85/1050682185.db2.gz HETRJVGZKFQNKN-UHFFFAOYSA-N -1 1 311.154 4.049 20 0 DIADMM COc1ccc(OC(F)(F)F)c(-c2c(F)cc([O-])cc2F)c1 ZINC001241121927 1050775539 /nfs/dbraw/zinc/77/55/39/1050775539.db2.gz TUEBOTJMCRDVKQ-UHFFFAOYSA-N -1 1 320.213 4.245 20 0 DIADMM CC[C@@](C)(NC(=O)Cc1ccc([O-])c(Cl)c1)c1ccccc1 ZINC001146927445 1050851336 /nfs/dbraw/zinc/85/13/36/1050851336.db2.gz ZYBRJJBARZMNOO-GOSISDBHSA-N -1 1 317.816 4.030 20 0 DIADMM CSc1ccc(Cl)c(NC(=O)c2cc(F)ccc2[O-])c1 ZINC001147126221 1050859847 /nfs/dbraw/zinc/85/98/47/1050859847.db2.gz JPNWWNIFEJDCMS-UHFFFAOYSA-N -1 1 311.765 4.159 20 0 DIADMM Cc1scc(C(=O)Nc2cccc(C(F)(F)F)c2[O-])c1C ZINC001147530821 1050892034 /nfs/dbraw/zinc/89/20/34/1050892034.db2.gz MBPLXFLLHIYLHW-UHFFFAOYSA-N -1 1 315.316 4.342 20 0 DIADMM [O-]c1c(Nc2ccc(OC(F)(F)F)cc2O)ccc(F)c1F ZINC001214397676 1050892561 /nfs/dbraw/zinc/89/25/61/1050892561.db2.gz FWNCJYXQHVPNTI-UHFFFAOYSA-N -1 1 321.201 4.018 20 0 DIADMM [O-]c1c(F)cc(Nc2csc(Br)n2)cc1Cl ZINC001214482904 1050918236 /nfs/dbraw/zinc/91/82/36/1050918236.db2.gz UPVZVQMJOKQOML-UHFFFAOYSA-N -1 1 323.574 4.147 20 0 DIADMM COC(=O)c1ccc(Nc2cc(F)c([O-])c(Cl)c2)c(C)c1 ZINC001214486543 1050919916 /nfs/dbraw/zinc/91/99/16/1050919916.db2.gz MAGDHJRXRDHXJI-UHFFFAOYSA-N -1 1 309.724 4.023 20 0 DIADMM COC(=O)c1ccc(C)c(Nc2cc(F)c([O-])c(Cl)c2)c1 ZINC001214488311 1050920397 /nfs/dbraw/zinc/92/03/97/1050920397.db2.gz BHWNMMNCXLOWQY-UHFFFAOYSA-N -1 1 309.724 4.023 20 0 DIADMM CCOC(=O)c1ccc(Nc2cc(F)c([O-])c(Cl)c2)cc1 ZINC001214488358 1050920424 /nfs/dbraw/zinc/92/04/24/1050920424.db2.gz DMCAQLJERHHTHG-UHFFFAOYSA-N -1 1 309.724 4.105 20 0 DIADMM Cc1ccccc1-n1nccc1Nc1cc(F)c([O-])c(Cl)c1 ZINC001214485317 1050920577 /nfs/dbraw/zinc/92/05/77/1050920577.db2.gz ZSYWHIMWCSTXBH-UHFFFAOYSA-N -1 1 317.751 4.422 20 0 DIADMM O=c1ccc2c(Nc3cc(F)c([O-])c(Cl)c3)cccc2[nH]1 ZINC001214489739 1050922208 /nfs/dbraw/zinc/92/22/08/1050922208.db2.gz JDMBSFFXLANCHK-UHFFFAOYSA-N -1 1 304.708 4.182 20 0 DIADMM COC(=O)c1ccc(C)c(Nc2cc(F)c([O-])c(Cl)c2)c1C ZINC001214491817 1050923357 /nfs/dbraw/zinc/92/33/57/1050923357.db2.gz LGSFIOBFTCCXND-UHFFFAOYSA-N -1 1 323.751 4.332 20 0 DIADMM O=C([O-])c1cc(Cl)c(Nc2ccc3nccn3c2)c(Cl)c1 ZINC001214512323 1050929945 /nfs/dbraw/zinc/92/99/45/1050929945.db2.gz XGGKYALASGFOSH-UHFFFAOYSA-N -1 1 322.151 4.083 20 0 DIADMM COc1ccc(C(C)=O)c(Nc2c(Cl)ccc([O-])c2F)c1 ZINC001214563717 1050947481 /nfs/dbraw/zinc/94/74/81/1050947481.db2.gz ORWGFXZSVFVWEV-UHFFFAOYSA-N -1 1 309.724 4.140 20 0 DIADMM C[C@@H]1CN(C(=O)c2cccc(-c3ccccc3)c2[O-])C2(CC2)C1 ZINC001148866767 1050978985 /nfs/dbraw/zinc/97/89/85/1050978985.db2.gz QEUIEMJUXSRSSN-AWEZNQCLSA-N -1 1 307.393 4.074 20 0 DIADMM Cc1ccc(NC(=O)c2cccc(-c3ccccc3)c2[O-])cc1O ZINC001148870032 1050979492 /nfs/dbraw/zinc/97/94/92/1050979492.db2.gz OVGNRAFLYSAIDY-UHFFFAOYSA-N -1 1 319.360 4.326 20 0 DIADMM CCCC[C@H](CCC)NC(=O)c1ncc2ccccc2c1[O-] ZINC001148998769 1050984002 /nfs/dbraw/zinc/98/40/02/1050984002.db2.gz ZRJRCIDNVLEWOT-AWEZNQCLSA-N -1 1 300.402 4.029 20 0 DIADMM CC(=O)c1ccc(F)c(Nc2cc([O-])c(Cl)cc2F)c1F ZINC001214762601 1050995476 /nfs/dbraw/zinc/99/54/76/1050995476.db2.gz BBSVCMMQAPFGQE-UHFFFAOYSA-N -1 1 315.678 4.409 20 0 DIADMM O=C(Nc1ccc(Nc2ccccc2)cc1)c1ccc(O)cc1[O-] ZINC000586737003 1051013755 /nfs/dbraw/zinc/01/37/55/1051013755.db2.gz DQTCXZVWEWDIRG-UHFFFAOYSA-N -1 1 320.348 4.094 20 0 DIADMM COc1c(F)cc(Nc2ccc(F)c(F)c2[O-])cc1Cl ZINC001214975429 1051041219 /nfs/dbraw/zinc/04/12/19/1051041219.db2.gz XDFYUXHNVMPDKN-UHFFFAOYSA-N -1 1 303.667 4.215 20 0 DIADMM Cc1nsc([N-]c2c(Cl)cccc2NC(=O)C(C)(C)C)n1 ZINC001215046046 1051061446 /nfs/dbraw/zinc/06/14/46/1051061446.db2.gz WJFPZPLEICBYIJ-UHFFFAOYSA-N -1 1 324.837 4.228 20 0 DIADMM CC(C)Oc1ccc(F)c(F)c1Nc1cc(F)c([O-])c(F)c1 ZINC001215078667 1051071755 /nfs/dbraw/zinc/07/17/55/1051071755.db2.gz AELZWUVDVNCOHU-UHFFFAOYSA-N -1 1 315.266 4.479 20 0 DIADMM CCOc1ccc(-c2nc(-c3ccc(Cl)cc3)no2)c([O-])c1 ZINC001215241354 1051129513 /nfs/dbraw/zinc/12/95/13/1051129513.db2.gz SEUSYGOUBVPVJT-UHFFFAOYSA-N -1 1 316.744 4.161 20 0 DIADMM [O-]c1ccc(-c2nc(-c3cccc4cccnc43)no2)c(Cl)c1 ZINC001215345679 1051171688 /nfs/dbraw/zinc/17/16/88/1051171688.db2.gz DDMPUVJUXPILQA-UHFFFAOYSA-N -1 1 323.739 4.311 20 0 DIADMM [O-]c1ccc(-c2nc(-c3cc(F)cc(F)c3)no2)c(Cl)c1 ZINC001215343405 1051172745 /nfs/dbraw/zinc/17/27/45/1051172745.db2.gz WPZRBQMEFKMODJ-UHFFFAOYSA-N -1 1 308.671 4.041 20 0 DIADMM O=C(Nc1cccc(F)c1[O-])[C@H]1C[C@H]1c1cccc2ccccc21 ZINC001171632551 1051175552 /nfs/dbraw/zinc/17/55/52/1051175552.db2.gz FSVOFEPDTQRERA-HOTGVXAUSA-N -1 1 321.351 4.427 20 0 DIADMM Cc1cccc(-c2ccc(C(=O)Nc3cccc(F)c3[O-])n2C)c1 ZINC001171637592 1051194913 /nfs/dbraw/zinc/19/49/13/1051194913.db2.gz NZZWWTHHSCUJMU-UHFFFAOYSA-N -1 1 324.355 4.098 20 0 DIADMM CCCOc1ccc(F)c(Nc2c([O-])cc(F)cc2F)c1F ZINC001215569449 1051250040 /nfs/dbraw/zinc/25/00/40/1051250040.db2.gz XYGKVLGNTICCBA-UHFFFAOYSA-N -1 1 315.266 4.481 20 0 DIADMM Nc1cc(Cl)c(Cl)cc1Nc1cc(F)c([O-])cc1F ZINC001215573197 1051252599 /nfs/dbraw/zinc/25/25/99/1051252599.db2.gz GKHITUJYPXKJPD-UHFFFAOYSA-N -1 1 305.111 4.303 20 0 DIADMM [O-]c1cc(F)c(Nc2ccc(Cc3cccnc3)cc2)cc1F ZINC001215575998 1051253264 /nfs/dbraw/zinc/25/32/64/1051253264.db2.gz JKHHPSSIINPWPZ-UHFFFAOYSA-N -1 1 312.319 4.400 20 0 DIADMM [O-]c1cc(Nc2ccc(Cl)c(CO)c2F)c(F)cc1Cl ZINC001215607705 1051272245 /nfs/dbraw/zinc/27/22/45/1051272245.db2.gz BJQYGDCURLCKQD-UHFFFAOYSA-N -1 1 320.122 4.213 20 0 DIADMM [O-]c1cc(F)cc(F)c1Nc1ccc(C2CCOCC2)cc1 ZINC001212653466 1051331784 /nfs/dbraw/zinc/33/17/84/1051331784.db2.gz ZPVUDDAPLGMMOP-UHFFFAOYSA-N -1 1 305.324 4.308 20 0 DIADMM Cc1nc(C(F)(F)F)nc(-c2ccc(Cl)c([O-])c2)c1C ZINC001243576458 1051335374 /nfs/dbraw/zinc/33/53/74/1051335374.db2.gz OUFCSZRSNIGJSI-UHFFFAOYSA-N -1 1 302.683 4.138 20 0 DIADMM Cc1c(F)ccc(-c2noc(-c3ccc([O-])cc3F)n2)c1Cl ZINC001215826949 1051392504 /nfs/dbraw/zinc/39/25/04/1051392504.db2.gz YSNJLQQXBQNKRI-UHFFFAOYSA-N -1 1 322.698 4.349 20 0 DIADMM CC(C)(C)C(=O)Nc1ccccc1Nc1c([O-])cc(F)cc1F ZINC001215835113 1051399602 /nfs/dbraw/zinc/39/96/02/1051399602.db2.gz XJWRYUCRRQVDCG-UHFFFAOYSA-N -1 1 320.339 4.399 20 0 DIADMM [O-]c1cc(-c2nc(-c3cccc(F)c3Cl)no2)ccc1F ZINC001215838451 1051402876 /nfs/dbraw/zinc/40/28/76/1051402876.db2.gz DEWRLIUGWJCHLM-UHFFFAOYSA-N -1 1 308.671 4.041 20 0 DIADMM [O-]c1cc(-c2nc(-c3ccc(C(F)(F)F)cc3)no2)ccc1F ZINC001215838482 1051402934 /nfs/dbraw/zinc/40/29/34/1051402934.db2.gz DXIACJVOZPOKIJ-UHFFFAOYSA-N -1 1 324.233 4.267 20 0 DIADMM CSc1cc(F)c(Nc2cc(F)c([O-])cc2F)c(F)c1 ZINC001215843621 1051407380 /nfs/dbraw/zinc/40/73/80/1051407380.db2.gz KWCFCWOTWNPNJA-UHFFFAOYSA-N -1 1 303.280 4.414 20 0 DIADMM [O-]c1cc(-c2nc(-c3cc(F)ccc3Cl)no2)ccc1F ZINC001215842274 1051407651 /nfs/dbraw/zinc/40/76/51/1051407651.db2.gz GQTGDELHVMMHBV-UHFFFAOYSA-N -1 1 308.671 4.041 20 0 DIADMM [O-]c1cccc(-c2nc(-c3cccc(F)c3Cl)no2)c1F ZINC001215983945 1051502399 /nfs/dbraw/zinc/50/23/99/1051502399.db2.gz BVJNUEFQYURLKT-UHFFFAOYSA-N -1 1 308.671 4.041 20 0 DIADMM [O-]c1cccc(-c2nc(-c3ccc4sccc4c3)no2)c1F ZINC001215989384 1051507391 /nfs/dbraw/zinc/50/73/91/1051507391.db2.gz ZXTVZOVIJAENAX-UHFFFAOYSA-N -1 1 312.325 4.463 20 0 DIADMM Nc1c(F)c(F)c(F)cc1Nc1c(Cl)ccc([O-])c1Cl ZINC001216009870 1051520982 /nfs/dbraw/zinc/52/09/82/1051520982.db2.gz MKHLNHGJTXUMDY-UHFFFAOYSA-N -1 1 323.101 4.442 20 0 DIADMM CC(C)(C)c1nsc([N-]c2ccc(Cl)c3c[nH]nc32)n1 ZINC001216054429 1051553148 /nfs/dbraw/zinc/55/31/48/1051553148.db2.gz PCHDUDOPEXPBPQ-UHFFFAOYSA-N -1 1 307.810 4.109 20 0 DIADMM CC(C)c1ccc(-c2noc(-c3ncc(C(F)(F)F)[n-]3)n2)cc1 ZINC001212689697 1051569261 /nfs/dbraw/zinc/56/92/61/1051569261.db2.gz MXDGRPBVIMHYII-UHFFFAOYSA-N -1 1 322.290 4.269 20 0 DIADMM CC(C)c1ccc(-c2noc(-c3nc(C(F)(F)F)c[n-]3)n2)cc1 ZINC001212689697 1051569265 /nfs/dbraw/zinc/56/92/65/1051569265.db2.gz MXDGRPBVIMHYII-UHFFFAOYSA-N -1 1 322.290 4.269 20 0 DIADMM CC(C)Oc1ccc2cc([N-]c3nnco3)ccc2c1Cl ZINC001216167425 1051608286 /nfs/dbraw/zinc/60/82/86/1051608286.db2.gz FPFNRNHNDCFAHD-UHFFFAOYSA-N -1 1 303.749 4.407 20 0 DIADMM COc1c(Cl)ccc([O-])c1-c1nc(-c2ccccc2C)no1 ZINC001216306639 1051686275 /nfs/dbraw/zinc/68/62/75/1051686275.db2.gz NMDKSSGLYKJKLS-UHFFFAOYSA-N -1 1 316.744 4.080 20 0 DIADMM CC[C@@H](C(=O)Nc1ccc([O-])c(Cl)c1)c1ccc(OC)cc1 ZINC000182873226 1051704711 /nfs/dbraw/zinc/70/47/11/1051704711.db2.gz KOSNAOADSCLCDS-CQSZACIVSA-N -1 1 319.788 4.187 20 0 DIADMM Cc1cc2ccccc2nc1-c1noc(-c2cc([O-])cc(F)c2)n1 ZINC001216339503 1051706529 /nfs/dbraw/zinc/70/65/29/1051706529.db2.gz JMQUPXMDORNZFN-UHFFFAOYSA-N -1 1 321.311 4.105 20 0 DIADMM Cc1cc(Cl)ccc1-c1noc(-c2cc([O-])cc(F)c2)n1 ZINC001216340401 1051709225 /nfs/dbraw/zinc/70/92/25/1051709225.db2.gz XTQVQHANUJFEKL-UHFFFAOYSA-N -1 1 304.708 4.210 20 0 DIADMM CCOc1cc(C)c(C)cc1Nc1ccc(-n2ccc(=O)[n-]2)cc1 ZINC001216378729 1051734496 /nfs/dbraw/zinc/73/44/96/1051734496.db2.gz MLUMKFNTSXKYDK-UHFFFAOYSA-N -1 1 323.396 4.337 20 0 DIADMM Cc1cc([N-]c2nnc(C(C)C)o2)ccc1C(=O)OC(C)(C)C ZINC001216380935 1051736138 /nfs/dbraw/zinc/73/61/38/1051736138.db2.gz HFBLJZPIPVTGDN-UHFFFAOYSA-N -1 1 317.389 4.200 20 0 DIADMM [O-]c1c(Br)c(F)ccc1Nc1cccnc1C1CC1 ZINC001212740766 1051746207 /nfs/dbraw/zinc/74/62/07/1051746207.db2.gz RGMRLVZDKFICFJ-UHFFFAOYSA-N -1 1 323.165 4.310 20 0 DIADMM Cc1cc(F)cc(Cl)c1Nc1cc2ccc([O-])cc2oc1=O ZINC001216402479 1051746516 /nfs/dbraw/zinc/74/65/16/1051746516.db2.gz HENXEJMLBUJIJI-UHFFFAOYSA-N -1 1 319.719 4.343 20 0 DIADMM O=C(c1cc2ccccc2cc1[O-])N(Cc1ccccc1)C1CC1 ZINC000219058243 1051766926 /nfs/dbraw/zinc/76/69/26/1051766926.db2.gz JPWPGGOZCDSGAO-UHFFFAOYSA-N -1 1 317.388 4.350 20 0 DIADMM [O-]c1c(Cl)cc(Cl)cc1Nc1cc(F)cc(CO)c1 ZINC001212747596 1051777967 /nfs/dbraw/zinc/77/79/67/1051777967.db2.gz NTVUKNZPAFJJHE-UHFFFAOYSA-N -1 1 302.132 4.074 20 0 DIADMM O=c1oc2cc([O-])ccc2cc1Nc1cccc2ccccc21 ZINC001173796889 1051805263 /nfs/dbraw/zinc/80/52/63/1051805263.db2.gz PLLIMDUUQDOKKK-UHFFFAOYSA-N -1 1 303.317 4.395 20 0 DIADMM Clc1cccc(COc2cccc([N-]c3nnco3)c2)c1 ZINC001216572671 1051822955 /nfs/dbraw/zinc/82/29/55/1051822955.db2.gz ULCOOKRLOGMRFU-UHFFFAOYSA-N -1 1 301.733 4.046 20 0 DIADMM COc1c([N-]c2nnc(C(C)(C)C)o2)cccc1C(F)(F)F ZINC001216634032 1051842504 /nfs/dbraw/zinc/84/25/04/1051842504.db2.gz SPJLLVHTGHHDBN-UHFFFAOYSA-N -1 1 315.295 4.138 20 0 DIADMM COc1c(Nc2cc([O-])c(F)c(F)c2)cccc1C(F)(F)F ZINC001216637358 1051844315 /nfs/dbraw/zinc/84/43/15/1051844315.db2.gz TWPGITFAZMQCMJ-UHFFFAOYSA-N -1 1 319.229 4.441 20 0 DIADMM CC(C)(C)OC(=O)n1ccc([N-]c2cc(C3CCCC3)no2)n1 ZINC001216670905 1051859357 /nfs/dbraw/zinc/85/93/57/1051859357.db2.gz GHCPVNJKNWXWTG-UHFFFAOYSA-N -1 1 318.377 4.056 20 0 DIADMM CCN(C(=O)c1ccc([O-])c(F)c1)c1ccc2ccccc2c1 ZINC000767924311 1051862176 /nfs/dbraw/zinc/86/21/76/1051862176.db2.gz YBWVLONLSAEWOJ-UHFFFAOYSA-N -1 1 309.340 4.351 20 0 DIADMM [O-]c1c(Cl)cc(Cl)cc1Nc1ccc2c(c1)OCCO2 ZINC001173878743 1051885053 /nfs/dbraw/zinc/88/50/53/1051885053.db2.gz CDSGDRLJXNPHMG-UHFFFAOYSA-N -1 1 312.152 4.214 20 0 DIADMM Cc1ccc(-c2noc(-c3cc(C(F)(F)F)ccc3[O-])n2)cc1 ZINC001216831759 1051889835 /nfs/dbraw/zinc/88/98/35/1051889835.db2.gz BAMFBRFYZFGJIC-UHFFFAOYSA-N -1 1 320.270 4.436 20 0 DIADMM COc1ccc(Nc2cc(Cl)c([O-])cc2Cl)cc1OC ZINC001173889616 1051890303 /nfs/dbraw/zinc/89/03/03/1051890303.db2.gz LTKRTHDGNSWZCC-UHFFFAOYSA-N -1 1 314.168 4.460 20 0 DIADMM Cc1cc(F)ccc1-c1ccc(C[N-]c2nnc(C(F)F)o2)o1 ZINC000189290447 1051907342 /nfs/dbraw/zinc/90/73/42/1051907342.db2.gz ISEZGBSOCUFWPS-UHFFFAOYSA-N -1 1 323.274 4.327 20 0 DIADMM O=C(Nc1ccc(F)cc1[O-])c1ccc(SC(F)F)cc1 ZINC000768257667 1051908679 /nfs/dbraw/zinc/90/86/79/1051908679.db2.gz ITZLCEYTJRDIMK-UHFFFAOYSA-N -1 1 313.300 4.098 20 0 DIADMM Cc1cccc(-c2noc(-c3c(F)ccc([O-])c3F)n2)c1C ZINC001216922442 1051910754 /nfs/dbraw/zinc/91/07/54/1051910754.db2.gz PHVRWISCCDTLJM-UHFFFAOYSA-N -1 1 302.280 4.004 20 0 DIADMM Cc1ccc(-c2noc(-c3cc([O-])cc(F)c3F)n2)c(C)c1 ZINC001216922547 1051910963 /nfs/dbraw/zinc/91/09/63/1051910963.db2.gz BBICCHQICTZPBJ-UHFFFAOYSA-N -1 1 302.280 4.004 20 0 DIADMM Cc1c(Cl)cccc1-c1noc(-c2cc([O-])cc(F)c2F)n1 ZINC001216922558 1051911221 /nfs/dbraw/zinc/91/12/21/1051911221.db2.gz BHLUHZNBNLKDMK-UHFFFAOYSA-N -1 1 322.698 4.349 20 0 DIADMM Cc1cc(Cl)ccc1-c1noc(-c2c(C)cc(O)cc2[O-])n1 ZINC001216987601 1051926807 /nfs/dbraw/zinc/92/68/07/1051926807.db2.gz ZKEUUOUALYLJMQ-UHFFFAOYSA-N -1 1 316.744 4.085 20 0 DIADMM CCCN(CCc1cccs1)C(=O)c1c([O-])cccc1Cl ZINC000768530898 1051941027 /nfs/dbraw/zinc/94/10/27/1051941027.db2.gz OOOXOWKJIPOAFK-UHFFFAOYSA-N -1 1 323.845 4.202 20 0 DIADMM COc1cccc(Nc2cc(Cl)cc(Cl)c2[O-])c1OC ZINC001174017297 1051949927 /nfs/dbraw/zinc/94/99/27/1051949927.db2.gz GJBDMFKUHLFHEU-UHFFFAOYSA-N -1 1 314.168 4.460 20 0 DIADMM COc1cccc(Nc2cc(Cl)c([O-])cc2Cl)c1OC ZINC001174018015 1051950394 /nfs/dbraw/zinc/95/03/94/1051950394.db2.gz PIEJCTCVXDJVPV-UHFFFAOYSA-N -1 1 314.168 4.460 20 0 DIADMM CSc1cccc(NC(=O)Nc2ccc([O-])c(Cl)c2)c1 ZINC000190909688 1051955012 /nfs/dbraw/zinc/95/50/12/1051955012.db2.gz YUKXVCGSOZIQMG-UHFFFAOYSA-N -1 1 308.790 4.412 20 0 DIADMM Cc1nc(-c2noc(-c3ccc4ccccc4c3[O-])n2)ccc1F ZINC001217129549 1051966356 /nfs/dbraw/zinc/96/63/56/1051966356.db2.gz DDNNHBVWAHVFKE-UHFFFAOYSA-N -1 1 321.311 4.105 20 0 DIADMM Cc1nc(C(=O)[N-]c2cccc(Cl)c2SC(F)F)co1 ZINC000808345942 1052004181 /nfs/dbraw/zinc/00/41/81/1052004181.db2.gz WRODCNQMDTVJPJ-UHFFFAOYSA-N -1 1 318.732 4.203 20 0 DIADMM Cc1cccc(-c2noc(-c3c(O)cc4ccccc4c3[O-])n2)c1 ZINC001217452067 1052059826 /nfs/dbraw/zinc/05/98/26/1052059826.db2.gz BERZEMLQASUQJC-UHFFFAOYSA-N -1 1 318.332 4.276 20 0 DIADMM CCCC1CCC(N(C)C(=O)c2c([O-])cccc2Cl)CC1 ZINC001156748702 1052082189 /nfs/dbraw/zinc/08/21/89/1052082189.db2.gz ARYCTORBSFTNGQ-UHFFFAOYSA-N -1 1 309.837 4.477 20 0 DIADMM O=C(c1c([O-])cccc1Cl)N1CCC[C@H]1c1ccccc1 ZINC000769636734 1052084447 /nfs/dbraw/zinc/08/44/47/1052084447.db2.gz HJJIIZVXJBXFHE-AWEZNQCLSA-N -1 1 301.773 4.023 20 0 DIADMM CC(C)N(Cc1ccccc1)C(=O)c1c([O-])cccc1Cl ZINC000769652823 1052090933 /nfs/dbraw/zinc/09/09/33/1052090933.db2.gz NCMUHPCPDPUGIK-UHFFFAOYSA-N -1 1 303.789 4.096 20 0 DIADMM Cc1ccc2ccc(-c3nc(-c4ccccc4C)no3)c([O-])c2n1 ZINC001217582399 1052101462 /nfs/dbraw/zinc/10/14/62/1052101462.db2.gz NVVCHYLQOMENHJ-UHFFFAOYSA-N -1 1 317.348 4.274 20 0 DIADMM Cn1ncc2ccc(Nc3cc(Cl)cc(Cl)c3[O-])cc21 ZINC001174340450 1052106383 /nfs/dbraw/zinc/10/63/83/1052106383.db2.gz ALXUEFOMJHXEMP-UHFFFAOYSA-N -1 1 308.168 4.329 20 0 DIADMM Cn1cnc2ccc(Nc3cc(Cl)cc(Cl)c3[O-])cc21 ZINC001174348441 1052114059 /nfs/dbraw/zinc/11/40/59/1052114059.db2.gz DHJUXOTYTGYGIP-UHFFFAOYSA-N -1 1 308.168 4.329 20 0 DIADMM Cc1ccc(C[C@@H](C)N(C)C(=O)c2c([O-])cccc2Cl)cc1 ZINC000769897416 1052118061 /nfs/dbraw/zinc/11/80/61/1052118061.db2.gz QCBWZRUQKNIFKU-CYBMUJFWSA-N -1 1 317.816 4.057 20 0 DIADMM CCOc1cc(C(=O)Nc2ccc(C)cc2)cc(Cl)c1[O-] ZINC000193056343 1052142280 /nfs/dbraw/zinc/14/22/80/1052142280.db2.gz SVRXGFSUNYNMMW-UHFFFAOYSA-N -1 1 305.761 4.005 20 0 DIADMM CCOc1cc(C(=O)N(CC)C(CC)CC)cc(Cl)c1[O-] ZINC000494835923 1052146291 /nfs/dbraw/zinc/14/62/91/1052146291.db2.gz IDHDWUWRSLHZSE-UHFFFAOYSA-N -1 1 313.825 4.095 20 0 DIADMM O=C(Nc1ccc2c(c1)NCCC2)c1c([O-])ccc2ccccc21 ZINC001218906256 1052261049 /nfs/dbraw/zinc/26/10/49/1052261049.db2.gz VZKQWIBHFCMBGF-UHFFFAOYSA-N -1 1 318.376 4.156 20 0 DIADMM O=C(Nc1ccc([O-])c(Cl)c1)Nc1cccc(F)c1Cl ZINC000495340841 1052298558 /nfs/dbraw/zinc/29/85/58/1052298558.db2.gz AMLHGSAMRGEMFR-UHFFFAOYSA-N -1 1 315.131 4.482 20 0 DIADMM O=C(Nc1cc(Cl)c(F)c(Cl)c1)c1ccc([O-])cc1F ZINC000236569349 1052426123 /nfs/dbraw/zinc/42/61/23/1052426123.db2.gz HCTGADRGLYWGQA-UHFFFAOYSA-N -1 1 318.106 4.230 20 0 DIADMM [O-]c1ccc(-c2nc([C@H]3CCCc4ccccc43)no2)c(F)c1 ZINC000322836265 1052498137 /nfs/dbraw/zinc/49/81/37/1052498137.db2.gz OUYISFDJRDHHAU-AWEZNQCLSA-N -1 1 310.328 4.050 20 0 DIADMM COC(=O)c1nc2cc(-c3cc(Cl)cc(Cl)c3)ccc2[n-]1 ZINC001222593580 1052515566 /nfs/dbraw/zinc/51/55/66/1052515566.db2.gz WJNCFSYYHPWDST-UHFFFAOYSA-N -1 1 321.163 4.323 20 0 DIADMM COC(=O)c1nc2ccc(-c3cc(Cl)cc(Cl)c3)cc2[n-]1 ZINC001222593580 1052515570 /nfs/dbraw/zinc/51/55/70/1052515570.db2.gz WJNCFSYYHPWDST-UHFFFAOYSA-N -1 1 321.163 4.323 20 0 DIADMM Cc1c2[nH]cnc2ccc1-c1cc(C(=O)[O-])cc(C(F)(F)F)c1 ZINC001222610330 1052517300 /nfs/dbraw/zinc/51/73/00/1052517300.db2.gz HBBWCCIXDLKNNK-UHFFFAOYSA-N -1 1 320.270 4.255 20 0 DIADMM Cc1cc(-c2cc(C(=O)[O-])cc(C(F)(F)F)c2)cc2nc[nH]c21 ZINC001222610629 1052517588 /nfs/dbraw/zinc/51/75/88/1052517588.db2.gz QLLQOPNXGTYNDL-UHFFFAOYSA-N -1 1 320.270 4.255 20 0 DIADMM CC(C)C[C@H](C)C[C@H](CC(C)C)OCCCC[P@](=O)([O-])O ZINC001225023672 1052744926 /nfs/dbraw/zinc/74/49/26/1052744926.db2.gz ZPYPMXGKMCVLJR-HOTGVXAUSA-N -1 1 322.426 4.448 20 0 DIADMM O=C(CCn1ccc2ccccc21)Nc1ccc([O-])c(Cl)c1 ZINC000129563209 1052796506 /nfs/dbraw/zinc/79/65/06/1052796506.db2.gz BTNTWULBSPBVHP-UHFFFAOYSA-N -1 1 314.772 4.029 20 0 DIADMM CC(=O)c1c(O)cc([O-])cc1O[C@@H]1Cc2cccc3cccc1c23 ZINC001225678291 1052815794 /nfs/dbraw/zinc/81/57/94/1052815794.db2.gz FXBZQOLZCFLGHX-QGZVFWFLSA-N -1 1 320.344 4.130 20 0 DIADMM COc1cnc(=S)[n-]c1O[C@@H](C)c1cccc2ccccc21 ZINC001226242111 1052880135 /nfs/dbraw/zinc/88/01/35/1052880135.db2.gz HTTWMMUHNGEIKY-NSHDSACASA-N -1 1 312.394 4.067 20 0 DIADMM Cc1cc(=O)oc2cc([O-])cc(O[C@H]3CCC=CCCC3)c12 ZINC001226484325 1052901357 /nfs/dbraw/zinc/90/13/57/1052901357.db2.gz CUARFUCZUXEEMP-AWEZNQCLSA-N -1 1 300.354 4.075 20 0 DIADMM C[C@H](Oc1[n-]c(=S)ncc1F)c1ccc(Cl)c(Cl)c1 ZINC001227382323 1052986981 /nfs/dbraw/zinc/98/69/81/1052986981.db2.gz CSGVAAWLNJFYIW-LURJTMIESA-N -1 1 319.188 4.351 20 0 DIADMM CC(=O)c1cc(C)ccc1OC(=C([O-])c1ccco1)c1ccco1 ZINC001227085256 1052959504 /nfs/dbraw/zinc/95/95/04/1052959504.db2.gz CTFGPNDANFGDNC-IBGZPJMESA-N -1 1 324.332 4.387 20 0 DIADMM C[C@@H](Oc1[n-]c(=S)ncc1F)c1ccc(C(F)(F)F)cc1 ZINC001227383822 1052986948 /nfs/dbraw/zinc/98/69/48/1052986948.db2.gz RWIVXGZIANGSQH-SSDOTTSWSA-N -1 1 318.295 4.063 20 0 DIADMM [O-]c1cc(Cl)c(O[C@H]2COCc3ccccc32)cc1Cl ZINC001227641528 1053006191 /nfs/dbraw/zinc/00/61/91/1053006191.db2.gz OWKKKKBXHDTMSS-HNNXBMFYSA-N -1 1 311.164 4.349 20 0 DIADMM CN(Cc1nc2ccccc2s1)Cc1cccc(Cl)c1[O-] ZINC000179610736 1053018527 /nfs/dbraw/zinc/01/85/27/1053018527.db2.gz NANDVRIMYYYYRX-UHFFFAOYSA-N -1 1 318.829 4.287 20 0 DIADMM Cc1cccc2c1[C@@H](Oc1[n-]c(=S)nc3cnccc31)CC2 ZINC001227882611 1053025199 /nfs/dbraw/zinc/02/51/99/1053025199.db2.gz YMHUXUPSXVMPCW-AWEZNQCLSA-N -1 1 309.394 4.062 20 0 DIADMM C[C@@H]1C[C@@H](Oc2[n-]c(=S)nc3cnccc32)CC(C)(C)C1 ZINC001227880387 1053025281 /nfs/dbraw/zinc/02/52/81/1053025281.db2.gz APUVWFIXQWQMCS-GHMZBOCLSA-N -1 1 303.431 4.281 20 0 DIADMM C[C@H](Oc1[n-]c(=S)nc2cnccc21)c1c(F)cccc1F ZINC001227881982 1053025401 /nfs/dbraw/zinc/02/54/01/1053025401.db2.gz RZMURXWTJQVYSQ-QMMMGPOBSA-N -1 1 319.336 4.106 20 0 DIADMM Cc1ccc2c(c1)[C@@H](Oc1[n-]c(=S)nc3cnccc31)CC2 ZINC001227882144 1053025483 /nfs/dbraw/zinc/02/54/83/1053025483.db2.gz UCMJSHJWVRRQNC-HNNXBMFYSA-N -1 1 309.394 4.062 20 0 DIADMM Cc1ccc([C@@H](C)Oc2[n-]c(=S)nc3cnccc32)c(C)c1 ZINC001227885622 1053025739 /nfs/dbraw/zinc/02/57/39/1053025739.db2.gz NIUFVJCNPDBXJG-GFCCVEGCSA-N -1 1 311.410 4.444 20 0 DIADMM C[C@H]1CN(Cc2cccc(Cl)c2[O-])C[C@H](c2ccccc2)O1 ZINC000179854719 1053030868 /nfs/dbraw/zinc/03/08/68/1053030868.db2.gz XBIHJDHHIHXHJB-SUMWQHHRSA-N -1 1 317.816 4.008 20 0 DIADMM C[C@@H](Oc1cc([O-])ccc1C(=O)c1ccccc1)c1ccncc1 ZINC001228184739 1053051504 /nfs/dbraw/zinc/05/15/04/1053051504.db2.gz WINHGYFPFNBSJS-CQSZACIVSA-N -1 1 319.360 4.158 20 0 DIADMM CC(C)[C@@H]1CCCCCN1C(=O)NCc1ccc([O-])c(Cl)c1 ZINC001313237559 1053096576 /nfs/dbraw/zinc/09/65/76/1053096576.db2.gz ZHDSXBMHZHMFDG-HNNXBMFYSA-N -1 1 324.852 4.156 20 0 DIADMM CC(C)COc1ccc(Nc2ccc(-n3ccc(=O)[n-]3)cc2)cc1 ZINC001212290211 1053096835 /nfs/dbraw/zinc/09/68/35/1053096835.db2.gz OTVWDDIICQPZTR-UHFFFAOYSA-N -1 1 323.396 4.356 20 0 DIADMM CCCC[C@@H](NC(=O)NCc1ccc([O-])c(Cl)c1)C1CCC1 ZINC001313235484 1053096783 /nfs/dbraw/zinc/09/67/83/1053096783.db2.gz BGERKOZHLPUPRG-OAHLLOKOSA-N -1 1 324.852 4.204 20 0 DIADMM CC[C@@H](C)[C@H](C)N(C(=O)NCc1ccc([O-])c(Cl)c1)C1CC1 ZINC001313236707 1053097320 /nfs/dbraw/zinc/09/73/20/1053097320.db2.gz OLWLNUOJIRMBLD-NEPJUHHUSA-N -1 1 324.852 4.154 20 0 DIADMM CSc1c(F)cccc1[N-]C(=O)c1noc2c1CCCCC2 ZINC000617274642 1053118720 /nfs/dbraw/zinc/11/87/20/1053118720.db2.gz DLEFOVIADDIJEK-UHFFFAOYSA-N -1 1 320.389 4.057 20 0 DIADMM CCC(=O)c1c(O)cc([O-])cc1O[C@@H](C)c1cccc(F)c1F ZINC001228556828 1053134117 /nfs/dbraw/zinc/13/41/17/1053134117.db2.gz RYBUKWGGIAEOSX-VIFPVBQESA-N -1 1 322.307 4.109 20 0 DIADMM CCC(=O)c1c(O)cc([O-])cc1O[C@@H](C)c1ccc(C)cc1 ZINC001228557548 1053134414 /nfs/dbraw/zinc/13/44/14/1053134414.db2.gz XESIOLZGJHFMFX-LBPRGKRZSA-N -1 1 300.354 4.139 20 0 DIADMM CCC(=O)c1c(O)cc([O-])cc1O[C@H](C)CCc1ccccc1 ZINC001228556852 1053134489 /nfs/dbraw/zinc/13/44/89/1053134489.db2.gz SABKUVAOFKBGGM-CYBMUJFWSA-N -1 1 314.381 4.091 20 0 DIADMM CCC(=O)c1c(O)cc([O-])cc1O[C@@H](C)c1ccc(F)c(F)c1 ZINC001228556342 1053134508 /nfs/dbraw/zinc/13/45/08/1053134508.db2.gz NQYANBZVIPISJI-VIFPVBQESA-N -1 1 322.307 4.109 20 0 DIADMM CCC(=O)c1c(O)cc([O-])cc1O[C@H](C)c1ccccc1C ZINC001228556550 1053134522 /nfs/dbraw/zinc/13/45/22/1053134522.db2.gz PWXOIHXNYYTZRJ-GFCCVEGCSA-N -1 1 300.354 4.139 20 0 DIADMM CCC(=O)c1c(O)cc([O-])cc1O[C@H](C)c1ccccc1Cl ZINC001228559765 1053134548 /nfs/dbraw/zinc/13/45/48/1053134548.db2.gz GVDFIGPBGAGZIJ-SNVBAGLBSA-N -1 1 320.772 4.484 20 0 DIADMM CC[C@H](C)CC[C@@H](C)Oc1c([O-])c(OC)cc2ccc(=O)oc21 ZINC001229216359 1053275350 /nfs/dbraw/zinc/27/53/50/1053275350.db2.gz PTOFYSGJFGRJCO-NWDGAFQWSA-N -1 1 320.385 4.101 20 0 DIADMM CC[C@H](C)CC[C@H](C)Oc1c([O-])c(OC)cc2ccc(=O)oc21 ZINC001229216360 1053275456 /nfs/dbraw/zinc/27/54/56/1053275456.db2.gz PTOFYSGJFGRJCO-RYUDHWBXSA-N -1 1 320.385 4.101 20 0 DIADMM O=C1C[C@@H](c2ccccc2)Oc2cc([O-])cc(OC3CC=CC3)c21 ZINC001229231808 1053278994 /nfs/dbraw/zinc/27/89/94/1053278994.db2.gz YAPLBJFNJHEICO-KRWDZBQOSA-N -1 1 322.360 4.196 20 0 DIADMM CCCC[C@@H](C)Oc1cc(O)ccc1C(=O)c1ccc([O-])cc1 ZINC001229293676 1053294069 /nfs/dbraw/zinc/29/40/69/1053294069.db2.gz GYQJSTMHSVHSQB-CYBMUJFWSA-N -1 1 314.381 4.286 20 0 DIADMM CCC[C@@H](CC)Oc1cc(O)ccc1C(=O)c1ccc([O-])cc1 ZINC001229295086 1053294628 /nfs/dbraw/zinc/29/46/28/1053294628.db2.gz VIEXYCXNIDXJJW-MRXNPFEDSA-N -1 1 314.381 4.286 20 0 DIADMM O=C(Nc1ccc(SC(F)F)cc1)c1ccc([O-])cc1F ZINC000181823278 1053296013 /nfs/dbraw/zinc/29/60/13/1053296013.db2.gz KUJRVDYOWDRVNC-UHFFFAOYSA-N -1 1 313.300 4.098 20 0 DIADMM CC[C@H](C)[C@@H](C)Oc1cc(O)ccc1C(=O)c1ccc([O-])cc1 ZINC001229296257 1053296768 /nfs/dbraw/zinc/29/67/68/1053296768.db2.gz GSWVUHZJDDLUNY-QWHCGFSZSA-N -1 1 314.381 4.142 20 0 DIADMM Cc1cn2c(n1)[C@H](Oc1cc([O-])c(Cl)cc1Cl)CCC2 ZINC001229405769 1053313342 /nfs/dbraw/zinc/31/33/42/1053313342.db2.gz AXVWOYUZBUALHU-GFCCVEGCSA-N -1 1 313.184 4.118 20 0 DIADMM [O-]c1cc(OC[C@@H]2Cc3ccccc3O2)c(Cl)cc1Cl ZINC001229411521 1053315003 /nfs/dbraw/zinc/31/50/03/1053315003.db2.gz RASULPJZYQKVQX-JTQLQIEISA-N -1 1 311.164 4.082 20 0 DIADMM C[C@@H](Oc1cc([O-])c(Cl)cc1Cl)c1ncccc1F ZINC001229406135 1053315739 /nfs/dbraw/zinc/31/57/39/1053315739.db2.gz LDVSOWJGPHQVHS-SSDOTTSWSA-N -1 1 302.132 4.373 20 0 DIADMM CC(=O)[C@@H](Oc1cc([O-])c(Cl)cc1Cl)c1ccccc1 ZINC001229406335 1053315896 /nfs/dbraw/zinc/31/58/96/1053315896.db2.gz RCLAHJGYKXTGDR-OAHLLOKOSA-N -1 1 311.164 4.408 20 0 DIADMM [O-]c1cc(O[C@@H]2COCc3ccccc32)c(Cl)cc1Cl ZINC001229409591 1053316584 /nfs/dbraw/zinc/31/65/84/1053316584.db2.gz FMRDTEFYNODUGH-OAHLLOKOSA-N -1 1 311.164 4.349 20 0 DIADMM CC(C)CCOC(=O)[C@@H](C)Oc1cc([O-])c(Cl)cc1Cl ZINC001229405949 1053316725 /nfs/dbraw/zinc/31/67/25/1053316725.db2.gz FTDXXEQIIXDFOY-SECBINFHSA-N -1 1 321.200 4.056 20 0 DIADMM CC(C)CCOC(=O)[C@H](C)Oc1cc([O-])c(Cl)cc1Cl ZINC001229405950 1053316852 /nfs/dbraw/zinc/31/68/52/1053316852.db2.gz FTDXXEQIIXDFOY-VIFPVBQESA-N -1 1 321.200 4.056 20 0 DIADMM CCC[C@H](C)Oc1cc([O-])ccc1C(=O)Cc1ccc(O)cc1 ZINC001229427111 1053317507 /nfs/dbraw/zinc/31/75/07/1053317507.db2.gz IEAOWILGYSQFLH-ZDUSSCGKSA-N -1 1 314.381 4.091 20 0 DIADMM O=C(Cc1ccc(O)cc1)c1ccc([O-])cc1O[C@H]1C=CCCC1 ZINC001229434554 1053321161 /nfs/dbraw/zinc/32/11/61/1053321161.db2.gz WFCIXXKUHRMBCM-KRWDZBQOSA-N -1 1 324.376 4.011 20 0 DIADMM CCC(=O)c1ccc([O-])cc1O[C@@H](C)c1cccnc1Cl ZINC001229475028 1053331624 /nfs/dbraw/zinc/33/16/24/1053331624.db2.gz PRLNHYLREBZNIX-JTQLQIEISA-N -1 1 305.761 4.173 20 0 DIADMM CCC(=O)c1ccc([O-])cc1O[C@H]1CCc2cc(F)ccc21 ZINC001229477922 1053332456 /nfs/dbraw/zinc/33/24/56/1053332456.db2.gz RWDVYRLNAFHZCH-KRWDZBQOSA-N -1 1 300.329 4.190 20 0 DIADMM CCC(=O)c1ccc([O-])cc1O[C@H](C)COc1cccc(C)c1 ZINC001229477500 1053332634 /nfs/dbraw/zinc/33/26/34/1053332634.db2.gz NTMVQGBIXZJPQN-CQSZACIVSA-N -1 1 314.381 4.140 20 0 DIADMM CCC(=O)c1ccc([O-])cc1O[C@H](C)COc1ccc(C)cc1 ZINC001229477568 1053333103 /nfs/dbraw/zinc/33/31/03/1053333103.db2.gz OMASAWBUKIUEHE-CQSZACIVSA-N -1 1 314.381 4.140 20 0 DIADMM CCC(=O)c1ccc([O-])cc1O[C@@H](C)c1cccc(F)c1F ZINC001229475663 1053333238 /nfs/dbraw/zinc/33/32/38/1053333238.db2.gz DDCHZUKCGIBJIF-JTQLQIEISA-N -1 1 306.308 4.403 20 0 DIADMM CCC(=O)c1ccc([O-])cc1O[C@H](C)COc1ccccc1C ZINC001229476136 1053333447 /nfs/dbraw/zinc/33/34/47/1053333447.db2.gz GBPFLQYRCUWAEQ-CQSZACIVSA-N -1 1 314.381 4.140 20 0 DIADMM O=C(CC1CCCCC1)Nc1ccc(Br)c([O-])c1 ZINC001320676195 1053354120 /nfs/dbraw/zinc/35/41/20/1053354120.db2.gz QTGLZOMNFGSQQX-UHFFFAOYSA-N -1 1 312.207 4.064 20 0 DIADMM O=C(Cc1ccc([O-])c(Cl)c1)Nc1cc(F)cc(Cl)c1 ZINC001545737169 1053361262 /nfs/dbraw/zinc/36/12/62/1053361262.db2.gz BAOQVSQDMYYWFR-UHFFFAOYSA-N -1 1 314.143 4.019 20 0 DIADMM CSc1ccc([O-])c(C(=O)Nc2ccc(Cl)c(C)c2)c1 ZINC001300096846 1053394453 /nfs/dbraw/zinc/39/44/53/1053394453.db2.gz ZYERDSFCLJDHIS-UHFFFAOYSA-N -1 1 307.802 4.328 20 0 DIADMM O=C(/C=C/C1CCCCC1)Nc1ccc(Br)c([O-])c1 ZINC001321151780 1053395740 /nfs/dbraw/zinc/39/57/40/1053395740.db2.gz ZJDCBBPGPGDISN-RMKNXTFCSA-N -1 1 324.218 4.230 20 0 DIADMM C/C(=C/C(C)(C)C)C(=O)Nc1ccc(Br)c([O-])c1 ZINC001321277897 1053404792 /nfs/dbraw/zinc/40/47/92/1053404792.db2.gz PXDCVDHVELGRPP-HJWRWDBZSA-N -1 1 312.207 4.086 20 0 DIADMM CC(C)C[C@@H](C)CC(=O)Nc1ccc(Br)c([O-])c1 ZINC001321276975 1053405173 /nfs/dbraw/zinc/40/51/73/1053405173.db2.gz MAYLHYCBNZTPEJ-SNVBAGLBSA-N -1 1 314.223 4.166 20 0 DIADMM CC(C)C[C@@H](Oc1cccnc1-c1ncccc1[O-])C(C)C ZINC001231200291 1053698792 /nfs/dbraw/zinc/69/87/92/1053698792.db2.gz LGUBHTVIHSTIQN-MRXNPFEDSA-N -1 1 300.402 4.299 20 0 DIADMM C[C@@H](Oc1cccnc1-c1ncccc1[O-])c1ccccc1F ZINC001231200112 1053699643 /nfs/dbraw/zinc/69/96/43/1053699643.db2.gz JPEJEBIMZJZLPF-GFCCVEGCSA-N -1 1 310.328 4.128 20 0 DIADMM CC[C@@H](Oc1cccnc1-c1ncccc1[O-])c1ccccc1 ZINC001231200709 1053700375 /nfs/dbraw/zinc/70/03/75/1053700375.db2.gz STILRAZJLOAYPY-MRXNPFEDSA-N -1 1 306.365 4.379 20 0 DIADMM O=C(c1ccc([O-])cc1)c1ccccc1OC(C1CC1)C1CC1 ZINC001231229807 1053708810 /nfs/dbraw/zinc/70/88/10/1053708810.db2.gz FTZUTVCJEMHJDH-UHFFFAOYSA-N -1 1 308.377 4.191 20 0 DIADMM O=C(Nc1ccc(Br)c([O-])c1)C1(C2CCC2)CCC1 ZINC001326007963 1053742689 /nfs/dbraw/zinc/74/26/89/1053742689.db2.gz NZEYHMBBRILLGY-UHFFFAOYSA-N -1 1 324.218 4.064 20 0 DIADMM O=C([O-])c1ccc(F)c(CN2CCC[C@H]2c2cccc(F)c2)c1 ZINC001231457151 1053755346 /nfs/dbraw/zinc/75/53/46/1053755346.db2.gz FBZLIVYNQSOLSG-KRWDZBQOSA-N -1 1 317.335 4.000 20 0 DIADMM CN(Cc1ccc2ccccc2c1)Cc1cc(C(=O)[O-])ccc1F ZINC001231460576 1053759752 /nfs/dbraw/zinc/75/97/52/1053759752.db2.gz MKSWJFOJDZIZQS-UHFFFAOYSA-N -1 1 323.367 4.309 20 0 DIADMM C[C@@H](c1nc(-c2ccc([O-])c(F)c2)no1)c1ccc(F)cc1F ZINC001326492857 1053787527 /nfs/dbraw/zinc/78/75/27/1053787527.db2.gz KPOYDSJYXZLPTM-MRVPVSSYSA-N -1 1 320.270 4.011 20 0 DIADMM [O-]c1cc(CN2CCc3ccc(Cl)cc3C2)ccc1Cl ZINC001231733545 1053842482 /nfs/dbraw/zinc/84/24/82/1053842482.db2.gz XYFUNUKMVPFFQR-UHFFFAOYSA-N -1 1 308.208 4.257 20 0 DIADMM CC1(C)CN(C(=O)c2cc(Cl)ccc2[O-])[C@H]1c1ccccc1 ZINC000621173327 1053888703 /nfs/dbraw/zinc/88/87/03/1053888703.db2.gz XJSMWNRGUOULMY-INIZCTEOSA-N -1 1 315.800 4.269 20 0 DIADMM Cc1cccc2c1CCN2C(=O)c1ccc2ccccc2c1[O-] ZINC000621616009 1053989450 /nfs/dbraw/zinc/98/94/50/1053989450.db2.gz ZVQDDJFYJROPGT-UHFFFAOYSA-N -1 1 303.361 4.057 20 0 DIADMM CC(C)c1occc1C(=O)Nc1ccc(Br)c([O-])c1 ZINC001331332419 1054072110 /nfs/dbraw/zinc/07/21/10/1054072110.db2.gz BUVRPOWCIKRKGW-UHFFFAOYSA-N -1 1 324.174 4.123 20 0 DIADMM C[C@](NCc1ccc(Cl)cc1Cl)(C(=O)[O-])c1ccccc1 ZINC001331945555 1054102502 /nfs/dbraw/zinc/10/25/02/1054102502.db2.gz AETNDLRGZVRDGN-MRXNPFEDSA-N -1 1 324.207 4.083 20 0 DIADMM [O-]c1c(F)ccc(CN2CCC[C@@H]2c2cccc(F)c2)c1F ZINC001232934195 1054150417 /nfs/dbraw/zinc/15/04/17/1054150417.db2.gz BDWGBJHSJZJDTG-OAHLLOKOSA-N -1 1 307.315 4.147 20 0 DIADMM CCc1ccc(C(=O)N2CCCc3c(C)cc(C)cc32)c([O-])c1 ZINC000622348995 1054183282 /nfs/dbraw/zinc/18/32/82/1054183282.db2.gz HRXSZULFUSHDKA-UHFFFAOYSA-N -1 1 309.409 4.164 20 0 DIADMM CCOc1ccc(-c2nc(=O)c3sccc3[n-]2)cc1Cl ZINC000671192454 1054192001 /nfs/dbraw/zinc/19/20/01/1054192001.db2.gz DVUVFFWFMNUVHS-UHFFFAOYSA-N -1 1 306.774 4.116 20 0 DIADMM Cc1ccc([C@@]2(C)CN(Cc3ccc([S-])cc3)CCO2)cc1 ZINC001233262223 1054219901 /nfs/dbraw/zinc/21/99/01/1054219901.db2.gz WQEDXYHHBYRTKQ-LJQANCHMSA-N -1 1 313.466 4.031 20 0 DIADMM CC1(c2ccccc2)CC[NH+](Cc2c(F)ccc(O)c2F)CC1 ZINC001233397169 1054261029 /nfs/dbraw/zinc/26/10/29/1054261029.db2.gz NUHPYEDEJXTTJD-UHFFFAOYSA-N -1 1 317.379 4.224 20 0 DIADMM O=C(NC[C@@H]1CCCC(F)(F)C1)c1cc2ccccc2cc1[O-] ZINC000622583077 1054292691 /nfs/dbraw/zinc/29/26/91/1054292691.db2.gz JUCICYCQENWRTM-GFCCVEGCSA-N -1 1 319.351 4.101 20 0 DIADMM CC(C)CN(C(=O)c1ccccc1[O-])c1cccc(Cl)c1 ZINC000622666369 1054320819 /nfs/dbraw/zinc/32/08/19/1054320819.db2.gz VUTSENHIETWELO-UHFFFAOYSA-N -1 1 303.789 4.348 20 0 DIADMM CCCC(=O)c1ccc([O-])cc1O[C@H](C(C)=O)c1ccccc1 ZINC001233650121 1054321882 /nfs/dbraw/zinc/32/18/82/1054321882.db2.gz ICMYLBASVQUXJT-LJQANCHMSA-N -1 1 312.365 4.084 20 0 DIADMM CCCC(=O)c1ccc([O-])cc1OC[C@H](C)Oc1ccccc1 ZINC001233650496 1054322811 /nfs/dbraw/zinc/32/28/11/1054322811.db2.gz LEGNEJMIONDFEI-AWEZNQCLSA-N -1 1 314.381 4.221 20 0 DIADMM CCN(C(=O)c1ccc(C(F)(F)F)cc1[O-])C1CC(C)(C)C1 ZINC000622710465 1054342269 /nfs/dbraw/zinc/34/22/69/1054342269.db2.gz HCRHZSNMSLVXHL-UHFFFAOYSA-N -1 1 315.335 4.062 20 0 DIADMM CC[C@H](NC(=O)c1c([O-])cccc1F)c1ccc(Cl)cc1 ZINC001440820772 1054368703 /nfs/dbraw/zinc/36/87/03/1054368703.db2.gz PVZICVBLQZCMPT-ZDUSSCGKSA-N -1 1 307.752 4.066 20 0 DIADMM O=C(N[C@H](c1cccs1)C1CC1)c1ccc2ccccc2c1[O-] ZINC001440882538 1054373283 /nfs/dbraw/zinc/37/32/83/1054373283.db2.gz IXNPYAOJVMKPNG-KRWDZBQOSA-N -1 1 323.417 4.488 20 0 DIADMM CCCN(Cc1ccc(F)cc1)C(=O)c1cc(Cl)ccc1[O-] ZINC001441145051 1054384672 /nfs/dbraw/zinc/38/46/72/1054384672.db2.gz IXCYHBKFLPJSRE-UHFFFAOYSA-N -1 1 321.779 4.237 20 0 DIADMM CCN(Cc1cccc(Cl)c1)C(=O)c1c([O-])cccc1Cl ZINC001441156496 1054385242 /nfs/dbraw/zinc/38/52/42/1054385242.db2.gz VOSYCOBYCCNAGO-UHFFFAOYSA-N -1 1 324.207 4.361 20 0 DIADMM CC(C)(C)[C@H](NC(=O)c1cc(F)ccc1[O-])c1ccccc1 ZINC001441734541 1054396204 /nfs/dbraw/zinc/39/62/04/1054396204.db2.gz JUXMXOKVUROOIG-MRXNPFEDSA-N -1 1 301.361 4.049 20 0 DIADMM Cc1ccc2c(c1)CC[C@H]2NC(=O)c1ccc2ccccc2c1[O-] ZINC001442180524 1054411279 /nfs/dbraw/zinc/41/12/79/1054411279.db2.gz JNBTUQHBJSFEFN-LJQANCHMSA-N -1 1 317.388 4.271 20 0 DIADMM CCCCN(C(=O)c1ccc([O-])cc1F)[C@@H](C)c1ccc(C)o1 ZINC001442409391 1054421702 /nfs/dbraw/zinc/42/17/02/1054421702.db2.gz GHRJBDRSDGYALQ-ZDUSSCGKSA-N -1 1 319.376 4.436 20 0 DIADMM O=C([N-]O[C@H]1CCCCO1)C1(C2CCCCC2)CCCCC1 ZINC001442534863 1054423896 /nfs/dbraw/zinc/42/38/96/1054423896.db2.gz XPNLMWGZWZSLEZ-INIZCTEOSA-N -1 1 309.450 4.092 20 0 DIADMM CC(C)(C)C[C@H]([N-]C(=O)C(F)(F)C(F)F)c1ccc(F)cc1 ZINC001357334883 1054462168 /nfs/dbraw/zinc/46/21/68/1054462168.db2.gz ZDGQZFGFLREWAH-NSHDSACASA-N -1 1 323.305 4.320 20 0 DIADMM Cc1ccc([C@H]2CCCCN2C(=O)c2ccc(F)c([O-])c2)cc1 ZINC001444334693 1054473268 /nfs/dbraw/zinc/47/32/68/1054473268.db2.gz CYNMZROZEQUZKC-QGZVFWFLSA-N -1 1 313.372 4.207 20 0 DIADMM Cc1cnc(C(=O)N2CCCC[C@@H]2c2cccc(C)c2C)c([O-])c1 ZINC001444746187 1054487627 /nfs/dbraw/zinc/48/76/27/1054487627.db2.gz WLAAOIQSCNKAHT-QGZVFWFLSA-N -1 1 324.424 4.080 20 0 DIADMM C[C@H](NCc1cscn1)c1ccc(Cl)c(Cl)c1[O-] ZINC000185246739 1054487698 /nfs/dbraw/zinc/48/76/98/1054487698.db2.gz ZQXYMJAWDFJEBR-ZETCQYMHSA-N -1 1 303.214 4.006 20 0 DIADMM C[C@@H](NCc1cscn1)c1ccc(Cl)c(Cl)c1[O-] ZINC000185246758 1054488490 /nfs/dbraw/zinc/48/84/90/1054488490.db2.gz ZQXYMJAWDFJEBR-SSDOTTSWSA-N -1 1 303.214 4.006 20 0 DIADMM CC(C)CN(C(=O)c1cccc([O-])c1F)c1ccc(Cl)cc1 ZINC001445934495 1054520728 /nfs/dbraw/zinc/52/07/28/1054520728.db2.gz VSOLWQAXQPIWDD-UHFFFAOYSA-N -1 1 321.779 4.488 20 0 DIADMM C[C@H]1CCc2ccccc2[C@H]1NC(=O)c1cc(Cl)ccc1[O-] ZINC001446841686 1054546492 /nfs/dbraw/zinc/54/64/92/1054546492.db2.gz BRIXHVQRTJPIJK-GTNSWQLSSA-N -1 1 315.800 4.099 20 0 DIADMM CCC(CC)c1nnc([N-]C(=O)c2nc(C3CC3)cs2)s1 ZINC001347375689 1054567889 /nfs/dbraw/zinc/56/78/89/1054567889.db2.gz SGJASAHHPSGLDJ-UHFFFAOYSA-N -1 1 322.459 4.028 20 0 DIADMM CCC[C@@H]1CCCC[C@H]1CNC(=O)c1ccc(Cl)cc1[O-] ZINC001451465568 1054678788 /nfs/dbraw/zinc/67/87/88/1054678788.db2.gz RUNFPKNGEQKGNQ-OLZOCXBDSA-N -1 1 309.837 4.382 20 0 DIADMM C[C@H](C(=O)Nc1cc(F)cc(F)c1[O-])c1cc2ccccc2o1 ZINC001451757281 1054687754 /nfs/dbraw/zinc/68/77/54/1054687754.db2.gz QGLNYAROBPUJNX-VIFPVBQESA-N -1 1 317.291 4.159 20 0 DIADMM O=C(Nc1cc(F)cc(F)c1[O-])[C@@H]1CC[C@H]2CCCC[C@H]2C1 ZINC001451760540 1054687897 /nfs/dbraw/zinc/68/78/97/1054687897.db2.gz WKXOOTFOCNRDNP-GRYCIOLGSA-N -1 1 309.356 4.215 20 0 DIADMM CSc1cccnc1[N-]C(=O)c1oc2ccc(F)cc2c1C ZINC001452821273 1054717835 /nfs/dbraw/zinc/71/78/35/1054717835.db2.gz LMKHBNMHHOQPEN-UHFFFAOYSA-N -1 1 316.357 4.250 20 0 DIADMM CCc1oc2ccccc2c1CC(=O)Nc1c([O-])cccc1F ZINC001453009921 1054726191 /nfs/dbraw/zinc/72/61/91/1054726191.db2.gz GHPDYSLNAXHFMI-UHFFFAOYSA-N -1 1 313.328 4.021 20 0 DIADMM CC[C@@H]1CCC[C@H](C)N1C(=O)c1ccc(C(F)(F)F)c([O-])c1 ZINC001453892447 1054751508 /nfs/dbraw/zinc/75/15/08/1054751508.db2.gz SWMOWWWQPUYXQE-CMPLNLGQSA-N -1 1 315.335 4.204 20 0 DIADMM CC1(C)CN(C(=O)c2cccc([O-])c2F)c2ccc(Cl)cc21 ZINC001454593906 1054776193 /nfs/dbraw/zinc/77/61/93/1054776193.db2.gz KJBLYOWBBVNGOT-UHFFFAOYSA-N -1 1 319.763 4.123 20 0 DIADMM O=C(Nc1cccc(F)c1[O-])c1cccc(OC2CCCC2)c1 ZINC001454759522 1054782711 /nfs/dbraw/zinc/78/27/11/1054782711.db2.gz VGPITEOXAKFHHN-UHFFFAOYSA-N -1 1 315.344 4.105 20 0 DIADMM CCc1ccc([C@H](C)CC(=O)Nc2cccc(F)c2[O-])cc1 ZINC001454756475 1054782956 /nfs/dbraw/zinc/78/29/56/1054782956.db2.gz LOADSQKZWJDHAX-GFCCVEGCSA-N -1 1 301.361 4.226 20 0 DIADMM O=C(Nc1cccc(F)c1[O-])C1(Cc2cccc(Cl)c2)CC1 ZINC001454766936 1054783872 /nfs/dbraw/zinc/78/38/72/1054783872.db2.gz FIAXINOQFFAQDI-UHFFFAOYSA-N -1 1 319.763 4.146 20 0 DIADMM COc1ccccc1[C@H](C)NC(=O)c1cc2ccccc2cc1[O-] ZINC001454981800 1054786496 /nfs/dbraw/zinc/78/64/96/1054786496.db2.gz RPXMQTKGYLXZPH-ZDUSSCGKSA-N -1 1 321.376 4.045 20 0 DIADMM Cc1c(C(=O)[O-])ccc(-c2cccc(CN(C)C)c2F)c1Cl ZINC001236130517 1054963536 /nfs/dbraw/zinc/96/35/36/1054963536.db2.gz ZFOAXOUERKMYJL-UHFFFAOYSA-N -1 1 321.779 4.214 20 0 DIADMM Cc1cc2[nH]cnc2cc1-c1ccc(Cl)c(C(=O)[O-])c1F ZINC001236152064 1054970502 /nfs/dbraw/zinc/97/05/02/1054970502.db2.gz IGFVKYUTUAGWSM-UHFFFAOYSA-N -1 1 304.708 4.029 20 0 DIADMM Cc1cc(-c2ccc(Cl)c(C(=O)[O-])c2F)cc2nc[nH]c21 ZINC001236152879 1054972611 /nfs/dbraw/zinc/97/26/11/1054972611.db2.gz OOFJGPIFTZXPKM-UHFFFAOYSA-N -1 1 304.708 4.029 20 0 DIADMM COCc1cc(-c2c(F)ccc(C)c2[O-])nc(-c2ccccc2)n1 ZINC001236388970 1055088791 /nfs/dbraw/zinc/08/87/91/1055088791.db2.gz CHMAUDNKSXDCAK-UHFFFAOYSA-N -1 1 324.355 4.110 20 0 DIADMM Cc1ccc(F)c(-c2nc(C(F)F)nc3ccccc32)c1[O-] ZINC001236389470 1055089615 /nfs/dbraw/zinc/08/96/15/1055089615.db2.gz DQYZTSZMJLZTMA-UHFFFAOYSA-N -1 1 304.271 4.388 20 0 DIADMM Cc1nc(C)c(-c2ccc(-c3c(F)ccc(C)c3[O-])nn2)s1 ZINC001236391630 1055090007 /nfs/dbraw/zinc/09/00/07/1055090007.db2.gz MFEURMJZEBWFGG-UHFFFAOYSA-N -1 1 315.373 4.037 20 0 DIADMM Cc1ccc(F)c(-c2cc3c(nn2)CC[C@H](C(C)(C)C)C3)c1[O-] ZINC001236392751 1055090282 /nfs/dbraw/zinc/09/02/82/1055090282.db2.gz RPPLEAYYKNBOJK-ZDUSSCGKSA-N -1 1 314.404 4.448 20 0 DIADMM Cc1ccc(F)c(-c2ncnc3c2cccc3C(F)(F)F)c1[O-] ZINC001236391615 1055090778 /nfs/dbraw/zinc/09/07/78/1055090778.db2.gz LWMMQJRHYBHWNW-UHFFFAOYSA-N -1 1 322.261 4.469 20 0 DIADMM Cc1ccc(F)c(-c2cc(N(C)c3ccccc3)ncn2)c1[O-] ZINC001236391723 1055091263 /nfs/dbraw/zinc/09/12/63/1055091263.db2.gz OESZZGBCDIZFKM-UHFFFAOYSA-N -1 1 309.344 4.065 20 0 DIADMM Cc1ccc(F)c(-c2ncnc3[nH]c4cc(F)ccc4c32)c1[O-] ZINC001236401775 1055093841 /nfs/dbraw/zinc/09/38/41/1055093841.db2.gz CQFHNUJXZQVVNF-UHFFFAOYSA-N -1 1 311.291 4.070 20 0 DIADMM CCC(F)(F)C(C)(C)CNC(=O)c1ccc2ccccc2c1[O-] ZINC001587243058 1055248674 /nfs/dbraw/zinc/24/86/74/1055248674.db2.gz KLNOUIWDGHOOIM-UHFFFAOYSA-N -1 1 321.367 4.347 20 0 DIADMM O=C(Nc1cccc(F)c1[O-])C1CCC(c2ccccc2)CC1 ZINC001587389720 1055284504 /nfs/dbraw/zinc/28/45/04/1055284504.db2.gz QBVHDMLYKQIWJF-UHFFFAOYSA-N -1 1 313.372 4.444 20 0 DIADMM Cc1cc(NC(=O)c2cc3ccccc3cc2[O-])cnc1Cl ZINC001587408021 1055290406 /nfs/dbraw/zinc/29/04/06/1055290406.db2.gz BVTYUXKLDGALTH-UHFFFAOYSA-N -1 1 312.756 4.155 20 0 DIADMM O=C(N[C@@H]1CC[C@@H]2CCCC[C@@H]2C1)c1c([O-])cccc1Cl ZINC001587542808 1055325262 /nfs/dbraw/zinc/32/52/62/1055325262.db2.gz GAGBLYGCEXXVPJ-YNEHKIRRSA-N -1 1 307.821 4.134 20 0 DIADMM Cc1cc(NC(=O)c2cc3ccccc3cc2[O-])ccc1N(C)C ZINC001587662323 1055343425 /nfs/dbraw/zinc/34/34/25/1055343425.db2.gz UQMVTHNIVPWTAH-UHFFFAOYSA-N -1 1 320.392 4.172 20 0 DIADMM CC(C)(C)OCc1ccc(NC(=O)c2ccc([O-])cc2F)cc1 ZINC001587747878 1055356643 /nfs/dbraw/zinc/35/66/43/1055356643.db2.gz WSKMXDDCWMECAO-UHFFFAOYSA-N -1 1 317.360 4.099 20 0 DIADMM CN(Cc1cc(Cl)c([O-])cc1F)[C@@H]1CCc2ccccc21 ZINC001238151257 1055611885 /nfs/dbraw/zinc/61/18/85/1055611885.db2.gz AKTFQCUOMWSNRX-MRXNPFEDSA-N -1 1 305.780 4.304 20 0 DIADMM O=C(N[C@@H]1CCSc2ccccc21)c1cc(Cl)ccc1[O-] ZINC000032742446 1055654895 /nfs/dbraw/zinc/65/48/95/1055654895.db2.gz KCOCFDQVPZTQFG-CYBMUJFWSA-N -1 1 319.813 4.013 20 0 DIADMM CCC(=O)c1cccc(NC(=O)c2cc([O-])c3ccccc3c2)c1 ZINC000472352112 1055708695 /nfs/dbraw/zinc/70/86/95/1055708695.db2.gz SOFSYQYSSSMOPP-UHFFFAOYSA-N -1 1 319.360 4.390 20 0 DIADMM C[C@@H]([N-]C(=O)C(C)(F)F)c1ccc(Cl)c(Cl)c1Cl ZINC001565672877 1055717807 /nfs/dbraw/zinc/71/78/07/1055717807.db2.gz OJXIPUOWGDIAKP-RXMQYKEDSA-N -1 1 316.562 4.479 20 0 DIADMM CCCC[C@H](CCC)NC(=O)c1c([O-])cnc2c(F)cccc21 ZINC001566213951 1055750026 /nfs/dbraw/zinc/75/00/26/1055750026.db2.gz OOQGJEKVVSLZQX-LBPRGKRZSA-N -1 1 318.392 4.168 20 0 DIADMM CCCC[C@@H](CCC)NC(=O)c1c([O-])cnc2c(F)cccc21 ZINC001566213950 1055751102 /nfs/dbraw/zinc/75/11/02/1055751102.db2.gz OOQGJEKVVSLZQX-GFCCVEGCSA-N -1 1 318.392 4.168 20 0 DIADMM O=C(Nc1ccc([O-])c(Cl)c1)c1sccc1C(F)F ZINC001596820036 1055751303 /nfs/dbraw/zinc/75/13/03/1055751303.db2.gz QGDWDVCLWXUIDW-UHFFFAOYSA-N -1 1 303.717 4.297 20 0 DIADMM Cc1ccc(Oc2ccccc2)c(NC(=O)c2ccc([O-])cn2)c1 ZINC001566252423 1055757043 /nfs/dbraw/zinc/75/70/43/1055757043.db2.gz LVKMUBJKICKSRQ-UHFFFAOYSA-N -1 1 320.348 4.140 20 0 DIADMM Cc1cc(C)c(NC(=O)Cc2ccc([O-])c(Cl)c2)c(C)c1 ZINC001597046989 1055780733 /nfs/dbraw/zinc/78/07/33/1055780733.db2.gz SLEXVNCUWMCCQL-UHFFFAOYSA-N -1 1 303.789 4.152 20 0 DIADMM C[C@H](NC(=O)c1cc(F)ccc1[O-])c1cc2ccccc2s1 ZINC001567648205 1055811114 /nfs/dbraw/zinc/81/11/14/1055811114.db2.gz NUJNMZZNMARLEV-JTQLQIEISA-N -1 1 315.369 4.237 20 0 DIADMM CC[C@H](C)c1ncc(NC(=O)c2cc3ccccc3cc2[O-])cn1 ZINC001568093490 1055827691 /nfs/dbraw/zinc/82/76/91/1055827691.db2.gz SKFUIQPUIHHBKG-LBPRGKRZSA-N -1 1 321.380 4.101 20 0 DIADMM O=C(Nc1ccc2cc[nH]c2c1)c1ccc(C(F)(F)F)c([O-])c1 ZINC001568218687 1055832196 /nfs/dbraw/zinc/83/21/96/1055832196.db2.gz HRPQLOXJVOFRPE-UHFFFAOYSA-N -1 1 320.270 4.145 20 0 DIADMM CCc1ccc(N(CC(C)C)C(=O)c2ccc(F)c([O-])c2)cc1 ZINC001568618197 1055840717 /nfs/dbraw/zinc/84/07/17/1055840717.db2.gz GZPNMEGGZYVORH-UHFFFAOYSA-N -1 1 315.388 4.397 20 0 DIADMM CC(C)c1ccc2nc(-c3cc4ccccc4o3)[n-]c(=O)c2c1 ZINC000060797381 1055849803 /nfs/dbraw/zinc/84/98/03/1055849803.db2.gz WEHKGLQCFFLYQJ-UHFFFAOYSA-N -1 1 304.349 4.460 20 0 DIADMM Cc1cccc(F)c1NC(=O)c1ccc(C(F)(F)F)cc1[O-] ZINC001597859648 1055884510 /nfs/dbraw/zinc/88/45/10/1055884510.db2.gz SEKKRSXNMHNCKQ-UHFFFAOYSA-N -1 1 313.250 4.111 20 0 DIADMM CC1(C)CCC(C)(CNC(=O)c2c([O-])cccc2Cl)CC1 ZINC001570370319 1055898889 /nfs/dbraw/zinc/89/88/89/1055898889.db2.gz BSYPOBVZPUQQOW-UHFFFAOYSA-N -1 1 309.837 4.382 20 0 DIADMM CCc1ccc2occ(C(=O)Nc3cc(F)cc(F)c3[O-])c2c1 ZINC001570465833 1055903754 /nfs/dbraw/zinc/90/37/54/1055903754.db2.gz RATARYZYURZLBF-UHFFFAOYSA-N -1 1 317.291 4.231 20 0 DIADMM CCc1cccc(NC(=O)c2ccc3ccccc3c2[O-])c1O ZINC001598497459 1055955173 /nfs/dbraw/zinc/95/51/73/1055955173.db2.gz MLRMODUVTBUTFG-UHFFFAOYSA-N -1 1 307.349 4.066 20 0 DIADMM Cc1cc(F)c(C(=O)Nc2cc(F)c([O-])cc2Cl)c(F)c1 ZINC001598590698 1055958439 /nfs/dbraw/zinc/95/84/39/1055958439.db2.gz FVQLLGYZEQBCOG-UHFFFAOYSA-N -1 1 315.678 4.024 20 0 DIADMM CCCOc1cccc(C(=O)Nc2cc(F)c([O-])cc2Cl)c1 ZINC001598582622 1055958638 /nfs/dbraw/zinc/95/86/38/1055958638.db2.gz HHMRLIAAMWRKTO-UHFFFAOYSA-N -1 1 323.751 4.226 20 0 DIADMM O=C(Nc1cc(F)c([O-])cc1Cl)[C@H]1CSc2ccccc21 ZINC001598582670 1055958757 /nfs/dbraw/zinc/95/87/57/1055958757.db2.gz JDIYOGVBELBZGN-VIFPVBQESA-N -1 1 323.776 4.013 20 0 DIADMM CC[C@@H](NC(=O)c1cc(Cl)ccc1[O-])c1ccccc1F ZINC001583151230 1056028375 /nfs/dbraw/zinc/02/83/75/1056028375.db2.gz IOMAFQVTCOCBPV-CQSZACIVSA-N -1 1 307.752 4.066 20 0 DIADMM CC(C)[C@@H](NC(=O)c1cccc([O-])c1F)c1ccc(Cl)cc1 ZINC001540556268 1056042567 /nfs/dbraw/zinc/04/25/67/1056042567.db2.gz ZYLUOMHCZOFIBN-MRXNPFEDSA-N -1 1 321.779 4.312 20 0 DIADMM CC(C)[C@H](NC(=O)c1cccc([O-])c1F)c1ccc(Cl)cc1 ZINC001540556267 1056043201 /nfs/dbraw/zinc/04/32/01/1056043201.db2.gz ZYLUOMHCZOFIBN-INIZCTEOSA-N -1 1 321.779 4.312 20 0 DIADMM CCC(C)(C)C1CCC(NC(=O)c2ccc(F)c([O-])c2)CC1 ZINC001540651579 1056056849 /nfs/dbraw/zinc/05/68/49/1056056849.db2.gz BFYAHSQSEWLODJ-UHFFFAOYSA-N -1 1 307.409 4.256 20 0 DIADMM CC(C)(C)[C@H]1CCCC[C@H]1NC(=O)Cc1ccc([O-])c(Cl)c1 ZINC001540711685 1056066228 /nfs/dbraw/zinc/06/62/28/1056066228.db2.gz AMVSSRXGVDOZQW-DZGCQCFKSA-N -1 1 323.864 4.309 20 0 DIADMM CC(C)Cc1cccc([C@H](C)C(=O)Nc2c([O-])cccc2F)c1 ZINC000671784879 1056067352 /nfs/dbraw/zinc/06/73/52/1056067352.db2.gz BTJHEYHGRJMBDQ-ZDUSSCGKSA-N -1 1 315.388 4.472 20 0 DIADMM C[C@H](c1cccc(Cl)c1)N(C)C(=O)c1cccc([O-])c1F ZINC001540800067 1056079365 /nfs/dbraw/zinc/07/93/65/1056079365.db2.gz DQKSZYPRGRWZCO-SNVBAGLBSA-N -1 1 307.752 4.018 20 0 DIADMM O=C(Nc1ccccc1OC1CCCC1)c1ccc(F)c([O-])c1 ZINC001542072050 1056102710 /nfs/dbraw/zinc/10/27/10/1056102710.db2.gz IJVUAOGYKAJCBI-UHFFFAOYSA-N -1 1 315.344 4.105 20 0 DIADMM C[C@H](CNC(=O)c1ccc2ccccc2c1[O-])c1ccc(F)cc1 ZINC001542627951 1056145880 /nfs/dbraw/zinc/14/58/80/1056145880.db2.gz UWSVPLOFBSLUNH-CYBMUJFWSA-N -1 1 323.367 4.218 20 0 DIADMM CCCCN(Cc1ccccc1F)C(=O)c1ccc([O-])cc1F ZINC001542731776 1056153125 /nfs/dbraw/zinc/15/31/25/1056153125.db2.gz ODXLILVBVFTPIB-UHFFFAOYSA-N -1 1 319.351 4.113 20 0 DIADMM Cc1cnc(C)c(-c2ccc([C@H](C)[N-]C(=O)C(F)(F)F)cc2)c1 ZINC001239913162 1056153205 /nfs/dbraw/zinc/15/32/05/1056153205.db2.gz BRYHEJUCFZXKPA-NSHDSACASA-N -1 1 322.330 4.105 20 0 DIADMM CC[C@H](c1ccccc1)N(CC)C(=O)c1ccc([O-])cc1F ZINC001583865579 1056189982 /nfs/dbraw/zinc/18/99/82/1056189982.db2.gz RNLFELGEWQGEER-QGZVFWFLSA-N -1 1 301.361 4.145 20 0 DIADMM CC(C)(C)[C@H]1CCCC[C@H]1NC(=O)c1cc(Cl)ccc1[O-] ZINC001543514572 1056241894 /nfs/dbraw/zinc/24/18/94/1056241894.db2.gz VUTYTQHBPGUALN-UONOGXRCSA-N -1 1 309.837 4.380 20 0 DIADMM CC(C)(C)[C@@H]1CCCC[C@@H]1NC(=O)c1cc(Cl)ccc1[O-] ZINC001543514571 1056242116 /nfs/dbraw/zinc/24/21/16/1056242116.db2.gz VUTYTQHBPGUALN-KGLIPLIRSA-N -1 1 309.837 4.380 20 0 DIADMM CCCCC[C@H](CC)C(=O)Nc1ccc(-c2cc(=O)[nH][n-]2)cc1 ZINC001543591311 1056260589 /nfs/dbraw/zinc/26/05/89/1056260589.db2.gz JDSGUOPPYIHVBD-ZDUSSCGKSA-N -1 1 315.417 4.327 20 0 DIADMM O=C(c1c(F)ccc([O-])c1F)N1CCC[C@H](C2CCCCC2)C1 ZINC001301405335 1056264700 /nfs/dbraw/zinc/26/47/00/1056264700.db2.gz GISJAKWTQBGISE-ZDUSSCGKSA-N -1 1 323.383 4.103 20 0 DIADMM CC(C)c1ccc(C(=O)Nc2ccc3ncsc3c2)c([O-])c1 ZINC001584113351 1056266820 /nfs/dbraw/zinc/26/68/20/1056266820.db2.gz LJCUMDDNRDTYAA-UHFFFAOYSA-N -1 1 312.394 4.378 20 0 DIADMM CC(C)N(Cc1cccc(F)c1)C(=O)c1cc(Cl)ccc1[O-] ZINC001543759279 1056293472 /nfs/dbraw/zinc/29/34/72/1056293472.db2.gz PDONGNIASOCDJP-UHFFFAOYSA-N -1 1 321.779 4.236 20 0 DIADMM Cc1cccc2cc(C(=O)Nc3c([O-])cccc3F)sc21 ZINC000685435865 1056355563 /nfs/dbraw/zinc/35/55/63/1056355563.db2.gz SVXIVFBPMUEAER-UHFFFAOYSA-N -1 1 301.342 4.307 20 0 DIADMM Cc1ccccc1CC(C)(C)NC(=O)c1cc(Cl)ccc1[O-] ZINC001584602200 1056379148 /nfs/dbraw/zinc/37/91/48/1056379148.db2.gz MLKDWOACOBQZRX-UHFFFAOYSA-N -1 1 317.816 4.105 20 0 DIADMM Cc1nc(SC[C@@H]2CC[C@@H](c3ccccc3)C2)[n-]c(=O)c1C ZINC001613672342 1056398015 /nfs/dbraw/zinc/39/80/15/1056398015.db2.gz VSRABESFTWLGKZ-GDBMZVCRSA-N -1 1 314.454 4.475 20 0 DIADMM CCc1ccc(CCSc2nc(C)c(C3CC3)c(=O)[n-]2)cc1 ZINC001614794492 1056452792 /nfs/dbraw/zinc/45/27/92/1056452792.db2.gz YXCGCJZYTMINAE-UHFFFAOYSA-N -1 1 314.454 4.265 20 0 DIADMM O=C(Nc1cc(Cl)c([O-])c2ccccc12)[C@@H]1CC=CCC1 ZINC001585192909 1056504900 /nfs/dbraw/zinc/50/49/00/1056504900.db2.gz DFUDMJHPCZGQRZ-LLVKDONJSA-N -1 1 301.773 4.494 20 0 DIADMM O=C(Nc1cc(Cl)c([O-])c2ccccc12)[C@H]1CC=CCC1 ZINC001585192910 1056505012 /nfs/dbraw/zinc/50/50/12/1056505012.db2.gz DFUDMJHPCZGQRZ-NSHDSACASA-N -1 1 301.773 4.494 20 0 DIADMM Cc1ccc(C)c2sc(NC(=O)c3cc(F)ccc3[O-])nc21 ZINC001585250116 1056516067 /nfs/dbraw/zinc/51/60/67/1056516067.db2.gz HMJOJEVEUPKPPP-UHFFFAOYSA-N -1 1 316.357 4.010 20 0 DIADMM N#Cc1ccc(NC(=O)Nc2cccc(Cl)c2Cl)c([O-])c1 ZINC000034046143 1056564793 /nfs/dbraw/zinc/56/47/93/1056564793.db2.gz DQRKQLTUZBFHPB-UHFFFAOYSA-N -1 1 322.151 4.215 20 0 DIADMM CC(C)=Cc1ccc(F)cc1[N-]S(=O)(=O)c1ccccc1 ZINC001240633055 1056618959 /nfs/dbraw/zinc/61/89/59/1056618959.db2.gz RUZMGIIUFHURBM-UHFFFAOYSA-N -1 1 305.374 4.050 20 0 DIADMM [O-]c1ccc(F)cc1-c1cnc2cc(C(F)(F)F)ccc2n1 ZINC001240693210 1056645441 /nfs/dbraw/zinc/64/54/41/1056645441.db2.gz HEJOXDKVJJLYHS-UHFFFAOYSA-N -1 1 308.234 4.160 20 0 DIADMM [O-]c1ccc(F)cc1-c1cc2c(nn1)-c1ccccc1CCC2 ZINC001240695760 1056647397 /nfs/dbraw/zinc/64/73/97/1056647397.db2.gz QNFWVDBEDRVCSY-UHFFFAOYSA-N -1 1 306.340 4.144 20 0 DIADMM CC[C@H](C)[C@H]([N-]C(=O)C(F)(F)c1ccccc1C)C(F)(F)F ZINC001586211948 1056693731 /nfs/dbraw/zinc/69/37/31/1056693731.db2.gz HQLJVYZJANWZIX-CABZTGNLSA-N -1 1 323.305 4.180 20 0 DIADMM [O-]c1ccc(-c2ncnc3c2cccc3C(F)(F)F)cc1F ZINC001240782739 1056695258 /nfs/dbraw/zinc/69/52/58/1056695258.db2.gz HGGOMIFTIVPVSM-UHFFFAOYSA-N -1 1 308.234 4.160 20 0 DIADMM [O-]c1ccc(-c2ncccc2OCc2ccccc2F)cc1F ZINC001240786155 1056697777 /nfs/dbraw/zinc/69/77/77/1056697777.db2.gz OJOQLGRSKZDEMG-UHFFFAOYSA-N -1 1 313.303 4.311 20 0 DIADMM [O-]c1ccc(-c2nc(-c3ccccn3)nc3ccccc32)cc1F ZINC001240783686 1056697949 /nfs/dbraw/zinc/69/79/49/1056697949.db2.gz XYAVCMITJVBQHZ-UHFFFAOYSA-N -1 1 317.323 4.204 20 0 DIADMM CC[C@H](NC(=O)c1ccc(F)c([O-])c1)C(C)(C)c1ccccc1 ZINC001586671669 1056779351 /nfs/dbraw/zinc/77/93/51/1056779351.db2.gz PLBROZLSFWASNV-KRWDZBQOSA-N -1 1 315.388 4.018 20 0 DIADMM O=C(c1cc(Cl)ccc1[O-])N1CCC[C@H]1c1cccs1 ZINC001586844016 1056817412 /nfs/dbraw/zinc/81/74/12/1056817412.db2.gz READXLRGVPTSPO-LBPRGKRZSA-N -1 1 307.802 4.084 20 0 DIADMM [O-]c1c(Cl)cc(Cl)cc1Nc1cc(F)cc(F)c1O ZINC001212487685 1056819804 /nfs/dbraw/zinc/81/98/04/1056819804.db2.gz UDVQSQFQFRXOIF-UHFFFAOYSA-N -1 1 306.095 4.426 20 0 DIADMM O=C(N[C@@H]1CC[C@H]2CCC[C@H]2C1)c1ccc2ccccc2c1[O-] ZINC001617425278 1056830823 /nfs/dbraw/zinc/83/08/23/1056830823.db2.gz HLAKSSRNHJHZSU-VNQPRFMTSA-N -1 1 309.409 4.244 20 0 DIADMM Cc1ccc(-c2nc(C)c(Cc3ccccc3)c(C)n2)c([O-])c1 ZINC001241036141 1056834814 /nfs/dbraw/zinc/83/48/14/1056834814.db2.gz PEDPNJZTKBAGTN-UHFFFAOYSA-N -1 1 304.393 4.365 20 0 DIADMM CSc1ccc([O-])c(C(=O)Nc2ccc(F)c(Cl)c2)c1 ZINC001586956902 1056839125 /nfs/dbraw/zinc/83/91/25/1056839125.db2.gz BEBOHBGAEPTLJV-UHFFFAOYSA-N -1 1 311.765 4.159 20 0 DIADMM CC(C)c1cc2c(ncnc2-c2c(F)cc([O-])cc2F)s1 ZINC001241116945 1056904301 /nfs/dbraw/zinc/90/43/01/1056904301.db2.gz IXAULZWZRXQSOV-UHFFFAOYSA-N -1 1 306.337 4.466 20 0 DIADMM [O-]c1cc(F)c(-c2cc(OCc3ccccc3)ccn2)c(F)c1 ZINC001241118021 1056905067 /nfs/dbraw/zinc/90/50/67/1056905067.db2.gz CLPJNIWDPGJTKL-UHFFFAOYSA-N -1 1 313.303 4.311 20 0 DIADMM CCOC(OCC)c1ccc(-c2c(F)cc([O-])cc2F)cc1 ZINC001241122871 1056907133 /nfs/dbraw/zinc/90/71/33/1056907133.db2.gz OHHJZBLYSGWJGJ-UHFFFAOYSA-N -1 1 308.324 4.409 20 0 DIADMM Cc1ccnc(-c2cc(C)cc(-c3c(F)cc([O-])cc3F)n2)c1 ZINC001241121897 1056907147 /nfs/dbraw/zinc/90/71/47/1056907147.db2.gz ROMSOPQCEAAEEW-UHFFFAOYSA-N -1 1 312.319 4.411 20 0 DIADMM Cc1nc2sc3c(c2c(-c2c(F)ccc([O-])c2F)n1)CCC3 ZINC001241289973 1056998708 /nfs/dbraw/zinc/99/87/08/1056998708.db2.gz HNTDCYWLWCWLHE-UHFFFAOYSA-N -1 1 318.348 4.139 20 0 DIADMM Cc1ccc(C)c(-c2ccc(-c3c(F)ccc([O-])c3F)nn2)c1 ZINC001241290251 1056998735 /nfs/dbraw/zinc/99/87/35/1056998735.db2.gz NUSBKGBRRSIACL-UHFFFAOYSA-N -1 1 312.319 4.411 20 0 DIADMM COc1cc2ccnc(-c3c(F)ccc([O-])c3F)c2cc1F ZINC001241291812 1057000304 /nfs/dbraw/zinc/00/03/04/1057000304.db2.gz YAKFWKTVEYGSEU-UHFFFAOYSA-N -1 1 305.255 4.033 20 0 DIADMM Cc1ccc2ncc(-c3cc(C(F)(F)F)ccc3[O-])nc2c1 ZINC001242131337 1057273777 /nfs/dbraw/zinc/27/37/77/1057273777.db2.gz HTTJEILSFYYKHX-UHFFFAOYSA-N -1 1 304.271 4.330 20 0 DIADMM [O-]c1ccc(C(F)(F)F)cc1-c1nc(C2CC2)nc2[nH]ccc21 ZINC001242133907 1057274466 /nfs/dbraw/zinc/27/44/66/1057274466.db2.gz NUHMGTIJUDJGKT-UHFFFAOYSA-N -1 1 319.286 4.178 20 0 DIADMM [O-]c1ccc(C(F)(F)F)cc1-c1ccc(-c2ccco2)nn1 ZINC001242134233 1057274745 /nfs/dbraw/zinc/27/47/45/1057274745.db2.gz UQPWNUXMKSXNQT-UHFFFAOYSA-N -1 1 306.243 4.128 20 0 DIADMM Cc1csc2c1ncnc2-c1ccc([O-])c(C(F)(F)F)c1 ZINC001242150944 1057280607 /nfs/dbraw/zinc/28/06/07/1057280607.db2.gz AMBLQWPEEOQDKE-UHFFFAOYSA-N -1 1 310.300 4.391 20 0 DIADMM Cc1ccc2ncnc(-c3ccc([O-])c(C(F)(F)F)c3)c2c1 ZINC001242151833 1057280876 /nfs/dbraw/zinc/28/08/76/1057280876.db2.gz VCBYRMKARIKNPR-UHFFFAOYSA-N -1 1 304.271 4.330 20 0 DIADMM COc1cccc2ncnc(-c3ccc([O-])c(C(F)(F)F)c3)c21 ZINC001242152931 1057281654 /nfs/dbraw/zinc/28/16/54/1057281654.db2.gz OAWSUJWAYCGOOM-UHFFFAOYSA-N -1 1 320.270 4.030 20 0 DIADMM [O-]c1ccc(-c2ncccc2-n2cccc2)cc1C(F)(F)F ZINC001242152398 1057281878 /nfs/dbraw/zinc/28/18/78/1057281878.db2.gz DVVSVQGWZZWMAX-UHFFFAOYSA-N -1 1 304.271 4.264 20 0 DIADMM COc1nc(-c2ccc([O-])c(C(F)(F)F)c2)nc2ccccc21 ZINC001242153212 1057281914 /nfs/dbraw/zinc/28/19/14/1057281914.db2.gz UCJNJNFLDMFIAJ-UHFFFAOYSA-N -1 1 320.270 4.030 20 0 DIADMM CCOC(=O)c1nc2cc(-c3ccccc3OC(C)C)ccc2[n-]1 ZINC001242225480 1057300622 /nfs/dbraw/zinc/30/06/22/1057300622.db2.gz VIIRIBUZZCCPHN-UHFFFAOYSA-N -1 1 324.380 4.194 20 0 DIADMM CCOC(=O)c1nc2ccc(-c3ccccc3OC(C)C)cc2[n-]1 ZINC001242225480 1057300627 /nfs/dbraw/zinc/30/06/27/1057300627.db2.gz VIIRIBUZZCCPHN-UHFFFAOYSA-N -1 1 324.380 4.194 20 0 DIADMM CCOc1cc(Nc2cc([O-])c(F)c(F)c2)c(F)cc1F ZINC001212531565 1057327472 /nfs/dbraw/zinc/32/74/72/1057327472.db2.gz JDDMJOOIXMGQLQ-UHFFFAOYSA-N -1 1 301.239 4.091 20 0 DIADMM CCOc1cc(Nc2cc(F)c([O-])cc2F)c(F)cc1F ZINC001212532638 1057331123 /nfs/dbraw/zinc/33/11/23/1057331123.db2.gz NJHZCIRHTNIFLZ-UHFFFAOYSA-N -1 1 301.239 4.091 20 0 DIADMM CCOc1cc(Nc2ccc(F)c(F)c2[O-])c(F)cc1F ZINC001212532416 1057331546 /nfs/dbraw/zinc/33/15/46/1057331546.db2.gz CBDDCKWOIINBQK-UHFFFAOYSA-N -1 1 301.239 4.091 20 0 DIADMM COc1cc2nccc(-c3cccc(Cl)c3[O-])c2cc1OC ZINC001242364557 1057346247 /nfs/dbraw/zinc/34/62/47/1057346247.db2.gz NHEZBIBDUXWHOA-UHFFFAOYSA-N -1 1 315.756 4.278 20 0 DIADMM CCOC(=O)c1cc2ccc(-c3cccc(Cl)c3[O-])cc2[nH]1 ZINC001242364118 1057346668 /nfs/dbraw/zinc/34/66/68/1057346668.db2.gz CLCTXFMTPFATBY-UHFFFAOYSA-N -1 1 315.756 4.371 20 0 DIADMM O=c1ccc(-c2cccc(Cl)c2[O-])cn1-c1cccc(F)c1 ZINC001242366203 1057347349 /nfs/dbraw/zinc/34/73/49/1057347349.db2.gz RUGBKIQAOPKWRO-UHFFFAOYSA-N -1 1 315.731 4.003 20 0 DIADMM CCOC(=O)c1cc(F)c(F)cc1-c1cccc(Cl)c1[O-] ZINC001242365707 1057347397 /nfs/dbraw/zinc/34/73/97/1057347397.db2.gz IPHOPTHPICEPHU-UHFFFAOYSA-N -1 1 312.699 4.168 20 0 DIADMM CCOC(=O)c1cc2cccc(-c3cccc(Cl)c3[O-])c2[nH]1 ZINC001242365884 1057347844 /nfs/dbraw/zinc/34/78/44/1057347844.db2.gz AKYQOHATSCJKRJ-UHFFFAOYSA-N -1 1 315.756 4.371 20 0 DIADMM CC1(C)CC(=O)Nc2ccc(-c3cccc(Cl)c3[O-])cc21 ZINC001242364826 1057347947 /nfs/dbraw/zinc/34/79/47/1057347947.db2.gz QSODUFOIZKIMAU-UHFFFAOYSA-N -1 1 301.773 4.332 20 0 DIADMM COC(=O)c1nccc2c1cccc2-c1cccc(Cl)c1[O-] ZINC001242367099 1057348268 /nfs/dbraw/zinc/34/82/68/1057348268.db2.gz INACGINFIMUCJB-UHFFFAOYSA-N -1 1 313.740 4.047 20 0 DIADMM CC1(C)Cc2cccc(-c3cccc(Cl)c3[O-])c2NC1=O ZINC001242367256 1057348846 /nfs/dbraw/zinc/34/88/46/1057348846.db2.gz HVQUZQBDMMSDTI-UHFFFAOYSA-N -1 1 301.773 4.233 20 0 DIADMM O=C([O-])c1cccc(-c2cccc3nc(C(F)(F)F)[nH]c32)c1F ZINC001242381533 1057354316 /nfs/dbraw/zinc/35/43/16/1057354316.db2.gz CXSTXLWKVFSMAP-UHFFFAOYSA-N -1 1 324.233 4.086 20 0 DIADMM CCOC(=O)c1nc2ccc(-c3cccc(F)c3Cl)cc2[n-]1 ZINC001242575202 1057411468 /nfs/dbraw/zinc/41/14/68/1057411468.db2.gz ZUULIVAQCJQLFD-UHFFFAOYSA-N -1 1 318.735 4.199 20 0 DIADMM CCOC(=O)c1nc2cc(-c3cccc(F)c3Cl)ccc2[n-]1 ZINC001242575202 1057411473 /nfs/dbraw/zinc/41/14/73/1057411473.db2.gz ZUULIVAQCJQLFD-UHFFFAOYSA-N -1 1 318.735 4.199 20 0 DIADMM O=C(Nc1c([O-])cccc1F)c1ccc(-c2ccco2)s1 ZINC000676051477 1057444683 /nfs/dbraw/zinc/44/46/83/1057444683.db2.gz YZVYUFRWOSRVTF-UHFFFAOYSA-N -1 1 303.314 4.105 20 0 DIADMM Cc1cccc(-c2cncc(C(=O)Nc3c([O-])cccc3F)c2)c1 ZINC000676151508 1057452908 /nfs/dbraw/zinc/45/29/08/1057452908.db2.gz LUKYHRCKNXYFGA-UHFFFAOYSA-N -1 1 322.339 4.154 20 0 DIADMM Cc1nc2ccc(-c3cccc([O-])c3Cl)nc2n1C(C)C ZINC001242797430 1057479595 /nfs/dbraw/zinc/47/95/95/1057479595.db2.gz INIBHTVNUBUHHB-UHFFFAOYSA-N -1 1 301.777 4.347 20 0 DIADMM COc1cc(OC)c2ccnc(-c3cccc([O-])c3Cl)c2c1 ZINC001242797893 1057479836 /nfs/dbraw/zinc/47/98/36/1057479836.db2.gz OMDJYCLWQNZYOG-UHFFFAOYSA-N -1 1 315.756 4.278 20 0 DIADMM COC(=O)C(C)(C)c1cccc(-c2cccc([O-])c2Cl)c1 ZINC001242799406 1057480631 /nfs/dbraw/zinc/48/06/31/1057480631.db2.gz JRJDRFFDPGHYMM-UHFFFAOYSA-N -1 1 304.773 4.163 20 0 DIADMM CCOC(=O)CCc1ccc(-c2cccc([O-])c2Cl)cc1 ZINC001242799837 1057480772 /nfs/dbraw/zinc/48/07/72/1057480772.db2.gz FLRSTTXBVOASTP-UHFFFAOYSA-N -1 1 304.773 4.208 20 0 DIADMM [O-]c1cccc(-c2cnc(OCc3ccccc3)cn2)c1Cl ZINC001242800030 1057480840 /nfs/dbraw/zinc/48/08/40/1057480840.db2.gz BLHKUMCTBPIKFR-UHFFFAOYSA-N -1 1 312.756 4.082 20 0 DIADMM [O-]c1cccc(-c2cncc(-c3ccc(F)cc3)n2)c1Cl ZINC001242799435 1057480874 /nfs/dbraw/zinc/48/08/74/1057480874.db2.gz KTXSZDIBKNMFAS-UHFFFAOYSA-N -1 1 300.720 4.309 20 0 DIADMM CCOC(=O)c1cc2c(cccc2-c2cccc([O-])c2Cl)[nH]1 ZINC001242799755 1057480985 /nfs/dbraw/zinc/48/09/85/1057480985.db2.gz APQYBZRSJFVQJZ-UHFFFAOYSA-N -1 1 315.756 4.371 20 0 DIADMM CC(C)(C)OC(=O)Nc1cc(-c2cccc([O-])c2Cl)ccn1 ZINC001242800297 1057482083 /nfs/dbraw/zinc/48/20/83/1057482083.db2.gz MKCLZIVRXGWZNM-UHFFFAOYSA-N -1 1 320.776 4.455 20 0 DIADMM CC[C@@H](C(=O)OC)c1ccc(-c2cccc([O-])c2Cl)cc1 ZINC001242802273 1057482829 /nfs/dbraw/zinc/48/28/29/1057482829.db2.gz DRMQJTGHTNXBQO-CYBMUJFWSA-N -1 1 304.773 4.379 20 0 DIADMM O=c1c(-c2cccc([O-])c2Cl)cccn1-c1ccc(F)cc1 ZINC001242802324 1057483056 /nfs/dbraw/zinc/48/30/56/1057483056.db2.gz WXUQZSQLBMULRA-UHFFFAOYSA-N -1 1 315.731 4.003 20 0 DIADMM COC(=O)C1(c2ccc(-c3cccc([O-])c3Cl)cc2)CCC1 ZINC001242802218 1057483236 /nfs/dbraw/zinc/48/32/36/1057483236.db2.gz BFILFLXLVLXJKU-UHFFFAOYSA-N -1 1 316.784 4.307 20 0 DIADMM COC(=O)c1cc(-c2cccc([O-])c2Cl)cc2cccnc21 ZINC001242802327 1057483465 /nfs/dbraw/zinc/48/34/65/1057483465.db2.gz XBQLASHTJVQBGO-UHFFFAOYSA-N -1 1 313.740 4.047 20 0 DIADMM Cc1ccc(-c2nc3c(ncnc3-c3ccc(F)c([O-])c3)o2)cc1 ZINC001243048283 1057557330 /nfs/dbraw/zinc/55/73/30/1057557330.db2.gz NUODNXNRFLWNGK-UHFFFAOYSA-N -1 1 321.311 4.105 20 0 DIADMM [O-]c1cc(-c2ncc(F)c(Oc3ccc(F)cc3)n2)ccc1F ZINC001243046732 1057557363 /nfs/dbraw/zinc/55/73/63/1057557363.db2.gz HQHFQRIACKLKJX-UHFFFAOYSA-N -1 1 318.254 4.059 20 0 DIADMM Cc1cnc(-c2ccc(F)c([O-])c2)nc1-c1c(F)cccc1F ZINC001243050645 1057558829 /nfs/dbraw/zinc/55/88/29/1057558829.db2.gz QIJLWHIFGGRYFP-UHFFFAOYSA-N -1 1 316.282 4.242 20 0 DIADMM [O-]c1cc(-c2ncnc3c(-c4ccccc4)nsc32)ccc1F ZINC001243050483 1057558869 /nfs/dbraw/zinc/55/88/69/1057558869.db2.gz ULNDCTZKNYXODM-UHFFFAOYSA-N -1 1 323.352 4.265 20 0 DIADMM Cc1ccc(-c2ccc3nc(C(F)(F)F)[nH]c3c2)cc1C(=O)[O-] ZINC001243194176 1057599741 /nfs/dbraw/zinc/59/97/41/1057599741.db2.gz CYVZPXOBQBUTJX-UHFFFAOYSA-N -1 1 320.270 4.255 20 0 DIADMM CC(C)(C)n1cc(Nc2ccc(Cl)c(Cl)c2[O-])cn1 ZINC001212572714 1057638691 /nfs/dbraw/zinc/63/86/91/1057638691.db2.gz RIKKMUSPSIZOHE-UHFFFAOYSA-N -1 1 300.189 4.394 20 0 DIADMM CCOC(OCC)c1cccc(-c2ccc([O-])c(F)c2F)c1 ZINC001243342935 1057652736 /nfs/dbraw/zinc/65/27/36/1057652736.db2.gz QKDZYMUMCMTVPJ-UHFFFAOYSA-N -1 1 308.324 4.409 20 0 DIADMM [O-]c1ccc(-c2cccc(OC(F)(F)F)c2F)c(F)c1F ZINC001243342612 1057652787 /nfs/dbraw/zinc/65/27/87/1057652787.db2.gz LAJXFQQQQOBGCW-UHFFFAOYSA-N -1 1 308.177 4.375 20 0 DIADMM COc1cc(-c2ccc([O-])c(F)c2F)cc(C(F)(F)F)c1 ZINC001243342047 1057652912 /nfs/dbraw/zinc/65/29/12/1057652912.db2.gz AMDLDHNFCWSDKU-UHFFFAOYSA-N -1 1 304.214 4.365 20 0 DIADMM [O-]c1ccc(-c2ccc(-c3nc4cc[nH]cc-4n3)cc2)c(F)c1F ZINC001243342331 1057653167 /nfs/dbraw/zinc/65/31/67/1057653167.db2.gz HDHAHOPRNHDKEH-UHFFFAOYSA-N -1 1 323.302 4.276 20 0 DIADMM [O-]c1ccc(-c2ccnc3[nH]cc(C(F)(F)F)c32)c(F)c1F ZINC001243342863 1057653205 /nfs/dbraw/zinc/65/32/05/1057653205.db2.gz NBDBNAUWZBIYMM-UHFFFAOYSA-N -1 1 314.213 4.184 20 0 DIADMM COC(=O)c1ccc(-c2ccc([O-])c(F)c2F)c2ccccc12 ZINC001243342992 1057653410 /nfs/dbraw/zinc/65/34/10/1057653410.db2.gz UDWAKHSJNHWLDQ-UHFFFAOYSA-N -1 1 314.287 4.277 20 0 DIADMM COc1ccc(-c2ccccn2)cc1-c1ccc([O-])c(F)c1F ZINC001243343427 1057654028 /nfs/dbraw/zinc/65/40/28/1057654028.db2.gz YORFMFMYHKQMHW-UHFFFAOYSA-N -1 1 313.303 4.408 20 0 DIADMM CCOC(=O)CCCc1ccc(-c2ccc([O-])c(F)c2F)cc1 ZINC001243343238 1057654251 /nfs/dbraw/zinc/65/42/51/1057654251.db2.gz UDJSRVNTWQKZOU-UHFFFAOYSA-N -1 1 320.335 4.223 20 0 DIADMM [O-]c1ccc(-c2cccc(-c3ncc4ncccn43)c2)c(F)c1F ZINC001243344971 1057654660 /nfs/dbraw/zinc/65/46/60/1057654660.db2.gz LARUJOVUQIJNSO-UHFFFAOYSA-N -1 1 323.302 4.047 20 0 DIADMM COc1c(F)ccc(SC)c1-c1ccc([O-])c(F)c1F ZINC001243345901 1057654787 /nfs/dbraw/zinc/65/47/87/1057654787.db2.gz WIRYHIKNNAHRNK-UHFFFAOYSA-N -1 1 300.301 4.207 20 0 DIADMM CCOC(=O)c1cc2cc(-c3cc(F)cc(F)c3[O-])ccc2o1 ZINC001243503155 1057696927 /nfs/dbraw/zinc/69/69/27/1057696927.db2.gz QBBAZKWNLJLDHK-UHFFFAOYSA-N -1 1 318.275 4.260 20 0 DIADMM COC(=O)c1cc2c(cccc2-c2cc(F)cc(F)c2[O-])s1 ZINC001243505152 1057697811 /nfs/dbraw/zinc/69/78/11/1057697811.db2.gz UKELHMOSGPVBMM-UHFFFAOYSA-N -1 1 320.316 4.339 20 0 DIADMM COC(=O)[C@H](c1ccc(-c2cc(F)cc(F)c2[O-])cc1)C(C)C ZINC001243504979 1057698000 /nfs/dbraw/zinc/69/80/00/1057698000.db2.gz COIQCXJGRSGFJF-INIZCTEOSA-N -1 1 320.335 4.250 20 0 DIADMM Cc1cnc(-c2cccc([O-])c2F)nc1-c1c(F)cccc1F ZINC001243546383 1057709859 /nfs/dbraw/zinc/70/98/59/1057709859.db2.gz LLIHZBFANRVDNT-UHFFFAOYSA-N -1 1 316.282 4.242 20 0 DIADMM [O-]c1cc(-c2ncc(OCc3ccccc3)cn2)ccc1Cl ZINC001243576165 1057721113 /nfs/dbraw/zinc/72/11/13/1057721113.db2.gz DGWAEMICCLFBCV-UHFFFAOYSA-N -1 1 312.756 4.082 20 0 DIADMM CN(c1ccccc1)c1cc(-c2ccc(Cl)c([O-])c2)ncn1 ZINC001243578529 1057721520 /nfs/dbraw/zinc/72/15/20/1057721520.db2.gz HEUILMOUHNGKAW-UHFFFAOYSA-N -1 1 311.772 4.271 20 0 DIADMM CC(C)(C)C(=O)Nc1ccc(-c2ccc(Cl)c([O-])c2)cn1 ZINC001243578116 1057721557 /nfs/dbraw/zinc/72/15/57/1057721557.db2.gz MAYHBEVBHVBOIM-UHFFFAOYSA-N -1 1 304.777 4.092 20 0 DIADMM CCN(CC)C(=O)c1ccc(-c2ccc(Cl)c([O-])c2)cc1 ZINC001243579353 1057722132 /nfs/dbraw/zinc/72/21/32/1057722132.db2.gz QZJYSGIDZSFZGD-UHFFFAOYSA-N -1 1 303.789 4.195 20 0 DIADMM CCOC(=O)c1ccc(-c2ccc(Cl)c([O-])c2)c(OCC)c1 ZINC001243579076 1057722228 /nfs/dbraw/zinc/72/22/28/1057722228.db2.gz NSPWLSGSAFNPGA-UHFFFAOYSA-N -1 1 320.772 4.288 20 0 DIADMM Cc1nc(-c2ccccn2)nc(-c2ccc(Cl)c([O-])c2)c1C ZINC001243578570 1057722262 /nfs/dbraw/zinc/72/22/62/1057722262.db2.gz IDZFAROTTWQZFQ-UHFFFAOYSA-N -1 1 311.772 4.181 20 0 DIADMM [O-]c1cc(-c2cncc(OC3CCCCC3)n2)ccc1Cl ZINC001243579030 1057722759 /nfs/dbraw/zinc/72/27/59/1057722759.db2.gz PAYBKJPNQWCXHY-UHFFFAOYSA-N -1 1 304.777 4.214 20 0 DIADMM COc1ccccc1-c1ccnc(-c2ccc(Cl)c([O-])c2)n1 ZINC001243579023 1057722815 /nfs/dbraw/zinc/72/28/15/1057722815.db2.gz OWEBWMPYHXMZHZ-UHFFFAOYSA-N -1 1 312.756 4.178 20 0 DIADMM CC1(C)NC(=O)Nc2cc(-c3ccc(Cl)c([O-])c3)ccc21 ZINC001243581629 1057723010 /nfs/dbraw/zinc/72/30/10/1057723010.db2.gz KVGRJRSVBZAPAY-UHFFFAOYSA-N -1 1 302.761 4.083 20 0 DIADMM CCOC(=O)CCc1ccc(-c2ccc(Cl)c([O-])c2)cc1 ZINC001243581355 1057723494 /nfs/dbraw/zinc/72/34/94/1057723494.db2.gz PJKFDGAPSMCTET-UHFFFAOYSA-N -1 1 304.773 4.208 20 0 DIADMM CCOC(=O)c1noc2cc(-c3ccc(Cl)c([O-])c3)ccc21 ZINC001243583505 1057724162 /nfs/dbraw/zinc/72/41/62/1057724162.db2.gz PWDMADDIBVIYBQ-UHFFFAOYSA-N -1 1 317.728 4.031 20 0 DIADMM Cc1nc2c(c(-c3ccc(C(F)(F)F)cc3[O-])n1)CCCC2 ZINC001243608744 1057731794 /nfs/dbraw/zinc/73/17/94/1057731794.db2.gz VJJWLLWFJSZKOD-UHFFFAOYSA-N -1 1 308.303 4.055 20 0 DIADMM [O-]c1cc(C(F)(F)F)ccc1-c1nc(C2CC2)nc2c1CCC2 ZINC001243609769 1057732177 /nfs/dbraw/zinc/73/21/77/1057732177.db2.gz AAHKVPSLDVYVNM-UHFFFAOYSA-N -1 1 320.314 4.234 20 0 DIADMM Cc1nc2ccccc2c(-c2ccc(C(F)(F)F)cc2[O-])n1 ZINC001243609893 1057732278 /nfs/dbraw/zinc/73/22/78/1057732278.db2.gz WQHJADXFCYFJAZ-UHFFFAOYSA-N -1 1 304.271 4.330 20 0 DIADMM CC(C)Sc1ccc(-c2ccc(C(F)(F)F)cc2[O-])nn1 ZINC001243610849 1057732991 /nfs/dbraw/zinc/73/29/91/1057732991.db2.gz VHCXUHNILMRPDB-UHFFFAOYSA-N -1 1 314.332 4.369 20 0 DIADMM [O-]c1cc(C(F)(F)F)ccc1-c1ncnc2c1CCCCC2 ZINC001243610903 1057733047 /nfs/dbraw/zinc/73/30/47/1057733047.db2.gz WCWOEUBRGNSKGB-UHFFFAOYSA-N -1 1 308.303 4.137 20 0 DIADMM O=C1[N-]C(=O)C(=Cc2ccc(-c3ccc(Cl)cc3)s2)S1 ZINC000732579102 1057780920 /nfs/dbraw/zinc/78/09/20/1057780920.db2.gz AOFTXTKTQLTHCF-GHXNOFRVSA-N -1 1 321.810 4.392 20 0 DIADMM O=C(Nc1ccnn1C1CCCC1)c1cc2ccccc2cc1[O-] ZINC000733311450 1057811602 /nfs/dbraw/zinc/81/16/02/1057811602.db2.gz UOVGTFBCCSXJCR-UHFFFAOYSA-N -1 1 321.380 4.109 20 0 DIADMM C[C@@H](OC(=O)c1ccc(Cl)c(Cl)c1[O-])c1cccnc1 ZINC000733490521 1057823585 /nfs/dbraw/zinc/82/35/85/1057823585.db2.gz QQXIMRUGKCFRCI-MRVPVSSYSA-N -1 1 312.152 4.012 20 0 DIADMM CC(C)(C)C(=O)Nc1cccc(-c2c([O-])cccc2Cl)n1 ZINC001244025567 1057841982 /nfs/dbraw/zinc/84/19/82/1057841982.db2.gz CZWZUTFLDGJQMW-UHFFFAOYSA-N -1 1 304.777 4.092 20 0 DIADMM [O-]c1c(F)cc(-c2ccc3nc(C(F)(F)F)cn3c2)cc1F ZINC001244093975 1057867063 /nfs/dbraw/zinc/86/70/63/1057867063.db2.gz MLJGSOHLWKVMRH-UHFFFAOYSA-N -1 1 314.213 4.004 20 0 DIADMM CCOC(=O)[C@@H](CC)c1ccc(-c2cc(F)c([O-])c(F)c2)cc1 ZINC001244097065 1057867614 /nfs/dbraw/zinc/86/76/14/1057867614.db2.gz MKERKGGPHXLDIF-AWEZNQCLSA-N -1 1 320.335 4.394 20 0 DIADMM COc1ccc2nc(C)cc(-c3cc(F)c([O-])c(F)c3)c2c1 ZINC001244097854 1057868377 /nfs/dbraw/zinc/86/83/77/1057868377.db2.gz SEPAEGLJIDQWPL-UHFFFAOYSA-N -1 1 301.292 4.203 20 0 DIADMM [O-]c1c(F)cc(-c2ccc(OCC(F)(F)F)cc2)cc1F ZINC001244098044 1057868894 /nfs/dbraw/zinc/86/88/94/1057868894.db2.gz UPOQGSFLCYTMSD-UHFFFAOYSA-N -1 1 304.214 4.279 20 0 DIADMM CCOC(=O)c1nc2cc(-c3ccc4[nH]c(C)cc4c3)ccc2[n-]1 ZINC001244243772 1057908047 /nfs/dbraw/zinc/90/80/47/1057908047.db2.gz SGWAYXHWKWENFM-UHFFFAOYSA-N -1 1 319.364 4.196 20 0 DIADMM CCOC(=O)c1nc2ccc(-c3ccc4[nH]c(C)cc4c3)cc2[n-]1 ZINC001244243772 1057908050 /nfs/dbraw/zinc/90/80/50/1057908050.db2.gz SGWAYXHWKWENFM-UHFFFAOYSA-N -1 1 319.364 4.196 20 0 DIADMM Cc1ccc(O)cc1-c1ccc([C@H](C)[N-]C(=O)C(F)(F)F)cc1 ZINC001244451607 1057961951 /nfs/dbraw/zinc/96/19/51/1057961951.db2.gz HERVINDCLORRFV-NSHDSACASA-N -1 1 323.314 4.107 20 0 DIADMM [O-]c1cc(OC(F)(F)F)ccc1-c1cccc(C(F)(F)F)n1 ZINC001244463059 1057965679 /nfs/dbraw/zinc/96/56/79/1057965679.db2.gz DLCQDIKMAHHSPQ-UHFFFAOYSA-N -1 1 323.192 4.372 20 0 DIADMM [O-]c1cc(OC(F)(F)F)ccc1-c1ccnc(C2CCCC2)n1 ZINC001244464248 1057966028 /nfs/dbraw/zinc/96/60/28/1057966028.db2.gz YTZAECXULGARCK-UHFFFAOYSA-N -1 1 324.302 4.405 20 0 DIADMM [O-]c1cc(OC(F)(F)F)ccc1-c1ccc2c(n1)CCCC2 ZINC001244464076 1057966042 /nfs/dbraw/zinc/96/60/42/1057966042.db2.gz OOXHVQFPBQTAPM-UHFFFAOYSA-N -1 1 309.287 4.232 20 0 DIADMM CC(C)(C)c1nccc(-c2ccc(OC(F)(F)F)cc2[O-])n1 ZINC001244464473 1057966081 /nfs/dbraw/zinc/96/60/81/1057966081.db2.gz NFGVOIDRORQICX-UHFFFAOYSA-N -1 1 312.291 4.045 20 0 DIADMM CCCCN(C)c1cncc(-c2cc(C)c([O-])c(Cl)c2)n1 ZINC001244537556 1057988803 /nfs/dbraw/zinc/98/88/03/1057988803.db2.gz AJABBRBPFAOWJE-UHFFFAOYSA-N -1 1 305.809 4.047 20 0 DIADMM CCc1cc2c(ncnc2-c2c(Cl)ccc([O-])c2F)s1 ZINC001244537345 1057989130 /nfs/dbraw/zinc/98/91/30/1057989130.db2.gz CNZFRQYMLPVSLB-UHFFFAOYSA-N -1 1 308.765 4.419 20 0 DIADMM CSc1ncc2c(ccnc2-c2cc(C)c([O-])c(Cl)c2)n1 ZINC001244536479 1057989247 /nfs/dbraw/zinc/98/92/47/1057989247.db2.gz JRFOOGIPVJRZBG-UHFFFAOYSA-N -1 1 317.801 4.081 20 0 DIADMM COc1ccc2cnc(-c3c(Cl)ccc([O-])c3F)cc2c1 ZINC001244538592 1057989560 /nfs/dbraw/zinc/98/95/60/1057989560.db2.gz NOWIANPIHKDYFS-UHFFFAOYSA-N -1 1 303.720 4.409 20 0 DIADMM Cc1cc(-c2cc(C(C)C)nc(N(C)C)n2)cc(Cl)c1[O-] ZINC001244538259 1057989954 /nfs/dbraw/zinc/98/99/54/1057989954.db2.gz LFHRDWKOKBRFMQ-UHFFFAOYSA-N -1 1 305.809 4.000 20 0 DIADMM [O-]c1ccc(Cl)c(-c2cc(C(F)(F)F)c(F)cn2)c1F ZINC001244538380 1057989978 /nfs/dbraw/zinc/98/99/78/1057989978.db2.gz KVEYNXIOXBAPEP-UHFFFAOYSA-N -1 1 309.621 4.405 20 0 DIADMM [O-]c1ccc(Cl)c(-c2ccc(-c3cccs3)nn2)c1F ZINC001244537972 1057989999 /nfs/dbraw/zinc/98/99/99/1057989999.db2.gz GZUGOUTYPLJXKW-UHFFFAOYSA-N -1 1 306.749 4.370 20 0 DIADMM CC(C)(C)OC(=O)c1cncc(-c2c(Cl)ccc([O-])c2F)c1 ZINC001244540608 1057990439 /nfs/dbraw/zinc/99/04/39/1057990439.db2.gz CKWKFTLLWVSSPG-UHFFFAOYSA-N -1 1 323.751 4.202 20 0 DIADMM [O-]c1ccc(Cl)c(-c2cncc(-c3cccs3)n2)c1F ZINC001244539648 1057990473 /nfs/dbraw/zinc/99/04/73/1057990473.db2.gz ATNMGZOZDDCBKB-UHFFFAOYSA-N -1 1 306.749 4.370 20 0 DIADMM [O-]c1ccc(Cl)c(-c2ccc(C3OCCO3)c(F)c2)c1F ZINC001244540620 1057990494 /nfs/dbraw/zinc/99/04/94/1057990494.db2.gz DEVZDGQJEVWKFZ-UHFFFAOYSA-N -1 1 312.699 4.036 20 0 DIADMM COC(=O)[C@H](C)c1cccc(-c2c(Cl)ccc([O-])c2F)c1 ZINC001244540647 1057990507 /nfs/dbraw/zinc/99/05/07/1057990507.db2.gz FJSMXHXYOORVHD-SECBINFHSA-N -1 1 308.736 4.128 20 0 DIADMM [O-]c1ccc(Cl)c(-c2ccc(-c3ccsc3)nn2)c1F ZINC001244539964 1057990584 /nfs/dbraw/zinc/99/05/84/1057990584.db2.gz BKMKVLGKFPYTEV-UHFFFAOYSA-N -1 1 306.749 4.370 20 0 DIADMM CSc1cc(-c2cc(C)c([O-])c(Cl)c2)nc(SC)n1 ZINC001244539618 1057990623 /nfs/dbraw/zinc/99/06/23/1057990623.db2.gz ZMWVDQCXXCGJGK-UHFFFAOYSA-N -1 1 312.847 4.255 20 0 DIADMM COc1ccc2ncc(-c3c(Cl)ccc([O-])c3F)cc2c1 ZINC001244541936 1057991199 /nfs/dbraw/zinc/99/11/99/1057991199.db2.gz GHAZBCSBLYOKTK-UHFFFAOYSA-N -1 1 303.720 4.409 20 0 DIADMM [O-]c1ccc(Cl)c(-c2ccc(F)c(C3OCCO3)c2)c1F ZINC001244541851 1057991287 /nfs/dbraw/zinc/99/12/87/1057991287.db2.gz UUFKUPFAFVYXBI-UHFFFAOYSA-N -1 1 312.699 4.036 20 0 DIADMM [O-]c1ccc(Cl)c(-c2ccc(N3CCSCC3)cc2)c1F ZINC001244540956 1057991533 /nfs/dbraw/zinc/99/15/33/1057991533.db2.gz JMSSOKPQINSUES-UHFFFAOYSA-N -1 1 323.820 4.405 20 0 DIADMM CC1(C)NC(=O)Nc2c(-c3c(F)c([O-])ccc3Cl)cccc21 ZINC001244541975 1057991587 /nfs/dbraw/zinc/99/15/87/1057991587.db2.gz ILQQWDLMWICILT-UHFFFAOYSA-N -1 1 320.751 4.222 20 0 DIADMM CC1(C)CC(=O)Nc2c(-c3c(Cl)ccc([O-])c3F)cccc21 ZINC001244542072 1057991671 /nfs/dbraw/zinc/99/16/71/1057991671.db2.gz WQWQWJWDCPBEGW-UHFFFAOYSA-N -1 1 319.763 4.472 20 0 DIADMM COC(=O)c1cc(C)c(-c2c(Cl)ccc([O-])c2F)c(C)c1 ZINC001244543532 1057991937 /nfs/dbraw/zinc/99/19/37/1057991937.db2.gz VNYBRMXOPWILNI-UHFFFAOYSA-N -1 1 308.736 4.255 20 0 DIADMM COC(=O)C1(c2ccc(-c3c(Cl)ccc([O-])c3F)cc2)CC1 ZINC001244543291 1057992095 /nfs/dbraw/zinc/99/20/95/1057992095.db2.gz RCWBMOYIZXZBEO-UHFFFAOYSA-N -1 1 320.747 4.056 20 0 DIADMM [O-]c1ccc(Cl)c(-c2ccc3c4c(ccnc24)CCO3)c1F ZINC001244542518 1057992210 /nfs/dbraw/zinc/99/22/10/1057992210.db2.gz LYQNMFFKTFLRKG-UHFFFAOYSA-N -1 1 315.731 4.335 20 0 DIADMM CC1(C)CC(=O)Nc2cc(-c3c(Cl)ccc([O-])c3F)ccc21 ZINC001244543054 1057992223 /nfs/dbraw/zinc/99/22/23/1057992223.db2.gz SCEBEDNTEBNMHA-UHFFFAOYSA-N -1 1 319.763 4.472 20 0 DIADMM COc1c(F)ccc(-c2c(Cl)ccc([O-])c2F)c1OC ZINC001244543657 1057992443 /nfs/dbraw/zinc/99/24/43/1057992443.db2.gz XAVLXMIWXVABPI-UHFFFAOYSA-N -1 1 300.688 4.008 20 0 DIADMM Cc1cc(-c2cccn(-c3ccccc3)c2=O)cc(Cl)c1[O-] ZINC001244553086 1057994517 /nfs/dbraw/zinc/99/45/17/1057994517.db2.gz CGNVCENBMLABOQ-UHFFFAOYSA-N -1 1 311.768 4.172 20 0 DIADMM CN(C)Cc1cccc(-c2ccc3sc(=S)[n-]c3c2)c1F ZINC001244865227 1058060186 /nfs/dbraw/zinc/06/01/86/1058060186.db2.gz PIXBANLYDVMCPN-UHFFFAOYSA-N -1 1 318.442 4.453 20 0 DIADMM O=C([O-])c1cc(-c2ccc3nc[nH]c3c2)c(Cl)cc1Cl ZINC001245001040 1058089324 /nfs/dbraw/zinc/08/93/24/1058089324.db2.gz ILZICJLVHYRSIE-UHFFFAOYSA-N -1 1 307.136 4.235 20 0 DIADMM C[C@H]1CCCCN1c1cccc(-c2cc(Cl)ccc2[O-])n1 ZINC001245050207 1058102578 /nfs/dbraw/zinc/10/25/78/1058102578.db2.gz PSOGLZJEONPYBB-LBPRGKRZSA-N -1 1 302.805 4.486 20 0 DIADMM [O-]c1ccc(Cl)cc1-c1cc(-c2nc(C3CC3)no2)ccn1 ZINC001245050670 1058103527 /nfs/dbraw/zinc/10/35/27/1058103527.db2.gz ZAUYECCEBHIMCB-UHFFFAOYSA-N -1 1 313.744 4.035 20 0 DIADMM Cc1ccc(Cl)cc1NC(=S)Nc1ccc(F)cc1[O-] ZINC001245164369 1058122703 /nfs/dbraw/zinc/12/27/03/1058122703.db2.gz MRYKTXFPWSBKFW-UHFFFAOYSA-N -1 1 310.781 4.302 20 0 DIADMM CCCC[C@@H](CCC)NC(=O)c1ccc(C(F)(F)F)cc1[O-] ZINC001545231549 1058188105 /nfs/dbraw/zinc/18/81/05/1058188105.db2.gz OKYHGTXDTRXAMK-GFCCVEGCSA-N -1 1 317.351 4.500 20 0 DIADMM O=C(Nc1ccc([O-])c(F)c1F)[C@H]1CC[C@H](c2ccccc2)C1 ZINC001552665802 1058444855 /nfs/dbraw/zinc/44/48/55/1058444855.db2.gz VDEBCXRELCXHCQ-STQMWFEESA-N -1 1 317.335 4.193 20 0 DIADMM [O-]c1ccc(F)c(-c2cc(Oc3ccccc3)ncn2)c1Cl ZINC001245828643 1058523941 /nfs/dbraw/zinc/52/39/41/1058523941.db2.gz WWVHBFXNOHSKNN-UHFFFAOYSA-N -1 1 316.719 4.434 20 0 DIADMM Cc1nc2cc(F)ccc2c(-c2c(F)ccc([O-])c2Cl)n1 ZINC001245828698 1058525045 /nfs/dbraw/zinc/52/50/45/1058525045.db2.gz ZWVXXOCRAKFBHY-UHFFFAOYSA-N -1 1 306.699 4.242 20 0 DIADMM [O-]c1ccc(F)c(-c2ccc(F)c(C(F)(F)F)n2)c1Cl ZINC001245828204 1058525820 /nfs/dbraw/zinc/52/58/20/1058525820.db2.gz QFQZTGSFMJKHCL-UHFFFAOYSA-N -1 1 309.621 4.405 20 0 DIADMM COc1cccc2ccc(-c3c(F)ccc([O-])c3Cl)nc21 ZINC001245828247 1058526244 /nfs/dbraw/zinc/52/62/44/1058526244.db2.gz RDTGGLGSJPEDRY-UHFFFAOYSA-N -1 1 303.720 4.409 20 0 DIADMM Cc1noc(-c2ccc(-c3c(F)ccc([O-])c3Cl)cc2)c1N ZINC001245831060 1058527029 /nfs/dbraw/zinc/52/70/29/1058527029.db2.gz BGQLAGONOSBYPT-UHFFFAOYSA-N -1 1 318.735 4.397 20 0 DIADMM COC(=O)C(C)(C)c1ccc(-c2c(F)ccc([O-])c2Cl)cc1 ZINC001245830995 1058527146 /nfs/dbraw/zinc/52/71/46/1058527146.db2.gz CWFXFOQUOQPLSB-UHFFFAOYSA-N -1 1 322.763 4.302 20 0 DIADMM [O-]c1ccc(F)c(-c2ccc(N3CCCCC3)nc2)c1Cl ZINC001245831192 1058528387 /nfs/dbraw/zinc/52/83/87/1058528387.db2.gz HUVIIZMLLRTACI-UHFFFAOYSA-N -1 1 306.768 4.237 20 0 DIADMM COc1cc2ncccc2c(-c2c(F)ccc([O-])c2Cl)c1 ZINC001245831266 1058528426 /nfs/dbraw/zinc/52/84/26/1058528426.db2.gz IOKJQAISQOLXDJ-UHFFFAOYSA-N -1 1 303.720 4.409 20 0 DIADMM CC(C)(C)c1nc2[nH]ccc2c(-c2c(F)ccc([O-])c2Cl)n1 ZINC001245830565 1058528465 /nfs/dbraw/zinc/52/84/65/1058528465.db2.gz RCKDFYLGVJWBHC-UHFFFAOYSA-N -1 1 319.767 4.372 20 0 DIADMM COc1ccc2cc(-c3c(F)ccc([O-])c3Cl)cnc2c1 ZINC001245831247 1058529910 /nfs/dbraw/zinc/52/99/10/1058529910.db2.gz BIHCMHCZMJCMJE-UHFFFAOYSA-N -1 1 303.720 4.409 20 0 DIADMM COc1ccc2nccc(-c3c(F)ccc([O-])c3Cl)c2c1 ZINC001245831113 1058530522 /nfs/dbraw/zinc/53/05/22/1058530522.db2.gz DNSINJDQUWUQDP-UHFFFAOYSA-N -1 1 303.720 4.409 20 0 DIADMM [O-]c1ccc(F)c(-c2ccc(OCC3CCC3)nc2)c1Cl ZINC001245832697 1058531763 /nfs/dbraw/zinc/53/17/63/1058531763.db2.gz SNWJZGXEYUCCEX-UHFFFAOYSA-N -1 1 307.752 4.426 20 0 DIADMM CC1(C)CC(=O)Nc2ccc(-c3c(F)ccc([O-])c3Cl)cc21 ZINC001245831512 1058531934 /nfs/dbraw/zinc/53/19/34/1058531934.db2.gz NQFATJKITJLHNA-UHFFFAOYSA-N -1 1 319.763 4.472 20 0 DIADMM COc1cnc2cc(-c3c(F)ccc([O-])c3Cl)ccc2c1 ZINC001245832347 1058532775 /nfs/dbraw/zinc/53/27/75/1058532775.db2.gz USCWLTRSNQIAEB-UHFFFAOYSA-N -1 1 303.720 4.409 20 0 DIADMM [O-]c1ccc(F)c(-c2ccc(C3N=NC(=S)O3)cc2)c1Cl ZINC001245832025 1058533230 /nfs/dbraw/zinc/53/32/30/1058533230.db2.gz KFSYFAHEJQEJOF-UHFFFAOYSA-N -1 1 322.748 4.190 20 0 DIADMM COC(=O)c1cc(F)cc(-c2c(F)ccc([O-])c2Cl)c1C ZINC001245832091 1058533787 /nfs/dbraw/zinc/53/37/87/1058533787.db2.gz TZFJNWZWSQLHLH-UHFFFAOYSA-N -1 1 312.699 4.086 20 0 DIADMM CC(=O)n1ccc2cc(-c3c(F)ccc([O-])c3Cl)ccc21 ZINC001245832359 1058534957 /nfs/dbraw/zinc/53/49/57/1058534957.db2.gz VRBMYSOVTVNQEI-UHFFFAOYSA-N -1 1 303.720 4.467 20 0 DIADMM O=C(NCC1(C2CCCCC2)CCCCC1)c1ncccc1[O-] ZINC001556050496 1058535183 /nfs/dbraw/zinc/53/51/83/1058535183.db2.gz WCYSWYWMWZVSLD-UHFFFAOYSA-N -1 1 316.445 4.048 20 0 DIADMM Cc1cnc(C(=O)N[C@@H]2CCCc3ccc(C(C)C)cc32)c([O-])c1 ZINC001556076833 1058537403 /nfs/dbraw/zinc/53/74/03/1058537403.db2.gz VKGOIFYTGJDKFL-QGZVFWFLSA-N -1 1 324.424 4.026 20 0 DIADMM CC1(C)CC(=O)Nc2cccc(-c3c(F)ccc([O-])c3Cl)c21 ZINC001245834186 1058537408 /nfs/dbraw/zinc/53/74/08/1058537408.db2.gz FAJYNSLKBZOTAH-UHFFFAOYSA-N -1 1 319.763 4.472 20 0 DIADMM [O-]c1ccc(F)c(-c2ccc(Cn3ccnc3)cc2)c1Cl ZINC001245833022 1058537492 /nfs/dbraw/zinc/53/74/92/1058537492.db2.gz XBXIXUFVWGSHSN-UHFFFAOYSA-N -1 1 302.736 4.097 20 0 DIADMM COc1ccc2cccnc2c1-c1c(F)ccc([O-])c1Cl ZINC001245832981 1058538298 /nfs/dbraw/zinc/53/82/98/1058538298.db2.gz QZJVIVRIUAKXRL-UHFFFAOYSA-N -1 1 303.720 4.409 20 0 DIADMM CC(C)C(CNC(=O)c1ccc(C(F)(F)F)cc1[O-])C(C)C ZINC001556257598 1058568505 /nfs/dbraw/zinc/56/85/05/1058568505.db2.gz CVUHRPYBBUJCBG-UHFFFAOYSA-N -1 1 317.351 4.069 20 0 DIADMM CCc1ccc(C(=O)N2CCc3cc(C(C)(C)C)ccc32)c([O-])c1 ZINC001556290747 1058574300 /nfs/dbraw/zinc/57/43/00/1058574300.db2.gz NGILSKHSKKIWNN-UHFFFAOYSA-N -1 1 323.436 4.455 20 0 DIADMM Cc1c2ccccc2oc1[C@H](C)NC(=O)c1c([O-])cccc1F ZINC001556500819 1058602654 /nfs/dbraw/zinc/60/26/54/1058602654.db2.gz SPESINKBCUIESH-NSHDSACASA-N -1 1 313.328 4.077 20 0 DIADMM O=c1cc(CC2CCC2)[n-]n1-c1ccnc2c(Cl)cccc12 ZINC001245935872 1058631813 /nfs/dbraw/zinc/63/18/13/1058631813.db2.gz DSXHEUOIEXZAGH-UHFFFAOYSA-N -1 1 313.788 4.122 20 0 DIADMM CC[C@H](NC(=O)c1ccc(C(F)(F)F)cc1[O-])c1ccccc1 ZINC001557051342 1058693223 /nfs/dbraw/zinc/69/32/23/1058693223.db2.gz ZIGVIFMLVFSDAN-AWEZNQCLSA-N -1 1 323.314 4.292 20 0 DIADMM C[C@H]1CN(C(=O)c2ccc3ccc(O)cc3c2[O-])c2ccccc21 ZINC001557103523 1058700610 /nfs/dbraw/zinc/70/06/10/1058700610.db2.gz OMIHMKFNZFQQPQ-LBPRGKRZSA-N -1 1 319.360 4.015 20 0 DIADMM O=C(NC1(c2ccc(Cl)cc2)CC1)c1c([O-])cccc1Cl ZINC001557104632 1058700873 /nfs/dbraw/zinc/70/08/73/1058700873.db2.gz GGZTWIAOYLWRBL-UHFFFAOYSA-N -1 1 322.191 4.118 20 0 DIADMM O=C(c1ncc2ccccc2c1[O-])N1CCC[C@@H]1CC1CCCC1 ZINC001557291696 1058729122 /nfs/dbraw/zinc/72/91/22/1058729122.db2.gz CTWPINVAGWWMCB-MRXNPFEDSA-N -1 1 324.424 4.125 20 0 DIADMM CC[C@@H]1CCC[C@H](C)N1C(=O)c1ccc2ccc(O)cc2c1[O-] ZINC001557616794 1058778380 /nfs/dbraw/zinc/77/83/80/1058778380.db2.gz SNPYNEQYOZWKNY-GXTWGEPZSA-N -1 1 313.397 4.044 20 0 DIADMM CC1(C)C[C@@]1(NC(=O)c1ccc(Cl)cc1[O-])c1ccccc1 ZINC001557663211 1058784420 /nfs/dbraw/zinc/78/44/20/1058784420.db2.gz ZAYBHDVNTDFLRQ-GOSISDBHSA-N -1 1 315.800 4.101 20 0 DIADMM O=C(Nc1cccc(F)c1[O-])c1[nH]c2ccc(F)cc2c1Cl ZINC001557955575 1058817720 /nfs/dbraw/zinc/81/77/20/1058817720.db2.gz DDBYXIQZMVKIRJ-UHFFFAOYSA-N -1 1 322.698 4.057 20 0 DIADMM C[C@H]1CCN(C(=O)c2cc(Cl)ccc2[O-])[C@@H]1c1ccccc1 ZINC001558302915 1058861988 /nfs/dbraw/zinc/86/19/88/1058861988.db2.gz FAGQFDUAZWCWKD-SJCJKPOMSA-N -1 1 315.800 4.269 20 0 DIADMM O=C(Nc1cc(F)c([O-])cc1Cl)c1ccc(C2CC2)cc1 ZINC001558644569 1058895428 /nfs/dbraw/zinc/89/54/28/1058895428.db2.gz PSSJXJYJPDSZSQ-UHFFFAOYSA-N -1 1 305.736 4.314 20 0 DIADMM C[C@H]([C@H](C)C(=O)Nc1cc(F)c([O-])cc1Cl)C(C)(C)C ZINC001558644260 1058896380 /nfs/dbraw/zinc/89/63/80/1058896380.db2.gz BZFZIEULZCPYFN-DTWKUNHWSA-N -1 1 301.789 4.442 20 0 DIADMM Cc1c([N-]c2nc(C3CCCC3)ns2)cnn1CC(C)C ZINC001559143128 1059031526 /nfs/dbraw/zinc/03/15/26/1059031526.db2.gz LBBFZFHCEFOMEP-UHFFFAOYSA-N -1 1 305.451 4.100 20 0 DIADMM Cc1cc(C)c(CSc2nc(C(F)F)cc(=O)[n-]2)c(C)c1 ZINC001559421381 1059221224 /nfs/dbraw/zinc/22/12/24/1059221224.db2.gz IZSJHBRFEXAWJK-UHFFFAOYSA-N -1 1 310.369 4.337 20 0 DIADMM Cc1ccc(C)c(CSc2nc(C)c(C3CC3)c(=O)[n-]2)c1 ZINC001559449743 1059239194 /nfs/dbraw/zinc/23/91/94/1059239194.db2.gz DQUKZFZSTVXWOF-UHFFFAOYSA-N -1 1 300.427 4.277 20 0 DIADMM Cc1cccc2[nH]c(Nc3cc4ccc([O-])cc4oc3=O)cc21 ZINC001248433336 1059830085 /nfs/dbraw/zinc/83/00/85/1059830085.db2.gz LGZKEKSYVBEEAC-UHFFFAOYSA-N -1 1 306.321 4.032 20 0 DIADMM [O-]c1ccc(Cl)c(Nc2ccncc2C(F)(F)F)c1Cl ZINC001249594101 1060309812 /nfs/dbraw/zinc/30/98/12/1060309812.db2.gz WLWLISHBOLBPKV-UHFFFAOYSA-N -1 1 323.101 4.278 20 0 DIADMM O=c1ccn(-c2ccc(Nc3cc4c(cccc4Cl)[nH]3)cc2)[n-]1 ZINC001249864912 1060432135 /nfs/dbraw/zinc/43/21/35/1060432135.db2.gz RMSBMQFZVPADEF-UHFFFAOYSA-N -1 1 324.771 4.456 20 0 DIADMM CN1Cc2c(cccc2Nc2cc(Cl)cc(Cl)c2[O-])C1=O ZINC001249940905 1060496691 /nfs/dbraw/zinc/49/66/91/1060496691.db2.gz BSVBSALXALKDJM-UHFFFAOYSA-N -1 1 323.179 4.028 20 0 DIADMM Cc1nc2ccccc2cc1Nc1cc([O-])c(F)c(F)c1F ZINC001249958804 1060502577 /nfs/dbraw/zinc/50/25/77/1060502577.db2.gz POWLJTQZNUTXCM-UHFFFAOYSA-N -1 1 304.271 4.410 20 0 DIADMM CCC[C@H](C)c1cc(Nc2cc([O-])c(F)c(F)c2F)on1 ZINC001249958802 1060502820 /nfs/dbraw/zinc/50/28/20/1060502820.db2.gz SXDFABHNRWEDEJ-ZETCQYMHSA-N -1 1 300.280 4.445 20 0 DIADMM CCC[C@@H](C)c1cc(Nc2cc([O-])c(F)c(F)c2F)on1 ZINC001249958800 1060502882 /nfs/dbraw/zinc/50/28/82/1060502882.db2.gz SXDFABHNRWEDEJ-SSDOTTSWSA-N -1 1 300.280 4.445 20 0 DIADMM CC(C)(C)Cc1cc(Nc2cc([O-])c(F)c(F)c2F)on1 ZINC001249958222 1060503219 /nfs/dbraw/zinc/50/32/19/1060503219.db2.gz LKOLABYMXOIEML-UHFFFAOYSA-N -1 1 300.280 4.130 20 0 DIADMM [O-]c1cc(Nc2cc(Cc3ccccc3)no2)c(F)c(F)c1F ZINC001249958209 1060505667 /nfs/dbraw/zinc/50/56/67/1060505667.db2.gz KZQVUIKSUYZCAM-UHFFFAOYSA-N -1 1 320.270 4.132 20 0 DIADMM Cc1ccc2c(cccc2Nc2cc([O-])c(F)c(F)c2F)n1 ZINC001249965113 1060507115 /nfs/dbraw/zinc/50/71/15/1060507115.db2.gz VWGGFDRBXMSOPX-UHFFFAOYSA-N -1 1 304.271 4.410 20 0 DIADMM Nc1cc(Cl)c(Nc2cc([O-])c(F)c(F)c2F)cc1Cl ZINC001249964333 1060507267 /nfs/dbraw/zinc/50/72/67/1060507267.db2.gz ACIFOTYUMUIRKS-UHFFFAOYSA-N -1 1 323.101 4.442 20 0 DIADMM Cc1cc(N)c(Cl)cc1Nc1cc([O-])c(F)c(F)c1F ZINC001249964543 1060508156 /nfs/dbraw/zinc/50/81/56/1060508156.db2.gz GDFMVSPRSOSSBV-UHFFFAOYSA-N -1 1 302.683 4.097 20 0 DIADMM Cc1cc(=O)[nH]c2cc(Nc3cc([O-])c(F)c(F)c3F)ccc12 ZINC001249965154 1060509339 /nfs/dbraw/zinc/50/93/39/1060509339.db2.gz XTPDQGJLNNZZFT-UHFFFAOYSA-N -1 1 320.270 4.115 20 0 DIADMM [O-]c1cc(Nc2ccc(-c3ncco3)cc2)c(F)c(F)c1F ZINC001249966010 1060511467 /nfs/dbraw/zinc/51/14/67/1060511467.db2.gz XCRPZWZSYZFREW-UHFFFAOYSA-N -1 1 306.243 4.208 20 0 DIADMM CC(=O)n1ccc2cc(Nc3cc([O-])c(F)c(F)c3F)ccc21 ZINC001249965823 1060514259 /nfs/dbraw/zinc/51/42/59/1060514259.db2.gz NGWLLQDIKOEHTC-UHFFFAOYSA-N -1 1 320.270 4.168 20 0 DIADMM COC(=O)c1cc(C)sc1Nc1cc(Cl)c([O-])cc1F ZINC001250020564 1060544150 /nfs/dbraw/zinc/54/41/50/1060544150.db2.gz NGWOJFIGVFWISJ-UHFFFAOYSA-N -1 1 315.753 4.085 20 0 DIADMM [O-]c1cc(F)c(Nc2cnc3ccc(O)cc3c2)cc1Cl ZINC001250020414 1060544686 /nfs/dbraw/zinc/54/46/86/1060544686.db2.gz UXKOVPJGDWVTPT-UHFFFAOYSA-N -1 1 304.708 4.182 20 0 DIADMM [O-]c1cc(F)c(Nc2cncc(-c3ccccn3)c2)cc1Cl ZINC001250023078 1060546643 /nfs/dbraw/zinc/54/66/43/1060546643.db2.gz BODRFZDGSHXWNV-UHFFFAOYSA-N -1 1 315.735 4.385 20 0 DIADMM [O-]c1cc(F)c(Nc2cc(C(F)(F)F)cnc2F)cc1Cl ZINC001250023498 1060547639 /nfs/dbraw/zinc/54/76/39/1060547639.db2.gz LUUKBCUUXFBBLG-UHFFFAOYSA-N -1 1 324.636 4.481 20 0 DIADMM [O-]c1cc(F)c(Nc2cc(OC(F)(F)F)ccn2)cc1Cl ZINC001250021972 1060547994 /nfs/dbraw/zinc/54/79/94/1060547994.db2.gz AIELXFOYKKTBKI-UHFFFAOYSA-N -1 1 322.645 4.222 20 0 DIADMM CC(C)c1c(Cl)ncnc1Nc1cc(Cl)c([O-])cc1F ZINC001250022351 1060549333 /nfs/dbraw/zinc/54/93/33/1060549333.db2.gz JNJXGQSEEFNCOG-UHFFFAOYSA-N -1 1 316.163 4.495 20 0 DIADMM COC(=O)/C=C/c1ccc(Nc2cc(Cl)c([O-])cc2F)cc1 ZINC001250025693 1060549965 /nfs/dbraw/zinc/54/99/65/1060549965.db2.gz ITIDLJZNCMZCBU-QPJJXVBHSA-N -1 1 321.735 4.115 20 0 DIADMM CCOC(=O)c1ccc(Nc2cc(Cl)c([O-])cc2F)cc1 ZINC001250024047 1060551107 /nfs/dbraw/zinc/55/11/07/1060551107.db2.gz NZURSFFUZITJJA-UHFFFAOYSA-N -1 1 309.724 4.105 20 0 DIADMM [O-]c1cc(F)c(Nc2cccc(-n3cccn3)c2)cc1Cl ZINC001250024008 1060551904 /nfs/dbraw/zinc/55/19/04/1060551904.db2.gz MMRLCHJUIFVZNW-UHFFFAOYSA-N -1 1 303.724 4.114 20 0 DIADMM Cc1c(Cl)cc(N)cc1Nc1cc(Cl)c([O-])cc1F ZINC001250025509 1060551938 /nfs/dbraw/zinc/55/19/38/1060551938.db2.gz CHYXQJZWBZRPTD-UHFFFAOYSA-N -1 1 301.148 4.472 20 0 DIADMM [O-]c1cc(F)c(Nc2cc(O)c(Cl)cc2F)cc1Cl ZINC001250024336 1060552462 /nfs/dbraw/zinc/55/24/62/1060552462.db2.gz YSUBOLLLILSIBV-UHFFFAOYSA-N -1 1 306.095 4.426 20 0 DIADMM O=C1CCCc2cc(Nc3cc(Cl)c([O-])cc3F)ccc21 ZINC001250027454 1060553445 /nfs/dbraw/zinc/55/34/45/1060553445.db2.gz ZPCBUTDMPHAPGV-UHFFFAOYSA-N -1 1 305.736 4.447 20 0 DIADMM [O-]c1ccc(Cc2ccc(OC(F)(F)F)cc2)c(F)c1F ZINC001250199056 1060677505 /nfs/dbraw/zinc/67/75/05/1060677505.db2.gz DYLNPKIOFWOVIL-UHFFFAOYSA-N -1 1 304.214 4.160 20 0 DIADMM Cc1c(Cl)ccc(N)c1Nc1c(F)ccc([O-])c1Cl ZINC001250232520 1060711214 /nfs/dbraw/zinc/71/12/14/1060711214.db2.gz PKHNMTSJACEMSJ-UHFFFAOYSA-N -1 1 301.148 4.472 20 0 DIADMM [O-]c1ccc(F)c(Nc2cc(Cl)nnc2Cl)c1Cl ZINC001250228299 1060707551 /nfs/dbraw/zinc/70/75/51/1060707551.db2.gz VPLSLPHZJJATBJ-UHFFFAOYSA-N -1 1 308.527 4.025 20 0 DIADMM [O-]c1ccc(F)c(Nc2ccccc2-n2ccnc2)c1Cl ZINC001250233979 1060713028 /nfs/dbraw/zinc/71/30/28/1060713028.db2.gz HWIHVPUDSOIBHV-UHFFFAOYSA-N -1 1 303.724 4.114 20 0 DIADMM Nc1cc(Cl)cc2c1ccn2-c1c(F)ccc([O-])c1Cl ZINC001250232925 1060715157 /nfs/dbraw/zinc/71/51/57/1060715157.db2.gz ZRORNSCFDVZUQC-UHFFFAOYSA-N -1 1 311.143 4.364 20 0 DIADMM COC(=O)c1cc(C)cc(Nc2c(F)ccc([O-])c2Cl)c1 ZINC001250235822 1060716962 /nfs/dbraw/zinc/71/69/62/1060716962.db2.gz BMHQXIWJMIQYFU-UHFFFAOYSA-N -1 1 309.724 4.023 20 0 DIADMM CCOC(=O)Cc1cccc(Nc2c(F)ccc([O-])c2Cl)c1 ZINC001250237900 1060720184 /nfs/dbraw/zinc/72/01/84/1060720184.db2.gz RAHDACQSVBHVAU-UHFFFAOYSA-N -1 1 323.751 4.034 20 0 DIADMM COc1cc(Cl)c(NCc2ccc([O-])c(F)c2F)cc1C ZINC001560862048 1060720379 /nfs/dbraw/zinc/72/03/79/1060720379.db2.gz FJOMWSMFWYFGRZ-UHFFFAOYSA-N -1 1 313.731 4.253 20 0 DIADMM COc1cc(Nc2cc([O-])c(F)c(F)c2)c(F)c(F)c1Cl ZINC001250265555 1060740348 /nfs/dbraw/zinc/74/03/48/1060740348.db2.gz KJMAXZKOEZJUOZ-UHFFFAOYSA-N -1 1 321.657 4.354 20 0 DIADMM COc1cc(Nc2cc(F)c([O-])c(F)c2)c(F)c(F)c1Cl ZINC001250265877 1060743111 /nfs/dbraw/zinc/74/31/11/1060743111.db2.gz QJWPHUZJMLUXIU-UHFFFAOYSA-N -1 1 321.657 4.354 20 0 DIADMM [S-]c1cc(Br)ccc1Nc1ccc2cncn2c1 ZINC001250332241 1060784260 /nfs/dbraw/zinc/78/42/60/1060784260.db2.gz YIDFABJMWQGJDB-UHFFFAOYSA-N -1 1 320.215 4.129 20 0 DIADMM Fc1cc(F)c(F)c2nc(-c3nc4ccccc4s3)[n-]c21 ZINC001250633551 1060964386 /nfs/dbraw/zinc/96/43/86/1060964386.db2.gz GBNVRJWOYTYDLW-UHFFFAOYSA-N -1 1 305.284 4.257 20 0 DIADMM CC(C)(C)n1c2ccc(F)cc2nc1-c1c([O-])cccc1F ZINC001250674839 1061005714 /nfs/dbraw/zinc/00/57/14/1061005714.db2.gz XGBWKEGDKQSRNQ-UHFFFAOYSA-N -1 1 302.324 4.442 20 0 DIADMM [O-]c1c(F)cccc1-c1nc2ccc(F)c(F)c2n1C1CC1 ZINC001250683959 1061015437 /nfs/dbraw/zinc/01/54/37/1061015437.db2.gz UFAZPGZFMYNGQY-UHFFFAOYSA-N -1 1 304.271 4.161 20 0 DIADMM Cc1cc(F)cc([N-]S(=O)(=O)c2ccc3ccccc3c2)c1 ZINC001250721482 1061041225 /nfs/dbraw/zinc/04/12/25/1061041225.db2.gz XCUILWGGLAJCIC-UHFFFAOYSA-N -1 1 315.369 4.088 20 0 DIADMM [O-]c1c(F)ccc(F)c1-c1nc2ccc(-c3ccncc3)cc2[nH]1 ZINC001250802937 1061075637 /nfs/dbraw/zinc/07/56/37/1061075637.db2.gz PNCUTVFNUYFZJK-UHFFFAOYSA-N -1 1 323.302 4.276 20 0 DIADMM CCn1c(-c2ccc(Cl)cc2[O-])nc2ccc(F)c(F)c21 ZINC001250871975 1061103115 /nfs/dbraw/zinc/10/31/15/1061103115.db2.gz IMCVEZYYSBJSJE-UHFFFAOYSA-N -1 1 308.715 4.360 20 0 DIADMM O=C([O-])c1ccccc1-c1nc2cc(C(F)(F)F)c(F)cc2[nH]1 ZINC001250879207 1061106537 /nfs/dbraw/zinc/10/65/37/1061106537.db2.gz LCAAWRDPHXVVEG-UHFFFAOYSA-N -1 1 324.233 4.086 20 0 DIADMM Cc1ccc2[nH]c(-c3cccc([O-])c3Br)nc2c1 ZINC001250880360 1061106979 /nfs/dbraw/zinc/10/69/79/1061106979.db2.gz JDHHPTWREXNDGJ-UHFFFAOYSA-N -1 1 303.159 4.006 20 0 DIADMM Cc1ccc2nc(-c3cccc([O-])c3Br)[nH]c2c1 ZINC001250880360 1061106991 /nfs/dbraw/zinc/10/69/91/1061106991.db2.gz JDHHPTWREXNDGJ-UHFFFAOYSA-N -1 1 303.159 4.006 20 0 DIADMM [O-]c1ccc(-c2nc3c(cc(F)c(Cl)c3F)[nH]2)c(F)c1F ZINC001250915175 1061124092 /nfs/dbraw/zinc/12/40/92/1061124092.db2.gz QMOAWJASGSUVQH-UHFFFAOYSA-N -1 1 316.641 4.145 20 0 DIADMM Cc1ccc2c(c1)nc(-c1ccc([O-])c(F)c1F)n2CC1CC1 ZINC001250914906 1061124444 /nfs/dbraw/zinc/12/44/44/1061124444.db2.gz KNYNCPUFUKVSQU-UHFFFAOYSA-N -1 1 314.335 4.406 20 0 DIADMM [O-]c1ccc(-c2nc3cc(F)ccc3n2C2CC2)c(F)c1F ZINC001250914887 1061124619 /nfs/dbraw/zinc/12/46/19/1061124619.db2.gz JZUABHQXSKMBJJ-UHFFFAOYSA-N -1 1 304.271 4.161 20 0 DIADMM [O-]c1ccc(CNC2(c3ccccc3Cl)CCC2)c(F)c1F ZINC001462394352 1061145777 /nfs/dbraw/zinc/14/57/77/1061145777.db2.gz KGGZHDJSAOLUAK-UHFFFAOYSA-N -1 1 323.770 4.493 20 0 DIADMM COc1ccc2nc(-c3cc(F)c(F)cc3[O-])n(C3CC3)c2c1 ZINC001250967094 1061151382 /nfs/dbraw/zinc/15/13/82/1061151382.db2.gz IHEXDOKWWUMMBA-UHFFFAOYSA-N -1 1 316.307 4.031 20 0 DIADMM [O-]c1cc(F)c(F)cc1-c1nc2c(cc(F)c(Cl)c2F)[nH]1 ZINC001250967426 1061153082 /nfs/dbraw/zinc/15/30/82/1061153082.db2.gz QSKWQSMAGMBORK-UHFFFAOYSA-N -1 1 316.641 4.145 20 0 DIADMM CCCn1c2cc(F)ccc2nc1-c1c(F)cc([O-])cc1F ZINC001251007125 1061178936 /nfs/dbraw/zinc/17/89/36/1061178936.db2.gz DJSRGSVGXPQDCJ-UHFFFAOYSA-N -1 1 306.287 4.236 20 0 DIADMM CC(=O)c1ccc2[nH]c(-c3ccc([O-])c(C(F)(F)F)c3)nc2c1 ZINC001251019674 1061185356 /nfs/dbraw/zinc/18/53/56/1061185356.db2.gz BCIGPHKTHNFRNC-UHFFFAOYSA-N -1 1 320.270 4.157 20 0 DIADMM COc1cc2[nH]c(-c3cccc(Cl)c3[O-])nc2cc1Cl ZINC001251051946 1061201775 /nfs/dbraw/zinc/20/17/75/1061201775.db2.gz MACYPTTYFAPTAA-UHFFFAOYSA-N -1 1 309.152 4.251 20 0 DIADMM C[C@]1(c2ccccc2)CCCN1C(=O)c1cc(Cl)ccc1[O-] ZINC001455225355 1061215206 /nfs/dbraw/zinc/21/52/06/1061215206.db2.gz NBEBJKKZKGCQGA-GOSISDBHSA-N -1 1 315.800 4.197 20 0 DIADMM CC(C)(C)c1ccc(NC(=O)c2cccc([O-])c2F)cc1F ZINC001455292969 1061216532 /nfs/dbraw/zinc/21/65/32/1061216532.db2.gz LCAMBGSRINFTJD-UHFFFAOYSA-N -1 1 305.324 4.220 20 0 DIADMM O=C([N-]c1cscc1Cl)c1snc(Cl)c1Cl ZINC001455413683 1061223560 /nfs/dbraw/zinc/22/35/60/1061223560.db2.gz URPOVLHSDDDRQV-UHFFFAOYSA-N -1 1 313.618 4.417 20 0 DIADMM CCn1c2ccc(Cl)cc2nc1-c1cc(Cl)c([O-])cc1O ZINC001251082237 1061223899 /nfs/dbraw/zinc/22/38/99/1061223899.db2.gz DOLQNVKNNSCMHQ-UHFFFAOYSA-N -1 1 323.179 4.441 20 0 DIADMM CC(C)(C)n1c2ccccc2nc1-c1cc(Cl)ncc1[O-] ZINC001251251436 1061290401 /nfs/dbraw/zinc/29/04/01/1061290401.db2.gz FFJGDHMIXLMQGJ-UHFFFAOYSA-N -1 1 301.777 4.212 20 0 DIADMM Cc1ccc2nc(-c3cc(Cl)ncc3[O-])n(C(C)C)c2c1 ZINC001251251508 1061291413 /nfs/dbraw/zinc/29/14/13/1061291413.db2.gz GLOXGWCNHRHEMF-UHFFFAOYSA-N -1 1 301.777 4.347 20 0 DIADMM Cc1cccc2nc(-c3c([O-])ccc(F)c3F)n(C3CC3)c21 ZINC001251322438 1061312540 /nfs/dbraw/zinc/31/25/40/1061312540.db2.gz UAYDKFAZRHEDTN-UHFFFAOYSA-N -1 1 300.308 4.330 20 0 DIADMM CCCn1c2cc(F)ccc2nc1-c1c([O-])ccc(F)c1F ZINC001251322451 1061314332 /nfs/dbraw/zinc/31/43/32/1061314332.db2.gz UKGRGYSIBRFZDJ-UHFFFAOYSA-N -1 1 306.287 4.236 20 0 DIADMM CC(C)n1c2cc(F)ccc2nc1-c1c(F)ccc([O-])c1F ZINC001251335909 1061320598 /nfs/dbraw/zinc/32/05/98/1061320598.db2.gz UXCNPVUDGBYMLV-UHFFFAOYSA-N -1 1 306.287 4.407 20 0 DIADMM CCn1c2ccc(Cl)cc2nc1-c1c(F)ccc([O-])c1F ZINC001251335844 1061320781 /nfs/dbraw/zinc/32/07/81/1061320781.db2.gz SJJJPRKUPBZTNR-UHFFFAOYSA-N -1 1 308.715 4.360 20 0 DIADMM Cc1cc2[nH]c(-c3cccc(C(F)(F)F)c3[O-])nc2cc1F ZINC001251340961 1061324095 /nfs/dbraw/zinc/32/40/95/1061324095.db2.gz CLLSUBBINLUBOC-UHFFFAOYSA-N -1 1 310.250 4.402 20 0 DIADMM [O-]c1c(-c2nc3c(cc(F)cc3F)[nH]2)cccc1C(F)(F)F ZINC001251340991 1061324795 /nfs/dbraw/zinc/32/47/95/1061324795.db2.gz FOJOXBRXPCPSPO-UHFFFAOYSA-N -1 1 314.213 4.233 20 0 DIADMM CC(C)(C)OCc1cccc(NC(=O)c2ccc(F)c([O-])c2)c1 ZINC001456557674 1061334984 /nfs/dbraw/zinc/33/49/84/1061334984.db2.gz FBNSYFRYVRPDBX-UHFFFAOYSA-N -1 1 317.360 4.099 20 0 DIADMM CC(C)(C)n1c2cc(F)ccc2nc1-c1ccc(F)c([O-])c1 ZINC001251477454 1061371015 /nfs/dbraw/zinc/37/10/15/1061371015.db2.gz MMJCZHKOOQVCHC-UHFFFAOYSA-N -1 1 302.324 4.442 20 0 DIADMM Cc1ccc(F)c2nc(-c3ccc(Br)c([O-])c3)[nH]c21 ZINC001251473701 1061372870 /nfs/dbraw/zinc/37/28/70/1061372870.db2.gz LHGDCEHXIYQRMB-UHFFFAOYSA-N -1 1 321.149 4.146 20 0 DIADMM CSCCCn1c2ccccc2nc1-c1ccc(F)c([O-])c1 ZINC001251477892 1061374001 /nfs/dbraw/zinc/37/40/01/1061374001.db2.gz YGKIBRSTTYHKOE-UHFFFAOYSA-N -1 1 316.401 4.301 20 0 DIADMM COc1ccc2nc(-c3cc(Cl)c(Cl)cc3[O-])n(C)c2c1 ZINC001251491440 1061377367 /nfs/dbraw/zinc/37/73/67/1061377367.db2.gz WDJKPOPVCYJRNV-UHFFFAOYSA-N -1 1 323.179 4.261 20 0 DIADMM COc1ccc2[nH]c(-c3cc(Cl)c(Cl)cc3[O-])nc2c1 ZINC001251491043 1061377736 /nfs/dbraw/zinc/37/77/36/1061377736.db2.gz FRLOLZFPIUPOEX-UHFFFAOYSA-N -1 1 309.152 4.251 20 0 DIADMM COc1cc([O-])c(-c2nc3cc(C)c(C)cc3[nH]2)c(Cl)c1 ZINC001251491484 1061379554 /nfs/dbraw/zinc/37/95/54/1061379554.db2.gz YJIFBSBNSZUDEU-UHFFFAOYSA-N -1 1 302.761 4.214 20 0 DIADMM C[C@@H](NC(=O)c1c([O-])cccc1F)c1csc2ccccc21 ZINC001456947885 1061389685 /nfs/dbraw/zinc/38/96/85/1061389685.db2.gz ARLVWDDVRXJJRL-SNVBAGLBSA-N -1 1 315.369 4.237 20 0 DIADMM COc1ccc2nc(-c3c([O-])ccc(Cl)c3Cl)n(C)c2c1 ZINC001251531955 1061390722 /nfs/dbraw/zinc/39/07/22/1061390722.db2.gz QHVNUTWITOPUIO-UHFFFAOYSA-N -1 1 323.179 4.261 20 0 DIADMM Cn1c(-c2c([O-])ccc(F)c2Cl)nc2ccc(F)c(F)c21 ZINC001251540643 1061397449 /nfs/dbraw/zinc/39/74/49/1061397449.db2.gz KDGOXNVZZKYQDM-UHFFFAOYSA-N -1 1 312.678 4.017 20 0 DIADMM O=c1[nH]c2ccccc2c(Cl)c1-c1nc2cccc(F)c2[n-]1 ZINC001251609928 1061417309 /nfs/dbraw/zinc/41/73/09/1061417309.db2.gz HADRTRIVSUQTFX-UHFFFAOYSA-N -1 1 313.719 4.276 20 0 DIADMM O=c1[nH]c2ccccc2c(Cl)c1-c1nc2c(cccc2F)[n-]1 ZINC001251609928 1061417325 /nfs/dbraw/zinc/41/73/25/1061417325.db2.gz HADRTRIVSUQTFX-UHFFFAOYSA-N -1 1 313.719 4.276 20 0 DIADMM Cc1cc(F)cc2[nH]c(-c3cc(Cl)nc(Cl)c3[O-])nc21 ZINC001251613950 1061419336 /nfs/dbraw/zinc/41/93/36/1061419336.db2.gz RSWXIVNCFVVUDC-UHFFFAOYSA-N -1 1 312.131 4.085 20 0 DIADMM CC(C)[C@@H](NC(=O)c1ccc(F)c([O-])c1)c1ccc(Cl)cc1 ZINC001463879877 1061530979 /nfs/dbraw/zinc/53/09/79/1061530979.db2.gz APNYWDILRNOIEJ-MRXNPFEDSA-N -1 1 321.779 4.312 20 0 DIADMM CC(C)c1ccc(C(=O)Nc2ccccc2N2CCCC2)c([O-])c1 ZINC001463953615 1061536489 /nfs/dbraw/zinc/53/64/89/1061536489.db2.gz VOIAFCUNGUNSBL-UHFFFAOYSA-N -1 1 324.424 4.368 20 0 DIADMM O=C(c1cccc([O-])c1F)N1CCC[C@@H]1c1ccc(Cl)cc1 ZINC001464020481 1061545514 /nfs/dbraw/zinc/54/55/14/1061545514.db2.gz TXXJHPDRBIVXPE-CQSZACIVSA-N -1 1 319.763 4.162 20 0 DIADMM CCN(C(=O)c1ccc2ccc(O)cc2c1[O-])c1cccc(C)c1 ZINC001464028586 1061546800 /nfs/dbraw/zinc/54/68/00/1061546800.db2.gz SZZDZYUCAKXZAP-UHFFFAOYSA-N -1 1 321.376 4.226 20 0 DIADMM CC(C)CCOc1cccc(NC(=O)c2ccc([O-])cc2F)c1 ZINC001464484968 1061599859 /nfs/dbraw/zinc/59/98/59/1061599859.db2.gz NJPYVHUUVKWFCX-UHFFFAOYSA-N -1 1 317.360 4.209 20 0 DIADMM Cc1ccc(CCNC(=O)c2cc3ccccc3cc2[O-])c(C)c1 ZINC001464500634 1061601032 /nfs/dbraw/zinc/60/10/32/1061601032.db2.gz DHVHABQSIKITLS-UHFFFAOYSA-N -1 1 319.404 4.135 20 0 DIADMM Cc1ccc(Oc2ccc(NC(=O)c3ccc([O-])cn3)cc2)cc1 ZINC001464531100 1061602812 /nfs/dbraw/zinc/60/28/12/1061602812.db2.gz WPSINQCUTMRIDP-UHFFFAOYSA-N -1 1 320.348 4.140 20 0 DIADMM Cc1ccc(S(=O)(=O)[N-]c2ccc3cc(F)ccc3c2)cc1 ZINC001252189613 1061606144 /nfs/dbraw/zinc/60/61/44/1061606144.db2.gz CZICZMRDLMGDDQ-UHFFFAOYSA-N -1 1 315.369 4.088 20 0 DIADMM Cc1ccc(S(=O)(=O)[N-]c2cccc3cccc(C)c32)cc1 ZINC001252206439 1061609012 /nfs/dbraw/zinc/60/90/12/1061609012.db2.gz YNVIQZOMAAEMIX-UHFFFAOYSA-N -1 1 311.406 4.257 20 0 DIADMM CC[C@H](Cc1ccccc1)NC(=O)c1ccc2ccccc2c1[O-] ZINC001464761580 1061632422 /nfs/dbraw/zinc/63/24/22/1061632422.db2.gz SBJNLCDIOQMPHG-QGZVFWFLSA-N -1 1 319.404 4.297 20 0 DIADMM Cc1ccc(-c2nnc(-c3c(O)cc4ccccc4c3[O-])o2)cc1 ZINC001252624654 1061683135 /nfs/dbraw/zinc/68/31/35/1061683135.db2.gz HXCPRYVHAPZEST-UHFFFAOYSA-N -1 1 318.332 4.276 20 0 DIADMM COc1c(Cl)ccc([O-])c1-c1nnc(-c2ccc(C)cc2)o1 ZINC001252690334 1061696673 /nfs/dbraw/zinc/69/66/73/1061696673.db2.gz IUSOIPIICNFFBS-UHFFFAOYSA-N -1 1 316.744 4.080 20 0 DIADMM C[C@H](CCC(C)(C)C)NC(=O)c1ccc(C(F)(F)F)c([O-])c1 ZINC001465257074 1061719975 /nfs/dbraw/zinc/71/99/75/1061719975.db2.gz DZPVJINUPVQDOT-SNVBAGLBSA-N -1 1 317.351 4.356 20 0 DIADMM C[C@@H](CCC(C)(C)C)NC(=O)c1ccc(C(F)(F)F)c([O-])c1 ZINC001465257071 1061720077 /nfs/dbraw/zinc/72/00/77/1061720077.db2.gz DZPVJINUPVQDOT-JTQLQIEISA-N -1 1 317.351 4.356 20 0 DIADMM CN(C(=O)c1cccc([O-])c1F)c1ccc(-c2ccccc2)cc1 ZINC001465541819 1061774715 /nfs/dbraw/zinc/77/47/15/1061774715.db2.gz VHHLBGACPXDTGU-UHFFFAOYSA-N -1 1 321.351 4.475 20 0 DIADMM Cc1cc(Cl)cc(CNc2ccc(-n3ccc(=O)[n-]3)cc2)c1 ZINC001474228839 1061791268 /nfs/dbraw/zinc/79/12/68/1061791268.db2.gz GYUBCNJGIAEJLU-UHFFFAOYSA-N -1 1 313.788 4.152 20 0 DIADMM CC(C)c1ccc(C(=O)Nc2ccc3c(c2)C(=O)CCC3)c([O-])c1 ZINC001465693569 1061796806 /nfs/dbraw/zinc/79/68/06/1061796806.db2.gz FCMWUOTUTMRLRY-UHFFFAOYSA-N -1 1 323.392 4.287 20 0 DIADMM CC(C)CCn1ccc(NC(=O)c2ccc3ccccc3c2[O-])n1 ZINC001465818355 1061816500 /nfs/dbraw/zinc/81/65/00/1061816500.db2.gz XPVYRZFMUKJVBV-UHFFFAOYSA-N -1 1 323.396 4.040 20 0 DIADMM CCCCC[C@H]1CCCN1C(=O)c1ncc2ccccc2c1[O-] ZINC001466009055 1061860219 /nfs/dbraw/zinc/86/02/19/1061860219.db2.gz ITLNARYLWPJBFX-HNNXBMFYSA-N -1 1 312.413 4.125 20 0 DIADMM O=C(CCCCc1cccc(O)c1)Nc1ccc([O-])c(Cl)c1 ZINC001466225705 1061901276 /nfs/dbraw/zinc/90/12/76/1061901276.db2.gz QNLBTMXBIOLZNO-UHFFFAOYSA-N -1 1 319.788 4.103 20 0 DIADMM CC(C)(C)C[C@@H](NC(=O)c1ccc(Cl)cc1[O-])C(F)(F)F ZINC001466490533 1061951633 /nfs/dbraw/zinc/95/16/33/1061951633.db2.gz XGTOWGCGJCFKSN-LLVKDONJSA-N -1 1 323.742 4.143 20 0 DIADMM CCOc1ccc(-c2nnc(-c3cccc(Cl)c3)o2)c([O-])c1 ZINC001253736182 1061966296 /nfs/dbraw/zinc/96/62/96/1061966296.db2.gz WTDOUGQHCAGHQG-UHFFFAOYSA-N -1 1 316.744 4.161 20 0 DIADMM [O-]c1c(-c2nnc(-c3cccc(Cl)c3)o2)ccc2cccnc21 ZINC001253734928 1061966849 /nfs/dbraw/zinc/96/68/49/1061966849.db2.gz IBYFADFIVHLPSG-UHFFFAOYSA-N -1 1 323.739 4.311 20 0 DIADMM Cc1nc(SC[C@H](OC(C)C)c2ccccc2)[n-]c(=O)c1C ZINC001459012662 1061974429 /nfs/dbraw/zinc/97/44/29/1061974429.db2.gz BHAGNNJJTQMJKD-HNNXBMFYSA-N -1 1 318.442 4.057 20 0 DIADMM Cc1nc(S[C@@H](C)c2ccc3c(c2)CCC3)[n-]c(=O)c1C ZINC001459019602 1061978510 /nfs/dbraw/zinc/97/85/10/1061978510.db2.gz WTGWJRRMJARWMM-LBPRGKRZSA-N -1 1 300.427 4.141 20 0 DIADMM CCOc1ccc(NC(=O)Nc2ccc([O-])c(Cl)c2)c(F)c1 ZINC001466884857 1062017091 /nfs/dbraw/zinc/01/70/91/1062017091.db2.gz FMSPRCJWPDVOPA-UHFFFAOYSA-N -1 1 324.739 4.227 20 0 DIADMM CC(C)(CC1CCCCCC1)NC(=O)c1cccc([O-])c1F ZINC001466939614 1062028654 /nfs/dbraw/zinc/02/86/54/1062028654.db2.gz LKSUKMCEEKYJBW-UHFFFAOYSA-N -1 1 307.409 4.400 20 0 DIADMM Fc1cccc(-c2nnc(-c3nc4ccc(Cl)cc4[nH]3)o2)c1 ZINC001254143824 1062033372 /nfs/dbraw/zinc/03/33/72/1062033372.db2.gz BSKQOMLSARSTBT-UHFFFAOYSA-N -1 1 314.707 4.072 20 0 DIADMM [O-]c1ccc(-c2nnc(Cc3ccccc3Cl)o2)c(Cl)c1 ZINC001254336022 1062078412 /nfs/dbraw/zinc/07/84/12/1062078412.db2.gz PVZWQJXMALMMFE-UHFFFAOYSA-N -1 1 321.163 4.340 20 0 DIADMM CC(C)C1(C)CCN(C(=O)c2ccc3ccccc3c2[O-])CC1 ZINC001467294648 1062102323 /nfs/dbraw/zinc/10/23/23/1062102323.db2.gz JWRLRHJYTKECQR-UHFFFAOYSA-N -1 1 311.425 4.444 20 0 DIADMM [O-]c1cccc(-c2nnc(Cc3cccc(Cl)c3)o2)c1Cl ZINC001254485452 1062129168 /nfs/dbraw/zinc/12/91/68/1062129168.db2.gz QPWFEBPLUHOGSU-UHFFFAOYSA-N -1 1 321.163 4.340 20 0 DIADMM Cc1ccc([N-]S(=O)(=O)c2ccccc2C)c2ccccc12 ZINC001254611170 1062198269 /nfs/dbraw/zinc/19/82/69/1062198269.db2.gz HUVOXYYQURKZHN-UHFFFAOYSA-N -1 1 311.406 4.257 20 0 DIADMM O=C(Nc1ccc([O-])c(F)c1F)c1cccc(-c2ccoc2)c1 ZINC001468002853 1062244175 /nfs/dbraw/zinc/24/41/75/1062244175.db2.gz ATGBHXHJPOILCY-UHFFFAOYSA-N -1 1 315.275 4.183 20 0 DIADMM Cc1cc2cc([N-]S(=O)(=O)c3cc(C)ccc3C)ccc2o1 ZINC001254786271 1062249062 /nfs/dbraw/zinc/24/90/62/1062249062.db2.gz IATWAFDHEAYHQQ-UHFFFAOYSA-N -1 1 315.394 4.159 20 0 DIADMM CCCc1ccc(S(=O)(=O)[N-]c2ccc3occc3c2)cc1 ZINC001255218162 1062358403 /nfs/dbraw/zinc/35/84/03/1062358403.db2.gz XJOSPILEEVABBX-UHFFFAOYSA-N -1 1 315.394 4.186 20 0 DIADMM O=C(Nc1cc([O-])c(F)cc1F)c1cscc1C(F)(F)F ZINC001468747884 1062392425 /nfs/dbraw/zinc/39/24/25/1062392425.db2.gz MPLLRGKKHJAOPV-UHFFFAOYSA-N -1 1 323.242 4.003 20 0 DIADMM CC(C)Cc1ccc(C(=O)Nc2cc([O-])c(F)cc2F)cc1 ZINC001468745297 1062393544 /nfs/dbraw/zinc/39/35/44/1062393544.db2.gz PIQHUFWRKCGCAY-UHFFFAOYSA-N -1 1 305.324 4.121 20 0 DIADMM CCCC[C@@H](CCC)C[N-]S(=O)(=O)c1sccc1Cl ZINC001475079715 1062492059 /nfs/dbraw/zinc/49/20/59/1062492059.db2.gz VYDGSRXYFHCSSV-LLVKDONJSA-N -1 1 323.911 4.286 20 0 DIADMM Cc1cc(C)c(/C=C\C(=O)Nc2cc(F)cc(F)c2[O-])cc1C ZINC001469159176 1062492243 /nfs/dbraw/zinc/49/22/43/1062492243.db2.gz CGJYEXUOHWLWJD-PLNGDYQASA-N -1 1 317.335 4.248 20 0 DIADMM [O-]c1c(-c2nnc(Cc3ccccc3F)o2)ccc2ccccc21 ZINC001255776872 1062600354 /nfs/dbraw/zinc/60/03/54/1062600354.db2.gz UITLDTWBBHBVPT-UHFFFAOYSA-N -1 1 320.323 4.325 20 0 DIADMM CCCCCc1nnc(-c2cc(OC(F)(F)F)ccc2[O-])o1 ZINC001256144991 1062726746 /nfs/dbraw/zinc/72/67/46/1062726746.db2.gz UABOJWZMFAVEED-UHFFFAOYSA-N -1 1 316.279 4.074 20 0 DIADMM O=C(Cc1ccc([O-])c(Cl)c1)NC1CCC(C2CCC2)CC1 ZINC001470287576 1062743411 /nfs/dbraw/zinc/74/34/11/1062743411.db2.gz ZSJXVRHYEWNCCP-UHFFFAOYSA-N -1 1 321.848 4.063 20 0 DIADMM CCCCCCc1nnc(-c2c([O-])ccc(Cl)c2OC)o1 ZINC001256390511 1062799717 /nfs/dbraw/zinc/79/97/17/1062799717.db2.gz FHBGKEJRWKZNHI-UHFFFAOYSA-N -1 1 310.781 4.227 20 0 DIADMM CCOc1ccc(-c2nnc(-c3ccc(C)c(C)c3)o2)c([O-])c1 ZINC001256531093 1062851476 /nfs/dbraw/zinc/85/14/76/1062851476.db2.gz JXUFMBOHAVTPAA-UHFFFAOYSA-N -1 1 310.353 4.125 20 0 DIADMM O=C(Cc1cccc(Cl)c1Cl)Nc1cccc(F)c1[O-] ZINC001471166381 1062931464 /nfs/dbraw/zinc/93/14/64/1062931464.db2.gz IBKVQBPEWQKFBW-UHFFFAOYSA-N -1 1 314.143 4.019 20 0 DIADMM CC[C@H](NC(=O)c1ccc(F)c([O-])c1)c1cc(C)ccc1C ZINC001471167825 1062931938 /nfs/dbraw/zinc/93/19/38/1062931938.db2.gz HWCVUYVIEPNQQI-INIZCTEOSA-N -1 1 301.361 4.029 20 0 DIADMM O=S(=O)([N-]c1cccc(C2CC2)c1)c1cccc(Cl)c1 ZINC001256803502 1062992442 /nfs/dbraw/zinc/99/24/42/1062992442.db2.gz FHVBRLQLDVDFRX-UHFFFAOYSA-N -1 1 307.802 4.018 20 0 DIADMM CC(C)=C[C@H]1[C@H](C(=O)Nc2cc(F)c([O-])cc2Cl)C1(C)C ZINC001472193253 1063056045 /nfs/dbraw/zinc/05/60/45/1063056045.db2.gz RXODYLVMQFMIJY-LKFCYVNXSA-N -1 1 311.784 4.362 20 0 DIADMM O=C(Cc1ccc(Cl)cc1)Nc1cc(F)c([O-])cc1Cl ZINC001472192266 1063056516 /nfs/dbraw/zinc/05/65/16/1063056516.db2.gz XHOPSMZLSVFJDM-UHFFFAOYSA-N -1 1 314.143 4.019 20 0 DIADMM Cc1cccc(S(=O)(=O)[N-]c2cccc3sccc32)c1 ZINC001256953979 1063058167 /nfs/dbraw/zinc/05/81/67/1063058167.db2.gz KLEGWHLNOMMMFD-UHFFFAOYSA-N -1 1 303.408 4.011 20 0 DIADMM CC[C@H]1CCCc2sc(NC(=O)c3ccc([O-])cc3F)nc21 ZINC001472220036 1063061380 /nfs/dbraw/zinc/06/13/80/1063061380.db2.gz LGGUBEYYRSZBIF-VIFPVBQESA-N -1 1 320.389 4.070 20 0 DIADMM Cc1ccc2ccc(-c3nnc(CC4CCCCC4)o3)c([O-])c2n1 ZINC001257012215 1063078146 /nfs/dbraw/zinc/07/81/46/1063078146.db2.gz UIETXDVUJAYIPZ-UHFFFAOYSA-N -1 1 323.396 4.422 20 0 DIADMM O=C(Cc1ccc([O-])c(Cl)c1)N1CCC[C@H](C2CCCC2)C1 ZINC001472380965 1063082060 /nfs/dbraw/zinc/08/20/60/1063082060.db2.gz RSUCOBNXXAJKLE-HNNXBMFYSA-N -1 1 321.848 4.017 20 0 DIADMM CCCn1c(C(=O)Nc2ccc(F)cc2[O-])cc2ccccc21 ZINC001472533872 1063098945 /nfs/dbraw/zinc/09/89/45/1063098945.db2.gz DFWLFNBNIKRTEG-UHFFFAOYSA-N -1 1 312.344 4.148 20 0 DIADMM Cc1cc(NC(=O)c2c([O-])cnc3ccc(Cl)cc32)cs1 ZINC001472606844 1063106700 /nfs/dbraw/zinc/10/67/00/1063106700.db2.gz OMIPJCDLUMOKHY-UHFFFAOYSA-N -1 1 318.785 4.216 20 0 DIADMM Cc1ccc([C@@H]2C[C@H]2c2nnc(-c3cc(F)ccc3[O-])o2)cc1 ZINC001257322863 1063201442 /nfs/dbraw/zinc/20/14/42/1063201442.db2.gz BMRIQLRXNLCVTG-UONOGXRCSA-N -1 1 310.328 4.161 20 0 DIADMM Cc1ccc([C@H]2C[C@H]2c2nnc(-c3cc(F)ccc3[O-])o2)cc1 ZINC001257322864 1063204590 /nfs/dbraw/zinc/20/45/90/1063204590.db2.gz BMRIQLRXNLCVTG-ZIAGYGMSSA-N -1 1 310.328 4.161 20 0 DIADMM Cc1ccc([C@H]2C[C@H]2c2nnc(-c3ccc(F)c([O-])c3)o2)cc1 ZINC001257323822 1063206905 /nfs/dbraw/zinc/20/69/05/1063206905.db2.gz JGWLXRMLXWVXHJ-ZIAGYGMSSA-N -1 1 310.328 4.161 20 0 DIADMM CCCc1cc(=O)[n-]c(SCc2ccc(Cl)c(OC)c2)n1 ZINC001472925455 1063317941 /nfs/dbraw/zinc/31/79/41/1063317941.db2.gz KSMQIUFPSPMNKO-UHFFFAOYSA-N -1 1 324.833 4.089 20 0 DIADMM CC[C@@H]1CCCC[C@H]1N(C)C(=O)NCc1ccc([O-])c(Cl)c1 ZINC001479211212 1063400216 /nfs/dbraw/zinc/40/02/16/1063400216.db2.gz FZVOTGNFWGADBO-UKRRQHHQSA-N -1 1 324.852 4.156 20 0 DIADMM Cc1ccc(S(=O)(=O)[N-]c2cc(C)cc(Cl)c2)c(C)c1 ZINC001259101107 1063883430 /nfs/dbraw/zinc/88/34/30/1063883430.db2.gz OOUHVJRPUUNSJJ-UHFFFAOYSA-N -1 1 309.818 4.066 20 0 DIADMM C=Cc1cccc([N-]S(=O)(=O)c2ccc(C)c(Cl)c2)c1 ZINC001259136048 1063884543 /nfs/dbraw/zinc/88/45/43/1063884543.db2.gz NCNBHJASFULQLL-UHFFFAOYSA-N -1 1 307.802 4.092 20 0 DIADMM Cc1ccc(S(=O)(=O)[N-]c2ccccc2C2CC2)cc1Cl ZINC001259129698 1063885452 /nfs/dbraw/zinc/88/54/52/1063885452.db2.gz DXASBRYWRYSPNW-UHFFFAOYSA-N -1 1 321.829 4.327 20 0 DIADMM C[C@H](CCC(=O)Nc1cc(F)cc(F)c1[O-])c1ccccc1 ZINC001299580093 1063887857 /nfs/dbraw/zinc/88/78/57/1063887857.db2.gz CELIBTYKIHVGNT-LLVKDONJSA-N -1 1 305.324 4.193 20 0 DIADMM O=S(=O)([N-]c1cc(-c2ccccc2)cs1)C1CCCCC1 ZINC001259808996 1063893678 /nfs/dbraw/zinc/89/36/78/1063893678.db2.gz CGWMOAYOJJRXRD-UHFFFAOYSA-N -1 1 321.467 4.490 20 0 DIADMM O=C(c1cc2ccccc2cc1[O-])N1CC[C@@H](C2CCCC2)C1 ZINC001299651844 1063899876 /nfs/dbraw/zinc/89/98/76/1063899876.db2.gz YNVCURWARIRNAL-QGZVFWFLSA-N -1 1 309.409 4.198 20 0 DIADMM CC[C@@H](C)S(=O)(=O)[N-]c1ccccc1Oc1ccc(C)cc1 ZINC001260737853 1063904437 /nfs/dbraw/zinc/90/44/37/1063904437.db2.gz AGOWQUYCYDIEED-CQSZACIVSA-N -1 1 319.426 4.328 20 0 DIADMM CCc1cc(Cl)ccc1[N-]S(=O)(=O)c1cccc(C)c1C ZINC001260999345 1063909303 /nfs/dbraw/zinc/90/93/03/1063909303.db2.gz RTOIYEVJZQDDPF-UHFFFAOYSA-N -1 1 323.845 4.320 20 0 DIADMM CC[C@H](CC(=O)Nc1ccc(Br)c([O-])c1)C(C)C ZINC001261361412 1063920889 /nfs/dbraw/zinc/92/08/89/1063920889.db2.gz RALYVTGDQKXSOE-SNVBAGLBSA-N -1 1 314.223 4.166 20 0 DIADMM CC[C@H](Cc1ccccc1C)C(=O)Nc1ccc(F)cc1[O-] ZINC001306799226 1064646236 /nfs/dbraw/zinc/64/62/36/1064646236.db2.gz KEXIROFWCRNLMI-CYBMUJFWSA-N -1 1 301.361 4.047 20 0 DIADMM O=C(NCCC1=CCCCC1)c1ccc(C(F)(F)F)cc1[O-] ZINC001290426116 1064692727 /nfs/dbraw/zinc/69/27/27/1064692727.db2.gz ANGRNSQPAPJBGH-UHFFFAOYSA-N -1 1 313.319 4.031 20 0 DIADMM Cc1cccc([C@H](NC(=O)c2ccc([O-])c(F)c2)C(C)(C)C)c1 ZINC001291927852 1064751463 /nfs/dbraw/zinc/75/14/63/1064751463.db2.gz FHSRPXZBWTZPHE-KRWDZBQOSA-N -1 1 315.388 4.357 20 0 DIADMM Cc1cc(C)cc(C[C@H](C)NC(=O)c2cc(Cl)ccc2[O-])c1 ZINC001294073980 1064847003 /nfs/dbraw/zinc/84/70/03/1064847003.db2.gz QWSGXFCYGGKXCX-ZDUSSCGKSA-N -1 1 317.816 4.023 20 0 DIADMM CC(C)(C)[C@@H]1CN(C(=O)c2cc(F)ccc2[O-])c2ccccc21 ZINC001297186827 1064971347 /nfs/dbraw/zinc/97/13/47/1064971347.db2.gz QPPFYSYKQRBBTM-OAHLLOKOSA-N -1 1 313.372 4.321 20 0 DIADMM C[C@@H](CCc1ccccc1F)C(=O)Nc1ccc([O-])c(F)c1F ZINC001297820877 1064990710 /nfs/dbraw/zinc/99/07/10/1064990710.db2.gz PUGNIHJNBIUGPL-JTQLQIEISA-N -1 1 323.314 4.017 20 0 DIADMM Cc1ccccc1[C@H](C)CC(=O)Nc1ccc([O-])c(F)c1F ZINC001297819671 1064990884 /nfs/dbraw/zinc/99/08/84/1064990884.db2.gz AODKUHBFXFVJMD-LLVKDONJSA-N -1 1 305.324 4.111 20 0 DIADMM CCCN(C(=O)c1ccc([O-])cc1F)c1ccc(CC)cc1 ZINC001298110242 1064996493 /nfs/dbraw/zinc/99/64/93/1064996493.db2.gz BNAFBPYWHJSNFM-UHFFFAOYSA-N -1 1 301.361 4.151 20 0 DIADMM O=C(CCCCc1ccccc1)Nc1cc([O-])c(F)cc1F ZINC001298975597 1065028274 /nfs/dbraw/zinc/02/82/74/1065028274.db2.gz XHQPDFZEGQMOBF-UHFFFAOYSA-N -1 1 305.324 4.022 20 0 DIADMM O=C(Nc1cccc(NC2CCCC2)c1)c1cccc([O-])c1F ZINC001301560313 1065068496 /nfs/dbraw/zinc/06/84/96/1065068496.db2.gz BOMUGUHZDLNYIN-UHFFFAOYSA-N -1 1 314.360 4.138 20 0 DIADMM C/C=C\C[C@H]1CCCN(C(=O)c2cc3ccccc3cc2[O-])C1 ZINC001301885497 1065075396 /nfs/dbraw/zinc/07/53/96/1065075396.db2.gz YNHUERXPXVMUTD-GWQWAINWSA-N -1 1 309.409 4.364 20 0 DIADMM C/C=C/C[C@H]1CCCN(C(=O)c2cc3ccccc3cc2[O-])C1 ZINC001301885496 1065075830 /nfs/dbraw/zinc/07/58/30/1065075830.db2.gz YNHUERXPXVMUTD-FAAWYNLUSA-N -1 1 309.409 4.364 20 0 DIADMM Cc1cccc([C@H](NC(=O)c2c([O-])cccc2Cl)C(C)C)c1 ZINC001302170770 1065080792 /nfs/dbraw/zinc/08/07/92/1065080792.db2.gz FGXFZLRMSRCPRA-QGZVFWFLSA-N -1 1 317.816 4.481 20 0 DIADMM O=C(Nc1cccc(F)c1[O-])c1cc(Cl)c(F)cc1Cl ZINC001302484223 1065087821 /nfs/dbraw/zinc/08/78/21/1065087821.db2.gz ADOKEXUYBSIWNY-UHFFFAOYSA-N -1 1 318.106 4.230 20 0 DIADMM CCCC1(CCC)CCCN1C(=O)c1cc(C)cc(C=O)c1[O-] ZINC001303304847 1065113175 /nfs/dbraw/zinc/11/31/75/1065113175.db2.gz SKNYMEUGOGLJBI-UHFFFAOYSA-N -1 1 317.429 4.088 20 0 DIADMM C[C@H](CN(C)C(=O)c1ccc(C(F)(F)F)cc1[O-])C(C)(C)C ZINC001303376131 1065115273 /nfs/dbraw/zinc/11/52/73/1065115273.db2.gz XWRYNHAJLMXPOF-SNVBAGLBSA-N -1 1 317.351 4.165 20 0 DIADMM O=C(NC(C1CCCC1)C1CCCC1)c1ccc([O-])c(F)c1 ZINC001303927296 1065125245 /nfs/dbraw/zinc/12/52/45/1065125245.db2.gz AYOSTDLJNQWVHH-UHFFFAOYSA-N -1 1 305.393 4.010 20 0 DIADMM Cc1[nH]c2ccccc2c1C(=O)Nc1cc(F)c([O-])cc1Cl ZINC001304284367 1065136145 /nfs/dbraw/zinc/13/61/45/1065136145.db2.gz MAZYVOKFFCHPIR-UHFFFAOYSA-N -1 1 318.735 4.227 20 0 DIADMM O=C(Nc1ccc([O-])c(F)c1F)c1c[nH]c2cc(Cl)ccc21 ZINC001306842730 1065196193 /nfs/dbraw/zinc/19/61/93/1065196193.db2.gz QENXKJNTDTXEGO-UHFFFAOYSA-N -1 1 322.698 4.057 20 0 DIADMM CC[C@H]1c2ccsc2CCN1Cc1ccc([O-])c(F)c1F ZINC001308628083 1066124914 /nfs/dbraw/zinc/12/49/14/1066124914.db2.gz PLXCXLFYDMLIJW-LBPRGKRZSA-N -1 1 309.381 4.241 20 0 DIADMM CCc1ccc(S(=O)(=O)[N-]c2cc(Cl)ccc2C)cc1 ZINC000005262308 181223759 /nfs/dbraw/zinc/22/37/59/181223759.db2.gz SQJHWOSRWXHUDT-UHFFFAOYSA-N -1 1 309.818 4.012 20 0 DIADMM COc1ccc(-c2noc(-c3ccc4ccccc4c3[O-])n2)cc1 ZINC000391577452 335002564 /nfs/dbraw/zinc/00/25/64/335002564.db2.gz AYWLWEKMOUDFBN-UHFFFAOYSA-N -1 1 318.332 4.271 20 0 DIADMM CCCC[C@@H](NCc1ccc(-c2ccc(CC)cc2)o1)C(=O)[O-] ZINC000417597156 335002598 /nfs/dbraw/zinc/00/25/98/335002598.db2.gz MKJKPPAULZPWFE-QGZVFWFLSA-N -1 1 315.413 4.242 20 0 DIADMM CN(C(=O)c1ccc2ccccc2c1[O-])C1CCC(F)(F)CC1 ZINC000289090608 131357241 /nfs/dbraw/zinc/35/72/41/131357241.db2.gz UVVXRXWHRJVPIL-UHFFFAOYSA-N -1 1 319.351 4.195 20 0 DIADMM Cc1c(=O)[n-]c(SCc2ccccc2)nc1-c1ccccc1 ZINC000016853162 335082815 /nfs/dbraw/zinc/08/28/15/335082815.db2.gz RSWGLGWMUVYLEG-UHFFFAOYSA-N -1 1 308.406 4.038 20 0 DIADMM CC[C@@H](Cc1nc(-c2ccc([O-])c(F)c2)no1)c1ccccc1 ZINC000445483077 332040528 /nfs/dbraw/zinc/04/05/28/332040528.db2.gz VATJEFPRNMSOPL-LBPRGKRZSA-N -1 1 312.344 4.318 20 0 DIADMM CCc1ccc(-c2ccc(CN[C@@H](C(=O)[O-])[C@@H](C)CC)o2)cc1 ZINC000426775916 332093711 /nfs/dbraw/zinc/09/37/11/332093711.db2.gz VODFBRBQCDDAHU-SCLBCKFNSA-N -1 1 315.413 4.098 20 0 DIADMM Cc1ccccc1S(=O)(=O)[N-]c1ccccc1NC(C)(C)C ZINC000410404664 332123536 /nfs/dbraw/zinc/12/35/36/332123536.db2.gz VSADPWCTPPKDGG-UHFFFAOYSA-N -1 1 318.442 4.006 20 0 DIADMM Cc1cccc(S(=O)(=O)[N-]c2ccccc2NC(C)(C)C)c1 ZINC000410409041 332124487 /nfs/dbraw/zinc/12/44/87/332124487.db2.gz TVQJQYBOOQMEMQ-UHFFFAOYSA-N -1 1 318.442 4.006 20 0 DIADMM C[C@@H](CC(=O)Nc1ccc(F)cc1[O-])c1c[nH]c2ccccc21 ZINC000426993795 332164835 /nfs/dbraw/zinc/16/48/35/332164835.db2.gz XKIOCGZPBCXVIJ-NSHDSACASA-N -1 1 312.344 4.145 20 0 DIADMM Cc1ccc(S(=O)(=O)[N-]c2cccc(Cl)c2Cl)s1 ZINC000096659760 332208602 /nfs/dbraw/zinc/20/86/02/332208602.db2.gz IYKRUFDLUUUGLU-UHFFFAOYSA-N -1 1 322.238 4.164 20 0 DIADMM C[C@H](Sc1nc(C(F)F)cc(=O)[n-]1)c1nc2ccccc2o1 ZINC000580261190 333043144 /nfs/dbraw/zinc/04/31/44/333043144.db2.gz WUDHUCONBJFSJX-ZETCQYMHSA-N -1 1 323.324 4.114 20 0 DIADMM Cc1ccc(F)cc1[N-]S(=O)(=O)c1cccc(C(C)C)c1 ZINC000460430091 333086015 /nfs/dbraw/zinc/08/60/15/333086015.db2.gz WAXGIVZFTMXCIY-UHFFFAOYSA-N -1 1 307.390 4.058 20 0 DIADMM CSc1ccccc1[N-]S(=O)(=O)c1cccc(C(C)C)c1 ZINC000460435487 333086395 /nfs/dbraw/zinc/08/63/95/333086395.db2.gz JEGRZHGJQFURIP-UHFFFAOYSA-N -1 1 321.467 4.333 20 0 DIADMM CCc1ccccc1[N-]S(=O)(=O)c1cccc(C(C)C)c1 ZINC000460439407 333087463 /nfs/dbraw/zinc/08/74/63/333087463.db2.gz UQUAMYCTINLPBM-UHFFFAOYSA-N -1 1 303.427 4.173 20 0 DIADMM Cc1ccccc1[N-]S(=O)(=O)c1cc(Cl)cc(Cl)c1 ZINC000007052932 333129720 /nfs/dbraw/zinc/12/97/20/333129720.db2.gz AYIGMUSODISZCR-UHFFFAOYSA-N -1 1 316.209 4.103 20 0 DIADMM CCOc1cccc([N-]S(=O)(=O)c2cccc(C(C)C)c2)c1 ZINC000460837441 333148416 /nfs/dbraw/zinc/14/84/16/333148416.db2.gz FHKZDLJCJOJOIB-UHFFFAOYSA-N -1 1 319.426 4.010 20 0 DIADMM [O-]c1c(-c2nc(-c3ccccc3F)no2)ccc2ccccc21 ZINC000390165201 333239199 /nfs/dbraw/zinc/23/91/99/333239199.db2.gz DTPMLOCLIMHGNW-UHFFFAOYSA-N -1 1 306.296 4.402 20 0 DIADMM O=C(c1ccc2ccccc2c1[O-])N1CCC[C@@H]2CCCC[C@H]21 ZINC000319524888 333312414 /nfs/dbraw/zinc/31/24/14/333312414.db2.gz KFDFTNIESJRNEG-MAUKXSAKSA-N -1 1 309.409 4.340 20 0 DIADMM CCc1cc(=O)[n-]c(S[C@H](C)c2ccc3c(c2)CCC3)n1 ZINC000413004025 333825156 /nfs/dbraw/zinc/82/51/56/333825156.db2.gz JSLWASWQGYXGBQ-LLVKDONJSA-N -1 1 300.427 4.087 20 0 DIADMM CC[C@@H](C)N(CC(=O)[O-])Cc1ccc(-c2ccccc2Cl)o1 ZINC000414684067 334068392 /nfs/dbraw/zinc/06/83/92/334068392.db2.gz QJONDYHMTXFKHC-GFCCVEGCSA-N -1 1 321.804 4.285 20 0 DIADMM Cc1cccc2[nH]cc(CC(=O)Nc3ccc([O-])c(Cl)c3)c21 ZINC000111666941 334352715 /nfs/dbraw/zinc/35/27/15/334352715.db2.gz MZRJXYJOMTZTCE-UHFFFAOYSA-N -1 1 314.772 4.017 20 0 DIADMM COc1cc(-c2nc(-c3ccc(C)cc3)no2)cc(Cl)c1[O-] ZINC000443095898 338444285 /nfs/dbraw/zinc/44/42/85/338444285.db2.gz PJFXNMUNJYTFFQ-UHFFFAOYSA-N -1 1 316.744 4.080 20 0 DIADMM CC(C)Oc1ccc(NC(=O)c2ccc([O-])cc2F)c(Cl)c1 ZINC000188336730 334686689 /nfs/dbraw/zinc/68/66/89/334686689.db2.gz PHSHBNANHBVDBU-UHFFFAOYSA-N -1 1 323.751 4.224 20 0 DIADMM COc1cc(C(=O)Nc2ccccc2SC)cc(Cl)c1[O-] ZINC000344776304 335276535 /nfs/dbraw/zinc/27/65/35/335276535.db2.gz PHHFPSGITKEXJK-UHFFFAOYSA-N -1 1 323.801 4.028 20 0 DIADMM C[C@@H](c1nc(-c2ccc([O-])c(F)c2)no1)c1c(F)cccc1F ZINC000445474694 338495986 /nfs/dbraw/zinc/49/59/86/338495986.db2.gz RGCZGAJSOSMITM-MRVPVSSYSA-N -1 1 320.270 4.011 20 0 DIADMM O=C(Nc1ccccc1-c1ccccc1)c1ccc(O)cc1[O-] ZINC000192663540 336258324 /nfs/dbraw/zinc/25/83/24/336258324.db2.gz JGRDRXJVCYXQBO-UHFFFAOYSA-N -1 1 305.333 4.017 20 0 DIADMM C[C@H](CSCc1ccccc1)C(=O)Nc1ccc(F)cc1[O-] ZINC000532701557 336267020 /nfs/dbraw/zinc/26/70/20/336267020.db2.gz FMFZLVVLICKOHS-GFCCVEGCSA-N -1 1 319.401 4.039 20 0 DIADMM COc1ccc2oc([C@@H](C)[N-]c3nc(C(C)C)no3)c(C)c2c1 ZINC000301338408 336301402 /nfs/dbraw/zinc/30/14/02/336301402.db2.gz OXOSLZUUFROCFO-LLVKDONJSA-N -1 1 315.373 4.429 20 0 DIADMM CC(C)(C)c1nc([N-][C@@H](c2nccs2)c2ccccc2)no1 ZINC000302153651 336351210 /nfs/dbraw/zinc/35/12/10/336351210.db2.gz VEEMAZVQRBEPDI-GFCCVEGCSA-N -1 1 314.414 4.025 20 0 DIADMM Cc1nc(-c2ccc(N[C@@H](C)CCC(C)C)nc2)[n-]c(=O)c1C ZINC000302746541 336367659 /nfs/dbraw/zinc/36/76/59/336367659.db2.gz SGKWLYNKDQOCSA-LBPRGKRZSA-N -1 1 314.433 4.098 20 0 DIADMM CCC[C@@H](C)N(C)Cc1csc(-c2ccc(C(=O)[O-])cc2)n1 ZINC000582246690 336393347 /nfs/dbraw/zinc/39/33/47/336393347.db2.gz MRWKOSZHTPJWKE-GFCCVEGCSA-N -1 1 318.442 4.129 20 0 DIADMM CC(C)[C@H]1CCCN(C(=O)c2cc3ccccc3cc2[O-])CC1 ZINC000321718044 337285698 /nfs/dbraw/zinc/28/56/98/337285698.db2.gz HBRPLIDAQALELI-HNNXBMFYSA-N -1 1 311.425 4.444 20 0 DIADMM C/C=C\c1ccc([N-]S(=O)(=O)c2ccccc2SC)cc1 ZINC000564062033 337450963 /nfs/dbraw/zinc/45/09/63/337450963.db2.gz QEKBKPWLHREKDD-UTCJRWHESA-N -1 1 319.451 4.242 20 0 DIADMM CC1(C)C[C@H](c2nc(-c3ccc([O-])cc3Cl)no2)C(C)(C)O1 ZINC000528168149 337791220 /nfs/dbraw/zinc/79/12/20/337791220.db2.gz KPPIEHHTPGOOQO-LLVKDONJSA-N -1 1 322.792 4.157 20 0 DIADMM C[C@H](Cc1ccccc1Cl)C(=O)Nc1ccc(F)cc1[O-] ZINC000533135836 337830470 /nfs/dbraw/zinc/83/04/70/337830470.db2.gz UDGHCZXUZQUOIF-SNVBAGLBSA-N -1 1 307.752 4.002 20 0 DIADMM Cc1ccc2oc(C(=O)Nc3ccc(Cl)cc3[O-])cc2c1 ZINC000533159509 337832125 /nfs/dbraw/zinc/83/21/25/337832125.db2.gz GDTCVIRGLJXYSR-UHFFFAOYSA-N -1 1 301.729 4.353 20 0 DIADMM Cc1ccc(/C=C/c2nc(-c3ccc([O-])cc3Cl)no2)o1 ZINC000445443575 337837693 /nfs/dbraw/zinc/83/76/93/337837693.db2.gz GUBYWHNPXWNLOM-FNORWQNLSA-N -1 1 302.717 4.167 20 0 DIADMM [O-]c1ccc(-c2noc(-c3ccnc(C4CC4)c3)n2)c(Cl)c1 ZINC000445446810 337845411 /nfs/dbraw/zinc/84/54/11/337845411.db2.gz NAIIPUKYNGVZRW-UHFFFAOYSA-N -1 1 313.744 4.035 20 0 DIADMM CC(=O)c1cccc(NC(=O)c2cc3ccccc3cc2[O-])c1 ZINC000005167629 338008265 /nfs/dbraw/zinc/00/82/65/338008265.db2.gz BFPWZQYIFPLUHD-UHFFFAOYSA-N -1 1 305.333 4.000 20 0 DIADMM CSc1cc(-c2nc(-c3ccc([O-])cc3F)no2)ccc1F ZINC000445454484 338017278 /nfs/dbraw/zinc/01/72/78/338017278.db2.gz GFYRMUPAGCYGFT-UHFFFAOYSA-N -1 1 320.320 4.109 20 0 DIADMM C[C@H](Cc1ccccc1F)c1nc(-c2ccc([O-])cc2F)no1 ZINC000445456357 338017452 /nfs/dbraw/zinc/01/74/52/338017452.db2.gz IQTKKAZSKPPGBG-SNVBAGLBSA-N -1 1 316.307 4.067 20 0 DIADMM [O-]c1ccc(-c2noc(-c3ccccc3C(F)(F)F)n2)c(F)c1 ZINC000445457721 338017778 /nfs/dbraw/zinc/01/77/78/338017778.db2.gz ZJXIPYSJSMKVNU-UHFFFAOYSA-N -1 1 324.233 4.267 20 0 DIADMM C[C@H](c1cc2ccccc2o1)c1nc(-c2ccc([O-])cc2F)no1 ZINC000445457402 338018288 /nfs/dbraw/zinc/01/82/88/338018288.db2.gz NHMMSRJKEBRKIZ-SNVBAGLBSA-N -1 1 324.311 4.479 20 0 DIADMM C[C@@H](Cc1cccc(F)c1)c1nc(-c2ccc([O-])cc2F)no1 ZINC000445461351 338022236 /nfs/dbraw/zinc/02/22/36/338022236.db2.gz GLQVIWYIXWGQPF-JTQLQIEISA-N -1 1 316.307 4.067 20 0 DIADMM COC[C@@H](c1ccc(Cl)cc1)[N@H+](C)Cc1cc(O)cc(F)c1 ZINC000426543174 338034500 /nfs/dbraw/zinc/03/45/00/338034500.db2.gz WZXXUAFPZVTIAM-KRWDZBQOSA-N -1 1 323.795 4.004 20 0 DIADMM CCc1ccc(-c2ccc(CN[C@H](CC(C)C)C(=O)[O-])o2)cc1 ZINC000426647692 338036940 /nfs/dbraw/zinc/03/69/40/338036940.db2.gz QAIFKOUKEYAYFQ-QGZVFWFLSA-N -1 1 315.413 4.098 20 0 DIADMM Cc1ccc([C@@H](NCc2ccc(Cl)cc2Cl)C(=O)[O-])cc1 ZINC000426706063 338038630 /nfs/dbraw/zinc/03/86/30/338038630.db2.gz YMVRNDUIGXOCME-OAHLLOKOSA-N -1 1 324.207 4.217 20 0 DIADMM Cc1cc(C)cc([C@H](NCc2ccc(Cl)cc2F)C(=O)[O-])c1 ZINC000426744227 338040311 /nfs/dbraw/zinc/04/03/11/338040311.db2.gz CGRGNSJRGCDAHR-INIZCTEOSA-N -1 1 321.779 4.011 20 0 DIADMM C[C@@H](C(=O)[O-])[C@H](NCc1cccc(Cl)c1F)c1ccccc1 ZINC000426754907 338040892 /nfs/dbraw/zinc/04/08/92/338040892.db2.gz VAXVLVYISPCPNY-BZNIZROVSA-N -1 1 321.779 4.031 20 0 DIADMM C[C@H](C(=O)[O-])[C@H](NCc1ccc(F)cc1Cl)c1ccccc1 ZINC000426758010 338041021 /nfs/dbraw/zinc/04/10/21/338041021.db2.gz GJNALKCUEVPOAD-ZBEGNZNMSA-N -1 1 321.779 4.031 20 0 DIADMM Cc1cc(F)cc(-c2nc3cc(C(F)(F)F)ccc3c(=O)[n-]2)c1 ZINC000431177644 338125007 /nfs/dbraw/zinc/12/50/07/338125007.db2.gz AZSYDQBYPYTXQQ-UHFFFAOYSA-N -1 1 322.261 4.469 20 0 DIADMM CCc1cc(=O)[n-]c(S[C@H]2CCCCc3ccccc32)n1 ZINC000436199092 338261618 /nfs/dbraw/zinc/26/16/18/338261618.db2.gz RNTUEQWPMPKQGW-HNNXBMFYSA-N -1 1 300.427 4.304 20 0 DIADMM O=c1cc(C2CC2)nc(SCc2ccc(C(F)F)cc2)[n-]1 ZINC000436265093 338264369 /nfs/dbraw/zinc/26/43/69/338264369.db2.gz WBHCARCVEFHNNS-UHFFFAOYSA-N -1 1 308.353 4.290 20 0 DIADMM C=Cc1ccc(S(=O)(=O)[N-]c2cccc3ccccc32)cc1 ZINC000436477625 338273721 /nfs/dbraw/zinc/27/37/21/338273721.db2.gz JFGOQHXNBRBYIC-UHFFFAOYSA-N -1 1 309.390 4.284 20 0 DIADMM O=C(c1ccc2ccccc2c1[O-])N1CC2C[C@@H]3CC1C[C@H](C2)C3 ZINC000436537900 338275967 /nfs/dbraw/zinc/27/59/67/338275967.db2.gz GRXBUJHYTSNRQU-KWOWKCNFSA-N -1 1 321.420 4.196 20 0 DIADMM CC(C)N(Cc1ccc(F)cc1)C(=O)c1ccc(Cl)cc1[O-] ZINC000436538767 338276104 /nfs/dbraw/zinc/27/61/04/338276104.db2.gz LBSUOVKIXDUNLU-UHFFFAOYSA-N -1 1 321.779 4.236 20 0 DIADMM CC[C@H](c1ccccc1)N(CC)C(=O)c1cc(F)ccc1[O-] ZINC000436540543 338276171 /nfs/dbraw/zinc/27/61/71/338276171.db2.gz RXMNLPAPXZWIFA-MRXNPFEDSA-N -1 1 301.361 4.145 20 0 DIADMM C[C@@H]1C[C@H](c2ccccc2)CN1C(=O)c1cc(Cl)ccc1[O-] ZINC000436549719 338276700 /nfs/dbraw/zinc/27/67/00/338276700.db2.gz VQIWSUXTPCJTHN-OCCSQVGLSA-N -1 1 315.800 4.064 20 0 DIADMM C[C@@H]1C[C@H]2CCCC[C@H]2N1C(=O)c1ccc2ccccc2c1[O-] ZINC000436551299 338276756 /nfs/dbraw/zinc/27/67/56/338276756.db2.gz MWSYOKNRRTUXBL-DDUZABMNSA-N -1 1 309.409 4.339 20 0 DIADMM CC(C)c1ccc(C(=O)N2CCCc3cc(F)ccc32)c([O-])c1 ZINC000436564914 338277232 /nfs/dbraw/zinc/27/72/32/338277232.db2.gz QAONZJMJFGZBKU-UHFFFAOYSA-N -1 1 313.372 4.248 20 0 DIADMM CC[C@H](Cc1ccccc1)N(C)C(=O)c1ccc(Cl)cc1[O-] ZINC000436592016 338278887 /nfs/dbraw/zinc/27/88/87/338278887.db2.gz SCHRFYTYGFWECR-OAHLLOKOSA-N -1 1 317.816 4.139 20 0 DIADMM CC[C@H]1CCCC[C@H]1c1noc(-c2ccc(OC)cc2[O-])n1 ZINC000436592880 338278968 /nfs/dbraw/zinc/27/89/68/338278968.db2.gz AITWWHMXQFBXBB-WCQYABFASA-N -1 1 302.374 4.135 20 0 DIADMM CC(C)c1ccc(C(=O)Nc2scnc2C2CC2)c([O-])c1 ZINC000436606951 338279557 /nfs/dbraw/zinc/27/95/57/338279557.db2.gz RMNLCNFLBZHNIZ-UHFFFAOYSA-N -1 1 302.399 4.102 20 0 DIADMM Cc1ccc2c(c1)CN(C(=O)c1cc3ccccc3cc1[O-])C2 ZINC000436607108 338279559 /nfs/dbraw/zinc/27/95/59/338279559.db2.gz RSQDYCDRRWJSJJ-UHFFFAOYSA-N -1 1 303.361 4.010 20 0 DIADMM [O-]c1ccc(-c2nc(-c3ccc(O)c4ccccc34)no2)c(F)c1 ZINC000436614452 338280106 /nfs/dbraw/zinc/28/01/06/338280106.db2.gz XSAZHGWGMIKWLI-UHFFFAOYSA-N -1 1 322.295 4.107 20 0 DIADMM [O-]c1ccc(-c2nc(-c3ccc(C(F)(F)F)cc3)no2)c(F)c1 ZINC000436688781 338282983 /nfs/dbraw/zinc/28/29/83/338282983.db2.gz LYBAZADENDEPDK-UHFFFAOYSA-N -1 1 324.233 4.267 20 0 DIADMM COc1cc(-c2nc(CCC(C)(C)C)no2)cc(Cl)c1[O-] ZINC000436688525 338283003 /nfs/dbraw/zinc/28/30/03/338283003.db2.gz OPYYQNNRHPFGGR-UHFFFAOYSA-N -1 1 310.781 4.083 20 0 DIADMM CSCc1cccc(-c2noc(-c3ccc([O-])cc3F)n2)c1 ZINC000436688486 338283077 /nfs/dbraw/zinc/28/30/77/338283077.db2.gz LGTCFDGRMUZZOW-UHFFFAOYSA-N -1 1 316.357 4.111 20 0 DIADMM O=C(Nc1ccc2nc(C(F)F)sc2c1)c1ccccc1[O-] ZINC000436695673 338283152 /nfs/dbraw/zinc/28/31/52/338283152.db2.gz FEYUJGVFFVJOBY-UHFFFAOYSA-N -1 1 320.320 4.192 20 0 DIADMM C[C@H]1CC[C@]2(CCN(C(=O)c3cc4ccccc4cc3[O-])C2)C1 ZINC000436702168 338283267 /nfs/dbraw/zinc/28/32/67/338283267.db2.gz DHHYVYWOAPGINI-XOBRGWDASA-N -1 1 309.409 4.198 20 0 DIADMM C[C@@H]1CC[C@@]2(CCN(C(=O)c3ccc4ccccc4c3[O-])C2)C1 ZINC000436702088 338283420 /nfs/dbraw/zinc/28/34/20/338283420.db2.gz CYMOPIQTADSLQJ-JLTOFOAXSA-N -1 1 309.409 4.198 20 0 DIADMM CC1CCC(N(C(=O)c2ccc(Cl)cc2[O-])C2CC2)CC1 ZINC000436717540 338283826 /nfs/dbraw/zinc/28/38/26/338283826.db2.gz HFJKOBHWBLNPFT-UHFFFAOYSA-N -1 1 307.821 4.229 20 0 DIADMM O=C(Nc1scnc1C1CC1)c1cc2ccccc2cc1[O-] ZINC000436717010 338283828 /nfs/dbraw/zinc/28/38/28/338283828.db2.gz VGFNRROLBIESKK-UHFFFAOYSA-N -1 1 310.378 4.132 20 0 DIADMM CCOCc1cccc(NC(=O)c2ccc3ccccc3c2[O-])c1 ZINC000436715841 338283871 /nfs/dbraw/zinc/28/38/71/338283871.db2.gz YUBAULWHJHZPON-UHFFFAOYSA-N -1 1 321.376 4.334 20 0 DIADMM CCOCc1cccc(NC(=O)c2ccc(C(C)C)cc2[O-])c1 ZINC000436725806 338284281 /nfs/dbraw/zinc/28/42/81/338284281.db2.gz RTAZMUVOSWAHCX-UHFFFAOYSA-N -1 1 313.397 4.304 20 0 DIADMM CN(Cc1cc2ccccc2o1)C(=O)c1ccc(Cl)cc1[O-] ZINC000436730885 338284502 /nfs/dbraw/zinc/28/45/02/338284502.db2.gz YQPFHTCKMQOLBA-UHFFFAOYSA-N -1 1 315.756 4.064 20 0 DIADMM CCN(Cc1cccc(Cl)c1)C(=O)c1ccc(Cl)cc1[O-] ZINC000436748716 338285192 /nfs/dbraw/zinc/28/51/92/338285192.db2.gz UUYJNWYPZMXJPK-UHFFFAOYSA-N -1 1 324.207 4.361 20 0 DIADMM CC[C@@]1(C)CCCN(C(=O)c2ccc(C(F)(F)F)cc2[O-])C1 ZINC000436751732 338285363 /nfs/dbraw/zinc/28/53/63/338285363.db2.gz NMKLVMFOWWEQNK-HNNXBMFYSA-N -1 1 315.335 4.063 20 0 DIADMM C[C@@H]1CN(C(=O)c2ccc(C(F)(F)F)cc2[O-])c2ccccc21 ZINC000436750518 338285460 /nfs/dbraw/zinc/28/54/60/338285460.db2.gz GGIGHVHOBPYVRD-SNVBAGLBSA-N -1 1 321.298 4.175 20 0 DIADMM CCC[C@H]1CCCN(C(=O)c2ccc(C(F)(F)F)cc2[O-])C1 ZINC000436753517 338285565 /nfs/dbraw/zinc/28/55/65/338285565.db2.gz VSRLQNBLOUPRNH-NSHDSACASA-N -1 1 315.335 4.063 20 0 DIADMM CCC(CC)n1nc(C(=O)Nc2ccc(Cl)cc2[O-])cc1C ZINC000436776228 338286681 /nfs/dbraw/zinc/28/66/81/338286681.db2.gz JQXKAEMNZSWYFU-UHFFFAOYSA-N -1 1 321.808 4.164 20 0 DIADMM O=C([O-])c1cnc(/C=C/c2cc(Cl)c(O)cc2Cl)s1 ZINC000436774189 338287024 /nfs/dbraw/zinc/28/70/24/338287024.db2.gz SIRQSLCKKCTDAF-OWOJBTEDSA-N -1 1 316.165 4.024 20 0 DIADMM CN(C(=O)c1ccc(C(F)(F)F)cc1[O-])C1CCCCCC1 ZINC000436789106 338287405 /nfs/dbraw/zinc/28/74/05/338287405.db2.gz CIWNIBKVXAYHQO-UHFFFAOYSA-N -1 1 315.335 4.206 20 0 DIADMM O=C(N[C@H]1CSc2ccccc21)c1ccc2ccccc2c1[O-] ZINC000436852464 338289826 /nfs/dbraw/zinc/28/98/26/338289826.db2.gz OSKOTNIYBCLVDK-INIZCTEOSA-N -1 1 321.401 4.122 20 0 DIADMM CSc1ccccc1CN(C)C(=O)c1cc(Cl)ccc1[O-] ZINC000436849172 338289850 /nfs/dbraw/zinc/28/98/50/338289850.db2.gz DPSSPVLPQOAAGT-UHFFFAOYSA-N -1 1 321.829 4.040 20 0 DIADMM CC[C@@H]1CCCC[C@@H]1OCc1nc(-c2ccc([O-])c(F)c2)no1 ZINC000436870853 338290836 /nfs/dbraw/zinc/29/08/36/338290836.db2.gz GKNFQUPXLBQMHO-ABAIWWIYSA-N -1 1 320.364 4.067 20 0 DIADMM CC[C@@H]1CCCC[C@H]1OCc1nc(-c2ccc([O-])c(F)c2)no1 ZINC000436870855 338290853 /nfs/dbraw/zinc/29/08/53/338290853.db2.gz GKNFQUPXLBQMHO-IAQYHMDHSA-N -1 1 320.364 4.067 20 0 DIADMM CCc1ccc(-c2nc(-c3ccc([O-])cc3Cl)no2)c(O)c1 ZINC000436870656 338290869 /nfs/dbraw/zinc/29/08/69/338290869.db2.gz QTEVVYKBXPPNTK-UHFFFAOYSA-N -1 1 316.744 4.031 20 0 DIADMM [O-]c1ccc(-c2noc(-c3cc4[nH]ccc4s3)n2)c(Cl)c1 ZINC000436873330 338290976 /nfs/dbraw/zinc/29/09/76/338290976.db2.gz PEHBMEIMUHPSJL-UHFFFAOYSA-N -1 1 317.757 4.305 20 0 DIADMM Cc1ccc([C@@H]2C[C@@H](C)CCN2C(=O)c2ccc([O-])cc2F)o1 ZINC000436877624 338291195 /nfs/dbraw/zinc/29/11/95/338291195.db2.gz BLDIFDXHENWAOZ-ZBEGNZNMSA-N -1 1 317.360 4.046 20 0 DIADMM [O-]c1ccc(-c2noc(-c3sccc3C3CC3)n2)cc1F ZINC000436878224 338291285 /nfs/dbraw/zinc/29/12/85/338291285.db2.gz JBEONXGGNXESFB-UHFFFAOYSA-N -1 1 302.330 4.187 20 0 DIADMM C[C@H]1[C@H](c2nc(-c3ccc([O-])cc3F)no2)[C@H]1c1ccccc1 ZINC000436878138 338291290 /nfs/dbraw/zinc/29/12/90/338291290.db2.gz IMTFVBJBGHEHCJ-GTTSAUCSSA-N -1 1 310.328 4.098 20 0 DIADMM [O-]c1ccc(-c2noc(/C=C/c3ccc(F)c(F)c3)n2)c(F)c1 ZINC000436876520 338291317 /nfs/dbraw/zinc/29/13/17/338291317.db2.gz ZWRDIEWFSMAPSJ-QHHAFSJGSA-N -1 1 318.254 4.030 20 0 DIADMM CC(C)N(Cc1cccc(Cl)c1)C(=O)c1ccc([O-])cc1F ZINC000436878920 338291448 /nfs/dbraw/zinc/29/14/48/338291448.db2.gz VSAGKPUURXZPBG-UHFFFAOYSA-N -1 1 321.779 4.236 20 0 DIADMM CC(C)Oc1ccc(NC(=O)c2ccccc2[O-])c(Cl)c1 ZINC000436896162 338292555 /nfs/dbraw/zinc/29/25/55/338292555.db2.gz XFUJLVNGYXURQO-UHFFFAOYSA-N -1 1 305.761 4.085 20 0 DIADMM O=C(c1cc2ccccc2cc1[O-])N(CC1CC1)CC1CCC1 ZINC000436928679 338294028 /nfs/dbraw/zinc/29/40/28/338294028.db2.gz BVWFCBUKDFUELP-UHFFFAOYSA-N -1 1 309.409 4.198 20 0 DIADMM CN(C(=O)c1ccc2ccccc2c1[O-])c1ccc2cc[nH]c2c1 ZINC000437003355 338297348 /nfs/dbraw/zinc/29/73/48/338297348.db2.gz STMRUUHXEKMNBQ-UHFFFAOYSA-N -1 1 316.360 4.303 20 0 DIADMM C[C@@H](CCc1ccccc1F)C(=O)Nc1ccc([O-])c(Cl)c1 ZINC000440783616 338397192 /nfs/dbraw/zinc/39/71/92/338397192.db2.gz YAIGXNLGTVKARZ-NSHDSACASA-N -1 1 321.779 4.392 20 0 DIADMM CCCc1cc(=O)[nH]c(C(=Cc2cccc([O-])c2Cl)CC)n1 ZINC000453025900 338786674 /nfs/dbraw/zinc/78/66/74/338786674.db2.gz MKKDEHKWSCQLQD-LUAWRHEFSA-N -1 1 318.804 4.444 20 0 DIADMM CC[C@H](CC(F)(F)F)c1nc(-c2ccc([O-])cc2F)no1 ZINC000453168563 338802068 /nfs/dbraw/zinc/80/20/68/338802068.db2.gz CIYHFHNWBCOBLA-SSDOTTSWSA-N -1 1 304.243 4.027 20 0 DIADMM Cc1cccc2c1N(C(=O)c1cc3ccccc3cc1[O-])CC2 ZINC000195637700 338912263 /nfs/dbraw/zinc/91/22/63/338912263.db2.gz PETFWOHQFGCTMZ-UHFFFAOYSA-N -1 1 303.361 4.057 20 0 DIADMM O=C(Nc1ccc([O-])c(F)c1F)[C@@H]1CCC[C@H]2CCCC[C@H]21 ZINC000456781764 338940400 /nfs/dbraw/zinc/94/04/00/338940400.db2.gz JOZLMMBFXXSTHO-IJLUTSLNSA-N -1 1 309.356 4.215 20 0 DIADMM Cc1ccccc1C1(C(=O)Nc2ccc([O-])c(F)c2F)CCC1 ZINC000456788800 338940895 /nfs/dbraw/zinc/94/08/95/338940895.db2.gz SLYFGMLPKXJMRJ-UHFFFAOYSA-N -1 1 317.335 4.039 20 0 DIADMM O=C(Nc1ccc([O-])c(F)c1F)[C@@H]1CC[C@@H]2CCCC[C@H]2C1 ZINC000456789112 338940924 /nfs/dbraw/zinc/94/09/24/338940924.db2.gz SQDNIDJKNPKNMS-SDDRHHMPSA-N -1 1 309.356 4.215 20 0 DIADMM CC(C)[C@H](CC(=O)Nc1ccc([O-])c(F)c1F)c1ccccc1 ZINC000456795780 338941100 /nfs/dbraw/zinc/94/11/00/338941100.db2.gz UPGSCHXUGXLQDA-ZDUSSCGKSA-N -1 1 319.351 4.439 20 0 DIADMM Cc1c(=O)[n-]c(S[C@@H](C)c2cccnc2)nc1-c1ccccc1 ZINC000467210081 339228506 /nfs/dbraw/zinc/22/85/06/339228506.db2.gz BMEKYCRMJLSHQC-ZDUSSCGKSA-N -1 1 323.421 4.406 20 0 DIADMM Cc1ccc(S(=O)(=O)[N-]c2ccccc2SC(C)C)cc1 ZINC000471137306 339338117 /nfs/dbraw/zinc/33/81/17/339338117.db2.gz RSJVZDYWVMQLAF-UHFFFAOYSA-N -1 1 321.467 4.296 20 0 DIADMM CCCOc1ccccc1NC(=O)Nc1ccc([O-])c(Cl)c1 ZINC000476375930 339475670 /nfs/dbraw/zinc/47/56/70/339475670.db2.gz NZCQPBTXIPSBGI-UHFFFAOYSA-N -1 1 320.776 4.478 20 0 DIADMM CC[C@H](C)Oc1ccc(-c2nc3cccc(C)c3c(=O)[n-]2)cc1 ZINC000481199090 339598272 /nfs/dbraw/zinc/59/82/72/339598272.db2.gz OZFMTCGSVAWVKB-ZDUSSCGKSA-N -1 1 308.381 4.076 20 0 DIADMM CC[C@H](CC(=O)Nc1ccc(F)cc1[O-])c1ccc(OC)cc1 ZINC000505620343 340173344 /nfs/dbraw/zinc/17/33/44/340173344.db2.gz NQIUCOWENFWMHM-GFCCVEGCSA-N -1 1 317.360 4.062 20 0 DIADMM CCC[N@H+](Cc1cccc([O-])c1Cl)[C@@H]1[C@@H]2CCO[C@@H]2C1(C)C ZINC000508718440 340251417 /nfs/dbraw/zinc/25/14/17/340251417.db2.gz LEMLAULSOYEAEN-XKQJLSEDSA-N -1 1 323.864 4.071 20 0 DIADMM CCOc1ccc2c(c1)CCN(Cc1cccc([O-])c1Cl)C2 ZINC000508790910 340253082 /nfs/dbraw/zinc/25/30/82/340253082.db2.gz VNNFKMIGFZKPAN-UHFFFAOYSA-N -1 1 317.816 4.003 20 0 DIADMM [O-]c1cccc(CN(Cc2ccccc2)CC(F)F)c1Cl ZINC000508810073 340253615 /nfs/dbraw/zinc/25/36/15/340253615.db2.gz GMQPYHWISDVQFC-UHFFFAOYSA-N -1 1 311.759 4.313 20 0 DIADMM Cc1csc2[n-]c([C@H](F)c3ccc(Cl)cc3)nc(=O)c12 ZINC000509073981 340260418 /nfs/dbraw/zinc/26/04/18/340260418.db2.gz FPVJENRXAUYNQR-LLVKDONJSA-N -1 1 308.765 4.418 20 0 DIADMM O=C(Nc1ccc([O-])c(Cl)c1)c1ccc(-c2ccccc2)[nH]1 ZINC000509165398 340262749 /nfs/dbraw/zinc/26/27/49/340262749.db2.gz JVQSVHYDWXQECP-UHFFFAOYSA-N -1 1 312.756 4.293 20 0 DIADMM O=C(Nc1ccc([O-])c(Cl)c1)[C@@H]1CCSc2ccccc21 ZINC000509167096 340262961 /nfs/dbraw/zinc/26/29/61/340262961.db2.gz MZWYAVRRYALAAT-GFCCVEGCSA-N -1 1 319.813 4.264 20 0 DIADMM O=C(Nc1ccc(COC2CCCC2)cc1)c1ccccc1[O-] ZINC000303785374 340346910 /nfs/dbraw/zinc/34/69/10/340346910.db2.gz JDAVRCGTZLDVTB-UHFFFAOYSA-N -1 1 311.381 4.104 20 0 DIADMM Cc1ccc2nc(-c3ccc(C(F)(F)F)c(F)c3)[n-]c(=O)c2c1 ZINC000178353309 340448618 /nfs/dbraw/zinc/44/86/18/340448618.db2.gz DUSPBLLUZRHHSY-UHFFFAOYSA-N -1 1 322.261 4.056 20 0 DIADMM O=S(=O)([N-]c1cccc(C(F)F)c1)c1ccc(Cl)cc1 ZINC000195451953 340580030 /nfs/dbraw/zinc/58/00/30/340580030.db2.gz IZAMMENZGVZWNO-UHFFFAOYSA-N -1 1 317.744 4.078 20 0 DIADMM [O-]c1ccc(F)cc1-c1nc([C@@H]2CCCc3ccccc32)no1 ZINC000322428571 340704747 /nfs/dbraw/zinc/70/47/47/340704747.db2.gz NZPNYBPRGHGTMH-CQSZACIVSA-N -1 1 310.328 4.050 20 0 DIADMM O=C(COC1CCCC1)Nc1cc(Cl)c([O-])c2ccccc12 ZINC000529538385 340760794 /nfs/dbraw/zinc/76/07/94/340760794.db2.gz BNDRGNFPIYFFSJ-UHFFFAOYSA-N -1 1 319.788 4.097 20 0 DIADMM CC[C@H]1CC[C@H](C(=O)Nc2cc(Cl)c([O-])c3ccccc23)O1 ZINC000529539784 340761139 /nfs/dbraw/zinc/76/11/39/340761139.db2.gz UGRBVTZNWAMGSF-ZUZCIYMTSA-N -1 1 319.788 4.095 20 0 DIADMM C[C@H](c1ccccc1F)N(C)C(=O)c1ccc(Cl)cc1[O-] ZINC000063240174 340797574 /nfs/dbraw/zinc/79/75/74/340797574.db2.gz FQXVKECDKPRUQZ-SNVBAGLBSA-N -1 1 307.752 4.018 20 0 DIADMM Cc1nc(C(C)(C)C)sc1C(=O)Nc1ccc([O-])c(Cl)c1 ZINC000540959622 340953398 /nfs/dbraw/zinc/95/33/98/340953398.db2.gz NIIWOVUJFPKMNF-UHFFFAOYSA-N -1 1 324.833 4.360 20 0 DIADMM CC(C)(C)[C@H]1CCCN(C(=O)c2ccc(Cl)cc2[O-])CC1 ZINC000071202749 341025453 /nfs/dbraw/zinc/02/54/53/341025453.db2.gz NVSOUVJGEAZYLN-LBPRGKRZSA-N -1 1 309.837 4.334 20 0 DIADMM Cc1ccc(CN(C)C(=O)c2cc3ccccc3cc2[O-])s1 ZINC000076175428 341203290 /nfs/dbraw/zinc/20/32/90/341203290.db2.gz XKVQSSMXNAPDOC-UHFFFAOYSA-N -1 1 311.406 4.188 20 0 DIADMM O=C([N-]c1c(F)cccc1F)c1nc(-c2ccccc2)cs1 ZINC000077923620 341232713 /nfs/dbraw/zinc/23/27/13/341232713.db2.gz YXGOTTNJVKXXFG-UHFFFAOYSA-N -1 1 316.332 4.341 20 0 DIADMM Cc1cc(Br)c([O-])c(NC(=O)C2=CCCCCC2)c1 ZINC000547837428 341236844 /nfs/dbraw/zinc/23/68/44/341236844.db2.gz MDWLXMPQTQGQOP-UHFFFAOYSA-N -1 1 324.218 4.292 20 0 DIADMM CN(Cc1csc2ccccc12)C(=O)c1cc(F)ccc1[O-] ZINC000080003100 341268391 /nfs/dbraw/zinc/26/83/91/341268391.db2.gz IZACAZYULSYIHM-UHFFFAOYSA-N -1 1 315.369 4.018 20 0 DIADMM CCC[C@H](C)C(=O)Nc1c([O-])cc(Br)cc1Cl ZINC000552196260 341377745 /nfs/dbraw/zinc/37/77/45/341377745.db2.gz RYFIGAKCZUDSBK-ZETCQYMHSA-N -1 1 320.614 4.183 20 0 DIADMM CCc1onc(C)c1[N-]C(=O)c1ccc(Oc2ccccc2)o1 ZINC000089408925 341404136 /nfs/dbraw/zinc/40/41/36/341404136.db2.gz ZXELOSUUWRILCM-UHFFFAOYSA-N -1 1 312.325 4.183 20 0 DIADMM Cc1nnc(-c2cccc(NCc3cccc([O-])c3Cl)c2)o1 ZINC000339314583 526318985 /nfs/dbraw/zinc/31/89/85/526318985.db2.gz LYAKFBZEMXCNKN-UHFFFAOYSA-N -1 1 315.760 4.016 20 0 DIADMM [O-]c1cc(F)c(Nc2c(Cl)cnnc2Cl)cc1Cl ZINC001250020162 1060541926 /nfs/dbraw/zinc/54/19/26/1060541926.db2.gz NAZXTONDQKSQLA-UHFFFAOYSA-N -1 1 308.527 4.025 20 0 DIADMM C[C@H](c1cc(Cl)ccc1Cl)[N@H+]1C[C@@H](C)[C@H](CC(=O)[O-])C1 ZINC000722634224 1035745743 /nfs/dbraw/zinc/74/57/43/1035745743.db2.gz GIMSQBJHPFXYIB-GMTAPVOTSA-N -1 1 316.228 4.097 20 0 DIADMM CC(C)Sc1c(Cl)cccc1NC(=O)c1cncc([O-])c1 ZINC000339897879 1036035989 /nfs/dbraw/zinc/03/59/89/1036035989.db2.gz XIQVKQLQWVZSET-UHFFFAOYSA-N -1 1 322.817 4.193 20 0 DIADMM Cc1cc(C)c(-c2noc(-c3ccc4ccccc4c3[O-])n2)cn1 ZINC000397402737 1036360126 /nfs/dbraw/zinc/36/01/26/1036360126.db2.gz FRYQPAUHTJDSJW-UHFFFAOYSA-N -1 1 317.348 4.274 20 0 DIADMM C[C@@H](c1ccc(Cl)c(Cl)c1)N1CCC(CC(=O)[O-])CC1 ZINC000093682322 1036387456 /nfs/dbraw/zinc/38/74/56/1036387456.db2.gz CFIIGBRRHHJDHW-JTQLQIEISA-N -1 1 316.228 4.241 20 0 DIADMM O=C([O-])CCC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1 ZINC000050926069 1036458932 /nfs/dbraw/zinc/45/89/32/1036458932.db2.gz GNRLXAVUSSFHTC-UHFFFAOYSA-N -1 1 316.228 4.070 20 0 DIADMM [O-]c1c(Cl)c(Cl)ccc1Nc1cc(F)ccc1CO ZINC001210184538 1036466192 /nfs/dbraw/zinc/46/61/92/1036466192.db2.gz ZCDXNFAAVNDLIR-UHFFFAOYSA-N -1 1 302.132 4.074 20 0 DIADMM CC(C)Oc1ccc(-c2nc(-c3ccc([O-])c(F)c3)no2)cc1 ZINC000683594285 1036532098 /nfs/dbraw/zinc/53/20/98/1036532098.db2.gz VNIODINBYJCSSR-UHFFFAOYSA-N -1 1 314.316 4.036 20 0 DIADMM CC(C)c1cc(Cl)ccc1NC(=O)c1ccc(O)cc1[O-] ZINC001167304641 1036571158 /nfs/dbraw/zinc/57/11/58/1036571158.db2.gz KUCPSKBZIMBRHW-UHFFFAOYSA-N -1 1 305.761 4.127 20 0 DIADMM O=C(Nc1cccc(F)c1[O-])c1cc2c(cccc2F)s1 ZINC001648847177 1036629585 /nfs/dbraw/zinc/62/95/85/1036629585.db2.gz LJOVWYHULPDPKC-UHFFFAOYSA-N -1 1 305.305 4.137 20 0 DIADMM CCCc1ccc(CCCC(=O)Nc2cccc(F)c2[O-])cc1 ZINC001648851218 1036640378 /nfs/dbraw/zinc/64/03/78/1036640378.db2.gz ZBTHACAEBIUZOL-UHFFFAOYSA-N -1 1 315.388 4.445 20 0 DIADMM Nc1c(F)cc(Nc2cc(Cl)cc(Cl)c2[O-])cc1F ZINC001210909508 1037037187 /nfs/dbraw/zinc/03/71/87/1037037187.db2.gz LPVNUGIYRMJKJV-UHFFFAOYSA-N -1 1 305.111 4.303 20 0 DIADMM FC(F)(F)c1cc(Br)cnc1[N-]c1nccs1 ZINC001210989877 1037084199 /nfs/dbraw/zinc/08/41/99/1037084199.db2.gz SKNLCBDQXUUWIR-UHFFFAOYSA-N -1 1 324.125 4.063 20 0 DIADMM COc1ncc(Nc2cc(Cl)cc(Cl)c2[O-])cc1Cl ZINC001211048072 1037111262 /nfs/dbraw/zinc/11/12/62/1037111262.db2.gz IBSWKEHCOVQVEL-UHFFFAOYSA-N -1 1 319.575 4.500 20 0 DIADMM CCc1nc(S[C@@H](C)c2c(F)cccc2F)[n-]c(=O)c1C ZINC000580660967 1037240907 /nfs/dbraw/zinc/24/09/07/1037240907.db2.gz YRYBDWFPEFTZSN-VIFPVBQESA-N -1 1 310.369 4.185 20 0 DIADMM Cc1cc2[n-]c(CCCc3c(F)cccc3F)nc(=O)c2s1 ZINC000656491373 1037542912 /nfs/dbraw/zinc/54/29/12/1037542912.db2.gz MJRNJKSCPZTEJQ-UHFFFAOYSA-N -1 1 320.364 4.159 20 0 DIADMM CCC[C@@H](C)C[C@@H](NCc1cc2cccc(CC)c2o1)C(=O)[O-] ZINC000656574810 1037657086 /nfs/dbraw/zinc/65/70/86/1037657086.db2.gz ZHTBVMCQMYMXLM-CXAGYDPISA-N -1 1 317.429 4.364 20 0 DIADMM CC[C@H](C)c1ccccc1OCC(=O)Nc1c([O-])cccc1F ZINC000605440734 1038516313 /nfs/dbraw/zinc/51/63/13/1038516313.db2.gz ZNTGSFDAVKTAQD-LBPRGKRZSA-N -1 1 317.360 4.062 20 0 DIADMM CCCCCOc1ccc(C(=O)Nc2c([O-])cccc2F)cc1 ZINC000608365502 1038828590 /nfs/dbraw/zinc/82/85/90/1038828590.db2.gz GDLNMZOASNUSBV-UHFFFAOYSA-N -1 1 317.360 4.353 20 0 DIADMM COCOc1ccccc1Nc1cc(Cl)c([O-])cc1Cl ZINC001211564540 1039088940 /nfs/dbraw/zinc/08/89/40/1039088940.db2.gz HIOUJJURUJUQOO-UHFFFAOYSA-N -1 1 314.168 4.425 20 0 DIADMM CCN(c1ccc(C(=O)Nc2ccc(F)cc2[O-])cc1)C(C)C ZINC000535419922 1039205637 /nfs/dbraw/zinc/20/56/37/1039205637.db2.gz ZFMYTGJEHVXKMH-UHFFFAOYSA-N -1 1 316.376 4.018 20 0 DIADMM CC(C)(C)SCCCc1nc(-c2ccc([O-])c(F)c2)no1 ZINC000278138528 1039208538 /nfs/dbraw/zinc/20/85/38/1039208538.db2.gz LAGLSJAAWGPVGN-UHFFFAOYSA-N -1 1 310.394 4.046 20 0 DIADMM CCC(C)(C)[C@H](NCc1ccc(-c2ccc(C)cc2)o1)C(=O)[O-] ZINC000583440982 1039326644 /nfs/dbraw/zinc/32/66/44/1039326644.db2.gz HDPGLKWEBWHTSA-QGZVFWFLSA-N -1 1 315.413 4.234 20 0 DIADMM O=C([N-]c1c(F)cc(F)cc1F)c1nc(Cl)ccc1Cl ZINC000088721100 1039581409 /nfs/dbraw/zinc/58/14/09/1039581409.db2.gz PYWMOFFMNABEHL-UHFFFAOYSA-N -1 1 321.085 4.058 20 0 DIADMM CC[C@@H](Cc1ccccc1)C(=O)Nc1ccc([O-])c(Cl)c1 ZINC000541887684 1039756140 /nfs/dbraw/zinc/75/61/40/1039756140.db2.gz FMYTZPGCMHLXQB-ZDUSSCGKSA-N -1 1 303.789 4.253 20 0 DIADMM CSc1cc(C(=O)Nc2ccc([O-])c(Cl)c2)ccc1F ZINC000152310556 1040032313 /nfs/dbraw/zinc/03/23/13/1040032313.db2.gz JDQJEVCGDQLDPH-UHFFFAOYSA-N -1 1 311.765 4.159 20 0 DIADMM O=C(Nc1cc(Cl)c([O-])c2ccccc12)[C@@H]1CC12CCC2 ZINC000628233383 1040520523 /nfs/dbraw/zinc/52/05/23/1040520523.db2.gz YJCGWNIEXQYGIH-LBPRGKRZSA-N -1 1 301.773 4.328 20 0 DIADMM Cc1ccc(C(C)(C)CNC(=O)c2c([O-])cccc2Cl)cc1 ZINC000728609656 1040539096 /nfs/dbraw/zinc/53/90/96/1040539096.db2.gz NNUVBUBWKTVKPJ-UHFFFAOYSA-N -1 1 317.816 4.062 20 0 DIADMM Cc1nc(NC(=O)c2ccc([O-])c(F)c2)ccc1-c1ccccc1 ZINC000685891255 1041018199 /nfs/dbraw/zinc/01/81/99/1041018199.db2.gz WSODAKXQNWHDBW-UHFFFAOYSA-N -1 1 322.339 4.154 20 0 DIADMM C[C@@]1(F)CCCN(Cc2cc(Cl)c([O-])c(Cl)c2)CC1 ZINC001140830583 1041111197 /nfs/dbraw/zinc/11/11/97/1041111197.db2.gz ZEMUGNKNMCTBNV-CQSZACIVSA-N -1 1 306.208 4.413 20 0 DIADMM CC(C)CCOc1ccc(C=C2SC(=S)[N-]C2=O)cc1 ZINC000023723523 1041281848 /nfs/dbraw/zinc/28/18/48/1041281848.db2.gz XAHBPLXTYDNHNV-LCYFTJDESA-N -1 1 307.440 4.441 20 0 DIADMM N#CCCCOc1cccc(NCc2cccc(Cl)c2[O-])c1 ZINC000180857932 1041358956 /nfs/dbraw/zinc/35/89/56/1041358956.db2.gz KOKOMZBHPGFPKC-UHFFFAOYSA-N -1 1 316.788 4.340 20 0 DIADMM Cc1c(Cl)nccc1NC(=O)Nc1ccc([O-])c(Cl)c1 ZINC000810294554 1041366902 /nfs/dbraw/zinc/36/69/02/1041366902.db2.gz VWWIIXLMXPUVRY-UHFFFAOYSA-N -1 1 312.156 4.046 20 0 DIADMM [O-]c1cccc(CNc2ccc(N3CCCC3)c(F)c2)c1Cl ZINC000328278975 1041430715 /nfs/dbraw/zinc/43/07/15/1041430715.db2.gz YMJCNRGICCNOSU-UHFFFAOYSA-N -1 1 320.795 4.397 20 0 DIADMM O=C(Nc1cc([O-])c(F)cc1F)c1cc(Cl)sc1Cl ZINC001625894011 1041499147 /nfs/dbraw/zinc/49/91/47/1041499147.db2.gz OFKKPJLULRTQTA-UHFFFAOYSA-N -1 1 324.135 4.291 20 0 DIADMM Cc1[nH]c2ccc(C(=O)Nc3cc([O-])c(F)cc3F)cc2c1C ZINC001625894094 1041501978 /nfs/dbraw/zinc/50/19/78/1041501978.db2.gz RNWHSYKHWLUWHZ-UHFFFAOYSA-N -1 1 316.307 4.021 20 0 DIADMM Cc1ccc2cc(C(=O)Nc3ccc([O-])c(Cl)c3)ccc2n1 ZINC000182865314 1041574511 /nfs/dbraw/zinc/57/45/11/1041574511.db2.gz HVZJIIZUIYGTOD-UHFFFAOYSA-N -1 1 312.756 4.155 20 0 DIADMM Oc1ccc(Cl)c(F)c1C[NH2+][C@@H]1CCCOc2ccccc21 ZINC000190915897 1041720246 /nfs/dbraw/zinc/72/02/46/1041720246.db2.gz PYCUCVSRMXMVGQ-CQSZACIVSA-N -1 1 321.779 4.188 20 0 DIADMM Cc1nc(Cl)ccc1NC(=O)Nc1ccc([O-])c(Cl)c1 ZINC000194605228 1041790382 /nfs/dbraw/zinc/79/03/82/1041790382.db2.gz DELMSGQGNMDJOU-UHFFFAOYSA-N -1 1 312.156 4.046 20 0 DIADMM COC(=O)Nc1cccc(NCc2cccc([O-])c2Cl)c1C ZINC000815139439 1041925753 /nfs/dbraw/zinc/92/57/53/1041925753.db2.gz FXNPGAIRGBLRNX-UHFFFAOYSA-N -1 1 320.776 4.144 20 0 DIADMM CC(F)(F)C(=O)[N-][C@H](c1cccc2ccccc21)C(F)(F)F ZINC000816030811 1042016500 /nfs/dbraw/zinc/01/65/00/1042016500.db2.gz COQHBOJWMKZEHS-GFCCVEGCSA-N -1 1 317.257 4.215 20 0 DIADMM Cc1cc(Cl)ccc1S(=O)(=O)[N-]c1cccc(Cl)c1 ZINC000048652450 1042018222 /nfs/dbraw/zinc/01/82/22/1042018222.db2.gz JHQBNGYCLWKQOQ-UHFFFAOYSA-N -1 1 316.209 4.103 20 0 DIADMM O=C(NCC(C1CCC1)C1CCC1)c1cc2ccccc2cc1[O-] ZINC001167787306 1042065265 /nfs/dbraw/zinc/06/52/65/1042065265.db2.gz ILAUQXCZOCBZSJ-UHFFFAOYSA-N -1 1 323.436 4.492 20 0 DIADMM Cc1c(Cl)cccc1[N-]S(=O)(=O)c1cccc(Cl)c1 ZINC000007402814 1042178887 /nfs/dbraw/zinc/17/88/87/1042178887.db2.gz APURWKYYNZYDHU-UHFFFAOYSA-N -1 1 316.209 4.103 20 0 DIADMM Nc1ncc(Nc2ccc(Cl)c(Cl)c2[O-])cc1Cl ZINC001159766212 1042187393 /nfs/dbraw/zinc/18/73/93/1042187393.db2.gz AAPGZKVLSZLHFA-UHFFFAOYSA-N -1 1 304.564 4.073 20 0 DIADMM C[C@@H](Cc1ccccc1Cl)NC(=O)c1ccc(Cl)cc1[O-] ZINC001136263948 1042195968 /nfs/dbraw/zinc/19/59/68/1042195968.db2.gz BLODRMRBGFTJLP-JTQLQIEISA-N -1 1 324.207 4.060 20 0 DIADMM CCCCC1CCC(CNC(=O)c2c([O-])cccc2F)CC1 ZINC001136396273 1042235859 /nfs/dbraw/zinc/23/58/59/1042235859.db2.gz OXMOBROKBFCCLX-UHFFFAOYSA-N -1 1 307.409 4.258 20 0 DIADMM CC(C)N(Cc1ccccc1F)C(=O)c1cc(Cl)ccc1[O-] ZINC001136456090 1042253028 /nfs/dbraw/zinc/25/30/28/1042253028.db2.gz WTVWUJMAODADDQ-UHFFFAOYSA-N -1 1 321.779 4.236 20 0 DIADMM CC(C)[C@@H]1CC[C@@H](C)C[C@H]1CNC(=O)c1cc(Cl)ccc1[O-] ZINC001136487104 1042263286 /nfs/dbraw/zinc/26/32/86/1042263286.db2.gz AQEYEJSHVILWJH-IPYPFGDCSA-N -1 1 323.864 4.484 20 0 DIADMM CC(C)(C)[C@@H]1CCCC[C@H]1CNC(=O)c1ccc(F)c([O-])c1 ZINC001136512870 1042268106 /nfs/dbraw/zinc/26/81/06/1042268106.db2.gz KRLWDEAINRQIGV-UONOGXRCSA-N -1 1 307.409 4.114 20 0 DIADMM CC(C)(C)[C@H]1CCCC[C@@H]1CNC(=O)c1cc(F)ccc1[O-] ZINC001136512632 1042268143 /nfs/dbraw/zinc/26/81/43/1042268143.db2.gz FOXYFMQTFSSKFO-DOMZBBRYSA-N -1 1 307.409 4.114 20 0 DIADMM Cc1cccc(C2(NC(=O)c3ccc(F)c([O-])c3)CCCC2)c1 ZINC001136593006 1042289286 /nfs/dbraw/zinc/28/92/86/1042289286.db2.gz OKJQJQZZPVKWQG-UHFFFAOYSA-N -1 1 313.372 4.039 20 0 DIADMM CC(C)CC[C@@H]1CCC[C@@H]1NC(=O)c1c([O-])cccc1Cl ZINC001136596095 1042291232 /nfs/dbraw/zinc/29/12/32/1042291232.db2.gz UNBCVWJIXDUZHW-JSGCOSHPSA-N -1 1 309.837 4.380 20 0 DIADMM [O-]c1cccc(CN[C@@H](c2ccccc2)c2ccccn2)c1Cl ZINC000645143641 1042439038 /nfs/dbraw/zinc/43/90/38/1042439038.db2.gz LLIROHVRHNWGFU-IBGZPJMESA-N -1 1 324.811 4.320 20 0 DIADMM CC(C)(CC(F)F)c1nc(-c2ccc([O-])cc2Cl)no1 ZINC000420495535 1042603165 /nfs/dbraw/zinc/60/31/65/1042603165.db2.gz WHESQLZCYWHLDV-UHFFFAOYSA-N -1 1 302.708 4.028 20 0 DIADMM CC(C)(C)c1cc(C(=O)[N-]c2c(F)cc(Cl)cc2F)no1 ZINC000271751996 1042667138 /nfs/dbraw/zinc/66/71/38/1042667138.db2.gz SUDOMYOJIGZGFR-UHFFFAOYSA-N -1 1 314.719 4.156 20 0 DIADMM O=S(=O)([N-]c1ccccc1C(F)F)c1ccc(C2CC2)cc1 ZINC000424087364 1042725059 /nfs/dbraw/zinc/72/50/59/1042725059.db2.gz RMDBCAGWLFPOKP-UHFFFAOYSA-N -1 1 323.364 4.302 20 0 DIADMM Cc1[nH]c2ccc(-c3nc4cccc(C)c4c(=O)[n-]3)cc2c1C ZINC000515438519 1042820347 /nfs/dbraw/zinc/82/03/47/1042820347.db2.gz UEIRHFLPZVNIIB-UHFFFAOYSA-N -1 1 303.365 4.409 20 0 DIADMM O=C1[N-]C(=S)SC1=Cc1cccc(OC2CCCC2)c1 ZINC000048625087 1042924166 /nfs/dbraw/zinc/92/41/66/1042924166.db2.gz VMCVEGFXMHYZTD-UKTHLTGXSA-N -1 1 305.424 4.337 20 0 DIADMM CC(C)CCc1ccccc1[N-]S(=O)(=O)c1cccc(F)c1 ZINC000519320320 1042943944 /nfs/dbraw/zinc/94/39/44/1042943944.db2.gz UHCVVJJREYDXAT-UHFFFAOYSA-N -1 1 321.417 4.215 20 0 DIADMM CSc1ccc([O-])c(-c2nc([C@@H]3CCC(F)(F)C3)no2)c1 ZINC000664866364 1042983608 /nfs/dbraw/zinc/98/36/08/1042983608.db2.gz CZAIPHAPYHXDEJ-MRVPVSSYSA-N -1 1 312.341 4.067 20 0 DIADMM Cc1cccc(CCc2nc(-c3ccc([O-])cc3Cl)no2)c1 ZINC000521967396 1043517287 /nfs/dbraw/zinc/51/72/87/1043517287.db2.gz CVGKRHYOCRYEPO-UHFFFAOYSA-N -1 1 314.772 4.189 20 0 DIADMM CC(C)(C)c1nc(C(=O)[N-]c2c(F)cc(Cl)cc2F)co1 ZINC000875527454 1043628259 /nfs/dbraw/zinc/62/82/59/1043628259.db2.gz FYRBRHHKNQPJBL-UHFFFAOYSA-N -1 1 314.719 4.156 20 0 DIADMM C[C@H](c1cccs1)N(C)C(=O)NCc1ccc([O-])c(Cl)c1 ZINC000876393224 1043679626 /nfs/dbraw/zinc/67/96/26/1043679626.db2.gz JARFALSGURZVLU-SNVBAGLBSA-N -1 1 324.833 4.010 20 0 DIADMM C[C@@H](Sc1nc(C(F)F)cc(=O)[n-]1)c1cccc(F)c1 ZINC000562043262 1044054247 /nfs/dbraw/zinc/05/42/47/1044054247.db2.gz HGPRRXCDRQLKFD-SSDOTTSWSA-N -1 1 300.305 4.112 20 0 DIADMM CC(C)(C)C[C@H]([N-]C(=O)C(F)(F)c1ccccc1)C(F)(F)F ZINC000778131197 1044169460 /nfs/dbraw/zinc/16/94/60/1044169460.db2.gz VPFYLOIQOKPXID-NSHDSACASA-N -1 1 323.305 4.262 20 0 DIADMM Cc1csc([C@H](NCc2cccc([O-])c2Cl)C2CC2)n1 ZINC000293478555 1044289545 /nfs/dbraw/zinc/28/95/45/1044289545.db2.gz FOUPBPLMOVBTAQ-CQSZACIVSA-N -1 1 308.834 4.051 20 0 DIADMM [O-]c1cccc(CN[C@@H]2c3ccccc3CC[C@@H]2F)c1Cl ZINC000883381201 1044294623 /nfs/dbraw/zinc/29/46/23/1044294623.db2.gz IPJGYRKGPAASOO-WMLDXEAASA-N -1 1 305.780 4.161 20 0 DIADMM Cc1oc(C(=O)[O-])cc1CN(C)[C@@H](C)c1cc2ccccc2o1 ZINC000565104803 1044414245 /nfs/dbraw/zinc/41/42/45/1044414245.db2.gz WAZLJNHFFNXSMJ-NSHDSACASA-N -1 1 313.353 4.225 20 0 DIADMM O=C1[N-]C(=O)C(=Cc2ccc(-c3ccc(Cl)cc3)cc2)S1 ZINC000215409511 1044530843 /nfs/dbraw/zinc/53/08/43/1044530843.db2.gz ISKIUMCGUXHXDM-NTEUORMPSA-N -1 1 315.781 4.331 20 0 DIADMM CCCCCCO[C@H](C)C(=O)Nc1cc(F)c([O-])cc1Cl ZINC000885678099 1044584491 /nfs/dbraw/zinc/58/44/91/1044584491.db2.gz JEQRVQIQQJMLLM-SNVBAGLBSA-N -1 1 317.788 4.109 20 0 DIADMM Cc1nc(C(C)C)sc1-c1nc(-c2ccc([O-])cc2F)no1 ZINC000568616861 1044639125 /nfs/dbraw/zinc/63/91/25/1044639125.db2.gz OKWMAPSQAQVMKW-UHFFFAOYSA-N -1 1 319.361 4.137 20 0 DIADMM CC[C@@H](NCc1cscn1)c1ccc(Cl)c(Cl)c1[O-] ZINC000155500703 1044700842 /nfs/dbraw/zinc/70/08/42/1044700842.db2.gz YUXBJOBFUIHOAY-LLVKDONJSA-N -1 1 317.241 4.396 20 0 DIADMM [O-]c1ccc(-c2noc(-c3scnc3C3CC3)n2)c(Cl)c1 ZINC000445448004 1044719805 /nfs/dbraw/zinc/71/98/05/1044719805.db2.gz JYLZCSZUWUOEHG-UHFFFAOYSA-N -1 1 319.773 4.097 20 0 DIADMM [O-]c1ccc(-c2noc(/C=C\c3c(F)cccc3F)n2)c(F)c1 ZINC000445465893 1044724822 /nfs/dbraw/zinc/72/48/22/1044724822.db2.gz VABUZEPIZUVEPI-SREVYHEPSA-N -1 1 318.254 4.030 20 0 DIADMM CSc1ccc(C)c(-c2nc(-c3ccc([O-])c(F)c3)no2)c1 ZINC000445479924 1044730544 /nfs/dbraw/zinc/73/05/44/1044730544.db2.gz JAOFCOVXYZQVRY-UHFFFAOYSA-N -1 1 316.357 4.279 20 0 DIADMM C[C@H](c1nc(-c2ccc([O-])c(F)c2)no1)c1ccc(F)c(F)c1 ZINC000445484210 1044733378 /nfs/dbraw/zinc/73/33/78/1044733378.db2.gz XYPZKAYOJNONGB-QMMMGPOBSA-N -1 1 320.270 4.011 20 0 DIADMM Cc1oc(CN(C)[C@H](C)c2cc3ccccc3o2)cc1C(=O)[O-] ZINC000570286273 1044746748 /nfs/dbraw/zinc/74/67/48/1044746748.db2.gz GRAZYHQMCKJQQY-LLVKDONJSA-N -1 1 313.353 4.225 20 0 DIADMM CCCCN(CC)Cc1csc(-c2cccc(C(=O)[O-])c2)n1 ZINC000571217948 1044802931 /nfs/dbraw/zinc/80/29/31/1044802931.db2.gz SGONUADTZCYDNZ-UHFFFAOYSA-N -1 1 318.442 4.130 20 0 DIADMM CCc1nc(SCc2cc(F)ccc2Cl)[n-]c(=O)c1C ZINC000574823193 1044974366 /nfs/dbraw/zinc/97/43/66/1044974366.db2.gz IIVJZIUEGUMJBV-UHFFFAOYSA-N -1 1 312.797 4.138 20 0 DIADMM Cc1cccc(C2=CCN(Cc3csc(C(=O)[O-])c3)CC2)c1 ZINC000579132389 1045296105 /nfs/dbraw/zinc/29/61/05/1045296105.db2.gz CBMXUXANGNIGCM-UHFFFAOYSA-N -1 1 313.422 4.044 20 0 DIADMM CCCn1ncc(NCc2cccc([O-])c2Cl)c1C1CC1 ZINC000449411814 1045391796 /nfs/dbraw/zinc/39/17/96/1045391796.db2.gz AKVZMHHCGDLQOM-UHFFFAOYSA-N -1 1 305.809 4.142 20 0 DIADMM O=C(Nc1cc(Cl)c([O-])c2ccccc12)C1(CCF)CC1 ZINC000529540287 1045491007 /nfs/dbraw/zinc/49/10/07/1045491007.db2.gz XFCFNOJTVHWITD-UHFFFAOYSA-N -1 1 307.752 4.277 20 0 DIADMM O=C(C[C@H]1CCCCO1)Nc1cc(Cl)c([O-])c2ccccc12 ZINC000529540283 1045491380 /nfs/dbraw/zinc/49/13/80/1045491380.db2.gz XDMWAFRFUGOKQK-LLVKDONJSA-N -1 1 319.788 4.097 20 0 DIADMM CCCCn1nc(C)c(/C=C/C(=O)c2ccc([O-])cc2)c1Cl ZINC000007718073 1045505951 /nfs/dbraw/zinc/50/59/51/1045505951.db2.gz NPEAQOYPWOLEFP-MDZDMXLPSA-N -1 1 318.804 4.247 20 0 DIADMM O=C(Nc1cc(Cl)c([O-])c2ccccc12)[C@@H]1CCCCS1 ZINC000628233283 1045549455 /nfs/dbraw/zinc/54/94/55/1045549455.db2.gz UBZOPXYLKJSEHO-AWEZNQCLSA-N -1 1 321.829 4.423 20 0 DIADMM O=C(Nc1cc(Cl)c([O-])c2ccccc12)[C@H]1CCCCS1 ZINC000628233284 1045550207 /nfs/dbraw/zinc/55/02/07/1045550207.db2.gz UBZOPXYLKJSEHO-CQSZACIVSA-N -1 1 321.829 4.423 20 0 DIADMM O=C([N-][C@H]1CCc2ccc(-c3ccccc3)cc21)C(F)(F)F ZINC000779303537 1045563871 /nfs/dbraw/zinc/56/38/71/1045563871.db2.gz CYCNQKXQSUFISV-HNNXBMFYSA-N -1 1 305.299 4.019 20 0 DIADMM Cc1ccc(NC(=O)Nc2ccc([O-])c(Cl)c2)c(Cl)n1 ZINC001123336498 1045578444 /nfs/dbraw/zinc/57/84/44/1045578444.db2.gz BWHAHBUANQEQNI-UHFFFAOYSA-N -1 1 312.156 4.046 20 0 DIADMM CSc1ccc([O-])c(C(=O)N(C)c2ccc(C)c(C)c2)c1 ZINC001626158585 1045583011 /nfs/dbraw/zinc/58/30/11/1045583011.db2.gz WGWPGFQJRRPMTN-UHFFFAOYSA-N -1 1 301.411 4.008 20 0 DIADMM C[C@@H]1[C@@H](c2ccccc2)CCN1C(=O)c1c([O-])cccc1Cl ZINC000751426305 1045605147 /nfs/dbraw/zinc/60/51/47/1045605147.db2.gz QHCVTOGZCNXMRS-OCCSQVGLSA-N -1 1 315.800 4.064 20 0 DIADMM C[C@H]1CC(C(=O)[O-])C[C@H](C)N1Cc1ccc(Cl)c(Cl)c1 ZINC000530175055 1045614143 /nfs/dbraw/zinc/61/41/43/1045614143.db2.gz CNDHZTOGVXEJKW-UWVGGRQHSA-N -1 1 316.228 4.067 20 0 DIADMM CCC1(C(=O)Nc2cccc(F)c2[O-])CCC(F)(F)CC1 ZINC000628960720 1045625522 /nfs/dbraw/zinc/62/55/22/1045625522.db2.gz XJTUQJCKXMQXGV-UHFFFAOYSA-N -1 1 301.308 4.076 20 0 DIADMM [O-]c1ccc(Cl)c(F)c1CNc1ccc(-c2ncco2)cc1 ZINC000191529371 1045724176 /nfs/dbraw/zinc/72/41/76/1045724176.db2.gz VCEHKNMMVCKHCJ-UHFFFAOYSA-N -1 1 318.735 4.452 20 0 DIADMM CCCCC/C(=C\c1ccccc1)CN1CC[C@@](F)(C(=O)[O-])C1 ZINC000901515464 1045754725 /nfs/dbraw/zinc/75/47/25/1045754725.db2.gz MPLRGTYZRATYCK-UMEYKSNOSA-N -1 1 319.420 4.149 20 0 DIADMM CO[C@@H](CSc1nc(C)c(C2CC2)c(=O)[n-]1)C1CCCCC1 ZINC000631023518 1045797382 /nfs/dbraw/zinc/79/73/82/1045797382.db2.gz UZWLUQPYVOUAPU-AWEZNQCLSA-N -1 1 322.474 4.055 20 0 DIADMM CCCCC[C@H](NCc1ccc(-c2ccc(F)cc2)o1)C(=O)[O-] ZINC000901722687 1045797715 /nfs/dbraw/zinc/79/77/15/1045797715.db2.gz BXRHNOWEJVIPBA-INIZCTEOSA-N -1 1 319.376 4.209 20 0 DIADMM CCCCC[C@@H](NCc1ccc(-c2ccc(C)cc2)o1)C(=O)[O-] ZINC000901725586 1045797791 /nfs/dbraw/zinc/79/77/91/1045797791.db2.gz XBKPHEPNGVRQFM-QGZVFWFLSA-N -1 1 315.413 4.378 20 0 DIADMM CO[C@H](CSc1nc(C)c(C2CC2)c(=O)[n-]1)C1CCCCC1 ZINC000631023519 1045798342 /nfs/dbraw/zinc/79/83/42/1045798342.db2.gz UZWLUQPYVOUAPU-CQSZACIVSA-N -1 1 322.474 4.055 20 0 DIADMM Cc1nc(SCc2cccc(Cl)c2)[n-]c(=O)c1C1CC1 ZINC000631023753 1045798674 /nfs/dbraw/zinc/79/86/74/1045798674.db2.gz WEEDRLMHKFUJIA-UHFFFAOYSA-N -1 1 306.818 4.314 20 0 DIADMM Cc1cc(F)ccc1CSc1nc(C)c(C2CC2)c(=O)[n-]1 ZINC000631024564 1045798890 /nfs/dbraw/zinc/79/88/90/1045798890.db2.gz VZDBYKZGYDSUAM-UHFFFAOYSA-N -1 1 304.390 4.108 20 0 DIADMM CC[C@H](NCc1cc(C)c(C(=O)[O-])o1)c1cccc(Cl)c1 ZINC000902107486 1045913647 /nfs/dbraw/zinc/91/36/47/1045913647.db2.gz CXKKWZSKEMHNDD-AWEZNQCLSA-N -1 1 307.777 4.181 20 0 DIADMM CC[C@@H](NCc1cc(C)c(C(=O)[O-])o1)c1cccc(Cl)c1 ZINC000902107487 1045913769 /nfs/dbraw/zinc/91/37/69/1045913769.db2.gz CXKKWZSKEMHNDD-CQSZACIVSA-N -1 1 307.777 4.181 20 0 DIADMM CCc1oc(CN[C@@H](C)c2cc(C)sc2C)cc1C(=O)[O-] ZINC000902112834 1045915409 /nfs/dbraw/zinc/91/54/09/1045915409.db2.gz PEVDAJKUIQPCHI-JTQLQIEISA-N -1 1 307.415 4.069 20 0 DIADMM CCOc1cccc(/C=C\C(=O)Nc2ccc([O-])c(Cl)c2)c1 ZINC001137674355 1045930795 /nfs/dbraw/zinc/93/07/95/1045930795.db2.gz QDZXIAGGIKYSEV-TWGQIWQCSA-N -1 1 317.772 4.096 20 0 DIADMM CCc1oc(CN[C@H]2CC(C)(C)c3ccccc32)cc1C(=O)[O-] ZINC000902263558 1045958862 /nfs/dbraw/zinc/95/88/62/1045958862.db2.gz WPSCUWLLOYOFMK-INIZCTEOSA-N -1 1 313.397 4.052 20 0 DIADMM CC(C)(C)c1ccc(CNCc2ccc(/C=C/C(=O)[O-])o2)s1 ZINC000902418467 1045995087 /nfs/dbraw/zinc/99/50/87/1045995087.db2.gz GLCOZTMNVKYLIB-RMKNXTFCSA-N -1 1 319.426 4.026 20 0 DIADMM CCc1oc(CNC2(c3cccc(C)c3)CCC2)cc1C(=O)[O-] ZINC000902441968 1045997923 /nfs/dbraw/zinc/99/79/23/1045997923.db2.gz DQBOGHNBUKQJJH-UHFFFAOYSA-N -1 1 313.397 4.018 20 0 DIADMM Cc1ccccc1-c1cccc(CNCc2ccc(C(=O)[O-])o2)c1 ZINC000756286685 1046063396 /nfs/dbraw/zinc/06/33/96/1046063396.db2.gz UPQLRACXNPJXOV-UHFFFAOYSA-N -1 1 321.376 4.243 20 0 DIADMM CC(C)[C@H]1CCc2[n-]n(Cc3cccc4cccnc43)c(=O)c2C1 ZINC000634592674 1046079199 /nfs/dbraw/zinc/07/91/99/1046079199.db2.gz QULPUDAORXCMAF-DOTOQJQBSA-N -1 1 321.424 4.005 20 0 DIADMM CC[C@@]1(C(=O)[O-])CCC[N@@H+](Cc2cccc(Cl)c2Cl)C1 ZINC000086784307 1046165264 /nfs/dbraw/zinc/16/52/64/1046165264.db2.gz MYEJUVFKCWVASP-OAHLLOKOSA-N -1 1 316.228 4.070 20 0 DIADMM COc1ccc(C)cc1NC(=O)Nc1cc([O-])c(Cl)cc1F ZINC001202870501 1046313541 /nfs/dbraw/zinc/31/35/41/1046313541.db2.gz YIAIVTAZZCDRDG-UHFFFAOYSA-N -1 1 324.739 4.146 20 0 DIADMM CC(C)c1ccc(NC(=O)Nc2cc(F)c(F)cc2[O-])cc1 ZINC001202924366 1046431441 /nfs/dbraw/zinc/43/14/41/1046431441.db2.gz OXUVXQPMQZTNTD-UHFFFAOYSA-N -1 1 306.312 4.438 20 0 DIADMM CC[C@H](CC(=O)Nc1c([O-])cccc1F)c1ccc(OC)cc1 ZINC000677000494 1046452417 /nfs/dbraw/zinc/45/24/17/1046452417.db2.gz QADBEPOMCCUIFO-GFCCVEGCSA-N -1 1 317.360 4.062 20 0 DIADMM Cc1ccccc1[C@H]1C[C@H](NC(=O)c2cc(Cl)ccc2[O-])C1 ZINC001139517628 1046459309 /nfs/dbraw/zinc/45/93/09/1046459309.db2.gz WBTUQLANVXUKLS-MQMHXKEQSA-N -1 1 315.800 4.030 20 0 DIADMM C[C@@H]1C[C@H](CCNC(=O)c2ccc(F)c([O-])c2)CC(C)(C)C1 ZINC001139605847 1046484998 /nfs/dbraw/zinc/48/49/98/1046484998.db2.gz SGLFLDLOMMDIIA-OLZOCXBDSA-N -1 1 307.409 4.114 20 0 DIADMM COc1nccc(Nc2ccc(Cl)c(Cl)c2[O-])c1Cl ZINC001211952782 1046544604 /nfs/dbraw/zinc/54/46/04/1046544604.db2.gz VVQIMEYMYUZXGH-UHFFFAOYSA-N -1 1 319.575 4.500 20 0 DIADMM O=C(Nc1ccc([O-])c(Cl)c1)[C@H]1C[C@@H]1c1cccc(Cl)c1 ZINC000533081551 1046650636 /nfs/dbraw/zinc/65/06/36/1046650636.db2.gz ABWVJJLAMLOYMZ-OLZOCXBDSA-N -1 1 322.191 4.441 20 0 DIADMM CC(C)(C)c1nc(C(=O)Nc2ccc(Cl)cc2[O-])cs1 ZINC000533159237 1046660406 /nfs/dbraw/zinc/66/04/06/1046660406.db2.gz PEXMIRHHSMKNJG-UHFFFAOYSA-N -1 1 310.806 4.052 20 0 DIADMM C[C@@H](CC(=O)Nc1c([O-])cccc1F)Cc1ccc(Cl)cc1 ZINC000678574621 1046661294 /nfs/dbraw/zinc/66/12/94/1046661294.db2.gz OCMBVQUMQAOXHE-LLVKDONJSA-N -1 1 321.779 4.392 20 0 DIADMM CCOc1cc(-c2noc(CCCC3CC3)n2)cc(Cl)c1[O-] ZINC000643359787 1046662745 /nfs/dbraw/zinc/66/27/45/1046662745.db2.gz ILICFIKGIMZSGL-UHFFFAOYSA-N -1 1 322.792 4.227 20 0 DIADMM CCc1ccc(CCC(=O)Nc2ccc([O-])c(Cl)c2)cc1 ZINC000533540563 1046748732 /nfs/dbraw/zinc/74/87/32/1046748732.db2.gz ODMBVQMLCRQTDO-UHFFFAOYSA-N -1 1 303.789 4.179 20 0 DIADMM [O-]c1cccc(CN[C@H](c2ccccc2)c2cccnc2)c1Cl ZINC000645151889 1046771343 /nfs/dbraw/zinc/77/13/43/1046771343.db2.gz CDFUTFOHIAMYJI-LJQANCHMSA-N -1 1 324.811 4.320 20 0 DIADMM [O-]c1cccc(CNc2c(F)cccc2N2CCCC2)c1Cl ZINC000645171228 1046772849 /nfs/dbraw/zinc/77/28/49/1046772849.db2.gz RXJIPCUSGCSBRP-UHFFFAOYSA-N -1 1 320.795 4.397 20 0 DIADMM [O-]c1cccc(CNc2ccccc2OCC(F)F)c1Cl ZINC000645163320 1046773402 /nfs/dbraw/zinc/77/34/02/1046773402.db2.gz USFFSWILXJFJHU-UHFFFAOYSA-N -1 1 313.731 4.302 20 0 DIADMM C[C@H]1C[C@@H]1c1ccc(CCC(=O)Nc2ccc([O-])c(Cl)c2)o1 ZINC000679643823 1046886708 /nfs/dbraw/zinc/88/67/08/1046886708.db2.gz LFGAOOXDEDHZIY-GWCFXTLKSA-N -1 1 319.788 4.333 20 0 DIADMM [O-]c1c(Cl)cc(CN2CC[C@H](c3cccnc3)C2)cc1Cl ZINC001140833648 1046921815 /nfs/dbraw/zinc/92/18/15/1046921815.db2.gz DVLHPXLUZGIGPN-ZDUSSCGKSA-N -1 1 323.223 4.084 20 0 DIADMM [O-]c1c(Cl)cc(CN2C[C@@H]3CC(F)(F)C[C@@H]3C2)cc1Cl ZINC001140833682 1046924804 /nfs/dbraw/zinc/92/48/04/1046924804.db2.gz CBPHDQDVIPUVRX-AOOOYVTPSA-N -1 1 322.182 4.176 20 0 DIADMM [O-]c1ccc(CN2CCC[C@H]2c2cccc(F)c2)c(F)c1F ZINC001140894016 1046946544 /nfs/dbraw/zinc/94/65/44/1046946544.db2.gz NWJCNRHNKINSKO-AWEZNQCLSA-N -1 1 307.315 4.147 20 0 DIADMM CCCC[C@H](NCc1ccc(-c2cccc(F)c2C)o1)C(=O)[O-] ZINC000262698912 1046973349 /nfs/dbraw/zinc/97/33/49/1046973349.db2.gz JDMLCQUACGNVAQ-INIZCTEOSA-N -1 1 319.376 4.127 20 0 DIADMM C[C@H](C(=O)[N-]OCc1ccccc1)c1ccc(C(F)(F)F)cc1 ZINC000798846388 1046976769 /nfs/dbraw/zinc/97/67/69/1046976769.db2.gz VUZMZNVXFMRJNW-LBPRGKRZSA-N -1 1 323.314 4.057 20 0 DIADMM C[C@H]1CCN(C(=O)c2cc(F)ccc2[O-])c2ccccc2S1 ZINC000536691470 1047072735 /nfs/dbraw/zinc/07/27/35/1047072735.db2.gz RRHNGHNIWZLJSX-NSHDSACASA-N -1 1 317.385 4.062 20 0 DIADMM O=C(Nc1cccc(OC2CCCC2)c1)c1ccc([O-])c(F)c1 ZINC000681017171 1047082600 /nfs/dbraw/zinc/08/26/00/1047082600.db2.gz XBQCZRAORGJPDE-UHFFFAOYSA-N -1 1 315.344 4.105 20 0 DIADMM CC(C)C[C@@H](NC(=O)c1ccc([O-])c(F)c1)c1ccccc1 ZINC000681014604 1047082700 /nfs/dbraw/zinc/08/27/00/1047082700.db2.gz QUZHNCRVFHGQBU-MRXNPFEDSA-N -1 1 301.361 4.049 20 0 DIADMM O=C(c1ccc([O-])c(F)c1)N1CCCCC[C@H]1c1ccccc1 ZINC000681019182 1047084311 /nfs/dbraw/zinc/08/43/11/1047084311.db2.gz SPHLFOGKIGJNQN-KRWDZBQOSA-N -1 1 313.372 4.289 20 0 DIADMM CC(C)(C)[C@@H](NC(=O)c1ccc([O-])c(F)c1)c1ccccc1 ZINC000681018787 1047084374 /nfs/dbraw/zinc/08/43/74/1047084374.db2.gz NZDRMIJIHLBMGZ-INIZCTEOSA-N -1 1 301.361 4.049 20 0 DIADMM Cc1ccc([C@H]2CCCCCN2C(=O)c2ccc([O-])c(F)c2)o1 ZINC000681048677 1047086333 /nfs/dbraw/zinc/08/63/33/1047086333.db2.gz NCZANTFCFFUMKC-OAHLLOKOSA-N -1 1 317.360 4.190 20 0 DIADMM CCC[C@@H](CCc1ccccc1)NC(=O)c1ccc([O-])c(F)c1 ZINC000681048985 1047086515 /nfs/dbraw/zinc/08/65/15/1047086515.db2.gz KOGOATDTBFBRER-INIZCTEOSA-N -1 1 315.388 4.063 20 0 DIADMM Cc1ccc(C(F)(F)F)cc1NC(=O)c1ccc([O-])c(F)c1 ZINC000681051627 1047086734 /nfs/dbraw/zinc/08/67/34/1047086734.db2.gz CJULYKWWBIAFIZ-UHFFFAOYSA-N -1 1 313.250 4.111 20 0 DIADMM CC[C@H](NC(=O)c1ccc([O-])c(F)c1)c1ccc(Cl)s1 ZINC000681046125 1047087671 /nfs/dbraw/zinc/08/76/71/1047087671.db2.gz CSXOKIWWNOYLOS-JTQLQIEISA-N -1 1 313.781 4.127 20 0 DIADMM Cc1ccc([C@@H]2CCCCN2C(=O)c2ccc([O-])c(F)c2)cc1 ZINC000681049480 1047087964 /nfs/dbraw/zinc/08/79/64/1047087964.db2.gz OPBSXAMYXISNRY-KRWDZBQOSA-N -1 1 313.372 4.207 20 0 DIADMM Cc1ccc(-c2ccncc2)cc1NC(=O)c1ccc([O-])c(F)c1 ZINC000681039897 1047088186 /nfs/dbraw/zinc/08/81/86/1047088186.db2.gz RBECJVWIRCNJRJ-UHFFFAOYSA-N -1 1 322.339 4.154 20 0 DIADMM O=C(c1cc(F)ccc1[O-])N1CC2(CC=CC2)[C@@H]1c1ccccc1 ZINC000649154990 1047112715 /nfs/dbraw/zinc/11/27/15/1047112715.db2.gz ZTHCMAPCEROLRO-SFHVURJKSA-N -1 1 323.367 4.065 20 0 DIADMM CC(C)CN(C(=O)c1ccc(F)c([O-])c1)c1ccc(Cl)cc1 ZINC001137454626 1047130159 /nfs/dbraw/zinc/13/01/59/1047130159.db2.gz NHXKLFQPKSREAE-UHFFFAOYSA-N -1 1 321.779 4.488 20 0 DIADMM Cc1cc(NC(=O)c2ccc([O-])cc2F)ccc1C(F)(F)F ZINC000681524494 1047130325 /nfs/dbraw/zinc/13/03/25/1047130325.db2.gz KJYPKJZBMHDBTF-UHFFFAOYSA-N -1 1 313.250 4.111 20 0 DIADMM Cc1cc(C)cc(C(=O)Nc2ccc(Br)c([O-])c2)c1 ZINC001116758271 1047175367 /nfs/dbraw/zinc/17/53/67/1047175367.db2.gz SSTKZGOMGGGNRY-UHFFFAOYSA-N -1 1 320.186 4.024 20 0 DIADMM COc1cc(C(=O)Nc2ccc(C3CC3)cc2)cc(Cl)c1[O-] ZINC000682386192 1047189794 /nfs/dbraw/zinc/18/97/94/1047189794.db2.gz JCPRYSQJKVRCNZ-UHFFFAOYSA-N -1 1 317.772 4.184 20 0 DIADMM C[C@@H]1CCN(C(=O)c2cc(Cl)ccc2[O-])[C@H]2CCCC[C@H]12 ZINC001141567131 1047194681 /nfs/dbraw/zinc/19/46/81/1047194681.db2.gz GNRKBSFAHHSYRY-KYOSRNDESA-N -1 1 307.821 4.086 20 0 DIADMM [O-]c1ccc(-c2noc(-c3cc4ccccc4cc3O)n2)cc1F ZINC000325811467 1047213930 /nfs/dbraw/zinc/21/39/30/1047213930.db2.gz HNTJMYAXCLVWKQ-UHFFFAOYSA-N -1 1 322.295 4.107 20 0 DIADMM O=C([O-])C[C@H]1CCCC[N@H+]1Cc1csc(C2CCCCC2)n1 ZINC000650506337 1047245076 /nfs/dbraw/zinc/24/50/76/1047245076.db2.gz IEMDMMGICLAYFC-OAHLLOKOSA-N -1 1 322.474 4.020 20 0 DIADMM O=C([O-])C[C@H]1CCCCN1Cc1csc(C2CCCCC2)n1 ZINC000650506337 1047245088 /nfs/dbraw/zinc/24/50/88/1047245088.db2.gz IEMDMMGICLAYFC-OAHLLOKOSA-N -1 1 322.474 4.020 20 0 DIADMM C[C@@H](c1ccccc1Cl)N(C)Cc1ccccc1CC(=O)[O-] ZINC000387595607 1047285498 /nfs/dbraw/zinc/28/54/98/1047285498.db2.gz UTERDUYUFQNJPJ-ZDUSSCGKSA-N -1 1 317.816 4.160 20 0 DIADMM C/C(=C\c1ccc(C)cc1)C(=O)Nc1cc([O-])c(F)cc1F ZINC001141834237 1047296517 /nfs/dbraw/zinc/29/65/17/1047296517.db2.gz XZPIMGHKEZJQIK-YRNVUSSQSA-N -1 1 303.308 4.021 20 0 DIADMM O=C(Nc1ccc2c3c(cccc31)CC2)c1cc(F)ccc1[O-] ZINC001142285385 1047422132 /nfs/dbraw/zinc/42/21/32/1047422132.db2.gz DBAGJOKFFOQALL-UHFFFAOYSA-N -1 1 307.324 4.035 20 0 DIADMM O=C(C[C@@H]1CCCc2ccccc21)Nc1cc(F)cc(F)c1[O-] ZINC001142541725 1047466844 /nfs/dbraw/zinc/46/68/44/1047466844.db2.gz FFJIGSXBSFQUKP-LBPRGKRZSA-N -1 1 317.335 4.119 20 0 DIADMM CC(C)(C)[C@H]1CCCC[C@H]1CNC(=O)c1cccc([O-])c1F ZINC001142870729 1047507149 /nfs/dbraw/zinc/50/71/49/1047507149.db2.gz QIENZGGXOZENEB-JSGCOSHPSA-N -1 1 307.409 4.114 20 0 DIADMM O=C(Nc1ccccc1NC1CCCCC1)c1ccccc1[O-] ZINC000842905543 1047513631 /nfs/dbraw/zinc/51/36/31/1047513631.db2.gz ZQZCVLGGGHPQQZ-UHFFFAOYSA-N -1 1 310.397 4.389 20 0 DIADMM CC[C@H](NC(=O)c1cc(Cl)ccc1[O-])c1ccc(C)cc1 ZINC001143083880 1047528597 /nfs/dbraw/zinc/52/85/97/1047528597.db2.gz IAZSMMRQISTLTD-HNNXBMFYSA-N -1 1 303.789 4.235 20 0 DIADMM O=C(N[C@H](C1CCC1)C1CCCCC1)c1ccc([O-])cc1F ZINC001143080168 1047529146 /nfs/dbraw/zinc/52/91/46/1047529146.db2.gz LQSIBSPFMIVZDS-KRWDZBQOSA-N -1 1 305.393 4.010 20 0 DIADMM C[C@H](c1cccs1)N(C)C(=O)c1ccc2ccccc2c1[O-] ZINC000121908075 1047530544 /nfs/dbraw/zinc/53/05/44/1047530544.db2.gz OHKXNDKCEKVGNE-GFCCVEGCSA-N -1 1 311.406 4.440 20 0 DIADMM O=C(N[C@H](CC1CCCCC1)c1ccccc1)c1ncccc1[O-] ZINC001143112784 1047532561 /nfs/dbraw/zinc/53/25/61/1047532561.db2.gz AZJQFPLGBGPSSM-QGZVFWFLSA-N -1 1 324.424 4.229 20 0 DIADMM Cc1cc(NC(=O)c2ccc(C(F)(F)F)cc2[O-])cs1 ZINC001149512556 1047564081 /nfs/dbraw/zinc/56/40/81/1047564081.db2.gz AYIKEXXUXWYEAZ-UHFFFAOYSA-N -1 1 301.289 4.033 20 0 DIADMM COc1cc(C)cc(NC(=O)c2ccc3ccccc3c2[O-])c1C ZINC001150994614 1047589343 /nfs/dbraw/zinc/58/93/43/1047589343.db2.gz KDGGLOYLSAIYAX-UHFFFAOYSA-N -1 1 321.376 4.423 20 0 DIADMM O=C(C[C@@H]1C[C@H]1Cc1ccccc1)Nc1ccc([O-])c(Cl)c1 ZINC001151583333 1047598856 /nfs/dbraw/zinc/59/88/56/1047598856.db2.gz XYVQBWCEPSZSNO-KGLIPLIRSA-N -1 1 315.800 4.253 20 0 DIADMM C[C@@H]1CC[C@@](C)(/C=C\C(=O)Nc2cccc(F)c2[O-])C1(C)C ZINC001151779722 1047601898 /nfs/dbraw/zinc/60/18/98/1047601898.db2.gz KWTCMXRVMVUEAX-WWAWELGDSA-N -1 1 305.393 4.488 20 0 DIADMM CC(C)[C@H]1N(C(=O)c2cccc([O-])c2F)CC12CCCCCC2 ZINC001151899233 1047603265 /nfs/dbraw/zinc/60/32/65/1047603265.db2.gz BEBQXAKHQJMLRL-QGZVFWFLSA-N -1 1 319.420 4.352 20 0 DIADMM CCC(F)(F)c1ccccc1NC(=O)c1ccc(OC)cc1[O-] ZINC001152364707 1047611027 /nfs/dbraw/zinc/61/10/27/1047611027.db2.gz UQQKVCLTBDKGHM-UHFFFAOYSA-N -1 1 321.323 4.155 20 0 DIADMM O=C(Nc1ccc(Cl)cc1[O-])c1cc2c(ccnc2Cl)o1 ZINC001153461738 1047625097 /nfs/dbraw/zinc/62/50/97/1047625097.db2.gz OHHSCSMMLQDZDJ-UHFFFAOYSA-N -1 1 323.135 4.093 20 0 DIADMM O=C(Nc1ccc2ccncc2c1)c1c([O-])ccc2ccccc21 ZINC001153506023 1047626825 /nfs/dbraw/zinc/62/68/25/1047626825.db2.gz QMSKOICNQDWQFX-UHFFFAOYSA-N -1 1 314.344 4.346 20 0 DIADMM CC(C)c1cccc(NC(=O)c2c(O)cc3ccccc3c2[O-])n1 ZINC001154023273 1047638131 /nfs/dbraw/zinc/63/81/31/1047638131.db2.gz RPRFASCVNAHUFR-UHFFFAOYSA-N -1 1 322.364 4.022 20 0 DIADMM CC(C)(C)[C@@H]1CCC[C@H](NC(=O)c2c([O-])cccc2F)CC1 ZINC001154445050 1047648921 /nfs/dbraw/zinc/64/89/21/1047648921.db2.gz NGOYYBFXFJJUPC-OLZOCXBDSA-N -1 1 307.409 4.256 20 0 DIADMM CC(C)[C@H]1CCC[C@H](NC(=O)c2c([O-])cccc2Cl)CC1 ZINC001154883081 1047660474 /nfs/dbraw/zinc/66/04/74/1047660474.db2.gz DEKVWRIUFPYPQY-STQMWFEESA-N -1 1 309.837 4.380 20 0 DIADMM CC(C)c1ccc2c(c1)[C@H](NC(=O)c1cc(F)ccc1[O-])CC2 ZINC001155016481 1047665134 /nfs/dbraw/zinc/66/51/34/1047665134.db2.gz PYOAHMKXQBURHT-QGZVFWFLSA-N -1 1 313.372 4.072 20 0 DIADMM Cc1ccc(-c2cccc(NC(=O)c3ccc([O-])cc3F)n2)cc1 ZINC001156533031 1047715937 /nfs/dbraw/zinc/71/59/37/1047715937.db2.gz HTUYEKFVNKTCMQ-UHFFFAOYSA-N -1 1 322.339 4.154 20 0 DIADMM C[C@@H]1C[C@@H](c2ccccc2)N(C(=O)c2c([O-])cccc2Cl)C1 ZINC001157232096 1047737445 /nfs/dbraw/zinc/73/74/45/1047737445.db2.gz KPUMTGLPRYVPSF-DOMZBBRYSA-N -1 1 315.800 4.269 20 0 DIADMM CC(C)(C)c1coc(NC(=O)c2cc3ccccc3cc2[O-])n1 ZINC001159189502 1047819422 /nfs/dbraw/zinc/81/94/22/1047819422.db2.gz HZYZGTBWXPGERC-UHFFFAOYSA-N -1 1 310.353 4.083 20 0 DIADMM CCc1c(Cl)cc(Nc2cnn(CC)c2)c([O-])c1Cl ZINC001174572173 1047890348 /nfs/dbraw/zinc/89/03/48/1047890348.db2.gz OOHCVLDXYVYBFU-UHFFFAOYSA-N -1 1 300.189 4.221 20 0 DIADMM COc1cc(Nc2c(Cl)ccc([O-])c2Cl)ccc1O ZINC001174544063 1047900647 /nfs/dbraw/zinc/90/06/47/1047900647.db2.gz DZIGUYCMRILINK-UHFFFAOYSA-N -1 1 300.141 4.157 20 0 DIADMM CC(C)(C)c1ccc(C(=O)Nc2nc(Cl)ccc2[O-])s1 ZINC001183210247 1047909873 /nfs/dbraw/zinc/90/98/73/1047909873.db2.gz SLQWWZSSHPOTPY-UHFFFAOYSA-N -1 1 310.806 4.052 20 0 DIADMM Cc1cncc(Nc2c(Cl)ccc(Br)c2[O-])c1 ZINC001174763013 1047963858 /nfs/dbraw/zinc/96/38/58/1047963858.db2.gz NRRBOLMIERCIOW-UHFFFAOYSA-N -1 1 313.582 4.255 20 0 DIADMM Cc1cccc(C)c1NC(=S)Nc1cc(F)c([O-])c(F)c1 ZINC001198357014 1047952027 /nfs/dbraw/zinc/95/20/27/1047952027.db2.gz DQKOHIJSJJVVRW-UHFFFAOYSA-N -1 1 308.353 4.096 20 0 DIADMM CC(C)c1ccc(C(=O)Nc2cncc(C(F)F)c2)c([O-])c1 ZINC001152447470 1047953083 /nfs/dbraw/zinc/95/30/83/1047953083.db2.gz MOZMGWBMIMNXLI-UHFFFAOYSA-N -1 1 306.312 4.101 20 0 DIADMM CC[C@@H](SCCC[N-]C(=O)C(F)(F)F)c1ccc(F)cc1 ZINC000774683994 1047967842 /nfs/dbraw/zinc/96/78/42/1047967842.db2.gz RCNHOAZYJOHNOV-GFCCVEGCSA-N -1 1 323.355 4.079 20 0 DIADMM Cc1ccc(F)cc1Nc1ccc(F)c(Br)c1[O-] ZINC001174887150 1047994760 /nfs/dbraw/zinc/99/47/60/1047994760.db2.gz ICDTVTMWQCPEKD-UHFFFAOYSA-N -1 1 314.129 4.485 20 0 DIADMM CC(C)c1ccc(NC(=S)Nc2cccc(F)c2[O-])cc1 ZINC001198618076 1047991699 /nfs/dbraw/zinc/99/16/99/1047991699.db2.gz CDQGODFKHZHRRA-UHFFFAOYSA-N -1 1 304.390 4.464 20 0 DIADMM Cc1cc(C)c([N-]S(=O)(=O)c2ccc3occc3c2)c(C)c1 ZINC001198858973 1048011059 /nfs/dbraw/zinc/01/10/59/1048011059.db2.gz OJIBCTSIIQLNER-UHFFFAOYSA-N -1 1 315.394 4.159 20 0 DIADMM CCCCOc1ccc(C(=O)Nc2c[nH]c3ccccc23)c([O-])c1 ZINC001184371855 1048038078 /nfs/dbraw/zinc/03/80/78/1048038078.db2.gz YWRDLRQWDZKNMR-UHFFFAOYSA-N -1 1 324.380 4.305 20 0 DIADMM O=C([N-]c1cc(F)cc(F)c1F)c1cc(-c2cccs2)on1 ZINC000554353479 1048069887 /nfs/dbraw/zinc/06/98/87/1048069887.db2.gz BWOSCIGDRGJSEX-UHFFFAOYSA-N -1 1 324.283 4.073 20 0 DIADMM Cc1c(NC(=O)c2ccc3ccccc3c2[O-])cccc1N(C)C ZINC000775989533 1048076895 /nfs/dbraw/zinc/07/68/95/1048076895.db2.gz XKGOIWWSXKYSOJ-UHFFFAOYSA-N -1 1 320.392 4.172 20 0 DIADMM C[C@@H](C(=O)Nc1cc([O-])c(F)cc1F)c1ccc(Cl)cc1 ZINC001160917443 1048096865 /nfs/dbraw/zinc/09/68/65/1048096865.db2.gz URMGFZXGKUOXCV-MRVPVSSYSA-N -1 1 311.715 4.066 20 0 DIADMM CCOc1ccc(F)c(Nc2cc([O-])c(F)c(F)c2)c1F ZINC001175041129 1048105382 /nfs/dbraw/zinc/10/53/82/1048105382.db2.gz FQWFWEKFZXXMJT-UHFFFAOYSA-N -1 1 301.239 4.091 20 0 DIADMM C[C@@H](NC(=O)Nc1cccc(C(F)(F)F)c1[O-])c1ccccc1 ZINC001185026512 1048113742 /nfs/dbraw/zinc/11/37/42/1048113742.db2.gz BDIAYQZJXRYJSA-SNVBAGLBSA-N -1 1 324.302 4.294 20 0 DIADMM CC(C)(C)C[C@H]1CCN(C(=O)c2ccc([O-])cc2F)C1(C)C ZINC001161555283 1048139176 /nfs/dbraw/zinc/13/91/76/1048139176.db2.gz ZVKDMIHQOHKWRK-GFCCVEGCSA-N -1 1 307.409 4.208 20 0 DIADMM C[C@H]([N-]C(=O)C(F)(F)F)c1ccc(NCCC(C)(C)C)cc1 ZINC001161681327 1048153709 /nfs/dbraw/zinc/15/37/09/1048153709.db2.gz RCOQORUWPUFGLH-NSHDSACASA-N -1 1 316.367 4.274 20 0 DIADMM Cc1ccc2c(c1)scc2C(=O)Nc1ccc(F)cc1[O-] ZINC000480499321 1048159097 /nfs/dbraw/zinc/15/90/97/1048159097.db2.gz OVJKWZXDCWKVHI-UHFFFAOYSA-N -1 1 301.342 4.307 20 0 DIADMM CCCCOc1ccc(C(=O)Nc2ccsc2C)c([O-])c1 ZINC001161727660 1048162223 /nfs/dbraw/zinc/16/22/23/1048162223.db2.gz SVYHTLFECXJITC-UHFFFAOYSA-N -1 1 305.399 4.193 20 0 DIADMM Cc1cc(Nc2ccc(-n3ccc(=O)[n-]3)cc2)ccc1OC(C)C ZINC001175196759 1048174297 /nfs/dbraw/zinc/17/42/97/1048174297.db2.gz GOZPXHLQQWDORP-UHFFFAOYSA-N -1 1 323.396 4.417 20 0 DIADMM CC[C@H](Nc1ccccc1)C(=O)Nc1cc(F)c([O-])cc1Cl ZINC001161866564 1048187032 /nfs/dbraw/zinc/18/70/32/1048187032.db2.gz WVVZHHCSWWCYAX-ZDUSSCGKSA-N -1 1 322.767 4.014 20 0 DIADMM [O-]c1cc(Nc2cccc(O[C@H]3CCCCO3)c2)cc(F)c1F ZINC001175186029 1048188716 /nfs/dbraw/zinc/18/87/16/1048188716.db2.gz DETTYEXKUJRUMA-INIZCTEOSA-N -1 1 321.323 4.319 20 0 DIADMM [O-]c1cc(F)c(F)cc1NC(=S)Nc1cccc(Cl)c1 ZINC001201102402 1048189875 /nfs/dbraw/zinc/18/98/75/1048189875.db2.gz DBXBSHLJPQLCAY-UHFFFAOYSA-N -1 1 314.744 4.133 20 0 DIADMM [O-]c1c(F)cc(NC(=S)Nc2cccc(Cl)c2)cc1F ZINC001201103257 1048191983 /nfs/dbraw/zinc/19/19/83/1048191983.db2.gz UKDVCMIEBJPMKI-UHFFFAOYSA-N -1 1 314.744 4.133 20 0 DIADMM Cc1cc(C)cc(NC(=S)Nc2cc(F)c([O-])c(F)c2)c1 ZINC001201207155 1048217904 /nfs/dbraw/zinc/21/79/04/1048217904.db2.gz RYQZHKLTQSIFMN-UHFFFAOYSA-N -1 1 308.353 4.096 20 0 DIADMM Cc1cc(C)cc(NC(=S)Nc2cc(F)c([O-])cc2F)c1 ZINC001201205512 1048218462 /nfs/dbraw/zinc/21/84/62/1048218462.db2.gz XPSWVKBNEVYEFS-UHFFFAOYSA-N -1 1 308.353 4.096 20 0 DIADMM Cc1cc(Nc2ccc(F)c(Br)c2[O-])ccc1F ZINC001175255990 1048241214 /nfs/dbraw/zinc/24/12/14/1048241214.db2.gz IWWJHZRHLWJNAM-UHFFFAOYSA-N -1 1 314.129 4.485 20 0 DIADMM CC(C)OC(=O)c1ccc(Nc2cc([O-])c(Cl)cc2F)cc1 ZINC001175259951 1048242620 /nfs/dbraw/zinc/24/26/20/1048242620.db2.gz YWZIBDWBXHJZOH-UHFFFAOYSA-N -1 1 323.751 4.494 20 0 DIADMM Cc1c(Cl)cc(Nc2ccc(N(C)C)nc2)c([O-])c1Cl ZINC001175345704 1048252112 /nfs/dbraw/zinc/25/21/12/1048252112.db2.gz GEXOFOANWAPHJH-UHFFFAOYSA-N -1 1 312.200 4.212 20 0 DIADMM C[S@@](=O)c1ccccc1Nc1cc(Cl)c([O-])cc1Cl ZINC001175306905 1048255918 /nfs/dbraw/zinc/25/59/18/1048255918.db2.gz DLFXOYAVZVHACW-LJQANCHMSA-N -1 1 316.209 4.180 20 0 DIADMM C[C@]12CC3CC(NC(=O)c4ccc([O-])c(F)c4)(C1)C[C@@](C)(C3)C2 ZINC001186236993 1048273294 /nfs/dbraw/zinc/27/32/94/1048273294.db2.gz MYXUCGZKKKLHGU-CMXJYWLISA-N -1 1 317.404 4.010 20 0 DIADMM [O-]c1cc(Nc2ccc(-n3cccn3)cc2)c(F)cc1Cl ZINC001175370708 1048283586 /nfs/dbraw/zinc/28/35/86/1048283586.db2.gz UBSJLKHSZLTVIQ-UHFFFAOYSA-N -1 1 303.724 4.114 20 0 DIADMM COc1cc(Nc2c(F)ccc([O-])c2Cl)cc(F)c1F ZINC001250237953 1048297759 /nfs/dbraw/zinc/29/77/59/1048297759.db2.gz TZILJUGVTMMYFT-UHFFFAOYSA-N -1 1 303.667 4.215 20 0 DIADMM Cn1ncc2cccc(Nc3cc(Cl)c([O-])cc3Cl)c21 ZINC001175442651 1048308721 /nfs/dbraw/zinc/30/87/21/1048308721.db2.gz FLHUGZNQEIVHKR-UHFFFAOYSA-N -1 1 308.168 4.329 20 0 DIADMM O=C(Nc1cccc([O-])c1Cl)N[C@@H]1CCCc2ccccc21 ZINC001186457572 1048309225 /nfs/dbraw/zinc/30/92/25/1048309225.db2.gz MLFCVFPRTKPBFB-CYBMUJFWSA-N -1 1 316.788 4.245 20 0 DIADMM Cn1cc2cccc(Nc3ccc(Cl)c(Cl)c3[O-])c2n1 ZINC001175462008 1048310400 /nfs/dbraw/zinc/31/04/00/1048310400.db2.gz BVWIEMDNZPIZCU-UHFFFAOYSA-N -1 1 308.168 4.329 20 0 DIADMM O=C(Nc1ccc([O-])c(Cl)c1)N[C@@H]1CCCc2ccccc21 ZINC001186459081 1048310637 /nfs/dbraw/zinc/31/06/37/1048310637.db2.gz XKAIJKCPGGWNRN-OAHLLOKOSA-N -1 1 316.788 4.245 20 0 DIADMM CC[C@@H](C)Oc1ccc(-c2nc3ccc(C)cc3c(=O)[n-]2)cc1 ZINC000481201298 1048331493 /nfs/dbraw/zinc/33/14/93/1048331493.db2.gz UKMIHFJTEMEBTM-CYBMUJFWSA-N -1 1 308.381 4.076 20 0 DIADMM CC(C)(C)OC(=O)c1cccc(Nc2cc([O-])c(F)c(F)c2)c1 ZINC001175544887 1048332968 /nfs/dbraw/zinc/33/29/68/1048332968.db2.gz PZMGEEAUHZVRHI-UHFFFAOYSA-N -1 1 321.323 4.369 20 0 DIADMM O=c1oc2cc([O-])ccc2cc1N/C=C/c1ccc(Cl)cc1 ZINC001175596881 1048364190 /nfs/dbraw/zinc/36/41/90/1048364190.db2.gz JFHOIXIBUJVJFV-BQYQJAHWSA-N -1 1 313.740 4.235 20 0 DIADMM CCCSCC(=O)Nc1cc(Cl)c([O-])c2ccccc12 ZINC000600135320 1048371819 /nfs/dbraw/zinc/37/18/19/1048371819.db2.gz DOMXABKLQWTCQO-UHFFFAOYSA-N -1 1 309.818 4.281 20 0 DIADMM Cn1cc2cc(Nc3cc(Cl)c([O-])cc3Cl)ccc2n1 ZINC001175625215 1048379649 /nfs/dbraw/zinc/37/96/49/1048379649.db2.gz VXQWJTXAASQJRQ-UHFFFAOYSA-N -1 1 308.168 4.329 20 0 DIADMM Brc1nnc([N-]c2csc3ccccc23)s1 ZINC001201845764 1048388015 /nfs/dbraw/zinc/38/80/15/1048388015.db2.gz PXTADIWXVPOMNH-UHFFFAOYSA-N -1 1 312.217 4.259 20 0 DIADMM O=C(N[C@@H](C1CCC1)C1CCCCC1)c1ccc([O-])c(F)c1 ZINC001163040385 1048408118 /nfs/dbraw/zinc/40/81/18/1048408118.db2.gz UPJHIPRNTXPKCF-QGZVFWFLSA-N -1 1 305.393 4.010 20 0 DIADMM C[C@@H](C1CC1)n1cc([N-]c2nc(C3CCCCC3)ns2)cn1 ZINC001163127187 1048419001 /nfs/dbraw/zinc/41/90/01/1048419001.db2.gz KXNNZLJUAKVTIW-NSHDSACASA-N -1 1 317.462 4.497 20 0 DIADMM Cc1cc(C)c(S(=O)(=O)[N-]c2cccc(C)c2Cl)s1 ZINC000555712256 1048425048 /nfs/dbraw/zinc/42/50/48/1048425048.db2.gz IPABGABJIXRPEB-UHFFFAOYSA-N -1 1 315.847 4.128 20 0 DIADMM O=C(Nc1ccc(F)c(Cl)c1)Nc1cc(F)c(F)cc1[O-] ZINC001187699988 1048429438 /nfs/dbraw/zinc/42/94/38/1048429438.db2.gz RPWAJUSMLFWELX-UHFFFAOYSA-N -1 1 316.666 4.107 20 0 DIADMM O=C(Nc1ccccc1Cl)Nc1cc([O-])c(Cl)cc1F ZINC001202063815 1048435896 /nfs/dbraw/zinc/43/58/96/1048435896.db2.gz GCWGCYIQGFLJCD-UHFFFAOYSA-N -1 1 315.131 4.482 20 0 DIADMM COc1cc(F)c(C(C)C)cc1[N-]c1nnc(-c2ccco2)o1 ZINC001175828694 1048457024 /nfs/dbraw/zinc/45/70/24/1048457024.db2.gz JYHIHZMKNKSUNA-UHFFFAOYSA-N -1 1 317.320 4.344 20 0 DIADMM CC(C)C1(C(=O)Nc2cccc(C(F)(F)F)c2[O-])CCC1 ZINC001142652761 1048471870 /nfs/dbraw/zinc/47/18/70/1048471870.db2.gz ZOGIDVNLLVOQGP-UHFFFAOYSA-N -1 1 301.308 4.176 20 0 DIADMM Brc1ccc(-c2cc([N-]c3cscn3)on2)cc1 ZINC001175937418 1048490315 /nfs/dbraw/zinc/49/03/15/1048490315.db2.gz GPMAAUBQRQYTSX-UHFFFAOYSA-N -1 1 322.187 4.304 20 0 DIADMM Cc1ccc(F)cc1NC(=O)c1ccc([O-])c(C(F)(F)F)c1 ZINC001188562556 1048521889 /nfs/dbraw/zinc/52/18/89/1048521889.db2.gz GZWSDDLUZDUINP-UHFFFAOYSA-N -1 1 313.250 4.111 20 0 DIADMM Cc1ccc(Cl)cc1NC(=O)Nc1cc(Cl)ncc1[O-] ZINC001188706254 1048545093 /nfs/dbraw/zinc/54/50/93/1048545093.db2.gz OBIJFRRGNNATKS-UHFFFAOYSA-N -1 1 312.156 4.046 20 0 DIADMM Cc1ccc(Cl)cc1NC(=O)Nc1cc([O-])c(F)cc1F ZINC001188729463 1048549526 /nfs/dbraw/zinc/54/95/26/1048549526.db2.gz ZBZZTJZINFLRJN-UHFFFAOYSA-N -1 1 312.703 4.276 20 0 DIADMM CC(C)[C@H]1N(c2cc(Cl)[n-]c(=O)n2)CC12CCCCCC2 ZINC001163935754 1048553422 /nfs/dbraw/zinc/55/34/22/1048553422.db2.gz GVBLRCQROWCGGF-CQSZACIVSA-N -1 1 309.841 4.021 20 0 DIADMM Cc1ccc2ccc(F)c(Nc3cc(F)c([O-])c(F)c3)c2n1 ZINC001176117668 1048573447 /nfs/dbraw/zinc/57/34/47/1048573447.db2.gz XDAZFSFJTRANBC-UHFFFAOYSA-N -1 1 304.271 4.410 20 0 DIADMM Cc1noc(C)c1Nc1cc(Br)cc(Cl)c1[O-] ZINC001176185345 1048585817 /nfs/dbraw/zinc/58/58/17/1048585817.db2.gz LQWLILJDWBNXFX-UHFFFAOYSA-N -1 1 317.570 4.157 20 0 DIADMM O=C1CCc2cc(Nc3cccc([O-])c3Br)ccc21 ZINC001176239096 1048614651 /nfs/dbraw/zinc/61/46/51/1048614651.db2.gz SNIBESZSUWXIOO-UHFFFAOYSA-N -1 1 318.170 4.027 20 0 DIADMM COc1ccc(Nc2cc(Cl)cc(Cl)c2[O-])cc1O ZINC001176258686 1048625073 /nfs/dbraw/zinc/62/50/73/1048625073.db2.gz PNWXMWJQZBAMHO-UHFFFAOYSA-N -1 1 300.141 4.157 20 0 DIADMM [O-]c1cc(F)cc(F)c1Nc1ccc(O)cc1C(F)(F)F ZINC001176339340 1048631464 /nfs/dbraw/zinc/63/14/64/1048631464.db2.gz WXNOBNNJYYLHJV-UHFFFAOYSA-N -1 1 305.202 4.138 20 0 DIADMM [O-]c1cc(Nc2ccc(O)cc2C(F)(F)F)cc(F)c1F ZINC001176340202 1048632998 /nfs/dbraw/zinc/63/29/98/1048632998.db2.gz HVKCXZKWJNXHFA-UHFFFAOYSA-N -1 1 305.202 4.138 20 0 DIADMM [O-]c1c(F)c(F)ccc1Nc1ccc(O)cc1C(F)(F)F ZINC001176342753 1048634084 /nfs/dbraw/zinc/63/40/84/1048634084.db2.gz WDWKWQDTUKAQDA-UHFFFAOYSA-N -1 1 305.202 4.138 20 0 DIADMM CCc1cccc(C)c1NC(=O)Nc1cc(F)cc(F)c1[O-] ZINC001189986208 1048686107 /nfs/dbraw/zinc/68/61/07/1048686107.db2.gz RAVHUJROSWNVDY-UHFFFAOYSA-N -1 1 306.312 4.185 20 0 DIADMM CCc1nc(C(C)C)ccc1CSc1nc(C)c(C)c(=O)[n-]1 ZINC001165918346 1048725561 /nfs/dbraw/zinc/72/55/61/1048725561.db2.gz XYSZKXNEXVXGGS-UHFFFAOYSA-N -1 1 317.458 4.172 20 0 DIADMM O=C(c1ccc(Cl)cc1[O-])N1CCC[C@H]1c1cccs1 ZINC000194584204 1048726886 /nfs/dbraw/zinc/72/68/86/1048726886.db2.gz LPNQHJUJILMMAY-LBPRGKRZSA-N -1 1 307.802 4.084 20 0 DIADMM [O-]c1c(F)cc(F)c(Nc2ncc(Cl)cc2Cl)c1F ZINC001176663917 1048751464 /nfs/dbraw/zinc/75/14/64/1048751464.db2.gz OAJNNZNHUFCAEB-UHFFFAOYSA-N -1 1 309.074 4.255 20 0 DIADMM COc1ccc2cc(Nc3c(F)cc(F)c([O-])c3F)cnc2c1 ZINC001176664570 1048752167 /nfs/dbraw/zinc/75/21/67/1048752167.db2.gz QEQYPWDBJNSNGQ-UHFFFAOYSA-N -1 1 320.270 4.110 20 0 DIADMM [O-]c1c(F)cc(F)c(Nc2c(Cl)ccnc2Cl)c1F ZINC001176664386 1048753754 /nfs/dbraw/zinc/75/37/54/1048753754.db2.gz XHSPNYRIBJOWDU-UHFFFAOYSA-N -1 1 309.074 4.255 20 0 DIADMM CNc1ccc(Cl)cc1Nc1c(F)cc(F)c([O-])c1F ZINC001176671454 1048754976 /nfs/dbraw/zinc/75/49/76/1048754976.db2.gz ZOJHUZQRXLCFJJ-UHFFFAOYSA-N -1 1 302.683 4.248 20 0 DIADMM COc1ccc(Nc2c(F)cc(F)c([O-])c2F)c2ncccc12 ZINC001176672417 1048755890 /nfs/dbraw/zinc/75/58/90/1048755890.db2.gz KCKUCASWWZTEBQ-UHFFFAOYSA-N -1 1 320.270 4.110 20 0 DIADMM [O-]c1c(F)cc(F)c(Nc2cc(C(F)(F)F)ccc2O)c1F ZINC001176671995 1048755928 /nfs/dbraw/zinc/75/59/28/1048755928.db2.gz CADOWFXAFKDONY-UHFFFAOYSA-N -1 1 323.192 4.278 20 0 DIADMM [O-]c1c(F)cc(F)c(Nc2ccc(-n3cccc3)cc2)c1F ZINC001176670106 1048756597 /nfs/dbraw/zinc/75/65/97/1048756597.db2.gz RJMAKGDEDSFUHO-UHFFFAOYSA-N -1 1 304.271 4.344 20 0 DIADMM [O-]c1c(F)cc(F)c(Nc2ccccc2-c2cnco2)c1F ZINC001176673724 1048757579 /nfs/dbraw/zinc/75/75/79/1048757579.db2.gz YDMVQOQYFRJASD-UHFFFAOYSA-N -1 1 306.243 4.208 20 0 DIADMM [O-]c1c(F)cc(F)c(Nc2cccc3ncc(F)cc32)c1F ZINC001176674763 1048757747 /nfs/dbraw/zinc/75/77/47/1048757747.db2.gz VHPCNBWAFSWCFJ-UHFFFAOYSA-N -1 1 308.234 4.240 20 0 DIADMM Cc1cc(N)c(Cl)cc1Nc1c(F)cc(F)c([O-])c1F ZINC001176673663 1048757854 /nfs/dbraw/zinc/75/78/54/1048757854.db2.gz VFRITJXFCZQKFR-UHFFFAOYSA-N -1 1 302.683 4.097 20 0 DIADMM COc1ccc2ccc(Nc3c(F)cc(F)c([O-])c3F)cc2n1 ZINC001176674877 1048758163 /nfs/dbraw/zinc/75/81/63/1048758163.db2.gz ZQULBMIVYDECBI-UHFFFAOYSA-N -1 1 320.270 4.110 20 0 DIADMM Cc1ccc(NC(=O)c2cncc([O-])c2)cc1-c1ccsc1 ZINC001177057755 1048821508 /nfs/dbraw/zinc/82/15/08/1048821508.db2.gz LWSSDXNMEGYUSJ-UHFFFAOYSA-N -1 1 310.378 4.076 20 0 DIADMM C[C@H](Cc1ccc(F)cc1)C(=O)Nc1ccc([O-])c(Cl)c1 ZINC000111666118 1048927813 /nfs/dbraw/zinc/92/78/13/1048927813.db2.gz YPTIZRGFIFOKHO-SNVBAGLBSA-N -1 1 307.752 4.002 20 0 DIADMM C[C@@H](Cc1ccc(F)cc1)C(=O)Nc1ccc([O-])c(Cl)c1 ZINC000111666115 1048928176 /nfs/dbraw/zinc/92/81/76/1048928176.db2.gz YPTIZRGFIFOKHO-JTQLQIEISA-N -1 1 307.752 4.002 20 0 DIADMM Cc1ccc(N(C)C(=O)c2ccc(C(F)(F)F)cc2[O-])cc1C ZINC000776706970 1048934320 /nfs/dbraw/zinc/93/43/20/1048934320.db2.gz VQWJZINUYRZVAZ-UHFFFAOYSA-N -1 1 323.314 4.304 20 0 DIADMM [O-]c1ccc(CNc2ccc(-c3nccs3)cc2)c(F)c1F ZINC001204914974 1048955562 /nfs/dbraw/zinc/95/55/62/1048955562.db2.gz ICOCNZUIJAECCR-UHFFFAOYSA-N -1 1 318.348 4.406 20 0 DIADMM CCc1cccc2cc(CN[C@H](CCCC(C)C)C(=O)[O-])oc21 ZINC000904036728 1048959105 /nfs/dbraw/zinc/95/91/05/1048959105.db2.gz QUFHNJRWLXSEAX-QGZVFWFLSA-N -1 1 317.429 4.364 20 0 DIADMM CC(C)(CC(=O)Nc1cc(F)c([O-])cc1Cl)C(F)(F)F ZINC000885678945 1048968861 /nfs/dbraw/zinc/96/88/61/1048968861.db2.gz YQKTXUMTJXVDBY-UHFFFAOYSA-N -1 1 313.678 4.102 20 0 DIADMM Cc1ccc(Cl)c(NC(=O)Nc2cc(F)c(F)cc2[O-])c1 ZINC001191702096 1048980421 /nfs/dbraw/zinc/98/04/21/1048980421.db2.gz CYXHARRBINDTFM-UHFFFAOYSA-N -1 1 312.703 4.276 20 0 DIADMM CC(C)Cc1ccc([C@@H](N[C@@H](C)C(=O)[O-])c2cccs2)cc1 ZINC000904204254 1049002762 /nfs/dbraw/zinc/00/27/62/1049002762.db2.gz VHXUEIIFOHHAFH-SUMWQHHRSA-N -1 1 317.454 4.099 20 0 DIADMM CC(C)Cc1ccc([C@H](N[C@H](C)C(=O)[O-])c2cccs2)cc1 ZINC000904204252 1049002841 /nfs/dbraw/zinc/00/28/41/1049002841.db2.gz VHXUEIIFOHHAFH-DYVFJYSZSA-N -1 1 317.454 4.099 20 0 DIADMM COc1cccc(C)c1NC(=O)c1cc2ccccc2cc1[O-] ZINC000194997422 1049021112 /nfs/dbraw/zinc/02/11/12/1049021112.db2.gz WMXPZNWQDIUNNP-UHFFFAOYSA-N -1 1 307.349 4.115 20 0 DIADMM [O-]c1cc(OC(F)(F)F)ccc1-c1ccc(C(F)(F)F)cn1 ZINC001250450746 1049040755 /nfs/dbraw/zinc/04/07/55/1049040755.db2.gz MAYUKUFEEYEFNO-UHFFFAOYSA-N -1 1 323.192 4.372 20 0 DIADMM CC(C)(C)c1ccc(C(=O)Nc2cnccc2C2CC2)c([O-])c1 ZINC001192313716 1049077067 /nfs/dbraw/zinc/07/70/67/1049077067.db2.gz HUXLVTRKZRLRGM-UHFFFAOYSA-N -1 1 310.397 4.214 20 0 DIADMM CCSc1cccc(F)c1[N-]C(=O)c1cccc(OC)c1F ZINC000484922672 1049082766 /nfs/dbraw/zinc/08/27/66/1049082766.db2.gz BYQDCONSRIWDQD-UHFFFAOYSA-N -1 1 323.364 4.338 20 0 DIADMM O=C([O-])c1ccc(C[N@H+]2CCCC[C@H]2c2ccccc2F)cc1 ZINC001204154385 1049097407 /nfs/dbraw/zinc/09/74/07/1049097407.db2.gz HHSTVHMBNXANTI-SFHVURJKSA-N -1 1 313.372 4.251 20 0 DIADMM O=C([O-])c1ccc(C[N@H+]2CCC[C@H]2c2ccccc2Cl)cc1 ZINC001204154575 1049098378 /nfs/dbraw/zinc/09/83/78/1049098378.db2.gz LQSIJKMNPJIWCU-KRWDZBQOSA-N -1 1 315.800 4.375 20 0 DIADMM O=C([O-])c1ccc(CN2CCC[C@@H]2c2cc(F)cc(F)c2)cc1 ZINC001204160493 1049100445 /nfs/dbraw/zinc/10/04/45/1049100445.db2.gz YURKDVQOKZLMIY-QGZVFWFLSA-N -1 1 317.335 4.000 20 0 DIADMM CCc1ccc(-c2noc(Cc3ccc([O-])c(Cl)c3)n2)cc1 ZINC000904573567 1049103442 /nfs/dbraw/zinc/10/34/42/1049103442.db2.gz HLONBHDWAUBFCY-UHFFFAOYSA-N -1 1 314.772 4.249 20 0 DIADMM CCCCN(Cc1ccccc1)C(=O)c1c(F)ccc([O-])c1F ZINC001192535246 1049116752 /nfs/dbraw/zinc/11/67/52/1049116752.db2.gz CXUCGAHLTGAVGO-UHFFFAOYSA-N -1 1 319.351 4.113 20 0 DIADMM CC(C)C[C@@H](NC(=O)c1c(F)ccc([O-])c1F)c1ccccc1 ZINC001192539529 1049118439 /nfs/dbraw/zinc/11/84/39/1049118439.db2.gz LKAOPUMHNJUKBQ-CQSZACIVSA-N -1 1 319.351 4.188 20 0 DIADMM O=C(Nc1cc(Cl)cc2[nH]ccc21)c1c(F)ccc([O-])c1F ZINC001192540595 1049118572 /nfs/dbraw/zinc/11/85/72/1049118572.db2.gz YAUPEOHNHQXHLS-UHFFFAOYSA-N -1 1 322.698 4.057 20 0 DIADMM CC[C@H](C)c1ccc(NC(=O)c2cc([O-])cc(F)c2F)cc1 ZINC001192651825 1049123315 /nfs/dbraw/zinc/12/33/15/1049123315.db2.gz OJTIYUCWVZYMEP-JTQLQIEISA-N -1 1 305.324 4.436 20 0 DIADMM [O-]c1ccc(Cc2nc(C3CCCCCC3)no2)cc1Cl ZINC000904687508 1049128352 /nfs/dbraw/zinc/12/83/52/1049128352.db2.gz FVUXGCHUUAQIJD-UHFFFAOYSA-N -1 1 306.793 4.457 20 0 DIADMM CC(C)c1ccc(N(C)C(=O)c2c(F)ccc([O-])c2F)cc1 ZINC000857470144 1049155887 /nfs/dbraw/zinc/15/58/87/1049155887.db2.gz DJWCVMAFSXCBLN-UHFFFAOYSA-N -1 1 305.324 4.070 20 0 DIADMM CCCCOC(=O)Nc1c([O-])cc(C(F)(F)F)cc1Cl ZINC001193706805 1049254133 /nfs/dbraw/zinc/25/41/33/1049254133.db2.gz HZJYHEAJBWXWID-UHFFFAOYSA-N -1 1 311.687 4.413 20 0 DIADMM C[C@H](NC(=O)c1cc(Cl)ccc1[O-])c1ccc(Cl)cc1 ZINC000070134295 1049262184 /nfs/dbraw/zinc/26/21/84/1049262184.db2.gz XICIUNSBJPDYQT-VIFPVBQESA-N -1 1 310.180 4.190 20 0 DIADMM CC(C)COC(=O)Nc1c([O-])cc(C(F)(F)F)cc1Cl ZINC001193840028 1049263652 /nfs/dbraw/zinc/26/36/52/1049263652.db2.gz FFYVYIKYCMWWFI-UHFFFAOYSA-N -1 1 311.687 4.269 20 0 DIADMM CCCC[C@H](CC)COC(=O)Nc1cc([O-])c(F)cc1F ZINC001193966777 1049286167 /nfs/dbraw/zinc/28/61/67/1049286167.db2.gz BDIKVUUJCKFJEX-JTQLQIEISA-N -1 1 301.333 4.435 20 0 DIADMM CCCC[C@@H](CC)COC(=O)Nc1cc([O-])c(F)cc1F ZINC001193966778 1049286800 /nfs/dbraw/zinc/28/68/00/1049286800.db2.gz BDIKVUUJCKFJEX-SNVBAGLBSA-N -1 1 301.333 4.435 20 0 DIADMM CSc1ccccc1[N-]C(=O)c1scnc1C(F)(F)F ZINC000485733474 1049330315 /nfs/dbraw/zinc/33/03/15/1049330315.db2.gz AOULVDCSKYLATM-UHFFFAOYSA-N -1 1 318.345 4.136 20 0 DIADMM O=C(CCC(F)=C(F)F)Nc1cccc(C(F)(F)F)c1[O-] ZINC001180279687 1049334468 /nfs/dbraw/zinc/33/44/68/1049334468.db2.gz FOBGVISEDJDXHN-UHFFFAOYSA-N -1 1 313.197 4.207 20 0 DIADMM Cc1ccc2ccccc2c1NC(=O)c1c[n-]c(C(F)(F)F)n1 ZINC001194769949 1049428039 /nfs/dbraw/zinc/42/80/39/1049428039.db2.gz BGXLULHZULJDAI-UHFFFAOYSA-N -1 1 319.286 4.142 20 0 DIADMM Cc1cc(C)c(NC(=O)Nc2cc([O-])c(F)cc2F)c(C)c1 ZINC001181266459 1049458427 /nfs/dbraw/zinc/45/84/27/1049458427.db2.gz QAZUYLCNDQWHNA-UHFFFAOYSA-N -1 1 306.312 4.240 20 0 DIADMM CC[C@@H](C)OC(=O)Nc1c([O-])cc(C(F)(F)F)cc1Cl ZINC001195127120 1049480509 /nfs/dbraw/zinc/48/05/09/1049480509.db2.gz ZZNGLRWBOVXPBC-ZCFIWIBFSA-N -1 1 311.687 4.411 20 0 DIADMM Cc1cc(C)c(NC(=O)Nc2cc(F)cc(F)c2[O-])c(C)c1 ZINC001181509433 1049486602 /nfs/dbraw/zinc/48/66/02/1049486602.db2.gz LVLSDLHZFXXKSA-UHFFFAOYSA-N -1 1 306.312 4.240 20 0 DIADMM CC[C@@H](CC(=O)Nc1cccc([O-])c1Br)C(C)C ZINC000908716662 1049501146 /nfs/dbraw/zinc/50/11/46/1049501146.db2.gz KJQKYVLKGLOFBZ-JTQLQIEISA-N -1 1 314.223 4.166 20 0 DIADMM Cc1ccc([N-]S(=O)(=O)c2c(C)cccc2Cl)c(C)c1 ZINC001195268151 1049504273 /nfs/dbraw/zinc/50/42/73/1049504273.db2.gz RBVQDJLFDKPHMX-UHFFFAOYSA-N -1 1 309.818 4.066 20 0 DIADMM O=C(Nc1ccc2ccoc2c1)Nc1ccc([O-])c(Cl)c1 ZINC000487227306 1049533338 /nfs/dbraw/zinc/53/33/38/1049533338.db2.gz BPMDXYOWQGJNAC-UHFFFAOYSA-N -1 1 302.717 4.436 20 0 DIADMM O=C(Nc1cccc(C(F)(F)F)c1[O-])[C@H]1CC12CCCCC2 ZINC001181908123 1049544873 /nfs/dbraw/zinc/54/48/73/1049544873.db2.gz KKGBGJANXWHACD-LLVKDONJSA-N -1 1 313.319 4.320 20 0 DIADMM Cc1ccccc1SC[C@@H](C)CSc1ncc(C)c(=O)[n-]1 ZINC000863342124 1049556080 /nfs/dbraw/zinc/55/60/80/1049556080.db2.gz ZHMWEIUGZIFFGF-LLVKDONJSA-N -1 1 320.483 4.320 20 0 DIADMM O=C(CC[C@H]1CCc2ccccc21)Nc1cc([O-])c(F)cc1F ZINC000909971544 1049573190 /nfs/dbraw/zinc/57/31/90/1049573190.db2.gz FNUQJJKPGOTBEX-GFCCVEGCSA-N -1 1 317.335 4.119 20 0 DIADMM CCCCC[C@H](C)NC(=O)c1c([O-])cnc2ccc(Cl)cc21 ZINC001182091520 1049574360 /nfs/dbraw/zinc/57/43/60/1049574360.db2.gz MNDNCIZCAGFWGG-NSHDSACASA-N -1 1 320.820 4.292 20 0 DIADMM O=C(Nc1cc([O-])c(F)cc1F)[C@@H]1CC[C@@H](c2ccccc2)C1 ZINC000909989138 1049577853 /nfs/dbraw/zinc/57/78/53/1049577853.db2.gz VXIOYSWTKXIRMX-CHWSQXEVSA-N -1 1 317.335 4.193 20 0 DIADMM CC(C)=CC[C@H](NCc1ccc(-c2ccc(C)cc2)o1)C(=O)[O-] ZINC000864526974 1049665232 /nfs/dbraw/zinc/66/52/32/1049665232.db2.gz ACHCTSCKSFMOKB-KRWDZBQOSA-N -1 1 313.397 4.154 20 0 DIADMM [O-]c1cc(F)c(NC(=S)Nc2ccc(Cl)cc2)cc1F ZINC001197337225 1049746403 /nfs/dbraw/zinc/74/64/03/1049746403.db2.gz YSLDSKFREZPGBI-UHFFFAOYSA-N -1 1 314.744 4.133 20 0 DIADMM CC1(C)CN(Cc2cccc([O-])c2Cl)c2cc(F)ccc21 ZINC001206516874 1049748903 /nfs/dbraw/zinc/74/89/03/1049748903.db2.gz GUIJGRZQQHUITQ-UHFFFAOYSA-N -1 1 305.780 4.483 20 0 DIADMM Cc1ncc(Nc2c(Cl)ccc(Br)c2[O-])s1 ZINC001212144438 1049912254 /nfs/dbraw/zinc/91/22/54/1049912254.db2.gz UOLYCQRLRMBEEO-UHFFFAOYSA-N -1 1 319.611 4.317 20 0 DIADMM Cc1oc(CN(C)[C@H]2CCc3c2cccc3Cl)cc1C(=O)[O-] ZINC000572295945 1050000025 /nfs/dbraw/zinc/00/00/25/1050000025.db2.gz GYHRJCMFLCKAIT-INIZCTEOSA-N -1 1 319.788 4.059 20 0 DIADMM COc1ccc(C=C2SC(=S)[N-]C2=O)cc1OCC(C)C ZINC000056683515 1050036376 /nfs/dbraw/zinc/03/63/76/1050036376.db2.gz ZUPQUUFJQQJQOI-NTUHNPAUSA-N -1 1 323.439 4.059 20 0 DIADMM [O-]c1cc(Cl)c(Nc2ccc3c(c2)NCCO3)cc1Cl ZINC001209799812 1050086171 /nfs/dbraw/zinc/08/61/71/1050086171.db2.gz MGORTWVZHUEFEE-UHFFFAOYSA-N -1 1 311.168 4.247 20 0 DIADMM COc1cc(C(F)(F)F)ccc1Nc1cc(F)c([O-])c(F)c1 ZINC001209884058 1050100514 /nfs/dbraw/zinc/10/05/14/1050100514.db2.gz LKNHBYDGFPAXDV-UHFFFAOYSA-N -1 1 319.229 4.441 20 0 DIADMM [O-]c1cc(Nc2ccc(O)c(C(F)(F)F)c2)cc(F)c1F ZINC001209986312 1050117479 /nfs/dbraw/zinc/11/74/79/1050117479.db2.gz XUOAJEGNHYWWLG-UHFFFAOYSA-N -1 1 305.202 4.138 20 0 DIADMM Cc1ccccc1[C@@H](CC(C)C)NC(=O)c1ccc(F)c([O-])c1 ZINC001136769183 1050151588 /nfs/dbraw/zinc/15/15/88/1050151588.db2.gz CXGCUQCGUCUONE-QGZVFWFLSA-N -1 1 315.388 4.357 20 0 DIADMM CC(C)c1ccc(SCC(=O)c2ccc([O-])cc2O)cc1 ZINC000031817727 1050159381 /nfs/dbraw/zinc/15/93/81/1050159381.db2.gz VVQFNNSFYCMTCL-UHFFFAOYSA-N -1 1 302.395 4.196 20 0 DIADMM CC(=O)c1ccc(Nc2cc(Cl)c(C)c(Cl)c2[O-])cn1 ZINC001210276022 1050188285 /nfs/dbraw/zinc/18/82/85/1050188285.db2.gz JZTQJJXLIMJZSR-UHFFFAOYSA-N -1 1 311.168 4.349 20 0 DIADMM Cc1[nH]c2ccc(-c3nc4cccc(F)c4c(=O)[n-]3)cc2c1C ZINC000591726635 1050200216 /nfs/dbraw/zinc/20/02/16/1050200216.db2.gz QQWVUXLTUGXCEM-UHFFFAOYSA-N -1 1 307.328 4.240 20 0 DIADMM CCCCCC(CCCCC)OCCCC[P@](=O)([O-])O ZINC001225019188 1050229191 /nfs/dbraw/zinc/22/91/91/1050229191.db2.gz UKJWQCWQBMTSQE-UHFFFAOYSA-N -1 1 308.399 4.490 20 0 DIADMM CCc1nc(SCc2c(F)cccc2Cl)[n-]c(=O)c1C ZINC000573816271 1050254063 /nfs/dbraw/zinc/25/40/63/1050254063.db2.gz AUYHNQLICFOXAT-UHFFFAOYSA-N -1 1 312.797 4.138 20 0 DIADMM [O-]c1c(Cl)cc(Cl)cc1Nc1ccc(CO)c(F)c1 ZINC001210485157 1050261645 /nfs/dbraw/zinc/26/16/45/1050261645.db2.gz LCVLIWYURSKDBK-UHFFFAOYSA-N -1 1 302.132 4.074 20 0 DIADMM O=c1oc2cc([O-])ccc2cc1Nc1cccc(F)c1Cl ZINC001210541863 1050289012 /nfs/dbraw/zinc/28/90/12/1050289012.db2.gz VDEBAABLWRSIAF-UHFFFAOYSA-N -1 1 305.692 4.035 20 0 DIADMM COc1cc(F)c(F)cc1Nc1cc([O-])c(Cl)cc1F ZINC001210548980 1050292008 /nfs/dbraw/zinc/29/20/08/1050292008.db2.gz YOMNPUNDTFVXAP-UHFFFAOYSA-N -1 1 303.667 4.215 20 0 DIADMM Cc1oncc1[N-]c1oncc1-c1ccc(Br)cc1 ZINC001210577856 1050304206 /nfs/dbraw/zinc/30/42/06/1050304206.db2.gz HBJCCXSYERLWNK-UHFFFAOYSA-N -1 1 320.146 4.144 20 0 DIADMM CC/C(C)=C/C(=O)Nc1c([O-])cc(Br)cc1Cl ZINC000843887447 1050331294 /nfs/dbraw/zinc/33/12/94/1050331294.db2.gz WDZHIYBZHVNPHE-QPJJXVBHSA-N -1 1 318.598 4.103 20 0 DIADMM CSc1ccc2ncnc(-c3cccc([O-])c3Cl)c2c1 ZINC001242799421 1050406599 /nfs/dbraw/zinc/40/65/99/1050406599.db2.gz KAIJHKKRBILFTD-UHFFFAOYSA-N -1 1 302.786 4.378 20 0 DIADMM Cc1nc(Cl)ncc1Nc1cc(Cl)c([O-])c(Cl)c1 ZINC001210924618 1050416490 /nfs/dbraw/zinc/41/64/90/1050416490.db2.gz OJSISIAOZMEENT-UHFFFAOYSA-N -1 1 304.564 4.194 20 0 DIADMM C[C@@H](NC(=O)c1c([O-])cccc1Cl)c1cc2ccccc2o1 ZINC000785831808 1050417747 /nfs/dbraw/zinc/41/77/47/1050417747.db2.gz VSHDJNMZSZHSIF-SNVBAGLBSA-N -1 1 315.756 4.283 20 0 DIADMM [O-]c1c(F)c(F)ccc1Nc1cccc(OCC(F)(F)F)c1 ZINC001212173845 1050424966 /nfs/dbraw/zinc/42/49/66/1050424966.db2.gz VCTDKRIMWXSNND-UHFFFAOYSA-N -1 1 319.229 4.355 20 0 DIADMM Cc1ccc(Nc2cc(Br)cc(Cl)c2[O-])nc1 ZINC001211013908 1050447314 /nfs/dbraw/zinc/44/73/14/1050447314.db2.gz MTRIXWVTFAUIFQ-UHFFFAOYSA-N -1 1 313.582 4.255 20 0 DIADMM Cc1ccc(OC(C)C)c(Nc2ccc(-n3ccc(=O)[n-]3)cc2)c1 ZINC001211280476 1050534349 /nfs/dbraw/zinc/53/43/49/1050534349.db2.gz OPGYRZQISFZQSH-UHFFFAOYSA-N -1 1 323.396 4.417 20 0 DIADMM Cc1ccc(S(=O)(=O)[N-]c2ccc(Cl)cc2Cl)s1 ZINC000069572723 1050549047 /nfs/dbraw/zinc/54/90/47/1050549047.db2.gz SKXZKPACKWHEBJ-UHFFFAOYSA-N -1 1 322.238 4.164 20 0 DIADMM COC(=O)[C@@H](c1ccc(-c2cc(F)c([O-])cc2F)cc1)C(C)C ZINC001211352621 1050555258 /nfs/dbraw/zinc/55/52/58/1050555258.db2.gz NLXRTNMSPJKSOF-QGZVFWFLSA-N -1 1 320.335 4.250 20 0 DIADMM [O-]c1cc(F)c(-c2ccc(-c3nc4cc[nH]cc-4n3)cc2)cc1F ZINC001211350543 1050555309 /nfs/dbraw/zinc/55/53/09/1050555309.db2.gz SHSFUGPXKQZZCU-UHFFFAOYSA-N -1 1 323.302 4.276 20 0 DIADMM [O-]c1cc(F)c(-c2ccc3nnc(-c4ccccc4)n3c2)cc1F ZINC001211360668 1050557399 /nfs/dbraw/zinc/55/73/99/1050557399.db2.gz VCPDDRMZHQRYNL-UHFFFAOYSA-N -1 1 323.302 4.047 20 0 DIADMM [O-]c1c(Cl)c(Cl)ccc1Nc1cccc(CO)c1F ZINC001211442215 1050569727 /nfs/dbraw/zinc/56/97/27/1050569727.db2.gz KMRXOXSHTPFEMU-UHFFFAOYSA-N -1 1 302.132 4.074 20 0 DIADMM C[C@H](NC(=O)c1c([O-])cccc1Cl)c1cc2ccccc2o1 ZINC000787411731 1050597851 /nfs/dbraw/zinc/59/78/51/1050597851.db2.gz VSHDJNMZSZHSIF-JTQLQIEISA-N -1 1 315.756 4.283 20 0 DIADMM COc1ccccc1[C@H]1CCCN1Cc1c(F)cc([O-])cc1F ZINC001144555132 1050614901 /nfs/dbraw/zinc/61/49/01/1050614901.db2.gz WQGRLMNXVYEXOF-QGZVFWFLSA-N -1 1 319.351 4.016 20 0 DIADMM COc1cccc([C@@H]2CCCN2Cc2cc(F)c([O-])cc2F)c1 ZINC001144657900 1050641821 /nfs/dbraw/zinc/64/18/21/1050641821.db2.gz MLMUYYXJTSXKPJ-KRWDZBQOSA-N -1 1 319.351 4.016 20 0 DIADMM O=C1CCCCc2c(Nc3cc(F)c([O-])c(F)c3)cccc21 ZINC001213386482 1050643778 /nfs/dbraw/zinc/64/37/78/1050643778.db2.gz FQCGYPFMFSXJFC-UHFFFAOYSA-N -1 1 303.308 4.323 20 0 DIADMM CC[C@H]1c2ccccc2CCN1Cc1cc(F)c([O-])cc1F ZINC001144659330 1050648658 /nfs/dbraw/zinc/64/86/58/1050648658.db2.gz DMHVAQSBMCUINO-KRWDZBQOSA-N -1 1 303.352 4.180 20 0 DIADMM CCN(Cc1cccc(Cl)c1)Cc1cc(F)c([O-])cc1F ZINC001144659515 1050649594 /nfs/dbraw/zinc/64/95/94/1050649594.db2.gz LLGDSQMMUSCJJJ-UHFFFAOYSA-N -1 1 311.759 4.346 20 0 DIADMM O=C([O-])c1ccsc1CN1CCC[C@H]1c1cc(F)ccc1F ZINC001144677759 1050650949 /nfs/dbraw/zinc/65/09/49/1050650949.db2.gz BGROFEVKMVFKAK-AWEZNQCLSA-N -1 1 323.364 4.062 20 0 DIADMM O=c1ccn(-c2ccc(Nc3c(F)cccc3C3CC3)cc2)[n-]1 ZINC001213454562 1050658371 /nfs/dbraw/zinc/65/83/71/1050658371.db2.gz DBGAVVGVBIHESX-UHFFFAOYSA-N -1 1 309.344 4.338 20 0 DIADMM C/C(=C/CN1CCC[C@H]1c1ccc(Cl)c(Cl)c1)C(=O)[O-] ZINC000846237267 1050701438 /nfs/dbraw/zinc/70/14/38/1050701438.db2.gz CEFFOEDEAJMXDX-APFBBLRHSA-N -1 1 314.212 4.161 20 0 DIADMM Cc1ccc(Cl)c(-c2noc(-c3cc([O-])cnc3Cl)n2)c1 ZINC001213696070 1050721240 /nfs/dbraw/zinc/72/12/40/1050721240.db2.gz DNPJALPVRCNDBZ-UHFFFAOYSA-N -1 1 322.151 4.119 20 0 DIADMM Cc1cccc2c1CC[C@H]2NC(=O)c1cc2ccccc2cc1[O-] ZINC001144848471 1050724900 /nfs/dbraw/zinc/72/49/00/1050724900.db2.gz BCRPLYAPYRUQEU-LJQANCHMSA-N -1 1 317.388 4.271 20 0 DIADMM CCSc1ccc([C@@H](C)NC(=O)c2c([O-])cccc2F)cc1 ZINC001144865440 1050733649 /nfs/dbraw/zinc/73/36/49/1050733649.db2.gz REOJALOIEREMSU-LLVKDONJSA-N -1 1 319.401 4.134 20 0 DIADMM COC(=O)c1c(F)cccc1[N-]c1nc2cc(Cl)ccc2o1 ZINC001214040875 1050803018 /nfs/dbraw/zinc/80/30/18/1050803018.db2.gz FDQUEAJGIYMJFT-UHFFFAOYSA-N -1 1 320.707 4.151 20 0 DIADMM C[C@@H]1CC[C@](C)(/C=C\C(=O)Nc2c([O-])cccc2F)C1(C)C ZINC001146492737 1050825731 /nfs/dbraw/zinc/82/57/31/1050825731.db2.gz PSURODJGELIEGL-GOCTYOJASA-N -1 1 305.393 4.488 20 0 DIADMM COCOc1cccc(Cl)c1Nc1c([O-])cc(F)cc1F ZINC001214309207 1050866083 /nfs/dbraw/zinc/86/60/83/1050866083.db2.gz CJWWSRFUGGFTSW-UHFFFAOYSA-N -1 1 315.703 4.050 20 0 DIADMM CSc1ccc([O-])c(C(=O)N2CC(C)(C)c3ccccc32)c1 ZINC001170120889 1050890375 /nfs/dbraw/zinc/89/03/75/1050890375.db2.gz ALUWSRDWFSEYRE-UHFFFAOYSA-N -1 1 313.422 4.052 20 0 DIADMM [O-]c1cc(Nc2ccc(OC(F)(F)F)cc2O)cc(F)c1F ZINC001214395533 1050892482 /nfs/dbraw/zinc/89/24/82/1050892482.db2.gz NJOFGIVNDCPTIA-UHFFFAOYSA-N -1 1 321.201 4.018 20 0 DIADMM Cc1cc(N)c(Cl)cc1Nc1cc(F)c([O-])c(Cl)c1 ZINC001214490040 1050922731 /nfs/dbraw/zinc/92/27/31/1050922731.db2.gz NXKZKDMZDATCOB-UHFFFAOYSA-N -1 1 301.148 4.472 20 0 DIADMM O=c1oc2ccccc2cc1Nc1cc(F)c([O-])c(Cl)c1 ZINC001214482864 1050917654 /nfs/dbraw/zinc/91/76/54/1050917654.db2.gz SCHDTGDHNJETSG-UHFFFAOYSA-N -1 1 305.692 4.035 20 0 DIADMM CC(C)NC(=O)c1cccc(Nc2cc(F)c([O-])c(Cl)c2)c1 ZINC001214488783 1050919417 /nfs/dbraw/zinc/91/94/17/1050919417.db2.gz LSVCMHRPQRGBBB-UHFFFAOYSA-N -1 1 322.767 4.067 20 0 DIADMM COC(=O)c1cc(Nc2cc(F)c([O-])c(Cl)c2)ccc1C ZINC001214488360 1050919539 /nfs/dbraw/zinc/91/95/39/1050919539.db2.gz DODPFMZKAYBOQR-UHFFFAOYSA-N -1 1 309.724 4.023 20 0 DIADMM [O-]c1c(F)cc(Nc2cc(CO)ccc2Cl)cc1Cl ZINC001214491603 1050922697 /nfs/dbraw/zinc/92/26/97/1050922697.db2.gz FIJXJHUKWSBLHG-UHFFFAOYSA-N -1 1 302.132 4.074 20 0 DIADMM COC(=O)c1cc(Nc2cc(F)c([O-])c(Cl)c2)c(C)cc1C ZINC001214491962 1050923584 /nfs/dbraw/zinc/92/35/84/1050923584.db2.gz NKFHJECGVLPXDR-UHFFFAOYSA-N -1 1 323.751 4.332 20 0 DIADMM COc1ccc(C(C)=O)c(Nc2c(Cl)ccc([O-])c2F)c1C ZINC001214561371 1050945175 /nfs/dbraw/zinc/94/51/75/1050945175.db2.gz IUTOBSOOQYBOBO-UHFFFAOYSA-N -1 1 323.751 4.448 20 0 DIADMM CC(=O)c1c(F)cc(F)cc1Nc1c(Cl)ccc([O-])c1F ZINC001214563751 1050947132 /nfs/dbraw/zinc/94/71/32/1050947132.db2.gz QXNIEXDENQSQLW-UHFFFAOYSA-N -1 1 315.678 4.409 20 0 DIADMM Cc1c(Cl)cc(Nc2cccc(F)c2CO)c([O-])c1Cl ZINC001214618622 1050964177 /nfs/dbraw/zinc/96/41/77/1050964177.db2.gz BLPGCSOZSFANIU-UHFFFAOYSA-N -1 1 316.159 4.382 20 0 DIADMM CSc1nc2ccnc(-c3c(F)ccc([O-])c3F)c2s1 ZINC001241290743 1050965664 /nfs/dbraw/zinc/96/56/64/1050965664.db2.gz CMPYAPFETGUZMV-UHFFFAOYSA-N -1 1 310.350 4.064 20 0 DIADMM O=C(Nc1ccc(F)c(O)c1)c1cccc(-c2ccccc2)c1[O-] ZINC001148868824 1050979030 /nfs/dbraw/zinc/97/90/30/1050979030.db2.gz CKSAYQVUMHRXGA-UHFFFAOYSA-N -1 1 323.323 4.156 20 0 DIADMM C[C@@H]1CCC[C@@H](C)N1C(=O)c1cccc(-c2ccccc2)c1[O-] ZINC001148861053 1050979275 /nfs/dbraw/zinc/97/92/75/1050979275.db2.gz IQKZOCYPOKIHIC-HUUCEWRRSA-N -1 1 309.409 4.462 20 0 DIADMM C[C@@H]1CCC[C@H](C)N1C(=O)c1cccc(-c2ccccc2)c1[O-] ZINC001148861051 1050979711 /nfs/dbraw/zinc/97/97/11/1050979711.db2.gz IQKZOCYPOKIHIC-GASCZTMLSA-N -1 1 309.409 4.462 20 0 DIADMM CC1(C)C[C@@]1(NC(=O)c1cc(Cl)ccc1[O-])c1ccccc1 ZINC001148887900 1050981461 /nfs/dbraw/zinc/98/14/61/1050981461.db2.gz PJDFQKOXAKVBCY-GOSISDBHSA-N -1 1 315.800 4.101 20 0 DIADMM C/C(=C/C(=O)Nc1c([O-])cccc1F)c1ccccc1Cl ZINC000743416269 1051026261 /nfs/dbraw/zinc/02/62/61/1051026261.db2.gz PPJFRSISGBZRSW-KTKRTIGZSA-N -1 1 305.736 4.227 20 0 DIADMM CCc1ccc(-c2ccc(C(=O)[N-]c3nc(C4CC4)no3)o2)cc1 ZINC000743420098 1051026502 /nfs/dbraw/zinc/02/65/02/1051026502.db2.gz VKTIINBAYKKKBQ-UHFFFAOYSA-N -1 1 323.352 4.022 20 0 DIADMM CC(C)Oc1c(F)cc(-c2ccc([O-])c(F)c2F)cc1F ZINC001243342537 1051062126 /nfs/dbraw/zinc/06/21/26/1051062126.db2.gz QIEBFRQUCMTNSK-UHFFFAOYSA-N -1 1 300.251 4.403 20 0 DIADMM COc1cccc([O-])c1-c1nc(-c2ccc(Cl)c(C)c2)no1 ZINC001215322555 1051165647 /nfs/dbraw/zinc/16/56/47/1051165647.db2.gz VCDQQBGWKWAZHR-UHFFFAOYSA-N -1 1 316.744 4.080 20 0 DIADMM Cc1cc(F)c(F)cc1-c1noc(-c2ccc([O-])cc2Cl)n1 ZINC001215343350 1051172426 /nfs/dbraw/zinc/17/24/26/1051172426.db2.gz UBOFCCRDJUOQDA-UHFFFAOYSA-N -1 1 322.698 4.349 20 0 DIADMM Cc1ccc(-c2noc(-c3ccc([O-])cc3Cl)n2)c(F)c1 ZINC001215343548 1051173136 /nfs/dbraw/zinc/17/31/36/1051173136.db2.gz YEGYEFNZWCNHJP-UHFFFAOYSA-N -1 1 304.708 4.210 20 0 DIADMM COc1ccc(-c2noc(-c3ccc([O-])cc3Cl)n2)c(C)c1 ZINC001215343376 1051173149 /nfs/dbraw/zinc/17/31/49/1051173149.db2.gz VJMCGYPLPMHRER-UHFFFAOYSA-N -1 1 316.744 4.080 20 0 DIADMM Cc1ccc(-c2noc(-c3ccc([O-])cc3Cl)n2)cc1C ZINC001215343572 1051173283 /nfs/dbraw/zinc/17/32/83/1051173283.db2.gz ZLLGOVLFOGOYHH-UHFFFAOYSA-N -1 1 300.745 4.379 20 0 DIADMM COC(=O)c1cc(Nc2cc([O-])c(Cl)cc2F)ccc1C ZINC001212626868 1051208925 /nfs/dbraw/zinc/20/89/25/1051208925.db2.gz UEXHVHHXBGPUJP-UHFFFAOYSA-N -1 1 309.724 4.023 20 0 DIADMM CCCCOc1ccc([N-]c2nnc(C(C)(C)C)o2)c(F)c1 ZINC001215481316 1051216630 /nfs/dbraw/zinc/21/66/30/1051216630.db2.gz BGKNBVXYPCDJKT-UHFFFAOYSA-N -1 1 307.369 4.429 20 0 DIADMM Cc1c(Cl)ccc(Nc2cc3ccc([O-])cc3oc2=O)c1F ZINC001215524494 1051231943 /nfs/dbraw/zinc/23/19/43/1051231943.db2.gz PFECXWFNUAGBGG-UHFFFAOYSA-N -1 1 319.719 4.343 20 0 DIADMM CNc1ccc(C(F)(F)F)cc1Nc1cc(F)c([O-])cc1F ZINC001215573357 1051250394 /nfs/dbraw/zinc/25/03/94/1051250394.db2.gz GXARBIDZBKJOEV-UHFFFAOYSA-N -1 1 318.245 4.475 20 0 DIADMM CCOc1ccc(OCC)c(Nc2cc(F)c([O-])cc2F)c1 ZINC001215571849 1051250565 /nfs/dbraw/zinc/25/05/65/1051250565.db2.gz NMTYVSXGWMBPER-UHFFFAOYSA-N -1 1 309.312 4.211 20 0 DIADMM [O-]c1cc(F)c(Nc2cccc(F)c2Br)cc1F ZINC001215573918 1051253573 /nfs/dbraw/zinc/25/35/73/1051253573.db2.gz TWALKHFOGQSUSW-UHFFFAOYSA-N -1 1 318.092 4.316 20 0 DIADMM CC(=O)Nc1cc(Nc2cc(F)c([O-])cc2F)ccc1Cl ZINC001215573852 1051254516 /nfs/dbraw/zinc/25/45/16/1051254516.db2.gz ROCXNJAMKGLXHU-UHFFFAOYSA-N -1 1 312.703 4.026 20 0 DIADMM [O-]c1ccc(Cl)c(Nc2ccc(F)c(CO)c2F)c1Cl ZINC001215653128 1051287350 /nfs/dbraw/zinc/28/73/50/1051287350.db2.gz NCSMDWRYYIKRHM-UHFFFAOYSA-N -1 1 320.122 4.213 20 0 DIADMM Cc1cccc(-c2noc(-c3cc(F)ccc3[O-])n2)c1Cl ZINC001215769400 1051356098 /nfs/dbraw/zinc/35/60/98/1051356098.db2.gz HEADDJFTDOSDFT-UHFFFAOYSA-N -1 1 304.708 4.210 20 0 DIADMM [O-]c1ccc(F)cc1-c1nc(-c2cccc3c2CCCC3)no1 ZINC001215769765 1051357809 /nfs/dbraw/zinc/35/78/09/1051357809.db2.gz QTUUOTODJJDDDI-UHFFFAOYSA-N -1 1 310.328 4.127 20 0 DIADMM CCCOc1ccccc1[C@@H](CC(C)C)[N-]C(=O)C(F)(F)F ZINC000746360786 1051382820 /nfs/dbraw/zinc/38/28/20/1051382820.db2.gz MWOFZCMJSYFMED-CYBMUJFWSA-N -1 1 317.351 4.241 20 0 DIADMM [O-]c1ccc(-c2nc(-c3cc(Cl)ccc3F)no2)c(F)c1 ZINC001215826026 1051391066 /nfs/dbraw/zinc/39/10/66/1051391066.db2.gz CUECOSWKYDLVNZ-UHFFFAOYSA-N -1 1 308.671 4.041 20 0 DIADMM CC(C)(C)C(=O)Nc1ccccc1Nc1cc([O-])c(F)c(F)c1 ZINC001215834465 1051398014 /nfs/dbraw/zinc/39/80/14/1051398014.db2.gz OKYBXXHSNVUJKP-UHFFFAOYSA-N -1 1 320.339 4.399 20 0 DIADMM CSc1ccc(F)c(Nc2cc([O-])c(F)c(F)c2)c1F ZINC001215839179 1051403205 /nfs/dbraw/zinc/40/32/05/1051403205.db2.gz OBIYNPPPTSKWOJ-UHFFFAOYSA-N -1 1 303.280 4.414 20 0 DIADMM CSc1ccc(F)c(Nc2c([O-])cc(F)cc2F)c1F ZINC001215839535 1051404149 /nfs/dbraw/zinc/40/41/49/1051404149.db2.gz SREMUOYVUXGLEW-UHFFFAOYSA-N -1 1 303.280 4.414 20 0 DIADMM [O-]c1cc(-c2nc(-c3ccc(Cl)c(F)c3)no2)ccc1F ZINC001215839631 1051404696 /nfs/dbraw/zinc/40/46/96/1051404696.db2.gz WVLDOJUCAYVZPB-UHFFFAOYSA-N -1 1 308.671 4.041 20 0 DIADMM Cc1ccc(-c2noc(-c3ccc(F)c([O-])c3)n2)cc1Cl ZINC001215843047 1051407611 /nfs/dbraw/zinc/40/76/11/1051407611.db2.gz YBIGXMIZIRZCHK-UHFFFAOYSA-N -1 1 304.708 4.210 20 0 DIADMM [O-]c1cc(-c2nc(-c3ccc4ccccc4c3)no2)ccc1F ZINC001215843002 1051407808 /nfs/dbraw/zinc/40/78/08/1051407808.db2.gz VZQPNKPRADKBID-UHFFFAOYSA-N -1 1 306.296 4.402 20 0 DIADMM CSc1cc(C)ccc1Nc1ccc(-n2ccc(=O)[n-]2)cc1 ZINC001215874109 1051430249 /nfs/dbraw/zinc/43/02/49/1051430249.db2.gz QXOKLDXDQFFVOS-UHFFFAOYSA-N -1 1 311.410 4.352 20 0 DIADMM CSc1c(F)cc(Nc2ccc(F)c(F)c2[O-])cc1F ZINC001215925939 1051462106 /nfs/dbraw/zinc/46/21/06/1051462106.db2.gz FFYJZWOMKPDUIW-UHFFFAOYSA-N -1 1 303.280 4.414 20 0 DIADMM CC(F)(F)c1ccc(Nc2cc3ccc([O-])cc3oc2=O)cc1 ZINC001212675224 1051472675 /nfs/dbraw/zinc/47/26/75/1051472675.db2.gz LTWDVXHHKANFRL-UHFFFAOYSA-N -1 1 317.291 4.354 20 0 DIADMM Cc1ccccc1[C@@H](C)NC(=O)c1ccc(C(F)(F)F)cc1[O-] ZINC001169012049 1051487138 /nfs/dbraw/zinc/48/71/38/1051487138.db2.gz CJRQTIPIINABJI-LLVKDONJSA-N -1 1 323.314 4.210 20 0 DIADMM CSc1cc(F)c(Nc2cc([O-])c(F)c(F)c2)cc1F ZINC001215968040 1051492110 /nfs/dbraw/zinc/49/21/10/1051492110.db2.gz YOZBLQQEQSDCCJ-UHFFFAOYSA-N -1 1 303.280 4.414 20 0 DIADMM CSc1cc(F)c(Nc2ccnc(Cl)c2[O-])cc1F ZINC001215968670 1051493752 /nfs/dbraw/zinc/49/37/52/1051493752.db2.gz QAXLBROSMHUJJE-UHFFFAOYSA-N -1 1 302.733 4.184 20 0 DIADMM [O-]c1cccc(-c2nc(-c3cccc(C(F)(F)F)c3)no2)c1F ZINC001215983918 1051501809 /nfs/dbraw/zinc/50/18/09/1051501809.db2.gz AORLISIREKPRJE-UHFFFAOYSA-N -1 1 324.233 4.267 20 0 DIADMM Nc1ccc(Nc2cc([O-])c(F)c(F)c2)cc1C(F)(F)F ZINC001216051606 1051549037 /nfs/dbraw/zinc/54/90/37/1051549037.db2.gz BKNDVXHLSKNMPM-UHFFFAOYSA-N -1 1 304.218 4.015 20 0 DIADMM COc1cc(Nc2cc3ccc([O-])cc3oc2=O)ccc1C1CC1 ZINC001216251136 1051657434 /nfs/dbraw/zinc/65/74/34/1051657434.db2.gz FUFVBGHEEWSEPF-UHFFFAOYSA-N -1 1 323.348 4.128 20 0 DIADMM Clc1cc(Cl)c([N-]c2noc3nccnc23)c(Cl)c1 ZINC001216298994 1051682362 /nfs/dbraw/zinc/68/23/62/1051682362.db2.gz RPTNAIQWLOXMCG-UHFFFAOYSA-N -1 1 315.547 4.322 20 0 DIADMM COc1c(O)cccc1Nc1cc(Cl)c([O-])cc1Cl ZINC001216350740 1051715121 /nfs/dbraw/zinc/71/51/21/1051715121.db2.gz WFMIHUWLQWKRLQ-UHFFFAOYSA-N -1 1 300.141 4.157 20 0 DIADMM Cc1c(O)cccc1Nc1ccc(F)c(Br)c1[O-] ZINC001216321856 1051699182 /nfs/dbraw/zinc/69/91/82/1051699182.db2.gz MQKKHVVJLRHBQB-UHFFFAOYSA-N -1 1 312.138 4.051 20 0 DIADMM Cc1ccc(-c2noc(-c3cc([O-])cc(F)c3)n2)c(Cl)c1 ZINC001216340010 1051708008 /nfs/dbraw/zinc/70/80/08/1051708008.db2.gz PMTFJMRLMUIGGE-UHFFFAOYSA-N -1 1 304.708 4.210 20 0 DIADMM [O-]c1cc(F)cc(-c2nc(-c3ccc(C(F)(F)F)cc3)no2)c1 ZINC001216340426 1051708437 /nfs/dbraw/zinc/70/84/37/1051708437.db2.gz YYTCFKLXQWBTHT-UHFFFAOYSA-N -1 1 324.233 4.267 20 0 DIADMM [O-]c1cc(F)cc(-c2nc(-c3cccc(F)c3Cl)no2)c1 ZINC001216340096 1051708923 /nfs/dbraw/zinc/70/89/23/1051708923.db2.gz SAXBEZARZMXDJH-UHFFFAOYSA-N -1 1 308.671 4.041 20 0 DIADMM [O-]c1c(F)c(F)ccc1Nc1c(Cl)cc(CO)cc1Cl ZINC001216365118 1051723048 /nfs/dbraw/zinc/72/30/48/1051723048.db2.gz UXODHHZBZJBNGR-UHFFFAOYSA-N -1 1 320.122 4.213 20 0 DIADMM Cc1oc2ccccc2c1C(=O)Nc1ccc([O-])c(Cl)c1 ZINC000184767645 1051746451 /nfs/dbraw/zinc/74/64/51/1051746451.db2.gz FSNUXGYTWJZXHX-UHFFFAOYSA-N -1 1 301.729 4.353 20 0 DIADMM [O-]c1cc(Nc2cc(Cl)cc(CO)c2)c(F)cc1Cl ZINC001216436500 1051764982 /nfs/dbraw/zinc/76/49/82/1051764982.db2.gz IQHXURROVIBWPY-UHFFFAOYSA-N -1 1 302.132 4.074 20 0 DIADMM [O-]c1c(Br)c(F)ccc1Nc1ccc(F)cc1 ZINC001173800704 1051809463 /nfs/dbraw/zinc/80/94/63/1051809463.db2.gz WOSZYVUGWBQZJS-UHFFFAOYSA-N -1 1 300.102 4.177 20 0 DIADMM O=C([N-]c1c(F)ccnc1F)c1cc(Cl)cc(Cl)c1F ZINC001129367060 1051809719 /nfs/dbraw/zinc/80/97/19/1051809719.db2.gz JCLOPNLOTKUYCX-UHFFFAOYSA-N -1 1 321.085 4.058 20 0 DIADMM COc1c(F)cc(SC)cc1Nc1cc(F)c([O-])c(F)c1 ZINC001216583198 1051826439 /nfs/dbraw/zinc/82/64/39/1051826439.db2.gz MBCVHACGTSUCMO-UHFFFAOYSA-N -1 1 315.316 4.284 20 0 DIADMM CC[C@@H](Sc1nc(C(=O)OC)c[n-]1)c1ccc(Cl)cc1 ZINC000187583713 1051851131 /nfs/dbraw/zinc/85/11/31/1051851131.db2.gz QFCREZIQWKYYDE-GFCCVEGCSA-N -1 1 310.806 4.093 20 0 DIADMM COC(=O)c1cccc(Nc2ccc(Cl)c(Cl)c2[O-])c1 ZINC001173963522 1051895041 /nfs/dbraw/zinc/89/50/41/1051895041.db2.gz JPKWYEDAUUIMRD-UHFFFAOYSA-N -1 1 312.152 4.229 20 0 DIADMM COC(=O)c1cccc(Nc2cc(Cl)cc(Cl)c2[O-])c1 ZINC001173963149 1051895502 /nfs/dbraw/zinc/89/55/02/1051895502.db2.gz JMNMTTASCOLOHB-UHFFFAOYSA-N -1 1 312.152 4.229 20 0 DIADMM O=C(Nc1ccc(F)cc1[O-])c1cc2cccc(Cl)c2o1 ZINC000768257071 1051909905 /nfs/dbraw/zinc/90/99/05/1051909905.db2.gz CWBSAHUWRQCSGC-UHFFFAOYSA-N -1 1 305.692 4.183 20 0 DIADMM [O-]c1cc(F)c(F)c(-c2nc(-c3ccccc3Cl)no2)c1 ZINC001216923899 1051911078 /nfs/dbraw/zinc/91/10/78/1051911078.db2.gz UBNHVBPHFSLJKU-UHFFFAOYSA-N -1 1 308.671 4.041 20 0 DIADMM CO[C@@H](C)c1cccc(NC(=O)Nc2ccc([O-])c(Cl)c2)c1 ZINC000190958599 1051955630 /nfs/dbraw/zinc/95/56/30/1051955630.db2.gz HDLFFZXEKNMTMO-JTQLQIEISA-N -1 1 320.776 4.397 20 0 DIADMM CC(C)NC(=O)c1ccc(Nc2cc([O-])c(Cl)cc2F)cc1 ZINC001174150549 1052020919 /nfs/dbraw/zinc/02/09/19/1052020919.db2.gz MPAPKMZJAUXDKA-UHFFFAOYSA-N -1 1 322.767 4.067 20 0 DIADMM Cc1ccc(-c2noc(-c3c(O)cc4ccccc4c3[O-])n2)cc1 ZINC001217452640 1052060377 /nfs/dbraw/zinc/06/03/77/1052060377.db2.gz GUYCNJBOGSVTSY-UHFFFAOYSA-N -1 1 318.332 4.276 20 0 DIADMM O=C(c1ccccc1)c1ccc(Nc2ccnc(Cl)c2[O-])cc1 ZINC001174223604 1052061371 /nfs/dbraw/zinc/06/13/71/1052061371.db2.gz ZDXHAWHEUWSGAP-UHFFFAOYSA-N -1 1 324.767 4.415 20 0 DIADMM [S-]c1cc(Br)ccc1Nc1ccc2nccn2c1 ZINC001174280142 1052066669 /nfs/dbraw/zinc/06/66/69/1052066669.db2.gz RMOSFWZJHXAXRM-UHFFFAOYSA-N -1 1 320.215 4.129 20 0 DIADMM [O-]c1cc(Nc2cccc(-n3cccn3)c2)c(F)cc1Cl ZINC001174299205 1052077155 /nfs/dbraw/zinc/07/71/55/1052077155.db2.gz YHGMPHAZSMKJQR-UHFFFAOYSA-N -1 1 303.724 4.114 20 0 DIADMM COc1ccc(-c2noc(-c3ccc4sccc4c3[O-])n2)cc1 ZINC001217513583 1052077391 /nfs/dbraw/zinc/07/73/91/1052077391.db2.gz BXDOGCPTZRNGSP-UHFFFAOYSA-N -1 1 324.361 4.333 20 0 DIADMM Cc1cc(C)c(-c2noc(-c3ccc4sccc4c3[O-])n2)cn1 ZINC001217513844 1052079001 /nfs/dbraw/zinc/07/90/01/1052079001.db2.gz AONAJFNJVQQXBU-UHFFFAOYSA-N -1 1 323.377 4.336 20 0 DIADMM C[C@H](c1ccc(F)cc1)N(C)C(=O)c1c([O-])cccc1Cl ZINC000769639489 1052085824 /nfs/dbraw/zinc/08/58/24/1052085824.db2.gz YMSLAAPLDNDMIW-SNVBAGLBSA-N -1 1 307.752 4.018 20 0 DIADMM Cc1cccc(-c2noc(-c3ccc4ccc(C)nc4c3[O-])n2)c1 ZINC001217581388 1052101413 /nfs/dbraw/zinc/10/14/13/1052101413.db2.gz FLROULOPVXCQGZ-UHFFFAOYSA-N -1 1 317.348 4.274 20 0 DIADMM C[C@@H]1CCN(C(=O)c2c([O-])cccc2Cl)[C@@H](c2ccco2)C1 ZINC000769931970 1052134292 /nfs/dbraw/zinc/13/42/92/1052134292.db2.gz HODALSPLWUCBQX-DGCLKSJQSA-N -1 1 319.788 4.252 20 0 DIADMM CCOc1cc(C(=O)Nc2ccccc2CC)cc(Cl)c1[O-] ZINC000193110554 1052185834 /nfs/dbraw/zinc/18/58/34/1052185834.db2.gz QMQJXEHQGILKGC-UHFFFAOYSA-N -1 1 319.788 4.259 20 0 DIADMM O=C(Nc1ccccc1OCc1ccccc1)c1ccccc1[O-] ZINC000310405788 1052267560 /nfs/dbraw/zinc/26/75/60/1052267560.db2.gz HYVIOMTVEALLQT-UHFFFAOYSA-N -1 1 319.360 4.224 20 0 DIADMM COC(=O)c1ccc(C2CC2)c(-c2cc(F)c([O-])cc2F)c1 ZINC001222082419 1052439429 /nfs/dbraw/zinc/43/94/29/1052439429.db2.gz DBMIWMWKRPFPMM-UHFFFAOYSA-N -1 1 304.292 4.001 20 0 DIADMM COc1cc(-c2cc(F)c([O-])cc2F)ccc1-c1ccncc1 ZINC001222083147 1052439784 /nfs/dbraw/zinc/43/97/84/1052439784.db2.gz QASNTYHJAUPROV-UHFFFAOYSA-N -1 1 313.303 4.408 20 0 DIADMM [O-]c1cc(F)c(-c2ccc(O[C@@H]3CCCCO3)cc2F)cc1F ZINC001222083284 1052439938 /nfs/dbraw/zinc/43/99/38/1052439938.db2.gz XXFBHQMSLMTFKV-QGZVFWFLSA-N -1 1 324.298 4.382 20 0 DIADMM [O-]c1ccc(F)cc1-c1nc([C@H]2CCCc3ccccc32)no1 ZINC000322428570 1052487727 /nfs/dbraw/zinc/48/77/27/1052487727.db2.gz NZPNYBPRGHGTMH-AWEZNQCLSA-N -1 1 310.328 4.050 20 0 DIADMM Cc1nc2ccc(-c3cc(C(=O)[O-])cc(C(F)(F)F)c3)cc2[nH]1 ZINC001222610713 1052517366 /nfs/dbraw/zinc/51/73/66/1052517366.db2.gz VIUTUJDBCBCXLL-UHFFFAOYSA-N -1 1 320.270 4.255 20 0 DIADMM CCOc1ccc(OCC)c(NCc2cccc([O-])c2Cl)c1 ZINC000328198867 1052592121 /nfs/dbraw/zinc/59/21/21/1052592121.db2.gz FPRXVYNDRWQNFK-UHFFFAOYSA-N -1 1 321.804 4.455 20 0 DIADMM CC(C)C[C@@H](C)C[C@H](CC(C)C)OCCCC[P@](=O)([O-])O ZINC001225023668 1052745060 /nfs/dbraw/zinc/74/50/60/1052745060.db2.gz ZPYPMXGKMCVLJR-CVEARBPZSA-N -1 1 322.426 4.448 20 0 DIADMM CCCCC(=O)[C@@H](CCCC)Oc1cc([O-])ccc1C(C)=O ZINC001225620294 1052809103 /nfs/dbraw/zinc/80/91/03/1052809103.db2.gz ZKTXBYXNKPTVOL-QGZVFWFLSA-N -1 1 306.402 4.292 20 0 DIADMM CC(=O)c1ccc([O-])cc1OC1CCC(C(F)(F)F)CC1 ZINC001225616983 1052809160 /nfs/dbraw/zinc/80/91/60/1052809160.db2.gz RZMXLZHMSOXGHA-UHFFFAOYSA-N -1 1 302.292 4.095 20 0 DIADMM CC(=O)c1c(O)cc([O-])cc1O[C@@H](C)c1cc(Cl)ccc1C ZINC001225680010 1052815751 /nfs/dbraw/zinc/81/57/51/1052815751.db2.gz UQRNIKMRBVJVLI-NSHDSACASA-N -1 1 320.772 4.402 20 0 DIADMM CC(=O)c1c(O)cc([O-])cc1O[C@H](C)c1csc(Cl)c1 ZINC001225679662 1052815938 /nfs/dbraw/zinc/81/59/38/1052815938.db2.gz QWRQPLRSNXGMNX-MRVPVSSYSA-N -1 1 312.774 4.155 20 0 DIADMM O=C(CC(F)(F)F)[N-][C@H](c1ccc(Cl)cc1)C(F)(F)F ZINC000129981716 1052816978 /nfs/dbraw/zinc/81/69/78/1052816978.db2.gz WJJBVKUKOVBMOM-SECBINFHSA-N -1 1 319.632 4.012 20 0 DIADMM O=C(CC(F)(F)F)[N-][C@@H](c1ccc(Cl)cc1)C(F)(F)F ZINC000129981554 1052817115 /nfs/dbraw/zinc/81/71/15/1052817115.db2.gz WJJBVKUKOVBMOM-VIFPVBQESA-N -1 1 319.632 4.012 20 0 DIADMM C[C@H](Oc1ccc(C(=O)c2ccc([O-])cc2)cc1)c1ccncc1 ZINC001225808484 1052833617 /nfs/dbraw/zinc/83/36/17/1052833617.db2.gz OKYZBPMOXAKJJZ-AWEZNQCLSA-N -1 1 319.360 4.158 20 0 DIADMM COC1=CC[C@H](Oc2ccc(C(=O)c3ccc([O-])cc3)cc2)CC1 ZINC001225807286 1052833688 /nfs/dbraw/zinc/83/36/88/1052833688.db2.gz HAPFEGYUCZZOQM-IBGZPJMESA-N -1 1 324.376 4.085 20 0 DIADMM O=C(c1ccc([O-])cc1)c1ccc(O[C@@H]2CCCC[C@@H]2F)cc1 ZINC001225807553 1052833827 /nfs/dbraw/zinc/83/38/27/1052833827.db2.gz IPWHGHUMBJXLCA-ZWKOTPCHSA-N -1 1 314.356 4.283 20 0 DIADMM Cc1ccc(-c2cc(C(=O)O[C@@H](C)c3ccccc3F)[nH]n2)o1 ZINC000919323839 1052863066 /nfs/dbraw/zinc/86/30/66/1052863066.db2.gz BRKJQFHQUKERCF-NSHDSACASA-N -1 1 314.316 4.035 20 0 DIADMM Cc1ccc(-c2cc(C(=O)O[C@@H](C)c3ccc(F)cc3)[nH]n2)o1 ZINC000919324400 1052863461 /nfs/dbraw/zinc/86/34/61/1052863461.db2.gz HQMLASJAIWEBKF-NSHDSACASA-N -1 1 314.316 4.035 20 0 DIADMM Cc1cc(=O)oc2cc([O-])cc(O[C@H](C)c3cccc(F)c3)c12 ZINC001226484883 1052900828 /nfs/dbraw/zinc/90/08/28/1052900828.db2.gz JGEIBYCZLFFBCL-LLVKDONJSA-N -1 1 314.312 4.086 20 0 DIADMM CC(C)=CCC[C@@H](C)Oc1cc([O-])cc2oc(=O)cc(C)c12 ZINC001226487624 1052901705 /nfs/dbraw/zinc/90/17/05/1052901705.db2.gz ZTFOZSVVAGPQPZ-CYBMUJFWSA-N -1 1 302.370 4.321 20 0 DIADMM Cc1cc(=O)oc2cc([O-])cc(O[C@H]3CCCc4ccccc43)c12 ZINC001226488621 1052901882 /nfs/dbraw/zinc/90/18/82/1052901882.db2.gz HLFZZAWADDUCSU-INIZCTEOSA-N -1 1 322.360 4.263 20 0 DIADMM Cc1ccc([C@H](C)Oc2cc([O-])cc3oc(=O)cc(C)c23)cc1 ZINC001226487053 1052902119 /nfs/dbraw/zinc/90/21/19/1052902119.db2.gz UJAZUEWMHICHEG-ZDUSSCGKSA-N -1 1 310.349 4.255 20 0 DIADMM CC(C)c1ccc(CNC(=O)c2c([O-])cccc2Cl)cc1 ZINC000920444860 1052939284 /nfs/dbraw/zinc/93/92/84/1052939284.db2.gz NOUZHTXCJCGUAX-UHFFFAOYSA-N -1 1 303.789 4.099 20 0 DIADMM O=C(NCc1csc2ccccc12)c1c([O-])cccc1Cl ZINC000920451561 1052940090 /nfs/dbraw/zinc/94/00/90/1052940090.db2.gz DVYGTPNENYBAKT-UHFFFAOYSA-N -1 1 317.797 4.190 20 0 DIADMM CC(C)[C@H](CNC(=O)c1c([O-])cccc1Cl)c1ccccc1 ZINC000920447457 1052940165 /nfs/dbraw/zinc/94/01/65/1052940165.db2.gz IRIHSPILVHLPKL-AWEZNQCLSA-N -1 1 317.816 4.215 20 0 DIADMM CC(C)c1ccc(CN(C)C(=O)c2c([O-])cccc2Cl)cc1 ZINC000920429967 1052940974 /nfs/dbraw/zinc/94/09/74/1052940974.db2.gz JGAHYFKVWDVSJV-UHFFFAOYSA-N -1 1 317.816 4.441 20 0 DIADMM C[C@@H](Oc1[n-]c(=S)ncc1F)c1ccc(Cl)c(Cl)c1 ZINC001227382324 1052987233 /nfs/dbraw/zinc/98/72/33/1052987233.db2.gz CSGVAAWLNJFYIW-ZCFIWIBFSA-N -1 1 319.188 4.351 20 0 DIADMM COc1ccc([C@@H](C)Oc2cc(Cl)c([O-])cc2Cl)cn1 ZINC001227642463 1053005911 /nfs/dbraw/zinc/00/59/11/1053005911.db2.gz ZLZDPOBHSFQJPI-MRVPVSSYSA-N -1 1 314.168 4.243 20 0 DIADMM C[C@@H](CC(=O)OC(C)(C)C)Oc1cc(Cl)c([O-])cc1Cl ZINC001227640615 1053005992 /nfs/dbraw/zinc/00/59/92/1053005992.db2.gz DYWKTLFKPOZMJZ-QMMMGPOBSA-N -1 1 321.200 4.198 20 0 DIADMM CCOC(=O)[C@H](CC(C)C)Oc1cc(Cl)c([O-])cc1Cl ZINC001227642307 1053006022 /nfs/dbraw/zinc/00/60/22/1053006022.db2.gz XLTRMICCLKCIQO-ZDUSSCGKSA-N -1 1 321.200 4.056 20 0 DIADMM CC1(C)CC(=O)CC[C@@H]1Oc1cc(Cl)c([O-])cc1Cl ZINC001227642230 1053006054 /nfs/dbraw/zinc/00/60/54/1053006054.db2.gz WRYQWPVJOGVNBU-ZDUSSCGKSA-N -1 1 303.185 4.226 20 0 DIADMM C[C@@H](Oc1[n-]c(=S)nc2cnccc21)c1ccc(F)c(F)c1 ZINC001227883588 1053025700 /nfs/dbraw/zinc/02/57/00/1053025700.db2.gz BFIXJOZUFKTJJT-MRVPVSSYSA-N -1 1 319.336 4.106 20 0 DIADMM S=c1nc2cnccc2c(O[C@@H]2CC[C@@H]3CCCC[C@H]3C2)[n-]1 ZINC001227885618 1053025718 /nfs/dbraw/zinc/02/57/18/1053025718.db2.gz NFBBCLSVXDWJDC-RWMBFGLXSA-N -1 1 315.442 4.425 20 0 DIADMM S=c1nc2cnccc2c(O[C@@H]2CC[C@H]3CCCC[C@@H]3C2)[n-]1 ZINC001227885616 1053025831 /nfs/dbraw/zinc/02/58/31/1053025831.db2.gz NFBBCLSVXDWJDC-JHJVBQTASA-N -1 1 315.442 4.425 20 0 DIADMM S=c1nc2cnccc2c(O[C@@H]2CC[C@@H]3CCCC[C@@H]3C2)[n-]1 ZINC001227885619 1053025969 /nfs/dbraw/zinc/02/59/69/1053025969.db2.gz NFBBCLSVXDWJDC-YNEHKIRRSA-N -1 1 315.442 4.425 20 0 DIADMM CC(C)[C@H](Oc1[n-]c(=S)nc2cnccc21)c1ccccc1 ZINC001227884965 1053025996 /nfs/dbraw/zinc/02/59/96/1053025996.db2.gz JSQNGGYODWRLAN-HNNXBMFYSA-N -1 1 311.410 4.463 20 0 DIADMM C[C@@H](Cc1ccco1)Oc1cc([O-])ccc1C(=O)c1ccccc1 ZINC001228184971 1053051250 /nfs/dbraw/zinc/05/12/50/1053051250.db2.gz ALVFWOUTSSVQEQ-AWEZNQCLSA-N -1 1 322.360 4.226 20 0 DIADMM O=C(c1ccccc1)c1ccc([O-])cc1O[C@H]1CCCC[C@H]1F ZINC001228185748 1053051396 /nfs/dbraw/zinc/05/13/96/1053051396.db2.gz LEZCSJRGNWBSAB-SJORKVTESA-N -1 1 314.356 4.283 20 0 DIADMM O=C(c1ccccc1)c1ccc([O-])cc1O[C@@H]1CCC(F)(F)C1 ZINC001228185151 1053051404 /nfs/dbraw/zinc/05/14/04/1053051404.db2.gz FFYVLXUMVVDBQD-CQSZACIVSA-N -1 1 318.319 4.190 20 0 DIADMM O=C(NCc1ccc([O-])c(Cl)c1)N(C1CC1)C1CCCCC1 ZINC001313236645 1053096905 /nfs/dbraw/zinc/09/69/05/1053096905.db2.gz MPVHCPYCDGKZSU-UHFFFAOYSA-N -1 1 322.836 4.052 20 0 DIADMM CCc1nc(SCc2ccc(OC(C)C)cc2)[n-]c(=O)c1C ZINC000849921208 1053117899 /nfs/dbraw/zinc/11/78/99/1053117899.db2.gz KUPFLZLYISIXJJ-UHFFFAOYSA-N -1 1 318.442 4.133 20 0 DIADMM CCC(=O)c1c(O)cc([O-])cc1O[C@H]1CCCc2ccccc21 ZINC001228560797 1053134475 /nfs/dbraw/zinc/13/44/75/1053134475.db2.gz SRVWHJSEKDGNNC-KRWDZBQOSA-N -1 1 312.365 4.147 20 0 DIADMM CCc1ccc2nc(-c3ccc(O[C@@H](C)CC)cc3)[n-]c(=O)c2c1 ZINC001318874051 1053200462 /nfs/dbraw/zinc/20/04/62/1053200462.db2.gz YKSKXEHMIMRFMM-ZDUSSCGKSA-N -1 1 322.408 4.330 20 0 DIADMM COc1cc2ccc(=O)oc2c(O[C@H](C)CCC=C(C)C)c1[O-] ZINC001229216853 1053275143 /nfs/dbraw/zinc/27/51/43/1053275143.db2.gz WAMLNSXUEKYERV-GFCCVEGCSA-N -1 1 318.369 4.021 20 0 DIADMM CCCCC[C@@H](CC)Oc1c([O-])c(OC)cc2ccc(=O)oc21 ZINC001229218582 1053275768 /nfs/dbraw/zinc/27/57/68/1053275768.db2.gz OMSMSCOGXHYUCA-CYBMUJFWSA-N -1 1 320.385 4.245 20 0 DIADMM CCCCCC[C@H](C)Oc1c([O-])c(OC)cc2ccc(=O)oc21 ZINC001229219003 1053278161 /nfs/dbraw/zinc/27/81/61/1053278161.db2.gz SGOCQYYLPKSHPL-LBPRGKRZSA-N -1 1 320.385 4.245 20 0 DIADMM C[C@H](Oc1cc([O-])cc2c1C(=O)C[C@@H](c1ccccc1)O2)C1CC1 ZINC001229229491 1053278806 /nfs/dbraw/zinc/27/88/06/1053278806.db2.gz LENKNAMZJHERDN-SJCJKPOMSA-N -1 1 324.376 4.276 20 0 DIADMM O=C1C[C@@H](c2ccccc2)Oc2cc([O-])cc(O[C@H]3C=CCC3)c21 ZINC001229231219 1053279157 /nfs/dbraw/zinc/27/91/57/1053279157.db2.gz UDUYTSUDBNWACR-RDJZCZTQSA-N -1 1 322.360 4.196 20 0 DIADMM CC[C@@H](C)Oc1cc([O-])cc2c1C(=O)C[C@@H](c1ccccc1)O2 ZINC001229230287 1053279928 /nfs/dbraw/zinc/27/99/28/1053279928.db2.gz OZTHWCJNSINMES-WBMJQRKESA-N -1 1 312.365 4.276 20 0 DIADMM Cc1cc(C(=O)Nc2ccc([O-])c(Cl)c2)c(C)n1CC1CC1 ZINC001320065443 1053300076 /nfs/dbraw/zinc/30/00/76/1053300076.db2.gz KZYZPSXKRNCIQE-UHFFFAOYSA-N -1 1 318.804 4.126 20 0 DIADMM C[C@@H](Oc1cc([O-])c(Cl)cc1Cl)c1ccncc1F ZINC001229405959 1053315157 /nfs/dbraw/zinc/31/51/57/1053315157.db2.gz GADOGGCQFUHYJB-SSDOTTSWSA-N -1 1 302.132 4.373 20 0 DIADMM CO[C@@H](COc1cc([O-])c(Cl)cc1Cl)c1ccccc1 ZINC001229411109 1053315262 /nfs/dbraw/zinc/31/52/62/1053315262.db2.gz OUBBTEJFDAKEIY-HNNXBMFYSA-N -1 1 313.180 4.466 20 0 DIADMM CCC(=O)c1ccc([O-])cc1O[C@H](C)c1cccc(OC)c1 ZINC001229475254 1053331360 /nfs/dbraw/zinc/33/13/60/1053331360.db2.gz RVQYBKQDJMYUEN-GFCCVEGCSA-N -1 1 300.354 4.134 20 0 DIADMM CCC(=O)c1ccc([O-])cc1O[C@@H]1CCc2c1cc(F)cc2F ZINC001229477907 1053334086 /nfs/dbraw/zinc/33/40/86/1053334086.db2.gz RDCFFASEZRUOTJ-QGZVFWFLSA-N -1 1 318.319 4.329 20 0 DIADMM CC(C)(CNC(=O)c1ccc2ccccc2c1[O-])C1CCCC1 ZINC001545840076 1053367515 /nfs/dbraw/zinc/36/75/15/1053367515.db2.gz TUZRHMUMPVNAOY-UHFFFAOYSA-N -1 1 311.425 4.492 20 0 DIADMM CSc1ccc(Cl)cc1[N-]C(=O)c1csc(Cl)n1 ZINC001434891158 1053381260 /nfs/dbraw/zinc/38/12/60/1053381260.db2.gz MBTJTQUTGCQTCS-UHFFFAOYSA-N -1 1 319.238 4.424 20 0 DIADMM Cc1cc(NC(=O)Cc2ccc([O-])c(Cl)c2)ccc1Cl ZINC001300095338 1053394336 /nfs/dbraw/zinc/39/43/36/1053394336.db2.gz LYFHTUATRITOSN-UHFFFAOYSA-N -1 1 310.180 4.189 20 0 DIADMM O=C([N-]c1cc(C(F)(F)F)ccc1F)c1ocnc1C(F)F ZINC001435011944 1053414950 /nfs/dbraw/zinc/41/49/50/1053414950.db2.gz DHZZMLIWCBISMJ-UHFFFAOYSA-N -1 1 324.180 4.022 20 0 DIADMM CCCC[C@@H](CC)C(=O)Nc1ccc(Br)c([O-])c1 ZINC001321816990 1053434841 /nfs/dbraw/zinc/43/48/41/1053434841.db2.gz HWXNXUNCLUFNCP-SNVBAGLBSA-N -1 1 314.223 4.310 20 0 DIADMM COC(=O)c1c[n-]c(O[C@@H](C)c2ccc(-c3ccccc3)cc2)n1 ZINC001230282612 1053511436 /nfs/dbraw/zinc/51/14/36/1053511436.db2.gz WWOWXVRTEOZXHH-ZDUSSCGKSA-N -1 1 322.364 4.003 20 0 DIADMM Cc1ccccc1[C@H](C)Oc1cccnc1-c1ncccc1[O-] ZINC001231200954 1053701065 /nfs/dbraw/zinc/70/10/65/1053701065.db2.gz VSIIXRYXCQRPQA-AWEZNQCLSA-N -1 1 306.365 4.298 20 0 DIADMM CCCN1C(=O)c2ccccc2N[C@@H]1c1ccc([O-])c(Cl)c1 ZINC000620753268 1053726603 /nfs/dbraw/zinc/72/66/03/1053726603.db2.gz NUDGYARFTMVVDE-INIZCTEOSA-N -1 1 316.788 4.022 20 0 DIADMM O=C([O-])c1ccc(F)c(CN2CCC[C@@H]2c2cccc(F)c2)c1 ZINC001231457152 1053755226 /nfs/dbraw/zinc/75/52/26/1053755226.db2.gz FBZLIVYNQSOLSG-QGZVFWFLSA-N -1 1 317.335 4.000 20 0 DIADMM O=C([O-])c1ccc(CN2CCC[C@H]2c2cccc(Cl)c2)s1 ZINC001231466532 1053759214 /nfs/dbraw/zinc/75/92/14/1053759214.db2.gz IIELEZNMKLKQNE-AWEZNQCLSA-N -1 1 321.829 4.437 20 0 DIADMM CC1CCC(=CC(=O)Nc2ccc(Br)c([O-])c2)CC1 ZINC001326234122 1053765806 /nfs/dbraw/zinc/76/58/06/1053765806.db2.gz HPPJKCPYHBTGOU-UHFFFAOYSA-N -1 1 324.218 4.230 20 0 DIADMM [O-]c1cc(CN2CCc3c4ccccc4oc3C2)ccc1Cl ZINC001231738069 1053846400 /nfs/dbraw/zinc/84/64/00/1053846400.db2.gz ZRKOVHQYWQFMIV-UHFFFAOYSA-N -1 1 313.784 4.350 20 0 DIADMM [O-]c1cc(Cl)c(Cl)cc1NC(=S)NC1CCCCC1 ZINC001200649395 1053851153 /nfs/dbraw/zinc/85/11/53/1053851153.db2.gz BPDUIGLDGSUGLV-UHFFFAOYSA-N -1 1 319.257 4.318 20 0 DIADMM [O-]c1ccc(NC(=S)Nc2ccccc2Cl)c(F)c1F ZINC001200857555 1054044650 /nfs/dbraw/zinc/04/46/50/1054044650.db2.gz XLHKYMMFZLAIQB-UHFFFAOYSA-N -1 1 314.744 4.133 20 0 DIADMM [O-]c1c(Cl)ccc(CN2CCC[C@@H]3CCC[C@H]32)c1Cl ZINC001232626752 1054088598 /nfs/dbraw/zinc/08/85/98/1054088598.db2.gz AFQHTEZCSBEARK-GXFFZTMASA-N -1 1 300.229 4.464 20 0 DIADMM [O-]c1c(Cl)ccc(CN2CCC3(CCCC3)C2)c1Cl ZINC001232632038 1054089732 /nfs/dbraw/zinc/08/97/32/1054089732.db2.gz USPUAEDMMSFNAX-UHFFFAOYSA-N -1 1 300.229 4.465 20 0 DIADMM [O-]c1c(F)ccc(CN2CCC[C@@H]2c2ccc(F)cc2)c1F ZINC001232931706 1054151144 /nfs/dbraw/zinc/15/11/44/1054151144.db2.gz RZUIIPRFGFMGME-OAHLLOKOSA-N -1 1 307.315 4.147 20 0 DIADMM CC(C)C[N@@H+](Cc1ccccc1)Cc1ccc(F)c(O)c1F ZINC001232932420 1054151174 /nfs/dbraw/zinc/15/11/74/1054151174.db2.gz YLFXSDNRTDWIGE-UHFFFAOYSA-N -1 1 305.368 4.329 20 0 DIADMM CN(Cc1ccc2ccccc2c1)Cc1ccc(F)c([O-])c1F ZINC001232939138 1054153545 /nfs/dbraw/zinc/15/35/45/1054153545.db2.gz GJBAPSIWPNLCGX-UHFFFAOYSA-N -1 1 313.347 4.456 20 0 DIADMM COc1ccccc1[C@@H]1CCCN1Cc1cc([O-])c(F)c(F)c1 ZINC001232972195 1054163402 /nfs/dbraw/zinc/16/34/02/1054163402.db2.gz VTPZBINJWSQPFO-HNNXBMFYSA-N -1 1 319.351 4.016 20 0 DIADMM CC[N@@H+](Cc1cccc(Cl)c1)Cc1cc(Cl)ncc1O ZINC001233037622 1054173633 /nfs/dbraw/zinc/17/36/33/1054173633.db2.gz FJZCLFNCKSWITG-UHFFFAOYSA-N -1 1 311.212 4.116 20 0 DIADMM Oc1cnc(Cl)cc1C[N@H+]1CCCC[C@H]1c1ccccc1 ZINC001233032777 1054174076 /nfs/dbraw/zinc/17/40/76/1054174076.db2.gz SRNFPONPPSMGQJ-HNNXBMFYSA-N -1 1 302.805 4.168 20 0 DIADMM CCc1ccc(C(=O)N(CC2CCC2)c2ccccc2)c([O-])c1 ZINC000622420796 1054211250 /nfs/dbraw/zinc/21/12/50/1054211250.db2.gz DEUALGHXWUNLAN-UHFFFAOYSA-N -1 1 309.409 4.402 20 0 DIADMM Oc1ccc(F)c(CN2CCC[C@@H]2Cc2ccc(F)cc2)c1F ZINC001233397237 1054261752 /nfs/dbraw/zinc/26/17/52/1054261752.db2.gz QMVSAVQKJGUQDS-CQSZACIVSA-N -1 1 321.342 4.017 20 0 DIADMM CCCC(=O)c1ccc([O-])cc1O[C@@H](C)COc1ccccc1 ZINC001233651047 1054321762 /nfs/dbraw/zinc/32/17/62/1054321762.db2.gz XGGJXLZJBDTVNV-AWEZNQCLSA-N -1 1 314.381 4.221 20 0 DIADMM O=C(Nc1cccc(OC2CCCC2)c1)c1ccc(F)c([O-])c1 ZINC001441072128 1054381469 /nfs/dbraw/zinc/38/14/69/1054381469.db2.gz HNDZHFWVMCGNEZ-UHFFFAOYSA-N -1 1 315.344 4.105 20 0 DIADMM CSc1ccc([O-])c(C(=O)Nc2ccc(Cl)c(F)c2)c1 ZINC001441564345 1054394714 /nfs/dbraw/zinc/39/47/14/1054394714.db2.gz SDSRCBABIQGBAZ-UHFFFAOYSA-N -1 1 311.765 4.159 20 0 DIADMM C[C@@H](CC(C)(C)c1ccccc1)NC(=O)c1ccc(F)c([O-])c1 ZINC001442600042 1054427941 /nfs/dbraw/zinc/42/79/41/1054427941.db2.gz RDAJIGMEUXCPRF-ZDUSSCGKSA-N -1 1 315.388 4.018 20 0 DIADMM O=C(NC1(c2cccc(Cl)c2)CC1)c1ccc(Cl)cc1[O-] ZINC001444332621 1054473298 /nfs/dbraw/zinc/47/32/98/1054473298.db2.gz UTOGUFMXDVNYBA-UHFFFAOYSA-N -1 1 322.191 4.118 20 0 DIADMM CC(C)(C)C(=O)Nc1ccc(-c2cc(Cl)c(F)cc2[O-])cn1 ZINC000623048569 1054520510 /nfs/dbraw/zinc/52/05/10/1054520510.db2.gz BDTKXPBVRHCSLX-UHFFFAOYSA-N -1 1 322.767 4.231 20 0 DIADMM CCC[C@H](NC(=O)c1cccc([O-])c1F)c1ccc(F)cc1F ZINC001446090705 1054526785 /nfs/dbraw/zinc/52/67/85/1054526785.db2.gz FRIMEPJENOUWLC-AWEZNQCLSA-N -1 1 323.314 4.081 20 0 DIADMM O=C(NC1CCC2(CCCCC2)CC1)c1cc(F)ccc1[O-] ZINC001447750913 1054572782 /nfs/dbraw/zinc/57/27/82/1054572782.db2.gz WHXTTXCVMZJTQU-UHFFFAOYSA-N -1 1 305.393 4.154 20 0 DIADMM CC[C@H](C)c1ncc(NC(=O)c2ccc3ccccc3c2[O-])cn1 ZINC001448362407 1054593747 /nfs/dbraw/zinc/59/37/47/1054593747.db2.gz DNTQUWODTAWHAZ-LBPRGKRZSA-N -1 1 321.380 4.101 20 0 DIADMM CC(C)N(CC1CCC1)C(=O)c1ccc(C(F)(F)F)c([O-])c1 ZINC001448625702 1054600368 /nfs/dbraw/zinc/60/03/68/1054600368.db2.gz BSLOTMAXFDUFQD-UHFFFAOYSA-N -1 1 315.335 4.062 20 0 DIADMM Clc1ccnc2c1CCC[C@H]2Oc1nc2sccc2[n-]1 ZINC001234856140 1054605428 /nfs/dbraw/zinc/60/54/28/1054605428.db2.gz WJKDSSDCWLVILD-LLVKDONJSA-N -1 1 305.790 4.129 20 0 DIADMM CCc1ccc(N(CC(C)C)C(=O)c2cc(F)ccc2[O-])cc1 ZINC001448974754 1054611205 /nfs/dbraw/zinc/61/12/05/1054611205.db2.gz XWIBIUXDHUZYOS-UHFFFAOYSA-N -1 1 315.388 4.397 20 0 DIADMM CSc1ccc([O-])c(C(=O)Nc2ccc(C3CCC3)cn2)c1 ZINC001450533116 1054651483 /nfs/dbraw/zinc/65/14/83/1054651483.db2.gz MOMLSLAQRXMCNE-UHFFFAOYSA-N -1 1 314.410 4.029 20 0 DIADMM CC(C)(C)[C@H]1CCC[C@@H]1NC(=O)c1cc2ccccc2cc1[O-] ZINC001451295401 1054673720 /nfs/dbraw/zinc/67/37/20/1054673720.db2.gz JQHNTZCHZYXZDS-IRXDYDNUSA-N -1 1 311.425 4.490 20 0 DIADMM CCC[C@H]1CCCC[C@H]1CNC(=O)c1ccc(Cl)cc1[O-] ZINC001451465577 1054679522 /nfs/dbraw/zinc/67/95/22/1054679522.db2.gz RUNFPKNGEQKGNQ-STQMWFEESA-N -1 1 309.837 4.382 20 0 DIADMM CCC(C)(C)c1ccc(CNC(=O)c2ccc([O-])c(F)c2)cc1 ZINC001546032582 1054683303 /nfs/dbraw/zinc/68/33/03/1054683303.db2.gz ZHZXYHIXUKOGQB-UHFFFAOYSA-N -1 1 315.388 4.149 20 0 DIADMM O=C(Nc1cc(F)cc(F)c1[O-])c1cc2c(cccc2F)s1 ZINC001451742368 1054686041 /nfs/dbraw/zinc/68/60/41/1054686041.db2.gz LOGKFQUUHINWJB-UHFFFAOYSA-N -1 1 323.295 4.277 20 0 DIADMM CC(C)[C@H](CC(=O)Nc1cc(F)cc(F)c1[O-])c1ccccc1 ZINC001451743775 1054687402 /nfs/dbraw/zinc/68/74/02/1054687402.db2.gz ORXFUZRUKFQNAN-AWEZNQCLSA-N -1 1 319.351 4.439 20 0 DIADMM CC(C)(C)Oc1cccc(C(=O)Nc2cc(F)cc(F)c2[O-])c1 ZINC001451747404 1054687876 /nfs/dbraw/zinc/68/78/76/1054687876.db2.gz AFPHFZMXVCMECI-UHFFFAOYSA-N -1 1 321.323 4.100 20 0 DIADMM C[C@@H](NC(=O)c1ccc(C(F)(F)F)c([O-])c1)C1CCCCC1 ZINC001451995020 1054691619 /nfs/dbraw/zinc/69/16/19/1054691619.db2.gz GSGUKFVFAHSUGT-SNVBAGLBSA-N -1 1 315.335 4.110 20 0 DIADMM O=C(c1c([O-])cccc1Cl)N1CCC[C@H]1CC1CCCC1 ZINC001452664596 1054711075 /nfs/dbraw/zinc/71/10/75/1054711075.db2.gz KQMDSGGXZJBRBN-ZDUSSCGKSA-N -1 1 307.821 4.231 20 0 DIADMM CC[C@H](C(=O)[N-]OCC1CCC1)c1cccc(C(F)(F)F)c1 ZINC001453744018 1054744987 /nfs/dbraw/zinc/74/49/87/1054744987.db2.gz VRWIUKPFNFINAL-AWEZNQCLSA-N -1 1 315.335 4.047 20 0 DIADMM CC(C)C[C@H](C(=O)[N-]OCC1CCC1)c1ccc(Cl)cc1 ZINC001453733440 1054745395 /nfs/dbraw/zinc/74/53/95/1054745395.db2.gz FDXQBNCWYNKXQO-INIZCTEOSA-N -1 1 309.837 4.318 20 0 DIADMM O=C(N[C@H]1CCc2ccc(Cl)cc21)c1c([O-])cccc1Cl ZINC001454347069 1054764775 /nfs/dbraw/zinc/76/47/75/1054764775.db2.gz NHAPPROBAJVUJN-ZDUSSCGKSA-N -1 1 322.191 4.116 20 0 DIADMM O=C(Nc1cccc(F)c1[O-])c1ccc(Cl)cc1Cl ZINC001454757974 1054782887 /nfs/dbraw/zinc/78/28/87/1054782887.db2.gz OAXKSFFSJVQJQP-UHFFFAOYSA-N -1 1 300.116 4.090 20 0 DIADMM O=C(Nc1cccc(F)c1[O-])c1ccccc1-c1ccccc1 ZINC001454758876 1054783061 /nfs/dbraw/zinc/78/30/61/1054783061.db2.gz SEIVWRKNNQJQGV-UHFFFAOYSA-N -1 1 307.324 4.451 20 0 DIADMM O=C(Nc1cccc(F)c1[O-])C1(Cc2ccc(Cl)cc2)CC1 ZINC001454754382 1054783417 /nfs/dbraw/zinc/78/34/17/1054783417.db2.gz IZTJNPXOXXCWMD-UHFFFAOYSA-N -1 1 319.763 4.146 20 0 DIADMM O=C(Nc1cccc(F)c1[O-])C1(Cc2ccccc2Cl)CC1 ZINC001454751838 1054783461 /nfs/dbraw/zinc/78/34/61/1054783461.db2.gz AVMBSABIIXFJEI-UHFFFAOYSA-N -1 1 319.763 4.146 20 0 DIADMM CC(C)[C@H]1N(C(=O)c2ccc([O-])c(F)c2)CC12CCCCCC2 ZINC001454819250 1054784690 /nfs/dbraw/zinc/78/46/90/1054784690.db2.gz DTACOCHSXBAVET-QGZVFWFLSA-N -1 1 319.420 4.352 20 0 DIADMM CN(C)c1ccc(NC(=O)c2ccc3ccccc3c2[O-])cc1F ZINC001455016156 1054791018 /nfs/dbraw/zinc/79/10/18/1054791018.db2.gz SFTFDFBTMAXUEH-UHFFFAOYSA-N -1 1 324.355 4.003 20 0 DIADMM Cc1ccc(F)c(-c2ccc(-c3c[nH]c4ccccc34)nn2)c1[O-] ZINC001236388995 1055087887 /nfs/dbraw/zinc/08/78/87/1055087887.db2.gz DHUKKGNRMHGJKM-UHFFFAOYSA-N -1 1 319.339 4.445 20 0 DIADMM Cc1ccc(F)c(-c2cncc(Oc3cccc(F)c3)n2)c1[O-] ZINC001236391626 1055089900 /nfs/dbraw/zinc/08/99/00/1055089900.db2.gz PRLDUDZRLFFGBX-UHFFFAOYSA-N -1 1 314.291 4.228 20 0 DIADMM Cc1ccc(F)c(-c2cc3c(nn2)CC[C@@H](C(C)(C)C)C3)c1[O-] ZINC001236392722 1055091117 /nfs/dbraw/zinc/09/11/17/1055091117.db2.gz RPPLEAYYKNBOJK-CYBMUJFWSA-N -1 1 314.404 4.448 20 0 DIADMM CSc1ccc2ncnc(-c3c(F)ccc(C)c3[O-])c2c1 ZINC001236394250 1055092542 /nfs/dbraw/zinc/09/25/42/1055092542.db2.gz YTWVDUJZCBBVSD-UHFFFAOYSA-N -1 1 300.358 4.172 20 0 DIADMM CC(=O)c1c(C)cc(OC(=O)c2cccc(Cl)c2[O-])cc1C ZINC001537187638 1055249922 /nfs/dbraw/zinc/24/99/22/1055249922.db2.gz GIYOQGOGANUMMN-UHFFFAOYSA-N -1 1 318.756 4.084 20 0 DIADMM C[C@@H](NC(=O)c1cc2ccccc2cc1[O-])[C@H](C)c1ccccc1 ZINC001587332440 1055269383 /nfs/dbraw/zinc/26/93/83/1055269383.db2.gz ORKVHLTUDXFINU-LSDHHAIUSA-N -1 1 319.404 4.467 20 0 DIADMM O=C(N[C@H](c1ccc(Cl)cc1)C1CC1)c1cccc([O-])c1F ZINC001587400414 1055288292 /nfs/dbraw/zinc/28/82/92/1055288292.db2.gz IKWGHVMNINMKKH-INIZCTEOSA-N -1 1 319.763 4.066 20 0 DIADMM O=C(N[C@@H](c1ccc(Cl)cc1)C1CC1)c1cccc([O-])c1F ZINC001587400416 1055288572 /nfs/dbraw/zinc/28/85/72/1055288572.db2.gz IKWGHVMNINMKKH-MRXNPFEDSA-N -1 1 319.763 4.066 20 0 DIADMM O=C(Nc1ccc([O-])c(Cl)c1)Nc1cncc(C(F)F)c1 ZINC001563197110 1055302810 /nfs/dbraw/zinc/30/28/10/1055302810.db2.gz YOGFFFXXJGNEPQ-UHFFFAOYSA-N -1 1 313.691 4.022 20 0 DIADMM CCc1ccc(C(C)(C)NC(=O)c2ccc(Cl)cc2[O-])cc1 ZINC001587527674 1055318408 /nfs/dbraw/zinc/31/84/08/1055318408.db2.gz JVYRANKYDDQXQS-UHFFFAOYSA-N -1 1 317.816 4.273 20 0 DIADMM O=C(N[C@@H]1CC[C@@H]2CCCC[C@H]2C1)c1ccc(Cl)cc1[O-] ZINC001587543204 1055323516 /nfs/dbraw/zinc/32/35/16/1055323516.db2.gz OLHKJZHYHXNTJM-SGMGOOAPSA-N -1 1 307.821 4.134 20 0 DIADMM CCC[C@@H](NC(=O)c1cc(Cl)ccc1[O-])c1ccccc1 ZINC001587935113 1055401885 /nfs/dbraw/zinc/40/18/85/1055401885.db2.gz TUQZGSSQGHUBAQ-OAHLLOKOSA-N -1 1 303.789 4.317 20 0 DIADMM O=C(c1ccc(Cl)cc1[O-])N1CCC[C@@H](C2CCC2)CC1 ZINC001588097396 1055428567 /nfs/dbraw/zinc/42/85/67/1055428567.db2.gz ZXCQKPIIODRXSW-CYBMUJFWSA-N -1 1 307.821 4.088 20 0 DIADMM O=C(NC(C1CCCCC1)C1CCCCC1)c1ccc([O-])cn1 ZINC001588723209 1055476249 /nfs/dbraw/zinc/47/62/49/1055476249.db2.gz UFNNDRNKEQEREC-UHFFFAOYSA-N -1 1 316.445 4.046 20 0 DIADMM CC1=C(C)C[C@@](C)(C(=O)NCc2ccc([O-])c(Cl)c2)CC1 ZINC001594565751 1055566578 /nfs/dbraw/zinc/56/65/78/1055566578.db2.gz OSOCKUNWTFEFHU-KRWDZBQOSA-N -1 1 307.821 4.188 20 0 DIADMM Cc1cccc2cc(C(=O)NCc3ccc([O-])c(Cl)c3)oc21 ZINC001594558197 1055566746 /nfs/dbraw/zinc/56/67/46/1055566746.db2.gz GFOIFPLHCHBHLV-UHFFFAOYSA-N -1 1 315.756 4.030 20 0 DIADMM C[C@@H]1CC(C)(C)C[C@](C)(NC(=O)Cc2ccc([O-])c(Cl)c2)C1 ZINC001594718330 1055570872 /nfs/dbraw/zinc/57/08/72/1055570872.db2.gz WCTJLGXFKLLVFA-KZULUSFZSA-N -1 1 323.864 4.309 20 0 DIADMM CCc1ccccc1[N-]S(=O)(=O)c1cc(Cl)ccc1C ZINC000031666468 1055642239 /nfs/dbraw/zinc/64/22/39/1055642239.db2.gz UFDHGOGMUMZGRU-UHFFFAOYSA-N -1 1 309.818 4.012 20 0 DIADMM CC(C)(C)Oc1cc(F)ccc1NC(=O)c1cc(F)ccc1[O-] ZINC001596247973 1055686929 /nfs/dbraw/zinc/68/69/29/1055686929.db2.gz BGXITVKURKEXIY-UHFFFAOYSA-N -1 1 321.323 4.100 20 0 DIADMM CCCCC[C@H]1CCCN1C(=O)NCc1ccc([O-])c(Cl)c1 ZINC001565296860 1055688427 /nfs/dbraw/zinc/68/84/27/1055688427.db2.gz NGFDOYNWZZZDPX-AWEZNQCLSA-N -1 1 324.852 4.300 20 0 DIADMM CCCCC[C@@H](NC(=O)c1cc(C)cc(C=O)c1[O-])C(C)(C)C ZINC001565734074 1055724696 /nfs/dbraw/zinc/72/46/96/1055724696.db2.gz UUXKNIHFNKGWHQ-MRXNPFEDSA-N -1 1 319.445 4.238 20 0 DIADMM CC(C)c1ccc(C(=O)Nc2cc(F)c(F)c(F)c2)c([O-])c1 ZINC001565943623 1055736223 /nfs/dbraw/zinc/73/62/23/1055736223.db2.gz IEMGTAYCUMWKNL-UHFFFAOYSA-N -1 1 309.287 4.185 20 0 DIADMM Cc1ccc([C@H]2[C@H](C)CCCN2C(=O)c2ncc(C)cc2[O-])cc1 ZINC001565973442 1055738451 /nfs/dbraw/zinc/73/84/51/1055738451.db2.gz USQYFJLPRNPTBV-DNVCBOLYSA-N -1 1 324.424 4.017 20 0 DIADMM O=C(Nc1ccc([O-])c(Cl)c1)c1ccc(C(F)F)cc1F ZINC001596819202 1055749501 /nfs/dbraw/zinc/74/95/01/1055749501.db2.gz BUCGRLJBTIBJEB-UHFFFAOYSA-N -1 1 315.678 4.375 20 0 DIADMM Cc1ccc(C(=O)Nc2ccc([O-])c(Cl)c2)c2c1CCC2 ZINC001596819337 1055750675 /nfs/dbraw/zinc/75/06/75/1055750675.db2.gz DSWPLYGQRHKYCM-UHFFFAOYSA-N -1 1 301.773 4.095 20 0 DIADMM CCCNc1ccc(Cl)cc1NC(=O)c1ccc(F)c([O-])c1 ZINC001566407091 1055770719 /nfs/dbraw/zinc/77/07/19/1055770719.db2.gz YVCPYYYKIYKAHT-UHFFFAOYSA-N -1 1 322.767 4.259 20 0 DIADMM O=C(CCCc1ccc(F)cc1)Nc1ccc([O-])c(Cl)c1 ZINC001566588992 1055776366 /nfs/dbraw/zinc/77/63/66/1055776366.db2.gz LHGKUKAHUDREEH-UHFFFAOYSA-N -1 1 307.752 4.146 20 0 DIADMM CC(C)Cc1cccc([C@@H](C)C(=O)[N-]OC2CCCCC2)c1 ZINC001567889853 1055825196 /nfs/dbraw/zinc/82/51/96/1055825196.db2.gz PTWDEEGVAOIJLE-OAHLLOKOSA-N -1 1 303.446 4.369 20 0 DIADMM O=C(N[C@@H]1CC[C@H]2CCCC[C@@H]2C1)c1ncc2ccccc2c1[O-] ZINC001539461142 1055848639 /nfs/dbraw/zinc/84/86/39/1055848639.db2.gz XODDSZYEBCDZJI-IIAWOOMASA-N -1 1 324.424 4.029 20 0 DIADMM CC(C)C[C@]1(C)CCCN1C(=O)Cc1ccc([O-])c(Cl)c1 ZINC001569418008 1055860891 /nfs/dbraw/zinc/86/08/91/1055860891.db2.gz MRJSSXIQSZHQKZ-KRWDZBQOSA-N -1 1 309.837 4.015 20 0 DIADMM O=C(NCc1cc2ccccc2s1)c1cc(Cl)ccc1[O-] ZINC001569592217 1055867052 /nfs/dbraw/zinc/86/70/52/1055867052.db2.gz KLJFTXSKONMLOL-UHFFFAOYSA-N -1 1 317.797 4.190 20 0 DIADMM CCCCOc1ccc(C(=O)Nc2cc([O-])c(F)cc2F)cc1 ZINC001570099799 1055887503 /nfs/dbraw/zinc/88/75/03/1055887503.db2.gz CLNZZRGQPSWPAC-UHFFFAOYSA-N -1 1 321.323 4.102 20 0 DIADMM CCc1oc2ccccc2c1C(=O)Nc1cc([O-])c(F)cc1F ZINC001570101767 1055887780 /nfs/dbraw/zinc/88/77/80/1055887780.db2.gz JUHNOCKSXVQOGG-UHFFFAOYSA-N -1 1 317.291 4.231 20 0 DIADMM CC(C)[C@@H]1N(C(=O)c2cc(Cl)ccc2[O-])CC12CCCCC2 ZINC001570191336 1055890427 /nfs/dbraw/zinc/89/04/27/1055890427.db2.gz JWMOJFVAVIXQBT-INIZCTEOSA-N -1 1 321.848 4.477 20 0 DIADMM COc1ccc(-c2ccc([C@H](C)[N-]C(=O)C(F)(F)F)cc2)cc1 ZINC001239485765 1055903939 /nfs/dbraw/zinc/90/39/39/1055903939.db2.gz KGHRTTZUAOOWBH-NSHDSACASA-N -1 1 323.314 4.102 20 0 DIADMM CN(C(=O)c1c([O-])cccc1Cl)[C@@H]1CCC[C@@H]1C(C)(C)C ZINC001570457568 1055904291 /nfs/dbraw/zinc/90/42/91/1055904291.db2.gz YEIZREMXECBDIY-WCQYABFASA-N -1 1 309.837 4.332 20 0 DIADMM O=C(Nc1cc(F)cc(F)c1[O-])[C@@H]1CCC[C@@H]2CCCC[C@H]12 ZINC001570465949 1055904746 /nfs/dbraw/zinc/90/47/46/1055904746.db2.gz WLNWBIYFLUNCJM-WCFLWFBJSA-N -1 1 309.356 4.215 20 0 DIADMM O=C(N[C@@H]1CCC[C@H](C2CC2)C1)c1ccc2ccccc2c1[O-] ZINC001570480549 1055906074 /nfs/dbraw/zinc/90/60/74/1055906074.db2.gz QYJGCMWKBISBKG-JKSUJKDBSA-N -1 1 309.409 4.244 20 0 DIADMM O=C(Cc1ccc2c(c1)CCCC2)Nc1ccc([O-])c(Cl)c1 ZINC000109013876 1055922714 /nfs/dbraw/zinc/92/27/14/1055922714.db2.gz XBDLEESVCWNFCC-UHFFFAOYSA-N -1 1 315.800 4.106 20 0 DIADMM COC(=O)c1nc2cc(-c3ccccc3C(F)(F)F)ccc2[n-]1 ZINC001239547902 1055947081 /nfs/dbraw/zinc/94/70/81/1055947081.db2.gz PMPSYQHSNRXJNB-UHFFFAOYSA-N -1 1 320.270 4.035 20 0 DIADMM COC(=O)c1nc2ccc(-c3ccccc3C(F)(F)F)cc2[n-]1 ZINC001239547902 1055947095 /nfs/dbraw/zinc/94/70/95/1055947095.db2.gz PMPSYQHSNRXJNB-UHFFFAOYSA-N -1 1 320.270 4.035 20 0 DIADMM O=C(Nc1cc(F)c([O-])cc1Cl)[C@@H]1CSc2ccccc21 ZINC001598582669 1055958126 /nfs/dbraw/zinc/95/81/26/1055958126.db2.gz JDIYOGVBELBZGN-SECBINFHSA-N -1 1 323.776 4.013 20 0 DIADMM CC(C)Oc1ccccc1C(=O)Nc1cc(F)c([O-])cc1Cl ZINC001598582703 1055959123 /nfs/dbraw/zinc/95/91/23/1055959123.db2.gz KNOQBYQHDKZASL-UHFFFAOYSA-N -1 1 323.751 4.224 20 0 DIADMM CC[C@@H]1CCCc2sc(NC(=O)c3cc(F)ccc3[O-])nc21 ZINC001602989659 1056019710 /nfs/dbraw/zinc/01/97/10/1056019710.db2.gz KWGQNXXNQNHOTH-SECBINFHSA-N -1 1 320.389 4.070 20 0 DIADMM Cc1ccc([C@@H](NC(=O)c2cc(Cl)ccc2[O-])C2CC2)cc1 ZINC001540555191 1056043343 /nfs/dbraw/zinc/04/33/43/1056043343.db2.gz AGVYDHXTPWMWOB-QGZVFWFLSA-N -1 1 315.800 4.235 20 0 DIADMM CN(C(=O)c1c(F)ccc([O-])c1F)c1ccc2ccccc2c1 ZINC001540590492 1056048618 /nfs/dbraw/zinc/04/86/18/1056048618.db2.gz OSIZZTJBBNPBSY-UHFFFAOYSA-N -1 1 313.303 4.100 20 0 DIADMM C[C@@H]1CCC[C@@H](N(C)C(=O)c2ccc(C(F)(F)F)c([O-])c2)C1 ZINC001540605312 1056049210 /nfs/dbraw/zinc/04/92/10/1056049210.db2.gz YGAORONYYVIUGL-ZYHUDNBSSA-N -1 1 315.335 4.062 20 0 DIADMM Cc1cccc(NC(=O)c2ccc(C(F)(F)F)cc2[O-])c1C ZINC001540600295 1056049272 /nfs/dbraw/zinc/04/92/72/1056049272.db2.gz HFECEDUDDLDOFX-UHFFFAOYSA-N -1 1 309.287 4.280 20 0 DIADMM CC(C)c1ccc(C(=O)Nc2cnc3ccccc3c2)c([O-])c1 ZINC001540624276 1056051898 /nfs/dbraw/zinc/05/18/98/1056051898.db2.gz UJGVENJSRQZZQB-UHFFFAOYSA-N -1 1 306.365 4.316 20 0 DIADMM Cc1[nH]c2ccccc2c1CC(=O)Nc1ccc([O-])c(Cl)c1 ZINC000111666397 1056057471 /nfs/dbraw/zinc/05/74/71/1056057471.db2.gz DXKIKXCHGFMWPX-UHFFFAOYSA-N -1 1 314.772 4.017 20 0 DIADMM CSc1ccc([O-])c(C(=O)N2CCCc3cc(C)ccc32)c1 ZINC001540665462 1056058017 /nfs/dbraw/zinc/05/80/17/1056058017.db2.gz WAQWPQJPGGDHRM-UHFFFAOYSA-N -1 1 313.422 4.016 20 0 DIADMM O=C(Nc1ccc([O-])c(Cl)c1)c1ccc(C(F)(F)F)s1 ZINC000671780629 1056063368 /nfs/dbraw/zinc/06/33/68/1056063368.db2.gz IILWNJKLCHLJAW-UHFFFAOYSA-N -1 1 321.707 4.378 20 0 DIADMM CCCN(Cc1ccc(F)cc1)C(=O)c1ccc(Cl)cc1[O-] ZINC001540719704 1056067313 /nfs/dbraw/zinc/06/73/13/1056067313.db2.gz SKNRZPRIQNSMRR-UHFFFAOYSA-N -1 1 321.779 4.237 20 0 DIADMM O=S(=O)([N-]c1cc(F)ccc1C1=CCCC1)c1ccccc1 ZINC001239787466 1056073228 /nfs/dbraw/zinc/07/32/28/1056073228.db2.gz AMRAXPJVEOJLGX-UHFFFAOYSA-N -1 1 317.385 4.194 20 0 DIADMM CC(C)(C)[C@H](NC(=O)c1ccc([O-])cc1F)c1ccc(F)cc1 ZINC001540924525 1056084929 /nfs/dbraw/zinc/08/49/29/1056084929.db2.gz DLSJENMDXHGHBJ-MRXNPFEDSA-N -1 1 319.351 4.188 20 0 DIADMM CC(C)(C)[C@H](NC(=O)c1cccc([O-])c1F)c1ccc(F)cc1 ZINC001540925392 1056085514 /nfs/dbraw/zinc/08/55/14/1056085514.db2.gz LVBLMNATMNODSE-MRXNPFEDSA-N -1 1 319.351 4.188 20 0 DIADMM CC(C)c1ccc2c(c1)CCCN2C(=O)c1ccc([O-])cc1F ZINC001542080707 1056102824 /nfs/dbraw/zinc/10/28/24/1056102824.db2.gz OIVDHMJQDGBKII-UHFFFAOYSA-N -1 1 313.372 4.248 20 0 DIADMM CC(C)c1ccc(C(=O)Nc2ccc(F)c(F)c2F)c([O-])c1 ZINC001542190793 1056108812 /nfs/dbraw/zinc/10/88/12/1056108812.db2.gz YNLZWYKBPDQYND-UHFFFAOYSA-N -1 1 309.287 4.185 20 0 DIADMM O=C(c1ccc(F)c([O-])c1)N1CC2(CC=CC2)[C@@H]1c1ccccc1 ZINC001583591452 1056112574 /nfs/dbraw/zinc/11/25/74/1056112574.db2.gz RXWPYFQOLVFBST-SFHVURJKSA-N -1 1 323.367 4.065 20 0 DIADMM Cc1ccc2sc(C(=O)Nc3nc(Cl)ccc3[O-])cc2c1 ZINC001611167241 1056120387 /nfs/dbraw/zinc/12/03/87/1056120387.db2.gz YNPNLTVSVDZZNH-UHFFFAOYSA-N -1 1 318.785 4.216 20 0 DIADMM Cc1ccc(-c2ccncc2)cc1NC(=O)c1ccc(F)c([O-])c1 ZINC001542639658 1056147630 /nfs/dbraw/zinc/14/76/30/1056147630.db2.gz JZPPOZBYLRKHFN-UHFFFAOYSA-N -1 1 322.339 4.154 20 0 DIADMM CC(C)Oc1ccc(NC(=O)Cc2ccc([O-])c(Cl)c2)cc1 ZINC001543068427 1056173722 /nfs/dbraw/zinc/17/37/22/1056173722.db2.gz RDEQSHIOFZDJAO-UHFFFAOYSA-N -1 1 319.788 4.014 20 0 DIADMM C[C@H]1C[C@@H]1c1ccc(CNC(=O)c2ccc3ccccc3c2[O-])o1 ZINC001543208712 1056188866 /nfs/dbraw/zinc/18/88/66/1056188866.db2.gz UIBNBNXFUFKJRQ-SJCJKPOMSA-N -1 1 321.376 4.192 20 0 DIADMM CC(C)[C@H](c1ccccc1)N(C)C(=O)c1cccc([O-])c1F ZINC001543317515 1056201973 /nfs/dbraw/zinc/20/19/73/1056201973.db2.gz WKWOPNDQKNXQKQ-QGZVFWFLSA-N -1 1 301.361 4.001 20 0 DIADMM Cc1ccc([C@H](C)NC(=O)c2ccc(C(F)(F)F)c([O-])c2)cc1 ZINC001543479626 1056232270 /nfs/dbraw/zinc/23/22/70/1056232270.db2.gz GECVJXPVFAZCHO-NSHDSACASA-N -1 1 323.314 4.210 20 0 DIADMM Cc1nn(-c2ccccc2)cc1[N-]c1nc2ccc(F)cc2o1 ZINC001612237225 1056258431 /nfs/dbraw/zinc/25/84/31/1056258431.db2.gz BMFYAWWNDFRKAI-UHFFFAOYSA-N -1 1 308.316 4.205 20 0 DIADMM Cc1nn(-c2ccccc2)cc1[N-]c1nc2cc(C)ccc2o1 ZINC001612237803 1056260017 /nfs/dbraw/zinc/26/00/17/1056260017.db2.gz ZJRLYGFQDOWPEZ-UHFFFAOYSA-N -1 1 304.353 4.374 20 0 DIADMM CCC(CC)N(C(=O)c1ccc(C(F)(F)F)c([O-])c1)C1CC1 ZINC001584437767 1056343040 /nfs/dbraw/zinc/34/30/40/1056343040.db2.gz SUTVXXFWUDUDST-UHFFFAOYSA-N -1 1 315.335 4.204 20 0 DIADMM CC(C)(C)C[C@H](NC(=O)c1cccc([O-])c1F)c1ccccc1 ZINC001544013714 1056343177 /nfs/dbraw/zinc/34/31/77/1056343177.db2.gz PFFUHZBUOOLALQ-HNNXBMFYSA-N -1 1 315.388 4.439 20 0 DIADMM Cc1nc(SCc2cccc(OCC(C)C)c2)[n-]c(=O)c1C ZINC001613671397 1056396731 /nfs/dbraw/zinc/39/67/31/1056396731.db2.gz BXTNHWKCNTVIQM-UHFFFAOYSA-N -1 1 318.442 4.126 20 0 DIADMM O=C(c1cc(Cl)ccc1[O-])N(CC1CC1)C1CCCCC1 ZINC001584769397 1056415068 /nfs/dbraw/zinc/41/50/68/1056415068.db2.gz QAACFQBMUYVHOL-UHFFFAOYSA-N -1 1 307.821 4.231 20 0 DIADMM CCCCS(=O)(=O)[N-]c1ccccc1Oc1ccccc1 ZINC000014257157 1056437536 /nfs/dbraw/zinc/43/75/36/1056437536.db2.gz BRSMEUUTSMWAKT-UHFFFAOYSA-N -1 1 305.399 4.021 20 0 DIADMM Cc1nc(SCCSc2ccccc2)[n-]c(=O)c1C1CC1 ZINC001614793157 1056452637 /nfs/dbraw/zinc/45/26/37/1056452637.db2.gz CIEZCDXEPGHXRV-UHFFFAOYSA-N -1 1 318.467 4.252 20 0 DIADMM O=C([O-])CN(Cc1ccc(-c2ccccc2Cl)o1)C1CCC1 ZINC000656100186 1056474315 /nfs/dbraw/zinc/47/43/15/1056474315.db2.gz GKFDDCADLRAQRF-UHFFFAOYSA-N -1 1 319.788 4.039 20 0 DIADMM O=C(Cc1ccc([O-])c(Cl)c1)N1CCC[C@H]1C1CCCCC1 ZINC001544676819 1056477019 /nfs/dbraw/zinc/47/70/19/1056477019.db2.gz NLZTVBNXWNZERC-INIZCTEOSA-N -1 1 321.848 4.159 20 0 DIADMM O=C(Cc1ccc([O-])c(Cl)c1)N1CCC[C@@H]1C1CCCCC1 ZINC001544676820 1056478021 /nfs/dbraw/zinc/47/80/21/1056478021.db2.gz NLZTVBNXWNZERC-MRXNPFEDSA-N -1 1 321.848 4.159 20 0 DIADMM [O-]c1c(F)cc(Nc2ccnn2-c2ccc(F)cc2)cc1Cl ZINC001214482725 1056562658 /nfs/dbraw/zinc/56/26/58/1056562658.db2.gz KRNCUJTWIVTGAC-UHFFFAOYSA-N -1 1 321.714 4.253 20 0 DIADMM O=S(=O)([N-]c1ccc2oc3ccccc3c2c1)c1ccccc1 ZINC000007055996 1056566668 /nfs/dbraw/zinc/56/66/68/1056566668.db2.gz BPQGDBYESDCGHP-UHFFFAOYSA-N -1 1 323.373 4.387 20 0 DIADMM C[C@H]1CC[C@@H](c2ccccc2)N(C(=O)c2ccc([O-])c(F)c2)C1 ZINC000672228014 1056572977 /nfs/dbraw/zinc/57/29/77/1056572977.db2.gz OSQPHPOKHOTOGR-GUYCJALGSA-N -1 1 313.372 4.145 20 0 DIADMM CC[C@H](C)c1ccc(S(=O)(=O)[N-]c2cc(F)ccc2C)cc1 ZINC000007405630 1056580079 /nfs/dbraw/zinc/58/00/79/1056580079.db2.gz XSAPSEXBSUJUKD-LBPRGKRZSA-N -1 1 321.417 4.448 20 0 DIADMM CSc1ccc([O-])c(C(=O)N2CCCc3c(C)cccc32)c1 ZINC001585916780 1056640365 /nfs/dbraw/zinc/64/03/65/1056640365.db2.gz MQCXHHCUAWTLEU-UHFFFAOYSA-N -1 1 313.422 4.016 20 0 DIADMM [O-]c1ccc(F)cc1-c1nc(C(F)(F)F)nc2ccsc21 ZINC001240693152 1056645297 /nfs/dbraw/zinc/64/52/97/1056645297.db2.gz DBVNFDZFPLBERM-UHFFFAOYSA-N -1 1 314.263 4.222 20 0 DIADMM [O-]c1ccc(F)cc1-c1cnc2ccc(C(F)(F)F)cc2n1 ZINC001240693267 1056645458 /nfs/dbraw/zinc/64/54/58/1056645458.db2.gz KDTMFVZWQNAOOG-UHFFFAOYSA-N -1 1 308.234 4.160 20 0 DIADMM [O-]c1ccc(F)cc1-c1ncnc2cc(C(F)(F)F)ccc21 ZINC001240693377 1056645649 /nfs/dbraw/zinc/64/56/49/1056645649.db2.gz PSRIBQJJXJYIGT-UHFFFAOYSA-N -1 1 308.234 4.160 20 0 DIADMM CCOc1cc(C(=O)Nc2ccc(C)c(F)c2)cc(Cl)c1[O-] ZINC000215959320 1056677164 /nfs/dbraw/zinc/67/71/64/1056677164.db2.gz QPQFBVHDOHFYMI-UHFFFAOYSA-N -1 1 323.751 4.144 20 0 DIADMM [O-]c1ccc(-c2nc(-c3ccccc3)nc3[nH]ccc32)cc1F ZINC001240781933 1056695122 /nfs/dbraw/zinc/69/51/22/1056695122.db2.gz LJGZURDOUSDESJ-UHFFFAOYSA-N -1 1 305.312 4.088 20 0 DIADMM Cn1cc(-c2ccnc(-c3ccc([O-])c(F)c3)n2)c2ccccc21 ZINC001240782322 1056695935 /nfs/dbraw/zinc/69/59/35/1056695935.db2.gz VRCPWCWSPARZEE-UHFFFAOYSA-N -1 1 319.339 4.147 20 0 DIADMM [O-]c1ccc(-c2nnc(-c3ccco3)cc2C(F)(F)F)cc1F ZINC001240783898 1056698609 /nfs/dbraw/zinc/69/86/09/1056698609.db2.gz ZCNKASJEKMTYCS-UHFFFAOYSA-N -1 1 324.233 4.267 20 0 DIADMM CSc1ccc([O-])c(C(=O)Nc2ccc3occ(C)c3c2)c1 ZINC001616954502 1056745044 /nfs/dbraw/zinc/74/50/44/1056745044.db2.gz IKZNWZMEWMOGEV-UHFFFAOYSA-N -1 1 313.378 4.421 20 0 DIADMM Cc1ccc(-c2ncc3ccc(C(F)(F)F)cc3n2)c([O-])c1 ZINC001241030138 1056830999 /nfs/dbraw/zinc/83/09/99/1056830999.db2.gz FUKOUDDMTOBICB-UHFFFAOYSA-N -1 1 304.271 4.330 20 0 DIADMM Cc1ccc(-c2ncc(C)c(-c3c(F)cccc3F)n2)c([O-])c1 ZINC001241035948 1056834197 /nfs/dbraw/zinc/83/41/97/1056834197.db2.gz KYOHEAFHMQFYFO-UHFFFAOYSA-N -1 1 312.319 4.411 20 0 DIADMM C[C@@H]1CCC[C@H](C)N(C(=O)c2ccc(C(F)(F)F)c([O-])c2)C1 ZINC001617797402 1056885293 /nfs/dbraw/zinc/88/52/93/1056885293.db2.gz NEOCZJLKBLUUMY-MNOVXSKESA-N -1 1 315.335 4.062 20 0 DIADMM [O-]c1cc(F)c(-c2cncc(Oc3cccc(F)c3)n2)c(F)c1 ZINC001241119218 1056904194 /nfs/dbraw/zinc/90/41/94/1056904194.db2.gz ZNLYMCRINJLHCO-UHFFFAOYSA-N -1 1 318.254 4.059 20 0 DIADMM [O-]c1cc(F)c(-c2ccc(-c3c[nH]c4ccccc43)nn2)c(F)c1 ZINC001241117453 1056905331 /nfs/dbraw/zinc/90/53/31/1056905331.db2.gz PAXGMZHEYJBQDK-UHFFFAOYSA-N -1 1 323.302 4.276 20 0 DIADMM Cc1ccc(-c2ccc(-c3c(F)cc([O-])cc3F)nn2)s1 ZINC001241119433 1056905554 /nfs/dbraw/zinc/90/55/54/1056905554.db2.gz NPBLULBYKCRFHN-UHFFFAOYSA-N -1 1 304.321 4.164 20 0 DIADMM [O-]c1cc(F)c(-c2cncc(-c3nc4ccccc4[nH]3)c2)c(F)c1 ZINC001241120796 1056906032 /nfs/dbraw/zinc/90/60/32/1056906032.db2.gz LRYYNJRUVJIIJF-UHFFFAOYSA-N -1 1 323.302 4.276 20 0 DIADMM [O-]c1cc(F)c(-c2ccc(-c3c[nH]c(=S)[nH]3)cc2)c(F)c1 ZINC001241122770 1056906144 /nfs/dbraw/zinc/90/61/44/1056906144.db2.gz YHXCQSPBIYCIST-UHFFFAOYSA-N -1 1 304.321 4.016 20 0 DIADMM [O-]c1cc(F)c(-c2nc(C(F)(F)F)cc3cc[nH]c32)c(F)c1 ZINC001241120207 1056906741 /nfs/dbraw/zinc/90/67/41/1056906741.db2.gz NFHJYZCQKGQXPP-UHFFFAOYSA-N -1 1 314.213 4.233 20 0 DIADMM CC(C)Oc1c(F)cc(-c2c(F)cc([O-])cc2F)cc1F ZINC001241121686 1056907544 /nfs/dbraw/zinc/90/75/44/1056907544.db2.gz BLJVKPDYFPCXJC-UHFFFAOYSA-N -1 1 300.251 4.403 20 0 DIADMM Cc1cccc(Oc2nc(-c3cc([O-])cc(F)c3)ncc2F)c1 ZINC001241261297 1056985548 /nfs/dbraw/zinc/98/55/48/1056985548.db2.gz JEXDKBSKWXVSMI-UHFFFAOYSA-N -1 1 314.291 4.228 20 0 DIADMM [O-]c1ccc(F)c(-c2nc(C(F)(F)F)cc3cc[nH]c32)c1F ZINC001241289758 1056998745 /nfs/dbraw/zinc/99/87/45/1056998745.db2.gz ZGZAYWNILRNZRJ-UHFFFAOYSA-N -1 1 314.213 4.233 20 0 DIADMM [O-]c1ccc(F)c(-c2ccc(-c3c[nH]c4ccccc43)nn2)c1F ZINC001241290425 1056999026 /nfs/dbraw/zinc/99/90/26/1056999026.db2.gz MPSVTLCJTJLVHA-UHFFFAOYSA-N -1 1 323.302 4.276 20 0 DIADMM Cc1cc(-c2c(F)ccc([O-])c2F)nc(-c2ccsc2)n1 ZINC001241290114 1056999065 /nfs/dbraw/zinc/99/90/65/1056999065.db2.gz KZIJNFQNDQHXIP-UHFFFAOYSA-N -1 1 304.321 4.164 20 0 DIADMM Cc1sc2nc(C)nc(-c3c(F)ccc([O-])c3F)c2c1C ZINC001241291186 1056999963 /nfs/dbraw/zinc/99/99/63/1056999963.db2.gz ICLCWEVOVFXKKM-UHFFFAOYSA-N -1 1 306.337 4.267 20 0 DIADMM COc1ccc2nc(-c3c(F)ccc([O-])c3F)cc(C)c2c1 ZINC001241291473 1057000208 /nfs/dbraw/zinc/00/02/08/1057000208.db2.gz MFHDQYBREKJBSD-UHFFFAOYSA-N -1 1 301.292 4.203 20 0 DIADMM Cc1cscc1-c1ccc([C@H](C)[N-]C(=O)C(F)(F)F)cc1 ZINC001241731127 1057149603 /nfs/dbraw/zinc/14/96/03/1057149603.db2.gz NAXZCWODWOGEIE-JTQLQIEISA-N -1 1 313.344 4.463 20 0 DIADMM CCCOc1ccc(-c2ccc3nc(C(=O)OCC)[nH]c3c2)cc1 ZINC001241747967 1057155008 /nfs/dbraw/zinc/15/50/08/1057155008.db2.gz NTGPSFSDPFPRHW-UHFFFAOYSA-N -1 1 324.380 4.195 20 0 DIADMM CCCOc1ccc(-c2ccc3[n-]c(C(=O)OCC)nc3c2)cc1 ZINC001241747967 1057155010 /nfs/dbraw/zinc/15/50/10/1057155010.db2.gz NTGPSFSDPFPRHW-UHFFFAOYSA-N -1 1 324.380 4.195 20 0 DIADMM CCCOc1ccc(-c2ccc3nc(C(=O)OCC)[n-]c3c2)cc1 ZINC001241747967 1057155013 /nfs/dbraw/zinc/15/50/13/1057155013.db2.gz NTGPSFSDPFPRHW-UHFFFAOYSA-N -1 1 324.380 4.195 20 0 DIADMM Cc1csc2c1ncnc2-c1cc(C(F)(F)F)ccc1[O-] ZINC001242131773 1057274431 /nfs/dbraw/zinc/27/44/31/1057274431.db2.gz OZJIQQIHAOTZCH-UHFFFAOYSA-N -1 1 310.300 4.391 20 0 DIADMM Cc1nc2sccc2c(-c2ccc([O-])c(C(F)(F)F)c2)n1 ZINC001242148368 1057280041 /nfs/dbraw/zinc/28/00/41/1057280041.db2.gz VUADDEYWWIWZEK-UHFFFAOYSA-N -1 1 310.300 4.391 20 0 DIADMM Cc1cc2cnc(-c3ccc([O-])c(C(F)(F)F)c3)nc2s1 ZINC001242152281 1057280729 /nfs/dbraw/zinc/28/07/29/1057280729.db2.gz BWBPNVDWGGUMCG-UHFFFAOYSA-N -1 1 310.300 4.391 20 0 DIADMM [O-]c1ccc(-c2nccc(-c3ccco3)n2)cc1C(F)(F)F ZINC001242151831 1057281155 /nfs/dbraw/zinc/28/11/55/1057281155.db2.gz VABISXFVQIXDOM-UHFFFAOYSA-N -1 1 306.243 4.128 20 0 DIADMM Cc1ccc(-c2ccc(-c3ccc([O-])c(C(F)(F)F)c3)nn2)o1 ZINC001242157525 1057283869 /nfs/dbraw/zinc/28/38/69/1057283869.db2.gz HMVBXXILZULECH-UHFFFAOYSA-N -1 1 320.270 4.436 20 0 DIADMM CC(C)(C)OC(=O)c1ccc(-c2ccc(F)cc2[O-])c(F)c1 ZINC001242218615 1057297771 /nfs/dbraw/zinc/29/77/71/1057297771.db2.gz HRYBGCJMWYWAAP-UHFFFAOYSA-N -1 1 306.308 4.293 20 0 DIADMM COC(=O)c1cc(C(F)(F)F)ccc1-c1ccc(F)cc1[O-] ZINC001242219232 1057297793 /nfs/dbraw/zinc/29/77/93/1057297793.db2.gz OKEMKKBTTPDJFY-UHFFFAOYSA-N -1 1 314.234 4.004 20 0 DIADMM COC(=O)c1cccc(C(F)(F)F)c1-c1ccc(F)cc1[O-] ZINC001242220530 1057297964 /nfs/dbraw/zinc/29/79/64/1057297964.db2.gz CMGOKNCISRAIGQ-UHFFFAOYSA-N -1 1 314.234 4.004 20 0 DIADMM C[C@@H](CSc1ccc(F)cc1)C(=O)Nc1c([O-])cccc1F ZINC000674903529 1057297999 /nfs/dbraw/zinc/29/79/99/1057297999.db2.gz YNKVTJMOBLVZEU-JTQLQIEISA-N -1 1 323.364 4.037 20 0 DIADMM O=C([O-])Cc1cccc(-c2ccc3nc4cc[nH]cc-4c3c2)c1 ZINC001242266164 1057314266 /nfs/dbraw/zinc/31/42/66/1057314266.db2.gz YFHKJVIEUZGHIH-UHFFFAOYSA-N -1 1 302.333 4.010 20 0 DIADMM CCOc1cc(Nc2c([O-])cc(F)cc2F)c(F)cc1F ZINC001212531438 1057325730 /nfs/dbraw/zinc/32/57/30/1057325730.db2.gz AZYUYZYLEMIUBW-UHFFFAOYSA-N -1 1 301.239 4.091 20 0 DIADMM CC(C)C(=O)NCCc1ccc(-c2cccc(Cl)c2[O-])cc1 ZINC001242365576 1057347361 /nfs/dbraw/zinc/34/73/61/1057347361.db2.gz FUHWEQQAOLXCEE-UHFFFAOYSA-N -1 1 317.816 4.027 20 0 DIADMM COC(=O)c1cc2c(cncc2-c2cccc(Cl)c2[O-])s1 ZINC001242366044 1057347552 /nfs/dbraw/zinc/34/75/52/1057347552.db2.gz FQIRCSNPLSPMBT-UHFFFAOYSA-N -1 1 319.769 4.109 20 0 DIADMM [O-]c1c(Cl)cccc1-c1ccc(C2N=NC(=S)O2)cc1 ZINC001242367737 1057348184 /nfs/dbraw/zinc/34/81/84/1057348184.db2.gz RCBTYNKWIYRNLO-UHFFFAOYSA-N -1 1 304.758 4.051 20 0 DIADMM COC(=O)c1cnc2ccc(-c3cccc(Cl)c3[O-])cc2c1 ZINC001242367985 1057348370 /nfs/dbraw/zinc/34/83/70/1057348370.db2.gz VDMZCQMIDGKADP-UHFFFAOYSA-N -1 1 313.740 4.047 20 0 DIADMM CSc1ncc2cc(-c3cccc(Cl)c3[O-])ccc2n1 ZINC001242366734 1057349176 /nfs/dbraw/zinc/34/91/76/1057349176.db2.gz SORALVGKCPKYAO-UHFFFAOYSA-N -1 1 302.786 4.378 20 0 DIADMM CC(C)C1=NCCc2ccc(-c3cccc(C(=O)[O-])c3F)cc21 ZINC001242381483 1057354863 /nfs/dbraw/zinc/35/48/63/1057354863.db2.gz VIHMFAPQHOKVGN-UHFFFAOYSA-N -1 1 311.356 4.192 20 0 DIADMM CCOC(=O)c1nc2ccc(-c3cc4cc(F)ccc4o3)cc2[n-]1 ZINC001242706143 1057453371 /nfs/dbraw/zinc/45/33/71/1057453371.db2.gz GZZRRJWITRBRLD-UHFFFAOYSA-N -1 1 324.311 4.292 20 0 DIADMM C/C=C(\C)c1ccc(F)cc1[N-]S(=O)(=O)c1ccccc1 ZINC001242758028 1057467232 /nfs/dbraw/zinc/46/72/32/1057467232.db2.gz FAECXBOMBWKIHE-KGVSQERTSA-N -1 1 305.374 4.050 20 0 DIADMM COc1cc(C(F)(F)F)cc(-c2cccc([O-])c2Cl)n1 ZINC001242797704 1057479939 /nfs/dbraw/zinc/47/99/39/1057479939.db2.gz FITOOZXWLLGPNT-UHFFFAOYSA-N -1 1 303.667 4.135 20 0 DIADMM COc1cc2cnc(-c3cccc([O-])c3Cl)cc2cc1F ZINC001242799374 1057480589 /nfs/dbraw/zinc/48/05/89/1057480589.db2.gz HUTBGJKGJCITBQ-UHFFFAOYSA-N -1 1 303.720 4.409 20 0 DIADMM [O-]c1cccc(-c2nc(-c3cccnc3)nc3c2CCC3)c1Cl ZINC001242799980 1057480847 /nfs/dbraw/zinc/48/08/47/1057480847.db2.gz BDAYEUDHAOFJIG-UHFFFAOYSA-N -1 1 323.783 4.053 20 0 DIADMM [O-]c1cccc(-c2ccnc(Cc3ccc(F)cc3)n2)c1Cl ZINC001242800170 1057480922 /nfs/dbraw/zinc/48/09/22/1057480922.db2.gz FORWFNQPTPMSKL-UHFFFAOYSA-N -1 1 314.747 4.233 20 0 DIADMM CCOC(=O)c1cc2cc(-c3cccc([O-])c3Cl)ccc2[nH]1 ZINC001242799364 1057480958 /nfs/dbraw/zinc/48/09/58/1057480958.db2.gz HKYAAHPVPDUTPG-UHFFFAOYSA-N -1 1 315.756 4.371 20 0 DIADMM CC(=O)N1CCCc2ccc(-c3cccc([O-])c3Cl)cc21 ZINC001242799598 1057481064 /nfs/dbraw/zinc/48/10/64/1057481064.db2.gz TZBPYAPCIRTWNM-UHFFFAOYSA-N -1 1 301.773 4.012 20 0 DIADMM [O-]c1cccc(-c2nnc(C3CC3)cc2C(F)(F)F)c1Cl ZINC001242801755 1057481736 /nfs/dbraw/zinc/48/17/36/1057481736.db2.gz XUMOWBALNQCOAN-UHFFFAOYSA-N -1 1 314.694 4.399 20 0 DIADMM COc1ccc(-c2nccc(-c3cccc([O-])c3Cl)n2)cc1 ZINC001242800598 1057481742 /nfs/dbraw/zinc/48/17/42/1057481742.db2.gz IPUMRMPWIOFHSO-UHFFFAOYSA-N -1 1 312.756 4.178 20 0 DIADMM [O-]c1cccc(-c2cc(-c3ccc(F)cc3)ncn2)c1Cl ZINC001242801658 1057482068 /nfs/dbraw/zinc/48/20/68/1057482068.db2.gz VIBJTWCXWIKRCQ-UHFFFAOYSA-N -1 1 300.720 4.309 20 0 DIADMM [O-]c1cccc(-c2nc(-c3ccccn3)nc3c2CCC3)c1Cl ZINC001242801237 1057482246 /nfs/dbraw/zinc/48/22/46/1057482246.db2.gz OVBONTYIBPBTSL-UHFFFAOYSA-N -1 1 323.783 4.053 20 0 DIADMM COC(=O)c1ccc(-c2cccc([O-])c2Cl)c2ncccc12 ZINC001242800310 1057482266 /nfs/dbraw/zinc/48/22/66/1057482266.db2.gz MNCJHPNVTKPDLT-UHFFFAOYSA-N -1 1 313.740 4.047 20 0 DIADMM [O-]c1cccc(-c2ccc(-c3ccccc3F)nn2)c1Cl ZINC001242801654 1057482294 /nfs/dbraw/zinc/48/22/94/1057482294.db2.gz VGPUAKWDVGGUGE-UHFFFAOYSA-N -1 1 300.720 4.309 20 0 DIADMM O=C(Nc1ccc(-c2cccc([O-])c2Cl)cc1)c1ccccn1 ZINC001242803673 1057482874 /nfs/dbraw/zinc/48/28/74/1057482874.db2.gz XEZHAKICOHFRRF-UHFFFAOYSA-N -1 1 324.767 4.360 20 0 DIADMM O=c1c(-c2cccc([O-])c2Cl)cccn1-c1cccc(F)c1 ZINC001242801921 1057482885 /nfs/dbraw/zinc/48/28/85/1057482885.db2.gz GUBNWROWWLPGAR-UHFFFAOYSA-N -1 1 315.731 4.003 20 0 DIADMM CCOC(=O)C1(c2ccc(-c3cccc([O-])c3Cl)cc2)CC1 ZINC001242802474 1057483042 /nfs/dbraw/zinc/48/30/42/1057483042.db2.gz JDLANZWYACKIFU-UHFFFAOYSA-N -1 1 316.784 4.307 20 0 DIADMM Cc1ccc(-c2cccc3nc(C(F)(F)F)[nH]c32)cc1C(=O)[O-] ZINC001243199673 1057601734 /nfs/dbraw/zinc/60/17/34/1057601734.db2.gz UVQWCJSKKGUDRE-UHFFFAOYSA-N -1 1 320.270 4.255 20 0 DIADMM COC(=O)c1nc2cc(-c3ccc(OC(C)C)cc3C)ccc2[n-]1 ZINC001243278493 1057633092 /nfs/dbraw/zinc/63/30/92/1057633092.db2.gz LPQWFUQGBZBDSS-UHFFFAOYSA-N -1 1 324.380 4.112 20 0 DIADMM COC(=O)c1nc2ccc(-c3ccc(OC(C)C)cc3C)cc2[n-]1 ZINC001243278493 1057633096 /nfs/dbraw/zinc/63/30/96/1057633096.db2.gz LPQWFUQGBZBDSS-UHFFFAOYSA-N -1 1 324.380 4.112 20 0 DIADMM [O-]c1ccc(-c2cc(C3(C(F)(F)F)CC3)ccn2)c(F)c1F ZINC001243338727 1057651296 /nfs/dbraw/zinc/65/12/96/1057651296.db2.gz IFKPKJUXWIUZEA-UHFFFAOYSA-N -1 1 315.241 4.326 20 0 DIADMM CCOc1ccc2cc(-c3ccc([O-])c(F)c3F)cnc2c1 ZINC001243340745 1057652210 /nfs/dbraw/zinc/65/22/10/1057652210.db2.gz GUJMDZLJPHUXIZ-UHFFFAOYSA-N -1 1 301.292 4.284 20 0 DIADMM [O-]c1ccc(-c2ccc(OCC(F)(F)F)cc2)c(F)c1F ZINC001243342190 1057652804 /nfs/dbraw/zinc/65/28/04/1057652804.db2.gz AQUBDOCBZVWVFC-UHFFFAOYSA-N -1 1 304.214 4.279 20 0 DIADMM CC(C)(C)OC(=O)c1ccc(-c2ccc([O-])c(F)c2F)cc1F ZINC001243342234 1057652809 /nfs/dbraw/zinc/65/28/09/1057652809.db2.gz GCJDVFFTEQGYPO-UHFFFAOYSA-N -1 1 324.298 4.432 20 0 DIADMM COc1ccc(-c2cncc(-c3ccc([O-])c(F)c3F)c2)cc1 ZINC001243342334 1057652816 /nfs/dbraw/zinc/65/28/16/1057652816.db2.gz HHVJHZXZWLINDL-UHFFFAOYSA-N -1 1 313.303 4.408 20 0 DIADMM Cc1cc(N2CCCCC2)ncc1-c1ccc([O-])c(F)c1F ZINC001243342344 1057653320 /nfs/dbraw/zinc/65/33/20/1057653320.db2.gz LDQFDLYNJVUXBB-UHFFFAOYSA-N -1 1 304.340 4.031 20 0 DIADMM CC[C@@H](C(=O)OC)c1ccc(-c2ccc([O-])c(F)c2F)cc1 ZINC001243343241 1057653658 /nfs/dbraw/zinc/65/36/58/1057653658.db2.gz UGRFLJUFTRGMIJ-GFCCVEGCSA-N -1 1 306.308 4.004 20 0 DIADMM [O-]c1ccc(-c2cc(F)cc(N3CCCCC3)c2)c(F)c1F ZINC001243343581 1057654091 /nfs/dbraw/zinc/65/40/91/1057654091.db2.gz IENQSNLJEVHKPF-UHFFFAOYSA-N -1 1 307.315 4.467 20 0 DIADMM CC(C)(C)OC(=O)c1cccc(-c2cc(F)cc(F)c2[O-])c1 ZINC001243504090 1057697088 /nfs/dbraw/zinc/69/70/88/1057697088.db2.gz YDNUOOHKHSHBFD-UHFFFAOYSA-N -1 1 306.308 4.293 20 0 DIADMM CCOC(OCC)c1cccc(-c2cc(F)cc(F)c2[O-])c1 ZINC001243505606 1057697740 /nfs/dbraw/zinc/69/77/40/1057697740.db2.gz UXAUOUOVJDFZOA-UHFFFAOYSA-N -1 1 308.324 4.409 20 0 DIADMM COc1ccc(-c2cc(F)cc(F)c2[O-])c(OC(F)(F)F)c1 ZINC001243505271 1057697918 /nfs/dbraw/zinc/69/79/18/1057697918.db2.gz PWLRBIQHFUXSHS-UHFFFAOYSA-N -1 1 320.213 4.245 20 0 DIADMM COC(=O)c1ccc(C2CC2)c(-c2cc(F)cc(F)c2[O-])c1 ZINC001243506894 1057698531 /nfs/dbraw/zinc/69/85/31/1057698531.db2.gz NOYAFDMVIXWYMJ-UHFFFAOYSA-N -1 1 304.292 4.001 20 0 DIADMM Cc1ccccc1Oc1nc(-c2cccc([O-])c2F)ncc1F ZINC001243546103 1057709707 /nfs/dbraw/zinc/70/97/07/1057709707.db2.gz IVQJSCQCMLJZJX-UHFFFAOYSA-N -1 1 314.291 4.228 20 0 DIADMM Cc1cccc(Oc2nc(-c3cccc([O-])c3F)ncc2F)c1 ZINC001243546934 1057710193 /nfs/dbraw/zinc/71/01/93/1057710193.db2.gz ROADEJIODJWKTO-UHFFFAOYSA-N -1 1 314.291 4.228 20 0 DIADMM CCCN(CCC)c1cc(-c2ccc(Cl)c([O-])c2)ncn1 ZINC001243576042 1057720719 /nfs/dbraw/zinc/72/07/19/1057720719.db2.gz GNWNBUKVTHLWCN-UHFFFAOYSA-N -1 1 305.809 4.129 20 0 DIADMM [O-]c1cc(-c2cncc(Oc3cccc(F)c3)n2)ccc1Cl ZINC001243576760 1057720938 /nfs/dbraw/zinc/72/09/38/1057720938.db2.gz UMHDYRODQBYJII-UHFFFAOYSA-N -1 1 316.719 4.434 20 0 DIADMM COc1cc(-c2ccc(Cl)c([O-])c2)nc(-c2ccccc2)n1 ZINC001243575948 1057721010 /nfs/dbraw/zinc/72/10/10/1057721010.db2.gz AAAJNQJYPNQESD-UHFFFAOYSA-N -1 1 312.756 4.178 20 0 DIADMM COC(=O)c1cccc2nc(-c3ccc(Cl)c([O-])c3)ccc21 ZINC001243579107 1057722461 /nfs/dbraw/zinc/72/24/61/1057722461.db2.gz OMRMKKOZSTVGMK-UHFFFAOYSA-N -1 1 313.740 4.047 20 0 DIADMM COC(=O)c1cccc2cnc(-c3ccc(Cl)c([O-])c3)cc21 ZINC001243578700 1057722500 /nfs/dbraw/zinc/72/25/00/1057722500.db2.gz IOJXZWYFQHQNRF-UHFFFAOYSA-N -1 1 313.740 4.047 20 0 DIADMM COC(=O)c1cc2c(cncc2-c2ccc(Cl)c([O-])c2)s1 ZINC001243581040 1057723046 /nfs/dbraw/zinc/72/30/46/1057723046.db2.gz KBDRTMFINXVKGC-UHFFFAOYSA-N -1 1 319.769 4.109 20 0 DIADMM CCOC(=O)/C=C/c1cccc(-c2ccc(Cl)c([O-])c2)c1 ZINC001243580529 1057723216 /nfs/dbraw/zinc/72/32/16/1057723216.db2.gz FZDFNCGZLOJBQW-RMKNXTFCSA-N -1 1 302.757 4.289 20 0 DIADMM CC(C)(C)OC(=O)Nc1cc(-c2ccc(Cl)c([O-])c2)ccn1 ZINC001243580910 1057723343 /nfs/dbraw/zinc/72/33/43/1057723343.db2.gz GCFFQYNRCZSHPZ-UHFFFAOYSA-N -1 1 320.776 4.455 20 0 DIADMM O=C1NCCC/C1=C\c1cccc(-c2ccc(Cl)c([O-])c2)c1 ZINC001243582563 1057723782 /nfs/dbraw/zinc/72/37/82/1057723782.db2.gz AKASNCZPYTZNJS-XNTDXEJSSA-N -1 1 313.784 4.006 20 0 DIADMM CCOC(=O)/C=C/c1ccc(-c2ccc(Cl)c([O-])c2)cc1 ZINC001243583490 1057724256 /nfs/dbraw/zinc/72/42/56/1057724256.db2.gz PMWMKPDDKGMMEM-BJMVGYQFSA-N -1 1 302.757 4.289 20 0 DIADMM O=c1c(-c2ccc(Cl)c([O-])c2)cccn1-c1cccc(F)c1 ZINC001243583129 1057724277 /nfs/dbraw/zinc/72/42/77/1057724277.db2.gz IYFPFFPSUWPLJD-UHFFFAOYSA-N -1 1 315.731 4.003 20 0 DIADMM CNC(=O)c1ccc2cc(-c3ccc(Cl)c([O-])c3)ccc2c1 ZINC001243584253 1057724764 /nfs/dbraw/zinc/72/47/64/1057724764.db2.gz UMKDNBCMZDZVGV-UHFFFAOYSA-N -1 1 311.768 4.225 20 0 DIADMM [O-]c1cc(C(F)(F)F)ccc1-c1nccc2c3c([nH]c21)CCC3 ZINC001243607135 1057731044 /nfs/dbraw/zinc/73/10/44/1057731044.db2.gz QOEIVQRAKCNUAW-UHFFFAOYSA-N -1 1 318.298 4.443 20 0 DIADMM Cn1cccc1-c1ccc(-c2ccc(C(F)(F)F)cc2[O-])nc1 ZINC001243607649 1057731140 /nfs/dbraw/zinc/73/11/40/1057731140.db2.gz XQLUKBMAMQTXCQ-UHFFFAOYSA-N -1 1 318.298 4.479 20 0 DIADMM [O-]c1cc(C(F)(F)F)ccc1-c1ccc2ncc(F)cc2n1 ZINC001243607697 1057731681 /nfs/dbraw/zinc/73/16/81/1057731681.db2.gz QCMMIBUCIHLTOY-UHFFFAOYSA-N -1 1 308.234 4.160 20 0 DIADMM CCCSc1cncc(-c2ccc(C(F)(F)F)cc2[O-])n1 ZINC001243610729 1057733190 /nfs/dbraw/zinc/73/31/90/1057733190.db2.gz QAPMWCUHFFDRST-UHFFFAOYSA-N -1 1 314.332 4.370 20 0 DIADMM Cc1cc(-c2ccc(C(F)(F)F)cc2[O-])nc(-c2ccco2)n1 ZINC001243610993 1057733278 /nfs/dbraw/zinc/73/32/78/1057733278.db2.gz XWHAMALXIAWRQV-UHFFFAOYSA-N -1 1 320.270 4.436 20 0 DIADMM COC(=O)c1nc2cc(-c3ccc(C(C)(F)F)cc3)ccc2[n-]1 ZINC001243644162 1057741839 /nfs/dbraw/zinc/74/18/39/1057741839.db2.gz WXJNPNCHMOANST-UHFFFAOYSA-N -1 1 316.307 4.128 20 0 DIADMM COC(=O)c1nc2ccc(-c3ccc(C(C)(F)F)cc3)cc2[n-]1 ZINC001243644162 1057741842 /nfs/dbraw/zinc/74/18/42/1057741842.db2.gz WXJNPNCHMOANST-UHFFFAOYSA-N -1 1 316.307 4.128 20 0 DIADMM CCOC(=O)c1nc2cc(-c3ccc(OC)c(C)c3C)ccc2[n-]1 ZINC001244001847 1057834703 /nfs/dbraw/zinc/83/47/03/1057834703.db2.gz IPQPRGSCLMDCHM-UHFFFAOYSA-N -1 1 324.380 4.032 20 0 DIADMM CCOC(=O)c1nc2ccc(-c3ccc(OC)c(C)c3C)cc2[n-]1 ZINC001244001847 1057834708 /nfs/dbraw/zinc/83/47/08/1057834708.db2.gz IPQPRGSCLMDCHM-UHFFFAOYSA-N -1 1 324.380 4.032 20 0 DIADMM COC(=O)c1cc2ccc(-c3cc(F)c([O-])c(F)c3)cc2s1 ZINC001244094107 1057866452 /nfs/dbraw/zinc/86/64/52/1057866452.db2.gz OIKRDCQDYPJTLU-UHFFFAOYSA-N -1 1 320.316 4.339 20 0 DIADMM COC(=O)c1cc2cc(-c3cc(F)c([O-])c(F)c3)ccc2s1 ZINC001244093706 1057866704 /nfs/dbraw/zinc/86/67/04/1057866704.db2.gz LATCJURLJQAOAB-UHFFFAOYSA-N -1 1 320.316 4.339 20 0 DIADMM COc1cc(-c2cc(F)c([O-])c(F)c2)cc(C(F)(F)F)c1 ZINC001244094192 1057866830 /nfs/dbraw/zinc/86/68/30/1057866830.db2.gz PQCBRXUBSYXPEB-UHFFFAOYSA-N -1 1 304.214 4.365 20 0 DIADMM CC(C)(C)OC(=O)c1ccc(-c2cc(F)c([O-])c(F)c2)cc1F ZINC001244093700 1057867161 /nfs/dbraw/zinc/86/71/61/1057867161.db2.gz KUXAGXQWZCNDDZ-UHFFFAOYSA-N -1 1 324.298 4.432 20 0 DIADMM [O-]c1c(F)cc(-c2ccc(-c3c[nH]c(=S)[nH]3)cc2)cc1F ZINC001244094154 1057867189 /nfs/dbraw/zinc/86/71/89/1057867189.db2.gz PGBZVCGXRFIBLO-UHFFFAOYSA-N -1 1 304.321 4.016 20 0 DIADMM CCOc1ccc2cc(-c3cc(F)c([O-])c(F)c3)cnc2c1 ZINC001244096429 1057868019 /nfs/dbraw/zinc/86/80/19/1057868019.db2.gz IYJGGKIWKBOXAZ-UHFFFAOYSA-N -1 1 301.292 4.284 20 0 DIADMM CCOC(OCC)c1cccc(-c2cc(F)c([O-])c(F)c2)c1 ZINC001244097631 1057868297 /nfs/dbraw/zinc/86/82/97/1057868297.db2.gz RONCEJFXEFDXLI-UHFFFAOYSA-N -1 1 308.324 4.409 20 0 DIADMM CCOC(=O)CCCc1ccc(-c2cc(F)c([O-])c(F)c2)cc1 ZINC001244098035 1057868488 /nfs/dbraw/zinc/86/84/88/1057868488.db2.gz UJAAFOJQWZIZED-UHFFFAOYSA-N -1 1 320.335 4.223 20 0 DIADMM [O-]c1ccc(OC(F)(F)F)cc1-c1ncccc1C(F)(F)F ZINC001244456816 1057963304 /nfs/dbraw/zinc/96/33/04/1057963304.db2.gz SEVPGEWWTVCMEN-UHFFFAOYSA-N -1 1 323.192 4.372 20 0 DIADMM [O-]c1cc(OC(F)(F)F)ccc1-c1cc(C(F)F)ccn1 ZINC001244463242 1057965661 /nfs/dbraw/zinc/96/56/61/1057965661.db2.gz DIPHMHMKBADUIV-UHFFFAOYSA-N -1 1 305.202 4.290 20 0 DIADMM [O-]c1cc(OC(F)(F)F)ccc1-c1ccc(C2CCC2)nn1 ZINC001244463602 1057965881 /nfs/dbraw/zinc/96/58/81/1057965881.db2.gz TZNDTOYYLWMUOU-UHFFFAOYSA-N -1 1 310.275 4.015 20 0 DIADMM Cc1cccc2ncc(-c3ccc(OC(F)(F)F)cc3[O-])nc12 ZINC001244464914 1057966071 /nfs/dbraw/zinc/96/60/71/1057966071.db2.gz XWPZSEVHLYZDEN-UHFFFAOYSA-N -1 1 320.270 4.209 20 0 DIADMM Cc1nc2ccccc2c(-c2ccc(OC(F)(F)F)cc2[O-])n1 ZINC001244464885 1057966209 /nfs/dbraw/zinc/96/62/09/1057966209.db2.gz XCCARPBNZIMJIU-UHFFFAOYSA-N -1 1 320.270 4.209 20 0 DIADMM CSc1cnc(-c2ccc(OC(F)(F)F)cc2[O-])c(C)c1 ZINC001244464214 1057966327 /nfs/dbraw/zinc/96/63/27/1057966327.db2.gz WWSOXERPELPLFJ-UHFFFAOYSA-N -1 1 315.316 4.383 20 0 DIADMM COc1cc(C)c2ncnc(-c3cc(C)c([O-])c(Cl)c3)c2c1 ZINC001244537701 1057989046 /nfs/dbraw/zinc/98/90/46/1057989046.db2.gz CIUCZQYIKUAYQW-UHFFFAOYSA-N -1 1 314.772 4.281 20 0 DIADMM [O-]c1ccc(Cl)c(-c2ccc(F)c(C(F)(F)F)n2)c1F ZINC001244537314 1057989102 /nfs/dbraw/zinc/98/91/02/1057989102.db2.gz BXRKMXKQBLNOQR-UHFFFAOYSA-N -1 1 309.621 4.405 20 0 DIADMM Cc1cc(-c2ccc(N3CCC(C)CC3)nn2)cc(Cl)c1[O-] ZINC001244536733 1057989162 /nfs/dbraw/zinc/98/91/62/1057989162.db2.gz OSCCCUFTNYMUFW-UHFFFAOYSA-N -1 1 317.820 4.047 20 0 DIADMM CC(C)(C)C(=O)Nc1cccc(-c2c(Cl)ccc([O-])c2F)n1 ZINC001244537474 1057989221 /nfs/dbraw/zinc/98/92/21/1057989221.db2.gz FMTJDKRVIOFPKP-UHFFFAOYSA-N -1 1 322.767 4.231 20 0 DIADMM CC(C)(C)c1nc2[nH]ccc2c(-c2c(Cl)ccc([O-])c2F)n1 ZINC001244537800 1057989523 /nfs/dbraw/zinc/98/95/23/1057989523.db2.gz FQPOIWRCQXBMJS-UHFFFAOYSA-N -1 1 319.767 4.372 20 0 DIADMM Cc1cc(-c2cc(N3CCC[C@@H](C)C3)ncn2)cc(Cl)c1[O-] ZINC001244537758 1057989533 /nfs/dbraw/zinc/98/95/33/1057989533.db2.gz FNLCCBMNHXZLAN-LLVKDONJSA-N -1 1 317.820 4.047 20 0 DIADMM CC(C)(C)OC(=O)c1ccc(-c2c(Cl)ccc([O-])c2F)nc1 ZINC001244538901 1057989676 /nfs/dbraw/zinc/98/96/76/1057989676.db2.gz PMRXKVYJIAOVNG-UHFFFAOYSA-N -1 1 323.751 4.202 20 0 DIADMM Cc1cc(-c2cnc3cc(F)c(F)cc3n2)cc(Cl)c1[O-] ZINC001244538692 1057989758 /nfs/dbraw/zinc/98/97/58/1057989758.db2.gz OQUJUOBVRFILKX-UHFFFAOYSA-N -1 1 306.699 4.242 20 0 DIADMM CC(C)(C)OC(=O)c1cccc(-c2c(Cl)ccc([O-])c2F)n1 ZINC001244537852 1057989804 /nfs/dbraw/zinc/98/98/04/1057989804.db2.gz GAQOTKIMNMEOER-UHFFFAOYSA-N -1 1 323.751 4.202 20 0 DIADMM [O-]c1ccc(Cl)c(-c2nccc(C(F)(F)F)c2F)c1F ZINC001244538344 1057989936 /nfs/dbraw/zinc/98/99/36/1057989936.db2.gz NFWBEUZPMVVWBQ-UHFFFAOYSA-N -1 1 309.621 4.405 20 0 DIADMM COc1nccc2cc(-c3c(Cl)ccc([O-])c3F)ccc21 ZINC001244539869 1057990500 /nfs/dbraw/zinc/99/05/00/1057990500.db2.gz LMTXWVIELLXEKJ-UHFFFAOYSA-N -1 1 303.720 4.409 20 0 DIADMM CCOC(=O)c1ccc(-c2c(Cl)ccc([O-])c2F)c(C)c1 ZINC001244539711 1057990816 /nfs/dbraw/zinc/99/08/16/1057990816.db2.gz DOLGTZPBGDUMKB-UHFFFAOYSA-N -1 1 308.736 4.337 20 0 DIADMM CCN(CC)C(=O)c1ccc(-c2c(Cl)ccc([O-])c2F)cc1 ZINC001244540204 1057990953 /nfs/dbraw/zinc/99/09/53/1057990953.db2.gz SRZORXUNZZSMFX-UHFFFAOYSA-N 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IPFLHMTWQJOSLR-UHFFFAOYSA-N -1 1 307.752 4.373 20 0 DIADMM CCOC(=O)c1cc(-c2c(Cl)ccc([O-])c2F)ccc1F ZINC001244543114 1057992072 /nfs/dbraw/zinc/99/20/72/1057992072.db2.gz TUXVDWDIYCZBSM-UHFFFAOYSA-N -1 1 312.699 4.168 20 0 DIADMM O=C([O-])c1cc(-c2cccn3cncc23)c(Cl)cc1Cl ZINC001245003973 1058090320 /nfs/dbraw/zinc/09/03/20/1058090320.db2.gz MYLSQEDIJPXIST-UHFFFAOYSA-N -1 1 307.136 4.006 20 0 DIADMM Cc1nc(-c2ccccn2)nc(-c2cc(Cl)ccc2[O-])c1C ZINC001245049293 1058102376 /nfs/dbraw/zinc/10/23/76/1058102376.db2.gz IQIVNZFLGMBCDD-UHFFFAOYSA-N -1 1 311.772 4.181 20 0 DIADMM COc1cc2nc(-c3cc(Cl)ccc3[O-])ccc2c(OC)c1 ZINC001245050125 1058102428 /nfs/dbraw/zinc/10/24/28/1058102428.db2.gz BOZBYXJNONSKHM-UHFFFAOYSA-N -1 1 315.756 4.278 20 0 DIADMM Cc1nc(-c2cccnc2)nc(-c2cc(Cl)ccc2[O-])c1C ZINC001245049330 1058102704 /nfs/dbraw/zinc/10/27/04/1058102704.db2.gz JHHAROZZEMQVSW-UHFFFAOYSA-N -1 1 311.772 4.181 20 0 DIADMM COC(=O)c1cc(-c2cc(Cl)ccc2[O-])nc2ccccc21 ZINC001245049643 1058102744 /nfs/dbraw/zinc/10/27/44/1058102744.db2.gz ZROMGHPNMQUSEQ-UHFFFAOYSA-N -1 1 313.740 4.047 20 0 DIADMM O=C([O-])c1ccc(-c2cc(N3CCCCC3)ccn2)c(Cl)c1 ZINC001245370895 1058154443 /nfs/dbraw/zinc/15/44/43/1058154443.db2.gz MWNOOFILIZAMIV-UHFFFAOYSA-N -1 1 316.788 4.091 20 0 DIADMM CC(C)(C)[C@@H]1CCCN1C(=O)c1ccc(C(F)(F)F)c([O-])c1 ZINC001545099969 1058182764 /nfs/dbraw/zinc/18/27/64/1058182764.db2.gz JMPVOEPJLTWIIH-ZDUSSCGKSA-N -1 1 315.335 4.062 20 0 DIADMM C[C@@H](NC(=S)Nc1cccc([O-])c1Cl)c1ccccc1 ZINC001245517536 1058193066 /nfs/dbraw/zinc/19/30/66/1058193066.db2.gz AQKGBOQCUZWUDT-SNVBAGLBSA-N -1 1 306.818 4.093 20 0 DIADMM C[C@@H](NC(=S)Nc1cc([O-])c(Cl)cc1F)c1ccccc1 ZINC001245514516 1058194102 /nfs/dbraw/zinc/19/41/02/1058194102.db2.gz GWHPBAZTIOFUQL-SECBINFHSA-N -1 1 324.808 4.232 20 0 DIADMM CCOC(=O)c1nc2cc(-c3cc4ccc(F)cc4[nH]3)ccc2[n-]1 ZINC001245590782 1058262042 /nfs/dbraw/zinc/26/20/42/1058262042.db2.gz YSWSYTQYOCOPJS-UHFFFAOYSA-N -1 1 323.327 4.027 20 0 DIADMM CCOC(=O)c1nc2ccc(-c3cc4ccc(F)cc4[nH]3)cc2[n-]1 ZINC001245590782 1058262043 /nfs/dbraw/zinc/26/20/43/1058262043.db2.gz YSWSYTQYOCOPJS-UHFFFAOYSA-N -1 1 323.327 4.027 20 0 DIADMM Nc1cccc(-c2cc3nc(-c4c([O-])cccc4F)ccc3[nH]2)c1 ZINC001245654083 1058313323 /nfs/dbraw/zinc/31/33/23/1058313323.db2.gz RXLUQGYLOCCRNL-UHFFFAOYSA-N -1 1 319.339 4.324 20 0 DIADMM CSc1nc2c(c(-c3c(F)ccc([O-])c3Cl)n1)CCCC2 ZINC001245826146 1058522455 /nfs/dbraw/zinc/52/24/55/1058522455.db2.gz DVMXFBVXJXQTHF-UHFFFAOYSA-N -1 1 324.808 4.242 20 0 DIADMM Cc1sc2ncnc(-c3c(F)ccc([O-])c3Cl)c2c1C ZINC001245826513 1058523245 /nfs/dbraw/zinc/52/32/45/1058523245.db2.gz JWPNQTABZUXDBS-UHFFFAOYSA-N -1 1 308.765 4.473 20 0 DIADMM [O-]c1ccc(F)c(-c2ccc(-c3ccccc3F)nn2)c1Cl ZINC001245829660 1058523637 /nfs/dbraw/zinc/52/36/37/1058523637.db2.gz DABSQUZUVXRPOQ-UHFFFAOYSA-N -1 1 318.710 4.448 20 0 DIADMM [O-]c1ccc(F)c(-c2ncc(C(F)(F)F)cc2F)c1Cl ZINC001245828684 1058526037 /nfs/dbraw/zinc/52/60/37/1058526037.db2.gz YTLCSBRBAYSOLY-UHFFFAOYSA-N -1 1 309.621 4.405 20 0 DIADMM Cc1cc(C(=O)OC(C)C)cnc1-c1c(F)ccc([O-])c1Cl ZINC001245830317 1058527285 /nfs/dbraw/zinc/52/72/85/1058527285.db2.gz KYXSIRPXEOBFAW-UHFFFAOYSA-N -1 1 323.751 4.120 20 0 DIADMM CCOC(=O)/C=C/c1cccc(-c2c(F)ccc([O-])c2Cl)c1 ZINC001245831254 1058528626 /nfs/dbraw/zinc/52/86/26/1058528626.db2.gz BQAQCYWAORPQMS-RMKNXTFCSA-N -1 1 320.747 4.428 20 0 DIADMM CCOC(=O)c1c(C)cc(-c2c(F)ccc([O-])c2Cl)nc1C ZINC001245830302 1058528714 /nfs/dbraw/zinc/52/87/14/1058528714.db2.gz KJJTUWVUTGXDSF-UHFFFAOYSA-N -1 1 323.751 4.040 20 0 DIADMM Cc1cc(-c2c(F)ccc([O-])c2Cl)nc(-c2cccnc2)n1 ZINC001245830014 1058529055 /nfs/dbraw/zinc/52/90/55/1058529055.db2.gz GYDJKEOKWQLDAR-UHFFFAOYSA-N -1 1 315.735 4.012 20 0 DIADMM [O-]c1ccc(F)c(-c2cccc(OCC(F)(F)F)n2)c1Cl ZINC001245829763 1058530052 /nfs/dbraw/zinc/53/00/52/1058530052.db2.gz CFYMTFKHUSKYJM-UHFFFAOYSA-N -1 1 321.657 4.188 20 0 DIADMM [O-]c1ccc(F)c(-c2ncncc2-c2ccccc2)c1Cl ZINC001245830045 1058530433 /nfs/dbraw/zinc/53/04/33/1058530433.db2.gz HGUVNNCILDGKKT-UHFFFAOYSA-N -1 1 300.720 4.309 20 0 DIADMM Cc1cc2ncnc(-c3c(F)ccc([O-])c3Cl)c2cc1C ZINC001245830493 1058530481 /nfs/dbraw/zinc/53/04/81/1058530481.db2.gz PKQSPTCFJLGTEY-UHFFFAOYSA-N -1 1 302.736 4.412 20 0 DIADMM [O-]c1ccc(F)c(-c2ccc(OC(F)(F)F)nc2)c1Cl ZINC001245832508 1058531690 /nfs/dbraw/zinc/53/16/90/1058531690.db2.gz XNQQDXMYUAZYPX-UHFFFAOYSA-N -1 1 307.630 4.145 20 0 DIADMM COc1ccc2cccc(-c3c(F)ccc([O-])c3Cl)c2n1 ZINC001245832030 1058532516 /nfs/dbraw/zinc/53/25/16/1058532516.db2.gz KGTRWFWJVBQILM-UHFFFAOYSA-N -1 1 303.720 4.409 20 0 DIADMM CCOC(=O)c1cc(F)ccc1-c1c(F)ccc([O-])c1Cl ZINC001245832404 1058533366 /nfs/dbraw/zinc/53/33/66/1058533366.db2.gz VNVRJVDDEKTINU-UHFFFAOYSA-N -1 1 312.699 4.168 20 0 DIADMM COc1ncc(-c2c(F)ccc([O-])c2Cl)cc1C(F)(F)F ZINC001245831855 1058533741 /nfs/dbraw/zinc/53/37/41/1058533741.db2.gz QYOXCFZGRKUORZ-UHFFFAOYSA-N -1 1 321.657 4.274 20 0 DIADMM CC(=O)Oc1c[nH]c2cc(-c3c(F)ccc([O-])c3Cl)ccc12 ZINC001245832561 1058534543 /nfs/dbraw/zinc/53/45/43/1058534543.db2.gz YYKSYRFXQHWMOG-UHFFFAOYSA-N -1 1 319.719 4.258 20 0 DIADMM CC(C)(C)c1nnc2ccc(-c3c(F)ccc([O-])c3Cl)cn21 ZINC001245832521 1058534877 /nfs/dbraw/zinc/53/48/77/1058534877.db2.gz XWKCMJIWIGCROC-UHFFFAOYSA-N -1 1 319.767 4.192 20 0 DIADMM O=C(c1ccccc1-c1c(F)ccc([O-])c1Cl)N1CCCC1 ZINC001245832122 1058534912 /nfs/dbraw/zinc/53/49/12/1058534912.db2.gz IBEZGNNPAVAQJU-UHFFFAOYSA-N -1 1 319.763 4.088 20 0 DIADMM [O-]c1ccc(F)c(-c2ncccc2C2CCOCC2)c1Cl ZINC001245833183 1058535690 /nfs/dbraw/zinc/53/56/90/1058535690.db2.gz UFEGVUVEHRRWRB-UHFFFAOYSA-N -1 1 307.752 4.141 20 0 DIADMM [O-]c1ccc(F)c(-c2nc(C3CCC3)nc3[nH]ccc32)c1Cl ZINC001245833286 1058537891 /nfs/dbraw/zinc/53/78/91/1058537891.db2.gz XPZPIBRWLRNNAU-UHFFFAOYSA-N -1 1 317.751 4.342 20 0 DIADMM COc1cc(-c2c(F)ccc([O-])c2Cl)c(NC(C)=O)cc1C ZINC001245834582 1058538753 /nfs/dbraw/zinc/53/87/53/1058538753.db2.gz IQCAXBGWPHAEBE-UHFFFAOYSA-N -1 1 323.751 4.127 20 0 DIADMM CC[C@H]1Cc2ccccc2CN1C(=O)c1ccc(Cl)cc1[O-] ZINC001556111005 1058543433 /nfs/dbraw/zinc/54/34/33/1058543433.db2.gz KLKUIGHEUWABAU-HNNXBMFYSA-N -1 1 315.800 4.023 20 0 DIADMM CC[C@H](NC(=O)c1ccc(C(F)(F)F)c([O-])c1)C1CCCC1 ZINC001556592150 1058618185 /nfs/dbraw/zinc/61/81/85/1058618185.db2.gz ZKPCXUIGXMDKED-ZDUSSCGKSA-N -1 1 315.335 4.110 20 0 DIADMM Cc1cc2cc(C(=O)Nc3cc([O-])c(F)cc3F)oc2cc1C ZINC001556919713 1058669573 /nfs/dbraw/zinc/66/95/73/1058669573.db2.gz MIHKYAPMECTZSK-UHFFFAOYSA-N -1 1 317.291 4.286 20 0 DIADMM O=C(Nc1cc([O-])c(F)cc1F)c1ccc(F)c2ccccc12 ZINC001556919945 1058670665 /nfs/dbraw/zinc/67/06/65/1058670665.db2.gz XCQFRIOYXTYSRA-UHFFFAOYSA-N -1 1 317.266 4.215 20 0 DIADMM O=C(Nc1cc(F)cc(F)c1[O-])c1ccc(C2CCC2)cc1 ZINC001557086095 1058697825 /nfs/dbraw/zinc/69/78/25/1058697825.db2.gz HHMXSEZKVZHYRL-UHFFFAOYSA-N -1 1 303.308 4.190 20 0 DIADMM C[C@@H]1CCc2sc(C(=O)Nc3cc(F)cc(F)c3[O-])cc2C1 ZINC001557086451 1058698813 /nfs/dbraw/zinc/69/88/13/1058698813.db2.gz RPDHHAPLCFBPSU-MRVPVSSYSA-N -1 1 323.364 4.109 20 0 DIADMM CC[C@@H](Sc1ccccc1)C(=O)Nc1c([O-])cccc1F ZINC001557408042 1058745745 /nfs/dbraw/zinc/74/57/45/1058745745.db2.gz KYIDJILLJIPRNC-CQSZACIVSA-N -1 1 305.374 4.041 20 0 DIADMM O=C(CCc1ccco1)Nc1cc(Cl)c([O-])c2ccccc12 ZINC001557586469 1058773100 /nfs/dbraw/zinc/77/31/00/1058773100.db2.gz NPEQOYZGLPWVBJ-UHFFFAOYSA-N -1 1 315.756 4.363 20 0 DIADMM CC1(C)C[C@]1(NC(=O)c1ccc(Cl)cc1[O-])c1ccccc1 ZINC001557663212 1058785899 /nfs/dbraw/zinc/78/58/99/1058785899.db2.gz ZAYBHDVNTDFLRQ-SFHVURJKSA-N -1 1 315.800 4.101 20 0 DIADMM Cc1ccc2sc(C(=O)Nc3cccc(F)c3[O-])cc2c1 ZINC001557957113 1058817080 /nfs/dbraw/zinc/81/70/80/1058817080.db2.gz RABATMJKFTUGOA-UHFFFAOYSA-N -1 1 301.342 4.307 20 0 DIADMM CCc1ccc(C(=O)N(CC)c2ccc(F)c(C)c2)c([O-])c1 ZINC001558241124 1058854906 /nfs/dbraw/zinc/85/49/06/1058854906.db2.gz OIVMXLVNRDZQGO-UHFFFAOYSA-N -1 1 301.361 4.069 20 0 DIADMM C[C@@H]1CCN(C(=O)c2cc(Cl)ccc2[O-])[C@H]1c1ccccc1 ZINC001558302916 1058862490 /nfs/dbraw/zinc/86/24/90/1058862490.db2.gz FAGQFDUAZWCWKD-SJKOYZFVSA-N -1 1 315.800 4.269 20 0 DIADMM CSc1c(F)cccc1[N-]C(=O)c1coc(C(C)(C)C)n1 ZINC001532197612 1059550477 /nfs/dbraw/zinc/55/04/77/1059550477.db2.gz BATQTVWNWDSCHL-UHFFFAOYSA-N -1 1 308.378 4.085 20 0 DIADMM [O-]c1cccc(NC(=S)Nc2cc(F)ccc2F)c1Cl ZINC001248593328 1059907320 /nfs/dbraw/zinc/90/73/20/1059907320.db2.gz BBWKYISPILQMDN-UHFFFAOYSA-N -1 1 314.744 4.133 20 0 DIADMM CCc1cccc(C)c1NC(=S)Nc1cc(Cl)ncc1[O-] ZINC001248729982 1059958093 /nfs/dbraw/zinc/95/80/93/1059958093.db2.gz AMECDCLZDWQOPF-UHFFFAOYSA-N -1 1 321.833 4.120 20 0 DIADMM COc1cc2ccccc2cc1Nc1ccnc(Cl)c1[O-] ZINC001249549131 1060284360 /nfs/dbraw/zinc/28/43/60/1060284360.db2.gz BIIGYSCYKWUHEH-UHFFFAOYSA-N -1 1 300.745 4.346 20 0 DIADMM CCc1cccc(C)c1NC(=S)Nc1cccc(F)c1[O-] ZINC001249560794 1060291395 /nfs/dbraw/zinc/29/13/95/1060291395.db2.gz KURPMXQHPMPOHW-UHFFFAOYSA-N -1 1 304.390 4.211 20 0 DIADMM Cc1cc(C)c(NC(=S)Nc2ccc([O-])c(F)c2F)c(C)c1 ZINC001249732658 1060378870 /nfs/dbraw/zinc/37/88/70/1060378870.db2.gz AFRNIKWPBVFKSU-UHFFFAOYSA-N -1 1 322.380 4.405 20 0 DIADMM CCc1c(Cl)cc(Nc2cnc(N)c(F)c2)c([O-])c1Cl ZINC001249768228 1060389247 /nfs/dbraw/zinc/38/92/47/1060389247.db2.gz KOERAUZESGREMB-UHFFFAOYSA-N -1 1 316.163 4.121 20 0 DIADMM O=C([O-])c1c(F)ccc(CN2CCC[C@@H]2c2ccccc2)c1F ZINC001249774257 1060393605 /nfs/dbraw/zinc/39/36/05/1060393605.db2.gz UQRCVHFITBLGOV-OAHLLOKOSA-N -1 1 317.335 4.000 20 0 DIADMM CC(C)Oc1cc(F)c(Nc2ccnc(Cl)c2[O-])c(F)c1 ZINC001249775835 1060393906 /nfs/dbraw/zinc/39/39/06/1060393906.db2.gz GAYAAWAKPZNZRZ-UHFFFAOYSA-N -1 1 314.719 4.250 20 0 DIADMM CC(C)COc1ncc([N-]c2nnc(C(C)(C)C)o2)cc1Cl ZINC001249778817 1060396297 /nfs/dbraw/zinc/39/62/97/1060396297.db2.gz MANKMPHMNRCBEN-UHFFFAOYSA-N -1 1 324.812 4.194 20 0 DIADMM [O-]c1cc(Nc2nc(-c3ccncc3)cs2)c(F)c(F)c1F ZINC001249957653 1060498774 /nfs/dbraw/zinc/49/87/74/1060498774.db2.gz DMZGTTASEQCLBU-UHFFFAOYSA-N -1 1 323.299 4.072 20 0 DIADMM COc1ccc2ncc(Nc3cc([O-])c(F)c(F)c3F)cc2c1 ZINC001249960708 1060503402 /nfs/dbraw/zinc/50/34/02/1060503402.db2.gz QZZXATKVMLJECO-UHFFFAOYSA-N -1 1 320.270 4.110 20 0 DIADMM [O-]c1cc(Nc2cc(-c3ccccc3)no2)c(F)c(F)c1F ZINC001249959265 1060504039 /nfs/dbraw/zinc/50/40/39/1060504039.db2.gz ZVGLPAHUYBWHKE-UHFFFAOYSA-N -1 1 306.243 4.208 20 0 DIADMM [O-]c1cc(Nc2ccc(C(F)(F)F)cc2O)c(F)c(F)c1F ZINC001249964058 1060507739 /nfs/dbraw/zinc/50/77/39/1060507739.db2.gz XXXXCIVGYQJUIL-UHFFFAOYSA-N -1 1 323.192 4.278 20 0 DIADMM [O-]c1cc(Nc2ccc(Br)cc2)c(F)c(F)c1F ZINC001249963490 1060508813 /nfs/dbraw/zinc/50/88/13/1060508813.db2.gz YKCXSTQAJLKBNV-UHFFFAOYSA-N -1 1 318.092 4.316 20 0 DIADMM [O-]c1cc(Nc2cccc(OC(F)(F)F)c2)c(F)c(F)c1F ZINC001249962896 1060509176 /nfs/dbraw/zinc/50/91/76/1060509176.db2.gz PCRIXGRAWBRXCT-UHFFFAOYSA-N -1 1 323.192 4.452 20 0 DIADMM CCOc1ccc(Nc2cc([O-])c(F)c(F)c2F)cc1F ZINC001249965884 1060511310 /nfs/dbraw/zinc/51/13/10/1060511310.db2.gz QKBABELMNURHAL-UHFFFAOYSA-N -1 1 301.239 4.091 20 0 DIADMM CC(C)Oc1cccc(F)c1Nc1cc([O-])c(F)c(F)c1F ZINC001249966054 1060512808 /nfs/dbraw/zinc/51/28/08/1060512808.db2.gz ZFKVTUWUFNOZJL-UHFFFAOYSA-N -1 1 315.266 4.479 20 0 DIADMM [O-]c1cc(Nc2cc(F)c(Cl)cc2F)c(F)c(F)c1F ZINC001249966023 1060514343 /nfs/dbraw/zinc/51/43/43/1060514343.db2.gz XRXOWRMMMHZOOX-UHFFFAOYSA-N -1 1 309.621 4.485 20 0 DIADMM [O-]c1cc(F)c(Nc2c(Cl)cncc2Cl)cc1Cl ZINC001250018937 1060543517 /nfs/dbraw/zinc/54/35/17/1060543517.db2.gz VPSUBPQWZOPPFB-UHFFFAOYSA-N -1 1 307.539 4.052 20 0 DIADMM [O-]c1cc(F)c(Nc2ncc(C(F)(F)F)cc2F)cc1Cl ZINC001250020561 1060542161 /nfs/dbraw/zinc/54/21/61/1060542161.db2.gz NGSUMCSIYDAJCC-UHFFFAOYSA-N -1 1 324.636 4.481 20 0 DIADMM [O-]c1cc(F)c(Nc2nc(C(F)(F)F)cs2)cc1Cl ZINC001250020042 1060543271 /nfs/dbraw/zinc/54/32/71/1060543271.db2.gz BVMVDRFLHAWQRW-UHFFFAOYSA-N -1 1 312.675 4.404 20 0 DIADMM [O-]c1cc(F)c(Nc2nc3c(cccc3O)s2)cc1Cl ZINC001250017770 1060543785 /nfs/dbraw/zinc/54/37/85/1060543785.db2.gz JNYORMUOJVWNGV-UHFFFAOYSA-N -1 1 310.737 4.244 20 0 DIADMM COC(=O)c1sc(C)cc1Nc1cc(Cl)c([O-])cc1F ZINC001250020290 1060544075 /nfs/dbraw/zinc/54/40/75/1060544075.db2.gz IYUDRYZTLNEVMA-UHFFFAOYSA-N -1 1 315.753 4.085 20 0 DIADMM O=c1oc2ccccc2cc1Nc1cc(Cl)c([O-])cc1F ZINC001250020171 1060544416 /nfs/dbraw/zinc/54/44/16/1060544416.db2.gz NHJJWYXBBYTCBH-UHFFFAOYSA-N -1 1 305.692 4.035 20 0 DIADMM Nc1ccc(N(c2cc(Cl)c([O-])cc2F)C2CCCC2)nc1 ZINC001250023669 1060546894 /nfs/dbraw/zinc/54/68/94/1060546894.db2.gz UYUQNLJMINXGAY-UHFFFAOYSA-N -1 1 321.783 4.243 20 0 DIADMM [O-]c1cc(F)c(Nc2cncc(Br)c2)cc1Cl ZINC001250021132 1060548787 /nfs/dbraw/zinc/54/87/87/1060548787.db2.gz YLIJUECCQUACPV-UHFFFAOYSA-N -1 1 317.545 4.086 20 0 DIADMM [O-]c1cc(F)c(Nc2ncccc2N2CCCCC2)cc1Cl ZINC001250023736 1060549292 /nfs/dbraw/zinc/54/92/92/1060549292.db2.gz YOGZDCQYZWAEPD-UHFFFAOYSA-N -1 1 321.783 4.314 20 0 DIADMM CCOC(=O)Cc1ccc(Nc2cc(Cl)c([O-])cc2F)cc1 ZINC001250023879 1060550005 /nfs/dbraw/zinc/55/00/05/1060550005.db2.gz GLCGXNWCBXCXPN-UHFFFAOYSA-N -1 1 323.751 4.034 20 0 DIADMM COC(=O)c1cc(Nc2cc(Cl)c([O-])cc2F)ccc1C ZINC001250024126 1060550675 /nfs/dbraw/zinc/55/06/75/1060550675.db2.gz SOJUBZSSZGZZPR-UHFFFAOYSA-N -1 1 309.724 4.023 20 0 DIADMM O=C1CCCc2ccc(Nc3cc(Cl)c([O-])cc3F)cc2N1 ZINC001250024164 1060552750 /nfs/dbraw/zinc/55/27/50/1060552750.db2.gz UQIXRICMYSPTMC-UHFFFAOYSA-N -1 1 320.751 4.203 20 0 DIADMM [O-]c1cc(F)c(Nc2ccc3c(c2)[C@@H](O)CCC3)cc1Cl ZINC001250026958 1060553881 /nfs/dbraw/zinc/55/38/81/1060553881.db2.gz UUNHHVPZPAQAPU-HNNXBMFYSA-N -1 1 307.752 4.298 20 0 DIADMM COc1cc(OC)c(Nc2ccc(F)c(F)c2[O-])cc1Cl ZINC001250098135 1060604534 /nfs/dbraw/zinc/60/45/34/1060604534.db2.gz OJDCQCAORIGSLL-UHFFFAOYSA-N -1 1 315.703 4.085 20 0 DIADMM COc1c(Cl)ccc(F)c1[N-]c1nnc(C(C)(C)C)s1 ZINC001250099166 1060607012 /nfs/dbraw/zinc/60/70/12/1060607012.db2.gz ILVBBUFBRHYTIT-UHFFFAOYSA-N -1 1 315.801 4.380 20 0 DIADMM Cc1cc(Nc2c(F)ccc([O-])c2Cl)n(-c2ccccc2)n1 ZINC001250228336 1060707076 /nfs/dbraw/zinc/70/70/76/1060707076.db2.gz XJWJQVVQWXIQLD-UHFFFAOYSA-N -1 1 317.751 4.422 20 0 DIADMM O=c1cc(C(F)(F)F)[nH]cc1Nc1c(F)ccc([O-])c1Cl ZINC001250228979 1060707120 /nfs/dbraw/zinc/70/71/20/1060707120.db2.gz QZPZRTXYAQJMTP-UHFFFAOYSA-N -1 1 322.645 4.048 20 0 DIADMM [O-]c1ccc(F)c(Nc2nc(-c3ccncc3)cs2)c1Cl ZINC001250228196 1060709268 /nfs/dbraw/zinc/70/92/68/1060709268.db2.gz PSHDKNHSPXYWKV-UHFFFAOYSA-N -1 1 321.764 4.447 20 0 DIADMM CC(C)OC(=O)c1cccc(Nc2c(F)ccc([O-])c2Cl)c1 ZINC001250232136 1060711652 /nfs/dbraw/zinc/71/16/52/1060711652.db2.gz AFTZZMKADGSQPI-UHFFFAOYSA-N -1 1 323.751 4.494 20 0 DIADMM COc1cc(C)c(Nc2c(F)ccc([O-])c2Cl)cc1OC ZINC001250232824 1060712264 /nfs/dbraw/zinc/71/22/64/1060712264.db2.gz GWZYGHJTRXRKRS-UHFFFAOYSA-N -1 1 311.740 4.254 20 0 DIADMM Cc1cc(=O)[nH]c2cc(Nc3c(F)ccc([O-])c3Cl)ccc12 ZINC001250232348 1060712424 /nfs/dbraw/zinc/71/24/24/1060712424.db2.gz KDOTWFHDVKWHQF-UHFFFAOYSA-N -1 1 318.735 4.491 20 0 DIADMM CC(C)c1cc2ncc(Nc3c(F)ccc([O-])c3Cl)cn2n1 ZINC001250234649 1060714119 /nfs/dbraw/zinc/71/41/19/1060714119.db2.gz UJGCNUVQXHNTSH-UHFFFAOYSA-N -1 1 320.755 4.094 20 0 DIADMM C[C@@H]1CCc2cc(N)ccc2N1c1c(F)ccc([O-])c1Cl ZINC001250234245 1060714221 /nfs/dbraw/zinc/71/42/21/1060714221.db2.gz MSBJHRLOGONMDL-SECBINFHSA-N -1 1 306.768 4.240 20 0 DIADMM COC(=O)c1ccc(Nc2c(F)ccc([O-])c2Cl)c(C)c1 ZINC001250233348 1060714654 /nfs/dbraw/zinc/71/46/54/1060714654.db2.gz NFJURNWDRSUSOY-UHFFFAOYSA-N -1 1 309.724 4.023 20 0 DIADMM C[C@H]1CCc2cc(N)ccc2N1c1c(F)ccc([O-])c1Cl ZINC001250234246 1060715029 /nfs/dbraw/zinc/71/50/29/1060715029.db2.gz MSBJHRLOGONMDL-VIFPVBQESA-N -1 1 306.768 4.240 20 0 DIADMM COC(=O)[C@H](C)c1ccc(Nc2c(F)ccc([O-])c2Cl)cc1 ZINC001250236492 1060715886 /nfs/dbraw/zinc/71/58/86/1060715886.db2.gz ROWPRKJHZDKRAH-SECBINFHSA-N -1 1 323.751 4.205 20 0 DIADMM Nc1cc(Cl)cc(F)c1Nc1c(F)ccc([O-])c1Cl ZINC001250236113 1060716126 /nfs/dbraw/zinc/71/61/26/1060716126.db2.gz IUGHSICYRYALJZ-UHFFFAOYSA-N -1 1 305.111 4.303 20 0 DIADMM O=C1CCCc2cccc(Nc3c(F)ccc([O-])c3Cl)c21 ZINC001250235734 1060716357 /nfs/dbraw/zinc/71/63/57/1060716357.db2.gz AIMFLQWXCWZSRV-UHFFFAOYSA-N -1 1 305.736 4.447 20 0 DIADMM [O-]c1ccc(F)c(Nc2ccc3c(c2)[C@@H](O)CCC3)c1Cl ZINC001250236300 1060716742 /nfs/dbraw/zinc/71/67/42/1060716742.db2.gz NIKKOKGMCOPQPQ-ZDUSSCGKSA-N -1 1 307.752 4.298 20 0 DIADMM COc1cc(Nc2c(F)ccc([O-])c2Cl)cc2cccnc21 ZINC001250236476 1060716998 /nfs/dbraw/zinc/71/69/98/1060716998.db2.gz RAOVOTRVVQBYSS-UHFFFAOYSA-N -1 1 318.735 4.485 20 0 DIADMM CO[C@H]1CCOc2c(Nc3c(F)ccc([O-])c3Cl)cccc21 ZINC001250236321 1060717514 /nfs/dbraw/zinc/71/75/14/1060717514.db2.gz OMSHDMQVNYDHQB-ZDUSSCGKSA-N -1 1 323.751 4.398 20 0 DIADMM Cc1c(Nc2c(F)ccc([O-])c2Cl)ccc2c1OCCO2 ZINC001250238192 1060721336 /nfs/dbraw/zinc/72/13/36/1060721336.db2.gz WPXLTROEKZXJDC-UHFFFAOYSA-N -1 1 309.724 4.008 20 0 DIADMM COc1ccc(Nc2c(F)ccc([O-])c2Cl)c(C(C)=O)c1 ZINC001250238240 1060721713 /nfs/dbraw/zinc/72/17/13/1060721713.db2.gz YTXDTHYWGUPGFB-UHFFFAOYSA-N -1 1 309.724 4.140 20 0 DIADMM O=C(Cc1cc(F)cc(F)c1[O-])c1ccc(C(F)(F)F)cc1 ZINC001250239412 1060723572 /nfs/dbraw/zinc/72/35/72/1060723572.db2.gz ZAGOWYCOCBOTIJ-UHFFFAOYSA-N -1 1 316.225 4.115 20 0 DIADMM O=C(Cc1ccc([O-])c(F)c1F)c1ccc(C(F)(F)F)cc1 ZINC001250239237 1060724109 /nfs/dbraw/zinc/72/41/09/1060724109.db2.gz VULIBSUXOMEDRA-UHFFFAOYSA-N -1 1 316.225 4.115 20 0 DIADMM FC(F)(F)c1ccc([S-])c(Nc2ccc3cncn3c2)c1 ZINC001250328792 1060782843 /nfs/dbraw/zinc/78/28/43/1060782843.db2.gz VOILYDBPPOHZJV-UHFFFAOYSA-N -1 1 309.316 4.385 20 0 DIADMM [O-]c1c(F)cccc1-c1nc2cc(F)c(C(F)(F)F)cc2[nH]1 ZINC001250683537 1061015366 /nfs/dbraw/zinc/01/53/66/1061015366.db2.gz KIBHYQYTWPWITM-UHFFFAOYSA-N -1 1 314.213 4.233 20 0 DIADMM [O-]c1cc(Cl)ccc1-c1nc2c([nH]1)c(F)c(F)c(F)c2F ZINC001250871572 1061102785 /nfs/dbraw/zinc/10/27/85/1061102785.db2.gz DBXAGYLBHKCLEJ-UHFFFAOYSA-N -1 1 316.641 4.145 20 0 DIADMM Cc1ccc(F)c2nc(-c3cccc([O-])c3Br)[nH]c21 ZINC001250880031 1061106903 /nfs/dbraw/zinc/10/69/03/1061106903.db2.gz DIJCSHJLROBNIV-UHFFFAOYSA-N -1 1 321.149 4.146 20 0 DIADMM Cc1cc(Cl)c(Cl)c([N-]S(=O)(=O)c2cccs2)c1 ZINC001250931516 1061130985 /nfs/dbraw/zinc/13/09/85/1061130985.db2.gz GWGQTFAOIYWYKT-UHFFFAOYSA-N -1 1 322.238 4.164 20 0 DIADMM CCCCn1c2ccccc2nc1-c1cc(F)c(F)cc1[O-] ZINC001250967582 1061153566 /nfs/dbraw/zinc/15/35/66/1061153566.db2.gz VUADCMLKCRCIOS-UHFFFAOYSA-N -1 1 302.324 4.487 20 0 DIADMM [O-]c1cc(F)c(-c2nc3ccc(F)c(F)c3n2C2CC2)c(F)c1 ZINC001251007337 1061177876 /nfs/dbraw/zinc/17/78/76/1061177876.db2.gz HPFCGIDDNOFWAK-UHFFFAOYSA-N -1 1 322.261 4.300 20 0 DIADMM C[C@@H]1c2sccc2CCN1C(=O)c1ccc2ccccc2c1[O-] ZINC001455293214 1061217208 /nfs/dbraw/zinc/21/72/08/1061217208.db2.gz MLSMTWVCLPYNFE-GFCCVEGCSA-N -1 1 323.417 4.366 20 0 DIADMM C[C@@H]1CCN(C(=O)c2ccc(Cl)cc2[O-])[C@H]1c1ccccc1 ZINC001455647171 1061231928 /nfs/dbraw/zinc/23/19/28/1061231928.db2.gz FFFKWWSTYXSAJH-SJKOYZFVSA-N -1 1 315.800 4.269 20 0 DIADMM C[C@H]1CCN(C(=O)c2ccc(Cl)cc2[O-])[C@H]1c1ccccc1 ZINC001455647175 1061232473 /nfs/dbraw/zinc/23/24/73/1061232473.db2.gz FFFKWWSTYXSAJH-YVEFUNNKSA-N -1 1 315.800 4.269 20 0 DIADMM O=C(N[C@@H]1CCc2c1cccc2F)c1cc2ccccc2cc1[O-] ZINC001455896577 1061238109 /nfs/dbraw/zinc/23/81/09/1061238109.db2.gz SLIDTYUEXLBWAW-GOSISDBHSA-N -1 1 321.351 4.102 20 0 DIADMM Cc1ccc(-c2ccccc2)cc1[N-]S(=O)(=O)c1ccccc1 ZINC001251141456 1061250977 /nfs/dbraw/zinc/25/09/77/1061250977.db2.gz XVWCNQJWFAJCFL-UHFFFAOYSA-N -1 1 323.417 4.463 20 0 DIADMM CN(C)c1ccc2nc(-c3ccc(Cl)c([O-])c3Cl)[nH]c2c1 ZINC001251169041 1061257439 /nfs/dbraw/zinc/25/74/39/1061257439.db2.gz WJYLZBDTTQHBPP-UHFFFAOYSA-N -1 1 322.195 4.308 20 0 DIADMM CCn1c2cc(OC)ccc2nc1-c1cccc([O-])c1Cl ZINC001251203210 1061267867 /nfs/dbraw/zinc/26/78/67/1061267867.db2.gz DXAHPRKURBBTTK-UHFFFAOYSA-N -1 1 302.761 4.091 20 0 DIADMM [O-]c1cc(-c2nc3ccc(-c4ccncc4)cc3[nH]2)cc(F)c1F ZINC001251242662 1061287369 /nfs/dbraw/zinc/28/73/69/1061287369.db2.gz WXLQPQAGLKXVIW-UHFFFAOYSA-N -1 1 323.302 4.276 20 0 DIADMM [O-]c1cnc(Cl)cc1-c1nc2cc(-c3ccncc3)ccc2[nH]1 ZINC001251252444 1061289944 /nfs/dbraw/zinc/28/99/44/1061289944.db2.gz WZYQQNQMKWMWNU-UHFFFAOYSA-N -1 1 322.755 4.046 20 0 DIADMM [O-]c1cnc(Cl)cc1-c1nc2ccc(-c3ccncc3)cc2[nH]1 ZINC001251252444 1061289963 /nfs/dbraw/zinc/28/99/63/1061289963.db2.gz WZYQQNQMKWMWNU-UHFFFAOYSA-N -1 1 322.755 4.046 20 0 DIADMM [O-]c1ccc(F)c(F)c1-c1nc2ccc(F)c(F)c2n1C1CC1 ZINC001251322515 1061313296 /nfs/dbraw/zinc/31/32/96/1061313296.db2.gz XSNUSNFWHOYRMD-UHFFFAOYSA-N -1 1 322.261 4.300 20 0 DIADMM CC(C)(C)n1c2ccccc2nc1-c1c([O-])ccc(F)c1F ZINC001251321983 1061314450 /nfs/dbraw/zinc/31/44/50/1061314450.db2.gz KUKDXAREPSPODE-UHFFFAOYSA-N -1 1 302.324 4.442 20 0 DIADMM [O-]c1ccc(F)c(-c2nc3ccc(F)c(F)c3n2C2CC2)c1F ZINC001251335956 1061320931 /nfs/dbraw/zinc/32/09/31/1061320931.db2.gz VVXFCVSXIZKESC-UHFFFAOYSA-N -1 1 322.261 4.300 20 0 DIADMM Cc1cccc2cc(C(=O)Nc3cc(F)c([O-])cc3Cl)oc21 ZINC001456603837 1061344159 /nfs/dbraw/zinc/34/41/59/1061344159.db2.gz FIINGNCFWLPBRG-UHFFFAOYSA-N -1 1 319.719 4.492 20 0 DIADMM CC(C)CCCCCC[N-]S(=O)(=O)c1ccc(C(F)F)o1 ZINC001462756680 1061351573 /nfs/dbraw/zinc/35/15/73/1061351573.db2.gz NJDKKENAOFXQKK-UHFFFAOYSA-N -1 1 323.405 4.102 20 0 DIADMM Cc1ccc2[nH]c(-c3ccc(Br)c([O-])c3)nc2c1F ZINC001251473679 1061373396 /nfs/dbraw/zinc/37/33/96/1061373396.db2.gz KBEWASAWUGFSKZ-UHFFFAOYSA-N -1 1 321.149 4.146 20 0 DIADMM COc1cc([O-])c(-c2nc3cccc(Cl)c3n2C)c(Cl)c1 ZINC001251491173 1061377453 /nfs/dbraw/zinc/37/74/53/1061377453.db2.gz GDWIYSKUHOGUHX-UHFFFAOYSA-N -1 1 323.179 4.261 20 0 DIADMM CCn1c2ccc(F)cc2nc1-c1c([O-])cc(OC)cc1Cl ZINC001251490916 1061378636 /nfs/dbraw/zinc/37/86/36/1061378636.db2.gz BRFXEXMJYOVQCT-UHFFFAOYSA-N -1 1 320.751 4.230 20 0 DIADMM CCn1c2cc(F)ccc2nc1-c1c([O-])cc(OC)cc1Cl ZINC001251490925 1061378807 /nfs/dbraw/zinc/37/88/07/1061378807.db2.gz BXDUVHPAGNCVNF-UHFFFAOYSA-N -1 1 320.751 4.230 20 0 DIADMM Cn1c2cc(F)ccc2nc1-c1c([O-])ccc(Cl)c1Cl ZINC001251536391 1061394705 /nfs/dbraw/zinc/39/47/05/1061394705.db2.gz GNWRXOUZWFSULJ-UHFFFAOYSA-N -1 1 311.143 4.392 20 0 DIADMM CCOc1cccc2[nH]c(-c3c([O-])ccc(F)c3Cl)nc21 ZINC001251540611 1061397898 /nfs/dbraw/zinc/39/78/98/1061397898.db2.gz IHACTHQTUOUOKM-UHFFFAOYSA-N -1 1 306.724 4.127 20 0 DIADMM Cn1c2ccc(Cl)cc2nc1-c1c([O-])ccc(F)c1Cl ZINC001251540902 1061400312 /nfs/dbraw/zinc/40/03/12/1061400312.db2.gz YWQYKDFASVDLRM-UHFFFAOYSA-N -1 1 311.143 4.392 20 0 DIADMM O=C(c1cccc([O-])c1F)N1CCCCC12CCCCCC2 ZINC001457221066 1061424670 /nfs/dbraw/zinc/42/46/70/1061424670.db2.gz KBTVRYPJTKIMLM-UHFFFAOYSA-N -1 1 305.393 4.250 20 0 DIADMM Cn1c2ccc(Cl)cc2nc1-c1cc(F)c(Cl)cc1[O-] ZINC001251680448 1061440676 /nfs/dbraw/zinc/44/06/76/1061440676.db2.gz DBPMFTLHNHWUNN-UHFFFAOYSA-N -1 1 311.143 4.392 20 0 DIADMM [O-]c1c(F)cc(-c2nc3c([nH]2)c(F)c(F)cc3F)cc1Cl ZINC001251692887 1061445594 /nfs/dbraw/zinc/44/55/94/1061445594.db2.gz VXWKJKIKZCTSRX-UHFFFAOYSA-N -1 1 316.641 4.145 20 0 DIADMM O=C([O-])c1cc(F)ccc1-c1nc2ccc(C(F)F)cc2[nH]1 ZINC001251726505 1061459278 /nfs/dbraw/zinc/45/92/78/1061459278.db2.gz KGOXYUHIKGKTRH-UHFFFAOYSA-N -1 1 306.243 4.005 20 0 DIADMM O=S(=O)([N-]c1cccc(C2CC2)c1)c1ccc(Cl)cc1 ZINC001251738063 1061464403 /nfs/dbraw/zinc/46/44/03/1061464403.db2.gz ABIFCBHUKSBSQB-UHFFFAOYSA-N -1 1 307.802 4.018 20 0 DIADMM CC[C@H](C)CN(CC)C(=O)c1c([O-])cnc2ccc(Cl)cc21 ZINC001457679248 1061483726 /nfs/dbraw/zinc/48/37/26/1061483726.db2.gz CRJCHVXGVJOEIK-NSHDSACASA-N -1 1 320.820 4.102 20 0 DIADMM C/C(=C/c1cccc(Cl)c1)C(=O)Nc1ccc(F)cc1[O-] ZINC001457716164 1061487424 /nfs/dbraw/zinc/48/74/24/1061487424.db2.gz PMNDSCFQUIALOJ-YFHOEESVSA-N -1 1 305.736 4.227 20 0 DIADMM CC(C)c1ccc(C(=O)Nc2cc(C(F)(F)F)ccn2)c([O-])c1 ZINC001457744791 1061495218 /nfs/dbraw/zinc/49/52/18/1061495218.db2.gz OACDYEKKQXISNV-UHFFFAOYSA-N -1 1 324.302 4.182 20 0 DIADMM CC(C)CCn1nccc1NC(=O)c1cc2ccccc2cc1[O-] ZINC001463796211 1061521159 /nfs/dbraw/zinc/52/11/59/1061521159.db2.gz QACVXSDNYVIXTG-UHFFFAOYSA-N -1 1 323.396 4.040 20 0 DIADMM CCc1ccc([C@@H](NC(=O)c2ccc(F)c([O-])c2)C(C)C)cc1 ZINC001463888150 1061529908 /nfs/dbraw/zinc/52/99/08/1061529908.db2.gz IEKSGDAKJWVITJ-SFHVURJKSA-N -1 1 315.388 4.221 20 0 DIADMM CSc1ccccc1[N-]C(=O)c1snc(Cl)c1Cl ZINC001463897352 1061532849 /nfs/dbraw/zinc/53/28/49/1061532849.db2.gz STLPTYDYYCVUPH-UHFFFAOYSA-N -1 1 319.238 4.424 20 0 DIADMM CCN(Cc1ccccc1F)C(=O)c1ccc2ccccc2c1[O-] ZINC001464076043 1061554987 /nfs/dbraw/zinc/55/49/87/1061554987.db2.gz ZDDXBIOUDWPJKD-UHFFFAOYSA-N -1 1 323.367 4.347 20 0 DIADMM CC1(C)CN(C(=O)c2c([O-])cccc2Cl)[C@H]1c1ccccc1 ZINC001464466391 1061597602 /nfs/dbraw/zinc/59/76/02/1061597602.db2.gz KYGZZUXWMMEFSE-INIZCTEOSA-N -1 1 315.800 4.269 20 0 DIADMM [O-]c1c2ccccc2cc(O)c1-c1nnc(-c2ccc(F)cc2)o1 ZINC001252178976 1061602278 /nfs/dbraw/zinc/60/22/78/1061602278.db2.gz COFLKIMDDINCGW-UHFFFAOYSA-N -1 1 322.295 4.107 20 0 DIADMM Cc1ccc(S(=O)(=O)[N-]c2ccc(-c3ccco3)cc2)cc1 ZINC001252178821 1061603306 /nfs/dbraw/zinc/60/33/06/1061603306.db2.gz YJFPKSSCEPZZLI-UHFFFAOYSA-N -1 1 313.378 4.056 20 0 DIADMM CC(C)[C@@H](NC(=O)c1cc(F)ccc1[O-])c1ccccc1Cl ZINC001465140355 1061689920 /nfs/dbraw/zinc/68/99/20/1061689920.db2.gz HJZSWWLXKGUXSQ-MRXNPFEDSA-N -1 1 321.779 4.312 20 0 DIADMM CC(C)(C)[C@@H]1CCCN(C(=O)Cc2ccc([O-])c(Cl)c2)CC1 ZINC001465143718 1061690028 /nfs/dbraw/zinc/69/00/28/1061690028.db2.gz SZXWSJAAWYYIFL-CQSZACIVSA-N -1 1 323.864 4.263 20 0 DIADMM [O-]c1c(-c2nnc(-c3ccc(Cl)cc3)o2)ccc2cccnc21 ZINC001252714647 1061698119 /nfs/dbraw/zinc/69/81/19/1061698119.db2.gz AYXFQSVXWUDVKV-UHFFFAOYSA-N -1 1 323.739 4.311 20 0 DIADMM [O-]c1ccc(OC(F)(F)F)cc1-c1nnc(-c2ccccc2)o1 ZINC001253138359 1061821973 /nfs/dbraw/zinc/82/19/73/1061821973.db2.gz SKTCJYZUKNQOPQ-UHFFFAOYSA-N -1 1 322.242 4.008 20 0 DIADMM [O-]c1ccc(C(F)(F)F)cc1-c1nnc(-c2ccccc2)o1 ZINC001253131475 1061823255 /nfs/dbraw/zinc/82/32/55/1061823255.db2.gz TWZPKCURGIPKDH-UHFFFAOYSA-N -1 1 306.243 4.128 20 0 DIADMM O=C(Nc1ccc([O-])c(Cl)c1)c1cccc2cccc(O)c21 ZINC001466225520 1061900957 /nfs/dbraw/zinc/90/09/57/1061900957.db2.gz IVJWIIPCRGTELQ-UHFFFAOYSA-N -1 1 313.740 4.157 20 0 DIADMM O=C(Nc1ccc(O)c(Cl)c1)c1cc2ccccc2cc1[O-] ZINC001466225009 1061901093 /nfs/dbraw/zinc/90/10/93/1061901093.db2.gz OSLRWGUHOAZBNO-UHFFFAOYSA-N -1 1 313.740 4.157 20 0 DIADMM CCCc1cnc(NC(=O)c2cc3ccccc3cc2[O-])s1 ZINC001466458213 1061944383 /nfs/dbraw/zinc/94/43/83/1061944383.db2.gz AKKNDZHYBIGBQN-UHFFFAOYSA-N -1 1 312.394 4.207 20 0 DIADMM CC(C)(C)[C@H]1CCC[C@@H](NC(=O)c2cccc([O-])c2F)CC1 ZINC001466945412 1062031373 /nfs/dbraw/zinc/03/13/73/1062031373.db2.gz RSUJNZQTBWNYRM-QWHCGFSZSA-N -1 1 307.409 4.256 20 0 DIADMM O=c1cc(-c2ccccc2)nc(SCC[C@@H]2C[C@H]2C2CC2)[n-]1 ZINC001459284513 1062068823 /nfs/dbraw/zinc/06/88/23/1062068823.db2.gz WMVCQKYVNFQDRB-CABCVRRESA-N -1 1 312.438 4.378 20 0 DIADMM [O-]c1cccc(-c2nnc(Cc3ccc(Cl)cc3)o2)c1Cl ZINC001254313719 1062075076 /nfs/dbraw/zinc/07/50/76/1062075076.db2.gz XOAAIRRFGGKJDH-UHFFFAOYSA-N -1 1 321.163 4.340 20 0 DIADMM CCCCc1ccccc1[N-]S(=O)(=O)c1ccccc1C ZINC001254611585 1062198931 /nfs/dbraw/zinc/19/89/31/1062198931.db2.gz QJIOAAOYJUTRPQ-UHFFFAOYSA-N -1 1 303.427 4.138 20 0 DIADMM Cc1ccc(C)c(S(=O)(=O)[N-]c2cc3cccccc-3c2)c1 ZINC001254718366 1062237963 /nfs/dbraw/zinc/23/79/63/1062237963.db2.gz WXMFYUFSKBIOSZ-UHFFFAOYSA-N -1 1 311.406 4.209 20 0 DIADMM C[C@@H](CCc1cccc(F)c1)C(=O)Nc1ccc([O-])c(F)c1F ZINC001468003959 1062246681 /nfs/dbraw/zinc/24/66/81/1062246681.db2.gz SYGJJZQDBRLHIZ-JTQLQIEISA-N -1 1 323.314 4.017 20 0 DIADMM Cc1ccc2sc(C(=O)Nc3ccc([O-])c(F)c3F)cc2c1 ZINC001468003593 1062247097 /nfs/dbraw/zinc/24/70/97/1062247097.db2.gz NAXJLUTZKMSNMG-UHFFFAOYSA-N -1 1 319.332 4.446 20 0 DIADMM C[C@H](CCc1ccc(F)cc1)C(=O)Nc1ccc([O-])c(F)c1F ZINC001468003530 1062247624 /nfs/dbraw/zinc/24/76/24/1062247624.db2.gz LJZXGALYCSBVDE-SNVBAGLBSA-N -1 1 323.314 4.017 20 0 DIADMM Cc1ccc(C)c(S(=O)(=O)[N-]c2cc(C)cc(Cl)c2)c1 ZINC001254785957 1062249704 /nfs/dbraw/zinc/24/97/04/1062249704.db2.gz AOWKCQDNQANALA-UHFFFAOYSA-N -1 1 309.818 4.066 20 0 DIADMM CCCCN(C(=O)c1ccc([O-])cc1F)[C@H]1CCC[C@H](C)C1 ZINC001468504016 1062336548 /nfs/dbraw/zinc/33/65/48/1062336548.db2.gz KHPQTUMRQUNHCA-KBPBESRZSA-N -1 1 307.409 4.352 20 0 DIADMM Cc1nc(NC(=O)c2ccc(F)c([O-])c2)ccc1-c1ccccc1 ZINC001468573134 1062349847 /nfs/dbraw/zinc/34/98/47/1062349847.db2.gz CHGPDPJOJPJESM-UHFFFAOYSA-N -1 1 322.339 4.154 20 0 DIADMM CCCc1ccc(S(=O)(=O)[N-]c2cccc3occc32)cc1 ZINC001255223450 1062360321 /nfs/dbraw/zinc/36/03/21/1062360321.db2.gz VKZWAWHEDUJOCC-UHFFFAOYSA-N -1 1 315.394 4.186 20 0 DIADMM Cc1cc(NC(=O)c2ccc([O-])cn2)ccc1-c1ccccc1 ZINC001468659573 1062372930 /nfs/dbraw/zinc/37/29/30/1062372930.db2.gz QBPHZPMVNSFSEG-UHFFFAOYSA-N -1 1 304.349 4.015 20 0 DIADMM CC[C@H](C)Oc1ccc(C(=O)Nc2cc([O-])c(F)cc2F)cc1 ZINC001468747189 1062393026 /nfs/dbraw/zinc/39/30/26/1062393026.db2.gz DKHGQKFSRVPPBL-JTQLQIEISA-N -1 1 321.323 4.100 20 0 DIADMM Cc1cc(Cl)ccc1-c1nnc(-c2cc([O-])cc(F)c2F)o1 ZINC001255356056 1062415490 /nfs/dbraw/zinc/41/54/90/1062415490.db2.gz QGNZFYNVQVQMNG-UHFFFAOYSA-N -1 1 322.698 4.349 20 0 DIADMM CC(C)(C)C[C@H]1CCN(C(=O)c2cccc([O-])c2F)C1(C)C ZINC001468926867 1062439083 /nfs/dbraw/zinc/43/90/83/1062439083.db2.gz DHSYEHUFNFRXSS-GFCCVEGCSA-N -1 1 307.409 4.208 20 0 DIADMM CC(C)[C@H]1N(C(=O)c2cc(Cl)ccc2[O-])CC12CCCC2 ZINC001468968718 1062452633 /nfs/dbraw/zinc/45/26/33/1062452633.db2.gz DREBTGGEJAQEQM-OAHLLOKOSA-N -1 1 307.821 4.086 20 0 DIADMM C[C@@H](CCCc1ccccc1)C(=O)Nc1cc(F)cc(F)c1[O-] ZINC001469161884 1062491996 /nfs/dbraw/zinc/49/19/96/1062491996.db2.gz RNOHWUJZGFRZMM-LBPRGKRZSA-N -1 1 319.351 4.268 20 0 DIADMM Cc1ccc(C(C)C)cc1[N-]S(=O)(=O)c1cccc(F)c1 ZINC001255647446 1062499354 /nfs/dbraw/zinc/49/93/54/1062499354.db2.gz GHUPDPLRJZBPFS-UHFFFAOYSA-N -1 1 307.390 4.058 20 0 DIADMM CC1(C)C[C@@H](c2ccccc2)N(C(=O)c2ccc(F)c([O-])c2)C1 ZINC001469279047 1062517484 /nfs/dbraw/zinc/51/74/84/1062517484.db2.gz JACZRDBGWBKTFT-INIZCTEOSA-N -1 1 313.372 4.145 20 0 DIADMM C/C=C(/C=C\C(=O)Nc1cc(C)cc(Br)c1[O-])CC ZINC001546177409 1062651681 /nfs/dbraw/zinc/65/16/81/1062651681.db2.gz ZHNYAUXVRYLTNA-BJNIYONUSA-N -1 1 324.218 4.314 20 0 DIADMM COc1ccc(-c2nnc(-c3ccc4ccccc4c3)o2)c([O-])c1 ZINC001255983077 1062676564 /nfs/dbraw/zinc/67/65/64/1062676564.db2.gz MEJSLFGPQOJVJQ-UHFFFAOYSA-N -1 1 318.332 4.271 20 0 DIADMM O=C(NCCCCCCc1ccccc1)c1ccc(F)c([O-])c1 ZINC001470168486 1062714983 /nfs/dbraw/zinc/71/49/83/1062714983.db2.gz DSOBBMYIKMQSHT-UHFFFAOYSA-N -1 1 315.388 4.064 20 0 DIADMM O=C(c1ccc2ccccc2c1[O-])N1CCC[C@H](C2CCC2)C1 ZINC001470264862 1062735275 /nfs/dbraw/zinc/73/52/75/1062735275.db2.gz LJEVOGQYNPCUAS-INIZCTEOSA-N -1 1 309.409 4.198 20 0 DIADMM O=C([N-]c1ccccc1SC(F)F)c1ncc(Cl)s1 ZINC001256285818 1062760605 /nfs/dbraw/zinc/76/06/05/1062760605.db2.gz LASOGVWPXPRIHS-UHFFFAOYSA-N -1 1 320.773 4.364 20 0 DIADMM CCCCCCc1nnc(-c2ccc3ccc(C)nc3c2[O-])o1 ZINC001256330741 1062776645 /nfs/dbraw/zinc/77/66/45/1062776645.db2.gz RQQMKKVOZQYBFH-UHFFFAOYSA-N -1 1 311.385 4.422 20 0 DIADMM CC1(C)CN(C(=O)c2ccc(F)c([O-])c2)c2ccc(Cl)cc21 ZINC001470979225 1062901305 /nfs/dbraw/zinc/90/13/05/1062901305.db2.gz MYRDMVVQGDMYAD-UHFFFAOYSA-N -1 1 319.763 4.123 20 0 DIADMM Cc1c(C(=O)Nc2cccc(F)c2[O-])sc2nccc(C)c12 ZINC001471167079 1062932297 /nfs/dbraw/zinc/93/22/97/1062932297.db2.gz XZMTUJUFBHRWFA-UHFFFAOYSA-N -1 1 316.357 4.010 20 0 DIADMM O=C(Nc1cccc(F)c1[O-])[C@H]1C[C@H]1c1ccc2ccccc2c1 ZINC001471166846 1062932423 /nfs/dbraw/zinc/93/24/23/1062932423.db2.gz SOYRPXBIJPPVSQ-HOTGVXAUSA-N -1 1 321.351 4.427 20 0 DIADMM Cc1cc(NC(=O)c2cc3ccccc3cc2[O-])cc(O)c1C ZINC001471603985 1063008767 /nfs/dbraw/zinc/00/87/67/1063008767.db2.gz BWTHRWKZUZCWAK-UHFFFAOYSA-N -1 1 307.349 4.120 20 0 DIADMM C[C@H]1CCCC[C@H]1CCNC(=O)NCc1ccc([O-])c(Cl)c1 ZINC001477900889 1063015460 /nfs/dbraw/zinc/01/54/60/1063015460.db2.gz XIWGWZWIVSZOQY-JSGCOSHPSA-N -1 1 324.852 4.061 20 0 DIADMM CC1(C)CCC(CC(=O)NCc2ccc([O-])c(Cl)c2)CC1 ZINC001471699610 1063016100 /nfs/dbraw/zinc/01/61/00/1063016100.db2.gz KXWZWOXLBODSTB-UHFFFAOYSA-N -1 1 309.837 4.268 20 0 DIADMM O=C(Nc1cc(F)c([O-])cc1Cl)c1ccc(Cl)s1 ZINC001472193324 1063057879 /nfs/dbraw/zinc/05/78/79/1063057879.db2.gz VOGKGXWCAOAIQK-UHFFFAOYSA-N -1 1 306.145 4.152 20 0 DIADMM Cc1cccc(S(=O)(=O)[N-]c2ccc(F)cc2C(C)C)c1 ZINC001256946228 1063058666 /nfs/dbraw/zinc/05/86/66/1063058666.db2.gz NPHSYRYWSJQTGN-UHFFFAOYSA-N -1 1 307.390 4.058 20 0 DIADMM [O-]c1ccc(Cc2nnc(CC3CCCCC3)o2)cc1Cl ZINC001256999777 1063072357 /nfs/dbraw/zinc/07/23/57/1063072357.db2.gz BFZWIOFLMCQFOP-UHFFFAOYSA-N -1 1 306.793 4.142 20 0 DIADMM [O-]c1c2ccccc2cc(O)c1-c1nnc(CC2CCCCC2)o1 ZINC001257008012 1063075503 /nfs/dbraw/zinc/07/55/03/1063075503.db2.gz GOIARBQMDSZAPV-UHFFFAOYSA-N -1 1 324.380 4.424 20 0 DIADMM Cc1cccc2c1[C@H](C)C[C@@H]2CC(=O)Nc1ccc(F)cc1[O-] ZINC001472534323 1063096352 /nfs/dbraw/zinc/09/63/52/1063096352.db2.gz IWNJKOSXJUCJPV-CHWSQXEVSA-N -1 1 313.372 4.459 20 0 DIADMM Cc1ccc([C@H]2C[C@@H]2c2nnc(-c3ccc(F)c([O-])c3)o2)cc1 ZINC001257323819 1063207007 /nfs/dbraw/zinc/20/70/07/1063207007.db2.gz JGWLXRMLXWVXHJ-KGLIPLIRSA-N -1 1 310.328 4.161 20 0 DIADMM Cc1ccc([C@H]2C[C@@H]2c2nnc(-c3cccc([O-])c3F)o2)cc1 ZINC001257325488 1063211005 /nfs/dbraw/zinc/21/10/05/1063211005.db2.gz RUNIHZZJPSLKOE-KGLIPLIRSA-N -1 1 310.328 4.161 20 0 DIADMM CCCc1cc(=O)[n-]c(SCc2cc(Cl)ccc2F)n1 ZINC001472925789 1063317550 /nfs/dbraw/zinc/31/75/50/1063317550.db2.gz ZJALJSKNAOJQNN-UHFFFAOYSA-N -1 1 312.797 4.220 20 0 DIADMM CCCCCC(CCCCC)[NH2+]CCCC[P@](=O)([O-])O ZINC001257549906 1063329578 /nfs/dbraw/zinc/32/95/78/1063329578.db2.gz GTATZRXEESMSEA-UHFFFAOYSA-N -1 1 307.415 4.063 20 0 DIADMM Cc1c(Cl)cccc1S(=O)(=O)[N-]c1ccc2occc2c1 ZINC001257620762 1063352946 /nfs/dbraw/zinc/35/29/46/1063352946.db2.gz COTXAGBVQKOWKN-UHFFFAOYSA-N -1 1 321.785 4.195 20 0 DIADMM Cc1cnc(SCc2c(Cl)cccc2Cl)[n-]c1=O ZINC001473035898 1063368899 /nfs/dbraw/zinc/36/88/99/1063368899.db2.gz NVCFYMYVPYFBRW-UHFFFAOYSA-N -1 1 301.198 4.090 20 0 DIADMM C[C@@H]1CCC[C@H](CCSc2nc(C(F)F)cc(=O)[n-]2)C1 ZINC001473041080 1063369930 /nfs/dbraw/zinc/36/99/30/1063369930.db2.gz MILXMTXNEMWHJO-NXEZZACHSA-N -1 1 302.390 4.428 20 0 DIADMM [O-]c1ccc(-c2nnc(CCCc3ccccc3)o2)c(Cl)c1 ZINC001257747325 1063379841 /nfs/dbraw/zinc/37/98/41/1063379841.db2.gz QCGBTHMVGYWEHL-UHFFFAOYSA-N -1 1 314.772 4.271 20 0 DIADMM CC(C)(C)Cc1nnc(-c2ccc(C(F)(F)F)cc2[O-])o1 ZINC001257838814 1063403538 /nfs/dbraw/zinc/40/35/38/1063403538.db2.gz CFJNRLHREMXFDK-UHFFFAOYSA-N -1 1 300.280 4.050 20 0 DIADMM Cc1ccc(S(=O)(=O)[N-]c2ccccc2C(F)F)c(C)c1 ZINC001259100300 1063882980 /nfs/dbraw/zinc/88/29/80/1063882980.db2.gz OKCPWNUXHDJDEN-UHFFFAOYSA-N -1 1 311.353 4.042 20 0 DIADMM Cc1ccc(S(=O)(=O)[N-]c2ccc3sccc3c2)cc1C ZINC001259168308 1063885052 /nfs/dbraw/zinc/88/50/52/1063885052.db2.gz XQUQRVPETNXGDY-UHFFFAOYSA-N -1 1 317.435 4.319 20 0 DIADMM Cc1cccc([N-]S(=O)(=O)c2cccc(-c3ccccc3)c2)c1 ZINC001259226465 1063885257 /nfs/dbraw/zinc/88/52/57/1063885257.db2.gz VJAKYPVBQFDHDW-UHFFFAOYSA-N -1 1 323.417 4.463 20 0 DIADMM CCc1ccc(C(=O)Nc2cc(F)cc(F)c2[O-])cc1CC ZINC001299581061 1063888250 /nfs/dbraw/zinc/88/82/50/1063888250.db2.gz MOJXAQAVDNGBQM-UHFFFAOYSA-N -1 1 305.324 4.048 20 0 DIADMM Cc1cc(C)cc(S(=O)(=O)[N-]c2ccccc2C(C)C)c1 ZINC001259516447 1063889397 /nfs/dbraw/zinc/88/93/97/1063889397.db2.gz QJXHDZULADUQID-UHFFFAOYSA-N -1 1 303.427 4.228 20 0 DIADMM Cc1cc(C)cc(S(=O)(=O)[N-]c2ccc3sccc3c2)c1 ZINC001259524320 1063889494 /nfs/dbraw/zinc/88/94/94/1063889494.db2.gz MVKHTFZZADSCIU-UHFFFAOYSA-N -1 1 317.435 4.319 20 0 DIADMM Cc1ccc(S(=O)(=O)[N-]c2ccccc2C(C)(C)C)cc1F ZINC001259480398 1063889538 /nfs/dbraw/zinc/88/95/38/1063889538.db2.gz DDEZXJCEVQLLCO-UHFFFAOYSA-N -1 1 321.417 4.232 20 0 DIADMM Cc1cc(C)cc(S(=O)(=O)[N-]c2cc(Cl)ccc2C)c1 ZINC001259521982 1063889595 /nfs/dbraw/zinc/88/95/95/1063889595.db2.gz BVQOZHXUPZPMDD-UHFFFAOYSA-N -1 1 309.818 4.066 20 0 DIADMM Cc1cc(F)ccc1S(=O)(=O)[N-]c1cccc2sccc21 ZINC001259491270 1063890296 /nfs/dbraw/zinc/89/02/96/1063890296.db2.gz RJDFWNACBDNSRU-UHFFFAOYSA-N -1 1 321.398 4.150 20 0 DIADMM Cc1ccc(S(=O)(=O)[N-]c2c(F)cccc2C(C)C)s1 ZINC001260685810 1063901077 /nfs/dbraw/zinc/90/10/77/1063901077.db2.gz PHCJNJCBMBMAMA-UHFFFAOYSA-N -1 1 313.419 4.120 20 0 DIADMM Cc1cccc(S(=O)(=O)[N-]c2ccccc2C(C)(C)C)c1C ZINC001260999220 1063908247 /nfs/dbraw/zinc/90/82/47/1063908247.db2.gz POWIFRKRKZAOEH-UHFFFAOYSA-N -1 1 317.454 4.402 20 0 DIADMM Cc1cc2cc([N-]S(=O)(=O)c3cccc(C)c3C)ccc2o1 ZINC001260997954 1063908373 /nfs/dbraw/zinc/90/83/73/1063908373.db2.gz BDRXVELLAIKXOI-UHFFFAOYSA-N -1 1 315.394 4.159 20 0 DIADMM CC(C)c1cccc(NC(=O)Cc2ccc([O-])c(Cl)c2)c1 ZINC001290044157 1064676809 /nfs/dbraw/zinc/67/68/09/1064676809.db2.gz ZAZYLPBAPQHVRT-UHFFFAOYSA-N -1 1 303.789 4.350 20 0 DIADMM CC(C)c1ccc(C(=O)Nc2nc3ccccc3s2)c([O-])c1 ZINC001290282394 1064688386 /nfs/dbraw/zinc/68/83/86/1064688386.db2.gz HCAQYFHRWXPPFU-UHFFFAOYSA-N -1 1 312.394 4.378 20 0 DIADMM CCC[C@@H](NC(=O)c1c([O-])cccc1Cl)c1ccccc1 ZINC001290533804 1064697757 /nfs/dbraw/zinc/69/77/57/1064697757.db2.gz QMWULFBLBZWBQC-CQSZACIVSA-N -1 1 303.789 4.317 20 0 DIADMM Cc1cccc([C@@H]2CCCN2C(=O)c2cc(Cl)ccc2[O-])c1 ZINC001291955213 1064750328 /nfs/dbraw/zinc/75/03/28/1064750328.db2.gz NLYHMCMMYPMITC-INIZCTEOSA-N -1 1 315.800 4.331 20 0 DIADMM C[C@@H](NC(=O)c1c([O-])cccc1Cl)C(C)(C)c1ccccc1 ZINC001292725176 1064784724 /nfs/dbraw/zinc/78/47/24/1064784724.db2.gz RJHXNYAQPGKDJF-GFCCVEGCSA-N -1 1 317.816 4.142 20 0 DIADMM CC(C)CCC1CCN(C(=O)c2ccc(Cl)cc2[O-])CC1 ZINC001294832169 1064887055 /nfs/dbraw/zinc/88/70/55/1064887055.db2.gz FDWDEXSSALXBMN-UHFFFAOYSA-N -1 1 309.837 4.334 20 0 DIADMM O=C(CCCC(=O)c1ccccc1)Nc1ccc([O-])c(Cl)c1 ZINC001295296453 1064909168 /nfs/dbraw/zinc/90/91/68/1064909168.db2.gz XGVHTHQMLALJDP-UHFFFAOYSA-N -1 1 317.772 4.037 20 0 DIADMM O=C(Nc1ccccc1Nc1ccccc1)c1ccccc1[O-] ZINC001295419269 1064911155 /nfs/dbraw/zinc/91/11/55/1064911155.db2.gz LXPYURGLRQWTSF-UHFFFAOYSA-N -1 1 304.349 4.388 20 0 DIADMM CC(C)(C)[C@@H]1CCC[C@H](NC(=O)c2ccc([O-])c(F)c2)CC1 ZINC001296516014 1064949731 /nfs/dbraw/zinc/94/97/31/1064949731.db2.gz SMHMHIZZHODIRU-KGLIPLIRSA-N -1 1 307.409 4.256 20 0 DIADMM CC(C)(C)[C@H]1CCC[C@@H](NC(=O)c2ccc([O-])c(F)c2)CC1 ZINC001296516015 1064951026 /nfs/dbraw/zinc/95/10/26/1064951026.db2.gz SMHMHIZZHODIRU-UONOGXRCSA-N -1 1 307.409 4.256 20 0 DIADMM CC(C)[C@@H](NC(=O)c1cc(Cl)ccc1[O-])c1ccc(F)cc1 ZINC001296999240 1064967874 /nfs/dbraw/zinc/96/78/74/1064967874.db2.gz RQXCLDYLNLINSK-MRXNPFEDSA-N -1 1 321.779 4.312 20 0 DIADMM CC/C=C(\F)C(=O)Nc1c([O-])cc(Br)cc1Cl ZINC001297577208 1064984743 /nfs/dbraw/zinc/98/47/43/1064984743.db2.gz VAUMKYCAGZWLSB-BAQGIRSFSA-N -1 1 322.561 4.010 20 0 DIADMM O=C(Nc1ccc([O-])c(F)c1F)c1cc2sccc2s1 ZINC001297821449 1064991839 /nfs/dbraw/zinc/99/18/39/1064991839.db2.gz UOQAYDBTRWKMPZ-UHFFFAOYSA-N -1 1 311.334 4.199 20 0 DIADMM CC(C)CCCCC(=O)Nc1cccc([O-])c1Br ZINC001298219528 1064999956 /nfs/dbraw/zinc/99/99/56/1064999956.db2.gz GBOYMEZYUJTRND-UHFFFAOYSA-N -1 1 314.223 4.310 20 0 DIADMM C=Cc1ccc(CCNC(=O)c2ccc3ccccc3c2[O-])cc1 ZINC001298320881 1065003224 /nfs/dbraw/zinc/00/32/24/1065003224.db2.gz KOFVNDLOZYEGBG-UHFFFAOYSA-N -1 1 317.388 4.161 20 0 DIADMM O=C(Nc1cc(Cl)c([O-])c2ccccc12)c1ccccc1O ZINC001301155527 1065053791 /nfs/dbraw/zinc/05/37/91/1065053791.db2.gz AJPCLVPIUGVFBG-UHFFFAOYSA-N -1 1 313.740 4.157 20 0 DIADMM Cc1ncc(C(=O)Nc2cc(Cl)c([O-])c3ccccc23)s1 ZINC001301159248 1065053861 /nfs/dbraw/zinc/05/38/61/1065053861.db2.gz OZQKEVCVFXHUCY-UHFFFAOYSA-N -1 1 318.785 4.216 20 0 DIADMM CC(C)[C@@H]1C[C@H](NC(=O)c2c([O-])cccc2F)c2ccccc21 ZINC001302319051 1065085610 /nfs/dbraw/zinc/08/56/10/1065085610.db2.gz GDAFRHCDNOKOMD-HOCLYGCPSA-N -1 1 313.372 4.146 20 0 DIADMM CCCc1sc(C(=O)Nc2cccc(F)c2[O-])cc1CC ZINC001302482115 1065088027 /nfs/dbraw/zinc/08/80/27/1065088027.db2.gz SODZJEYTASFHGP-UHFFFAOYSA-N -1 1 307.390 4.360 20 0 DIADMM C/C(=C/c1ccccc1Cl)C(=O)Nc1cccc(F)c1[O-] ZINC001302487780 1065089381 /nfs/dbraw/zinc/08/93/81/1065089381.db2.gz YEXNBHIPIQOAQD-KTKRTIGZSA-N -1 1 305.736 4.227 20 0 DIADMM C[C@H](CC(=O)Nc1cccc(F)c1[O-])c1c[nH]c2ccccc21 ZINC001302485685 1065089581 /nfs/dbraw/zinc/08/95/81/1065089581.db2.gz KDLLKAQWKSDBKN-LLVKDONJSA-N -1 1 312.344 4.145 20 0 DIADMM O=C(NCc1ccc([O-])c(Cl)c1)c1cc2sccc2s1 ZINC001303297054 1065111452 /nfs/dbraw/zinc/11/14/52/1065111452.db2.gz QRUOKZOHFPUDEH-UHFFFAOYSA-N -1 1 323.826 4.252 20 0 DIADMM CC(C)[C@@H](C(=O)NCc1ccc([O-])c(Cl)c1)c1ccccc1 ZINC001303298690 1065113669 /nfs/dbraw/zinc/11/36/69/1065113669.db2.gz HTKSACCEFZMWLH-QGZVFWFLSA-N -1 1 317.816 4.102 20 0 DIADMM Cc1nc(SCc2ccc(CC(C)C)cc2)[n-]c(=O)c1C ZINC001307323629 1065341609 /nfs/dbraw/zinc/34/16/09/1065341609.db2.gz YJOOJPMRIMCCFR-UHFFFAOYSA-N -1 1 302.443 4.290 20 0 DIADMM CCc1cc(=O)[n-]c(SC[C@@H]2CC[C@@H](c3ccccc3)C2)n1 ZINC001307332038 1065344193 /nfs/dbraw/zinc/34/41/93/1065344193.db2.gz FZZPPEBDNCOALB-UKRRQHHQSA-N -1 1 314.454 4.421 20 0 DIADMM C[C@H]1C[C@H](c2ccccc2F)N(Cc2ccc([O-])c(F)c2F)C1 ZINC001308573638 1066085894 /nfs/dbraw/zinc/08/58/94/1066085894.db2.gz PUKYYWPIJGGMNN-XHDPSFHLSA-N -1 1 321.342 4.393 20 0 DIADMM C[C@H]1C[C@@H](c2ccccc2F)N(Cc2ccc([O-])c(F)c2F)C1 ZINC001308573637 1066087603 /nfs/dbraw/zinc/08/76/03/1066087603.db2.gz PUKYYWPIJGGMNN-NHYWBVRUSA-N -1 1 321.342 4.393 20 0 DIADMM COc1cc(NCc2ccc([O-])c(F)c2F)ccc1OC(C)C ZINC001308670151 1066147128 /nfs/dbraw/zinc/14/71/28/1066147128.db2.gz RWIAJACPKMJNMQ-UHFFFAOYSA-N -1 1 323.339 4.078 20 0 DIADMM CCCCCC[C@@H](C)[N-]S(=O)(=O)c1cc(Cl)ccc1F ZINC001309037166 1066440286 /nfs/dbraw/zinc/44/02/86/1066440286.db2.gz NLFJEVDKHNJUCV-LLVKDONJSA-N -1 1 321.845 4.116 20 0 DIADMM C[C@H](NC(=O)NCc1ccc([O-])c(Cl)c1)[C@@H]1CCC[C@@H](C)C1 ZINC001312872104 1066875568 /nfs/dbraw/zinc/87/55/68/1066875568.db2.gz FIEVYYVMBZMBJT-MBNYWOFBSA-N -1 1 324.852 4.060 20 0 DIADMM Cc1c(=O)[n-]c(SC2CCCCC2)nc1-c1ccccc1 ZINC000005891053 181293662 /nfs/dbraw/zinc/29/36/62/181293662.db2.gz HJVJBDUTFKNEIZ-UHFFFAOYSA-N -1 1 300.427 4.170 20 0 DIADMM O=C([O-])CC[C@H](NCc1ccsc1Cl)c1ccccc1 ZINC000417599317 335004913 /nfs/dbraw/zinc/00/49/13/335004913.db2.gz HJPZPGIHGHTBBK-ZDUSSCGKSA-N -1 1 309.818 4.097 20 0 DIADMM Cc1ccc(Oc2ccccc2NC(=O)c2cncc([O-])c2)cc1 ZINC000391602331 335021505 /nfs/dbraw/zinc/02/15/05/335021505.db2.gz GXBGAILDTFVJPC-UHFFFAOYSA-N -1 1 320.348 4.140 20 0 DIADMM O=C(Nc1ccc([O-])c(Cl)c1)[C@@H](c1ccccc1)C1CC1 ZINC000182873064 331540616 /nfs/dbraw/zinc/54/06/16/331540616.db2.gz XLWOPHVWLZMWME-INIZCTEOSA-N -1 1 301.773 4.178 20 0 DIADMM Cc1cnc(S[C@@H](C)c2ccc(C(F)(F)F)cc2)[n-]c1=O ZINC000584183317 331859364 /nfs/dbraw/zinc/85/93/64/331859364.db2.gz DHURZDKYWJCFFW-VIFPVBQESA-N -1 1 314.332 4.363 20 0 DIADMM CCc1ccc(-c2ccc(CN[C@@H](C(=O)[O-])C(C)(C)C)o2)cc1 ZINC000426778581 332152402 /nfs/dbraw/zinc/15/24/02/332152402.db2.gz YULDYYGALJVQIF-KRWDZBQOSA-N -1 1 315.413 4.098 20 0 DIADMM Cc1ccc([C@@H](CC(=O)[O-])NCc2ccc3ccccc3c2)o1 ZINC000426782765 332152708 /nfs/dbraw/zinc/15/27/08/332152708.db2.gz HZBPTLBNPIROBK-QGZVFWFLSA-N -1 1 309.365 4.047 20 0 DIADMM CCC[C@H](C)C[C@@H](NCc1cc2cc(C)c(C)cc2o1)C(=O)[O-] ZINC000426828441 332156041 /nfs/dbraw/zinc/15/60/41/332156041.db2.gz YYLUIOOTDLIRSM-YVEFUNNKSA-N -1 1 317.429 4.419 20 0 DIADMM Cc1cc2cc(CN[C@@H](CC(C)(C)C)C(=O)[O-])oc2cc1C ZINC000426826128 332158180 /nfs/dbraw/zinc/15/81/80/332158180.db2.gz CXBIMHOYMRKDKT-HNNXBMFYSA-N -1 1 303.402 4.029 20 0 DIADMM C[C@@H](c1ccc(Cl)cc1)N(C)C(=O)c1ccc([O-])cc1F ZINC000181110932 333029258 /nfs/dbraw/zinc/02/92/58/333029258.db2.gz CPIFKWNJUFHPJF-JTQLQIEISA-N -1 1 307.752 4.018 20 0 DIADMM O=C(Nc1ccccc1-c1ccccc1)c1ccc([O-])cc1F ZINC000181847881 333034802 /nfs/dbraw/zinc/03/48/02/333034802.db2.gz KQLODRIJAMXPRF-UHFFFAOYSA-N -1 1 307.324 4.451 20 0 DIADMM CSc1ccc([N-]S(=O)(=O)c2cccc(C(C)C)c2)cc1 ZINC000460430007 333085865 /nfs/dbraw/zinc/08/58/65/333085865.db2.gz OFADDBZYVCMJLK-UHFFFAOYSA-N -1 1 321.467 4.333 20 0 DIADMM O=C(c1ccc2ccccc2c1[O-])N1CCC[C@H]2CCCC[C@H]21 ZINC000319524887 333312437 /nfs/dbraw/zinc/31/24/37/333312437.db2.gz KFDFTNIESJRNEG-CRAIPNDOSA-N -1 1 309.409 4.340 20 0 DIADMM Cc1cc(C)cc(N(C)C(=O)c2ccc3ccccc3c2[O-])c1 ZINC000320740485 335133146 /nfs/dbraw/zinc/13/31/46/335133146.db2.gz LXCWEBSLGLSOLP-UHFFFAOYSA-N -1 1 305.377 4.439 20 0 DIADMM O=C(c1cc2ccccc2cc1[O-])N1CCC[C@@H]2CCCC[C@H]21 ZINC000319660465 333394102 /nfs/dbraw/zinc/39/41/02/333394102.db2.gz GPKQXQBUJLFYDR-KBXCAEBGSA-N -1 1 309.409 4.340 20 0 DIADMM CC(=O)c1cccc(NC(=O)c2ccc3ccccc3c2[O-])c1 ZINC000320342287 333517014 /nfs/dbraw/zinc/51/70/14/333517014.db2.gz ONDRTLYDRQXICQ-UHFFFAOYSA-N -1 1 305.333 4.000 20 0 DIADMM CC[C@@H](C)c1ccccc1OCC(=O)Nc1ccc(F)cc1[O-] ZINC000531755837 333553751 /nfs/dbraw/zinc/55/37/51/333553751.db2.gz FFVMANUIJWNCSZ-GFCCVEGCSA-N -1 1 317.360 4.062 20 0 DIADMM C/C=C/c1ccc([N-]S(=O)(=O)c2cccc(SC)c2)cc1 ZINC000571153381 333671034 /nfs/dbraw/zinc/67/10/34/333671034.db2.gz BNHQYGVROJIYLS-HWKANZROSA-N -1 1 319.451 4.242 20 0 DIADMM Cc1cnc(S[C@@H](C)CCSc2ccccc2)[n-]c1=O ZINC000571345410 333768912 /nfs/dbraw/zinc/76/89/12/333768912.db2.gz NSAPNLPCJJVOLY-LBPRGKRZSA-N -1 1 306.456 4.154 20 0 DIADMM CC1(C)CN(C(=O)c2cc(Cl)ccc2[O-])[C@@H]1c1cccs1 ZINC000436849397 334007163 /nfs/dbraw/zinc/00/71/63/334007163.db2.gz ZJPTVQLWSJSOJY-CQSZACIVSA-N -1 1 321.829 4.330 20 0 DIADMM CC[C@@H](C)N(CC(=O)[O-])Cc1ccc(-c2ccc(F)cc2C)o1 ZINC000414671929 334064780 /nfs/dbraw/zinc/06/47/80/334064780.db2.gz BRKVMPVLKPZHIE-CYBMUJFWSA-N -1 1 319.376 4.079 20 0 DIADMM Cc1ccc2c(c1)nc(-c1ccc([O-])c(Br)c1)n2C ZINC000048526546 334287906 /nfs/dbraw/zinc/28/79/06/334287906.db2.gz VRXNUDGFUUUWBS-UHFFFAOYSA-N -1 1 317.186 4.017 20 0 DIADMM C[C@H](CC(=O)Nc1ccc([O-])c(Cl)c1)c1ccc(F)cc1 ZINC000111666962 334352751 /nfs/dbraw/zinc/35/27/51/334352751.db2.gz COQWQXRJRJGMJX-SNVBAGLBSA-N -1 1 307.752 4.317 20 0 DIADMM O=C(Cc1ccc2ccccc2c1)Nc1ccc([O-])c(Cl)c1 ZINC000111668481 334353009 /nfs/dbraw/zinc/35/30/09/334353009.db2.gz CCZGPHYIACETNA-UHFFFAOYSA-N -1 1 311.768 4.380 20 0 DIADMM COc1cc(-c2nc(C3CCCCC3)no2)cc(Cl)c1[O-] ZINC000443087969 338444056 /nfs/dbraw/zinc/44/40/56/338444056.db2.gz RDEQJJLCOJFOCG-UHFFFAOYSA-N -1 1 308.765 4.152 20 0 DIADMM O=C(Cc1c(Cl)cccc1Cl)Nc1ccc(F)cc1[O-] ZINC000532012888 334373805 /nfs/dbraw/zinc/37/38/05/334373805.db2.gz MQMPFLHLGNOYGA-UHFFFAOYSA-N -1 1 314.143 4.019 20 0 DIADMM COc1cc(-c2nc([C@@H]3CCCC[C@@H]3C)no2)cc(Cl)c1[O-] ZINC000443201991 338446971 /nfs/dbraw/zinc/44/69/71/338446971.db2.gz WGMSENXNXIGOLF-GXSJLCMTSA-N -1 1 322.792 4.398 20 0 DIADMM CC[C@@H](Cc1ccccc1C)C(=O)Nc1ccc([O-])c(F)c1F ZINC000424860182 334873770 /nfs/dbraw/zinc/87/37/70/334873770.db2.gz BMOGAALKNLBASR-LBPRGKRZSA-N -1 1 319.351 4.186 20 0 DIADMM CC[C@@H](C)Cc1c(C)sc2nc(-c3coc(C)n3)[n-]c(=O)c12 ZINC000345210148 335307950 /nfs/dbraw/zinc/30/79/50/335307950.db2.gz QKXMFVJYCPDWFG-MRVPVSSYSA-N -1 1 317.414 4.257 20 0 DIADMM Cc1nc(-c2nc(=O)c3cc(-c4ccccc4)sc3[n-]2)co1 ZINC000345215370 335308406 /nfs/dbraw/zinc/30/84/06/335308406.db2.gz XSSCYUZYCPYKCS-UHFFFAOYSA-N -1 1 309.350 4.027 20 0 DIADMM CC[C@@H](C)Sc1ccc(NC(=O)c2cncc([O-])c2)c(C)c1 ZINC000518879343 335664091 /nfs/dbraw/zinc/66/40/91/335664091.db2.gz UXJVASMFVAULCY-GFCCVEGCSA-N -1 1 316.426 4.239 20 0 DIADMM Cc1ccc2cccc(-c3nc(-c4ccc([O-])c(F)c4)no3)c2n1 ZINC000445482484 338496429 /nfs/dbraw/zinc/49/64/29/338496429.db2.gz QCQSDLLKXOLIBR-UHFFFAOYSA-N -1 1 321.311 4.105 20 0 DIADMM C[C@H]1CN(Cc2cccc([O-])c2Cl)C[C@H](c2ccsc2)O1 ZINC000351686360 336058248 /nfs/dbraw/zinc/05/82/48/336058248.db2.gz QSNSDIHPZXDNFL-XHDPSFHLSA-N -1 1 323.845 4.069 20 0 DIADMM O=C(CCCCCc1cccs1)Nc1ccc(F)cc1[O-] ZINC000532621013 336257161 /nfs/dbraw/zinc/25/71/61/336257161.db2.gz DBWCSPGGGXTIQQ-UHFFFAOYSA-N -1 1 307.390 4.334 20 0 DIADMM Cc1cc(CCCC(=O)Nc2ccc(F)cc2[O-])c(C)s1 ZINC000532621234 336257190 /nfs/dbraw/zinc/25/71/90/336257190.db2.gz PZFCCQGBVDBTML-UHFFFAOYSA-N -1 1 307.390 4.171 20 0 DIADMM CC(C)(CC(=O)Nc1ccc([O-])c(Cl)c1)c1ccccc1 ZINC000532749803 336269484 /nfs/dbraw/zinc/26/94/84/336269484.db2.gz DDLPPAWYQOPOMF-UHFFFAOYSA-N -1 1 303.789 4.352 20 0 DIADMM C[C@@H]1c2ccsc2CCN1C(=O)c1ccc2ccccc2c1[O-] ZINC000320938735 336386981 /nfs/dbraw/zinc/38/69/81/336386981.db2.gz WWZDKGVHMXLUIZ-GFCCVEGCSA-N -1 1 323.417 4.366 20 0 DIADMM CC[C@@H](NCc1ccc(-c2ccc(C(C)(C)C)cc2)o1)C(=O)[O-] ZINC000362346909 336793306 /nfs/dbraw/zinc/79/33/06/336793306.db2.gz PJFMYQMNKDFFFZ-MRXNPFEDSA-N -1 1 315.413 4.197 20 0 DIADMM O=S(=O)([N-]c1ccc2cc[nH]c2c1)c1cccc2ccccc21 ZINC000193477698 336995351 /nfs/dbraw/zinc/99/53/51/336995351.db2.gz UWEGACLIFYQKFB-UHFFFAOYSA-N -1 1 322.389 4.122 20 0 DIADMM O=S(=O)([N-]c1ccc2cc[nH]c2c1)c1ccc2ccccc2c1 ZINC000193483329 337007631 /nfs/dbraw/zinc/00/76/31/337007631.db2.gz JIQOBWNSMDULRZ-UHFFFAOYSA-N -1 1 322.389 4.122 20 0 DIADMM COC(=O)c1c[n-]c(S[C@H](C)c2ccc3ccccc3c2)n1 ZINC000193543829 337077947 /nfs/dbraw/zinc/07/79/47/337077947.db2.gz FJGZKTGFLXKTMR-LLVKDONJSA-N -1 1 312.394 4.203 20 0 DIADMM O=C([O-])c1cccc(C[N@H+]2CC[C@H](c3ccccc3)C2)c1Cl ZINC000394473799 337114324 /nfs/dbraw/zinc/11/43/24/337114324.db2.gz OCYZVGOQMIYKIT-AWEZNQCLSA-N -1 1 315.800 4.028 20 0 DIADMM Cc1ccncc1CSc1nc(-c2ccccc2)c(C)c(=O)[n-]1 ZINC000467203227 337188460 /nfs/dbraw/zinc/18/84/60/337188460.db2.gz XCHOMSBQBQSWKU-UHFFFAOYSA-N -1 1 323.421 4.153 20 0 DIADMM Cc1noc(-c2ccccc2)c1[N-]C(=O)c1ccc(Cl)o1 ZINC000183373148 337191519 /nfs/dbraw/zinc/19/15/19/337191519.db2.gz DZYUOMFQQPXSBP-UHFFFAOYSA-N -1 1 302.717 4.149 20 0 DIADMM [O-]c1cccc(CNc2ccc(N3CCCCC3)nc2)c1Cl ZINC000393385257 337263658 /nfs/dbraw/zinc/26/36/58/337263658.db2.gz QCDCLHXPYNUCSQ-UHFFFAOYSA-N -1 1 317.820 4.043 20 0 DIADMM O=C(c1ccc2ccccc2c1[O-])N1CCC[C@H]1C1CCCC1 ZINC000321436877 337265111 /nfs/dbraw/zinc/26/51/11/337265111.db2.gz MFTIGCCJQHQFFB-SFHVURJKSA-N -1 1 309.409 4.340 20 0 DIADMM Cc1cc(C(=O)[N-]c2ccccc2SC2CCCC2)on1 ZINC000025266435 337305487 /nfs/dbraw/zinc/30/54/87/337305487.db2.gz RUZDOOCCDUSWRE-UHFFFAOYSA-N -1 1 302.399 4.270 20 0 DIADMM CC1(c2nc(-c3ccc([O-])cc3F)no2)CCC(F)(F)CC1 ZINC000528168692 337791624 /nfs/dbraw/zinc/79/16/24/337791624.db2.gz OHTFOFJXSQZTOB-UHFFFAOYSA-N -1 1 312.291 4.048 20 0 DIADMM CC(C)(C)c1cc(-c2nc(-c3ccc([O-])cc3Cl)no2)no1 ZINC000445446517 337844693 /nfs/dbraw/zinc/84/46/93/337844693.db2.gz MAHVWWLAMKNKHB-UHFFFAOYSA-N -1 1 319.748 4.048 20 0 DIADMM CCC1(CC)CCC(NC(=O)c2c(F)ccc([O-])c2F)CC1 ZINC000514758008 337970185 /nfs/dbraw/zinc/97/01/85/337970185.db2.gz HTDLKQHNOLZUHW-UHFFFAOYSA-N -1 1 311.372 4.149 20 0 DIADMM CCCCSCCc1nc(-c2ccc([O-])cc2Cl)no1 ZINC000445451959 338016598 /nfs/dbraw/zinc/01/65/98/338016598.db2.gz MXLVJJLWYQMCNU-UHFFFAOYSA-N -1 1 312.822 4.171 20 0 DIADMM [O-]c1ccc(-c2noc(-c3cc(Cl)ccc3F)n2)c(F)c1 ZINC000445453550 338016989 /nfs/dbraw/zinc/01/69/89/338016989.db2.gz BOJLXZDLIVSEKG-UHFFFAOYSA-N -1 1 308.671 4.041 20 0 DIADMM C[C@H](c1nc(-c2ccc([O-])cc2Cl)no1)c1cccc(F)c1 ZINC000445453775 338017077 /nfs/dbraw/zinc/01/70/77/338017077.db2.gz XHAGHCWCHJPAOG-VIFPVBQESA-N -1 1 318.735 4.387 20 0 DIADMM Cc1c(-c2nc(-c3ccc([O-])cc3F)no2)cnc2ccccc12 ZINC000445456647 338017588 /nfs/dbraw/zinc/01/75/88/338017588.db2.gz PFWOAXJXRKMSHZ-UHFFFAOYSA-N -1 1 321.311 4.105 20 0 DIADMM [O-]c1ccc(-c2noc(-c3ccc(Cl)cc3F)n2)c(F)c1 ZINC000445460304 338019358 /nfs/dbraw/zinc/01/93/58/338019358.db2.gz PZYDMVBQBHGXGG-UHFFFAOYSA-N -1 1 308.671 4.041 20 0 DIADMM CC(C)(C)c1nc(-c2nc(-c3ccc([O-])cc3F)no2)cs1 ZINC000445460926 338020933 /nfs/dbraw/zinc/02/09/33/338020933.db2.gz UNOMQEIIBOSKKN-UHFFFAOYSA-N -1 1 319.361 4.002 20 0 DIADMM C[C@H](Cc1cccc(F)c1)c1nc(-c2ccc([O-])cc2F)no1 ZINC000445461353 338022251 /nfs/dbraw/zinc/02/22/51/338022251.db2.gz GLQVIWYIXWGQPF-SNVBAGLBSA-N -1 1 316.307 4.067 20 0 DIADMM Cc1cccc(O[C@H](C)c2nc(-c3ccc([O-])cc3F)no2)c1 ZINC000445462631 338027650 /nfs/dbraw/zinc/02/76/50/338027650.db2.gz LXARHEPCIKZSIR-LLVKDONJSA-N -1 1 314.316 4.030 20 0 DIADMM Cc1ccccc1-c1cccc(CNCc2cc(C(=O)[O-])co2)c1 ZINC000426687467 338038127 /nfs/dbraw/zinc/03/81/27/338038127.db2.gz KPNMPVFZUTYMRN-UHFFFAOYSA-N -1 1 321.376 4.243 20 0 DIADMM O=C([O-])[C@H](CC1CCCC1)NCc1ccc(-c2ccccc2)o1 ZINC000426728771 338039560 /nfs/dbraw/zinc/03/95/60/338039560.db2.gz XFZPYAIPMBZHBQ-KRWDZBQOSA-N -1 1 313.397 4.070 20 0 DIADMM Cc1cccc([C@@H](NCc2cccc(Cl)c2F)C(=O)[O-])c1C ZINC000426730220 338039641 /nfs/dbraw/zinc/03/96/41/338039641.db2.gz KGXHIODNAGQXQH-MRXNPFEDSA-N -1 1 321.779 4.011 20 0 DIADMM Cc1cc(C)cc([C@@H](NCc2cc(Cl)ccc2F)C(=O)[O-])c1 ZINC000426751312 338040706 /nfs/dbraw/zinc/04/07/06/338040706.db2.gz UXHSTTBMUPBRTH-MRXNPFEDSA-N -1 1 321.779 4.011 20 0 DIADMM C[C@@H]1[C@@H](C(=O)Nc2ccc([O-])c(Cl)c2)[C@@H]1c1ccccc1 ZINC000435762620 338248222 /nfs/dbraw/zinc/24/82/22/338248222.db2.gz JJNZEHMDUHNETA-CIISACIHSA-N -1 1 301.773 4.034 20 0 DIADMM [O-]c1ccc(-c2noc(-c3cc(F)ccc3Cl)n2)c(F)c1 ZINC000436520211 338274876 /nfs/dbraw/zinc/27/48/76/338274876.db2.gz DDGGHKVRHYEECI-UHFFFAOYSA-N -1 1 308.671 4.041 20 0 DIADMM CC(C)N(Cc1ccco1)C(=O)c1cc2ccccc2cc1[O-] ZINC000436540205 338276175 /nfs/dbraw/zinc/27/61/75/338276175.db2.gz OLHTUTLBRUBTPX-UHFFFAOYSA-N -1 1 309.365 4.189 20 0 DIADMM O=C(c1ccc2ccccc2c1[O-])N1CCCc2cc(F)ccc21 ZINC000436565573 338277184 /nfs/dbraw/zinc/27/71/84/338277184.db2.gz RZRSBDLVQDNPMQ-UHFFFAOYSA-N -1 1 321.351 4.278 20 0 DIADMM C[C@@H]1CN(C(=O)c2cc3ccccc3cc2[O-])[C@@H]1c1ccccc1 ZINC000436574044 338277862 /nfs/dbraw/zinc/27/78/62/338277862.db2.gz KVUCEZOHTNUXKV-VLIAUNLRSA-N -1 1 317.388 4.379 20 0 DIADMM C[C@@H]1[C@H](c2ccccc2)CCN1C(=O)c1ccc(Cl)cc1[O-] ZINC000436588019 338278577 /nfs/dbraw/zinc/27/85/77/338278577.db2.gz RCLQHVYPHQSFLS-IUODEOHRSA-N -1 1 315.800 4.064 20 0 DIADMM C[C@H]1[C@@H](c2ccccc2)CCN1C(=O)c1cc(Cl)ccc1[O-] ZINC000436590931 338278849 /nfs/dbraw/zinc/27/88/49/338278849.db2.gz UWTGFGHXMAUTND-WFASDCNBSA-N -1 1 315.800 4.064 20 0 DIADMM CC[C@@H](C)n1ncc(NC(=O)c2cc3ccccc3cc2[O-])c1C ZINC000436598091 338279254 /nfs/dbraw/zinc/27/92/54/338279254.db2.gz XYJPJJQYYBVOSA-GFCCVEGCSA-N -1 1 323.396 4.274 20 0 DIADMM Cc1[nH]c2ccc(-c3noc(-c4ccc([O-])cc4F)n3)cc2c1C ZINC000436687807 338282981 /nfs/dbraw/zinc/28/29/81/338282981.db2.gz JTUGGWIVPIMCIK-UHFFFAOYSA-N -1 1 323.327 4.346 20 0 DIADMM Cc1csc(-c2cccc(NC(=O)c3ccccc3[O-])c2)n1 ZINC000436715556 338283824 /nfs/dbraw/zinc/28/38/24/338283824.db2.gz XRWYGMSKHDCJRZ-UHFFFAOYSA-N -1 1 310.378 4.076 20 0 DIADMM C[C@@H]1CCN(C(=O)c2cc3ccccc3cc2[O-])CC12CCC2 ZINC000436717870 338284089 /nfs/dbraw/zinc/28/40/89/338284089.db2.gz YITSNHJBSQYSNV-CQSZACIVSA-N -1 1 309.409 4.198 20 0 DIADMM C[C@@H]1CCC[C@H](C)N(C(=O)c2ccc(C(F)(F)F)cc2[O-])C1 ZINC000436751742 338285426 /nfs/dbraw/zinc/28/54/26/338285426.db2.gz NNHKPEDKTJEWAG-MNOVXSKESA-N -1 1 315.335 4.062 20 0 DIADMM CCCC[C@H](CC)CNC(=O)c1cc(Cl)c([O-])c(OC)c1 ZINC000436751645 338285433 /nfs/dbraw/zinc/28/54/33/338285433.db2.gz UFEYRXJIRNDDFF-NSHDSACASA-N -1 1 313.825 4.000 20 0 DIADMM CC[C@H]1CCCN(C(=O)c2ccc(C(F)(F)F)cc2[O-])CC1 ZINC000436751533 338285456 /nfs/dbraw/zinc/28/54/56/338285456.db2.gz MADFJCKSMUJQKE-NSHDSACASA-N -1 1 315.335 4.063 20 0 DIADMM CCC[C@@H]1CCCN(C(=O)c2ccc(C(F)(F)F)cc2[O-])C1 ZINC000436753516 338285642 /nfs/dbraw/zinc/28/56/42/338285642.db2.gz VSRLQNBLOUPRNH-LLVKDONJSA-N -1 1 315.335 4.063 20 0 DIADMM CCN(Cc1ccccc1)C(=O)c1ccc(C(F)(F)F)cc1[O-] ZINC000436763104 338286097 /nfs/dbraw/zinc/28/60/97/338286097.db2.gz IWFSOVJPMWLQQT-UHFFFAOYSA-N -1 1 323.314 4.073 20 0 DIADMM O=C(c1cc(F)ccc1[O-])N1CCC[C@@H]1c1ccc(Cl)cc1 ZINC000436760641 338286234 /nfs/dbraw/zinc/28/62/34/338286234.db2.gz RCEAYDAWHYXKKO-OAHLLOKOSA-N -1 1 319.763 4.162 20 0 DIADMM CC(C)C[C@@H]1CCCN1C(=O)c1ccc(C(F)(F)F)cc1[O-] ZINC000436767625 338286621 /nfs/dbraw/zinc/28/66/21/338286621.db2.gz GQHOHIAIUKFGFC-LBPRGKRZSA-N -1 1 315.335 4.062 20 0 DIADMM CCN(C(=O)c1ccc(C(F)(F)F)cc1[O-])C1CCCCC1 ZINC000436793855 338287549 /nfs/dbraw/zinc/28/75/49/338287549.db2.gz UEGMQPNDZKYCGM-UHFFFAOYSA-N -1 1 315.335 4.206 20 0 DIADMM C/C(=C\c1ccccc1)CN(C)C(=O)c1ccc(Cl)cc1[O-] ZINC000436810041 338288064 /nfs/dbraw/zinc/28/80/64/338288064.db2.gz WBBLSCXRSXGTHY-JLHYYAGUSA-N -1 1 315.800 4.221 20 0 DIADMM Cc1nc(-c2ccccc2)sc1NC(=O)c1ccccc1[O-] ZINC000436840932 338289581 /nfs/dbraw/zinc/28/95/81/338289581.db2.gz YBMZYOODYPPQSJ-UHFFFAOYSA-N -1 1 310.378 4.076 20 0 DIADMM O=C(c1cc(Cl)ccc1[O-])N1CCC[C@@H](c2ccccc2)C1 ZINC000436852161 338289865 /nfs/dbraw/zinc/28/98/65/338289865.db2.gz NXCXBPAASXRMAW-CQSZACIVSA-N -1 1 315.800 4.065 20 0 DIADMM CC(=O)c1cc(NC(=O)c2ccc3ccccc3c2[O-])ccc1F ZINC000436856202 338290081 /nfs/dbraw/zinc/29/00/81/338290081.db2.gz LKSPQQSZZDJEAM-UHFFFAOYSA-N -1 1 323.323 4.139 20 0 DIADMM O=C(NC1CCC2(CCCCC2)CC1)c1ccc([O-])cc1F ZINC000436864166 338290364 /nfs/dbraw/zinc/29/03/64/338290364.db2.gz LNDJHOMFFBIJIY-UHFFFAOYSA-N -1 1 305.393 4.154 20 0 DIADMM CC(C)C[C@@H](NC(=O)c1ccc([O-])cc1F)c1ccccc1 ZINC000436861538 338290408 /nfs/dbraw/zinc/29/04/08/338290408.db2.gz KVLMBFIMDZKMPO-QGZVFWFLSA-N -1 1 301.361 4.049 20 0 DIADMM O=C(c1cc(Cl)ccc1[O-])N1CCCC2(CCCCC2)C1 ZINC000436865633 338290465 /nfs/dbraw/zinc/29/04/65/338290465.db2.gz UZYUPXMGUMCJGQ-UHFFFAOYSA-N -1 1 307.821 4.232 20 0 DIADMM CCOc1cc(-c2noc(C3CC(C)(C)C3)n2)cc(Cl)c1[O-] ZINC000436867124 338290625 /nfs/dbraw/zinc/29/06/25/338290625.db2.gz ATFNUYCQFOVEDW-UHFFFAOYSA-N -1 1 322.792 4.398 20 0 DIADMM [O-]c1ccc(-c2noc(Cc3cccc(C(F)F)c3)n2)cc1F ZINC000436871353 338290750 /nfs/dbraw/zinc/29/07/50/338290750.db2.gz HGYURHIQRMYHBQ-UHFFFAOYSA-N -1 1 320.270 4.110 20 0 DIADMM Cc1oc(C(C)C)cc1-c1nc(-c2ccc([O-])cc2F)no1 ZINC000436873998 338290911 /nfs/dbraw/zinc/29/09/11/338290911.db2.gz OYFFHUPWEFHSQH-UHFFFAOYSA-N -1 1 302.305 4.273 20 0 DIADMM O=C(N[C@H]1CCSc2ccccc21)c1ccc(Cl)cc1[O-] ZINC000436879733 338291391 /nfs/dbraw/zinc/29/13/91/338291391.db2.gz HPSJUBNWASQLBU-ZDUSSCGKSA-N -1 1 319.813 4.013 20 0 DIADMM Cc1ccc([C@H]2CCCCCN2C(=O)c2ccc([O-])cc2F)o1 ZINC000436880358 338291410 /nfs/dbraw/zinc/29/14/10/338291410.db2.gz NWLHJIBTZFSEHH-MRXNPFEDSA-N -1 1 317.360 4.190 20 0 DIADMM [O-]c1ccc(-c2noc(Cc3cccc(C(F)F)c3)n2)c(F)c1 ZINC000436878623 338291421 /nfs/dbraw/zinc/29/14/21/338291421.db2.gz KORBHKCAGCMSIB-UHFFFAOYSA-N -1 1 320.270 4.110 20 0 DIADMM COc1cc(-c2nc(CC3(C)CCCC3)no2)cc(Cl)c1[O-] ZINC000436885516 338291837 /nfs/dbraw/zinc/29/18/37/338291837.db2.gz JOJSHDKYYGZQCL-UHFFFAOYSA-N -1 1 322.792 4.227 20 0 DIADMM Cc1ccc(-c2cccnc2)cc1NC(=O)c1cc(F)ccc1[O-] ZINC000436889063 338292052 /nfs/dbraw/zinc/29/20/52/338292052.db2.gz AOLRQBBUSCXHKC-UHFFFAOYSA-N -1 1 322.339 4.154 20 0 DIADMM O=C(N[C@@H](CC1CCC1)c1ccccc1)c1ccc([O-])cc1F ZINC000436896486 338292468 /nfs/dbraw/zinc/29/24/68/338292468.db2.gz YZGSVEXQAJTEQC-SFHVURJKSA-N -1 1 313.372 4.193 20 0 DIADMM CCCOc1cccc(-c2noc(-c3cc(F)ccc3[O-])n2)c1 ZINC000436916286 338293224 /nfs/dbraw/zinc/29/32/24/338293224.db2.gz VPOSLVXDWNWXOC-UHFFFAOYSA-N -1 1 314.316 4.037 20 0 DIADMM O=C(Nc1ccc(CNc2ccccc2)cc1)c1ccccc1[O-] ZINC000436937670 338294588 /nfs/dbraw/zinc/29/45/88/338294588.db2.gz QWMBWZOQHZVXLS-UHFFFAOYSA-N -1 1 318.376 4.257 20 0 DIADMM [O-]c1ccc(F)cc1-c1nc(CSCc2ccccc2)no1 ZINC000436945102 338295157 /nfs/dbraw/zinc/29/51/57/338295157.db2.gz RYAPUFNNMIJEGU-UHFFFAOYSA-N -1 1 316.357 4.015 20 0 DIADMM CCCc1cc(=O)[nH]c(C(=Cc2ccc([O-])c(Cl)c2)CC)n1 ZINC000436963093 338296019 /nfs/dbraw/zinc/29/60/19/338296019.db2.gz BKALQNWDNXGMBR-XYOKQWHBSA-N -1 1 318.804 4.032 20 0 DIADMM CC[C@H](CC(F)(F)F)NC(=O)c1ccc2ccccc2c1[O-] ZINC000436979783 338296557 /nfs/dbraw/zinc/29/65/57/338296557.db2.gz LPEJIIJGNSAMQV-LLVKDONJSA-N -1 1 311.303 4.006 20 0 DIADMM CN(C(=O)c1cc2ccccc2cc1[O-])c1ccc2cc[nH]c2c1 ZINC000436999347 338297318 /nfs/dbraw/zinc/29/73/18/338297318.db2.gz KVULHTGLWKTBAK-UHFFFAOYSA-N -1 1 316.360 4.303 20 0 DIADMM Cc1cc(CN(C)C(=O)c2ccc3ccccc3c2[O-])ccc1F ZINC000437006312 338297446 /nfs/dbraw/zinc/29/74/46/338297446.db2.gz XFWXHWHLODVSMM-UHFFFAOYSA-N -1 1 323.367 4.265 20 0 DIADMM Cc1c(F)cccc1S(=O)(=O)[N-]c1ccc(C(C)C)cc1 ZINC000438795447 338352208 /nfs/dbraw/zinc/35/22/08/338352208.db2.gz UUVQPOKNUCEBSW-UHFFFAOYSA-N -1 1 307.390 4.058 20 0 DIADMM O=C(Nc1nc(C2CCC2)cs1)Nc1ccc([O-])c(Cl)c1 ZINC000442049604 338420727 /nfs/dbraw/zinc/42/07/27/338420727.db2.gz QRQPRQHNBFSTFZ-UHFFFAOYSA-N -1 1 323.805 4.414 20 0 DIADMM O=c1cc(C(F)F)nc(SC[C@H]2CCCCC2(F)F)[n-]1 ZINC000450960886 338714501 /nfs/dbraw/zinc/71/45/01/338714501.db2.gz SQRXZSDSNIMRBN-SSDOTTSWSA-N -1 1 310.316 4.037 20 0 DIADMM CCOc1cc(CN(C)[C@@H](C)c2ccco2)cc(Cl)c1O ZINC000459299843 339020125 /nfs/dbraw/zinc/02/01/25/339020125.db2.gz LJIAUNAPEHQHTA-NSHDSACASA-N -1 1 309.793 4.230 20 0 DIADMM O=C(Nc1cccc(C2CCC2)c1)c1c(F)ccc([O-])c1F ZINC000462725141 339084908 /nfs/dbraw/zinc/08/49/08/339084908.db2.gz YCLMUDXZVUQNBD-UHFFFAOYSA-N -1 1 303.308 4.190 20 0 DIADMM Cc1cc(CSc2nc(C3CC3)cc(=O)[n-]2)c2ccccc2n1 ZINC000470439762 339319759 /nfs/dbraw/zinc/31/97/59/339319759.db2.gz YKOUNEQSTCFLPY-UHFFFAOYSA-N -1 1 323.421 4.209 20 0 DIADMM CCc1cccc(S(=O)(=O)[N-]c2c(C)cccc2SC)c1 ZINC000471980543 339358637 /nfs/dbraw/zinc/35/86/37/339358637.db2.gz SECHQGNJCGUWPX-UHFFFAOYSA-N -1 1 321.467 4.080 20 0 DIADMM O=c1cc(C2CC2)nc(SCc2cccc(C(F)F)c2)[n-]1 ZINC000475893138 339464267 /nfs/dbraw/zinc/46/42/67/339464267.db2.gz UZVDGVCVQSHCBE-UHFFFAOYSA-N -1 1 308.353 4.290 20 0 DIADMM O=C(Nc1ccc([O-])c(Cl)c1)c1coc2cc(F)ccc21 ZINC000476451330 339476595 /nfs/dbraw/zinc/47/65/95/339476595.db2.gz XZOWYTXKDBCKOC-UHFFFAOYSA-N -1 1 305.692 4.183 20 0 DIADMM Cc1cc(-c2nc3cc(F)c(F)cc3c(=O)[n-]2)nc2ccccc12 ZINC000487500042 339755168 /nfs/dbraw/zinc/75/51/68/339755168.db2.gz HWXHXGURWMRPQT-UHFFFAOYSA-N -1 1 323.302 4.137 20 0 DIADMM CCSc1cccc([N-]S(=O)(=O)c2cc(C)ccc2C)c1 ZINC000505279615 340165490 /nfs/dbraw/zinc/16/54/90/340165490.db2.gz FXEKNDIYHAQLEP-UHFFFAOYSA-N -1 1 321.467 4.216 20 0 DIADMM [O-]c1cccc(CN(Cc2ccc(F)cc2)C2CC2)c1Cl ZINC000506808817 340202225 /nfs/dbraw/zinc/20/22/25/340202225.db2.gz YYQISZIGMZSHMG-UHFFFAOYSA-N -1 1 305.780 4.349 20 0 DIADMM Cc1ccc(CC(=O)Nc2ccc([O-])c(Cl)c2)c(Cl)c1 ZINC000509174658 340263042 /nfs/dbraw/zinc/26/30/42/340263042.db2.gz VNIFARFUNYMLQT-UHFFFAOYSA-N -1 1 310.180 4.189 20 0 DIADMM CC[C@H](Oc1cccc(C)c1)C(=O)Nc1ccc([O-])c(Cl)c1 ZINC000509172302 340263084 /nfs/dbraw/zinc/26/30/84/340263084.db2.gz VOGWOXUAVLAFCL-INIZCTEOSA-N -1 1 319.788 4.150 20 0 DIADMM Cc1ccc2[nH]c(C(=O)Nc3ccc([O-])c(Cl)c3)cc2c1C ZINC000509188145 340263452 /nfs/dbraw/zinc/26/34/52/340263452.db2.gz ZOKHTPQZXKYFCV-UHFFFAOYSA-N -1 1 314.772 4.396 20 0 DIADMM CC(C)c1cnc(NC(=O)Nc2ccc([O-])c(Cl)c2)s1 ZINC000192395466 340566934 /nfs/dbraw/zinc/56/69/34/340566934.db2.gz GLEPTFMPIXMEOJ-UHFFFAOYSA-N -1 1 311.794 4.270 20 0 DIADMM O=C(Nc1ccccc1Oc1ccccc1)c1ccc(O)cc1[O-] ZINC000325978976 340711084 /nfs/dbraw/zinc/71/10/84/340711084.db2.gz AUMBAPCKXNGRQL-UHFFFAOYSA-N -1 1 321.332 4.142 20 0 DIADMM CC[C@H]1CC[C@@H](C(=O)Nc2cc(Cl)c([O-])c3ccccc23)O1 ZINC000529539782 340761210 /nfs/dbraw/zinc/76/12/10/340761210.db2.gz UGRBVTZNWAMGSF-BONVTDFDSA-N -1 1 319.788 4.095 20 0 DIADMM CC(C)c1ccccc1OCCC(=O)Nc1cccc(F)c1[O-] ZINC000530006705 340775911 /nfs/dbraw/zinc/77/59/11/340775911.db2.gz UAIRHHVGGQJBSI-UHFFFAOYSA-N -1 1 317.360 4.062 20 0 DIADMM C[C@@H](c1ccccc1F)N(C)C(=O)c1ccc(Cl)cc1[O-] ZINC000063240173 340797661 /nfs/dbraw/zinc/79/76/61/340797661.db2.gz FQXVKECDKPRUQZ-JTQLQIEISA-N -1 1 307.752 4.018 20 0 DIADMM CCCc1cc(=O)[n-]c(S[C@@H](C)c2nc3ccccc3o2)n1 ZINC000538656454 340837334 /nfs/dbraw/zinc/83/73/34/340837334.db2.gz GABKYAGSDQJAES-JTQLQIEISA-N -1 1 315.398 4.129 20 0 DIADMM COc1cc(C(=O)Nc2ccccc2C(C)C)cc(Cl)c1[O-] ZINC000545886588 341144261 /nfs/dbraw/zinc/14/42/61/341144261.db2.gz FTLCKSDAAFYLOO-UHFFFAOYSA-N -1 1 319.788 4.430 20 0 DIADMM C[C@H](OC1CCCCCC1)c1nc(-c2ccc([O-])c(F)c2)no1 ZINC000556002752 341492319 /nfs/dbraw/zinc/49/23/19/341492319.db2.gz LCPKUAFAJWHHRY-NSHDSACASA-N -1 1 320.364 4.382 20 0 DIADMM CC(C)[C@@H]1CN(C(=O)c2c(F)ccc([O-])c2F)c2ccccc21 ZINC000568815254 341682544 /nfs/dbraw/zinc/68/25/44/341682544.db2.gz OOEMDZYZMIEWIR-LBPRGKRZSA-N -1 1 317.335 4.070 20 0 DIADMM Cc1ccc2[nH]c(-c3nc(-c4ccc([O-])c(F)c4)no3)cc2c1 ZINC000573314645 341724558 /nfs/dbraw/zinc/72/45/58/341724558.db2.gz BXIRHYFVNGMIOJ-UHFFFAOYSA-N -1 1 309.300 4.038 20 0 DIADMM CC1(CC(=O)Nc2ccc(-c3cc(=O)[nH][n-]3)cc2)CCCCC1 ZINC000338085568 520697528 /nfs/dbraw/zinc/69/75/28/520697528.db2.gz QHLKHQFIQZNDMB-UHFFFAOYSA-N -1 1 313.401 4.081 20 0 DIADMM Cc1nc(C(C)(C)NCc2cccc([O-])c2Cl)sc1C ZINC000339267942 526664481 /nfs/dbraw/zinc/66/44/81/526664481.db2.gz CEWYQBRRCITNRB-UHFFFAOYSA-N -1 1 310.850 4.144 20 0 DIADMM CN(C(=O)c1cc2ccccc2cc1[O-])C1CCC(F)(F)CC1 ZINC000288918697 536067950 /nfs/dbraw/zinc/06/79/50/536067950.db2.gz HKOSDJJKHKTVQC-UHFFFAOYSA-N -1 1 319.351 4.195 20 0 DIADMM O=C(Nc1ccc(Br)c([O-])c1)[C@H]1CCCC2(CC2)C1 ZINC001330788345 1054052008 /nfs/dbraw/zinc/05/20/08/1054052008.db2.gz RJGBKANSCVEXFS-JTQLQIEISA-N -1 1 324.218 4.064 20 0 DIADMM Cc1ccc(-c2ccc(CNCc3cccc(C(=O)[O-])c3)o2)cc1 ZINC000683176107 1035667307 /nfs/dbraw/zinc/66/73/07/1035667307.db2.gz HAYBAAZQUUCFIG-UHFFFAOYSA-N -1 1 321.376 4.243 20 0 DIADMM C[C@@H](c1cc(Cl)ccc1Cl)[N@H+]1C[C@@H](C)[C@H](CC(=O)[O-])C1 ZINC000722634227 1035747068 /nfs/dbraw/zinc/74/70/68/1035747068.db2.gz GIMSQBJHPFXYIB-OUAUKWLOSA-N -1 1 316.228 4.097 20 0 DIADMM CC[C@@H]1c2ccccc2CN1C(=O)Cc1ccc([O-])c(Cl)c1 ZINC000890614164 1035836214 /nfs/dbraw/zinc/83/62/14/1035836214.db2.gz AKFYGVAINOVXPU-MRXNPFEDSA-N -1 1 315.800 4.082 20 0 DIADMM Cc1ccccc1[C@H](C)CC(=O)Nc1ccc([O-])c(Cl)c1 ZINC000533540142 1036111089 /nfs/dbraw/zinc/11/10/89/1036111089.db2.gz SGZBBCWRIAOAMK-GFCCVEGCSA-N -1 1 303.789 4.486 20 0 DIADMM CC(C)(C)C[C@@H]1CCN(C(=O)c2ccc([O-])c(F)c2)C1(C)C ZINC001626304685 1036144006 /nfs/dbraw/zinc/14/40/06/1036144006.db2.gz MSTOKMDKHXRKAG-ZDUSSCGKSA-N -1 1 307.409 4.208 20 0 DIADMM CCN(C(=O)c1cc2ccccc2cc1[O-])[C@@H](C)c1cccnc1 ZINC000115226134 1036871716 /nfs/dbraw/zinc/87/17/16/1036871716.db2.gz BCXGNOIXCWUJBM-AWEZNQCLSA-N -1 1 320.392 4.164 20 0 DIADMM Cc1ccc2oc([N-][C@H](C[C@@H]3CCCO3)C(F)(F)F)nc2c1 ZINC000656224566 1037148663 /nfs/dbraw/zinc/14/86/63/1037148663.db2.gz MJXNXGVCMCNTKC-GXFFZTMASA-N -1 1 314.307 4.048 20 0 DIADMM Cc1occc1Nc1c(Cl)ccc(Br)c1[O-] ZINC001211245887 1037233711 /nfs/dbraw/zinc/23/37/11/1037233711.db2.gz RNOAFFAUYWIQTA-UHFFFAOYSA-N -1 1 302.555 4.453 20 0 DIADMM COC(=O)c1cc2cccc(-c3cc(F)c([O-])cc3F)c2s1 ZINC001211340066 1037304681 /nfs/dbraw/zinc/30/46/81/1037304681.db2.gz SDXZNNPJIIMTGK-UHFFFAOYSA-N -1 1 320.316 4.339 20 0 DIADMM CCCOc1c(F)cc(-c2cc(F)c([O-])cc2F)cc1F ZINC001211339258 1037306140 /nfs/dbraw/zinc/30/61/40/1037306140.db2.gz MBOLMWBUOGHUQU-UHFFFAOYSA-N -1 1 300.251 4.404 20 0 DIADMM CCc1cc(Nc2c(Cl)ccc([O-])c2Cl)ccc1CO ZINC001216105453 1038195838 /nfs/dbraw/zinc/19/58/38/1038195838.db2.gz CNRKVQDFWQETBU-UHFFFAOYSA-N -1 1 312.196 4.497 20 0 DIADMM Cc1cc(-c2nc3ccc(Oc4ccccc4)cc3c(=O)[n-]2)no1 ZINC000684558584 1038270699 /nfs/dbraw/zinc/27/06/99/1038270699.db2.gz LFMJVHIVGYXATG-UHFFFAOYSA-N -1 1 319.320 4.091 20 0 DIADMM C[C@H](CSCc1ccccc1)C(=O)Nc1c([O-])cccc1F ZINC000610967277 1038409578 /nfs/dbraw/zinc/40/95/78/1038409578.db2.gz MIAYBMSZXNNKAI-GFCCVEGCSA-N -1 1 319.401 4.039 20 0 DIADMM O=C(Nc1c([O-])cccc1F)c1cc2cc(Cl)ccc2o1 ZINC000605435440 1038516018 /nfs/dbraw/zinc/51/60/18/1038516018.db2.gz FUWCDAUVBBOJMY-UHFFFAOYSA-N -1 1 305.692 4.183 20 0 DIADMM Cc1c2cc(Cl)ccc2oc1C(=O)Nc1c([O-])cccc1F ZINC000605435482 1038516623 /nfs/dbraw/zinc/51/66/23/1038516623.db2.gz GKCSEZZIIILNFP-UHFFFAOYSA-N -1 1 319.719 4.492 20 0 DIADMM C[C@H](Sc1nc(C(F)(F)F)cc(=O)[n-]1)c1cccc(F)c1 ZINC000605446903 1038518200 /nfs/dbraw/zinc/51/82/00/1038518200.db2.gz QSYGDUGRCIVJDY-ZETCQYMHSA-N -1 1 318.295 4.193 20 0 DIADMM Cc1c(Cl)cc(Nc2cc(F)nc(F)c2)c([O-])c1Cl ZINC001213083766 1038520357 /nfs/dbraw/zinc/52/03/57/1038520357.db2.gz RWBUXOAPMXEWSH-UHFFFAOYSA-N -1 1 305.111 4.424 20 0 DIADMM Cc1ccc(NC(=O)c2ccc(C(F)(F)F)c([O-])c2)cc1F ZINC000684868842 1038664804 /nfs/dbraw/zinc/66/48/04/1038664804.db2.gz HDLWEECGKRCOHU-UHFFFAOYSA-N -1 1 313.250 4.111 20 0 DIADMM CC(C)[C@@H](C(=O)Nc1ccc(F)cc1[O-])c1ccc(F)cc1 ZINC000533970647 1038786144 /nfs/dbraw/zinc/78/61/44/1038786144.db2.gz HRRMKVXOGKMRAT-MRXNPFEDSA-N -1 1 305.324 4.049 20 0 DIADMM O=C(Nc1ccc(F)cc1[O-])c1ccc(-c2ccccc2F)o1 ZINC000533971956 1038810148 /nfs/dbraw/zinc/81/01/48/1038810148.db2.gz PAJLSKLMEHPEBK-UHFFFAOYSA-N -1 1 315.275 4.183 20 0 DIADMM Cc1c(C(=O)Nc2c([O-])cccc2F)sc2nccc(C)c12 ZINC000608365185 1038829913 /nfs/dbraw/zinc/82/99/13/1038829913.db2.gz AVMXMJNNDRCESA-UHFFFAOYSA-N -1 1 316.357 4.010 20 0 DIADMM Cc1ccc(CCCCC(=O)Nc2c([O-])cccc2F)cc1 ZINC000608366990 1038830059 /nfs/dbraw/zinc/83/00/59/1038830059.db2.gz FMUOZYBAUAQHRQ-UHFFFAOYSA-N -1 1 301.361 4.191 20 0 DIADMM O=C(Nc1ccc([O-])c(F)c1F)C1(c2ccccc2)CCCC1 ZINC000456779747 1039075057 /nfs/dbraw/zinc/07/50/57/1039075057.db2.gz AHPYCNICJHFCLK-UHFFFAOYSA-N -1 1 317.335 4.121 20 0 DIADMM Cc1ccc(SCC(=O)Nc2ccc([O-])c(Cl)c2)c(C)c1 ZINC000541888370 1039755958 /nfs/dbraw/zinc/75/59/58/1039755958.db2.gz WGPREQXTZOOYPH-UHFFFAOYSA-N -1 1 321.829 4.393 20 0 DIADMM COc1ccc(C)cc1NC(=O)c1ccc2ccccc2c1[O-] ZINC000148690241 1039965620 /nfs/dbraw/zinc/96/56/20/1039965620.db2.gz GNHQVASEGBWESB-UHFFFAOYSA-N -1 1 307.349 4.115 20 0 DIADMM Cc1cccc2cc(C(=O)Nc3ccc(F)cc3[O-])sc21 ZINC000685448625 1040053368 /nfs/dbraw/zinc/05/33/68/1040053368.db2.gz CNHLFRDTRDBWRC-UHFFFAOYSA-N -1 1 301.342 4.307 20 0 DIADMM [O-]c1ccc(/C=C(\Cl)c2nc3cc(F)c(F)cc3[nH]2)cc1F ZINC000179324705 1040388109 /nfs/dbraw/zinc/38/81/09/1040388109.db2.gz CIJNXQSANIMVIC-BAQGIRSFSA-N -1 1 324.689 4.423 20 0 DIADMM O=C(Nc1ccc([O-])c(Cl)c1)[C@H]1C[C@H]1c1cc(F)ccc1F ZINC000173379669 1040888726 /nfs/dbraw/zinc/88/87/26/1040888726.db2.gz GIEUWNFQPFJSTP-JQWIXIFHSA-N -1 1 323.726 4.066 20 0 DIADMM CCSCc1cccc(NC(=O)c2ccc([O-])c(F)c2)c1 ZINC000613509778 1041040583 /nfs/dbraw/zinc/04/05/83/1041040583.db2.gz ORJQXXHEALOPHJ-UHFFFAOYSA-N -1 1 305.374 4.037 20 0 DIADMM O=C1Nc2cc(Cl)ccc2/C1=C\c1ccc([O-])c(Cl)c1 ZINC000103230912 1041341413 /nfs/dbraw/zinc/34/14/13/1041341413.db2.gz URRAHUGKTXPMMX-VZUCSPMQSA-N -1 1 306.148 4.192 20 0 DIADMM CCCOc1ccc(Cl)cc1NC(=O)c1ccc([O-])cc1F ZINC000181895340 1041366929 /nfs/dbraw/zinc/36/69/29/1041366929.db2.gz ZCNHSOBWAWIPMT-UHFFFAOYSA-N -1 1 323.751 4.226 20 0 DIADMM CCc1nc(SCc2ccc(OC)c(Cl)c2)[n-]c(=O)c1C ZINC000584732549 1041654410 /nfs/dbraw/zinc/65/44/10/1041654410.db2.gz PPDAOSNSBMBDEM-UHFFFAOYSA-N -1 1 324.833 4.007 20 0 DIADMM CC1(C)CN(C(=O)c2c([O-])cccc2Cl)[C@@H]1c1cccs1 ZINC000813785666 1041731413 /nfs/dbraw/zinc/73/14/13/1041731413.db2.gz FSKOABMQXCRDJE-CQSZACIVSA-N -1 1 321.829 4.330 20 0 DIADMM CC1(C)CN(C(=O)c2c([O-])cccc2Cl)[C@H]1c1cccs1 ZINC000813785665 1041731485 /nfs/dbraw/zinc/73/14/85/1041731485.db2.gz FSKOABMQXCRDJE-AWEZNQCLSA-N -1 1 321.829 4.330 20 0 DIADMM Cc1ccc(S(=O)(=O)[N-]c2c(C)cccc2C)cc1Cl ZINC000048653329 1042019836 /nfs/dbraw/zinc/01/98/36/1042019836.db2.gz DYZRGMRESYUSCX-UHFFFAOYSA-N -1 1 309.818 4.066 20 0 DIADMM O=C([O-])CCC1CCN(Cc2ccc(Cl)cc2Cl)CC1 ZINC000050926216 1042069686 /nfs/dbraw/zinc/06/96/86/1042069686.db2.gz HCEFBDXJPBXCBG-UHFFFAOYSA-N -1 1 316.228 4.070 20 0 DIADMM O=C(Nc1ccc2oc3ccccc3c2c1)c1ccc(O)cc1[O-] ZINC001135943598 1042112038 /nfs/dbraw/zinc/11/20/38/1042112038.db2.gz ROBVMPAHWDGTCW-UHFFFAOYSA-N -1 1 319.316 4.250 20 0 DIADMM [O-]c1ccc(F)c(-c2cccc(OC(F)(F)F)n2)c1Cl ZINC001245827598 1042137060 /nfs/dbraw/zinc/13/70/60/1042137060.db2.gz NTMIJFWMJLTZQN-UHFFFAOYSA-N -1 1 307.630 4.145 20 0 DIADMM CCN(Cc1ccc(C)cc1)C(=O)c1cc(Cl)ccc1[O-] ZINC001136183442 1042166411 /nfs/dbraw/zinc/16/64/11/1042166411.db2.gz FDJOZEZRAWNBQK-UHFFFAOYSA-N -1 1 303.789 4.016 20 0 DIADMM CC(C)(C)[C@@H]1CCCC[C@@H]1NC(=O)c1ccc(Cl)cc1[O-] ZINC001136181122 1042168293 /nfs/dbraw/zinc/16/82/93/1042168293.db2.gz CKBPPUBEHMSGPX-KGLIPLIRSA-N -1 1 309.837 4.380 20 0 DIADMM CC[C@@H]1c2ccsc2CCN1C(=O)c1cc(Cl)ccc1[O-] ZINC001136210665 1042178590 /nfs/dbraw/zinc/17/85/90/1042178590.db2.gz NFIGXAMZSKELQV-CYBMUJFWSA-N -1 1 321.829 4.257 20 0 DIADMM CC(C)(C)C[C@H](NC(=O)c1ccc([O-])c(F)c1)c1ccccc1 ZINC001136236328 1042188818 /nfs/dbraw/zinc/18/88/18/1042188818.db2.gz SOXKSQQJRYDALH-INIZCTEOSA-N -1 1 315.388 4.439 20 0 DIADMM CCN(C(=O)Cc1ccc([O-])c(Cl)c1)c1cc(C)cc(C)c1 ZINC001136350178 1042220548 /nfs/dbraw/zinc/22/05/48/1042220548.db2.gz BFVFJCBAVRIYDF-UHFFFAOYSA-N -1 1 317.816 4.258 20 0 DIADMM C[C@@H]1Cc2ccccc2N1C(=O)c1ccc2ccccc2c1[O-] ZINC000319762171 1042248609 /nfs/dbraw/zinc/24/86/09/1042248609.db2.gz CTRHJBHNIPUUEB-CYBMUJFWSA-N -1 1 303.361 4.137 20 0 DIADMM CC[C@H]([NH2+][C@H](C)c1nc(C)cc(=O)[nH]1)c1ccc(Cl)s1 ZINC000279045023 1042263153 /nfs/dbraw/zinc/26/31/53/1042263153.db2.gz GJSTYWYALVKTRC-ZJUUUORDSA-N -1 1 311.838 4.007 20 0 DIADMM CC(C)[C@@H]1CC[C@@H](C)C[C@@H]1CNC(=O)c1cc(Cl)ccc1[O-] ZINC001136487105 1042263559 /nfs/dbraw/zinc/26/35/59/1042263559.db2.gz AQEYEJSHVILWJH-NFAWXSAZSA-N -1 1 323.864 4.484 20 0 DIADMM Cc1cccc(C2(NC(=O)c3c([O-])cccc3F)CCCC2)c1 ZINC001136592467 1042288655 /nfs/dbraw/zinc/28/86/55/1042288655.db2.gz AOKDDNOBKVXJIX-UHFFFAOYSA-N -1 1 313.372 4.039 20 0 DIADMM O=C(Nc1cc([O-])c(F)cc1F)C1(CCc2ccccc2)CC1 ZINC000822542454 1042290438 /nfs/dbraw/zinc/29/04/38/1042290438.db2.gz ARFCUCSHQZMZTO-UHFFFAOYSA-N -1 1 317.335 4.022 20 0 DIADMM O=C(NCCCc1cccc(F)c1)c1cc2ccccc2cc1[O-] ZINC001136676531 1042312755 /nfs/dbraw/zinc/31/27/55/1042312755.db2.gz DHKQWRZOMXEUNY-UHFFFAOYSA-N -1 1 323.367 4.047 20 0 DIADMM Cc1ccccc1[C@H](NC(=O)c1cc(Cl)ccc1[O-])C(C)C ZINC001136736962 1042331652 /nfs/dbraw/zinc/33/16/52/1042331652.db2.gz UKSZPLHDVSDKHV-QGZVFWFLSA-N -1 1 317.816 4.481 20 0 DIADMM [O-]c1ccc(-c2noc([C@H]3CC[C@H](C(F)(F)F)C3)n2)cc1F ZINC000436871252 1042337749 /nfs/dbraw/zinc/33/77/49/1042337749.db2.gz GUICCSPJALVOCB-IUCAKERBSA-N -1 1 316.254 4.027 20 0 DIADMM COc1cc(-c2nc3cccc(C)c3c(=O)[n-]2)ccc1OC(C)C ZINC000614113595 1042411145 /nfs/dbraw/zinc/41/11/45/1042411145.db2.gz VFISAADOZUZYSA-UHFFFAOYSA-N -1 1 324.380 4.107 20 0 DIADMM O=c1c2c([n-]n1Cc1ccc(Cl)cc1Cl)CCCCC2 ZINC000614188534 1042424958 /nfs/dbraw/zinc/42/49/58/1042424958.db2.gz DRJSNNSAMAYGAA-GFCCVEGCSA-N -1 1 311.212 4.272 20 0 DIADMM C[C@H]1c2cc(Cl)cc(Cl)c2CCN1CCCCC(=O)[O-] ZINC000262211150 1042535763 /nfs/dbraw/zinc/53/57/63/1042535763.db2.gz IVZUXPAYZRYEMM-JTQLQIEISA-N -1 1 316.228 4.167 20 0 DIADMM O=C(c1cc2ccccc2cc1[O-])N1Cc2ccc(Cl)cc2C1 ZINC001299171842 1042697217 /nfs/dbraw/zinc/69/72/17/1042697217.db2.gz ZZIVWDDGFZEFMZ-UHFFFAOYSA-N -1 1 323.779 4.355 20 0 DIADMM CCc1nc(SCc2ccc(Cl)s2)[n-]c(=O)c1C ZINC000514873668 1042795802 /nfs/dbraw/zinc/79/58/02/1042795802.db2.gz QJOZWVFCGLRLMD-UHFFFAOYSA-N -1 1 300.836 4.060 20 0 DIADMM C[C@H](Sc1nc(C(F)F)cc(=O)[n-]1)c1ccc(F)cc1F ZINC000514972785 1042803275 /nfs/dbraw/zinc/80/32/75/1042803275.db2.gz SPFLRNOXEJVZPJ-LURJTMIESA-N -1 1 318.295 4.251 20 0 DIADMM CC(C)N(Cc1ccco1)Cc1ccc(C(=O)[O-])c(Cl)c1 ZINC000515305657 1042814980 /nfs/dbraw/zinc/81/49/80/1042814980.db2.gz DRQPPVJQWDSIFC-UHFFFAOYSA-N -1 1 307.777 4.042 20 0 DIADMM Cc1ccc(S(=O)(=O)[N-]c2cccc(C(C)C)c2)cc1F ZINC000515621459 1042829017 /nfs/dbraw/zinc/82/90/17/1042829017.db2.gz JYNBZJKSZDQAMJ-UHFFFAOYSA-N -1 1 307.390 4.058 20 0 DIADMM CSc1ccc([O-])c(-c2nc([C@@H]3CCC[C@H]4C[C@H]43)no2)c1 ZINC000664915883 1042994769 /nfs/dbraw/zinc/99/47/69/1042994769.db2.gz ITNYJWDENQKJKQ-MVWJERBFSA-N -1 1 302.399 4.068 20 0 DIADMM O=C([O-])CC[C@@H]1CCCCN1Cc1ccc(Cl)cc1Cl ZINC000050924957 1043064084 /nfs/dbraw/zinc/06/40/84/1043064084.db2.gz XTRFVACOTSAHPM-ZDUSSCGKSA-N -1 1 316.228 4.213 20 0 DIADMM Cc1ccc(C)c(NC(=O)Nc2cc([O-])c(Cl)cc2F)c1 ZINC001202767781 1043069992 /nfs/dbraw/zinc/06/99/92/1043069992.db2.gz LYOBPXZATOHQFX-UHFFFAOYSA-N -1 1 308.740 4.446 20 0 DIADMM Cc1nc(SCC[C@@H]2CC2(Cl)Cl)[n-]c(=O)c1C1CC1 ZINC000865373109 1043088703 /nfs/dbraw/zinc/08/87/03/1043088703.db2.gz GHRVMRZWCSPAQE-SECBINFHSA-N -1 1 319.257 4.044 20 0 DIADMM C[C@@H](c1ccco1)N(Cc1ccc(C(=O)[O-])c(Cl)c1)C1CC1 ZINC000520594406 1043230870 /nfs/dbraw/zinc/23/08/70/1043230870.db2.gz KERNVLLKTZWHKO-NSHDSACASA-N -1 1 319.788 4.357 20 0 DIADMM CCCCC1CCC(NC(=O)c2c(F)ccc([O-])c2F)CC1 ZINC000521257927 1043378861 /nfs/dbraw/zinc/37/88/61/1043378861.db2.gz RYUCVIKGEJIFOB-UHFFFAOYSA-N -1 1 311.372 4.149 20 0 DIADMM COc1cc(-c2nc(-c3ccccc3C)no2)cc(Cl)c1[O-] ZINC000443092813 1043492061 /nfs/dbraw/zinc/49/20/61/1043492061.db2.gz KVMJZVKWXLACCK-UHFFFAOYSA-N -1 1 316.744 4.080 20 0 DIADMM CCOc1cc(-c2nc(C(CC)CC)no2)cc(Cl)c1[O-] ZINC000443199346 1043509821 /nfs/dbraw/zinc/50/98/21/1043509821.db2.gz DGXVWJGDQPHOOF-UHFFFAOYSA-N -1 1 310.781 4.398 20 0 DIADMM CCOc1cccc(S(=O)(=O)[N-]c2ccccc2C(C)C)c1 ZINC000443406768 1043546941 /nfs/dbraw/zinc/54/69/41/1043546941.db2.gz NQFZZWFVOPOWDN-UHFFFAOYSA-N -1 1 319.426 4.010 20 0 DIADMM CCc1cccc(C(=O)Nc2cc(C)c(C(C)=O)c(C)c2)c1[O-] ZINC001303169286 1043555425 /nfs/dbraw/zinc/55/54/25/1043555425.db2.gz QFQFCMFYHYZOQJ-UHFFFAOYSA-N -1 1 311.381 4.026 20 0 DIADMM C[C@H]1CN(C(=O)c2cc3ccccc3cc2[O-])c2ccccc21 ZINC000398518775 1043562147 /nfs/dbraw/zinc/56/21/47/1043562147.db2.gz UPNQIGRZOCOHDM-ZDUSSCGKSA-N -1 1 303.361 4.309 20 0 DIADMM C[C@@H]1CN(C(=O)c2cc3ccccc3cc2[O-])c2ccccc21 ZINC000398518774 1043562596 /nfs/dbraw/zinc/56/25/96/1043562596.db2.gz UPNQIGRZOCOHDM-CYBMUJFWSA-N -1 1 303.361 4.309 20 0 DIADMM CC(C)c1nsc([N-]C(=O)c2cc(Cl)sc2Cl)n1 ZINC000874698197 1043597622 /nfs/dbraw/zinc/59/76/22/1043597622.db2.gz WRESBLLNUXOUEV-UHFFFAOYSA-N -1 1 322.242 4.282 20 0 DIADMM CC(C)(C)OCc1ccccc1NC(=O)c1ccc([O-])cc1F ZINC000928391471 1043748140 /nfs/dbraw/zinc/74/81/40/1043748140.db2.gz DCKMAKQUWIYHCN-UHFFFAOYSA-N -1 1 317.360 4.099 20 0 DIADMM CC(C)(C)OCc1ccccc1NC(=O)c1ccc([O-])c(F)c1 ZINC000928392260 1043749223 /nfs/dbraw/zinc/74/92/23/1043749223.db2.gz RSIRIAIOSQTZLZ-UHFFFAOYSA-N -1 1 317.360 4.099 20 0 DIADMM Cc1c(=O)[n-]c(SCOC2CCCC2)nc1-c1ccccc1 ZINC000289792033 1043877411 /nfs/dbraw/zinc/87/74/11/1043877411.db2.gz XTAOEUZEIOWHOK-UHFFFAOYSA-N -1 1 316.426 4.166 20 0 DIADMM CCN(Cn1c(CCC2CCCC2)n[nH]c1=S)C1CCCC1 ZINC000127395568 1043925511 /nfs/dbraw/zinc/92/55/11/1043925511.db2.gz KYZCQXNOKRIABK-UHFFFAOYSA-N -1 1 322.522 4.285 20 0 DIADMM C[C@H](Sc1nc(C(F)F)cc(=O)[n-]1)c1cccc(F)c1 ZINC000562043263 1044053607 /nfs/dbraw/zinc/05/36/07/1044053607.db2.gz HGPRRXCDRQLKFD-ZETCQYMHSA-N -1 1 300.305 4.112 20 0 DIADMM CCSc1cccc(F)c1[N-]C(=O)c1sc(C)nc1C ZINC000291643157 1044092328 /nfs/dbraw/zinc/09/23/28/1044092328.db2.gz LCSCOUQAEZMYEY-UHFFFAOYSA-N -1 1 310.419 4.263 20 0 DIADMM Cc1nc(SCC[C@H]2CCCC2(F)F)[n-]c(=O)c1C1CC1 ZINC000882277248 1044162037 /nfs/dbraw/zinc/16/20/37/1044162037.db2.gz CBYYLACXUZRVTB-LLVKDONJSA-N -1 1 314.401 4.286 20 0 DIADMM Cc1nc(SC[C@@H]2CC(C)(C)OC2(C)C)[n-]c(=O)c1C1CC1 ZINC000882277391 1044162155 /nfs/dbraw/zinc/16/21/55/1044162155.db2.gz INCXKNHTVVVCRI-LBPRGKRZSA-N -1 1 322.474 4.054 20 0 DIADMM O=C(Nc1ccc([O-])c(Cl)c1)c1ccccc1OCC1CC1 ZINC000129585387 1044163948 /nfs/dbraw/zinc/16/39/48/1044163948.db2.gz FLVKOFJNUPFDAN-UHFFFAOYSA-N -1 1 317.772 4.087 20 0 DIADMM O=C([O-])c1cccc(CN2CCC[C@H]2c2ccsc2)c1Cl ZINC000563279515 1044242740 /nfs/dbraw/zinc/24/27/40/1044242740.db2.gz VWNMKZNIWUHQCH-AWEZNQCLSA-N -1 1 321.829 4.437 20 0 DIADMM CC(C)(C)SCCSCc1cc(=O)oc2cc([O-])ccc12 ZINC000783555721 1044275491 /nfs/dbraw/zinc/27/54/91/1044275491.db2.gz SDSYFJBHIKCOQU-UHFFFAOYSA-N -1 1 324.467 4.264 20 0 DIADMM CC1(C)C(=O)CCC[C@@H]1Oc1cc(Cl)c([O-])cc1Cl ZINC001227645885 1044361500 /nfs/dbraw/zinc/36/15/00/1044361500.db2.gz MQXSGVFXXKPTDB-ZDUSSCGKSA-N -1 1 303.185 4.226 20 0 DIADMM CC(C)(C)C[C@@H](NC(=O)c1c([O-])cccc1Cl)C(F)(F)F ZINC000778458284 1044410503 /nfs/dbraw/zinc/41/05/03/1044410503.db2.gz VTXFDESBOJOESB-SNVBAGLBSA-N -1 1 323.742 4.143 20 0 DIADMM O=C(NCc1ccccc1)Nc1cc(Cl)c(Cl)cc1[O-] ZINC001202633960 1044424799 /nfs/dbraw/zinc/42/47/99/1044424799.db2.gz POVKFNIIVIOYOQ-UHFFFAOYSA-N -1 1 311.168 4.021 20 0 DIADMM C[C@H](c1ccc(Cl)cc1Cl)N1CC[C@@H](C)[C@H](C(=O)[O-])C1 ZINC000566067930 1044472632 /nfs/dbraw/zinc/47/26/32/1044472632.db2.gz JGOITUXCMRJYBC-GIPNMCIBSA-N -1 1 316.228 4.097 20 0 DIADMM CC(C)(CC(F)(F)F)C(=O)Nc1cc(F)c([O-])cc1Cl ZINC000885680709 1044585542 /nfs/dbraw/zinc/58/55/42/1044585542.db2.gz WTZDVBUVFQUZCJ-UHFFFAOYSA-N -1 1 313.678 4.102 20 0 DIADMM CC(=O)c1cc(NC(=O)c2cc([O-])c3ccccc3c2)ccc1F ZINC000568612714 1044638100 /nfs/dbraw/zinc/63/81/00/1044638100.db2.gz VYIAZNFXEZRGJT-UHFFFAOYSA-N -1 1 323.323 4.139 20 0 DIADMM CC(C)[C@@H]1OCCC[C@@H]1c1nc(-c2ccc([O-])cc2Cl)no1 ZINC000568750252 1044646641 /nfs/dbraw/zinc/64/66/41/1044646641.db2.gz FHOYJIIAOIFCPI-JSGCOSHPSA-N -1 1 322.792 4.014 20 0 DIADMM CCOc1cc(-c2noc(C[C@@H]3C=CCC3)n2)cc(Cl)c1[O-] ZINC000445424996 1044714625 /nfs/dbraw/zinc/71/46/25/1044714625.db2.gz ALSPFUZHTNDQDG-SNVBAGLBSA-N -1 1 320.776 4.003 20 0 DIADMM CCOc1cc(-c2noc(CC(C)(C)C)n2)cc(Cl)c1[O-] ZINC000445407941 1044715187 /nfs/dbraw/zinc/71/51/87/1044715187.db2.gz WQHWJBYCEPGDIE-UHFFFAOYSA-N -1 1 310.781 4.083 20 0 DIADMM [O-]c1ccc(-c2noc(-c3ccc4ncccc4c3)n2)c(Cl)c1 ZINC000445449582 1044718665 /nfs/dbraw/zinc/71/86/65/1044718665.db2.gz VWDXQBRCTCGGMR-UHFFFAOYSA-N -1 1 323.739 4.311 20 0 DIADMM [O-]c1ccc(-c2noc(-c3ccc(F)c(F)c3)n2)c(Cl)c1 ZINC000445447048 1044718872 /nfs/dbraw/zinc/71/88/72/1044718872.db2.gz GNOKVEBXZBPLFT-UHFFFAOYSA-N -1 1 308.671 4.041 20 0 DIADMM C[C@H](Oc1ccccc1)c1nc(-c2ccc([O-])cc2Cl)no1 ZINC000445448650 1044718932 /nfs/dbraw/zinc/71/89/32/1044718932.db2.gz WNOURAVIMPZNHS-JTQLQIEISA-N -1 1 316.744 4.236 20 0 DIADMM CCOc1cc(-c2noc(-c3occc3C)n2)cc(Cl)c1[O-] ZINC000445421808 1044719304 /nfs/dbraw/zinc/71/93/04/1044719304.db2.gz ISTYMQUQXJYGTK-UHFFFAOYSA-N -1 1 320.732 4.063 20 0 DIADMM C[C@H](Sc1nc(C(F)(F)F)cc(=O)[n-]1)c1ccc(F)cc1 ZINC000524032584 1044722113 /nfs/dbraw/zinc/72/21/13/1044722113.db2.gz YLULUHPYZXNTHL-ZETCQYMHSA-N -1 1 318.295 4.193 20 0 DIADMM Cc1ccccc1CCc1nc(-c2ccc([O-])cc2Cl)no1 ZINC000445446565 1044722554 /nfs/dbraw/zinc/72/25/54/1044722554.db2.gz FABHHXOXODYNKB-UHFFFAOYSA-N -1 1 314.772 4.189 20 0 DIADMM [O-]c1ccc(-c2noc(/C=C/c3ccc(Cl)s3)n2)cc1F ZINC000445467883 1044725137 /nfs/dbraw/zinc/72/51/37/1044725137.db2.gz BPHWJMOVRSYKRX-ZZXKWVIFSA-N -1 1 322.748 4.467 20 0 DIADMM C[C@@H](Cc1nc(-c2ccc([O-])c(F)c2)no1)c1cccc(F)c1 ZINC000445478656 1044728940 /nfs/dbraw/zinc/72/89/40/1044728940.db2.gz HRZKBJZWGSRJTA-JTQLQIEISA-N -1 1 316.307 4.067 20 0 DIADMM Cc1ccc(C(F)(F)c2nc(-c3ccc([O-])c(F)c3)no2)cc1 ZINC000445477022 1044729173 /nfs/dbraw/zinc/72/91/73/1044729173.db2.gz LISXRMHNVKMMDH-UHFFFAOYSA-N -1 1 320.270 4.030 20 0 DIADMM Cc1ccc(O[C@H](C)c2nc(-c3ccc([O-])c(F)c3)no2)cc1 ZINC000445479602 1044729858 /nfs/dbraw/zinc/72/98/58/1044729858.db2.gz WLFCEBJMPLYCCM-LLVKDONJSA-N -1 1 314.316 4.030 20 0 DIADMM C[C@@H](Sc1ccccc1)c1nc(-c2ccc([O-])c(F)c2)no1 ZINC000445479337 1044730025 /nfs/dbraw/zinc/73/00/25/1044730025.db2.gz VPBGPGZFOSZUMO-SNVBAGLBSA-N -1 1 316.357 4.435 20 0 DIADMM Cc1ccccc1[C@@H](C)Cc1nc(-c2ccc([O-])c(F)c2)no1 ZINC000445482659 1044731839 /nfs/dbraw/zinc/73/18/39/1044731839.db2.gz SZKAZESXSDLITB-LBPRGKRZSA-N -1 1 312.344 4.236 20 0 DIADMM [O-]c1ccc(-c2noc(-c3ccc(Cl)c(F)c3)n2)cc1F ZINC000445484089 1044732571 /nfs/dbraw/zinc/73/25/71/1044732571.db2.gz VIPZVAWGWQDILM-UHFFFAOYSA-N -1 1 308.671 4.041 20 0 DIADMM Cc1ccc(C[C@H](C)c2nc(-c3ccc([O-])c(F)c3)no2)cc1 ZINC000445483167 1044732867 /nfs/dbraw/zinc/73/28/67/1044732867.db2.gz RMASLYNPWHZQIW-LBPRGKRZSA-N -1 1 312.344 4.236 20 0 DIADMM CC(F)(F)c1cccc(NC(=O)c2c(F)ccc([O-])c2F)c1 ZINC000576669261 1045071268 /nfs/dbraw/zinc/07/12/68/1045071268.db2.gz AXLBLKXJUPKRBW-UHFFFAOYSA-N -1 1 313.250 4.034 20 0 DIADMM O=c1cc(C(F)F)nc(SCc2ccc(Cl)c(F)c2)[n-]1 ZINC000576971442 1045091858 /nfs/dbraw/zinc/09/18/58/1045091858.db2.gz VCPUKISHPKWVSF-UHFFFAOYSA-N -1 1 320.723 4.205 20 0 DIADMM CCOc1cccc(Cl)c1CSc1nc(CC)cc(=O)[n-]1 ZINC000577192689 1045106465 /nfs/dbraw/zinc/10/64/65/1045106465.db2.gz RLZSOSDYASEYIX-UHFFFAOYSA-N -1 1 324.833 4.089 20 0 DIADMM C[C@@H](NC(=O)c1c(F)ccc([O-])c1F)[C@@H](C)C1CCCCC1 ZINC000577562290 1045137715 /nfs/dbraw/zinc/13/77/15/1045137715.db2.gz YBPMBCROKBJTNQ-GHMZBOCLSA-N -1 1 311.372 4.005 20 0 DIADMM COc1cc(C(=O)Nc2ccc(C(C)C)cc2)cc(Cl)c1[O-] ZINC000578242820 1045222928 /nfs/dbraw/zinc/22/29/28/1045222928.db2.gz PALHJWRTJXLYOE-UHFFFAOYSA-N -1 1 319.788 4.430 20 0 DIADMM Cc1oc([C@H](C)N(C)Cc2cc3ccccc3o2)cc1C(=O)[O-] ZINC000579484380 1045317339 /nfs/dbraw/zinc/31/73/39/1045317339.db2.gz MILOJVIEEFAILH-NSHDSACASA-N -1 1 313.353 4.225 20 0 DIADMM O=C(CC(C1CCC1)C1CCC1)Nc1ccc([O-])c(F)c1F ZINC000627680619 1045382438 /nfs/dbraw/zinc/38/24/38/1045382438.db2.gz UASVIJHXZXIFTK-UHFFFAOYSA-N -1 1 309.356 4.215 20 0 DIADMM [O-]c1cccc(CN2CC3(CCC3)[C@H]2c2ccco2)c1Cl ZINC000449634359 1045424714 /nfs/dbraw/zinc/42/47/14/1045424714.db2.gz ACMBVOKSKSHMEQ-MRXNPFEDSA-N -1 1 303.789 4.366 20 0 DIADMM Cc1ccc(C(=O)Nc2ccc([O-])c(Cl)c2)c(C(C)C)n1 ZINC000450294262 1045485759 /nfs/dbraw/zinc/48/57/59/1045485759.db2.gz MGNMYIZHPGAVJR-UHFFFAOYSA-N -1 1 304.777 4.125 20 0 DIADMM CCN(C(=O)c1c([O-])cccc1Cl)[C@H](C)Cc1ccsc1 ZINC000779334925 1045597782 /nfs/dbraw/zinc/59/77/82/1045597782.db2.gz SZBHVFNULJKPLY-LLVKDONJSA-N -1 1 323.845 4.200 20 0 DIADMM C[C@H]1[C@H](c2ccccc2)CCN1C(=O)c1c([O-])cccc1Cl ZINC000751426303 1045605596 /nfs/dbraw/zinc/60/55/96/1045605596.db2.gz QHCVTOGZCNXMRS-GXTWGEPZSA-N -1 1 315.800 4.064 20 0 DIADMM C[C@@H](C#N)Oc1ccccc1NCc1c([O-])ccc(Cl)c1F ZINC000191575928 1045729579 /nfs/dbraw/zinc/72/95/79/1045729579.db2.gz IIKCDNWKNIVYQR-JTQLQIEISA-N -1 1 320.751 4.088 20 0 DIADMM Cc1oc(C(=O)[O-])cc1CN[C@@H](C)c1oc2ccccc2c1C ZINC000901463985 1045739830 /nfs/dbraw/zinc/73/98/30/1045739830.db2.gz DKCWNUWDSLMNFT-NSHDSACASA-N -1 1 313.353 4.192 20 0 DIADMM Cc1nc(SCc2ccccc2CF)[n-]c(=O)c1C1CC1 ZINC000901585545 1045770460 /nfs/dbraw/zinc/77/04/60/1045770460.db2.gz CSHOLSJVOPJIKU-UHFFFAOYSA-N -1 1 304.390 4.130 20 0 DIADMM Cc1cc(C)c(/C=C/CN[C@@H](C(=O)[O-])c2cccs2)cc1C ZINC000901598699 1045775105 /nfs/dbraw/zinc/77/51/05/1045775105.db2.gz PVXBCCFFNBMYIH-UKINESCASA-N -1 1 315.438 4.102 20 0 DIADMM CC(C)CCOCCSc1nc(-c2ccccc2)cc(=O)[n-]1 ZINC000901618369 1045778949 /nfs/dbraw/zinc/77/89/49/1045778949.db2.gz FPDUGDLFGJHARA-UHFFFAOYSA-N -1 1 318.442 4.004 20 0 DIADMM CO[C@H](CSc1nc(-c2ccccc2)cc(=O)[n-]1)CC(C)C ZINC000901615320 1045779035 /nfs/dbraw/zinc/77/90/35/1045779035.db2.gz DBEZIZDEFKIHGV-AWEZNQCLSA-N -1 1 318.442 4.002 20 0 DIADMM CO[C@@H](CSc1nc(-c2ccccc2)cc(=O)[n-]1)CC(C)C ZINC000901615321 1045780097 /nfs/dbraw/zinc/78/00/97/1045780097.db2.gz DBEZIZDEFKIHGV-CQSZACIVSA-N -1 1 318.442 4.002 20 0 DIADMM CC[C@H](C)C[C@@H](NCc1ccc(-c2ccc(F)cc2)o1)C(=O)[O-] ZINC000901674416 1045791883 /nfs/dbraw/zinc/79/18/83/1045791883.db2.gz ALFVKVIMNFATJI-BLLLJJGKSA-N -1 1 319.376 4.065 20 0 DIADMM Cc1nc(S[C@@H](C)c2cccc(F)c2)[n-]c(=O)c1C1CC1 ZINC000631024232 1045797952 /nfs/dbraw/zinc/79/79/52/1045797952.db2.gz PKIOJGGTCLDLII-JTQLQIEISA-N -1 1 304.390 4.360 20 0 DIADMM Cc1nc(SCc2ccc(Cl)s2)[n-]c(=O)c1C1CC1 ZINC000631024127 1045798528 /nfs/dbraw/zinc/79/85/28/1045798528.db2.gz LOQIRWYJFNFCQL-UHFFFAOYSA-N -1 1 312.847 4.375 20 0 DIADMM Cc1nc(S[C@H](C)c2cc(F)ccc2F)[n-]c(=O)c1C1CC1 ZINC000631024235 1045798991 /nfs/dbraw/zinc/79/89/91/1045798991.db2.gz PPUCMKRHWSPQSP-SECBINFHSA-N -1 1 322.380 4.500 20 0 DIADMM Cc1cc(CNC/C=C/c2cc(C)c(C)cc2C)oc1C(=O)[O-] ZINC000901938328 1045874751 /nfs/dbraw/zinc/87/47/51/1045874751.db2.gz NDWNAPVZPVMAGN-AATRIKPKSA-N -1 1 313.397 4.014 20 0 DIADMM O=C(c1ccc([O-])cc1F)N1CCC[C@@H]1CCC1CCCC1 ZINC001137527364 1045885710 /nfs/dbraw/zinc/88/57/10/1045885710.db2.gz WFLCSZBJIQGOAP-CQSZACIVSA-N -1 1 305.393 4.106 20 0 DIADMM O=C(c1ccc([O-])cc1F)N1CCC[C@H]1CCC1CCCC1 ZINC001137527363 1045886179 /nfs/dbraw/zinc/88/61/79/1045886179.db2.gz WFLCSZBJIQGOAP-AWEZNQCLSA-N -1 1 305.393 4.106 20 0 DIADMM Cc1ccc(-c2ccc(CN(C)[C@@H](CC(C)C)C(=O)[O-])o2)cc1 ZINC000902019443 1045889294 /nfs/dbraw/zinc/88/92/94/1045889294.db2.gz PTBMOZZSSNDJJA-KRWDZBQOSA-N -1 1 315.413 4.186 20 0 DIADMM CCc1oc(CN[C@H](CC)c2ccc(C)cc2)cc1C(=O)[O-] ZINC000902214366 1045944120 /nfs/dbraw/zinc/94/41/20/1045944120.db2.gz QNXBBYGRHXJHCR-MRXNPFEDSA-N -1 1 301.386 4.090 20 0 DIADMM Cc1oc(CN[C@@H](c2ccc(F)cc2)C2CCC2)cc1C(=O)[O-] ZINC000902224298 1045951052 /nfs/dbraw/zinc/95/10/52/1045951052.db2.gz HTQILRGYDFITMP-QGZVFWFLSA-N -1 1 317.360 4.056 20 0 DIADMM CCc1oc(CN[C@@](C)(CC)c2ccc(F)cc2)cc1C(=O)[O-] ZINC000902336874 1045978825 /nfs/dbraw/zinc/97/88/25/1045978825.db2.gz QSAJGTLQMGWAGX-SFHVURJKSA-N -1 1 319.376 4.094 20 0 DIADMM CCc1oc(CNC(C)(C)c2ccc(CC)cc2)cc1C(=O)[O-] ZINC000902332922 1045979135 /nfs/dbraw/zinc/97/91/35/1045979135.db2.gz YFEYYNQSJLAJEA-UHFFFAOYSA-N -1 1 315.413 4.128 20 0 DIADMM Cc1cc(Br)c([O-])c(NC(=O)/C=C2/CC[C@H](C)C2)c1 ZINC001137838846 1045979497 /nfs/dbraw/zinc/97/94/97/1045979497.db2.gz XHCIATQQNHVHTF-ANHFWZFOSA-N -1 1 324.218 4.148 20 0 DIADMM CC(C)=C(C)CC(=O)Nc1cc(C)cc(Br)c1[O-] ZINC001137838287 1045981894 /nfs/dbraw/zinc/98/18/94/1045981894.db2.gz LQMHCQRHDZAXFH-UHFFFAOYSA-N -1 1 312.207 4.148 20 0 DIADMM CC(C)(C)[C@@H](NCc1ccoc1C(=O)[O-])c1ccc(F)cc1F ZINC000902382277 1045988020 /nfs/dbraw/zinc/98/80/20/1045988020.db2.gz SQXHSXFUAGSRDM-HNNXBMFYSA-N -1 1 323.339 4.133 20 0 DIADMM CCc1oc(CN[C@@H]2CCCc3c(C)cccc32)cc1C(=O)[O-] ZINC000902466703 1046002259 /nfs/dbraw/zinc/00/22/59/1046002259.db2.gz RXTHCTXPSBSKGV-QGZVFWFLSA-N -1 1 313.397 4.016 20 0 DIADMM O=C(Nc1cc(Cl)c(F)c(Cl)c1)c1ccc([O-])c(F)c1 ZINC000757643618 1046197883 /nfs/dbraw/zinc/19/78/83/1046197883.db2.gz PPLOANHSSKUTIR-UHFFFAOYSA-N -1 1 318.106 4.230 20 0 DIADMM CCc1cc(=O)[n-]c(S[C@@H]2CCc3cc(Cl)ccc32)n1 ZINC000795228511 1046210950 /nfs/dbraw/zinc/21/09/50/1046210950.db2.gz KBMCQCDVCKRRJK-CYBMUJFWSA-N -1 1 306.818 4.178 20 0 DIADMM [O-]c1c(F)cc(Nc2ccc(Br)cc2F)cc1F ZINC001212870608 1046237795 /nfs/dbraw/zinc/23/77/95/1046237795.db2.gz IJXBFQFDPJSION-UHFFFAOYSA-N -1 1 318.092 4.316 20 0 DIADMM C[C@@H]1CCN(C(=O)c2cc(Cl)ccc2[O-])CC12CCCCC2 ZINC001138547148 1046224064 /nfs/dbraw/zinc/22/40/64/1046224064.db2.gz JIZPLTQHBOXKEG-CYBMUJFWSA-N -1 1 321.848 4.478 20 0 DIADMM [O-]c1c(Cl)nccc1Nc1ccc(Br)cc1F ZINC001212870250 1046234691 /nfs/dbraw/zinc/23/46/91/1046234691.db2.gz QRDYEBUNSROWFQ-UHFFFAOYSA-N -1 1 317.545 4.086 20 0 DIADMM COc1ccc(C)cc1NC(=O)Nc1cccc([O-])c1Cl ZINC001202869890 1046310352 /nfs/dbraw/zinc/31/03/52/1046310352.db2.gz OQRMOJROCUPFLO-UHFFFAOYSA-N -1 1 306.749 4.007 20 0 DIADMM CC/C(C)=C(/C)C(=O)Nc1cc(C)cc(Br)c1[O-] ZINC000781022047 1046416960 /nfs/dbraw/zinc/41/69/60/1046416960.db2.gz VPGZFEWFVDKAMV-KTKRTIGZSA-N -1 1 312.207 4.148 20 0 DIADMM COCOc1cccc(Nc2ccc(Cl)c(Cl)c2[O-])c1 ZINC001212902176 1046501982 /nfs/dbraw/zinc/50/19/82/1046501982.db2.gz XHHDERCTKAZZQP-UHFFFAOYSA-N -1 1 314.168 4.425 20 0 DIADMM O=C(c1ccc2ccccc2c1[O-])N1CC[C@H]1c1cccc(F)c1 ZINC000678314021 1046617014 /nfs/dbraw/zinc/61/70/14/1046617014.db2.gz PIVBHQONCTZMRF-SFHVURJKSA-N -1 1 321.351 4.272 20 0 DIADMM COc1ccc(Nc2c([O-])cc(F)cc2F)cc1OC(C)C ZINC001203018233 1046631929 /nfs/dbraw/zinc/63/19/29/1046631929.db2.gz ZBJZDJWRQPYFLS-UHFFFAOYSA-N -1 1 309.312 4.210 20 0 DIADMM Cc1cc2[nH]c(C(=O)Nc3ccc([O-])c(Cl)c3)cc2c(C)c1 ZINC000533540338 1046749266 /nfs/dbraw/zinc/74/92/66/1046749266.db2.gz LAIAWCMQZJDBJR-UHFFFAOYSA-N -1 1 314.772 4.396 20 0 DIADMM CC/C(=C\C(=O)Nc1ccc([O-])c(F)c1F)c1ccc(C)cc1 ZINC001140652297 1046833714 /nfs/dbraw/zinc/83/37/14/1046833714.db2.gz ITWFBDCIIBKGPF-ZRDIBKRKSA-N -1 1 317.335 4.411 20 0 DIADMM [O-]c1cccc(CN2CCn3c(cc4ccccc43)C2)c1Cl ZINC000646205870 1046874767 /nfs/dbraw/zinc/87/47/67/1046874767.db2.gz GTFFJVGKLPNWCT-UHFFFAOYSA-N -1 1 312.800 4.016 20 0 DIADMM CN(Cc1cccc(O)c1)Cc1cc(Cl)c([O-])c(Cl)c1 ZINC001140829404 1046919723 /nfs/dbraw/zinc/91/97/23/1046919723.db2.gz IRDUMOMECUMJRV-UHFFFAOYSA-N -1 1 312.196 4.037 20 0 DIADMM CC(=O)Oc1ccc(Nc2cc(Cl)c([O-])cc2Cl)cc1 ZINC001212079399 1046930640 /nfs/dbraw/zinc/93/06/40/1046930640.db2.gz BRXXMNRXIZKVCX-UHFFFAOYSA-N -1 1 312.152 4.368 20 0 DIADMM [O-]c1ccc(CN2CCC[C@H]2c2ccc(F)cc2)c(F)c1F ZINC001140889687 1046942710 /nfs/dbraw/zinc/94/27/10/1046942710.db2.gz JPGYOXJJDPCFRI-AWEZNQCLSA-N -1 1 307.315 4.147 20 0 DIADMM COc1ccc([C@@H]2CCCN2Cc2ccc([O-])c(F)c2F)cc1 ZINC001140893077 1046943409 /nfs/dbraw/zinc/94/34/09/1046943409.db2.gz FFFRMWHTXZQASG-HNNXBMFYSA-N -1 1 319.351 4.016 20 0 DIADMM [O-]c1ccc(CN2CCC[C@@H]2c2cccc(F)c2)c(F)c1F ZINC001140892453 1046943623 /nfs/dbraw/zinc/94/36/23/1046943623.db2.gz NWJCNRHNKINSKO-CQSZACIVSA-N -1 1 307.315 4.147 20 0 DIADMM COc1cccc([C@H]2CCCN2Cc2ccc([O-])c(F)c2F)c1 ZINC001140893705 1046944479 /nfs/dbraw/zinc/94/44/79/1046944479.db2.gz ZICMJYGSHGZGDP-OAHLLOKOSA-N -1 1 319.351 4.016 20 0 DIADMM O=C([O-])c1ccc(CN2CCC(c3ccccc3Cl)CC2)o1 ZINC001140947467 1046958379 /nfs/dbraw/zinc/95/83/79/1046958379.db2.gz PJALTQRSJBNVKP-UHFFFAOYSA-N -1 1 319.788 4.011 20 0 DIADMM C[C@@H](c1cc(Cl)ccc1Cl)N1CCC(CC(=O)[O-])CC1 ZINC000093682313 1046963760 /nfs/dbraw/zinc/96/37/60/1046963760.db2.gz SJTYONQBNGCHJY-JTQLQIEISA-N -1 1 316.228 4.241 20 0 DIADMM CSc1ccc([C@@H](C)NC(=O)c2c([O-])cccc2Cl)cc1 ZINC000799067493 1046997690 /nfs/dbraw/zinc/99/76/90/1046997690.db2.gz VHJWETRRIVZJGZ-SNVBAGLBSA-N -1 1 321.829 4.259 20 0 DIADMM Cc1ccc(C(=O)Nc2cccc([O-])c2Br)c(C)c1 ZINC001141218569 1047048255 /nfs/dbraw/zinc/04/82/55/1047048255.db2.gz DTCGUWUUVIVWRB-UHFFFAOYSA-N -1 1 320.186 4.024 20 0 DIADMM C[C@@H]1CCN(C(=O)c2cc(F)ccc2[O-])c2ccccc2S1 ZINC000536691469 1047072321 /nfs/dbraw/zinc/07/23/21/1047072321.db2.gz RRHNGHNIWZLJSX-LLVKDONJSA-N -1 1 317.385 4.062 20 0 DIADMM C[C@@H](c1cccc(Cl)c1)N(C)C(=O)c1ccc([O-])c(F)c1 ZINC000681017297 1047081697 /nfs/dbraw/zinc/08/16/97/1047081697.db2.gz PGKDYOFBBHHHTA-JTQLQIEISA-N -1 1 307.752 4.018 20 0 DIADMM Cc1cc2sc(NC(=O)c3ccc([O-])c(F)c3)nc2c(C)c1 ZINC000681015090 1047082657 /nfs/dbraw/zinc/08/26/57/1047082657.db2.gz CSCFMWLKBSLCNZ-UHFFFAOYSA-N -1 1 316.357 4.010 20 0 DIADMM O=C(NC(c1ccccc1)c1ccccc1)c1ccc([O-])c(F)c1 ZINC000681016543 1047082903 /nfs/dbraw/zinc/08/29/03/1047082903.db2.gz ZWNOWHQAMDMHGM-UHFFFAOYSA-N -1 1 321.351 4.051 20 0 DIADMM CC[C@H](c1ccccc1)N(CC)C(=O)c1ccc([O-])c(F)c1 ZINC000681034764 1047084166 /nfs/dbraw/zinc/08/41/66/1047084166.db2.gz DGYZCYBHFKPNJS-MRXNPFEDSA-N -1 1 301.361 4.145 20 0 DIADMM Cc1ccc(CSc2nc(-c3ccccc3)c(C)c(=O)[n-]2)nc1 ZINC000681023905 1047084518 /nfs/dbraw/zinc/08/45/18/1047084518.db2.gz ORVHTAVUXGEGMV-UHFFFAOYSA-N -1 1 323.421 4.153 20 0 DIADMM C[C@@H](CC(C)(C)c1ccccc1)NC(=O)c1ccc([O-])c(F)c1 ZINC000681025844 1047085711 /nfs/dbraw/zinc/08/57/11/1047085711.db2.gz SWVSRJRWJJBZPV-ZDUSSCGKSA-N -1 1 315.388 4.018 20 0 DIADMM CCCN(C(=O)c1ccc([O-])c(F)c1)[C@H]1CCc2ccccc21 ZINC000681036391 1047085749 /nfs/dbraw/zinc/08/57/49/1047085749.db2.gz YCXAWUXQJLIWJS-KRWDZBQOSA-N -1 1 313.372 4.071 20 0 DIADMM CCCCN(C(=O)c1ccc([O-])c(F)c1)[C@@H](C)c1ccc(C)o1 ZINC000681036729 1047085941 /nfs/dbraw/zinc/08/59/41/1047085941.db2.gz XJVKPQNDDFTBNN-ZDUSSCGKSA-N -1 1 319.376 4.436 20 0 DIADMM CCSc1ccc([C@@H](C)NC(=O)c2ccc([O-])c(F)c2)cc1 ZINC000681041694 1047086415 /nfs/dbraw/zinc/08/64/15/1047086415.db2.gz CPDMGVRUIRTUQU-LLVKDONJSA-N -1 1 319.401 4.134 20 0 DIADMM CN(C(=O)c1ccc([O-])c(F)c1)c1ccc(-c2ccccc2)cc1 ZINC000681050549 1047086860 /nfs/dbraw/zinc/08/68/60/1047086860.db2.gz NMTLANBJXHBQFR-UHFFFAOYSA-N -1 1 321.351 4.475 20 0 DIADMM Cc1ccc([C@@H]2C[C@@H](C)CCN2C(=O)c2ccc([O-])c(F)c2)o1 ZINC000681052326 1047087329 /nfs/dbraw/zinc/08/73/29/1047087329.db2.gz ONPWNWPYBHXSSL-NHYWBVRUSA-N -1 1 317.360 4.046 20 0 DIADMM Cc1ccc([C@@H]2C[C@H](C)CCN2C(=O)c2ccc([O-])c(F)c2)o1 ZINC000681052322 1047088295 /nfs/dbraw/zinc/08/82/95/1047088295.db2.gz ONPWNWPYBHXSSL-ABAIWWIYSA-N -1 1 317.360 4.046 20 0 DIADMM O=C(Nc1ncc(C2CCCCC2)s1)c1ccc([O-])c(F)c1 ZINC000681068913 1047089986 /nfs/dbraw/zinc/08/99/86/1047089986.db2.gz TWHPTGMRGPBORK-UHFFFAOYSA-N -1 1 320.389 4.288 20 0 DIADMM CC(C)(C)OCc1ccc(NC(=O)c2ccc([O-])c(F)c2)cc1 ZINC000681053988 1047090420 /nfs/dbraw/zinc/09/04/20/1047090420.db2.gz IAVYQZSQDVLFPU-UHFFFAOYSA-N -1 1 317.360 4.099 20 0 DIADMM O=C(c1cc(F)ccc1[O-])N1CC2(CC=CC2)[C@H]1c1ccccc1 ZINC000649154989 1047112396 /nfs/dbraw/zinc/11/23/96/1047112396.db2.gz ZTHCMAPCEROLRO-GOSISDBHSA-N -1 1 323.367 4.065 20 0 DIADMM O=C(c1ccc([O-])cc1F)N1CC2(CC=CC2)[C@H]1c1ccccc1 ZINC000649154313 1047112613 /nfs/dbraw/zinc/11/26/13/1047112613.db2.gz KPNVGOLMFRNATI-GOSISDBHSA-N -1 1 323.367 4.065 20 0 DIADMM O=C(NC1(c2ccccc2)CCC1)c1cc2ccccc2cc1[O-] ZINC001141503889 1047151404 /nfs/dbraw/zinc/15/14/04/1047151404.db2.gz GCXRBCCKJGGMPA-UHFFFAOYSA-N -1 1 317.388 4.355 20 0 DIADMM CC[C@H](C)CCCCC(=O)Nc1ccc(-c2cc(=O)[nH][n-]2)cc1 ZINC001141538702 1047172040 /nfs/dbraw/zinc/17/20/40/1047172040.db2.gz UIDCTSGTPLVAPP-ZDUSSCGKSA-N -1 1 315.417 4.327 20 0 DIADMM C[C@@H]1CCN(C(=O)c2cc(Cl)ccc2[O-])[C@H]2CCCC[C@@H]12 ZINC001141567134 1047194882 /nfs/dbraw/zinc/19/48/82/1047194882.db2.gz GNRKBSFAHHSYRY-ZLDLUXBVSA-N -1 1 307.821 4.086 20 0 DIADMM O=C(CSc1ccc2ccccc2c1)c1ccc([O-])cc1O ZINC000010439910 1047195005 /nfs/dbraw/zinc/19/50/05/1047195005.db2.gz OMIBKYPLPKWCFF-UHFFFAOYSA-N -1 1 310.374 4.226 20 0 DIADMM COc1ccc([C@H](C)NC(=O)c2cc3ccccc3cc2[O-])cc1 ZINC000325650272 1047203456 /nfs/dbraw/zinc/20/34/56/1047203456.db2.gz KPICKRQBKLQGKM-ZDUSSCGKSA-N -1 1 321.376 4.045 20 0 DIADMM C[C@H]1C[C@H](C(C)(C)C)CCN1C(=O)c1cc(Cl)ccc1[O-] ZINC001141661455 1047250297 /nfs/dbraw/zinc/25/02/97/1047250297.db2.gz BJNAEIMXNGNPQJ-NWDGAFQWSA-N -1 1 309.837 4.332 20 0 DIADMM CC(C)(C)C[C@H](NC(=O)c1c([O-])cccc1F)c1ccccc1 ZINC001141673021 1047261637 /nfs/dbraw/zinc/26/16/37/1047261637.db2.gz KALAHZRIBJOUPI-HNNXBMFYSA-N -1 1 315.388 4.439 20 0 DIADMM CC(C)(C)C[C@@H](NC(=O)c1c([O-])cccc1F)c1ccccc1 ZINC001141673022 1047261698 /nfs/dbraw/zinc/26/16/98/1047261698.db2.gz KALAHZRIBJOUPI-OAHLLOKOSA-N -1 1 315.388 4.439 20 0 DIADMM Cc1ccc2c(c1)[C@@H](NC(=O)c1cc(Cl)ccc1[O-])CCC2 ZINC001141713894 1047275021 /nfs/dbraw/zinc/27/50/21/1047275021.db2.gz CRGWRHMRUYXAHV-INIZCTEOSA-N -1 1 315.800 4.161 20 0 DIADMM CC(=O)c1ccc(NC(=O)c2cc3c(cc2[O-])CCCC3)cc1C ZINC001141718537 1047275906 /nfs/dbraw/zinc/27/59/06/1047275906.db2.gz AJBGOSPNPNXHJA-UHFFFAOYSA-N -1 1 323.392 4.034 20 0 DIADMM CCc1cc(=O)[n-]c(SCCO[C@@H](CC)c2ccccc2)n1 ZINC000651194189 1047301316 /nfs/dbraw/zinc/30/13/16/1047301316.db2.gz WWIXKAJITUHMHM-HNNXBMFYSA-N -1 1 318.442 4.005 20 0 DIADMM CCC[C@@H](C(=O)Nc1cc(F)cc(F)c1[O-])c1ccccc1 ZINC001142537367 1047321945 /nfs/dbraw/zinc/32/19/45/1047321945.db2.gz JITNLUMCNQUTMD-CYBMUJFWSA-N -1 1 305.324 4.193 20 0 DIADMM O=C([N-][C@@H](CCCc1ccccc1)c1ccccc1)C(F)(F)F ZINC000725879246 1047323881 /nfs/dbraw/zinc/32/38/81/1047323881.db2.gz FEJFKZRLTCPAAZ-INIZCTEOSA-N -1 1 321.342 4.429 20 0 DIADMM CCOc1ccc(NC(=O)c2cc(SC)ccc2[O-])c(C)c1 ZINC001141974718 1047324453 /nfs/dbraw/zinc/32/44/53/1047324453.db2.gz WSALHNUQAKWOQN-UHFFFAOYSA-N -1 1 317.410 4.074 20 0 DIADMM O=C(Nc1cc(F)cc(F)c1[O-])c1[nH]c2ccccc2c1Cl ZINC001142542838 1047333334 /nfs/dbraw/zinc/33/33/34/1047333334.db2.gz VUDPETHPLKVSCF-UHFFFAOYSA-N -1 1 322.698 4.057 20 0 DIADMM C[C@H](Cc1ccccc1F)NC(=O)c1ccc2ccccc2c1[O-] ZINC001142079543 1047371916 /nfs/dbraw/zinc/37/19/16/1047371916.db2.gz WCCJKZDNWFNOKQ-CYBMUJFWSA-N -1 1 323.367 4.046 20 0 DIADMM O=C(CSc1cccc(C(F)(F)F)c1)c1ccc([O-])cc1 ZINC000749513409 1047424512 /nfs/dbraw/zinc/42/45/12/1047424512.db2.gz DEBGCFYUOHRFKC-UHFFFAOYSA-N -1 1 312.312 4.386 20 0 DIADMM O=C(NCCCc1ccc(Cl)cc1)c1c([O-])cccc1Cl ZINC000749946155 1047450397 /nfs/dbraw/zinc/45/03/97/1047450397.db2.gz ZVMHFRLUFMSYDC-UHFFFAOYSA-N -1 1 324.207 4.062 20 0 DIADMM O=C(CCCc1ccccc1)Nc1cccc(C(F)(F)F)c1[O-] ZINC001142881867 1047508658 /nfs/dbraw/zinc/50/86/58/1047508658.db2.gz QRQFCIWNPVRORC-UHFFFAOYSA-N -1 1 323.314 4.372 20 0 DIADMM C[C@@H](c1cccs1)N(C)C(=O)c1cc2ccccc2cc1[O-] ZINC000121891240 1047531754 /nfs/dbraw/zinc/53/17/54/1047531754.db2.gz USDTTYLWWWNILB-LBPRGKRZSA-N -1 1 311.406 4.440 20 0 DIADMM C[C@H]1c2ccccc2CCN1C(=O)c1c([O-])ccc2ccccc21 ZINC001153497583 1047625675 /nfs/dbraw/zinc/62/56/75/1047625675.db2.gz FENRUFGHJGMBQW-AWEZNQCLSA-N -1 1 317.388 4.305 20 0 DIADMM CN(C(=O)c1c([O-])ccc2ccccc21)[C@@H]1CCc2ccccc21 ZINC001153505900 1047626857 /nfs/dbraw/zinc/62/68/57/1047626857.db2.gz OPQIOZOKEQLBHD-GOSISDBHSA-N -1 1 317.388 4.305 20 0 DIADMM CCc1ccc([C@H](C)C(=O)NCc2ccc([O-])c(Cl)c2)cc1 ZINC001154105797 1047640196 /nfs/dbraw/zinc/64/01/96/1047640196.db2.gz RASIHIDDOGGHQT-LBPRGKRZSA-N -1 1 317.816 4.028 20 0 DIADMM CC(C)c1ccc2c(c1)[C@H](NC(=O)c1ccc(F)c([O-])c1)CC2 ZINC001155027288 1047665484 /nfs/dbraw/zinc/66/54/84/1047665484.db2.gz XGFCDPOIERLZLY-QGZVFWFLSA-N -1 1 313.372 4.072 20 0 DIADMM CSc1ccccc1[C@@H](C)NC(=O)c1cc(Cl)ccc1[O-] ZINC001155451771 1047681800 /nfs/dbraw/zinc/68/18/00/1047681800.db2.gz XFWYKJGLMDLMDN-SNVBAGLBSA-N -1 1 321.829 4.259 20 0 DIADMM C[C@@H]1C[C@H](c2ccccc2)N(C(=O)c2c([O-])cccc2Cl)C1 ZINC001157232099 1047737622 /nfs/dbraw/zinc/73/76/22/1047737622.db2.gz KPUMTGLPRYVPSF-IUODEOHRSA-N -1 1 315.800 4.269 20 0 DIADMM Cc1cc(-c2nc(=O)c3c(-c4ccc(C)cc4)csc3[n-]2)no1 ZINC000479198732 1047845285 /nfs/dbraw/zinc/84/52/85/1047845285.db2.gz KKARABUQKWYSQM-UHFFFAOYSA-N -1 1 323.377 4.336 20 0 DIADMM Nc1ncc(Nc2cc(Cl)cc(Cl)c2[O-])cc1Cl ZINC001159591578 1047875491 /nfs/dbraw/zinc/87/54/91/1047875491.db2.gz SYQWDSHHIKALMF-UHFFFAOYSA-N -1 1 304.564 4.073 20 0 DIADMM CC(C)Cc1cccc([C@@H](C)C(=O)Nc2ccc(F)cc2[O-])c1 ZINC001183053931 1047884336 /nfs/dbraw/zinc/88/43/36/1047884336.db2.gz AFMBHPRZIATIBN-CYBMUJFWSA-N -1 1 315.388 4.472 20 0 DIADMM O=C([O-])c1ccc(Nc2ccc3c[nH]nc3c2)cc1C(F)(F)F ZINC001159663369 1047896849 /nfs/dbraw/zinc/89/68/49/1047896849.db2.gz YFSAYFNRLXQAEI-UHFFFAOYSA-N -1 1 321.258 4.024 20 0 DIADMM CC(C)(O)c1cncc(Nc2c(Cl)ccc([O-])c2Cl)c1 ZINC001174591404 1047897743 /nfs/dbraw/zinc/89/77/43/1047897743.db2.gz NQVAJPVIKFMPJY-UHFFFAOYSA-N -1 1 313.184 4.065 20 0 DIADMM COc1cc(Nc2cc(Cl)cc(Cl)c2[O-])ccc1O ZINC001174544503 1047900767 /nfs/dbraw/zinc/90/07/67/1047900767.db2.gz PAAMJMLBLLVGDX-UHFFFAOYSA-N -1 1 300.141 4.157 20 0 DIADMM [O-]c1c(Cl)c(Cl)ccc1Nc1c[nH]c2ncc(F)cc12 ZINC001159766361 1047919281 /nfs/dbraw/zinc/91/92/81/1047919281.db2.gz IMHMEEFWFYVUDK-UHFFFAOYSA-N -1 1 312.131 4.458 20 0 DIADMM Nc1nc2ccc(Nc3c(F)ccc([O-])c3Cl)cc2s1 ZINC001159822605 1047931777 /nfs/dbraw/zinc/93/17/77/1047931777.db2.gz OCBJUTSKACYSNW-UHFFFAOYSA-N -1 1 309.753 4.120 20 0 DIADMM CCCCN(C(=O)c1ccc(F)c([O-])c1)[C@H]1CCC[C@@H](C)C1 ZINC001159892573 1047942622 /nfs/dbraw/zinc/94/26/22/1047942622.db2.gz QYFPFOIMNPHORR-HIFRSBDPSA-N -1 1 307.409 4.352 20 0 DIADMM CC(C)(C)OCc1ccc(Nc2ccnc(Cl)c2[O-])cc1 ZINC001174909820 1048021778 /nfs/dbraw/zinc/02/17/78/1048021778.db2.gz DJMUYDGILTYGCX-UHFFFAOYSA-N -1 1 306.793 4.499 20 0 DIADMM Cc1c(Cl)cccc1NC(=O)Nc1cc([O-])c(F)cc1F ZINC001184680111 1048082289 /nfs/dbraw/zinc/08/22/89/1048082289.db2.gz SFYACAIPEYEEBS-UHFFFAOYSA-N -1 1 312.703 4.276 20 0 DIADMM O=C(Nc1cc([O-])c(F)cc1F)[C@@H]1CCC[C@@H]2CCCC[C@@H]12 ZINC001160916194 1048096759 /nfs/dbraw/zinc/09/67/59/1048096759.db2.gz GGGBZWUCYLVFAN-QJPTWQEYSA-N -1 1 309.356 4.215 20 0 DIADMM Cc1cc(C(=O)Nc2cc([O-])c(F)cc2F)c(C)cc1Cl ZINC001160915958 1048097074 /nfs/dbraw/zinc/09/70/74/1048097074.db2.gz AHBHIYRJIIFVJP-UHFFFAOYSA-N -1 1 311.715 4.193 20 0 DIADMM CC(C)[C@H]1N(C(=O)c2c(F)ccc([O-])c2F)CC12CCCCC2 ZINC001161238343 1048117130 /nfs/dbraw/zinc/11/71/30/1048117130.db2.gz SUISCYGFXKFEJE-MRXNPFEDSA-N -1 1 323.383 4.101 20 0 DIADMM CCC[C@H](NC(=O)c1ccc(C(F)(F)F)cc1[O-])C1CCC1 ZINC001161465833 1048132254 /nfs/dbraw/zinc/13/22/54/1048132254.db2.gz GPFUWLUPNPVKKU-ZDUSSCGKSA-N -1 1 315.335 4.110 20 0 DIADMM CC(C)[C@H]1N(C(=O)c2ccc(Cl)cc2[O-])CC12CCCC2 ZINC001161679043 1048153365 /nfs/dbraw/zinc/15/33/65/1048153365.db2.gz MANWYBCZKBRAHZ-OAHLLOKOSA-N -1 1 307.821 4.086 20 0 DIADMM C[C@@H](C(=O)[N-]OC1CCCC1)c1ccc(Cl)c(Cl)c1 ZINC000774865009 1048169369 /nfs/dbraw/zinc/16/93/69/1048169369.db2.gz FMUJTNLBLUAZKU-SECBINFHSA-N -1 1 302.201 4.087 20 0 DIADMM C[C@@H](CNC(=O)c1c([O-])cnc2ccc(Cl)cc21)C(C)(C)C ZINC001161819004 1048177523 /nfs/dbraw/zinc/17/75/23/1048177523.db2.gz KQZQUDMWYVYVTN-JTQLQIEISA-N -1 1 320.820 4.006 20 0 DIADMM CC(=O)c1ccccc1Nc1cccc([O-])c1Br ZINC001175179694 1048184346 /nfs/dbraw/zinc/18/43/46/1048184346.db2.gz BJBABPCSUYXJPJ-UHFFFAOYSA-N -1 1 306.159 4.101 20 0 DIADMM [O-]c1cc(F)cc(F)c1Nc1cccc(O[C@H]2CCCCO2)c1 ZINC001175187088 1048190067 /nfs/dbraw/zinc/19/00/67/1048190067.db2.gz USJLHWGDSCOOIN-INIZCTEOSA-N -1 1 321.323 4.319 20 0 DIADMM C=Cc1ccccc1[N-]S(=O)(=O)c1ccc(Cl)c(C)c1 ZINC001185529595 1048192268 /nfs/dbraw/zinc/19/22/68/1048192268.db2.gz IBBSTLPQTYWWCH-UHFFFAOYSA-N -1 1 307.802 4.092 20 0 DIADMM CCC[C@H](C)[N-]S(=O)(=O)c1sc2ccccc2c1Cl ZINC001185560532 1048195258 /nfs/dbraw/zinc/19/52/58/1048195258.db2.gz UKIYZJJBSRMBSE-VIFPVBQESA-N -1 1 317.863 4.022 20 0 DIADMM O=C(Nc1ccc2c(c1)CCC2)Nc1cc([O-])c(Cl)cc1F ZINC001185764089 1048222786 /nfs/dbraw/zinc/22/27/86/1048222786.db2.gz UOBPTRQQVGNOHC-UHFFFAOYSA-N -1 1 320.751 4.317 20 0 DIADMM Cc1c(F)cccc1S(=O)(=O)[N-]c1cc2cccccc-2c1 ZINC001185796641 1048227799 /nfs/dbraw/zinc/22/77/99/1048227799.db2.gz LQCZTONZPWGLFD-UHFFFAOYSA-N -1 1 315.369 4.040 20 0 DIADMM CSc1cc(C)ccc1[N-]C(=O)c1c(C)noc1C(F)F ZINC000667744048 1048236293 /nfs/dbraw/zinc/23/62/93/1048236293.db2.gz NBINXLQTTXHVFS-UHFFFAOYSA-N -1 1 312.341 4.203 20 0 DIADMM C[S@](=O)c1ccccc1Nc1cc(Cl)c([O-])cc1Cl ZINC001175306903 1048255036 /nfs/dbraw/zinc/25/50/36/1048255036.db2.gz DLFXOYAVZVHACW-IBGZPJMESA-N -1 1 316.209 4.180 20 0 DIADMM CCCCOc1ccc(C(=O)Nc2cc(F)cc(F)c2[O-])cc1 ZINC001162283909 1048256333 /nfs/dbraw/zinc/25/63/33/1048256333.db2.gz CNIJKVSPLBELBR-UHFFFAOYSA-N -1 1 321.323 4.102 20 0 DIADMM [O-]c1c(Cl)cc(Cl)cc1Nc1ccc(N2CCCC2)nc1 ZINC001175352415 1048273528 /nfs/dbraw/zinc/27/35/28/1048273528.db2.gz OTMCQPXVWZZHPR-UHFFFAOYSA-N -1 1 324.211 4.438 20 0 DIADMM C[C@H]1CN(C(=O)c2ccc(C(F)(F)F)c([O-])c2)c2ccccc21 ZINC001162450689 1048281873 /nfs/dbraw/zinc/28/18/73/1048281873.db2.gz FQKPIWDIZOHMLP-JTQLQIEISA-N -1 1 321.298 4.175 20 0 DIADMM CC[C@@H](NC(=O)c1ccc([O-])cc1F)c1ccc(C)cc1C ZINC001186339557 1048289928 /nfs/dbraw/zinc/28/99/28/1048289928.db2.gz KLPYMKXENFGSCM-QGZVFWFLSA-N -1 1 301.361 4.029 20 0 DIADMM Fc1c(F)c(F)c([N-]c2cc(C3CCC3)no2)c(F)c1F ZINC001175383733 1048290171 /nfs/dbraw/zinc/29/01/71/1048290171.db2.gz QNIFUYJLCHGVLR-UHFFFAOYSA-N -1 1 304.218 4.381 20 0 DIADMM COc1ncc(Nc2cc(Cl)c(C)c(Cl)c2[O-])s1 ZINC001175393725 1048294671 /nfs/dbraw/zinc/29/46/71/1048294671.db2.gz CLTKENQYMKHKDI-UHFFFAOYSA-N -1 1 305.186 4.216 20 0 DIADMM Cc1c(Cl)cc(Nc2cnn(C(F)F)c2)c([O-])c1Cl ZINC001201743241 1048363603 /nfs/dbraw/zinc/36/36/03/1048363603.db2.gz BJJJDNMMDAHPEE-UHFFFAOYSA-N -1 1 308.115 4.343 20 0 DIADMM CCCOc1cccc(Nc2ccc(-n3ccc(=O)[n-]3)cc2)c1 ZINC001175601787 1048369353 /nfs/dbraw/zinc/36/93/53/1048369353.db2.gz UKJFONNQTWJMFB-UHFFFAOYSA-N -1 1 309.369 4.110 20 0 DIADMM O=C(Nc1ccc(F)c(Cl)c1)Nc1cc(F)c([O-])c(F)c1 ZINC001187699517 1048429053 /nfs/dbraw/zinc/42/90/53/1048429053.db2.gz AYAONJAUVIFAGC-UHFFFAOYSA-N -1 1 316.666 4.107 20 0 DIADMM O=C(Nc1ccc(F)c(Cl)c1)Nc1cc(F)c([O-])cc1F ZINC001187699695 1048429135 /nfs/dbraw/zinc/42/91/35/1048429135.db2.gz HBOUVMLKTZZSLD-UHFFFAOYSA-N -1 1 316.666 4.107 20 0 DIADMM O=C(Nc1ccc(F)c(Cl)c1)Nc1cc([O-])c(F)cc1F ZINC001187696659 1048429323 /nfs/dbraw/zinc/42/93/23/1048429323.db2.gz YGSCJSUXWDKXSI-UHFFFAOYSA-N -1 1 316.666 4.107 20 0 DIADMM O=C(Nc1ccc(F)c(Cl)c1)Nc1c(F)cc([O-])cc1F ZINC001187704334 1048430712 /nfs/dbraw/zinc/43/07/12/1048430712.db2.gz CGUVXYMJEQKSCX-UHFFFAOYSA-N -1 1 316.666 4.107 20 0 DIADMM O=C(Nc1ccc(F)cc1[O-])Nc1ccc(Cl)cc1Cl ZINC001202081900 1048444132 /nfs/dbraw/zinc/44/41/32/1048444132.db2.gz FTOTTXZUEZSBEV-UHFFFAOYSA-N -1 1 315.131 4.482 20 0 DIADMM CSc1cccc(NC(=O)Nc2c(F)cc([O-])cc2F)c1 ZINC001188053817 1048465390 /nfs/dbraw/zinc/46/53/90/1048465390.db2.gz VEWTXLQKINEYIH-UHFFFAOYSA-N -1 1 310.325 4.036 20 0 DIADMM Cc1ccccc1NC(=O)Nc1cccc([O-])c1Br ZINC001202186333 1048475184 /nfs/dbraw/zinc/47/51/84/1048475184.db2.gz IGIAGXXZADNHEU-UHFFFAOYSA-N -1 1 321.174 4.107 20 0 DIADMM CSc1ccc(NC(=O)Nc2cc(F)cc(F)c2[O-])cc1 ZINC001188114534 1048477802 /nfs/dbraw/zinc/47/78/02/1048477802.db2.gz YLKDHGKFYLOEQY-UHFFFAOYSA-N -1 1 310.325 4.036 20 0 DIADMM CCCc1cc(=O)[n-]c(SCCc2ccccc2CC)n1 ZINC001188163440 1048482818 /nfs/dbraw/zinc/48/28/18/1048482818.db2.gz VTXJLXZQNGZHSU-UHFFFAOYSA-N -1 1 302.443 4.032 20 0 DIADMM Brc1cccc(-c2cc([N-]c3cscn3)on2)c1 ZINC001175938353 1048490415 /nfs/dbraw/zinc/49/04/15/1048490415.db2.gz WLLGMBBGSHNYCA-UHFFFAOYSA-N -1 1 322.187 4.304 20 0 DIADMM O=C(Nc1ccc(Cl)c(Cl)c1)Nc1c([O-])cccc1F ZINC001202264756 1048494215 /nfs/dbraw/zinc/49/42/15/1048494215.db2.gz XPQFIWUOXUPVAF-UHFFFAOYSA-N -1 1 315.131 4.482 20 0 DIADMM O=C(Nc1cccc(F)c1)Nc1cccc(C(F)(F)F)c1[O-] ZINC001202231950 1048498130 /nfs/dbraw/zinc/49/81/30/1048498130.db2.gz HYBWHIAHQJVAPQ-UHFFFAOYSA-N -1 1 314.238 4.194 20 0 DIADMM Cc1nnc(-c2cccc(Nc3cc([O-])c(Cl)cc3F)c2)o1 ZINC001175994867 1048523306 /nfs/dbraw/zinc/52/33/06/1048523306.db2.gz OAWJSOZHMNRZHQ-UHFFFAOYSA-N -1 1 319.723 4.287 20 0 DIADMM CCCC[C@H](O)CNc1cc(Cl)c(Cl)c(Cl)c1[O-] ZINC001252105533 1048546150 /nfs/dbraw/zinc/54/61/50/1048546150.db2.gz QDYINUSVTBZNEO-ZETCQYMHSA-N -1 1 312.624 4.315 20 0 DIADMM COc1ccc(Nc2c([O-])cc(F)cc2F)c(C(F)(F)F)c1 ZINC001213049824 1048573861 /nfs/dbraw/zinc/57/38/61/1048573861.db2.gz JJOJTOYFKKYEBZ-UHFFFAOYSA-N -1 1 319.229 4.441 20 0 DIADMM Cc1ccc(C)c(SCc2cc(=O)oc3cc([O-])ccc23)c1 ZINC000006916701 1048602882 /nfs/dbraw/zinc/60/28/82/1048602882.db2.gz BHNWCTLURAVMGX-UHFFFAOYSA-N -1 1 312.390 4.408 20 0 DIADMM O=C(OCc1csc(C2CCCC2)n1)c1ccc([O-])cc1F ZINC000773566084 1048626050 /nfs/dbraw/zinc/62/60/50/1048626050.db2.gz CKNWSRWQUCBRTQ-UHFFFAOYSA-N -1 1 321.373 4.002 20 0 DIADMM CCCc1cc(=O)[n-]c(S[C@H](C)c2ccc(F)c(F)c2)n1 ZINC001164552259 1048640957 /nfs/dbraw/zinc/64/09/57/1048640957.db2.gz UDBWCBVOGHMZIK-SECBINFHSA-N -1 1 310.369 4.266 20 0 DIADMM CCc1cccc(CC)c1NC(=O)Nc1c([O-])cccc1F ZINC001189769071 1048664154 /nfs/dbraw/zinc/66/41/54/1048664154.db2.gz KPAABSKCCAAFHP-UHFFFAOYSA-N -1 1 302.349 4.300 20 0 DIADMM O=c1oc2cc([O-])ccc2cc1Nc1cccc(OCC2CC2)c1 ZINC001176493456 1048698461 /nfs/dbraw/zinc/69/84/61/1048698461.db2.gz RHXHUAGNJKVRON-UHFFFAOYSA-N -1 1 323.348 4.031 20 0 DIADMM O=c1cc(-c2ccccc2)nc(SC[C@@H]2C[C@H]3C=C[C@@H]2C3)[n-]1 ZINC001190210649 1048708307 /nfs/dbraw/zinc/70/83/07/1048708307.db2.gz PGUOYHNESBHWFT-CFVMTHIKSA-N -1 1 310.422 4.154 20 0 DIADMM CN(C(=O)c1ccc([O-])c(F)c1)C1CC(C)(C)CC(C)(C)C1 ZINC001165844490 1048721309 /nfs/dbraw/zinc/72/13/09/1048721309.db2.gz DKCQTJQVCLFCJP-UHFFFAOYSA-N -1 1 307.409 4.208 20 0 DIADMM [O-]c1c(F)cc(F)c(Nc2cnc3ccc(F)cc3c2)c1F ZINC001176664277 1048751759 /nfs/dbraw/zinc/75/17/59/1048751759.db2.gz RZJIOJKKVZSTIQ-UHFFFAOYSA-N -1 1 308.234 4.240 20 0 DIADMM Cc1nc2ccccc2cc1Nc1c(F)cc(F)c([O-])c1F ZINC001176664029 1048752190 /nfs/dbraw/zinc/75/21/90/1048752190.db2.gz JULFWWMSTJWZTG-UHFFFAOYSA-N -1 1 304.271 4.410 20 0 DIADMM [O-]c1c(F)cc(F)c(Nc2ccc(N3CCCC3)cc2)c1F ZINC001176669631 1048752804 /nfs/dbraw/zinc/75/28/04/1048752804.db2.gz JDQOMOHXESVFOW-UHFFFAOYSA-N -1 1 308.303 4.153 20 0 DIADMM [O-]c1c(F)cc(F)c(Nc2cnc3cccc(F)c3c2)c1F ZINC001176663412 1048753450 /nfs/dbraw/zinc/75/34/50/1048753450.db2.gz JFRYVHSYBFGXMG-UHFFFAOYSA-N -1 1 308.234 4.240 20 0 DIADMM [O-]c1c(F)cc(F)c(Nc2ccc(OCC3CCC3)nc2)c1F ZINC001176664667 1048753807 /nfs/dbraw/zinc/75/38/07/1048753807.db2.gz UFBBKJUBOINVLP-UHFFFAOYSA-N -1 1 324.302 4.127 20 0 DIADMM [O-]c1c(F)cc(F)c(Nc2cccc(-c3cnco3)c2)c1F ZINC001176671713 1048754090 /nfs/dbraw/zinc/75/40/90/1048754090.db2.gz MKDQFMUUJMQJFY-UHFFFAOYSA-N -1 1 306.243 4.208 20 0 DIADMM Cc1cc(Nc2c(F)cc(F)c([O-])c2F)cnc1OC(C)C ZINC001176670577 1048754456 /nfs/dbraw/zinc/75/44/56/1048754456.db2.gz ZFCRBNZCTNDOMO-UHFFFAOYSA-N -1 1 312.291 4.044 20 0 DIADMM CCOc1ccc(Nc2c(F)cc(F)c([O-])c2F)c(F)c1 ZINC001176672374 1048754848 /nfs/dbraw/zinc/75/48/48/1048754848.db2.gz IEPUJAGHZHKWKG-UHFFFAOYSA-N -1 1 301.239 4.091 20 0 DIADMM CC(=O)n1ccc2cc(Nc3c(F)cc(F)c([O-])c3F)ccc21 ZINC001176671298 1048755343 /nfs/dbraw/zinc/75/53/43/1048755343.db2.gz WSFCXLWROPBOLN-UHFFFAOYSA-N -1 1 320.270 4.168 20 0 DIADMM COc1ccc(Cl)cc1Nc1c(F)cc(F)c([O-])c1F ZINC001176670535 1048755376 /nfs/dbraw/zinc/75/53/76/1048755376.db2.gz XWNNISXQCLTCNY-UHFFFAOYSA-N -1 1 303.667 4.215 20 0 DIADMM [O-]c1c(F)cc(F)c(Nc2ccc(C3CCOCC3)cc2)c1F ZINC001176672090 1048755835 /nfs/dbraw/zinc/75/58/35/1048755835.db2.gz DNOQEPPDXAMZIB-UHFFFAOYSA-N -1 1 323.314 4.447 20 0 DIADMM Nc1ccc(Nc2c(F)cc(F)c([O-])c2F)c(C(F)(F)F)c1 ZINC001176672078 1048756376 /nfs/dbraw/zinc/75/63/76/1048756376.db2.gz SIUZKLHDNLBGGP-UHFFFAOYSA-N -1 1 322.208 4.154 20 0 DIADMM [O-]c1c(F)cc(F)c(Nc2ccc(F)c(Cl)c2F)c1F ZINC001176673107 1048757714 /nfs/dbraw/zinc/75/77/14/1048757714.db2.gz PKPBTYLBWTUTEI-UHFFFAOYSA-N -1 1 309.621 4.485 20 0 DIADMM COc1cc(F)c(Cl)cc1Nc1c(F)cc(F)c([O-])c1F ZINC001176674800 1048758082 /nfs/dbraw/zinc/75/80/82/1048758082.db2.gz WJAVTAGFSXZETI-UHFFFAOYSA-N -1 1 321.657 4.354 20 0 DIADMM COc1cc(Nc2c(F)cc(F)c([O-])c2F)cc2cccnc21 ZINC001176674121 1048758250 /nfs/dbraw/zinc/75/82/50/1048758250.db2.gz QQJBFALVSLJSEA-UHFFFAOYSA-N -1 1 320.270 4.110 20 0 DIADMM [O-]c1c(F)cc(F)c(Nc2cc(Cl)ncc2Cl)c1F ZINC001176663100 1048768279 /nfs/dbraw/zinc/76/82/79/1048768279.db2.gz BRZUSCOHQHLRNY-UHFFFAOYSA-N -1 1 309.074 4.255 20 0 DIADMM Cc1cccc(-n2nccc2Nc2c(F)cc(F)c([O-])c2F)c1 ZINC001176663353 1048769615 /nfs/dbraw/zinc/76/96/15/1048769615.db2.gz GKROECGPVLXBEO-UHFFFAOYSA-N -1 1 319.286 4.047 20 0 DIADMM CC[C@@H](C)c1ccc(C(=O)NCc2ccc([O-])c(Cl)c2)cc1 ZINC001176987651 1048809179 /nfs/dbraw/zinc/80/91/79/1048809179.db2.gz ASBJCFVWNDHWQF-GFCCVEGCSA-N -1 1 317.816 4.489 20 0 DIADMM Cc1ccc(CSc2nc(-c3ccccc3)cc(=O)[n-]2)c(C)n1 ZINC001166904159 1048813217 /nfs/dbraw/zinc/81/32/17/1048813217.db2.gz WPKDTIDALLSUSU-UHFFFAOYSA-N -1 1 323.421 4.153 20 0 DIADMM Cc1cccc(CNC(=O)Nc2cccc(C(F)(F)F)c2[O-])c1 ZINC001191002076 1048817103 /nfs/dbraw/zinc/81/71/03/1048817103.db2.gz QTUDQDQIOIVYSE-UHFFFAOYSA-N -1 1 324.302 4.041 20 0 DIADMM O=C(c1cccc(Nc2cc([O-])c(F)c(F)c2)c1)C(F)(F)F ZINC001203344652 1048874372 /nfs/dbraw/zinc/87/43/72/1048874372.db2.gz NAVBRKBYKIRZCQ-UHFFFAOYSA-N -1 1 317.213 4.159 20 0 DIADMM O=C(Nc1cccc(C(F)(F)F)c1[O-])NC1CCCCCC1 ZINC001191273581 1048914182 /nfs/dbraw/zinc/91/41/82/1048914182.db2.gz SNPWPHXWGFDAEV-UHFFFAOYSA-N -1 1 316.323 4.255 20 0 DIADMM Cc1coc(CN[C@@H](CC(=O)[O-])c2ccc(C(C)C)cc2)c1 ZINC000904001911 1048940580 /nfs/dbraw/zinc/94/05/80/1048940580.db2.gz JWLTWQBKYCJSEJ-KRWDZBQOSA-N -1 1 301.386 4.017 20 0 DIADMM Cc1oc(-c2ccccc2)nc1C(=O)[N-]c1cnoc1C(C)C ZINC001177843973 1048951057 /nfs/dbraw/zinc/95/10/57/1048951057.db2.gz TYLREDVQGCGGQO-UHFFFAOYSA-N -1 1 311.341 4.014 20 0 DIADMM O=C([O-])CC[C@@H](NCc1cscc1Cl)c1ccccc1 ZINC000904011920 1048951378 /nfs/dbraw/zinc/95/13/78/1048951378.db2.gz LXBGRWSKUHLAAE-CQSZACIVSA-N -1 1 309.818 4.097 20 0 DIADMM Cc1ccc(Cl)c(NC(=O)Nc2ccc([O-])c(F)c2F)c1 ZINC001191704380 1048980152 /nfs/dbraw/zinc/98/01/52/1048980152.db2.gz GEFKLEHXDLXIJU-UHFFFAOYSA-N -1 1 312.703 4.276 20 0 DIADMM CCCCc1ccc([C@@H](N[C@@H](C)C(=O)[O-])c2cccs2)cc1 ZINC000904203193 1049002481 /nfs/dbraw/zinc/00/24/81/1049002481.db2.gz GFRLRDGFMRIROL-SUMWQHHRSA-N -1 1 317.454 4.243 20 0 DIADMM CCc1cc(=O)[n-]c(S[C@H](C)c2ccc3ccccc3c2)n1 ZINC000195063710 1049051346 /nfs/dbraw/zinc/05/13/46/1049051346.db2.gz LXPFFFJGJOATOB-GFCCVEGCSA-N -1 1 310.422 4.339 20 0 DIADMM Cc1cc(NC(=O)Nc2cc([O-])c(Cl)cc2F)ccc1F ZINC001192392243 1049097500 /nfs/dbraw/zinc/09/75/00/1049097500.db2.gz WNVKRDDAQDVJNA-UHFFFAOYSA-N -1 1 312.703 4.276 20 0 DIADMM O=C(Nc1ccc2sccc2c1)Nc1cccc(F)c1[O-] ZINC001192448932 1049105437 /nfs/dbraw/zinc/10/54/37/1049105437.db2.gz QMMRVOJJNKHUME-UHFFFAOYSA-N -1 1 302.330 4.390 20 0 DIADMM CC(C)(C)[C@H]1CC[C@@H](NC(=O)c2c(F)ccc([O-])c2F)CC1 ZINC001192556025 1049114662 /nfs/dbraw/zinc/11/46/62/1049114662.db2.gz JTJCPGRTUAKZBU-PHIMTYICSA-N -1 1 311.372 4.005 20 0 DIADMM O=C(Nc1ccc(F)c2ccccc12)c1c(F)ccc([O-])c1F ZINC001192540315 1049117721 /nfs/dbraw/zinc/11/77/21/1049117721.db2.gz UVPNQBHBPSXDNA-UHFFFAOYSA-N -1 1 317.266 4.215 20 0 DIADMM CC(C)(C)c1cccc(NC(=O)c2c(F)ccc([O-])c2F)c1 ZINC001192541524 1049118700 /nfs/dbraw/zinc/11/87/00/1049118700.db2.gz XWQYNMAGGJLVQQ-UHFFFAOYSA-N -1 1 305.324 4.220 20 0 DIADMM CCc1cccc(CC)c1NC(=O)c1c(F)ccc([O-])c1F ZINC001192540867 1049118736 /nfs/dbraw/zinc/11/87/36/1049118736.db2.gz PRXDAGCKIUFGOD-UHFFFAOYSA-N -1 1 305.324 4.048 20 0 DIADMM Cc1ccc2ccccc2c1NC(=O)c1cc([O-])cc(F)c1F ZINC001192651315 1049123679 /nfs/dbraw/zinc/12/36/79/1049123679.db2.gz GCFMGJNEQOLXLB-UHFFFAOYSA-N -1 1 313.303 4.384 20 0 DIADMM O=C(Nc1ccc2cc(F)ccc2c1)c1cc([O-])cc(F)c1F ZINC001192671229 1049126427 /nfs/dbraw/zinc/12/64/27/1049126427.db2.gz YIUMGQDSWLQXEM-UHFFFAOYSA-N -1 1 317.266 4.215 20 0 DIADMM Cc1oc2ccccc2c1CNc1ccc(-n2ccc(=O)[n-]2)cc1 ZINC001179307737 1049152606 /nfs/dbraw/zinc/15/26/06/1049152606.db2.gz ARVDUHXWKFQTLL-UHFFFAOYSA-N -1 1 319.364 4.245 20 0 DIADMM CC(C)(C)c1ccc2c(c1)CCCN2C(=O)c1ccccc1[O-] ZINC000857480847 1049158837 /nfs/dbraw/zinc/15/88/37/1049158837.db2.gz NMVMJFKUIMPWMU-UHFFFAOYSA-N -1 1 309.409 4.283 20 0 DIADMM Cc1c(Cl)cccc1C(=O)Nc1cc(F)c([O-])cc1Cl ZINC001179660300 1049188438 /nfs/dbraw/zinc/18/84/38/1049188438.db2.gz PCVUPAHLGONIQI-UHFFFAOYSA-N -1 1 314.143 4.399 20 0 DIADMM CSc1cc(C)nc(SC)c1[N-]C(=O)c1ccsc1C ZINC001193369363 1049203928 /nfs/dbraw/zinc/20/39/28/1049203928.db2.gz VXIYCSSYCDWPRV-UHFFFAOYSA-N -1 1 324.496 4.456 20 0 DIADMM O=S(=O)(CC1CCC1)[N-]c1ccccc1Oc1ccccc1 ZINC001193513730 1049222159 /nfs/dbraw/zinc/22/21/59/1049222159.db2.gz HVRPAFSPCRFFAK-UHFFFAOYSA-N -1 1 317.410 4.021 20 0 DIADMM CCCOc1ccc(NCc2cccc([O-])c2Cl)cc1OC ZINC000858343422 1049245473 /nfs/dbraw/zinc/24/54/73/1049245473.db2.gz AQUSCRDAPAVUOS-UHFFFAOYSA-N -1 1 321.804 4.455 20 0 DIADMM CC[C@H]1c2ccccc2CN1C(=O)c1cc(Cl)ccc1[O-] ZINC001180139989 1049281859 /nfs/dbraw/zinc/28/18/59/1049281859.db2.gz LETOAVCNNXRVAH-HNNXBMFYSA-N -1 1 301.773 4.153 20 0 DIADMM C[C@@H](NC(=O)c1ccc(F)c([O-])c1)c1csc2ccccc21 ZINC001180226210 1049311341 /nfs/dbraw/zinc/31/13/41/1049311341.db2.gz OIXAEJDOTDLQKW-SNVBAGLBSA-N -1 1 315.369 4.237 20 0 DIADMM Cc1cc2cc([N-]S(=O)(=O)c3c(C)cccc3C)ccc2o1 ZINC001194643659 1049403941 /nfs/dbraw/zinc/40/39/41/1049403941.db2.gz LBOPTFJTJYILCN-UHFFFAOYSA-N -1 1 315.394 4.159 20 0 DIADMM O=C(c1ccc(Cl)cc1[O-])N1CCC[C@@H](C2CCCC2)C1 ZINC001181054978 1049431741 /nfs/dbraw/zinc/43/17/41/1049431741.db2.gz YWTUFUBUCOYTQG-CYBMUJFWSA-N -1 1 307.821 4.088 20 0 DIADMM Cc1cc(C)c(NC(=O)Nc2cc(F)c([O-])c(F)c2)c(C)c1 ZINC001181264819 1049456307 /nfs/dbraw/zinc/45/63/07/1049456307.db2.gz FZXDGQCZLGSTPK-UHFFFAOYSA-N -1 1 306.312 4.240 20 0 DIADMM O=C(Nc1cc(Cl)c(Cl)cc1[O-])Oc1ccc(F)cc1 ZINC001195036081 1049464560 /nfs/dbraw/zinc/46/45/60/1049464560.db2.gz GROADXCAJOMKEH-UHFFFAOYSA-N -1 1 316.115 4.449 20 0 DIADMM CC(C)(C)CCCC(=O)Nc1cccc([O-])c1Br ZINC000908716782 1049501712 /nfs/dbraw/zinc/50/17/12/1049501712.db2.gz OESRZUQDRTZABB-UHFFFAOYSA-N -1 1 314.223 4.310 20 0 DIADMM CCCC[C@](C)(F)C(=O)Nc1cccc([O-])c1Br ZINC000908708180 1049499569 /nfs/dbraw/zinc/49/95/69/1049499569.db2.gz PWMASXVINQJOML-ZDUSSCGKSA-N -1 1 318.186 4.012 20 0 DIADMM CCC(CC)(CC)C(=O)Nc1cccc([O-])c1Br ZINC000908710079 1049501975 /nfs/dbraw/zinc/50/19/75/1049501975.db2.gz WBENAMWLCANGEK-UHFFFAOYSA-N -1 1 314.223 4.310 20 0 DIADMM CCNc1ccnc(Cl)c1Nc1cc(Cl)c([O-])cc1F ZINC001250019780 1049514724 /nfs/dbraw/zinc/51/47/24/1049514724.db2.gz FBTGWHIYSCPUJW-UHFFFAOYSA-N -1 1 316.163 4.409 20 0 DIADMM CC(C)N(C(=O)c1cc([O-])cnc1Cl)[C@@H](C)c1ccccc1 ZINC001195308547 1049516560 /nfs/dbraw/zinc/51/65/60/1049516560.db2.gz GCJSZPSAJBWBTR-LBPRGKRZSA-N -1 1 318.804 4.052 20 0 DIADMM COC(=O)c1ccc(Nc2cc(Cl)c([O-])cc2F)c(C)c1 ZINC001250022666 1049535916 /nfs/dbraw/zinc/53/59/16/1049535916.db2.gz RJYZSMTWAHEKHF-UHFFFAOYSA-N -1 1 309.724 4.023 20 0 DIADMM CC(=O)c1sc([N-]c2c3nsnc3ccc2Cl)nc1C ZINC000773952569 1049539237 /nfs/dbraw/zinc/53/92/37/1049539237.db2.gz AGXIQXKXAWDUHL-UHFFFAOYSA-N -1 1 324.818 4.056 20 0 DIADMM Cc1cccc(C2(C(=O)Nc3cc([O-])c(F)cc3F)CCC2)c1 ZINC000909975038 1049572748 /nfs/dbraw/zinc/57/27/48/1049572748.db2.gz OBOBHYLRAKXFFZ-UHFFFAOYSA-N -1 1 317.335 4.039 20 0 DIADMM CC(C)Cn1cc(Nc2c(Cl)ccc([O-])c2Cl)cn1 ZINC001205870594 1049588965 /nfs/dbraw/zinc/58/89/65/1049588965.db2.gz QSURJBOPJAXFEP-UHFFFAOYSA-N -1 1 300.189 4.295 20 0 DIADMM CCc1ccccc1S(=O)(=O)[N-]c1cccc(SC)c1C ZINC000488223095 1049614771 /nfs/dbraw/zinc/61/47/71/1049614771.db2.gz ZGLQTLKGTSRROS-UHFFFAOYSA-N -1 1 321.467 4.080 20 0 DIADMM CCc1cc(=O)[n-]c(SC[C@@H](OC(C)C)c2ccccc2)n1 ZINC000488269463 1049624791 /nfs/dbraw/zinc/62/47/91/1049624791.db2.gz YMUUKBCXBBDFRI-OAHLLOKOSA-N -1 1 318.442 4.003 20 0 DIADMM Cc1sc(C)c2c1[n-]c(CC[C@H]1CC1(Cl)Cl)nc2=O ZINC000864355635 1049651959 /nfs/dbraw/zinc/65/19/59/1049651959.db2.gz NWTKLJORNUNUOK-QMMMGPOBSA-N -1 1 317.241 4.140 20 0 DIADMM CCC[C@H]1[C@@H](C)CCCN1C(=O)Cc1ccc([O-])c(Cl)c1 ZINC001294211257 1049681034 /nfs/dbraw/zinc/68/10/34/1049681034.db2.gz DPCDZLFDRSDWOF-WFASDCNBSA-N -1 1 309.837 4.015 20 0 DIADMM [O-]c1cc(F)c(NC(=S)Nc2ccc(Cl)cc2)c(F)c1 ZINC001197336071 1049744237 /nfs/dbraw/zinc/74/42/37/1049744237.db2.gz DOUKJVKMJXVMNV-UHFFFAOYSA-N -1 1 314.744 4.133 20 0 DIADMM CCC[C@@H]1CCCC[C@H]1[N-]S(=O)(=O)c1sccc1Cl ZINC001209229593 1050045931 /nfs/dbraw/zinc/04/59/31/1050045931.db2.gz BIEFGNRGZSXGIN-ZYHUDNBSSA-N -1 1 321.895 4.039 20 0 DIADMM [O-]c1c(Cl)nccc1Nc1ccc(C(F)(F)F)c(F)c1 ZINC001209911420 1050104697 /nfs/dbraw/zinc/10/46/97/1050104697.db2.gz ZCHNLBQQVSNYPR-UHFFFAOYSA-N -1 1 306.646 4.342 20 0 DIADMM [O-]c1c(Cl)cc(Cl)cc1Nc1cc(F)ccc1CO ZINC001210185883 1050151493 /nfs/dbraw/zinc/15/14/93/1050151493.db2.gz YYXDKZYMWFUNNW-UHFFFAOYSA-N -1 1 302.132 4.074 20 0 DIADMM O=C(NC[C@H]1CCc2ccccc21)c1ccc2ccccc2c1[O-] ZINC001136784940 1050159652 /nfs/dbraw/zinc/15/96/52/1050159652.db2.gz JCVBSTNUTIEJKG-MRXNPFEDSA-N -1 1 317.388 4.005 20 0 DIADMM C/C(=C\c1ccc(Cl)cc1)C(=O)Nc1c([O-])cccc1F ZINC000770863845 1050195909 /nfs/dbraw/zinc/19/59/09/1050195909.db2.gz VNDCGCUNNXKHHL-MDZDMXLPSA-N -1 1 305.736 4.227 20 0 DIADMM CCOc1cc(-c2noc(C[C@H](C)C3CC3)n2)cc(Cl)c1[O-] ZINC000771107192 1050221571 /nfs/dbraw/zinc/22/15/71/1050221571.db2.gz DKPWQACQGFSQBS-VIFPVBQESA-N -1 1 322.792 4.083 20 0 DIADMM [O-]c1c(Cl)c(Cl)ccc1Nc1ccc2ncncc2c1 ZINC001210458807 1050254572 /nfs/dbraw/zinc/25/45/72/1050254572.db2.gz RKCDHTLGMPAKDO-UHFFFAOYSA-N -1 1 306.152 4.386 20 0 DIADMM [O-]c1ccc(Cl)c(Nc2ccc(CO)c(F)c2)c1Cl ZINC001210487666 1050264368 /nfs/dbraw/zinc/26/43/68/1050264368.db2.gz IRLOHLMWAFVQSC-UHFFFAOYSA-N -1 1 302.132 4.074 20 0 DIADMM Cc1c(Cl)cc(Nc2ccc(CO)c(F)c2)c([O-])c1Cl ZINC001210486963 1050264558 /nfs/dbraw/zinc/26/45/58/1050264558.db2.gz CFNHEQSHMVGUME-UHFFFAOYSA-N -1 1 316.159 4.382 20 0 DIADMM Cc1cccc([C@@H](C)NC(=O)c2c([O-])cccc2Cl)c1C ZINC000734558160 1050289637 /nfs/dbraw/zinc/28/96/37/1050289637.db2.gz QUOKLSCRFXPOOW-GFCCVEGCSA-N -1 1 303.789 4.153 20 0 DIADMM [O-]c1c(Br)c(F)ccc1Nc1ccc2ocnc2c1 ZINC001210571585 1050300076 /nfs/dbraw/zinc/30/00/76/1050300076.db2.gz AMJUVRTUZFGFIH-UHFFFAOYSA-N -1 1 323.121 4.179 20 0 DIADMM Cc1cccc(C(=O)Nc2ccc(C(=O)C(C)(C)C)cc2)c1[O-] ZINC001137045062 1050310144 /nfs/dbraw/zinc/31/01/44/1050310144.db2.gz UYDSWANFRRKFBM-UHFFFAOYSA-N -1 1 311.381 4.182 20 0 DIADMM [O-]c1ccc(Cl)c(Nc2cccnc2OC(F)F)c1Cl ZINC001210627805 1050318218 /nfs/dbraw/zinc/31/82/18/1050318218.db2.gz NZCZLSOYQJLPFE-UHFFFAOYSA-N -1 1 321.110 4.439 20 0 DIADMM Cc1ccccc1C([N-]C(=O)C(F)(F)F)c1ccccc1C ZINC000760988955 1050326922 /nfs/dbraw/zinc/32/69/22/1050326922.db2.gz SQBHLPWJLIAKOV-UHFFFAOYSA-N -1 1 307.315 4.071 20 0 DIADMM CCC/C=C/C(=O)Nc1c([O-])cc(Br)cc1Cl ZINC000843887731 1050329696 /nfs/dbraw/zinc/32/96/96/1050329696.db2.gz YVNTTWNDXJLPGU-SNAWJCMRSA-N -1 1 318.598 4.103 20 0 DIADMM O=C(c1cc2ccccc2cc1[O-])N1CCCc2sccc2C1 ZINC000593422732 1050417298 /nfs/dbraw/zinc/41/72/98/1050417298.db2.gz QAXGZYHJWAOHPQ-UHFFFAOYSA-N -1 1 323.417 4.196 20 0 DIADMM [O-]c1c(Cl)cc(Nc2ccnc(Cl)c2O)cc1Cl ZINC001210927298 1050418813 /nfs/dbraw/zinc/41/88/13/1050418813.db2.gz OLFGBXZTMXDDIJ-UHFFFAOYSA-N -1 1 305.548 4.197 20 0 DIADMM O=C(Nc1c([O-])cccc1F)c1ccc(SC(F)F)cc1 ZINC000735924942 1050439109 /nfs/dbraw/zinc/43/91/09/1050439109.db2.gz HOVDLBMWTIRXQH-UHFFFAOYSA-N -1 1 313.300 4.098 20 0 DIADMM Cc1ccc(N(Cc2cccs2)C(=O)c2cncc([O-])c2)cc1 ZINC000786138573 1050456567 /nfs/dbraw/zinc/45/65/67/1050456567.db2.gz AXBSETZXTIBAAY-UHFFFAOYSA-N -1 1 324.405 4.004 20 0 DIADMM COc1ncc(Nc2c(Cl)ccc([O-])c2Cl)cc1Cl ZINC001211048100 1050456859 /nfs/dbraw/zinc/45/68/59/1050456859.db2.gz JTLKBUKOOMRDPG-UHFFFAOYSA-N -1 1 319.575 4.500 20 0 DIADMM COc1ncc(Nc2ccc(Cl)c(Cl)c2[O-])cc1Cl ZINC001211048608 1050457627 /nfs/dbraw/zinc/45/76/27/1050457627.db2.gz ZRFJWSAIIPVFEW-UHFFFAOYSA-N -1 1 319.575 4.500 20 0 DIADMM c1coc(-c2nnc([N-]c3cccc(-c4cccnc4)c3)o2)c1 ZINC001211143503 1050495695 /nfs/dbraw/zinc/49/56/95/1050495695.db2.gz MYKLAQMZMYPIDF-UHFFFAOYSA-N -1 1 304.309 4.135 20 0 DIADMM COC(=O)c1cc2c(cccc2-c2cc(F)c([O-])cc2F)s1 ZINC001211338741 1050551750 /nfs/dbraw/zinc/55/17/50/1050551750.db2.gz ITJIBSUWZKGVKU-UHFFFAOYSA-N -1 1 320.316 4.339 20 0 DIADMM [O-]c1cc(F)c(-c2cncc(OCc3ccccc3)c2)cc1F ZINC001211349843 1050554295 /nfs/dbraw/zinc/55/42/95/1050554295.db2.gz IXDAMZZPYXQCHN-UHFFFAOYSA-N -1 1 313.303 4.311 20 0 DIADMM CSCc1cccc(NC(=O)c2cc(SC)ccc2[O-])c1 ZINC001144413179 1050567241 /nfs/dbraw/zinc/56/72/41/1050567241.db2.gz AMINFIXELPLQQU-UHFFFAOYSA-N -1 1 319.451 4.229 20 0 DIADMM [O-]c1cc(Nc2ccc(-c3ncc[nH]3)cc2)c(F)cc1Cl ZINC001213088776 1050583907 /nfs/dbraw/zinc/58/39/07/1050583907.db2.gz CVKKAKRZUVRSHT-UHFFFAOYSA-N -1 1 303.724 4.318 20 0 DIADMM [O-]c1cc(F)c(CN2CCCC[C@@H]2c2ccccc2)c(F)c1 ZINC001144542395 1050610855 /nfs/dbraw/zinc/61/08/55/1050610855.db2.gz WAJFBOQRUGWUQE-GOSISDBHSA-N -1 1 303.352 4.398 20 0 DIADMM CN(Cc1ccc2ccccc2c1)Cc1c(F)cc([O-])cc1F ZINC001144560821 1050618298 /nfs/dbraw/zinc/61/82/98/1050618298.db2.gz APIFRLFKGQBMIF-UHFFFAOYSA-N -1 1 313.347 4.456 20 0 DIADMM Nc1cc(F)cc(C(F)(F)F)c1Nc1cc(F)c([O-])c(F)c1 ZINC001213388907 1050647129 /nfs/dbraw/zinc/64/71/29/1050647129.db2.gz SFBJGGCRESCWFW-UHFFFAOYSA-N -1 1 322.208 4.154 20 0 DIADMM COc1c(N)cc(C(C)(C)C)cc1Nc1cc(F)c([O-])c(F)c1 ZINC001213389031 1050647392 /nfs/dbraw/zinc/64/73/92/1050647392.db2.gz YMYSUYPZPHJQRG-UHFFFAOYSA-N -1 1 322.355 4.302 20 0 DIADMM Cc1c(Nc2cc3ccc([O-])cc3oc2=O)cccc1C1CC1 ZINC001213473268 1050666203 /nfs/dbraw/zinc/66/62/03/1050666203.db2.gz WAZGTGPYMMDFJX-UHFFFAOYSA-N -1 1 307.349 4.428 20 0 DIADMM CSc1cccnc1[N-]C(=O)c1ccc(-c2cccs2)o1 ZINC001144820754 1050720549 /nfs/dbraw/zinc/72/05/49/1050720549.db2.gz QEFYKPOVEFTWRG-UHFFFAOYSA-N -1 1 316.407 4.377 20 0 DIADMM O=C(c1ccc2ccccc2c1[O-])N1CCCC[C@H]1C1CCC1 ZINC001144953773 1050769268 /nfs/dbraw/zinc/76/92/68/1050769268.db2.gz QZLBEUVMCDIPOY-SFHVURJKSA-N -1 1 309.409 4.340 20 0 DIADMM CN(Cc1ccc(Cl)c([O-])c1)[C@@H](C1CCC1)C(F)(F)F ZINC001231736318 1050776955 /nfs/dbraw/zinc/77/69/55/1050776955.db2.gz HMJXNKXASYEPIG-ZDUSSCGKSA-N -1 1 307.743 4.208 20 0 DIADMM [O-]c1cc(Nc2ccc(CC(F)(F)F)nc2)c(F)cc1Cl ZINC001213916477 1050778603 /nfs/dbraw/zinc/77/86/03/1050778603.db2.gz UBIQEAOFXRSXKM-UHFFFAOYSA-N -1 1 320.673 4.428 20 0 DIADMM Cc1cc(NC(=O)c2cc(F)ccc2[O-])cc(C(F)(F)F)c1 ZINC001146376555 1050821406 /nfs/dbraw/zinc/82/14/06/1050821406.db2.gz ZUIJHXDBNTVMBT-UHFFFAOYSA-N -1 1 313.250 4.111 20 0 DIADMM COCOc1cccc(Cl)c1Nc1ccc(F)c(F)c1[O-] ZINC001214314510 1050867317 /nfs/dbraw/zinc/86/73/17/1050867317.db2.gz YSILABKQKLRLTH-UHFFFAOYSA-N -1 1 315.703 4.050 20 0 DIADMM CC[C@H]1CCC[C@@H](NC(=O)c2ccc(C(F)(F)F)cc2[O-])C1 ZINC001147264028 1050872807 /nfs/dbraw/zinc/87/28/07/1050872807.db2.gz ZKBUVBFDMZDFLY-CMPLNLGQSA-N -1 1 315.335 4.110 20 0 DIADMM Cc1ccc(Nc2ccc(-n3ccc(=O)[n-]3)cc2)cc1OC(C)C ZINC001214336837 1050877031 /nfs/dbraw/zinc/87/70/31/1050877031.db2.gz DJWPPFBYPSEUNR-UHFFFAOYSA-N -1 1 323.396 4.417 20 0 DIADMM [O-]c1c(F)cc(Nc2ccc(OC(F)(F)F)cc2O)cc1F ZINC001214395693 1050892052 /nfs/dbraw/zinc/89/20/52/1050892052.db2.gz VPWMZAIFFCRYAG-UHFFFAOYSA-N -1 1 321.201 4.018 20 0 DIADMM Cc1c(Cl)cc(N)cc1Nc1cc(F)c([O-])c(Cl)c1 ZINC001214491612 1050923474 /nfs/dbraw/zinc/92/34/74/1050923474.db2.gz FUAKMKNXJGRJSC-UHFFFAOYSA-N -1 1 301.148 4.472 20 0 DIADMM CCc1cc(C(=O)Nc2cccc(C(F)(F)F)c2[O-])cs1 ZINC001147714626 1050898915 /nfs/dbraw/zinc/89/89/15/1050898915.db2.gz TZEKJYCHDMGKKZ-UHFFFAOYSA-N -1 1 315.316 4.287 20 0 DIADMM COCOc1cccc(F)c1Nc1cc([O-])c(Cl)cc1F ZINC001214440412 1050903574 /nfs/dbraw/zinc/90/35/74/1050903574.db2.gz RWZUKLVZHDZWDL-UHFFFAOYSA-N -1 1 315.703 4.050 20 0 DIADMM [O-]c1c(F)cc(Nc2ccnc(C(F)(F)F)c2)cc1Cl ZINC001214479912 1050918080 /nfs/dbraw/zinc/91/80/80/1050918080.db2.gz JUZQWCXHVFSFOO-UHFFFAOYSA-N -1 1 306.646 4.342 20 0 DIADMM O=c1[nH]cc(Nc2cc(F)c([O-])c(Cl)c2)c2ccccc12 ZINC001214482871 1050918525 /nfs/dbraw/zinc/91/85/25/1050918525.db2.gz SNRDBPLINIKOJU-UHFFFAOYSA-N -1 1 304.708 4.182 20 0 DIADMM CC(C)c1c(Cl)ncnc1Nc1cc(F)c([O-])c(Cl)c1 ZINC001214486432 1050919589 /nfs/dbraw/zinc/91/95/89/1050919589.db2.gz HPWAXGMQUQZVEE-UHFFFAOYSA-N -1 1 316.163 4.495 20 0 DIADMM [O-]c1c(F)cc(Nc2cccc(Cn3ccnc3)c2)cc1Cl ZINC001214488353 1050919952 /nfs/dbraw/zinc/91/99/52/1050919952.db2.gz DJCZROWAGWDHHM-UHFFFAOYSA-N -1 1 317.751 4.173 20 0 DIADMM COc1ccc(Nc2cc(F)c([O-])c(Cl)c2)c(OC)c1F ZINC001214491653 1050921713 /nfs/dbraw/zinc/92/17/13/1050921713.db2.gz HVYPXISFZSDECH-UHFFFAOYSA-N -1 1 315.703 4.085 20 0 DIADMM O=C1CCCc2cccc(Nc3cc(F)c([O-])c(Cl)c3)c21 ZINC001214491613 1050922236 /nfs/dbraw/zinc/92/22/36/1050922236.db2.gz FUUIFQSURRTLLK-UHFFFAOYSA-N -1 1 305.736 4.447 20 0 DIADMM Nc1cc(F)cc(Cl)c1Nc1cc(F)c([O-])c(Cl)c1 ZINC001214491996 1050922485 /nfs/dbraw/zinc/92/24/85/1050922485.db2.gz OLKYNRHWUFHBRB-UHFFFAOYSA-N -1 1 305.111 4.303 20 0 DIADMM Nc1cc(Cl)cc(F)c1Nc1cc(F)c([O-])c(Cl)c1 ZINC001214492161 1050923139 /nfs/dbraw/zinc/92/31/39/1050923139.db2.gz RPXACDBLUZGIRK-UHFFFAOYSA-N -1 1 305.111 4.303 20 0 DIADMM O=C(CSC(F)F)Nc1cc(Cl)c([O-])c2ccccc12 ZINC001148253062 1050928196 /nfs/dbraw/zinc/92/81/96/1050928196.db2.gz OSSAWYZSXWKOAJ-UHFFFAOYSA-N -1 1 317.744 4.093 20 0 DIADMM O=C(Nc1ccccc1O)c1cccc(-c2ccccc2)c1[O-] ZINC001148869609 1050980380 /nfs/dbraw/zinc/98/03/80/1050980380.db2.gz LZUGJIXEIUXUFR-UHFFFAOYSA-N -1 1 305.333 4.017 20 0 DIADMM C/C(=C\C(=O)Nc1c([O-])cccc1F)c1ccccc1Cl ZINC000743416271 1051025822 /nfs/dbraw/zinc/02/58/22/1051025822.db2.gz PPJFRSISGBZRSW-MDZDMXLPSA-N -1 1 305.736 4.227 20 0 DIADMM [O-]c1ccc(-c2ccc(F)c(OC(F)(F)F)c2)c(F)c1F ZINC001243342634 1051064291 /nfs/dbraw/zinc/06/42/91/1051064291.db2.gz MMEFRGBDKXTJBZ-UHFFFAOYSA-N -1 1 308.177 4.375 20 0 DIADMM COc1ccc(C(F)(F)F)c(-c2ccc([O-])c(F)c2F)c1 ZINC001243344019 1051069287 /nfs/dbraw/zinc/06/92/87/1051069287.db2.gz VYOASSVJSAPMPJ-UHFFFAOYSA-N -1 1 304.214 4.365 20 0 DIADMM COc1ccc(-c2nc(-c3cccc(Cl)c3C)no2)c([O-])c1 ZINC001215147909 1051087977 /nfs/dbraw/zinc/08/79/77/1051087977.db2.gz SCJJPUYQZBHEOU-UHFFFAOYSA-N -1 1 316.744 4.080 20 0 DIADMM O=C(Nc1ccc([O-])c(Cl)c1)c1cc(O)c2ccccc2c1 ZINC000792259556 1051132619 /nfs/dbraw/zinc/13/26/19/1051132619.db2.gz PUUVHSUTONXJIW-UHFFFAOYSA-N -1 1 313.740 4.157 20 0 DIADMM COc1cc(C)ccc1-c1noc(-c2ccc([O-])cc2Cl)n1 ZINC001215343366 1051172672 /nfs/dbraw/zinc/17/26/72/1051172672.db2.gz UXOBULYVFHGWBM-UHFFFAOYSA-N -1 1 316.744 4.080 20 0 DIADMM [O-]c1ccc(-c2nc(-c3ccc(F)cc3F)no2)c(Cl)c1 ZINC001215342911 1051172968 /nfs/dbraw/zinc/17/29/68/1051172968.db2.gz GKLIEJDNXOJVQS-UHFFFAOYSA-N -1 1 308.671 4.041 20 0 DIADMM Cc1cc(F)c(F)c(-c2noc(-c3ccc([O-])cc3Cl)n2)c1 ZINC001215345994 1051173076 /nfs/dbraw/zinc/17/30/76/1051173076.db2.gz WULBNNXXINZHGU-UHFFFAOYSA-N -1 1 322.698 4.349 20 0 DIADMM [O-]c1ccc(-c2nc(-c3ccc4cnccc4c3)no2)c(Cl)c1 ZINC001215343553 1051173172 /nfs/dbraw/zinc/17/31/72/1051173172.db2.gz YLCXUGSUJNECPU-UHFFFAOYSA-N -1 1 323.739 4.311 20 0 DIADMM Cc1c(F)ccc(-c2noc(-c3ccc([O-])cc3Cl)n2)c1F ZINC001215345833 1051173210 /nfs/dbraw/zinc/17/32/10/1051173210.db2.gz MQNFDCCGFVOATB-UHFFFAOYSA-N -1 1 322.698 4.349 20 0 DIADMM O=C(Nc1ccc2occc2c1)c1ccc2ccc(O)cc2c1[O-] ZINC001171632985 1051175401 /nfs/dbraw/zinc/17/54/01/1051175401.db2.gz ZWAJAQJWELWZGS-UHFFFAOYSA-N -1 1 319.316 4.250 20 0 DIADMM CC(C)Oc1c(Nc2cc([O-])c(F)c(F)c2)ccc(F)c1F ZINC001215426356 1051201788 /nfs/dbraw/zinc/20/17/88/1051201788.db2.gz MQEUKLMWWVEAQP-UHFFFAOYSA-N -1 1 315.266 4.479 20 0 DIADMM Fc1cc(Nc2ccc3[n-]c(=S)sc3c2)cc2[nH]ncc21 ZINC001215555887 1051240326 /nfs/dbraw/zinc/24/03/26/1051240326.db2.gz QCHXJOOSOPFBPE-UHFFFAOYSA-N -1 1 316.386 4.344 20 0 DIADMM CCCOc1ccc(F)c(Nc2ccnc(Cl)c2[O-])c1F ZINC001215568414 1051249491 /nfs/dbraw/zinc/24/94/91/1051249491.db2.gz IFBDJHVAWIGQCL-UHFFFAOYSA-N -1 1 314.719 4.251 20 0 DIADMM Nc1cccc(C(F)(F)F)c1Nc1cc(F)c([O-])cc1F ZINC001215576168 1051253180 /nfs/dbraw/zinc/25/31/80/1051253180.db2.gz LYMHJABHDIPLDD-UHFFFAOYSA-N -1 1 304.218 4.015 20 0 DIADMM O=C1CCCCc2cc(Nc3cc(F)c([O-])cc3F)ccc21 ZINC001215574292 1051253381 /nfs/dbraw/zinc/25/33/81/1051253381.db2.gz PEMNNPYROPCALK-UHFFFAOYSA-N -1 1 303.308 4.323 20 0 DIADMM Cc1ccc(Br)c(Nc2cc(F)c([O-])cc2F)c1 ZINC001215573722 1051253631 /nfs/dbraw/zinc/25/36/31/1051253631.db2.gz OXRFMZGXAOEKMU-UHFFFAOYSA-N -1 1 314.129 4.485 20 0 DIADMM O=C1CCCCc2c(Nc3cc(F)c([O-])cc3F)cccc21 ZINC001215575560 1051254733 /nfs/dbraw/zinc/25/47/33/1051254733.db2.gz ANTSHASRIRRHRJ-UHFFFAOYSA-N -1 1 303.308 4.323 20 0 DIADMM [O-]c1cc(F)c(Nc2ccc(OC(F)(F)F)cc2F)cc1F ZINC001215573812 1051255195 /nfs/dbraw/zinc/25/51/95/1051255195.db2.gz IVEMXBXTCKEWCZ-UHFFFAOYSA-N -1 1 323.192 4.452 20 0 DIADMM [O-]c1cc(F)cc(F)c1Nc1ccc(C(F)(F)F)cc1O ZINC001212632748 1051257979 /nfs/dbraw/zinc/25/79/79/1051257979.db2.gz WVNGPJAGCTZOEX-UHFFFAOYSA-N -1 1 305.202 4.138 20 0 DIADMM CC(C)Oc1c(F)ccc(Nc2cc(F)c([O-])cc2F)c1F ZINC001215730671 1051329885 /nfs/dbraw/zinc/32/98/85/1051329885.db2.gz BILOHOLZTNFHTP-UHFFFAOYSA-N -1 1 315.266 4.479 20 0 DIADMM CCOCc1cncc(Nc2cc(Cl)cc(Cl)c2[O-])c1 ZINC001215789386 1051371590 /nfs/dbraw/zinc/37/15/90/1051371590.db2.gz NWVZMJSZZJFOMI-UHFFFAOYSA-N -1 1 313.184 4.374 20 0 DIADMM Cc1nsc([N-]c2cc(Cl)cc(C(F)(F)F)c2F)n1 ZINC001215813545 1051385425 /nfs/dbraw/zinc/38/54/25/1051385425.db2.gz DNANQNZYIRFFAD-UHFFFAOYSA-N -1 1 311.691 4.401 20 0 DIADMM [O-]c1ccc(-c2nc(-c3cc(F)ccc3Cl)no2)c(F)c1 ZINC001215826815 1051391799 /nfs/dbraw/zinc/39/17/99/1051391799.db2.gz STISCHGDTPQEDR-UHFFFAOYSA-N -1 1 308.671 4.041 20 0 DIADMM Cc1cc(Cl)ccc1-c1noc(-c2ccc(F)c([O-])c2)n1 ZINC001215839715 1051404570 /nfs/dbraw/zinc/40/45/70/1051404570.db2.gz ZEYKQVVWPLSCIH-UHFFFAOYSA-N -1 1 304.708 4.210 20 0 DIADMM CSc1cc(F)c(Nc2cc(F)c([O-])c(F)c2)c(F)c1 ZINC001215842224 1051407794 /nfs/dbraw/zinc/40/77/94/1051407794.db2.gz HHBXCLKMAUXTIS-UHFFFAOYSA-N -1 1 303.280 4.414 20 0 DIADMM CSc1c(F)cc(Nc2c([O-])cc(F)cc2F)cc1F ZINC001215925299 1051461744 /nfs/dbraw/zinc/46/17/44/1051461744.db2.gz POEIOBKHVOOBSE-UHFFFAOYSA-N -1 1 303.280 4.414 20 0 DIADMM FC(F)(F)c1ccc([N-]c2nonc2C2CC2)c(Cl)c1 ZINC001215970312 1051493121 /nfs/dbraw/zinc/49/31/21/1051493121.db2.gz ITIYLPBCUHRNJI-UHFFFAOYSA-N -1 1 303.671 4.363 20 0 DIADMM [O-]c1cccc(-c2nc(-c3ccc(F)c(Cl)c3)no2)c1F ZINC001215983924 1051502069 /nfs/dbraw/zinc/50/20/69/1051502069.db2.gz AZNGNHJSXJYQMZ-UHFFFAOYSA-N -1 1 308.671 4.041 20 0 DIADMM CCCOc1ccc(-c2noc(-c3cccc([O-])c3F)n2)cc1 ZINC001215989069 1051505676 /nfs/dbraw/zinc/50/56/76/1051505676.db2.gz PNLPXXQLRQGOLZ-UHFFFAOYSA-N -1 1 314.316 4.037 20 0 DIADMM Cc1ccc(-n2[n-]c(=O)c3cc(N)ccc32)cc1-c1ccccc1 ZINC001216147966 1051603252 /nfs/dbraw/zinc/60/32/52/1051603252.db2.gz MHFGFTLNYIFQAW-UHFFFAOYSA-N -1 1 315.376 4.289 20 0 DIADMM O=C(Nc1cccc2cnccc21)c1ccc2ccccc2c1[O-] ZINC000324180279 1051611223 /nfs/dbraw/zinc/61/12/23/1051611223.db2.gz HPRDSBWYHOZKFU-UHFFFAOYSA-N -1 1 314.344 4.346 20 0 DIADMM CCN(CC)c1cc(F)cc([N-]c2nnc(-c3ccco3)o2)c1 ZINC001216180897 1051616292 /nfs/dbraw/zinc/61/62/92/1051616292.db2.gz FTZPUQJTGWLQSU-UHFFFAOYSA-N -1 1 316.336 4.059 20 0 DIADMM COc1ccc(C(C)=O)c(Nc2ccc(Cl)c([O-])c2)c1C ZINC001212593519 1051664710 /nfs/dbraw/zinc/66/47/10/1051664710.db2.gz VSJFYKOYIJRUDW-UHFFFAOYSA-N -1 1 305.761 4.309 20 0 DIADMM O=c1ccn(-c2ccc(Nc3ccc(F)c4ccoc43)cc2)[n-]1 ZINC001216297747 1051682713 /nfs/dbraw/zinc/68/27/13/1051682713.db2.gz CXACKMKWSWVDJJ-UHFFFAOYSA-N -1 1 309.300 4.207 20 0 DIADMM Cc1c(Cl)cccc1Nc1cc2ccc([O-])cc2oc1=O ZINC001216324543 1051699437 /nfs/dbraw/zinc/69/94/37/1051699437.db2.gz JBULYUILAUQTPV-UHFFFAOYSA-N -1 1 301.729 4.204 20 0 DIADMM [O-]c1cc(F)cc(-c2nc(-c3ccccc3C(F)(F)F)no2)c1 ZINC001216339757 1051707079 /nfs/dbraw/zinc/70/70/79/1051707079.db2.gz LGWBCWAASUJAGQ-UHFFFAOYSA-N -1 1 324.233 4.267 20 0 DIADMM [O-]c1cc(F)cc(-c2nc(-c3cccc(Cl)c3F)no2)c1 ZINC001216339136 1051707138 /nfs/dbraw/zinc/70/71/38/1051707138.db2.gz AJLDFOWQQSBETE-UHFFFAOYSA-N -1 1 308.671 4.041 20 0 DIADMM Cc1ccc(-c2noc(-c3cc([O-])cc(F)c3)n2)cc1Cl ZINC001216340053 1051707928 /nfs/dbraw/zinc/70/79/28/1051707928.db2.gz QEISCWNPAQUFCG-UHFFFAOYSA-N -1 1 304.708 4.210 20 0 DIADMM Cc1cc([N-]c2nnc(-c3ccco3)o2)c(OC(C)C)cc1C ZINC001216378845 1051734450 /nfs/dbraw/zinc/73/44/50/1051734450.db2.gz OMTKAAIGWGUQFL-UHFFFAOYSA-N -1 1 313.357 4.477 20 0 DIADMM O=C([N-]c1cc(-c2ccccc2)on1)c1c(F)ccc(F)c1F ZINC000185607573 1051777189 /nfs/dbraw/zinc/77/71/89/1051777189.db2.gz NLQAOTDZVZXYDS-UHFFFAOYSA-N -1 1 318.254 4.011 20 0 DIADMM Cc1cc(OCc2ccc([N-]c3nnco3)cc2)ccc1Cl ZINC001216518292 1051802053 /nfs/dbraw/zinc/80/20/53/1051802053.db2.gz WAEAWRMMHNAVOW-UHFFFAOYSA-N -1 1 315.760 4.354 20 0 DIADMM CCN(Cc1ccccc1C)C(=O)c1cc(Cl)ccc1[O-] ZINC000220094880 1051824131 /nfs/dbraw/zinc/82/41/31/1051824131.db2.gz MSCUPXMBLYGLBF-UHFFFAOYSA-N -1 1 303.789 4.016 20 0 DIADMM COc1c(F)cc(SC)cc1Nc1ccc(F)c(F)c1[O-] ZINC001216583706 1051826701 /nfs/dbraw/zinc/82/67/01/1051826701.db2.gz HCVIGPHFHKJBCJ-UHFFFAOYSA-N -1 1 315.316 4.284 20 0 DIADMM CC(=O)Nc1cccc(Nc2cc(Cl)c([O-])cc2Cl)c1 ZINC001173834022 1051851505 /nfs/dbraw/zinc/85/15/05/1051851505.db2.gz UKNOONUBIMQZNI-UHFFFAOYSA-N -1 1 311.168 4.401 20 0 DIADMM CC(=O)Nc1cccc(Nc2ccc(Cl)c(Cl)c2[O-])c1 ZINC001173835377 1051853301 /nfs/dbraw/zinc/85/33/01/1051853301.db2.gz JXMJYBNDQMXIMH-UHFFFAOYSA-N -1 1 311.168 4.401 20 0 DIADMM [O-]c1c(Br)c(F)ccc1Nc1cc(F)cc(F)c1 ZINC001173917112 1051877127 /nfs/dbraw/zinc/87/71/27/1051877127.db2.gz YXCLSODRMRTWPB-UHFFFAOYSA-N -1 1 318.092 4.316 20 0 DIADMM COc1ccc(OC)c(Nc2cc(Cl)c([O-])cc2Cl)c1 ZINC001173919722 1051878118 /nfs/dbraw/zinc/87/81/18/1051878118.db2.gz LPHHVZXZZYBQLU-UHFFFAOYSA-N -1 1 314.168 4.460 20 0 DIADMM COc1cccc(OC)c1Nc1c(Cl)ccc([O-])c1Cl ZINC001173924400 1051880814 /nfs/dbraw/zinc/88/08/14/1051880814.db2.gz SFPVXLSASWMRKP-UHFFFAOYSA-N -1 1 314.168 4.460 20 0 DIADMM Cc1cccc(-c2noc(-c3cc(C(F)(F)F)ccc3[O-])n2)c1 ZINC001216831764 1051891693 /nfs/dbraw/zinc/89/16/93/1051891693.db2.gz BIXXRUJCUZSKQY-UHFFFAOYSA-N -1 1 320.270 4.436 20 0 DIADMM Cc1cc(F)ccc1Nc1ccc(F)c(Br)c1[O-] ZINC001173968250 1051898018 /nfs/dbraw/zinc/89/80/18/1051898018.db2.gz QLMWWOYHSNETLM-UHFFFAOYSA-N -1 1 314.129 4.485 20 0 DIADMM [O-]c1c(Br)c(F)ccc1Nc1ccc(F)cc1F ZINC001173928034 1051900519 /nfs/dbraw/zinc/90/05/19/1051900519.db2.gz KRQIWBFRZXFPID-UHFFFAOYSA-N -1 1 318.092 4.316 20 0 DIADMM CCCCc1ccc(N(C)C(=O)c2ccc([O-])c(F)c2)cc1 ZINC000768224028 1051903948 /nfs/dbraw/zinc/90/39/48/1051903948.db2.gz OLLYAIMJBLRBRN-UHFFFAOYSA-N -1 1 301.361 4.151 20 0 DIADMM FC(F)c1nnc([N-]Cc2ccc(Oc3ccccc3)o2)o1 ZINC000189288635 1051907191 /nfs/dbraw/zinc/90/71/91/1051907191.db2.gz ZCLBQDNJKGDBHJ-UHFFFAOYSA-N -1 1 307.256 4.005 20 0 DIADMM [O-]c1cc(F)c(F)c(-c2nc(-c3cccc4ccoc43)no2)c1 ZINC001216924838 1051911117 /nfs/dbraw/zinc/91/11/17/1051911117.db2.gz VJFZLBIDSRBTIY-UHFFFAOYSA-N -1 1 314.247 4.134 20 0 DIADMM Cc1cc(O)cc([O-])c1-c1nc(-c2ccc(C(C)(C)C)cc2)no1 ZINC001216986033 1051926703 /nfs/dbraw/zinc/92/67/03/1051926703.db2.gz HEVJINMLRQEGRU-UHFFFAOYSA-N -1 1 324.380 4.421 20 0 DIADMM CC(=O)Nc1ccc(Nc2cc(Cl)c([O-])cc2Cl)cc1 ZINC001173976147 1051938063 /nfs/dbraw/zinc/93/80/63/1051938063.db2.gz BAQQHRMIUAUHAB-UHFFFAOYSA-N -1 1 311.168 4.401 20 0 DIADMM CC(=O)Nc1ccc(Nc2cc(Cl)cc(Cl)c2[O-])cc1 ZINC001173978868 1051939263 /nfs/dbraw/zinc/93/92/63/1051939263.db2.gz YDYOSBWYHJFLFZ-UHFFFAOYSA-N -1 1 311.168 4.401 20 0 DIADMM CCOc1ccccc1NC(=O)Nc1ccc([O-])c(Cl)c1 ZINC000190919828 1051955323 /nfs/dbraw/zinc/95/53/23/1051955323.db2.gz WXVNVNGRTCTVMA-UHFFFAOYSA-N -1 1 306.749 4.088 20 0 DIADMM CCS(=O)(=O)c1ccc([O-])c(Nc2ccccc2C(C)C)c1 ZINC001174046642 1051966137 /nfs/dbraw/zinc/96/61/37/1051966137.db2.gz BEBOUXLRRHSSDS-UHFFFAOYSA-N -1 1 319.426 4.053 20 0 DIADMM CC(C)Oc1ccc(Nc2cc3ccc([O-])cc3oc2=O)cc1 ZINC001174109046 1051983311 /nfs/dbraw/zinc/98/33/11/1051983311.db2.gz GKKZHGLMFNSDSL-UHFFFAOYSA-N -1 1 311.337 4.029 20 0 DIADMM [O-]c1c(-c2nc(-c3ccc(F)cc3)no2)cc(O)c2ccccc12 ZINC001217158880 1051983937 /nfs/dbraw/zinc/98/39/37/1051983937.db2.gz DGPNJUUOIKFVLY-UHFFFAOYSA-N -1 1 322.295 4.107 20 0 DIADMM Cc1cccc(-c2noc(-c3cc(O)c4ccccc4c3[O-])n2)c1 ZINC001217160183 1051984652 /nfs/dbraw/zinc/98/46/52/1051984652.db2.gz SELUKMZLTJBXEM-UHFFFAOYSA-N -1 1 318.332 4.276 20 0 DIADMM O=C(Nc1ccsc1Cl)Nc1ccc([O-])c(Cl)c1 ZINC000192314781 1052009121 /nfs/dbraw/zinc/00/91/21/1052009121.db2.gz BDQVHIGTBALDMS-UHFFFAOYSA-N -1 1 303.170 4.405 20 0 DIADMM Cc1ccccc1-c1noc(-c2c(O)cc3ccccc3c2[O-])n1 ZINC001217454165 1052060080 /nfs/dbraw/zinc/06/00/80/1052060080.db2.gz XFBYEPHWZXIYAM-UHFFFAOYSA-N -1 1 318.332 4.276 20 0 DIADMM CC(C)(C)[C@@H](C(=O)[O-])c1ccc(Nc2ccc3nccn3c2)cc1 ZINC001174280511 1052067447 /nfs/dbraw/zinc/06/74/47/1052067447.db2.gz ZDALNWHDJQTJID-QGZVFWFLSA-N -1 1 323.396 4.292 20 0 DIADMM COc1cccc(-c2noc(-c3ccc4sccc4c3[O-])n2)c1 ZINC001217514098 1052079109 /nfs/dbraw/zinc/07/91/09/1052079109.db2.gz IOIJRDDITBFHNR-UHFFFAOYSA-N -1 1 324.361 4.333 20 0 DIADMM Cc1cc(-c2noc(-c3ccc4sccc4c3[O-])n2)cc(C)n1 ZINC001217514166 1052079517 /nfs/dbraw/zinc/07/95/17/1052079517.db2.gz KGQKKSKVWNZPBX-UHFFFAOYSA-N -1 1 323.377 4.336 20 0 DIADMM O=C(c1c([O-])cccc1Cl)N1CCC[C@H]1c1ccc(F)cc1 ZINC000769642198 1052086956 /nfs/dbraw/zinc/08/69/56/1052086956.db2.gz LLBCOFIEMKQEMY-AWEZNQCLSA-N -1 1 319.763 4.162 20 0 DIADMM C[C@H](c1ccccc1F)N(C)C(=O)c1c([O-])cccc1Cl ZINC000769671599 1052091487 /nfs/dbraw/zinc/09/14/87/1052091487.db2.gz KSAHTAMPVWFDOZ-SNVBAGLBSA-N -1 1 307.752 4.018 20 0 DIADMM C[C@@H]1CCN(C(=O)c2c([O-])cccc2Cl)[C@@H]2CCCC[C@@H]12 ZINC000769690949 1052094032 /nfs/dbraw/zinc/09/40/32/1052094032.db2.gz ZXHZQBKQHWTJNY-MBNYWOFBSA-N -1 1 307.821 4.086 20 0 DIADMM CCc1c(Cl)cc(Nc2cn(C)nc2C)c([O-])c1Cl ZINC001174336646 1052104547 /nfs/dbraw/zinc/10/45/47/1052104547.db2.gz SZDWCVMQNRQWTM-UHFFFAOYSA-N -1 1 300.189 4.047 20 0 DIADMM CC(C)n1cnc2cc(Nc3cc([O-])c(F)c(F)c3)ccc21 ZINC001174383729 1052142440 /nfs/dbraw/zinc/14/24/40/1052142440.db2.gz RXWYCRNQFHXHCC-UHFFFAOYSA-N -1 1 303.312 4.345 20 0 DIADMM Nc1cccc(Cl)c1NC(=O)c1c([O-])ccc2ccccc21 ZINC001218908979 1052263121 /nfs/dbraw/zinc/26/31/21/1052263121.db2.gz JUBBVLXSVGARSB-UHFFFAOYSA-N -1 1 312.756 4.033 20 0 DIADMM Cc1nc2ccc(C(=O)Nc3ccc([O-])c(Cl)c3)cc2s1 ZINC000762141420 1052317389 /nfs/dbraw/zinc/31/73/89/1052317389.db2.gz YRFGIEXYSKFJLI-UHFFFAOYSA-N -1 1 318.785 4.216 20 0 DIADMM C[C@@H]1CCCN(Cc2sc3ccccc3c2Cl)[C@@H]1C(=O)[O-] ZINC000235396705 1052412504 /nfs/dbraw/zinc/41/25/04/1052412504.db2.gz GOUQRPRTUXRJAW-BMIGLBTASA-N -1 1 323.845 4.240 20 0 DIADMM COC(=O)c1ccc(C(C)C)c(-c2cc(F)c([O-])cc2F)c1 ZINC001222083281 1052439689 /nfs/dbraw/zinc/43/96/89/1052439689.db2.gz XUXXGFGQMXXBBG-UHFFFAOYSA-N -1 1 306.308 4.247 20 0 DIADMM CC1(C)CN(C(=O)c2cc3ccccc3cc2[O-])[C@@H]2CCC[C@@H]21 ZINC000393442026 1052483830 /nfs/dbraw/zinc/48/38/30/1052483830.db2.gz OHDUAXLXHXIYPC-DLBZAZTESA-N -1 1 309.409 4.196 20 0 DIADMM CC(C)c1ccc(C(=O)Nc2ccc(N3CCCC3)cc2)c([O-])c1 ZINC000916986224 1052675315 /nfs/dbraw/zinc/67/53/15/1052675315.db2.gz PEQYIOKHYWHOHI-UHFFFAOYSA-N -1 1 324.424 4.368 20 0 DIADMM [O-]c1c(F)cc(NC(=S)Nc2ccc(Cl)cc2)cc1F ZINC000168852159 1052757921 /nfs/dbraw/zinc/75/79/21/1052757921.db2.gz COBARXQDHPVRTO-UHFFFAOYSA-N -1 1 314.744 4.133 20 0 DIADMM CC(=O)c1c(O)cc([O-])cc1O[C@@H]1CC[C@H]2CCCC[C@@H]2C1 ZINC001225679978 1052815545 /nfs/dbraw/zinc/81/55/45/1052815545.db2.gz SZIZRKXZFJXEOV-UMVBOHGHSA-N -1 1 304.386 4.038 20 0 DIADMM CC(=O)c1c(O)cc([O-])cc1O[C@H](C)c1ccc(C)cc1C ZINC001225674152 1052816025 /nfs/dbraw/zinc/81/60/25/1052816025.db2.gz CPOPWSCNONMRKI-CYBMUJFWSA-N -1 1 300.354 4.057 20 0 DIADMM O=C(c1ccc([O-])cc1)c1ccc(O[C@H]2CCCC[C@@H]2F)cc1 ZINC001225807551 1052833591 /nfs/dbraw/zinc/83/35/91/1052833591.db2.gz IPWHGHUMBJXLCA-ROUUACIJSA-N -1 1 314.356 4.283 20 0 DIADMM C[C@@H](Oc1ccc(C(=O)c2ccc([O-])cc2)cc1)c1cccnc1 ZINC001225808669 1052833936 /nfs/dbraw/zinc/83/39/36/1052833936.db2.gz QBINUFNFAFGXIK-CQSZACIVSA-N -1 1 319.360 4.158 20 0 DIADMM Cc1ccc([C@@H](C)Oc2cc([O-])cc3oc(=O)cc(C)c23)cc1 ZINC001226487051 1052901933 /nfs/dbraw/zinc/90/19/33/1052901933.db2.gz UJAZUEWMHICHEG-CYBMUJFWSA-N -1 1 310.349 4.255 20 0 DIADMM CCC[C@@H](Oc1[n-]c(=O)nc(C)c1Cl)c1ccc(OC)cc1 ZINC001227112969 1052961925 /nfs/dbraw/zinc/96/19/25/1052961925.db2.gz RMQMWKBZOMPAKO-CYBMUJFWSA-N -1 1 322.792 4.073 20 0 DIADMM COCC(=O)c1ccc([O-])cc1O[C@H](C)c1ccccc1Cl ZINC001227169351 1052967369 /nfs/dbraw/zinc/96/73/69/1052967369.db2.gz SBVQYNYLPZGJQV-LLVKDONJSA-N -1 1 320.772 4.015 20 0 DIADMM C[C@H](Oc1[n-]c(=S)ncc1F)c1ccc2ccccc2c1 ZINC001227385076 1052987102 /nfs/dbraw/zinc/98/71/02/1052987102.db2.gz IUVALJPQCLZOSH-JTQLQIEISA-N -1 1 300.358 4.198 20 0 DIADMM C[C@H](Oc1[n-]c(=S)ncc1F)c1ccccc1C(F)(F)F ZINC001227383981 1052987253 /nfs/dbraw/zinc/98/72/53/1052987253.db2.gz VKMWSKFHOBQYBZ-ZETCQYMHSA-N -1 1 318.295 4.063 20 0 DIADMM C[C@@H](Oc1cc(Cl)c([O-])cc1Cl)c1ccncc1F ZINC001227644723 1053005877 /nfs/dbraw/zinc/00/58/77/1053005877.db2.gz CMHOGTUFTCRXDG-SSDOTTSWSA-N -1 1 302.132 4.373 20 0 DIADMM CC1(C)[C@H]2CC[C@]1(C)[C@H](Oc1[n-]c(=S)nc3cnccc31)C2 ZINC001227881703 1053025099 /nfs/dbraw/zinc/02/50/99/1053025099.db2.gz NUCHYARJTTVHLD-MNRXQERYSA-N -1 1 315.442 4.281 20 0 DIADMM C[C@@H](Oc1[n-]c(=S)nc2cnccc21)c1ccccc1Cl ZINC001227880502 1053025504 /nfs/dbraw/zinc/02/55/04/1053025504.db2.gz BHNJHUORDANAJA-SECBINFHSA-N -1 1 317.801 4.481 20 0 DIADMM C[C@H](Oc1[n-]c(=S)nc2cnccc21)c1ccc(F)c(F)c1 ZINC001227883592 1053025933 /nfs/dbraw/zinc/02/59/33/1053025933.db2.gz BFIXJOZUFKTJJT-QMMMGPOBSA-N -1 1 319.336 4.106 20 0 DIADMM C[C@@H](Oc1cc([O-])ccc1C(=O)c1ccccc1)c1cccnc1 ZINC001228182076 1053051198 /nfs/dbraw/zinc/05/11/98/1053051198.db2.gz AOYLSXCAAMTLQL-CQSZACIVSA-N -1 1 319.360 4.158 20 0 DIADMM O=C(c1ccccc1)c1ccc([O-])cc1O[C@@H]1CCCC[C@@H]1F ZINC001228185745 1053051523 /nfs/dbraw/zinc/05/15/23/1053051523.db2.gz LEZCSJRGNWBSAB-DLBZAZTESA-N -1 1 314.356 4.283 20 0 DIADMM O=C(Nc1ccccc1Cl)c1ccc(C(F)(F)F)cc1[O-] ZINC000168929470 1053125047 /nfs/dbraw/zinc/12/50/47/1053125047.db2.gz DLZPPZCIYOVKEU-UHFFFAOYSA-N -1 1 315.678 4.317 20 0 DIADMM CCC(=O)c1c(O)cc([O-])cc1O[C@@H](C)CCc1ccccc1 ZINC001228556854 1053133948 /nfs/dbraw/zinc/13/39/48/1053133948.db2.gz SABKUVAOFKBGGM-ZDUSSCGKSA-N -1 1 314.381 4.091 20 0 DIADMM CCC(=O)c1c(O)cc([O-])cc1O[C@H](CC)c1ccccc1F ZINC001228557560 1053134047 /nfs/dbraw/zinc/13/40/47/1053134047.db2.gz XQUBSYHVAZEPLM-MRXNPFEDSA-N -1 1 318.344 4.360 20 0 DIADMM Cc1ccc([C@@H](C)Oc2cc([O-])cc3oc(=O)ccc23)c(C)c1 ZINC001229135557 1053254916 /nfs/dbraw/zinc/25/49/16/1053254916.db2.gz NKZYYBZRYPEKRW-CYBMUJFWSA-N -1 1 310.349 4.255 20 0 DIADMM CC/C=C(\C)[C@H](CC)Oc1c([O-])c(OC)cc2ccc(=O)oc21 ZINC001229217004 1053275323 /nfs/dbraw/zinc/27/53/23/1053275323.db2.gz XVLWNCNNNMHZQN-HJTPGIPUSA-N -1 1 318.369 4.021 20 0 DIADMM CCCC[C@@H](CCC)Oc1c([O-])c(OC)cc2ccc(=O)oc21 ZINC001229215983 1053275626 /nfs/dbraw/zinc/27/56/26/1053275626.db2.gz NVYDAOCXUBNYMG-CYBMUJFWSA-N -1 1 320.385 4.245 20 0 DIADMM CC[C@@H](C)C[C@H](CC)Oc1c([O-])c(OC)cc2ccc(=O)oc21 ZINC001229217151 1053275704 /nfs/dbraw/zinc/27/57/04/1053275704.db2.gz YDHZSPJRBLJDSB-YPMHNXCESA-N -1 1 320.385 4.101 20 0 DIADMM C[C@@H](Oc1cc([O-])cc2c1C(=O)C[C@@H](c1ccccc1)O2)C1CC1 ZINC001229229479 1053279588 /nfs/dbraw/zinc/27/95/88/1053279588.db2.gz LENKNAMZJHERDN-PXAZEXFGSA-N -1 1 324.376 4.276 20 0 DIADMM C[C@H](Oc1cc([O-])ccc1C(=O)Cc1ccccc1)C(F)(F)F ZINC001229258454 1053286168 /nfs/dbraw/zinc/28/61/68/1053286168.db2.gz FNJIEYUXHRTEQK-NSHDSACASA-N -1 1 324.298 4.147 20 0 DIADMM O=C(Nc1cccc(-c2cccs2)c1)c1ccc(O)cc1[O-] ZINC001320202948 1053313936 /nfs/dbraw/zinc/31/39/36/1053313936.db2.gz OHLJCAFTJJSEIQ-UHFFFAOYSA-N -1 1 311.362 4.079 20 0 DIADMM C[C@@H]1c2cnccc2C[C@@H]1Oc1cc([O-])c(Cl)cc1Cl ZINC001229405909 1053313975 /nfs/dbraw/zinc/31/39/75/1053313975.db2.gz DHWSMHAMSPWJON-CLAHSXSESA-N -1 1 310.180 4.201 20 0 DIADMM C[C@H](Oc1cc([O-])c(Cl)cc1Cl)c1ccncc1F ZINC001229405960 1053316311 /nfs/dbraw/zinc/31/63/11/1053316311.db2.gz GADOGGCQFUHYJB-ZETCQYMHSA-N -1 1 302.132 4.373 20 0 DIADMM CCC(=O)c1ccc([O-])cc1O[C@H]1CCC(=O)c2ccccc21 ZINC001229474971 1053332111 /nfs/dbraw/zinc/33/21/11/1053332111.db2.gz NVMNDAQOFFQSHU-SFHVURJKSA-N -1 1 310.349 4.082 20 0 DIADMM CCC(=O)c1ccc([O-])cc1O[C@H](C)c1cccc(N(C)C)c1 ZINC001229477476 1053333910 /nfs/dbraw/zinc/33/39/10/1053333910.db2.gz NOIIDCMVGDUYFV-CYBMUJFWSA-N -1 1 313.397 4.191 20 0 DIADMM CC[C@@H](C)CNC(=S)Nc1cc(Cl)c(Cl)cc1[O-] ZINC001200253881 1053500508 /nfs/dbraw/zinc/50/05/08/1053500508.db2.gz KYFRGMDXNHDSHC-SSDOTTSWSA-N -1 1 307.246 4.032 20 0 DIADMM Cc1ccc(C2(NC(=O)c3cc(Cl)ccc3[O-])CCC2)cc1 ZINC001300280611 1053556096 /nfs/dbraw/zinc/55/60/96/1053556096.db2.gz XBDACQQADGNJOX-UHFFFAOYSA-N -1 1 315.800 4.163 20 0 DIADMM [O-]c1cc(O)ccc1-c1nc(-c2ccc(F)c3ccccc23)no1 ZINC000326395680 1053619100 /nfs/dbraw/zinc/61/91/00/1053619100.db2.gz PGAYJEMJMFNKNO-UHFFFAOYSA-N -1 1 322.295 4.107 20 0 DIADMM Cc1ccc([C@@H](C)Oc2nc3c(cc(Cl)nc3Cl)[n-]2)cn1 ZINC001231048097 1053661086 /nfs/dbraw/zinc/66/10/86/1053661086.db2.gz GENWTRVJGWVOPL-MRVPVSSYSA-N -1 1 323.183 4.108 20 0 DIADMM Cc1ccc([C@@H](C)Oc2nc3cc(Cl)nc(Cl)c3[n-]2)cn1 ZINC001231048097 1053661093 /nfs/dbraw/zinc/66/10/93/1053661093.db2.gz GENWTRVJGWVOPL-MRVPVSSYSA-N -1 1 323.183 4.108 20 0 DIADMM C[C@@H](Oc1cccnc1-c1ncccc1[O-])c1cccc(F)c1 ZINC001231199971 1053698663 /nfs/dbraw/zinc/69/86/63/1053698663.db2.gz IBVYDTZIQKNTHN-GFCCVEGCSA-N -1 1 310.328 4.128 20 0 DIADMM CCC(CC)[C@@H](CC)Oc1cccnc1-c1ncccc1[O-] ZINC001231200478 1053699737 /nfs/dbraw/zinc/69/97/37/1053699737.db2.gz OLCWEGDTCCOOER-OAHLLOKOSA-N -1 1 300.402 4.443 20 0 DIADMM Cc1cccc2c1CC[C@@H]2Oc1cccnc1-c1ncccc1[O-] ZINC001231201290 1053701224 /nfs/dbraw/zinc/70/12/24/1053701224.db2.gz JRCKOIHEWLLUPR-KRWDZBQOSA-N -1 1 318.376 4.224 20 0 DIADMM Cc1ccc2c(c1)CC[C@H]2Oc1cccnc1-c1ncccc1[O-] ZINC001231201729 1053701469 /nfs/dbraw/zinc/70/14/69/1053701469.db2.gz NBDPNMLNTKXKIW-QGZVFWFLSA-N -1 1 318.376 4.224 20 0 DIADMM CC[C@H](C)Oc1cc(Br)c([O-])cc1Br ZINC001231243955 1053708689 /nfs/dbraw/zinc/70/86/89/1053708689.db2.gz VDRNZXJFEQUBOP-LURJTMIESA-N -1 1 324.012 4.095 20 0 DIADMM Cc1cc(C(=O)[N-]c2cccc(Cl)c2SC(C)C)on1 ZINC000157514646 1053857226 /nfs/dbraw/zinc/85/72/26/1053857226.db2.gz JAMYFJJKBGIQCE-UHFFFAOYSA-N -1 1 310.806 4.389 20 0 DIADMM CC(C)c1ccc(C(C)(C)NC(=O)c2ccc(F)c([O-])c2)cc1 ZINC001300752792 1054002350 /nfs/dbraw/zinc/00/23/50/1054002350.db2.gz PCOJQIINKAUGRL-UHFFFAOYSA-N -1 1 315.388 4.320 20 0 DIADMM Cc1nocc1[N-]C(=O)c1cnc(-c2cccc(Cl)c2)s1 ZINC001437255431 1054023110 /nfs/dbraw/zinc/02/31/10/1054023110.db2.gz ZUCGZYULTXUPHI-UHFFFAOYSA-N -1 1 319.773 4.012 20 0 DIADMM [O-]c1c(-c2nc([C@H]3Cc4ccccc43)no2)ccc2ccccc21 ZINC000325678773 1054080583 /nfs/dbraw/zinc/08/05/83/1054080583.db2.gz NDLJPMABUCGEDB-KRWDZBQOSA-N -1 1 314.344 4.283 20 0 DIADMM Cc1cc(F)ccc1NC(=O)c1ccc(C(F)(F)F)cc1[O-] ZINC000622276717 1054142892 /nfs/dbraw/zinc/14/28/92/1054142892.db2.gz FDLCECSULLPSAQ-UHFFFAOYSA-N -1 1 313.250 4.111 20 0 DIADMM COc1ccccc1[C@@H]1CCCN1Cc1ccc(F)c([O-])c1F ZINC001232935570 1054149505 /nfs/dbraw/zinc/14/95/05/1054149505.db2.gz UCZLVKOFNBWLSQ-HNNXBMFYSA-N -1 1 319.351 4.016 20 0 DIADMM [O-]c1c(F)ccc(CN2CCC[C@@H]2c2ccccc2F)c1F ZINC001232934585 1054150981 /nfs/dbraw/zinc/15/09/81/1054150981.db2.gz ILSMJVJUAWXHEC-OAHLLOKOSA-N -1 1 307.315 4.147 20 0 DIADMM [O-]c1c(F)ccc(CN2CCC[C@H]2c2ccccc2F)c1F ZINC001232934584 1054151132 /nfs/dbraw/zinc/15/11/32/1054151132.db2.gz ILSMJVJUAWXHEC-HNNXBMFYSA-N -1 1 307.315 4.147 20 0 DIADMM COc1ccccc1[C@H]1CCCN1Cc1cc([O-])c(F)c(F)c1 ZINC001232972196 1054162684 /nfs/dbraw/zinc/16/26/84/1054162684.db2.gz VTPZBINJWSQPFO-OAHLLOKOSA-N -1 1 319.351 4.016 20 0 DIADMM [O-]c1cc(CN2CCC[C@@H]2c2cccc(F)c2)cc(F)c1F ZINC001232970192 1054163226 /nfs/dbraw/zinc/16/32/26/1054163226.db2.gz BBJKKCPDAQETJY-OAHLLOKOSA-N -1 1 307.315 4.147 20 0 DIADMM [O-]c1cnc(Cl)cc1C[N@H+]1CC[C@H](c2ccc(Cl)cc2)C1 ZINC001233037663 1054173568 /nfs/dbraw/zinc/17/35/68/1054173568.db2.gz DHIHPJKUCHEEFT-LBPRGKRZSA-N -1 1 323.223 4.084 20 0 DIADMM Cc1cccc([C@H]2CCC[N@H+]2Cc2cc(Cl)ncc2O)c1 ZINC001233032410 1054175371 /nfs/dbraw/zinc/17/53/71/1054175371.db2.gz JUTJMPMUSGMDBY-OAHLLOKOSA-N -1 1 302.805 4.086 20 0 DIADMM Oc1cnc(Cl)cc1C[N@H+]1CCCC[C@@H]1c1ccccc1 ZINC001233032778 1054175553 /nfs/dbraw/zinc/17/55/53/1054175553.db2.gz SRNFPONPPSMGQJ-OAHLLOKOSA-N -1 1 302.805 4.168 20 0 DIADMM CC[C@H](NC(=O)c1cc(F)ccc1[O-])c1ccc(Cl)s1 ZINC000622372475 1054189393 /nfs/dbraw/zinc/18/93/93/1054189393.db2.gz NNRUNZXRFVLPCU-JTQLQIEISA-N -1 1 313.781 4.127 20 0 DIADMM CCOc1ccc(-c2nc3cccc(F)c3c(=O)[n-]2)cc1Cl ZINC000671192491 1054192759 /nfs/dbraw/zinc/19/27/59/1054192759.db2.gz RZRKFGYGNBTIOS-UHFFFAOYSA-N -1 1 318.735 4.194 20 0 DIADMM O=C([N-][C@H](c1ccccc1F)C1CCCC1)C(F)(F)C(F)F ZINC001355648501 1054193754 /nfs/dbraw/zinc/19/37/54/1054193754.db2.gz DEJLKPFGLYMGFB-LBPRGKRZSA-N -1 1 321.289 4.074 20 0 DIADMM Cc1ccccc1[C@H]1CCC[N@H+]1Cc1c(F)ccc(O)c1F ZINC001233394046 1054261415 /nfs/dbraw/zinc/26/14/15/1054261415.db2.gz XHVCLQXVZFLIOH-MRXNPFEDSA-N -1 1 303.352 4.316 20 0 DIADMM CCCC(=O)c1ccc([O-])cc1O[C@H](CCC)C(=O)CCC ZINC001233649617 1054319242 /nfs/dbraw/zinc/31/92/42/1054319242.db2.gz APMNZLFFQABWAG-QGZVFWFLSA-N -1 1 306.402 4.292 20 0 DIADMM CCCC(=O)c1ccc([O-])cc1O[C@@H](CCC)C(=O)CCC ZINC001233649616 1054319993 /nfs/dbraw/zinc/31/99/93/1054319993.db2.gz APMNZLFFQABWAG-KRWDZBQOSA-N -1 1 306.402 4.292 20 0 DIADMM CCCC(=O)c1ccc([O-])cc1O[C@@H](C)c1cc(C)cnc1F ZINC001233650464 1054321535 /nfs/dbraw/zinc/32/15/35/1054321535.db2.gz KJLCEWAZLUENFT-LBPRGKRZSA-N -1 1 317.360 4.358 20 0 DIADMM CCCC(=O)c1ccc([O-])cc1O[C@@H]1COCc2ccccc21 ZINC001233651356 1054322209 /nfs/dbraw/zinc/32/22/09/1054322209.db2.gz YQCFPVOUYHKTBC-LJQANCHMSA-N -1 1 312.365 4.025 20 0 DIADMM CCCC(=O)c1ccc([O-])cc1O[C@H]1CCC(=O)c2ccccc21 ZINC001233650671 1054322900 /nfs/dbraw/zinc/32/29/00/1054322900.db2.gz PHJJXYVIPUVCQQ-IBGZPJMESA-N -1 1 324.376 4.472 20 0 DIADMM CCc1cccc(NC(=O)c2ccc(C(F)(F)F)c([O-])c2)c1 ZINC001440401046 1054349938 /nfs/dbraw/zinc/34/99/38/1054349938.db2.gz WVFPCZGUHQOKQD-UHFFFAOYSA-N -1 1 309.287 4.226 20 0 DIADMM O=C(N[C@H](c1cccs1)C1CC1)c1cc2ccccc2cc1[O-] ZINC001440882401 1054373248 /nfs/dbraw/zinc/37/32/48/1054373248.db2.gz ICTBYUAQRAGRIY-SFHVURJKSA-N -1 1 323.417 4.488 20 0 DIADMM Cc1ccc([C@H](C)N(C)C(=O)c2cc(Cl)ccc2[O-])cc1 ZINC001441177519 1054385388 /nfs/dbraw/zinc/38/53/88/1054385388.db2.gz NBLDSXSFIUJGQX-LBPRGKRZSA-N -1 1 303.789 4.187 20 0 DIADMM CCN(C(=O)c1cc(Cl)ccc1[O-])[C@H](C)c1ccc(F)cc1 ZINC001441816135 1054398506 /nfs/dbraw/zinc/39/85/06/1054398506.db2.gz VISPPGZROFSDRL-LLVKDONJSA-N -1 1 321.779 4.408 20 0 DIADMM O=C(Nc1ccc([O-])c(Cl)c1)Nc1cc(F)ccc1Cl ZINC000192212826 1054406529 /nfs/dbraw/zinc/40/65/29/1054406529.db2.gz CFVZSRPQBFAYAI-UHFFFAOYSA-N -1 1 315.131 4.482 20 0 DIADMM C[C@@H](Cc1ccccc1F)NC(=O)c1cc2ccccc2cc1[O-] ZINC001442095249 1054409949 /nfs/dbraw/zinc/40/99/49/1054409949.db2.gz PHSVTUZZNSAWDG-ZDUSSCGKSA-N -1 1 323.367 4.046 20 0 DIADMM Cc1ccc([C@@H]2C[C@H]2C(=O)Nc2ccc([O-])c(Cl)c2)cc1C ZINC001545951194 1054430555 /nfs/dbraw/zinc/43/05/55/1054430555.db2.gz IVDGEINHQRAVNR-LSDHHAIUSA-N -1 1 315.800 4.405 20 0 DIADMM Cc1ccc(-c2ccncc2)cc1NC(=O)c1cccc([O-])c1F ZINC001442761943 1054431129 /nfs/dbraw/zinc/43/11/29/1054431129.db2.gz JBRUMYUPSSTUFO-UHFFFAOYSA-N -1 1 322.339 4.154 20 0 DIADMM CC(C)(C)CN(Cc1ccccc1)C(=O)c1ccc([O-])cc1F ZINC001443700744 1054455826 /nfs/dbraw/zinc/45/58/26/1054455826.db2.gz DPDUZEFIALSJBJ-UHFFFAOYSA-N -1 1 315.388 4.220 20 0 DIADMM Cc1ccc([C@H]2CCCCN2C(=O)c2cccc([O-])c2F)cc1 ZINC001444335441 1054473507 /nfs/dbraw/zinc/47/35/07/1054473507.db2.gz HGKCNEGYLDWWLV-MRXNPFEDSA-N -1 1 313.372 4.207 20 0 DIADMM CSc1cc(C)ccc1CNC(=O)c1c([O-])cccc1Cl ZINC001446043911 1054523653 /nfs/dbraw/zinc/52/36/53/1054523653.db2.gz QZQCRVPGUNQYLN-UHFFFAOYSA-N -1 1 321.829 4.006 20 0 DIADMM COc1cccc2c(C(=O)Nc3ccc([O-])c(Cl)c3)coc21 ZINC001446466546 1054535884 /nfs/dbraw/zinc/53/58/84/1054535884.db2.gz HCMDKXRULPNDNN-UHFFFAOYSA-N -1 1 317.728 4.053 20 0 DIADMM C[C@@H]1CCc2ccccc2[C@@H]1NC(=O)c1cc(Cl)ccc1[O-] ZINC001446841688 1054546271 /nfs/dbraw/zinc/54/62/71/1054546271.db2.gz BRIXHVQRTJPIJK-PIGZYNQJSA-N -1 1 315.800 4.099 20 0 DIADMM CSCc1ccccc1NC(=O)Cc1ccc([O-])c(Cl)c1 ZINC001447513926 1054567202 /nfs/dbraw/zinc/56/72/02/1054567202.db2.gz RHLNNUFVZLOFDQ-UHFFFAOYSA-N -1 1 321.829 4.090 20 0 DIADMM CCC1(CC)CCCN(C(=O)c2cc(Cl)ccc2[O-])CC1 ZINC001447747136 1054572746 /nfs/dbraw/zinc/57/27/46/1054572746.db2.gz MOLVAABHHQWVGP-UHFFFAOYSA-N -1 1 309.837 4.478 20 0 DIADMM C[C@H]1C[C@H](c2ccccc2)N(C(=O)c2cc(Cl)ccc2[O-])C1 ZINC001449201336 1054614659 /nfs/dbraw/zinc/61/46/59/1054614659.db2.gz HMALQLCIXVTTAQ-BLLLJJGKSA-N -1 1 315.800 4.269 20 0 DIADMM Cc1ccc2c(c1)[C@@H](NC(=O)c1ccc(Cl)cc1[O-])CCC2 ZINC001450694680 1054659191 /nfs/dbraw/zinc/65/91/91/1054659191.db2.gz RNTHRMMHIHTGER-INIZCTEOSA-N -1 1 315.800 4.161 20 0 DIADMM C[C@@H](CCc1ccc(F)cc1)C(=O)Nc1cc([O-])c(F)cc1F ZINC001450899654 1054663509 /nfs/dbraw/zinc/66/35/09/1054663509.db2.gz RWLSRXZPRQMFEP-JTQLQIEISA-N -1 1 323.314 4.017 20 0 DIADMM CC(C)(C)[C@H]1CCC[C@H]1NC(=O)c1cc2ccccc2cc1[O-] ZINC001451294559 1054673883 /nfs/dbraw/zinc/67/38/83/1054673883.db2.gz JQHNTZCHZYXZDS-DLBZAZTESA-N -1 1 311.425 4.490 20 0 DIADMM Cc1c(F)c(F)ccc1NC(=O)c1ccc2ccccc2c1[O-] ZINC001451310949 1054675728 /nfs/dbraw/zinc/67/57/28/1054675728.db2.gz ONJHOPWWOALTRI-UHFFFAOYSA-N -1 1 313.303 4.384 20 0 DIADMM CC[C@H](NC(=O)c1ccc2ccc(O)cc2c1[O-])c1ccccc1 ZINC001451581536 1054682948 /nfs/dbraw/zinc/68/29/48/1054682948.db2.gz VUSXJTNASCZTPF-SFHVURJKSA-N -1 1 321.376 4.132 20 0 DIADMM C[C@@H](C(=O)Nc1cc(F)cc(F)c1[O-])c1cc2ccccc2o1 ZINC001451757265 1054687854 /nfs/dbraw/zinc/68/78/54/1054687854.db2.gz QGLNYAROBPUJNX-SECBINFHSA-N -1 1 317.291 4.159 20 0 DIADMM O=C(N[C@@H](C1CCC1)C1CCCCC1)c1cccc([O-])c1F ZINC001452182570 1054696834 /nfs/dbraw/zinc/69/68/34/1054696834.db2.gz GGRIEEFOBZCZEM-QGZVFWFLSA-N -1 1 305.393 4.010 20 0 DIADMM O=C(Nc1c([O-])cccc1F)c1sc2ncccc2c1Cl ZINC001453014363 1054725589 /nfs/dbraw/zinc/72/55/89/1054725589.db2.gz JWGMCBTYXNXIKD-UHFFFAOYSA-N -1 1 322.748 4.047 20 0 DIADMM COc1cc(C)c(C)cc1NC(=O)c1ccc2ccccc2c1[O-] ZINC001453302444 1054730816 /nfs/dbraw/zinc/73/08/16/1054730816.db2.gz DXQIOONUAMSPBQ-UHFFFAOYSA-N -1 1 321.376 4.423 20 0 DIADMM CC1(C)CCC(C)(C)N(C(=O)Cc2ccc([O-])c(Cl)c2)C1 ZINC001453690406 1054743951 /nfs/dbraw/zinc/74/39/51/1054743951.db2.gz UOFGYULSMYHORR-UHFFFAOYSA-N -1 1 309.837 4.015 20 0 DIADMM O=C([N-]c1c(F)cc(Cl)cc1F)c1ccc(F)c(F)c1F ZINC000180329079 1054748074 /nfs/dbraw/zinc/74/80/74/1054748074.db2.gz YRJMWWCLPUWBBH-UHFFFAOYSA-N -1 1 321.632 4.288 20 0 DIADMM CC(C)[C@H]1C[C@@H]1C(=O)Nc1cc(Cl)c([O-])c2ccccc12 ZINC001453774216 1054748334 /nfs/dbraw/zinc/74/83/34/1054748334.db2.gz ZEYRTCPYXKKZRG-OLZOCXBDSA-N -1 1 303.789 4.429 20 0 DIADMM O=C(c1ccc(Cl)cc1[O-])N1CCC[C@H](C2CCCCC2)C1 ZINC001454037090 1054755240 /nfs/dbraw/zinc/75/52/40/1054755240.db2.gz KLVYTEWELMWQGW-AWEZNQCLSA-N -1 1 321.848 4.478 20 0 DIADMM O=C(N[C@@H]1CCc2ccc(Cl)cc21)c1c([O-])cccc1Cl ZINC001454347066 1054763777 /nfs/dbraw/zinc/76/37/77/1054763777.db2.gz NHAPPROBAJVUJN-CYBMUJFWSA-N -1 1 322.191 4.116 20 0 DIADMM O=C(N[C@@H]1CCc2ccc(Cl)cc21)c1ccc(Cl)cc1[O-] ZINC001454343008 1054764571 /nfs/dbraw/zinc/76/45/71/1054764571.db2.gz ASULTZGFJDXRTB-CQSZACIVSA-N -1 1 322.191 4.116 20 0 DIADMM CCC(CC)c1nnc([N-]C(=O)c2ccc(C(F)F)o2)s1 ZINC000624515279 1054796967 /nfs/dbraw/zinc/79/69/67/1054796967.db2.gz MDDICDGATURYFL-UHFFFAOYSA-N -1 1 315.345 4.225 20 0 DIADMM CCOC(=O)c1nc2cc(-c3ccc(Cl)cc3)ccc2[n-]1 ZINC001236095963 1054940010 /nfs/dbraw/zinc/94/00/10/1054940010.db2.gz SXQVJLOEAXWBAG-UHFFFAOYSA-N -1 1 300.745 4.060 20 0 DIADMM CCOC(=O)c1nc2ccc(-c3ccc(Cl)cc3)cc2[n-]1 ZINC001236095963 1054940022 /nfs/dbraw/zinc/94/00/22/1054940022.db2.gz SXQVJLOEAXWBAG-UHFFFAOYSA-N -1 1 300.745 4.060 20 0 DIADMM Cc1c2[nH]cnc2ccc1-c1ccc(C(=O)[O-])c(C)c1Cl ZINC001236119233 1054958463 /nfs/dbraw/zinc/95/84/63/1054958463.db2.gz DRPKCSJNQGZPFS-UHFFFAOYSA-N -1 1 300.745 4.198 20 0 DIADMM Cc1nc2cccc(-c3ccc(Cl)c(C(=O)[O-])c3F)c2[nH]1 ZINC001236164516 1054974729 /nfs/dbraw/zinc/97/47/29/1054974729.db2.gz JWKUZVTUICORPL-UHFFFAOYSA-N -1 1 304.708 4.029 20 0 DIADMM Cc1ccc(F)c(-c2cc(-c3nc(C(C)C)no3)ccn2)c1[O-] ZINC001236389289 1055090330 /nfs/dbraw/zinc/09/03/30/1055090330.db2.gz AREKTXLEOPGUTN-UHFFFAOYSA-N -1 1 313.332 4.075 20 0 DIADMM Cc1ccc(F)c(-c2cc(C(F)(F)F)c3c(n2)CCC3)c1[O-] ZINC001236402796 1055096322 /nfs/dbraw/zinc/09/63/22/1055096322.db2.gz NPNNABMGDVTJPT-UHFFFAOYSA-N -1 1 311.278 4.409 20 0 DIADMM C[C@H](NC(=O)c1cc2ccccc2cc1[O-])[C@@H](C)c1ccccc1 ZINC001587332437 1055270010 /nfs/dbraw/zinc/27/00/10/1055270010.db2.gz ORKVHLTUDXFINU-CABCVRRESA-N -1 1 319.404 4.467 20 0 DIADMM CCc1oc2ccccc2c1CC(=O)Nc1cccc(F)c1[O-] ZINC001587389569 1055284720 /nfs/dbraw/zinc/28/47/20/1055284720.db2.gz NTYSUUQTXKNHID-UHFFFAOYSA-N -1 1 313.328 4.021 20 0 DIADMM O=C(N[C@@H]1CC[C@@H]2CCCC[C@H]2C1)c1c([O-])cccc1Cl ZINC001587542807 1055323986 /nfs/dbraw/zinc/32/39/86/1055323986.db2.gz GAGBLYGCEXXVPJ-RWMBFGLXSA-N -1 1 307.821 4.134 20 0 DIADMM O=C(Cc1ccc([O-])c(Cl)c1)Nc1ccc2sccc2c1 ZINC001587655137 1055341554 /nfs/dbraw/zinc/34/15/54/1055341554.db2.gz CBNDLBHGVKSDSL-UHFFFAOYSA-N -1 1 317.797 4.442 20 0 DIADMM CC(F)(F)c1c(F)cccc1NC(=O)c1ccc([O-])cc1F ZINC001587859869 1055381647 /nfs/dbraw/zinc/38/16/47/1055381647.db2.gz RJRQQFPSRYAXEN-UHFFFAOYSA-N -1 1 313.250 4.034 20 0 DIADMM Cc1cccc(CN(Cc2sc(=O)[nH]c2Cl)C2CC2)c1C ZINC001237153297 1055386154 /nfs/dbraw/zinc/38/61/54/1055386154.db2.gz CRXCMZBIZDOIRW-UHFFFAOYSA-N -1 1 322.861 4.284 20 0 DIADMM CCC1CCC(N(C)C(=O)Cc2ccc([O-])c(Cl)c2)CC1 ZINC001587999663 1055411148 /nfs/dbraw/zinc/41/11/48/1055411148.db2.gz OOFMMHAOQOJDNL-UHFFFAOYSA-N -1 1 309.837 4.015 20 0 DIADMM CCC[C@H]1CCCN(C(=O)c2ccc(C(F)(F)F)c([O-])c2)C1 ZINC001588198882 1055449101 /nfs/dbraw/zinc/44/91/01/1055449101.db2.gz HYMGDDSEAGDLCE-NSHDSACASA-N -1 1 315.335 4.063 20 0 DIADMM C/C(=C/C1CCC(C)CC1)C(=O)NCc1ccc([O-])c(Cl)c1 ZINC001594558544 1055566392 /nfs/dbraw/zinc/56/63/92/1055566392.db2.gz QLPOAPSAXCFEER-LCYFTJDESA-N -1 1 321.848 4.434 20 0 DIADMM C[C@H]1CCN(Cc2cc(F)c([O-])c(Cl)c2)CCC1(F)F ZINC001237984924 1055572255 /nfs/dbraw/zinc/57/22/55/1055572255.db2.gz SCSWLALCKOAUDD-VIFPVBQESA-N -1 1 307.743 4.052 20 0 DIADMM [O-]c1cc(F)c(CN2CCC3(CC[C@@H](F)C3)CC2)cc1Cl ZINC001238150058 1055611777 /nfs/dbraw/zinc/61/17/77/1055611777.db2.gz QCKHUCIHFLILMM-GFCCVEGCSA-N -1 1 315.791 4.289 20 0 DIADMM CC(C)c1ccc(CN(C)C(=O)c2cc(Cl)ccc2[O-])cc1 ZINC000030684999 1055630104 /nfs/dbraw/zinc/63/01/04/1055630104.db2.gz UOVVUUPLQTZQAO-UHFFFAOYSA-N -1 1 317.816 4.441 20 0 DIADMM O=C(Nc1cccc(SC(F)F)c1)c1cccc([O-])c1F ZINC001565557266 1055709966 /nfs/dbraw/zinc/70/99/66/1055709966.db2.gz QNXADBNQBBNBLW-UHFFFAOYSA-N -1 1 313.300 4.098 20 0 DIADMM CC(C)(C)c1ccc([C@H]2CCCN2C(=O)c2ccc([O-])cn2)cc1 ZINC001596474039 1055714143 /nfs/dbraw/zinc/71/41/43/1055714143.db2.gz JHPUEYYBHYMGCY-GOSISDBHSA-N -1 1 324.424 4.062 20 0 DIADMM O=C(N[C@H]1CCc2ccc(F)cc21)c1ccc2ccccc2c1[O-] ZINC001565681173 1055717077 /nfs/dbraw/zinc/71/70/77/1055717077.db2.gz MWLNHIQPNIURTF-SFHVURJKSA-N -1 1 321.351 4.102 20 0 DIADMM CC(C)c1ccc(C(=O)Nc2ccc3c(c2)CCCN3C)c([O-])c1 ZINC001565700430 1055719381 /nfs/dbraw/zinc/71/93/81/1055719381.db2.gz AOYCTZHWCYENOK-UHFFFAOYSA-N -1 1 324.424 4.150 20 0 DIADMM O=C(Nc1ccc2c(c1)Cc1ccccc1-2)c1ccc(F)c([O-])c1 ZINC001538883986 1055742247 /nfs/dbraw/zinc/74/22/47/1055742247.db2.gz VHILLYIYUJLXIZ-UHFFFAOYSA-N -1 1 319.335 4.355 20 0 DIADMM Cc1cccc(C)c1CCNC(=O)c1cc2ccccc2cc1[O-] ZINC001566293067 1055759906 /nfs/dbraw/zinc/75/99/06/1055759906.db2.gz RZEXNVZRKHJXPX-UHFFFAOYSA-N -1 1 319.404 4.135 20 0 DIADMM CCOc1ccc(NC(=O)c2ccc(C(C)C)cc2[O-])c(C)c1 ZINC001596946927 1055765338 /nfs/dbraw/zinc/76/53/38/1055765338.db2.gz BRCROMAUBMSFKQ-UHFFFAOYSA-N -1 1 313.397 4.475 20 0 DIADMM Cc1ccc(C)c([C@@H]2CCCN2C(=O)c2cccc([O-])c2F)c1 ZINC001566377805 1055767395 /nfs/dbraw/zinc/76/73/95/1055767395.db2.gz NRLIZULOROKBCH-INIZCTEOSA-N -1 1 313.372 4.125 20 0 DIADMM CC(C)c1ccc(C[C@@H](C)NC(=O)c2ccc(F)c([O-])c2)cc1 ZINC001566424530 1055772652 /nfs/dbraw/zinc/77/26/52/1055772652.db2.gz VJCUGVHGZMFWFM-CYBMUJFWSA-N -1 1 315.388 4.016 20 0 DIADMM CC(C)c1ccc(C[C@H](C)NC(=O)c2ccc(F)c([O-])c2)cc1 ZINC001566424531 1055773585 /nfs/dbraw/zinc/77/35/85/1055773585.db2.gz VJCUGVHGZMFWFM-ZDUSSCGKSA-N -1 1 315.388 4.016 20 0 DIADMM Cc1cc2ccccc2nc1C(=O)Nc1ccc([O-])c(Cl)c1 ZINC001566589017 1055776695 /nfs/dbraw/zinc/77/66/95/1055776695.db2.gz MYNGCKVUXQFARE-UHFFFAOYSA-N -1 1 312.756 4.155 20 0 DIADMM Cc1ccc(C)c([C@@H](C)NC(=O)c2c([O-])cccc2Cl)c1 ZINC001567096720 1055792658 /nfs/dbraw/zinc/79/26/58/1055792658.db2.gz GDIUCQHRJRAKPG-GFCCVEGCSA-N -1 1 303.789 4.153 20 0 DIADMM CC(C)Sc1ccccc1[N-]C(=O)c1cc(C2CC2)no1 ZINC000282205287 1055801871 /nfs/dbraw/zinc/80/18/71/1055801871.db2.gz CYETXICAWKHEID-UHFFFAOYSA-N -1 1 302.399 4.305 20 0 DIADMM O=C(NC(c1ccccc1)c1ccccc1)c1ccc(F)c([O-])c1 ZINC001539234516 1055806064 /nfs/dbraw/zinc/80/60/64/1055806064.db2.gz NJXDYGCSMIOKPT-UHFFFAOYSA-N -1 1 321.351 4.051 20 0 DIADMM CC(C)C(CNC(=O)c1ccc(C(F)(F)F)c([O-])c1)C(C)C ZINC001567772578 1055816988 /nfs/dbraw/zinc/81/69/88/1055816988.db2.gz BNVJXFXRYCFXSO-UHFFFAOYSA-N -1 1 317.351 4.069 20 0 DIADMM CC(C)c1ccc(C(=O)N(C)c2cccc3c2CCCN3)c([O-])c1 ZINC001568475349 1055838968 /nfs/dbraw/zinc/83/89/68/1055838968.db2.gz PVHOERSWSLZBHG-UHFFFAOYSA-N -1 1 324.424 4.150 20 0 DIADMM CCC(C)(C)c1ccc(NC(=O)c2cccc([O-])c2F)cc1 ZINC001568621461 1055840649 /nfs/dbraw/zinc/84/06/49/1055840649.db2.gz TYMFQOLTQLDMJV-UHFFFAOYSA-N -1 1 301.361 4.471 20 0 DIADMM CCCC1CCC(N(C)C(=O)Cc2ccc([O-])c(Cl)c2)CC1 ZINC001568590521 1055841103 /nfs/dbraw/zinc/84/11/03/1055841103.db2.gz NOXSERDZTBYXAN-UHFFFAOYSA-N -1 1 323.864 4.405 20 0 DIADMM C[C@H]1C[C@@H](c2ccccc2)N(C(=O)c2ccc(Cl)cc2[O-])C1 ZINC001568779847 1055845727 /nfs/dbraw/zinc/84/57/27/1055845727.db2.gz FLYDYVSQSNUTHV-LRDDRELGSA-N -1 1 315.800 4.269 20 0 DIADMM CC[C@H](C)n1nc(NC(=O)c2ccc(C(C)C)cc2[O-])cc1C ZINC001597627609 1055855555 /nfs/dbraw/zinc/85/55/55/1055855555.db2.gz RTUKDWLEPBALHZ-LBPRGKRZSA-N -1 1 315.417 4.244 20 0 DIADMM CCC[C@H](C)CC(=O)Nc1cc(C)cc(Br)c1[O-] ZINC001597673926 1055861546 /nfs/dbraw/zinc/86/15/46/1055861546.db2.gz FWNMBEGFHJXTLP-VIFPVBQESA-N -1 1 314.223 4.228 20 0 DIADMM CC1CCC(N(C(=O)c2cc(Cl)ccc2[O-])C2CC2)CC1 ZINC001597796465 1055876866 /nfs/dbraw/zinc/87/68/66/1055876866.db2.gz NURSEDURPFGFME-UHFFFAOYSA-N -1 1 307.821 4.229 20 0 DIADMM CC(C)[C@H]1N(C(=O)c2cc(Cl)ccc2[O-])CC12CCCCC2 ZINC001570191337 1055890321 /nfs/dbraw/zinc/89/03/21/1055890321.db2.gz JWMOJFVAVIXQBT-MRXNPFEDSA-N -1 1 321.848 4.477 20 0 DIADMM COC(=O)c1nc2cc(-c3cccc(C(F)(F)F)c3)ccc2[n-]1 ZINC001239516325 1055923729 /nfs/dbraw/zinc/92/37/29/1055923729.db2.gz ZSMZBLQFVRRJBF-UHFFFAOYSA-N -1 1 320.270 4.035 20 0 DIADMM COC(=O)c1nc2ccc(-c3cccc(C(F)(F)F)c3)cc2[n-]1 ZINC001239516325 1055923737 /nfs/dbraw/zinc/92/37/37/1055923737.db2.gz ZSMZBLQFVRRJBF-UHFFFAOYSA-N -1 1 320.270 4.035 20 0 DIADMM CC(C)(NC(=O)c1ccc(C(F)(F)F)cc1[O-])c1ccccc1 ZINC001598227958 1055929359 /nfs/dbraw/zinc/92/93/59/1055929359.db2.gz LYCMDMIYXQDDHH-UHFFFAOYSA-N -1 1 323.314 4.076 20 0 DIADMM Cc1cc(Cl)ccc1CNc1ccc(-n2ccc(=O)[n-]2)cc1 ZINC001621026459 1055990827 /nfs/dbraw/zinc/99/08/27/1055990827.db2.gz IJKYQEXCMROSBP-UHFFFAOYSA-N -1 1 313.788 4.152 20 0 DIADMM CSc1ccc([O-])c(C(=O)Nc2nccc3ccc(C)cc32)c1 ZINC001583069769 1056014855 /nfs/dbraw/zinc/01/48/55/1056014855.db2.gz OOOPVPLSZPLJLM-UHFFFAOYSA-N -1 1 324.405 4.223 20 0 DIADMM O=C(Nc1ccccc1Cl)c1ccc2ccc(O)cc2c1[O-] ZINC001540362605 1056021274 /nfs/dbraw/zinc/02/12/74/1056021274.db2.gz PGLHKNFMPGFRMD-UHFFFAOYSA-N -1 1 313.740 4.157 20 0 DIADMM CCCc1ccc(NC(=O)c2ccc3ccc(O)cc3c2[O-])cc1 ZINC001540368997 1056022211 /nfs/dbraw/zinc/02/22/11/1056022211.db2.gz BPECABUFIHMWLT-UHFFFAOYSA-N -1 1 321.376 4.456 20 0 DIADMM CCCCCCN(Cc1ccco1)C(=O)c1ccc([O-])c(F)c1 ZINC001603596710 1056028240 /nfs/dbraw/zinc/02/82/40/1056028240.db2.gz NAQFURGDRNPPGV-UHFFFAOYSA-N -1 1 319.376 4.347 20 0 DIADMM O=C(Nc1ccccc1-c1ccccc1)c1ccc(F)c([O-])c1 ZINC001540523741 1056039437 /nfs/dbraw/zinc/03/94/37/1056039437.db2.gz WIICUQBYFCBTIB-UHFFFAOYSA-N -1 1 307.324 4.451 20 0 DIADMM CC(C)C[C@H](NC(=O)c1cc(F)ccc1[O-])c1ccccc1 ZINC001540538353 1056041444 /nfs/dbraw/zinc/04/14/44/1056041444.db2.gz HRBRERVCGFLYDM-INIZCTEOSA-N -1 1 301.361 4.049 20 0 DIADMM O=C(c1cc(Cl)ccc1[O-])N1CCC[C@H]1c1ccc(F)cc1 ZINC001540547924 1056042836 /nfs/dbraw/zinc/04/28/36/1056042836.db2.gz GSWQWVXZUDYLOE-HNNXBMFYSA-N -1 1 319.763 4.162 20 0 DIADMM C[C@@H](Cc1cccc(F)c1)C(=O)Nc1ccc([O-])c(Cl)c1 ZINC000111666419 1056057523 /nfs/dbraw/zinc/05/75/23/1056057523.db2.gz VUFDWTNNSBUPES-JTQLQIEISA-N -1 1 307.752 4.002 20 0 DIADMM CCCCC1CCC(CNC(=O)c2cccc([O-])c2F)CC1 ZINC001583327833 1056065613 /nfs/dbraw/zinc/06/56/13/1056065613.db2.gz SPZHZXVSAZLKTA-UHFFFAOYSA-N -1 1 307.409 4.258 20 0 DIADMM C[C@@H](c1cc(Cl)ccc1Cl)N1CCC[C@H](CC(=O)[O-])C1 ZINC000086757328 1056070717 /nfs/dbraw/zinc/07/07/17/1056070717.db2.gz SYJBBXCMZPOPLK-WDEREUQCSA-N -1 1 316.228 4.241 20 0 DIADMM Cc1ccc2c(c1)[C@H](NC(=O)c1ccc3ccccc3c1[O-])CC2 ZINC001583457463 1056088494 /nfs/dbraw/zinc/08/84/94/1056088494.db2.gz SLGVDSLABILFST-LJQANCHMSA-N -1 1 317.388 4.271 20 0 DIADMM CSc1cccnc1[N-]C(=O)c1cc2cccc(Cl)c2o1 ZINC001583586116 1056111185 /nfs/dbraw/zinc/11/11/85/1056111185.db2.gz DODXROCYKVESFV-UHFFFAOYSA-N -1 1 318.785 4.455 20 0 DIADMM O=C(N[C@H]1CCc2cc(F)ccc21)c1ccc2ccccc2c1[O-] ZINC001542286920 1056115745 /nfs/dbraw/zinc/11/57/45/1056115745.db2.gz AYPBRHJKFPURKD-SFHVURJKSA-N -1 1 321.351 4.102 20 0 DIADMM CCC[C@H](Cc1ccccc1)NC(=O)c1ccc(Cl)cc1[O-] ZINC001611443696 1056160266 /nfs/dbraw/zinc/16/02/66/1056160266.db2.gz RVVAQUFLYSYOPK-OAHLLOKOSA-N -1 1 317.816 4.187 20 0 DIADMM O=C(c1c([O-])cccc1Cl)N1CCC(C2CCCCC2)CC1 ZINC001583779862 1056165430 /nfs/dbraw/zinc/16/54/30/1056165430.db2.gz DFCXLYUFJQZGDC-UHFFFAOYSA-N -1 1 321.848 4.478 20 0 DIADMM O=C(N[C@@H](c1ccccc1)C1CC1)c1ccc2ccccc2c1[O-] ZINC001543122619 1056179902 /nfs/dbraw/zinc/17/99/02/1056179902.db2.gz WYHPNHAULWMJHC-IBGZPJMESA-N -1 1 317.388 4.427 20 0 DIADMM O=C(c1ccc(F)c([O-])c1)N1CCC[C@@H]1c1ccc(Cl)cc1 ZINC001543283538 1056195754 /nfs/dbraw/zinc/19/57/54/1056195754.db2.gz DXFTZYTUQVEMOC-OAHLLOKOSA-N -1 1 319.763 4.162 20 0 DIADMM Cc1cccc([C@H](C)NC(=O)c2ncc3ccccc3c2[O-])c1C ZINC001543319375 1056202578 /nfs/dbraw/zinc/20/25/78/1056202578.db2.gz JWOUBEQZFMAOBZ-AWEZNQCLSA-N -1 1 320.392 4.048 20 0 DIADMM CCCCCN(C(=O)c1ccc(C(F)(F)F)cc1[O-])C(C)C ZINC001543376038 1056209636 /nfs/dbraw/zinc/20/96/36/1056209636.db2.gz UYMABAJAQQHDCS-UHFFFAOYSA-N -1 1 317.351 4.452 20 0 DIADMM CCN(Cc1ccc2ccccc2c1)C(=O)c1ccc([O-])cc1F ZINC001543460307 1056227691 /nfs/dbraw/zinc/22/76/91/1056227691.db2.gz CDSICCZZCLLOIQ-UHFFFAOYSA-N -1 1 323.367 4.347 20 0 DIADMM CCCN(CC1CCCCC1)C(=O)c1cc(Cl)ccc1[O-] ZINC001543567123 1056256256 /nfs/dbraw/zinc/25/62/56/1056256256.db2.gz DPDRLRRFHIUXCN-UHFFFAOYSA-N -1 1 309.837 4.478 20 0 DIADMM CC(C)CCCCCC(=O)Nc1ccc(-c2cc(=O)[nH][n-]2)cc1 ZINC001543591312 1056260431 /nfs/dbraw/zinc/26/04/31/1056260431.db2.gz JEEQWGFZBBEPJB-UHFFFAOYSA-N -1 1 315.417 4.327 20 0 DIADMM O=C(N[C@H]1CCc2c1cccc2Cl)c1ccc(Cl)cc1[O-] ZINC001543721233 1056283144 /nfs/dbraw/zinc/28/31/44/1056283144.db2.gz LIDFNEXTKBKUGC-AWEZNQCLSA-N -1 1 322.191 4.116 20 0 DIADMM Cc1ccccc1-c1nsc([N-]c2cnn(C3CCC3)c2)n1 ZINC001612979262 1056342677 /nfs/dbraw/zinc/34/26/77/1056342677.db2.gz TUIUAPBGIWPWPG-UHFFFAOYSA-N -1 1 311.414 4.179 20 0 DIADMM CC(C)C[C@@H]1CCCCCN1C(=O)c1cc(Cl)ccc1[O-] ZINC001544064384 1056352973 /nfs/dbraw/zinc/35/29/73/1056352973.db2.gz IJKJDXNLMSHIRF-AWEZNQCLSA-N -1 1 309.837 4.477 20 0 DIADMM CCCc1cc(=O)[n-]c(SCCCSC(C)(C)C)n1 ZINC001613234500 1056361941 /nfs/dbraw/zinc/36/19/41/1056361941.db2.gz MCOHQJVHLMYWIM-UHFFFAOYSA-N -1 1 300.493 4.149 20 0 DIADMM CCN(C(=O)Cc1ccc([O-])c(Cl)c1)[C@@H]1CCCC[C@H]1C ZINC001584664233 1056392388 /nfs/dbraw/zinc/39/23/88/1056392388.db2.gz CKXNMFADQMNJJN-IUODEOHRSA-N -1 1 309.837 4.015 20 0 DIADMM CC(C)CC[C@H]1CCC[C@@H]1NC(=O)c1cc(Cl)ccc1[O-] ZINC001584729947 1056405051 /nfs/dbraw/zinc/40/50/51/1056405051.db2.gz MQVKGSGSYXETLZ-DOMZBBRYSA-N -1 1 309.837 4.380 20 0 DIADMM Cc1cnc(SCc2ccc(-c3ccccc3)cc2)[n-]c1=O ZINC001613808256 1056409655 /nfs/dbraw/zinc/40/96/55/1056409655.db2.gz HOOOUAHIDCFXDF-UHFFFAOYSA-N -1 1 308.406 4.450 20 0 DIADMM CCC1(C)CCN(C(=O)c2ccc(C(F)(F)F)c([O-])c2)CC1 ZINC001626216176 1056453971 /nfs/dbraw/zinc/45/39/71/1056453971.db2.gz MTVRDCASMAHFBE-UHFFFAOYSA-N -1 1 315.335 4.063 20 0 DIADMM O=C(c1ccc(F)c([O-])c1)N1CCC[C@H]1c1ccccc1Cl ZINC001544805741 1056504696 /nfs/dbraw/zinc/50/46/96/1056504696.db2.gz IASDHMODTYAHAP-HNNXBMFYSA-N -1 1 319.763 4.162 20 0 DIADMM [O-]c1c(F)cc(Nc2nc3c(cccc3O)s2)cc1Cl ZINC001214480158 1056541657 /nfs/dbraw/zinc/54/16/57/1056541657.db2.gz MTPBASUPGBGKHO-UHFFFAOYSA-N -1 1 310.737 4.244 20 0 DIADMM [O-]c1c(F)cc(Nc2nc(-c3ccncc3)cs2)cc1Cl ZINC001214480654 1056548221 /nfs/dbraw/zinc/54/82/21/1056548221.db2.gz WXLSXRLXQPAVLX-UHFFFAOYSA-N -1 1 321.764 4.447 20 0 DIADMM CC(=O)c1ccnc(Cl)c1Nc1cc(F)c([O-])c(Cl)c1 ZINC001214482742 1056562485 /nfs/dbraw/zinc/56/24/85/1056562485.db2.gz LLOOBUCNHIPHKD-UHFFFAOYSA-N -1 1 315.131 4.179 20 0 DIADMM CC(C)c1ccc(CCCNC(=O)c2ccc([O-])cc2F)cc1 ZINC001585866009 1056634597 /nfs/dbraw/zinc/63/45/97/1056634597.db2.gz XTVSXVUCPHHJCE-UHFFFAOYSA-N -1 1 315.388 4.017 20 0 DIADMM O=C(NC1CCC2(CCCCC2)CC1)c1c([O-])cccc1F ZINC001616340990 1056636811 /nfs/dbraw/zinc/63/68/11/1056636811.db2.gz WXSZXCISVVTPCA-UHFFFAOYSA-N -1 1 305.393 4.154 20 0 DIADMM C[C@@H]1CCc2c(sc3ncnc(-c4cc(F)ccc4[O-])c23)C1 ZINC001240693272 1056645408 /nfs/dbraw/zinc/64/54/08/1056645408.db2.gz KMGIZNQYAKEJMP-SECBINFHSA-N -1 1 314.385 4.328 20 0 DIADMM Cc1cccc(Sc2cncc(-c3cc(F)ccc3[O-])n2)c1 ZINC001240694232 1056645499 /nfs/dbraw/zinc/64/54/99/1056645499.db2.gz ROVXJTYWOPCQNT-UHFFFAOYSA-N -1 1 312.369 4.448 20 0 DIADMM CSc1cnc(-c2cc(F)ccc2[O-])c(C(F)(F)F)c1 ZINC001240695261 1056645597 /nfs/dbraw/zinc/64/55/97/1056645597.db2.gz GJOBJUNVDVTEHE-UHFFFAOYSA-N -1 1 303.280 4.334 20 0 DIADMM Cc1ccc(-c2nc3c(ncnc3-c3cc(F)ccc3[O-])o2)cc1 ZINC001240695816 1056647813 /nfs/dbraw/zinc/64/78/13/1056647813.db2.gz TXRAVAFODJSGSL-UHFFFAOYSA-N -1 1 321.311 4.105 20 0 DIADMM CC[C@@H]1c2ccccc2CCN1C(=O)c1cc(Cl)ccc1[O-] ZINC001586204845 1056692387 /nfs/dbraw/zinc/69/23/87/1056692387.db2.gz NYARRNDYHDVNCY-MRXNPFEDSA-N -1 1 315.800 4.195 20 0 DIADMM CCn1cc2cc(Nc3cc(F)c([O-])c(Cl)c3)ccc2n1 ZINC001214489269 1056694863 /nfs/dbraw/zinc/69/48/63/1056694863.db2.gz AFDSUOMTKSPFID-UHFFFAOYSA-N -1 1 305.740 4.298 20 0 DIADMM [O-]c1ccc(-c2ccc(-c3c[nH]c4ccccc43)nn2)cc1F ZINC001240783178 1056695368 /nfs/dbraw/zinc/69/53/68/1056695368.db2.gz NOSXHVXGNVULGW-UHFFFAOYSA-N -1 1 305.312 4.137 20 0 DIADMM COC(=O)c1cc(-c2ccccc2)cnc1-c1ccc([O-])c(F)c1 ZINC001240783703 1056697908 /nfs/dbraw/zinc/69/79/08/1056697908.db2.gz YFGABEJGVNPFPF-UHFFFAOYSA-N -1 1 323.323 4.047 20 0 DIADMM CCCc1ccc(NC(=O)c2cc(SC)ccc2[O-])cc1 ZINC001586909680 1056829956 /nfs/dbraw/zinc/82/99/56/1056829956.db2.gz XHPPHIQUOZTZPT-UHFFFAOYSA-N -1 1 301.411 4.319 20 0 DIADMM O=C(N[C@@H]1CC[C@H]2CCC[C@H]2C1)c1cc2ccccc2cc1[O-] ZINC001617426312 1056830803 /nfs/dbraw/zinc/83/08/03/1056830803.db2.gz OWQVKLJOTMIMRF-JKIFEVAISA-N -1 1 309.409 4.244 20 0 DIADMM CC1(C)CN(C(=O)c2ccc([O-])cc2F)c2cccc(Cl)c21 ZINC001587086679 1056857485 /nfs/dbraw/zinc/85/74/85/1056857485.db2.gz WOJOLZBKAAYKSQ-UHFFFAOYSA-N -1 1 319.763 4.123 20 0 DIADMM CC(C)c1ccc2c(c1)[C@@H](NC(=O)c1ccc([O-])c(F)c1)CC2 ZINC000681762428 1056879060 /nfs/dbraw/zinc/87/90/60/1056879060.db2.gz OTJCZGIAPAWBHV-KRWDZBQOSA-N -1 1 313.372 4.072 20 0 DIADMM Cc1c(NC(=O)c2ccc(F)c([O-])c2)sc2c1CCCC2 ZINC001617913357 1056901444 /nfs/dbraw/zinc/90/14/44/1056901444.db2.gz MYUMRLAJWWROHG-UHFFFAOYSA-N -1 1 305.374 4.032 20 0 DIADMM COc1ccc2nc(-c3c(F)cc([O-])cc3F)cc(C)c2c1 ZINC001241119278 1056905115 /nfs/dbraw/zinc/90/51/15/1056905115.db2.gz ZYONHZPUQFUXQU-UHFFFAOYSA-N -1 1 301.292 4.203 20 0 DIADMM [O-]c1cc(F)c(-c2cccnc2OCc2ccccc2)c(F)c1 ZINC001241120734 1056906223 /nfs/dbraw/zinc/90/62/23/1056906223.db2.gz ITARLAOCHXZGAP-UHFFFAOYSA-N -1 1 313.303 4.311 20 0 DIADMM CC[C@@H](C(=O)OC)c1ccc(-c2c(F)cc([O-])cc2F)cc1 ZINC001241122648 1056906900 /nfs/dbraw/zinc/90/69/00/1056906900.db2.gz JPZROWTWDVJTLH-CYBMUJFWSA-N -1 1 306.308 4.004 20 0 DIADMM [O-]c1cc(F)c(-c2ccnc3[nH]cc(C(F)(F)F)c32)c(F)c1 ZINC001241122832 1056906992 /nfs/dbraw/zinc/90/69/92/1056906992.db2.gz NJTAMCNJSJGSNQ-UHFFFAOYSA-N -1 1 314.213 4.233 20 0 DIADMM COc1ccc(-c2cncc(-c3c(F)cc([O-])cc3F)c2)cc1 ZINC001241120752 1056907740 /nfs/dbraw/zinc/90/77/40/1056907740.db2.gz JKYZHJQOLKAFCM-UHFFFAOYSA-N -1 1 313.303 4.408 20 0 DIADMM CC(C)Oc1c(F)c(F)ccc1-c1c(F)cc([O-])cc1F ZINC001241125117 1056910095 /nfs/dbraw/zinc/91/00/95/1056910095.db2.gz RYNZRTOOLJULIF-UHFFFAOYSA-N -1 1 300.251 4.403 20 0 DIADMM CSc1ccc([O-])c(C(=O)Nc2ccc(Cl)cc2F)c1 ZINC001618261328 1056942573 /nfs/dbraw/zinc/94/25/73/1056942573.db2.gz RSTSWHTWPWISLI-UHFFFAOYSA-N -1 1 311.765 4.159 20 0 DIADMM CC(C)C1=NCCc2ccc(-c3ccc(C(=O)[O-])c(F)c3)cc21 ZINC001241186774 1056951136 /nfs/dbraw/zinc/95/11/36/1056951136.db2.gz FYCQFWWGAOAYPL-UHFFFAOYSA-N -1 1 311.356 4.192 20 0 DIADMM CCOc1cc(C)c(-c2ccc3[n-]c(C(=O)OC)nc3c2)c(C)c1 ZINC001241202721 1056956853 /nfs/dbraw/zinc/95/68/53/1056956853.db2.gz UAJGQJSWVBDMAZ-UHFFFAOYSA-N -1 1 324.380 4.032 20 0 DIADMM CCOc1cc(C)c(-c2ccc3nc(C(=O)OC)[n-]c3c2)c(C)c1 ZINC001241202721 1056956859 /nfs/dbraw/zinc/95/68/59/1056956859.db2.gz UAJGQJSWVBDMAZ-UHFFFAOYSA-N -1 1 324.380 4.032 20 0 DIADMM Cc1cc(C=C2SC(=S)[N-]C2=O)ccc1Br ZINC000080642031 1056980063 /nfs/dbraw/zinc/98/00/63/1056980063.db2.gz VEHAUACVJNUMNZ-UITAMQMPSA-N -1 1 314.229 4.087 20 0 DIADMM [O-]c1cc(F)cc(-c2ncc(F)c(Oc3cccc(F)c3)n2)c1 ZINC001241261222 1056984651 /nfs/dbraw/zinc/98/46/51/1056984651.db2.gz HVIWMWWVEOQNMF-UHFFFAOYSA-N -1 1 318.254 4.059 20 0 DIADMM Cc1ccccc1Oc1nc(-c2cc([O-])cc(F)c2)ncc1F ZINC001241260860 1056984680 /nfs/dbraw/zinc/98/46/80/1056984680.db2.gz AXLZGJQRLYWCQG-UHFFFAOYSA-N -1 1 314.291 4.228 20 0 DIADMM Cc1c(NC(=O)C(C)(C)C)ccnc1-c1c(F)ccc([O-])c1F ZINC001241289126 1056998604 /nfs/dbraw/zinc/99/86/04/1056998604.db2.gz LTBLDOICIKILAK-UHFFFAOYSA-N -1 1 320.339 4.025 20 0 DIADMM [O-]c1ccc(F)c(-c2cncc(Oc3cccc(F)c3)n2)c1F ZINC001241289345 1056998817 /nfs/dbraw/zinc/99/88/17/1056998817.db2.gz RJIXEMWAGAIXBE-UHFFFAOYSA-N -1 1 318.254 4.059 20 0 DIADMM [O-]c1ccc(F)c(-c2nc(-c3ccccc3)nc3[nH]ccc32)c1F ZINC001241289689 1056998846 /nfs/dbraw/zinc/99/88/46/1056998846.db2.gz YBEJCYCEDVBVRF-UHFFFAOYSA-N -1 1 323.302 4.227 20 0 DIADMM [O-]c1ccc(F)c(-c2ccc(OCc3ccccc3)cn2)c1F ZINC001241289036 1056998950 /nfs/dbraw/zinc/99/89/50/1056998950.db2.gz IAGLTMUFWRLYCD-UHFFFAOYSA-N -1 1 313.303 4.311 20 0 DIADMM COc1cc(F)cc2ccc(-c3c(F)ccc([O-])c3F)nc21 ZINC001241289696 1056999074 /nfs/dbraw/zinc/99/90/74/1056999074.db2.gz YEECNKJCWNADJL-UHFFFAOYSA-N -1 1 305.255 4.033 20 0 DIADMM [O-]c1ccc(F)c(-c2ccc(-c3nc4ccccc4[nH]3)cn2)c1F ZINC001241289686 1056999145 /nfs/dbraw/zinc/99/91/45/1056999145.db2.gz BSPPMGYJPMZVMC-UHFFFAOYSA-N -1 1 323.302 4.276 20 0 DIADMM [O-]c1ccc(F)c(-c2cc(OCc3ccccc3)ccn2)c1F ZINC001241289121 1056999210 /nfs/dbraw/zinc/99/92/10/1056999210.db2.gz LMAYOOFWEMYCJM-UHFFFAOYSA-N -1 1 313.303 4.311 20 0 DIADMM CCOC(=O)c1nc2cc(-c3cccc([C@@H](C)OC)c3)ccc2[n-]1 ZINC001242042126 1057248081 /nfs/dbraw/zinc/24/80/81/1057248081.db2.gz YTFTTZHMSCGUSB-GFCCVEGCSA-N -1 1 324.380 4.114 20 0 DIADMM CCOC(=O)c1nc2ccc(-c3cccc([C@@H](C)OC)c3)cc2[n-]1 ZINC001242042126 1057248087 /nfs/dbraw/zinc/24/80/87/1057248087.db2.gz YTFTTZHMSCGUSB-GFCCVEGCSA-N -1 1 324.380 4.114 20 0 DIADMM Cc1nc2cc(F)ccc2c(-c2cc(C(F)(F)F)ccc2[O-])n1 ZINC001242131329 1057273462 /nfs/dbraw/zinc/27/34/62/1057273462.db2.gz HOHBEXVZBUMYFK-UHFFFAOYSA-N -1 1 322.261 4.469 20 0 DIADMM CSc1cc(-c2cc(C(F)(F)F)ccc2[O-])ncc1F ZINC001242131577 1057274123 /nfs/dbraw/zinc/27/41/23/1057274123.db2.gz NCZNOQOVJJRFMX-UHFFFAOYSA-N -1 1 303.280 4.334 20 0 DIADMM CCCSc1cncc(-c2cc(C(F)(F)F)ccc2[O-])n1 ZINC001242133061 1057274562 /nfs/dbraw/zinc/27/45/62/1057274562.db2.gz DHYOGUJJMLCQHV-UHFFFAOYSA-N -1 1 314.332 4.370 20 0 DIADMM CC(C)(C)Oc1ccc(-c2ccc([O-])c(C(F)(F)F)c2)nn1 ZINC001242148348 1057280070 /nfs/dbraw/zinc/28/00/70/1057280070.db2.gz VEVFDHNDXTYMQM-UHFFFAOYSA-N -1 1 312.291 4.045 20 0 DIADMM Cc1ccc2nc(-c3ccc([O-])c(C(F)(F)F)c3)ncc2c1 ZINC001242151694 1057280750 /nfs/dbraw/zinc/28/07/50/1057280750.db2.gz UIOAJUQAMVYMNA-UHFFFAOYSA-N -1 1 304.271 4.330 20 0 DIADMM COc1ccc2nc(-c3ccc([O-])c(C(F)(F)F)c3)cnc2c1 ZINC001242151069 1057281138 /nfs/dbraw/zinc/28/11/38/1057281138.db2.gz FOOMCTMAWLLKPC-UHFFFAOYSA-N -1 1 320.270 4.030 20 0 DIADMM [O-]c1ccc(-c2ncnc3c2CCCCC3)cc1C(F)(F)F ZINC001242157190 1057283096 /nfs/dbraw/zinc/28/30/96/1057283096.db2.gz DIFHVRONIRAJNK-UHFFFAOYSA-N -1 1 308.303 4.137 20 0 DIADMM Cc1cc2ncccc2nc1-c1ccc([O-])c(C(F)(F)F)c1 ZINC001242157781 1057283396 /nfs/dbraw/zinc/28/33/96/1057283396.db2.gz MQGHDHWLCBGTDB-UHFFFAOYSA-N -1 1 304.271 4.330 20 0 DIADMM CC(C)OCc1ccc(-c2ccc([O-])c(C(F)(F)F)c2)nc1 ZINC001242158003 1057283521 /nfs/dbraw/zinc/28/35/21/1057283521.db2.gz QVSYEBLAKJLNIR-UHFFFAOYSA-N -1 1 311.303 4.398 20 0 DIADMM Cc1cc(-c2ccc([O-])c(C(F)(F)F)c2)nc(-c2ccco2)n1 ZINC001242158336 1057284577 /nfs/dbraw/zinc/28/45/77/1057284577.db2.gz YYYZZFYHPJBKNS-UHFFFAOYSA-N -1 1 320.270 4.436 20 0 DIADMM [O-]c1ccc(-c2nc(C3CC3)nc3c2CCC3)cc1C(F)(F)F ZINC001242158303 1057284849 /nfs/dbraw/zinc/28/48/49/1057284849.db2.gz XMYJJHHGGXLGCS-UHFFFAOYSA-N -1 1 320.314 4.234 20 0 DIADMM COC(=O)c1cccc(F)c1-c1ccc([O-])c(C(F)(F)F)c1 ZINC001242162815 1057285324 /nfs/dbraw/zinc/28/53/24/1057285324.db2.gz UDBWMEAIYXSOCN-UHFFFAOYSA-N -1 1 314.234 4.004 20 0 DIADMM COC(=O)c1ccc(C(F)(F)F)cc1-c1ccc(F)cc1[O-] ZINC001242218408 1057297062 /nfs/dbraw/zinc/29/70/62/1057297062.db2.gz CVWAKASITLUBAW-UHFFFAOYSA-N -1 1 314.234 4.004 20 0 DIADMM Cc1cccc(-c2ncc3ccc(C(F)(F)F)cc3n2)c1[O-] ZINC001242344600 1057340212 /nfs/dbraw/zinc/34/02/12/1057340212.db2.gz PHVTYFFKNXCAEX-UHFFFAOYSA-N -1 1 304.271 4.330 20 0 DIADMM CC(C)(C)OC(=O)c1ccc(F)cc1-c1cccc(F)c1[O-] ZINC001242351912 1057342216 /nfs/dbraw/zinc/34/22/16/1057342216.db2.gz AXAVZWPDCPMNLN-UHFFFAOYSA-N -1 1 306.308 4.293 20 0 DIADMM [O-]c1c(Cl)cccc1-c1ccc2c(c1)C1(CN2)CCOCC1 ZINC001242364284 1057346317 /nfs/dbraw/zinc/34/63/17/1057346317.db2.gz GCRSJWCWUAYXFZ-UHFFFAOYSA-N -1 1 315.800 4.186 20 0 DIADMM CC(C)(C)NC(=O)c1ccc(-c2cccc(Cl)c2[O-])cc1 ZINC001242364565 1057346708 /nfs/dbraw/zinc/34/67/08/1057346708.db2.gz NQFYJKTULYDAOJ-UHFFFAOYSA-N -1 1 303.789 4.241 20 0 DIADMM COC(=O)c1ccc(-c2cccc(Cl)c2[O-])c2ncccc12 ZINC001242364858 1057347423 /nfs/dbraw/zinc/34/74/23/1057347423.db2.gz SMETZVONDJLWEQ-UHFFFAOYSA-N -1 1 313.740 4.047 20 0 DIADMM O=C(Nc1ccc(-c2cccc(Cl)c2[O-])cc1)c1ccccn1 ZINC001242367967 1057348334 /nfs/dbraw/zinc/34/83/34/1057348334.db2.gz SHDKHAQNJIICAY-UHFFFAOYSA-N -1 1 324.767 4.360 20 0 DIADMM CCOC(=O)c1cc2c(cccc2-c2cccc(Cl)c2[O-])[nH]1 ZINC001242367019 1057348768 /nfs/dbraw/zinc/34/87/68/1057348768.db2.gz VIHSZAZFCARYBQ-UHFFFAOYSA-N -1 1 315.756 4.371 20 0 DIADMM O=c1ccc(-c2cccc(Cl)c2[O-])cn1-c1ccccc1F ZINC001242367239 1057349126 /nfs/dbraw/zinc/34/91/26/1057349126.db2.gz JOWSFAVPZHHHNN-UHFFFAOYSA-N -1 1 315.731 4.003 20 0 DIADMM CCOC(=O)c1c(F)cc(-c2cccc(Cl)c2[O-])cc1F ZINC001242367825 1057349190 /nfs/dbraw/zinc/34/91/90/1057349190.db2.gz TZJRWOFXOQVUFT-UHFFFAOYSA-N -1 1 312.699 4.168 20 0 DIADMM [O-]c1cccc(-c2cncc(OC3CCCCC3)n2)c1Cl ZINC001242800005 1057480824 /nfs/dbraw/zinc/48/08/24/1057480824.db2.gz BKZXEAMGCJLJNK-UHFFFAOYSA-N -1 1 304.777 4.214 20 0 DIADMM [O-]c1cccc(-c2ncc(F)c(Oc3ccccc3)n2)c1Cl ZINC001242799693 1057481080 /nfs/dbraw/zinc/48/10/80/1057481080.db2.gz YILPYOSEXIDWMK-UHFFFAOYSA-N -1 1 316.719 4.434 20 0 DIADMM CCc1cc(-c2cccc([O-])c2Cl)nc(-c2ccncc2)n1 ZINC001242799959 1057481093 /nfs/dbraw/zinc/48/10/93/1057481093.db2.gz AZYMJWBDBUPBMT-UHFFFAOYSA-N -1 1 311.772 4.127 20 0 DIADMM COC(=O)c1ccc2cc(-c3cccc([O-])c3Cl)ccc2n1 ZINC001242800766 1057481996 /nfs/dbraw/zinc/48/19/96/1057481996.db2.gz OLODHJMSCGJGSM-UHFFFAOYSA-N -1 1 313.740 4.047 20 0 DIADMM [O-]c1cccc(-c2cncc(Oc3cccc(F)c3)n2)c1Cl ZINC001242801518 1057482000 /nfs/dbraw/zinc/48/20/00/1057482000.db2.gz UYRBJSHTKMCFPP-UHFFFAOYSA-N -1 1 316.719 4.434 20 0 DIADMM [O-]c1cccc(-c2cc(OCc3ccccc3)cnn2)c1Cl ZINC001242800193 1057482008 /nfs/dbraw/zinc/48/20/08/1057482008.db2.gz DYXXMGRQVUMAGE-UHFFFAOYSA-N -1 1 312.756 4.082 20 0 DIADMM C=C(C(=O)OCC)c1ccc(-c2cccc([O-])c2Cl)cc1 ZINC001242801604 1057482117 /nfs/dbraw/zinc/48/21/17/1057482117.db2.gz BUYGVSPKEUFKFP-UHFFFAOYSA-N -1 1 302.757 4.289 20 0 DIADMM [O-]c1cccc(-c2nccc(N3Cc4ccccc4C3)n2)c1Cl ZINC001242801466 1057482130 /nfs/dbraw/zinc/48/21/30/1057482130.db2.gz RGGAVPBRTLDWFI-UHFFFAOYSA-N -1 1 323.783 4.023 20 0 DIADMM CC(=O)Oc1c[nH]c2ccc(-c3cccc([O-])c3Cl)cc12 ZINC001242801191 1057482162 /nfs/dbraw/zinc/48/21/62/1057482162.db2.gz UOJQQHVJVQYUJZ-UHFFFAOYSA-N -1 1 301.729 4.119 20 0 DIADMM CCCN(CCC)c1cncc(-c2cccc([O-])c2Cl)n1 ZINC001242801207 1057482319 /nfs/dbraw/zinc/48/23/19/1057482319.db2.gz PZDYPKIVKMZLFN-UHFFFAOYSA-N -1 1 305.809 4.129 20 0 DIADMM CCOC(=O)c1cc(-c2cccc([O-])c2Cl)cc2cc[nH]c21 ZINC001242800363 1057482368 /nfs/dbraw/zinc/48/23/68/1057482368.db2.gz HBNSBXSTJWKXFE-UHFFFAOYSA-N -1 1 315.756 4.371 20 0 DIADMM COc1cccc(-c2ccc(-c3cccc([O-])c3Cl)nn2)c1 ZINC001242800914 1057482408 /nfs/dbraw/zinc/48/24/08/1057482408.db2.gz MCKTUXAYFMAJNQ-UHFFFAOYSA-N -1 1 312.756 4.178 20 0 DIADMM CC(C)(C)OC(=O)c1nc(F)ccc1-c1cccc([O-])c1Cl ZINC001242802637 1057482863 /nfs/dbraw/zinc/48/28/63/1057482863.db2.gz DETPFRZKBBDSRV-UHFFFAOYSA-N -1 1 323.751 4.202 20 0 DIADMM [O-]c1cccc(-c2ccc(OCc3cccnc3)nc2)c1Cl ZINC001242802334 1057482929 /nfs/dbraw/zinc/48/29/29/1057482929.db2.gz XHHMSGDDCVAQHE-UHFFFAOYSA-N -1 1 312.756 4.082 20 0 DIADMM COC(=O)c1ccc2ncc(-c3cccc([O-])c3Cl)cc2c1 ZINC001242802686 1057483067 /nfs/dbraw/zinc/48/30/67/1057483067.db2.gz OGNWOMPFXMFRFM-UHFFFAOYSA-N -1 1 313.740 4.047 20 0 DIADMM COC(=O)c1cc2cc(-c3cccc([O-])c3Cl)c(F)cc2[nH]1 ZINC001242802820 1057483098 /nfs/dbraw/zinc/48/30/98/1057483098.db2.gz IVEDECLNSCDAIT-UHFFFAOYSA-N -1 1 319.719 4.120 20 0 DIADMM [O-]c1cc(-c2nc(C(F)(F)F)nc3ccsc32)ccc1F ZINC001243050366 1057558850 /nfs/dbraw/zinc/55/88/50/1057558850.db2.gz YKFFXTAMNWXYPI-UHFFFAOYSA-N -1 1 314.263 4.222 20 0 DIADMM [O-]c1ccc(-c2ccc(C3(C(F)(F)F)CC3)cn2)c(F)c1F ZINC001243338183 1057651172 /nfs/dbraw/zinc/65/11/72/1057651172.db2.gz BQHPRPZKTAQXFG-UHFFFAOYSA-N -1 1 315.241 4.326 20 0 DIADMM CCOC(=O)[C@H](CC)c1ccc(-c2ccc([O-])c(F)c2F)cc1 ZINC001243342235 1057652727 /nfs/dbraw/zinc/65/27/27/1057652727.db2.gz BKVRKOWXBNXETN-CYBMUJFWSA-N -1 1 320.335 4.394 20 0 DIADMM COC(=O)c1cc2cccc(-c3ccc([O-])c(F)c3F)c2s1 ZINC001243342708 1057652893 /nfs/dbraw/zinc/65/28/93/1057652893.db2.gz QKMPUSUCDAIFFO-UHFFFAOYSA-N -1 1 320.316 4.339 20 0 DIADMM [O-]c1ccc(-c2cc(OCc3ccccc3)ccn2)c(F)c1F ZINC001243341116 1057653080 /nfs/dbraw/zinc/65/30/80/1057653080.db2.gz CMGXMWMLESSYDU-UHFFFAOYSA-N -1 1 313.303 4.311 20 0 DIADMM [O-]c1ccc(-c2ccc(OCc3ccccc3)nc2)c(F)c1F ZINC001243342386 1057653157 /nfs/dbraw/zinc/65/31/57/1057653157.db2.gz IMCYUQHKIWLKNY-UHFFFAOYSA-N -1 1 313.303 4.311 20 0 DIADMM CCOC(=O)[C@@H](CC)c1ccc(-c2ccc([O-])c(F)c2F)cc1 ZINC001243342237 1057653210 /nfs/dbraw/zinc/65/32/10/1057653210.db2.gz BKVRKOWXBNXETN-ZDUSSCGKSA-N -1 1 320.335 4.394 20 0 DIADMM [O-]c1ccc(-c2ccc3nc(C(F)(F)F)cn3c2)c(F)c1F ZINC001243342496 1057653263 /nfs/dbraw/zinc/65/32/63/1057653263.db2.gz OZLDNCAVBLBTSR-UHFFFAOYSA-N -1 1 314.213 4.004 20 0 DIADMM COc1ccc(-c2ccncc2)cc1-c1ccc([O-])c(F)c1F ZINC001243343024 1057653439 /nfs/dbraw/zinc/65/34/39/1057653439.db2.gz VAXHRJIRKLBCBJ-UHFFFAOYSA-N -1 1 313.303 4.408 20 0 DIADMM COC(=O)c1ccc2ccc(-c3ccc([O-])c(F)c3F)cc2c1 ZINC001243345500 1057655015 /nfs/dbraw/zinc/65/50/15/1057655015.db2.gz TUDAPCKWJUSDGL-UHFFFAOYSA-N -1 1 314.287 4.277 20 0 DIADMM CC(=O)c1cccc(NC(=O)c2cc([O-])c3ccccc3c2)c1 ZINC000526820565 1057659144 /nfs/dbraw/zinc/65/91/44/1057659144.db2.gz VAJWKQLEQSPVAU-UHFFFAOYSA-N -1 1 305.333 4.000 20 0 DIADMM CCOC(=O)c1nc2cc(-c3ccc(C)cc3OCC)ccc2[n-]1 ZINC001243407615 1057673232 /nfs/dbraw/zinc/67/32/32/1057673232.db2.gz MWKHVHMDLJIZRJ-UHFFFAOYSA-N -1 1 324.380 4.114 20 0 DIADMM CCOC(=O)c1nc2ccc(-c3ccc(C)cc3OCC)cc2[n-]1 ZINC001243407615 1057673235 /nfs/dbraw/zinc/67/32/35/1057673235.db2.gz MWKHVHMDLJIZRJ-UHFFFAOYSA-N -1 1 324.380 4.114 20 0 DIADMM O=C(CSc1ccccc1Br)c1ccc([O-])cc1 ZINC000029745126 1057693394 /nfs/dbraw/zinc/69/33/94/1057693394.db2.gz YTPANOVOWBPRCH-UHFFFAOYSA-N -1 1 323.211 4.130 20 0 DIADMM [O-]c1c(F)cc(F)cc1-c1ccc(-c2c[nH]c(=S)[nH]2)cc1 ZINC001243504025 1057696705 /nfs/dbraw/zinc/69/67/05/1057696705.db2.gz XGWPTYQQIKFVAR-UHFFFAOYSA-N -1 1 304.321 4.016 20 0 DIADMM [O-]c1c(F)cc(F)cc1-c1cccc(OC(F)(F)F)c1F ZINC001243503305 1057696714 /nfs/dbraw/zinc/69/67/14/1057696714.db2.gz UXGHPQGEJCVVDO-UHFFFAOYSA-N -1 1 308.177 4.375 20 0 DIADMM [O-]c1c(F)cc(F)cc1-c1ccnc(OCc2ccccc2)c1 ZINC001243503644 1057697270 /nfs/dbraw/zinc/69/72/70/1057697270.db2.gz ISPMSEJCYHSZSA-UHFFFAOYSA-N -1 1 313.303 4.311 20 0 DIADMM COc1ccc(C(F)(F)F)c(-c2cc(F)cc(F)c2[O-])c1 ZINC001243506115 1057697680 /nfs/dbraw/zinc/69/76/80/1057697680.db2.gz ZQZIDXBRKUCONB-UHFFFAOYSA-N -1 1 304.214 4.365 20 0 DIADMM CC(C)(C)OC(=O)Cc1ccc(-c2cc(F)cc(F)c2[O-])cc1 ZINC001243506125 1057697695 /nfs/dbraw/zinc/69/76/95/1057697695.db2.gz PWJRDIKZNBPMHX-UHFFFAOYSA-N -1 1 320.335 4.222 20 0 DIADMM CCOC(=O)C(C)(C)c1ccc(-c2cc(F)cc(F)c2[O-])cc1 ZINC001243506772 1057697878 /nfs/dbraw/zinc/69/78/78/1057697878.db2.gz KERJVRIAKARJCE-UHFFFAOYSA-N -1 1 320.335 4.178 20 0 DIADMM COc1cc(-c2cc(F)cc(F)c2[O-])ccc1-c1ccncc1 ZINC001243507006 1057698484 /nfs/dbraw/zinc/69/84/84/1057698484.db2.gz QLMRLAJCOZYJBQ-UHFFFAOYSA-N -1 1 313.303 4.408 20 0 DIADMM [O-]c1cc(-c2ncc3c(n2)-c2ccccc2OC3)ccc1Cl ZINC001243578209 1057721403 /nfs/dbraw/zinc/72/14/03/1057721403.db2.gz DQSQIWFKHNERIY-UHFFFAOYSA-N -1 1 310.740 4.062 20 0 DIADMM COC(=O)c1cc(-c2ccc(Cl)c([O-])c2)nc(C(C)(C)C)c1 ZINC001243577873 1057721690 /nfs/dbraw/zinc/72/16/90/1057721690.db2.gz AZGRPFKOHUNZRX-UHFFFAOYSA-N -1 1 319.788 4.192 20 0 DIADMM [O-]c1cc(-c2cc(OCc3ccccc3)ncn2)ccc1Cl ZINC001243578729 1057722621 /nfs/dbraw/zinc/72/26/21/1057722621.db2.gz JYJYHKVUANFIDF-UHFFFAOYSA-N -1 1 312.756 4.082 20 0 DIADMM [O-]c1cc(-c2nnc(C3CC3)cc2C(F)(F)F)ccc1Cl ZINC001243579639 1057722733 /nfs/dbraw/zinc/72/27/33/1057722733.db2.gz WGNLSDQVKJQKLW-UHFFFAOYSA-N -1 1 314.694 4.399 20 0 DIADMM COc1cc(-c2ccc(Cl)c([O-])c2)ccc1OC(F)F ZINC001243581036 1057723350 /nfs/dbraw/zinc/72/33/50/1057723350.db2.gz JZXJRNXMECIHSG-UHFFFAOYSA-N -1 1 300.688 4.323 20 0 DIADMM CN1C(=O)CC(C)(C)c2cc(-c3ccc(Cl)c([O-])c3)ccc21 ZINC001243581116 1057723388 /nfs/dbraw/zinc/72/33/88/1057723388.db2.gz CGZGUBPCFMMPKS-UHFFFAOYSA-N -1 1 315.800 4.357 20 0 DIADMM CCOC(=O)CCc1ccc(-c2ccc(Cl)c([O-])c2)c(F)c1 ZINC001243583015 1057724104 /nfs/dbraw/zinc/72/41/04/1057724104.db2.gz GYTKCFOXGDFZAB-UHFFFAOYSA-N -1 1 322.763 4.347 20 0 DIADMM CC1(C)NC(=O)Nc2c(-c3ccc(Cl)c([O-])c3)cccc21 ZINC001243583080 1057724140 /nfs/dbraw/zinc/72/41/40/1057724140.db2.gz IGBZXHYYJWAZSC-UHFFFAOYSA-N -1 1 302.761 4.083 20 0 DIADMM [O-]c1cc(-c2ccc(OCc3cccnc3)nc2)ccc1Cl ZINC001243583727 1057724188 /nfs/dbraw/zinc/72/41/88/1057724188.db2.gz KPKWYBSLNIDQRE-UHFFFAOYSA-N -1 1 312.756 4.082 20 0 DIADMM CCOC(=O)c1c(F)cc(F)cc1-c1ccc(Cl)c([O-])c1 ZINC001243582348 1057724223 /nfs/dbraw/zinc/72/42/23/1057724223.db2.gz PSBZHBRZFIHDCQ-UHFFFAOYSA-N -1 1 312.699 4.168 20 0 DIADMM Cc1cc(-c2ccc(Cl)c([O-])c2)cnc1OCC(F)(F)F ZINC001243582477 1057724246 /nfs/dbraw/zinc/72/42/46/1057724246.db2.gz TWWDZLCWSZKRGA-UHFFFAOYSA-N -1 1 317.694 4.357 20 0 DIADMM O=c1c(-c2ccc(Cl)c([O-])c2)cccn1-c1ccc(F)cc1 ZINC001243584653 1057724586 /nfs/dbraw/zinc/72/45/86/1057724586.db2.gz VOBGBBXBWGCHOO-UHFFFAOYSA-N -1 1 315.731 4.003 20 0 DIADMM CC(=O)Oc1c[nH]c2cc(-c3ccc(Cl)c([O-])c3)ccc12 ZINC001243584890 1057724629 /nfs/dbraw/zinc/72/46/29/1057724629.db2.gz ZPVCAYDINDBXDP-UHFFFAOYSA-N -1 1 301.729 4.119 20 0 DIADMM CC1(C)C(=O)Nc2cc(F)c(-c3ccc(Cl)c([O-])c3)cc21 ZINC001243583913 1057724872 /nfs/dbraw/zinc/72/48/72/1057724872.db2.gz NEXPIVPNSGAFAR-UHFFFAOYSA-N -1 1 305.736 4.081 20 0 DIADMM CCOC(=O)c1c(F)cc(-c2ccc(Cl)c([O-])c2)cc1F ZINC001243584132 1057724942 /nfs/dbraw/zinc/72/49/42/1057724942.db2.gz RFJKTQJTMRMWPS-UHFFFAOYSA-N -1 1 312.699 4.168 20 0 DIADMM COC(=O)c1ccc2ncc(-c3ccc(Cl)c([O-])c3)cc2c1 ZINC001243583918 1057724965 /nfs/dbraw/zinc/72/49/65/1057724965.db2.gz NFORZZUTBQXGCQ-UHFFFAOYSA-N -1 1 313.740 4.047 20 0 DIADMM [O-]c1cc(C(F)(F)F)ccc1-c1cnc(-c2ccco2)cn1 ZINC001243607772 1057731553 /nfs/dbraw/zinc/73/15/53/1057731553.db2.gz COAJVGZBHQDUHG-UHFFFAOYSA-N -1 1 306.243 4.128 20 0 DIADMM [O-]c1cc(C(F)(F)F)ccc1-c1ccc(OC(F)F)cn1 ZINC001243609925 1057732081 /nfs/dbraw/zinc/73/20/81/1057732081.db2.gz XYZPCFPJRBHKFQ-UHFFFAOYSA-N -1 1 305.202 4.074 20 0 DIADMM Cc1cc2ncccc2nc1-c1ccc(C(F)(F)F)cc1[O-] ZINC001243609785 1057732355 /nfs/dbraw/zinc/73/23/55/1057732355.db2.gz AMMAGBJPZIPAAT-UHFFFAOYSA-N -1 1 304.271 4.330 20 0 DIADMM [O-]c1cc(C(F)(F)F)ccc1-c1cnc2cc(F)ccc2n1 ZINC001243609943 1057732496 /nfs/dbraw/zinc/73/24/96/1057732496.db2.gz YVBIRCGFQJPTOH-UHFFFAOYSA-N -1 1 308.234 4.160 20 0 DIADMM [O-]c1c(F)cc(-c2ccc(-c3nc4cc[nH]cc-4n3)cc2)cc1F ZINC001244094432 1057866538 /nfs/dbraw/zinc/86/65/38/1057866538.db2.gz RKFOLPLQJVWGED-UHFFFAOYSA-N -1 1 323.302 4.276 20 0 DIADMM CC(C)(C)OC(=O)c1cccc(-c2cc(F)c([O-])c(F)c2)c1 ZINC001244094049 1057866915 /nfs/dbraw/zinc/86/69/15/1057866915.db2.gz NNIATRDXSCEJSF-UHFFFAOYSA-N -1 1 306.308 4.293 20 0 DIADMM COc1ccc(-c2cc(F)c([O-])c(F)c2)c(C(F)(F)F)c1 ZINC001244095968 1057867474 /nfs/dbraw/zinc/86/74/74/1057867474.db2.gz FCKSXPIBPYSORB-UHFFFAOYSA-N -1 1 304.214 4.365 20 0 DIADMM [O-]c1c(F)cc(-c2ccnc(OCc3ccccc3)c2)cc1F ZINC001244096728 1057867964 /nfs/dbraw/zinc/86/79/64/1057867964.db2.gz LVXGWQWYZPXEQZ-UHFFFAOYSA-N -1 1 313.303 4.311 20 0 DIADMM COc1cc(-c2cc(F)c([O-])c(F)c2)ccc1C(F)(F)F ZINC001244098321 1057868854 /nfs/dbraw/zinc/86/88/54/1057868854.db2.gz YVRKGNYZIMYAML-UHFFFAOYSA-N -1 1 304.214 4.365 20 0 DIADMM CCOC(=O)c1nc2ccc(-c3ccc(C4CC4)cc3F)cc2[n-]1 ZINC001244125364 1057878250 /nfs/dbraw/zinc/87/82/50/1057878250.db2.gz DAESJKNBBRGXAL-UHFFFAOYSA-N -1 1 324.355 4.423 20 0 DIADMM CCOC(=O)c1nc2cc(-c3ccc(C4CC4)cc3F)ccc2[n-]1 ZINC001244125364 1057878253 /nfs/dbraw/zinc/87/82/53/1057878253.db2.gz DAESJKNBBRGXAL-UHFFFAOYSA-N -1 1 324.355 4.423 20 0 DIADMM COC(=O)c1nc2cc(-c3ccc(OC)c(C(C)C)c3)ccc2[n-]1 ZINC001244129718 1057880047 /nfs/dbraw/zinc/88/00/47/1057880047.db2.gz PKUNMYQTANHTQS-UHFFFAOYSA-N -1 1 324.380 4.149 20 0 DIADMM COC(=O)c1nc2ccc(-c3ccc(OC)c(C(C)C)c3)cc2[n-]1 ZINC001244129718 1057880048 /nfs/dbraw/zinc/88/00/48/1057880048.db2.gz PKUNMYQTANHTQS-UHFFFAOYSA-N -1 1 324.380 4.149 20 0 DIADMM Cc1ccc([O-])c(-c2ncc(F)c(Oc3ccccc3C)n2)c1 ZINC001244402950 1057951116 /nfs/dbraw/zinc/95/11/16/1057951116.db2.gz KCNIOQQSZCNMOX-UHFFFAOYSA-N -1 1 310.328 4.397 20 0 DIADMM Cc1ccc([O-])c(-c2ncc(F)c(Oc3ccccc3F)n2)c1 ZINC001244402790 1057951281 /nfs/dbraw/zinc/95/12/81/1057951281.db2.gz IANLHDCELZBMPK-UHFFFAOYSA-N -1 1 314.291 4.228 20 0 DIADMM Cc1ccc([O-])c(-c2ncc(F)c(Oc3ccc(F)cc3)n2)c1 ZINC001244403723 1057951870 /nfs/dbraw/zinc/95/18/70/1057951870.db2.gz ZIOXSAYNPRKHAL-UHFFFAOYSA-N -1 1 314.291 4.228 20 0 DIADMM Cc1cc(-c2ccc(OC(F)(F)F)cc2[O-])nc(C(C)C)n1 ZINC001244461740 1057964735 /nfs/dbraw/zinc/96/47/35/1057964735.db2.gz DFCPJLZDSNGKQK-UHFFFAOYSA-N -1 1 312.291 4.180 20 0 DIADMM Cc1cc2ncccc2nc1-c1ccc(OC(F)(F)F)cc1[O-] ZINC001244462340 1057965278 /nfs/dbraw/zinc/96/52/78/1057965278.db2.gz JXBMTPGSROEXHN-UHFFFAOYSA-N -1 1 320.270 4.209 20 0 DIADMM Cc1cccc2c1ncnc2-c1ccc(OC(F)(F)F)cc1[O-] ZINC001244464961 1057966282 /nfs/dbraw/zinc/96/62/82/1057966282.db2.gz YXVXZBLEUSHFGM-UHFFFAOYSA-N -1 1 320.270 4.209 20 0 DIADMM Cc1ccc2nc(-c3ccc(OC(F)(F)F)cc3[O-])ccc2n1 ZINC001244465523 1057967063 /nfs/dbraw/zinc/96/70/63/1057967063.db2.gz YEVBVAWZDPEZOB-UHFFFAOYSA-N -1 1 320.270 4.209 20 0 DIADMM O=C([O-])c1cc(Cl)c(-c2ccc3cncn3c2)c(Cl)c1 ZINC001244513620 1057982496 /nfs/dbraw/zinc/98/24/96/1057982496.db2.gz JFRCQJCOTSOBQZ-UHFFFAOYSA-N -1 1 307.136 4.006 20 0 DIADMM Cc1nc2ccc(F)cc2c(-c2cc(C)c([O-])c(Cl)c2)n1 ZINC001244530621 1057987470 /nfs/dbraw/zinc/98/74/70/1057987470.db2.gz PPJHDTDFPRDWBC-UHFFFAOYSA-N -1 1 302.736 4.412 20 0 DIADMM Cc1cc(-c2nccc(-c3cccnc3F)n2)cc(Cl)c1[O-] ZINC001244536707 1057988831 /nfs/dbraw/zinc/98/88/31/1057988831.db2.gz NULMRWKMOVSAKP-UHFFFAOYSA-N -1 1 315.735 4.012 20 0 DIADMM COc1cc(C(F)(F)F)cc(-c2c(Cl)ccc([O-])c2F)n1 ZINC001244537334 1057988936 /nfs/dbraw/zinc/98/89/36/1057988936.db2.gz ALBZTNFCJPMBCN-UHFFFAOYSA-N -1 1 321.657 4.274 20 0 DIADMM Cc1cc(-c2ncnc(-c3cccc(F)c3)n2)cc(Cl)c1[O-] ZINC001244536738 1057989115 /nfs/dbraw/zinc/98/91/15/1057989115.db2.gz OUUWWPHFGDAQRX-UHFFFAOYSA-N -1 1 315.735 4.012 20 0 DIADMM Cc1cc(-c2ccc(SC(=O)N(C)C)cn2)cc(Cl)c1[O-] ZINC001244537572 1057989341 /nfs/dbraw/zinc/98/93/41/1057989341.db2.gz ANJABKLKHOEFRH-UHFFFAOYSA-N -1 1 322.817 4.190 20 0 DIADMM Cc1nc2cc(F)ccc2c(-c2c(Cl)ccc([O-])c2F)n1 ZINC001244538388 1057989880 /nfs/dbraw/zinc/98/98/80/1057989880.db2.gz LDASUWIYQCMOOG-UHFFFAOYSA-N -1 1 306.699 4.242 20 0 DIADMM CCOc1ccc2ncnc(-c3c(Cl)ccc([O-])c3F)c2c1 ZINC001244538550 1057989897 /nfs/dbraw/zinc/98/98/97/1057989897.db2.gz MWQSVIRMQUHSLX-UHFFFAOYSA-N -1 1 318.735 4.194 20 0 DIADMM Cc1cc(-c2cc(C)c([O-])c(Cl)c2)nc(-c2ccco2)n1 ZINC001244538591 1057989940 /nfs/dbraw/zinc/98/99/40/1057989940.db2.gz NMONSYOQTJDYQY-UHFFFAOYSA-N -1 1 300.745 4.379 20 0 DIADMM CCOC(=O)c1c(C)cc(-c2c(Cl)ccc([O-])c2F)nc1C ZINC001244538062 1057989969 /nfs/dbraw/zinc/98/99/69/1057989969.db2.gz HIWVJROTANTJQQ-UHFFFAOYSA-N -1 1 323.751 4.040 20 0 DIADMM COCc1cc(-c2cc(C)c([O-])c(Cl)c2)nc(C(C)(C)C)n1 ZINC001244538041 1057990082 /nfs/dbraw/zinc/99/00/82/1057990082.db2.gz IWRBRUODGDTAJM-UHFFFAOYSA-N -1 1 320.820 4.255 20 0 DIADMM [O-]c1ccc(Cl)c(-c2ncccc2OC(F)(F)F)c1F ZINC001244538429 1057990095 /nfs/dbraw/zinc/99/00/95/1057990095.db2.gz NHEXYGLGDSJYKQ-UHFFFAOYSA-N -1 1 307.630 4.145 20 0 DIADMM Cc1cc(-c2cncc(N3CCCCCC3)n2)cc(Cl)c1[O-] ZINC001244538556 1057990105 /nfs/dbraw/zinc/99/01/05/1057990105.db2.gz MPZSWBWIJIGTRN-UHFFFAOYSA-N -1 1 317.820 4.191 20 0 DIADMM CC(C)(C)C(=O)Nc1ccc(-c2c(Cl)ccc([O-])c2F)cn1 ZINC001244539674 1057990341 /nfs/dbraw/zinc/99/03/41/1057990341.db2.gz BPPTUQLJJQLUCW-UHFFFAOYSA-N -1 1 322.767 4.231 20 0 DIADMM [O-]c1ccc(Cl)c(-c2ccc(COC3CCC3)cn2)c1F ZINC001244540113 1057990633 /nfs/dbraw/zinc/99/06/33/1057990633.db2.gz HPUORJBTPJOGEP-UHFFFAOYSA-N -1 1 307.752 4.316 20 0 DIADMM Cc1nc(-c2c(Cl)ccc([O-])c2F)nc(C)c1CC(C)C ZINC001244540069 1057990732 /nfs/dbraw/zinc/99/07/32/1057990732.db2.gz OPQRWKPJCOSLLM-UHFFFAOYSA-N -1 1 308.784 4.457 20 0 DIADMM COc1ncc(-c2c(Cl)ccc([O-])c2F)cc1C(F)(F)F ZINC001244540533 1057990782 /nfs/dbraw/zinc/99/07/82/1057990782.db2.gz ADKLUNICZXCAKO-UHFFFAOYSA-N -1 1 321.657 4.274 20 0 DIADMM COc1cccc2nccc(-c3c(Cl)ccc([O-])c3F)c21 ZINC001244541217 1057991086 /nfs/dbraw/zinc/99/10/86/1057991086.db2.gz ACLVXCYYPOUVLP-UHFFFAOYSA-N -1 1 303.720 4.409 20 0 DIADMM CC(=O)Nc1cc(C)c(C)cc1-c1c(Cl)ccc([O-])c1F ZINC001244541629 1057991242 /nfs/dbraw/zinc/99/12/42/1057991242.db2.gz DXQQXDWHRZNYND-UHFFFAOYSA-N -1 1 307.752 4.427 20 0 DIADMM COc1cc2ncccc2c(-c2c(Cl)ccc([O-])c2F)c1 ZINC001244541477 1057991331 /nfs/dbraw/zinc/99/13/31/1057991331.db2.gz DBYHGDLDGWAJPQ-UHFFFAOYSA-N -1 1 303.720 4.409 20 0 DIADMM [O-]c1ccc(Cl)c(-c2cnc(-c3ccccc3)nc2)c1F ZINC001244540915 1057991364 /nfs/dbraw/zinc/99/13/64/1057991364.db2.gz IZXDNDPVEYZNLD-UHFFFAOYSA-N -1 1 300.720 4.309 20 0 DIADMM CCOc1nnc(-c2c(Cl)ccc([O-])c2F)c2ccccc21 ZINC001244540886 1057991392 /nfs/dbraw/zinc/99/13/92/1057991392.db2.gz UKYHSVCKJDUNCO-UHFFFAOYSA-N -1 1 318.735 4.194 20 0 DIADMM [O-]c1ccc(Cl)c(-c2ccccc2Cn2ccnc2)c1F ZINC001244541262 1057991548 /nfs/dbraw/zinc/99/15/48/1057991548.db2.gz APDXFGUXGADBGA-UHFFFAOYSA-N -1 1 302.736 4.097 20 0 DIADMM CCOC(=O)CCc1cccc(-c2c(Cl)ccc([O-])c2F)c1 ZINC001244541763 1057991611 /nfs/dbraw/zinc/99/16/11/1057991611.db2.gz HDVOSKRUGBXMMO-UHFFFAOYSA-N -1 1 322.763 4.347 20 0 DIADMM CC(C)[S@](=O)c1ccc(-c2c(F)c([O-])ccc2Cl)cc1 ZINC001244541350 1057991648 /nfs/dbraw/zinc/99/16/48/1057991648.db2.gz OKYQGPPBUWRPJK-FQEVSTJZSA-N -1 1 312.793 4.368 20 0 DIADMM CC(C)(C)c1nnc2ccc(-c3c(Cl)ccc([O-])c3F)cn21 ZINC001244542500 1057992162 /nfs/dbraw/zinc/99/21/62/1057992162.db2.gz LWXLDJKCJCOOGA-UHFFFAOYSA-N -1 1 319.767 4.192 20 0 DIADMM COC(=O)C(C)(C)c1ccc(-c2c(Cl)ccc([O-])c2F)cc1 ZINC001244542554 1057992401 /nfs/dbraw/zinc/99/24/01/1057992401.db2.gz ZTVINUQTIOPKLA-UHFFFAOYSA-N -1 1 322.763 4.302 20 0 DIADMM CCOC(=O)c1nc2ccc(-c3ccc(F)c4ccoc43)cc2[n-]1 ZINC001244931881 1058074481 /nfs/dbraw/zinc/07/44/81/1058074481.db2.gz GCPMACGDCZEHEX-UHFFFAOYSA-N -1 1 324.311 4.292 20 0 DIADMM CCOC(=O)c1nc2cc(-c3ccc(F)c4ccoc43)ccc2[n-]1 ZINC001244931881 1058074486 /nfs/dbraw/zinc/07/44/86/1058074486.db2.gz GCPMACGDCZEHEX-UHFFFAOYSA-N -1 1 324.311 4.292 20 0 DIADMM CCOC(=O)c1nc2cc(-c3cc(C)c(C)cc3OC)ccc2[n-]1 ZINC001245022050 1058095416 /nfs/dbraw/zinc/09/54/16/1058095416.db2.gz OXGZCIDXFVBOLQ-UHFFFAOYSA-N -1 1 324.380 4.032 20 0 DIADMM CCOC(=O)c1nc2ccc(-c3cc(C)c(C)cc3OC)cc2[n-]1 ZINC001245022050 1058095420 /nfs/dbraw/zinc/09/54/20/1058095420.db2.gz OXGZCIDXFVBOLQ-UHFFFAOYSA-N -1 1 324.380 4.032 20 0 DIADMM [O-]c1ccc(Cl)cc1-c1nc(-c2ccncc2)nc2c1CCC2 ZINC001245049444 1058102350 /nfs/dbraw/zinc/10/23/50/1058102350.db2.gz JZDNBPHXJBPBDE-UHFFFAOYSA-N -1 1 323.783 4.053 20 0 DIADMM [O-]c1ccc(Cl)cc1-c1ccc2nc(C(F)(F)F)[nH]c2n1 ZINC001245048783 1058102406 /nfs/dbraw/zinc/10/24/06/1058102406.db2.gz AIGZNKZSFNKDPA-UHFFFAOYSA-N -1 1 313.666 4.003 20 0 DIADMM COc1cc2cnc(-c3cc(Cl)ccc3[O-])cc2cc1F ZINC001245050561 1058102489 /nfs/dbraw/zinc/10/24/89/1058102489.db2.gz IUDHVKUMHBOMMA-UHFFFAOYSA-N -1 1 303.720 4.409 20 0 DIADMM C[C@H](NC(=S)Nc1cc([O-])c(Cl)cc1F)c1ccccc1 ZINC001245514517 1058194083 /nfs/dbraw/zinc/19/40/83/1058194083.db2.gz GWHPBAZTIOFUQL-VIFPVBQESA-N -1 1 324.808 4.232 20 0 DIADMM CCOC(=O)c1nc2cc(-c3cc4cc(F)ccc4[nH]3)ccc2[n-]1 ZINC001245575761 1058243339 /nfs/dbraw/zinc/24/33/39/1058243339.db2.gz HVOAOXSIFQTDPC-UHFFFAOYSA-N -1 1 323.327 4.027 20 0 DIADMM CCOC(=O)c1nc2ccc(-c3cc4cc(F)ccc4[nH]3)cc2[n-]1 ZINC001245575761 1058243357 /nfs/dbraw/zinc/24/33/57/1058243357.db2.gz HVOAOXSIFQTDPC-UHFFFAOYSA-N -1 1 323.327 4.027 20 0 DIADMM Cc1noc(-c2ccccc2)c1[N-]C(=O)c1ccc(F)s1 ZINC001528154493 1058341474 /nfs/dbraw/zinc/34/14/74/1058341474.db2.gz TZVJUMQXVXQSRA-UHFFFAOYSA-N -1 1 302.330 4.103 20 0 DIADMM O=C(Nc1cc([O-])c(F)cc1F)[C@@H]1CC[C@H](c2ccccc2)C1 ZINC001552982778 1058459704 /nfs/dbraw/zinc/45/97/04/1058459704.db2.gz VXIOYSWTKXIRMX-QWHCGFSZSA-N -1 1 317.335 4.193 20 0 DIADMM [O-]c1ccc(F)c(-c2cccc(-c3ccccn3)n2)c1Cl ZINC001245827277 1058521502 /nfs/dbraw/zinc/52/15/02/1058521502.db2.gz JUMAXDBXUGOMSE-UHFFFAOYSA-N -1 1 300.720 4.309 20 0 DIADMM CCc1cc2c(ncnc2-c2c(F)ccc([O-])c2Cl)s1 ZINC001245828405 1058524117 /nfs/dbraw/zinc/52/41/17/1058524117.db2.gz UELNHXNRDJINJS-UHFFFAOYSA-N -1 1 308.765 4.419 20 0 DIADMM [O-]c1ccc(F)c(-c2ccc(F)c(C3OCCO3)c2)c1Cl ZINC001245831140 1058528585 /nfs/dbraw/zinc/52/85/85/1058528585.db2.gz GVDPGPHADMXHEA-UHFFFAOYSA-N -1 1 312.699 4.036 20 0 DIADMM Cn1cncc1-c1ccc(-c2c(F)ccc([O-])c2Cl)cc1 ZINC001245831111 1058528987 /nfs/dbraw/zinc/52/89/87/1058528987.db2.gz DKQPYEZGBLICOK-UHFFFAOYSA-N -1 1 302.736 4.252 20 0 DIADMM CC(C)(C)OC(=O)c1cccc(-c2c(F)ccc([O-])c2Cl)n1 ZINC001245830231 1058529131 /nfs/dbraw/zinc/52/91/31/1058529131.db2.gz JCLGWZGANAONBL-UHFFFAOYSA-N -1 1 323.751 4.202 20 0 DIADMM CCCN(CCC)c1cc(-c2c(F)ccc([O-])c2Cl)ncn1 ZINC001245830513 1058529761 /nfs/dbraw/zinc/52/97/61/1058529761.db2.gz OXPHMMCPVNCVFK-UHFFFAOYSA-N -1 1 323.799 4.268 20 0 DIADMM COC(=O)c1cc(C)c(-c2c(F)ccc([O-])c2Cl)c(C)c1 ZINC001245831100 1058530097 /nfs/dbraw/zinc/53/00/97/1058530097.db2.gz DBIANSURYDSKNR-UHFFFAOYSA-N -1 1 308.736 4.255 20 0 DIADMM COC(=O)c1cc(-c2c(F)ccc([O-])c2Cl)cc2[nH]ccc21 ZINC001245831201 1058530221 /nfs/dbraw/zinc/53/02/21/1058530221.db2.gz HYRCWJBLMDBYRH-UHFFFAOYSA-N -1 1 319.719 4.120 20 0 DIADMM [O-]c1ccc(F)c(-c2cnc(-c3ccccc3)nc2)c1Cl ZINC001245830952 1058530271 /nfs/dbraw/zinc/53/02/71/1058530271.db2.gz AUBWNRRQPBSQCE-UHFFFAOYSA-N -1 1 300.720 4.309 20 0 DIADMM CC1(C)C(=O)Nc2cccc(-c3c(F)ccc([O-])c3Cl)c21 ZINC001245832064 1058531277 /nfs/dbraw/zinc/53/12/77/1058531277.db2.gz SSNZCBCSWMZDDB-UHFFFAOYSA-N -1 1 305.736 4.081 20 0 DIADMM CCOC(=O)CCc1cccc(-c2c(F)ccc([O-])c2Cl)c1 ZINC001245831747 1058531404 /nfs/dbraw/zinc/53/14/04/1058531404.db2.gz OPHOEQBJGLYNPR-UHFFFAOYSA-N -1 1 322.763 4.347 20 0 DIADMM COC(=O)c1cc(-c2c(F)ccc([O-])c2Cl)c(C)cc1F ZINC001245831969 1058531728 /nfs/dbraw/zinc/53/17/28/1058531728.db2.gz GJORAYXFGGIMBB-UHFFFAOYSA-N -1 1 312.699 4.086 20 0 DIADMM [O-]c1ccc(F)c(-c2cncc(-c3ccncc3)c2)c1Cl ZINC001245832155 1058531803 /nfs/dbraw/zinc/53/18/03/1058531803.db2.gz NCUADORIFBKOIH-UHFFFAOYSA-N -1 1 300.720 4.309 20 0 DIADMM CC(=O)N1CCCc2ccc(-c3c(F)ccc([O-])c3Cl)cc21 ZINC001245832026 1058532249 /nfs/dbraw/zinc/53/22/49/1058532249.db2.gz GZGUEQFAEXATDC-UHFFFAOYSA-N -1 1 319.763 4.151 20 0 DIADMM CCOC(=O)c1ccc(-c2c(F)ccc([O-])c2Cl)c(C)c1 ZINC001245832613 1058532325 /nfs/dbraw/zinc/53/23/25/1058532325.db2.gz LTROPKFPBMTFSE-UHFFFAOYSA-N -1 1 308.736 4.337 20 0 DIADMM [O-]c1ccc(F)c(-c2ccc3c4c(ccnc24)CCO3)c1Cl ZINC001245831904 1058532366 /nfs/dbraw/zinc/53/23/66/1058532366.db2.gz PXGNPFADGNXVOX-UHFFFAOYSA-N -1 1 315.731 4.335 20 0 DIADMM COC(=O)c1c[nH]c2ccc(-c3c(F)ccc([O-])c3Cl)cc21 ZINC001245831301 1058532961 /nfs/dbraw/zinc/53/29/61/1058532961.db2.gz JAEUGVGXACVXGQ-UHFFFAOYSA-N -1 1 319.719 4.120 20 0 DIADMM COC(=O)c1cc2cc(-c3c(F)ccc([O-])c3Cl)ccc2[nH]1 ZINC001245831996 1058533035 /nfs/dbraw/zinc/53/30/35/1058533035.db2.gz GQUCHWGKIZUNDA-UHFFFAOYSA-N -1 1 319.719 4.120 20 0 DIADMM CC(C)(C)OC(=O)c1ccc(-c2c(F)ccc([O-])c2Cl)cn1 ZINC001245831828 1058533193 /nfs/dbraw/zinc/53/31/93/1058533193.db2.gz JXRNCGYULDWNIH-UHFFFAOYSA-N -1 1 323.751 4.202 20 0 DIADMM COc1ccc2ncc(-c3c(F)ccc([O-])c3Cl)cc2c1 ZINC001245832084 1058534051 /nfs/dbraw/zinc/53/40/51/1058534051.db2.gz LKNANHQTZGXWFN-UHFFFAOYSA-N -1 1 303.720 4.409 20 0 DIADMM COC(=O)c1c[nH]c2cc(-c3c(F)ccc([O-])c3Cl)ccc21 ZINC001245832473 1058534262 /nfs/dbraw/zinc/53/42/62/1058534262.db2.gz WPOIXJXCJSIWBI-UHFFFAOYSA-N -1 1 319.719 4.120 20 0 DIADMM COc1cc(C)c2ncnc(-c3c(F)ccc([O-])c3Cl)c2c1 ZINC001245831588 1058534778 /nfs/dbraw/zinc/53/47/78/1058534778.db2.gz BDTMDWBHZILMPX-UHFFFAOYSA-N -1 1 318.735 4.112 20 0 DIADMM CC(=O)N1CCCc2cc(-c3c(F)ccc([O-])c3Cl)ccc21 ZINC001245832875 1058535326 /nfs/dbraw/zinc/53/53/26/1058535326.db2.gz VCCDWOZADSOEHW-UHFFFAOYSA-N -1 1 319.763 4.151 20 0 DIADMM [O-]c1ccc(F)c(-c2ccc(F)c(-n3ccnc3)c2)c1Cl ZINC001245834566 1058539564 /nfs/dbraw/zinc/53/95/64/1058539564.db2.gz JZZCZIDEYFQPGX-UHFFFAOYSA-N -1 1 306.699 4.177 20 0 DIADMM [O-]c1ccc(F)c(-c2ccc3nnc(C4CCC4)n3c2)c1Cl ZINC001245834504 1058539700 /nfs/dbraw/zinc/53/97/00/1058539700.db2.gz JBDAITYVGKMLDD-UHFFFAOYSA-N -1 1 317.751 4.162 20 0 DIADMM CC1(C)Cc2c(cccc2-c2c(F)ccc([O-])c2Cl)NC1=O ZINC001245835173 1058540516 /nfs/dbraw/zinc/54/05/16/1058540516.db2.gz MJDKBKDNCFFBCL-UHFFFAOYSA-N -1 1 319.763 4.373 20 0 DIADMM CN(C)Cc1c(F)cc(-c2c(F)ccc([O-])c2Cl)cc1F ZINC001245836054 1058541233 /nfs/dbraw/zinc/54/12/33/1058541233.db2.gz WVNCXMFWJVRYDN-UHFFFAOYSA-N -1 1 315.722 4.192 20 0 DIADMM [O-]c1ccc(F)c(-c2ccnc(OCC3CCC3)c2)c1Cl ZINC001245835539 1058541358 /nfs/dbraw/zinc/54/13/58/1058541358.db2.gz RNLXQNLMEPBSCC-UHFFFAOYSA-N -1 1 307.752 4.426 20 0 DIADMM CC[C@@H]1Cc2ccccc2CN1C(=O)c1ccc(Cl)cc1[O-] ZINC001556111006 1058544399 /nfs/dbraw/zinc/54/43/99/1058544399.db2.gz KLKUIGHEUWABAU-OAHLLOKOSA-N -1 1 315.800 4.023 20 0 DIADMM CC(C)[C@@H](C(=O)Nc1ccc([O-])c(F)c1F)c1ccc(F)cc1 ZINC001556591927 1058617692 /nfs/dbraw/zinc/61/76/92/1058617692.db2.gz QAUICNMQTKTNKL-CQSZACIVSA-N -1 1 323.314 4.188 20 0 DIADMM O=c1cc(CC2CCCC2)[n-]n1-c1cccc2ccc(O)cc21 ZINC001245932459 1058634329 /nfs/dbraw/zinc/63/43/29/1058634329.db2.gz PJWOXTGMXDUYGT-UHFFFAOYSA-N -1 1 308.381 4.169 20 0 DIADMM CC1(C)[C@H](C(=O)Nc2cc([O-])c(F)cc2F)[C@H]1c1ccccc1 ZINC001556920226 1058670774 /nfs/dbraw/zinc/67/07/74/1058670774.db2.gz IIFOBTPKLIZLTQ-CVEARBPZSA-N -1 1 317.335 4.049 20 0 DIADMM Cc1ccc(N(CC(C)C)C(=O)c2cccc([O-])c2F)cc1 ZINC001557080013 1058694260 /nfs/dbraw/zinc/69/42/60/1058694260.db2.gz PRIKMOITNGHDGJ-UHFFFAOYSA-N -1 1 301.361 4.143 20 0 DIADMM O=C([N-]Oc1ccc(F)cc1)C1CCC(c2ccccc2)CC1 ZINC001557411993 1058745671 /nfs/dbraw/zinc/74/56/71/1058745671.db2.gz BIUYMCLKTKPHNW-UHFFFAOYSA-N -1 1 313.372 4.210 20 0 DIADMM CC[C@@H](C)c1cccc(NC(=O)c2c(F)ccc([O-])c2F)c1 ZINC001557559432 1058767412 /nfs/dbraw/zinc/76/74/12/1058767412.db2.gz BOPXTJOZPAKONJ-SNVBAGLBSA-N -1 1 305.324 4.436 20 0 DIADMM O=C(Nc1nc(C2CCCCC2)cs1)c1ccc([O-])cc1F ZINC001557942344 1058815324 /nfs/dbraw/zinc/81/53/24/1058815324.db2.gz UZFTZQCFUYAAJL-UHFFFAOYSA-N -1 1 320.389 4.288 20 0 DIADMM C[C@@]1(C2CCCCC2)CCN1C(=O)c1c([O-])cccc1Cl ZINC001558069705 1058832112 /nfs/dbraw/zinc/83/21/12/1058832112.db2.gz MEGBKVPYXDAOBV-KRWDZBQOSA-N -1 1 307.821 4.231 20 0 DIADMM CC(C)C[C@@H](C(=O)[N-]OCCCC(F)(F)F)c1ccccc1 ZINC001558056710 1058834434 /nfs/dbraw/zinc/83/44/34/1058834434.db2.gz PVDMDTJZVPPIRM-CQSZACIVSA-N -1 1 317.351 4.207 20 0 DIADMM CCCc1cc(C(=O)NCc2ccc([O-])c(Cl)c2)sc1C ZINC001558208827 1058852179 /nfs/dbraw/zinc/85/21/79/1058852179.db2.gz IWMXPQGPBAPSEV-UHFFFAOYSA-N -1 1 323.845 4.298 20 0 DIADMM C[C@H](C(=O)Nc1cc(F)c([O-])cc1Cl)[C@H](C)C(C)(C)C ZINC001558644261 1058896119 /nfs/dbraw/zinc/89/61/19/1058896119.db2.gz BZFZIEULZCPYFN-IUCAKERBSA-N -1 1 301.789 4.442 20 0 DIADMM [O-]c1ccc(CNc2cc(C3CC3)nc(C3CC3)n2)cc1Cl ZINC001559272336 1059135209 /nfs/dbraw/zinc/13/52/09/1059135209.db2.gz TYPSKDLASNKIQI-UHFFFAOYSA-N -1 1 315.804 4.203 20 0 DIADMM Cc1cccc(-c2noc(Cc3ccc([O-])c(Cl)c3)n2)c1F ZINC001247588286 1059566978 /nfs/dbraw/zinc/56/69/78/1059566978.db2.gz UUICUAQVCGOOFZ-UHFFFAOYSA-N -1 1 318.735 4.134 20 0 DIADMM CCc1cccc(C)c1NC(=S)Nc1c(F)cc([O-])cc1F ZINC001249565230 1060294789 /nfs/dbraw/zinc/29/47/89/1060294789.db2.gz OVNJOXRNIPMOKK-UHFFFAOYSA-N -1 1 322.380 4.350 20 0 DIADMM Cc1c(N)c(F)ccc1Nc1cc(Cl)cc(Cl)c1[O-] ZINC001249641072 1060325745 /nfs/dbraw/zinc/32/57/45/1060325745.db2.gz JFJJIUVDKUSBCM-UHFFFAOYSA-N -1 1 301.148 4.472 20 0 DIADMM Cc1cc(C)c(NC(=S)Nc2cc(F)c([O-])cc2F)c(C)c1 ZINC001249734656 1060379095 /nfs/dbraw/zinc/37/90/95/1060379095.db2.gz NYBDGVTUQOPOAD-UHFFFAOYSA-N -1 1 322.380 4.405 20 0 DIADMM Cc1cc(C)c(NC(=S)Nc2cc(F)cc(F)c2[O-])c(C)c1 ZINC001249737708 1060382167 /nfs/dbraw/zinc/38/21/67/1060382167.db2.gz YNJYRHQJXKZJPN-UHFFFAOYSA-N -1 1 322.380 4.405 20 0 DIADMM O=C1CCCCc2ccc(Nc3ccc([O-])c(F)c3F)cc21 ZINC001249893678 1060455678 /nfs/dbraw/zinc/45/56/78/1060455678.db2.gz OLIVKOXUNZCRHZ-UHFFFAOYSA-N -1 1 303.308 4.323 20 0 DIADMM Cc1ccnc2c(Nc3cc([O-])c(F)c(F)c3F)cccc12 ZINC001249964363 1060507841 /nfs/dbraw/zinc/50/78/41/1060507841.db2.gz BDVRYCWATBKUCM-UHFFFAOYSA-N -1 1 304.271 4.410 20 0 DIADMM O=C1CCCc2ccc(Nc3cc([O-])c(F)c(F)c3F)cc21 ZINC001249964046 1060508511 /nfs/dbraw/zinc/50/85/11/1060508511.db2.gz XEMQOTZWAOYEJS-UHFFFAOYSA-N -1 1 307.271 4.072 20 0 DIADMM Nc1cc(Cl)c(Cl)cc1Nc1cc([O-])c(F)c(F)c1F ZINC001249962889 1060508650 /nfs/dbraw/zinc/50/86/50/1060508650.db2.gz HTINUTMYTXIJIZ-UHFFFAOYSA-N -1 1 323.101 4.442 20 0 DIADMM [O-]c1cc(Nc2cc(F)c(F)cc2Cl)c(F)c(F)c1F ZINC001249964529 1060510272 /nfs/dbraw/zinc/51/02/72/1060510272.db2.gz FTHGNUFKTCAXFC-UHFFFAOYSA-N -1 1 309.621 4.485 20 0 DIADMM [O-]c1cc(Nc2cccc(C(F)(F)F)c2O)c(F)c(F)c1F ZINC001249966795 1060512601 /nfs/dbraw/zinc/51/26/01/1060512601.db2.gz MHIIAVZANPPBFW-UHFFFAOYSA-N -1 1 323.192 4.278 20 0 DIADMM [O-]c1cc(F)c(Nc2nc(Cl)cnc2Cl)cc1Cl ZINC001250020163 1060542567 /nfs/dbraw/zinc/54/25/67/1060542567.db2.gz NBBMXWGXRJSALV-UHFFFAOYSA-N -1 1 308.527 4.025 20 0 DIADMM Cc1nc(Cl)nc(Cl)c1Nc1cc(Cl)c([O-])cc1F ZINC001250020502 1060544626 /nfs/dbraw/zinc/54/46/26/1060544626.db2.gz MIKOZKXWXXSPEI-UHFFFAOYSA-N -1 1 322.554 4.334 20 0 DIADMM COc1ccc2cc(Nc3cc(Cl)c([O-])cc3F)cnc2c1 ZINC001250020146 1060545034 /nfs/dbraw/zinc/54/50/34/1060545034.db2.gz MJYNSYMOBDUPJR-UHFFFAOYSA-N -1 1 318.735 4.485 20 0 DIADMM COC(=O)c1cccc(Nc2cc(Cl)c([O-])cc2F)c1C ZINC001250021983 1060546452 /nfs/dbraw/zinc/54/64/52/1060546452.db2.gz AXZYSVBWFXQNLF-UHFFFAOYSA-N -1 1 309.724 4.023 20 0 DIADMM CC(C)c1nc2ccc(Nc3cc(Cl)c([O-])cc3F)cn2n1 ZINC001250022031 1060546689 /nfs/dbraw/zinc/54/66/89/1060546689.db2.gz DFWYSCNJSLXSNK-UHFFFAOYSA-N -1 1 320.755 4.094 20 0 DIADMM CC(=O)Nc1cc(Nc2cc(Cl)c([O-])cc2F)ccc1C ZINC001250022658 1060547743 /nfs/dbraw/zinc/54/77/43/1060547743.db2.gz RCXTYSDCSOZXCY-UHFFFAOYSA-N -1 1 308.740 4.195 20 0 DIADMM Cc1cnn(CC2CCC2)c1Nc1cc(Cl)c([O-])cc1F ZINC001250023718 1060548423 /nfs/dbraw/zinc/54/84/23/1060548423.db2.gz XNQZJFZZEDTCST-UHFFFAOYSA-N -1 1 309.772 4.233 20 0 DIADMM [O-]c1cc(F)c(Nc2ccccc2-n2ccnc2)cc1Cl ZINC001250022911 1060548492 /nfs/dbraw/zinc/54/84/92/1060548492.db2.gz YOMJLWYVSKZXQT-UHFFFAOYSA-N -1 1 303.724 4.114 20 0 DIADMM Nc1cc(F)cc(Cl)c1Nc1cc(Cl)c([O-])cc1F ZINC001250025663 1060550996 /nfs/dbraw/zinc/55/09/96/1060550996.db2.gz FLLJJKQXBXEHRI-UHFFFAOYSA-N -1 1 305.111 4.303 20 0 DIADMM COc1ccc(C(C)=O)c(Nc2cc(Cl)c([O-])cc2F)c1C ZINC001250024112 1060552153 /nfs/dbraw/zinc/55/21/53/1060552153.db2.gz RJTIZOYDYLVURB-UHFFFAOYSA-N -1 1 323.751 4.448 20 0 DIADMM Cc1cc(=O)[nH]c2cc(Nc3cc(Cl)c([O-])cc3F)ccc12 ZINC001250025571 1060552784 /nfs/dbraw/zinc/55/27/84/1060552784.db2.gz DFKSFKCZUUCJLH-UHFFFAOYSA-N -1 1 318.735 4.491 20 0 DIADMM COc1cc(Nc2cc(Cl)c([O-])cc2F)cc2cccnc21 ZINC001250026701 1060554773 /nfs/dbraw/zinc/55/47/73/1060554773.db2.gz STFJPBSHHAVTCF-UHFFFAOYSA-N -1 1 318.735 4.485 20 0 DIADMM CC1(c2ccc(Nc3cc(Cl)c([O-])cc3F)cc2)COC1 ZINC001250029232 1060558008 /nfs/dbraw/zinc/55/80/08/1060558008.db2.gz CXPUVJXFPJIPCP-UHFFFAOYSA-N -1 1 307.752 4.216 20 0 DIADMM O=c1oc2cc([O-])ccc2cc1Nc1c(F)ccc(Cl)c1F ZINC001250090470 1060599426 /nfs/dbraw/zinc/59/94/26/1060599426.db2.gz OPNQRADXYVUXBH-UHFFFAOYSA-N -1 1 323.682 4.174 20 0 DIADMM COc1c(Cl)ccc(F)c1Nc1cc(F)c([O-])c(F)c1 ZINC001250105870 1060613404 /nfs/dbraw/zinc/61/34/04/1060613404.db2.gz NCOOCIDOSUGXLM-UHFFFAOYSA-N -1 1 303.667 4.215 20 0 DIADMM Cc1cc(F)c([N-]c2noc3nccnc23)c(Cl)c1Cl ZINC001250106541 1060614331 /nfs/dbraw/zinc/61/43/31/1060614331.db2.gz DMRBWBNLPYQGQP-UHFFFAOYSA-N -1 1 313.119 4.116 20 0 DIADMM COc1c(F)c(Cl)ccc1Nc1ccc(F)c(F)c1[O-] ZINC001250194761 1060673309 /nfs/dbraw/zinc/67/33/09/1060673309.db2.gz CMSNBZHMRIJBHD-UHFFFAOYSA-N -1 1 303.667 4.215 20 0 DIADMM [O-]c1ccc(F)c(Nc2cccc(Br)n2)c1Cl ZINC001250228096 1060706191 /nfs/dbraw/zinc/70/61/91/1060706191.db2.gz KYFFWZRBSBNIMO-UHFFFAOYSA-N -1 1 317.545 4.086 20 0 DIADMM COc1cccc2cc(Nc3c(F)ccc([O-])c3Cl)cnc21 ZINC001250229817 1060707376 /nfs/dbraw/zinc/70/73/76/1060707376.db2.gz OPRCLTHUUNTPEA-UHFFFAOYSA-N -1 1 318.735 4.485 20 0 DIADMM O=c1[nH]cc(Nc2c(F)ccc([O-])c2Cl)c2ccccc12 ZINC001250228520 1060707425 /nfs/dbraw/zinc/70/74/25/1060707425.db2.gz DVNISQAQMJVKON-UHFFFAOYSA-N -1 1 304.708 4.182 20 0 DIADMM [O-]c1ccc(F)c(Nc2nc3c(cccc3O)s2)c1Cl ZINC001250228255 1060708086 /nfs/dbraw/zinc/70/80/86/1060708086.db2.gz SYARHFCBSLKDNL-UHFFFAOYSA-N -1 1 310.737 4.244 20 0 DIADMM Cc1nn(C)c2ccc(Nc3c(F)ccc([O-])c3Cl)cc12 ZINC001250232491 1060710819 /nfs/dbraw/zinc/71/08/19/1060710819.db2.gz NZXACEDYRPYJSA-UHFFFAOYSA-N -1 1 305.740 4.123 20 0 DIADMM Cc1cc2c(cccc2Nc2c(F)ccc([O-])c2Cl)nn1 ZINC001250232765 1060711715 /nfs/dbraw/zinc/71/17/15/1060711715.db2.gz CHCBDIAERHXVMW-UHFFFAOYSA-N -1 1 303.724 4.180 20 0 DIADMM [O-]c1ccc(F)c(Nc2cn3c(cccc3Cl)n2)c1Cl ZINC001250233678 1060713786 /nfs/dbraw/zinc/71/37/86/1060713786.db2.gz BKZVIUVMACPCRX-UHFFFAOYSA-N -1 1 312.131 4.229 20 0 DIADMM O=c1ccc2cccc(Nc3c(F)ccc([O-])c3Cl)c2[nH]1 ZINC001250237905 1060719001 /nfs/dbraw/zinc/71/90/01/1060719001.db2.gz RHFJQLJDQNFTGS-UHFFFAOYSA-N -1 1 304.708 4.182 20 0 DIADMM COc1ccc2cccnc2c1Nc1c(F)ccc([O-])c1Cl ZINC001250237467 1060719361 /nfs/dbraw/zinc/71/93/61/1060719361.db2.gz IZXZCPOBLDHNRJ-UHFFFAOYSA-N -1 1 318.735 4.485 20 0 DIADMM O=C([O-])c1ccc(-c2nc3cc(F)cc(C(F)(F)F)c3[nH]2)cc1 ZINC001250479309 1060835982 /nfs/dbraw/zinc/83/59/82/1060835982.db2.gz GYSMAAUPKYPCGL-UHFFFAOYSA-N -1 1 324.233 4.086 20 0 DIADMM CCOc1ccc2nc(-c3c([O-])cccc3F)n(C3CC3)c2c1 ZINC001250674338 1061006143 /nfs/dbraw/zinc/00/61/43/1061006143.db2.gz OOVIGEDJFWONPA-UHFFFAOYSA-N -1 1 312.344 4.282 20 0 DIADMM CCn1c2ccccc2nc1-c1cccc([O-])c1Br ZINC001250881003 1061107360 /nfs/dbraw/zinc/10/73/60/1061107360.db2.gz PVERHDPVBWBMTJ-UHFFFAOYSA-N -1 1 317.186 4.191 20 0 DIADMM Cc1cc2nc(-c3ccccc3C(=O)[O-])[nH]c2cc1C(F)(F)F ZINC001250879577 1061107502 /nfs/dbraw/zinc/10/75/02/1061107502.db2.gz OGCNWTNQWYRUHV-UHFFFAOYSA-N -1 1 320.270 4.255 20 0 DIADMM Cc1cc(F)cc2nc(-c3cccc([O-])c3Br)[nH]c21 ZINC001250880955 1061107522 /nfs/dbraw/zinc/10/75/22/1061107522.db2.gz NPWUIDMKEIKJIJ-UHFFFAOYSA-N -1 1 321.149 4.146 20 0 DIADMM [O-]c1ccc(CNc2ccc3c(c2)[C@@H](O)CCCC3)c(F)c1F ZINC001462413841 1061157964 /nfs/dbraw/zinc/15/79/64/1061157964.db2.gz LNUXSVYMBABSDF-HNNXBMFYSA-N -1 1 319.351 4.042 20 0 DIADMM Cc1cccc2nc(-c3cc(Br)c(F)cc3[O-])[nH]c21 ZINC001251001588 1061175595 /nfs/dbraw/zinc/17/55/95/1061175595.db2.gz TXPZDOKPIMSULB-UHFFFAOYSA-N -1 1 321.149 4.146 20 0 DIADMM CCCSc1ccc2nc(-c3sccc3C(=O)[O-])[nH]c2c1 ZINC001251009615 1061180788 /nfs/dbraw/zinc/18/07/88/1061180788.db2.gz PUKINQUHPJTMBZ-UHFFFAOYSA-N -1 1 318.423 4.492 20 0 DIADMM [O-]c1ccc(CNCc2csc(C(F)(F)F)c2)c(F)c1F ZINC001462484840 1061205064 /nfs/dbraw/zinc/20/50/64/1061205064.db2.gz MCMYHNYXNUIGKL-UHFFFAOYSA-N -1 1 323.286 4.041 20 0 DIADMM O=C(NC(C1CCCCC1)C1CCCCC1)c1cncc([O-])c1 ZINC001455176568 1061212489 /nfs/dbraw/zinc/21/24/89/1061212489.db2.gz IQTMSIPXRIERHT-UHFFFAOYSA-N -1 1 316.445 4.046 20 0 DIADMM CC(C)(C)c1ccc(NC(=O)c2ccc([O-])cc2F)cc1F ZINC001455294962 1061220146 /nfs/dbraw/zinc/22/01/46/1061220146.db2.gz ZSQSKSOXUNUGNI-UHFFFAOYSA-N -1 1 305.324 4.220 20 0 DIADMM O=C(Nc1ccc2c(n1)CCCC2)c1cc2ccccc2cc1[O-] ZINC001455475006 1061225679 /nfs/dbraw/zinc/22/56/79/1061225679.db2.gz FHKUBKPTLMNHTP-UHFFFAOYSA-N -1 1 318.376 4.072 20 0 DIADMM O=S(=O)([N-]c1cccc2cccc(Cl)c21)c1ccccc1 ZINC001251155226 1061251581 /nfs/dbraw/zinc/25/15/81/1061251581.db2.gz UQFJBNVCUPXELV-UHFFFAOYSA-N -1 1 317.797 4.294 20 0 DIADMM Cc1ccc2nc(-c3cc(F)c([O-])c(Br)c3)[nH]c2c1 ZINC001251168883 1061258042 /nfs/dbraw/zinc/25/80/42/1061258042.db2.gz RWHSVMKXLPCUHO-UHFFFAOYSA-N -1 1 321.149 4.146 20 0 DIADMM Cn1c2ccc3ncccc3c2nc1-c1cccc([O-])c1Cl ZINC001251203232 1061268452 /nfs/dbraw/zinc/26/84/52/1061268452.db2.gz GIKOUIIXXRYNAP-UHFFFAOYSA-N -1 1 309.756 4.148 20 0 DIADMM CCOc1ccc2nc(-c3cccc([O-])c3Cl)n(CC)c2c1 ZINC001251203139 1061268520 /nfs/dbraw/zinc/26/85/20/1061268520.db2.gz APFVPLNPDUFNBT-UHFFFAOYSA-N -1 1 316.788 4.481 20 0 DIADMM [O-]c1c(F)ccc(-c2nc3ccc(-c4ccncc4)cc3[nH]2)c1F ZINC001251235404 1061282381 /nfs/dbraw/zinc/28/23/81/1061282381.db2.gz YSDXVAPJSRJSRQ-UHFFFAOYSA-N -1 1 323.302 4.276 20 0 DIADMM CCOc1cccc2[nH]c(-c3cccc(C(F)(F)F)c3[O-])nc21 ZINC001251341122 1061324542 /nfs/dbraw/zinc/32/45/42/1061324542.db2.gz MRTIURSJDRRQLU-UHFFFAOYSA-N -1 1 322.286 4.353 20 0 DIADMM Cc1cc(Br)c([O-])c(-c2nc3cc(F)ccc3[nH]2)c1 ZINC001251470375 1061368873 /nfs/dbraw/zinc/36/88/73/1061368873.db2.gz REHLVEYSVLPRIK-UHFFFAOYSA-N -1 1 321.149 4.146 20 0 DIADMM COc1cc([O-])c(-c2nc3ccccc3n2C2CC2)c(Cl)c1 ZINC001251491306 1061376657 /nfs/dbraw/zinc/37/66/57/1061376657.db2.gz OFMBWHMIQQBRPQ-UHFFFAOYSA-N -1 1 314.772 4.406 20 0 DIADMM COc1ccc(-c2nc3ccc(C)c(C)c3[nH]2)c([O-])c1Cl ZINC001251491505 1061379435 /nfs/dbraw/zinc/37/94/35/1061379435.db2.gz ZJYWLSNQSJXEGC-UHFFFAOYSA-N -1 1 302.761 4.214 20 0 DIADMM Cn1c2ccc(F)cc2nc1-c1c([O-])ccc(Cl)c1Cl ZINC001251532042 1061392216 /nfs/dbraw/zinc/39/22/16/1061392216.db2.gz VTAFQJBKNCYUAS-UHFFFAOYSA-N -1 1 311.143 4.392 20 0 DIADMM COc1cccc2c1nc(-c1c([O-])ccc(Cl)c1Cl)n2C ZINC001251532030 1061392277 /nfs/dbraw/zinc/39/22/77/1061392277.db2.gz VDHMSYZIXAGGAH-UHFFFAOYSA-N -1 1 323.179 4.261 20 0 DIADMM Cn1c(-c2c([O-])ccc(Cl)c2Cl)nc2cccc(F)c21 ZINC001251536492 1061394360 /nfs/dbraw/zinc/39/43/60/1061394360.db2.gz LKQDQTHKPRAKDW-UHFFFAOYSA-N -1 1 311.143 4.392 20 0 DIADMM CCn1c2ccc(F)cc2nc1-c1c([O-])ccc(F)c1Cl ZINC001251540696 1061397744 /nfs/dbraw/zinc/39/77/44/1061397744.db2.gz MYIJKIONODSBTK-UHFFFAOYSA-N -1 1 308.715 4.360 20 0 DIADMM CCOc1ccc2nc(-c3cc(Cl)c([O-])cc3F)[nH]c2c1 ZINC001251710984 1061453736 /nfs/dbraw/zinc/45/37/36/1061453736.db2.gz WAPAFRACODGUNR-UHFFFAOYSA-N -1 1 306.724 4.127 20 0 DIADMM O=S(=O)([N-]c1cc2cccccc-2c1)c1ccc(Cl)cc1 ZINC001251712469 1061454207 /nfs/dbraw/zinc/45/42/07/1061454207.db2.gz OVUNNGOLAPBASN-UHFFFAOYSA-N -1 1 317.797 4.246 20 0 DIADMM Cc1cc(C(=O)[O-])ccc1-c1nc2ccc(Cl)c(C)c2[nH]1 ZINC001251710490 1061454404 /nfs/dbraw/zinc/45/44/04/1061454404.db2.gz FUPYKWATKIFMEQ-UHFFFAOYSA-N -1 1 300.745 4.198 20 0 DIADMM Cc1ccc2[nH]c(-c3c(Br)ccc([O-])c3F)nc2c1 ZINC001251729844 1061460999 /nfs/dbraw/zinc/46/09/99/1061460999.db2.gz UHCMMEMEVHOJGD-UHFFFAOYSA-N -1 1 321.149 4.146 20 0 DIADMM Cc1ccc2nc(-c3c(Br)ccc([O-])c3F)[nH]c2c1 ZINC001251729844 1061461008 /nfs/dbraw/zinc/46/10/08/1061461008.db2.gz UHCMMEMEVHOJGD-UHFFFAOYSA-N -1 1 321.149 4.146 20 0 DIADMM O=C(CCCc1ccc(C2CC2)cc1)Nc1ccc(F)cc1[O-] ZINC001457715330 1061487591 /nfs/dbraw/zinc/48/75/91/1061487591.db2.gz MAHOAVUJIYBDGF-UHFFFAOYSA-N -1 1 313.372 4.370 20 0 DIADMM CC[C@@H](CC(=O)Nc1nc(Cl)ccc1[O-])c1ccc(C)cc1 ZINC001457763925 1061496501 /nfs/dbraw/zinc/49/65/01/1061496501.db2.gz OYJJPQDNPZSQNY-LBPRGKRZSA-N -1 1 318.804 4.271 20 0 DIADMM CC[C@H](CC(=O)Nc1nc(Cl)ccc1[O-])c1ccc(C)cc1 ZINC001457763920 1061497203 /nfs/dbraw/zinc/49/72/03/1061497203.db2.gz OYJJPQDNPZSQNY-GFCCVEGCSA-N -1 1 318.804 4.271 20 0 DIADMM C[C@H](CCCc1ccccc1)C(=O)Nc1nc(Cl)ccc1[O-] ZINC001457763861 1061497401 /nfs/dbraw/zinc/49/74/01/1061497401.db2.gz ORBZTOCYBGRASS-GFCCVEGCSA-N -1 1 318.804 4.038 20 0 DIADMM O=C(Nc1ccccc1-c1ccccc1)c1cccc([O-])c1F ZINC001463760981 1061517359 /nfs/dbraw/zinc/51/73/59/1061517359.db2.gz BYGPRIFCQAIIBL-UHFFFAOYSA-N -1 1 307.324 4.451 20 0 DIADMM O=C(NCC1(c2ccccc2)CC1)c1cc2ccccc2cc1[O-] ZINC001463869982 1061528631 /nfs/dbraw/zinc/52/86/31/1061528631.db2.gz HKPZUGDDFOIBEV-UHFFFAOYSA-N -1 1 317.388 4.007 20 0 DIADMM CC[C@H](C)[C@H](C)N(C(=O)Cc1ccc([O-])c(Cl)c1)C1CC1 ZINC001464993572 1061660728 /nfs/dbraw/zinc/66/07/28/1061660728.db2.gz VESFYQWYLXFMAV-RYUDHWBXSA-N -1 1 309.837 4.014 20 0 DIADMM O=C(Nc1cc(C2CCCC2)[nH]n1)c1ccc2ccccc2c1[O-] ZINC001465370302 1061741759 /nfs/dbraw/zinc/74/17/59/1061741759.db2.gz WPAJFUGUIXOECB-UHFFFAOYSA-N -1 1 321.380 4.178 20 0 DIADMM CC(C)c1ccc(N(C)C(=O)Cc2ccc([O-])c(Cl)c2)cc1 ZINC001465827516 1061818626 /nfs/dbraw/zinc/81/86/26/1061818626.db2.gz OBHOIUNQWJPZIJ-UHFFFAOYSA-N -1 1 317.816 4.375 20 0 DIADMM COc1cccc(-c2nnc(-c3ccc4ccccc4c3[O-])o2)c1 ZINC001253260263 1061863004 /nfs/dbraw/zinc/86/30/04/1061863004.db2.gz OMQVPRQYASGGOY-UHFFFAOYSA-N -1 1 318.332 4.271 20 0 DIADMM Cc1cccc(-c2nnc(-c3ccc4ccc(C)nc4c3[O-])o2)c1 ZINC001253637264 1061945165 /nfs/dbraw/zinc/94/51/65/1061945165.db2.gz HOGHZMAMJGBFMG-UHFFFAOYSA-N -1 1 317.348 4.274 20 0 DIADMM CSc1cccc(NC(=O)Cc2ccc([O-])c(Cl)c2)c1C ZINC001466478014 1061950440 /nfs/dbraw/zinc/95/04/40/1061950440.db2.gz PZJSEQDLHNKSPZ-UHFFFAOYSA-N -1 1 321.829 4.257 20 0 DIADMM [O-]c1ccc(Cc2nnc(-c3cccc(Cl)c3)o2)cc1Cl ZINC001253728325 1061962184 /nfs/dbraw/zinc/96/21/84/1061962184.db2.gz PYFQFPNIMRZBBI-UHFFFAOYSA-N -1 1 321.163 4.340 20 0 DIADMM O=C(CSc1nc2cccc(F)c2s1)c1ccc([O-])cc1 ZINC001459246704 1062052100 /nfs/dbraw/zinc/05/21/00/1062052100.db2.gz YTTMQTYTQWVHDH-UHFFFAOYSA-N -1 1 319.382 4.116 20 0 DIADMM Cc1ccccc1S(=O)(=O)[N-]c1c(C)ccc2ccccc21 ZINC001254497662 1062143741 /nfs/dbraw/zinc/14/37/41/1062143741.db2.gz JCNBVTJSORROKI-UHFFFAOYSA-N -1 1 311.406 4.257 20 0 DIADMM COc1cc(NC(=O)c2ccc(C(C)C)cc2[O-])ccc1Cl ZINC001467588621 1062147816 /nfs/dbraw/zinc/14/78/16/1062147816.db2.gz PXVZDVVQSUYRHI-UHFFFAOYSA-N -1 1 319.788 4.430 20 0 DIADMM Cc1ccccc1S(=O)(=O)[N-]c1cc2ccccc2cc1C ZINC001254618861 1062201655 /nfs/dbraw/zinc/20/16/55/1062201655.db2.gz LRIZBZHSPLUQIZ-UHFFFAOYSA-N -1 1 311.406 4.257 20 0 DIADMM Cc1ccccc1S(=O)(=O)[N-]c1cccc2cccc(C)c21 ZINC001254626285 1062206639 /nfs/dbraw/zinc/20/66/39/1062206639.db2.gz REISTMHAVDWFFX-UHFFFAOYSA-N -1 1 311.406 4.257 20 0 DIADMM O=C(Nc1ccc([O-])c(F)c1F)c1cscc1C(F)(F)F ZINC001468003685 1062248089 /nfs/dbraw/zinc/24/80/89/1062248089.db2.gz OKKAZEDSGWLBGS-UHFFFAOYSA-N -1 1 323.242 4.003 20 0 DIADMM Cc1ccc(C)c(S(=O)(=O)[N-]c2ccc3sccc3c2)c1 ZINC001254794531 1062250678 /nfs/dbraw/zinc/25/06/78/1062250678.db2.gz TYXRGEYIBYCJRW-UHFFFAOYSA-N -1 1 317.435 4.319 20 0 DIADMM Cc1ccc(C)c(S(=O)(=O)[N-]c2ccccc2CC(C)C)c1 ZINC001254794045 1062250767 /nfs/dbraw/zinc/25/07/67/1062250767.db2.gz LAZSLYWVGGXDLA-UHFFFAOYSA-N -1 1 317.454 4.303 20 0 DIADMM CC(C)c1ccc(-c2nnc(-c3cc([O-])cnc3Cl)o2)cc1 ZINC001254878232 1062273542 /nfs/dbraw/zinc/27/35/42/1062273542.db2.gz HFKGOPJRCCOKIW-UHFFFAOYSA-N -1 1 315.760 4.281 20 0 DIADMM Cc1cnc(C(=O)NCc2ccc(C3CCCCC3)cc2)c([O-])c1 ZINC001468351763 1062306025 /nfs/dbraw/zinc/30/60/25/1062306025.db2.gz SGJCPCONNXUKCW-UHFFFAOYSA-N -1 1 324.424 4.073 20 0 DIADMM COc1cccc([O-])c1-c1nnc(-c2ccc(Cl)cc2C)o1 ZINC001255272821 1062370809 /nfs/dbraw/zinc/37/08/09/1062370809.db2.gz GURVGOQGVWBKIN-UHFFFAOYSA-N -1 1 316.744 4.080 20 0 DIADMM CCC[C@@H](C(=O)Nc1cc([O-])c(F)cc1F)c1ccccc1 ZINC001468746047 1062392512 /nfs/dbraw/zinc/39/25/12/1062392512.db2.gz ZIQCAPJBVXCBPZ-GFCCVEGCSA-N -1 1 305.324 4.193 20 0 DIADMM Cc1cc(Cl)ccc1-c1nnc(-c2ccc([O-])cc2F)o1 ZINC001255347005 1062412333 /nfs/dbraw/zinc/41/23/33/1062412333.db2.gz UCVORVCZPBCLIE-UHFFFAOYSA-N -1 1 304.708 4.210 20 0 DIADMM Cc1cc(Cl)ccc1-c1nnc(-c2c(F)ccc([O-])c2F)o1 ZINC001255356049 1062414770 /nfs/dbraw/zinc/41/47/70/1062414770.db2.gz PVJCRPYASJKINC-UHFFFAOYSA-N -1 1 322.698 4.349 20 0 DIADMM CCCC[C@H](CCC)[N-]S(=O)(=O)c1cc(Cl)ccc1F ZINC001475052414 1062490524 /nfs/dbraw/zinc/49/05/24/1062490524.db2.gz MOKMBDQQDOMTRF-LBPRGKRZSA-N -1 1 321.845 4.116 20 0 DIADMM Cc1ccc(C2(NC(=O)c3ccc(Cl)cc3[O-])CCC2)cc1 ZINC001469800311 1062631447 /nfs/dbraw/zinc/63/14/47/1062631447.db2.gz SPDZGJYKUBVDTN-UHFFFAOYSA-N -1 1 315.800 4.163 20 0 DIADMM COc1cccc(NC(=O)c2cc3ccccc3cc2[O-])c1C ZINC001470122975 1062708788 /nfs/dbraw/zinc/70/87/88/1062708788.db2.gz LEBKKKDIIMQWNZ-UHFFFAOYSA-N -1 1 307.349 4.115 20 0 DIADMM CCCCCc1nnc(-c2cc(C(F)(F)F)ccc2[O-])o1 ZINC001256137535 1062724630 /nfs/dbraw/zinc/72/46/30/1062724630.db2.gz ZATYKRRPHYYURD-UHFFFAOYSA-N -1 1 300.280 4.194 20 0 DIADMM Cc1ccc(-c2nnc(-c3cccc([O-])c3Cl)o2)cc1C ZINC001256599678 1062908505 /nfs/dbraw/zinc/90/85/05/1062908505.db2.gz YQFVOVZGQSVFQI-UHFFFAOYSA-N -1 1 300.745 4.379 20 0 DIADMM Cc1ccc(C(=O)Nc2cccc(F)c2[O-])c(Cl)c1Cl ZINC001471167357 1062931084 /nfs/dbraw/zinc/93/10/84/1062931084.db2.gz ADVBEPYBSAIUHT-UHFFFAOYSA-N -1 1 314.143 4.399 20 0 DIADMM Cc1ccc2c(CC(=O)Nc3cccc(F)c3[O-])coc2c1C ZINC001471166211 1062933422 /nfs/dbraw/zinc/93/34/22/1062933422.db2.gz DASCSCUBOCZGEQ-UHFFFAOYSA-N -1 1 313.328 4.076 20 0 DIADMM O=S(=O)([N-]c1cc2cccccc-2c1)c1cccc(Cl)c1 ZINC001256723079 1062952606 /nfs/dbraw/zinc/95/26/06/1062952606.db2.gz UTLICVSGFUUTAJ-UHFFFAOYSA-N -1 1 317.797 4.246 20 0 DIADMM CCOc1ccc(-c2nnc(CCC3CCCCC3)o2)c([O-])c1 ZINC001256788600 1062979304 /nfs/dbraw/zinc/97/93/04/1062979304.db2.gz UDDKLONPIMYIEZ-UHFFFAOYSA-N -1 1 316.401 4.354 20 0 DIADMM Cc1cccc(C2CC2)c1[N-]S(=O)(=O)c1cccc(Cl)c1 ZINC001256811714 1062994659 /nfs/dbraw/zinc/99/46/59/1062994659.db2.gz RRDKFOJGGXEJPF-UHFFFAOYSA-N -1 1 321.829 4.327 20 0 DIADMM CC(C)(NC(=O)c1cc2ccccc2cc1[O-])c1ccc(F)cc1 ZINC001471890281 1063030135 /nfs/dbraw/zinc/03/01/35/1063030135.db2.gz BSYPVSKUGWEFOM-UHFFFAOYSA-N -1 1 323.367 4.350 20 0 DIADMM CC(C)c1ccc(NC(=O)c2ccc(C(F)(F)F)c([O-])c2)cn1 ZINC001471997401 1063039605 /nfs/dbraw/zinc/03/96/05/1063039605.db2.gz DNIKCUMTOFPOLF-UHFFFAOYSA-N -1 1 324.302 4.182 20 0 DIADMM O=C(NC(C1CCCC1)C1CCCC1)c1cccc([O-])c1F ZINC001471998386 1063040209 /nfs/dbraw/zinc/04/02/09/1063040209.db2.gz QHUBCFWIZMYXSO-UHFFFAOYSA-N -1 1 305.393 4.010 20 0 DIADMM CC(C)Oc1ccc(-c2nnc(-c3cccc([O-])c3F)o2)cc1 ZINC001256920895 1063053317 /nfs/dbraw/zinc/05/33/17/1063053317.db2.gz AHTWZLDRWDHJMD-UHFFFAOYSA-N -1 1 314.316 4.036 20 0 DIADMM CC(C)=C[C@@H]1[C@H](C(=O)Nc2cc(F)c([O-])cc2Cl)C1(C)C ZINC001472193256 1063056205 /nfs/dbraw/zinc/05/62/05/1063056205.db2.gz RXODYLVMQFMIJY-YMTOWFKASA-N -1 1 311.784 4.362 20 0 DIADMM Cc1cccc(S(=O)(=O)[N-]c2c(C)cc(Cl)cc2C)c1 ZINC001256953650 1063057912 /nfs/dbraw/zinc/05/79/12/1063057912.db2.gz FWYYYIFJDQVUQJ-UHFFFAOYSA-N -1 1 309.818 4.066 20 0 DIADMM C/C(=C\C(=O)Nc1cc(F)c([O-])cc1Cl)c1ccc(F)cc1 ZINC001472193118 1063058073 /nfs/dbraw/zinc/05/80/73/1063058073.db2.gz LZFJQKUPJIFZJJ-RMKNXTFCSA-N -1 1 323.726 4.366 20 0 DIADMM [O-]c1c(-c2nnc(CC3CCCCC3)o2)ccc2cccnc21 ZINC001257004364 1063075446 /nfs/dbraw/zinc/07/54/46/1063075446.db2.gz LFXCAOYQCITDSC-UHFFFAOYSA-N -1 1 309.369 4.113 20 0 DIADMM CC(C)C1CCC(NC(=O)NCc2ccc([O-])c(Cl)c2)CC1 ZINC001478150091 1063089892 /nfs/dbraw/zinc/08/98/92/1063089892.db2.gz KQDRWPOVTZVGFN-UHFFFAOYSA-N -1 1 324.852 4.060 20 0 DIADMM CC(C)c1ccc(C(=O)Nc2nc(-c3ccccc3)co2)c([O-])c1 ZINC001472560381 1063103860 /nfs/dbraw/zinc/10/38/60/1063103860.db2.gz FNCWCDYZZATFFA-UHFFFAOYSA-N -1 1 322.364 4.423 20 0 DIADMM Cc1ccc([C@@H]2C[C@H]2c2nnc(-c3ccc(F)c([O-])c3)o2)cc1 ZINC001257323821 1063205661 /nfs/dbraw/zinc/20/56/61/1063205661.db2.gz JGWLXRMLXWVXHJ-UONOGXRCSA-N -1 1 310.328 4.161 20 0 DIADMM Cc1ccc([C@H]2C[C@H]2c2nnc(-c3ccc([O-])c(F)c3)o2)cc1 ZINC001257323266 1063207871 /nfs/dbraw/zinc/20/78/71/1063207871.db2.gz GUPUUWAZBRRMLA-ZIAGYGMSSA-N -1 1 310.328 4.161 20 0 DIADMM CCCc1cc(=O)[n-]c(SCc2ccc(OC)c(Cl)c2)n1 ZINC001472924509 1063317800 /nfs/dbraw/zinc/31/78/00/1063317800.db2.gz VQFUIBMLFROJFF-UHFFFAOYSA-N -1 1 324.833 4.089 20 0 DIADMM CC[C@H](NC(=O)c1ccc(Cl)cc1[O-])c1ccc(C)c(F)c1 ZINC001546307800 1063523652 /nfs/dbraw/zinc/52/36/52/1063523652.db2.gz HEEWDFLKGMKBLG-HNNXBMFYSA-N -1 1 321.779 4.374 20 0 DIADMM Cc1ccc2ccc(-c3nnc(CC4CCCC4)o3)c([O-])c2n1 ZINC001258627765 1063714979 /nfs/dbraw/zinc/71/49/79/1063714979.db2.gz JYSLQJUEZYHBCP-UHFFFAOYSA-N -1 1 309.369 4.032 20 0 DIADMM CC[C@H](Cc1ccccc1)Nc1c(C)c(=O)[n-]n1-c1ccccc1 ZINC001258843606 1063864322 /nfs/dbraw/zinc/86/43/22/1063864322.db2.gz GRIHQXGBVLYHAD-QGZVFWFLSA-N -1 1 321.424 4.320 20 0 DIADMM CCOc1ccc(NC(=O)c2ccc(C(C)C)cc2[O-])c(F)c1 ZINC001299538298 1063869894 /nfs/dbraw/zinc/86/98/94/1063869894.db2.gz KYUBHLRSOAZEKZ-UHFFFAOYSA-N -1 1 317.360 4.306 20 0 DIADMM CCc1cc([N-]S(=O)(=O)c2cc(F)ccc2C)c(C)cc1C ZINC001258927481 1063880319 /nfs/dbraw/zinc/88/03/19/1063880319.db2.gz CSLSQXHPRLHYCW-UHFFFAOYSA-N -1 1 321.417 4.114 20 0 DIADMM Cc1ccc(F)cc1S(=O)(=O)[N-]c1ccccc1CC(C)C ZINC001258926518 1063880782 /nfs/dbraw/zinc/88/07/82/1063880782.db2.gz CJJUWFJCLPDAGS-UHFFFAOYSA-N -1 1 321.417 4.133 20 0 DIADMM Cc1ccc(S(=O)(=O)[N-]c2cccc3sccc32)c(C)c1 ZINC001259101640 1063883177 /nfs/dbraw/zinc/88/31/77/1063883177.db2.gz PMEFCEHGFTZLGP-UHFFFAOYSA-N -1 1 317.435 4.319 20 0 DIADMM CC[C@H](C)c1ccccc1[N-]S(=O)(=O)c1cccc(OC)c1 ZINC001259182948 1063885657 /nfs/dbraw/zinc/88/56/57/1063885657.db2.gz XULBYDQLFUUUDD-ZDUSSCGKSA-N -1 1 319.426 4.010 20 0 DIADMM Cc1cc(C)cc(S(=O)(=O)[N-]c2ccc(F)cc2C(C)C)c1 ZINC001259524348 1063889234 /nfs/dbraw/zinc/88/92/34/1063889234.db2.gz NROVVXBULNVKFS-UHFFFAOYSA-N -1 1 321.417 4.367 20 0 DIADMM CCc1cccc(CC)c1[N-]S(=O)(=O)c1cc(C)cc(C)c1 ZINC001259522840 1063889833 /nfs/dbraw/zinc/88/98/33/1063889833.db2.gz AXBXGSUUJSRHDC-UHFFFAOYSA-N -1 1 317.454 4.229 20 0 DIADMM CC1(C)[C@H](C(=O)Nc2cc(F)cc(F)c2[O-])[C@H]1c1ccccc1 ZINC001299587705 1063890675 /nfs/dbraw/zinc/89/06/75/1063890675.db2.gz ZIHFOTVSWKCHBH-CABCVRRESA-N -1 1 317.335 4.049 20 0 DIADMM CC[C@H](C)S(=O)(=O)[N-]c1ccccc1Oc1ccccc1C ZINC001260738900 1063904042 /nfs/dbraw/zinc/90/40/42/1063904042.db2.gz SBXACGHLEZMNRZ-AWEZNQCLSA-N -1 1 319.426 4.328 20 0 DIADMM CC[C@@H](C)S(=O)(=O)[N-]c1ccccc1Oc1ccccc1 ZINC001260737974 1063904585 /nfs/dbraw/zinc/90/45/85/1063904585.db2.gz DKHYSVUXUFIPTQ-CYBMUJFWSA-N -1 1 305.399 4.019 20 0 DIADMM Cc1ccc2[nH]c(-c3ccc(Br)c([O-])c3)nc2c1C ZINC000389463555 1064129330 /nfs/dbraw/zinc/12/93/30/1064129330.db2.gz YXQVVMLRXWHVBZ-UHFFFAOYSA-N -1 1 317.186 4.315 20 0 DIADMM Cc1cc(=Nc2ccc(C(=O)[O-])c(Cl)c2)[nH]c2ccccc12 ZINC000390518371 1064161082 /nfs/dbraw/zinc/16/10/82/1064161082.db2.gz TVBZKYNBMYLEAJ-UHFFFAOYSA-N -1 1 312.756 4.060 20 0 DIADMM O=C(NC[C@@H]1CCCCC1(F)F)c1cc2ccccc2cc1[O-] ZINC000391047882 1064179157 /nfs/dbraw/zinc/17/91/57/1064179157.db2.gz UBBLNYJARKBPCR-AWEZNQCLSA-N -1 1 319.351 4.101 20 0 DIADMM C[C@H](CNC(=O)c1cc2ccccc2cc1[O-])c1ccccc1 ZINC000391329699 1064185795 /nfs/dbraw/zinc/18/57/95/1064185795.db2.gz SDBQMHSRORUCKJ-CQSZACIVSA-N -1 1 305.377 4.079 20 0 DIADMM O=C(Cc1ccc([O-])c(Cl)c1)N[C@@H]1CC[C@H]2CCCC[C@H]2C1 ZINC001290366513 1064692676 /nfs/dbraw/zinc/69/26/76/1064692676.db2.gz MWTRZMIDHKHNMQ-QLFBSQMISA-N -1 1 321.848 4.063 20 0 DIADMM CC(C)[C@H](NC(=O)Cc1ccc([O-])c(Cl)c1)c1ccccc1 ZINC001290482495 1064696896 /nfs/dbraw/zinc/69/68/96/1064696896.db2.gz HARBTMUOHBHSQK-SFHVURJKSA-N -1 1 317.816 4.102 20 0 DIADMM Cc1cc(C=O)c([O-])c(C(=O)N(CCC(C)C)CCC(C)C)c1 ZINC001290735888 1064708941 /nfs/dbraw/zinc/70/89/41/1064708941.db2.gz XYYJXVBCLLRWPB-UHFFFAOYSA-N -1 1 319.445 4.048 20 0 DIADMM O=C(Nc1ccccc1OC1CCCC1)c1cccc([O-])c1F ZINC001291673786 1064739227 /nfs/dbraw/zinc/73/92/27/1064739227.db2.gz GNCPMKHJYSRDOM-UHFFFAOYSA-N -1 1 315.344 4.105 20 0 DIADMM CC(C)C[C@H]1CCCN1C(=O)c1ccc(C(F)(F)F)c([O-])c1 ZINC001292677926 1064782195 /nfs/dbraw/zinc/78/21/95/1064782195.db2.gz XHMCPTVKHVOZBS-GFCCVEGCSA-N -1 1 315.335 4.062 20 0 DIADMM CCCCN(C(=O)c1ccc(C(F)(F)F)cc1[O-])[C@H](C)CC ZINC001292902909 1064792765 /nfs/dbraw/zinc/79/27/65/1064792765.db2.gz DGFRZGWDRQWQEY-LLVKDONJSA-N -1 1 317.351 4.452 20 0 DIADMM CC(C)(C)CN(Cc1ccccc1)C(=O)c1cc(F)ccc1[O-] ZINC001293174650 1064802323 /nfs/dbraw/zinc/80/23/23/1064802323.db2.gz ZVEYFAADPAPATH-UHFFFAOYSA-N -1 1 315.388 4.220 20 0 DIADMM Cc1cccc2c1CCCN2C(=O)c1ccc(C(C)C)cc1[O-] ZINC001293350264 1064809933 /nfs/dbraw/zinc/80/99/33/1064809933.db2.gz MQZATVVOVLAITP-UHFFFAOYSA-N -1 1 309.409 4.417 20 0 DIADMM O=C(N[C@@H](CC1CC1)c1ccccc1)c1cc(Cl)ccc1[O-] ZINC001293598898 1064823091 /nfs/dbraw/zinc/82/30/91/1064823091.db2.gz UADCTCVNXGJQEE-INIZCTEOSA-N -1 1 315.800 4.317 20 0 DIADMM Cc1cccc([C@@H]2CCCCCN2C(=O)c2ncc(C)cc2[O-])c1 ZINC001293750032 1064830498 /nfs/dbraw/zinc/83/04/98/1064830498.db2.gz JRVDSUOPGISQNM-KRWDZBQOSA-N -1 1 324.424 4.162 20 0 DIADMM Cc1ccc([C@@H]2C[C@H](C)CCN2C(=O)c2cccc([O-])c2F)o1 ZINC001294078001 1064847345 /nfs/dbraw/zinc/84/73/45/1064847345.db2.gz ONGJYXRZMNTRPB-RISCZKNCSA-N -1 1 317.360 4.046 20 0 DIADMM C[C@H]1CC(C)(C)CC[C@H]1NC(=O)c1ccc2ccccc2c1[O-] ZINC001294395436 1064865316 /nfs/dbraw/zinc/86/53/16/1064865316.db2.gz GURIFXJZVQALJG-SUMWQHHRSA-N -1 1 311.425 4.490 20 0 DIADMM CC(C)CC[C@@H]1CCCCN1C(=O)Cc1ccc([O-])c(Cl)c1 ZINC001295003729 1064892341 /nfs/dbraw/zinc/89/23/41/1064892341.db2.gz FRCCNZGNZZJWCP-HNNXBMFYSA-N -1 1 323.864 4.405 20 0 DIADMM CC1(C)CN(C(=O)c2cc3ccccc3cc2[O-])CC(C)(C)C1 ZINC001296076568 1064935727 /nfs/dbraw/zinc/93/57/27/1064935727.db2.gz LZURPLXJLONGKM-UHFFFAOYSA-N -1 1 311.425 4.444 20 0 DIADMM CC[C@@H](CCc1ccccc1)NC(=O)c1cc(Cl)ccc1[O-] ZINC001300846767 1065044713 /nfs/dbraw/zinc/04/47/13/1065044713.db2.gz FXFQOYYLUHKLKH-HNNXBMFYSA-N -1 1 317.816 4.187 20 0 DIADMM CC[C@@H](NC(=O)c1cc(F)ccc1[O-])c1cc(C)ccc1C ZINC001302491631 1065089540 /nfs/dbraw/zinc/08/95/40/1065089540.db2.gz BYWMQSUNASVNRW-MRXNPFEDSA-N -1 1 301.361 4.029 20 0 DIADMM O=C(NCc1ccc([O-])c(Cl)c1)[C@@H]1CC[C@H]2CCCC[C@@H]2C1 ZINC001303299193 1065113332 /nfs/dbraw/zinc/11/33/32/1065113332.db2.gz RDIWTVMYGHKBLJ-RBSFLKMASA-N -1 1 321.848 4.268 20 0 DIADMM O=C(Nc1cc(F)c([O-])cc1Cl)c1cccc(C2CC2)c1 ZINC001304283081 1065136065 /nfs/dbraw/zinc/13/60/65/1065136065.db2.gz AJFRVTQDTHPUQB-UHFFFAOYSA-N -1 1 305.736 4.314 20 0 DIADMM O=C(Nc1cc(F)c([O-])cc1Cl)[C@@H]1C[C@]1(F)c1ccccc1 ZINC001304283323 1065136206 /nfs/dbraw/zinc/13/62/06/1065136206.db2.gz WQRBMVZFRCFQGK-QFYYESIMSA-N -1 1 323.726 4.008 20 0 DIADMM O=C(Nc1cc(F)c([O-])cc1Cl)c1cccc2scnc21 ZINC001304283049 1065136256 /nfs/dbraw/zinc/13/62/56/1065136256.db2.gz ACILDMLSVNYJEU-UHFFFAOYSA-N -1 1 322.748 4.047 20 0 DIADMM Cc1ccc(CCC(=O)Nc2cc(F)c([O-])cc2Cl)cc1 ZINC001304284913 1065136407 /nfs/dbraw/zinc/13/64/07/1065136407.db2.gz SRRACVKCMFHSKV-UHFFFAOYSA-N -1 1 307.752 4.064 20 0 DIADMM CCCc1cc(=O)[n-]c(SCc2cccc(Cl)c2F)n1 ZINC001307252954 1065315578 /nfs/dbraw/zinc/31/55/78/1065315578.db2.gz ITSCRGAVGUHWHZ-UHFFFAOYSA-N -1 1 312.797 4.220 20 0 DIADMM Cc1c(=O)[n-]c(SC[C@H]2C[C@H]3C=C[C@@H]2C3)nc1-c1ccccc1 ZINC001307327615 1065342209 /nfs/dbraw/zinc/34/22/09/1065342209.db2.gz OCRHASIZVDOFST-NUEKZKHPSA-N -1 1 324.449 4.462 20 0 DIADMM CCC1(C[N-]S(=O)(=O)c2cc3ccccc3o2)CCCCC1 ZINC001309379362 1066454693 /nfs/dbraw/zinc/45/46/93/1066454693.db2.gz BMMWNNROYUGOSB-UHFFFAOYSA-N -1 1 321.442 4.072 20 0 DIADMM Cc1ccc(S(=O)(=O)[N-]c2ccc3ccccc3c2)cc1C ZINC000006315943 181329413 /nfs/dbraw/zinc/32/94/13/181329413.db2.gz RCNOCKAJDQKPDV-UHFFFAOYSA-N -1 1 311.406 4.257 20 0 DIADMM CCSc1cccc(F)c1[N-]C(=O)c1c(C)nsc1C ZINC000297610538 132025672 /nfs/dbraw/zinc/02/56/72/132025672.db2.gz BFVNOUOQTPCFJB-UHFFFAOYSA-N -1 1 310.419 4.263 20 0 DIADMM O=C(Nc1ccc([O-])c(Cl)c1)[C@H]1C[C@@H]1c1cccc(F)c1F ZINC000173378590 332828997 /nfs/dbraw/zinc/82/89/97/332828997.db2.gz XPZWTPFCOHJWAB-MNOVXSKESA-N -1 1 323.726 4.066 20 0 DIADMM Cc1cc(Br)c([O-])c(NC(=O)c2ccccc2C)c1 ZINC000182929046 331561334 /nfs/dbraw/zinc/56/13/34/331561334.db2.gz XNPZDHOXVPIYGO-UHFFFAOYSA-N -1 1 320.186 4.024 20 0 DIADMM O=C(Nc1ccc([O-])c(Cl)c1)[C@H]1C[C@H]1c1ccccc1Cl ZINC000558325197 331896840 /nfs/dbraw/zinc/89/68/40/331896840.db2.gz BZZZQNUPYWNJOG-RYUDHWBXSA-N -1 1 322.191 4.441 20 0 DIADMM Cc1ccc([C@H](CC(=O)[O-])NCc2ccc(C(C)(C)C)s2)o1 ZINC000426810737 332152062 /nfs/dbraw/zinc/15/20/62/332152062.db2.gz JNCSFADGQBMZCC-ZDUSSCGKSA-N -1 1 321.442 4.253 20 0 DIADMM CCC[C@@H](C)C[C@@H](NCc1cc2cc(C)c(C)cc2o1)C(=O)[O-] ZINC000426828440 332155952 /nfs/dbraw/zinc/15/59/52/332155952.db2.gz YYLUIOOTDLIRSM-SJKOYZFVSA-N -1 1 317.429 4.419 20 0 DIADMM Cc1ccc(F)c(CN[C@@H](CC(=O)[O-])c2cccc(Cl)c2)c1 ZINC000426812844 332157141 /nfs/dbraw/zinc/15/71/41/332157141.db2.gz SHFHXCIFJHISDO-INIZCTEOSA-N -1 1 321.779 4.093 20 0 DIADMM O=C(CC/C=C/c1ccccc1)Nc1ccc([O-])c(Cl)c1 ZINC000150718840 332407962 /nfs/dbraw/zinc/40/79/62/332407962.db2.gz AWDBKZPWRNBUMH-XBXARRHUSA-N -1 1 301.773 4.478 20 0 DIADMM Cc1ccc(CN[C@@H](CC(=O)[O-])c2ccsc2)c(Cl)c1 ZINC000580201316 333002800 /nfs/dbraw/zinc/00/28/00/333002800.db2.gz HUQLIADGDLDKKL-AWEZNQCLSA-N -1 1 309.818 4.016 20 0 DIADMM Cc1ccc2nc(-c3ccc(F)c(C(F)(F)F)c3)[n-]c(=O)c2c1 ZINC000178985305 333022821 /nfs/dbraw/zinc/02/28/21/333022821.db2.gz NMLGYRZFEHRAJI-UHFFFAOYSA-N -1 1 322.261 4.056 20 0 DIADMM C[C@@H](NC(=O)c1ccc([O-])cc1F)c1cccc2ccccc21 ZINC000181035375 333029394 /nfs/dbraw/zinc/02/93/94/333029394.db2.gz QGBILEAZIMFJFV-GFCCVEGCSA-N -1 1 309.340 4.176 20 0 DIADMM CC1(C)CN(C(=O)c2ccc3ccccc3c2[O-])[C@H]2CCC[C@@H]21 ZINC000378816221 333054915 /nfs/dbraw/zinc/05/49/15/333054915.db2.gz BXYXGQSVENUPGM-IRXDYDNUSA-N -1 1 309.409 4.196 20 0 DIADMM Cc1ccccc1[N-]S(=O)(=O)c1ccccc1C(C)(C)C ZINC000460411674 333081098 /nfs/dbraw/zinc/08/10/98/333081098.db2.gz LYHJGSXMJHUEPS-UHFFFAOYSA-N -1 1 303.427 4.093 20 0 DIADMM Cc1noc(-c2ccccc2)c1[N-]C(=O)c1c(F)cccc1F ZINC000460462312 333091640 /nfs/dbraw/zinc/09/16/40/333091640.db2.gz OQQKISKUNLBPNT-UHFFFAOYSA-N -1 1 314.291 4.181 20 0 DIADMM CN(CCc1ccc(Cl)cc1)C(=O)c1cc(Cl)ccc1[O-] ZINC000436545354 333973994 /nfs/dbraw/zinc/97/39/94/333973994.db2.gz MCLJNTUKMHHPPF-UHFFFAOYSA-N -1 1 324.207 4.014 20 0 DIADMM C[C@@H]1CCCC[C@H]1N(C)C(=O)c1ccc(C(F)(F)F)cc1[O-] ZINC000436762183 333998368 /nfs/dbraw/zinc/99/83/68/333998368.db2.gz CMBXNDWPSAGMIK-ZWNOBZJWSA-N -1 1 315.335 4.062 20 0 DIADMM CCOc1cc(-c2noc(C(C)(C)C3CC3)n2)cc(Cl)c1[O-] ZINC000436868660 334012948 /nfs/dbraw/zinc/01/29/48/334012948.db2.gz BGCBJRAYMBNWGZ-UHFFFAOYSA-N -1 1 322.792 4.182 20 0 DIADMM C[C@H](N[C@H](CCC(C)(C)C)C(=O)[O-])c1cc2ccccc2o1 ZINC000414667924 334063593 /nfs/dbraw/zinc/06/35/93/334063593.db2.gz WYJVZLPPHAOATK-GXTWGEPZSA-N -1 1 303.402 4.363 20 0 DIADMM C[C@H](Cc1ccc(Cl)cc1)C(=O)Nc1ccc(F)cc1[O-] ZINC000534493651 334277472 /nfs/dbraw/zinc/27/74/72/334277472.db2.gz HTIZGYZIQBXWSS-SNVBAGLBSA-N -1 1 307.752 4.002 20 0 DIADMM Cc1c(Cl)cccc1S(=O)(=O)[N-]c1cccc(Cl)c1 ZINC000048652455 334290949 /nfs/dbraw/zinc/29/09/49/334290949.db2.gz DZWONFNJVOBUDO-UHFFFAOYSA-N -1 1 316.209 4.103 20 0 DIADMM C[C@H](CC(=O)Nc1ccc([O-])c(Cl)c1)c1ccccc1F ZINC000111668678 334352934 /nfs/dbraw/zinc/35/29/34/334352934.db2.gz DETDJGMQHHHACD-SNVBAGLBSA-N -1 1 307.752 4.317 20 0 DIADMM Cc1ccc(-c2ccncc2)cc1NC(=O)c1ccccc1[O-] ZINC000101848405 334359457 /nfs/dbraw/zinc/35/94/57/334359457.db2.gz WXRCWDAHBVSJAQ-UHFFFAOYSA-N -1 1 304.349 4.015 20 0 DIADMM COc1cc(C(=O)Nc2ccc(SC)cc2)cc(Cl)c1[O-] ZINC000340913953 334397286 /nfs/dbraw/zinc/39/72/86/334397286.db2.gz LAMUNZGPFPRKMO-UHFFFAOYSA-N -1 1 323.801 4.028 20 0 DIADMM CCCC[C@@H](CCC)NC(=O)c1cc(Cl)c([O-])c(OC)c1 ZINC000443288513 338448379 /nfs/dbraw/zinc/44/83/79/338448379.db2.gz BDIZFYMTWZKNKF-GFCCVEGCSA-N -1 1 313.825 4.143 20 0 DIADMM CCc1cccc(C)c1[N-]S(=O)(=O)c1ccccc1SC ZINC000188241643 334669729 /nfs/dbraw/zinc/66/97/29/334669729.db2.gz RIXLXWHCMJQERD-UHFFFAOYSA-N -1 1 321.467 4.080 20 0 DIADMM CC(C)Oc1ccc(NC(=O)c2cc(F)ccc2[O-])c(Cl)c1 ZINC000444513419 338474432 /nfs/dbraw/zinc/47/44/32/338474432.db2.gz RSIBTGMZEWQVLR-UHFFFAOYSA-N -1 1 323.751 4.224 20 0 DIADMM C[C@@H](C(=O)Nc1ccc(F)cc1[O-])c1ccc2ccccc2c1 ZINC000532266800 335927472 /nfs/dbraw/zinc/92/74/72/335927472.db2.gz VAKCFXLPYSPKHK-GFCCVEGCSA-N -1 1 309.340 4.427 20 0 DIADMM O=C(Nc1ccc([O-])c(Cl)c1)[C@@H]1C[C@H]1c1c(F)cccc1F ZINC000116469383 336250942 /nfs/dbraw/zinc/25/09/42/336250942.db2.gz PEEBZIFGKOHPGX-NXEZZACHSA-N -1 1 323.726 4.066 20 0 DIADMM O=C(Nc1ccc([O-])c(Cl)c1)[C@H]1C[C@@H]1c1c(F)cccc1F ZINC000116469381 336251021 /nfs/dbraw/zinc/25/10/21/336251021.db2.gz PEEBZIFGKOHPGX-UWVGGRQHSA-N -1 1 323.726 4.066 20 0 DIADMM COc1cccc(-c2noc(-c3ccc4ccccc4c3[O-])n2)c1 ZINC000324815192 336259738 /nfs/dbraw/zinc/25/97/38/336259738.db2.gz QLPDTJNZAXXPCQ-UHFFFAOYSA-N -1 1 318.332 4.271 20 0 DIADMM COc1ccc2oc([C@H](C)[N-]c3nc(C(C)C)no3)c(C)c2c1 ZINC000301338409 336301412 /nfs/dbraw/zinc/30/14/12/336301412.db2.gz OXOSLZUUFROCFO-NSHDSACASA-N -1 1 315.373 4.429 20 0 DIADMM Cc1c([N-]c2nc(CC(C)C)ns2)cnn1C1CCCC1 ZINC000302885171 336373307 /nfs/dbraw/zinc/37/33/07/336373307.db2.gz MGXFMYPUUDXAKZ-UHFFFAOYSA-N -1 1 305.451 4.100 20 0 DIADMM Cc1cc(S(=O)(=O)[N-]c2ccc(C)cc2Cl)sc1C ZINC000583040711 337232678 /nfs/dbraw/zinc/23/26/78/337232678.db2.gz CQPRVWZJIPMMBL-UHFFFAOYSA-N -1 1 315.847 4.128 20 0 DIADMM Cc1cc(CSc2nc(C(F)F)cc(=O)[n-]2)c(C)s1 ZINC000584379487 337232891 /nfs/dbraw/zinc/23/28/91/337232891.db2.gz DUPJBVSORKWIGO-UHFFFAOYSA-N -1 1 302.371 4.090 20 0 DIADMM CC(C)[C@@H]1CCCN(C(=O)c2cc3ccccc3cc2[O-])CC1 ZINC000321718047 337285777 /nfs/dbraw/zinc/28/57/77/337285777.db2.gz HBRPLIDAQALELI-OAHLLOKOSA-N -1 1 311.425 4.444 20 0 DIADMM Cc1nc(CC2CC2)sc1C(=O)Nc1ccc([O-])c(Cl)c1 ZINC000190818596 337290107 /nfs/dbraw/zinc/29/01/07/337290107.db2.gz CTUBHFRLCTUUFM-UHFFFAOYSA-N -1 1 322.817 4.015 20 0 DIADMM O=C([O-])c1ccc(CN2CCC[C@H]2c2cccs2)cc1Cl ZINC000583877398 337369051 /nfs/dbraw/zinc/36/90/51/337369051.db2.gz IOSRSSRAFGHCOM-AWEZNQCLSA-N -1 1 321.829 4.437 20 0 DIADMM CCOc1cc(-c2noc([C@H]3CC[C@H](C)C3)n2)cc(Cl)c1[O-] ZINC000445429492 337729610 /nfs/dbraw/zinc/72/96/10/337729610.db2.gz ABDJSFGHOWPDFP-UWVGGRQHSA-N -1 1 322.792 4.398 20 0 DIADMM Cc1ccccc1OCCCC(=O)Nc1ccc([O-])c(Cl)c1 ZINC000533082156 337812642 /nfs/dbraw/zinc/81/26/42/337812642.db2.gz UYBDRXLTJXXXLM-UHFFFAOYSA-N -1 1 319.788 4.152 20 0 DIADMM O=C(CSc1cccc(Br)c1)c1ccc([O-])cc1 ZINC000055308389 337846880 /nfs/dbraw/zinc/84/68/80/337846880.db2.gz FFTHWILNKMJWSI-UHFFFAOYSA-N -1 1 323.211 4.130 20 0 DIADMM [O-]c1ccc(-c2noc(-c3ccc4cc[nH]c4c3)n2)c(Cl)c1 ZINC000445447911 337849541 /nfs/dbraw/zinc/84/95/41/337849541.db2.gz JCOBHUHMVASRRC-UHFFFAOYSA-N -1 1 311.728 4.244 20 0 DIADMM C[C@@H](c1cccs1)N(C)C(=O)c1ccc2ccccc2c1[O-] ZINC000121907838 337901815 /nfs/dbraw/zinc/90/18/15/337901815.db2.gz OHKXNDKCEKVGNE-LBPRGKRZSA-N -1 1 311.406 4.440 20 0 DIADMM Cc1ccc(C(C)(C)C(=O)Nc2ccc([O-])c(Cl)c2)cc1 ZINC000129607642 337935769 /nfs/dbraw/zinc/93/57/69/337935769.db2.gz YXNMKQSDDQHMET-UHFFFAOYSA-N -1 1 303.789 4.270 20 0 DIADMM CC(=O)c1csc(-c2nc(-c3ccc([O-])cc3Cl)no2)c1 ZINC000445449711 337945212 /nfs/dbraw/zinc/94/52/12/337945212.db2.gz ZFBTWTQBMGMRDP-UHFFFAOYSA-N -1 1 320.757 4.027 20 0 DIADMM COC(=O)c1c[n-]c(S[C@H](C)c2cccc3ccccc32)n1 ZINC000516138253 338004958 /nfs/dbraw/zinc/00/49/58/338004958.db2.gz XVEIPKFQNDWHBU-LLVKDONJSA-N -1 1 312.394 4.203 20 0 DIADMM Cc1ncc(/C=C/c2nc(-c3ccc([O-])cc3Cl)no2)s1 ZINC000445451463 338016460 /nfs/dbraw/zinc/01/64/60/338016460.db2.gz GCBSHIMSCOJHEB-HWKANZROSA-N -1 1 319.773 4.031 20 0 DIADMM [O-]c1ccc(-c2noc(-c3ccc(Cl)s3)n2)c(Cl)c1 ZINC000445452228 338016591 /nfs/dbraw/zinc/01/65/91/338016591.db2.gz BCCORUBPMWNRED-UHFFFAOYSA-N -1 1 313.165 4.478 20 0 DIADMM CC(C)C[C@@H](C)OCCc1nc(-c2ccc([O-])cc2Cl)no1 ZINC000445451784 338016611 /nfs/dbraw/zinc/01/66/11/338016611.db2.gz KIWRBYOPTDCZSD-LLVKDONJSA-N -1 1 324.808 4.089 20 0 DIADMM C[C@@H](c1nc(-c2ccc([O-])cc2Cl)no1)c1cccc(F)c1 ZINC000445453774 338017084 /nfs/dbraw/zinc/01/70/84/338017084.db2.gz XHAGHCWCHJPAOG-SECBINFHSA-N -1 1 318.735 4.387 20 0 DIADMM C[C@@H](c1nc(-c2ccc([O-])cc2F)no1)c1c(F)cccc1F ZINC000445456276 338017461 /nfs/dbraw/zinc/01/74/61/338017461.db2.gz IJPIYNYZCDTRBO-MRVPVSSYSA-N -1 1 320.270 4.011 20 0 DIADMM CCc1ccsc1-c1nc(-c2ccc([O-])cc2Cl)no1 ZINC000445456143 338017477 /nfs/dbraw/zinc/01/74/77/338017477.db2.gz SDXVXAIOVWFJFH-UHFFFAOYSA-N -1 1 306.774 4.387 20 0 DIADMM O=C([O-])[C@@H](CC1CCCC1)NCc1ccc(-c2ccccc2)o1 ZINC000426728772 338039574 /nfs/dbraw/zinc/03/95/74/338039574.db2.gz XFZPYAIPMBZHBQ-QGZVFWFLSA-N -1 1 313.397 4.070 20 0 DIADMM Cc1cc2cc(CN[C@@H](CCC(C)(C)C)C(=O)[O-])oc2cc1C ZINC000426761285 338041209 /nfs/dbraw/zinc/04/12/09/338041209.db2.gz ZFHRFBHDTQQTIN-INIZCTEOSA-N -1 1 317.429 4.419 20 0 DIADMM O=C(c1ccc(Cl)cc1[O-])N1CCC[C@@H]1c1ccsc1 ZINC000436525580 338275203 /nfs/dbraw/zinc/27/52/03/338275203.db2.gz GTNWOZIZCYLKQS-CYBMUJFWSA-N -1 1 307.802 4.084 20 0 DIADMM O=C(c1ccc(Cl)cc1[O-])N1CCCCC[C@@H]1c1ccco1 ZINC000436530275 338275353 /nfs/dbraw/zinc/27/53/53/338275353.db2.gz QCAJBBRTCPVZCF-CQSZACIVSA-N -1 1 319.788 4.396 20 0 DIADMM O=C(c1ccc2ccccc2c1[O-])N1CC[C@H]1c1ccccc1 ZINC000436530874 338275459 /nfs/dbraw/zinc/27/54/59/338275459.db2.gz RGLXKRQAFWZMLM-SFHVURJKSA-N -1 1 303.361 4.133 20 0 DIADMM [O-]c1ccc(F)cc1-c1nc(-c2ccc(Cl)cc2F)no1 ZINC000436537596 338275875 /nfs/dbraw/zinc/27/58/75/338275875.db2.gz YHDJBXZEQNMDBU-UHFFFAOYSA-N -1 1 308.671 4.041 20 0 DIADMM Cc1nc2cc(NC(=O)c3ccc4ccccc4c3[O-])ccc2o1 ZINC000436538993 338276143 /nfs/dbraw/zinc/27/61/43/338276143.db2.gz UTGKRDKARDMYRW-UHFFFAOYSA-N -1 1 318.332 4.247 20 0 DIADMM CC(C)c1ccc(C(=O)N2CCCN(C)c3ccccc32)c([O-])c1 ZINC000436539116 338276177 /nfs/dbraw/zinc/27/61/77/338276177.db2.gz SLDFWAINWDYGOU-UHFFFAOYSA-N -1 1 324.424 4.002 20 0 DIADMM C[C@H]1CN(C(=O)c2ccc3ccccc3c2[O-])[C@@H]1c1ccccc1 ZINC000436574007 338277755 /nfs/dbraw/zinc/27/77/55/338277755.db2.gz KSDIFGFSRCYLBY-LIRRHRJNSA-N -1 1 317.388 4.379 20 0 DIADMM C[C@@H]1c2ccccc2CN1C(=O)c1cc2ccccc2cc1[O-] ZINC000436582327 338278313 /nfs/dbraw/zinc/27/83/13/338278313.db2.gz HGYOGKCKWJUEMJ-CYBMUJFWSA-N -1 1 303.361 4.262 20 0 DIADMM O=C(c1cc2ccccc2cc1[O-])N1CCc2c1cccc2Cl ZINC000436582198 338278431 /nfs/dbraw/zinc/27/84/31/338278431.db2.gz ANDDCEDSOWGEHI-UHFFFAOYSA-N -1 1 323.779 4.402 20 0 DIADMM O=C(c1cc(Cl)ccc1[O-])N1CC[C@@H]1c1ccc(Cl)cc1 ZINC000436591589 338279004 /nfs/dbraw/zinc/27/90/04/338279004.db2.gz XBIYQCMWLITZGR-CQSZACIVSA-N -1 1 322.191 4.286 20 0 DIADMM COc1ccc(-c2nc([C@@H]3CCCC(C)(C)C3)no2)c([O-])c1 ZINC000436685426 338282836 /nfs/dbraw/zinc/28/28/36/338282836.db2.gz AUOPVPHNEDPSIZ-LLVKDONJSA-N -1 1 302.374 4.135 20 0 DIADMM O=C(c1ccc(Cl)cc1[O-])N1CCC[C@@H]1c1cccc(F)c1 ZINC000436721329 338284125 /nfs/dbraw/zinc/28/41/25/338284125.db2.gz IZZHJKFKBWRIJC-OAHLLOKOSA-N -1 1 319.763 4.162 20 0 DIADMM C[C@@H]1CN(C(=O)c2cc3ccccc3cc2[O-])[C@H]2CCCC[C@@H]12 ZINC000436734665 338284632 /nfs/dbraw/zinc/28/46/32/338284632.db2.gz BJPRDEBQNDFBGJ-SKDZVZGDSA-N -1 1 309.409 4.196 20 0 DIADMM C[C@@H]1CN(C(=O)c2cc3ccccc3cc2[O-])[C@H]2CCCC[C@H]12 ZINC000436734661 338284673 /nfs/dbraw/zinc/28/46/73/338284673.db2.gz BJPRDEBQNDFBGJ-QBIMZIAESA-N -1 1 309.409 4.196 20 0 DIADMM Cc1cc(F)ccc1CN(C)C(=O)c1ccc2ccccc2c1[O-] ZINC000436741767 338284993 /nfs/dbraw/zinc/28/49/93/338284993.db2.gz VZDHGISARLCQAF-UHFFFAOYSA-N -1 1 323.367 4.265 20 0 DIADMM C[C@@H]1CN(C(=O)c2ccc3ccccc3c2[O-])[C@H]2CCCC[C@H]12 ZINC000436741160 338285060 /nfs/dbraw/zinc/28/50/60/338285060.db2.gz RVDKDZDHAZRQNY-SIIHOXLZSA-N -1 1 309.409 4.196 20 0 DIADMM CC1(C)CCCN(C(=O)c2ccc(C(F)(F)F)cc2[O-])CC1 ZINC000436749960 338285331 /nfs/dbraw/zinc/28/53/31/338285331.db2.gz CYULMFLWYUOBBD-UHFFFAOYSA-N -1 1 315.335 4.063 20 0 DIADMM O=C(Nc1ccc2[nH]ccc2c1)c1ccc2ccccc2c1[O-] ZINC000436754273 338285595 /nfs/dbraw/zinc/28/55/95/338285595.db2.gz ILQQPUFCAZFXNJ-UHFFFAOYSA-N -1 1 302.333 4.279 20 0 DIADMM C[C@@H]1c2ccccc2CN1C(=O)c1ccc(C(F)(F)F)cc1[O-] ZINC000436753846 338285607 /nfs/dbraw/zinc/28/56/07/338285607.db2.gz WCYIKGMBHZEDEU-SNVBAGLBSA-N -1 1 321.298 4.128 20 0 DIADMM CCN(C(=O)c1ccc(C(F)(F)F)cc1[O-])c1ccccc1 ZINC000436790560 338287476 /nfs/dbraw/zinc/28/74/76/338287476.db2.gz GZBJSFFAJDHTAE-UHFFFAOYSA-N -1 1 309.287 4.078 20 0 DIADMM C/C(=C/c1ccccc1)CN(C)C(=O)c1ccc(Cl)cc1[O-] ZINC000436810043 338288068 /nfs/dbraw/zinc/28/80/68/338288068.db2.gz WBBLSCXRSXGTHY-RAXLEYEMSA-N -1 1 315.800 4.221 20 0 DIADMM CC(C)c1ccc2c(c1)[C@H](NC(=O)c1ccc([O-])cc1F)CC2 ZINC000436837574 338289294 /nfs/dbraw/zinc/28/92/94/338289294.db2.gz PICFEEOAVWVNKW-GOSISDBHSA-N -1 1 313.372 4.072 20 0 DIADMM Cc1oc(C(C)C)cc1-c1nc(-c2ccc([O-])c(F)c2)no1 ZINC000436871696 338290844 /nfs/dbraw/zinc/29/08/44/338290844.db2.gz HSOQUVYWGWKBBR-UHFFFAOYSA-N -1 1 302.305 4.273 20 0 DIADMM C[C@@H]1[C@@H](c2ccccc2)[C@H]1c1nc(-c2ccc([O-])cc2F)no1 ZINC000436878141 338291231 /nfs/dbraw/zinc/29/12/31/338291231.db2.gz IMTFVBJBGHEHCJ-VFVAKGGASA-N -1 1 310.328 4.098 20 0 DIADMM Cc1csc(-c2nc(-c3ccc([O-])cc3F)no2)c1Cl ZINC000436880203 338291538 /nfs/dbraw/zinc/29/15/38/338291538.db2.gz QCCPPOJIGBXISF-UHFFFAOYSA-N -1 1 310.737 4.272 20 0 DIADMM Cc1oc2ccccc2c1Cc1nc(-c2ccc([O-])c(F)c2)no1 ZINC000436881958 338291622 /nfs/dbraw/zinc/29/16/22/338291622.db2.gz ZIUUZPGCQHDLKY-UHFFFAOYSA-N -1 1 324.311 4.227 20 0 DIADMM CSCc1ccc(-c2noc(-c3cc(F)ccc3[O-])n2)cc1 ZINC000436917797 338293197 /nfs/dbraw/zinc/29/31/97/338293197.db2.gz FMMUIEZWVDOPOY-UHFFFAOYSA-N -1 1 316.357 4.111 20 0 DIADMM CC1(C)CCCCN(C(=O)c2ccc(C(F)(F)F)cc2[O-])C1 ZINC000438505984 338346385 /nfs/dbraw/zinc/34/63/85/338346385.db2.gz ONESANBQRYAKSE-UHFFFAOYSA-N -1 1 315.335 4.063 20 0 DIADMM CCc1ccc([C@H](C)CC(=O)Nc2ccc([O-])c(F)c2F)cc1 ZINC000456762139 338939483 /nfs/dbraw/zinc/93/94/83/338939483.db2.gz AMASNEHQQHPBPK-LLVKDONJSA-N -1 1 319.351 4.365 20 0 DIADMM O=C(Nc1ccc([O-])c(F)c1F)[C@@H]1CCC[C@@H]2CCCC[C@H]12 ZINC000456781771 338940397 /nfs/dbraw/zinc/94/03/97/338940397.db2.gz JOZLMMBFXXSTHO-SDDRHHMPSA-N -1 1 309.356 4.215 20 0 DIADMM O=C(Nc1ccc([O-])c(F)c1F)c1scnc1C1CCCC1 ZINC000456789182 338940902 /nfs/dbraw/zinc/94/09/02/338940902.db2.gz TWCJDLVMKIHMKJ-UHFFFAOYSA-N -1 1 324.352 4.037 20 0 DIADMM Cc1cc(S(=O)(=O)[N-]c2c(C)cccc2Cl)sc1C ZINC000461120376 339059748 /nfs/dbraw/zinc/05/97/48/339059748.db2.gz BKUHKMKQSOIZIO-UHFFFAOYSA-N -1 1 315.847 4.128 20 0 DIADMM Cn1cc([N-]c2nc3cc(Cl)cc(Cl)c3o2)c(C2CC2)n1 ZINC000461868447 339067607 /nfs/dbraw/zinc/06/76/07/339067607.db2.gz UESUSJDQBIBLQI-UHFFFAOYSA-N -1 1 323.183 4.489 20 0 DIADMM CCC(C)(C)c1ccc(S(=O)(=O)[N-]c2ccsc2)cc1 ZINC000467087699 339226006 /nfs/dbraw/zinc/22/60/06/339226006.db2.gz ZVRZUNIILZQEMP-UHFFFAOYSA-N -1 1 309.456 4.237 20 0 DIADMM CSc1cccc(C)c1[N-]S(=O)(=O)c1ccc(C)cc1C ZINC000471980495 339358642 /nfs/dbraw/zinc/35/86/42/339358642.db2.gz RUWCFUHKSIIBFA-UHFFFAOYSA-N -1 1 321.467 4.135 20 0 DIADMM CSc1cccc(C)c1[N-]S(=O)(=O)c1ccc(C)c(C)c1 ZINC000471988268 339358875 /nfs/dbraw/zinc/35/88/75/339358875.db2.gz ILEPFEYARBWYFQ-UHFFFAOYSA-N -1 1 321.467 4.135 20 0 DIADMM O=C(CCSCc1ccccc1)Nc1ccc([O-])c(Cl)c1 ZINC000472404855 339371531 /nfs/dbraw/zinc/37/15/31/339371531.db2.gz NVDHSNOREVYPIL-UHFFFAOYSA-N -1 1 321.829 4.308 20 0 DIADMM Cc1csc(-c2nc3cc(Cl)c(Cl)cc3c(=O)[n-]2)n1 ZINC000485368214 339702066 /nfs/dbraw/zinc/70/20/66/339702066.db2.gz YMNQUYUBTOXFQB-UHFFFAOYSA-N -1 1 312.181 4.074 20 0 DIADMM CC(C)O[C@H](C(=O)Nc1ccc([O-])c(Cl)c1)c1ccccc1 ZINC000485662653 339708559 /nfs/dbraw/zinc/70/85/59/339708559.db2.gz XIBIFXLRECWIFX-INIZCTEOSA-N -1 1 319.788 4.150 20 0 DIADMM CC[C@H](C)[C@H](C)C(=O)Nc1cc(C)cc(Br)c1[O-] ZINC000507366335 340218155 /nfs/dbraw/zinc/21/81/55/340218155.db2.gz AYRRUDURHAWASD-UWVGGRQHSA-N -1 1 314.223 4.084 20 0 DIADMM O=C(Nc1ccc(Cl)c(Cl)c1)c1c(F)ccc([O-])c1F ZINC000507859566 340234456 /nfs/dbraw/zinc/23/44/56/340234456.db2.gz MFPGPFLUYOPDLR-UHFFFAOYSA-N -1 1 318.106 4.230 20 0 DIADMM Oc1cccc(C[N@H+]2CC[C@@H](c3ccccc3F)C2)c1Cl ZINC000508355968 340242713 /nfs/dbraw/zinc/24/27/13/340242713.db2.gz UKWWHYIDXDJOHD-GFCCVEGCSA-N -1 1 305.780 4.174 20 0 DIADMM CC(C)c1ccc(S(=O)(=O)[N-]c2cccc3[nH]ccc32)cc1 ZINC000508450633 340243966 /nfs/dbraw/zinc/24/39/66/340243966.db2.gz OWSVROOHMIZQDB-UHFFFAOYSA-N -1 1 314.410 4.092 20 0 DIADMM O=C(Nc1ccc([O-])c(Cl)c1)c1[nH]c2ccccc2c1Cl ZINC000509171806 340263034 /nfs/dbraw/zinc/26/30/34/340263034.db2.gz WUFHXPXQDMRPQB-UHFFFAOYSA-N -1 1 321.163 4.433 20 0 DIADMM C[C@@H](CC(=O)Nc1ccc([O-])c(Cl)c1)Cc1cccc(F)c1 ZINC000509172872 340263046 /nfs/dbraw/zinc/26/30/46/340263046.db2.gz PQDAWFIAHZMPTP-LLVKDONJSA-N -1 1 321.779 4.392 20 0 DIADMM C[C@]1(C(=O)Nc2ccc([O-])c(Cl)c2)CCc2ccccc2C1 ZINC000509185958 340263357 /nfs/dbraw/zinc/26/33/57/340263357.db2.gz QDVMBCAMVVRCOT-SFHVURJKSA-N -1 1 315.800 4.179 20 0 DIADMM C[C@H](C(=O)Nc1ccc([O-])c(Cl)c1)c1ccc(F)c(F)c1 ZINC000509188144 340263520 /nfs/dbraw/zinc/26/35/20/340263520.db2.gz ZNKWYXKPEMZIHB-QMMMGPOBSA-N -1 1 311.715 4.066 20 0 DIADMM CCc1nn(C)cc1[N-]c1nc2cc(Cl)cc(Cl)c2o1 ZINC000513046984 340390646 /nfs/dbraw/zinc/39/06/46/340390646.db2.gz PNONNECBVJVGKO-UHFFFAOYSA-N -1 1 311.172 4.174 20 0 DIADMM CC(C)(c1noc(-c2cc(F)ccc2[O-])n1)C1=CCCCC1 ZINC000517275014 340467339 /nfs/dbraw/zinc/46/73/39/340467339.db2.gz QMHDQDUQBNWFDG-UHFFFAOYSA-N -1 1 302.349 4.359 20 0 DIADMM CCn1cc(C(=O)Nc2ccc([O-])c(Cl)c2)c2ccccc21 ZINC000182879750 340485704 /nfs/dbraw/zinc/48/57/04/340485704.db2.gz OWLOBUOBSKQWDT-UHFFFAOYSA-N -1 1 314.772 4.273 20 0 DIADMM O=C(Nc1ccc([O-])c(Cl)c1)C1CC(c2cccc(F)c2)C1 ZINC000542817689 341022007 /nfs/dbraw/zinc/02/20/07/341022007.db2.gz MHUDZTLOGNIXTB-UHFFFAOYSA-N -1 1 319.763 4.317 20 0 DIADMM CCOc1cc(C(=O)Nc2ccc(F)c(C)c2)cc(Cl)c1[O-] ZINC000545854716 341143367 /nfs/dbraw/zinc/14/33/67/341143367.db2.gz YEUFBYILVGEEQB-UHFFFAOYSA-N -1 1 323.751 4.144 20 0 DIADMM C[C@H]1C[C@@H]1c1noc(-c2cc(Oc3ccccc3)ccc2[O-])n1 ZINC000547187793 341200452 /nfs/dbraw/zinc/20/04/52/341200452.db2.gz UOCYAUBYVOHESX-FZMZJTMJSA-N -1 1 308.337 4.358 20 0 DIADMM CCc1ccccc1OCCC(=O)Nc1ccc([O-])c(Cl)c1 ZINC000552363097 341389155 /nfs/dbraw/zinc/38/91/55/341389155.db2.gz BJGZNJUXJILEPE-UHFFFAOYSA-N -1 1 319.788 4.016 20 0 DIADMM O=C(C/C=C\c1ccccc1F)Nc1ccc([O-])c(Cl)c1 ZINC000255000002 341496708 /nfs/dbraw/zinc/49/67/08/341496708.db2.gz WDEUDCGAPOBHMA-HYXAFXHYSA-N -1 1 305.736 4.227 20 0 DIADMM CC[C@@H](NC(=O)c1ccc([O-])cc1F)c1cccc(Cl)c1 ZINC000154785530 341596027 /nfs/dbraw/zinc/59/60/27/341596027.db2.gz WEKIMYFFZWDCCY-OAHLLOKOSA-N -1 1 307.752 4.066 20 0 DIADMM CC[C@@H]([N-]c1nc(C(C)C)no1)c1nc(C(F)(F)F)cs1 ZINC000266756032 522966312 /nfs/dbraw/zinc/96/63/12/522966312.db2.gz UJTCQWKNYVRSEV-SSDOTTSWSA-N -1 1 320.340 4.232 20 0 DIADMM Cc1cc(C(=O)Nc2ccc([O-])c(Cl)c2)c(C)n1C(C)C ZINC000129613232 524170602 /nfs/dbraw/zinc/17/06/02/524170602.db2.gz XLVMNZICKLPZPE-UHFFFAOYSA-N -1 1 306.793 4.297 20 0 DIADMM O=C(Nc1ccc([O-])c(Cl)c1)c1cccc(C(F)(F)F)c1 ZINC000067738967 1035593975 /nfs/dbraw/zinc/59/39/75/1035593975.db2.gz IDGRRNQCJOJHCW-UHFFFAOYSA-N -1 1 315.678 4.317 20 0 DIADMM CC(C)CCOc1ccccc1NC(=O)c1ccc([O-])c(F)c1 ZINC000655229357 1035984635 /nfs/dbraw/zinc/98/46/35/1035984635.db2.gz KJNLTFWNLXPBLV-UHFFFAOYSA-N -1 1 317.360 4.209 20 0 DIADMM O=C(C/C=C/c1cccc(F)c1)Nc1ccc([O-])c(Cl)c1 ZINC000182880373 1035991378 /nfs/dbraw/zinc/99/13/78/1035991378.db2.gz AHGUAFPTYNYMPV-DUXPYHPUSA-N -1 1 305.736 4.227 20 0 DIADMM O=C(c1cc(Cl)ccc1[O-])N1CCC[C@H](C2CCCC2)C1 ZINC001648803934 1036384837 /nfs/dbraw/zinc/38/48/37/1036384837.db2.gz VGBHPYSWWBWNJO-ZDUSSCGKSA-N -1 1 307.821 4.088 20 0 DIADMM C[C@H](c1ccc(Cl)c(Cl)c1)N1CCC(CC(=O)[O-])CC1 ZINC000093682323 1036388335 /nfs/dbraw/zinc/38/83/35/1036388335.db2.gz CFIIGBRRHHJDHW-SNVBAGLBSA-N -1 1 316.228 4.241 20 0 DIADMM COc1ccc(C(C)=O)c(Nc2cccc([O-])c2Cl)c1C ZINC001210855409 1037017133 /nfs/dbraw/zinc/01/71/33/1037017133.db2.gz ZLODGNLGIZKYOM-UHFFFAOYSA-N -1 1 305.761 4.309 20 0 DIADMM CCc1nc2ccc(Nc3cc(Cl)c([O-])c(Cl)c3)cn2n1 ZINC001210928064 1037057905 /nfs/dbraw/zinc/05/79/05/1037057905.db2.gz ZFKMPRNVIFBBPN-UHFFFAOYSA-N -1 1 323.183 4.048 20 0 DIADMM Cc1cnc(SCc2cccc(Cl)c2Cl)[n-]c1=O ZINC001656575255 1037105749 /nfs/dbraw/zinc/10/57/49/1037105749.db2.gz BWXUPCCMVBVYFD-UHFFFAOYSA-N -1 1 301.198 4.090 20 0 DIADMM C[C@H](c1ccc(Cl)c(Cl)c1)N1CCC[C@@H](CC(=O)[O-])C1 ZINC000226420459 1037194651 /nfs/dbraw/zinc/19/46/51/1037194651.db2.gz NTAHZRFXDLNWHZ-MNOVXSKESA-N -1 1 316.228 4.241 20 0 DIADMM CC(C)(C)c1nnc([N-]c2ccc(Cl)nc2Cl)s1 ZINC001211271418 1037262638 /nfs/dbraw/zinc/26/26/38/1037262638.db2.gz OFHFKAVMQYPLLK-UHFFFAOYSA-N -1 1 303.218 4.281 20 0 DIADMM [O-]c1cc(F)c(-c2cnc3[nH]cc(C(F)(F)F)c3c2)cc1F ZINC001211353477 1037314197 /nfs/dbraw/zinc/31/41/97/1037314197.db2.gz WTOMBHJZJZEKRE-UHFFFAOYSA-N -1 1 314.213 4.233 20 0 DIADMM O=C(CCC(F)(F)F)Nc1cc(Cl)c([O-])c2ccccc12 ZINC001167439734 1037376205 /nfs/dbraw/zinc/37/62/05/1037376205.db2.gz GLICURZPOALTBJ-UHFFFAOYSA-N -1 1 317.694 4.480 20 0 DIADMM Cc1nc(CNCc2cccc(C3CCCC3)c2)ccc1C(=O)[O-] ZINC000656565571 1037647921 /nfs/dbraw/zinc/64/79/21/1037647921.db2.gz QNPHUWLXOHTDID-UHFFFAOYSA-N -1 1 324.424 4.036 20 0 DIADMM CCc1cccc2cc(CN[C@H](CCC(C)(C)C)C(=O)[O-])oc21 ZINC000656573443 1037660554 /nfs/dbraw/zinc/66/05/54/1037660554.db2.gz PJYOBOTYLXETDI-MRXNPFEDSA-N -1 1 317.429 4.364 20 0 DIADMM CC(C)Sc1ccc(C(=O)Nc2c([O-])cccc2F)cc1 ZINC000605440561 1038516126 /nfs/dbraw/zinc/51/61/26/1038516126.db2.gz VISGSWHXJUSEHA-UHFFFAOYSA-N -1 1 305.374 4.284 20 0 DIADMM CC[C@@H](C)c1ccccc1OCC(=O)Nc1c([O-])cccc1F ZINC000605440733 1038516224 /nfs/dbraw/zinc/51/62/24/1038516224.db2.gz ZNTGSFDAVKTAQD-GFCCVEGCSA-N -1 1 317.360 4.062 20 0 DIADMM O=C(Nc1c([O-])cccc1F)c1ccc2[nH]c3c(c2c1)CCCC3 ZINC000605439375 1038516575 /nfs/dbraw/zinc/51/65/75/1038516575.db2.gz WCPLHYQFNYAKIL-UHFFFAOYSA-N -1 1 324.355 4.144 20 0 DIADMM C[C@H]1CCCC[C@@H]1N(C)C(=O)c1ccc(C(F)(F)F)c([O-])c1 ZINC000684870409 1038666246 /nfs/dbraw/zinc/66/62/46/1038666246.db2.gz FSIHLANIWZOXEI-GWCFXTLKSA-N -1 1 315.335 4.062 20 0 DIADMM CC(C)[C@@H](C)N(C(=O)c1ccc(C(F)(F)F)c([O-])c1)C1CC1 ZINC000684874426 1038670372 /nfs/dbraw/zinc/67/03/72/1038670372.db2.gz NTVZLNHAJIHANB-SNVBAGLBSA-N -1 1 315.335 4.060 20 0 DIADMM O=C(Nc1c([O-])cccc1F)[C@H]1C[C@@H]1c1cccc2ccccc21 ZINC000608367201 1038830305 /nfs/dbraw/zinc/83/03/05/1038830305.db2.gz MQMYQYNZINWIGD-CVEARBPZSA-N -1 1 321.351 4.427 20 0 DIADMM Cc1ccsc1CN(C)C(=O)c1ccc2ccccc2c1[O-] ZINC000078566830 1038975516 /nfs/dbraw/zinc/97/55/16/1038975516.db2.gz FBLZVHNRVUXEBV-UHFFFAOYSA-N -1 1 311.406 4.188 20 0 DIADMM CC(=O)[C@H](C)CCCCc1nc(-c2ccc([O-])cc2Cl)no1 ZINC000278093142 1039151073 /nfs/dbraw/zinc/15/10/73/1039151073.db2.gz HJFRJQLNJMAYBF-SNVBAGLBSA-N -1 1 322.792 4.034 20 0 DIADMM COc1cc(OC)c(Nc2cc(F)c([O-])c(F)c2)cc1Cl ZINC001213379352 1039202537 /nfs/dbraw/zinc/20/25/37/1039202537.db2.gz QXSNGRYUCSGGOM-UHFFFAOYSA-N -1 1 315.703 4.085 20 0 DIADMM [O-]c1c(F)cc(Nc2cc3nsnc3cc2Cl)cc1F ZINC001213386578 1039339702 /nfs/dbraw/zinc/33/97/02/1039339702.db2.gz KDAJNQVDMFDTLO-UHFFFAOYSA-N -1 1 313.716 4.072 20 0 DIADMM CC(C)[C@H]1CCC[C@@H](NC(=O)c2c(F)ccc([O-])c2F)CC1 ZINC000584081121 1039596781 /nfs/dbraw/zinc/59/67/81/1039596781.db2.gz IOAXBVACGUVOGX-NWDGAFQWSA-N -1 1 311.372 4.005 20 0 DIADMM CCOc1ccc(NCc2cccc([O-])c2Cl)cc1OC ZINC000293708183 1039656922 /nfs/dbraw/zinc/65/69/22/1039656922.db2.gz XRAZKLKPDGWMMX-UHFFFAOYSA-N -1 1 307.777 4.065 20 0 DIADMM Cc1ccc(SCCC(=O)Nc2ccc([O-])c(Cl)c2)cc1 ZINC000541888074 1039757236 /nfs/dbraw/zinc/75/72/36/1039757236.db2.gz JRHVLSLORCSXNH-UHFFFAOYSA-N -1 1 321.829 4.475 20 0 DIADMM C[C@H](Cc1ccccc1F)C(=O)Nc1ccc([O-])c(Cl)c1 ZINC000150718787 1040528743 /nfs/dbraw/zinc/52/87/43/1040528743.db2.gz IROWCNQJWMJENR-SNVBAGLBSA-N -1 1 307.752 4.002 20 0 DIADMM C[C@@H]1CCC[N@@H+](Cc2sc3ccccc3c2Cl)[C@H]1C(=O)[O-] ZINC000300293327 1040985328 /nfs/dbraw/zinc/98/53/28/1040985328.db2.gz GOUQRPRTUXRJAW-MEBBXXQBSA-N -1 1 323.845 4.240 20 0 DIADMM C[C@@H]1CCCN(Cc2sc3ccccc3c2Cl)[C@H]1C(=O)[O-] ZINC000300293327 1040985345 /nfs/dbraw/zinc/98/53/45/1040985345.db2.gz GOUQRPRTUXRJAW-MEBBXXQBSA-N -1 1 323.845 4.240 20 0 DIADMM O=C([N-]C1(C(F)F)CCCC1)C(F)(F)c1cccc(Cl)c1 ZINC000809373139 1041151919 /nfs/dbraw/zinc/15/19/19/1041151919.db2.gz VAZJPXUEVORMBY-UHFFFAOYSA-N -1 1 323.717 4.126 20 0 DIADMM [O-]c1c(Cl)cc(CN2CCC3(CC(F)C3)CC2)cc1Cl ZINC001140834987 1041158685 /nfs/dbraw/zinc/15/86/85/1041158685.db2.gz IHGXJWQKYMCANM-UHFFFAOYSA-N -1 1 318.219 4.413 20 0 DIADMM O=C(c1c(F)ccc([O-])c1F)N1CCC(C2CCCCC2)CC1 ZINC000809613560 1041194826 /nfs/dbraw/zinc/19/48/26/1041194826.db2.gz YPGDXWUNJBATNT-UHFFFAOYSA-N -1 1 323.383 4.103 20 0 DIADMM COC(=O)c1ccc(C)c(-c2c(Cl)ccc([O-])c2F)c1C ZINC001244541316 1041392815 /nfs/dbraw/zinc/39/28/15/1041392815.db2.gz ASEIMBAGQUSNNH-UHFFFAOYSA-N -1 1 308.736 4.255 20 0 DIADMM CCN(C(=O)c1ccc(OC)cc1[O-])c1ccc2ccccc2c1 ZINC000747663001 1041467174 /nfs/dbraw/zinc/46/71/74/1041467174.db2.gz TUDIYGHMVVHJNX-UHFFFAOYSA-N -1 1 321.376 4.221 20 0 DIADMM Cc1ccccc1[C@H](C)CC(=O)Nc1cc([O-])c(F)cc1F ZINC001625893032 1041491628 /nfs/dbraw/zinc/49/16/28/1041491628.db2.gz DNTKZVCJIGONPG-LLVKDONJSA-N -1 1 305.324 4.111 20 0 DIADMM CC(C)(C)c1ccc(C(=O)Nc2cc([O-])c(F)cc2F)s1 ZINC001625894025 1041498581 /nfs/dbraw/zinc/49/85/81/1041498581.db2.gz OUWPPNLPSLQMKU-UHFFFAOYSA-N -1 1 311.353 4.282 20 0 DIADMM Cc1nc(Cl)ccc1NC(=O)c1ccc2ccccc2c1[O-] ZINC000318594705 1041590576 /nfs/dbraw/zinc/59/05/76/1041590576.db2.gz GKCRWCJKXWYUNZ-UHFFFAOYSA-N -1 1 312.756 4.155 20 0 DIADMM Cc1ccccc1C[C@@H](C)NC(=O)c1ccc2ccccc2c1[O-] ZINC001626287576 1041595428 /nfs/dbraw/zinc/59/54/28/1041595428.db2.gz CPDRGEUCLNSZBR-OAHLLOKOSA-N -1 1 319.404 4.215 20 0 DIADMM [O-]c1cccc(CNc2ccnn2C2CCCCC2)c1Cl ZINC000815121704 1041915517 /nfs/dbraw/zinc/91/55/17/1041915517.db2.gz OIOKAHUXMPLOLM-UHFFFAOYSA-N -1 1 305.809 4.359 20 0 DIADMM Cc1ccc(Cl)cc1NC(=O)Cc1ccc([O-])c(Cl)c1 ZINC001135312147 1042011819 /nfs/dbraw/zinc/01/18/19/1042011819.db2.gz DMDMYNLRNICRDR-UHFFFAOYSA-N -1 1 310.180 4.189 20 0 DIADMM CC(F)(F)C(=O)[N-][C@@H](c1cccc2ccccc21)C(F)(F)F ZINC000816030812 1042016874 /nfs/dbraw/zinc/01/68/74/1042016874.db2.gz COQHBOJWMKZEHS-LBPRGKRZSA-N -1 1 317.257 4.215 20 0 DIADMM Cc1c(=O)[n-]c(SC[C@@H]2C[C@H]3C[C@H]3C2)nc1-c1ccccc1 ZINC000663247834 1042086568 /nfs/dbraw/zinc/08/65/68/1042086568.db2.gz IKIGKYDNADAZMQ-YOWGUQMCSA-N -1 1 312.438 4.296 20 0 DIADMM CCc1ccc(C(=O)Nc2nc(-c3ccccc3)cs2)c([O-])c1 ZINC001135795504 1042091230 /nfs/dbraw/zinc/09/12/30/1042091230.db2.gz WUFKTRBMGOXYSG-UHFFFAOYSA-N -1 1 324.405 4.330 20 0 DIADMM O=C(c1cc(Cl)ccc1[O-])N1CCC[C@H]1c1ccccc1 ZINC001135937158 1042114235 /nfs/dbraw/zinc/11/42/35/1042114235.db2.gz HBFUCKPNVHFGQA-HNNXBMFYSA-N -1 1 301.773 4.023 20 0 DIADMM O=C(c1cc(Cl)ccc1[O-])N1CCC[C@@H]1c1ccccc1 ZINC001135937159 1042114276 /nfs/dbraw/zinc/11/42/76/1042114276.db2.gz HBFUCKPNVHFGQA-OAHLLOKOSA-N -1 1 301.773 4.023 20 0 DIADMM CC(C)(C)C[C@@H](NC(=O)c1ccc([O-])c(F)c1)c1ccccc1 ZINC001136236329 1042189063 /nfs/dbraw/zinc/18/90/63/1042189063.db2.gz SOXKSQQJRYDALH-MRXNPFEDSA-N -1 1 315.388 4.439 20 0 DIADMM C[C@H]1Cc2ccccc2N1C(=O)c1ccc2ccccc2c1[O-] ZINC000319762175 1042248442 /nfs/dbraw/zinc/24/84/42/1042248442.db2.gz CTRHJBHNIPUUEB-ZDUSSCGKSA-N -1 1 303.361 4.137 20 0 DIADMM Cc1ccc(Oc2ccc(NC(=O)c3cncc([O-])c3)cc2)cc1 ZINC001136441401 1042249296 /nfs/dbraw/zinc/24/92/96/1042249296.db2.gz DDECJBVPBJZBOP-UHFFFAOYSA-N -1 1 320.348 4.140 20 0 DIADMM CCCCN(C(=O)c1ccc(F)c([O-])c1)[C@@H](C)c1ccc(C)o1 ZINC001136443531 1042251226 /nfs/dbraw/zinc/25/12/26/1042251226.db2.gz FSJXQLLFADTMCF-ZDUSSCGKSA-N -1 1 319.376 4.436 20 0 DIADMM CC1(C)CC[C@H](NC(=O)c2ccc(F)c([O-])c2)c2ccccc21 ZINC001136448224 1042251707 /nfs/dbraw/zinc/25/17/07/1042251707.db2.gz YCJWNRSMLYYTSD-INIZCTEOSA-N -1 1 313.372 4.074 20 0 DIADMM CC(C)[C@H]1CC[C@@H](C)C[C@@H]1CNC(=O)c1cc(Cl)ccc1[O-] ZINC001136487106 1042263761 /nfs/dbraw/zinc/26/37/61/1042263761.db2.gz AQEYEJSHVILWJH-UMVBOHGHSA-N -1 1 323.864 4.484 20 0 DIADMM Cc1oc(C(C)(C)C)cc1C(=O)Nc1cc([O-])c(F)cc1F ZINC000822543307 1042291095 /nfs/dbraw/zinc/29/10/95/1042291095.db2.gz SZJNNKAVHSOIAS-UHFFFAOYSA-N -1 1 309.312 4.122 20 0 DIADMM O=C(C/C=C/Cc1ccccc1)Nc1ccc([O-])c(Cl)c1 ZINC001137674123 1042334865 /nfs/dbraw/zinc/33/48/65/1042334865.db2.gz GSECECXAWMTISM-SNAWJCMRSA-N -1 1 301.773 4.173 20 0 DIADMM CCOc1cc(F)c(F)cc1Nc1ccc(F)c(F)c1[O-] ZINC001211807275 1042456508 /nfs/dbraw/zinc/45/65/08/1042456508.db2.gz ACYYQLAXGLSYBY-UHFFFAOYSA-N -1 1 301.239 4.091 20 0 DIADMM Cc1ccc(Cl)cc1S(=O)(=O)[N-]c1cccc(Cl)c1 ZINC000031665490 1042721099 /nfs/dbraw/zinc/72/10/99/1042721099.db2.gz QMCJVPKICNYDAA-UHFFFAOYSA-N -1 1 316.209 4.103 20 0 DIADMM CCN(Cc1cccc(F)c1)[C@H](C)c1cc(C)c(C(=O)[O-])o1 ZINC000519712767 1043000658 /nfs/dbraw/zinc/00/06/58/1043000658.db2.gz WXZDPGBLPNNIFI-GFCCVEGCSA-N -1 1 305.349 4.008 20 0 DIADMM CC[C@@H](C)[C@@H](NC(=O)Nc1ccc([O-])c(Cl)c1)C(F)(F)F ZINC000520331380 1043034626 /nfs/dbraw/zinc/03/46/26/1043034626.db2.gz ABSBKZFTAIPVKW-RDDDGLTNSA-N -1 1 324.730 4.144 20 0 DIADMM O=C([O-])CC[C@@H]1CCCCN1Cc1ccc(Cl)c(Cl)c1 ZINC000050924537 1043063575 /nfs/dbraw/zinc/06/35/75/1043063575.db2.gz LDHKJHFKVJHFOO-LBPRGKRZSA-N -1 1 316.228 4.213 20 0 DIADMM Cc1ccc(CSc2nc(C)c(C3CC3)c(=O)[n-]2)c(Cl)n1 ZINC000865373461 1043088095 /nfs/dbraw/zinc/08/80/95/1043088095.db2.gz VQEGRZOUZPDPTF-UHFFFAOYSA-N -1 1 321.833 4.017 20 0 DIADMM Cc1nc(SCc2ccc(CF)cc2)[n-]c(=O)c1C1CC1 ZINC000865373463 1043088795 /nfs/dbraw/zinc/08/87/95/1043088795.db2.gz VSNZWBQULQGMLB-UHFFFAOYSA-N -1 1 304.390 4.130 20 0 DIADMM Cc1nc(SCCCSC(C)(C)C)[n-]c(=O)c1C1CC1 ZINC000865373319 1043088894 /nfs/dbraw/zinc/08/88/94/1043088894.db2.gz OYUIRDIPSPNQJG-UHFFFAOYSA-N -1 1 312.504 4.382 20 0 DIADMM O=C(Nc1cccc(C2SCCS2)c1)c1ccccc1[O-] ZINC000018216400 1043349653 /nfs/dbraw/zinc/34/96/53/1043349653.db2.gz XRYUSIDDRKACJY-UHFFFAOYSA-N -1 1 317.435 4.123 20 0 DIADMM O=C([N-]c1cc(F)c(F)cc1F)c1cc(-c2ccccc2)no1 ZINC000521511523 1043405797 /nfs/dbraw/zinc/40/57/97/1043405797.db2.gz OFZPWJHPOMEXNI-UHFFFAOYSA-N -1 1 318.254 4.011 20 0 DIADMM Cc1cc(CN[C@@H](CC(=O)[O-])c2ccccc2Cl)cs1 ZINC000871883179 1043412128 /nfs/dbraw/zinc/41/21/28/1043412128.db2.gz FGNKKCZWIKCXHH-AWEZNQCLSA-N -1 1 309.818 4.016 20 0 DIADMM Cc1c2cc(F)ccc2oc1C(=O)Nc1ccc([O-])c(Cl)c1 ZINC000349256621 1043499912 /nfs/dbraw/zinc/49/99/12/1043499912.db2.gz FZVRAWMZDPVPAW-UHFFFAOYSA-N -1 1 319.719 4.492 20 0 DIADMM CCc1nc(S[C@@H](C)c2nc3ccccc3o2)[n-]c(=O)c1C ZINC000522015165 1043523374 /nfs/dbraw/zinc/52/33/74/1043523374.db2.gz SRPJIWBBDYZHLV-JTQLQIEISA-N -1 1 315.398 4.048 20 0 DIADMM Cc1ccc2c(c1)[C@@H]([NH2+]Cc1c(F)ccc(O)c1F)CCC2 ZINC000353529644 1043613156 /nfs/dbraw/zinc/61/31/56/1043613156.db2.gz JZYRZKIZPVYBIY-INIZCTEOSA-N -1 1 303.352 4.146 20 0 DIADMM O=C(Nc1ccc([O-])c(Cl)c1)[C@@H]1C[C@@H]1c1ccc(F)cc1F ZINC000113460973 1043641319 /nfs/dbraw/zinc/64/13/19/1043641319.db2.gz NCOQMTCONJPBOV-VXGBXAGGSA-N -1 1 323.726 4.066 20 0 DIADMM CCC(CC)CCC[N@@H+](C)Cc1nnc(-c2ccccc2O)o1 ZINC000878993453 1043934230 /nfs/dbraw/zinc/93/42/30/1043934230.db2.gz FRGXZBQNNBXKLG-UHFFFAOYSA-N -1 1 317.433 4.090 20 0 DIADMM Cc1nc(SCC[C@@H]2CCCC2(F)F)[n-]c(=O)c1C1CC1 ZINC000882277249 1044162330 /nfs/dbraw/zinc/16/23/30/1044162330.db2.gz CBYYLACXUZRVTB-NSHDSACASA-N -1 1 314.401 4.286 20 0 DIADMM Cc1ccc([C@@H]([N-]c2nnc(C(C)(C)C)o2)c2ccccn2)cc1 ZINC000882286311 1044162506 /nfs/dbraw/zinc/16/25/06/1044162506.db2.gz FQCQCXWMKAJRPN-MRXNPFEDSA-N -1 1 322.412 4.272 20 0 DIADMM C[C@@H](Oc1[n-]c(=S)ncc1F)c1c(Cl)cccc1Cl ZINC001227386913 1044223033 /nfs/dbraw/zinc/22/30/33/1044223033.db2.gz QJVMLFGAACGJNK-ZCFIWIBFSA-N -1 1 319.188 4.351 20 0 DIADMM C[C@@H](c1ccc(Cl)cc1Cl)N1CCC(C)(C(=O)[O-])CC1 ZINC000086776639 1044241227 /nfs/dbraw/zinc/24/12/27/1044241227.db2.gz KHTUFNXUWNTVLC-JTQLQIEISA-N -1 1 316.228 4.241 20 0 DIADMM C[C@H](c1cc(Cl)ccc1Cl)N1CCC(C)(C(=O)[O-])CC1 ZINC000086776890 1044241653 /nfs/dbraw/zinc/24/16/53/1044241653.db2.gz RIKWFBKOTOHIQY-SNVBAGLBSA-N -1 1 316.228 4.241 20 0 DIADMM O=C(Nc1c([O-])cccc1F)c1cc(C2CC2)oc1C1CC1 ZINC000935100988 1044312623 /nfs/dbraw/zinc/31/26/23/1044312623.db2.gz RUMRIQVGMWKPDG-UHFFFAOYSA-N -1 1 301.317 4.131 20 0 DIADMM CC[C@](C)(NCc1cccc([O-])c1Cl)c1nc(C)cs1 ZINC000293694108 1044314815 /nfs/dbraw/zinc/31/48/15/1044314815.db2.gz WNBTVWQHADBYFL-HNNXBMFYSA-N -1 1 310.850 4.226 20 0 DIADMM Cc1cc(C(=O)Nc2ccc([O-])c(Cl)c2)c(Cl)cc1F ZINC000132125874 1044316200 /nfs/dbraw/zinc/31/62/00/1044316200.db2.gz VTXKPTBZTQYOIQ-UHFFFAOYSA-N -1 1 314.143 4.399 20 0 DIADMM CCc1nc(S[C@H]2CCCc3ccccc32)[n-]c(=O)c1C ZINC000564227624 1044360322 /nfs/dbraw/zinc/36/03/22/1044360322.db2.gz QXVIGYYSFNRBQM-HNNXBMFYSA-N -1 1 300.427 4.223 20 0 DIADMM CC1(C)CN(Cc2cccc([O-])c2Cl)[C@H]1c1cccnc1 ZINC000294021347 1044367278 /nfs/dbraw/zinc/36/72/78/1044367278.db2.gz UYNUVUTXZPGIPX-INIZCTEOSA-N -1 1 302.805 4.024 20 0 DIADMM Cc1ccc(F)cc1S(=O)(=O)[N-]c1ccc(C(C)C)cc1 ZINC000614736691 1044400616 /nfs/dbraw/zinc/40/06/16/1044400616.db2.gz HBOWMBXUAQOXSW-UHFFFAOYSA-N -1 1 307.390 4.058 20 0 DIADMM CCC/C(C)=C\C(=O)Nc1cc(C)cc(Br)c1[O-] ZINC000778447983 1044404180 /nfs/dbraw/zinc/40/41/80/1044404180.db2.gz HXVNGSLTYAXDTB-HJWRWDBZSA-N -1 1 312.207 4.148 20 0 DIADMM CCc1nc(SCc2ccccc2OC(C)C)[n-]c(=O)c1C ZINC000566864509 1044523722 /nfs/dbraw/zinc/52/37/22/1044523722.db2.gz IFZLESMPKCHQHG-UHFFFAOYSA-N -1 1 318.442 4.133 20 0 DIADMM CC(C)N(CC1CCC1)C(=O)c1ccc(C(F)(F)F)cc1[O-] ZINC000444524901 1044565008 /nfs/dbraw/zinc/56/50/08/1044565008.db2.gz GLIOHJICSGRXTG-UHFFFAOYSA-N -1 1 315.335 4.062 20 0 DIADMM CCCCS[C@H](C)C(=O)Nc1cc(F)c([O-])cc1Cl ZINC000885674960 1044585566 /nfs/dbraw/zinc/58/55/66/1044585566.db2.gz XEALLNPVPOHJRH-MRVPVSSYSA-N -1 1 305.802 4.045 20 0 DIADMM Cc1ccc(C(=O)Nc2cc(F)c([O-])cc2Cl)c(C(C)C)n1 ZINC000885677961 1044585719 /nfs/dbraw/zinc/58/57/19/1044585719.db2.gz FFVKRCABVYKIOA-UHFFFAOYSA-N -1 1 322.767 4.264 20 0 DIADMM C[C@@H](c1cc(Cl)ccc1Cl)N1CC[C@@H](C)[C@H](C(=O)[O-])C1 ZINC000567856531 1044588539 /nfs/dbraw/zinc/58/85/39/1044588539.db2.gz LYPYORBNWHQBLQ-GBIKHYSHSA-N -1 1 316.228 4.097 20 0 DIADMM CCOc1cc(-c2noc([C@H]3C[C@@]3(C)CC)n2)cc(Cl)c1[O-] ZINC000445408882 1044713623 /nfs/dbraw/zinc/71/36/23/1044713623.db2.gz OGBJORJUYKYBCV-QLJPJBMISA-N -1 1 322.792 4.398 20 0 DIADMM Cc1ccc(CCc2nc(-c3ccc([O-])cc3Cl)no2)cc1 ZINC000445450288 1044718437 /nfs/dbraw/zinc/71/84/37/1044718437.db2.gz RVDZQYGPVLLXMS-UHFFFAOYSA-N -1 1 314.772 4.189 20 0 DIADMM Cc1ccc(Cc2nc(-c3ccc([O-])cc3Cl)no2)s1 ZINC000445446687 1044722947 /nfs/dbraw/zinc/72/29/47/1044722947.db2.gz FJJVCOVBITVJSA-UHFFFAOYSA-N -1 1 306.774 4.056 20 0 DIADMM [O-]c1ccc(-c2noc(-c3ccnc4ccccc43)n2)c(Cl)c1 ZINC000445445307 1044723496 /nfs/dbraw/zinc/72/34/96/1044723496.db2.gz IZPMPCOHCKNNCK-UHFFFAOYSA-N -1 1 323.739 4.311 20 0 DIADMM Cc1c(-c2nc(-c3ccc([O-])c(F)c3)no2)cnc2ccccc12 ZINC000445467560 1044725036 /nfs/dbraw/zinc/72/50/36/1044725036.db2.gz AQJHWXQOXFSBFQ-UHFFFAOYSA-N -1 1 321.311 4.105 20 0 DIADMM C[C@@H](Cc1ccccc1F)c1nc(-c2ccc([O-])c(F)c2)no1 ZINC000445477411 1044729912 /nfs/dbraw/zinc/72/99/12/1044729912.db2.gz NZMHEJKCHOTQDF-JTQLQIEISA-N -1 1 316.307 4.067 20 0 DIADMM C[C@H](Cc1nc(-c2ccc([O-])c(F)c2)no1)c1ccccc1F ZINC000445477719 1044730194 /nfs/dbraw/zinc/73/01/94/1044730194.db2.gz PCNOLWRELIIMCE-SNVBAGLBSA-N -1 1 316.307 4.067 20 0 DIADMM C[C@@H](Cc1nc(-c2ccc([O-])c(F)c2)no1)c1ccc(F)cc1 ZINC000445482448 1044731658 /nfs/dbraw/zinc/73/16/58/1044731658.db2.gz PWSPFWYQOZKEEO-JTQLQIEISA-N -1 1 316.307 4.067 20 0 DIADMM CCSc1ccc(Cl)cc1[N-]C(=O)c1ccc(C(C)=O)o1 ZINC000446078438 1044896260 /nfs/dbraw/zinc/89/62/60/1044896260.db2.gz GZWNKSBZYSABSI-UHFFFAOYSA-N -1 1 323.801 4.500 20 0 DIADMM Cc1noc(C(C)C)c1[N-]C(=O)c1cc(F)c(Cl)cc1F ZINC000928785847 1044975521 /nfs/dbraw/zinc/97/55/21/1044975521.db2.gz IKEVQAUBKURARB-UHFFFAOYSA-N -1 1 314.719 4.290 20 0 DIADMM Cc1c(Cl)cc(F)c([N-]C(=O)c2ocnc2C2CC2)c1F ZINC000575090181 1044986042 /nfs/dbraw/zinc/98/60/42/1044986042.db2.gz PTYYHTCONPGANZ-UHFFFAOYSA-N -1 1 312.703 4.044 20 0 DIADMM CCN(Cc1cc(C(=O)[O-])c(C)o1)[C@H](C)c1ccc(F)cc1 ZINC000577404203 1045120932 /nfs/dbraw/zinc/12/09/32/1045120932.db2.gz GJEOTWNGRHCJMO-LLVKDONJSA-N -1 1 305.349 4.008 20 0 DIADMM Cc1c2cccc(F)c2oc1C(=O)Nc1ccc([O-])c(Cl)c1 ZINC000601053571 1045179190 /nfs/dbraw/zinc/17/91/90/1045179190.db2.gz CJNWSGBIKQRUCX-UHFFFAOYSA-N -1 1 319.719 4.492 20 0 DIADMM O=S(=O)([N-]c1cccc(Cl)c1)c1ccc(C(F)F)cc1 ZINC000578358961 1045234058 /nfs/dbraw/zinc/23/40/58/1045234058.db2.gz PUOHWYWYENPCIP-UHFFFAOYSA-N -1 1 317.744 4.078 20 0 DIADMM Cc1cc(F)ccc1[N-]S(=O)(=O)c1cccc2ccccc21 ZINC000389660588 1045404086 /nfs/dbraw/zinc/40/40/86/1045404086.db2.gz RNYMNQURBNVBNS-UHFFFAOYSA-N -1 1 315.369 4.088 20 0 DIADMM O=C(Nc1cc(Cl)c([O-])c2ccccc12)[C@H]1CCCS1 ZINC000628233330 1045549200 /nfs/dbraw/zinc/54/92/00/1045549200.db2.gz WLNMDPKBIQSUBK-CYBMUJFWSA-N -1 1 307.802 4.033 20 0 DIADMM CCC(C)(C)OCC(=O)Nc1cc(Cl)c([O-])c2ccccc12 ZINC000628233413 1045551723 /nfs/dbraw/zinc/55/17/23/1045551723.db2.gz ATXASANHTNKDLZ-UHFFFAOYSA-N -1 1 321.804 4.343 20 0 DIADMM CCn1c2ccccc2c2cc(C=C3SC(=O)[N-]C3=O)ccc21 ZINC000115654539 1045572911 /nfs/dbraw/zinc/57/29/11/1045572911.db2.gz MXRTWMVXDVMZJB-MHWRWJLKSA-N -1 1 322.389 4.138 20 0 DIADMM O=C(Nc1ccc([O-])c(Cl)c1)c1cc(F)ccc1Cl ZINC000381856709 1045585423 /nfs/dbraw/zinc/58/54/23/1045585423.db2.gz LUGNWONSLURSPS-UHFFFAOYSA-N -1 1 300.116 4.090 20 0 DIADMM C[C@@H]1CC(C(=O)[O-])C[C@@H](C)N1Cc1cccc(Cl)c1Cl ZINC000530173437 1045613974 /nfs/dbraw/zinc/61/39/74/1045613974.db2.gz FQNZACAMFVNMMS-NXEZZACHSA-N -1 1 316.228 4.067 20 0 DIADMM C[C@@H]1CC(C(=O)[O-])C[C@@H](C)N1Cc1c(Cl)cccc1Cl ZINC000530179627 1045616233 /nfs/dbraw/zinc/61/62/33/1045616233.db2.gz NJPDMTQFFNOIKN-NXEZZACHSA-N -1 1 316.228 4.067 20 0 DIADMM O=C(Nc1ccc(N2CCCCCC2)cc1)c1ccccc1[O-] ZINC000752305531 1045673343 /nfs/dbraw/zinc/67/33/43/1045673343.db2.gz KXPSLDCDKHCFGI-UHFFFAOYSA-N -1 1 310.397 4.025 20 0 DIADMM CCOCc1cccc(NCc2c([O-])ccc(Cl)c2F)c1 ZINC000191424010 1045701842 /nfs/dbraw/zinc/70/18/42/1045701842.db2.gz PKBWUNLKKAJSDF-UHFFFAOYSA-N -1 1 309.768 4.333 20 0 DIADMM O=C1[N-]C(=S)SC1=Cc1csc(-c2cccs2)n1 ZINC000078481738 1045722841 /nfs/dbraw/zinc/72/28/41/1045722841.db2.gz SZBSNVHKJWZSTE-XBXARRHUSA-N -1 1 310.450 4.201 20 0 DIADMM C[C@H]1CC[C@H](c2nc(=O)c3cc(-c4ccccc4)sc3[n-]2)O1 ZINC000630384935 1045756258 /nfs/dbraw/zinc/75/62/58/1045756258.db2.gz JPHUGGMAKWTINZ-GXFFZTMASA-N -1 1 312.394 4.304 20 0 DIADMM C[C@@H]1CC[C@H](c2nc(=O)c3c(-c4ccccc4)csc3[n-]2)O1 ZINC000630384768 1045756563 /nfs/dbraw/zinc/75/65/63/1045756563.db2.gz HLGPHBHTOXNKPG-ZWNOBZJWSA-N -1 1 312.394 4.304 20 0 DIADMM O=C(Cc1ccc([O-])c(Cl)c1)N1CCC[C@@H]1c1cccs1 ZINC000630497264 1045765895 /nfs/dbraw/zinc/76/58/95/1045765895.db2.gz JHQPZCABKVXGAE-CYBMUJFWSA-N -1 1 321.829 4.013 20 0 DIADMM Cc1cc(C)c(/C=C/CN[C@H](C(=O)[O-])c2cccs2)cc1C ZINC000901598701 1045775894 /nfs/dbraw/zinc/77/58/94/1045775894.db2.gz PVXBCCFFNBMYIH-YXMMZVCTSA-N -1 1 315.438 4.102 20 0 DIADMM CCCCC(=O)CSc1nc(-c2ccccc2)c(C)c(=O)[n-]1 ZINC000631017656 1045795545 /nfs/dbraw/zinc/79/55/45/1045795545.db2.gz CCJHWXKROXEMGZ-UHFFFAOYSA-N -1 1 316.426 4.009 20 0 DIADMM Cc1nc(SCCO[C@H]2CCCC[C@H]2C)[n-]c(=O)c1C1CC1 ZINC000631024578 1045797176 /nfs/dbraw/zinc/79/71/76/1045797176.db2.gz BVIRFCQFZDTNFW-RISCZKNCSA-N -1 1 322.474 4.055 20 0 DIADMM Cc1nc(SCc2ccc3ncccc3c2)[n-]c(=O)c1C1CC1 ZINC000631024771 1045797202 /nfs/dbraw/zinc/79/72/02/1045797202.db2.gz ZZFYNPDPVRTTSP-UHFFFAOYSA-N -1 1 323.421 4.209 20 0 DIADMM Cc1nc(S[C@H](C)c2cccc(F)c2)[n-]c(=O)c1C1CC1 ZINC000631024233 1045797931 /nfs/dbraw/zinc/79/79/31/1045797931.db2.gz PKIOJGGTCLDLII-SNVBAGLBSA-N -1 1 304.390 4.360 20 0 DIADMM Cc1nc(SCc2ccc(Cl)cc2)[n-]c(=O)c1C1CC1 ZINC000631023466 1045798010 /nfs/dbraw/zinc/79/80/10/1045798010.db2.gz SBWGCYAQUDMJFI-UHFFFAOYSA-N -1 1 306.818 4.314 20 0 DIADMM Cc1nc(SCc2cccc3cccnc32)[n-]c(=O)c1C1CC1 ZINC000631024438 1045798549 /nfs/dbraw/zinc/79/85/49/1045798549.db2.gz TVSSEKPBNSXBTQ-UHFFFAOYSA-N -1 1 323.421 4.209 20 0 DIADMM CC(C)C[C@@H](C(=O)[O-])N(C)Cc1ccc(-c2ccccc2F)o1 ZINC000902019775 1045889349 /nfs/dbraw/zinc/88/93/49/1045889349.db2.gz SXRZMZKJIRCICA-INIZCTEOSA-N -1 1 319.376 4.017 20 0 DIADMM O=C([O-])C[N@@H+](Cc1ccc(-c2ccc(Cl)cc2)o1)C1CCC1 ZINC000902044982 1045894616 /nfs/dbraw/zinc/89/46/16/1045894616.db2.gz OPQHXHJYGCURLB-UHFFFAOYSA-N -1 1 319.788 4.039 20 0 DIADMM O=C([O-])CN(Cc1ccc(-c2ccc(Cl)cc2)o1)C1CCC1 ZINC000902044982 1045894624 /nfs/dbraw/zinc/89/46/24/1045894624.db2.gz OPQHXHJYGCURLB-UHFFFAOYSA-N -1 1 319.788 4.039 20 0 DIADMM CC[C@@H](NCc1cc(C(=O)[O-])c(C)o1)c1ccc(Cl)cc1 ZINC000902087788 1045910116 /nfs/dbraw/zinc/91/01/16/1045910116.db2.gz DFYACVDYWDOVJQ-OAHLLOKOSA-N -1 1 307.777 4.181 20 0 DIADMM C[C@@H]1C[C@@H]1c1ccc(CNCc2ccc(C(=O)[O-])c(Cl)c2)o1 ZINC000902107975 1045914579 /nfs/dbraw/zinc/91/45/79/1045914579.db2.gz IDCBRPACRPONJK-YGRLFVJLSA-N -1 1 319.788 4.044 20 0 DIADMM CCc1oc(CN[C@H](c2ccccc2)C(C)(C)C)cc1C(=O)[O-] ZINC000902123903 1045918218 /nfs/dbraw/zinc/91/82/18/1045918218.db2.gz SDFQYFVFWHASLA-QGZVFWFLSA-N -1 1 315.413 4.417 20 0 DIADMM O=C(C/C=C\Cc1ccccc1)Nc1ccc([O-])c(Cl)c1 ZINC001137674122 1045929439 /nfs/dbraw/zinc/92/94/39/1045929439.db2.gz GSECECXAWMTISM-PLNGDYQASA-N -1 1 301.773 4.173 20 0 DIADMM CCSc1ccc([C@@H](C)NCc2cc(C)c(C(=O)[O-])o2)cc1 ZINC000902221132 1045948564 /nfs/dbraw/zinc/94/85/64/1045948564.db2.gz MSNQEDCHOUWGNL-GFCCVEGCSA-N -1 1 319.426 4.249 20 0 DIADMM CCc1oc(CN[C@@H](C)c2cccc(C)c2C)cc1C(=O)[O-] ZINC000902267009 1045959255 /nfs/dbraw/zinc/95/92/55/1045959255.db2.gz AQYIKAQSPVURCW-ZDUSSCGKSA-N -1 1 301.386 4.008 20 0 DIADMM CCc1oc(CN[C@](C)(CC)c2ccc(F)cc2)cc1C(=O)[O-] ZINC000902336871 1045978679 /nfs/dbraw/zinc/97/86/79/1045978679.db2.gz QSAJGTLQMGWAGX-GOSISDBHSA-N -1 1 319.376 4.094 20 0 DIADMM Cc1oc(CNC2(c3cccc(Cl)c3)CCC2)cc1C(=O)[O-] ZINC000902373706 1045986935 /nfs/dbraw/zinc/98/69/35/1045986935.db2.gz SXYXHKFTGBQZEY-UHFFFAOYSA-N -1 1 319.788 4.109 20 0 DIADMM CC(C)(CC1CCCCCC1)NC(=O)c1ccc([O-])cc1F ZINC001138278484 1046136395 /nfs/dbraw/zinc/13/63/95/1046136395.db2.gz RVCWENXJEWRLRN-UHFFFAOYSA-N -1 1 307.409 4.400 20 0 DIADMM CC(C)c1cccc(CNC(=O)c2ccc(Cl)cc2[O-])c1 ZINC001138318934 1046151130 /nfs/dbraw/zinc/15/11/30/1046151130.db2.gz CDFZNPNPUZWSKT-UHFFFAOYSA-N -1 1 303.789 4.099 20 0 DIADMM Cc1nnc(C(=O)[N-]c2ccccc2SC2CCCC2)s1 ZINC000666250690 1046273114 /nfs/dbraw/zinc/27/31/14/1046273114.db2.gz YSDAISBJKPTGPJ-UHFFFAOYSA-N -1 1 319.455 4.134 20 0 DIADMM CCc1cccc(NC(=O)Nc2cc([O-])c(Cl)cc2F)c1 ZINC001202886333 1046354566 /nfs/dbraw/zinc/35/45/66/1046354566.db2.gz DRFARNIPLQCMMZ-UHFFFAOYSA-N -1 1 308.740 4.391 20 0 DIADMM C[C@@H](c1cc(Cl)ccc1Cl)[N@H+]1CCC[C@@H](CC(=O)[O-])C1 ZINC000226420765 1046397094 /nfs/dbraw/zinc/39/70/94/1046397094.db2.gz SYJBBXCMZPOPLK-QWRGUYRKSA-N -1 1 316.228 4.241 20 0 DIADMM C[C@@H](c1cc(Cl)ccc1Cl)N1CCC[C@@H](CC(=O)[O-])C1 ZINC000226420765 1046397109 /nfs/dbraw/zinc/39/71/09/1046397109.db2.gz SYJBBXCMZPOPLK-QWRGUYRKSA-N -1 1 316.228 4.241 20 0 DIADMM CCCN1C(=O)c2ccccc2N[C@H]1c1cccc([O-])c1Cl ZINC000639431333 1046399702 /nfs/dbraw/zinc/39/97/02/1046399702.db2.gz PBVBZSHMSPVFBE-MRXNPFEDSA-N -1 1 316.788 4.022 20 0 DIADMM C[C@@H]1CCC[C@H](CNC(=O)c2ccc3ccccc3c2[O-])[C@H]1C ZINC001139524616 1046463713 /nfs/dbraw/zinc/46/37/13/1046463713.db2.gz SFAIHEJQOLRWGE-IJEWVQPXSA-N -1 1 311.425 4.348 20 0 DIADMM Cc1cc(C)c(NC(=O)Nc2cc(Cl)ncc2[O-])c(C)c1 ZINC001202950734 1046478239 /nfs/dbraw/zinc/47/82/39/1046478239.db2.gz HEMJXLDBIOMCNZ-UHFFFAOYSA-N -1 1 305.765 4.010 20 0 DIADMM Cc1[nH]c2ccc(Cl)cc2c1C(=O)Nc1c([O-])cccc1F ZINC000677892063 1046535531 /nfs/dbraw/zinc/53/55/31/1046535531.db2.gz UCBWERUHILOBFA-UHFFFAOYSA-N -1 1 318.735 4.227 20 0 DIADMM O=C(Nc1c([O-])cccc1F)c1cc2ccc(F)cc2s1 ZINC000678374366 1046626402 /nfs/dbraw/zinc/62/64/02/1046626402.db2.gz GTNQCQHGVRFTAB-UHFFFAOYSA-N -1 1 305.305 4.137 20 0 DIADMM C[C@H](CCCc1ccccc1)C(=O)Nc1c([O-])cccc1F ZINC000678864204 1046724002 /nfs/dbraw/zinc/72/40/02/1046724002.db2.gz OUURLEIOGFJPGK-CYBMUJFWSA-N -1 1 301.361 4.129 20 0 DIADMM CCSc1cccc(-c2nc3cccc(F)c3c(=O)[n-]2)c1 ZINC000644623273 1046729171 /nfs/dbraw/zinc/72/91/71/1046729171.db2.gz WSRGIBIRKNXMTB-UHFFFAOYSA-N -1 1 300.358 4.254 20 0 DIADMM O=C([O-])c1ccccc1CN1CCC[C@H]1c1cc(F)ccc1F ZINC001140506586 1046759191 /nfs/dbraw/zinc/75/91/91/1046759191.db2.gz URBWAIGIPAZFLU-KRWDZBQOSA-N -1 1 317.335 4.000 20 0 DIADMM CC(=O)Nc1c(C)ccc(NCc2cccc([O-])c2Cl)c1C ZINC000645147769 1046768930 /nfs/dbraw/zinc/76/89/30/1046768930.db2.gz RFQQQPQDTMEFDL-UHFFFAOYSA-N -1 1 318.804 4.233 20 0 DIADMM [O-]c1cccc(CNc2ccccc2OCC2CC2)c1Cl ZINC000645157427 1046771116 /nfs/dbraw/zinc/77/11/16/1046771116.db2.gz DXIVMYMCGFECQH-UHFFFAOYSA-N -1 1 303.789 4.447 20 0 DIADMM CCc1c(NCc2cccc([O-])c2Cl)cnn1CC(C)C ZINC000645170051 1046772812 /nfs/dbraw/zinc/77/28/12/1046772812.db2.gz REFILDPVWAUMDK-UHFFFAOYSA-N -1 1 307.825 4.073 20 0 DIADMM COc1cc(NCc2cccc([O-])c2Cl)cc2cccnc21 ZINC000645182034 1046775171 /nfs/dbraw/zinc/77/51/71/1046775171.db2.gz XZQAOWNGNDJVFP-UHFFFAOYSA-N -1 1 314.772 4.215 20 0 DIADMM [O-]c1cccc(CNCc2cc(F)c(Cl)cc2F)c1Cl ZINC000645178100 1046776434 /nfs/dbraw/zinc/77/64/34/1046776434.db2.gz YFWLCTBNHIAYIH-UHFFFAOYSA-N -1 1 318.150 4.267 20 0 DIADMM C[C@@H](C(=O)Nc1ccc([O-])c(F)c1F)c1ccc(Cl)cc1 ZINC001140657128 1046840703 /nfs/dbraw/zinc/84/07/03/1046840703.db2.gz KPZHXHZAFGOERI-MRVPVSSYSA-N -1 1 311.715 4.066 20 0 DIADMM CC(C)C1CCC(CNC(=O)Cc2ccc([O-])c(Cl)c2)CC1 ZINC001137376210 1046850373 /nfs/dbraw/zinc/85/03/73/1046850373.db2.gz RXVQCEKABZSNTO-UHFFFAOYSA-N -1 1 323.864 4.167 20 0 DIADMM [O-]c1ccc(CN2CCC[C@H]2c2ccccc2F)c(F)c1F ZINC001140894387 1046946801 /nfs/dbraw/zinc/94/68/01/1046946801.db2.gz WIIKYXIITIDUEF-AWEZNQCLSA-N -1 1 307.315 4.147 20 0 DIADMM CCC[C@@H](NC(=O)c1c([O-])cnc2c(F)cccc21)C(C)(C)C ZINC001141013556 1046979891 /nfs/dbraw/zinc/97/98/91/1046979891.db2.gz NHNBADROISFUJN-CQSZACIVSA-N -1 1 318.392 4.024 20 0 DIADMM CC(C)c1ccc(C(=O)N(C)c2cccc3cccnc32)c([O-])c1 ZINC000647656622 1047014627 /nfs/dbraw/zinc/01/46/27/1047014627.db2.gz RVJBLEXOVHEFAS-UHFFFAOYSA-N -1 1 320.392 4.340 20 0 DIADMM CCCCN(Cc1ccccc1F)C(=O)c1ccc([O-])c(F)c1 ZINC000681017458 1047082394 /nfs/dbraw/zinc/08/23/94/1047082394.db2.gz ZQFKQMPYWWIAFO-UHFFFAOYSA-N -1 1 319.351 4.113 20 0 DIADMM CCCN(C(=O)c1ccc([O-])c(F)c1)[C@@H]1CCc2ccccc21 ZINC000681036392 1047084888 /nfs/dbraw/zinc/08/48/88/1047084888.db2.gz YCXAWUXQJLIWJS-QGZVFWFLSA-N -1 1 313.372 4.071 20 0 DIADMM C[C@H](NC(=O)c1ccc([O-])c(F)c1)c1cc2ccccc2s1 ZINC000681042629 1047086226 /nfs/dbraw/zinc/08/62/26/1047086226.db2.gz AEYLKXMTXVKINJ-JTQLQIEISA-N -1 1 315.369 4.237 20 0 DIADMM Cc1cccc([C@H]2CCCN2C(=O)c2ccc([O-])c(F)c2)c1C ZINC000681049076 1047087903 /nfs/dbraw/zinc/08/79/03/1047087903.db2.gz LRTBUMMEVSBPMZ-QGZVFWFLSA-N -1 1 313.372 4.125 20 0 DIADMM CC[C@H](Cc1ccccc1)N(CC)C(=O)c1ccc([O-])c(F)c1 ZINC000681056000 1047089175 /nfs/dbraw/zinc/08/91/75/1047089175.db2.gz SRCKNRYPXWERKV-MRXNPFEDSA-N -1 1 315.388 4.015 20 0 DIADMM O=C(c1ccc([O-])c(F)c1)N1CC2(CCCC2)c2ccccc21 ZINC000681055037 1047089387 /nfs/dbraw/zinc/08/93/87/1047089387.db2.gz PJCWUEUDQZCHNI-UHFFFAOYSA-N -1 1 311.356 4.004 20 0 DIADMM C[C@H]1CCN(C(=O)c2ccc(F)c([O-])c2)c2ccccc2S1 ZINC001141334742 1047096389 /nfs/dbraw/zinc/09/63/89/1047096389.db2.gz XOTIFIHWLGBWMR-NSHDSACASA-N -1 1 317.385 4.062 20 0 DIADMM CCC[C@@H](C)[C@@H]1CCCN1C(=O)Cc1ccc([O-])c(Cl)c1 ZINC001137435589 1047113364 /nfs/dbraw/zinc/11/33/64/1047113364.db2.gz AGOWRCHLFUKQRS-DOMZBBRYSA-N -1 1 309.837 4.015 20 0 DIADMM CC[C@@H](C)CO[N-]C(=O)[C@@H](CC)c1cccc(C(F)(F)F)c1 ZINC001141518568 1047157946 /nfs/dbraw/zinc/15/79/46/1047157946.db2.gz OLAHFWPKPMPJSP-RISCZKNCSA-N -1 1 317.351 4.293 20 0 DIADMM CCCCN(C(=O)c1ccc([O-])c(F)c1)[C@H]1CCC[C@H](C)C1 ZINC001141522735 1047160206 /nfs/dbraw/zinc/16/02/06/1047160206.db2.gz QTJYTQVYOWATSF-ZFWWWQNUSA-N -1 1 307.409 4.352 20 0 DIADMM O=C(N[C@H]1CCCCC12CCCC2)c1c([O-])cccc1Cl ZINC001141558469 1047185748 /nfs/dbraw/zinc/18/57/48/1047185748.db2.gz VFTQJWWOTVVPHL-AWEZNQCLSA-N -1 1 307.821 4.278 20 0 DIADMM O=C(c1ccc([O-])c(F)c1)N1CCCC2(CCCCC2)CC1 ZINC000682568635 1047204604 /nfs/dbraw/zinc/20/46/04/1047204604.db2.gz VUBKSQGFCDVJSK-UHFFFAOYSA-N -1 1 305.393 4.108 20 0 DIADMM CCCc1ccccc1[N-]S(=O)(=O)c1ccc(Cl)cc1 ZINC000032098375 1047205894 /nfs/dbraw/zinc/20/58/94/1047205894.db2.gz MWOMXFOPJFABNT-UHFFFAOYSA-N -1 1 309.818 4.093 20 0 DIADMM O=C(Nc1ccc([O-])c(Cl)c1)C12CC(c3ccccc3)(C1)C2 ZINC000682926459 1047239894 /nfs/dbraw/zinc/23/98/94/1047239894.db2.gz STJKWXGSPALZPH-UHFFFAOYSA-N -1 1 313.784 4.106 20 0 DIADMM C[C@H]1C[C@@H](C(C)(C)C)CCN1C(=O)c1cc(Cl)ccc1[O-] ZINC001141661456 1047250146 /nfs/dbraw/zinc/25/01/46/1047250146.db2.gz BJNAEIMXNGNPQJ-RYUDHWBXSA-N -1 1 309.837 4.332 20 0 DIADMM C[C@@H]1C[C@@H](C(C)(C)C)CCN1C(=O)c1cc(Cl)ccc1[O-] ZINC001141661454 1047252195 /nfs/dbraw/zinc/25/21/95/1047252195.db2.gz BJNAEIMXNGNPQJ-NEPJUHHUSA-N -1 1 309.837 4.332 20 0 DIADMM CC1(C)CC[C@@H](NC(=O)c2c([O-])cccc2F)c2ccccc21 ZINC001142531967 1047320425 /nfs/dbraw/zinc/32/04/25/1047320425.db2.gz RMTPTEYLXWNIRE-OAHLLOKOSA-N -1 1 313.372 4.074 20 0 DIADMM O=c1cc(CSc2cccc(Cl)c2)c2ccc([O-])cc2o1 ZINC000726121077 1047334981 /nfs/dbraw/zinc/33/49/81/1047334981.db2.gz PQCAXWPFGOMYDS-UHFFFAOYSA-N -1 1 318.781 4.444 20 0 DIADMM CCC[C@H](NC(=O)Cc1ccc([O-])c(Cl)c1)C1CCCC1 ZINC001142043207 1047359373 /nfs/dbraw/zinc/35/93/73/1047359373.db2.gz OIRASIPMQNZDPP-HNNXBMFYSA-N -1 1 309.837 4.063 20 0 DIADMM CC(C)(C)C[C@@H]1CCN(C(=O)c2ccc(F)c([O-])c2)C1(C)C ZINC001142066682 1047366756 /nfs/dbraw/zinc/36/67/56/1047366756.db2.gz WDARKSDAFYMTBV-ZDUSSCGKSA-N -1 1 307.409 4.208 20 0 DIADMM O=C(Nc1ccc([O-])c(Cl)c1)c1cc2cc(F)ccc2o1 ZINC000117991815 1047427714 /nfs/dbraw/zinc/42/77/14/1047427714.db2.gz RRENDSIWFRAROI-UHFFFAOYSA-N -1 1 305.692 4.183 20 0 DIADMM CCN(Cc1ccccc1F)Cc1ccc(Cl)cc1C(=O)[O-] ZINC001142660056 1047477133 /nfs/dbraw/zinc/47/71/33/1047477133.db2.gz CRDOCXUQWXEQPG-UHFFFAOYSA-N -1 1 321.779 4.199 20 0 DIADMM COc1ccc(C(=O)Nc2ccc(CCC(C)C)cc2)c([O-])c1 ZINC001142692979 1047482184 /nfs/dbraw/zinc/48/21/84/1047482184.db2.gz KOLOUQUWVQPEQX-UHFFFAOYSA-N -1 1 313.397 4.242 20 0 DIADMM CCCCc1ccc(N(C)C(=O)c2ccc(F)c([O-])c2)cc1 ZINC001149248798 1047558474 /nfs/dbraw/zinc/55/84/74/1047558474.db2.gz BHPFZPFNULQHBL-UHFFFAOYSA-N -1 1 301.361 4.151 20 0 DIADMM C[C@@H]1CC[C@](C)(/C=C/C(=O)Nc2cccc(F)c2[O-])C1(C)C ZINC001151779719 1047601812 /nfs/dbraw/zinc/60/18/12/1047601812.db2.gz KWTCMXRVMVUEAX-AJDAEKEXSA-N -1 1 305.393 4.488 20 0 DIADMM O=C(Nc1csc2cnccc12)c1c([O-])ccc2ccccc21 ZINC001153499402 1047625920 /nfs/dbraw/zinc/62/59/20/1047625920.db2.gz VKSUPXXZCFVIRP-UHFFFAOYSA-N -1 1 320.373 4.407 20 0 DIADMM Cc1nc2c(cccc2NC(=O)c2c([O-])ccc3ccccc32)o1 ZINC001153504062 1047627140 /nfs/dbraw/zinc/62/71/40/1047627140.db2.gz BVLOCGREQQAYGS-UHFFFAOYSA-N -1 1 318.332 4.247 20 0 DIADMM O=C(/C=C\c1ccc(Cl)cc1)NCc1ccc([O-])c(Cl)c1 ZINC001154105628 1047640090 /nfs/dbraw/zinc/64/00/90/1047640090.db2.gz JYIXCFHATXMRGC-YWEYNIOJSA-N -1 1 322.191 4.029 20 0 DIADMM CCc1ccc([C@@H](C)C(=O)NCc2ccc([O-])c(Cl)c2)cc1 ZINC001154105796 1047640332 /nfs/dbraw/zinc/64/03/32/1047640332.db2.gz RASIHIDDOGGHQT-GFCCVEGCSA-N -1 1 317.816 4.028 20 0 DIADMM CC[C@H](CC(C)C)C(=O)Nc1ccc(Br)c([O-])c1 ZINC001154321163 1047645321 /nfs/dbraw/zinc/64/53/21/1047645321.db2.gz CQDNUGGRQUVZGO-SNVBAGLBSA-N -1 1 314.223 4.166 20 0 DIADMM CC(C)CCCCC(=O)Nc1ccc(Br)c([O-])c1 ZINC001154321198 1047645521 /nfs/dbraw/zinc/64/55/21/1047645521.db2.gz DZUXTYVGASFODM-UHFFFAOYSA-N -1 1 314.223 4.310 20 0 DIADMM CCN(C(=O)c1ccc(C(F)(F)F)cc1[O-])c1ccccc1C ZINC000538511273 1047685298 /nfs/dbraw/zinc/68/52/98/1047685298.db2.gz XCFQQUAKRQESTH-UHFFFAOYSA-N -1 1 323.314 4.386 20 0 DIADMM CCCc1cc(=O)[n-]c(S[C@H](C)c2nc3ccccc3o2)n1 ZINC000538656457 1047695499 /nfs/dbraw/zinc/69/54/99/1047695499.db2.gz GABKYAGSDQJAES-SNVBAGLBSA-N -1 1 315.398 4.129 20 0 DIADMM O=C(Nc1ccc([O-])c(F)c1F)c1ccc(-c2cccs2)o1 ZINC001157811866 1047756319 /nfs/dbraw/zinc/75/63/19/1047756319.db2.gz WGTRAKUCKNNVAS-UHFFFAOYSA-N -1 1 321.304 4.244 20 0 DIADMM CCc1ccc(N(CC2CC2)C(=O)c2ccc(F)c([O-])c2)cc1 ZINC001158640376 1047792535 /nfs/dbraw/zinc/79/25/35/1047792535.db2.gz DDXBJPUOHXBRGK-UHFFFAOYSA-N -1 1 313.372 4.151 20 0 DIADMM O=C(Nc1cccc(C2CC2)n1)c1ccc2ccccc2c1[O-] ZINC001159039252 1047809518 /nfs/dbraw/zinc/80/95/18/1047809518.db2.gz VHQQFQTUDCDRBE-UHFFFAOYSA-N -1 1 304.349 4.070 20 0 DIADMM [O-]c1cc(Nc2cccc(-c3cc[nH]n3)c2)c(F)cc1Cl ZINC001174507883 1047873400 /nfs/dbraw/zinc/87/34/00/1047873400.db2.gz BBUNMIWUUJHRQG-UHFFFAOYSA-N -1 1 303.724 4.318 20 0 DIADMM COc1cc(Nc2cc([O-])c(Cl)cc2F)cc(F)c1F ZINC001174584895 1047894779 /nfs/dbraw/zinc/89/47/79/1047894779.db2.gz IHDSVMOGUSGXHQ-UHFFFAOYSA-N -1 1 303.667 4.215 20 0 DIADMM C/C(=C/c1ccccc1Cl)C(=O)Nc1nc(Cl)ccc1[O-] ZINC001183217390 1047905489 /nfs/dbraw/zinc/90/54/89/1047905489.db2.gz BZLVRWMUCDEGIK-HJWRWDBZSA-N -1 1 323.179 4.136 20 0 DIADMM Cc1c(Cl)cc(Nc2cnc(C3CC3)nc2)c([O-])c1Cl ZINC001174618182 1047908563 /nfs/dbraw/zinc/90/85/63/1047908563.db2.gz RETAIAACKPJMQT-UHFFFAOYSA-N -1 1 310.184 4.418 20 0 DIADMM C[C@@H]1C[C@H](CC(=O)Nc2nc(Cl)ccc2[O-])CC(C)(C)C1 ZINC001183210779 1047909458 /nfs/dbraw/zinc/90/94/58/1047909458.db2.gz YFMRETBQZMNMJG-GHMZBOCLSA-N -1 1 310.825 4.232 20 0 DIADMM O=C(Nc1nc(Cl)ccc1[O-])c1cc2c(s1)CCCCC2 ZINC001183210235 1047909896 /nfs/dbraw/zinc/90/98/96/1047909896.db2.gz RYQNDHCELNSWDE-UHFFFAOYSA-N -1 1 322.817 4.023 20 0 DIADMM Cc1ccc(NC(=S)Nc2ccc([O-])c(F)c2F)c(C)c1 ZINC001197988817 1047915586 /nfs/dbraw/zinc/91/55/86/1047915586.db2.gz KUICEEZZCUUXEJ-UHFFFAOYSA-N -1 1 308.353 4.096 20 0 DIADMM Cc1ccc(NC(=S)Nc2cc(F)c([O-])cc2F)c(C)c1 ZINC001197994509 1047917487 /nfs/dbraw/zinc/91/74/87/1047917487.db2.gz ANPRWUMFIRCTKF-UHFFFAOYSA-N -1 1 308.353 4.096 20 0 DIADMM Cc1c(Cl)cc(Nc2cnc(N)c(Cl)c2)c([O-])c1Cl ZINC001159789433 1047924628 /nfs/dbraw/zinc/92/46/28/1047924628.db2.gz AIPOIDNKTYQEKQ-UHFFFAOYSA-N -1 1 318.591 4.382 20 0 DIADMM Cc1c(F)cccc1Nc1ccc(F)c(Br)c1[O-] ZINC001174671630 1047928823 /nfs/dbraw/zinc/92/88/23/1047928823.db2.gz VPCMCIFFEZHLRE-UHFFFAOYSA-N -1 1 314.129 4.485 20 0 DIADMM Nc1nc2ccc(Nc3cc(F)c([O-])c(Cl)c3)cc2s1 ZINC001159823376 1047931741 /nfs/dbraw/zinc/93/17/41/1047931741.db2.gz VUQARWYROAYRFU-UHFFFAOYSA-N -1 1 309.753 4.120 20 0 DIADMM FC(F)(F)c1ccccc1[N-]c1nnc(Br)s1 ZINC000081663346 1047948243 /nfs/dbraw/zinc/94/82/43/1047948243.db2.gz OWGXEMHKSHFHTJ-UHFFFAOYSA-N -1 1 324.125 4.063 20 0 DIADMM Cc1cccc(C)c1NC(=S)Nc1cc([O-])c(F)cc1F ZINC001198357440 1047951467 /nfs/dbraw/zinc/95/14/67/1047951467.db2.gz MATFTTDHISEKTL-UHFFFAOYSA-N -1 1 308.353 4.096 20 0 DIADMM COc1ccc(C(F)(F)F)cc1[N-]c1nnc(C(C)(C)C)o1 ZINC001174773822 1047967727 /nfs/dbraw/zinc/96/77/27/1047967727.db2.gz BRFVPQSTCXBWHH-UHFFFAOYSA-N -1 1 315.295 4.138 20 0 DIADMM COc1ccc(C(F)(F)F)cc1Nc1cc([O-])c(F)c(F)c1 ZINC001174778989 1047969918 /nfs/dbraw/zinc/96/99/18/1047969918.db2.gz PQOWEERMRJBAHX-UHFFFAOYSA-N -1 1 319.229 4.441 20 0 DIADMM CC(C)c1ccccc1[N-]S(=O)(=O)c1ccc2occc2c1 ZINC001198816899 1048009165 /nfs/dbraw/zinc/00/91/65/1048009165.db2.gz RFRMIXZZAFGRJQ-UHFFFAOYSA-N -1 1 315.394 4.357 20 0 DIADMM Cc1ccc(Cl)cc1[N-]S(=O)(=O)c1ccc2occc2c1 ZINC001198857398 1048012315 /nfs/dbraw/zinc/01/23/15/1048012315.db2.gz YHVVRQGYTOHKIX-UHFFFAOYSA-N -1 1 321.785 4.195 20 0 DIADMM O=S(=O)([N-]c1ccc2ccccc2c1)c1ccc2occc2c1 ZINC001198861325 1048014383 /nfs/dbraw/zinc/01/43/83/1048014383.db2.gz JBKIJIAWONHETH-UHFFFAOYSA-N -1 1 323.373 4.387 20 0 DIADMM CC(C)C(=O)Nc1ccc(Nc2cc(F)c([O-])cc2F)cc1 ZINC001199075503 1048034198 /nfs/dbraw/zinc/03/41/98/1048034198.db2.gz ZVECAHLNGZMFME-UHFFFAOYSA-N -1 1 306.312 4.009 20 0 DIADMM C[C@@H]1CCC[C@H](C(=O)Nc2cccc(C(F)(F)F)c2[O-])C1 ZINC001184512506 1048054013 /nfs/dbraw/zinc/05/40/13/1048054013.db2.gz ODDBDNBRFWCTHP-ZJUUUORDSA-N -1 1 301.308 4.176 20 0 DIADMM Cc1c(Cl)cc(NC(=O)c2cccc([O-])c2F)cc1Cl ZINC001160512035 1048063743 /nfs/dbraw/zinc/06/37/43/1048063743.db2.gz QGRQHIRGHUXXRY-UHFFFAOYSA-N -1 1 314.143 4.399 20 0 DIADMM COc1c(C)ccc(NC(=O)c2cc3ccccc3cc2[O-])c1C ZINC000554338992 1048071025 /nfs/dbraw/zinc/07/10/25/1048071025.db2.gz MQFNHTCFKCELHC-UHFFFAOYSA-N -1 1 321.376 4.423 20 0 DIADMM COc1ccc(Nc2cc([O-])c(Cl)cc2F)c(F)c1F ZINC001175022644 1048077702 /nfs/dbraw/zinc/07/77/02/1048077702.db2.gz AEAZBWNDUQDSMF-UHFFFAOYSA-N -1 1 303.667 4.215 20 0 DIADMM CCOc1cc(F)c(Nc2cc([O-])c(F)c(F)c2)cc1F ZINC001175058805 1048084682 /nfs/dbraw/zinc/08/46/82/1048084682.db2.gz SUFJEWXGQOMFSO-UHFFFAOYSA-N -1 1 301.239 4.091 20 0 DIADMM CC(C)COc1cc(F)cc([N-]c2nnc(C(C)(C)C)o2)c1 ZINC001175059085 1048087113 /nfs/dbraw/zinc/08/71/13/1048087113.db2.gz PZWTYFUURUTGPU-UHFFFAOYSA-N -1 1 307.369 4.285 20 0 DIADMM O=C(Nc1cc([O-])c(F)cc1F)[C@@H]1CCC[C@@H]2CCCC[C@H]12 ZINC001160916196 1048097566 /nfs/dbraw/zinc/09/75/66/1048097566.db2.gz GGGBZWUCYLVFAN-SDDRHHMPSA-N -1 1 309.356 4.215 20 0 DIADMM Cc1ccc(C(=O)Nc2cc([O-])c(F)cc2F)c(Cl)c1C ZINC001160918068 1048098175 /nfs/dbraw/zinc/09/81/75/1048098175.db2.gz XLPXBBVRBSOFHB-UHFFFAOYSA-N -1 1 311.715 4.193 20 0 DIADMM O=C(Nc1ccc(F)cc1[O-])[C@H]1C[C@@H]1c1cccc2ccccc21 ZINC001161035898 1048104491 /nfs/dbraw/zinc/10/44/91/1048104491.db2.gz VDPPVAUWVPMJFK-SJORKVTESA-N -1 1 321.351 4.427 20 0 DIADMM Cc1oc(-c2ccccc2)cc1C(=O)Nc1ccc(F)cc1[O-] ZINC001161045382 1048104720 /nfs/dbraw/zinc/10/47/20/1048104720.db2.gz CFVUGOCLKHTUJG-UHFFFAOYSA-N -1 1 311.312 4.352 20 0 DIADMM [O-]c1cc(NC(=S)NC2CCCCCC2)c(F)cc1Cl ZINC001199969749 1048126737 /nfs/dbraw/zinc/12/67/37/1048126737.db2.gz WTHRHJCFOLUEIO-UHFFFAOYSA-N -1 1 316.829 4.194 20 0 DIADMM COc1ccc(Nc2cc([O-])c(F)c(F)c2)cc1C(F)(F)F ZINC001175071623 1048127729 /nfs/dbraw/zinc/12/77/29/1048127729.db2.gz WFXJLNUSEIMDIR-UHFFFAOYSA-N -1 1 319.229 4.441 20 0 DIADMM Fc1ccc([N-]c2nnc(-c3ccco3)o2)cc1C(F)(F)F ZINC001175073634 1048128763 /nfs/dbraw/zinc/12/87/63/1048128763.db2.gz WVPFVXNCLFMNOA-UHFFFAOYSA-N -1 1 313.210 4.231 20 0 DIADMM CCCCCC[C@@H](C)[N-]S(=O)(=O)c1sccc1Cl ZINC001185102533 1048129081 /nfs/dbraw/zinc/12/90/81/1048129081.db2.gz MYFWPPOZAFAJMB-SNVBAGLBSA-N -1 1 309.884 4.039 20 0 DIADMM Cc1cc(NC(=S)Nc2cccc([O-])c2Cl)ccc1F ZINC001201038167 1048184930 /nfs/dbraw/zinc/18/49/30/1048184930.db2.gz PSMLPTODWCIAGS-UHFFFAOYSA-N -1 1 310.781 4.302 20 0 DIADMM [O-]c1cc(F)c(Nc2cccc(O[C@H]3CCCCO3)c2)cc1F ZINC001175188840 1048192164 /nfs/dbraw/zinc/19/21/64/1048192164.db2.gz ARLHBZHRDWGPKC-KRWDZBQOSA-N -1 1 321.323 4.319 20 0 DIADMM [O-]c1c(Nc2cccc(O[C@@H]3CCCCO3)c2)ccc(F)c1F ZINC001175189348 1048193831 /nfs/dbraw/zinc/19/38/31/1048193831.db2.gz FGRVSJXUWIBAMH-OAHLLOKOSA-N -1 1 321.323 4.319 20 0 DIADMM CCc1ccccc1NC(=S)Nc1cc(F)c([O-])cc1F ZINC001201148361 1048201026 /nfs/dbraw/zinc/20/10/26/1048201026.db2.gz CIEQZQGPQYZRBP-UHFFFAOYSA-N -1 1 308.353 4.042 20 0 DIADMM CCc1ccccc1NC(=S)Nc1cc(F)c(F)cc1[O-] ZINC001201149092 1048201686 /nfs/dbraw/zinc/20/16/86/1048201686.db2.gz WQMJCLXBQXSFGI-UHFFFAOYSA-N -1 1 308.353 4.042 20 0 DIADMM CC[C@@H](NC(=O)c1ccc2ccc(O)cc2c1[O-])c1ccccc1 ZINC001162018050 1048215357 /nfs/dbraw/zinc/21/53/57/1048215357.db2.gz VUSXJTNASCZTPF-GOSISDBHSA-N -1 1 321.376 4.132 20 0 DIADMM Cc1cc(C)cc(NC(=S)Nc2cc([O-])c(F)cc2F)c1 ZINC001201207328 1048218327 /nfs/dbraw/zinc/21/83/27/1048218327.db2.gz ZFHPZGUBUZFOEC-UHFFFAOYSA-N -1 1 308.353 4.096 20 0 DIADMM O=C(Nc1ccc2c(c1)CCC2)Nc1ccc(Cl)cc1[O-] ZINC001185764132 1048222462 /nfs/dbraw/zinc/22/24/62/1048222462.db2.gz VVDUOKDBGJBWNE-UHFFFAOYSA-N -1 1 302.761 4.178 20 0 DIADMM Cc1ccc(Nc2ccc(F)c(Br)c2[O-])c(F)c1 ZINC001175327778 1048265301 /nfs/dbraw/zinc/26/53/01/1048265301.db2.gz UHSFUQNRNUNCQN-UHFFFAOYSA-N -1 1 314.129 4.485 20 0 DIADMM [O-]c1ccc(Cl)c(Nc2ccc(N3CCCC3)nc2)c1Cl ZINC001175352660 1048274611 /nfs/dbraw/zinc/27/46/11/1048274611.db2.gz ZDNLYXBQBQXOKN-UHFFFAOYSA-N -1 1 324.211 4.438 20 0 DIADMM Nc1ccccc1N(C(=O)c1ccc([O-])cc1F)c1ccccc1 ZINC001186327978 1048281443 /nfs/dbraw/zinc/28/14/43/1048281443.db2.gz ZNXSUHITCARFDW-UHFFFAOYSA-N -1 1 322.339 4.092 20 0 DIADMM CC(C)N(C(=O)c1ccc([O-])cc1F)[C@@H](C)c1ccccc1 ZINC001186326377 1048281821 /nfs/dbraw/zinc/28/18/21/1048281821.db2.gz CHFSWJWHBTVLLS-ZDUSSCGKSA-N -1 1 301.361 4.143 20 0 DIADMM C[S@@](=O)c1ccc(Nc2cc(Cl)cc(Cl)c2[O-])cc1 ZINC001175484298 1048322467 /nfs/dbraw/zinc/32/24/67/1048322467.db2.gz QSYTZWOJSUKJDT-LJQANCHMSA-N -1 1 316.209 4.180 20 0 DIADMM CSc1ccccc1NC(=O)Nc1cccc([O-])c1Cl ZINC001186745894 1048337927 /nfs/dbraw/zinc/33/79/27/1048337927.db2.gz LHMGXAWDDUFOBX-UHFFFAOYSA-N -1 1 308.790 4.412 20 0 DIADMM CC(C)c1nsc([N-]c2cnn([C@H](C)c3ccccc3)c2)n1 ZINC001186791832 1048345955 /nfs/dbraw/zinc/34/59/55/1048345955.db2.gz PAGVKYZVEDWSIX-GFCCVEGCSA-N -1 1 313.430 4.211 20 0 DIADMM Cn1cc2c(cccc2Nc2c(Cl)ccc([O-])c2Cl)n1 ZINC001175594047 1048363364 /nfs/dbraw/zinc/36/33/64/1048363364.db2.gz LKCXUACCMIHKEN-UHFFFAOYSA-N -1 1 308.168 4.329 20 0 DIADMM CC[C@@H](SC)C(=O)Nc1cc(Cl)c([O-])c2ccccc12 ZINC000600135358 1048372689 /nfs/dbraw/zinc/37/26/89/1048372689.db2.gz GGJZZPQPKOGUNU-CYBMUJFWSA-N -1 1 309.818 4.279 20 0 DIADMM CSc1ncc(Nc2cc(Cl)c(C)c(Cl)c2[O-])cn1 ZINC001175652740 1048392888 /nfs/dbraw/zinc/39/28/88/1048392888.db2.gz XNPONFGHUITYBH-UHFFFAOYSA-N -1 1 316.213 4.263 20 0 DIADMM CSc1ccc([O-])c(C(=O)Nc2ccc(F)cc2SC)c1 ZINC001162985089 1048399016 /nfs/dbraw/zinc/39/90/16/1048399016.db2.gz WVVPSNKSEUSLDX-UHFFFAOYSA-N -1 1 323.414 4.227 20 0 DIADMM C[C@@H]1CN(Cc2ccc(Cl)cc2C(=O)[O-])Cc2ccccc21 ZINC001142643184 1048418384 /nfs/dbraw/zinc/41/83/84/1048418384.db2.gz JVQULFGJKZZYPC-GFCCVEGCSA-N -1 1 315.800 4.158 20 0 DIADMM O=C(Nc1ccc(F)c(Cl)c1)Nc1cccc([O-])c1Cl ZINC001187699704 1048429064 /nfs/dbraw/zinc/42/90/64/1048429064.db2.gz HTSLEFRXDBMFLV-UHFFFAOYSA-N -1 1 315.131 4.482 20 0 DIADMM O=C(Nc1cc([O-])c(Cl)cc1F)Nc1c(F)cccc1F ZINC001202041808 1048443225 /nfs/dbraw/zinc/44/32/25/1048443225.db2.gz GSNSNYNWHJPHCX-UHFFFAOYSA-N -1 1 316.666 4.107 20 0 DIADMM CCC[C@@H](C)c1cc(NC(=O)c2ccc(C(C)C)cc2[O-])n[nH]1 ZINC001163271820 1048446203 /nfs/dbraw/zinc/44/62/03/1048446203.db2.gz LTNISPHCTBNGBV-GFCCVEGCSA-N -1 1 315.417 4.395 20 0 DIADMM CCCn1nc(C)cc1Nc1c(Cl)ccc([O-])c1Cl ZINC001175804482 1048464267 /nfs/dbraw/zinc/46/42/67/1048464267.db2.gz DNYSHBBSXZTXKQ-UHFFFAOYSA-N -1 1 300.189 4.358 20 0 DIADMM O=c1oc2cc([O-])ccc2cc1Nc1csc2ccccc12 ZINC001202165858 1048468480 /nfs/dbraw/zinc/46/84/80/1048468480.db2.gz MUZKCDCGEKFUDG-UHFFFAOYSA-N -1 1 309.346 4.457 20 0 DIADMM O=c1ccn(-c2ccc(Nc3cnn(C4CCCCC4)c3)cc2)[n-]1 ZINC001175885789 1048472228 /nfs/dbraw/zinc/47/22/28/1048472228.db2.gz RKJHVYQUVSNDFU-UHFFFAOYSA-N -1 1 323.400 4.023 20 0 DIADMM CCCc1cc(=O)[n-]c(S[C@H](C)c2ccc3c(c2)CCC3)n1 ZINC001188161552 1048487885 /nfs/dbraw/zinc/48/78/85/1048487885.db2.gz AYVAFIIRUDZWDQ-GFCCVEGCSA-N -1 1 314.454 4.477 20 0 DIADMM O=C(Nc1ccc(Cl)c(Cl)c1)Nc1cccc(F)c1[O-] ZINC001202263368 1048494786 /nfs/dbraw/zinc/49/47/86/1048494786.db2.gz OOMGVXITBKMXME-UHFFFAOYSA-N -1 1 315.131 4.482 20 0 DIADMM O=C(Nc1cc(F)c(F)cc1[O-])Nc1cccc(Cl)c1F ZINC001188411454 1048513067 /nfs/dbraw/zinc/51/30/67/1048513067.db2.gz VIHDJCOVJODHCT-UHFFFAOYSA-N -1 1 316.666 4.107 20 0 DIADMM O=C(Nc1ccc2ccccc2c1)Nc1cc(Cl)ncc1[O-] ZINC001188584011 1048532358 /nfs/dbraw/zinc/53/23/58/1048532358.db2.gz NKYSZVAEBXXSFG-UHFFFAOYSA-N -1 1 313.744 4.238 20 0 DIADMM O=C(Nc1cccc2ccccc21)Nc1cc(Cl)ncc1[O-] ZINC001188912476 1048563323 /nfs/dbraw/zinc/56/33/23/1048563323.db2.gz HTSSMHLEHWKYHL-UHFFFAOYSA-N -1 1 313.744 4.238 20 0 DIADMM Cc1cccc(C)c1C(=O)Nc1cccc(C(F)(F)F)c1[O-] ZINC001189057177 1048586527 /nfs/dbraw/zinc/58/65/27/1048586527.db2.gz YDAVTGAFBFUMEG-UHFFFAOYSA-N -1 1 309.287 4.280 20 0 DIADMM COc1ccc(Nc2c(Cl)ccc([O-])c2Cl)cc1O ZINC001176258389 1048625049 /nfs/dbraw/zinc/62/50/49/1048625049.db2.gz JMDOOMTWYGUHSO-UHFFFAOYSA-N -1 1 300.141 4.157 20 0 DIADMM Cc1cccc(Cl)c1CSc1nc(C(F)F)cc(=O)[n-]1 ZINC001189476484 1048628683 /nfs/dbraw/zinc/62/86/83/1048628683.db2.gz NDBPPONBJXJQAW-UHFFFAOYSA-N -1 1 316.760 4.374 20 0 DIADMM CCCc1cc(=O)[n-]c(SCC[C@H]2CCc3ccccc32)n1 ZINC001164551152 1048640210 /nfs/dbraw/zinc/64/02/10/1048640210.db2.gz HSOWLAKFYHMJKE-CQSZACIVSA-N -1 1 314.454 4.347 20 0 DIADMM O=c1oc2cc([O-])ccc2cc1Nc1ccc2cc(O)ccc2c1 ZINC001176387613 1048653279 /nfs/dbraw/zinc/65/32/79/1048653279.db2.gz FYHIDLUWULDACD-UHFFFAOYSA-N -1 1 319.316 4.101 20 0 DIADMM Cc1c(Cl)cc(Nc2csc(CO)c2)c([O-])c1Cl ZINC001176371417 1048663593 /nfs/dbraw/zinc/66/35/93/1048663593.db2.gz FDTIBNNXNYILNK-UHFFFAOYSA-N -1 1 304.198 4.305 20 0 DIADMM Cc1nc(SCc2ccc(Cl)cc2F)[n-]c(=O)c1C1CC1 ZINC001189892853 1048675360 /nfs/dbraw/zinc/67/53/60/1048675360.db2.gz VKQCDFRYBWIQEU-UHFFFAOYSA-N -1 1 324.808 4.453 20 0 DIADMM COc1ccc2cc(C(=O)Nc3c([O-])cccc3F)sc2c1 ZINC001165761086 1048715838 /nfs/dbraw/zinc/71/58/38/1048715838.db2.gz YITNQZIHPDJTBF-UHFFFAOYSA-N -1 1 317.341 4.007 20 0 DIADMM COc1ccc(O)cc1Nc1c(Cl)ccc([O-])c1Cl ZINC001176580177 1048735398 /nfs/dbraw/zinc/73/53/98/1048735398.db2.gz KSSZYKCWUBLHOG-UHFFFAOYSA-N -1 1 300.141 4.157 20 0 DIADMM O=c1cc(C(F)F)nc(SCC2CCC3(CC3)CC2)[n-]1 ZINC001166294400 1048744243 /nfs/dbraw/zinc/74/42/43/1048744243.db2.gz HUFMLGMREMTMOI-UHFFFAOYSA-N -1 1 300.374 4.182 20 0 DIADMM [O-]c1cc(F)cc(F)c1Nc1ccc(OC(F)(F)F)cc1 ZINC001176643336 1048747232 /nfs/dbraw/zinc/74/72/32/1048747232.db2.gz VMWQOPUOGMYOGP-UHFFFAOYSA-N -1 1 305.202 4.313 20 0 DIADMM O=S(=O)([N-]c1ccc2occc2c1)c1ccc(C2CC2)cc1 ZINC001190506877 1048747217 /nfs/dbraw/zinc/74/72/17/1048747217.db2.gz NUPPCRUDZIOWTE-UHFFFAOYSA-N -1 1 313.378 4.111 20 0 DIADMM [O-]c1c(Nc2ccc(OC(F)(F)F)cc2)ccc(F)c1F ZINC001176644034 1048748916 /nfs/dbraw/zinc/74/89/16/1048748916.db2.gz OTMKLQNUGIBMPT-UHFFFAOYSA-N -1 1 305.202 4.313 20 0 DIADMM CCNc1ccnc(Cl)c1Nc1c(F)cc(F)c([O-])c1F ZINC001176664600 1048753143 /nfs/dbraw/zinc/75/31/43/1048753143.db2.gz RTUXOECZTSQFCA-UHFFFAOYSA-N -1 1 317.698 4.033 20 0 DIADMM [O-]c1c(F)cc(F)c(Nc2cc(-c3cccnc3)ccn2)c1F ZINC001176663776 1048753317 /nfs/dbraw/zinc/75/33/17/1048753317.db2.gz LWFYOEJJUGTYHH-UHFFFAOYSA-N -1 1 317.270 4.010 20 0 DIADMM [O-]c1c(F)cc(F)c(Nc2cncc(Cl)c2Cl)c1F ZINC001176664274 1048753698 /nfs/dbraw/zinc/75/36/98/1048753698.db2.gz ONVVZPYDPYXEQT-UHFFFAOYSA-N -1 1 309.074 4.255 20 0 DIADMM COc1ccc(Nc2c(F)cc(F)c([O-])c2F)cc1Cl ZINC001176671483 1048754513 /nfs/dbraw/zinc/75/45/13/1048754513.db2.gz FREZORQODDZOPT-UHFFFAOYSA-N -1 1 303.667 4.215 20 0 DIADMM Nc1ccc(C(F)(F)F)cc1Nc1c(F)cc(F)c([O-])c1F ZINC001176670155 1048755055 /nfs/dbraw/zinc/75/50/55/1048755055.db2.gz TXNFRRDQGWOBON-UHFFFAOYSA-N -1 1 322.208 4.154 20 0 DIADMM [O-]c1c(F)cc(F)c(Nc2ccc(-c3cnco3)cc2)c1F ZINC001176671738 1048755271 /nfs/dbraw/zinc/75/52/71/1048755271.db2.gz MXCQVOUTMBFTOK-UHFFFAOYSA-N -1 1 306.243 4.208 20 0 DIADMM [O-]c1c(F)cc(F)c(Nc2cc(F)cc(F)c2Cl)c1F ZINC001176672160 1048755298 /nfs/dbraw/zinc/75/52/98/1048755298.db2.gz FVCVUMLRWAHTAJ-UHFFFAOYSA-N -1 1 309.621 4.485 20 0 DIADMM [O-]c1c(F)cc(F)c(Nc2cccc3cc(O)ccc32)c1F ZINC001176670638 1048756292 /nfs/dbraw/zinc/75/62/92/1048756292.db2.gz IYLJUMJVXNRCLW-UHFFFAOYSA-N -1 1 305.255 4.412 20 0 DIADMM [O-]c1c(F)cc(F)c(Nc2cccc3cc(F)cnc32)c1F ZINC001176673852 1048757159 /nfs/dbraw/zinc/75/71/59/1048757159.db2.gz OSOCARWHVICTIT-UHFFFAOYSA-N -1 1 308.234 4.240 20 0 DIADMM [O-]c1c(F)cc(F)c(Nc2cccc(C(F)(F)F)c2O)c1F ZINC001176672918 1048757439 /nfs/dbraw/zinc/75/74/39/1048757439.db2.gz BBPHTIYAERMSDM-UHFFFAOYSA-N -1 1 323.192 4.278 20 0 DIADMM COc1cc(Nc2c(F)cc(F)c([O-])c2F)ccc1Cl ZINC001176673369 1048757526 /nfs/dbraw/zinc/75/75/26/1048757526.db2.gz UHYJFNLOJVERQE-UHFFFAOYSA-N -1 1 303.667 4.215 20 0 DIADMM COc1ccc2cccnc2c1Nc1c(F)cc(F)c([O-])c1F ZINC001176673817 1048757627 /nfs/dbraw/zinc/75/76/27/1048757627.db2.gz NIHUYGDTBGXHMQ-UHFFFAOYSA-N -1 1 320.270 4.110 20 0 DIADMM [O-]c1c(F)cc(F)c(Nc2ccc(C(F)(F)F)cc2O)c1F ZINC001176673734 1048757802 /nfs/dbraw/zinc/75/78/02/1048757802.db2.gz YOZOUGUBGYLEBP-UHFFFAOYSA-N -1 1 323.192 4.278 20 0 DIADMM CC1(C)Oc2ccc(Nc3c(F)cc(F)c([O-])c3F)cc2O1 ZINC001176672530 1048758842 /nfs/dbraw/zinc/75/88/42/1048758842.db2.gz ZQJYOBDTVBAELI-UHFFFAOYSA-N -1 1 311.259 4.060 20 0 DIADMM [O-]c1c(F)cc(F)c(Nc2snnc2-c2ccccc2)c1F ZINC001176663167 1048769437 /nfs/dbraw/zinc/76/94/37/1048769437.db2.gz CYNHZBASFIJCLE-UHFFFAOYSA-N -1 1 323.299 4.072 20 0 DIADMM [O-]c1c(F)cc(F)c(Nc2cc(Cc3ccccc3)no2)c1F ZINC001176663244 1048769927 /nfs/dbraw/zinc/76/99/27/1048769927.db2.gz DHAQCTWPVIWZRS-UHFFFAOYSA-N -1 1 320.270 4.132 20 0 DIADMM Cc1nc(SCc2c(F)cccc2Cl)[n-]c(=O)c1C1CC1 ZINC001166631957 1048774131 /nfs/dbraw/zinc/77/41/31/1048774131.db2.gz IJCZFVHYFHHQNS-UHFFFAOYSA-N -1 1 324.808 4.453 20 0 DIADMM O=c1cc(CSc2ccc(F)cc2F)c2ccc([O-])cc2o1 ZINC000007921310 1048789523 /nfs/dbraw/zinc/78/95/23/1048789523.db2.gz UMKCUVABGIFIFM-UHFFFAOYSA-N -1 1 320.316 4.069 20 0 DIADMM O=C([N-]c1cscc1Cl)c1ncc(C(F)(F)F)s1 ZINC001176884854 1048798210 /nfs/dbraw/zinc/79/82/10/1048798210.db2.gz HDYWSZQZGUXAGH-UHFFFAOYSA-N -1 1 312.725 4.129 20 0 DIADMM CC(C)=CCC[C@@H](C)CC(=O)NCc1ccc([O-])c(Cl)c1 ZINC001176993998 1048815044 /nfs/dbraw/zinc/81/50/44/1048815044.db2.gz MIKBIHLJVHQKOH-CYBMUJFWSA-N -1 1 309.837 4.434 20 0 DIADMM CCSc1ccc(Cl)cc1[N-]C(=O)c1conc1CC ZINC000668270922 1048869873 /nfs/dbraw/zinc/86/98/73/1048869873.db2.gz RKTPLXHHNYRNTR-UHFFFAOYSA-N -1 1 310.806 4.255 20 0 DIADMM CNc1ccc(Nc2c(Cl)ccc([O-])c2Cl)c(F)n1 ZINC001203362287 1048879420 /nfs/dbraw/zinc/87/94/20/1048879420.db2.gz SDYGUYIKUMMHNY-UHFFFAOYSA-N -1 1 302.136 4.018 20 0 DIADMM O=C(Nc1cc([O-])c(Cl)cc1F)NC1CCCCCC1 ZINC001191267967 1048912838 /nfs/dbraw/zinc/91/28/38/1048912838.db2.gz FYUBZVJAHCJQEN-UHFFFAOYSA-N -1 1 300.761 4.029 20 0 DIADMM FC(F)(F)c1ccc(-c2ccc([N-]c3nnco3)cc2)cc1 ZINC001203591812 1048936644 /nfs/dbraw/zinc/93/66/44/1048936644.db2.gz IMEUPEHTQLTNOM-UHFFFAOYSA-N -1 1 305.259 4.499 20 0 DIADMM Cc1cnc(C)c(Nc2ccc(F)c(Br)c2[O-])c1 ZINC001203667488 1048957277 /nfs/dbraw/zinc/95/72/77/1048957277.db2.gz MPYPYSQDRJQBRT-UHFFFAOYSA-N -1 1 311.154 4.049 20 0 DIADMM CCC[C@H](C(=O)Nc1cc(F)c([O-])cc1Cl)c1ccccn1 ZINC000885678968 1048967837 /nfs/dbraw/zinc/96/78/37/1048967837.db2.gz ZRXZGENVRKSBDX-JTQLQIEISA-N -1 1 322.767 4.102 20 0 DIADMM [O-]c1cc(Nc2ccc(N3CCCCC3)cc2)cc(F)c1F ZINC001203718794 1048975854 /nfs/dbraw/zinc/97/58/54/1048975854.db2.gz AKNVJZGNWKMPDL-UHFFFAOYSA-N -1 1 304.340 4.404 20 0 DIADMM Cc1ccc(Cl)c(NC(=O)Nc2cc([O-])c(F)cc2F)c1 ZINC001191701998 1048980446 /nfs/dbraw/zinc/98/04/46/1048980446.db2.gz CONLWRUAIJCTFK-UHFFFAOYSA-N -1 1 312.703 4.276 20 0 DIADMM Cc1cc(NC(=O)Nc2cc([O-])c(F)cc2F)ccc1Cl ZINC001191767749 1048988956 /nfs/dbraw/zinc/98/89/56/1048988956.db2.gz ANMRVUVGAWBCLV-UHFFFAOYSA-N -1 1 312.703 4.276 20 0 DIADMM CC(C)c1ccc([C@H](N[C@@H](C)C(=O)[O-])c2cccs2)cc1 ZINC000904204814 1049001404 /nfs/dbraw/zinc/00/14/04/1049001404.db2.gz ZMEKOEPKDJUUKF-LRDDRELGSA-N -1 1 303.427 4.024 20 0 DIADMM CC[C@H](C)c1ccc([C@@H](N[C@@H](C)C(=O)[O-])c2cccs2)cc1 ZINC000904203160 1049002570 /nfs/dbraw/zinc/00/25/70/1049002570.db2.gz FFDHFWTUVUMHRY-GDZNZVCISA-N -1 1 317.454 4.414 20 0 DIADMM C[C@H]1CC[C@H](NC(=O)Nc2cc(Cl)c(Cl)cc2[O-])CC1 ZINC001191825118 1049009350 /nfs/dbraw/zinc/00/93/50/1049009350.db2.gz ZETSGYVTSYSJSJ-KYZUINATSA-N -1 1 317.216 4.399 20 0 DIADMM CC(C)c1ccccc1NC(=O)Nc1cc(F)c([O-])cc1F ZINC001192259357 1049069419 /nfs/dbraw/zinc/06/94/19/1049069419.db2.gz HCNOUMJAFCUTKZ-UHFFFAOYSA-N -1 1 306.312 4.438 20 0 DIADMM CCSc1cccc(F)c1[N-]C(=O)c1cc(F)cc(F)c1 ZINC000484925745 1049084920 /nfs/dbraw/zinc/08/49/20/1049084920.db2.gz ITAZJUWPYCLJFT-UHFFFAOYSA-N -1 1 311.328 4.468 20 0 DIADMM O=C(Nc1ccc2sccc2c1)Nc1ccc(F)cc1[O-] ZINC001192449074 1049105627 /nfs/dbraw/zinc/10/56/27/1049105627.db2.gz VBJZSHGBLWSWEF-UHFFFAOYSA-N -1 1 302.330 4.390 20 0 DIADMM CSc1ccc([O-])c(-c2nc(Cc3ccccc3C)no2)c1 ZINC000904648408 1049123552 /nfs/dbraw/zinc/12/35/52/1049123552.db2.gz ZULPFLBMSRSUJH-UHFFFAOYSA-N -1 1 312.394 4.063 20 0 DIADMM CC(C)N(C(=O)c1cc([O-])cc(F)c1F)[C@@H](C)c1ccccc1 ZINC001192665689 1049132124 /nfs/dbraw/zinc/13/21/24/1049132124.db2.gz TXPJUIBAPVMDTD-LBPRGKRZSA-N -1 1 319.351 4.282 20 0 DIADMM CC1(C)CN(Cc2ccc([O-])c(F)c2F)[C@H]1c1ccccc1 ZINC001204515409 1049180199 /nfs/dbraw/zinc/18/01/99/1049180199.db2.gz MCFOQNNMMRUIEI-KRWDZBQOSA-N -1 1 303.352 4.254 20 0 DIADMM CC(C)(Nc1ccccc1)C(=O)Nc1cc(F)c([O-])cc1Cl ZINC001179660285 1049189173 /nfs/dbraw/zinc/18/91/73/1049189173.db2.gz NYVFYIDJPAYWFF-UHFFFAOYSA-N -1 1 322.767 4.014 20 0 DIADMM O=C(CCCc1cccs1)Nc1cc(F)c([O-])cc1Cl ZINC001179656595 1049189219 /nfs/dbraw/zinc/18/92/19/1049189219.db2.gz UKMVXKFNPYOCDP-UHFFFAOYSA-N -1 1 313.781 4.208 20 0 DIADMM Cc1ccccc1C[C@H](C)C(=O)Nc1cc(F)c([O-])cc1Cl ZINC001179660575 1049189341 /nfs/dbraw/zinc/18/93/41/1049189341.db2.gz XHKHMDYTOCZJJT-NSHDSACASA-N -1 1 321.779 4.310 20 0 DIADMM O=C(/C=C/Sc1ccccc1)Nc1cc(F)c([O-])cc1Cl ZINC001179660016 1049189421 /nfs/dbraw/zinc/18/94/21/1049189421.db2.gz KFINSSKCUIMHAF-VOTSOKGWSA-N -1 1 323.776 4.429 20 0 DIADMM O=c1nc(N[C@H]2CC[C@H](c3ccc(Cl)cc3)C2)cc(Cl)[n-]1 ZINC000858567630 1049276755 /nfs/dbraw/zinc/27/67/55/1049276755.db2.gz HJUNSXUNWCWSKG-JQWIXIFHSA-N -1 1 324.211 4.237 20 0 DIADMM CCCC[C@@H](CC)COC(=O)Nc1ccc([O-])c(F)c1F ZINC001193968649 1049288010 /nfs/dbraw/zinc/28/80/10/1049288010.db2.gz PFNPZSLBYGOSCI-SNVBAGLBSA-N -1 1 301.333 4.435 20 0 DIADMM C[C@H](NC(=O)c1ccc(F)c([O-])c1)c1csc2ccccc21 ZINC001180226209 1049311011 /nfs/dbraw/zinc/31/10/11/1049311011.db2.gz OIXAEJDOTDLQKW-JTQLQIEISA-N -1 1 315.369 4.237 20 0 DIADMM CC(C)c1ccc(C(=O)Nc2nc(C(C)(C)C)co2)c([O-])c1 ZINC001180595853 1049389325 /nfs/dbraw/zinc/38/93/25/1049389325.db2.gz ASGJYUCIUJSOMJ-UHFFFAOYSA-N -1 1 302.374 4.053 20 0 DIADMM Cc1ccc(Cl)cc1[N-]S(=O)(=O)c1c(C)cccc1C ZINC001194634603 1049401663 /nfs/dbraw/zinc/40/16/63/1049401663.db2.gz WXKWTNXFQZNRMJ-UHFFFAOYSA-N -1 1 309.818 4.066 20 0 DIADMM Cc1cccc(C)c1S(=O)(=O)[N-]c1ccc2sccc2c1 ZINC001194643770 1049402820 /nfs/dbraw/zinc/40/28/20/1049402820.db2.gz NFJQLHOXPVQJOL-UHFFFAOYSA-N -1 1 317.435 4.319 20 0 DIADMM O=C(Nc1ccc([O-])c(F)c1F)Oc1ccc2ccccc2c1 ZINC001194656865 1049405187 /nfs/dbraw/zinc/40/51/87/1049405187.db2.gz ZZINKUWVBZTPLI-UHFFFAOYSA-N -1 1 315.275 4.435 20 0 DIADMM CCC[C@@H](C(=O)[N-]OCCC(F)(F)F)c1cccc(Cl)c1 ZINC000860995963 1049427983 /nfs/dbraw/zinc/42/79/83/1049427983.db2.gz SMOVUSMSGVWSNK-GFCCVEGCSA-N -1 1 323.742 4.224 20 0 DIADMM CCC[C@H](C(=O)[N-]OCCC(F)(F)F)c1cccc(Cl)c1 ZINC000860995969 1049428628 /nfs/dbraw/zinc/42/86/28/1049428628.db2.gz SMOVUSMSGVWSNK-LBPRGKRZSA-N -1 1 323.742 4.224 20 0 DIADMM O=C(/C=C/c1ccnc2ccccc12)Nc1ccc([O-])c(Cl)c1 ZINC000117991818 1049432382 /nfs/dbraw/zinc/43/23/82/1049432382.db2.gz ACDBSDUFUPCWDT-VMPITWQZSA-N -1 1 324.767 4.246 20 0 DIADMM C[C@]1(C(=O)Nc2cc(Cl)c([O-])c3ccccc23)CCCCO1 ZINC000862295539 1049486932 /nfs/dbraw/zinc/48/69/32/1049486932.db2.gz LTOUHDHZSMHFDA-QGZVFWFLSA-N -1 1 319.788 4.097 20 0 DIADMM CC(=O)c1cc(NC(=O)Nc2ccc([O-])c(Cl)c2)ccc1F ZINC000486939406 1049494805 /nfs/dbraw/zinc/49/48/05/1049494805.db2.gz UOJXMPIGMYEHJT-UHFFFAOYSA-N -1 1 322.723 4.031 20 0 DIADMM CCC[C@](C)(CC)C(=O)Nc1cccc([O-])c1Br ZINC000908706980 1049498536 /nfs/dbraw/zinc/49/85/36/1049498536.db2.gz CFLRBYFRUDDELM-AWEZNQCLSA-N -1 1 314.223 4.310 20 0 DIADMM O=C(/C=C/C1CCCCC1)Nc1cccc([O-])c1Br ZINC000908713430 1049500706 /nfs/dbraw/zinc/50/07/06/1049500706.db2.gz SUBGRGPLRZXHFD-MDZDMXLPSA-N -1 1 324.218 4.230 20 0 DIADMM O=C(Nc1cccc([O-])c1Br)[C@@H]1CCC=CCCC1 ZINC000908717538 1049500830 /nfs/dbraw/zinc/50/08/30/1049500830.db2.gz LCAIUYWYOKZBDA-LLVKDONJSA-N -1 1 324.218 4.230 20 0 DIADMM CC1CCC(=CC(=O)Nc2cccc([O-])c2Br)CC1 ZINC000908713380 1049501345 /nfs/dbraw/zinc/50/13/45/1049501345.db2.gz RAFBCNCDLLFATQ-UHFFFAOYSA-N -1 1 324.218 4.230 20 0 DIADMM CC(C)(C)c1nsc(Nc2cc(Cl)c([O-])cc2F)n1 ZINC001250019997 1049516286 /nfs/dbraw/zinc/51/62/86/1049516286.db2.gz ADSRKZPYSDNNLP-UHFFFAOYSA-N -1 1 301.774 4.077 20 0 DIADMM CCOC(=O)NC(=S)[N-]c1ccc(-c2ccccc2C)cc1 ZINC001195491190 1049536992 /nfs/dbraw/zinc/53/69/92/1049536992.db2.gz UXDDEZLAXWEYEQ-UHFFFAOYSA-N -1 1 314.410 4.105 20 0 DIADMM COC(=O)c1cc(C)cc(Nc2cc(Cl)c([O-])cc2F)c1 ZINC001250025208 1049539034 /nfs/dbraw/zinc/53/90/34/1049539034.db2.gz DJUURZRBSOWNGC-UHFFFAOYSA-N -1 1 309.724 4.023 20 0 DIADMM Cc1ccc(Nc2ccc(F)c(Br)c2[O-])c(O)c1 ZINC001206294677 1049703020 /nfs/dbraw/zinc/70/30/20/1049703020.db2.gz OZSKUFZZSUOGLT-UHFFFAOYSA-N -1 1 312.138 4.051 20 0 DIADMM CC(C)(C)Oc1ncccc1[N-]c1nc(C(C)(C)C)ns1 ZINC001206487699 1049741634 /nfs/dbraw/zinc/74/16/34/1049741634.db2.gz JHUFPJKZQZMGQJ-UHFFFAOYSA-N -1 1 306.435 4.152 20 0 DIADMM C/C=C/c1ccc(NC(=O)c2cc(Cl)c([O-])c(OC)c2)cc1 ZINC000489948357 1049793001 /nfs/dbraw/zinc/79/30/01/1049793001.db2.gz RQEUEDLZKSCETJ-ONEGZZNKSA-N -1 1 317.772 4.340 20 0 DIADMM O=S(=O)([N-]c1ccccc1Oc1ccc(Cl)cc1)C1CC1 ZINC000589435941 1050037067 /nfs/dbraw/zinc/03/70/67/1050037067.db2.gz QKGXLQJVCKGERH-UHFFFAOYSA-N -1 1 323.801 4.036 20 0 DIADMM [O-]c1c(Cl)cc(Cl)cc1Nc1ccc2c(c1)NCCO2 ZINC001209798897 1050085844 /nfs/dbraw/zinc/08/58/44/1050085844.db2.gz AOLSANRDPDJIHU-UHFFFAOYSA-N -1 1 311.168 4.247 20 0 DIADMM CO[C@@H](C)c1cccc(Nc2ccc(-n3ccc(=O)[n-]3)cc2)c1 ZINC001209955292 1050111804 /nfs/dbraw/zinc/11/18/04/1050111804.db2.gz OJMOGDSHWYBRLQ-ZDUSSCGKSA-N -1 1 309.369 4.029 20 0 DIADMM Cc1cc(Nc2ccc(F)c(Br)c2[O-])ccc1O ZINC001209979732 1050115064 /nfs/dbraw/zinc/11/50/64/1050115064.db2.gz MOOSBOBGQKGPHT-UHFFFAOYSA-N -1 1 312.138 4.051 20 0 DIADMM [O-]c1cc(Nc2ccc3c(c2)OCCCO3)c(F)cc1Cl ZINC001210003564 1050120531 /nfs/dbraw/zinc/12/05/31/1050120531.db2.gz GHWZVEUJIRTCIL-UHFFFAOYSA-N -1 1 309.724 4.090 20 0 DIADMM CC1(C)CC=C(Nc2ccc(Cl)cc2S(=O)(=O)[O-])CC1 ZINC001210166325 1050145969 /nfs/dbraw/zinc/14/59/69/1050145969.db2.gz SIIWAZCNRCEARR-UHFFFAOYSA-N -1 1 315.822 4.093 20 0 DIADMM CN(C(=O)c1c(F)ccc([O-])c1F)c1ccc(C(C)(C)C)cc1 ZINC000798283924 1050146284 /nfs/dbraw/zinc/14/62/84/1050146284.db2.gz OVFWERNFTGLNCM-UHFFFAOYSA-N -1 1 319.351 4.245 20 0 DIADMM CC(C)[C@H](NC(=O)c1ccc(F)c([O-])c1)c1ccccc1Cl ZINC001136784782 1050160067 /nfs/dbraw/zinc/16/00/67/1050160067.db2.gz DHDIZRLPJZIDAW-INIZCTEOSA-N -1 1 321.779 4.312 20 0 DIADMM CCC[C@H](NC(=O)c1ccc2ccccc2c1[O-])c1ccccn1 ZINC000591671887 1050187963 /nfs/dbraw/zinc/18/79/63/1050187963.db2.gz BNZGBYQHLNOKKN-SFHVURJKSA-N -1 1 320.392 4.212 20 0 DIADMM [O-]c1c(Cl)cc(Cl)cc1Nc1ccc(-n2ccnn2)cc1 ZINC001210296622 1050194625 /nfs/dbraw/zinc/19/46/25/1050194625.db2.gz DQHSBSADZCRCLJ-UHFFFAOYSA-N -1 1 321.167 4.023 20 0 DIADMM CC[C@H]1CCCCCN1C(=O)c1ccc2ccc(O)cc2c1[O-] ZINC001136870807 1050211353 /nfs/dbraw/zinc/21/13/53/1050211353.db2.gz NEMKAUDZDYMWFL-AWEZNQCLSA-N -1 1 313.397 4.046 20 0 DIADMM O=C(c1c([O-])cccc1Cl)N1CCC[C@]2(CC=CCC2)C1 ZINC000734026471 1050215826 /nfs/dbraw/zinc/21/58/26/1050215826.db2.gz SOJSWQXULGJQLH-QGZVFWFLSA-N -1 1 305.805 4.008 20 0 DIADMM [O-]c1ccc(-c2nc(-c3cccc(C(F)F)c3)no2)c(F)c1 ZINC000771506153 1050258155 /nfs/dbraw/zinc/25/81/55/1050258155.db2.gz IWLUJEVFUHDYDU-UHFFFAOYSA-N -1 1 306.243 4.186 20 0 DIADMM C[C@H]1C[C@H](c2ccccc2)CN1C(=O)c1c([O-])cccc1Cl ZINC000734555354 1050287692 /nfs/dbraw/zinc/28/76/92/1050287692.db2.gz PYDJKHGCLPGCCF-JSGCOSHPSA-N -1 1 315.800 4.064 20 0 DIADMM Cc1cccc([C@H](C)NC(=O)c2c([O-])cccc2Cl)c1C ZINC000734558161 1050288819 /nfs/dbraw/zinc/28/88/19/1050288819.db2.gz QUOKLSCRFXPOOW-LBPRGKRZSA-N -1 1 303.789 4.153 20 0 DIADMM Cc1c(Cl)cc(Nc2cccc3c2OCO3)c([O-])c1Cl ZINC001210561882 1050295803 /nfs/dbraw/zinc/29/58/03/1050295803.db2.gz GXLWEJSYJAYQAO-UHFFFAOYSA-N -1 1 312.152 4.480 20 0 DIADMM Cc1oncc1[N-]c1cc(-c2ccc(C(F)(F)F)cc2)no1 ZINC001210577909 1050304278 /nfs/dbraw/zinc/30/42/78/1050304278.db2.gz JCDMZPYGPSMJKO-UHFFFAOYSA-N -1 1 309.247 4.400 20 0 DIADMM Cc1oncc1[N-]c1cc(-c2ccccc2Br)no1 ZINC001210577749 1050304402 /nfs/dbraw/zinc/30/44/02/1050304402.db2.gz ANJWCQGAKYEAMW-UHFFFAOYSA-N -1 1 320.146 4.144 20 0 DIADMM [O-]c1ccc(Cl)c(Nc2cncc(N3CCCC3)c2)c1Cl ZINC001210610188 1050312684 /nfs/dbraw/zinc/31/26/84/1050312684.db2.gz WPCXIWVYJRVFAP-UHFFFAOYSA-N -1 1 324.211 4.438 20 0 DIADMM CC(C)CC[C@@H]1CCC[C@@H]1NC(=O)c1ccc(Cl)cc1[O-] ZINC001143640626 1050325810 /nfs/dbraw/zinc/32/58/10/1050325810.db2.gz BKPWUMYELCGDID-WFASDCNBSA-N -1 1 309.837 4.380 20 0 DIADMM CC(C)CC[C@H]1CCC[C@H]1NC(=O)c1ccc(Cl)cc1[O-] ZINC001143640622 1050326347 /nfs/dbraw/zinc/32/63/47/1050326347.db2.gz BKPWUMYELCGDID-IUODEOHRSA-N -1 1 309.837 4.380 20 0 DIADMM [O-]c1c(Cl)nccc1Nc1ccc(OCC(F)(F)F)cc1 ZINC001210744706 1050359478 /nfs/dbraw/zinc/35/94/78/1050359478.db2.gz GPRIFUUUQWZYRU-UHFFFAOYSA-N -1 1 318.682 4.125 20 0 DIADMM Cc1cc(=O)c2ccc(Nc3c(Cl)ccc([O-])c3F)cc2o1 ZINC001214563520 1050373414 /nfs/dbraw/zinc/37/34/14/1050373414.db2.gz GKWDDEGHUFXNHG-UHFFFAOYSA-N -1 1 319.719 4.343 20 0 DIADMM Cc1cc(=O)c2ccc(Nc3cccc([O-])c3Cl)cc2o1 ZINC001210859997 1050394324 /nfs/dbraw/zinc/39/43/24/1050394324.db2.gz PVSMXOVIKAXQAG-UHFFFAOYSA-N -1 1 301.729 4.204 20 0 DIADMM CCc1[nH]nc2ncc(Nc3cc(Cl)cc(Cl)c3[O-])cc21 ZINC001210883464 1050405932 /nfs/dbraw/zinc/40/59/32/1050405932.db2.gz DYXKIKTYWCXQQA-UHFFFAOYSA-N -1 1 323.183 4.276 20 0 DIADMM CC(=Nc1ccc(C(=O)OC(C)(C)C)cc1[O-])c1ccccc1 ZINC001210991518 1050439884 /nfs/dbraw/zinc/43/98/84/1050439884.db2.gz XYSFYHZHTKNSBK-UHFFFAOYSA-N -1 1 311.381 4.430 20 0 DIADMM CC[C@@H](C)c1ccc(S(=O)(=O)[N-]c2ccnc(Cl)c2)cc1 ZINC000226511590 1050481589 /nfs/dbraw/zinc/48/15/89/1050481589.db2.gz SAYAPQIHVBDHEY-LLVKDONJSA-N -1 1 324.833 4.049 20 0 DIADMM [O-]c1cc(F)cc(F)c1Nc1cc(O)cc(OC(F)(F)F)c1 ZINC001211124206 1050486303 /nfs/dbraw/zinc/48/63/03/1050486303.db2.gz JJFRVLVFBFNFPQ-UHFFFAOYSA-N -1 1 321.201 4.018 20 0 DIADMM CCc1ccc(C(=O)N(C)c2ccc3ccccc3c2)c([O-])c1 ZINC000786721792 1050514822 /nfs/dbraw/zinc/51/48/22/1050514822.db2.gz HHORXIKWRUSZKI-UHFFFAOYSA-N -1 1 305.377 4.384 20 0 DIADMM [O-]c1cc(Nc2ccc(C(F)(F)F)nc2Cl)cc(F)c1F ZINC001211202749 1050516622 /nfs/dbraw/zinc/51/66/22/1050516622.db2.gz ALCXKMPTOPXPAO-UHFFFAOYSA-N -1 1 324.636 4.481 20 0 DIADMM CCOC(=O)c1cccc(Nc2cc([O-])c(Cl)cc2F)c1 ZINC001211205684 1050518351 /nfs/dbraw/zinc/51/83/51/1050518351.db2.gz LSRVNLFYFKWJDD-UHFFFAOYSA-N -1 1 309.724 4.105 20 0 DIADMM [O-]c1cc(F)c(-c2ccnc(OCc3ccccc3)c2)cc1F ZINC001211340898 1050552498 /nfs/dbraw/zinc/55/24/98/1050552498.db2.gz ZUVDEJCGKYRXNT-UHFFFAOYSA-N -1 1 313.303 4.311 20 0 DIADMM COc1ccc(-c2cc(F)c([O-])cc2F)c(C(F)(F)F)c1 ZINC001211338700 1050552965 /nfs/dbraw/zinc/55/29/65/1050552965.db2.gz HROVBSWZURCHIF-UHFFFAOYSA-N -1 1 304.214 4.365 20 0 DIADMM COc1ccc(C(F)(F)F)cc1-c1cc(F)c([O-])cc1F ZINC001211349853 1050554107 /nfs/dbraw/zinc/55/41/07/1050554107.db2.gz JDURQHCODKAXED-UHFFFAOYSA-N -1 1 304.214 4.365 20 0 DIADMM CCOC(OCC)c1ccc(-c2cc(F)c([O-])cc2F)cc1 ZINC001211352363 1050555514 /nfs/dbraw/zinc/55/55/14/1050555514.db2.gz LDZVVPKBPWHHFJ-UHFFFAOYSA-N -1 1 308.324 4.409 20 0 DIADMM Cc1c(Cl)cc(Nc2cccc(CO)c2F)c([O-])c1Cl ZINC001211442180 1050569400 /nfs/dbraw/zinc/56/94/00/1050569400.db2.gz IRPZESFUJZCHHQ-UHFFFAOYSA-N -1 1 316.159 4.382 20 0 DIADMM CN(Cc1cc2ccccc2o1)C(=O)c1c([O-])cccc1Cl ZINC000746702256 1050613240 /nfs/dbraw/zinc/61/32/40/1050613240.db2.gz RVAATQDGHAVMAP-UHFFFAOYSA-N -1 1 315.756 4.064 20 0 DIADMM [O-]c1cc(F)c(CN2CCC[C@@H]2c2cccc(F)c2)c(F)c1 ZINC001144554634 1050613183 /nfs/dbraw/zinc/61/31/83/1050613183.db2.gz CUGFCMDJLPAPIS-QGZVFWFLSA-N -1 1 307.315 4.147 20 0 DIADMM [O-]c1cc(F)c(CN2CCC[C@@H]2c2ccccc2F)c(F)c1 ZINC001144555018 1050615569 /nfs/dbraw/zinc/61/55/69/1050615569.db2.gz RDCZQQIITNUKJN-QGZVFWFLSA-N -1 1 307.315 4.147 20 0 DIADMM [O-]c1c(F)c(F)ccc1Nc1ccc(OCC(F)F)cc1 ZINC001213309682 1050625454 /nfs/dbraw/zinc/62/54/54/1050625454.db2.gz JOFPJUSUIHFOEV-UHFFFAOYSA-N -1 1 301.239 4.058 20 0 DIADMM [O-]c1cc(F)cc(F)c1Nc1ccc(OCC(F)F)cc1 ZINC001213305404 1050625536 /nfs/dbraw/zinc/62/55/36/1050625536.db2.gz ZVDNXTSEXQJTHU-UHFFFAOYSA-N -1 1 301.239 4.058 20 0 DIADMM [O-]c1cc(F)c(Nc2ccc(OCC(F)F)cc2)cc1F ZINC001213309772 1050625791 /nfs/dbraw/zinc/62/57/91/1050625791.db2.gz OBEPLVZUDPJULF-UHFFFAOYSA-N -1 1 301.239 4.058 20 0 DIADMM [O-]c1c(Cl)c(Cl)ccc1Nc1cc(F)c(O)c(F)c1 ZINC001213386706 1050643841 /nfs/dbraw/zinc/64/38/41/1050643841.db2.gz QOIWIZTWOMLAGU-UHFFFAOYSA-N -1 1 306.095 4.426 20 0 DIADMM COc1ccc([C@@H]2CCCN2Cc2cc(F)c([O-])cc2F)cc1 ZINC001144667067 1050645477 /nfs/dbraw/zinc/64/54/77/1050645477.db2.gz QTBCNHHUNQZPFJ-KRWDZBQOSA-N -1 1 319.351 4.016 20 0 DIADMM [O-]c1cc(F)c(CN2CCC[C@H]2c2cccc(F)c2)cc1F ZINC001144666509 1050646587 /nfs/dbraw/zinc/64/65/87/1050646587.db2.gz LNMFKMFKQLYVPE-INIZCTEOSA-N -1 1 307.315 4.147 20 0 DIADMM CC[C@@H]1c2ccccc2CCN1Cc1cc(F)c([O-])cc1F ZINC001144659331 1050648108 /nfs/dbraw/zinc/64/81/08/1050648108.db2.gz DMHVAQSBMCUINO-QGZVFWFLSA-N -1 1 303.352 4.180 20 0 DIADMM C/C(=C\CN1CCC[C@H]1c1ccc(Cl)c(Cl)c1)C(=O)[O-] ZINC000846237272 1050701201 /nfs/dbraw/zinc/70/12/01/1050701201.db2.gz CEFFOEDEAJMXDX-XYYIANASSA-N -1 1 314.212 4.161 20 0 DIADMM C/C(=C\CN(C)[C@@H](C)c1ccc(Cl)cc1Cl)C(=O)[O-] ZINC000846240831 1050702082 /nfs/dbraw/zinc/70/20/82/1050702082.db2.gz ZTUQGCNDAWMVJI-ZKXNXJMVSA-N -1 1 302.201 4.017 20 0 DIADMM Cc1sccc1NC(=O)c1ccc(C(F)(F)F)cc1[O-] ZINC001171246490 1050739853 /nfs/dbraw/zinc/73/98/53/1050739853.db2.gz JSAIZLYSCGTSAJ-UHFFFAOYSA-N -1 1 301.289 4.033 20 0 DIADMM [O-]c1cc(F)cc(F)c1Nc1ccc(N2CCCC2)cc1F ZINC001213849920 1050763623 /nfs/dbraw/zinc/76/36/23/1050763623.db2.gz SMGWWPIIFNWGDI-UHFFFAOYSA-N -1 1 308.303 4.153 20 0 DIADMM O=c1[nH]ccc2ccc(Nc3cc([O-])c(Cl)cc3F)cc12 ZINC001213961137 1050792162 /nfs/dbraw/zinc/79/21/62/1050792162.db2.gz OWFSFXWWUSXRLZ-UHFFFAOYSA-N -1 1 304.708 4.182 20 0 DIADMM COc1cc(F)c(Nc2cc(F)c([O-])cc2F)cc1Cl ZINC001214067924 1050809137 /nfs/dbraw/zinc/80/91/37/1050809137.db2.gz VEIMCZYXEGHQEQ-UHFFFAOYSA-N -1 1 303.667 4.215 20 0 DIADMM COc1cc(F)c(Nc2cc(F)c([O-])c(F)c2)cc1Cl ZINC001214065422 1050810002 /nfs/dbraw/zinc/81/00/02/1050810002.db2.gz RWRARWHEONKWRJ-UHFFFAOYSA-N -1 1 303.667 4.215 20 0 DIADMM Cc1cc(F)cc(Nc2cc3ccc([O-])cc3oc2=O)c1Cl ZINC001214073622 1050811735 /nfs/dbraw/zinc/81/17/35/1050811735.db2.gz RECRPORGXFMYKD-UHFFFAOYSA-N -1 1 319.719 4.343 20 0 DIADMM CCC(NC(=O)c1ccc2ccccc2c1[O-])(C1CC1)C1CC1 ZINC001147385122 1050878262 /nfs/dbraw/zinc/87/82/62/1050878262.db2.gz TXQYJNYHCXYLCN-UHFFFAOYSA-N -1 1 309.409 4.244 20 0 DIADMM [O-]c1c(F)cc(Nc2cccc(Br)n2)cc1Cl ZINC001214477214 1050915215 /nfs/dbraw/zinc/91/52/15/1050915215.db2.gz AGYMHFAZELQFGF-UHFFFAOYSA-N -1 1 317.545 4.086 20 0 DIADMM [O-]c1c(F)cc(Nc2nc(Cl)cnc2Cl)cc1Cl ZINC001214482584 1050917251 /nfs/dbraw/zinc/91/72/51/1050917251.db2.gz CGYSIXAOAAWWNW-UHFFFAOYSA-N -1 1 308.527 4.025 20 0 DIADMM Cc1cc2c(ncnc2Nc2cc(F)c([O-])c(Cl)c2)s1 ZINC001214480210 1050917403 /nfs/dbraw/zinc/91/74/03/1050917403.db2.gz PGGCYWCVIPJIHE-UHFFFAOYSA-N -1 1 309.753 4.241 20 0 DIADMM [O-]c1c(F)cc(Nc2cc(-c3cccnc3)ccn2)cc1Cl ZINC001214480474 1050918102 /nfs/dbraw/zinc/91/81/02/1050918102.db2.gz RNXITNWTXLLIAC-UHFFFAOYSA-N -1 1 315.735 4.385 20 0 DIADMM [O-]c1c(F)cc(Nc2ncccc2OC(F)(F)F)cc1Cl ZINC001214482985 1050918183 /nfs/dbraw/zinc/91/81/83/1050918183.db2.gz YAIOGKTUDZPQBM-UHFFFAOYSA-N -1 1 322.645 4.222 20 0 DIADMM [O-]c1c(F)cc(Nc2ncccc2Br)cc1Cl ZINC001214477381 1050918363 /nfs/dbraw/zinc/91/83/63/1050918363.db2.gz KCOPJUZFNLJVIJ-UHFFFAOYSA-N -1 1 317.545 4.086 20 0 DIADMM [O-]c1c(F)cc(Nc2ccnn2Cc2ccccc2)cc1Cl ZINC001214480201 1050918864 /nfs/dbraw/zinc/91/88/64/1050918864.db2.gz OUJZDRNBGFOZAY-UHFFFAOYSA-N -1 1 317.751 4.173 20 0 DIADMM COc1cccc2ncc(Nc3cc(F)c([O-])c(Cl)c3)cc21 ZINC001214484647 1050919352 /nfs/dbraw/zinc/91/93/52/1050919352.db2.gz OJIOUOOYFWGHPB-UHFFFAOYSA-N -1 1 318.735 4.485 20 0 DIADMM [O-]c1c(F)cc(Nc2cc(-c3ccccc3)cnn2)cc1Cl ZINC001214486352 1050919712 /nfs/dbraw/zinc/91/97/12/1050919712.db2.gz CAWDKBOTHJWKBJ-UHFFFAOYSA-N -1 1 315.735 4.385 20 0 DIADMM [O-]c1c(F)cc(Nc2ccc(Cn3ccnc3)cc2)cc1Cl ZINC001214488584 1050920300 /nfs/dbraw/zinc/92/03/00/1050920300.db2.gz HOERVJYHDXSUAS-UHFFFAOYSA-N -1 1 317.751 4.173 20 0 DIADMM [O-]c1c(F)cc(Nc2ccnc(OC(F)(F)F)c2)cc1Cl ZINC001214486675 1050920969 /nfs/dbraw/zinc/92/09/69/1050920969.db2.gz TZEVPKAMUXFGIV-UHFFFAOYSA-N -1 1 322.645 4.222 20 0 DIADMM COc1cc(Nc2cc(F)c([O-])c(Cl)c2)ccc1C(C)=O ZINC001214491576 1050921949 /nfs/dbraw/zinc/92/19/49/1050921949.db2.gz CZOCEHYYMLCQHP-UHFFFAOYSA-N -1 1 309.724 4.140 20 0 DIADMM Cc1nn(C)c2ccc(Nc3cc(F)c([O-])c(Cl)c3)cc12 ZINC001214490319 1050922288 /nfs/dbraw/zinc/92/22/88/1050922288.db2.gz TXOQDOMPXRLBAQ-UHFFFAOYSA-N -1 1 305.740 4.123 20 0 DIADMM [O-]c1c(F)cc(Nc2ccc(-c3ccncn3)cc2)cc1Cl ZINC001214490560 1050923202 /nfs/dbraw/zinc/92/32/02/1050923202.db2.gz XWHQNNTZXDROPY-UHFFFAOYSA-N -1 1 315.735 4.385 20 0 DIADMM COC(=O)CCc1ccc(Nc2cc(F)c([O-])c(Cl)c2)cc1 ZINC001214492308 1050923548 /nfs/dbraw/zinc/92/35/48/1050923548.db2.gz YNQQCHBSDAUMRD-UHFFFAOYSA-N -1 1 323.751 4.034 20 0 DIADMM CCOC(=O)Cc1ccccc1Nc1cc(F)c([O-])c(Cl)c1 ZINC001214494762 1050924324 /nfs/dbraw/zinc/92/43/24/1050924324.db2.gz ZFKSRWJZKBEXKC-UHFFFAOYSA-N -1 1 323.751 4.034 20 0 DIADMM O=c1ccc2cccc(Nc3cc(F)c([O-])c(Cl)c3)c2[nH]1 ZINC001214494126 1050925363 /nfs/dbraw/zinc/92/53/63/1050925363.db2.gz IQVUZRCZUGLGDT-UHFFFAOYSA-N -1 1 304.708 4.182 20 0 DIADMM C[C@H](C(=O)Nc1cc(Cl)c([O-])c2ccccc12)n1cccc1 ZINC001148251824 1050926048 /nfs/dbraw/zinc/92/60/48/1050926048.db2.gz CKNZWUMFDAUCMQ-LLVKDONJSA-N -1 1 314.772 4.200 20 0 DIADMM CCCC1CCN(C(=O)c2ccc(C(F)(F)F)cc2[O-])CC1 ZINC001148797777 1050975767 /nfs/dbraw/zinc/97/57/67/1050975767.db2.gz GKSTXNSEWKRDNY-UHFFFAOYSA-N -1 1 315.335 4.063 20 0 DIADMM O=C(c1cccc(-c2ccccc2)c1[O-])N1CCC12CCCC2 ZINC001148867331 1050980854 /nfs/dbraw/zinc/98/08/54/1050980854.db2.gz QBZPOQQEYRGNII-UHFFFAOYSA-N -1 1 307.393 4.218 20 0 DIADMM Cc1c(F)cccc1S(=O)(=O)[N-]c1ccc2ccccc2c1 ZINC000743252370 1051006623 /nfs/dbraw/zinc/00/66/23/1051006623.db2.gz YSHXXXFUIJDPMV-UHFFFAOYSA-N -1 1 315.369 4.088 20 0 DIADMM COc1ccc(-c2nc(-c3ccc(Cl)c(C)c3)no2)c([O-])c1 ZINC001215149550 1051090273 /nfs/dbraw/zinc/09/02/73/1051090273.db2.gz ITRWQWPQKIHSOZ-UHFFFAOYSA-N -1 1 316.744 4.080 20 0 DIADMM Cc1ccccc1C[C@@H](C)N(C)C(=O)c1c([O-])cccc1Cl ZINC000773211562 1051113208 /nfs/dbraw/zinc/11/32/08/1051113208.db2.gz GKBFCDHQQOKXDP-CYBMUJFWSA-N -1 1 317.816 4.057 20 0 DIADMM COCOc1ccc(Nc2cc(F)c([O-])cc2F)cc1Cl ZINC001215261732 1051140889 /nfs/dbraw/zinc/14/08/89/1051140889.db2.gz LBLORASNBVKGLQ-UHFFFAOYSA-N -1 1 315.703 4.050 20 0 DIADMM COCOc1ccc(Nc2cc([O-])c(F)c(F)c2)cc1Cl ZINC001215261292 1051141736 /nfs/dbraw/zinc/14/17/36/1051141736.db2.gz AILGSISZBTZBCP-UHFFFAOYSA-N -1 1 315.703 4.050 20 0 DIADMM [O-]c1ccc(-c2nc(-c3ccc4ncccc4c3)no2)c(Cl)c1 ZINC001215343570 1051172717 /nfs/dbraw/zinc/17/27/17/1051172717.db2.gz ZKSYWTODLHYWJE-UHFFFAOYSA-N -1 1 323.739 4.311 20 0 DIADMM Cc1[nH]c2ccc(Cl)cc2c1C(=O)Nc1cccc(F)c1[O-] ZINC001171632441 1051175115 /nfs/dbraw/zinc/17/51/15/1051175115.db2.gz ASJRXUJLZQBQGU-UHFFFAOYSA-N -1 1 318.735 4.227 20 0 DIADMM CC[C@H](Cc1cccc(C)c1)C(=O)Nc1cccc(F)c1[O-] ZINC001171637703 1051194634 /nfs/dbraw/zinc/19/46/34/1051194634.db2.gz QAQWSLUJYUCCOZ-CQSZACIVSA-N -1 1 301.361 4.047 20 0 DIADMM O=C(Nc1cccc(F)c1[O-])C1=C(c2ccccc2)CCCC1 ZINC001171636327 1051194861 /nfs/dbraw/zinc/19/48/61/1051194861.db2.gz GRMURNFXTCPJAO-UHFFFAOYSA-N -1 1 311.356 4.498 20 0 DIADMM Cc1ccc(Nc2cc(F)c([O-])cc2F)c(Br)c1 ZINC001215572077 1051252207 /nfs/dbraw/zinc/25/22/07/1051252207.db2.gz WKRABWIBQHYWSX-UHFFFAOYSA-N -1 1 314.129 4.485 20 0 DIADMM COc1cc(Nc2cc(F)c([O-])cc2F)ccc1N1CCCC1 ZINC001215576230 1051253941 /nfs/dbraw/zinc/25/39/41/1051253941.db2.gz PGEMQTKADMFLCY-UHFFFAOYSA-N -1 1 320.339 4.023 20 0 DIADMM [O-]c1cc(Nc2ccc(C(F)(F)F)cc2O)cc(F)c1F ZINC001212633031 1051258494 /nfs/dbraw/zinc/25/84/94/1051258494.db2.gz BUPBCVPWTCEOHE-UHFFFAOYSA-N -1 1 305.202 4.138 20 0 DIADMM CCCOc1ccc(C)c(Nc2ccc(-n3ccc(=O)[n-]3)cc2)c1 ZINC001215587323 1051261836 /nfs/dbraw/zinc/26/18/36/1051261836.db2.gz ONKIGFNLMJXEDS-UHFFFAOYSA-N -1 1 323.396 4.419 20 0 DIADMM Cc1ccc(OC(C)C)cc1Nc1ccc(-n2ccc(=O)[n-]2)cc1 ZINC001215587025 1051262013 /nfs/dbraw/zinc/26/20/13/1051262013.db2.gz ZDDNKJBCWBIBSA-UHFFFAOYSA-N -1 1 323.396 4.417 20 0 DIADMM CC(=O)c1ccc([O-])c(CCOC(=O)CCCC2CCCC2)c1 ZINC000745603454 1051269376 /nfs/dbraw/zinc/26/93/76/1051269376.db2.gz UMWQASDUOPHRDF-UHFFFAOYSA-N -1 1 318.413 4.041 20 0 DIADMM CC(C)Oc1c(F)ccc(Nc2c([O-])cc(F)cc2F)c1F ZINC001215728632 1051330430 /nfs/dbraw/zinc/33/04/30/1051330430.db2.gz PGCOQRNMCXBJFF-UHFFFAOYSA-N -1 1 315.266 4.479 20 0 DIADMM COc1ncc(-c2ccc(Cl)c([O-])c2)cc1C(F)(F)F ZINC001243581785 1051341735 /nfs/dbraw/zinc/34/17/35/1051341735.db2.gz USVGXVYWYYFLQD-UHFFFAOYSA-N -1 1 303.667 4.135 20 0 DIADMM COc1ccc(Nc2c(Cl)ccc([O-])c2Cl)c2c[nH]nc21 ZINC001215751583 1051344530 /nfs/dbraw/zinc/34/45/30/1051344530.db2.gz SFVILXNCYLOLFH-UHFFFAOYSA-N -1 1 324.167 4.328 20 0 DIADMM [O-]c1ccc(F)cc1-c1nc(-c2cc(F)ccc2Cl)no1 ZINC001215769535 1051357796 /nfs/dbraw/zinc/35/77/96/1051357796.db2.gz JHOQSMLKGYVEHC-UHFFFAOYSA-N -1 1 308.671 4.041 20 0 DIADMM Cc1ccc(Cl)cc1-c1noc(-c2ccc(F)c([O-])c2)n1 ZINC001215839434 1051402960 /nfs/dbraw/zinc/40/29/60/1051402960.db2.gz SHMUEBPDGCGQCO-UHFFFAOYSA-N -1 1 304.708 4.210 20 0 DIADMM [O-]c1cc(-c2nc(-c3cccc(C(F)(F)F)c3)no2)ccc1F ZINC001215843013 1051407196 /nfs/dbraw/zinc/40/71/96/1051407196.db2.gz WIXXKOXVXITPJG-UHFFFAOYSA-N -1 1 324.233 4.267 20 0 DIADMM CC(C)c1cc(Nc2cc3ccc([O-])cc3oc2=O)ccc1O ZINC001215844337 1051408737 /nfs/dbraw/zinc/40/87/37/1051408737.db2.gz GBPPDYJRUGAJRP-UHFFFAOYSA-N -1 1 311.337 4.071 20 0 DIADMM CSc1ncc(Cl)cc1Nc1cc([O-])c(F)c(F)c1 ZINC001215916211 1051452993 /nfs/dbraw/zinc/45/29/93/1051452993.db2.gz NUZJJGIDIXFAOQ-UHFFFAOYSA-N -1 1 302.733 4.184 20 0 DIADMM O=c1oc2cc([O-])ccc2cc1Nc1cc(F)cc(F)c1Cl ZINC001215950527 1051476375 /nfs/dbraw/zinc/47/63/75/1051476375.db2.gz ASKVAZSESGDXBF-UHFFFAOYSA-N -1 1 323.682 4.174 20 0 DIADMM FC(F)(F)c1cccc(Cl)c1[N-]c1noc2nccnc12 ZINC001215969806 1051493243 /nfs/dbraw/zinc/49/32/43/1051493243.db2.gz TWHVOBNBALFOMT-UHFFFAOYSA-N -1 1 314.654 4.034 20 0 DIADMM [O-]c1cccc(-c2nc(-c3ccccc3C(F)(F)F)no2)c1F ZINC001215983990 1051502803 /nfs/dbraw/zinc/50/28/03/1051502803.db2.gz DYJDGYHXVUDROC-UHFFFAOYSA-N -1 1 324.233 4.267 20 0 DIADMM Nc1ccc(Nc2ccc(F)c(F)c2[O-])c(C(F)(F)F)c1 ZINC001216133933 1051594588 /nfs/dbraw/zinc/59/45/88/1051594588.db2.gz YADYVERHSPYESG-UHFFFAOYSA-N -1 1 304.218 4.015 20 0 DIADMM O=C(NC(C1CCCC1)C1CCCC1)c1ccc(F)c([O-])c1 ZINC001156358719 1051670501 /nfs/dbraw/zinc/67/05/01/1051670501.db2.gz RWKPPGSINMVTPF-UHFFFAOYSA-N -1 1 305.393 4.010 20 0 DIADMM Cc1cccc(-c2noc(-c3cc([O-])cc(F)c3)n2)c1Cl ZINC001216339794 1051708998 /nfs/dbraw/zinc/70/89/98/1051708998.db2.gz NFDRAULSONWHNG-UHFFFAOYSA-N -1 1 304.708 4.210 20 0 DIADMM O=C(Nc1ccc(Cl)cc1Cl)c1ccc([O-])c(F)c1 ZINC000767245973 1051782468 /nfs/dbraw/zinc/78/24/68/1051782468.db2.gz LUUVZVSKABFRGV-UHFFFAOYSA-N -1 1 300.116 4.090 20 0 DIADMM CC(C)(O)c1cc(F)cc(Nc2cc([O-])c(Cl)cc2F)c1 ZINC001216492189 1051789457 /nfs/dbraw/zinc/78/94/57/1051789457.db2.gz TZAHSSNGNFEBDW-UHFFFAOYSA-N -1 1 313.731 4.295 20 0 DIADMM O=c1oc2cc([O-])ccc2cc1Nc1cccc(C(F)(F)F)c1 ZINC001173822829 1051799218 /nfs/dbraw/zinc/79/92/18/1051799218.db2.gz MQELXTQMKLEAGV-UHFFFAOYSA-N -1 1 321.254 4.261 20 0 DIADMM [O-]c1cc(Nc2cccc(OC(F)(F)F)c2F)cc(F)c1F ZINC001216522947 1051803354 /nfs/dbraw/zinc/80/33/54/1051803354.db2.gz JTTWNGGHFXHDLD-UHFFFAOYSA-N -1 1 323.192 4.452 20 0 DIADMM CC(C)(C)OC(=O)n1ccc([N-]c2nc3ccccc3s2)n1 ZINC001216668997 1051857307 /nfs/dbraw/zinc/85/73/07/1051857307.db2.gz RVKJUKQQFMSAMZ-UHFFFAOYSA-N -1 1 316.386 4.020 20 0 DIADMM COc1ccc(Nc2cc(Cl)c([O-])cc2Cl)c(OC)c1 ZINC001173891340 1051857959 /nfs/dbraw/zinc/85/79/59/1051857959.db2.gz MHWYVCQTWFQGNA-UHFFFAOYSA-N -1 1 314.168 4.460 20 0 DIADMM CCC[C@@H](C)c1cc([N-]c2ccn(C(=O)OC(C)(C)C)n2)on1 ZINC001216670924 1051859031 /nfs/dbraw/zinc/85/90/31/1051859031.db2.gz HBSBQGCZBVIFNS-LLVKDONJSA-N -1 1 320.393 4.302 20 0 DIADMM CCS(=O)(=O)c1ccc([O-])c(Nc2ccc(C(C)C)cc2)c1 ZINC001173893572 1051859624 /nfs/dbraw/zinc/85/96/24/1051859624.db2.gz HSLITFCJIHDYAT-UHFFFAOYSA-N -1 1 319.426 4.053 20 0 DIADMM [O-]c1cc(Cl)c(Nc2ccc3c(c2)OCCO3)cc1Cl ZINC001173878786 1051884476 /nfs/dbraw/zinc/88/44/76/1051884476.db2.gz FNGYLLMKTBNEOM-UHFFFAOYSA-N -1 1 312.152 4.214 20 0 DIADMM [O-]c1ccc(OC(F)(F)F)cc1-c1nc(-c2ccccc2)no1 ZINC001216921780 1051908415 /nfs/dbraw/zinc/90/84/15/1051908415.db2.gz APFABCMPXURVGD-UHFFFAOYSA-N -1 1 322.242 4.008 20 0 DIADMM Cc1cc(Cl)ccc1-c1noc(-c2c(F)ccc([O-])c2F)n1 ZINC001216922803 1051910082 /nfs/dbraw/zinc/91/00/82/1051910082.db2.gz SCWZPPLXGOPSBI-UHFFFAOYSA-N -1 1 322.698 4.349 20 0 DIADMM Cc1ccc(-c2noc(-c3cc([O-])cc(F)c3F)n2)cc1C ZINC001216923799 1051910228 /nfs/dbraw/zinc/91/02/28/1051910228.db2.gz QBMVUAQGSWURMC-UHFFFAOYSA-N -1 1 302.280 4.004 20 0 DIADMM Cc1ccc(-c2noc(-c3cc([O-])cc(F)c3F)n2)c(Cl)c1 ZINC001216922673 1051910620 /nfs/dbraw/zinc/91/06/20/1051910620.db2.gz FMIGELYIPZUKDF-UHFFFAOYSA-N -1 1 322.698 4.349 20 0 DIADMM Cc1cccc(-c2noc(-c3cc([O-])cc(F)c3F)n2)c1Cl ZINC001216923387 1051911631 /nfs/dbraw/zinc/91/16/31/1051911631.db2.gz NBFTWJFIPSKBCK-UHFFFAOYSA-N -1 1 322.698 4.349 20 0 DIADMM Cc1ccc(Cl)c(-c2noc(-c3c(C)cc(O)cc3[O-])n2)c1 ZINC001216985594 1051927203 /nfs/dbraw/zinc/92/72/03/1051927203.db2.gz FPOGEKRWXICTDQ-UHFFFAOYSA-N -1 1 316.744 4.085 20 0 DIADMM Cc1ccc(Nc2cc3ccc([O-])cc3oc2=O)c(Cl)c1 ZINC001174044780 1051963904 /nfs/dbraw/zinc/96/39/04/1051963904.db2.gz NZMPFXPAGPKXIK-UHFFFAOYSA-N -1 1 301.729 4.204 20 0 DIADMM [O-]c1c(-c2nc(-c3cccc(Cl)c3)no2)ccc2cccnc21 ZINC001217143299 1051976525 /nfs/dbraw/zinc/97/65/25/1051976525.db2.gz VCZYLWGSAHIQNV-UHFFFAOYSA-N -1 1 323.739 4.311 20 0 DIADMM [O-]c1c(-c2nc(-c3ccccc3F)no2)cc(O)c2ccccc12 ZINC001217160251 1051984142 /nfs/dbraw/zinc/98/41/42/1051984142.db2.gz WMUWPRQPYIFGEE-UHFFFAOYSA-N -1 1 322.295 4.107 20 0 DIADMM Cc1ccc(F)c(Nc2ccc(F)c(Br)c2[O-])c1 ZINC001174114424 1051988045 /nfs/dbraw/zinc/98/80/45/1051988045.db2.gz RUKOUVYLSSOXSC-UHFFFAOYSA-N -1 1 314.129 4.485 20 0 DIADMM Cc1ccc([C@H](C)N(C)C(=O)c2c([O-])cccc2Cl)cc1 ZINC000769671469 1052091690 /nfs/dbraw/zinc/09/16/90/1052091690.db2.gz LPQYPDLMLRUHKJ-LBPRGKRZSA-N -1 1 303.789 4.187 20 0 DIADMM CCN(C(=O)c1c([O-])cccc1Cl)[C@H](C)c1ccc(F)cc1 ZINC000769711819 1052095364 /nfs/dbraw/zinc/09/53/64/1052095364.db2.gz IRFYMZFPNNAKRX-LLVKDONJSA-N -1 1 321.779 4.408 20 0 DIADMM CCN(C(=O)c1c([O-])cccc1Cl)[C@@H](C)c1ccc(F)cc1 ZINC000769711823 1052095385 /nfs/dbraw/zinc/09/53/85/1052095385.db2.gz IRFYMZFPNNAKRX-NSHDSACASA-N -1 1 321.779 4.408 20 0 DIADMM CCN(C(=O)c1cc(F)ccc1[O-])c1ccc2ccccc2c1 ZINC000769738674 1052102859 /nfs/dbraw/zinc/10/28/59/1052102859.db2.gz RIPCBYMWHMMCBC-UHFFFAOYSA-N -1 1 309.340 4.351 20 0 DIADMM CCCN(C(=O)c1ncc(C)cc1[O-])[C@@H](CC)c1ccccc1 ZINC000494823087 1052137774 /nfs/dbraw/zinc/13/77/74/1052137774.db2.gz WRPAQRQMCUAKDG-INIZCTEOSA-N -1 1 312.413 4.099 20 0 DIADMM Cn1cc(-c2ccc(Nc3cc([O-])c(Cl)cc3F)cc2)cn1 ZINC001174380252 1052139102 /nfs/dbraw/zinc/13/91/02/1052139102.db2.gz NOHFUBYMQKABQA-UHFFFAOYSA-N -1 1 317.751 4.329 20 0 DIADMM CC(C)(C)OC(=O)c1ccc([N-]c2nnc(C(C)(C)C)o2)cc1 ZINC001174425947 1052155787 /nfs/dbraw/zinc/15/57/87/1052155787.db2.gz JVIWFLLJFSHCMZ-UHFFFAOYSA-N -1 1 317.389 4.066 20 0 DIADMM CC(C)Oc1c(F)c(F)ccc1-c1cc(F)c([O-])cc1F ZINC001222083244 1052439655 /nfs/dbraw/zinc/43/96/55/1052439655.db2.gz VQQGPNDAFNDRDW-UHFFFAOYSA-N -1 1 300.251 4.403 20 0 DIADMM CCCCC[C@H](OCCCC[P@](=O)([O-])O)[C@@H](C)CCC ZINC001225019615 1052744665 /nfs/dbraw/zinc/74/46/65/1052744665.db2.gz YXEYVNOOMDHSDZ-GJZGRUSLSA-N -1 1 308.399 4.346 20 0 DIADMM O=C(Nc1ccc([O-])c(Cl)c1)C1(c2cccc(F)c2)CCC1 ZINC000129598095 1052797065 /nfs/dbraw/zinc/79/70/65/1052797065.db2.gz YSUWATIJPFLFCW-UHFFFAOYSA-N -1 1 319.763 4.245 20 0 DIADMM CC(=O)c1ccccc1OC(=C([O-])c1ccco1)c1ccco1 ZINC001225572659 1052803357 /nfs/dbraw/zinc/80/33/57/1052803357.db2.gz NDRLOLZKSOUOLZ-SFHVURJKSA-N -1 1 310.305 4.078 20 0 DIADMM CC(=O)c1ccc([O-])cc1O[C@H]1CCc2cc(Cl)ccc21 ZINC001225616725 1052808733 /nfs/dbraw/zinc/80/87/33/1052808733.db2.gz ONRKWRVPEZNZPH-INIZCTEOSA-N -1 1 302.757 4.315 20 0 DIADMM CC(=O)c1ccc([O-])cc1O[C@@H]1CCc2ccc(Cl)cc21 ZINC001225618452 1052809136 /nfs/dbraw/zinc/80/91/36/1052809136.db2.gz FFZACCXIZPDDJD-MRXNPFEDSA-N -1 1 302.757 4.315 20 0 DIADMM CC(=O)c1ccc([O-])cc1O[C@H]1CCCc2c(Cl)ccnc21 ZINC001225619182 1052809241 /nfs/dbraw/zinc/80/92/41/1052809241.db2.gz MSXSESXCHUXKMU-HNNXBMFYSA-N -1 1 317.772 4.100 20 0 DIADMM CC(=O)c1c(O)cc([O-])cc1O[C@@H]1CC[C@@H]2CCCC[C@@H]2C1 ZINC001225679976 1052815777 /nfs/dbraw/zinc/81/57/77/1052815777.db2.gz SZIZRKXZFJXEOV-GZBFAFLISA-N -1 1 304.386 4.038 20 0 DIADMM CCC[C@H](Oc1cc([O-])cc(O)c1C(C)=O)c1ccccc1 ZINC001225673903 1052815810 /nfs/dbraw/zinc/81/58/10/1052815810.db2.gz BAPIATRQZQRAQE-INIZCTEOSA-N -1 1 300.354 4.221 20 0 DIADMM C[C@@H](Oc1ccc(C(=O)c2ccc([O-])cc2)cc1)c1ccncc1 ZINC001225810739 1052833849 /nfs/dbraw/zinc/83/38/49/1052833849.db2.gz OKYZBPMOXAKJJZ-CQSZACIVSA-N -1 1 319.360 4.158 20 0 DIADMM C[C@@H](NC(=O)NCc1ccc([O-])c(Cl)c1)C1CCCCCC1 ZINC001225995903 1052856498 /nfs/dbraw/zinc/85/64/98/1052856498.db2.gz LBCQVKDCMXJOMF-GFCCVEGCSA-N -1 1 324.852 4.204 20 0 DIADMM Cc1cc(=O)oc2cc([O-])cc(O[C@H](C)CCc3ccccc3)c12 ZINC001226483121 1052901273 /nfs/dbraw/zinc/90/12/73/1052901273.db2.gz AICGFCQEDAMFQP-CQSZACIVSA-N -1 1 324.376 4.207 20 0 DIADMM CC(C)=CCC[C@H](C)Oc1cc([O-])cc2oc(=O)cc(C)c12 ZINC001226487625 1052902186 /nfs/dbraw/zinc/90/21/86/1052902186.db2.gz ZTFOZSVVAGPQPZ-ZDUSSCGKSA-N -1 1 302.370 4.321 20 0 DIADMM C[C@H](Oc1[n-]c(=S)ncc1F)c1cc(Cl)ccc1Cl ZINC001227386261 1052987496 /nfs/dbraw/zinc/98/74/96/1052987496.db2.gz OSLYFOXGDINYOH-LURJTMIESA-N -1 1 319.188 4.351 20 0 DIADMM CCC[C@@H](C)[C@@H](Oc1cc([O-])ccc1C(=O)COC)C(C)C ZINC001227173220 1052967710 /nfs/dbraw/zinc/96/77/10/1052967710.db2.gz VGFABIMYTJKGJU-ACJLOTCBSA-N -1 1 308.418 4.061 20 0 DIADMM CCC[C@H](C)[C@H](Oc1cc([O-])ccc1C(=O)COC)C(C)C ZINC001227173224 1052967738 /nfs/dbraw/zinc/96/77/38/1052967738.db2.gz VGFABIMYTJKGJU-SCLBCKFNSA-N -1 1 308.418 4.061 20 0 DIADMM Cc1ccccc1Cc1noc(-c2ccc3ccccc3c2[O-])n1 ZINC000324775037 1052972075 /nfs/dbraw/zinc/97/20/75/1052972075.db2.gz DVLOPCHQNQGUNU-UHFFFAOYSA-N -1 1 316.360 4.495 20 0 DIADMM [O-]c1cc(Cl)c(OC[C@H]2Cc3ccccc3O2)cc1Cl ZINC001227642151 1053005801 /nfs/dbraw/zinc/00/58/01/1053005801.db2.gz VWHJNCJFUNCLLM-SNVBAGLBSA-N -1 1 311.164 4.082 20 0 DIADMM CCOC(=O)[C@@H](CC(C)C)Oc1cc(Cl)c([O-])cc1Cl ZINC001227642305 1053006003 /nfs/dbraw/zinc/00/60/03/1053006003.db2.gz XLTRMICCLKCIQO-CYBMUJFWSA-N -1 1 321.200 4.056 20 0 DIADMM [O-]c1cc(Cl)c(O[C@H]2CC(F)(F)C2(F)F)cc1Cl ZINC001227644710 1053006159 /nfs/dbraw/zinc/00/61/59/1053006159.db2.gz CFCUDNNBLMOYGR-QMMMGPOBSA-N -1 1 305.054 4.121 20 0 DIADMM CCCC[C@@H](Oc1[n-]c(=O)nc2c1CO[C@H]2C)c1ccccc1 ZINC001227715033 1053009953 /nfs/dbraw/zinc/00/99/53/1053009953.db2.gz XXEKGMMAUUIGTB-SWLSCSKDSA-N -1 1 314.385 4.084 20 0 DIADMM CCCC[C@H](Oc1[n-]c(=O)nc2c1CO[C@H]2C)c1ccccc1 ZINC001227715034 1053009978 /nfs/dbraw/zinc/00/99/78/1053009978.db2.gz XXEKGMMAUUIGTB-WFASDCNBSA-N -1 1 314.385 4.084 20 0 DIADMM CC1CCC(C)(CNC(=O)NCc2ccc([O-])c(Cl)c2)CC1 ZINC001227748526 1053012865 /nfs/dbraw/zinc/01/28/65/1053012865.db2.gz ATFKCTXTWIFYAX-UHFFFAOYSA-N -1 1 324.852 4.061 20 0 DIADMM S=c1nc2cnccc2c(O[C@@H]2CCCc3ccccc32)[n-]1 ZINC001227881927 1053025066 /nfs/dbraw/zinc/02/50/66/1053025066.db2.gz RQMIMUIAFXUOMT-OAHLLOKOSA-N -1 1 309.394 4.144 20 0 DIADMM Cc1cccc2c1CC[C@@H]2Oc1[n-]c(=S)nc2cnccc21 ZINC001227881938 1053025111 /nfs/dbraw/zinc/02/51/11/1053025111.db2.gz RSBUMOJOGGUBIU-HNNXBMFYSA-N -1 1 309.394 4.062 20 0 DIADMM C[C@H](Oc1[n-]c(=S)nc2cnccc21)c1ccc(Cl)cc1 ZINC001227880330 1053025244 /nfs/dbraw/zinc/02/52/44/1053025244.db2.gz AEZMDGZPBVPFDC-VIFPVBQESA-N -1 1 317.801 4.481 20 0 DIADMM C[C@@H](Oc1[n-]c(=S)nc2cnccc21)c1cccc(F)c1F ZINC001227883470 1053025330 /nfs/dbraw/zinc/02/53/30/1053025330.db2.gz AEAREXUPPLZTQL-MRVPVSSYSA-N -1 1 319.336 4.106 20 0 DIADMM Cc1ccc([C@H](C)Oc2[n-]c(=S)nc3cnccc32)c(C)c1 ZINC001227885634 1053025848 /nfs/dbraw/zinc/02/58/48/1053025848.db2.gz NIUFVJCNPDBXJG-LBPRGKRZSA-N -1 1 311.410 4.444 20 0 DIADMM O=C(Nc1ccc([O-])c(F)c1F)[C@H]1CC[C@H](C2CCC2)CC1 ZINC000616101966 1053045562 /nfs/dbraw/zinc/04/55/62/1053045562.db2.gz VACMCUILYNXTJV-HAQNSBGRSA-N -1 1 309.356 4.215 20 0 DIADMM CN(Cc1nc2c(s1)CCCC2)Cc1cccc(Cl)c1[O-] ZINC000180195949 1053048403 /nfs/dbraw/zinc/04/84/03/1053048403.db2.gz STVFCZDAMCUXKC-UHFFFAOYSA-N -1 1 322.861 4.013 20 0 DIADMM CC(C)C[C@@H]1CCCCN1C(=O)NCc1ccc([O-])c(Cl)c1 ZINC001313237466 1053096741 /nfs/dbraw/zinc/09/67/41/1053096741.db2.gz VSTCQJQZYBICSK-AWEZNQCLSA-N -1 1 324.852 4.156 20 0 DIADMM O=C(c1cc2ccccc2cc1[O-])N1CCC(c2ccco2)CC1 ZINC000617379525 1053130180 /nfs/dbraw/zinc/13/01/80/1053130180.db2.gz DTXQCAHRYBOQOV-UHFFFAOYSA-N -1 1 321.376 4.158 20 0 DIADMM CCC(=O)c1c(O)cc([O-])cc1O[C@H](C)c1cccc(Cl)c1 ZINC001228557058 1053134166 /nfs/dbraw/zinc/13/41/66/1053134166.db2.gz SWVYBVWEVZUSES-SNVBAGLBSA-N -1 1 320.772 4.484 20 0 DIADMM CCC(=O)c1c(O)cc([O-])cc1O[C@H](C)c1ccc(F)c(F)c1 ZINC001228556339 1053134305 /nfs/dbraw/zinc/13/43/05/1053134305.db2.gz NQYANBZVIPISJI-SECBINFHSA-N -1 1 322.307 4.109 20 0 DIADMM CCC(=O)c1c(O)cc([O-])cc1O[C@H](C)c1ccc(C)cc1 ZINC001228557547 1053134600 /nfs/dbraw/zinc/13/46/00/1053134600.db2.gz XESIOLZGJHFMFX-GFCCVEGCSA-N -1 1 300.354 4.139 20 0 DIADMM O=C(CSc1ncc(-c2ccccc2)o1)c1ccc([O-])cc1 ZINC001318124244 1053152694 /nfs/dbraw/zinc/15/26/94/1053152694.db2.gz USFFAXLOKRQQCE-UHFFFAOYSA-N -1 1 311.362 4.022 20 0 DIADMM C[C@H](Oc1cc([O-])cc2oc(=O)ccc12)c1cccc(Cl)c1 ZINC001229134680 1053254887 /nfs/dbraw/zinc/25/48/87/1053254887.db2.gz IEDWJJIMERAJNO-JTQLQIEISA-N -1 1 316.740 4.292 20 0 DIADMM COc1cc2ccc(=O)oc2c(O[C@H](C)CCCC(C)C)c1[O-] ZINC001229214219 1053275475 /nfs/dbraw/zinc/27/54/75/1053275475.db2.gz CMAYDUWTSUNNEZ-GFCCVEGCSA-N -1 1 320.385 4.101 20 0 DIADMM CCCC/C=C/[C@H](C)Oc1c([O-])c(OC)cc2ccc(=O)oc21 ZINC001229214180 1053275833 /nfs/dbraw/zinc/27/58/33/1053275833.db2.gz CEHGBSPJOXSWEV-GUOLPTJISA-N -1 1 318.369 4.021 20 0 DIADMM CC[C@@H](C)[C@@H](C)Oc1cc(O)ccc1C(=O)c1ccc([O-])cc1 ZINC001229296251 1053296556 /nfs/dbraw/zinc/29/65/56/1053296556.db2.gz GSWVUHZJDDLUNY-CHWSQXEVSA-N -1 1 314.381 4.142 20 0 DIADMM CC(C)CC[C@@H]1CCCCN1C(=O)c1cc(Cl)ccc1[O-] ZINC001545742309 1053362629 /nfs/dbraw/zinc/36/26/29/1053362629.db2.gz KMZQVEMRJGSZTB-AWEZNQCLSA-N -1 1 309.837 4.477 20 0 DIADMM CCC[C@@](C)(CC)C(=O)Nc1ccc(Br)c([O-])c1 ZINC001321109447 1053391748 /nfs/dbraw/zinc/39/17/48/1053391748.db2.gz IJFBNVBMHLKKOZ-CQSZACIVSA-N -1 1 314.223 4.310 20 0 DIADMM CC[C@H](NC(=O)c1cc(Cl)ccc1[O-])c1ccccc1F ZINC001300244640 1053525728 /nfs/dbraw/zinc/52/57/28/1053525728.db2.gz IOMAFQVTCOCBPV-AWEZNQCLSA-N -1 1 307.752 4.066 20 0 DIADMM CC[C@H](NC(=O)c1c([O-])cccc1Cl)c1ccc(F)cc1 ZINC001323756215 1053600128 /nfs/dbraw/zinc/60/01/28/1053600128.db2.gz HOZCHXCSALONPA-ZDUSSCGKSA-N -1 1 307.752 4.066 20 0 DIADMM O=C(c1c([O-])cccc1Cl)N1CC[C@H](C2CCCCC2)C1 ZINC001300414776 1053674869 /nfs/dbraw/zinc/67/48/69/1053674869.db2.gz UDCBDRZVXXOKNT-ZDUSSCGKSA-N -1 1 307.821 4.088 20 0 DIADMM COc1cnc(C=Cc2ccc(-c3ccccc3)s2)[n-]c1=O ZINC001325089108 1053697395 /nfs/dbraw/zinc/69/73/95/1053697395.db2.gz KWKNIOOOXKNENW-NTMALXAHSA-N -1 1 310.378 4.090 20 0 DIADMM CC[C@H](C[C@@H](C)CC)Oc1cccnc1-c1ncccc1[O-] ZINC001231200420 1053698639 /nfs/dbraw/zinc/69/86/39/1053698639.db2.gz NGKSZKDQSONRIY-UONOGXRCSA-N -1 1 300.402 4.443 20 0 DIADMM CCC[C@@H](Oc1cccnc1-c1ncccc1[O-])C(C)(C)C ZINC001231200619 1053699463 /nfs/dbraw/zinc/69/94/63/1053699463.db2.gz QENDRRYHFPCXJM-OAHLLOKOSA-N -1 1 300.402 4.443 20 0 DIADMM Cc1ccc2c(c1)CN(C(=O)c1ccc3ccccc3c1[O-])CC2 ZINC001300445119 1053701268 /nfs/dbraw/zinc/70/12/68/1053701268.db2.gz VFJMUBFIFASEHV-UHFFFAOYSA-N -1 1 317.388 4.052 20 0 DIADMM CCC[C@@H](C)[C@@H](CC)Oc1cccnc1-c1ncccc1[O-] ZINC001231201677 1053701653 /nfs/dbraw/zinc/70/16/53/1053701653.db2.gz BSIZFLCYLCJEIT-UKRRQHHQSA-N -1 1 300.402 4.443 20 0 DIADMM Cc1ccc2c(c1)CC[C@@H]2Oc1cccnc1-c1ncccc1[O-] ZINC001231201725 1053702229 /nfs/dbraw/zinc/70/22/29/1053702229.db2.gz NBDPNMLNTKXKIW-KRWDZBQOSA-N -1 1 318.376 4.224 20 0 DIADMM COC1=CC[C@@H](Oc2ccccc2C(=O)c2ccc([O-])cc2)CC1 ZINC001231230026 1053707824 /nfs/dbraw/zinc/70/78/24/1053707824.db2.gz JQUSRWULMLOLTB-QGZVFWFLSA-N -1 1 324.376 4.085 20 0 DIADMM O=C(c1ccc([O-])cc1)c1ccccc1O[C@@H]1CCC(F)(F)C1 ZINC001231230885 1053708500 /nfs/dbraw/zinc/70/85/00/1053708500.db2.gz QIXIYBVPWPTRAU-CQSZACIVSA-N -1 1 318.319 4.190 20 0 DIADMM O=C([O-])c1ccc(CN2CCC[C@H]2c2ccccc2Cl)s1 ZINC001231463949 1053759140 /nfs/dbraw/zinc/75/91/40/1053759140.db2.gz WZRBIKKAHXKYNI-AWEZNQCLSA-N -1 1 321.829 4.437 20 0 DIADMM CC(C)CCc1ccccc1[N-]S(=O)(=O)c1ccccc1 ZINC000621548480 1053984520 /nfs/dbraw/zinc/98/45/20/1053984520.db2.gz CWCLGYVDVORUBG-UHFFFAOYSA-N -1 1 303.427 4.076 20 0 DIADMM O=C([N-]c1cscc1Cl)c1oc(C2CC2)nc1C(F)F ZINC001355018714 1054033337 /nfs/dbraw/zinc/03/33/37/1054033337.db2.gz HXEUGYRSSKZHHB-UHFFFAOYSA-N -1 1 318.732 4.457 20 0 DIADMM [O-]c1c(F)cc(NC(=S)Nc2ccccc2Cl)cc1F ZINC001200858251 1054046428 /nfs/dbraw/zinc/04/64/28/1054046428.db2.gz NLKHQATVXJURPZ-UHFFFAOYSA-N -1 1 314.744 4.133 20 0 DIADMM CC(C)c1ccc(C(=O)Nc2ccccc2OC(F)F)c([O-])c1 ZINC000622289901 1054149778 /nfs/dbraw/zinc/14/97/78/1054149778.db2.gz JNBAVQATOAKLCJ-UHFFFAOYSA-N -1 1 321.323 4.369 20 0 DIADMM COc1cccc([C@@H]2CCCN2Cc2ccc(F)c([O-])c2F)c1 ZINC001232937971 1054152437 /nfs/dbraw/zinc/15/24/37/1054152437.db2.gz XLJPGRFAKWZJIV-INIZCTEOSA-N -1 1 319.351 4.016 20 0 DIADMM COc1ccc([C@@H]2CCCN2Cc2cc([O-])c(F)c(F)c2)cc1 ZINC001232970496 1054162793 /nfs/dbraw/zinc/16/27/93/1054162793.db2.gz DOJYVJWSDHKFHW-INIZCTEOSA-N -1 1 319.351 4.016 20 0 DIADMM COc1ccc([C@H]2CCCN2Cc2cc([O-])c(F)c(F)c2)cc1 ZINC001232970497 1054163173 /nfs/dbraw/zinc/16/31/73/1054163173.db2.gz DOJYVJWSDHKFHW-MRXNPFEDSA-N -1 1 319.351 4.016 20 0 DIADMM CC(C)(C)[C@@H](NC(=O)c1c([O-])cccc1F)c1ccccc1 ZINC000622315605 1054169704 /nfs/dbraw/zinc/16/97/04/1054169704.db2.gz KAYAYOVRDLYXGE-INIZCTEOSA-N -1 1 301.361 4.049 20 0 DIADMM Cc1cccc([C@@H]2CCC[N@H+]2Cc2cc(Cl)ncc2O)c1 ZINC001233032409 1054174398 /nfs/dbraw/zinc/17/43/98/1054174398.db2.gz JUTJMPMUSGMDBY-HNNXBMFYSA-N -1 1 302.805 4.086 20 0 DIADMM Oc1cnc(Cl)cc1C[N@H+]1CC[C@@H](c2cccc(Cl)c2)C1 ZINC001233038865 1054174540 /nfs/dbraw/zinc/17/45/40/1054174540.db2.gz HZSNVZAUACDCBD-GFCCVEGCSA-N -1 1 323.223 4.084 20 0 DIADMM CC[N@@H+](Cc1ccc(C)c(C)c1)Cc1cc(Cl)ncc1[O-] ZINC001233037234 1054175485 /nfs/dbraw/zinc/17/54/85/1054175485.db2.gz ADASAYMRSHTYAL-UHFFFAOYSA-N -1 1 304.821 4.080 20 0 DIADMM COc1ccc(Cl)c(NC(=O)c2ccc(C(C)C)cc2[O-])c1 ZINC000622330139 1054176004 /nfs/dbraw/zinc/17/60/04/1054176004.db2.gz LZPDOFCOMFTFTI-UHFFFAOYSA-N -1 1 319.788 4.430 20 0 DIADMM CC[C@@H](NC(=O)c1c([O-])cccc1F)c1ccc(Cl)s1 ZINC000622372547 1054189123 /nfs/dbraw/zinc/18/91/23/1054189123.db2.gz PTDBGEGKDIYPSE-SECBINFHSA-N -1 1 313.781 4.127 20 0 DIADMM CN(c1ccccc1NC(=O)c1ccccc1[O-])C1CCCC1 ZINC000622441464 1054215728 /nfs/dbraw/zinc/21/57/28/1054215728.db2.gz BWGHTWJHWSQZDG-UHFFFAOYSA-N -1 1 310.397 4.023 20 0 DIADMM Cc1c(NC(=O)c2cc(F)ccc2[O-])cccc1C(F)(F)F ZINC000622436818 1054227349 /nfs/dbraw/zinc/22/73/49/1054227349.db2.gz KTKKPJVNAJMDMI-UHFFFAOYSA-N -1 1 313.250 4.111 20 0 DIADMM Oc1ccc(F)c(CN2CCC[C@@H](c3ccccc3)C2)c1F ZINC001233395695 1054259338 /nfs/dbraw/zinc/25/93/38/1054259338.db2.gz JWLSIKCZZUWSMY-CQSZACIVSA-N -1 1 303.352 4.050 20 0 DIADMM CCC(C)(C)c1ccccc1C(=O)Nc1nc(-c2ccco2)n[nH]1 ZINC001439506750 1054276590 /nfs/dbraw/zinc/27/65/90/1054276590.db2.gz DPLMFVWEDMHLBA-UHFFFAOYSA-N -1 1 324.384 4.005 20 0 DIADMM CCc1ccc(C(=O)N2C[C@@H](C(C)C)c3ccccc32)c([O-])c1 ZINC000622562674 1054282462 /nfs/dbraw/zinc/28/24/62/1054282462.db2.gz MVZZTIBFQOXJNO-KRWDZBQOSA-N -1 1 309.409 4.355 20 0 DIADMM CCCC(=O)c1ccc([O-])cc1O[C@H](C)c1ncccc1F ZINC001233649864 1054319477 /nfs/dbraw/zinc/31/94/77/1054319477.db2.gz DRLDRULEAPFYSO-LLVKDONJSA-N -1 1 303.333 4.049 20 0 DIADMM CCCC(=O)c1ccc([O-])cc1OC1CC(C)(C)OC(C)(C)C1 ZINC001233649896 1054319794 /nfs/dbraw/zinc/31/97/94/1054319794.db2.gz FPSBFINUJWCHDV-UHFFFAOYSA-N -1 1 320.429 4.490 20 0 DIADMM CCCC(=O)c1ccc([O-])cc1O[C@H]1CCOc2ccccc21 ZINC001233650539 1054322243 /nfs/dbraw/zinc/32/22/43/1054322243.db2.gz MMERHBZRBYXBSN-SFHVURJKSA-N -1 1 312.365 4.278 20 0 DIADMM CCc1ccc([C@H](NC(=O)c2ccc([O-])cc2F)C(C)C)cc1 ZINC001440834472 1054371793 /nfs/dbraw/zinc/37/17/93/1054371793.db2.gz SGGJIHQILACVTN-GOSISDBHSA-N -1 1 315.388 4.221 20 0 DIADMM C[C@@H](Oc1ccc(CC(=O)c2ccc([O-])cc2)cc1)C1CCC1 ZINC001233940104 1054395697 /nfs/dbraw/zinc/39/56/97/1054395697.db2.gz AQNXQQBHJONVFF-CQSZACIVSA-N -1 1 310.393 4.385 20 0 DIADMM CC(C)(C)[C@@H](NC(=O)c1cc(F)ccc1[O-])c1ccccc1 ZINC001441734539 1054396940 /nfs/dbraw/zinc/39/69/40/1054396940.db2.gz JUXMXOKVUROOIG-INIZCTEOSA-N -1 1 301.361 4.049 20 0 DIADMM O=C(c1cc(Cl)ccc1[O-])N1CCC[C@H]1c1cccc(F)c1 ZINC001441889489 1054401729 /nfs/dbraw/zinc/40/17/29/1054401729.db2.gz YEVYAYJTJXAFKW-HNNXBMFYSA-N -1 1 319.763 4.162 20 0 DIADMM CC[C@@H](C)n1nc(NC(=O)Nc2ccc([O-])c(Cl)c2)cc1C ZINC000487215308 1054411347 /nfs/dbraw/zinc/41/13/47/1054411347.db2.gz AVHRZQBQCMQTBV-SECBINFHSA-N -1 1 322.796 4.166 20 0 DIADMM Cc1ccc2c(c1)CC[C@@H]2NC(=O)c1ccc2ccccc2c1[O-] ZINC001442180521 1054412118 /nfs/dbraw/zinc/41/21/18/1054412118.db2.gz JNBTUQHBJSFEFN-IBGZPJMESA-N -1 1 317.388 4.271 20 0 DIADMM CC[C@H](C)n1nc(NC(=O)Nc2ccc([O-])c(Cl)c2)cc1C ZINC000487215309 1054412144 /nfs/dbraw/zinc/41/21/44/1054412144.db2.gz AVHRZQBQCMQTBV-VIFPVBQESA-N -1 1 322.796 4.166 20 0 DIADMM Cc1ccc(CCNC(=O)c2ccc3ccccc3c2[O-])c(C)c1 ZINC001442357378 1054419038 /nfs/dbraw/zinc/41/90/38/1054419038.db2.gz TWQIBIUKZFHSJZ-UHFFFAOYSA-N -1 1 319.404 4.135 20 0 DIADMM Cc1cccc(CN(CC(C)C)C(=O)c2cccc([O-])c2F)c1 ZINC001442374890 1054419435 /nfs/dbraw/zinc/41/94/35/1054419435.db2.gz LTSGPYAPJQIHGK-UHFFFAOYSA-N -1 1 315.388 4.138 20 0 DIADMM CC(C)[C@H](NC(=O)c1ccc([O-])c(F)c1)c1ccccc1Cl ZINC001444019392 1054466446 /nfs/dbraw/zinc/46/64/46/1054466446.db2.gz NUAMGRVLJLGKKX-INIZCTEOSA-N -1 1 321.779 4.312 20 0 DIADMM CSc1ccc([O-])c(C(=O)Nc2ncc(C(C)(C)C)s2)c1 ZINC001444865858 1054491047 /nfs/dbraw/zinc/49/10/47/1054491047.db2.gz DSRPNTBVDOXODF-UHFFFAOYSA-N -1 1 322.455 4.120 20 0 DIADMM C[C@@]1(c2ccccc2)C[C@H]1NC(=O)c1ccc2ccccc2c1[O-] ZINC001444954514 1054493212 /nfs/dbraw/zinc/49/32/12/1054493212.db2.gz KYOGJWJMWGQIAC-NQIIRXRSSA-N -1 1 317.388 4.005 20 0 DIADMM CCc1ccc(C(=O)N2CC3(CCCC3)c3ccccc32)c([O-])c1 ZINC001445360973 1054505514 /nfs/dbraw/zinc/50/55/14/1054505514.db2.gz QFGYLCNSPCIYFN-UHFFFAOYSA-N -1 1 321.420 4.427 20 0 DIADMM CC[C@H](Cc1ccccc1)N(CC)C(=O)c1ccc(F)c([O-])c1 ZINC001445846669 1054516650 /nfs/dbraw/zinc/51/66/50/1054516650.db2.gz BLBVNKQNXZBFTN-MRXNPFEDSA-N -1 1 315.388 4.015 20 0 DIADMM C[C@H](c1ccccc1)N(C(=O)c1cc(Cl)ccc1[O-])C1CC1 ZINC001346105453 1054529444 /nfs/dbraw/zinc/52/94/44/1054529444.db2.gz GQQKUKVGECGHQA-GFCCVEGCSA-N -1 1 315.800 4.411 20 0 DIADMM O=C(Cc1ccc([O-])c(Cl)c1)Nc1cccc2ccsc21 ZINC001446585348 1054540489 /nfs/dbraw/zinc/54/04/89/1054540489.db2.gz LIIVDCKHCKSHCN-UHFFFAOYSA-N -1 1 317.797 4.442 20 0 DIADMM O=C(NC1CCC2(CCCCC2)CC1)c1ccc(F)c([O-])c1 ZINC001447747197 1054572856 /nfs/dbraw/zinc/57/28/56/1054572856.db2.gz NAJCIIJHLPQWIH-UHFFFAOYSA-N -1 1 305.393 4.154 20 0 DIADMM CSc1ccc([O-])c(C(=O)Nc2cccc(C(C)(F)F)c2)c1 ZINC001447810924 1054578553 /nfs/dbraw/zinc/57/85/53/1054578553.db2.gz RAFZPJRUUCOYHO-UHFFFAOYSA-N -1 1 323.364 4.478 20 0 DIADMM CCOc1cc(NC(=O)c2ccc(C(C)C)cc2[O-])ccc1C ZINC001449396816 1054620421 /nfs/dbraw/zinc/62/04/21/1054620421.db2.gz KNUNNEYTDTWUFN-UHFFFAOYSA-N -1 1 313.397 4.475 20 0 DIADMM C/C(=C/c1cccc(Cl)c1)C(=O)Nc1ccc([O-])c(F)c1F ZINC001449451977 1054623168 /nfs/dbraw/zinc/62/31/68/1054623168.db2.gz XPMVCTUTFADJKK-CLFYSBASSA-N -1 1 323.726 4.366 20 0 DIADMM CC(C)C[C@@H](C(=O)[N-]OCCC1CC1)c1ccc(Cl)cc1 ZINC001450208277 1054639453 /nfs/dbraw/zinc/63/94/53/1054639453.db2.gz GCOGBBWMMLTPJH-MRXNPFEDSA-N -1 1 309.837 4.318 20 0 DIADMM CSc1cc(NC(=O)c2cc(F)ccc2[O-])ccc1Cl ZINC001451487056 1054681260 /nfs/dbraw/zinc/68/12/60/1054681260.db2.gz OSNUYMRTMWKHFS-UHFFFAOYSA-N -1 1 311.765 4.159 20 0 DIADMM CC/C(=C/C(=O)Nc1cc(F)cc(F)c1[O-])c1ccc(C)cc1 ZINC001451740212 1054685585 /nfs/dbraw/zinc/68/55/85/1054685585.db2.gz GRECGLFJZBSMEW-WQLSENKSSA-N -1 1 317.335 4.411 20 0 DIADMM C[C@@H](NC(=O)c1ccc(C(F)(F)F)cc1[O-])C1CCCCC1 ZINC001452005908 1054693457 /nfs/dbraw/zinc/69/34/57/1054693457.db2.gz XKANCUZXAXZFMG-SNVBAGLBSA-N -1 1 315.335 4.110 20 0 DIADMM CCc1ccc(C(=O)Nc2ccc(C(=O)C(C)C)cc2)c([O-])c1 ZINC001452608505 1054709237 /nfs/dbraw/zinc/70/92/37/1054709237.db2.gz XQLINILEPMZOCM-UHFFFAOYSA-N -1 1 311.381 4.046 20 0 DIADMM Cc1ccc(CC(=O)Nc2cc(Cl)c([O-])c3ccccc23)o1 ZINC001453773072 1054747218 /nfs/dbraw/zinc/74/72/18/1054747218.db2.gz SQBPWVKKLNWGRN-UHFFFAOYSA-N -1 1 315.756 4.281 20 0 DIADMM CC(C)[C@@H]1C[C@@H]1C(=O)Nc1cc(Cl)c([O-])c2ccccc12 ZINC001453774225 1054748091 /nfs/dbraw/zinc/74/80/91/1054748091.db2.gz ZEYRTCPYXKKZRG-STQMWFEESA-N -1 1 303.789 4.429 20 0 DIADMM Cc1nc2cc(-c3ccc(C(=O)[O-])c(C)c3Cl)ccc2[nH]1 ZINC001236121707 1054958400 /nfs/dbraw/zinc/95/84/00/1054958400.db2.gz ZFLDVMVYKUEZPY-UHFFFAOYSA-N -1 1 300.745 4.198 20 0 DIADMM Cc1ccc(F)c(-c2ncnc3sc4c(c32)CCC4)c1[O-] ZINC001236393823 1055091092 /nfs/dbraw/zinc/09/10/92/1055091092.db2.gz YHCGGLPGKBREKF-UHFFFAOYSA-N -1 1 300.358 4.000 20 0 DIADMM CN(C(=O)c1cc2ccccc2cc1[O-])c1ccc(F)c(F)c1 ZINC000194236658 1055118729 /nfs/dbraw/zinc/11/87/29/1055118729.db2.gz FEPLFULIMWIWEA-UHFFFAOYSA-N -1 1 313.303 4.100 20 0 DIADMM Cc1ccccc1C1(C(=O)Nc2cccc(F)c2[O-])CCCC1 ZINC001587390033 1055285292 /nfs/dbraw/zinc/28/52/92/1055285292.db2.gz YMEGRMIAODOZBU-UHFFFAOYSA-N -1 1 313.372 4.290 20 0 DIADMM CC(C)(C)c1ccc(CNC(=O)c2cc3ccccc3cc2[O-])o1 ZINC001587428812 1055294155 /nfs/dbraw/zinc/29/41/55/1055294155.db2.gz DYZHQUURTTZTMN-UHFFFAOYSA-N -1 1 323.392 4.366 20 0 DIADMM COc1ccc(C(=O)Nc2ccc(SC)c(Cl)c2)c([O-])c1 ZINC001587422006 1055294773 /nfs/dbraw/zinc/29/47/73/1055294773.db2.gz XANFLXHNGWMKHM-UHFFFAOYSA-N -1 1 323.801 4.028 20 0 DIADMM CC(C)c1ccc([C@H](NC(=O)c2ncccc2[O-])C(C)C)cc1 ZINC001587811195 1055370158 /nfs/dbraw/zinc/37/01/58/1055370158.db2.gz VTVJFXQNDYISGZ-QGZVFWFLSA-N -1 1 312.413 4.038 20 0 DIADMM CC(C)CCC[C@H](C)NC(=O)c1ccc(C(F)(F)F)c([O-])c1 ZINC001588041870 1055419381 /nfs/dbraw/zinc/41/93/81/1055419381.db2.gz MTNNDXJVAASFIU-NSHDSACASA-N -1 1 317.351 4.356 20 0 DIADMM CC(C)CCC[C@@H](C)NC(=O)c1ccc(C(F)(F)F)c([O-])c1 ZINC001588041869 1055419620 /nfs/dbraw/zinc/41/96/20/1055419620.db2.gz MTNNDXJVAASFIU-LLVKDONJSA-N -1 1 317.351 4.356 20 0 DIADMM CC(C)CCN(C(=O)c1ccc(C(F)(F)F)c([O-])c1)C1CC1 ZINC001588231742 1055455845 /nfs/dbraw/zinc/45/58/45/1055455845.db2.gz AXXFCYNCBSRTCK-UHFFFAOYSA-N -1 1 315.335 4.062 20 0 DIADMM C[C@@H]1CN(Cc2cc(Cl)nc(Cl)c2[O-])Cc2ccccc21 ZINC001237521089 1055466184 /nfs/dbraw/zinc/46/61/84/1055466184.db2.gz BFTTZQJNURUKKU-SNVBAGLBSA-N -1 1 323.223 4.213 20 0 DIADMM O=C([O-])c1cc(F)ccc1CN1CCC[C@@H]1c1ccc(F)cc1 ZINC001238234980 1055627381 /nfs/dbraw/zinc/62/73/81/1055627381.db2.gz ZWGPRESAOLJXAP-QGZVFWFLSA-N -1 1 317.335 4.000 20 0 DIADMM O=C(N[C@@H]1CCc2ccc(F)cc21)c1ccc2ccccc2c1[O-] ZINC001565681172 1055718192 /nfs/dbraw/zinc/71/81/92/1055718192.db2.gz MWLNHIQPNIURTF-GOSISDBHSA-N -1 1 321.351 4.102 20 0 DIADMM CC[C@H](C)[C@@H]1CCCCN1C(=O)Cc1ccc([O-])c(Cl)c1 ZINC001565889572 1055734754 /nfs/dbraw/zinc/73/47/54/1055734754.db2.gz NZGYSFOFHSBKOI-WFASDCNBSA-N -1 1 309.837 4.015 20 0 DIADMM Cc1ccc([C@H]2[C@@H](C)CCCN2C(=O)c2ncc(C)cc2[O-])cc1 ZINC001565973443 1055738076 /nfs/dbraw/zinc/73/80/76/1055738076.db2.gz USQYFJLPRNPTBV-HNAYVOBHSA-N -1 1 324.424 4.017 20 0 DIADMM Cc1ccc([C@@H]2[C@H](C)CCCN2C(=O)c2ncc(C)cc2[O-])cc1 ZINC001565973440 1055738269 /nfs/dbraw/zinc/73/82/69/1055738269.db2.gz USQYFJLPRNPTBV-BEFAXECRSA-N -1 1 324.424 4.017 20 0 DIADMM CCC(CC)(CNC(=O)c1ccc(F)c([O-])c1)c1ccccc1 ZINC001566151789 1055743663 /nfs/dbraw/zinc/74/36/63/1055743663.db2.gz APIVGWZRKOYHMJ-UHFFFAOYSA-N -1 1 315.388 4.019 20 0 DIADMM CCCC[C@@H](CCC)NC(=O)c1ccc2ccc(O)cc2c1[O-] ZINC001566213613 1055750817 /nfs/dbraw/zinc/75/08/17/1055750817.db2.gz DOKKDOVSGAYLDC-CQSZACIVSA-N -1 1 315.413 4.340 20 0 DIADMM O=C(NCc1ccc(C2CCC2)cc1)c1cc(Cl)ccc1[O-] ZINC001567594520 1055808556 /nfs/dbraw/zinc/80/85/56/1055808556.db2.gz VYASGGLFESKXCK-UHFFFAOYSA-N -1 1 315.800 4.243 20 0 DIADMM O=C(Cc1ccc([O-])c(Cl)c1)N1CCCCc2sccc21 ZINC001568254636 1055832317 /nfs/dbraw/zinc/83/23/17/1055832317.db2.gz CKLOGPXIFWOSLK-UHFFFAOYSA-N -1 1 321.829 4.019 20 0 DIADMM C[C@@H]1C[C@@H](c2ccccc2)N(C(=O)c2ccc(Cl)cc2[O-])C1 ZINC001568779849 1055846460 /nfs/dbraw/zinc/84/64/60/1055846460.db2.gz FLYDYVSQSNUTHV-WBMJQRKESA-N -1 1 315.800 4.269 20 0 DIADMM CC[C@@H](C)n1nc(NC(=O)c2ccc(C(C)C)cc2[O-])cc1C ZINC001597627608 1055855709 /nfs/dbraw/zinc/85/57/09/1055855709.db2.gz RTUKDWLEPBALHZ-GFCCVEGCSA-N -1 1 315.417 4.244 20 0 DIADMM Cc1ccc(F)c2oc(C(=O)Nc3cc(F)cc(F)c3[O-])cc21 ZINC001570465473 1055903895 /nfs/dbraw/zinc/90/38/95/1055903895.db2.gz AQWWBWLLYWIDRI-UHFFFAOYSA-N -1 1 321.254 4.116 20 0 DIADMM C/C(=C\c1ccccc1Cl)C(=O)Nc1cc(F)cc(F)c1[O-] ZINC001570465489 1055904059 /nfs/dbraw/zinc/90/40/59/1055904059.db2.gz BFWCWAZEXWLOFW-RMKNXTFCSA-N -1 1 323.726 4.366 20 0 DIADMM Cc1ccc(NC(=O)c2ccc3ccc(O)cc3c2[O-])c(C)c1 ZINC001540434887 1056031161 /nfs/dbraw/zinc/03/11/61/1056031161.db2.gz WSAPZUKCAGAFJO-UHFFFAOYSA-N -1 1 307.349 4.120 20 0 DIADMM CCC[C@@](C)(NC(=O)c1cc(Cl)ccc1[O-])c1ccccc1 ZINC001607228939 1056045220 /nfs/dbraw/zinc/04/52/20/1056045220.db2.gz ARCPZIMNTZSWJU-GOSISDBHSA-N -1 1 317.816 4.491 20 0 DIADMM O=C(N[C@@H]1CCc2c1cccc2Cl)c1cc(Cl)ccc1[O-] ZINC001583258916 1056049175 /nfs/dbraw/zinc/04/91/75/1056049175.db2.gz MLHDZZMYYWNUPT-CQSZACIVSA-N -1 1 322.191 4.116 20 0 DIADMM C[C@H]1CCC[C@H](N(C)C(=O)c2ccc(C(F)(F)F)c([O-])c2)C1 ZINC001540605310 1056049688 /nfs/dbraw/zinc/04/96/88/1056049688.db2.gz YGAORONYYVIUGL-JQWIXIFHSA-N -1 1 315.335 4.062 20 0 DIADMM CCCN(Cc1ccc(C)cc1)C(=O)c1ccc(Cl)cc1[O-] ZINC001540621812 1056051204 /nfs/dbraw/zinc/05/12/04/1056051204.db2.gz QULYKDMVJZPFGO-UHFFFAOYSA-N -1 1 317.816 4.406 20 0 DIADMM CCc1ccc([C@@H](NC(=O)c2ccc([O-])c(F)c2)C(C)C)cc1 ZINC001540633699 1056052826 /nfs/dbraw/zinc/05/28/26/1056052826.db2.gz PSAZPLTXAYRMID-SFHVURJKSA-N -1 1 315.388 4.221 20 0 DIADMM Cc1ccc(C)c([N-]S(=O)(=O)c2ccc(Cl)c(C)c2)c1 ZINC000005652499 1056054560 /nfs/dbraw/zinc/05/45/60/1056054560.db2.gz GSWUWBXKDCVAEV-UHFFFAOYSA-N -1 1 309.818 4.066 20 0 DIADMM COc1ccccc1[C@H](C)CC(=O)Nc1ccc([O-])c(Cl)c1 ZINC000111666373 1056058079 /nfs/dbraw/zinc/05/80/79/1056058079.db2.gz YCJRKDINWURISF-LLVKDONJSA-N -1 1 319.788 4.187 20 0 DIADMM O=S(=O)([N-]c1cccc(Cc2ccccc2)c1)c1ccccc1 ZINC000005985639 1056059016 /nfs/dbraw/zinc/05/90/16/1056059016.db2.gz JXLIXIXNNQJMFG-UHFFFAOYSA-N -1 1 323.417 4.078 20 0 DIADMM O=C([O-])CCC1CCN(Cc2cccc(Cl)c2Cl)CC1 ZINC000086755818 1056070514 /nfs/dbraw/zinc/07/05/14/1056070514.db2.gz XVTHMHKOIJQRFD-UHFFFAOYSA-N -1 1 316.228 4.070 20 0 DIADMM CCN(Cc1ccccc1Cl)C(=O)c1cc(Cl)ccc1[O-] ZINC001540800283 1056078812 /nfs/dbraw/zinc/07/88/12/1056078812.db2.gz LWMMGHLIUHCOPW-UHFFFAOYSA-N -1 1 324.207 4.361 20 0 DIADMM CC[C@@H](NC(=O)c1ccc(F)c([O-])c1)c1cccc(Cl)c1 ZINC001540797454 1056079335 /nfs/dbraw/zinc/07/93/35/1056079335.db2.gz YXECNUBNXIDQIF-CQSZACIVSA-N -1 1 307.752 4.066 20 0 DIADMM CC[C@@H](NC(=O)c1ccc(Cl)cc1[O-])c1ccc(C)cc1 ZINC001610934677 1056080820 /nfs/dbraw/zinc/08/08/20/1056080820.db2.gz MNXCOHALDPJQFO-OAHLLOKOSA-N -1 1 303.789 4.235 20 0 DIADMM O=C(/C=C\c1ccc2[nH]ccc2c1)Nc1ccc([O-])c(Cl)c1 ZINC000765799410 1056093093 /nfs/dbraw/zinc/09/30/93/1056093093.db2.gz XLMBITXAXWMVBW-KXFIGUGUSA-N -1 1 312.756 4.179 20 0 DIADMM C/C(=C\C(=O)Nc1ccc(F)cc1[O-])c1ccccc1Cl ZINC001611075190 1056105441 /nfs/dbraw/zinc/10/54/41/1056105441.db2.gz XMNCKQVXXKNOCZ-CSKARUKUSA-N -1 1 305.736 4.227 20 0 DIADMM CCCCOc1ccc(NC(=O)c2cc(F)ccc2[O-])c(C)c1 ZINC001542232104 1056112209 /nfs/dbraw/zinc/11/22/09/1056112209.db2.gz LVJPOWIPGHPGMT-UHFFFAOYSA-N -1 1 317.360 4.271 20 0 DIADMM O=C(Nc1nc(Cl)ccc1[O-])c1ccc(Cl)c2occc21 ZINC001611166632 1056119964 /nfs/dbraw/zinc/11/99/64/1056119964.db2.gz KKZBPCAAFDFQAH-UHFFFAOYSA-N -1 1 323.135 4.093 20 0 DIADMM C[C@H](NC(=O)Cc1ccc([O-])c(Cl)c1)C1CCCCCC1 ZINC001611315814 1056141560 /nfs/dbraw/zinc/14/15/60/1056141560.db2.gz HRHOCNWDAJXVOL-LBPRGKRZSA-N -1 1 309.837 4.063 20 0 DIADMM O=C(Nc1ccc([O-])c(Cl)c1)c1c(F)cccc1Cl ZINC000085204550 1056145902 /nfs/dbraw/zinc/14/59/02/1056145902.db2.gz YKQUPDUVAKXESG-UHFFFAOYSA-N -1 1 300.116 4.090 20 0 DIADMM CCC[C@@H]1CCCC[C@H]1NC(=O)Cc1ccc([O-])c(Cl)c1 ZINC001542873053 1056160237 /nfs/dbraw/zinc/16/02/37/1056160237.db2.gz YGFUOMVMJWEOCS-UKRRQHHQSA-N -1 1 309.837 4.063 20 0 DIADMM CCC[C@@H]1CCCC[C@@H]1NC(=O)Cc1ccc([O-])c(Cl)c1 ZINC001542873052 1056160480 /nfs/dbraw/zinc/16/04/80/1056160480.db2.gz YGFUOMVMJWEOCS-HIFRSBDPSA-N -1 1 309.837 4.063 20 0 DIADMM O=C(N[C@@H](c1ccccc1)C1CCC1)c1ccc(Cl)cc1[O-] ZINC001543082848 1056173654 /nfs/dbraw/zinc/17/36/54/1056173654.db2.gz VUIWVQDFEWCNNM-KRWDZBQOSA-N -1 1 315.800 4.317 20 0 DIADMM CC(C)c1ccc(C(=O)Nc2ccc(-c3cnco3)cc2)c([O-])c1 ZINC001543238241 1056190288 /nfs/dbraw/zinc/19/02/88/1056190288.db2.gz FIZGZTUBNBCMSC-UHFFFAOYSA-N -1 1 322.364 4.423 20 0 DIADMM Cc1oc(-c2ccccc2)cc1C(=O)Nc1c([O-])cccc1F ZINC001583971301 1056224516 /nfs/dbraw/zinc/22/45/16/1056224516.db2.gz BFVLUAGZDYFCSY-UHFFFAOYSA-N -1 1 311.312 4.352 20 0 DIADMM CCN(Cc1ccc(Cl)cc1)C(=O)c1c([O-])cccc1Cl ZINC001543540533 1056248584 /nfs/dbraw/zinc/24/85/84/1056248584.db2.gz BAAPIAPPYQYALT-UHFFFAOYSA-N -1 1 324.207 4.361 20 0 DIADMM Cc1cc(SC(C)(C)C)ccc1NC(=O)c1ccc([O-])cn1 ZINC001584144096 1056271616 /nfs/dbraw/zinc/27/16/16/1056271616.db2.gz LCTSTRAERMALLM-UHFFFAOYSA-N -1 1 316.426 4.239 20 0 DIADMM O=C(Cc1ccc([O-])c(Cl)c1)NCCCC1CCCCC1 ZINC001543828186 1056307136 /nfs/dbraw/zinc/30/71/36/1056307136.db2.gz ASUVPEZUYHGZAO-UHFFFAOYSA-N -1 1 309.837 4.065 20 0 DIADMM O=C(Cc1ccc([O-])c(Cl)c1)N1CCCC2(CCCC2)CC1 ZINC001584358648 1056325998 /nfs/dbraw/zinc/32/59/98/1056325998.db2.gz CGWMBIOQWLQIOY-UHFFFAOYSA-N -1 1 321.848 4.161 20 0 DIADMM Cc1cccc(CN(CC(C)C)C(=O)c2ccc([O-])c(F)c2)c1 ZINC001544127120 1056367010 /nfs/dbraw/zinc/36/70/10/1056367010.db2.gz OERNPIXLKUXYSG-UHFFFAOYSA-N -1 1 315.388 4.138 20 0 DIADMM O=C(NCc1cc2ccccc2o1)c1cc2ccccc2cc1[O-] ZINC001544189113 1056378775 /nfs/dbraw/zinc/37/87/75/1056378775.db2.gz YWMFPZIDKSSRIM-UHFFFAOYSA-N -1 1 317.344 4.222 20 0 DIADMM Cc1nc(SCCCc2ccccc2)[n-]c(=O)c1C1CC1 ZINC001614794501 1056451900 /nfs/dbraw/zinc/45/19/00/1056451900.db2.gz ZGYBOJOLCAJHMS-UHFFFAOYSA-N -1 1 300.427 4.093 20 0 DIADMM O=C(Nc1cc(Cl)c([O-])c2ccccc12)C(F)(F)C(F)F ZINC001585193435 1056503578 /nfs/dbraw/zinc/50/35/78/1056503578.db2.gz ZBSNZENLASZZSG-UHFFFAOYSA-N -1 1 321.657 4.038 20 0 DIADMM CCc1ccc(CC)c(NC(=O)Cc2ccc([O-])c(Cl)c2)c1 ZINC001544825846 1056508651 /nfs/dbraw/zinc/50/86/51/1056508651.db2.gz KFUJYWMEMNIKHX-UHFFFAOYSA-N -1 1 317.816 4.352 20 0 DIADMM CCSc1cccc(F)c1[N-]C(=O)c1cc(C)cnc1F ZINC001544920445 1056528625 /nfs/dbraw/zinc/52/86/25/1056528625.db2.gz NJWGAUFCKPGVFS-UHFFFAOYSA-N -1 1 308.353 4.033 20 0 DIADMM [O-]c1c(F)cc(Nc2nc(C(F)(F)F)cs2)cc1Cl ZINC001214479887 1056542506 /nfs/dbraw/zinc/54/25/06/1056542506.db2.gz IKHPFIWAJLQZQF-UHFFFAOYSA-N -1 1 312.675 4.404 20 0 DIADMM Cc1cc(C)cc([C@@H](C)NC(=O)Cc2ccc([O-])c(Cl)c2)c1 ZINC001585476016 1056560880 /nfs/dbraw/zinc/56/08/80/1056560880.db2.gz WCENTLQTIXPLQF-CYBMUJFWSA-N -1 1 317.816 4.082 20 0 DIADMM Cc1ccc(N(Cc2cccs2)C(=O)c2ccc([O-])cn2)cc1 ZINC001585497217 1056566869 /nfs/dbraw/zinc/56/68/69/1056566869.db2.gz HDXAMEUIEVPRQY-UHFFFAOYSA-N -1 1 324.405 4.004 20 0 DIADMM Cc1ccccc1[C@@H](NC(=O)c1ccc(Cl)cc1[O-])C(C)C ZINC001585741708 1056614281 /nfs/dbraw/zinc/61/42/81/1056614281.db2.gz SBLVLTHFQIGOCJ-KRWDZBQOSA-N -1 1 317.816 4.481 20 0 DIADMM CC(C)c1ccc(CCCNC(=O)c2ccc(F)c([O-])c2)cc1 ZINC001585864657 1056633058 /nfs/dbraw/zinc/63/30/58/1056633058.db2.gz NUXVUTTWAOWIOX-UHFFFAOYSA-N -1 1 315.388 4.017 20 0 DIADMM CC1=CC[C@](C)(C(=O)Nc2ccc(Br)c([O-])c2)CC1 ZINC001616324839 1056635971 /nfs/dbraw/zinc/63/59/71/1056635971.db2.gz NPERAZCPMJTACW-HNNXBMFYSA-N -1 1 324.218 4.230 20 0 DIADMM CC[C@H]1CCCN(C(=O)c2ccc(C(F)(F)F)c([O-])c2)CC1 ZINC001585899203 1056636819 /nfs/dbraw/zinc/63/68/19/1056636819.db2.gz RMGAWTHFAOZPBT-NSHDSACASA-N -1 1 315.335 4.063 20 0 DIADMM Nc1cccc(-c2cc3nc(-c4cc(F)ccc4[O-])ccc3[nH]2)c1 ZINC001240694532 1056645820 /nfs/dbraw/zinc/64/58/20/1056645820.db2.gz WXGGHXPSTPIIHE-UHFFFAOYSA-N -1 1 319.339 4.324 20 0 DIADMM [O-]c1ccc(F)cc1-c1ccnc(CSc2ccccc2)n1 ZINC001240696315 1056647524 /nfs/dbraw/zinc/64/75/24/1056647524.db2.gz MMNNRWTUDRRRCM-UHFFFAOYSA-N -1 1 312.369 4.281 20 0 DIADMM CC(C)(C)[C@H]1CCc2nnc(-c3cc(F)ccc3[O-])cc2C1 ZINC001240696358 1056647931 /nfs/dbraw/zinc/64/79/31/1056647931.db2.gz NOXAHCLSWKDTDI-LBPRGKRZSA-N -1 1 300.377 4.139 20 0 DIADMM O=C(c1cc2ccccc2cc1[O-])N1CC=CC12CCCCC2 ZINC001585950184 1056647965 /nfs/dbraw/zinc/64/79/65/1056647965.db2.gz NCSKZLLAKKNWMG-UHFFFAOYSA-N -1 1 307.393 4.260 20 0 DIADMM CC(C)[C@H]1CCCCN1C(=O)c1ccc(C(F)(F)F)c([O-])c1 ZINC001586091154 1056669388 /nfs/dbraw/zinc/66/93/88/1056669388.db2.gz LBWLOFYSHHVHIB-CYBMUJFWSA-N -1 1 315.335 4.062 20 0 DIADMM CC[C@H](C)[C@@H]([N-]C(=O)C(F)(F)c1ccccc1C)C(F)(F)F ZINC001586211949 1056693483 /nfs/dbraw/zinc/69/34/83/1056693483.db2.gz HQLJVYZJANWZIX-JOYOIKCWSA-N -1 1 323.305 4.180 20 0 DIADMM [O-]c1ccc(-c2nc(-c3cccnc3)nc3sccc32)cc1F ZINC001240786434 1056697519 /nfs/dbraw/zinc/69/75/19/1056697519.db2.gz SMCOLASGXYMBEL-UHFFFAOYSA-N -1 1 323.352 4.265 20 0 DIADMM CC(C)(C)[C@@H]1CCc2nnc(-c3ccc([O-])c(F)c3)cc2C1 ZINC001240786438 1056697896 /nfs/dbraw/zinc/69/78/96/1056697896.db2.gz STFWVTHCQLSDFP-CYBMUJFWSA-N -1 1 300.377 4.139 20 0 DIADMM [O-]c1ccc(-c2nc(-c3ccccn3)nc3sccc32)cc1F ZINC001240786692 1056698516 /nfs/dbraw/zinc/69/85/16/1056698516.db2.gz ZWFQHLSAJYFEPN-UHFFFAOYSA-N -1 1 323.352 4.265 20 0 DIADMM O=C(Nc1cccc(-c2ccccc2)c1)c1ccc([O-])c(F)c1 ZINC000672487494 1056705312 /nfs/dbraw/zinc/70/53/12/1056705312.db2.gz SLSLJHZPJANYDX-UHFFFAOYSA-N -1 1 307.324 4.451 20 0 DIADMM Cc1ccccc1[C@H](C)N(C)C(=O)c1ncc2ccccc2c1[O-] ZINC001586349974 1056719231 /nfs/dbraw/zinc/71/92/31/1056719231.db2.gz LAOFXMQHHWBWGF-AWEZNQCLSA-N -1 1 320.392 4.082 20 0 DIADMM COC(=O)c1nc2cc(-c3ccc4ccccc4c3)ccc2[n-]1 ZINC001240909925 1056754050 /nfs/dbraw/zinc/75/40/50/1056754050.db2.gz UQHKLCJKUQCWJX-UHFFFAOYSA-N -1 1 302.333 4.170 20 0 DIADMM COC(=O)c1nc2ccc(-c3ccc4ccccc4c3)cc2[n-]1 ZINC001240909925 1056754063 /nfs/dbraw/zinc/75/40/63/1056754063.db2.gz UQHKLCJKUQCWJX-UHFFFAOYSA-N -1 1 302.333 4.170 20 0 DIADMM CCC(CC)[C@H](NC(=O)c1ccc([O-])cc1F)c1ccccc1 ZINC001586619861 1056768888 /nfs/dbraw/zinc/76/88/88/1056768888.db2.gz OLZAYEMAZUYIEL-SFHVURJKSA-N -1 1 315.388 4.439 20 0 DIADMM CC(C)[C@H](c1ccccc1)N(C)C(=O)c1ccc(F)c([O-])c1 ZINC001617064937 1056770125 /nfs/dbraw/zinc/77/01/25/1056770125.db2.gz DYBMZROCKKXGIB-QGZVFWFLSA-N -1 1 301.361 4.001 20 0 DIADMM CSc1c(F)cccc1[N-]C(=O)c1c(F)cc(F)cc1F ZINC001617328968 1056815882 /nfs/dbraw/zinc/81/58/82/1056815882.db2.gz DGZNARRWIPSVRR-UHFFFAOYSA-N -1 1 315.291 4.217 20 0 DIADMM Cc1ccc(-c2ncc(F)c(Oc3ccc(F)cc3)n2)c([O-])c1 ZINC001241036364 1056834843 /nfs/dbraw/zinc/83/48/43/1056834843.db2.gz VWWSOMVVJMFERM-UHFFFAOYSA-N -1 1 314.291 4.228 20 0 DIADMM O=C(N[C@H]1C[C@@H]1C1CCCCC1)c1cc2ccccc2cc1[O-] ZINC001587111999 1056860421 /nfs/dbraw/zinc/86/04/21/1056860421.db2.gz HFGJIEIEXTWLBL-AEFFLSMTSA-N -1 1 309.409 4.244 20 0 DIADMM [O-]c1cc(F)c(-c2cc(Oc3cccc(F)c3)ncn2)c(F)c1 ZINC001241118224 1056904119 /nfs/dbraw/zinc/90/41/19/1056904119.db2.gz OONKMWFRXLXEJB-UHFFFAOYSA-N -1 1 318.254 4.059 20 0 DIADMM [O-]c1cc(F)c(-c2ccc(OCc3ccccc3)cn2)c(F)c1 ZINC001241119125 1056904266 /nfs/dbraw/zinc/90/42/66/1056904266.db2.gz YDOUQBSNKQDCDQ-UHFFFAOYSA-N -1 1 313.303 4.311 20 0 DIADMM [O-]c1cc(F)c(-c2nc(-c3ccccc3)nc3[nH]ccc32)c(F)c1 ZINC001241118116 1056904718 /nfs/dbraw/zinc/90/47/18/1056904718.db2.gz IGBIQXXYOSKQRF-UHFFFAOYSA-N -1 1 323.302 4.227 20 0 DIADMM [O-]c1cc(F)c(-c2cc(C(F)(F)F)c3c(n2)CCC3)c(F)c1 ZINC001241118943 1056904794 /nfs/dbraw/zinc/90/47/94/1056904794.db2.gz IZXBJCUYFHIYGA-UHFFFAOYSA-N -1 1 315.241 4.240 20 0 DIADMM [O-]c1cc(F)c(-c2ccc(C3(C(F)(F)F)CC3)cn2)c(F)c1 ZINC001241118905 1056905186 /nfs/dbraw/zinc/90/51/86/1056905186.db2.gz ILKRSQRJGQYYIF-UHFFFAOYSA-N -1 1 315.241 4.326 20 0 DIADMM [O-]c1cc(F)c(-c2ccc(-c3ccc(F)cc3F)nn2)c(F)c1 ZINC001241119457 1056905232 /nfs/dbraw/zinc/90/52/32/1056905232.db2.gz OJUNFRLOOFUVEC-UHFFFAOYSA-N -1 1 320.245 4.073 20 0 DIADMM CC[C@H](C)c1nc2[nH]ccc2c(-c2c(F)cc([O-])cc2F)n1 ZINC001241120142 1056906336 /nfs/dbraw/zinc/90/63/36/1056906336.db2.gz VBXZUGPAXKHGAL-QMMMGPOBSA-N -1 1 303.312 4.074 20 0 DIADMM [O-]c1cc(F)c(-c2ccc(O[C@@H]3CCCCO3)cc2)c(F)c1 ZINC001241123188 1056908823 /nfs/dbraw/zinc/90/88/23/1056908823.db2.gz UMBXZFUDQKTVRC-MRXNPFEDSA-N -1 1 306.308 4.243 20 0 DIADMM O=C(C[C@@H]1CCc2ccccc21)Nc1ccc([O-])c(Cl)c1 ZINC000115729279 1056947261 /nfs/dbraw/zinc/94/72/61/1056947261.db2.gz AVJRJMHZXKPDSA-LBPRGKRZSA-N -1 1 301.773 4.104 20 0 DIADMM O=C(c1ccc([O-])cc1F)N1CCC[C@H]1c1cccc(Cl)c1 ZINC001626073137 1056990971 /nfs/dbraw/zinc/99/09/71/1056990971.db2.gz GCAIWCDMYPWUOW-INIZCTEOSA-N -1 1 319.763 4.162 20 0 DIADMM [O-]c1ccc(F)c(-c2nccc(Oc3cccc(F)c3)n2)c1F ZINC001241289310 1056998933 /nfs/dbraw/zinc/99/89/33/1056998933.db2.gz PCQDKPDCMBQSDY-UHFFFAOYSA-N -1 1 318.254 4.059 20 0 DIADMM COc1ccc2c(C)cc(-c3c(F)ccc([O-])c3F)nc2c1 ZINC001241289303 1056999016 /nfs/dbraw/zinc/99/90/16/1056999016.db2.gz OQCRPQLWHYZDHB-UHFFFAOYSA-N -1 1 301.292 4.203 20 0 DIADMM Cc1cc(-c2c(F)ccc([O-])c2F)nc(-c2cccs2)n1 ZINC001241290016 1056999110 /nfs/dbraw/zinc/99/91/10/1056999110.db2.gz JFGFROUYIDNISB-UHFFFAOYSA-N -1 1 304.321 4.164 20 0 DIADMM COc1cc2cnc(-c3c(F)ccc([O-])c3F)cc2cc1F ZINC001241291611 1056999917 /nfs/dbraw/zinc/99/99/17/1056999917.db2.gz SQISHIXNAQSEKE-UHFFFAOYSA-N -1 1 305.255 4.033 20 0 DIADMM CSc1nc2ccsc2c(-c2c(F)ccc([O-])c2F)n1 ZINC001241291956 1057000055 /nfs/dbraw/zinc/00/00/55/1057000055.db2.gz ZZFWUKLFGNSEKT-UHFFFAOYSA-N -1 1 310.350 4.064 20 0 DIADMM CC(C)c1scnc1NC(=O)c1cc2ccccc2cc1[O-] ZINC000673551923 1057024103 /nfs/dbraw/zinc/02/41/03/1057024103.db2.gz WOYADGCAFKETDV-UHFFFAOYSA-N -1 1 312.394 4.378 20 0 DIADMM [O-]c1ccc(C(F)(F)F)cc1-c1cc(C(F)(F)F)ccn1 ZINC001242125910 1057271266 /nfs/dbraw/zinc/27/12/66/1057271266.db2.gz ACNACWUSQXVNJC-UHFFFAOYSA-N -1 1 307.193 4.492 20 0 DIADMM [O-]c1ccc(C(F)(F)F)cc1-c1cc(OCC2CC2)ccn1 ZINC001242134223 1057274595 /nfs/dbraw/zinc/27/45/95/1057274595.db2.gz UFJGYHNVEAHWKG-UHFFFAOYSA-N -1 1 309.287 4.262 20 0 DIADMM Cc1nnc(-c2cc(C(F)(F)F)ccc2[O-])c2ccccc12 ZINC001242132726 1057274638 /nfs/dbraw/zinc/27/46/38/1057274638.db2.gz ZPQMGIJTJZHEBE-UHFFFAOYSA-N -1 1 304.271 4.330 20 0 DIADMM COc1nc2ccccc2nc1-c1cc(C(F)(F)F)ccc1[O-] ZINC001242132093 1057274677 /nfs/dbraw/zinc/27/46/77/1057274677.db2.gz VFLDMFWLGBCOOS-UHFFFAOYSA-N -1 1 320.270 4.030 20 0 DIADMM [O-]c1ccc(C(F)(F)F)cc1-c1ncccc1OC(F)F ZINC001242132086 1057274847 /nfs/dbraw/zinc/27/48/47/1057274847.db2.gz UXZGLBNPGLOQKR-UHFFFAOYSA-N -1 1 305.202 4.074 20 0 DIADMM [O-]c1ccc(-c2ncnc3cc(F)ccc32)cc1C(F)(F)F ZINC001242148434 1057280199 /nfs/dbraw/zinc/28/01/99/1057280199.db2.gz YHCXAPVZPCAVDY-UHFFFAOYSA-N -1 1 308.234 4.160 20 0 DIADMM [O-]c1ccc(-c2cnc3cc(F)ccc3n2)cc1C(F)(F)F ZINC001242151898 1057280555 /nfs/dbraw/zinc/28/05/55/1057280555.db2.gz YEUZZHRHLDCSLD-UHFFFAOYSA-N -1 1 308.234 4.160 20 0 DIADMM Cc1cccc2ncnc(-c3ccc([O-])c(C(F)(F)F)c3)c12 ZINC001242151329 1057281026 /nfs/dbraw/zinc/28/10/26/1057281026.db2.gz KDHRGLHYRBOGDQ-UHFFFAOYSA-N -1 1 304.271 4.330 20 0 DIADMM COc1nnc(-c2ccc([O-])c(C(F)(F)F)c2)c2ccccc21 ZINC001242153125 1057281625 /nfs/dbraw/zinc/28/16/25/1057281625.db2.gz REUDFVFWHHJIBM-UHFFFAOYSA-N -1 1 320.270 4.030 20 0 DIADMM Cc1cc2ncnc(-c3ccc([O-])c(C(F)(F)F)c3)c2s1 ZINC001242153462 1057282061 /nfs/dbraw/zinc/28/20/61/1057282061.db2.gz YBAXTZRMUSJQJY-UHFFFAOYSA-N -1 1 310.300 4.391 20 0 DIADMM COc1c(F)ccc(F)c1-c1ccc([O-])c(C(F)(F)F)c1 ZINC001242166072 1057285988 /nfs/dbraw/zinc/28/59/88/1057285988.db2.gz MLZFYHUHKQAREU-UHFFFAOYSA-N -1 1 304.214 4.365 20 0 DIADMM CC(C)(C)OC(=O)c1ccc(F)cc1-c1ccc(F)cc1[O-] ZINC001242219092 1057297931 /nfs/dbraw/zinc/29/79/31/1057297931.db2.gz WWIDKZIKYDISNH-UHFFFAOYSA-N -1 1 306.308 4.293 20 0 DIADMM C[C@H](CSc1ccc(F)cc1)C(=O)Nc1c([O-])cccc1F ZINC000674903530 1057298012 /nfs/dbraw/zinc/29/80/12/1057298012.db2.gz YNKVTJMOBLVZEU-SNVBAGLBSA-N -1 1 323.364 4.037 20 0 DIADMM Cc1cccc(-c2ncc(C)c(-c3c(F)cccc3F)n2)c1[O-] ZINC001242345015 1057340085 /nfs/dbraw/zinc/34/00/85/1057340085.db2.gz GKVZCMBNXUGYCY-UHFFFAOYSA-N -1 1 312.319 4.411 20 0 DIADMM Cc1cc(OCc2ccccc2)nc(-c2cccc(C)c2[O-])n1 ZINC001242345653 1057340578 /nfs/dbraw/zinc/34/05/78/1057340578.db2.gz WVYJBVLVVAORQN-UHFFFAOYSA-N -1 1 306.365 4.045 20 0 DIADMM [O-]c1c(F)cccc1-c1ccc(O[C@H]2CCCCO2)cc1F ZINC001242352992 1057342286 /nfs/dbraw/zinc/34/22/86/1057342286.db2.gz JULJAMUSWIIVPM-INIZCTEOSA-N -1 1 306.308 4.243 20 0 DIADMM CC(C)(C)C(=O)Nc1ccc(-c2cccc(Cl)c2[O-])cn1 ZINC001242364489 1057346265 /nfs/dbraw/zinc/34/62/65/1057346265.db2.gz KPJJBPMKFCRJPU-UHFFFAOYSA-N -1 1 304.777 4.092 20 0 DIADMM [O-]c1c(Cl)cccc1-c1ccnc(OCc2ccccn2)c1 ZINC001242367406 1057348949 /nfs/dbraw/zinc/34/89/49/1057348949.db2.gz LBIVWHIMOXGUCA-UHFFFAOYSA-N -1 1 312.756 4.082 20 0 DIADMM CC(=O)Oc1c[nH]c2cc(-c3cccc(Cl)c3[O-])ccc12 ZINC001242367846 1057349011 /nfs/dbraw/zinc/34/90/11/1057349011.db2.gz UWZJJIPIPDJMDK-UHFFFAOYSA-N -1 1 301.729 4.119 20 0 DIADMM [O-]c1c(Cl)cccc1-c1ccc(OCc2ccncc2)nc1 ZINC001242366750 1057349023 /nfs/dbraw/zinc/34/90/23/1057349023.db2.gz BQGCBFCFPIDEAD-UHFFFAOYSA-N -1 1 312.756 4.082 20 0 DIADMM O=C([O-])c1cccc(-c2ccc3[nH]c(C(F)(F)F)nc3c2)c1F ZINC001242379567 1057354825 /nfs/dbraw/zinc/35/48/25/1057354825.db2.gz VHXMEUQDFZKVSW-UHFFFAOYSA-N -1 1 324.233 4.086 20 0 DIADMM CSc1nc2sccc2c(-c2cccc([O-])c2Cl)n1 ZINC001242799094 1057480701 /nfs/dbraw/zinc/48/07/01/1057480701.db2.gz SXPFYIZODUJPRS-UHFFFAOYSA-N -1 1 308.815 4.439 20 0 DIADMM [O-]c1cccc(-c2ccc(-c3c[nH]c(=S)[nH]3)cc2)c1Cl ZINC001242799752 1057481030 /nfs/dbraw/zinc/48/10/30/1057481030.db2.gz ALCQNXPSKRNRFC-UHFFFAOYSA-N -1 1 302.786 4.391 20 0 DIADMM Cc1csc(-c2cc(C)nnc2-c2cccc([O-])c2Cl)n1 ZINC001242801785 1057481931 /nfs/dbraw/zinc/48/19/31/1057481931.db2.gz ZCBPSVRBMAYILX-UHFFFAOYSA-N -1 1 317.801 4.243 20 0 DIADMM [O-]c1cccc(-c2cc(OCc3ccccc3)ncn2)c1Cl ZINC001242800614 1057482090 /nfs/dbraw/zinc/48/20/90/1057482090.db2.gz IZPQEIDCQDCVMM-UHFFFAOYSA-N -1 1 312.756 4.082 20 0 DIADMM CCOC(=O)/C=C/c1cccc(-c2cccc([O-])c2Cl)c1 ZINC001242800304 1057482442 /nfs/dbraw/zinc/48/24/42/1057482442.db2.gz GATRRLLXCRYROZ-MDZDMXLPSA-N -1 1 302.757 4.289 20 0 DIADMM CCOC(=O)CCc1cccc(-c2cccc([O-])c2Cl)c1 ZINC001242802281 1057482778 /nfs/dbraw/zinc/48/27/78/1057482778.db2.gz DVRXJRJUDVIIGZ-UHFFFAOYSA-N -1 1 304.773 4.208 20 0 DIADMM CC(C)c1noc(-c2ccnc(-c3cccc([O-])c3Cl)c2)n1 ZINC001242801861 1057483004 /nfs/dbraw/zinc/48/30/04/1057483004.db2.gz ZOZINOKCCCEHLQ-UHFFFAOYSA-N -1 1 315.760 4.281 20 0 DIADMM [O-]c1cccc(-c2ccc(OCC(F)(F)F)nc2)c1Cl ZINC001242802970 1057483123 /nfs/dbraw/zinc/48/31/23/1057483123.db2.gz TUCIKBRUEQZZBO-UHFFFAOYSA-N -1 1 303.667 4.049 20 0 DIADMM CC1(C)NC(=O)Nc2cc(-c3cccc([O-])c3Cl)ccc21 ZINC001242802069 1057483280 /nfs/dbraw/zinc/48/32/80/1057483280.db2.gz PHHOINLGOLWKSP-UHFFFAOYSA-N -1 1 302.761 4.083 20 0 DIADMM CCCOc1ccccc1-c1ccc2[n-]c(C(=O)OCC)nc2c1 ZINC001243127425 1057581369 /nfs/dbraw/zinc/58/13/69/1057581369.db2.gz JLJWLYYGPHEUCJ-UHFFFAOYSA-N -1 1 324.380 4.195 20 0 DIADMM CCCOc1ccccc1-c1ccc2nc(C(=O)OCC)[n-]c2c1 ZINC001243127425 1057581375 /nfs/dbraw/zinc/58/13/75/1057581375.db2.gz JLJWLYYGPHEUCJ-UHFFFAOYSA-N -1 1 324.380 4.195 20 0 DIADMM [O-]c1ccc(-c2ccc3nnc(-c4ccccc4)n3c2)c(F)c1F ZINC001243340439 1057652175 /nfs/dbraw/zinc/65/21/75/1057652175.db2.gz AJFKKDJRZPBJJG-UHFFFAOYSA-N -1 1 323.302 4.047 20 0 DIADMM [O-]c1ccc(-c2ccc(OC(F)(F)F)c(F)c2)c(F)c1F ZINC001243342519 1057652715 /nfs/dbraw/zinc/65/27/15/1057652715.db2.gz PZSYPNFOZHAHEL-UHFFFAOYSA-N -1 1 308.177 4.375 20 0 DIADMM [O-]c1ccc(-c2cc(F)ccc2OC(F)(F)F)c(F)c1F ZINC001243341216 1057652781 /nfs/dbraw/zinc/65/27/81/1057652781.db2.gz LJTQIZQBSMIMRX-UHFFFAOYSA-N -1 1 308.177 4.375 20 0 DIADMM COc1ccc(-c2ccc([O-])c(F)c2F)c(C(F)(F)F)c1 ZINC001243341624 1057653290 /nfs/dbraw/zinc/65/32/90/1057653290.db2.gz AUBOIZSIBLCKBY-UHFFFAOYSA-N -1 1 304.214 4.365 20 0 DIADMM [O-]c1ccc(-c2cc(F)c(OC(F)F)c(F)c2)c(F)c1F ZINC001243342194 1057653361 /nfs/dbraw/zinc/65/33/61/1057653361.db2.gz FDHVNDGQGMPNSA-UHFFFAOYSA-N -1 1 308.177 4.217 20 0 DIADMM [O-]c1ccc(-c2cccc3[nH]c(C(F)(F)F)nc32)c(F)c1F ZINC001243343642 1057653695 /nfs/dbraw/zinc/65/36/95/1057653695.db2.gz KWJWVXHHSUDIKE-UHFFFAOYSA-N -1 1 314.213 4.233 20 0 DIADMM COc1cc(-c2ccc([O-])c(F)c2F)ccc1-c1ccncc1 ZINC001243343874 1057654136 /nfs/dbraw/zinc/65/41/36/1057654136.db2.gz RKJDNOBIWHQZAR-UHFFFAOYSA-N -1 1 313.303 4.408 20 0 DIADMM COC(=O)c1nc2cc(-c3ccc(C)cc3OC(C)C)ccc2[n-]1 ZINC001243431332 1057680677 /nfs/dbraw/zinc/68/06/77/1057680677.db2.gz MCRPGYBFKCOZDG-UHFFFAOYSA-N -1 1 324.380 4.112 20 0 DIADMM COC(=O)c1nc2ccc(-c3ccc(C)cc3OC(C)C)cc2[n-]1 ZINC001243431332 1057680678 /nfs/dbraw/zinc/68/06/78/1057680678.db2.gz MCRPGYBFKCOZDG-UHFFFAOYSA-N -1 1 324.380 4.112 20 0 DIADMM [O-]c1c(F)cc(F)cc1-c1cc(OC(F)(F)F)ccc1F ZINC001243502696 1057696688 /nfs/dbraw/zinc/69/66/88/1057696688.db2.gz OQVIDJCOQJMGAK-UHFFFAOYSA-N -1 1 308.177 4.375 20 0 DIADMM CC[C@@H](C(=O)OC)c1ccc(-c2cc(F)cc(F)c2[O-])cc1 ZINC001243506266 1057697720 /nfs/dbraw/zinc/69/77/20/1057697720.db2.gz RQPFPBNMGOBKLG-CYBMUJFWSA-N -1 1 306.308 4.004 20 0 DIADMM COC(=O)c1cc(-c2cc(F)cc(F)c2[O-])cc(C(C)C)c1 ZINC001243504687 1057697749 /nfs/dbraw/zinc/69/77/49/1057697749.db2.gz PHASCJSGLFBSJC-UHFFFAOYSA-N -1 1 306.308 4.247 20 0 DIADMM [O-]c1cccc(-c2ncc(F)c(Oc3ccc(F)cc3)n2)c1F ZINC001243543153 1057708645 /nfs/dbraw/zinc/70/86/45/1057708645.db2.gz DPCVHNHPAQQMGE-UHFFFAOYSA-N -1 1 318.254 4.059 20 0 DIADMM [O-]c1cccc(-c2nccc(-c3c[nH]c4ccccc43)n2)c1F ZINC001243543982 1057709387 /nfs/dbraw/zinc/70/93/87/1057709387.db2.gz TXEWHHJQPLLGBT-UHFFFAOYSA-N -1 1 305.312 4.137 20 0 DIADMM Cc1ccc(Oc2nc(-c3cccc([O-])c3F)ncc2F)cc1 ZINC001243545659 1057709883 /nfs/dbraw/zinc/70/98/83/1057709883.db2.gz ARGPKKLPSMHBJW-UHFFFAOYSA-N -1 1 314.291 4.228 20 0 DIADMM Cc1cc(C)cc([C@H](C)NC(=O)c2c([O-])cccc2Cl)c1 ZINC000730591716 1057718926 /nfs/dbraw/zinc/71/89/26/1057718926.db2.gz BVLTVMAMPHTXLN-LBPRGKRZSA-N -1 1 303.789 4.153 20 0 DIADMM [O-]c1cc(-c2ncnc3[nH]c4cc(F)ccc4c32)ccc1Cl ZINC001243577909 1057721401 /nfs/dbraw/zinc/72/14/01/1057721401.db2.gz CSHOAMQUMRXIOT-UHFFFAOYSA-N -1 1 313.719 4.276 20 0 DIADMM [O-]c1cc(-c2ccc(-c3ccccc3F)nn2)ccc1Cl ZINC001243577912 1057721485 /nfs/dbraw/zinc/72/14/85/1057721485.db2.gz CXHDBLHUPMNPPJ-UHFFFAOYSA-N -1 1 300.720 4.309 20 0 DIADMM COc1ccccc1-c1cc(-c2ccc(Cl)c([O-])c2)ncn1 ZINC001243578218 1057721546 /nfs/dbraw/zinc/72/15/46/1057721546.db2.gz DWBZURGTVPNQQT-UHFFFAOYSA-N -1 1 312.756 4.178 20 0 DIADMM [O-]c1cc(-c2cc(Oc3cccc(F)c3)ncn2)ccc1Cl ZINC001243578210 1057721681 /nfs/dbraw/zinc/72/16/81/1057721681.db2.gz DQZOPCUSQZGPFM-UHFFFAOYSA-N -1 1 316.719 4.434 20 0 DIADMM [O-]c1cc(-c2cc(N3CCc4ccccc43)ncn2)ccc1Cl ZINC001243577928 1057721730 /nfs/dbraw/zinc/72/17/30/1057721730.db2.gz DTBAZRRGZXCBOW-UHFFFAOYSA-N -1 1 323.783 4.197 20 0 DIADMM CSc1ccc2ncnc(-c3ccc(Cl)c([O-])c3)c2c1 ZINC001243578664 1057722105 /nfs/dbraw/zinc/72/21/05/1057722105.db2.gz KCYVAMLJZWPSFC-UHFFFAOYSA-N -1 1 302.786 4.378 20 0 DIADMM CC(C)c1noc(-c2ccnc(-c3ccc(Cl)c([O-])c3)c2)n1 ZINC001243579989 1057722443 /nfs/dbraw/zinc/72/24/43/1057722443.db2.gz ZJIFUTFEASPXBV-UHFFFAOYSA-N -1 1 315.760 4.281 20 0 DIADMM CC(=O)Oc1c[nH]c2ccc(-c3ccc(Cl)c([O-])c3)cc12 ZINC001243580373 1057723192 /nfs/dbraw/zinc/72/31/92/1057723192.db2.gz BGPKXYCINIFSOD-UHFFFAOYSA-N -1 1 301.729 4.119 20 0 DIADMM COC(=O)c1cnc2ccc(-c3ccc(Cl)c([O-])c3)cc2c1 ZINC001243581390 1057723305 /nfs/dbraw/zinc/72/33/05/1057723305.db2.gz BBYYYOYRNFRCCA-UHFFFAOYSA-N -1 1 313.740 4.047 20 0 DIADMM [O-]c1cc(-c2cccc(-c3cc[nH]c(=S)n3)c2)ccc1Cl ZINC001243582964 1057723898 /nfs/dbraw/zinc/72/38/98/1057723898.db2.gz GDFLHHABEAXKQG-UHFFFAOYSA-N -1 1 314.797 4.458 20 0 DIADMM [O-]c1cc(-c2ccc(OCc3ccccn3)nc2)ccc1Cl ZINC001243582719 1057723939 /nfs/dbraw/zinc/72/39/39/1057723939.db2.gz DXVIUBPVEPOVEI-UHFFFAOYSA-N -1 1 312.756 4.082 20 0 DIADMM C=C(C(=O)OCC)c1ccc(-c2ccc(Cl)c([O-])c2)cc1 ZINC001243582658 1057724230 /nfs/dbraw/zinc/72/42/30/1057724230.db2.gz CBDLJJXLRBNSQQ-UHFFFAOYSA-N -1 1 302.757 4.289 20 0 DIADMM CN1C(=O)CC(C)(C)c2ccc(-c3ccc(Cl)c([O-])c3)cc21 ZINC001243582960 1057724305 /nfs/dbraw/zinc/72/43/05/1057724305.db2.gz VWVCUMVHSLIDDD-UHFFFAOYSA-N -1 1 315.800 4.357 20 0 DIADMM Nc1cc(-c2ccc(C(F)(F)F)cc2[O-])nc(C(F)(F)F)c1 ZINC001243608935 1057731451 /nfs/dbraw/zinc/73/14/51/1057731451.db2.gz YXQPCNVSCUWEBO-UHFFFAOYSA-N -1 1 322.208 4.074 20 0 DIADMM COc1cccc2ncnc(-c3ccc(C(F)(F)F)cc3[O-])c21 ZINC001243610699 1057732831 /nfs/dbraw/zinc/73/28/31/1057732831.db2.gz OPZKUXHUQBSACN-UHFFFAOYSA-N -1 1 320.270 4.030 20 0 DIADMM Cc1cc(-c2ccc(C(F)(F)F)cc2[O-])nc(C(C)(C)C)n1 ZINC001243611112 1057732903 /nfs/dbraw/zinc/73/29/03/1057732903.db2.gz ZMEOMBXGUFSKMS-UHFFFAOYSA-N -1 1 310.319 4.474 20 0 DIADMM Cc1cc(-c2ccccc2)ccc1NC(=O)c1cncc([O-])c1 ZINC000732269144 1057772162 /nfs/dbraw/zinc/77/21/62/1057772162.db2.gz QHCUSQALDUALQV-UHFFFAOYSA-N -1 1 304.349 4.015 20 0 DIADMM O=C(c1c([O-])cccc1Cl)N1CCCC2(CCCCC2)C1 ZINC000732306460 1057772519 /nfs/dbraw/zinc/77/25/19/1057772519.db2.gz VFLGAHCYYSGOIG-UHFFFAOYSA-N -1 1 307.821 4.232 20 0 DIADMM C[C@@H]1CN(C(=O)c2ccc3ccccc3c2[O-])Cc2ccccc21 ZINC000733303312 1057811065 /nfs/dbraw/zinc/81/10/65/1057811065.db2.gz MIDVNHDBZAVARS-CQSZACIVSA-N -1 1 317.388 4.305 20 0 DIADMM CN(CCc1ccc(Cl)cc1)C(=O)c1c([O-])cccc1Cl ZINC000733367079 1057814836 /nfs/dbraw/zinc/81/48/36/1057814836.db2.gz HVBFQQLHFMGDLD-UHFFFAOYSA-N -1 1 324.207 4.014 20 0 DIADMM O=C(Nc1ccccc1)c1ccnc(-c2c([O-])cccc2Cl)c1 ZINC001244031081 1057843247 /nfs/dbraw/zinc/84/32/47/1057843247.db2.gz MUYUSZJAZURPLV-UHFFFAOYSA-N -1 1 324.767 4.360 20 0 DIADMM CC(C)c1noc(-c2ccnc(-c3c([O-])cccc3Cl)c2)n1 ZINC001244036042 1057845330 /nfs/dbraw/zinc/84/53/30/1057845330.db2.gz HSUWVYONSPKILW-UHFFFAOYSA-N -1 1 315.760 4.281 20 0 DIADMM COC(=O)c1nc2cc(-c3ccccc3OCC(C)C)ccc2[n-]1 ZINC001244057614 1057852501 /nfs/dbraw/zinc/85/25/01/1057852501.db2.gz YTWUTOMIIWMZHB-UHFFFAOYSA-N -1 1 324.380 4.051 20 0 DIADMM COC(=O)c1nc2ccc(-c3ccccc3OCC(C)C)cc2[n-]1 ZINC001244057614 1057852507 /nfs/dbraw/zinc/85/25/07/1057852507.db2.gz YTWUTOMIIWMZHB-UHFFFAOYSA-N -1 1 324.380 4.051 20 0 DIADMM Cc1ccc(-c2ccccc2)cc1-c1ccc([P@@](=O)([O-])O)cc1 ZINC001244060526 1057853551 /nfs/dbraw/zinc/85/35/51/1057853551.db2.gz MUKSIOCKUJTIRU-UHFFFAOYSA-N -1 1 324.316 4.132 20 0 DIADMM Cc1ccc(-c2ccccc2)cc1-c1ccc([P@](=O)([O-])O)cc1 ZINC001244060526 1057853552 /nfs/dbraw/zinc/85/35/52/1057853552.db2.gz MUKSIOCKUJTIRU-UHFFFAOYSA-N -1 1 324.316 4.132 20 0 DIADMM [O-]c1c(F)cc(-c2ccc3[nH]c(C(F)(F)F)nc3c2)cc1F ZINC001244094583 1057866443 /nfs/dbraw/zinc/86/64/43/1057866443.db2.gz VDBUJAMMJGLYEK-UHFFFAOYSA-N -1 1 314.213 4.233 20 0 DIADMM [O-]c1c(F)cc(-c2ccc3nc(C(F)(F)F)[nH]c3c2)cc1F ZINC001244094583 1057866446 /nfs/dbraw/zinc/86/64/46/1057866446.db2.gz VDBUJAMMJGLYEK-UHFFFAOYSA-N -1 1 314.213 4.233 20 0 DIADMM CCOC(=O)CCCc1cccc(-c2cc(F)c([O-])c(F)c2)c1 ZINC001244095765 1057867602 /nfs/dbraw/zinc/86/76/02/1057867602.db2.gz DELBIIXRXGHBLM-UHFFFAOYSA-N -1 1 320.335 4.223 20 0 DIADMM CCOC(=O)[C@H](CC)c1ccc(-c2cc(F)c([O-])c(F)c2)cc1 ZINC001244097070 1057867743 /nfs/dbraw/zinc/86/77/43/1057867743.db2.gz MKERKGGPHXLDIF-CQSZACIVSA-N -1 1 320.335 4.394 20 0 DIADMM CC(C)(C)OC(=O)Nc1ccc(-c2cc(F)c([O-])c(F)c2)cn1 ZINC001244098260 1057868308 /nfs/dbraw/zinc/86/83/08/1057868308.db2.gz VROPDRCGLXZAPA-UHFFFAOYSA-N -1 1 322.311 4.079 20 0 DIADMM COC(=O)c1cc(-c2cc(F)c([O-])c(F)c2)cc2ccccc21 ZINC001244098016 1057868598 /nfs/dbraw/zinc/86/85/98/1057868598.db2.gz SXZXISITKCCZKI-UHFFFAOYSA-N -1 1 314.287 4.277 20 0 DIADMM COC(=O)c1nc2cc(-c3ccc4sccc4c3)ccc2[n-]1 ZINC001244296563 1057925748 /nfs/dbraw/zinc/92/57/48/1057925748.db2.gz HVCNAOCRNANYOW-UHFFFAOYSA-N -1 1 308.362 4.231 20 0 DIADMM COC(=O)c1nc2ccc(-c3ccc4sccc4c3)cc2[n-]1 ZINC001244296563 1057925752 /nfs/dbraw/zinc/92/57/52/1057925752.db2.gz HVCNAOCRNANYOW-UHFFFAOYSA-N -1 1 308.362 4.231 20 0 DIADMM CCOC(=O)c1nc2cc(-c3ccc(N)c(C(C)C)c3)ccc2[n-]1 ZINC001244340456 1057936840 /nfs/dbraw/zinc/93/68/40/1057936840.db2.gz FCKSGHWABFSCME-UHFFFAOYSA-N -1 1 323.396 4.112 20 0 DIADMM CCOC(=O)c1nc2ccc(-c3ccc(N)c(C(C)C)c3)cc2[n-]1 ZINC001244340456 1057936841 /nfs/dbraw/zinc/93/68/41/1057936841.db2.gz FCKSGHWABFSCME-UHFFFAOYSA-N -1 1 323.396 4.112 20 0 DIADMM [O-]c1cc(OC(F)(F)F)ccc1-c1ccc(-n2cccc2)cn1 ZINC001244462846 1057965377 /nfs/dbraw/zinc/96/53/77/1057965377.db2.gz NOVHDTGEYNYDMZ-UHFFFAOYSA-N -1 1 320.270 4.144 20 0 DIADMM [O-]c1cc(OC(F)(F)F)ccc1-c1cc(C(F)(F)F)ccn1 ZINC001244463708 1057965895 /nfs/dbraw/zinc/96/58/95/1057965895.db2.gz LCKWAQDNJYLSPS-UHFFFAOYSA-N -1 1 323.192 4.372 20 0 DIADMM Cc1cccc2ncnc(-c3ccc(OC(F)(F)F)cc3[O-])c12 ZINC001244464436 1057965905 /nfs/dbraw/zinc/96/59/05/1057965905.db2.gz LRCFMVWQTBFWEX-UHFFFAOYSA-N -1 1 320.270 4.209 20 0 DIADMM [O-]c1cc(OC(F)(F)F)ccc1-c1ncnc2c(F)cccc21 ZINC001244464907 1057966401 /nfs/dbraw/zinc/96/64/01/1057966401.db2.gz XSMZTBHQFKHXAN-UHFFFAOYSA-N -1 1 324.233 4.040 20 0 DIADMM Cc1cc2cccnc2c(-c2ccc(OC(F)(F)F)cc2[O-])n1 ZINC001244465470 1057967005 /nfs/dbraw/zinc/96/70/05/1057967005.db2.gz XEKATEYHDUPBII-UHFFFAOYSA-N -1 1 320.270 4.209 20 0 DIADMM Cc1cc(-c2ncnc3[nH]c4c(c32)CCCC4)cc(Cl)c1[O-] ZINC001244532571 1057987402 /nfs/dbraw/zinc/98/74/02/1057987402.db2.gz VTERTLKXMLQVEW-UHFFFAOYSA-N -1 1 313.788 4.171 20 0 DIADMM Cc1cc(-c2ccc(COCC3CC3)cn2)cc(Cl)c1[O-] ZINC001244537761 1057989616 /nfs/dbraw/zinc/98/96/16/1057989616.db2.gz FQVLYYIZZPVSIU-UHFFFAOYSA-N -1 1 303.789 4.343 20 0 DIADMM [O-]c1ccc(Cl)c(-c2cccc(OCC(F)(F)F)n2)c1F ZINC001244539100 1057989781 /nfs/dbraw/zinc/98/97/81/1057989781.db2.gz RGZWYVMXORQHTB-UHFFFAOYSA-N -1 1 321.657 4.188 20 0 DIADMM CCc1noc(-c2ccnc(-c3cc(C)c([O-])c(Cl)c3)c2)n1 ZINC001244537990 1057989967 /nfs/dbraw/zinc/98/99/67/1057989967.db2.gz HVURCISJOVQKSJ-UHFFFAOYSA-N -1 1 315.760 4.028 20 0 DIADMM Cc1ccc(-c2ccc(-c3cc(C)c([O-])c(Cl)c3)nn2)o1 ZINC001244539247 1057989992 /nfs/dbraw/zinc/98/99/92/1057989992.db2.gz SBNBOPKEWHMAJI-UHFFFAOYSA-N -1 1 300.745 4.379 20 0 DIADMM [O-]c1ccc(Cl)c(-c2ncnc3[nH]c4c(c32)CCCC4)c1F ZINC001244539507 1057990421 /nfs/dbraw/zinc/99/04/21/1057990421.db2.gz ZLIIDUNUYIFDEX-UHFFFAOYSA-N -1 1 317.751 4.002 20 0 DIADMM COc1ccc2cccnc2c1-c1c(Cl)ccc([O-])c1F ZINC001244539784 1057990452 /nfs/dbraw/zinc/99/04/52/1057990452.db2.gz IBZBMUCUULMPJA-UHFFFAOYSA-N -1 1 303.720 4.409 20 0 DIADMM [O-]c1ccc(Cl)c(-c2cc(-c3cccs3)ncn2)c1F ZINC001244540354 1057990490 /nfs/dbraw/zinc/99/04/90/1057990490.db2.gz LNTNORQEQDMHRM-UHFFFAOYSA-N -1 1 306.749 4.370 20 0 DIADMM Cc1cc(-c2c(Cl)ccc([O-])c2F)nc(-c2cccnc2)n1 ZINC001244540147 1057990541 /nfs/dbraw/zinc/99/05/41/1057990541.db2.gz IWNJDNNCBLKOTA-UHFFFAOYSA-N -1 1 315.735 4.012 20 0 DIADMM COC(=O)C(C)(C)c1cccc(-c2c(Cl)ccc([O-])c2F)c1 ZINC001244539785 1057990545 /nfs/dbraw/zinc/99/05/45/1057990545.db2.gz ICQMKILPZCQQEG-UHFFFAOYSA-N -1 1 322.763 4.302 20 0 DIADMM [O-]c1ccc(Cl)c(-c2ccc(OC(F)(F)F)cn2)c1F ZINC001244539377 1057990598 /nfs/dbraw/zinc/99/05/98/1057990598.db2.gz YMSDSBMIKNGWPZ-UHFFFAOYSA-N -1 1 307.630 4.145 20 0 DIADMM Cc1nc(-c2ccc(-c3c(Cl)ccc([O-])c3F)cc2)no1 ZINC001244539775 1057990662 /nfs/dbraw/zinc/99/06/62/1057990662.db2.gz HNZKAWDDTNAXAQ-UHFFFAOYSA-N -1 1 304.708 4.210 20 0 DIADMM [O-]c1ccc(Cl)c(-c2ccc(-c3ccc(F)cc3)nn2)c1F ZINC001244540133 1057990945 /nfs/dbraw/zinc/99/09/45/1057990945.db2.gz IEAIERWORKNGHZ-UHFFFAOYSA-N -1 1 318.710 4.448 20 0 DIADMM [O-]c1ccc(Cl)c(-c2ccc(-c3ccccc3F)nn2)c1F ZINC001244540772 1057991103 /nfs/dbraw/zinc/99/11/03/1057991103.db2.gz QVQJJKTYGYJOTE-UHFFFAOYSA-N -1 1 318.710 4.448 20 0 DIADMM COc1cc2cccnc2c(-c2c(Cl)ccc([O-])c2F)c1 ZINC001244542482 1057991299 /nfs/dbraw/zinc/99/12/99/1057991299.db2.gz LQSYDPNWHCWDMZ-UHFFFAOYSA-N -1 1 303.720 4.409 20 0 DIADMM Cc1cc2ncnc(-c3c(Cl)ccc([O-])c3F)c2cc1C ZINC001244541011 1057991372 /nfs/dbraw/zinc/99/13/72/1057991372.db2.gz UUUYCYBSADTMON-UHFFFAOYSA-N -1 1 302.736 4.412 20 0 DIADMM COc1ccc(-c2c(Cl)ccc([O-])c2F)c(OC)c1F ZINC001244542021 1057991574 /nfs/dbraw/zinc/99/15/74/1057991574.db2.gz IWAMCOOKOXICSW-UHFFFAOYSA-N -1 1 300.688 4.008 20 0 DIADMM COC(=O)c1cc2cc[nH]c2c(-c2c(Cl)ccc([O-])c2F)c1 ZINC001244541808 1057991581 /nfs/dbraw/zinc/99/15/81/1057991581.db2.gz FTXIHPWNHNTJCA-UHFFFAOYSA-N -1 1 319.719 4.120 20 0 DIADMM [O-]c1ccc(Cl)c(-c2cc(-c3ccccc3)ncn2)c1F ZINC001244540769 1057991592 /nfs/dbraw/zinc/99/15/92/1057991592.db2.gz QSIAOQXACOSVAS-UHFFFAOYSA-N -1 1 300.720 4.309 20 0 DIADMM Cc1nc(-c2ccccn2)cc(-c2c(Cl)ccc([O-])c2F)n1 ZINC001244541105 1057991600 /nfs/dbraw/zinc/99/16/00/1057991600.db2.gz YNUFTNSRQIEPBC-UHFFFAOYSA-N -1 1 315.735 4.012 20 0 DIADMM [O-]c1ccc(Cl)c(-c2ccc(C3N=NC(=S)O3)cc2)c1F ZINC001244542729 1057992044 /nfs/dbraw/zinc/99/20/44/1057992044.db2.gz KTKZTONYBWEPBK-UHFFFAOYSA-N -1 1 322.748 4.190 20 0 DIADMM CCOC(=O)CCc1ccccc1-c1c(Cl)ccc([O-])c1F ZINC001244543787 1057992099 /nfs/dbraw/zinc/99/20/99/1057992099.db2.gz WLMTZJRRMDFHNQ-UHFFFAOYSA-N -1 1 322.763 4.347 20 0 DIADMM CC1(c2cccc(-c3c(Cl)ccc([O-])c3F)c2)OCCO1 ZINC001244542768 1057992129 /nfs/dbraw/zinc/99/21/29/1057992129.db2.gz MDUANCGFIOEGDB-UHFFFAOYSA-N -1 1 308.736 4.071 20 0 DIADMM CC(C)c1nnc2ccc(-c3c(Cl)ccc([O-])c3F)cn21 ZINC001244543101 1057992149 /nfs/dbraw/zinc/99/21/49/1057992149.db2.gz SXGXTHQUBADHIA-UHFFFAOYSA-N -1 1 305.740 4.018 20 0 DIADMM COc1cccc2cc(-c3c(Cl)ccc([O-])c3F)cnc21 ZINC001244542792 1057992216 /nfs/dbraw/zinc/99/22/16/1057992216.db2.gz NGIFULBFCMHVNV-UHFFFAOYSA-N -1 1 303.720 4.409 20 0 DIADMM CCc1cc(-c2c(Cl)ccc([O-])c2F)ccc1NC(C)=O ZINC001244543788 1057992234 /nfs/dbraw/zinc/99/22/34/1057992234.db2.gz WLWWLULDQNQFBG-UHFFFAOYSA-N -1 1 307.752 4.373 20 0 DIADMM COC(=O)CCCc1ccc(-c2c(Cl)ccc([O-])c2F)cc1 ZINC001244543538 1057992298 /nfs/dbraw/zinc/99/22/98/1057992298.db2.gz VUKDQMCZQNIFOZ-UHFFFAOYSA-N -1 1 322.763 4.347 20 0 DIADMM [O-]c1ccc(Cl)c(-c2cncc(-c3ccncc3)c2)c1F ZINC001244543795 1057992318 /nfs/dbraw/zinc/99/23/18/1057992318.db2.gz XCHHLZJXDIFVNU-UHFFFAOYSA-N -1 1 300.720 4.309 20 0 DIADMM Cc1nc(C(=O)OC(C)C)ccc1-c1c(Cl)ccc([O-])c1F ZINC001244543069 1057992339 /nfs/dbraw/zinc/99/23/39/1057992339.db2.gz QOZQKAOLGFJNOH-UHFFFAOYSA-N -1 1 323.751 4.120 20 0 DIADMM CN(C)Cc1c(F)cc(-c2c(Cl)ccc([O-])c2F)cc1F ZINC001244542653 1057992407 /nfs/dbraw/zinc/99/24/07/1057992407.db2.gz NEJMIPBPSQBCMN-UHFFFAOYSA-N -1 1 315.722 4.192 20 0 DIADMM CC1(C)C(=O)Nc2cccc(-c3c(Cl)ccc([O-])c3F)c21 ZINC001244543658 1057992456 /nfs/dbraw/zinc/99/24/56/1057992456.db2.gz YWHBLVXXBIZAPU-UHFFFAOYSA-N -1 1 305.736 4.081 20 0 DIADMM Cc1ncc(-c2cc(C)c([O-])c(Cl)c2)c(C(F)(F)F)n1 ZINC001244555890 1057995109 /nfs/dbraw/zinc/99/51/09/1057995109.db2.gz RGHQEPSOZOOIBY-UHFFFAOYSA-N -1 1 302.683 4.138 20 0 DIADMM Cc1ccc(-c2ccc([P@@](=O)([O-])O)cc2)cc1-c1ccccc1 ZINC001244786720 1058048595 /nfs/dbraw/zinc/04/85/95/1058048595.db2.gz PBQRNXJGVDIJMP-UHFFFAOYSA-N -1 1 324.316 4.132 20 0 DIADMM Cc1ccc(-c2ccc([P@](=O)([O-])O)cc2)cc1-c1ccccc1 ZINC001244786720 1058048598 /nfs/dbraw/zinc/04/85/98/1058048598.db2.gz PBQRNXJGVDIJMP-UHFFFAOYSA-N -1 1 324.316 4.132 20 0 DIADMM Cc1nc(C(F)(F)F)nc(-c2cc(Cl)ccc2[O-])c1C ZINC001245048405 1058102067 /nfs/dbraw/zinc/10/20/67/1058102067.db2.gz KECFPWINGJJMJN-UHFFFAOYSA-N -1 1 302.683 4.138 20 0 DIADMM CC(C)(C)OC(=O)Nc1cccc(-c2cc(Cl)ccc2[O-])n1 ZINC001245050290 1058102413 /nfs/dbraw/zinc/10/24/13/1058102413.db2.gz DUWARNLJTDUAHA-UHFFFAOYSA-N -1 1 320.776 4.455 20 0 DIADMM CSc1nc(-c2cc(Cl)ccc2[O-])cc(C(F)F)n1 ZINC001245050280 1058102460 /nfs/dbraw/zinc/10/24/60/1058102460.db2.gz QOIIPHWPXZXSPT-UHFFFAOYSA-N -1 1 302.733 4.162 20 0 DIADMM COc1cc(OC)c2ccnc(-c3cc(Cl)ccc3[O-])c2c1 ZINC001245049653 1058102697 /nfs/dbraw/zinc/10/26/97/1058102697.db2.gz UBQBCQLICVPQMV-UHFFFAOYSA-N -1 1 315.756 4.278 20 0 DIADMM O=C(Nc1ccccc1)c1ccnc(-c2cc(Cl)ccc2[O-])c1 ZINC001245049417 1058102799 /nfs/dbraw/zinc/10/27/99/1058102799.db2.gz PKRDZNGEDPHPGN-UHFFFAOYSA-N -1 1 324.767 4.360 20 0 DIADMM CC(C)(C)C(=O)Nc1cccc(-c2cc(Cl)ccc2[O-])n1 ZINC001245051067 1058103124 /nfs/dbraw/zinc/10/31/24/1058103124.db2.gz AXDBSGQRUQAFOE-UHFFFAOYSA-N -1 1 304.777 4.092 20 0 DIADMM COC(=O)c1cc2ccccc2c(-c2cc(Cl)ccc2[O-])n1 ZINC001245050652 1058103168 /nfs/dbraw/zinc/10/31/68/1058103168.db2.gz YFJOTEPQWOPRND-UHFFFAOYSA-N -1 1 313.740 4.047 20 0 DIADMM COC(=O)c1nc2cc(-c3cccc(Cl)c3Cl)ccc2[n-]1 ZINC001245098147 1058112682 /nfs/dbraw/zinc/11/26/82/1058112682.db2.gz KALWLFFOXRYYDV-UHFFFAOYSA-N -1 1 321.163 4.323 20 0 DIADMM COC(=O)c1nc2ccc(-c3cccc(Cl)c3Cl)cc2[n-]1 ZINC001245098147 1058112685 /nfs/dbraw/zinc/11/26/85/1058112685.db2.gz KALWLFFOXRYYDV-UHFFFAOYSA-N -1 1 321.163 4.323 20 0 DIADMM CSc1ccc([O-])c(C(=O)Nc2cc(C)ccc2Cl)c1 ZINC001545654086 1058218519 /nfs/dbraw/zinc/21/85/19/1058218519.db2.gz BFAIELOFEHWZSG-UHFFFAOYSA-N -1 1 307.802 4.328 20 0 DIADMM CCOC(=O)c1nc2cc(-c3cc4cc(C)ccc4[nH]3)ccc2[n-]1 ZINC001245570525 1058237159 /nfs/dbraw/zinc/23/71/59/1058237159.db2.gz DKWMVHUVLJEYBM-UHFFFAOYSA-N -1 1 319.364 4.196 20 0 DIADMM CCOC(=O)c1nc2ccc(-c3cc4cc(C)ccc4[nH]3)cc2[n-]1 ZINC001245570525 1058237176 /nfs/dbraw/zinc/23/71/76/1058237176.db2.gz DKWMVHUVLJEYBM-UHFFFAOYSA-N -1 1 319.364 4.196 20 0 DIADMM CCC(CC)[C@H]([N-]C(=O)C(F)(F)C(F)F)c1cccs1 ZINC001527790858 1058243420 /nfs/dbraw/zinc/24/34/20/1058243420.db2.gz XJOMDXPREDULIT-JTQLQIEISA-N -1 1 311.344 4.242 20 0 DIADMM [O-]c1cc(F)c(-c2cc(N3CCCCC3)ccn2)cc1Cl ZINC001245669517 1058324920 /nfs/dbraw/zinc/32/49/20/1058324920.db2.gz UKEWTLDCDKKTLB-UHFFFAOYSA-N -1 1 306.768 4.237 20 0 DIADMM Cc1nc2ccc(F)cc2c(-c2c(F)ccc([O-])c2Cl)n1 ZINC001245826156 1058523063 /nfs/dbraw/zinc/52/30/63/1058523063.db2.gz FFTPRDGIRKXRRL-UHFFFAOYSA-N -1 1 306.699 4.242 20 0 DIADMM [O-]c1ccc(F)c(-c2ccc(-c3ccsc3)nn2)c1Cl ZINC001245829997 1058523677 /nfs/dbraw/zinc/52/36/77/1058523677.db2.gz GBEOOAUBHCRRDG-UHFFFAOYSA-N -1 1 306.749 4.370 20 0 DIADMM Cc1nc2ccc(-c3c(F)ccc([O-])c3Cl)nc2n1C(C)C ZINC001245828622 1058526184 /nfs/dbraw/zinc/52/61/84/1058526184.db2.gz WJBZHMHVOTTYRX-UHFFFAOYSA-N -1 1 319.767 4.486 20 0 DIADMM COc1cccc2c1ccnc2-c1c(F)ccc([O-])c1Cl ZINC001245830170 1058527456 /nfs/dbraw/zinc/52/74/56/1058527456.db2.gz JYMATVJFGROFHV-UHFFFAOYSA-N -1 1 303.720 4.409 20 0 DIADMM Cc1ccc(-c2ccc(-c3c(F)ccc([O-])c3Cl)nn2)o1 ZINC001245830064 1058527543 /nfs/dbraw/zinc/52/75/43/1058527543.db2.gz HWFWOOBKUNOAIZ-UHFFFAOYSA-N -1 1 304.708 4.210 20 0 DIADMM Cc1cc(C)c2ccc(-c3c(F)ccc([O-])c3Cl)nc2n1 ZINC001245830102 1058529330 /nfs/dbraw/zinc/52/93/30/1058529330.db2.gz HJQKJKOQUGKNJI-UHFFFAOYSA-N -1 1 302.736 4.412 20 0 DIADMM [O-]c1ccc(F)c(-c2ccc(-c3cccc(F)c3)nn2)c1Cl ZINC001245830345 1058529653 /nfs/dbraw/zinc/52/96/53/1058529653.db2.gz KZCMDRZRFZCPOD-UHFFFAOYSA-N -1 1 318.710 4.448 20 0 DIADMM [O-]c1ccc(F)c(-c2cnc3cc(F)c(F)cc3n2)c1Cl ZINC001245830615 1058530647 /nfs/dbraw/zinc/53/06/47/1058530647.db2.gz QEOUUYRBVDLCJR-UHFFFAOYSA-N -1 1 310.662 4.073 20 0 DIADMM CCOC(=O)c1cc(-c2c(F)ccc([O-])c2Cl)ccc1F ZINC001245832652 1058531202 /nfs/dbraw/zinc/53/12/02/1058531202.db2.gz ZUHBKBDQGCSLGL-UHFFFAOYSA-N -1 1 312.699 4.168 20 0 DIADMM CCOC(=O)c1ccc(-c2c(F)ccc([O-])c2Cl)c(F)c1 ZINC001245832530 1058531529 /nfs/dbraw/zinc/53/15/29/1058531529.db2.gz PKDGXGWRYRMJQZ-UHFFFAOYSA-N -1 1 312.699 4.168 20 0 DIADMM [O-]c1ccc(F)c(-c2cccc(-c3ccncc3)n2)c1Cl ZINC001245832475 1058531967 /nfs/dbraw/zinc/53/19/67/1058531967.db2.gz WPXJQIZTOPFOMR-UHFFFAOYSA-N -1 1 300.720 4.309 20 0 DIADMM CC(C)c1nnc2ccc(-c3c(F)ccc([O-])c3Cl)cn21 ZINC001245831802 1058532090 /nfs/dbraw/zinc/53/20/90/1058532090.db2.gz PFJUVVAHPMQAHJ-UHFFFAOYSA-N -1 1 305.740 4.018 20 0 DIADMM COc1ncc(-c2c(F)ccc([O-])c2Cl)c2ccccc21 ZINC001245831334 1058532205 /nfs/dbraw/zinc/53/22/05/1058532205.db2.gz JWYMKXMEHHSQPA-UHFFFAOYSA-N -1 1 303.720 4.409 20 0 DIADMM COC(=O)c1cc2ccc(-c3c(F)ccc([O-])c3Cl)cc2[nH]1 ZINC001245831890 1058533446 /nfs/dbraw/zinc/53/34/46/1058533446.db2.gz SCRQBVDCIWTPMK-UHFFFAOYSA-N -1 1 319.719 4.120 20 0 DIADMM COC(=O)c1cc2c(cccc2-c2c(F)ccc([O-])c2Cl)[nH]1 ZINC001245832394 1058533647 /nfs/dbraw/zinc/53/36/47/1058533647.db2.gz WQEDYAARJDBOLE-UHFFFAOYSA-N -1 1 319.719 4.120 20 0 DIADMM [O-]c1ccc(F)c(-c2ccccc2Cn2ccnc2)c1Cl ZINC001245831660 1058534371 /nfs/dbraw/zinc/53/43/71/1058534371.db2.gz HIIBDVLNZBEBMK-UHFFFAOYSA-N -1 1 302.736 4.097 20 0 DIADMM [O-]c1ccc(F)c(-c2ccc(N3CCSCC3)cc2)c1Cl ZINC001245833918 1058536567 /nfs/dbraw/zinc/53/65/67/1058536567.db2.gz FHWZZCHCTBZOGI-UHFFFAOYSA-N -1 1 323.820 4.405 20 0 DIADMM CC1(C)Cc2ccc(-c3c(F)ccc([O-])c3Cl)cc2NC1=O ZINC001245833927 1058537227 /nfs/dbraw/zinc/53/72/27/1058537227.db2.gz FNDFBKWDLXNGKO-UHFFFAOYSA-N -1 1 319.763 4.373 20 0 DIADMM C=C(C(=O)OCC)c1ccc(-c2c(F)ccc([O-])c2Cl)cc1 ZINC001245834161 1058537806 /nfs/dbraw/zinc/53/78/06/1058537806.db2.gz DGOOLTCOVDUIQM-UHFFFAOYSA-N -1 1 320.747 4.428 20 0 DIADMM O=c1cc(-c2c(F)ccc([O-])c2Cl)ccn1-c1ccccc1 ZINC001245835124 1058540078 /nfs/dbraw/zinc/54/00/78/1058540078.db2.gz QFAOIWUJGIUVNU-UHFFFAOYSA-N -1 1 315.731 4.003 20 0 DIADMM COC(=O)/C=C\c1ccc(-c2c(F)ccc([O-])c2Cl)cc1 ZINC001245835165 1058540395 /nfs/dbraw/zinc/54/03/95/1058540395.db2.gz LUYAVADPTKGVBV-WTKPLQERSA-N -1 1 306.720 4.038 20 0 DIADMM COc1ccc(-c2c(F)ccc([O-])c2Cl)c(OC)c1F ZINC001245836279 1058542266 /nfs/dbraw/zinc/54/22/66/1058542266.db2.gz ZPZHXHACVXHXGR-UHFFFAOYSA-N -1 1 300.688 4.008 20 0 DIADMM C[C@@H]1CCC[C@@H](NC(=O)c2ccc(C(F)(F)F)c([O-])c2)CC1 ZINC001556236009 1058566639 /nfs/dbraw/zinc/56/66/39/1058566639.db2.gz TZGZAVSJIVUQOY-ZYHUDNBSSA-N -1 1 315.335 4.110 20 0 DIADMM Cc1ccc2[nH]c(C(=O)Nc3ccc([O-])c(F)c3F)cc2c1C ZINC001556592087 1058618161 /nfs/dbraw/zinc/61/81/61/1058618161.db2.gz XLOOYBTZPJENRO-UHFFFAOYSA-N -1 1 316.307 4.021 20 0 DIADMM CN(C)c1ccc(-c2cc(=O)n(C3CCC(F)(F)CC3)[n-]2)cc1 ZINC001245944099 1058640515 /nfs/dbraw/zinc/64/05/15/1058640515.db2.gz MXDIDSYBLFORJE-UHFFFAOYSA-N -1 1 321.371 4.072 20 0 DIADMM CC[C@@H](C)CO[N-]C(=O)[C@@H](C)c1ccc(Cl)c(Cl)c1 ZINC001556803585 1058642005 /nfs/dbraw/zinc/64/20/05/1058642005.db2.gz FTSCWWAOIFXSKZ-ZJUUUORDSA-N -1 1 304.217 4.191 20 0 DIADMM C[C@H](Cn1[n-]c(-c2ccc(N(C)C)cc2)cc1=O)c1ccccc1 ZINC001245944220 1058642181 /nfs/dbraw/zinc/64/21/81/1058642181.db2.gz PCKRRFNPNPJFOU-OAHLLOKOSA-N -1 1 321.424 4.125 20 0 DIADMM CC(C)(NC(=O)c1cc2ccccc2cc1[O-])c1ccccc1F ZINC001556798653 1058642173 /nfs/dbraw/zinc/64/21/73/1058642173.db2.gz GUXZNKRIPFOUEV-UHFFFAOYSA-N -1 1 323.367 4.350 20 0 DIADMM O=c1cc(CC2CC2)[n-]n1-c1ccc(Cl)c(C(F)(F)F)c1 ZINC001245953517 1058649376 /nfs/dbraw/zinc/64/93/76/1058649376.db2.gz PAVVOFDVXFYRSD-UHFFFAOYSA-N -1 1 316.710 4.203 20 0 DIADMM O=C(Nc1cc([O-])c(F)cc1F)c1ccc(-c2cccs2)o1 ZINC001556919785 1058669993 /nfs/dbraw/zinc/66/99/93/1058669993.db2.gz PUVACPVZTZIOJQ-UHFFFAOYSA-N -1 1 321.304 4.244 20 0 DIADMM O=C(Nc1cc([O-])c(F)cc1F)[C@@H]1C[C@H]1c1ccc(Cl)cc1 ZINC001556920521 1058670523 /nfs/dbraw/zinc/67/05/23/1058670523.db2.gz WPYFVZHFVMLUDI-WDEREUQCSA-N -1 1 323.726 4.066 20 0 DIADMM CCC[C@@H]1CCCC[C@@H]1CNC(=O)c1cc(Cl)ccc1[O-] ZINC001557028105 1058686808 /nfs/dbraw/zinc/68/68/08/1058686808.db2.gz IIEMUMUXKCNJFT-CHWSQXEVSA-N -1 1 309.837 4.382 20 0 DIADMM CCCO[N-]C(=O)C(CC)(CC)Cc1nc2ccccc2s1 ZINC001557192508 1058714244 /nfs/dbraw/zinc/71/42/44/1058714244.db2.gz BVHNURKEBYKDMS-UHFFFAOYSA-N -1 1 320.458 4.103 20 0 DIADMM O=C(NCC(C1CCC1)C1CCC1)c1ccc2ccccc2c1[O-] ZINC001557642631 1058779433 /nfs/dbraw/zinc/77/94/33/1058779433.db2.gz YNXUSUQAMMBQDQ-UHFFFAOYSA-N -1 1 323.436 4.492 20 0 DIADMM CN(C)c1ccc(F)cc1NC(=O)c1cc2ccccc2cc1[O-] ZINC001558228858 1058851393 /nfs/dbraw/zinc/85/13/93/1058851393.db2.gz VZICDFBACBXESQ-UHFFFAOYSA-N -1 1 324.355 4.003 20 0 DIADMM Cc1ccc(C[C@@H](C)C(=O)Nc2cc(F)c([O-])cc2Cl)cc1 ZINC001558644249 1058894592 /nfs/dbraw/zinc/89/45/92/1058894592.db2.gz BMPXULLQKYODTP-LLVKDONJSA-N -1 1 321.779 4.310 20 0 DIADMM C/C(=C\C(=O)Nc1cc(F)c([O-])cc1Cl)c1ccccc1 ZINC001558643864 1058894843 /nfs/dbraw/zinc/89/48/43/1058894843.db2.gz KRJDONOYWCCBJW-JXMROGBWSA-N -1 1 305.736 4.227 20 0 DIADMM O=C(N[C@@H]1CCc2cc(F)ccc21)c1cc2ccccc2cc1[O-] ZINC001558673725 1058898269 /nfs/dbraw/zinc/89/82/69/1058898269.db2.gz OZMZSBOVQBXGEY-GOSISDBHSA-N -1 1 321.351 4.102 20 0 DIADMM O=C(c1ccc([O-])cc1F)N1CCCCC12CCCCCC2 ZINC001558818792 1058915788 /nfs/dbraw/zinc/91/57/88/1058915788.db2.gz PGODCEXGPCPZGV-UHFFFAOYSA-N -1 1 305.393 4.250 20 0 DIADMM O=C(Nc1nc(Cl)ccc1[O-])c1coc2ccc(Cl)cc12 ZINC001558967178 1058930630 /nfs/dbraw/zinc/93/06/30/1058930630.db2.gz SYRLXSZUZHPGON-UHFFFAOYSA-N -1 1 323.135 4.093 20 0 DIADMM [O-]c1ccc(CNc2cnc3cc(Cl)ccc3n2)cc1Cl ZINC001559272330 1059134778 /nfs/dbraw/zinc/13/47/78/1059134778.db2.gz SYEXUDSHRLBJRL-UHFFFAOYSA-N -1 1 320.179 4.254 20 0 DIADMM Cc1cccc(CCCSc2nc(C)c(C3CC3)c(=O)[n-]2)c1 ZINC001559450366 1059238482 /nfs/dbraw/zinc/23/84/82/1059238482.db2.gz PNDYEIVVMAQBOQ-UHFFFAOYSA-N -1 1 314.454 4.401 20 0 DIADMM Cc1nc(SCc2ccc3cnccc3c2)[n-]c(=O)c1C1CC1 ZINC001559450198 1059239852 /nfs/dbraw/zinc/23/98/52/1059239852.db2.gz LYLACEKWFFBQSU-UHFFFAOYSA-N -1 1 323.421 4.209 20 0 DIADMM CCc1ccc(NC(=S)Nc2cc(F)c([O-])cc2F)cc1 ZINC001247340616 1059383607 /nfs/dbraw/zinc/38/36/07/1059383607.db2.gz OVENMCUEZRIGQR-UHFFFAOYSA-N -1 1 308.353 4.042 20 0 DIADMM CC[C@@H](C)[C@@H]([N-]C(=O)C(F)(F)c1ccc(C)cc1)C(F)(F)F ZINC001524463316 1059528241 /nfs/dbraw/zinc/52/82/41/1059528241.db2.gz FEUALILSRPKDGF-ZYHUDNBSSA-N -1 1 323.305 4.180 20 0 DIADMM Cc1cc(C)cc(-c2noc(Cc3ccc([O-])c(Cl)c3)n2)c1 ZINC001247587772 1059565503 /nfs/dbraw/zinc/56/55/03/1059565503.db2.gz LIJMQUZUYSANHO-UHFFFAOYSA-N -1 1 314.772 4.303 20 0 DIADMM Cn1cc(Nc2c(Cl)ccc([O-])c2Cl)c2ccncc21 ZINC001249699327 1060359243 /nfs/dbraw/zinc/35/92/43/1060359243.db2.gz YSNOULQHAKZPRK-UHFFFAOYSA-N -1 1 308.168 4.329 20 0 DIADMM O=C([O-])c1c(F)ccc(CN2CCC3(CCCCC3)CC2)c1F ZINC001249759906 1060387380 /nfs/dbraw/zinc/38/73/80/1060387380.db2.gz MOJZWJJWGKQDPW-UHFFFAOYSA-N -1 1 323.383 4.209 20 0 DIADMM COc1cccc(C([O-])=Cc2c(F)ccc(SC)c2F)c1 ZINC001249902061 1060466156 /nfs/dbraw/zinc/46/61/56/1060466156.db2.gz KBVHSGZKNVRLGL-UHFFFAOYSA-N -1 1 308.349 4.121 20 0 DIADMM Cc1ccc2cc(Nc3cc([O-])c(F)c(F)c3F)ccc2n1 ZINC001249962118 1060502776 /nfs/dbraw/zinc/50/27/76/1060502776.db2.gz GWEXSOBUJWPAIV-UHFFFAOYSA-N -1 1 304.271 4.410 20 0 DIADMM [O-]c1cc(Nc2cc(-c3ccccc3)cnn2)c(F)c(F)c1F ZINC001249961123 1060502970 /nfs/dbraw/zinc/50/29/70/1060502970.db2.gz GRGDBKKKVXFOHY-UHFFFAOYSA-N -1 1 317.270 4.010 20 0 DIADMM [O-]c1ccc(CN(Cc2ccccc2F)C2CCC2)c(F)c1F ZINC001560670531 1060503455 /nfs/dbraw/zinc/50/34/55/1060503455.db2.gz GDXUEKDSXARXJC-UHFFFAOYSA-N -1 1 321.342 4.364 20 0 DIADMM [O-]c1cc(Nc2cnc3ccc(F)cc3c2)c(F)c(F)c1F ZINC001249961306 1060503670 /nfs/dbraw/zinc/50/36/70/1060503670.db2.gz PRDBSQZZNFXADN-UHFFFAOYSA-N -1 1 308.234 4.240 20 0 DIADMM [O-]c1cc(Nc2ccccc2OC(F)(F)F)c(F)c(F)c1F ZINC001249961677 1060504932 /nfs/dbraw/zinc/50/49/32/1060504932.db2.gz AUIABVCKYWRVBQ-UHFFFAOYSA-N -1 1 323.192 4.452 20 0 DIADMM Cc1nc2cc(Nc3cc([O-])c(F)c(F)c3F)ccc2s1 ZINC001249961757 1060505255 /nfs/dbraw/zinc/50/52/55/1060505255.db2.gz DMQWIFIACCOIFT-UHFFFAOYSA-N -1 1 310.300 4.471 20 0 DIADMM COc1cc(Nc2cc([O-])c(F)c(F)c2F)ccc1Cl ZINC001249963390 1060507878 /nfs/dbraw/zinc/50/78/78/1060507878.db2.gz PORDVIWVLVWSOO-UHFFFAOYSA-N -1 1 303.667 4.215 20 0 DIADMM [O-]c1cc(Nc2ccccc2OC(F)F)c(F)c(F)c1F ZINC001249963660 1060509096 /nfs/dbraw/zinc/50/90/96/1060509096.db2.gz RKGOCVVOSFYRGR-UHFFFAOYSA-N -1 1 305.202 4.155 20 0 DIADMM CNc1ccc(Cl)cc1Nc1cc([O-])c(F)c(F)c1F ZINC001249964791 1060509290 /nfs/dbraw/zinc/50/92/90/1060509290.db2.gz MQBLOLFOHYCETK-UHFFFAOYSA-N -1 1 302.683 4.248 20 0 DIADMM Cc1nc2ccc(Nc3cc([O-])c(F)c(F)c3F)cc2s1 ZINC001249963423 1060509846 /nfs/dbraw/zinc/50/98/46/1060509846.db2.gz VVBWSFFMTJNOLF-UHFFFAOYSA-N -1 1 310.300 4.471 20 0 DIADMM [O-]c1cc(Nc2ccc(F)c3cccnc23)c(F)c(F)c1F ZINC001249964999 1060510231 /nfs/dbraw/zinc/51/02/31/1060510231.db2.gz QTXLTVDPZRTOGE-UHFFFAOYSA-N -1 1 308.234 4.240 20 0 DIADMM [O-]c1cc(Nc2cc3ocnc3cc2Cl)c(F)c(F)c1F ZINC001249965931 1060513618 /nfs/dbraw/zinc/51/36/18/1060513618.db2.gz SRHWULRRSOTYPW-UHFFFAOYSA-N -1 1 314.650 4.348 20 0 DIADMM CN1Cc2ccc(Nc3cc(Cl)c([O-])cc3Cl)cc2C1=O ZINC001249982553 1060519712 /nfs/dbraw/zinc/51/97/12/1060519712.db2.gz XOEHBWILKCIUKS-UHFFFAOYSA-N -1 1 323.179 4.028 20 0 DIADMM COC(=O)c1csc(C)c1Nc1cc(Cl)c([O-])cc1F ZINC001250019711 1060542912 /nfs/dbraw/zinc/54/29/12/1060542912.db2.gz BAMQYYSORXCFEI-UHFFFAOYSA-N -1 1 315.753 4.085 20 0 DIADMM [O-]c1cc(F)c(Nc2cnccc2Br)cc1Cl ZINC001250020376 1060543406 /nfs/dbraw/zinc/54/34/06/1060543406.db2.gz SJJKZLQJELNYSY-UHFFFAOYSA-N -1 1 317.545 4.086 20 0 DIADMM [O-]c1cc(F)c(Nc2cc(-c3ccncn3)cs2)cc1Cl ZINC001250019730 1060544543 /nfs/dbraw/zinc/54/45/43/1060544543.db2.gz CAABKBSZNMVCJF-UHFFFAOYSA-N -1 1 321.764 4.447 20 0 DIADMM CC(=O)c1ccnc(Cl)c1Nc1cc(Cl)c([O-])cc1F ZINC001250020327 1060544581 /nfs/dbraw/zinc/54/45/81/1060544581.db2.gz QCWFFVPCXBYYPA-UHFFFAOYSA-N -1 1 315.131 4.179 20 0 DIADMM [O-]c1cc(F)c(Nc2ccc(Br)nc2)cc1Cl ZINC001250020760 1060544845 /nfs/dbraw/zinc/54/48/45/1060544845.db2.gz QMDZWCGPFBCFFT-UHFFFAOYSA-N -1 1 317.545 4.086 20 0 DIADMM [O-]c1cc(F)c(Nc2ccnn2Cc2ccccc2)cc1Cl ZINC001250020744 1060545395 /nfs/dbraw/zinc/54/53/95/1060545395.db2.gz QBCYWUFKFFZLMJ-UHFFFAOYSA-N -1 1 317.751 4.173 20 0 DIADMM COc1cc(C)c(Nc2cc(Cl)c([O-])cc2F)cc1OC ZINC001250022625 1060545727 /nfs/dbraw/zinc/54/57/27/1060545727.db2.gz PWWXYVNDWZPDQB-UHFFFAOYSA-N -1 1 311.740 4.254 20 0 DIADMM [O-]c1cc(F)c(Nc2cnc(Br)s2)cc1Cl ZINC001250023117 1060545852 /nfs/dbraw/zinc/54/58/52/1060545852.db2.gz CXZPTYWTRFDUBU-UHFFFAOYSA-N -1 1 323.574 4.147 20 0 DIADMM [O-]c1cc(F)c(Nc2cnn(Cc3ccccc3)c2)cc1Cl ZINC001250021134 1060546145 /nfs/dbraw/zinc/54/61/45/1060546145.db2.gz YMXLLFYQYQYCNA-UHFFFAOYSA-N -1 1 317.751 4.173 20 0 DIADMM [O-]c1cc(F)c(Nc2ccc(OC(F)(F)F)nc2)cc1Cl ZINC001250023074 1060546409 /nfs/dbraw/zinc/54/64/09/1060546409.db2.gz BGDZZLQDVDMWDO-UHFFFAOYSA-N -1 1 322.645 4.222 20 0 DIADMM COc1cccc2ncc(Nc3cc(Cl)c([O-])cc3F)cc21 ZINC001250023263 1060547344 /nfs/dbraw/zinc/54/73/44/1060547344.db2.gz FZFKUCFJNHZQOR-UHFFFAOYSA-N -1 1 318.735 4.485 20 0 DIADMM [O-]c1cc(F)c(Nc2ccnn2-c2cccc(F)c2)cc1Cl ZINC001250023299 1060547476 /nfs/dbraw/zinc/54/74/76/1060547476.db2.gz HNLFFHQXVKDACE-UHFFFAOYSA-N -1 1 321.714 4.253 20 0 DIADMM Nc1cc(Cl)cc(F)c1Nc1cc(Cl)c([O-])cc1F ZINC001250026004 1060551868 /nfs/dbraw/zinc/55/18/68/1060551868.db2.gz KVSTVDKWUPRURY-UHFFFAOYSA-N -1 1 305.111 4.303 20 0 DIADMM CCC(=O)Nc1cccc(Nc2cc(Cl)c([O-])cc2F)c1 ZINC001250024060 1060552646 /nfs/dbraw/zinc/55/26/46/1060552646.db2.gz OVLIIRLEIDUMOB-UHFFFAOYSA-N -1 1 308.740 4.277 20 0 DIADMM COc1ccc(F)c(Nc2cc(Cl)c([O-])cc2F)c1F ZINC001250027422 1060554430 /nfs/dbraw/zinc/55/44/30/1060554430.db2.gz YCXJLUMTWXNVOK-UHFFFAOYSA-N -1 1 303.667 4.215 20 0 DIADMM COc1c(F)c(Cl)ccc1Nc1c([O-])cc(F)cc1F ZINC001250190778 1060668085 /nfs/dbraw/zinc/66/80/85/1060668085.db2.gz CIBFRZHCEPYBSO-UHFFFAOYSA-N -1 1 303.667 4.215 20 0 DIADMM [O-]c1ccc(F)c(Nc2nc(C(F)(F)F)cs2)c1Cl ZINC001250227899 1060705587 /nfs/dbraw/zinc/70/55/87/1060705587.db2.gz BOEISEHEYIYBGT-UHFFFAOYSA-N -1 1 312.675 4.404 20 0 DIADMM Nc1cc(F)c(Cl)cc1Nc1c(F)ccc([O-])c1Cl ZINC001250233122 1060713131 /nfs/dbraw/zinc/71/31/31/1060713131.db2.gz IQTLMJVWLOWAHA-UHFFFAOYSA-N -1 1 305.111 4.303 20 0 DIADMM [O-]c1ccc(F)c(Nc2ccc(C(F)(F)F)cn2)c1Cl ZINC001250227953 1060705953 /nfs/dbraw/zinc/70/59/53/1060705953.db2.gz DKFSWBDFHFDFCD-UHFFFAOYSA-N -1 1 306.646 4.342 20 0 DIADMM O=c1oc2ccccc2cc1Nc1c(F)ccc([O-])c1Cl ZINC001250228426 1060709609 /nfs/dbraw/zinc/70/96/09/1060709609.db2.gz APHWXAOHIWXDRH-UHFFFAOYSA-N -1 1 305.692 4.035 20 0 DIADMM [O-]c1ccc(F)c(Nc2c(Cl)cccc2CO)c1Cl ZINC001250232804 1060710409 /nfs/dbraw/zinc/71/04/09/1060710409.db2.gz FRZUWWLWIGQYFT-UHFFFAOYSA-N -1 1 302.132 4.074 20 0 DIADMM COc1cccc(C(C)=O)c1Nc1c(F)ccc([O-])c1Cl ZINC001250232657 1060711905 /nfs/dbraw/zinc/71/19/05/1060711905.db2.gz VHIQMFRVTAYXIL-UHFFFAOYSA-N -1 1 309.724 4.140 20 0 DIADMM COc1ccc2cc(Nc3c(F)ccc([O-])c3Cl)ccc2n1 ZINC001250232475 1060712070 /nfs/dbraw/zinc/71/20/70/1060712070.db2.gz NCAXSQUFGYDUSG-UHFFFAOYSA-N -1 1 318.735 4.485 20 0 DIADMM [O-]c1ccc(F)c(Nc2c(F)c(F)cc(F)c2F)c1Cl ZINC001250232829 1060712292 /nfs/dbraw/zinc/71/22/92/1060712292.db2.gz HGEKJDSRTQSNIN-UHFFFAOYSA-N -1 1 309.621 4.485 20 0 DIADMM [O-]c1ccc(F)c(Nc2cncc(N3CCCCC3)c2)c1Cl ZINC001250234269 1060713815 /nfs/dbraw/zinc/71/38/15/1060713815.db2.gz NVBPHFRCTHQJBB-UHFFFAOYSA-N -1 1 321.783 4.314 20 0 DIADMM [O-]c1ccc(F)c(Nc2cccc(-n3cccn3)c2)c1Cl ZINC001250233193 1060715323 /nfs/dbraw/zinc/71/53/23/1060715323.db2.gz JYBYZLRLEWOFRK-UHFFFAOYSA-N -1 1 303.724 4.114 20 0 DIADMM CC(=O)c1c(F)cc(F)cc1Nc1c(F)ccc([O-])c1Cl ZINC001250236459 1060717083 /nfs/dbraw/zinc/71/70/83/1060717083.db2.gz QQXZWHWAQLYHPR-UHFFFAOYSA-N -1 1 315.678 4.409 20 0 DIADMM COc1c(F)c(F)ccc1Nc1c(F)ccc([O-])c1Cl ZINC001250237657 1060718585 /nfs/dbraw/zinc/71/85/85/1060718585.db2.gz KYKCETHTBDEGDQ-UHFFFAOYSA-N -1 1 303.667 4.215 20 0 DIADMM COC(=O)/C=C/c1ccc(Nc2c(F)ccc([O-])c2Cl)cc1 ZINC001250237192 1060719294 /nfs/dbraw/zinc/71/92/94/1060719294.db2.gz FERZVVAKOOCRDV-RUDMXATFSA-N -1 1 321.735 4.115 20 0 DIADMM [O-]c1ccc(F)c(Nc2cc(CO)ccc2Cl)c1Cl ZINC001250236949 1060720208 /nfs/dbraw/zinc/72/02/08/1060720208.db2.gz YYQCAAPEIUNJLE-UHFFFAOYSA-N -1 1 302.132 4.074 20 0 DIADMM CSc1ncc(Cl)cc1C=C([O-])c1ccc(F)cc1F ZINC001250250636 1060731734 /nfs/dbraw/zinc/73/17/34/1060731734.db2.gz RMHJHKWAFJQQGU-UHFFFAOYSA-N -1 1 313.756 4.161 20 0 DIADMM CN(CCc1cccs1)Cc1cc([O-])c(Cl)c(F)c1F ZINC001250408485 1060795235 /nfs/dbraw/zinc/79/52/35/1060795235.db2.gz IAYVVRPSQXYZAQ-UHFFFAOYSA-N -1 1 317.788 4.060 20 0 DIADMM CC(C)n1c2ccccc2nc1NCc1ccc([O-])c(F)c1F ZINC001561058438 1060905219 /nfs/dbraw/zinc/90/52/19/1060905219.db2.gz QLPHDOQDFVYPLG-UHFFFAOYSA-N -1 1 317.339 4.213 20 0 DIADMM CC(C)CCCCCC[N-]S(=O)(=O)c1cc2ccccc2o1 ZINC001561092622 1060908671 /nfs/dbraw/zinc/90/86/71/1060908671.db2.gz RKCTXLUPARAGER-UHFFFAOYSA-N -1 1 323.458 4.318 20 0 DIADMM CCCC[C@@H]([N-]S(=O)(=O)c1cc2ccccc2o1)C1CCC1 ZINC001561381421 1060928721 /nfs/dbraw/zinc/92/87/21/1060928721.db2.gz CMKGBKGBQAKIQQ-OAHLLOKOSA-N -1 1 321.442 4.070 20 0 DIADMM [O-]c1c(F)cccc1-c1nc2cc(-c3ccncc3)ccc2[nH]1 ZINC001250684011 1061016151 /nfs/dbraw/zinc/01/61/51/1061016151.db2.gz WGEWHDWVURIPIR-UHFFFAOYSA-N -1 1 305.312 4.137 20 0 DIADMM C=Cc1ccc([N-]S(=O)(=O)c2ccc3ccccc3c2)cc1 ZINC001250721356 1061040345 /nfs/dbraw/zinc/04/03/45/1061040345.db2.gz KENDTJPRLVSMPK-UHFFFAOYSA-N -1 1 309.390 4.284 20 0 DIADMM CCCn1c2cc(F)ccc2nc1-c1ccc([O-])c(F)c1F ZINC001250915402 1061124489 /nfs/dbraw/zinc/12/44/89/1061124489.db2.gz ZSVSCHXMVYOQNO-UHFFFAOYSA-N -1 1 306.287 4.236 20 0 DIADMM CC(C)n1c2ccc(F)cc2nc1-c1ccc([O-])c(F)c1F ZINC001250915362 1061124954 /nfs/dbraw/zinc/12/49/54/1061124954.db2.gz WXZWLGULISTPMB-UHFFFAOYSA-N -1 1 306.287 4.407 20 0 DIADMM O=C([O-])c1ccc(-c2nc3ccc(-c4ccccc4)cc3[nH]2)o1 ZINC001250922092 1061126264 /nfs/dbraw/zinc/12/62/64/1061126264.db2.gz BVIINEKDGLXMMI-UHFFFAOYSA-N -1 1 304.305 4.188 20 0 DIADMM CCCn1c2cc(OC)ccc2nc1-c1cc(F)c(F)cc1[O-] ZINC001250967104 1061151163 /nfs/dbraw/zinc/15/11/63/1061151163.db2.gz IPLJSXZGPNECJK-UHFFFAOYSA-N -1 1 318.323 4.106 20 0 DIADMM CCCOc1ccc2nc(-c3cc(F)c(F)cc3[O-])n(C)c2c1 ZINC001250967659 1061152732 /nfs/dbraw/zinc/15/27/32/1061152732.db2.gz ZANWFZGRJBWJNW-UHFFFAOYSA-N -1 1 318.323 4.013 20 0 DIADMM Cc1cccc2nc(-c3c(F)cc([O-])cc3F)n(C3CC3)c21 ZINC001251007064 1061177908 /nfs/dbraw/zinc/17/79/08/1061177908.db2.gz CFNFSVRWHLHMNF-UHFFFAOYSA-N -1 1 300.308 4.330 20 0 DIADMM [O-]c1cc(F)c(-c2nc3c(cccc3C(F)(F)F)[nH]2)c(F)c1 ZINC001251007671 1061178622 /nfs/dbraw/zinc/17/86/22/1061178622.db2.gz OPYSDJNMAWWOPP-UHFFFAOYSA-N -1 1 314.213 4.233 20 0 DIADMM CC(C)(C)n1c2ccccc2nc1-c1c(F)cc([O-])cc1F ZINC001251008027 1061178950 /nfs/dbraw/zinc/17/89/50/1061178950.db2.gz YXPSNJKWBSURPA-UHFFFAOYSA-N -1 1 302.324 4.442 20 0 DIADMM [O-]c1cc(F)c(-c2nc3ccc(C(F)(F)F)cc3[nH]2)cc1F ZINC001251011107 1061181241 /nfs/dbraw/zinc/18/12/41/1061181241.db2.gz KCJCFFNLUUSTML-UHFFFAOYSA-N -1 1 314.213 4.233 20 0 DIADMM O=C([O-])c1ccc(F)c(-c2nc3ccc(C(F)(F)F)cc3[nH]2)c1 ZINC001251015156 1061183118 /nfs/dbraw/zinc/18/31/18/1061183118.db2.gz PDZYCQHZJWNNIF-UHFFFAOYSA-N -1 1 324.233 4.086 20 0 DIADMM Cc1ccc(-c2ccccc2)c([N-]S(=O)(=O)c2ccccc2)c1 ZINC001251152245 1061252130 /nfs/dbraw/zinc/25/21/30/1061252130.db2.gz ZLSCQXGDLUJNDT-UHFFFAOYSA-N -1 1 323.417 4.463 20 0 DIADMM CC(C)c1ccc(NC(=O)c2ccc3ccccc3c2[O-])cn1 ZINC001456085560 1061266669 /nfs/dbraw/zinc/26/66/69/1061266669.db2.gz GZSSZEREWSNDOR-UHFFFAOYSA-N -1 1 306.365 4.316 20 0 DIADMM [O-]c1cnc(Cl)cc1-c1nc2c(cccc2C(F)(F)F)[nH]1 ZINC001251251434 1061290482 /nfs/dbraw/zinc/29/04/82/1061290482.db2.gz FDYXABWCWGRGGT-UHFFFAOYSA-N -1 1 313.666 4.003 20 0 DIADMM CC(C)n1c2ccc(F)cc2nc1-c1cc(Cl)ncc1[O-] ZINC001251252317 1061291529 /nfs/dbraw/zinc/29/15/29/1061291529.db2.gz SYRIKYPNUGLYDF-UHFFFAOYSA-N -1 1 305.740 4.177 20 0 DIADMM [O-]c1cnc(Cl)cc1-c1nc2cc(Cl)ccc2n1C1CC1 ZINC001251252091 1061292928 /nfs/dbraw/zinc/29/29/28/1061292928.db2.gz OMWUBPRTJSJMGW-UHFFFAOYSA-N -1 1 320.179 4.446 20 0 DIADMM [O-]c1ccc(F)c(F)c1-c1nc2ccc(F)cc2n1C1CC1 ZINC001251322202 1061313701 /nfs/dbraw/zinc/31/37/01/1061313701.db2.gz PNOJCTCERQMXQW-UHFFFAOYSA-N -1 1 304.271 4.161 20 0 DIADMM COc1ccc2nc(-c3c(F)ccc([O-])c3F)n(C3CC3)c2c1 ZINC001251335497 1061320045 /nfs/dbraw/zinc/32/00/45/1061320045.db2.gz GWSJLRMTLHVANS-UHFFFAOYSA-N -1 1 316.307 4.031 20 0 DIADMM Cn1c2cc(F)ccc2nc1-c1cccc(C(F)(F)F)c1[O-] ZINC001251341050 1061325136 /nfs/dbraw/zinc/32/51/36/1061325136.db2.gz ITMOFXHGWMTATQ-UHFFFAOYSA-N -1 1 310.250 4.104 20 0 DIADMM Cc1ccc2nc(-c3cc(Br)cc(F)c3[O-])[nH]c2c1 ZINC001251389278 1061341364 /nfs/dbraw/zinc/34/13/64/1061341364.db2.gz FLIDOIIKNDOKBK-UHFFFAOYSA-N -1 1 321.149 4.146 20 0 DIADMM Cn1c(-c2cc(Cl)c(Cl)cc2[O-])nc2cccc(F)c21 ZINC001251491244 1061378557 /nfs/dbraw/zinc/37/85/57/1061378557.db2.gz JTAWRXFRPJEOQF-UHFFFAOYSA-N -1 1 311.143 4.392 20 0 DIADMM C=Cc1ccccc1[N-]S(=O)(=O)c1c(C)cc(C)cc1C ZINC001251497027 1061381732 /nfs/dbraw/zinc/38/17/32/1061381732.db2.gz SUMHQZTYJGGALC-UHFFFAOYSA-N -1 1 301.411 4.056 20 0 DIADMM C[C@H](NC(=O)c1c([O-])cccc1F)c1csc2ccccc21 ZINC001456947882 1061389896 /nfs/dbraw/zinc/38/98/96/1061389896.db2.gz ARLVWDDVRXJJRL-JTQLQIEISA-N -1 1 315.369 4.237 20 0 DIADMM CN(C)c1ccc2[nH]c(-c3c([O-])ccc(Cl)c3Cl)nc2c1 ZINC001251532078 1061391727 /nfs/dbraw/zinc/39/17/27/1061391727.db2.gz XJAZZTICNSNACT-UHFFFAOYSA-N -1 1 322.195 4.308 20 0 DIADMM O=C(c1ccccc1)c1ccc2[n-]c(C3OC=CC3=S)nc2c1 ZINC001251547093 1061401789 /nfs/dbraw/zinc/40/17/89/1061401789.db2.gz ZZTLOXNRFUDWLV-UHFFFAOYSA-N -1 1 320.373 4.343 20 0 DIADMM Cc1ccc2ccccc2c1[N-]S(=O)(=O)c1ccc(F)cc1 ZINC001251601074 1061413177 /nfs/dbraw/zinc/41/31/77/1061413177.db2.gz IVTFBRRRKPCBAW-UHFFFAOYSA-N -1 1 315.369 4.088 20 0 DIADMM CSc1ccc2nc(-c3cc(Cl)cc(F)c3[O-])[nH]c2c1 ZINC001251634892 1061427546 /nfs/dbraw/zinc/42/75/46/1061427546.db2.gz QNEZENVNYJDAGN-UHFFFAOYSA-N -1 1 308.765 4.450 20 0 DIADMM Cc1ccc([N-]S(=O)(=O)c2ccc(F)cc2)c2ccccc12 ZINC001251661542 1061434319 /nfs/dbraw/zinc/43/43/19/1061434319.db2.gz OERVSVUDNILKLQ-UHFFFAOYSA-N -1 1 315.369 4.088 20 0 DIADMM [O-]c1cc(Cl)c(F)cc1-c1nc2cc3c(cc2[nH]1)CCC3 ZINC001251681368 1061442440 /nfs/dbraw/zinc/44/24/40/1061442440.db2.gz WSXBFFIUGNRKRM-UHFFFAOYSA-N -1 1 302.736 4.217 20 0 DIADMM CCOc1cccc2[nH]c(-c3cc(F)c(Cl)cc3[O-])nc21 ZINC001251684817 1061442617 /nfs/dbraw/zinc/44/26/17/1061442617.db2.gz RGTHCLUHQPDJQZ-UHFFFAOYSA-N -1 1 306.724 4.127 20 0 DIADMM CC(C)c1ccc(C(=O)Nc2cccc3c2ccn3C)c([O-])c1 ZINC001546199253 1061472345 /nfs/dbraw/zinc/47/23/45/1061472345.db2.gz OWKPMTVRAUPAMI-UHFFFAOYSA-N -1 1 308.381 4.260 20 0 DIADMM CCC[C@@H]([N-]S(=O)(=O)c1cc2ccccc2o1)C1CCCC1 ZINC001463853389 1061526209 /nfs/dbraw/zinc/52/62/09/1061526209.db2.gz HWLCFKBPGSTWON-OAHLLOKOSA-N -1 1 321.442 4.070 20 0 DIADMM CC(C)[C@H](NC(=O)c1ccc(F)c([O-])c1)c1ccc(Cl)cc1 ZINC001463879873 1061530652 /nfs/dbraw/zinc/53/06/52/1061530652.db2.gz APNYWDILRNOIEJ-INIZCTEOSA-N -1 1 321.779 4.312 20 0 DIADMM O=c1nc(Cl)cc(Oc2ccc(Oc3ccccc3)cc2)[n-]1 ZINC001458060708 1061550902 /nfs/dbraw/zinc/55/09/02/1061550902.db2.gz CQHIWSYBXAJJHW-UHFFFAOYSA-N -1 1 314.728 4.420 20 0 DIADMM C[C@H](Cc1ccccc1Cl)NC(=O)c1cc(Cl)ccc1[O-] ZINC001464237348 1061567419 /nfs/dbraw/zinc/56/74/19/1061567419.db2.gz SWMIZHBFJUADIG-SNVBAGLBSA-N -1 1 324.207 4.060 20 0 DIADMM O=C(c1cccc([O-])c1F)N1CCC[C@@H]1c1cccc(Cl)c1 ZINC001464307725 1061575283 /nfs/dbraw/zinc/57/52/83/1061575283.db2.gz YHKCLAHTLCMAQB-CQSZACIVSA-N -1 1 319.763 4.162 20 0 DIADMM CCCN(CC1CCCCC1)C(=O)c1c([O-])cccc1Cl ZINC001464407592 1061589508 /nfs/dbraw/zinc/58/95/08/1061589508.db2.gz CBIHBZKUVPZUPR-UHFFFAOYSA-N -1 1 309.837 4.478 20 0 DIADMM Cc1ccc(S(=O)(=O)[N-]c2ccccc2-c2ccco2)cc1 ZINC001252197517 1061606385 /nfs/dbraw/zinc/60/63/85/1061606385.db2.gz DCMDWSMYWCWHOU-UHFFFAOYSA-N -1 1 313.378 4.056 20 0 DIADMM [O-]c1ccc(C(F)(F)F)cc1-c1nnc(-c2ccc(F)cc2)o1 ZINC001252260344 1061618323 /nfs/dbraw/zinc/61/83/23/1061618323.db2.gz MRHROTDGUIHMMZ-UHFFFAOYSA-N -1 1 324.233 4.267 20 0 DIADMM O=C(Nc1nc(/C=C\c2ccccc2)cs1)c1ccccc1[O-] ZINC001465081696 1061675033 /nfs/dbraw/zinc/67/50/33/1061675033.db2.gz OOFVWTTWWDJFJF-KHPPLWFESA-N -1 1 322.389 4.271 20 0 DIADMM CC(C)c1ccc(C(=O)Nc2cc(C3CCCC3)[nH]n2)c([O-])c1 ZINC001465369995 1061741188 /nfs/dbraw/zinc/74/11/88/1061741188.db2.gz HQHFPBMRZAWZIL-UHFFFAOYSA-N -1 1 313.401 4.149 20 0 DIADMM O=C(CC[C@@H]1CCc2ccccc21)Nc1ccc([O-])c(Cl)c1 ZINC001466225529 1061901987 /nfs/dbraw/zinc/90/19/87/1061901987.db2.gz IYQCRBADABIJIK-ZDUSSCGKSA-N -1 1 315.800 4.494 20 0 DIADMM [O-]c1ccc(C(F)(F)F)cc1-c1nnc(Cc2ccccc2)o1 ZINC001253589516 1061933465 /nfs/dbraw/zinc/93/34/65/1061933465.db2.gz SAHNQZNBFXHKNB-UHFFFAOYSA-N -1 1 320.270 4.052 20 0 DIADMM CC(C)[C@@H]1CCCCCN1C(=O)Cc1ccc([O-])c(Cl)c1 ZINC001466447296 1061942366 /nfs/dbraw/zinc/94/23/66/1061942366.db2.gz DBXCTTBYIOJFML-HNNXBMFYSA-N -1 1 309.837 4.015 20 0 DIADMM Cc1cccc(-c2nnc(-c3cc(C(F)(F)F)ccc3[O-])o2)c1 ZINC001253710220 1061956230 /nfs/dbraw/zinc/95/62/30/1061956230.db2.gz GKQIJCCOONPUBI-UHFFFAOYSA-N -1 1 320.270 4.436 20 0 DIADMM CCc1cc(=O)[n-]c(SCc2cccc(OC(C)(C)C)c2)n1 ZINC001459035393 1061984954 /nfs/dbraw/zinc/98/49/54/1061984954.db2.gz SGRBPRYALYMUBP-UHFFFAOYSA-N -1 1 318.442 4.214 20 0 DIADMM C[C@@H](NC(=O)c1ccc(Cl)cc1[O-])c1cc2ccccc2o1 ZINC001466896461 1062021015 /nfs/dbraw/zinc/02/10/15/1062021015.db2.gz CTBVVXBVFIIKFM-SNVBAGLBSA-N -1 1 315.756 4.283 20 0 DIADMM CC(C)(C)[C@@H]1CCC[C@H](NC(=O)c2ccc(F)c([O-])c2)CC1 ZINC001466943531 1062030149 /nfs/dbraw/zinc/03/01/49/1062030149.db2.gz GJAYNONVKZEZSG-KGLIPLIRSA-N -1 1 307.409 4.256 20 0 DIADMM [O-]c1c(-c2nnc(-c3cccc(F)c3)o2)ccc2ccccc21 ZINC001254140420 1062031173 /nfs/dbraw/zinc/03/11/73/1062031173.db2.gz LOOIGHGSNLPMNX-UHFFFAOYSA-N -1 1 306.296 4.402 20 0 DIADMM [O-]c1c2ccsc2ccc1-c1nnc(-c2cccc(F)c2)o1 ZINC001254150956 1062036137 /nfs/dbraw/zinc/03/61/37/1062036137.db2.gz UVHBTADDYYCFSH-UHFFFAOYSA-N -1 1 312.325 4.463 20 0 DIADMM CCOc1ccc(-c2nnc([C@H]3C[C@@H]3c3ccccc3)o2)c([O-])c1 ZINC001254513070 1062154322 /nfs/dbraw/zinc/15/43/22/1062154322.db2.gz MWNICIVYEHZQMG-CVEARBPZSA-N -1 1 322.364 4.112 20 0 DIADMM Cc1ccccc1S(=O)(=O)[N-]c1cccc(C(C)(C)C)c1 ZINC001254602025 1062195822 /nfs/dbraw/zinc/19/58/22/1062195822.db2.gz OEYKAXLIYDVEFD-UHFFFAOYSA-N -1 1 303.427 4.093 20 0 DIADMM COc1cccc([O-])c1-c1nnc(-c2ccc(C(C)C)cc2)o1 ZINC001254824457 1062257882 /nfs/dbraw/zinc/25/78/82/1062257882.db2.gz UNDZEXRXUVXJHT-UHFFFAOYSA-N -1 1 310.353 4.241 20 0 DIADMM C[C@@H](C1CCCCC1)N(C)C(=O)NCc1ccc([O-])c(Cl)c1 ZINC001254934689 1062284521 /nfs/dbraw/zinc/28/45/21/1062284521.db2.gz AFLRWOBKISNKRD-LBPRGKRZSA-N -1 1 324.852 4.156 20 0 DIADMM Cc1cc(C)c2c(c1)N(Cc1cccc([O-])c1Cl)CCO2 ZINC001474610478 1062324021 /nfs/dbraw/zinc/32/40/21/1062324021.db2.gz CFVOXAGBMPAYEG-UHFFFAOYSA-N -1 1 303.789 4.061 20 0 DIADMM C=Cc1ccccc1[N-]S(=O)(=O)c1ccc(C(C)C)cc1 ZINC001255335405 1062408079 /nfs/dbraw/zinc/40/80/79/1062408079.db2.gz GKQGVCJPYKZYSQ-UHFFFAOYSA-N -1 1 301.411 4.254 20 0 DIADMM CSc1cc(F)ccc1[N-]C(=O)c1nc2ccccc2s1 ZINC001469352292 1062532975 /nfs/dbraw/zinc/53/29/75/1062532975.db2.gz CHHLKRWQLKWHED-UHFFFAOYSA-N -1 1 318.398 4.410 20 0 DIADMM CN(C)c1cc(F)cc(NC(=O)c2ccc3ccccc3c2[O-])c1 ZINC001469775989 1062624789 /nfs/dbraw/zinc/62/47/89/1062624789.db2.gz OEHMLEZEYYCRLX-UHFFFAOYSA-N -1 1 324.355 4.003 20 0 DIADMM CCC(C)(C)CC(=O)Nc1cc(C)cc(Br)c1[O-] ZINC001546177252 1062661629 /nfs/dbraw/zinc/66/16/29/1062661629.db2.gz TYDLITLVPVKQPV-UHFFFAOYSA-N -1 1 314.223 4.228 20 0 DIADMM C[C@@H](c1nc(-c2ccc([O-])cc2F)no1)c1ccc(F)cc1F ZINC001255960631 1062673633 /nfs/dbraw/zinc/67/36/33/1062673633.db2.gz PPAOSARKKIVXGB-MRVPVSSYSA-N -1 1 320.270 4.011 20 0 DIADMM CC1(C(=O)Nc2ccc(Br)c([O-])c2)CCCCC1 ZINC001256446670 1062826927 /nfs/dbraw/zinc/82/69/27/1062826927.db2.gz HWCNWDWFQNSMGE-UHFFFAOYSA-N -1 1 312.207 4.064 20 0 DIADMM CCc1cc2c(CN(C)c3ccccc3C)cc(=O)oc2cc1[O-] ZINC001460497239 1062885872 /nfs/dbraw/zinc/88/58/72/1062885872.db2.gz UTDDQJIIZKZQFN-UHFFFAOYSA-N -1 1 323.392 4.006 20 0 DIADMM CC[C@H](CC(=O)Nc1cccc(F)c1[O-])c1ccc(C)cc1 ZINC001471167013 1062931131 /nfs/dbraw/zinc/93/11/31/1062931131.db2.gz WDPCRAAPIWANGI-CYBMUJFWSA-N -1 1 301.361 4.362 20 0 DIADMM Cc1cccc2c1[C@H](C)C[C@H]2CC(=O)Nc1cccc(F)c1[O-] ZINC001471168508 1062932673 /nfs/dbraw/zinc/93/26/73/1062932673.db2.gz QZULPUZKDQOPOU-OLZOCXBDSA-N -1 1 313.372 4.459 20 0 DIADMM C[C@H](CSCc1ccccc1)C(=O)Nc1cccc(F)c1[O-] ZINC001471166181 1062933574 /nfs/dbraw/zinc/93/35/74/1062933574.db2.gz BWGWRZRJZUSOOH-GFCCVEGCSA-N -1 1 319.401 4.039 20 0 DIADMM CC(C)[C@@H]1N(C(=O)c2cc(F)ccc2[O-])CC12CCCCCC2 ZINC001471199343 1062942443 /nfs/dbraw/zinc/94/24/43/1062942443.db2.gz VTXSOJPRQHATMR-KRWDZBQOSA-N -1 1 319.420 4.352 20 0 DIADMM CC(C)(C)c1ccc(C(=O)NCc2ccc([O-])c(Cl)c2)cc1 ZINC001471699605 1063014531 /nfs/dbraw/zinc/01/45/31/1063014531.db2.gz KSFRSZTZXITVCH-UHFFFAOYSA-N -1 1 317.816 4.273 20 0 DIADMM Cc1cc(Cl)c(C(=O)NCc2ccc([O-])c(Cl)c2)cc1C ZINC001471700105 1063014607 /nfs/dbraw/zinc/01/46/07/1063014607.db2.gz HJHYYCFXSHPBBP-UHFFFAOYSA-N -1 1 324.207 4.246 20 0 DIADMM C[C@@H]1CCCC[C@H]1CCNC(=O)NCc1ccc([O-])c(Cl)c1 ZINC001477900890 1063015277 /nfs/dbraw/zinc/01/52/77/1063015277.db2.gz XIWGWZWIVSZOQY-OCCSQVGLSA-N -1 1 324.852 4.061 20 0 DIADMM Cc1ccccc1Oc1cccc(NC(=O)c2ccc([O-])cn2)c1 ZINC001472167686 1063055534 /nfs/dbraw/zinc/05/55/34/1063055534.db2.gz AKYUSLKBULTFJU-UHFFFAOYSA-N -1 1 320.348 4.140 20 0 DIADMM CCc1ccc(Cl)cc1[N-]S(=O)(=O)c1cccc(C)c1 ZINC001256954352 1063059613 /nfs/dbraw/zinc/05/96/13/1063059613.db2.gz PYNANRHFFONMBF-UHFFFAOYSA-N -1 1 309.818 4.012 20 0 DIADMM Cc1cccc2c1[C@H](C)C[C@H]2CC(=O)Nc1ccc(F)cc1[O-] ZINC001472534329 1063097570 /nfs/dbraw/zinc/09/75/70/1063097570.db2.gz IWNJKOSXJUCJPV-OLZOCXBDSA-N -1 1 313.372 4.459 20 0 DIADMM COc1c(Cl)ccc([O-])c1-c1nnc(CC2CCCCC2)o1 ZINC001257073162 1063100130 /nfs/dbraw/zinc/10/01/30/1063100130.db2.gz SRALLVKFNDXFSI-UHFFFAOYSA-N -1 1 322.792 4.227 20 0 DIADMM CC(C)c1ccc(CCC(=O)Nc2nc(Cl)ccc2[O-])cc1 ZINC001472546864 1063100768 /nfs/dbraw/zinc/10/07/68/1063100768.db2.gz RXBITYDOBRDYCN-UHFFFAOYSA-N -1 1 318.804 4.135 20 0 DIADMM Cc1ccc([C@H]2C[C@@H]2c2nnc(-c3ccc([O-])c(F)c3)o2)cc1 ZINC001257323264 1063205248 /nfs/dbraw/zinc/20/52/48/1063205248.db2.gz GUPUUWAZBRRMLA-KGLIPLIRSA-N -1 1 310.328 4.161 20 0 DIADMM CC(C)(C)[C@H]1CCCN(C(=O)NCc2ccc([O-])c(Cl)c2)C1 ZINC001479211672 1063400075 /nfs/dbraw/zinc/40/00/75/1063400075.db2.gz OGNLPZLJFBQZFM-ZDUSSCGKSA-N -1 1 324.852 4.013 20 0 DIADMM Cn1c2ccc(Cl)cc2nc1NCc1cccc([O-])c1Cl ZINC001461822837 1063738101 /nfs/dbraw/zinc/73/81/01/1063738101.db2.gz OBPJBAWNASRYME-UHFFFAOYSA-N -1 1 322.195 4.198 20 0 DIADMM Cc1ccc(-c2nnc(Cc3ccc([O-])c(Cl)c3)o2)cc1F ZINC001258712485 1063768009 /nfs/dbraw/zinc/76/80/09/1063768009.db2.gz LDHBMLYJCGZYDK-UHFFFAOYSA-N -1 1 318.735 4.134 20 0 DIADMM CC[C@@H](Cc1ccccc1)Nc1c(C)c(=O)[n-]n1-c1ccccc1 ZINC001258843605 1063864051 /nfs/dbraw/zinc/86/40/51/1063864051.db2.gz GRIHQXGBVLYHAD-KRWDZBQOSA-N -1 1 321.424 4.320 20 0 DIADMM COc1ccc(C(=O)N(CC(C)C)c2ccc(C)cc2)c([O-])c1 ZINC001299550356 1063880933 /nfs/dbraw/zinc/88/09/33/1063880933.db2.gz KENPALGDVRVFEQ-UHFFFAOYSA-N -1 1 313.397 4.012 20 0 DIADMM Cc1ccc(S(=O)(=O)[N-]c2ccc3c(c2)N=NC3)cc1Cl ZINC001259136775 1063885645 /nfs/dbraw/zinc/88/56/45/1063885645.db2.gz QQXXTJINAZTRIU-UHFFFAOYSA-N -1 1 321.789 4.047 20 0 DIADMM Cc1ccccc1[C@@H](C)CC(=O)Nc1cc(F)cc(F)c1[O-] ZINC001299581458 1063887484 /nfs/dbraw/zinc/88/74/84/1063887484.db2.gz RCXALLMNQDFOKO-NSHDSACASA-N -1 1 305.324 4.111 20 0 DIADMM Cc1cc(C)cc(S(=O)(=O)[N-]c2c(C)cc(Cl)cc2C)c1 ZINC001259524353 1063888926 /nfs/dbraw/zinc/88/89/26/1063888926.db2.gz NUSAXSJMQLJOFB-UHFFFAOYSA-N -1 1 323.845 4.374 20 0 DIADMM O=C(Nc1cc(F)cc(F)c1[O-])c1ccccc1C1CCC1 ZINC001299585233 1063889028 /nfs/dbraw/zinc/88/90/28/1063889028.db2.gz ATKYSXAVXQOTKZ-UHFFFAOYSA-N -1 1 303.308 4.190 20 0 DIADMM Cc1ccc(S(=O)(=O)[N-]c2ccc3sccc3c2)cc1F ZINC001259480752 1063889087 /nfs/dbraw/zinc/88/90/87/1063889087.db2.gz PDTVJFXJDLBLIQ-UHFFFAOYSA-N -1 1 321.398 4.150 20 0 DIADMM CCc1cc(Cl)ccc1[N-]S(=O)(=O)c1cc(C)cc(C)c1 ZINC001259524205 1063889119 /nfs/dbraw/zinc/88/91/19/1063889119.db2.gz GFJDIPPSBMWJHV-UHFFFAOYSA-N -1 1 323.845 4.320 20 0 DIADMM Cc1ccc(S(=O)(=O)[N-]c2cccc3sccc32)cc1F ZINC001259480929 1063890033 /nfs/dbraw/zinc/89/00/33/1063890033.db2.gz VHGXBSSWOYONGX-UHFFFAOYSA-N -1 1 321.398 4.150 20 0 DIADMM Cc1cccc(S(=O)(=O)[N-]c2ccc(Cl)c(C)c2)c1C ZINC001260997598 1063909071 /nfs/dbraw/zinc/90/90/71/1063909071.db2.gz CDZXAAJINQYJBT-UHFFFAOYSA-N -1 1 309.818 4.066 20 0 DIADMM O=C(NC[C@H]1CCCCC1(F)F)c1cc2ccccc2cc1[O-] ZINC000391047887 1064179309 /nfs/dbraw/zinc/17/93/09/1064179309.db2.gz UBBLNYJARKBPCR-CQSZACIVSA-N -1 1 319.351 4.101 20 0 DIADMM O=C(Nc1ccc(Oc2ccccc2)cc1)c1ccc(O)cc1[O-] ZINC000392420193 1064231256 /nfs/dbraw/zinc/23/12/56/1064231256.db2.gz FSMGGRAXVRZLLV-UHFFFAOYSA-N -1 1 321.332 4.142 20 0 DIADMM CC(C)(F)c1cc([N-]C(=O)c2coc(C3CCCCC3)n2)no1 ZINC001289938957 1064672867 /nfs/dbraw/zinc/67/28/67/1064672867.db2.gz DJXRLFRVNIKNLB-UHFFFAOYSA-N -1 1 321.352 4.167 20 0 DIADMM O=C(Cc1ccc([O-])c(Cl)c1)N[C@@H]1CC[C@H]2CCCC[C@@H]2C1 ZINC001290366515 1064692691 /nfs/dbraw/zinc/69/26/91/1064692691.db2.gz MWTRZMIDHKHNMQ-RBSFLKMASA-N -1 1 321.848 4.063 20 0 DIADMM O=C(N[C@H](c1ccccc1)C1CCCC1)c1cccc([O-])c1F ZINC001292390383 1064772000 /nfs/dbraw/zinc/77/20/00/1064772000.db2.gz WKBTYWLZVSQKNX-GOSISDBHSA-N -1 1 313.372 4.193 20 0 DIADMM CCCCN(C(=O)c1ccc(C(F)(F)F)cc1[O-])[C@@H](C)CC ZINC001292902910 1064793045 /nfs/dbraw/zinc/79/30/45/1064793045.db2.gz DGFRZGWDRQWQEY-NSHDSACASA-N -1 1 317.351 4.452 20 0 DIADMM Cc1ccc([C@H]2C[C@@H](C)CCN2C(=O)c2cccc([O-])c2F)o1 ZINC001294078002 1064846864 /nfs/dbraw/zinc/84/68/64/1064846864.db2.gz ONGJYXRZMNTRPB-SMDDNHRTSA-N -1 1 317.360 4.046 20 0 DIADMM CCC(CC)(CNC(=O)c1ccc([O-])c(F)c1)c1ccccc1 ZINC001294152902 1064850437 /nfs/dbraw/zinc/85/04/37/1064850437.db2.gz TWKKGWJLFBBIBV-UHFFFAOYSA-N -1 1 315.388 4.019 20 0 DIADMM CC(C)C1CCC(CNC(=O)c2ccc(Cl)cc2[O-])CC1 ZINC001294735610 1064881794 /nfs/dbraw/zinc/88/17/94/1064881794.db2.gz LMDXWRJKTVMEPU-UHFFFAOYSA-N -1 1 309.837 4.238 20 0 DIADMM CC1(C)C[C@@H](NC(=O)c2c([O-])cccc2Cl)c2ccccc21 ZINC001294741976 1064881915 /nfs/dbraw/zinc/88/19/15/1064881915.db2.gz NFDJEVDWUPJHTE-CQSZACIVSA-N -1 1 315.800 4.198 20 0 DIADMM CCC1(CNC(=O)c2ncc3ccccc3c2[O-])CCCCC1 ZINC001296102309 1064938304 /nfs/dbraw/zinc/93/83/04/1064938304.db2.gz WDIFDEDWIVZFGW-UHFFFAOYSA-N -1 1 312.413 4.031 20 0 DIADMM CC/C=C(/F)C(=O)Nc1c([O-])cc(Br)cc1Cl ZINC001297577209 1064984703 /nfs/dbraw/zinc/98/47/03/1064984703.db2.gz VAUMKYCAGZWLSB-FPYGCLRLSA-N -1 1 322.561 4.010 20 0 DIADMM Cc1ccccc1CCN(C)C(=O)c1ccc2ccccc2c1[O-] ZINC001298511834 1065007225 /nfs/dbraw/zinc/00/72/25/1065007225.db2.gz FXERNGGJHPFGKW-UHFFFAOYSA-N -1 1 319.404 4.169 20 0 DIADMM O=C(Nc1ccc(C2CCC2)cn1)c1ccc2ccccc2c1[O-] ZINC001298702122 1065016196 /nfs/dbraw/zinc/01/61/96/1065016196.db2.gz BTWGMCDXJQILIJ-UHFFFAOYSA-N -1 1 318.376 4.460 20 0 DIADMM O=C(NCc1ccc2sccc2c1)c1cc(Cl)ccc1[O-] ZINC001298866962 1065023995 /nfs/dbraw/zinc/02/39/95/1065023995.db2.gz CBTZVWJDBCNIQG-UHFFFAOYSA-N -1 1 317.797 4.190 20 0 DIADMM Cc1c2cccc(C)c2oc1C(=O)Nc1cc([O-])c(F)cc1F ZINC001298975018 1065027449 /nfs/dbraw/zinc/02/74/49/1065027449.db2.gz SRYADMBZYLJIHT-UHFFFAOYSA-N -1 1 317.291 4.286 20 0 DIADMM Cc1[nH]ccc1C(=O)Nc1cc(Cl)c([O-])c2ccccc12 ZINC001301158224 1065053403 /nfs/dbraw/zinc/05/34/03/1065053403.db2.gz FORHRQYGOAEVIV-UHFFFAOYSA-N -1 1 300.745 4.088 20 0 DIADMM Cc1cccc2c1CCC[C@H]2NC(=O)c1c([O-])cccc1Cl ZINC001301381681 1065063203 /nfs/dbraw/zinc/06/32/03/1065063203.db2.gz ZCUWHWGDHJNQBV-OAHLLOKOSA-N -1 1 315.800 4.161 20 0 DIADMM C/C=C/C[C@@H]1CCCN(C(=O)c2cc3ccccc3cc2[O-])C1 ZINC001301885499 1065074500 /nfs/dbraw/zinc/07/45/00/1065074500.db2.gz YNHUERXPXVMUTD-XYBNCVKDSA-N -1 1 309.409 4.364 20 0 DIADMM CC(C)[C@@H]1C[C@H](NC(=O)c2cc(F)ccc2[O-])c2ccccc21 ZINC001302319262 1065084519 /nfs/dbraw/zinc/08/45/19/1065084519.db2.gz NIFHNOQELRNAAV-RDJZCZTQSA-N -1 1 313.372 4.146 20 0 DIADMM C/C(=C/c1ccc(Cl)cc1)C(=O)Nc1cccc(F)c1[O-] ZINC001302486627 1065090561 /nfs/dbraw/zinc/09/05/61/1065090561.db2.gz RJZYSSYIZVVQCI-KTKRTIGZSA-N -1 1 305.736 4.227 20 0 DIADMM CSc1ccc([O-])c(C(=O)Nc2ccc(O)c(C(C)C)c2)c1 ZINC001302993362 1065104284 /nfs/dbraw/zinc/10/42/84/1065104284.db2.gz KXSUHLRYTBRYAM-UHFFFAOYSA-N -1 1 317.410 4.195 20 0 DIADMM CCCc1cc(=O)[n-]c(S[C@H](C)c2cc(F)ccc2F)n1 ZINC001307252328 1065315155 /nfs/dbraw/zinc/31/51/55/1065315155.db2.gz DPQNYPXNJMTDLI-SECBINFHSA-N -1 1 310.369 4.266 20 0 DIADMM Cc1cnc(SCc2cc(Cl)cc(Cl)c2F)[n-]c1=O ZINC001307347106 1065351522 /nfs/dbraw/zinc/35/15/22/1065351522.db2.gz JPNFHEQMRZIYEL-UHFFFAOYSA-N -1 1 319.188 4.229 20 0 DIADMM CCc1nc(SCCCc2c(F)cccc2F)[n-]c(=O)c1C ZINC001307353927 1065353729 /nfs/dbraw/zinc/35/37/29/1065353729.db2.gz DLSGVRLOBJGBIP-UHFFFAOYSA-N -1 1 324.396 4.056 20 0 DIADMM CC[C@H]([N-]S(=O)(=O)c1sccc1Cl)C1CCCCC1 ZINC001309130232 1066444184 /nfs/dbraw/zinc/44/41/84/1066444184.db2.gz LERINCOWJISVAC-LBPRGKRZSA-N -1 1 321.895 4.039 20 0 DIADMM CCCC[C@H]1CCC[C@@H]1[N-]S(=O)(=O)c1sccc1Cl ZINC001309150886 1066444257 /nfs/dbraw/zinc/44/42/57/1066444257.db2.gz FSPHVKGXJCZDTN-JQWIXIFHSA-N -1 1 321.895 4.039 20 0 DIADMM CCCC[C@@H]1CCC[C@H]1[N-]S(=O)(=O)c1sccc1Cl ZINC001309150888 1066444340 /nfs/dbraw/zinc/44/43/40/1066444340.db2.gz FSPHVKGXJCZDTN-ZYHUDNBSSA-N -1 1 321.895 4.039 20 0 DIADMM C[C@H](NC(=O)NCc1ccc([O-])c(Cl)c1)[C@H]1CCC[C@H](C)C1 ZINC001312872105 1066875517 /nfs/dbraw/zinc/87/55/17/1066875517.db2.gz FIEVYYVMBZMBJT-OBJOEFQTSA-N -1 1 324.852 4.060 20 0 DIADMM CCN(C(=O)c1cc2ccccc2cc1[O-])[C@H](C)c1cccnc1 ZINC000115226135 331695532 /nfs/dbraw/zinc/69/55/32/331695532.db2.gz BCXGNOIXCWUJBM-CQSZACIVSA-N -1 1 320.392 4.164 20 0 DIADMM O=C(CC/C=C\c1ccccc1)Nc1ccc([O-])c(Cl)c1 ZINC000255418293 331739519 /nfs/dbraw/zinc/73/95/19/331739519.db2.gz AWDBKZPWRNBUMH-YWEYNIOJSA-N -1 1 301.773 4.478 20 0 DIADMM O=C(Nc1ccc([O-])c(Cl)c1)[C@@H]1C[C@@H]1c1ccccc1Cl ZINC000558325198 331896846 /nfs/dbraw/zinc/89/68/46/331896846.db2.gz BZZZQNUPYWNJOG-VXGBXAGGSA-N -1 1 322.191 4.441 20 0 DIADMM CCc1ccc(NC(=O)c2c(F)ccc([O-])c2F)cc1CC ZINC000558421431 331905309 /nfs/dbraw/zinc/90/53/09/331905309.db2.gz CSURBGXZWVQUAP-UHFFFAOYSA-N -1 1 305.324 4.048 20 0 DIADMM Cc1ccc([C@H](CC(=O)[O-])NCc2ccc(CC(C)C)cc2)o1 ZINC000426796100 332154474 /nfs/dbraw/zinc/15/44/74/332154474.db2.gz ZVVGHWJMKNABQD-KRWDZBQOSA-N -1 1 315.413 4.092 20 0 DIADMM Cc1ccccc1S(=O)(=O)[N-]c1ccc(Cl)c(Cl)c1 ZINC000112333392 332313017 /nfs/dbraw/zinc/31/30/17/332313017.db2.gz DBFPZNLUKICTGO-UHFFFAOYSA-N -1 1 316.209 4.103 20 0 DIADMM O=c1cc(C(F)F)nc(SCc2ccccc2Cl)[n-]1 ZINC000583350806 332345982 /nfs/dbraw/zinc/34/59/82/332345982.db2.gz SVZXUMBKGWIRDX-UHFFFAOYSA-N -1 1 302.733 4.066 20 0 DIADMM CC(C)[C@H](C)C(=O)Nc1c([O-])cc(Br)cc1Cl ZINC000560505442 332347647 /nfs/dbraw/zinc/34/76/47/332347647.db2.gz NFZLQLTUMGHQKP-ZETCQYMHSA-N -1 1 320.614 4.039 20 0 DIADMM CSc1cccc([N-]S(=O)(=O)c2cccc(C(C)C)c2)c1 ZINC000460428832 333084973 /nfs/dbraw/zinc/08/49/73/333084973.db2.gz SNDXNILWIUXZDW-UHFFFAOYSA-N -1 1 321.467 4.333 20 0 DIADMM CC[C@@H](C)c1ccc(S(=O)(=O)[N-]c2c(C)ccnc2C)cc1 ZINC000460545866 333102901 /nfs/dbraw/zinc/10/29/01/333102901.db2.gz BBBLWUBAOHMIAL-GFCCVEGCSA-N -1 1 318.442 4.013 20 0 DIADMM [O-]c1ccc(F)cc1-c1nc(CSc2ccc(F)cc2)no1 ZINC000388724782 333169532 /nfs/dbraw/zinc/16/95/32/333169532.db2.gz AUMWEJARFBVLND-UHFFFAOYSA-N -1 1 320.320 4.013 20 0 DIADMM O=C(c1ccc2ccccc2c1[O-])N1CCC[C@@H]2CCCC[C@@H]21 ZINC000319524891 333312386 /nfs/dbraw/zinc/31/23/86/333312386.db2.gz KFDFTNIESJRNEG-YJBOKZPZSA-N -1 1 309.409 4.340 20 0 DIADMM Cc1nc(-c2ccc(N[C@@H](C)CC(C)(C)C)nc2)[n-]c(=O)c1C ZINC000413359151 333844632 /nfs/dbraw/zinc/84/46/32/333844632.db2.gz XPCVTCISOJFLNZ-NSHDSACASA-N -1 1 314.433 4.098 20 0 DIADMM [O-]c1ccc(-c2noc(/C(F)=C\C3CCCCC3)n2)cc1F ZINC000436522309 333973636 /nfs/dbraw/zinc/97/36/36/333973636.db2.gz TYHGYDXPBUNYKY-MDWZMJQESA-N -1 1 306.312 4.472 20 0 DIADMM O=C(CCc1c[nH]c2ccccc12)Nc1ccc([O-])c(Cl)c1 ZINC000111667462 334352946 /nfs/dbraw/zinc/35/29/46/334352946.db2.gz RRANPPYRHZWEJZ-UHFFFAOYSA-N -1 1 314.772 4.098 20 0 DIADMM O=C(Nc1ccc(F)cc1[O-])c1ccc(-c2ccc(F)cc2)o1 ZINC000532012333 334371636 /nfs/dbraw/zinc/37/16/36/334371636.db2.gz LRZJMSBNXNSFNH-UHFFFAOYSA-N -1 1 315.275 4.183 20 0 DIADMM CC(=O)c1cc(F)c([N-]C(=O)c2sccc2Cl)c(F)c1 ZINC000342717417 334568301 /nfs/dbraw/zinc/56/83/01/334568301.db2.gz QNRICCCSEVQGJL-UHFFFAOYSA-N -1 1 315.728 4.135 20 0 DIADMM CSc1ccccc1S(=O)(=O)[N-]c1ccccc1C(C)C ZINC000188250951 334670808 /nfs/dbraw/zinc/67/08/08/334670808.db2.gz FVEFHBYEBFZGQO-UHFFFAOYSA-N -1 1 321.467 4.333 20 0 DIADMM CCSc1cccc(-c2nc(-c3ccc([O-])c(F)c3)no2)c1 ZINC000445479100 338496308 /nfs/dbraw/zinc/49/63/08/338496308.db2.gz IWJPVDOWGZCONQ-UHFFFAOYSA-N -1 1 316.357 4.360 20 0 DIADMM CC(C)(c1nc(-c2ccc([O-])c(F)c2)no1)c1ccc(F)cc1 ZINC000445480400 338496369 /nfs/dbraw/zinc/49/63/69/338496369.db2.gz KBQIPRFYPCKHSL-UHFFFAOYSA-N -1 1 316.307 4.046 20 0 DIADMM CCC(CC)c1cc(-c2nc(-c3ccc([O-])c(F)c3)no2)on1 ZINC000445482139 338496528 /nfs/dbraw/zinc/49/65/28/338496528.db2.gz RFTPSLVVZIXLKX-UHFFFAOYSA-N -1 1 317.320 4.140 20 0 DIADMM CCC[C@H](C)S(=O)(=O)[N-]c1sc(-c2ccccc2)nc1C ZINC000519534373 335872634 /nfs/dbraw/zinc/87/26/34/335872634.db2.gz BYCCZPJHNBNYNH-NSHDSACASA-N -1 1 324.471 4.049 20 0 DIADMM Cc1noc(-c2ccccc2)c1[N-]C(=O)c1ccoc1Cl ZINC000192355422 336029849 /nfs/dbraw/zinc/02/98/49/336029849.db2.gz VQJILFLZYKLLQS-UHFFFAOYSA-N -1 1 302.717 4.149 20 0 DIADMM C[C@@H]1CN(Cc2cccc([O-])c2Cl)C[C@@H](c2ccsc2)O1 ZINC000351686348 336057703 /nfs/dbraw/zinc/05/77/03/336057703.db2.gz QSNSDIHPZXDNFL-ABAIWWIYSA-N -1 1 323.845 4.069 20 0 DIADMM O=c1nc(-c2ccc(-c3ccccc3)cc2)[n-]c2ccsc21 ZINC000520749014 336078727 /nfs/dbraw/zinc/07/87/27/336078727.db2.gz QTUYHQDJJINHND-UHFFFAOYSA-N -1 1 304.374 4.319 20 0 DIADMM O=C(Nc1ccc([O-])c(Cl)c1)[C@@H]1C[C@@H]1c1c(F)cccc1F ZINC000116469385 336251039 /nfs/dbraw/zinc/25/10/39/336251039.db2.gz PEEBZIFGKOHPGX-VHSXEESVSA-N -1 1 323.726 4.066 20 0 DIADMM CCSCc1ccc(C(=O)Nc2ccc(F)cc2[O-])cc1 ZINC000532622104 336257156 /nfs/dbraw/zinc/25/71/56/336257156.db2.gz AVWPKNMAIPSVQC-UHFFFAOYSA-N -1 1 305.374 4.037 20 0 DIADMM C[C@@H](CSc1ccc(F)cc1)C(=O)Nc1ccc(F)cc1[O-] ZINC000532863695 336273381 /nfs/dbraw/zinc/27/33/81/336273381.db2.gz ANWTYTLDTSQUNZ-JTQLQIEISA-N -1 1 323.364 4.037 20 0 DIADMM O=C(c1ccc2ccccc2c1[O-])N(Cc1cccs1)C1CC1 ZINC000321152681 337201244 /nfs/dbraw/zinc/20/12/44/337201244.db2.gz PCANPEJIGOWKOY-UHFFFAOYSA-N -1 1 323.417 4.412 20 0 DIADMM CCOc1cc(-c2noc([C@H]3C[C@H]3C3CC3)n2)cc(Cl)c1[O-] ZINC000583122914 337244256 /nfs/dbraw/zinc/24/42/56/337244256.db2.gz NPHRCFNDKSYJJN-QWRGUYRKSA-N -1 1 320.776 4.008 20 0 DIADMM CCc1cc(=O)[n-]c(SCc2cccc(Cl)c2Cl)n1 ZINC000446073952 338520039 /nfs/dbraw/zinc/52/00/39/338520039.db2.gz VCLCBOKGVBWQFL-UHFFFAOYSA-N -1 1 315.225 4.344 20 0 DIADMM O=C([O-])c1ccc(CN2CCC[C@@H]2c2cccs2)cc1Cl ZINC000583877399 337369075 /nfs/dbraw/zinc/36/90/75/337369075.db2.gz IOSRSSRAFGHCOM-CQSZACIVSA-N -1 1 321.829 4.437 20 0 DIADMM C/C=C/C=C/c1nc(-c2cc(Cl)c([O-])c(OCC)c2)no1 ZINC000445407205 337671298 /nfs/dbraw/zinc/67/12/98/337671298.db2.gz MGZLUYFREFOZPB-TWTPFVCWSA-N -1 1 306.749 4.084 20 0 DIADMM CCOc1cc(-c2noc(C3(C)CCCC3)n2)cc(Cl)c1[O-] ZINC000445408109 337673491 /nfs/dbraw/zinc/67/34/91/337673491.db2.gz ZNRGZDIYTQYEAF-UHFFFAOYSA-N -1 1 322.792 4.326 20 0 DIADMM Cc1ccccc1C1CC([N@H+](Cc2ncccc2[O-])C2CC2)C1 ZINC000516347440 338010365 /nfs/dbraw/zinc/01/03/65/338010365.db2.gz WDGMJSYERKQHHU-UHFFFAOYSA-N -1 1 308.425 4.006 20 0 DIADMM CC(C)CCO[C@H](C)c1nc(-c2ccc([O-])cc2Cl)no1 ZINC000445450758 338015475 /nfs/dbraw/zinc/01/54/75/338015475.db2.gz WDUUOSIOIMVFSH-SNVBAGLBSA-N -1 1 310.781 4.219 20 0 DIADMM [O-]c1ccc(-c2noc(CSc3ccc(F)cc3)n2)c(F)c1 ZINC000445456939 338017536 /nfs/dbraw/zinc/01/75/36/338017536.db2.gz WPPXGKKCITWPPA-UHFFFAOYSA-N -1 1 320.320 4.013 20 0 DIADMM [O-]c1ccc(-c2noc(-c3cccn3C3CCCC3)n2)c(F)c1 ZINC000445456803 338017544 /nfs/dbraw/zinc/01/75/44/338017544.db2.gz KJNVPXAZBCTRDA-UHFFFAOYSA-N -1 1 313.332 4.165 20 0 DIADMM [O-]c1ccc(-c2noc(-c3cccc(C(F)(F)F)c3)n2)c(F)c1 ZINC000445457297 338018301 /nfs/dbraw/zinc/01/83/01/338018301.db2.gz MPKIFNHPKXMGBU-UHFFFAOYSA-N -1 1 324.233 4.267 20 0 DIADMM [O-]c1ccc(-c2noc(-c3ccc(F)cc3Cl)n2)c(F)c1 ZINC000445460687 338020739 /nfs/dbraw/zinc/02/07/39/338020739.db2.gz CCULKBYGAYIULE-UHFFFAOYSA-N -1 1 308.671 4.041 20 0 DIADMM [O-]c1ccc(-c2noc(-c3cccc(C(F)F)c3)n2)c(F)c1 ZINC000445462363 338025848 /nfs/dbraw/zinc/02/58/48/338025848.db2.gz KTMQQGXJABAWEP-UHFFFAOYSA-N -1 1 306.243 4.186 20 0 DIADMM CC(C)(C)c1ncc(-c2nc(-c3ccc([O-])cc3F)no2)s1 ZINC000445462805 338028148 /nfs/dbraw/zinc/02/81/48/338028148.db2.gz MVFNTNCFPFWZQF-UHFFFAOYSA-N -1 1 319.361 4.002 20 0 DIADMM [O-]c1ccc(-c2noc(CC/C=C\c3ccccc3)n2)c(F)c1 ZINC000445462929 338028939 /nfs/dbraw/zinc/02/89/39/338028939.db2.gz MQCLNRFDGPRVPW-YWEYNIOJSA-N -1 1 310.328 4.227 20 0 DIADMM Cc1ccc([C@H](NCc2cc3ccccc3s2)C(=O)[O-])cc1 ZINC000426702143 338038600 /nfs/dbraw/zinc/03/86/00/338038600.db2.gz DYJNZQSIMBEMNA-KRWDZBQOSA-N -1 1 311.406 4.125 20 0 DIADMM Cc1ccc([C@H](NCc2cc(Cl)ccc2Cl)C(=O)[O-])cc1 ZINC000426708680 338038749 /nfs/dbraw/zinc/03/87/49/338038749.db2.gz LWXIYWSCQNHHLM-HNNXBMFYSA-N -1 1 324.207 4.217 20 0 DIADMM Cc1ccc(-c2cccc(CNCc3cc(C(=O)[O-])co3)c2)cc1 ZINC000426715227 338038999 /nfs/dbraw/zinc/03/89/99/338038999.db2.gz QFNXBYHPRLTAIH-UHFFFAOYSA-N -1 1 321.376 4.243 20 0 DIADMM Cc1cccc([C@H](NCc2cc(Cl)ccc2F)C(=O)[O-])c1C ZINC000426724090 338039347 /nfs/dbraw/zinc/03/93/47/338039347.db2.gz PEVOJACTUUARHJ-INIZCTEOSA-N -1 1 321.779 4.011 20 0 DIADMM Cc1cc(C)cc([C@@H](NCc2ccc(Cl)cc2F)C(=O)[O-])c1 ZINC000426744228 338040413 /nfs/dbraw/zinc/04/04/13/338040413.db2.gz CGRGNSJRGCDAHR-MRXNPFEDSA-N -1 1 321.779 4.011 20 0 DIADMM CC(C)(C)CC[C@@H](NCc1ccc(-c2ccccc2)o1)C(=O)[O-] ZINC000426747267 338040548 /nfs/dbraw/zinc/04/05/48/338040548.db2.gz OAWQWKVWHTUKPI-MRXNPFEDSA-N -1 1 315.413 4.316 20 0 DIADMM Cc1cc(C)cc([C@H](NCc2cc(Cl)ccc2F)C(=O)[O-])c1 ZINC000426751311 338040594 /nfs/dbraw/zinc/04/05/94/338040594.db2.gz UXHSTTBMUPBRTH-INIZCTEOSA-N -1 1 321.779 4.011 20 0 DIADMM C[C@H](C(=O)[O-])[C@@H](NCc1cccc(Cl)c1F)c1ccccc1 ZINC000426754908 338040960 /nfs/dbraw/zinc/04/09/60/338040960.db2.gz VAXVLVYISPCPNY-MEDUHNTESA-N -1 1 321.779 4.031 20 0 DIADMM CC(C)c1ccccc1S(=O)(=O)[N-]c1ccc2cc[nH]c2c1 ZINC000432641383 338161491 /nfs/dbraw/zinc/16/14/91/338161491.db2.gz JAFTVKDRRLZTPI-UHFFFAOYSA-N -1 1 314.410 4.092 20 0 DIADMM COc1cc(NC(=O)Nc2ccc([O-])c(Cl)c2)c(C)cc1C ZINC000434895668 338227006 /nfs/dbraw/zinc/22/70/06/338227006.db2.gz LKSHJMRIKRPONN-UHFFFAOYSA-N -1 1 320.776 4.315 20 0 DIADMM CCc1cc(=O)[n-]c(SCCc2ccc3ccccc3c2)n1 ZINC000436212597 338262090 /nfs/dbraw/zinc/26/20/90/338262090.db2.gz VQSBQSZYSIIBPQ-UHFFFAOYSA-N -1 1 310.422 4.233 20 0 DIADMM C=Cc1ccc(S(=O)(=O)[N-]c2cc(Cl)ccc2C)cc1 ZINC000436479292 338273660 /nfs/dbraw/zinc/27/36/60/338273660.db2.gz QCMADVSLJFKVSJ-UHFFFAOYSA-N -1 1 307.802 4.092 20 0 DIADMM C=Cc1ccc(S(=O)(=O)[N-]c2ccc3occ(C)c3c2)cc1 ZINC000436477386 338273709 /nfs/dbraw/zinc/27/37/09/338273709.db2.gz MNGIPKGZKAPYQA-UHFFFAOYSA-N -1 1 313.378 4.185 20 0 DIADMM CO[C@@H](C)c1cccc(NC(=O)c2ccc(C(C)C)cc2[O-])c1 ZINC000436509384 338274503 /nfs/dbraw/zinc/27/45/03/338274503.db2.gz BGTXIGAYMXJPMV-ZDUSSCGKSA-N -1 1 313.397 4.475 20 0 DIADMM Cc1nc2ccc(NC(=O)c3ccc4ccccc4c3[O-])cc2o1 ZINC000436514793 338274581 /nfs/dbraw/zinc/27/45/81/338274581.db2.gz PTWHEMGODBLIOD-UHFFFAOYSA-N -1 1 318.332 4.247 20 0 DIADMM [O-]c1ccc(-c2noc(/C(F)=C/C3CCCCC3)n2)cc1F ZINC000436522308 338275084 /nfs/dbraw/zinc/27/50/84/338275084.db2.gz TYHGYDXPBUNYKY-JYRVWZFOSA-N -1 1 306.312 4.472 20 0 DIADMM Cc1ccc([C@@H]2CCCCCN2C(=O)c2cc(F)ccc2[O-])o1 ZINC000436526343 338275145 /nfs/dbraw/zinc/27/51/45/338275145.db2.gz DFVFLQQCWQLAJP-HNNXBMFYSA-N -1 1 317.360 4.190 20 0 DIADMM C[C@@H]1C[C@@H]2CCCC[C@@H]2N1C(=O)c1cc2ccccc2cc1[O-] ZINC000436550016 338276747 /nfs/dbraw/zinc/27/67/47/338276747.db2.gz HLLGPUWLASYOLM-SKDZVZGDSA-N -1 1 309.409 4.339 20 0 DIADMM O=C(c1cc2ccccc2cc1[O-])N1CCc2cc(Cl)ccc21 ZINC000436555291 338276823 /nfs/dbraw/zinc/27/68/23/338276823.db2.gz LKMSQBPSEOBZDP-UHFFFAOYSA-N -1 1 323.779 4.402 20 0 DIADMM O=C(c1cc2ccccc2cc1[O-])N1CCCc2cc(F)ccc21 ZINC000436561760 338277004 /nfs/dbraw/zinc/27/70/04/338277004.db2.gz HQKGJWCYODUKEJ-UHFFFAOYSA-N -1 1 321.351 4.278 20 0 DIADMM [O-]c1ccc(F)cc1-c1nc(-c2cccc(Cl)c2F)no1 ZINC000436564687 338277344 /nfs/dbraw/zinc/27/73/44/338277344.db2.gz RERVHVPUKUTHIR-UHFFFAOYSA-N -1 1 308.671 4.041 20 0 DIADMM C[C@H]1CN(C(=O)c2cc3ccccc3cc2[O-])[C@H]1c1ccccc1 ZINC000436574041 338277773 /nfs/dbraw/zinc/27/77/73/338277773.db2.gz KVUCEZOHTNUXKV-VBKZILBWSA-N -1 1 317.388 4.379 20 0 DIADMM C[C@H]1c2ccccc2CN1C(=O)c1cc2ccccc2cc1[O-] ZINC000436582328 338278393 /nfs/dbraw/zinc/27/83/93/338278393.db2.gz HGYOGKCKWJUEMJ-ZDUSSCGKSA-N -1 1 303.361 4.262 20 0 DIADMM C[C@@H]1[C@@H](c2ccccc2)CCN1C(=O)c1ccc(Cl)cc1[O-] ZINC000436588018 338278545 /nfs/dbraw/zinc/27/85/45/338278545.db2.gz RCLQHVYPHQSFLS-DOMZBBRYSA-N -1 1 315.800 4.064 20 0 DIADMM CCCC[C@H](C)N(C)C(=O)c1ccc(C(F)(F)F)cc1[O-] ZINC000436623336 338280278 /nfs/dbraw/zinc/28/02/78/338280278.db2.gz YTOIHABHRKJWLT-JTQLQIEISA-N -1 1 303.324 4.062 20 0 DIADMM CCC[C@@H]1C[C@H]1c1nc(-c2cc(Cl)c([O-])c(OCC)c2)no1 ZINC000436659320 338282058 /nfs/dbraw/zinc/28/20/58/338282058.db2.gz ZXFADFXYWCMXFO-MWLCHTKSSA-N -1 1 322.792 4.398 20 0 DIADMM C[C@H]1CC[C@@]2(CCN(C(=O)c3ccc4ccccc4c3[O-])C2)C1 ZINC000436702091 338283286 /nfs/dbraw/zinc/28/32/86/338283286.db2.gz CYMOPIQTADSLQJ-VBKZILBWSA-N -1 1 309.409 4.198 20 0 DIADMM O=C(c1ccc2ccccc2c1[O-])N1CC(C2CCCCC2)C1 ZINC000436730857 338284492 /nfs/dbraw/zinc/28/44/92/338284492.db2.gz YOVBZHHKLUGNNR-UHFFFAOYSA-N -1 1 309.409 4.198 20 0 DIADMM C[C@@H]1CCN(C(=O)c2ccc(Cl)cc2[O-])[C@H](c2ccco2)C1 ZINC000436728282 338284540 /nfs/dbraw/zinc/28/45/40/338284540.db2.gz JQVUIKZYJPLEIZ-RISCZKNCSA-N -1 1 319.788 4.252 20 0 DIADMM O=C(Nc1cccc2[nH]ccc21)c1ccc2ccccc2c1[O-] ZINC000436737390 338284875 /nfs/dbraw/zinc/28/48/75/338284875.db2.gz QLMUKDUIQOKLAY-UHFFFAOYSA-N -1 1 302.333 4.279 20 0 DIADMM Cc1cscc1NC(=O)c1ccc(C(F)(F)F)cc1[O-] ZINC000436764948 338286284 /nfs/dbraw/zinc/28/62/84/338286284.db2.gz VOWPVCHTDDPBDW-UHFFFAOYSA-N -1 1 301.289 4.033 20 0 DIADMM CC(C)(C)[C@@H]1CCCN1C(=O)c1ccc(C(F)(F)F)cc1[O-] ZINC000436803984 338287969 /nfs/dbraw/zinc/28/79/69/338287969.db2.gz ABMBOQWPMJCLDH-ZDUSSCGKSA-N -1 1 315.335 4.062 20 0 DIADMM CCCC[C@@H](C)N(C)C(=O)c1cc(Cl)c([O-])c(OCC)c1 ZINC000436819293 338288429 /nfs/dbraw/zinc/28/84/29/338288429.db2.gz HSKSLPOKPXQSAB-LLVKDONJSA-N -1 1 313.825 4.095 20 0 DIADMM CC(C)[C@@H]1N(C(=O)c2ccc3ccccc3c2[O-])CC12CCC2 ZINC000436824545 338288843 /nfs/dbraw/zinc/28/88/43/338288843.db2.gz BUSYBOLPZNJRRN-SFHVURJKSA-N -1 1 309.409 4.196 20 0 DIADMM O=C(c1cc(Cl)ccc1[O-])N1CCC[C@H](c2ccccc2)C1 ZINC000436852159 338289920 /nfs/dbraw/zinc/28/99/20/338289920.db2.gz NXCXBPAASXRMAW-AWEZNQCLSA-N -1 1 315.800 4.065 20 0 DIADMM CSc1ccccc1CN(C)C(=O)c1ccc(Cl)cc1[O-] ZINC000436856379 338290000 /nfs/dbraw/zinc/29/00/00/338290000.db2.gz ZTISTDKSMUBOGJ-UHFFFAOYSA-N -1 1 321.829 4.040 20 0 DIADMM O=C(c1ccc(Cl)cc1[O-])N1CCC[C@@H](c2ccccc2)C1 ZINC000436853809 338290091 /nfs/dbraw/zinc/29/00/91/338290091.db2.gz SQJBZBRMNHWUCW-CQSZACIVSA-N -1 1 315.800 4.065 20 0 DIADMM CC1(C)CC[C@@H](NC(=O)c2ccc([O-])cc2F)c2ccccc21 ZINC000436868880 338290565 /nfs/dbraw/zinc/29/05/65/338290565.db2.gz IUSVQINTSJNLDP-QGZVFWFLSA-N -1 1 313.372 4.074 20 0 DIADMM CC(C)c1ccoc1-c1nc(-c2ccc([O-])cc2Cl)no1 ZINC000436870217 338290807 /nfs/dbraw/zinc/29/08/07/338290807.db2.gz GYFPOTGGEBPWPN-UHFFFAOYSA-N -1 1 304.733 4.479 20 0 DIADMM [O-]c1ccc(-c2noc([C@H](F)c3ccccc3)n2)c(Cl)c1 ZINC000436869948 338290832 /nfs/dbraw/zinc/29/08/32/338290832.db2.gz FWKSSBSBDZFFQB-CYBMUJFWSA-N -1 1 304.708 4.155 20 0 DIADMM [O-]c1ccc(-c2noc(/C=C/c3ccc(F)c(F)c3)n2)cc1F ZINC000436874447 338291107 /nfs/dbraw/zinc/29/11/07/338291107.db2.gz QNDNZEXUHRXPCQ-QHHAFSJGSA-N -1 1 318.254 4.030 20 0 DIADMM Cc1oc2ccccc2c1-c1nc(-c2ccc([O-])cc2F)no1 ZINC000436878653 338291531 /nfs/dbraw/zinc/29/15/31/338291531.db2.gz KZQYGOALQQSWQX-UHFFFAOYSA-N -1 1 310.284 4.303 20 0 DIADMM COc1cccc([C@@H](C)NC(=O)c2cc3ccccc3cc2[O-])c1 ZINC000436885718 338291835 /nfs/dbraw/zinc/29/18/35/338291835.db2.gz IWYJIQVMMYGCPK-CYBMUJFWSA-N -1 1 321.376 4.045 20 0 DIADMM CN(C(=O)c1ccc(C(F)(F)F)cc1[O-])[C@H]1CCC(C)(C)C1 ZINC000436923159 338293602 /nfs/dbraw/zinc/29/36/02/338293602.db2.gz RWUBNLKDLQHKIV-NSHDSACASA-N -1 1 315.335 4.062 20 0 DIADMM [O-]c1ccc(F)cc1-c1nc(-c2ccc3sccc3c2)no1 ZINC000436934017 338294333 /nfs/dbraw/zinc/29/43/33/338294333.db2.gz RJRAMRGMOSTAEN-UHFFFAOYSA-N -1 1 312.325 4.463 20 0 DIADMM Cc1cscc1[N-]S(=O)(=O)c1c(C)c(C)cc(C)c1C ZINC000439054969 338359846 /nfs/dbraw/zinc/35/98/46/338359846.db2.gz HPJYHEPUDFBHMH-UHFFFAOYSA-N -1 1 309.456 4.091 20 0 DIADMM C[C@H](CCc1cccc(F)c1)C(=O)Nc1ccc([O-])c(Cl)c1 ZINC000440777791 338397157 /nfs/dbraw/zinc/39/71/57/338397157.db2.gz HVEFMCGBFJCYJJ-LLVKDONJSA-N -1 1 321.779 4.392 20 0 DIADMM COc1cc(C)c(NC(=O)Nc2ccc([O-])c(Cl)c2)cc1C ZINC000446364334 338526577 /nfs/dbraw/zinc/52/65/77/338526577.db2.gz RJFUPAIMZAJJPK-UHFFFAOYSA-N -1 1 320.776 4.315 20 0 DIADMM O=C(c1cc(Cl)ccc1[O-])N1CC2(CCC2)[C@@H]1c1ccco1 ZINC000456556920 338933972 /nfs/dbraw/zinc/93/39/72/338933972.db2.gz HSYPYPQCZKCJOJ-HNNXBMFYSA-N -1 1 317.772 4.006 20 0 DIADMM O=C(Nc1ccc([O-])c(F)c1F)[C@@H]1CCC[C@H]2CCCC[C@@H]21 ZINC000456781748 338940426 /nfs/dbraw/zinc/94/04/26/338940426.db2.gz JOZLMMBFXXSTHO-GRYCIOLGSA-N -1 1 309.356 4.215 20 0 DIADMM Cc1ccc(CCCC(=O)Nc2ccc([O-])c(F)c2F)s1 ZINC000456788761 338940906 /nfs/dbraw/zinc/94/09/06/338940906.db2.gz SIEGCIVGGPUGGC-UHFFFAOYSA-N -1 1 311.353 4.002 20 0 DIADMM CC[C@@H](C)[C@@H](C(=O)Nc1ccc([O-])c(F)c1F)c1ccccc1 ZINC000456797281 338941157 /nfs/dbraw/zinc/94/11/57/338941157.db2.gz ZVFFSFKWYWNUGF-IAQYHMDHSA-N -1 1 319.351 4.439 20 0 DIADMM CC[C@H](C)[C@H](C(=O)Nc1ccc([O-])c(F)c1F)c1ccccc1 ZINC000456797282 338941175 /nfs/dbraw/zinc/94/11/75/338941175.db2.gz ZVFFSFKWYWNUGF-NHYWBVRUSA-N -1 1 319.351 4.439 20 0 DIADMM CCc1cccc(CC)c1[N-]S(=O)(=O)c1cccc(F)c1C ZINC000461424791 339063715 /nfs/dbraw/zinc/06/37/15/339063715.db2.gz IGYPTVAHAROIIA-UHFFFAOYSA-N -1 1 321.417 4.060 20 0 DIADMM CC[C@H](C)c1ccc(S(=O)(=O)[N-]c2ccc(C)c(O)c2)cc1 ZINC000462104272 339072165 /nfs/dbraw/zinc/07/21/65/339072165.db2.gz SRQKTVXPHWLVLY-LBPRGKRZSA-N -1 1 319.426 4.015 20 0 DIADMM Cc1oc2ccccc2c1CC(=O)Nc1ccc([O-])c(Cl)c1 ZINC000466751724 339215847 /nfs/dbraw/zinc/21/58/47/339215847.db2.gz ZPJZOHRFIXZCAS-UHFFFAOYSA-N -1 1 315.756 4.281 20 0 DIADMM Cc1c(F)cccc1[N-]S(=O)(=O)c1ccccc1C(C)(C)C ZINC000467072282 339225790 /nfs/dbraw/zinc/22/57/90/339225790.db2.gz AVDHMEMMOOMYTO-UHFFFAOYSA-N -1 1 321.417 4.232 20 0 DIADMM O=C(Nc1ccc([O-])c(Cl)c1)[C@@H]1[C@@H](c2ccccc2)C1(F)F ZINC000485755076 339712229 /nfs/dbraw/zinc/71/22/29/339712229.db2.gz HRVWPSDOZILEQC-KGLIPLIRSA-N -1 1 323.726 4.033 20 0 DIADMM CCc1cccc(CC)c1[N-]S(=O)(=O)c1ccc(C)c(F)c1 ZINC000494571985 339953807 /nfs/dbraw/zinc/95/38/07/339953807.db2.gz VJNZYCCBZDUZOL-UHFFFAOYSA-N -1 1 321.417 4.060 20 0 DIADMM C[C@H]1CCc2c(sc3nc(-c4ccc(Cl)o4)[n-]c(=O)c32)C1 ZINC000507038412 340206079 /nfs/dbraw/zinc/20/60/79/340206079.db2.gz JXFCKDITRKQFDT-ZETCQYMHSA-N -1 1 320.801 4.435 20 0 DIADMM Oc1cccc(C[N@H+]2CC[C@H](c3ccccc3F)C2)c1Cl ZINC000508355969 340242733 /nfs/dbraw/zinc/24/27/33/340242733.db2.gz UKWWHYIDXDJOHD-LBPRGKRZSA-N -1 1 305.780 4.174 20 0 DIADMM Cc1csc2[n-]c([C@@H](F)c3ccc(Cl)cc3)nc(=O)c12 ZINC000509073985 340260402 /nfs/dbraw/zinc/26/04/02/340260402.db2.gz FPVJENRXAUYNQR-NSHDSACASA-N -1 1 308.765 4.418 20 0 DIADMM Cc1ccc(/C=C\CC(=O)Nc2ccc([O-])c(Cl)c2)cc1 ZINC000509180433 340263217 /nfs/dbraw/zinc/26/32/17/340263217.db2.gz SQLAHTDYLYEBPE-IHWYPQMZSA-N -1 1 301.773 4.396 20 0 DIADMM Cc1ccc(/C=C/CC(=O)Nc2ccc([O-])c(Cl)c2)cc1 ZINC000509180435 340263289 /nfs/dbraw/zinc/26/32/89/340263289.db2.gz SQLAHTDYLYEBPE-NSCUHMNNSA-N -1 1 301.773 4.396 20 0 DIADMM CCN(Cc1ccccc1)C(=O)c1ccc2ccccc2c1[O-] ZINC000302791020 340282152 /nfs/dbraw/zinc/28/21/52/340282152.db2.gz FHXSBGBXMRPNKX-UHFFFAOYSA-N -1 1 305.377 4.208 20 0 DIADMM COc1ccc([C@H](C)CC(=O)Nc2ccc([O-])c(Cl)c2)cc1 ZINC000176690787 340430268 /nfs/dbraw/zinc/43/02/68/340430268.db2.gz UKFWURIOKPWNQO-LLVKDONJSA-N -1 1 319.788 4.187 20 0 DIADMM CCN(CCc1ccccc1)C(=O)c1cc2ccccc2cc1[O-] ZINC000220094335 340514065 /nfs/dbraw/zinc/51/40/65/340514065.db2.gz ROQMZRFCXUSRHA-UHFFFAOYSA-N -1 1 319.404 4.250 20 0 DIADMM Cc1ccc(-c2ccc(C[N-]c3nnc(C(F)F)o3)o2)cc1 ZINC000189297508 340533240 /nfs/dbraw/zinc/53/32/40/340533240.db2.gz QINHHVKGGSEMNK-UHFFFAOYSA-N -1 1 305.284 4.188 20 0 DIADMM Cc1c(NC(=O)Nc2ccc([O-])c(Cl)c2)cccc1N(C)C ZINC000192253916 340565355 /nfs/dbraw/zinc/56/53/55/340565355.db2.gz ZNLOUZWUEORCJR-UHFFFAOYSA-N -1 1 319.792 4.064 20 0 DIADMM Cc1cccc(C(C)C)c1[N-]S(=O)(=O)c1cccc(F)c1C ZINC000539104655 340873604 /nfs/dbraw/zinc/87/36/04/340873604.db2.gz OCCLFILPKSWXCE-UHFFFAOYSA-N -1 1 321.417 4.367 20 0 DIADMM CC(C)(C)[C@@H]1CCCN(C(=O)c2ccc(Cl)cc2[O-])CC1 ZINC000071202748 341025490 /nfs/dbraw/zinc/02/54/90/341025490.db2.gz NVSOUVJGEAZYLN-GFCCVEGCSA-N -1 1 309.837 4.334 20 0 DIADMM O=C([N-]c1c(F)cc(F)cc1F)c1cc2cc(F)ccc2o1 ZINC000072506624 341087654 /nfs/dbraw/zinc/08/76/54/341087654.db2.gz AOKXSTILOQNGOV-UHFFFAOYSA-N -1 1 309.218 4.242 20 0 DIADMM O=C(c1ccc(Cl)cc1[O-])N1CCC(c2ccccc2)CC1 ZINC000073843541 341121910 /nfs/dbraw/zinc/12/19/10/341121910.db2.gz CROFWGAAEUNOJR-UHFFFAOYSA-N -1 1 315.800 4.065 20 0 DIADMM C[C@@H](c1ccc(Cl)cc1)N(C)C(=O)c1cc(F)ccc1[O-] ZINC000132891750 341148621 /nfs/dbraw/zinc/14/86/21/341148621.db2.gz ZVEPHLFZVZFSIT-JTQLQIEISA-N -1 1 307.752 4.018 20 0 DIADMM O=C(Nc1ccc([O-])c(Cl)c1)[C@H]1CCCC[C@@H]1C(F)(F)F ZINC000136121613 341253054 /nfs/dbraw/zinc/25/30/54/341253054.db2.gz YYVGYOPHAJVBMB-UWVGGRQHSA-N -1 1 321.726 4.353 20 0 DIADMM O=C(Nc1ccc([O-])c(Cl)c1)[C@@H]1CCCC[C@H]1C(F)(F)F ZINC000136121649 341253076 /nfs/dbraw/zinc/25/30/76/341253076.db2.gz YYVGYOPHAJVBMB-NXEZZACHSA-N -1 1 321.726 4.353 20 0 DIADMM O=C(Nc1cccc2cc[nH]c21)c1cc2ccccc2cc1[O-] ZINC000548476416 341262804 /nfs/dbraw/zinc/26/28/04/341262804.db2.gz HDDPOIFPQKUTPZ-UHFFFAOYSA-N -1 1 302.333 4.279 20 0 DIADMM Cc1cc(-c2noc(-c3ccc4ccccc4c3[O-])n2)ccc1O ZINC000576814800 341864343 /nfs/dbraw/zinc/86/43/43/341864343.db2.gz GRIWHGLOPAZBDD-UHFFFAOYSA-N -1 1 318.332 4.276 20 0 DIADMM O=c1cc(C(F)F)nc(SCc2ccc(F)c(Cl)c2)[n-]1 ZINC000577105777 341886245 /nfs/dbraw/zinc/88/62/45/341886245.db2.gz LSXPSKLSYGNWGI-UHFFFAOYSA-N -1 1 320.723 4.205 20 0 DIADMM Cc1ccc(C)c(NC(=O)c2cc(Br)ccc2[O-])c1 ZINC000011639322 563650232 /nfs/dbraw/zinc/65/02/32/563650232.db2.gz AQNKCYANDHWBFC-UHFFFAOYSA-N -1 1 320.186 4.024 20 0 DIADMM CCc1ccc(S(=O)(=O)[N-]c2cccc(C)c2Cl)s1 ZINC000608755221 1038914639 /nfs/dbraw/zinc/91/46/39/1038914639.db2.gz DFPMRXGHWOLVGY-UHFFFAOYSA-N -1 1 315.847 4.073 20 0 DIADMM [O-]c1c(Cl)nccc1Nc1cccc(Br)c1F ZINC001249687118 1060345587 /nfs/dbraw/zinc/34/55/87/1060345587.db2.gz SBFNOJXSWCQREM-UHFFFAOYSA-N -1 1 317.545 4.086 20 0 DIADMM COc1cccc2cc(C(=O)Nc3ccc(Cl)cc3[O-])oc21 ZINC000153605073 1035733438 /nfs/dbraw/zinc/73/34/38/1035733438.db2.gz UPPWAHHPPCRROI-UHFFFAOYSA-N -1 1 317.728 4.053 20 0 DIADMM [O-]c1c(-c2nc(COc3ccccc3)no2)ccc2ccccc21 ZINC000109037585 1035741622 /nfs/dbraw/zinc/74/16/22/1035741622.db2.gz IZIYYDMANOJOHH-UHFFFAOYSA-N -1 1 318.332 4.174 20 0 DIADMM CCOc1ccc(NC(=O)c2ccc3ccccc3c2[O-])cc1 ZINC000143041446 1036343263 /nfs/dbraw/zinc/34/32/63/1036343263.db2.gz CYSILXMJSLKELC-UHFFFAOYSA-N -1 1 307.349 4.196 20 0 DIADMM CC(C)[C@H]1N(C(=O)c2ccc(F)c([O-])c2)CC12CCCCCC2 ZINC001648894887 1036676640 /nfs/dbraw/zinc/67/66/40/1036676640.db2.gz VAACXFNPZUWFDG-QGZVFWFLSA-N -1 1 319.420 4.352 20 0 DIADMM C[C@@H](c1ccc(Cl)c(Cl)c1)N1CCC[C@@H](CC(=O)[O-])C1 ZINC000226420453 1037195621 /nfs/dbraw/zinc/19/56/21/1037195621.db2.gz NTAHZRFXDLNWHZ-QWRGUYRKSA-N -1 1 316.228 4.241 20 0 DIADMM COc1cc(F)c(Nc2cc([O-])c(Cl)cc2F)cc1OC ZINC001215721747 1037555412 /nfs/dbraw/zinc/55/54/12/1037555412.db2.gz KMEBCIAIHPJTJQ-UHFFFAOYSA-N -1 1 315.703 4.085 20 0 DIADMM CCC[C@H](C)C[C@@H](NCc1cc2cccc(CC)c2o1)C(=O)[O-] ZINC000656574813 1037655895 /nfs/dbraw/zinc/65/58/95/1037655895.db2.gz ZHTBVMCQMYMXLM-SUMWQHHRSA-N -1 1 317.429 4.364 20 0 DIADMM O=C(Nc1cc(Cl)cc(Cl)c1)Nc1cccc(F)c1[O-] ZINC000168779232 1038007213 /nfs/dbraw/zinc/00/72/13/1038007213.db2.gz QCGKBKJMNQAMAR-UHFFFAOYSA-N -1 1 315.131 4.482 20 0 DIADMM CCN(Cc1ccc(Cl)s1)Cc1ccsc1C(=O)[O-] ZINC000581830046 1038014176 /nfs/dbraw/zinc/01/41/76/1038014176.db2.gz WPOZGCRCHPLWOO-UHFFFAOYSA-N -1 1 315.847 4.183 20 0 DIADMM Cc1ccc2c(c1)scc2C(=O)Nc1c([O-])cccc1F ZINC000684575513 1038297285 /nfs/dbraw/zinc/29/72/85/1038297285.db2.gz DUWQYLAPOWHCSE-UHFFFAOYSA-N -1 1 301.342 4.307 20 0 DIADMM O=C(Cc1ccc(Cl)cc1Cl)Nc1c([O-])cccc1F ZINC000605440562 1038516728 /nfs/dbraw/zinc/51/67/28/1038516728.db2.gz VPUDLPQQXJANPB-UHFFFAOYSA-N -1 1 314.143 4.019 20 0 DIADMM [O-]c1c(Cl)ccc(CN2CC[C@@H]3CCC[C@@H]3C2)c1Cl ZINC001232626116 1038608251 /nfs/dbraw/zinc/60/82/51/1038608251.db2.gz VSJGIWJNLGQSNT-WDEREUQCSA-N -1 1 300.229 4.321 20 0 DIADMM Cc1ccc([C@@H]2CCCN2[C@H](C)c2cc(C(=O)[O-])c(C)o2)o1 ZINC000515489342 1038608758 /nfs/dbraw/zinc/60/87/58/1038608758.db2.gz BSTGUXAZWBPHLP-RISCZKNCSA-N -1 1 303.358 4.086 20 0 DIADMM Cc1ccc(NC(=O)c2ccc(C(F)(F)F)c([O-])c2)cc1C ZINC000684869286 1038665933 /nfs/dbraw/zinc/66/59/33/1038665933.db2.gz QNMHAVRAUVWFKR-UHFFFAOYSA-N -1 1 309.287 4.280 20 0 DIADMM C[C@H]1CCCC[C@H]1N(C)C(=O)c1ccc(C(F)(F)F)c([O-])c1 ZINC000684870410 1038666055 /nfs/dbraw/zinc/66/60/55/1038666055.db2.gz FSIHLANIWZOXEI-GXFFZTMASA-N -1 1 315.335 4.062 20 0 DIADMM C[C@@H]1CCCC[C@H]1N(C)C(=O)c1ccc(C(F)(F)F)c([O-])c1 ZINC000684870412 1038666723 /nfs/dbraw/zinc/66/67/23/1038666723.db2.gz FSIHLANIWZOXEI-ZWNOBZJWSA-N -1 1 315.335 4.062 20 0 DIADMM O=C(Cc1ccc([O-])c(Cl)c1)N1CCCC[C@H]1CC1CCC1 ZINC001167603185 1038767927 /nfs/dbraw/zinc/76/79/27/1038767927.db2.gz NJZSWCGDOZSIKA-HNNXBMFYSA-N -1 1 321.848 4.159 20 0 DIADMM CCc1ccc([C@H](C)CC(=O)Nc2c([O-])cccc2F)cc1 ZINC000608365259 1038829972 /nfs/dbraw/zinc/82/99/72/1038829972.db2.gz DHDITXUMYSZBAG-GFCCVEGCSA-N -1 1 301.361 4.226 20 0 DIADMM O=C(c1ccc(Cl)cc1[O-])N1CCC(C2CCCC2)CC1 ZINC000608475226 1038852930 /nfs/dbraw/zinc/85/29/30/1038852930.db2.gz PODAPABIIISEJW-UHFFFAOYSA-N -1 1 307.821 4.088 20 0 DIADMM O=C(CC1CC(c2ccccc2)C1)Nc1ccc([O-])c(F)c1F ZINC000456789572 1039078823 /nfs/dbraw/zinc/07/88/23/1039078823.db2.gz URMFASULRVXNHE-UHFFFAOYSA-N -1 1 317.335 4.193 20 0 DIADMM C[C@H](Sc1nc(C(F)F)cc(=O)[n-]1)c1ccccc1F ZINC000685574995 1040142954 /nfs/dbraw/zinc/14/29/54/1040142954.db2.gz WWIWUCVPLYBYIB-ZETCQYMHSA-N -1 1 300.305 4.112 20 0 DIADMM CCO[C@@H](C(=O)Nc1cc(Cl)c([O-])c2ccccc12)C(C)C ZINC000628233826 1040240927 /nfs/dbraw/zinc/24/09/27/1040240927.db2.gz XLLARCHZPVFQPR-MRXNPFEDSA-N -1 1 321.804 4.198 20 0 DIADMM COCCC(C)(C)C(=O)Nc1cc(Cl)c([O-])c2ccccc12 ZINC000628233144 1040519333 /nfs/dbraw/zinc/51/93/33/1040519333.db2.gz JCGUQTSDQBLSBL-UHFFFAOYSA-N -1 1 321.804 4.200 20 0 DIADMM O=C(c1ccccc1[O-])N1Cc2ccccc2-c2ccccc21 ZINC000612665938 1040673871 /nfs/dbraw/zinc/67/38/71/1040673871.db2.gz DXMPRYXSZPVGOK-UHFFFAOYSA-N -1 1 301.345 4.220 20 0 DIADMM C=CCOc1ccc(C=C2SC(=S)[N-]C2=O)cc1Cl ZINC000066255689 1040748071 /nfs/dbraw/zinc/74/80/71/1040748071.db2.gz PMEHGCZYXMCWHN-XFFZJAGNSA-N -1 1 311.815 4.234 20 0 DIADMM CCC(CC)c1cc(C(=O)Nc2ccc([O-])c(Cl)c2)on1 ZINC000173379189 1040888879 /nfs/dbraw/zinc/88/88/79/1040888879.db2.gz MQBFLQGZOSNKSP-UHFFFAOYSA-N -1 1 308.765 4.190 20 0 DIADMM CCOc1cc(C(=O)N(C)c2cccc(C)c2)cc(Cl)c1[O-] ZINC000186771837 1041178777 /nfs/dbraw/zinc/17/87/77/1041178777.db2.gz KQUUTXZQBUWYBH-UHFFFAOYSA-N -1 1 319.788 4.029 20 0 DIADMM CSc1cc(-c2ccc(OC(F)(F)F)cc2[O-])ncc1F ZINC001244463081 1041246608 /nfs/dbraw/zinc/24/66/08/1041246608.db2.gz GAMHVAUKKVIXRH-UHFFFAOYSA-N -1 1 319.279 4.214 20 0 DIADMM Cc1csc2nc(C)nc(-c3c(Cl)ccc([O-])c3F)c12 ZINC001244541041 1041392575 /nfs/dbraw/zinc/39/25/75/1041392575.db2.gz WBAMJNBJUBVEIR-UHFFFAOYSA-N -1 1 308.765 4.473 20 0 DIADMM COc1ccc(OC(=O)c2cc3cc(Cl)sc3[n-]2)cc1 ZINC000810523771 1041397957 /nfs/dbraw/zinc/39/79/57/1041397957.db2.gz MHSHUUIXSARSKI-UHFFFAOYSA-N -1 1 307.758 4.111 20 0 DIADMM C[C@H](CC(=O)Nc1ccc(-c2cc(=O)[nH][n-]2)cc1)CC(C)(C)C ZINC000613668360 1041418713 /nfs/dbraw/zinc/41/87/13/1041418713.db2.gz LPVKCMFXTRRPHP-GFCCVEGCSA-N -1 1 315.417 4.183 20 0 DIADMM C[C@H](c1ccccc1Cl)N(C)Cc1ccccc1CC(=O)[O-] ZINC000387595606 1041456812 /nfs/dbraw/zinc/45/68/12/1041456812.db2.gz UTERDUYUFQNJPJ-CYBMUJFWSA-N -1 1 317.816 4.160 20 0 DIADMM C[C@@H](c1ccc(Cl)cc1Cl)N1CCC[C@H](CC(=O)[O-])C1 ZINC000086757021 1041741222 /nfs/dbraw/zinc/74/12/22/1041741222.db2.gz HERAGZXLIRHKEL-WDEREUQCSA-N -1 1 316.228 4.241 20 0 DIADMM C[C@H](c1cccs1)N(C)Cc1c(Cl)cccc1C(=O)[O-] ZINC000652392839 1042034524 /nfs/dbraw/zinc/03/45/24/1042034524.db2.gz CUNYQLSDNOXZFQ-SNVBAGLBSA-N -1 1 309.818 4.293 20 0 DIADMM Cc1sc(C(=O)[O-])cc1CN([C@@H](C)c1ccco1)C1CC1 ZINC000652401437 1042038066 /nfs/dbraw/zinc/03/80/66/1042038066.db2.gz FAADWSHHFHNZHE-JTQLQIEISA-N -1 1 305.399 4.073 20 0 DIADMM CC(C)c1scnc1NC(=O)c1ccc(C(C)C)cc1[O-] ZINC000647722269 1042048871 /nfs/dbraw/zinc/04/88/71/1042048871.db2.gz CRAKEDCKHKBCKJ-UHFFFAOYSA-N -1 1 304.415 4.348 20 0 DIADMM O=C(c1c([O-])cccc1Cl)N1CCC[C@H](c2ccccc2)C1 ZINC000817107014 1042094548 /nfs/dbraw/zinc/09/45/48/1042094548.db2.gz OUZQFFVDVQEAQC-AWEZNQCLSA-N -1 1 315.800 4.065 20 0 DIADMM Cc1oc(CN(C)[C@H](C)c2ccc(Cl)cc2)cc1C(=O)[O-] ZINC000062015130 1042107698 /nfs/dbraw/zinc/10/76/98/1042107698.db2.gz XETLUVVZYSWRDM-SNVBAGLBSA-N -1 1 307.777 4.133 20 0 DIADMM Cc1ccc([C@H](NC(=O)c2c([O-])cccc2Cl)C2CC2)cc1 ZINC001135984510 1042121911 /nfs/dbraw/zinc/12/19/11/1042121911.db2.gz CRVKJQJZBXCKOE-KRWDZBQOSA-N -1 1 315.800 4.235 20 0 DIADMM CSc1ccc([O-])c(C(=O)Nc2cccc3c2CCCC3)c1 ZINC001135999196 1042124149 /nfs/dbraw/zinc/12/41/49/1042124149.db2.gz CHZCQHGKQWXMAL-UHFFFAOYSA-N -1 1 313.422 4.245 20 0 DIADMM CCc1ccccc1NC(=O)c1ccc2ccc(O)cc2c1[O-] ZINC001136104958 1042140054 /nfs/dbraw/zinc/14/00/54/1042140054.db2.gz ZDBAPMXOZBTPGG-UHFFFAOYSA-N -1 1 307.349 4.066 20 0 DIADMM CC(C)(C)[C@H](NC(=O)c1cc(F)ccc1[O-])c1ccc(F)cc1 ZINC001136256896 1042192509 /nfs/dbraw/zinc/19/25/09/1042192509.db2.gz NJNKMTVRABQWEO-MRXNPFEDSA-N -1 1 319.351 4.188 20 0 DIADMM CSc1ccccc1[N-]C(=O)c1nc(Cl)sc1Cl ZINC000821670865 1042261779 /nfs/dbraw/zinc/26/17/79/1042261779.db2.gz VUQAWEBMAUDLIJ-UHFFFAOYSA-N -1 1 319.238 4.424 20 0 DIADMM COc1cnc(C=Cc2sc3ccccc3c2Cl)[n-]c1=O ZINC000821008854 1042240155 /nfs/dbraw/zinc/24/01/55/1042240155.db2.gz SUBAXWFKBOFAPN-VOTSOKGWSA-N -1 1 318.785 4.229 20 0 DIADMM COc1cnc(C=Cc2cccc(Oc3ccccc3)c2)[n-]c1=O ZINC000821009245 1042240502 /nfs/dbraw/zinc/24/05/02/1042240502.db2.gz XYBUMRJYSRKECT-KHPPLWFESA-N -1 1 320.348 4.154 20 0 DIADMM CCCCN(C(=O)c1ccc(F)c([O-])c1)[C@H](C)c1ccc(C)o1 ZINC001136443530 1042250643 /nfs/dbraw/zinc/25/06/43/1042250643.db2.gz FSJXQLLFADTMCF-CYBMUJFWSA-N -1 1 319.376 4.436 20 0 DIADMM O=C(NCCCCCc1ccccc1)c1cc(Cl)ccc1[O-] ZINC001136588887 1042289610 /nfs/dbraw/zinc/28/96/10/1042289610.db2.gz RUICCXMXJKOLLG-UHFFFAOYSA-N -1 1 317.816 4.188 20 0 DIADMM CC(C)CC[C@H]1CCC[C@H]1NC(=O)c1c([O-])cccc1Cl ZINC001136596097 1042290745 /nfs/dbraw/zinc/29/07/45/1042290745.db2.gz UNBCVWJIXDUZHW-TZMCWYRMSA-N -1 1 309.837 4.380 20 0 DIADMM O=C(c1ncc2ccccc2c1[O-])N(CC1CC1)C1CCCCC1 ZINC001136600226 1042293240 /nfs/dbraw/zinc/29/32/40/1042293240.db2.gz JKXWAFVGUPWBCM-UHFFFAOYSA-N -1 1 324.424 4.125 20 0 DIADMM [O-]c1ccc(-c2noc([C@@H]3CC[C@H](C(F)(F)F)C3)n2)cc1F ZINC000436871248 1042338010 /nfs/dbraw/zinc/33/80/10/1042338010.db2.gz GUICCSPJALVOCB-BDAKNGLRSA-N -1 1 316.254 4.027 20 0 DIADMM C[C@H](c1cc(Cl)ccc1Cl)N1CC[C@H](C(=O)[O-])[C@H](C)C1 ZINC000312830677 1042363505 /nfs/dbraw/zinc/36/35/05/1042363505.db2.gz JSIQEWIXPKYLQV-FOGDFJRCSA-N -1 1 316.228 4.097 20 0 DIADMM O=c1c2c([n-]n1Cc1ccc(Cl)cc1Cl)CCCCC2 ZINC000614188536 1042424691 /nfs/dbraw/zinc/42/46/91/1042424691.db2.gz DRJSNNSAMAYGAA-LBPRGKRZSA-N -1 1 311.212 4.272 20 0 DIADMM CCOc1ccc(F)c([N-]c2nc(C)co2)c1Br ZINC001211754201 1042432105 /nfs/dbraw/zinc/43/21/05/1042432105.db2.gz GFLIKEZXLXNWHE-UHFFFAOYSA-N -1 1 315.142 4.027 20 0 DIADMM CCOc1cc(F)c(F)cc1Nc1cc(F)c([O-])c(F)c1 ZINC001211803472 1042456011 /nfs/dbraw/zinc/45/60/11/1042456011.db2.gz LOJGWBYNUJCSDF-UHFFFAOYSA-N -1 1 301.239 4.091 20 0 DIADMM Cc1ccn(-c2ccc(NCc3cccc([O-])c3Cl)cc2)n1 ZINC000645181305 1042458324 /nfs/dbraw/zinc/45/83/24/1042458324.db2.gz UMWMHUDUQHMAOT-UHFFFAOYSA-N -1 1 313.788 4.152 20 0 DIADMM O=C1[N-]C(=O)C(=Cc2ccc(-c3ccc(Cl)cc3)cc2)S1 ZINC000034041497 1042517382 /nfs/dbraw/zinc/51/73/82/1042517382.db2.gz ISKIUMCGUXHXDM-ZROIWOOFSA-N -1 1 315.781 4.331 20 0 DIADMM CCCC[C@@H](NCc1ccc(-c2ccc(F)cc2C)o1)C(=O)[O-] ZINC000262700336 1042543737 /nfs/dbraw/zinc/54/37/37/1042543737.db2.gz KCQQCWTYRXPPEF-MRXNPFEDSA-N -1 1 319.376 4.127 20 0 DIADMM O=c1[n-]c(-c2ccc(O)cc2Cl)nc2cc(Cl)ccc12 ZINC000438883044 1042910964 /nfs/dbraw/zinc/91/09/64/1042910964.db2.gz ORTHKWVRRCSCDD-UHFFFAOYSA-N -1 1 307.136 4.015 20 0 DIADMM O=C1[N-]C(=S)SC1=Cc1cccc(OC2CCCC2)c1 ZINC000048625084 1042923794 /nfs/dbraw/zinc/92/37/94/1042923794.db2.gz VMCVEGFXMHYZTD-LCYFTJDESA-N -1 1 305.424 4.337 20 0 DIADMM CCc1cc(=O)[n-]c(SC(c2ccccc2)c2ccccc2)n1 ZINC000188097217 1043010985 /nfs/dbraw/zinc/01/09/85/1043010985.db2.gz DHBVXYZTVDNPQN-UHFFFAOYSA-N -1 1 322.433 4.214 20 0 DIADMM CC(C)[C@H](C(=O)Nc1ccc([O-])c(Cl)c1)c1ccccc1 ZINC000440950037 1043014468 /nfs/dbraw/zinc/01/44/68/1043014468.db2.gz QFNGVTJSOOUGLE-INIZCTEOSA-N -1 1 303.789 4.424 20 0 DIADMM Cc1ccc(CSc2nc(C)c(C3CC3)c(=O)[n-]2)nc1Cl ZINC000865373258 1043088659 /nfs/dbraw/zinc/08/86/59/1043088659.db2.gz MBSDFUNVXIUYNS-UHFFFAOYSA-N -1 1 321.833 4.017 20 0 DIADMM CC(C)c1ccc([C@H](CC(=O)[O-])NCc2ccc(Cl)o2)cc1 ZINC000417569726 1043217841 /nfs/dbraw/zinc/21/78/41/1043217841.db2.gz LYZKZJBCLOFVKM-HNNXBMFYSA-N -1 1 321.804 4.362 20 0 DIADMM Cc1cc(NC(=O)c2c(F)ccc([O-])c2F)cc(C)c1Cl ZINC001625933313 1043258877 /nfs/dbraw/zinc/25/88/77/1043258877.db2.gz OPZQJVOWKRLXNZ-UHFFFAOYSA-N -1 1 311.715 4.193 20 0 DIADMM O=C(CC1CCCCCC1)Nc1ccc(-c2cc(=O)[nH][n-]2)cc1 ZINC000428040747 1043322047 /nfs/dbraw/zinc/32/20/47/1043322047.db2.gz MDFIKKFDKVLJSN-UHFFFAOYSA-N -1 1 313.401 4.081 20 0 DIADMM O=c1cc(CSc2ccc(F)c(F)c2)c2ccc([O-])cc2o1 ZINC000017982578 1043334757 /nfs/dbraw/zinc/33/47/57/1043334757.db2.gz JAUBDBPBXRFMIR-UHFFFAOYSA-N -1 1 320.316 4.069 20 0 DIADMM Cc1nocc1C(=O)[N-]c1cc(Cl)ccc1SC(C)C ZINC000630929877 1043431542 /nfs/dbraw/zinc/43/15/42/1043431542.db2.gz ZPZQGXLAYNWRPW-UHFFFAOYSA-N -1 1 310.806 4.389 20 0 DIADMM CCN(C(=O)c1cc(Cl)c([O-])c(OC)c1)c1cccc(C)c1 ZINC000442874537 1043441175 /nfs/dbraw/zinc/44/11/75/1043441175.db2.gz QUSLFQLKKYDTEV-UHFFFAOYSA-N -1 1 319.788 4.029 20 0 DIADMM O=c1cc(C(F)F)nc(SCc2cccc(Cl)c2F)[n-]1 ZINC000521630304 1043445627 /nfs/dbraw/zinc/44/56/27/1043445627.db2.gz CRFUQRWHRNZODI-UHFFFAOYSA-N -1 1 320.723 4.205 20 0 DIADMM CC(C)Sc1ccccc1[N-]C(=O)c1nnc(C(C)C)s1 ZINC000339223260 1043456419 /nfs/dbraw/zinc/45/64/19/1043456419.db2.gz NRYDUHAOYRSLNM-UHFFFAOYSA-N -1 1 321.471 4.414 20 0 DIADMM CCCC[C@H](CCC)NC(=O)c1cc(Cl)c([O-])c(OC)c1 ZINC000443288515 1043522551 /nfs/dbraw/zinc/52/25/51/1043522551.db2.gz BDIZFYMTWZKNKF-LBPRGKRZSA-N -1 1 313.825 4.143 20 0 DIADMM COc1ccc2cc(-c3nc4ccc(C)cc4c(=O)[n-]3)ccc2c1 ZINC000522069917 1043529880 /nfs/dbraw/zinc/52/98/80/1043529880.db2.gz UBQNGCDBOKZKGR-UHFFFAOYSA-N -1 1 316.360 4.060 20 0 DIADMM CCC(CC)c1cc(C(=O)[N-]c2ccc(O)cc2SC)on1 ZINC000191202277 1043546389 /nfs/dbraw/zinc/54/63/89/1043546389.db2.gz JGLOMTBHUYIRDS-UHFFFAOYSA-N -1 1 320.414 4.258 20 0 DIADMM CC[C@@H](C)Cc1c(C)sc2nc(-c3cc(C)on3)[n-]c(=O)c12 ZINC000358838704 1044103639 /nfs/dbraw/zinc/10/36/39/1044103639.db2.gz FRHOOWVWWVZUPH-MRVPVSSYSA-N -1 1 317.414 4.257 20 0 DIADMM Cc1cccc([C@@H]([N-]c2nnc(C(C)(C)C)o2)c2ccccn2)c1 ZINC000882143935 1044153781 /nfs/dbraw/zinc/15/37/81/1044153781.db2.gz AJZCSVSRIHQRMT-MRXNPFEDSA-N -1 1 322.412 4.272 20 0 DIADMM Cc1[nH]c2c(cccc2C(=O)Nc2ccc([O-])c(Cl)c2)c1C ZINC000129554697 1044162651 /nfs/dbraw/zinc/16/26/51/1044162651.db2.gz PUDSUECHDMNVIT-UHFFFAOYSA-N -1 1 314.772 4.396 20 0 DIADMM C[C@@H](C(=O)[N-]OCc1ccc(C(F)(F)F)cc1)c1ccccc1 ZINC000130478544 1044204174 /nfs/dbraw/zinc/20/41/74/1044204174.db2.gz YPEDRSXOFHRJLI-GFCCVEGCSA-N -1 1 323.314 4.057 20 0 DIADMM C[C@@H](c1ccc(F)c(Cl)c1)N1CCC(CCC(=O)[O-])CC1 ZINC000086756154 1044235496 /nfs/dbraw/zinc/23/54/96/1044235496.db2.gz VMCQTZRDBWYMNN-NSHDSACASA-N -1 1 313.800 4.117 20 0 DIADMM O=C([O-])CC[C@H]1CCCN(Cc2cc(Cl)cc(Cl)c2)C1 ZINC000086809235 1044251588 /nfs/dbraw/zinc/25/15/88/1044251588.db2.gz HKABCAUDARVKFW-LLVKDONJSA-N -1 1 316.228 4.070 20 0 DIADMM Cc1ccc2c(cccc2Nc2cc3ccc([O-])cc3oc2=O)n1 ZINC001212796430 1044328966 /nfs/dbraw/zinc/32/89/66/1044328966.db2.gz ZICQAHNHOFXEEF-UHFFFAOYSA-N -1 1 318.332 4.099 20 0 DIADMM CC1(C)CN(Cc2cccc([O-])c2Cl)[C@@H]1c1cccnc1 ZINC000294021348 1044368192 /nfs/dbraw/zinc/36/81/92/1044368192.db2.gz UYNUVUTXZPGIPX-MRXNPFEDSA-N -1 1 302.805 4.024 20 0 DIADMM Cc1ccc(S(=O)(=O)[N-]c2ccc(C(C)C)cc2)cc1F ZINC000614737063 1044413821 /nfs/dbraw/zinc/41/38/21/1044413821.db2.gz YZWMXIFDCWVRNU-UHFFFAOYSA-N -1 1 307.390 4.058 20 0 DIADMM Cc1cnc(C2CC[NH+](Cc3cccc(O)c3Cl)CC2)s1 ZINC000294486651 1044424612 /nfs/dbraw/zinc/42/46/12/1044424612.db2.gz AYDKDMCRNNMXKC-UHFFFAOYSA-N -1 1 322.861 4.190 20 0 DIADMM Cc1cccc(NC(=O)Nc2cc([O-])c(Cl)cc2F)c1C ZINC001202700716 1044479617 /nfs/dbraw/zinc/47/96/17/1044479617.db2.gz ACQHKIPIFNOKCU-UHFFFAOYSA-N -1 1 308.740 4.446 20 0 DIADMM COc1ccc(NC(=O)Nc2cccc([O-])c2Cl)c(C)c1 ZINC001202726990 1044523038 /nfs/dbraw/zinc/52/30/38/1044523038.db2.gz DEQZWMDJOWSVCI-UHFFFAOYSA-N -1 1 306.749 4.007 20 0 DIADMM CC(C)(C)SCCCC(=O)Nc1cc(F)c([O-])cc1Cl ZINC000885676331 1044584221 /nfs/dbraw/zinc/58/42/21/1044584221.db2.gz NAYURNXMFLDMAX-UHFFFAOYSA-N -1 1 319.829 4.435 20 0 DIADMM [O-]c1ccc(-c2nc(-c3cccc(Cl)c3F)no2)c(F)c1 ZINC000445381950 1044710499 /nfs/dbraw/zinc/71/04/99/1044710499.db2.gz BWDJEMABPPPWPI-UHFFFAOYSA-N -1 1 308.671 4.041 20 0 DIADMM CCC[C@@H](C)c1nc(-c2cc(Cl)c([O-])c(OCC)c2)no1 ZINC000445412621 1044713110 /nfs/dbraw/zinc/71/31/10/1044713110.db2.gz OAQMUZGWUIHEQM-SECBINFHSA-N -1 1 310.781 4.398 20 0 DIADMM CCOc1cc(-c2noc([C@@H]3C[C@]3(C)CC)n2)cc(Cl)c1[O-] ZINC000445408881 1044715025 /nfs/dbraw/zinc/71/50/25/1044715025.db2.gz OGBJORJUYKYBCV-QFYYESIMSA-N -1 1 322.792 4.398 20 0 DIADMM C[C@@H](c1ccc(Cl)s1)c1nc(-c2ccc([O-])c(F)c2)no1 ZINC000445479370 1044729356 /nfs/dbraw/zinc/72/93/56/1044729356.db2.gz VSVVFGLLZFNLEF-ZETCQYMHSA-N -1 1 324.764 4.448 20 0 DIADMM [O-]c1ccc(-c2noc(-c3cccc(C(F)F)c3)n2)cc1F ZINC000445478719 1044730942 /nfs/dbraw/zinc/73/09/42/1044730942.db2.gz RXUZESUTLMZORA-UHFFFAOYSA-N -1 1 306.243 4.186 20 0 DIADMM [O-]c1ccc(-c2noc([C@@H](c3ccccc3)C3CC3)n2)cc1F ZINC000445484506 1044732523 /nfs/dbraw/zinc/73/25/23/1044732523.db2.gz ZOYZLQWYWFBCAD-INIZCTEOSA-N -1 1 310.328 4.123 20 0 DIADMM [O-]c1ccc(-c2noc(CCc3cc(Cl)cs3)n2)cc1F ZINC000445482986 1044733294 /nfs/dbraw/zinc/73/32/94/1044733294.db2.gz ULWYWTUCEAZJFD-UHFFFAOYSA-N -1 1 324.764 4.081 20 0 DIADMM [O-]c1ccc(-c2noc(-c3ccc(F)c(Cl)c3)n2)cc1F ZINC000445483712 1044733421 /nfs/dbraw/zinc/73/34/21/1044733421.db2.gz TZNVFWJXIYJWFI-UHFFFAOYSA-N -1 1 308.671 4.041 20 0 DIADMM COc1ccc(/C(C)=C/C(=O)Nc2ccc([O-])c(Cl)c2)cc1 ZINC001295291769 1044988471 /nfs/dbraw/zinc/98/84/71/1044988471.db2.gz AEAMBISEHWQCRT-PKNBQFBNSA-N -1 1 317.772 4.096 20 0 DIADMM CC(C)(C)Sc1cc(C(=O)Nc2c([O-])cccc2F)ccn1 ZINC000778942967 1045058997 /nfs/dbraw/zinc/05/89/97/1045058997.db2.gz ZGZBZHBHSZPRJF-UHFFFAOYSA-N -1 1 320.389 4.069 20 0 DIADMM O=C(CCc1ccc(Cl)cc1)Nc1ccc([O-])c(Cl)c1 ZINC000601053593 1045179666 /nfs/dbraw/zinc/17/96/66/1045179666.db2.gz KVEQQJHIKIGEFG-UHFFFAOYSA-N -1 1 310.180 4.270 20 0 DIADMM CCC[C@H](C)N(C)Cc1csc(-c2cccc(C(=O)[O-])c2)n1 ZINC000578242295 1045223186 /nfs/dbraw/zinc/22/31/86/1045223186.db2.gz RBIBSJSORVWGMB-LBPRGKRZSA-N -1 1 318.442 4.129 20 0 DIADMM O=c1cc(C(F)F)nc(SCc2cc(F)ccc2Cl)[n-]1 ZINC000579649516 1045327874 /nfs/dbraw/zinc/32/78/74/1045327874.db2.gz DFTTWUCYUKNDEM-UHFFFAOYSA-N -1 1 320.723 4.205 20 0 DIADMM O=C(Nc1ccc([O-])c(F)c1F)[C@@H]1CC[C@@H](c2ccccc2)C1 ZINC000627680644 1045382230 /nfs/dbraw/zinc/38/22/30/1045382230.db2.gz VDEBCXRELCXHCQ-CHWSQXEVSA-N -1 1 317.335 4.193 20 0 DIADMM CC(C)OCCCC(=O)Nc1cc(Cl)c([O-])c2ccccc12 ZINC000628233230 1045548553 /nfs/dbraw/zinc/54/85/53/1045548553.db2.gz PUISOJZRYOOFDW-UHFFFAOYSA-N -1 1 321.804 4.343 20 0 DIADMM CC(C)CO[C@H](C)C(=O)Nc1cc(Cl)c([O-])c2ccccc12 ZINC000628233261 1045550424 /nfs/dbraw/zinc/55/04/24/1045550424.db2.gz RUOWUXAXCZALHU-LLVKDONJSA-N -1 1 321.804 4.198 20 0 DIADMM O=C(Nc1cc(Cl)c([O-])c2ccccc12)[C@H]1CC12CCC2 ZINC000628233382 1045551260 /nfs/dbraw/zinc/55/12/60/1045551260.db2.gz YJCGWNIEXQYGIH-GFCCVEGCSA-N -1 1 301.773 4.328 20 0 DIADMM Cc1ccc(NC(=O)Nc2cc(Cl)ncc2[O-])cc1Cl ZINC001202800008 1045577798 /nfs/dbraw/zinc/57/77/98/1045577798.db2.gz FFXOKZMCPUOAPB-UHFFFAOYSA-N -1 1 312.156 4.046 20 0 DIADMM Cc1c(=O)[n-]c(SCCC(C)(F)F)nc1-c1ccccc1 ZINC000450897540 1045587180 /nfs/dbraw/zinc/58/71/80/1045587180.db2.gz AKPOPFAAQQRDSG-UHFFFAOYSA-N -1 1 310.369 4.295 20 0 DIADMM Cc1sc([C@H](C)NCc2cccc(C(C)C)c2)nc1C(=O)[O-] ZINC000900078501 1045598350 /nfs/dbraw/zinc/59/83/50/1045598350.db2.gz KIQCPVHDSQPTIZ-NSHDSACASA-N -1 1 318.442 4.124 20 0 DIADMM O=S(=O)(CCC1CCCC1)[N-]c1ccccc1C(F)(F)F ZINC000450964534 1045602181 /nfs/dbraw/zinc/60/21/81/1045602181.db2.gz CXTSHKUNZADYBL-UHFFFAOYSA-N -1 1 321.364 4.027 20 0 DIADMM CC(=O)Nc1cccc(NCc2c([O-])ccc(Cl)c2F)c1C ZINC000190807690 1045612257 /nfs/dbraw/zinc/61/22/57/1045612257.db2.gz SCBXYYFWTGPXCL-UHFFFAOYSA-N -1 1 322.767 4.064 20 0 DIADMM C[C@H]1CC(C(=O)[O-])C[C@H](C)N1Cc1cc(Cl)ccc1Cl ZINC000530174247 1045616670 /nfs/dbraw/zinc/61/66/70/1045616670.db2.gz JEXIZSGYJYOHPI-UWVGGRQHSA-N -1 1 316.228 4.067 20 0 DIADMM COc1cccc(/C(C)=C\C(=O)Nc2ccc([O-])c(Cl)c2)c1 ZINC000751619327 1045621541 /nfs/dbraw/zinc/62/15/41/1045621541.db2.gz XGAJNHXGEKIICQ-FLIBITNWSA-N -1 1 317.772 4.096 20 0 DIADMM O=C([N-][C@H](C1CCCC1)C(F)(F)F)C(F)(F)c1ccccc1 ZINC000752470044 1045681373 /nfs/dbraw/zinc/68/13/73/1045681373.db2.gz NOSRDKQJSHCAKM-GFCCVEGCSA-N -1 1 321.289 4.016 20 0 DIADMM CC(C)c1cccc(S(=O)(=O)[N-]c2ccc3cc[nH]c3c2)c1 ZINC000193475845 1045707320 /nfs/dbraw/zinc/70/73/20/1045707320.db2.gz UTVQEKVQZXYRGR-UHFFFAOYSA-N -1 1 314.410 4.092 20 0 DIADMM Cc1cnc(Cl)c(NC(=O)Nc2ccc([O-])c(Cl)c2)c1 ZINC000753106060 1045725803 /nfs/dbraw/zinc/72/58/03/1045725803.db2.gz GHDAXOKIIYLZAS-UHFFFAOYSA-N -1 1 312.156 4.046 20 0 DIADMM O=C(c1c([O-])cnc2ccc(Cl)cc21)N1CCCCCCC1 ZINC000801600351 1045751046 /nfs/dbraw/zinc/75/10/46/1045751046.db2.gz FZUBDLBMRGNZPF-UHFFFAOYSA-N -1 1 318.804 4.000 20 0 DIADMM CCCc1cc(=O)[nH]c(C(=Cc2ccc([O-])c(F)c2F)CC)n1 ZINC000901502683 1045751686 /nfs/dbraw/zinc/75/16/86/1045751686.db2.gz MGEFDPVJRQGXIO-NTMALXAHSA-N -1 1 320.339 4.069 20 0 DIADMM CCCc1cc(=O)[nH]c(C(=Cc2ccc([O-])c(F)c2F)CC)n1 ZINC000901502682 1045752252 /nfs/dbraw/zinc/75/22/52/1045752252.db2.gz MGEFDPVJRQGXIO-CSKARUKUSA-N -1 1 320.339 4.069 20 0 DIADMM Cc1ccccc1[C@@H](C)N(C)C(=O)Cc1ccc([O-])c(Cl)c1 ZINC000630699903 1045775620 /nfs/dbraw/zinc/77/56/20/1045775620.db2.gz VZQWVUIJMXCFHH-CYBMUJFWSA-N -1 1 317.816 4.116 20 0 DIADMM O=c1cc(-c2ccccc2)nc(SC2CC(CF)(CF)C2)[n-]1 ZINC000901616509 1045778674 /nfs/dbraw/zinc/77/86/74/1045778674.db2.gz NEBLYSHOJDNJIK-UHFFFAOYSA-N -1 1 322.380 4.029 20 0 DIADMM C[C@H](CN1Cc2ccc(C(=O)[O-])cc2C1)c1cccc(Cl)c1 ZINC000901646519 1045782736 /nfs/dbraw/zinc/78/27/36/1045782736.db2.gz PXNRBESIJPUDAD-GFCCVEGCSA-N -1 1 315.800 4.158 20 0 DIADMM Cc1nc(SC[C@H]2CCCCC2(F)F)[n-]c(=O)c1C1CC1 ZINC000631023097 1045797463 /nfs/dbraw/zinc/79/74/63/1045797463.db2.gz HOJWAADEHHKAQD-LLVKDONJSA-N -1 1 314.401 4.286 20 0 DIADMM Cc1nc(SCc2cnc3ccccc3c2)[n-]c(=O)c1C1CC1 ZINC000631023889 1045798105 /nfs/dbraw/zinc/79/81/05/1045798105.db2.gz ZGBYAYFWAFCCAD-UHFFFAOYSA-N -1 1 323.421 4.209 20 0 DIADMM CC[C@H](NCc1cc(C)c(C(=O)[O-])o1)c1ccc(Cl)cc1 ZINC000902089008 1045910429 /nfs/dbraw/zinc/91/04/29/1045910429.db2.gz QWENILJUSBIPSV-AWEZNQCLSA-N -1 1 307.777 4.181 20 0 DIADMM CC[C@@H](NCc1cc(C(=O)[O-])c(C)o1)c1cccc(Cl)c1 ZINC000902107448 1045913007 /nfs/dbraw/zinc/91/30/07/1045913007.db2.gz CBJQIIZSSHHYRO-OAHLLOKOSA-N -1 1 307.777 4.181 20 0 DIADMM O=C(Cc1ccc(Cl)c(Cl)c1)Nc1ccc(F)cc1[O-] ZINC000531755825 1045917712 /nfs/dbraw/zinc/91/77/12/1045917712.db2.gz CXYYJGGBQPQMAA-UHFFFAOYSA-N -1 1 314.143 4.019 20 0 DIADMM Cc1ccccc1C[C@H](C)C(=O)Nc1ccc([O-])c(Cl)c1 ZINC001137674227 1045930157 /nfs/dbraw/zinc/93/01/57/1045930157.db2.gz LQSMNEBYYCTOGH-LBPRGKRZSA-N -1 1 303.789 4.171 20 0 DIADMM O=C(/C=C\CCc1ccccc1)Nc1ccc([O-])c(Cl)c1 ZINC001137674505 1045931044 /nfs/dbraw/zinc/93/10/44/1045931044.db2.gz WIOOTFNNWCKKBN-UITAMQMPSA-N -1 1 301.773 4.173 20 0 DIADMM CCSc1ccc([C@@H](C)NCc2cc(C(=O)[O-])c(C)o2)cc1 ZINC000902222338 1045949482 /nfs/dbraw/zinc/94/94/82/1045949482.db2.gz ZOEQPKIJBAPSQK-LLVKDONJSA-N -1 1 319.426 4.249 20 0 DIADMM Cc1cc(CN[C@@H]2CCCc3ccc(Cl)cc32)oc1C(=O)[O-] ZINC000902262353 1045959500 /nfs/dbraw/zinc/95/95/00/1045959500.db2.gz VTQRRKXRIMRITK-OAHLLOKOSA-N -1 1 319.788 4.107 20 0 DIADMM CC[C@H](CC(F)(F)F)c1nc(-c2ccc([O-])c(F)c2)no1 ZINC000453185050 1045971635 /nfs/dbraw/zinc/97/16/35/1045971635.db2.gz WWNLENJAGWSDHA-SSDOTTSWSA-N -1 1 304.243 4.027 20 0 DIADMM CC[C@H]1Cc2ccccc2CN1C(=O)c1c([O-])cccc1Cl ZINC001138069178 1046081941 /nfs/dbraw/zinc/08/19/41/1046081941.db2.gz GYHHXLKDMMZZTO-AWEZNQCLSA-N -1 1 315.800 4.023 20 0 DIADMM C[C@@H](C[N@@H+](C)[C@H](C(=O)[O-])c1c(F)cccc1Cl)C(C)(C)C ZINC000634697140 1046086854 /nfs/dbraw/zinc/08/68/54/1046086854.db2.gz BGUNEAXNECFOON-HZMBPMFUSA-N -1 1 315.816 4.219 20 0 DIADMM CC(C)(CC1CCCCCC1)NC(=O)c1ccc([O-])c(F)c1 ZINC001138278460 1046135887 /nfs/dbraw/zinc/13/58/87/1046135887.db2.gz QXUICNUEVXCNST-UHFFFAOYSA-N -1 1 307.409 4.400 20 0 DIADMM Cc1ccc(C(F)(F)C(=O)[N-][C@H](C(C)(C)C)C(F)(F)F)cc1 ZINC000779963803 1046179167 /nfs/dbraw/zinc/17/91/67/1046179167.db2.gz NJZOGYMKZDAZCU-LLVKDONJSA-N -1 1 323.305 4.180 20 0 DIADMM CCc1cc(=O)[n-]c(S[C@H]2CCc3cc(Cl)ccc32)n1 ZINC000795228512 1046211900 /nfs/dbraw/zinc/21/19/00/1046211900.db2.gz KBMCQCDVCKRRJK-ZDUSSCGKSA-N -1 1 306.818 4.178 20 0 DIADMM O=C([O-])[C@@H]1CCCCN1Cc1ccc(-c2ccccc2Cl)o1 ZINC000263387648 1046311130 /nfs/dbraw/zinc/31/11/30/1046311130.db2.gz DJFFIVUZQXROJU-HNNXBMFYSA-N -1 1 319.788 4.039 20 0 DIADMM CC[C@@]1(C)CCCN(Cc2occ(C(F)(F)F)c2C(=O)[O-])C1 ZINC000903890690 1046337070 /nfs/dbraw/zinc/33/70/70/1046337070.db2.gz CBVUWKUMBXOWCN-AWEZNQCLSA-N -1 1 319.323 4.009 20 0 DIADMM CC[C@@H]1CCC[C@H](C)N1Cc1occ(C(F)(F)F)c1C(=O)[O-] ZINC000903910235 1046340064 /nfs/dbraw/zinc/34/00/64/1046340064.db2.gz QYCFHXIFSZLVTC-VHSXEESVSA-N -1 1 319.323 4.150 20 0 DIADMM CC(C)c1ccc(NC(=O)Nc2c(F)cc([O-])cc2F)cc1 ZINC001202924172 1046431239 /nfs/dbraw/zinc/43/12/39/1046431239.db2.gz KHYRBRIBYVXPJX-UHFFFAOYSA-N -1 1 306.312 4.438 20 0 DIADMM CC(C)c1ccc(NC(=O)Nc2ccc([O-])c(F)c2F)cc1 ZINC001202924140 1046431572 /nfs/dbraw/zinc/43/15/72/1046431572.db2.gz CBIKRDHHQTVXMI-UHFFFAOYSA-N -1 1 306.312 4.438 20 0 DIADMM C[C@@H]1CCC[C@@H](CNC(=O)c2ccc3ccccc3c2[O-])[C@@H]1C ZINC001139524514 1046463444 /nfs/dbraw/zinc/46/34/44/1046463444.db2.gz SFAIHEJQOLRWGE-FMKPAKJESA-N -1 1 311.425 4.348 20 0 DIADMM CC(C)(CCC(=O)Nc1c([O-])cccc1F)c1ccccc1 ZINC000677204028 1046472851 /nfs/dbraw/zinc/47/28/51/1046472851.db2.gz AEGBNQVFRDUDLG-UHFFFAOYSA-N -1 1 301.361 4.228 20 0 DIADMM Cc1cc(C)cc(CN(C)C(=O)c2cc3ccccc3cc2[O-])c1 ZINC001140054118 1046579047 /nfs/dbraw/zinc/57/90/47/1046579047.db2.gz OVEQAKPXQLDTAA-UHFFFAOYSA-N -1 1 319.404 4.434 20 0 DIADMM CCOC(=O)[C@H](CC(C)C)Oc1cc([O-])c(Cl)cc1Cl ZINC001229409089 1046585038 /nfs/dbraw/zinc/58/50/38/1046585038.db2.gz BIUAROVFZVAGEX-ZDUSSCGKSA-N -1 1 321.200 4.056 20 0 DIADMM Cc1nc(-c2cccc(NCc3cccc([O-])c3Cl)c2)no1 ZINC000645167505 1046772702 /nfs/dbraw/zinc/77/27/02/1046772702.db2.gz GVEJLZYXJDVRJJ-UHFFFAOYSA-N -1 1 315.760 4.016 20 0 DIADMM CC1(C)CCCC[C@@H]1NC(=O)c1ccc(C(F)(F)F)c([O-])c1 ZINC001137373436 1046842092 /nfs/dbraw/zinc/84/20/92/1046842092.db2.gz ZEBFIDPDUITGAV-ZDUSSCGKSA-N -1 1 315.335 4.110 20 0 DIADMM CC(C)c1ccc(C(=O)Nc2nccc3ccccc32)c([O-])c1 ZINC001140695922 1046858205 /nfs/dbraw/zinc/85/82/05/1046858205.db2.gz KJVVHUCYZMBGNQ-UHFFFAOYSA-N -1 1 306.365 4.316 20 0 DIADMM Cc1nc(NC(=O)c2ccccc2[O-])sc1-c1ccccc1 ZINC000029913317 1046895040 /nfs/dbraw/zinc/89/50/40/1046895040.db2.gz XDEIIKZJAVSMDH-UHFFFAOYSA-N -1 1 310.378 4.076 20 0 DIADMM [O-]c1c(Cl)cc(CN2CC[C@H](c3ccncc3)C2)cc1Cl ZINC001140834667 1046922836 /nfs/dbraw/zinc/92/28/36/1046922836.db2.gz USFJJWSMCFGPSR-ZDUSSCGKSA-N -1 1 323.223 4.084 20 0 DIADMM COCC[C@H]1CCCCN1Cc1cc(Cl)c([O-])c(Cl)c1 ZINC001140834157 1046924580 /nfs/dbraw/zinc/92/45/80/1046924580.db2.gz ISOWAADRWXBZEQ-GFCCVEGCSA-N -1 1 318.244 4.090 20 0 DIADMM CC(=O)Oc1ccc(Nc2cc(Cl)cc(Cl)c2[O-])cc1 ZINC001212079615 1046929945 /nfs/dbraw/zinc/92/99/45/1046929945.db2.gz MGFKMNHAQSDIPR-UHFFFAOYSA-N -1 1 312.152 4.368 20 0 DIADMM [O-]c1ccc(CN2CCC[C@@H]2c2ccc(F)cc2)c(F)c1F ZINC001140889689 1046943352 /nfs/dbraw/zinc/94/33/52/1046943352.db2.gz JPGYOXJJDPCFRI-CQSZACIVSA-N -1 1 307.315 4.147 20 0 DIADMM [O-]c1ccc(CN2CCC[C@@H]2c2ccccc2F)c(F)c1F ZINC001140894388 1046945447 /nfs/dbraw/zinc/94/54/47/1046945447.db2.gz WIIKYXIITIDUEF-CQSZACIVSA-N -1 1 307.315 4.147 20 0 DIADMM Cc1c(CN2CCCC[C@H]2C(=O)[O-])sc2c1cccc2Cl ZINC000263413682 1046991347 /nfs/dbraw/zinc/99/13/47/1046991347.db2.gz MIKYMQWWJOYHNI-ZDUSSCGKSA-N -1 1 323.845 4.302 20 0 DIADMM O=C([N-]c1ccccc1SC(F)F)c1cc(C2CC2)no1 ZINC000799297952 1047014641 /nfs/dbraw/zinc/01/46/41/1047014641.db2.gz RPROBMNIQYJKNM-UHFFFAOYSA-N -1 1 310.325 4.119 20 0 DIADMM Cc1cc(C)c(NC(=O)c2ccc3ccccc3c2[O-])cc1O ZINC000680826990 1047051514 /nfs/dbraw/zinc/05/15/14/1047051514.db2.gz ZGHZRVHREVXCOB-UHFFFAOYSA-N -1 1 307.349 4.120 20 0 DIADMM CC(C)C[C@H](NC(=O)c1cccc([O-])c1F)c1ccccc1 ZINC001141246642 1047065072 /nfs/dbraw/zinc/06/50/72/1047065072.db2.gz UHHRWYFTDDSXCN-HNNXBMFYSA-N -1 1 301.361 4.049 20 0 DIADMM CC(C)C[C@H](NC(=O)c1ccc([O-])c(F)c1)c1ccccc1 ZINC000681014602 1047083138 /nfs/dbraw/zinc/08/31/38/1047083138.db2.gz QUZHNCRVFHGQBU-INIZCTEOSA-N -1 1 301.361 4.049 20 0 DIADMM Cc1ccc([C@H]2CCCN2C(=O)c2ccc([O-])c(F)c2)cc1C ZINC000681022936 1047083981 /nfs/dbraw/zinc/08/39/81/1047083981.db2.gz VEOSXTCKBRFWFX-QGZVFWFLSA-N -1 1 313.372 4.125 20 0 DIADMM CC(C)(C)[C@@H](NC(=O)c1ccc([O-])c(F)c1)c1ccc(F)cc1 ZINC000681020214 1047084078 /nfs/dbraw/zinc/08/40/78/1047084078.db2.gz UWARQORNGHLZSL-INIZCTEOSA-N -1 1 319.351 4.188 20 0 DIADMM O=C(N[C@@H](c1ccccc1)C1CCCC1)c1ccc([O-])c(F)c1 ZINC000681018434 1047085104 /nfs/dbraw/zinc/08/51/04/1047085104.db2.gz BTWWDJKCPOPOJG-SFHVURJKSA-N -1 1 313.372 4.193 20 0 DIADMM CC(C)(C)[C@H](NC(=O)c1ccc([O-])c(F)c1)c1ccc(F)cc1 ZINC000681020215 1047086000 /nfs/dbraw/zinc/08/60/00/1047086000.db2.gz UWARQORNGHLZSL-MRXNPFEDSA-N -1 1 319.351 4.188 20 0 DIADMM CC(C)[C@@H](c1ccccc1)N(C)C(=O)c1ccc([O-])c(F)c1 ZINC000681047514 1047087130 /nfs/dbraw/zinc/08/71/30/1047087130.db2.gz ZLRMWGSFPCETLR-KRWDZBQOSA-N -1 1 301.361 4.001 20 0 DIADMM O=C(N[C@@H](C1CCC1)C1CCCCC1)c1c(F)ccc([O-])c1F ZINC000649111964 1047106208 /nfs/dbraw/zinc/10/62/08/1047106208.db2.gz ITXBRUDKKDGNDA-QGZVFWFLSA-N -1 1 323.383 4.149 20 0 DIADMM CCC[C@H](C)[C@H]1CCCN1C(=O)Cc1ccc([O-])c(Cl)c1 ZINC001137435591 1047113392 /nfs/dbraw/zinc/11/33/92/1047113392.db2.gz AGOWRCHLFUKQRS-SWLSCSKDSA-N -1 1 309.837 4.015 20 0 DIADMM CCCC[C@@H](CC)CNC(=O)c1c([O-])cnc2c(F)cccc21 ZINC001141455086 1047136339 /nfs/dbraw/zinc/13/63/39/1047136339.db2.gz CDCPVICRRIEBIG-GFCCVEGCSA-N -1 1 318.392 4.026 20 0 DIADMM O=C(CCCCCc1ccc(F)cc1)Nc1c([O-])cccc1F ZINC000681742120 1047145686 /nfs/dbraw/zinc/14/56/86/1047145686.db2.gz FUIRZTOTFZHYFY-UHFFFAOYSA-N -1 1 319.351 4.412 20 0 DIADMM CCc1ccc(C(=O)N(C)c2cccc3ccccc32)c([O-])c1 ZINC000682474193 1047198140 /nfs/dbraw/zinc/19/81/40/1047198140.db2.gz VSZKWPGVLVYMQT-UHFFFAOYSA-N -1 1 305.377 4.384 20 0 DIADMM CCCn1c(C(=O)Nc2c([O-])cccc2F)cc2ccccc21 ZINC000682517441 1047200021 /nfs/dbraw/zinc/20/00/21/1047200021.db2.gz YGMQQPLMZJJRLX-UHFFFAOYSA-N -1 1 312.344 4.148 20 0 DIADMM COc1ccc([C@@H](C)NC(=O)c2cc3ccccc3cc2[O-])cc1 ZINC000325650270 1047203693 /nfs/dbraw/zinc/20/36/93/1047203693.db2.gz KPICKRQBKLQGKM-CYBMUJFWSA-N -1 1 321.376 4.045 20 0 DIADMM O=C([O-])C[C@@H]1CCCC[N@H+]1Cc1csc(C2CCCCC2)n1 ZINC000650506336 1047244652 /nfs/dbraw/zinc/24/46/52/1047244652.db2.gz IEMDMMGICLAYFC-HNNXBMFYSA-N -1 1 322.474 4.020 20 0 DIADMM O=C([O-])C[C@@H]1CCCCN1Cc1csc(C2CCCCC2)n1 ZINC000650506336 1047244657 /nfs/dbraw/zinc/24/46/57/1047244657.db2.gz IEMDMMGICLAYFC-HNNXBMFYSA-N -1 1 322.474 4.020 20 0 DIADMM C[C@@H]1C[C@H](C(C)(C)C)CCN1C(=O)c1cc(Cl)ccc1[O-] ZINC001141661457 1047251654 /nfs/dbraw/zinc/25/16/54/1047251654.db2.gz BJNAEIMXNGNPQJ-VXGBXAGGSA-N -1 1 309.837 4.332 20 0 DIADMM CCC[C@H](C(=O)[N-]OCCC(F)(F)F)c1ccc(Cl)cc1 ZINC000832552844 1047253417 /nfs/dbraw/zinc/25/34/17/1047253417.db2.gz IEOHQJHGIKAQND-LBPRGKRZSA-N -1 1 323.742 4.224 20 0 DIADMM CC(C)[C@H](C(=O)Nc1cc([O-])c(F)cc1F)c1ccccc1 ZINC001141834232 1047296621 /nfs/dbraw/zinc/29/66/21/1047296621.db2.gz XWVQJXXHGXHJFI-INIZCTEOSA-N -1 1 305.324 4.049 20 0 DIADMM CCc1nc(SCc2ccccc2C2CC2)[n-]c(=O)c1C ZINC001118479819 1047299069 /nfs/dbraw/zinc/29/90/69/1047299069.db2.gz VTZFOVAGPVZYID-UHFFFAOYSA-N -1 1 300.427 4.223 20 0 DIADMM O=S(=O)([N-]c1ccccc1Nc1ccccc1)c1ccccc1 ZINC000218535440 1047370058 /nfs/dbraw/zinc/37/00/58/1047370058.db2.gz FXKYTDSOHLNQJQ-UHFFFAOYSA-N -1 1 324.405 4.231 20 0 DIADMM C[C@]1(F)CCC[N@@H+](Cc2c(Cl)cc(O)cc2Cl)CC1 ZINC001142105641 1047380780 /nfs/dbraw/zinc/38/07/80/1047380780.db2.gz IKTBBODFCNWQAA-AWEZNQCLSA-N -1 1 306.208 4.413 20 0 DIADMM CCc1cc(C)c(-c2nc(-c3ccc([O-])cc3Cl)no2)o1 ZINC000445447753 1047421322 /nfs/dbraw/zinc/42/13/22/1047421322.db2.gz PQTGINNUHJNBIV-UHFFFAOYSA-N -1 1 304.733 4.226 20 0 DIADMM Cc1c(Cl)cc(Nc2cccc(CCO)c2)c([O-])c1Cl ZINC001203119348 1047421686 /nfs/dbraw/zinc/42/16/86/1047421686.db2.gz JRWITZMBXLAKCA-UHFFFAOYSA-N -1 1 312.196 4.286 20 0 DIADMM CCN(CC)c1ccc(C(=O)Nc2ccc([O-])c(Cl)c2)cc1 ZINC000749558457 1047426110 /nfs/dbraw/zinc/42/61/10/1047426110.db2.gz JVAWYIZSPYSPPV-UHFFFAOYSA-N -1 1 318.804 4.144 20 0 DIADMM Cc1c2cccc(C)c2oc1C(=O)Nc1cc(F)cc(F)c1[O-] ZINC001142542098 1047466649 /nfs/dbraw/zinc/46/66/49/1047466649.db2.gz MDLLNZRMXJGPQY-UHFFFAOYSA-N -1 1 317.291 4.286 20 0 DIADMM O=C(N[C@@H](CC1CCCCC1)c1ccccc1)c1ncccc1[O-] ZINC001143112783 1047532749 /nfs/dbraw/zinc/53/27/49/1047532749.db2.gz AZJQFPLGBGPSSM-KRWDZBQOSA-N -1 1 324.424 4.229 20 0 DIADMM O=C(NC[C@H]1C[C@@H]1c1ccccc1)c1ccc2ccccc2c1[O-] ZINC001143195870 1047539910 /nfs/dbraw/zinc/53/99/10/1047539910.db2.gz NXWCACSBNRSETK-VQIMIIECSA-N -1 1 317.388 4.079 20 0 DIADMM O=C(c1ccc2cccnc2c1[O-])N1CCC[C@H]1C1CCCCC1 ZINC001149319862 1047559878 /nfs/dbraw/zinc/55/98/78/1047559878.db2.gz IHIMYPJOXJSQAR-KRWDZBQOSA-N -1 1 324.424 4.125 20 0 DIADMM Cc1cc(F)cc(NC(=O)c2ccc(C(F)(F)F)cc2[O-])c1 ZINC001150023158 1047572946 /nfs/dbraw/zinc/57/29/46/1047572946.db2.gz VUIGRTHYYJNKFD-UHFFFAOYSA-N -1 1 313.250 4.111 20 0 DIADMM CC(C)c1ccc(C[C@@H](C)NC(=O)c2cccc([O-])c2F)cc1 ZINC001151003898 1047589493 /nfs/dbraw/zinc/58/94/93/1047589493.db2.gz ARMBUMSBKLXPQH-CYBMUJFWSA-N -1 1 315.388 4.016 20 0 DIADMM CCN(c1ccc(C(=O)Nc2cccc(F)c2[O-])cc1)C(C)C ZINC001151773034 1047601535 /nfs/dbraw/zinc/60/15/35/1047601535.db2.gz WNAYVWWMIPDUMF-UHFFFAOYSA-N -1 1 316.376 4.018 20 0 DIADMM O=C(Nc1cccc(F)c1[O-])c1cccc2c3c([nH]c21)CCCC3 ZINC001151771167 1047601597 /nfs/dbraw/zinc/60/15/97/1047601597.db2.gz CBTRYZCWFGVEMY-UHFFFAOYSA-N -1 1 324.355 4.144 20 0 DIADMM O=C(c1cc(Cl)ccc1[O-])N1CCC[C@@H](C2CCC2)CC1 ZINC001152804068 1047615822 /nfs/dbraw/zinc/61/58/22/1047615822.db2.gz UFRNNUXESCLYGW-CYBMUJFWSA-N -1 1 307.821 4.088 20 0 DIADMM O=C(N[C@@H](CC1CCC1)c1ccccc1)c1c([O-])cccc1F ZINC001152853125 1047616406 /nfs/dbraw/zinc/61/64/06/1047616406.db2.gz WGQMWHBBLYHNDM-INIZCTEOSA-N -1 1 313.372 4.193 20 0 DIADMM CCCc1csc(NC(=O)c2ccc3ccccc3c2[O-])n1 ZINC001153364135 1047622664 /nfs/dbraw/zinc/62/26/64/1047622664.db2.gz FGBURPHGZHDQRH-UHFFFAOYSA-N -1 1 312.394 4.207 20 0 DIADMM O=C(/C=C/c1ccc(Cl)cc1)NCc1ccc([O-])c(Cl)c1 ZINC001154105627 1047640205 /nfs/dbraw/zinc/64/02/05/1047640205.db2.gz JYIXCFHATXMRGC-XBXARRHUSA-N -1 1 322.191 4.029 20 0 DIADMM CC(C)(C)[C@H]1CCC[C@@H](NC(=O)c2c([O-])cccc2F)CC1 ZINC001154445051 1047648588 /nfs/dbraw/zinc/64/85/88/1047648588.db2.gz NGOYYBFXFJJUPC-QWHCGFSZSA-N -1 1 307.409 4.256 20 0 DIADMM Cc1ccc2ncc([O-])c(C(=O)Nc3ncccc3C(C)C)c2c1 ZINC001154529416 1047650761 /nfs/dbraw/zinc/65/07/61/1047650761.db2.gz JZUZHQSDTABTCY-UHFFFAOYSA-N -1 1 321.380 4.020 20 0 DIADMM CC(C)(C)[C@@H]1CN(C(=O)c2cccc([O-])c2F)c2ccccc21 ZINC001156190946 1047705640 /nfs/dbraw/zinc/70/56/40/1047705640.db2.gz NZMXHBTVAKXHPW-CQSZACIVSA-N -1 1 313.372 4.321 20 0 DIADMM CC(C)[C@H]1CN(C(=O)c2cc3ccccc3cc2[O-])[C@H]1C(C)C ZINC001157778643 1047754665 /nfs/dbraw/zinc/75/46/65/1047754665.db2.gz VCBLWRQYTMYDQD-MJGOQNOKSA-N -1 1 311.425 4.298 20 0 DIADMM CC(C)[C@@H]1CN(C(=O)c2cc3ccccc3cc2[O-])[C@H]1C(C)C ZINC001157778641 1047754794 /nfs/dbraw/zinc/75/47/94/1047754794.db2.gz VCBLWRQYTMYDQD-HKUYNNGSSA-N -1 1 311.425 4.298 20 0 DIADMM Cc1nc2c(cccc2NC(=O)c2ccc3ccccc3c2[O-])o1 ZINC001157834369 1047757686 /nfs/dbraw/zinc/75/76/86/1047757686.db2.gz YQWDWUOIDLXHSO-UHFFFAOYSA-N -1 1 318.332 4.247 20 0 DIADMM C[C@H](NC(=O)c1cccc([O-])c1F)c1csc2ccccc21 ZINC001158797995 1047799173 /nfs/dbraw/zinc/79/91/73/1047799173.db2.gz JILCKNLWUDBTFV-JTQLQIEISA-N -1 1 315.369 4.237 20 0 DIADMM Fc1ccc2oc([N-]c3cc([C@H]4CCCCN4)no3)cc2c1 ZINC001159312629 1047829758 /nfs/dbraw/zinc/82/97/58/1047829758.db2.gz DAPGQMAXZZJGOO-GFCCVEGCSA-N -1 1 301.321 4.118 20 0 DIADMM Nc1nc(Cl)ccc1Nc1cc(Cl)c([O-])c(Cl)c1 ZINC001159379357 1047837547 /nfs/dbraw/zinc/83/75/47/1047837547.db2.gz KHRPMHSLHIGHBI-UHFFFAOYSA-N -1 1 304.564 4.073 20 0 DIADMM O=C(N[C@H]1CCc2cc(Cl)ccc21)c1ccc(Cl)cc1[O-] ZINC001151300437 1047859747 /nfs/dbraw/zinc/85/97/47/1047859747.db2.gz LWPWMCNHUDIYGY-AWEZNQCLSA-N -1 1 322.191 4.116 20 0 DIADMM COc1cc(Nc2ccc(Cl)c(Cl)c2[O-])ccc1O ZINC001174542722 1047868879 /nfs/dbraw/zinc/86/88/79/1047868879.db2.gz DSRFKOOUKZHJFW-UHFFFAOYSA-N -1 1 300.141 4.157 20 0 DIADMM CCNC(=O)Nc1ccc(Nc2cc([O-])c(Cl)cc2F)cc1 ZINC001174520246 1047883454 /nfs/dbraw/zinc/88/34/54/1047883454.db2.gz LJSANNCBUJXHIO-UHFFFAOYSA-N -1 1 323.755 4.070 20 0 DIADMM CCCCCOc1ccc(C(=O)Nc2ccc(F)cc2[O-])cc1 ZINC001183054211 1047884687 /nfs/dbraw/zinc/88/46/87/1047884687.db2.gz GLBSLPNKEUHTLU-UHFFFAOYSA-N -1 1 317.360 4.353 20 0 DIADMM [O-]c1cc(Nc2ccc(N3CCCCC3)nc2)c(F)cc1Cl ZINC001174524235 1047888607 /nfs/dbraw/zinc/88/86/07/1047888607.db2.gz JMFUUCRWVZWMQI-UHFFFAOYSA-N -1 1 321.783 4.314 20 0 DIADMM O=C(Nc1nc(Cl)ccc1[O-])c1cc(C2CC2)oc1C1CC1 ZINC001183218870 1047905382 /nfs/dbraw/zinc/90/53/82/1047905382.db2.gz QFUZUKPETDPHTM-UHFFFAOYSA-N -1 1 318.760 4.041 20 0 DIADMM C[C@@H]1C[C@@H](CC(=O)Nc2nc(Cl)ccc2[O-])CC(C)(C)C1 ZINC001183210780 1047909683 /nfs/dbraw/zinc/90/96/83/1047909683.db2.gz YFMRETBQZMNMJG-MNOVXSKESA-N -1 1 310.825 4.232 20 0 DIADMM COc1c(F)ccc(F)c1Nc1cc([O-])c(Cl)cc1F ZINC001174662613 1047940854 /nfs/dbraw/zinc/94/08/54/1047940854.db2.gz LLVOZHRBGBLOAJ-UHFFFAOYSA-N -1 1 303.667 4.215 20 0 DIADMM Cc1cccc(C)c1NC(=S)Nc1cc(F)cc(F)c1[O-] ZINC001198372186 1047948773 /nfs/dbraw/zinc/94/87/73/1047948773.db2.gz XMRCSZBOXOQIMO-UHFFFAOYSA-N -1 1 308.353 4.096 20 0 DIADMM O=c1ccn(-c2ccc(Nc3ccc(C(F)F)cc3)cc2)[n-]1 ZINC001174719871 1047953151 /nfs/dbraw/zinc/95/31/51/1047953151.db2.gz MWEATUGNDQXNON-UHFFFAOYSA-N -1 1 301.296 4.259 20 0 DIADMM Cc1c(Cl)cccc1[N-]S(=O)(=O)c1ccc2occc2c1 ZINC001198817117 1048010516 /nfs/dbraw/zinc/01/05/16/1048010516.db2.gz WXJIEOPHPQSEPK-UHFFFAOYSA-N -1 1 321.785 4.195 20 0 DIADMM O=S(=O)([N-]c1cccc2ccccc21)c1ccc2occc2c1 ZINC001198859136 1048012402 /nfs/dbraw/zinc/01/24/02/1048012402.db2.gz QIULKZGZHXQPBZ-UHFFFAOYSA-N -1 1 323.373 4.387 20 0 DIADMM O=S(=O)([N-]c1cccc(C2CC2)c1)c1ccc2occc2c1 ZINC001198868615 1048014151 /nfs/dbraw/zinc/01/41/51/1048014151.db2.gz KCRUBWYLCOYVCN-UHFFFAOYSA-N -1 1 313.378 4.111 20 0 DIADMM CCCc1cccc([N-]S(=O)(=O)c2ccc3occc3c2)c1 ZINC001198869212 1048014633 /nfs/dbraw/zinc/01/46/33/1048014633.db2.gz AZIRTZNCAFTVFF-UHFFFAOYSA-N -1 1 315.394 4.186 20 0 DIADMM CCCCOc1ccc(C(=O)Nc2ccc(CC)cc2)c([O-])c1 ZINC001160373458 1048041493 /nfs/dbraw/zinc/04/14/93/1048041493.db2.gz LJLBUXZDZUKLRY-UHFFFAOYSA-N -1 1 313.397 4.386 20 0 DIADMM Cc1cccc(Cl)c1NC(=O)Nc1cc(F)c(F)cc1[O-] ZINC001184537436 1048051124 /nfs/dbraw/zinc/05/11/24/1048051124.db2.gz KBINCULEVVUEJR-UHFFFAOYSA-N -1 1 312.703 4.276 20 0 DIADMM CCc1onc(C)c1[N-]C(=O)c1ccc(SC(F)(F)F)o1 ZINC000867037772 1048102217 /nfs/dbraw/zinc/10/22/17/1048102217.db2.gz DOZULZCINSMNLK-UHFFFAOYSA-N -1 1 320.292 4.003 20 0 DIADMM O=C(Nc1ccc(F)cc1[O-])[C@@H]1C[C@H]1c1cccc2ccccc21 ZINC001161035891 1048104193 /nfs/dbraw/zinc/10/41/93/1048104193.db2.gz VDPPVAUWVPMJFK-DLBZAZTESA-N -1 1 321.351 4.427 20 0 DIADMM [O-]c1c(Cl)c(Cl)ccc1Nc1cccnc1N1CCCC1 ZINC001184965189 1048108100 /nfs/dbraw/zinc/10/81/00/1048108100.db2.gz SZMCITICMKEIIP-UHFFFAOYSA-N -1 1 324.211 4.438 20 0 DIADMM [O-]c1c(Cl)c(Cl)ccc1Nc1c(F)cc(O)cc1F ZINC001175100115 1048116055 /nfs/dbraw/zinc/11/60/55/1048116055.db2.gz WEXYUYHROLKWRW-UHFFFAOYSA-N -1 1 306.095 4.426 20 0 DIADMM [O-]c1cc(NC(=S)NCC2CCCCC2)c(F)cc1Cl ZINC001199922381 1048118104 /nfs/dbraw/zinc/11/81/04/1048118104.db2.gz CDOGIDWXYMYVET-UHFFFAOYSA-N -1 1 316.829 4.051 20 0 DIADMM Cc1ccccc1CSCc1cc(=O)oc2cc([O-])ccc12 ZINC000005368080 1048146758 /nfs/dbraw/zinc/14/67/58/1048146758.db2.gz HNJRRQYBTKCDES-UHFFFAOYSA-N -1 1 312.390 4.240 20 0 DIADMM Cc1ccc(F)c(NC(=O)Nc2cc([O-])c(Cl)cc2F)c1 ZINC001185254690 1048152519 /nfs/dbraw/zinc/15/25/19/1048152519.db2.gz AZBUWSANJPDJSP-UHFFFAOYSA-N -1 1 312.703 4.276 20 0 DIADMM CCOc1ccc(C)cc1Nc1ccc(-n2ccc(=O)[n-]2)cc1 ZINC001175128235 1048155227 /nfs/dbraw/zinc/15/52/27/1048155227.db2.gz MSDCNTMJPSMNHW-UHFFFAOYSA-N -1 1 309.369 4.029 20 0 DIADMM Cc1ccc(CNC(=O)Nc2cccc(C(F)(F)F)c2[O-])cc1 ZINC001185410296 1048178963 /nfs/dbraw/zinc/17/89/63/1048178963.db2.gz VEZASKBZPWFEEU-UHFFFAOYSA-N -1 1 324.302 4.041 20 0 DIADMM COc1cccc([O-])c1C(=O)Nc1ccc(Cl)c(SC)c1 ZINC001161863925 1048187237 /nfs/dbraw/zinc/18/72/37/1048187237.db2.gz GCJSABFJRBNEHB-UHFFFAOYSA-N -1 1 323.801 4.028 20 0 DIADMM [O-]c1cc(Nc2cccc(O[C@@H]3CCCCO3)c2)cc(F)c1F ZINC001175186031 1048188443 /nfs/dbraw/zinc/18/84/43/1048188443.db2.gz DETTYEXKUJRUMA-MRXNPFEDSA-N -1 1 321.323 4.319 20 0 DIADMM C=Cc1cccc([N-]S(=O)(=O)c2ccc(Cl)c(C)c2)c1 ZINC001185529704 1048192307 /nfs/dbraw/zinc/19/23/07/1048192307.db2.gz LGUAYOXNINSVMI-UHFFFAOYSA-N -1 1 307.802 4.092 20 0 DIADMM Cc1cc(C)cc(NC(=S)Nc2cccc([O-])c2Cl)c1 ZINC001201205106 1048217528 /nfs/dbraw/zinc/21/75/28/1048217528.db2.gz MULKDUDOKWZDSS-UHFFFAOYSA-N -1 1 306.818 4.471 20 0 DIADMM CC(=O)c1ccc(F)c(Nc2nc3c(cccc3[O-])s2)c1 ZINC001175273601 1048223038 /nfs/dbraw/zinc/22/30/38/1048223038.db2.gz XDWNGAWLSQEZIK-UHFFFAOYSA-N -1 1 302.330 4.087 20 0 DIADMM O=C(NC(C1CCCC1)C1CCCC1)c1ccc([O-])cc1F ZINC000776149868 1048229324 /nfs/dbraw/zinc/22/93/24/1048229324.db2.gz YOVJANGVVRJWFG-UHFFFAOYSA-N -1 1 305.393 4.010 20 0 DIADMM O=c1oc2cc([O-])ccc2cc1Nc1cc(Cl)ccc1F ZINC001175298445 1048239183 /nfs/dbraw/zinc/23/91/83/1048239183.db2.gz DSEYLXALQYBVAP-UHFFFAOYSA-N -1 1 305.692 4.035 20 0 DIADMM Cc1c([N-]c2nnc(C(C)(C)C)s2)cnn1-c1ccccc1 ZINC001201363473 1048239923 /nfs/dbraw/zinc/23/99/23/1048239923.db2.gz YEWIMNKKBPRVBH-UHFFFAOYSA-N -1 1 313.430 4.073 20 0 DIADMM C/C(=C/c1ccc(Cl)cc1)C(=O)Nc1cc(F)cc(F)c1[O-] ZINC001162290589 1048257288 /nfs/dbraw/zinc/25/72/88/1048257288.db2.gz BEMWLOQRGPOKDP-TWGQIWQCSA-N -1 1 323.726 4.366 20 0 DIADMM C[S@@](=O)c1ccccc1Nc1ccc(Cl)c(Cl)c1[O-] ZINC001175311458 1048259550 /nfs/dbraw/zinc/25/95/50/1048259550.db2.gz RIKDDLDJZLFTCG-LJQANCHMSA-N -1 1 316.209 4.180 20 0 DIADMM CCNc1ccnc(Cl)c1Nc1c(F)ccc([O-])c1Cl ZINC001250228815 1048263837 /nfs/dbraw/zinc/26/38/37/1048263837.db2.gz LUEQSSJROKUJPT-UHFFFAOYSA-N -1 1 316.163 4.409 20 0 DIADMM [O-]c1ccc(F)c(Nc2csc(Br)n2)c1Cl ZINC001250228994 1048264443 /nfs/dbraw/zinc/26/44/43/1048264443.db2.gz ROHVGIHLSBLLKR-UHFFFAOYSA-N -1 1 323.574 4.147 20 0 DIADMM [O-]c1c(Cl)c(Cl)ccc1Nc1ccc(N2CCCC2)nc1 ZINC001175349601 1048271016 /nfs/dbraw/zinc/27/10/16/1048271016.db2.gz AJANWPAMZMNZPK-UHFFFAOYSA-N -1 1 324.211 4.438 20 0 DIADMM CN1CCCc2ccc(Nc3c(F)ccc([O-])c3Cl)cc21 ZINC001250233524 1048271981 /nfs/dbraw/zinc/27/19/81/1048271981.db2.gz QJYZOPFTOQDIEC-UHFFFAOYSA-N -1 1 306.768 4.311 20 0 DIADMM CC(C)Nc1ccc(Nc2cc3ccc([O-])cc3oc2=O)cc1 ZINC001201490664 1048282836 /nfs/dbraw/zinc/28/28/36/1048282836.db2.gz JBZSRPHAACJUNE-UHFFFAOYSA-N -1 1 310.353 4.063 20 0 DIADMM Cc1c(Cl)cc(N)cc1Nc1c(F)ccc([O-])c1Cl ZINC001250235797 1048290528 /nfs/dbraw/zinc/29/05/28/1048290528.db2.gz BFSBFARXTMDNCJ-UHFFFAOYSA-N -1 1 301.148 4.472 20 0 DIADMM O=C(N[C@H](c1ccccc1)C1CCCC1)c1ccc([O-])cc1F ZINC001186339663 1048290916 /nfs/dbraw/zinc/29/09/16/1048290916.db2.gz NOESBTOMBFQFCR-GOSISDBHSA-N -1 1 313.372 4.193 20 0 DIADMM Cn1ncc2cc(Nc3cc(Cl)c([O-])cc3Cl)ccc21 ZINC001175421493 1048301036 /nfs/dbraw/zinc/30/10/36/1048301036.db2.gz ZUCXMGVQSPAANK-UHFFFAOYSA-N -1 1 308.168 4.329 20 0 DIADMM Brc1ccc2nc([N-]c3cncs3)sc2c1 ZINC001175496122 1048329262 /nfs/dbraw/zinc/32/92/62/1048329262.db2.gz SPFZGXHFFUMSJZ-UHFFFAOYSA-N -1 1 312.217 4.259 20 0 DIADMM CSc1ccccc1NC(=O)Nc1cc(F)c(F)cc1[O-] ZINC001186745957 1048337086 /nfs/dbraw/zinc/33/70/86/1048337086.db2.gz OLMNOVUDBBXWMT-UHFFFAOYSA-N -1 1 310.325 4.036 20 0 DIADMM CC1(C)C[C@@H](c2ccccc2)N(C(=O)c2ccc([O-])c(F)c2)C1 ZINC001162711836 1048340624 /nfs/dbraw/zinc/34/06/24/1048340624.db2.gz DJGXDPOQBYVIBN-INIZCTEOSA-N -1 1 313.372 4.145 20 0 DIADMM [O-]c1c(Br)ccc(Cl)c1Nc1cncs1 ZINC001175508119 1048344163 /nfs/dbraw/zinc/34/41/63/1048344163.db2.gz PEOMBRKUNYZLKJ-UHFFFAOYSA-N -1 1 305.584 4.008 20 0 DIADMM Cc1c([N-]c2nc3ccccc3o2)cnn1-c1ccc(F)cc1 ZINC001186913702 1048359580 /nfs/dbraw/zinc/35/95/80/1048359580.db2.gz HOMCWLKELBDSBC-UHFFFAOYSA-N -1 1 308.316 4.205 20 0 DIADMM O=c1[nH]c2ccccc2cc1Nc1cc([O-])c(Cl)cc1F ZINC001201759463 1048369246 /nfs/dbraw/zinc/36/92/46/1048369246.db2.gz YTZFNCPJOWCRQM-UHFFFAOYSA-N -1 1 304.708 4.182 20 0 DIADMM CS[C@H](C)CC(=O)Nc1cc(Cl)c([O-])c2ccccc12 ZINC000600135050 1048371731 /nfs/dbraw/zinc/37/17/31/1048371731.db2.gz BUIAOBXQAJUGCI-SECBINFHSA-N -1 1 309.818 4.279 20 0 DIADMM O=C(Nc1cc(F)cc(F)c1)Nc1cc([O-])c(Cl)cc1F ZINC001187570349 1048411633 /nfs/dbraw/zinc/41/16/33/1048411633.db2.gz PYAPGXXOBCZKEI-UHFFFAOYSA-N -1 1 316.666 4.107 20 0 DIADMM CCC[C@H](C)c1cc(NC(=O)c2ccc(C(C)C)cc2[O-])n[nH]1 ZINC001163271821 1048447087 /nfs/dbraw/zinc/44/70/87/1048447087.db2.gz LTNISPHCTBNGBV-LBPRGKRZSA-N -1 1 315.417 4.395 20 0 DIADMM CCOc1ccccc1NC(=O)Nc1cccc([O-])c1Cl ZINC001202148070 1048463798 /nfs/dbraw/zinc/46/37/98/1048463798.db2.gz RBSOJBOTJFLNPL-UHFFFAOYSA-N -1 1 306.749 4.088 20 0 DIADMM O=C(Nc1cccc(F)c1[O-])Nc1ccccc1C(F)(F)F ZINC001202168193 1048470348 /nfs/dbraw/zinc/47/03/48/1048470348.db2.gz ZWBCULGDAHHYJZ-UHFFFAOYSA-N -1 1 314.238 4.194 20 0 DIADMM Cc1ccccc1NC(=O)Nc1cccc(C(F)(F)F)c1[O-] ZINC001202187144 1048475154 /nfs/dbraw/zinc/47/51/54/1048475154.db2.gz VQVTXXBGIILATK-UHFFFAOYSA-N -1 1 310.275 4.363 20 0 DIADMM O=C(Nc1cc(F)c([O-])cc1F)Nc1cccc(Cl)c1F ZINC001188411262 1048513104 /nfs/dbraw/zinc/51/31/04/1048513104.db2.gz QZKGCWJBKXNOCW-UHFFFAOYSA-N -1 1 316.666 4.107 20 0 DIADMM [O-]c1c(Br)ccc(Cl)c1Nc1cscn1 ZINC001175946505 1048523561 /nfs/dbraw/zinc/52/35/61/1048523561.db2.gz WRXOYRGTWLRQEB-UHFFFAOYSA-N -1 1 305.584 4.008 20 0 DIADMM O=C(Nc1ccc2ccccc2c1)Nc1c(F)cc([O-])cc1F ZINC001188608776 1048526487 /nfs/dbraw/zinc/52/64/87/1048526487.db2.gz JEKTVSVIEGWTJT-UHFFFAOYSA-N -1 1 314.291 4.468 20 0 DIADMM CC(C)CCOc1ccc(NC(=O)c2ccccc2[O-])cc1F ZINC001163924465 1048549710 /nfs/dbraw/zinc/54/97/10/1048549710.db2.gz JTTSRNGJSNWJLD-UHFFFAOYSA-N -1 1 317.360 4.209 20 0 DIADMM COc1cc(Nc2cc([O-])c(Cl)cc2F)c(F)cc1F ZINC001176110114 1048569027 /nfs/dbraw/zinc/56/90/27/1048569027.db2.gz VDWUDBOESBOLQX-UHFFFAOYSA-N -1 1 303.667 4.215 20 0 DIADMM O=C(Nc1cc(F)c([O-])cc1F)Nc1cccc2ccccc21 ZINC001188944157 1048570138 /nfs/dbraw/zinc/57/01/38/1048570138.db2.gz VRGSJKLTOKIMDN-UHFFFAOYSA-N -1 1 314.291 4.468 20 0 DIADMM Cc1ccc2ccc(F)c(Nc3ccc(F)c(F)c3[O-])c2n1 ZINC001176119248 1048574562 /nfs/dbraw/zinc/57/45/62/1048574562.db2.gz QFEBUFXWMQKHTC-UHFFFAOYSA-N -1 1 304.271 4.410 20 0 DIADMM [O-]c1cc(Nc2cnn(Cc3cccs3)c2)c(F)cc1Cl ZINC001176162247 1048600715 /nfs/dbraw/zinc/60/07/15/1048600715.db2.gz QPTLHFYONVKREV-UHFFFAOYSA-N -1 1 323.780 4.235 20 0 DIADMM Cc1cc(C(F)(F)F)ccc1[N-]c1nnc(-c2ccco2)o1 ZINC001176204750 1048602934 /nfs/dbraw/zinc/60/29/34/1048602934.db2.gz HNAQSPXKWUEMTD-UHFFFAOYSA-N -1 1 309.247 4.400 20 0 DIADMM CC1(C)CCC(CSc2nc(C(F)F)cc(=O)[n-]2)CC1 ZINC001189476468 1048628904 /nfs/dbraw/zinc/62/89/04/1048628904.db2.gz MIYGQRGJWSWLBD-UHFFFAOYSA-N -1 1 302.390 4.428 20 0 DIADMM CCCc1cc(=O)[n-]c(SCC[C@@H]2CCc3ccccc32)n1 ZINC001164551151 1048640287 /nfs/dbraw/zinc/64/02/87/1048640287.db2.gz HSOWLAKFYHMJKE-AWEZNQCLSA-N -1 1 314.454 4.347 20 0 DIADMM CCc1cccc(CC)c1NC(=O)Nc1cc(F)c([O-])cc1F ZINC001189772971 1048663630 /nfs/dbraw/zinc/66/36/30/1048663630.db2.gz SQBNJJFXSXODIX-UHFFFAOYSA-N -1 1 320.339 4.439 20 0 DIADMM O=c1ccn(-c2ccc(Nc3cccc(OCC4CC4)c3)cc2)[n-]1 ZINC001176497999 1048701189 /nfs/dbraw/zinc/70/11/89/1048701189.db2.gz UWDXRSCXLMGTRY-UHFFFAOYSA-N -1 1 321.380 4.110 20 0 DIADMM COC(=O)c1c[n-]c(S[C@H](C)c2ccc(C(C)(C)C)cc2)n1 ZINC001166030957 1048730964 /nfs/dbraw/zinc/73/09/64/1048730964.db2.gz YGUADJMAKRZIFU-LLVKDONJSA-N -1 1 318.442 4.347 20 0 DIADMM COC(=O)c1c[n-]c(SCc2c(C)c(C)c(C)c(C)c2C)n1 ZINC001166030237 1048731132 /nfs/dbraw/zinc/73/11/32/1048731132.db2.gz NHAAPTFVAISJOP-UHFFFAOYSA-N -1 1 318.442 4.031 20 0 DIADMM Cc1cccc(C)c1[C@H]1CCCN1C(=O)c1ccc([O-])cc1F ZINC001166231786 1048742430 /nfs/dbraw/zinc/74/24/30/1048742430.db2.gz GZBLAPGXSIZHON-QGZVFWFLSA-N -1 1 313.372 4.125 20 0 DIADMM Cc1c(Cl)cccc1[N-]S(=O)(=O)c1ccc(C2CC2)cc1 ZINC001190464831 1048742340 /nfs/dbraw/zinc/74/23/40/1048742340.db2.gz WQXYOADGKSFUKV-UHFFFAOYSA-N -1 1 321.829 4.327 20 0 DIADMM O=c1cc(C(F)F)nc(SCC[C@@H]2CCc3ccccc32)[n-]1 ZINC001166294491 1048742953 /nfs/dbraw/zinc/74/29/53/1048742953.db2.gz IVZWIUXIJSOFDP-NSHDSACASA-N -1 1 322.380 4.332 20 0 DIADMM COc1ccc2ncc(Nc3c(F)cc(F)c([O-])c3F)cc2c1 ZINC001176664867 1048752724 /nfs/dbraw/zinc/75/27/24/1048752724.db2.gz WNMJUUXKPYBJEY-UHFFFAOYSA-N -1 1 320.270 4.110 20 0 DIADMM CC(C)(C)c1cc(Nc2c(F)cc(F)c([O-])c2F)sn1 ZINC001176664655 1048752908 /nfs/dbraw/zinc/75/29/08/1048752908.db2.gz WUIAQOGMPGWQOJ-UHFFFAOYSA-N -1 1 302.321 4.307 20 0 DIADMM [O-]c1c(F)cc(F)c(Nc2cc(Cl)cnc2Cl)c1F ZINC001176664394 1048753100 /nfs/dbraw/zinc/75/31/00/1048753100.db2.gz XRFMSBZTVAJZMP-UHFFFAOYSA-N -1 1 309.074 4.255 20 0 DIADMM CCOc1cc(F)ccc1Nc1c(F)cc(F)c([O-])c1F ZINC001176669487 1048753200 /nfs/dbraw/zinc/75/32/00/1048753200.db2.gz IGGPBWOGJZUFJA-UHFFFAOYSA-N -1 1 301.239 4.091 20 0 DIADMM O=C1CCCc2ccc(Nc3c(F)cc(F)c([O-])c3F)cc21 ZINC001176671729 1048754241 /nfs/dbraw/zinc/75/42/41/1048754241.db2.gz MUNNKPPHUBJMNS-UHFFFAOYSA-N -1 1 307.271 4.072 20 0 DIADMM [O-]c1c(F)cc(F)c(Nc2cc3ocnc3cc2Cl)c1F ZINC001176670134 1048754369 /nfs/dbraw/zinc/75/43/69/1048754369.db2.gz AALCJUVGBFETFF-UHFFFAOYSA-N -1 1 314.650 4.348 20 0 DIADMM [O-]c1c(F)cc(F)c(Nc2ccc(OCC3CC3)cc2)c1F ZINC001176670142 1048756070 /nfs/dbraw/zinc/75/60/70/1048756070.db2.gz AISGDVCYHCWDSN-UHFFFAOYSA-N -1 1 309.287 4.342 20 0 DIADMM [O-]c1c(F)cc(F)c(Nc2c(F)cc(F)cc2Cl)c1F ZINC001176672335 1048756218 /nfs/dbraw/zinc/75/62/18/1048756218.db2.gz GJYCXKVJTSXNTC-UHFFFAOYSA-N -1 1 309.621 4.485 20 0 DIADMM [O-]c1c(F)cc(F)c(Nc2ccccc2OC(F)F)c1F ZINC001176672513 1048757550 /nfs/dbraw/zinc/75/75/50/1048757550.db2.gz YYJKMLNMUGVUBE-UHFFFAOYSA-N -1 1 305.202 4.155 20 0 DIADMM Cc1c(C)c(Nc2c(F)cc(F)c([O-])c2F)c(C)c(C)c1N ZINC001176673054 1048757688 /nfs/dbraw/zinc/75/76/88/1048757688.db2.gz DGOZEQSHEXECKG-UHFFFAOYSA-N -1 1 310.319 4.369 20 0 DIADMM CC(C)Oc1ccc(Nc2c(F)cc(F)c([O-])c2F)cc1F ZINC001176673397 1048757775 /nfs/dbraw/zinc/75/77/75/1048757775.db2.gz FQMGLFABUPIQSL-UHFFFAOYSA-N -1 1 315.266 4.479 20 0 DIADMM CC(C)Oc1c(F)cccc1Nc1c(F)cc(F)c([O-])c1F ZINC001176673793 1048757958 /nfs/dbraw/zinc/75/79/58/1048757958.db2.gz LWDFYTWVJBLCPY-UHFFFAOYSA-N -1 1 315.266 4.479 20 0 DIADMM COc1ccc2cc(Nc3c(F)cc(F)c([O-])c3F)ccc2n1 ZINC001176673365 1048758803 /nfs/dbraw/zinc/75/88/03/1048758803.db2.gz UEBITCYNAMWUSJ-UHFFFAOYSA-N -1 1 320.270 4.110 20 0 DIADMM [O-]c1c(F)cc(F)c(Nc2cnc(-c3ccccc3)cn2)c1F ZINC001176662214 1048766548 /nfs/dbraw/zinc/76/65/48/1048766548.db2.gz KGBMEBOILPDLMX-UHFFFAOYSA-N -1 1 317.270 4.010 20 0 DIADMM Cc1ccc2sc(Nc3c(F)cc(F)c([O-])c3F)nc2c1 ZINC001176663047 1048769738 /nfs/dbraw/zinc/76/97/38/1048769738.db2.gz AMLUAYIWTONHLT-UHFFFAOYSA-N -1 1 310.300 4.471 20 0 DIADMM CC(C)c1cccc(C(C)C)c1[N-]S(=O)(=O)c1ccncc1 ZINC001190888141 1048797854 /nfs/dbraw/zinc/79/78/54/1048797854.db2.gz SOPMRRMEWNMPTC-UHFFFAOYSA-N -1 1 318.442 4.129 20 0 DIADMM O=C(NCc1ccc([O-])c(Cl)c1)/C(F)=C/C1CCCCC1 ZINC001176994268 1048813011 /nfs/dbraw/zinc/81/30/11/1048813011.db2.gz OUGNTNAMJHQMIW-ZROIWOOFSA-N -1 1 311.784 4.096 20 0 DIADMM CC(C)Oc1ncc(Cl)cc1Nc1ccc(F)c(F)c1[O-] ZINC001203315708 1048868292 /nfs/dbraw/zinc/86/82/92/1048868292.db2.gz ZIUQNZUAJQNVFV-UHFFFAOYSA-N -1 1 314.719 4.250 20 0 DIADMM O=C(c1cccc(Nc2c([O-])cc(F)cc2F)c1)C(F)(F)F ZINC001203345211 1048877722 /nfs/dbraw/zinc/87/77/22/1048877722.db2.gz SIOQLNALOYFSKJ-UHFFFAOYSA-N -1 1 317.213 4.159 20 0 DIADMM CCCCc1ccc(S(=O)(=O)[N-]c2cccc(F)c2C)cc1 ZINC001191224742 1048901989 /nfs/dbraw/zinc/90/19/89/1048901989.db2.gz SXFGRPSNFSJIHM-UHFFFAOYSA-N -1 1 321.417 4.278 20 0 DIADMM CCc1cccc2cc(CN[C@@H](CCCC(C)C)C(=O)[O-])oc21 ZINC000904036727 1048958544 /nfs/dbraw/zinc/95/85/44/1048958544.db2.gz QUFHNJRWLXSEAX-KRWDZBQOSA-N -1 1 317.429 4.364 20 0 DIADMM O=C([O-])C[C@@H](NCc1cccc(C2CC2)c1)c1ccccc1F ZINC000904045418 1048962660 /nfs/dbraw/zinc/96/26/60/1048962660.db2.gz JECZMMLNXQOTHN-GOSISDBHSA-N -1 1 313.372 4.009 20 0 DIADMM [O-]c1cc(Cl)c(Nc2ccc3cncnc3c2)cc1Cl ZINC001203707638 1048970371 /nfs/dbraw/zinc/97/03/71/1048970371.db2.gz HCGYTJHXKQKJCJ-UHFFFAOYSA-N -1 1 306.152 4.386 20 0 DIADMM Cc1cc(NC(=O)Nc2c(F)cc([O-])cc2F)ccc1Cl ZINC001191773134 1048989599 /nfs/dbraw/zinc/98/95/99/1048989599.db2.gz ZNXHACFCZSVWHF-UHFFFAOYSA-N -1 1 312.703 4.276 20 0 DIADMM CC(C)Cc1ccc([C@@H](N[C@H](C)C(=O)[O-])c2cccs2)cc1 ZINC000904204251 1049001593 /nfs/dbraw/zinc/00/15/93/1049001593.db2.gz VHXUEIIFOHHAFH-CXAGYDPISA-N -1 1 317.454 4.099 20 0 DIADMM O=C(c1ccc([O-])cc1F)N1CCC[C@H]1CCC1CCCCC1 ZINC001150805785 1049055409 /nfs/dbraw/zinc/05/54/09/1049055409.db2.gz IIEYEKCGHFROAE-HNNXBMFYSA-N -1 1 319.420 4.496 20 0 DIADMM CC[C@@]1(C(=O)[O-])CCCN(Cc2csc(Cl)c2Cl)C1 ZINC000904400654 1049060660 /nfs/dbraw/zinc/06/06/60/1049060660.db2.gz JOPYEVFOTAPMAH-CYBMUJFWSA-N -1 1 322.257 4.132 20 0 DIADMM CC(C)Cc1noc(-c2cc(Oc3ccccc3)ccc2[O-])n1 ZINC000904412959 1049061538 /nfs/dbraw/zinc/06/15/38/1049061538.db2.gz BETRDACQIMINTK-UHFFFAOYSA-N -1 1 310.353 4.433 20 0 DIADMM CC(C)c1ccccc1NC(=O)Nc1cc(F)c(F)cc1[O-] ZINC001192259502 1049068848 /nfs/dbraw/zinc/06/88/48/1049068848.db2.gz JYTDKRQXPYDHQC-UHFFFAOYSA-N -1 1 306.312 4.438 20 0 DIADMM CC(C)N(C(=O)c1c(F)ccc([O-])c1F)[C@@H](C)c1ccccc1 ZINC001192540913 1049118387 /nfs/dbraw/zinc/11/83/87/1049118387.db2.gz RACVFZGPBXRTLP-LBPRGKRZSA-N -1 1 319.351 4.282 20 0 DIADMM Nc1ccccc1Nc1cc(Br)cc(Cl)c1[O-] ZINC001206375573 1049151285 /nfs/dbraw/zinc/15/12/85/1049151285.db2.gz KDCMXQQIKAHMIU-UHFFFAOYSA-N -1 1 313.582 4.134 20 0 DIADMM C[C@@H](C(=O)[N-]OC1CCCCC1)c1ccc(Cl)c(Cl)c1 ZINC000857493416 1049162888 /nfs/dbraw/zinc/16/28/88/1049162888.db2.gz ZDJCJCMRHYTGOW-SNVBAGLBSA-N -1 1 316.228 4.477 20 0 DIADMM C[C@@H](NC(=O)Nc1ccc([O-])c(Cl)c1)c1ccc(F)cc1 ZINC001193142303 1049183435 /nfs/dbraw/zinc/18/34/35/1049183435.db2.gz AJNSCSCBIRBOBZ-SECBINFHSA-N -1 1 308.740 4.067 20 0 DIADMM CSc1cc(C)c(C(=O)Nc2cc(F)c([O-])cc2Cl)o1 ZINC001179660150 1049188739 /nfs/dbraw/zinc/18/87/39/1049188739.db2.gz MQRURFSWOFMAGF-UHFFFAOYSA-N -1 1 315.753 4.060 20 0 DIADMM Cc1sccc1C(=O)Nc1cccc(C(F)(F)F)c1[O-] ZINC001193385607 1049205441 /nfs/dbraw/zinc/20/54/41/1049205441.db2.gz VNSXORNNXXSERO-UHFFFAOYSA-N -1 1 301.289 4.033 20 0 DIADMM O=C(Nc1cccc([O-])c1Br)OC1CCCCC1 ZINC001193641620 1049236958 /nfs/dbraw/zinc/23/69/58/1049236958.db2.gz FKTBFJVYVGTRNU-UHFFFAOYSA-N -1 1 314.179 4.036 20 0 DIADMM CCCCCOc1ccc(Oc2cc(Cl)nc(=O)[n-]2)cc1 ZINC000858312146 1049239526 /nfs/dbraw/zinc/23/95/26/1049239526.db2.gz RSTFWACTHURDLY-UHFFFAOYSA-N -1 1 308.765 4.197 20 0 DIADMM O=C(c1cc2ccccc2cc1[O-])N1CC=C(c2ccccc2)C1 ZINC000436864576 1049254984 /nfs/dbraw/zinc/25/49/84/1049254984.db2.gz NHHPJJVHTCFKGP-UHFFFAOYSA-N -1 1 315.372 4.085 20 0 DIADMM C[C@@H]1C[C@H](Nc2cc(Cl)[n-]c(=O)n2)C[C@@H](c2ccccc2)C1 ZINC000858569980 1049278403 /nfs/dbraw/zinc/27/84/03/1049278403.db2.gz DQUORQKLUAZZGW-UBHSHLNASA-N -1 1 317.820 4.220 20 0 DIADMM O=S(=O)([N-]c1ccccc1)c1ccc(-c2cccs2)cc1 ZINC001194131287 1049325016 /nfs/dbraw/zinc/32/50/16/1049325016.db2.gz SSGLDMFNTNLMGN-UHFFFAOYSA-N -1 1 315.419 4.216 20 0 DIADMM Cc1ccc(CC(=O)Nc2cccc(C(F)(F)F)c2[O-])cc1C ZINC001180462817 1049369185 /nfs/dbraw/zinc/36/91/85/1049369185.db2.gz FDUAVGKJXYSSOH-UHFFFAOYSA-N -1 1 323.314 4.209 20 0 DIADMM [O-]c1ccc(CN(Cc2ccco2)Cc2ccco2)c(F)c1F ZINC001205088148 1049371559 /nfs/dbraw/zinc/37/15/59/1049371559.db2.gz IZWBIKMNWWOCHZ-UHFFFAOYSA-N -1 1 319.307 4.059 20 0 DIADMM Cc1cccc(C)c1S(=O)(=O)[N-]c1cccc(Cl)c1C ZINC001194602028 1049397977 /nfs/dbraw/zinc/39/79/77/1049397977.db2.gz CCPRCLWOHBHKQL-UHFFFAOYSA-N -1 1 309.818 4.066 20 0 DIADMM Cc1cccc(C)c1S(=O)(=O)[N-]c1cccc2ccccc21 ZINC001194637807 1049401226 /nfs/dbraw/zinc/40/12/26/1049401226.db2.gz DYZFWFHCRQRELA-UHFFFAOYSA-N -1 1 311.406 4.257 20 0 DIADMM CCOc1cc(C(=O)Nc2cc(C)ccc2C)cc(Cl)c1[O-] ZINC000192952867 1049448088 /nfs/dbraw/zinc/44/80/88/1049448088.db2.gz LVCBFMKEUOJXHN-UHFFFAOYSA-N -1 1 319.788 4.313 20 0 DIADMM CSC(C)(C)C(=O)Nc1cc(Cl)c([O-])c2ccccc12 ZINC000862295603 1049486457 /nfs/dbraw/zinc/48/64/57/1049486457.db2.gz OCKHDGAHFOHQGY-UHFFFAOYSA-N -1 1 309.818 4.279 20 0 DIADMM O=C(Nc1ccc([O-])c(Cl)c1)Nc1cccc2c1OCCC2 ZINC000486923278 1049490810 /nfs/dbraw/zinc/49/08/10/1049490810.db2.gz YQDCVZJYWTXMAT-UHFFFAOYSA-N -1 1 318.760 4.015 20 0 DIADMM CC1(CC(=O)Nc2cccc([O-])c2Br)CCCC1 ZINC000908707429 1049499230 /nfs/dbraw/zinc/49/92/30/1049499230.db2.gz HRNHFGLNNBNLOQ-UHFFFAOYSA-N -1 1 312.207 4.064 20 0 DIADMM O=C(Nc1cccc([O-])c1Br)C1CCCCCC1 ZINC000908717339 1049500775 /nfs/dbraw/zinc/50/07/75/1049500775.db2.gz YMZKARSITZRGHB-UHFFFAOYSA-N -1 1 312.207 4.064 20 0 DIADMM [O-]c1cc(F)c(Nc2ncccc2C(F)(F)F)cc1Cl ZINC001250020261 1049516838 /nfs/dbraw/zinc/51/68/38/1049516838.db2.gz HRMXENIJTBLYLS-UHFFFAOYSA-N -1 1 306.646 4.342 20 0 DIADMM COc1cccc(C(C)=O)c1Nc1cc(Cl)c([O-])cc1F ZINC001250026949 1049542332 /nfs/dbraw/zinc/54/23/32/1049542332.db2.gz UKJARSBQHYSGTQ-UHFFFAOYSA-N -1 1 309.724 4.140 20 0 DIADMM Cn1ccc2cc(Nc3cc(Cl)cc(Cl)c3[O-])cnc21 ZINC001205735819 1049546894 /nfs/dbraw/zinc/54/68/94/1049546894.db2.gz NEVNTUMSHALVQG-UHFFFAOYSA-N -1 1 308.168 4.329 20 0 DIADMM Cc1ccccc1SC[C@H](C)CSc1ncc(C)c(=O)[n-]1 ZINC000863342125 1049556407 /nfs/dbraw/zinc/55/64/07/1049556407.db2.gz ZHMWEIUGZIFFGF-NSHDSACASA-N -1 1 320.483 4.320 20 0 DIADMM CCc1nc(C(C)C)ccc1C(=O)Nc1cc([O-])c(F)cc1F ZINC000909987045 1049575097 /nfs/dbraw/zinc/57/50/97/1049575097.db2.gz GFZUOFCTYMRJTI-UHFFFAOYSA-N -1 1 320.339 4.004 20 0 DIADMM COc1nccc2c(NCc3cccc([O-])c3Cl)cccc21 ZINC000864015318 1049620419 /nfs/dbraw/zinc/62/04/19/1049620419.db2.gz LDJOEQUYLYRZHD-UHFFFAOYSA-N -1 1 314.772 4.215 20 0 DIADMM CCc1ccccc1S(=O)(=O)[N-]c1cc(Cl)ccc1C ZINC000488268054 1049621346 /nfs/dbraw/zinc/62/13/46/1049621346.db2.gz RPWIQCOZUQGZAW-UHFFFAOYSA-N -1 1 309.818 4.012 20 0 DIADMM [O-]c1ccc(CN2CC3(CCC3)[C@H]2c2ccccc2)c(F)c1F ZINC001206047563 1049638945 /nfs/dbraw/zinc/63/89/45/1049638945.db2.gz JJYIFPKNQDOUMP-GOSISDBHSA-N -1 1 315.363 4.398 20 0 DIADMM Cc1cccc(NC(=S)Nc2cc(F)c([O-])cc2F)c1C ZINC001196419772 1049656411 /nfs/dbraw/zinc/65/64/11/1049656411.db2.gz DRTMZXFLAMZENY-UHFFFAOYSA-N -1 1 308.353 4.096 20 0 DIADMM [O-]c1cc(NC(=S)Nc2ccc(Cl)cc2)c(F)cc1F ZINC001197331285 1049744188 /nfs/dbraw/zinc/74/41/88/1049744188.db2.gz OZWKKNQBTMTAGC-UHFFFAOYSA-N -1 1 314.744 4.133 20 0 DIADMM [O-]c1c(F)cc(F)cc1NC(=S)Nc1ccc(Cl)cc1 ZINC001197338854 1049745383 /nfs/dbraw/zinc/74/53/83/1049745383.db2.gz YGPGZJDJVUXMPK-UHFFFAOYSA-N -1 1 314.744 4.133 20 0 DIADMM COc1cc(NCc2ccc([O-])c(F)c2F)cc2ccccc21 ZINC001207655482 1049922569 /nfs/dbraw/zinc/92/25/69/1049922569.db2.gz VYFZQABQOXITQD-UHFFFAOYSA-N -1 1 315.319 4.444 20 0 DIADMM CCCOc1c(C=C2SC(=S)[N-]C2=O)cccc1OCC ZINC000056677849 1050036090 /nfs/dbraw/zinc/03/60/90/1050036090.db2.gz YUYRKWPMSILWJK-FMIVXFBMSA-N -1 1 323.439 4.203 20 0 DIADMM CCCOc1ccc(Nc2ccc(-n3ccc(=O)[n-]3)cc2)cc1 ZINC001209867720 1050098104 /nfs/dbraw/zinc/09/81/04/1050098104.db2.gz RXZUMSHOBRXFCH-UHFFFAOYSA-N -1 1 309.369 4.110 20 0 DIADMM COc1cc(C(F)(F)F)ccc1Nc1cc(F)c([O-])cc1F ZINC001209886188 1050100650 /nfs/dbraw/zinc/10/06/50/1050100650.db2.gz DYMHMFWCSKDYLH-UHFFFAOYSA-N -1 1 319.229 4.441 20 0 DIADMM COc1cc(C(F)(F)F)ccc1Nc1ccc(F)c(F)c1[O-] ZINC001209888539 1050101230 /nfs/dbraw/zinc/10/12/30/1050101230.db2.gz VZKZWBJYTTYABB-UHFFFAOYSA-N -1 1 319.229 4.441 20 0 DIADMM [O-]c1cc(F)c(Nc2cc(C(F)(F)F)ccc2O)cc1F ZINC001209985199 1050116927 /nfs/dbraw/zinc/11/69/27/1050116927.db2.gz WRDJWBLJFBBENL-UHFFFAOYSA-N -1 1 305.202 4.138 20 0 DIADMM C/C(=C/c1ccccc1Cl)C(=O)Nc1c([O-])cccc1F ZINC000770863656 1050196285 /nfs/dbraw/zinc/19/62/85/1050196285.db2.gz SWMUWPWYJCWDAD-KTKRTIGZSA-N -1 1 305.736 4.227 20 0 DIADMM C/C(=C\c1cccc(Cl)c1)C(=O)Nc1c([O-])cccc1F ZINC000770862124 1050196802 /nfs/dbraw/zinc/19/68/02/1050196802.db2.gz KQRUCKBHVOQAAU-CSKARUKUSA-N -1 1 305.736 4.227 20 0 DIADMM [O-]c1ccc(Cl)c(Nc2ccc(OC(F)F)nc2)c1Cl ZINC001210304114 1050198540 /nfs/dbraw/zinc/19/85/40/1050198540.db2.gz WGYMVRIGTNIKJD-UHFFFAOYSA-N -1 1 321.110 4.439 20 0 DIADMM O=C(c1c([O-])cccc1Cl)N1CCC[C@@]2(CC=CCC2)C1 ZINC000734026470 1050214638 /nfs/dbraw/zinc/21/46/38/1050214638.db2.gz SOJSWQXULGJQLH-KRWDZBQOSA-N -1 1 305.805 4.008 20 0 DIADMM Cn1ccc2c1cccc2NC(=O)Nc1ccc([O-])c(Cl)c1 ZINC000573869259 1050260574 /nfs/dbraw/zinc/26/05/74/1050260574.db2.gz RAAUSIYYRKREJD-UHFFFAOYSA-N -1 1 315.760 4.181 20 0 DIADMM C[C@@H]1C[C@H](c2ccccc2)CN1C(=O)c1c([O-])cccc1Cl ZINC000734555355 1050289271 /nfs/dbraw/zinc/28/92/71/1050289271.db2.gz PYDJKHGCLPGCCF-OCCSQVGLSA-N -1 1 315.800 4.064 20 0 DIADMM CC(C)(CNC(=O)c1c([O-])cccc1Cl)Cc1ccccc1 ZINC000735330721 1050373365 /nfs/dbraw/zinc/37/33/65/1050373365.db2.gz HKFVNIUCRLAACY-UHFFFAOYSA-N -1 1 317.816 4.044 20 0 DIADMM [O-]c1cc(F)c(Nc2cc(O)cc(C(F)(F)F)c2)cc1F ZINC001210828896 1050383337 /nfs/dbraw/zinc/38/33/37/1050383337.db2.gz YYIHYMCPAAQGKW-UHFFFAOYSA-N -1 1 305.202 4.138 20 0 DIADMM COc1cc(Nc2cc(Cl)c([O-])c(Cl)c2)cc(Cl)n1 ZINC001210925848 1050416001 /nfs/dbraw/zinc/41/60/01/1050416001.db2.gz DBBUSBBZSXKRGJ-UHFFFAOYSA-N -1 1 319.575 4.500 20 0 DIADMM Nc1cc(Cl)ncc1Nc1cc(Cl)c([O-])c(Cl)c1 ZINC001210924337 1050416321 /nfs/dbraw/zinc/41/63/21/1050416321.db2.gz JJLHMOXGMOBSPH-UHFFFAOYSA-N -1 1 304.564 4.073 20 0 DIADMM Nc1cccc2c1CCCN2c1cc(Cl)c([O-])c(Cl)c1 ZINC001210928529 1050418557 /nfs/dbraw/zinc/41/85/57/1050418557.db2.gz ATVUEMGHZUAUBF-UHFFFAOYSA-N -1 1 309.196 4.366 20 0 DIADMM Nc1ccc(C(F)(F)F)cc1Nc1cc([O-])c(F)c(F)c1 ZINC001211150984 1050500380 /nfs/dbraw/zinc/50/03/80/1050500380.db2.gz IGJNAFQIPMTCHV-UHFFFAOYSA-N -1 1 304.218 4.015 20 0 DIADMM [O-]c1c(Br)c(F)ccc1Nc1cnccc1Cl ZINC001211212951 1050520146 /nfs/dbraw/zinc/52/01/46/1050520146.db2.gz DUICOADKCHPNBJ-UHFFFAOYSA-N -1 1 317.545 4.086 20 0 DIADMM COc1cc(OC(F)(F)F)ccc1-c1cc(F)c([O-])cc1F ZINC001211360315 1050556943 /nfs/dbraw/zinc/55/69/43/1050556943.db2.gz RDXGHINGZNJHAC-UHFFFAOYSA-N -1 1 320.213 4.245 20 0 DIADMM CCOC(=O)CCCc1cccc(-c2cc(F)c([O-])cc2F)c1 ZINC001211360234 1050557693 /nfs/dbraw/zinc/55/76/93/1050557693.db2.gz PRSCDDNNBGVGQI-UHFFFAOYSA-N -1 1 320.335 4.223 20 0 DIADMM CCCOc1ccccc1Nc1ccc(-n2ccc(=O)[n-]2)cc1 ZINC001211387830 1050561006 /nfs/dbraw/zinc/56/10/06/1050561006.db2.gz DMXCDPKGTANUMQ-UHFFFAOYSA-N -1 1 309.369 4.110 20 0 DIADMM [O-]c1ccc(Cl)c(Nc2cccc(CO)c2F)c1Cl ZINC001211439779 1050566957 /nfs/dbraw/zinc/56/69/57/1050566957.db2.gz CKRUYXVJNOMBEL-UHFFFAOYSA-N -1 1 302.132 4.074 20 0 DIADMM [O-]c1cc(Cl)c(Nc2cc(F)c(O)c(F)c2)cc1Cl ZINC001213381841 1050644867 /nfs/dbraw/zinc/64/48/67/1050644867.db2.gz KHFLFNNYYXSASK-UHFFFAOYSA-N -1 1 306.095 4.426 20 0 DIADMM CC(C)COc1cccc(Nc2ccc(-n3ccc(=O)[n-]3)cc2)c1 ZINC001213644127 1050707177 /nfs/dbraw/zinc/70/71/77/1050707177.db2.gz MMCZSVKGFSDIDE-UHFFFAOYSA-N -1 1 323.396 4.356 20 0 DIADMM Cc1cc(Cl)cc(-c2noc(-c3cc([O-])cnc3Cl)n2)c1 ZINC001213698434 1050720070 /nfs/dbraw/zinc/72/00/70/1050720070.db2.gz WUZNXLUOJSAAFT-UHFFFAOYSA-N -1 1 322.151 4.119 20 0 DIADMM Cc1cc2cc(Nc3cc4ccc([O-])cc4oc3=O)ccc2[nH]1 ZINC001213789962 1050743090 /nfs/dbraw/zinc/74/30/90/1050743090.db2.gz QMNDVDMYJGXDHC-UHFFFAOYSA-N -1 1 306.321 4.032 20 0 DIADMM Cc1ccc(C(=O)Nc2ccc([O-])c(Cl)c2)c(F)c1Cl ZINC000788742084 1050744994 /nfs/dbraw/zinc/74/49/94/1050744994.db2.gz LXRCGKCYMYPUNV-UHFFFAOYSA-N -1 1 314.143 4.399 20 0 DIADMM Cc1ncc(C(F)(F)F)cc1Nc1ccc(F)c(F)c1[O-] ZINC001213832535 1050756956 /nfs/dbraw/zinc/75/69/56/1050756956.db2.gz CGLYECLOSBLUIO-UHFFFAOYSA-N -1 1 304.218 4.136 20 0 DIADMM [O-]c1c(F)cc(Nc2ccc(N3CCCC3)cc2F)cc1F ZINC001213851301 1050764690 /nfs/dbraw/zinc/76/46/90/1050764690.db2.gz FYZAJCYOEBVBRF-UHFFFAOYSA-N -1 1 308.303 4.153 20 0 DIADMM O=c1oc2cc([O-])ccc2cc1Nc1ccc2sccc2c1 ZINC001213928566 1050782724 /nfs/dbraw/zinc/78/27/24/1050782724.db2.gz RAPBXUPBQIRBPO-UHFFFAOYSA-N -1 1 309.346 4.457 20 0 DIADMM CC(C)(C)c1cc(C(=O)Nc2c([O-])cccc2F)cc(Cl)n1 ZINC001146491956 1050827379 /nfs/dbraw/zinc/82/73/79/1050827379.db2.gz HEAXCIHUYNGRQU-UHFFFAOYSA-N -1 1 322.767 4.130 20 0 DIADMM COCOc1cccc(Cl)c1Nc1cc([O-])c(F)c(F)c1 ZINC001214311352 1050865837 /nfs/dbraw/zinc/86/58/37/1050865837.db2.gz GCRLLRVIEDGBNT-UHFFFAOYSA-N -1 1 315.703 4.050 20 0 DIADMM COCOc1cccc(Cl)c1Nc1cc(F)c([O-])cc1F ZINC001214313611 1050867520 /nfs/dbraw/zinc/86/75/20/1050867520.db2.gz HOYIWVGJGBDDKS-UHFFFAOYSA-N -1 1 315.703 4.050 20 0 DIADMM [O-]c1cc(F)cc(F)c1Nc1cc(OC(F)(F)F)ccc1O ZINC001214380349 1050888573 /nfs/dbraw/zinc/88/85/73/1050888573.db2.gz NCHXXQBDKNSYFO-UHFFFAOYSA-N -1 1 321.201 4.018 20 0 DIADMM Cc1cccc([C@H]2CCCN2C(=O)c2ccc(F)c([O-])c2)c1C ZINC001147538089 1050892247 /nfs/dbraw/zinc/89/22/47/1050892247.db2.gz KFUBIQCNGNTVJQ-QGZVFWFLSA-N -1 1 313.372 4.125 20 0 DIADMM CC(C)(NC(=O)c1ccc(Cl)cc1[O-])c1cccc(Cl)c1 ZINC001147578617 1050892606 /nfs/dbraw/zinc/89/26/06/1050892606.db2.gz NJQCNUNBSHLDJV-UHFFFAOYSA-N -1 1 324.207 4.364 20 0 DIADMM CC(C)(O)c1cccc(NC(=O)c2cc3ccccc3cc2[O-])c1 ZINC000789933488 1050903331 /nfs/dbraw/zinc/90/33/31/1050903331.db2.gz AMVMJGBNVUBQOW-UHFFFAOYSA-N -1 1 321.376 4.025 20 0 DIADMM CCOC(=O)c1ccsc1Nc1cc(F)c([O-])c(Cl)c1 ZINC001214477500 1050917092 /nfs/dbraw/zinc/91/70/92/1050917092.db2.gz RRYNUHKYWHYIGJ-UHFFFAOYSA-N -1 1 315.753 4.167 20 0 DIADMM COC(=O)c1cc(C)sc1Nc1cc(F)c([O-])c(Cl)c1 ZINC001214479611 1050918055 /nfs/dbraw/zinc/91/80/55/1050918055.db2.gz BQWDBVHTCXGGTJ-UHFFFAOYSA-N -1 1 315.753 4.085 20 0 DIADMM [O-]c1c(F)cc(Nc2cc(F)c(F)c(F)c2F)cc1Cl ZINC001214488960 1050918160 /nfs/dbraw/zinc/91/81/60/1050918160.db2.gz REJBMGNCDJDURA-UHFFFAOYSA-N -1 1 309.621 4.485 20 0 DIADMM CNc1ccnc(Cl)c1Nc1cc(F)c([O-])c(Cl)c1 ZINC001214479840 1050918948 /nfs/dbraw/zinc/91/89/48/1050918948.db2.gz FYPDFFUIQAWAKP-UHFFFAOYSA-N -1 1 302.136 4.018 20 0 DIADMM COc1cc(C)c(Nc2cc(F)c([O-])c(Cl)c2)cc1OC ZINC001214488293 1050920055 /nfs/dbraw/zinc/92/00/55/1050920055.db2.gz ASRRLJOEJAQAGD-UHFFFAOYSA-N -1 1 311.740 4.254 20 0 DIADMM [O-]c1c(F)cc(Nc2cn3c(cccc3Cl)n2)cc1Cl ZINC001214484994 1050920569 /nfs/dbraw/zinc/92/05/69/1050920569.db2.gz UTGUJYQIETXWQL-UHFFFAOYSA-N -1 1 312.131 4.229 20 0 DIADMM CC(C)OC(=O)c1ccc(Nc2cc(F)c([O-])c(Cl)c2)cc1 ZINC001214489232 1050921269 /nfs/dbraw/zinc/92/12/69/1050921269.db2.gz YSJVMCWMVCIBAG-UHFFFAOYSA-N -1 1 323.751 4.494 20 0 DIADMM CCOC(=O)Nc1ccc(Nc2cc(F)c([O-])c(Cl)c2)cc1 ZINC001214490602 1050922381 /nfs/dbraw/zinc/92/23/81/1050922381.db2.gz YLOOBHKARKTIPB-UHFFFAOYSA-N -1 1 324.739 4.497 20 0 DIADMM O=c1[nH]ccc2c(Nc3cc(F)c([O-])c(Cl)c3)cccc12 ZINC001214490165 1050922409 /nfs/dbraw/zinc/92/24/09/1050922409.db2.gz PDVZCPNYAJEIER-UHFFFAOYSA-N -1 1 304.708 4.182 20 0 DIADMM Cc1noc(-c2ccc(Nc3cc(F)c([O-])c(Cl)c3)cc2)n1 ZINC001214490557 1050922542 /nfs/dbraw/zinc/92/25/42/1050922542.db2.gz XUBSAZVALKUWAI-UHFFFAOYSA-N -1 1 319.723 4.287 20 0 DIADMM CN(c1cc(F)c([O-])c(Cl)c1)c1cc(Cl)ccc1N ZINC001214489654 1050923179 /nfs/dbraw/zinc/92/31/79/1050923179.db2.gz FHUQOSCQENJNGL-UHFFFAOYSA-N -1 1 301.148 4.188 20 0 DIADMM COc1ccc2ccc(Nc3cc(F)c([O-])c(Cl)c3)cc2n1 ZINC001214493898 1050925197 /nfs/dbraw/zinc/92/51/97/1050925197.db2.gz APQYOUIGCHEXGW-UHFFFAOYSA-N -1 1 318.735 4.485 20 0 DIADMM [O-]c1cc(Nc2c(Cl)ccc(O)c2F)c(F)cc1Cl ZINC001214561493 1050944952 /nfs/dbraw/zinc/94/49/52/1050944952.db2.gz OXZHXAFURWWOHG-UHFFFAOYSA-N -1 1 306.095 4.426 20 0 DIADMM Cc1cc(C)c(NC(=O)c2cccc(-c3ccccc3)c2[O-])cn1 ZINC001148860982 1050979695 /nfs/dbraw/zinc/97/96/95/1050979695.db2.gz FNXOABPFVRSYBR-UHFFFAOYSA-N -1 1 318.376 4.323 20 0 DIADMM O=C(c1cccc(-c2ccccc2)c1[O-])N1CCC2(CCC2)C1 ZINC001148865940 1050979896 /nfs/dbraw/zinc/97/98/96/1050979896.db2.gz BOZGIXNTBXVHND-UHFFFAOYSA-N -1 1 307.393 4.075 20 0 DIADMM CC[C@@H](NC(=O)c1cccc(-c2ccccc2)c1[O-])C(F)(F)F ZINC001148872949 1050980563 /nfs/dbraw/zinc/98/05/63/1050980563.db2.gz MLOGFKSZGGVSIA-CQSZACIVSA-N -1 1 323.314 4.130 20 0 DIADMM COc1c(F)cc(Nc2cc([O-])c(F)c(F)c2)cc1Cl ZINC001214973717 1051039661 /nfs/dbraw/zinc/03/96/61/1051039661.db2.gz AFLVFRXSBCVSMM-UHFFFAOYSA-N -1 1 303.667 4.215 20 0 DIADMM [O-]c1c(Cl)c(Cl)ccc1Nc1ccc(CO)c(F)c1F ZINC001215041160 1051059481 /nfs/dbraw/zinc/05/94/81/1051059481.db2.gz IDMYLPPGEMTESW-UHFFFAOYSA-N -1 1 320.122 4.213 20 0 DIADMM CC(C)Oc1ccc(F)c(F)c1Nc1ccnc(Cl)c1[O-] ZINC001215074041 1051068924 /nfs/dbraw/zinc/06/89/24/1051068924.db2.gz OOSYUASOXPNBSW-UHFFFAOYSA-N -1 1 314.719 4.250 20 0 DIADMM CC(C)Oc1ccc(F)c(Nc2cc(F)c([O-])cc2F)c1F ZINC001215176168 1051103385 /nfs/dbraw/zinc/10/33/85/1051103385.db2.gz FZNZVIJEAHZVPS-UHFFFAOYSA-N -1 1 315.266 4.479 20 0 DIADMM CCOc1ccc(-c2nc(-c3ccc(CC)cc3)no2)c([O-])c1 ZINC001215241365 1051129300 /nfs/dbraw/zinc/12/93/00/1051129300.db2.gz SQGQAPNKDSZOMN-UHFFFAOYSA-N -1 1 310.353 4.070 20 0 DIADMM CCOc1ccc(-c2nc(-c3cccc(Cl)c3)no2)c([O-])c1 ZINC001215241088 1051129354 /nfs/dbraw/zinc/12/93/54/1051129354.db2.gz FYIZLWNUFVUEHG-UHFFFAOYSA-N -1 1 316.744 4.161 20 0 DIADMM CCOc1ccc(-c2nc(-c3ccc(C)cc3C)no2)c([O-])c1 ZINC001215241079 1051129442 /nfs/dbraw/zinc/12/94/42/1051129442.db2.gz FPIFMZDVDDNIIM-UHFFFAOYSA-N -1 1 310.353 4.125 20 0 DIADMM CCOc1ccc(-c2nc(-c3cccc4ccoc43)no2)c([O-])c1 ZINC001215241042 1051129724 /nfs/dbraw/zinc/12/97/24/1051129724.db2.gz CMUBGBZXFGTOHW-UHFFFAOYSA-N -1 1 322.320 4.254 20 0 DIADMM CCc1cccc(-c2noc(-c3ccc([O-])cc3Cl)n2)c1 ZINC001215343249 1051172458 /nfs/dbraw/zinc/17/24/58/1051172458.db2.gz QIISCNIBKYKHFA-UHFFFAOYSA-N -1 1 300.745 4.325 20 0 DIADMM Cc1c(F)cc(-c2noc(-c3ccc([O-])cc3Cl)n2)cc1F ZINC001215342865 1051172586 /nfs/dbraw/zinc/17/25/86/1051172586.db2.gz CQSUWJLBBNYWES-UHFFFAOYSA-N -1 1 322.698 4.349 20 0 DIADMM Cc1ccc(-c2noc(-c3ccc([O-])cc3Cl)n2)c(F)c1F ZINC001215342851 1051172687 /nfs/dbraw/zinc/17/26/87/1051172687.db2.gz BWRGBSOZIVBCHG-UHFFFAOYSA-N -1 1 322.698 4.349 20 0 DIADMM [O-]c1ccc(-c2nc(-c3cncc4ccccc43)no2)c(Cl)c1 ZINC001215345882 1051173015 /nfs/dbraw/zinc/17/30/15/1051173015.db2.gz PUHAYMUAZRUIMT-UHFFFAOYSA-N -1 1 323.739 4.311 20 0 DIADMM O=c1oc2cc([O-])ccc2cc1Nc1ccc(F)c(F)c1Cl ZINC001215401813 1051190029 /nfs/dbraw/zinc/19/00/29/1051190029.db2.gz SMIRYBZQOGXVQS-UHFFFAOYSA-N -1 1 323.682 4.174 20 0 DIADMM CC(=O)c1ccc([O-])c(CCOC(=O)C2CCCCCCC2)c1 ZINC000745123121 1051224431 /nfs/dbraw/zinc/22/44/31/1051224431.db2.gz ZMHHHSXKCONNCK-UHFFFAOYSA-N -1 1 318.413 4.041 20 0 DIADMM Oc1c(Cl)cc(Cl)cc1Nc1cc2[nH]ncc2c(F)c1 ZINC001215556163 1051240473 /nfs/dbraw/zinc/24/04/73/1051240473.db2.gz WKEPLYYFNPJHHQ-UHFFFAOYSA-N -1 1 312.131 4.458 20 0 DIADMM [O-]c1c(Cl)cc(Cl)cc1Nc1cc2n[nH]cc2c(F)c1 ZINC001215556163 1051240483 /nfs/dbraw/zinc/24/04/83/1051240483.db2.gz WKEPLYYFNPJHHQ-UHFFFAOYSA-N -1 1 312.131 4.458 20 0 DIADMM Oc1c(Cl)c(Cl)ccc1Nc1cc2[nH]ncc2c(F)c1 ZINC001215556579 1051241021 /nfs/dbraw/zinc/24/10/21/1051241021.db2.gz IGHWFONACFMOKG-UHFFFAOYSA-N -1 1 312.131 4.458 20 0 DIADMM [O-]c1c(Cl)c(Cl)ccc1Nc1cc2n[nH]cc2c(F)c1 ZINC001215556579 1051241036 /nfs/dbraw/zinc/24/10/36/1051241036.db2.gz IGHWFONACFMOKG-UHFFFAOYSA-N -1 1 312.131 4.458 20 0 DIADMM [O-]c1c(Cl)c(Cl)ccc1Nc1cc2[nH]ncc2c(F)c1 ZINC001215556579 1051241050 /nfs/dbraw/zinc/24/10/50/1051241050.db2.gz IGHWFONACFMOKG-UHFFFAOYSA-N -1 1 312.131 4.458 20 0 DIADMM [O-]c1cc(F)c(Nc2ccc(Cc3ccncc3)cc2)cc1F ZINC001215571600 1051251370 /nfs/dbraw/zinc/25/13/70/1051251370.db2.gz IWJHHTIKSOIPEG-UHFFFAOYSA-N -1 1 312.319 4.400 20 0 DIADMM [O-]c1cc(F)c(Nc2c(F)cccc2Br)cc1F ZINC001215571580 1051252184 /nfs/dbraw/zinc/25/21/84/1051252184.db2.gz HYJFWUXWBSMTFS-UHFFFAOYSA-N -1 1 318.092 4.316 20 0 DIADMM COc1cccc(Nc2cc(F)c([O-])cc2F)c1C(F)(F)F ZINC001215573302 1051252487 /nfs/dbraw/zinc/25/24/87/1051252487.db2.gz CPPJYODTHNIDAW-UHFFFAOYSA-N -1 1 319.229 4.441 20 0 DIADMM O=C(c1ccc(Nc2cc(F)c([O-])cc2F)cc1)C(F)(F)F ZINC001215573400 1051252543 /nfs/dbraw/zinc/25/25/43/1051252543.db2.gz IWROMOBWPNNRHJ-UHFFFAOYSA-N -1 1 317.213 4.159 20 0 DIADMM [O-]c1cc(F)c(Nc2cc(F)ccc2OCC(F)F)cc1F ZINC001215574480 1051253690 /nfs/dbraw/zinc/25/36/90/1051253690.db2.gz VJLSKVUXEYBWDE-UHFFFAOYSA-N -1 1 319.229 4.197 20 0 DIADMM Cc1ccc(Br)cc1Nc1cc(F)c([O-])cc1F ZINC001215574141 1051254983 /nfs/dbraw/zinc/25/49/83/1051254983.db2.gz YCUSEQGKYZNNIV-UHFFFAOYSA-N -1 1 314.129 4.485 20 0 DIADMM CC(=O)c1cc(Cl)c(F)cc1Nc1cc(F)c([O-])cc1F ZINC001215575944 1051255131 /nfs/dbraw/zinc/25/51/31/1051255131.db2.gz GXUMKACVOZPWED-UHFFFAOYSA-N -1 1 315.678 4.409 20 0 DIADMM CC(C)(C)OC(=O)c1cccnc1-c1ccc(Cl)c([O-])c1 ZINC001243576170 1051335176 /nfs/dbraw/zinc/33/51/76/1051335176.db2.gz IOZDMFBSJSZGJE-UHFFFAOYSA-N -1 1 305.761 4.063 20 0 DIADMM COc1ccc(Nc2cc(Cl)c([O-])cc2Cl)c2c[nH]nc21 ZINC001215751477 1051344039 /nfs/dbraw/zinc/34/40/39/1051344039.db2.gz MOMPGZNWRUJZLH-UHFFFAOYSA-N -1 1 324.167 4.328 20 0 DIADMM CC(C)(C)c1nc([N-]c2ccnc(Oc3ccccc3)c2)no1 ZINC001215773321 1051359959 /nfs/dbraw/zinc/35/99/59/1051359959.db2.gz SFUSZAOPNLEIKD-UHFFFAOYSA-N -1 1 310.357 4.298 20 0 DIADMM CSc1cc(Nc2cc3ccc([O-])cc3oc2=O)ccc1F ZINC001215793965 1051373447 /nfs/dbraw/zinc/37/34/47/1051373447.db2.gz MXVMEOBNZDCLJX-UHFFFAOYSA-N -1 1 317.341 4.103 20 0 DIADMM COc1cc(SC)c(Nc2cc([O-])c(Cl)cc2F)cn1 ZINC001215813326 1051385673 /nfs/dbraw/zinc/38/56/73/1051385673.db2.gz JEHHORLPLWDQSS-UHFFFAOYSA-N -1 1 314.769 4.054 20 0 DIADMM Cc1cc(Cl)cc(-c2noc(-c3ccc([O-])cc3F)n2)c1 ZINC001215826374 1051390643 /nfs/dbraw/zinc/39/06/43/1051390643.db2.gz KMEYNXZOFHPPIP-UHFFFAOYSA-N -1 1 304.708 4.210 20 0 DIADMM [O-]c1cc(-c2nc(-c3cc(F)cc(Cl)c3)no2)ccc1F ZINC001215839408 1051403011 /nfs/dbraw/zinc/40/30/11/1051403011.db2.gz RHWNAEGJODVQLP-UHFFFAOYSA-N -1 1 308.671 4.041 20 0 DIADMM [O-]c1cc(-c2nc(-c3cccc4ccccc43)no2)ccc1F ZINC001215842145 1051406054 /nfs/dbraw/zinc/40/60/54/1051406054.db2.gz COWCEAIMTBFPFO-UHFFFAOYSA-N -1 1 306.296 4.402 20 0 DIADMM CCCOc1ccc(-c2noc(-c3ccc(F)c([O-])c3)n2)cc1 ZINC001215843006 1051407437 /nfs/dbraw/zinc/40/74/37/1051407437.db2.gz 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/nfs/dbraw/zinc/53/47/79/1051534779.db2.gz MWZFEOHEIJAVHO-UHFFFAOYSA-N -1 1 302.733 4.184 20 0 DIADMM Nc1ccc(Nc2c([O-])cc(F)cc2F)c(C(F)(F)F)c1 ZINC001216132288 1051595823 /nfs/dbraw/zinc/59/58/23/1051595823.db2.gz ZBXWNTAZNSPJNB-UHFFFAOYSA-N -1 1 304.218 4.015 20 0 DIADMM O=S(=O)([N-]c1ccccc1Cc1ccccc1)c1ccccc1 ZINC000007057533 1051626744 /nfs/dbraw/zinc/62/67/44/1051626744.db2.gz XCBKHFSACSQOLS-UHFFFAOYSA-N -1 1 323.417 4.078 20 0 DIADMM O=C(Nc1ccc([O-])c(Cl)c1)C1(Cc2ccccc2)CC1 ZINC000182875384 1051705374 /nfs/dbraw/zinc/70/53/74/1051705374.db2.gz MGFTYXLTOSNXDA-UHFFFAOYSA-N -1 1 301.773 4.007 20 0 DIADMM [O-]c1cc(F)cc(-c2nc(-c3ccc(F)c(Cl)c3)no2)c1 ZINC001216336186 1051705643 /nfs/dbraw/zinc/70/56/43/1051705643.db2.gz MOADWEWQDABNMY-UHFFFAOYSA-N -1 1 308.671 4.041 20 0 DIADMM Cc1cc(Cl)cc(-c2noc(-c3cc([O-])cc(F)c3)n2)c1 ZINC001216339191 1051707258 /nfs/dbraw/zinc/70/72/58/1051707258.db2.gz CPCZRHNARNXNJF-UHFFFAOYSA-N -1 1 304.708 4.210 20 0 DIADMM CC(C)c1ccc2nc(-c3ccc(C(C)C)nc3)[n-]c(=O)c2c1 ZINC000183885366 1051722709 /nfs/dbraw/zinc/72/27/09/1051722709.db2.gz PYNDYDBZQKOKOX-UHFFFAOYSA-N -1 1 307.397 4.232 20 0 DIADMM [O-]c1ccc(Cl)c(Nc2cc(F)cc(CO)c2)c1Cl ZINC001212747768 1051768384 /nfs/dbraw/zinc/76/83/84/1051768384.db2.gz RPYQKVPNUPSGIF-UHFFFAOYSA-N -1 1 302.132 4.074 20 0 DIADMM Cc1c(Cl)cc(Nc2cc(F)cc(CO)c2)c([O-])c1Cl ZINC001212749616 1051769148 /nfs/dbraw/zinc/76/91/48/1051769148.db2.gz PALJCSKCRKJSQU-UHFFFAOYSA-N -1 1 316.159 4.382 20 0 DIADMM CN(C(=O)c1ccc([O-])c(F)c1)c1ccc(C(C)(C)C)cc1 ZINC000767322546 1051790033 /nfs/dbraw/zinc/79/00/33/1051790033.db2.gz LPWQQJIBRMSQAS-UHFFFAOYSA-N -1 1 301.361 4.105 20 0 DIADMM [O-]c1cc(F)cc(F)c1Nc1cccc(OC(F)(F)F)c1F ZINC001216522689 1051803153 /nfs/dbraw/zinc/80/31/53/1051803153.db2.gz MRTLETYFONPMBW-UHFFFAOYSA-N -1 1 323.192 4.452 20 0 DIADMM CC(C)(C)OC(=O)c1cncc(-c2cccc(Cl)c2[O-])c1 ZINC001242366516 1051817066 /nfs/dbraw/zinc/81/70/66/1051817066.db2.gz OAHNJZJLWJVJGV-UHFFFAOYSA-N -1 1 305.761 4.063 20 0 DIADMM CC(C)Oc1ncc(Nc2cc(Cl)cc(Cl)c2[O-])cn1 ZINC001216621420 1051841391 /nfs/dbraw/zinc/84/13/91/1051841391.db2.gz PUZRLDGXBQGNET-UHFFFAOYSA-N -1 1 314.172 4.020 20 0 DIADMM [O-]c1c(Cl)c(Cl)ccc1Nc1ccc2c(c1)OCCO2 ZINC001173880787 1051886900 /nfs/dbraw/zinc/88/69/00/1051886900.db2.gz TTYFTWHMBIHUEM-UHFFFAOYSA-N -1 1 312.152 4.214 20 0 DIADMM Cc1cc(-c2noc(-c3c(F)ccc([O-])c3F)n2)ccc1Cl ZINC001216922143 1051909000 /nfs/dbraw/zinc/90/90/00/1051909000.db2.gz KNMFSMBVBYGSNS-UHFFFAOYSA-N -1 1 322.698 4.349 20 0 DIADMM Cc1cc(Cl)cc(-c2noc(-c3c(F)ccc([O-])c3F)n2)c1 ZINC001216921907 1051909255 /nfs/dbraw/zinc/90/92/55/1051909255.db2.gz DJJANGWDPOMLHQ-UHFFFAOYSA-N -1 1 322.698 4.349 20 0 DIADMM Cc1cccc(-c2noc(-c3cc([O-])cc(F)c3F)n2)c1C ZINC001216924056 1051910778 /nfs/dbraw/zinc/91/07/78/1051910778.db2.gz WSVFTIHUWHTEMG-UHFFFAOYSA-N -1 1 302.280 4.004 20 0 DIADMM CCCCc1ccc(-c2noc(-c3c(C)cc(O)cc3[O-])n2)cc1 ZINC001216987201 1051928006 /nfs/dbraw/zinc/92/80/06/1051928006.db2.gz URPAJMQWNRSAIE-UHFFFAOYSA-N -1 1 324.380 4.466 20 0 DIADMM Cc1ccc(-c2noc(-c3ccc4cccnc4c3[O-])n2)c(C)c1 ZINC001217141573 1051975970 /nfs/dbraw/zinc/97/59/70/1051975970.db2.gz GLEOVMOEEYQYBZ-UHFFFAOYSA-N -1 1 317.348 4.274 20 0 DIADMM Cc1ccc(F)c(-c2noc(-c3ccc4cccnc4c3[O-])n2)c1 ZINC001217142209 1051976483 /nfs/dbraw/zinc/97/64/83/1051976483.db2.gz UVTRCTKPOCJREP-UHFFFAOYSA-N -1 1 321.311 4.105 20 0 DIADMM Cc1cc(F)ccc1-c1noc(-c2ccc3cccnc3c2[O-])n1 ZINC001217142210 1051976588 /nfs/dbraw/zinc/97/65/88/1051976588.db2.gz UVZSZIOEUFJYJE-UHFFFAOYSA-N -1 1 321.311 4.105 20 0 DIADMM CCCc1ccccc1[N-]S(=O)(=O)c1ccc(SC)cc1 ZINC000494636445 1051995491 /nfs/dbraw/zinc/99/54/91/1051995491.db2.gz WZXPYCAAFRQKLT-UHFFFAOYSA-N -1 1 321.467 4.162 20 0 DIADMM O=C(Nc1ccc([O-])c(Cl)c1)Nc1ccc2c(c1)CCCO2 ZINC000192211281 1052005713 /nfs/dbraw/zinc/00/57/13/1052005713.db2.gz FEZIPSGOBKUBHL-UHFFFAOYSA-N -1 1 318.760 4.015 20 0 DIADMM [O-]c1c(Cl)cc(Br)cc1Nc1cncc(F)c1 ZINC001174292588 1052073419 /nfs/dbraw/zinc/07/34/19/1052073419.db2.gz WHLDXCDJQRIIHK-UHFFFAOYSA-N -1 1 317.545 4.086 20 0 DIADMM [O-]c1c(Cl)nccc1Nc1cccc(N2CCCCC2)c1 ZINC001174301818 1052079464 /nfs/dbraw/zinc/07/94/64/1052079464.db2.gz KNLSRQREYCTOKD-UHFFFAOYSA-N -1 1 303.793 4.175 20 0 DIADMM [O-]c1cc(F)c(Nc2cccc(N3CCCCC3)c2)cc1F ZINC001174304517 1052088703 /nfs/dbraw/zinc/08/87/03/1052088703.db2.gz FTWMUBZEFJQHDM-UHFFFAOYSA-N -1 1 304.340 4.404 20 0 DIADMM Cc1ccc([C@@H](C)N(C)C(=O)c2c([O-])cccc2Cl)cc1 ZINC000769671468 1052090777 /nfs/dbraw/zinc/09/07/77/1052090777.db2.gz LPQYPDLMLRUHKJ-GFCCVEGCSA-N -1 1 303.789 4.187 20 0 DIADMM CCN(C)C(=O)c1ccc(Nc2cc([O-])c(Cl)cc2F)cc1 ZINC001174322371 1052100267 /nfs/dbraw/zinc/10/02/67/1052100267.db2.gz UAWPYAFYSDMRTL-UHFFFAOYSA-N -1 1 322.767 4.020 20 0 DIADMM [O-]c1c(Cl)nccc1Nc1ccc(C(F)(F)F)cc1F ZINC001174400562 1052121365 /nfs/dbraw/zinc/12/13/65/1052121365.db2.gz JEOHROAUXZOAHJ-UHFFFAOYSA-N -1 1 306.646 4.342 20 0 DIADMM COc1ccc(-c2nc3ccc(C(C)C)cc3c(=O)[n-]2)cc1C ZINC000303143689 1052315822 /nfs/dbraw/zinc/31/58/22/1052315822.db2.gz QKMDGTWWIJODME-UHFFFAOYSA-N -1 1 308.381 4.443 20 0 DIADMM COc1cc2c(cc1C)nccc2-c1cc(F)c([O-])cc1F ZINC001222083142 1052439597 /nfs/dbraw/zinc/43/95/97/1052439597.db2.gz POIBPFMAISQAGN-UHFFFAOYSA-N -1 1 301.292 4.203 20 0 DIADMM CCC(=O)Nc1ccc(NCc2cccc([O-])c2Cl)cc1 ZINC000393404298 1052482685 /nfs/dbraw/zinc/48/26/85/1052482685.db2.gz YMHHGICRWUCPFU-UHFFFAOYSA-N -1 1 304.777 4.006 20 0 DIADMM CC1(C)CN(C(=O)c2cc3ccccc3cc2[O-])[C@H]2CCC[C@@H]21 ZINC000393442030 1052483480 /nfs/dbraw/zinc/48/34/80/1052483480.db2.gz OHDUAXLXHXIYPC-IRXDYDNUSA-N -1 1 309.409 4.196 20 0 DIADMM [O-]c1ccc(F)cc1-c1nc(-c2cccc3ccccc32)no1 ZINC000322896556 1052499564 /nfs/dbraw/zinc/49/95/64/1052499564.db2.gz GJUKDCVUPZDZLG-UHFFFAOYSA-N -1 1 306.296 4.402 20 0 DIADMM Cc1cc2nc[nH]c2cc1-c1cc(C(=O)[O-])cc(C(F)(F)F)c1 ZINC001222610529 1052517681 /nfs/dbraw/zinc/51/76/81/1052517681.db2.gz LTVDEEKBQREFEM-UHFFFAOYSA-N -1 1 320.270 4.255 20 0 DIADMM Oc1c(F)cc(F)c(-c2ccc3[n-]c(=S)sc3c2)c1F ZINC001235998840 1052653002 /nfs/dbraw/zinc/65/30/02/1052653002.db2.gz QRFRXLZBQDDMFM-UHFFFAOYSA-N -1 1 313.325 4.375 20 0 DIADMM C[C@H](c1ccco1)N(C(=O)c1ccc(Cl)cc1[O-])C1CC1 ZINC000126323565 1052669236 /nfs/dbraw/zinc/66/92/36/1052669236.db2.gz DOJUAULAOXBXSS-SNVBAGLBSA-N -1 1 305.761 4.004 20 0 DIADMM CCCCC[C@H](OCCCC[P@](=O)([O-])O)[C@H](C)CCC ZINC001225019614 1052744982 /nfs/dbraw/zinc/74/49/82/1052744982.db2.gz YXEYVNOOMDHSDZ-CABCVRRESA-N -1 1 308.399 4.346 20 0 DIADMM CC1(CNC(=O)NCc2ccc([O-])c(Cl)c2)CCCCCC1 ZINC001225429420 1052788046 /nfs/dbraw/zinc/78/80/46/1052788046.db2.gz DSJJRXPLSCDQBL-UHFFFAOYSA-N -1 1 324.852 4.205 20 0 DIADMM CC(=O)c1c(O)cc([O-])cc1O[C@@H]1CC[C@H]2CCCC[C@H]2C1 ZINC001225679979 1052815772 /nfs/dbraw/zinc/81/57/72/1052815772.db2.gz SZIZRKXZFJXEOV-VNHYZAJKSA-N -1 1 304.386 4.038 20 0 DIADMM O=C(/C=C\c1ccc(Cl)cc1)Nc1ccc([O-])c(Cl)c1 ZINC000210441502 1052851688 /nfs/dbraw/zinc/85/16/88/1052851688.db2.gz HNCJSSSRTUZGKB-BAQGIRSFSA-N -1 1 308.164 4.351 20 0 DIADMM Cc1ccc(-c2cc(C(=O)O[C@H](C)c3ccc(F)cc3)[nH]n2)o1 ZINC000919324399 1052863643 /nfs/dbraw/zinc/86/36/43/1052863643.db2.gz HQMLASJAIWEBKF-LLVKDONJSA-N -1 1 314.316 4.035 20 0 DIADMM Cc1cc(=O)oc2cc([O-])cc(O[C@@H]3CCC=CCCC3)c12 ZINC001226484326 1052901198 /nfs/dbraw/zinc/90/11/98/1052901198.db2.gz CUARFUCZUXEEMP-CQSZACIVSA-N -1 1 300.354 4.075 20 0 DIADMM Cc1ccc2c(c1)CC[C@@H]2Oc1cc([O-])cc2oc(=O)cc(C)c12 ZINC001226489506 1052902606 /nfs/dbraw/zinc/90/26/06/1052902606.db2.gz LFUGJMWQWRTDDP-INIZCTEOSA-N -1 1 322.360 4.182 20 0 DIADMM CN(CCCCc1ccccc1)C(=O)c1c([O-])cccc1Cl ZINC000920454788 1052939882 /nfs/dbraw/zinc/93/98/82/1052939882.db2.gz YYKXUKHZUWBGRC-UHFFFAOYSA-N -1 1 317.816 4.141 20 0 DIADMM C[C@@H](Cc1ccccc1Cl)NC(=O)c1c([O-])cccc1Cl ZINC000920451066 1052940214 /nfs/dbraw/zinc/94/02/14/1052940214.db2.gz LDXIFBIPPBGQFA-JTQLQIEISA-N -1 1 324.207 4.060 20 0 DIADMM CCc1ccc([C@@H](C)NC(=O)c2c([O-])cccc2Cl)cc1 ZINC000920427595 1052940571 /nfs/dbraw/zinc/94/05/71/1052940571.db2.gz GEMIRZGFYWOZOR-LLVKDONJSA-N -1 1 303.789 4.099 20 0 DIADMM C/C=C/[C@H](Oc1cc([O-])ccc1C(=O)COC)C1CCCCC1 ZINC001227171943 1052968089 /nfs/dbraw/zinc/96/80/89/1052968089.db2.gz IXBRWWLMMOHSFV-JGIVAVPZSA-N -1 1 318.413 4.125 20 0 DIADMM Fc1cnc(=S)[n-]c1OC1c2ccccc2-c2ccccc21 ZINC001227383837 1052987073 /nfs/dbraw/zinc/98/70/73/1052987073.db2.gz RZCBHVKLJGQDDF-UHFFFAOYSA-N -1 1 310.353 4.053 20 0 DIADMM C[C@H](Oc1cc(Cl)c([O-])cc1Cl)c1ncccc1F ZINC001227645055 1053005820 /nfs/dbraw/zinc/00/58/20/1053005820.db2.gz GGZTVJGYBOHCHO-ZETCQYMHSA-N -1 1 302.132 4.373 20 0 DIADMM CC(C)CCOC(=O)[C@@H](C)Oc1cc(Cl)c([O-])cc1Cl ZINC001227647376 1053005855 /nfs/dbraw/zinc/00/58/55/1053005855.db2.gz YAQNANLHJZJPHN-SECBINFHSA-N -1 1 321.200 4.056 20 0 DIADMM CO[C@@H](COc1cc(Cl)c([O-])cc1Cl)c1ccccc1 ZINC001227641427 1053005970 /nfs/dbraw/zinc/00/59/70/1053005970.db2.gz NTPZVRKZOLEZGW-HNNXBMFYSA-N -1 1 313.180 4.466 20 0 DIADMM Cc1cn2c(n1)[C@@H](Oc1cc(Cl)c([O-])cc1Cl)CCC2 ZINC001227645005 1053006031 /nfs/dbraw/zinc/00/60/31/1053006031.db2.gz GCKPYVPYLVAJEH-LBPRGKRZSA-N -1 1 313.184 4.118 20 0 DIADMM C[C@H](Oc1[n-]c(=O)nc2c1CO[C@H]2C)c1ccc2ccccc2c1 ZINC001227710040 1053009382 /nfs/dbraw/zinc/00/93/82/1053009382.db2.gz ILOKVSVDHBTVKQ-RYUDHWBXSA-N -1 1 322.364 4.067 20 0 DIADMM C[C@@H](Oc1[n-]c(=O)nc2c1CO[C@@H]2C)c1ccc2ccccc2c1 ZINC001227710044 1053009528 /nfs/dbraw/zinc/00/95/28/1053009528.db2.gz ILOKVSVDHBTVKQ-VXGBXAGGSA-N -1 1 322.364 4.067 20 0 DIADMM C[C@H]1C[C@@H](Oc2[n-]c(=S)nc3cnccc32)CC(C)(C)C1 ZINC001227880397 1053025257 /nfs/dbraw/zinc/02/52/57/1053025257.db2.gz APUVWFIXQWQMCS-WDEREUQCSA-N -1 1 303.431 4.281 20 0 DIADMM C[C@@H]1CN(Cc2cccc(Cl)c2[O-])C[C@H](c2ccccc2)O1 ZINC000179854701 1053031338 /nfs/dbraw/zinc/03/13/38/1053031338.db2.gz XBIHJDHHIHXHJB-CXAGYDPISA-N -1 1 317.816 4.008 20 0 DIADMM CCC(=O)c1ccccc1OC(=C([O-])c1ccco1)c1ccco1 ZINC001228453828 1053108094 /nfs/dbraw/zinc/10/80/94/1053108094.db2.gz GWGJCQPZABGINL-IBGZPJMESA-N -1 1 324.332 4.468 20 0 DIADMM CCC(=O)c1c(O)cc([O-])cc1O[C@@H](C)c1ccc(C)cc1C ZINC001228553382 1053132569 /nfs/dbraw/zinc/13/25/69/1053132569.db2.gz BORUXIIYMMCBLB-ZDUSSCGKSA-N -1 1 314.381 4.447 20 0 DIADMM CCC(=O)c1c(O)cc([O-])cc1O[C@H](CC)c1ccccc1 ZINC001228560314 1053134590 /nfs/dbraw/zinc/13/45/90/1053134590.db2.gz MOVYALPHSOFVIJ-MRXNPFEDSA-N -1 1 300.354 4.221 20 0 DIADMM CCC(=O)c1c(O)cc([O-])cc1O[C@@H]1CCc2cc(C)ccc21 ZINC001228560188 1053134683 /nfs/dbraw/zinc/13/46/83/1053134683.db2.gz KZOOOUKTDJPRQP-QGZVFWFLSA-N -1 1 312.365 4.065 20 0 DIADMM CCC(=O)c1c(O)cc([O-])cc1O[C@@H](C)c1c(F)cccc1F ZINC001228560399 1053134719 /nfs/dbraw/zinc/13/47/19/1053134719.db2.gz OFBAFAJRYXQJPS-VIFPVBQESA-N -1 1 322.307 4.109 20 0 DIADMM C[C@H](Oc1[n-]c(=S)nc2ccccc21)c1c(F)cccc1F ZINC001228760260 1053178318 /nfs/dbraw/zinc/17/83/18/1053178318.db2.gz KYTYUOCALWIVEF-VIFPVBQESA-N -1 1 318.348 4.337 20 0 DIADMM COc1cccc([C@H](C)Oc2[n-]c(=S)nc3ccccc32)c1 ZINC001228766986 1053178665 /nfs/dbraw/zinc/17/86/65/1053178665.db2.gz YEXXLIRAOQVSCI-NSHDSACASA-N -1 1 312.394 4.067 20 0 DIADMM C[C@@H](Oc1[n-]c(=S)nc2ccccc21)c1cccnc1Cl ZINC001228764149 1053178845 /nfs/dbraw/zinc/17/88/45/1053178845.db2.gz GMZDORPERVFVPA-SECBINFHSA-N -1 1 317.801 4.107 20 0 DIADMM CC(=O)c1c(C)cccc1OC(=C([O-])c1ccco1)c1ccco1 ZINC001228994602 1053220284 /nfs/dbraw/zinc/22/02/84/1053220284.db2.gz ZWFHLMFDPSYSSW-LJQANCHMSA-N -1 1 324.332 4.387 20 0 DIADMM CC[C@@H](Oc1cc([O-])cc2oc(=O)ccc12)c1ccccc1F ZINC001229133890 1053255740 /nfs/dbraw/zinc/25/57/40/1053255740.db2.gz CQZRMZIWCAZICW-OAHLLOKOSA-N -1 1 314.312 4.168 20 0 DIADMM CC[C@H](C)C[C@H](CC)Oc1c([O-])c(OC)cc2ccc(=O)oc21 ZINC001229217147 1053275534 /nfs/dbraw/zinc/27/55/34/1053275534.db2.gz YDHZSPJRBLJDSB-AAEUAGOBSA-N -1 1 320.385 4.101 20 0 DIADMM CC/C=C(\C)[C@@H](CC)Oc1c([O-])c(OC)cc2ccc(=O)oc21 ZINC001229217007 1053275869 /nfs/dbraw/zinc/27/58/69/1053275869.db2.gz XVLWNCNNNMHZQN-SVTZGKHISA-N -1 1 318.369 4.021 20 0 DIADMM COc1ccc([C@H](C)Oc2cc([O-])c(Cl)cc2Cl)cn1 ZINC001229410714 1053316934 /nfs/dbraw/zinc/31/69/34/1053316934.db2.gz MFHXUFFIQXGGHZ-QMMMGPOBSA-N -1 1 314.168 4.243 20 0 DIADMM CCC(=O)c1ccc([O-])cc1O[C@H](C)c1ccccc1OC ZINC001229475329 1053330980 /nfs/dbraw/zinc/33/09/80/1053330980.db2.gz UUGVQGHUCFILAH-GFCCVEGCSA-N -1 1 300.354 4.134 20 0 DIADMM CCC[C@H](C(=O)Nc1ccc(Br)c([O-])c1)C(C)C ZINC001320950193 1053377324 /nfs/dbraw/zinc/37/73/24/1053377324.db2.gz ZABCRTXLHMCQHL-NSHDSACASA-N -1 1 314.223 4.166 20 0 DIADMM CCc1cccc(S(=O)(=O)[N-]c2c(C)cc(Cl)cc2C)c1 ZINC001322962698 1053557700 /nfs/dbraw/zinc/55/77/00/1053557700.db2.gz ZUTBJNIFZJBRRD-UHFFFAOYSA-N -1 1 323.845 4.320 20 0 DIADMM Cc1c(Cl)cc([N-]S(=O)(=O)c2ccccc2)cc1Cl ZINC000620476458 1053668055 /nfs/dbraw/zinc/66/80/55/1053668055.db2.gz ZIDFIEQCDRZRCT-UHFFFAOYSA-N -1 1 316.209 4.103 20 0 DIADMM O=C([N-]c1c(F)ccnc1F)c1sc2ccccc2c1Cl ZINC001324730766 1053675562 /nfs/dbraw/zinc/67/55/62/1053675562.db2.gz VZFIHWUVWMFXDU-UHFFFAOYSA-N -1 1 324.739 4.480 20 0 DIADMM Cc1noc(-c2ccccc2)c1[N-]C(=O)c1ccc(C(F)F)o1 ZINC001435811861 1053689795 /nfs/dbraw/zinc/68/97/95/1053689795.db2.gz GWAQZOGUORFGPB-UHFFFAOYSA-N -1 1 318.279 4.433 20 0 DIADMM Cc1cccc([C@H](C)Oc2cccnc2-c2ncccc2[O-])c1 ZINC001231200116 1053698519 /nfs/dbraw/zinc/69/85/19/1053698519.db2.gz JPTOOHCONXOHFZ-AWEZNQCLSA-N -1 1 306.365 4.298 20 0 DIADMM Cc1cccc2c1CC[C@H]2Oc1cccnc1-c1ncccc1[O-] ZINC001231201291 1053700951 /nfs/dbraw/zinc/70/09/51/1053700951.db2.gz JRCKOIHEWLLUPR-QGZVFWFLSA-N -1 1 318.376 4.224 20 0 DIADMM Cc1ccc([C@H](C)Oc2cccnc2-c2ncccc2[O-])cc1 ZINC001231203248 1053700996 /nfs/dbraw/zinc/70/09/96/1053700996.db2.gz HMQXETHTZMCODS-AWEZNQCLSA-N -1 1 306.365 4.298 20 0 DIADMM CCC[C@@H](C)[C@H](CC)Oc1cccnc1-c1ncccc1[O-] ZINC001231201673 1053701606 /nfs/dbraw/zinc/70/16/06/1053701606.db2.gz BSIZFLCYLCJEIT-HIFRSBDPSA-N -1 1 300.402 4.443 20 0 DIADMM [O-]c1cccnc1-c1ncccc1O[C@@H](c1ccccc1)C1CC1 ZINC001231201455 1053702186 /nfs/dbraw/zinc/70/21/86/1053702186.db2.gz LAMGGBMDUASXOD-FQEVSTJZSA-N -1 1 318.376 4.379 20 0 DIADMM O=C(c1ccc([O-])cc1)c1ccccc1O[C@H]1CCC(F)(F)C1 ZINC001231230882 1053708843 /nfs/dbraw/zinc/70/88/43/1053708843.db2.gz QIXIYBVPWPTRAU-AWEZNQCLSA-N -1 1 318.319 4.190 20 0 DIADMM O=C(Nc1ccc(OC2CCCC2)cc1)c1ccc([O-])cc1F ZINC000154627995 1053742966 /nfs/dbraw/zinc/74/29/66/1053742966.db2.gz YHNRPGCDTBJXIA-UHFFFAOYSA-N -1 1 315.344 4.105 20 0 DIADMM [O-]c1cccc(CNc2ccc(N3CCCC3)cc2)c1Cl ZINC000293661439 1053982215 /nfs/dbraw/zinc/98/22/15/1053982215.db2.gz UAONPKUBSVPYGJ-UHFFFAOYSA-N -1 1 302.805 4.258 20 0 DIADMM CCC(CC)[C@@H](C)C(=O)Nc1ccc(Br)c([O-])c1 ZINC001331336631 1054072869 /nfs/dbraw/zinc/07/28/69/1054072869.db2.gz YKWUNHKNWIVENQ-SECBINFHSA-N -1 1 314.223 4.166 20 0 DIADMM [O-]c1c(Cl)ccc(CN2CC[C@H]3CCC[C@@H]3C2)c1Cl ZINC001232626112 1054087769 /nfs/dbraw/zinc/08/77/69/1054087769.db2.gz VSJGIWJNLGQSNT-GHMZBOCLSA-N -1 1 300.229 4.321 20 0 DIADMM C[C@H]([N-]C(=O)C(F)(F)c1ccc(C(C)(C)C)cc1)C(F)(F)F ZINC001437873265 1054105123 /nfs/dbraw/zinc/10/51/23/1054105123.db2.gz HMEJBRRVCKRLAV-VIFPVBQESA-N -1 1 323.305 4.143 20 0 DIADMM [O-]c1cccc(CN2CCCC[C@H]2c2cccnc2)c1Cl ZINC001232787999 1054118662 /nfs/dbraw/zinc/11/86/62/1054118662.db2.gz XSCLFYKPFXLNIT-HNNXBMFYSA-N -1 1 302.805 4.168 20 0 DIADMM [O-]c1cccc(CN2CCc3cc(Cl)ccc3C2)c1Cl ZINC001232788420 1054121300 /nfs/dbraw/zinc/12/13/00/1054121300.db2.gz UEJAEAUQGIWVJK-UHFFFAOYSA-N -1 1 308.208 4.257 20 0 DIADMM CC(C)c1nc(CN(C)Cc2cccc([O-])c2Cl)cs1 ZINC001232788026 1054121354 /nfs/dbraw/zinc/12/13/54/1054121354.db2.gz GNOPEPBHGXVKCN-UHFFFAOYSA-N -1 1 310.850 4.258 20 0 DIADMM CCN(Cc1cccc(F)c1F)Cc1cccc([O-])c1Cl ZINC001232788971 1054121376 /nfs/dbraw/zinc/12/13/76/1054121376.db2.gz DUWGEONESOYWIR-UHFFFAOYSA-N -1 1 311.759 4.346 20 0 DIADMM CCN(Cc1cccc(Cl)c1)Cc1ccc(F)c([O-])c1F ZINC001232941028 1054153602 /nfs/dbraw/zinc/15/36/02/1054153602.db2.gz SJNQPXLECAUFGR-UHFFFAOYSA-N -1 1 311.759 4.346 20 0 DIADMM COc1ccc([C@H]2CCCN2Cc2ccc(F)c([O-])c2F)cc1 ZINC001232936866 1054154019 /nfs/dbraw/zinc/15/40/19/1054154019.db2.gz YAWROUGIFQOWQZ-MRXNPFEDSA-N -1 1 319.351 4.016 20 0 DIADMM CC[C@H]1c2ccccc2CCN1Cc1cc([O-])c(F)c(F)c1 ZINC001232975193 1054161806 /nfs/dbraw/zinc/16/18/06/1054161806.db2.gz GHXMRHUDMZQLCJ-INIZCTEOSA-N -1 1 303.352 4.180 20 0 DIADMM COc1cccc([C@H]2CCCN2Cc2cc([O-])c(F)c(F)c2)c1 ZINC001232972929 1054162191 /nfs/dbraw/zinc/16/21/91/1054162191.db2.gz HAIAVBMPMPSOHG-MRXNPFEDSA-N -1 1 319.351 4.016 20 0 DIADMM [O-]c1cc(CN2CCC(c3ccccc3F)CC2)cc(F)c1F ZINC001232971907 1054162938 /nfs/dbraw/zinc/16/29/38/1054162938.db2.gz RWBRZTJTAZHWFK-UHFFFAOYSA-N -1 1 321.342 4.189 20 0 DIADMM [O-]c1cc(CN2CCC[C@@H]2c2ccc(F)cc2)cc(F)c1F ZINC001232971253 1054163148 /nfs/dbraw/zinc/16/31/48/1054163148.db2.gz ZCYSXKPTOQTLOE-OAHLLOKOSA-N -1 1 307.315 4.147 20 0 DIADMM Cc1cccc(C[N@@H+](Cc2cc(Cl)ncc2O)C2CC2)c1C ZINC001233037327 1054174090 /nfs/dbraw/zinc/17/40/90/1054174090.db2.gz CIBKVTBYJIEDKB-UHFFFAOYSA-N -1 1 316.832 4.222 20 0 DIADMM CCC1(CC)CN(C(=O)c2cc(F)ccc2[O-])c2ccccc21 ZINC000622459134 1054233021 /nfs/dbraw/zinc/23/30/21/1054233021.db2.gz KUGLKDHUQCFWSE-UHFFFAOYSA-N -1 1 313.372 4.250 20 0 DIADMM Oc1ccc(F)c(CN2CCC[C@H]2Cc2ccc(F)cc2)c1F ZINC001233397236 1054258918 /nfs/dbraw/zinc/25/89/18/1054258918.db2.gz QMVSAVQKJGUQDS-AWEZNQCLSA-N -1 1 321.342 4.017 20 0 DIADMM CCc1nc(C)c(NC(=O)c2cc3ccccc3cc2[O-])s1 ZINC000622524526 1054260269 /nfs/dbraw/zinc/26/02/69/1054260269.db2.gz YWDDZYJLOQNLNB-UHFFFAOYSA-N -1 1 312.394 4.125 20 0 DIADMM COc1cc(C)c(NC(=O)c2ccc(C(C)C)cc2[O-])cc1F ZINC000622520497 1054270323 /nfs/dbraw/zinc/27/03/23/1054270323.db2.gz VXXVFFVWVQUTAZ-UHFFFAOYSA-N -1 1 317.360 4.224 20 0 DIADMM Cc1nc(S[C@@H]2CCCc3ccc(F)cc32)[n-]c(=O)c1C ZINC001473011124 1054279842 /nfs/dbraw/zinc/27/98/42/1054279842.db2.gz ILWMZFNRBVMZKL-CQSZACIVSA-N -1 1 304.390 4.108 20 0 DIADMM CC(C)c1ccc(C(=O)Nc2ccccc2OCCF)c([O-])c1 ZINC000622629701 1054312393 /nfs/dbraw/zinc/31/23/93/1054312393.db2.gz ZRYDBLSTDCVVNX-UHFFFAOYSA-N -1 1 317.360 4.116 20 0 DIADMM CCCC(=O)c1ccc([O-])cc1O[C@@H]1CCC(=O)c2ccccc21 ZINC001233650672 1054322423 /nfs/dbraw/zinc/32/24/23/1054322423.db2.gz PHJJXYVIPUVCQQ-LJQANCHMSA-N -1 1 324.376 4.472 20 0 DIADMM Cc1ccc(CN(C)C(=O)c2cc3ccccc3cc2[O-])cc1C ZINC000622671048 1054333069 /nfs/dbraw/zinc/33/30/69/1054333069.db2.gz WOVRSUAJDYQPDA-UHFFFAOYSA-N -1 1 319.404 4.434 20 0 DIADMM CSc1ccc([O-])c(C(=O)Nc2cc(Cl)ccc2C)c1 ZINC001440420298 1054351140 /nfs/dbraw/zinc/35/11/40/1054351140.db2.gz YVTOHMIRQKDQFR-UHFFFAOYSA-N -1 1 307.802 4.328 20 0 DIADMM O=C(N[C@@H](c1ccc(Cl)cc1)C1CC1)c1c([O-])cccc1F ZINC001440667023 1054363137 /nfs/dbraw/zinc/36/31/37/1054363137.db2.gz PEZJXKWONWLOAX-MRXNPFEDSA-N -1 1 319.763 4.066 20 0 DIADMM O=C(Cc1ccc(O[C@@H]2C[C@H]3C=C[C@@H]2C3)cc1)c1ccc([O-])cc1 ZINC001233940078 1054394357 /nfs/dbraw/zinc/39/43/57/1054394357.db2.gz AAIKSABKNWKNMV-LUQKVYGDSA-N -1 1 320.388 4.161 20 0 DIADMM CCCOc1ccc(Cl)cc1NC(=O)c1cccc([O-])c1F ZINC001441724125 1054396902 /nfs/dbraw/zinc/39/69/02/1054396902.db2.gz BUZNSAMXSMULMK-UHFFFAOYSA-N -1 1 323.751 4.226 20 0 DIADMM O=C(c1cc(Cl)ccc1[O-])N1CCC[C@@H]1c1cccc(F)c1 ZINC001441889495 1054401260 /nfs/dbraw/zinc/40/12/60/1054401260.db2.gz YEVYAYJTJXAFKW-OAHLLOKOSA-N -1 1 319.763 4.162 20 0 DIADMM O=C([N-]O[C@@H]1CCCCO1)C1(C2CCCCC2)CCCCC1 ZINC001442534866 1054424219 /nfs/dbraw/zinc/42/42/19/1054424219.db2.gz XPNLMWGZWZSLEZ-MRXNPFEDSA-N -1 1 309.450 4.092 20 0 DIADMM Cc1nc(NC(=O)c2ccccc2[O-])sc1Cc1ccccc1 ZINC001442614706 1054428308 /nfs/dbraw/zinc/42/83/08/1054428308.db2.gz INQCKGRQASKYEP-UHFFFAOYSA-N -1 1 324.405 4.000 20 0 DIADMM O=C(Nc1ccccc1Sc1ccccc1)c1cncc([O-])c1 ZINC000336868175 1054454548 /nfs/dbraw/zinc/45/45/48/1054454548.db2.gz RRMZOABIVLNPAN-UHFFFAOYSA-N -1 1 322.389 4.191 20 0 DIADMM CC(C)(C)CCCCNC(=O)c1ccc(C(F)(F)F)c([O-])c1 ZINC001443721857 1054457312 /nfs/dbraw/zinc/45/73/12/1054457312.db2.gz CWBVHGHIKIKWGU-UHFFFAOYSA-N -1 1 317.351 4.357 20 0 DIADMM Cc1ccc([C@@H]2CCCCN2C(=O)c2cccc([O-])c2F)cc1 ZINC001444335440 1054473958 /nfs/dbraw/zinc/47/39/58/1054473958.db2.gz HGKCNEGYLDWWLV-INIZCTEOSA-N -1 1 313.372 4.207 20 0 DIADMM Cc1ccc([C@H]2C[C@@H](C)CCN2C(=O)c2ccc(F)c([O-])c2)o1 ZINC001444887755 1054490809 /nfs/dbraw/zinc/49/08/09/1054490809.db2.gz UACQYUVVCMOWPX-XHDPSFHLSA-N -1 1 317.360 4.046 20 0 DIADMM CCCNc1ccc(Cl)cc1NC(=O)c1cccc([O-])c1F ZINC001446125599 1054525761 /nfs/dbraw/zinc/52/57/61/1054525761.db2.gz MXTKUSCRAAXVGC-UHFFFAOYSA-N -1 1 322.767 4.259 20 0 DIADMM CCC[C@@H](CC)C(=O)Nc1cc(C)cc(Br)c1[O-] ZINC001446846872 1054546397 /nfs/dbraw/zinc/54/63/97/1054546397.db2.gz JBEJCKPBSKADAX-SNVBAGLBSA-N -1 1 314.223 4.228 20 0 DIADMM Cc1cnc(CN[C@H](C)c2ccc(Cl)c(Cl)c2[O-])s1 ZINC000185569431 1054582306 /nfs/dbraw/zinc/58/23/06/1054582306.db2.gz DDHHXZLJPOLOKO-MRVPVSSYSA-N -1 1 317.241 4.315 20 0 DIADMM CCSCc1ccc(NC(=O)c2cccc([O-])c2F)cc1 ZINC001449734558 1054626148 /nfs/dbraw/zinc/62/61/48/1054626148.db2.gz VDSRQWQJNBUXFQ-UHFFFAOYSA-N -1 1 305.374 4.037 20 0 DIADMM CC[C@@H]1CCCC[C@H]1CNC(=O)c1cc2ccccc2cc1[O-] ZINC001450397587 1054648182 /nfs/dbraw/zinc/64/81/82/1054648182.db2.gz DUDNITQBXNUGLG-PBHICJAKSA-N -1 1 311.425 4.492 20 0 DIADMM Cc1ccc(C(=O)Nc2cc([O-])c(F)cc2F)c(F)c1Cl ZINC001450892102 1054663872 /nfs/dbraw/zinc/66/38/72/1054663872.db2.gz ABSXPJMSPUNZOO-UHFFFAOYSA-N -1 1 315.678 4.024 20 0 DIADMM C/C(=C\c1ccc(Cl)cc1)C(=O)Nc1cc([O-])c(F)cc1F ZINC001450899841 1054663927 /nfs/dbraw/zinc/66/39/27/1054663927.db2.gz SPXDDIMWQPZWNU-RMKNXTFCSA-N -1 1 323.726 4.366 20 0 DIADMM C=COc1ccc(NC(=O)c2ccc(C(F)(F)F)cc2[O-])cc1 ZINC001451150352 1054669634 /nfs/dbraw/zinc/66/96/34/1054669634.db2.gz OQJZKZGMVZUOJG-UHFFFAOYSA-N -1 1 323.270 4.186 20 0 DIADMM CSc1cc(NC(=O)c2ccc([O-])c(F)c2)ccc1Cl ZINC001451485209 1054680802 /nfs/dbraw/zinc/68/08/02/1054680802.db2.gz LBRRRLVHPQIDML-UHFFFAOYSA-N -1 1 311.765 4.159 20 0 DIADMM O=C(Nc1cc(F)cc(F)c1[O-])c1cc2ccc(F)cc2s1 ZINC001451740653 1054685232 /nfs/dbraw/zinc/68/52/32/1054685232.db2.gz HJVBQAXYCZWXSO-UHFFFAOYSA-N -1 1 323.295 4.277 20 0 DIADMM CC(C)[C@@H](CC(=O)Nc1cc(F)cc(F)c1[O-])c1ccccc1 ZINC001451743777 1054687366 /nfs/dbraw/zinc/68/73/66/1054687366.db2.gz ORXFUZRUKFQNAN-CQSZACIVSA-N -1 1 319.351 4.439 20 0 DIADMM C[C@H](NC(=O)c1ccc(C(F)(F)F)c([O-])c1)C1CCCCC1 ZINC001451995016 1054691253 /nfs/dbraw/zinc/69/12/53/1054691253.db2.gz GSGUKFVFAHSUGT-JTQLQIEISA-N -1 1 315.335 4.110 20 0 DIADMM CSc1ccc(CCCC(=O)Nc2c([O-])cccc2F)cc1 ZINC001453020350 1054725777 /nfs/dbraw/zinc/72/57/77/1054725777.db2.gz ZEMIIPMFJIAZGU-UHFFFAOYSA-N -1 1 319.401 4.215 20 0 DIADMM CSc1ccc([O-])c(C(=O)Nc2cccc(F)c2SC)c1 ZINC001453283993 1054730315 /nfs/dbraw/zinc/73/03/15/1054730315.db2.gz GOGHJDUHGSLYPR-UHFFFAOYSA-N -1 1 323.414 4.227 20 0 DIADMM Cc1ccc2sc(NC(=O)c3ccc([O-])c(F)c3)nc2c1C ZINC001454730178 1054780478 /nfs/dbraw/zinc/78/04/78/1054780478.db2.gz ILSCDHILHTXSEX-UHFFFAOYSA-N -1 1 316.357 4.010 20 0 DIADMM CCCCc1ccc(CC(=O)Nc2cccc(F)c2[O-])cc1 ZINC001454752099 1054783784 /nfs/dbraw/zinc/78/37/84/1054783784.db2.gz CBXAVKQGNLCQQH-UHFFFAOYSA-N -1 1 301.361 4.055 20 0 DIADMM CSc1nc2sccc2c(-c2c(F)ccc(C)c2[O-])n1 ZINC001236388977 1055087728 /nfs/dbraw/zinc/08/77/28/1055087728.db2.gz CPCUIYNPZIZLBV-UHFFFAOYSA-N -1 1 306.387 4.233 20 0 DIADMM Cc1ccc(F)c(-c2cccc(OCc3ccccc3)n2)c1[O-] ZINC001236394176 1055091896 /nfs/dbraw/zinc/09/18/96/1055091896.db2.gz ZPNFMMKXSFSEKD-UHFFFAOYSA-N -1 1 309.340 4.481 20 0 DIADMM COc1cc2ccc(-c3c(F)ccc(C)c3[O-])nc2cc1OC ZINC001236393946 1055092071 /nfs/dbraw/zinc/09/20/71/1055092071.db2.gz YYXRVHXLLWMNAN-UHFFFAOYSA-N -1 1 313.328 4.072 20 0 DIADMM Cc1ccc(F)c(-c2cc(C3(C(F)(F)F)CC3)ccn2)c1[O-] ZINC001236402579 1055093308 /nfs/dbraw/zinc/09/33/08/1055093308.db2.gz MATDAUJSCYTAAZ-UHFFFAOYSA-N -1 1 311.278 4.496 20 0 DIADMM O=C(Nc1cccc(F)c1[O-])c1cc(Cl)sc1Cl ZINC001587389278 1055284548 /nfs/dbraw/zinc/28/45/48/1055284548.db2.gz DVXKGXHMIFCGFC-UHFFFAOYSA-N -1 1 306.145 4.152 20 0 DIADMM CC(C)(C)Sc1cc(C(=O)Nc2cccc(F)c2[O-])ccn1 ZINC001587390093 1055284783 /nfs/dbraw/zinc/28/47/83/1055284783.db2.gz ZOMDKWMKNJGNIP-UHFFFAOYSA-N -1 1 320.389 4.069 20 0 DIADMM CC(C)c1ccc(CCC(=O)Nc2cccc(F)c2[O-])cc1 ZINC001587389530 1055285490 /nfs/dbraw/zinc/28/54/90/1055285490.db2.gz MLCGNDRRPFZFKG-UHFFFAOYSA-N -1 1 301.361 4.226 20 0 DIADMM O=C(N[C@@H]1CC[C@H]2CCCC[C@H]2C1)c1c([O-])cccc1Cl ZINC001587542805 1055324400 /nfs/dbraw/zinc/32/44/00/1055324400.db2.gz GAGBLYGCEXXVPJ-FRRDWIJNSA-N -1 1 307.821 4.134 20 0 DIADMM CC(C)CC(C)(C)CNC(=O)c1ccc2ccc(O)cc2c1[O-] ZINC001587579299 1055329122 /nfs/dbraw/zinc/32/91/22/1055329122.db2.gz HUNLINVVSCKIDY-UHFFFAOYSA-N -1 1 315.413 4.053 20 0 DIADMM C[C@@H](CSc1ccc(F)cc1)C(=O)Nc1cccc(F)c1[O-] ZINC001302486380 1055340474 /nfs/dbraw/zinc/34/04/74/1055340474.db2.gz PHMRNFQUNXVHAB-JTQLQIEISA-N -1 1 323.364 4.037 20 0 DIADMM O=C(CCC1CCCCCC1)NCc1ccc([O-])c(Cl)c1 ZINC001594565317 1055566526 /nfs/dbraw/zinc/56/65/26/1055566526.db2.gz DMBIXDFMKMOECY-UHFFFAOYSA-N -1 1 309.837 4.412 20 0 DIADMM CCC(CC)(CC)CNC(=O)c1ccc(C(F)(F)F)c([O-])c1 ZINC001595861240 1055641986 /nfs/dbraw/zinc/64/19/86/1055641986.db2.gz AFDJEKDESVDQLF-UHFFFAOYSA-N -1 1 317.351 4.357 20 0 DIADMM CCC(C)(C)c1ccc(S(=O)(=O)[N-]c2ccccc2)cc1 ZINC000033752316 1055660360 /nfs/dbraw/zinc/66/03/60/1055660360.db2.gz LBZGWOCKQLCXKF-UHFFFAOYSA-N -1 1 303.427 4.175 20 0 DIADMM CC(C)[C@H]1CCC[C@H](NC(=O)c2ccc3ccccc3c2[O-])C1 ZINC001565659305 1055715852 /nfs/dbraw/zinc/71/58/52/1055715852.db2.gz OLEQBFUZEJKPRD-HOTGVXAUSA-N -1 1 311.425 4.490 20 0 DIADMM CCN(C(=O)c1ccc(C(F)(F)F)c([O-])c1)c1ccccc1C ZINC001596529078 1055719968 /nfs/dbraw/zinc/71/99/68/1055719968.db2.gz QGDMOEHDXVSJOE-UHFFFAOYSA-N -1 1 323.314 4.386 20 0 DIADMM CCCCC[C@H](NC(=O)c1cc(C)cc(C=O)c1[O-])C(C)(C)C ZINC001565734073 1055723878 /nfs/dbraw/zinc/72/38/78/1055723878.db2.gz UUXKNIHFNKGWHQ-INIZCTEOSA-N -1 1 319.445 4.238 20 0 DIADMM CCC[C@@]1(C)CCCN(C(=O)Cc2ccc([O-])c(Cl)c2)C1 ZINC001566099346 1055742110 /nfs/dbraw/zinc/74/21/10/1055742110.db2.gz KOPUWSMYGVREST-KRWDZBQOSA-N -1 1 309.837 4.017 20 0 DIADMM CC1(C)Cc2cc(C(=O)Nc3ccc([O-])c(Cl)c3)ccc2O1 ZINC001596819289 1055749450 /nfs/dbraw/zinc/74/94/50/1055749450.db2.gz CQGCDBUHRYOILP-UHFFFAOYSA-N -1 1 317.772 4.011 20 0 DIADMM O=C(Nc1ccc([O-])c(Cl)c1)c1cccc(C(F)F)c1F ZINC001596820479 1055750728 /nfs/dbraw/zinc/75/07/28/1055750728.db2.gz WPZAKYQHYRZLKP-UHFFFAOYSA-N -1 1 315.678 4.375 20 0 DIADMM C[C@@H](NC(=O)c1ccc(Cl)cc1[O-])c1ccc2c(c1)CCC2 ZINC001567154394 1055794147 /nfs/dbraw/zinc/79/41/47/1055794147.db2.gz HHGWURQPGWJMIC-LLVKDONJSA-N -1 1 315.800 4.025 20 0 DIADMM CCOC(=O)c1nc2ccc(-c3cccc(Cl)c3F)cc2[n-]1 ZINC001238961044 1055804141 /nfs/dbraw/zinc/80/41/41/1055804141.db2.gz VCJGTBUFDAYSEE-UHFFFAOYSA-N -1 1 318.735 4.199 20 0 DIADMM CCOC(=O)c1nc2cc(-c3cccc(Cl)c3F)ccc2[n-]1 ZINC001238961044 1055804149 /nfs/dbraw/zinc/80/41/49/1055804149.db2.gz VCJGTBUFDAYSEE-UHFFFAOYSA-N -1 1 318.735 4.199 20 0 DIADMM CC(C)[C@H](NC(=O)c1c([O-])cccc1Cl)c1ccc(F)cc1 ZINC001568130916 1055830006 /nfs/dbraw/zinc/83/00/06/1055830006.db2.gz LBIIKGNZNPIVLS-INIZCTEOSA-N -1 1 321.779 4.312 20 0 DIADMM CCOC(=O)c1nc2ccc(-c3coc4ccccc43)cc2[n-]1 ZINC001239063035 1055835980 /nfs/dbraw/zinc/83/59/80/1055835980.db2.gz AZDGDVOAWNQXQK-UHFFFAOYSA-N -1 1 306.321 4.153 20 0 DIADMM CCOC(=O)c1nc2cc(-c3coc4ccccc43)ccc2[n-]1 ZINC001239063035 1055835984 /nfs/dbraw/zinc/83/59/84/1055835984.db2.gz AZDGDVOAWNQXQK-UHFFFAOYSA-N -1 1 306.321 4.153 20 0 DIADMM CCCC[C@H](CC)C(=O)Nc1cccc([O-])c1Br ZINC001569379152 1055861287 /nfs/dbraw/zinc/86/12/87/1055861287.db2.gz PUMMNWKXQNRIJL-JTQLQIEISA-N -1 1 314.223 4.310 20 0 DIADMM C[C@@H]1C[C@H](C(C)(C)C)CCN1Cc1nc(=O)c2sccc2[n-]1 ZINC000347575828 1055849873 /nfs/dbraw/zinc/84/98/73/1055849873.db2.gz DCUDNCQMTWCNNR-VXGBXAGGSA-N -1 1 319.474 4.044 20 0 DIADMM C[C@@H](C(=O)Nc1ccc([O-])c(F)c1F)c1cc2ccccc2o1 ZINC001569010809 1055851894 /nfs/dbraw/zinc/85/18/94/1055851894.db2.gz NSHGYXQNJQBTOT-SECBINFHSA-N -1 1 317.291 4.159 20 0 DIADMM CCc1ccc(NC(=O)c2ccc3ccccc3c2[O-])cc1OC ZINC001569181818 1055855263 /nfs/dbraw/zinc/85/52/63/1055855263.db2.gz KSBUHPAXVUJVEI-UHFFFAOYSA-N -1 1 321.376 4.369 20 0 DIADMM O=C([O-])c1ccc(-c2cccc3nc(C(F)(F)F)[nH]c32)c(F)c1 ZINC001239274770 1055856658 /nfs/dbraw/zinc/85/66/58/1055856658.db2.gz FYWGQMJAOOEJBY-UHFFFAOYSA-N -1 1 324.233 4.086 20 0 DIADMM C[C@H](NC(=O)c1cc(Cl)ccc1[O-])c1cccc(C2CC2)c1 ZINC001569655951 1055868118 /nfs/dbraw/zinc/86/81/18/1055868118.db2.gz SYBJAYDYYQVMOU-NSHDSACASA-N -1 1 315.800 4.414 20 0 DIADMM O=C(Nc1cc(F)cc(F)c1[O-])[C@@H]1CCC[C@H]2CCCC[C@H]21 ZINC001570465948 1055904364 /nfs/dbraw/zinc/90/43/64/1055904364.db2.gz WLNWBIYFLUNCJM-RAIGVLPGSA-N -1 1 309.356 4.215 20 0 DIADMM CN(C(=O)c1c([O-])cccc1Cl)[C@H]1CCC[C@@H]1C(C)(C)C ZINC001570457566 1055904798 /nfs/dbraw/zinc/90/47/98/1055904798.db2.gz YEIZREMXECBDIY-AAEUAGOBSA-N -1 1 309.837 4.332 20 0 DIADMM O=C(Cc1ccc([O-])c(Cl)c1)N[C@@H](C1CCC1)C1CCCC1 ZINC001570659599 1055911375 /nfs/dbraw/zinc/91/13/75/1055911375.db2.gz SAIZZYKWGYFEDR-GOSISDBHSA-N -1 1 321.848 4.063 20 0 DIADMM CCOC(=O)c1nc2cc(-c3ccc(SC)cc3)ccc2[n-]1 ZINC001239498562 1055913370 /nfs/dbraw/zinc/91/33/70/1055913370.db2.gz MCWNHTNMFXILPU-UHFFFAOYSA-N -1 1 312.394 4.129 20 0 DIADMM CCOC(=O)c1nc2ccc(-c3ccc(SC)cc3)cc2[n-]1 ZINC001239498562 1055913378 /nfs/dbraw/zinc/91/33/78/1055913378.db2.gz MCWNHTNMFXILPU-UHFFFAOYSA-N -1 1 312.394 4.129 20 0 DIADMM COc1cccc(-c2ccc([C@H](C)[N-]C(=O)C(F)(F)F)cc2)c1 ZINC001239522865 1055928825 /nfs/dbraw/zinc/92/88/25/1055928825.db2.gz RITDNXKWJQYQHP-NSHDSACASA-N -1 1 323.314 4.102 20 0 DIADMM O=C(Nc1cc(F)c([O-])cc1Cl)[C@H]1C[C@H]1c1ccc(F)cc1 ZINC001598582791 1055957899 /nfs/dbraw/zinc/95/78/99/1055957899.db2.gz OGOCMZAODCGTIF-QWRGUYRKSA-N -1 1 323.726 4.066 20 0 DIADMM O=C(Nc1cc(F)c([O-])cc1Cl)[C@H]1C[C@@H]1c1ccc(F)cc1 ZINC001598582790 1055958574 /nfs/dbraw/zinc/95/85/74/1055958574.db2.gz OGOCMZAODCGTIF-MNOVXSKESA-N -1 1 323.726 4.066 20 0 DIADMM O=C(Nc1cc(F)c([O-])cc1Cl)[C@@H](F)CC1CCCCC1 ZINC001598591151 1055958873 /nfs/dbraw/zinc/95/88/73/1055958873.db2.gz YPIWNCWXSVEDHI-LBPRGKRZSA-N -1 1 317.763 4.432 20 0 DIADMM O=C(Cc1ccc([O-])c(Cl)c1)Nc1ccc(Cl)cc1F ZINC001540384780 1056024837 /nfs/dbraw/zinc/02/48/37/1056024837.db2.gz WPMDSQRLOPUDPN-UHFFFAOYSA-N -1 1 314.143 4.019 20 0 DIADMM CSc1ccc([O-])c(C(=O)Nc2ccc(C)cc2Cl)c1 ZINC001540428526 1056029314 /nfs/dbraw/zinc/02/93/14/1056029314.db2.gz BEPCIEMLZDFBTB-UHFFFAOYSA-N -1 1 307.802 4.328 20 0 DIADMM O=C(c1cc(Cl)ccc1[O-])N1CCC[C@@H]1c1ccc(F)cc1 ZINC001540547925 1056042605 /nfs/dbraw/zinc/04/26/05/1056042605.db2.gz GSWQWVXZUDYLOE-OAHLLOKOSA-N -1 1 319.763 4.162 20 0 DIADMM CC[C@H](NC(=O)Cc1ccc([O-])c(Cl)c1)C1CCCCC1 ZINC001607365009 1056049043 /nfs/dbraw/zinc/04/90/43/1056049043.db2.gz KLXBIUGMXOCPBK-HNNXBMFYSA-N -1 1 309.837 4.063 20 0 DIADMM CCCCC1CCC(CNC(=O)c2cc(F)ccc2[O-])CC1 ZINC001583327608 1056064740 /nfs/dbraw/zinc/06/47/40/1056064740.db2.gz LAZXMQIJBOIQEX-UHFFFAOYSA-N -1 1 307.409 4.258 20 0 DIADMM CSc1ccc([O-])c(C(=O)Nc2ccccc2C(C)C)c1 ZINC001540705355 1056064917 /nfs/dbraw/zinc/06/49/17/1056064917.db2.gz WRWSGIAEZHINNO-UHFFFAOYSA-N -1 1 301.411 4.490 20 0 DIADMM CC(C)(C)[C@@H]1CCCC[C@H]1NC(=O)Cc1ccc([O-])c(Cl)c1 ZINC001540711687 1056065997 /nfs/dbraw/zinc/06/59/97/1056065997.db2.gz AMVSSRXGVDOZQW-UKRRQHHQSA-N -1 1 323.864 4.309 20 0 DIADMM CC(C)(C)[C@H]1CCCC[C@@H]1NC(=O)Cc1ccc([O-])c(Cl)c1 ZINC001540711688 1056066024 /nfs/dbraw/zinc/06/60/24/1056066024.db2.gz AMVSSRXGVDOZQW-ZFWWWQNUSA-N -1 1 323.864 4.309 20 0 DIADMM CC(C)Oc1ccc(NC(=O)c2ccc(F)c([O-])c2)cc1Cl ZINC001540766598 1056073433 /nfs/dbraw/zinc/07/34/33/1056073433.db2.gz RCHAWGOATNCJBT-UHFFFAOYSA-N -1 1 323.751 4.224 20 0 DIADMM CCC(CC)N(C(=O)c1ccc2ccc(O)cc2c1[O-])C1CC1 ZINC001611093915 1056108253 /nfs/dbraw/zinc/10/82/53/1056108253.db2.gz JNJVAGNJIYRAGF-UHFFFAOYSA-N -1 1 313.397 4.044 20 0 DIADMM O=C(c1cccc([O-])c1F)N1CC2(CC=CC2)[C@@H]1c1ccccc1 ZINC001583591262 1056112329 /nfs/dbraw/zinc/11/23/29/1056112329.db2.gz OIQXKKIPBGDHFZ-SFHVURJKSA-N -1 1 323.367 4.065 20 0 DIADMM Cc1cc2occ(C(=O)Nc3nc(Cl)ccc3[O-])c2cc1C ZINC001611167216 1056120831 /nfs/dbraw/zinc/12/08/31/1056120831.db2.gz XVSGDARQZDDZCL-UHFFFAOYSA-N -1 1 316.744 4.056 20 0 DIADMM CC(C)c1ccc(C(=O)Nc2ccc3ccccc3n2)c([O-])c1 ZINC001542523132 1056128837 /nfs/dbraw/zinc/12/88/37/1056128837.db2.gz SPVOAWIWIVGKFI-UHFFFAOYSA-N -1 1 306.365 4.316 20 0 DIADMM C[C@H](NC(=O)c1ncc2ccccc2c1[O-])C1CCCCCC1 ZINC001611315789 1056141369 /nfs/dbraw/zinc/14/13/69/1056141369.db2.gz HGRAAAOQQIHJRP-ZDUSSCGKSA-N -1 1 312.413 4.029 20 0 DIADMM O=C([N-]c1cscc1Cl)c1cc(-c2ccc(F)cc2)no1 ZINC001583716312 1056149807 /nfs/dbraw/zinc/14/98/07/1056149807.db2.gz WARQWJUNEOSVRU-UHFFFAOYSA-N -1 1 322.748 4.448 20 0 DIADMM Cc1ccc(F)cc1S(=O)(=O)[N-]c1ccccc1C(C)C ZINC000055551504 1056274177 /nfs/dbraw/zinc/27/41/77/1056274177.db2.gz HPYARXWOMFZVJB-UHFFFAOYSA-N -1 1 307.390 4.058 20 0 DIADMM O=C(NCCC1CCCCC1)c1ccc(C(F)(F)F)cc1[O-] ZINC001543706211 1056281581 /nfs/dbraw/zinc/28/15/81/1056281581.db2.gz JEQGDAOTWMEDAQ-UHFFFAOYSA-N -1 1 315.335 4.111 20 0 DIADMM CC(C)(NC(=O)c1cc2ccccc2cc1[O-])c1cccs1 ZINC001543707373 1056282420 /nfs/dbraw/zinc/28/24/20/1056282420.db2.gz FONACDIAGJXLEU-UHFFFAOYSA-N -1 1 311.406 4.272 20 0 DIADMM O=C(N[C@@H]1CCc2c1cccc2Cl)c1ccc(Cl)cc1[O-] ZINC001543721234 1056284133 /nfs/dbraw/zinc/28/41/33/1056284133.db2.gz LIDFNEXTKBKUGC-CQSZACIVSA-N -1 1 322.191 4.116 20 0 DIADMM [O-]c1ccc(CNc2cc(Cl)nc(C3CCC3)n2)cc1Cl ZINC001612852806 1056334094 /nfs/dbraw/zinc/33/40/94/1056334094.db2.gz DQAQYFCWIZGCMV-UHFFFAOYSA-N -1 1 324.211 4.369 20 0 DIADMM O=C([O-])c1ccc(CN(Cc2ccccc2)Cc2ccccc2)o1 ZINC000011895231 1056378421 /nfs/dbraw/zinc/37/84/21/1056378421.db2.gz ILPVGCAFSSKUEY-UHFFFAOYSA-N -1 1 321.376 4.180 20 0 DIADMM CC1(C)CC[C@@H](NC(=O)c2ccc([O-])c(F)c2)c2ccccc21 ZINC001544257779 1056393964 /nfs/dbraw/zinc/39/39/64/1056393964.db2.gz MEOVPBLKCSCICP-MRXNPFEDSA-N -1 1 313.372 4.074 20 0 DIADMM Cc1cccc([N-]S(=O)(=O)c2ccc(C)c3ccccc32)c1 ZINC000012291148 1056395506 /nfs/dbraw/zinc/39/55/06/1056395506.db2.gz OWNVEJFNAFKMCO-UHFFFAOYSA-N -1 1 311.406 4.257 20 0 DIADMM Cc1ccc([N-]S(=O)(=O)c2ccc(C)c3ccccc32)cc1 ZINC000012291188 1056396191 /nfs/dbraw/zinc/39/61/91/1056396191.db2.gz WQVSDVZYHJBRPM-UHFFFAOYSA-N -1 1 311.406 4.257 20 0 DIADMM Cc1cccc(C2(NC(=O)c3cccc([O-])c3F)CCCC2)c1 ZINC001584709507 1056402334 /nfs/dbraw/zinc/40/23/34/1056402334.db2.gz MMWNIAZUOWAKLK-UHFFFAOYSA-N -1 1 313.372 4.039 20 0 DIADMM CC(C)CC[C@@H]1CCC[C@@H]1NC(=O)c1cc(Cl)ccc1[O-] ZINC001584729955 1056405578 /nfs/dbraw/zinc/40/55/78/1056405578.db2.gz MQVKGSGSYXETLZ-WFASDCNBSA-N -1 1 309.837 4.380 20 0 DIADMM CCc1nc(SCc2ccccc2C(C)C)[n-]c(=O)c1C ZINC001613845135 1056412987 /nfs/dbraw/zinc/41/29/87/1056412987.db2.gz WOCBOWIXSCUDFK-UHFFFAOYSA-N -1 1 302.443 4.469 20 0 DIADMM CC(C)CCOc1ccc(NC(=O)c2ccc([O-])cc2F)cc1 ZINC001544563595 1056458091 /nfs/dbraw/zinc/45/80/91/1056458091.db2.gz JWPWTFNMAAMVFX-UHFFFAOYSA-N -1 1 317.360 4.209 20 0 DIADMM Cc1ccccc1[C@@H]1CCCN1C(=O)c1cc(Cl)ccc1[O-] ZINC001544805497 1056504841 /nfs/dbraw/zinc/50/48/41/1056504841.db2.gz BOWBCPYEUNNCGK-INIZCTEOSA-N -1 1 315.800 4.331 20 0 DIADMM Cc1cc(Nc2cc(F)c([O-])c(Cl)c2)n(-c2ccccc2)n1 ZINC001214477425 1056538329 /nfs/dbraw/zinc/53/83/29/1056538329.db2.gz MVUYYHITWXDNJE-UHFFFAOYSA-N -1 1 317.751 4.422 20 0 DIADMM CC[C@@H]1CCC[C@H](C)N1C(=O)c1ccc(C(F)(F)F)cc1[O-] ZINC001585379839 1056541676 /nfs/dbraw/zinc/54/16/76/1056541676.db2.gz BWKCCDRKQLVUSH-CMPLNLGQSA-N -1 1 315.335 4.204 20 0 DIADMM CCCc1ccc(S(=O)(=O)[N-]c2ccccc2SC)cc1 ZINC000007056664 1056566111 /nfs/dbraw/zinc/56/61/11/1056566111.db2.gz MPFLODRNHBPUQQ-UHFFFAOYSA-N -1 1 321.467 4.162 20 0 DIADMM Cc1ccccc1[C@H](NC(=O)c1ccc(Cl)cc1[O-])C(C)C ZINC001585741710 1056614465 /nfs/dbraw/zinc/61/44/65/1056614465.db2.gz SBLVLTHFQIGOCJ-QGZVFWFLSA-N -1 1 317.816 4.481 20 0 DIADMM Nc1ccc(N(c2cc(F)c([O-])c(Cl)c2)C2CCCC2)nc1 ZINC001214486550 1056642803 /nfs/dbraw/zinc/64/28/03/1056642803.db2.gz MMKGLRGTSLBVIB-UHFFFAOYSA-N -1 1 321.783 4.243 20 0 DIADMM CCOC(=O)c1nc2cc(-c3ccc(C(F)F)cc3)ccc2[n-]1 ZINC001240771254 1056692338 /nfs/dbraw/zinc/69/23/38/1056692338.db2.gz PHNXYJGQDRLCOG-UHFFFAOYSA-N -1 1 316.307 4.344 20 0 DIADMM CCOC(=O)c1nc2ccc(-c3ccc(C(F)F)cc3)cc2[n-]1 ZINC001240771254 1056692342 /nfs/dbraw/zinc/69/23/42/1056692342.db2.gz PHNXYJGQDRLCOG-UHFFFAOYSA-N -1 1 316.307 4.344 20 0 DIADMM CC[C@@H](C)[C@@H]([N-]C(=O)C(F)(F)c1ccccc1C)C(F)(F)F ZINC001586211947 1056693636 /nfs/dbraw/zinc/69/36/36/1056693636.db2.gz HQLJVYZJANWZIX-BXKDBHETSA-N -1 1 323.305 4.180 20 0 DIADMM COc1c(F)cc(F)cc1Nc1cc(F)c([O-])c(Cl)c1 ZINC001214489430 1056694488 /nfs/dbraw/zinc/69/44/88/1056694488.db2.gz DKUSGTUCGJZBHK-UHFFFAOYSA-N -1 1 303.667 4.215 20 0 DIADMM COC(=O)c1nc2cc(-c3ccc(C(F)(F)F)cc3)ccc2[n-]1 ZINC001240820497 1056714592 /nfs/dbraw/zinc/71/45/92/1056714592.db2.gz UWLOCZMOWUKLNO-UHFFFAOYSA-N -1 1 320.270 4.035 20 0 DIADMM COC(=O)c1nc2ccc(-c3ccc(C(F)(F)F)cc3)cc2[n-]1 ZINC001240820497 1056714600 /nfs/dbraw/zinc/71/46/00/1056714600.db2.gz UWLOCZMOWUKLNO-UHFFFAOYSA-N -1 1 320.270 4.035 20 0 DIADMM CCSc1ccc([C@H](C)NC(=O)c2ccc(F)c([O-])c2)cc1 ZINC001616792487 1056718028 /nfs/dbraw/zinc/71/80/28/1056718028.db2.gz AWDXPLIBWQIBKC-NSHDSACASA-N -1 1 319.401 4.134 20 0 DIADMM CCOc1ccc(Nc2cc([O-])c(Cl)cc2F)c(OC)c1 ZINC001213118931 1056820046 /nfs/dbraw/zinc/82/00/46/1056820046.db2.gz DPOMOQAGDVBREL-UHFFFAOYSA-N -1 1 311.740 4.336 20 0 DIADMM [O-]c1ccc(Cl)c(Nc2cc(F)cc(F)c2O)c1Cl ZINC001212487692 1056820430 /nfs/dbraw/zinc/82/04/30/1056820430.db2.gz UMFIDZBAXVFRIB-UHFFFAOYSA-N -1 1 306.095 4.426 20 0 DIADMM Cc1ccc(-c2ccc([C@H](C)[N-]C(=O)C(F)(F)F)cc2)c(O)c1 ZINC001241050546 1056846533 /nfs/dbraw/zinc/84/65/33/1056846533.db2.gz JAIRGGXSUNJGCQ-NSHDSACASA-N -1 1 323.314 4.107 20 0 DIADMM CC(C)(C)Oc1cc(F)ccc1NC(=O)c1ccc([O-])c(F)c1 ZINC000681065619 1056846766 /nfs/dbraw/zinc/84/67/66/1056846766.db2.gz GSRCBNYQVQTEPZ-UHFFFAOYSA-N -1 1 321.323 4.100 20 0 DIADMM CC1(C)CN(C(=O)c2ccc(F)c([O-])c2)c2cccc(Cl)c21 ZINC001587085044 1056857103 /nfs/dbraw/zinc/85/71/03/1056857103.db2.gz AFYJOXPLJQJSCQ-UHFFFAOYSA-N -1 1 319.763 4.123 20 0 DIADMM [O-]c1cc(F)c(-c2ncnc3c2ccn3C2CCCC2)c(F)c1 ZINC001241118588 1056904860 /nfs/dbraw/zinc/90/48/60/1056904860.db2.gz RFCRDYNRPCIDRA-UHFFFAOYSA-N -1 1 315.323 4.197 20 0 DIADMM [O-]c1cc(F)c(-c2ncnc3sc4ccccc4c32)c(F)c1 ZINC001241119415 1056904970 /nfs/dbraw/zinc/90/49/70/1056904970.db2.gz MSEBLMUHQYPDNC-UHFFFAOYSA-N -1 1 314.316 4.495 20 0 DIADMM COc1ccc2nc(C)cc(-c3c(F)cc([O-])cc3F)c2c1 ZINC001241122646 1056906012 /nfs/dbraw/zinc/90/60/12/1056906012.db2.gz JMSYWZHOLYKIOT-UHFFFAOYSA-N -1 1 301.292 4.203 20 0 DIADMM COc1cc(C(F)(F)F)ccc1-c1c(F)cc([O-])cc1F ZINC001241120588 1056906159 /nfs/dbraw/zinc/90/61/59/1056906159.db2.gz BQCSRQBYCNYGNF-UHFFFAOYSA-N -1 1 304.214 4.365 20 0 DIADMM CCc1ccc(-c2ccc(-c3c(F)cc([O-])cc3F)nn2)cc1 ZINC001241119834 1056906496 /nfs/dbraw/zinc/90/64/96/1056906496.db2.gz SMJWTXXHPRFORF-UHFFFAOYSA-N -1 1 312.319 4.357 20 0 DIADMM [O-]c1cc(F)c(-c2ccc(-c3c(F)cccc3F)nn2)c(F)c1 ZINC001241120313 1056907281 /nfs/dbraw/zinc/90/72/81/1056907281.db2.gz ZLEVHCDGOSLDMS-UHFFFAOYSA-N -1 1 320.245 4.073 20 0 DIADMM CC(C)(C)OC(=O)c1ccc(-c2c(F)cc([O-])cc2F)cc1F ZINC001241120574 1056907695 /nfs/dbraw/zinc/90/76/95/1056907695.db2.gz AZBWVPAVPCNIPD-UHFFFAOYSA-N -1 1 324.298 4.432 20 0 DIADMM [O-]c1cc(F)c(-c2cccc3[nH]c(C(F)(F)F)nc32)c(F)c1 ZINC001241125179 1056909943 /nfs/dbraw/zinc/90/99/43/1056909943.db2.gz UCHZCVKLSNRZEG-UHFFFAOYSA-N -1 1 314.213 4.233 20 0 DIADMM Cn1cc(-c2ccnc(-c3cc([O-])cc(F)c3)n2)c2ccccc21 ZINC001241256586 1056983090 /nfs/dbraw/zinc/98/30/90/1056983090.db2.gz YHFMPSGLVKYLGV-UHFFFAOYSA-N -1 1 319.339 4.147 20 0 DIADMM CCc1ccc(-c2ccc(-c3c(F)ccc([O-])c3F)nn2)cc1 ZINC001241289745 1056998981 /nfs/dbraw/zinc/99/89/81/1056998981.db2.gz CPBPNVDBLAUNNZ-UHFFFAOYSA-N -1 1 312.319 4.357 20 0 DIADMM [O-]c1ccc(F)c(-c2ccc(C3(C(F)(F)F)CC3)cn2)c1F ZINC001241290772 1056999861 /nfs/dbraw/zinc/99/98/61/1056999861.db2.gz FXGKKMJFZDXRLR-UHFFFAOYSA-N -1 1 315.241 4.326 20 0 DIADMM CC[C@H](C)c1nc2[nH]ccc2c(-c2c(F)ccc([O-])c2F)n1 ZINC001241291844 1057000168 /nfs/dbraw/zinc/00/01/68/1057000168.db2.gz ZJJRMSHASXVKQH-QMMMGPOBSA-N -1 1 303.312 4.074 20 0 DIADMM Cc1cnc(-c2c(F)ccc([O-])c2F)nc1-c1ccccc1F ZINC001241291568 1057000442 /nfs/dbraw/zinc/00/04/42/1057000442.db2.gz QLZOROJMFLXOIY-UHFFFAOYSA-N -1 1 316.282 4.242 20 0 DIADMM COC(=O)c1nc2cc(C=Cc3ccc(Cl)cc3)ccc2[n-]1 ZINC001241588514 1057101758 /nfs/dbraw/zinc/10/17/58/1057101758.db2.gz XKRUPWCVASBVHA-NSCUHMNNSA-N -1 1 312.756 4.173 20 0 DIADMM COC(=O)c1nc2ccc(C=Cc3ccc(Cl)cc3)cc2[n-]1 ZINC001241588514 1057101759 /nfs/dbraw/zinc/10/17/59/1057101759.db2.gz XKRUPWCVASBVHA-NSCUHMNNSA-N -1 1 312.756 4.173 20 0 DIADMM CC(C)C1=NCCc2ccc(-c3cc(F)cc(C(=O)[O-])c3)cc21 ZINC001241835188 1057183284 /nfs/dbraw/zinc/18/32/84/1057183284.db2.gz DEEIXCBVQMZADS-UHFFFAOYSA-N -1 1 311.356 4.192 20 0 DIADMM O=C(/C=C/c1ccc(Cl)s1)Nc1ccc([O-])c(Cl)c1 ZINC000701148190 1057244932 /nfs/dbraw/zinc/24/49/32/1057244932.db2.gz LSAGJBLOJFAVKV-ZZXKWVIFSA-N -1 1 314.193 4.412 20 0 DIADMM CC(C)(C)OCc1ccc(NC(=O)c2cc(F)ccc2[O-])cc1 ZINC000674606766 1057263007 /nfs/dbraw/zinc/26/30/07/1057263007.db2.gz SOAJHOHQSBRPLM-UHFFFAOYSA-N -1 1 317.360 4.099 20 0 DIADMM [O-]c1ccc(C(F)(F)F)cc1-c1ncnc2cc(F)ccc21 ZINC001242127346 1057271068 /nfs/dbraw/zinc/27/10/68/1057271068.db2.gz XZPMRKTUPMUIDE-UHFFFAOYSA-N -1 1 308.234 4.160 20 0 DIADMM Cc1nc2ccccc2nc1-c1cc(C(F)(F)F)ccc1[O-] ZINC001242126502 1057271277 /nfs/dbraw/zinc/27/12/77/1057271277.db2.gz MQZGAKCMZFITCC-UHFFFAOYSA-N -1 1 304.271 4.330 20 0 DIADMM Nc1cc(-c2cc(C(F)(F)F)ccc2[O-])nc(C(F)(F)F)c1 ZINC001242131422 1057273747 /nfs/dbraw/zinc/27/37/47/1057273747.db2.gz DZZUPMDQDXAXBY-UHFFFAOYSA-N -1 1 322.208 4.074 20 0 DIADMM Nc1cc(C(F)(F)F)cnc1-c1cc(C(F)(F)F)ccc1[O-] ZINC001242131972 1057275086 /nfs/dbraw/zinc/27/50/86/1057275086.db2.gz OIUTWPRCCYUOLN-UHFFFAOYSA-N -1 1 322.208 4.074 20 0 DIADMM [O-]c1ccc(-c2cccc(OC(F)F)n2)cc1C(F)(F)F ZINC001242151874 1057280921 /nfs/dbraw/zinc/28/09/21/1057280921.db2.gz XBYHVZJCZVOVAE-UHFFFAOYSA-N -1 1 305.202 4.074 20 0 DIADMM Cc1csc2cnc(-c3ccc([O-])c(C(F)(F)F)c3)nc12 ZINC001242153087 1057282000 /nfs/dbraw/zinc/28/20/00/1057282000.db2.gz PYSHKMXQMCBGKC-UHFFFAOYSA-N -1 1 310.300 4.391 20 0 DIADMM [O-]c1ccc(-c2cccnc2C(F)(F)F)cc1C(F)(F)F ZINC001242157469 1057283805 /nfs/dbraw/zinc/28/38/05/1057283805.db2.gz GUIHTHJRRNRQJS-UHFFFAOYSA-N -1 1 307.193 4.492 20 0 DIADMM CC[C@@H](C)Oc1nccnc1-c1ccc([O-])c(C(F)(F)F)c1 ZINC001242158290 1057284655 /nfs/dbraw/zinc/28/46/55/1057284655.db2.gz WUBXSVRCOFMDPU-SECBINFHSA-N -1 1 312.291 4.045 20 0 DIADMM Cc1cccc(-c2nccc(-c3c[nH]c4ccccc43)n2)c1[O-] ZINC001242344559 1057340234 /nfs/dbraw/zinc/34/02/34/1057340234.db2.gz YZVPWIFUHVRMDC-UHFFFAOYSA-N -1 1 301.349 4.306 20 0 DIADMM CC(=O)Oc1c[nH]c2ccc(-c3cccc(Cl)c3[O-])cc12 ZINC001242366381 1057347059 /nfs/dbraw/zinc/34/70/59/1057347059.db2.gz LIEGDCQVZJYHLC-UHFFFAOYSA-N -1 1 301.729 4.119 20 0 DIADMM [O-]c1c(Cl)cccc1-c1ccc2nnc(-c3ccccc3)n2c1 ZINC001242365432 1057347196 /nfs/dbraw/zinc/34/71/96/1057347196.db2.gz COSDKSFNGATUFG-UHFFFAOYSA-N -1 1 321.767 4.422 20 0 DIADMM CCOC(=O)c1ccc(-c2cccc(Cl)c2[O-])c(OCC)c1 ZINC001242365013 1057347730 /nfs/dbraw/zinc/34/77/30/1057347730.db2.gz HBVFJHXLMAHGNH-UHFFFAOYSA-N -1 1 320.772 4.288 20 0 DIADMM CCOC(=O)CCc1cccc(-c2cccc(Cl)c2[O-])c1 ZINC001242367720 1057348207 /nfs/dbraw/zinc/34/82/07/1057348207.db2.gz QUIMRVFESFNKAX-UHFFFAOYSA-N -1 1 304.773 4.208 20 0 DIADMM CN1C(=O)CC(C)(C)c2cc(-c3cccc(Cl)c3[O-])ccc21 ZINC001242367532 1057348229 /nfs/dbraw/zinc/34/82/29/1057348229.db2.gz PEAHHWLOFVCXPI-UHFFFAOYSA-N -1 1 315.800 4.357 20 0 DIADMM O=c1cc(-c2cccc(Cl)c2[O-])ccn1-c1ccccc1F ZINC001242366497 1057348410 /nfs/dbraw/zinc/34/84/10/1057348410.db2.gz YPNPOGPWEYOFRI-UHFFFAOYSA-N -1 1 315.731 4.003 20 0 DIADMM [O-]c1c(Cl)cccc1-c1ccnc(OCc2cccnc2)c1 ZINC001242367382 1057348554 /nfs/dbraw/zinc/34/85/54/1057348554.db2.gz JWAPSGIJYIMIRZ-UHFFFAOYSA-N -1 1 312.756 4.082 20 0 DIADMM CC1(C)Cc2ccc(-c3cccc(Cl)c3[O-])cc2NC1=O ZINC001242367272 1057348785 /nfs/dbraw/zinc/34/87/85/1057348785.db2.gz IITJYFXMLZAOON-UHFFFAOYSA-N -1 1 301.773 4.233 20 0 DIADMM O=C(Nc1ccc(F)cc1[O-])c1ccc(OC2CCCC2)cc1 ZINC000676055054 1057444698 /nfs/dbraw/zinc/44/46/98/1057444698.db2.gz CIQYWNGRVZQYKL-UHFFFAOYSA-N -1 1 315.344 4.105 20 0 DIADMM COC(=O)c1ccc2c(ccnc2-c2cccc([O-])c2Cl)c1 ZINC001242798293 1057480000 /nfs/dbraw/zinc/48/00/00/1057480000.db2.gz QGABSMDWSKQPEB-UHFFFAOYSA-N -1 1 313.740 4.047 20 0 DIADMM CC(C)(C)C(=O)Nc1cccc(-c2cccc([O-])c2Cl)n1 ZINC001242797369 1057480218 /nfs/dbraw/zinc/48/02/18/1057480218.db2.gz AOWHWIJTGZMVKH-UHFFFAOYSA-N -1 1 304.777 4.092 20 0 DIADMM COc1cccc(-c2ccnc(-c3cccc([O-])c3Cl)n2)c1 ZINC001242800173 1057480963 /nfs/dbraw/zinc/48/09/63/1057480963.db2.gz DRSBNAACOIJSAP-UHFFFAOYSA-N -1 1 312.756 4.178 20 0 DIADMM [O-]c1cccc(-c2cc(N3CCc4ccccc43)ncn2)c1Cl ZINC001242799936 1057481010 /nfs/dbraw/zinc/48/10/10/1057481010.db2.gz AQQCTJKUDGZUFE-UHFFFAOYSA-N -1 1 323.783 4.197 20 0 DIADMM [O-]c1cccc(-c2ccc(OCc3ccccc3)nn2)c1Cl ZINC001242798737 1057481132 /nfs/dbraw/zinc/48/11/32/1057481132.db2.gz XLSDKYXWXUACCB-UHFFFAOYSA-N -1 1 312.756 4.082 20 0 DIADMM Cc1nc(-c2ccncc2)nc(-c2cccc([O-])c2Cl)c1C ZINC001242801460 1057481719 /nfs/dbraw/zinc/48/17/19/1057481719.db2.gz RBYUUAPQJAXWHV-UHFFFAOYSA-N -1 1 311.772 4.181 20 0 DIADMM COC(=O)c1cnc2cc(-c3cccc([O-])c3Cl)ccc2c1 ZINC001242801140 1057481750 /nfs/dbraw/zinc/48/17/50/1057481750.db2.gz TWOXOTWGTCQOIW-UHFFFAOYSA-N -1 1 313.740 4.047 20 0 DIADMM COC(=O)c1nccc2c1cccc2-c1cccc([O-])c1Cl ZINC001242800217 1057482045 /nfs/dbraw/zinc/48/20/45/1057482045.db2.gz DUKLSEVUJSHBHI-UHFFFAOYSA-N -1 1 313.740 4.047 20 0 DIADMM [O-]c1cccc(-c2ccc(-c3c(F)cccc3F)nn2)c1Cl ZINC001242801762 1057482231 /nfs/dbraw/zinc/48/22/31/1057482231.db2.gz YEZCNYQFLYNSRT-UHFFFAOYSA-N -1 1 318.710 4.448 20 0 DIADMM CCOC(=O)c1cc(F)c(F)cc1-c1cccc([O-])c1Cl ZINC001242802518 1057482961 /nfs/dbraw/zinc/48/29/61/1057482961.db2.gz KDJKNXQBPXPUIN-UHFFFAOYSA-N -1 1 312.699 4.168 20 0 DIADMM [O-]c1cccc(-c2ccc3nnc(-c4ccccc4)n3c2)c1Cl ZINC001242802108 1057483017 /nfs/dbraw/zinc/48/30/17/1057483017.db2.gz RAIGCHNLNLIOMD-UHFFFAOYSA-N -1 1 321.767 4.422 20 0 DIADMM [O-]c1cccc(-c2ccc(N3CCSCC3)cc2)c1Cl ZINC001242803712 1057483131 /nfs/dbraw/zinc/48/31/31/1057483131.db2.gz YJEMSUUWMYRLQV-UHFFFAOYSA-N -1 1 305.830 4.266 20 0 DIADMM Cc1cc(-c2cccc([O-])c2Cl)cnc1OCC(F)(F)F ZINC001242803191 1057483361 /nfs/dbraw/zinc/48/33/61/1057483361.db2.gz OQEFMMCTCOSKFZ-UHFFFAOYSA-N -1 1 317.694 4.357 20 0 DIADMM [O-]c1cc(-c2ncc(F)c(Oc3ccccc3F)n2)ccc1F ZINC001243048029 1057556812 /nfs/dbraw/zinc/55/68/12/1057556812.db2.gz CULDQBHAWXBRCU-UHFFFAOYSA-N -1 1 318.254 4.059 20 0 DIADMM [O-]c1cc(-c2nnc(-c3ccco3)cc2C(F)(F)F)ccc1F ZINC001243050504 1057558998 /nfs/dbraw/zinc/55/89/98/1057558998.db2.gz VIYWEYLVOGMQBG-UHFFFAOYSA-N -1 1 324.233 4.267 20 0 DIADMM CCOC(=O)c1nc2cc(-c3ccc(O)c(C(C)C)c3)ccc2[n-]1 ZINC001243257789 1057622331 /nfs/dbraw/zinc/62/23/31/1057622331.db2.gz JSZYBWUJJGSAKJ-UHFFFAOYSA-N -1 1 324.380 4.236 20 0 DIADMM CCOC(=O)c1nc2ccc(-c3ccc(O)c(C(C)C)c3)cc2[n-]1 ZINC001243257789 1057622332 /nfs/dbraw/zinc/62/23/32/1057622332.db2.gz JSZYBWUJJGSAKJ-UHFFFAOYSA-N -1 1 324.380 4.236 20 0 DIADMM COc1nc(-c2ccc([O-])c(F)c2F)cc2cc(F)ccc21 ZINC001243339700 1057652305 /nfs/dbraw/zinc/65/23/05/1057652305.db2.gz PYVIMUSFHGOCGJ-UHFFFAOYSA-N -1 1 305.255 4.033 20 0 DIADMM [O-]c1ccc(-c2ccc3c(C(F)(F)F)c[nH]c3n2)c(F)c1F ZINC001243341534 1057652837 /nfs/dbraw/zinc/65/28/37/1057652837.db2.gz NPOJLIDSJNELDI-UHFFFAOYSA-N -1 1 314.213 4.233 20 0 DIADMM COC(=O)[C@@H](c1ccc(-c2ccc([O-])c(F)c2F)cc1)C(C)C ZINC001243342285 1057652995 /nfs/dbraw/zinc/65/29/95/1057652995.db2.gz DQHZFIUQXQTFJP-OAHLLOKOSA-N -1 1 320.335 4.250 20 0 DIADMM COc1ccc2c(C)cc(-c3ccc([O-])c(F)c3F)nc2c1 ZINC001243341591 1057653234 /nfs/dbraw/zinc/65/32/34/1057653234.db2.gz OKWXSHJUQQWQNJ-UHFFFAOYSA-N -1 1 301.292 4.203 20 0 DIADMM [O-]c1ccc(-c2ccnc(OCc3ccccc3)c2)c(F)c1F ZINC001243342052 1057653430 /nfs/dbraw/zinc/65/34/30/1057653430.db2.gz HVANLGBKHNPWCW-UHFFFAOYSA-N -1 1 313.303 4.311 20 0 DIADMM [O-]c1ccc(-c2ccc3nc4c(cc3c2)CCCO4)c(F)c1F ZINC001243343375 1057653631 /nfs/dbraw/zinc/65/36/31/1057653631.db2.gz XHUBLTXMVOPURO-UHFFFAOYSA-N -1 1 313.303 4.211 20 0 DIADMM [O-]c1ccc(-c2ccc(O[C@@H]3CCCCO3)cc2F)c(F)c1F ZINC001243343704 1057653920 /nfs/dbraw/zinc/65/39/20/1057653920.db2.gz NQDKQGMNGDLGCH-OAHLLOKOSA-N -1 1 324.298 4.382 20 0 DIADMM COc1cccc(C(F)(F)F)c1-c1ccc([O-])c(F)c1F ZINC001243343518 1057654125 /nfs/dbraw/zinc/65/41/25/1057654125.db2.gz ZKCCOWVOIIFQDE-UHFFFAOYSA-N -1 1 304.214 4.365 20 0 DIADMM [O-]c1c(F)cc(F)cc1-c1ccc(OC(F)(F)F)c(F)c1 ZINC001243503788 1057696732 /nfs/dbraw/zinc/69/67/32/1057696732.db2.gz VMUWZVAQFRFRRI-UHFFFAOYSA-N -1 1 308.177 4.375 20 0 DIADMM COc1ccc(-c2cncc(-c3cc(F)cc(F)c3[O-])c2)cc1 ZINC001243502250 1057696974 /nfs/dbraw/zinc/69/69/74/1057696974.db2.gz IWLKCDDLNLEHSM-UHFFFAOYSA-N -1 1 313.303 4.408 20 0 DIADMM COc1ccc(C(F)(F)F)cc1-c1cc(F)cc(F)c1[O-] ZINC001243503947 1057697199 /nfs/dbraw/zinc/69/71/99/1057697199.db2.gz WGFRZYLDXAYKTR-UHFFFAOYSA-N -1 1 304.214 4.365 20 0 DIADMM COc1ccc(-c2ccncc2)cc1-c1cc(F)cc(F)c1[O-] ZINC001243503273 1057697264 /nfs/dbraw/zinc/69/72/64/1057697264.db2.gz UFUWAHVXACDETC-UHFFFAOYSA-N -1 1 313.303 4.408 20 0 DIADMM CC(C)(C)OC(=O)c1ccc(-c2cc(F)cc(F)c2[O-])cc1F ZINC001243504105 1057697295 /nfs/dbraw/zinc/69/72/95/1057697295.db2.gz JKRYFLOEPPFHBC-UHFFFAOYSA-N -1 1 324.298 4.432 20 0 DIADMM COc1cc2c(cc1C)nccc2-c1cc(F)cc(F)c1[O-] ZINC001243506657 1057697708 /nfs/dbraw/zinc/69/77/08/1057697708.db2.gz HRRLNTKNLGDWAT-UHFFFAOYSA-N -1 1 301.292 4.203 20 0 DIADMM CCOC(=O)[C@H](CC)c1ccc(-c2cc(F)cc(F)c2[O-])cc1 ZINC001243504964 1057697714 /nfs/dbraw/zinc/69/77/14/1057697714.db2.gz CECDPWVUTJCMBG-CQSZACIVSA-N -1 1 320.335 4.394 20 0 DIADMM COc1cc(-c2cc(F)cc(F)c2[O-])ccc1-c1cnc(C)o1 ZINC001243505094 1057697956 /nfs/dbraw/zinc/69/79/56/1057697956.db2.gz CBXLTVGUYVPYJQ-UHFFFAOYSA-N -1 1 317.291 4.309 20 0 DIADMM [O-]c1c(F)cc(F)cc1-c1cccc2[nH]c(C(F)(F)F)nc21 ZINC001243506809 1057698018 /nfs/dbraw/zinc/69/80/18/1057698018.db2.gz LFBGXZWADOFTTC-UHFFFAOYSA-N -1 1 314.213 4.233 20 0 DIADMM COc1ccc(C(F)(F)F)nc1-c1ccc(Cl)c([O-])c1 ZINC001243576870 1057720672 /nfs/dbraw/zinc/72/06/72/1057720672.db2.gz WHIFVIVTSOWIKU-UHFFFAOYSA-N -1 1 303.667 4.135 20 0 DIADMM COC(=O)c1cc(-c2ccc(Cl)c([O-])c2)nc2ccccc21 ZINC001243576242 1057720797 /nfs/dbraw/zinc/72/07/97/1057720797.db2.gz KTGFYNGBCVIMKD-UHFFFAOYSA-N -1 1 313.740 4.047 20 0 DIADMM CSc1nc2ccsc2c(-c2ccc(Cl)c([O-])c2)n1 ZINC001243576667 1057720849 /nfs/dbraw/zinc/72/08/49/1057720849.db2.gz RYSIYVMNWGSVRT-UHFFFAOYSA-N -1 1 308.815 4.439 20 0 DIADMM CC(C)(C)NC(=O)c1ccc(-c2ccc(Cl)c([O-])c2)cc1 ZINC001243578506 1057721509 /nfs/dbraw/zinc/72/15/09/1057721509.db2.gz QMAUEMXVSPNCCK-UHFFFAOYSA-N -1 1 303.789 4.241 20 0 DIADMM CC(C)(C)C(=O)Nc1cccnc1-c1ccc(Cl)c([O-])c1 ZINC001243578115 1057721588 /nfs/dbraw/zinc/72/15/88/1057721588.db2.gz MAMVOVNMGJFLKV-UHFFFAOYSA-N -1 1 304.777 4.092 20 0 DIADMM CCc1cc(-c2ccc(Cl)c([O-])c2)nc(-c2ccccn2)n1 ZINC001243578943 1057722138 /nfs/dbraw/zinc/72/21/38/1057722138.db2.gz MCYMVDFOGFJOCH-UHFFFAOYSA-N -1 1 311.772 4.127 20 0 DIADMM CCc1cc(-c2ccc(Cl)c([O-])c2)nc(-c2ccncc2)n1 ZINC001243579359 1057722203 /nfs/dbraw/zinc/72/22/03/1057722203.db2.gz RFNCYPHFUXJSCO-UHFFFAOYSA-N -1 1 311.772 4.127 20 0 DIADMM [O-]c1cc(-c2cnc(OCc3ccccc3)cn2)ccc1Cl ZINC001243579285 1057722311 /nfs/dbraw/zinc/72/23/11/1057722311.db2.gz SCPNWLXLDYLNSX-UHFFFAOYSA-N -1 1 312.756 4.082 20 0 DIADMM [O-]c1cc(-c2nc(-c3cccnc3)nc3c2CCC3)ccc1Cl ZINC001243579956 1057722520 /nfs/dbraw/zinc/72/25/20/1057722520.db2.gz YHSPPCNPRDDLNM-UHFFFAOYSA-N -1 1 323.783 4.053 20 0 DIADMM CCCSc1ncnc(-c2ccc(Cl)c([O-])c2)c1OC ZINC001243578583 1057722628 /nfs/dbraw/zinc/72/26/28/1057722628.db2.gz IKZSBQUGNKTWJZ-UHFFFAOYSA-N -1 1 310.806 4.013 20 0 DIADMM [O-]c1cc(-c2ccnc(Cc3ccc(F)cc3)n2)ccc1Cl ZINC001243579902 1057722780 /nfs/dbraw/zinc/72/27/80/1057722780.db2.gz XIJSJKRLACXGSC-UHFFFAOYSA-N -1 1 314.747 4.233 20 0 DIADMM [O-]c1cc(-c2ccnc(OCc3ccccn3)c2)ccc1Cl ZINC001243581543 1057723037 /nfs/dbraw/zinc/72/30/37/1057723037.db2.gz HVMVAMMYLCWMIJ-UHFFFAOYSA-N -1 1 312.756 4.082 20 0 DIADMM O=c1ccc(-c2ccc(Cl)c([O-])c2)cn1-c1ccccc1F ZINC001243581966 1057723247 /nfs/dbraw/zinc/72/32/47/1057723247.db2.gz OWFZHJOISCGEBS-UHFFFAOYSA-N -1 1 315.731 4.003 20 0 DIADMM [O-]c1cc(-c2cccc(-c3ncc4ncccn43)c2)ccc1Cl ZINC001243582486 1057723838 /nfs/dbraw/zinc/72/38/38/1057723838.db2.gz UCZCWIIMDKGLJV-UHFFFAOYSA-N -1 1 321.767 4.422 20 0 DIADMM COC(=O)CCCc1ccc(-c2ccc(Cl)c([O-])c2)cc1 ZINC001243583055 1057724200 /nfs/dbraw/zinc/72/42/00/1057724200.db2.gz HNNVODVQXOMVGQ-UHFFFAOYSA-N -1 1 304.773 4.208 20 0 DIADMM Cc1ccc2nc(-c3ccc(C(F)(F)F)cc3[O-])ccc2n1 ZINC001243607056 1057730864 /nfs/dbraw/zinc/73/08/64/1057730864.db2.gz MRSWOEJHZYZBCK-UHFFFAOYSA-N -1 1 304.271 4.330 20 0 DIADMM Cc1nc2cc(F)ccc2c(-c2ccc(C(F)(F)F)cc2[O-])n1 ZINC001243607880 1057731709 /nfs/dbraw/zinc/73/17/09/1057731709.db2.gz DNVVVWXOMRDYHE-UHFFFAOYSA-N -1 1 322.261 4.469 20 0 DIADMM COc1ccc2ncnc(-c3ccc(C(F)(F)F)cc3[O-])c2c1 ZINC001243608030 1057731820 /nfs/dbraw/zinc/73/18/20/1057731820.db2.gz FIEDZPFXYHBMIA-UHFFFAOYSA-N -1 1 320.270 4.030 20 0 DIADMM CC(C)c1nc2[nH]ccc2c(-c2ccc(C(F)(F)F)cc2[O-])n1 ZINC001243610373 1057732408 /nfs/dbraw/zinc/73/24/08/1057732408.db2.gz JTUYECSKLYIJTI-UHFFFAOYSA-N -1 1 321.302 4.424 20 0 DIADMM COc1nnc(-c2ccc(C(F)(F)F)cc2[O-])c2ccccc21 ZINC001243609873 1057732436 /nfs/dbraw/zinc/73/24/36/1057732436.db2.gz FAEAZGFEJWUNEC-UHFFFAOYSA-N -1 1 320.270 4.030 20 0 DIADMM Nc1cc(C(F)(F)F)cnc1-c1ccc(C(F)(F)F)cc1[O-] ZINC001243610326 1057732530 /nfs/dbraw/zinc/73/25/30/1057732530.db2.gz HQJPSNVGQZZWNJ-UHFFFAOYSA-N -1 1 322.208 4.074 20 0 DIADMM [O-]c1cc(C(F)(F)F)ccc1-c1cc(OC(F)(F)F)ccn1 ZINC001243611113 1057732910 /nfs/dbraw/zinc/73/29/10/1057732910.db2.gz ZNFGJJMKDBUSPQ-UHFFFAOYSA-N -1 1 323.192 4.372 20 0 DIADMM [O-]c1c(F)cc(-c2ccc(F)c(OC(F)(F)F)c2)cc1F ZINC001244093262 1057866519 /nfs/dbraw/zinc/86/65/19/1057866519.db2.gz FFTQGRFUHHKRJK-UHFFFAOYSA-N -1 1 308.177 4.375 20 0 DIADMM CCOC(=O)C(C)(C)c1ccc(-c2cc(F)c([O-])c(F)c2)cc1 ZINC001244099144 1057869668 /nfs/dbraw/zinc/86/96/68/1057869668.db2.gz WIIKUUCKIZBAKL-UHFFFAOYSA-N -1 1 320.335 4.178 20 0 DIADMM COC(=O)c1nc2cc(-c3ccc(C4CC4)cc3C)ccc2[n-]1 ZINC001244276214 1057920923 /nfs/dbraw/zinc/92/09/23/1057920923.db2.gz OWYBLCFJMZEDRI-UHFFFAOYSA-N -1 1 306.365 4.202 20 0 DIADMM COC(=O)c1nc2ccc(-c3ccc(C4CC4)cc3C)cc2[n-]1 ZINC001244276214 1057920926 /nfs/dbraw/zinc/92/09/26/1057920926.db2.gz OWYBLCFJMZEDRI-UHFFFAOYSA-N -1 1 306.365 4.202 20 0 DIADMM CC(C)Oc1cccnc1-c1cc(OC(F)(F)F)ccc1[O-] ZINC001244458091 1057963662 /nfs/dbraw/zinc/96/36/62/1057963662.db2.gz AIHYOGPZRMXJBK-UHFFFAOYSA-N -1 1 313.275 4.140 20 0 DIADMM [O-]c1cc(OC(F)(F)F)ccc1-c1cc(-c2ccco2)ncn1 ZINC001244462851 1057965310 /nfs/dbraw/zinc/96/53/10/1057965310.db2.gz NXNZMQOIHKHFIS-UHFFFAOYSA-N -1 1 322.242 4.008 20 0 DIADMM [O-]c1cc(OC(F)(F)F)ccc1-c1ncnc2cc(F)ccc21 ZINC001244463386 1057965581 /nfs/dbraw/zinc/96/55/81/1057965581.db2.gz GKHZRFHPRXLWJC-UHFFFAOYSA-N -1 1 324.233 4.040 20 0 DIADMM CSc1ccnc(-c2ccc(OC(F)(F)F)cc2[O-])c1F ZINC001244464874 1057966143 /nfs/dbraw/zinc/96/61/43/1057966143.db2.gz RKSIRZLVVYJLDI-UHFFFAOYSA-N -1 1 319.279 4.214 20 0 DIADMM CCSc1ccnc(-c2ccc(OC(F)(F)F)cc2[O-])c1 ZINC001244464144 1057966334 /nfs/dbraw/zinc/96/63/34/1057966334.db2.gz IZSKLCPZCSEKRO-UHFFFAOYSA-N -1 1 315.316 4.465 20 0 DIADMM Cc1ccc2ncnc(-c3ccc(OC(F)(F)F)cc3[O-])c2c1 ZINC001244464856 1057966389 /nfs/dbraw/zinc/96/63/89/1057966389.db2.gz VVJSLPXNJJZDDN-UHFFFAOYSA-N -1 1 320.270 4.209 20 0 DIADMM Cc1cc(-c2cc(C(=O)OC(C)(C)C)ccn2)cc(Cl)c1[O-] ZINC001244530003 1057987225 /nfs/dbraw/zinc/98/72/25/1057987225.db2.gz HZZIIRXJCBDBNU-UHFFFAOYSA-N -1 1 319.788 4.371 20 0 DIADMM Cc1cc(-c2ncccc2NC(=O)C(C)(C)C)cc(Cl)c1[O-] ZINC001244537620 1057988818 /nfs/dbraw/zinc/98/88/18/1057988818.db2.gz NVIHDRKTFLCMPS-UHFFFAOYSA-N -1 1 318.804 4.401 20 0 DIADMM Cc1nc2ccc(-c3c(Cl)ccc([O-])c3F)nc2n1C(C)C ZINC001244537633 1057989067 /nfs/dbraw/zinc/98/90/67/1057989067.db2.gz CHXVYWUQOLFLEE-UHFFFAOYSA-N -1 1 319.767 4.486 20 0 DIADMM CC(=O)N1CCCc2ccc(-c3c(Cl)ccc([O-])c3F)cc21 ZINC001244540065 1057990382 /nfs/dbraw/zinc/99/03/82/1057990382.db2.gz ONXARWROSMPDDA-UHFFFAOYSA-N -1 1 319.763 4.151 20 0 DIADMM [O-]c1ccc(Cl)c(-c2nccc(-c3ccc(F)cc3)n2)c1F ZINC001244539311 1057990505 /nfs/dbraw/zinc/99/05/05/1057990505.db2.gz VLLLQQLIGWRLQM-UHFFFAOYSA-N -1 1 318.710 4.448 20 0 DIADMM COc1ccc2cc(-c3c(Cl)ccc([O-])c3F)ccc2n1 ZINC001244539827 1057990913 /nfs/dbraw/zinc/99/09/13/1057990913.db2.gz JRIBDVHTCGKKMJ-UHFFFAOYSA-N -1 1 303.720 4.409 20 0 DIADMM COc1cc(C)c2ncnc(-c3c(Cl)ccc([O-])c3F)c2c1 ZINC001244539914 1057990921 /nfs/dbraw/zinc/99/09/21/1057990921.db2.gz NIYFQYQXHVRLDB-UHFFFAOYSA-N -1 1 318.735 4.112 20 0 DIADMM [O-]c1ccc(Cl)c(-c2ccc(N3CCCCC3)nc2)c1F ZINC001244541372 1057991058 /nfs/dbraw/zinc/99/10/58/1057991058.db2.gz OQJNCBSZEIRWRL-UHFFFAOYSA-N -1 1 306.768 4.237 20 0 DIADMM COc1cc(-c2c(Cl)ccc([O-])c2F)c(NC(C)=O)cc1C ZINC001244541136 1057991454 /nfs/dbraw/zinc/99/14/54/1057991454.db2.gz NLCPGNJPGCJAAW-UHFFFAOYSA-N -1 1 323.751 4.127 20 0 DIADMM [O-]c1ccc(Cl)c(-c2cnc(Oc3ccccc3)nc2)c1F ZINC001244541752 1057991615 /nfs/dbraw/zinc/99/16/15/1057991615.db2.gz SVGIIHPBCOXKPK-UHFFFAOYSA-N -1 1 316.719 4.434 20 0 DIADMM COc1ccc2c(c1)nccc2-c1c(Cl)ccc([O-])c1F ZINC001244541298 1057991637 /nfs/dbraw/zinc/99/16/37/1057991637.db2.gz AWRHDAOTCFWEBZ-UHFFFAOYSA-N -1 1 303.720 4.409 20 0 DIADMM [O-]c1ccc(Cl)c(-c2ccc(-c3csnn3)cc2)c1F ZINC001244543775 1057992081 /nfs/dbraw/zinc/99/20/81/1057992081.db2.gz VRZIQECIBUZBBJ-UHFFFAOYSA-N -1 1 306.749 4.370 20 0 DIADMM COC(=O)c1cc2ccc(-c3c(Cl)ccc([O-])c3F)cc2[nH]1 ZINC001244542521 1057992186 /nfs/dbraw/zinc/99/21/86/1057992186.db2.gz ZIGURTWNVPIWJB-UHFFFAOYSA-N -1 1 319.719 4.120 20 0 DIADMM CC(=O)Oc1c[nH]c2ccc(-c3c(Cl)ccc([O-])c3F)cc12 ZINC001244543206 1057992288 /nfs/dbraw/zinc/99/22/88/1057992288.db2.gz PTDDQFUNSACKNE-UHFFFAOYSA-N -1 1 319.719 4.258 20 0 DIADMM CC(=O)N1CCCc2cc(-c3c(Cl)ccc([O-])c3F)ccc21 ZINC001244543303 1057992419 /nfs/dbraw/zinc/99/24/19/1057992419.db2.gz RNFPTHUIGFPSAD-UHFFFAOYSA-N -1 1 319.763 4.151 20 0 DIADMM COC(=O)/C=C\c1ccc(-c2c(Cl)ccc([O-])c2F)cc1 ZINC001244543218 1057992437 /nfs/dbraw/zinc/99/24/37/1057992437.db2.gz SSHJVGSYRDFGDY-WTKPLQERSA-N -1 1 306.720 4.038 20 0 DIADMM COc1ncc(C(F)(F)F)cc1-c1cc(C)c([O-])c(Cl)c1 ZINC001244550809 1057993703 /nfs/dbraw/zinc/99/37/03/1057993703.db2.gz NJOWYKCCJZSTPN-UHFFFAOYSA-N -1 1 317.694 4.443 20 0 DIADMM Cc1nc2cc(-c3cc(C(=O)[O-])c(Cl)cc3F)ccc2[nH]1 ZINC001244611720 1058009385 /nfs/dbraw/zinc/00/93/85/1058009385.db2.gz CGMUSGANAQLVQH-UHFFFAOYSA-N -1 1 304.708 4.029 20 0 DIADMM Cc1c2[nH]cnc2ccc1-c1cc(C(=O)[O-])c(Cl)cc1F ZINC001244614385 1058010176 /nfs/dbraw/zinc/01/01/76/1058010176.db2.gz UAQVKJZOKRBCQI-UHFFFAOYSA-N -1 1 304.708 4.029 20 0 DIADMM CN(C)Cc1cccc(-c2ccc3[n-]c(=S)sc3c2)c1F ZINC001244865924 1058060748 /nfs/dbraw/zinc/06/07/48/1058060748.db2.gz WQRZHNVIUXVKEF-UHFFFAOYSA-N -1 1 318.442 4.453 20 0 DIADMM CCOc1cc(C)c(C)cc1-c1ccc2[n-]c(C(=O)OC)nc2c1 ZINC001245022292 1058095490 /nfs/dbraw/zinc/09/54/90/1058095490.db2.gz BKQPNUNXFOAIAQ-UHFFFAOYSA-N -1 1 324.380 4.032 20 0 DIADMM CCOc1cc(C)c(C)cc1-c1ccc2nc(C(=O)OC)[n-]c2c1 ZINC001245022292 1058095494 /nfs/dbraw/zinc/09/54/94/1058095494.db2.gz BKQPNUNXFOAIAQ-UHFFFAOYSA-N -1 1 324.380 4.032 20 0 DIADMM COC(=O)c1ccc2cc(-c3cc(Cl)ccc3[O-])ncc2c1 ZINC001245049110 1058102840 /nfs/dbraw/zinc/10/28/40/1058102840.db2.gz QBVCAJUSDSJYNC-UHFFFAOYSA-N -1 1 313.740 4.047 20 0 DIADMM CCOC(=O)c1nc2cc(-c3cc(F)ccc3Cl)ccc2[n-]1 ZINC001245136471 1058119467 /nfs/dbraw/zinc/11/94/67/1058119467.db2.gz HBUKGHOEGDKJRK-UHFFFAOYSA-N -1 1 318.735 4.199 20 0 DIADMM CCOC(=O)c1nc2ccc(-c3cc(F)ccc3Cl)cc2[n-]1 ZINC001245136471 1058119468 /nfs/dbraw/zinc/11/94/68/1058119468.db2.gz HBUKGHOEGDKJRK-UHFFFAOYSA-N -1 1 318.735 4.199 20 0 DIADMM CCCC[C@H](CCC)NC(=O)c1ccc(C(F)(F)F)cc1[O-] ZINC001545231550 1058187424 /nfs/dbraw/zinc/18/74/24/1058187424.db2.gz OKYHGTXDTRXAMK-LBPRGKRZSA-N -1 1 317.351 4.500 20 0 DIADMM CC1(C)C[C@@H](NC(=O)c2cc(Cl)ccc2[O-])c2ccccc21 ZINC001545547370 1058209497 /nfs/dbraw/zinc/20/94/97/1058209497.db2.gz JSZWTKDCODOWHC-OAHLLOKOSA-N -1 1 315.800 4.198 20 0 DIADMM CC(C)C[C@H]1CCCCN1C(=O)Cc1ccc([O-])c(Cl)c1 ZINC001545543213 1058210849 /nfs/dbraw/zinc/21/08/49/1058210849.db2.gz SMXBITHFBLPSLW-CQSZACIVSA-N -1 1 309.837 4.015 20 0 DIADMM O=C(Nc1cc([O-])c(F)cc1F)[C@H]1CC[C@H](c2ccccc2)C1 ZINC001552982779 1058460195 /nfs/dbraw/zinc/46/01/95/1058460195.db2.gz VXIOYSWTKXIRMX-STQMWFEESA-N -1 1 317.335 4.193 20 0 DIADMM [O-]c1ccc(F)c(-c2ccc(OC(F)(F)F)cn2)c1Cl ZINC001245826064 1058520438 /nfs/dbraw/zinc/52/04/38/1058520438.db2.gz AGZUUFMLLITPHH-UHFFFAOYSA-N -1 1 307.630 4.145 20 0 DIADMM [O-]c1ccc(F)c(-c2cc(C(F)(F)F)c(F)cn2)c1Cl ZINC001245828576 1058523873 /nfs/dbraw/zinc/52/38/73/1058523873.db2.gz VQABQADZJLSSER-UHFFFAOYSA-N -1 1 309.621 4.405 20 0 DIADMM Cc1cc(-c2c(F)ccc([O-])c2Cl)nc(-c2ccccn2)n1 ZINC001245829991 1058526293 /nfs/dbraw/zinc/52/62/93/1058526293.db2.gz FSSVNMPCIHEUOK-UHFFFAOYSA-N -1 1 315.735 4.012 20 0 DIADMM [O-]c1ccc(F)c(-c2ccc(COC3CCC3)cn2)c1Cl ZINC001245830673 1058529094 /nfs/dbraw/zinc/52/90/94/1058529094.db2.gz SMAIUNNGDMZYBW-UHFFFAOYSA-N -1 1 307.752 4.316 20 0 DIADMM [O-]c1ccc(F)c(-c2ccc(-c3cccs3)nn2)c1Cl ZINC001245830226 1058529295 /nfs/dbraw/zinc/52/92/95/1058529295.db2.gz JBSOQMKUPWABRC-UHFFFAOYSA-N -1 1 306.749 4.370 20 0 DIADMM [O-]c1ccc(F)c(-c2nccc3c4c([nH]c32)CCC4)c1Cl ZINC001245832525 1058531067 /nfs/dbraw/zinc/53/10/67/1058531067.db2.gz JOJKYBUUIXUJKA-UHFFFAOYSA-N -1 1 302.736 4.217 20 0 DIADMM Cn1cncc1-c1cccc(-c2c(F)ccc([O-])c2Cl)c1 ZINC001245831333 1058532559 /nfs/dbraw/zinc/53/25/59/1058532559.db2.gz JWVIRZWXTYNLQL-UHFFFAOYSA-N -1 1 302.736 4.252 20 0 DIADMM [O-]c1ccc(F)c(-c2ccc(C3OCCO3)c(F)c2)c1Cl ZINC001245831982 1058533115 /nfs/dbraw/zinc/53/31/15/1058533115.db2.gz UCQZWFDSWCBQIN-UHFFFAOYSA-N -1 1 312.699 4.036 20 0 DIADMM [O-]c1ccc(F)c(-c2cncc(OCC3CCCC3)n2)c1Cl ZINC001245832615 1058533480 /nfs/dbraw/zinc/53/34/80/1058533480.db2.gz LVBCNMWLXRTIKX-UHFFFAOYSA-N -1 1 322.767 4.211 20 0 DIADMM CC(C)[S@@](=O)c1ccc(-c2c(F)ccc([O-])c2Cl)cc1 ZINC001245831295 1058534224 /nfs/dbraw/zinc/53/42/24/1058534224.db2.gz ITPCWIBHIBQLSG-HXUWFJFHSA-N -1 1 312.793 4.368 20 0 DIADMM Cc1nc(-c2ccc(-c3c(F)ccc([O-])c3Cl)cc2)no1 ZINC001245832863 1058536981 /nfs/dbraw/zinc/53/69/81/1058536981.db2.gz ONGUGIZMYJNYLG-UHFFFAOYSA-N -1 1 304.708 4.210 20 0 DIADMM CCOC(=O)c1ccc(-c2c(F)ccc([O-])c2Cl)cc1F ZINC001245832972 1058537190 /nfs/dbraw/zinc/53/71/90/1058537190.db2.gz WECQOQIPEFOXAB-UHFFFAOYSA-N -1 1 312.699 4.168 20 0 DIADMM CC(C)c1nc2[nH]ccc2c(-c2c(F)ccc([O-])c2Cl)n1 ZINC001245833382 1058537364 /nfs/dbraw/zinc/53/73/64/1058537364.db2.gz ZGNTXQKGEDURIJ-UHFFFAOYSA-N -1 1 305.740 4.198 20 0 DIADMM C[C@@H](NC(=O)c1c([O-])cccc1Cl)c1ccc2c(c1)CCC2 ZINC001556062975 1058538013 /nfs/dbraw/zinc/53/80/13/1058538013.db2.gz JFNSKGMNGBIBKQ-LLVKDONJSA-N -1 1 315.800 4.025 20 0 DIADMM [O-]c1ccc(F)c(-c2nc(CC3CC3)nc3[nH]ccc32)c1Cl ZINC001245832730 1058538238 /nfs/dbraw/zinc/53/82/38/1058538238.db2.gz OEAUIAWAOMPOKM-UHFFFAOYSA-N -1 1 317.751 4.027 20 0 DIADMM CC1(C)C(=O)Nc2cc(-c3c(F)ccc([O-])c3Cl)ccc21 ZINC001245835604 1058541100 /nfs/dbraw/zinc/54/11/00/1058541100.db2.gz UMRMHGIZZVAJDI-UHFFFAOYSA-N -1 1 305.736 4.081 20 0 DIADMM CCCNc1ccccc1NC(=O)c1cc(SC)ccc1[O-] ZINC001556149278 1058551931 /nfs/dbraw/zinc/55/19/31/1058551931.db2.gz GJMHZPGONPNVSH-UHFFFAOYSA-N -1 1 316.426 4.188 20 0 DIADMM Cc1ccc(NC(=S)Nc2ccc(F)cc2[O-])cc1Cl ZINC001245847584 1058553315 /nfs/dbraw/zinc/55/33/15/1058553315.db2.gz UGTGJIDGAAALSE-UHFFFAOYSA-N -1 1 310.781 4.302 20 0 DIADMM Cn1ccc2cccc(NC(=O)c3cc4ccccc4cc3[O-])c21 ZINC001556214046 1058561686 /nfs/dbraw/zinc/56/16/86/1058561686.db2.gz XYHRJGNMWDRTJB-UHFFFAOYSA-N -1 1 316.360 4.289 20 0 DIADMM CC(C)(C)[C@H]1CCCN(C(=O)c2ccc3ccccc3c2[O-])C1 ZINC001556357196 1058580219 /nfs/dbraw/zinc/58/02/19/1058580219.db2.gz UKJYNVAVJMGFSX-HNNXBMFYSA-N -1 1 311.425 4.444 20 0 DIADMM CC(C)Cc1ccc(C(=O)Nc2cc([O-])c(F)cc2F)s1 ZINC001556920152 1058669389 /nfs/dbraw/zinc/66/93/89/1058669389.db2.gz FHQAQFYMLKRXAW-UHFFFAOYSA-N -1 1 311.353 4.183 20 0 DIADMM O=C(Nc1cc([O-])c(F)cc1F)[C@@H]1C[C@H]1c1cccc(Cl)c1 ZINC001556919440 1058669866 /nfs/dbraw/zinc/66/98/66/1058669866.db2.gz AFRIWFNYPSZCMO-WDEREUQCSA-N -1 1 323.726 4.066 20 0 DIADMM Cc1c(F)c(F)ccc1NC(=O)c1ccc(C(C)C)cc1[O-] ZINC001556996407 1058682291 /nfs/dbraw/zinc/68/22/91/1058682291.db2.gz AAWWKRGNSGAZOE-UHFFFAOYSA-N -1 1 305.324 4.355 20 0 DIADMM CCC[C@H]1CCCC[C@@H]1CNC(=O)c1cc(Cl)ccc1[O-] ZINC001557028107 1058687542 /nfs/dbraw/zinc/68/75/42/1058687542.db2.gz IIEMUMUXKCNJFT-QWHCGFSZSA-N -1 1 309.837 4.382 20 0 DIADMM C[C@@H](C(=O)Nc1cc(F)cc(F)c1[O-])c1cccc(Cl)c1 ZINC001557086115 1058698355 /nfs/dbraw/zinc/69/83/55/1058698355.db2.gz HYXPYKRQUKILPP-MRVPVSSYSA-N -1 1 311.715 4.066 20 0 DIADMM CC[C@H](Sc1ccccc1)C(=O)Nc1c([O-])cccc1F ZINC001557408040 1058746059 /nfs/dbraw/zinc/74/60/59/1058746059.db2.gz KYIDJILLJIPRNC-AWEZNQCLSA-N -1 1 305.374 4.041 20 0 DIADMM CC(C)Nc1ccc(Cl)cc1NC(=O)c1cc(F)ccc1[O-] ZINC001557448960 1058750884 /nfs/dbraw/zinc/75/08/84/1058750884.db2.gz WTXCVSWRIJNZNQ-UHFFFAOYSA-N -1 1 322.767 4.257 20 0 DIADMM CSc1c(F)cccc1[N-]C(=O)c1nc2ccccc2s1 ZINC001557460540 1058751399 /nfs/dbraw/zinc/75/13/99/1058751399.db2.gz MCDUTUZSDGVHFG-UHFFFAOYSA-N -1 1 318.398 4.410 20 0 DIADMM CCc1nc(C(=O)Nc2cc(Cl)c([O-])c3ccccc23)co1 ZINC001557586553 1058772883 /nfs/dbraw/zinc/77/28/83/1058772883.db2.gz PGBBFOMZSFWAAD-UHFFFAOYSA-N -1 1 316.744 4.002 20 0 DIADMM O=C(Nc1cccc(NC2CCCC2)c1)c1cc(F)ccc1[O-] ZINC001557699250 1058784911 /nfs/dbraw/zinc/78/49/11/1058784911.db2.gz ISXAFVLYRZCPBL-UHFFFAOYSA-N -1 1 314.360 4.138 20 0 DIADMM O=C(N[C@@H]1CCc2ccc(Cl)cc21)c1cc(Cl)ccc1[O-] ZINC001557770560 1058792338 /nfs/dbraw/zinc/79/23/38/1058792338.db2.gz MVBTUUBTQBNLQS-CQSZACIVSA-N -1 1 322.191 4.116 20 0 DIADMM O=C(N[C@@H]1CCc2cc(Cl)ccc21)c1ccc(Cl)cc1[O-] ZINC001557923094 1058812070 /nfs/dbraw/zinc/81/20/70/1058812070.db2.gz LWPWMCNHUDIYGY-CQSZACIVSA-N -1 1 322.191 4.116 20 0 DIADMM O=C(Nc1cccc(F)c1[O-])c1cc(F)c(Cl)cc1Cl ZINC001557956437 1058819524 /nfs/dbraw/zinc/81/95/24/1058819524.db2.gz KUWYXCCKRLICNP-UHFFFAOYSA-N -1 1 318.106 4.230 20 0 DIADMM C[C@@H]1CCN(C(=O)c2cc(Cl)ccc2[O-])[C@@H]1c1ccccc1 ZINC001558302914 1058857795 /nfs/dbraw/zinc/85/77/95/1058857795.db2.gz FAGQFDUAZWCWKD-PXAZEXFGSA-N -1 1 315.800 4.269 20 0 DIADMM CC(C)(Cc1ccccc1)C(=O)Nc1cc(F)c([O-])cc1Cl ZINC001558644218 1058894639 /nfs/dbraw/zinc/89/46/39/1058894639.db2.gz AEDPLYGHFBWHHJ-UHFFFAOYSA-N -1 1 321.779 4.392 20 0 DIADMM [O-]c1ccc(CNc2ncnc3cc(Cl)ccc32)cc1Cl ZINC001559272298 1059135624 /nfs/dbraw/zinc/13/56/24/1059135624.db2.gz RGWLKHMMGJANDI-UHFFFAOYSA-N -1 1 320.179 4.254 20 0 DIADMM CCc1ccc(NC(=S)Nc2cc(F)c([O-])c(F)c2)cc1 ZINC001247338575 1059385662 /nfs/dbraw/zinc/38/56/62/1059385662.db2.gz CMTFUJRTNWWJDK-UHFFFAOYSA-N -1 1 308.353 4.042 20 0 DIADMM CC[C@H](C)[C@H]([N-]C(=O)C(F)(F)c1ccc(C)cc1)C(F)(F)F ZINC001524463311 1059527249 /nfs/dbraw/zinc/52/72/49/1059527249.db2.gz FEUALILSRPKDGF-JQWIXIFHSA-N -1 1 323.305 4.180 20 0 DIADMM Cc1cc(F)ccc1-c1noc(Cc2ccc([O-])c(Cl)c2)n1 ZINC001247587432 1059564740 /nfs/dbraw/zinc/56/47/40/1059564740.db2.gz FQPDOFACIIFMNJ-UHFFFAOYSA-N -1 1 318.735 4.134 20 0 DIADMM CC(C)(C)CNC(=S)Nc1cc(Cl)c(Cl)cc1[O-] ZINC001247979687 1059667305 /nfs/dbraw/zinc/66/73/05/1059667305.db2.gz SLCJUTFAINFSFP-UHFFFAOYSA-N -1 1 307.246 4.032 20 0 DIADMM CCC[C@@H](C)[C@H]1CCCN1C(=O)NCc1ccc([O-])c(Cl)c1 ZINC001248411181 1059819888 /nfs/dbraw/zinc/81/98/88/1059819888.db2.gz MUMPWEULMCHCTN-IUODEOHRSA-N -1 1 324.852 4.156 20 0 DIADMM C[C@@H](NC(=S)Nc1cccc([O-])c1Cl)c1ccc(F)cc1 ZINC001249607138 1060313887 /nfs/dbraw/zinc/31/38/87/1060313887.db2.gz NEYHQEMJLWKYGK-SECBINFHSA-N -1 1 324.808 4.232 20 0 DIADMM Cc1c(N)c(F)ccc1Nc1c(Cl)ccc([O-])c1Cl ZINC001249643470 1060327804 /nfs/dbraw/zinc/32/78/04/1060327804.db2.gz MBTSIBDKXCBDMK-UHFFFAOYSA-N -1 1 301.148 4.472 20 0 DIADMM CC(C)COc1ncc([N-]c2nnc(C(C)C)o2)cc1Cl ZINC001249778927 1060394504 /nfs/dbraw/zinc/39/45/04/1060394504.db2.gz OZLNXXNIOOHSAU-UHFFFAOYSA-N -1 1 310.785 4.020 20 0 DIADMM CC(C)Oc1cc(F)c(Nc2ccc(F)c(F)c2[O-])c(F)c1 ZINC001249778416 1060396781 /nfs/dbraw/zinc/39/67/81/1060396781.db2.gz ILENSEZPCPMDSB-UHFFFAOYSA-N -1 1 315.266 4.479 20 0 DIADMM CC(C)Oc1cc(F)c(Nc2cc([O-])c(F)c(F)c2)c(F)c1 ZINC001249779290 1060399033 /nfs/dbraw/zinc/39/90/33/1060399033.db2.gz XBKWRRSUDZQZMM-UHFFFAOYSA-N -1 1 315.266 4.479 20 0 DIADMM O=C1CCCCc2ccc(Nc3cc(F)c([O-])c(F)c3)cc21 ZINC001249893847 1060455875 /nfs/dbraw/zinc/45/58/75/1060455875.db2.gz UXPVYWDEGZYYRZ-UHFFFAOYSA-N -1 1 303.308 4.323 20 0 DIADMM O=C1CCCCc2ccc(Nc3c(F)cc([O-])cc3F)cc21 ZINC001249895935 1060461201 /nfs/dbraw/zinc/46/12/01/1060461201.db2.gz YTJFWANKULZAMN-UHFFFAOYSA-N -1 1 303.308 4.323 20 0 DIADMM [O-]c1cc(Nc2cc(Cl)cnc2Cl)c(F)c(F)c1F ZINC001249958200 1060503504 /nfs/dbraw/zinc/50/35/04/1060503504.db2.gz KPQAMZPNCCBLGW-UHFFFAOYSA-N -1 1 309.074 4.255 20 0 DIADMM CN1Cc2c(cccc2Nc2cc(Cl)c([O-])cc2Cl)C1=O ZINC001249940972 1060495548 /nfs/dbraw/zinc/49/55/48/1060495548.db2.gz DSFANXRBMNISDK-UHFFFAOYSA-N -1 1 323.179 4.028 20 0 DIADMM [O-]c1cc(Nc2ccc(-c3ccccn3)nc2)c(F)c(F)c1F ZINC001249961173 1060505465 /nfs/dbraw/zinc/50/54/65/1060505465.db2.gz JNQVOEUPHZANED-UHFFFAOYSA-N -1 1 317.270 4.010 20 0 DIADMM [O-]c1cc(Nc2cc(Cl)ncc2Cl)c(F)c(F)c1F ZINC001249961000 1060505939 /nfs/dbraw/zinc/50/59/39/1060505939.db2.gz ZSJBPOOEXUZVMZ-UHFFFAOYSA-N -1 1 309.074 4.255 20 0 DIADMM Cc1ccc(-n2nccc2Nc2cc([O-])c(F)c(F)c2F)cc1 ZINC001249960394 1060506391 /nfs/dbraw/zinc/50/63/91/1060506391.db2.gz FRQKJUWJQDTDOS-UHFFFAOYSA-N -1 1 319.286 4.047 20 0 DIADMM COc1cccc(Nc2cc([O-])c(F)c(F)c2F)c1Cl ZINC001249963376 1060508604 /nfs/dbraw/zinc/50/86/04/1060508604.db2.gz OWDPDAFVWSVHIG-UHFFFAOYSA-N -1 1 303.667 4.215 20 0 DIADMM [O-]c1cc(Nc2ccc(-n3cccc3)cc2)c(F)c(F)c1F ZINC001249962782 1060508776 /nfs/dbraw/zinc/50/87/76/1060508776.db2.gz NVWBNQBEDZTAAC-UHFFFAOYSA-N -1 1 304.271 4.344 20 0 DIADMM Nc1ccc(Nc2cc([O-])c(F)c(F)c2F)c(C(F)(F)F)c1 ZINC001249963017 1060509258 /nfs/dbraw/zinc/50/92/58/1060509258.db2.gz PORSGLKKQMHRDG-UHFFFAOYSA-N -1 1 322.208 4.154 20 0 DIADMM [O-]c1cc(F)c(Nc2cnccc2C(F)(F)F)cc1Cl ZINC001250020309 1060542959 /nfs/dbraw/zinc/54/29/59/1060542959.db2.gz JUUBKKNGCXXVDN-UHFFFAOYSA-N -1 1 306.646 4.342 20 0 DIADMM [O-]c1cc(F)c(Nc2ccc(C(F)(F)F)cn2)cc1Cl ZINC001250018676 1060543242 /nfs/dbraw/zinc/54/32/42/1060543242.db2.gz SUEYYRMAZCXKDR-UHFFFAOYSA-N -1 1 306.646 4.342 20 0 DIADMM [O-]c1cc(F)c(Nc2c(F)c(F)cc(F)c2F)cc1Cl ZINC001250022361 1060546831 /nfs/dbraw/zinc/54/68/31/1060546831.db2.gz KOSATCCNATWEIH-UHFFFAOYSA-N -1 1 309.621 4.485 20 0 DIADMM CC(C)OC(=O)c1ccc(Nc2cc(Cl)c([O-])cc2F)cc1 ZINC001250022046 1060548671 /nfs/dbraw/zinc/54/86/71/1060548671.db2.gz FHGBGXYZWTVISS-UHFFFAOYSA-N -1 1 323.751 4.494 20 0 DIADMM COc1ccc2cccnc2c1Nc1cc(Cl)c([O-])cc1F ZINC001250026183 1060550047 /nfs/dbraw/zinc/55/00/47/1060550047.db2.gz NZNKWEUFSYWTGB-UHFFFAOYSA-N -1 1 318.735 4.485 20 0 DIADMM O=c1ccc2cccc(Nc3cc(Cl)c([O-])cc3F)c2[nH]1 ZINC001250025614 1060550326 /nfs/dbraw/zinc/55/03/26/1060550326.db2.gz HQCPZQVJNWMSTC-UHFFFAOYSA-N -1 1 304.708 4.182 20 0 DIADMM COC(=O)[C@H](C)c1ccc(Nc2cc(Cl)c([O-])cc2F)cc1 ZINC001250025213 1060550443 /nfs/dbraw/zinc/55/04/43/1060550443.db2.gz DRBRYHFISLMURL-SECBINFHSA-N -1 1 323.751 4.205 20 0 DIADMM Cc1noc(-c2ccc(Nc3cc(Cl)c([O-])cc3F)cc2)n1 ZINC001250025602 1060551978 /nfs/dbraw/zinc/55/19/78/1060551978.db2.gz DQSRBRUFXXXHFE-UHFFFAOYSA-N -1 1 319.723 4.287 20 0 DIADMM CCn1ncc2cc(Nc3cc(Cl)c([O-])cc3F)ccc21 ZINC001250025760 1060552050 /nfs/dbraw/zinc/55/20/50/1060552050.db2.gz JMRMFVPFAOZTLT-UHFFFAOYSA-N -1 1 305.740 4.298 20 0 DIADMM CC1(C)C(=O)Nc2cc(Nc3cc(Cl)c([O-])cc3F)ccc21 ZINC001250026390 1060555062 /nfs/dbraw/zinc/55/50/62/1060555062.db2.gz LRKGIUXUTCKAQD-UHFFFAOYSA-N -1 1 320.751 4.158 20 0 DIADMM [O-]c1cc(F)c(Nc2cc(CO)ccc2Cl)cc1Cl ZINC001250026902 1060555644 /nfs/dbraw/zinc/55/56/44/1060555644.db2.gz RGJWWPWROMWGHN-UHFFFAOYSA-N -1 1 302.132 4.074 20 0 DIADMM CCOc1c(F)cc(Nc2ccnc(Cl)c2[O-])cc1Cl ZINC001250221691 1060700574 /nfs/dbraw/zinc/70/05/74/1060700574.db2.gz PEAKCUUDUFZNHM-UHFFFAOYSA-N -1 1 317.147 4.375 20 0 DIADMM CNc1ccnc(Cl)c1Nc1c(F)ccc([O-])c1Cl ZINC001250228649 1060707447 /nfs/dbraw/zinc/70/74/47/1060707447.db2.gz IRQWMSMZHZJJDI-UHFFFAOYSA-N -1 1 302.136 4.018 20 0 DIADMM Cc1noc(-c2ccc(Nc3c(F)ccc([O-])c3Cl)cc2)n1 ZINC001250232510 1060710368 /nfs/dbraw/zinc/71/03/68/1060710368.db2.gz OXEGWYOJXOJRCE-UHFFFAOYSA-N -1 1 319.723 4.287 20 0 DIADMM Cc1nn(C)c2cc(Nc3c(F)ccc([O-])c3Cl)ccc12 ZINC001250232492 1060710500 /nfs/dbraw/zinc/71/05/00/1060710500.db2.gz OAIGLOKDQYCXOA-UHFFFAOYSA-N -1 1 305.740 4.123 20 0 DIADMM [O-]c1ccc(F)c(Nc2ncccc2OC(F)(F)F)c1Cl ZINC001250230353 1060711406 /nfs/dbraw/zinc/71/14/06/1060711406.db2.gz VRUHLEUMXBPNEX-UHFFFAOYSA-N -1 1 322.645 4.222 20 0 DIADMM O=C1CCCc2ccc(Nc3c(F)ccc([O-])c3Cl)cc21 ZINC001250233130 1060713709 /nfs/dbraw/zinc/71/37/09/1060713709.db2.gz JADJRFOVFBRSGB-UHFFFAOYSA-N -1 1 305.736 4.447 20 0 DIADMM CC(C)c1nnc2ccc(Nc3c(F)ccc([O-])c3Cl)cn21 ZINC001250234105 1060713860 /nfs/dbraw/zinc/71/38/60/1060713860.db2.gz LARJBEVYJSPPLB-UHFFFAOYSA-N -1 1 320.755 4.094 20 0 DIADMM [O-]c1ccc(F)c(Nc2ccnc(OC(F)(F)F)c2)c1Cl ZINC001250234614 1060714548 /nfs/dbraw/zinc/71/45/48/1060714548.db2.gz TUTKUBUZJMHGEJ-UHFFFAOYSA-N -1 1 322.645 4.222 20 0 DIADMM CC(C)(C)[C@H](C(=O)[O-])c1ccc(Nc2ccc3cncn3c2)cc1 ZINC001250331749 1060784213 /nfs/dbraw/zinc/78/42/13/1060784213.db2.gz BREGNCBGDKHMFJ-KRWDZBQOSA-N -1 1 323.396 4.292 20 0 DIADMM Cc1cc2[nH]c(-c3cccc(F)c3[O-])nc2cc1C(F)(F)F ZINC001250684020 1061014270 /nfs/dbraw/zinc/01/42/70/1061014270.db2.gz WMGPCBNNHQQELV-UHFFFAOYSA-N -1 1 310.250 4.402 20 0 DIADMM [O-]c1c(F)cccc1-c1nc2c(cc(F)cc2C(F)(F)F)[nH]1 ZINC001250683528 1061014913 /nfs/dbraw/zinc/01/49/13/1061014913.db2.gz JZALXDZRASITFF-UHFFFAOYSA-N -1 1 314.213 4.233 20 0 DIADMM CCCn1c(-c2cccc(F)c2[O-])nc2ccc(F)c(F)c21 ZINC001250683368 1061016938 /nfs/dbraw/zinc/01/69/38/1061016938.db2.gz CNZUXIONLKDKCF-UHFFFAOYSA-N -1 1 306.287 4.236 20 0 DIADMM CCCCc1ccc2nc(-c3[nH]c(C)c(C(=O)[O-])c3C)[nH]c2c1 ZINC001250876813 1061104380 /nfs/dbraw/zinc/10/43/80/1061104380.db2.gz OXNBTHHTQPFTQJ-UHFFFAOYSA-N -1 1 311.385 4.216 20 0 DIADMM Cc1[nH]c(-c2nc3ccc(C(C)(C)C)cc3[nH]2)c(C)c1C(=O)[O-] ZINC001250877199 1061104617 /nfs/dbraw/zinc/10/46/17/1061104617.db2.gz RZUDWIXKFZBBLF-UHFFFAOYSA-N -1 1 311.385 4.171 20 0 DIADMM Cc1cc2[nH]c(-c3cccc([O-])c3Br)nc2cc1F ZINC001250880967 1061106726 /nfs/dbraw/zinc/10/67/26/1061106726.db2.gz OIGJEWUDEZVSAD-UHFFFAOYSA-N -1 1 321.149 4.146 20 0 DIADMM CCOc1ccc2nc(-c3ccc([O-])c(F)c3F)n(CC)c2c1 ZINC001250914949 1061124987 /nfs/dbraw/zinc/12/49/87/1061124987.db2.gz LTSUCVIZOSSLDW-UHFFFAOYSA-N -1 1 318.323 4.106 20 0 DIADMM O=C([O-])c1cc(Cl)ccc1-c1nc2ccc3ncccc3c2[nH]1 ZINC001250969153 1061152436 /nfs/dbraw/zinc/15/24/36/1061152436.db2.gz ZWOUNFRTNXNZDZ-UHFFFAOYSA-N -1 1 323.739 4.130 20 0 DIADMM CC(C)Cn1c2ccccc2nc1-c1cc(F)c(F)cc1[O-] ZINC001250967358 1061152707 /nfs/dbraw/zinc/15/27/07/1061152707.db2.gz NPMKHJVUSNHBGK-UHFFFAOYSA-N -1 1 302.324 4.343 20 0 DIADMM O=C([O-])c1ccsc1-c1nc2cc(Cl)cc(Cl)c2[nH]1 ZINC001251010523 1061180394 /nfs/dbraw/zinc/18/03/94/1061180394.db2.gz CBCQSWVPHFIHBS-UHFFFAOYSA-N -1 1 313.165 4.296 20 0 DIADMM O=C([O-])c1ccc(-c2nc3ccc(C(F)(F)F)cc3[nH]2)s1 ZINC001251015161 1061182758 /nfs/dbraw/zinc/18/27/58/1061182758.db2.gz PHSFIPZTGMXIIY-UHFFFAOYSA-N -1 1 312.272 4.008 20 0 DIADMM Cn1c2ccc(F)cc2nc1-c1ccc([O-])c(C(F)(F)F)c1 ZINC001251019696 1061185335 /nfs/dbraw/zinc/18/53/35/1061185335.db2.gz CEIZHRXNGYWLOP-UHFFFAOYSA-N -1 1 310.250 4.104 20 0 DIADMM CCn1c(-c2ccc(Cl)c([O-])c2)nc2ccc(F)c(F)c21 ZINC001251037354 1061194765 /nfs/dbraw/zinc/19/47/65/1061194765.db2.gz QVNQALGJROIJFQ-UHFFFAOYSA-N -1 1 308.715 4.360 20 0 DIADMM C/C(=C\c1ccc(C)cc1)C(=O)NCc1ccc([O-])c(Cl)c1 ZINC001455450164 1061222157 /nfs/dbraw/zinc/22/21/57/1061222157.db2.gz MZYRHGYHZYSWAS-UKTHLTGXSA-N -1 1 315.800 4.074 20 0 DIADMM CC(C)Cn1c2ccccc2nc1-c1cc(Cl)c([O-])cc1O ZINC001251082524 1061225673 /nfs/dbraw/zinc/22/56/73/1061225673.db2.gz JGNPZMSXKLLFHG-UHFFFAOYSA-N -1 1 316.788 4.424 20 0 DIADMM Cc1ccc(Cl)c2nc(-c3cc(Cl)c([O-])cc3O)[nH]c21 ZINC001251083878 1061229121 /nfs/dbraw/zinc/22/91/21/1061229121.db2.gz XYMSPFSOCNOOPB-UHFFFAOYSA-N -1 1 309.152 4.256 20 0 DIADMM [O-]c1cc(O)c(-c2nc3ccc(F)cc3n2C2CC2)cc1Cl ZINC001251083054 1061230299 /nfs/dbraw/zinc/23/02/99/1061230299.db2.gz NJIFXXOMQWXFRR-UHFFFAOYSA-N -1 1 318.735 4.242 20 0 DIADMM CCn1c2ccc3ncccc3c2nc1-c1cc(Cl)ncc1[O-] ZINC001251251418 1061290445 /nfs/dbraw/zinc/29/04/45/1061290445.db2.gz DIWVBBDNPQJLAK-UHFFFAOYSA-N -1 1 324.771 4.025 20 0 DIADMM [O-]c1ccc(F)c(F)c1-c1nc2ccccc2n1CC1CC1 ZINC001251322400 1061312342 /nfs/dbraw/zinc/31/23/42/1061312342.db2.gz SEOLSGYJONPIOH-UHFFFAOYSA-N -1 1 300.308 4.097 20 0 DIADMM [O-]c1ccc(F)c(F)c1-c1nc2c(cc(F)c(Cl)c2F)[nH]1 ZINC001251322586 1061312717 /nfs/dbraw/zinc/31/27/17/1061312717.db2.gz YWSBYBHTPMYAOZ-UHFFFAOYSA-N -1 1 316.641 4.145 20 0 DIADMM CC(C)Cn1c2ccccc2nc1-c1c(F)ccc([O-])c1F ZINC001251335779 1061322152 /nfs/dbraw/zinc/32/21/52/1061322152.db2.gz PQWQXLITYLFKOQ-UHFFFAOYSA-N -1 1 302.324 4.343 20 0 DIADMM Cc1cccc(C)c1CN(C)C(=O)c1ccc2ccccc2c1[O-] ZINC001456472695 1061322147 /nfs/dbraw/zinc/32/21/47/1061322147.db2.gz BGIBENMEGTYCLR-UHFFFAOYSA-N -1 1 319.404 4.434 20 0 DIADMM Cc1cccc2nc(-c3c(F)ccc([O-])c3F)n(C3CC3)c21 ZINC001251335776 1061322648 /nfs/dbraw/zinc/32/26/48/1061322648.db2.gz PNBJQNYRONFETF-UHFFFAOYSA-N -1 1 300.308 4.330 20 0 DIADMM Cc1ccc(F)c2nc(-c3cccc(C(F)(F)F)c3[O-])[nH]c21 ZINC001251341144 1061326024 /nfs/dbraw/zinc/32/60/24/1061326024.db2.gz NRJDFTPQZPRICU-UHFFFAOYSA-N -1 1 310.250 4.402 20 0 DIADMM CCCCCC[C@@H](C)[N-]S(=O)(=O)c1cc2ccccc2o1 ZINC001462783776 1061356735 /nfs/dbraw/zinc/35/67/35/1061356735.db2.gz VLACICVBMQIKCZ-CYBMUJFWSA-N -1 1 309.431 4.070 20 0 DIADMM Cc1ccc2[nH]c(-c3cc(C)cc(Br)c3[O-])nc2c1 ZINC001251470218 1061370347 /nfs/dbraw/zinc/37/03/47/1061370347.db2.gz MNYRBTXQAHKANM-UHFFFAOYSA-N -1 1 317.186 4.315 20 0 DIADMM Cc1ccc2nc(-c3cc(C)cc(Br)c3[O-])[nH]c2c1 ZINC001251470218 1061370362 /nfs/dbraw/zinc/37/03/62/1061370362.db2.gz MNYRBTXQAHKANM-UHFFFAOYSA-N -1 1 317.186 4.315 20 0 DIADMM Cc1cc(F)cc2nc(-c3ccc(Br)c([O-])c3)[nH]c21 ZINC001251473511 1061371646 /nfs/dbraw/zinc/37/16/46/1061371646.db2.gz GBZSCPKQSATDJN-UHFFFAOYSA-N -1 1 321.149 4.146 20 0 DIADMM CCn1c2ccc3ncccc3c2nc1-c1ccc(F)c([O-])c1 ZINC001251477494 1061372539 /nfs/dbraw/zinc/37/25/39/1061372539.db2.gz NSDGPAXQAWSNBR-UHFFFAOYSA-N -1 1 307.328 4.116 20 0 DIADMM CCOc1ccc2[nH]c(-c3c([O-])ccc(F)c3Cl)nc2c1 ZINC001251540922 1061396596 /nfs/dbraw/zinc/39/65/96/1061396596.db2.gz ZWNMZDZSBLWNJE-UHFFFAOYSA-N -1 1 306.724 4.127 20 0 DIADMM CCn1c2cc(F)ccc2nc1-c1c([O-])ccc(F)c1Cl ZINC001251540656 1061397072 /nfs/dbraw/zinc/39/70/72/1061397072.db2.gz KWVASSJFLHSGKP-UHFFFAOYSA-N -1 1 308.715 4.360 20 0 DIADMM CC[C@H]1c2ccccc2CN1C(=O)c1ncc2ccccc2c1[O-] ZINC001457010076 1061399124 /nfs/dbraw/zinc/39/91/24/1061399124.db2.gz RDCRIFMKQRTTDS-KRWDZBQOSA-N -1 1 318.376 4.048 20 0 DIADMM O=c1[nH]c2ccccc2c(Cl)c1-c1nc2cc(F)ccc2[n-]1 ZINC001251610307 1061417535 /nfs/dbraw/zinc/41/75/35/1061417535.db2.gz UHVWEBLQEXTCRS-UHFFFAOYSA-N -1 1 313.719 4.276 20 0 DIADMM O=C(c1cc(F)ccc1[O-])N1CCCCC12CCCCCC2 ZINC001457223518 1061425337 /nfs/dbraw/zinc/42/53/37/1061425337.db2.gz QLFZPCKVACDPSF-UHFFFAOYSA-N -1 1 305.393 4.250 20 0 DIADMM COc1cc2nc(-c3cc(F)c(Cl)cc3[O-])[nH]c2cc1C ZINC001251681369 1061443044 /nfs/dbraw/zinc/44/30/44/1061443044.db2.gz WTFXLPULKYQXKI-UHFFFAOYSA-N -1 1 306.724 4.045 20 0 DIADMM Cc1cc2cc([N-]S(=O)(=O)c3ccc(Cl)cc3)ccc2o1 ZINC001251738923 1061466714 /nfs/dbraw/zinc/46/67/14/1061466714.db2.gz ZFXPIFYFTUVPFG-UHFFFAOYSA-N -1 1 321.785 4.195 20 0 DIADMM CCCN(C(=O)c1ccc([O-])cc1F)[C@H]1CCc2ccccc21 ZINC001464519494 1061602321 /nfs/dbraw/zinc/60/23/21/1061602321.db2.gz ILIVIDAWZAKXCX-SFHVURJKSA-N -1 1 313.372 4.071 20 0 DIADMM O=C(c1ccc(F)c([O-])c1)N1CCC[C@@H]1CC1CCCCC1 ZINC001464557203 1061604817 /nfs/dbraw/zinc/60/48/17/1061604817.db2.gz FRQNEILVFRITLP-OAHLLOKOSA-N -1 1 305.393 4.106 20 0 DIADMM Cc1ccc2ccc(-c3nnc(-c4ccc(F)cc4)o3)c([O-])c2n1 ZINC001252186961 1061605195 /nfs/dbraw/zinc/60/51/95/1061605195.db2.gz LOAGPWPMQHQLOR-UHFFFAOYSA-N -1 1 321.311 4.105 20 0 DIADMM CC(C)[C@H]1CC[C@@H](C)C[C@H]1CNC(=O)c1ccc(Cl)cc1[O-] ZINC001464598244 1061611853 /nfs/dbraw/zinc/61/18/53/1061611853.db2.gz ROIXQXCCWNZMKO-VNHYZAJKSA-N -1 1 323.864 4.484 20 0 DIADMM CN(C(=O)c1ncc2ccccc2c1[O-])C1CCCCCCC1 ZINC001464751851 1061629164 /nfs/dbraw/zinc/62/91/64/1061629164.db2.gz LEUPNGRBBRXDDF-UHFFFAOYSA-N -1 1 312.413 4.125 20 0 DIADMM CCc1ccc(C(=O)Nc2scnc2-c2ccccc2)c([O-])c1 ZINC001464830811 1061640775 /nfs/dbraw/zinc/64/07/75/1061640775.db2.gz IHUFVABBPRLTBS-UHFFFAOYSA-N -1 1 324.405 4.330 20 0 DIADMM CCOc1ccc(-c2nnc(-c3ccc(Cl)cc3)o2)c([O-])c1 ZINC001252715560 1061699749 /nfs/dbraw/zinc/69/97/49/1061699749.db2.gz MWYPLSLCAMZGPS-UHFFFAOYSA-N -1 1 316.744 4.161 20 0 DIADMM [O-]c1cc(F)c(F)c(-c2nnc(-c3ccc(Cl)cc3)o2)c1 ZINC001252788299 1061716936 /nfs/dbraw/zinc/71/69/36/1061716936.db2.gz ZXBFQKOGVHZWKL-UHFFFAOYSA-N -1 1 308.671 4.041 20 0 DIADMM [O-]c1cccc(-c2nnc(-c3ccc(Cl)cc3)o2)c1Cl ZINC001252788228 1061719362 /nfs/dbraw/zinc/71/93/62/1061719362.db2.gz XHMYVCCZWOMXND-UHFFFAOYSA-N -1 1 307.136 4.416 20 0 DIADMM [O-]c1ccc(F)cc1-c1nnc(-c2ccc(C(F)(F)F)cc2)o1 ZINC001252925976 1061755169 /nfs/dbraw/zinc/75/51/69/1061755169.db2.gz MDXZKBGFFOOUCQ-UHFFFAOYSA-N -1 1 324.233 4.267 20 0 DIADMM CCc1ccc(-c2nnc(-c3ccc([O-])cc3Cl)o2)cc1 ZINC001252954275 1061760679 /nfs/dbraw/zinc/76/06/79/1061760679.db2.gz VVNXOQXFIHATGE-UHFFFAOYSA-N -1 1 300.745 4.325 20 0 DIADMM C[C@@]1(c2ccccc2)C[C@H]1NC(=O)c1cc2ccccc2cc1[O-] ZINC001465513236 1061766025 /nfs/dbraw/zinc/76/60/25/1061766025.db2.gz GRLWONTVQBHQKO-CTNGQTDRSA-N -1 1 317.388 4.005 20 0 DIADMM CC(C)CCn1ccc(NC(=O)c2ccc(C(C)C)cc2[O-])n1 ZINC001465818112 1061816151 /nfs/dbraw/zinc/81/61/51/1061816151.db2.gz SFDQQJYFBRFIFN-UHFFFAOYSA-N -1 1 315.417 4.011 20 0 DIADMM CCCc1cc(=O)[n-]c(SCCCc2c(F)cccc2F)n1 ZINC001458790837 1061903643 /nfs/dbraw/zinc/90/36/43/1061903643.db2.gz AMACMBXIAGRUMD-UHFFFAOYSA-N -1 1 324.396 4.138 20 0 DIADMM Cc1cccc(-c2nnc(-c3ccc(C(F)(F)F)cc3[O-])o2)c1 ZINC001253622011 1061940689 /nfs/dbraw/zinc/94/06/89/1061940689.db2.gz YPQYIWQTEAILDL-UHFFFAOYSA-N -1 1 320.270 4.436 20 0 DIADMM CC[C@@H](NC(=O)c1c([O-])cccc1Cl)c1ccc(C)c(F)c1 ZINC001466448344 1061942497 /nfs/dbraw/zinc/94/24/97/1061942497.db2.gz RXXATOVKZRZQGV-CQSZACIVSA-N -1 1 321.779 4.374 20 0 DIADMM COc1c(Cl)ccc([O-])c1-c1nnc(-c2cccc(C)c2)o1 ZINC001253712129 1061959751 /nfs/dbraw/zinc/95/97/51/1061959751.db2.gz ZVYPQALZFZQVRU-UHFFFAOYSA-N -1 1 316.744 4.080 20 0 DIADMM CCCN(CCc1cccs1)C(=O)c1cc(Cl)ccc1[O-] ZINC001466709748 1061992424 /nfs/dbraw/zinc/99/24/24/1061992424.db2.gz GIHJTBBMIGUHIG-UHFFFAOYSA-N -1 1 323.845 4.202 20 0 DIADMM O=C(Nc1ccc(Br)c([O-])c1)C12CCC(CC1)CC2 ZINC001466898587 1062021786 /nfs/dbraw/zinc/02/17/86/1062021786.db2.gz OUYAOVHHEUVPGP-UHFFFAOYSA-N -1 1 324.218 4.064 20 0 DIADMM CC(C)c1ccc(C(=O)Nc2cccc3ccn(C)c32)c([O-])c1 ZINC001466914809 1062025856 /nfs/dbraw/zinc/02/58/56/1062025856.db2.gz JZJLMXURSKSYST-UHFFFAOYSA-N -1 1 308.381 4.260 20 0 DIADMM [O-]c1cc(C(F)(F)F)ccc1-c1nnc(-c2cccc(F)c2)o1 ZINC001254140361 1062031703 /nfs/dbraw/zinc/03/17/03/1062031703.db2.gz IDVGGRCFYMEGPN-UHFFFAOYSA-N -1 1 324.233 4.267 20 0 DIADMM C[C@@H]1CCC[C@H](NC(=O)c2ccc(C(F)(F)F)cc2[O-])CC1 ZINC001466958864 1062037146 /nfs/dbraw/zinc/03/71/46/1062037146.db2.gz CFTDZZCCTSHZBR-PWSUYJOCSA-N -1 1 315.335 4.110 20 0 DIADMM O=C(N[C@H]1C[C@H](c2ccccc2)C1)c1ccc2ccccc2c1[O-] ZINC001467620753 1062158886 /nfs/dbraw/zinc/15/88/86/1062158886.db2.gz SBMBYJQHAZOYQL-QAQDUYKDSA-N -1 1 317.388 4.221 20 0 DIADMM C[C@@H]1C[C@@H](CCNC(=O)c2cc(F)ccc2[O-])CC(C)(C)C1 ZINC001467635711 1062166789 /nfs/dbraw/zinc/16/67/89/1062166789.db2.gz FEABMYVIBZOQKK-CHWSQXEVSA-N -1 1 307.409 4.114 20 0 DIADMM CCc1cc(Cl)ccc1[N-]S(=O)(=O)c1ccccc1C ZINC001254611577 1062199622 /nfs/dbraw/zinc/19/96/22/1062199622.db2.gz PZXUYIYALSHTLA-UHFFFAOYSA-N -1 1 309.818 4.012 20 0 DIADMM Cc1ccc2c(cccc2[N-]S(=O)(=O)c2ccccc2C)c1 ZINC001254625986 1062206233 /nfs/dbraw/zinc/20/62/33/1062206233.db2.gz LQZONCGTDHWHGW-UHFFFAOYSA-N -1 1 311.406 4.257 20 0 DIADMM CCc1ccc(NC(=O)Cc2ccc([O-])c(Cl)c2)cc1Cl ZINC001467846500 1062222765 /nfs/dbraw/zinc/22/27/65/1062222765.db2.gz GICVHSURSMEPQW-UHFFFAOYSA-N -1 1 324.207 4.443 20 0 DIADMM C[C@@H](CCc1ccc(F)cc1)C(=O)Nc1ccc([O-])c(F)c1F ZINC001468003529 1062246567 /nfs/dbraw/zinc/24/65/67/1062246567.db2.gz LJZXGALYCSBVDE-JTQLQIEISA-N -1 1 323.314 4.017 20 0 DIADMM CCCCN(C(=O)c1ccc([O-])cc1F)[C@@H]1CCC[C@@H](C)C1 ZINC001468504022 1062336665 /nfs/dbraw/zinc/33/66/65/1062336665.db2.gz KHPQTUMRQUNHCA-ZIAGYGMSSA-N -1 1 307.409 4.352 20 0 DIADMM CC(C)c1ccc(S(=O)(=O)[N-]c2ccc(C(C)C)nc2)cc1 ZINC001255274489 1062376148 /nfs/dbraw/zinc/37/61/48/1062376148.db2.gz QLFWLAZTXDSBBX-UHFFFAOYSA-N -1 1 318.442 4.129 20 0 DIADMM CC(C)(CC(=O)Nc1cc([O-])c(F)cc1F)c1ccc(F)cc1 ZINC001468747173 1062391246 /nfs/dbraw/zinc/39/12/46/1062391246.db2.gz CZVNPRBWKPZGMK-UHFFFAOYSA-N -1 1 323.314 4.116 20 0 DIADMM Cc1cc(C)c(/C=C/C(=O)Nc2cc([O-])c(F)cc2F)cc1C ZINC001468747588 1062392560 /nfs/dbraw/zinc/39/25/60/1062392560.db2.gz HSUQDRXDHUHSHZ-SNAWJCMRSA-N -1 1 317.335 4.248 20 0 DIADMM O=C(Nc1cc([O-])c(F)cc1F)c1c(Cl)cccc1Cl ZINC001468748011 1062393458 /nfs/dbraw/zinc/39/34/58/1062393458.db2.gz QYPCLYNXVQKICY-UHFFFAOYSA-N -1 1 318.106 4.230 20 0 DIADMM CC1(C)C[C@H](c2ccccc2)N(C(=O)c2ccc(F)c([O-])c2)C1 ZINC001469279048 1062518338 /nfs/dbraw/zinc/51/83/38/1062518338.db2.gz JACZRDBGWBKTFT-MRXNPFEDSA-N -1 1 313.372 4.145 20 0 DIADMM C/C=C(/C=C/C(=O)Nc1cc(C)cc(Br)c1[O-])CC ZINC001546177410 1062651585 /nfs/dbraw/zinc/65/15/85/1062651585.db2.gz ZHNYAUXVRYLTNA-HNGDNPSASA-N -1 1 324.218 4.314 20 0 DIADMM CC(C)Nc1ccc(Cl)cc1NC(=O)c1ccc([O-])c(F)c1 ZINC001470024679 1062686395 /nfs/dbraw/zinc/68/63/95/1062686395.db2.gz GWDYUPVJBWRBBW-UHFFFAOYSA-N -1 1 322.767 4.257 20 0 DIADMM [O-]c1cnc(Cl)c(-c2nnc(-c3ccc4ccccc4c3)o2)c1 ZINC001256044267 1062686525 /nfs/dbraw/zinc/68/65/25/1062686525.db2.gz PFRDIHPUMBQUBS-UHFFFAOYSA-N -1 1 323.739 4.311 20 0 DIADMM [O-]c1cc(-c2nnc(-c3ccc4ccccc4c3)o2)ccc1F ZINC001256052972 1062689383 /nfs/dbraw/zinc/68/93/83/1062689383.db2.gz PZQLVVIOLVDJHH-UHFFFAOYSA-N -1 1 306.296 4.402 20 0 DIADMM CCCOc1ccc(-c2nnc(-c3ccc([O-])cc3F)o2)cc1 ZINC001256302132 1062767465 /nfs/dbraw/zinc/76/74/65/1062767465.db2.gz OOKBPAHBRWMQRI-UHFFFAOYSA-N -1 1 314.316 4.037 20 0 DIADMM CCCCCCc1nnc(-c2c(O)cc3ccccc3c2[O-])o1 ZINC001256330398 1062777110 /nfs/dbraw/zinc/77/71/10/1062777110.db2.gz MTBDCHMOHPFKOZ-UHFFFAOYSA-N -1 1 312.369 4.424 20 0 DIADMM CC(C)CCCCCC(=O)Nc1ccc(-n2ccc(=O)[n-]2)cc1 ZINC001470670616 1062832773 /nfs/dbraw/zinc/83/27/73/1062832773.db2.gz ZCYPERXZTNWRMN-UHFFFAOYSA-N -1 1 315.417 4.123 20 0 DIADMM CCCCCC[C@@H](C)NC(=O)NCc1ccc([O-])c(Cl)c1 ZINC001477306960 1062836096 /nfs/dbraw/zinc/83/60/96/1062836096.db2.gz MQNRRANLNTXHFH-GFCCVEGCSA-N -1 1 312.841 4.204 20 0 DIADMM O=C(CCCc1ccc(Cl)cc1)Nc1cccc(F)c1[O-] ZINC001471166401 1062930652 /nfs/dbraw/zinc/93/06/52/1062930652.db2.gz ISPMHYSVCHBVRG-UHFFFAOYSA-N -1 1 307.752 4.146 20 0 DIADMM Cc1cc2cc([N-]S(=O)(=O)c3cccc(Cl)c3)ccc2o1 ZINC001256796459 1062985432 /nfs/dbraw/zinc/98/54/32/1062985432.db2.gz VQHCGQACXBMRPC-UHFFFAOYSA-N -1 1 321.785 4.195 20 0 DIADMM CC[C@H](CC(=O)NCc1ccc([O-])c(Cl)c1)c1ccccc1 ZINC001471699537 1063013394 /nfs/dbraw/zinc/01/33/94/1063013394.db2.gz ILYAOHJPBPGCQM-CQSZACIVSA-N -1 1 317.816 4.246 20 0 DIADMM [O-]c1ccc(F)c(-c2nnc(CCC3CCCCC3)o2)c1F ZINC001256854724 1063018205 /nfs/dbraw/zinc/01/82/05/1063018205.db2.gz PVHBKFHFVBZQSA-UHFFFAOYSA-N -1 1 308.328 4.233 20 0 DIADMM O=C(NCCCCC1CCCC1)NCc1ccc([O-])c(Cl)c1 ZINC001477976639 1063040821 /nfs/dbraw/zinc/04/08/21/1063040821.db2.gz DXRPCRQZWJFDHN-UHFFFAOYSA-N -1 1 324.852 4.205 20 0 DIADMM Cc1cccc(S(=O)(=O)[N-]c2cccc(C(C)(C)C)c2)c1 ZINC001256929292 1063056456 /nfs/dbraw/zinc/05/64/56/1063056456.db2.gz QBPSBTQXOVTYGQ-UHFFFAOYSA-N -1 1 303.427 4.093 20 0 DIADMM O=C(CCCc1ccsc1)Nc1cc(F)c([O-])cc1Cl ZINC001472193141 1063057505 /nfs/dbraw/zinc/05/75/05/1063057505.db2.gz NFYGKBZYFSZOMC-UHFFFAOYSA-N -1 1 313.781 4.208 20 0 DIADMM Cc1cccc(S(=O)(=O)[N-]c2cc3ccccc3cc2C)c1 ZINC001256953374 1063058243 /nfs/dbraw/zinc/05/82/43/1063058243.db2.gz AJUSWZIWGLRTED-UHFFFAOYSA-N -1 1 311.406 4.257 20 0 DIADMM CCc1cc(Cl)ccc1[N-]S(=O)(=O)c1cccc(C)c1 ZINC001256946211 1063059216 /nfs/dbraw/zinc/05/92/16/1063059216.db2.gz NAAXMSBKGCPATN-UHFFFAOYSA-N -1 1 309.818 4.012 20 0 DIADMM CC(C)c1ccc(C(=O)Nc2nc(-c3ccccc3)c[nH]2)c([O-])c1 ZINC001472537310 1063097208 /nfs/dbraw/zinc/09/72/08/1063097208.db2.gz WSTBFHTXODXXFB-UHFFFAOYSA-N -1 1 321.380 4.158 20 0 DIADMM O=C(Nc1ccc(F)cc1[O-])c1ccc2c(c1)-c1ccccc1C2 ZINC001472535363 1063098450 /nfs/dbraw/zinc/09/84/50/1063098450.db2.gz SNMWJZKMEXVFCH-UHFFFAOYSA-N -1 1 319.335 4.355 20 0 DIADMM COc1cccc([O-])c1-c1nnc([C@H]2C[C@@H]2c2ccc(C)cc2)o1 ZINC001257208665 1063136147 /nfs/dbraw/zinc/13/61/47/1063136147.db2.gz CYOURJVOWADCBZ-KGLIPLIRSA-N -1 1 322.364 4.030 20 0 DIADMM COc1cccc([O-])c1-c1nnc([C@@H]2C[C@@H]2c2ccc(C)cc2)o1 ZINC001257208668 1063137120 /nfs/dbraw/zinc/13/71/20/1063137120.db2.gz CYOURJVOWADCBZ-ZIAGYGMSSA-N -1 1 322.364 4.030 20 0 DIADMM COc1ccc(-c2nnc([C@H]3C[C@H]3c3ccc(C)cc3)o2)c([O-])c1 ZINC001257211036 1063143966 /nfs/dbraw/zinc/14/39/66/1063143966.db2.gz ZEEPCBYSCYOVAP-HOTGVXAUSA-N -1 1 322.364 4.030 20 0 DIADMM Cc1ccc([C@@H]2C[C@H]2c2nnc(-c3ccc([O-])c(F)c3)o2)cc1 ZINC001257323265 1063207495 /nfs/dbraw/zinc/20/74/95/1063207495.db2.gz GUPUUWAZBRRMLA-UONOGXRCSA-N -1 1 310.328 4.161 20 0 DIADMM CCC1(CC)CCN(C(=O)NCc2ccc([O-])c(Cl)c2)CC1 ZINC001479211422 1063400333 /nfs/dbraw/zinc/40/03/33/1063400333.db2.gz IKEYFEGCFOALSC-UHFFFAOYSA-N -1 1 324.852 4.157 20 0 DIADMM [O-]c1c2ccccc2cc(O)c1-c1nnc(CC2CCCC2)o1 ZINC001258618527 1063714150 /nfs/dbraw/zinc/71/41/50/1063714150.db2.gz WKELIDCGUKISGV-UHFFFAOYSA-N -1 1 310.353 4.034 20 0 DIADMM Cc1ccc(-c2nnc(-c3cccc([O-])c3Cl)o2)cc1F ZINC001258784884 1063820996 /nfs/dbraw/zinc/82/09/96/1063820996.db2.gz GHCVAWXBCNXIOH-UHFFFAOYSA-N -1 1 304.708 4.210 20 0 DIADMM CC[C@@H](C)c1ccc([N-]S(=O)(=O)c2cccc(OC)c2)cc1 ZINC001259182924 1063884838 /nfs/dbraw/zinc/88/48/38/1063884838.db2.gz VHRKLVIATIWMLX-CYBMUJFWSA-N -1 1 319.426 4.010 20 0 DIADMM O=C(Nc1cc(F)cc(F)c1[O-])c1ccc(Cl)cc1Cl ZINC001299579569 1063886360 /nfs/dbraw/zinc/88/63/60/1063886360.db2.gz CXDMPBWFZODMSC-UHFFFAOYSA-N -1 1 318.106 4.230 20 0 DIADMM CC[C@@H](Sc1ccccc1)C(=O)Nc1cc(F)cc(F)c1[O-] ZINC001299581094 1063887530 /nfs/dbraw/zinc/88/75/30/1063887530.db2.gz NAUQSXUFPCJRKV-CQSZACIVSA-N -1 1 323.364 4.180 20 0 DIADMM CC[C@H](Sc1ccccc1)C(=O)Nc1cc(F)cc(F)c1[O-] ZINC001299581089 1063888069 /nfs/dbraw/zinc/88/80/69/1063888069.db2.gz NAUQSXUFPCJRKV-AWEZNQCLSA-N -1 1 323.364 4.180 20 0 DIADMM Cc1cc(C)cc(S(=O)(=O)[N-]c2ccccc2C(F)F)c1 ZINC001259522633 1063889786 /nfs/dbraw/zinc/88/97/86/1063889786.db2.gz RIRQGRQFECMKEB-UHFFFAOYSA-N -1 1 311.353 4.042 20 0 DIADMM Cc1cc(C)cc(S(=O)(=O)[N-]c2ccc3ccccc3c2)c1 ZINC001259522897 1063889817 /nfs/dbraw/zinc/88/98/17/1063889817.db2.gz CCVGFLSEIOOASB-UHFFFAOYSA-N -1 1 311.406 4.257 20 0 DIADMM O=C(CC[C@@H]1CCc2ccccc21)Nc1cc(F)cc(F)c1[O-] ZINC001299587317 1063890596 /nfs/dbraw/zinc/89/05/96/1063890596.db2.gz UJINFUHGPVQNAI-LBPRGKRZSA-N -1 1 317.335 4.119 20 0 DIADMM CCCCCc1ccc(S(=O)(=O)[N-]c2ccsc2)cc1 ZINC001260567864 1063902327 /nfs/dbraw/zinc/90/23/27/1063902327.db2.gz SSRNIKZVYLIFCN-UHFFFAOYSA-N -1 1 309.456 4.282 20 0 DIADMM CC[C@H](C)c1ccccc1[N-]S(=O)(=O)c1ccc(F)c(C)c1 ZINC001260753719 1063905747 /nfs/dbraw/zinc/90/57/47/1063905747.db2.gz GDKQBFYACDRKOC-LBPRGKRZSA-N -1 1 321.417 4.448 20 0 DIADMM Cc1cccc(S(=O)(=O)[N-]c2cccc(C(C)C)c2)c1C ZINC001260991874 1063906185 /nfs/dbraw/zinc/90/61/85/1063906185.db2.gz RRDDUMRRJUKHRM-UHFFFAOYSA-N -1 1 303.427 4.228 20 0 DIADMM CC[C@@H](C)c1ccccc1[N-]S(=O)(=O)c1ccc(F)c(C)c1 ZINC001260753718 1063906828 /nfs/dbraw/zinc/90/68/28/1063906828.db2.gz GDKQBFYACDRKOC-GFCCVEGCSA-N -1 1 321.417 4.448 20 0 DIADMM Cc1cccc(S(=O)(=O)[N-]c2ccc3sccc3c2)c1C ZINC001260998346 1063907549 /nfs/dbraw/zinc/90/75/49/1063907549.db2.gz GTSYTUYCPCLLLI-UHFFFAOYSA-N -1 1 317.435 4.319 20 0 DIADMM CN(Cc1ccc(C(C)(C)C)cc1)C(=O)c1cc(F)ccc1[O-] ZINC001289982650 1064674168 /nfs/dbraw/zinc/67/41/68/1064674168.db2.gz OEWLVAZVOOKGEA-UHFFFAOYSA-N -1 1 315.388 4.101 20 0 DIADMM CCC[C@H](NC(=O)c1c([O-])cccc1Cl)c1ccccc1 ZINC001290533803 1064697845 /nfs/dbraw/zinc/69/78/45/1064697845.db2.gz QMWULFBLBZWBQC-AWEZNQCLSA-N -1 1 303.789 4.317 20 0 DIADMM CCC[C@H](NC(=O)c1ccc(Cl)cc1[O-])c1ccccc1 ZINC001290533545 1064698017 /nfs/dbraw/zinc/69/80/17/1064698017.db2.gz LOIQEDBKPDYAAD-HNNXBMFYSA-N -1 1 303.789 4.317 20 0 DIADMM O=C(Nc1cccc(OC2CCCC2)c1)c1cccc([O-])c1F ZINC001290692190 1064705926 /nfs/dbraw/zinc/70/59/26/1064705926.db2.gz PTTYKOZMVMMQTN-UHFFFAOYSA-N -1 1 315.344 4.105 20 0 DIADMM CCC(CC)CN(CC)C(=O)c1ccc(C(F)(F)F)cc1[O-] ZINC001290939289 1064718124 /nfs/dbraw/zinc/71/81/24/1064718124.db2.gz JKDOLBKFPAKTJY-UHFFFAOYSA-N -1 1 317.351 4.309 20 0 DIADMM CC(C)CCOc1cccc(NC(=O)c2cccc([O-])c2F)c1 ZINC001292129193 1064762132 /nfs/dbraw/zinc/76/21/32/1064762132.db2.gz IVHCAYYFHDCCGR-UHFFFAOYSA-N -1 1 317.360 4.209 20 0 DIADMM Cc1ccccc1CC(C)(C)NC(=O)c1ccc(Cl)cc1[O-] ZINC001292715132 1064784748 /nfs/dbraw/zinc/78/47/48/1064784748.db2.gz FORBHPQUUFKDBW-UHFFFAOYSA-N -1 1 317.816 4.105 20 0 DIADMM Cc1cccc2c1CC[C@H]2NC(=O)c1ccc2ccccc2c1[O-] ZINC001293174534 1064801848 /nfs/dbraw/zinc/80/18/48/1064801848.db2.gz WOKWRIHOCLFUGN-LJQANCHMSA-N -1 1 317.388 4.271 20 0 DIADMM CC[C@H](NC(=O)c1cc(F)ccc1[O-])C(C)(C)c1ccccc1 ZINC001293844731 1064833788 /nfs/dbraw/zinc/83/37/88/1064833788.db2.gz BALHFCNCBPKYFF-KRWDZBQOSA-N -1 1 315.388 4.018 20 0 DIADMM C[C@H]1Cc2ccccc2CN1C(=O)c1ccc2ccccc2c1[O-] ZINC001294184749 1064855185 /nfs/dbraw/zinc/85/51/85/1064855185.db2.gz VNVCMHQAOLFDMJ-AWEZNQCLSA-N -1 1 317.388 4.132 20 0 DIADMM C[C@H]1CC(C)(C)CC[C@@H]1NC(=O)c1ccc2ccccc2c1[O-] ZINC001294395435 1064865815 /nfs/dbraw/zinc/86/58/15/1064865815.db2.gz GURIFXJZVQALJG-GUYCJALGSA-N -1 1 311.425 4.490 20 0 DIADMM CC(C)(CNC(=O)Cc1ccc([O-])c(Cl)c1)C1CCCCC1 ZINC001295175750 1064905620 /nfs/dbraw/zinc/90/56/20/1064905620.db2.gz UVVJZYNYSHQAOO-UHFFFAOYSA-N -1 1 323.864 4.311 20 0 DIADMM CCC1(CC)CN(C(=O)c2cccc([O-])c2F)c2ccccc21 ZINC001295359411 1064911319 /nfs/dbraw/zinc/91/13/19/1064911319.db2.gz IMPLVYSACXZSLT-UHFFFAOYSA-N -1 1 313.372 4.250 20 0 DIADMM O=C(c1c([O-])cccc1Cl)N1CCCC[C@@H]1c1ccccc1 ZINC001296046021 1064936250 /nfs/dbraw/zinc/93/62/50/1064936250.db2.gz HPRAQHUAYBCIRG-OAHLLOKOSA-N -1 1 315.800 4.413 20 0 DIADMM CC(C)[C@H](NC(=O)c1cc(Cl)ccc1[O-])c1ccc(F)cc1 ZINC001296999239 1064967233 /nfs/dbraw/zinc/96/72/33/1064967233.db2.gz RQXCLDYLNLINSK-INIZCTEOSA-N -1 1 321.779 4.312 20 0 DIADMM O=C(Nc1ccc([O-])c(F)c1F)c1ccc(SC2CC2)cc1 ZINC001297820527 1064990805 /nfs/dbraw/zinc/99/08/05/1064990805.db2.gz PESZRSHODNTNQZ-UHFFFAOYSA-N -1 1 321.348 4.177 20 0 DIADMM Cc1ccc(C)c(SCC(=O)Nc2ccc([O-])c(F)c2F)c1 ZINC001297819781 1064990850 /nfs/dbraw/zinc/99/08/50/1064990850.db2.gz FRGUAKWPPISWJV-UHFFFAOYSA-N -1 1 323.364 4.018 20 0 DIADMM C[C@H](CSc1ccccc1)C(=O)Nc1ccc([O-])c(F)c1F ZINC001297821937 1064990931 /nfs/dbraw/zinc/99/09/31/1064990931.db2.gz ZMBXONXZEAVBCK-SNVBAGLBSA-N -1 1 323.364 4.037 20 0 DIADMM Cc1ccccc1[C@@H](C)CC(=O)Nc1ccc([O-])c(F)c1F ZINC001297819672 1064991259 /nfs/dbraw/zinc/99/12/59/1064991259.db2.gz AODKUHBFXFVJMD-NSHDSACASA-N -1 1 305.324 4.111 20 0 DIADMM Cc1cc(C(=O)Nc2ccc([O-])c(F)c2F)c(C)cc1Cl ZINC001297820207 1064992162 /nfs/dbraw/zinc/99/21/62/1064992162.db2.gz IIPUDOPOFPAUDN-UHFFFAOYSA-N -1 1 311.715 4.193 20 0 DIADMM Cc1ccc2c(c1)[C@H](NC(=O)c1c([O-])cccc1Cl)CCC2 ZINC001298698794 1065015870 /nfs/dbraw/zinc/01/58/70/1065015870.db2.gz ZHVUGRJZBPFXGH-OAHLLOKOSA-N -1 1 315.800 4.161 20 0 DIADMM CC(C)[C@H](CC(=O)Nc1cc([O-])c(F)cc1F)c1ccccc1 ZINC001298975761 1065026812 /nfs/dbraw/zinc/02/68/12/1065026812.db2.gz ZZRTUEAHTYIFJF-ZDUSSCGKSA-N -1 1 319.351 4.439 20 0 DIADMM O=C(Nc1cc([O-])c(F)cc1F)[C@@H]1CCC[C@@H]1c1ccccc1 ZINC001298972527 1065027886 /nfs/dbraw/zinc/02/78/86/1065027886.db2.gz GLCREZSKOFQKPS-CHWSQXEVSA-N -1 1 317.335 4.193 20 0 DIADMM O=C(NC1CCC(C2CCC2)CC1)c1c([O-])cccc1Cl ZINC001301093569 1065052768 /nfs/dbraw/zinc/05/27/68/1065052768.db2.gz IJJDCLGLNYABTB-UHFFFAOYSA-N -1 1 307.821 4.134 20 0 DIADMM Cc1cccc2c1CCC[C@@H]2NC(=O)c1ccc(Cl)cc1[O-] ZINC001301380234 1065063415 /nfs/dbraw/zinc/06/34/15/1065063415.db2.gz FIJKYHFXNNCESL-INIZCTEOSA-N -1 1 315.800 4.161 20 0 DIADMM CC1(C)CN(C(=O)c2ccc3ccccc3c2[O-])c2ccccc21 ZINC001302047747 1065077407 /nfs/dbraw/zinc/07/74/07/1065077407.db2.gz SGMBTMIXKZOVHE-UHFFFAOYSA-N -1 1 317.388 4.483 20 0 DIADMM CC(C)[C@@H]1C[C@H](NC(=O)c2ccc([O-])c(F)c2)c2ccccc21 ZINC001302319088 1065084948 /nfs/dbraw/zinc/08/49/48/1065084948.db2.gz HNGWXDSBZCVKFR-RDJZCZTQSA-N -1 1 313.372 4.146 20 0 DIADMM C[C@@H](C(=O)Nc1cccc(F)c1[O-])c1ccc2ccccc2c1 ZINC001302487194 1065090206 /nfs/dbraw/zinc/09/02/06/1065090206.db2.gz WTNAIGGLPQOGRB-GFCCVEGCSA-N -1 1 309.340 4.427 20 0 DIADMM Cc1ccc(CCCCC(=O)Nc2cccc(F)c2[O-])cc1 ZINC001302487173 1065090372 /nfs/dbraw/zinc/09/03/72/1065090372.db2.gz WQILTRHPQFCVHN-UHFFFAOYSA-N -1 1 301.361 4.191 20 0 DIADMM CC[C@@H](Cc1ccccc1C)C(=O)Nc1cccc(F)c1[O-] ZINC001302484366 1065090497 /nfs/dbraw/zinc/09/04/97/1065090497.db2.gz BSNHYOAYESGBLP-ZDUSSCGKSA-N -1 1 301.361 4.047 20 0 DIADMM Cc1cccc(Oc2cccc(NC(=O)c3ccc([O-])cn3)c2)c1 ZINC001302750534 1065098382 /nfs/dbraw/zinc/09/83/82/1065098382.db2.gz CSEQAXFZMMNZQI-UHFFFAOYSA-N -1 1 320.348 4.140 20 0 DIADMM O=C(NCc1ccc([O-])c(Cl)c1)[C@@H]1CC[C@@H]2CCCC[C@@H]2C1 ZINC001303299242 1065113639 /nfs/dbraw/zinc/11/36/39/1065113639.db2.gz RDIWTVMYGHKBLJ-RRFJBIMHSA-N -1 1 321.848 4.268 20 0 DIADMM CC(C)(C)OCc1ccccc1NC(=O)c1cc(F)ccc1[O-] ZINC001303790347 1065122535 /nfs/dbraw/zinc/12/25/35/1065122535.db2.gz JSNJLBFFYQKLCU-UHFFFAOYSA-N -1 1 317.360 4.099 20 0 DIADMM Cc1ccccc1C(C)(C)C(=O)Nc1cc(F)c([O-])cc1Cl ZINC001304285434 1065135429 /nfs/dbraw/zinc/13/54/29/1065135429.db2.gz ZFQNZJBWHYHHLY-UHFFFAOYSA-N -1 1 321.779 4.409 20 0 DIADMM O=C(Nc1cc(F)c([O-])cc1Cl)[C@@H]1C[C@@]1(F)c1ccccc1 ZINC001304283322 1065136049 /nfs/dbraw/zinc/13/60/49/1065136049.db2.gz WQRBMVZFRCFQGK-MGPLVRAMSA-N -1 1 323.726 4.008 20 0 DIADMM CC(C)(CCC(=O)Nc1ccc(F)cc1[O-])c1ccccc1 ZINC001306783826 1065192762 /nfs/dbraw/zinc/19/27/62/1065192762.db2.gz QKMZPZUTDYENPQ-UHFFFAOYSA-N -1 1 301.361 4.228 20 0 DIADMM O=C(Nc1nc(Cl)ccc1[O-])c1ccc(C2=CCCC2)cc1 ZINC001306825666 1065194029 /nfs/dbraw/zinc/19/40/29/1065194029.db2.gz GQBCKLQJSXXUBD-UHFFFAOYSA-N -1 1 314.772 4.260 20 0 DIADMM [O-]c1ccc(CNc2ccc(C(F)(F)F)cc2)c(F)c1F ZINC001308644608 1066133833 /nfs/dbraw/zinc/13/38/33/1066133833.db2.gz ZIBZEXAQRWJMQA-UHFFFAOYSA-N -1 1 303.230 4.301 20 0 DIADMM O=S(=O)([N-]CCCCC1CCCC1)c1cc2ccccc2o1 ZINC001309240792 1066449349 /nfs/dbraw/zinc/44/93/49/1066449349.db2.gz RGESPYJBVISSRZ-UHFFFAOYSA-N -1 1 321.442 4.072 20 0 DIADMM C[C@H](NC(=O)NCc1ccc([O-])c(Cl)c1)[C@@H]1CCC[C@H](C)C1 ZINC001312872106 1066875632 /nfs/dbraw/zinc/87/56/32/1066875632.db2.gz FIEVYYVMBZMBJT-SGMGOOAPSA-N -1 1 324.852 4.060 20 0 DIADMM C[C@@H](Sc1nc(C2CC2)cc(=O)[n-]1)c1ncc(C(C)(C)C)o1 ZINC000188140097 200200226 /nfs/dbraw/zinc/20/02/26/200200226.db2.gz FRTGFRRYWWNWFI-SECBINFHSA-N -1 1 319.430 4.198 20 0 DIADMM Cc1nc(C(C)C)ccc1C(=O)Nc1ccc([O-])c(Cl)c1 ZINC000343308425 335031365 /nfs/dbraw/zinc/03/13/65/335031365.db2.gz ZXHVVTAYNWEGLY-UHFFFAOYSA-N -1 1 304.777 4.125 20 0 DIADMM [O-]c1cccc(CNc2ccc([C@@H]3CCOC3)cc2)c1Cl ZINC000292984091 131697650 /nfs/dbraw/zinc/69/76/50/131697650.db2.gz LMZMUNNUDILWLX-CQSZACIVSA-N -1 1 303.789 4.162 20 0 DIADMM [O-]c1c(-c2nc(-c3cccc(F)c3)no2)ccc2ccccc21 ZINC000320504373 335067574 /nfs/dbraw/zinc/06/75/74/335067574.db2.gz XMEHISVQSWKTIC-UHFFFAOYSA-N -1 1 306.296 4.402 20 0 DIADMM CSc1ccc(Cl)cc1[N-]C(=O)c1cc(C(C)C)on1 ZINC000179663782 331533058 /nfs/dbraw/zinc/53/30/58/331533058.db2.gz PIHQZCJFKZJUID-UHFFFAOYSA-N -1 1 310.806 4.426 20 0 DIADMM Cc1cccc(S(=O)(=O)[N-]c2ccc3c4c(cccc42)CC3)c1 ZINC000409867813 332061822 /nfs/dbraw/zinc/06/18/22/332061822.db2.gz SGILHKGUYIDAQB-UHFFFAOYSA-N -1 1 323.417 4.048 20 0 DIADMM Cc1ccc(S(=O)(=O)[N-]c2ccccc2NC(C)(C)C)cc1 ZINC000410406437 332123727 /nfs/dbraw/zinc/12/37/27/332123727.db2.gz LHBDEJYMQCDOGA-UHFFFAOYSA-N -1 1 318.442 4.006 20 0 DIADMM Cc1cccc(S(=O)(=O)[N-]c2c(C)cccc2C(C)C)c1 ZINC000096659382 332138748 /nfs/dbraw/zinc/13/87/48/332138748.db2.gz WWMJCNKOHOKFIN-UHFFFAOYSA-N -1 1 303.427 4.228 20 0 DIADMM CCSc1cccc(CN[C@H](CC(=O)[O-])c2ccc(C)o2)c1 ZINC000426783235 332152526 /nfs/dbraw/zinc/15/25/26/332152526.db2.gz KFSDLKBJJFOTDR-OAHLLOKOSA-N -1 1 319.426 4.006 20 0 DIADMM CCC[C@H](C)C[C@@H](NCc1ccc(-c2ccccc2)o1)C(=O)[O-] ZINC000426794869 332154409 /nfs/dbraw/zinc/15/44/09/332154409.db2.gz VYBOBGOSXFBOJQ-WMLDXEAASA-N -1 1 315.413 4.316 20 0 DIADMM CCCCCC(=O)Nc1c([O-])cc(Br)cc1Cl ZINC000560503828 332347436 /nfs/dbraw/zinc/34/74/36/332347436.db2.gz RSHOYVRMJHLZOG-UHFFFAOYSA-N -1 1 320.614 4.327 20 0 DIADMM CCCCN(C(=O)c1ncccc1[O-])[C@@H](CC)c1ccccc1 ZINC000427463065 332431738 /nfs/dbraw/zinc/43/17/38/332431738.db2.gz QJSFTBVPDIAORA-INIZCTEOSA-N -1 1 312.413 4.181 20 0 DIADMM CCSc1cccc(-c2nc3ccc(OC)cc3c(=O)[n-]2)c1 ZINC000427472956 332433876 /nfs/dbraw/zinc/43/38/76/332433876.db2.gz IMWNRISEGHOHJW-UHFFFAOYSA-N -1 1 312.394 4.123 20 0 DIADMM Cc1c(=O)[n-]c(SCC2CCCC2)nc1-c1ccccc1 ZINC000466462669 333021957 /nfs/dbraw/zinc/02/19/57/333021957.db2.gz LHGDDUSULFBWAR-UHFFFAOYSA-N -1 1 300.427 4.440 20 0 DIADMM O=C(Nc1cccc(OC2CCCC2)c1)c1ccc([O-])cc1F ZINC000181109229 333029470 /nfs/dbraw/zinc/02/94/70/333029470.db2.gz HTOBOJNQKJCEFN-UHFFFAOYSA-N -1 1 315.344 4.105 20 0 DIADMM CC1(C)CN(C(=O)c2ccc3ccccc3c2[O-])[C@@H]2CCC[C@@H]21 ZINC000378816219 333054908 /nfs/dbraw/zinc/05/49/08/333054908.db2.gz BXYXGQSVENUPGM-DLBZAZTESA-N -1 1 309.409 4.196 20 0 DIADMM CCc1ccccc1[N-]S(=O)(=O)c1ccccc1C(C)(C)C ZINC000460437119 333087096 /nfs/dbraw/zinc/08/70/96/333087096.db2.gz KKFUKTRJRYUVMA-UHFFFAOYSA-N -1 1 317.454 4.347 20 0 DIADMM CC(C)(C)C1=CCN(C(=O)c2cc3ccccc3cc2[O-])CC1 ZINC000323396371 333117210 /nfs/dbraw/zinc/11/72/10/333117210.db2.gz JYJNIGGRGNQWII-UHFFFAOYSA-N -1 1 309.409 4.364 20 0 DIADMM Cc1cc([N-]S(=O)(=O)c2cccc(C(C)C)c2)ccc1F ZINC000460834895 333146884 /nfs/dbraw/zinc/14/68/84/333146884.db2.gz XMIUWDXIQGPDJP-UHFFFAOYSA-N -1 1 307.390 4.058 20 0 DIADMM O=C(c1ccc2ccccc2c1[O-])N1CCC[C@H]2CCCC[C@@H]21 ZINC000319524890 333312457 /nfs/dbraw/zinc/31/24/57/333312457.db2.gz KFDFTNIESJRNEG-QAPCUYQASA-N -1 1 309.409 4.340 20 0 DIADMM C[C@@H](NC(=O)c1ccc([O-])cc1F)c1cc2ccccc2s1 ZINC000185436566 333369977 /nfs/dbraw/zinc/36/99/77/333369977.db2.gz NQEYTNBVWGAAET-SNVBAGLBSA-N -1 1 315.369 4.237 20 0 DIADMM O=C(Nc1ccc([O-])c(Cl)c1)[C@@H]1CCC[C@@H](C(F)(F)F)C1 ZINC000096482091 333482250 /nfs/dbraw/zinc/48/22/50/333482250.db2.gz LTDXBYKHLBYLRT-RKDXNWHRSA-N -1 1 321.726 4.353 20 0 DIADMM O=C(Nc1ccc([O-])c(Cl)c1)[C@H]1CCC[C@@H](C(F)(F)F)C1 ZINC000096482092 333482276 /nfs/dbraw/zinc/48/22/76/333482276.db2.gz LTDXBYKHLBYLRT-DTWKUNHWSA-N -1 1 321.726 4.353 20 0 DIADMM O=C(Nc1ccc(F)cc1[O-])c1cc(F)c(Cl)cc1Cl ZINC000531756257 333551577 /nfs/dbraw/zinc/55/15/77/333551577.db2.gz CFMWWTVXMYRSRQ-UHFFFAOYSA-N -1 1 318.106 4.230 20 0 DIADMM O=C(Nc1ccc(F)cc1[O-])c1occc1-c1ccc(F)cc1 ZINC000533970508 333552518 /nfs/dbraw/zinc/55/25/18/333552518.db2.gz WWYAEEYTHICMCT-UHFFFAOYSA-N -1 1 315.275 4.183 20 0 DIADMM O=C(Cc1ccc(Cl)cc1Cl)Nc1ccc(F)cc1[O-] ZINC000531755771 333553697 /nfs/dbraw/zinc/55/36/97/333553697.db2.gz OVMJNFYKNFCQJO-UHFFFAOYSA-N -1 1 314.143 4.019 20 0 DIADMM CC[C@H](C)c1ccccc1OCC(=O)Nc1ccc(F)cc1[O-] ZINC000531755838 333553731 /nfs/dbraw/zinc/55/37/31/333553731.db2.gz FFVMANUIJWNCSZ-LBPRGKRZSA-N -1 1 317.360 4.062 20 0 DIADMM [O-]c1cccc(CNc2ccccc2N2CCCC2)c1Cl ZINC000293505660 333717626 /nfs/dbraw/zinc/71/76/26/333717626.db2.gz HRSDMFZPRVDWMX-UHFFFAOYSA-N -1 1 302.805 4.258 20 0 DIADMM Cc1cnc(S[C@H](C)CCSc2ccccc2)[n-]c1=O ZINC000571345405 333768868 /nfs/dbraw/zinc/76/88/68/333768868.db2.gz NSAPNLPCJJVOLY-GFCCVEGCSA-N -1 1 306.456 4.154 20 0 DIADMM [O-]c1c(-c2nc(C3CC(F)(F)C3)no2)ccc2ccccc21 ZINC000296329184 334231910 /nfs/dbraw/zinc/23/19/10/334231910.db2.gz GEJOMLQNLWHLMY-UHFFFAOYSA-N -1 1 302.280 4.108 20 0 DIADMM Cc1cc(Cl)ccc1S(=O)(=O)[N-]c1ccc(Cl)cc1 ZINC000048652545 334290960 /nfs/dbraw/zinc/29/09/60/334290960.db2.gz WDQPPXYPOYQDQA-UHFFFAOYSA-N -1 1 316.209 4.103 20 0 DIADMM Cc1cccc([N-]S(=O)(=O)c2ccc(C)c(Cl)c2)c1C ZINC000048652278 334291082 /nfs/dbraw/zinc/29/10/82/334291082.db2.gz VPUYNJVAGOPZQC-UHFFFAOYSA-N -1 1 309.818 4.066 20 0 DIADMM [O-]c1ccc(-c2noc(/C=C/c3ccc4[nH]ccc4c3)n2)cc1F ZINC000445470544 338495824 /nfs/dbraw/zinc/49/58/24/338495824.db2.gz FEKDMGNFAIFWBU-QHHAFSJGSA-N -1 1 321.311 4.233 20 0 DIADMM CC(C)c1ccc(-c2nc(-c3ccc([O-])c(F)c3)no2)c(O)c1 ZINC000445482487 338496478 /nfs/dbraw/zinc/49/64/78/338496478.db2.gz QDCFCSZPVAAEKR-UHFFFAOYSA-N -1 1 314.316 4.077 20 0 DIADMM CSc1ccccc1[N-]C(=O)c1cc(-c2ccccc2)no1 ZINC000041751500 335930537 /nfs/dbraw/zinc/93/05/37/335930537.db2.gz AKYUAOXITGZXQF-UHFFFAOYSA-N -1 1 310.378 4.316 20 0 DIADMM Oc1cc(F)cc(C[N@@H+]2CC=C(c3c[nH]c4ccccc34)CC2)c1 ZINC000351983444 336185651 /nfs/dbraw/zinc/18/56/51/336185651.db2.gz RXVLTBUCXWBJPL-UHFFFAOYSA-N -1 1 322.383 4.302 20 0 DIADMM O=C(Nc1ccc2ncccc2c1)c1ccc2ccccc2c1[O-] ZINC000324478734 336221957 /nfs/dbraw/zinc/22/19/57/336221957.db2.gz CJHIQRBGTRIWPU-UHFFFAOYSA-N -1 1 314.344 4.346 20 0 DIADMM Cc1nc(-c2ccc(NCCC3=CCCCC3)nc2)[n-]c(=O)c1C ZINC000301194011 336294266 /nfs/dbraw/zinc/29/42/66/336294266.db2.gz XUWLMURKWJSBRN-UHFFFAOYSA-N -1 1 324.428 4.163 20 0 DIADMM Cc1ccc2oc(-c3nc4cc(F)c(F)cc4c(=O)[n-]3)cc2c1 ZINC000358132614 336612626 /nfs/dbraw/zinc/61/26/26/336612626.db2.gz ZXVKLHZZPGCHEE-UHFFFAOYSA-N -1 1 312.275 4.335 20 0 DIADMM Cc1ccccc1CN(C)C(=O)c1ccc2ccccc2c1[O-] ZINC000321067041 337193067 /nfs/dbraw/zinc/19/30/67/337193067.db2.gz GZONLIMMOMWKES-UHFFFAOYSA-N -1 1 305.377 4.126 20 0 DIADMM Cc1cc(S(=O)(=O)[N-]c2ccc(C(C)C)cc2)c(C)s1 ZINC000024070101 337257901 /nfs/dbraw/zinc/25/79/01/337257901.db2.gz VLGGLKDCENVVGJ-UHFFFAOYSA-N -1 1 309.456 4.289 20 0 DIADMM O=C(c1ccc2ccccc2c1[O-])N1CCC[C@@H]1C1CCCC1 ZINC000321436873 337265085 /nfs/dbraw/zinc/26/50/85/337265085.db2.gz MFTIGCCJQHQFFB-GOSISDBHSA-N -1 1 309.409 4.340 20 0 DIADMM O=C(Nc1nc(C2CC2)cs1)Nc1ccc([O-])c(Cl)c1 ZINC000190925201 337291512 /nfs/dbraw/zinc/29/15/12/337291512.db2.gz NTIDDJRPNBIRJN-UHFFFAOYSA-N -1 1 309.778 4.024 20 0 DIADMM COCCC1(c2noc(-c3ccc4ccccc4c3[O-])n2)CCC1 ZINC000420514092 337506497 /nfs/dbraw/zinc/50/64/97/337506497.db2.gz LWVGMVRDRRUOGC-UHFFFAOYSA-N -1 1 324.380 4.054 20 0 DIADMM C/C=C/C=C\c1nc(-c2cc(Cl)c([O-])c(OCC)c2)no1 ZINC000445407207 337671346 /nfs/dbraw/zinc/67/13/46/337671346.db2.gz MGZLUYFREFOZPB-WZWXSLMZSA-N -1 1 306.749 4.084 20 0 DIADMM C[C@@H](Cc1ccccc1Cl)C(=O)Nc1ccc(F)cc1[O-] ZINC000533135835 337830443 /nfs/dbraw/zinc/83/04/43/337830443.db2.gz UDGHCZXUZQUOIF-JTQLQIEISA-N -1 1 307.752 4.002 20 0 DIADMM CCc1nc(C)c(-c2nc(-c3ccc([O-])cc3Cl)no2)s1 ZINC000445444005 337837505 /nfs/dbraw/zinc/83/75/05/337837505.db2.gz ICWZSSPDDRAODR-UHFFFAOYSA-N -1 1 321.789 4.090 20 0 DIADMM O=C(c1ccc(Cl)cc1[O-])N1CCC2(CCCCC2)CC1 ZINC000061559161 337945128 /nfs/dbraw/zinc/94/51/28/337945128.db2.gz HDAGSTOHDAZVQC-UHFFFAOYSA-N -1 1 307.821 4.232 20 0 DIADMM CC(C)CCO[C@@H](C)c1nc(-c2ccc([O-])cc2Cl)no1 ZINC000445450757 338015465 /nfs/dbraw/zinc/01/54/65/338015465.db2.gz WDUUOSIOIMVFSH-JTQLQIEISA-N -1 1 310.781 4.219 20 0 DIADMM CC[C@H](C)c1cc(-c2nc(-c3ccc([O-])cc3Cl)no2)on1 ZINC000445453024 338016931 /nfs/dbraw/zinc/01/69/31/338016931.db2.gz UYXGHUMCRNGDDN-QMMMGPOBSA-N -1 1 319.748 4.264 20 0 DIADMM [O-]c1ccc(-c2noc(CCc3cc4ccccc4o3)n2)c(F)c1 ZINC000445453754 338017088 /nfs/dbraw/zinc/01/70/88/338017088.db2.gz JOABTKMLHWAOQZ-UHFFFAOYSA-N -1 1 324.311 4.113 20 0 DIADMM CCOc1ccc(-c2nc(-c3ccc([O-])cc3Cl)no2)cc1 ZINC000445454579 338017185 /nfs/dbraw/zinc/01/71/85/338017185.db2.gz METUWJKLOWGOFY-UHFFFAOYSA-N -1 1 316.744 4.161 20 0 DIADMM [O-]c1ccc(-c2noc(-c3cccc4cccnc43)n2)c(Cl)c1 ZINC000445454541 338017260 /nfs/dbraw/zinc/01/72/60/338017260.db2.gz LMNSXSCGEUJJCZ-UHFFFAOYSA-N -1 1 323.739 4.311 20 0 DIADMM Cc1ccc2cccc(-c3nc(-c4ccc([O-])cc4F)no3)c2n1 ZINC000445455316 338017334 /nfs/dbraw/zinc/01/73/34/338017334.db2.gz JYKJFAFOXIVANI-UHFFFAOYSA-N -1 1 321.311 4.105 20 0 DIADMM Cc1ccccc1SCc1nc(-c2ccc([O-])cc2F)no1 ZINC000445457869 338017868 /nfs/dbraw/zinc/01/78/68/338017868.db2.gz UMAIRKQJURBQKB-UHFFFAOYSA-N -1 1 316.357 4.182 20 0 DIADMM Cc1[nH]c2ccc(-c3nc(-c4ccc([O-])cc4F)no3)cc2c1C ZINC000445461491 338022617 /nfs/dbraw/zinc/02/26/17/338022617.db2.gz XKKYDULWZUYJGJ-UHFFFAOYSA-N -1 1 323.327 4.346 20 0 DIADMM CC(C)c1ccc(-c2nc(-c3ccc([O-])cc3F)no2)c(O)c1 ZINC000445462607 338027624 /nfs/dbraw/zinc/02/76/24/338027624.db2.gz LFKAVNRQZWJVNE-UHFFFAOYSA-N -1 1 314.316 4.077 20 0 DIADMM [O-]c1ccc(-c2noc(-c3ccc(Cl)c(F)c3)n2)c(F)c1 ZINC000445463977 338033808 /nfs/dbraw/zinc/03/38/08/338033808.db2.gz RJLMICRZKOVIJF-UHFFFAOYSA-N -1 1 308.671 4.041 20 0 DIADMM C[C@@H](C(=O)[O-])[C@@H](NCc1ccc(F)cc1Cl)c1ccccc1 ZINC000426758007 338041092 /nfs/dbraw/zinc/04/10/92/338041092.db2.gz GJNALKCUEVPOAD-BDJLRTHQSA-N -1 1 321.779 4.031 20 0 DIADMM C[C@@H]1[C@H](C(=O)Nc2ccc([O-])c(Cl)c2)[C@H]1c1ccccc1 ZINC000435762624 338248231 /nfs/dbraw/zinc/24/82/31/338248231.db2.gz JJNZEHMDUHNETA-JQAFLVLXSA-N -1 1 301.773 4.034 20 0 DIADMM Cc1nc2ccc(NC(=O)c3cc4ccccc4cc3[O-])cc2o1 ZINC000436512533 338274677 /nfs/dbraw/zinc/27/46/77/338274677.db2.gz KLYLQROZURLMDE-UHFFFAOYSA-N -1 1 318.332 4.247 20 0 DIADMM Cc1ccc(C[C@@H](C)N(C)C(=O)c2ccc(Cl)cc2[O-])cc1 ZINC000436526954 338275126 /nfs/dbraw/zinc/27/51/26/338275126.db2.gz FZMYEOOCTJWNEC-CYBMUJFWSA-N -1 1 317.816 4.057 20 0 DIADMM Cc1ccc([C@H]2CCCCCN2C(=O)c2cc(F)ccc2[O-])o1 ZINC000436526345 338275181 /nfs/dbraw/zinc/27/51/81/338275181.db2.gz DFVFLQQCWQLAJP-OAHLLOKOSA-N -1 1 317.360 4.190 20 0 DIADMM Cc1cc(N(C)C)ccc1NC(=O)c1ccc2ccccc2c1[O-] ZINC000436533416 338275449 /nfs/dbraw/zinc/27/54/49/338275449.db2.gz ZHPZXJRTPBTNQQ-UHFFFAOYSA-N -1 1 320.392 4.172 20 0 DIADMM CCN(C(=O)c1ccc(C(C)C)cc1[O-])c1ccccc1OC ZINC000436533703 338275588 /nfs/dbraw/zinc/27/55/88/338275588.db2.gz NAVXLXPUYGOWIO-UHFFFAOYSA-N -1 1 313.397 4.191 20 0 DIADMM C[C@@H]1C[C@@H](c2ccccc2)CN1C(=O)c1ccc(Cl)cc1[O-] ZINC000436547581 338276447 /nfs/dbraw/zinc/27/64/47/338276447.db2.gz NUKFZXRHXJBVAZ-TZMCWYRMSA-N -1 1 315.800 4.064 20 0 DIADMM CN(CCc1ccc(Cl)cc1)C(=O)c1ccc(Cl)cc1[O-] ZINC000436546431 338276565 /nfs/dbraw/zinc/27/65/65/338276565.db2.gz KHNUQVFVOBQXOB-UHFFFAOYSA-N -1 1 324.207 4.014 20 0 DIADMM C[C@@H]1C[C@@H]2CCCC[C@@H]2N1C(=O)c1ccc2ccccc2c1[O-] ZINC000436551302 338276694 /nfs/dbraw/zinc/27/66/94/338276694.db2.gz MWSYOKNRRTUXBL-XUWXXGDYSA-N -1 1 309.409 4.339 20 0 DIADMM CC(C)N(Cc1cccc(F)c1)C(=O)c1ccc(Cl)cc1[O-] ZINC000436549765 338276720 /nfs/dbraw/zinc/27/67/20/338276720.db2.gz WVRHPBKJYPMLDN-UHFFFAOYSA-N -1 1 321.779 4.236 20 0 DIADMM C[C@H]1CN(C(=O)c2ccc3ccccc3c2[O-])[C@H]1c1ccccc1 ZINC000436574003 338277724 /nfs/dbraw/zinc/27/77/24/338277724.db2.gz KSDIFGFSRCYLBY-IFXJQAMLSA-N -1 1 317.388 4.379 20 0 DIADMM Cc1ccc([C@H]2C[C@H](C)CCN2C(=O)c2cc(F)ccc2[O-])o1 ZINC000436576386 338277990 /nfs/dbraw/zinc/27/79/90/338277990.db2.gz QZQHIOQQRCVDGP-IAQYHMDHSA-N -1 1 317.360 4.046 20 0 DIADMM O=C(Nc1ccccc1-c1cccs1)c1ccc(O)cc1[O-] ZINC000436595750 338279111 /nfs/dbraw/zinc/27/91/11/338279111.db2.gz NTUWWXBDWBUVCV-UHFFFAOYSA-N -1 1 311.362 4.079 20 0 DIADMM CC[C@H](C)n1ncc(NC(=O)c2cc3ccccc3cc2[O-])c1C ZINC000436598094 338279281 /nfs/dbraw/zinc/27/92/81/338279281.db2.gz XYJPJJQYYBVOSA-LBPRGKRZSA-N -1 1 323.396 4.274 20 0 DIADMM CC(C)c1cccnc1NC(=O)c1ccc2ccccc2c1[O-] ZINC000436612601 338279926 /nfs/dbraw/zinc/27/99/26/338279926.db2.gz YEMPZDYFDSKOBL-UHFFFAOYSA-N -1 1 306.365 4.316 20 0 DIADMM Cc1ccccc1C[C@@H](C)N(C)C(=O)c1cc(Cl)ccc1[O-] ZINC000436708316 338283547 /nfs/dbraw/zinc/28/35/47/338283547.db2.gz RVGOYJBOZDUKOY-CYBMUJFWSA-N -1 1 317.816 4.057 20 0 DIADMM O=C(Nc1scnc1C1CC1)c1ccc2ccccc2c1[O-] ZINC000436714971 338283842 /nfs/dbraw/zinc/28/38/42/338283842.db2.gz NTRZWBCZAGLDMK-UHFFFAOYSA-N -1 1 310.378 4.132 20 0 DIADMM C[C@@H]1CCN(C(=O)c2ccc(Cl)cc2[O-])[C@@H](c2ccco2)C1 ZINC000436728280 338284412 /nfs/dbraw/zinc/28/44/12/338284412.db2.gz JQVUIKZYJPLEIZ-BXUZGUMPSA-N -1 1 319.788 4.252 20 0 DIADMM O=C(Nc1cccc2[nH]ccc21)c1cc2ccccc2cc1[O-] ZINC000436736343 338284785 /nfs/dbraw/zinc/28/47/85/338284785.db2.gz OLXMLWDHTKXADA-UHFFFAOYSA-N -1 1 302.333 4.279 20 0 DIADMM C[C@H](CN(C)C(=O)c1cc2ccccc2cc1[O-])c1ccccc1 ZINC000436741291 338285049 /nfs/dbraw/zinc/28/50/49/338285049.db2.gz SFAPWOYOFXTMIO-OAHLLOKOSA-N -1 1 319.404 4.421 20 0 DIADMM CCN(Cc1ccccc1C)C(=O)c1ccc(Cl)cc1[O-] ZINC000436761350 338286184 /nfs/dbraw/zinc/28/61/84/338286184.db2.gz YIYDILNBQAEGJV-UHFFFAOYSA-N -1 1 303.789 4.016 20 0 DIADMM O=C(Nc1ccc(-c2cnc(C3CC3)o2)cc1)c1ccccc1[O-] ZINC000436762117 338286217 /nfs/dbraw/zinc/28/62/17/338286217.db2.gz QPIXWRAEUIIXTB-UHFFFAOYSA-N -1 1 320.348 4.177 20 0 DIADMM C[C@@H]1CCC[C@H](N(C)C(=O)c2ccc(C(F)(F)F)cc2[O-])C1 ZINC000436764685 338286431 /nfs/dbraw/zinc/28/64/31/338286431.db2.gz SMWCYMBGHOMXHO-PWSUYJOCSA-N -1 1 315.335 4.062 20 0 DIADMM CC1(C)CN(C(=O)c2ccc(Cl)cc2[O-])[C@H]1c1cccs1 ZINC000436847581 338289806 /nfs/dbraw/zinc/28/98/06/338289806.db2.gz QZHCWGZSVDFPMQ-AWEZNQCLSA-N -1 1 321.829 4.330 20 0 DIADMM O=C(c1ccccc1[O-])N1C[C@H](c2ccccc2)c2ccccc21 ZINC000436857691 338290194 /nfs/dbraw/zinc/29/01/94/338290194.db2.gz BRSXAMWCALBXID-GOSISDBHSA-N -1 1 315.372 4.185 20 0 DIADMM Cc1cc(NC(=O)c2ccccc2[O-])ccc1-c1ccncc1 ZINC000436858061 338290280 /nfs/dbraw/zinc/29/02/80/338290280.db2.gz CYPPPNANVDDXSM-UHFFFAOYSA-N -1 1 304.349 4.015 20 0 DIADMM CC1(C)CC[C@H](NC(=O)c2ccc([O-])cc2F)c2ccccc21 ZINC000436868879 338290681 /nfs/dbraw/zinc/29/06/81/338290681.db2.gz IUSVQINTSJNLDP-KRWDZBQOSA-N -1 1 313.372 4.074 20 0 DIADMM Cc1sccc1Cc1nc(-c2ccc([O-])cc2Cl)no1 ZINC000436873482 338291032 /nfs/dbraw/zinc/29/10/32/338291032.db2.gz ZVNNJZIYVOQNIA-UHFFFAOYSA-N -1 1 306.774 4.056 20 0 DIADMM Cc1oc2ccccc2c1-c1nc(-c2ccc([O-])c(F)c2)no1 ZINC000436877310 338291315 /nfs/dbraw/zinc/29/13/15/338291315.db2.gz FYMGUKKGEFCNKI-UHFFFAOYSA-N -1 1 310.284 4.303 20 0 DIADMM C[C@H]1[C@@H](c2nc(-c3ccc([O-])cc3F)no2)[C@H]1c1ccccc1 ZINC000436878140 338291343 /nfs/dbraw/zinc/29/13/43/338291343.db2.gz IMTFVBJBGHEHCJ-UHNFBRDESA-N -1 1 310.328 4.098 20 0 DIADMM COc1cccc([C@H](C)NC(=O)c2ccc3ccccc3c2[O-])c1 ZINC000436905505 338292897 /nfs/dbraw/zinc/29/28/97/338292897.db2.gz AHBCRYOZFRRQTO-ZDUSSCGKSA-N -1 1 321.376 4.045 20 0 DIADMM COc1ccc(N(CCC(C)C)C(=O)c2ccccc2[O-])cc1 ZINC000436906971 338293088 /nfs/dbraw/zinc/29/30/88/338293088.db2.gz FOMAXZAQCYZDOI-UHFFFAOYSA-N -1 1 313.397 4.094 20 0 DIADMM Cc1[nH]c2ccc(-c3noc(-c4cc(F)ccc4[O-])n3)cc2c1C ZINC000436919211 338293503 /nfs/dbraw/zinc/29/35/03/338293503.db2.gz MRSBOZOBUHNQRN-UHFFFAOYSA-N -1 1 323.327 4.346 20 0 DIADMM [O-]c1ccc(F)cc1-c1nc(-c2ccccc2C(F)(F)F)no1 ZINC000437002068 338297419 /nfs/dbraw/zinc/29/74/19/338297419.db2.gz QMBCBLJZKZURGJ-UHFFFAOYSA-N -1 1 324.233 4.267 20 0 DIADMM CCn1c(C(=O)Nc2ccc([O-])c(Cl)c2)cc2ccccc21 ZINC000440944898 338400226 /nfs/dbraw/zinc/40/02/26/338400226.db2.gz YVVLHPYSOQOBOH-UHFFFAOYSA-N -1 1 314.772 4.273 20 0 DIADMM CCc1cc(=O)[n-]c(SCc2cc(Cl)sc2Cl)n1 ZINC000450914391 338712213 /nfs/dbraw/zinc/71/22/13/338712213.db2.gz XDUIQARPDLQSBS-UHFFFAOYSA-N -1 1 321.254 4.405 20 0 DIADMM C[C@H]1CCc2sc(C(=O)Nc3ccc([O-])c(F)c3F)cc2C1 ZINC000456781446 338940469 /nfs/dbraw/zinc/94/04/69/338940469.db2.gz DFDDJVJWFXJHEM-QMMMGPOBSA-N -1 1 323.364 4.109 20 0 DIADMM Cc1c(F)cccc1[N-]S(=O)(=O)c1cccc(C(C)C)c1 ZINC000467077615 339225874 /nfs/dbraw/zinc/22/58/74/339225874.db2.gz BUGHKRDFNNSTHA-UHFFFAOYSA-N -1 1 307.390 4.058 20 0 DIADMM Cc1ccc(F)cc1[N-]S(=O)(=O)c1ccccc1C(C)C ZINC000468515668 339265202 /nfs/dbraw/zinc/26/52/02/339265202.db2.gz KGRFVWJKXYQHJU-UHFFFAOYSA-N -1 1 307.390 4.058 20 0 DIADMM Cc1cc(C(=O)Nc2ccc([O-])c(Cl)c2)c(C(F)(F)F)o1 ZINC000474520004 339418136 /nfs/dbraw/zinc/41/81/36/339418136.db2.gz YASDSPKUOZOHAF-UHFFFAOYSA-N -1 1 319.666 4.218 20 0 DIADMM CC(C)c1ccc2nc(-c3cc([O-])cc(Cl)c3)[nH]c(=O)c2c1 ZINC000487474999 339754783 /nfs/dbraw/zinc/75/47/83/339754783.db2.gz OYZPFCZLYCBKIG-UHFFFAOYSA-N -1 1 314.772 4.485 20 0 DIADMM Cc1ccc([N-]S(=O)(=O)c2csc3ccccc32)c(F)c1 ZINC000506584390 340197161 /nfs/dbraw/zinc/19/71/61/340197161.db2.gz LCMJUJYYSVBFGX-UHFFFAOYSA-N -1 1 321.398 4.150 20 0 DIADMM [O-]c1cccc(CN(Cc2ccccc2F)C2CC2)c1Cl ZINC000507022060 340205557 /nfs/dbraw/zinc/20/55/57/340205557.db2.gz MVEAUAMHIYHOMP-UHFFFAOYSA-N -1 1 305.780 4.349 20 0 DIADMM Cc1cccc([N-]S(=O)(=O)c2csc3ccccc32)c1F ZINC000507907410 340235569 /nfs/dbraw/zinc/23/55/69/340235569.db2.gz VNIKGHAIAGWEDI-UHFFFAOYSA-N -1 1 321.398 4.150 20 0 DIADMM Cc1cccc(C2(C(=O)Nc3ccc([O-])c(Cl)c3)CC2)c1 ZINC000509172108 340263082 /nfs/dbraw/zinc/26/30/82/340263082.db2.gz OHVXEAKLCUHJOU-UHFFFAOYSA-N -1 1 301.773 4.024 20 0 DIADMM Cc1cccc(C)c1[N-]S(=O)(=O)c1cccc(C(C)C)c1 ZINC000172882530 340345451 /nfs/dbraw/zinc/34/54/51/340345451.db2.gz HKDRNOJYPSUGNU-UHFFFAOYSA-N -1 1 303.427 4.228 20 0 DIADMM Cc1[nH]c2ccccc2c1C(=O)Nc1ccc([O-])c(Cl)c1 ZINC000182861457 340485612 /nfs/dbraw/zinc/48/56/12/340485612.db2.gz OGJOJEFEGAPTIC-UHFFFAOYSA-N -1 1 300.745 4.088 20 0 DIADMM CC(C)Oc1ccc(NC(=O)Nc2ccc([O-])c(Cl)c2)cc1 ZINC000190941675 340548313 /nfs/dbraw/zinc/54/83/13/340548313.db2.gz DCXZNSZLLQOFAH-UHFFFAOYSA-N -1 1 320.776 4.477 20 0 DIADMM [O-]c1ccc(F)cc1-c1nc(-c2ccc3ccccc3c2)no1 ZINC000322906094 340706711 /nfs/dbraw/zinc/70/67/11/340706711.db2.gz IIDTWSXDTJIZGG-UHFFFAOYSA-N -1 1 306.296 4.402 20 0 DIADMM CC[C@@H](C)c1ccc(S(=O)(=O)[N-]c2cc(O)ccc2C)cc1 ZINC000530144679 340780677 /nfs/dbraw/zinc/78/06/77/340780677.db2.gz JVJPNZDBVPXAEV-GFCCVEGCSA-N -1 1 319.426 4.015 20 0 DIADMM Cc1ccc(S(=O)(=O)[N-]c2c(C)cc(C)cc2C)c(Cl)c1 ZINC000538008006 340806991 /nfs/dbraw/zinc/80/69/91/340806991.db2.gz AHYSKCUPYQMPCW-UHFFFAOYSA-N -1 1 323.845 4.374 20 0 DIADMM Cc1ccc2[nH]c(C(=O)Nc3ccc([O-])c(Cl)c3)cc2c1 ZINC000542817340 341021973 /nfs/dbraw/zinc/02/19/73/341021973.db2.gz SEAOBAKZNDSAEQ-UHFFFAOYSA-N -1 1 300.745 4.088 20 0 DIADMM CC(C)c1ccccc1OCC(=O)Nc1ccc([O-])c(Cl)c1 ZINC000543745714 341056435 /nfs/dbraw/zinc/05/64/35/341056435.db2.gz OEWCDFJBYQOMHO-UHFFFAOYSA-N -1 1 319.788 4.187 20 0 DIADMM C[C@H](c1cccc(Cl)c1)N(C)C(=O)c1cc(F)ccc1[O-] ZINC000132892764 341148667 /nfs/dbraw/zinc/14/86/67/341148667.db2.gz KXCYNDACOKXRFM-SNVBAGLBSA-N -1 1 307.752 4.018 20 0 DIADMM C[C@@H]1C[C@H]1c1noc(-c2cc(Oc3ccccc3)ccc2[O-])n1 ZINC000547187792 341200430 /nfs/dbraw/zinc/20/04/30/341200430.db2.gz UOCYAUBYVOHESX-BXUZGUMPSA-N -1 1 308.337 4.358 20 0 DIADMM C[C@H](C(=O)Nc1ccc([O-])c(Cl)c1)c1c(F)cccc1F ZINC000134406295 341214783 /nfs/dbraw/zinc/21/47/83/341214783.db2.gz IJXSYTTZFOAUBC-QMMMGPOBSA-N -1 1 311.715 4.066 20 0 DIADMM O=C(Nc1cccc2cc[nH]c21)c1ccc2ccccc2c1[O-] ZINC000548144855 341249167 /nfs/dbraw/zinc/24/91/67/341249167.db2.gz ZAIJAWBWAWHGHK-UHFFFAOYSA-N -1 1 302.333 4.279 20 0 DIADMM COc1cc(-c2nc3ccc(C(C)C)cc3c(=O)[n-]2)ccc1C ZINC000549920433 341306532 /nfs/dbraw/zinc/30/65/32/341306532.db2.gz UUPORZLHUKUJQU-UHFFFAOYSA-N -1 1 308.381 4.443 20 0 DIADMM O=c1cc(C(F)F)nc(S[C@H]2CCc3ccc(F)cc32)[n-]1 ZINC000568568127 341675198 /nfs/dbraw/zinc/67/51/98/341675198.db2.gz HDNTYIDXVPGUNT-NSHDSACASA-N -1 1 312.316 4.039 20 0 DIADMM CC[C@H](C)[C@H](NCc1ccc(-c2ccc(Cl)cc2)o1)C(=O)[O-] ZINC000683170794 1035657359 /nfs/dbraw/zinc/65/73/59/1035657359.db2.gz AUNZHKIFUWVWRX-ZBEGNZNMSA-N -1 1 321.804 4.189 20 0 DIADMM COc1ccccc1-c1noc(-c2ccc3ccccc3c2[O-])n1 ZINC000109037301 1035740631 /nfs/dbraw/zinc/74/06/31/1035740631.db2.gz ZIVRIAMGCSRAIK-UHFFFAOYSA-N -1 1 318.332 4.271 20 0 DIADMM Cc1ccc2cc(C(=O)Nc3ccc([O-])c(Cl)c3)[nH]c2c1 ZINC000182861551 1035901316 /nfs/dbraw/zinc/90/13/16/1035901316.db2.gz LHFNNXPSIVXVMW-UHFFFAOYSA-N -1 1 300.745 4.088 20 0 DIADMM CC(C)Sc1ccc(Cl)cc1NC(=O)c1cncc([O-])c1 ZINC000339927378 1036064432 /nfs/dbraw/zinc/06/44/32/1036064432.db2.gz SSXWBAPLQWSEJW-UHFFFAOYSA-N -1 1 322.817 4.193 20 0 DIADMM CC[C@@H](C)N(CC(=O)[O-])Cc1sc2ccccc2c1Cl ZINC000037599168 1036120844 /nfs/dbraw/zinc/12/08/44/1036120844.db2.gz NMMXHZABCAEIFQ-SNVBAGLBSA-N -1 1 311.834 4.240 20 0 DIADMM C[C@H](c1ccc(Cl)cc1Cl)N1CCC(CC(=O)[O-])CC1 ZINC000093682460 1036388241 /nfs/dbraw/zinc/38/82/41/1036388241.db2.gz UWODBNRBVURDOE-SNVBAGLBSA-N -1 1 316.228 4.241 20 0 DIADMM CC(C)[C@@H]1N(C(=O)c2ccc(F)c([O-])c2)CC12CCCCCC2 ZINC001648894886 1036677533 /nfs/dbraw/zinc/67/75/33/1036677533.db2.gz VAACXFNPZUWFDG-KRWDZBQOSA-N -1 1 319.420 4.352 20 0 DIADMM CC=C(C)Nc1ccc(C([O-])(C(F)(F)F)C(F)(F)F)cc1 ZINC001210795019 1036976562 /nfs/dbraw/zinc/97/65/62/1036976562.db2.gz PZRPIXOCMVOTES-FPYGCLRLSA-N -1 1 313.241 4.334 20 0 DIADMM CC(C)C[C@H](NCc1ccc(-c2ccc(Cl)cc2)o1)C(=O)[O-] ZINC000113401661 1037223706 /nfs/dbraw/zinc/22/37/06/1037223706.db2.gz MXVXGKZOSGKVDJ-HNNXBMFYSA-N -1 1 321.804 4.189 20 0 DIADMM CCc1nc(S[C@H](C)c2c(F)cccc2F)[n-]c(=O)c1C ZINC000580660966 1037240882 /nfs/dbraw/zinc/24/08/82/1037240882.db2.gz YRYBDWFPEFTZSN-SECBINFHSA-N -1 1 310.369 4.185 20 0 DIADMM O=C(/C=C/c1csc(-c2ccccc2)n1)c1ccc([O-])cc1 ZINC000023715279 1037257093 /nfs/dbraw/zinc/25/70/93/1037257093.db2.gz QORCOCBUUGZTBP-DHZHZOJOSA-N -1 1 307.374 4.412 20 0 DIADMM [O-]c1c(Cl)c(Cl)ccc1Nc1cc(F)c(O)cc1F ZINC001215573352 1037382985 /nfs/dbraw/zinc/38/29/85/1037382985.db2.gz GSRHBBGVBUZVAB-UHFFFAOYSA-N -1 1 306.095 4.426 20 0 DIADMM CCc1[nH]ccc1C(=O)Nc1cc(Cl)c([O-])c2ccccc12 ZINC001167444397 1037421483 /nfs/dbraw/zinc/42/14/83/1037421483.db2.gz CGKCQFSNYCPJMT-UHFFFAOYSA-N -1 1 314.772 4.342 20 0 DIADMM Cc1ccc(S(=O)(=O)[N-]c2c(C)cc(C)cc2Cl)s1 ZINC000096659510 1037477182 /nfs/dbraw/zinc/47/71/82/1037477182.db2.gz GEXKWKYHTULPFJ-UHFFFAOYSA-N -1 1 315.847 4.128 20 0 DIADMM Cc1ccc2cccc(C(=O)Nc3ccc([O-])c(Cl)c3)c2n1 ZINC000157820174 1037553914 /nfs/dbraw/zinc/55/39/14/1037553914.db2.gz RFEZFJSCDBTSKV-UHFFFAOYSA-N -1 1 312.756 4.155 20 0 DIADMM O=C([O-])c1ccc(Cl)c(CN2CCC(c3ccco3)CC2)c1 ZINC000656756512 1037840355 /nfs/dbraw/zinc/84/03/55/1037840355.db2.gz FLOYOGWDMZJYSV-UHFFFAOYSA-N -1 1 319.788 4.011 20 0 DIADMM Cc1cc(-c2nc3scc(C4CCCCC4)c3c(=O)[n-]2)no1 ZINC000684559703 1038272699 /nfs/dbraw/zinc/27/26/99/1038272699.db2.gz YQRIEYYXJKOXRK-UHFFFAOYSA-N -1 1 315.398 4.408 20 0 DIADMM CCN(c1ccc(C(=O)Nc2c([O-])cccc2F)cc1)C(C)C ZINC000605438047 1038516650 /nfs/dbraw/zinc/51/66/50/1038516650.db2.gz CEJFODNMKOUGOJ-UHFFFAOYSA-N -1 1 316.376 4.018 20 0 DIADMM O=C(CCCc1ccc(Cl)cc1)Nc1c([O-])cccc1F ZINC000605434651 1038516889 /nfs/dbraw/zinc/51/68/89/1038516889.db2.gz AZMDFHSNGNGINB-UHFFFAOYSA-N -1 1 307.752 4.146 20 0 DIADMM CC[N@@H+](Cc1cccc(F)c1)[C@H](C)c1cc(C(=O)[O-])c(C)o1 ZINC000515855541 1038645124 /nfs/dbraw/zinc/64/51/24/1038645124.db2.gz HMTRXCIPDWJFRJ-LLVKDONJSA-N -1 1 305.349 4.008 20 0 DIADMM CCN(Cc1cccc(F)c1)[C@H](C)c1cc(C(=O)[O-])c(C)o1 ZINC000515855541 1038645126 /nfs/dbraw/zinc/64/51/26/1038645126.db2.gz HMTRXCIPDWJFRJ-LLVKDONJSA-N -1 1 305.349 4.008 20 0 DIADMM C[C@H]1Cc2ccccc2N1C(=O)c1ccc(C(F)(F)F)c([O-])c1 ZINC000684871145 1038667800 /nfs/dbraw/zinc/66/78/00/1038667800.db2.gz WLDNGFSQBUBODG-JTQLQIEISA-N -1 1 321.298 4.002 20 0 DIADMM O=C(CCCCCc1cccs1)Nc1c([O-])cccc1F ZINC000608366573 1038829688 /nfs/dbraw/zinc/82/96/88/1038829688.db2.gz MWHMXKUFNLPPMW-UHFFFAOYSA-N -1 1 307.390 4.334 20 0 DIADMM O=C(Nc1c([O-])cccc1F)[C@H]1C[C@@H]1c1ccc2ccccc2c1 ZINC000608366340 1038829787 /nfs/dbraw/zinc/82/97/87/1038829787.db2.gz SBWBKZUNECOKAS-CVEARBPZSA-N -1 1 321.351 4.427 20 0 DIADMM O=C(Nc1c([O-])cccc1F)C1CCC(c2ccccc2)CC1 ZINC000608367548 1038830480 /nfs/dbraw/zinc/83/04/80/1038830480.db2.gz VUPJNJWZXGYHQV-UHFFFAOYSA-N -1 1 313.372 4.444 20 0 DIADMM COCOc1ccccc1Nc1cc(Cl)cc(Cl)c1[O-] ZINC001211564436 1039084707 /nfs/dbraw/zinc/08/47/07/1039084707.db2.gz CKHNHVCXTGTXEP-UHFFFAOYSA-N -1 1 314.168 4.425 20 0 DIADMM CCc1nc(SCc2cccc(OC(C)C)c2)[n-]c(=O)c1C ZINC000574703205 1039117087 /nfs/dbraw/zinc/11/70/87/1039117087.db2.gz ATHOKKNOZBGDCL-UHFFFAOYSA-N -1 1 318.442 4.133 20 0 DIADMM [O-]c1c(F)cc(Nc2cc(OC(F)(F)F)ccc2F)cc1F ZINC001213379150 1039194522 /nfs/dbraw/zinc/19/45/22/1039194522.db2.gz AQTNOZMKLAJGMG-UHFFFAOYSA-N -1 1 323.192 4.452 20 0 DIADMM CCc1nc(SCc2cc(OC)ccc2Cl)[n-]c(=O)c1C ZINC000583945698 1039515506 /nfs/dbraw/zinc/51/55/06/1039515506.db2.gz DBBYBCYKEIHYQZ-UHFFFAOYSA-N -1 1 324.833 4.007 20 0 DIADMM Cc1c(CN2[C@H](C)CC[C@@H]2C(=O)[O-])sc2c1cccc2Cl ZINC000650796463 1039608391 /nfs/dbraw/zinc/60/83/91/1039608391.db2.gz VACJTAACEVBALT-NOZJJQNGSA-N -1 1 323.845 4.301 20 0 DIADMM Cc1ncoc1C(=O)[N-]c1cc(Cl)ccc1SC(C)C ZINC000081684170 1039722897 /nfs/dbraw/zinc/72/28/97/1039722897.db2.gz BUWRBKQQBYDEJE-UHFFFAOYSA-N -1 1 310.806 4.389 20 0 DIADMM CCc1ccc(NC(=O)c2ccc(C(F)(F)F)c([O-])c2)cc1 ZINC001290075156 1040141567 /nfs/dbraw/zinc/14/15/67/1040141567.db2.gz OGWCIGSBODCIAF-UHFFFAOYSA-N -1 1 309.287 4.226 20 0 DIADMM CSc1cc(C)ccc1[N-]C(=O)c1nnc(C(C)(C)C)s1 ZINC000413892741 1040692404 /nfs/dbraw/zinc/69/24/04/1040692404.db2.gz GGRHHNGJYWCMPG-UHFFFAOYSA-N -1 1 321.471 4.118 20 0 DIADMM COCOc1ccc(Nc2c(Cl)ccc([O-])c2Cl)cc1 ZINC001211641992 1041184224 /nfs/dbraw/zinc/18/42/24/1041184224.db2.gz LUVLNORJTWIBSP-UHFFFAOYSA-N -1 1 314.168 4.425 20 0 DIADMM Cc1cc(CCCC(=O)Nc2c([O-])cccc2F)c(C)s1 ZINC000084631947 1041340978 /nfs/dbraw/zinc/34/09/78/1041340978.db2.gz MZTMNEKCDSNEQV-UHFFFAOYSA-N -1 1 307.390 4.171 20 0 DIADMM [O-]c1ccc(Cl)c(-c2ncnc3c(F)c(F)ccc32)c1F ZINC001244540186 1041389104 /nfs/dbraw/zinc/38/91/04/1041389104.db2.gz SHVUOZLGUSRYSK-UHFFFAOYSA-N -1 1 310.662 4.073 20 0 DIADMM COCc1cccc(OC(=O)c2cc3cc(Cl)sc3[n-]2)c1 ZINC000810581973 1041409318 /nfs/dbraw/zinc/40/93/18/1041409318.db2.gz BVQSKTPGRWTPGX-UHFFFAOYSA-N -1 1 321.785 4.248 20 0 DIADMM CN(C)c1ccc(NCc2cccc([O-])c2Cl)cc1Cl ZINC000328196315 1041427607 /nfs/dbraw/zinc/42/76/07/1041427607.db2.gz DZMLCPXKMZVVMG-UHFFFAOYSA-N -1 1 311.212 4.377 20 0 DIADMM [O-]c1cccc(CNc2ccc(OC(F)F)c(F)c2)c1Cl ZINC000328440253 1041436928 /nfs/dbraw/zinc/43/69/28/1041436928.db2.gz DOOFNCKBHRPRDK-UHFFFAOYSA-N -1 1 317.694 4.398 20 0 DIADMM O=C([N-]OC1CCCC1)C1(Cc2cccs2)CCCCC1 ZINC000810890514 1041463244 /nfs/dbraw/zinc/46/32/44/1041463244.db2.gz KWZLGRMDYCKESN-UHFFFAOYSA-N -1 1 307.459 4.232 20 0 DIADMM O=C(CC/C=C/c1ccccc1)Nc1cc([O-])c(F)cc1F ZINC001625894073 1041501949 /nfs/dbraw/zinc/50/19/49/1041501949.db2.gz QRASSASFFGZIOI-XBXARRHUSA-N -1 1 303.308 4.103 20 0 DIADMM Cc1ccccc1C[C@H](C)NC(=O)c1ccc2ccccc2c1[O-] ZINC001626287575 1041593372 /nfs/dbraw/zinc/59/33/72/1041593372.db2.gz CPDRGEUCLNSZBR-HNNXBMFYSA-N -1 1 319.404 4.215 20 0 DIADMM O=C([N-]OC/C=C/Cl)C1(Cc2cccs2)CCCCC1 ZINC000812409281 1041621749 /nfs/dbraw/zinc/62/17/49/1041621749.db2.gz OZTGUFPDDZHJOY-WEVVVXLNSA-N -1 1 313.850 4.041 20 0 DIADMM C[C@H](c1ccc(Cl)cc1Cl)N1CCC[C@H](CC(=O)[O-])C1 ZINC000086757024 1041741164 /nfs/dbraw/zinc/74/11/64/1041741164.db2.gz HERAGZXLIRHKEL-GHMZBOCLSA-N -1 1 316.228 4.241 20 0 DIADMM C[C@@H]([N-]C(=O)C(F)F)c1ccc(Cl)c(Cl)c1Cl ZINC001125947835 1041805349 /nfs/dbraw/zinc/80/53/49/1041805349.db2.gz YCLRVIVIYYDQDZ-SCSAIBSYSA-N -1 1 302.535 4.089 20 0 DIADMM C/C=C(\CC)C(=O)Nc1c([O-])cc(Br)cc1Cl ZINC000816590502 1042066409 /nfs/dbraw/zinc/06/64/09/1042066409.db2.gz CBPITCCVHZEBQQ-XVNBXDOJSA-N -1 1 318.598 4.103 20 0 DIADMM O=C(Nc1ccc(Cl)c(Cl)c1)c1ccc(F)c([O-])c1 ZINC001135678970 1042079460 /nfs/dbraw/zinc/07/94/60/1042079460.db2.gz HWTHQHBCMVLPRV-UHFFFAOYSA-N -1 1 300.116 4.090 20 0 DIADMM Cc1cccc(NC(=O)c2ccc3ccc(O)cc3c2[O-])c1C ZINC001135881216 1042103938 /nfs/dbraw/zinc/10/39/38/1042103938.db2.gz VVIZIBWDMGKDOJ-UHFFFAOYSA-N -1 1 307.349 4.120 20 0 DIADMM [O-]c1ccc(Cl)c(Nc2c[nH]c3ncc(F)cc23)c1Cl ZINC001159656696 1042110480 /nfs/dbraw/zinc/11/04/80/1042110480.db2.gz XKEQVKZHRYOZLD-UHFFFAOYSA-N -1 1 312.131 4.458 20 0 DIADMM CC(C)[C@H](NC(=O)c1ccc(Cl)cc1[O-])c1ccccc1 ZINC001135978433 1042121742 /nfs/dbraw/zinc/12/17/42/1042121742.db2.gz OVTDJRQOWCYSPO-INIZCTEOSA-N -1 1 303.789 4.173 20 0 DIADMM CCCc1cc(=O)n(-c2ccc(SC(F)(F)F)cc2)[n-]1 ZINC001245923329 1042180874 /nfs/dbraw/zinc/18/08/74/1042180874.db2.gz FHVXFXALTZJOOQ-UHFFFAOYSA-N -1 1 302.321 4.142 20 0 DIADMM CC(C)c1ccc2c(c1)CCCN2C(=O)c1cc(F)ccc1[O-] ZINC001136296884 1042204420 /nfs/dbraw/zinc/20/44/20/1042204420.db2.gz YWDMCVQQZHYBNS-UHFFFAOYSA-N -1 1 313.372 4.248 20 0 DIADMM Cc1cccc([C@@H](NC(=O)c2ccc(F)c([O-])c2)C(C)(C)C)c1 ZINC001136356327 1042222608 /nfs/dbraw/zinc/22/26/08/1042222608.db2.gz UXWOWVDGDMVNJK-QGZVFWFLSA-N -1 1 315.388 4.357 20 0 DIADMM CCCN(CC1CCCCC1)C(=O)c1ccc(Cl)cc1[O-] ZINC001136368981 1042225580 /nfs/dbraw/zinc/22/55/80/1042225580.db2.gz STYDCMLTDLSRPG-UHFFFAOYSA-N -1 1 309.837 4.478 20 0 DIADMM CC[C@H]([NH2+][C@@H](C)c1nc(C)cc(=O)[nH]1)c1ccc(Cl)s1 ZINC000279045013 1042263544 /nfs/dbraw/zinc/26/35/44/1042263544.db2.gz GJSTYWYALVKTRC-UWVGGRQHSA-N -1 1 311.838 4.007 20 0 DIADMM CC(C)(C)[C@H]1CCCC[C@H]1CNC(=O)c1cc(F)ccc1[O-] ZINC001136512635 1042268172 /nfs/dbraw/zinc/26/81/72/1042268172.db2.gz FOXYFMQTFSSKFO-WFASDCNBSA-N -1 1 307.409 4.114 20 0 DIADMM O=C(Nc1ccc([O-])c(F)c1F)c1cc(C2CC2)oc1C1CC1 ZINC000821981310 1042270291 /nfs/dbraw/zinc/27/02/91/1042270291.db2.gz ZNWPVYCNVGKJFD-UHFFFAOYSA-N -1 1 319.307 4.271 20 0 DIADMM Cc1ccc(Nc2ccc(F)c(Br)c2[O-])cc1O ZINC001211703623 1042313254 /nfs/dbraw/zinc/31/32/54/1042313254.db2.gz QRJVNMTYPCVCIG-UHFFFAOYSA-N -1 1 312.138 4.051 20 0 DIADMM O=C(Cc1ccc([O-])c(Cl)c1)N1CCCC2(CCCCC2)C1 ZINC001136674144 1042313719 /nfs/dbraw/zinc/31/37/19/1042313719.db2.gz WTYZEWXOUNNMAG-UHFFFAOYSA-N -1 1 321.848 4.161 20 0 DIADMM CC(C)[C@@H]1CCCN(C(=O)c2ccc3ccccc3c2[O-])CC1 ZINC000391312868 1042319032 /nfs/dbraw/zinc/31/90/32/1042319032.db2.gz KFEODFOVITZOPR-OAHLLOKOSA-N -1 1 311.425 4.444 20 0 DIADMM O=c1oc2cc([O-])ccc2cc1Nc1ccc(C2CC2)cc1F ZINC001213459540 1042351584 /nfs/dbraw/zinc/35/15/84/1042351584.db2.gz BNDITRHWHLCNGA-UHFFFAOYSA-N -1 1 311.312 4.259 20 0 DIADMM CCn1ncc2ccc(NCc3cccc([O-])c3Cl)cc21 ZINC000645166449 1042454370 /nfs/dbraw/zinc/45/43/70/1042454370.db2.gz LKQPUFAGFGVHBI-UHFFFAOYSA-N -1 1 301.777 4.027 20 0 DIADMM CCc1cccc(CC)c1[N-]S(=O)(=O)c1cc(C)sc1C ZINC000216471733 1042496322 /nfs/dbraw/zinc/49/63/22/1042496322.db2.gz GBYAZGQTKRXXJR-UHFFFAOYSA-N -1 1 323.483 4.291 20 0 DIADMM CC[C@H](Cc1ccccc1C)C(=O)Nc1ccc([O-])c(F)c1F ZINC000424860180 1042754023 /nfs/dbraw/zinc/75/40/23/1042754023.db2.gz BMOGAALKNLBASR-GFCCVEGCSA-N -1 1 319.351 4.186 20 0 DIADMM Cc1oc(CN(C)[C@@H]2CCc3ccc(Cl)cc32)cc1C(=O)[O-] ZINC000518990579 1042928450 /nfs/dbraw/zinc/92/84/50/1042928450.db2.gz KWNKZIWUTUSWOO-MRXNPFEDSA-N -1 1 319.788 4.059 20 0 DIADMM COc1ccccc1[C@H]1CCCN1Cc1cc(F)c([O-])c(F)c1 ZINC000093008509 1042973311 /nfs/dbraw/zinc/97/33/11/1042973311.db2.gz VSJPZWOGXFBNST-MRXNPFEDSA-N -1 1 319.351 4.016 20 0 DIADMM Cc1ccc([C@H](CC(=O)[O-])NCc2ccc(C(C)C)cc2)o1 ZINC000426769036 1042979964 /nfs/dbraw/zinc/97/99/64/1042979964.db2.gz FKKZVNFIGSMMND-INIZCTEOSA-N -1 1 301.386 4.017 20 0 DIADMM C[C@H](NC(=O)c1c(F)ccc([O-])c1F)c1ccc(C2CC2)cc1 ZINC000416294748 1043015394 /nfs/dbraw/zinc/01/53/94/1043015394.db2.gz YVHVFUYRPNDWHV-JTQLQIEISA-N -1 1 317.335 4.039 20 0 DIADMM CSc1ccccc1S(=O)(=O)[N-]c1c(C)cc(C)cc1C ZINC000188239899 1043018248 /nfs/dbraw/zinc/01/82/48/1043018248.db2.gz SKOKKKNDKBUGGH-UHFFFAOYSA-N -1 1 321.467 4.135 20 0 DIADMM Cc1cc(CSc2nc(C)c(C3CC3)c(=O)[n-]2)cc(Cl)n1 ZINC000865373230 1043088043 /nfs/dbraw/zinc/08/80/43/1043088043.db2.gz LGGMUCOJFFFTQD-UHFFFAOYSA-N -1 1 321.833 4.017 20 0 DIADMM CC[C@H](C)CO[N-]C(=O)[C@@H](C)c1ccc2cc(OC)ccc2c1 ZINC000794848579 1043108760 /nfs/dbraw/zinc/10/87/60/1043108760.db2.gz BZMJDKLNASXRDS-KBPBESRZSA-N -1 1 315.413 4.046 20 0 DIADMM Cc1cc(Br)c([O-])c(NC(=O)C[C@H]2C=CCCC2)c1 ZINC000428026777 1043321144 /nfs/dbraw/zinc/32/11/44/1043321144.db2.gz FTXGNBSTDSNZIC-NSHDSACASA-N -1 1 324.218 4.148 20 0 DIADMM O=S(=O)([N-]c1ccc2ccoc2c1)c1ccc(C(F)F)cc1 ZINC000558038344 1043426334 /nfs/dbraw/zinc/42/63/34/1043426334.db2.gz WJWBGVXVABXZEK-UHFFFAOYSA-N -1 1 323.320 4.171 20 0 DIADMM CCOc1cc(-c2nc(-c3cccs3)no2)cc(Cl)c1[O-] ZINC000191158222 1043536203 /nfs/dbraw/zinc/53/62/03/1043536203.db2.gz YRAHHCVHHWAFMX-UHFFFAOYSA-N -1 1 322.773 4.223 20 0 DIADMM C[C@H]1CN(C(=O)c2ccc3ccccc3c2[O-])c2ccccc21 ZINC000398491011 1043562684 /nfs/dbraw/zinc/56/26/84/1043562684.db2.gz DINQORUKGDKBAM-ZDUSSCGKSA-N -1 1 303.361 4.309 20 0 DIADMM CC1(C)CCC(C)(CNC(=O)c2cc(Cl)ccc2[O-])CC1 ZINC001299418454 1043567026 /nfs/dbraw/zinc/56/70/26/1043567026.db2.gz ISNWEVLGLSGQHQ-UHFFFAOYSA-N -1 1 309.837 4.382 20 0 DIADMM Cc1cccc2c1CCN(C(=O)c1cc3ccccc3cc1[O-])C2 ZINC000729537342 1043568520 /nfs/dbraw/zinc/56/85/20/1043568520.db2.gz ACCADJQZWXUSBY-UHFFFAOYSA-N -1 1 317.388 4.052 20 0 DIADMM C[C@@H](c1cccs1)N(C)C(=O)NCc1ccc([O-])c(Cl)c1 ZINC000876393222 1043679404 /nfs/dbraw/zinc/67/94/04/1043679404.db2.gz JARFALSGURZVLU-JTQLQIEISA-N -1 1 324.833 4.010 20 0 DIADMM O=C(N[C@@H]1CCSc2ccccc21)c1c([O-])cccc1Cl ZINC000148329948 1043902327 /nfs/dbraw/zinc/90/23/27/1043902327.db2.gz MFVVZGRFQIQQRO-GFCCVEGCSA-N -1 1 319.813 4.013 20 0 DIADMM Cc1cccc(S(=O)(=O)[N-]c2ccc(C(C)(C)C)cc2)c1 ZINC000034379011 1043938416 /nfs/dbraw/zinc/93/84/16/1043938416.db2.gz SOOPRAMVNSASAN-UHFFFAOYSA-N -1 1 303.427 4.093 20 0 DIADMM O=C(CC[C@@H]1CCc2ccccc21)Nc1ccc([O-])c(F)c1F ZINC000880237019 1044023216 /nfs/dbraw/zinc/02/32/16/1044023216.db2.gz OMJZQBKQEVLNBU-LBPRGKRZSA-N -1 1 317.335 4.119 20 0 DIADMM CC(C)(CNC(=O)c1c(F)ccc([O-])c1F)C1CCCCC1 ZINC000561979995 1044041252 /nfs/dbraw/zinc/04/12/52/1044041252.db2.gz LZYUSJYIVMAHJK-UHFFFAOYSA-N -1 1 311.372 4.007 20 0 DIADMM Cc1cc(C(=O)[N-]c2c(F)cc(F)cc2F)c(C(F)(F)F)o1 ZINC000350412573 1044176227 /nfs/dbraw/zinc/17/62/27/1044176227.db2.gz LDCLXCYHQGDDGY-UHFFFAOYSA-N -1 1 323.192 4.276 20 0 DIADMM COc1ccc2oc([C@H](C)[N-]c3nnc(C(F)F)o3)c(C)c2c1 ZINC000292509657 1044178949 /nfs/dbraw/zinc/17/89/49/1044178949.db2.gz OGOLHBIILIWXER-QMMMGPOBSA-N -1 1 323.299 4.244 20 0 DIADMM O=C([O-])CCC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1 ZINC000086755677 1044236629 /nfs/dbraw/zinc/23/66/29/1044236629.db2.gz YKJZHMZKRUAOEW-UHFFFAOYSA-N -1 1 316.228 4.070 20 0 DIADMM CC[C@@H](c1ccc(F)cc1)N(C)Cc1cc(C(=O)[O-])c(C)o1 ZINC000563282597 1044243027 /nfs/dbraw/zinc/24/30/27/1044243027.db2.gz RJLCDGGRXFAMHO-INIZCTEOSA-N -1 1 305.349 4.008 20 0 DIADMM [O-]c1cccc(CN[C@@H]2c3ccccc3CC[C@H]2F)c1Cl ZINC000883381200 1044291494 /nfs/dbraw/zinc/29/14/94/1044291494.db2.gz IPJGYRKGPAASOO-RHSMWYFYSA-N -1 1 305.780 4.161 20 0 DIADMM CC1(C)CN(Cc2cccc([O-])c2Cl)[C@@H]1c1ccncc1 ZINC000293810555 1044331122 /nfs/dbraw/zinc/33/11/22/1044331122.db2.gz FCLZIEUESAVRFZ-MRXNPFEDSA-N -1 1 302.805 4.024 20 0 DIADMM Cc1cc(Br)c([O-])c(NC(=O)/C=C/C(C)(C)C)c1 ZINC000778446667 1044404619 /nfs/dbraw/zinc/40/46/19/1044404619.db2.gz AVINJOPQGOEQAT-AATRIKPKSA-N -1 1 312.207 4.004 20 0 DIADMM CCC(=CC(=O)Nc1cc(C)cc(Br)c1[O-])CC ZINC000778447426 1044406187 /nfs/dbraw/zinc/40/61/87/1044406187.db2.gz SRRDAWLTAOITIQ-UHFFFAOYSA-N -1 1 312.207 4.148 20 0 DIADMM C[C@@]1(C2CCCCC2)CCN1C(=O)Cc1ccc([O-])c(Cl)c1 ZINC001302917748 1044415317 /nfs/dbraw/zinc/41/53/17/1044415317.db2.gz ZXLYTEPKEAHMEJ-SFHVURJKSA-N -1 1 321.848 4.159 20 0 DIADMM O=c1cc(C(F)F)nc(SCc2sccc2Cl)[n-]1 ZINC000565803229 1044457903 /nfs/dbraw/zinc/45/79/03/1044457903.db2.gz SWEAFDQLQGDJAZ-UHFFFAOYSA-N -1 1 308.762 4.127 20 0 DIADMM O=C([O-])c1ccc(CN2CCCC[C@H]2c2cc3ccccc3[nH]2)o1 ZINC000565956606 1044466583 /nfs/dbraw/zinc/46/65/83/1044466583.db2.gz IJKZHDYETKYOLC-KRWDZBQOSA-N -1 1 324.380 4.186 20 0 DIADMM CC1(C(=O)Nc2cc(F)c([O-])cc2Cl)CCC(F)(F)CC1 ZINC000885679572 1044584346 /nfs/dbraw/zinc/58/43/46/1044584346.db2.gz CGUKZEGJPLQOFF-UHFFFAOYSA-N -1 1 321.726 4.339 20 0 DIADMM Cc1nc(C2CC2)ccc1C(=O)Nc1cc(F)c([O-])cc1Cl ZINC000885677795 1044584923 /nfs/dbraw/zinc/58/49/23/1044584923.db2.gz ADQUBWZCTBEIGI-UHFFFAOYSA-N -1 1 320.751 4.018 20 0 DIADMM O=c1cc(C(F)F)nc(SCc2cc(Cl)ccc2F)[n-]1 ZINC000568448803 1044627540 /nfs/dbraw/zinc/62/75/40/1044627540.db2.gz CDACKMRLSGWXIA-UHFFFAOYSA-N -1 1 320.723 4.205 20 0 DIADMM CCOc1cc(-c2noc(/C=C\C3CCC3)n2)cc(Cl)c1[O-] ZINC000445411380 1044712766 /nfs/dbraw/zinc/71/27/66/1044712766.db2.gz JHMYNWXMQOJXJT-SREVYHEPSA-N -1 1 320.776 4.308 20 0 DIADMM CCOc1cc(-c2noc(-c3ccsc3)n2)cc(Cl)c1[O-] ZINC000445409184 1044713464 /nfs/dbraw/zinc/71/34/64/1044713464.db2.gz AGROFPZUZAGGHG-UHFFFAOYSA-N -1 1 322.773 4.223 20 0 DIADMM CCOc1cc(-c2noc([C@H](C)C3CC3)n2)cc(Cl)c1[O-] ZINC000445430030 1044716522 /nfs/dbraw/zinc/71/65/22/1044716522.db2.gz HLFNSEHDIQTJFA-MRVPVSSYSA-N -1 1 308.765 4.008 20 0 DIADMM CCOc1cc(-c2noc(C(CC)CC)n2)cc(Cl)c1[O-] ZINC000445431076 1044716827 /nfs/dbraw/zinc/71/68/27/1044716827.db2.gz MIVCXYSBMFAFAQ-UHFFFAOYSA-N -1 1 310.781 4.398 20 0 DIADMM COc1cc(-c2nc(-c3ccc([O-])cc3Cl)no2)ccc1C ZINC000445445977 1044723314 /nfs/dbraw/zinc/72/33/14/1044723314.db2.gz KMCFCFBLDBHXBF-UHFFFAOYSA-N -1 1 316.744 4.080 20 0 DIADMM [O-]c1ccc(-c2noc(CCCc3cccs3)n2)c(Cl)c1 ZINC000445446573 1044724046 /nfs/dbraw/zinc/72/40/46/1044724046.db2.gz FBDRQVUSXUEBHK-UHFFFAOYSA-N -1 1 320.801 4.332 20 0 DIADMM Cc1ccsc1[C@@H]1C[C@@H]1c1nc(-c2ccc([O-])cc2F)no1 ZINC000445464871 1044725978 /nfs/dbraw/zinc/72/59/78/1044725978.db2.gz VXADHQUPMJPZRO-NEPJUHHUSA-N -1 1 316.357 4.222 20 0 DIADMM [O-]c1ccc(-c2noc([C@H](F)Cc3ccccc3)n2)c(Cl)c1 ZINC000445446086 1044726085 /nfs/dbraw/zinc/72/60/85/1044726085.db2.gz CIWBPOIPFMJOQK-CQSZACIVSA-N -1 1 318.735 4.349 20 0 DIADMM C/C(=C\c1ccc(F)cc1)c1nc(-c2ccc([O-])c(F)c2)no1 ZINC000445472301 1044728058 /nfs/dbraw/zinc/72/80/58/1044728058.db2.gz KBOSMKPKFRPJPP-CSKARUKUSA-N -1 1 314.291 4.281 20 0 DIADMM C[C@@H](Cc1cccc(F)c1)c1nc(-c2ccc([O-])c(F)c2)no1 ZINC000445479341 1044730160 /nfs/dbraw/zinc/73/01/60/1044730160.db2.gz VPNGDXMPVNNGCO-JTQLQIEISA-N -1 1 316.307 4.067 20 0 DIADMM Cc1ccc(CCCc2nc(-c3ccc([O-])c(F)c3)no2)cc1 ZINC000445478076 1044730514 /nfs/dbraw/zinc/73/05/14/1044730514.db2.gz PTEXJOXBKMTIGW-UHFFFAOYSA-N -1 1 312.344 4.065 20 0 DIADMM C[C@H](c1nc(-c2ccc([O-])c(F)c2)no1)c1cccc(Cl)c1 ZINC000445486098 1044731591 /nfs/dbraw/zinc/73/15/91/1044731591.db2.gz IITQVGDVRBCJKS-VIFPVBQESA-N -1 1 318.735 4.387 20 0 DIADMM Cc1ccccc1[C@H](C)Cc1nc(-c2ccc([O-])c(F)c2)no1 ZINC000445482658 1044731735 /nfs/dbraw/zinc/73/17/35/1044731735.db2.gz SZKAZESXSDLITB-GFCCVEGCSA-N -1 1 312.344 4.236 20 0 DIADMM Cc1c2ccccc2oc1-c1nc(-c2ccc([O-])c(F)c2)no1 ZINC000445485030 1044732102 /nfs/dbraw/zinc/73/21/02/1044732102.db2.gz ZQTAWCZKMILBOR-UHFFFAOYSA-N -1 1 310.284 4.303 20 0 DIADMM Cc1ccc(C[C@@H](C)c2nc(-c3ccc([O-])c(F)c3)no2)cc1 ZINC000445483165 1044732232 /nfs/dbraw/zinc/73/22/32/1044732232.db2.gz RMASLYNPWHZQIW-GFCCVEGCSA-N -1 1 312.344 4.236 20 0 DIADMM CC(C)(C)c1nc(-c2nc(-c3ccc([O-])c(F)c3)no2)cs1 ZINC000445476301 1044734926 /nfs/dbraw/zinc/73/49/26/1044734926.db2.gz AXTXBAUXUFDNMI-UHFFFAOYSA-N -1 1 319.361 4.002 20 0 DIADMM Cc1oc(CN(C)[C@@H](C)c2cc3ccccc3o2)cc1C(=O)[O-] ZINC000570286275 1044747815 /nfs/dbraw/zinc/74/78/15/1044747815.db2.gz GRAZYHQMCKJQQY-NSHDSACASA-N -1 1 313.353 4.225 20 0 DIADMM CC(C)(c1noc(-c2ccc([O-])cc2F)n1)c1cccc(F)c1 ZINC000445618140 1044775838 /nfs/dbraw/zinc/77/58/38/1044775838.db2.gz JXLGRLNFEHWWPX-UHFFFAOYSA-N -1 1 316.307 4.046 20 0 DIADMM CC(C)(Cc1ccccc1)c1noc(-c2ccc([O-])cc2F)n1 ZINC000445775590 1044812494 /nfs/dbraw/zinc/81/24/94/1044812494.db2.gz KCITYZUOEUTONE-UHFFFAOYSA-N -1 1 312.344 4.102 20 0 DIADMM CCCCOc1cccc(NC(=O)c2c(F)ccc([O-])c2F)c1 ZINC000575587441 1045003454 /nfs/dbraw/zinc/00/34/54/1045003454.db2.gz MMPFVCPQZOBDTO-UHFFFAOYSA-N -1 1 321.323 4.102 20 0 DIADMM Cc1ccsc1S(=O)(=O)[N-]c1c(C)c(C)ccc1Cl ZINC000446958300 1045074790 /nfs/dbraw/zinc/07/47/90/1045074790.db2.gz QHDNVWGONPAGGZ-UHFFFAOYSA-N -1 1 315.847 4.128 20 0 DIADMM Oc1cc(Cl)c(C[N@@H+]2C[C@H]3[C@H](CCC3(F)F)C2)c(Cl)c1 ZINC001142105625 1045082441 /nfs/dbraw/zinc/08/24/41/1045082441.db2.gz HYQKRMZDOFOABQ-KCJUWKMLSA-N -1 1 322.182 4.176 20 0 DIADMM C[C@@H]([C@H](C)NC(=O)c1c(F)ccc([O-])c1F)C1CCCCC1 ZINC000577562292 1045137547 /nfs/dbraw/zinc/13/75/47/1045137547.db2.gz YBPMBCROKBJTNQ-QWRGUYRKSA-N -1 1 311.372 4.005 20 0 DIADMM O=C1[N-]C(=S)SC1=Cc1ccccc1OC1CCCC1 ZINC000048984765 1045295020 /nfs/dbraw/zinc/29/50/20/1045295020.db2.gz LJECKKIRMGQCMQ-LCYFTJDESA-N -1 1 305.424 4.337 20 0 DIADMM Cc1c(C(=O)/C=C/c2ccc([O-])c(Cl)c2)cnn1C(C)(C)C ZINC000188873742 1045340846 /nfs/dbraw/zinc/34/08/46/1045340846.db2.gz DJFQAWSQAXEMKZ-FNORWQNLSA-N -1 1 318.804 4.202 20 0 DIADMM O=C(Nc1cc(Cl)c([O-])c2ccccc12)[C@H]1C[C@@H]1C1CC1 ZINC000529539038 1045490499 /nfs/dbraw/zinc/49/04/99/1045490499.db2.gz ODMHZNFHMOGDFM-OLZOCXBDSA-N -1 1 301.773 4.183 20 0 DIADMM O=C(C[C@@H]1CCCCO1)Nc1cc(Cl)c([O-])c2ccccc12 ZINC000529540284 1045491210 /nfs/dbraw/zinc/49/12/10/1045491210.db2.gz XDMWAFRFUGOKQK-NSHDSACASA-N -1 1 319.788 4.097 20 0 DIADMM CC[C@@H](C)Oc1ccc(C(=O)Nc2ccc([O-])c(Cl)c2)cc1 ZINC000750305582 1045518580 /nfs/dbraw/zinc/51/85/80/1045518580.db2.gz IJHMKVBVZWQMFX-LLVKDONJSA-N -1 1 319.788 4.475 20 0 DIADMM O=C([N-]c1cc(F)ccc1F)c1oc(C2CC2)nc1C(F)F ZINC001120878169 1045549662 /nfs/dbraw/zinc/54/96/62/1045549662.db2.gz YNUQXWIVORNRJG-UHFFFAOYSA-N -1 1 314.238 4.020 20 0 DIADMM COc1c(F)cc(NCc2c([O-])ccc(Cl)c2F)cc1F ZINC000190839947 1045617708 /nfs/dbraw/zinc/61/77/08/1045617708.db2.gz FJSYKACONYTILZ-UHFFFAOYSA-N -1 1 317.694 4.084 20 0 DIADMM CC(C)c1csc2nc(-c3coc(C4CCC4)n3)[n-]c(=O)c12 ZINC000630385555 1045755826 /nfs/dbraw/zinc/75/58/26/1045755826.db2.gz PASOWCAXJXOSJM-UHFFFAOYSA-N -1 1 315.398 4.443 20 0 DIADMM CC(C)CN(CC(=O)[O-])Cc1ccc(-c2ccc(Cl)cc2)o1 ZINC000901591258 1045773884 /nfs/dbraw/zinc/77/38/84/1045773884.db2.gz ZBARFAGCEONAFG-UHFFFAOYSA-N -1 1 321.804 4.143 20 0 DIADMM Cc1cc(C)c(/C=C/CN[C@@H](C(=O)[O-])c2cccs2)c(C)c1 ZINC000901597891 1045774764 /nfs/dbraw/zinc/77/47/64/1045774764.db2.gz JPYDNIATUYAFLN-UKINESCASA-N -1 1 315.438 4.102 20 0 DIADMM Cc1ccc([C@H](C)N(C)C(=O)Cc2ccc([O-])c(Cl)c2)cc1 ZINC000630695979 1045775746 /nfs/dbraw/zinc/77/57/46/1045775746.db2.gz BXGNFCYNBFRRTR-ZDUSSCGKSA-N -1 1 317.816 4.116 20 0 DIADMM CC(C)N(Cc1cccs1)C(=O)Cc1ccc([O-])c(Cl)c1 ZINC000630819290 1045783386 /nfs/dbraw/zinc/78/33/86/1045783386.db2.gz DJUWPXFJYIBWSP-UHFFFAOYSA-N -1 1 323.845 4.087 20 0 DIADMM Cc1nc(SCc2csc(C(C)C)n2)[n-]c(=O)c1C1CC1 ZINC000631025171 1045797677 /nfs/dbraw/zinc/79/76/77/1045797677.db2.gz QUNTVIKIULSBFZ-UHFFFAOYSA-N -1 1 321.471 4.240 20 0 DIADMM CC(C)C(=O)c1ccc([C@@H](C)C(=O)[N-]OC2CCCCC2)cc1 ZINC000801955877 1045861837 /nfs/dbraw/zinc/86/18/37/1045861837.db2.gz XPIOFFQIEVYYLQ-CQSZACIVSA-N -1 1 317.429 4.009 20 0 DIADMM C[C@H]1C[C@@H]1c1ccc(CNCc2ccc(C(=O)[O-])c(Cl)c2)o1 ZINC000902107970 1045914288 /nfs/dbraw/zinc/91/42/88/1045914288.db2.gz IDCBRPACRPONJK-HZMBPMFUSA-N -1 1 319.788 4.044 20 0 DIADMM CCc1oc(CN[C@H](CC)c2cccc(Cl)c2)cc1C(=O)[O-] ZINC000902109728 1045915328 /nfs/dbraw/zinc/91/53/28/1045915328.db2.gz UGUWVIMYVONYPE-OAHLLOKOSA-N -1 1 321.804 4.435 20 0 DIADMM O=C(Nc1ccc(F)cc1[O-])c1cc2cc(Cl)ccc2o1 ZINC000531756344 1045915823 /nfs/dbraw/zinc/91/58/23/1045915823.db2.gz RDHFDYHXGPUIGG-UHFFFAOYSA-N -1 1 305.692 4.183 20 0 DIADMM Cc1oc(C(=O)[O-])cc1CN[C@H](C)c1oc2ccccc2c1C ZINC000902158720 1045927714 /nfs/dbraw/zinc/92/77/14/1045927714.db2.gz DKCWNUWDSLMNFT-LLVKDONJSA-N -1 1 313.353 4.192 20 0 DIADMM Cc1ccc(NC(=O)Nc2cc([O-])c(F)cc2F)cc1Cl ZINC001202808979 1045929787 /nfs/dbraw/zinc/92/97/87/1045929787.db2.gz IYBMWRPBNICLSK-UHFFFAOYSA-N -1 1 312.703 4.276 20 0 DIADMM O=C(Nc1ccc([O-])c(Cl)c1)[C@@H]1CC[C@@H]1c1ccc(F)cc1 ZINC001137674425 1045931066 /nfs/dbraw/zinc/93/10/66/1045931066.db2.gz TXOQFGUUPPJRBV-ZIAGYGMSSA-N -1 1 319.763 4.317 20 0 DIADMM CC(C)Sc1ccc([C@@H](C)NCc2ccc(C(=O)[O-])o2)cc1 ZINC000902221180 1045947934 /nfs/dbraw/zinc/94/79/34/1045947934.db2.gz OMCYUOLJTLOFPH-GFCCVEGCSA-N -1 1 319.426 4.329 20 0 DIADMM CCc1oc(CN[C@@H](C)c2cc(C)cc(C)c2)cc1C(=O)[O-] ZINC000902236291 1045954353 /nfs/dbraw/zinc/95/43/53/1045954353.db2.gz RHAODNVUBGGQEZ-ZDUSSCGKSA-N -1 1 301.386 4.008 20 0 DIADMM Cc1cc(Br)c([O-])c(NC(=O)/C=C2\CC[C@H](C)C2)c1 ZINC001137838849 1045980203 /nfs/dbraw/zinc/98/02/03/1045980203.db2.gz XHCIATQQNHVHTF-OHMLCJAVSA-N -1 1 324.218 4.148 20 0 DIADMM CC(C)(C)C(F)(F)CN[C@@H]1CCC[C@H](CCCC(=O)[O-])C1 ZINC000902470946 1046003161 /nfs/dbraw/zinc/00/31/61/1046003161.db2.gz VQZINYJEUVOUEN-CHWSQXEVSA-N -1 1 305.409 4.071 20 0 DIADMM O=C(NCC1(C2CCCCC2)CCCCC1)c1cncc([O-])c1 ZINC001137954508 1046030295 /nfs/dbraw/zinc/03/02/95/1046030295.db2.gz MPFGQVGEEZSBQV-UHFFFAOYSA-N -1 1 316.445 4.048 20 0 DIADMM CC[C@@H]1Cc2ccccc2CN1C(=O)c1c([O-])cccc1Cl ZINC001138069180 1046083228 /nfs/dbraw/zinc/08/32/28/1046083228.db2.gz GYHHXLKDMMZZTO-CQSZACIVSA-N -1 1 315.800 4.023 20 0 DIADMM CC(C)Oc1ccccc1[C@@H](C)NCc1cccc(C(=O)[O-])c1 ZINC000666573587 1046376682 /nfs/dbraw/zinc/37/66/82/1046376682.db2.gz WQGUCCXKLUDHIH-CQSZACIVSA-N -1 1 313.397 4.023 20 0 DIADMM O=C1[N-]C(=S)SC1=Cc1ncc(-c2ccccc2)s1 ZINC000092198135 1046377481 /nfs/dbraw/zinc/37/74/81/1046377481.db2.gz UTBHPAJSXMIVII-TWGQIWQCSA-N -1 1 304.421 4.139 20 0 DIADMM O=S(=O)([N-]c1ccc(Cl)cc1)c1cccc(C(F)F)c1 ZINC000780363921 1046383297 /nfs/dbraw/zinc/38/32/97/1046383297.db2.gz YSFJVSHEAGQJCX-UHFFFAOYSA-N -1 1 317.744 4.078 20 0 DIADMM Cc1ccc(C)c([N-]S(=O)(=O)c2cccc(C(F)F)c2)c1 ZINC000780363919 1046383477 /nfs/dbraw/zinc/38/34/77/1046383477.db2.gz YNYZVYYXRPVJLM-UHFFFAOYSA-N -1 1 311.353 4.042 20 0 DIADMM COCOc1cccc(Nc2cc(Cl)cc(Cl)c2[O-])c1 ZINC001212901019 1046501386 /nfs/dbraw/zinc/50/13/86/1046501386.db2.gz KOOKQROPIIILOM-UHFFFAOYSA-N -1 1 314.168 4.425 20 0 DIADMM CSc1ccc(S(=O)(=O)[N-]c2ccc(C3CC3)cc2)cc1 ZINC000678479272 1046643505 /nfs/dbraw/zinc/64/35/05/1046643505.db2.gz SMRVKKDYNPLKRH-UHFFFAOYSA-N -1 1 319.451 4.087 20 0 DIADMM COc1ccc(Nc2cc([O-])c(F)c(F)c2)cc1OC(C)C ZINC001203021197 1046643451 /nfs/dbraw/zinc/64/34/51/1046643451.db2.gz WOCVKPSFJZLTPH-UHFFFAOYSA-N -1 1 309.312 4.210 20 0 DIADMM C[C@@H](CCCc1ccccc1)C(=O)Nc1c([O-])cccc1F ZINC000678864205 1046723458 /nfs/dbraw/zinc/72/34/58/1046723458.db2.gz OUURLEIOGFJPGK-ZDUSSCGKSA-N -1 1 301.361 4.129 20 0 DIADMM CCCC[C@@H](C)N(C)C(=O)c1ccc(C(F)(F)F)c([O-])c1 ZINC000644646250 1046730592 /nfs/dbraw/zinc/73/05/92/1046730592.db2.gz UHWJTCLXWFXVHM-SNVBAGLBSA-N -1 1 303.324 4.062 20 0 DIADMM [O-]c1cccc(CN[C@@H](c2ccccc2)c2cccnc2)c1Cl ZINC000645151888 1046770679 /nfs/dbraw/zinc/77/06/79/1046770679.db2.gz CDFUTFOHIAMYJI-IBGZPJMESA-N -1 1 324.811 4.320 20 0 DIADMM COc1cccc(F)c1[C@@H](C)NCc1cccc([O-])c1Cl ZINC000645157047 1046770723 /nfs/dbraw/zinc/77/07/23/1046770723.db2.gz FPQQSHIOYMNIRQ-SNVBAGLBSA-N -1 1 309.768 4.044 20 0 DIADMM [O-]c1cccc(CN[C@@H](c2ccccc2)c2ccncc2)c1Cl ZINC000645150596 1046771043 /nfs/dbraw/zinc/77/10/43/1046771043.db2.gz HPPAILIWMJVPSL-IBGZPJMESA-N -1 1 324.811 4.320 20 0 DIADMM O=C(Cc1ccc2ccccc2c1)Nc1ccc([O-])c(F)c1F ZINC001140653197 1046834086 /nfs/dbraw/zinc/83/40/86/1046834086.db2.gz YUSFHWYLLIWFRL-UHFFFAOYSA-N -1 1 313.303 4.005 20 0 DIADMM CC(C)CN(C(=O)c1ccc([O-])c(F)c1)c1cccc(Cl)c1 ZINC001140759181 1046888981 /nfs/dbraw/zinc/88/89/81/1046888981.db2.gz NJHPZYWQBODTEY-UHFFFAOYSA-N -1 1 321.779 4.488 20 0 DIADMM [O-]c1c(F)cc(CN2CCC[C@H]2c2cccc(F)c2)cc1F ZINC001140990905 1046971289 /nfs/dbraw/zinc/97/12/89/1046971289.db2.gz CHEARPHIVWBBLR-INIZCTEOSA-N -1 1 307.315 4.147 20 0 DIADMM C[C@@H](C(=O)[N-]OC1CCCCC1)c1ccc(C(F)(F)F)cc1 ZINC000798997240 1046995408 /nfs/dbraw/zinc/99/54/08/1046995408.db2.gz VMOXIVCPCIRJEM-LLVKDONJSA-N -1 1 315.335 4.189 20 0 DIADMM O=C(Nc1ccc2c3c(cccc31)CC2)c1ccc([O-])c(F)c1 ZINC000681015669 1047083471 /nfs/dbraw/zinc/08/34/71/1047083471.db2.gz JPNDBZHRUWCWHD-UHFFFAOYSA-N -1 1 307.324 4.035 20 0 DIADMM CC(C)(C)[C@H](NC(=O)c1ccc([O-])c(F)c1)c1ccccc1 ZINC000681018790 1047084051 /nfs/dbraw/zinc/08/40/51/1047084051.db2.gz NZDRMIJIHLBMGZ-MRXNPFEDSA-N -1 1 301.361 4.049 20 0 DIADMM Cc1c2ccccc2oc1[C@@H](C)NC(=O)c1ccc([O-])c(F)c1 ZINC000681019551 1047085005 /nfs/dbraw/zinc/08/50/05/1047085005.db2.gz VRCCNMUYFJTUTD-LLVKDONJSA-N -1 1 313.328 4.077 20 0 DIADMM Cc1c2ccccc2oc1[C@H](C)NC(=O)c1ccc([O-])c(F)c1 ZINC000681019554 1047085817 /nfs/dbraw/zinc/08/58/17/1047085817.db2.gz VRCCNMUYFJTUTD-NSHDSACASA-N -1 1 313.328 4.077 20 0 DIADMM CSc1ccc(NC(=O)c2ccc([O-])c(F)c2)cc1Cl ZINC000681051509 1047087608 /nfs/dbraw/zinc/08/76/08/1047087608.db2.gz DRBBSBHEVUMASF-UHFFFAOYSA-N -1 1 311.765 4.159 20 0 DIADMM O=C(c1ccc([O-])c(F)c1)N1CCCC2(C1)CCCCCC2 ZINC000681049421 1047087996 /nfs/dbraw/zinc/08/79/96/1047087996.db2.gz JAJWBINIFKGFND-UHFFFAOYSA-N -1 1 305.393 4.108 20 0 DIADMM CCCC[C@H](C)N(CCCC)C(=O)c1cc(C)cc(C=O)c1[O-] ZINC001141324039 1047090644 /nfs/dbraw/zinc/09/06/44/1047090644.db2.gz RVWHPKUMCDDNRI-HNNXBMFYSA-N -1 1 319.445 4.334 20 0 DIADMM CCN(CC)c1ccc(Nc2cc3ccc([O-])cc3oc2=O)cc1 ZINC001212968907 1047116882 /nfs/dbraw/zinc/11/68/82/1047116882.db2.gz BIXOWKAIDVEPPD-UHFFFAOYSA-N -1 1 324.380 4.088 20 0 DIADMM CC[C@H](C)CO[N-]C(=O)[C@@H](CC)c1cccc(C(F)(F)F)c1 ZINC001141518566 1047158080 /nfs/dbraw/zinc/15/80/80/1047158080.db2.gz OLAHFWPKPMPJSP-FZMZJTMJSA-N -1 1 317.351 4.293 20 0 DIADMM CSc1ccc([O-])c(C(=O)Nc2ccc3[nH]c(C)cc3c2)c1 ZINC001141596934 1047211867 /nfs/dbraw/zinc/21/18/67/1047211867.db2.gz BMCNVUKDVUJHQI-UHFFFAOYSA-N -1 1 312.394 4.156 20 0 DIADMM O=C(c1c([O-])cccc1Cl)N1CCC(c2ccccc2)CC1 ZINC000148341727 1047283672 /nfs/dbraw/zinc/28/36/72/1047283672.db2.gz VEIPLDRMCSNNCR-UHFFFAOYSA-N -1 1 315.800 4.065 20 0 DIADMM CCOc1cc(-c2noc(CC3CCCC3)n2)cc(Cl)c1[O-] ZINC000445432885 1047316297 /nfs/dbraw/zinc/31/62/97/1047316297.db2.gz ZBGZJFITTSOEAA-UHFFFAOYSA-N -1 1 322.792 4.227 20 0 DIADMM CCC(CC)(C[N-]C(=O)C(F)(F)F)c1ccc(Cl)cc1 ZINC000725905028 1047329139 /nfs/dbraw/zinc/32/91/39/1047329139.db2.gz UAPCVGHQWQOURF-UHFFFAOYSA-N -1 1 307.743 4.076 20 0 DIADMM O=C(c1cc(F)ccc1[O-])N(Cc1ccccc1)c1ccccc1 ZINC001142019678 1047347303 /nfs/dbraw/zinc/34/73/03/1047347303.db2.gz UGULMBRGWAWLSD-UHFFFAOYSA-N -1 1 321.351 4.378 20 0 DIADMM CC(C)N(Cc1ccc(F)cc1)C(=O)c1cc(Cl)ccc1[O-] ZINC001142469754 1047459229 /nfs/dbraw/zinc/45/92/29/1047459229.db2.gz MJISPOASZUKZIW-UHFFFAOYSA-N -1 1 321.779 4.236 20 0 DIADMM CCCCCCO[C@@H](C)c1nc(-c2ccc([O-])c(F)c2)no1 ZINC000842497019 1047485999 /nfs/dbraw/zinc/48/59/99/1047485999.db2.gz KHEKIIFMFZVOOI-NSHDSACASA-N -1 1 308.353 4.239 20 0 DIADMM Cc1ccccc1[C@H](NC(=O)c1c([O-])cccc1F)C(C)(C)C ZINC001149184045 1047556228 /nfs/dbraw/zinc/55/62/28/1047556228.db2.gz VXAZPMNDJLDHKJ-KRWDZBQOSA-N -1 1 315.388 4.357 20 0 DIADMM O=C(Nc1cccc(C(F)(F)F)c1[O-])c1ccc2cc[nH]c2c1 ZINC001149217617 1047557183 /nfs/dbraw/zinc/55/71/83/1047557183.db2.gz OYNTUAODKCEKJS-UHFFFAOYSA-N -1 1 320.270 4.145 20 0 DIADMM CCc1cccc(CC)c1NC(=O)c1ccc2cccnc2c1[O-] ZINC001149322425 1047559386 /nfs/dbraw/zinc/55/93/86/1047559386.db2.gz MHZNNVZRXRGURO-UHFFFAOYSA-N -1 1 320.392 4.318 20 0 DIADMM CC(C)(C(=O)Nc1ccc([O-])c(Cl)c1)c1cccc(F)c1 ZINC000129619659 1047568998 /nfs/dbraw/zinc/56/89/98/1047568998.db2.gz GOBJXHARFWNJAH-UHFFFAOYSA-N -1 1 307.752 4.101 20 0 DIADMM CC(C)c1ccc(C(=O)Nc2cccc3ccncc32)c([O-])c1 ZINC001149818282 1047570315 /nfs/dbraw/zinc/57/03/15/1047570315.db2.gz CMIPIAQPODQHNY-UHFFFAOYSA-N -1 1 306.365 4.316 20 0 DIADMM C[C@@H](C(=O)Nc1ccc([O-])c(Cl)c1)c1ccc(Cl)cc1 ZINC001151582726 1047598766 /nfs/dbraw/zinc/59/87/66/1047598766.db2.gz MENYMXKZMXYZIA-SECBINFHSA-N -1 1 310.180 4.441 20 0 DIADMM O=C(Nc1cc(O)cc(Cl)c1)c1c([O-])ccc2ccccc21 ZINC001153505332 1047627033 /nfs/dbraw/zinc/62/70/33/1047627033.db2.gz UFXBELGXAVQZML-UHFFFAOYSA-N -1 1 313.740 4.157 20 0 DIADMM COc1cc(C)c(NC(=O)c2c([O-])ccc3ccccc32)cc1C ZINC001153504846 1047627104 /nfs/dbraw/zinc/62/71/04/1047627104.db2.gz PGCVOBQZXNUNMR-UHFFFAOYSA-N -1 1 321.376 4.423 20 0 DIADMM CCC1(CC)CCCN1C(=O)c1ccc2ccc(O)cc2c1[O-] ZINC001154140814 1047641199 /nfs/dbraw/zinc/64/11/99/1047641199.db2.gz BQYHHZUEUVDSFP-UHFFFAOYSA-N -1 1 313.397 4.046 20 0 DIADMM CC(C)(C)c1ccc2c(c1)CCN2C(=O)c1cccc([O-])c1F ZINC001154965102 1047663915 /nfs/dbraw/zinc/66/39/15/1047663915.db2.gz OPSCSKAZPUMUKB-UHFFFAOYSA-N -1 1 313.372 4.032 20 0 DIADMM CSc1ccccc1[C@H](C)NC(=O)c1cc(Cl)ccc1[O-] ZINC001155711748 1047687363 /nfs/dbraw/zinc/68/73/63/1047687363.db2.gz XFWYKJGLMDLMDN-JTQLQIEISA-N -1 1 321.829 4.259 20 0 DIADMM CCc1nc(S[C@@H](C)c2ccc(F)cc2F)[n-]c(=O)c1C ZINC000566498703 1047747226 /nfs/dbraw/zinc/74/72/26/1047747226.db2.gz LKCUYQKQCQCXBB-VIFPVBQESA-N -1 1 310.369 4.185 20 0 DIADMM CC[C@@H](Cc1cccc(C)c1)C(=O)Nc1ccc([O-])c(F)c1F ZINC001157811729 1047755708 /nfs/dbraw/zinc/75/57/08/1047755708.db2.gz PVVOJXRFTPLDIF-ZDUSSCGKSA-N -1 1 319.351 4.186 20 0 DIADMM CC(C)c1ncsc1C(=O)Nc1cc(F)c([O-])cc1Cl ZINC001157899408 1047763145 /nfs/dbraw/zinc/76/31/45/1047763145.db2.gz GUSMXCHCHHIXJA-UHFFFAOYSA-N -1 1 314.769 4.017 20 0 DIADMM O=C(Nc1cc(F)c([O-])cc1Cl)c1coc2ccccc21 ZINC001157899189 1047763455 /nfs/dbraw/zinc/76/34/55/1047763455.db2.gz BLYFUQDBPYJBOZ-UHFFFAOYSA-N -1 1 305.692 4.183 20 0 DIADMM C[C@@H](NC(=O)c1cccc([O-])c1F)c1csc2ccccc21 ZINC001158797996 1047799204 /nfs/dbraw/zinc/79/92/04/1047799204.db2.gz JILCKNLWUDBTFV-SNVBAGLBSA-N -1 1 315.369 4.237 20 0 DIADMM Cc1c(Cl)cc(Nc2cnn(CC3CC3)c2)c([O-])c1Cl ZINC001174470303 1047847556 /nfs/dbraw/zinc/84/75/56/1047847556.db2.gz VOPGZIIIDJSGGV-UHFFFAOYSA-N -1 1 312.200 4.358 20 0 DIADMM Nc1ncc(Nc2c(Cl)ccc([O-])c2Cl)cc1Cl ZINC001159655790 1047895199 /nfs/dbraw/zinc/89/51/99/1047895199.db2.gz HAPHZMYXHJAQFZ-UHFFFAOYSA-N -1 1 304.564 4.073 20 0 DIADMM O=C([O-])c1cc(Nc2ccc3c[nH]nc3c2)c(Cl)cc1Cl ZINC001159663389 1047897094 /nfs/dbraw/zinc/89/70/94/1047897094.db2.gz ZBZUNUBJIRHZJH-UHFFFAOYSA-N -1 1 322.151 4.312 20 0 DIADMM Cc1ccc(NC(=S)Nc2cc([O-])c(Cl)cc2F)cc1 ZINC001197923668 1047902393 /nfs/dbraw/zinc/90/23/93/1047902393.db2.gz XEZDENDWSIYEFU-UHFFFAOYSA-N -1 1 310.781 4.302 20 0 DIADMM C[C@H]1C[C@@H](CC(=O)Nc2nc(Cl)ccc2[O-])CC(C)(C)C1 ZINC001183210781 1047908967 /nfs/dbraw/zinc/90/89/67/1047908967.db2.gz YFMRETBQZMNMJG-QWRGUYRKSA-N -1 1 310.825 4.232 20 0 DIADMM CCCCN(C(=O)c1ccc(F)c([O-])c1)[C@H]1CCC[C@H](C)C1 ZINC001159892575 1047941984 /nfs/dbraw/zinc/94/19/84/1047941984.db2.gz QYFPFOIMNPHORR-ZFWWWQNUSA-N -1 1 307.409 4.352 20 0 DIADMM Cc1cccc(Cl)c1NC(=O)Nc1cc(Cl)ncc1[O-] ZINC001183720109 1047959670 /nfs/dbraw/zinc/95/96/70/1047959670.db2.gz YYVOQLKQXRDILY-UHFFFAOYSA-N -1 1 312.156 4.046 20 0 DIADMM O=c1oc2cc([O-])ccc2cc1Nc1ccc(C(F)(F)F)cc1 ZINC001174772160 1047966475 /nfs/dbraw/zinc/96/64/75/1047966475.db2.gz VEWVDGKRCHUHRQ-UHFFFAOYSA-N -1 1 321.254 4.261 20 0 DIADMM Nc1nc2cc(Nc3cc(F)c([O-])c(Cl)c3)ccc2s1 ZINC001160006505 1047966878 /nfs/dbraw/zinc/96/68/78/1047966878.db2.gz WOSWGAVGTQJNIC-UHFFFAOYSA-N -1 1 309.753 4.120 20 0 DIADMM O=C(Nc1cccc(C(F)(F)F)c1[O-])C1CCC2(CC2)CC1 ZINC001183882914 1047975322 /nfs/dbraw/zinc/97/53/22/1047975322.db2.gz YTVXDPIUJAYJIE-UHFFFAOYSA-N -1 1 313.319 4.320 20 0 DIADMM [O-]c1cc(F)cc(F)c1Nc1ccc(OC(F)(F)F)c(F)c1 ZINC001213021069 1047986521 /nfs/dbraw/zinc/98/65/21/1047986521.db2.gz NCZBNKDSOIPQMO-UHFFFAOYSA-N -1 1 323.192 4.452 20 0 DIADMM Cc1cccc(NC(=S)Nc2cc([O-])c(Cl)cc2F)c1 ZINC001198688109 1047997412 /nfs/dbraw/zinc/99/74/12/1047997412.db2.gz OETLLMXDJXGFKW-UHFFFAOYSA-N -1 1 310.781 4.302 20 0 DIADMM Cc1cc(Cl)ccc1[N-]S(=O)(=O)c1ccc2occc2c1 ZINC001198817100 1048009049 /nfs/dbraw/zinc/00/90/49/1048009049.db2.gz WJUILDJEYQFLKR-UHFFFAOYSA-N -1 1 321.785 4.195 20 0 DIADMM O=S(=O)([N-]c1ccccc1C1CC1)c1ccc2occc2c1 ZINC001198816371 1048010379 /nfs/dbraw/zinc/01/03/79/1048010379.db2.gz GOQUSSGHIHJPLR-UHFFFAOYSA-N -1 1 313.378 4.111 20 0 DIADMM O=S(=O)([N-]c1ccc(C2CC2)cc1)c1ccc2occc2c1 ZINC001198858771 1048012010 /nfs/dbraw/zinc/01/20/10/1048012010.db2.gz JGRABZKJRLIBRL-UHFFFAOYSA-N -1 1 313.378 4.111 20 0 DIADMM Cc1cc(Cl)cc([N-]S(=O)(=O)c2ccc3occc3c2)c1 ZINC001198861989 1048014753 /nfs/dbraw/zinc/01/47/53/1048014753.db2.gz OROLYURRVXITRO-UHFFFAOYSA-N -1 1 321.785 4.195 20 0 DIADMM Cc1cccc(Cl)c1NC(=O)Nc1c(F)cc([O-])cc1F ZINC001184542069 1048050729 /nfs/dbraw/zinc/05/07/29/1048050729.db2.gz WQLFKBTXVGOMEG-UHFFFAOYSA-N -1 1 312.703 4.276 20 0 DIADMM CCC(CC)(C(=O)Nc1cc([O-])c(F)cc1F)c1ccccc1 ZINC001160917397 1048096635 /nfs/dbraw/zinc/09/66/35/1048096635.db2.gz SMEIZJIKYDGKQR-UHFFFAOYSA-N -1 1 319.351 4.367 20 0 DIADMM O=C(Nc1cc([O-])c(F)cc1F)c1ccc2sccc2c1 ZINC001160916889 1048096659 /nfs/dbraw/zinc/09/66/59/1048096659.db2.gz OQNZVZKTQABRBV-UHFFFAOYSA-N -1 1 305.305 4.137 20 0 DIADMM C[C@@H](CCCc1ccccc1)C(=O)Nc1cc([O-])c(F)cc1F ZINC001160916597 1048097647 /nfs/dbraw/zinc/09/76/47/1048097647.db2.gz LEZDHIXROPAYDZ-LBPRGKRZSA-N -1 1 319.351 4.268 20 0 DIADMM CCOc1ccc(F)c(Nc2cc(F)c([O-])c(F)c2)c1F ZINC001175037848 1048102246 /nfs/dbraw/zinc/10/22/46/1048102246.db2.gz NHQWGAVUUMHEBA-UHFFFAOYSA-N -1 1 301.239 4.091 20 0 DIADMM CC(C)c1ccc2cc(C(=O)Nc3ccc(F)cc3[O-])[nH]c2c1 ZINC001161035270 1048104367 /nfs/dbraw/zinc/10/43/67/1048104367.db2.gz MKMYAIPILGYARZ-UHFFFAOYSA-N -1 1 312.344 4.388 20 0 DIADMM CCON(Cc1ccccc1)C(=O)c1ccc2ccccc2c1[O-] ZINC001161094823 1048109386 /nfs/dbraw/zinc/10/93/86/1048109386.db2.gz VUVSVZYOHNHLDD-UHFFFAOYSA-N -1 1 321.376 4.139 20 0 DIADMM COc1cc(Nc2ccc(Cl)c(Cl)c2[O-])cc(OC)c1 ZINC001175111686 1048122635 /nfs/dbraw/zinc/12/26/35/1048122635.db2.gz UCFDTTAOSWZXJR-UHFFFAOYSA-N -1 1 314.168 4.460 20 0 DIADMM CC1(C)CC[C@@H](C(=O)Nc2cccc(C(F)(F)F)c2[O-])C1 ZINC001185172356 1048140573 /nfs/dbraw/zinc/14/05/73/1048140573.db2.gz HMKQHHBNIMQYFB-SECBINFHSA-N -1 1 301.308 4.176 20 0 DIADMM [O-]c1c(Cl)cc(Cl)cc1Nc1c(F)cc(O)cc1F ZINC001175097611 1048142410 /nfs/dbraw/zinc/14/24/10/1048142410.db2.gz QPYZUIHIDTZEJX-UHFFFAOYSA-N -1 1 306.095 4.426 20 0 DIADMM C[C@H](CNC(=O)c1c([O-])cnc2ccc(Cl)cc21)C(C)(C)C ZINC001161819005 1048177787 /nfs/dbraw/zinc/17/77/87/1048177787.db2.gz KQZQUDMWYVYVTN-SNVBAGLBSA-N -1 1 320.820 4.006 20 0 DIADMM CC[C@@H](Nc1ccccc1)C(=O)Nc1cc(F)c([O-])cc1Cl ZINC001161866563 1048186421 /nfs/dbraw/zinc/18/64/21/1048186421.db2.gz WVVZHHCSWWCYAX-CYBMUJFWSA-N -1 1 322.767 4.014 20 0 DIADMM [O-]c1cc(NC(=S)Nc2cccc(Cl)c2)c(F)cc1F ZINC001201104955 1048190901 /nfs/dbraw/zinc/19/09/01/1048190901.db2.gz VZXWMASILATMOU-UHFFFAOYSA-N -1 1 314.744 4.133 20 0 DIADMM [O-]c1c(Nc2cccc(O[C@H]3CCCCO3)c2)ccc(F)c1F ZINC001175189347 1048193948 /nfs/dbraw/zinc/19/39/48/1048193948.db2.gz FGRVSJXUWIBAMH-HNNXBMFYSA-N -1 1 321.323 4.319 20 0 DIADMM CCc1ccccc1NC(=S)Nc1cccc([O-])c1Cl ZINC001201148367 1048200168 /nfs/dbraw/zinc/20/01/68/1048200168.db2.gz CPYCODYWKNJCMM-UHFFFAOYSA-N -1 1 306.818 4.417 20 0 DIADMM CCc1ccccc1NC(=S)Nc1ccc([O-])c(F)c1F ZINC001201144657 1048200903 /nfs/dbraw/zinc/20/09/03/1048200903.db2.gz BBOMBGIOGCWBJS-UHFFFAOYSA-N -1 1 308.353 4.042 20 0 DIADMM [O-]c1c(Cl)c(Cl)ccc1Nc1c(F)ccc(O)c1F ZINC001175267654 1048246612 /nfs/dbraw/zinc/24/66/12/1048246612.db2.gz FEGVHUZCFWJNEQ-UHFFFAOYSA-N -1 1 306.095 4.426 20 0 DIADMM Cc1nc(Cl)c(Nc2c(F)ccc([O-])c2Cl)c(Cl)n1 ZINC001250228500 1048264988 /nfs/dbraw/zinc/26/49/88/1048264988.db2.gz DDIAKNQBNTWXKB-UHFFFAOYSA-N -1 1 322.554 4.334 20 0 DIADMM CC[C@@H](NC(=O)c1ccc([O-])c(F)c1)c1ccc(C)cc1C ZINC001186232898 1048273146 /nfs/dbraw/zinc/27/31/46/1048273146.db2.gz AUHGPMOODHQEFS-MRXNPFEDSA-N -1 1 301.361 4.029 20 0 DIADMM CC(C)Cc1ccc([C@@H](C)NC(=O)c2ccc([O-])c(F)c2)cc1 ZINC001186242318 1048275656 /nfs/dbraw/zinc/27/56/56/1048275656.db2.gz HPNNSBXXMSMMDF-CYBMUJFWSA-N -1 1 315.388 4.221 20 0 DIADMM CC(C)(C)c1cc([N-]c2c(F)c(F)c(F)c(F)c2F)on1 ZINC001175383683 1048289375 /nfs/dbraw/zinc/28/93/75/1048289375.db2.gz NPEHTQSLZALGSU-UHFFFAOYSA-N -1 1 306.234 4.411 20 0 DIADMM CC(C)c1ccc([C@@H](C)NC(=O)c2ccc([O-])cc2F)cc1 ZINC001186339623 1048290163 /nfs/dbraw/zinc/29/01/63/1048290163.db2.gz LRXWZDBTRYETCE-GFCCVEGCSA-N -1 1 301.361 4.146 20 0 DIADMM O=C(NC1c2ccccc2-c2ccccc21)c1ccc([O-])cc1F ZINC001186337581 1048290734 /nfs/dbraw/zinc/29/07/34/1048290734.db2.gz MTSXNFSCDHSJGH-UHFFFAOYSA-N -1 1 319.335 4.031 20 0 DIADMM COc1ncc([N-]c2cc(-c3ccc(Cl)cc3)no2)s1 ZINC001175386726 1048293331 /nfs/dbraw/zinc/29/33/31/1048293331.db2.gz AKDOKBXWNASQBO-UHFFFAOYSA-N -1 1 307.762 4.204 20 0 DIADMM Cc1c(Cl)cc(Nc2cnc3n[nH]cc3c2)c([O-])c1Cl ZINC001175406526 1048298529 /nfs/dbraw/zinc/29/85/29/1048298529.db2.gz YARJCQFXKCOJIG-UHFFFAOYSA-N -1 1 309.156 4.022 20 0 DIADMM Cn1ncc2c1cccc2Nc1cc(Cl)c([O-])cc1Cl ZINC001175436627 1048306311 /nfs/dbraw/zinc/30/63/11/1048306311.db2.gz IDXKEQKWPAHVCX-UHFFFAOYSA-N -1 1 308.168 4.329 20 0 DIADMM CCCC[C@@H]1CCC[C@@H]1[N-]S(=O)(=O)c1cc2ccccc2o1 ZINC001186540782 1048316537 /nfs/dbraw/zinc/31/65/37/1048316537.db2.gz LTINPXZHVRCJCM-HIFRSBDPSA-N -1 1 321.442 4.070 20 0 DIADMM CCCC[C@H]1CCC[C@@H]1[N-]S(=O)(=O)c1cc2ccccc2o1 ZINC001186540784 1048317148 /nfs/dbraw/zinc/31/71/48/1048317148.db2.gz LTINPXZHVRCJCM-ZFWWWQNUSA-N -1 1 321.442 4.070 20 0 DIADMM C[S@](=O)c1ccc(Nc2cc(Cl)cc(Cl)c2[O-])cc1 ZINC001175484297 1048322340 /nfs/dbraw/zinc/32/23/40/1048322340.db2.gz QSYTZWOJSUKJDT-IBGZPJMESA-N -1 1 316.209 4.180 20 0 DIADMM Cn1cc2cccc(Nc3cc(Cl)cc(Cl)c3[O-])c2n1 ZINC001175459122 1048332785 /nfs/dbraw/zinc/33/27/85/1048332785.db2.gz GEHRDGPJIMYFJW-UHFFFAOYSA-N -1 1 308.168 4.329 20 0 DIADMM CSc1ccccc1NC(=O)Nc1cc(F)c([O-])cc1F ZINC001186745593 1048337534 /nfs/dbraw/zinc/33/75/34/1048337534.db2.gz ZYFFBFGXHWYVAO-UHFFFAOYSA-N -1 1 310.325 4.036 20 0 DIADMM CSc1ccccc1NC(=O)Nc1cc(F)cc(F)c1[O-] ZINC001186753895 1048338479 /nfs/dbraw/zinc/33/84/79/1048338479.db2.gz LIEGFZWOZLPNNR-UHFFFAOYSA-N -1 1 310.325 4.036 20 0 DIADMM CSc1ccccc1NC(=O)Nc1ccc(Cl)cc1[O-] ZINC001186746368 1048338757 /nfs/dbraw/zinc/33/87/57/1048338757.db2.gz ZTUDAQCSUBGLCJ-UHFFFAOYSA-N -1 1 308.790 4.412 20 0 DIADMM CC1(C)C[C@H](c2ccccc2)N(C(=O)c2ccc([O-])c(F)c2)C1 ZINC001162711838 1048341408 /nfs/dbraw/zinc/34/14/08/1048341408.db2.gz DJGXDPOQBYVIBN-MRXNPFEDSA-N -1 1 313.372 4.145 20 0 DIADMM CC(C)SCC(=O)Nc1cc(Cl)c([O-])c2ccccc12 ZINC000600135826 1048372937 /nfs/dbraw/zinc/37/29/37/1048372937.db2.gz MUEWAPTYNMVGIO-UHFFFAOYSA-N -1 1 309.818 4.279 20 0 DIADMM C[C@H]1c2ccccc2CCN1Cc1ccc(Cl)cc1C(=O)[O-] ZINC001142643288 1048418069 /nfs/dbraw/zinc/41/80/69/1048418069.db2.gz OUHRFOSQCOTDFK-LBPRGKRZSA-N -1 1 315.800 4.158 20 0 DIADMM C[C@H](C1CC1)n1cc([N-]c2nc(C3CCCCC3)ns2)cn1 ZINC001163127184 1048418534 /nfs/dbraw/zinc/41/85/34/1048418534.db2.gz KXNNZLJUAKVTIW-LLVKDONJSA-N -1 1 317.462 4.497 20 0 DIADMM C[C@@H]1c2ccccc2CCN1Cc1ccc(Cl)cc1C(=O)[O-] ZINC001142643287 1048419292 /nfs/dbraw/zinc/41/92/92/1048419292.db2.gz OUHRFOSQCOTDFK-GFCCVEGCSA-N -1 1 315.800 4.158 20 0 DIADMM O=C(Nc1ccc(Cl)cc1Cl)Nc1c([O-])cccc1F ZINC001202082384 1048445101 /nfs/dbraw/zinc/44/51/01/1048445101.db2.gz LKFVLZZZVUZCLJ-UHFFFAOYSA-N -1 1 315.131 4.482 20 0 DIADMM CSc1cccc(NC(=O)Nc2cc(F)c([O-])cc2F)c1 ZINC001188050040 1048463365 /nfs/dbraw/zinc/46/33/65/1048463365.db2.gz DPSGSLZUADIYGH-UHFFFAOYSA-N -1 1 310.325 4.036 20 0 DIADMM CSc1ccc(NC(=O)Nc2cccc([O-])c2Cl)cc1 ZINC001188109999 1048476657 /nfs/dbraw/zinc/47/66/57/1048476657.db2.gz PGAPPYOOPRAVEF-UHFFFAOYSA-N -1 1 308.790 4.412 20 0 DIADMM Cc1cccc(C)c1NC(=O)Nc1cc([O-])c(Cl)cc1F ZINC001202206770 1048482087 /nfs/dbraw/zinc/48/20/87/1048482087.db2.gz VDZKLSINXHRKLG-UHFFFAOYSA-N -1 1 308.740 4.446 20 0 DIADMM CC1(C)CC(=Nc2cccc(S(=O)(=O)[O-])c2)CC(C)(C)C1 ZINC001175947045 1048522563 /nfs/dbraw/zinc/52/25/63/1048522563.db2.gz JMRXNBISORDWDW-UHFFFAOYSA-N -1 1 309.431 4.075 20 0 DIADMM Cc1ccc2ccc(F)c(Nc3c([O-])cc(F)cc3F)c2n1 ZINC001176114834 1048569943 /nfs/dbraw/zinc/56/99/43/1048569943.db2.gz DNPIOCDIJZLLKU-UHFFFAOYSA-N -1 1 304.271 4.410 20 0 DIADMM [O-]c1ccc(CNc2nc(-c3ccccc3)ns2)cc1Cl ZINC001164061614 1048573751 /nfs/dbraw/zinc/57/37/51/1048573751.db2.gz UVUQNHQFRZGBIP-UHFFFAOYSA-N -1 1 317.801 4.176 20 0 DIADMM COCOc1ccc(Nc2cc([O-])c(Cl)cc2F)cc1F ZINC001176190866 1048588455 /nfs/dbraw/zinc/58/84/55/1048588455.db2.gz JMCTWHHHXFDZOC-UHFFFAOYSA-N -1 1 315.703 4.050 20 0 DIADMM Cc1cccc([N-]S(=O)(=O)c2ccc(F)c3ccccc32)c1 ZINC001189347888 1048618963 /nfs/dbraw/zinc/61/89/63/1048618963.db2.gz LOSHYIAYJZSANL-UHFFFAOYSA-N -1 1 315.369 4.088 20 0 DIADMM Cc1c(Cl)cc(Nc2ccc3nonc3c2)c([O-])c1Cl ZINC001176327345 1048627958 /nfs/dbraw/zinc/62/79/58/1048627958.db2.gz GOVHFAJPTOLUCZ-UHFFFAOYSA-N -1 1 310.140 4.287 20 0 DIADMM CCc1nc(SCCCc2ccccc2C)[n-]c(=O)c1C ZINC001189495470 1048630632 /nfs/dbraw/zinc/63/06/32/1048630632.db2.gz IGBVMXIXUGYWHW-UHFFFAOYSA-N -1 1 302.443 4.086 20 0 DIADMM CC(C)(C)c1ccc(CC(=O)Nc2cccc(F)c2[O-])cc1 ZINC001151771147 1048634198 /nfs/dbraw/zinc/63/41/98/1048634198.db2.gz BDNDNVRKQSARPE-UHFFFAOYSA-N -1 1 301.361 4.010 20 0 DIADMM [O-]c1cccc(CNc2ccc3c(c2)[C@H](O)CCCC3)c1Cl ZINC000850363497 1048640327 /nfs/dbraw/zinc/64/03/27/1048640327.db2.gz BQGWHUMYJOHZIS-MRXNPFEDSA-N -1 1 317.816 4.418 20 0 DIADMM [O-]c1cccc(CNc2ccc3c(c2)[C@@H](O)CCCC3)c1Cl ZINC000850363496 1048640467 /nfs/dbraw/zinc/64/04/67/1048640467.db2.gz BQGWHUMYJOHZIS-INIZCTEOSA-N -1 1 317.816 4.418 20 0 DIADMM COc1c(Cl)cc(Nc2ccnc(Cl)c2[O-])cc1Cl ZINC001176309896 1048646427 /nfs/dbraw/zinc/64/64/27/1048646427.db2.gz IAFZFXHDZHJLKR-UHFFFAOYSA-N -1 1 319.575 4.500 20 0 DIADMM CCC[C@H](C)CCNC(=O)c1cc(Cl)c([O-])c(OCC)c1 ZINC001176313287 1048648197 /nfs/dbraw/zinc/64/81/97/1048648197.db2.gz VFIACCSQXIXELJ-NSHDSACASA-N -1 1 313.825 4.000 20 0 DIADMM [O-]c1cc(F)cc(F)c1Nc1cccc(OC(F)(F)F)c1 ZINC001176541033 1048714052 /nfs/dbraw/zinc/71/40/52/1048714052.db2.gz PANZRGFCVRZYTP-UHFFFAOYSA-N -1 1 305.202 4.313 20 0 DIADMM Cc1nc(SCC[C@@H]2CCc3ccccc32)[n-]c(=O)c1C ZINC001165916559 1048725108 /nfs/dbraw/zinc/72/51/08/1048725108.db2.gz ACIBAOOLAQBYSQ-AWEZNQCLSA-N -1 1 300.427 4.011 20 0 DIADMM CC[C@@H]1C[C@H]1CSc1nc(-c2ccccc2)c(C)c(=O)[n-]1 ZINC001165965353 1048727168 /nfs/dbraw/zinc/72/71/68/1048727168.db2.gz LLJOPKKSVFFEHT-OCCSQVGLSA-N -1 1 300.427 4.296 20 0 DIADMM COc1ccc(O)cc1Nc1cc(Cl)cc(Cl)c1[O-] ZINC001176579322 1048734341 /nfs/dbraw/zinc/73/43/41/1048734341.db2.gz MPQKWWYCGFMHTA-UHFFFAOYSA-N -1 1 300.141 4.157 20 0 DIADMM Cc1cccc(C)c1[C@@H]1CCCN1C(=O)c1ccc([O-])cc1F ZINC001166231785 1048742125 /nfs/dbraw/zinc/74/21/25/1048742125.db2.gz GZBLAPGXSIZHON-KRWDZBQOSA-N -1 1 313.372 4.125 20 0 DIADMM CCc1nc(S[C@H](C)CCc2ccccc2)[n-]c(=O)c1C ZINC001166308018 1048742918 /nfs/dbraw/zinc/74/29/18/1048742918.db2.gz PDXQIAXXRHJXCP-GFCCVEGCSA-N -1 1 302.443 4.166 20 0 DIADMM [O-]c1c(F)cc(F)c(Nc2cccnc2-c2ccccn2)c1F ZINC001176669156 1048751963 /nfs/dbraw/zinc/75/19/63/1048751963.db2.gz FBAQXPZYZSSUTD-UHFFFAOYSA-N -1 1 317.270 4.010 20 0 DIADMM Cc1ccc(-n2nccc2Nc2c(F)cc(F)c([O-])c2F)cc1 ZINC001176664240 1048753026 /nfs/dbraw/zinc/75/30/26/1048753026.db2.gz QWAJMSXNZZDQEU-UHFFFAOYSA-N -1 1 319.286 4.047 20 0 DIADMM [O-]c1c(F)cc(F)c(Nc2csc(-c3ccncc3)n2)c1F ZINC001176668988 1048753784 /nfs/dbraw/zinc/75/37/84/1048753784.db2.gz AGWMEEJYULQROG-UHFFFAOYSA-N -1 1 323.299 4.072 20 0 DIADMM [O-]c1c(F)cc(F)c(Nc2ccc(-c3ccccn3)nc2)c1F ZINC001176670192 1048754485 /nfs/dbraw/zinc/75/44/85/1048754485.db2.gz UHYLWURUHJLUDA-UHFFFAOYSA-N -1 1 317.270 4.010 20 0 DIADMM COc1cc(Cl)ccc1Nc1c(F)cc(F)c([O-])c1F ZINC001176671792 1048754569 /nfs/dbraw/zinc/75/45/69/1048754569.db2.gz PGVHVNVRNSSSNR-UHFFFAOYSA-N -1 1 303.667 4.215 20 0 DIADMM Nc1cc(Cl)cc(Cl)c1Nc1c(F)cc(F)c([O-])c1F ZINC001176672384 1048754706 /nfs/dbraw/zinc/75/47/06/1048754706.db2.gz IQNUVCKSXRFYEA-UHFFFAOYSA-N -1 1 323.101 4.442 20 0 DIADMM [O-]c1c(F)cc(F)c(Nc2ccc(Br)cc2)c1F ZINC001176670530 1048755031 /nfs/dbraw/zinc/75/50/31/1048755031.db2.gz XSQOHCOTMBOVEV-UHFFFAOYSA-N -1 1 318.092 4.316 20 0 DIADMM [O-]c1c(F)cc(F)c(Nc2cc3ccccc3cc2O)c1F ZINC001176672158 1048755760 /nfs/dbraw/zinc/75/57/60/1048755760.db2.gz UVEAXXBVXMAJMB-UHFFFAOYSA-N -1 1 305.255 4.412 20 0 DIADMM Nc1ccccc1N(c1c(F)cc(F)c([O-])c1F)C1CCCC1 ZINC001176673643 1048758194 /nfs/dbraw/zinc/75/81/94/1048758194.db2.gz ZLGPIZDJLGSFLD-UHFFFAOYSA-N -1 1 322.330 4.472 20 0 DIADMM CC(C)Oc1cccc(F)c1Nc1c(F)cc(F)c([O-])c1F ZINC001176674166 1048758336 /nfs/dbraw/zinc/75/83/36/1048758336.db2.gz RMXPOLRSFAYGSD-UHFFFAOYSA-N -1 1 315.266 4.479 20 0 DIADMM [O-]c1c(F)cc(F)c(Nc2nc(-c3ccncc3)cs2)c1F ZINC001176661590 1048767016 /nfs/dbraw/zinc/76/70/16/1048767016.db2.gz AJYZOEJTGYLLQQ-UHFFFAOYSA-N -1 1 323.299 4.072 20 0 DIADMM [O-]c1c(F)cc(F)c(Nc2ccc(Cl)nc2Cl)c1F ZINC001176663057 1048768302 /nfs/dbraw/zinc/76/83/02/1048768302.db2.gz ATKHRBVJIHKBIP-UHFFFAOYSA-N -1 1 309.074 4.255 20 0 DIADMM [O-]c1c(F)cc(F)c(Nc2cc(-c3cccs3)no2)c1F ZINC001176662860 1048768788 /nfs/dbraw/zinc/76/87/88/1048768788.db2.gz AYYCBQZIWOJESV-UHFFFAOYSA-N -1 1 312.272 4.270 20 0 DIADMM CNc1ccc(Nc2cc(Cl)cc(Cl)c2[O-])c(F)n1 ZINC001203357932 1048880813 /nfs/dbraw/zinc/88/08/13/1048880813.db2.gz FEQLBWIWVFKIJA-UHFFFAOYSA-N -1 1 302.136 4.018 20 0 DIADMM Cc1ccc2c(CC(=O)Nc3ccc([O-])c(Cl)c3)c[nH]c2c1 ZINC000111668317 1048927383 /nfs/dbraw/zinc/92/73/83/1048927383.db2.gz MIMSNWMYJZBTBE-UHFFFAOYSA-N -1 1 314.772 4.017 20 0 DIADMM CCCOc1ccc(Nc2cc(F)c([O-])cc2F)c(F)c1F ZINC001203696855 1048968472 /nfs/dbraw/zinc/96/84/72/1048968472.db2.gz MGOJZPUKSZYXFM-UHFFFAOYSA-N -1 1 315.266 4.481 20 0 DIADMM Cc1cc(NCc2cccc([O-])c2Cl)ccc1-n1ccnc1 ZINC001178139201 1048990794 /nfs/dbraw/zinc/99/07/94/1048990794.db2.gz QWPFGWDOYMJLRE-UHFFFAOYSA-N -1 1 313.788 4.152 20 0 DIADMM CCCCc1ccc([C@@H](N[C@H](C)C(=O)[O-])c2cccs2)cc1 ZINC000904203190 1049001862 /nfs/dbraw/zinc/00/18/62/1049001862.db2.gz GFRLRDGFMRIROL-CXAGYDPISA-N -1 1 317.454 4.243 20 0 DIADMM CSc1ccc([O-])c(-c2nc(-c3ccc(C)c(F)c3)no2)c1 ZINC000904334886 1049032632 /nfs/dbraw/zinc/03/26/32/1049032632.db2.gz LNYSSJHRJBIFEN-UHFFFAOYSA-N -1 1 316.357 4.279 20 0 DIADMM Cc1ccc(-c2noc(Cc3ccc([O-])c(Cl)c3)n2)cc1F ZINC000904335052 1049035057 /nfs/dbraw/zinc/03/50/57/1049035057.db2.gz OEZQNTXIZUMUFO-UHFFFAOYSA-N -1 1 318.735 4.134 20 0 DIADMM COc1cccc(C)c1NC(=O)c1ccc2ccccc2c1[O-] ZINC000195013005 1049036783 /nfs/dbraw/zinc/03/67/83/1049036783.db2.gz XFJKYGAMMWBHAL-UHFFFAOYSA-N -1 1 307.349 4.115 20 0 DIADMM CCOc1cc(C(=O)Nc2ccc([O-])c(Cl)c2)ccc1C ZINC000113460968 1049046362 /nfs/dbraw/zinc/04/63/62/1049046362.db2.gz CWTBSXZFHAXSSI-UHFFFAOYSA-N -1 1 305.761 4.005 20 0 DIADMM O=C(c1ccc([O-])cc1F)N1CCC[C@@H]1CCC1CCCCC1 ZINC001150805786 1049054872 /nfs/dbraw/zinc/05/48/72/1049054872.db2.gz IIEYEKCGHFROAE-OAHLLOKOSA-N -1 1 319.420 4.496 20 0 DIADMM Cc1cc(O)cc(C)c1NC(=O)c1ccc(C(C)(C)C)cc1[O-] ZINC001192322495 1049079356 /nfs/dbraw/zinc/07/93/56/1049079356.db2.gz AXIWEFFSCYOUHM-UHFFFAOYSA-N -1 1 313.397 4.264 20 0 DIADMM Cc1[nH]c2c(cccc2NC(=O)c2c(F)ccc([O-])c2F)c1C ZINC001192539957 1049118675 /nfs/dbraw/zinc/11/86/75/1049118675.db2.gz OZNDEHYDJCUCMG-UHFFFAOYSA-N -1 1 316.307 4.021 20 0 DIADMM CC[C@@H](C)c1ccc(NC(=O)c2cc([O-])cc(F)c2F)cc1 ZINC001192651826 1049122907 /nfs/dbraw/zinc/12/29/07/1049122907.db2.gz OJTIYUCWVZYMEP-SNVBAGLBSA-N -1 1 305.324 4.436 20 0 DIADMM O=C(Nc1ccc(F)c2ccccc12)c1cc([O-])cc(F)c1F ZINC001192670932 1049126863 /nfs/dbraw/zinc/12/68/63/1049126863.db2.gz QXAZDXBGXDJTRD-UHFFFAOYSA-N -1 1 317.266 4.215 20 0 DIADMM Cc1ccc(OC(C)C)cc1NC(=O)c1cc([O-])cc(F)c1F ZINC001192670337 1049127087 /nfs/dbraw/zinc/12/70/87/1049127087.db2.gz HPOHTRPJYOGEKQ-UHFFFAOYSA-N -1 1 321.323 4.018 20 0 DIADMM O=c1ccn(-c2ccc(NCc3ccccc3C3CC3)cc2)[n-]1 ZINC001179308888 1049152179 /nfs/dbraw/zinc/15/21/79/1049152179.db2.gz VDGBLUDJPUVCBC-UHFFFAOYSA-N -1 1 305.381 4.067 20 0 DIADMM O=C([N-]c1cnoc1)c1cc(-c2ccccc2)oc1C(F)(F)F ZINC001193786518 1049256602 /nfs/dbraw/zinc/25/66/02/1049256602.db2.gz CCGWLTFNSFEVMQ-UHFFFAOYSA-N -1 1 322.242 4.206 20 0 DIADMM [O-]c1cccc(CN2CCc3ccc(Cl)cc3C2)c1Cl ZINC001204796068 1049266314 /nfs/dbraw/zinc/26/63/14/1049266314.db2.gz KLIQIHBNBRCJIJ-UHFFFAOYSA-N -1 1 308.208 4.257 20 0 DIADMM COc1ccc(Cl)cc1Nc1cc([O-])c(F)c(F)c1F ZINC001249962671 1049332107 /nfs/dbraw/zinc/33/21/07/1049332107.db2.gz MGIVOCOWMBMCGV-UHFFFAOYSA-N -1 1 303.667 4.215 20 0 DIADMM CSCCCCCCC(=O)Nc1ccc([O-])c(Cl)c1 ZINC000860314980 1049382981 /nfs/dbraw/zinc/38/29/81/1049382981.db2.gz ITYSAKXVUHYTCL-UHFFFAOYSA-N -1 1 301.839 4.298 20 0 DIADMM Cc1ccccc1[N-]S(=O)(=O)c1ccccc1-c1ccccc1 ZINC000485789541 1049342525 /nfs/dbraw/zinc/34/25/25/1049342525.db2.gz HNVUIOCVZVTRMJ-UHFFFAOYSA-N -1 1 323.417 4.463 20 0 DIADMM Cc1cc(C)c(NC(=O)Nc2cc(F)c(F)cc2[O-])c(C)c1 ZINC001181266852 1049458130 /nfs/dbraw/zinc/45/81/30/1049458130.db2.gz UCPSNVJGBURNCQ-UHFFFAOYSA-N -1 1 306.312 4.240 20 0 DIADMM Cc1ccc(C[C@H](C)C(=O)Nc2ccc([O-])c(Cl)c2)cc1 ZINC000486776838 1049469112 /nfs/dbraw/zinc/46/91/12/1049469112.db2.gz UWWBIWJNHJHJQC-LBPRGKRZSA-N -1 1 303.789 4.171 20 0 DIADMM [O-]c1cccc(CN2CC(Cc3ccccc3Cl)C2)c1Cl ZINC001181544617 1049489846 /nfs/dbraw/zinc/48/98/46/1049489846.db2.gz SVDOIQDERLMDDJ-UHFFFAOYSA-N -1 1 322.235 4.374 20 0 DIADMM CC(C)c1cccc(S(=O)(=O)[N-]c2ccc3c(c2)N=NC3)c1 ZINC001195169660 1049491031 /nfs/dbraw/zinc/49/10/31/1049491031.db2.gz UAJJJRXTCMXQRE-UHFFFAOYSA-N -1 1 315.398 4.208 20 0 DIADMM CCC[C@@H](C(=O)Nc1cccc([O-])c1Br)C(C)C ZINC000908709719 1049501684 /nfs/dbraw/zinc/50/16/84/1049501684.db2.gz SJQIFGQKWKPPHW-SNVBAGLBSA-N -1 1 314.223 4.166 20 0 DIADMM CC[C@@H](CC(C)C)C(=O)Nc1cccc([O-])c1Br ZINC000908708623 1049499418 /nfs/dbraw/zinc/49/94/18/1049499418.db2.gz YSHFSCUGQVCZON-JTQLQIEISA-N -1 1 314.223 4.166 20 0 DIADMM C/C(=C\C(=O)Nc1cccc([O-])c1Br)C(C)(C)C ZINC000908710629 1049502049 /nfs/dbraw/zinc/50/20/49/1049502049.db2.gz MJCADVAHQMYXRK-CMDGGOBGSA-N -1 1 312.207 4.086 20 0 DIADMM Cc1c(=O)[n-]c(SCSC(C)C)nc1-c1ccccc1 ZINC000863321671 1049555747 /nfs/dbraw/zinc/55/57/47/1049555747.db2.gz XEOMSEXYXXWETF-UHFFFAOYSA-N -1 1 306.456 4.349 20 0 DIADMM CS(C)(=O)=Nc1ccc(NCc2cccc([O-])c2Cl)cc1 ZINC000864012845 1049617775 /nfs/dbraw/zinc/61/77/75/1049617775.db2.gz DKQROVJYYQLDLR-UHFFFAOYSA-N -1 1 324.833 4.017 20 0 DIADMM Cc1cccc(NC(=S)Nc2cccc([O-])c2Cl)c1C ZINC001196421458 1049655564 /nfs/dbraw/zinc/65/55/64/1049655564.db2.gz ZKACOJCAGXQVCL-UHFFFAOYSA-N -1 1 306.818 4.471 20 0 DIADMM Cc1cc(O)cc(-c2ccc([C@H](C)[N-]C(=O)C(F)(F)F)cc2)c1 ZINC001206261090 1049692806 /nfs/dbraw/zinc/69/28/06/1049692806.db2.gz CJYARBAFEWJTLO-NSHDSACASA-N -1 1 323.314 4.107 20 0 DIADMM C[C@H](c1ccc(C(C)(C)C)cc1)S(=O)(=O)c1ccc([O-])cc1 ZINC000488938496 1049713010 /nfs/dbraw/zinc/71/30/10/1049713010.db2.gz RUPQQFVSDJOFBK-CYBMUJFWSA-N -1 1 318.438 4.225 20 0 DIADMM C/C=C\c1ccc(NC(=O)c2cc(Cl)c([O-])c(OC)c2)cc1 ZINC000489948356 1049793340 /nfs/dbraw/zinc/79/33/40/1049793340.db2.gz RQEUEDLZKSCETJ-ARJAWSKDSA-N -1 1 317.772 4.340 20 0 DIADMM Cc1cc([C@@H](C)N(C)Cc2cccc(Cl)c2)oc1C(=O)[O-] ZINC000572296167 1050000178 /nfs/dbraw/zinc/00/01/78/1050000178.db2.gz RANAZEUPEXSAJK-LLVKDONJSA-N -1 1 307.777 4.133 20 0 DIADMM CCC[C@H]1CCCC[C@@H]1[N-]S(=O)(=O)c1sccc1Cl ZINC001209229591 1050045388 /nfs/dbraw/zinc/04/53/88/1050045388.db2.gz BIEFGNRGZSXGIN-JQWIXIFHSA-N -1 1 321.895 4.039 20 0 DIADMM CCC[C@@H]1CCCC[C@@H]1[N-]S(=O)(=O)c1sccc1Cl ZINC001209229592 1050045807 /nfs/dbraw/zinc/04/58/07/1050045807.db2.gz BIEFGNRGZSXGIN-PWSUYJOCSA-N -1 1 321.895 4.039 20 0 DIADMM Cc1cc([C@H](C)NC(=O)c2c([O-])cccc2Cl)c(C)s1 ZINC000057307724 1050083094 /nfs/dbraw/zinc/08/30/94/1050083094.db2.gz RMAIMYJOXFIFBN-VIFPVBQESA-N -1 1 309.818 4.215 20 0 DIADMM [O-]c1cc(Nc2cc(C(F)(F)F)ccc2O)cc(F)c1F ZINC001209983143 1050115751 /nfs/dbraw/zinc/11/57/51/1050115751.db2.gz AMNIYWNWFRYQIU-UHFFFAOYSA-N -1 1 305.202 4.138 20 0 DIADMM O=c1oc2cc([O-])ccc2cc1Nc1cc(Cl)c(F)cc1F ZINC001210110615 1050138232 /nfs/dbraw/zinc/13/82/32/1050138232.db2.gz CMYWWLDMQFYRSN-UHFFFAOYSA-N -1 1 323.682 4.174 20 0 DIADMM CCc1c(Cl)cc(Nc2cnc(C)c(N)c2)c([O-])c1Cl ZINC001210289414 1050192397 /nfs/dbraw/zinc/19/23/97/1050192397.db2.gz KMLZOMWOYFOQEP-UHFFFAOYSA-N -1 1 312.200 4.291 20 0 DIADMM [O-]c1ccc(Cl)c(Nc2cnn(C(F)(F)F)c2)c1Cl ZINC001210361526 1050215120 /nfs/dbraw/zinc/21/51/20/1050215120.db2.gz AQRMKYGFYAEXFX-UHFFFAOYSA-N -1 1 312.078 4.115 20 0 DIADMM C[C@H](Cc1ccc(F)cc1)c1nc(-c2ccc([O-])c(F)c2)no1 ZINC000771220625 1050231874 /nfs/dbraw/zinc/23/18/74/1050231874.db2.gz BCIXZSBOMZWIPT-SNVBAGLBSA-N -1 1 316.307 4.067 20 0 DIADMM CC[C@@H](NC(=O)c1cccc([O-])c1F)C(C)(C)c1ccccc1 ZINC001136921653 1050231829 /nfs/dbraw/zinc/23/18/29/1050231829.db2.gz KAMQGHJHBGYVEG-MRXNPFEDSA-N -1 1 315.388 4.018 20 0 DIADMM O=S(=O)([O-])c1ccc(NC2=CCCCCCC2)c(Cl)c1 ZINC001210450004 1050251337 /nfs/dbraw/zinc/25/13/37/1050251337.db2.gz TYSHOJDBESKLQH-UHFFFAOYSA-N -1 1 315.822 4.237 20 0 DIADMM [O-]c1c(Cl)c(Cl)ccc1Nc1ccc(CO)c(F)c1 ZINC001210487247 1050264185 /nfs/dbraw/zinc/26/41/85/1050264185.db2.gz RBQMMYMENAAWAL-UHFFFAOYSA-N -1 1 302.132 4.074 20 0 DIADMM Cc1oncc1[N-]c1cc(-c2cccc(C(F)(F)F)c2)no1 ZINC001210578602 1050303642 /nfs/dbraw/zinc/30/36/42/1050303642.db2.gz GXILDFRULLCPMN-UHFFFAOYSA-N -1 1 309.247 4.400 20 0 DIADMM CC(C)(C)[C@H]1CCCN(C(=O)c2c([O-])cccc2Cl)CC1 ZINC000734872572 1050326785 /nfs/dbraw/zinc/32/67/85/1050326785.db2.gz OUZMBMQOWKSUGP-LBPRGKRZSA-N -1 1 309.837 4.334 20 0 DIADMM O=C([N-]c1cccc(Cl)c1SC(F)F)c1nccs1 ZINC000772173996 1050336320 /nfs/dbraw/zinc/33/63/20/1050336320.db2.gz GPYCMKQKRIJBOY-UHFFFAOYSA-N -1 1 320.773 4.364 20 0 DIADMM CCC[C@H](Cc1ccccc1)NC(=O)c1cc(Cl)ccc1[O-] ZINC001143696275 1050338755 /nfs/dbraw/zinc/33/87/55/1050338755.db2.gz GNGXFHWFCDKFNW-OAHLLOKOSA-N -1 1 317.816 4.187 20 0 DIADMM CC(=O)c1oc2cccnc2c1Nc1cccc([O-])c1Cl ZINC001210853729 1050392800 /nfs/dbraw/zinc/39/28/00/1050392800.db2.gz GSPIXXKANLUIQT-UHFFFAOYSA-N -1 1 302.717 4.133 20 0 DIADMM COc1ccc(C(C)=O)c(Nc2cccc([O-])c2Cl)c1OC ZINC001210854952 1050392874 /nfs/dbraw/zinc/39/28/74/1050392874.db2.gz NVISPAPHLKHEMO-UHFFFAOYSA-N -1 1 321.760 4.009 20 0 DIADMM O=C(c1ccncc1)c1ccc(Nc2cccc([O-])c2Cl)cc1 ZINC001210859619 1050395198 /nfs/dbraw/zinc/39/51/98/1050395198.db2.gz IGUOLQJKWCLHSG-UHFFFAOYSA-N -1 1 324.767 4.415 20 0 DIADMM Nc1c(F)cc(Nc2c(Cl)ccc([O-])c2Cl)cc1F ZINC001210909131 1050410076 /nfs/dbraw/zinc/41/00/76/1050410076.db2.gz BQLBERWCFLHJSD-UHFFFAOYSA-N -1 1 305.111 4.303 20 0 DIADMM [O-]c1c(Cl)cc(Nc2cccnc2N2CCCC2)cc1Cl ZINC001210924009 1050415511 /nfs/dbraw/zinc/41/55/11/1050415511.db2.gz CJSPVUDXGJIFCN-UHFFFAOYSA-N -1 1 324.211 4.438 20 0 DIADMM COC(=O)c1cscc1Nc1cc(Cl)c([O-])c(Cl)c1 ZINC001210924324 1050415809 /nfs/dbraw/zinc/41/58/09/1050415809.db2.gz JCVWWQKGBUYLQL-UHFFFAOYSA-N -1 1 318.181 4.291 20 0 DIADMM Nc1cc(F)cc2c1ccn2-c1cc(Cl)c([O-])c(Cl)c1 ZINC001210931890 1050420913 /nfs/dbraw/zinc/42/09/13/1050420913.db2.gz WAVYZEDCRIRDPS-UHFFFAOYSA-N -1 1 311.143 4.364 20 0 DIADMM Cc1c(Cl)cc(Nc2cnn3ccccc23)c([O-])c1Cl ZINC001211095090 1050473265 /nfs/dbraw/zinc/47/32/65/1050473265.db2.gz IZIGQJHLZXTBJV-UHFFFAOYSA-N -1 1 308.168 4.399 20 0 DIADMM [O-]c1c(Nc2cc(O)cc(OC(F)(F)F)c2)ccc(F)c1F ZINC001211125399 1050487502 /nfs/dbraw/zinc/48/75/02/1050487502.db2.gz DOFDXLYGMQILHO-UHFFFAOYSA-N -1 1 321.201 4.018 20 0 DIADMM [O-]c1cc(F)c(Nc2cc(O)cc(OC(F)(F)F)c2)cc1F ZINC001211125835 1050488560 /nfs/dbraw/zinc/48/85/60/1050488560.db2.gz KGILMHVCROSIOM-UHFFFAOYSA-N -1 1 321.201 4.018 20 0 DIADMM CCOC(=O)CCCc1ccc(-c2cc(F)c([O-])cc2F)cc1 ZINC001211352140 1050553936 /nfs/dbraw/zinc/55/39/36/1050553936.db2.gz IASDMYBVVKSJRP-UHFFFAOYSA-N -1 1 320.335 4.223 20 0 DIADMM Cc1ccc([C@H](C)C(=O)Nc2cccc(C(F)(F)F)c2[O-])cc1 ZINC001144456160 1050588426 /nfs/dbraw/zinc/58/84/26/1050588426.db2.gz XVNYZJKHJDJBJR-NSHDSACASA-N -1 1 323.314 4.462 20 0 DIADMM COc1cccc([C@H]2CCCN2Cc2c(F)cc([O-])cc2F)c1 ZINC001144559614 1050619409 /nfs/dbraw/zinc/61/94/09/1050619409.db2.gz OPABUXCKTUHTGC-GOSISDBHSA-N -1 1 319.351 4.016 20 0 DIADMM [O-]c1c(F)cc(Nc2ccc(OC(F)(F)F)cc2F)cc1F ZINC001213384300 1050644440 /nfs/dbraw/zinc/64/44/40/1050644440.db2.gz DYHMMQZYXCDWIE-UHFFFAOYSA-N -1 1 323.192 4.452 20 0 DIADMM [O-]c1c(F)cc(Nc2c(F)cccc2N2CCCC2)cc1F ZINC001213389012 1050646583 /nfs/dbraw/zinc/64/65/83/1050646583.db2.gz XNTXJYOUIVTQBQ-UHFFFAOYSA-N -1 1 308.303 4.153 20 0 DIADMM C/C(=C/CN1CCC[C@@H]1c1ccc(Cl)c(Cl)c1)C(=O)[O-] ZINC000846237269 1050701865 /nfs/dbraw/zinc/70/18/65/1050701865.db2.gz CEFFOEDEAJMXDX-LBIZBFCRSA-N -1 1 314.212 4.161 20 0 DIADMM Cc1ccc(Cl)cc1-c1noc(-c2cc([O-])cnc2Cl)n1 ZINC001213696290 1050720518 /nfs/dbraw/zinc/72/05/18/1050720518.db2.gz POAXEPRMCJKMMJ-UHFFFAOYSA-N -1 1 322.151 4.119 20 0 DIADMM Cc1ccc(-c2noc(-c3cc([O-])cnc3Cl)n2)c(Cl)c1 ZINC001213698095 1050721823 /nfs/dbraw/zinc/72/18/23/1050721823.db2.gz NZTDMUQNZFXYTE-UHFFFAOYSA-N -1 1 322.151 4.119 20 0 DIADMM COc1cc(F)c(Nc2c([O-])cc(F)cc2F)cc1Cl ZINC001214065075 1050807990 /nfs/dbraw/zinc/80/79/90/1050807990.db2.gz ALZYPUVJKPRERA-UHFFFAOYSA-N -1 1 303.667 4.215 20 0 DIADMM C[C@@H]1CC[C@@](C)(/C=C/C(=O)Nc2c([O-])cccc2F)C1(C)C ZINC001146492738 1050826778 /nfs/dbraw/zinc/82/67/78/1050826778.db2.gz PSURODJGELIEGL-QHNKHSLHSA-N -1 1 305.393 4.488 20 0 DIADMM O=C(NC1(c2cccc(Cl)c2)CC1)c1cc(Cl)ccc1[O-] ZINC001147206089 1050866233 /nfs/dbraw/zinc/86/62/33/1050866233.db2.gz ZSISBXQNVWOQME-UHFFFAOYSA-N -1 1 322.191 4.118 20 0 DIADMM CC[C@@H]1CCC[C@H](NC(=O)c2ccc(C(F)(F)F)cc2[O-])C1 ZINC001147264032 1050873914 /nfs/dbraw/zinc/87/39/14/1050873914.db2.gz ZKBUVBFDMZDFLY-PWSUYJOCSA-N -1 1 315.335 4.110 20 0 DIADMM [O-]c1c(F)cc(Nc2cc(Cl)nnc2Cl)cc1Cl ZINC001214480689 1050913933 /nfs/dbraw/zinc/91/39/33/1050913933.db2.gz YRJSYLXGZPBHAB-UHFFFAOYSA-N -1 1 308.527 4.025 20 0 DIADMM [O-]c1c(F)cc(Nc2ccc(Br)cn2)cc1Cl ZINC001214477489 1050914435 /nfs/dbraw/zinc/91/44/35/1050914435.db2.gz QSLBWZREUKEMQH-UHFFFAOYSA-N -1 1 317.545 4.086 20 0 DIADMM [O-]c1c(F)cc(Nc2ccnn2-c2ccccc2)cc1Cl ZINC001214482550 1050917352 /nfs/dbraw/zinc/91/73/52/1050917352.db2.gz ATUBZEJBBKVXEY-UHFFFAOYSA-N -1 1 303.724 4.114 20 0 DIADMM [O-]c1c(F)cc(Nc2cccnc2-c2ccccn2)cc1Cl ZINC001214486689 1050919836 /nfs/dbraw/zinc/91/98/36/1050919836.db2.gz UKIVBBNQVMCNTK-UHFFFAOYSA-N -1 1 315.735 4.385 20 0 DIADMM C[C@H]1CCc2cc(N)ccc2N1c1cc(F)c([O-])c(Cl)c1 ZINC001214486345 1050920331 /nfs/dbraw/zinc/92/03/31/1050920331.db2.gz BSEHICQDPLENES-VIFPVBQESA-N -1 1 306.768 4.240 20 0 DIADMM [O-]c1c(F)cc(Nc2ccc(-n3ccnc3)cc2)cc1Cl ZINC001214486487 1050920350 /nfs/dbraw/zinc/92/03/50/1050920350.db2.gz KCJUFWXAXBATDG-UHFFFAOYSA-N -1 1 303.724 4.114 20 0 DIADMM [O-]c1c(F)cc(Nc2csc(-c3ccncc3)n2)cc1Cl ZINC001214486341 1050920801 /nfs/dbraw/zinc/92/08/01/1050920801.db2.gz BQVJLVIRGUAYKG-UHFFFAOYSA-N -1 1 321.764 4.447 20 0 DIADMM CC(C)NC(=O)c1ccc(Nc2cc(F)c([O-])c(Cl)c2)cc1 ZINC001214488370 1050920887 /nfs/dbraw/zinc/92/08/87/1050920887.db2.gz DYKAYRMISUCXHZ-UHFFFAOYSA-N -1 1 322.767 4.067 20 0 DIADMM O=C1CCCc2cc(Nc3cc(F)c([O-])c(Cl)c3)ccc21 ZINC001214492004 1050921655 /nfs/dbraw/zinc/92/16/55/1050921655.db2.gz OZXCGLCHJFGNDN-UHFFFAOYSA-N -1 1 305.736 4.447 20 0 DIADMM Cc1cc2nsnc2cc1Nc1cc(F)c([O-])c(Cl)c1 ZINC001214492208 1050921758 /nfs/dbraw/zinc/92/17/58/1050921758.db2.gz SXACOGFDTCBLIT-UHFFFAOYSA-N -1 1 309.753 4.241 20 0 DIADMM CC(=O)c1c(F)cc(F)cc1Nc1cc(F)c([O-])c(Cl)c1 ZINC001214491529 1050922676 /nfs/dbraw/zinc/92/26/76/1050922676.db2.gz ARGFBFUWFMXGTR-UHFFFAOYSA-N -1 1 315.678 4.409 20 0 DIADMM COc1ccc(Nc2cc(F)c([O-])c(Cl)c2)c2ncccc12 ZINC001214490356 1050922989 /nfs/dbraw/zinc/92/29/89/1050922989.db2.gz UKZLUDYHVHJKKI-UHFFFAOYSA-N -1 1 318.735 4.485 20 0 DIADMM COc1ccc2c(c1Nc1c(Cl)ccc([O-])c1F)C(=O)CC2 ZINC001214563374 1050945281 /nfs/dbraw/zinc/94/52/81/1050945281.db2.gz CRGQQTNBEWIQBL-UHFFFAOYSA-N -1 1 321.735 4.066 20 0 DIADMM COc1ccc(Nc2c(Cl)ccc([O-])c2F)c(C(C)=O)c1 ZINC001214564970 1050947125 /nfs/dbraw/zinc/94/71/25/1050947125.db2.gz RNRVOMBLCNLHJN-UHFFFAOYSA-N -1 1 309.724 4.140 20 0 DIADMM Cc1ccc(C(=O)N(c2ccccc2)c2ccccc2N)c([O-])c1 ZINC001148500388 1050949219 /nfs/dbraw/zinc/94/92/19/1050949219.db2.gz MVNCJQGPAOYYAF-UHFFFAOYSA-N -1 1 318.376 4.261 20 0 DIADMM C[C@H]1CN(C(=O)c2cccc(-c3ccccc3)c2[O-])C2(CC2)C1 ZINC001148866768 1050979748 /nfs/dbraw/zinc/97/97/48/1050979748.db2.gz QEUIEMJUXSRSSN-CQSZACIVSA-N -1 1 307.393 4.074 20 0 DIADMM CC(C)N(CC1CC1)C(=O)c1cccc(-c2ccccc2)c1[O-] ZINC001148866897 1050979835 /nfs/dbraw/zinc/97/98/35/1050979835.db2.gz RELYIFAEYLLZNP-UHFFFAOYSA-N -1 1 309.409 4.320 20 0 DIADMM CCc1ncsc1NC(=O)c1cccc(-c2ccccc2)c1[O-] ZINC001148866872 1050980199 /nfs/dbraw/zinc/98/01/99/1050980199.db2.gz INERMPTXYZJLHH-UHFFFAOYSA-N -1 1 324.405 4.330 20 0 DIADMM O=C(c1c([O-])cccc1Cl)N1CCC(C2CCCC2)CC1 ZINC000743737002 1051062258 /nfs/dbraw/zinc/06/22/58/1051062258.db2.gz TYAVATRJUGWZBZ-UHFFFAOYSA-N -1 1 307.821 4.088 20 0 DIADMM COc1ccc(-c2nc(-c3ccc(C)c(Cl)c3)no2)c([O-])c1 ZINC001215149286 1051088946 /nfs/dbraw/zinc/08/89/46/1051088946.db2.gz DITCRCSWVPMVCG-UHFFFAOYSA-N -1 1 316.744 4.080 20 0 DIADMM COCOc1cc(C)c(Nc2c([O-])cc(F)cc2F)c(C)c1 ZINC001215163718 1051095985 /nfs/dbraw/zinc/09/59/85/1051095985.db2.gz HEEFXPLCEDNPMT-UHFFFAOYSA-N -1 1 309.312 4.014 20 0 DIADMM CC(C)Oc1ccc(F)c(Nc2ccnc(Cl)c2[O-])c1F ZINC001215174765 1051103220 /nfs/dbraw/zinc/10/32/20/1051103220.db2.gz LJTDUNYAHBAUMT-UHFFFAOYSA-N -1 1 314.719 4.250 20 0 DIADMM COc1cccc([O-])c1-c1nc(-c2ccc(C)c(Cl)c2)no1 ZINC001215322404 1051165188 /nfs/dbraw/zinc/16/51/88/1051165188.db2.gz LGDPNWUUQOKXRP-UHFFFAOYSA-N -1 1 316.744 4.080 20 0 DIADMM CCCCc1ccc(-c2noc(-c3c([O-])cccc3OC)n2)cc1 ZINC001215322605 1051165268 /nfs/dbraw/zinc/16/52/68/1051165268.db2.gz YHUCTGPTKYBGOT-UHFFFAOYSA-N -1 1 324.380 4.460 20 0 DIADMM [O-]c1ccc(-c2nc(-c3ccc4ccncc4c3)no2)c(Cl)c1 ZINC001215342919 1051171951 /nfs/dbraw/zinc/17/19/51/1051171951.db2.gz GYIDGIKIKHPEKE-UHFFFAOYSA-N -1 1 323.739 4.311 20 0 DIADMM Cc1ncc(Cl)cc1-c1noc(-c2ccc([O-])cc2Cl)n1 ZINC001215345737 1051172013 /nfs/dbraw/zinc/17/20/13/1051172013.db2.gz HHZOBKODGFBZGB-UHFFFAOYSA-N -1 1 322.151 4.119 20 0 DIADMM Cc1cc(F)ccc1-c1noc(-c2ccc([O-])cc2Cl)n1 ZINC001215343576 1051172573 /nfs/dbraw/zinc/17/25/73/1051172573.db2.gz ZQEYCBRZIHRCMA-UHFFFAOYSA-N -1 1 304.708 4.210 20 0 DIADMM CCOc1cccc(-c2noc(-c3ccc([O-])cc3Cl)n2)c1 ZINC001215343327 1051172803 /nfs/dbraw/zinc/17/28/03/1051172803.db2.gz SCYUBOBMRICNED-UHFFFAOYSA-N -1 1 316.744 4.161 20 0 DIADMM [O-]c1ccc(-c2nc(-c3cccc4ccncc43)no2)c(Cl)c1 ZINC001215345820 1051172998 /nfs/dbraw/zinc/17/29/98/1051172998.db2.gz MEJVOFKIGBEYQY-UHFFFAOYSA-N -1 1 323.739 4.311 20 0 DIADMM [O-]c1cc(Cl)c(Nc2ccc(F)c3n[nH]cc32)cc1Cl ZINC001215377637 1051181129 /nfs/dbraw/zinc/18/11/29/1051181129.db2.gz WEVYVPKABQCZSZ-UHFFFAOYSA-N -1 1 312.131 4.458 20 0 DIADMM [O-]c1ccc(Cl)c(Nc2ccc(F)c3n[nH]cc32)c1Cl ZINC001215377225 1051181790 /nfs/dbraw/zinc/18/17/90/1051181790.db2.gz AJNRAINLECNMDG-UHFFFAOYSA-N -1 1 312.131 4.458 20 0 DIADMM O=C(Nc1cccc(F)c1[O-])c1cc2sccc2nc1Cl ZINC001171638548 1051195312 /nfs/dbraw/zinc/19/53/12/1051195312.db2.gz YJWDCZDRHRDCDG-UHFFFAOYSA-N -1 1 322.748 4.047 20 0 DIADMM CCOc1c(Nc2cc([O-])c(F)c(F)c2)ccc(F)c1F ZINC001215417716 1051196886 /nfs/dbraw/zinc/19/68/86/1051196886.db2.gz YVEJTQAWQGRKLM-UHFFFAOYSA-N -1 1 301.239 4.091 20 0 DIADMM Cc1cccc(C(C)(C)CNC(=O)c2c([O-])cccc2Cl)c1 ZINC000745189061 1051231452 /nfs/dbraw/zinc/23/14/52/1051231452.db2.gz FYIWYGPORYWXCY-UHFFFAOYSA-N -1 1 317.816 4.062 20 0 DIADMM [O-]c1ccc(Cl)c(Nc2cc3n[nH]cc3c(F)c2)c1Cl ZINC001215555087 1051241964 /nfs/dbraw/zinc/24/19/64/1051241964.db2.gz BDJMILFTDQSEBF-UHFFFAOYSA-N -1 1 312.131 4.458 20 0 DIADMM [O-]c1ccc(Cl)c(Nc2cc3[nH]ncc3c(F)c2)c1Cl ZINC001215555087 1051241973 /nfs/dbraw/zinc/24/19/73/1051241973.db2.gz BDJMILFTDQSEBF-UHFFFAOYSA-N -1 1 312.131 4.458 20 0 DIADMM [O-]c1cc(F)c(Nc2ccc(Br)cc2)cc1F ZINC001215571983 1051252003 /nfs/dbraw/zinc/25/20/03/1051252003.db2.gz REOBNNVFQZLENN-UHFFFAOYSA-N -1 1 300.102 4.177 20 0 DIADMM COc1ccc(F)c(Nc2cc(F)c([O-])cc2F)c1Cl ZINC001215573277 1051252558 /nfs/dbraw/zinc/25/25/58/1051252558.db2.gz AOQCGQNYNKDOMW-UHFFFAOYSA-N -1 1 303.667 4.215 20 0 DIADMM COc1cc(Nc2cc(F)c([O-])cc2F)c(Cl)c(OC)c1 ZINC001215573875 1051255009 /nfs/dbraw/zinc/25/50/09/1051255009.db2.gz JSOLATJCIIMCMX-UHFFFAOYSA-N -1 1 315.703 4.085 20 0 DIADMM CC(C)Oc1c(F)cc(F)c([N-]c2noc3cccnc23)c1F ZINC001212642138 1051308994 /nfs/dbraw/zinc/30/89/94/1051308994.db2.gz JIIIMRPFEMRLHZ-UHFFFAOYSA-N -1 1 323.274 4.171 20 0 DIADMM CC(C)Oc1c(F)ccc(Nc2ccnc(Cl)c2[O-])c1F ZINC001215727774 1051328126 /nfs/dbraw/zinc/32/81/26/1051328126.db2.gz BRFCVOKUYFTCIU-UHFFFAOYSA-N -1 1 314.719 4.250 20 0 DIADMM CSc1nc(-c2ccc(Cl)c([O-])c2)cc(C(F)(F)F)n1 ZINC001243576726 1051337046 /nfs/dbraw/zinc/33/70/46/1051337046.db2.gz LKFRSAHBYRRQCK-UHFFFAOYSA-N -1 1 320.723 4.243 20 0 DIADMM [O-]c1cc(-c2ccc(OCC(F)(F)F)nc2)ccc1Cl ZINC001243581771 1051341584 /nfs/dbraw/zinc/34/15/84/1051341584.db2.gz HSRYRHIRWVSIJE-UHFFFAOYSA-N -1 1 303.667 4.049 20 0 DIADMM Cc1cc(-c2noc(-c3cc(F)ccc3[O-])n2)cc(C)c1F ZINC001215769703 1051357370 /nfs/dbraw/zinc/35/73/70/1051357370.db2.gz MXQYTVYDAIMQRT-UHFFFAOYSA-N -1 1 302.280 4.004 20 0 DIADMM Cc1cc(Cl)cc(-c2noc(-c3cc(F)ccc3[O-])n2)c1 ZINC001215769594 1051357920 /nfs/dbraw/zinc/35/79/20/1051357920.db2.gz MMXBGDAXYDJILT-UHFFFAOYSA-N -1 1 304.708 4.210 20 0 DIADMM Cc1noc(-c2ccccc2)c1[N-]C(=O)c1coc(C2CCC2)n1 ZINC000194859866 1051378558 /nfs/dbraw/zinc/37/85/58/1051378558.db2.gz LBJLKJYUBIIOMM-UHFFFAOYSA-N -1 1 323.352 4.158 20 0 DIADMM Cc1ccc(Cl)c(-c2noc(-c3ccc([O-])cc3F)n2)c1 ZINC001215826829 1051392196 /nfs/dbraw/zinc/39/21/96/1051392196.db2.gz TUNVQFABNASNJQ-UHFFFAOYSA-N -1 1 304.708 4.210 20 0 DIADMM Cc1cc2ccccc2nc1-c1noc(-c2ccc([O-])cc2F)n1 ZINC001215830664 1051393966 /nfs/dbraw/zinc/39/39/66/1051393966.db2.gz CLFVABHILYZNCR-UHFFFAOYSA-N -1 1 321.311 4.105 20 0 DIADMM CSc1ccc(F)c(Nc2ccnc(Cl)c2[O-])c1F ZINC001215837554 1051400585 /nfs/dbraw/zinc/40/05/85/1051400585.db2.gz SJJPZHBEHOSLMD-UHFFFAOYSA-N -1 1 302.733 4.184 20 0 DIADMM [O-]c1cc(-c2nc(-c3ccc(Cl)cc3F)no2)ccc1F ZINC001215838580 1051402480 /nfs/dbraw/zinc/40/24/80/1051402480.db2.gz GPAWFLJPESHTNP-UHFFFAOYSA-N -1 1 308.671 4.041 20 0 DIADMM CSc1cc(F)c(Nc2ccc(F)c(F)c2[O-])c(F)c1 ZINC001215843664 1051407219 /nfs/dbraw/zinc/40/72/19/1051407219.db2.gz MTVDOKQWMZHLDF-UHFFFAOYSA-N -1 1 303.280 4.414 20 0 DIADMM [O-]c1cc(-c2nc(-c3ccc4sccc4c3)no2)ccc1F ZINC001215842515 1051407498 /nfs/dbraw/zinc/40/74/98/1051407498.db2.gz LXRBMMBNJSHXJA-UHFFFAOYSA-N -1 1 312.325 4.463 20 0 DIADMM COc1nccc(SC)c1[N-]c1nc2cc(Cl)ccc2o1 ZINC001215926528 1051463031 /nfs/dbraw/zinc/46/30/31/1051463031.db2.gz USWZCCVZKGMTGU-UHFFFAOYSA-N -1 1 321.789 4.350 20 0 DIADMM CC[C@H](C)CCCCC(=O)Nc1ccc(-n2ccc(=O)[n-]2)cc1 ZINC001168914862 1051466036 /nfs/dbraw/zinc/46/60/36/1051466036.db2.gz PKLRXLQCNXNDJK-AWEZNQCLSA-N -1 1 315.417 4.123 20 0 DIADMM [O-]c1cccc(-c2nc(-c3cc(F)cc(Cl)c3)no2)c1F ZINC001215984260 1051502047 /nfs/dbraw/zinc/50/20/47/1051502047.db2.gz MWPAUKJEUNTJIK-UHFFFAOYSA-N -1 1 308.671 4.041 20 0 DIADMM CC(C)Oc1cccc(-c2noc(-c3cccc([O-])c3F)n2)c1 ZINC001215988899 1051505359 /nfs/dbraw/zinc/50/53/59/1051505359.db2.gz LNONCINDKSCECI-UHFFFAOYSA-N -1 1 314.316 4.036 20 0 DIADMM Cc1cc2ccccc2nc1-c1noc(-c2cccc([O-])c2F)n1 ZINC001215989220 1051507408 /nfs/dbraw/zinc/50/74/08/1051507408.db2.gz VGAQVDNZNZRDMQ-UHFFFAOYSA-N -1 1 321.311 4.105 20 0 DIADMM [O-]c1cccc(-c2nc(-c3cc(F)ccc3Cl)no2)c1F ZINC001215989363 1051507554 /nfs/dbraw/zinc/50/75/54/1051507554.db2.gz YQCCIHVZEXNPAN-UHFFFAOYSA-N -1 1 308.671 4.041 20 0 DIADMM CCOc1ccc(Nc2ccc(-n3ccc(=O)[n-]3)cc2)c(C)c1C ZINC001215992852 1051511513 /nfs/dbraw/zinc/51/15/13/1051511513.db2.gz VUBBMUPFJCUCPK-UHFFFAOYSA-N -1 1 323.396 4.337 20 0 DIADMM [O-]c1cc(Nc2ccc(Cl)c3c[nH]nc32)c(F)cc1Cl ZINC001216057899 1051554089 /nfs/dbraw/zinc/55/40/89/1051554089.db2.gz CRESZGFXLICKRY-UHFFFAOYSA-N -1 1 312.131 4.458 20 0 DIADMM c1coc(-c2nnc([N-]c3cccc(-c4ccncc4)c3)o2)c1 ZINC001216143816 1051599744 /nfs/dbraw/zinc/59/97/44/1051599744.db2.gz OWDSNBCGAWRFFG-UHFFFAOYSA-N -1 1 304.309 4.135 20 0 DIADMM COc1ccc(Nc2cc(Cl)c(C)c(Cl)c2[O-])cc1N ZINC001216260709 1051663249 /nfs/dbraw/zinc/66/32/49/1051663249.db2.gz JUVUDORAPIUCSE-UHFFFAOYSA-N -1 1 313.184 4.342 20 0 DIADMM [O-]c1cc(Cl)c(Nc2ccc(CO)cc2F)cc1Cl ZINC001216273987 1051668577 /nfs/dbraw/zinc/66/85/77/1051668577.db2.gz KUGSJIWJUBVVBH-UHFFFAOYSA-N -1 1 302.132 4.074 20 0 DIADMM [O-]c1cc(F)cc(-c2nc(-c3ccc(Cl)c(F)c3)no2)c1 ZINC001216339214 1051707318 /nfs/dbraw/zinc/70/73/18/1051707318.db2.gz DMMYOLSFOBPXBL-UHFFFAOYSA-N -1 1 308.671 4.041 20 0 DIADMM [O-]c1cc(F)c(Nc2c(Cl)cc(CO)cc2Cl)cc1F ZINC001216364992 1051723152 /nfs/dbraw/zinc/72/31/52/1051723152.db2.gz RZGSSZRCWSDZCT-UHFFFAOYSA-N -1 1 320.122 4.213 20 0 DIADMM Cc1cc(F)cc(Cl)c1Nc1ccc(-n2ccc(=O)[n-]2)cc1 ZINC001216405096 1051751136 /nfs/dbraw/zinc/75/11/36/1051751136.db2.gz ZLACXDFNDWVIDR-UHFFFAOYSA-N -1 1 317.751 4.422 20 0 DIADMM CCc1cc(=O)[n-]c(SCCSc2ccc(C)c(C)c2)n1 ZINC000767058665 1051751128 /nfs/dbraw/zinc/75/11/28/1051751128.db2.gz ZTZMMEZMQXHANG-UHFFFAOYSA-N -1 1 320.483 4.246 20 0 DIADMM [O-]c1cc(Cl)c(Nc2cc(F)cc(CO)c2)cc1Cl ZINC001212747591 1051778089 /nfs/dbraw/zinc/77/80/89/1051778089.db2.gz NLQRPHVMZPTFAW-UHFFFAOYSA-N -1 1 302.132 4.074 20 0 DIADMM O=C(Nc1cc(Cl)cc(Cl)c1)c1ccc([O-])c(F)c1 ZINC000767245318 1051782663 /nfs/dbraw/zinc/78/26/63/1051782663.db2.gz FMQNWVJDCMENCC-UHFFFAOYSA-N -1 1 300.116 4.090 20 0 DIADMM O=C(c1cc2ccccc2cc1[O-])N(Cc1cccs1)C1CC1 ZINC000219951132 1051813596 /nfs/dbraw/zinc/81/35/96/1051813596.db2.gz WTXBZPWWYQVMSO-UHFFFAOYSA-N -1 1 323.417 4.412 20 0 DIADMM CC(C)c1ccccc1S(=O)(=O)[N-]c1cccc2[nH]ccc21 ZINC000188984044 1051864559 /nfs/dbraw/zinc/86/45/59/1051864559.db2.gz RZZOFNXSXHBORX-UHFFFAOYSA-N -1 1 314.410 4.092 20 0 DIADMM CCCCN(C)c1ccc(NC(=O)c2ccc([O-])c(F)c2)cc1 ZINC000767993537 1051872491 /nfs/dbraw/zinc/87/24/91/1051872491.db2.gz ILABQEVBJRRXKN-UHFFFAOYSA-N -1 1 316.376 4.020 20 0 DIADMM COc1cccc(OC)c1Nc1ccc(Cl)c(Cl)c1[O-] ZINC001173922905 1051881601 /nfs/dbraw/zinc/88/16/01/1051881601.db2.gz OLKCZKWCFOBUGD-UHFFFAOYSA-N -1 1 314.168 4.460 20 0 DIADMM [O-]c1ccc(F)c(-c2nc(-c3ccc(Cl)cc3)no2)c1F ZINC001216921818 1051908980 /nfs/dbraw/zinc/90/89/80/1051908980.db2.gz AJEXVOQBABMEQB-UHFFFAOYSA-N -1 1 308.671 4.041 20 0 DIADMM Cc1cc(-c2noc(-c3cc([O-])cc(F)c3F)n2)cc(C)c1F ZINC001216924046 1051910995 /nfs/dbraw/zinc/91/09/95/1051910995.db2.gz WIKBZALCFASTBI-UHFFFAOYSA-N -1 1 320.270 4.143 20 0 DIADMM CC(C)Oc1c(F)cc(-c2cc(F)c([O-])c(F)c2)cc1F ZINC001244097507 1051913108 /nfs/dbraw/zinc/91/31/08/1051913108.db2.gz WCRQGLMITNTMNB-UHFFFAOYSA-N -1 1 300.251 4.403 20 0 DIADMM Cc1ncc(-c2ccccc2)cc1NC(=O)c1ccc([O-])c(F)c1 ZINC000768322576 1051917935 /nfs/dbraw/zinc/91/79/35/1051917935.db2.gz QYTSZMOHRGBJIK-UHFFFAOYSA-N -1 1 322.339 4.154 20 0 DIADMM O=C(Nc1ccc([O-])c(Cl)c1)Nc1cccc(Cl)c1F ZINC000190923199 1051954022 /nfs/dbraw/zinc/95/40/22/1051954022.db2.gz LHXRRDAJQILDKA-UHFFFAOYSA-N -1 1 315.131 4.482 20 0 DIADMM COc1ccc(C)cc1NC(=O)Nc1ccc([O-])c(Cl)c1 ZINC000190917889 1051954272 /nfs/dbraw/zinc/95/42/72/1051954272.db2.gz QSKJZTIWPNGHKM-UHFFFAOYSA-N -1 1 306.749 4.007 20 0 DIADMM COc1ccc(NC(=O)Nc2ccc([O-])c(Cl)c2)c(C)c1 ZINC000190958980 1051955669 /nfs/dbraw/zinc/95/56/69/1051955669.db2.gz BWABLRBULWYOOU-UHFFFAOYSA-N -1 1 306.749 4.007 20 0 DIADMM CCOc1ccc(NC(=O)Nc2ccc([O-])c(Cl)c2)cc1F ZINC000190949858 1051955878 /nfs/dbraw/zinc/95/58/78/1051955878.db2.gz QLPXHGHZLAHOPV-UHFFFAOYSA-N -1 1 324.739 4.227 20 0 DIADMM CC(=O)c1ccc(NC(=O)Nc2ccc([O-])c(Cl)c2)cc1C ZINC000190981443 1051957294 /nfs/dbraw/zinc/95/72/94/1051957294.db2.gz RMJDHUWKOKCHDR-UHFFFAOYSA-N -1 1 318.760 4.201 20 0 DIADMM [O-]c1c(-c2nc(-c3ccccc3Cl)no2)ccc2cccnc21 ZINC001217141591 1051976122 /nfs/dbraw/zinc/97/61/22/1051976122.db2.gz HAUIIASWNITLFP-UHFFFAOYSA-N -1 1 323.739 4.311 20 0 DIADMM Cc1ccc(-c2noc(-c3ccc4cccnc4c3[O-])n2)cc1C ZINC001217141305 1051976838 /nfs/dbraw/zinc/97/68/38/1051976838.db2.gz BOKLIZSFNYIEEC-UHFFFAOYSA-N -1 1 317.348 4.274 20 0 DIADMM [O-]c1cc2c(O)cccc2cc1-c1nc(-c2cccc(F)c2)no1 ZINC001217161829 1051984937 /nfs/dbraw/zinc/98/49/37/1051984937.db2.gz UJLYWQFIWGFMDI-UHFFFAOYSA-N -1 1 322.295 4.107 20 0 DIADMM CC(C)Oc1cccc(Nc2ccc(-n3ccc(=O)[n-]3)cc2)c1 ZINC001174115868 1051988256 /nfs/dbraw/zinc/98/82/56/1051988256.db2.gz PKIQOXLFKRYGGH-UHFFFAOYSA-N -1 1 309.369 4.109 20 0 DIADMM CC(C)(C)c1nnc([N-]c2ccc(C(=O)c3ccccc3)cc2)o1 ZINC001174223070 1052059417 /nfs/dbraw/zinc/05/94/17/1052059417.db2.gz UBLXKLDBTIBLRF-UHFFFAOYSA-N -1 1 321.380 4.342 20 0 DIADMM Cc1ncccc1-c1noc(-c2ccc3sccc3c2[O-])n1 ZINC001217514763 1052078825 /nfs/dbraw/zinc/07/88/25/1052078825.db2.gz WPELXBCBHJKXCG-UHFFFAOYSA-N -1 1 309.350 4.027 20 0 DIADMM COc1ccccc1-c1noc(-c2ccc3sccc3c2[O-])n1 ZINC001217514918 1052079736 /nfs/dbraw/zinc/07/97/36/1052079736.db2.gz YHPVWNCMWZSWJP-UHFFFAOYSA-N -1 1 324.361 4.333 20 0 DIADMM O=C(c1c([O-])cccc1Cl)N1CCC[C@@H]1c1ccccc1 ZINC000769636735 1052085701 /nfs/dbraw/zinc/08/57/01/1052085701.db2.gz HJJIIZVXJBXFHE-CQSZACIVSA-N -1 1 301.773 4.023 20 0 DIADMM CC[C@H]1c2ccsc2CCN1C(=O)c1c([O-])cccc1Cl ZINC000769694983 1052092612 /nfs/dbraw/zinc/09/26/12/1052092612.db2.gz VQTHKKZNGWRLGR-LBPRGKRZSA-N -1 1 321.829 4.257 20 0 DIADMM Cc1ccc2ccc(-c3nc(-c4cccc(F)c4)no3)c([O-])c2n1 ZINC001217583445 1052102721 /nfs/dbraw/zinc/10/27/21/1052102721.db2.gz PGHLGSBGGJTLCT-UHFFFAOYSA-N -1 1 321.311 4.105 20 0 DIADMM Cn1cnc2ccc(Nc3ccc(Cl)c(Cl)c3[O-])cc21 ZINC001174349774 1052114087 /nfs/dbraw/zinc/11/40/87/1052114087.db2.gz IDQBHKJENABDGO-UHFFFAOYSA-N -1 1 308.168 4.329 20 0 DIADMM CCCCN(C(=O)c1ncc(C)cc1[O-])[C@H](C)c1ccccc1 ZINC000494828038 1052138537 /nfs/dbraw/zinc/13/85/37/1052138537.db2.gz ABNJCISGKXEVSL-OAHLLOKOSA-N -1 1 312.413 4.099 20 0 DIADMM Cc1sccc1Nc1ccc(F)c(Br)c1[O-] ZINC001174461051 1052179460 /nfs/dbraw/zinc/17/94/60/1052179460.db2.gz IWQXHDKJJRPJSE-UHFFFAOYSA-N -1 1 302.168 4.407 20 0 DIADMM COC(=O)c1nc2ccc(-c3cc(C)c(Cl)cc3F)cc2[n-]1 ZINC001222231352 1052465212 /nfs/dbraw/zinc/46/52/12/1052465212.db2.gz DPZKDILUQPLTAF-UHFFFAOYSA-N -1 1 318.735 4.117 20 0 DIADMM COC(=O)c1nc2cc(-c3cc(C)c(Cl)cc3F)ccc2[n-]1 ZINC001222231352 1052465214 /nfs/dbraw/zinc/46/52/14/1052465214.db2.gz DPZKDILUQPLTAF-UHFFFAOYSA-N -1 1 318.735 4.117 20 0 DIADMM COC(=O)c1nc2cc(-c3ccc(Cl)c(Cl)c3)ccc2[n-]1 ZINC001222351818 1052488505 /nfs/dbraw/zinc/48/85/05/1052488505.db2.gz DGNIRMAVVVZYFC-UHFFFAOYSA-N -1 1 321.163 4.323 20 0 DIADMM COC(=O)c1nc2ccc(-c3ccc(Cl)c(Cl)c3)cc2[n-]1 ZINC001222351818 1052488507 /nfs/dbraw/zinc/48/85/07/1052488507.db2.gz DGNIRMAVVVZYFC-UHFFFAOYSA-N -1 1 321.163 4.323 20 0 DIADMM Cc1oc(CN(C)[C@@H](C)c2cccc(Cl)c2)cc1C(=O)[O-] ZINC000062015261 1052617766 /nfs/dbraw/zinc/61/77/66/1052617766.db2.gz UCXNKINRSXAERV-JTQLQIEISA-N -1 1 307.777 4.133 20 0 DIADMM CC[C@H](NC(=O)c1ccc2ccccc2c1[O-])c1ccccc1 ZINC000321053200 1052621022 /nfs/dbraw/zinc/62/10/22/1052621022.db2.gz XOPLLOHAMQHBPN-SFHVURJKSA-N -1 1 305.377 4.427 20 0 DIADMM CCCN(C(=O)c1ncccc1[O-])[C@@H](C)c1cc2ccccc2o1 ZINC000123448335 1052622073 /nfs/dbraw/zinc/62/20/73/1052622073.db2.gz ZHAGDIMAAYONCA-ZDUSSCGKSA-N -1 1 324.380 4.147 20 0 DIADMM C[C@@H](c1ccco1)N(C(=O)c1ccc(Cl)cc1[O-])C1CC1 ZINC000126323285 1052668856 /nfs/dbraw/zinc/66/88/56/1052668856.db2.gz DOJUAULAOXBXSS-JTQLQIEISA-N -1 1 305.761 4.004 20 0 DIADMM O=C(Nc1cc(F)c(F)c(F)c1)c1cc2ccccc2cc1[O-] ZINC000321316095 1052669756 /nfs/dbraw/zinc/66/97/56/1052669756.db2.gz NFRIAEKIIHEILO-UHFFFAOYSA-N -1 1 317.266 4.215 20 0 DIADMM CC(C)Oc1cc(F)c(F)cc1Nc1c([O-])cc(F)cc1F ZINC001212224826 1052705633 /nfs/dbraw/zinc/70/56/33/1052705633.db2.gz AICNLACXHFZANU-UHFFFAOYSA-N -1 1 315.266 4.479 20 0 DIADMM Cc1ccc(N(C)C(=O)c2cc3ccccc3cc2[O-])cc1C ZINC000917804798 1052759497 /nfs/dbraw/zinc/75/94/97/1052759497.db2.gz GTDKIQFLKHKLDU-UHFFFAOYSA-N -1 1 305.377 4.439 20 0 DIADMM CC(=O)c1ccc([O-])cc1OCc1ccc(C)cc1OC(C)C ZINC001225618386 1052808675 /nfs/dbraw/zinc/80/86/75/1052808675.db2.gz CUOGGOKBFKMEHT-UHFFFAOYSA-N -1 1 314.381 4.269 20 0 DIADMM CCCCC(=O)[C@H](CCCC)Oc1cc([O-])ccc1C(C)=O ZINC001225620289 1052808844 /nfs/dbraw/zinc/80/88/44/1052808844.db2.gz ZKTXBYXNKPTVOL-KRWDZBQOSA-N -1 1 306.402 4.292 20 0 DIADMM O=C(c1ccc([O-])cc1)c1ccc(O[C@@H]2CCCC[C@H]2F)cc1 ZINC001225807550 1052833881 /nfs/dbraw/zinc/83/38/81/1052833881.db2.gz IPWHGHUMBJXLCA-QZTJIDSGSA-N -1 1 314.356 4.283 20 0 DIADMM COc1cnc(=S)[n-]c1O[C@@H](C)c1ccc2ccccc2c1 ZINC001226242029 1052880119 /nfs/dbraw/zinc/88/01/19/1052880119.db2.gz GTWBSCWTCUQDJC-NSHDSACASA-N -1 1 312.394 4.067 20 0 DIADMM Cc1ccc2c(c1)CC[C@H]2Oc1cc([O-])cc2oc(=O)cc(C)c12 ZINC001226489508 1052902592 /nfs/dbraw/zinc/90/25/92/1052902592.db2.gz LFUGJMWQWRTDDP-MRXNPFEDSA-N -1 1 322.360 4.182 20 0 DIADMM C[C@H](Cc1ccccc1Cl)NC(=O)c1c([O-])cccc1Cl ZINC000920451067 1052940289 /nfs/dbraw/zinc/94/02/89/1052940289.db2.gz LDXIFBIPPBGQFA-SNVBAGLBSA-N -1 1 324.207 4.060 20 0 DIADMM O=C(N[C@@H]1CCc2c1cccc2Cl)c1c([O-])cccc1Cl ZINC000920462704 1052940962 /nfs/dbraw/zinc/94/09/62/1052940962.db2.gz HYPRINWHCHGXET-CYBMUJFWSA-N -1 1 322.191 4.116 20 0 DIADMM C[C@@H](NC(=O)c1c([O-])cccc1Cl)c1ccc(Cl)cc1 ZINC000920427761 1052941062 /nfs/dbraw/zinc/94/10/62/1052941062.db2.gz KBFPLWLGUSICJM-SECBINFHSA-N -1 1 310.180 4.190 20 0 DIADMM O=c1[n-]cncc1O[C@H](/C=C/c1ccccc1)c1ccccc1 ZINC001227052247 1052956822 /nfs/dbraw/zinc/95/68/22/1052956822.db2.gz XLWRSABZVZUIAP-FMQWLBJXSA-N -1 1 304.349 4.016 20 0 DIADMM O=c1[n-]cncc1O[C@@H](/C=C/c1ccccc1)c1ccccc1 ZINC001227052244 1052956843 /nfs/dbraw/zinc/95/68/43/1052956843.db2.gz XLWRSABZVZUIAP-FLVLSHQESA-N -1 1 304.349 4.016 20 0 DIADMM COCC(=O)c1ccc([O-])cc1OC(CC(C)C)CC(C)C ZINC001227169308 1052967092 /nfs/dbraw/zinc/96/70/92/1052967092.db2.gz RDEDYWJDMZDUHG-UHFFFAOYSA-N -1 1 308.418 4.061 20 0 DIADMM C[C@@H](Oc1[n-]c(=S)ncc1F)c1ccc(Cl)cc1Cl ZINC001227382177 1052986973 /nfs/dbraw/zinc/98/69/73/1052986973.db2.gz AZWDUIBLMQSELE-ZCFIWIBFSA-N -1 1 319.188 4.351 20 0 DIADMM CCC[C@H](CC(=O)OCC)Oc1cc(Cl)c([O-])cc1Cl ZINC001227640639 1053005784 /nfs/dbraw/zinc/00/57/84/1053005784.db2.gz FNTZEBLEGAQLHN-SECBINFHSA-N -1 1 321.200 4.200 20 0 DIADMM CC1(C)CC(=O)CC[C@H]1Oc1cc(Cl)c([O-])cc1Cl ZINC001227642229 1053006067 /nfs/dbraw/zinc/00/60/67/1053006067.db2.gz WRYQWPVJOGVNBU-CYBMUJFWSA-N -1 1 303.185 4.226 20 0 DIADMM [O-]c1cc(Cl)c(O[C@@H]2COCc3ccccc32)cc1Cl ZINC001227641529 1053006077 /nfs/dbraw/zinc/00/60/77/1053006077.db2.gz OWKKKKBXHDTMSS-OAHLLOKOSA-N -1 1 311.164 4.349 20 0 DIADMM C[C@H](Oc1[n-]c(=S)nc2cnccc21)c1cccc(F)c1F ZINC001227883471 1053025044 /nfs/dbraw/zinc/02/50/44/1053025044.db2.gz AEAREXUPPLZTQL-QMMMGPOBSA-N -1 1 319.336 4.106 20 0 DIADMM Cc1cccc2c1CC[C@H]2Oc1[n-]c(=S)nc2cnccc21 ZINC001227881940 1053025493 /nfs/dbraw/zinc/02/54/93/1053025493.db2.gz RSBUMOJOGGUBIU-OAHLLOKOSA-N -1 1 309.394 4.062 20 0 DIADMM C[C@@H](Oc1[n-]c(=S)nc2cnccc21)c1cccc(Cl)c1 ZINC001227886694 1053026023 /nfs/dbraw/zinc/02/60/23/1053026023.db2.gz XDKSLUKLGJEEOU-SECBINFHSA-N -1 1 317.801 4.481 20 0 DIADMM O=C(c1ccccc1)c1ccc([O-])cc1OC(C1CC1)C1CC1 ZINC001228185370 1053051275 /nfs/dbraw/zinc/05/12/75/1053051275.db2.gz IYWRIWHANZJKHY-UHFFFAOYSA-N -1 1 308.377 4.191 20 0 DIADMM C[C@@H](Oc1cc([O-])ccc1C(=O)c1ccccc1)c1ccco1 ZINC001228187070 1053051794 /nfs/dbraw/zinc/05/17/94/1053051794.db2.gz YMYNYFZVHHTBBZ-CYBMUJFWSA-N -1 1 308.333 4.356 20 0 DIADMM CC[C@H](C)[C@H](C)N(C(=O)NCc1ccc([O-])c(Cl)c1)C1CC1 ZINC001313236709 1053096984 /nfs/dbraw/zinc/09/69/84/1053096984.db2.gz OLWLNUOJIRMBLD-RYUDHWBXSA-N -1 1 324.852 4.154 20 0 DIADMM CCc1nc(SCCSC2CCCCC2)[n-]c(=O)c1C ZINC000849921437 1053117507 /nfs/dbraw/zinc/11/75/07/1053117507.db2.gz LPSVEEMJQHGNKS-UHFFFAOYSA-N -1 1 312.504 4.211 20 0 DIADMM CCC(=O)c1c(O)cc([O-])cc1O[C@@H](c1ccccc1)C1CC1 ZINC001228560847 1053134579 /nfs/dbraw/zinc/13/45/79/1053134579.db2.gz USVXMSQXFFHISH-IBGZPJMESA-N -1 1 312.365 4.221 20 0 DIADMM C[C@@H](Oc1[n-]c(=S)nc2ccccc21)c1c(F)cccc1F ZINC001228760252 1053178406 /nfs/dbraw/zinc/17/84/06/1053178406.db2.gz KYTYUOCALWIVEF-SECBINFHSA-N -1 1 318.348 4.337 20 0 DIADMM C[C@H](Oc1[n-]c(=S)nc2ccccc21)c1ccc(F)cc1 ZINC001228765686 1053178744 /nfs/dbraw/zinc/17/87/44/1053178744.db2.gz OKAYSUIEGVMXGP-JTQLQIEISA-N -1 1 300.358 4.198 20 0 DIADMM COc1cccc([C@@H](C)Oc2[n-]c(=S)nc3ccccc32)c1 ZINC001228766980 1053178872 /nfs/dbraw/zinc/17/88/72/1053178872.db2.gz YEXXLIRAOQVSCI-LLVKDONJSA-N -1 1 312.394 4.067 20 0 DIADMM O=C(Nc1ccccc1N1CCCCCC1)c1ccccc1[O-] ZINC000617960420 1053220156 /nfs/dbraw/zinc/22/01/56/1053220156.db2.gz GKZZJGBMLJIHRO-UHFFFAOYSA-N -1 1 310.397 4.025 20 0 DIADMM O=c1ccc2c(O[C@H](c3ccccc3)C3CC3)cc([O-])cc2o1 ZINC001229128787 1053253242 /nfs/dbraw/zinc/25/32/42/1053253242.db2.gz DDPKSNBFYYOMHC-LJQANCHMSA-N -1 1 308.333 4.029 20 0 DIADMM CCC[C@H](Oc1cc([O-])cc2oc(=O)ccc12)c1ccccc1 ZINC001229134188 1053254680 /nfs/dbraw/zinc/25/46/80/1053254680.db2.gz FWDBSJSRKDNHFJ-INIZCTEOSA-N -1 1 310.349 4.419 20 0 DIADMM C[C@@H](Oc1cc([O-])cc2oc(=O)ccc12)c1cccc(Cl)c1 ZINC001229131408 1053255767 /nfs/dbraw/zinc/25/57/67/1053255767.db2.gz IEDWJJIMERAJNO-SNVBAGLBSA-N -1 1 316.740 4.292 20 0 DIADMM Cc1ccccc1C(F)(F)C(=O)[N-][C@@H](C(C)(C)C)C(F)(F)F ZINC001319607084 1053256784 /nfs/dbraw/zinc/25/67/84/1053256784.db2.gz MVKWZZCJCZOZNH-NSHDSACASA-N -1 1 323.305 4.180 20 0 DIADMM CCCCC[C@H](CC)Oc1c([O-])c(OC)cc2ccc(=O)oc21 ZINC001229218583 1053275404 /nfs/dbraw/zinc/27/54/04/1053275404.db2.gz OMSMSCOGXHYUCA-ZDUSSCGKSA-N -1 1 320.385 4.245 20 0 DIADMM CCC(CC)[C@H](CC)Oc1c([O-])c(OC)cc2ccc(=O)oc21 ZINC001229217187 1053275948 /nfs/dbraw/zinc/27/59/48/1053275948.db2.gz ZCFLSDCPVIOHMF-ZDUSSCGKSA-N -1 1 320.385 4.101 20 0 DIADMM CCC[C@@H](C)[C@@H](CC)Oc1c([O-])c(OC)cc2ccc(=O)oc21 ZINC001229216405 1053276074 /nfs/dbraw/zinc/27/60/74/1053276074.db2.gz QHGQLHUIFYBMFD-DGCLKSJQSA-N -1 1 320.385 4.101 20 0 DIADMM CCC[C@H](Oc1c([O-])c(OC)cc2ccc(=O)oc21)[C@@H](C)CC ZINC001229215568 1053276237 /nfs/dbraw/zinc/27/62/37/1053276237.db2.gz MAKPMNQGNJXJGV-AAEUAGOBSA-N -1 1 320.385 4.101 20 0 DIADMM CCC[C@@H](Oc1c([O-])c(OC)cc2ccc(=O)oc21)[C@H](C)CC ZINC001229215574 1053276350 /nfs/dbraw/zinc/27/63/50/1053276350.db2.gz MAKPMNQGNJXJGV-DGCLKSJQSA-N -1 1 320.385 4.101 20 0 DIADMM C[C@@H](C(=O)Nc1ccc([O-])c(Cl)c1)c1ccc(F)cc1F ZINC001319949820 1053288419 /nfs/dbraw/zinc/28/84/19/1053288419.db2.gz MWIVDWDNPCGHCJ-MRVPVSSYSA-N -1 1 311.715 4.066 20 0 DIADMM CCC(=O)c1ccc([O-])cc1O[C@H](C)c1ccc(OC)cc1 ZINC001229475333 1053330557 /nfs/dbraw/zinc/33/05/57/1053330557.db2.gz UVBZAALCKCDDSS-GFCCVEGCSA-N -1 1 300.354 4.134 20 0 DIADMM CCC(=O)c1ccc([O-])cc1O[C@H](C)c1cccnc1Cl ZINC001229475029 1053332084 /nfs/dbraw/zinc/33/20/84/1053332084.db2.gz PRLNHYLREBZNIX-SNVBAGLBSA-N -1 1 305.761 4.173 20 0 DIADMM CCC(=O)c1ccc([O-])cc1O[C@@H](C)COc1ccccc1C ZINC001229476130 1053333948 /nfs/dbraw/zinc/33/39/48/1053333948.db2.gz GBPFLQYRCUWAEQ-AWEZNQCLSA-N -1 1 314.381 4.140 20 0 DIADMM CCCCCNC(=S)Nc1cc(Cl)c(Cl)cc1[O-] ZINC001200057395 1053341489 /nfs/dbraw/zinc/34/14/89/1053341489.db2.gz VHYPWOWNCWNORH-UHFFFAOYSA-N -1 1 307.246 4.176 20 0 DIADMM Cc1cccc(C)c1C(=O)Nc1ccc(Br)c([O-])c1 ZINC001321111311 1053391022 /nfs/dbraw/zinc/39/10/22/1053391022.db2.gz QFYSOGMTGXXKMT-UHFFFAOYSA-N -1 1 320.186 4.024 20 0 DIADMM CC(C)CC(C)(C)C(=O)Nc1ccc(Br)c([O-])c1 ZINC001321147224 1053394641 /nfs/dbraw/zinc/39/46/41/1053394641.db2.gz ADGKZVIOBJANDT-UHFFFAOYSA-N -1 1 314.223 4.166 20 0 DIADMM O=C(/C=C\C1CCCCC1)Nc1ccc(Br)c([O-])c1 ZINC001321151782 1053395373 /nfs/dbraw/zinc/39/53/73/1053395373.db2.gz ZJDCBBPGPGDISN-TWGQIWQCSA-N -1 1 324.218 4.230 20 0 DIADMM CCCCCCC(=O)Nc1ccc(Br)c([O-])c1 ZINC001321584093 1053422400 /nfs/dbraw/zinc/42/24/00/1053422400.db2.gz XBORZMVODMXARE-UHFFFAOYSA-N -1 1 300.196 4.064 20 0 DIADMM Cc1ccc(N(CC(C)C)C(=O)c2ccc([O-])c(F)c2)c(C)c1 ZINC001300326695 1053593750 /nfs/dbraw/zinc/59/37/50/1053593750.db2.gz RTVJANJKHBSFJR-UHFFFAOYSA-N -1 1 315.388 4.451 20 0 DIADMM Cc1ccc(N(CC(C)C)C(=O)c2cc(F)ccc2[O-])c(C)c1 ZINC001300326204 1053594024 /nfs/dbraw/zinc/59/40/24/1053594024.db2.gz JQHBTAWCZYWSJD-UHFFFAOYSA-N -1 1 315.388 4.451 20 0 DIADMM Clc1cc2[n-]c(O[C@@H]3CCc4ccccc43)nc2c(Cl)n1 ZINC001231045380 1053660971 /nfs/dbraw/zinc/66/09/71/1053660971.db2.gz VUWJFOYIGNVWTE-LLVKDONJSA-N -1 1 320.179 4.331 20 0 DIADMM Clc1cc2nc(O[C@@H]3CCc4ccccc43)[n-]c2c(Cl)n1 ZINC001231045380 1053660979 /nfs/dbraw/zinc/66/09/79/1053660979.db2.gz VUWJFOYIGNVWTE-LLVKDONJSA-N -1 1 320.179 4.331 20 0 DIADMM Cc1ccc([C@H](C)Oc2nc3c(cc(Cl)nc3Cl)[n-]2)cn1 ZINC001231048098 1053661258 /nfs/dbraw/zinc/66/12/58/1053661258.db2.gz GENWTRVJGWVOPL-QMMMGPOBSA-N -1 1 323.183 4.108 20 0 DIADMM Cc1ccc([C@H](C)Oc2nc3cc(Cl)nc(Cl)c3[n-]2)cn1 ZINC001231048098 1053661264 /nfs/dbraw/zinc/66/12/64/1053661264.db2.gz GENWTRVJGWVOPL-QMMMGPOBSA-N -1 1 323.183 4.108 20 0 DIADMM [O-]c1cccnc1-c1ncccc1O[C@H]1CCCc2ccccc21 ZINC001231199217 1053698592 /nfs/dbraw/zinc/69/85/92/1053698592.db2.gz CYTCZMPBPXRGHK-KRWDZBQOSA-N -1 1 318.376 4.306 20 0 DIADMM CC(C)C[C@H](Oc1cccnc1-c1ncccc1[O-])C(C)C ZINC001231200290 1053699112 /nfs/dbraw/zinc/69/91/12/1053699112.db2.gz LGUBHTVIHSTIQN-INIZCTEOSA-N -1 1 300.402 4.299 20 0 DIADMM CCC[C@H](Oc1cccnc1-c1ncccc1[O-])C(C)(C)C ZINC001231200618 1053699402 /nfs/dbraw/zinc/69/94/02/1053699402.db2.gz QENDRRYHFPCXJM-HNNXBMFYSA-N -1 1 300.402 4.443 20 0 DIADMM Cc1ccccc1[C@@H](C)Oc1cccnc1-c1ncccc1[O-] ZINC001231200955 1053700923 /nfs/dbraw/zinc/70/09/23/1053700923.db2.gz VSIIXRYXCQRPQA-CQSZACIVSA-N -1 1 306.365 4.298 20 0 DIADMM Cc1ccc([C@@H](C)Oc2cccnc2-c2ncccc2[O-])cc1 ZINC001231203249 1053701337 /nfs/dbraw/zinc/70/13/37/1053701337.db2.gz HMQXETHTZMCODS-CQSZACIVSA-N -1 1 306.365 4.298 20 0 DIADMM CC(C)CCC[C@H](C)Oc1cccnc1-c1ncccc1[O-] ZINC001231200655 1053701508 /nfs/dbraw/zinc/70/15/08/1053701508.db2.gz RNASUNAJAZLDBO-AWEZNQCLSA-N -1 1 300.402 4.443 20 0 DIADMM O=C(c1ccc([O-])cc1)c1ccccc1O[C@@H]1CCCC[C@H]1F ZINC001231229388 1053705410 /nfs/dbraw/zinc/70/54/10/1053705410.db2.gz BXELCULPCPTWBN-SJLPKXTDSA-N -1 1 314.356 4.283 20 0 DIADMM C[C@H](Oc1ccccc1C(=O)c1ccc([O-])cc1)c1ccncc1 ZINC001231228986 1053705660 /nfs/dbraw/zinc/70/56/60/1053705660.db2.gz MAPDRANBRHUCAB-AWEZNQCLSA-N -1 1 319.360 4.158 20 0 DIADMM O=C(c1ccc([O-])cc1)c1ccccc1O[C@@H]1CCCC[C@@H]1F ZINC001231229387 1053706235 /nfs/dbraw/zinc/70/62/35/1053706235.db2.gz BXELCULPCPTWBN-FUHWJXTLSA-N -1 1 314.356 4.283 20 0 DIADMM O=C([O-])c1ccc(CN2CCC[C@H]2c2ccc(Cl)cc2)s1 ZINC001231463929 1053756744 /nfs/dbraw/zinc/75/67/44/1053756744.db2.gz VWAVZFQZSBIBQH-AWEZNQCLSA-N -1 1 321.829 4.437 20 0 DIADMM O=C([O-])c1ccc(CN2CCC[C@@H]2c2ccccc2Cl)s1 ZINC001231463950 1053759001 /nfs/dbraw/zinc/75/90/01/1053759001.db2.gz WZRBIKKAHXKYNI-CQSZACIVSA-N -1 1 321.829 4.437 20 0 DIADMM [O-]c1c(F)cccc1NC(=S)Nc1ccc(F)c(Cl)c1 ZINC001200589701 1053795540 /nfs/dbraw/zinc/79/55/40/1053795540.db2.gz PATIFSLSRNKFCD-UHFFFAOYSA-N -1 1 314.744 4.133 20 0 DIADMM [O-]c1cc(CN2CCc3c(Cl)cccc3C2)ccc1Cl ZINC001231736213 1053843722 /nfs/dbraw/zinc/84/37/22/1053843722.db2.gz FMNAVXOFMVKNKL-UHFFFAOYSA-N -1 1 308.208 4.257 20 0 DIADMM COC(C)(C)[C@@H]1CCCN1Cc1ccc(Cl)c([O-])c1Cl ZINC001232631605 1054089199 /nfs/dbraw/zinc/08/91/99/1054089199.db2.gz OCUHVKRYXOPOGA-LBPRGKRZSA-N -1 1 318.244 4.088 20 0 DIADMM Cc1ccc(NC(=O)c2ccc(C(F)(F)F)cc2[O-])c(F)c1 ZINC000622287116 1054148061 /nfs/dbraw/zinc/14/80/61/1054148061.db2.gz YMTJCIYTOCTEBJ-UHFFFAOYSA-N -1 1 313.250 4.111 20 0 DIADMM CCc1ccccc1NC(=O)c1ccc(C(F)(F)F)cc1[O-] ZINC000622291575 1054151474 /nfs/dbraw/zinc/15/14/74/1054151474.db2.gz PUCLGEKUBKODHX-UHFFFAOYSA-N -1 1 309.287 4.226 20 0 DIADMM COc1cccc([C@H]2CCCN2Cc2ccc(F)c([O-])c2F)c1 ZINC001232937972 1054152264 /nfs/dbraw/zinc/15/22/64/1054152264.db2.gz XLJPGRFAKWZJIV-MRXNPFEDSA-N -1 1 319.351 4.016 20 0 DIADMM [O-]c1cc(CN2CCC[C@H]2c2ccccc2F)cc(F)c1F ZINC001232972208 1054161143 /nfs/dbraw/zinc/16/11/43/1054161143.db2.gz WNJYFKINMRHJPD-HNNXBMFYSA-N -1 1 307.315 4.147 20 0 DIADMM CCCN(CC1CCCCC1)C(=O)c1c(F)ccc([O-])c1F ZINC000622323693 1054163999 /nfs/dbraw/zinc/16/39/99/1054163999.db2.gz OLQIHGZDOMZZAH-UHFFFAOYSA-N -1 1 311.372 4.103 20 0 DIADMM Cc1cc(OC(C)C)ccc1NC(=O)c1c(F)ccc([O-])c1F ZINC000622318394 1054170843 /nfs/dbraw/zinc/17/08/43/1054170843.db2.gz MGGSEMDEGKFHHR-UHFFFAOYSA-N -1 1 321.323 4.018 20 0 DIADMM [O-]c1cnc(Cl)cc1CN1CCC[C@@H]1c1cc(F)cc(F)c1 ZINC001233041094 1054177736 /nfs/dbraw/zinc/17/77/36/1054177736.db2.gz RJLPKTFGMXIURJ-CQSZACIVSA-N -1 1 324.758 4.056 20 0 DIADMM CC(C)c1ccc(C(=O)N2CCc3c2cccc3Cl)c([O-])c1 ZINC000622427731 1054217907 /nfs/dbraw/zinc/21/79/07/1054217907.db2.gz FMENVKBASLNHJR-UHFFFAOYSA-N -1 1 315.800 4.372 20 0 DIADMM CC(C)C[C@H]1CCCN(C(=O)c2cc3ccccc3cc2[O-])C1 ZINC000622433884 1054225354 /nfs/dbraw/zinc/22/53/54/1054225354.db2.gz SNQYKXSGJRJVBJ-OAHLLOKOSA-N -1 1 311.425 4.444 20 0 DIADMM CC(C)c1ccc([C@@H]2CCCCN2C(=O)c2cncc([O-])c2)cc1 ZINC000622471944 1054242102 /nfs/dbraw/zinc/24/21/02/1054242102.db2.gz NOGGPYLAMTVOOU-IBGZPJMESA-N -1 1 324.424 4.278 20 0 DIADMM Oc1ccc(F)c(C[N@H+]2CCC[C@H](Cc3ccccc3)C2)c1F ZINC001233395933 1054259596 /nfs/dbraw/zinc/25/95/96/1054259596.db2.gz ZYUQXDWMAKDXJA-OAHLLOKOSA-N -1 1 317.379 4.125 20 0 DIADMM CCCC(=O)c1ccc([O-])cc1O[C@H]1COCc2ccccc21 ZINC001233651355 1054321373 /nfs/dbraw/zinc/32/13/73/1054321373.db2.gz YQCFPVOUYHKTBC-IBGZPJMESA-N -1 1 312.365 4.025 20 0 DIADMM CCCC(=O)c1ccc([O-])cc1O[C@H](C)COc1ccccc1 ZINC001233651048 1054322596 /nfs/dbraw/zinc/32/25/96/1054322596.db2.gz XGGJXLZJBDTVNV-CQSZACIVSA-N -1 1 314.381 4.221 20 0 DIADMM CN(C(=O)c1cc(F)ccc1[O-])C1CC(C)(C)CC(C)(C)C1 ZINC000622750085 1054367444 /nfs/dbraw/zinc/36/74/44/1054367444.db2.gz YQBLCLAPGMHUDT-UHFFFAOYSA-N -1 1 307.409 4.208 20 0 DIADMM CC[C@@H](NC(=O)c1c([O-])cccc1F)c1ccc(Cl)cc1 ZINC001440820771 1054368782 /nfs/dbraw/zinc/36/87/82/1054368782.db2.gz PVZICVBLQZCMPT-CYBMUJFWSA-N -1 1 307.752 4.066 20 0 DIADMM Cc1cccc([C@@H](NC(=O)c2cc(F)ccc2[O-])C(C)(C)C)c1 ZINC001442058332 1054408046 /nfs/dbraw/zinc/40/80/46/1054408046.db2.gz ZHMXJYVVSGYTPQ-QGZVFWFLSA-N -1 1 315.388 4.357 20 0 DIADMM Cc1ccc2c(c1)S[C@H](C(=O)Nc1ccc([O-])c(Cl)c1)C2 ZINC001342033398 1054413954 /nfs/dbraw/zinc/41/39/54/1054413954.db2.gz BGTUFRDLKCIHNU-HNNXBMFYSA-N -1 1 319.813 4.010 20 0 DIADMM CC(C)N(CCc1ccccc1)C(=O)c1cc(Cl)ccc1[O-] ZINC001442385522 1054419129 /nfs/dbraw/zinc/41/91/29/1054419129.db2.gz CMHGLLJEWIVFNO-UHFFFAOYSA-N -1 1 317.816 4.139 20 0 DIADMM C[C@H](CC(C)(C)c1ccccc1)NC(=O)c1ccc(F)c([O-])c1 ZINC001442600040 1054427347 /nfs/dbraw/zinc/42/73/47/1054427347.db2.gz RDAJIGMEUXCPRF-CYBMUJFWSA-N -1 1 315.388 4.018 20 0 DIADMM Cc1cccc(C2(NC(=O)c3cc(F)ccc3[O-])CCCC2)c1 ZINC001443142395 1054441009 /nfs/dbraw/zinc/44/10/09/1054441009.db2.gz LYAKRTKGSLEDLG-UHFFFAOYSA-N -1 1 313.372 4.039 20 0 DIADMM O=C(CCC1CCCC1)Nc1ccc(Br)c([O-])c1 ZINC001343489336 1054446199 /nfs/dbraw/zinc/44/61/99/1054446199.db2.gz GNFNAGZFBYJVMZ-UHFFFAOYSA-N -1 1 312.207 4.064 20 0 DIADMM CC(C)[C@@H](NC(=O)c1ccc([O-])c(F)c1)c1ccccc1Cl ZINC001444019394 1054465399 /nfs/dbraw/zinc/46/53/99/1054465399.db2.gz NUAMGRVLJLGKKX-MRXNPFEDSA-N -1 1 321.779 4.312 20 0 DIADMM C[C@H]1CCCC[C@@H]1CCNC(=O)c1ccc2ccccc2c1[O-] ZINC001444070599 1054467570 /nfs/dbraw/zinc/46/75/70/1054467570.db2.gz PAGTVRPHXXTPJJ-LSDHHAIUSA-N -1 1 311.425 4.492 20 0 DIADMM C[C@@H]1CCCC[C@@H]1CCNC(=O)c1ccc2ccccc2c1[O-] ZINC001444070598 1054468482 /nfs/dbraw/zinc/46/84/82/1054468482.db2.gz PAGTVRPHXXTPJJ-HUUCEWRRSA-N -1 1 311.425 4.492 20 0 DIADMM CCC(CC)(CC)C(=O)Nc1ccc(Br)c([O-])c1 ZINC001344476128 1054470247 /nfs/dbraw/zinc/47/02/47/1054470247.db2.gz GVGVEXHCOTZBOV-UHFFFAOYSA-N -1 1 314.223 4.310 20 0 DIADMM CCC[C@@H](CCc1ccccc1)NC(=O)c1c([O-])cccc1F ZINC001444677995 1054483093 /nfs/dbraw/zinc/48/30/93/1054483093.db2.gz VDCWZZIPPDTPFU-HNNXBMFYSA-N -1 1 315.388 4.063 20 0 DIADMM C[C@H](NC(=O)c1ccc2ccccc2c1[O-])[C@@H](C)c1ccccc1 ZINC001445149804 1054496391 /nfs/dbraw/zinc/49/63/91/1054496391.db2.gz FCMRGTBWJXMPOC-CABCVRRESA-N -1 1 319.404 4.467 20 0 DIADMM O=C(c1cccc([O-])c1F)N1CC2(CCCC2)c2ccccc21 ZINC001445355743 1054504776 /nfs/dbraw/zinc/50/47/76/1054504776.db2.gz GLJXQTGFMZOSDA-UHFFFAOYSA-N -1 1 311.356 4.004 20 0 DIADMM CCC(C)(C)c1ccc(CNC(=O)c2ccc(F)c([O-])c2)cc1 ZINC001446562396 1054539669 /nfs/dbraw/zinc/53/96/69/1054539669.db2.gz DCWFSPZBJMHYBW-UHFFFAOYSA-N -1 1 315.388 4.149 20 0 DIADMM CC[C@H]1Cc2ccccc2CN1C(=O)c1cc(Cl)ccc1[O-] ZINC001447372285 1054562855 /nfs/dbraw/zinc/56/28/55/1054562855.db2.gz BQCLVRJBRUDZLL-HNNXBMFYSA-N -1 1 315.800 4.023 20 0 DIADMM CC[C@@H](C)c1ncc(NC(=O)c2ccc3ccccc3c2[O-])cn1 ZINC001448362405 1054594132 /nfs/dbraw/zinc/59/41/32/1054594132.db2.gz DNTQUWODTAWHAZ-GFCCVEGCSA-N -1 1 321.380 4.101 20 0 DIADMM CSc1ccc([C@H](C)NC(=O)c2ccc(Cl)cc2[O-])cc1 ZINC001448520356 1054599050 /nfs/dbraw/zinc/59/90/50/1054599050.db2.gz PDTDBFZSPBTXFP-JTQLQIEISA-N -1 1 321.829 4.259 20 0 DIADMM CC[C@H]1CCCC[C@H]1CNC(=O)c1cc2ccccc2cc1[O-] ZINC001450397602 1054647563 /nfs/dbraw/zinc/64/75/63/1054647563.db2.gz DUDNITQBXNUGLG-YOEHRIQHSA-N -1 1 311.425 4.492 20 0 DIADMM Cc1ccc(CCCCC(=O)Nc2cc([O-])c(F)cc2F)cc1 ZINC001450902706 1054664039 /nfs/dbraw/zinc/66/40/39/1054664039.db2.gz QTNHWGKQRVUNDP-UHFFFAOYSA-N -1 1 319.351 4.330 20 0 DIADMM CCC[C@H]1CCCC[C@@H]1CNC(=O)c1ccc(Cl)cc1[O-] ZINC001451465573 1054679333 /nfs/dbraw/zinc/67/93/33/1054679333.db2.gz RUNFPKNGEQKGNQ-QWHCGFSZSA-N -1 1 309.837 4.382 20 0 DIADMM CSc1cc(NC(=O)c2ccc(F)c([O-])c2)ccc1Cl ZINC001451475769 1054679670 /nfs/dbraw/zinc/67/96/70/1054679670.db2.gz BJEOAYUYGKGGHQ-UHFFFAOYSA-N -1 1 311.765 4.159 20 0 DIADMM O=C(Nc1cc(F)cc(F)c1[O-])[C@@H]1CC[C@H]2CCCC[C@@H]2C1 ZINC001451760553 1054686770 /nfs/dbraw/zinc/68/67/70/1054686770.db2.gz WKXOOTFOCNRDNP-IJLUTSLNSA-N -1 1 309.356 4.215 20 0 DIADMM CC1(C)CCC[C@H]1[C@@H]1CCN(C(=O)c2cc(Cl)ccc2[O-])C1 ZINC001452131013 1054693586 /nfs/dbraw/zinc/69/35/86/1054693586.db2.gz KNCRUYHBWTVPGL-DOMZBBRYSA-N -1 1 321.848 4.334 20 0 DIADMM CC(C)Nc1ccccc1NC(=O)Cc1ccc([O-])c(Cl)c1 ZINC001453564708 1054739784 /nfs/dbraw/zinc/73/97/84/1054739784.db2.gz JZNZEKRUCSAWKE-UHFFFAOYSA-N -1 1 318.804 4.047 20 0 DIADMM CC(C)C[C@@H](C(=O)[N-]OCC1CCC1)c1ccc(Cl)cc1 ZINC001453733443 1054745658 /nfs/dbraw/zinc/74/56/58/1054745658.db2.gz FDXQBNCWYNKXQO-MRXNPFEDSA-N -1 1 309.837 4.318 20 0 DIADMM Cc1c(C(=O)Nc2cc(Cl)c([O-])c3ccccc23)ccn1C ZINC001453766133 1054747581 /nfs/dbraw/zinc/74/75/81/1054747581.db2.gz FTRSLTGTHXGJNV-UHFFFAOYSA-N -1 1 314.772 4.098 20 0 DIADMM C[C@@H]1C[C@@H]1[C@H]1C[C@H]1C(=O)Nc1cc(Cl)c([O-])c2ccccc12 ZINC001453779900 1054748440 /nfs/dbraw/zinc/74/84/40/1054748440.db2.gz GGRAOOUPSPEUPY-GJQVQUKXSA-N -1 1 315.800 4.429 20 0 DIADMM O=C(c1ccc(Cl)cc1[O-])N1CCC[C@@H](C2CCCCC2)C1 ZINC001454037092 1054756115 /nfs/dbraw/zinc/75/61/15/1054756115.db2.gz KLVYTEWELMWQGW-CQSZACIVSA-N -1 1 321.848 4.478 20 0 DIADMM O=C(c1cc(Cl)ccc1[O-])N1CCC[C@H](C2CCCCC2)C1 ZINC001454039267 1054756326 /nfs/dbraw/zinc/75/63/26/1054756326.db2.gz RWYVRQJWVKEEKG-AWEZNQCLSA-N -1 1 321.848 4.478 20 0 DIADMM CC(C)(NC(=O)c1cc(F)ccc1[O-])c1ccc2ccccc2c1 ZINC001454349067 1054766078 /nfs/dbraw/zinc/76/60/78/1054766078.db2.gz SSIFOMRSYDVUIF-UHFFFAOYSA-N -1 1 323.367 4.350 20 0 DIADMM O=C(Nc1cccc(F)c1[O-])C1(c2cccc(Cl)c2)CCC1 ZINC001454760641 1054782348 /nfs/dbraw/zinc/78/23/48/1054782348.db2.gz ZLBAXWWWKSQVLF-UHFFFAOYSA-N -1 1 319.763 4.245 20 0 DIADMM CC(C)c1ccc(OCCC(=O)Nc2cccc(F)c2[O-])cc1 ZINC001454753605 1054783490 /nfs/dbraw/zinc/78/34/90/1054783490.db2.gz DVMYYEXBBGDMMI-UHFFFAOYSA-N -1 1 317.360 4.062 20 0 DIADMM CC(F)(F)c1c(F)cccc1NC(=O)c1cc(F)ccc1[O-] ZINC001455017194 1054790490 /nfs/dbraw/zinc/79/04/90/1054790490.db2.gz CCOUPEYNQZODNW-UHFFFAOYSA-N -1 1 313.250 4.034 20 0 DIADMM Cc1ccc(F)c(-c2ccnc(CCc3ccccc3)n2)c1[O-] ZINC001236391587 1055090455 /nfs/dbraw/zinc/09/04/55/1055090455.db2.gz LJHXOVHCIHTZCP-UHFFFAOYSA-N -1 1 308.356 4.082 20 0 DIADMM Cc1ccc(F)c(-c2cnc3ccc(C(F)(F)F)cc3n2)c1[O-] ZINC001236394229 1055091870 /nfs/dbraw/zinc/09/18/70/1055091870.db2.gz VDTGAIFZLOXMFC-UHFFFAOYSA-N -1 1 322.261 4.469 20 0 DIADMM CCN(Cc1ccccc1)Cc1cccc(C(=O)[O-])c1Cl ZINC000382014457 1055196596 /nfs/dbraw/zinc/19/65/96/1055196596.db2.gz ZSHXOLXRCQUFJE-UHFFFAOYSA-N -1 1 303.789 4.060 20 0 DIADMM O=C(N[C@@H]1CC[C@H]2CCCC[C@H]2C1)c1ccc(Cl)cc1[O-] ZINC001587543202 1055324903 /nfs/dbraw/zinc/32/49/03/1055324903.db2.gz OLHKJZHYHXNTJM-MBNYWOFBSA-N -1 1 307.821 4.134 20 0 DIADMM O=C(c1ccc2ccccc2c1[O-])N(Cc1ccccc1)C1CC1 ZINC000384414999 1055331530 /nfs/dbraw/zinc/33/15/30/1055331530.db2.gz NYWJJYLJPCFEJZ-UHFFFAOYSA-N -1 1 317.388 4.350 20 0 DIADMM C[C@H](CSc1ccc(F)cc1)C(=O)Nc1cccc(F)c1[O-] ZINC001302486405 1055349771 /nfs/dbraw/zinc/34/97/71/1055349771.db2.gz PHMRNFQUNXVHAB-SNVBAGLBSA-N -1 1 323.364 4.037 20 0 DIADMM C[C@H](c1cc2ccccc2o1)N(C)C(=O)c1cccc([O-])c1F ZINC001588172495 1055440919 /nfs/dbraw/zinc/44/09/19/1055440919.db2.gz PPAONYQSBQWFIA-LLVKDONJSA-N -1 1 313.328 4.111 20 0 DIADMM C[C@H]1CN(Cc2cc(Cl)nc(Cl)c2[O-])Cc2ccccc21 ZINC001237517478 1055466788 /nfs/dbraw/zinc/46/67/88/1055466788.db2.gz BFTTZQJNURUKKU-JTQLQIEISA-N -1 1 323.223 4.213 20 0 DIADMM Cc1cccc2oc(C(=O)NCc3ccc([O-])c(Cl)c3)cc21 ZINC001594565257 1055566778 /nfs/dbraw/zinc/56/67/78/1055566778.db2.gz BEGMGYFZHHBNMK-UHFFFAOYSA-N -1 1 315.756 4.030 20 0 DIADMM C/C(=C\C1CCC(C)CC1)C(=O)NCc1ccc([O-])c(Cl)c1 ZINC001594558545 1055566850 /nfs/dbraw/zinc/56/68/50/1055566850.db2.gz QLPOAPSAXCFEER-UKTHLTGXSA-N -1 1 321.848 4.434 20 0 DIADMM Cc1ccc(/C=C/CC(=O)NCc2ccc([O-])c(Cl)c2)cc1 ZINC001594558666 1055566900 /nfs/dbraw/zinc/56/69/00/1055566900.db2.gz RBKZKQYCBAUOAL-NSCUHMNNSA-N -1 1 315.800 4.074 20 0 DIADMM C[C@@H]1CCN(Cc2cc(F)c([O-])c(Cl)c2)CCC1(F)F ZINC001237984923 1055572707 /nfs/dbraw/zinc/57/27/07/1055572707.db2.gz SCSWLALCKOAUDD-SECBINFHSA-N -1 1 307.743 4.052 20 0 DIADMM COc1ccccc1[C@H](C)N(C)Cc1cc(F)c([O-])c(Cl)c1 ZINC001237998772 1055580495 /nfs/dbraw/zinc/58/04/95/1055580495.db2.gz WSAGLLQFFRTTBB-NSHDSACASA-N -1 1 323.795 4.386 20 0 DIADMM O=C([O-])c1cc(F)ccc1CN1CCC[C@@H]1c1ccccc1F ZINC001238236144 1055627767 /nfs/dbraw/zinc/62/77/67/1055627767.db2.gz QHAQXGZCBNSADB-QGZVFWFLSA-N -1 1 317.335 4.000 20 0 DIADMM CCC1CCC(N(C)C(=O)NCc2ccc([O-])c(Cl)c2)CC1 ZINC001565296906 1055688288 /nfs/dbraw/zinc/68/82/88/1055688288.db2.gz PNXAQFYWGDGUJS-UHFFFAOYSA-N -1 1 324.852 4.156 20 0 DIADMM CC(C)[C@@H]1CCC[C@@H](NC(=O)c2ccc3ccccc3c2[O-])C1 ZINC001565659306 1055715945 /nfs/dbraw/zinc/71/59/45/1055715945.db2.gz OLEQBFUZEJKPRD-HZPDHXFCSA-N -1 1 311.425 4.490 20 0 DIADMM Cc1ccc(NC(=O)c2ccccc2[O-])cc1OCCC(C)C ZINC001565842586 1055733204 /nfs/dbraw/zinc/73/32/04/1055733204.db2.gz PDQKNUMORLYPQE-UHFFFAOYSA-N -1 1 313.397 4.378 20 0 DIADMM CCCC[C@H](CCC)NC(=O)c1ccc2ccc(O)cc2c1[O-] ZINC001566213612 1055750309 /nfs/dbraw/zinc/75/03/09/1055750309.db2.gz DOKKDOVSGAYLDC-AWEZNQCLSA-N -1 1 315.413 4.340 20 0 DIADMM CC(C)Cc1ccc(NC(=O)c2c(F)ccc([O-])c2F)cc1 ZINC001566329767 1055763018 /nfs/dbraw/zinc/76/30/18/1055763018.db2.gz KPOCMNISTQOHNU-UHFFFAOYSA-N -1 1 305.324 4.121 20 0 DIADMM Cc1cccc([C@H](C)NC(=O)c2ccc(C(F)(F)F)cc2[O-])c1 ZINC001566763983 1055781415 /nfs/dbraw/zinc/78/14/15/1055781415.db2.gz HILYJPQLAXLWID-NSHDSACASA-N -1 1 323.314 4.210 20 0 DIADMM O=C(c1ccc(F)c([O-])c1)N(Cc1ccccc1)c1ccccc1 ZINC001597062973 1055781759 /nfs/dbraw/zinc/78/17/59/1055781759.db2.gz OYZWAHUDNUYKMZ-UHFFFAOYSA-N -1 1 321.351 4.378 20 0 DIADMM COC(=O)c1nc2cc(-c3csc4ccccc43)ccc2[n-]1 ZINC001238890150 1055782087 /nfs/dbraw/zinc/78/20/87/1055782087.db2.gz LSVKZMDNODEBTA-UHFFFAOYSA-N -1 1 308.362 4.231 20 0 DIADMM COC(=O)c1nc2ccc(-c3csc4ccccc43)cc2[n-]1 ZINC001238890150 1055782098 /nfs/dbraw/zinc/78/20/98/1055782098.db2.gz LSVKZMDNODEBTA-UHFFFAOYSA-N -1 1 308.362 4.231 20 0 DIADMM CCCCCCC(=O)Nc1cc(C)cc(Br)c1[O-] ZINC001566887645 1055785581 /nfs/dbraw/zinc/78/55/81/1055785581.db2.gz FRFRIEQSXKWPQH-UHFFFAOYSA-N -1 1 314.223 4.372 20 0 DIADMM CC1(C)CC(NC(=O)c2c([O-])cccc2Cl)CC(C)(C)C1 ZINC001566947501 1055787741 /nfs/dbraw/zinc/78/77/41/1055787741.db2.gz XXPXRWZOLZAGOH-UHFFFAOYSA-N -1 1 309.837 4.380 20 0 DIADMM CC1(C)CCC[C@H](NC(=O)c2ccc(C(F)(F)F)cc2[O-])C1 ZINC001567700367 1055814145 /nfs/dbraw/zinc/81/41/45/1055814145.db2.gz IOBZRSWJLQEQEF-NSHDSACASA-N -1 1 315.335 4.110 20 0 DIADMM O=C(N[C@H]1C[C@H](c2ccccc2)C1)c1cc2ccccc2cc1[O-] ZINC001568352071 1055835784 /nfs/dbraw/zinc/83/57/84/1055835784.db2.gz PHTQFRNVXXITME-IYARVYRRSA-N -1 1 317.388 4.221 20 0 DIADMM Cc1cc(C)cc(CN(C)C(=O)c2ccc3ccccc3c2[O-])c1 ZINC001568653036 1055842023 /nfs/dbraw/zinc/84/20/23/1055842023.db2.gz ACPPGGZUWWTCFR-UHFFFAOYSA-N -1 1 319.404 4.434 20 0 DIADMM O=C(N[C@@H]1CC[C@H]2CCCC[C@H]2C1)c1ncc2ccccc2c1[O-] ZINC001539461145 1055848534 /nfs/dbraw/zinc/84/85/34/1055848534.db2.gz XODDSZYEBCDZJI-IJEWVQPXSA-N -1 1 324.424 4.029 20 0 DIADMM O=C(Nc1ccc([O-])c(F)c1F)c1cc(Cl)sc1Cl ZINC001569010745 1055852530 /nfs/dbraw/zinc/85/25/30/1055852530.db2.gz LWNIHCATQWXMLP-UHFFFAOYSA-N -1 1 324.135 4.291 20 0 DIADMM CC[C@H](NC(=O)c1ccc(C(F)(F)F)cc1[O-])C1CCCC1 ZINC001569009277 1055852341 /nfs/dbraw/zinc/85/23/41/1055852341.db2.gz ZWGLNJBMBXYJRU-ZDUSSCGKSA-N -1 1 315.335 4.110 20 0 DIADMM Cc1cccc(CN(CC(C)C)C(=O)c2cc(F)ccc2[O-])c1 ZINC001597814767 1055878556 /nfs/dbraw/zinc/87/85/56/1055878556.db2.gz KVSHWBUGPGCFQW-UHFFFAOYSA-N -1 1 315.388 4.138 20 0 DIADMM CC[C@@H](NC(=O)c1cccc([O-])c1F)c1ccc(Cl)cc1 ZINC001539788810 1055903825 /nfs/dbraw/zinc/90/38/25/1055903825.db2.gz PBQJZZSYSGWPRT-CYBMUJFWSA-N -1 1 307.752 4.066 20 0 DIADMM Cc1ccc2[nH]c(C(=O)Nc3cc(F)cc(F)c3[O-])cc2c1C ZINC001570464453 1055904828 /nfs/dbraw/zinc/90/48/28/1055904828.db2.gz CAZHVZYDDZGJBR-UHFFFAOYSA-N -1 1 316.307 4.021 20 0 DIADMM Cc1ccccc1-c1cnc(NC(=O)c2ccccc2[O-])s1 ZINC001621037793 1055998469 /nfs/dbraw/zinc/99/84/69/1055998469.db2.gz ALQWTWXJLPQHSF-UHFFFAOYSA-N -1 1 310.378 4.076 20 0 DIADMM Cc1cc(Cl)ccc1OC(=O)Cc1ccc([O-])c(Cl)c1 ZINC001540437817 1056032143 /nfs/dbraw/zinc/03/21/43/1056032143.db2.gz JBSLEZLUNIWRTH-UHFFFAOYSA-N -1 1 311.164 4.156 20 0 DIADMM O=C(NC1(C2CCCCC2)CC1)c1cc2ccccc2cc1[O-] ZINC001606603351 1056038354 /nfs/dbraw/zinc/03/83/54/1056038354.db2.gz SCNJIHPFPBCOAB-UHFFFAOYSA-N -1 1 309.409 4.388 20 0 DIADMM Cc1ccc(NC(=O)c2cccc([O-])c2F)cc1C(F)(F)F ZINC001540594960 1056047622 /nfs/dbraw/zinc/04/76/22/1056047622.db2.gz JEFUKXRPRGQKPS-UHFFFAOYSA-N -1 1 313.250 4.111 20 0 DIADMM Cc1ccc(-c2csc(NC(=O)c3ccccc3[O-])n2)cc1 ZINC000006215313 1056058519 /nfs/dbraw/zinc/05/85/19/1056058519.db2.gz YPSOVMATUAIZFR-UHFFFAOYSA-N -1 1 310.378 4.076 20 0 DIADMM CN(C(=O)c1cccc([O-])c1F)C1CCC(C(C)(C)C)CC1 ZINC001540685102 1056061529 /nfs/dbraw/zinc/06/15/29/1056061529.db2.gz BKKIAXXOONATIK-UHFFFAOYSA-N -1 1 307.409 4.208 20 0 DIADMM COc1c(Cl)cc(Cl)cc1C=C1SC(=S)[N-]C1=O ZINC000033847501 1056065364 /nfs/dbraw/zinc/06/53/64/1056065364.db2.gz HBMTYWBFPTYJAG-FPYGCLRLSA-N -1 1 320.222 4.331 20 0 DIADMM Cc1ccc([C@@H](C)N(C)C(=O)c2ccc(Cl)cc2[O-])c(C)c1 ZINC001540721091 1056068397 /nfs/dbraw/zinc/06/83/97/1056068397.db2.gz RPSLCJHQVXYYLV-CYBMUJFWSA-N -1 1 317.816 4.496 20 0 DIADMM C[C@H](c1cc(Cl)ccc1Cl)N1CCC[C@H](CC(=O)[O-])C1 ZINC000086757329 1056069741 /nfs/dbraw/zinc/06/97/41/1056069741.db2.gz SYJBBXCMZPOPLK-GHMZBOCLSA-N -1 1 316.228 4.241 20 0 DIADMM CC(C)(C)C[C@H](NC(=O)c1cc(F)ccc1[O-])c1ccccc1 ZINC001541069187 1056089714 /nfs/dbraw/zinc/08/97/14/1056089714.db2.gz QBMAULBXANLEEC-INIZCTEOSA-N -1 1 315.388 4.439 20 0 DIADMM CC(C)c1ccc(C(=O)Nc2ccc(-c3ncco3)cc2)c([O-])c1 ZINC001611047353 1056101500 /nfs/dbraw/zinc/10/15/00/1056101500.db2.gz QKEBIMNLWGRMJH-UHFFFAOYSA-N -1 1 322.364 4.423 20 0 DIADMM Cc1cc2scc(CC(=O)Nc3ccc(F)cc3[O-])c2s1 ZINC001611073913 1056104660 /nfs/dbraw/zinc/10/46/60/1056104660.db2.gz FWJHTSSCZLZGRE-UHFFFAOYSA-N -1 1 321.398 4.297 20 0 DIADMM C/C(=C/C(=O)Nc1ccc(F)cc1[O-])c1ccccc1Cl ZINC001611075192 1056105082 /nfs/dbraw/zinc/10/50/82/1056105082.db2.gz XMNCKQVXXKNOCZ-NTMALXAHSA-N -1 1 305.736 4.227 20 0 DIADMM O=C(NCC1CCCCCCC1)c1ncc2ccccc2c1[O-] ZINC001542158959 1056106141 /nfs/dbraw/zinc/10/61/41/1056106141.db2.gz OJMANPXKOFETHJ-UHFFFAOYSA-N -1 1 312.413 4.031 20 0 DIADMM O=C(N[C@@H]1CCc2cc(F)ccc21)c1ccc2ccccc2c1[O-] ZINC001542286919 1056115639 /nfs/dbraw/zinc/11/56/39/1056115639.db2.gz AYPBRHJKFPURKD-GOSISDBHSA-N -1 1 321.351 4.102 20 0 DIADMM CC[C@@H](C)Sc1ccc(NC(=O)c2ccc([O-])cn2)c(C)c1 ZINC001542476847 1056124881 /nfs/dbraw/zinc/12/48/81/1056124881.db2.gz QTGOYMPZOHWJHJ-GFCCVEGCSA-N -1 1 316.426 4.239 20 0 DIADMM CC[C@H](c1ccccc1)N(CC)C(=O)c1cccc([O-])c1F ZINC001542469529 1056125338 /nfs/dbraw/zinc/12/53/38/1056125338.db2.gz HIHVVAWVCRXNOZ-OAHLLOKOSA-N -1 1 301.361 4.145 20 0 DIADMM CCC[C@@H](Cc1ccccc1)NC(=O)c1ccc(Cl)cc1[O-] ZINC001611443695 1056160138 /nfs/dbraw/zinc/16/01/38/1056160138.db2.gz RVVAQUFLYSYOPK-HNNXBMFYSA-N -1 1 317.816 4.187 20 0 DIADMM CCC[C@H]1CCCC[C@@H]1NC(=O)Cc1ccc([O-])c(Cl)c1 ZINC001542873054 1056160276 /nfs/dbraw/zinc/16/02/76/1056160276.db2.gz YGFUOMVMJWEOCS-ZFWWWQNUSA-N -1 1 309.837 4.063 20 0 DIADMM CCCOc1ccc(NC(=O)c2ccccc2[O-])cc1Cl ZINC001543279701 1056194031 /nfs/dbraw/zinc/19/40/31/1056194031.db2.gz ZSZCEGSRSAAYQM-UHFFFAOYSA-N -1 1 305.761 4.087 20 0 DIADMM CCSc1cccc(NC(=O)Cc2ccc([O-])c(Cl)c2)c1 ZINC001543824918 1056306088 /nfs/dbraw/zinc/30/60/88/1056306088.db2.gz SVOGDTHUWKMLAC-UHFFFAOYSA-N -1 1 321.829 4.339 20 0 DIADMM [O-]c1ccc(CNc2ncncc2-c2ccccc2)cc1Cl ZINC001612853553 1056333672 /nfs/dbraw/zinc/33/36/72/1056333672.db2.gz OUUABPFGXXOLMV-UHFFFAOYSA-N -1 1 311.772 4.115 20 0 DIADMM [O-]c1ccc(CNc2ccnc(-c3ccccc3)n2)cc1Cl ZINC001612853568 1056334051 /nfs/dbraw/zinc/33/40/51/1056334051.db2.gz PKXWLLVPHKFVPK-UHFFFAOYSA-N -1 1 311.772 4.115 20 0 DIADMM Cc1ccc2sc(CSc3nc(C)c(C)c(=O)[n-]3)nc2c1 ZINC001613672514 1056397293 /nfs/dbraw/zinc/39/72/93/1056397293.db2.gz ZZHOUPUWVURCDJ-UHFFFAOYSA-N -1 1 317.439 4.009 20 0 DIADMM O=C(CC(F)(F)F)Nc1cc(Cl)c([O-])c2ccccc12 ZINC001585193000 1056504068 /nfs/dbraw/zinc/50/40/68/1056504068.db2.gz HJIYNNWRWRPJCF-UHFFFAOYSA-N -1 1 303.667 4.090 20 0 DIADMM CCc1ccc(CC)c(NC(=O)c2cc(SC)ccc2[O-])c1 ZINC001544826941 1056509644 /nfs/dbraw/zinc/50/96/44/1056509644.db2.gz VXIMFIXYUSDNIV-UHFFFAOYSA-N -1 1 315.438 4.491 20 0 DIADMM [O-]c1c(F)cc(Nc2snnc2-c2ccccc2)cc1Cl ZINC001214482960 1056575796 /nfs/dbraw/zinc/57/57/96/1056575796.db2.gz WWQSQQUWSCKSIH-UHFFFAOYSA-N -1 1 321.764 4.447 20 0 DIADMM [O-]c1c(F)cc(Nc2ccccc2-n2ccnc2)cc1Cl ZINC001214486413 1056599488 /nfs/dbraw/zinc/59/94/88/1056599488.db2.gz GHRYJNWHDJFZED-UHFFFAOYSA-N -1 1 303.724 4.114 20 0 DIADMM C[C@H]([N-]C(=O)C(F)(F)F)c1ccc(N[C@@H](C)C(C)(C)C)cc1 ZINC001168695611 1056628886 /nfs/dbraw/zinc/62/88/86/1056628886.db2.gz QEBMHXGYCAGNJL-QWRGUYRKSA-N -1 1 316.367 4.273 20 0 DIADMM CSCc1cccc(NC(=O)Cc2ccc([O-])c(Cl)c2)c1 ZINC001616322215 1056633298 /nfs/dbraw/zinc/63/32/98/1056633298.db2.gz ABNLQBPUTVXCLA-UHFFFAOYSA-N -1 1 321.829 4.090 20 0 DIADMM COC(=O)c1cc(-c2ccccc2)cnc1-c1cc(F)ccc1[O-] ZINC001240694080 1056645324 /nfs/dbraw/zinc/64/53/24/1056645324.db2.gz PGCWYGLPSUZQOZ-UHFFFAOYSA-N -1 1 323.323 4.047 20 0 DIADMM [O-]c1ccc(F)cc1-c1ncnc2sc3c(c21)CCCC3 ZINC001240693189 1056645637 /nfs/dbraw/zinc/64/56/37/1056645637.db2.gz GBQRKGKARPTEOE-UHFFFAOYSA-N -1 1 300.358 4.082 20 0 DIADMM Cc1ccccc1-c1nc2c(ncnc2-c2cc(F)ccc2[O-])o1 ZINC001240695049 1056645895 /nfs/dbraw/zinc/64/58/95/1056645895.db2.gz AJOLXPWLDQWSBM-UHFFFAOYSA-N -1 1 321.311 4.105 20 0 DIADMM [O-]c1ccc(F)cc1-c1ccc(Oc2ccc(F)cc2F)nn1 ZINC001240695532 1056647115 /nfs/dbraw/zinc/64/71/15/1056647115.db2.gz LNYQJCYZLLDUQT-UHFFFAOYSA-N -1 1 318.254 4.059 20 0 DIADMM C[C@H](NC(=O)c1ccc(Cl)cc1[O-])c1cc2ccccc2o1 ZINC001616384150 1056647138 /nfs/dbraw/zinc/64/71/38/1056647138.db2.gz CTBVVXBVFIIKFM-JTQLQIEISA-N -1 1 315.756 4.283 20 0 DIADMM Cc1ccc(NC(=O)c2ccc(-c3cc(F)ccc3[O-])nc2)cc1 ZINC001240695619 1056647768 /nfs/dbraw/zinc/64/77/68/1056647768.db2.gz OOZCPKKVBNBTSQ-UHFFFAOYSA-N -1 1 322.339 4.154 20 0 DIADMM CCN(c1ccccc1)c1cc(-c2cc(F)ccc2[O-])ncn1 ZINC001240696268 1056648018 /nfs/dbraw/zinc/64/80/18/1056648018.db2.gz KRTXVRCYCRPYBJ-UHFFFAOYSA-N -1 1 309.344 4.146 20 0 DIADMM [O-]c1cc(F)cc(F)c1Nc1cc(F)c(OC(F)F)c(F)c1 ZINC001212448833 1056665558 /nfs/dbraw/zinc/66/55/58/1056665558.db2.gz AKKKPEVALFHMTB-UHFFFAOYSA-N -1 1 323.192 4.294 20 0 DIADMM CCOc1cc(C(=O)Nc2cccc(CC)c2)cc(Cl)c1[O-] ZINC000215977942 1056686152 /nfs/dbraw/zinc/68/61/52/1056686152.db2.gz BJKBIKDTFFYKCN-UHFFFAOYSA-N -1 1 319.788 4.259 20 0 DIADMM [O-]c1ccc(-c2ncc(F)c(Oc3ccc(F)cc3)n2)cc1F ZINC001240782818 1056696028 /nfs/dbraw/zinc/69/60/28/1056696028.db2.gz KMQRKGOQXSCQIW-UHFFFAOYSA-N -1 1 318.254 4.059 20 0 DIADMM CCc1cccc2cc(CN[C@H](CC3CCCC3)C(=O)[O-])oc21 ZINC000656572342 1056696879 /nfs/dbraw/zinc/69/68/79/1056696879.db2.gz HSUJDORNSYCQFS-QGZVFWFLSA-N -1 1 315.413 4.118 20 0 DIADMM Cc1ccccc1Oc1nc(-c2ccc([O-])c(F)c2)ncc1F ZINC001240785693 1056697228 /nfs/dbraw/zinc/69/72/28/1056697228.db2.gz BLHQBTGCFRLVON-UHFFFAOYSA-N -1 1 314.291 4.228 20 0 DIADMM COC(=O)[C@@H](C)c1ccc(Nc2cc(F)c([O-])c(Cl)c2)cc1 ZINC001214491639 1056725734 /nfs/dbraw/zinc/72/57/34/1056725734.db2.gz HGXOSXISRDWMIO-VIFPVBQESA-N -1 1 323.751 4.205 20 0 DIADMM CC(C)c1ccc(C(=O)N2CC(C)(C)c3ccccc32)c([O-])c1 ZINC001586679510 1056781161 /nfs/dbraw/zinc/78/11/61/1056781161.db2.gz PLBKLCFFTYUKKP-UHFFFAOYSA-N -1 1 309.409 4.454 20 0 DIADMM CCCCOc1ccccc1-c1ccc2[n-]c(C(=O)OC)nc2c1 ZINC001241021174 1056822505 /nfs/dbraw/zinc/82/25/05/1056822505.db2.gz VPKGQWIRVWRLSP-UHFFFAOYSA-N -1 1 324.380 4.195 20 0 DIADMM CCCCOc1ccccc1-c1ccc2nc(C(=O)OC)[n-]c2c1 ZINC001241021174 1056822507 /nfs/dbraw/zinc/82/25/07/1056822507.db2.gz VPKGQWIRVWRLSP-UHFFFAOYSA-N -1 1 324.380 4.195 20 0 DIADMM O=C(N[C@@H]1CC[C@H]2CCC[C@@H]2C1)c1cc2ccccc2cc1[O-] ZINC001617426308 1056830596 /nfs/dbraw/zinc/83/05/96/1056830596.db2.gz OWQVKLJOTMIMRF-CKEIUWERSA-N -1 1 309.409 4.244 20 0 DIADMM CC1(C)CN(C(=O)c2cc(F)ccc2[O-])c2ccc(Cl)cc21 ZINC001586925429 1056832576 /nfs/dbraw/zinc/83/25/76/1056832576.db2.gz NVHSKROLWOLZFG-UHFFFAOYSA-N -1 1 319.763 4.123 20 0 DIADMM CC(C)(CNC(=O)c1ccc(Cl)cc1[O-])Cc1ccccc1 ZINC001617432018 1056832527 /nfs/dbraw/zinc/83/25/27/1056832527.db2.gz DBYDSRWEHZGWKQ-UHFFFAOYSA-N -1 1 317.816 4.044 20 0 DIADMM Cc1cccc(Oc2nc(-c3ccc(C)cc3[O-])ncc2F)c1 ZINC001241035608 1056834576 /nfs/dbraw/zinc/83/45/76/1056834576.db2.gz COHRNFDYGKFAHK-UHFFFAOYSA-N -1 1 310.328 4.397 20 0 DIADMM O=C(N[C@@H]1C[C@H]1C1CCCCC1)c1cc2ccccc2cc1[O-] ZINC001587112000 1056860959 /nfs/dbraw/zinc/86/09/59/1056860959.db2.gz HFGJIEIEXTWLBL-FUHWJXTLSA-N -1 1 309.409 4.244 20 0 DIADMM O=C(c1cc(Cl)ccc1[O-])N1CCCCC[C@H]1c1ccco1 ZINC001617913355 1056900257 /nfs/dbraw/zinc/90/02/57/1056900257.db2.gz MXYWZNHKYHHXMF-AWEZNQCLSA-N -1 1 319.788 4.396 20 0 DIADMM C[C@H]1CCCCN1c1cccc(-c2c(F)cc([O-])cc2F)n1 ZINC001241118427 1056904523 /nfs/dbraw/zinc/90/45/23/1056904523.db2.gz DWPHAJAHLPSHHH-NSHDSACASA-N -1 1 304.340 4.111 20 0 DIADMM CCc1cc(-c2c(F)cc([O-])cc2F)nnc1-c1ccccc1 ZINC001241120365 1056906128 /nfs/dbraw/zinc/90/61/28/1056906128.db2.gz QTTJBACIHAUYSZ-UHFFFAOYSA-N -1 1 312.319 4.357 20 0 DIADMM [O-]c1cc(F)c(-c2cnc3[nH]cc(C(F)(F)F)c3c2)c(F)c1 ZINC001241122429 1056907139 /nfs/dbraw/zinc/90/71/39/1056907139.db2.gz CJNZVAVOXKUNLY-UHFFFAOYSA-N -1 1 314.213 4.233 20 0 DIADMM Cc1cc(-c2ccccc2F)nnc1-c1c(F)cc([O-])cc1F ZINC001241119782 1056907662 /nfs/dbraw/zinc/90/76/62/1056907662.db2.gz PLNHCVYINYFBJV-UHFFFAOYSA-N -1 1 316.282 4.242 20 0 DIADMM CC(C)(C)OC(=O)Cc1cccc(-c2c(F)cc([O-])cc2F)c1 ZINC001241124191 1056908481 /nfs/dbraw/zinc/90/84/81/1056908481.db2.gz CMTZIUPFBAMNQQ-UHFFFAOYSA-N -1 1 320.335 4.222 20 0 DIADMM COc1cc2c(cc1C)nccc2-c1c(F)cc([O-])cc1F ZINC001241124234 1056909086 /nfs/dbraw/zinc/90/90/86/1056909086.db2.gz DKGKJPUNDNSOJW-UHFFFAOYSA-N -1 1 301.292 4.203 20 0 DIADMM Cc1ccc([C@H]2CCCCN2C(=O)c2cc(F)ccc2[O-])cc1 ZINC001618009023 1056913839 /nfs/dbraw/zinc/91/38/39/1056913839.db2.gz INQGZEOQCICSCI-QGZVFWFLSA-N -1 1 313.372 4.207 20 0 DIADMM CCOC(=O)c1nc2cc(-c3cc(C)c(OC)cc3C)ccc2[n-]1 ZINC001241139141 1056919632 /nfs/dbraw/zinc/91/96/32/1056919632.db2.gz XLYBCYFEKJRJCM-UHFFFAOYSA-N -1 1 324.380 4.032 20 0 DIADMM CCOC(=O)c1nc2ccc(-c3cc(C)c(OC)cc3C)cc2[n-]1 ZINC001241139141 1056919637 /nfs/dbraw/zinc/91/96/37/1056919637.db2.gz XLYBCYFEKJRJCM-UHFFFAOYSA-N -1 1 324.380 4.032 20 0 DIADMM O=C(C[C@H]1CCc2ccccc21)Nc1ccc([O-])c(Cl)c1 ZINC000115729277 1056947883 /nfs/dbraw/zinc/94/78/83/1056947883.db2.gz AVJRJMHZXKPDSA-GFCCVEGCSA-N -1 1 301.773 4.104 20 0 DIADMM CC(C)C1=NCCc2ccc(-c3ccc(F)c(C(=O)[O-])c3)cc21 ZINC001241246874 1056978748 /nfs/dbraw/zinc/97/87/48/1056978748.db2.gz HAFCMOCYLCXMGB-UHFFFAOYSA-N -1 1 311.356 4.192 20 0 DIADMM C[C@H]1CCCCN1c1cccc(-c2c(F)ccc([O-])c2F)n1 ZINC001241289793 1056998439 /nfs/dbraw/zinc/99/84/39/1056998439.db2.gz DVXSUTLTZFLBEO-NSHDSACASA-N -1 1 304.340 4.111 20 0 DIADMM CSc1cnc(-c2c(F)ccc([O-])c2F)c(C(F)(F)F)c1 ZINC001241290127 1056998579 /nfs/dbraw/zinc/99/85/79/1056998579.db2.gz LHGKIJDZVSNZLC-UHFFFAOYSA-N -1 1 321.270 4.473 20 0 DIADMM [O-]c1ccc(F)c(-c2ccc3c(C(F)(F)F)c[nH]c3n2)c1F ZINC001241291865 1057000359 /nfs/dbraw/zinc/00/03/59/1057000359.db2.gz UXTISRZKMJGVEB-UHFFFAOYSA-N -1 1 314.213 4.233 20 0 DIADMM COC(=O)c1nc2cc(-c3cccc4ccsc43)ccc2[n-]1 ZINC001241403923 1057041767 /nfs/dbraw/zinc/04/17/67/1057041767.db2.gz KZXMOISJQHIMBJ-UHFFFAOYSA-N -1 1 308.362 4.231 20 0 DIADMM COC(=O)c1nc2ccc(-c3cccc4ccsc43)cc2[n-]1 ZINC001241403923 1057041770 /nfs/dbraw/zinc/04/17/70/1057041770.db2.gz KZXMOISJQHIMBJ-UHFFFAOYSA-N -1 1 308.362 4.231 20 0 DIADMM CC(C)CCc1ccc(NC(=O)c2cc(F)ccc2[O-])cc1 ZINC001626085924 1057062641 /nfs/dbraw/zinc/06/26/41/1057062641.db2.gz QDKLMDMOAIWMEH-UHFFFAOYSA-N -1 1 301.361 4.372 20 0 DIADMM CCCOc1ccc(Cl)cc1NC(=O)c1ccc(F)c([O-])c1 ZINC001626093716 1057182893 /nfs/dbraw/zinc/18/28/93/1057182893.db2.gz WDDHNNQYYAUUCY-UHFFFAOYSA-N -1 1 323.751 4.226 20 0 DIADMM [O-]c1ccc(C(F)(F)F)cc1-c1cnc2ccc(F)cc2n1 ZINC001242131475 1057273527 /nfs/dbraw/zinc/27/35/27/1057273527.db2.gz KVDSTVUUWGZQIK-UHFFFAOYSA-N -1 1 308.234 4.160 20 0 DIADMM Cc1nc2ccc(F)cc2c(-c2cc(C(F)(F)F)ccc2[O-])n1 ZINC001242131110 1057273996 /nfs/dbraw/zinc/27/39/96/1057273996.db2.gz BTEJIGAMUGCDQT-UHFFFAOYSA-N -1 1 322.261 4.469 20 0 DIADMM Cc1nc(-c2cc(C(F)(F)F)ccc2[O-])cc(C(F)(F)F)n1 ZINC001242131446 1057274162 /nfs/dbraw/zinc/27/41/62/1057274162.db2.gz JYPHLPVKZFUGSP-UHFFFAOYSA-N -1 1 322.208 4.195 20 0 DIADMM [O-]c1ccc(C(F)(F)F)cc1-c1ccc(COCC2CC2)cn1 ZINC001242133042 1057274449 /nfs/dbraw/zinc/27/44/49/1057274449.db2.gz CIKQOZRLFHTJFV-UHFFFAOYSA-N -1 1 323.314 4.400 20 0 DIADMM Cc1cc(C(F)(F)F)c(-c2cc(C(F)(F)F)ccc2[O-])nn1 ZINC001242134091 1057274515 /nfs/dbraw/zinc/27/45/15/1057274515.db2.gz SJRJONLHVNKHHX-UHFFFAOYSA-N -1 1 322.208 4.195 20 0 DIADMM Cc1cc2ccncc2nc1-c1cc(C(F)(F)F)ccc1[O-] ZINC001242133493 1057274697 /nfs/dbraw/zinc/27/46/97/1057274697.db2.gz JTBXBDSMWDHBIU-UHFFFAOYSA-N -1 1 304.271 4.330 20 0 DIADMM Cc1nc2ccccc2nc1-c1ccc([O-])c(C(F)(F)F)c1 ZINC001242148263 1057279796 /nfs/dbraw/zinc/27/97/96/1057279796.db2.gz QOWKYMGCDHJVFU-UHFFFAOYSA-N -1 1 304.271 4.330 20 0 DIADMM Cc1cc2c(ncnc2-c2ccc([O-])c(C(F)(F)F)c2)s1 ZINC001242148264 1057280229 /nfs/dbraw/zinc/28/02/29/1057280229.db2.gz QQYAKBDVZJFQOK-UHFFFAOYSA-N -1 1 310.300 4.391 20 0 DIADMM Nc1cc(-c2ccc([O-])c(C(F)(F)F)c2)nc(C(F)(F)F)c1 ZINC001242152918 1057281963 /nfs/dbraw/zinc/28/19/63/1057281963.db2.gz NQJDEBLKXUIRKE-UHFFFAOYSA-N -1 1 322.208 4.074 20 0 DIADMM [O-]c1ccc(-c2ccc(COCC3CC3)cn2)cc1C(F)(F)F ZINC001242158084 1057283292 /nfs/dbraw/zinc/28/32/92/1057283292.db2.gz RZUCRFZWCOVNBQ-UHFFFAOYSA-N -1 1 323.314 4.400 20 0 DIADMM CCCSc1cncc(-c2ccc([O-])c(C(F)(F)F)c2)n1 ZINC001242158245 1057283756 /nfs/dbraw/zinc/28/37/56/1057283756.db2.gz UOOFJOIGSAGEGI-UHFFFAOYSA-N -1 1 314.332 4.370 20 0 DIADMM CCOC(=O)Cc1cccc(Nc2cc([O-])c(Cl)cc2F)c1 ZINC001212526570 1057306742 /nfs/dbraw/zinc/30/67/42/1057306742.db2.gz LJKJNYIQCIHGSH-UHFFFAOYSA-N -1 1 323.751 4.034 20 0 DIADMM Cc1cccc(-c2nccc(SCc3ccccc3)n2)c1[O-] ZINC001242345266 1057340308 /nfs/dbraw/zinc/34/03/08/1057340308.db2.gz NMUQQXGUILQVFB-UHFFFAOYSA-N -1 1 308.406 4.450 20 0 DIADMM COC(=O)c1ccc(C(F)(F)F)cc1-c1cccc(F)c1[O-] ZINC001242351923 1057342020 /nfs/dbraw/zinc/34/20/20/1057342020.db2.gz BIYYNKIICYQKKP-UHFFFAOYSA-N -1 1 314.234 4.004 20 0 DIADMM CC(C)(C)OC(=O)c1ccc(-c2cccc(F)c2[O-])c(F)c1 ZINC001242352124 1057342631 /nfs/dbraw/zinc/34/26/31/1057342631.db2.gz NKQKRRVFZRYNBP-UHFFFAOYSA-N -1 1 306.308 4.293 20 0 DIADMM COC(=O)c1cccc2c(-c3cccc(Cl)c3[O-])ccnc12 ZINC001242366249 1057346933 /nfs/dbraw/zinc/34/69/33/1057346933.db2.gz SYJWLTIUZGSLOA-UHFFFAOYSA-N -1 1 313.740 4.047 20 0 DIADMM CC(=O)N1CCCc2cc(-c3cccc(Cl)c3[O-])ccc21 ZINC001242366275 1057347185 /nfs/dbraw/zinc/34/71/85/1057347185.db2.gz IJIARYFFSAQAMX-UHFFFAOYSA-N -1 1 301.773 4.012 20 0 DIADMM Cc1noc(-c2ccc(-c3cccc(Cl)c3[O-])cc2F)n1 ZINC001242366180 1057347324 /nfs/dbraw/zinc/34/73/24/1057347324.db2.gz GRURJSIQQPIZMB-UHFFFAOYSA-N -1 1 304.708 4.210 20 0 DIADMM CC(C)(C)OC(=O)Nc1ccc(-c2cccc(Cl)c2[O-])cn1 ZINC001242366533 1057348472 /nfs/dbraw/zinc/34/84/72/1057348472.db2.gz ZLKXBCCTRHAITM-UHFFFAOYSA-N -1 1 320.776 4.455 20 0 DIADMM O=C(Nc1ccccn1)c1ccc(-c2cccc(Cl)c2[O-])cc1 ZINC001242367794 1057348831 /nfs/dbraw/zinc/34/88/31/1057348831.db2.gz SJMUSTCGPIQGMR-UHFFFAOYSA-N -1 1 324.767 4.360 20 0 DIADMM CCOC(=O)c1c[nH]c2cc(-c3cccc(Cl)c3[O-])ccc21 ZINC001242366667 1057348860 /nfs/dbraw/zinc/34/88/60/1057348860.db2.gz CFFUZJKRXBZXDU-UHFFFAOYSA-N -1 1 315.756 4.371 20 0 DIADMM CC1(C)CC(=O)Nc2c(-c3cccc(Cl)c3[O-])cccc21 ZINC001242366920 1057349053 /nfs/dbraw/zinc/34/90/53/1057349053.db2.gz FMTVXMDKBLSDAT-UHFFFAOYSA-N -1 1 301.773 4.332 20 0 DIADMM CCOC(=O)/C=C/c1ccc(-c2cccc(Cl)c2[O-])cc1 ZINC001242367447 1057349097 /nfs/dbraw/zinc/34/90/97/1057349097.db2.gz MXZYGWCLQPXVSB-DHZHZOJOSA-N -1 1 302.757 4.289 20 0 DIADMM CC1(C)NC(=O)Nc2cc(-c3cccc(Cl)c3[O-])ccc21 ZINC001242367522 1057349134 /nfs/dbraw/zinc/34/91/34/1057349134.db2.gz OFGLYBTWWJLFAY-UHFFFAOYSA-N -1 1 302.761 4.083 20 0 DIADMM O=C(Nc1ccccc1)c1ccnc(-c2cccc([O-])c2Cl)c1 ZINC001242797885 1057479786 /nfs/dbraw/zinc/47/97/86/1057479786.db2.gz OHJOUHXLJAKSMG-UHFFFAOYSA-N -1 1 324.767 4.360 20 0 DIADMM CC(C)(C)c1nc(-c2cccc([O-])c2Cl)nc(C(C)(C)C)n1 ZINC001242797820 1057480024 /nfs/dbraw/zinc/48/00/24/1057480024.db2.gz NJJOJWYJFJMNEO-UHFFFAOYSA-N -1 1 319.836 4.493 20 0 DIADMM CC(C)(C)OC(=O)c1cncc(-c2cccc([O-])c2Cl)c1 ZINC001242799798 1057480648 /nfs/dbraw/zinc/48/06/48/1057480648.db2.gz CUUSUKUKGSWPNI-UHFFFAOYSA-N -1 1 305.761 4.063 20 0 DIADMM CC(C)(C)OC(=O)Nc1ccc(-c2cccc([O-])c2Cl)nc1 ZINC001242799916 1057480866 /nfs/dbraw/zinc/48/08/66/1057480866.db2.gz AGOSNSNPOXKKRY-UHFFFAOYSA-N -1 1 320.776 4.455 20 0 DIADMM CSc1nc2ccnc(-c3cccc([O-])c3Cl)c2s1 ZINC001242798700 1057480930 /nfs/dbraw/zinc/48/09/30/1057480930.db2.gz VYKXRAYADHVFSH-UHFFFAOYSA-N -1 1 308.815 4.439 20 0 DIADMM CSc1nc(-c2cccc([O-])c2Cl)cc(C(F)F)n1 ZINC001242801107 1057481747 /nfs/dbraw/zinc/48/17/47/1057481747.db2.gz NKVJFYNDZNDRLQ-UHFFFAOYSA-N -1 1 302.733 4.162 20 0 DIADMM CN(c1ccccc1)c1cc(-c2cccc([O-])c2Cl)ncn1 ZINC001242801060 1057481860 /nfs/dbraw/zinc/48/18/60/1057481860.db2.gz MXINORGQJKIESZ-UHFFFAOYSA-N -1 1 311.772 4.271 20 0 DIADMM CCOC(=O)/C=C/c1ccc(-c2cccc([O-])c2Cl)cc1 ZINC001242800413 1057482035 /nfs/dbraw/zinc/48/20/35/1057482035.db2.gz IEUVQWIITPTMDG-DHZHZOJOSA-N -1 1 302.757 4.289 20 0 DIADMM CCOC(=O)c1cc2ccc(-c3cccc([O-])c3Cl)cn2c1 ZINC001242800275 1057482344 /nfs/dbraw/zinc/48/23/44/1057482344.db2.gz LRVZDIHBANCJNC-UHFFFAOYSA-N -1 1 315.756 4.142 20 0 DIADMM CCOc1nnc(-c2cccc([O-])c2Cl)c2ccccc21 ZINC001242800584 1057482393 /nfs/dbraw/zinc/48/23/93/1057482393.db2.gz ICMFIRRHBDSYSK-UHFFFAOYSA-N -1 1 300.745 4.055 20 0 DIADMM O=c1cc(-c2cccc([O-])c2Cl)ccn1-c1ccccc1F ZINC001242802109 1057482849 /nfs/dbraw/zinc/48/28/49/1057482849.db2.gz RCGDUNYYDCIBIL-UHFFFAOYSA-N -1 1 315.731 4.003 20 0 DIADMM [O-]c1cccc(-c2ccnc(OCc3ccccn3)c2)c1Cl ZINC001242801965 1057483024 /nfs/dbraw/zinc/48/30/24/1057483024.db2.gz JOSJZSRXJJFFDF-UHFFFAOYSA-N -1 1 312.756 4.082 20 0 DIADMM CC[C@H](C(=O)OC)c1ccc(-c2cccc([O-])c2Cl)cc1 ZINC001242802274 1057483092 /nfs/dbraw/zinc/48/30/92/1057483092.db2.gz DRMQJTGHTNXBQO-ZDUSSCGKSA-N -1 1 304.773 4.379 20 0 DIADMM CC1(C)C(=O)Nc2cc(F)c(-c3cccc([O-])c3Cl)cc21 ZINC001242801936 1057483194 /nfs/dbraw/zinc/48/31/94/1057483194.db2.gz HQJJZTTZHPHRON-UHFFFAOYSA-N -1 1 305.736 4.081 20 0 DIADMM [O-]c1cccc(-c2ccnc(OCc3ccncc3)c2)c1Cl ZINC001242801983 1057483245 /nfs/dbraw/zinc/48/32/45/1057483245.db2.gz KRPJEBLINCMNML-UHFFFAOYSA-N -1 1 312.756 4.082 20 0 DIADMM CC1(C)Cc2ccc(-c3cccc([O-])c3Cl)cc2NC1=O ZINC001242803642 1057483285 /nfs/dbraw/zinc/48/32/85/1057483285.db2.gz WCYBLWARYKGWEX-UHFFFAOYSA-N -1 1 301.773 4.233 20 0 DIADMM Cc1ccc(-c2csc3[n-]c([C@H]4CCCO4)nc(=O)c23)s1 ZINC000676559070 1057483389 /nfs/dbraw/zinc/48/33/89/1057483389.db2.gz XXXSLBAAHYMMJE-SNVBAGLBSA-N -1 1 318.423 4.285 20 0 DIADMM O=C(Nc1ccc([O-])c(Cl)c1)c1cc2cc(Cl)ccc2[nH]1 ZINC000676706348 1057496730 /nfs/dbraw/zinc/49/67/30/1057496730.db2.gz NTMQTIWQCGGRJQ-UHFFFAOYSA-N -1 1 321.163 4.433 20 0 DIADMM Cc1ccccc1Oc1nc(-c2ccc(F)c([O-])c2)ncc1F ZINC001243050823 1057558512 /nfs/dbraw/zinc/55/85/12/1057558512.db2.gz TUDFXBURGAQWQV-UHFFFAOYSA-N -1 1 314.291 4.228 20 0 DIADMM COC(=O)c1nc2cc(-c3cc(C)ccc3OC(C)C)ccc2[n-]1 ZINC001243091702 1057569571 /nfs/dbraw/zinc/56/95/71/1057569571.db2.gz DKBSHAQBJJAVGO-UHFFFAOYSA-N -1 1 324.380 4.112 20 0 DIADMM COC(=O)c1nc2ccc(-c3cc(C)ccc3OC(C)C)cc2[n-]1 ZINC001243091702 1057569576 /nfs/dbraw/zinc/56/95/76/1057569576.db2.gz DKBSHAQBJJAVGO-UHFFFAOYSA-N -1 1 324.380 4.112 20 0 DIADMM Cc1cccc2nc(-c3ccc(C(F)(F)F)c(F)c3)[n-]c(=O)c12 ZINC000489111394 1057583994 /nfs/dbraw/zinc/58/39/94/1057583994.db2.gz PDYRRVUPFLWITR-UHFFFAOYSA-N -1 1 322.261 4.469 20 0 DIADMM CC(C)[C@H]1N(C(=O)Cc2ccc([O-])c(Cl)c2)CC12CCCC2 ZINC001299297211 1057612695 /nfs/dbraw/zinc/61/26/95/1057612695.db2.gz HYCKSBAEROSNHP-QGZVFWFLSA-N -1 1 321.848 4.015 20 0 DIADMM CC(C)[C@@H]1N(C(=O)Cc2ccc([O-])c(Cl)c2)CC12CCCC2 ZINC001299297205 1057612887 /nfs/dbraw/zinc/61/28/87/1057612887.db2.gz HYCKSBAEROSNHP-KRWDZBQOSA-N -1 1 321.848 4.015 20 0 DIADMM CC(C)(C)n1cc(Nc2c(Cl)ccc([O-])c2Cl)cn1 ZINC001212572231 1057625383 /nfs/dbraw/zinc/62/53/83/1057625383.db2.gz QORXSOYKTVPQBX-UHFFFAOYSA-N -1 1 300.189 4.394 20 0 DIADMM Cc1c(NC(=O)C(C)(C)C)ccnc1-c1ccc([O-])c(F)c1F ZINC001243340200 1057651748 /nfs/dbraw/zinc/65/17/48/1057651748.db2.gz RNROTTAAQYBCQA-UHFFFAOYSA-N -1 1 320.339 4.025 20 0 DIADMM COc1ccc(OC(F)(F)F)c(-c2ccc([O-])c(F)c2F)c1 ZINC001243340559 1057651795 /nfs/dbraw/zinc/65/17/95/1057651795.db2.gz DDLFZCHTVDJOPC-UHFFFAOYSA-N -1 1 320.213 4.245 20 0 DIADMM Cc1ccnc(-c2cc(C)cc(-c3ccc([O-])c(F)c3F)n2)c1 ZINC001243340570 1057652287 /nfs/dbraw/zinc/65/22/87/1057652287.db2.gz DRMVJGUPNHZFCC-UHFFFAOYSA-N -1 1 312.319 4.411 20 0 DIADMM [O-]c1ccc(-c2nccc3c4c([nH]c32)CCCC4)c(F)c1F ZINC001243340625 1057652389 /nfs/dbraw/zinc/65/23/89/1057652389.db2.gz ZVHOTRIAPNSZAG-UHFFFAOYSA-N -1 1 300.308 4.093 20 0 DIADMM [O-]c1ccc(-c2cccc(-c3cc[nH]c(=S)n3)c2)c(F)c1F ZINC001243340876 1057652755 /nfs/dbraw/zinc/65/27/55/1057652755.db2.gz IMYXXCLTINJECY-UHFFFAOYSA-N -1 1 316.332 4.083 20 0 DIADMM COc1cccc2c(-c3ccc([O-])c(F)c3F)cc(C)nc12 ZINC001243342243 1057653277 /nfs/dbraw/zinc/65/32/77/1057653277.db2.gz BNVIEBJFVNQLIY-UHFFFAOYSA-N -1 1 301.292 4.203 20 0 DIADMM CCCOc1c(F)cc(-c2ccc([O-])c(F)c2F)cc1F ZINC001243342027 1057653400 /nfs/dbraw/zinc/65/34/00/1057653400.db2.gz HJJHNEWCIRAYFE-UHFFFAOYSA-N -1 1 300.251 4.404 20 0 DIADMM CCOC(=O)c1cc(C)c(-c2ccc([O-])c(F)c2F)cc1C ZINC001243343682 1057653936 /nfs/dbraw/zinc/65/39/36/1057653936.db2.gz MNTMDZMCLJEFSM-UHFFFAOYSA-N -1 1 306.308 4.131 20 0 DIADMM [O-]c1ccc(-c2ccc(O[C@@H]3CCCCO3)cc2)c(F)c1F ZINC001243343521 1057654086 /nfs/dbraw/zinc/65/40/86/1057654086.db2.gz ZOBUGGUXXSFNLW-OAHLLOKOSA-N -1 1 306.308 4.243 20 0 DIADMM COC(=O)c1cc2cccc(-c3cc(F)cc(F)c3[O-])c2s1 ZINC001243501819 1057697323 /nfs/dbraw/zinc/69/73/23/1057697323.db2.gz CJGZHUJKJJUNJA-UHFFFAOYSA-N -1 1 320.316 4.339 20 0 DIADMM COc1cc(-c2cc(F)cc(F)c2[O-])ccc1C(F)(F)F ZINC001243505523 1057697756 /nfs/dbraw/zinc/69/77/56/1057697756.db2.gz HMTDYIVPYUDETB-UHFFFAOYSA-N -1 1 304.214 4.365 20 0 DIADMM [O-]c1c(F)cc(F)cc1-c1cnc2[nH]cc(C(F)(F)F)c2c1 ZINC001243506189 1057697892 /nfs/dbraw/zinc/69/78/92/1057697892.db2.gz ZYYREBBIXYHRDF-UHFFFAOYSA-N -1 1 314.213 4.233 20 0 DIADMM COc1cccc(C(F)(F)F)c1-c1cc(F)cc(F)c1[O-] ZINC001243506060 1057697952 /nfs/dbraw/zinc/69/79/52/1057697952.db2.gz OQIWYKFGPDDXLV-UHFFFAOYSA-N -1 1 304.214 4.365 20 0 DIADMM Cc1nc(-c2cccc([O-])c2F)nc(C)c1Cc1ccccc1 ZINC001243546065 1057709503 /nfs/dbraw/zinc/70/95/03/1057709503.db2.gz GTMSXJDXECRJQM-UHFFFAOYSA-N -1 1 308.356 4.196 20 0 DIADMM [O-]c1cc(-c2cccc(OCC(F)(F)F)n2)ccc1Cl ZINC001243576397 1057720824 /nfs/dbraw/zinc/72/08/24/1057720824.db2.gz NIPOBZNCWCFCTK-UHFFFAOYSA-N -1 1 303.667 4.049 20 0 DIADMM COc1ccc(C(F)(F)F)c(-c2ccc(Cl)c([O-])c2)n1 ZINC001243576935 1057721147 /nfs/dbraw/zinc/72/11/47/1057721147.db2.gz XZFLRYRONREQTE-UHFFFAOYSA-N -1 1 303.667 4.135 20 0 DIADMM C[C@H]1CCCCN1c1cccc(-c2ccc(Cl)c([O-])c2)n1 ZINC001243577933 1057721421 /nfs/dbraw/zinc/72/14/21/1057721421.db2.gz DXARQAHLTVLSHA-LBPRGKRZSA-N -1 1 302.805 4.486 20 0 DIADMM CCOc1nnc(-c2ccc(Cl)c([O-])c2)c2ccccc21 ZINC001243578096 1057721572 /nfs/dbraw/zinc/72/15/72/1057721572.db2.gz ACLABIIFSBBAMG-UHFFFAOYSA-N -1 1 300.745 4.055 20 0 DIADMM C[C@@H]1CCCCN1c1cccc(-c2ccc(Cl)c([O-])c2)n1 ZINC001243577932 1057721810 /nfs/dbraw/zinc/72/18/10/1057721810.db2.gz DXARQAHLTVLSHA-GFCCVEGCSA-N -1 1 302.805 4.486 20 0 DIADMM [O-]c1cc(-c2ncc3c(n2)-c2ccccc2CC3)ccc1Cl ZINC001243579000 1057722340 /nfs/dbraw/zinc/72/23/40/1057722340.db2.gz OFRMDMXVOPBXTP-UHFFFAOYSA-N -1 1 308.768 4.268 20 0 DIADMM [O-]c1cc(-c2ccc(-c3ccc(F)cc3)nn2)ccc1Cl ZINC001243579274 1057722765 /nfs/dbraw/zinc/72/27/65/1057722765.db2.gz RPODNICQWJTIOL-UHFFFAOYSA-N -1 1 300.720 4.309 20 0 DIADMM COC(=O)c1nc2ccc(-c3ccc(Cl)c([O-])c3)cc2s1 ZINC001243581399 1057723088 /nfs/dbraw/zinc/72/30/88/1057723088.db2.gz BMGCUYHXCXWROM-UHFFFAOYSA-N -1 1 319.769 4.109 20 0 DIADMM [O-]c1cc(-c2cccnc2OCC(F)(F)F)ccc1Cl ZINC001243581825 1057723373 /nfs/dbraw/zinc/72/33/73/1057723373.db2.gz IVKOCLZLRIFWLY-UHFFFAOYSA-N -1 1 303.667 4.049 20 0 DIADMM CCOC(=O)c1cc2cccc(-c3ccc(Cl)c([O-])c3)c2[nH]1 ZINC001243581775 1057723448 /nfs/dbraw/zinc/72/34/48/1057723448.db2.gz UGBDHLVKPILSTI-UHFFFAOYSA-N -1 1 315.756 4.371 20 0 DIADMM O=c1c(-c2ccc(Cl)c([O-])c2)cccn1-c1ccccc1F ZINC001243583661 1057724286 /nfs/dbraw/zinc/72/42/86/1057724286.db2.gz JZFCLXNVZVURQR-UHFFFAOYSA-N -1 1 315.731 4.003 20 0 DIADMM [O-]c1cc(-c2ccnc(OCc3ccncc3)c2)ccc1Cl ZINC001243584923 1057725008 /nfs/dbraw/zinc/72/50/08/1057725008.db2.gz ZILFLQNVJUPQPF-UHFFFAOYSA-N -1 1 312.756 4.082 20 0 DIADMM Cc1cc(-c2ccc(C(F)(F)F)cc2[O-])nc(C(F)(F)F)n1 ZINC001243605141 1057730397 /nfs/dbraw/zinc/73/03/97/1057730397.db2.gz UCBWITBNSNOGIC-UHFFFAOYSA-N -1 1 322.208 4.195 20 0 DIADMM Cc1cccc2ncc(-c3ccc(C(F)(F)F)cc3[O-])nc12 ZINC001243608516 1057731384 /nfs/dbraw/zinc/73/13/84/1057731384.db2.gz JWDIVZTZPTTZBD-UHFFFAOYSA-N -1 1 304.271 4.330 20 0 DIADMM Cc1nc2ccc(F)cc2c(-c2ccc(C(F)(F)F)cc2[O-])n1 ZINC001243609424 1057732306 /nfs/dbraw/zinc/73/23/06/1057732306.db2.gz SJSARQDWYMRCFM-UHFFFAOYSA-N -1 1 322.261 4.469 20 0 DIADMM [O-]c1cc(C(F)(F)F)ccc1-c1ccc(-c2ccco2)nn1 ZINC001243610717 1057732936 /nfs/dbraw/zinc/73/29/36/1057732936.db2.gz PONVQHWXTBLGGT-UHFFFAOYSA-N -1 1 306.243 4.128 20 0 DIADMM C/C(=C/C(=O)Nc1ccc([O-])c(Cl)c1)c1ccc(F)cc1 ZINC000732306850 1057772551 /nfs/dbraw/zinc/77/25/51/1057772551.db2.gz ZYMJZYCUQNZZFJ-NTMALXAHSA-N -1 1 305.736 4.227 20 0 DIADMM CCOC(=O)c1nc2cc(-c3c(C)cc(F)cc3C)ccc2[n-]1 ZINC001243929276 1057810319 /nfs/dbraw/zinc/81/03/19/1057810319.db2.gz RYEPAZHRKQAYEW-UHFFFAOYSA-N -1 1 312.344 4.163 20 0 DIADMM CCOC(=O)c1nc2ccc(-c3c(C)cc(F)cc3C)cc2[n-]1 ZINC001243929276 1057810320 /nfs/dbraw/zinc/81/03/20/1057810320.db2.gz RYEPAZHRKQAYEW-UHFFFAOYSA-N -1 1 312.344 4.163 20 0 DIADMM COc1nc(-c2c([O-])cccc2Cl)cc2cc(F)ccc21 ZINC001244033088 1057844474 /nfs/dbraw/zinc/84/44/74/1057844474.db2.gz MPUFMAAXIWMPQE-UHFFFAOYSA-N -1 1 303.720 4.409 20 0 DIADMM COc1cc2cnc(-c3c([O-])cccc3Cl)cc2cc1OC ZINC001244036286 1057845130 /nfs/dbraw/zinc/84/51/30/1057845130.db2.gz KNJKPMPBBNGUEL-UHFFFAOYSA-N -1 1 315.756 4.278 20 0 DIADMM COC(=O)c1cccc2nc(-c3c([O-])cccc3Cl)ccc21 ZINC001244035255 1057845135 /nfs/dbraw/zinc/84/51/35/1057845135.db2.gz DXQDEOONPPRBHB-UHFFFAOYSA-N -1 1 313.740 4.047 20 0 DIADMM COC(=O)c1ccc2cc(-c3cc(F)c([O-])c(F)c3)ccc2c1 ZINC001244096012 1057867667 /nfs/dbraw/zinc/86/76/67/1057867667.db2.gz HIDVWZUEWHZQJG-UHFFFAOYSA-N -1 1 314.287 4.277 20 0 DIADMM [O-]c1c(F)cc(-c2ccc3nnc(-c4ccccc4)n3c2)cc1F ZINC001244096217 1057867702 /nfs/dbraw/zinc/86/77/02/1057867702.db2.gz FWGPPGQSJFKKAI-UHFFFAOYSA-N -1 1 323.302 4.047 20 0 DIADMM COc1cc(OC(F)(F)F)ccc1-c1cc(F)c([O-])c(F)c1 ZINC001244095661 1057867846 /nfs/dbraw/zinc/86/78/46/1057867846.db2.gz CMPOYCPELFOSHZ-UHFFFAOYSA-N -1 1 320.213 4.245 20 0 DIADMM Cc1ccc([O-])c(-c2ncc(C)c(-c3c(F)cccc3F)n2)c1 ZINC001244403119 1057951091 /nfs/dbraw/zinc/95/10/91/1057951091.db2.gz OMUDBYYAUJMBDR-UHFFFAOYSA-N -1 1 312.319 4.411 20 0 DIADMM Cc1cccc(Oc2nc(-c3cc(C)ccc3[O-])ncc2F)c1 ZINC001244403668 1057952059 /nfs/dbraw/zinc/95/20/59/1057952059.db2.gz XSDVNRJKZZTTHD-UHFFFAOYSA-N -1 1 310.328 4.397 20 0 DIADMM [O-]c1cc(OC(F)(F)F)ccc1-c1ccc2ncc(F)cc2n1 ZINC001244461700 1057965044 /nfs/dbraw/zinc/96/50/44/1057965044.db2.gz BHTJPJNAUAMIRX-UHFFFAOYSA-N -1 1 324.233 4.040 20 0 DIADMM CCCc1cc(-c2ccc(OC(F)(F)F)cc2[O-])nc(C)n1 ZINC001244464398 1057966266 /nfs/dbraw/zinc/96/62/66/1057966266.db2.gz KOMKLFYICQWMML-UHFFFAOYSA-N -1 1 312.291 4.009 20 0 DIADMM [O-]c1cc(OC(F)(F)F)ccc1-c1ncnc2c1CCCCC2 ZINC001244465399 1057966824 /nfs/dbraw/zinc/96/68/24/1057966824.db2.gz WBHDFPQWBGKHQI-UHFFFAOYSA-N -1 1 324.302 4.017 20 0 DIADMM Cc1cc(-c2cncc(N3CCC(C)CC3)n2)cc(Cl)c1[O-] ZINC001244536000 1057988431 /nfs/dbraw/zinc/98/84/31/1057988431.db2.gz FZLFKGGOJNZCKY-UHFFFAOYSA-N -1 1 317.820 4.047 20 0 DIADMM Cc1cc(-c2ncc3c(n2)-c2ccccc2OC3)cc(Cl)c1[O-] ZINC001244536301 1057988960 /nfs/dbraw/zinc/98/89/60/1057988960.db2.gz IVUJGUALYZHAFM-UHFFFAOYSA-N -1 1 324.767 4.370 20 0 DIADMM COc1ccc2ccc(-c3c(Cl)ccc([O-])c3F)nc2c1 ZINC001244537607 1057989094 /nfs/dbraw/zinc/98/90/94/1057989094.db2.gz BYUCMXTUQLWKAJ-UHFFFAOYSA-N -1 1 303.720 4.409 20 0 DIADMM [O-]c1ccc(Cl)c(-c2ncc(-c3ccccc3)cn2)c1F ZINC001244537425 1057989269 /nfs/dbraw/zinc/98/92/69/1057989269.db2.gz DYQCKBJJDJQPLB-UHFFFAOYSA-N -1 1 300.720 4.309 20 0 DIADMM [O-]c1ccc(Cl)c(-c2cncc(-c3ccccc3)n2)c1F ZINC001244537341 1057989331 /nfs/dbraw/zinc/98/93/31/1057989331.db2.gz CMBVHGGJMADDOG-UHFFFAOYSA-N -1 1 300.720 4.309 20 0 DIADMM [O-]c1ccc(Cl)c(-c2ncnc3cc(F)cc(F)c32)c1F ZINC001244537669 1057989358 /nfs/dbraw/zinc/98/93/58/1057989358.db2.gz DKWJTPKJYOFXEN-UHFFFAOYSA-N -1 1 310.662 4.073 20 0 DIADMM Cc1cc(-c2ncccc2C2CCOCC2)cc(Cl)c1[O-] ZINC001244537754 1057990014 /nfs/dbraw/zinc/99/00/14/1057990014.db2.gz FLASIYQQAYBLGG-UHFFFAOYSA-N -1 1 303.789 4.310 20 0 DIADMM Cc1cc(-c2cccc(COCC3CC3)n2)cc(Cl)c1[O-] ZINC001244539577 1057990475 /nfs/dbraw/zinc/99/04/75/1057990475.db2.gz XKKDZMKWOGLRRH-UHFFFAOYSA-N -1 1 303.789 4.343 20 0 DIADMM CC(C)(C)NC(=O)c1ccc(-c2c(Cl)ccc([O-])c2F)cc1 ZINC001244539919 1057990479 /nfs/dbraw/zinc/99/04/79/1057990479.db2.gz NMDJZOXSHVBFLG-UHFFFAOYSA-N -1 1 321.779 4.380 20 0 DIADMM [O-]c1ccc(Cl)c(-c2nc(CC3CC3)nc3[nH]ccc32)c1F ZINC001244539672 1057990513 /nfs/dbraw/zinc/99/05/13/1057990513.db2.gz BNYMNVQLQBCAFF-UHFFFAOYSA-N -1 1 317.751 4.027 20 0 DIADMM Cn1cccc1-c1ccc(-c2c(Cl)ccc([O-])c2F)nc1 ZINC001244540107 1057990792 /nfs/dbraw/zinc/99/07/92/1057990792.db2.gz PMCMQTFRYYEUEC-UHFFFAOYSA-N -1 1 302.736 4.252 20 0 DIADMM Cc1cc(-c2nc(CC3CC3)nc3[nH]ccc32)cc(Cl)c1[O-] ZINC001244539630 1057990844 /nfs/dbraw/zinc/99/08/44/1057990844.db2.gz ZUOKCBYFRCMYIG-UHFFFAOYSA-N -1 1 313.788 4.196 20 0 DIADMM CC[S@@](=N)(=O)c1ccc(-c2c(Cl)ccc([O-])c2F)cc1 ZINC001244542101 1057991210 /nfs/dbraw/zinc/99/12/10/1057991210.db2.gz IFQWJSULHSPVMI-HXUWFJFHSA-N -1 1 313.781 4.277 20 0 DIADMM CCOC(=O)c1cccc(-c2c(Cl)ccc([O-])c2F)c1C ZINC001244541923 1057991261 /nfs/dbraw/zinc/99/12/61/1057991261.db2.gz JRFFDQCYLZBRIA-UHFFFAOYSA-N -1 1 308.736 4.337 20 0 DIADMM [O-]c1ccc(Cl)c(-c2cccc(-c3cccnc3)n2)c1F ZINC001244543138 1057992051 /nfs/dbraw/zinc/99/20/51/1057992051.db2.gz ROYPMYRVKYMXLW-UHFFFAOYSA-N -1 1 300.720 4.309 20 0 DIADMM Cn1cncc1-c1cccc(-c2c(Cl)ccc([O-])c2F)c1 ZINC001244542570 1057992191 /nfs/dbraw/zinc/99/21/91/1057992191.db2.gz NKXBOXAOBGQCER-UHFFFAOYSA-N -1 1 302.736 4.252 20 0 DIADMM CC(=O)Nc1c(C)cc(-c2c(Cl)ccc([O-])c2F)cc1C ZINC001244543583 1057992205 /nfs/dbraw/zinc/99/22/05/1057992205.db2.gz XSECANHYRGWDAR-UHFFFAOYSA-N -1 1 307.752 4.427 20 0 DIADMM CCOC(=O)c1nc2cc(-c3cc(OCC)ccc3C)ccc2[n-]1 ZINC001244873211 1058062460 /nfs/dbraw/zinc/06/24/60/1058062460.db2.gz GNENFBAIMJSNAH-UHFFFAOYSA-N -1 1 324.380 4.114 20 0 DIADMM CCOC(=O)c1nc2ccc(-c3cc(OCC)ccc3C)cc2[n-]1 ZINC001244873211 1058062466 /nfs/dbraw/zinc/06/24/66/1058062466.db2.gz GNENFBAIMJSNAH-UHFFFAOYSA-N -1 1 324.380 4.114 20 0 DIADMM O=C([O-])c1cc(-c2cccc3cncn32)c(Cl)cc1Cl ZINC001245005578 1058090273 /nfs/dbraw/zinc/09/02/73/1058090273.db2.gz XUNOPQYPKKTHRH-UHFFFAOYSA-N -1 1 307.136 4.006 20 0 DIADMM COc1ccccc1-c1cc(-c2cc(Cl)ccc2[O-])ncn1 ZINC001245049744 1058102382 /nfs/dbraw/zinc/10/23/82/1058102382.db2.gz LVJLJTQDIFVWPY-UHFFFAOYSA-N -1 1 312.756 4.178 20 0 DIADMM CSc1nc2c(c(-c3cc(Cl)ccc3[O-])n1)CCCC2 ZINC001245049949 1058102619 /nfs/dbraw/zinc/10/26/19/1058102619.db2.gz YTNMBQFDTBFLMZ-UHFFFAOYSA-N -1 1 306.818 4.103 20 0 DIADMM COc1cc2ccc(-c3cc(Cl)ccc3[O-])nc2cc1OC ZINC001245049556 1058102660 /nfs/dbraw/zinc/10/26/60/1058102660.db2.gz YGTSWTIXSLHIDE-UHFFFAOYSA-N -1 1 315.756 4.278 20 0 DIADMM COC(=O)c1cccc2nc(-c3cc(Cl)ccc3[O-])ccc21 ZINC001245050582 1058103501 /nfs/dbraw/zinc/10/35/01/1058103501.db2.gz VTTBCBXGTKXQMC-UHFFFAOYSA-N -1 1 313.740 4.047 20 0 DIADMM CCOC(=O)c1nc2cc(-c3ccc(Cl)cc3C)ccc2[n-]1 ZINC001245086184 1058109687 /nfs/dbraw/zinc/10/96/87/1058109687.db2.gz AHHZNBWRJBQYTC-UHFFFAOYSA-N -1 1 314.772 4.368 20 0 DIADMM CCOC(=O)c1nc2ccc(-c3ccc(Cl)cc3C)cc2[n-]1 ZINC001245086184 1058109690 /nfs/dbraw/zinc/10/96/90/1058109690.db2.gz AHHZNBWRJBQYTC-UHFFFAOYSA-N -1 1 314.772 4.368 20 0 DIADMM Cc1ccccc1[C@H](NC(=O)c1ccc([O-])c(F)c1)C(C)(C)C ZINC001545295136 1058193992 /nfs/dbraw/zinc/19/39/92/1058193992.db2.gz GFIFNGBXYRJXTG-KRWDZBQOSA-N -1 1 315.388 4.357 20 0 DIADMM CCN1CCc2ccc(NC(=O)c3ccc(C(C)C)cc3[O-])cc21 ZINC001547269391 1058242879 /nfs/dbraw/zinc/24/28/79/1058242879.db2.gz KKMFPYQFXAKJPD-UHFFFAOYSA-N -1 1 324.424 4.150 20 0 DIADMM O=C([O-])c1ccc(-c2ccc(-c3ccc4cncn4c3)cc2)cc1 ZINC001245664722 1058317321 /nfs/dbraw/zinc/31/73/21/1058317321.db2.gz LRFRYFOZOWTHIQ-UHFFFAOYSA-N -1 1 314.344 4.367 20 0 DIADMM CC(C)(C)OC(=O)c1ccc(-c2c(F)ccc([O-])c2Cl)nc1 ZINC001245826093 1058521277 /nfs/dbraw/zinc/52/12/77/1058521277.db2.gz BILLSNGGIYSEIV-UHFFFAOYSA-N -1 1 323.751 4.202 20 0 DIADMM [O-]c1ccc(F)c(-c2ncnc3[nH]c4c(c32)CCCC4)c1Cl ZINC001245826922 1058521350 /nfs/dbraw/zinc/52/13/50/1058521350.db2.gz IHFRXROGHIVGMM-UHFFFAOYSA-N -1 1 317.751 4.002 20 0 DIADMM [O-]c1ccc(F)c(-c2nccc(C(F)(F)F)c2F)c1Cl ZINC001245826226 1058523282 /nfs/dbraw/zinc/52/32/82/1058523282.db2.gz HBXMUKFHNMVDGY-UHFFFAOYSA-N -1 1 309.621 4.405 20 0 DIADMM [O-]c1ccc(F)c(-c2nccnc2Oc2ccccc2)c1Cl ZINC001245830094 1058528263 /nfs/dbraw/zinc/52/82/63/1058528263.db2.gz ISUBBUYUVQSUIV-UHFFFAOYSA-N -1 1 316.719 4.434 20 0 DIADMM COC(=O)c1cc2[nH]ccc2cc1-c1c(F)ccc([O-])c1Cl ZINC001245831281 1058528548 /nfs/dbraw/zinc/52/85/48/1058528548.db2.gz ISAPTQSJHDCPEW-UHFFFAOYSA-N -1 1 319.719 4.120 20 0 DIADMM COc1cc2cccnc2c(-c2c(F)ccc([O-])c2Cl)c1 ZINC001245831175 1058529881 /nfs/dbraw/zinc/52/98/81/1058529881.db2.gz GLHCCPNUCVTYCJ-UHFFFAOYSA-N -1 1 303.720 4.409 20 0 DIADMM CCOC(=O)c1cccc(-c2c(F)ccc([O-])c2Cl)c1C ZINC001245831208 1058529958 /nfs/dbraw/zinc/52/99/58/1058529958.db2.gz HJZSTZTZJFMSEO-UHFFFAOYSA-N -1 1 308.736 4.337 20 0 DIADMM COc1ccnc2ccc(-c3c(F)ccc([O-])c3Cl)cc21 ZINC001245831820 1058531570 /nfs/dbraw/zinc/53/15/70/1058531570.db2.gz JOOSFZYUMABMDX-UHFFFAOYSA-N -1 1 303.720 4.409 20 0 DIADMM CCOC(=O)/C=C/c1ccc(-c2c(F)ccc([O-])c2Cl)cc1 ZINC001245832594 1058533916 /nfs/dbraw/zinc/53/39/16/1058533916.db2.gz QMOQLCMICWGRPH-BJMVGYQFSA-N -1 1 320.747 4.428 20 0 DIADMM COC(=O)C(C)(C)c1cccc(-c2c(F)ccc([O-])c2Cl)c1 ZINC001245833373 1058537617 /nfs/dbraw/zinc/53/76/17/1058537617.db2.gz YXAGRIXLOHUZIC-UHFFFAOYSA-N -1 1 322.763 4.302 20 0 DIADMM CC(=O)Nc1ccc(-c2c(F)ccc([O-])c2Cl)c(C)c1C ZINC001245835623 1058539360 /nfs/dbraw/zinc/53/93/60/1058539360.db2.gz VAMABPYOVGBFLO-UHFFFAOYSA-N -1 1 307.752 4.427 20 0 DIADMM CC1(C)NC(=O)Nc2cc(-c3c(F)ccc([O-])c3Cl)ccc21 ZINC001245836173 1058540158 /nfs/dbraw/zinc/54/01/58/1058540158.db2.gz YKNYOEOWNAMGHG-UHFFFAOYSA-N -1 1 320.751 4.222 20 0 DIADMM CC1(C)Cc2cc(-c3c(F)ccc([O-])c3Cl)ccc2NC1=O ZINC001245835326 1058541421 /nfs/dbraw/zinc/54/14/21/1058541421.db2.gz PAJBJOBUCHFAAO-UHFFFAOYSA-N -1 1 319.763 4.373 20 0 DIADMM CC1(C)Cc2cccc(-c3c(F)ccc([O-])c3Cl)c2NC1=O ZINC001245834749 1058541481 /nfs/dbraw/zinc/54/14/81/1058541481.db2.gz KYVAFRAVHUXRNB-UHFFFAOYSA-N -1 1 319.763 4.373 20 0 DIADMM O=C(Nc1ccc(-c2ccco2)cc1F)c1cccc([O-])c1F ZINC001556355047 1058582081 /nfs/dbraw/zinc/58/20/81/1058582081.db2.gz CVIJVTAGYDQYBN-UHFFFAOYSA-N -1 1 315.275 4.183 20 0 DIADMM CC(C)(NC(=O)c1cc(Cl)ccc1[O-])c1ccc(Cl)cc1 ZINC001556580701 1058613983 /nfs/dbraw/zinc/61/39/83/1058613983.db2.gz VGYJEUHVVHPKQJ-UHFFFAOYSA-N -1 1 324.207 4.364 20 0 DIADMM O=C(Nc1ccc([O-])c(F)c1F)c1ccc(-c2ccco2)s1 ZINC001556591660 1058615255 /nfs/dbraw/zinc/61/52/55/1058615255.db2.gz GMBQUHFBJUJVAY-UHFFFAOYSA-N -1 1 321.304 4.244 20 0 DIADMM CCc1c2ccccc2oc1C(=O)Nc1ccc([O-])c(F)c1F ZINC001556592326 1058618705 /nfs/dbraw/zinc/61/87/05/1058618705.db2.gz HNYQMVMXJBPQSZ-UHFFFAOYSA-N -1 1 317.291 4.231 20 0 DIADMM O=c1cc(CCC2CCCC2)[n-]n1-c1cccc2ncccc21 ZINC001245931307 1058633702 /nfs/dbraw/zinc/63/37/02/1058633702.db2.gz FEICVMVFZRLMJI-UHFFFAOYSA-N -1 1 307.397 4.249 20 0 DIADMM O=c1cc(CCC2CCCC2)[n-]n1-c1ccc2ncccc2c1 ZINC001245931586 1058634447 /nfs/dbraw/zinc/63/44/47/1058634447.db2.gz HIWBEQFUYDAQMJ-UHFFFAOYSA-N -1 1 307.397 4.249 20 0 DIADMM CC[C@H](C)CO[N-]C(=O)[C@H](C)c1ccc(Cl)c(Cl)c1 ZINC001556803584 1058643191 /nfs/dbraw/zinc/64/31/91/1058643191.db2.gz FTSCWWAOIFXSKZ-VHSXEESVSA-N -1 1 304.217 4.191 20 0 DIADMM CCc1ccc(C(=O)Nc2ccnn2[C@@H](C)CC(C)C)c([O-])c1 ZINC001556872535 1058662002 /nfs/dbraw/zinc/66/20/02/1058662002.db2.gz SJZYFTBBYCDTLR-ZDUSSCGKSA-N -1 1 315.417 4.011 20 0 DIADMM C[C@@H]1CCCC[C@@]1(C)NC(=O)c1ccc(C(F)(F)F)c([O-])c1 ZINC001556916789 1058667477 /nfs/dbraw/zinc/66/74/77/1058667477.db2.gz WJMYEGHFYBMGFO-MEBBXXQBSA-N -1 1 315.335 4.110 20 0 DIADMM O=C(Cc1cccc2ccccc21)Nc1cc([O-])c(F)cc1F ZINC001556919776 1058668926 /nfs/dbraw/zinc/66/89/26/1058668926.db2.gz PICOESGEGZYYAT-UHFFFAOYSA-N -1 1 313.303 4.005 20 0 DIADMM CC(C)CCc1cc(NC(=O)c2cc3ccccc3cc2[O-])n[nH]1 ZINC001557211169 1058718320 /nfs/dbraw/zinc/71/83/20/1058718320.db2.gz PLJUVGGGKZUHJE-UHFFFAOYSA-N -1 1 323.396 4.109 20 0 DIADMM O=C(c1ccc([O-])c(F)c1)N1Cc2ccccc2-c2ccccc21 ZINC001557291697 1058729310 /nfs/dbraw/zinc/72/93/10/1058729310.db2.gz CVEYVONFJKMJQI-UHFFFAOYSA-N -1 1 319.335 4.359 20 0 DIADMM CC1(NC(=O)c2ccc3ccccc3c2[O-])CCC(F)(F)CC1 ZINC001557508436 1058759019 /nfs/dbraw/zinc/75/90/19/1058759019.db2.gz FMRPZDUYCPOZFT-UHFFFAOYSA-N -1 1 319.351 4.243 20 0 DIADMM CCCOc1ccc(Cl)cc1C(=O)Nc1cccc(F)c1[O-] ZINC001557958176 1058818748 /nfs/dbraw/zinc/81/87/48/1058818748.db2.gz XYCSWZFJWKONBE-UHFFFAOYSA-N -1 1 323.751 4.226 20 0 DIADMM CC(C)(C)c1ccc(CNC(=O)c2c([O-])cccc2Cl)s1 ZINC001558242829 1058855650 /nfs/dbraw/zinc/85/56/50/1058855650.db2.gz LFHJISGVONNZFV-UHFFFAOYSA-N -1 1 323.845 4.335 20 0 DIADMM O=C(Nc1cc(F)c([O-])cc1Cl)c1ccc(F)c2occc21 ZINC001558644440 1058894881 /nfs/dbraw/zinc/89/48/81/1058894881.db2.gz KSTYKLVYRJSVLD-UHFFFAOYSA-N -1 1 323.682 4.322 20 0 DIADMM O=C(Nc1cc(F)c([O-])cc1Cl)[C@@H]1C[C@H]1c1ccc(F)cc1 ZINC001558644533 1058896847 /nfs/dbraw/zinc/89/68/47/1058896847.db2.gz OGOCMZAODCGTIF-WDEREUQCSA-N -1 1 323.726 4.066 20 0 DIADMM CCCCOc1ccc(C(=O)Nc2ccc3[nH]ccc3c2)c([O-])c1 ZINC001558909139 1058921167 /nfs/dbraw/zinc/92/11/67/1058921167.db2.gz SOZXTDKAIFCQRM-UHFFFAOYSA-N -1 1 324.380 4.305 20 0 DIADMM O=C(C[C@@H]1CCC[C@H](C(F)(F)F)C1)Nc1ccc(F)cc1[O-] ZINC001558955793 1058928450 /nfs/dbraw/zinc/92/84/50/1058928450.db2.gz JPXDHQPJHNMJPG-ZJUUUORDSA-N -1 1 319.298 4.229 20 0 DIADMM O=C([N-]c1c(F)cccc1F)c1sc2ncccc2c1Cl ZINC001522212105 1059063790 /nfs/dbraw/zinc/06/37/90/1059063790.db2.gz KNVXPBJYDWEVAW-UHFFFAOYSA-N -1 1 324.739 4.480 20 0 DIADMM CCCc1cc(=O)[n-]c(SCCc2ccc(Cl)cc2)n1 ZINC001559324447 1059162778 /nfs/dbraw/zinc/16/27/78/1059162778.db2.gz RGHFVQSSZUUSAD-UHFFFAOYSA-N -1 1 308.834 4.123 20 0 DIADMM O=c1cc(CSCc2ccccc2F)c2ccc([O-])cc2o1 ZINC001559480435 1059253263 /nfs/dbraw/zinc/25/32/63/1059253263.db2.gz BFEHHDCXDNCIGD-UHFFFAOYSA-N -1 1 316.353 4.071 20 0 DIADMM Cc1c(F)cccc1-c1noc(Cc2ccc([O-])c(Cl)c2)n1 ZINC001247588002 1059567676 /nfs/dbraw/zinc/56/76/76/1059567676.db2.gz QFXWFGXQHLDLNQ-UHFFFAOYSA-N -1 1 318.735 4.134 20 0 DIADMM Cc1ccc(-c2noc(Cc3ccc([O-])c(Cl)c3)n2)cc1C ZINC001247588438 1059568180 /nfs/dbraw/zinc/56/81/80/1059568180.db2.gz ZFVZHEQKCGCFDJ-UHFFFAOYSA-N -1 1 314.772 4.303 20 0 DIADMM CCC[C@@H](C)[C@@H]1CCCN1C(=O)NCc1ccc([O-])c(Cl)c1 ZINC001248411179 1059819333 /nfs/dbraw/zinc/81/93/33/1059819333.db2.gz MUMPWEULMCHCTN-DOMZBBRYSA-N -1 1 324.852 4.156 20 0 DIADMM CCc1cccc(C)c1NC(=S)Nc1ccc([O-])c(F)c1F ZINC001249553043 1060291055 /nfs/dbraw/zinc/29/10/55/1060291055.db2.gz RJHWGBBIDRDIFN-UHFFFAOYSA-N -1 1 322.380 4.350 20 0 DIADMM [O-]c1cccc(CNCC(F)(F)c2cccc(F)c2)c1Cl ZINC001560526260 1060325411 /nfs/dbraw/zinc/32/54/11/1060325411.db2.gz JWODEXZBHXEPGZ-UHFFFAOYSA-N -1 1 315.722 4.066 20 0 DIADMM COc1ccc(C)cc1NC(=S)Nc1cccc([O-])c1Cl ZINC001249668930 1060340185 /nfs/dbraw/zinc/34/01/85/1060340185.db2.gz KFWPKVKHFJGIKA-UHFFFAOYSA-N -1 1 322.817 4.172 20 0 DIADMM Cn1cc(Nc2ccc(Cl)c(Cl)c2[O-])c2ccncc21 ZINC001249698706 1060356716 /nfs/dbraw/zinc/35/67/16/1060356716.db2.gz KXPXQYFEXXRQEP-UHFFFAOYSA-N -1 1 308.168 4.329 20 0 DIADMM COc1cc(Nc2cc(Cl)c(C)c(Cl)c2[O-])ccc1N ZINC001249724799 1060374314 /nfs/dbraw/zinc/37/43/14/1060374314.db2.gz RRDFFFRLLFXBCW-UHFFFAOYSA-N -1 1 313.184 4.342 20 0 DIADMM CC(C)Oc1cc(F)c(Nc2c([O-])cc(F)cc2F)c(F)c1 ZINC001249775686 1060393395 /nfs/dbraw/zinc/39/33/95/1060393395.db2.gz CXXOBULKNSQEMZ-UHFFFAOYSA-N -1 1 315.266 4.479 20 0 DIADMM Cc1ccc2[nH]c(Nc3cc4ccc([O-])cc4oc3=O)cc2c1 ZINC001249844269 1060418473 /nfs/dbraw/zinc/41/84/73/1060418473.db2.gz RXQNNBQFLANMAN-UHFFFAOYSA-N -1 1 306.321 4.032 20 0 DIADMM O=C1CCCCc2ccc(Nc3cc(F)c([O-])cc3F)cc21 ZINC001249894157 1060455595 /nfs/dbraw/zinc/45/55/95/1060455595.db2.gz VLXROSZRTFVNLO-UHFFFAOYSA-N -1 1 303.308 4.323 20 0 DIADMM Cc1ccc(C([O-])=Cc2c(F)c(F)c(F)c(F)c2F)cc1 ZINC001249908327 1060474630 /nfs/dbraw/zinc/47/46/30/1060474630.db2.gz LRVPMRXPIVJEAU-UHFFFAOYSA-N -1 1 300.226 4.116 20 0 DIADMM CCNc1ccnc(Cl)c1Nc1cc([O-])c(F)c(F)c1F ZINC001249960418 1060502529 /nfs/dbraw/zinc/50/25/29/1060502529.db2.gz GSPGIWYBPOUEHR-UHFFFAOYSA-N -1 1 317.698 4.033 20 0 DIADMM [O-]c1cc(Nc2csc(-c3ccncc3)n2)c(F)c(F)c1F ZINC001249961609 1060505371 /nfs/dbraw/zinc/50/53/71/1060505371.db2.gz UYYAMZPQYBMMAZ-UHFFFAOYSA-N -1 1 323.299 4.072 20 0 DIADMM Cc1ccc2cccc(Nc3cc([O-])c(F)c(F)c3F)c2n1 ZINC001249961792 1060506130 /nfs/dbraw/zinc/50/61/30/1060506130.db2.gz GDBKHJZTWSLCBV-UHFFFAOYSA-N -1 1 304.271 4.410 20 0 DIADMM [O-]c1cc(Nc2cc(F)cc(F)c2Cl)c(F)c(F)c1F ZINC001249964645 1060506898 /nfs/dbraw/zinc/50/68/98/1060506898.db2.gz JYHGSYVKNJLNCQ-UHFFFAOYSA-N -1 1 309.621 4.485 20 0 DIADMM COc1ccc2cc(Nc3cc([O-])c(F)c(F)c3F)ccc2n1 ZINC001249965120 1060507687 /nfs/dbraw/zinc/50/76/87/1060507687.db2.gz WEITZJFTERRANB-UHFFFAOYSA-N -1 1 320.270 4.110 20 0 DIADMM CC(C)OCc1cccc(Nc2cc([O-])c(F)c(F)c2F)c1 ZINC001249964600 1060508866 /nfs/dbraw/zinc/50/88/66/1060508866.db2.gz HSBYOZCSVPMOGB-UHFFFAOYSA-N -1 1 311.303 4.478 20 0 DIADMM [O-]c1cc(Nc2c(F)cc(Cl)cc2F)c(F)c(F)c1F ZINC001249965027 1060509475 /nfs/dbraw/zinc/50/94/75/1060509475.db2.gz RJIZMERLYQQXAL-UHFFFAOYSA-N -1 1 309.621 4.485 20 0 DIADMM [O-]c1cc(Nc2ccc(C3CCOCC3)cc2)c(F)c(F)c1F ZINC001249963627 1060510166 /nfs/dbraw/zinc/51/01/66/1060510166.db2.gz QNMHXFNDTUYYNS-UHFFFAOYSA-N -1 1 323.314 4.447 20 0 DIADMM [O-]c1cc(Nc2ccc(F)c(Cl)c2F)c(F)c(F)c1F ZINC001249964170 1060510442 /nfs/dbraw/zinc/51/04/42/1060510442.db2.gz ZXOBLAYPNYSOBX-UHFFFAOYSA-N -1 1 309.621 4.485 20 0 DIADMM COc1cc(Nc2cc([O-])c(F)c(F)c2F)cc2cccnc21 ZINC001249965894 1060512867 /nfs/dbraw/zinc/51/28/67/1060512867.db2.gz QTHMEBXRLIGUML-UHFFFAOYSA-N -1 1 320.270 4.110 20 0 DIADMM [O-]c1cc(Nc2ccc(F)c3cnccc23)c(F)c(F)c1F ZINC001249965832 1060514415 /nfs/dbraw/zinc/51/44/15/1060514415.db2.gz NTKAJSRZGVLRJG-UHFFFAOYSA-N -1 1 308.234 4.240 20 0 DIADMM O=c1cc(C(F)(F)F)[nH]cc1Nc1cc(Cl)c([O-])cc1F ZINC001250020374 1060543921 /nfs/dbraw/zinc/54/39/21/1060543921.db2.gz SGAUEQUMJVDDLK-UHFFFAOYSA-N -1 1 322.645 4.048 20 0 DIADMM Cc1cn(-c2ccc(Nc3cc(Cl)c([O-])cc3F)cc2)cn1 ZINC001250022880 1060546222 /nfs/dbraw/zinc/54/62/22/1060546222.db2.gz XLRSGOOZTBKWKK-UHFFFAOYSA-N -1 1 317.751 4.422 20 0 DIADMM CC(C)c1cc2ncc(Nc3cc(Cl)c([O-])cc3F)cn2n1 ZINC001250023100 1060547010 /nfs/dbraw/zinc/54/70/10/1060547010.db2.gz CDAAVEYFHAYXBH-UHFFFAOYSA-N -1 1 320.755 4.094 20 0 DIADMM Cc1cccc(-n2nccc2Nc2cc(Cl)c([O-])cc2F)c1 ZINC001250023483 1060547179 /nfs/dbraw/zinc/54/71/79/1060547179.db2.gz LCWXSMRMUUNPNW-UHFFFAOYSA-N -1 1 317.751 4.422 20 0 DIADMM Cc1nn(C)c2cc(Nc3cc(Cl)c([O-])cc3F)ccc12 ZINC001250024159 1060550495 /nfs/dbraw/zinc/55/04/95/1060550495.db2.gz UJOLJTMPMXYSFB-UHFFFAOYSA-N -1 1 305.740 4.123 20 0 DIADMM [O-]c1cc(F)c(Nc2cccc(Cn3ccnc3)c2)cc1Cl ZINC001250024134 1060550708 /nfs/dbraw/zinc/55/07/08/1060550708.db2.gz SUROSULQRJTXDU-UHFFFAOYSA-N -1 1 317.751 4.173 20 0 DIADMM COc1ccc(Nc2cc(Cl)c([O-])cc2F)c2ncccc12 ZINC001250027417 1060553588 /nfs/dbraw/zinc/55/35/88/1060553588.db2.gz XZEYIEUZJZOBCI-UHFFFAOYSA-N -1 1 318.735 4.485 20 0 DIADMM [O-]c1ccc(Cc2cccc(OC(F)(F)F)c2)c(F)c1F ZINC001250222485 1060702405 /nfs/dbraw/zinc/70/24/05/1060702405.db2.gz OXJSOURNVXSYDO-UHFFFAOYSA-N -1 1 304.214 4.160 20 0 DIADMM Cc1cc(Nc2c(F)ccc([O-])c2Cl)n(CC2CCC2)n1 ZINC001250229172 1060707483 /nfs/dbraw/zinc/70/74/83/1060707483.db2.gz BZFXUAVKLXWBAX-UHFFFAOYSA-N -1 1 309.772 4.233 20 0 DIADMM [O-]c1ccc(F)c(Nc2cnc(Cl)nc2Cl)c1Cl ZINC001250228645 1060708548 /nfs/dbraw/zinc/70/85/48/1060708548.db2.gz IMRFIVRPRFERML-UHFFFAOYSA-N -1 1 308.527 4.025 20 0 DIADMM CC1(C)C(=O)Nc2cc(Nc3c(F)ccc([O-])c3Cl)ccc21 ZINC001250232597 1060710532 /nfs/dbraw/zinc/71/05/32/1060710532.db2.gz RYVVMWILKVJRPI-UHFFFAOYSA-N -1 1 320.751 4.158 20 0 DIADMM [O-]c1ccc(F)c(Nc2cccnc2C(F)(F)F)c1Cl ZINC001250230005 1060711132 /nfs/dbraw/zinc/71/11/32/1060711132.db2.gz QIPQYYHPSQANOG-UHFFFAOYSA-N -1 1 306.646 4.342 20 0 DIADMM CC(C)NC(=O)c1ccc(Nc2c(F)ccc([O-])c2Cl)cc1 ZINC001250232779 1060711370 /nfs/dbraw/zinc/71/13/70/1060711370.db2.gz CXMCWPAWAMQNAW-UHFFFAOYSA-N -1 1 322.767 4.067 20 0 DIADMM CCn1cc2cc(Nc3c(F)ccc([O-])c3Cl)ccc2n1 ZINC001250232135 1060712237 /nfs/dbraw/zinc/71/22/37/1060712237.db2.gz AFRRQCULNWZAEH-UHFFFAOYSA-N -1 1 305.740 4.298 20 0 DIADMM COc1cc(F)c(F)cc1Nc1c(F)ccc([O-])c1Cl ZINC001250232425 1060712508 /nfs/dbraw/zinc/71/25/08/1060712508.db2.gz KVVKELJBLFWKCN-UHFFFAOYSA-N -1 1 303.667 4.215 20 0 DIADMM [O-]c1ccc(F)c(Nc2ccc(OCC3CC3)nc2)c1Cl ZINC001250234303 1060713995 /nfs/dbraw/zinc/71/39/95/1060713995.db2.gz PKGAMLZBLJKQFB-UHFFFAOYSA-N -1 1 308.740 4.112 20 0 DIADMM [O-]c1ccc(F)c(Nc2cc(Cl)ccc2CO)c1Cl ZINC001250236063 1060716463 /nfs/dbraw/zinc/71/64/63/1060716463.db2.gz GZRZVQQSJVDPOI-UHFFFAOYSA-N -1 1 302.132 4.074 20 0 DIADMM COc1ccc2c(c1Nc1c(F)ccc([O-])c1Cl)C(=O)CC2 ZINC001250236106 1060716904 /nfs/dbraw/zinc/71/69/04/1060716904.db2.gz ILMDFKZJCQCNCT-UHFFFAOYSA-N -1 1 321.735 4.066 20 0 DIADMM O=c1ccc2cc(Nc3c(F)ccc([O-])c3Cl)ccc2o1 ZINC001250238233 1060721409 /nfs/dbraw/zinc/72/14/09/1060721409.db2.gz YMCUAABBWLXAFU-UHFFFAOYSA-N -1 1 305.692 4.035 20 0 DIADMM CCOc1ccc(Nc2ccc(-n3ccc(=O)[n-]3)cc2)cc1CC ZINC001250284514 1060756081 /nfs/dbraw/zinc/75/60/81/1060756081.db2.gz WYEJZBNIIFUUSK-UHFFFAOYSA-N -1 1 323.396 4.283 20 0 DIADMM [O-]c1cc(C(F)(F)F)ccc1-c1ccc(C(F)(F)F)cn1 ZINC001250448430 1060807165 /nfs/dbraw/zinc/80/71/65/1060807165.db2.gz CNYFRZFJZHVNOO-UHFFFAOYSA-N -1 1 307.193 4.492 20 0 DIADMM CCCC[C@@H](CCC)C[N-]S(=O)(=O)c1cc2ccccc2o1 ZINC001561360492 1060926938 /nfs/dbraw/zinc/92/69/38/1060926938.db2.gz QMLPAGRTJZAIPM-CQSZACIVSA-N -1 1 323.458 4.318 20 0 DIADMM CSCCCn1c2ccccc2nc1-c1cccc(F)c1[O-] ZINC001250683375 1061014735 /nfs/dbraw/zinc/01/47/35/1061014735.db2.gz CXGWFUBQGTZTSS-UHFFFAOYSA-N -1 1 316.401 4.301 20 0 DIADMM CCOc1ccc2nc(-c3cccc(F)c3[O-])n(C3CC3)c2c1 ZINC001250683342 1061015132 /nfs/dbraw/zinc/01/51/32/1061015132.db2.gz BSTFMKABJDQCAZ-UHFFFAOYSA-N -1 1 312.344 4.282 20 0 DIADMM Cc1c(NCc2ccc([O-])c(F)c2F)cccc1-c1ncco1 ZINC001462280108 1061073142 /nfs/dbraw/zinc/07/31/42/1061073142.db2.gz AHZGLYDZLWWSMF-UHFFFAOYSA-N -1 1 316.307 4.246 20 0 DIADMM [O-]c1c(F)ccc(F)c1-c1nc2ccc(C(F)(F)F)cc2[nH]1 ZINC001250801414 1061074937 /nfs/dbraw/zinc/07/49/37/1061074937.db2.gz DKCOILPSXYPQSY-UHFFFAOYSA-N -1 1 314.213 4.233 20 0 DIADMM Cc1[nH]c(-c2nc3cc(Cl)cc(Cl)c3[nH]2)c(C)c1C(=O)[O-] ZINC001250876874 1061104661 /nfs/dbraw/zinc/10/46/61/1061104661.db2.gz QXGWMMYHXQYLJA-UHFFFAOYSA-N -1 1 324.167 4.180 20 0 DIADMM CCCSc1ccc2nc(-c3ccc(C(=O)[O-])o3)[nH]c2c1 ZINC001250922936 1061126524 /nfs/dbraw/zinc/12/65/24/1061126524.db2.gz OSNQXQDIXIYUOH-UHFFFAOYSA-N -1 1 302.355 4.023 20 0 DIADMM Fc1cc(F)c(F)c2nc(-c3nc(C(F)(F)F)cs3)[n-]c21 ZINC001250950878 1061140700 /nfs/dbraw/zinc/14/07/00/1061140700.db2.gz IFTWNDGQNSOFRG-UHFFFAOYSA-N -1 1 323.221 4.123 20 0 DIADMM [O-]c1cc(F)c(F)cc1-c1nc2cc(F)ccc2n1C1CC1 ZINC001250967602 1061153291 /nfs/dbraw/zinc/15/32/91/1061153291.db2.gz WWGVFBOWEQKDMN-UHFFFAOYSA-N -1 1 304.271 4.161 20 0 DIADMM [O-]c1cc(F)c(F)cc1-c1nc2c(cc(Cl)c(F)c2F)[nH]1 ZINC001250967369 1061153425 /nfs/dbraw/zinc/15/34/25/1061153425.db2.gz OCCGHHBLABYTAR-UHFFFAOYSA-N -1 1 316.641 4.145 20 0 DIADMM CCCn1c2ccc(F)cc2nc1-c1c(F)cc([O-])cc1F ZINC001251007661 1061178091 /nfs/dbraw/zinc/17/80/91/1061178091.db2.gz OBVQVVLVYATRQC-UHFFFAOYSA-N -1 1 306.287 4.236 20 0 DIADMM [O-]c1cc(F)c(-c2nc3cc(-c4ccncc4)ccc3[nH]2)c(F)c1 ZINC001251007396 1061178238 /nfs/dbraw/zinc/17/82/38/1061178238.db2.gz KKFFLQTYEWQBQS-UHFFFAOYSA-N -1 1 323.302 4.276 20 0 DIADMM O=C([O-])c1ccc(-c2nc3ccc(-c4ccncc4)cc3[nH]2)s1 ZINC001251015863 1061185488 /nfs/dbraw/zinc/18/54/88/1061185488.db2.gz ZUTSJXNNYOTPPS-UHFFFAOYSA-N -1 1 321.361 4.052 20 0 DIADMM CCCCc1ccc2nc(-c3ccccc3OCC(=O)[O-])[nH]c2c1 ZINC001251042418 1061196818 /nfs/dbraw/zinc/19/68/18/1061196818.db2.gz MHVDBVKLJGHRIJ-UHFFFAOYSA-N -1 1 324.380 4.036 20 0 DIADMM COc1ccc(C(=O)Nc2ccc(C(C)(C)C)c(F)c2)c([O-])c1 ZINC001455292484 1061216104 /nfs/dbraw/zinc/21/61/04/1061216104.db2.gz IPLQZPWJHGEHRK-UHFFFAOYSA-N -1 1 317.360 4.090 20 0 DIADMM Cc1cc(C(=O)NCc2ccc([O-])c(Cl)c2)c(C)cc1Cl ZINC001455454433 1061221811 /nfs/dbraw/zinc/22/18/11/1061221811.db2.gz WKAOIWSEWLKLOO-UHFFFAOYSA-N -1 1 324.207 4.246 20 0 DIADMM O=C(NCc1ccc([O-])c(Cl)c1)c1ccc2sccc2c1 ZINC001455451831 1061222296 /nfs/dbraw/zinc/22/22/96/1061222296.db2.gz RNXSBTBVCROFSP-UHFFFAOYSA-N -1 1 317.797 4.190 20 0 DIADMM CC(C)Cc1ccccc1C(=O)NCc1ccc([O-])c(Cl)c1 ZINC001455451755 1061224018 /nfs/dbraw/zinc/22/40/18/1061224018.db2.gz QBNCLBGONYVMPP-UHFFFAOYSA-N -1 1 317.816 4.174 20 0 DIADMM Cc1cc2[nH]c(-c3cc(Cl)c([O-])cc3O)nc2c(Cl)c1 ZINC001251082530 1061223938 /nfs/dbraw/zinc/22/39/38/1061223938.db2.gz JLRCWBQVMRNYFS-UHFFFAOYSA-N -1 1 309.152 4.256 20 0 DIADMM Cc1c2nc(-c3cc(Cl)c([O-])cc3O)[nH]c2ccc1Cl ZINC001251082465 1061223979 /nfs/dbraw/zinc/22/39/79/1061223979.db2.gz HWICXIVPVUHHEC-UHFFFAOYSA-N -1 1 309.152 4.256 20 0 DIADMM CCCn1c2ccc(F)cc2nc1-c1cc(Cl)c([O-])cc1O ZINC001251082016 1061226328 /nfs/dbraw/zinc/22/63/28/1061226328.db2.gz BGUBLWTVOMCKRX-UHFFFAOYSA-N -1 1 320.751 4.317 20 0 DIADMM CC(C)n1c2ccccc2nc1-c1cc(Cl)c([O-])cc1O ZINC001251083201 1061227568 /nfs/dbraw/zinc/22/75/68/1061227568.db2.gz REBFCITUORGSIF-UHFFFAOYSA-N -1 1 302.761 4.349 20 0 DIADMM CCc1ccc2ccccc2c1CNC(=O)c1ccc([O-])c(F)c1 ZINC001455555526 1061229437 /nfs/dbraw/zinc/22/94/37/1061229437.db2.gz QQCTYELRZMKVIM-UHFFFAOYSA-N -1 1 323.367 4.177 20 0 DIADMM [O-]c1cc(O)c(-c2nc3cc(F)ccc3n2C2CC2)cc1Cl ZINC001251083886 1061229694 /nfs/dbraw/zinc/22/96/94/1061229694.db2.gz YBDZPRUQDQITPA-UHFFFAOYSA-N -1 1 318.735 4.242 20 0 DIADMM [O-]c1c(Cl)ccc(-c2nc3cc4c(cc3[nH]2)OCC4)c1Cl ZINC001251169294 1061258488 /nfs/dbraw/zinc/25/84/88/1061258488.db2.gz ZWHTXJAEBVBCNE-UHFFFAOYSA-N -1 1 321.163 4.177 20 0 DIADMM CCCOc1ccc2nc(-c3cccc([O-])c3Cl)n(C)c2c1 ZINC001251203949 1061267826 /nfs/dbraw/zinc/26/78/26/1061267826.db2.gz URKDWVTWFUFIDM-UHFFFAOYSA-N -1 1 316.788 4.388 20 0 DIADMM COCCCn1c2ccccc2nc1-c1cccc([O-])c1Cl ZINC001251203840 1061268126 /nfs/dbraw/zinc/26/81/26/1061268126.db2.gz RVDAIDFFHGYDII-UHFFFAOYSA-N -1 1 316.788 4.099 20 0 DIADMM CC(C)n1c2cc(F)ccc2nc1-c1cc(Cl)ncc1[O-] ZINC001251252079 1061290152 /nfs/dbraw/zinc/29/01/52/1061290152.db2.gz NUZQRZKGHCRFIT-UHFFFAOYSA-N -1 1 305.740 4.177 20 0 DIADMM Cc1ccc2c(c1)nc(-c1cc(Cl)ncc1[O-])n2CC1CC1 ZINC001251251777 1061290592 /nfs/dbraw/zinc/29/05/92/1061290592.db2.gz IWGUYTATNZZKGB-UHFFFAOYSA-N -1 1 313.788 4.176 20 0 DIADMM [O-]c1ccc(F)c(F)c1-c1nc2cc(F)ccc2n1C1CC1 ZINC001251322294 1061312620 /nfs/dbraw/zinc/31/26/20/1061312620.db2.gz ROVVPFNTKPEKEW-UHFFFAOYSA-N -1 1 304.271 4.161 20 0 DIADMM [O-]c1ccc(F)c(F)c1-c1nc2cc(C(F)(F)F)ccc2[nH]1 ZINC001251319239 1061313664 /nfs/dbraw/zinc/31/36/64/1061313664.db2.gz VKENNUVSZPRXTC-UHFFFAOYSA-N -1 1 314.213 4.233 20 0 DIADMM CCCn1c2cc(OC)ccc2nc1-c1c(F)ccc([O-])c1F ZINC001251335685 1061321831 /nfs/dbraw/zinc/32/18/31/1061321831.db2.gz MBBQJZHWQNNAJT-UHFFFAOYSA-N -1 1 318.323 4.106 20 0 DIADMM CC(C)(C(=O)Nc1cc(F)c([O-])cc1Cl)c1ccccc1 ZINC001456607376 1061344815 /nfs/dbraw/zinc/34/48/15/1061344815.db2.gz OHFDEDNRXRERLJ-UHFFFAOYSA-N -1 1 307.752 4.101 20 0 DIADMM Cc1cc(C)c(S(=O)(=O)[N-]c2csc(Cl)c2)c(C)c1 ZINC001251460588 1061367297 /nfs/dbraw/zinc/36/72/97/1061367297.db2.gz NYHZNYRWCUSYIQ-UHFFFAOYSA-N -1 1 315.847 4.128 20 0 DIADMM CCOc1ccc2nc(-c3ccc(F)c([O-])c3)n(C3CC3)c2c1 ZINC001251477433 1061372434 /nfs/dbraw/zinc/37/24/34/1061372434.db2.gz LPSODPAJLYFBHC-UHFFFAOYSA-N -1 1 312.344 4.282 20 0 DIADMM Cn1c2cc(F)ccc2nc1-c1cc(Cl)c(Cl)cc1[O-] ZINC001251491431 1061379351 /nfs/dbraw/zinc/37/93/51/1061379351.db2.gz VSBLTKJWGBZCSW-UHFFFAOYSA-N -1 1 311.143 4.392 20 0 DIADMM [O-]c1ccc(F)c(Cl)c1-c1nc2c([nH]1)c(F)cc(F)c2F ZINC001251540626 1061398005 /nfs/dbraw/zinc/39/80/05/1061398005.db2.gz JDJZBKPJBHWLDP-UHFFFAOYSA-N -1 1 316.641 4.145 20 0 DIADMM CCn1c2cc(OC)ccc2nc1-c1cc(F)c(Cl)cc1[O-] ZINC001251680864 1061439589 /nfs/dbraw/zinc/43/95/89/1061439589.db2.gz KYXYBWGDCZPNDP-UHFFFAOYSA-N -1 1 320.751 4.230 20 0 DIADMM Cc1cc(C(=O)[O-])ccc1-c1nc2cc(Cl)c(F)cc2[nH]1 ZINC001251710739 1061453034 /nfs/dbraw/zinc/45/30/34/1061453034.db2.gz NMLUUTMWGLQOIB-UHFFFAOYSA-N -1 1 304.708 4.029 20 0 DIADMM Cc1cccc2[nH]c(-c3c(Br)ccc([O-])c3F)nc21 ZINC001251729866 1061461447 /nfs/dbraw/zinc/46/14/47/1061461447.db2.gz UYAFWHTVTSATOB-UHFFFAOYSA-N -1 1 321.149 4.146 20 0 DIADMM CC[C@@H](CC1CCCCC1)C(=O)Nc1nc(Cl)ccc1[O-] ZINC001457765697 1061496412 /nfs/dbraw/zinc/49/64/12/1061496412.db2.gz UWHLRLJCVFSNHC-LBPRGKRZSA-N -1 1 310.825 4.376 20 0 DIADMM Fc1c2nc(-c3nc(C4CC4)cs3)[n-]c2c(F)c(F)c1F ZINC001251833373 1061504663 /nfs/dbraw/zinc/50/46/63/1061504663.db2.gz MZYMHUYTQZWQIO-UHFFFAOYSA-N -1 1 313.279 4.120 20 0 DIADMM Cc1cc2nc(-c3cc([O-])c(Cl)c(F)c3F)[nH]c2cc1F ZINC001251865643 1061518528 /nfs/dbraw/zinc/51/85/28/1061518528.db2.gz TWGWHBUHPVXBFK-UHFFFAOYSA-N -1 1 312.678 4.315 20 0 DIADMM CC(C)c1nc2cc(NC(=O)c3cccc([O-])c3F)ccc2o1 ZINC001463848260 1061525491 /nfs/dbraw/zinc/52/54/91/1061525491.db2.gz WDPCDVUHXZYXLX-UHFFFAOYSA-N -1 1 314.316 4.048 20 0 DIADMM [O-]c1c(-c2nnc(Cc3ccc(F)cc3)o2)ccc2ccccc21 ZINC001251883193 1061525480 /nfs/dbraw/zinc/52/54/80/1061525480.db2.gz OZBZAYGAGBXQOD-UHFFFAOYSA-N -1 1 320.323 4.325 20 0 DIADMM CC(C)C[C@H](NC(=O)c1c([O-])cccc1F)c1ccccc1 ZINC001463874282 1061527707 /nfs/dbraw/zinc/52/77/07/1061527707.db2.gz JKGPRWYIRUYCLB-HNNXBMFYSA-N -1 1 301.361 4.049 20 0 DIADMM CC(C)C[C@@H](NC(=O)c1c([O-])cccc1F)c1ccccc1 ZINC001463874288 1061528169 /nfs/dbraw/zinc/52/81/69/1061528169.db2.gz JKGPRWYIRUYCLB-OAHLLOKOSA-N -1 1 301.361 4.049 20 0 DIADMM CCN(C(=O)c1ccc2ccc(O)cc2c1[O-])c1ccccc1C ZINC001464282011 1061568925 /nfs/dbraw/zinc/56/89/25/1061568925.db2.gz HFNCKVZTNYABTH-UHFFFAOYSA-N -1 1 321.376 4.226 20 0 DIADMM CC(C)[C@H]1CC[C@@H](C)C[C@@H]1CNC(=O)c1ccc(Cl)cc1[O-] ZINC001464598239 1061612425 /nfs/dbraw/zinc/61/24/25/1061612425.db2.gz ROIXQXCCWNZMKO-UMVBOHGHSA-N -1 1 323.864 4.484 20 0 DIADMM C[C@@H](NC(=O)c1ccc(Cl)cc1[O-])C(C)(C)c1ccccc1 ZINC001464760782 1061629811 /nfs/dbraw/zinc/62/98/11/1061629811.db2.gz XCNYIJZHAJCLRU-GFCCVEGCSA-N -1 1 317.816 4.142 20 0 DIADMM C[C@H](NC(=O)c1ccc(Cl)cc1[O-])C(C)(C)c1ccccc1 ZINC001464760783 1061631732 /nfs/dbraw/zinc/63/17/32/1061631732.db2.gz XCNYIJZHAJCLRU-LBPRGKRZSA-N -1 1 317.816 4.142 20 0 DIADMM CC(C)(NC(=O)Cc1ccc([O-])c(Cl)c1)C1CCCCC1 ZINC001464791653 1061634545 /nfs/dbraw/zinc/63/45/45/1061634545.db2.gz SCXBFEXTLIXPCF-UHFFFAOYSA-N -1 1 309.837 4.063 20 0 DIADMM Cc1ccc(-c2nnc(-c3ccc4ccc(C)nc4c3[O-])o2)cc1 ZINC001252625491 1061682904 /nfs/dbraw/zinc/68/29/04/1061682904.db2.gz WXEUGMXLSRNRJP-UHFFFAOYSA-N -1 1 317.348 4.274 20 0 DIADMM Cc1c(CNC(=O)c2ccc(Cl)cc2[O-])oc2ccccc12 ZINC001465140717 1061689220 /nfs/dbraw/zinc/68/92/20/1061689220.db2.gz SYTFMTAAFLCGQS-UHFFFAOYSA-N -1 1 315.756 4.030 20 0 DIADMM CC(C)[C@H](NC(=O)c1cc(F)ccc1[O-])c1ccccc1Cl ZINC001465140354 1061689978 /nfs/dbraw/zinc/68/99/78/1061689978.db2.gz HJZSWWLXKGUXSQ-INIZCTEOSA-N -1 1 321.779 4.312 20 0 DIADMM [O-]c1cccc(CNc2cccc(-c3ccon3)c2)c1Cl ZINC001474278848 1061847751 /nfs/dbraw/zinc/84/77/51/1061847751.db2.gz YGKPPHXZOXLYMD-UHFFFAOYSA-N -1 1 300.745 4.313 20 0 DIADMM CCCCC[C@@H]1CCCN1C(=O)c1ncc2ccccc2c1[O-] ZINC001466009056 1061860789 /nfs/dbraw/zinc/86/07/89/1061860789.db2.gz ITLNARYLWPJBFX-OAHLLOKOSA-N -1 1 312.413 4.125 20 0 DIADMM CC(C)CC1(CNC(=O)c2ccc3ccccc3c2[O-])CCC1 ZINC001466060805 1061869485 /nfs/dbraw/zinc/86/94/85/1061869485.db2.gz KHYRAOVPTQWSNF-UHFFFAOYSA-N -1 1 311.425 4.492 20 0 DIADMM C[C@@H]1CCN(Cc2ccc([O-])c(F)c2F)[C@@H](c2ccco2)C1 ZINC001474319928 1061897586 /nfs/dbraw/zinc/89/75/86/1061897586.db2.gz SYLFNOKOVDBUES-DGCLKSJQSA-N -1 1 307.340 4.237 20 0 DIADMM O=C(Nc1cc(Cl)ccc1O)c1cc2ccccc2cc1[O-] ZINC001466258481 1061907694 /nfs/dbraw/zinc/90/76/94/1061907694.db2.gz UFTWCZIUAFTQBK-UHFFFAOYSA-N -1 1 313.740 4.157 20 0 DIADMM CC(C)[C@H]1CCCCCN1C(=O)Cc1ccc([O-])c(Cl)c1 ZINC001466447297 1061942626 /nfs/dbraw/zinc/94/26/26/1061942626.db2.gz DBXCTTBYIOJFML-OAHLLOKOSA-N -1 1 309.837 4.015 20 0 DIADMM CC(C)(C)[C@@H](O)CNc1cc(Cl)c(Cl)c(Cl)c1[O-] ZINC001253739521 1061968345 /nfs/dbraw/zinc/96/83/45/1061968345.db2.gz FLDHEDCHMMHRSZ-QMMMGPOBSA-N -1 1 312.624 4.171 20 0 DIADMM [O-]c1ccc(F)c(-c2nnc(-c3cccc(Cl)c3)o2)c1F ZINC001253806397 1061987065 /nfs/dbraw/zinc/98/70/65/1061987065.db2.gz DIQFWPWXFWVHEA-UHFFFAOYSA-N -1 1 308.671 4.041 20 0 DIADMM CCc1cc(SCC(=O)c2ccc([O-])cc2)c(C)cc1OC ZINC001459213014 1062045453 /nfs/dbraw/zinc/04/54/53/1062045453.db2.gz SSPKHCJJNKSMNZ-UHFFFAOYSA-N -1 1 316.422 4.247 20 0 DIADMM C[C@@H](Sc1nc(-c2ccccc2)cc(=O)[n-]1)c1cccnc1 ZINC001459292225 1062070980 /nfs/dbraw/zinc/07/09/80/1062070980.db2.gz OZRUJVYOHOQIGS-GFCCVEGCSA-N -1 1 309.394 4.098 20 0 DIADMM Cc1cc(NC(=O)c2ccc3ccccc3c2[O-])c(C)c(C)c1O ZINC001467265918 1062097912 /nfs/dbraw/zinc/09/79/12/1062097912.db2.gz JIGNKEDJYYCSID-UHFFFAOYSA-N -1 1 321.376 4.429 20 0 DIADMM [O-]c1ccc(CN2CCCc3cc(Cl)ccc32)c(F)c1F ZINC001474469135 1062148451 /nfs/dbraw/zinc/14/84/51/1062148451.db2.gz QYPSJKQSJOFVAP-UHFFFAOYSA-N -1 1 309.743 4.277 20 0 DIADMM CCOc1ccc(-c2nnc([C@@H]3C[C@@H]3c3ccccc3)o2)c([O-])c1 ZINC001254513078 1062152731 /nfs/dbraw/zinc/15/27/31/1062152731.db2.gz MWNICIVYEHZQMG-HZPDHXFCSA-N -1 1 322.364 4.112 20 0 DIADMM CCOc1ccc(-c2nnc([C@@H]3C[C@H]3c3ccccc3)o2)c([O-])c1 ZINC001254513081 1062154505 /nfs/dbraw/zinc/15/45/05/1062154505.db2.gz MWNICIVYEHZQMG-JKSUJKDBSA-N -1 1 322.364 4.112 20 0 DIADMM CC(C)CCC[C@@H](C)NC(=O)NCc1ccc([O-])c(Cl)c1 ZINC001467629927 1062164577 /nfs/dbraw/zinc/16/45/77/1062164577.db2.gz KCGAJEOWBJEHIS-GFCCVEGCSA-N -1 1 312.841 4.060 20 0 DIADMM Cc1ccccc1S(=O)(=O)[N-]c1ccc(-c2ccco2)cc1 ZINC001254592572 1062194898 /nfs/dbraw/zinc/19/48/98/1062194898.db2.gz MRGAYJOTWDERQM-UHFFFAOYSA-N -1 1 313.378 4.056 20 0 DIADMM Cc1ccccc1S(=O)(=O)[N-]c1cccc(-c2ccccc2)c1 ZINC001254592317 1062196583 /nfs/dbraw/zinc/19/65/83/1062196583.db2.gz IBBMGKDEWVGCOI-UHFFFAOYSA-N -1 1 323.417 4.463 20 0 DIADMM Cc1ccccc1S(=O)(=O)[N-]c1ccc2cc(F)ccc2c1 ZINC001254610781 1062200038 /nfs/dbraw/zinc/20/00/38/1062200038.db2.gz DGZWXCWGMHPLJY-UHFFFAOYSA-N -1 1 315.369 4.088 20 0 DIADMM Cc1cccc(C(C)(C)C)c1[N-]S(=O)(=O)c1ccccc1C ZINC001254619343 1062203215 /nfs/dbraw/zinc/20/32/15/1062203215.db2.gz QWBCOXKVNZCGAE-UHFFFAOYSA-N -1 1 317.454 4.402 20 0 DIADMM [O-]c1cccc(-c2nnc([C@H]3C[C@H]3c3ccccc3)o2)c1Cl ZINC001254693375 1062234093 /nfs/dbraw/zinc/23/40/93/1062234093.db2.gz CVMPWFVZUQVOME-STQMWFEESA-N -1 1 312.756 4.367 20 0 DIADMM COc1ccc(-c2nnc(-c3ccc(C(C)C)cc3)o2)c([O-])c1 ZINC001254824375 1062257114 /nfs/dbraw/zinc/25/71/14/1062257114.db2.gz SBGCYNZDNRZWHJ-UHFFFAOYSA-N -1 1 310.353 4.241 20 0 DIADMM CCCCN(C(=O)c1cc(F)ccc1[O-])[C@@H]1CCC[C@H](C)C1 ZINC001468507148 1062338046 /nfs/dbraw/zinc/33/80/46/1062338046.db2.gz YPDORWVJMVIGRO-DZGCQCFKSA-N -1 1 307.409 4.352 20 0 DIADMM CC1(CNC(=O)c2ccc(C(F)(F)F)cc2[O-])CCCCC1 ZINC001468639148 1062369924 /nfs/dbraw/zinc/36/99/24/1062369924.db2.gz FCNJPQWTZYWOMV-UHFFFAOYSA-N -1 1 315.335 4.111 20 0 DIADMM Cc1cc(C)c(/C=C\C(=O)Nc2cc([O-])c(F)cc2F)cc1C ZINC001468747587 1062392030 /nfs/dbraw/zinc/39/20/30/1062392030.db2.gz HSUQDRXDHUHSHZ-PLNGDYQASA-N -1 1 317.335 4.248 20 0 DIADMM C[C@H](CCCc1ccccc1)C(=O)Nc1cc(F)cc(F)c1[O-] ZINC001469161883 1062492260 /nfs/dbraw/zinc/49/22/60/1062492260.db2.gz RNOHWUJZGFRZMM-GFCCVEGCSA-N -1 1 319.351 4.268 20 0 DIADMM O=C(N[C@@H]1CCC[C@H](C2CC2)C1)c1cc2ccccc2cc1[O-] ZINC001469183556 1062496193 /nfs/dbraw/zinc/49/61/93/1062496193.db2.gz HJUJZBZJYLZPHA-WMLDXEAASA-N -1 1 309.409 4.244 20 0 DIADMM O=C(N[C@@H](C1CCC1)C1CCCC1)c1cc(Cl)ccc1[O-] ZINC001469360769 1062535017 /nfs/dbraw/zinc/53/50/17/1062535017.db2.gz INSCMGQOFCCXDH-MRXNPFEDSA-N -1 1 307.821 4.134 20 0 DIADMM [O-]c1cc(F)cc(-c2nnc(-c3ccc4ccccc4c3)o2)c1 ZINC001256052984 1062689010 /nfs/dbraw/zinc/68/90/10/1062689010.db2.gz QOSRKEXRLWMKDA-UHFFFAOYSA-N -1 1 306.296 4.402 20 0 DIADMM Cc1nc(C(=O)Nc2cc(Cl)c([O-])c3ccccc23)c(C)o1 ZINC001470327065 1062754617 /nfs/dbraw/zinc/75/46/17/1062754617.db2.gz RGTZXKJUHRUGCQ-UHFFFAOYSA-N -1 1 316.744 4.056 20 0 DIADMM CC[C@](C)(NC(=O)c1cc(Cl)ccc1[O-])c1ccc(F)cc1 ZINC001471018845 1062909161 /nfs/dbraw/zinc/90/91/61/1062909161.db2.gz WGEHRDKNKNTGCH-KRWDZBQOSA-N -1 1 321.779 4.240 20 0 DIADMM CC[C@@H](NC(=O)c1cccc([O-])c1F)c1cc(C)ccc1C ZINC001471167820 1062931754 /nfs/dbraw/zinc/93/17/54/1062931754.db2.gz HRVUWJSQMGXKOH-OAHLLOKOSA-N -1 1 301.361 4.029 20 0 DIADMM CCC(CC)(C(=O)Nc1cccc(F)c1[O-])c1ccccc1 ZINC001471167115 1062932345 /nfs/dbraw/zinc/93/23/45/1062932345.db2.gz YJSPQPJIHOAEFE-UHFFFAOYSA-N -1 1 301.361 4.228 20 0 DIADMM C/C(=C\C(=O)Nc1cccc(F)c1[O-])c1ccccc1Cl ZINC001471167018 1062932510 /nfs/dbraw/zinc/93/25/10/1062932510.db2.gz WFFRSYXPWFYEQL-MDZDMXLPSA-N -1 1 305.736 4.227 20 0 DIADMM CC(C)c1cc(NC(=O)Cc2ccc([O-])c(Cl)c2)ccc1O ZINC001471501916 1062992636 /nfs/dbraw/zinc/99/26/36/1062992636.db2.gz FAIPGCZHHVBWLE-UHFFFAOYSA-N -1 1 319.788 4.056 20 0 DIADMM O=C(NC(C1CCCCC1)C1CCCCC1)c1ncccc1[O-] ZINC001471516333 1062995619 /nfs/dbraw/zinc/99/56/19/1062995619.db2.gz CDBYTXPYYDSHCY-UHFFFAOYSA-N -1 1 316.445 4.046 20 0 DIADMM C[C@]1(c2ccccc2)CCCN1C(=O)c1c([O-])cccc1Cl ZINC001471563373 1063001140 /nfs/dbraw/zinc/00/11/40/1063001140.db2.gz WHYVJNHRDAPSRM-GOSISDBHSA-N -1 1 315.800 4.197 20 0 DIADMM O=C(NCc1cscc1Cl)c1cc2ccccc2cc1[O-] ZINC001471905738 1063033081 /nfs/dbraw/zinc/03/30/81/1063033081.db2.gz NBJZRMCFMRYDNB-UHFFFAOYSA-N -1 1 317.797 4.190 20 0 DIADMM Cc1ccccc1Oc1cccc(NC(=O)c2cncc([O-])c2)c1 ZINC001472167176 1063054979 /nfs/dbraw/zinc/05/49/79/1063054979.db2.gz LUYMTIWVJCCKON-UHFFFAOYSA-N -1 1 320.348 4.140 20 0 DIADMM Cc1ccc(C(=O)Nc2cc(F)c([O-])cc2Cl)cc1Cl ZINC001472192794 1063058235 /nfs/dbraw/zinc/05/82/35/1063058235.db2.gz CHURNBBGONPBQZ-UHFFFAOYSA-N -1 1 314.143 4.399 20 0 DIADMM Cc1cccc(S(=O)(=O)[N-]c2ccc3cc(F)ccc3c2)c1 ZINC001256947421 1063058291 /nfs/dbraw/zinc/05/82/91/1063058291.db2.gz ZGAYIBPIWSBPGE-UHFFFAOYSA-N -1 1 315.369 4.088 20 0 DIADMM COc1cccc([O-])c1-c1nnc([C@H]2C[C@H]2c2ccc(C)cc2)o1 ZINC001257208662 1063137534 /nfs/dbraw/zinc/13/75/34/1063137534.db2.gz CYOURJVOWADCBZ-KBPBESRZSA-N -1 1 322.364 4.030 20 0 DIADMM Cc1ccc([C@@H]2C[C@@H]2c2nnc(-c3cc([O-])cc(F)c3)o2)cc1 ZINC001257325931 1063210253 /nfs/dbraw/zinc/21/02/53/1063210253.db2.gz VGPGMOQIPLYQMD-HOTGVXAUSA-N -1 1 310.328 4.161 20 0 DIADMM C=Cc1ccc([N-]S(=O)(=O)c2cccc(Cl)c2C)cc1 ZINC001257614865 1063349915 /nfs/dbraw/zinc/34/99/15/1063349915.db2.gz NDDDBQROXCFDGT-UHFFFAOYSA-N -1 1 307.802 4.092 20 0 DIADMM C[C@@H]1CCC[C@@H](CCSc2nc(C(F)F)cc(=O)[n-]2)C1 ZINC001473041083 1063371369 /nfs/dbraw/zinc/37/13/69/1063371369.db2.gz MILXMTXNEMWHJO-ZJUUUORDSA-N -1 1 302.390 4.428 20 0 DIADMM CCc1nc(SCCc2ccc(Cl)cc2)[n-]c(=O)c1C ZINC001473041804 1063371680 /nfs/dbraw/zinc/37/16/80/1063371680.db2.gz FNVBRHCDVHIVKO-UHFFFAOYSA-N -1 1 308.834 4.041 20 0 DIADMM CC[C@H]1CCCC[C@@H]1N(C)C(=O)NCc1ccc([O-])c(Cl)c1 ZINC001479211214 1063400377 /nfs/dbraw/zinc/40/03/77/1063400377.db2.gz FZVOTGNFWGADBO-ZFWWWQNUSA-N -1 1 324.852 4.156 20 0 DIADMM Cc1ccccc1Cc1nnc(-c2ccc3ccccc3c2[O-])o1 ZINC001258381464 1063626759 /nfs/dbraw/zinc/62/67/59/1063626759.db2.gz KXMQVIWXMBIGBO-UHFFFAOYSA-N -1 1 316.360 4.495 20 0 DIADMM CN(C)c1c(Cl)cccc1NCc1ccc([O-])c(F)c1F ZINC001461995791 1063868815 /nfs/dbraw/zinc/86/88/15/1063868815.db2.gz PPAOLPFAYCHZCA-UHFFFAOYSA-N -1 1 312.747 4.002 20 0 DIADMM CCc1ccc(Cl)cc1[N-]S(=O)(=O)c1ccc(C)c(C)c1 ZINC001259168345 1063884822 /nfs/dbraw/zinc/88/48/22/1063884822.db2.gz XQDOHFDZDAVDQY-UHFFFAOYSA-N -1 1 323.845 4.320 20 0 DIADMM Cc1ccc([N-]S(=O)(=O)c2cccc(-c3ccccc3)c2)cc1 ZINC001259226305 1063884855 /nfs/dbraw/zinc/88/48/55/1063884855.db2.gz PMXFDWLSDWXJCV-UHFFFAOYSA-N -1 1 323.417 4.463 20 0 DIADMM C=Cc1ccccc1[N-]S(=O)(=O)c1ccc(C)c(Cl)c1 ZINC001259136123 1063884993 /nfs/dbraw/zinc/88/49/93/1063884993.db2.gz REEORBVMPYLLRY-UHFFFAOYSA-N -1 1 307.802 4.092 20 0 DIADMM C=Cc1ccc([N-]S(=O)(=O)c2ccc(C)c(Cl)c2)cc1 ZINC001259135157 1063885682 /nfs/dbraw/zinc/88/56/82/1063885682.db2.gz OGOOKFNYXPSFOJ-UHFFFAOYSA-N -1 1 307.802 4.092 20 0 DIADMM Cc1cc(C)cc(S(=O)(=O)[N-]c2cc3cccccc-3c2)c1 ZINC001259518356 1063888730 /nfs/dbraw/zinc/88/87/30/1063888730.db2.gz XOXOXUKNUFBOFG-UHFFFAOYSA-N -1 1 311.406 4.209 20 0 DIADMM Cc1cc(C)cc(S(=O)(=O)[N-]c2ccccc2C(C)(C)C)c1 ZINC001259524311 1063889992 /nfs/dbraw/zinc/88/99/92/1063889992.db2.gz MFNMXLLJPAZDOA-UHFFFAOYSA-N -1 1 317.454 4.402 20 0 DIADMM Cc1ccc(S(=O)(=O)[N-]c2c(C)cccc2C2CC2)cc1F ZINC001259481141 1063890361 /nfs/dbraw/zinc/89/03/61/1063890361.db2.gz JLLNVEUDRPKBOG-UHFFFAOYSA-N -1 1 319.401 4.121 20 0 DIADMM O=S(=O)(CC1CCCCC1)[N-]c1ccccc1C(F)(F)F ZINC001259613075 1063892421 /nfs/dbraw/zinc/89/24/21/1063892421.db2.gz SSBLFJZKZRFKBX-UHFFFAOYSA-N -1 1 321.364 4.027 20 0 DIADMM CCc1ccc(Cl)cc1[N-]S(=O)(=O)c1cccc(C)c1C ZINC001260999677 1063909029 /nfs/dbraw/zinc/90/90/29/1063909029.db2.gz YIIMYNCWPGXAPV-UHFFFAOYSA-N -1 1 323.845 4.320 20 0 DIADMM COC(=O)c1cc(NCc2cccc([O-])c2Cl)c(C)cc1C ZINC001462105356 1063931286 /nfs/dbraw/zinc/93/12/86/1063931286.db2.gz RIDGUUZVVBRXMD-UHFFFAOYSA-N -1 1 319.788 4.061 20 0 DIADMM O=C([N-]c1cscc1Cl)c1ncsc1C(F)(F)F ZINC001288450144 1064544058 /nfs/dbraw/zinc/54/40/58/1064544058.db2.gz QIMLIQNLSPGFCQ-UHFFFAOYSA-N -1 1 312.725 4.129 20 0 DIADMM O=C(c1ccc([O-])cc1F)N(Cc1ccccc1)c1ccccc1 ZINC001291896019 1064749263 /nfs/dbraw/zinc/74/92/63/1064749263.db2.gz IJBPMPUZIHXIIQ-UHFFFAOYSA-N -1 1 321.351 4.378 20 0 DIADMM Cc1cccc([C@H]2CCCN2C(=O)c2cc(Cl)ccc2[O-])c1 ZINC001291955214 1064750363 /nfs/dbraw/zinc/75/03/63/1064750363.db2.gz NLYHMCMMYPMITC-MRXNPFEDSA-N -1 1 315.800 4.331 20 0 DIADMM Cc1cc(C)cc(C[C@@H](C)NC(=O)c2cc(Cl)ccc2[O-])c1 ZINC001294073976 1064847608 /nfs/dbraw/zinc/84/76/08/1064847608.db2.gz QWSGXFCYGGKXCX-CYBMUJFWSA-N -1 1 317.816 4.023 20 0 DIADMM CC[C@H](NC(=O)c1c([O-])cccc1Cl)c1ccc(C)c(F)c1 ZINC001295804376 1064927844 /nfs/dbraw/zinc/92/78/44/1064927844.db2.gz RXXATOVKZRZQGV-AWEZNQCLSA-N -1 1 321.779 4.374 20 0 DIADMM O=C(NC1CC(c2ccccc2)C1)c1cc2ccccc2cc1[O-] ZINC001296983167 1064965518 /nfs/dbraw/zinc/96/55/18/1064965518.db2.gz PHTQFRNVXXITME-UHFFFAOYSA-N -1 1 317.388 4.221 20 0 DIADMM CSc1ccccc1[C@H](C)NC(=O)c1ccc(Cl)cc1[O-] ZINC001297007943 1064967000 /nfs/dbraw/zinc/96/70/00/1064967000.db2.gz NVDDRBCEQUDNTA-JTQLQIEISA-N -1 1 321.829 4.259 20 0 DIADMM CC(C)(C)[C@H]1CN(C(=O)c2ccc(F)c([O-])c2)c2ccccc21 ZINC001297186928 1064971419 /nfs/dbraw/zinc/97/14/19/1064971419.db2.gz UCDKSPAHTNQXNH-AWEZNQCLSA-N -1 1 313.372 4.321 20 0 DIADMM Cc1ccc2c(c1)[C@@H](NC(=O)c1c([O-])cccc1Cl)CCC2 ZINC001298823093 1065021738 /nfs/dbraw/zinc/02/17/38/1065021738.db2.gz ZHVUGRJZBPFXGH-HNNXBMFYSA-N -1 1 315.800 4.161 20 0 DIADMM CC[C@H](C(=O)Nc1cc([O-])c(F)cc1F)C1CCC(C)CC1 ZINC001298975161 1065027598 /nfs/dbraw/zinc/02/75/98/1065027598.db2.gz VOHLQKMICNAXNK-MCIGGMRASA-N -1 1 311.372 4.461 20 0 DIADMM CC[C@H](NC(=O)c1cc(F)ccc1[O-])c1cc(C)ccc1C ZINC001302491630 1065089655 /nfs/dbraw/zinc/08/96/55/1065089655.db2.gz BYWMQSUNASVNRW-INIZCTEOSA-N -1 1 301.361 4.029 20 0 DIADMM O=C(NCc1ccc([O-])c(Cl)c1)[C@@H]1CC[C@@H]2CCCC[C@H]2C1 ZINC001303299243 1065113501 /nfs/dbraw/zinc/11/35/01/1065113501.db2.gz RDIWTVMYGHKBLJ-SOUVJXGZSA-N -1 1 321.848 4.268 20 0 DIADMM CC(C)c1oncc1[N-]C(=O)c1cc(-c2ccccc2)ns1 ZINC001303586373 1065119320 /nfs/dbraw/zinc/11/93/20/1065119320.db2.gz SJFQMCKSVQGDPY-UHFFFAOYSA-N -1 1 313.382 4.174 20 0 DIADMM C[C@@H]1Cc2cc(NC(=O)c3ccc4ccccc4c3[O-])ccc2O1 ZINC001304220232 1065132697 /nfs/dbraw/zinc/13/26/97/1065132697.db2.gz MTFBQRWPTQZSKI-GFCCVEGCSA-N -1 1 319.360 4.121 20 0 DIADMM O=C(Nc1cc(F)c([O-])cc1Cl)c1cccc(Cl)c1 ZINC001304284516 1065136217 /nfs/dbraw/zinc/13/62/17/1065136217.db2.gz OJZPZCJPQIOFAX-UHFFFAOYSA-N -1 1 300.116 4.090 20 0 DIADMM O=C(NC[C@@H]1C[C@@H]1C1CCCC1)c1ccc2ccccc2c1[O-] ZINC001305873719 1065166977 /nfs/dbraw/zinc/16/69/77/1065166977.db2.gz KHTPNUHLUREAAZ-MAUKXSAKSA-N -1 1 309.409 4.102 20 0 DIADMM O=C(NC[C@@H]1C[C@H]1C1CCCC1)c1ccc2ccccc2c1[O-] ZINC001305873722 1065167052 /nfs/dbraw/zinc/16/70/52/1065167052.db2.gz KHTPNUHLUREAAZ-YJBOKZPZSA-N -1 1 309.409 4.102 20 0 DIADMM CCCc1cc(=O)[n-]c(SCCSC2CCCCC2)n1 ZINC001307252519 1065314876 /nfs/dbraw/zinc/31/48/76/1065314876.db2.gz GNSMTPPIKHKMFO-UHFFFAOYSA-N -1 1 312.504 4.293 20 0 DIADMM CCCc1cc(=O)[n-]c(S[C@@H](C)c2cc(F)ccc2F)n1 ZINC001307252331 1065314893 /nfs/dbraw/zinc/31/48/93/1065314893.db2.gz DPQNYPXNJMTDLI-VIFPVBQESA-N -1 1 310.369 4.266 20 0 DIADMM Cc1cnc(SCCc2cc(Cl)cc(Cl)c2)[n-]c1=O ZINC001307347555 1065350756 /nfs/dbraw/zinc/35/07/56/1065350756.db2.gz REZIUTRABMSSRC-UHFFFAOYSA-N -1 1 315.225 4.132 20 0 DIADMM Cc1nc2c(c(=O)[nH]1)C[N@H+](Cc1ccc(C3CCCCC3)cc1)C2 ZINC001307978305 1065710052 /nfs/dbraw/zinc/71/00/52/1065710052.db2.gz MMMAVEIOHOYRDG-UHFFFAOYSA-N -1 1 323.440 4.054 20 0 DIADMM C[C@H]1C[C@@H](c2cccc(F)c2)N(Cc2ccc([O-])c(F)c2F)C1 ZINC001308574428 1066087831 /nfs/dbraw/zinc/08/78/31/1066087831.db2.gz VSZLETLKCNGSAN-NHYWBVRUSA-N -1 1 321.342 4.393 20 0 DIADMM CC[C@H]([N-]S(=O)(=O)c1cc2ccccc2o1)C1CCCCC1 ZINC001309130304 1066444804 /nfs/dbraw/zinc/44/48/04/1066444804.db2.gz MFGDHNQNQZGSIE-HNNXBMFYSA-N -1 1 321.442 4.070 20 0 DIADMM O=C(NCCCC1CCCCC1)NCc1ccc([O-])c(Cl)c1 ZINC001311383139 1066633641 /nfs/dbraw/zinc/63/36/41/1066633641.db2.gz UQXLZVKWMRFULD-UHFFFAOYSA-N -1 1 324.852 4.205 20 0 DIADMM CCCC[C@@H](CCC)NC(=O)NCc1ccc([O-])c(Cl)c1 ZINC001312181628 1066753398 /nfs/dbraw/zinc/75/33/98/1066753398.db2.gz SWMSNFMFXHIQIP-CYBMUJFWSA-N -1 1 312.841 4.204 20 0 DIADMM COc1ccc(-c2nc(-c3ccc(C(C)C)cc3)no2)c([O-])c1 ZINC000320392703 334961905 /nfs/dbraw/zinc/96/19/05/334961905.db2.gz DNBSYVDSUYEHEO-UHFFFAOYSA-N -1 1 310.353 4.241 20 0 DIADMM CC(C)(Cc1nc(-c2ccc([O-])cc2Cl)no1)C(F)(F)F ZINC000288933623 535192824 /nfs/dbraw/zinc/19/28/24/535192824.db2.gz AFTOYBOSFWCNAA-UHFFFAOYSA-N -1 1 320.698 4.227 20 0 DIADMM Cc1ccc([C@H](CC(=O)[O-])NCc2ccc(C(C)(C)C)cc2)o1 ZINC000426770400 541305930 /nfs/dbraw/zinc/30/59/30/541305930.db2.gz RNJHXMOPKRBDGD-INIZCTEOSA-N -1 1 315.413 4.191 20 0 DIADMM COc1cc(C(=O)Nc2ccc3ccoc3c2)cc(Cl)c1[O-] ZINC000442933686 338439747 /nfs/dbraw/zinc/43/97/47/338439747.db2.gz KDXGNLHEQVWNQX-UHFFFAOYSA-N -1 1 317.728 4.053 20 0 DIADMM Cc1cccc(CN(C)C(=O)c2ccc3ccccc3c2[O-])c1 ZINC000320581072 335087304 /nfs/dbraw/zinc/08/73/04/335087304.db2.gz VIYZXIUTMRMOPK-UHFFFAOYSA-N -1 1 305.377 4.126 20 0 DIADMM [O-]c1ccc(-c2noc(CC/C=C\c3ccccc3)n2)cc1F ZINC000445481438 331525162 /nfs/dbraw/zinc/52/51/62/331525162.db2.gz PDTWBXXYGJNKJL-YWEYNIOJSA-N -1 1 310.328 4.227 20 0 DIADMM CC(C)[C@@H]1CCC[C@@H](NC(=O)c2c(F)ccc([O-])c2F)CC1 ZINC000584081123 331668094 /nfs/dbraw/zinc/66/80/94/331668094.db2.gz IOAXBVACGUVOGX-VXGBXAGGSA-N -1 1 311.372 4.005 20 0 DIADMM O=C([N-]c1cc(F)cc(F)c1F)c1cc(-c2ccccc2)no1 ZINC000558236960 331886130 /nfs/dbraw/zinc/88/61/30/331886130.db2.gz SUOVYNOWPCNHKR-UHFFFAOYSA-N -1 1 318.254 4.011 20 0 DIADMM O=C(Nc1ccc([O-])c(Cl)c1)[C@H]1C[C@@H]1c1ccccc1Cl ZINC000558325194 331896859 /nfs/dbraw/zinc/89/68/59/331896859.db2.gz BZZZQNUPYWNJOG-NEPJUHHUSA-N -1 1 322.191 4.441 20 0 DIADMM CCc1ccc(-c2ccc(CN[C@H](C(=O)[O-])[C@@H](C)CC)o2)cc1 ZINC000426775917 332093583 /nfs/dbraw/zinc/09/35/83/332093583.db2.gz VODFBRBQCDDAHU-UGSOOPFHSA-N -1 1 315.413 4.098 20 0 DIADMM C[C@@H](c1cccc(O)c1)N(C)C(=O)c1cc2ccccc2cc1[O-] ZINC000092602214 332136041 /nfs/dbraw/zinc/13/60/41/332136041.db2.gz BLDCDMWUULQQRB-ZDUSSCGKSA-N -1 1 321.376 4.084 20 0 DIADMM Cc1ccc([C@H](CC(=O)[O-])NCc2ccc3ccccc3c2)o1 ZINC000426782764 332152541 /nfs/dbraw/zinc/15/25/41/332152541.db2.gz HZBPTLBNPIROBK-KRWDZBQOSA-N -1 1 309.365 4.047 20 0 DIADMM CCC[C@@H](C)C[C@H](NCc1ccc(-c2ccccc2)o1)C(=O)[O-] ZINC000426794862 332154472 /nfs/dbraw/zinc/15/44/72/332154472.db2.gz VYBOBGOSXFBOJQ-PBHICJAKSA-N -1 1 315.413 4.316 20 0 DIADMM Cc1ccc([C@@H](CC(=O)[O-])NCc2ccc(CC(C)C)cc2)o1 ZINC000426796101 332154745 /nfs/dbraw/zinc/15/47/45/332154745.db2.gz ZVVGHWJMKNABQD-QGZVFWFLSA-N -1 1 315.413 4.092 20 0 DIADMM O=C([O-])CC[C@H]1CCCN(Cc2c(Cl)cccc2Cl)C1 ZINC000049842184 332329330 /nfs/dbraw/zinc/32/93/30/332329330.db2.gz NUZRCSPKXAMYNP-LLVKDONJSA-N -1 1 316.228 4.070 20 0 DIADMM Cc1cc([C@@H](C)N(C)Cc2ccc(Cl)cc2)oc1C(=O)[O-] ZINC000566358055 332374904 /nfs/dbraw/zinc/37/49/04/332374904.db2.gz CPGDHLBUJTZFRW-LLVKDONJSA-N -1 1 307.777 4.133 20 0 DIADMM Cc1cc([C@H](C)N(C)Cc2ccc(Cl)cc2)oc1C(=O)[O-] ZINC000566358059 332375253 /nfs/dbraw/zinc/37/52/53/332375253.db2.gz CPGDHLBUJTZFRW-NSHDSACASA-N -1 1 307.777 4.133 20 0 DIADMM O=C([O-])c1cccc(CN2CCC[C@@H]2c2cccs2)c1Cl ZINC000566359779 332377392 /nfs/dbraw/zinc/37/73/92/332377392.db2.gz XZKNBYZPVXUZFQ-CYBMUJFWSA-N -1 1 321.829 4.437 20 0 DIADMM CCc1nc(S[C@H](CC)c2ccc(F)cc2)[n-]c(=O)c1C ZINC000566498614 332458026 /nfs/dbraw/zinc/45/80/26/332458026.db2.gz KRCMMAAULSVQSF-CQSZACIVSA-N -1 1 306.406 4.436 20 0 DIADMM Cc1ccc(CN[C@H](CC(=O)[O-])c2ccsc2)c(Cl)c1 ZINC000580201317 333002971 /nfs/dbraw/zinc/00/29/71/333002971.db2.gz HUQLIADGDLDKKL-CQSZACIVSA-N -1 1 309.818 4.016 20 0 DIADMM CN(Cc1csc2ccccc12)C(=O)c1ccc([O-])cc1F ZINC000181138581 333029229 /nfs/dbraw/zinc/02/92/29/333029229.db2.gz JRJSDEBBCROSSZ-UHFFFAOYSA-N -1 1 315.369 4.018 20 0 DIADMM CC1(C)CN(C(=O)c2ccc3ccccc3c2[O-])[C@@H]2CCC[C@H]21 ZINC000378816220 333054899 /nfs/dbraw/zinc/05/48/99/333054899.db2.gz BXYXGQSVENUPGM-IAGOWNOFSA-N -1 1 309.409 4.196 20 0 DIADMM CCc1cccc(C)c1[N-]S(=O)(=O)c1cccc(C(C)C)c1 ZINC000460427973 333084749 /nfs/dbraw/zinc/08/47/49/333084749.db2.gz RCQGSZFMGKDUNU-UHFFFAOYSA-N -1 1 317.454 4.482 20 0 DIADMM Cc1ccc([N-]S(=O)(=O)c2cccc(C(C)C)c2)cc1C ZINC000460440685 333088150 /nfs/dbraw/zinc/08/81/50/333088150.db2.gz QLFAEPHLBOPRPV-UHFFFAOYSA-N -1 1 303.427 4.228 20 0 DIADMM O=C(c1cc2ccccc2cc1[O-])N1CCC[C@H]2CCCC[C@H]21 ZINC000319660480 333393945 /nfs/dbraw/zinc/39/39/45/333393945.db2.gz GPKQXQBUJLFYDR-RDTXWAMCSA-N -1 1 309.409 4.340 20 0 DIADMM CCc1nc(SCc2ccc(Cl)cc2F)[n-]c(=O)c1C ZINC000563438497 333605861 /nfs/dbraw/zinc/60/58/61/333605861.db2.gz BEOIGLZPMSVJFI-UHFFFAOYSA-N -1 1 312.797 4.138 20 0 DIADMM O=c1cc(C(F)F)nc(SC[C@@H]2CCCCC2(F)F)[n-]1 ZINC000450960887 333701945 /nfs/dbraw/zinc/70/19/45/333701945.db2.gz SQRXZSDSNIMRBN-ZETCQYMHSA-N -1 1 310.316 4.037 20 0 DIADMM Cc1ccccc1[C@H](C)N(C)C(=O)c1ccc(Cl)cc1[O-] ZINC000436758615 333997824 /nfs/dbraw/zinc/99/78/24/333997824.db2.gz ZWEKVEFUVRZZFR-LBPRGKRZSA-N -1 1 303.789 4.187 20 0 DIADMM Cc1oc([C@@H](C)N(C)Cc2cccc(Cl)c2)cc1C(=O)[O-] ZINC000571650002 334030267 /nfs/dbraw/zinc/03/02/67/334030267.db2.gz ZVWWTUPPSXNXTG-SNVBAGLBSA-N -1 1 307.777 4.133 20 0 DIADMM CC(C)Sc1cccc(Cl)c1CN(C)CCCC(=O)[O-] ZINC000414641117 334050073 /nfs/dbraw/zinc/05/00/73/334050073.db2.gz SNZUQUGOCMCLFJ-UHFFFAOYSA-N -1 1 315.866 4.137 20 0 DIADMM C[C@@H](N[C@H](CCC(C)(C)C)C(=O)[O-])c1cc2ccccc2o1 ZINC000414667927 334063696 /nfs/dbraw/zinc/06/36/96/334063696.db2.gz WYJVZLPPHAOATK-TZMCWYRMSA-N -1 1 303.402 4.363 20 0 DIADMM CCc1ccc(-c2ccc(CN(CC(=O)[O-])[C@H](C)CC)o2)cc1 ZINC000414685857 334068938 /nfs/dbraw/zinc/06/89/38/334068938.db2.gz USCNAAGCEXBQSF-CQSZACIVSA-N -1 1 315.413 4.194 20 0 DIADMM CC[C@@H](C)N(CC(=O)[O-])Cc1ccc(-c2cccc(F)c2C)o1 ZINC000414687695 334069464 /nfs/dbraw/zinc/06/94/64/334069464.db2.gz XHYKEMGECRCTRO-GFCCVEGCSA-N -1 1 319.376 4.079 20 0 DIADMM CCc1ccc(NC(=O)c2cc(Cl)c([O-])c(OC)c2)cc1F ZINC000443069842 338443273 /nfs/dbraw/zinc/44/32/73/338443273.db2.gz YFUPWEOXDUBNPV-UHFFFAOYSA-N -1 1 323.751 4.008 20 0 DIADMM CCOc1ccc(CCC(=O)Nc2ccc([O-])c(Cl)c2)cc1 ZINC000111668590 334352883 /nfs/dbraw/zinc/35/28/83/334352883.db2.gz RWGDYMRLQCYVRE-UHFFFAOYSA-N -1 1 319.788 4.016 20 0 DIADMM C[C@H](SCc1ccccc1)C(=O)Nc1ccc([O-])c(Cl)c1 ZINC000111668298 334352982 /nfs/dbraw/zinc/35/29/82/334352982.db2.gz MOMGPLIMOBCFEP-NSHDSACASA-N -1 1 321.829 4.306 20 0 DIADMM Cc1ccc2c(CC(=O)Nc3ccc(F)cc3[O-])coc2c1C ZINC000532012569 334371547 /nfs/dbraw/zinc/37/15/47/334371547.db2.gz RWQBUJRUDPQPKD-UHFFFAOYSA-N -1 1 313.328 4.076 20 0 DIADMM O=C(Nc1ccc(F)cc1[O-])[C@@H]1C[C@@H]1c1c(F)cccc1Cl ZINC000532012886 334373937 /nfs/dbraw/zinc/37/39/37/334373937.db2.gz MPZQNLAETATVPN-VHSXEESVSA-N -1 1 323.726 4.066 20 0 DIADMM COc1cc(-c2nc([C@@H]3CCCC[C@H]3C)no2)cc(Cl)c1[O-] ZINC000443201995 338446949 /nfs/dbraw/zinc/44/69/49/338446949.db2.gz WGMSENXNXIGOLF-MWLCHTKSSA-N -1 1 322.792 4.398 20 0 DIADMM COc1cc(-c2nc([C@H](C)C(C)(C)C)no2)cc(Cl)c1[O-] ZINC000443201753 338446973 /nfs/dbraw/zinc/44/69/73/338446973.db2.gz ITJJTTKMUDHJPO-QMMMGPOBSA-N -1 1 310.781 4.254 20 0 DIADMM CC[C@@H](C)c1cc(C(=O)[N-]c2c(OC)cccc2SC)on1 ZINC000416118238 334652143 /nfs/dbraw/zinc/65/21/43/334652143.db2.gz AYHDLQVWIDMQSI-SNVBAGLBSA-N -1 1 320.414 4.171 20 0 DIADMM Cc1nc(-c2nc(=O)c3c(-c4ccc(C)cc4)csc3[n-]2)co1 ZINC000345196993 335306951 /nfs/dbraw/zinc/30/69/51/335306951.db2.gz FNOLJXKQRFHCBY-UHFFFAOYSA-N -1 1 323.377 4.336 20 0 DIADMM CSc1ccc(C)c(-c2nc(-c3ccc([O-])cc3F)no2)c1 ZINC000445465285 338495588 /nfs/dbraw/zinc/49/55/88/338495588.db2.gz YMYOLGFYGZKJNJ-UHFFFAOYSA-N -1 1 316.357 4.279 20 0 DIADMM C[C@H](Cc1nc(-c2ccc([O-])c(F)c2)no1)c1ccc(F)cc1 ZINC000445482449 338496422 /nfs/dbraw/zinc/49/64/22/338496422.db2.gz PWSPFWYQOZKEEO-SNVBAGLBSA-N -1 1 316.307 4.067 20 0 DIADMM [O-]c1ccc(-c2noc(CCc3ccc(Cl)cc3)n2)cc1F ZINC000445481710 338496432 /nfs/dbraw/zinc/49/64/32/338496432.db2.gz PZWCNFDPWBKPFU-UHFFFAOYSA-N -1 1 318.735 4.020 20 0 DIADMM Cc1c2ccccc2oc1-c1noc(-c2cc(F)ccc2[O-])n1 ZINC000445488445 338496873 /nfs/dbraw/zinc/49/68/73/338496873.db2.gz HREZCIOIBOSZGU-UHFFFAOYSA-N -1 1 310.284 4.303 20 0 DIADMM CC(C)N(Cc1cccs1)C(=O)c1ccc(Cl)cc1[O-] ZINC000042355793 336239711 /nfs/dbraw/zinc/23/97/11/336239711.db2.gz VOOAIZZPCXIEDX-UHFFFAOYSA-N -1 1 309.818 4.158 20 0 DIADMM Cc1cccc(Oc2ccccc2NC(=O)c2cncc([O-])c2)c1 ZINC000324727038 336253880 /nfs/dbraw/zinc/25/38/80/336253880.db2.gz ZZXKFWGWLUJOLU-UHFFFAOYSA-N -1 1 320.348 4.140 20 0 DIADMM [O-]c1c(-c2nc(Cc3ccccc3F)no2)ccc2ccccc21 ZINC000324963084 336275440 /nfs/dbraw/zinc/27/54/40/336275440.db2.gz XRJXZBXNMKBTOC-UHFFFAOYSA-N -1 1 320.323 4.325 20 0 DIADMM Cc1csc([C@H](C)[N-]c2nc(-c3cccc(Cl)c3)no2)n1 ZINC000301196229 336294417 /nfs/dbraw/zinc/29/44/17/336294417.db2.gz OANHQFZHXJMZHC-VIFPVBQESA-N -1 1 320.805 4.328 20 0 DIADMM C[C@H]1c2ccsc2CCN1C(=O)c1cc2ccccc2cc1[O-] ZINC000320866377 336374741 /nfs/dbraw/zinc/37/47/41/336374741.db2.gz QQJQDSGKAVJJGL-LBPRGKRZSA-N -1 1 323.417 4.366 20 0 DIADMM CCc1nc(SCc2ccccc2SC)[n-]c(=O)c1C ZINC000583705009 337092523 /nfs/dbraw/zinc/09/25/23/337092523.db2.gz YFTXRBOMWNZDHL-UHFFFAOYSA-N -1 1 306.456 4.067 20 0 DIADMM CCOc1cc(-c2noc([C@@H]3C[C@@H]3C3CC3)n2)cc(Cl)c1[O-] ZINC000583122913 337244139 /nfs/dbraw/zinc/24/41/39/337244139.db2.gz NPHRCFNDKSYJJN-GHMZBOCLSA-N -1 1 320.776 4.008 20 0 DIADMM CCOc1cc(-c2noc(CCC3CCC3)n2)cc(Cl)c1[O-] ZINC000445410099 337675805 /nfs/dbraw/zinc/67/58/05/337675805.db2.gz DFTFAEIYUIOSFP-UHFFFAOYSA-N -1 1 322.792 4.227 20 0 DIADMM CCOc1cc(-c2noc(C3(CC)CCC3)n2)cc(Cl)c1[O-] ZINC000445409420 337676799 /nfs/dbraw/zinc/67/67/99/337676799.db2.gz ADOLMFLLVJWHOI-UHFFFAOYSA-N -1 1 322.792 4.326 20 0 DIADMM CCOc1cc(-c2noc(C(C)(C)CC)n2)cc(Cl)c1[O-] ZINC000445413296 337682988 /nfs/dbraw/zinc/68/29/88/337682988.db2.gz SVHQCRAAWDNGHF-UHFFFAOYSA-N -1 1 310.781 4.182 20 0 DIADMM Cc1ncc(/C=C\c2nc(-c3ccc([O-])cc3Cl)no2)s1 ZINC000445451464 338016430 /nfs/dbraw/zinc/01/64/30/338016430.db2.gz GCBSHIMSCOJHEB-HYXAFXHYSA-N -1 1 319.773 4.031 20 0 DIADMM C/C(=C\c1nc(-c2ccc([O-])cc2F)no1)c1cccc(F)c1 ZINC000445456303 338017494 /nfs/dbraw/zinc/01/74/94/338017494.db2.gz NSNWUBJGRZPJCH-JXMROGBWSA-N -1 1 314.291 4.281 20 0 DIADMM C[C@@H](Cc1nc(-c2ccc([O-])cc2F)no1)c1cccc(F)c1 ZINC000445456655 338017610 /nfs/dbraw/zinc/01/76/10/338017610.db2.gz PKNOWGJTROQYLS-JTQLQIEISA-N -1 1 316.307 4.067 20 0 DIADMM CC(C)(c1nc(-c2ccc([O-])cc2F)no1)c1ccccc1F ZINC000445460247 338019381 /nfs/dbraw/zinc/01/93/81/338019381.db2.gz PDIJSJLNUKUJHS-UHFFFAOYSA-N -1 1 316.307 4.046 20 0 DIADMM O=c1nc(-c2cncs2)[n-]c2sc(-c3ccccc3)cc21 ZINC000426123670 338020765 /nfs/dbraw/zinc/02/07/65/338020765.db2.gz OYOLBNVSJXLRGW-UHFFFAOYSA-N -1 1 311.391 4.187 20 0 DIADMM Cc1cccc([C@@H](NCc2ccc(F)cc2Cl)C(=O)[O-])c1C ZINC000426738886 338040087 /nfs/dbraw/zinc/04/00/87/338040087.db2.gz ZMNOCVJELAYSHT-MRXNPFEDSA-N -1 1 321.779 4.011 20 0 DIADMM CSc1ccccc1[N-]C(=O)c1ncsc1C(F)(F)F ZINC000431032930 338120877 /nfs/dbraw/zinc/12/08/77/338120877.db2.gz MFSCUHKMRZZVCP-UHFFFAOYSA-N -1 1 318.345 4.136 20 0 DIADMM Cc1cc(C)c(S(=O)(=O)[N-]c2ccc(C)cc2Cl)s1 ZINC000431148118 338124174 /nfs/dbraw/zinc/12/41/74/338124174.db2.gz FJQFYBUKFRPVNG-UHFFFAOYSA-N -1 1 315.847 4.128 20 0 DIADMM CCCOc1cccc(CSc2nc(CC)c(C)c(=O)[n-]2)c1 ZINC000572901081 338135935 /nfs/dbraw/zinc/13/59/35/338135935.db2.gz XOKZCZGOPFAJHK-UHFFFAOYSA-N -1 1 318.442 4.134 20 0 DIADMM C[C@@H]1[C@@H](C(=O)Nc2ccc([O-])c(Cl)c2)[C@H]1c1ccccc1 ZINC000435762619 338248196 /nfs/dbraw/zinc/24/81/96/338248196.db2.gz JJNZEHMDUHNETA-AMKSKSKJSA-N -1 1 301.773 4.034 20 0 DIADMM CCc1cc(=O)[n-]c(S[C@@H]2CCCCc3ccccc32)n1 ZINC000436199093 338261660 /nfs/dbraw/zinc/26/16/60/338261660.db2.gz RNTUEQWPMPKQGW-OAHLLOKOSA-N -1 1 300.427 4.304 20 0 DIADMM CCc1cc(=O)[n-]c(SC/C=C\c2ccc(Cl)cc2)n1 ZINC000436246489 338263404 /nfs/dbraw/zinc/26/34/04/338263404.db2.gz YXBFZWRGJMVLGH-ARJAWSKDSA-N -1 1 306.818 4.204 20 0 DIADMM CN(CCCCc1ccccc1)C(=O)c1ccc(Cl)cc1[O-] ZINC000436492833 338274159 /nfs/dbraw/zinc/27/41/59/338274159.db2.gz SDVLXHXJDGQXPD-UHFFFAOYSA-N -1 1 317.816 4.141 20 0 DIADMM O=C(c1ccc(Cl)cc1[O-])N1CCCCC[C@H]1c1ccco1 ZINC000436530271 338275284 /nfs/dbraw/zinc/27/52/84/338275284.db2.gz QCAJBBRTCPVZCF-AWEZNQCLSA-N -1 1 319.788 4.396 20 0 DIADMM CC(C)[C@H](c1ccccc1)N(C)C(=O)c1cc(F)ccc1[O-] ZINC000436545522 338276403 /nfs/dbraw/zinc/27/64/03/338276403.db2.gz HILZQSXMSLGAIH-QGZVFWFLSA-N -1 1 301.361 4.001 20 0 DIADMM C[C@@H]1C[C@H]2CCCC[C@H]2N1C(=O)c1cc2ccccc2cc1[O-] ZINC000436550010 338276622 /nfs/dbraw/zinc/27/66/22/338276622.db2.gz HLLGPUWLASYOLM-MZMPZRCHSA-N -1 1 309.409 4.339 20 0 DIADMM C[C@@H]1C[C@H]2CCCC[C@@H]2N1C(=O)c1cc2ccccc2cc1[O-] ZINC000436550012 338276718 /nfs/dbraw/zinc/27/67/18/338276718.db2.gz HLLGPUWLASYOLM-QBIMZIAESA-N -1 1 309.409 4.339 20 0 DIADMM CC[C@H](CN(CC)C(=O)c1ccc([O-])cc1F)c1ccccc1 ZINC000436564480 338277222 /nfs/dbraw/zinc/27/72/22/338277222.db2.gz KDBVVTWVYMRZPC-CQSZACIVSA-N -1 1 315.388 4.187 20 0 DIADMM C[C@H]1CN(C(=O)c2cc3ccccc3cc2[O-])[C@@H]1c1ccccc1 ZINC000436574047 338277759 /nfs/dbraw/zinc/27/77/59/338277759.db2.gz KVUCEZOHTNUXKV-XOBRGWDASA-N -1 1 317.388 4.379 20 0 DIADMM C[C@@H]1CN(C(=O)c2ccc3ccccc3c2[O-])[C@@H]1c1ccccc1 ZINC000436574005 338277761 /nfs/dbraw/zinc/27/77/61/338277761.db2.gz KSDIFGFSRCYLBY-KUHUBIRLSA-N -1 1 317.388 4.379 20 0 DIADMM O=C(c1cc(F)ccc1[O-])N1CCCC2(C1)CCCCCC2 ZINC000436572336 338277892 /nfs/dbraw/zinc/27/78/92/338277892.db2.gz FHVBWCGHBNTMHJ-UHFFFAOYSA-N -1 1 305.393 4.108 20 0 DIADMM CCCCn1ncc(NC(=O)c2ccc(C(C)C)cc2[O-])c1C ZINC000436596222 338279089 /nfs/dbraw/zinc/27/90/89/338279089.db2.gz PMAKBVGFHVHNNZ-UHFFFAOYSA-N -1 1 315.417 4.073 20 0 DIADMM Cc1cc(-c2nc3ccc(C(C)C)cc3c(=O)[n-]2)cc(C)c1O ZINC000436661760 338282099 /nfs/dbraw/zinc/28/20/99/338282099.db2.gz GVEPLULFFLHFFX-UHFFFAOYSA-N -1 1 308.381 4.036 20 0 DIADMM Cc1ccccc1C[C@H](C)N(C)C(=O)c1cc(Cl)ccc1[O-] ZINC000436708318 338283519 /nfs/dbraw/zinc/28/35/19/338283519.db2.gz RVGOYJBOZDUKOY-ZDUSSCGKSA-N -1 1 317.816 4.057 20 0 DIADMM C[C@@H]1CCN(C(=O)c2ccc3ccccc3c2[O-])CC12CCC2 ZINC000436718291 338283972 /nfs/dbraw/zinc/28/39/72/338283972.db2.gz ZIFNUKKFFASDRT-CQSZACIVSA-N -1 1 309.409 4.198 20 0 DIADMM CCc1cccc(C)c1NC(=O)c1cc(Cl)c([O-])c(OC)c1 ZINC000436731195 338284439 /nfs/dbraw/zinc/28/44/39/338284439.db2.gz OMJJDNSXDCVBQC-UHFFFAOYSA-N -1 1 319.788 4.177 20 0 DIADMM CCC(CC)c1cc(C(=O)Nc2ccc(Cl)cc2[O-])on1 ZINC000436740505 338285091 /nfs/dbraw/zinc/28/50/91/338285091.db2.gz QGVBRGVLUKODES-UHFFFAOYSA-N -1 1 308.765 4.190 20 0 DIADMM CN(C(=O)c1ccc2ccccc2c1[O-])[C@@H]1CCc2ccccc21 ZINC000436756097 338285731 /nfs/dbraw/zinc/28/57/31/338285731.db2.gz QCMPFDIAEZREDE-LJQANCHMSA-N -1 1 317.388 4.305 20 0 DIADMM CCN(C(=O)c1ccc(C(C)C)cc1[O-])c1ccc(OC)cc1 ZINC000436757893 338286023 /nfs/dbraw/zinc/28/60/23/338286023.db2.gz WBOYDZVJNRYOSO-UHFFFAOYSA-N -1 1 313.397 4.191 20 0 DIADMM CN(CC1CCCCC1)C(=O)c1ccc(C(F)(F)F)cc1[O-] ZINC000436765260 338286364 /nfs/dbraw/zinc/28/63/64/338286364.db2.gz WLSXTWCEXFUTBK-UHFFFAOYSA-N -1 1 315.335 4.063 20 0 DIADMM C[C@H]1CCC[C@H](N(C)C(=O)c2ccc(C(F)(F)F)cc2[O-])C1 ZINC000436764684 338286455 /nfs/dbraw/zinc/28/64/55/338286455.db2.gz SMWCYMBGHOMXHO-JQWIXIFHSA-N -1 1 315.335 4.062 20 0 DIADMM CCc1ccc(C(=O)N2CCCSc3ccccc32)c([O-])c1 ZINC000436796516 338287712 /nfs/dbraw/zinc/28/77/12/338287712.db2.gz BNGQQRVEDAATIB-UHFFFAOYSA-N -1 1 313.422 4.097 20 0 DIADMM Cc1cc(NC(=O)c2cc(F)ccc2[O-])ccc1-c1ccncc1 ZINC000436867834 338290586 /nfs/dbraw/zinc/29/05/86/338290586.db2.gz FAJPBBXFYNUJPW-UHFFFAOYSA-N -1 1 322.339 4.154 20 0 DIADMM CCOc1cc(-c2noc([C@@H]3C[C@H]3C(C)C)n2)cc(Cl)c1[O-] ZINC000436869327 338290621 /nfs/dbraw/zinc/29/06/21/338290621.db2.gz CSTMZDLJBLTKHH-WDEREUQCSA-N -1 1 322.792 4.254 20 0 DIADMM [O-]c1ccc(-c2noc(-c3sccc3Cl)n2)c(Cl)c1 ZINC000436872345 338290907 /nfs/dbraw/zinc/29/09/07/338290907.db2.gz MGOIBBPUVRQNSU-UHFFFAOYSA-N -1 1 313.165 4.478 20 0 DIADMM [O-]c1ccc(-c2noc(-c3csc(Cl)c3)n2)c(Cl)c1 ZINC000436873575 338290932 /nfs/dbraw/zinc/29/09/32/338290932.db2.gz QGOBUVDPMOVPKJ-UHFFFAOYSA-N -1 1 313.165 4.478 20 0 DIADMM C[C@H]1[C@@H](c2nc(-c3ccc([O-])c(F)c3)no2)[C@H]1c1ccccc1 ZINC000436875235 338291062 /nfs/dbraw/zinc/29/10/62/338291062.db2.gz UBGRKOZHWIGLBP-UHNFBRDESA-N -1 1 310.328 4.098 20 0 DIADMM Cc1cccc([C@@H]2CCCN2C(=O)c2ccc([O-])cc2F)c1C ZINC000436877574 338291204 /nfs/dbraw/zinc/29/12/04/338291204.db2.gz ASWITKYAASVPPZ-SFHVURJKSA-N -1 1 313.372 4.125 20 0 DIADMM CCc1ccc(C(=O)N(CC)c2ccc3[nH]ccc3c2)c([O-])c1 ZINC000436888951 338291998 /nfs/dbraw/zinc/29/19/98/338291998.db2.gz WFJCIWNZRHEVFS-UHFFFAOYSA-N -1 1 308.381 4.103 20 0 DIADMM CN(C(=O)c1ccc(C(F)(F)F)cc1[O-])[C@@H]1CCC(C)(C)C1 ZINC000436923158 338293693 /nfs/dbraw/zinc/29/36/93/338293693.db2.gz RWUBNLKDLQHKIV-LLVKDONJSA-N -1 1 315.335 4.062 20 0 DIADMM Cc1cc(CN(C)C(=O)c2cc3ccccc3cc2[O-])ccc1F ZINC000436999637 338297287 /nfs/dbraw/zinc/29/72/87/338297287.db2.gz KONJNIFVOMXCAC-UHFFFAOYSA-N -1 1 323.367 4.265 20 0 DIADMM Cc1ccc(F)c(CN(C)C(=O)c2cc3ccccc3cc2[O-])c1 ZINC000436998437 338297429 /nfs/dbraw/zinc/29/74/29/338297429.db2.gz HFJLBZWIRWYWIR-UHFFFAOYSA-N -1 1 323.367 4.265 20 0 DIADMM CC(C)[C@@H](c1ccc(F)cc1)N(C)C(=O)c1ccc([O-])cc1F ZINC000447861065 338569708 /nfs/dbraw/zinc/56/97/08/338569708.db2.gz MNGJTWWKUQAMOG-KRWDZBQOSA-N -1 1 319.351 4.140 20 0 DIADMM O=S(=O)([N-]c1cccc(C(F)F)c1)c1ccc(C2CC2)cc1 ZINC000450995313 338716263 /nfs/dbraw/zinc/71/62/63/338716263.db2.gz FERQVMDZNDJTHB-UHFFFAOYSA-N -1 1 323.364 4.302 20 0 DIADMM CCc1nc(C(C)C)ccc1C(=O)Nc1ccc([O-])c(F)c1F ZINC000456774429 338939993 /nfs/dbraw/zinc/93/99/93/338939993.db2.gz CCYBBZVYDBVYPO-UHFFFAOYSA-N -1 1 320.339 4.004 20 0 DIADMM O=C(C[C@H]1CCCc2ccccc21)Nc1ccc([O-])c(F)c1F ZINC000456780383 338940362 /nfs/dbraw/zinc/94/03/62/338940362.db2.gz BTZZISXWMLNBON-GFCCVEGCSA-N -1 1 317.335 4.119 20 0 DIADMM O=C(Cc1cccc(C(F)F)c1)Nc1ccc([O-])c(Cl)c1 ZINC000468418688 339262548 /nfs/dbraw/zinc/26/25/48/339262548.db2.gz KQCUTUDMXPSBCJ-UHFFFAOYSA-N -1 1 311.715 4.164 20 0 DIADMM CSc1cccc(C)c1[N-]S(=O)(=O)c1cc(C)ccc1C ZINC000471982939 339358696 /nfs/dbraw/zinc/35/86/96/339358696.db2.gz DMKZUMOMJNWGHO-UHFFFAOYSA-N -1 1 321.467 4.135 20 0 DIADMM Cc1cc(S(=O)(=O)[N-]c2ccccc2Cl)sc1Cl ZINC000473501842 339386363 /nfs/dbraw/zinc/38/63/63/339386363.db2.gz HTEPNKGXJKMWQY-UHFFFAOYSA-N -1 1 322.238 4.164 20 0 DIADMM O=C([N-]c1c(F)cc(F)cc1F)c1cc(F)c(Cl)cc1F ZINC000489961791 339822363 /nfs/dbraw/zinc/82/23/63/339822363.db2.gz ZNXRHAZDPZMVAO-UHFFFAOYSA-N -1 1 321.632 4.288 20 0 DIADMM CCSc1cccc([N-]S(=O)(=O)c2ccc(CC)cc2)c1 ZINC000505294722 340165708 /nfs/dbraw/zinc/16/57/08/340165708.db2.gz YNEUFPHMHMTNGC-UHFFFAOYSA-N -1 1 321.467 4.162 20 0 DIADMM [O-]c1cccc(CN(Cc2cccc(F)c2)C2CC2)c1Cl ZINC000507169027 340210613 /nfs/dbraw/zinc/21/06/13/340210613.db2.gz HGFXAIWAVRWMEL-UHFFFAOYSA-N -1 1 305.780 4.349 20 0 DIADMM C[C@@H]1CN(Cc2cccc([O-])c2Cl)C[C@H](c2ccccc2)O1 ZINC000507783897 340231349 /nfs/dbraw/zinc/23/13/49/340231349.db2.gz HHTTZIOMMUZNHW-CXAGYDPISA-N -1 1 317.816 4.008 20 0 DIADMM CC(C)(C)c1ccc(NC(=O)c2c(F)ccc([O-])c2F)cc1 ZINC000507833031 340233547 /nfs/dbraw/zinc/23/35/47/340233547.db2.gz GHODXSGXFUPTLW-UHFFFAOYSA-N -1 1 305.324 4.220 20 0 DIADMM Cc1cccc(F)c1[N-]S(=O)(=O)c1csc2ccccc21 ZINC000508207616 340240681 /nfs/dbraw/zinc/24/06/81/340240681.db2.gz LFXJNDLQDLPBFI-UHFFFAOYSA-N -1 1 321.398 4.150 20 0 DIADMM [O-]c1cccc(CN2CCc3c4ccccc4[nH]c3C2)c1Cl ZINC000508837405 340254056 /nfs/dbraw/zinc/25/40/56/340254056.db2.gz NALXBQBNMOERHE-UHFFFAOYSA-N -1 1 312.800 4.085 20 0 DIADMM CCc1cccc(C)c1[N-]S(=O)(=O)c1cccc(SC)c1 ZINC000509103925 340261509 /nfs/dbraw/zinc/26/15/09/340261509.db2.gz SFEZKQXGZNUFJD-UHFFFAOYSA-N -1 1 321.467 4.080 20 0 DIADMM O=S(=O)([N-]c1cccc(-c2cccs2)c1)c1ccccc1 ZINC000509579066 340274078 /nfs/dbraw/zinc/27/40/78/340274078.db2.gz SHHUKXCJCBLXFN-UHFFFAOYSA-N -1 1 315.419 4.216 20 0 DIADMM C[C@H](CCOc1ccccc1)C(=O)Nc1ccc([O-])c(Cl)c1 ZINC000174737947 340395504 /nfs/dbraw/zinc/39/55/04/340395504.db2.gz ZDHNGCXJNWSZDP-GFCCVEGCSA-N -1 1 319.788 4.089 20 0 DIADMM CCC(=O)c1cccc(NC(=O)Nc2ccc([O-])c(Cl)c2)c1 ZINC000190979869 340548718 /nfs/dbraw/zinc/54/87/18/340548718.db2.gz ZCSFRHHMRNTUAE-UHFFFAOYSA-N -1 1 318.760 4.282 20 0 DIADMM CCc1cc(=O)[n-]c(SCc2ccc(C(C)C)nc2CC)n1 ZINC000564188867 340572382 /nfs/dbraw/zinc/57/23/82/340572382.db2.gz QQOZPNGPOFTDGH-UHFFFAOYSA-N -1 1 317.458 4.118 20 0 DIADMM CC1(C)CC[C@@H](C(=O)Nc2cc(Cl)c([O-])c3ccccc23)O1 ZINC000529538904 340761055 /nfs/dbraw/zinc/76/10/55/340761055.db2.gz NFUFVWLHSBBPLO-AWEZNQCLSA-N -1 1 319.788 4.095 20 0 DIADMM O=C(Nc1cc(Cl)c([O-])c2ccccc12)[C@H]1[C@@H]2CCC[C@@H]21 ZINC000529539056 340761060 /nfs/dbraw/zinc/76/10/60/340761060.db2.gz OODCBYXNHRJIHK-HBYGRHMLSA-N -1 1 301.773 4.183 20 0 DIADMM CC[C@@H](CC(=O)Nc1cccc(F)c1[O-])c1ccc(OC)cc1 ZINC000530005142 340775799 /nfs/dbraw/zinc/77/57/99/340775799.db2.gz IJHUVONTJJMAOK-LBPRGKRZSA-N -1 1 317.360 4.062 20 0 DIADMM C[C@H]1CC(C(=O)[O-])C[C@H](C)N1Cc1ccc(Cl)cc1Cl ZINC000530175193 340781730 /nfs/dbraw/zinc/78/17/30/340781730.db2.gz OJDIYJGGULINCL-UWVGGRQHSA-N -1 1 316.228 4.067 20 0 DIADMM C[C@@H]1CC(C(=O)[O-])C[C@@H](C)N1Cc1ccc(Cl)cc1Cl ZINC000530175189 340781739 /nfs/dbraw/zinc/78/17/39/340781739.db2.gz OJDIYJGGULINCL-NXEZZACHSA-N -1 1 316.228 4.067 20 0 DIADMM Cc1cc(S(=O)(=O)[N-]c2cccc(C)c2Cl)sc1C ZINC000538014900 340807264 /nfs/dbraw/zinc/80/72/64/340807264.db2.gz GQOJERBRQPIGNR-UHFFFAOYSA-N -1 1 315.847 4.128 20 0 DIADMM CC[C@H](NC(=O)c1ccc2ccccc2c1[O-])c1c(C)noc1C ZINC000129719926 340984317 /nfs/dbraw/zinc/98/43/17/340984317.db2.gz OCIXQOVNRZRDRA-INIZCTEOSA-N -1 1 324.380 4.031 20 0 DIADMM CC[C@@H](NC(=O)c1ccc2ccccc2c1[O-])c1c(C)noc1C ZINC000129720124 340984403 /nfs/dbraw/zinc/98/44/03/340984403.db2.gz OCIXQOVNRZRDRA-MRXNPFEDSA-N -1 1 324.380 4.031 20 0 DIADMM Cc1noc(-c2ccccc2)c1[N-]C(=O)c1cc(C(C)C)on1 ZINC000130857428 341049378 /nfs/dbraw/zinc/04/93/78/341049378.db2.gz XRAMVDZKRYUCTA-UHFFFAOYSA-N -1 1 311.341 4.014 20 0 DIADMM O=C(CCc1ccccc1Cl)Nc1ccc([O-])c(Cl)c1 ZINC000543745988 341056546 /nfs/dbraw/zinc/05/65/46/341056546.db2.gz YBKSEUCAODKRCT-UHFFFAOYSA-N -1 1 310.180 4.270 20 0 DIADMM C[C@H](CCC1CCCCC1)NC(=O)c1c(F)ccc([O-])c1F ZINC000564309097 341181124 /nfs/dbraw/zinc/18/11/24/341181124.db2.gz OMPGGTKHSUPZOK-LLVKDONJSA-N -1 1 311.372 4.149 20 0 DIADMM CCSc1cccc(NC(=O)c2c(F)ccc([O-])c2F)c1 ZINC000564309817 341182276 /nfs/dbraw/zinc/18/22/76/341182276.db2.gz XCBICGRNDRTVPU-UHFFFAOYSA-N -1 1 309.337 4.035 20 0 DIADMM C[C@@H]1C[C@@H]1c1noc(-c2cc(Oc3ccccc3)ccc2[O-])n1 ZINC000547187794 341200450 /nfs/dbraw/zinc/20/04/50/341200450.db2.gz UOCYAUBYVOHESX-RISCZKNCSA-N -1 1 308.337 4.358 20 0 DIADMM CC(C)c1noc([N-][C@H](C)c2nc3ccccc3n2C(F)F)n1 ZINC000267198364 519906281 /nfs/dbraw/zinc/90/62/81/519906281.db2.gz ISZDKICJYZDUDN-SECBINFHSA-N -1 1 321.331 4.111 20 0 DIADMM O=C([O-])C[C@@H]1CCCN(Cc2cc(Cl)ccc2Cl)CC1 ZINC000299745961 534504828 /nfs/dbraw/zinc/50/48/28/534504828.db2.gz UHWQDRVIDZPTJK-LLVKDONJSA-N -1 1 316.228 4.070 20 0 DIADMM Cc1cnc([C@H](NCc2cccc([O-])c2Cl)C2CC2)s1 ZINC000339281723 526165502 /nfs/dbraw/zinc/16/55/02/526165502.db2.gz JAYMVETZOIQRAO-CQSZACIVSA-N -1 1 308.834 4.051 20 0 DIADMM O=C([N-]c1c(F)cc(F)cc1F)c1coc(C2CCCC2)n1 ZINC000337956533 527091417 /nfs/dbraw/zinc/09/14/17/527091417.db2.gz WHWKPOHBPZWQEG-UHFFFAOYSA-N -1 1 310.275 4.002 20 0 DIADMM CC[C@@H](C)CO[N-]C(=O)[C@H](C)c1ccc(Cl)c(Cl)c1 ZINC001556803582 1058644266 /nfs/dbraw/zinc/64/42/66/1058644266.db2.gz FTSCWWAOIFXSKZ-NXEZZACHSA-N -1 1 304.217 4.191 20 0 DIADMM O=C(Nc1cc(F)c(F)cc1F)c1cc2ccccc2cc1[O-] ZINC000321233118 1035627066 /nfs/dbraw/zinc/62/70/66/1035627066.db2.gz MVIURHOAEPQBHZ-UHFFFAOYSA-N -1 1 317.266 4.215 20 0 DIADMM Cc1cnc(F)c([N-]c2nc3cc(Br)ccc3o2)c1 ZINC001211496219 1035702339 /nfs/dbraw/zinc/70/23/39/1035702339.db2.gz SNEVHHOKTLPBAO-UHFFFAOYSA-N -1 1 322.137 4.176 20 0 DIADMM C[C@H](Sc1nc(C(F)(F)F)cc(=O)[n-]1)c1ccccc1F ZINC000261430568 1035871169 /nfs/dbraw/zinc/87/11/69/1035871169.db2.gz QMTKVAYPPGPATC-ZETCQYMHSA-N -1 1 318.295 4.193 20 0 DIADMM Cc1c2cc(C)ccc2[nH]c1C(=O)Nc1ccc([O-])c(Cl)c1 ZINC000182876902 1035991713 /nfs/dbraw/zinc/99/17/13/1035991713.db2.gz DXTNNFSHEBDXCC-UHFFFAOYSA-N -1 1 314.772 4.396 20 0 DIADMM CC[C@H](C)c1ccc(S(=O)(=O)[N-]c2ncccc2Cl)cc1 ZINC000180193918 1036052175 /nfs/dbraw/zinc/05/21/75/1036052175.db2.gz RCQRNWMTCHXZDH-NSHDSACASA-N -1 1 324.833 4.049 20 0 DIADMM CC(C)(C)C[C@H]1CCN(C(=O)c2ccc([O-])c(F)c2)C1(C)C ZINC001626304682 1036143867 /nfs/dbraw/zinc/14/38/67/1036143867.db2.gz MSTOKMDKHXRKAG-CYBMUJFWSA-N -1 1 307.409 4.208 20 0 DIADMM [O-]c1cc(F)cc(F)c1Nc1cc(C(F)(F)F)ccc1O ZINC001209982743 1036338157 /nfs/dbraw/zinc/33/81/57/1036338157.db2.gz VSDZVNMGPOKAOZ-UHFFFAOYSA-N -1 1 305.202 4.138 20 0 DIADMM [O-]c1cc(Nc2cnccc2C(F)(F)F)c(F)cc1Cl ZINC001210094461 1036388700 /nfs/dbraw/zinc/38/87/00/1036388700.db2.gz VPQIRBKMMATFMR-UHFFFAOYSA-N -1 1 306.646 4.342 20 0 DIADMM O=C(Nc1cccc(F)c1[O-])c1cc2c(ccc3ccccc23)[nH]1 ZINC001648848081 1036629939 /nfs/dbraw/zinc/62/99/39/1036629939.db2.gz ZEBJZWNWHBUATR-UHFFFAOYSA-N -1 1 320.323 4.418 20 0 DIADMM O=C([N-]c1ccccc1SC(F)F)c1scnc1Cl ZINC000047206080 1037000551 /nfs/dbraw/zinc/00/05/51/1037000551.db2.gz BWKYEJQQMHGTGN-UHFFFAOYSA-N -1 1 320.773 4.364 20 0 DIADMM Nc1ccc(-c2nccn2-c2cc(Cl)c([O-])c(Cl)c2)cc1 ZINC001210928858 1037060425 /nfs/dbraw/zinc/06/04/25/1037060425.db2.gz NZEAQQWQLFZJOB-UHFFFAOYSA-N -1 1 320.179 4.134 20 0 DIADMM C[C@@H](Sc1nc(C(F)F)cc(=O)[n-]1)c1cc(F)ccc1F ZINC000562906628 1037289643 /nfs/dbraw/zinc/28/96/43/1037289643.db2.gz VVBUCWROGZVIBF-ZCFIWIBFSA-N -1 1 318.295 4.251 20 0 DIADMM [O-]c1ccc(-c2noc(CCc3cccc(Cl)c3)n2)c(F)c1 ZINC000581111133 1037441191 /nfs/dbraw/zinc/44/11/91/1037441191.db2.gz YEWMHIQPIWZRPY-UHFFFAOYSA-N -1 1 318.735 4.020 20 0 DIADMM CC(C)c1ccc(C(=O)N2CCc3ccc(Cl)cc32)c([O-])c1 ZINC000060471608 1037590170 /nfs/dbraw/zinc/59/01/70/1037590170.db2.gz ZQMLDGQRKDYMLI-UHFFFAOYSA-N -1 1 315.800 4.372 20 0 DIADMM C[C@@H](c1ccc(Cl)cc1)N(Cc1occc1C(=O)[O-])C1CC1 ZINC000581434794 1037639896 /nfs/dbraw/zinc/63/98/96/1037639896.db2.gz MCSWJGPSWOEFBF-NSHDSACASA-N -1 1 319.788 4.357 20 0 DIADMM CC[C@H](C)CC(=O)Nc1c([O-])cc(Br)cc1Cl ZINC000581682523 1037903099 /nfs/dbraw/zinc/90/30/99/1037903099.db2.gz VRXYMWTUDBKLME-ZETCQYMHSA-N -1 1 320.614 4.183 20 0 DIADMM CCc1nc(SCc2ccc(SC)cc2)[n-]c(=O)c1C ZINC000657263947 1038479138 /nfs/dbraw/zinc/47/91/38/1038479138.db2.gz SJGUARMUMVGWTR-UHFFFAOYSA-N -1 1 306.456 4.067 20 0 DIADMM CCc1nc(SCc2ccc(F)cc2Cl)[n-]c(=O)c1C ZINC000657263603 1038479592 /nfs/dbraw/zinc/47/95/92/1038479592.db2.gz JMTODEFEAMTASE-UHFFFAOYSA-N -1 1 312.797 4.138 20 0 DIADMM CC(C)c1ccc(CCC(=O)Nc2c([O-])cccc2F)cc1 ZINC000605440361 1038516087 /nfs/dbraw/zinc/51/60/87/1038516087.db2.gz QHSXLHZDCFVPTR-UHFFFAOYSA-N -1 1 301.361 4.226 20 0 DIADMM O=C(Nc1c([O-])cccc1F)c1ccc(-c2ccccc2F)o1 ZINC000605440539 1038516683 /nfs/dbraw/zinc/51/66/83/1038516683.db2.gz UQHXTOFMKAOHCC-UHFFFAOYSA-N -1 1 315.275 4.183 20 0 DIADMM O=C(Nc1ccc(Cl)cc1)c1ccc(C(F)(F)F)c([O-])c1 ZINC000684868428 1038663705 /nfs/dbraw/zinc/66/37/05/1038663705.db2.gz BCFOUPXKHIZBFD-UHFFFAOYSA-N -1 1 315.678 4.317 20 0 DIADMM CC1CCC(N(C)C(=O)c2ccc(C(F)(F)F)c([O-])c2)CC1 ZINC000684870562 1038666530 /nfs/dbraw/zinc/66/65/30/1038666530.db2.gz IXIHWJFCAZPELT-UHFFFAOYSA-N -1 1 315.335 4.062 20 0 DIADMM CCN(C(=O)c1ccc(C(F)(F)F)c([O-])c1)c1ccccc1 ZINC000684871063 1038667760 /nfs/dbraw/zinc/66/77/60/1038667760.db2.gz ZDYNLKUZWPKLQM-UHFFFAOYSA-N -1 1 309.287 4.078 20 0 DIADMM Cc1c(F)cccc1NC(=O)c1ccc(C(F)(F)F)c([O-])c1 ZINC000684876287 1038671026 /nfs/dbraw/zinc/67/10/26/1038671026.db2.gz RQZVBPHQFOKKKL-UHFFFAOYSA-N -1 1 313.250 4.111 20 0 DIADMM [O-]c1cccc(CN2CCc3cccc(Cl)c3C2)c1Cl ZINC001232789076 1038787191 /nfs/dbraw/zinc/78/71/91/1038787191.db2.gz VMELEMGHQAUTCA-UHFFFAOYSA-N -1 1 308.208 4.257 20 0 DIADMM CC[C@@H](CC(=O)Nc1c([O-])cccc1F)c1ccc(C)cc1 ZINC000608366869 1038831210 /nfs/dbraw/zinc/83/12/10/1038831210.db2.gz PECGSDRKLNIBTN-ZDUSSCGKSA-N -1 1 301.361 4.362 20 0 DIADMM CCCCN(C)c1ccc(C(=O)Nc2c([O-])cccc2F)cc1 ZINC000608366430 1038831745 /nfs/dbraw/zinc/83/17/45/1038831745.db2.gz KCDJLCOMERDHLO-UHFFFAOYSA-N -1 1 316.376 4.020 20 0 DIADMM O=C(Nc1c([O-])cccc1F)[C@H]1C[C@H]1c1cccc2ccccc21 ZINC000608367202 1038831991 /nfs/dbraw/zinc/83/19/91/1038831991.db2.gz MQMYQYNZINWIGD-HOTGVXAUSA-N -1 1 321.351 4.427 20 0 DIADMM CC(C)=CCOc1cccc(C(=O)Nc2c([O-])cccc2F)c1 ZINC000608365661 1038832331 /nfs/dbraw/zinc/83/23/31/1038832331.db2.gz IECSVZIBMSJDMY-UHFFFAOYSA-N -1 1 315.344 4.129 20 0 DIADMM [O-]c1cccc(CNCc2cccc(OC3CC3)c2F)c1Cl ZINC000657621577 1038921585 /nfs/dbraw/zinc/92/15/85/1038921585.db2.gz UVKTVFBIXCFIIU-UHFFFAOYSA-N -1 1 321.779 4.016 20 0 DIADMM CC[C@H](C)[C@@H](C(=O)Nc1ccc([O-])c(F)c1F)c1ccccc1 ZINC000456797283 1039076382 /nfs/dbraw/zinc/07/63/82/1039076382.db2.gz ZVFFSFKWYWNUGF-XHDPSFHLSA-N -1 1 319.351 4.439 20 0 DIADMM Cc1cc(SCC(=O)c2ccc([O-])cc2)nc2ccccc12 ZINC000016774907 1039141167 /nfs/dbraw/zinc/14/11/67/1039141167.db2.gz SBYPOMXPUWBQIC-UHFFFAOYSA-N -1 1 309.390 4.224 20 0 DIADMM C[C@@H](Cc1cccc(Cl)c1)C(=O)Nc1ccc(F)cc1[O-] ZINC000535986457 1039259343 /nfs/dbraw/zinc/25/93/43/1039259343.db2.gz NVYUFJWUWPTFTQ-JTQLQIEISA-N -1 1 307.752 4.002 20 0 DIADMM C[C@H](c1ccc(Cl)c(Cl)c1)N1CC[C@@H](C(=O)[O-])[C@H](C)C1 ZINC000380191065 1039334658 /nfs/dbraw/zinc/33/46/58/1039334658.db2.gz DRVTUJAIHFVPSD-CKYFFXLPSA-N -1 1 316.228 4.097 20 0 DIADMM CC(C)(C)c1nc(C(=O)Nc2ccc([O-])c(Cl)c2)cs1 ZINC000540959092 1039596759 /nfs/dbraw/zinc/59/67/59/1039596759.db2.gz FXVJAXXGFGWZLZ-UHFFFAOYSA-N -1 1 310.806 4.052 20 0 DIADMM CC(C)c1cccc(OCC(=O)Nc2ccc([O-])c(Cl)c2)c1 ZINC000540959219 1039597082 /nfs/dbraw/zinc/59/70/82/1039597082.db2.gz VVPLUPUMQQIVCT-UHFFFAOYSA-N -1 1 319.788 4.187 20 0 DIADMM O=C(Nc1ccc([O-])c(Cl)c1)c1cc(F)c(Cl)cc1F ZINC000152218419 1039992129 /nfs/dbraw/zinc/99/21/29/1039992129.db2.gz QEBFBWPBQGNGNA-UHFFFAOYSA-N -1 1 318.106 4.230 20 0 DIADMM O=C(C/C=C/c1ccccc1F)Nc1ccc([O-])c(Cl)c1 ZINC000176690863 1040085331 /nfs/dbraw/zinc/08/53/31/1040085331.db2.gz WDEUDCGAPOBHMA-HWKANZROSA-N -1 1 305.736 4.227 20 0 DIADMM CCC[C@@H](OCC)C(=O)Nc1cc(Cl)c([O-])c2ccccc12 ZINC000628233776 1040241424 /nfs/dbraw/zinc/24/14/24/1040241424.db2.gz UPXJCKOVRPHMJP-OAHLLOKOSA-N -1 1 321.804 4.343 20 0 DIADMM O=C(Nc1ccccc1SC(F)(F)F)c1ccccc1[O-] ZINC001143459476 1040246922 /nfs/dbraw/zinc/24/69/22/1040246922.db2.gz WMELVVOMILGWNO-UHFFFAOYSA-N -1 1 313.300 4.256 20 0 DIADMM CSc1ccc([O-])c(C(=O)N(CC2CC2)c2ccccc2)c1 ZINC000612081341 1040324624 /nfs/dbraw/zinc/32/46/24/1040324624.db2.gz IDROPYISYMJHFI-UHFFFAOYSA-N -1 1 313.422 4.171 20 0 DIADMM CCN(C(=O)c1cc(F)ccc1[O-])c1cccc2ccccc21 ZINC000322690291 1040602957 /nfs/dbraw/zinc/60/29/57/1040602957.db2.gz JEKSLSSYVNCGNM-UHFFFAOYSA-N -1 1 309.340 4.351 20 0 DIADMM O=C1[N-]C(=S)SC1=Cc1cnc(-c2ccccc2)s1 ZINC000066255675 1040747858 /nfs/dbraw/zinc/74/78/58/1040747858.db2.gz NBUQNXCJHNTBCQ-UXBLZVDNSA-N -1 1 304.421 4.139 20 0 DIADMM CCOc1cc(C(=O)Nc2cccc(F)c2C)cc(Cl)c1[O-] ZINC000186844737 1041186715 /nfs/dbraw/zinc/18/67/15/1041186715.db2.gz WPZUCIILDWFVJK-UHFFFAOYSA-N -1 1 323.751 4.144 20 0 DIADMM C[C@@H](c1ccc(Cl)cc1Cl)N1CCC[C@@H](CC(=O)[O-])C1 ZINC000226420081 1041399674 /nfs/dbraw/zinc/39/96/74/1041399674.db2.gz HERAGZXLIRHKEL-QWRGUYRKSA-N -1 1 316.228 4.241 20 0 DIADMM [O-]c1cccc(CNc2cc3c(cc2Cl)OCO3)c1Cl ZINC000328235225 1041428635 /nfs/dbraw/zinc/42/86/35/1041428635.db2.gz PKVLGAQJLQDYFK-UHFFFAOYSA-N -1 1 312.152 4.040 20 0 DIADMM O=C(Nc1cc([O-])c(F)cc1F)c1cccc(C2CCC2)c1 ZINC001625894456 1041513643 /nfs/dbraw/zinc/51/36/43/1041513643.db2.gz YAPXVPMLZBCCOL-UHFFFAOYSA-N -1 1 303.308 4.190 20 0 DIADMM O=C([N-]c1cscc1Cl)c1cc(-c2ccccc2)no1 ZINC001133290288 1041620681 /nfs/dbraw/zinc/62/06/81/1041620681.db2.gz XRVGVRZXTHSNBY-UHFFFAOYSA-N -1 1 304.758 4.309 20 0 DIADMM Cc1ccc(C)c(SCC(=O)Nc2ccc([O-])c(Cl)c2)c1 ZINC000584710768 1041649122 /nfs/dbraw/zinc/64/91/22/1041649122.db2.gz FWMVIATULWYZAI-UHFFFAOYSA-N -1 1 321.829 4.393 20 0 DIADMM Cc1cccc(-c2ccc(NC(=O)c3ccccc3[O-])nc2)c1 ZINC001648926985 1041676888 /nfs/dbraw/zinc/67/68/88/1041676888.db2.gz YUKHGZSCUXWCBI-UHFFFAOYSA-N -1 1 304.349 4.015 20 0 DIADMM C[C@H](C#N)Oc1ccccc1NCc1c([O-])ccc(Cl)c1F ZINC000191575945 1041731411 /nfs/dbraw/zinc/73/14/11/1041731411.db2.gz IIKCDNWKNIVYQR-SNVBAGLBSA-N -1 1 320.751 4.088 20 0 DIADMM [O-]c1cc(F)c(Cl)cc1-c1ccc(O[C@H]2CCOC2)cc1 ZINC000623048607 1041736335 /nfs/dbraw/zinc/73/63/35/1041736335.db2.gz JPBLLUBPFZIWRO-LBPRGKRZSA-N -1 1 308.736 4.019 20 0 DIADMM O=C(Nc1ccc([O-])c(Cl)c1)c1cc(C2CC2)[nH]c1C1CC1 ZINC000626227689 1041823135 /nfs/dbraw/zinc/82/31/35/1041823135.db2.gz BSTWRWXSMQYJDB-UHFFFAOYSA-N -1 1 316.788 4.381 20 0 DIADMM O=C([N-]c1nnc(C2CCCCC2)s1)c1sccc1F ZINC000815086990 1041914000 /nfs/dbraw/zinc/91/40/00/1041914000.db2.gz XNGHJYQPCXUWBR-UHFFFAOYSA-N -1 1 311.407 4.039 20 0 DIADMM [O-]c1cccc(CNc2ccc(OCC(F)F)cc2)c1Cl ZINC000815128827 1041918569 /nfs/dbraw/zinc/91/85/69/1041918569.db2.gz OEGUQRPBFRVVDL-UHFFFAOYSA-N -1 1 313.731 4.302 20 0 DIADMM CC1(C)Cc2cc(NCc3cccc([O-])c3Cl)ccc2O1 ZINC000815132450 1041923413 /nfs/dbraw/zinc/92/34/13/1041923413.db2.gz XTFDHNGRTGWTBE-UHFFFAOYSA-N -1 1 303.789 4.371 20 0 DIADMM CCc1ccc(NC(=O)c2ccc3ccc(O)cc3c2[O-])cc1 ZINC001135372734 1042021287 /nfs/dbraw/zinc/02/12/87/1042021287.db2.gz JTDSSSXITAGEKE-UHFFFAOYSA-N -1 1 307.349 4.066 20 0 DIADMM O=C(Cc1ccc([O-])c(Cl)c1)Nc1ccc2ccccc2c1 ZINC001135507752 1042038314 /nfs/dbraw/zinc/03/83/14/1042038314.db2.gz JIXJNIQDFBESJY-UHFFFAOYSA-N -1 1 311.768 4.380 20 0 DIADMM CCc1ccc([C@H]2CCCN2[C@H](C)c2cc(C(=O)[O-])c(C)o2)o1 ZINC000652416594 1042042873 /nfs/dbraw/zinc/04/28/73/1042042873.db2.gz UQTHBLMNHHHFEB-IAQYHMDHSA-N -1 1 317.385 4.340 20 0 DIADMM O=C(N[C@@H]1CC[C@@H]2CCCC[C@H]2C1)c1cc(Cl)ccc1[O-] ZINC001136019225 1042125149 /nfs/dbraw/zinc/12/51/49/1042125149.db2.gz MWLHZOLOWLMNQV-SGMGOOAPSA-N -1 1 307.821 4.134 20 0 DIADMM O=C(N[C@@H]1CC[C@H]2CCCC[C@H]2C1)c1cc(Cl)ccc1[O-] ZINC001136019223 1042125234 /nfs/dbraw/zinc/12/52/34/1042125234.db2.gz MWLHZOLOWLMNQV-MBNYWOFBSA-N -1 1 307.821 4.134 20 0 DIADMM CC[S@@](=N)(=O)c1ccc(-c2c(F)ccc([O-])c2Cl)cc1 ZINC001245831583 1042138622 /nfs/dbraw/zinc/13/86/22/1042138622.db2.gz NKQOOLIQJRHLCN-HXUWFJFHSA-N -1 1 313.781 4.277 20 0 DIADMM [O-]c1ccc(F)c(-c2cccnc2OCC(F)(F)F)c1Cl ZINC001245831095 1042139849 /nfs/dbraw/zinc/13/98/49/1042139849.db2.gz CYCYVKPWADCGHX-UHFFFAOYSA-N -1 1 321.657 4.188 20 0 DIADMM CCCc1ccccc1NC(=O)c1ccc2ccc(O)cc2c1[O-] ZINC001136116637 1042141652 /nfs/dbraw/zinc/14/16/52/1042141652.db2.gz SOZVVGUTTWNAGN-UHFFFAOYSA-N -1 1 321.376 4.456 20 0 DIADMM CCN(Cc1ccc2ccccc2c1)C(=O)c1cc(F)ccc1[O-] ZINC001136176030 1042164440 /nfs/dbraw/zinc/16/44/40/1042164440.db2.gz CYKNTLYKSURTDQ-UHFFFAOYSA-N -1 1 323.367 4.347 20 0 DIADMM CSc1ccc([O-])c(C(=O)Nc2ccccc2OC(C)C)c1 ZINC001136242114 1042190330 /nfs/dbraw/zinc/19/03/30/1042190330.db2.gz QUTCKSFNXTVTPE-UHFFFAOYSA-N -1 1 317.410 4.154 20 0 DIADMM CC(C)(C)[C@@H](NC(=O)c1cc(F)ccc1[O-])c1ccc(F)cc1 ZINC001136256895 1042192642 /nfs/dbraw/zinc/19/26/42/1042192642.db2.gz NJNKMTVRABQWEO-INIZCTEOSA-N -1 1 319.351 4.188 20 0 DIADMM CC(C)c1ccc(C(=O)Nc2nc3c(s2)CCCC3)c([O-])c1 ZINC001136339854 1042215871 /nfs/dbraw/zinc/21/58/71/1042215871.db2.gz VUPHJKHIULBBCG-UHFFFAOYSA-N -1 1 316.426 4.103 20 0 DIADMM Cc1c(Cl)cc(NC(=O)c2ccc([O-])cc2F)cc1Cl ZINC000647743463 1042217395 /nfs/dbraw/zinc/21/73/95/1042217395.db2.gz SELVNFWNAUXZGY-UHFFFAOYSA-N -1 1 314.143 4.399 20 0 DIADMM CCc1cccc(C)c1NC(=O)c1cc(SC)ccc1[O-] ZINC001136344574 1042218725 /nfs/dbraw/zinc/21/87/25/1042218725.db2.gz LPONQRRXPHSRKR-UHFFFAOYSA-N -1 1 301.411 4.237 20 0 DIADMM Cc1c2ccccc2oc1[C@@H](C)NC(=O)c1cc(F)ccc1[O-] ZINC001136375636 1042226702 /nfs/dbraw/zinc/22/67/02/1042226702.db2.gz WWDLXKLJLYABAU-LLVKDONJSA-N -1 1 313.328 4.077 20 0 DIADMM COc1cnc(C=Cc2sc3ccccc3c2Cl)[n-]c1=O ZINC000821008851 1042240616 /nfs/dbraw/zinc/24/06/16/1042240616.db2.gz SUBAXWFKBOFAPN-SREVYHEPSA-N -1 1 318.785 4.229 20 0 DIADMM CC(C)c1nc2ccc(NC(=O)c3ccccc3[O-])cc2s1 ZINC001136467475 1042256800 /nfs/dbraw/zinc/25/68/00/1042256800.db2.gz ATFMTILDRDVICB-UHFFFAOYSA-N -1 1 312.394 4.378 20 0 DIADMM O=C(Nc1ccc([O-])c(Cl)c1)[C@H]1CCC[C@H](C(F)(F)F)C1 ZINC000096482090 1042351441 /nfs/dbraw/zinc/35/14/41/1042351441.db2.gz LTDXBYKHLBYLRT-IUCAKERBSA-N -1 1 321.726 4.353 20 0 DIADMM CCOc1cc(F)c(F)cc1Nc1c([O-])cc(F)cc1F ZINC001211800908 1042454364 /nfs/dbraw/zinc/45/43/64/1042454364.db2.gz JROLFSFZDHANGB-UHFFFAOYSA-N -1 1 301.239 4.091 20 0 DIADMM CCCC[C@H](CC)CSc1nc([O-])cc(=O)n1C1CCCC1 ZINC000515288927 1042814733 /nfs/dbraw/zinc/81/47/33/1042814733.db2.gz GAFOUGLYNGRXOK-ZDUSSCGKSA-N -1 1 324.490 4.373 20 0 DIADMM Cc1ccc(F)cc1S(=O)(=O)[N-]c1cccc(C(C)C)c1 ZINC000515621383 1042828759 /nfs/dbraw/zinc/82/87/59/1042828759.db2.gz FMHOQZDMHBEFRM-UHFFFAOYSA-N -1 1 307.390 4.058 20 0 DIADMM Cc1c(NCc2cccc([O-])c2Cl)cnn1C1CCCC1 ZINC000293285117 1042900460 /nfs/dbraw/zinc/90/04/60/1042900460.db2.gz OKSIHKZGVWEPIY-UHFFFAOYSA-N -1 1 305.809 4.278 20 0 DIADMM CSc1ccc([O-])c(-c2nc([C@H]3CCCCS3)no2)c1 ZINC000664822738 1042963485 /nfs/dbraw/zinc/96/34/85/1042963485.db2.gz ZLFDGHLLXBZTSF-GFCCVEGCSA-N -1 1 308.428 4.122 20 0 DIADMM CC[C@H](C)[C@H](NC(=O)Nc1ccc([O-])c(Cl)c1)C(F)(F)F ZINC000520331378 1043034776 /nfs/dbraw/zinc/03/47/76/1043034776.db2.gz ABSBKZFTAIPVKW-CPCISQLKSA-N -1 1 324.730 4.144 20 0 DIADMM CC[C@H](C)[C@@H](NC(=O)Nc1ccc([O-])c(Cl)c1)C(F)(F)F ZINC000520331381 1043034927 /nfs/dbraw/zinc/03/49/27/1043034927.db2.gz ABSBKZFTAIPVKW-WRWORJQWSA-N -1 1 324.730 4.144 20 0 DIADMM CCCCN(CCCC)C(=O)c1cc(Cl)c([O-])c(OC)c1 ZINC000442858660 1043446252 /nfs/dbraw/zinc/44/62/52/1043446252.db2.gz SMFXLSQJDMIHFC-UHFFFAOYSA-N -1 1 313.825 4.097 20 0 DIADMM CCOc1cc(-c2nc([C@H](C)C3CC3)no2)cc(Cl)c1[O-] ZINC000443218677 1043513897 /nfs/dbraw/zinc/51/38/97/1043513897.db2.gz CEPKTHMTRZLCLX-MRVPVSSYSA-N -1 1 308.765 4.008 20 0 DIADMM CC(C)(C)CN(CC(=O)[O-])Cc1ccc(-c2ccc(F)cc2)o1 ZINC000665349639 1043596294 /nfs/dbraw/zinc/59/62/94/1043596294.db2.gz PKTXEEWJBRNJHT-UHFFFAOYSA-N -1 1 319.376 4.018 20 0 DIADMM Cc1cc(-c2nc(=O)c3c([n-]2)sc(C)c3-c2ccccc2)no1 ZINC000358836728 1044102797 /nfs/dbraw/zinc/10/27/97/1044102797.db2.gz XOLVZCLIWRSIQB-UHFFFAOYSA-N -1 1 323.377 4.336 20 0 DIADMM CCCCCC[C@H](C)NC(=O)c1cc(Cl)c([O-])c(OC)c1 ZINC000881466559 1044118510 /nfs/dbraw/zinc/11/85/10/1044118510.db2.gz ZRWMDDDJOWCCHU-NSHDSACASA-N -1 1 313.825 4.143 20 0 DIADMM C[C@H](C(=O)[N-]OCc1ccc(C(F)(F)F)cc1)c1ccccc1 ZINC000130478323 1044202878 /nfs/dbraw/zinc/20/28/78/1044202878.db2.gz YPEDRSXOFHRJLI-LBPRGKRZSA-N -1 1 323.314 4.057 20 0 DIADMM C[C@@H](c1ccc(Cl)c(Cl)c1)N1CCC(C)(C(=O)[O-])CC1 ZINC000086776772 1044241286 /nfs/dbraw/zinc/24/12/86/1044241286.db2.gz DLRULDDVFPAVNO-JTQLQIEISA-N -1 1 316.228 4.241 20 0 DIADMM C[C@H](c1ccc(Cl)c(Cl)c1)N1CCC(C)(C(=O)[O-])CC1 ZINC000086776774 1044241897 /nfs/dbraw/zinc/24/18/97/1044241897.db2.gz DLRULDDVFPAVNO-SNVBAGLBSA-N -1 1 316.228 4.241 20 0 DIADMM CCc1nc(SCc2sccc2Cl)[n-]c(=O)c1C ZINC000563639026 1044292296 /nfs/dbraw/zinc/29/22/96/1044292296.db2.gz YJZQUJVCADQYGB-UHFFFAOYSA-N -1 1 300.836 4.060 20 0 DIADMM O=C(Nc1ccc(F)cc1[O-])c1cc(C2CC2)oc1C1CC1 ZINC000935099428 1044313571 /nfs/dbraw/zinc/31/35/71/1044313571.db2.gz JDKAROADHWIJGE-UHFFFAOYSA-N -1 1 301.317 4.131 20 0 DIADMM O=C([N-]c1nnc(C2CCCCC2)s1)c1ccc(Cl)o1 ZINC000029090105 1044356968 /nfs/dbraw/zinc/35/69/68/1044356968.db2.gz TVCZKTSOWKKOFC-UHFFFAOYSA-N -1 1 311.794 4.085 20 0 DIADMM CCc1nc(S[C@H](C)c2cc(F)ccc2F)[n-]c(=O)c1C ZINC000564585973 1044392198 /nfs/dbraw/zinc/39/21/98/1044392198.db2.gz NTMNIQUYNMDELY-SECBINFHSA-N -1 1 310.369 4.185 20 0 DIADMM C[C@@H](c1ccc(Cl)cc1Cl)N1CC[C@@H](C)[C@@H](C(=O)[O-])C1 ZINC000566067931 1044472470 /nfs/dbraw/zinc/47/24/70/1044472470.db2.gz JGOITUXCMRJYBC-NRUUGDAUSA-N -1 1 316.228 4.097 20 0 DIADMM C[C@@H](c1ccc(Cl)cc1Cl)N1CC[C@@H](C)[C@H](C(=O)[O-])C1 ZINC000566067929 1044473065 /nfs/dbraw/zinc/47/30/65/1044473065.db2.gz JGOITUXCMRJYBC-GBIKHYSHSA-N -1 1 316.228 4.097 20 0 DIADMM O=c1cc(C(F)F)nc(S[C@@H]2CCc3ccc(F)cc32)[n-]1 ZINC000568568126 1044635590 /nfs/dbraw/zinc/63/55/90/1044635590.db2.gz HDNTYIDXVPGUNT-LLVKDONJSA-N -1 1 312.316 4.039 20 0 DIADMM CCOc1cc(-c2noc(C[C@H]3C=CCC3)n2)cc(Cl)c1[O-] ZINC000445424995 1044714782 /nfs/dbraw/zinc/71/47/82/1044714782.db2.gz ALSPFUZHTNDQDG-JTQLQIEISA-N -1 1 320.776 4.003 20 0 DIADMM CSc1ccc(-c2nc(-c3ccc([O-])cc3Cl)no2)o1 ZINC000445445928 1044722473 /nfs/dbraw/zinc/72/24/73/1044722473.db2.gz NFDMWWVXHRRCMV-UHFFFAOYSA-N -1 1 308.746 4.078 20 0 DIADMM Cc1ccsc1[C@H]1C[C@@H]1c1nc(-c2ccc([O-])cc2F)no1 ZINC000445464873 1044725796 /nfs/dbraw/zinc/72/57/96/1044725796.db2.gz VXADHQUPMJPZRO-RYUDHWBXSA-N -1 1 316.357 4.222 20 0 DIADMM Cc1cc(-c2nc(-c3ccc([O-])c(F)c3)no2)c2ccccc2n1 ZINC000445482695 1044729060 /nfs/dbraw/zinc/72/90/60/1044729060.db2.gz UDPIWAGWJYBWCZ-UHFFFAOYSA-N -1 1 321.311 4.105 20 0 DIADMM [O-]c1ccc(-c2noc(-c3csc4ccccc34)n2)cc1F ZINC000445479963 1044729146 /nfs/dbraw/zinc/72/91/46/1044729146.db2.gz XJZWDIGEZYKVPP-UHFFFAOYSA-N -1 1 312.325 4.463 20 0 DIADMM C[C@@H](c1cc2ccccc2o1)c1nc(-c2ccc([O-])c(F)c2)no1 ZINC000445484038 1044732399 /nfs/dbraw/zinc/73/23/99/1044732399.db2.gz UTOCHCOYFCQOII-JTQLQIEISA-N -1 1 324.311 4.479 20 0 DIADMM C[C@H](c1nc(-c2ccc([O-])c(F)c2)no1)c1c(F)cccc1F ZINC000445474696 1044735184 /nfs/dbraw/zinc/73/51/84/1044735184.db2.gz RGCZGAJSOSMITM-QMMMGPOBSA-N -1 1 320.270 4.011 20 0 DIADMM O=C(c1c(F)ccc([O-])c1F)N1CCCC2(CCCCC2)CC1 ZINC000572325064 1044854989 /nfs/dbraw/zinc/85/49/89/1044854989.db2.gz SCLDGAWRQSNJSD-UHFFFAOYSA-N -1 1 323.383 4.247 20 0 DIADMM CCOc1ncc(Nc2c(Cl)ccc([O-])c2Cl)cc1F ZINC001212832388 1044926721 /nfs/dbraw/zinc/92/67/21/1044926721.db2.gz RGYLEQGPQQBKRX-UHFFFAOYSA-N -1 1 317.147 4.375 20 0 DIADMM CCOc1ncc(Nc2ccc(Cl)c(Cl)c2[O-])cc1F ZINC001212833242 1044929546 /nfs/dbraw/zinc/92/95/46/1044929546.db2.gz OWYQIXXTRSBAHU-UHFFFAOYSA-N -1 1 317.147 4.375 20 0 DIADMM Cc1ccsc1[C@@H]1C[C@H]1C(=O)Nc1ccc([O-])c(Cl)c1 ZINC000153640679 1045059941 /nfs/dbraw/zinc/05/99/41/1045059941.db2.gz YAXZGUWEMBSTIS-GHMZBOCLSA-N -1 1 307.802 4.158 20 0 DIADMM Cc1ccsc1[C@@H]1C[C@@H]1C(=O)Nc1ccc([O-])c(Cl)c1 ZINC000153640474 1045060349 /nfs/dbraw/zinc/06/03/49/1045060349.db2.gz YAXZGUWEMBSTIS-MNOVXSKESA-N -1 1 307.802 4.158 20 0 DIADMM CCc1cc(=O)[n-]c(SCc2ccc(C3CCC3)cc2)n1 ZINC000447310709 1045116433 /nfs/dbraw/zinc/11/64/33/1045116433.db2.gz ZPWFMPDPABKPJG-UHFFFAOYSA-N -1 1 300.427 4.304 20 0 DIADMM CC(C)c1ccc(OCC(=O)Nc2ccc([O-])c(Cl)c2)cc1 ZINC000601052627 1045179691 /nfs/dbraw/zinc/17/96/91/1045179691.db2.gz OABAHADQGKZFHY-UHFFFAOYSA-N -1 1 319.788 4.187 20 0 DIADMM C[C@@H](C(=O)[O-])[C@H](NCc1ccc(Cl)cc1F)c1ccccc1 ZINC000426747153 1045456782 /nfs/dbraw/zinc/45/67/82/1045456782.db2.gz NGIWESWMMRYITD-BZNIZROVSA-N -1 1 321.779 4.031 20 0 DIADMM C/C(=C/c1ccc(F)cc1)C(=O)Nc1ccc([O-])c(Cl)c1 ZINC000750306238 1045518409 /nfs/dbraw/zinc/51/84/09/1045518409.db2.gz XILBTYFGSNDQHW-NTMALXAHSA-N -1 1 305.736 4.227 20 0 DIADMM O=C(Nc1ccc(Nc2ccccc2)cc1)c1ccccc1[O-] ZINC000021007011 1045583311 /nfs/dbraw/zinc/58/33/11/1045583311.db2.gz HSRVSHOLQZXPIY-UHFFFAOYSA-N -1 1 304.349 4.388 20 0 DIADMM C[C@@H]1[C@H](c2ccccc2)CCN1C(=O)c1c([O-])cccc1Cl ZINC000751426306 1045605206 /nfs/dbraw/zinc/60/52/06/1045605206.db2.gz QHCVTOGZCNXMRS-TZMCWYRMSA-N -1 1 315.800 4.064 20 0 DIADMM Cc1cccc(C([N-]C(=O)C(F)(F)F)c2cccc(C)c2)c1 ZINC000752768955 1045703312 /nfs/dbraw/zinc/70/33/12/1045703312.db2.gz SZEFURYRNZOYIU-UHFFFAOYSA-N -1 1 307.315 4.071 20 0 DIADMM Cc1nc(S[C@H]2CCc3ccc(F)cc32)[n-]c(=O)c1C1CC1 ZINC000631024751 1045797735 /nfs/dbraw/zinc/79/77/35/1045797735.db2.gz ZGPAMRZYECQECJ-AWEZNQCLSA-N -1 1 316.401 4.287 20 0 DIADMM Cc1nc(S[C@H](C)c2ccc(F)cc2)[n-]c(=O)c1C1CC1 ZINC000631024122 1045797770 /nfs/dbraw/zinc/79/77/70/1045797770.db2.gz LMQHZOHBPZMGTO-SNVBAGLBSA-N -1 1 304.390 4.360 20 0 DIADMM Cc1nc(SCCO[C@@H]2CCCC[C@H]2C)[n-]c(=O)c1C1CC1 ZINC000631024576 1045797801 /nfs/dbraw/zinc/79/78/01/1045797801.db2.gz BVIRFCQFZDTNFW-BXUZGUMPSA-N -1 1 322.474 4.055 20 0 DIADMM CCCCC[C@H](NCc1ccc(-c2ccc(C)cc2)o1)C(=O)[O-] ZINC000901725585 1045797811 /nfs/dbraw/zinc/79/78/11/1045797811.db2.gz XBKPHEPNGVRQFM-KRWDZBQOSA-N -1 1 315.413 4.378 20 0 DIADMM CC[C@H](CSc1nc(C)c(C2CC2)c(=O)[n-]1)CC(F)F ZINC000631023823 1045798380 /nfs/dbraw/zinc/79/83/80/1045798380.db2.gz YNHTVNSDIGXQSC-VIFPVBQESA-N -1 1 302.390 4.142 20 0 DIADMM Cc1nc(S[C@@H](C)c2cc(F)ccc2F)[n-]c(=O)c1C1CC1 ZINC000631024236 1045798616 /nfs/dbraw/zinc/79/86/16/1045798616.db2.gz PPUCMKRHWSPQSP-VIFPVBQESA-N -1 1 322.380 4.500 20 0 DIADMM Cc1cc(Cl)ncc1NC(=O)c1ccc(C(C)C)cc1[O-] ZINC001137542900 1045889029 /nfs/dbraw/zinc/88/90/29/1045889029.db2.gz ADASGWDLHPCBDY-UHFFFAOYSA-N -1 1 304.777 4.125 20 0 DIADMM CCc1oc(CN[C@@H](CC(C)C)c2ccccc2)cc1C(=O)[O-] ZINC000902072767 1045905026 /nfs/dbraw/zinc/90/50/26/1045905026.db2.gz UVCDVAIMPQQYRI-KRWDZBQOSA-N -1 1 315.413 4.417 20 0 DIADMM Cc1ccc(NC(=O)Nc2cc(F)c(F)cc2[O-])cc1Cl ZINC001202807888 1045906687 /nfs/dbraw/zinc/90/66/87/1045906687.db2.gz SNCGJPWOSWLUON-UHFFFAOYSA-N -1 1 312.703 4.276 20 0 DIADMM CCCc1ccc(NC(=O)c2cc(Cl)c([O-])c(OC)c2)cc1 ZINC000802146204 1045907863 /nfs/dbraw/zinc/90/78/63/1045907863.db2.gz PQDXNTZUVIAAMP-UHFFFAOYSA-N -1 1 319.788 4.259 20 0 DIADMM CCc1oc(CN[C@@H](CC)c2cccc(Cl)c2)cc1C(=O)[O-] ZINC000902109727 1045915766 /nfs/dbraw/zinc/91/57/66/1045915766.db2.gz UGUWVIMYVONYPE-HNNXBMFYSA-N -1 1 321.804 4.435 20 0 DIADMM CCc1oc(CN[C@@H](c2ccccc2)C(C)(C)C)cc1C(=O)[O-] ZINC000902123902 1045917981 /nfs/dbraw/zinc/91/79/81/1045917981.db2.gz SDFQYFVFWHASLA-KRWDZBQOSA-N -1 1 315.413 4.417 20 0 DIADMM C[C@@H](C(=O)[N-]OCc1ccc(F)cc1)c1ccc2ccccc2c1 ZINC000754714249 1045918216 /nfs/dbraw/zinc/91/82/16/1045918216.db2.gz OIWXJQVOWQYCNK-CQSZACIVSA-N -1 1 323.367 4.330 20 0 DIADMM CSc1cc(O)ccc1NC(=O)c1ccc(C(C)C)cc1[O-] ZINC000754732821 1045920977 /nfs/dbraw/zinc/92/09/77/1045920977.db2.gz SPACFMZURPBGCT-UHFFFAOYSA-N -1 1 317.410 4.195 20 0 DIADMM CCSc1ccc([C@H](C)NCc2cc(C(=O)[O-])c(C)o2)cc1 ZINC000902222339 1045949697 /nfs/dbraw/zinc/94/96/97/1045949697.db2.gz ZOEQPKIJBAPSQK-NSHDSACASA-N -1 1 319.426 4.249 20 0 DIADMM Cc1oc(CN[C@@H]2CCCc3ccc(Cl)cc32)cc1C(=O)[O-] ZINC000902262392 1045959199 /nfs/dbraw/zinc/95/91/99/1045959199.db2.gz WHAGFYLOTYOTIL-MRXNPFEDSA-N -1 1 319.788 4.107 20 0 DIADMM CCOc1cc(-c2noc([C@@H]3C[C@H]3CC)n2)cc(Cl)c1[O-] ZINC000453164863 1045963985 /nfs/dbraw/zinc/96/39/85/1045963985.db2.gz OPWOIDRGAPNDLG-PSASIEDQSA-N -1 1 308.765 4.008 20 0 DIADMM Cc1cc(CNC2(c3cccc(Cl)c3)CCC2)oc1C(=O)[O-] ZINC000902371530 1045986667 /nfs/dbraw/zinc/98/66/67/1045986667.db2.gz BQZYULHILXORSA-UHFFFAOYSA-N -1 1 319.788 4.109 20 0 DIADMM CCc1oc(CN[C@H](C)c2ccc(SC)cc2)cc1C(=O)[O-] ZINC000902379472 1045986683 /nfs/dbraw/zinc/98/66/83/1045986683.db2.gz FBFHQIYYNBKPIE-LLVKDONJSA-N -1 1 319.426 4.113 20 0 DIADMM CCc1oc(CN[C@@H](c2ccccc2F)C(C)C)cc1C(=O)[O-] ZINC000902382701 1045988967 /nfs/dbraw/zinc/98/89/67/1045988967.db2.gz SZHDCNWWKBWLHR-QGZVFWFLSA-N -1 1 319.376 4.166 20 0 DIADMM CCSCc1cccc([N-]S(=O)(=O)c2cccc(C)c2)c1 ZINC000610193766 1046142111 /nfs/dbraw/zinc/14/21/11/1046142111.db2.gz HEHBEMJWOCHBJH-UHFFFAOYSA-N -1 1 321.467 4.049 20 0 DIADMM C[C@H](OC(=O)c1ccc(Cl)c(Cl)c1[O-])c1ccncc1 ZINC000757714974 1046206320 /nfs/dbraw/zinc/20/63/20/1046206320.db2.gz KBBQJFRSXPLQJC-QMMMGPOBSA-N -1 1 312.152 4.012 20 0 DIADMM C[C@H](O[N-]C(=O)CCC1CCCCC1)c1ncc(C(C)(C)C)o1 ZINC000089126802 1046252795 /nfs/dbraw/zinc/25/27/95/1046252795.db2.gz AHGOOBRKSWGLRD-ZDUSSCGKSA-N -1 1 322.449 4.441 20 0 DIADMM CCc1ccc([N-]S(=O)(=O)c2ccc(C)cc2Cl)cc1 ZINC000025365803 1046268221 /nfs/dbraw/zinc/26/82/21/1046268221.db2.gz IZQPEEDFYCKITM-UHFFFAOYSA-N -1 1 309.818 4.012 20 0 DIADMM CN(CCC1(C(=O)[O-])CCC1)Cc1c(Cl)cccc1Cl ZINC000903696661 1046305811 /nfs/dbraw/zinc/30/58/11/1046305811.db2.gz LBWIEBRNMPITJC-UHFFFAOYSA-N -1 1 316.228 4.070 20 0 DIADMM CCOc1ccc(NC(=O)Nc2cc([O-])c(Cl)cc2F)cc1 ZINC001202908467 1046412480 /nfs/dbraw/zinc/41/24/80/1046412480.db2.gz CNBRDWNGNZJIHD-UHFFFAOYSA-N -1 1 324.739 4.227 20 0 DIADMM CC(C)c1ccc(NC(=O)Nc2cc([O-])c(F)cc2F)cc1 ZINC001202924062 1046428732 /nfs/dbraw/zinc/42/87/32/1046428732.db2.gz AJXQKUZIOWKHAI-UHFFFAOYSA-N -1 1 306.312 4.438 20 0 DIADMM C[C@H](Cc1ccccc1Cl)C(=O)Nc1c([O-])cccc1F ZINC000677204111 1046473465 /nfs/dbraw/zinc/47/34/65/1046473465.db2.gz DCRIPGHLJWTWGS-SNVBAGLBSA-N -1 1 307.752 4.002 20 0 DIADMM C[C@H]1C[C@@H](CCNC(=O)c2ccc(F)c([O-])c2)CC(C)(C)C1 ZINC001139605848 1046485189 /nfs/dbraw/zinc/48/51/89/1046485189.db2.gz SGLFLDLOMMDIIA-QWHCGFSZSA-N -1 1 307.409 4.114 20 0 DIADMM C[C@H](CC(=O)Nc1c([O-])cccc1F)Cc1ccc(Cl)cc1 ZINC000678574623 1046661600 /nfs/dbraw/zinc/66/16/00/1046661600.db2.gz OCMBVQUMQAOXHE-NSHDSACASA-N -1 1 321.779 4.392 20 0 DIADMM O=c1oc2cc([O-])ccc2cc1Nc1cccc(Cl)c1F ZINC001203034653 1046710093 /nfs/dbraw/zinc/71/00/93/1046710093.db2.gz VRFNSACMLOYMHG-UHFFFAOYSA-N -1 1 305.692 4.035 20 0 DIADMM [O-]c1cccc(CNCc2ccc(Cl)cc2F)c1Cl ZINC000645172533 1046775938 /nfs/dbraw/zinc/77/59/38/1046775938.db2.gz ISQJMZUDRINBBX-UHFFFAOYSA-N -1 1 300.160 4.128 20 0 DIADMM Cn1nc(C2CCCC2)cc1NCc1cccc([O-])c1Cl ZINC000645171913 1046776898 /nfs/dbraw/zinc/77/68/98/1046776898.db2.gz ONIYUIFXEAWAQK-UHFFFAOYSA-N -1 1 305.809 4.049 20 0 DIADMM CC/C(=C/C(=O)Nc1ccc([O-])c(F)c1F)c1ccc(C)cc1 ZINC001140652296 1046835125 /nfs/dbraw/zinc/83/51/25/1046835125.db2.gz ITWFBDCIIBKGPF-BENRWUELSA-N -1 1 317.335 4.411 20 0 DIADMM O=C(CCCCc1ccccc1)Nc1ccc([O-])c(F)c1F ZINC001140656793 1046839815 /nfs/dbraw/zinc/83/98/15/1046839815.db2.gz CFXYTWIEKZRLGS-UHFFFAOYSA-N -1 1 305.324 4.022 20 0 DIADMM [O-]c1c(Cl)cc(CN2CC[C@@H](c3ccncc3)C2)cc1Cl ZINC001140834666 1046922704 /nfs/dbraw/zinc/92/27/04/1046922704.db2.gz USFJJWSMCFGPSR-CYBMUJFWSA-N -1 1 323.223 4.084 20 0 DIADMM [O-]c1c(Cl)cc(CN2CC[C@H](c3ccccn3)C2)cc1Cl ZINC001140834531 1046923336 /nfs/dbraw/zinc/92/33/36/1046923336.db2.gz OQKUTUDGZMRNHV-LBPRGKRZSA-N -1 1 323.223 4.084 20 0 DIADMM [O-]c1c(F)cc(CN2CCC[C@@H]2c2cccc(F)c2)cc1F ZINC001140990906 1046971620 /nfs/dbraw/zinc/97/16/20/1046971620.db2.gz CHEARPHIVWBBLR-MRXNPFEDSA-N -1 1 307.315 4.147 20 0 DIADMM Cc1cc(S(=O)(=O)[N-]c2ccc(C3CC3)cc2)c(C)s1 ZINC000678478836 1046982098 /nfs/dbraw/zinc/98/20/98/1046982098.db2.gz LJONTNVIYUKYFU-UHFFFAOYSA-N -1 1 307.440 4.043 20 0 DIADMM CSc1ccccc1[C@H](C)NC(=O)c1c([O-])cccc1Cl ZINC000799741410 1047060270 /nfs/dbraw/zinc/06/02/70/1047060270.db2.gz NBSMHUURUPIOEE-JTQLQIEISA-N -1 1 321.829 4.259 20 0 DIADMM CC(C)C[C@@H](NC(=O)c1cccc([O-])c1F)c1ccccc1 ZINC001141246643 1047063505 /nfs/dbraw/zinc/06/35/05/1047063505.db2.gz UHHRWYFTDDSXCN-OAHLLOKOSA-N -1 1 301.361 4.049 20 0 DIADMM CCN(Cc1ccc2ccccc2c1)C(=O)c1ccc([O-])c(F)c1 ZINC000681017074 1047081836 /nfs/dbraw/zinc/08/18/36/1047081836.db2.gz FZHJPGVFAUQJRM-UHFFFAOYSA-N -1 1 323.367 4.347 20 0 DIADMM C[C@H](c1cc2ccccc2o1)N(C)C(=O)c1ccc([O-])c(F)c1 ZINC000681016710 1047082870 /nfs/dbraw/zinc/08/28/70/1047082870.db2.gz BANZQBMGDRBMSR-LLVKDONJSA-N -1 1 313.328 4.111 20 0 DIADMM O=C(c1ccc([O-])c(F)c1)N1CCC[C@@H]1c1ccc(Cl)cc1 ZINC000681017036 1047083305 /nfs/dbraw/zinc/08/33/05/1047083305.db2.gz CIGQUVTVRTVOEV-OAHLLOKOSA-N -1 1 319.763 4.162 20 0 DIADMM O=C(c1ccc([O-])c(F)c1)N1CCC[C@H]1c1ccc(Cl)cc1 ZINC000681017035 1047083551 /nfs/dbraw/zinc/08/35/51/1047083551.db2.gz CIGQUVTVRTVOEV-HNNXBMFYSA-N -1 1 319.763 4.162 20 0 DIADMM CC(C)C[C@@H](NC(=O)c1ccc([O-])c(F)c1)c1cccs1 ZINC000681022178 1047084227 /nfs/dbraw/zinc/08/42/27/1047084227.db2.gz WJMXEIUOHBCQPA-CYBMUJFWSA-N -1 1 307.390 4.110 20 0 DIADMM CC(C)C[C@H](NC(=O)c1ccc([O-])c(F)c1)c1cccs1 ZINC000681022179 1047085284 /nfs/dbraw/zinc/08/52/84/1047085284.db2.gz WJMXEIUOHBCQPA-ZDUSSCGKSA-N -1 1 307.390 4.110 20 0 DIADMM C[C@H](CC(C)(C)c1ccccc1)NC(=O)c1ccc([O-])c(F)c1 ZINC000681025843 1047085634 /nfs/dbraw/zinc/08/56/34/1047085634.db2.gz SWVSRJRWJJBZPV-CYBMUJFWSA-N -1 1 315.388 4.018 20 0 DIADMM CC(C)N(Cc1cccc(Cl)c1)C(=O)c1ccc([O-])c(F)c1 ZINC000681046757 1047087001 /nfs/dbraw/zinc/08/70/01/1047087001.db2.gz QWRQRSCYEPYTKO-UHFFFAOYSA-N -1 1 321.779 4.236 20 0 DIADMM O=C(c1ccc([O-])c(F)c1)N1CCC[C@H]1CCC1CCCC1 ZINC000681057730 1047089078 /nfs/dbraw/zinc/08/90/78/1047089078.db2.gz VCYJCBCXXRETMZ-HNNXBMFYSA-N -1 1 305.393 4.106 20 0 DIADMM CCCCc1oc2ccccc2c1C=C1SC(=S)[N-]C1=O ZINC000008446246 1047091184 /nfs/dbraw/zinc/09/11/84/1047091184.db2.gz WCYMDQWTEVQWSV-ZROIWOOFSA-N -1 1 317.435 4.264 20 0 DIADMM CSc1cccc(C)c1[N-]C(=O)c1c(C)noc1C(F)F ZINC000681153424 1047103907 /nfs/dbraw/zinc/10/39/07/1047103907.db2.gz SPQNNCAYVBOBIC-UHFFFAOYSA-N -1 1 312.341 4.203 20 0 DIADMM O=C(c1ccc([O-])c(F)c1)N1CC2(CC=CC2)[C@H]1c1ccccc1 ZINC000649154417 1047112625 /nfs/dbraw/zinc/11/26/25/1047112625.db2.gz NPBFASUYIVJLCU-GOSISDBHSA-N -1 1 323.367 4.065 20 0 DIADMM CSc1ccc(Cl)cc1[N-]C(=O)c1coc(C2CC2)n1 ZINC000681592348 1047131652 /nfs/dbraw/zinc/13/16/52/1047131652.db2.gz CPMFBSAMXOURJE-UHFFFAOYSA-N -1 1 308.790 4.180 20 0 DIADMM CCCC[C@H](CC)CNC(=O)c1c([O-])cnc2c(F)cccc21 ZINC001141455087 1047136462 /nfs/dbraw/zinc/13/64/62/1047136462.db2.gz CDCPVICRRIEBIG-LBPRGKRZSA-N -1 1 318.392 4.026 20 0 DIADMM CCc1ccc(N(CC)C(=O)Cc2ccc([O-])c(Cl)c2)cc1 ZINC001141472416 1047143965 /nfs/dbraw/zinc/14/39/65/1047143965.db2.gz OCSKKJHKVBIJQJ-UHFFFAOYSA-N -1 1 317.816 4.204 20 0 DIADMM CCc1cccc(S(=O)(=O)[N-]c2cc(SC)ccc2C)c1 ZINC000537197892 1047147326 /nfs/dbraw/zinc/14/73/26/1047147326.db2.gz JOZBEMQTJXZCMC-UHFFFAOYSA-N -1 1 321.467 4.080 20 0 DIADMM CCOc1cc(-c2noc(/C=C(/C)C3CC3)n2)cc(Cl)c1[O-] ZINC000445420195 1047149306 /nfs/dbraw/zinc/14/93/06/1047149306.db2.gz ASMUTTXFCINUEY-TWGQIWQCSA-N -1 1 320.776 4.308 20 0 DIADMM O=C(Nc1ccc([O-])c(Cl)c1)C1(Sc2ccccc2)CC1 ZINC001116514706 1047151409 /nfs/dbraw/zinc/15/14/09/1047151409.db2.gz MPXLQNCGARSUPK-UHFFFAOYSA-N -1 1 319.813 4.309 20 0 DIADMM CSc1ccccc1S(=O)(=O)[N-]c1ccc(C2CC2)cc1 ZINC000681963997 1047155866 /nfs/dbraw/zinc/15/58/66/1047155866.db2.gz CYXYOLJWJVYMQW-UHFFFAOYSA-N -1 1 319.451 4.087 20 0 DIADMM CC(C)(CC(F)(F)F)NC(=O)c1cc2ccccc2cc1[O-] ZINC000682019547 1047162471 /nfs/dbraw/zinc/16/24/71/1047162471.db2.gz KNOMBCLBQHVDNX-UHFFFAOYSA-N -1 1 311.303 4.006 20 0 DIADMM Cc1ccc(Cl)cc1S(=O)(=O)[N-]c1c(C)cccc1C ZINC000031666154 1047188914 /nfs/dbraw/zinc/18/89/14/1047188914.db2.gz OJFXODIIWODNFR-UHFFFAOYSA-N -1 1 309.818 4.066 20 0 DIADMM CCCc1ccccc1[N-]S(=O)(=O)c1cc(C)sc1C ZINC000032098461 1047206135 /nfs/dbraw/zinc/20/61/35/1047206135.db2.gz XIEGGEHRDNRWHT-UHFFFAOYSA-N -1 1 309.456 4.118 20 0 DIADMM C[C@H](c1ccccc1)N(C(=O)c1c([O-])cccc1Cl)C1CC1 ZINC001117256443 1047221638 /nfs/dbraw/zinc/22/16/38/1047221638.db2.gz RRGOGIFAISNCOQ-GFCCVEGCSA-N -1 1 315.800 4.411 20 0 DIADMM CC(C)C[C@H](C(=O)Nc1cc([O-])c(F)cc1F)c1ccccc1 ZINC001141833825 1047296579 /nfs/dbraw/zinc/29/65/79/1047296579.db2.gz NDNOECPOTVHLCI-ZDUSSCGKSA-N -1 1 319.351 4.439 20 0 DIADMM CC1(C)Oc2ccc(NCc3cccc([O-])c3Cl)cc2O1 ZINC000393225948 1047307262 /nfs/dbraw/zinc/30/72/62/1047307262.db2.gz HVLKGRAYZNBQCE-UHFFFAOYSA-N -1 1 305.761 4.165 20 0 DIADMM CCC[C@H](C(=O)Nc1cc(F)cc(F)c1[O-])c1ccccc1 ZINC001142537368 1047321926 /nfs/dbraw/zinc/32/19/26/1047321926.db2.gz JITNLUMCNQUTMD-ZDUSSCGKSA-N -1 1 305.324 4.193 20 0 DIADMM CC(C)Cc1ccc(C(=O)Nc2cc(F)cc(F)c2[O-])cc1 ZINC001142537768 1047323717 /nfs/dbraw/zinc/32/37/17/1047323717.db2.gz SKOVTHNWWWQQKQ-UHFFFAOYSA-N -1 1 305.324 4.121 20 0 DIADMM CC(C)(C)C[C@H]1CCN(C(=O)c2ccc(F)c([O-])c2)C1(C)C ZINC001142066681 1047368151 /nfs/dbraw/zinc/36/81/51/1047368151.db2.gz WDARKSDAFYMTBV-CYBMUJFWSA-N -1 1 307.409 4.208 20 0 DIADMM CCCCCCO[C@H](C)c1nc(-c2ccc([O-])c(F)c2)no1 ZINC000842497017 1047486273 /nfs/dbraw/zinc/48/62/73/1047486273.db2.gz KHEKIIFMFZVOOI-LLVKDONJSA-N -1 1 308.353 4.239 20 0 DIADMM CC(C)(C)[C@@H]1CCCC[C@H]1CNC(=O)c1cccc([O-])c1F ZINC001142870728 1047507215 /nfs/dbraw/zinc/50/72/15/1047507215.db2.gz QIENZGGXOZENEB-GXTWGEPZSA-N -1 1 307.409 4.114 20 0 DIADMM O=C(c1ccc2ccccc2c1[O-])N1CC[C@H](c2ccccc2)C1 ZINC000121539787 1047521668 /nfs/dbraw/zinc/52/16/68/1047521668.db2.gz YZRKNLPAIWFFNU-KRWDZBQOSA-N -1 1 317.388 4.175 20 0 DIADMM O=C(c1ccc2cccnc2c1[O-])N1CCC[C@@H]1C1CCCCC1 ZINC001149320115 1047560085 /nfs/dbraw/zinc/56/00/85/1047560085.db2.gz IHIMYPJOXJSQAR-QGZVFWFLSA-N -1 1 324.424 4.125 20 0 DIADMM CC(C)(NC(=O)c1cccc([O-])c1F)c1ccc2ccccc2c1 ZINC001149985725 1047572511 /nfs/dbraw/zinc/57/25/11/1047572511.db2.gz GELBHMTVNXPNHK-UHFFFAOYSA-N -1 1 323.367 4.350 20 0 DIADMM Cc1cc(F)cc(NC(=O)c2ccc(C(F)(F)F)c([O-])c2)c1 ZINC001150022721 1047573466 /nfs/dbraw/zinc/57/34/66/1047573466.db2.gz PWJOLSFGBCRYFT-UHFFFAOYSA-N -1 1 313.250 4.111 20 0 DIADMM Cc1ccc(Cl)c(NC(=O)Cc2ccc([O-])c(Cl)c2)c1 ZINC001150439301 1047577472 /nfs/dbraw/zinc/57/74/72/1047577472.db2.gz OGEDZEJBQYQOAS-UHFFFAOYSA-N -1 1 310.180 4.189 20 0 DIADMM CC(C)(C)c1cc2cccnc2c(NC(=O)c2ccccc2[O-])c1 ZINC001150841497 1047586182 /nfs/dbraw/zinc/58/61/82/1047586182.db2.gz ILQRWTSVAKFKOO-UHFFFAOYSA-N -1 1 320.392 4.490 20 0 DIADMM O=C(N[C@@H]1CCC[C@@H]1c1ccccc1)c1c([O-])cccc1Cl ZINC001151517821 1047596870 /nfs/dbraw/zinc/59/68/70/1047596870.db2.gz IXYUSXIZGOHIHO-UKRRQHHQSA-N -1 1 315.800 4.112 20 0 DIADMM C[C@@H]1CCc2sc(C(=O)Nc3ccc([O-])c(Cl)c3)cc2C1 ZINC001151583317 1047598830 /nfs/dbraw/zinc/59/88/30/1047598830.db2.gz XGVGFCMWKVPSPD-SECBINFHSA-N -1 1 321.829 4.484 20 0 DIADMM CC(C)Sc1ccc(C(=O)Nc2cccc(F)c2[O-])cc1 ZINC001151773085 1047601838 /nfs/dbraw/zinc/60/18/38/1047601838.db2.gz YBTYDHUXXPVULM-UHFFFAOYSA-N -1 1 305.374 4.284 20 0 DIADMM Cc1cc2occ(CC(=O)Nc3cccc(F)c3[O-])c2cc1C ZINC001151771290 1047601868 /nfs/dbraw/zinc/60/18/68/1047601868.db2.gz GCDWJSBBUUOYIZ-UHFFFAOYSA-N -1 1 313.328 4.076 20 0 DIADMM Cc1cc(C)c2cc(C(=O)Nc3cccc(F)c3[O-])sc2n1 ZINC001151779519 1047601956 /nfs/dbraw/zinc/60/19/56/1047601956.db2.gz FJBUFCIGTXFKHH-UHFFFAOYSA-N -1 1 316.357 4.010 20 0 DIADMM CCC(F)(F)c1ccccc1NC(=O)c1ccc(F)c([O-])c1 ZINC001152363813 1047610979 /nfs/dbraw/zinc/61/09/79/1047610979.db2.gz DNLKNXDKEWYVTL-UHFFFAOYSA-N -1 1 309.287 4.285 20 0 DIADMM CC(C)c1cccnc1NC(=O)c1c([O-])ccc2ccccc21 ZINC001153499336 1047625827 /nfs/dbraw/zinc/62/58/27/1047625827.db2.gz RWLNDTYLRKATDT-UHFFFAOYSA-N -1 1 306.365 4.316 20 0 DIADMM O=C(Nc1cnc(C2CC2)s1)c1c([O-])ccc2ccccc21 ZINC001153498419 1047626066 /nfs/dbraw/zinc/62/60/66/1047626066.db2.gz DTRCBBQZYKTGLX-UHFFFAOYSA-N -1 1 310.378 4.132 20 0 DIADMM Cc1cc(NC(=O)c2c([O-])ccc3ccccc32)n(C2CCC2)n1 ZINC001153498363 1047626354 /nfs/dbraw/zinc/62/63/54/1047626354.db2.gz CTKVSSZEVGNBAO-UHFFFAOYSA-N -1 1 321.380 4.028 20 0 DIADMM O=C(Nc1cccc2cc[nH]c21)c1c([O-])ccc2ccccc21 ZINC001153505539 1047627125 /nfs/dbraw/zinc/62/71/25/1047627125.db2.gz YTBYMNISOGXFDM-UHFFFAOYSA-N -1 1 302.333 4.279 20 0 DIADMM Cc1c2ccccc2oc1[C@@H](C)NC(=O)c1cccc([O-])c1F ZINC001154217485 1047643347 /nfs/dbraw/zinc/64/33/47/1047643347.db2.gz UJPNUSZEGKLSLC-LLVKDONJSA-N -1 1 313.328 4.077 20 0 DIADMM CC(C)Cc1ccc([C@H](C)C(=O)[N-]OC2CCCCC2)cc1 ZINC001155048351 1047665957 /nfs/dbraw/zinc/66/59/57/1047665957.db2.gz SRPPUDYZQWVCOT-HNNXBMFYSA-N -1 1 303.446 4.369 20 0 DIADMM Cc1ccc2ccc(C(=O)Nc3ncccc3C(C)C)c([O-])c2n1 ZINC001155654295 1047685926 /nfs/dbraw/zinc/68/59/26/1047685926.db2.gz UMVFAKSVVXVVNW-UHFFFAOYSA-N -1 1 321.380 4.020 20 0 DIADMM C[C@H]1C[C@@H](c2ccccc2)N(C(=O)c2c([O-])cccc2Cl)C1 ZINC001157232105 1047737480 /nfs/dbraw/zinc/73/74/80/1047737480.db2.gz KPUMTGLPRYVPSF-WFASDCNBSA-N -1 1 315.800 4.269 20 0 DIADMM O=C(NCC1CCCCCC1)c1ccc(C(F)(F)F)cc1[O-] ZINC001158161479 1047770918 /nfs/dbraw/zinc/77/09/18/1047770918.db2.gz OKXWFBSFSASBFR-UHFFFAOYSA-N -1 1 315.335 4.111 20 0 DIADMM CC[C@@H]1c2ccccc2CN1C(=O)c1c([O-])cccc1Cl ZINC001158652111 1047792805 /nfs/dbraw/zinc/79/28/05/1047792805.db2.gz HQCFOKCMLDUUES-CQSZACIVSA-N -1 1 301.773 4.153 20 0 DIADMM Cc1cc(-c2nc(=O)c3c(C)c(-c4ccccc4)sc3[n-]2)no1 ZINC000479153503 1047842022 /nfs/dbraw/zinc/84/20/22/1047842022.db2.gz CBGNFIYYTVFALA-UHFFFAOYSA-N -1 1 323.377 4.336 20 0 DIADMM O=C([O-])c1ccc(Nc2cccc3[nH]ncc32)cc1C(F)(F)F ZINC001159575300 1047872945 /nfs/dbraw/zinc/87/29/45/1047872945.db2.gz VSCORWLHXPPTQQ-UHFFFAOYSA-N -1 1 321.258 4.024 20 0 DIADMM CC(C)Cc1cccc([C@H](C)C(=O)Nc2ccc(F)cc2[O-])c1 ZINC001183053932 1047884492 /nfs/dbraw/zinc/88/44/92/1047884492.db2.gz AFMBHPRZIATIBN-ZDUSSCGKSA-N -1 1 315.388 4.472 20 0 DIADMM Cc1cc2c(CC(=O)Nc3ccc(F)cc3[O-])csc2s1 ZINC001183053930 1047885103 /nfs/dbraw/zinc/88/51/03/1047885103.db2.gz ABTACRNDFJBPLP-UHFFFAOYSA-N -1 1 321.398 4.297 20 0 DIADMM CC(C)(O)c1cncc(Nc2cc(Cl)cc(Cl)c2[O-])c1 ZINC001174591532 1047898889 /nfs/dbraw/zinc/89/88/89/1047898889.db2.gz QISGHEFSOSWKEM-UHFFFAOYSA-N -1 1 313.184 4.065 20 0 DIADMM Cn1c2cc(Cl)ccc2nc1-c1cc(F)c(Cl)cc1[O-] ZINC001251680820 1047916824 /nfs/dbraw/zinc/91/68/24/1047916824.db2.gz INGVFTLEZOGWNI-UHFFFAOYSA-N -1 1 311.143 4.392 20 0 DIADMM CCO[C@@H](C)n1cc(Nc2ccc(Cl)c(Cl)c2[O-])cn1 ZINC001174701479 1047945348 /nfs/dbraw/zinc/94/53/48/1047945348.db2.gz JXOLEBJHWLMZTI-QMMMGPOBSA-N -1 1 316.188 4.194 20 0 DIADMM CC(C)c1ccc([N-]S(=O)(=O)c2ccc3occc3c2)cc1 ZINC001198816433 1048009094 /nfs/dbraw/zinc/00/90/94/1048009094.db2.gz JWFDTLNSBDGIGN-UHFFFAOYSA-N -1 1 315.394 4.357 20 0 DIADMM Cc1ccc([N-]S(=O)(=O)c2ccc3occc3c2)cc1Cl ZINC001198816421 1048010571 /nfs/dbraw/zinc/01/05/71/1048010571.db2.gz JLIGTIBODVHBLZ-UHFFFAOYSA-N -1 1 321.785 4.195 20 0 DIADMM CCc1cccc(C)c1[N-]S(=O)(=O)c1ccc2occc2c1 ZINC001198858932 1048011677 /nfs/dbraw/zinc/01/16/77/1048011677.db2.gz MCKDNPZYSDQGIP-UHFFFAOYSA-N -1 1 315.394 4.104 20 0 DIADMM [O-]c1c(Nc2ccc(OC(F)(F)F)c(F)c2)ccc(F)c1F ZINC001213022008 1048024680 /nfs/dbraw/zinc/02/46/80/1048024680.db2.gz OJQLDXPQHYJEJH-UHFFFAOYSA-N -1 1 323.192 4.452 20 0 DIADMM O=c1ccoc2ccc(Nc3cc([O-])c(Cl)cc3F)cc12 ZINC001174946675 1048042496 /nfs/dbraw/zinc/04/24/96/1048042496.db2.gz VFAAUGGKEZOBDH-UHFFFAOYSA-N -1 1 305.692 4.035 20 0 DIADMM C[C@H]1CCC[C@@H](C(=O)Nc2cccc(C(F)(F)F)c2[O-])C1 ZINC001184512505 1048054113 /nfs/dbraw/zinc/05/41/13/1048054113.db2.gz ODDBDNBRFWCTHP-VHSXEESVSA-N -1 1 301.308 4.176 20 0 DIADMM CCOc1cc(F)c(Nc2ccc(F)c(F)c2[O-])cc1F ZINC001175057717 1048084801 /nfs/dbraw/zinc/08/48/01/1048084801.db2.gz FPVOBYUMCXFMEQ-UHFFFAOYSA-N -1 1 301.239 4.091 20 0 DIADMM COc1cc(Nc2c(Cl)ccc([O-])c2Cl)cc(OC)c1 ZINC001175111782 1048122524 /nfs/dbraw/zinc/12/25/24/1048122524.db2.gz UYDTTZKTZAETED-UHFFFAOYSA-N -1 1 314.168 4.460 20 0 DIADMM COc1cc(Nc2cc(Cl)cc(Cl)c2[O-])cc(OC)c1 ZINC001175111783 1048122937 /nfs/dbraw/zinc/12/29/37/1048122937.db2.gz UZENGSKONVDQJP-UHFFFAOYSA-N -1 1 314.168 4.460 20 0 DIADMM CCOc1ccc(Nc2cc(F)c([O-])cc2F)c(F)c1F ZINC001175152152 1048144356 /nfs/dbraw/zinc/14/43/56/1048144356.db2.gz KPIVWLLWKHKVEM-UHFFFAOYSA-N -1 1 301.239 4.091 20 0 DIADMM COc1ccc(F)c(Nc2cc([O-])c(Cl)cc2F)c1F ZINC001175121063 1048151391 /nfs/dbraw/zinc/15/13/91/1048151391.db2.gz YFTDMOWIVJSCDP-UHFFFAOYSA-N -1 1 303.667 4.215 20 0 DIADMM CC(C)[C@@H]1N(C(=O)c2ccc(Cl)cc2[O-])CC12CCCC2 ZINC001161679042 1048153833 /nfs/dbraw/zinc/15/38/33/1048153833.db2.gz MANWYBCZKBRAHZ-HNNXBMFYSA-N -1 1 307.821 4.086 20 0 DIADMM [O-]c1ccc(Cl)c(Nc2cc(CO)ccc2F)c1Cl ZINC001175131266 1048156896 /nfs/dbraw/zinc/15/68/96/1048156896.db2.gz BJSMPPFRHBKMJM-UHFFFAOYSA-N -1 1 302.132 4.074 20 0 DIADMM CCOc1cc([N-]c2nnc(C(C)C)o2)cc(C(F)(F)F)c1 ZINC001175139155 1048162342 /nfs/dbraw/zinc/16/23/42/1048162342.db2.gz SIXMXWOWZGJXKO-UHFFFAOYSA-N -1 1 315.295 4.354 20 0 DIADMM O=C(CC(c1ccccc1)c1ccccc1)[N-]Oc1ccccc1 ZINC000773473741 1048174807 /nfs/dbraw/zinc/17/48/07/1048174807.db2.gz SVZWVLVYKKQWCA-UHFFFAOYSA-N -1 1 317.388 4.319 20 0 DIADMM Cc1cc(S(=O)(=O)[N-]c2ccc3occc3c2)ccc1Cl ZINC001185529662 1048192502 /nfs/dbraw/zinc/19/25/02/1048192502.db2.gz JVROKQWWNDYHMB-UHFFFAOYSA-N -1 1 321.785 4.195 20 0 DIADMM Cc1cc(S(=O)(=O)[N-]c2ccc3c(c2)N=NC3)ccc1Cl ZINC001185532736 1048194501 /nfs/dbraw/zinc/19/45/01/1048194501.db2.gz PQMLICXQYBAVFY-UHFFFAOYSA-N -1 1 321.789 4.047 20 0 DIADMM CCOc1ccc(OC)cc1Nc1cc([O-])c(Cl)cc1F ZINC001175212691 1048196829 /nfs/dbraw/zinc/19/68/29/1048196829.db2.gz FPNRZDQROPEXTQ-UHFFFAOYSA-N -1 1 311.740 4.336 20 0 DIADMM CCc1ccccc1NC(=S)Nc1cc([O-])c(F)cc1F ZINC001201146233 1048200584 /nfs/dbraw/zinc/20/05/84/1048200584.db2.gz LVVUVCOSCYMTJT-UHFFFAOYSA-N -1 1 308.353 4.042 20 0 DIADMM O=C(Nc1ccc2c(c1)CCC2)Nc1cccc([O-])c1Cl ZINC001185763656 1048222759 /nfs/dbraw/zinc/22/27/59/1048222759.db2.gz NLPVHYKNYUTNMJ-UHFFFAOYSA-N -1 1 302.761 4.178 20 0 DIADMM [O-]c1c(Cl)cc(Cl)cc1Nc1c(F)ccc(O)c1F ZINC001175269026 1048248818 /nfs/dbraw/zinc/24/88/18/1048248818.db2.gz XORBYLCFWXOOBS-UHFFFAOYSA-N -1 1 306.095 4.426 20 0 DIADMM Cc1c(Nc2cc([O-])c(Cl)cc2F)cnn1-c1ccccc1 ZINC001201375864 1048253309 /nfs/dbraw/zinc/25/33/09/1048253309.db2.gz WLSZEICOBMNFTK-UHFFFAOYSA-N -1 1 317.751 4.422 20 0 DIADMM C[S@@](=O)c1ccccc1Nc1c(Cl)ccc([O-])c1Cl ZINC001175310170 1048256722 /nfs/dbraw/zinc/25/67/22/1048256722.db2.gz PTSIQFYQXHRLBI-LJQANCHMSA-N -1 1 316.209 4.180 20 0 DIADMM C[S@](=O)c1ccccc1Nc1cc(Cl)cc(Cl)c1[O-] ZINC001175308675 1048257703 /nfs/dbraw/zinc/25/77/03/1048257703.db2.gz JAARCQSURTZBLC-IBGZPJMESA-N -1 1 316.209 4.180 20 0 DIADMM CN(c1cc(Cl)ccc1N)c1c(F)ccc([O-])c1Cl ZINC001250232471 1048270366 /nfs/dbraw/zinc/27/03/66/1048270366.db2.gz MZHMPIVSHZIGMU-UHFFFAOYSA-N -1 1 301.148 4.188 20 0 DIADMM O=C(Nc1ccc(-c2cccc(O)c2)cc1)c1ccc([O-])c(F)c1 ZINC001186237127 1048273645 /nfs/dbraw/zinc/27/36/45/1048273645.db2.gz PYGNXQFDILWQAO-UHFFFAOYSA-N -1 1 323.323 4.156 20 0 DIADMM O=C(NC1c2ccccc2-c2ccccc21)c1ccc([O-])c(F)c1 ZINC001186237151 1048274130 /nfs/dbraw/zinc/27/41/30/1048274130.db2.gz QLLOMIWYHRMTCV-UHFFFAOYSA-N -1 1 319.335 4.031 20 0 DIADMM C[C@@H](NC(=O)Nc1cc([O-])c(Cl)cc1F)C1CCCCC1 ZINC001186342537 1048290559 /nfs/dbraw/zinc/29/05/59/1048290559.db2.gz HSBDJFPWPTZWKB-SECBINFHSA-N -1 1 314.788 4.275 20 0 DIADMM O=C(Nc1cccc([O-])c1Cl)N[C@H]1CCCc2ccccc21 ZINC001186457573 1048309179 /nfs/dbraw/zinc/30/91/79/1048309179.db2.gz MLFCVFPRTKPBFB-ZDUSSCGKSA-N -1 1 316.788 4.245 20 0 DIADMM Cn1ncc2cccc(Nc3cc(Cl)cc(Cl)c3[O-])c21 ZINC001175443975 1048310760 /nfs/dbraw/zinc/31/07/60/1048310760.db2.gz YVXBSLCWDUPECN-UHFFFAOYSA-N -1 1 308.168 4.329 20 0 DIADMM Cn1ncc2cccc(Nc3c(Cl)ccc([O-])c3Cl)c21 ZINC001175443630 1048311047 /nfs/dbraw/zinc/31/10/47/1048311047.db2.gz SOLIKQAFCXPUGQ-UHFFFAOYSA-N -1 1 308.168 4.329 20 0 DIADMM [O-]c1cc(Cl)c(Nc2ccc3nccnc3c2)cc1Cl ZINC001175491213 1048327334 /nfs/dbraw/zinc/32/73/34/1048327334.db2.gz HJWSKYOREIZTIA-UHFFFAOYSA-N -1 1 306.152 4.386 20 0 DIADMM CC[C@H](SC)C(=O)Nc1cc(Cl)c([O-])c2ccccc12 ZINC000600135361 1048372903 /nfs/dbraw/zinc/37/29/03/1048372903.db2.gz GGJZZPQPKOGUNU-ZDUSSCGKSA-N -1 1 309.818 4.279 20 0 DIADMM O=C(Nc1cc(Cl)cc(Cl)c1)Nc1ccc(F)cc1[O-] ZINC001187148559 1048380044 /nfs/dbraw/zinc/38/00/44/1048380044.db2.gz TUCBTPBWQDYXEV-UHFFFAOYSA-N -1 1 315.131 4.482 20 0 DIADMM Cn1cc2ccc(Nc3cc(Cl)c([O-])cc3Cl)cc2n1 ZINC001175615428 1048397261 /nfs/dbraw/zinc/39/72/61/1048397261.db2.gz XEGXBTSPAAHQKV-UHFFFAOYSA-N -1 1 308.168 4.329 20 0 DIADMM COc1cc(F)c(Nc2cc([O-])c(Cl)cc2F)c(F)c1 ZINC001175722411 1048424698 /nfs/dbraw/zinc/42/46/98/1048424698.db2.gz SWHMEVNBDONTFP-UHFFFAOYSA-N -1 1 303.667 4.215 20 0 DIADMM CSc1cccc(NC(=O)Nc2cc(F)cc(F)c2[O-])c1 ZINC001188052544 1048465373 /nfs/dbraw/zinc/46/53/73/1048465373.db2.gz DOACWXQNKPHISW-UHFFFAOYSA-N -1 1 310.325 4.036 20 0 DIADMM CSc1ccc(NC(=O)Nc2cc(F)c(F)cc2[O-])cc1 ZINC001188110396 1048477396 /nfs/dbraw/zinc/47/73/96/1048477396.db2.gz RDNSRYLKEOBCSH-UHFFFAOYSA-N -1 1 310.325 4.036 20 0 DIADMM CCCc1cc(=O)[n-]c(SCCCOc2ccccc2C)n1 ZINC001188163527 1048482785 /nfs/dbraw/zinc/48/27/85/1048482785.db2.gz ZBDQMGQSOQFTMD-UHFFFAOYSA-N -1 1 318.442 4.004 20 0 DIADMM O=C(Nc1ccc(Cl)c(Cl)c1)Nc1ccc(F)cc1[O-] ZINC001202264116 1048494712 /nfs/dbraw/zinc/49/47/12/1048494712.db2.gz MOVJQFMORAZUIC-UHFFFAOYSA-N -1 1 315.131 4.482 20 0 DIADMM O=C(Nc1cccc(Cl)c1F)Nc1cc(F)cc(F)c1[O-] ZINC001188411845 1048513727 /nfs/dbraw/zinc/51/37/27/1048513727.db2.gz PKKWUVYYXZTPIA-UHFFFAOYSA-N -1 1 316.666 4.107 20 0 DIADMM CC(C)c1cccc(NC(=O)c2ccc([O-])c(C(F)(F)F)c2)n1 ZINC001188561759 1048521760 /nfs/dbraw/zinc/52/17/60/1048521760.db2.gz BWEJEBPWMIZAEY-UHFFFAOYSA-N -1 1 324.302 4.182 20 0 DIADMM O=C(Nc1ccc2[nH]ccc2c1)c1ccc([O-])c(C(F)(F)F)c1 ZINC001188564106 1048521939 /nfs/dbraw/zinc/52/19/39/1048521939.db2.gz RAGIJEYBACRCOZ-UHFFFAOYSA-N -1 1 320.270 4.145 20 0 DIADMM C=Cc1ccc(NC(=O)c2ccc([O-])c(C(F)(F)F)c2)cc1 ZINC001188587948 1048533092 /nfs/dbraw/zinc/53/30/92/1048533092.db2.gz YLGWWZPOMXATLQ-UHFFFAOYSA-N -1 1 307.271 4.306 20 0 DIADMM Cc1ccc(Cl)cc1NC(=O)Nc1ccc([O-])c(F)c1F ZINC001188729453 1048549639 /nfs/dbraw/zinc/54/96/39/1048549639.db2.gz YNTKGIVUWVBZIW-UHFFFAOYSA-N -1 1 312.703 4.276 20 0 DIADMM Cc1noc(C)c1Nc1c(Cl)ccc(Br)c1[O-] ZINC001176182258 1048585462 /nfs/dbraw/zinc/58/54/62/1048585462.db2.gz ZECODZOXKOQHFM-UHFFFAOYSA-N -1 1 317.570 4.157 20 0 DIADMM CCOc1ccc(-c2cc([N-]c3cnc(C)s3)on2)cc1 ZINC001212125520 1048595768 /nfs/dbraw/zinc/59/57/68/1048595768.db2.gz CTZCKQNBVQBFPC-UHFFFAOYSA-N -1 1 301.371 4.249 20 0 DIADMM Cc1ccc(SCc2cc(=O)oc3cc([O-])ccc23)c(C)c1 ZINC000006916969 1048602199 /nfs/dbraw/zinc/60/21/99/1048602199.db2.gz JBSOQTSEGFRSFU-UHFFFAOYSA-N -1 1 312.390 4.408 20 0 DIADMM [O-]c1c(Br)c(F)ccc1Nc1cncc(C2CC2)c1 ZINC001176284322 1048618465 /nfs/dbraw/zinc/61/84/65/1048618465.db2.gz HFQQXTNQQACJCF-UHFFFAOYSA-N -1 1 323.165 4.310 20 0 DIADMM Cc1ccccc1C1(NC(=O)c2ccc(Cl)cc2[O-])CCC1 ZINC001164499618 1048636783 /nfs/dbraw/zinc/63/67/83/1048636783.db2.gz BAOCVDXPFKTGDU-UHFFFAOYSA-N -1 1 315.800 4.163 20 0 DIADMM CC(C)(C(=O)Nc1cccc(F)c1[O-])c1cccc(Cl)c1 ZINC001151772749 1048639406 /nfs/dbraw/zinc/63/94/06/1048639406.db2.gz TWZKWUNQVOZNLI-UHFFFAOYSA-N -1 1 307.752 4.101 20 0 DIADMM CCCc1cc(=O)[n-]c(SCCSc2ccccc2F)n1 ZINC001164552423 1048641016 /nfs/dbraw/zinc/64/10/16/1048641016.db2.gz WEYFIZXBFGLYCO-UHFFFAOYSA-N -1 1 324.446 4.158 20 0 DIADMM CCc1cccc(C)c1NC(=O)Nc1cc([O-])c(F)cc1F ZINC001189980206 1048685569 /nfs/dbraw/zinc/68/55/69/1048685569.db2.gz NQKMZJXSHTUVPU-UHFFFAOYSA-N -1 1 306.312 4.185 20 0 DIADMM O=c1cc(-c2ccccc2)nc(SC[C@H]2C[C@H]3C=C[C@@H]2C3)[n-]1 ZINC001190210650 1048707784 /nfs/dbraw/zinc/70/77/84/1048707784.db2.gz PGUOYHNESBHWFT-NWANDNLSSA-N -1 1 310.422 4.154 20 0 DIADMM Cn1cc([N-]c2nc3ccc(F)cc3o2)c(-c2ccccc2)n1 ZINC001176563011 1048724776 /nfs/dbraw/zinc/72/47/76/1048724776.db2.gz QVHDMPVUWXPUDC-UHFFFAOYSA-N -1 1 308.316 4.111 20 0 DIADMM Cc1ccc(Cl)cc1[N-]S(=O)(=O)c1ccc(C2CC2)cc1 ZINC001190500052 1048742723 /nfs/dbraw/zinc/74/27/23/1048742723.db2.gz JQPWWZSZRDDHBY-UHFFFAOYSA-N -1 1 321.829 4.327 20 0 DIADMM [O-]c1c(F)cc(F)c(Nc2ccnc3ccc(Cl)cc32)c1F ZINC001176663484 1048751421 /nfs/dbraw/zinc/75/14/21/1048751421.db2.gz GTEPJWCUNALGPE-UHFFFAOYSA-N -1 1 324.689 4.177 20 0 DIADMM [O-]c1c(F)cc(F)c(Nc2cc(Cl)nc(Cl)c2)c1F ZINC001176664419 1048751672 /nfs/dbraw/zinc/75/16/72/1048751672.db2.gz YUDBBGPZAFJASK-UHFFFAOYSA-N -1 1 309.074 4.255 20 0 DIADMM Cc1cccc2ccc(Nc3c(F)cc(F)c([O-])c3F)nc12 ZINC001176663481 1048753275 /nfs/dbraw/zinc/75/32/75/1048753275.db2.gz GQETZMSUBXSDGI-UHFFFAOYSA-N -1 1 304.271 4.410 20 0 DIADMM [O-]c1c(F)cc(F)c(Nc2cccc(OC(F)F)c2)c1F ZINC001176672393 1048755075 /nfs/dbraw/zinc/75/50/75/1048755075.db2.gz IZLSVYIJLLHQPC-UHFFFAOYSA-N -1 1 305.202 4.155 20 0 DIADMM [O-]c1c(F)cc(F)c(Nc2cc(Cl)c(F)cc2F)c1F ZINC001176671939 1048755479 /nfs/dbraw/zinc/75/54/79/1048755479.db2.gz ARFLELDSFQGTTR-UHFFFAOYSA-N -1 1 309.621 4.485 20 0 DIADMM O=C1CCCCc2c(Nc3c(F)cc(F)c([O-])c3F)cccc21 ZINC001176670661 1048755525 /nfs/dbraw/zinc/75/55/25/1048755525.db2.gz JTPZRKISKCTLCD-UHFFFAOYSA-N -1 1 321.298 4.462 20 0 DIADMM CC(C)c1c(Cl)ncnc1Nc1c(F)cc(F)c([O-])c1F ZINC001176670139 1048755662 /nfs/dbraw/zinc/75/56/62/1048755662.db2.gz SVXCJJWSLSFXJT-UHFFFAOYSA-N -1 1 317.698 4.120 20 0 DIADMM [O-]c1c(F)cc(F)c(Nc2cncc(-c3ccccn3)c2)c1F ZINC001176670217 1048755953 /nfs/dbraw/zinc/75/59/53/1048755953.db2.gz UTXBNIHQUIFJAY-UHFFFAOYSA-N -1 1 317.270 4.010 20 0 DIADMM [O-]c1c(F)cc(F)c(Nc2ccc(F)c(F)c2Cl)c1F ZINC001176671394 1048756428 /nfs/dbraw/zinc/75/64/28/1048756428.db2.gz XYWXGDIMHPEDMK-UHFFFAOYSA-N -1 1 309.621 4.485 20 0 DIADMM Nc1cccc2cccc(Nc3c(F)cc(F)c([O-])c3F)c12 ZINC001176672050 1048756543 /nfs/dbraw/zinc/75/65/43/1048756543.db2.gz CQPVVBQFPGYLTL-UHFFFAOYSA-N -1 1 304.271 4.289 20 0 DIADMM COc1ccc(Nc2c(F)cc(F)c([O-])c2F)c(Cl)c1 ZINC001176673240 1048758619 /nfs/dbraw/zinc/75/86/19/1048758619.db2.gz PUUJPWUZTQYKGC-UHFFFAOYSA-N -1 1 303.667 4.215 20 0 DIADMM [O-]c1c(F)cc(F)c(Nc2cccc3cncc(F)c32)c1F ZINC001176673853 1048758776 /nfs/dbraw/zinc/75/87/76/1048758776.db2.gz OVDHMBJACNNTJH-UHFFFAOYSA-N -1 1 308.234 4.240 20 0 DIADMM CCc1ccc(CSc2nc(C)c(C3CC3)c(=O)[n-]2)cc1 ZINC001166631982 1048772914 /nfs/dbraw/zinc/77/29/14/1048772914.db2.gz JHYHZNLJEBXKFI-UHFFFAOYSA-N -1 1 300.427 4.223 20 0 DIADMM CC(C)=CCC[C@H](C)CC(=O)NCc1ccc([O-])c(Cl)c1 ZINC001176993999 1048815256 /nfs/dbraw/zinc/81/52/56/1048815256.db2.gz MIKBIHLJVHQKOH-ZDUSSCGKSA-N -1 1 309.837 4.434 20 0 DIADMM CC[C@@H]1CC[C@@H](C)N(C(=O)c2ccc(C(F)(F)F)cc2[O-])C1 ZINC001166944773 1048817893 /nfs/dbraw/zinc/81/78/93/1048817893.db2.gz RQPLBZJEHHWFIG-GHMZBOCLSA-N -1 1 315.335 4.062 20 0 DIADMM CCc1nc(SCc2ccc(C(F)F)cc2)[n-]c(=O)c1C ZINC000568271392 1048838611 /nfs/dbraw/zinc/83/86/11/1048838611.db2.gz BJZNXVCTQPYARJ-UHFFFAOYSA-N -1 1 310.369 4.283 20 0 DIADMM CNc1ccc(Nc2ccc(Cl)c(Cl)c2[O-])c(F)n1 ZINC001203362083 1048879807 /nfs/dbraw/zinc/87/98/07/1048879807.db2.gz MZLPAYRZUNYFRA-UHFFFAOYSA-N -1 1 302.136 4.018 20 0 DIADMM CSCc1ccc(C(=O)Nc2ccc([O-])c(Cl)c2)cc1 ZINC000111666186 1048927072 /nfs/dbraw/zinc/92/70/72/1048927072.db2.gz NJYVOXKTBMNGLH-UHFFFAOYSA-N -1 1 307.802 4.161 20 0 DIADMM O=C([O-])CC[C@H](NCc1cscc1Cl)c1ccccc1 ZINC000904011919 1048952400 /nfs/dbraw/zinc/95/24/00/1048952400.db2.gz LXBGRWSKUHLAAE-AWEZNQCLSA-N -1 1 309.818 4.097 20 0 DIADMM CC[C@@H](CC(F)(F)F)C(=O)Nc1cc(F)c([O-])cc1Cl ZINC000885678873 1048968707 /nfs/dbraw/zinc/96/87/07/1048968707.db2.gz XBAOJVAEHOCOJK-LURJTMIESA-N -1 1 313.678 4.102 20 0 DIADMM [O-]c1c(Cl)nccc1Nc1ccc(N2CCCCC2)cc1 ZINC001203719445 1048978174 /nfs/dbraw/zinc/97/81/74/1048978174.db2.gz XBRGRCZBYDOASR-UHFFFAOYSA-N -1 1 303.793 4.175 20 0 DIADMM CC[C@H](C)c1ccc([C@@H](N[C@H](C)C(=O)[O-])c2cccs2)cc1 ZINC000904203161 1049001213 /nfs/dbraw/zinc/00/12/13/1049001213.db2.gz FFDHFWTUVUMHRY-OGHNNQOOSA-N -1 1 317.454 4.414 20 0 DIADMM CCCCCCNC(=O)Nc1cccc(C(F)(F)F)c1[O-] ZINC001191978400 1049028924 /nfs/dbraw/zinc/02/89/24/1049028924.db2.gz ACVVHPDBRUSCCA-UHFFFAOYSA-N -1 1 304.312 4.113 20 0 DIADMM O=C([N-]c1c(F)cc(Cl)cc1F)c1nc(Cl)ccc1F ZINC000775499675 1049035276 /nfs/dbraw/zinc/03/52/76/1049035276.db2.gz KBRJTWOONPWPRW-UHFFFAOYSA-N -1 1 321.085 4.058 20 0 DIADMM Cc1ccc(-c2cccc(NC(=O)c3cc(F)ccc3[O-])n2)cc1 ZINC001178662358 1049073235 /nfs/dbraw/zinc/07/32/35/1049073235.db2.gz LKCSCWSRMBSDPL-UHFFFAOYSA-N -1 1 322.339 4.154 20 0 DIADMM Cc1cnc(Cl)c(NC(=O)c2ccc(C(C)(C)C)cc2[O-])c1 ZINC001192314743 1049074797 /nfs/dbraw/zinc/07/47/97/1049074797.db2.gz SEGOIHGWFCZHNQ-UHFFFAOYSA-N -1 1 318.804 4.299 20 0 DIADMM CCSc1cccc(F)c1[N-]C(=O)c1ccc(F)cc1F ZINC000484930442 1049079696 /nfs/dbraw/zinc/07/96/96/1049079696.db2.gz ABPBTLZMGHZOTK-UHFFFAOYSA-N -1 1 311.328 4.468 20 0 DIADMM CCSc1cccc(F)c1[N-]C(=O)c1cc(Cl)ccn1 ZINC000484923703 1049084961 /nfs/dbraw/zinc/08/49/61/1049084961.db2.gz FBDBLMOVABDWLQ-UHFFFAOYSA-N -1 1 310.781 4.238 20 0 DIADMM O=C([O-])c1ccc(C[N@H+]2CCC[C@@H]2c2ccc(Cl)s2)cc1 ZINC001204155365 1049097865 /nfs/dbraw/zinc/09/78/65/1049097865.db2.gz LBXYRZPZGAYWAU-CYBMUJFWSA-N -1 1 321.829 4.437 20 0 DIADMM O=C([O-])c1ccc(CN2CCC[C@@H]2c2ccc(Cl)s2)cc1 ZINC001204155365 1049097878 /nfs/dbraw/zinc/09/78/78/1049097878.db2.gz LBXYRZPZGAYWAU-CYBMUJFWSA-N -1 1 321.829 4.437 20 0 DIADMM O=C([O-])c1ccc(C[N@H+]2CCC[C@@H]2c2ccccc2Cl)cc1 ZINC001204154576 1049098561 /nfs/dbraw/zinc/09/85/61/1049098561.db2.gz LQSIJKMNPJIWCU-QGZVFWFLSA-N -1 1 315.800 4.375 20 0 DIADMM CC(C)C[C@@H](NC(=O)c1cc([O-])cc(F)c1F)c1ccccc1 ZINC001192678584 1049128461 /nfs/dbraw/zinc/12/84/61/1049128461.db2.gz HNCXYOPOQYKFEQ-MRXNPFEDSA-N -1 1 319.351 4.188 20 0 DIADMM CC(C)[C@H](CNc1ccc(-n2ccc(=O)[n-]2)cc1)c1ccccc1 ZINC001179307772 1049152191 /nfs/dbraw/zinc/15/21/91/1049152191.db2.gz CCBZOWNKFQDSKQ-IBGZPJMESA-N -1 1 321.424 4.430 20 0 DIADMM CSc1ccc([O-])c(-c2nc(-c3ccc(F)cc3F)no2)c1 ZINC000904806906 1049163131 /nfs/dbraw/zinc/16/31/31/1049163131.db2.gz NQWSCRVARSGMLA-UHFFFAOYSA-N -1 1 320.320 4.109 20 0 DIADMM CC1(C)CN(Cc2ccc([O-])c(F)c2F)[C@@H]1c1ccccc1 ZINC001204515410 1049180781 /nfs/dbraw/zinc/18/07/81/1049180781.db2.gz MCFOQNNMMRUIEI-QGZVFWFLSA-N -1 1 303.352 4.254 20 0 DIADMM O=C(Nc1c([O-])cccc1F)c1cc(Cl)c(F)cc1Cl ZINC000645926937 1049201180 /nfs/dbraw/zinc/20/11/80/1049201180.db2.gz VDRSZFPIZUERRN-UHFFFAOYSA-N -1 1 318.106 4.230 20 0 DIADMM CCc1ccnc(-c2nc3cc(Cl)c(Cl)cc3c(=O)[n-]2)c1 ZINC000485371497 1049231823 /nfs/dbraw/zinc/23/18/23/1049231823.db2.gz PWIHRBYSZARRGM-UHFFFAOYSA-N -1 1 320.179 4.267 20 0 DIADMM C[C@H](CC(C)(C)c1ccccc1)Nc1cc(Cl)[n-]c(=O)n1 ZINC000858364666 1049247907 /nfs/dbraw/zinc/24/79/07/1049247907.db2.gz GVQHHNXHUJZGPU-LLVKDONJSA-N -1 1 305.809 4.004 20 0 DIADMM C[C@@H]1C[C@@H](Nc2cc(Cl)[n-]c(=O)n2)C[C@H](c2ccccc2)C1 ZINC000858569979 1049277610 /nfs/dbraw/zinc/27/76/10/1049277610.db2.gz DQUORQKLUAZZGW-IACUBPJLSA-N -1 1 317.820 4.220 20 0 DIADMM C[C@H]1C[C@@H](c2ccccc2)C[C@@H](Nc2cc(Cl)[n-]c(=O)n2)C1 ZINC000858569981 1049277836 /nfs/dbraw/zinc/27/78/36/1049277836.db2.gz DQUORQKLUAZZGW-YUTCNCBUSA-N -1 1 317.820 4.220 20 0 DIADMM O=C(Nc1cc([O-])c(Cl)cc1F)Oc1ccc(Cl)cc1 ZINC001194055471 1049309289 /nfs/dbraw/zinc/30/92/89/1049309289.db2.gz DTRKFLKYGYPKKJ-UHFFFAOYSA-N -1 1 316.115 4.449 20 0 DIADMM CCCCCCOC(=O)Nc1cccc([O-])c1Br ZINC001194187721 1049339284 /nfs/dbraw/zinc/33/92/84/1049339284.db2.gz GAVZCJCFNXVJOR-UHFFFAOYSA-N -1 1 316.195 4.284 20 0 DIADMM CCc1ccc(Cl)cc1[N-]S(=O)(=O)c1c(C)cccc1C ZINC001194642178 1049403421 /nfs/dbraw/zinc/40/34/21/1049403421.db2.gz FQEQTSPNAAQRGE-UHFFFAOYSA-N -1 1 323.845 4.320 20 0 DIADMM CCC(CC)COC(=O)Nc1ccc(Br)cc1[O-] ZINC001194706481 1049419282 /nfs/dbraw/zinc/41/92/82/1049419282.db2.gz GFWAGSGLPMMEFZ-UHFFFAOYSA-N -1 1 316.195 4.139 20 0 DIADMM Cc1ncccc1Nc1cc(Br)cc(Cl)c1[O-] ZINC001205429934 1049469381 /nfs/dbraw/zinc/46/93/81/1049469381.db2.gz UEHUEEIOWFMITG-UHFFFAOYSA-N -1 1 313.582 4.255 20 0 DIADMM O=C(Nc1cc(Cl)c([O-])c2ccccc12)C1(C(F)F)CC1 ZINC000862295485 1049486807 /nfs/dbraw/zinc/48/68/07/1049486807.db2.gz JUFBLQCIAZHUDR-UHFFFAOYSA-N -1 1 311.715 4.183 20 0 DIADMM Cc1ccccc1[C@]1(F)CCN(Cc2ccc([O-])c(F)c2F)C1 ZINC001205516917 1049489789 /nfs/dbraw/zinc/48/97/89/1049489789.db2.gz AOWXJNBGFWQLLS-SFHVURJKSA-N -1 1 321.342 4.050 20 0 DIADMM O=C(Nc1ccc(F)cc1[O-])Oc1ccccc1C(F)(F)F ZINC001195197254 1049494076 /nfs/dbraw/zinc/49/40/76/1049494076.db2.gz UPIHNVVCCINBSW-UHFFFAOYSA-N -1 1 315.222 4.161 20 0 DIADMM O=C(Nc1c([O-])cccc1F)Oc1ccccc1C(F)(F)F ZINC001195196557 1049494674 /nfs/dbraw/zinc/49/46/74/1049494674.db2.gz JPUZVDHQHIQTHZ-UHFFFAOYSA-N -1 1 315.222 4.161 20 0 DIADMM O=C(Nc1ccc([O-])c(Cl)c1)c1coc(C2CCCCC2)n1 ZINC000486956417 1049499109 /nfs/dbraw/zinc/49/91/09/1049499109.db2.gz NIIVLBOUZLQGLE-UHFFFAOYSA-N -1 1 320.776 4.334 20 0 DIADMM CCC1(C(=O)Nc2cccc([O-])c2Br)CCCC1 ZINC000908709040 1049499298 /nfs/dbraw/zinc/49/92/98/1049499298.db2.gz GCVQTDSBZRBVQE-UHFFFAOYSA-N -1 1 312.207 4.064 20 0 DIADMM CCC(CC)[C@@H](C)C(=O)Nc1cccc([O-])c1Br ZINC000908709696 1049502225 /nfs/dbraw/zinc/50/22/25/1049502225.db2.gz RVSMEZOPLDWKQK-SECBINFHSA-N -1 1 314.223 4.166 20 0 DIADMM O=C([O-])c1sccc1-c1cccc2nc(C(F)(F)F)[nH]c21 ZINC001205614920 1049512502 /nfs/dbraw/zinc/51/25/02/1049512502.db2.gz SPEQJPSERPHPOZ-UHFFFAOYSA-N -1 1 312.272 4.008 20 0 DIADMM Cc1cc(C)c([N-]S(=O)(=O)c2c(C)cccc2Cl)c(C)c1 ZINC001195309238 1049516480 /nfs/dbraw/zinc/51/64/80/1049516480.db2.gz JYKMLOPWFGDZOJ-UHFFFAOYSA-N -1 1 323.845 4.374 20 0 DIADMM CCOC(=O)NC(=S)[N-]c1ccc(C2CC2)c2ccccc12 ZINC001195490607 1049537138 /nfs/dbraw/zinc/53/71/38/1049537138.db2.gz JXAMHDZOLQGIGE-UHFFFAOYSA-N -1 1 314.410 4.160 20 0 DIADMM CCOC(=O)NC(=S)[N-]c1cccc(-c2ccccc2C)c1 ZINC001195490831 1049537538 /nfs/dbraw/zinc/53/75/38/1049537538.db2.gz NJNTUICUDPABDF-UHFFFAOYSA-N -1 1 314.410 4.105 20 0 DIADMM [O-]c1cc(F)c(Nc2ccc(CO)cc2Cl)cc1Cl ZINC001250025737 1049539458 /nfs/dbraw/zinc/53/94/58/1049539458.db2.gz JBPWMCUPJNUAAA-UHFFFAOYSA-N -1 1 302.132 4.074 20 0 DIADMM O=C(CC1CC(c2ccccc2)C1)Nc1cc([O-])c(F)cc1F ZINC000909986289 1049572648 /nfs/dbraw/zinc/57/26/48/1049572648.db2.gz FZRDANNDSUKLKB-UHFFFAOYSA-N -1 1 317.335 4.193 20 0 DIADMM Cn1cc(-c2ccnc(-c3ccc([O-])cc3F)n2)c2ccccc21 ZINC001206030046 1049634748 /nfs/dbraw/zinc/63/47/48/1049634748.db2.gz MNNGIZYNKYUXKD-UHFFFAOYSA-N -1 1 319.339 4.147 20 0 DIADMM [O-]c1ccc(CN2CC3(CCC3)[C@@H]2c2ccccc2)c(F)c1F ZINC001206047564 1049638982 /nfs/dbraw/zinc/63/89/82/1049638982.db2.gz JJYIFPKNQDOUMP-SFHVURJKSA-N -1 1 315.363 4.398 20 0 DIADMM O=C(Nc1cc(F)cc(F)c1[O-])c1scnc1C1CCCC1 ZINC000910983020 1049653801 /nfs/dbraw/zinc/65/38/01/1049653801.db2.gz OILXVDSDHNVHLT-UHFFFAOYSA-N -1 1 324.352 4.037 20 0 DIADMM [O-]c1c(Br)ccc(Cl)c1Nc1ccccc1O ZINC001206247122 1049689462 /nfs/dbraw/zinc/68/94/62/1049689462.db2.gz MHHXEYIRQTWLDE-UHFFFAOYSA-N -1 1 314.566 4.257 20 0 DIADMM CCc1ccc2nc(-c3ccc4nc(C)sc4c3)[n-]c(=O)c2c1 ZINC000160109726 1049698194 /nfs/dbraw/zinc/69/81/94/1049698194.db2.gz ABYFCCDLCRMLBL-UHFFFAOYSA-N -1 1 321.405 4.071 20 0 DIADMM CCOc1cc(C(=O)Nc2cccc(C)c2)cc(Cl)c1[O-] ZINC000192981687 1049947408 /nfs/dbraw/zinc/94/74/08/1049947408.db2.gz LDNFUSRNCBWILR-UHFFFAOYSA-N -1 1 305.761 4.005 20 0 DIADMM COc1cc(C(F)(F)F)ccc1Nc1ccnc(Cl)c1[O-] ZINC001209883038 1050100053 /nfs/dbraw/zinc/10/00/53/1050100053.db2.gz WINBUWFMGSMDQO-UHFFFAOYSA-N -1 1 318.682 4.212 20 0 DIADMM COc1cc(C(F)(F)F)ccc1Nc1c([O-])cc(F)cc1F ZINC001209884477 1050100547 /nfs/dbraw/zinc/10/05/47/1050100547.db2.gz YEJVKXCWWAKTSU-UHFFFAOYSA-N -1 1 319.229 4.441 20 0 DIADMM [O-]c1cc(Nc2ccc(OCC3CC3)nc2)c(F)cc1Cl ZINC001210014559 1050122702 /nfs/dbraw/zinc/12/27/02/1050122702.db2.gz HROJTFNVNQDIJC-UHFFFAOYSA-N -1 1 308.740 4.112 20 0 DIADMM CCC[C@H](NC(=O)c1cc2ccccc2cc1[O-])c1ccccn1 ZINC000591672004 1050188334 /nfs/dbraw/zinc/18/83/34/1050188334.db2.gz DDGGEZLVXMROLS-SFHVURJKSA-N -1 1 320.392 4.212 20 0 DIADMM [O-]c1cc(Cl)c(Nc2cccc3c2OCCO3)cc1Cl ZINC001210369503 1050219370 /nfs/dbraw/zinc/21/93/70/1050219370.db2.gz KPWHXGRUVSDHOQ-UHFFFAOYSA-N -1 1 312.152 4.214 20 0 DIADMM Cc1ccc([C@H]2CCCCCN2C(=O)c2cccc([O-])c2F)o1 ZINC001136941624 1050249914 /nfs/dbraw/zinc/24/99/14/1050249914.db2.gz YTKBCGRAAHDKOI-CQSZACIVSA-N -1 1 317.360 4.190 20 0 DIADMM [O-]c1cc(Cl)c(Nc2ccc3ncncc3c2)cc1Cl ZINC001210457113 1050252922 /nfs/dbraw/zinc/25/29/22/1050252922.db2.gz MLPYLGFJUKAGPF-UHFFFAOYSA-N -1 1 306.152 4.386 20 0 DIADMM Cc1oncc1[N-]c1nc2cccc(Br)c2s1 ZINC001210579683 1050304631 /nfs/dbraw/zinc/30/46/31/1050304631.db2.gz YYBUIUGRTDZSDA-UHFFFAOYSA-N -1 1 310.176 4.099 20 0 DIADMM [O-]c1c(F)c(F)ccc1Nc1cc(O)cc(C(F)(F)F)c1 ZINC001210826455 1050382055 /nfs/dbraw/zinc/38/20/55/1050382055.db2.gz ARICDHHHWVDJCI-UHFFFAOYSA-N -1 1 305.202 4.138 20 0 DIADMM CCC[C@@H](C)c1noc(-c2cc(Cl)c([O-])c(OCC)c2)n1 ZINC000785586408 1050391984 /nfs/dbraw/zinc/39/19/84/1050391984.db2.gz YGPDIIDXERPHPT-SECBINFHSA-N -1 1 310.781 4.398 20 0 DIADMM COC(=O)C(C)(C)c1ccc(-c2cccc([O-])c2Cl)cc1 ZINC001242799750 1050407587 /nfs/dbraw/zinc/40/75/87/1050407587.db2.gz AGPDZZNJEQZCHP-UHFFFAOYSA-N -1 1 304.773 4.163 20 0 DIADMM [O-]c1c(Cl)cc(Nc2ccnc(OC(F)F)c2)cc1Cl ZINC001210927107 1050419083 /nfs/dbraw/zinc/41/90/83/1050419083.db2.gz LFZPTHIDCMRIGP-UHFFFAOYSA-N -1 1 321.110 4.439 20 0 DIADMM [O-]c1c(Cl)cc(Nc2ccc(N3CCCC3)nc2)cc1Cl ZINC001210927204 1050418920 /nfs/dbraw/zinc/41/89/20/1050418920.db2.gz NAJZAEIRJJIITD-UHFFFAOYSA-N -1 1 324.211 4.438 20 0 DIADMM CCc1nnc2ccc(Nc3cc(Cl)c([O-])c(Cl)c3)cn21 ZINC001210927093 1050419054 /nfs/dbraw/zinc/41/90/54/1050419054.db2.gz KYBNGIXCSYTOTR-UHFFFAOYSA-N -1 1 323.183 4.048 20 0 DIADMM CC(C)(C)c1nnc([N-]c2ccccc2N2CCCCC2)o1 ZINC001210960414 1050433529 /nfs/dbraw/zinc/43/35/29/1050433529.db2.gz AARAUURNSJYJSE-UHFFFAOYSA-N -1 1 300.406 4.101 20 0 DIADMM CCc1ccc(-c2csc(NC(=O)c3ccccc3[O-])n2)cc1 ZINC001144061290 1050451780 /nfs/dbraw/zinc/45/17/80/1050451780.db2.gz NDHXHGRIFMZKNK-UHFFFAOYSA-N -1 1 324.405 4.330 20 0 DIADMM [O-]c1cc(Nc2cc(O)cc(OC(F)(F)F)c2)cc(F)c1F ZINC001211121969 1050484814 /nfs/dbraw/zinc/48/48/14/1050484814.db2.gz GGVBWURZOMQMHS-UHFFFAOYSA-N -1 1 321.201 4.018 20 0 DIADMM COc1ccc(-c2cccnc2)cc1-c1cc(F)c([O-])cc1F ZINC001211349225 1050553208 /nfs/dbraw/zinc/55/32/08/1050553208.db2.gz BARPGCIJCDTPQM-UHFFFAOYSA-N -1 1 313.303 4.408 20 0 DIADMM COc1ccc2nc(C)cc(-c3cc(F)c([O-])cc3F)c2c1 ZINC001211352357 1050554329 /nfs/dbraw/zinc/55/43/29/1050554329.db2.gz LAVBJSAQBHABOW-UHFFFAOYSA-N -1 1 301.292 4.203 20 0 DIADMM CC(C)(C)OC(=O)Nc1cc(-c2cc(F)c([O-])cc2F)ccn1 ZINC001211350874 1050554465 /nfs/dbraw/zinc/55/44/65/1050554465.db2.gz WMZCTMGQTBJIMB-UHFFFAOYSA-N -1 1 322.311 4.079 20 0 DIADMM [O-]c1cc(F)c(CN2CCCC[C@H]2c2ccccc2)c(F)c1 ZINC001144542396 1050610403 /nfs/dbraw/zinc/61/04/03/1050610403.db2.gz WAJFBOQRUGWUQE-SFHVURJKSA-N -1 1 303.352 4.398 20 0 DIADMM CCOc1ccc([N-]c2nnc(C(C)C)o2)c(C(F)(F)F)c1 ZINC001213231924 1050613371 /nfs/dbraw/zinc/61/33/71/1050613371.db2.gz LHTMURULJFRTGG-UHFFFAOYSA-N -1 1 315.295 4.354 20 0 DIADMM COc1ccccc1[C@@H]1CCCN1Cc1c(F)cc([O-])cc1F ZINC001144555131 1050614743 /nfs/dbraw/zinc/61/47/43/1050614743.db2.gz WQGRLMNXVYEXOF-KRWDZBQOSA-N -1 1 319.351 4.016 20 0 DIADMM CCCC[C@H](NCc1ccc(-c2ccc(Cl)cc2)o1)C(=O)[O-] ZINC000575050129 1050628992 /nfs/dbraw/zinc/62/89/92/1050628992.db2.gz MDNBYUUNFUUSHW-HNNXBMFYSA-N -1 1 321.804 4.333 20 0 DIADMM [O-]c1c(F)cc(Nc2c(F)cccc2Br)cc1F ZINC001213379270 1050644119 /nfs/dbraw/zinc/64/41/19/1050644119.db2.gz KALHHKQRGHJWQP-UHFFFAOYSA-N -1 1 318.092 4.316 20 0 DIADMM [O-]c1c(F)cc(Nc2cc(F)ccc2OCC(F)F)cc1F ZINC001213384359 1050644970 /nfs/dbraw/zinc/64/49/70/1050644970.db2.gz IATVNKFRARWAFI-UHFFFAOYSA-N -1 1 319.229 4.197 20 0 DIADMM [O-]c1cc(F)c(CN2CCC[C@H]2c2ccccc2F)cc1F ZINC001144666114 1050646054 /nfs/dbraw/zinc/64/60/54/1050646054.db2.gz GTBNLFXKEXECHX-INIZCTEOSA-N -1 1 307.315 4.147 20 0 DIADMM COc1cc(F)c(Cl)cc1Nc1cc(F)c([O-])c(F)c1 ZINC001213388974 1050647466 /nfs/dbraw/zinc/64/74/66/1050647466.db2.gz VRMQFSYVKLQZEQ-UHFFFAOYSA-N -1 1 303.667 4.215 20 0 DIADMM C[C@@H](c1ccccc1Cl)N(C)Cc1sccc1C(=O)[O-] ZINC001144680112 1050652747 /nfs/dbraw/zinc/65/27/47/1050652747.db2.gz JGPDDHUGTZLVSC-JTQLQIEISA-N -1 1 309.818 4.293 20 0 DIADMM CC(C)Oc1c(F)cc(Nc2cc([O-])c(F)c(F)c2)cc1F ZINC001213423745 1050653170 /nfs/dbraw/zinc/65/31/70/1050653170.db2.gz QDESQMNKVURPLL-UHFFFAOYSA-N -1 1 315.266 4.479 20 0 DIADMM C[C@H](c1ccccc1Cl)N(C)Cc1sccc1C(=O)[O-] ZINC001144680113 1050653528 /nfs/dbraw/zinc/65/35/28/1050653528.db2.gz JGPDDHUGTZLVSC-SNVBAGLBSA-N -1 1 309.818 4.293 20 0 DIADMM CSc1cccnc1[N-]C(=O)c1sccc1C(F)F ZINC001144820469 1050721115 /nfs/dbraw/zinc/72/11/15/1050721115.db2.gz HWMJCFIQTFSKHC-UHFFFAOYSA-N -1 1 300.355 4.055 20 0 DIADMM Cc1cc(C2CC2)ccc1Nc1cc2ccc([O-])cc2oc1=O ZINC001213862433 1050769537 /nfs/dbraw/zinc/76/95/37/1050769537.db2.gz VGZHIQCVTCRHPQ-UHFFFAOYSA-N -1 1 307.349 4.428 20 0 DIADMM C[C@@H](C(=O)[N-]OCc1ccccc1)c1ccccc1C(F)(F)F ZINC000742036784 1050798473 /nfs/dbraw/zinc/79/84/73/1050798473.db2.gz PQMWRWXFRCKTFF-GFCCVEGCSA-N -1 1 323.314 4.057 20 0 DIADMM Cc1cc(F)cc([N-]c2nnc(Br)s2)c1Cl ZINC001214071933 1050811320 /nfs/dbraw/zinc/81/13/20/1050811320.db2.gz UHFFCURJNXNDLK-UHFFFAOYSA-N -1 1 322.590 4.145 20 0 DIADMM Cc1cccc([C@H](C)NC(=O)Cc2ccc([O-])c(Cl)c2)c1C ZINC001146225234 1050819385 /nfs/dbraw/zinc/81/93/85/1050819385.db2.gz AASXNRUBXPNTNB-ZDUSSCGKSA-N -1 1 317.816 4.082 20 0 DIADMM C[C@@H]1CC[C@](C)(/C=C/C(=O)Nc2c([O-])cccc2F)C1(C)C ZINC001146492736 1050825972 /nfs/dbraw/zinc/82/59/72/1050825972.db2.gz PSURODJGELIEGL-AJDAEKEXSA-N -1 1 305.393 4.488 20 0 DIADMM Cc1cc(C)c2cc(C(=O)Nc3c([O-])cccc3F)sc2n1 ZINC001146491940 1050826117 /nfs/dbraw/zinc/82/61/17/1050826117.db2.gz GUMMANGLUNUGLM-UHFFFAOYSA-N -1 1 316.357 4.010 20 0 DIADMM C[C@H]1CC[C@@](C)(CNC(=O)c2ccc(Cl)cc2[O-])C1(C)C ZINC001146569365 1050831875 /nfs/dbraw/zinc/83/18/75/1050831875.db2.gz FRQPWSUKJBMJOG-GTNSWQLSSA-N -1 1 309.837 4.238 20 0 DIADMM CC[C@](C)(NC(=O)c1ccc(Cl)cc1[O-])c1ccccc1 ZINC001146926547 1050850551 /nfs/dbraw/zinc/85/05/51/1050850551.db2.gz NCXZPWSCKGAXGJ-KRWDZBQOSA-N -1 1 303.789 4.101 20 0 DIADMM Cc1ccc([N-]S(=O)(=O)c2ccccc2-c2ccccc2)cc1 ZINC000641909626 1050852976 /nfs/dbraw/zinc/85/29/76/1050852976.db2.gz CFOITNQMOLBJNF-UHFFFAOYSA-N -1 1 323.417 4.463 20 0 DIADMM O=C(Nc1cccc2c1ccn2C(F)F)c1ccc(F)c([O-])c1 ZINC001146964549 1050853648 /nfs/dbraw/zinc/85/36/48/1050853648.db2.gz VZZHIZNSBNETOZ-UHFFFAOYSA-N -1 1 320.270 4.133 20 0 DIADMM C[C@H](CCC(C)(C)C)NC(=O)c1c([O-])cnc2c(F)cccc21 ZINC001147198170 1050867081 /nfs/dbraw/zinc/86/70/81/1050867081.db2.gz DELBFYDDHRSLKS-LLVKDONJSA-N -1 1 318.392 4.024 20 0 DIADMM O=C(Nc1cncc2c1CCCC2)c1ccc2ccccc2c1[O-] ZINC001147247890 1050869084 /nfs/dbraw/zinc/86/90/84/1050869084.db2.gz BHFKPXLWRHCWDV-UHFFFAOYSA-N -1 1 318.376 4.072 20 0 DIADMM [O-]c1c(F)cc(Nc2cccnc2Br)cc1Cl ZINC001214479703 1050917623 /nfs/dbraw/zinc/91/76/23/1050917623.db2.gz DMZBVQNQDQUCRX-UHFFFAOYSA-N -1 1 317.545 4.086 20 0 DIADMM CC(C)Sc1ccccc1C(=O)Nc1nc(Cl)ccc1[O-] ZINC000789929762 1050894100 /nfs/dbraw/zinc/89/41/00/1050894100.db2.gz FEOHJRCCGXADDA-UHFFFAOYSA-N -1 1 322.817 4.193 20 0 DIADMM COCOc1ccc(Cl)cc1Nc1c([O-])cc(F)cc1F ZINC001214422188 1050898181 /nfs/dbraw/zinc/89/81/81/1050898181.db2.gz FNSHTZDWOSHGEJ-UHFFFAOYSA-N -1 1 315.703 4.050 20 0 DIADMM COCOc1ccc(Cl)cc1Nc1cc([O-])c(F)c(F)c1 ZINC001214425851 1050899536 /nfs/dbraw/zinc/89/95/36/1050899536.db2.gz DRFXOSZJKBBHPX-UHFFFAOYSA-N -1 1 315.703 4.050 20 0 DIADMM CCCn1ccc2ccc(NC(=O)c3ccc(F)c([O-])c3)cc21 ZINC001147902215 1050908753 /nfs/dbraw/zinc/90/87/53/1050908753.db2.gz HHMHGPHNFCTAML-UHFFFAOYSA-N -1 1 312.344 4.148 20 0 DIADMM Cc1cn(-c2ccc(Nc3cc(F)c([O-])c(Cl)c3)cc2)cn1 ZINC001214486554 1050919732 /nfs/dbraw/zinc/91/97/32/1050919732.db2.gz MQMHDFIUMRFSPX-UHFFFAOYSA-N -1 1 317.751 4.422 20 0 DIADMM CC1(C)Oc2ccc(Nc3cc(F)c([O-])c(Cl)c3)cc2O1 ZINC001214488603 1050919779 /nfs/dbraw/zinc/91/97/79/1050919779.db2.gz IAALLTNUQSMBQW-UHFFFAOYSA-N -1 1 309.724 4.436 20 0 DIADMM C[C@@H]1CCc2cc(N)ccc2N1c1cc(F)c([O-])c(Cl)c1 ZINC001214486344 1050919993 /nfs/dbraw/zinc/91/99/93/1050919993.db2.gz BSEHICQDPLENES-SECBINFHSA-N -1 1 306.768 4.240 20 0 DIADMM CCOC(=O)c1ccccc1Nc1cc(F)c([O-])c(Cl)c1 ZINC001214489295 1050920769 /nfs/dbraw/zinc/92/07/69/1050920769.db2.gz APNLAEMJRFVJSR-UHFFFAOYSA-N -1 1 309.724 4.105 20 0 DIADMM [O-]c1c(F)cc(Nc2c(Cl)cnnc2Cl)cc1Cl ZINC001214485180 1050921005 /nfs/dbraw/zinc/92/10/05/1050921005.db2.gz WKMVPDWRQXIDDV-UHFFFAOYSA-N -1 1 308.527 4.025 20 0 DIADMM Cc1nc(-c2ccc(Nc3cc(F)c([O-])c(Cl)c3)cc2)no1 ZINC001214489362 1050922658 /nfs/dbraw/zinc/92/26/58/1050922658.db2.gz BMYYYBYQVSOYLT-UHFFFAOYSA-N -1 1 319.723 4.287 20 0 DIADMM COc1cnc2c(cccc2Nc2cc(F)c([O-])c(Cl)c2)c1 ZINC001214492292 1050922855 /nfs/dbraw/zinc/92/28/55/1050922855.db2.gz XTERYTLENOSSGT-UHFFFAOYSA-N -1 1 318.735 4.485 20 0 DIADMM COc1ccc2cccnc2c1Nc1cc(F)c([O-])c(Cl)c1 ZINC001214494554 1050924049 /nfs/dbraw/zinc/92/40/49/1050924049.db2.gz UXPQLVMQXZPWLK-UHFFFAOYSA-N -1 1 318.735 4.485 20 0 DIADMM Cc1c(Nc2cc(F)c([O-])c(Cl)c2)ccc2c1OCCO2 ZINC001214494572 1050925043 /nfs/dbraw/zinc/92/50/43/1050925043.db2.gz VTPLRRZARXHKQQ-UHFFFAOYSA-N -1 1 309.724 4.008 20 0 DIADMM CC(C)CCC[C@H](C)N(CCC(C)C)C(=O)c1cncc([O-])c1 ZINC001148370857 1050933286 /nfs/dbraw/zinc/93/32/86/1050933286.db2.gz DZEUOKPVUJJUJV-INIZCTEOSA-N -1 1 320.477 4.490 20 0 DIADMM COc1cc(C(C)=O)ccc1Nc1c(Cl)ccc([O-])c1F ZINC001214561416 1050945308 /nfs/dbraw/zinc/94/53/08/1050945308.db2.gz KZYSJRSAIDJVIX-UHFFFAOYSA-N -1 1 309.724 4.140 20 0 DIADMM O=C(Nc1ccc2[nH]ccc2c1)c1ccc(C(F)(F)F)cc1[O-] ZINC001148790472 1050972432 /nfs/dbraw/zinc/97/24/32/1050972432.db2.gz LEJPRORFCVLSQP-UHFFFAOYSA-N -1 1 320.270 4.145 20 0 DIADMM O=C(Nc1cccc2cc[nH]c21)c1ccc(C(F)(F)F)cc1[O-] ZINC001148801131 1050975624 /nfs/dbraw/zinc/97/56/24/1050975624.db2.gz TUIHROKGWNSAHP-UHFFFAOYSA-N -1 1 320.270 4.145 20 0 DIADMM CC(C)Cc1ccccc1C(=O)Nc1ccc([O-])c(Cl)c1 ZINC000790803947 1050996842 /nfs/dbraw/zinc/99/68/42/1050996842.db2.gz FJFDZHHJYRXSNG-UHFFFAOYSA-N -1 1 303.789 4.496 20 0 DIADMM [O-]c1cc(Cl)c(Nc2ccc(CO)c(F)c2F)cc1Cl ZINC001215038658 1051059267 /nfs/dbraw/zinc/05/92/67/1051059267.db2.gz WTZVHTYWMHIYIK-UHFFFAOYSA-N -1 1 320.122 4.213 20 0 DIADMM CC(C)Oc1ccc(F)c(F)c1Nc1cc(F)c([O-])cc1F ZINC001215079007 1051072307 /nfs/dbraw/zinc/07/23/07/1051072307.db2.gz RCUZRIRJASSGPD-UHFFFAOYSA-N -1 1 315.266 4.479 20 0 DIADMM COc1ccc(-c2nc(-c3ccc(Cl)cc3C)no2)c([O-])c1 ZINC001215147704 1051087892 /nfs/dbraw/zinc/08/78/92/1051087892.db2.gz KWROSRVXDRHCIM-UHFFFAOYSA-N -1 1 316.744 4.080 20 0 DIADMM COc1ccc(-c2nc(-c3cc(C)ccc3Cl)no2)c([O-])c1 ZINC001215147924 1051088182 /nfs/dbraw/zinc/08/81/82/1051088182.db2.gz TZWGCPCSGGSAOE-UHFFFAOYSA-N -1 1 316.744 4.080 20 0 DIADMM COc1ccc(-c2nc(-c3ccc(C)cc3Cl)no2)c([O-])c1 ZINC001215149331 1051090352 /nfs/dbraw/zinc/09/03/52/1051090352.db2.gz HFVLIYAWDJXBPG-UHFFFAOYSA-N -1 1 316.744 4.080 20 0 DIADMM CSc1ccccc1CN(C)C(=O)c1c([O-])cccc1Cl ZINC000792543601 1051144217 /nfs/dbraw/zinc/14/42/17/1051144217.db2.gz ZDNJVKFDBMYVEP-UHFFFAOYSA-N -1 1 321.829 4.040 20 0 DIADMM COc1cccc([O-])c1-c1nc(-c2cc(C)cc(Cl)c2)no1 ZINC001215322474 1051164996 /nfs/dbraw/zinc/16/49/96/1051164996.db2.gz PQAMDHJCKWEBNB-UHFFFAOYSA-N -1 1 316.744 4.080 20 0 DIADMM Cc1cc(-c2noc(-c3ccc([O-])cc3Cl)n2)ccc1F ZINC001215343555 1051172648 /nfs/dbraw/zinc/17/26/48/1051172648.db2.gz YNHQTBJOPWWTGX-UHFFFAOYSA-N -1 1 304.708 4.210 20 0 DIADMM Cc1c(F)cccc1-c1noc(-c2ccc([O-])cc2Cl)n1 ZINC001215343420 1051172907 /nfs/dbraw/zinc/17/29/07/1051172907.db2.gz XGPBRLYCFGYVDK-UHFFFAOYSA-N -1 1 304.708 4.210 20 0 DIADMM CCOc1c(Nc2ccc(F)c(F)c2[O-])ccc(F)c1F ZINC001215419924 1051199068 /nfs/dbraw/zinc/19/90/68/1051199068.db2.gz YTQRBOCLWWPMHI-UHFFFAOYSA-N -1 1 301.239 4.091 20 0 DIADMM [O-]c1cc(Cl)c(Nc2cc3n[nH]cc3c(F)c2)cc1Cl ZINC001215555332 1051241915 /nfs/dbraw/zinc/24/19/15/1051241915.db2.gz HLUXTTZQRWYFNX-UHFFFAOYSA-N -1 1 312.131 4.458 20 0 DIADMM CCOc1ccc(Nc2cc(F)c([O-])cc2F)cc1OCC ZINC001215573343 1051251541 /nfs/dbraw/zinc/25/15/41/1051251541.db2.gz GIEWRFGOVLLCOZ-UHFFFAOYSA-N -1 1 309.312 4.211 20 0 DIADMM [O-]c1cc(F)c(Nc2cc(F)cc(Br)c2)cc1F ZINC001215571585 1051251937 /nfs/dbraw/zinc/25/19/37/1051251937.db2.gz IGGCYQQFUAJJMG-UHFFFAOYSA-N -1 1 318.092 4.316 20 0 DIADMM CC(C)n1ncc2cc(Nc3cc(F)c([O-])cc3F)ccc21 ZINC001215576355 1051253217 /nfs/dbraw/zinc/25/32/17/1051253217.db2.gz WWVMCBKGTZARHE-UHFFFAOYSA-N -1 1 303.312 4.345 20 0 DIADMM Nc1cc(F)cc(C(F)(F)F)c1Nc1cc(F)c([O-])cc1F ZINC001215577266 1051253485 /nfs/dbraw/zinc/25/34/85/1051253485.db2.gz XLVZIHGJMGAICL-UHFFFAOYSA-N -1 1 322.208 4.154 20 0 DIADMM [O-]c1c(Cl)cc(Cl)cc1Nc1cc(F)c(O)cc1F ZINC001215573879 1051253543 /nfs/dbraw/zinc/25/35/43/1051253543.db2.gz RXWAGCIDSAAHAH-UHFFFAOYSA-N -1 1 306.095 4.426 20 0 DIADMM CC1(C)CC(=O)Nc2c(Nc3cc(F)c([O-])cc3F)cccc21 ZINC001215577085 1051253908 /nfs/dbraw/zinc/25/39/08/1051253908.db2.gz SSKJHBAPSMJPCO-UHFFFAOYSA-N -1 1 318.323 4.034 20 0 DIADMM COc1cc(Nc2cc(F)c([O-])cc2F)ccc1-c1cnco1 ZINC001215574107 1051254410 /nfs/dbraw/zinc/25/44/10/1051254410.db2.gz XKSAYIIJCKLKIN-UHFFFAOYSA-N -1 1 318.279 4.078 20 0 DIADMM CC(=O)Nc1ccc(Nc2cc(F)c([O-])cc2F)cc1Cl ZINC001215573452 1051254756 /nfs/dbraw/zinc/25/47/56/1051254756.db2.gz KCVUJOYAEKBUJY-UHFFFAOYSA-N -1 1 312.703 4.026 20 0 DIADMM FC(F)(F)c1ccc(Cl)c([N-]c2nonc2C2CC2)c1 ZINC001215688632 1051303296 /nfs/dbraw/zinc/30/32/96/1051303296.db2.gz UEGJZTGTPJOGJY-UHFFFAOYSA-N -1 1 303.671 4.363 20 0 DIADMM O=C(Nc1ccc([O-])c(Cl)c1)c1cc(C2CC2)cnc1Cl ZINC000793708478 1051335753 /nfs/dbraw/zinc/33/57/53/1051335753.db2.gz GDPZFJSJFBSYKR-UHFFFAOYSA-N -1 1 323.179 4.224 20 0 DIADMM Cc1ccc(-c2noc(-c3cc(F)ccc3[O-])n2)cc1Cl ZINC001215769501 1051356609 /nfs/dbraw/zinc/35/66/09/1051356609.db2.gz HUSPQOKIHTUZLK-UHFFFAOYSA-N -1 1 304.708 4.210 20 0 DIADMM CCOCc1cncc(Nc2ccc(Cl)c(Cl)c2[O-])c1 ZINC001215792078 1051371509 /nfs/dbraw/zinc/37/15/09/1051371509.db2.gz WDNWSUBSVFHEBK-UHFFFAOYSA-N -1 1 313.184 4.374 20 0 DIADMM CC(C)(C)C(=O)Nc1ccccc1Nc1ccnc(Cl)c1[O-] ZINC001215834551 1051397632 /nfs/dbraw/zinc/39/76/32/1051397632.db2.gz XKSVFFYNBRPEBR-UHFFFAOYSA-N -1 1 319.792 4.169 20 0 DIADMM Cc1cc(-c2noc(-c3ccc(F)c([O-])c3)n2)cc(C)c1F ZINC001215842109 1051406148 /nfs/dbraw/zinc/40/61/48/1051406148.db2.gz BLBCLWLVAXCASX-UHFFFAOYSA-N -1 1 302.280 4.004 20 0 DIADMM Cc1cc(-c2noc(-c3ccc(F)c([O-])c3)n2)ccc1Cl ZINC001215842732 1051406878 /nfs/dbraw/zinc/40/68/78/1051406878.db2.gz RRIBKOIZKIAAOY-UHFFFAOYSA-N -1 1 304.708 4.210 20 0 DIADMM CSc1cc(F)c(Nc2c([O-])cc(F)cc2F)c(F)c1 ZINC001215842858 1051406924 /nfs/dbraw/zinc/40/69/24/1051406924.db2.gz WPJQLSQZFXEINS-UHFFFAOYSA-N -1 1 303.280 4.414 20 0 DIADMM CSc1cccc(Nc2ccc(-n3ccc(=O)[n-]3)cc2)c1F ZINC001215871133 1051426712 /nfs/dbraw/zinc/42/67/12/1051426712.db2.gz ZQQCWGKBQMHSKJ-UHFFFAOYSA-N -1 1 315.373 4.183 20 0 DIADMM CCOc1cc(C)ccc1Nc1ccc(-n2ccc(=O)[n-]2)cc1 ZINC001215877139 1051432306 /nfs/dbraw/zinc/43/23/06/1051432306.db2.gz KKIJDNBOUWDJIB-UHFFFAOYSA-N -1 1 309.369 4.029 20 0 DIADMM [O-]c1cccc(-c2nc(-c3ccc(F)cc3Cl)no2)c1F ZINC001215984050 1051501680 /nfs/dbraw/zinc/50/16/80/1051501680.db2.gz IBSRDXLCEHMFRX-UHFFFAOYSA-N -1 1 308.671 4.041 20 0 DIADMM Cc1c(Cl)cccc1-c1noc(-c2cccc([O-])c2F)n1 ZINC001215984726 1051504562 /nfs/dbraw/zinc/50/45/62/1051504562.db2.gz WESQHAUMPFTINM-UHFFFAOYSA-N -1 1 304.708 4.210 20 0 DIADMM Cc1ccc2cccc(-c3noc(-c4cccc([O-])c4F)n3)c2n1 ZINC001215989135 1051505762 /nfs/dbraw/zinc/50/57/62/1051505762.db2.gz SARWHJQZTJHNSH-UHFFFAOYSA-N -1 1 321.311 4.105 20 0 DIADMM Cc1c(F)ccc(-c2noc(-c3cccc([O-])c3F)n2)c1Cl ZINC001215989030 1051505831 /nfs/dbraw/zinc/50/58/31/1051505831.db2.gz OVBGIYDTIONAOJ-UHFFFAOYSA-N -1 1 322.698 4.349 20 0 DIADMM [O-]c1c(Cl)nccc1Nc1cc(-c2ccccc2)cnc1F ZINC001216071422 1051561377 /nfs/dbraw/zinc/56/13/77/1051561377.db2.gz HPUYUJMHBIVUSU-UHFFFAOYSA-N -1 1 315.735 4.385 20 0 DIADMM CCc1cc(Nc2ccc(Cl)c(Cl)c2[O-])ccc1CO ZINC001216106543 1051582262 /nfs/dbraw/zinc/58/22/62/1051582262.db2.gz XFYCGIUEPBXWKL-UHFFFAOYSA-N -1 1 312.196 4.497 20 0 DIADMM COc1cc(Nc2cc(F)c([O-])cc2F)ccc1OC(C)C ZINC001216247297 1051653675 /nfs/dbraw/zinc/65/36/75/1051653675.db2.gz CIJZVZZDCMOEIJ-UHFFFAOYSA-N -1 1 309.312 4.210 20 0 DIADMM COc1cc(Nc2cc([O-])c(F)c(F)c2)ccc1OC(C)C ZINC001216247780 1051655037 /nfs/dbraw/zinc/65/50/37/1051655037.db2.gz UTYLFVXHFSTNAP-UHFFFAOYSA-N -1 1 309.312 4.210 20 0 DIADMM O=C(c1ccncc1)c1ccc(Nc2ccc(Cl)c([O-])c2)cc1 ZINC001212593406 1051664963 /nfs/dbraw/zinc/66/49/63/1051664963.db2.gz PHULRJLZGQFFTL-UHFFFAOYSA-N -1 1 324.767 4.415 20 0 DIADMM Cc1cc(=O)c2ccc(Nc3ccc(Cl)c([O-])c3)cc2o1 ZINC001212593808 1051679016 /nfs/dbraw/zinc/67/90/16/1051679016.db2.gz KWKMIZXWUWCBFP-UHFFFAOYSA-N -1 1 301.729 4.204 20 0 DIADMM Clc1ccnc(Cl)c1[N-]c1cc(-c2ccccn2)no1 ZINC001216301601 1051684370 /nfs/dbraw/zinc/68/43/70/1051684370.db2.gz SRNPTXQPJUYBGD-UHFFFAOYSA-N -1 1 307.140 4.182 20 0 DIADMM Cc1c(Cl)cccc1-c1noc(-c2cc([O-])cc(F)c2)n1 ZINC001216336241 1051706574 /nfs/dbraw/zinc/70/65/74/1051706574.db2.gz ODCZCUFRXMBDPY-UHFFFAOYSA-N -1 1 304.708 4.210 20 0 DIADMM [O-]c1cc(F)cc(-c2nc(-c3ccc(Cl)cc3F)no2)c1 ZINC001216339174 1051707557 /nfs/dbraw/zinc/70/75/57/1051707557.db2.gz CCTGGNZMONJNIN-UHFFFAOYSA-N -1 1 308.671 4.041 20 0 DIADMM [O-]c1cc(F)cc(F)c1Nc1c(Cl)cc(CO)cc1Cl ZINC001216363254 1051720787 /nfs/dbraw/zinc/72/07/87/1051720787.db2.gz LOIXSYKKQHQBDR-UHFFFAOYSA-N -1 1 320.122 4.213 20 0 DIADMM COc1c(F)ccc(Nc2cc([O-])c(Cl)cc2F)c1OC ZINC001216393771 1051741593 /nfs/dbraw/zinc/74/15/93/1051741593.db2.gz CHPCEVJJHRAUIR-UHFFFAOYSA-N -1 1 315.703 4.085 20 0 DIADMM [O-]c1c(Cl)c(Cl)ccc1Nc1cc(F)cc(CO)c1 ZINC001212749320 1051769896 /nfs/dbraw/zinc/76/98/96/1051769896.db2.gz ZLFGGPWYDOATHA-UHFFFAOYSA-N -1 1 302.132 4.074 20 0 DIADMM COc1ccc(Nc2ccc(F)c(Br)c2[O-])cc1 ZINC001173804938 1051810730 /nfs/dbraw/zinc/81/07/30/1051810730.db2.gz MJNYAVYPAMXQHO-UHFFFAOYSA-N -1 1 312.138 4.046 20 0 DIADMM [O-]c1c(Cl)cccc1-c1ccc2nc(C(F)(F)F)cn2c1 ZINC001242364137 1051817517 /nfs/dbraw/zinc/81/75/17/1051817517.db2.gz DIHQAMVNYLBQDR-UHFFFAOYSA-N -1 1 312.678 4.379 20 0 DIADMM [O-]c1c(Br)c(F)ccc1Nc1ccccc1F ZINC001173847399 1051822192 /nfs/dbraw/zinc/82/21/92/1051822192.db2.gz BKXAHKCUCBBDHY-UHFFFAOYSA-N -1 1 300.102 4.177 20 0 DIADMM COc1c(F)cc(SC)cc1Nc1c([O-])cc(F)cc1F ZINC001216582990 1051826576 /nfs/dbraw/zinc/82/65/76/1051826576.db2.gz YISUTNPTSHZJRP-UHFFFAOYSA-N -1 1 315.316 4.284 20 0 DIADMM CC[C@H](Sc1nc(C(=O)OC)c[n-]1)c1ccc(Cl)cc1 ZINC000187583694 1051850660 /nfs/dbraw/zinc/85/06/60/1051850660.db2.gz QFCREZIQWKYYDE-LBPRGKRZSA-N -1 1 310.806 4.093 20 0 DIADMM [O-]c1ccc(Cl)c(Nc2ccc3c(c2)OCCO3)c1Cl ZINC001173878976 1051884571 /nfs/dbraw/zinc/88/45/71/1051884571.db2.gz PRSMCBKJXDIYMO-UHFFFAOYSA-N -1 1 312.152 4.214 20 0 DIADMM COc1ccc(Nc2cc(Cl)cc(Cl)c2[O-])cc1OC ZINC001173889467 1051889740 /nfs/dbraw/zinc/88/97/40/1051889740.db2.gz HPMBKWLOGOYILV-UHFFFAOYSA-N -1 1 314.168 4.460 20 0 DIADMM O=C(Nc1cc(Cl)ccc1NC1CC1)c1ccc([O-])c(F)c1 ZINC000768217075 1051903778 /nfs/dbraw/zinc/90/37/78/1051903778.db2.gz JQERPBGJMWOGCS-UHFFFAOYSA-N -1 1 320.751 4.011 20 0 DIADMM [O-]c1ccc(F)c(-c2nc(-c3ccccc3Cl)no2)c1F ZINC001216922164 1051909609 /nfs/dbraw/zinc/90/96/09/1051909609.db2.gz LIVFOJDPQAQSTJ-UHFFFAOYSA-N -1 1 308.671 4.041 20 0 DIADMM Cc1cccc(-c2noc(-c3c(F)ccc([O-])c3F)n2)c1Cl ZINC001216922925 1051911145 /nfs/dbraw/zinc/91/11/45/1051911145.db2.gz WQFCCRNCQPJAOB-UHFFFAOYSA-N -1 1 322.698 4.349 20 0 DIADMM [O-]c1c(Br)c(F)ccc1Nc1cc(F)ccc1F ZINC001173952084 1051916836 /nfs/dbraw/zinc/91/68/36/1051916836.db2.gz CIXRLBBSYDNHOB-UHFFFAOYSA-N -1 1 318.092 4.316 20 0 DIADMM COc1cccc(Nc2c(Cl)ccc([O-])c2Cl)c1OC ZINC001174017145 1051950011 /nfs/dbraw/zinc/95/00/11/1051950011.db2.gz CZKPMGTVRIEYDA-UHFFFAOYSA-N -1 1 314.168 4.460 20 0 DIADMM Cc1cc(C)cc(C[C@H](C)NC(=O)c2c([O-])cccc2Cl)c1 ZINC000743716358 1051959643 /nfs/dbraw/zinc/95/96/43/1051959643.db2.gz HQBDWTRNFLPXPX-ZDUSSCGKSA-N -1 1 317.816 4.023 20 0 DIADMM Cc1cc(-c2noc(-c3ccc4cccnc4c3[O-])n2)ccc1F ZINC001217142228 1051976161 /nfs/dbraw/zinc/97/61/61/1051976161.db2.gz VTFXDSPKUXGDEF-UHFFFAOYSA-N -1 1 321.311 4.105 20 0 DIADMM COc1cc(C)c(NC(=O)Nc2ccc([O-])c(Cl)c2)cc1F ZINC000192272809 1052007901 /nfs/dbraw/zinc/00/79/01/1052007901.db2.gz BRWPENGNLRZBPG-UHFFFAOYSA-N -1 1 324.739 4.146 20 0 DIADMM CC(C)NC(=O)c1cccc(Nc2cc([O-])c(Cl)cc2F)c1 ZINC001174186838 1052036550 /nfs/dbraw/zinc/03/65/50/1052036550.db2.gz PSMRYXRMJVRALF-UHFFFAOYSA-N -1 1 322.767 4.067 20 0 DIADMM CC(C)c1nnc([N-]c2ccc(C(=O)c3ccccc3)cc2)o1 ZINC001174222839 1052059367 /nfs/dbraw/zinc/05/93/67/1052059367.db2.gz KZLSYAVEPZUOQK-UHFFFAOYSA-N -1 1 307.353 4.168 20 0 DIADMM [O-]c1c2ccccc2cc(O)c1-c1nc(-c2ccc(F)cc2)no1 ZINC001217453716 1052060570 /nfs/dbraw/zinc/06/05/70/1052060570.db2.gz QZNPDLDWOYGSAA-UHFFFAOYSA-N -1 1 322.295 4.107 20 0 DIADMM [O-]c1c2ccccc2cc(O)c1-c1nc(-c2cccc(F)c2)no1 ZINC001217452935 1052060660 /nfs/dbraw/zinc/06/06/60/1052060660.db2.gz KAYWPPABOSWJAX-UHFFFAOYSA-N -1 1 322.295 4.107 20 0 DIADMM CC(C)(C)[C@H](C(=O)[O-])c1ccc(Nc2ccc3nccn3c2)cc1 ZINC001174280508 1052067413 /nfs/dbraw/zinc/06/74/13/1052067413.db2.gz ZDALNWHDJQTJID-KRWDZBQOSA-N -1 1 323.396 4.292 20 0 DIADMM [O-]c1c2ccsc2ccc1-c1nc(-c2ccccc2F)no1 ZINC001217513831 1052076384 /nfs/dbraw/zinc/07/63/84/1052076384.db2.gz KNXUBJOHGCDOEY-UHFFFAOYSA-N -1 1 312.325 4.463 20 0 DIADMM Cc1cccc(-c2noc(-c3ccc4sccc4c3[O-])n2)n1 ZINC001217514383 1052079351 /nfs/dbraw/zinc/07/93/51/1052079351.db2.gz PZWJYFWAWQJNPA-UHFFFAOYSA-N -1 1 309.350 4.027 20 0 DIADMM CN(C(=O)c1c([O-])cccc1Cl)[C@@H]1CCCc2ccccc21 ZINC000769654533 1052091561 /nfs/dbraw/zinc/09/15/61/1052091561.db2.gz VVSCMBWFJYURQR-OAHLLOKOSA-N -1 1 315.800 4.195 20 0 DIADMM O=C(c1c([O-])cccc1Cl)N(Cc1ccco1)C1CCCC1 ZINC000769715740 1052097720 /nfs/dbraw/zinc/09/77/20/1052097720.db2.gz DDNNYLHCMHMTLF-UHFFFAOYSA-N -1 1 319.788 4.224 20 0 DIADMM CCc1c(Cl)cc(Nc2cnn(C)c2C)c([O-])c1Cl ZINC001174392000 1052114233 /nfs/dbraw/zinc/11/42/33/1052114233.db2.gz PTIIEWXZGXXXLP-UHFFFAOYSA-N -1 1 300.189 4.047 20 0 DIADMM O=C(c1c([O-])cccc1Cl)N1CCCCC[C@@H]1c1ccco1 ZINC000769886216 1052126573 /nfs/dbraw/zinc/12/65/73/1052126573.db2.gz BCLVAIJNPSSSHQ-CYBMUJFWSA-N -1 1 319.788 4.396 20 0 DIADMM CCCCN(C(=O)c1ncc(C)cc1[O-])[C@@H](C)c1ccccc1 ZINC000494828037 1052138568 /nfs/dbraw/zinc/13/85/68/1052138568.db2.gz ABNJCISGKXEVSL-HNNXBMFYSA-N -1 1 312.413 4.099 20 0 DIADMM CC(C)(C)OC(=O)c1ccc(Nc2ccc(F)c(F)c2[O-])cc1 ZINC001174425746 1052154255 /nfs/dbraw/zinc/15/42/55/1052154255.db2.gz IELONTXHOMJFHI-UHFFFAOYSA-N -1 1 321.323 4.369 20 0 DIADMM [O-]c1cc(Nc2cccc(CO)c2Cl)c(F)cc1Cl ZINC001212764375 1052157422 /nfs/dbraw/zinc/15/74/22/1052157422.db2.gz WCAQYTWGPGFIHQ-UHFFFAOYSA-N -1 1 302.132 4.074 20 0 DIADMM CCCCOc1ccc(C(=O)Nc2ccc([O-])c(Cl)c2)cc1 ZINC000315445750 1052338009 /nfs/dbraw/zinc/33/80/09/1052338009.db2.gz RSSNTBNSWDJRGO-UHFFFAOYSA-N -1 1 319.788 4.477 20 0 DIADMM C[C@H]1CCCN(Cc2sc3ccccc3c2Cl)[C@@H]1C(=O)[O-] ZINC000235713460 1052417897 /nfs/dbraw/zinc/41/78/97/1052417897.db2.gz GOUQRPRTUXRJAW-BONVTDFDSA-N -1 1 323.845 4.240 20 0 DIADMM O=C([O-])c1cc(-c2cc3nc[nH]c3cc2F)cc(C(F)(F)F)c1 ZINC001222621180 1052519329 /nfs/dbraw/zinc/51/93/29/1052519329.db2.gz PSLMCUHTYUQWAB-UHFFFAOYSA-N -1 1 324.233 4.086 20 0 DIADMM Cc1cc(S(=O)(=O)[N-]c2ccccc2C(C)C)c(C)s1 ZINC000032531947 1052561171 /nfs/dbraw/zinc/56/11/71/1052561171.db2.gz ITWPFFIRNIDWBY-UHFFFAOYSA-N -1 1 309.456 4.289 20 0 DIADMM O=C(Nc1ccc([O-])c(Cl)c1)c1ccc(Cl)c(F)c1 ZINC000154022424 1052612203 /nfs/dbraw/zinc/61/22/03/1052612203.db2.gz OWVPOCBFFSCEFY-UHFFFAOYSA-N -1 1 300.116 4.090 20 0 DIADMM Cc1oc(CN(C)[C@H](C)c2cccc(Cl)c2)cc1C(=O)[O-] ZINC000062015262 1052617439 /nfs/dbraw/zinc/61/74/39/1052617439.db2.gz UCXNKINRSXAERV-SNVBAGLBSA-N -1 1 307.777 4.133 20 0 DIADMM CC(C)Oc1cc(F)c(F)cc1[N-]c1nnc(C(C)(C)C)o1 ZINC001212220493 1052687943 /nfs/dbraw/zinc/68/79/43/1052687943.db2.gz PTXYODHIZYIKKL-UHFFFAOYSA-N -1 1 311.332 4.176 20 0 DIADMM Cc1c(=O)[n-]c(SC2CCSCC2)nc1-c1ccccc1 ZINC000917467230 1052730697 /nfs/dbraw/zinc/73/06/97/1052730697.db2.gz BLSUIUFJQHVKFU-UHFFFAOYSA-N -1 1 318.467 4.145 20 0 DIADMM CCCCC[C@@H](OCCCC[P@](=O)([O-])O)[C@@H](C)CCC ZINC001225019617 1052744762 /nfs/dbraw/zinc/74/47/62/1052744762.db2.gz YXEYVNOOMDHSDZ-LSDHHAIUSA-N -1 1 308.399 4.346 20 0 DIADMM Cc1cc(Nc2cc(F)c(C(=O)[O-])c(F)c2)c2ccccc2n1 ZINC000321851190 1052761208 /nfs/dbraw/zinc/76/12/08/1052761208.db2.gz KFBXCGGPHGKTNW-UHFFFAOYSA-N -1 1 314.291 4.263 20 0 DIADMM CC(=O)c1ccc([O-])cc1O[C@H]1CCc2ccc(Cl)cc21 ZINC001225618451 1052808794 /nfs/dbraw/zinc/80/87/94/1052808794.db2.gz FFZACCXIZPDDJD-INIZCTEOSA-N -1 1 302.757 4.315 20 0 DIADMM COc1ccc([C@H](Oc2cc([O-])ccc2C(C)=O)C(C)C)cc1 ZINC001225619285 1052809051 /nfs/dbraw/zinc/80/90/51/1052809051.db2.gz RJVAAEDFMAUGIW-LJQANCHMSA-N -1 1 314.381 4.380 20 0 DIADMM CC(=O)c1c(O)cc([O-])cc1O[C@H](c1ccccc1)C(C)C ZINC001225680281 1052815561 /nfs/dbraw/zinc/81/55/61/1052815561.db2.gz WRJLBJMABJAYGK-SFHVURJKSA-N -1 1 300.354 4.077 20 0 DIADMM CC(=O)c1c(O)cc([O-])cc1O[C@@H](c1ccccc1)C(C)C ZINC001225680279 1052815571 /nfs/dbraw/zinc/81/55/71/1052815571.db2.gz WRJLBJMABJAYGK-GOSISDBHSA-N -1 1 300.354 4.077 20 0 DIADMM O=C(c1ccc([O-])cc1)c1ccc(O[C@H]2CCCC[C@H]2F)cc1 ZINC001225807548 1052833791 /nfs/dbraw/zinc/83/37/91/1052833791.db2.gz IPWHGHUMBJXLCA-MSOLQXFVSA-N -1 1 314.356 4.283 20 0 DIADMM C[C@@H](Cc1ccco1)Oc1ccc(C(=O)c2ccc([O-])cc2)cc1 ZINC001225808112 1052833948 /nfs/dbraw/zinc/83/39/48/1052833948.db2.gz LMXDYZUTULHXOB-AWEZNQCLSA-N -1 1 322.360 4.226 20 0 DIADMM COc1cnc(=S)[n-]c1O[C@H](C)c1ccc2ccccc2c1 ZINC001226242028 1052880179 /nfs/dbraw/zinc/88/01/79/1052880179.db2.gz GTWBSCWTCUQDJC-LLVKDONJSA-N -1 1 312.394 4.067 20 0 DIADMM Cc1cc(=O)oc2cc([O-])cc(O[C@@H](C)c3ccc(F)cc3)c12 ZINC001226486474 1052901979 /nfs/dbraw/zinc/90/19/79/1052901979.db2.gz QELLRCQKKZPFSH-NSHDSACASA-N -1 1 314.312 4.086 20 0 DIADMM Cc1cccc2c1[C@@H](Oc1cc([O-])cc3oc(=O)cc(C)c13)CC2 ZINC001226489550 1052902923 /nfs/dbraw/zinc/90/29/23/1052902923.db2.gz MDXYHPOPAXJXHH-HNNXBMFYSA-N -1 1 322.360 4.182 20 0 DIADMM CC(=O)c1cc(C)ccc1OC(=C([O-])c1ccco1)c1ccco1 ZINC001227085257 1052959404 /nfs/dbraw/zinc/95/94/04/1052959404.db2.gz CTFGPNDANFGDNC-LJQANCHMSA-N -1 1 324.332 4.387 20 0 DIADMM C[C@]12CC3CC(NC(=O)c4ccc([O-])cc4F)(C1)C[C@@](C)(C3)C2 ZINC000322847351 1052963615 /nfs/dbraw/zinc/96/36/15/1052963615.db2.gz UBTAZBSPWYYDKR-CMXJYWLISA-N -1 1 317.404 4.010 20 0 DIADMM O=C1Nc2ccc(Cl)cc2/C1=C\c1ccc([O-])c(Cl)c1 ZINC000921261580 1052966626 /nfs/dbraw/zinc/96/66/26/1052966626.db2.gz IJFXLXBWIZUVCO-VZUCSPMQSA-N -1 1 306.148 4.192 20 0 DIADMM C/C=C/[C@@H](Oc1cc([O-])ccc1C(=O)COC)C1CCCCC1 ZINC001227171944 1052968135 /nfs/dbraw/zinc/96/81/35/1052968135.db2.gz IXBRWWLMMOHSFV-NTSMAEHXSA-N -1 1 318.413 4.125 20 0 DIADMM Cc1cn2c(n1)[C@H](Oc1cc(Cl)c([O-])cc1Cl)CCC2 ZINC001227645003 1053005925 /nfs/dbraw/zinc/00/59/25/1053005925.db2.gz GCKPYVPYLVAJEH-GFCCVEGCSA-N -1 1 313.184 4.118 20 0 DIADMM C[C@@H](Oc1cc(Cl)c([O-])cc1Cl)c1ncccc1F ZINC001227645050 1053006168 /nfs/dbraw/zinc/00/61/68/1053006168.db2.gz GGZTVJGYBOHCHO-SSDOTTSWSA-N -1 1 302.132 4.373 20 0 DIADMM C[C@H](Oc1[n-]c(=O)nc2c1CO[C@@H]2C)c1ccc2ccccc2c1 ZINC001227710039 1053009482 /nfs/dbraw/zinc/00/94/82/1053009482.db2.gz ILOKVSVDHBTVKQ-NWDGAFQWSA-N -1 1 322.364 4.067 20 0 DIADMM C[C@H](Oc1[n-]c(=O)nc2c1CO[C@H]2C)c1cccc2ccccc21 ZINC001227712937 1053010193 /nfs/dbraw/zinc/01/01/93/1053010193.db2.gz MVPXXOUHOAGXFV-RYUDHWBXSA-N -1 1 322.364 4.067 20 0 DIADMM CC[C@H](Oc1[n-]c(=S)nc2cnccc21)c1ccccc1F ZINC001227885287 1053025977 /nfs/dbraw/zinc/02/59/77/1053025977.db2.gz MBACCKLDWGNXLF-AWEZNQCLSA-N -1 1 315.373 4.357 20 0 DIADMM C[C@H](Oc1cc([O-])ccc1C(=O)c1ccccc1)c1ccccn1 ZINC001228185196 1053051181 /nfs/dbraw/zinc/05/11/81/1053051181.db2.gz GKDQKMGORHTGRJ-AWEZNQCLSA-N -1 1 319.360 4.158 20 0 DIADMM C[C@H](Oc1cc([O-])ccc1C(=O)c1ccccc1)c1cccnc1 ZINC001228182073 1053051467 /nfs/dbraw/zinc/05/14/67/1053051467.db2.gz AOYLSXCAAMTLQL-AWEZNQCLSA-N -1 1 319.360 4.158 20 0 DIADMM CC(C)[C@H]1CCCCCN1C(=O)NCc1ccc([O-])c(Cl)c1 ZINC001313237561 1053096291 /nfs/dbraw/zinc/09/62/91/1053096291.db2.gz ZHDSXBMHZHMFDG-OAHLLOKOSA-N -1 1 324.852 4.156 20 0 DIADMM CC[C@@H](C)[C@@H](C)N(C(=O)NCc1ccc([O-])c(Cl)c1)C1CC1 ZINC001313236710 1053096468 /nfs/dbraw/zinc/09/64/68/1053096468.db2.gz OLWLNUOJIRMBLD-VXGBXAGGSA-N -1 1 324.852 4.154 20 0 DIADMM CC(C)CC[C@@H]1CCCN1C(=O)NCc1ccc([O-])c(Cl)c1 ZINC001313235869 1053096682 /nfs/dbraw/zinc/09/66/82/1053096682.db2.gz DZXYTPWTGSCGSZ-AWEZNQCLSA-N -1 1 324.852 4.156 20 0 DIADMM CSc1cc(Cl)ccc1[N-]C(=O)c1cc(C2CC2)no1 ZINC000617253758 1053111514 /nfs/dbraw/zinc/11/15/14/1053111514.db2.gz ZIOKFHNPVBWPQK-UHFFFAOYSA-N -1 1 308.790 4.180 20 0 DIADMM CSc1cc(Cl)ccc1[N-]C(=O)c1cc(C(C)C)no1 ZINC000617251966 1053115848 /nfs/dbraw/zinc/11/58/48/1053115848.db2.gz DLRDKTDQVRALRJ-UHFFFAOYSA-N -1 1 310.806 4.426 20 0 DIADMM CCC(=O)c1c(O)cc([O-])cc1O[C@@H]1CCCc2ccccc21 ZINC001228557045 1053133662 /nfs/dbraw/zinc/13/36/62/1053133662.db2.gz SRVWHJSEKDGNNC-QGZVFWFLSA-N -1 1 312.365 4.147 20 0 DIADMM CCC(=O)c1c(O)cc([O-])cc1O[C@H](C)c1c(F)cccc1F ZINC001228560397 1053134198 /nfs/dbraw/zinc/13/41/98/1053134198.db2.gz OFBAFAJRYXQJPS-SECBINFHSA-N -1 1 322.307 4.109 20 0 DIADMM CCC(=O)c1c(O)cc([O-])cc1O[C@@H](C)c1ccc(Cl)cc1 ZINC001228554829 1053134395 /nfs/dbraw/zinc/13/43/95/1053134395.db2.gz MPYHTFQOHYKSLL-JTQLQIEISA-N -1 1 320.772 4.484 20 0 DIADMM COc1ccc([C@@H](C)Oc2[n-]c(=S)nc3ccccc32)cc1 ZINC001228766395 1053178698 /nfs/dbraw/zinc/17/86/98/1053178698.db2.gz RYUOGAOWHIBLFN-LLVKDONJSA-N -1 1 312.394 4.067 20 0 DIADMM Cc1c(Cl)cc(Nc2ccc(F)c(N)c2)c([O-])c1Cl ZINC001212345459 1053267042 /nfs/dbraw/zinc/26/70/42/1053267042.db2.gz RSIYLVJPZRTTIJ-UHFFFAOYSA-N -1 1 301.148 4.472 20 0 DIADMM CC[C@@H](C)CC[C@@H](C)Oc1c([O-])c(OC)cc2ccc(=O)oc21 ZINC001229216362 1053275733 /nfs/dbraw/zinc/27/57/33/1053275733.db2.gz PTOFYSGJFGRJCO-VXGBXAGGSA-N -1 1 320.385 4.101 20 0 DIADMM O=C(c1ccc([O-])cc1)c1ccc(O)cc1OC1CCCCC1 ZINC001229294692 1053293700 /nfs/dbraw/zinc/29/37/00/1053293700.db2.gz RZCFBRDHIHXTEI-UHFFFAOYSA-N -1 1 312.365 4.040 20 0 DIADMM C[C@@H](Oc1cc(O)ccc1C(=O)c1ccc([O-])cc1)c1ccco1 ZINC001229297030 1053296657 /nfs/dbraw/zinc/29/66/57/1053296657.db2.gz KRHYTNFTMVNRGD-GFCCVEGCSA-N -1 1 324.332 4.062 20 0 DIADMM C[C@H](Oc1cc([O-])c(Cl)cc1Cl)c1cccnc1F ZINC001229406197 1053315220 /nfs/dbraw/zinc/31/52/20/1053315220.db2.gz NGVDFLXCLSECMV-ZETCQYMHSA-N -1 1 302.132 4.373 20 0 DIADMM CCC(=O)c1ccc([O-])cc1O[C@@H](C)c1ccc(F)c(F)c1 ZINC001229475590 1053331184 /nfs/dbraw/zinc/33/11/84/1053331184.db2.gz AGRJFDKXFUDBLA-JTQLQIEISA-N -1 1 306.308 4.403 20 0 DIADMM CCC(=O)c1ccc([O-])cc1OC1CC(C)(C)OC(C)(C)C1 ZINC001229477471 1053332970 /nfs/dbraw/zinc/33/29/70/1053332970.db2.gz NLUQNFMGPAPSOU-UHFFFAOYSA-N -1 1 306.402 4.100 20 0 DIADMM Cc1cccc(Cl)c1NC(=S)Nc1ccc(F)cc1[O-] ZINC001200194610 1053451969 /nfs/dbraw/zinc/45/19/69/1053451969.db2.gz XUAAJWLIORPLMR-UHFFFAOYSA-N -1 1 310.781 4.302 20 0 DIADMM Cc1ccc2c(c1)[C@H](NC(=O)c1cc3ccccc3cc1[O-])CC2 ZINC001300225674 1053506346 /nfs/dbraw/zinc/50/63/46/1053506346.db2.gz GGAHFNKQMJRHNQ-LJQANCHMSA-N -1 1 317.388 4.271 20 0 DIADMM C/C=C(/C=C\C(=O)Nc1ccc(Br)c([O-])c1)CC ZINC001325060588 1053698205 /nfs/dbraw/zinc/69/82/05/1053698205.db2.gz AYYSUJDPJLDENU-IKJNXXLOSA-N -1 1 310.191 4.006 20 0 DIADMM C[C@@H](Oc1nc2c(cc(Cl)nc2Cl)[n-]1)c1cccs1 ZINC001231045008 1053660215 /nfs/dbraw/zinc/66/02/15/1053660215.db2.gz RFJSKVVBHWVUON-ZCFIWIBFSA-N -1 1 314.197 4.466 20 0 DIADMM C[C@@H](Oc1nc2cc(Cl)nc(Cl)c2[n-]1)c1cccs1 ZINC001231045008 1053660222 /nfs/dbraw/zinc/66/02/22/1053660222.db2.gz RFJSKVVBHWVUON-ZCFIWIBFSA-N -1 1 314.197 4.466 20 0 DIADMM C[C@@H](Oc1cccnc1-c1ncccc1[O-])c1ccc(F)cc1 ZINC001231200224 1053698634 /nfs/dbraw/zinc/69/86/34/1053698634.db2.gz KDVMDQCMIPFWCZ-GFCCVEGCSA-N -1 1 310.328 4.128 20 0 DIADMM C[C@H](Oc1cccnc1-c1ncccc1[O-])c1cccc(F)c1 ZINC001231199982 1053698776 /nfs/dbraw/zinc/69/87/76/1053698776.db2.gz IBVYDTZIQKNTHN-LBPRGKRZSA-N -1 1 310.328 4.128 20 0 DIADMM CCC[C@@H](Oc1cccnc1-c1ncccc1[O-])[C@H](C)CC ZINC001231199073 1053699310 /nfs/dbraw/zinc/69/93/10/1053699310.db2.gz ACUPQIHWAYQUGP-UKRRQHHQSA-N -1 1 300.402 4.443 20 0 DIADMM CCCc1ccccc1NC(=O)c1cc(Cl)c([O-])c(OC)c1 ZINC000153563638 1053699601 /nfs/dbraw/zinc/69/96/01/1053699601.db2.gz GKKGFVIZHNYQLP-UHFFFAOYSA-N -1 1 319.788 4.259 20 0 DIADMM C[C@H](Oc1ccccc1C(=O)c1ccc([O-])cc1)c1cccnc1 ZINC001231229659 1053707715 /nfs/dbraw/zinc/70/77/15/1053707715.db2.gz WMZFJFVZNJTRPQ-AWEZNQCLSA-N -1 1 319.360 4.158 20 0 DIADMM C[C@H](Cc1ccco1)Oc1ccccc1C(=O)c1ccc([O-])cc1 ZINC001231229981 1053708139 /nfs/dbraw/zinc/70/81/39/1053708139.db2.gz INBBZJZARXIZSZ-CQSZACIVSA-N -1 1 322.360 4.226 20 0 DIADMM O=C([O-])c1ccc(CN2CCC[C@@H]2c2cccc(Cl)c2)s1 ZINC001231465299 1053758310 /nfs/dbraw/zinc/75/83/10/1053758310.db2.gz IIELEZNMKLKQNE-CQSZACIVSA-N -1 1 321.829 4.437 20 0 DIADMM CC1(C)CC(CNC(=O)c2cccc([O-])c2F)CC(C)(C)C1 ZINC001300508928 1053758501 /nfs/dbraw/zinc/75/85/01/1053758501.db2.gz UWKZCAOVPFYHML-UHFFFAOYSA-N -1 1 307.409 4.114 20 0 DIADMM O=C([O-])c1ccc(CN2CCCC[C@H]2c2ccccc2F)s1 ZINC001231463960 1053759809 /nfs/dbraw/zinc/75/98/09/1053759809.db2.gz XXSLUWFRXUVTJU-HNNXBMFYSA-N -1 1 319.401 4.313 20 0 DIADMM CC(C)(C)CCCC(=O)Nc1ccc(Br)c([O-])c1 ZINC001326234580 1053765755 /nfs/dbraw/zinc/76/57/55/1053765755.db2.gz NPTXEAIPRXVDQF-UHFFFAOYSA-N -1 1 314.223 4.310 20 0 DIADMM Oc1ccc(C[N@@H+]2CCCC(F)(F)CC2)cc1C(F)(F)F ZINC001231521275 1053778651 /nfs/dbraw/zinc/77/86/51/1053778651.db2.gz CIGSXFKPWLZSON-UHFFFAOYSA-N -1 1 309.278 4.032 20 0 DIADMM CCN(Cc1ccc(Cl)c([O-])c1)Cc1cccc(F)c1F ZINC001231735085 1053844050 /nfs/dbraw/zinc/84/40/50/1053844050.db2.gz IVMUOPGXARVDPB-UHFFFAOYSA-N -1 1 311.759 4.346 20 0 DIADMM C/C(=C\C(=O)Nc1ccc(Br)c([O-])c1)C(C)(C)C ZINC001327329346 1053851262 /nfs/dbraw/zinc/85/12/62/1053851262.db2.gz WTNRJPNDXPDEJS-VQHVLOKHSA-N -1 1 312.207 4.086 20 0 DIADMM [O-]c1cccc(CN2CCc3c(Cl)cccc3C2)c1Cl ZINC001232788885 1054122178 /nfs/dbraw/zinc/12/21/78/1054122178.db2.gz RIYVVGOQUOWVSV-UHFFFAOYSA-N -1 1 308.208 4.257 20 0 DIADMM [O-]c1c(F)ccc(CN2CCC[C@H]2c2ccc(F)cc2)c1F ZINC001232931705 1054149106 /nfs/dbraw/zinc/14/91/06/1054149106.db2.gz RZUIIPRFGFMGME-HNNXBMFYSA-N -1 1 307.315 4.147 20 0 DIADMM Cc1c(F)cccc1NC(=O)c1ccc(C(F)(F)F)cc1[O-] ZINC000622405313 1054204778 /nfs/dbraw/zinc/20/47/78/1054204778.db2.gz NTEPFPOWPDJREP-UHFFFAOYSA-N -1 1 313.250 4.111 20 0 DIADMM COc1cc(NC(=O)c2cc3ccccc3cc2[O-])c(C)cc1C ZINC000622574984 1054298227 /nfs/dbraw/zinc/29/82/27/1054298227.db2.gz DECOJYGCLYWSCC-UHFFFAOYSA-N -1 1 321.376 4.423 20 0 DIADMM CCCC(=O)c1ccc([O-])cc1O[C@H]1CCCc2cccnc21 ZINC001233646249 1054319770 /nfs/dbraw/zinc/31/97/70/1054319770.db2.gz GMAIYRQHELHSQL-KRWDZBQOSA-N -1 1 311.381 4.226 20 0 DIADMM O=C(N[C@@H](c1cccs1)C1CC1)c1cc2ccccc2cc1[O-] ZINC001440882394 1054373393 /nfs/dbraw/zinc/37/33/93/1054373393.db2.gz ICTBYUAQRAGRIY-GOSISDBHSA-N -1 1 323.417 4.488 20 0 DIADMM O=C(N[C@@H](c1ccccc1)C1CC1)c1cc2ccccc2cc1[O-] ZINC001441013397 1054378453 /nfs/dbraw/zinc/37/84/53/1054378453.db2.gz SRPMVPIDAAJTQI-FQEVSTJZSA-N -1 1 317.388 4.427 20 0 DIADMM CCCn1ccc2cc(NC(=O)c3cccc([O-])c3F)ccc21 ZINC001442515681 1054423916 /nfs/dbraw/zinc/42/39/16/1054423916.db2.gz GIYVMWDPVDQELY-UHFFFAOYSA-N -1 1 312.344 4.148 20 0 DIADMM [O-]c1ccc(-c2noc(CSCc3cccs3)n2)cc1F ZINC001343847430 1054453341 /nfs/dbraw/zinc/45/33/41/1054453341.db2.gz CSXRLBOMQUSXLR-UHFFFAOYSA-N -1 1 322.386 4.076 20 0 DIADMM C[C@H]1CCCC[C@H]1CCNC(=O)c1ccc2ccccc2c1[O-] ZINC001444069501 1054467502 /nfs/dbraw/zinc/46/75/02/1054467502.db2.gz PAGTVRPHXXTPJJ-GJZGRUSLSA-N -1 1 311.425 4.492 20 0 DIADMM Cc1ccc([C@@H]2CCCCN2C(=O)c2ccc(F)c([O-])c2)cc1 ZINC001444334688 1054473760 /nfs/dbraw/zinc/47/37/60/1054473760.db2.gz CYNMZROZEQUZKC-KRWDZBQOSA-N -1 1 313.372 4.207 20 0 DIADMM C[C@@]1(c2ccccc2)C[C@@H]1NC(=O)c1ccc2ccccc2c1[O-] ZINC001444954520 1054493019 /nfs/dbraw/zinc/49/30/19/1054493019.db2.gz KYOGJWJMWGQIAC-RXVVDRJESA-N -1 1 317.388 4.005 20 0 DIADMM C[C@H](c1ccccc1)[C@H](C)NC(=O)c1ccc2ccccc2c1[O-] ZINC001445149807 1054497496 /nfs/dbraw/zinc/49/74/96/1054497496.db2.gz FCMRGTBWJXMPOC-GJZGRUSLSA-N -1 1 319.404 4.467 20 0 DIADMM Cc1ccc(C(F)(F)F)cc1NC(=O)c1ccc(F)c([O-])c1 ZINC001445285632 1054501550 /nfs/dbraw/zinc/50/15/50/1054501550.db2.gz JGLZSTKTHMNIQK-UHFFFAOYSA-N -1 1 313.250 4.111 20 0 DIADMM CC(C)(C)C1CCC(CNC(=O)c2c([O-])cccc2F)CC1 ZINC001445597866 1054511461 /nfs/dbraw/zinc/51/14/61/1054511461.db2.gz GWNJAJXPKWAQMR-UHFFFAOYSA-N -1 1 307.409 4.114 20 0 DIADMM O=C(c1cccc([O-])c1F)N1CCC[C@H]1CCC1CCCC1 ZINC001446122358 1054525878 /nfs/dbraw/zinc/52/58/78/1054525878.db2.gz ZXWQHGMUSYUKGE-AWEZNQCLSA-N -1 1 305.393 4.106 20 0 DIADMM O=C(Nc1ccc(C2CC2)cc1)c1ccc2ccc(O)cc2c1[O-] ZINC001446990208 1054552178 /nfs/dbraw/zinc/55/21/78/1054552178.db2.gz LBLZPYWYJKPINI-UHFFFAOYSA-N -1 1 319.360 4.381 20 0 DIADMM O=C(Cc1ccc(C2CCC2)cc1)Nc1ccc([O-])c(F)c1F ZINC001347161418 1054560108 /nfs/dbraw/zinc/56/01/08/1054560108.db2.gz QJTZMGRQOUNGIM-UHFFFAOYSA-N -1 1 317.335 4.119 20 0 DIADMM CC1=C(C)C[C@H](C(=O)Nc2ccc(Br)c([O-])c2)CC1 ZINC001447737246 1054573150 /nfs/dbraw/zinc/57/31/50/1054573150.db2.gz ZDJYZTDTOGWIIW-LLVKDONJSA-N -1 1 324.218 4.230 20 0 DIADMM Cc1cc(NC(=O)c2ccc(C(C)C)cc2[O-])c(C)c(C)c1O ZINC001447963106 1054583324 /nfs/dbraw/zinc/58/33/24/1054583324.db2.gz FTMYEGWBADQEMV-UHFFFAOYSA-N -1 1 313.397 4.399 20 0 DIADMM C[C@@H]1C[C@H](c2ccccc2)N(C(=O)c2cc(Cl)ccc2[O-])C1 ZINC001449201344 1054614236 /nfs/dbraw/zinc/61/42/36/1054614236.db2.gz HMALQLCIXVTTAQ-MLGOLLRUSA-N -1 1 315.800 4.269 20 0 DIADMM Cc1cccc2cc(C(=O)Nc3ccc([O-])c(F)c3F)sc21 ZINC001449445366 1054620564 /nfs/dbraw/zinc/62/05/64/1054620564.db2.gz HJTYEKXFTHPLKQ-UHFFFAOYSA-N -1 1 319.332 4.446 20 0 DIADMM C[C@H](C(=O)Nc1ccc([O-])c(F)c1F)c1ccc(Cl)s1 ZINC001449449376 1054621365 /nfs/dbraw/zinc/62/13/65/1054621365.db2.gz QQRJSFRGGPKRNQ-LURJTMIESA-N -1 1 317.744 4.128 20 0 DIADMM O=C(CC/C=C\c1ccccc1)Nc1ccc([O-])c(F)c1F ZINC001449452067 1054622411 /nfs/dbraw/zinc/62/24/11/1054622411.db2.gz YPKRMZHSAJQEHI-YWEYNIOJSA-N -1 1 303.308 4.103 20 0 DIADMM Cc1cc(Cl)c(NC(=O)Cc2ccc([O-])c(Cl)c2)cc1C ZINC001450026194 1054635293 /nfs/dbraw/zinc/63/52/93/1054635293.db2.gz XZDWQKANGANJJG-UHFFFAOYSA-N -1 1 324.207 4.497 20 0 DIADMM C[C@H](NC(=O)Cc1ccc([O-])c(Cl)c1)c1ccccc1Cl ZINC001450208199 1054640198 /nfs/dbraw/zinc/64/01/98/1054640198.db2.gz KJAZBFVEDDCQLZ-JTQLQIEISA-N -1 1 324.207 4.119 20 0 DIADMM Cc1ccc(SCCC(=O)Nc2cc([O-])c(F)cc2F)cc1 ZINC001450904276 1054663413 /nfs/dbraw/zinc/66/34/13/1054663413.db2.gz SAYXMZMWEUUTBW-UHFFFAOYSA-N -1 1 323.364 4.100 20 0 DIADMM C[C@@H](C(=O)Nc1cc([O-])c(F)cc1F)c1ccc(Cl)s1 ZINC001450899284 1054664000 /nfs/dbraw/zinc/66/40/00/1054664000.db2.gz QRRQXWXFZZPTHG-ZCFIWIBFSA-N -1 1 317.744 4.128 20 0 DIADMM CCN(Cc1occc1C)C(=O)c1cc2ccccc2cc1[O-] ZINC001451641276 1054682763 /nfs/dbraw/zinc/68/27/63/1054682763.db2.gz URXGKYGZAKWAGN-UHFFFAOYSA-N -1 1 309.365 4.109 20 0 DIADMM O=C(Nc1cc(F)cc(F)c1[O-])c1ccc(Cl)c2occc21 ZINC001451748316 1054687478 /nfs/dbraw/zinc/68/74/78/1054687478.db2.gz CUCKPUJHMJHXJA-UHFFFAOYSA-N -1 1 323.682 4.322 20 0 DIADMM CC1(C)CCC[C@H]1[C@H]1CCN(C(=O)c2cc(Cl)ccc2[O-])C1 ZINC001452132024 1054695641 /nfs/dbraw/zinc/69/56/41/1054695641.db2.gz KNCRUYHBWTVPGL-WFASDCNBSA-N -1 1 321.848 4.334 20 0 DIADMM CSc1cccnc1[N-]C(=O)c1ccc(C(F)(F)F)s1 ZINC001452823360 1054718879 /nfs/dbraw/zinc/71/88/79/1054718879.db2.gz RDSAVMACQFEQRC-UHFFFAOYSA-N -1 1 318.345 4.136 20 0 DIADMM Cc1cc(NC(=O)c2ccc(F)c([O-])c2)cc(C(F)(F)F)c1 ZINC001452983587 1054722846 /nfs/dbraw/zinc/72/28/46/1054722846.db2.gz KBVFNJXVLZJPQY-UHFFFAOYSA-N -1 1 313.250 4.111 20 0 DIADMM Cc1cc(C(=O)Nc2cc(Cl)c([O-])c3ccccc23)c(C)[nH]1 ZINC001453770661 1054748678 /nfs/dbraw/zinc/74/86/78/1054748678.db2.gz NZRMXOQWYNLIKC-UHFFFAOYSA-N -1 1 314.772 4.396 20 0 DIADMM O=C([N-]c1c(F)cc(Cl)cc1F)c1cc(F)c(F)cc1F ZINC000180329630 1054748953 /nfs/dbraw/zinc/74/89/53/1054748953.db2.gz OCXBZTNFYLRGHR-UHFFFAOYSA-N -1 1 321.632 4.288 20 0 DIADMM Cc1ccc(-c2c[nH]cc2C(=O)Nc2cccc(F)c2[O-])s1 ZINC001454754046 1054782311 /nfs/dbraw/zinc/78/23/11/1054782311.db2.gz HGBHSDLYLAPGTM-UHFFFAOYSA-N -1 1 316.357 4.149 20 0 DIADMM CCc1ccc([C@@H](C)CC(=O)Nc2cccc(F)c2[O-])cc1 ZINC001454756480 1054783335 /nfs/dbraw/zinc/78/33/35/1054783335.db2.gz LOADSQKZWJDHAX-LBPRGKRZSA-N -1 1 301.361 4.226 20 0 DIADMM Cc1c(C(=O)[O-])ccc(-c2ccc(F)c(CN(C)C)c2)c1Cl ZINC001236127689 1054962716 /nfs/dbraw/zinc/96/27/16/1054962716.db2.gz FOELBHNBMGJDEM-UHFFFAOYSA-N -1 1 321.779 4.214 20 0 DIADMM O=C([N-]c1cc(Cl)cc(Cl)c1F)c1c(F)ccnc1F ZINC001536238430 1055066144 /nfs/dbraw/zinc/06/61/44/1055066144.db2.gz MFJWEQNAJXIWPZ-UHFFFAOYSA-N -1 1 321.085 4.058 20 0 DIADMM CSc1nc2ccnc(-c3c(F)ccc(C)c3[O-])c2s1 ZINC001236392227 1055089461 /nfs/dbraw/zinc/08/94/61/1055089461.db2.gz MTKWZZFRLAVQEZ-UHFFFAOYSA-N -1 1 306.387 4.233 20 0 DIADMM COc1cc2cnc(-c3c(F)ccc(C)c3[O-])cc2cc1OC ZINC001236389424 1055089488 /nfs/dbraw/zinc/08/94/88/1055089488.db2.gz CMVUPSSKNJBRHI-UHFFFAOYSA-N -1 1 313.328 4.072 20 0 DIADMM Cc1ccc(F)c(-c2nnc(-c3ccccc3F)cc2C)c1[O-] ZINC001236391677 1055091192 /nfs/dbraw/zinc/09/11/92/1055091192.db2.gz MUPDTBHVLIFYOB-UHFFFAOYSA-N -1 1 312.319 4.411 20 0 DIADMM Cc1ccc(F)c(-c2ccc(C3(C(F)(F)F)CC3)cn2)c1[O-] ZINC001236403474 1055095357 /nfs/dbraw/zinc/09/53/57/1055095357.db2.gz SJFRIADDXFRRPF-UHFFFAOYSA-N -1 1 311.278 4.496 20 0 DIADMM O=C(Nc1nc2c(s1)c(Cl)ccc2F)c1ccccc1[O-] ZINC001587227851 1055245100 /nfs/dbraw/zinc/24/51/00/1055245100.db2.gz ZKXKEZBIBGAONL-UHFFFAOYSA-N -1 1 322.748 4.047 20 0 DIADMM CSc1ccc(NC(=O)c2cc(SC)ccc2[O-])cc1 ZINC001587463563 1055302286 /nfs/dbraw/zinc/30/22/86/1055302286.db2.gz MVBVPHXZWIJRTR-UHFFFAOYSA-N -1 1 305.424 4.088 20 0 DIADMM Cc1cc(NC(=O)c2ccc(C(C)C)cc2[O-])ccc1N(C)C ZINC001587661286 1055342425 /nfs/dbraw/zinc/34/24/25/1055342425.db2.gz NFPFNVZHKBWJSV-UHFFFAOYSA-N -1 1 312.413 4.142 20 0 DIADMM C[C@H]1c2ccccc2CCN1C(=O)c1cc2ccccc2cc1[O-] ZINC001587674517 1055344481 /nfs/dbraw/zinc/34/44/81/1055344481.db2.gz DADHBJXBXMPWQW-AWEZNQCLSA-N -1 1 317.388 4.305 20 0 DIADMM O=c1[nH]c(Cl)c(C[N@@H+](Cc2ccccc2)C2CCC2)s1 ZINC001237153295 1055387959 /nfs/dbraw/zinc/38/79/59/1055387959.db2.gz CRKJQUQIPPPNNZ-UHFFFAOYSA-N -1 1 308.834 4.057 20 0 DIADMM O=c1[nH]c(Cl)c(C[N@H+]2CCCC[C@@H]2c2ccccc2)s1 ZINC001237160051 1055389140 /nfs/dbraw/zinc/38/91/40/1055389140.db2.gz FDJANBXFIJEFBD-GFCCVEGCSA-N -1 1 308.834 4.229 20 0 DIADMM O=C(Nc1nc(C2CC2)cs1)c1ccc2ccccc2c1[O-] ZINC000386970595 1055537440 /nfs/dbraw/zinc/53/74/40/1055537440.db2.gz YFRAQUUDCVWTKG-UHFFFAOYSA-N -1 1 310.378 4.132 20 0 DIADMM O=C(/C=C\C1CCCCCC1)NCc1ccc([O-])c(Cl)c1 ZINC001594565612 1055567553 /nfs/dbraw/zinc/56/75/53/1055567553.db2.gz MTOVAMHWAMOVIA-NTMALXAHSA-N -1 1 307.821 4.188 20 0 DIADMM C[C@H](CC1CCCCC1)NC(=O)NCc1ccc([O-])c(Cl)c1 ZINC001564663329 1055573436 /nfs/dbraw/zinc/57/34/36/1055573436.db2.gz CENVAEXRTDLXKK-GFCCVEGCSA-N -1 1 324.852 4.204 20 0 DIADMM CC(C)Oc1ccc(NC(=O)c2ccccc2[O-])cc1Cl ZINC000029800801 1055622174 /nfs/dbraw/zinc/62/21/74/1055622174.db2.gz SHQSYIGNDRDHLT-UHFFFAOYSA-N -1 1 305.761 4.085 20 0 DIADMM O=C([O-])c1cc(F)ccc1CN1CCC[C@H]1c1cccc(F)c1 ZINC001238233628 1055627925 /nfs/dbraw/zinc/62/79/25/1055627925.db2.gz AMMLOVIDMHAITC-KRWDZBQOSA-N -1 1 317.335 4.000 20 0 DIADMM CC(C)(C)C[C@H](NC(=O)c1ccc(F)c([O-])c1)c1ccccc1 ZINC001595933339 1055651292 /nfs/dbraw/zinc/65/12/92/1055651292.db2.gz SAUNAXHHIPHJBA-INIZCTEOSA-N -1 1 315.388 4.439 20 0 DIADMM CC(C)CN(CC(C)(C)C)C(=O)c1ncc2ccccc2c1[O-] ZINC001595957660 1055652688 /nfs/dbraw/zinc/65/26/88/1055652688.db2.gz ADBNDUZLUTYVBG-UHFFFAOYSA-N -1 1 314.429 4.085 20 0 DIADMM CC(C)c1ccc(C(=O)N2C[C@@H](C)Cc3ccccc32)c([O-])c1 ZINC001565636612 1055714461 /nfs/dbraw/zinc/71/44/61/1055714461.db2.gz XKWAVFWOXSMKMT-AWEZNQCLSA-N -1 1 309.409 4.355 20 0 DIADMM Cc1ccc(-c2csc(NC(=O)c3ccccc3[O-])n2)s1 ZINC001565622817 1055714562 /nfs/dbraw/zinc/71/45/62/1055714562.db2.gz CJTNMTFLUONIMY-UHFFFAOYSA-N -1 1 316.407 4.138 20 0 DIADMM CC[C@H](C)N(Cc1ccccc1)C(=O)c1c([O-])cccc1Cl ZINC001565660865 1055716860 /nfs/dbraw/zinc/71/68/60/1055716860.db2.gz LJJLZBLTXSBOHW-ZDUSSCGKSA-N -1 1 317.816 4.487 20 0 DIADMM CCC(CC)[C@@H](NC(=O)c1cc(F)ccc1[O-])c1ccccc1 ZINC001565884416 1055735418 /nfs/dbraw/zinc/73/54/18/1055735418.db2.gz QYMRHRWQNSVTNW-GOSISDBHSA-N -1 1 315.388 4.439 20 0 DIADMM CC(C)Sc1ccccc1NC(=O)c1cc(F)ccc1[O-] ZINC001566403808 1055768698 /nfs/dbraw/zinc/76/86/98/1055768698.db2.gz LIDFTMIGSGYNEI-UHFFFAOYSA-N -1 1 305.374 4.284 20 0 DIADMM CC(C)c1ccc(C(=O)Nc2c[nH]nc2-c2ccccc2)c([O-])c1 ZINC001566569437 1055776312 /nfs/dbraw/zinc/77/63/12/1055776312.db2.gz SVFFFPHPKPFISX-UHFFFAOYSA-N -1 1 321.380 4.158 20 0 DIADMM CC[C@H](NC(=O)c1ccc(Cl)cc1[O-])c1ccc(F)cc1 ZINC001566744402 1055779834 /nfs/dbraw/zinc/77/98/34/1055779834.db2.gz POQXSMOUADIFCA-AWEZNQCLSA-N -1 1 307.752 4.066 20 0 DIADMM CN(C(=O)c1ccc(C(F)(F)F)c([O-])c1)[C@H]1CCC(C)(C)C1 ZINC001568573400 1055840851 /nfs/dbraw/zinc/84/08/51/1055840851.db2.gz WBVVTIIHJZPEDD-NSHDSACASA-N -1 1 315.335 4.062 20 0 DIADMM Cc1cc(Br)c([O-])c(NC(=O)C[C@H]2CC=CCC2)c1 ZINC001597675082 1055862378 /nfs/dbraw/zinc/86/23/78/1055862378.db2.gz ZWSKVKHFKVZNGH-NSHDSACASA-N -1 1 324.218 4.148 20 0 DIADMM CC1(CNC(=O)c2ncc3ccccc3c2[O-])CCCCCC1 ZINC001597710291 1055865835 /nfs/dbraw/zinc/86/58/35/1055865835.db2.gz MMYFOVASACLKFC-UHFFFAOYSA-N -1 1 312.413 4.031 20 0 DIADMM CC(C)c1nc2cc(NC(=O)c3cc(F)ccc3[O-])ccc2o1 ZINC001539644593 1055875643 /nfs/dbraw/zinc/87/56/43/1055875643.db2.gz VWRXUYVZEZEVQZ-UHFFFAOYSA-N -1 1 314.316 4.048 20 0 DIADMM C[C@@H]1C[C@@H](C(C)(C)C)CCN1C(=O)Cc1ccc([O-])c(Cl)c1 ZINC001569936637 1055880083 /nfs/dbraw/zinc/88/00/83/1055880083.db2.gz VYAMYILSCRIJAZ-OCCSQVGLSA-N -1 1 323.864 4.261 20 0 DIADMM Cc1ccc(/C=C/CC(=O)Nc2cc([O-])c(F)cc2F)cc1 ZINC001570101380 1055886653 /nfs/dbraw/zinc/88/66/53/1055886653.db2.gz GMBYDHGRVSMHGO-NSCUHMNNSA-N -1 1 303.308 4.021 20 0 DIADMM C[C@H](CCC(=O)Nc1cc([O-])c(F)cc1F)c1ccccc1 ZINC001570101537 1055887127 /nfs/dbraw/zinc/88/71/27/1055887127.db2.gz IOSHAVOQOHENJT-LLVKDONJSA-N -1 1 305.324 4.193 20 0 DIADMM CC(C)CN(Cc1ccccc1)C(=O)c1c([O-])cccc1Cl ZINC001597981736 1055903210 /nfs/dbraw/zinc/90/32/10/1055903210.db2.gz GMYKHIQACAPHOQ-UHFFFAOYSA-N -1 1 317.816 4.344 20 0 DIADMM C/C(=C/c1ccccc1Cl)C(=O)Nc1cc(F)cc(F)c1[O-] ZINC001570465490 1055904993 /nfs/dbraw/zinc/90/49/93/1055904993.db2.gz BFWCWAZEXWLOFW-TWGQIWQCSA-N -1 1 323.726 4.366 20 0 DIADMM Cc1ccc2c(c1)CCN(C(=O)c1ccc3ccccc3c1[O-])C2 ZINC001570489540 1055905627 /nfs/dbraw/zinc/90/56/27/1055905627.db2.gz PXWJXYJSUQXBDN-UHFFFAOYSA-N -1 1 317.388 4.052 20 0 DIADMM O=C(Nc1ccc2nc(C3CC3)sc2c1)c1ccccc1[O-] ZINC000063962685 1055909527 /nfs/dbraw/zinc/90/95/27/1055909527.db2.gz CPCMIQUAZWCSRJ-UHFFFAOYSA-N -1 1 310.378 4.132 20 0 DIADMM Cc1ccccc1-c1ccc([C@H](C)[N-]C(=O)C(F)(F)F)cc1 ZINC001239504891 1055916799 /nfs/dbraw/zinc/91/67/99/1055916799.db2.gz YSKUUOKGUZFCJU-LBPRGKRZSA-N -1 1 307.315 4.402 20 0 DIADMM CCNc1ccc(C)cc1C(=O)Nc1cc(F)c([O-])cc1Cl ZINC001598590786 1055957926 /nfs/dbraw/zinc/95/79/26/1055957926.db2.gz JPZLMJPBVGHAII-UHFFFAOYSA-N -1 1 322.767 4.177 20 0 DIADMM CCCc1ccccc1C(=O)Nc1cc(F)c([O-])cc1Cl ZINC001598590847 1055958519 /nfs/dbraw/zinc/95/85/19/1055958519.db2.gz LYYBYMDMDHXSQT-UHFFFAOYSA-N -1 1 307.752 4.390 20 0 DIADMM Cc1ccc(NC(=O)c2ccc(C(F)(F)F)cc2[O-])cc1F ZINC001540312018 1056014597 /nfs/dbraw/zinc/01/45/97/1056014597.db2.gz FDUGBOVUDYERJG-UHFFFAOYSA-N -1 1 313.250 4.111 20 0 DIADMM CC[C@H]1CCCc2sc(NC(=O)c3cc(F)ccc3[O-])nc21 ZINC001602989661 1056019399 /nfs/dbraw/zinc/01/93/99/1056019399.db2.gz KWGQNXXNQNHOTH-VIFPVBQESA-N -1 1 320.389 4.070 20 0 DIADMM O=C(Cc1ccc([O-])c(Cl)c1)N1CCC[C@@H]1CC1CCCC1 ZINC001583184801 1056034591 /nfs/dbraw/zinc/03/45/91/1056034591.db2.gz OPGTUKLEQRWLJT-OAHLLOKOSA-N -1 1 321.848 4.159 20 0 DIADMM C[C@H](c1ccc(F)cc1)N(C)C(=O)c1cc(Cl)ccc1[O-] ZINC001540569995 1056045250 /nfs/dbraw/zinc/04/52/50/1056045250.db2.gz JRIPBMXZQQMZDL-SNVBAGLBSA-N -1 1 307.752 4.018 20 0 DIADMM C[C@H]1CCC[C@@H](N(C)C(=O)c2ccc(C(F)(F)F)c([O-])c2)C1 ZINC001540605309 1056049556 /nfs/dbraw/zinc/04/95/56/1056049556.db2.gz YGAORONYYVIUGL-CMPLNLGQSA-N -1 1 315.335 4.062 20 0 DIADMM CC[C@H](C)c1ccc([N-]S(=O)(=O)c2cccc(F)c2)cc1 ZINC000007057573 1056062083 /nfs/dbraw/zinc/06/20/83/1056062083.db2.gz PGALBCNIWACLAH-LBPRGKRZSA-N -1 1 307.390 4.140 20 0 DIADMM C[C@@H](c1cccc(Cl)c1)N(C)C(=O)c1cccc([O-])c1F ZINC001540800066 1056079734 /nfs/dbraw/zinc/07/97/34/1056079734.db2.gz DQKSZYPRGRWZCO-JTQLQIEISA-N -1 1 307.752 4.018 20 0 DIADMM Cc1cccc([C@H](NC(=O)c2c([O-])cccc2F)C(C)(C)C)c1 ZINC001542214534 1056109959 /nfs/dbraw/zinc/10/99/59/1056109959.db2.gz VYHPHKPMLLZITN-KRWDZBQOSA-N -1 1 315.388 4.357 20 0 DIADMM O=C(c1ccc(F)c([O-])c1)N1CC2(CC=CC2)[C@H]1c1ccccc1 ZINC001583591451 1056112718 /nfs/dbraw/zinc/11/27/18/1056112718.db2.gz RXWPYFQOLVFBST-GOSISDBHSA-N -1 1 323.367 4.065 20 0 DIADMM C[C@@H](NC(=O)c1ncc2ccccc2c1[O-])C1CCCCCC1 ZINC001611320263 1056141706 /nfs/dbraw/zinc/14/17/06/1056141706.db2.gz HGRAAAOQQIHJRP-CYBMUJFWSA-N -1 1 312.413 4.029 20 0 DIADMM Cc1cc(NC(=O)c2ccc(C(F)(F)F)c([O-])c2)ccc1F ZINC001542840394 1056160137 /nfs/dbraw/zinc/16/01/37/1056160137.db2.gz IBHDDHZYZGLKRE-UHFFFAOYSA-N -1 1 313.250 4.111 20 0 DIADMM CCC[C@H]1CCCC[C@H]1NC(=O)Cc1ccc([O-])c(Cl)c1 ZINC001542873051 1056160706 /nfs/dbraw/zinc/16/07/06/1056160706.db2.gz YGFUOMVMJWEOCS-DZGCQCFKSA-N -1 1 309.837 4.063 20 0 DIADMM O=C(c1cc(Cl)ccc1[O-])N1CCC[C@@H]1c1ccsc1 ZINC001543020457 1056168693 /nfs/dbraw/zinc/16/86/93/1056168693.db2.gz CBHQFCBWQYWSDY-CYBMUJFWSA-N -1 1 307.802 4.084 20 0 DIADMM Cc1cc(C)cc([C@@H](C)NC(=O)c2cc(Cl)ccc2[O-])c1 ZINC001543103816 1056175379 /nfs/dbraw/zinc/17/53/79/1056175379.db2.gz KRDRLYMSJJDHAU-GFCCVEGCSA-N -1 1 303.789 4.153 20 0 DIADMM Cc1cc(C)cc([C@@H](C)NC(=O)c2ncc3ccccc3c2[O-])c1 ZINC001543103732 1056177551 /nfs/dbraw/zinc/17/75/51/1056177551.db2.gz HWLBOIXVFHMQSC-CQSZACIVSA-N -1 1 320.392 4.048 20 0 DIADMM C[C@H]1c2ccccc2C[C@H]1NC(=O)c1cc2ccccc2cc1[O-] ZINC001583998763 1056233150 /nfs/dbraw/zinc/23/31/50/1056233150.db2.gz RQLIHLNRVHNTQW-ORAYPTAESA-N -1 1 317.388 4.004 20 0 DIADMM CC(C)(C)[C@@H]1CCCC[C@H]1NC(=O)c1cc(Cl)ccc1[O-] ZINC001543514573 1056241505 /nfs/dbraw/zinc/24/15/05/1056241505.db2.gz VUTYTQHBPGUALN-ZIAGYGMSSA-N -1 1 309.837 4.380 20 0 DIADMM CC[C@H](NC(=O)c1cc(F)ccc1[O-])c1cccc(Cl)c1 ZINC001543528393 1056243992 /nfs/dbraw/zinc/24/39/92/1056243992.db2.gz FJGCPGVVHQPRQP-AWEZNQCLSA-N -1 1 307.752 4.066 20 0 DIADMM CCOC(=O)c1nc2cc(-c3cc(F)cc4[nH]ccc43)ccc2[n-]1 ZINC001240042798 1056276635 /nfs/dbraw/zinc/27/66/35/1056276635.db2.gz UBEGZPLWSMEGST-UHFFFAOYSA-N -1 1 323.327 4.027 20 0 DIADMM CCOC(=O)c1nc2ccc(-c3cc(F)cc4[nH]ccc43)cc2[n-]1 ZINC001240042798 1056276643 /nfs/dbraw/zinc/27/66/43/1056276643.db2.gz UBEGZPLWSMEGST-UHFFFAOYSA-N -1 1 323.327 4.027 20 0 DIADMM Cc1ccc2c(c1)CC[C@H]2NC(=O)c1cc2ccccc2cc1[O-] ZINC001543738204 1056289157 /nfs/dbraw/zinc/28/91/57/1056289157.db2.gz UPEPXEIOACFYEX-LJQANCHMSA-N -1 1 317.388 4.271 20 0 DIADMM CCCN(C(=O)c1ccc([O-])cn1)[C@H](C)c1cc2ccccc2o1 ZINC001543809587 1056303544 /nfs/dbraw/zinc/30/35/44/1056303544.db2.gz NWOQNWHFKCUCBJ-CYBMUJFWSA-N -1 1 324.380 4.147 20 0 DIADMM CC(C)CC[C@H]1CCC[C@H]1NC(=O)c1cc(Cl)ccc1[O-] ZINC001584729949 1056405166 /nfs/dbraw/zinc/40/51/66/1056405166.db2.gz MQVKGSGSYXETLZ-IUODEOHRSA-N -1 1 309.837 4.380 20 0 DIADMM Cc1cccc(CSCc2cc(=O)oc3cc([O-])ccc23)c1 ZINC001613785122 1056408165 /nfs/dbraw/zinc/40/81/65/1056408165.db2.gz CLAGGSTZEBCRQY-UHFFFAOYSA-N -1 1 312.390 4.240 20 0 DIADMM CCSCc1cccc(NC(=O)c2ccc(F)c([O-])c2)c1 ZINC001544367306 1056414374 /nfs/dbraw/zinc/41/43/74/1056414374.db2.gz CJWGNSRFZJYIIF-UHFFFAOYSA-N -1 1 305.374 4.037 20 0 DIADMM Cc1nc(SCc2ccc(F)c(Cl)c2)[n-]c(=O)c1C1CC1 ZINC001614794062 1056452496 /nfs/dbraw/zinc/45/24/96/1056452496.db2.gz QLUOCNLRNVJXBS-UHFFFAOYSA-N -1 1 324.808 4.453 20 0 DIADMM O=c1cc(-c2ccccc2)nc(SCC=C(Cl)Cl)[n-]1 ZINC001615017445 1056464001 /nfs/dbraw/zinc/46/40/01/1056464001.db2.gz VBJPEMQGHKPYCF-UHFFFAOYSA-N -1 1 313.209 4.260 20 0 DIADMM Cc1sccc1-c1ccc([C@H](C)[N-]C(=O)C(F)(F)F)cc1 ZINC001240503491 1056540420 /nfs/dbraw/zinc/54/04/20/1056540420.db2.gz MUICVOFTNUTLOJ-VIFPVBQESA-N -1 1 313.344 4.463 20 0 DIADMM O=C(N[C@@H](c1ccccc1)C1CCC1)c1cc(Cl)ccc1[O-] ZINC001585424493 1056552403 /nfs/dbraw/zinc/55/24/03/1056552403.db2.gz ZGAKUGYXNJABGI-KRWDZBQOSA-N -1 1 315.800 4.317 20 0 DIADMM C[C@@H]1CC[C@H](c2ccccc2)N(C(=O)c2ccc([O-])c(F)c2)C1 ZINC000672228012 1056572572 /nfs/dbraw/zinc/57/25/72/1056572572.db2.gz OSQPHPOKHOTOGR-CXAGYDPISA-N -1 1 313.372 4.145 20 0 DIADMM Cc1ccc(S(=O)(=O)[N-]c2ccc3sccc3c2)cc1 ZINC000034102392 1056588231 /nfs/dbraw/zinc/58/82/31/1056588231.db2.gz JONUORIKZXETNU-UHFFFAOYSA-N -1 1 303.408 4.011 20 0 DIADMM [O-]c1ccc(F)cc1-c1nc(-c2ccccc2)nc2[nH]ccc21 ZINC001240693483 1056646008 /nfs/dbraw/zinc/64/60/08/1056646008.db2.gz DHHJJDYUKBGXBO-UHFFFAOYSA-N -1 1 305.312 4.088 20 0 DIADMM [O-]c1ccc(F)cc1-c1nc2ccccc2nc1N1CCCCC1 ZINC001240696054 1056647002 /nfs/dbraw/zinc/64/70/02/1056647002.db2.gz XNEJWMNBKGBMHR-UHFFFAOYSA-N -1 1 323.371 4.132 20 0 DIADMM [O-]c1ccc(F)cc1-c1ccc(-c2nc3ccccc3[nH]2)cn1 ZINC001240695742 1056647460 /nfs/dbraw/zinc/64/74/60/1056647460.db2.gz PPOZYYVSIWHDBW-UHFFFAOYSA-N -1 1 305.312 4.137 20 0 DIADMM [O-]c1ccc(F)cc1-c1nc(-c2ccncc2)nc2sccc21 ZINC001240696132 1056647873 /nfs/dbraw/zinc/64/78/73/1056647873.db2.gz CIBBTVAPIFNWCP-UHFFFAOYSA-N -1 1 323.352 4.265 20 0 DIADMM CCOc1cc(C(=O)Nc2cc(C)cc(C)c2)cc(Cl)c1[O-] ZINC000215955154 1056680225 /nfs/dbraw/zinc/68/02/25/1056680225.db2.gz OIPVXRGCBIQZSC-UHFFFAOYSA-N -1 1 319.788 4.313 20 0 DIADMM [O-]c1ccc(-c2nc(-c3cccnc3)nc3ccccc32)cc1F ZINC001240783216 1056695215 /nfs/dbraw/zinc/69/52/15/1056695215.db2.gz PWQRJWHSXBHRLY-UHFFFAOYSA-N -1 1 317.323 4.204 20 0 DIADMM [O-]c1ccc(-c2cnc3cc(C(F)(F)F)ccc3n2)cc1F ZINC001240782990 1056696125 /nfs/dbraw/zinc/69/61/25/1056696125.db2.gz LAVQDCBYIXCZDP-UHFFFAOYSA-N -1 1 308.234 4.160 20 0 DIADMM CC(C)[C@H]1CCC[C@H](NC(=O)c2cc3ccccc3cc2[O-])C1 ZINC001616662384 1056696792 /nfs/dbraw/zinc/69/67/92/1056696792.db2.gz VWHSMYLSJHLRPG-YOEHRIQHSA-N -1 1 311.425 4.490 20 0 DIADMM Cc1cnc(-c2ccc([O-])c(F)c2)nc1-c1c(F)cccc1F ZINC001240786450 1056697809 /nfs/dbraw/zinc/69/78/09/1056697809.db2.gz TVNFFAKGDKWESQ-UHFFFAOYSA-N -1 1 316.282 4.242 20 0 DIADMM Cc1cccc(Oc2nc(-c3ccc([O-])c(F)c3)ncc2F)c1 ZINC001240786051 1056697979 /nfs/dbraw/zinc/69/79/79/1056697979.db2.gz JFHPOKCDCXGOPU-UHFFFAOYSA-N -1 1 314.291 4.228 20 0 DIADMM [O-]c1ccc(-c2cncc(SCc3ccccc3)n2)cc1F ZINC001240786500 1056698040 /nfs/dbraw/zinc/69/80/40/1056698040.db2.gz VXVDLUWQDFFZAY-UHFFFAOYSA-N -1 1 312.369 4.281 20 0 DIADMM [O-]c1ccc(-c2nccc(SCc3ccccc3)n2)cc1F ZINC001240786458 1056698076 /nfs/dbraw/zinc/69/80/76/1056698076.db2.gz UEKMDPUXWJVERR-UHFFFAOYSA-N -1 1 312.369 4.281 20 0 DIADMM C[C@H]1CCN(C(=O)Cc2ccc([O-])c(Cl)c2)c2ccccc21 ZINC001626066117 1056715002 /nfs/dbraw/zinc/71/50/02/1056715002.db2.gz ZCTYCGHGEVAZCK-LBPRGKRZSA-N -1 1 315.800 4.129 20 0 DIADMM CCSc1ccc([C@@H](C)NC(=O)c2cccc([O-])c2F)cc1 ZINC001616792649 1056719015 /nfs/dbraw/zinc/71/90/15/1056719015.db2.gz DCQYKYRBPHZBFV-LLVKDONJSA-N -1 1 319.401 4.134 20 0 DIADMM COc1cc(Nc2cc(F)c([O-])c(Cl)c2)cc2cccnc21 ZINC001214491519 1056719341 /nfs/dbraw/zinc/71/93/41/1056719341.db2.gz ABJWLWSFIMYXTJ-UHFFFAOYSA-N -1 1 318.735 4.485 20 0 DIADMM CC(C)C[C@H]1CCCCCN1C(=O)c1c([O-])cccc1Cl ZINC001586491626 1056746907 /nfs/dbraw/zinc/74/69/07/1056746907.db2.gz XXQACPSEGOLLID-CYBMUJFWSA-N -1 1 309.837 4.477 20 0 DIADMM CCC(CC)[C@H](NC(=O)c1cccc([O-])c1F)c1ccccc1 ZINC001586623990 1056770031 /nfs/dbraw/zinc/77/00/31/1056770031.db2.gz NUSRHJZOCIBMRW-SFHVURJKSA-N -1 1 315.388 4.439 20 0 DIADMM [O-]c1cccnc1-c1nc(-c2ccc(-c3ccccc3)cc2)no1 ZINC001212480860 1056790394 /nfs/dbraw/zinc/79/03/94/1056790394.db2.gz MZTRUQHURRGNNN-UHFFFAOYSA-N -1 1 315.332 4.171 20 0 DIADMM Cc1ccc(C(=O)[O-])cc1-c1cccc2nc(C(F)(F)F)[nH]c21 ZINC001241005788 1056810481 /nfs/dbraw/zinc/81/04/81/1056810481.db2.gz UARFJLCJAZTEEA-UHFFFAOYSA-N -1 1 320.270 4.255 20 0 DIADMM CCOC(=O)c1nc2cc(-c3cc(C)c(OC)c(C)c3)ccc2[n-]1 ZINC001241019977 1056822740 /nfs/dbraw/zinc/82/27/40/1056822740.db2.gz QWNZBZXCSFZKRZ-UHFFFAOYSA-N -1 1 324.380 4.032 20 0 DIADMM CCOC(=O)c1nc2ccc(-c3cc(C)c(OC)c(C)c3)cc2[n-]1 ZINC001241019977 1056822745 /nfs/dbraw/zinc/82/27/45/1056822745.db2.gz QWNZBZXCSFZKRZ-UHFFFAOYSA-N -1 1 324.380 4.032 20 0 DIADMM O=C(N[C@@H]1CC[C@@H]2CCC[C@@H]2C1)c1ccc2ccccc2c1[O-] ZINC001617425277 1056830933 /nfs/dbraw/zinc/83/09/33/1056830933.db2.gz HLAKSSRNHJHZSU-NUEKZKHPSA-N -1 1 309.409 4.244 20 0 DIADMM O=C(N[C@@H]1CC[C@H]2CCC[C@@H]2C1)c1ccc2ccccc2c1[O-] ZINC001617425275 1056831061 /nfs/dbraw/zinc/83/10/61/1056831061.db2.gz HLAKSSRNHJHZSU-FVQBIDKESA-N -1 1 309.409 4.244 20 0 DIADMM Cc1ccc(Oc2nc(-c3ccc(C)cc3[O-])ncc2F)cc1 ZINC001241036326 1056833917 /nfs/dbraw/zinc/83/39/17/1056833917.db2.gz UBDNYHGQJZKGBB-UHFFFAOYSA-N -1 1 310.328 4.397 20 0 DIADMM CSc1ccc(Cl)c(C(=O)Nc2c([O-])cccc2F)c1 ZINC000078807014 1056879671 /nfs/dbraw/zinc/87/96/71/1056879671.db2.gz WTCCMKQTQCSBBQ-UHFFFAOYSA-N -1 1 311.765 4.159 20 0 DIADMM C[C@@H]1CCC[C@@H](C)N(C(=O)c2ccc(C(F)(F)F)c([O-])c2)C1 ZINC001617797401 1056885270 /nfs/dbraw/zinc/88/52/70/1056885270.db2.gz NEOCZJLKBLUUMY-GHMZBOCLSA-N -1 1 315.335 4.062 20 0 DIADMM [O-]c1cc(F)c(-c2cc(C3(C(F)(F)F)CC3)ccn2)c(F)c1 ZINC001241118325 1056904321 /nfs/dbraw/zinc/90/43/21/1056904321.db2.gz CIVVERRIMJQLHM-UHFFFAOYSA-N -1 1 315.241 4.326 20 0 DIADMM CSc1nc2sccc2c(-c2c(F)cc([O-])cc2F)n1 ZINC001241117468 1056905417 /nfs/dbraw/zinc/90/54/17/1056905417.db2.gz PTURUMYSEIWYCW-UHFFFAOYSA-N -1 1 310.350 4.064 20 0 DIADMM [O-]c1cc(F)c(-c2cnc3[nH]c(-c4ccccc4)nc3c2)c(F)c1 ZINC001241122555 1056906180 /nfs/dbraw/zinc/90/61/80/1056906180.db2.gz SNWSLADBOXIMOC-UHFFFAOYSA-N -1 1 323.302 4.276 20 0 DIADMM CC(C)(C)OC(=O)Nc1ccc(-c2c(F)cc([O-])cc2F)nc1 ZINC001241119718 1056906696 /nfs/dbraw/zinc/90/66/96/1056906696.db2.gz JBUJUVXKGJPTDS-UHFFFAOYSA-N -1 1 322.311 4.079 20 0 DIADMM CCOC(OCC)c1ccccc1-c1c(F)cc([O-])cc1F ZINC001241120782 1056906772 /nfs/dbraw/zinc/90/67/72/1056906772.db2.gz KWEUYLOCAMVPCA-UHFFFAOYSA-N -1 1 308.324 4.409 20 0 DIADMM COc1ccc(-c2ccncc2)cc1-c1c(F)cc([O-])cc1F ZINC001241121734 1056906978 /nfs/dbraw/zinc/90/69/78/1056906978.db2.gz DYJUNWXYTHEQBG-UHFFFAOYSA-N -1 1 313.303 4.408 20 0 DIADMM CC[C@H](C(=O)OC)c1ccc(-c2c(F)cc([O-])cc2F)cc1 ZINC001241122649 1056907001 /nfs/dbraw/zinc/90/70/01/1056907001.db2.gz JPZROWTWDVJTLH-ZDUSSCGKSA-N -1 1 306.308 4.004 20 0 DIADMM CCOc1ccc2cc(-c3c(F)cc([O-])cc3F)cnc2c1 ZINC001241121512 1056907016 /nfs/dbraw/zinc/90/70/16/1056907016.db2.gz LKKIASHPICLXGH-UHFFFAOYSA-N -1 1 301.292 4.284 20 0 DIADMM [O-]c1cc(F)c(-c2cccc(OCc3ccccc3)n2)c(F)c1 ZINC001241119615 1056907028 /nfs/dbraw/zinc/90/70/28/1056907028.db2.gz HNEKNAPIUGNCOV-UHFFFAOYSA-N -1 1 313.303 4.311 20 0 DIADMM [O-]c1cc(F)c(-c2ccc(-c3nc4ccccc4[nH]3)cn2)c(F)c1 ZINC001241120164 1056907039 /nfs/dbraw/zinc/90/70/39/1056907039.db2.gz MFOJMGZCCWJWQV-UHFFFAOYSA-N -1 1 323.302 4.276 20 0 DIADMM COc1cccc2c(-c3c(F)cc([O-])cc3F)cc(C)nc12 ZINC001241120678 1056907127 /nfs/dbraw/zinc/90/71/27/1056907127.db2.gz GJEXLHLMSOHDAX-UHFFFAOYSA-N -1 1 301.292 4.203 20 0 DIADMM CC(C)c1ccc2ncnc(-c3c(F)cc([O-])cc3F)c2c1 ZINC001241120460 1056907213 /nfs/dbraw/zinc/90/72/13/1056907213.db2.gz VWBPEOHZCVRRAD-UHFFFAOYSA-N -1 1 300.308 4.404 20 0 DIADMM [O-]c1cc(F)c(-c2cc3c(nn2)-c2ccccc2CCC3)c(F)c1 ZINC001241120343 1056907300 /nfs/dbraw/zinc/90/73/00/1056907300.db2.gz PPWQJHAZBPPUKC-UHFFFAOYSA-N -1 1 324.330 4.283 20 0 DIADMM COc1cccc(C(F)(F)F)c1-c1c(F)cc([O-])cc1F ZINC001241123211 1056908279 /nfs/dbraw/zinc/90/82/79/1056908279.db2.gz VNZOZIUMHVCWFE-UHFFFAOYSA-N -1 1 304.214 4.365 20 0 DIADMM [O-]c1cc(F)c(-c2ccc(O[C@H]3CCCCO3)cc2)c(F)c1 ZINC001241123187 1056908545 /nfs/dbraw/zinc/90/85/45/1056908545.db2.gz UMBXZFUDQKTVRC-INIZCTEOSA-N -1 1 306.308 4.243 20 0 DIADMM [O-]c1cc(F)c(-c2ccc(O[C@H]3CCCCO3)cc2F)c(F)c1 ZINC001241124228 1056908620 /nfs/dbraw/zinc/90/86/20/1056908620.db2.gz DJPZNEPHVFDWAH-INIZCTEOSA-N -1 1 324.298 4.382 20 0 DIADMM COc1cc(-c2c(F)cc([O-])cc2F)ccc1-c1cnc(C)o1 ZINC001241125109 1056910505 /nfs/dbraw/zinc/91/05/05/1056910505.db2.gz RUSGPIFHJLYFQR-UHFFFAOYSA-N -1 1 317.291 4.309 20 0 DIADMM CCc1nc(SCc2cccc(OC)c2Cl)[n-]c(=O)c1C ZINC000657264211 1056911552 /nfs/dbraw/zinc/91/15/52/1056911552.db2.gz JWNVJBZVXFJMLJ-UHFFFAOYSA-N -1 1 324.833 4.007 20 0 DIADMM CCCCOc1ccc(-c2ccc3[n-]c(C(=O)OC)nc3c2)cc1 ZINC001241268324 1056988367 /nfs/dbraw/zinc/98/83/67/1056988367.db2.gz JYVPPFSZOQWHMW-UHFFFAOYSA-N -1 1 324.380 4.195 20 0 DIADMM CCCCOc1ccc(-c2ccc3nc(C(=O)OC)[n-]c3c2)cc1 ZINC001241268324 1056988376 /nfs/dbraw/zinc/98/83/76/1056988376.db2.gz JYVPPFSZOQWHMW-UHFFFAOYSA-N -1 1 324.380 4.195 20 0 DIADMM [O-]c1ccc(F)c(-c2cccc(OCc3ccccc3)n2)c1F ZINC001241289151 1056998796 /nfs/dbraw/zinc/99/87/96/1056998796.db2.gz MBYCUMAZUWIPOM-UHFFFAOYSA-N -1 1 313.303 4.311 20 0 DIADMM C[C@@H]1CCCCN1c1cccc(-c2c(F)ccc([O-])c2F)n1 ZINC001241289792 1056998838 /nfs/dbraw/zinc/99/88/38/1056998838.db2.gz DVXSUTLTZFLBEO-LLVKDONJSA-N -1 1 304.340 4.111 20 0 DIADMM [O-]c1ccc(F)c(-c2nnc(C3CC3)cc2C(F)(F)F)c1F ZINC001241291079 1056999650 /nfs/dbraw/zinc/99/96/50/1056999650.db2.gz ZFDGRDOLSAFHEG-UHFFFAOYSA-N -1 1 316.229 4.024 20 0 DIADMM CC[C@@H](C)c1nc2[nH]ccc2c(-c2c(F)ccc([O-])c2F)n1 ZINC001241291843 1056999661 /nfs/dbraw/zinc/99/96/61/1056999661.db2.gz ZJJRMSHASXVKQH-MRVPVSSYSA-N -1 1 303.312 4.074 20 0 DIADMM CC(C)(C)[C@H]1CCc2nnc(-c3c(F)ccc([O-])c3F)cc2C1 ZINC001241291586 1057000096 /nfs/dbraw/zinc/00/00/96/1057000096.db2.gz RHWDCLCAEXISIR-NSHDSACASA-N -1 1 318.367 4.278 20 0 DIADMM Cc1nc(-c2ccccc2)nc(-c2c(F)ccc([O-])c2F)c1F ZINC001241290911 1057000283 /nfs/dbraw/zinc/00/02/83/1057000283.db2.gz XCXLXCZZKSFYTG-UHFFFAOYSA-N -1 1 316.282 4.242 20 0 DIADMM C[C@@H](CC(C)(C)c1ccccc1)NC(=O)c1cccc([O-])c1F ZINC001626089164 1057092183 /nfs/dbraw/zinc/09/21/83/1057092183.db2.gz JKBQWYOQQASAHS-ZDUSSCGKSA-N -1 1 315.388 4.018 20 0 DIADMM C[C@H](CC(C)(C)c1ccccc1)NC(=O)c1cccc([O-])c1F ZINC001626089163 1057092421 /nfs/dbraw/zinc/09/24/21/1057092421.db2.gz JKBQWYOQQASAHS-CYBMUJFWSA-N -1 1 315.388 4.018 20 0 DIADMM CCCOc1cccc(-c2ccc3[n-]c(C(=O)OCC)nc3c2)c1 ZINC001241593055 1057102949 /nfs/dbraw/zinc/10/29/49/1057102949.db2.gz DHQNBCLIBHATSA-UHFFFAOYSA-N -1 1 324.380 4.195 20 0 DIADMM CCCOc1cccc(-c2ccc3nc(C(=O)OCC)[n-]c3c2)c1 ZINC001241593055 1057102953 /nfs/dbraw/zinc/10/29/53/1057102953.db2.gz DHQNBCLIBHATSA-UHFFFAOYSA-N -1 1 324.380 4.195 20 0 DIADMM O=C([O-])c1cc(F)cc(-c2cccc3nc(C(F)(F)F)[nH]c32)c1 ZINC001241837371 1057183903 /nfs/dbraw/zinc/18/39/03/1057183903.db2.gz RXNPFVBXMHFPLZ-UHFFFAOYSA-N -1 1 324.233 4.086 20 0 DIADMM Cc1cc(-c2ccc([C@H](C)[N-]C(=O)C(F)(F)F)cc2)cc(C)n1 ZINC001241996642 1057234350 /nfs/dbraw/zinc/23/43/50/1057234350.db2.gz XWAFSOUHZDVPEN-LBPRGKRZSA-N -1 1 322.330 4.105 20 0 DIADMM [O-]c1ccc(C(F)(F)F)cc1-c1ncnc2ccc(F)cc21 ZINC001242126453 1057271628 /nfs/dbraw/zinc/27/16/28/1057271628.db2.gz LNENZTGFJBCCJC-UHFFFAOYSA-N -1 1 308.234 4.160 20 0 DIADMM Cc1cc2c(ncnc2-c2cc(C(F)(F)F)ccc2[O-])s1 ZINC001242127572 1057271633 /nfs/dbraw/zinc/27/16/33/1057271633.db2.gz ZWUHWTADEJAIQX-UHFFFAOYSA-N -1 1 310.300 4.391 20 0 DIADMM [O-]c1ccc(C(F)(F)F)cc1-c1ncccc1OC(F)(F)F ZINC001242131318 1057273513 /nfs/dbraw/zinc/27/35/13/1057273513.db2.gz HHIGAXLNEIFPFI-UHFFFAOYSA-N -1 1 323.192 4.372 20 0 DIADMM CC[C@@H](C)Oc1nccnc1-c1cc(C(F)(F)F)ccc1[O-] ZINC001242133012 1057274856 /nfs/dbraw/zinc/27/48/56/1057274856.db2.gz AXWFITUPAYPMRW-SECBINFHSA-N -1 1 312.291 4.045 20 0 DIADMM [O-]c1ccc(C(F)(F)F)cc1-c1nccc2c3c([nH]c21)CCC3 ZINC001242134253 1057274907 /nfs/dbraw/zinc/27/49/07/1057274907.db2.gz VKZWULOGBVGSLR-UHFFFAOYSA-N -1 1 318.298 4.443 20 0 DIADMM Cc1nc(C2CC2)nc(-c2cc(C(F)(F)F)ccc2[O-])c1F ZINC001242134118 1057274946 /nfs/dbraw/zinc/27/49/46/1057274946.db2.gz TYDMUFUVEXUSIO-UHFFFAOYSA-N -1 1 312.266 4.193 20 0 DIADMM Cc1ccc2c(c1)ncnc2-c1ccc([O-])c(C(F)(F)F)c1 ZINC001242151046 1057280584 /nfs/dbraw/zinc/28/05/84/1057280584.db2.gz FAZGLTOSUJGISS-UHFFFAOYSA-N -1 1 304.271 4.330 20 0 DIADMM [O-]c1ccc(-c2ccc(OC(F)F)cn2)cc1C(F)(F)F ZINC001242150949 1057281014 /nfs/dbraw/zinc/28/10/14/1057281014.db2.gz APYAFGWIZKRPBZ-UHFFFAOYSA-N -1 1 305.202 4.074 20 0 DIADMM Nc1cc(C(F)(F)F)cnc1-c1ccc([O-])c(C(F)(F)F)c1 ZINC001242152290 1057281055 /nfs/dbraw/zinc/28/10/55/1057281055.db2.gz BZAMLTUMEGTSRA-UHFFFAOYSA-N -1 1 322.208 4.074 20 0 DIADMM COc1c(C)nc(C2CC2)nc1-c1ccc([O-])c(C(F)(F)F)c1 ZINC001242158262 1057284333 /nfs/dbraw/zinc/28/43/33/1057284333.db2.gz VIJXAVBSRMCNBC-UHFFFAOYSA-N -1 1 324.302 4.062 20 0 DIADMM Cc1ccc(-c2cncc(C(=O)Nc3c([O-])cccc3F)c2)cc1 ZINC000675143872 1057320743 /nfs/dbraw/zinc/32/07/43/1057320743.db2.gz RREOJQVMWHYIHI-UHFFFAOYSA-N -1 1 322.339 4.154 20 0 DIADMM [O-]c1c(F)cccc1-c1ccc(OC(F)(F)F)c(F)c1F ZINC001242351498 1057342698 /nfs/dbraw/zinc/34/26/98/1057342698.db2.gz XBUOAEDTBDJDGO-UHFFFAOYSA-N -1 1 308.177 4.375 20 0 DIADMM [O-]c1c(Cl)cccc1-c1cnc(OCc2ccccc2)nc1 ZINC001242366204 1057347029 /nfs/dbraw/zinc/34/70/29/1057347029.db2.gz RVMHPMMNLMGFGR-UHFFFAOYSA-N -1 1 312.756 4.082 20 0 DIADMM COC(=O)C(C)(C)c1ccc(-c2cccc(Cl)c2[O-])cc1 ZINC001242365907 1057347309 /nfs/dbraw/zinc/34/73/09/1057347309.db2.gz BDXJPOURRAMMAM-UHFFFAOYSA-N -1 1 304.773 4.163 20 0 DIADMM [O-]c1c(Cl)cccc1-c1ccc(OCc2ccccn2)nc1 ZINC001242367005 1057348159 /nfs/dbraw/zinc/34/81/59/1057348159.db2.gz GIEMJALFSPONEK-UHFFFAOYSA-N -1 1 312.756 4.082 20 0 DIADMM COC(=O)c1cc(-c2cccc(Cl)c2[O-])cc2cccnc21 ZINC001242366986 1057348353 /nfs/dbraw/zinc/34/83/53/1057348353.db2.gz FXUZCKUXJUJUOX-UHFFFAOYSA-N -1 1 313.740 4.047 20 0 DIADMM COc1ncc(-c2cccc(Cl)c2[O-])cc1C(F)(F)F ZINC001242366411 1057348389 /nfs/dbraw/zinc/34/83/89/1057348389.db2.gz LSOMYIJHLCZKNS-UHFFFAOYSA-N -1 1 303.667 4.135 20 0 DIADMM O=c1cc(-c2cccc(Cl)c2[O-])ccn1-c1ccc(F)cc1 ZINC001242367211 1057348428 /nfs/dbraw/zinc/34/84/28/1057348428.db2.gz ITFISJXGEPLJBZ-UHFFFAOYSA-N -1 1 315.731 4.003 20 0 DIADMM CC1(C)CC(=O)Nc2cc(-c3cccc(Cl)c3[O-])ccc21 ZINC001242366520 1057348444 /nfs/dbraw/zinc/34/84/44/1057348444.db2.gz ZBWHHQVMCODVIY-UHFFFAOYSA-N -1 1 301.773 4.332 20 0 DIADMM Cc1noc(-c2ccc(-c3cccc(Cl)c3[O-])cc2)c1N ZINC001242367742 1057348935 /nfs/dbraw/zinc/34/89/35/1057348935.db2.gz RDDMFBUFHACRBT-UHFFFAOYSA-N -1 1 300.745 4.258 20 0 DIADMM CC[C@@H](C(=O)OC)c1ccc(-c2cccc(Cl)c2[O-])cc1 ZINC001242367461 1057348989 /nfs/dbraw/zinc/34/89/89/1057348989.db2.gz NJNYIGIVGJNWSR-CYBMUJFWSA-N -1 1 304.773 4.379 20 0 DIADMM C=C(C(=O)OCC)c1ccc(-c2cccc(Cl)c2[O-])cc1 ZINC001242367712 1057349058 /nfs/dbraw/zinc/34/90/58/1057349058.db2.gz QRKDHRGXJLEXIG-UHFFFAOYSA-N -1 1 302.757 4.289 20 0 DIADMM Cc1cc(-c2cccc(Cl)c2[O-])cnc1OCC(F)(F)F ZINC001242366901 1057349118 /nfs/dbraw/zinc/34/91/18/1057349118.db2.gz DIBLMYAILYSZRE-UHFFFAOYSA-N -1 1 317.694 4.357 20 0 DIADMM CCOC(=O)c1nc2cc(-c3cnc4sccc4c3)ccc2[n-]1 ZINC001242682123 1057446428 /nfs/dbraw/zinc/44/64/28/1057446428.db2.gz KFDLRRYHPPRBAQ-UHFFFAOYSA-N -1 1 323.377 4.016 20 0 DIADMM CCOC(=O)c1nc2ccc(-c3cnc4sccc4c3)cc2[n-]1 ZINC001242682123 1057446431 /nfs/dbraw/zinc/44/64/31/1057446431.db2.gz KFDLRRYHPPRBAQ-UHFFFAOYSA-N -1 1 323.377 4.016 20 0 DIADMM COC(=O)c1ccc2nc(-c3cccc([O-])c3Cl)ccc2c1 ZINC001242796978 1057480073 /nfs/dbraw/zinc/48/00/73/1057480073.db2.gz DPUDPESUPNPPQS-UHFFFAOYSA-N -1 1 313.740 4.047 20 0 DIADMM [O-]c1cccc(-c2ncc(F)c(-c3ccsc3)n2)c1Cl ZINC001242799436 1057480891 /nfs/dbraw/zinc/48/08/91/1057480891.db2.gz KUJJRHQUIVBZBW-UHFFFAOYSA-N -1 1 306.749 4.370 20 0 DIADMM COc1cc2ccnc(-c3cccc([O-])c3Cl)c2cc1F ZINC001242799324 1057481015 /nfs/dbraw/zinc/48/10/15/1057481015.db2.gz FLKKVBWRSXINHZ-UHFFFAOYSA-N -1 1 303.720 4.409 20 0 DIADMM COc1cc2nccc(-c3cccc([O-])c3Cl)c2cc1OC ZINC001242799818 1057481113 /nfs/dbraw/zinc/48/11/13/1057481113.db2.gz DSWNSSVHFIWPLR-UHFFFAOYSA-N -1 1 315.756 4.278 20 0 DIADMM C[C@H]1CCCCN1c1cccc(-c2cccc([O-])c2Cl)n1 ZINC001242801656 1057481772 /nfs/dbraw/zinc/48/17/72/1057481772.db2.gz VHNWRXICDNPHRB-LBPRGKRZSA-N -1 1 302.805 4.486 20 0 DIADMM COC(=O)c1cc(-c2cccc([O-])c2Cl)nc2ccccc21 ZINC001242801380 1057481778 /nfs/dbraw/zinc/48/17/78/1057481778.db2.gz RJWGGCAEEQBDAC-UHFFFAOYSA-N -1 1 313.740 4.047 20 0 DIADMM COc1ccc(-c2cc(-c3cccc([O-])c3Cl)ncn2)cc1 ZINC001242800609 1057482172 /nfs/dbraw/zinc/48/21/72/1057482172.db2.gz ISSZZYUTCIIRCF-UHFFFAOYSA-N -1 1 312.756 4.178 20 0 DIADMM [O-]c1cccc(-c2ccc(-c3ccc(F)cc3F)nn2)c1Cl ZINC001242800884 1057482202 /nfs/dbraw/zinc/48/22/02/1057482202.db2.gz LEXXYAJSLQRXEQ-UHFFFAOYSA-N -1 1 318.710 4.448 20 0 DIADMM COc1cc(-c2cccc([O-])c2Cl)ccc1OC(F)F ZINC001242801017 1057482353 /nfs/dbraw/zinc/48/23/53/1057482353.db2.gz RAJVIMWWDASKNP-UHFFFAOYSA-N -1 1 300.688 4.323 20 0 DIADMM COc1cc2ccnc(-c3cccc([O-])c3Cl)c2cc1OC ZINC001242800300 1057482381 /nfs/dbraw/zinc/48/23/81/1057482381.db2.gz GARHNYHERCHPFI-UHFFFAOYSA-N -1 1 315.756 4.278 20 0 DIADMM CC(C)(C)c1nnc2ccc(-c3cccc([O-])c3Cl)cn21 ZINC001242802081 1057482909 /nfs/dbraw/zinc/48/29/09/1057482909.db2.gz PRWPMCOLMNRUEX-UHFFFAOYSA-N -1 1 301.777 4.053 20 0 DIADMM CCOC(=O)c1c[nH]c2cc(-c3cccc([O-])c3Cl)ccc21 ZINC001242802530 1057483423 /nfs/dbraw/zinc/48/34/23/1057483423.db2.gz KLBLPLMXODMKIB-UHFFFAOYSA-N -1 1 315.756 4.371 20 0 DIADMM O=c1cc(-c2cccc([O-])c2Cl)ccn1-c1ccc(F)cc1 ZINC001242802371 1057483454 /nfs/dbraw/zinc/48/34/54/1057483454.db2.gz YWQSMLZCAKUMAN-UHFFFAOYSA-N -1 1 315.731 4.003 20 0 DIADMM [O-]c1cc(-c2nccc(SCc3ccccc3)n2)ccc1F ZINC001243049023 1057557666 /nfs/dbraw/zinc/55/76/66/1057557666.db2.gz KGPXNFRIFMEDFT-UHFFFAOYSA-N -1 1 312.369 4.281 20 0 DIADMM [O-]c1cc(-c2ncc3ccc(C(F)(F)F)cc3n2)ccc1F ZINC001243053843 1057559554 /nfs/dbraw/zinc/55/95/54/1057559554.db2.gz HDJHOFLLOOPMDJ-UHFFFAOYSA-N -1 1 308.234 4.160 20 0 DIADMM O=S(=O)([N-]c1ccccc1)c1ccc2oc3ccccc3c2c1 ZINC000135833286 1057563068 /nfs/dbraw/zinc/56/30/68/1057563068.db2.gz SOEFBEOCLSJNOT-UHFFFAOYSA-N -1 1 323.373 4.387 20 0 DIADMM Cc1c2[nH]cnc2ccc1-c1ccc(C(=O)[O-])c(C(F)(F)F)c1 ZINC001243158748 1057590273 /nfs/dbraw/zinc/59/02/73/1057590273.db2.gz UFUMACLAFCTPTM-UHFFFAOYSA-N -1 1 320.270 4.255 20 0 DIADMM Cc1cc(C(=O)[O-])cc(-c2ccc3nc(C(F)(F)F)[nH]c3c2)c1 ZINC001243182768 1057596010 /nfs/dbraw/zinc/59/60/10/1057596010.db2.gz QJOMVNIXVIAOFP-UHFFFAOYSA-N -1 1 320.270 4.255 20 0 DIADMM CC(C)(C)OC(=O)Nc1ccc(-c2ccc([O-])c(F)c2F)nc1 ZINC001243338990 1057651044 /nfs/dbraw/zinc/65/10/44/1057651044.db2.gz GKPUMGMZIDDIIF-UHFFFAOYSA-N -1 1 322.311 4.079 20 0 DIADMM [O-]c1ccc(-c2cccc(OCc3ccccc3)n2)c(F)c1F ZINC001243339059 1057651722 /nfs/dbraw/zinc/65/17/22/1057651722.db2.gz JLHCOVCXTGENTH-UHFFFAOYSA-N -1 1 313.303 4.311 20 0 DIADMM COC(=O)[C@H](c1ccc(-c2ccc([O-])c(F)c2F)cc1)C(C)C ZINC001243342284 1057652762 /nfs/dbraw/zinc/65/27/62/1057652762.db2.gz DQHZFIUQXQTFJP-HNNXBMFYSA-N -1 1 320.335 4.250 20 0 DIADMM CC(C)(C)OC(=O)Nc1cc(-c2ccc([O-])c(F)c2F)ccn1 ZINC001243342321 1057652844 /nfs/dbraw/zinc/65/28/44/1057652844.db2.gz GRQWWBFXRDUTKM-UHFFFAOYSA-N -1 1 322.311 4.079 20 0 DIADMM [O-]c1ccc(-c2ccc(OCc3ccccc3)cn2)c(F)c1F ZINC001243340952 1057652854 /nfs/dbraw/zinc/65/28/54/1057652854.db2.gz ABZUECJSRURDJF-UHFFFAOYSA-N -1 1 313.303 4.311 20 0 DIADMM CCOC(=O)c1cc2cc(-c3ccc([O-])c(F)c3F)ccc2o1 ZINC001243342767 1057653011 /nfs/dbraw/zinc/65/30/11/1057653011.db2.gz TUNUKWQIUOQEEX-UHFFFAOYSA-N -1 1 318.275 4.260 20 0 DIADMM CCOC(=O)/C=C/c1ccc(-c2ccc([O-])c(F)c2F)c(F)c1 ZINC001243341835 1057653226 /nfs/dbraw/zinc/65/32/26/1057653226.db2.gz YOOWUEZFZJIWPL-XBXARRHUSA-N -1 1 322.282 4.053 20 0 DIADMM CSc1ncc2cc(-c3ccc([O-])c(F)c3F)ccc2n1 ZINC001243342376 1057653255 /nfs/dbraw/zinc/65/32/55/1057653255.db2.gz IBMUVSWBZZBMQU-UHFFFAOYSA-N -1 1 304.321 4.003 20 0 DIADMM CC(C)(C)OC(=O)c1ccccc1-c1ccc([O-])c(F)c1F ZINC001243342479 1057653417 /nfs/dbraw/zinc/65/34/17/1057653417.db2.gz GATBCCZBVHZJAD-UHFFFAOYSA-N -1 1 306.308 4.293 20 0 DIADMM COC(=O)c1cccc2cc(-c3ccc([O-])c(F)c3F)ccc21 ZINC001243344565 1057653869 /nfs/dbraw/zinc/65/38/69/1057653869.db2.gz GNMAWEOQBPYBLS-UHFFFAOYSA-N -1 1 314.287 4.277 20 0 DIADMM COc1cc(-c2ccc([O-])c(F)c2F)ccc1OC(F)(F)F ZINC001243345874 1057654966 /nfs/dbraw/zinc/65/49/66/1057654966.db2.gz UYOIDTMYKOCTGA-UHFFFAOYSA-N -1 1 320.213 4.245 20 0 DIADMM [O-]c1c(F)cc(F)cc1-c1cc(F)c(OC(F)F)c(F)c1 ZINC001243502296 1057696630 /nfs/dbraw/zinc/69/66/30/1057696630.db2.gz KAGWGUFLNNXACT-UHFFFAOYSA-N -1 1 308.177 4.217 20 0 DIADMM COc1cc(OC(F)(F)F)ccc1-c1cc(F)cc(F)c1[O-] ZINC001243503415 1057696819 /nfs/dbraw/zinc/69/68/19/1057696819.db2.gz BXVDKEWUWGPNNS-UHFFFAOYSA-N -1 1 320.213 4.245 20 0 DIADMM [O-]c1c(F)cc(F)cc1-c1ccc(F)c(OC(F)(F)F)c1 ZINC001243504153 1057697169 /nfs/dbraw/zinc/69/71/69/1057697169.db2.gz ZAJDCTOVSQSJME-UHFFFAOYSA-N -1 1 308.177 4.375 20 0 DIADMM [O-]c1c(F)cc(F)cc1-c1cccnc1OCc1ccccc1 ZINC001243502198 1057697347 /nfs/dbraw/zinc/69/73/47/1057697347.db2.gz GNJCHHZCOIWCSE-UHFFFAOYSA-N -1 1 313.303 4.311 20 0 DIADMM [O-]c1c(F)cc(F)cc1-c1cncc(OCc2ccccc2)c1 ZINC001243504761 1057697608 /nfs/dbraw/zinc/69/76/08/1057697608.db2.gz PWIXBPMWFKDYOF-UHFFFAOYSA-N -1 1 313.303 4.311 20 0 DIADMM CCOC(=O)[C@@H](CC)c1ccc(-c2cc(F)cc(F)c2[O-])cc1 ZINC001243504963 1057697703 /nfs/dbraw/zinc/69/77/03/1057697703.db2.gz CECDPWVUTJCMBG-AWEZNQCLSA-N -1 1 320.335 4.394 20 0 DIADMM CC(C)(C)OC(=O)c1ccccc1-c1cc(F)cc(F)c1[O-] ZINC001243504758 1057697808 /nfs/dbraw/zinc/69/78/08/1057697808.db2.gz PVGWBAJLKFMXIG-UHFFFAOYSA-N -1 1 306.308 4.293 20 0 DIADMM COc1ccc(-c2cc(F)cc(F)c2[O-])c2ccc(C)nc12 ZINC001243505443 1057697841 /nfs/dbraw/zinc/69/78/41/1057697841.db2.gz SBSWIGLXMNGASS-UHFFFAOYSA-N -1 1 301.292 4.203 20 0 DIADMM COc1cccc(-c2cc(F)cc(F)c2[O-])c1C(F)(F)F ZINC001243506639 1057697989 /nfs/dbraw/zinc/69/79/89/1057697989.db2.gz GUWDUFFMHHNJQH-UHFFFAOYSA-N -1 1 304.214 4.365 20 0 DIADMM CC(C)(C)OC(=O)Cc1cccc(-c2cc(F)cc(F)c2[O-])c1 ZINC001243507575 1057698639 /nfs/dbraw/zinc/69/86/39/1057698639.db2.gz ZALUXNDPQUXQMB-UHFFFAOYSA-N -1 1 320.335 4.222 20 0 DIADMM [O-]c1cccc(-c2ncc3ccc(C(F)(F)F)cc3n2)c1F ZINC001243540991 1057708691 /nfs/dbraw/zinc/70/86/91/1057708691.db2.gz BPQGYSZPLDAYJM-UHFFFAOYSA-N -1 1 308.234 4.160 20 0 DIADMM [O-]c1cc(-c2ccc(OCc3ccccc3)nn2)ccc1Cl ZINC001243576854 1057720590 /nfs/dbraw/zinc/72/05/90/1057720590.db2.gz VNTMNINNROAVSK-UHFFFAOYSA-N -1 1 312.756 4.082 20 0 DIADMM COC(=O)c1cc2ccccc2nc1-c1ccc(Cl)c([O-])c1 ZINC001243576886 1057720878 /nfs/dbraw/zinc/72/08/78/1057720878.db2.gz WQBLHYIPIUPOIY-UHFFFAOYSA-N -1 1 313.740 4.047 20 0 DIADMM Cc1nc2ccc(-c3ccc(Cl)c([O-])c3)nc2n1C(C)C ZINC001243576213 1057720886 /nfs/dbraw/zinc/72/08/86/1057720886.db2.gz JNLIULBRTNXRMH-UHFFFAOYSA-N -1 1 301.777 4.347 20 0 DIADMM [O-]c1cc(-c2nccnc2C2SCCCS2)ccc1Cl ZINC001243576539 1057720964 /nfs/dbraw/zinc/72/09/64/1057720964.db2.gz KFLBKLPYAJNEAR-UHFFFAOYSA-N -1 1 324.858 4.371 20 0 DIADMM [O-]c1cc(-c2ccc3nc(C(F)(F)F)cn3c2)ccc1Cl ZINC001243578775 1057721644 /nfs/dbraw/zinc/72/16/44/1057721644.db2.gz QQUUEQXNHPKQPL-UHFFFAOYSA-N -1 1 312.678 4.379 20 0 DIADMM COc1nc(-c2ccc(Cl)c([O-])c2)cc2cc(F)ccc21 ZINC001243579439 1057722125 /nfs/dbraw/zinc/72/21/25/1057722125.db2.gz USSPBKJOPRCYJN-UHFFFAOYSA-N -1 1 303.720 4.409 20 0 DIADMM CCCN(CCC)c1cncc(-c2ccc(Cl)c([O-])c2)n1 ZINC001243579726 1057722184 /nfs/dbraw/zinc/72/21/84/1057722184.db2.gz YIDURIBIFCHYIK-UHFFFAOYSA-N -1 1 305.809 4.129 20 0 DIADMM [O-]c1cc(-c2ccc(-c3c[nH]c(=S)[nH]3)cc2)ccc1Cl ZINC001243579202 1057722379 /nfs/dbraw/zinc/72/23/79/1057722379.db2.gz YNQPUBKYYXYYBI-UHFFFAOYSA-N -1 1 302.786 4.391 20 0 DIADMM [O-]c1cc(-c2ncc(F)c(Oc3ccccc3)n2)ccc1Cl ZINC001243579419 1057722662 /nfs/dbraw/zinc/72/26/62/1057722662.db2.gz UGCFMFOQCCPUPU-UHFFFAOYSA-N -1 1 316.719 4.434 20 0 DIADMM COC(=O)c1nccc2c(-c3ccc(Cl)c([O-])c3)cccc12 ZINC001243580367 1057723108 /nfs/dbraw/zinc/72/31/08/1057723108.db2.gz BCXOXNBJVIERAU-UHFFFAOYSA-N -1 1 313.740 4.047 20 0 DIADMM COC(=O)c1nc2c(cccc2-c2ccc(Cl)c([O-])c2)s1 ZINC001243581913 1057723120 /nfs/dbraw/zinc/72/31/20/1057723120.db2.gz MKMUSMQEGORPDO-UHFFFAOYSA-N -1 1 319.769 4.109 20 0 DIADMM [O-]c1cc(-c2cnc(OCc3ccccc3)nc2)ccc1Cl ZINC001243581456 1057723401 /nfs/dbraw/zinc/72/34/01/1057723401.db2.gz FGJUGPIAGMIWKY-UHFFFAOYSA-N -1 1 312.756 4.082 20 0 DIADMM CCOC(=O)C1(c2ccc(-c3ccc(Cl)c([O-])c3)cc2)CC1 ZINC001243581717 1057723461 /nfs/dbraw/zinc/72/34/61/1057723461.db2.gz GDOIKRNYENRFTI-UHFFFAOYSA-N -1 1 316.784 4.307 20 0 DIADMM COC(=O)c1nc2cccc(-c3ccc(Cl)c([O-])c3)c2s1 ZINC001243583087 1057724182 /nfs/dbraw/zinc/72/41/82/1057724182.db2.gz XYRSWRJIWNCPDE-UHFFFAOYSA-N -1 1 319.769 4.109 20 0 DIADMM CC1(C)CC(=O)Nc2cccc(-c3ccc(Cl)c([O-])c3)c21 ZINC001243582466 1057724260 /nfs/dbraw/zinc/72/42/60/1057724260.db2.gz SVFUWTCLKQOHPP-UHFFFAOYSA-N -1 1 301.773 4.332 20 0 DIADMM CC[C@@H](C(=O)OC)c1ccc(-c2ccc(Cl)c([O-])c2)cc1 ZINC001243584160 1057724504 /nfs/dbraw/zinc/72/45/04/1057724504.db2.gz RMWRAWUCCFFJDG-CQSZACIVSA-N -1 1 304.773 4.379 20 0 DIADMM CCOC(=O)c1c[nH]c2cc(-c3ccc(Cl)c([O-])c3)ccc21 ZINC001243584171 1057724971 /nfs/dbraw/zinc/72/49/71/1057724971.db2.gz RYXVSJUCIMGJKO-UHFFFAOYSA-N -1 1 315.756 4.371 20 0 DIADMM [O-]c1cc(C(F)(F)F)ccc1-c1cc(C(F)(F)F)ccn1 ZINC001243604299 1057730548 /nfs/dbraw/zinc/73/05/48/1057730548.db2.gz BTFIGSKNTMJOFO-UHFFFAOYSA-N -1 1 307.193 4.492 20 0 DIADMM CC(C)n1ccc2c1ncnc2-c1ccc(C(F)(F)F)cc1[O-] ZINC001243606972 1057731023 /nfs/dbraw/zinc/73/10/23/1057731023.db2.gz LKQXNBZABPQOJE-UHFFFAOYSA-N -1 1 321.302 4.404 20 0 DIADMM Cc1ccc2ncnc(-c3ccc(C(F)(F)F)cc3[O-])c2c1 ZINC001243607945 1057731747 /nfs/dbraw/zinc/73/17/47/1057731747.db2.gz DZCZLBWOTFHEQB-UHFFFAOYSA-N -1 1 304.271 4.330 20 0 DIADMM Cc1nnc(-c2ccc(C(F)(F)F)cc2[O-])c2ccccc12 ZINC001243609838 1057732400 /nfs/dbraw/zinc/73/24/00/1057732400.db2.gz CTNPWRTWZGGMBT-UHFFFAOYSA-N -1 1 304.271 4.330 20 0 DIADMM Cc1ccc(C[C@@H](C)NC(=O)c2c([O-])cccc2Cl)c(C)c1 ZINC000731231381 1057738835 /nfs/dbraw/zinc/73/88/35/1057738835.db2.gz MOVVOUGCXATJEM-CYBMUJFWSA-N -1 1 317.816 4.023 20 0 DIADMM COc1ccccc1/C(C)=C\C(=O)Nc1ccc([O-])c(Cl)c1 ZINC000732306675 1057772343 /nfs/dbraw/zinc/77/23/43/1057772343.db2.gz NAKIHOIMESKIFD-LUAWRHEFSA-N -1 1 317.772 4.096 20 0 DIADMM C/C(=C/C(=O)Nc1ccc([O-])c(Cl)c1)c1cccc(F)c1 ZINC000732309298 1057772454 /nfs/dbraw/zinc/77/24/54/1057772454.db2.gz OKOHVTKNUCMFSA-YFHOEESVSA-N -1 1 305.736 4.227 20 0 DIADMM Cc1ccc(Oc2ccc(NC(=O)c3ccccc3[O-])cc2)nc1 ZINC000733235013 1057809069 /nfs/dbraw/zinc/80/90/69/1057809069.db2.gz RPQZUGBPAINIGP-UHFFFAOYSA-N -1 1 320.348 4.140 20 0 DIADMM COc1cc2nc(-c3c([O-])cccc3Cl)ccc2c(OC)c1 ZINC001244037968 1057845618 /nfs/dbraw/zinc/84/56/18/1057845618.db2.gz ROLIEDKOOLKQLU-UHFFFAOYSA-N -1 1 315.756 4.278 20 0 DIADMM CC(C)(C)OC(=O)Nc1cc(-c2cc(F)c([O-])c(F)c2)ccn1 ZINC001244094129 1057866582 /nfs/dbraw/zinc/86/65/82/1057866582.db2.gz OSEUDNIUSUYYRF-UHFFFAOYSA-N -1 1 322.311 4.079 20 0 DIADMM CSc1ncc2cc(-c3cc(F)c([O-])c(F)c3)ccc2n1 ZINC001244093169 1057866759 /nfs/dbraw/zinc/86/67/59/1057866759.db2.gz CMPFFCWRYPQQJP-UHFFFAOYSA-N -1 1 304.321 4.003 20 0 DIADMM [O-]c1c(F)cc(-c2ccc(OC(F)(F)F)c(F)c2)cc1F ZINC001244097275 1057867915 /nfs/dbraw/zinc/86/79/15/1057867915.db2.gz SNRZGMDQXIMRRL-UHFFFAOYSA-N -1 1 308.177 4.375 20 0 DIADMM COc1cc(-c2cc(F)c([O-])c(F)c2)ccc1-c1ccncc1 ZINC001244098751 1057868747 /nfs/dbraw/zinc/86/87/47/1057868747.db2.gz QMIWAOHUPZXXNW-UHFFFAOYSA-N -1 1 313.303 4.408 20 0 DIADMM COC(=O)c1cccc2cc(-c3cc(F)c([O-])c(F)c3)ccc21 ZINC001244097972 1057868989 /nfs/dbraw/zinc/86/89/89/1057868989.db2.gz CLKBTDVGEGFJHB-UHFFFAOYSA-N -1 1 314.287 4.277 20 0 DIADMM COC(=O)c1nc2cc(-c3cccc(C4CC4)c3C)ccc2[n-]1 ZINC001244132164 1057881222 /nfs/dbraw/zinc/88/12/22/1057881222.db2.gz KEHYQZMTWGECSG-UHFFFAOYSA-N -1 1 306.365 4.202 20 0 DIADMM COC(=O)c1nc2ccc(-c3cccc(C4CC4)c3C)cc2[n-]1 ZINC001244132164 1057881227 /nfs/dbraw/zinc/88/12/27/1057881227.db2.gz KEHYQZMTWGECSG-UHFFFAOYSA-N -1 1 306.365 4.202 20 0 DIADMM COC(=O)c1nc2cc(-c3cc(F)cc(C)c3Cl)ccc2[n-]1 ZINC001244355488 1057941326 /nfs/dbraw/zinc/94/13/26/1057941326.db2.gz ZPKXNGOQNSFLKB-UHFFFAOYSA-N -1 1 318.735 4.117 20 0 DIADMM COC(=O)c1nc2ccc(-c3cc(F)cc(C)c3Cl)cc2[n-]1 ZINC001244355488 1057941331 /nfs/dbraw/zinc/94/13/31/1057941331.db2.gz ZPKXNGOQNSFLKB-UHFFFAOYSA-N -1 1 318.735 4.117 20 0 DIADMM Cc1ccc([O-])c(-c2nc(C)cc(OCc3ccccc3)n2)c1 ZINC001244402703 1057951169 /nfs/dbraw/zinc/95/11/69/1057951169.db2.gz GPYRVPABQZUTCH-UHFFFAOYSA-N -1 1 306.365 4.045 20 0 DIADMM [O-]c1ccc(OC(F)(F)F)cc1-c1nncc2ccc(F)cc21 ZINC001244457592 1057964005 /nfs/dbraw/zinc/96/40/05/1057964005.db2.gz PPJXVRNWEZJNLC-UHFFFAOYSA-N -1 1 324.233 4.040 20 0 DIADMM CSCc1ccc(-c2ccc(OC(F)(F)F)cc2[O-])nc1 ZINC001244462282 1057965605 /nfs/dbraw/zinc/96/56/05/1057965605.db2.gz IBNCVGAGJFGLMD-UHFFFAOYSA-N -1 1 315.316 4.216 20 0 DIADMM [O-]c1cc(OC(F)(F)F)ccc1-c1ncnc2ccc(F)cc21 ZINC001244463565 1057966012 /nfs/dbraw/zinc/96/60/12/1057966012.db2.gz JMBNXEZNWBAJSY-UHFFFAOYSA-N -1 1 324.233 4.040 20 0 DIADMM [O-]c1cc(OC(F)(F)F)ccc1-c1nncc2ccc(F)cc21 ZINC001244463877 1057966216 /nfs/dbraw/zinc/96/62/16/1057966216.db2.gz GIWDFFIHSIOXIJ-UHFFFAOYSA-N -1 1 324.233 4.040 20 0 DIADMM Cc1cc2cc[nH]c2c(-c2ccc(OC(F)(F)F)cc2[O-])n1 ZINC001244464485 1057966253 /nfs/dbraw/zinc/96/62/53/1057966253.db2.gz NWMMELFSWMHPQX-UHFFFAOYSA-N -1 1 308.259 4.143 20 0 DIADMM O=C([O-])c1cc(Cl)c(-c2cccn3cncc23)c(Cl)c1 ZINC001244518055 1057983866 /nfs/dbraw/zinc/98/38/66/1057983866.db2.gz HDFISQZRCVLABX-UHFFFAOYSA-N -1 1 307.136 4.006 20 0 DIADMM Cc1cc(C(F)(F)F)nc(-c2cc(C)c([O-])c(Cl)c2)n1 ZINC001244531124 1057987292 /nfs/dbraw/zinc/98/72/92/1057987292.db2.gz GCSCCFQCFZGUKB-UHFFFAOYSA-N -1 1 302.683 4.138 20 0 DIADMM COc1cc2c(cc1F)ncnc2-c1cc(C)c([O-])c(Cl)c1 ZINC001244530951 1057987379 /nfs/dbraw/zinc/98/73/79/1057987379.db2.gz FEQGRJDJWZLQQR-UHFFFAOYSA-N -1 1 318.735 4.112 20 0 DIADMM Cc1nc(-c2cc(C)c([O-])c(Cl)c2)cc(C(F)(F)F)n1 ZINC001244531413 1057987498 /nfs/dbraw/zinc/98/74/98/1057987498.db2.gz ZFWHYJSIKCWFKW-UHFFFAOYSA-N -1 1 302.683 4.138 20 0 DIADMM Cc1cc(C(F)(F)F)c(-c2cc(C)c([O-])c(Cl)c2)nn1 ZINC001244536624 1057989232 /nfs/dbraw/zinc/98/92/32/1057989232.db2.gz KKRKDHKQGCQBSM-UHFFFAOYSA-N -1 1 302.683 4.138 20 0 DIADMM [O-]c1ccc(Cl)c(-c2nccc(-c3ccccc3)n2)c1F ZINC001244537913 1057989603 /nfs/dbraw/zinc/98/96/03/1057989603.db2.gz IDVNOPJLJLXAJS-UHFFFAOYSA-N -1 1 300.720 4.309 20 0 DIADMM CC(C)n1ccc2c1ncnc2-c1c(Cl)ccc([O-])c1F ZINC001244539031 1057989659 /nfs/dbraw/zinc/98/96/59/1057989659.db2.gz PEZCCZKIHCUEHK-UHFFFAOYSA-N -1 1 305.740 4.177 20 0 DIADMM Cc1sc2ncnc(-c3c(Cl)ccc([O-])c3F)c2c1C ZINC001244538405 1057989703 /nfs/dbraw/zinc/98/97/03/1057989703.db2.gz LVMRYHQVBKHUBJ-UHFFFAOYSA-N -1 1 308.765 4.473 20 0 DIADMM CC(C)(C)OC(=O)c1ccnc(-c2c(Cl)ccc([O-])c2F)c1 ZINC001244538936 1057989720 /nfs/dbraw/zinc/98/97/20/1057989720.db2.gz RESKWFHDUJLEKV-UHFFFAOYSA-N -1 1 323.751 4.202 20 0 DIADMM Cc1cc(-c2ncnc3c(F)c(F)ccc32)cc(Cl)c1[O-] ZINC001244538010 1057989908 /nfs/dbraw/zinc/98/99/08/1057989908.db2.gz IFLKHUNDQMDQKB-UHFFFAOYSA-N -1 1 306.699 4.242 20 0 DIADMM COc1cc(-c2c(Cl)ccc([O-])c2F)nc2ccccc21 ZINC001244538181 1057989958 /nfs/dbraw/zinc/98/99/58/1057989958.db2.gz KNZOEXCMUQFIHM-UHFFFAOYSA-N -1 1 303.720 4.409 20 0 DIADMM Cc1nc(C(F)(F)F)nc(-c2c(Cl)ccc([O-])c2F)c1C ZINC001244539467 1057990454 /nfs/dbraw/zinc/99/04/54/1057990454.db2.gz XFPGIARNRSWRAX-UHFFFAOYSA-N -1 1 320.673 4.277 20 0 DIADMM CC(C)c1nc2[nH]ccc2c(-c2c(Cl)ccc([O-])c2F)n1 ZINC001244539910 1057990901 /nfs/dbraw/zinc/99/09/01/1057990901.db2.gz NEOUTJAPEUBLRK-UHFFFAOYSA-N -1 1 305.740 4.198 20 0 DIADMM [O-]c1ccc(Cl)c(-c2cccc(COCC3CC3)n2)c1F ZINC001244539764 1057990970 /nfs/dbraw/zinc/99/09/70/1057990970.db2.gz GYYGQMAMEYJKNR-UHFFFAOYSA-N -1 1 307.752 4.173 20 0 DIADMM CC1(C)Cc2cc(-c3c(Cl)ccc([O-])c3F)ccc2NC1=O ZINC001244541609 1057991234 /nfs/dbraw/zinc/99/12/34/1057991234.db2.gz SACCNQFZBHOSOO-UHFFFAOYSA-N -1 1 319.763 4.373 20 0 DIADMM CCOC(=O)CCc1ccc(-c2c(Cl)ccc([O-])c2F)cc1 ZINC001244541737 1057991280 /nfs/dbraw/zinc/99/12/80/1057991280.db2.gz SEEOJSBBHSRAOV-UHFFFAOYSA-N -1 1 322.763 4.347 20 0 DIADMM Cc1nc(-c2ccncc2)cc(-c2c(Cl)ccc([O-])c2F)n1 ZINC001244540776 1057991504 /nfs/dbraw/zinc/99/15/04/1057991504.db2.gz QWHOGVHAHAKQLK-UHFFFAOYSA-N -1 1 315.735 4.012 20 0 DIADMM [O-]c1ccc(Cl)c(-c2cncc(N3CCCCCC3)n2)c1F ZINC001244541047 1057991525 /nfs/dbraw/zinc/99/15/25/1057991525.db2.gz WKMCWGJUUIJSSN-UHFFFAOYSA-N -1 1 321.783 4.022 20 0 DIADMM CCOC(=O)c1ccc(-c2c(Cl)ccc([O-])c2F)cc1OC ZINC001244540777 1057991562 /nfs/dbraw/zinc/99/15/62/1057991562.db2.gz JFYQAIRHFBCECK-UHFFFAOYSA-N -1 1 324.735 4.037 20 0 DIADMM COC(=O)/C=C/c1ccc(-c2c(Cl)ccc([O-])c2F)cc1 ZINC001244543216 1057991867 /nfs/dbraw/zinc/99/18/67/1057991867.db2.gz SSHJVGSYRDFGDY-RUDMXATFSA-N -1 1 306.720 4.038 20 0 DIADMM COc1cccc2c(-c3c(Cl)ccc([O-])c3F)ccnc12 ZINC001244542968 1057992003 /nfs/dbraw/zinc/99/20/03/1057992003.db2.gz QEFXXAMPHYBUCR-UHFFFAOYSA-N -1 1 303.720 4.409 20 0 DIADMM COC(=O)[C@H](C)c1ccc(-c2c(Cl)ccc([O-])c2F)cc1 ZINC001244542736 1057992201 /nfs/dbraw/zinc/99/22/01/1057992201.db2.gz KYTXIACFVJZKKC-SECBINFHSA-N -1 1 308.736 4.128 20 0 DIADMM COC(=O)c1ccc(-c2c(Cl)ccc([O-])c2F)c2cc[nH]c21 ZINC001244542798 1057992502 /nfs/dbraw/zinc/99/25/02/1057992502.db2.gz NOKSVJRSGKBVSN-UHFFFAOYSA-N -1 1 319.719 4.120 20 0 DIADMM COC(=O)c1c(F)cc(F)cc1-c1cc(C)c([O-])c(Cl)c1 ZINC001244550976 1057993878 /nfs/dbraw/zinc/99/38/78/1057993878.db2.gz QELFXEVLAYALDO-UHFFFAOYSA-N -1 1 312.699 4.086 20 0 DIADMM CC(C)(C)OC(=O)c1ccc(-c2cc(Cl)ccc2[O-])nc1 ZINC001245048781 1058102076 /nfs/dbraw/zinc/10/20/76/1058102076.db2.gz GEJLLWORPFLMDW-UHFFFAOYSA-N -1 1 305.761 4.063 20 0 DIADMM CC(C)(C)[C@H]1CCCN1C(=O)c1ccc(C(F)(F)F)c([O-])c1 ZINC001545099968 1058182701 /nfs/dbraw/zinc/18/27/01/1058182701.db2.gz JMPVOEPJLTWIIH-CYBMUJFWSA-N -1 1 315.335 4.062 20 0 DIADMM Cc1ccccc1[C@@H](NC(=O)c1cccc([O-])c1F)C(C)(C)C ZINC001545295034 1058192954 /nfs/dbraw/zinc/19/29/54/1058192954.db2.gz CTPYXLQVVXENGT-QGZVFWFLSA-N -1 1 315.388 4.357 20 0 DIADMM CC1(C)C[C@H](NC(=O)c2cc(Cl)ccc2[O-])c2ccccc21 ZINC001545547369 1058210015 /nfs/dbraw/zinc/21/00/15/1058210015.db2.gz JSZWTKDCODOWHC-HNNXBMFYSA-N -1 1 315.800 4.198 20 0 DIADMM CCCCN(C(=O)Cc1ccc([O-])c(Cl)c1)c1ccccc1 ZINC001566225705 1058242758 /nfs/dbraw/zinc/24/27/58/1058242758.db2.gz ZBDNBCYIRNALOR-UHFFFAOYSA-N -1 1 317.816 4.421 20 0 DIADMM Oc1cc(-c2ccc3sc(=S)[n-]c3c2)c(F)c(F)c1F ZINC001245637602 1058302695 /nfs/dbraw/zinc/30/26/95/1058302695.db2.gz TUYOXHJOTLALCM-UHFFFAOYSA-N -1 1 313.325 4.375 20 0 DIADMM CCOC(=O)c1nc2cc(-c3c(C)cc(OC)cc3C)ccc2[n-]1 ZINC001245681088 1058342982 /nfs/dbraw/zinc/34/29/82/1058342982.db2.gz NTAJHESVMQBVPM-UHFFFAOYSA-N -1 1 324.380 4.032 20 0 DIADMM CCOC(=O)c1nc2ccc(-c3c(C)cc(OC)cc3C)cc2[n-]1 ZINC001245681088 1058342998 /nfs/dbraw/zinc/34/29/98/1058342998.db2.gz NTAJHESVMQBVPM-UHFFFAOYSA-N -1 1 324.380 4.032 20 0 DIADMM COc1ccc2cnc(-c3c(F)ccc([O-])c3Cl)cc2c1 ZINC001245830256 1058527401 /nfs/dbraw/zinc/52/74/01/1058527401.db2.gz JMHQJBCXHLDMGA-UHFFFAOYSA-N -1 1 303.720 4.409 20 0 DIADMM [O-]c1ccc(F)c(-c2cc(N3CCCCC3)ccn2)c1Cl ZINC001245830576 1058528032 /nfs/dbraw/zinc/52/80/32/1058528032.db2.gz SANCYFCFRKPYBF-UHFFFAOYSA-N -1 1 306.768 4.237 20 0 DIADMM COC(=O)c1ccc(-c2c(F)ccc([O-])c2Cl)c(C)c1F ZINC001245831203 1058530311 /nfs/dbraw/zinc/53/03/11/1058530311.db2.gz AHUBYZYCHJCWPF-UHFFFAOYSA-N -1 1 312.699 4.086 20 0 DIADMM COCc1cc(-c2c(F)ccc([O-])c2Cl)nc(C(C)(C)C)n1 ZINC001245830495 1058530391 /nfs/dbraw/zinc/53/03/91/1058530391.db2.gz PMBZCANPJAYKAX-UHFFFAOYSA-N -1 1 324.783 4.086 20 0 DIADMM [O-]c1ccc(F)c(-c2ccc(-c3ccccn3)nc2)c1Cl ZINC001245831691 1058531015 /nfs/dbraw/zinc/53/10/15/1058531015.db2.gz PELHCEAARSCOGH-UHFFFAOYSA-N -1 1 300.720 4.309 20 0 DIADMM CCOC(=O)c1ccc(F)c(-c2c(F)ccc([O-])c2Cl)c1 ZINC001245831559 1058531118 /nfs/dbraw/zinc/53/11/18/1058531118.db2.gz AMJRLJXNLVRUPH-UHFFFAOYSA-N -1 1 312.699 4.168 20 0 DIADMM COC(=O)c1cc2cccc(-c3c(F)ccc([O-])c3Cl)c2[nH]1 ZINC001245831449 1058534464 /nfs/dbraw/zinc/53/44/64/1058534464.db2.gz LWWOLAVVYIYAHP-UHFFFAOYSA-N -1 1 319.719 4.120 20 0 DIADMM Cc1ccc(C(=O)Nc2ccc([O-])c(F)c2F)c(Cl)c1C ZINC001556591907 1058618813 /nfs/dbraw/zinc/61/88/13/1058618813.db2.gz PQBQWKDMMLFDMK-UHFFFAOYSA-N -1 1 311.715 4.193 20 0 DIADMM O=c1cc(CC2CC2)[n-]n1-c1ccc(OCc2ccccc2)cc1 ZINC001245952878 1058649746 /nfs/dbraw/zinc/64/97/46/1058649746.db2.gz IXBGKGIALRWOCK-UHFFFAOYSA-N -1 1 320.392 4.109 20 0 DIADMM C[C@@H]1CCCC[C@]1(C)NC(=O)c1ccc(C(F)(F)F)c([O-])c1 ZINC001556916787 1058667319 /nfs/dbraw/zinc/66/73/19/1058667319.db2.gz WJMYEGHFYBMGFO-BMIGLBTASA-N -1 1 315.335 4.110 20 0 DIADMM O=C(/C=C\c1ccc(Cl)s1)Nc1cc([O-])c(F)cc1F ZINC001556920279 1058669185 /nfs/dbraw/zinc/66/91/85/1058669185.db2.gz KVDCOBBLOAZJTO-RQOWECAXSA-N -1 1 315.728 4.037 20 0 DIADMM Cc1ccc([C@@H]2C[C@H]2C(=O)Nc2cc([O-])c(F)cc2F)cc1C ZINC001556920203 1058669694 /nfs/dbraw/zinc/66/96/94/1058669694.db2.gz HFKOUIVXFCSRDK-QWHCGFSZSA-N -1 1 317.335 4.029 20 0 DIADMM CCC[C@@H]1CCCC[C@H]1CNC(=O)c1cc(Cl)ccc1[O-] ZINC001557028106 1058686750 /nfs/dbraw/zinc/68/67/50/1058686750.db2.gz IIEMUMUXKCNJFT-OLZOCXBDSA-N -1 1 309.837 4.382 20 0 DIADMM CC[C@H](C)Oc1ccc(C(=O)Nc2cc(F)cc(F)c2[O-])cc1 ZINC001557086233 1058698527 /nfs/dbraw/zinc/69/85/27/1058698527.db2.gz MBZADFNRBMLRND-JTQLQIEISA-N -1 1 321.323 4.100 20 0 DIADMM O=C(Nc1cc(F)cc(F)c1[O-])c1cc2sccc2s1 ZINC001557085952 1058698560 /nfs/dbraw/zinc/69/85/60/1058698560.db2.gz ASSAJNFUPROLQR-UHFFFAOYSA-N -1 1 311.334 4.199 20 0 DIADMM CCCC[C@@H](CC)CCCN(C)C(=O)C(=O)c1ccc([O-])cc1 ZINC001557560325 1058769053 /nfs/dbraw/zinc/76/90/53/1058769053.db2.gz FLONXAGVLJWEON-OAHLLOKOSA-N -1 1 319.445 4.030 20 0 DIADMM O=C(Nc1cccc(F)c1[O-])c1ccc(-c2ccccc2)cc1 ZINC001557957118 1058818290 /nfs/dbraw/zinc/81/82/90/1058818290.db2.gz SFOPQFVZMBXIQV-UHFFFAOYSA-N -1 1 307.324 4.451 20 0 DIADMM O=C(CCCCCc1ccc(F)cc1)Nc1cccc(F)c1[O-] ZINC001557955427 1058819625 /nfs/dbraw/zinc/81/96/25/1058819625.db2.gz BCJUKKFHFKPMEF-UHFFFAOYSA-N -1 1 319.351 4.412 20 0 DIADMM CCC(CC)(CNC(=O)c1cc(Cl)ccc1[O-])C(F)(F)F ZINC001557995502 1058824156 /nfs/dbraw/zinc/82/41/56/1058824156.db2.gz CONNZWXDCKMCCF-UHFFFAOYSA-N -1 1 323.742 4.144 20 0 DIADMM CC(C)(C)c1ccc(NC(=O)c2ccc([O-])c(F)c2)cc1F ZINC001558153617 1058845253 /nfs/dbraw/zinc/84/52/53/1058845253.db2.gz TVYSZHYUBRIGKX-UHFFFAOYSA-N -1 1 305.324 4.220 20 0 DIADMM CC(C)(C)OCc1ccccc1NC(=O)c1cccc([O-])c1F ZINC001558422862 1058869779 /nfs/dbraw/zinc/86/97/79/1058869779.db2.gz GDGQNNYJCKTYPQ-UHFFFAOYSA-N -1 1 317.360 4.099 20 0 DIADMM O=C(Nc1ccc(F)cc1[O-])C1CCC(c2ccccc2)CC1 ZINC001558956097 1058926829 /nfs/dbraw/zinc/92/68/29/1058926829.db2.gz YLJCAGRRIISRHM-UHFFFAOYSA-N -1 1 313.372 4.444 20 0 DIADMM O=C(C[C@@H]1CCC[C@@H](C(F)(F)F)C1)Nc1ccc(F)cc1[O-] ZINC001558955790 1058926901 /nfs/dbraw/zinc/92/69/01/1058926901.db2.gz JPXDHQPJHNMJPG-NXEZZACHSA-N -1 1 319.298 4.229 20 0 DIADMM CCCc1cc(=O)[n-]c(SC[C@@H](C)c2ccc(OC)cc2)n1 ZINC001559324376 1059161194 /nfs/dbraw/zinc/16/11/94/1059161194.db2.gz OFHPKBPDVIKYEU-GFCCVEGCSA-N -1 1 318.442 4.039 20 0 DIADMM Cc1cc(CSc2nc(-c3ccccc3)c(C)c(=O)[n-]2)ccn1 ZINC001559396370 1059206330 /nfs/dbraw/zinc/20/63/30/1059206330.db2.gz HYPSJENBSZUFNA-UHFFFAOYSA-N -1 1 323.421 4.153 20 0 DIADMM O=c1cc(-c2ccccc2)nc(SCCC(F)=C(F)F)[n-]1 ZINC001559472963 1059251150 /nfs/dbraw/zinc/25/11/50/1059251150.db2.gz DDZQSXFXMJLNMU-UHFFFAOYSA-N -1 1 312.316 4.409 20 0 DIADMM O=c1cc(-c2ccccc2)nc(SCCC(F)(F)Cl)[n-]1 ZINC001559473047 1059251702 /nfs/dbraw/zinc/25/17/02/1059251702.db2.gz GSRXSXNSNXVRDR-UHFFFAOYSA-N -1 1 316.760 4.163 20 0 DIADMM Nc1cc(F)cc(Nc2cc([O-])c(Cl)cc2F)c1Cl ZINC001249652267 1060335333 /nfs/dbraw/zinc/33/53/33/1060335333.db2.gz VCDKLAFNGIFUCJ-UHFFFAOYSA-N -1 1 305.111 4.303 20 0 DIADMM [O-]c1cccc(CNc2nc3ccccc3n2C2CC2)c1Cl ZINC001560576163 1060388691 /nfs/dbraw/zinc/38/86/91/1060388691.db2.gz XVZVIUSNQPYHJI-UHFFFAOYSA-N -1 1 313.788 4.342 20 0 DIADMM O=C1CCCCc2ccc(Nc3c([O-])cc(F)cc3F)cc21 ZINC001249892761 1060455125 /nfs/dbraw/zinc/45/51/25/1060455125.db2.gz FHQBOBNOYXEGCK-UHFFFAOYSA-N -1 1 303.308 4.323 20 0 DIADMM O=C1CCCCc2ccc(Nc3ccc(F)c(F)c3[O-])cc21 ZINC001249893757 1060456176 /nfs/dbraw/zinc/45/61/76/1060456176.db2.gz QLFCOAHKFRFCDA-UHFFFAOYSA-N -1 1 303.308 4.323 20 0 DIADMM Cc1ccc2sc(Nc3cc([O-])c(F)c(F)c3F)nc2c1 ZINC001249959137 1060502643 /nfs/dbraw/zinc/50/26/43/1060502643.db2.gz WULIKEQKWOBWGU-UHFFFAOYSA-N -1 1 310.300 4.471 20 0 DIADMM [O-]c1cc(Nc2ncc(Cl)cc2Cl)c(F)c(F)c1F ZINC001249958849 1060503085 /nfs/dbraw/zinc/50/30/85/1060503085.db2.gz QJFFENPJSJWNBY-UHFFFAOYSA-N -1 1 309.074 4.255 20 0 DIADMM [O-]c1cc(Nc2ccnc3ccc(Cl)cc32)c(F)c(F)c1F ZINC001249958939 1060504270 /nfs/dbraw/zinc/50/42/70/1060504270.db2.gz RIUFXYYRLLTBDJ-UHFFFAOYSA-N -1 1 324.689 4.177 20 0 DIADMM [O-]c1cc(Nc2cnc3c(F)cccc3c2)c(F)c(F)c1F ZINC001249961452 1060504527 /nfs/dbraw/zinc/50/45/27/1060504527.db2.gz QHIZSWWQBKTUIR-UHFFFAOYSA-N -1 1 308.234 4.240 20 0 DIADMM [O-]c1cc(Nc2cccc(Br)c2)c(F)c(F)c1F ZINC001249962908 1060507027 /nfs/dbraw/zinc/50/70/27/1060507027.db2.gz PIRPRYOXJPOZLH-UHFFFAOYSA-N -1 1 318.092 4.316 20 0 DIADMM [O-]c1cc(Nc2ccc(Cl)c(F)c2F)c(F)c(F)c1F ZINC001249964380 1060507379 /nfs/dbraw/zinc/50/73/79/1060507379.db2.gz BZKDTWNBKXBNLW-UHFFFAOYSA-N -1 1 309.621 4.485 20 0 DIADMM Cc1c(Cl)cc(N)cc1Nc1cc([O-])c(F)c(F)c1F ZINC001249964369 1060507526 /nfs/dbraw/zinc/50/75/26/1060507526.db2.gz BJHDDIRVKCDEOC-UHFFFAOYSA-N -1 1 302.683 4.097 20 0 DIADMM CCOc1ccc(F)cc1Nc1cc([O-])c(F)c(F)c1F ZINC001249963689 1060509139 /nfs/dbraw/zinc/50/91/39/1060509139.db2.gz RSZQVJPEBSJKPN-UHFFFAOYSA-N -1 1 301.239 4.091 20 0 DIADMM Nc1cccc2cccc(Nc3cc([O-])c(F)c(F)c3F)c12 ZINC001249964061 1060509617 /nfs/dbraw/zinc/50/96/17/1060509617.db2.gz XYZPKBYFMFSRIV-UHFFFAOYSA-N -1 1 304.271 4.289 20 0 DIADMM [O-]c1cc(Nc2ccccc2-n2cccc2)c(F)c(F)c1F ZINC001249962921 1060509939 /nfs/dbraw/zinc/50/99/39/1060509939.db2.gz IIPXYGUTHOSJIP-UHFFFAOYSA-N -1 1 304.271 4.344 20 0 DIADMM [O-]c1cc(Nc2ccc(O)c3ccccc23)c(F)c(F)c1F ZINC001249962803 1060510314 /nfs/dbraw/zinc/51/03/14/1060510314.db2.gz GTHCISMCNJDOLY-UHFFFAOYSA-N -1 1 305.255 4.412 20 0 DIADMM [O-]c1cc(Nc2c(F)cc(F)cc2Cl)c(F)c(F)c1F ZINC001249962951 1060510403 /nfs/dbraw/zinc/51/04/03/1060510403.db2.gz JZNUPJAUAGEIOK-UHFFFAOYSA-N -1 1 309.621 4.485 20 0 DIADMM COc1ccc2cccnc2c1Nc1cc([O-])c(F)c(F)c1F ZINC001249967139 1060512769 /nfs/dbraw/zinc/51/27/69/1060512769.db2.gz REMUFRBRRVGPTA-UHFFFAOYSA-N -1 1 320.270 4.110 20 0 DIADMM [O-]c1cc(Nc2ccc(F)c(F)c2Cl)c(F)c(F)c1F ZINC001249965681 1060512971 /nfs/dbraw/zinc/51/29/71/1060512971.db2.gz GIVAQFFVOZBMOD-UHFFFAOYSA-N -1 1 309.621 4.485 20 0 DIADMM [O-]c1cc(F)c(Nc2cccc(C(F)(F)F)n2)cc1Cl ZINC001250021079 1060542328 /nfs/dbraw/zinc/54/23/28/1060542328.db2.gz XYWQZEPVWXVWDY-UHFFFAOYSA-N -1 1 306.646 4.342 20 0 DIADMM [O-]c1cc(F)c(Nc2ccc(-c3ccccn3)nc2)cc1Cl ZINC001250023655 1060547117 /nfs/dbraw/zinc/54/71/17/1060547117.db2.gz UKNQZQWRXJHOGW-UHFFFAOYSA-N -1 1 315.735 4.385 20 0 DIADMM [O-]c1cc(F)c(Nc2ccccc2-n2cccn2)cc1Cl ZINC001250022927 1060547574 /nfs/dbraw/zinc/54/75/74/1060547574.db2.gz ZFNBWACVAPZOJM-UHFFFAOYSA-N -1 1 303.724 4.114 20 0 DIADMM O=c1[nH]c2ccc(Nc3cc(Cl)c([O-])cc3F)cc2s1 ZINC001250022017 1060548915 /nfs/dbraw/zinc/54/89/15/1060548915.db2.gz CNPRMLVUPJAYAC-UHFFFAOYSA-N -1 1 310.737 4.244 20 0 DIADMM COc1ccc(Nc2cc(Cl)c([O-])cc2F)c(C(C)=O)c1 ZINC001250025555 1060550134 /nfs/dbraw/zinc/55/01/34/1060550134.db2.gz HAFQZJCPONLWDU-UHFFFAOYSA-N -1 1 309.724 4.140 20 0 DIADMM COc1ccc(Nc2cc(Cl)c([O-])cc2F)c(OC)c1F ZINC001250025489 1060550850 /nfs/dbraw/zinc/55/08/50/1060550850.db2.gz GQHTVJPQRZZRHJ-UHFFFAOYSA-N -1 1 315.703 4.085 20 0 DIADMM COc1c(F)cc(Nc2cc(Cl)c([O-])cc2F)cc1F ZINC001250024061 1060551549 /nfs/dbraw/zinc/55/15/49/1060551549.db2.gz OXEYCXRHVOODPY-UHFFFAOYSA-N -1 1 303.667 4.215 20 0 DIADMM COc1c(F)ccc(Nc2cc(Cl)c([O-])cc2F)c1F ZINC001250026023 1060552427 /nfs/dbraw/zinc/55/24/27/1060552427.db2.gz KHLDMRHQHMIWTN-UHFFFAOYSA-N -1 1 303.667 4.215 20 0 DIADMM CCOC(=O)Cc1ccccc1Nc1cc(Cl)c([O-])cc1F ZINC001250026096 1060552607 /nfs/dbraw/zinc/55/26/07/1060552607.db2.gz MQDXVGGDZPYCQY-UHFFFAOYSA-N -1 1 323.751 4.034 20 0 DIADMM Cc1ccc(CCCO)c(Nc2cc(Cl)c([O-])cc2F)c1 ZINC001250026954 1060555228 /nfs/dbraw/zinc/55/52/28/1060555228.db2.gz UPVMGGDJOOOVBM-UHFFFAOYSA-N -1 1 309.768 4.162 20 0 DIADMM COc1cc(OC)c(Nc2cc([O-])c(F)c(F)c2)cc1Cl ZINC001250099835 1060606851 /nfs/dbraw/zinc/60/68/51/1060606851.db2.gz PRLJLPCUSPIBPJ-UHFFFAOYSA-N -1 1 315.703 4.085 20 0 DIADMM [O-]c1cccc(CN2CC[C@@](F)(c3ccccc3)C2)c1Cl ZINC001560786218 1060646255 /nfs/dbraw/zinc/64/62/55/1060646255.db2.gz TVWAMVQMIDIQOF-KRWDZBQOSA-N -1 1 305.780 4.116 20 0 DIADMM [O-]c1c(F)cc(Cc2cccc(OC(F)(F)F)c2)cc1F ZINC001250223219 1060702700 /nfs/dbraw/zinc/70/27/00/1060702700.db2.gz IILOKWQRKQXBMF-UHFFFAOYSA-N -1 1 304.214 4.160 20 0 DIADMM [O-]c1ccc(F)c(Nc2ccc(Br)cn2)c1Cl ZINC001250228170 1060705314 /nfs/dbraw/zinc/70/53/14/1060705314.db2.gz ONANRADIPVLUER-UHFFFAOYSA-N -1 1 317.545 4.086 20 0 DIADMM [O-]c1ccc(F)c(Nc2cnccc2C(F)(F)F)c1Cl ZINC001250227891 1060706146 /nfs/dbraw/zinc/70/61/46/1060706146.db2.gz BGCORIVVWVTOPM-UHFFFAOYSA-N -1 1 306.646 4.342 20 0 DIADMM COC(=O)c1c(C)csc1Nc1c(F)ccc([O-])c1Cl ZINC001250228459 1060707273 /nfs/dbraw/zinc/70/72/73/1060707273.db2.gz BUTFBNHPLFENPA-UHFFFAOYSA-N -1 1 315.753 4.085 20 0 DIADMM [O-]c1ccc(F)c(Nc2ccnn2-c2ccc(F)cc2)c1Cl ZINC001250229858 1060707347 /nfs/dbraw/zinc/70/73/47/1060707347.db2.gz PTCIXELIIDSIJB-UHFFFAOYSA-N -1 1 321.714 4.253 20 0 DIADMM COC(=O)c1csc(C)c1Nc1c(F)ccc([O-])c1Cl ZINC001250229104 1060707828 /nfs/dbraw/zinc/70/78/28/1060707828.db2.gz ANJXWVGHRFFXOA-UHFFFAOYSA-N -1 1 315.753 4.085 20 0 DIADMM [O-]c1ccc(F)c(Nc2ccc(Br)nc2)c1Cl ZINC001250228348 1060708029 /nfs/dbraw/zinc/70/80/29/1060708029.db2.gz YAIRWJPZZAWKBZ-UHFFFAOYSA-N -1 1 317.545 4.086 20 0 DIADMM COc1ccc2cc(Nc3c(F)ccc([O-])c3Cl)cnc2c1 ZINC001250229117 1060708807 /nfs/dbraw/zinc/70/88/07/1060708807.db2.gz AUSNKLPKNBHQCB-UHFFFAOYSA-N -1 1 318.735 4.485 20 0 DIADMM COC(=O)c1scc(C)c1Nc1c(F)ccc([O-])c1Cl ZINC001250228268 1060709158 /nfs/dbraw/zinc/70/91/58/1060709158.db2.gz TZMXVCGIGOZLRS-UHFFFAOYSA-N -1 1 315.753 4.085 20 0 DIADMM [O-]c1ccc(F)c(Nc2ncc(C(F)(F)F)cc2F)c1Cl ZINC001250228378 1060709632 /nfs/dbraw/zinc/70/96/32/1060709632.db2.gz ZUTQUHZGXFMEIL-UHFFFAOYSA-N -1 1 324.636 4.481 20 0 DIADMM COc1ccc(C(C)=O)c(Nc2c(F)ccc([O-])c2Cl)c1C ZINC001250232222 1060710328 /nfs/dbraw/zinc/71/03/28/1060710328.db2.gz FAOIQUXNHLZKAH-UHFFFAOYSA-N -1 1 323.751 4.448 20 0 DIADMM COc1cc(C(C)=O)ccc1Nc1c(F)ccc([O-])c1Cl ZINC001250233215 1060713224 /nfs/dbraw/zinc/71/32/24/1060713224.db2.gz KRNWBXQZVDZHRT-UHFFFAOYSA-N -1 1 309.724 4.140 20 0 DIADMM COC(=O)c1cc(Nc2c(F)ccc([O-])c2Cl)ccc1C ZINC001250233856 1060713376 /nfs/dbraw/zinc/71/33/76/1060713376.db2.gz XGQCWZZLUXCIIR-UHFFFAOYSA-N -1 1 309.724 4.023 20 0 DIADMM [O-]c1ccc(F)c(Nc2ccc(-n3ccnc3)cc2)c1Cl ZINC001250234062 1060713453 /nfs/dbraw/zinc/71/34/53/1060713453.db2.gz KGRNITDAWHPVPZ-UHFFFAOYSA-N -1 1 303.724 4.114 20 0 DIADMM Nc1ccc(N(c2c(F)ccc([O-])c2Cl)C2CCCC2)nc1 ZINC001250234723 1060715985 /nfs/dbraw/zinc/71/59/85/1060715985.db2.gz VYZLIXBPCBFZIW-UHFFFAOYSA-N -1 1 321.783 4.243 20 0 DIADMM [O-]c1ccc(F)c(Nc2ccc(CO)c(Cl)c2)c1Cl ZINC001250236082 1060716182 /nfs/dbraw/zinc/71/61/82/1060716182.db2.gz HTGNZJPFNMXUMH-UHFFFAOYSA-N -1 1 302.132 4.074 20 0 DIADMM CO[C@@H]1CCOc2c(Nc3c(F)ccc([O-])c3Cl)cccc21 ZINC001250236320 1060717049 /nfs/dbraw/zinc/71/70/49/1060717049.db2.gz OMSHDMQVNYDHQB-CYBMUJFWSA-N -1 1 323.751 4.398 20 0 DIADMM COC(=O)CCc1ccc(Nc2c(F)ccc([O-])c2Cl)cc1 ZINC001250235834 1060717298 /nfs/dbraw/zinc/71/72/98/1060717298.db2.gz BQTYYYUIGDEXAJ-UHFFFAOYSA-N -1 1 323.751 4.034 20 0 DIADMM Nc1cc(F)cc(Cl)c1Nc1c(F)ccc([O-])c1Cl ZINC001250236854 1060719879 /nfs/dbraw/zinc/71/98/79/1060719879.db2.gz XAEDFFRDWGGTGM-UHFFFAOYSA-N -1 1 305.111 4.303 20 0 DIADMM Nc1cc(F)cc(Nc2c(F)ccc([O-])c2Cl)c1Cl ZINC001250238227 1060721375 /nfs/dbraw/zinc/72/13/75/1060721375.db2.gz XZZGSSBOVUSJBE-UHFFFAOYSA-N -1 1 305.111 4.303 20 0 DIADMM O=C(Cc1cc(F)c([O-])cc1F)c1ccc(C(F)(F)F)cc1 ZINC001250238466 1060721765 /nfs/dbraw/zinc/72/17/65/1060721765.db2.gz DZOCZODYDFPQCM-UHFFFAOYSA-N -1 1 316.225 4.115 20 0 DIADMM CC1(c2ccc(Nc3c(F)ccc([O-])c3Cl)cc2)COC1 ZINC001250238206 1060721918 /nfs/dbraw/zinc/72/19/18/1060721918.db2.gz XBCCCYSPFVYXEK-UHFFFAOYSA-N -1 1 307.752 4.216 20 0 DIADMM [O-]c1c(Cl)c(Cl)ccc1Nc1c(F)ccc(CO)c1F ZINC001250260014 1060737852 /nfs/dbraw/zinc/73/78/52/1060737852.db2.gz VUGHQVCDALEXMA-UHFFFAOYSA-N -1 1 320.122 4.213 20 0 DIADMM [O-]c1cc(Cc2cccc(OC(F)F)c2)c(F)c(F)c1F ZINC001250268995 1060745673 /nfs/dbraw/zinc/74/56/73/1060745673.db2.gz NNWQZDRCYXDAHD-UHFFFAOYSA-N -1 1 304.214 4.002 20 0 DIADMM Fc1cc([N-]c2nnco2)cc(Cl)c1OCc1ccccc1 ZINC001250277616 1060750062 /nfs/dbraw/zinc/75/00/62/1060750062.db2.gz DTFJRJGNOVUZLC-UHFFFAOYSA-N -1 1 319.723 4.185 20 0 DIADMM [O-]c1ccc(C(F)(F)F)cc1-c1ccc(C(F)(F)F)cn1 ZINC001250449632 1060806933 /nfs/dbraw/zinc/80/69/33/1060806933.db2.gz XRKNEYNTWPRUKF-UHFFFAOYSA-N -1 1 307.193 4.492 20 0 DIADMM [O-]c1cccc(CN2CCCCC[C@H]2C(F)(F)F)c1Cl ZINC001561007258 1060865345 /nfs/dbraw/zinc/86/53/45/1060865345.db2.gz OVVDQKXRWNBBHP-LBPRGKRZSA-N -1 1 307.743 4.353 20 0 DIADMM CC(C)([N-]S(=O)(=O)c1cc2ccccc2o1)C1CCCCC1 ZINC001561218657 1060919867 /nfs/dbraw/zinc/91/98/67/1060919867.db2.gz OMUCYGIWMIMVNJ-UHFFFAOYSA-N -1 1 321.442 4.070 20 0 DIADMM Cn1c2ccc(C(F)(F)F)cc2nc1-c1cccc(F)c1[O-] ZINC001250684030 1061015488 /nfs/dbraw/zinc/01/54/88/1061015488.db2.gz WXPBXQXBXNHEPS-UHFFFAOYSA-N -1 1 310.250 4.104 20 0 DIADMM CCn1c2cc(OC)ccc2nc1-c1ccc(Cl)cc1[O-] ZINC001250872041 1061102141 /nfs/dbraw/zinc/10/21/41/1061102141.db2.gz NFRBJEYJWGOCIU-UHFFFAOYSA-N -1 1 302.761 4.091 20 0 DIADMM Cc1cccc2[nH]c(-c3cccc([O-])c3Br)nc21 ZINC001250881445 1061109256 /nfs/dbraw/zinc/10/92/56/1061109256.db2.gz WOARHOXLWBQGLB-UHFFFAOYSA-N -1 1 303.159 4.006 20 0 DIADMM [O-]c1c(Cl)cc(-c2nc3cc4c(cc3[nH]2)OCC4)cc1Cl ZINC001250911494 1061121914 /nfs/dbraw/zinc/12/19/14/1061121914.db2.gz JTCVIUWQLPUJNK-UHFFFAOYSA-N -1 1 321.163 4.177 20 0 DIADMM CC(C)(C)n1c2ccccc2nc1-c1ccc([O-])c(F)c1F ZINC001250914898 1061123725 /nfs/dbraw/zinc/12/37/25/1061123725.db2.gz KLMQSIBXQZQGRU-UHFFFAOYSA-N -1 1 302.324 4.442 20 0 DIADMM CC(C)Cn1c2ccccc2nc1-c1ccc([O-])c(F)c1F ZINC001250914430 1061124350 /nfs/dbraw/zinc/12/43/50/1061124350.db2.gz AEZWGWDFQIOGTL-UHFFFAOYSA-N -1 1 302.324 4.343 20 0 DIADMM CC(C)n1c2ccc(F)cc2nc1-c1cc(F)c(F)cc1[O-] ZINC001250966494 1061151125 /nfs/dbraw/zinc/15/11/25/1061151125.db2.gz AWFRZUBOOLASTN-UHFFFAOYSA-N -1 1 306.287 4.407 20 0 DIADMM CC(C)n1c2cc(F)ccc2nc1-c1cc(F)c(F)cc1[O-] ZINC001250967425 1061152756 /nfs/dbraw/zinc/15/27/56/1061152756.db2.gz QSFJLIWOFHEXDV-UHFFFAOYSA-N -1 1 306.287 4.407 20 0 DIADMM CCOc1ccc2nc(-c3cc(F)c(F)cc3[O-])n(CC)c2c1 ZINC001250967548 1061153717 /nfs/dbraw/zinc/15/37/17/1061153717.db2.gz UIRPCRLDEFWYHJ-UHFFFAOYSA-N -1 1 318.323 4.106 20 0 DIADMM Cn1c2cc(F)ccc2nc1-c1ccc([O-])c(C(F)(F)F)c1 ZINC001251020501 1061187749 /nfs/dbraw/zinc/18/77/49/1061187749.db2.gz PLANXHMRQNRTPI-UHFFFAOYSA-N -1 1 310.250 4.104 20 0 DIADMM C[C@]1(C2CCCCC2)CCN1C(=O)c1cc(Cl)ccc1[O-] ZINC001455118570 1061207988 /nfs/dbraw/zinc/20/79/88/1061207988.db2.gz UVYIOQNRGFMJSM-QGZVFWFLSA-N -1 1 307.821 4.231 20 0 DIADMM O=C(CC/C=C\c1ccccc1)NCc1ccc([O-])c(Cl)c1 ZINC001455448998 1061222577 /nfs/dbraw/zinc/22/25/77/1061222577.db2.gz JLBBBLGOGAONJG-YWEYNIOJSA-N -1 1 315.800 4.155 20 0 DIADMM [O-]c1cc(O)c(-c2nc3ccccc3n2CC2CC2)cc1Cl ZINC001251081950 1061226206 /nfs/dbraw/zinc/22/62/06/1061226206.db2.gz AKMNYXMBQVUILX-UHFFFAOYSA-N -1 1 314.772 4.178 20 0 DIADMM [O-]c1cc(O)c(-c2nc3c(cc(F)cc3Cl)[nH]2)cc1Cl ZINC001251082704 1061228826 /nfs/dbraw/zinc/22/88/26/1061228826.db2.gz MGHMVDMZWYVOTR-UHFFFAOYSA-N -1 1 313.115 4.087 20 0 DIADMM Cc1cc2[nH]c(-c3cc(Cl)c([O-])cc3O)nc2cc1Cl ZINC001251083218 1061229198 /nfs/dbraw/zinc/22/91/98/1061229198.db2.gz RPBZVOLFVOIHCU-UHFFFAOYSA-N -1 1 309.152 4.256 20 0 DIADMM Cc1ccc2[nH]c(-c3cc(Cl)c([O-])cc3O)nc2c1Cl ZINC001251083205 1061229295 /nfs/dbraw/zinc/22/92/95/1061229295.db2.gz RGQNGSWUICRHGH-UHFFFAOYSA-N -1 1 309.152 4.256 20 0 DIADMM [O-]c1cc(O)c(-c2nc3c(ccc(F)c3Cl)[nH]2)cc1Cl ZINC001251082556 1061230144 /nfs/dbraw/zinc/23/01/44/1061230144.db2.gz KOMWOPRWAANPCM-UHFFFAOYSA-N -1 1 313.115 4.087 20 0 DIADMM CCn1c(-c2cccc([O-])c2Cl)nc2ccc(F)c(F)c21 ZINC001251204198 1061269641 /nfs/dbraw/zinc/26/96/41/1061269641.db2.gz ZSTZUMKQHBHYGI-UHFFFAOYSA-N -1 1 308.715 4.360 20 0 DIADMM [O-]c1cnc(Cl)cc1-c1nc2ccc(F)c(F)c2n1C1CC1 ZINC001251251773 1061290195 /nfs/dbraw/zinc/29/01/95/1061290195.db2.gz ISKAHCGTSCORHV-UHFFFAOYSA-N -1 1 321.714 4.070 20 0 DIADMM CC(C)n1c2ccc(F)cc2nc1-c1c([O-])ccc(F)c1F ZINC001251322514 1061314129 /nfs/dbraw/zinc/31/41/29/1061314129.db2.gz XSKADBKPKJVBPD-UHFFFAOYSA-N -1 1 306.287 4.407 20 0 DIADMM [O-]c1ccc(F)c(-c2nc3cc(F)ccc3n2C2CC2)c1F ZINC001251335354 1061318239 /nfs/dbraw/zinc/31/82/39/1061318239.db2.gz CUDOGFMNKQPHIN-UHFFFAOYSA-N -1 1 304.271 4.161 20 0 DIADMM CCCn1c2ccc(F)cc2nc1-c1c(F)ccc([O-])c1F ZINC001251336044 1061320965 /nfs/dbraw/zinc/32/09/65/1061320965.db2.gz ZFBILIYYFFPWKW-UHFFFAOYSA-N -1 1 306.287 4.236 20 0 DIADMM CN(C)c1ccc2[nH]c(-c3cccc(C(F)(F)F)c3[O-])nc2c1 ZINC001251341054 1061324887 /nfs/dbraw/zinc/32/48/87/1061324887.db2.gz IWWCGPAJMJFCCS-UHFFFAOYSA-N -1 1 321.302 4.020 20 0 DIADMM Cc1cc(F)cc2nc(-c3cccc(C(F)(F)F)c3[O-])[nH]c21 ZINC001251340919 1061325881 /nfs/dbraw/zinc/32/58/81/1061325881.db2.gz ADBOIKUWAHUOIY-UHFFFAOYSA-N -1 1 310.250 4.402 20 0 DIADMM COc1ccc2c(c1)nc(-c1cc(Cl)c(Cl)cc1[O-])n2C ZINC001251490994 1061377219 /nfs/dbraw/zinc/37/72/19/1061377219.db2.gz DPJUUQIRQSVAGF-UHFFFAOYSA-N -1 1 323.179 4.261 20 0 DIADMM CCn1c2ccccc2nc1-c1c([O-])cc(OC)cc1Cl ZINC001251491418 1061378597 /nfs/dbraw/zinc/37/85/97/1061378597.db2.gz VCZXHSKLVHHWGO-UHFFFAOYSA-N -1 1 302.761 4.091 20 0 DIADMM FC(F)(F)Oc1ccc2nc(C3OC=CC3=S)[n-]c2c1 ZINC001251546823 1061402336 /nfs/dbraw/zinc/40/23/36/1061402336.db2.gz PCOQTTQVCOHFSA-UHFFFAOYSA-N -1 1 300.261 4.010 20 0 DIADMM FC(F)(F)Oc1ccc2[n-]c(C3OC=CC3=S)nc2c1 ZINC001251546823 1061402341 /nfs/dbraw/zinc/40/23/41/1061402341.db2.gz PCOQTTQVCOHFSA-UHFFFAOYSA-N -1 1 300.261 4.010 20 0 DIADMM COc1cc2[nH]c(-c3cc(F)cc(Cl)c3[O-])nc2cc1C ZINC001251658904 1061435218 /nfs/dbraw/zinc/43/52/18/1061435218.db2.gz JZFQOBNPWWIHBF-UHFFFAOYSA-N -1 1 306.724 4.045 20 0 DIADMM CCOc1ccc2nc(-c3cc(F)cc(Cl)c3[O-])[nH]c2c1 ZINC001251659147 1061435459 /nfs/dbraw/zinc/43/54/59/1061435459.db2.gz XOZNHYYHNSRKNO-UHFFFAOYSA-N -1 1 306.724 4.127 20 0 DIADMM CCn1c2cc(F)ccc2nc1-c1cc(F)c(Cl)cc1[O-] ZINC001251680794 1061440660 /nfs/dbraw/zinc/44/06/60/1061440660.db2.gz GZYGBEAMJNEFPL-UHFFFAOYSA-N -1 1 308.715 4.360 20 0 DIADMM CCOc1ccc2nc(-c3cc(F)c([O-])c(Cl)c3)[nH]c2c1 ZINC001251692198 1061443447 /nfs/dbraw/zinc/44/34/47/1061443447.db2.gz BLUOQWYZCRQLMJ-UHFFFAOYSA-N -1 1 306.724 4.127 20 0 DIADMM C[C@]1(NC(=O)c2c([O-])cccc2Cl)CCCc2ccccc21 ZINC001546090443 1061447842 /nfs/dbraw/zinc/44/78/42/1061447842.db2.gz RQFFGOGZKFTDBN-SFHVURJKSA-N -1 1 315.800 4.027 20 0 DIADMM Cc1cc(C(=O)[O-])ccc1-c1nc2ccc(C(F)(F)F)cc2[nH]1 ZINC001251711135 1061453571 /nfs/dbraw/zinc/45/35/71/1061453571.db2.gz YFNWHYOKPIMUAY-UHFFFAOYSA-N -1 1 320.270 4.255 20 0 DIADMM CC(C)c1nc2cc(NC(=O)c3ccc(F)c([O-])c3)ccc2o1 ZINC001463842667 1061526068 /nfs/dbraw/zinc/52/60/68/1061526068.db2.gz GKZONMMLFISHMQ-UHFFFAOYSA-N -1 1 314.316 4.048 20 0 DIADMM CC(C)[C@H](NC(=O)c1cc(Cl)ccc1[O-])c1ccccc1 ZINC001463884131 1061530788 /nfs/dbraw/zinc/53/07/88/1061530788.db2.gz FWBLUYYIZLQHEW-INIZCTEOSA-N -1 1 303.789 4.173 20 0 DIADMM CCN(Cc1ccc(C)cc1)C(=O)c1c([O-])cccc1Cl ZINC001464067392 1061550867 /nfs/dbraw/zinc/55/08/67/1061550867.db2.gz UJIZKASIUWODOT-UHFFFAOYSA-N -1 1 303.789 4.016 20 0 DIADMM CCCC[C@H](C(=O)Nc1ccc(-c2cc(=O)[nH][n-]2)cc1)C(C)C ZINC001464076577 1061554739 /nfs/dbraw/zinc/55/47/39/1061554739.db2.gz CWZKAVYJXZETGS-HNNXBMFYSA-N -1 1 315.417 4.183 20 0 DIADMM Cc1ccc(S(=O)(=O)[N-]c2c(C)ccc3ccccc32)cc1 ZINC001252074818 1061565476 /nfs/dbraw/zinc/56/54/76/1061565476.db2.gz UDZUQPUBKNUFNU-UHFFFAOYSA-N -1 1 311.406 4.257 20 0 DIADMM CC(C)(C)[C@@H](NC(=O)c1ccc(F)c([O-])c1)c1ccc(F)cc1 ZINC001464214244 1061565485 /nfs/dbraw/zinc/56/54/85/1061565485.db2.gz HSOWILCYYNYHSR-INIZCTEOSA-N -1 1 319.351 4.188 20 0 DIADMM O=C(c1cccc([O-])c1F)N1CCC[C@H]1c1cccc(Cl)c1 ZINC001464307723 1061575990 /nfs/dbraw/zinc/57/59/90/1061575990.db2.gz YHKCLAHTLCMAQB-AWEZNQCLSA-N -1 1 319.763 4.162 20 0 DIADMM O=C(c1ccc([O-])cc1F)N1CCC[C@H]1CC1CCCCC1 ZINC001464558290 1061604310 /nfs/dbraw/zinc/60/43/10/1061604310.db2.gz IAULNWAYTULRNV-AWEZNQCLSA-N -1 1 305.393 4.106 20 0 DIADMM CC[C@@H](Cc1ccccc1)NC(=O)c1ccc2ccccc2c1[O-] ZINC001464761577 1061631654 /nfs/dbraw/zinc/63/16/54/1061631654.db2.gz SBJNLCDIOQMPHG-KRWDZBQOSA-N -1 1 319.404 4.297 20 0 DIADMM CC(C)(C)c1ccc(-c2nnc(-c3ccc(O)cc3[O-])o2)cc1 ZINC001252803955 1061725869 /nfs/dbraw/zinc/72/58/69/1061725869.db2.gz VTCWJKXUPIDJMD-UHFFFAOYSA-N -1 1 310.353 4.112 20 0 DIADMM CC[C@H](c1ccncc1)N(CC)C(=O)c1cc(Cl)ccc1[O-] ZINC001465298010 1061727558 /nfs/dbraw/zinc/72/75/58/1061727558.db2.gz QTAWGZHZQTVDHC-OAHLLOKOSA-N -1 1 318.804 4.054 20 0 DIADMM CC[C@@H](c1ccncc1)N(CC)C(=O)c1cc(Cl)ccc1[O-] ZINC001465298009 1061727870 /nfs/dbraw/zinc/72/78/70/1061727870.db2.gz QTAWGZHZQTVDHC-HNNXBMFYSA-N -1 1 318.804 4.054 20 0 DIADMM Cc1cccc([C@H]2CCCN2C(=O)c2cccc([O-])c2F)c1C ZINC001465330326 1061735055 /nfs/dbraw/zinc/73/50/55/1061735055.db2.gz IVBAJGWCJPONJU-MRXNPFEDSA-N -1 1 313.372 4.125 20 0 DIADMM C[C@]1(c2ccccc2)C[C@@H]1NC(=O)c1cc2ccccc2cc1[O-] ZINC001465513238 1061767839 /nfs/dbraw/zinc/76/78/39/1061767839.db2.gz GRLWONTVQBHQKO-PZJWPPBQSA-N -1 1 317.388 4.005 20 0 DIADMM O=C(Nc1cc(Cl)ccc1NC1CC1)c1ccc([O-])cc1F ZINC001465621618 1061787221 /nfs/dbraw/zinc/78/72/21/1061787221.db2.gz MYJWLWPEUIKUTR-UHFFFAOYSA-N -1 1 320.751 4.011 20 0 DIADMM c1nn(C2CCCC2)cc1[N-]c1nc(-c2ccccc2)ns1 ZINC001458625443 1061858431 /nfs/dbraw/zinc/85/84/31/1061858431.db2.gz VLDZGOUCRGVBAM-UHFFFAOYSA-N -1 1 311.414 4.260 20 0 DIADMM CC(C)c1ccc(C[C@H](C)NC(=O)c2cc(F)ccc2[O-])cc1 ZINC001466093500 1061873272 /nfs/dbraw/zinc/87/32/72/1061873272.db2.gz ISHOVXGAUBPUGQ-ZDUSSCGKSA-N -1 1 315.388 4.016 20 0 DIADMM CCCCCC[C@H](O)CCC(=O)Nc1ccc([O-])c(Cl)c1 ZINC001466225460 1061901912 /nfs/dbraw/zinc/90/19/12/1061901912.db2.gz FAAHAAIXDFMHQP-ZDUSSCGKSA-N -1 1 313.825 4.096 20 0 DIADMM CCCC[C@@H](C)C(=O)Nc1cc(C)cc(Br)c1[O-] ZINC001466423214 1061938858 /nfs/dbraw/zinc/93/88/58/1061938858.db2.gz NKJDJKRFKRDVGF-SNVBAGLBSA-N -1 1 314.223 4.228 20 0 DIADMM Cc1ccccc1[C@]1(F)CCN(Cc2cccc([O-])c2Cl)C1 ZINC001474473010 1062152187 /nfs/dbraw/zinc/15/21/87/1062152187.db2.gz JBCKKUZPRGSERE-SFHVURJKSA-N -1 1 319.807 4.425 20 0 DIADMM [O-]c1ccc(-c2nnc([C@@H]3C[C@H]3c3ccccc3)o2)c(Cl)c1 ZINC001254511618 1062154021 /nfs/dbraw/zinc/15/40/21/1062154021.db2.gz CZOKPPOJSJVDNU-UONOGXRCSA-N -1 1 312.756 4.367 20 0 DIADMM C[C@@H]1C[C@H](CCNC(=O)c2cc(F)ccc2[O-])CC(C)(C)C1 ZINC001467635712 1062166859 /nfs/dbraw/zinc/16/68/59/1062166859.db2.gz FEABMYVIBZOQKK-OLZOCXBDSA-N -1 1 307.409 4.114 20 0 DIADMM C[C@H]1C[C@H](CCNC(=O)c2cc(F)ccc2[O-])CC(C)(C)C1 ZINC001467635714 1062167271 /nfs/dbraw/zinc/16/72/71/1062167271.db2.gz FEABMYVIBZOQKK-STQMWFEESA-N -1 1 307.409 4.114 20 0 DIADMM Cc1ccc2cccc([N-]S(=O)(=O)c3ccccc3C)c2c1 ZINC001254611586 1062200090 /nfs/dbraw/zinc/20/00/90/1062200090.db2.gz QJVWJGAXKCNGOU-UHFFFAOYSA-N -1 1 311.406 4.257 20 0 DIADMM CC(C)Cc1ccc(C(=O)Nc2ccc([O-])c(F)c2F)s1 ZINC001468004049 1062246472 /nfs/dbraw/zinc/24/64/72/1062246472.db2.gz XBTDUYROVSOOSX-UHFFFAOYSA-N -1 1 311.353 4.183 20 0 DIADMM Cc1cc2cc(C(=O)Nc3ccc([O-])c(F)c3F)oc2cc1C ZINC001468003778 1062247893 /nfs/dbraw/zinc/24/78/93/1062247893.db2.gz PLAQFCYNBSMIBF-UHFFFAOYSA-N -1 1 317.291 4.286 20 0 DIADMM C/C(=C\C(=O)Nc1ccc([O-])c(F)c1F)c1ccccc1C ZINC001468004109 1062248524 /nfs/dbraw/zinc/24/85/24/1062248524.db2.gz YCPCJDXQGRWUAL-PKNBQFBNSA-N -1 1 303.308 4.021 20 0 DIADMM CCc1cc(Cl)ccc1[N-]S(=O)(=O)c1cc(C)ccc1C ZINC001254786021 1062248875 /nfs/dbraw/zinc/24/88/75/1062248875.db2.gz CATZWPVVZFWZNC-UHFFFAOYSA-N -1 1 323.845 4.320 20 0 DIADMM COc1cccc2c1CCCCN2Cc1cccc([O-])c1Cl ZINC001474553892 1062255569 /nfs/dbraw/zinc/25/55/69/1062255569.db2.gz ARXIXDSOOGYYDB-UHFFFAOYSA-N -1 1 317.816 4.397 20 0 DIADMM COc1ccc(NCc2ccc([O-])c(F)c2F)cc1SC ZINC001474573532 1062283569 /nfs/dbraw/zinc/28/35/69/1062283569.db2.gz XHPYINPXKZAKGI-UHFFFAOYSA-N -1 1 311.353 4.013 20 0 DIADMM CCc1cc2c(CN(CC)c3ccccc3)cc(=O)oc2cc1[O-] ZINC001459720447 1062334382 /nfs/dbraw/zinc/33/43/82/1062334382.db2.gz GCQFFDYHEWOJHU-UHFFFAOYSA-N -1 1 323.392 4.088 20 0 DIADMM CCC[C@H](C(=O)Nc1cc([O-])c(F)cc1F)c1ccccc1 ZINC001468746049 1062391990 /nfs/dbraw/zinc/39/19/90/1062391990.db2.gz ZIQCAPJBVXCBPZ-LBPRGKRZSA-N -1 1 305.324 4.193 20 0 DIADMM CC(C)[C@@H]1N(C(=O)c2c([O-])cccc2Cl)CC12CCCC2 ZINC001468969727 1062451748 /nfs/dbraw/zinc/45/17/48/1062451748.db2.gz VFMVVLBTBGQIRT-HNNXBMFYSA-N -1 1 307.821 4.086 20 0 DIADMM CC1(C)CCC(C)(CNC(=O)c2ccc(Cl)cc2[O-])CC1 ZINC001469046081 1062467656 /nfs/dbraw/zinc/46/76/56/1062467656.db2.gz MCCZDIUZYHXCSF-UHFFFAOYSA-N -1 1 309.837 4.382 20 0 DIADMM CCCC[C@@H](CCC)[N-]S(=O)(=O)c1cc(Cl)ccc1F ZINC001475052413 1062489301 /nfs/dbraw/zinc/48/93/01/1062489301.db2.gz MOKMBDQQDOMTRF-GFCCVEGCSA-N -1 1 321.845 4.116 20 0 DIADMM O=C(c1ccc2ccccc2c1[O-])N1CC[C@@H](C2CCCC2)C1 ZINC001469194555 1062501308 /nfs/dbraw/zinc/50/13/08/1062501308.db2.gz DEJGBKSNASPSIS-MRXNPFEDSA-N -1 1 309.409 4.198 20 0 DIADMM O=C(c1cc2ccccc2cc1[O-])N1CC[C@@H]1c1ccc(F)cc1 ZINC001469935856 1062663275 /nfs/dbraw/zinc/66/32/75/1062663275.db2.gz IJKQAUSPKORIQF-GOSISDBHSA-N -1 1 321.351 4.272 20 0 DIADMM COc1ccc(C(=O)Nc2ccc(Cl)cc2SC)c([O-])c1 ZINC001470026268 1062686199 /nfs/dbraw/zinc/68/61/99/1062686199.db2.gz XIEVPAJXBQWEFT-UHFFFAOYSA-N -1 1 323.801 4.028 20 0 DIADMM Cc1ccc(-c2nnc(-c3cc([O-])cc(F)c3F)o2)cc1C ZINC001256598795 1062909826 /nfs/dbraw/zinc/90/98/26/1062909826.db2.gz JNFCJMCVMUFFGK-UHFFFAOYSA-N -1 1 302.280 4.004 20 0 DIADMM Cc1cccc2c1[C@@H](C)C[C@H]2CC(=O)Nc1cccc(F)c1[O-] ZINC001471168510 1062934832 /nfs/dbraw/zinc/93/48/32/1062934832.db2.gz QZULPUZKDQOPOU-STQMWFEESA-N -1 1 313.372 4.459 20 0 DIADMM C[C@H]1CCC[C@H](C2CN(C(=O)c3cc4ccccc4cc3[O-])C2)C1 ZINC001471317634 1062962702 /nfs/dbraw/zinc/96/27/02/1062962702.db2.gz SRFDYCWBQNSAAD-GJZGRUSLSA-N -1 1 323.436 4.444 20 0 DIADMM Cc1cc(C)c([N-]S(=O)(=O)c2cccc(Cl)c2)cc1C ZINC001256804236 1062989981 /nfs/dbraw/zinc/98/99/81/1062989981.db2.gz NINPLOPNUXLUBQ-UHFFFAOYSA-N -1 1 309.818 4.066 20 0 DIADMM O=C(NCc1ccc([O-])c(Cl)c1)c1ccccc1C1CCC1 ZINC001471700007 1063016031 /nfs/dbraw/zinc/01/60/31/1063016031.db2.gz BXSSBPYCBIJHTQ-UHFFFAOYSA-N -1 1 315.800 4.243 20 0 DIADMM CCc1ccc2ccccc2c1CNC(=O)c1ccc(F)c([O-])c1 ZINC001471758263 1063021031 /nfs/dbraw/zinc/02/10/31/1063021031.db2.gz XVFQPRYWHGXLGT-UHFFFAOYSA-N -1 1 323.367 4.177 20 0 DIADMM Cc1cccc(S(=O)(=O)[N-]c2cccc3cccc(C)c32)c1 ZINC001256958228 1063057330 /nfs/dbraw/zinc/05/73/30/1063057330.db2.gz FFCVYPPDNWVDEK-UHFFFAOYSA-N -1 1 311.406 4.257 20 0 DIADMM Cc1cccc(S(=O)(=O)[N-]c2c(C)cccc2C(C)(C)C)c1 ZINC001256953928 1063058335 /nfs/dbraw/zinc/05/83/35/1063058335.db2.gz INYHZFUVZZYCEV-UHFFFAOYSA-N -1 1 317.454 4.402 20 0 DIADMM C/C(=C/C(=O)Nc1cc(F)c([O-])cc1Cl)c1cccs1 ZINC001472193870 1063058353 /nfs/dbraw/zinc/05/83/53/1063058353.db2.gz CPEGWUGZFVRBMA-YVMONPNESA-N -1 1 311.765 4.288 20 0 DIADMM O=C(Cc1ccc([O-])c(Cl)c1)N1CCC[C@@H](C2CCCC2)C1 ZINC001472380966 1063081655 /nfs/dbraw/zinc/08/16/55/1063081655.db2.gz RSUCOBNXXAJKLE-OAHLLOKOSA-N -1 1 321.848 4.017 20 0 DIADMM Cc1ccc([C@@H]2C[C@@H]2c2nnc(-c3ccc([O-])cc3F)o2)cc1 ZINC001257326180 1063209683 /nfs/dbraw/zinc/20/96/83/1063209683.db2.gz XBMRPEPUVNBRMJ-GJZGRUSLSA-N -1 1 310.328 4.161 20 0 DIADMM C=Cc1ccccc1[N-]S(=O)(=O)c1cccc(Cl)c1C ZINC001257621612 1063352889 /nfs/dbraw/zinc/35/28/89/1063352889.db2.gz SUZBOTRCUDARLS-UHFFFAOYSA-N -1 1 307.802 4.092 20 0 DIADMM CC[C@@H]1CCCC[C@@H]1N(C)C(=O)NCc1ccc([O-])c(Cl)c1 ZINC001479211211 1063399470 /nfs/dbraw/zinc/39/94/70/1063399470.db2.gz FZVOTGNFWGADBO-HIFRSBDPSA-N -1 1 324.852 4.156 20 0 DIADMM CC(C)C[C@@H]1CCCN(C(=O)NCc2ccc([O-])c(Cl)c2)C1 ZINC001479210982 1063399498 /nfs/dbraw/zinc/39/94/98/1063399498.db2.gz BMNBNXACYMTCBS-AWEZNQCLSA-N -1 1 324.852 4.013 20 0 DIADMM CC[C@H]1CCCC[C@H]1N(C)C(=O)NCc1ccc([O-])c(Cl)c1 ZINC001479211209 1063401126 /nfs/dbraw/zinc/40/11/26/1063401126.db2.gz FZVOTGNFWGADBO-DZGCQCFKSA-N -1 1 324.852 4.156 20 0 DIADMM CSc1cc(Cl)ccc1[N-]C(=O)c1scnc1Cl ZINC001461500195 1063541039 /nfs/dbraw/zinc/54/10/39/1063541039.db2.gz AUBMEODDNRVIBL-UHFFFAOYSA-N -1 1 319.238 4.424 20 0 DIADMM CC(C)CCc1nnc(-c2cc(C(F)(F)F)ccc2[O-])o1 ZINC001258356805 1063622676 /nfs/dbraw/zinc/62/26/76/1063622676.db2.gz MDDHDQAHWLVTTC-UHFFFAOYSA-N -1 1 300.280 4.050 20 0 DIADMM [O-]c1cccc(CNc2cncc(C(F)(F)F)c2)c1Cl ZINC001461822098 1063737647 /nfs/dbraw/zinc/73/76/47/1063737647.db2.gz IUOFEKRKRJPVQO-UHFFFAOYSA-N -1 1 302.683 4.072 20 0 DIADMM CC[C@H](C)c1ccccc1[N-]S(=O)(=O)c1cc(F)ccc1C ZINC001258920737 1063880469 /nfs/dbraw/zinc/88/04/69/1063880469.db2.gz OYZMZSRYJKGHIY-LBPRGKRZSA-N -1 1 321.417 4.448 20 0 DIADMM Cc1ccccc1[C@H](C)CC(=O)Nc1cc(F)cc(F)c1[O-] ZINC001299581457 1063887437 /nfs/dbraw/zinc/88/74/37/1063887437.db2.gz RCXALLMNQDFOKO-LLVKDONJSA-N -1 1 305.324 4.111 20 0 DIADMM Cc1cc2cc(C(=O)Nc3cc(F)cc(F)c3[O-])oc2cc1C ZINC001299582225 1063887805 /nfs/dbraw/zinc/88/78/05/1063887805.db2.gz YZUIZVXJHRUJLB-UHFFFAOYSA-N -1 1 317.291 4.286 20 0 DIADMM CCc1cc([N-]S(=O)(=O)c2ccc(C)c(F)c2)c(C)cc1C ZINC001259480668 1063889206 /nfs/dbraw/zinc/88/92/06/1063889206.db2.gz SHDVWJDEWOYISK-UHFFFAOYSA-N -1 1 321.417 4.114 20 0 DIADMM Cc1cccc(S(=O)(=O)[N-]c2cc3cccccc-3c2)c1C ZINC001260992505 1063907746 /nfs/dbraw/zinc/90/77/46/1063907746.db2.gz WNFFLPSDAHZCBM-UHFFFAOYSA-N -1 1 311.406 4.209 20 0 DIADMM Cc1cccc(S(=O)(=O)[N-]c2cccc(Cl)c2C)c1C ZINC001260992112 1063908120 /nfs/dbraw/zinc/90/81/20/1063908120.db2.gz ZPBPJRFUPWPVNG-UHFFFAOYSA-N -1 1 309.818 4.066 20 0 DIADMM CC[C@H](C)N(Cc1ccccc1)C(=O)c1ccc(Cl)cc1[O-] ZINC000387271770 1064069960 /nfs/dbraw/zinc/06/99/60/1064069960.db2.gz MYBLDBGNAIBDMR-ZDUSSCGKSA-N -1 1 317.816 4.487 20 0 DIADMM C[C@@H](CNC(=O)c1cc2ccccc2cc1[O-])c1ccccc1 ZINC000391329698 1064185762 /nfs/dbraw/zinc/18/57/62/1064185762.db2.gz SDBQMHSRORUCKJ-AWEZNQCLSA-N -1 1 305.377 4.079 20 0 DIADMM C[C@H]([N-]C(=O)C(F)F)c1ccc(Cl)c(Cl)c1Cl ZINC001265059416 1064188357 /nfs/dbraw/zinc/18/83/57/1064188357.db2.gz YCLRVIVIYYDQDZ-BYPYZUCNSA-N -1 1 302.535 4.089 20 0 DIADMM Cc1ccc(NC(=O)c2ccc3ccc(O)cc3c2[O-])cc1C ZINC001290101732 1064682542 /nfs/dbraw/zinc/68/25/42/1064682542.db2.gz RALCSTYRDRRPSG-UHFFFAOYSA-N -1 1 307.349 4.120 20 0 DIADMM CCC[C@@H](NC(=O)c1ccc(Cl)cc1[O-])c1ccccc1 ZINC001290533546 1064698729 /nfs/dbraw/zinc/69/87/29/1064698729.db2.gz LOIQEDBKPDYAAD-OAHLLOKOSA-N -1 1 303.789 4.317 20 0 DIADMM CC(C)(C)CC(C)(C)C(=O)Nc1ccc(-c2cc(=O)[nH][n-]2)cc1 ZINC001290782181 1064712014 /nfs/dbraw/zinc/71/20/14/1064712014.db2.gz LUBVXVAJMQNIGD-UHFFFAOYSA-N -1 1 315.417 4.183 20 0 DIADMM CC(C)C[C@@H]1CCCN1C(=O)c1ccc(C(F)(F)F)c([O-])c1 ZINC001292677927 1064782446 /nfs/dbraw/zinc/78/24/46/1064782446.db2.gz XHMCPTVKHVOZBS-LBPRGKRZSA-N -1 1 315.335 4.062 20 0 DIADMM Cc1ccccc1[C@H](CC(C)C)NC(=O)c1cc(F)ccc1[O-] ZINC001293385116 1064812474 /nfs/dbraw/zinc/81/24/74/1064812474.db2.gz CTIWGFPMFQWNRU-KRWDZBQOSA-N -1 1 315.388 4.357 20 0 DIADMM CC[C@@H]1c2ccccc2CCN1C(=O)c1c([O-])cccc1Cl ZINC001293503344 1064819110 /nfs/dbraw/zinc/81/91/10/1064819110.db2.gz BKYKUCGVJPVWOX-OAHLLOKOSA-N -1 1 315.800 4.195 20 0 DIADMM CC[C@@H](NC(=O)c1cc(F)ccc1[O-])C(C)(C)c1ccccc1 ZINC001293844732 1064833947 /nfs/dbraw/zinc/83/39/47/1064833947.db2.gz BALHFCNCBPKYFF-QGZVFWFLSA-N -1 1 315.388 4.018 20 0 DIADMM CCCn1ccc2ccc(NC(=O)c3cc(F)ccc3[O-])cc21 ZINC001293965807 1064842419 /nfs/dbraw/zinc/84/24/19/1064842419.db2.gz DPNKKXKXHGJBSJ-UHFFFAOYSA-N -1 1 312.344 4.148 20 0 DIADMM CCC[C@@H]1[C@H](C)CCCN1C(=O)Cc1ccc([O-])c(Cl)c1 ZINC001294211255 1064855509 /nfs/dbraw/zinc/85/55/09/1064855509.db2.gz DPCDZLFDRSDWOF-IUODEOHRSA-N -1 1 309.837 4.015 20 0 DIADMM CC(C)(C)[C@@H]1CCC[C@@H](NC(=O)c2ccc([O-])c(F)c2)CC1 ZINC001296516016 1064950106 /nfs/dbraw/zinc/95/01/06/1064950106.db2.gz SMHMHIZZHODIRU-ZIAGYGMSSA-N -1 1 307.409 4.256 20 0 DIADMM CCCN(C(=O)c1ccc([O-])c(F)c1)c1ccc(CC)cc1 ZINC001298110861 1064997701 /nfs/dbraw/zinc/99/77/01/1064997701.db2.gz MBUJZQREXUQAQS-UHFFFAOYSA-N -1 1 301.361 4.151 20 0 DIADMM Cc1cc(Cl)c(C(=O)Nc2cc([O-])c(F)cc2F)cc1C ZINC001298972747 1065026841 /nfs/dbraw/zinc/02/68/41/1065026841.db2.gz JFWZCYQOJOGUQC-UHFFFAOYSA-N -1 1 311.715 4.193 20 0 DIADMM O=C(Nc1cc([O-])c(F)cc1F)[C@H]1CCC[C@@H]1c1ccccc1 ZINC001298972530 1065027060 /nfs/dbraw/zinc/02/70/60/1065027060.db2.gz GLCREZSKOFQKPS-OLZOCXBDSA-N -1 1 317.335 4.193 20 0 DIADMM Cc1cccc2c1CCC[C@@H]2NC(=O)c1c([O-])cccc1Cl ZINC001301381680 1065062944 /nfs/dbraw/zinc/06/29/44/1065062944.db2.gz ZCUWHWGDHJNQBV-HNNXBMFYSA-N -1 1 315.800 4.161 20 0 DIADMM Cc1cccc2c1CCC[C@H]2NC(=O)c1ccc(Cl)cc1[O-] ZINC001301380235 1065063232 /nfs/dbraw/zinc/06/32/32/1065063232.db2.gz FIJKYHFXNNCESL-MRXNPFEDSA-N -1 1 315.800 4.161 20 0 DIADMM O=C(Cc1coc2cc(Cl)ccc12)Nc1cccc(F)c1[O-] ZINC001302486989 1065089234 /nfs/dbraw/zinc/08/92/34/1065089234.db2.gz TXAKBJIWKZKRKQ-UHFFFAOYSA-N -1 1 319.719 4.112 20 0 DIADMM CC[C@H](Cc1ccccc1C)C(=O)Nc1cccc(F)c1[O-] ZINC001302484363 1065090037 /nfs/dbraw/zinc/09/00/37/1065090037.db2.gz BSNHYOAYESGBLP-CYBMUJFWSA-N -1 1 301.361 4.047 20 0 DIADMM COc1ccccc1[C@@H](C)NC(=O)c1ccc2ccccc2c1[O-] ZINC001302687736 1065094894 /nfs/dbraw/zinc/09/48/94/1065094894.db2.gz SAAWNGDZIKDGDY-CYBMUJFWSA-N -1 1 321.376 4.045 20 0 DIADMM O=C(Nc1cscc1Cl)c1ccc(C(F)(F)F)cc1[O-] ZINC001303264609 1065111668 /nfs/dbraw/zinc/11/16/68/1065111668.db2.gz IKUUHMHQULPDNY-UHFFFAOYSA-N -1 1 321.707 4.378 20 0 DIADMM C[C@H]1Cc2cc(NC(=O)c3ccc4ccccc4c3[O-])ccc2O1 ZINC001304220233 1065132458 /nfs/dbraw/zinc/13/24/58/1065132458.db2.gz MTFBQRWPTQZSKI-LBPRGKRZSA-N -1 1 319.360 4.121 20 0 DIADMM O=C(Nc1cc(F)c([O-])cc1Cl)[C@H]1C[C@]1(F)c1ccccc1 ZINC001304283157 1065135355 /nfs/dbraw/zinc/13/53/55/1065135355.db2.gz WQRBMVZFRCFQGK-HWPZZCPQSA-N -1 1 323.726 4.008 20 0 DIADMM O=C(Nc1cc(F)c([O-])cc1Cl)C1(C2CCCCC2)CC1 ZINC001304283413 1065135630 /nfs/dbraw/zinc/13/56/30/1065135630.db2.gz WZRMYDXHJDZQPA-UHFFFAOYSA-N -1 1 311.784 4.484 20 0 DIADMM CC(C)(CC(=O)Nc1cc(F)c([O-])cc1Cl)c1ccccc1 ZINC001304283220 1065136267 /nfs/dbraw/zinc/13/62/67/1065136267.db2.gz DLPCBYVZNJOZBC-UHFFFAOYSA-N -1 1 321.779 4.491 20 0 DIADMM O=C(Nc1cc(F)c([O-])cc1Cl)[C@@H](c1ccccc1)C1CC1 ZINC001304284319 1065136342 /nfs/dbraw/zinc/13/63/42/1065136342.db2.gz KTFITQFLPYLTPR-INIZCTEOSA-N -1 1 319.763 4.317 20 0 DIADMM Cc1ccc(CSc2nc(-c3ccccc3)c(C)c(=O)[n-]2)cn1 ZINC001307327213 1065342600 /nfs/dbraw/zinc/34/26/00/1065342600.db2.gz GOOZHKSACCFYBU-UHFFFAOYSA-N -1 1 323.421 4.153 20 0 DIADMM [O-]c1ccc(CN2CCCCC[C@H]2c2ccco2)c(F)c1F ZINC001308572374 1066083387 /nfs/dbraw/zinc/08/33/87/1066083387.db2.gz BIOHYZOHXZZQOC-ZDUSSCGKSA-N -1 1 307.340 4.381 20 0 DIADMM O=C(NCc1ccc(Cl)cc1)c1ccc2ccccc2c1[O-] ZINC000006584075 181356929 /nfs/dbraw/zinc/35/69/29/181356929.db2.gz LSUIBLVDVBWYCI-UHFFFAOYSA-N -1 1 311.768 4.129 20 0 DIADMM O=S(=O)([N-]c1cccc(-c2ccccc2)c1)c1ccccc1 ZINC000563765193 335002476 /nfs/dbraw/zinc/00/24/76/335002476.db2.gz CCPPCAJMFFDFAH-UHFFFAOYSA-N -1 1 309.390 4.154 20 0 DIADMM Cc1cccc(C)c1NC(=O)c1cc(Br)ccc1[O-] ZINC000011639323 181696856 /nfs/dbraw/zinc/69/68/56/181696856.db2.gz QUSJHALOCXXHKM-UHFFFAOYSA-N -1 1 320.186 4.024 20 0 DIADMM O=C([O-])CC[C@@H]1CCCN(Cc2ccc(Cl)c(Cl)c2)C1 ZINC000043585245 132156342 /nfs/dbraw/zinc/15/63/42/132156342.db2.gz WGTUZPDZBDTXRW-NSHDSACASA-N -1 1 316.228 4.070 20 0 DIADMM CC(C)c1ccc(CNCc2ccc(C(=O)[O-])c(C3CC3)n2)cc1 ZINC000417709709 335067116 /nfs/dbraw/zinc/06/71/16/335067116.db2.gz TZJUCITVNAVOGS-UHFFFAOYSA-N -1 1 324.424 4.070 20 0 DIADMM O=C(Nc1ccc([O-])c(Cl)c1)c1csc2c1CCCC2 ZINC000399769958 331484384 /nfs/dbraw/zinc/48/43/84/331484384.db2.gz MEIGGECAZZZINJ-UHFFFAOYSA-N -1 1 307.802 4.238 20 0 DIADMM [O-]c1c(-c2nc(Cc3ccccc3)no2)ccc2ccccc21 ZINC000109037018 331504683 /nfs/dbraw/zinc/50/46/83/331504683.db2.gz KOYAFEVUEJHZDE-UHFFFAOYSA-N -1 1 302.333 4.186 20 0 DIADMM Cc1ccccc1C1(C(=O)Nc2ccc([O-])c(Cl)c2)CC1 ZINC000182868626 331536580 /nfs/dbraw/zinc/53/65/80/331536580.db2.gz NCSUWANYADBLBN-UHFFFAOYSA-N -1 1 301.773 4.024 20 0 DIADMM O=C(Nc1ccc([O-])c(Cl)c1)[C@H](c1ccccc1)C1CC1 ZINC000182873084 331540696 /nfs/dbraw/zinc/54/06/96/331540696.db2.gz XLWOPHVWLZMWME-MRXNPFEDSA-N -1 1 301.773 4.178 20 0 DIADMM COCC1(c2noc(-c3ccc4ccccc4c3[O-])n2)CCCC1 ZINC000312980231 331799612 /nfs/dbraw/zinc/79/96/12/331799612.db2.gz OHKRKCRLHOMHAF-UHFFFAOYSA-N -1 1 324.380 4.054 20 0 DIADMM C[C@@H](Sc1nc(C(F)F)cc(=O)[n-]1)c1ccc(F)c(F)c1 ZINC000558463930 331909425 /nfs/dbraw/zinc/90/94/25/331909425.db2.gz LVQDYMUYARGADA-ZCFIWIBFSA-N -1 1 318.295 4.251 20 0 DIADMM CC(C)(C)c1ccc(CN[C@@H](C(=O)[O-])c2ccccc2F)cc1 ZINC000426770722 331967050 /nfs/dbraw/zinc/96/70/50/331967050.db2.gz VHPUPDDTJRJYAP-QGZVFWFLSA-N -1 1 315.388 4.039 20 0 DIADMM CSc1ccc(NC(=O)Nc2ccc([O-])c(Cl)c2)cc1 ZINC000190927420 332011577 /nfs/dbraw/zinc/01/15/77/332011577.db2.gz FHABIMCRPQOTSV-UHFFFAOYSA-N -1 1 308.790 4.412 20 0 DIADMM Cc1ccc([C@@H](CC(=O)[O-])NCc2csc3ccccc23)o1 ZINC000426777055 332135679 /nfs/dbraw/zinc/13/56/79/332135679.db2.gz KBBPXUNESFAAQF-CQSZACIVSA-N -1 1 315.394 4.108 20 0 DIADMM CCc1ccc(CN[C@H](CC(=O)[O-])c2ccc(C(C)C)cc2)o1 ZINC000426808851 332152036 /nfs/dbraw/zinc/15/20/36/332152036.db2.gz OKAPECHXFMDTRE-GOSISDBHSA-N -1 1 315.413 4.271 20 0 DIADMM Cc1ccc(F)c(CN[C@@H](C(=O)[O-])c2ccc(Cl)c(C)c2)c1 ZINC000426782723 332152670 /nfs/dbraw/zinc/15/26/70/332152670.db2.gz HOMNDEBUQUVMQE-MRXNPFEDSA-N -1 1 321.779 4.011 20 0 DIADMM CC(C)c1ccc([C@@H](CC(=O)[O-])NCc2ccccc2F)cc1 ZINC000426805982 332155629 /nfs/dbraw/zinc/15/56/29/332155629.db2.gz HPCXQBKAFNIXPZ-GOSISDBHSA-N -1 1 315.388 4.255 20 0 DIADMM Cc1ccc(-c2ccc(CN[C@H](CC(C)(C)C)C(=O)[O-])o2)cc1 ZINC000426829677 332156049 /nfs/dbraw/zinc/15/60/49/332156049.db2.gz QUEVKHKJDIKUDP-MRXNPFEDSA-N -1 1 315.413 4.234 20 0 DIADMM C[C@H](NC(=O)c1ccc([O-])cc1F)c1cccc2ccccc21 ZINC000181035355 333029448 /nfs/dbraw/zinc/02/94/48/333029448.db2.gz QGBILEAZIMFJFV-LBPRGKRZSA-N -1 1 309.340 4.176 20 0 DIADMM CSc1ccc(NC(=O)c2ccc([O-])cc2F)cc1Cl ZINC000181249724 333029808 /nfs/dbraw/zinc/02/98/08/333029808.db2.gz SGFNGWWJIRPEKT-UHFFFAOYSA-N -1 1 311.765 4.159 20 0 DIADMM Cc1cccc([N-]S(=O)(=O)c2ccccc2C(C)(C)C)c1 ZINC000460406027 333079522 /nfs/dbraw/zinc/07/95/22/333079522.db2.gz BUPWOOJNOZNFLL-UHFFFAOYSA-N -1 1 303.427 4.093 20 0 DIADMM Cc1cccc([N-]S(=O)(=O)c2ccccc2C(C)(C)C)c1C ZINC000460410555 333080868 /nfs/dbraw/zinc/08/08/68/333080868.db2.gz GTDVBOPMONIWDR-UHFFFAOYSA-N -1 1 317.454 4.402 20 0 DIADMM C[C@@H](c1ccccc1)N(C)C(=O)c1ccc2ccccc2c1[O-] ZINC000394872660 334163444 /nfs/dbraw/zinc/16/34/44/334163444.db2.gz DWBWFDKITCYTLS-AWEZNQCLSA-N -1 1 305.377 4.379 20 0 DIADMM CCCc1nc(-c2nc3sc(C(C)(C)C)cc3c(=O)[n-]2)co1 ZINC000582146739 334269368 /nfs/dbraw/zinc/26/93/68/334269368.db2.gz HNZZYKDAQMAYDB-UHFFFAOYSA-N -1 1 317.414 4.302 20 0 DIADMM C[C@@H]1CN(C(=O)c2ccc3ccccc3c2[O-])c2ccccc21 ZINC000398491006 335651619 /nfs/dbraw/zinc/65/16/19/335651619.db2.gz DINQORUKGDKBAM-CYBMUJFWSA-N -1 1 303.361 4.309 20 0 DIADMM C/C(=C/c1nc(-c2ccc([O-])c(F)c2)no1)c1cccc(F)c1 ZINC000445479419 338496376 /nfs/dbraw/zinc/49/63/76/338496376.db2.gz HPGUMSXFWUZBQO-YFHOEESVSA-N -1 1 314.291 4.281 20 0 DIADMM Cc1ccccc1SCc1nc(-c2ccc([O-])c(F)c2)no1 ZINC000445481670 338496489 /nfs/dbraw/zinc/49/64/89/338496489.db2.gz PPUDXNTYGYHJMF-UHFFFAOYSA-N -1 1 316.357 4.182 20 0 DIADMM O=C(Nc1ccc([O-])c(Cl)c1)[C@H]1C[C@@H]1c1ccc(F)cc1F ZINC000113460976 335745469 /nfs/dbraw/zinc/74/54/69/335745469.db2.gz NCOQMTCONJPBOV-NEPJUHHUSA-N -1 1 323.726 4.066 20 0 DIADMM O=C(Nc1ccc(F)cc1[O-])c1cccc(Cl)c1Cl ZINC000532266535 335927490 /nfs/dbraw/zinc/92/74/90/335927490.db2.gz JKKXMXIOORGRSD-UHFFFAOYSA-N -1 1 300.116 4.090 20 0 DIADMM C[C@@H](CSCc1ccccc1)C(=O)Nc1ccc(F)cc1[O-] ZINC000532701558 336267128 /nfs/dbraw/zinc/26/71/28/336267128.db2.gz FMFZLVVLICKOHS-LBPRGKRZSA-N -1 1 319.401 4.039 20 0 DIADMM O=C(c1cc2ccccc2cc1[O-])N1CCC2(CCCC2)CC1 ZINC000320924206 336385692 /nfs/dbraw/zinc/38/56/92/336385692.db2.gz QTXWIMIHQAKKFA-UHFFFAOYSA-N -1 1 309.409 4.342 20 0 DIADMM Cc1c(F)cccc1[N-]S(=O)(=O)c1cccc2ccccc21 ZINC000389769427 336892431 /nfs/dbraw/zinc/89/24/31/336892431.db2.gz WRNOZQDSYIWBTB-UHFFFAOYSA-N -1 1 315.369 4.088 20 0 DIADMM COC(=O)c1c[n-]c(S[C@@H](C)c2ccc3ccccc3c2)n1 ZINC000193543813 337077870 /nfs/dbraw/zinc/07/78/70/337077870.db2.gz FJGZKTGFLXKTMR-NSHDSACASA-N -1 1 312.394 4.203 20 0 DIADMM O=C(Nc1ccc2cc[nH]c2c1)Nc1ccc([O-])c(Cl)c1 ZINC000194280032 337130334 /nfs/dbraw/zinc/13/03/34/337130334.db2.gz YVBYSPFVMGQJTN-UHFFFAOYSA-N -1 1 301.733 4.171 20 0 DIADMM CCc1nc(SCc2ccc(Cl)cc2OC)[n-]c(=O)c1C ZINC000584480710 337348863 /nfs/dbraw/zinc/34/88/63/337348863.db2.gz LASIKNPCMHOTNY-UHFFFAOYSA-N -1 1 324.833 4.007 20 0 DIADMM CCOc1cc(-c2noc(C3CCCC3)n2)cc(Cl)c1[O-] ZINC000445414141 337682625 /nfs/dbraw/zinc/68/26/25/337682625.db2.gz WJZGXFFPXXRXQF-UHFFFAOYSA-N -1 1 308.765 4.152 20 0 DIADMM CCOc1cc(-c2noc(-c3cccs3)n2)cc(Cl)c1[O-] ZINC000445413713 337682627 /nfs/dbraw/zinc/68/26/27/337682627.db2.gz VQENRERNJBVPDY-UHFFFAOYSA-N -1 1 322.773 4.223 20 0 DIADMM CCOc1cc(-c2noc([C@@H]3CC[C@@H](C)C3)n2)cc(Cl)c1[O-] ZINC000445429491 337729612 /nfs/dbraw/zinc/72/96/12/337729612.db2.gz ABDJSFGHOWPDFP-NXEZZACHSA-N -1 1 322.792 4.398 20 0 DIADMM CCN(C(=O)c1cc(Cl)c([O-])c(OC)c1)c1ccccc1C ZINC000527483988 337743922 /nfs/dbraw/zinc/74/39/22/337743922.db2.gz UFVYHJBVAYLTQN-UHFFFAOYSA-N -1 1 319.788 4.029 20 0 DIADMM CCOc1cccc(-c2nc(-c3ccc([O-])cc3Cl)no2)c1 ZINC000445446008 337845048 /nfs/dbraw/zinc/84/50/48/337845048.db2.gz KQKBDMYTNRMBRR-UHFFFAOYSA-N -1 1 316.744 4.161 20 0 DIADMM [O-]c1ccc(-c2noc(C(F)(F)c3ccccc3)n2)c(Cl)c1 ZINC000445447989 337849402 /nfs/dbraw/zinc/84/94/02/337849402.db2.gz JTPUYAVAOFVQGY-UHFFFAOYSA-N -1 1 322.698 4.236 20 0 DIADMM [O-]c1ccc(-c2noc(C3(c4ccccc4)CC3)n2)c(Cl)c1 ZINC000445450895 338015749 /nfs/dbraw/zinc/01/57/49/338015749.db2.gz YARNXFRJRXCYQQ-UHFFFAOYSA-N -1 1 312.756 4.176 20 0 DIADMM [O-]c1ccc(-c2noc(CCc3cc(Cl)cs3)n2)c(F)c1 ZINC000445453684 338017139 /nfs/dbraw/zinc/01/71/39/338017139.db2.gz CDQGLMNFRGHCFK-UHFFFAOYSA-N -1 1 324.764 4.081 20 0 DIADMM C[C@H](c1nc(-c2ccc([O-])cc2F)no1)c1c(F)cccc1F ZINC000445456278 338017444 /nfs/dbraw/zinc/01/74/44/338017444.db2.gz IJPIYNYZCDTRBO-QMMMGPOBSA-N -1 1 320.270 4.011 20 0 DIADMM Cc1ccc(SCc2nc(-c3ccc([O-])cc3F)no2)cc1 ZINC000445456709 338017634 /nfs/dbraw/zinc/01/76/34/338017634.db2.gz VQNOMKVXEBPGGJ-UHFFFAOYSA-N -1 1 316.357 4.182 20 0 DIADMM C/C(=C\c1ccc(F)cc1)c1nc(-c2ccc([O-])cc2F)no1 ZINC000445458491 338018069 /nfs/dbraw/zinc/01/80/69/338018069.db2.gz YGFGAORWZNOLAI-CSKARUKUSA-N -1 1 314.291 4.281 20 0 DIADMM [O-]c1ccc(-c2noc([C@@H]3CCCc4ccccc43)n2)c(F)c1 ZINC000445461014 338021366 /nfs/dbraw/zinc/02/13/66/338021366.db2.gz DRQVBFCPIOZHJF-CQSZACIVSA-N -1 1 310.328 4.050 20 0 DIADMM [O-]c1ccc(-c2noc(CCc3ccccc3Cl)n2)c(F)c1 ZINC000445463661 338031402 /nfs/dbraw/zinc/03/14/02/338031402.db2.gz PQNGPSABGOXMCW-UHFFFAOYSA-N -1 1 318.735 4.020 20 0 DIADMM CCCC[C@H](NCc1ccc(-c2ccc(CC)cc2)o1)C(=O)[O-] ZINC000426669464 338037577 /nfs/dbraw/zinc/03/75/77/338037577.db2.gz MKJKPPAULZPWFE-KRWDZBQOSA-N -1 1 315.413 4.242 20 0 DIADMM Cc1ccc([C@H](NCc2ccc(Cl)cc2Cl)C(=O)[O-])cc1 ZINC000426706062 338038622 /nfs/dbraw/zinc/03/86/22/338038622.db2.gz YMVRNDUIGXOCME-HNNXBMFYSA-N -1 1 324.207 4.217 20 0 DIADMM O=C([O-])c1coc(CNCc2cccc(Oc3ccccc3)c2)c1 ZINC000426706765 338038694 /nfs/dbraw/zinc/03/86/94/338038694.db2.gz WWBRMFFQXDUHDB-UHFFFAOYSA-N -1 1 323.348 4.060 20 0 DIADMM Cc1ccc([C@@H](NCc2cc(Cl)ccc2Cl)C(=O)[O-])cc1 ZINC000426708681 338038773 /nfs/dbraw/zinc/03/87/73/338038773.db2.gz LWXIYWSCQNHHLM-OAHLLOKOSA-N -1 1 324.207 4.217 20 0 DIADMM O=C([O-])c1ccc(CNCc2c(Cl)oc3ccccc32)cc1 ZINC000426711567 338038888 /nfs/dbraw/zinc/03/88/88/338038888.db2.gz PFGHYGGVIYJNDD-UHFFFAOYSA-N -1 1 315.756 4.074 20 0 DIADMM CC(C)(C)CC[C@H](NCc1ccc(-c2ccccc2)o1)C(=O)[O-] ZINC000426747266 338040472 /nfs/dbraw/zinc/04/04/72/338040472.db2.gz OAWQWKVWHTUKPI-INIZCTEOSA-N -1 1 315.413 4.316 20 0 DIADMM Cc1cc(C)cc([C@H](NCc2cccc(Cl)c2F)C(=O)[O-])c1 ZINC000426757518 338041077 /nfs/dbraw/zinc/04/10/77/338041077.db2.gz PKOCJVIMDCWQOR-INIZCTEOSA-N -1 1 321.779 4.011 20 0 DIADMM CCc1cc(=O)[n-]c(SCC2CCC(C(F)(F)F)CC2)n1 ZINC000436190457 338261372 /nfs/dbraw/zinc/26/13/72/338261372.db2.gz ULXUTCFYDWOLRV-UHFFFAOYSA-N -1 1 320.380 4.205 20 0 DIADMM Cc1cccc2c1N(C(=O)c1ccc3ccccc3c1[O-])CC2 ZINC000436511605 338274626 /nfs/dbraw/zinc/27/46/26/338274626.db2.gz LDGHAPAYKGUODG-UHFFFAOYSA-N -1 1 303.361 4.057 20 0 DIADMM CCN(CCc1ccccc1)C(=O)c1ccc2ccccc2c1[O-] ZINC000436509906 338274647 /nfs/dbraw/zinc/27/46/47/338274647.db2.gz CHOIFDPPPUVDQQ-UHFFFAOYSA-N -1 1 319.404 4.250 20 0 DIADMM CC[C@@H](c1ccccc1)N(CC)C(=O)c1cc(F)ccc1[O-] ZINC000436540540 338276163 /nfs/dbraw/zinc/27/61/63/338276163.db2.gz RXMNLPAPXZWIFA-INIZCTEOSA-N -1 1 301.361 4.145 20 0 DIADMM CCN(C(=O)c1cc2ccccc2cc1[O-])c1ccccc1OC ZINC000436541592 338276221 /nfs/dbraw/zinc/27/62/21/338276221.db2.gz WROYAJIEQLGXAJ-UHFFFAOYSA-N -1 1 321.376 4.221 20 0 DIADMM CC[C@@H](CN(CC)C(=O)c1cc(F)ccc1[O-])c1ccccc1 ZINC000436567051 338277527 /nfs/dbraw/zinc/27/75/27/338277527.db2.gz RQEQAYMTTOSAME-AWEZNQCLSA-N -1 1 315.388 4.187 20 0 DIADMM CCSCC[C@H](C)N(C)C(=O)c1ccc2ccccc2c1[O-] ZINC000436572997 338277886 /nfs/dbraw/zinc/27/78/86/338277886.db2.gz GNGLFAQKJNCALA-ZDUSSCGKSA-N -1 1 317.454 4.149 20 0 DIADMM O=C(c1ccc2ccccc2c1[O-])N1CC[C@H]1Cc1ccccc1 ZINC000436581112 338278186 /nfs/dbraw/zinc/27/81/86/338278186.db2.gz YRLNGQXCAGOUCF-KRWDZBQOSA-N -1 1 317.388 4.003 20 0 DIADMM Cc1ccc(NC(=O)c2ccc3ccccc3c2[O-])c(C)c1O ZINC000436583474 338278309 /nfs/dbraw/zinc/27/83/09/338278309.db2.gz NTMPTAZZWUNLAR-UHFFFAOYSA-N -1 1 307.349 4.120 20 0 DIADMM C[C@@H]1c2ccccc2CN1C(=O)c1ccc2ccccc2c1[O-] ZINC000436582418 338278401 /nfs/dbraw/zinc/27/84/01/338278401.db2.gz IBUBRNPEJNVRGS-CYBMUJFWSA-N -1 1 303.361 4.262 20 0 DIADMM O=C(c1ccc2ccccc2c1[O-])N1CCCC12CCCCC2 ZINC000436600732 338279330 /nfs/dbraw/zinc/27/93/30/338279330.db2.gz HTSCPYKEDDOSOC-UHFFFAOYSA-N -1 1 309.409 4.484 20 0 DIADMM O=C(c1cc2ccccc2cc1[O-])N1CCCC12CCCCC2 ZINC000436599999 338279367 /nfs/dbraw/zinc/27/93/67/338279367.db2.gz GFGHPHCELTVRIA-UHFFFAOYSA-N -1 1 309.409 4.484 20 0 DIADMM CCC[C@@H](CCc1ccccc1)NC(=O)c1ccc([O-])cc1F ZINC000436608132 338279761 /nfs/dbraw/zinc/27/97/61/338279761.db2.gz PEIKMVHOZDXTCR-HNNXBMFYSA-N -1 1 315.388 4.063 20 0 DIADMM O=C(c1cc2ccccc2cc1[O-])N(CC(F)F)CC1CCC1 ZINC000436661295 338282083 /nfs/dbraw/zinc/28/20/83/338282083.db2.gz CQUKCKCQGGJRAH-UHFFFAOYSA-N -1 1 319.351 4.053 20 0 DIADMM [O-]c1ccc(-c2nc(CSCc3ccccc3)no2)c(F)c1 ZINC000436686322 338282864 /nfs/dbraw/zinc/28/28/64/338282864.db2.gz DVAUIJSNKSCWCV-UHFFFAOYSA-N -1 1 316.357 4.015 20 0 DIADMM C[C@@H]1CN(C(=O)c2ccc3ccccc3c2[O-])[C@@H]2CCCC[C@@H]21 ZINC000436741155 338284933 /nfs/dbraw/zinc/28/49/33/338284933.db2.gz RVDKDZDHAZRQNY-DDUZABMNSA-N -1 1 309.409 4.196 20 0 DIADMM C[C@@H]1CCC[C@@H](C)N(C(=O)c2ccc(C(F)(F)F)cc2[O-])C1 ZINC000436751741 338285452 /nfs/dbraw/zinc/28/54/52/338285452.db2.gz NNHKPEDKTJEWAG-GHMZBOCLSA-N -1 1 315.335 4.062 20 0 DIADMM Cc1ccc([C@@H](C)N(C)C(=O)c2ccc(Cl)cc2[O-])cc1 ZINC000436753394 338285651 /nfs/dbraw/zinc/28/56/51/338285651.db2.gz DIBUJUWPXCRONV-GFCCVEGCSA-N -1 1 303.789 4.187 20 0 DIADMM CN(C(=O)c1ccc2ccccc2c1[O-])[C@H]1CCc2ccccc21 ZINC000436756094 338285751 /nfs/dbraw/zinc/28/57/51/338285751.db2.gz QCMPFDIAEZREDE-IBGZPJMESA-N -1 1 317.388 4.305 20 0 DIADMM O=C(c1cc(F)ccc1[O-])N1CCC[C@H]1c1ccc(Cl)cc1 ZINC000436760639 338286121 /nfs/dbraw/zinc/28/61/21/338286121.db2.gz RCEAYDAWHYXKKO-HNNXBMFYSA-N -1 1 319.763 4.162 20 0 DIADMM C[C@H]1CCC[C@@H](N(C)C(=O)c2ccc(C(F)(F)F)cc2[O-])C1 ZINC000436764683 338286352 /nfs/dbraw/zinc/28/63/52/338286352.db2.gz SMWCYMBGHOMXHO-CMPLNLGQSA-N -1 1 315.335 4.062 20 0 DIADMM O=C(Nc1cccc(-c2ccccc2)c1)c1ccc([O-])cc1F ZINC000436768201 338286539 /nfs/dbraw/zinc/28/65/39/338286539.db2.gz FIBUHWDCSPDEHE-UHFFFAOYSA-N -1 1 307.324 4.451 20 0 DIADMM CCN(C(=O)c1ccc(C(F)(F)F)cc1[O-])c1cccc(C)c1 ZINC000436793476 338287702 /nfs/dbraw/zinc/28/77/02/338287702.db2.gz RJSXRZQNUHBNHJ-UHFFFAOYSA-N -1 1 323.314 4.386 20 0 DIADMM CCOc1ccc(N(CC)C(=O)c2ccc(CC)cc2[O-])cc1 ZINC000436795849 338287837 /nfs/dbraw/zinc/28/78/37/338287837.db2.gz GKTBEBPQYRHTEX-UHFFFAOYSA-N -1 1 313.397 4.020 20 0 DIADMM CC(C)[C@H]1C[C@@H](NC(=O)c2ccc([O-])cc2F)c2ccccc21 ZINC000436805479 338288038 /nfs/dbraw/zinc/28/80/38/338288038.db2.gz DYCLYTWMYKSKIW-SJLPKXTDSA-N -1 1 313.372 4.146 20 0 DIADMM O=C(c1ccc(Cl)cc1[O-])N1CCCC2(CCCCC2)C1 ZINC000436864990 338290482 /nfs/dbraw/zinc/29/04/82/338290482.db2.gz QIEDBZOOELBKQY-UHFFFAOYSA-N -1 1 307.821 4.232 20 0 DIADMM C[C@H](Cc1ccccc1)c1nc(-c2ccc([O-])cc2Cl)no1 ZINC000436871427 338290838 /nfs/dbraw/zinc/29/08/38/338290838.db2.gz SPEFXUNCPVJDEO-LLVKDONJSA-N -1 1 314.772 4.442 20 0 DIADMM [O-]c1ccc(-c2noc(C(C3CCC3)C3CCC3)n2)cc1F ZINC000436874135 338291060 /nfs/dbraw/zinc/29/10/60/338291060.db2.gz PNQOMNXASOCXDB-UHFFFAOYSA-N -1 1 302.349 4.265 20 0 DIADMM [O-]c1ccc(-c2noc(/C=C\c3ccc(F)c(F)c3)n2)cc1F ZINC000436874446 338291078 /nfs/dbraw/zinc/29/10/78/338291078.db2.gz QNDNZEXUHRXPCQ-KXFIGUGUSA-N -1 1 318.254 4.030 20 0 DIADMM Cc1ccc([C@H]2C[C@H](C)CCN2C(=O)c2ccc([O-])cc2F)o1 ZINC000436877621 338291254 /nfs/dbraw/zinc/29/12/54/338291254.db2.gz BLDIFDXHENWAOZ-BDJLRTHQSA-N -1 1 317.360 4.046 20 0 DIADMM Cc1ccc([C@@H]2CCCCCN2C(=O)c2ccc([O-])cc2F)o1 ZINC000436880356 338291511 /nfs/dbraw/zinc/29/15/11/338291511.db2.gz NWLHJIBTZFSEHH-INIZCTEOSA-N -1 1 317.360 4.190 20 0 DIADMM COc1ccc(-c2nc(Cc3ccc(C(C)C)cc3)no2)c([O-])c1 ZINC000436893602 338292373 /nfs/dbraw/zinc/29/23/73/338292373.db2.gz OFJBVQVCVDHTNV-UHFFFAOYSA-N -1 1 324.380 4.165 20 0 DIADMM [O-]c1c(F)cc(/C=C\c2ncc(Br)s2)cc1F ZINC000436925014 338293642 /nfs/dbraw/zinc/29/36/42/338293642.db2.gz YTKYHMBOXVBYBP-UPHRSURJSA-N -1 1 318.142 4.060 20 0 DIADMM COc1ccc(-c2nc(-c3cc(Cl)ccc3C)no2)c([O-])c1 ZINC000436935944 338294461 /nfs/dbraw/zinc/29/44/61/338294461.db2.gz FELDMHQMWIKFNS-UHFFFAOYSA-N -1 1 316.744 4.080 20 0 DIADMM COc1ccc(-c2nc(-c3ccc4sccc4c3)no2)c([O-])c1 ZINC000436940362 338294759 /nfs/dbraw/zinc/29/47/59/338294759.db2.gz VXJYHLUBAYHFQM-UHFFFAOYSA-N -1 1 324.361 4.333 20 0 DIADMM COc1cc(-c2nc(-c3sccc3C)no2)cc(Cl)c1[O-] ZINC000436956603 338295907 /nfs/dbraw/zinc/29/59/07/338295907.db2.gz NSBGRNXYYJFLPY-UHFFFAOYSA-N -1 1 322.773 4.141 20 0 DIADMM CC(C)c1ccc(-c2nc(-c3ccc([O-])cc3Cl)no2)nc1 ZINC000436957516 338295917 /nfs/dbraw/zinc/29/59/17/338295917.db2.gz VXKDPIPBZYWGSH-UHFFFAOYSA-N -1 1 315.760 4.281 20 0 DIADMM CCC[C@H]1CCCCN1C(=O)c1ccc(C(F)(F)F)cc1[O-] ZINC000436989108 338296928 /nfs/dbraw/zinc/29/69/28/338296928.db2.gz NMMANQYZYZLDNS-LBPRGKRZSA-N -1 1 315.335 4.206 20 0 DIADMM O=C(Nc1ccc([O-])c(Cl)c1)C1(Cc2ccc(F)cc2)CC1 ZINC000438155244 338334429 /nfs/dbraw/zinc/33/44/29/338334429.db2.gz NBNVALFJXZSSFJ-UHFFFAOYSA-N -1 1 319.763 4.146 20 0 DIADMM O=C(Nc1ccsc1Cl)c1ccc(C(F)(F)F)cc1[O-] ZINC000438558743 338348140 /nfs/dbraw/zinc/34/81/40/338348140.db2.gz MANJACPHBPLIPI-UHFFFAOYSA-N -1 1 321.707 4.378 20 0 DIADMM O=C(c1cc2ccccc2cc1[O-])N1CCCC2(CCCC2)C1 ZINC000438688716 338351031 /nfs/dbraw/zinc/35/10/31/338351031.db2.gz AHAAGORTMGWWPE-UHFFFAOYSA-N -1 1 309.409 4.342 20 0 DIADMM O=C(Nc1ccc([O-])c(F)c1F)[C@@H]1CCC[C@H]1c1ccccc1 ZINC000456790074 338940922 /nfs/dbraw/zinc/94/09/22/338940922.db2.gz VJZYJIGMQMAUEL-QWHCGFSZSA-N -1 1 317.335 4.193 20 0 DIADMM C[C@H](CCCc1ccccc1)C(=O)Nc1ccc([O-])c(F)c1F ZINC000456790826 338941001 /nfs/dbraw/zinc/94/10/01/338941001.db2.gz WLDRDVWMPSGWKG-GFCCVEGCSA-N -1 1 319.351 4.268 20 0 DIADMM CC(C)Cc1ccc(CC(=O)Nc2ccc([O-])c(F)c2F)cc1 ZINC000456794452 338941066 /nfs/dbraw/zinc/94/10/66/338941066.db2.gz POJOATWKGUJDHK-UHFFFAOYSA-N -1 1 319.351 4.050 20 0 DIADMM CCOc1cc(CN(C)[C@H](C)c2ccco2)cc(Cl)c1O ZINC000459299837 339020083 /nfs/dbraw/zinc/02/00/83/339020083.db2.gz LJIAUNAPEHQHTA-LLVKDONJSA-N -1 1 309.793 4.230 20 0 DIADMM Cc1c(=O)[n-]c(S[C@H](C)c2cccnc2)nc1-c1ccccc1 ZINC000467210080 339228491 /nfs/dbraw/zinc/22/84/91/339228491.db2.gz BMEKYCRMJLSHQC-CYBMUJFWSA-N -1 1 323.421 4.406 20 0 DIADMM Cc1c2ccc(F)cc2sc1C(=O)Nc1ccc(F)cc1[O-] ZINC000501345050 340078843 /nfs/dbraw/zinc/07/88/43/340078843.db2.gz GPADFZQRZPJBLO-UHFFFAOYSA-N -1 1 319.332 4.446 20 0 DIADMM CN(Cc1nc2ccccc2s1)Cc1cccc([O-])c1Cl ZINC000507022640 340205543 /nfs/dbraw/zinc/20/55/43/340205543.db2.gz PFMGPLWEBDOHBL-UHFFFAOYSA-N -1 1 318.829 4.287 20 0 DIADMM C[C@H]1CN(Cc2cccc([O-])c2Cl)C[C@H](c2ccccc2)O1 ZINC000507784000 340231422 /nfs/dbraw/zinc/23/14/22/340231422.db2.gz HHTTZIOMMUZNHW-SUMWQHHRSA-N -1 1 317.816 4.008 20 0 DIADMM Oc1cccc(C[N@H+]2CC[C@@H](c3cccc(F)c3)C2)c1Cl ZINC000508251833 340241446 /nfs/dbraw/zinc/24/14/46/340241446.db2.gz YDPOLLCYUKLICN-CYBMUJFWSA-N -1 1 305.780 4.174 20 0 DIADMM CN(Cc1cc2ccccc2o1)Cc1cccc([O-])c1Cl ZINC000508776849 340252821 /nfs/dbraw/zinc/25/28/21/340252821.db2.gz AMMPVDMLZCYYQP-UHFFFAOYSA-N -1 1 301.773 4.424 20 0 DIADMM C[C@@H](C(=O)Nc1ccc([O-])c(Cl)c1)c1cccc(Cl)c1 ZINC000509153399 340262428 /nfs/dbraw/zinc/26/24/28/340262428.db2.gz GORAEXQXYIJHFO-SECBINFHSA-N -1 1 310.180 4.441 20 0 DIADMM C[C@@H](Sc1nc(C(F)(F)F)cc(=O)[n-]1)c1ccc(F)cc1 ZINC000524032583 340646216 /nfs/dbraw/zinc/64/62/16/340646216.db2.gz YLULUHPYZXNTHL-SSDOTTSWSA-N -1 1 318.295 4.193 20 0 DIADMM CC[C@@H](C)[C@@H](OC)C(=O)Nc1cc(Cl)c([O-])c2ccccc12 ZINC000529538389 340760756 /nfs/dbraw/zinc/76/07/56/340760756.db2.gz BQLGLKFTAKKQLF-QLJPJBMISA-N -1 1 321.804 4.198 20 0 DIADMM CC(C)(C)[C@H]1CCCN(C(=O)c2cc(Cl)ccc2[O-])CC1 ZINC000071202741 341025440 /nfs/dbraw/zinc/02/54/40/341025440.db2.gz OREWSIHFGMTYPJ-LBPRGKRZSA-N -1 1 309.837 4.334 20 0 DIADMM C[C@@H](CCC1CCCCC1)NC(=O)c1c(F)ccc([O-])c1F ZINC000564309098 341181139 /nfs/dbraw/zinc/18/11/39/341181139.db2.gz OMPGGTKHSUPZOK-NSHDSACASA-N -1 1 311.372 4.149 20 0 DIADMM C[C@@H](C(=O)Nc1ccc([O-])c(Cl)c1)c1c(F)cccc1F ZINC000134406317 341214822 /nfs/dbraw/zinc/21/48/22/341214822.db2.gz IJXSYTTZFOAUBC-MRVPVSSYSA-N -1 1 311.715 4.066 20 0 DIADMM O=C(Nc1ccc([O-])c(Cl)c1)c1cc2c(s1)CCCC2 ZINC000082192771 341317887 /nfs/dbraw/zinc/31/78/87/341317887.db2.gz HKFNFNKZOORYSJ-UHFFFAOYSA-N -1 1 307.802 4.238 20 0 DIADMM CCC[C@@H](C)C(=O)Nc1c([O-])cc(Br)cc1Cl ZINC000552196259 341377749 /nfs/dbraw/zinc/37/77/49/341377749.db2.gz RYFIGAKCZUDSBK-SSDOTTSWSA-N -1 1 320.614 4.183 20 0 DIADMM O=c1cc(C(F)F)nc(SCc2ccc(Cl)cc2F)[n-]1 ZINC000577027226 341878195 /nfs/dbraw/zinc/87/81/95/341878195.db2.gz GGPAUVAQGHKURH-UHFFFAOYSA-N -1 1 320.723 4.205 20 0 DIADMM Cc1ccc2c(Cc3nc(-c4ccc([O-])c(F)c4)no3)coc2c1 ZINC000577259626 341900729 /nfs/dbraw/zinc/90/07/29/341900729.db2.gz DKWBYXHHACUBPT-UHFFFAOYSA-N -1 1 324.311 4.227 20 0 DIADMM Cc1cnc([C@@H](NCc2cccc([O-])c2Cl)C2CC2)s1 ZINC000339281722 526133980 /nfs/dbraw/zinc/13/39/80/526133980.db2.gz JAYMVETZOIQRAO-AWEZNQCLSA-N -1 1 308.834 4.051 20 0 DIADMM C[C@@]1(F)CCC[N@@H+](Cc2c(Cl)cc(O)cc2Cl)CC1 ZINC001142105642 1047379843 /nfs/dbraw/zinc/37/98/43/1047379843.db2.gz IKTBBODFCNWQAA-CQSZACIVSA-N -1 1 306.208 4.413 20 0 DIADMM Cc1occc1Nc1cc(Br)cc(Cl)c1[O-] ZINC001211245108 1050526653 /nfs/dbraw/zinc/52/66/53/1050526653.db2.gz DXXKPKUNFWHDBZ-UHFFFAOYSA-N -1 1 302.555 4.453 20 0 DIADMM Cc1cccc2c1[C@H](C)C[C@@H]2CC(=O)Nc1c([O-])cccc1F ZINC000683114641 1035548104 /nfs/dbraw/zinc/54/81/04/1035548104.db2.gz LASVGHSVRUMPFV-CHWSQXEVSA-N -1 1 313.372 4.459 20 0 DIADMM CC[C@H]1c2ccccc2CN1C(=O)Cc1ccc([O-])c(Cl)c1 ZINC000890614163 1035835586 /nfs/dbraw/zinc/83/55/86/1035835586.db2.gz AKFYGVAINOVXPU-INIZCTEOSA-N -1 1 315.800 4.082 20 0 DIADMM CCCCN(C(=O)c1cncc([O-])c1)[C@H](CC)c1ccccc1 ZINC000339951984 1036090995 /nfs/dbraw/zinc/09/09/95/1036090995.db2.gz FHOAQHIRLVGSIQ-GOSISDBHSA-N -1 1 312.413 4.181 20 0 DIADMM Cc1nc(C2CCCC2)sc1C(=O)Nc1ccc(F)cc1[O-] ZINC000340332389 1036363822 /nfs/dbraw/zinc/36/38/22/1036363822.db2.gz TZXNVCFHRGWKRH-UHFFFAOYSA-N -1 1 320.389 4.206 20 0 DIADMM CCc1cnn2cc(Nc3cc(Cl)c([O-])c(Cl)c3)cnc12 ZINC001210928026 1037058812 /nfs/dbraw/zinc/05/88/12/1037058812.db2.gz XQFHVDVGULZXSD-UHFFFAOYSA-N -1 1 323.183 4.048 20 0 DIADMM O=C(Nc1c([O-])cccc1F)c1cc(C2CC2)nc2ccccc21 ZINC000089541255 1037086222 /nfs/dbraw/zinc/08/62/22/1037086222.db2.gz IKQQUNBTXDRGHU-UHFFFAOYSA-N -1 1 322.339 4.209 20 0 DIADMM Cc1ccc2oc([N-][C@@H](C[C@H]3CCCO3)C(F)(F)F)nc2c1 ZINC000656224567 1037147308 /nfs/dbraw/zinc/14/73/08/1037147308.db2.gz MJXNXGVCMCNTKC-MFKMUULPSA-N -1 1 314.307 4.048 20 0 DIADMM Cc1cnc(SCc2nc(C3CCCCC3)cs2)[n-]c1=O ZINC000580785145 1037296911 /nfs/dbraw/zinc/29/69/11/1037296911.db2.gz PRRKLPDFBBEXMN-UHFFFAOYSA-N -1 1 321.471 4.287 20 0 DIADMM O=C(Cc1cccc(Cl)c1Cl)Nc1c([O-])cccc1F ZINC000684057918 1037301667 /nfs/dbraw/zinc/30/16/67/1037301667.db2.gz RQXJWMGKCBTIQM-UHFFFAOYSA-N -1 1 314.143 4.019 20 0 DIADMM COC(=O)c1cc2cc(-c3cc(F)c([O-])cc3F)ccc2s1 ZINC001211340238 1037308416 /nfs/dbraw/zinc/30/84/16/1037308416.db2.gz UQGUYCGVQAIPPX-UHFFFAOYSA-N -1 1 320.316 4.339 20 0 DIADMM CC(C)(C)C(=O)Nc1cc(F)ccc1-c1cc(F)c([O-])cc1F ZINC001211353611 1037310242 /nfs/dbraw/zinc/31/02/42/1037310242.db2.gz YAHYOWMKOSFUTQ-UHFFFAOYSA-N -1 1 323.314 4.461 20 0 DIADMM COc1ccc(-c2cc(F)c([O-])cc2F)c2ccc(C)nc12 ZINC001211353443 1037312789 /nfs/dbraw/zinc/31/27/89/1037312789.db2.gz WIPGUQGYPMYBFY-UHFFFAOYSA-N -1 1 301.292 4.203 20 0 DIADMM [O-]c1cc(F)c(Nc2ccccc2Br)cc1F ZINC001215571331 1037383208 /nfs/dbraw/zinc/38/32/08/1037383208.db2.gz ABDUVPRYVJVFJC-UHFFFAOYSA-N -1 1 300.102 4.177 20 0 DIADMM CCc1ocnc1C(=O)Nc1cc(Cl)c([O-])c2ccccc12 ZINC001167440947 1037391513 /nfs/dbraw/zinc/39/15/13/1037391513.db2.gz YJPQNMRDFFUNBG-UHFFFAOYSA-N -1 1 316.744 4.002 20 0 DIADMM CC1(C(=O)Nc2cc(Cl)c([O-])c3ccccc23)CC=CC1 ZINC001167445141 1037423950 /nfs/dbraw/zinc/42/39/50/1037423950.db2.gz SAAKHBRKZYNNOB-UHFFFAOYSA-N -1 1 301.773 4.494 20 0 DIADMM O=C(Nc1ccc([O-])c(F)c1F)c1cc(C2CC2)[nH]c1C1CC1 ZINC000627680427 1037443838 /nfs/dbraw/zinc/44/38/38/1037443838.db2.gz IGAZIVFZVDHRGH-UHFFFAOYSA-N -1 1 318.323 4.006 20 0 DIADMM Cc1noc(-c2ccccc2)c1[N-]C(=O)c1nc(C2CC2)oc1C ZINC000581682833 1037904032 /nfs/dbraw/zinc/90/40/32/1037904032.db2.gz NAJCBOJUCPLCQU-UHFFFAOYSA-N -1 1 323.352 4.076 20 0 DIADMM CC(C)(C)c1csc([N-]c2cnc(Br)s2)n1 ZINC001216265677 1038461350 /nfs/dbraw/zinc/46/13/50/1038461350.db2.gz WTWZRCPXRAKILO-UHFFFAOYSA-N -1 1 318.265 4.403 20 0 DIADMM Cc1ccc([C@@H]2CCCN2[C@@H](C)c2cc(C(=O)[O-])c(C)o2)o1 ZINC000515489338 1038608849 /nfs/dbraw/zinc/60/88/49/1038608849.db2.gz BSTGUXAZWBPHLP-FZMZJTMJSA-N -1 1 303.358 4.086 20 0 DIADMM O=C(c1c(F)ccc([O-])c1F)N1CCCC2(C1)CCCCCC2 ZINC000582388034 1038648005 /nfs/dbraw/zinc/64/80/05/1038648005.db2.gz WWADYSMODOOJBF-UHFFFAOYSA-N -1 1 323.383 4.247 20 0 DIADMM C[C@@H](c1ccccc1)N(C)C(=O)c1ccc(C(F)(F)F)c([O-])c1 ZINC000684870493 1038666355 /nfs/dbraw/zinc/66/63/55/1038666355.db2.gz DZJIEOOYGZYOIU-NSHDSACASA-N -1 1 323.314 4.244 20 0 DIADMM O=C(Cc1ccc([O-])c(Cl)c1)N1CCCC[C@@H]1CC1CCC1 ZINC001167603189 1038767836 /nfs/dbraw/zinc/76/78/36/1038767836.db2.gz NJZSWCGDOZSIKA-OAHLLOKOSA-N -1 1 321.848 4.159 20 0 DIADMM O=C(Nc1c([O-])cccc1F)c1cc(Cl)ccc1Cl ZINC000608366419 1038829105 /nfs/dbraw/zinc/82/91/05/1038829105.db2.gz UUMYDSAGSNKMEN-UHFFFAOYSA-N -1 1 300.116 4.090 20 0 DIADMM O=c1nc(COC2CCCC2)[n-]c2sc3ccccc3c21 ZINC000608386167 1038837756 /nfs/dbraw/zinc/83/77/56/1038837756.db2.gz PMTVDZACMHMUBW-UHFFFAOYSA-N -1 1 300.383 4.009 20 0 DIADMM COc1cc(/C=C/C(=O)c2ccc([O-])cc2)ccc1SC ZINC000063866697 1038892861 /nfs/dbraw/zinc/89/28/61/1038892861.db2.gz LCRCREXGASBVQD-YCRREMRBSA-N -1 1 300.379 4.019 20 0 DIADMM O=C(c1cc(Cl)ccc1[O-])N1CC2(CCC2)[C@H]1c1ccco1 ZINC000456556923 1039059789 /nfs/dbraw/zinc/05/97/89/1039059789.db2.gz HSYPYPQCZKCJOJ-OAHLLOKOSA-N -1 1 317.772 4.006 20 0 DIADMM Cc1ccc(S[C@@H](C)C(=O)Nc2ccc([O-])c(Cl)c2)cc1 ZINC000541887587 1039755350 /nfs/dbraw/zinc/75/53/50/1039755350.db2.gz NWDBWPTVBURZSV-NSHDSACASA-N -1 1 321.829 4.473 20 0 DIADMM O=C([O-])CC[C@@H]1CCCCN1Cc1cccc(Cl)c1Cl ZINC000086755030 1040038781 /nfs/dbraw/zinc/03/87/81/1040038781.db2.gz XHVFDPXAGSTBLN-LBPRGKRZSA-N -1 1 316.228 4.213 20 0 DIADMM CSc1ccccc1[N-]C(=O)c1c(F)c(F)cc(F)c1F ZINC000175592873 1040041780 /nfs/dbraw/zinc/04/17/80/1040041780.db2.gz NKSHQXKWNOFIRD-UHFFFAOYSA-N -1 1 315.291 4.217 20 0 DIADMM O=C([N-]c1ncsc1C1CC1)c1nc(Cl)sc1Cl ZINC000914119941 1040083845 /nfs/dbraw/zinc/08/38/45/1040083845.db2.gz RXYFIOCLJACHMK-UHFFFAOYSA-N -1 1 320.226 4.036 20 0 DIADMM CSc1ccc(CSc2nc(C(F)F)cc(=O)[n-]2)cc1 ZINC000685575151 1040143030 /nfs/dbraw/zinc/14/30/30/1040143030.db2.gz NGERLWFPHDZSGR-UHFFFAOYSA-N -1 1 314.382 4.134 20 0 DIADMM CCCCO[C@@H](C)C(=O)Nc1cc(Cl)c([O-])c2ccccc12 ZINC000628233394 1040243128 /nfs/dbraw/zinc/24/31/28/1040243128.db2.gz ZKURGNLYTIKCPV-NSHDSACASA-N -1 1 321.804 4.343 20 0 DIADMM C[C@H](c1ccc(Cl)c(Cl)c1)N1CC[C@@H](C)[C@@H](C(=O)[O-])C1 ZINC000647367785 1040254177 /nfs/dbraw/zinc/25/41/77/1040254177.db2.gz OADCVEXITSTLAR-FOGDFJRCSA-N -1 1 316.228 4.097 20 0 DIADMM C[C@@H](Cc1ccccc1F)C(=O)Nc1ccc([O-])c(Cl)c1 ZINC000150718781 1040529972 /nfs/dbraw/zinc/52/99/72/1040529972.db2.gz IROWCNQJWMJENR-JTQLQIEISA-N -1 1 307.752 4.002 20 0 DIADMM C[C@H]1CCC[N@@H+](Cc2sc3ccccc3c2Cl)[C@H]1C(=O)[O-] ZINC000300293329 1040988398 /nfs/dbraw/zinc/98/83/98/1040988398.db2.gz GOUQRPRTUXRJAW-ZUZCIYMTSA-N -1 1 323.845 4.240 20 0 DIADMM C[C@H]1CCCN(Cc2sc3ccccc3c2Cl)[C@H]1C(=O)[O-] ZINC000300293329 1040988418 /nfs/dbraw/zinc/98/84/18/1040988418.db2.gz GOUQRPRTUXRJAW-ZUZCIYMTSA-N -1 1 323.845 4.240 20 0 DIADMM CCOc1cc(-c2noc([C@@H](F)C(C)C)n2)cc(Cl)c1[O-] ZINC000809466227 1041165204 /nfs/dbraw/zinc/16/52/04/1041165204.db2.gz LBESLOFAOSCAPT-NSHDSACASA-N -1 1 314.744 4.161 20 0 DIADMM O=c1cc(C(F)F)nc(SCCSc2ccccc2)[n-]1 ZINC000809986148 1041288807 /nfs/dbraw/zinc/28/88/07/1041288807.db2.gz AOVNQWWAXNXOJN-UHFFFAOYSA-N -1 1 314.382 4.004 20 0 DIADMM Cc1cc(Cl)ccc1CSc1nc(C(F)F)cc(=O)[n-]1 ZINC000809986546 1041289211 /nfs/dbraw/zinc/28/92/11/1041289211.db2.gz JSRIGFQAKQYLLO-UHFFFAOYSA-N -1 1 316.760 4.374 20 0 DIADMM CC(=O)c1cccc(OC(=O)c2cc3cc(Cl)sc3[n-]2)c1 ZINC000810525264 1041399078 /nfs/dbraw/zinc/39/90/78/1041399078.db2.gz ZEIADTHBMLMYGS-UHFFFAOYSA-N -1 1 319.769 4.305 20 0 DIADMM CCc1nc(SCc2cc(Cl)ccc2OC)[n-]c(=O)c1C ZINC000565242178 1041468055 /nfs/dbraw/zinc/46/80/55/1041468055.db2.gz LYMJIRLSWBZLJJ-UHFFFAOYSA-N -1 1 324.833 4.007 20 0 DIADMM O=C(Nc1cc([O-])c(F)cc1F)[C@@H]1CC[C@H]2CCCC[C@H]2C1 ZINC001625894408 1041513505 /nfs/dbraw/zinc/51/35/05/1041513505.db2.gz WXCLGVLMMQSTED-GRYCIOLGSA-N -1 1 309.356 4.215 20 0 DIADMM COc1cc(-c2cc(F)c([O-])cc2F)ccc1OC(F)(F)F ZINC001222086835 1041702959 /nfs/dbraw/zinc/70/29/59/1041702959.db2.gz RJSBEVMSWPLLQE-UHFFFAOYSA-N -1 1 320.213 4.245 20 0 DIADMM [O-]c1cc(F)c(Cl)cc1-c1ccccc1OC[C@@H]1CCOC1 ZINC000623048587 1041735959 /nfs/dbraw/zinc/73/59/59/1041735959.db2.gz DYKNPRIVWCROFT-LLVKDONJSA-N -1 1 322.763 4.267 20 0 DIADMM O=C(CC1CCC(F)(F)CC1)Nc1ccc([O-])c(Cl)c1 ZINC000626228149 1041829952 /nfs/dbraw/zinc/82/99/52/1041829952.db2.gz ZUEKMBVVACUYRM-UHFFFAOYSA-N -1 1 303.736 4.200 20 0 DIADMM COc1ccc(NCc2cccc([O-])c2Cl)c2cccnc12 ZINC000815130698 1041918309 /nfs/dbraw/zinc/91/83/09/1041918309.db2.gz FUJBAAZWWGTONA-UHFFFAOYSA-N -1 1 314.772 4.215 20 0 DIADMM Cc1cccc(OCCCC(=O)Nc2ccc([O-])c(Cl)c2)c1 ZINC000109014290 1041939488 /nfs/dbraw/zinc/93/94/88/1041939488.db2.gz NJHMXYNKFKTJJC-UHFFFAOYSA-N -1 1 319.788 4.152 20 0 DIADMM CCc1ccccc1[N-]S(=O)(=O)c1ccc(C)c(Cl)c1 ZINC000048653434 1042019704 /nfs/dbraw/zinc/01/97/04/1042019704.db2.gz APDJJXODPOEGTG-UHFFFAOYSA-N -1 1 309.818 4.012 20 0 DIADMM CC1(C)CCCN([C@H](C(=O)[O-])c2ccc(Cl)cc2Cl)C1 ZINC000652397396 1042035953 /nfs/dbraw/zinc/03/59/53/1042035953.db2.gz RTBMVMKPIGNSGU-ZDUSSCGKSA-N -1 1 316.228 4.241 20 0 DIADMM CSc1ccc([O-])c(C(=O)Nc2cccc(Cl)c2C)c1 ZINC001135565946 1042051565 /nfs/dbraw/zinc/05/15/65/1042051565.db2.gz KQRRHYZHRIMNPN-UHFFFAOYSA-N -1 1 307.802 4.328 20 0 DIADMM C/C=C(/CC)C(=O)Nc1c([O-])cc(Br)cc1Cl ZINC000816590501 1042066388 /nfs/dbraw/zinc/06/63/88/1042066388.db2.gz CBPITCCVHZEBQQ-CLTKARDFSA-N -1 1 318.598 4.103 20 0 DIADMM [O-]c1cccc(CN2CCC[C@@H](O)c3cc(F)ccc32)c1Cl ZINC000816589994 1042067894 /nfs/dbraw/zinc/06/78/94/1042067894.db2.gz OPBYZFIVRQSYFV-OAHLLOKOSA-N -1 1 321.779 4.019 20 0 DIADMM CC(C)[C@@H](NC(=O)c1ccc(Cl)cc1[O-])c1ccccc1 ZINC001135978434 1042122242 /nfs/dbraw/zinc/12/22/42/1042122242.db2.gz OVTDJRQOWCYSPO-MRXNPFEDSA-N -1 1 303.789 4.173 20 0 DIADMM Cc1ccc2c(c1)CCCN2C(=O)c1ccc(C(C)C)cc1[O-] ZINC001136051244 1042128299 /nfs/dbraw/zinc/12/82/99/1042128299.db2.gz WAUUGJRTYRABLX-UHFFFAOYSA-N -1 1 309.409 4.417 20 0 DIADMM CC(C)Cc1cccc([C@H](C)C(=O)[N-]OCc2ccccc2)c1 ZINC001136106476 1042139244 /nfs/dbraw/zinc/13/92/44/1042139244.db2.gz LCMHLGJQSBXZRB-INIZCTEOSA-N -1 1 311.425 4.237 20 0 DIADMM COCOc1ccc(-c2c(F)ccc([O-])c2Cl)c(C)c1C ZINC001245831032 1042139926 /nfs/dbraw/zinc/13/99/26/1042139926.db2.gz AAAFGUXMMZDABO-UHFFFAOYSA-N -1 1 310.752 4.451 20 0 DIADMM CCc1cccc(C)c1NC(=O)c1ccc2ccc(O)cc2c1[O-] ZINC001136344419 1042219118 /nfs/dbraw/zinc/21/91/18/1042219118.db2.gz FXZHHGYHPMTWQW-UHFFFAOYSA-N -1 1 321.376 4.374 20 0 DIADMM Cc1cccc([C@H](NC(=O)c2ccc(F)c([O-])c2)C(C)(C)C)c1 ZINC001136356326 1042222868 /nfs/dbraw/zinc/22/28/68/1042222868.db2.gz UXWOWVDGDMVNJK-KRWDZBQOSA-N -1 1 315.388 4.357 20 0 DIADMM CCc1ccc(Cl)c(CC)c1[N-]S(=O)(=O)c1ccccc1 ZINC000007378944 1042249026 /nfs/dbraw/zinc/24/90/26/1042249026.db2.gz VZQJYBSEXJHRMQ-UHFFFAOYSA-N -1 1 323.845 4.266 20 0 DIADMM Cc1oc(C(C)(C)C)cc1C(=O)Nc1ccc([O-])c(F)c1F ZINC000821980238 1042270798 /nfs/dbraw/zinc/27/07/98/1042270798.db2.gz LTRLOXNDVOLXHI-UHFFFAOYSA-N -1 1 309.312 4.122 20 0 DIADMM CCCCC[C@H](NC(=O)c1ncc(C)cc1[O-])c1ccccc1 ZINC001136597721 1042291967 /nfs/dbraw/zinc/29/19/67/1042291967.db2.gz GUUBIAMHBVGPNO-INIZCTEOSA-N -1 1 312.413 4.147 20 0 DIADMM CCCCC[C@@H](NC(=O)c1ncc(C)cc1[O-])c1ccccc1 ZINC001136597722 1042292023 /nfs/dbraw/zinc/29/20/23/1042292023.db2.gz GUUBIAMHBVGPNO-MRXNPFEDSA-N -1 1 312.413 4.147 20 0 DIADMM CCCCN(C(=O)c1ccc(C(F)(F)F)c([O-])c1)[C@H](C)CC ZINC001136636086 1042303146 /nfs/dbraw/zinc/30/31/46/1042303146.db2.gz LIVJGWKCAJAGKQ-LLVKDONJSA-N -1 1 317.351 4.452 20 0 DIADMM C[C@H](c1cc(Cl)ccc1Cl)N1CC[C@@H](C(=O)[O-])[C@H](C)C1 ZINC000312830674 1042363629 /nfs/dbraw/zinc/36/36/29/1042363629.db2.gz JSIQEWIXPKYLQV-CKYFFXLPSA-N -1 1 316.228 4.097 20 0 DIADMM C[C@@H](c1cc(Cl)ccc1Cl)N1CC[C@@H](C(=O)[O-])[C@H](C)C1 ZINC000312830679 1042363948 /nfs/dbraw/zinc/36/39/48/1042363948.db2.gz JSIQEWIXPKYLQV-JFGNBEQYSA-N -1 1 316.228 4.097 20 0 DIADMM Cc1cc(-c2nc3cc(C(F)(F)F)ccc3c(=O)[n-]2)ccc1F ZINC000614116833 1042412137 /nfs/dbraw/zinc/41/21/37/1042412137.db2.gz BFYJMPMJJJJPJG-UHFFFAOYSA-N -1 1 322.261 4.056 20 0 DIADMM O=c1oc2cc([O-])ccc2cc1Nc1ccc(F)c(Cl)c1F ZINC001213203119 1042427829 /nfs/dbraw/zinc/42/78/29/1042427829.db2.gz HIUGANKJJQWCES-UHFFFAOYSA-N -1 1 323.682 4.174 20 0 DIADMM [O-]c1cccc(CN[C@H](c2ccccc2)c2ccccn2)c1Cl ZINC000645143644 1042438619 /nfs/dbraw/zinc/43/86/19/1042438619.db2.gz LLIROHVRHNWGFU-LJQANCHMSA-N -1 1 324.811 4.320 20 0 DIADMM C[C@H]1CCC[C@H](C)N(C(=O)c2ccc(C(F)(F)F)cc2[O-])C1 ZINC000436751743 1042843047 /nfs/dbraw/zinc/84/30/47/1042843047.db2.gz NNHKPEDKTJEWAG-QWRGUYRKSA-N -1 1 315.335 4.062 20 0 DIADMM CCCC[C@@H](C(=O)[O-])N1CCC[C@H]1c1nc2ccccc2s1 ZINC000516976006 1042861638 /nfs/dbraw/zinc/86/16/38/1042861638.db2.gz REJNDUPWRTXULG-KBPBESRZSA-N -1 1 318.442 4.077 20 0 DIADMM CSc1ccc([O-])c(-c2nc([C@@H]3CCCCS3)no2)c1 ZINC000664822741 1042963905 /nfs/dbraw/zinc/96/39/05/1042963905.db2.gz ZLFDGHLLXBZTSF-LBPRGKRZSA-N -1 1 308.428 4.122 20 0 DIADMM COc1ccccc1[C@@H]1CCCN1Cc1cc(F)c([O-])c(F)c1 ZINC000093008507 1042973590 /nfs/dbraw/zinc/97/35/90/1042973590.db2.gz VSJPZWOGXFBNST-INIZCTEOSA-N -1 1 319.351 4.016 20 0 DIADMM C[C@H](C(=O)[O-])[C@@H](NCc1ccc(Cl)cc1F)c1ccccc1 ZINC000426747154 1042979238 /nfs/dbraw/zinc/97/92/38/1042979238.db2.gz NGIWESWMMRYITD-MEDUHNTESA-N -1 1 321.779 4.031 20 0 DIADMM Cc1cc([C@@H](C)N(C)Cc2cc3ccccc3o2)oc1C(=O)[O-] ZINC000520241568 1043027011 /nfs/dbraw/zinc/02/70/11/1043027011.db2.gz AHTCPDVKLXNXGP-GFCCVEGCSA-N -1 1 313.353 4.225 20 0 DIADMM COc1ccc2occ(C(=O)Nc3ccc([O-])c(Cl)c3)c2c1 ZINC000442657172 1043402556 /nfs/dbraw/zinc/40/25/56/1043402556.db2.gz VLABKIXSCSLKDC-UHFFFAOYSA-N -1 1 317.728 4.053 20 0 DIADMM COc1cc(C(=O)NCCCCC(C)(C)C)cc(Cl)c1[O-] ZINC000442963165 1043461834 /nfs/dbraw/zinc/46/18/34/1043461834.db2.gz LKOUHVVJWVIIGF-UHFFFAOYSA-N -1 1 313.825 4.000 20 0 DIADMM COc1cc(C(=O)NCCC2=CCCCCC2)cc(Cl)c1[O-] ZINC000443123673 1043495178 /nfs/dbraw/zinc/49/51/78/1043495178.db2.gz NERGVQHNGCGTMB-UHFFFAOYSA-N -1 1 323.820 4.065 20 0 DIADMM CCOc1cc(-c2nc([C@@H](C)C3CC3)no2)cc(Cl)c1[O-] ZINC000443218678 1043515671 /nfs/dbraw/zinc/51/56/71/1043515671.db2.gz CEPKTHMTRZLCLX-QMMMGPOBSA-N -1 1 308.765 4.008 20 0 DIADMM Cc1cc(NC(=O)Nc2ccc([O-])c(Cl)c2)cnc1Cl ZINC000192234626 1043524118 /nfs/dbraw/zinc/52/41/18/1043524118.db2.gz HJGXRELORWGZDH-UHFFFAOYSA-N -1 1 312.156 4.046 20 0 DIADMM O=C1[N-]C(=O)C(=Cc2ccc(Sc3ccccc3)cc2)S1 ZINC000874927542 1043606282 /nfs/dbraw/zinc/60/62/82/1043606282.db2.gz DLLRNLGVNJVPJS-UVTDQMKNSA-N -1 1 313.403 4.162 20 0 DIADMM Oc1ccc(-c2nc3ccc(Cl)cc3[nH]2)cc1Br ZINC000261367413 1043756105 /nfs/dbraw/zinc/75/61/05/1043756105.db2.gz RJPJBPSOXDNUTN-UHFFFAOYSA-N -1 1 323.577 4.351 20 0 DIADMM [O-]c1ccc(-c2nc3cc(Cl)ccc3[nH]2)cc1Br ZINC000261367413 1043756118 /nfs/dbraw/zinc/75/61/18/1043756118.db2.gz RJPJBPSOXDNUTN-UHFFFAOYSA-N -1 1 323.577 4.351 20 0 DIADMM CCOc1cc(C(=O)Nc2cc(C)ccc2F)cc(Cl)c1[O-] ZINC000178124132 1043923307 /nfs/dbraw/zinc/92/33/07/1043923307.db2.gz DFSWKSOZEPICFC-UHFFFAOYSA-N -1 1 323.751 4.144 20 0 DIADMM Cc1ccc(CN(C)C(=O)c2ccc3ccccc3c2[O-])s1 ZINC000102735975 1043931452 /nfs/dbraw/zinc/93/14/52/1043931452.db2.gz FKLWXYMWGNFBRY-UHFFFAOYSA-N -1 1 311.406 4.188 20 0 DIADMM CCCc1nc(C)c(-c2nc(-c3ccc([O-])cc3Cl)no2)o1 ZINC000291913655 1044115960 /nfs/dbraw/zinc/11/59/60/1044115960.db2.gz NCNRHUWHWFZGCE-UHFFFAOYSA-N -1 1 319.748 4.012 20 0 DIADMM O=C(Nc1ccc([O-])c(Cl)c1)c1cccc(Cl)c1F ZINC000130646876 1044208806 /nfs/dbraw/zinc/20/88/06/1044208806.db2.gz PDUGGVWPZOGJFL-UHFFFAOYSA-N -1 1 300.116 4.090 20 0 DIADMM CC(C)(C)c1csc(CNCc2cccc([O-])c2Cl)n1 ZINC000293511841 1044290622 /nfs/dbraw/zinc/29/06/22/1044290622.db2.gz IBJXNSGBHHOVKX-UHFFFAOYSA-N -1 1 310.850 4.089 20 0 DIADMM [O-]c1cccc(CN[C@H]2c3ccccc3CC[C@H]2F)c1Cl ZINC000883381199 1044293169 /nfs/dbraw/zinc/29/31/69/1044293169.db2.gz IPJGYRKGPAASOO-PBHICJAKSA-N -1 1 305.780 4.161 20 0 DIADMM Cc1c2ccccc2nc(CN(C)[C@H](C)c2ccco2)c1C(=O)[O-] ZINC000565103019 1044415092 /nfs/dbraw/zinc/41/50/92/1044415092.db2.gz LGVANKHEWXWQPV-CYBMUJFWSA-N -1 1 324.380 4.027 20 0 DIADMM CC[C@H](C)C[C@@H](C)Nc1ccc(-c2nc(C)c(C)c(=O)[n-]2)cn1 ZINC000566389025 1044487095 /nfs/dbraw/zinc/48/70/95/1044487095.db2.gz ZYVITHWIQCJKLS-NWDGAFQWSA-N -1 1 314.433 4.098 20 0 DIADMM CCc1nc(SCc2c(Cl)cccc2OC)[n-]c(=O)c1C ZINC000566498617 1044493642 /nfs/dbraw/zinc/49/36/42/1044493642.db2.gz DQNVIODLQMAPRL-UHFFFAOYSA-N -1 1 324.833 4.007 20 0 DIADMM Cc1nc(C(C)C)sc1[C@H](C)N(C)Cc1ccoc1C(=O)[O-] ZINC000566625684 1044505223 /nfs/dbraw/zinc/50/52/23/1044505223.db2.gz YAECSVHZMBBTFO-NSHDSACASA-N -1 1 322.430 4.059 20 0 DIADMM O=C(Nc1cc(F)c([O-])cc1Cl)c1conc1C1CCCC1 ZINC000885680082 1044585097 /nfs/dbraw/zinc/58/50/97/1044585097.db2.gz LKGLZGUAIMZTMM-UHFFFAOYSA-N -1 1 324.739 4.083 20 0 DIADMM O=C(Nc1cccc2ccsc21)c1c(F)ccc([O-])c1F ZINC000568799693 1044650558 /nfs/dbraw/zinc/65/05/58/1044650558.db2.gz BYOHMIADNHYJSZ-UHFFFAOYSA-N -1 1 305.305 4.137 20 0 DIADMM Cc1nc(C)c([C@H](C)[N@@H+](C)Cc2cc(C(=O)[O-])sc2C)s1 ZINC000568990901 1044665086 /nfs/dbraw/zinc/66/50/86/1044665086.db2.gz NSGRQQJDAXAWDO-VIFPVBQESA-N -1 1 324.471 4.021 20 0 DIADMM Cc1nc(C)c([C@H](C)N(C)Cc2cc(C(=O)[O-])sc2C)s1 ZINC000568990901 1044665092 /nfs/dbraw/zinc/66/50/92/1044665092.db2.gz NSGRQQJDAXAWDO-VIFPVBQESA-N -1 1 324.471 4.021 20 0 DIADMM CCC[C@H](C)c1nc(-c2cc(Cl)c([O-])c(OCC)c2)no1 ZINC000445412622 1044711879 /nfs/dbraw/zinc/71/18/79/1044711879.db2.gz OAQMUZGWUIHEQM-VIFPVBQESA-N -1 1 310.781 4.398 20 0 DIADMM CCOc1cc(-c2noc([C@@H]3C[C@@]3(C)CC)n2)cc(Cl)c1[O-] ZINC000445408880 1044714380 /nfs/dbraw/zinc/71/43/80/1044714380.db2.gz OGBJORJUYKYBCV-MGPLVRAMSA-N -1 1 322.792 4.398 20 0 DIADMM CCOc1cc(-c2noc([C@H]3C[C@]3(C)CC)n2)cc(Cl)c1[O-] ZINC000445408879 1044714816 /nfs/dbraw/zinc/71/48/16/1044714816.db2.gz OGBJORJUYKYBCV-HWPZZCPQSA-N -1 1 322.792 4.398 20 0 DIADMM CCOc1cc(-c2noc(-c3ccoc3C)n2)cc(Cl)c1[O-] ZINC000445428011 1044717571 /nfs/dbraw/zinc/71/75/71/1044717571.db2.gz TXROVRVRGABILX-UHFFFAOYSA-N -1 1 320.732 4.063 20 0 DIADMM Cc1ccc(/C=C\c2nc(-c3ccc([O-])cc3Cl)no2)o1 ZINC000445443573 1044722905 /nfs/dbraw/zinc/72/29/05/1044722905.db2.gz GUBYWHNPXWNLOM-ALCCZGGFSA-N -1 1 302.717 4.167 20 0 DIADMM C[C@H](Cc1cccc(F)c1)c1nc(-c2ccc([O-])c(F)c2)no1 ZINC000445479344 1044729003 /nfs/dbraw/zinc/72/90/03/1044729003.db2.gz VPNGDXMPVNNGCO-SNVBAGLBSA-N -1 1 316.307 4.067 20 0 DIADMM [O-]c1ccc(-c2noc([C@H](c3ccccc3)C3CC3)n2)cc1F ZINC000445484509 1044731958 /nfs/dbraw/zinc/73/19/58/1044731958.db2.gz ZOYZLQWYWFBCAD-MRXNPFEDSA-N -1 1 310.328 4.123 20 0 DIADMM O=c1nc(-c2cscn2)[n-]c2scc(-c3ccccc3)c21 ZINC000337662225 1044937222 /nfs/dbraw/zinc/93/72/22/1044937222.db2.gz MKBKOPWIEXYJTN-UHFFFAOYSA-N -1 1 311.391 4.187 20 0 DIADMM O=C(Nc1ccc([O-])c(Cl)c1)c1ccsc1C(F)F ZINC001295291780 1044990052 /nfs/dbraw/zinc/99/00/52/1044990052.db2.gz AQONEEFMRFZFKD-UHFFFAOYSA-N -1 1 303.717 4.297 20 0 DIADMM Cc1c(=O)[n-]c(S[C@H]2CC[C@@H](C)C2)nc1-c1ccccc1 ZINC000575198443 1044991065 /nfs/dbraw/zinc/99/10/65/1044991065.db2.gz JLNCVYMQYAMKRU-RISCZKNCSA-N -1 1 300.427 4.438 20 0 DIADMM O=c1cc(C(F)F)nc(SCc2cccc(F)c2Cl)[n-]1 ZINC000579449234 1045316332 /nfs/dbraw/zinc/31/63/32/1045316332.db2.gz CKFGBBZKHXTCFN-UHFFFAOYSA-N -1 1 320.723 4.205 20 0 DIADMM COC1(CC(=O)Nc2cc(Cl)c([O-])c3ccccc23)CCC1 ZINC000529538590 1045494744 /nfs/dbraw/zinc/49/47/44/1045494744.db2.gz GBWQVCOLMKOCRO-UHFFFAOYSA-N -1 1 319.788 4.097 20 0 DIADMM C/C(=C\C(=O)Nc1c([O-])cccc1F)c1cccc(Cl)c1 ZINC000750240948 1045516492 /nfs/dbraw/zinc/51/64/92/1045516492.db2.gz AQBQSWLBQYZKJX-CSKARUKUSA-N -1 1 305.736 4.227 20 0 DIADMM CC(C)(C)O[C@@H](C(=O)Nc1cccc(F)c1[O-])c1ccccc1 ZINC000530004128 1045578471 /nfs/dbraw/zinc/57/84/71/1045578471.db2.gz BKUAPAYISTUQKY-MRXNPFEDSA-N -1 1 317.360 4.026 20 0 DIADMM C[C@@H]1C[C@@H](C(=O)[O-])C[C@H](C)N1Cc1ccc(Cl)c(Cl)c1 ZINC000530175054 1045615008 /nfs/dbraw/zinc/61/50/08/1045615008.db2.gz CNDHZTOGVXEJKW-PEGIJTEDSA-N -1 1 316.228 4.067 20 0 DIADMM C[C@@H]1C[C@@H](C(=O)[O-])C[C@H](C)N1Cc1cc(Cl)ccc1Cl ZINC000530174245 1045617323 /nfs/dbraw/zinc/61/73/23/1045617323.db2.gz JEXIZSGYJYOHPI-JGPRNRPPSA-N -1 1 316.228 4.067 20 0 DIADMM Cc1c(=O)[n-]c(SCCSC(C)C)nc1-c1ccccc1 ZINC000800837274 1045655438 /nfs/dbraw/zinc/65/54/38/1045655438.db2.gz SKFQBNLDVCALQI-UHFFFAOYSA-N -1 1 320.483 4.391 20 0 DIADMM CCCCc1ccc(N(C)C(=O)c2ccc(OC)cc2[O-])cc1 ZINC000752372267 1045676462 /nfs/dbraw/zinc/67/64/62/1045676462.db2.gz IKYPCTVKNCUDON-UHFFFAOYSA-N -1 1 313.397 4.020 20 0 DIADMM [O-]c1ccc(Cl)c(F)c1CNc1cccc(-c2cnco2)c1 ZINC000191393674 1045695320 /nfs/dbraw/zinc/69/53/20/1045695320.db2.gz QZJVSQGDTOCMDJ-UHFFFAOYSA-N -1 1 318.735 4.452 20 0 DIADMM CCc1c(C)sc2nc(-c3coc(C4CCC4)n3)[n-]c(=O)c12 ZINC000630384749 1045755456 /nfs/dbraw/zinc/75/54/56/1045755456.db2.gz GYJPROVXUKMTPQ-UHFFFAOYSA-N -1 1 315.398 4.190 20 0 DIADMM O=C(Cc1ccc([O-])c(Cl)c1)N1CCC[C@@H]1c1ccsc1 ZINC000630744932 1045778746 /nfs/dbraw/zinc/77/87/46/1045778746.db2.gz AYPHQVFRCLBURV-CQSZACIVSA-N -1 1 321.829 4.013 20 0 DIADMM CC(C)SCCSc1nc(-c2ccccc2)cc(=O)[n-]1 ZINC000901616133 1045780151 /nfs/dbraw/zinc/78/01/51/1045780151.db2.gz LEGLUWZOXVLKGV-UHFFFAOYSA-N -1 1 306.456 4.083 20 0 DIADMM CC[C@H](C)C[C@H](NCc1cc2cc(C)c(C)cc2o1)C(=O)[O-] ZINC000901675235 1045793123 /nfs/dbraw/zinc/79/31/23/1045793123.db2.gz MQEAGPLLRUYAJP-ZBEGNZNMSA-N -1 1 303.402 4.029 20 0 DIADMM Cc1nc(S[C@@H](C)c2c(F)cccc2F)[n-]c(=O)c1C1CC1 ZINC000631023592 1045797110 /nfs/dbraw/zinc/79/71/10/1045797110.db2.gz BINXDQSMBPPDKE-VIFPVBQESA-N -1 1 322.380 4.500 20 0 DIADMM CCCc1nc(CSc2nc(C)c(C3CC3)c(=O)[n-]2)cs1 ZINC000631024880 1045797298 /nfs/dbraw/zinc/79/72/98/1045797298.db2.gz HVJCQIOOHGQSLH-UHFFFAOYSA-N -1 1 321.471 4.069 20 0 DIADMM Cc1nc(SC[C@@H]2CCCCC2(F)F)[n-]c(=O)c1C1CC1 ZINC000631023098 1045798698 /nfs/dbraw/zinc/79/86/98/1045798698.db2.gz HOJWAADEHHKAQD-NSHDSACASA-N -1 1 314.401 4.286 20 0 DIADMM CCCCC[C@@H](NCc1cc2cc(C)c(C)cc2o1)C(=O)[O-] ZINC000901721531 1045798664 /nfs/dbraw/zinc/79/86/64/1045798664.db2.gz GZJOSHWOTBZLGL-MRXNPFEDSA-N -1 1 303.402 4.173 20 0 DIADMM Cc1nc(S[C@@H](C)c2ccc(F)c(F)c2)[n-]c(=O)c1C1CC1 ZINC000631024424 1045798796 /nfs/dbraw/zinc/79/87/96/1045798796.db2.gz SNUCLKIUKIHBMN-VIFPVBQESA-N -1 1 322.380 4.500 20 0 DIADMM Cc1nc(S[C@@H](C)c2ccc(F)cc2)[n-]c(=O)c1C1CC1 ZINC000631024121 1045798826 /nfs/dbraw/zinc/79/88/26/1045798826.db2.gz LMQHZOHBPZMGTO-JTQLQIEISA-N -1 1 304.390 4.360 20 0 DIADMM O=C([O-])[C@@H]1CCCCN1Cc1ccc(-c2ccc(Cl)cc2)o1 ZINC000901969355 1045877962 /nfs/dbraw/zinc/87/79/62/1045877962.db2.gz ZUEKPYHBMMLXEY-HNNXBMFYSA-N -1 1 319.788 4.039 20 0 DIADMM O=C([O-])[C@H]1CCCCN1Cc1ccc(-c2ccc(Cl)cc2)o1 ZINC000901969356 1045878272 /nfs/dbraw/zinc/87/82/72/1045878272.db2.gz ZUEKPYHBMMLXEY-OAHLLOKOSA-N -1 1 319.788 4.039 20 0 DIADMM O=C([O-])CN(Cc1ccc(-c2ccc(Cl)cc2)s1)C1CC1 ZINC000901972547 1045879587 /nfs/dbraw/zinc/87/95/87/1045879587.db2.gz VQRONUATNPLPTK-UHFFFAOYSA-N -1 1 321.829 4.118 20 0 DIADMM CC(C)Sc1ccccc1NC(=O)c1ccc(F)c([O-])c1 ZINC001137527138 1045886528 /nfs/dbraw/zinc/88/65/28/1045886528.db2.gz PXWVXCPWQMUHIX-UHFFFAOYSA-N -1 1 305.374 4.284 20 0 DIADMM CC(C)C[C@@H](C(=O)[O-])N(C)Cc1ccc(-c2ccc(F)cc2)o1 ZINC000902022845 1045888965 /nfs/dbraw/zinc/88/89/65/1045888965.db2.gz SABKOEYIOCEZHS-INIZCTEOSA-N -1 1 319.376 4.017 20 0 DIADMM CC(C)c1ccc(C[C@@H](C)NC(=O)c2ccc([O-])cc2F)cc1 ZINC001137561662 1045897800 /nfs/dbraw/zinc/89/78/00/1045897800.db2.gz WXSCGTQANKOKOX-CYBMUJFWSA-N -1 1 315.388 4.016 20 0 DIADMM CCOc1ccccc1[C@H](CC)NCc1csc(C(=O)[O-])c1 ZINC000902119083 1045917842 /nfs/dbraw/zinc/91/78/42/1045917842.db2.gz PWRKKKLORCOZRZ-AWEZNQCLSA-N -1 1 319.426 4.086 20 0 DIADMM Cc1oc(CN[C@@H](c2ccccc2)C(C)(C)C)cc1C(=O)[O-] ZINC000902123804 1045918069 /nfs/dbraw/zinc/91/80/69/1045918069.db2.gz ORHRTYGIFKDZGA-INIZCTEOSA-N -1 1 301.386 4.163 20 0 DIADMM Cc1ccc(NC(=O)Nc2cc(F)c([O-])c(F)c2)cc1Cl ZINC001202809012 1045931095 /nfs/dbraw/zinc/93/10/95/1045931095.db2.gz JZLIAMVUNREDOT-UHFFFAOYSA-N -1 1 312.703 4.276 20 0 DIADMM Cc1ccc(NC(=O)Nc2ccc([O-])c(F)c2F)cc1Cl ZINC001202809407 1045938411 /nfs/dbraw/zinc/93/84/11/1045938411.db2.gz OPNYPBVUYYDAHO-UHFFFAOYSA-N -1 1 312.703 4.276 20 0 DIADMM CCSc1ccc([C@H](C)NCc2cc(C(=O)[O-])oc2C)cc1 ZINC000902220232 1045947650 /nfs/dbraw/zinc/94/76/50/1045947650.db2.gz CNFIWRRMWKCLDC-NSHDSACASA-N -1 1 319.426 4.249 20 0 DIADMM Cc1cc(CN[C@H](c2ccc(F)cc2)C2CCC2)oc1C(=O)[O-] ZINC000902223508 1045949601 /nfs/dbraw/zinc/94/96/01/1045949601.db2.gz BWYWWIJSVLMRLD-INIZCTEOSA-N -1 1 317.360 4.056 20 0 DIADMM CCCc1cc(C(=O)Nc2nc(Cl)ccc2[O-])sc1C ZINC001161178861 1046082933 /nfs/dbraw/zinc/08/29/33/1046082933.db2.gz BKMHLUIBUDCCPJ-UHFFFAOYSA-N -1 1 310.806 4.015 20 0 DIADMM C[C@@H](C[N@@H+](C)[C@@H](C(=O)[O-])c1c(F)cccc1Cl)C(C)(C)C ZINC000634697141 1046086404 /nfs/dbraw/zinc/08/64/04/1046086404.db2.gz BGUNEAXNECFOON-IINYFYTJSA-N -1 1 315.816 4.219 20 0 DIADMM C[C@H](C[N@@H+](C)[C@@H](C(=O)[O-])c1c(F)cccc1Cl)C(C)(C)C ZINC000634697142 1046087472 /nfs/dbraw/zinc/08/74/72/1046087472.db2.gz BGUNEAXNECFOON-QMTHXVAHSA-N -1 1 315.816 4.219 20 0 DIADMM CCCOc1cccc(C(=O)Nc2ccc([O-])c(Cl)c2)c1 ZINC000082192803 1046112498 /nfs/dbraw/zinc/11/24/98/1046112498.db2.gz CGPJLPCDMZZCGB-UHFFFAOYSA-N -1 1 305.761 4.087 20 0 DIADMM C[C@@H](NC(=O)c1cccc([O-])c1F)c1cc2ccccc2s1 ZINC001138264618 1046131374 /nfs/dbraw/zinc/13/13/74/1046131374.db2.gz WRQOLLZCQMWSKR-SNVBAGLBSA-N -1 1 315.369 4.237 20 0 DIADMM CCN(C(=O)c1ccc(C(F)(F)F)c([O-])c1)C1CC(C)(C)C1 ZINC000666034098 1046147376 /nfs/dbraw/zinc/14/73/76/1046147376.db2.gz PYZKIQWOOJAONR-UHFFFAOYSA-N -1 1 315.335 4.062 20 0 DIADMM C/C(=C/c1ccccc1)CN(C)C(=O)c1c([O-])cccc1Cl ZINC000757645392 1046197407 /nfs/dbraw/zinc/19/74/07/1046197407.db2.gz LPDWBJLKTBVKNE-QBFSEMIESA-N -1 1 315.800 4.221 20 0 DIADMM [O-]c1cc(F)cc(F)c1Nc1ccc(Br)cc1F ZINC001212870028 1046232396 /nfs/dbraw/zinc/23/23/96/1046232396.db2.gz LMYDUFLDUXSHFE-UHFFFAOYSA-N -1 1 318.092 4.316 20 0 DIADMM Cc1cc(C)cc(NC(=O)Nc2cc([O-])c(Cl)cc2F)c1 ZINC001202844575 1046236715 /nfs/dbraw/zinc/23/67/15/1046236715.db2.gz ABFMAWRVMDLRIB-UHFFFAOYSA-N -1 1 308.740 4.446 20 0 DIADMM COc1ccc(C)cc1NC(=O)Nc1ccc(Cl)cc1[O-] ZINC001202870352 1046311540 /nfs/dbraw/zinc/31/15/40/1046311540.db2.gz VJSRCQKYGZLFOX-UHFFFAOYSA-N -1 1 306.749 4.007 20 0 DIADMM CC(C)c1ccc(-c2nc(C(=O)[N-]c3cnoc3)cs2)cc1 ZINC000623940365 1046344126 /nfs/dbraw/zinc/34/41/26/1046344126.db2.gz CMZYYZHAPMDODM-UHFFFAOYSA-N -1 1 313.382 4.174 20 0 DIADMM Cc1cccc([N-]S(=O)(=O)c2cccc(C(F)F)c2)c1C ZINC000780363873 1046382187 /nfs/dbraw/zinc/38/21/87/1046382187.db2.gz XCZBISCWFHQOQU-UHFFFAOYSA-N -1 1 311.353 4.042 20 0 DIADMM CCOc1ccc(NC(=O)Nc2cccc([O-])c2Cl)cc1 ZINC001202906763 1046406078 /nfs/dbraw/zinc/40/60/78/1046406078.db2.gz GCBNOLRRNVKAHH-UHFFFAOYSA-N -1 1 306.749 4.088 20 0 DIADMM CC(C)COc1ccccc1C(=O)Nc1ccc([O-])c(Cl)c1 ZINC000780991474 1046416232 /nfs/dbraw/zinc/41/62/32/1046416232.db2.gz IUHIWXOGHZCANI-UHFFFAOYSA-N -1 1 319.788 4.333 20 0 DIADMM Cc1cccc2cc(C(=O)Nc3ccc(Cl)cc3[O-])oc21 ZINC000677212090 1046474971 /nfs/dbraw/zinc/47/49/71/1046474971.db2.gz KNYFUYZVVRLLJW-UHFFFAOYSA-N -1 1 301.729 4.353 20 0 DIADMM Cc1nc2ccc(-c3nc4cccc(F)c4c(=O)[n-]3)cc2s1 ZINC000677846604 1046529257 /nfs/dbraw/zinc/52/92/57/1046529257.db2.gz RITDHSGBTWFWER-UHFFFAOYSA-N -1 1 311.341 4.060 20 0 DIADMM Cc1ccc(-n2ccc(NCc3cccc([O-])c3Cl)n2)cc1 ZINC001202994381 1046570764 /nfs/dbraw/zinc/57/07/64/1046570764.db2.gz YQZNCVIACFBIGL-UHFFFAOYSA-N -1 1 313.788 4.152 20 0 DIADMM Cc1cccc(C)c1CCNC(=O)c1ccc2ccccc2c1[O-] ZINC001137326307 1046602179 /nfs/dbraw/zinc/60/21/79/1046602179.db2.gz LUHUVMLACQZSIH-UHFFFAOYSA-N -1 1 319.404 4.135 20 0 DIADMM CCc1cc(NC(=O)c2cc(SC)ccc2[O-])ccc1F ZINC001140318593 1046654084 /nfs/dbraw/zinc/65/40/84/1046654084.db2.gz ZWIARQDTBQQWSM-UHFFFAOYSA-N -1 1 305.374 4.068 20 0 DIADMM CC(C)(Cc1nc(-c2ccc([O-])c(F)c2)no1)c1ccccc1 ZINC000445476404 1046683211 /nfs/dbraw/zinc/68/32/11/1046683211.db2.gz CAPWWAHHJQNYGO-UHFFFAOYSA-N -1 1 312.344 4.102 20 0 DIADMM Cc1ccn(-c2ccccc2NCc2cccc([O-])c2Cl)n1 ZINC000645170056 1046772503 /nfs/dbraw/zinc/77/25/03/1046772503.db2.gz SYSKXPVXFWXPNL-UHFFFAOYSA-N -1 1 313.788 4.152 20 0 DIADMM CC1(C)Cc2cccc(NCc3cccc([O-])c3Cl)c2O1 ZINC000645176950 1046775886 /nfs/dbraw/zinc/77/58/86/1046775886.db2.gz OTCQFCVUWIRCFI-UHFFFAOYSA-N -1 1 303.789 4.371 20 0 DIADMM O=C(Nc1cccc(NC2CCCC2)c1)c1ccc([O-])cc1F ZINC000679173555 1046790097 /nfs/dbraw/zinc/79/00/97/1046790097.db2.gz OFOUVNUTGHTJFS-UHFFFAOYSA-N -1 1 314.360 4.138 20 0 DIADMM CCc1ccc2occ(C(=O)Nc3ccc([O-])c(F)c3F)c2c1 ZINC001140656781 1046841111 /nfs/dbraw/zinc/84/11/11/1046841111.db2.gz BMMGRZQSDKCWMP-UHFFFAOYSA-N -1 1 317.291 4.231 20 0 DIADMM COCC[C@@H]1CCCCN1Cc1cc(Cl)c([O-])c(Cl)c1 ZINC001140834158 1046923306 /nfs/dbraw/zinc/92/33/06/1046923306.db2.gz ISOWAADRWXBZEQ-LBPRGKRZSA-N -1 1 318.244 4.090 20 0 DIADMM CC[C@H]1c2ccccc2CCN1Cc1ccc([O-])c(F)c1F ZINC001140892879 1046942398 /nfs/dbraw/zinc/94/23/98/1046942398.db2.gz CVDOTKRHBCHFPR-HNNXBMFYSA-N -1 1 303.352 4.180 20 0 DIADMM [O-]c1cccc(CNC2(c3ccccc3Cl)CC2)c1Cl ZINC000647224306 1046955731 /nfs/dbraw/zinc/95/57/31/1046955731.db2.gz AOQSCTIWQLKRQV-UHFFFAOYSA-N -1 1 308.208 4.478 20 0 DIADMM [O-]c1c(F)cc(CN2CCC[C@H]2c2ccccc2F)cc1F ZINC001140990903 1046970253 /nfs/dbraw/zinc/97/02/53/1046970253.db2.gz CHBGAEXEWLDTAS-INIZCTEOSA-N -1 1 307.315 4.147 20 0 DIADMM CSc1cccc(F)c1C(=O)Nc1ccc([O-])c(Cl)c1 ZINC000798981912 1046995689 /nfs/dbraw/zinc/99/56/89/1046995689.db2.gz WMMVDGYSQQQOMC-UHFFFAOYSA-N -1 1 311.765 4.159 20 0 DIADMM CSc1ccc([C@H](C)NC(=O)c2c([O-])cccc2Cl)cc1 ZINC000799038630 1046996426 /nfs/dbraw/zinc/99/64/26/1046996426.db2.gz VHJWETRRIVZJGZ-JTQLQIEISA-N -1 1 321.829 4.259 20 0 DIADMM CC(C)c1nc2cc(NC(=O)c3ccc([O-])c(F)c3)ccc2o1 ZINC000681017940 1047082470 /nfs/dbraw/zinc/08/24/70/1047082470.db2.gz GGCBZHUBBCBROX-UHFFFAOYSA-N -1 1 314.316 4.048 20 0 DIADMM C[C@@H](NC(=O)c1ccc([O-])c(F)c1)c1cccc2ccccc21 ZINC000681015880 1047083205 /nfs/dbraw/zinc/08/32/05/1047083205.db2.gz IWQFSBTXGRWVHN-GFCCVEGCSA-N -1 1 309.340 4.176 20 0 DIADMM Cc1ccc([C@@H]2CCCN2C(=O)c2ccc([O-])c(F)c2)cc1C ZINC000681022929 1047085195 /nfs/dbraw/zinc/08/51/95/1047085195.db2.gz VEOSXTCKBRFWFX-KRWDZBQOSA-N -1 1 313.372 4.125 20 0 DIADMM CCCCOc1ccc(NC(=O)c2ccc([O-])c(F)c2)c(C)c1 ZINC000681022037 1047085678 /nfs/dbraw/zinc/08/56/78/1047085678.db2.gz XAVKVXKQQBMFIH-UHFFFAOYSA-N -1 1 317.360 4.271 20 0 DIADMM Cc1ccc(C)c2sc(NC(=O)c3ccc([O-])c(F)c3)nc21 ZINC000681044593 1047087559 /nfs/dbraw/zinc/08/75/59/1047087559.db2.gz MVFZUWXKUNROMT-UHFFFAOYSA-N -1 1 316.357 4.010 20 0 DIADMM O=C(c1ccc([O-])c(F)c1)N1CCCC[C@H]1c1ccc(F)cc1 ZINC000681053004 1047088070 /nfs/dbraw/zinc/08/80/70/1047088070.db2.gz GSDAVMUSBFTWJC-INIZCTEOSA-N -1 1 317.335 4.038 20 0 DIADMM Cc1cccc([C@@H]2CCCN2C(=O)c2ccc([O-])c(F)c2)c1C ZINC000681049075 1047088241 /nfs/dbraw/zinc/08/82/41/1047088241.db2.gz LRTBUMMEVSBPMZ-KRWDZBQOSA-N -1 1 313.372 4.125 20 0 DIADMM [O-]c1ccc(-c2noc(-c3cccc(Cl)c3F)n2)cc1F ZINC000445477121 1047096670 /nfs/dbraw/zinc/09/66/70/1047096670.db2.gz BBVSIQJGBYGGCK-UHFFFAOYSA-N -1 1 308.671 4.041 20 0 DIADMM CCC[C@@H](C)[C@H]1CCCN1C(=O)Cc1ccc([O-])c(Cl)c1 ZINC001137435590 1047112562 /nfs/dbraw/zinc/11/25/62/1047112562.db2.gz AGOWRCHLFUKQRS-IUODEOHRSA-N -1 1 309.837 4.015 20 0 DIADMM CCOc1cc(-c2noc(-c3ccccc3)n2)cc(Cl)c1[O-] ZINC000445422138 1047154712 /nfs/dbraw/zinc/15/47/12/1047154712.db2.gz KZHDNPLBUXXWHM-UHFFFAOYSA-N -1 1 316.744 4.161 20 0 DIADMM CC[C@@H](C)CO[N-]C(=O)[C@H](CC)c1cccc(C(F)(F)F)c1 ZINC001141518564 1047158242 /nfs/dbraw/zinc/15/82/42/1047158242.db2.gz OLAHFWPKPMPJSP-BXUZGUMPSA-N -1 1 317.351 4.293 20 0 DIADMM CC(C)Oc1ccc(NC(=O)c2ccc([O-])c(F)c2)c(Cl)c1 ZINC000682014129 1047161510 /nfs/dbraw/zinc/16/15/10/1047161510.db2.gz GIFPKDFZLGXDJM-UHFFFAOYSA-N -1 1 323.751 4.224 20 0 DIADMM Cc1cc(F)c2[nH]ccc2c1Nc1cc2ccc([O-])cc2oc1=O ZINC001212973769 1047198440 /nfs/dbraw/zinc/19/84/40/1047198440.db2.gz HDDUGIGFQNWUIM-UHFFFAOYSA-N -1 1 324.311 4.171 20 0 DIADMM O=C(Nc1ccc(Cl)c(F)c1)Nc1ccc([O-])c(Cl)c1 ZINC000476372470 1047373566 /nfs/dbraw/zinc/37/35/66/1047373566.db2.gz IPSQLDIIYYITIL-UHFFFAOYSA-N -1 1 315.131 4.482 20 0 DIADMM CCCCC1CCC(CNC(=O)c2ccc(F)c([O-])c2)CC1 ZINC001142228885 1047409376 /nfs/dbraw/zinc/40/93/76/1047409376.db2.gz DEOVCGNJQPSHPC-UHFFFAOYSA-N -1 1 307.409 4.258 20 0 DIADMM CCC(CC)(C(=O)Nc1cc(F)cc(F)c1[O-])c1ccccc1 ZINC001142541621 1047466596 /nfs/dbraw/zinc/46/65/96/1047466596.db2.gz DZFHGVFDXQZXSS-UHFFFAOYSA-N -1 1 319.351 4.367 20 0 DIADMM CC(C)c1ccc(CCC(=O)Nc2cc(F)cc(F)c2[O-])cc1 ZINC001142542394 1047466709 /nfs/dbraw/zinc/46/67/09/1047466709.db2.gz QFMWNCYRURVSSF-UHFFFAOYSA-N -1 1 319.351 4.365 20 0 DIADMM CC(C)Cc1ccccc1C(=O)Nc1cc(F)cc(F)c1[O-] ZINC001142541579 1047467009 /nfs/dbraw/zinc/46/70/09/1047467009.db2.gz CFRKRWWEJCSVOK-UHFFFAOYSA-N -1 1 305.324 4.121 20 0 DIADMM CSc1cc(F)ccc1[N-]C(=O)c1cc(-c2ccco2)on1 ZINC001143015632 1047524413 /nfs/dbraw/zinc/52/44/13/1047524413.db2.gz AMDZGSZAWBQDKR-UHFFFAOYSA-N -1 1 318.329 4.048 20 0 DIADMM O=C(Nc1ccc2c(c1)N=NC2)c1cc2cccc(O)c2cc1[O-] ZINC001149653245 1047566988 /nfs/dbraw/zinc/56/69/88/1047566988.db2.gz GWWSMOYLGBZPJE-UHFFFAOYSA-N -1 1 319.320 4.101 20 0 DIADMM CC(C)c1cccnc1NC(=O)c1cc2cccc(O)c2cc1[O-] ZINC001149649509 1047567196 /nfs/dbraw/zinc/56/71/96/1047567196.db2.gz DSUGJLQVEFWUEZ-UHFFFAOYSA-N -1 1 322.364 4.022 20 0 DIADMM CCCCCC(C)(C)C(=O)Nc1ccc(-n2ccc(=O)[n-]2)cc1 ZINC001149658015 1047567432 /nfs/dbraw/zinc/56/74/32/1047567432.db2.gz RBVRHDDESTYJNQ-UHFFFAOYSA-N -1 1 315.417 4.123 20 0 DIADMM CCC[C@@H](NC(=O)c1ccc(F)c([O-])c1)c1ccc(F)cc1F ZINC001150827452 1047586109 /nfs/dbraw/zinc/58/61/09/1047586109.db2.gz NBMHTZFCGJZLHE-OAHLLOKOSA-N -1 1 323.314 4.081 20 0 DIADMM CC(C)c1ccc(C[C@H](C)NC(=O)c2cccc([O-])c2F)cc1 ZINC001151003899 1047589310 /nfs/dbraw/zinc/58/93/10/1047589310.db2.gz ARMBUMSBKLXPQH-ZDUSSCGKSA-N -1 1 315.388 4.016 20 0 DIADMM C[C@H]1CCc2sc(C(=O)Nc3ccc([O-])c(Cl)c3)cc2C1 ZINC001151583318 1047598637 /nfs/dbraw/zinc/59/86/37/1047598637.db2.gz XGVGFCMWKVPSPD-VIFPVBQESA-N -1 1 321.829 4.484 20 0 DIADMM O=C(Nc1ccc([O-])c(Cl)c1)c1ccsc1C(F)(F)F ZINC001151583000 1047598712 /nfs/dbraw/zinc/59/87/12/1047598712.db2.gz RDVISAJHGBZMFX-UHFFFAOYSA-N -1 1 321.707 4.378 20 0 DIADMM CCC(C)(C)c1ccc(C(=O)Nc2cccc(F)c2[O-])cc1 ZINC001151772349 1047601684 /nfs/dbraw/zinc/60/16/84/1047601684.db2.gz NYHTZGXDFSMMRI-UHFFFAOYSA-N -1 1 301.361 4.471 20 0 DIADMM C[C@@H]1CC[C@@](C)(/C=C/C(=O)Nc2cccc(F)c2[O-])C1(C)C ZINC001151779721 1047601831 /nfs/dbraw/zinc/60/18/31/1047601831.db2.gz KWTCMXRVMVUEAX-QHNKHSLHSA-N -1 1 305.393 4.488 20 0 DIADMM CC(C)[C@@H]1N(C(=O)c2cccc([O-])c2F)CC12CCCCCC2 ZINC001151899230 1047603359 /nfs/dbraw/zinc/60/33/59/1047603359.db2.gz BEBQXAKHQJMLRL-KRWDZBQOSA-N -1 1 319.420 4.352 20 0 DIADMM Cc1cc(Br)c([O-])c(NC(=O)/C=C\C2CCCC2)c1 ZINC001152517000 1047612456 /nfs/dbraw/zinc/61/24/56/1047612456.db2.gz FDVOSRMGRBADTL-SREVYHEPSA-N -1 1 324.218 4.148 20 0 DIADMM Cc1ccc2nc(C(=O)Nc3ccc(Cl)cc3[O-])ccc2c1 ZINC001153462320 1047625111 /nfs/dbraw/zinc/62/51/11/1047625111.db2.gz VPTQBZCBRUNXPV-UHFFFAOYSA-N -1 1 312.756 4.155 20 0 DIADMM Cc1c(C)c(NC(=O)c2c([O-])ccc3ccccc32)ccc1O ZINC001153504655 1047626944 /nfs/dbraw/zinc/62/69/44/1047626944.db2.gz FLRAYBRSJQNOGD-UHFFFAOYSA-N -1 1 307.349 4.120 20 0 DIADMM CC(=O)c1c(C)cc(NC(=O)c2ccc(C)c(C)c2[O-])cc1C ZINC001153701099 1047630287 /nfs/dbraw/zinc/63/02/87/1047630287.db2.gz SQQDLSCKYCNHKY-UHFFFAOYSA-N -1 1 311.381 4.081 20 0 DIADMM CC(C)[C@@H](CC1CCCCC1)C(=O)[N-]Oc1ccccc1F ZINC001154215593 1047643404 /nfs/dbraw/zinc/64/34/04/1047643404.db2.gz JRICMGVKVRUBES-OAHLLOKOSA-N -1 1 307.409 4.478 20 0 DIADMM O=C(c1cccc([O-])c1F)N1CCCC2(CCCCC2)CC1 ZINC001154357800 1047646297 /nfs/dbraw/zinc/64/62/97/1047646297.db2.gz MUHGJEXRFMBDJA-UHFFFAOYSA-N -1 1 305.393 4.108 20 0 DIADMM COc1ccc2cc([O-])c(C(=O)Nc3cc(C)cs3)cc2c1 ZINC001154749653 1047655974 /nfs/dbraw/zinc/65/59/74/1047655974.db2.gz RJWSJEGPUXDVFR-UHFFFAOYSA-N -1 1 313.378 4.176 20 0 DIADMM CC(C)c1ccc2c(c1)[C@H](NC(=O)c1c([O-])cccc1F)CC2 ZINC001155027201 1047665419 /nfs/dbraw/zinc/66/54/19/1047665419.db2.gz VIRBZTNFAYDRPF-MRXNPFEDSA-N -1 1 313.372 4.072 20 0 DIADMM CC(C)c1oncc1[N-]C(=O)c1ccc(Oc2ccccc2)o1 ZINC001155104117 1047667692 /nfs/dbraw/zinc/66/76/92/1047667692.db2.gz IZWLHDPNMZFHSW-UHFFFAOYSA-N -1 1 312.325 4.436 20 0 DIADMM CC[C@H](C)c1ncc(NC(=O)c2ccc(C(C)C)cc2[O-])cn1 ZINC001155551630 1047684438 /nfs/dbraw/zinc/68/44/38/1047684438.db2.gz IBIBIDUSUFWVDZ-LBPRGKRZSA-N -1 1 313.401 4.071 20 0 DIADMM Cc1cc(C)nc(-c2nc3cc(C(F)(F)F)ccc3c(=O)[n-]2)c1 ZINC000538949420 1047720738 /nfs/dbraw/zinc/72/07/38/1047720738.db2.gz NZEKGRUIMSKZDZ-UHFFFAOYSA-N -1 1 319.286 4.033 20 0 DIADMM Cc1cccc(C2(C(=O)Nc3cc(F)c([O-])cc3Cl)CC2)c1 ZINC001157893547 1047762276 /nfs/dbraw/zinc/76/22/76/1047762276.db2.gz LXEVUNWATNHGFU-UHFFFAOYSA-N -1 1 319.763 4.163 20 0 DIADMM CCC[C@@H](NC(=O)c1ccc2ccc(O)cc2c1[O-])C(C)(C)C ZINC001158430117 1047779229 /nfs/dbraw/zinc/77/92/29/1047779229.db2.gz ZKRPDNRQJIUIBT-MRXNPFEDSA-N -1 1 315.413 4.196 20 0 DIADMM [O-]c1cc(NC(=S)Nc2cccc(F)c2)c(F)cc1Cl ZINC001197641755 1047855627 /nfs/dbraw/zinc/85/56/27/1047855627.db2.gz ZDMBPNJQLMDCKR-UHFFFAOYSA-N -1 1 314.744 4.133 20 0 DIADMM Cc1cc(F)cc(Nc2ccc(F)c(Br)c2[O-])c1 ZINC001174531484 1047861724 /nfs/dbraw/zinc/86/17/24/1047861724.db2.gz ULSOBYDXACTTOP-UHFFFAOYSA-N -1 1 314.129 4.485 20 0 DIADMM O=C([O-])c1cc(Nc2cccc3[nH]ncc32)cc(C(F)(F)F)c1 ZINC001159575330 1047873146 /nfs/dbraw/zinc/87/31/46/1047873146.db2.gz XCFKSAXFRPRZQY-UHFFFAOYSA-N -1 1 321.258 4.024 20 0 DIADMM CCCc1sc(C(=O)Nc2ccc(F)cc2[O-])cc1CC ZINC001183054587 1047884744 /nfs/dbraw/zinc/88/47/44/1047884744.db2.gz OOLYUPUBUXRYBR-UHFFFAOYSA-N -1 1 307.390 4.360 20 0 DIADMM C/C(=C\c1ccccc1Cl)C(=O)Nc1nc(Cl)ccc1[O-] ZINC001183217389 1047906040 /nfs/dbraw/zinc/90/60/40/1047906040.db2.gz BZLVRWMUCDEGIK-CMDGGOBGSA-N -1 1 323.179 4.136 20 0 DIADMM O=c1ccn(-c2ccc(Nc3cccc(C(F)F)c3)cc2)[n-]1 ZINC001174624207 1047912161 /nfs/dbraw/zinc/91/21/61/1047912161.db2.gz BYGZBYNDPKXZPQ-UHFFFAOYSA-N -1 1 301.296 4.259 20 0 DIADMM Cc1ccc(NC(=S)Nc2cccc([O-])c2Cl)c(C)c1 ZINC001197995029 1047917671 /nfs/dbraw/zinc/91/76/71/1047917671.db2.gz NXSJMSUFBRCJQE-UHFFFAOYSA-N -1 1 306.818 4.471 20 0 DIADMM CCO[C@H](C)n1cc(Nc2ccc(Cl)c(Cl)c2[O-])cn1 ZINC001174701477 1047945941 /nfs/dbraw/zinc/94/59/41/1047945941.db2.gz JXOLEBJHWLMZTI-MRVPVSSYSA-N -1 1 316.188 4.194 20 0 DIADMM Cc1ccccc1NC(=S)Nc1cc([O-])c(Cl)cc1F ZINC001198427901 1047955957 /nfs/dbraw/zinc/95/59/57/1047955957.db2.gz URZWISGSRRRNIY-UHFFFAOYSA-N -1 1 310.781 4.302 20 0 DIADMM Cc1ccccc1OCc1nc(=O)c2c3ccccc3sc2[n-]1 ZINC000479775180 1047967795 /nfs/dbraw/zinc/96/77/95/1047967795.db2.gz RPYDDWOYNRYOHI-UHFFFAOYSA-N -1 1 322.389 4.438 20 0 DIADMM CC[C@H](SCCC[N-]C(=O)C(F)(F)F)c1ccc(F)cc1 ZINC000774683999 1047969074 /nfs/dbraw/zinc/96/90/74/1047969074.db2.gz RCNHOAZYJOHNOV-LBPRGKRZSA-N -1 1 323.355 4.079 20 0 DIADMM CCCc1ccc([N-]S(=O)(=O)c2ccc3occc3c2)cc1 ZINC001198816912 1048008306 /nfs/dbraw/zinc/00/83/06/1048008306.db2.gz RTHZUKJWPWUDAH-UHFFFAOYSA-N -1 1 315.394 4.186 20 0 DIADMM CCCC1CCN(C(=O)c2ccc(C(F)(F)F)c([O-])c2)CC1 ZINC001294228509 1048023887 /nfs/dbraw/zinc/02/38/87/1048023887.db2.gz PSSJPZJXMZFTLY-UHFFFAOYSA-N -1 1 315.335 4.063 20 0 DIADMM Cc1c(Cl)cccc1NC(=O)Nc1cc(Cl)ncc1[O-] ZINC001184657108 1048074578 /nfs/dbraw/zinc/07/45/78/1048074578.db2.gz OWXCERQZMYWJRY-UHFFFAOYSA-N -1 1 312.156 4.046 20 0 DIADMM CC(C)Cn1cc(Nc2cc(Cl)cc(Cl)c2[O-])cn1 ZINC001205870469 1048095201 /nfs/dbraw/zinc/09/52/01/1048095201.db2.gz LMXYUJBSDNGWJV-UHFFFAOYSA-N -1 1 300.189 4.295 20 0 DIADMM O=C(Nc1cc([O-])c(F)cc1F)[C@@H]1CCC[C@H]2CCCC[C@@H]21 ZINC001160916191 1048097178 /nfs/dbraw/zinc/09/71/78/1048097178.db2.gz GGGBZWUCYLVFAN-GRYCIOLGSA-N -1 1 309.356 4.215 20 0 DIADMM O=C(Nc1cc([O-])c(F)cc1F)c1ccsc1C(F)(F)F ZINC001160916067 1048097542 /nfs/dbraw/zinc/09/75/42/1048097542.db2.gz FCLXPSJGJQUMSH-UHFFFAOYSA-N -1 1 323.242 4.003 20 0 DIADMM CCOc1ccc(F)c(Nc2cc(F)c([O-])cc2F)c1F ZINC001175040946 1048105620 /nfs/dbraw/zinc/10/56/20/1048105620.db2.gz ADDBREVXCFMEKO-UHFFFAOYSA-N -1 1 301.239 4.091 20 0 DIADMM CCOc1ccc(F)c(Nc2ccc(F)c(F)c2[O-])c1F ZINC001175041648 1048105658 /nfs/dbraw/zinc/10/56/58/1048105658.db2.gz LFQIYVMACMVGNS-UHFFFAOYSA-N -1 1 301.239 4.091 20 0 DIADMM CCOC(=O)c1nc(C2CC2)oc1[N-]c1coc2ccccc12 ZINC001203146956 1048114832 /nfs/dbraw/zinc/11/48/32/1048114832.db2.gz VBNJFYHYHXHDGU-UHFFFAOYSA-N -1 1 312.325 4.219 20 0 DIADMM CCC/C=C\C(=O)Nc1c([O-])cc(Br)cc1Cl ZINC000843887730 1048132483 /nfs/dbraw/zinc/13/24/83/1048132483.db2.gz YVNTTWNDXJLPGU-PLNGDYQASA-N -1 1 318.598 4.103 20 0 DIADMM Cc1c(F)c(F)ccc1NC(=O)c1cc2ccccc2cc1[O-] ZINC001161592825 1048140118 /nfs/dbraw/zinc/14/01/18/1048140118.db2.gz GZQMTTZTFHWKMU-UHFFFAOYSA-N -1 1 313.303 4.384 20 0 DIADMM O=c1oc2cc([O-])ccc2cc1Nc1ccc(Cl)c(F)c1 ZINC001175205889 1048175790 /nfs/dbraw/zinc/17/57/90/1048175790.db2.gz MLZLUOZQGFUZPP-UHFFFAOYSA-N -1 1 305.692 4.035 20 0 DIADMM Cc1nc2cc(Nc3cc4ccc([O-])cc4oc3=O)ccc2s1 ZINC001213036517 1048186624 /nfs/dbraw/zinc/18/66/24/1048186624.db2.gz SZHVPXZZTCMNOS-UHFFFAOYSA-N -1 1 324.361 4.160 20 0 DIADMM [O-]c1cc(F)c(Nc2cccc(O[C@@H]3CCCCO3)c2)cc1F ZINC001175188843 1048192311 /nfs/dbraw/zinc/19/23/11/1048192311.db2.gz ARLHBZHRDWGPKC-QGZVFWFLSA-N -1 1 321.323 4.319 20 0 DIADMM CCC[C@@H](C)[N-]S(=O)(=O)c1sc2ccccc2c1Cl ZINC001185560530 1048195990 /nfs/dbraw/zinc/19/59/90/1048195990.db2.gz UKIYZJJBSRMBSE-SECBINFHSA-N -1 1 317.863 4.022 20 0 DIADMM O=S(=O)([N-]CC1CCCCCCC1)c1sccc1Cl ZINC001185673556 1048216152 /nfs/dbraw/zinc/21/61/52/1048216152.db2.gz BLLZHSSQIVDFEV-UHFFFAOYSA-N -1 1 321.895 4.040 20 0 DIADMM C[C@@H](NC(=O)c1ccc([O-])cc1F)c1csc2ccccc21 ZINC000776141692 1048221216 /nfs/dbraw/zinc/22/12/16/1048221216.db2.gz OYEOYQDPKYBDME-SNVBAGLBSA-N -1 1 315.369 4.237 20 0 DIADMM CC[C@H](C)c1ccccc1[N-]S(=O)(=O)c1cccc(F)c1C ZINC001185790444 1048228307 /nfs/dbraw/zinc/22/83/07/1048228307.db2.gz DETWBOFQXDBHPX-LBPRGKRZSA-N -1 1 321.417 4.448 20 0 DIADMM CC[C@@H](C)c1ccccc1[N-]S(=O)(=O)c1cccc(F)c1C ZINC001185790441 1048228382 /nfs/dbraw/zinc/22/83/82/1048228382.db2.gz DETWBOFQXDBHPX-GFCCVEGCSA-N -1 1 321.417 4.448 20 0 DIADMM [O-]c1cc(Cl)c(Nc2c(F)ccc(O)c2F)cc1Cl ZINC001175268184 1048246499 /nfs/dbraw/zinc/24/64/99/1048246499.db2.gz JOIJAUAJQYSBDB-UHFFFAOYSA-N -1 1 306.095 4.426 20 0 DIADMM O=C(Nc1c(Cl)ccc(O)c1Cl)c1cccc([S-])c1 ZINC001186153169 1048269093 /nfs/dbraw/zinc/26/90/93/1048269093.db2.gz XWCAZSWLBVXFEJ-UHFFFAOYSA-N -1 1 314.193 4.240 20 0 DIADMM O=C(NC1(c2cccc3ccccc32)CC1)c1ccc([O-])c(F)c1 ZINC001186232919 1048273828 /nfs/dbraw/zinc/27/38/28/1048273828.db2.gz BBEOMVWOVLFVOK-UHFFFAOYSA-N -1 1 321.351 4.104 20 0 DIADMM [O-]c1ccc(F)c(Nc2cnccc2OC(F)(F)F)c1Cl ZINC001250234596 1048277027 /nfs/dbraw/zinc/27/70/27/1048277027.db2.gz STLZFLSFBRMAHG-UHFFFAOYSA-N -1 1 322.645 4.222 20 0 DIADMM [O-]c1c(Cl)c(Cl)ccc1Nc1cnc2cccnc2c1 ZINC001175360994 1048277151 /nfs/dbraw/zinc/27/71/51/1048277151.db2.gz UMNKKNSZGROUCM-UHFFFAOYSA-N -1 1 306.152 4.386 20 0 DIADMM [O-]c1ccc(F)c(Nc2cncc(OC(F)(F)F)c2)c1Cl ZINC001250234289 1048280466 /nfs/dbraw/zinc/28/04/66/1048280466.db2.gz ORZLPBPZYLBBCU-UHFFFAOYSA-N -1 1 322.645 4.222 20 0 DIADMM CC(C)Cc1cc([N-]c2c(F)c(F)c(F)c(F)c2F)on1 ZINC001175384047 1048289595 /nfs/dbraw/zinc/28/95/95/1048289595.db2.gz YQPGQGMIMXBYPB-UHFFFAOYSA-N -1 1 306.234 4.312 20 0 DIADMM O=C(NC1(c2cccc3ccccc32)CC1)c1ccc([O-])cc1F ZINC001186339694 1048289685 /nfs/dbraw/zinc/28/96/85/1048289685.db2.gz OTZMIJUYDUWNQZ-UHFFFAOYSA-N -1 1 321.351 4.104 20 0 DIADMM CCOc1ncc(Cl)cc1[N-]c1nc(C(C)(C)C)ns1 ZINC001201506439 1048292533 /nfs/dbraw/zinc/29/25/33/1048292533.db2.gz YMXOYHCLSRHUTG-UHFFFAOYSA-N -1 1 312.826 4.026 20 0 DIADMM Cn1ncc2cccc(Nc3ccc(Cl)c(Cl)c3[O-])c21 ZINC001175447877 1048330381 /nfs/dbraw/zinc/33/03/81/1048330381.db2.gz YOJCWPVWHPYSKM-UHFFFAOYSA-N -1 1 308.168 4.329 20 0 DIADMM CC(C)(C)OC(=O)c1cccc(Nc2cc(F)c([O-])cc2F)c1 ZINC001175545912 1048335803 /nfs/dbraw/zinc/33/58/03/1048335803.db2.gz QDRZSZCPCIIRJE-UHFFFAOYSA-N -1 1 321.323 4.369 20 0 DIADMM CCOc1cccc(CCC(=O)Nc2ccc([O-])c(Cl)c2)c1 ZINC001151582305 1048344096 /nfs/dbraw/zinc/34/40/96/1048344096.db2.gz FKSVKFXLDCELPM-UHFFFAOYSA-N -1 1 319.788 4.016 20 0 DIADMM [O-]c1c(Cl)cc(Br)cc1Nc1cncs1 ZINC001175508488 1048345864 /nfs/dbraw/zinc/34/58/64/1048345864.db2.gz WANZOZKOJRXERD-UHFFFAOYSA-N -1 1 305.584 4.008 20 0 DIADMM CCCOc1cccc(Nc2cc3ccc([O-])cc3oc2=O)c1 ZINC001175598111 1048366665 /nfs/dbraw/zinc/36/66/65/1048366665.db2.gz IWDMBGGZOLVVRO-UHFFFAOYSA-N -1 1 311.337 4.031 20 0 DIADMM CSC[C@H](C)C(=O)Nc1cc(Cl)c([O-])c2ccccc12 ZINC000600135023 1048371325 /nfs/dbraw/zinc/37/13/25/1048371325.db2.gz AXVYUIQYFQCYDM-VIFPVBQESA-N -1 1 309.818 4.136 20 0 DIADMM CS[C@@H](C)CC(=O)Nc1cc(Cl)c([O-])c2ccccc12 ZINC000600135051 1048371608 /nfs/dbraw/zinc/37/16/08/1048371608.db2.gz BUIAOBXQAJUGCI-VIFPVBQESA-N -1 1 309.818 4.279 20 0 DIADMM CSC1(C(=O)Nc2cc(Cl)c([O-])c3ccccc23)CCC1 ZINC000600135086 1048372049 /nfs/dbraw/zinc/37/20/49/1048372049.db2.gz CKJDPUGXGHXTHG-UHFFFAOYSA-N -1 1 321.829 4.423 20 0 DIADMM Cn1cc2cc(Nc3c(Cl)ccc([O-])c3Cl)ccc2n1 ZINC001175620927 1048378107 /nfs/dbraw/zinc/37/81/07/1048378107.db2.gz GYJSIKCYMUOPFS-UHFFFAOYSA-N -1 1 308.168 4.329 20 0 DIADMM Cc1nn(-c2ccccc2)cc1[N-]c1nc2cccc(F)c2o1 ZINC001163026611 1048406310 /nfs/dbraw/zinc/40/63/10/1048406310.db2.gz XHKCGKILZCNSEH-UHFFFAOYSA-N -1 1 308.316 4.205 20 0 DIADMM O=C(N[C@H](C1CCC1)C1CCCCC1)c1ccc([O-])c(F)c1 ZINC001163040384 1048408076 /nfs/dbraw/zinc/40/80/76/1048408076.db2.gz UPJHIPRNTXPKCF-KRWDZBQOSA-N -1 1 305.393 4.010 20 0 DIADMM O=C(Nc1cccc(F)c1[O-])Nc1ccc(Cl)cc1Cl ZINC001202083388 1048445262 /nfs/dbraw/zinc/44/52/62/1048445262.db2.gz QLTMGJSJBLJLCW-UHFFFAOYSA-N -1 1 315.131 4.482 20 0 DIADMM O=C(Nc1ccc(F)cc1[O-])Nc1ccccc1C(F)(F)F ZINC001202166261 1048468983 /nfs/dbraw/zinc/46/89/83/1048468983.db2.gz ZYXYDVPYVXGVTB-UHFFFAOYSA-N -1 1 314.238 4.194 20 0 DIADMM Brc1ccccc1-c1cc([N-]c2cscn2)on1 ZINC001175940354 1048491573 /nfs/dbraw/zinc/49/15/73/1048491573.db2.gz FNLBUKJWEKZILW-UHFFFAOYSA-N -1 1 322.187 4.304 20 0 DIADMM O=C(Nc1cccc(C(F)(F)F)c1)Nc1cccc(F)c1[O-] ZINC001202297924 1048515151 /nfs/dbraw/zinc/51/51/51/1048515151.db2.gz GCSCCCALXMPPSM-UHFFFAOYSA-N -1 1 314.238 4.194 20 0 DIADMM O=C(Nc1ccc2ccccc2c1)Nc1cc(F)c(F)cc1[O-] ZINC001188609528 1048526703 /nfs/dbraw/zinc/52/67/03/1048526703.db2.gz WPOIGKWTZAKTLR-UHFFFAOYSA-N -1 1 314.291 4.468 20 0 DIADMM O=C(Nc1ccc2ccccc2c1)Nc1cc(F)c([O-])c(F)c1 ZINC001188611500 1048528507 /nfs/dbraw/zinc/52/85/07/1048528507.db2.gz MGBCJWGWIWROSF-UHFFFAOYSA-N -1 1 314.291 4.468 20 0 DIADMM FC(F)(F)c1ccc([S-])c(Nc2ccc3nn[nH]c3c2)c1 ZINC001176005814 1048528917 /nfs/dbraw/zinc/52/89/17/1048528917.db2.gz KILKTMYYQXANGR-UHFFFAOYSA-N -1 1 310.304 4.009 20 0 DIADMM FC(F)(F)c1ccc([S-])c(Nc2ccc3n[nH]nc3c2)c1 ZINC001176005814 1048528926 /nfs/dbraw/zinc/52/89/26/1048528926.db2.gz KILKTMYYQXANGR-UHFFFAOYSA-N -1 1 310.304 4.009 20 0 DIADMM O=C(Nc1ccc(F)cc1)Nc1cc(Cl)c(Cl)cc1[O-] ZINC001202354481 1048529508 /nfs/dbraw/zinc/52/95/08/1048529508.db2.gz KJPCMLKHPSECEG-UHFFFAOYSA-N -1 1 315.131 4.482 20 0 DIADMM Cc1ccc(NC(=O)Nc2cccc([O-])c2Br)cc1 ZINC001202434471 1048550227 /nfs/dbraw/zinc/55/02/27/1048550227.db2.gz NXPDQHKJRHZKLM-UHFFFAOYSA-N -1 1 321.174 4.107 20 0 DIADMM Cc1ccc(Cl)cc1NC(=O)Nc1cc(F)c([O-])cc1F ZINC001188734090 1048551433 /nfs/dbraw/zinc/55/14/33/1048551433.db2.gz UZDOAYIIWTXONL-UHFFFAOYSA-N -1 1 312.703 4.276 20 0 DIADMM O=C(Nc1cc([O-])c(F)cc1F)Nc1cccc2ccccc21 ZINC001188936305 1048568847 /nfs/dbraw/zinc/56/88/47/1048568847.db2.gz CCFFXGUMNKWDEM-UHFFFAOYSA-N -1 1 314.291 4.468 20 0 DIADMM O=C(Nc1cc(F)c(F)cc1[O-])Nc1cccc2ccccc21 ZINC001188944130 1048570802 /nfs/dbraw/zinc/57/08/02/1048570802.db2.gz UPIBZTGMYMAYTG-UHFFFAOYSA-N -1 1 314.291 4.468 20 0 DIADMM O=C(c1ccc(F)c([O-])c1)N1Cc2ccccc2-c2ccccc21 ZINC001164105612 1048585107 /nfs/dbraw/zinc/58/51/07/1048585107.db2.gz ZCNUTMUULBDKIQ-UHFFFAOYSA-N -1 1 319.335 4.359 20 0 DIADMM CCCc1cc(=O)[n-]c(SC[C@@H]2CCCc3ccccc32)n1 ZINC001164551493 1048641174 /nfs/dbraw/zinc/64/11/74/1048641174.db2.gz KUBQXIKTQRVWNU-AWEZNQCLSA-N -1 1 314.454 4.347 20 0 DIADMM CCCc1cc(=O)[n-]c(SCc2ccc(Cl)c(F)c2)n1 ZINC001164551568 1048641280 /nfs/dbraw/zinc/64/12/80/1048641280.db2.gz MELFQWBJVPYCNW-UHFFFAOYSA-N -1 1 312.797 4.220 20 0 DIADMM Cc1ccccc1[C@@H]1C[C@H]1NC(=O)c1cc2ccccc2cc1[O-] ZINC001165349201 1048684416 /nfs/dbraw/zinc/68/44/16/1048684416.db2.gz HSWKPTDQCFZBET-PKOBYXMFSA-N -1 1 317.388 4.140 20 0 DIADMM CCc1cccc(C)c1NC(=O)Nc1cc(F)c([O-])cc1F ZINC001189982267 1048685477 /nfs/dbraw/zinc/68/54/77/1048685477.db2.gz SQKNRTWLQNXSEB-UHFFFAOYSA-N -1 1 306.312 4.185 20 0 DIADMM CC(C)(C)c1ccc(/C=C\C(=O)Nc2c([O-])cccc2F)cc1 ZINC001165758426 1048714774 /nfs/dbraw/zinc/71/47/74/1048714774.db2.gz HGTUQRSULVNDCZ-XFXZXTDPSA-N -1 1 313.372 4.481 20 0 DIADMM CN(C(=O)c1cccc([O-])c1F)C1CC(C)(C)CC(C)(C)C1 ZINC001165844471 1048721269 /nfs/dbraw/zinc/72/12/69/1048721269.db2.gz DGOSRYZOJNNHDC-UHFFFAOYSA-N -1 1 307.409 4.208 20 0 DIADMM Cc1nc(SCCc2ccc3ccccc3c2)[n-]c(=O)c1C ZINC001165916984 1048724842 /nfs/dbraw/zinc/72/48/42/1048724842.db2.gz GGYIMEFJEHMVQZ-UHFFFAOYSA-N -1 1 310.422 4.287 20 0 DIADMM O=S(=O)([N-]c1ccc(Cl)cc1)c1ccc(C2CC2)cc1 ZINC001190463665 1048742402 /nfs/dbraw/zinc/74/24/02/1048742402.db2.gz JLTSZFLSDLZGIA-UHFFFAOYSA-N -1 1 307.802 4.018 20 0 DIADMM Cc1cc(Cl)cc([N-]S(=O)(=O)c2ccc(C3CC3)cc2)c1 ZINC001190499407 1048743550 /nfs/dbraw/zinc/74/35/50/1048743550.db2.gz FFVGJMHFZZLQLJ-UHFFFAOYSA-N -1 1 321.829 4.327 20 0 DIADMM [O-]c1c(Cl)nccc1Nc1ccc(OC(F)(F)F)cc1 ZINC001176641493 1048744531 /nfs/dbraw/zinc/74/45/31/1048744531.db2.gz KJONEPZKJVKMAG-UHFFFAOYSA-N -1 1 304.655 4.083 20 0 DIADMM [O-]c1c(F)cc(F)c(Nc2ccccc2OC(F)(F)F)c1F ZINC001176669347 1048752516 /nfs/dbraw/zinc/75/25/16/1048752516.db2.gz HPQWYRZNGQSZPO-UHFFFAOYSA-N -1 1 323.192 4.452 20 0 DIADMM [O-]c1c(F)cc(F)c(Nc2ccc(OC(F)F)cc2)c1F ZINC001176669163 1048752830 /nfs/dbraw/zinc/75/28/30/1048752830.db2.gz FHVPYTBURBDDCR-UHFFFAOYSA-N -1 1 305.202 4.155 20 0 DIADMM [O-]c1c(F)cc(F)c(Nc2cc(Cl)cc(Cl)n2)c1F ZINC001176664106 1048753603 /nfs/dbraw/zinc/75/36/03/1048753603.db2.gz TUKVYJHYPSZBSP-UHFFFAOYSA-N -1 1 309.074 4.255 20 0 DIADMM COc1cccc(Nc2c(F)cc(F)c([O-])c2F)c1Cl ZINC001176671376 1048754778 /nfs/dbraw/zinc/75/47/78/1048754778.db2.gz BOORHSHPZCNDMF-UHFFFAOYSA-N -1 1 303.667 4.215 20 0 DIADMM [O-]c1c(F)cc(F)c(Nc2c(O)cccc2C(F)(F)F)c1F ZINC001176670678 1048754824 /nfs/dbraw/zinc/75/48/24/1048754824.db2.gz KLQOHQCSHQTYES-UHFFFAOYSA-N -1 1 323.192 4.278 20 0 DIADMM Cc1ccc2cccc(Nc3c(F)cc(F)c([O-])c3F)c2n1 ZINC001176671464 1048754959 /nfs/dbraw/zinc/75/49/59/1048754959.db2.gz DVILSBMBGGILHC-UHFFFAOYSA-N -1 1 304.271 4.410 20 0 DIADMM COc1cccc(Cl)c1Nc1c(F)cc(F)c([O-])c1F ZINC001176671197 1048755105 /nfs/dbraw/zinc/75/51/05/1048755105.db2.gz UXQRCBPOKLJCNN-UHFFFAOYSA-N -1 1 303.667 4.215 20 0 DIADMM Cc1nc2ccc(Nc3c(F)cc(F)c([O-])c3F)cc2s1 ZINC001176670498 1048755127 /nfs/dbraw/zinc/75/51/27/1048755127.db2.gz WTIQEKBMCBWGHF-UHFFFAOYSA-N -1 1 310.300 4.471 20 0 DIADMM COc1cc(Nc2c(F)cc(F)c([O-])c2F)ccc1SC ZINC001176669681 1048756678 /nfs/dbraw/zinc/75/66/78/1048756678.db2.gz KBZAOPNCHGIGRY-UHFFFAOYSA-N -1 1 315.316 4.284 20 0 DIADMM [O-]c1c(F)cc(F)c(Nc2ccc(Cl)c(F)c2F)c1F ZINC001176673672 1048758171 /nfs/dbraw/zinc/75/81/71/1048758171.db2.gz VPWDEOCSWGNNRE-UHFFFAOYSA-N -1 1 309.621 4.485 20 0 DIADMM CCC[C@H](C)c1cc(Nc2c(F)cc(F)c([O-])c2F)on1 ZINC001176663194 1048769986 /nfs/dbraw/zinc/76/99/86/1048769986.db2.gz CVCQDUHIBJPDQE-ZETCQYMHSA-N -1 1 300.280 4.445 20 0 DIADMM CC(C)n1ccc(Nc2ccc(F)c(Br)c2[O-])c1 ZINC001203171271 1048790059 /nfs/dbraw/zinc/79/00/59/1048790059.db2.gz ZUHKBZKYKBXBBS-UHFFFAOYSA-N -1 1 313.170 4.420 20 0 DIADMM O=C(c1cccc(Nc2ccc([O-])c(F)c2F)c1)C(F)(F)F ZINC001203345140 1048877354 /nfs/dbraw/zinc/87/73/54/1048877354.db2.gz PAIHFJVCLWWJFN-UHFFFAOYSA-N -1 1 317.213 4.159 20 0 DIADMM O=C(c1cccc(Nc2cc(F)c([O-])cc2F)c1)C(F)(F)F ZINC001203347083 1048878422 /nfs/dbraw/zinc/87/84/22/1048878422.db2.gz QBYDPLVHGDUUDP-UHFFFAOYSA-N -1 1 317.213 4.159 20 0 DIADMM O=C(Nc1ccc([O-])c(Cl)c1)c1ccc(OCC2CC2)cc1 ZINC000111667253 1048928040 /nfs/dbraw/zinc/92/80/40/1048928040.db2.gz JVJVNYDDFGYKPX-UHFFFAOYSA-N -1 1 317.772 4.087 20 0 DIADMM Cc1cc2cc(CN[C@H](CCCC(C)C)C(=O)[O-])oc2cc1C ZINC000904035344 1048955164 /nfs/dbraw/zinc/95/51/64/1048955164.db2.gz CSIAPDWREOELPK-QGZVFWFLSA-N -1 1 317.429 4.419 20 0 DIADMM CCCOc1ccc(Nc2ccnc(Cl)c2[O-])c(F)c1F ZINC001203695256 1048967110 /nfs/dbraw/zinc/96/71/10/1048967110.db2.gz JBWSJASRQQHJKC-UHFFFAOYSA-N -1 1 314.719 4.251 20 0 DIADMM CCCOc1ccc(Nc2c([O-])cc(F)cc2F)c(F)c1F ZINC001203695505 1048967262 /nfs/dbraw/zinc/96/72/62/1048967262.db2.gz MBFDRYCKOAWNCJ-UHFFFAOYSA-N -1 1 315.266 4.481 20 0 DIADMM CC[C@H](CC(F)(F)F)C(=O)Nc1cc(F)c([O-])cc1Cl ZINC000885678877 1048968089 /nfs/dbraw/zinc/96/80/89/1048968089.db2.gz XBAOJVAEHOCOJK-ZCFIWIBFSA-N -1 1 313.678 4.102 20 0 DIADMM Cc1ccc(Cl)c(NC(=O)Nc2c(F)cc([O-])cc2F)c1 ZINC001191708767 1048981705 /nfs/dbraw/zinc/98/17/05/1048981705.db2.gz VRWLODURUUNPQV-UHFFFAOYSA-N -1 1 312.703 4.276 20 0 DIADMM [O-]c1ccc(Cc2nc(-c3cccc(Cl)c3)no2)cc1Cl ZINC000904287914 1049022007 /nfs/dbraw/zinc/02/20/07/1049022007.db2.gz CBVTUPYBYUDIDK-UHFFFAOYSA-N -1 1 321.163 4.340 20 0 DIADMM CC(C)c1ccccc1NC(=O)Nc1cc([O-])c(F)cc1F ZINC001192252595 1049058825 /nfs/dbraw/zinc/05/88/25/1049058825.db2.gz SITVWMPRPGNQJF-UHFFFAOYSA-N -1 1 306.312 4.438 20 0 DIADMM CC(C)c1ccccc1NC(=O)Nc1cc(Cl)ncc1[O-] ZINC001192227771 1049067940 /nfs/dbraw/zinc/06/79/40/1049067940.db2.gz VPQFXVIDOCJTEK-UHFFFAOYSA-N -1 1 305.765 4.208 20 0 DIADMM CC(C)(C)c1ccc(C(=O)Nc2scnc2C2CC2)c([O-])c1 ZINC001192313616 1049075335 /nfs/dbraw/zinc/07/53/35/1049075335.db2.gz FFRIOTIQLZFQGE-UHFFFAOYSA-N -1 1 316.426 4.276 20 0 DIADMM CC(C)(C)c1ccc(C(=O)Nc2cnc3occc3c2)c([O-])c1 ZINC001192313371 1049075599 /nfs/dbraw/zinc/07/55/99/1049075599.db2.gz COYVLQYQRFSXJK-UHFFFAOYSA-N -1 1 310.353 4.083 20 0 DIADMM Cc1c(C)c(NC(=O)c2ccc(C(C)(C)C)cc2[O-])ccc1O ZINC001192323520 1049078071 /nfs/dbraw/zinc/07/80/71/1049078071.db2.gz YTQQVLCHDOYQCS-UHFFFAOYSA-N -1 1 313.397 4.264 20 0 DIADMM COc1nccc2cc(NCc3cccc([O-])c3Cl)ccc21 ZINC001178762309 1049085327 /nfs/dbraw/zinc/08/53/27/1049085327.db2.gz JLCUQPBWILXGMT-UHFFFAOYSA-N -1 1 314.772 4.215 20 0 DIADMM CSc1ccc([O-])c(-c2nc(-c3ccccc3Cl)no2)c1 ZINC000904567933 1049100059 /nfs/dbraw/zinc/10/00/59/1049100059.db2.gz VHAJJQPAMWDWSS-UHFFFAOYSA-N -1 1 318.785 4.485 20 0 DIADMM O=C(c1ccc(C(F)(F)F)cc1[O-])N1CCCCCCCC1 ZINC000857529072 1049170493 /nfs/dbraw/zinc/17/04/93/1049170493.db2.gz PAIKZJVQUILWCB-UHFFFAOYSA-N -1 1 315.335 4.207 20 0 DIADMM [O-]c1cccc(CNc2ccc(-c3ccon3)cc2)c1Cl ZINC001179658148 1049189255 /nfs/dbraw/zinc/18/92/55/1049189255.db2.gz DQCYGJWLAUWPSD-UHFFFAOYSA-N -1 1 300.745 4.313 20 0 DIADMM Cc1cccnc1[C@H](NCc1csc(C(=O)[O-])c1)C(C)(C)C ZINC000905800751 1049253593 /nfs/dbraw/zinc/25/35/93/1049253593.db2.gz ZZVRGNYGLMWNQF-HNNXBMFYSA-N -1 1 318.442 4.027 20 0 DIADMM O=c1nc(N2CCC[C@@H]2CCC2CCCCC2)cc(Cl)[n-]1 ZINC000858451578 1049260432 /nfs/dbraw/zinc/26/04/32/1049260432.db2.gz ZWCVNXAUTFEFAL-CYBMUJFWSA-N -1 1 309.841 4.165 20 0 DIADMM CCc1c(Cl)cc(Nc2cnc3ccnn3c2)c([O-])c1Cl ZINC001204821305 1049276669 /nfs/dbraw/zinc/27/66/69/1049276669.db2.gz VVPSHPOAIBSRGO-UHFFFAOYSA-N -1 1 323.183 4.048 20 0 DIADMM Cc1c(Cl)cc(Nc2ccn3ccnc3c2)c([O-])c1Cl ZINC001204990740 1049332898 /nfs/dbraw/zinc/33/28/98/1049332898.db2.gz FWCZLXOCKOSOFB-UHFFFAOYSA-N -1 1 308.168 4.399 20 0 DIADMM CC(C)(C)C[C@@H](NCc1ccc([O-])c(F)c1F)C(F)(F)F ZINC001204999904 1049335214 /nfs/dbraw/zinc/33/52/14/1049335214.db2.gz GMPIHLZVONMZNE-SNVBAGLBSA-N -1 1 311.294 4.127 20 0 DIADMM CC(C)(C)Sc1ccc([N-]S(=O)(=O)c2ccccc2)cc1 ZINC000201437404 1049379107 /nfs/dbraw/zinc/37/91/07/1049379107.db2.gz DSFWKGLGZWTBFL-UHFFFAOYSA-N -1 1 321.467 4.378 20 0 DIADMM O=C(c1c([O-])cccc1Cl)N1CCC(c2ccsc2)CC1 ZINC000777224624 1049466684 /nfs/dbraw/zinc/46/66/84/1049466684.db2.gz MKOXRTOPKZYUOM-UHFFFAOYSA-N -1 1 321.829 4.127 20 0 DIADMM O=C(Nc1cccc(F)c1[O-])Oc1ccccc1C(F)(F)F ZINC001195196817 1049494555 /nfs/dbraw/zinc/49/45/55/1049494555.db2.gz LKITZDMTBQDWRD-UHFFFAOYSA-N -1 1 315.222 4.161 20 0 DIADMM O=C(/C=C\C1CCCCC1)Nc1cccc([O-])c1Br ZINC000908713429 1049502308 /nfs/dbraw/zinc/50/23/08/1049502308.db2.gz SUBGRGPLRZXHFD-KTKRTIGZSA-N -1 1 324.218 4.230 20 0 DIADMM Nc1cc(Cl)c(Cl)nc1Nc1cc(Cl)c([O-])cc1F ZINC001250023637 1049531440 /nfs/dbraw/zinc/53/14/40/1049531440.db2.gz SUYFEHHZEQSPAW-UHFFFAOYSA-N -1 1 322.554 4.212 20 0 DIADMM CCOC(=O)NC(=S)[N-]c1ccc2oc3ccccc3c2c1 ZINC001195482019 1049534550 /nfs/dbraw/zinc/53/45/50/1049534550.db2.gz CZYVHBRQAROWTH-UHFFFAOYSA-N -1 1 314.366 4.029 20 0 DIADMM CCOC(=O)NC(=S)[N-]c1cc(C)ccc1-c1ccccc1 ZINC001195495217 1049537569 /nfs/dbraw/zinc/53/75/69/1049537569.db2.gz XBFAIBMEMRAIFW-UHFFFAOYSA-N -1 1 314.410 4.105 20 0 DIADMM [O-]c1cc(NC(=S)Nc2ccccc2F)c(F)cc1Cl ZINC001195776931 1049568342 /nfs/dbraw/zinc/56/83/42/1049568342.db2.gz YAOWPVGOZHULCK-UHFFFAOYSA-N -1 1 314.744 4.133 20 0 DIADMM Cc1ccsc1CCCC(=O)Nc1cc([O-])c(F)cc1F ZINC000909983874 1049575228 /nfs/dbraw/zinc/57/52/28/1049575228.db2.gz DVMQEPKGWUVDCX-UHFFFAOYSA-N -1 1 311.353 4.002 20 0 DIADMM O=C(Nc1cc([O-])c(F)cc1F)C1(Cc2ccccc2)CCC1 ZINC000909981150 1049575441 /nfs/dbraw/zinc/57/54/41/1049575441.db2.gz AMNWHKXFDLAUOW-UHFFFAOYSA-N -1 1 317.335 4.022 20 0 DIADMM CC(C)Cn1cc(Nc2ccc(Cl)c(Cl)c2[O-])cn1 ZINC001205876652 1049591286 /nfs/dbraw/zinc/59/12/86/1049591286.db2.gz TZURYBGJCSJATP-UHFFFAOYSA-N -1 1 300.189 4.295 20 0 DIADMM Cc1cc(F)ccc1NC(=S)Nc1cccc([O-])c1Cl ZINC001196122549 1049623079 /nfs/dbraw/zinc/62/30/79/1049623079.db2.gz KZCIZHUKLXAVFZ-UHFFFAOYSA-N -1 1 310.781 4.302 20 0 DIADMM Cc1cccc(NC(=S)Nc2c(F)cc([O-])cc2F)c1C ZINC001196422154 1049656372 /nfs/dbraw/zinc/65/63/72/1049656372.db2.gz LFYMMFXUUXAWBZ-UHFFFAOYSA-N -1 1 308.353 4.096 20 0 DIADMM COC(=O)c1nc2ccc(-c3ccc(Cl)c(C)c3F)cc2[n-]1 ZINC001206277783 1049698160 /nfs/dbraw/zinc/69/81/60/1049698160.db2.gz FKYUUGFMXFNLPK-UHFFFAOYSA-N -1 1 318.735 4.117 20 0 DIADMM COC(=O)c1nc2cc(-c3ccc(Cl)c(C)c3F)ccc2[n-]1 ZINC001206277783 1049698165 /nfs/dbraw/zinc/69/81/65/1049698165.db2.gz FKYUUGFMXFNLPK-UHFFFAOYSA-N -1 1 318.735 4.117 20 0 DIADMM COc1c(F)ccc(Nc2cc([O-])c(F)c(F)c2)c1Cl ZINC001209805103 1050087130 /nfs/dbraw/zinc/08/71/30/1050087130.db2.gz XJJPNXXOEIHQQI-UHFFFAOYSA-N -1 1 303.667 4.215 20 0 DIADMM COc1cc(C(F)(F)F)ccc1[N-]c1nnc(C(C)(C)C)o1 ZINC001209882530 1050099663 /nfs/dbraw/zinc/09/96/63/1050099663.db2.gz ZHWUZEBRMMLIHE-UHFFFAOYSA-N -1 1 315.295 4.138 20 0 DIADMM COc1ccc(Nc2ccnc(Cl)c2[O-])c2ccccc12 ZINC001209923880 1050106488 /nfs/dbraw/zinc/10/64/88/1050106488.db2.gz UBIKIWFSYLHKSS-UHFFFAOYSA-N -1 1 300.745 4.346 20 0 DIADMM [O-]c1c(F)c(F)ccc1Nc1cc(C(F)(F)F)ccc1O ZINC001209985233 1050116759 /nfs/dbraw/zinc/11/67/59/1050116759.db2.gz XHYDPNREZNYKQG-UHFFFAOYSA-N -1 1 305.202 4.138 20 0 DIADMM CC(=O)c1cc(Nc2cccc(Cl)c2[O-])cc(C(C)=O)c1 ZINC001210223331 1050165062 /nfs/dbraw/zinc/16/50/62/1050165062.db2.gz OMHGGHQSBPDGDF-UHFFFAOYSA-N -1 1 303.745 4.194 20 0 DIADMM CCC[C@@H](NC(=O)c1ccc2ccccc2c1[O-])c1ccccn1 ZINC000591671884 1050188534 /nfs/dbraw/zinc/18/85/34/1050188534.db2.gz BNZGBYQHLNOKKN-GOSISDBHSA-N -1 1 320.392 4.212 20 0 DIADMM Cc1ccc(CN[C@H]2C[C@H](C(=O)[O-])c3ccccc32)c(Cl)c1 ZINC000573729516 1050248615 /nfs/dbraw/zinc/24/86/15/1050248615.db2.gz WHHRLHVNFNYQDU-RDJZCZTQSA-N -1 1 315.800 4.051 20 0 DIADMM O=C([O-])CN(Cc1ccc(-c2ccccc2Cl)s1)C1CC1 ZINC000734845749 1050324563 /nfs/dbraw/zinc/32/45/63/1050324563.db2.gz DTZSPLQRZRJDPK-UHFFFAOYSA-N -1 1 321.829 4.118 20 0 DIADMM CC(=O)c1cc(NC(=O)c2cc([O-])c3ccccc3c2)ccc1C ZINC001143669392 1050333275 /nfs/dbraw/zinc/33/32/75/1050333275.db2.gz QVOGFIDOMHFVBY-UHFFFAOYSA-N -1 1 319.360 4.309 20 0 DIADMM CCC[C@@H](Cc1ccccc1)NC(=O)c1cc(Cl)ccc1[O-] ZINC001143696274 1050338781 /nfs/dbraw/zinc/33/87/81/1050338781.db2.gz GNGXFHWFCDKFNW-HNNXBMFYSA-N -1 1 317.816 4.187 20 0 DIADMM COc1c(F)cc(F)cc1Nc1cc([O-])c(Cl)cc1F ZINC001210868889 1050400891 /nfs/dbraw/zinc/40/08/91/1050400891.db2.gz YSDWTNMQYFZUOG-UHFFFAOYSA-N -1 1 303.667 4.215 20 0 DIADMM [O-]c1c(Cl)cc(Nc2ccncc2C(F)(F)F)cc1Cl ZINC001210922841 1050414212 /nfs/dbraw/zinc/41/42/12/1050414212.db2.gz FIGZYRLOMKSBNK-UHFFFAOYSA-N -1 1 323.101 4.278 20 0 DIADMM Nc1cc2ccn(-c3cc(Cl)c([O-])c(Cl)c3)c2cc1F ZINC001210930021 1050420332 /nfs/dbraw/zinc/42/03/32/1050420332.db2.gz CUKFONFXANRADI-UHFFFAOYSA-N -1 1 311.143 4.364 20 0 DIADMM Cc1ccc(Nc2c(Cl)ccc(Br)c2[O-])nc1 ZINC001211013916 1050447172 /nfs/dbraw/zinc/44/71/72/1050447172.db2.gz MXDIUXLAZRAIPB-UHFFFAOYSA-N -1 1 313.582 4.255 20 0 DIADMM C[C@@H](C(=O)[N-]OCc1ccccc1)c1ccc(Cl)c(Cl)c1 ZINC000746582306 1050474911 /nfs/dbraw/zinc/47/49/11/1050474911.db2.gz UIKUOJMGOTXQLT-LLVKDONJSA-N -1 1 324.207 4.345 20 0 DIADMM COC(=O)c1cc2ccc(-c3cc(F)c([O-])cc3F)cc2s1 ZINC001211338414 1050552121 /nfs/dbraw/zinc/55/21/21/1050552121.db2.gz FTAKYCULRTYVQQ-UHFFFAOYSA-N -1 1 320.316 4.339 20 0 DIADMM [O-]c1cc(F)c(-c2ccc(OCc3ccccc3)nc2)cc1F ZINC001211349207 1050552526 /nfs/dbraw/zinc/55/25/26/1050552526.db2.gz AIXDYWZBWPXYAT-UHFFFAOYSA-N -1 1 313.303 4.311 20 0 DIADMM COc1ccc(-c2ccncc2)cc1-c1cc(F)c([O-])cc1F ZINC001211349411 1050552896 /nfs/dbraw/zinc/55/28/96/1050552896.db2.gz FQEBQHMBQSMEQO-UHFFFAOYSA-N -1 1 313.303 4.408 20 0 DIADMM CC(C)(C)OC(=O)c1ccc(-c2cc(F)c([O-])cc2F)cc1F ZINC001211350201 1050554179 /nfs/dbraw/zinc/55/41/79/1050554179.db2.gz OXSGIOOEZINKQX-UHFFFAOYSA-N -1 1 324.298 4.432 20 0 DIADMM CC[C@@H](C(=O)OC)c1ccc(-c2cc(F)c([O-])cc2F)cc1 ZINC001211352272 1050554607 /nfs/dbraw/zinc/55/46/07/1050554607.db2.gz KAOLOCLIBOELEN-GFCCVEGCSA-N -1 1 306.308 4.004 20 0 DIADMM COC(=O)[C@H](c1ccc(-c2cc(F)c([O-])cc2F)cc1)C(C)C ZINC001211352620 1050554684 /nfs/dbraw/zinc/55/46/84/1050554684.db2.gz NLXRTNMSPJKSOF-KRWDZBQOSA-N -1 1 320.335 4.250 20 0 DIADMM COc1cc(-c2cc(F)c([O-])cc2F)ccc1C(F)(F)F ZINC001211353725 1050555282 /nfs/dbraw/zinc/55/52/82/1050555282.db2.gz ZBQXQVIUHIBWRE-UHFFFAOYSA-N -1 1 304.214 4.365 20 0 DIADMM COc1ccc(-c2ccccn2)cc1-c1cc(F)c([O-])cc1F ZINC001211352950 1050555374 /nfs/dbraw/zinc/55/53/74/1050555374.db2.gz OPDBZZBLSWYUIA-UHFFFAOYSA-N -1 1 313.303 4.408 20 0 DIADMM [O-]c1cc(F)c(-c2ccc(O[C@@H]3CCCCO3)cc2)cc1F ZINC001211352978 1050555397 /nfs/dbraw/zinc/55/53/97/1050555397.db2.gz PSOIQOUSWGZQKU-QGZVFWFLSA-N -1 1 306.308 4.243 20 0 DIADMM [O-]c1c(Nc2ccc3c(c2)NCC3)ccc(F)c1Br ZINC001213156709 1050603333 /nfs/dbraw/zinc/60/33/33/1050603333.db2.gz QGIRGEMGHZPYIK-UHFFFAOYSA-N -1 1 323.165 4.005 20 0 DIADMM Cc1c(Cl)cc(Nc2cnc3nccnc3c2)c([O-])c1Cl ZINC001213226883 1050613600 /nfs/dbraw/zinc/61/36/00/1050613600.db2.gz KFNDAKHQDAMHHD-UHFFFAOYSA-N -1 1 321.167 4.089 20 0 DIADMM COc1cccc(C(F)(F)F)c1Nc1cc(F)c([O-])cc1F ZINC001213344763 1050635752 /nfs/dbraw/zinc/63/57/52/1050635752.db2.gz FWHVMBSVWIRMMB-UHFFFAOYSA-N -1 1 319.229 4.441 20 0 DIADMM [O-]c1cc(F)c(CN2CCC[C@H]2c2ccc(F)cc2)cc1F ZINC001144647169 1050639083 /nfs/dbraw/zinc/63/90/83/1050639083.db2.gz BFSSJJXBKYPSDR-INIZCTEOSA-N -1 1 307.315 4.147 20 0 DIADMM [O-]c1c(F)cc(Nc2cccc(Br)c2F)cc1F ZINC001213382059 1050645204 /nfs/dbraw/zinc/64/52/04/1050645204.db2.gz XZSYJAMWWDFFRV-UHFFFAOYSA-N -1 1 318.092 4.316 20 0 DIADMM CN(Cc1ccc2ccccc2c1)Cc1cc(F)c([O-])cc1F ZINC001144659920 1050649004 /nfs/dbraw/zinc/64/90/04/1050649004.db2.gz QYMSBXOVTSADNV-UHFFFAOYSA-N -1 1 313.347 4.456 20 0 DIADMM CC(C)Oc1c(F)cc(Nc2ccnc(Cl)c2[O-])cc1F ZINC001213422058 1050651001 /nfs/dbraw/zinc/65/10/01/1050651001.db2.gz UOSXZJCMNDHDJF-UHFFFAOYSA-N -1 1 314.719 4.250 20 0 DIADMM O=C([O-])c1ccsc1CN1CCC[C@H]1c1ccc(F)cc1F ZINC001144680414 1050653498 /nfs/dbraw/zinc/65/34/98/1050653498.db2.gz NMTYGRPHOKJSMF-AWEZNQCLSA-N -1 1 323.364 4.062 20 0 DIADMM C/C(=C\CN(C)[C@H](C)c1ccc(Cl)cc1Cl)C(=O)[O-] ZINC000846240829 1050700669 /nfs/dbraw/zinc/70/06/69/1050700669.db2.gz ZTUQGCNDAWMVJI-OLKPEBQYSA-N -1 1 302.201 4.017 20 0 DIADMM O=C1c2ccccc2SC/C1=C\c1ccc([O-])c(Cl)c1 ZINC000060132616 1050737177 /nfs/dbraw/zinc/73/71/77/1050737177.db2.gz WAXHMWALEUHACI-YRNVUSSQSA-N -1 1 302.782 4.418 20 0 DIADMM O=c1ccc2cc(Nc3cc(Cl)cc(Cl)c3[O-])ccc2[nH]1 ZINC001213777013 1050738384 /nfs/dbraw/zinc/73/83/84/1050738384.db2.gz GAJUUMKGZKLFSR-UHFFFAOYSA-N -1 1 321.163 4.284 20 0 DIADMM O=C([N-]c1cc(C(F)F)ccc1F)c1ocnc1C(F)(F)F ZINC001144940350 1050755100 /nfs/dbraw/zinc/75/51/00/1050755100.db2.gz NHBYZJLNDXYKRX-UHFFFAOYSA-N -1 1 324.180 4.022 20 0 DIADMM O=C(c1ccc2ccccc2c1[O-])N1CCCC[C@@H]1C1CCC1 ZINC001144953772 1050768881 /nfs/dbraw/zinc/76/88/81/1050768881.db2.gz QZLBEUVMCDIPOY-GOSISDBHSA-N -1 1 309.409 4.340 20 0 DIADMM Cc1ccc(-c2ccc(-n3[n-]c(=O)c4cc(N)ccc43)cc2)cc1 ZINC001213924884 1050782301 /nfs/dbraw/zinc/78/23/01/1050782301.db2.gz VUOKDYAGWNKSDR-UHFFFAOYSA-N -1 1 315.376 4.289 20 0 DIADMM O=c1oc2cc([O-])ccc2cc1Nc1cc(F)c(Cl)cc1F ZINC001213937163 1050784395 /nfs/dbraw/zinc/78/43/95/1050784395.db2.gz DGZGOGZGINZGHC-UHFFFAOYSA-N -1 1 323.682 4.174 20 0 DIADMM [O-]c1cc(Cl)c(Nc2cc(F)c(CO)c(F)c2)cc1Cl ZINC001214034743 1050798873 /nfs/dbraw/zinc/79/88/73/1050798873.db2.gz FDTBNRXDGHPRPU-UHFFFAOYSA-N -1 1 320.122 4.213 20 0 DIADMM C[C@H](C(=O)[N-]OCc1ccccc1)c1ccccc1C(F)(F)F ZINC000742036786 1050800084 /nfs/dbraw/zinc/80/00/84/1050800084.db2.gz PQMWRWXFRCKTFF-LBPRGKRZSA-N -1 1 323.314 4.057 20 0 DIADMM CCN(c1ccccc1)c1ccc(C[N-]C(=O)C(F)(F)F)cc1 ZINC000742118362 1050801530 /nfs/dbraw/zinc/80/15/30/1050801530.db2.gz KGHHUWAGSBACBR-UHFFFAOYSA-N -1 1 322.330 4.023 20 0 DIADMM Cc1ccccc1[C@H](CC(C)C)NC(=O)c1c([O-])cccc1F ZINC001146489227 1050826052 /nfs/dbraw/zinc/82/60/52/1050826052.db2.gz RYTRGESKLQXQOQ-INIZCTEOSA-N -1 1 315.388 4.357 20 0 DIADMM O=C(Nc1c([O-])cccc1F)c1cc2c(cncc2Cl)s1 ZINC001146492903 1050827444 /nfs/dbraw/zinc/82/74/44/1050827444.db2.gz URLQUUFVHJBNMF-UHFFFAOYSA-N -1 1 322.748 4.047 20 0 DIADMM O=C(c1ccc2ccccc2c1[O-])N1CC[C@@H]1c1ccc(F)cc1 ZINC001146530739 1050829222 /nfs/dbraw/zinc/82/92/22/1050829222.db2.gz SZBORHBGPXANGD-GOSISDBHSA-N -1 1 321.351 4.272 20 0 DIADMM O=C([N-]c1ccccc1SC(F)F)c1nc(Cl)cs1 ZINC000789881605 1050890436 /nfs/dbraw/zinc/89/04/36/1050890436.db2.gz RRELECMPDDOKLF-UHFFFAOYSA-N -1 1 320.773 4.364 20 0 DIADMM COCOc1ccc(Cl)cc1Nc1cc(F)c([O-])cc1F ZINC001214426246 1050901906 /nfs/dbraw/zinc/90/19/06/1050901906.db2.gz XYAYTEIUBMXUOG-UHFFFAOYSA-N -1 1 315.703 4.050 20 0 DIADMM CCNc1ccnc(Cl)c1Nc1cc(F)c([O-])c(Cl)c1 ZINC001214482989 1050916913 /nfs/dbraw/zinc/91/69/13/1050916913.db2.gz YCSVCQJXHDJGLO-UHFFFAOYSA-N -1 1 316.163 4.409 20 0 DIADMM [O-]c1c(F)cc(Nc2ncccc2C(F)(F)F)cc1Cl ZINC001214480516 1050916950 /nfs/dbraw/zinc/91/69/50/1050916950.db2.gz UGARASULMBTQBT-UHFFFAOYSA-N -1 1 306.646 4.342 20 0 DIADMM [O-]c1c(F)cc(Nc2cc(-c3ccccc3O)no2)cc1Cl ZINC001214484601 1050917011 /nfs/dbraw/zinc/91/70/11/1050917011.db2.gz NPTWDEYHXJYTNG-UHFFFAOYSA-N -1 1 320.707 4.289 20 0 DIADMM [O-]c1c(F)cc(Nc2ccnn2-c2cccc(F)c2)cc1Cl ZINC001214484134 1050918708 /nfs/dbraw/zinc/91/87/08/1050918708.db2.gz AVQNLJRFZTWKLA-UHFFFAOYSA-N -1 1 321.714 4.253 20 0 DIADMM CC(C)(C)c1nsc(Nc2cc(F)c([O-])c(Cl)c2)n1 ZINC001214479902 1050918894 /nfs/dbraw/zinc/91/88/94/1050918894.db2.gz JIWDBEMDYKIBEE-UHFFFAOYSA-N -1 1 301.774 4.077 20 0 DIADMM [O-]c1c(F)cc(Nc2ccc(OCC3CC3)nc2)cc1Cl ZINC001214486590 1050920749 /nfs/dbraw/zinc/92/07/49/1050920749.db2.gz OJRVJSRTYZUNLX-UHFFFAOYSA-N -1 1 308.740 4.112 20 0 DIADMM O=c1[nH]cc(Nc2cc(F)c([O-])c(Cl)c2)cc1C(F)(F)F ZINC001214485133 1050921101 /nfs/dbraw/zinc/92/11/01/1050921101.db2.gz VEFGQSIFTASZQA-UHFFFAOYSA-N -1 1 322.645 4.048 20 0 DIADMM CP(C)(=O)c1ccccc1Nc1cc(F)c([O-])c(Cl)c1 ZINC001214490041 1050921901 /nfs/dbraw/zinc/92/19/01/1050921901.db2.gz NXZUTAAGZQTJRL-UHFFFAOYSA-N -1 1 313.696 4.176 20 0 DIADMM COC(=O)c1ccc(C)cc1Nc1cc(F)c([O-])c(Cl)c1 ZINC001214490163 1050922824 /nfs/dbraw/zinc/92/28/24/1050922824.db2.gz PBRUSCMAKGKOAH-UHFFFAOYSA-N -1 1 309.724 4.023 20 0 DIADMM [O-]c1c(F)cc(Nc2ccc(Cl)c(CO)c2)cc1Cl ZINC001214491956 1050923112 /nfs/dbraw/zinc/92/31/12/1050923112.db2.gz NGFKQKAXKDXUID-UHFFFAOYSA-N -1 1 302.132 4.074 20 0 DIADMM COc1cc(Nc2cc(F)c([O-])c(Cl)c2)cc(F)c1F ZINC001214493982 1050925062 /nfs/dbraw/zinc/92/50/62/1050925062.db2.gz GSSBWKIHRYYCCC-UHFFFAOYSA-N -1 1 303.667 4.215 20 0 DIADMM CC(C)CCC[C@H](C)N(CCC(C)C)C(=O)c1ccc([O-])cn1 ZINC001148371583 1050936120 /nfs/dbraw/zinc/93/61/20/1050936120.db2.gz NIJLATUALVAXEP-INIZCTEOSA-N -1 1 320.477 4.490 20 0 DIADMM CC(C)CCC[C@@H](C)N(CCC(C)C)C(=O)c1ccc([O-])cn1 ZINC001148371584 1050936857 /nfs/dbraw/zinc/93/68/57/1050936857.db2.gz NIJLATUALVAXEP-MRXNPFEDSA-N -1 1 320.477 4.490 20 0 DIADMM [O-]c1ccc(Cl)c(Nc2cccc(F)c2CO)c1Cl ZINC001214616930 1050963371 /nfs/dbraw/zinc/96/33/71/1050963371.db2.gz VKXBTBUCWUFQPO-UHFFFAOYSA-N -1 1 302.132 4.074 20 0 DIADMM [O-]c1c(Cl)c(Cl)ccc1Nc1cccc(F)c1CO ZINC001214619049 1050964303 /nfs/dbraw/zinc/96/43/03/1050964303.db2.gz LHLOWPORNSRRRW-UHFFFAOYSA-N -1 1 302.132 4.074 20 0 DIADMM Cc1cccc(N)c1NC(=O)c1cccc(-c2ccccc2)c1[O-] ZINC001148869993 1050979195 /nfs/dbraw/zinc/97/91/95/1050979195.db2.gz NQCWMFAMNFWUTN-UHFFFAOYSA-N -1 1 318.376 4.202 20 0 DIADMM O=C(Nc1c([O-])cccc1F)c1ccc2c(c1)-c1ccccc1C2 ZINC000743417406 1051026195 /nfs/dbraw/zinc/02/61/95/1051026195.db2.gz XIWUOBGEDCWZBG-UHFFFAOYSA-N -1 1 319.335 4.355 20 0 DIADMM CC(=O)c1ccc([N-]c2nc3ccc(F)cc3o2)c(F)c1F ZINC001214977059 1051043492 /nfs/dbraw/zinc/04/34/92/1051043492.db2.gz XLVFIFJBIYFDBT-UHFFFAOYSA-N -1 1 306.243 4.191 20 0 DIADMM COc1cccc([O-])c1-c1nc(-c2ccc(Cl)cc2C)no1 ZINC001215322624 1051165369 /nfs/dbraw/zinc/16/53/69/1051165369.db2.gz ZSPBLISFMJNFGF-UHFFFAOYSA-N -1 1 316.744 4.080 20 0 DIADMM [O-]c1ccc(-c2nc(-c3ccc(Cl)cc3)no2)c(Cl)c1 ZINC001215343267 1051171633 /nfs/dbraw/zinc/17/16/33/1051171633.db2.gz QXBGHWQHDUVPHD-UHFFFAOYSA-N -1 1 307.136 4.416 20 0 DIADMM [O-]c1ccc(-c2nc(-c3ccnc4ccccc43)no2)c(Cl)c1 ZINC001215345620 1051172955 /nfs/dbraw/zinc/17/29/55/1051172955.db2.gz AGYASYPCTGLDTO-UHFFFAOYSA-N -1 1 323.739 4.311 20 0 DIADMM [O-]c1ccc(-c2nc(-c3ccccc3Cl)no2)c(Cl)c1 ZINC001215343361 1051173183 /nfs/dbraw/zinc/17/31/83/1051173183.db2.gz UOGNSXUWTUSYBC-UHFFFAOYSA-N -1 1 307.136 4.416 20 0 DIADMM O=C(Cc1ccc(Cl)c(Cl)c1)Nc1cccc(F)c1[O-] ZINC001171632643 1051174307 /nfs/dbraw/zinc/17/43/07/1051174307.db2.gz JITHCVZMEXCJSD-UHFFFAOYSA-N -1 1 314.143 4.019 20 0 DIADMM O=C(Nc1cccc(F)c1[O-])[C@@H]1C[C@H]1c1cccc2ccccc21 ZINC001171632553 1051174966 /nfs/dbraw/zinc/17/49/66/1051174966.db2.gz FSVOFEPDTQRERA-JKSUJKDBSA-N -1 1 321.351 4.427 20 0 DIADMM [O-]c1c(Cl)cc(Cl)cc1Nc1ccc(F)c2n[nH]cc21 ZINC001215377326 1051181797 /nfs/dbraw/zinc/18/17/97/1051181797.db2.gz GIOUKXQKKXXSHZ-UHFFFAOYSA-N -1 1 312.131 4.458 20 0 DIADMM C[C@@H](c1ccccc1F)N(C)C(=O)c1cc(Cl)ccc1[O-] ZINC000063240160 1051188853 /nfs/dbraw/zinc/18/88/53/1051188853.db2.gz ALIXBMFHPIRZCT-JTQLQIEISA-N -1 1 307.752 4.018 20 0 DIADMM CC[C@H](NC(=O)c1ccc([O-])c(F)c1)c1cc(C)ccc1C ZINC001171637537 1051195079 /nfs/dbraw/zinc/19/50/79/1051195079.db2.gz NIWLRLKJGKSCAY-INIZCTEOSA-N -1 1 301.361 4.029 20 0 DIADMM COc1cc(Nc2cc(F)c([O-])cc2F)ccc1C(F)(F)F ZINC001215573125 1051250796 /nfs/dbraw/zinc/25/07/96/1051250796.db2.gz DPMDTLAKHHMJQI-UHFFFAOYSA-N -1 1 319.229 4.441 20 0 DIADMM [O-]c1cc(F)c(Nc2c(F)cccc2N2CCCC2)cc1F ZINC001215576343 1051253325 /nfs/dbraw/zinc/25/33/25/1051253325.db2.gz WKPLTOTUYFRDHB-UHFFFAOYSA-N -1 1 308.303 4.153 20 0 DIADMM COc1ccc(-n2cccc2)c(Nc2cc(F)c([O-])cc2F)c1 ZINC001215573516 1051253401 /nfs/dbraw/zinc/25/34/01/1051253401.db2.gz LPZOPXIXQUYRLX-UHFFFAOYSA-N -1 1 316.307 4.213 20 0 DIADMM Nc1cc(Cl)cc(Cl)c1Nc1cc(F)c([O-])cc1F ZINC001215574438 1051254004 /nfs/dbraw/zinc/25/40/04/1051254004.db2.gz SZZLKNBEHHQQMO-UHFFFAOYSA-N -1 1 305.111 4.303 20 0 DIADMM [O-]c1cc(F)c(Nc2cccc(F)c2N2CCCC2)cc1F ZINC001215575609 1051254283 /nfs/dbraw/zinc/25/42/83/1051254283.db2.gz BGFIEIXIUYHZEW-UHFFFAOYSA-N -1 1 308.303 4.153 20 0 DIADMM O=C(c1ccccc1Nc1cc(F)c([O-])cc1F)C(F)(F)F ZINC001215577300 1051254544 /nfs/dbraw/zinc/25/45/44/1051254544.db2.gz ZBJPYBSKWOUTHH-UHFFFAOYSA-N -1 1 317.213 4.159 20 0 DIADMM [O-]c1c(F)c(F)ccc1Nc1ccc(C(F)(F)F)cc1O ZINC001212633722 1051259350 /nfs/dbraw/zinc/25/93/50/1051259350.db2.gz AGALAHLGEOCGBN-UHFFFAOYSA-N -1 1 305.202 4.138 20 0 DIADMM Cc1ccc(C)c(C(=O)Nc2ccc(Br)c([O-])c2)c1 ZINC001324462758 1051279109 /nfs/dbraw/zinc/27/91/09/1051279109.db2.gz QGKNUMXPJKPRJF-UHFFFAOYSA-N -1 1 320.186 4.024 20 0 DIADMM COc1ccc(Nc2ccc(Cl)c(Cl)c2[O-])c2c[nH]nc21 ZINC001215751924 1051344361 /nfs/dbraw/zinc/34/43/61/1051344361.db2.gz FHFUZCIYPNLOOM-UHFFFAOYSA-N -1 1 324.167 4.328 20 0 DIADMM [O-]c1ccc(F)cc1-c1nc(-c2cc(F)cc(Cl)c2)no1 ZINC001215765553 1051354375 /nfs/dbraw/zinc/35/43/75/1051354375.db2.gz AARPLXDASTYGGF-UHFFFAOYSA-N -1 1 308.671 4.041 20 0 DIADMM Cc1ccc2cccc(-c3noc(-c4cc(F)ccc4[O-])n3)c2n1 ZINC001215769502 1051355597 /nfs/dbraw/zinc/35/55/97/1051355597.db2.gz HVJRBSBJECIYKK-UHFFFAOYSA-N -1 1 321.311 4.105 20 0 DIADMM [O-]c1ccc(F)cc1-c1nc(-c2cccc(F)c2Cl)no1 ZINC001215769966 1051357654 /nfs/dbraw/zinc/35/76/54/1051357654.db2.gz XXMRKBNUGBWFJX-UHFFFAOYSA-N -1 1 308.671 4.041 20 0 DIADMM [O-]c1cc(F)c(Nc2ccc(C3CCOCC3)cc2)cc1F ZINC001212654825 1051359291 /nfs/dbraw/zinc/35/92/91/1051359291.db2.gz AJSCINQXVQIDIJ-UHFFFAOYSA-N -1 1 305.324 4.308 20 0 DIADMM Cc1ccc2cccc(-c3noc(-c4ccc([O-])cc4F)n3)c2n1 ZINC001215826241 1051391055 /nfs/dbraw/zinc/39/10/55/1051391055.db2.gz HVACQPWZUPDMPT-UHFFFAOYSA-N -1 1 321.311 4.105 20 0 DIADMM Cc1cc(-c2noc(-c3ccc([O-])cc3F)n2)ccc1Cl ZINC001215826956 1051392446 /nfs/dbraw/zinc/39/24/46/1051392446.db2.gz ZDZMMMPAEBSDKA-UHFFFAOYSA-N -1 1 304.708 4.210 20 0 DIADMM Cc1ccc(-c2noc(-c3ccc([O-])cc3F)n2)cc1Cl ZINC001215826905 1051392793 /nfs/dbraw/zinc/39/27/93/1051392793.db2.gz XDXLTKGYKSIACC-UHFFFAOYSA-N -1 1 304.708 4.210 20 0 DIADMM CC(C)(C)C(=O)Nc1ccccc1Nc1ccc(F)c(F)c1[O-] ZINC001215836433 1051400626 /nfs/dbraw/zinc/40/06/26/1051400626.db2.gz NWXXTGYRLAEKGI-UHFFFAOYSA-N -1 1 320.339 4.399 20 0 DIADMM [O-]c1cc(-c2nc(-c3ccc(F)c(Cl)c3)no2)ccc1F ZINC001215838583 1051402920 /nfs/dbraw/zinc/40/29/20/1051402920.db2.gz GRGQWRSEQKMYJD-UHFFFAOYSA-N -1 1 308.671 4.041 20 0 DIADMM Cc1c(Cl)cccc1-c1noc(-c2ccc(F)c([O-])c2)n1 ZINC001215838489 1051403332 /nfs/dbraw/zinc/40/33/32/1051403332.db2.gz FITSFTYJHSORSM-UHFFFAOYSA-N -1 1 304.708 4.210 20 0 DIADMM Cc1ccc2cccc(-c3noc(-c4ccc(F)c([O-])c4)n3)c2n1 ZINC001215842744 1051407455 /nfs/dbraw/zinc/40/74/55/1051407455.db2.gz SOVRLKYTCSVSRF-UHFFFAOYSA-N -1 1 321.311 4.105 20 0 DIADMM [O-]c1ccc(-c2cc(OC(F)F)ccn2)cc1C(F)(F)F ZINC001242151227 1051416704 /nfs/dbraw/zinc/41/67/04/1051416704.db2.gz HVLVAPKCCKQBCC-UHFFFAOYSA-N -1 1 305.202 4.074 20 0 DIADMM [O-]c1cc(Nc2cc(Cl)cc3n[nH]cc32)c(F)cc1Cl ZINC001215858681 1051418302 /nfs/dbraw/zinc/41/83/02/1051418302.db2.gz CEKNXSCJPDZNJJ-UHFFFAOYSA-N -1 1 312.131 4.458 20 0 DIADMM CSc1c(F)cc(Nc2ccnc(Cl)c2[O-])cc1F ZINC001215924359 1051459934 /nfs/dbraw/zinc/45/99/34/1051459934.db2.gz HLZRLQZSPJTSBB-UHFFFAOYSA-N -1 1 302.733 4.184 20 0 DIADMM CSc1c(F)cc(Nc2cc(F)c([O-])cc2F)cc1F ZINC001215926060 1051461295 /nfs/dbraw/zinc/46/12/95/1051461295.db2.gz GCXIHYRSUPAFTM-UHFFFAOYSA-N -1 1 303.280 4.414 20 0 DIADMM [O-]c1cc(Nc2ccc(Cl)c3n[nH]cc32)c(F)cc1Cl ZINC001215942732 1051472060 /nfs/dbraw/zinc/47/20/60/1051472060.db2.gz AXTQIKGGPFVQPO-UHFFFAOYSA-N -1 1 312.131 4.458 20 0 DIADMM COCc1cc(OC)ccc1Nc1cc([O-])c(Cl)cc1F ZINC001215979459 1051499839 /nfs/dbraw/zinc/49/98/39/1051499839.db2.gz PUNDMZSJLBOFMM-UHFFFAOYSA-N -1 1 311.740 4.083 20 0 DIADMM [O-]c1cccc(-c2nc(-c3cc(Cl)ccc3F)no2)c1F ZINC001215984243 1051502001 /nfs/dbraw/zinc/50/20/01/1051502001.db2.gz MNHZNYCKAXYDIA-UHFFFAOYSA-N -1 1 308.671 4.041 20 0 DIADMM Cc1cc(Cl)ccc1-c1noc(-c2cccc([O-])c2F)n1 ZINC001215984065 1051502527 /nfs/dbraw/zinc/50/25/27/1051502527.db2.gz IRIBQIWGVDWPTG-UHFFFAOYSA-N -1 1 304.708 4.210 20 0 DIADMM Cc1ccc(-c2ccccc2)cc1-n1[n-]c(=O)c2cc(N)ccc21 ZINC001215988456 1051505040 /nfs/dbraw/zinc/50/50/40/1051505040.db2.gz WKMZIAAGCZRTDT-UHFFFAOYSA-N -1 1 315.376 4.289 20 0 DIADMM COc1c(Cl)ccc(Nc2ccc(F)c(F)c2[O-])c1F ZINC001212587406 1051566015 /nfs/dbraw/zinc/56/60/15/1051566015.db2.gz SCQPOJLPCISVFE-UHFFFAOYSA-N -1 1 303.667 4.215 20 0 DIADMM C[C@@H]([N-]C(=O)C(F)(F)c1ccc(C(C)(C)C)cc1)C(F)(F)F ZINC001129968671 1051579592 /nfs/dbraw/zinc/57/95/92/1051579592.db2.gz HMEJBRRVCKRLAV-SECBINFHSA-N -1 1 323.305 4.143 20 0 DIADMM CC(=O)c1oc2cccnc2c1Nc1ccc(Cl)c([O-])c1 ZINC001212590668 1051630613 /nfs/dbraw/zinc/63/06/13/1051630613.db2.gz XTKRVUMOBOVNCZ-UHFFFAOYSA-N -1 1 302.717 4.133 20 0 DIADMM COc1cc(Nc2c([O-])cc(F)cc2F)ccc1OC(C)C ZINC001216249519 1051657178 /nfs/dbraw/zinc/65/71/78/1051657178.db2.gz JIDBNZREYLYVHP-UHFFFAOYSA-N -1 1 309.312 4.210 20 0 DIADMM COc1cc(C(C)=O)c(Nc2ccc(Cl)c([O-])c2)cc1F ZINC001212594904 1051700650 /nfs/dbraw/zinc/70/06/50/1051700650.db2.gz CLRMBBMNSPTSCJ-UHFFFAOYSA-N -1 1 309.724 4.140 20 0 DIADMM Cc1c(F)ccc(-c2noc(-c3cc([O-])cc(F)c3)n2)c1Cl ZINC001216340399 1051708299 /nfs/dbraw/zinc/70/82/99/1051708299.db2.gz XRRCFXUOMPFOGG-UHFFFAOYSA-N -1 1 322.698 4.349 20 0 DIADMM COc1c(O)cccc1Nc1cc(Cl)cc(Cl)c1[O-] ZINC001216350751 1051714390 /nfs/dbraw/zinc/71/43/90/1051714390.db2.gz XKUMCPHKDRWJKB-UHFFFAOYSA-N -1 1 300.141 4.157 20 0 DIADMM O=c1oc2cc([O-])ccc2cc1Nc1cc(F)c(F)cc1Cl ZINC001216369787 1051727767 /nfs/dbraw/zinc/72/77/67/1051727767.db2.gz UGUVXLSILUBJAE-UHFFFAOYSA-N -1 1 323.682 4.174 20 0 DIADMM COc1cnc(F)c(Nc2cc(Cl)c(C)c(Cl)c2[O-])c1 ZINC001216412495 1051754268 /nfs/dbraw/zinc/75/42/68/1051754268.db2.gz VREPHIGYLJSVOA-UHFFFAOYSA-N -1 1 317.147 4.294 20 0 DIADMM O=c1oc2cc([O-])ccc2cc1Nc1cc(F)ccc1Cl ZINC001216477937 1051781735 /nfs/dbraw/zinc/78/17/35/1051781735.db2.gz IJIOELZJVKRFIN-UHFFFAOYSA-N -1 1 305.692 4.035 20 0 DIADMM C[C@H]1CCN(C(=O)c2ccc([O-])c(F)c2)c2ccccc2S1 ZINC000767292303 1051785195 /nfs/dbraw/zinc/78/51/95/1051785195.db2.gz IFFHBSCJTFCFND-NSHDSACASA-N -1 1 317.385 4.062 20 0 DIADMM CC(=O)c1cccc(Nc2nc3c(cccc3[O-])s2)c1F ZINC001216496456 1051792356 /nfs/dbraw/zinc/79/23/56/1051792356.db2.gz SRIHOXZNRRGUQU-UHFFFAOYSA-N -1 1 302.330 4.087 20 0 DIADMM COc1c(F)cc(SC)cc1Nc1ccnc(Cl)c1[O-] ZINC001216581576 1051825234 /nfs/dbraw/zinc/82/52/34/1051825234.db2.gz KJIPGXJMFMGXOT-UHFFFAOYSA-N -1 1 314.769 4.054 20 0 DIADMM CC(C)Oc1ncc(Nc2c(Cl)ccc([O-])c2Cl)cn1 ZINC001216620910 1051840988 /nfs/dbraw/zinc/84/09/88/1051840988.db2.gz AVFOOBAMFLCTAK-UHFFFAOYSA-N -1 1 314.172 4.020 20 0 DIADMM COC(=O)c1cnc(SC(c2ccccc2)c2ccccc2)[n-]1 ZINC000187587360 1051850481 /nfs/dbraw/zinc/85/04/81/1051850481.db2.gz WNPNELSJFFDFQE-UHFFFAOYSA-N -1 1 324.405 4.078 20 0 DIADMM COC(=O)c1c[n-]c(SC(c2ccccc2)c2ccccc2)n1 ZINC000187587360 1051850489 /nfs/dbraw/zinc/85/04/89/1051850489.db2.gz WNPNELSJFFDFQE-UHFFFAOYSA-N -1 1 324.405 4.078 20 0 DIADMM COc1ccccc1Nc1ccc(F)c(Br)c1[O-] ZINC001173839991 1051854441 /nfs/dbraw/zinc/85/44/41/1051854441.db2.gz JTQKCOWKFJURGZ-UHFFFAOYSA-N -1 1 312.138 4.046 20 0 DIADMM COc1ccc(Nc2ccc(Cl)c(Cl)c2[O-])c(OC)c1 ZINC001173892164 1051857443 /nfs/dbraw/zinc/85/74/43/1051857443.db2.gz PDUCJQNMYSFKCQ-UHFFFAOYSA-N -1 1 314.168 4.460 20 0 DIADMM COc1ccc(OC)c(Nc2c(Cl)ccc([O-])c2Cl)c1 ZINC001173919861 1051877885 /nfs/dbraw/zinc/87/78/85/1051877885.db2.gz TXYYBZFHMDMOFI-UHFFFAOYSA-N -1 1 314.168 4.460 20 0 DIADMM COc1cccc(OC)c1Nc1cc(Cl)cc(Cl)c1[O-] ZINC001173924194 1051881247 /nfs/dbraw/zinc/88/12/47/1051881247.db2.gz IMYXIYPBQQCBDH-UHFFFAOYSA-N -1 1 314.168 4.460 20 0 DIADMM [O-]c1ccc(C(F)(F)F)cc1-c1nc(-c2cccc(F)c2)no1 ZINC001216831663 1051889806 /nfs/dbraw/zinc/88/98/06/1051889806.db2.gz WQVXZLRQLBIFMZ-UHFFFAOYSA-N -1 1 324.233 4.267 20 0 DIADMM O=C(Nc1ccc(F)cc1[O-])c1cc2c(cccc2F)s1 ZINC000768257076 1051908768 /nfs/dbraw/zinc/90/87/68/1051908768.db2.gz DBACZOLUQUAMPO-UHFFFAOYSA-N -1 1 305.305 4.137 20 0 DIADMM Cc1ccc(Cl)cc1-c1noc(-c2c(F)ccc([O-])c2F)n1 ZINC001216921898 1051908789 /nfs/dbraw/zinc/90/87/89/1051908789.db2.gz DDTOBEHBGAWTDC-UHFFFAOYSA-N -1 1 322.698 4.349 20 0 DIADMM CCc1cc(-c2noc(-c3c(F)ccc([O-])c3F)n2)ccc1F ZINC001216920085 1051908816 /nfs/dbraw/zinc/90/88/16/1051908816.db2.gz GNQIALZMAZYQND-UHFFFAOYSA-N -1 1 320.270 4.089 20 0 DIADMM Cc1ccc(-c2noc(-c3c(F)ccc([O-])c3F)n2)c(Cl)c1 ZINC001216922155 1051909297 /nfs/dbraw/zinc/90/92/97/1051909297.db2.gz LCKZJMSFPVINCK-UHFFFAOYSA-N -1 1 322.698 4.349 20 0 DIADMM CCc1cc(-c2noc(-c3cc([O-])cc(F)c3F)n2)ccc1F ZINC001216924907 1051910942 /nfs/dbraw/zinc/91/09/42/1051910942.db2.gz ZBTPXEIHDCBTRY-UHFFFAOYSA-N -1 1 320.270 4.089 20 0 DIADMM Cc1ccc(-c2noc(-c3c(F)ccc([O-])c3F)n2)cc1C ZINC001216923298 1051910981 /nfs/dbraw/zinc/91/09/81/1051910981.db2.gz YTKDUJLZDMYTSZ-UHFFFAOYSA-N -1 1 302.280 4.004 20 0 DIADMM O=C(Nc1ccc([O-])c(Cl)c1)Nc1cccc2[nH]ccc21 ZINC000190957294 1051954120 /nfs/dbraw/zinc/95/41/20/1051954120.db2.gz BGZXJUSSHNQKSO-UHFFFAOYSA-N -1 1 301.733 4.171 20 0 DIADMM [O-]c1c(-c2nc(-c3ccc(Cl)cc3)no2)ccc2cccnc21 ZINC001217141322 1051976049 /nfs/dbraw/zinc/97/60/49/1051976049.db2.gz CBMJGZQFCYZWKW-UHFFFAOYSA-N -1 1 323.739 4.311 20 0 DIADMM CC/C=C(/C)C(=O)Nc1c([O-])cc(Br)cc1Cl ZINC000808113083 1051978549 /nfs/dbraw/zinc/97/85/49/1051978549.db2.gz WOSWCZAYLLPZLC-DAXSKMNVSA-N -1 1 318.598 4.103 20 0 DIADMM CCOCc1cccc(NC(=O)Nc2ccc([O-])c(Cl)c2)c1 ZINC000192211479 1052005934 /nfs/dbraw/zinc/00/59/34/1052005934.db2.gz NMZKQHQXVHMCHC-UHFFFAOYSA-N -1 1 320.776 4.226 20 0 DIADMM O=C(Nc1cccc(OCCF)c1)Nc1ccc([O-])c(Cl)c1 ZINC000192235844 1052007620 /nfs/dbraw/zinc/00/76/20/1052007620.db2.gz UNALYHZOHNCVNB-UHFFFAOYSA-N -1 1 324.739 4.038 20 0 DIADMM O=S(=O)([N-]c1cccc(C(F)F)c1)c1cccc(Cl)c1 ZINC000195451889 1052053919 /nfs/dbraw/zinc/05/39/19/1052053919.db2.gz ZAJZOTQVROOJIO-UHFFFAOYSA-N -1 1 317.744 4.078 20 0 DIADMM Cc1ccc(CN(C(=O)c2c([O-])cccc2Cl)C(C)C)s1 ZINC000769732876 1052092769 /nfs/dbraw/zinc/09/27/69/1052092769.db2.gz RMBBZFALQGNPAN-UHFFFAOYSA-N -1 1 323.845 4.466 20 0 DIADMM C[C@@H]1CCN(C(=O)c2c([O-])cccc2Cl)[C@@H]2CCCC[C@H]12 ZINC000769690951 1052093081 /nfs/dbraw/zinc/09/30/81/1052093081.db2.gz ZXHZQBKQHWTJNY-YRGRVCCFSA-N -1 1 307.821 4.086 20 0 DIADMM CC[C@@H]1c2ccsc2CCN1C(=O)c1c([O-])cccc1Cl ZINC000769694979 1052093524 /nfs/dbraw/zinc/09/35/24/1052093524.db2.gz VQTHKKZNGWRLGR-GFCCVEGCSA-N -1 1 321.829 4.257 20 0 DIADMM CC(C)N(Cc1cccc(F)c1)C(=O)c1c([O-])cccc1Cl ZINC000769719039 1052097096 /nfs/dbraw/zinc/09/70/96/1052097096.db2.gz CDBSAPLYLIKRPE-UHFFFAOYSA-N -1 1 321.779 4.236 20 0 DIADMM Cn1cnc2ccc(Nc3cc(Cl)c([O-])cc3Cl)cc21 ZINC001174348582 1052114030 /nfs/dbraw/zinc/11/40/30/1052114030.db2.gz GDHUVPZYRYGRLS-UHFFFAOYSA-N -1 1 308.168 4.329 20 0 DIADMM CC[C@H](Cc1ccccc1)N(C)C(=O)c1c([O-])cccc1Cl ZINC000769920239 1052123151 /nfs/dbraw/zinc/12/31/51/1052123151.db2.gz HLVJLFMSSIHRDC-CQSZACIVSA-N -1 1 317.816 4.139 20 0 DIADMM CC(C)n1cnc2cc(Nc3c([O-])cc(F)cc3F)ccc21 ZINC001174381528 1052141035 /nfs/dbraw/zinc/14/10/35/1052141035.db2.gz MODJIXZKMJBIRR-UHFFFAOYSA-N -1 1 303.312 4.345 20 0 DIADMM CC(C)n1cnc2cc(Nc3ccnc(Cl)c3[O-])ccc21 ZINC001174382174 1052141077 /nfs/dbraw/zinc/14/10/77/1052141077.db2.gz CEYFDVWMPLMEAI-UHFFFAOYSA-N -1 1 302.765 4.115 20 0 DIADMM Cc1cc(-c2ccccc2)ccc1NC(=O)c1ccc(O)cc1[O-] ZINC000914733583 1052231813 /nfs/dbraw/zinc/23/18/13/1052231813.db2.gz QUFPIHFZGBNGCP-UHFFFAOYSA-N -1 1 319.360 4.326 20 0 DIADMM O=C(Nc1ccc(-c2ccccc2)cc1F)c1ccc(O)cc1[O-] ZINC000914733986 1052232249 /nfs/dbraw/zinc/23/22/49/1052232249.db2.gz BWCXTOHSGCJOAP-UHFFFAOYSA-N -1 1 323.323 4.156 20 0 DIADMM O=C(Nc1cccc(C(F)(F)F)c1[O-])c1cc2ccccc2[nH]1 ZINC001219313388 1052282550 /nfs/dbraw/zinc/28/25/50/1052282550.db2.gz URMFXPAEMHOXLM-UHFFFAOYSA-N -1 1 320.270 4.145 20 0 DIADMM Cc1cc(S(=O)(=O)[N-]c2cccc(C(C)C)c2)ccc1F ZINC000303325294 1052322426 /nfs/dbraw/zinc/32/24/26/1052322426.db2.gz VSHFKCFGQYFSAW-UHFFFAOYSA-N -1 1 307.390 4.058 20 0 DIADMM CCCCC[C@H](C)NC(=O)c1cc(Cl)c([O-])c(OCC)c1 ZINC000762576163 1052401379 /nfs/dbraw/zinc/40/13/79/1052401379.db2.gz CQJLSNIYLBGXCL-NSHDSACASA-N -1 1 313.825 4.143 20 0 DIADMM CCCC[C@H]1CCC[C@@H]1NC(=O)NCc1ccc([O-])c(Cl)c1 ZINC001221757816 1052412097 /nfs/dbraw/zinc/41/20/97/1052412097.db2.gz UBQDPVRTAKMHMF-ZFWWWQNUSA-N -1 1 324.852 4.204 20 0 DIADMM COC(=O)c1cccc2cc(-c3cc(F)c([O-])cc3F)ccc21 ZINC001222086023 1052440783 /nfs/dbraw/zinc/44/07/83/1052440783.db2.gz GNBOXAMHEAWKIJ-UHFFFAOYSA-N -1 1 314.287 4.277 20 0 DIADMM O=C(Nc1ccc(SC2CCCC2)cc1)c1cncc([O-])c1 ZINC000316169704 1052457148 /nfs/dbraw/zinc/45/71/48/1052457148.db2.gz YKLFQMJBIATQDO-UHFFFAOYSA-N -1 1 314.410 4.074 20 0 DIADMM Cc1cc(-c2noc(-c3cc(F)ccc3[O-])n2)nc2ccccc12 ZINC000325962568 1052505077 /nfs/dbraw/zinc/50/50/77/1052505077.db2.gz RSCHAJWJWINCQG-UHFFFAOYSA-N -1 1 321.311 4.105 20 0 DIADMM CCc1cccc(C)c1[N-]S(=O)(=O)c1cc(C)sc1C ZINC000032531878 1052561934 /nfs/dbraw/zinc/56/19/34/1052561934.db2.gz OKBRYCXDZCKBFK-UHFFFAOYSA-N -1 1 309.456 4.037 20 0 DIADMM O=C(Nc1cccc(NCc2cccc([O-])c2Cl)c1)C1CC1 ZINC000328399906 1052622134 /nfs/dbraw/zinc/62/21/34/1052622134.db2.gz VWAPEQCVZMJKBG-UHFFFAOYSA-N -1 1 316.788 4.006 20 0 DIADMM C[C@H](OC1CCCCCC1)C(=O)Nc1ccc([O-])c(Cl)c1 ZINC000125214061 1052647324 /nfs/dbraw/zinc/64/73/24/1052647324.db2.gz YGVQIPLDJHKUKW-NSHDSACASA-N -1 1 311.809 4.112 20 0 DIADMM CC(C)Oc1cc(F)c(F)cc1[N-]c1noc(C(C)(C)C)n1 ZINC001212221033 1052691200 /nfs/dbraw/zinc/69/12/00/1052691200.db2.gz ZNYSGIYCHZTUFA-UHFFFAOYSA-N -1 1 311.332 4.176 20 0 DIADMM CC(C)Oc1cc(F)c(F)cc1Nc1ccnc(Cl)c1[O-] ZINC001212225206 1052707603 /nfs/dbraw/zinc/70/76/03/1052707603.db2.gz PBRSBRRROVERJA-UHFFFAOYSA-N -1 1 314.719 4.250 20 0 DIADMM CC[C@@H](c1ccncc1)N(C)C(=O)c1cc2ccccc2cc1[O-] ZINC000128207741 1052712762 /nfs/dbraw/zinc/71/27/62/1052712762.db2.gz VFLOHMONWUGYGC-SFHVURJKSA-N -1 1 320.392 4.164 20 0 DIADMM CCCCc1oc2ccccc2c1C=C1SC(=O)[N-]C1=O ZINC000917359759 1052723527 /nfs/dbraw/zinc/72/35/27/1052723527.db2.gz RFFMYMCMUXCEFC-NTEUORMPSA-N -1 1 301.367 4.099 20 0 DIADMM CC(C)Oc1cc(F)c(F)cc1Nc1cc(F)c([O-])c(F)c1 ZINC001212227388 1052726656 /nfs/dbraw/zinc/72/66/56/1052726656.db2.gz HSUQCAQPGMDIJL-UHFFFAOYSA-N -1 1 315.266 4.479 20 0 DIADMM Cc1ccc(N(C)C(=O)c2ccc3ccccc3c2[O-])cc1C ZINC000917807596 1052757590 /nfs/dbraw/zinc/75/75/90/1052757590.db2.gz SEIWMDHCMAMAJU-UHFFFAOYSA-N -1 1 305.377 4.439 20 0 DIADMM CC(=O)c1ccc([O-])cc1O[C@H](C)c1cc(-c2ccccc2)no1 ZINC001225618629 1052808950 /nfs/dbraw/zinc/80/89/50/1052808950.db2.gz GOPHAJXNVIJKBJ-CYBMUJFWSA-N -1 1 323.348 4.390 20 0 DIADMM COc1ccc([C@@H](Oc2cc([O-])ccc2C(C)=O)C(C)C)cc1 ZINC001225619284 1052809215 /nfs/dbraw/zinc/80/92/15/1052809215.db2.gz RJVAAEDFMAUGIW-IBGZPJMESA-N -1 1 314.381 4.380 20 0 DIADMM CC(=O)c1c(O)cc([O-])cc1O[C@@H](C)c1csc(Cl)c1 ZINC001225679665 1052815802 /nfs/dbraw/zinc/81/58/02/1052815802.db2.gz QWRQPLRSNXGMNX-QMMMGPOBSA-N -1 1 312.774 4.155 20 0 DIADMM CC[C@H](Oc1cc([O-])cc(O)c1C(C)=O)c1cccc(F)c1C ZINC001225678526 1052815824 /nfs/dbraw/zinc/81/58/24/1052815824.db2.gz IHPSUCKNJJHGMB-INIZCTEOSA-N -1 1 318.344 4.278 20 0 DIADMM CC(=O)c1c(O)cc([O-])cc1O[C@H](C)c1cc(Cl)ccc1C ZINC001225680009 1052815846 /nfs/dbraw/zinc/81/58/46/1052815846.db2.gz UQRNIKMRBVJVLI-LLVKDONJSA-N -1 1 320.772 4.402 20 0 DIADMM CC(=O)c1c(O)cc([O-])cc1O[C@H]1CCc2cc(Cl)ccc21 ZINC001225679746 1052815948 /nfs/dbraw/zinc/81/59/48/1052815948.db2.gz RZZVGBQPFOVEDE-HNNXBMFYSA-N -1 1 318.756 4.020 20 0 DIADMM O=C(Nc1ccc([O-])c(Cl)c1)C12CC3CC(CC(C3)C1)C2 ZINC000070333846 1052818673 /nfs/dbraw/zinc/81/86/73/1052818673.db2.gz NDZKIGMDHAZIEG-UHFFFAOYSA-N -1 1 305.805 4.201 20 0 DIADMM C[C@H](Oc1ccc(C(=O)c2ccc([O-])cc2)cc1)c1cccnc1 ZINC001225810787 1052833490 /nfs/dbraw/zinc/83/34/90/1052833490.db2.gz QBINUFNFAFGXIK-AWEZNQCLSA-N -1 1 319.360 4.158 20 0 DIADMM Cc1cccc2c1[C@H](Oc1cc([O-])cc3oc(=O)cc(C)c13)CC2 ZINC001226489552 1052902457 /nfs/dbraw/zinc/90/24/57/1052902457.db2.gz MDXYHPOPAXJXHH-OAHLLOKOSA-N -1 1 322.360 4.182 20 0 DIADMM Cc1cc(=O)oc2cc([O-])cc(O[C@@H](c3ccccc3)C3CC3)c12 ZINC001226490134 1052902930 /nfs/dbraw/zinc/90/29/30/1052902930.db2.gz NFAFRXGGBBDFKS-FQEVSTJZSA-N -1 1 322.360 4.337 20 0 DIADMM Cc1ccc([C@H](C)NC(=O)c2c([O-])cccc2Cl)c(C)c1 ZINC000920444824 1052939277 /nfs/dbraw/zinc/93/92/77/1052939277.db2.gz LROACRWAQGICJZ-LBPRGKRZSA-N -1 1 303.789 4.153 20 0 DIADMM Cc1ccc([C@@H](C)NC(=O)c2c([O-])cccc2Cl)cc1C ZINC000920445090 1052939524 /nfs/dbraw/zinc/93/95/24/1052939524.db2.gz LJCIXUBMGDOXGD-GFCCVEGCSA-N -1 1 303.789 4.153 20 0 DIADMM CC(C)[C@@H](CNC(=O)c1c([O-])cccc1Cl)c1ccccc1 ZINC000920447458 1052939987 /nfs/dbraw/zinc/93/99/87/1052939987.db2.gz IRIHSPILVHLPKL-CQSZACIVSA-N -1 1 317.816 4.215 20 0 DIADMM O=C(N[C@@H]1CCc2cc(Cl)ccc21)c1c([O-])cccc1Cl ZINC000920463470 1052940831 /nfs/dbraw/zinc/94/08/31/1052940831.db2.gz PXRNLBPVGIXAKK-CYBMUJFWSA-N -1 1 322.191 4.116 20 0 DIADMM [O-]c1ccc(-c2nc(-c3ccc4ccccc4c3)no2)c(F)c1 ZINC000322771430 1052951979 /nfs/dbraw/zinc/95/19/79/1052951979.db2.gz FXHZEFCCHNFKGF-UHFFFAOYSA-N -1 1 306.296 4.402 20 0 DIADMM CC(=O)c1ccc(C)cc1OC(=C([O-])c1ccco1)c1ccco1 ZINC001227115420 1052962354 /nfs/dbraw/zinc/96/23/54/1052962354.db2.gz URVAXAJWTXNFKG-LJQANCHMSA-N -1 1 324.332 4.387 20 0 DIADMM COCC(=O)c1ccc([O-])cc1O[C@@H](C)c1ccc(Cl)cc1 ZINC001227169028 1052967256 /nfs/dbraw/zinc/96/72/56/1052967256.db2.gz OWJMIEVIKDRVRZ-NSHDSACASA-N -1 1 320.772 4.015 20 0 DIADMM CCC[C@@H](Oc1cc([O-])ccc1C(=O)COC)c1ccccc1 ZINC001227172555 1052967850 /nfs/dbraw/zinc/96/78/50/1052967850.db2.gz PEULXADTXQEOER-GOSISDBHSA-N -1 1 314.381 4.142 20 0 DIADMM O=C([N-]c1c(F)cc(Cl)cc1F)c1ccc(C(F)F)o1 ZINC001127557411 1052978145 /nfs/dbraw/zinc/97/81/45/1052978145.db2.gz NWZAWYWFQFGCMT-UHFFFAOYSA-N -1 1 307.630 4.401 20 0 DIADMM C[C@H](Oc1[n-]c(=S)ncc1F)c1ccc(Cl)cc1Cl ZINC001227382174 1052987200 /nfs/dbraw/zinc/98/72/00/1052987200.db2.gz AZWDUIBLMQSELE-LURJTMIESA-N -1 1 319.188 4.351 20 0 DIADMM COc1ccc([C@H](C)Oc2cc(Cl)c([O-])cc2Cl)cn1 ZINC001227642466 1053005940 /nfs/dbraw/zinc/00/59/40/1053005940.db2.gz ZLZDPOBHSFQJPI-QMMMGPOBSA-N -1 1 314.168 4.243 20 0 DIADMM O=C(c1ccccc1)c1ccc([O-])cc1O[C@H]1CCCC[C@@H]1F ZINC001228185747 1053051221 /nfs/dbraw/zinc/05/12/21/1053051221.db2.gz LEZCSJRGNWBSAB-IRXDYDNUSA-N -1 1 314.356 4.283 20 0 DIADMM O=C(c1ccccc1)c1ccc([O-])cc1O[C@@H]1CCCC[C@H]1F ZINC001228185746 1053051300 /nfs/dbraw/zinc/05/13/00/1053051300.db2.gz LEZCSJRGNWBSAB-IAGOWNOFSA-N -1 1 314.356 4.283 20 0 DIADMM COC1=CC[C@H](Oc2cc([O-])ccc2C(=O)c2ccccc2)CC1 ZINC001228185046 1053051377 /nfs/dbraw/zinc/05/13/77/1053051377.db2.gz CEDGLBZTHLNKKI-KRWDZBQOSA-N -1 1 324.376 4.085 20 0 DIADMM CC(C)CC[C@H]1CCCN1C(=O)NCc1ccc([O-])c(Cl)c1 ZINC001313235872 1053097194 /nfs/dbraw/zinc/09/71/94/1053097194.db2.gz DZXYTPWTGSCGSZ-CQSZACIVSA-N -1 1 324.852 4.156 20 0 DIADMM CCc1nc(SCCSCc2ccccc2)[n-]c(=O)c1C ZINC000849921939 1053117214 /nfs/dbraw/zinc/11/72/14/1053117214.db2.gz RYYYXGVUQCOLJT-UHFFFAOYSA-N -1 1 320.483 4.079 20 0 DIADMM CCC(=O)c1c(O)cc([O-])cc1O[C@H]1CCc2c1cccc2C ZINC001228560157 1053134438 /nfs/dbraw/zinc/13/44/38/1053134438.db2.gz KMIITZFMMRBYPC-KRWDZBQOSA-N -1 1 312.365 4.065 20 0 DIADMM Cc1noc(C)c1[N-]C(=O)c1nc(-c2ccccc2)oc1C1CC1 ZINC001318093221 1053150381 /nfs/dbraw/zinc/15/03/81/1053150381.db2.gz KFYGVFCJXLUACP-UHFFFAOYSA-N -1 1 323.352 4.076 20 0 DIADMM C[C@H](Oc1[n-]c(=S)nc2ccccc21)c1ccc(F)c(F)c1 ZINC001228764167 1053177897 /nfs/dbraw/zinc/17/78/97/1053177897.db2.gz GSGCAHHLECRBON-VIFPVBQESA-N -1 1 318.348 4.337 20 0 DIADMM Fc1ccc2c(c1)CC[C@H]2Oc1[n-]c(=S)nc2ccccc21 ZINC001228767434 1053180018 /nfs/dbraw/zinc/18/00/18/1053180018.db2.gz ZNPJMLWETLBNOA-OAHLLOKOSA-N -1 1 312.369 4.124 20 0 DIADMM Cc1ccccc1C(F)(F)C(=O)[N-][C@H](C(C)(C)C)C(F)(F)F ZINC001319607074 1053256304 /nfs/dbraw/zinc/25/63/04/1053256304.db2.gz MVKWZZCJCZOZNH-LLVKDONJSA-N -1 1 323.305 4.180 20 0 DIADMM C[C@H](C(=O)Nc1ccc([O-])c(Cl)c1)c1ccc(F)cc1F ZINC001319949821 1053287797 /nfs/dbraw/zinc/28/77/97/1053287797.db2.gz MWIVDWDNPCGHCJ-QMMMGPOBSA-N -1 1 311.715 4.066 20 0 DIADMM C[C@H](Oc1cc([O-])c(Cl)cc1Cl)c1ncccc1F ZINC001229406136 1053315036 /nfs/dbraw/zinc/31/50/36/1053315036.db2.gz LDVSOWJGPHQVHS-ZETCQYMHSA-N -1 1 302.132 4.373 20 0 DIADMM C[C@@H](Oc1cc([O-])c(Cl)cc1Cl)c1cnc2ccccn21 ZINC001229409136 1053316613 /nfs/dbraw/zinc/31/66/13/1053316613.db2.gz CYABKMRQZAHAOJ-SECBINFHSA-N -1 1 323.179 4.487 20 0 DIADMM CCC[C@@H](CC(=O)OCC)Oc1cc([O-])c(Cl)cc1Cl ZINC001229411585 1053316758 /nfs/dbraw/zinc/31/67/58/1053316758.db2.gz TUSABUCCJURWMB-VIFPVBQESA-N -1 1 321.200 4.200 20 0 DIADMM CCC(=O)c1ccc([O-])cc1O[C@@H]1CCC(=O)c2ccccc21 ZINC001229474970 1053330315 /nfs/dbraw/zinc/33/03/15/1053330315.db2.gz NVMNDAQOFFQSHU-GOSISDBHSA-N -1 1 310.349 4.082 20 0 DIADMM CCC(=O)c1ccc([O-])cc1O[C@H]1CCc2c1nccc2Cl ZINC001229474906 1053331059 /nfs/dbraw/zinc/33/10/59/1053331059.db2.gz MQGZAKYEGYLPOO-HNNXBMFYSA-N -1 1 317.772 4.100 20 0 DIADMM CCC(=O)c1ccc([O-])cc1O[C@@H](C)c1ccccc1OC ZINC001229475330 1053331114 /nfs/dbraw/zinc/33/11/14/1053331114.db2.gz UUGVQGHUCFILAH-LBPRGKRZSA-N -1 1 300.354 4.134 20 0 DIADMM CCc1ccccc1S(=O)(=O)[N-]c1c(C)cc(Cl)cc1C ZINC001320445410 1053334388 /nfs/dbraw/zinc/33/43/88/1053334388.db2.gz JZMQQNQVKHHODI-UHFFFAOYSA-N -1 1 323.845 4.320 20 0 DIADMM CSc1cc(C)ccc1CNC(=O)c1ccc(Cl)cc1[O-] ZINC001545725224 1053361197 /nfs/dbraw/zinc/36/11/97/1053361197.db2.gz LUMWIIAGMNIYRM-UHFFFAOYSA-N -1 1 321.829 4.006 20 0 DIADMM CCC1(C(=O)Nc2ccc(Br)c([O-])c2)CCCC1 ZINC001321582423 1053422565 /nfs/dbraw/zinc/42/25/65/1053422565.db2.gz FVQGAQYSPDSXBY-UHFFFAOYSA-N -1 1 312.207 4.064 20 0 DIADMM CCCOc1cccc(CC(=O)Nc2ccc([O-])c(Cl)c2)c1 ZINC000153354524 1053607156 /nfs/dbraw/zinc/60/71/56/1053607156.db2.gz OOXMHNODAKEWOD-UHFFFAOYSA-N -1 1 319.788 4.016 20 0 DIADMM Cc1ccc(-c2nc3ccc(Oc4ccccc4)cc3c(=O)[n-]2)o1 ZINC000620127001 1053609016 /nfs/dbraw/zinc/60/90/16/1053609016.db2.gz DTJBYRSINQCFSI-UHFFFAOYSA-N -1 1 318.332 4.284 20 0 DIADMM C/C=C(/C=C/C(=O)Nc1ccc(Br)c([O-])c1)CC ZINC001325060589 1053698384 /nfs/dbraw/zinc/69/83/84/1053698384.db2.gz AYYSUJDPJLDENU-ZVBUZHGDSA-N -1 1 310.191 4.006 20 0 DIADMM Cc1ccc2c(c1)[C@H](Oc1cccnc1-c1ncccc1[O-])CC2 ZINC001231201930 1053701723 /nfs/dbraw/zinc/70/17/23/1053701723.db2.gz OVSNOWASQPQMDK-QGZVFWFLSA-N -1 1 318.376 4.224 20 0 DIADMM COC1=CC[C@H](Oc2ccccc2C(=O)c2ccc([O-])cc2)CC1 ZINC001231230025 1053707936 /nfs/dbraw/zinc/70/79/36/1053707936.db2.gz JQUSRWULMLOLTB-KRWDZBQOSA-N -1 1 324.376 4.085 20 0 DIADMM O=C([O-])c1ccc(F)c(CN2CCCC[C@@H]2c2ccccc2)c1 ZINC001231457221 1053754224 /nfs/dbraw/zinc/75/42/24/1053754224.db2.gz PFPJAOXKPBSBNC-GOSISDBHSA-N -1 1 313.372 4.251 20 0 DIADMM O=C([O-])c1ccc(F)c(CN2CCC[C@@H]2c2ccc(F)cc2)c1 ZINC001231457474 1053758638 /nfs/dbraw/zinc/75/86/38/1053758638.db2.gz UADXXTFYEDPMCT-QGZVFWFLSA-N -1 1 317.335 4.000 20 0 DIADMM C[C@H](c1nc(-c2ccc([O-])c(F)c2)no1)c1ccc(F)cc1F ZINC001326492859 1053786419 /nfs/dbraw/zinc/78/64/19/1053786419.db2.gz KPOYDSJYXZLPTM-QMMMGPOBSA-N -1 1 320.270 4.011 20 0 DIADMM CN(Cc1ccc(Cl)c([O-])c1)[C@H](C1CCC1)C(F)(F)F ZINC001231736314 1053845704 /nfs/dbraw/zinc/84/57/04/1053845704.db2.gz HMJXNKXASYEPIG-CYBMUJFWSA-N -1 1 307.743 4.208 20 0 DIADMM CN(Cc1nc2ccccc2s1)Cc1ccc(Cl)c([O-])c1 ZINC001231731482 1053840806 /nfs/dbraw/zinc/84/08/06/1053840806.db2.gz MVEDKJAYIXKPFI-UHFFFAOYSA-N -1 1 318.829 4.287 20 0 DIADMM CC(C)c1scnc1[N-]C(=O)c1snc(Cl)c1Cl ZINC000848095461 1053855160 /nfs/dbraw/zinc/85/51/60/1053855160.db2.gz RAQHSYQWANCOHP-UHFFFAOYSA-N -1 1 322.242 4.282 20 0 DIADMM CC(C)(CCCc1ccccc1)CNc1cc(Cl)[n-]c(=O)n1 ZINC001472698009 1053895816 /nfs/dbraw/zinc/89/58/16/1053895816.db2.gz UXAAVWCTTWCXIR-UHFFFAOYSA-N -1 1 319.836 4.297 20 0 DIADMM CCc1ccc2nc(-c3cccc(CSC)c3)[n-]c(=O)c2c1 ZINC001328473963 1053935429 /nfs/dbraw/zinc/93/54/29/1053935429.db2.gz YOZDLCGAQSVFJI-UHFFFAOYSA-N -1 1 310.422 4.428 20 0 DIADMM O=C([N-]C1(C(F)F)CCCC1)C(F)(F)c1ccc(Cl)cc1 ZINC001330174610 1054029782 /nfs/dbraw/zinc/02/97/82/1054029782.db2.gz NIZHQTVZKHFKNY-UHFFFAOYSA-N -1 1 323.717 4.126 20 0 DIADMM C[C@@H](SCCC(=O)c1ccc([O-])cc1O)c1cccs1 ZINC000848430773 1054083655 /nfs/dbraw/zinc/08/36/55/1054083655.db2.gz BEWVHNQLSGDPIB-SNVBAGLBSA-N -1 1 308.424 4.227 20 0 DIADMM [O-]c1c(Cl)ccc(CN2C[C@H]3[C@H](CCC3(F)F)C2)c1Cl ZINC001232624241 1054086549 /nfs/dbraw/zinc/08/65/49/1054086549.db2.gz CYTMCJVOOUMZAN-SCZZXKLOSA-N -1 1 322.182 4.176 20 0 DIADMM [O-]c1c(Cl)ccc(CN2CCC3(CCC3)CC2)c1Cl ZINC001232626476 1054089840 /nfs/dbraw/zinc/08/98/40/1054089840.db2.gz ZERCTXSQQZYEJS-UHFFFAOYSA-N -1 1 300.229 4.465 20 0 DIADMM [O-]c1cccc(CN2Cc3ccccc3C(F)(F)C2)c1Cl ZINC001232784325 1054118245 /nfs/dbraw/zinc/11/82/45/1054118245.db2.gz KCPPKMZEXVKGQA-UHFFFAOYSA-N -1 1 309.743 4.153 20 0 DIADMM [O-]c1c(F)ccc(CN2CCC[C@H]2c2cccc(F)c2)c1F ZINC001232934193 1054149450 /nfs/dbraw/zinc/14/94/50/1054149450.db2.gz BDWGBJHSJZJDTG-HNNXBMFYSA-N -1 1 307.315 4.147 20 0 DIADMM CC[C@H]1c2ccccc2CCN1Cc1ccc(F)c([O-])c1F ZINC001232936458 1054150487 /nfs/dbraw/zinc/15/04/87/1054150487.db2.gz CWTFUWADUJJSAX-INIZCTEOSA-N -1 1 303.352 4.180 20 0 DIADMM [O-]c1cnc(Cl)cc1C[N@H+]1CC[C@@H](c2ccc(Cl)cc2)C1 ZINC001233037662 1054175444 /nfs/dbraw/zinc/17/54/44/1054175444.db2.gz DHIHPJKUCHEEFT-GFCCVEGCSA-N -1 1 323.223 4.084 20 0 DIADMM CC[C@H](NC(=O)c1c([O-])cccc1F)c1ccc(Cl)s1 ZINC000622372548 1054188684 /nfs/dbraw/zinc/18/86/84/1054188684.db2.gz PTDBGEGKDIYPSE-VIFPVBQESA-N -1 1 313.781 4.127 20 0 DIADMM CC(C)Oc1c(Cl)cccc1NC(=O)c1cc(F)ccc1[O-] ZINC000622380054 1054195529 /nfs/dbraw/zinc/19/55/29/1054195529.db2.gz VKKBJBKOTTWUOQ-UHFFFAOYSA-N -1 1 323.751 4.224 20 0 DIADMM Cc1ccc([C@]2(C)CN(Cc3ccc([S-])cc3)CCO2)cc1 ZINC001233262222 1054218549 /nfs/dbraw/zinc/21/85/49/1054218549.db2.gz WQEDXYHHBYRTKQ-IBGZPJMESA-N -1 1 313.466 4.031 20 0 DIADMM CCc1ccc(C(=O)N2C[C@H](C(C)C)c3ccccc32)c([O-])c1 ZINC000622562675 1054282687 /nfs/dbraw/zinc/28/26/87/1054282687.db2.gz MVZZTIBFQOXJNO-QGZVFWFLSA-N -1 1 309.409 4.355 20 0 DIADMM Cc1cccc2c1CN(C(=O)c1cc3ccccc3cc1[O-])CC2 ZINC000622555919 1054288997 /nfs/dbraw/zinc/28/89/97/1054288997.db2.gz LSSJHSRAOBCBCA-UHFFFAOYSA-N -1 1 317.388 4.052 20 0 DIADMM CCCC(=O)c1ccc([O-])cc1O[C@@H](C)c1cccnc1F ZINC001233650972 1054322170 /nfs/dbraw/zinc/32/21/70/1054322170.db2.gz UZOLOTZQQCUFRJ-NSHDSACASA-N -1 1 303.333 4.049 20 0 DIADMM CCCC(=O)c1ccc([O-])cc1O[C@@H](C(C)C)C(F)(F)F ZINC001233650204 1054322839 /nfs/dbraw/zinc/32/28/39/1054322839.db2.gz JEHNCBOEXJTPMH-AWEZNQCLSA-N -1 1 304.308 4.341 20 0 DIADMM CC1(C)CCC(C)(CNC(=O)c2c(F)ccc([O-])c2F)CC1 ZINC000622706172 1054340954 /nfs/dbraw/zinc/34/09/54/1054340954.db2.gz ZWSOLOWGHCZRAD-UHFFFAOYSA-N -1 1 311.372 4.007 20 0 DIADMM CCc1ccc([C@@H](NC(=O)c2ccc([O-])cc2F)C(C)C)cc1 ZINC001440834483 1054370762 /nfs/dbraw/zinc/37/07/62/1054370762.db2.gz SGGJIHQILACVTN-SFHVURJKSA-N -1 1 315.388 4.221 20 0 DIADMM CC(C)CCCCCCNC(=O)c1ncc2ccccc2c1[O-] ZINC001441066041 1054379298 /nfs/dbraw/zinc/37/92/98/1054379298.db2.gz FMRYAQQWGNLDHR-UHFFFAOYSA-N -1 1 314.429 4.277 20 0 DIADMM O=C(Nc1ccc2scnc2c1)c1ccc2ccccc2c1[O-] ZINC001442870325 1054434809 /nfs/dbraw/zinc/43/48/09/1054434809.db2.gz LUVSYHKUMGOZAB-UHFFFAOYSA-N -1 1 320.373 4.407 20 0 DIADMM CC(C)(C)Cc1ncc(C(=O)Nc2ccc([O-])c(Cl)c2)s1 ZINC001545953884 1054439423 /nfs/dbraw/zinc/43/94/23/1054439423.db2.gz NUPHQLMQHAYKJH-UHFFFAOYSA-N -1 1 324.833 4.343 20 0 DIADMM CSc1ccc(N(C)C(=O)c2cc(SC)ccc2[O-])cc1 ZINC001443826873 1054459355 /nfs/dbraw/zinc/45/93/55/1054459355.db2.gz VPFIRBJTZWFTHN-UHFFFAOYSA-N -1 1 319.451 4.113 20 0 DIADMM CC[C@@H](C)C[C@H](NCc1cc2cc(C)c(C)cc2o1)C(=O)[O-] ZINC000901675233 1054466759 /nfs/dbraw/zinc/46/67/59/1054466759.db2.gz MQEAGPLLRUYAJP-BZNIZROVSA-N -1 1 303.402 4.029 20 0 DIADMM CC(C)CCOc1ccc(NC(=O)c2cc(F)ccc2[O-])cc1 ZINC001444686444 1054483134 /nfs/dbraw/zinc/48/31/34/1054483134.db2.gz HNSAINYENYYXRF-UHFFFAOYSA-N -1 1 317.360 4.209 20 0 DIADMM O=C(N[C@@H]1C[C@@H]1C1CCCCC1)c1ccc2ccccc2c1[O-] ZINC001444973879 1054492626 /nfs/dbraw/zinc/49/26/26/1054492626.db2.gz IIIMQMLPZBHWMQ-QZTJIDSGSA-N -1 1 309.409 4.244 20 0 DIADMM O=C(N[C@H]1C[C@H]1C1CCCCC1)c1ccc2ccccc2c1[O-] ZINC001444973880 1054493127 /nfs/dbraw/zinc/49/31/27/1054493127.db2.gz IIIMQMLPZBHWMQ-ROUUACIJSA-N -1 1 309.409 4.244 20 0 DIADMM C[C@]1(c2ccccc2)C[C@@H]1NC(=O)c1ccc2ccccc2c1[O-] ZINC001444954509 1054493188 /nfs/dbraw/zinc/49/31/88/1054493188.db2.gz KYOGJWJMWGQIAC-GHTZIAJQSA-N -1 1 317.388 4.005 20 0 DIADMM COCCOCc1cccc(-c2cc(Cl)c(F)cc2[O-])c1 ZINC000623048602 1054521377 /nfs/dbraw/zinc/52/13/77/1054521377.db2.gz HPIJUUXNRSJCLK-UHFFFAOYSA-N -1 1 310.752 4.015 20 0 DIADMM Cc1ccc(C)c([C@@H]2CCCN2C(=O)c2ccc([O-])cc2F)c1 ZINC001445999930 1054522807 /nfs/dbraw/zinc/52/28/07/1054522807.db2.gz LGPZWUOOJLAYBJ-SFHVURJKSA-N -1 1 313.372 4.125 20 0 DIADMM C[C@@H](c1ccccc1)N(C(=O)c1cc(Cl)ccc1[O-])C1CC1 ZINC001346105454 1054528913 /nfs/dbraw/zinc/52/89/13/1054528913.db2.gz GQQKUKVGECGHQA-LBPRGKRZSA-N -1 1 315.800 4.411 20 0 DIADMM Cc1nc(C(C)C)[n-]c(=O)c1C(=O)Nc1cccc2ccccc21 ZINC001346208033 1054530864 /nfs/dbraw/zinc/53/08/64/1054530864.db2.gz HVHPOPXZIMNTID-UHFFFAOYSA-N -1 1 321.380 4.020 20 0 DIADMM CCC(=O)c1cccc(NC(=O)c2ccc(C(C)C)cc2[O-])c1 ZINC001446364130 1054534242 /nfs/dbraw/zinc/53/42/42/1054534242.db2.gz IBBHUPSFMFNUBO-UHFFFAOYSA-N -1 1 311.381 4.361 20 0 DIADMM C/C(=C/C(=O)Nc1ccc([O-])c(Cl)c1)c1ccccc1C ZINC001446467322 1054535186 /nfs/dbraw/zinc/53/51/86/1054535186.db2.gz LYNOZQJUWZDUQH-XFXZXTDPSA-N -1 1 301.773 4.396 20 0 DIADMM C[C@H]1CCc2ccccc2[C@@H]1NC(=O)c1cc(Cl)ccc1[O-] ZINC001446841682 1054546245 /nfs/dbraw/zinc/54/62/45/1054546245.db2.gz BRIXHVQRTJPIJK-APPDUMDISA-N -1 1 315.800 4.099 20 0 DIADMM C[C@@H]1CCc2ccccc2[C@H]1NC(=O)c1cc(Cl)ccc1[O-] ZINC001446841684 1054546954 /nfs/dbraw/zinc/54/69/54/1054546954.db2.gz BRIXHVQRTJPIJK-DIFFPNOSSA-N -1 1 315.800 4.099 20 0 DIADMM CCC[C@H](CC)C(=O)Nc1cc(C)cc(Br)c1[O-] ZINC001446846871 1054547204 /nfs/dbraw/zinc/54/72/04/1054547204.db2.gz JBEJCKPBSKADAX-JTQLQIEISA-N -1 1 314.223 4.228 20 0 DIADMM COc1cccc([O-])c1C(=O)Nc1cccc(-c2ccccc2)c1 ZINC001449101402 1054613129 /nfs/dbraw/zinc/61/31/29/1054613129.db2.gz SAJZRAYQLUUENS-UHFFFAOYSA-N -1 1 319.360 4.320 20 0 DIADMM O=C(NC1(c2ccccc2Cl)CC1)c1ccc(Cl)cc1[O-] ZINC001452133299 1054695093 /nfs/dbraw/zinc/69/50/93/1054695093.db2.gz LOXTZGAAHJKCPW-UHFFFAOYSA-N -1 1 322.191 4.118 20 0 DIADMM Cc1c2cccc(Cl)c2[nH]c1C(=O)Nc1c([O-])cccc1F ZINC001453020393 1054726476 /nfs/dbraw/zinc/72/64/76/1054726476.db2.gz ZSCKHDUIFJWSPK-UHFFFAOYSA-N -1 1 318.735 4.227 20 0 DIADMM C[C@@H]1C[C@@H]1[C@@H]1C[C@H]1C(=O)Nc1cc(Cl)c([O-])c2ccccc12 ZINC001453779911 1054748293 /nfs/dbraw/zinc/74/82/93/1054748293.db2.gz GGRAOOUPSPEUPY-IGJVIKARSA-N -1 1 315.800 4.429 20 0 DIADMM C[C@@H]1C[C@@H]1[C@H]1C[C@@H]1C(=O)Nc1cc(Cl)c([O-])c2ccccc12 ZINC001453779918 1054748809 /nfs/dbraw/zinc/74/88/09/1054748809.db2.gz GGRAOOUPSPEUPY-PCDDKUFXSA-N -1 1 315.800 4.429 20 0 DIADMM Cc1c(C(=O)Nc2cccc(F)c2[O-])oc2c1c(C)ccc2C ZINC001454752029 1054783280 /nfs/dbraw/zinc/78/32/80/1054783280.db2.gz BTXNSXMNYNSLTE-UHFFFAOYSA-N -1 1 313.328 4.455 20 0 DIADMM Cc1cc(-c2ccc(C(=O)[O-])c(C)c2Cl)cc2nc[nH]c21 ZINC001236119226 1054958878 /nfs/dbraw/zinc/95/88/78/1054958878.db2.gz DHZQPFMEYIYZRX-UHFFFAOYSA-N -1 1 300.745 4.198 20 0 DIADMM Cc1ccc(F)c(-c2cc3c(nn2)-c2ccccc2CCC3)c1[O-] ZINC001236391719 1055089352 /nfs/dbraw/zinc/08/93/52/1055089352.db2.gz OCGXVDMALWGGOA-UHFFFAOYSA-N -1 1 320.367 4.452 20 0 DIADMM Cc1ccc(F)c(-c2ncccc2OCc2ccccc2)c1[O-] ZINC001236391279 1055089758 /nfs/dbraw/zinc/08/97/58/1055089758.db2.gz MVYCZMXPJVUFLG-UHFFFAOYSA-N -1 1 309.340 4.481 20 0 DIADMM Cc1ccc(F)c(-c2ncnc3ccc(C(F)(F)F)cc32)c1[O-] ZINC001236390976 1055089786 /nfs/dbraw/zinc/08/97/86/1055089786.db2.gz GUSOTNWHFGSKGZ-UHFFFAOYSA-N -1 1 322.261 4.469 20 0 DIADMM Cc1ccc(F)c(-c2cnc3cc(C(F)(F)F)ccc3n2)c1[O-] ZINC001236392111 1055089961 /nfs/dbraw/zinc/08/99/61/1055089961.db2.gz LNULASVJCUBWFK-UHFFFAOYSA-N -1 1 322.261 4.469 20 0 DIADMM Cc1ccc(F)c(-c2nnc(-c3cccc(F)c3)cc2C)c1[O-] ZINC001236392763 1055090534 /nfs/dbraw/zinc/09/05/34/1055090534.db2.gz RRKZJPHEMULWJN-UHFFFAOYSA-N -1 1 312.319 4.411 20 0 DIADMM Cc1ccc(F)c(-c2ncnc3c2ccn3C2CCCC2)c1[O-] ZINC001236392025 1055090554 /nfs/dbraw/zinc/09/05/54/1055090554.db2.gz KMNSCCVUTJQCHS-UHFFFAOYSA-N -1 1 311.360 4.367 20 0 DIADMM Cc1ccc(F)c(-c2ccc(-c3ccc(F)cc3F)nn2)c1[O-] ZINC001236392657 1055090565 /nfs/dbraw/zinc/09/05/65/1055090565.db2.gz QUTRFSGKNWCMNA-UHFFFAOYSA-N -1 1 316.282 4.242 20 0 DIADMM COc1cc2nc(-c3c(F)ccc(C)c3[O-])ccc2c(OC)c1 ZINC001236394094 1055091830 /nfs/dbraw/zinc/09/18/30/1055091830.db2.gz VWWOHHUZSUTSBX-UHFFFAOYSA-N -1 1 313.328 4.072 20 0 DIADMM COc1nc(-c2c(F)ccc(C)c2[O-])cc2cc(F)ccc21 ZINC001236403198 1055095973 /nfs/dbraw/zinc/09/59/73/1055095973.db2.gz QHOAZYWELGPZHX-UHFFFAOYSA-N -1 1 301.292 4.203 20 0 DIADMM CC(C)[C@@H]1C[C@H](NC(=O)c2cccc([O-])c2F)c2ccccc21 ZINC001587122208 1055221098 /nfs/dbraw/zinc/22/10/98/1055221098.db2.gz KNEIWLGGCWWTRV-HOTGVXAUSA-N -1 1 313.372 4.146 20 0 DIADMM CCC(F)(F)C(C)(C)CNC(=O)c1cc2ccccc2cc1[O-] ZINC001587243385 1055249308 /nfs/dbraw/zinc/24/93/08/1055249308.db2.gz PJZPIPBIXUDHOC-UHFFFAOYSA-N -1 1 321.367 4.347 20 0 DIADMM CC(C)(C)[C@H]1Cc2ccccc2N(C(=O)c2ccccc2[O-])C1 ZINC001587317602 1055265958 /nfs/dbraw/zinc/26/59/58/1055265958.db2.gz RMTSACPVSUGUGH-HNNXBMFYSA-N -1 1 309.409 4.257 20 0 DIADMM C[C@H](c1ccccc1)[C@H](C)NC(=O)c1cc2ccccc2cc1[O-] ZINC001587332438 1055270602 /nfs/dbraw/zinc/27/06/02/1055270602.db2.gz ORKVHLTUDXFINU-GJZGRUSLSA-N -1 1 319.404 4.467 20 0 DIADMM CCCn1c(C(=O)Nc2cccc(F)c2[O-])cc2ccccc21 ZINC001587389986 1055285631 /nfs/dbraw/zinc/28/56/31/1055285631.db2.gz XNPQGMADENEUAY-UHFFFAOYSA-N -1 1 312.344 4.148 20 0 DIADMM O=C(NCCCCc1ccccc1)c1ccc2ccccc2c1[O-] ZINC001587696741 1055348350 /nfs/dbraw/zinc/34/83/50/1055348350.db2.gz ZMTJVHCMJHHEFI-UHFFFAOYSA-N -1 1 319.404 4.298 20 0 DIADMM CC(C)CCC[C@@H](C)NC(=O)c1c([O-])cnc2c(F)cccc21 ZINC001588042144 1055419606 /nfs/dbraw/zinc/41/96/06/1055419606.db2.gz YPCHIVHQZUAIMZ-GFCCVEGCSA-N -1 1 318.392 4.024 20 0 DIADMM C[C@@]1(C2CCCCC2)CCN1C(=O)c1ncc2ccccc2c1[O-] ZINC001588180018 1055443817 /nfs/dbraw/zinc/44/38/17/1055443817.db2.gz XINNJURBHGUCHS-FQEVSTJZSA-N -1 1 324.424 4.125 20 0 DIADMM CCC[C@@H]1CCCN(C(=O)c2ccc(C(F)(F)F)c([O-])c2)C1 ZINC001588198881 1055448228 /nfs/dbraw/zinc/44/82/28/1055448228.db2.gz HYMGDDSEAGDLCE-LLVKDONJSA-N -1 1 315.335 4.063 20 0 DIADMM CCCCC[C@@H](C)NC(=O)c1ccc(C(F)(F)F)c([O-])c1 ZINC001588282791 1055463506 /nfs/dbraw/zinc/46/35/06/1055463506.db2.gz FDYAGJFTISNFOZ-SNVBAGLBSA-N -1 1 303.324 4.110 20 0 DIADMM CC1=C(C)C[C@](C)(C(=O)NCc2ccc([O-])c(Cl)c2)CC1 ZINC001594565752 1055566333 /nfs/dbraw/zinc/56/63/33/1055566333.db2.gz OSOCKUNWTFEFHU-QGZVFWFLSA-N -1 1 307.821 4.188 20 0 DIADMM Cc1ccc(/C=C\CC(=O)NCc2ccc([O-])c(Cl)c2)cc1 ZINC001594558665 1055567043 /nfs/dbraw/zinc/56/70/43/1055567043.db2.gz RBKZKQYCBAUOAL-IHWYPQMZSA-N -1 1 315.800 4.074 20 0 DIADMM C/C(=C\C(=O)NCc1ccc([O-])c(Cl)c1)c1ccccc1C ZINC001594558081 1055567335 /nfs/dbraw/zinc/56/73/35/1055567335.db2.gz DKTNQKMYUGVVPY-UKTHLTGXSA-N -1 1 315.800 4.074 20 0 DIADMM CCC(F)(F)C(=O)[N-][C@@H](C)c1cc(Cl)cc(Cl)c1F ZINC001595110949 1055579202 /nfs/dbraw/zinc/57/92/02/1055579202.db2.gz IDCPPKNIRLPEOX-LURJTMIESA-N -1 1 314.134 4.355 20 0 DIADMM COc1ccccc1[C@@H](C)N(C)Cc1cc(F)c([O-])c(Cl)c1 ZINC001237998770 1055580557 /nfs/dbraw/zinc/58/05/57/1055580557.db2.gz WSAGLLQFFRTTBB-LLVKDONJSA-N -1 1 323.795 4.386 20 0 DIADMM O=C([O-])c1cc(F)ccc1CN1CCC[C@H]1c1ccc(F)cc1 ZINC001238234979 1055627051 /nfs/dbraw/zinc/62/70/51/1055627051.db2.gz ZWGPRESAOLJXAP-KRWDZBQOSA-N -1 1 317.335 4.000 20 0 DIADMM Cc1ccc(Cl)cc1S(=O)(=O)[N-]c1ccc(Cl)cc1 ZINC000031665572 1055642166 /nfs/dbraw/zinc/64/21/66/1055642166.db2.gz RTRASNKLCFXEDI-UHFFFAOYSA-N -1 1 316.209 4.103 20 0 DIADMM CC(C)CN(CC(C)(C)C)C(=O)Cc1ccc([O-])c(Cl)c1 ZINC001595959028 1055654753 /nfs/dbraw/zinc/65/47/53/1055654753.db2.gz YDBBWZRVDZRCGX-UHFFFAOYSA-N -1 1 311.853 4.119 20 0 DIADMM C[C@H](NC(=O)c1cccc([O-])c1F)c1cccc2ccccc21 ZINC001538543219 1055654882 /nfs/dbraw/zinc/65/48/82/1055654882.db2.gz VQMLUEKVPPLFGZ-LBPRGKRZSA-N -1 1 309.340 4.176 20 0 DIADMM CSc1ccc([O-])c(C(=O)N2CCCCc3ccccc32)c1 ZINC001565561893 1055710394 /nfs/dbraw/zinc/71/03/94/1055710394.db2.gz ZZIFOYJLOOBSPC-UHFFFAOYSA-N -1 1 313.422 4.097 20 0 DIADMM CC[C@@H](C)[C@H]1CCCCN1C(=O)Cc1ccc([O-])c(Cl)c1 ZINC001565889570 1055735822 /nfs/dbraw/zinc/73/58/22/1055735822.db2.gz NZGYSFOFHSBKOI-IUODEOHRSA-N -1 1 309.837 4.015 20 0 DIADMM CC1(C)CCC(NC(=O)c2ccc(C(F)(F)F)c([O-])c2)CC1 ZINC001565988644 1055737608 /nfs/dbraw/zinc/73/76/08/1055737608.db2.gz IMRREZJHHPSMRJ-UHFFFAOYSA-N -1 1 315.335 4.110 20 0 DIADMM CC1(C)Cc2ccc(C(=O)Nc3ccc([O-])c(Cl)c3)cc2O1 ZINC001596819192 1055749272 /nfs/dbraw/zinc/74/92/72/1055749272.db2.gz BSTMODAUILUFQP-UHFFFAOYSA-N -1 1 317.772 4.011 20 0 DIADMM CC(C)Cc1ccc(C(=O)Nc2ccc([O-])c(Cl)c2)cc1 ZINC001566587146 1055777194 /nfs/dbraw/zinc/77/71/94/1055777194.db2.gz SWDKYZIOQYFGDS-UHFFFAOYSA-N -1 1 303.789 4.496 20 0 DIADMM CC[C@H](C)n1nc(NC(=O)c2ccc3ccccc3c2[O-])cc1C ZINC001566870665 1055785848 /nfs/dbraw/zinc/78/58/48/1055785848.db2.gz GTOFIHRAIMWDJK-LBPRGKRZSA-N -1 1 323.396 4.274 20 0 DIADMM CCc1ccc(O)c(NC(=O)c2ccc3ccccc3c2[O-])c1 ZINC001567091278 1055792209 /nfs/dbraw/zinc/79/22/09/1055792209.db2.gz YXVNBKUPLQSGQR-UHFFFAOYSA-N -1 1 307.349 4.066 20 0 DIADMM CCN(C(=O)Cc1ccc([O-])c(Cl)c1)c1ccc(Cl)cc1 ZINC001597222365 1055803689 /nfs/dbraw/zinc/80/36/89/1055803689.db2.gz JJCVRZWDZRSWJR-UHFFFAOYSA-N -1 1 324.207 4.295 20 0 DIADMM CC(C)(C)c1nc2cc(NC(=O)c3ccccc3[O-])ccc2o1 ZINC000058760209 1055816068 /nfs/dbraw/zinc/81/60/68/1055816068.db2.gz LNTNCRALJOPXBM-UHFFFAOYSA-N -1 1 310.353 4.083 20 0 DIADMM CC[C@@H](C)c1ncc(NC(=O)c2cc3ccccc3cc2[O-])cn1 ZINC001568093489 1055828550 /nfs/dbraw/zinc/82/85/50/1055828550.db2.gz SKFUIQPUIHHBKG-GFCCVEGCSA-N -1 1 321.380 4.101 20 0 DIADMM CCc1cc(NC(=O)c2cc3ccccc3cc2[O-])ccc1F ZINC001568801222 1055846011 /nfs/dbraw/zinc/84/60/11/1055846011.db2.gz PBIOVNAQGSXCPU-UHFFFAOYSA-N -1 1 309.340 4.499 20 0 DIADMM C[C@H]1C[C@H](C(C)(C)C)CCN1Cc1nc(=O)c2sccc2[n-]1 ZINC000347575816 1055847254 /nfs/dbraw/zinc/84/72/54/1055847254.db2.gz DCUDNCQMTWCNNR-NWDGAFQWSA-N -1 1 319.474 4.044 20 0 DIADMM C[C@H]1C[C@@H](C(C)(C)C)CCN1Cc1nc(=O)c2sccc2[n-]1 ZINC000347575823 1055848415 /nfs/dbraw/zinc/84/84/15/1055848415.db2.gz DCUDNCQMTWCNNR-RYUDHWBXSA-N -1 1 319.474 4.044 20 0 DIADMM CC[C@@H](NC(=O)c1ccc(C(F)(F)F)cc1[O-])C1CCCC1 ZINC001569009276 1055852801 /nfs/dbraw/zinc/85/28/01/1055852801.db2.gz ZWGLNJBMBXYJRU-CYBMUJFWSA-N -1 1 315.335 4.110 20 0 DIADMM CCCC[C@@H](CC)C(=O)Nc1cccc([O-])c1Br ZINC001569379153 1055861318 /nfs/dbraw/zinc/86/13/18/1055861318.db2.gz PUMMNWKXQNRIJL-SNVBAGLBSA-N -1 1 314.223 4.310 20 0 DIADMM CN(C)c1ccc2cc(NC(=O)c3ccc([O-])c(F)c3)ccc2c1 ZINC001569393559 1055861406 /nfs/dbraw/zinc/86/14/06/1055861406.db2.gz LWQQHJIAKDGYFU-UHFFFAOYSA-N -1 1 324.355 4.003 20 0 DIADMM CC[C@H](C)[C@@H](C(=O)Nc1cc([O-])c(F)cc1F)c1ccccc1 ZINC001570102206 1055887042 /nfs/dbraw/zinc/88/70/42/1055887042.db2.gz VKMQNUHJIOFSCQ-APPDUMDISA-N -1 1 319.351 4.439 20 0 DIADMM Cc1ccc(-c2ccc([C@H](C)[N-]C(=O)C(F)(F)F)cc2)c(C)n1 ZINC001239470543 1055895507 /nfs/dbraw/zinc/89/55/07/1055895507.db2.gz OWFOXORCUGCELY-NSHDSACASA-N -1 1 322.330 4.105 20 0 DIADMM CN(C(=O)c1c([O-])cccc1Cl)[C@@H]1CCC[C@H]1C(C)(C)C ZINC001570457567 1055903540 /nfs/dbraw/zinc/90/35/40/1055903540.db2.gz YEIZREMXECBDIY-DGCLKSJQSA-N -1 1 309.837 4.332 20 0 DIADMM O=C(Nc1cc(F)c([O-])cc1Cl)c1ccc(Cl)cc1 ZINC001598582704 1055958241 /nfs/dbraw/zinc/95/82/41/1055958241.db2.gz KOCOHKBXDWJNDU-UHFFFAOYSA-N -1 1 300.116 4.090 20 0 DIADMM Cc1cc(C)cc(NC(=O)c2ccc3ccc(O)cc3c2[O-])c1 ZINC001540384385 1056024440 /nfs/dbraw/zinc/02/44/40/1056024440.db2.gz FBWVMPRZXZIROT-UHFFFAOYSA-N -1 1 307.349 4.120 20 0 DIADMM O=C(Nc1ccc(Cl)cc1Cl)c1ccc(F)c([O-])c1 ZINC001540392956 1056024776 /nfs/dbraw/zinc/02/47/76/1056024776.db2.gz QITWTNPXRZOXLM-UHFFFAOYSA-N -1 1 300.116 4.090 20 0 DIADMM Cc1ccc(C)c(NC(=O)c2ccc3ccc(O)cc3c2[O-])c1 ZINC001540407414 1056027596 /nfs/dbraw/zinc/02/75/96/1056027596.db2.gz VASDATHWLWDKQW-UHFFFAOYSA-N -1 1 307.349 4.120 20 0 DIADMM CC(C)C[C@@H](NC(=O)c1ccc(F)c([O-])c1)c1ccccc1 ZINC001540618532 1056051239 /nfs/dbraw/zinc/05/12/39/1056051239.db2.gz ULWTVEDYXGVPBF-MRXNPFEDSA-N -1 1 301.361 4.049 20 0 DIADMM Cc1cc2sc(NC(=O)c3cc(F)ccc3[O-])nc2c(C)c1 ZINC001608503919 1056056243 /nfs/dbraw/zinc/05/62/43/1056056243.db2.gz VQUWLCMNAKEFTA-UHFFFAOYSA-N -1 1 316.357 4.010 20 0 DIADMM Cc1c2ccccc2oc1C(=O)Nc1ccc([O-])c(Cl)c1 ZINC000111666915 1056057230 /nfs/dbraw/zinc/05/72/30/1056057230.db2.gz MLMBCNWPSNAQQT-UHFFFAOYSA-N -1 1 301.729 4.353 20 0 DIADMM C[C@@H](CSc1ccccc1)C(=O)Nc1ccc([O-])c(Cl)c1 ZINC000111667563 1056057343 /nfs/dbraw/zinc/05/73/43/1056057343.db2.gz QRYYUSKFIPGPQI-NSHDSACASA-N -1 1 321.829 4.413 20 0 DIADMM COc1ccccc1[C@@H](C)CC(=O)Nc1ccc([O-])c(Cl)c1 ZINC000111666371 1056057890 /nfs/dbraw/zinc/05/78/90/1056057890.db2.gz YCJRKDINWURISF-NSHDSACASA-N -1 1 319.788 4.187 20 0 DIADMM CCOc1ccccc1CCC(=O)Nc1ccc([O-])c(Cl)c1 ZINC000111665992 1056058238 /nfs/dbraw/zinc/05/82/38/1056058238.db2.gz ISBKKMBZCCOBAT-UHFFFAOYSA-N -1 1 319.788 4.016 20 0 DIADMM C[C@H](Cc1cccc(F)c1)C(=O)Nc1ccc([O-])c(Cl)c1 ZINC000111666421 1056058560 /nfs/dbraw/zinc/05/85/60/1056058560.db2.gz VUFDWTNNSBUPES-SNVBAGLBSA-N -1 1 307.752 4.002 20 0 DIADMM CC[C@@H](C)c1ccc([N-]S(=O)(=O)c2cccc(F)c2)cc1 ZINC000007057571 1056061685 /nfs/dbraw/zinc/06/16/85/1056061685.db2.gz PGALBCNIWACLAH-GFCCVEGCSA-N -1 1 307.390 4.140 20 0 DIADMM CC(C)(C)[C@@H]1CCCC[C@@H]1NC(=O)Cc1ccc([O-])c(Cl)c1 ZINC001540711686 1056065981 /nfs/dbraw/zinc/06/59/81/1056065981.db2.gz AMVSSRXGVDOZQW-HIFRSBDPSA-N -1 1 323.864 4.309 20 0 DIADMM Cc1cc(-c2ccccc2)ccc1NC(=O)c1ccc([O-])cn1 ZINC001540737231 1056070031 /nfs/dbraw/zinc/07/00/31/1056070031.db2.gz OINFSVQWCYYMKA-UHFFFAOYSA-N -1 1 304.349 4.015 20 0 DIADMM Cc1ccc([C@H](C)N(C)C(=O)c2cc(Cl)ccc2[O-])c(C)c1 ZINC001540804673 1056079580 /nfs/dbraw/zinc/07/95/80/1056079580.db2.gz FJAKVKYYPAAEAK-ZDUSSCGKSA-N -1 1 317.816 4.496 20 0 DIADMM CC(C)(C)[C@@H](NC(=O)c1cccc([O-])c1F)c1ccc(F)cc1 ZINC001540925391 1056085087 /nfs/dbraw/zinc/08/50/87/1056085087.db2.gz LVBLMNATMNODSE-INIZCTEOSA-N -1 1 319.351 4.188 20 0 DIADMM CC(C)(C)[C@@H](NC(=O)c1ccc([O-])cc1F)c1ccc(F)cc1 ZINC001540924458 1056085489 /nfs/dbraw/zinc/08/54/89/1056085489.db2.gz DLSJENMDXHGHBJ-INIZCTEOSA-N -1 1 319.351 4.188 20 0 DIADMM CC(C)Oc1ccccc1NC(=O)Cc1ccc([O-])c(Cl)c1 ZINC001541102377 1056092312 /nfs/dbraw/zinc/09/23/12/1056092312.db2.gz QVPHARSBBTXYLP-UHFFFAOYSA-N -1 1 319.788 4.014 20 0 DIADMM CCN(C(=O)c1cc(SC)ccc1[O-])c1ccccc1C ZINC001542080429 1056102845 /nfs/dbraw/zinc/10/28/45/1056102845.db2.gz AQHUEXPLRZHRDO-UHFFFAOYSA-N -1 1 301.411 4.089 20 0 DIADMM O=C(Nc1ccc(F)cc1[O-])c1ccc(-c2ccccc2)cc1 ZINC001611068284 1056104949 /nfs/dbraw/zinc/10/49/49/1056104949.db2.gz VXBSKDZGDNZZFX-UHFFFAOYSA-N -1 1 307.324 4.451 20 0 DIADMM CCCCN(C)c1ccc(C(=O)Nc2ccc(F)cc2[O-])cc1 ZINC001611074119 1056105351 /nfs/dbraw/zinc/10/53/51/1056105351.db2.gz IZWVKLWCKFGXLR-UHFFFAOYSA-N -1 1 316.376 4.020 20 0 DIADMM CCC1CCC(N(C(=O)c2ccc(F)c([O-])c2)C2CC2)CC1 ZINC001583558213 1056106179 /nfs/dbraw/zinc/10/61/79/1056106179.db2.gz FKMJAZULLJHYHW-UHFFFAOYSA-N -1 1 305.393 4.105 20 0 DIADMM CCOC(=O)c1nc2cc(-c3ccc(C)cc3Cl)ccc2[n-]1 ZINC001239864137 1056115526 /nfs/dbraw/zinc/11/55/26/1056115526.db2.gz YSPJGBCMQQLFIB-UHFFFAOYSA-N -1 1 314.772 4.368 20 0 DIADMM CCOC(=O)c1nc2ccc(-c3ccc(C)cc3Cl)cc2[n-]1 ZINC001239864137 1056115530 /nfs/dbraw/zinc/11/55/30/1056115530.db2.gz YSPJGBCMQQLFIB-UHFFFAOYSA-N -1 1 314.772 4.368 20 0 DIADMM CCCN(Cc1ccc(C)cc1)C(=O)c1cc(Cl)ccc1[O-] ZINC001542539305 1056132472 /nfs/dbraw/zinc/13/24/72/1056132472.db2.gz KSMFPLDAMONQIT-UHFFFAOYSA-N -1 1 317.816 4.406 20 0 DIADMM O=C(c1cccc([O-])c1F)N1CCCCC[C@H]1c1ccccc1 ZINC001542627747 1056145970 /nfs/dbraw/zinc/14/59/70/1056145970.db2.gz QBZBEIAXUQVUTB-INIZCTEOSA-N -1 1 313.372 4.289 20 0 DIADMM CSCc1ccc(NC(=O)c2cc(SC)ccc2[O-])cc1 ZINC001611439384 1056160407 /nfs/dbraw/zinc/16/04/07/1056160407.db2.gz YIKPATDJXCJLPH-UHFFFAOYSA-N -1 1 319.451 4.229 20 0 DIADMM CN(CCC(C)(C)C)C(=O)c1c([O-])cnc2ccc(Cl)cc21 ZINC001611476078 1056166238 /nfs/dbraw/zinc/16/62/38/1056166238.db2.gz OTNAHSSGAQTZND-UHFFFAOYSA-N -1 1 320.820 4.102 20 0 DIADMM O=C(c1cc(Cl)ccc1[O-])N1CCC[C@H]1c1ccsc1 ZINC001543020458 1056168203 /nfs/dbraw/zinc/16/82/03/1056168203.db2.gz CBHQFCBWQYWSDY-ZDUSSCGKSA-N -1 1 307.802 4.084 20 0 DIADMM C[C@H]1C[C@H]1c1ccc(CNC(=O)c2ccc3ccccc3c2[O-])o1 ZINC001543208717 1056188901 /nfs/dbraw/zinc/18/89/01/1056188901.db2.gz UIBNBNXFUFKJRQ-YVEFUNNKSA-N -1 1 321.376 4.192 20 0 DIADMM CC(C)CCc1ccc(NC(=O)c2ccc([O-])c(F)c2)cc1 ZINC001583897549 1056199210 /nfs/dbraw/zinc/19/92/10/1056199210.db2.gz DKZJXSDQRCDEQG-UHFFFAOYSA-N -1 1 301.361 4.372 20 0 DIADMM CCCC[C@@H](CC)CNC(=O)c1ccc2ccc(O)cc2c1[O-] ZINC001543336399 1056203294 /nfs/dbraw/zinc/20/32/94/1056203294.db2.gz SNSHCXFBJAOAFY-CYBMUJFWSA-N -1 1 315.413 4.197 20 0 DIADMM CC(C)c1ccc(CCCNC(=O)c2cccc([O-])c2F)cc1 ZINC001543351349 1056205848 /nfs/dbraw/zinc/20/58/48/1056205848.db2.gz NCPQGLVIGVHXSA-UHFFFAOYSA-N -1 1 315.388 4.017 20 0 DIADMM CC[C@H](NC(=O)c1ccc([O-])cc1F)c1ccc(Cl)s1 ZINC001543690879 1056280041 /nfs/dbraw/zinc/28/00/41/1056280041.db2.gz FJLSENAHUBNQCJ-NSHDSACASA-N -1 1 313.781 4.127 20 0 DIADMM CSc1cc(Cl)ccc1NC(=O)c1cccc([O-])c1F ZINC001584248817 1056298386 /nfs/dbraw/zinc/29/83/86/1056298386.db2.gz VWSZUEYLZBZYPK-UHFFFAOYSA-N -1 1 311.765 4.159 20 0 DIADMM CSc1ccc(Cl)c(NC(=O)c2ccc(F)c([O-])c2)c1 ZINC001584363667 1056325215 /nfs/dbraw/zinc/32/52/15/1056325215.db2.gz PCKJCPQKMBHDEN-UHFFFAOYSA-N -1 1 311.765 4.159 20 0 DIADMM O=C(c1ccccc1[O-])N(Cc1ccccc1)c1ccccc1 ZINC000011639206 1056361865 /nfs/dbraw/zinc/36/18/65/1056361865.db2.gz DNHLESXCJZAMAD-UHFFFAOYSA-N -1 1 303.361 4.239 20 0 DIADMM CN(C(=O)Cc1ccc([O-])c(Cl)c1)C1CCCCCCC1 ZINC001584563169 1056370728 /nfs/dbraw/zinc/37/07/28/1056370728.db2.gz BVWLCWFAHRZOJG-UHFFFAOYSA-N -1 1 309.837 4.159 20 0 DIADMM CCN(C(=O)Cc1ccc([O-])c(Cl)c1)[C@H]1CCCC[C@@H]1C ZINC001584664235 1056392516 /nfs/dbraw/zinc/39/25/16/1056392516.db2.gz CKXNMFADQMNJJN-WFASDCNBSA-N -1 1 309.837 4.015 20 0 DIADMM CCSc1ccccc1CSc1nc(CC)cc(=O)[n-]1 ZINC001613723432 1056401106 /nfs/dbraw/zinc/40/11/06/1056401106.db2.gz MYCGPDRDANVWST-UHFFFAOYSA-N -1 1 306.456 4.149 20 0 DIADMM CCc1ccccc1CCSc1nc(C(F)F)cc(=O)[n-]1 ZINC001613840136 1056413804 /nfs/dbraw/zinc/41/38/04/1056413804.db2.gz UKLMYQUXBOFYJI-UHFFFAOYSA-N -1 1 310.369 4.017 20 0 DIADMM CCSCc1cccc(NC(=O)c2cccc([O-])c2F)c1 ZINC001544367689 1056414717 /nfs/dbraw/zinc/41/47/17/1056414717.db2.gz HNIKENUTAJOCES-UHFFFAOYSA-N -1 1 305.374 4.037 20 0 DIADMM O=C(N[C@@H](c1ccccc1)C1CCCC1)c1ccc(F)c([O-])c1 ZINC001544547343 1056453222 /nfs/dbraw/zinc/45/32/22/1056453222.db2.gz OLEOMJORKGADGI-SFHVURJKSA-N -1 1 313.372 4.193 20 0 DIADMM CCCOc1ccc(NC(=O)c2cccc([O-])c2F)cc1Cl ZINC001626217328 1056457920 /nfs/dbraw/zinc/45/79/20/1056457920.db2.gz PGDMYTQMDRUVJR-UHFFFAOYSA-N -1 1 323.751 4.226 20 0 DIADMM CCCC[C@@H](CC)CCCN(C)C(=O)c1ncc(C)cc1[O-] ZINC001585044646 1056472807 /nfs/dbraw/zinc/47/28/07/1056472807.db2.gz XSZTYGQHYFEHOM-OAHLLOKOSA-N -1 1 306.450 4.164 20 0 DIADMM O=C(/C=C/c1cccnc1)Nc1cc(Cl)c([O-])c2ccccc12 ZINC001585193033 1056503474 /nfs/dbraw/zinc/50/34/74/1056503474.db2.gz IJLVNJVRSYDURP-BQYQJAHWSA-N -1 1 324.767 4.246 20 0 DIADMM Cc1ccccc1[C@H]1CCCN1C(=O)c1cc(Cl)ccc1[O-] ZINC001544805499 1056504977 /nfs/dbraw/zinc/50/49/77/1056504977.db2.gz BOWBCPYEUNNCGK-MRXNPFEDSA-N -1 1 315.800 4.331 20 0 DIADMM CC(C)(C)Sc1ccc(NC(=O)c2ccc(O)cc2[O-])cc1 ZINC001544883587 1056520037 /nfs/dbraw/zinc/52/00/37/1056520037.db2.gz POWYJFJLMZBBNM-UHFFFAOYSA-N -1 1 317.410 4.241 20 0 DIADMM O=c1cc(Nc2cc(F)c([O-])c(Cl)c2)c2ccccc2[nH]1 ZINC001214482721 1056557017 /nfs/dbraw/zinc/55/70/17/1056557017.db2.gz KIKPKNLAMDKIBC-UHFFFAOYSA-N -1 1 304.708 4.182 20 0 DIADMM CCc1cccc([N-]S(=O)(=O)c2ccc3ccccc3c2)c1 ZINC000007057458 1056566309 /nfs/dbraw/zinc/56/63/09/1056566309.db2.gz YIIMCGBTRAJZEP-UHFFFAOYSA-N -1 1 311.406 4.203 20 0 DIADMM C[C@H]1CC[C@H](c2ccccc2)N(C(=O)c2ccc([O-])c(F)c2)C1 ZINC000672228015 1056572467 /nfs/dbraw/zinc/57/24/67/1056572467.db2.gz OSQPHPOKHOTOGR-SUMWQHHRSA-N -1 1 313.372 4.145 20 0 DIADMM O=c1ccc2cc(Nc3cc(F)c([O-])c(Cl)c3)c[nH]c-2c1 ZINC001214484155 1056575506 /nfs/dbraw/zinc/57/55/06/1056575506.db2.gz BIMZMTHOOYAFOK-UHFFFAOYSA-N -1 1 304.708 4.182 20 0 DIADMM Cc1ccc(-n2nccc2Nc2cc(F)c([O-])c(Cl)c2)cc1 ZINC001214484339 1056580669 /nfs/dbraw/zinc/58/06/69/1056580669.db2.gz HUZZYOJVHFLOGP-UHFFFAOYSA-N -1 1 317.751 4.422 20 0 DIADMM [O-]c1c(Cl)nccc1Nc1cc(F)c(OC(F)F)c(F)c1 ZINC001212446719 1056584812 /nfs/dbraw/zinc/58/48/12/1056584812.db2.gz JLPUXMQVBYOJPS-UHFFFAOYSA-N -1 1 322.645 4.064 20 0 DIADMM CCC1(CC)CCCN(C(=O)Cc2ccc([O-])c(Cl)c2)CC1 ZINC001616354600 1056640476 /nfs/dbraw/zinc/64/04/76/1056640476.db2.gz KYFCHVTUUOEPCS-UHFFFAOYSA-N -1 1 323.864 4.407 20 0 DIADMM CCOc1ccc(-c2ccc(-c3cc(F)ccc3[O-])nn2)cc1 ZINC001240695217 1056645400 /nfs/dbraw/zinc/64/54/00/1056645400.db2.gz FSGMOUYHFICGEY-UHFFFAOYSA-N -1 1 310.328 4.054 20 0 DIADMM [O-]c1ccc(F)cc1-c1ncnc2ccc(C(F)(F)F)cc21 ZINC001240693722 1056645543 /nfs/dbraw/zinc/64/55/43/1056645543.db2.gz XBDFZTPSWITRBA-UHFFFAOYSA-N -1 1 308.234 4.160 20 0 DIADMM COC(=O)c1cc(-c2ccccc2)nc(-c2cc(F)ccc2[O-])c1 ZINC001240693805 1056645776 /nfs/dbraw/zinc/64/57/76/1056645776.db2.gz IEOAKTLJHYOECU-UHFFFAOYSA-N -1 1 323.323 4.047 20 0 DIADMM [O-]c1ccc(F)cc1-c1nnc(-c2ccco2)cc1C(F)(F)F ZINC001240695796 1056647619 /nfs/dbraw/zinc/64/76/19/1056647619.db2.gz SLPBAXBAKCXUDA-UHFFFAOYSA-N -1 1 324.233 4.267 20 0 DIADMM [O-]c1ccc(F)cc1-c1cc(SCc2ccccc2)ncn1 ZINC001240696411 1056647976 /nfs/dbraw/zinc/64/79/76/1056647976.db2.gz PCBPVWCYEQLFHE-UHFFFAOYSA-N -1 1 312.369 4.281 20 0 DIADMM COc1c(F)ccc(Nc2cc(F)c([O-])c(Cl)c2)c1F ZINC001214489283 1056694385 /nfs/dbraw/zinc/69/43/85/1056694385.db2.gz AHGFIEXPABNNOF-UHFFFAOYSA-N -1 1 303.667 4.215 20 0 DIADMM Cc1ccccc1-c1nc2c(ncnc2-c2ccc([O-])c(F)c2)o1 ZINC001240783048 1056695286 /nfs/dbraw/zinc/69/52/86/1056695286.db2.gz NXPGGLWNZNLETR-UHFFFAOYSA-N -1 1 321.311 4.105 20 0 DIADMM CSc1cnc(-c2ccc([O-])c(F)c2)c(C(F)(F)F)c1 ZINC001240783309 1056695646 /nfs/dbraw/zinc/69/56/46/1056695646.db2.gz UGHOLZKPFFCWFR-UHFFFAOYSA-N -1 1 303.280 4.334 20 0 DIADMM Cc1nc2sc3c(c2c(-c2ccc([O-])c(F)c2)n1)CCCC3 ZINC001240783080 1056696213 /nfs/dbraw/zinc/69/62/13/1056696213.db2.gz PHRIYFFCHCYTIF-UHFFFAOYSA-N -1 1 314.385 4.390 20 0 DIADMM Cc1nc(-c2ccc([O-])c(F)c2)nc(C)c1Cc1ccccc1 ZINC001240786137 1056697734 /nfs/dbraw/zinc/69/77/34/1056697734.db2.gz NKEHDNKZMHEJNG-UHFFFAOYSA-N -1 1 308.356 4.196 20 0 DIADMM COc1c(F)cc(Nc2cc(F)c([O-])c(Cl)c2)cc1F ZINC001214490384 1056713963 /nfs/dbraw/zinc/71/39/63/1056713963.db2.gz VMTLXNVPYLYRLW-UHFFFAOYSA-N -1 1 303.667 4.215 20 0 DIADMM CCSc1ccc([C@@H](C)NC(=O)c2ccc(F)c([O-])c2)cc1 ZINC001616792486 1056717916 /nfs/dbraw/zinc/71/79/16/1056717916.db2.gz AWDXPLIBWQIBKC-LLVKDONJSA-N -1 1 319.401 4.134 20 0 DIADMM O=C([O-])c1ccc(-c2ccc3[nH]c(C(F)(F)F)nc3c2)s1 ZINC001240847754 1056727421 /nfs/dbraw/zinc/72/74/21/1056727421.db2.gz JGYSGPDFCASDPE-UHFFFAOYSA-N -1 1 312.272 4.008 20 0 DIADMM CC(C)C[C@@H]1CCCCCN1C(=O)c1c([O-])cccc1Cl ZINC001586491627 1056747371 /nfs/dbraw/zinc/74/73/71/1056747371.db2.gz XXQACPSEGOLLID-ZDUSSCGKSA-N -1 1 309.837 4.477 20 0 DIADMM Cc1cccc([C@@H](C)NC(=O)c2cc(Cl)ccc2[O-])c1C ZINC001617074075 1056772458 /nfs/dbraw/zinc/77/24/58/1056772458.db2.gz SKJFWLLOTMFGBS-GFCCVEGCSA-N -1 1 303.789 4.153 20 0 DIADMM O=C(N[C@@H]1C[C@@H]1C1CCCCC1)c1cc2ccccc2cc1[O-] ZINC001587112001 1056859996 /nfs/dbraw/zinc/85/99/96/1056859996.db2.gz HFGJIEIEXTWLBL-SJLPKXTDSA-N -1 1 309.409 4.244 20 0 DIADMM O=C(Nc1c([O-])cccc1F)c1cccc(Cl)c1Cl ZINC000078807011 1056879174 /nfs/dbraw/zinc/87/91/74/1056879174.db2.gz LZAWVTIBYJUCJY-UHFFFAOYSA-N -1 1 300.116 4.090 20 0 DIADMM [O-]c1cc(F)c(-c2ncnc3sc4c(c32)CCCC4)c(F)c1 ZINC001241116588 1056903384 /nfs/dbraw/zinc/90/33/84/1056903384.db2.gz CDLSDGDSNDPJJA-UHFFFAOYSA-N -1 1 318.348 4.221 20 0 DIADMM Cc1cc(-c2cccc(F)c2)nnc1-c1c(F)cc([O-])cc1F ZINC001241118721 1056904950 /nfs/dbraw/zinc/90/49/50/1056904950.db2.gz FFIQLRVZQZBNAV-UHFFFAOYSA-N -1 1 316.282 4.242 20 0 DIADMM COc1cc2cnc(-c3c(F)cc([O-])cc3F)cc2cc1F ZINC001241119458 1056905102 /nfs/dbraw/zinc/90/51/02/1056905102.db2.gz OLJWVVNXZFGBQO-UHFFFAOYSA-N -1 1 305.255 4.033 20 0 DIADMM [O-]c1cc(F)c(-c2ccc3nc(C(F)(F)F)[nH]c3c2)c(F)c1 ZINC001241121731 1056906107 /nfs/dbraw/zinc/90/61/07/1056906107.db2.gz DTKXHJAXTCMNKF-UHFFFAOYSA-N -1 1 314.213 4.233 20 0 DIADMM Cc1c(NC(=O)C(C)(C)C)ccnc1-c1c(F)cc([O-])cc1F ZINC001241119731 1056906384 /nfs/dbraw/zinc/90/63/84/1056906384.db2.gz JIHZQQBBFABFFF-UHFFFAOYSA-N -1 1 320.339 4.025 20 0 DIADMM COc1cc(OC(F)(F)F)ccc1-c1c(F)cc([O-])cc1F ZINC001241121920 1056906857 /nfs/dbraw/zinc/90/68/57/1056906857.db2.gz SQGSASCNGGGNDH-UHFFFAOYSA-N -1 1 320.213 4.245 20 0 DIADMM CCOC(=O)c1nc2cc(-c3ccc(OCC)c(C)c3)ccc2[n-]1 ZINC001241198358 1056954231 /nfs/dbraw/zinc/95/42/31/1056954231.db2.gz ICVVWMTXHMNHAK-UHFFFAOYSA-N -1 1 324.380 4.114 20 0 DIADMM CCOC(=O)c1nc2ccc(-c3ccc(OCC)c(C)c3)cc2[n-]1 ZINC001241198358 1056954237 /nfs/dbraw/zinc/95/42/37/1056954237.db2.gz ICVVWMTXHMNHAK-UHFFFAOYSA-N -1 1 324.380 4.114 20 0 DIADMM COC(=O)c1nc2cc(-c3ccc(OC(C)C)c(C)c3)ccc2[n-]1 ZINC001241220985 1056967701 /nfs/dbraw/zinc/96/77/01/1056967701.db2.gz FCPJVYYJCWFVNY-UHFFFAOYSA-N -1 1 324.380 4.112 20 0 DIADMM COC(=O)c1nc2ccc(-c3ccc(OC(C)C)c(C)c3)cc2[n-]1 ZINC001241220985 1056967705 /nfs/dbraw/zinc/96/77/05/1056967705.db2.gz FCPJVYYJCWFVNY-UHFFFAOYSA-N -1 1 324.380 4.112 20 0 DIADMM O=C([O-])c1cc(-c2cccc3nc(C(F)(F)F)[nH]c32)ccc1F ZINC001241247207 1056978926 /nfs/dbraw/zinc/97/89/26/1056978926.db2.gz NUSLNKZBLQXSEH-UHFFFAOYSA-N -1 1 324.233 4.086 20 0 DIADMM [O-]c1ccc(F)c(-c2nc(C(F)F)nc3ccccc32)c1F ZINC001241290487 1056998476 /nfs/dbraw/zinc/99/84/76/1056998476.db2.gz SYIUZVGSXSVQBB-UHFFFAOYSA-N -1 1 308.234 4.218 20 0 DIADMM CC(C)c1cc2c(ncnc2-c2c(F)ccc([O-])c2F)s1 ZINC001241289990 1056998698 /nfs/dbraw/zinc/99/86/98/1056998698.db2.gz GWSJFFXTCHOBBP-UHFFFAOYSA-N -1 1 306.337 4.466 20 0 DIADMM CCc1cncc(-c2ccc([C@H](C)[N-]C(=O)C(F)(F)F)cc2)c1 ZINC001241386774 1057033464 /nfs/dbraw/zinc/03/34/64/1057033464.db2.gz UXOZVZLSNLVCOY-NSHDSACASA-N -1 1 322.330 4.051 20 0 DIADMM COc1ccc([C@H](C)[NH2+]Cc2cccc(O)c2Cl)cc1C ZINC000922672067 1057045926 /nfs/dbraw/zinc/04/59/26/1057045926.db2.gz KUGBLGZOFXVCKM-LBPRGKRZSA-N -1 1 305.805 4.213 20 0 DIADMM O=C([N-]c1cc(Cl)c(Cl)cc1F)c1c(F)ccnc1F ZINC001128516983 1057083548 /nfs/dbraw/zinc/08/35/48/1057083548.db2.gz UVBCDYDABOGQEV-UHFFFAOYSA-N -1 1 321.085 4.058 20 0 DIADMM CC(C)(C)C[C@@H]1CCN(C(=O)c2cc3ccccc3cc2[O-])C1 ZINC000307770528 1057186583 /nfs/dbraw/zinc/18/65/83/1057186583.db2.gz FXDQXVFKOWDCNM-AWEZNQCLSA-N -1 1 311.425 4.444 20 0 DIADMM COC(=O)c1nc2cc(-c3ccc(F)c4ccccc43)ccc2[n-]1 ZINC001241901399 1057204617 /nfs/dbraw/zinc/20/46/17/1057204617.db2.gz BXQKMFLLBKBBRF-UHFFFAOYSA-N -1 1 320.323 4.309 20 0 DIADMM COC(=O)c1nc2ccc(-c3ccc(F)c4ccccc43)cc2[n-]1 ZINC001241901399 1057204624 /nfs/dbraw/zinc/20/46/24/1057204624.db2.gz BXQKMFLLBKBBRF-UHFFFAOYSA-N -1 1 320.323 4.309 20 0 DIADMM [O-]c1ccc(C(F)(F)F)cc1-c1cccc(C(F)(F)F)n1 ZINC001242127199 1057271556 /nfs/dbraw/zinc/27/15/56/1057271556.db2.gz WPSQCWHFEMADCO-UHFFFAOYSA-N -1 1 307.193 4.492 20 0 DIADMM [O-]c1ccc(C(F)(F)F)cc1-c1ccc(OC(F)F)cn1 ZINC001242131417 1057273668 /nfs/dbraw/zinc/27/36/68/1057273668.db2.gz JLLAPMGOHUYZBY-UHFFFAOYSA-N -1 1 305.202 4.074 20 0 DIADMM [O-]c1ccc(C(F)(F)F)cc1-c1cnc2cc(F)ccc2n1 ZINC001242131123 1057273803 /nfs/dbraw/zinc/27/38/03/1057273803.db2.gz CQWLMGGKAULSRH-UHFFFAOYSA-N -1 1 308.234 4.160 20 0 DIADMM [O-]c1ccc(C(F)(F)F)cc1-c1ncccc1-n1cccc1 ZINC001242131525 1057273856 /nfs/dbraw/zinc/27/38/56/1057273856.db2.gz GRTMMAPFWAUCDY-UHFFFAOYSA-N -1 1 304.271 4.264 20 0 DIADMM COc1cccc2ncnc(-c3cc(C(F)(F)F)ccc3[O-])c21 ZINC001242133903 1057274731 /nfs/dbraw/zinc/27/47/31/1057274731.db2.gz NOXAWQZGJBMPMA-UHFFFAOYSA-N -1 1 320.270 4.030 20 0 DIADMM Cc1cc2cccnc2c(-c2cc(C(F)(F)F)ccc2[O-])n1 ZINC001242134023 1057274913 /nfs/dbraw/zinc/27/49/13/1057274913.db2.gz ORSLYVGQAQBDSD-UHFFFAOYSA-N -1 1 304.271 4.330 20 0 DIADMM Cc1nsc2nc(-c3cc(C(F)(F)F)ccc3[O-])ccc12 ZINC001242132307 1057274982 /nfs/dbraw/zinc/27/49/82/1057274982.db2.gz QDNXKXJZXDNUFX-UHFFFAOYSA-N -1 1 310.300 4.391 20 0 DIADMM [O-]c1ccc(-c2ncccc2C(F)(F)F)cc1C(F)(F)F ZINC001242147874 1057280195 /nfs/dbraw/zinc/28/01/95/1057280195.db2.gz HIWMBRUUXCDMIQ-UHFFFAOYSA-N -1 1 307.193 4.492 20 0 DIADMM Cc1cccc2ncc(-c3ccc([O-])c(C(F)(F)F)c3)nc12 ZINC001242151669 1057280904 /nfs/dbraw/zinc/28/09/04/1057280904.db2.gz TWZDBKUEUAHYBE-UHFFFAOYSA-N -1 1 304.271 4.330 20 0 DIADMM [O-]c1ccc(-c2nncc3ccc(F)cc32)cc1C(F)(F)F ZINC001242151397 1057280912 /nfs/dbraw/zinc/28/09/12/1057280912.db2.gz LZGPJOUPJSLRMK-UHFFFAOYSA-N -1 1 308.234 4.160 20 0 DIADMM Cc1nc(-c2ccc([O-])c(C(F)(F)F)c2)nc2ccccc12 ZINC001242151205 1057280958 /nfs/dbraw/zinc/28/09/58/1057280958.db2.gz HPAOGWUBJSHXPZ-UHFFFAOYSA-N -1 1 304.271 4.330 20 0 DIADMM [O-]c1ccc(-c2ncnc3c(F)cccc32)cc1C(F)(F)F ZINC001242151571 1057281035 /nfs/dbraw/zinc/28/10/35/1057281035.db2.gz PTPPDMNUBWASMQ-UHFFFAOYSA-N -1 1 308.234 4.160 20 0 DIADMM Cc1nc2c(c(-c3ccc([O-])c(C(F)(F)F)c3)n1)CCCC2 ZINC001242152652 1057281957 /nfs/dbraw/zinc/28/19/57/1057281957.db2.gz IJTIHMYNFWQNLJ-UHFFFAOYSA-N -1 1 308.303 4.055 20 0 DIADMM CCOC(=O)Cc1ccc(Nc2cc([O-])c(Cl)cc2F)cc1 ZINC001212520707 1057287573 /nfs/dbraw/zinc/28/75/73/1057287573.db2.gz MRUIVYMOSNHZIH-UHFFFAOYSA-N -1 1 323.751 4.034 20 0 DIADMM Cc1ccc(Oc2nc(-c3cccc(C)c3[O-])ncc2F)cc1 ZINC001242345274 1057340297 /nfs/dbraw/zinc/34/02/97/1057340297.db2.gz NRYVLPBPAYDMPR-UHFFFAOYSA-N -1 1 310.328 4.397 20 0 DIADMM Cc1cccc(-c2ncc(F)c(Oc3ccc(F)cc3)n2)c1[O-] ZINC001242344865 1057340348 /nfs/dbraw/zinc/34/03/48/1057340348.db2.gz DMVOUXCAIFZZHV-UHFFFAOYSA-N -1 1 314.291 4.228 20 0 DIADMM Cc1cccc(-c2nccc(-c3cn(C)c4ccccc34)n2)c1[O-] ZINC001242344339 1057340388 /nfs/dbraw/zinc/34/03/88/1057340388.db2.gz USZQXXFZQZTBGZ-UHFFFAOYSA-N -1 1 315.376 4.316 20 0 DIADMM [O-]c1c(Cl)cccc1-c1cccc(-c2cc[nH]c(=S)n2)c1 ZINC001242365462 1057347015 /nfs/dbraw/zinc/34/70/15/1057347015.db2.gz DOPZPHOQKKCSCE-UHFFFAOYSA-N -1 1 314.797 4.458 20 0 DIADMM CCOC(=O)/C=C/c1ccc(-c2cccc(Cl)c2[O-])c(F)c1 ZINC001242365601 1057347544 /nfs/dbraw/zinc/34/75/44/1057347544.db2.gz GEVRPJQKBACRJG-VQHVLOKHSA-N -1 1 320.747 4.428 20 0 DIADMM O=C(c1ccc(-c2cccc(Cl)c2[O-])cc1)N1CCCCC1 ZINC001242365947 1057347580 /nfs/dbraw/zinc/34/75/80/1057347580.db2.gz BXDUVLIXUAXJTQ-UHFFFAOYSA-N -1 1 315.800 4.339 20 0 DIADMM CCOC(=O)c1noc2cc(-c3cccc(Cl)c3[O-])ccc21 ZINC001242366674 1057348924 /nfs/dbraw/zinc/34/89/24/1057348924.db2.gz CICXMXZFQICUIV-UHFFFAOYSA-N -1 1 317.728 4.031 20 0 DIADMM CCOC(=O)/C=C/c1cccc(-c2cccc(Cl)c2[O-])c1 ZINC001242367028 1057348976 /nfs/dbraw/zinc/34/89/76/1057348976.db2.gz HIDGVQJMHQOWBL-MDZDMXLPSA-N -1 1 302.757 4.289 20 0 DIADMM CC(C)(C)c1ccc(CC(=O)Nc2c([O-])cccc2F)cc1 ZINC000676051282 1057445107 /nfs/dbraw/zinc/44/51/07/1057445107.db2.gz RYTXAWUSQQFAPK-UHFFFAOYSA-N -1 1 301.361 4.010 20 0 DIADMM COc1cc2cnc(-c3cccc([O-])c3Cl)cc2cc1OC ZINC001242800039 1057481053 /nfs/dbraw/zinc/48/10/53/1057481053.db2.gz CFBMXESGSHGUNE-UHFFFAOYSA-N -1 1 315.756 4.278 20 0 DIADMM CSc1ncc2cc(-c3cccc([O-])c3Cl)ccc2n1 ZINC001242801300 1057481676 /nfs/dbraw/zinc/48/16/76/1057481676.db2.gz XCEVAWJDGYHABJ-UHFFFAOYSA-N -1 1 302.786 4.378 20 0 DIADMM CCOC(=O)CCc1ccccc1-c1cccc([O-])c1Cl ZINC001242800161 1057481754 /nfs/dbraw/zinc/48/17/54/1057481754.db2.gz DDSAZIHKIIMBSS-UHFFFAOYSA-N -1 1 304.773 4.208 20 0 DIADMM COc1cc2ccc(-c3cccc([O-])c3Cl)nc2cc1OC ZINC001242801213 1057481826 /nfs/dbraw/zinc/48/18/26/1057481826.db2.gz QENDMEPYGWXMFD-UHFFFAOYSA-N -1 1 315.756 4.278 20 0 DIADMM COc1cc(F)cc2ccc(-c3cccc([O-])c3Cl)nc21 ZINC001242801184 1057482191 /nfs/dbraw/zinc/48/21/91/1057482191.db2.gz PWMXOSRPAPELCN-UHFFFAOYSA-N -1 1 303.720 4.409 20 0 DIADMM [O-]c1cccc(-c2ncnc3sc4c(c32)CCC4)c1Cl ZINC001242800506 1057482211 /nfs/dbraw/zinc/48/22/11/1057482211.db2.gz HHPUDJLRPFROPN-UHFFFAOYSA-N -1 1 302.786 4.206 20 0 DIADMM COc1ccccc1-c1cc(-c2cccc([O-])c2Cl)ncn1 ZINC001242801238 1057482338 /nfs/dbraw/zinc/48/23/38/1057482338.db2.gz OVFGGAMGFHJIEL-UHFFFAOYSA-N -1 1 312.756 4.178 20 0 DIADMM CC1(C)CC(=O)Nc2cccc(-c3cccc([O-])c3Cl)c21 ZINC001242802343 1057483175 /nfs/dbraw/zinc/48/31/75/1057483175.db2.gz XKRSFQWOJHGDPQ-UHFFFAOYSA-N -1 1 301.773 4.332 20 0 DIADMM CC1(C)CC(=O)Nc2cc(-c3cccc([O-])c3Cl)ccc21 ZINC001242802096 1057483291 /nfs/dbraw/zinc/48/32/91/1057483291.db2.gz QMIZPJZYKNUMMZ-UHFFFAOYSA-N -1 1 301.773 4.332 20 0 DIADMM COC(=O)c1ccc(C2CC2)c(-c2cccc([O-])c2Cl)c1 ZINC001242803067 1057483323 /nfs/dbraw/zinc/48/33/23/1057483323.db2.gz LWDSPTNSAOHYIE-UHFFFAOYSA-N -1 1 302.757 4.377 20 0 DIADMM CC1(C)CC(=O)Nc2c(-c3cccc([O-])c3Cl)cccc21 ZINC001242802706 1057483430 /nfs/dbraw/zinc/48/34/30/1057483430.db2.gz GFJGTOBELOPQLM-UHFFFAOYSA-N -1 1 301.773 4.332 20 0 DIADMM CCOC(=O)c1nc2cc(-c3ccccc3SC)ccc2[n-]1 ZINC001242944949 1057526027 /nfs/dbraw/zinc/52/60/27/1057526027.db2.gz ZRXWUBMTXCDSIB-UHFFFAOYSA-N -1 1 312.394 4.129 20 0 DIADMM CCOC(=O)c1nc2ccc(-c3ccccc3SC)cc2[n-]1 ZINC001242944949 1057526029 /nfs/dbraw/zinc/52/60/29/1057526029.db2.gz ZRXWUBMTXCDSIB-UHFFFAOYSA-N -1 1 312.394 4.129 20 0 DIADMM Cc1cccc2c(-c3ccnc(-c4ccc(F)c([O-])c4)n3)c[nH]c21 ZINC001243054828 1057559501 /nfs/dbraw/zinc/55/95/01/1057559501.db2.gz VBXURVXOQDLZOR-UHFFFAOYSA-N -1 1 319.339 4.445 20 0 DIADMM Cn1cc(-c2ccnc(-c3ccc(F)c([O-])c3)n2)c2ccccc21 ZINC001243053433 1057559543 /nfs/dbraw/zinc/55/95/43/1057559543.db2.gz DEPKMIQMFCCEMT-UHFFFAOYSA-N -1 1 319.339 4.147 20 0 DIADMM Cc1cccc2nc(-c3cc(C)c4ccccc4n3)[n-]c(=O)c12 ZINC000487512712 1057573122 /nfs/dbraw/zinc/57/31/22/1057573122.db2.gz ZSQQMUPAXZVMTR-UHFFFAOYSA-N -1 1 301.349 4.167 20 0 DIADMM Cc1nc2ccc(-c3ccc(C(=O)[O-])c(C(F)(F)F)c3)cc2[nH]1 ZINC001243155361 1057588526 /nfs/dbraw/zinc/58/85/26/1057588526.db2.gz JGVFGMRHFDSEJK-UHFFFAOYSA-N -1 1 320.270 4.255 20 0 DIADMM Cc1cc(-c2ccc3nc(C(F)(F)F)[nH]c3c2)ccc1C(=O)[O-] ZINC001243215414 1057607869 /nfs/dbraw/zinc/60/78/69/1057607869.db2.gz ZFQIJXZTTZLARQ-UHFFFAOYSA-N -1 1 320.270 4.255 20 0 DIADMM COc1cc2cnc(-c3ccc([O-])c(F)c3F)cc2cc1F ZINC001243340443 1057652205 /nfs/dbraw/zinc/65/22/05/1057652205.db2.gz XRYOWNAQNRDFTR-UHFFFAOYSA-N -1 1 305.255 4.033 20 0 DIADMM [O-]c1ccc(-c2cncc(OCc3ccccc3)c2)c(F)c1F ZINC001243342203 1057652823 /nfs/dbraw/zinc/65/28/23/1057652823.db2.gz FNAMATUDRBYFRH-UHFFFAOYSA-N -1 1 313.303 4.311 20 0 DIADMM CCOC(OCC)c1ccccc1-c1ccc([O-])c(F)c1F ZINC001243342392 1057653283 /nfs/dbraw/zinc/65/32/83/1057653283.db2.gz IQLOPKKONJJJRK-UHFFFAOYSA-N -1 1 308.324 4.409 20 0 DIADMM COc1ccc(C(F)(F)F)cc1-c1ccc([O-])c(F)c1F ZINC001243342136 1057653367 /nfs/dbraw/zinc/65/33/67/1057653367.db2.gz CTEVLVWYTGPSFN-UHFFFAOYSA-N -1 1 304.214 4.365 20 0 DIADMM CCC[C@H](Cc1ccccc1)NC(=O)c1c([O-])cccc1Cl ZINC000727860697 1057678495 /nfs/dbraw/zinc/67/84/95/1057678495.db2.gz GKUPMJVRLLQJKM-CQSZACIVSA-N -1 1 317.816 4.187 20 0 DIADMM [O-]c1c(F)cc(F)cc1-c1ccnc2[nH]cc(C(F)(F)F)c21 ZINC001243503857 1057696650 /nfs/dbraw/zinc/69/66/50/1057696650.db2.gz IBDDUABDIVMCRB-UHFFFAOYSA-N -1 1 314.213 4.184 20 0 DIADMM COC(=O)c1ccc2cc(-c3cc(F)cc(F)c3[O-])ccc2c1 ZINC001243503938 1057696770 /nfs/dbraw/zinc/69/67/70/1057696770.db2.gz WFQDJBRMJCQGFX-UHFFFAOYSA-N -1 1 314.287 4.277 20 0 DIADMM [O-]c1c(F)cc(F)cc1-c1ccc(OC(F)(F)F)cc1F ZINC001243503700 1057696779 /nfs/dbraw/zinc/69/67/79/1057696779.db2.gz KNOLREIXFUAUJG-UHFFFAOYSA-N -1 1 308.177 4.375 20 0 DIADMM COC(=O)c1cc2ccc(-c3cc(F)cc(F)c3[O-])cc2s1 ZINC001243503271 1057696949 /nfs/dbraw/zinc/69/69/49/1057696949.db2.gz UEVKXLSBXLOFQC-UHFFFAOYSA-N -1 1 320.316 4.339 20 0 DIADMM COc1ccc(-c2cccnc2)cc1-c1cc(F)cc(F)c1[O-] ZINC001243502693 1057697099 /nfs/dbraw/zinc/69/70/99/1057697099.db2.gz OLOWZCMRZGISAO-UHFFFAOYSA-N -1 1 313.303 4.408 20 0 DIADMM COc1ccc(-c2cc(F)cc(F)c2[O-])c(C(F)(F)F)c1 ZINC001243501831 1057697231 /nfs/dbraw/zinc/69/72/31/1057697231.db2.gz COKIDFKLULPBML-UHFFFAOYSA-N -1 1 304.214 4.365 20 0 DIADMM COC(=O)c1ccc(C(C)C)c(-c2cc(F)cc(F)c2[O-])c1 ZINC001243504396 1057697602 /nfs/dbraw/zinc/69/76/02/1057697602.db2.gz LXEXGYQOQIUJNE-UHFFFAOYSA-N -1 1 306.308 4.247 20 0 DIADMM CCOC(=O)/C=C/c1ccc(-c2cc(F)cc(F)c2[O-])c(F)c1 ZINC001243506491 1057697888 /nfs/dbraw/zinc/69/78/88/1057697888.db2.gz WWSDQDONHOFMAI-GQCTYLIASA-N -1 1 322.282 4.053 20 0 DIADMM COc1ncc(-c2ccccc2)cc1-c1cc(F)cc(F)c1[O-] ZINC001243507328 1057698382 /nfs/dbraw/zinc/69/83/82/1057698382.db2.gz XGHKBQIVQNQJCO-UHFFFAOYSA-N -1 1 313.303 4.408 20 0 DIADMM Cc1cccc2c(-c3ccnc(-c4cccc([O-])c4F)n3)c[nH]c21 ZINC001243541597 1057708533 /nfs/dbraw/zinc/70/85/33/1057708533.db2.gz GWMJVUHZKDLKBI-UHFFFAOYSA-N -1 1 319.339 4.445 20 0 DIADMM CC(C)(C)C(=O)Nc1cccc(-c2ccc(Cl)c([O-])c2)n1 ZINC001243576776 1057720712 /nfs/dbraw/zinc/72/07/12/1057720712.db2.gz MWWIQODGWKMZCP-UHFFFAOYSA-N -1 1 304.777 4.092 20 0 DIADMM COc1cc(C(F)(F)F)cc(-c2ccc(Cl)c([O-])c2)n1 ZINC001243576063 1057720790 /nfs/dbraw/zinc/72/07/90/1057720790.db2.gz APNFNHQDKVAIMC-UHFFFAOYSA-N -1 1 303.667 4.135 20 0 DIADMM COC(=O)c1ccc(-c2ccc(Cl)c([O-])c2)c2ncccc12 ZINC001243577995 1057721712 /nfs/dbraw/zinc/72/17/12/1057721712.db2.gz IYMWSBTVGNESJG-UHFFFAOYSA-N -1 1 313.740 4.047 20 0 DIADMM COC(=O)C(C)(C)c1cccc(-c2ccc(Cl)c([O-])c2)c1 ZINC001243578343 1057721785 /nfs/dbraw/zinc/72/17/85/1057721785.db2.gz NSMQLFDPMWCLFZ-UHFFFAOYSA-N -1 1 304.773 4.163 20 0 DIADMM COc1ccccc1-c1ccc(-c2ccc(Cl)c([O-])c2)nn1 ZINC001243579674 1057722119 /nfs/dbraw/zinc/72/21/19/1057722119.db2.gz WZFUTYHZDOMGDS-UHFFFAOYSA-N -1 1 312.756 4.178 20 0 DIADMM COc1cc2ccnc(-c3ccc(Cl)c([O-])c3)c2cc1F ZINC001243579871 1057722386 /nfs/dbraw/zinc/72/23/86/1057722386.db2.gz WGGIYMWFGPURIX-UHFFFAOYSA-N -1 1 303.720 4.409 20 0 DIADMM CC(C)(C)OC(=O)Nc1ccc(-c2ccc(Cl)c([O-])c2)nc1 ZINC001243579763 1057722722 /nfs/dbraw/zinc/72/27/22/1057722722.db2.gz ZCUZPWIBVHNHOW-UHFFFAOYSA-N -1 1 320.776 4.455 20 0 DIADMM [O-]c1cc(-c2cnc3nc(C(F)(F)F)oc3c2)ccc1Cl ZINC001243581673 1057723170 /nfs/dbraw/zinc/72/31/70/1057723170.db2.gz QOSNIOBOEXMJOP-UHFFFAOYSA-N -1 1 314.650 4.268 20 0 DIADMM COC(=O)C(C)(C)c1ccc(-c2ccc(Cl)c([O-])c2)cc1 ZINC001243580960 1057723384 /nfs/dbraw/zinc/72/33/84/1057723384.db2.gz HAQXKKWEVAQBLT-UHFFFAOYSA-N -1 1 304.773 4.163 20 0 DIADMM CCOC(=O)c1noc2ccc(-c3ccc(Cl)c([O-])c3)cc21 ZINC001243581883 1057723488 /nfs/dbraw/zinc/72/34/88/1057723488.db2.gz LHYNYSIZHZRNAL-UHFFFAOYSA-N -1 1 317.728 4.031 20 0 DIADMM [O-]c1cc(-c2ccc(N3CCSCC3)cc2)ccc1Cl ZINC001243581601 1057723522 /nfs/dbraw/zinc/72/35/22/1057723522.db2.gz JYZMCCJIGLFQJR-UHFFFAOYSA-N -1 1 305.830 4.266 20 0 DIADMM CCOC(=O)CCc1ccccc1-c1ccc(Cl)c([O-])c1 ZINC001243582148 1057723930 /nfs/dbraw/zinc/72/39/30/1057723930.db2.gz YVKMKANUVMSDNE-UHFFFAOYSA-N -1 1 304.773 4.208 20 0 DIADMM CCOC(=O)c1c[nH]c2c1cccc2-c1ccc(Cl)c([O-])c1 ZINC001243583763 1057724311 /nfs/dbraw/zinc/72/43/11/1057724311.db2.gz LBVQLQFJMHUZDL-UHFFFAOYSA-N -1 1 315.756 4.371 20 0 DIADMM CC1(C)CC(=O)Nc2cc(-c3ccc(Cl)c([O-])c3)ccc21 ZINC001243583897 1057724577 /nfs/dbraw/zinc/72/45/77/1057724577.db2.gz NBCKJYKPHHLITR-UHFFFAOYSA-N -1 1 301.773 4.332 20 0 DIADMM [O-]c1cc(-c2ccc(OCc3ccncc3)nc2)ccc1Cl ZINC001243584349 1057724797 /nfs/dbraw/zinc/72/47/97/1057724797.db2.gz OPEPZRKQTGBYEK-UHFFFAOYSA-N -1 1 312.756 4.082 20 0 DIADMM [O-]c1cc(C(F)(F)F)ccc1-c1ncccc1C1CCOCC1 ZINC001243605614 1057730295 /nfs/dbraw/zinc/73/02/95/1057730295.db2.gz ITVDOACYEVOWPJ-UHFFFAOYSA-N -1 1 323.314 4.367 20 0 DIADMM Cc1csc2ncnc(-c3ccc(C(F)(F)F)cc3[O-])c12 ZINC001243604427 1057730516 /nfs/dbraw/zinc/73/05/16/1057730516.db2.gz JDSGYCUJAZOJTI-UHFFFAOYSA-N -1 1 310.300 4.391 20 0 DIADMM [O-]c1cc(C(F)(F)F)ccc1-c1ncccc1-n1cccc1 ZINC001243607688 1057730931 /nfs/dbraw/zinc/73/09/31/1057730931.db2.gz PQXAWUQZUHJZHA-UHFFFAOYSA-N -1 1 304.271 4.264 20 0 DIADMM [O-]c1cc(C(F)(F)F)ccc1-c1ccc(OC(F)(F)F)cn1 ZINC001243607999 1057731404 /nfs/dbraw/zinc/73/14/04/1057731404.db2.gz FCKYUWOJMMMXBB-UHFFFAOYSA-N -1 1 323.192 4.372 20 0 DIADMM Cc1ccc2ncc(-c3ccc(C(F)(F)F)cc3[O-])nc2c1 ZINC001243608033 1057731492 /nfs/dbraw/zinc/73/14/92/1057731492.db2.gz FKFAXUIPGVOJBZ-UHFFFAOYSA-N -1 1 304.271 4.330 20 0 DIADMM [O-]c1cc(C(F)(F)F)ccc1-c1ccc(COCC2CC2)cn1 ZINC001243610374 1057732129 /nfs/dbraw/zinc/73/21/29/1057732129.db2.gz JUZMAPBDQYTNMT-UHFFFAOYSA-N -1 1 323.314 4.400 20 0 DIADMM CSc1cc(-c2ccc(C(F)(F)F)cc2[O-])ncc1F ZINC001243609905 1057732459 /nfs/dbraw/zinc/73/24/59/1057732459.db2.gz XEVFUSDMTCRTOT-UHFFFAOYSA-N -1 1 303.280 4.334 20 0 DIADMM Cc1ccc(C[C@H](C)NC(=O)c2c([O-])cccc2Cl)c(C)c1 ZINC000731231382 1057738974 /nfs/dbraw/zinc/73/89/74/1057738974.db2.gz MOVVOUGCXATJEM-ZDUSSCGKSA-N -1 1 317.816 4.023 20 0 DIADMM CCOC(=O)c1nc2cc(-c3ccnc(C(C)(C)C)c3)ccc2[n-]1 ZINC001244022573 1057841527 /nfs/dbraw/zinc/84/15/27/1057841527.db2.gz IOHVGUORZGFESP-UHFFFAOYSA-N -1 1 323.396 4.099 20 0 DIADMM CCOC(=O)c1nc2ccc(-c3ccnc(C(C)(C)C)c3)cc2[n-]1 ZINC001244022573 1057841531 /nfs/dbraw/zinc/84/15/31/1057841531.db2.gz IOHVGUORZGFESP-UHFFFAOYSA-N -1 1 323.396 4.099 20 0 DIADMM [O-]c1c(F)cc(-c2ccc(OCc3ccccc3)nc2)cc1F ZINC001244094589 1057866897 /nfs/dbraw/zinc/86/68/97/1057866897.db2.gz VJPKUYKGFJZURP-UHFFFAOYSA-N -1 1 313.303 4.311 20 0 DIADMM COc1ccc(-c2cc(F)c([O-])c(F)c2)cc1C(F)(F)F ZINC001244096738 1057868074 /nfs/dbraw/zinc/86/80/74/1057868074.db2.gz MFNMEIRORVEXCP-UHFFFAOYSA-N -1 1 304.214 4.365 20 0 DIADMM COC(=O)[C@@H](c1ccc(-c2cc(F)c([O-])c(F)c2)cc1)C(C)C ZINC001244097558 1057868475 /nfs/dbraw/zinc/86/84/75/1057868475.db2.gz QUZHMRCOFATIAV-MRXNPFEDSA-N -1 1 320.335 4.250 20 0 DIADMM [O-]c1c(F)cc(-c2cc(F)cc(N3CCCCC3)c2)cc1F ZINC001244099348 1057869420 /nfs/dbraw/zinc/86/94/20/1057869420.db2.gz YMVJWKARGCEVJD-UHFFFAOYSA-N -1 1 307.315 4.467 20 0 DIADMM COC(=O)c1nc2ccc(-c3c(C)cc(C4CC4)cc3F)cc2[n-]1 ZINC001244126713 1057879354 /nfs/dbraw/zinc/87/93/54/1057879354.db2.gz FZWAHJLMNAWMCE-UHFFFAOYSA-N -1 1 324.355 4.341 20 0 DIADMM COC(=O)c1nc2cc(-c3c(C)cc(C4CC4)cc3F)ccc2[n-]1 ZINC001244126713 1057879357 /nfs/dbraw/zinc/87/93/57/1057879357.db2.gz FZWAHJLMNAWMCE-UHFFFAOYSA-N -1 1 324.355 4.341 20 0 DIADMM Cc1cc(C)c(-c2ccc([C@H](C)[N-]C(=O)C(F)(F)F)cc2)cn1 ZINC001244150909 1057887585 /nfs/dbraw/zinc/88/75/85/1057887585.db2.gz YKGPAXZGUUNIPD-LBPRGKRZSA-N -1 1 322.330 4.105 20 0 DIADMM Cc1ccc([O-])c(-c2nc(C)c(Cc3ccccc3)c(C)n2)c1 ZINC001244403403 1057951889 /nfs/dbraw/zinc/95/18/89/1057951889.db2.gz SVFUAXMLBJFQCA-UHFFFAOYSA-N -1 1 304.393 4.365 20 0 DIADMM Cc1ccc(O)c(-c2ccc([C@H](C)[N-]C(=O)C(F)(F)F)cc2)c1 ZINC001244408348 1057952244 /nfs/dbraw/zinc/95/22/44/1057952244.db2.gz IYWBJMQGIVNYQA-NSHDSACASA-N -1 1 323.314 4.107 20 0 DIADMM Cc1cc2cccnc2c(-c2cc(OC(F)(F)F)ccc2[O-])n1 ZINC001244458617 1057963746 /nfs/dbraw/zinc/96/37/46/1057963746.db2.gz UKJQSRWSFDCJCO-UHFFFAOYSA-N -1 1 320.270 4.209 20 0 DIADMM [O-]c1cc(OC(F)(F)F)ccc1-c1ccc(-c2ccco2)nn1 ZINC001244461747 1057964976 /nfs/dbraw/zinc/96/49/76/1057964976.db2.gz DNFQZQPMPIYCEK-UHFFFAOYSA-N -1 1 322.242 4.008 20 0 DIADMM CC(C)(C)c1ccc(-c2ccc(OC(F)(F)F)cc2[O-])nn1 ZINC001244463477 1057965307 /nfs/dbraw/zinc/96/53/07/1057965307.db2.gz RUVFRMMASMGOII-UHFFFAOYSA-N -1 1 312.291 4.045 20 0 DIADMM Cc1cc2ccnc(-c3ccc(OC(F)(F)F)cc3[O-])c2[nH]1 ZINC001244464424 1057966362 /nfs/dbraw/zinc/96/63/62/1057966362.db2.gz KXQKSCBOBWUKHY-UHFFFAOYSA-N -1 1 308.259 4.143 20 0 DIADMM Cc1cc2ccncc2nc1-c1ccc(OC(F)(F)F)cc1[O-] ZINC001244465435 1057966857 /nfs/dbraw/zinc/96/68/57/1057966857.db2.gz WKQDGKGZIBYDHS-UHFFFAOYSA-N -1 1 320.270 4.209 20 0 DIADMM Cc1cc(-c2ccc(C(=O)OC(C)(C)C)cn2)cc(Cl)c1[O-] ZINC001244531195 1057987261 /nfs/dbraw/zinc/98/72/61/1057987261.db2.gz HECZKPPUJWPKKG-UHFFFAOYSA-N -1 1 319.788 4.371 20 0 DIADMM Cc1cc(-c2ncnc3cc(F)cc(F)c32)cc(Cl)c1[O-] ZINC001244535877 1057988543 /nfs/dbraw/zinc/98/85/43/1057988543.db2.gz DLECMOVPDUSDHI-UHFFFAOYSA-N -1 1 306.699 4.242 20 0 DIADMM Cc1cc(-c2cc(C)c([O-])c(Cl)c2)nc(-c2ccncc2)n1 ZINC001244536511 1057989290 /nfs/dbraw/zinc/98/92/90/1057989290.db2.gz KIZSJYRYJPURPN-UHFFFAOYSA-N -1 1 311.772 4.181 20 0 DIADMM CCCN(CCC)c1cc(-c2c(Cl)ccc([O-])c2F)ncn1 ZINC001244537546 1057989380 /nfs/dbraw/zinc/98/93/80/1057989380.db2.gz AKYQLKNUYAYETR-UHFFFAOYSA-N -1 1 323.799 4.268 20 0 DIADMM COc1ccc2c(C)nc(-c3c(Cl)ccc([O-])c3F)nc2c1 ZINC001244539137 1057989571 /nfs/dbraw/zinc/98/95/71/1057989571.db2.gz SPPGLPUOLRCWKV-UHFFFAOYSA-N -1 1 318.735 4.112 20 0 DIADMM CCc1cc2ncnc(-c3c(Cl)ccc([O-])c3F)c2s1 ZINC001244538195 1057989645 /nfs/dbraw/zinc/98/96/45/1057989645.db2.gz KYEKCWBYEVDJMM-UHFFFAOYSA-N -1 1 308.765 4.419 20 0 DIADMM [O-]c1ccc(Cl)c(-c2cccc(OC(F)(F)F)n2)c1F ZINC001244538905 1057989913 /nfs/dbraw/zinc/98/99/13/1057989913.db2.gz PPGYWDSVSXASIR-UHFFFAOYSA-N -1 1 307.630 4.145 20 0 DIADMM Cc1cc(-c2cc(N3CCC[C@H](C)C3)ncn2)cc(Cl)c1[O-] ZINC001244537759 1057989923 /nfs/dbraw/zinc/98/99/23/1057989923.db2.gz FNLCCBMNHXZLAN-NSHDSACASA-N -1 1 317.820 4.047 20 0 DIADMM [O-]c1ccc(Cl)c(-c2ccc(-c3ccccc3)nn2)c1F ZINC001244538488 1057990109 /nfs/dbraw/zinc/99/01/09/1057990109.db2.gz OLENGLGENKRTHX-UHFFFAOYSA-N -1 1 300.720 4.309 20 0 DIADMM COCc1cc(-c2c(Cl)ccc([O-])c2F)nc(C(C)(C)C)n1 ZINC001244539973 1057990469 /nfs/dbraw/zinc/99/04/69/1057990469.db2.gz CAYICIQZUAELPY-UHFFFAOYSA-N -1 1 324.783 4.086 20 0 DIADMM Cc1ccc(-c2ccc(-c3c(Cl)ccc([O-])c3F)nn2)o1 ZINC001244539969 1057990349 /nfs/dbraw/zinc/99/03/49/1057990349.db2.gz BXEILULRAQZGCL-UHFFFAOYSA-N -1 1 304.708 4.210 20 0 DIADMM COC(=O)c1cc(-c2c(Cl)ccc([O-])c2F)c(C)cc1C ZINC001244540514 1057990402 /nfs/dbraw/zinc/99/04/02/1057990402.db2.gz XUXMHHDWNVPSEC-UHFFFAOYSA-N -1 1 308.736 4.255 20 0 DIADMM [O-]c1ccc(Cl)c(-c2nccnc2Oc2ccccc2)c1F ZINC001244539941 1057990456 /nfs/dbraw/zinc/99/04/56/1057990456.db2.gz AOUARXIJSGVQIB-UHFFFAOYSA-N -1 1 316.719 4.434 20 0 DIADMM [O-]c1ccc(Cl)c(-c2cc(C3CC3)nc(C3CC3)n2)c1F ZINC001244540026 1057990718 /nfs/dbraw/zinc/99/07/18/1057990718.db2.gz FTWZDCZHXKJBNI-UHFFFAOYSA-N -1 1 304.752 4.397 20 0 DIADMM CC1(C)Cc2ccc(-c3c(Cl)ccc([O-])c3F)cc2NC1=O ZINC001244540238 1057990767 /nfs/dbraw/zinc/99/07/67/1057990767.db2.gz AEMVSXDEFFUCBX-UHFFFAOYSA-N -1 1 319.763 4.373 20 0 DIADMM COC(=O)c1c(F)cc(C)cc1-c1c(Cl)ccc([O-])c1F ZINC001244540248 1057990857 /nfs/dbraw/zinc/99/08/57/1057990857.db2.gz ANFCTDMFLUFEJO-UHFFFAOYSA-N -1 1 312.699 4.086 20 0 DIADMM CC1(C)NC(=O)Nc2cc(-c3c(F)c([O-])ccc3Cl)ccc21 ZINC001244542073 1057991144 /nfs/dbraw/zinc/99/11/44/1057991144.db2.gz JPOYSPPOFKKNGU-UHFFFAOYSA-N -1 1 320.751 4.222 20 0 DIADMM COC(=O)c1cc(-c2c(Cl)ccc([O-])c2F)cc2cc[nH]c21 ZINC001244540823 1057991497 /nfs/dbraw/zinc/99/14/97/1057991497.db2.gz GRWTZIHRZDGKHM-UHFFFAOYSA-N -1 1 319.719 4.120 20 0 DIADMM [O-]c1ccc(Cl)c(-c2ccc(-c3ccncc3)cn2)c1F ZINC001244540819 1057991542 /nfs/dbraw/zinc/99/15/42/1057991542.db2.gz RZWBIZPFQUHYNR-UHFFFAOYSA-N -1 1 300.720 4.309 20 0 DIADMM COC(=O)c1cc2[nH]ccc2cc1-c1c(Cl)ccc([O-])c1F ZINC001244540948 1057991684 /nfs/dbraw/zinc/99/16/84/1057991684.db2.gz KYNXZXHHUYOOHP-UHFFFAOYSA-N -1 1 319.719 4.120 20 0 DIADMM CC(=O)n1ccc2cc(-c3c(Cl)ccc([O-])c3F)ccc21 ZINC001244541684 1057991698 /nfs/dbraw/zinc/99/16/98/1057991698.db2.gz QDZQJJDTXWNBRA-UHFFFAOYSA-N -1 1 303.720 4.467 20 0 DIADMM [O-]c1ccc(Cl)c(-c2ccc(OCC(F)(F)F)nc2)c1F ZINC001244542763 1057991908 /nfs/dbraw/zinc/99/19/08/1057991908.db2.gz PZWBWMRKPUIHKB-UHFFFAOYSA-N -1 1 321.657 4.188 20 0 DIADMM COc1cc(-c2c(Cl)ccc([O-])c2F)ccc1OC(F)F ZINC001244543728 1057992145 /nfs/dbraw/zinc/99/21/45/1057992145.db2.gz UHSWEGJWGIRHNE-UHFFFAOYSA-N -1 1 318.678 4.462 20 0 DIADMM Cc1noc(-c2ccc(-c3c(Cl)ccc([O-])c3F)cc2F)n1 ZINC001244542764 1057992263 /nfs/dbraw/zinc/99/22/63/1057992263.db2.gz MBPLVOBBRISICS-UHFFFAOYSA-N -1 1 322.698 4.349 20 0 DIADMM [O-]c1ccc(Cl)c(-c2ccc(F)c(-n3ccnc3)c2)c1F ZINC001244543117 1057992278 /nfs/dbraw/zinc/99/22/78/1057992278.db2.gz RCEVDKOZBHNZFH-UHFFFAOYSA-N -1 1 306.699 4.177 20 0 DIADMM O=c1cc(-c2c(F)c([O-])ccc2Cl)ccn1-c1ccccc1 ZINC001244543603 1057992494 /nfs/dbraw/zinc/99/24/94/1057992494.db2.gz VIHMCDXMYPLIOU-UHFFFAOYSA-N -1 1 315.731 4.003 20 0 DIADMM COC(=O)c1cc(F)c(F)c(-c2cc(C)c([O-])c(Cl)c2)c1 ZINC001244550806 1057993775 /nfs/dbraw/zinc/99/37/75/1057993775.db2.gz NFBFLNLGRWAQPX-UHFFFAOYSA-N -1 1 312.699 4.086 20 0 DIADMM Cc1cc(-c2cc(C(=O)[O-])c(Cl)cc2F)cc2nc[nH]c21 ZINC001244611415 1058009253 /nfs/dbraw/zinc/00/92/53/1058009253.db2.gz BMDFCXLJXLAEOR-UHFFFAOYSA-N -1 1 304.708 4.029 20 0 DIADMM COC(=O)c1ccc2c(ccnc2-c2cc(Cl)ccc2[O-])c1 ZINC001245048510 1058102032 /nfs/dbraw/zinc/10/20/32/1058102032.db2.gz CWXIEXIYXSCWRR-UHFFFAOYSA-N -1 1 313.740 4.047 20 0 DIADMM CC(C)(C)OC(=O)Nc1ccc(-c2cc(Cl)ccc2[O-])nc1 ZINC001245047851 1058102138 /nfs/dbraw/zinc/10/21/38/1058102138.db2.gz BFTZKLWLZXPSFL-UHFFFAOYSA-N -1 1 320.776 4.455 20 0 DIADMM C[C@@H]1CCCCN1c1cccc(-c2cc(Cl)ccc2[O-])n1 ZINC001245050205 1058102651 /nfs/dbraw/zinc/10/26/51/1058102651.db2.gz PSOGLZJEONPYBB-GFCCVEGCSA-N -1 1 302.805 4.486 20 0 DIADMM Cc1c(NC(=O)C(C)(C)C)ccnc1-c1cc(Cl)ccc1[O-] ZINC001245049200 1058102748 /nfs/dbraw/zinc/10/27/48/1058102748.db2.gz SEDWJLKCPBHGEG-UHFFFAOYSA-N -1 1 318.804 4.401 20 0 DIADMM COc1ccc(-c2cc(-c3cc(Cl)ccc3[O-])ncn2)cc1 ZINC001245049325 1058102766 /nfs/dbraw/zinc/10/27/66/1058102766.db2.gz JEFZRPRDLRFTRR-UHFFFAOYSA-N -1 1 312.756 4.178 20 0 DIADMM COc1cc2ccnc(-c3cc(Cl)ccc3[O-])c2cc1F ZINC001245051211 1058103118 /nfs/dbraw/zinc/10/31/18/1058103118.db2.gz SRYWTOZWFHGFIB-UHFFFAOYSA-N -1 1 303.720 4.409 20 0 DIADMM COC(=O)c1cc(-c2cc(Cl)ccc2[O-])nc(C(C)(C)C)c1 ZINC001245051229 1058103291 /nfs/dbraw/zinc/10/32/91/1058103291.db2.gz UFHLEZJRUBJOGL-UHFFFAOYSA-N -1 1 319.788 4.192 20 0 DIADMM CCOC(=O)c1nc2cc(-c3cc4c(cccc4C)[nH]3)ccc2[n-]1 ZINC001245341661 1058147556 /nfs/dbraw/zinc/14/75/56/1058147556.db2.gz BLSRAHNAOZDTSZ-UHFFFAOYSA-N -1 1 319.364 4.196 20 0 DIADMM CCOC(=O)c1nc2ccc(-c3cc4c(cccc4C)[nH]3)cc2[n-]1 ZINC001245341661 1058147558 /nfs/dbraw/zinc/14/75/58/1058147558.db2.gz BLSRAHNAOZDTSZ-UHFFFAOYSA-N -1 1 319.364 4.196 20 0 DIADMM CC(C)CCn1c2ccccc2nc1NC(=O)c1ccccc1[O-] ZINC001545171751 1058185738 /nfs/dbraw/zinc/18/57/38/1058185738.db2.gz DIKHEJZRZLLKRL-UHFFFAOYSA-N -1 1 323.396 4.040 20 0 DIADMM Cc1ccccc1[C@@H](NC(=O)c1ccc([O-])c(F)c1)C(C)(C)C ZINC001545295137 1058193380 /nfs/dbraw/zinc/19/33/80/1058193380.db2.gz GFIFNGBXYRJXTG-QGZVFWFLSA-N -1 1 315.388 4.357 20 0 DIADMM [O-]c1ccc(F)c(-c2ccc(COCC3CC3)cn2)c1Cl ZINC001245830913 1058527493 /nfs/dbraw/zinc/52/74/93/1058527493.db2.gz ZDCDNMYFIZROCY-UHFFFAOYSA-N -1 1 307.752 4.173 20 0 DIADMM [O-]c1ccc(F)c(-c2cncc(OC3CCCCC3)n2)c1Cl ZINC001245830921 1058527917 /nfs/dbraw/zinc/52/79/17/1058527917.db2.gz ZOMRJZSLVBNPHB-UHFFFAOYSA-N -1 1 322.767 4.353 20 0 DIADMM CCOC(=O)c1ccc(C)c(-c2c(F)ccc([O-])c2Cl)c1 ZINC001245831075 1058528889 /nfs/dbraw/zinc/52/88/89/1058528889.db2.gz CBUYUQUKIIROOS-UHFFFAOYSA-N -1 1 308.736 4.337 20 0 DIADMM [O-]c1ccc(F)c(-c2cncc(Oc3ccccc3)n2)c1Cl ZINC001245830728 1058529840 /nfs/dbraw/zinc/52/98/40/1058529840.db2.gz VLAMFSOMYCPGPM-UHFFFAOYSA-N -1 1 316.719 4.434 20 0 DIADMM COc1ccc(C(F)(F)F)nc1-c1c(F)ccc([O-])c1Cl ZINC001245830304 1058530357 /nfs/dbraw/zinc/53/03/57/1058530357.db2.gz KLUYERWKGUJFDD-UHFFFAOYSA-N -1 1 321.657 4.274 20 0 DIADMM CC1(C)C(=O)Nc2cc(F)c(-c3c(F)ccc([O-])c3Cl)cc21 ZINC001245832543 1058532045 /nfs/dbraw/zinc/53/20/45/1058532045.db2.gz YHZAEHWULQDJKP-UHFFFAOYSA-N -1 1 323.726 4.221 20 0 DIADMM COc1cccc2ncc(-c3c(F)ccc([O-])c3Cl)cc21 ZINC001245832048 1058532853 /nfs/dbraw/zinc/53/28/53/1058532853.db2.gz SNKPHKKTYKETTR-UHFFFAOYSA-N -1 1 303.720 4.409 20 0 DIADMM [O-]c1ccc(F)c(-c2ccc(-c3csnn3)cc2)c1Cl ZINC001245832137 1058533959 /nfs/dbraw/zinc/53/39/59/1058533959.db2.gz MMUZTAYQXJKZAR-UHFFFAOYSA-N -1 1 306.749 4.370 20 0 DIADMM COc1ncc(C(F)(F)F)cc1-c1c(F)ccc([O-])c1Cl ZINC001245832646 1058534504 /nfs/dbraw/zinc/53/45/04/1058534504.db2.gz RCFXXFGETPPWRS-UHFFFAOYSA-N -1 1 321.657 4.274 20 0 DIADMM CSc1cc(-c2c(F)ccc([O-])c2Cl)nc(SC)n1 ZINC001245831546 1058534852 /nfs/dbraw/zinc/53/48/52/1058534852.db2.gz ADANCNNXZPRLTC-UHFFFAOYSA-N -1 1 316.810 4.086 20 0 DIADMM COC(=O)c1c(F)c(C)ccc1-c1c(F)ccc([O-])c1Cl ZINC001245834000 1058538083 /nfs/dbraw/zinc/53/80/83/1058538083.db2.gz BFBVXCJVIHMQJI-UHFFFAOYSA-N -1 1 312.699 4.086 20 0 DIADMM CC1(C)NC(=O)Nc2c(-c3c(F)ccc([O-])c3Cl)cccc21 ZINC001245835120 1058539985 /nfs/dbraw/zinc/53/99/85/1058539985.db2.gz QBRNROHBXDOYFL-UHFFFAOYSA-N -1 1 320.751 4.222 20 0 DIADMM CCCC1CCC(N(C)C(=O)c2cc(Cl)ccc2[O-])CC1 ZINC001556476264 1058600537 /nfs/dbraw/zinc/60/05/37/1058600537.db2.gz UDCYUYDOMLDYNN-UHFFFAOYSA-N -1 1 309.837 4.477 20 0 DIADMM CCc1cc(NC(=O)c2ccc(C(C)C)cc2[O-])ccc1F ZINC001556536076 1058608774 /nfs/dbraw/zinc/60/87/74/1058608774.db2.gz RYLMXZHFBJXAAF-UHFFFAOYSA-N -1 1 301.361 4.469 20 0 DIADMM Cc1[nH]c2ccc(C(=O)Nc3ccc([O-])c(F)c3F)cc2c1C ZINC001556591615 1058616122 /nfs/dbraw/zinc/61/61/22/1058616122.db2.gz DJSGRHMTVLWBHW-UHFFFAOYSA-N -1 1 316.307 4.021 20 0 DIADMM Cc1cccc(C(=O)Nc2cccc([O-])c2Br)c1C ZINC001556696213 1058629119 /nfs/dbraw/zinc/62/91/19/1058629119.db2.gz CXKDJEXRMHXBIQ-UHFFFAOYSA-N -1 1 320.186 4.024 20 0 DIADMM CC(C)(C)C(C)(C)CNC(=O)c1ccc(C(F)(F)F)cc1[O-] ZINC001556757784 1058637595 /nfs/dbraw/zinc/63/75/95/1058637595.db2.gz LREULNRFCSIQJQ-UHFFFAOYSA-N -1 1 317.351 4.213 20 0 DIADMM Cc1noc(C)c1C(=O)Nc1cc(Cl)c([O-])c2ccccc12 ZINC001557587681 1058771997 /nfs/dbraw/zinc/77/19/97/1058771997.db2.gz XTSRJUCLBWCPOH-UHFFFAOYSA-N -1 1 316.744 4.056 20 0 DIADMM Cc1nscc1C(=O)Nc1cc(Cl)c([O-])c2ccccc12 ZINC001557586597 1058773265 /nfs/dbraw/zinc/77/32/65/1058773265.db2.gz PXNRPFYDSPJDPD-UHFFFAOYSA-N -1 1 318.785 4.216 20 0 DIADMM C[C@H](NC(=O)c1cc2ccccc2cc1[O-])[C@]12C[C@H]1CCCC2 ZINC001557928194 1058811687 /nfs/dbraw/zinc/81/16/87/1058811687.db2.gz ZXDPICXZEATCBH-OWZDWXTDSA-N -1 1 309.409 4.244 20 0 DIADMM O=C(Nc1cncc(C(F)F)c1)c1ccc2ccccc2c1[O-] ZINC001558022739 1058829975 /nfs/dbraw/zinc/82/99/75/1058829975.db2.gz GDNMLGAYJXEOKD-UHFFFAOYSA-N -1 1 314.291 4.130 20 0 DIADMM CCCc1ccc(C(=O)Nc2cc(F)c([O-])cc2Cl)s1 ZINC001558644394 1058894911 /nfs/dbraw/zinc/89/49/11/1058894911.db2.gz ITWZDSFQOXUALF-UHFFFAOYSA-N -1 1 313.781 4.451 20 0 DIADMM Cc1cc(C(=O)Nc2cc(F)c([O-])cc2Cl)cc(C)c1F ZINC001558644623 1058896062 /nfs/dbraw/zinc/89/60/62/1058896062.db2.gz RQBMSFFHLDLJBQ-UHFFFAOYSA-N -1 1 311.715 4.193 20 0 DIADMM Cc1nc(S[C@@H]2CCc3c2cccc3Cl)[n-]c(=O)c1C ZINC001559393504 1059203259 /nfs/dbraw/zinc/20/32/59/1059203259.db2.gz QNPMEPSRYXRZPD-CYBMUJFWSA-N -1 1 306.818 4.232 20 0 DIADMM CCc1ccc(NC(=S)Nc2c(F)cc([O-])cc2F)cc1 ZINC001247340151 1059384318 /nfs/dbraw/zinc/38/43/18/1059384318.db2.gz AQZMWOVJBJBVOG-UHFFFAOYSA-N -1 1 308.353 4.042 20 0 DIADMM CSc1cc(Cl)ccc1[N-]C(=O)c1nc(Cl)cs1 ZINC001531796814 1059415850 /nfs/dbraw/zinc/41/58/50/1059415850.db2.gz DATSBLUMGOEDMF-UHFFFAOYSA-N -1 1 319.238 4.424 20 0 DIADMM Cc1cccc(-c2noc(Cc3ccc([O-])c(Cl)c3)n2)c1C ZINC001247587087 1059565737 /nfs/dbraw/zinc/56/57/37/1059565737.db2.gz BTZVMPVBJUFQAA-UHFFFAOYSA-N -1 1 314.772 4.303 20 0 DIADMM Cc1cc(Cl)ccc1NC(=S)Nc1ccc(F)cc1[O-] ZINC001248412062 1059818440 /nfs/dbraw/zinc/81/84/40/1059818440.db2.gz MDAJXFXTCBZULM-UHFFFAOYSA-N -1 1 310.781 4.302 20 0 DIADMM CCc1cccc(C)c1NC(=S)Nc1cc(F)c([O-])c(F)c1 ZINC001249561053 1060291754 /nfs/dbraw/zinc/29/17/54/1060291754.db2.gz NESHTGWYJXQEPK-UHFFFAOYSA-N -1 1 322.380 4.350 20 0 DIADMM Cc1c(Cl)cc(Nc2cnc3c(cnn3C)c2)c([O-])c1Cl ZINC001249667011 1060341716 /nfs/dbraw/zinc/34/17/16/1060341716.db2.gz LYUHLCLRBPTKHK-UHFFFAOYSA-N -1 1 323.183 4.033 20 0 DIADMM CCCN(Cc1ccccc1)Cc1ccc(F)c(C(=O)[O-])c1F ZINC001249769170 1060388876 /nfs/dbraw/zinc/38/88/76/1060388876.db2.gz IFWYORKXCIAYHW-UHFFFAOYSA-N -1 1 319.351 4.075 20 0 DIADMM CC(C)c1ccc(CN(C)Cc2ccc([O-])c(F)c2F)cc1 ZINC001560634911 1060448812 /nfs/dbraw/zinc/44/88/12/1060448812.db2.gz MGDCFQWYVNBTOD-UHFFFAOYSA-N -1 1 305.368 4.426 20 0 DIADMM Cc1ccccc1-n1nccc1Nc1cc([O-])c(F)c(F)c1F ZINC001249961014 1060503759 /nfs/dbraw/zinc/50/37/59/1060503759.db2.gz AIJDSQCHYXUTCY-UHFFFAOYSA-N -1 1 319.286 4.047 20 0 DIADMM COc1cccc2ncc(Nc3cc([O-])c(F)c(F)c3F)cc21 ZINC001249961812 1060504134 /nfs/dbraw/zinc/50/41/34/1060504134.db2.gz WCMBJBOBDKKTAH-UHFFFAOYSA-N -1 1 320.270 4.110 20 0 DIADMM [O-]c1cc(Nc2ccc(OCC3CCC3)nc2)c(F)c(F)c1F ZINC001249958476 1060505177 /nfs/dbraw/zinc/50/51/77/1060505177.db2.gz MZKNCACSXVYSEY-UHFFFAOYSA-N -1 1 324.302 4.127 20 0 DIADMM [O-]c1cc(Nc2cc(-c3cccc(F)c3)no2)c(F)c(F)c1F ZINC001249960887 1060505715 /nfs/dbraw/zinc/50/57/15/1060505715.db2.gz WPWPXTLTVFSXGU-UHFFFAOYSA-N -1 1 324.233 4.347 20 0 DIADMM [O-]c1cc(Nc2ccsc2Br)c(F)c(F)c1F ZINC001249961451 1060505839 /nfs/dbraw/zinc/50/58/39/1060505839.db2.gz QHFMQWJDQXJXOF-UHFFFAOYSA-N -1 1 324.121 4.377 20 0 DIADMM CCOc1cc(F)ccc1Nc1cc([O-])c(F)c(F)c1F ZINC001249962122 1060506291 /nfs/dbraw/zinc/50/62/91/1060506291.db2.gz HBMDZSPOPPTULW-UHFFFAOYSA-N -1 1 301.239 4.091 20 0 DIADMM COc1ccc(Nc2cc([O-])c(F)c(F)c2F)c2ncccc12 ZINC001249964391 1060508114 /nfs/dbraw/zinc/50/81/14/1060508114.db2.gz CGZNETKFQYQYPK-UHFFFAOYSA-N -1 1 320.270 4.110 20 0 DIADMM [O-]c1cc(Nc2c(O)cccc2C(F)(F)F)c(F)c(F)c1F ZINC001249964813 1060508243 /nfs/dbraw/zinc/50/82/43/1060508243.db2.gz NKNYEROGGXXDTH-UHFFFAOYSA-N -1 1 323.192 4.278 20 0 DIADMM CC(C)(C)c1ccc(N)c(Nc2cc([O-])c(F)c(F)c2F)c1 ZINC001249964561 1060508689 /nfs/dbraw/zinc/50/86/89/1060508689.db2.gz GRAMETHMZUYKRZ-UHFFFAOYSA-N -1 1 310.319 4.433 20 0 DIADMM Cc1cncc2cccc(Nc3cc([O-])c(F)c(F)c3F)c12 ZINC001249964385 1060509429 /nfs/dbraw/zinc/50/94/29/1060509429.db2.gz CDKQOLIVSWORAK-UHFFFAOYSA-N -1 1 304.271 4.410 20 0 DIADMM [O-]c1cc(Nc2ccc(-c3cnco3)cc2)c(F)c(F)c1F ZINC001249963790 1060509680 /nfs/dbraw/zinc/50/96/80/1060509680.db2.gz UTVOGEYJBCPSET-UHFFFAOYSA-N -1 1 306.243 4.208 20 0 DIADMM COc1cc(Cl)cc(Nc2cc([O-])c(F)c(F)c2F)c1 ZINC001249964416 1060510061 /nfs/dbraw/zinc/51/00/61/1060510061.db2.gz DDACPTJWBWRCDP-UHFFFAOYSA-N -1 1 303.667 4.215 20 0 DIADMM Cc1cc(Nc2cc([O-])c(F)c(F)c2F)cc2scnc21 ZINC001249965807 1060512096 /nfs/dbraw/zinc/51/20/96/1060512096.db2.gz MPNBXYRWOYKJOG-UHFFFAOYSA-N -1 1 310.300 4.471 20 0 DIADMM Nc1ccccc1N(c1cc([O-])c(F)c(F)c1F)C1CCCC1 ZINC001249966682 1060512139 /nfs/dbraw/zinc/51/21/39/1060512139.db2.gz JVWJEFMUUDZWRU-UHFFFAOYSA-N -1 1 322.330 4.472 20 0 DIADMM O=C1CCCCc2c(Nc3cc([O-])c(F)c(F)c3F)cccc21 ZINC001249965826 1060512408 /nfs/dbraw/zinc/51/24/08/1060512408.db2.gz NJXFFBYNKKNVRN-UHFFFAOYSA-N -1 1 321.298 4.462 20 0 DIADMM CN1Cc2ccc(Nc3ccc(Cl)c(Cl)c3[O-])cc2C1=O ZINC001249982451 1060520167 /nfs/dbraw/zinc/52/01/67/1060520167.db2.gz QOMORFSHHJALRP-UHFFFAOYSA-N -1 1 323.179 4.028 20 0 DIADMM [O-]c1cc(F)c(Nc2cncc(C(F)(F)F)c2)cc1Cl ZINC001250020993 1060542829 /nfs/dbraw/zinc/54/28/29/1060542829.db2.gz VRCYSGNKCISARU-UHFFFAOYSA-N -1 1 306.646 4.342 20 0 DIADMM Cc1nc2sccc2c(Nc2cc(Cl)c([O-])cc2F)n1 ZINC001250020997 1060543651 /nfs/dbraw/zinc/54/36/51/1060543651.db2.gz VSRPBCOPQXZSJV-UHFFFAOYSA-N -1 1 309.753 4.241 20 0 DIADMM COC(=O)c1c(C)scc1Nc1cc(Cl)c([O-])cc1F ZINC001250019853 1060544465 /nfs/dbraw/zinc/54/44/65/1060544465.db2.gz ITFVQWDILGTKOC-UHFFFAOYSA-N -1 1 315.753 4.085 20 0 DIADMM [O-]c1cc(F)c(Nc2cncc(OC(F)(F)F)c2)cc1Cl ZINC001250022405 1060545688 /nfs/dbraw/zinc/54/56/88/1060545688.db2.gz LLSLFYRINGSNJP-UHFFFAOYSA-N -1 1 322.645 4.222 20 0 DIADMM [O-]c1cc(F)c(Nc2cccc(-n3ccnc3)c2)cc1Cl ZINC001250022668 1060545788 /nfs/dbraw/zinc/54/57/88/1060545788.db2.gz RKWOEERQYVDSLH-UHFFFAOYSA-N -1 1 303.724 4.114 20 0 DIADMM CC(C)c1cnn2cc(Nc3cc(Cl)c([O-])cc3F)cnc12 ZINC001250023716 1060545894 /nfs/dbraw/zinc/54/58/94/1060545894.db2.gz XKRUFQDXQULDMA-UHFFFAOYSA-N -1 1 320.755 4.094 20 0 DIADMM [O-]c1cc(F)c(Nc2ccc3c(c2)OCCCO3)cc1Cl ZINC001250022349 1060547700 /nfs/dbraw/zinc/54/77/00/1060547700.db2.gz JJUSQRVZMHLERD-UHFFFAOYSA-N -1 1 309.724 4.090 20 0 DIADMM Cc1cc(=O)oc2cc(Nc3cc(Cl)c([O-])cc3F)ccc12 ZINC001250022343 1060547802 /nfs/dbraw/zinc/54/78/02/1060547802.db2.gz JDXXXKDXBGJDKN-UHFFFAOYSA-N -1 1 319.719 4.343 20 0 DIADMM [O-]c1cc(F)c(Nc2cn3c(cccc3Cl)n2)cc1Cl ZINC001250023073 1060548539 /nfs/dbraw/zinc/54/85/39/1060548539.db2.gz BFWHXSIRVXMXJV-UHFFFAOYSA-N -1 1 312.131 4.229 20 0 DIADMM [O-]c1cc(F)c(Nc2cnccc2OC(F)(F)F)cc1Cl ZINC001250023082 1060549115 /nfs/dbraw/zinc/54/91/15/1060549115.db2.gz BTJWLRWZSQNCCJ-UHFFFAOYSA-N -1 1 322.645 4.222 20 0 DIADMM [O-]c1cc(F)c(Nc2ccc(CO)c(Cl)c2)cc1Cl ZINC001250026402 1060549827 /nfs/dbraw/zinc/54/98/27/1060549827.db2.gz MCPNKCWJQCBKRK-UHFFFAOYSA-N -1 1 302.132 4.074 20 0 DIADMM CC(C)NC(=O)c1cccc(Nc2cc(Cl)c([O-])cc2F)c1 ZINC001250023799 1060551068 /nfs/dbraw/zinc/55/10/68/1060551068.db2.gz BGYVNDWDHPVWGF-UHFFFAOYSA-N -1 1 322.767 4.067 20 0 DIADMM Cc1nn(C)c2ccc(Nc3cc(Cl)c([O-])cc3F)cc12 ZINC001250024049 1060552240 /nfs/dbraw/zinc/55/22/40/1060552240.db2.gz OEYNRWNIZHTJRD-UHFFFAOYSA-N -1 1 305.740 4.123 20 0 DIADMM Cc1cc2c(cccc2Nc2cc(Cl)c([O-])cc2F)nn1 ZINC001250023899 1060552373 /nfs/dbraw/zinc/55/23/73/1060552373.db2.gz HBKGBVBRHGXKLK-UHFFFAOYSA-N -1 1 303.724 4.180 20 0 DIADMM [O-]c1cc(F)c(Nc2ccc(Cl)c(CO)c2)cc1Cl ZINC001250025682 1060552866 /nfs/dbraw/zinc/55/28/66/1060552866.db2.gz FUTJZQKMWYYTFU-UHFFFAOYSA-N -1 1 302.132 4.074 20 0 DIADMM COc1cc(Nc2cc(Cl)c([O-])cc2F)ccc1C(C)=O ZINC001250027332 1060553639 /nfs/dbraw/zinc/55/36/39/1060553639.db2.gz XAOMYFRPOISDCI-UHFFFAOYSA-N -1 1 309.724 4.140 20 0 DIADMM O=C1CCCc2cccc(Nc3cc(Cl)c([O-])cc3F)c21 ZINC001250027058 1060553994 /nfs/dbraw/zinc/55/39/94/1060553994.db2.gz VVWPFLQNUGJTCO-UHFFFAOYSA-N -1 1 305.736 4.447 20 0 DIADMM FC(F)(F)c1cccc([N-]c2nonc2C2CC2)c1Cl ZINC001250075853 1060589242 /nfs/dbraw/zinc/58/92/42/1060589242.db2.gz NMVVKBYUZVICQD-UHFFFAOYSA-N -1 1 303.671 4.363 20 0 DIADMM CSc1ccc(F)c(Nc2cc3ccc([O-])cc3oc2=O)c1 ZINC001250119675 1060625298 /nfs/dbraw/zinc/62/52/98/1060625298.db2.gz MYHSLRYCDJCPFE-UHFFFAOYSA-N -1 1 317.341 4.103 20 0 DIADMM [O-]c1c(F)cc(Cc2ccc(OC(F)(F)F)cc2)cc1F ZINC001250199406 1060677386 /nfs/dbraw/zinc/67/73/86/1060677386.db2.gz GLPJWNQAWMJVGN-UHFFFAOYSA-N -1 1 304.214 4.160 20 0 DIADMM [O-]c1ccc(F)c(Nc2cnc(-c3ccccc3)cn2)c1Cl ZINC001250228272 1060707309 /nfs/dbraw/zinc/70/73/09/1060707309.db2.gz UCVOIKRWCNEHRC-UHFFFAOYSA-N -1 1 315.735 4.385 20 0 DIADMM O=c1[nH]cc(Nc2c(F)ccc([O-])c2Cl)cc1C(F)(F)F ZINC001250229822 1060707793 /nfs/dbraw/zinc/70/77/93/1060707793.db2.gz ORCIAVIXCQMDJD-UHFFFAOYSA-N -1 1 322.645 4.048 20 0 DIADMM [O-]c1ccc(F)c(Nc2cnnc(Cl)c2Cl)c1Cl ZINC001250229470 1060708255 /nfs/dbraw/zinc/70/82/55/1060708255.db2.gz JRXQBHGCYUTRCN-UHFFFAOYSA-N -1 1 308.527 4.025 20 0 DIADMM [O-]c1ccc(F)c(Nc2cnc3cccc(O)c3c2)c1Cl ZINC001250229397 1060708423 /nfs/dbraw/zinc/70/84/23/1060708423.db2.gz FSXHSWFUWLWNTE-UHFFFAOYSA-N -1 1 304.708 4.182 20 0 DIADMM Cc1nc(Cl)nc(Cl)c1Nc1c(F)ccc([O-])c1Cl ZINC001250228800 1060708944 /nfs/dbraw/zinc/70/89/44/1060708944.db2.gz LIYACXCHPFEGFZ-UHFFFAOYSA-N -1 1 322.554 4.334 20 0 DIADMM [O-]c1ccc(F)c(Nc2cc(Cl)cc(CO)c2)c1Cl ZINC001250232311 1060710283 /nfs/dbraw/zinc/71/02/83/1060710283.db2.gz JGJZPYZAMXXJKR-UHFFFAOYSA-N -1 1 302.132 4.074 20 0 DIADMM [O-]c1ccc(F)c(Nc2cncc(-c3ccccn3)c2)c1Cl ZINC001250234231 1060713504 /nfs/dbraw/zinc/71/35/04/1060713504.db2.gz MCGLIILSUFGDAZ-UHFFFAOYSA-N -1 1 315.735 4.385 20 0 DIADMM [O-]c1ccc(F)c(Nc2ccc3c(c2)OCCCO3)c1Cl ZINC001250234297 1060714082 /nfs/dbraw/zinc/71/40/82/1060714082.db2.gz PANJTKZSCNHTQT-UHFFFAOYSA-N -1 1 309.724 4.090 20 0 DIADMM [O-]c1ccc(F)c(Nc2ncccc2N2CCCCC2)c1Cl ZINC001250233676 1060715204 /nfs/dbraw/zinc/71/52/04/1060715204.db2.gz BJVZLLCLKLWFDC-UHFFFAOYSA-N -1 1 321.783 4.314 20 0 DIADMM CCOC(=O)Cc1ccccc1Nc1c(F)ccc([O-])c1Cl ZINC001250237459 1060719569 /nfs/dbraw/zinc/71/95/69/1060719569.db2.gz IRVQKFULLXNRDS-UHFFFAOYSA-N -1 1 323.751 4.034 20 0 DIADMM O=C(Cc1cc(F)c([O-])c(F)c1)c1ccc(C(F)(F)F)cc1 ZINC001250238868 1060723462 /nfs/dbraw/zinc/72/34/62/1060723462.db2.gz MYIJOWMLARHYDJ-UHFFFAOYSA-N -1 1 316.225 4.115 20 0 DIADMM [O-]C(=Cc1c(F)ccc(Cl)c1F)c1ccc(F)cc1F ZINC001250250097 1060730210 /nfs/dbraw/zinc/73/02/10/1060730210.db2.gz HEQWBYASOVCPPX-UHFFFAOYSA-N -1 1 302.654 4.322 20 0 DIADMM [O-]c1ccc(CNCc2ccsc2C(F)(F)F)c(F)c1F ZINC001560959857 1060823974 /nfs/dbraw/zinc/82/39/74/1060823974.db2.gz QCGMYYYQNWBHCM-UHFFFAOYSA-N -1 1 323.286 4.041 20 0 DIADMM O=C([O-])c1ccc(-c2nc3cc(C(F)(F)F)c(F)cc3[nH]2)cc1 ZINC001250480245 1060838246 /nfs/dbraw/zinc/83/82/46/1060838246.db2.gz UZYARYAJAHZVNU-UHFFFAOYSA-N -1 1 324.233 4.086 20 0 DIADMM [O-]c1cccc(F)c1-c1nc2c(cc(F)cc2C(F)(F)F)[nH]1 ZINC001250674860 1061007039 /nfs/dbraw/zinc/00/70/39/1061007039.db2.gz YIVGFTPZCLEVDO-UHFFFAOYSA-N -1 1 314.213 4.233 20 0 DIADMM Cc1cccc2c1nc(-c1cccc([O-])c1Br)n2C ZINC001250881066 1061106458 /nfs/dbraw/zinc/10/64/58/1061106458.db2.gz RZMPMVXVPKKSSW-UHFFFAOYSA-N -1 1 317.186 4.017 20 0 DIADMM [O-]c1cccc(-c2nc3c(cccc3Cl)[nH]2)c1Br ZINC001250881451 1061109790 /nfs/dbraw/zinc/10/97/90/1061109790.db2.gz WRCLCEKLZJHAHE-UHFFFAOYSA-N -1 1 323.577 4.351 20 0 DIADMM [O-]c1cc(F)cc(F)c1-c1nc2ccc(C(F)(F)F)cc2[nH]1 ZINC001250886026 1061110126 /nfs/dbraw/zinc/11/01/26/1061110126.db2.gz QACVIYLCZBKXJG-UHFFFAOYSA-N -1 1 314.213 4.233 20 0 DIADMM [O-]c1ccc(-c2nc3cc(-c4ccncc4)ccc3[nH]2)c(F)c1F ZINC001250915358 1061124121 /nfs/dbraw/zinc/12/41/21/1061124121.db2.gz WXDSKJWBJUMZAL-UHFFFAOYSA-N -1 1 323.302 4.276 20 0 DIADMM [O-]c1ccc(-c2nc3ccc(-c4ccncc4)cc3[nH]2)c(F)c1F ZINC001250915358 1061124135 /nfs/dbraw/zinc/12/41/35/1061124135.db2.gz WXDSKJWBJUMZAL-UHFFFAOYSA-N -1 1 323.302 4.276 20 0 DIADMM CC(C)n1c2cc(F)ccc2nc1-c1ccc([O-])c(F)c1F ZINC001250914635 1061125035 /nfs/dbraw/zinc/12/50/35/1061125035.db2.gz GHGUJWWVCQRLHI-UHFFFAOYSA-N -1 1 306.287 4.407 20 0 DIADMM Cn1c2ccc(F)cc2nc1-c1c(Cl)cc([O-])cc1Cl ZINC001250957644 1061145589 /nfs/dbraw/zinc/14/55/89/1061145589.db2.gz WHJXXMSHCSWOJQ-UHFFFAOYSA-N -1 1 311.143 4.392 20 0 DIADMM Cc1ccc2nc(-c3ccc(Cl)cc3C(=O)[O-])[nH]c2c1C ZINC001250967703 1061152643 /nfs/dbraw/zinc/15/26/43/1061152643.db2.gz AWRQLSQRPYWYPU-UHFFFAOYSA-N -1 1 300.745 4.198 20 0 DIADMM O=C([O-])c1cc(Cl)ccc1-c1nc2ccc(Cl)cc2[nH]1 ZINC001250968449 1061152974 /nfs/dbraw/zinc/15/29/74/1061152974.db2.gz NGRPZDZAZXYRQC-UHFFFAOYSA-N -1 1 307.136 4.235 20 0 DIADMM CCCn1c(-c2cc(F)c(F)cc2[O-])nc2ccc(F)c(F)c21 ZINC001250967569 1061153840 /nfs/dbraw/zinc/15/38/40/1061153840.db2.gz VGZKBRWXAMYIKF-UHFFFAOYSA-N -1 1 324.277 4.375 20 0 DIADMM CCn1c2ccc(Cl)cc2nc1-c1c(F)cc([O-])cc1F ZINC001251007415 1061178475 /nfs/dbraw/zinc/17/84/75/1061178475.db2.gz KYEJEDSRQZXWDX-UHFFFAOYSA-N -1 1 308.715 4.360 20 0 DIADMM O=C([O-])c1ccc(F)c(-c2nc3ccc(C(F)F)cc3[nH]2)c1 ZINC001251014245 1061183503 /nfs/dbraw/zinc/18/35/03/1061183503.db2.gz CQHJMVRJTGFYEB-UHFFFAOYSA-N -1 1 306.243 4.005 20 0 DIADMM O=C([O-])c1ccsc1-c1nc2ccc(C(F)(F)F)cc2[nH]1 ZINC001251012282 1061183698 /nfs/dbraw/zinc/18/36/98/1061183698.db2.gz YWNUPVDPZQJVQA-UHFFFAOYSA-N -1 1 312.272 4.008 20 0 DIADMM Cc1cc2nc(-c3cc(C(=O)[O-])ccc3F)[nH]c2cc1Cl ZINC001251015554 1061184951 /nfs/dbraw/zinc/18/49/51/1061184951.db2.gz SWRFGONFFSCNPB-UHFFFAOYSA-N -1 1 304.708 4.029 20 0 DIADMM CCn1c2cc(OC)ccc2nc1-c1ccc(Cl)c([O-])c1 ZINC001251036629 1061193317 /nfs/dbraw/zinc/19/33/17/1061193317.db2.gz IPAFPPILNRNEJV-UHFFFAOYSA-N -1 1 302.761 4.091 20 0 DIADMM COCCCn1c2ccccc2nc1-c1ccc(Cl)c([O-])c1 ZINC001251036559 1061194571 /nfs/dbraw/zinc/19/45/71/1061194571.db2.gz FRXCCNPDIBIHTE-UHFFFAOYSA-N -1 1 316.788 4.099 20 0 DIADMM CCC[C@@H](C(=O)NCc1ccc([O-])c(Cl)c1)c1ccccc1 ZINC001455439233 1061223425 /nfs/dbraw/zinc/22/34/25/1061223425.db2.gz IJWVOMJEBUDUFC-OAHLLOKOSA-N -1 1 317.816 4.246 20 0 DIADMM [O-]c1cc(O)c(-c2nc3cc(F)c(Cl)cc3[nH]2)cc1Cl ZINC001251082269 1061223655 /nfs/dbraw/zinc/22/36/55/1061223655.db2.gz DXYRNRDOLKHJDE-UHFFFAOYSA-N -1 1 313.115 4.087 20 0 DIADMM CCC[C@H](C(=O)NCc1ccc([O-])c(Cl)c1)c1ccccc1 ZINC001455439231 1061223939 /nfs/dbraw/zinc/22/39/39/1061223939.db2.gz IJWVOMJEBUDUFC-HNNXBMFYSA-N -1 1 317.816 4.246 20 0 DIADMM CCn1c2ccc(C)cc2nc1-c1cc(Cl)c([O-])cc1O ZINC001251083164 1061227397 /nfs/dbraw/zinc/22/73/97/1061227397.db2.gz PWKZPZBJJZZGMK-UHFFFAOYSA-N -1 1 302.761 4.096 20 0 DIADMM CCCn1c2cc(F)ccc2nc1-c1cc(Cl)c([O-])cc1O ZINC001251082616 1061227457 /nfs/dbraw/zinc/22/74/57/1061227457.db2.gz LAYDQFIIERBNQF-UHFFFAOYSA-N -1 1 320.751 4.317 20 0 DIADMM [O-]c1cc(O)c(-c2nc3ccccc3n2C2CC2)cc1Cl ZINC001251083144 1061228772 /nfs/dbraw/zinc/22/87/72/1061228772.db2.gz PNOJHSRSLZGQOB-UHFFFAOYSA-N -1 1 300.745 4.103 20 0 DIADMM C[C@H]1CCN(C(=O)c2ccc(Cl)cc2[O-])[C@@H]1c1ccccc1 ZINC001455647168 1061230496 /nfs/dbraw/zinc/23/04/96/1061230496.db2.gz FFFKWWSTYXSAJH-SJCJKPOMSA-N -1 1 315.800 4.269 20 0 DIADMM CCn1c2ccc(Cl)cc2nc1-c1cc(Cl)ncc1[O-] ZINC001251252375 1061291159 /nfs/dbraw/zinc/29/11/59/1061291159.db2.gz VEPOIBKYKAAFGN-UHFFFAOYSA-N -1 1 308.168 4.131 20 0 DIADMM CCCn1c2ccc(F)cc2nc1-c1cc(Cl)ncc1[O-] ZINC001251252325 1061291919 /nfs/dbraw/zinc/29/19/19/1061291919.db2.gz TXRUXLVSBASJHD-UHFFFAOYSA-N -1 1 305.740 4.006 20 0 DIADMM CCCSc1ccc2[nH]c(-c3cc(Cl)ncc3[O-])nc2c1 ZINC001251252425 1061292077 /nfs/dbraw/zinc/29/20/77/1061292077.db2.gz WQEPWDQQVXPEHG-UHFFFAOYSA-N -1 1 319.817 4.486 20 0 DIADMM CCCSc1ccc2nc(-c3cc(Cl)ncc3[O-])[nH]c2c1 ZINC001251252425 1061292121 /nfs/dbraw/zinc/29/21/21/1061292121.db2.gz WQEPWDQQVXPEHG-UHFFFAOYSA-N -1 1 319.817 4.486 20 0 DIADMM CCOc1ccc2nc(-c3c([O-])ccc(F)c3F)n(CC)c2c1 ZINC001251321790 1061312399 /nfs/dbraw/zinc/31/23/99/1061312399.db2.gz FAUZSRXWIXQKDL-UHFFFAOYSA-N -1 1 318.323 4.106 20 0 DIADMM CCCCn1c2ccccc2nc1-c1c([O-])ccc(F)c1F ZINC001251322517 1061312768 /nfs/dbraw/zinc/31/27/68/1061312768.db2.gz XVAYJKLKYFUJMG-UHFFFAOYSA-N -1 1 302.324 4.487 20 0 DIADMM CC(C)n1c2cc(F)ccc2nc1-c1c([O-])ccc(F)c1F ZINC001251322298 1061313258 /nfs/dbraw/zinc/31/32/58/1061313258.db2.gz RWCVPLIQVKVZDU-UHFFFAOYSA-N -1 1 306.287 4.407 20 0 DIADMM CCCn1c(-c2c([O-])ccc(F)c2F)nc2ccc(F)c(F)c21 ZINC001251321935 1061313333 /nfs/dbraw/zinc/31/33/33/1061313333.db2.gz HRWVEGWLIHMPIZ-UHFFFAOYSA-N -1 1 324.277 4.375 20 0 DIADMM CCCn1c2cc(OC)ccc2nc1-c1c([O-])ccc(F)c1F ZINC001251322453 1061313923 /nfs/dbraw/zinc/31/39/23/1061313923.db2.gz UKPBAASZWMOOQI-UHFFFAOYSA-N -1 1 318.323 4.106 20 0 DIADMM [O-]c1ccc(F)c(-c2nc3c(cccc3C(F)(F)F)[nH]2)c1F ZINC001251335691 1061321099 /nfs/dbraw/zinc/32/10/99/1061321099.db2.gz MTMVBLVBGWTUGI-UHFFFAOYSA-N -1 1 314.213 4.233 20 0 DIADMM [O-]c1ccc(F)c(-c2nc3cc(-c4ccncc4)ccc3[nH]2)c1F ZINC001251335878 1061322495 /nfs/dbraw/zinc/32/24/95/1061322495.db2.gz TYPLMBWWQQHQED-UHFFFAOYSA-N -1 1 323.302 4.276 20 0 DIADMM Cc1c2nc(-c3cccc(C(F)(F)F)c3[O-])[nH]c2ccc1F ZINC001251340942 1061323326 /nfs/dbraw/zinc/32/33/26/1061323326.db2.gz BIHOLOPFJWEFAO-UHFFFAOYSA-N -1 1 310.250 4.402 20 0 DIADMM CCOc1ccc2[nH]c(-c3cccc(C(F)(F)F)c3[O-])nc2c1 ZINC001251341261 1061324984 /nfs/dbraw/zinc/32/49/84/1061324984.db2.gz VMRUJPJGQAJMBY-UHFFFAOYSA-N -1 1 322.286 4.353 20 0 DIADMM CCn1c2ccccc2nc1-c1cccc(C(F)(F)F)c1[O-] ZINC001251340954 1061325167 /nfs/dbraw/zinc/32/51/67/1061325167.db2.gz CBMBHTKFQMOLSH-UHFFFAOYSA-N -1 1 306.287 4.448 20 0 DIADMM [O-]c1cc(-c2nc3ccc(F)c(F)c3n2C2CC2)ccc1F ZINC001251477599 1061376296 /nfs/dbraw/zinc/37/62/96/1061376296.db2.gz QRBWGOSTEWROIF-UHFFFAOYSA-N -1 1 304.271 4.161 20 0 DIADMM COc1cc([O-])c(-c2nc3cc(Cl)ccc3n2C)c(Cl)c1 ZINC001251491352 1061377256 /nfs/dbraw/zinc/37/72/56/1061377256.db2.gz QTCHIEBIMSJGMY-UHFFFAOYSA-N -1 1 323.179 4.261 20 0 DIADMM COc1cccc2[nH]c(-c3c([O-])ccc(Cl)c3Cl)nc21 ZINC001251531845 1061391860 /nfs/dbraw/zinc/39/18/60/1061391860.db2.gz KOLAYTMPSOHQKE-UHFFFAOYSA-N -1 1 309.152 4.251 20 0 DIADMM Cc1cccc2cccc([N-]S(=O)(=O)c3ccc(F)cc3)c12 ZINC001251668643 1061438284 /nfs/dbraw/zinc/43/82/84/1061438284.db2.gz ZCIAOYQOXDILGP-UHFFFAOYSA-N -1 1 315.369 4.088 20 0 DIADMM CCCCCC(C)(C)C[N-]S(=O)(=O)c1cc2ccccc2o1 ZINC001463275824 1061452364 /nfs/dbraw/zinc/45/23/64/1061452364.db2.gz NKKDIPTZSLCDEQ-UHFFFAOYSA-N -1 1 323.458 4.318 20 0 DIADMM CC(C)[C@@H](NC(=O)c1cc(Cl)ccc1[O-])c1ccccc1 ZINC001463884132 1061530225 /nfs/dbraw/zinc/53/02/25/1061530225.db2.gz FWBLUYYIZLQHEW-MRXNPFEDSA-N -1 1 303.789 4.173 20 0 DIADMM CCCC[C@@H](C(=O)Nc1ccc(-c2cc(=O)[nH][n-]2)cc1)C(C)C ZINC001464076578 1061553194 /nfs/dbraw/zinc/55/31/94/1061553194.db2.gz CWZKAVYJXZETGS-OAHLLOKOSA-N -1 1 315.417 4.183 20 0 DIADMM CC(C)c1ccc(C(=O)Nc2ccc3scnc3c2)c([O-])c1 ZINC001464671993 1061621736 /nfs/dbraw/zinc/62/17/36/1061621736.db2.gz ICVUBNPKGVRLSD-UHFFFAOYSA-N -1 1 312.394 4.378 20 0 DIADMM CC[C@@H](C)[C@H](C)N(C(=O)Cc1ccc([O-])c(Cl)c1)C1CC1 ZINC001464993566 1061659592 /nfs/dbraw/zinc/65/95/92/1061659592.db2.gz VESFYQWYLXFMAV-NEPJUHHUSA-N -1 1 309.837 4.014 20 0 DIADMM CCSc1ccc([C@@H](C)NC(=O)c2cc(F)ccc2[O-])cc1 ZINC001464996309 1061663026 /nfs/dbraw/zinc/66/30/26/1061663026.db2.gz KJUWDGRGCBCCAJ-LLVKDONJSA-N -1 1 319.401 4.134 20 0 DIADMM CC(C)c1csc(NC(=O)c2ccc(C(C)C)cc2[O-])n1 ZINC001465132218 1061687688 /nfs/dbraw/zinc/68/76/88/1061687688.db2.gz RDRMTDXDPUFRDG-UHFFFAOYSA-N -1 1 304.415 4.348 20 0 DIADMM CCc1ccc(CCNC(=O)c2cc3ccccc3cc2[O-])cc1 ZINC001465288464 1061728156 /nfs/dbraw/zinc/72/81/56/1061728156.db2.gz ZRCAEDCPRWPTOZ-UHFFFAOYSA-N -1 1 319.404 4.080 20 0 DIADMM CSc1ccc([O-])c(C(=O)Nc2nc3ccsc3s2)c1 ZINC001465303761 1061730405 /nfs/dbraw/zinc/73/04/05/1061730405.db2.gz WKYJAYJOTIFXFT-UHFFFAOYSA-N -1 1 322.436 4.038 20 0 DIADMM CCOc1ccc(-c2nnc(-c3ccc(CC)cc3)o2)c([O-])c1 ZINC001252954061 1061760009 /nfs/dbraw/zinc/76/00/09/1061760009.db2.gz QVHUVHGUKSNMQC-UHFFFAOYSA-N -1 1 310.353 4.070 20 0 DIADMM C[C@]1(c2ccccc2)C[C@H]1NC(=O)c1cc2ccccc2cc1[O-] ZINC001465513239 1061765910 /nfs/dbraw/zinc/76/59/10/1061765910.db2.gz GRLWONTVQBHQKO-TZIWHRDSSA-N -1 1 317.388 4.005 20 0 DIADMM O=c1ccn(-c2ccc(NCc3cc4cc(F)ccc4o3)cc2)[n-]1 ZINC001474229237 1061792487 /nfs/dbraw/zinc/79/24/87/1061792487.db2.gz OCQBFFWAUZJWJJ-UHFFFAOYSA-N -1 1 323.327 4.075 20 0 DIADMM [O-]c1ccc(CNc2nc(C(F)(F)F)cs2)cc1Cl ZINC001458570308 1061843561 /nfs/dbraw/zinc/84/35/61/1061843561.db2.gz QHVDBUTYQLDVPI-UHFFFAOYSA-N -1 1 308.712 4.133 20 0 DIADMM CC(C)CSCCCNC(=O)c1cc2ccccc2cc1[O-] ZINC001466119878 1061879024 /nfs/dbraw/zinc/87/90/24/1061879024.db2.gz NDZGOPJBTIUSIC-UHFFFAOYSA-N -1 1 317.454 4.055 20 0 DIADMM [O-]c1cc(C(F)(F)F)ccc1-c1nnc(Cc2ccccc2)o1 ZINC001253489698 1061901477 /nfs/dbraw/zinc/90/14/77/1061901477.db2.gz XTVMOASCPRXHDU-UHFFFAOYSA-N -1 1 320.270 4.052 20 0 DIADMM CCCc1cc(=O)[n-]c(SCc2ccc(C(F)F)cc2)n1 ZINC001458793034 1061906764 /nfs/dbraw/zinc/90/67/64/1061906764.db2.gz LHLIVKFFBYJFBD-UHFFFAOYSA-N -1 1 310.369 4.365 20 0 DIADMM [O-]c1c2ccsc2ccc1-c1nnc(Cc2ccccc2)o1 ZINC001253504362 1061908457 /nfs/dbraw/zinc/90/84/57/1061908457.db2.gz SSNYBLCFIPXCQT-UHFFFAOYSA-N -1 1 308.362 4.248 20 0 DIADMM C[C@H]1CCC[C@H](NC(=O)c2ccc(C(F)(F)F)cc2[O-])CC1 ZINC001466958863 1062036100 /nfs/dbraw/zinc/03/61/00/1062036100.db2.gz CFTDZZCCTSHZBR-JQWIXIFHSA-N -1 1 315.335 4.110 20 0 DIADMM Cc1ccc2ccc(-c3nnc(-c4cccc(F)c4)o3)c([O-])c2n1 ZINC001254150775 1062036182 /nfs/dbraw/zinc/03/61/82/1062036182.db2.gz QNOBYCBXMZMTEL-UHFFFAOYSA-N -1 1 321.311 4.105 20 0 DIADMM C[C@H](Sc1nc(-c2ccccc2)cc(=O)[n-]1)c1cccnc1 ZINC001459292228 1062071599 /nfs/dbraw/zinc/07/15/99/1062071599.db2.gz OZRUJVYOHOQIGS-LBPRGKRZSA-N -1 1 309.394 4.098 20 0 DIADMM [O-]c1cccc(-c2nnc(Cc3ccccc3Cl)o2)c1Cl ZINC001254403279 1062093172 /nfs/dbraw/zinc/09/31/72/1062093172.db2.gz RNRVVGOIYHJUPX-UHFFFAOYSA-N -1 1 321.163 4.340 20 0 DIADMM CC[C@@H](C)Oc1cccc(NCc2ccc([O-])c(F)c2F)c1 ZINC001474546606 1062243017 /nfs/dbraw/zinc/24/30/17/1062243017.db2.gz MYXABIBPKBAZQE-LLVKDONJSA-N -1 1 307.340 4.460 20 0 DIADMM Cc1[nH]c2c(cccc2C(=O)Nc2ccc([O-])c(F)c2F)c1C ZINC001467999697 1062243669 /nfs/dbraw/zinc/24/36/69/1062243669.db2.gz OUFNXASIBXRODC-UHFFFAOYSA-N -1 1 316.307 4.021 20 0 DIADMM Cc1cc(Cl)c(C(=O)Nc2ccc([O-])c(F)c2F)cc1C ZINC001468003285 1062243730 /nfs/dbraw/zinc/24/37/30/1062243730.db2.gz HRMZZZUDFVOQAB-UHFFFAOYSA-N -1 1 311.715 4.193 20 0 DIADMM O=C(Nc1ccc([O-])c(F)c1F)c1csc(C(F)(F)F)c1 ZINC001468003460 1062246933 /nfs/dbraw/zinc/24/69/33/1062246933.db2.gz JTYBPQRXDGZMLE-UHFFFAOYSA-N -1 1 323.242 4.003 20 0 DIADMM C/C(=C/C(=O)Nc1ccc([O-])c(F)c1F)c1ccccc1C ZINC001468004108 1062247475 /nfs/dbraw/zinc/24/74/75/1062247475.db2.gz YCPCJDXQGRWUAL-LUAWRHEFSA-N -1 1 303.308 4.021 20 0 DIADMM C[C@H](C(=O)Nc1ccc([O-])c(F)c1F)c1cccc(Cl)c1 ZINC001468003811 1062248362 /nfs/dbraw/zinc/24/83/62/1062248362.db2.gz QTROCYKOBVQZQE-QMMMGPOBSA-N -1 1 311.715 4.066 20 0 DIADMM C[C@H](C1CCCCC1)N(C)C(=O)NCc1ccc([O-])c(Cl)c1 ZINC001254934685 1062282969 /nfs/dbraw/zinc/28/29/69/1062282969.db2.gz AFLRWOBKISNKRD-GFCCVEGCSA-N -1 1 324.852 4.156 20 0 DIADMM CCCCN(C(=O)c1cc(F)ccc1[O-])[C@H]1CCC[C@H](C)C1 ZINC001468507151 1062340478 /nfs/dbraw/zinc/34/04/78/1062340478.db2.gz YPDORWVJMVIGRO-ZFWWWQNUSA-N -1 1 307.409 4.352 20 0 DIADMM CC(C)(C)Oc1ccc(C(=O)Nc2cc([O-])c(F)cc2F)cc1 ZINC001468748242 1062393667 /nfs/dbraw/zinc/39/36/67/1062393667.db2.gz SYSHSBQYXKABLZ-UHFFFAOYSA-N -1 1 321.323 4.100 20 0 DIADMM CC1(C)CCC(C)(CNC(=O)Cc2ccc([O-])c(Cl)c2)CC1 ZINC001469048634 1062467546 /nfs/dbraw/zinc/46/75/46/1062467546.db2.gz UBMVXLRXODTQLT-UHFFFAOYSA-N -1 1 323.864 4.311 20 0 DIADMM O=S(=O)([N-]CCCC1CCCCC1)c1cc2ccccc2o1 ZINC001474830038 1062475971 /nfs/dbraw/zinc/47/59/71/1062475971.db2.gz GEHAIYRROHHUIR-UHFFFAOYSA-N -1 1 321.442 4.072 20 0 DIADMM C/C(=C/c1ccc(C)cc1)C(=O)Nc1cc(F)cc(F)c1[O-] ZINC001469161479 1062490898 /nfs/dbraw/zinc/49/08/98/1062490898.db2.gz OULJFPPKSMFSLE-XFFZJAGNSA-N -1 1 303.308 4.021 20 0 DIADMM CC(C)C[C@@H](C(=O)Nc1cc(F)cc(F)c1[O-])c1ccccc1 ZINC001469161521 1062491547 /nfs/dbraw/zinc/49/15/47/1062491547.db2.gz MINJQFSTWPOCSW-CQSZACIVSA-N -1 1 319.351 4.439 20 0 DIADMM O=C(NCCC1=CCCCCC1)NCc1ccc([O-])c(Cl)c1 ZINC001469728106 1062611448 /nfs/dbraw/zinc/61/14/48/1062611448.db2.gz SLGZSCGNVIVTPO-UHFFFAOYSA-N -1 1 322.836 4.125 20 0 DIADMM COc1cccc([O-])c1-c1nnc(-c2ccc3ccccc3c2)o1 ZINC001255982643 1062676761 /nfs/dbraw/zinc/67/67/61/1062676761.db2.gz CVMYFSUNLZIPER-UHFFFAOYSA-N -1 1 318.332 4.271 20 0 DIADMM Cc1cccc(C)c1[C@H]1CCCN1C(=O)c1ccc(F)c([O-])c1 ZINC001470021878 1062686556 /nfs/dbraw/zinc/68/65/56/1062686556.db2.gz BVQFUOQDUFLYDC-MRXNPFEDSA-N -1 1 313.372 4.125 20 0 DIADMM [O-]c1ccc(-c2nnc(-c3ccc4ccccc4c3)o2)cc1F ZINC001256052699 1062688483 /nfs/dbraw/zinc/68/84/83/1062688483.db2.gz CKVRFCRDEMEPFM-UHFFFAOYSA-N -1 1 306.296 4.402 20 0 DIADMM CCCOc1ccc(-c2nnc(-c3cccc([O-])c3F)o2)cc1 ZINC001256302673 1062768004 /nfs/dbraw/zinc/76/80/04/1062768004.db2.gz VJTISWPFOIFUSI-UHFFFAOYSA-N -1 1 314.316 4.037 20 0 DIADMM Cc1ccc(CCC(=O)Nc2cccc(F)c2[O-])cc1Cl ZINC001471167051 1062931002 /nfs/dbraw/zinc/93/10/02/1062931002.db2.gz XJBNZHKXIIVLPG-UHFFFAOYSA-N -1 1 307.752 4.064 20 0 DIADMM CC[C@@H](CC(=O)Nc1cccc(F)c1[O-])c1ccc(C)cc1 ZINC001471167014 1062931811 /nfs/dbraw/zinc/93/18/11/1062931811.db2.gz WDPCRAAPIWANGI-ZDUSSCGKSA-N -1 1 301.361 4.362 20 0 DIADMM CC(C)(C)Cc1ccccc1C(=O)Nc1cccc(F)c1[O-] ZINC001471167692 1062932618 /nfs/dbraw/zinc/93/26/18/1062932618.db2.gz GVSMGPIBQIFUGZ-UHFFFAOYSA-N -1 1 301.361 4.372 20 0 DIADMM O=C(Nc1cccc(F)c1[O-])c1ccc(-c2ccc(F)cc2)o1 ZINC001471166361 1062933322 /nfs/dbraw/zinc/93/33/22/1062933322.db2.gz GJCQVMUCIVGWKW-UHFFFAOYSA-N -1 1 315.275 4.183 20 0 DIADMM C[C@@H](CSCc1ccccc1)C(=O)Nc1cccc(F)c1[O-] ZINC001471166182 1062933522 /nfs/dbraw/zinc/93/35/22/1062933522.db2.gz BWGWRZRJZUSOOH-LBPRGKRZSA-N -1 1 319.401 4.039 20 0 DIADMM O=C(Nc1cccc(F)c1[O-])c1cc2c(ccnc2Cl)s1 ZINC001471167377 1062933729 /nfs/dbraw/zinc/93/37/29/1062933729.db2.gz AGCKFYJQTZPFMD-UHFFFAOYSA-N -1 1 322.748 4.047 20 0 DIADMM CCCCN(CCCC)C(=O)NCc1ccc([O-])c(Cl)c1 ZINC001471235503 1062951959 /nfs/dbraw/zinc/95/19/59/1062951959.db2.gz MTWNPCKPGSYACC-UHFFFAOYSA-N -1 1 312.841 4.157 20 0 DIADMM C[C@@H]1CCC[C@@H](C2CN(C(=O)c3cc4ccccc4cc3[O-])C2)C1 ZINC001471317636 1062962883 /nfs/dbraw/zinc/96/28/83/1062962883.db2.gz SRFDYCWBQNSAAD-HUUCEWRRSA-N -1 1 323.436 4.444 20 0 DIADMM C[C@@H]1CCCC[C@@H]1CCNC(=O)NCc1ccc([O-])c(Cl)c1 ZINC001477900891 1063014550 /nfs/dbraw/zinc/01/45/50/1063014550.db2.gz XIWGWZWIVSZOQY-TZMCWYRMSA-N -1 1 324.852 4.061 20 0 DIADMM CC(C)Oc1ccc(-c2nnc(-c3ccc(F)c([O-])c3)o2)cc1 ZINC001256921546 1063051591 /nfs/dbraw/zinc/05/15/91/1063051591.db2.gz SCVAVKUEIMXLAC-UHFFFAOYSA-N -1 1 314.316 4.036 20 0 DIADMM Cc1cccc(S(=O)(=O)[N-]c2ccc(C(C)C)c(C)c2)c1 ZINC001256929288 1063054568 /nfs/dbraw/zinc/05/45/68/1063054568.db2.gz POLIPYIMSRJBST-UHFFFAOYSA-N -1 1 303.427 4.228 20 0 DIADMM Cc1cccc(S(=O)(=O)[N-]c2cc(C)c(Cl)cc2C)c1 ZINC001256929030 1063056293 /nfs/dbraw/zinc/05/62/93/1063056293.db2.gz KUTJLFHUWSTPKO-UHFFFAOYSA-N -1 1 309.818 4.066 20 0 DIADMM Cc1cccc(S(=O)(=O)[N-]c2ccc(C)c3ccccc23)c1 ZINC001256947312 1063057671 /nfs/dbraw/zinc/05/76/71/1063057671.db2.gz WGGQEIROJLRUTA-UHFFFAOYSA-N -1 1 311.406 4.257 20 0 DIADMM C[C@@H](NC(=O)c1cc(F)ccc1[O-])c1cccc2ccccc21 ZINC001472280396 1063069002 /nfs/dbraw/zinc/06/90/02/1063069002.db2.gz CFLQOPKWJXVSLA-GFCCVEGCSA-N -1 1 309.340 4.176 20 0 DIADMM O=C(Nc1ccc(F)cc1[O-])c1sc2ncccc2c1Cl ZINC001472535371 1063097645 /nfs/dbraw/zinc/09/76/45/1063097645.db2.gz SQPSNNMKVUCVOA-UHFFFAOYSA-N -1 1 322.748 4.047 20 0 DIADMM COc1cc(-c2nnc(CC3CCCCC3)o2)cc(Cl)c1[O-] ZINC001257076733 1063103596 /nfs/dbraw/zinc/10/35/96/1063103596.db2.gz TTXNSZCZMRQEEV-UHFFFAOYSA-N -1 1 322.792 4.227 20 0 DIADMM Cc1ccc([C@H]2C[C@@H]2c2nnc(-c3cc(F)ccc3[O-])o2)cc1 ZINC001257322862 1063203622 /nfs/dbraw/zinc/20/36/22/1063203622.db2.gz BMRIQLRXNLCVTG-KGLIPLIRSA-N -1 1 310.328 4.161 20 0 DIADMM Cc1ccc([C@@H]2C[C@@H]2c2nnc(-c3ccc(F)c([O-])c3)o2)cc1 ZINC001257323817 1063207772 /nfs/dbraw/zinc/20/77/72/1063207772.db2.gz JGWLXRMLXWVXHJ-KBPBESRZSA-N -1 1 310.328 4.161 20 0 DIADMM Cc1ccc([C@H]2C[C@@H]2c2nnc(-c3ccc([O-])cc3F)o2)cc1 ZINC001257326179 1063210796 /nfs/dbraw/zinc/21/07/96/1063210796.db2.gz XBMRPEPUVNBRMJ-CABCVRRESA-N -1 1 310.328 4.161 20 0 DIADMM C[C@H]1CCC[C@H](CCSc2nc(C(F)F)cc(=O)[n-]2)C1 ZINC001473041082 1063370200 /nfs/dbraw/zinc/37/02/00/1063370200.db2.gz MILXMTXNEMWHJO-VHSXEESVSA-N -1 1 302.390 4.428 20 0 DIADMM C[C@H]1CCC[C@@H](CCSc2nc(C(F)F)cc(=O)[n-]2)C1 ZINC001473041081 1063370800 /nfs/dbraw/zinc/37/08/00/1063370800.db2.gz MILXMTXNEMWHJO-UWVGGRQHSA-N -1 1 302.390 4.428 20 0 DIADMM Cc1nocc1[N-]C(=O)c1csc(-c2cccc(Cl)c2)n1 ZINC001461263113 1063375229 /nfs/dbraw/zinc/37/52/29/1063375229.db2.gz GFDNLDDMTYFUNO-UHFFFAOYSA-N -1 1 319.773 4.012 20 0 DIADMM CC(C)C(C)(C)CSCc1cc(=O)oc2cc([O-])ccc12 ZINC001473087468 1063394095 /nfs/dbraw/zinc/39/40/95/1063394095.db2.gz CRDMBIIKHKLIBO-UHFFFAOYSA-N -1 1 306.427 4.414 20 0 DIADMM CSC(C)(C)C[C@@H](C)Nc1c(C)c(=O)[n-]n1-c1ccccc1 ZINC001258332120 1063614698 /nfs/dbraw/zinc/61/46/98/1063614698.db2.gz UBVWVKFELLUZDC-GFCCVEGCSA-N -1 1 319.474 4.218 20 0 DIADMM CC[C@@H](C)c1ccccc1[N-]S(=O)(=O)c1cc(F)ccc1C ZINC001258920736 1063880958 /nfs/dbraw/zinc/88/09/58/1063880958.db2.gz OYZMZSRYJKGHIY-GFCCVEGCSA-N -1 1 321.417 4.448 20 0 DIADMM Cc1ccc(S(=O)(=O)[N-]c2cc3cccccc-3c2)cc1C ZINC001259162784 1063885224 /nfs/dbraw/zinc/88/52/24/1063885224.db2.gz ILQRBSBNURBFRE-UHFFFAOYSA-N -1 1 311.406 4.209 20 0 DIADMM Cc1cc(C)cc(S(=O)(=O)[N-]c2cc(C)cc(Cl)c2)c1 ZINC001259523600 1063889729 /nfs/dbraw/zinc/88/97/29/1063889729.db2.gz WGGJSEQHSUZHAJ-UHFFFAOYSA-N -1 1 309.818 4.066 20 0 DIADMM Cc1cc(C)cc(S(=O)(=O)[N-]c2cccc(C(F)F)c2)c1 ZINC001259522060 1063890159 /nfs/dbraw/zinc/89/01/59/1063890159.db2.gz DZQHRHXABCJIAT-UHFFFAOYSA-N -1 1 311.353 4.042 20 0 DIADMM O=S(=O)(CC1CCCCC1)[N-]c1cc2ccccc2s1 ZINC001259614138 1063892107 /nfs/dbraw/zinc/89/21/07/1063892107.db2.gz PPMVNJMTXFYPTR-UHFFFAOYSA-N -1 1 309.456 4.223 20 0 DIADMM Cc1cccc(CS(=O)(=O)[N-]c2cc3ccccc3s2)c1 ZINC001259743868 1063894353 /nfs/dbraw/zinc/89/43/53/1063894353.db2.gz WUTSWXJKFUTZDM-UHFFFAOYSA-N -1 1 317.435 4.152 20 0 DIADMM O=S(=O)([N-]c1cc2cccccc-2c1)c1ccc2c(c1)CCC2 ZINC001259855063 1063895636 /nfs/dbraw/zinc/89/56/36/1063895636.db2.gz AHAAUOJSZALCSA-UHFFFAOYSA-N -1 1 323.417 4.081 20 0 DIADMM CC(C)CS(=O)(=O)[N-]c1ccccc1Oc1ccc(F)cc1 ZINC001259877657 1063895872 /nfs/dbraw/zinc/89/58/72/1063895872.db2.gz OAJVKUHBLFOSPZ-UHFFFAOYSA-N -1 1 323.389 4.016 20 0 DIADMM CC[C@H](C)S(=O)(=O)[N-]c1ccccc1Oc1ccccc1 ZINC001260737975 1063903521 /nfs/dbraw/zinc/90/35/21/1063903521.db2.gz DKHYSVUXUFIPTQ-ZDUSSCGKSA-N -1 1 305.399 4.019 20 0 DIADMM Cc1cccc(S(=O)(=O)[N-]c2cccc3sccc32)c1C ZINC001260999212 1063909420 /nfs/dbraw/zinc/90/94/20/1063909420.db2.gz PGQNAFVRUIMBID-UHFFFAOYSA-N -1 1 317.435 4.319 20 0 DIADMM CC(C)[C@@H](NC(=O)Cc1ccc([O-])c(Cl)c1)c1ccccc1 ZINC001290482490 1064696703 /nfs/dbraw/zinc/69/67/03/1064696703.db2.gz HARBTMUOHBHSQK-GOSISDBHSA-N -1 1 317.816 4.102 20 0 DIADMM CC(C)c1ccccc1NC(=O)Cc1ccc([O-])c(Cl)c1 ZINC001290595645 1064701303 /nfs/dbraw/zinc/70/13/03/1064701303.db2.gz BZYQDUUXOYQART-UHFFFAOYSA-N -1 1 303.789 4.350 20 0 DIADMM CCc1ccc(C(=O)N(CC)c2cccc(Cl)c2)c([O-])c1 ZINC001290703802 1064707904 /nfs/dbraw/zinc/70/79/04/1064707904.db2.gz FOZBMRARZNDPBJ-UHFFFAOYSA-N -1 1 303.789 4.275 20 0 DIADMM Cc1ccccc1CN(C(=O)c1c([O-])cccc1Cl)C1CC1 ZINC001290740650 1064709266 /nfs/dbraw/zinc/70/92/66/1064709266.db2.gz AKYSHSJXQBDVCK-UHFFFAOYSA-N -1 1 315.800 4.159 20 0 DIADMM Cc1cc(C)c(CNC(=O)c2cc3ccccc3cc2[O-])c(C)c1 ZINC001290743353 1064709799 /nfs/dbraw/zinc/70/97/99/1064709799.db2.gz OXZQZHXZXXKNIX-UHFFFAOYSA-N -1 1 319.404 4.401 20 0 DIADMM CSc1ccc([O-])c(C(=O)N2CC[C@@H](C)c3ccccc32)c1 ZINC001291693532 1064740734 /nfs/dbraw/zinc/74/07/34/1064740734.db2.gz UQDRJGUZBCYPKN-GFCCVEGCSA-N -1 1 313.422 4.268 20 0 DIADMM O=C(c1ncc2ccccc2c1[O-])N(CC1CCCCC1)C1CC1 ZINC001291831629 1064747868 /nfs/dbraw/zinc/74/78/68/1064747868.db2.gz FPDPCPWEGOAIEP-UHFFFAOYSA-N -1 1 324.424 4.125 20 0 DIADMM CC(C)[C@H]1CC[C@@H](C)C[C@H]1CNC(=O)c1c([O-])cccc1Cl ZINC001292405364 1064772928 /nfs/dbraw/zinc/77/29/28/1064772928.db2.gz JSUPVCVNHUKUKJ-HZSPNIEDSA-N -1 1 323.864 4.484 20 0 DIADMM Cc1cccc([C@H]2CCCCCN2C(=O)c2ncc(C)cc2[O-])c1 ZINC001293750033 1064830345 /nfs/dbraw/zinc/83/03/45/1064830345.db2.gz JRVDSUOPGISQNM-QGZVFWFLSA-N -1 1 324.424 4.162 20 0 DIADMM C[C@H]1Cc2ccccc2CN1C(=O)c1cc2ccccc2cc1[O-] ZINC001294184028 1064853165 /nfs/dbraw/zinc/85/31/65/1064853165.db2.gz PCSZIYLEJZUJIX-AWEZNQCLSA-N -1 1 317.388 4.132 20 0 DIADMM C[C@H](CCc1ccccc1F)C(=O)Nc1ccc([O-])c(F)c1F ZINC001297820880 1064992011 /nfs/dbraw/zinc/99/20/11/1064992011.db2.gz PUGNIHJNBIUGPL-SNVBAGLBSA-N -1 1 323.314 4.017 20 0 DIADMM Cc1ccc2c(c1)[C@H](NC(=O)c1cc(Cl)ccc1[O-])CCC2 ZINC001298696334 1065015890 /nfs/dbraw/zinc/01/58/90/1065015890.db2.gz CRGWRHMRUYXAHV-MRXNPFEDSA-N -1 1 315.800 4.161 20 0 DIADMM O=C(Nc1cc([O-])c(F)cc1F)c1ccc(C2=CCCC2)cc1 ZINC001298975585 1065027227 /nfs/dbraw/zinc/02/72/27/1065027227.db2.gz WQSLQGUJQDMFJU-UHFFFAOYSA-N -1 1 315.319 4.490 20 0 DIADMM C[C@@H](CC(=O)Nc1cccc(F)c1[O-])c1c[nH]c2ccccc21 ZINC001302485688 1065090698 /nfs/dbraw/zinc/09/06/98/1065090698.db2.gz KDLLKAQWKSDBKN-NSHDSACASA-N -1 1 312.344 4.145 20 0 DIADMM C[C@]1(C2CCCCC2)CCN1C(=O)Cc1ccc([O-])c(Cl)c1 ZINC001302917747 1065102922 /nfs/dbraw/zinc/10/29/22/1065102922.db2.gz ZXLYTEPKEAHMEJ-GOSISDBHSA-N -1 1 321.848 4.159 20 0 DIADMM O=C(Nc1c[nH]c2ccccc12)c1cc2ccccc2cc1[O-] ZINC001304096638 1065129322 /nfs/dbraw/zinc/12/93/22/1065129322.db2.gz PUKYATLOXXVTBZ-UHFFFAOYSA-N -1 1 302.333 4.279 20 0 DIADMM CC(C)c1ccc(C(=O)Nc2ccc3c(c2)C[C@H](C)O3)c([O-])c1 ZINC001304220394 1065133204 /nfs/dbraw/zinc/13/32/04/1065133204.db2.gz SXCVSWBISVVBGV-LBPRGKRZSA-N -1 1 311.381 4.091 20 0 DIADMM O=C(NC[C@@H]1C[C@H]1C1CCCC1)c1cc2ccccc2cc1[O-] ZINC001305873032 1065166664 /nfs/dbraw/zinc/16/66/64/1065166664.db2.gz FNCDJLNYAWKIMQ-IRXDYDNUSA-N -1 1 309.409 4.102 20 0 DIADMM O=C(NC[C@H]1C[C@H]1C1CCCC1)c1cc2ccccc2cc1[O-] ZINC001305873034 1065166961 /nfs/dbraw/zinc/16/69/61/1065166961.db2.gz FNCDJLNYAWKIMQ-SJORKVTESA-N -1 1 309.409 4.102 20 0 DIADMM CCCc1cc(=O)[n-]c(SCc2ccc(Cl)s2)n1 ZINC001307251927 1065314767 /nfs/dbraw/zinc/31/47/67/1065314767.db2.gz AKUIFPCHKTYZDP-UHFFFAOYSA-N -1 1 300.836 4.142 20 0 DIADMM CCCC[C@H](CCC)NC(=O)NCc1ccc([O-])c(Cl)c1 ZINC001312181629 1066753359 /nfs/dbraw/zinc/75/33/59/1066753359.db2.gz SWMSNFMFXHIQIP-ZDUSSCGKSA-N -1 1 312.841 4.204 20 0 DIADMM Cc1ccc2[nH]c(-c3ccc([O-])c(Br)c3)nc2c1 ZINC000041005830 183155832 /nfs/dbraw/zinc/15/58/32/183155832.db2.gz RHFOAIPOTOVKTN-UHFFFAOYSA-N -1 1 303.159 4.006 20 0 DIADMM O=C([N-]c1nnc(C(F)F)s1)c1cc2sccc2s1 ZINC000514290542 435417511 /nfs/dbraw/zinc/41/75/11/435417511.db2.gz NDRIZPAGAYJVGN-UHFFFAOYSA-N -1 1 317.367 4.004 20 0 DIADMM CC(C)[C@H]1CCC[C@H](NC(=O)c2c(F)ccc([O-])c2F)CC1 ZINC000584081122 331668099 /nfs/dbraw/zinc/66/80/99/331668099.db2.gz IOAXBVACGUVOGX-RYUDHWBXSA-N -1 1 311.372 4.005 20 0 DIADMM CC[C@H](Cc1nc(-c2ccc([O-])c(F)c2)no1)c1ccccc1 ZINC000445483076 332040163 /nfs/dbraw/zinc/04/01/63/332040163.db2.gz VATJEFPRNMSOPL-GFCCVEGCSA-N -1 1 312.344 4.318 20 0 DIADMM Cc1ccc([C@@H](CC(=O)[O-])NCc2ccc(C(C)(C)C)s2)o1 ZINC000426810736 332152163 /nfs/dbraw/zinc/15/21/63/332152163.db2.gz JNCSFADGQBMZCC-CYBMUJFWSA-N -1 1 321.442 4.253 20 0 DIADMM CCC(C)(C)[C@@H](NCc1ccc(-c2ccc(C)cc2)o1)C(=O)[O-] ZINC000583440981 332411878 /nfs/dbraw/zinc/41/18/78/332411878.db2.gz HDPGLKWEBWHTSA-KRWDZBQOSA-N -1 1 315.413 4.234 20 0 DIADMM C[C@H](c1ccc(Cl)cc1)N(C)C(=O)c1ccc([O-])cc1F ZINC000181110953 333029224 /nfs/dbraw/zinc/02/92/24/333029224.db2.gz CPIFKWNJUFHPJF-SNVBAGLBSA-N -1 1 307.752 4.018 20 0 DIADMM CCCNc1ccc(Cl)cc1NC(=O)c1ccc([O-])cc1F ZINC000182457640 333040537 /nfs/dbraw/zinc/04/05/37/333040537.db2.gz PYQCLCZPTFCBEW-UHFFFAOYSA-N -1 1 322.767 4.259 20 0 DIADMM CC(C)c1cccc(S(=O)(=O)[N-]c2cccc(Cl)c2)c1 ZINC000460420669 333082565 /nfs/dbraw/zinc/08/25/65/333082565.db2.gz CRIZQJSXGDDICT-UHFFFAOYSA-N -1 1 309.818 4.264 20 0 DIADMM CC[C@H](C)Oc1cccc(NC(=O)c2c(F)ccc([O-])c2F)c1 ZINC000497631765 333272503 /nfs/dbraw/zinc/27/25/03/333272503.db2.gz DLWAQEQEYNPOHG-JTQLQIEISA-N -1 1 321.323 4.100 20 0 DIADMM O=C(Nc1ccc(F)cc1[O-])c1ccc2c3c(cccc31)CC2 ZINC000533971986 333552423 /nfs/dbraw/zinc/55/24/23/333552423.db2.gz GLJNXCYRZHBVJE-UHFFFAOYSA-N -1 1 307.324 4.035 20 0 DIADMM O=C(c1cc2ccccc2cc1[O-])N1CCC2(C1)CCCCC2 ZINC000323679056 333771210 /nfs/dbraw/zinc/77/12/10/333771210.db2.gz PIKGUYMRHOQOHA-UHFFFAOYSA-N -1 1 309.409 4.342 20 0 DIADMM Cc1nc(-c2ccc(N[C@H](C)CC(C)(C)C)nc2)[n-]c(=O)c1C ZINC000413359149 333844560 /nfs/dbraw/zinc/84/45/60/333844560.db2.gz XPCVTCISOJFLNZ-LLVKDONJSA-N -1 1 314.433 4.098 20 0 DIADMM C[C@@H]1CCCC[N@H+]([C@@H](C(=O)[O-])c2ccc(Cl)cc2Cl)C1 ZINC000571648662 334017208 /nfs/dbraw/zinc/01/72/08/334017208.db2.gz AQPRPAQQYYIBRF-QMTHXVAHSA-N -1 1 316.228 4.241 20 0 DIADMM CC[C@H](C)N(CC(=O)[O-])Cc1ccc(-c2ccccc2Cl)o1 ZINC000414684068 334068448 /nfs/dbraw/zinc/06/84/48/334068448.db2.gz QJONDYHMTXFKHC-LBPRGKRZSA-N -1 1 321.804 4.285 20 0 DIADMM CSc1nc(=O)c2sc(-c3ccccc3Cl)cc2[n-]1 ZINC000049068660 334306991 /nfs/dbraw/zinc/30/69/91/334306991.db2.gz IDSSDYMOEQLPGC-UHFFFAOYSA-N -1 1 308.815 4.027 20 0 DIADMM COc1cc(-c2nc([C@@H](C)C(C)(C)C)no2)cc(Cl)c1[O-] ZINC000443201752 338446944 /nfs/dbraw/zinc/44/69/44/338446944.db2.gz ITJJTTKMUDHJPO-MRVPVSSYSA-N -1 1 310.781 4.254 20 0 DIADMM CCOc1cc(-c2nc(-c3ccsc3)no2)cc(Cl)c1[O-] ZINC000191160012 335619935 /nfs/dbraw/zinc/61/99/35/335619935.db2.gz FWYHAUUEJQUYAF-UHFFFAOYSA-N -1 1 322.773 4.223 20 0 DIADMM CSCc1ccc(-c2nc(-c3ccc([O-])c(F)c3)no2)cc1 ZINC000445482180 338496476 /nfs/dbraw/zinc/49/64/76/338496476.db2.gz RLRGOPBWOUJFNV-UHFFFAOYSA-N -1 1 316.357 4.111 20 0 DIADMM C[C@@H](c1nc(-c2ccc([O-])c(F)c2)no1)c1ccc(F)c(F)c1 ZINC000445484208 338496559 /nfs/dbraw/zinc/49/65/59/338496559.db2.gz XYPZKAYOJNONGB-MRVPVSSYSA-N -1 1 320.270 4.011 20 0 DIADMM [O-]c1ccc(-c2noc(-c3ccc(-c4ccccc4)[nH]3)n2)cc1F ZINC000445485646 338496673 /nfs/dbraw/zinc/49/66/73/338496673.db2.gz BLWDRHAWPGPIEK-UHFFFAOYSA-N -1 1 321.311 4.243 20 0 DIADMM O=c1nc(-c2ccc(-c3ccc(O)cc3)cc2)[n-]c2ccsc21 ZINC000053847972 335841742 /nfs/dbraw/zinc/84/17/42/335841742.db2.gz OBNSQDZXMQNONK-UHFFFAOYSA-N -1 1 320.373 4.024 20 0 DIADMM [O-]c1cccc(CNc2cccc(-c3cnco3)c2)c1Cl ZINC000328486940 336254202 /nfs/dbraw/zinc/25/42/02/336254202.db2.gz RGBQJDPFIGUEIX-UHFFFAOYSA-N -1 1 300.745 4.313 20 0 DIADMM O=C(Nc1ccc(F)cc1[O-])c1ccc(Cl)c(Cl)c1 ZINC000532620899 336257125 /nfs/dbraw/zinc/25/71/25/336257125.db2.gz AXPOSXYTCFGGJL-UHFFFAOYSA-N -1 1 300.116 4.090 20 0 DIADMM COc1ccc([C@H](C)NC(=O)c2ccc3ccccc3c2[O-])cc1 ZINC000392028986 336374837 /nfs/dbraw/zinc/37/48/37/336374837.db2.gz QAWKTUKGYKNVDX-ZDUSSCGKSA-N -1 1 321.376 4.045 20 0 DIADMM COc1ccc([C@@H](C)NC(=O)c2ccc3ccccc3c2[O-])cc1 ZINC000392028984 336374905 /nfs/dbraw/zinc/37/49/05/336374905.db2.gz QAWKTUKGYKNVDX-CYBMUJFWSA-N -1 1 321.376 4.045 20 0 DIADMM CCCc1cc(=O)[nH]c(C(=Cc2ccc([O-])c(Cl)c2)CC)n1 ZINC000193619319 337078632 /nfs/dbraw/zinc/07/86/32/337078632.db2.gz BKALQNWDNXGMBR-WQLSENKSSA-N -1 1 318.804 4.032 20 0 DIADMM O=C([O-])c1cccc(C[N@H+]2CC[C@@H](c3ccccc3)C2)c1Cl ZINC000394473803 337114414 /nfs/dbraw/zinc/11/44/14/337114414.db2.gz OCYZVGOQMIYKIT-CQSZACIVSA-N -1 1 315.800 4.028 20 0 DIADMM Cc1cc(Cl)ccc1-c1nc(-c2ccc([O-])c(F)c2)no1 ZINC000445473393 337458481 /nfs/dbraw/zinc/45/84/81/337458481.db2.gz USPVSOOJFTVXNM-UHFFFAOYSA-N -1 1 304.708 4.210 20 0 DIADMM CCOc1cc(-c2noc([C@H]3CC[C@@H](C)C3)n2)cc(Cl)c1[O-] ZINC000445429494 337729651 /nfs/dbraw/zinc/72/96/51/337729651.db2.gz ABDJSFGHOWPDFP-ZJUUUORDSA-N -1 1 322.792 4.398 20 0 DIADMM [O-]c1ccc(-c2noc(/C=C\c3cccs3)n2)c(Cl)c1 ZINC000445450262 337956493 /nfs/dbraw/zinc/95/64/93/337956493.db2.gz XLQSFTRXOIOJIZ-XQRVVYSFSA-N -1 1 304.758 4.328 20 0 DIADMM [O-]c1ccc(-c2noc(/C=C/c3ccc4[nH]ccc4c3)n2)c(F)c1 ZINC000445455327 338017364 /nfs/dbraw/zinc/01/73/64/338017364.db2.gz CVIWLIXJLYCVBJ-QHHAFSJGSA-N -1 1 321.311 4.233 20 0 DIADMM Cc1cc(-c2nc(-c3ccc([O-])cc3F)no2)c2ccccc2n1 ZINC000445455895 338017393 /nfs/dbraw/zinc/01/73/93/338017393.db2.gz MAULLUZDGCXDGN-UHFFFAOYSA-N -1 1 321.311 4.105 20 0 DIADMM [O-]c1ccc(-c2noc([C@@H](c3ccccc3)C3CC3)n2)c(F)c1 ZINC000445459951 338018768 /nfs/dbraw/zinc/01/87/68/338018768.db2.gz KKGNNNWGSGEQRH-INIZCTEOSA-N -1 1 310.328 4.123 20 0 DIADMM [O-]c1ccc(-c2noc(-c3ccc(C(F)F)cc3)n2)c(F)c1 ZINC000445460626 338020786 /nfs/dbraw/zinc/02/07/86/338020786.db2.gz SFTSDSRHLBLRHA-UHFFFAOYSA-N -1 1 306.243 4.186 20 0 DIADMM Cc1ccc2cc(-c3nc(-c4ccc([O-])cc4F)no3)[nH]c2c1 ZINC000445463721 338031438 /nfs/dbraw/zinc/03/14/38/338031438.db2.gz QAKGHHNWERHCHF-UHFFFAOYSA-N -1 1 309.300 4.038 20 0 DIADMM Cc1cccc([C@@H](NCc2cc(Cl)ccc2F)C(=O)[O-])c1C ZINC000426724091 338039399 /nfs/dbraw/zinc/03/93/99/338039399.db2.gz PEVOJACTUUARHJ-MRXNPFEDSA-N -1 1 321.779 4.011 20 0 DIADMM Cc1cc2cc(CN[C@H](CC3CCCC3)C(=O)[O-])oc2cc1C ZINC000426742310 338040264 /nfs/dbraw/zinc/04/02/64/338040264.db2.gz OXBZQYGZTVDFKA-QGZVFWFLSA-N -1 1 315.413 4.173 20 0 DIADMM C[C@H](C(=O)[O-])[C@@H](NCc1cc(Cl)ccc1F)c1ccccc1 ZINC000426749627 338040598 /nfs/dbraw/zinc/04/05/98/338040598.db2.gz HHFYJCHUSOORPZ-MEDUHNTESA-N -1 1 321.779 4.031 20 0 DIADMM Cc1cc2cc(CN[C@H](CCC(C)(C)C)C(=O)[O-])oc2cc1C ZINC000426761286 338041197 /nfs/dbraw/zinc/04/11/97/338041197.db2.gz ZFHRFBHDTQQTIN-MRXNPFEDSA-N -1 1 317.429 4.419 20 0 DIADMM Cc1nn(C)c(C)c1[N-]c1nc2cc(Cl)cc(Cl)c2o1 ZINC000433037011 338177695 /nfs/dbraw/zinc/17/76/95/338177695.db2.gz BMKJNMZJARIZCR-UHFFFAOYSA-N -1 1 311.172 4.229 20 0 DIADMM CCc1cccc(S(=O)(=O)[N-]c2cccc(Cl)c2C)c1 ZINC000433807332 338202450 /nfs/dbraw/zinc/20/24/50/338202450.db2.gz FXVYWYZVKXVDDI-UHFFFAOYSA-N -1 1 309.818 4.012 20 0 DIADMM O=C(Nc1ccccc1OC1CCCC1)c1cc(F)ccc1[O-] ZINC000436539349 338276125 /nfs/dbraw/zinc/27/61/25/338276125.db2.gz ODZYVJOERCINFV-UHFFFAOYSA-N -1 1 315.344 4.105 20 0 DIADMM C[C@H]1C[C@@H](c2ccccc2)CN1C(=O)c1cc(Cl)ccc1[O-] ZINC000436549717 338276660 /nfs/dbraw/zinc/27/66/60/338276660.db2.gz VQIWSUXTPCJTHN-GXTWGEPZSA-N -1 1 315.800 4.064 20 0 DIADMM C[C@H]1C[C@H](c2ccccc2)CN1C(=O)c1cc(Cl)ccc1[O-] ZINC000436549718 338276735 /nfs/dbraw/zinc/27/67/35/338276735.db2.gz VQIWSUXTPCJTHN-JSGCOSHPSA-N -1 1 315.800 4.064 20 0 DIADMM Cc1ccc([C@@H]2CCCN2C(=O)c2ccc(Cl)cc2[O-])s1 ZINC000436549571 338276766 /nfs/dbraw/zinc/27/67/66/338276766.db2.gz XONAUVMDGFIQPR-ZDUSSCGKSA-N -1 1 321.829 4.393 20 0 DIADMM CC[C@@H](CN(CC)C(=O)c1ccc([O-])cc1F)c1ccccc1 ZINC000436564479 338277322 /nfs/dbraw/zinc/27/73/22/338277322.db2.gz KDBVVTWVYMRZPC-AWEZNQCLSA-N -1 1 315.388 4.187 20 0 DIADMM Cc1c(COC(C)(C)C)cccc1NC(=O)c1ccccc1[O-] ZINC000436576626 338277922 /nfs/dbraw/zinc/27/79/22/338277922.db2.gz PPAUGLPUEXXSNX-UHFFFAOYSA-N -1 1 313.397 4.268 20 0 DIADMM O=C(c1ccc(Cl)cc1[O-])N1CC[C@H]1c1ccc(Cl)cc1 ZINC000436589429 338278809 /nfs/dbraw/zinc/27/88/09/338278809.db2.gz KPLPCHARJWIYRI-AWEZNQCLSA-N -1 1 322.191 4.286 20 0 DIADMM C[C@H]1[C@H](c2ccccc2)CCN1C(=O)c1cc(Cl)ccc1[O-] ZINC000436590930 338278853 /nfs/dbraw/zinc/27/88/53/338278853.db2.gz UWTGFGHXMAUTND-SWLSCSKDSA-N -1 1 315.800 4.064 20 0 DIADMM O=C(c1cc(Cl)ccc1[O-])N1CC[C@H]1c1ccc(Cl)cc1 ZINC000436591587 338278956 /nfs/dbraw/zinc/27/89/56/338278956.db2.gz XBIYQCMWLITZGR-AWEZNQCLSA-N -1 1 322.191 4.286 20 0 DIADMM CCCC[C@@H](C)N(C)C(=O)c1ccc(C(F)(F)F)cc1[O-] ZINC000436623338 338280296 /nfs/dbraw/zinc/28/02/96/338280296.db2.gz YTOIHABHRKJWLT-SNVBAGLBSA-N -1 1 303.324 4.062 20 0 DIADMM CSCc1ccc(-c2noc(-c3ccc([O-])cc3F)n2)cc1 ZINC000436691611 338283240 /nfs/dbraw/zinc/28/32/40/338283240.db2.gz UAZAUYDYDQOLHG-UHFFFAOYSA-N -1 1 316.357 4.111 20 0 DIADMM O=C(c1cc2ccccc2cc1[O-])N1CC(C2CCCCC2)C1 ZINC000436730635 338284423 /nfs/dbraw/zinc/28/44/23/338284423.db2.gz XMTFSWHAOBMWAR-UHFFFAOYSA-N -1 1 309.409 4.198 20 0 DIADMM C[C@@H]1CN(C(=O)c2cc3ccccc3cc2[O-])[C@@H]2CCCC[C@@H]21 ZINC000436734659 338284652 /nfs/dbraw/zinc/28/46/52/338284652.db2.gz BJPRDEBQNDFBGJ-MZMPZRCHSA-N -1 1 309.409 4.196 20 0 DIADMM C[C@@H]1CN(C(=O)c2ccc3ccccc3c2[O-])[C@@H]2CCCC[C@H]21 ZINC000436741158 338285077 /nfs/dbraw/zinc/28/50/77/338285077.db2.gz RVDKDZDHAZRQNY-QIIPPGSGSA-N -1 1 309.409 4.196 20 0 DIADMM C[C@@H]1CN(C(=O)c2ccc3ccccc3c2[O-])[C@H]2CCCC[C@@H]12 ZINC000436741162 338285096 /nfs/dbraw/zinc/28/50/96/338285096.db2.gz RVDKDZDHAZRQNY-XUWXXGDYSA-N -1 1 309.409 4.196 20 0 DIADMM CC[C@]1(C)CCCN(C(=O)c2ccc(C(F)(F)F)cc2[O-])C1 ZINC000436751733 338285416 /nfs/dbraw/zinc/28/54/16/338285416.db2.gz NMKLVMFOWWEQNK-OAHLLOKOSA-N -1 1 315.335 4.063 20 0 DIADMM O=C(c1ccc(Cl)cc1[O-])N1CCC[C@H]1c1ccc(F)cc1 ZINC000436755251 338285519 /nfs/dbraw/zinc/28/55/19/338285519.db2.gz MDOZSCZTGCBCSF-HNNXBMFYSA-N -1 1 319.763 4.162 20 0 DIADMM O=C([O-])c1cnc(/C=C\c2cc(Cl)c(O)cc2Cl)s1 ZINC000436774190 338286940 /nfs/dbraw/zinc/28/69/40/338286940.db2.gz SIRQSLCKKCTDAF-UPHRSURJSA-N -1 1 316.165 4.024 20 0 DIADMM CCSc1cccc(-c2noc(-c3cc(F)ccc3[O-])n2)c1 ZINC000436782388 338287118 /nfs/dbraw/zinc/28/71/18/338287118.db2.gz BJWWJVYUEQMDLG-UHFFFAOYSA-N -1 1 316.357 4.360 20 0 DIADMM CC(C)[C@H]1N(C(=O)c2cc3ccccc3cc2[O-])CC12CCC2 ZINC000436827266 338288737 /nfs/dbraw/zinc/28/87/37/338288737.db2.gz NEBKLBSFGXUSDZ-GOSISDBHSA-N -1 1 309.409 4.196 20 0 DIADMM CCc1ccc(C(=O)N(C)c2ccc(F)c(Cl)c2)c([O-])c1 ZINC000436835920 338289212 /nfs/dbraw/zinc/28/92/12/338289212.db2.gz BMGFEEIDWAJRPD-UHFFFAOYSA-N -1 1 307.752 4.024 20 0 DIADMM CCOc1cc(-c2noc([C@H]3C[C@@H]3C(C)C)n2)cc(Cl)c1[O-] ZINC000436869323 338290555 /nfs/dbraw/zinc/29/05/55/338290555.db2.gz CSTMZDLJBLTKHH-MNOVXSKESA-N -1 1 322.792 4.254 20 0 DIADMM O=C(c1ccc([O-])cc1F)N1CCC[C@H]1c1ccccc1Cl ZINC000436871431 338290846 /nfs/dbraw/zinc/29/08/46/338290846.db2.gz SRABYGLRSZOBGM-INIZCTEOSA-N -1 1 319.763 4.162 20 0 DIADMM CCCc1occc1-c1nc(-c2ccc([O-])cc2Cl)no1 ZINC000436870766 338290864 /nfs/dbraw/zinc/29/08/64/338290864.db2.gz IJQVLUROINTWRF-UHFFFAOYSA-N -1 1 304.733 4.308 20 0 DIADMM Cc1ncsc1/C=C\c1nc(-c2ccc([O-])cc2Cl)no1 ZINC000436871808 338290902 /nfs/dbraw/zinc/29/09/02/338290902.db2.gz LEBGILQKMQPQSE-PLNGDYQASA-N -1 1 319.773 4.031 20 0 DIADMM C[C@H](c1nc(-c2ccc([O-])cc2Cl)no1)c1ccccc1 ZINC000436872385 338290964 /nfs/dbraw/zinc/29/09/64/338290964.db2.gz MPTQWCGHSHRDPJ-JTQLQIEISA-N -1 1 300.745 4.247 20 0 DIADMM COC[C@H](C)n1c2ccccc2nc1-c1ccc([O-])c(Cl)c1 ZINC000436989239 338297023 /nfs/dbraw/zinc/29/70/23/338297023.db2.gz NMLQGLDCQPOAGA-NSHDSACASA-N -1 1 316.788 4.270 20 0 DIADMM O=C([O-])c1ccc2oc(/C=C/c3ccc(O)c(Cl)c3)nc2c1 ZINC000439268026 338365498 /nfs/dbraw/zinc/36/54/98/338365498.db2.gz FKZJUMDURMMPQK-QHHAFSJGSA-N -1 1 315.712 4.055 20 0 DIADMM C[C@@H](CCc1cccc(F)c1)C(=O)Nc1ccc([O-])c(Cl)c1 ZINC000440777792 338397187 /nfs/dbraw/zinc/39/71/87/338397187.db2.gz HVEFMCGBFJCYJJ-NSHDSACASA-N -1 1 321.779 4.392 20 0 DIADMM CCOCc1ccc(NC(=O)c2ccc(C(C)C)cc2[O-])cc1 ZINC000440815260 338398078 /nfs/dbraw/zinc/39/80/78/338398078.db2.gz IAVGHOJOTQBXIZ-UHFFFAOYSA-N -1 1 313.397 4.304 20 0 DIADMM O=C(Nc1ccc([O-])c(F)c1F)[C@H]1CCC[C@@H]1c1ccccc1 ZINC000456790071 338940892 /nfs/dbraw/zinc/94/08/92/338940892.db2.gz VJZYJIGMQMAUEL-OLZOCXBDSA-N -1 1 317.335 4.193 20 0 DIADMM CCN(C(=O)c1ncc(C)cc1[O-])[C@@H](C)c1cc2ccccc2o1 ZINC000460208413 339039199 /nfs/dbraw/zinc/03/91/99/339039199.db2.gz BSCLAACDNPBRHC-ZDUSSCGKSA-N -1 1 324.380 4.065 20 0 DIADMM CCc1cccc(CC)c1[N-]S(=O)(=O)c1cc(C)cc(F)c1 ZINC000461418799 339063571 /nfs/dbraw/zinc/06/35/71/339063571.db2.gz BVMDAWMXQQPKSM-UHFFFAOYSA-N -1 1 321.417 4.060 20 0 DIADMM Cc1cccc([C@H](C)Sc2nc(C(F)(F)F)cc(=O)[n-]2)c1 ZINC000463261221 339112480 /nfs/dbraw/zinc/11/24/80/339112480.db2.gz HOJILZDLJJJUPO-VIFPVBQESA-N -1 1 314.332 4.363 20 0 DIADMM Cc1cc(C)c(C)c(S(=O)(=O)[N-]c2cccc(F)c2C)c1C ZINC000467072227 339225756 /nfs/dbraw/zinc/22/57/56/339225756.db2.gz ANJSNFGPASCHRR-UHFFFAOYSA-N -1 1 321.417 4.169 20 0 DIADMM CC[C@H](C)c1ccc(S(=O)(=O)[N-]c2cccc(F)c2C)cc1 ZINC000467080958 339225872 /nfs/dbraw/zinc/22/58/72/339225872.db2.gz JJEIDSHDXIZNPP-LBPRGKRZSA-N -1 1 321.417 4.448 20 0 DIADMM O=C(Cc1ccc(Cl)c(F)c1)Nc1ccc([O-])c(Cl)c1 ZINC000468416860 339262528 /nfs/dbraw/zinc/26/25/28/339262528.db2.gz DILGEKRLZSUIIN-UHFFFAOYSA-N -1 1 314.143 4.019 20 0 DIADMM Cc1cccc(S(=O)(=O)[N-]c2ccccc2SC(C)C)c1 ZINC000471115231 339337590 /nfs/dbraw/zinc/33/75/90/339337590.db2.gz IDWZLNPBVCASOQ-UHFFFAOYSA-N -1 1 321.467 4.296 20 0 DIADMM C[C@H](NCc1cc(O)cc(F)c1)c1ccccc1C(F)(F)F ZINC000472050517 339360876 /nfs/dbraw/zinc/36/08/76/339360876.db2.gz ZXIMLINPOSQKRP-JTQLQIEISA-N -1 1 313.294 4.401 20 0 DIADMM Cc1ccnc(-c2nc3cc(Cl)c(Cl)cc3c(=O)[n-]2)c1 ZINC000485357115 339701907 /nfs/dbraw/zinc/70/19/07/339701907.db2.gz MEUXKZVZLCFFIA-UHFFFAOYSA-N -1 1 306.152 4.013 20 0 DIADMM Cc1cccc(Cl)c1CC(=O)Nc1ccc([O-])c(Cl)c1 ZINC000485778651 339712704 /nfs/dbraw/zinc/71/27/04/339712704.db2.gz DAAKFCGNMFDEJM-UHFFFAOYSA-N -1 1 310.180 4.189 20 0 DIADMM Cc1ccc(F)c([N-]S(=O)(=O)c2csc3ccccc32)c1 ZINC000506552187 340196633 /nfs/dbraw/zinc/19/66/33/340196633.db2.gz CKAATNMUXAWOIK-UHFFFAOYSA-N -1 1 321.398 4.150 20 0 DIADMM O=c1nc(-c2cncs2)[n-]c2scc(-c3ccccc3)c21 ZINC000507710030 340229145 /nfs/dbraw/zinc/22/91/45/340229145.db2.gz OYZARHVQFUCIBF-UHFFFAOYSA-N -1 1 311.391 4.187 20 0 DIADMM CCC[N@H+](Cc1cccc([O-])c1Cl)[C@@H]1[C@H]2CCO[C@H]2C1(C)C ZINC000508718436 340251410 /nfs/dbraw/zinc/25/14/10/340251410.db2.gz LEMLAULSOYEAEN-KBRIMQKVSA-N -1 1 323.864 4.071 20 0 DIADMM CCCc1ccccc1[N-]S(=O)(=O)c1cccc(SC)c1 ZINC000509089246 340260992 /nfs/dbraw/zinc/26/09/92/340260992.db2.gz KGMCJDBVHIPMEQ-UHFFFAOYSA-N -1 1 321.467 4.162 20 0 DIADMM CC[C@@H](Oc1cccc(C)c1)C(=O)Nc1ccc([O-])c(Cl)c1 ZINC000509172304 340262995 /nfs/dbraw/zinc/26/29/95/340262995.db2.gz VOGWOXUAVLAFCL-MRXNPFEDSA-N -1 1 319.788 4.150 20 0 DIADMM O=C(Cc1coc2cc(F)ccc12)Nc1ccc([O-])c(Cl)c1 ZINC000509177047 340263105 /nfs/dbraw/zinc/26/31/05/340263105.db2.gz FBIYGUUAJFUDBY-UHFFFAOYSA-N -1 1 319.719 4.112 20 0 DIADMM CCOCc1cccc(NC(=O)c2cc3ccccc3cc2[O-])c1 ZINC000303181655 340310470 /nfs/dbraw/zinc/31/04/70/340310470.db2.gz SXFBCOSRVJOGKU-UHFFFAOYSA-N -1 1 321.376 4.334 20 0 DIADMM CC[C@@H](C)c1cc(C(=O)[N-]c2cc(-c3ccccc3)on2)on1 ZINC000175869427 340422107 /nfs/dbraw/zinc/42/21/07/340422107.db2.gz KIJZIAQPNICQPU-LLVKDONJSA-N -1 1 311.341 4.095 20 0 DIADMM O=C(Nc1ccc2ncsc2c1)Nc1ccc([O-])c(Cl)c1 ZINC000192199252 340564437 /nfs/dbraw/zinc/56/44/37/340564437.db2.gz OXIQPOGGXFKDNN-UHFFFAOYSA-N -1 1 319.773 4.299 20 0 DIADMM [O-]c1cccc(CNc2ccc(-c3cnco3)cc2)c1Cl ZINC000393352613 340585707 /nfs/dbraw/zinc/58/57/07/340585707.db2.gz KVJAJEDXGPNWAA-UHFFFAOYSA-N -1 1 300.745 4.313 20 0 DIADMM O=S(=O)([N-]c1ccccc1Oc1ccccc1Cl)C1CC1 ZINC000524292239 340651846 /nfs/dbraw/zinc/65/18/46/340651846.db2.gz YOCWYEXTPUEFLG-UHFFFAOYSA-N -1 1 323.801 4.036 20 0 DIADMM Cc1cc(C)nc(-c2noc(-c3ccc4ccccc4c3[O-])n2)c1 ZINC000326422792 340714695 /nfs/dbraw/zinc/71/46/95/340714695.db2.gz RNNIZBCENYZWIH-UHFFFAOYSA-N -1 1 317.348 4.274 20 0 DIADMM C[C@@H](C(=O)Nc1cc(Cl)c([O-])c2ccccc12)C(C)(F)F ZINC000529538828 340761085 /nfs/dbraw/zinc/76/10/85/340761085.db2.gz KYXBBGDDOHLKGH-QMMMGPOBSA-N -1 1 313.731 4.429 20 0 DIADMM C[C@H]1CC(C(=O)[O-])C[C@H](C)N1Cc1cccc(Cl)c1Cl ZINC000530173439 340781430 /nfs/dbraw/zinc/78/14/30/340781430.db2.gz FQNZACAMFVNMMS-UWVGGRQHSA-N -1 1 316.228 4.067 20 0 DIADMM C[C@@H]1CC(C(=O)[O-])C[C@@H](C)N1Cc1cc(Cl)cc(Cl)c1 ZINC000530175481 340781809 /nfs/dbraw/zinc/78/18/09/340781809.db2.gz PQLDDSDQOQYKEK-NXEZZACHSA-N -1 1 316.228 4.067 20 0 DIADMM Cc1ccccc1SCC(=O)Nc1ccc([O-])c(Cl)c1 ZINC000067738927 340861194 /nfs/dbraw/zinc/86/11/94/340861194.db2.gz SREARGHLARBLGJ-UHFFFAOYSA-N -1 1 307.802 4.085 20 0 DIADMM Cc1cccc2cc(C(=O)Nc3ccc([O-])c(Cl)c3)oc21 ZINC000542817381 341021899 /nfs/dbraw/zinc/02/18/99/341021899.db2.gz FOJCOUJIQKEKAW-UHFFFAOYSA-N -1 1 301.729 4.353 20 0 DIADMM O=C(CC1CCC(C(F)(F)F)CC1)Nc1ccc(F)cc1[O-] ZINC000544023615 341067061 /nfs/dbraw/zinc/06/70/61/341067061.db2.gz BVJBBYRCDVMGSG-UHFFFAOYSA-N -1 1 319.298 4.229 20 0 DIADMM C[C@H](CCC(C)(C)C)C(=O)Nc1ccc(-c2cc(=O)[nH][n-]2)cc1 ZINC000544610248 341088892 /nfs/dbraw/zinc/08/88/92/341088892.db2.gz WIQXTUPOSGIOBA-GFCCVEGCSA-N -1 1 315.417 4.183 20 0 DIADMM Cc1ccc2oc(C(=O)Nc3ccc([O-])c(Cl)c3)cc2c1 ZINC000082192797 341317855 /nfs/dbraw/zinc/31/78/55/341317855.db2.gz OEPVOVKPIBNDOQ-UHFFFAOYSA-N -1 1 301.729 4.353 20 0 DIADMM CCc1cc(=O)[n-]c(SCc2cc(Cl)cc(Cl)c2)n1 ZINC000564390143 341385369 /nfs/dbraw/zinc/38/53/69/341385369.db2.gz PEOCPQGRGVFJGC-UHFFFAOYSA-N -1 1 315.225 4.344 20 0 DIADMM Cc1cc(Br)c([O-])c(NC(=O)[C@@H]2CC=CC[C@H]2C)c1 ZINC000552427583 341393226 /nfs/dbraw/zinc/39/32/26/341393226.db2.gz ITMRIZOZTSNSBZ-GHMZBOCLSA-N -1 1 324.218 4.004 20 0 DIADMM CCC(CC)c1cc(C(=O)[N-]c2cc(F)cc(F)c2F)on1 ZINC000554072683 341442614 /nfs/dbraw/zinc/44/26/14/341442614.db2.gz YPNJCQYFBCHXTN-UHFFFAOYSA-N -1 1 312.291 4.248 20 0 DIADMM O=C(C/C=C\c1ccc(F)cc1)Nc1ccc([O-])c(Cl)c1 ZINC000255029051 341498972 /nfs/dbraw/zinc/49/89/72/341498972.db2.gz VNXHVAOSVJFXKD-UPHRSURJSA-N -1 1 305.736 4.227 20 0 DIADMM CCc1nc(SCc2csc(C(C)(C)C)n2)[n-]c(=O)c1C ZINC000568414793 341670621 /nfs/dbraw/zinc/67/06/21/341670621.db2.gz VNWPRZLLTQFIEF-UHFFFAOYSA-N -1 1 323.487 4.099 20 0 DIADMM CCCC[C@@H](NCc1ccc(-c2ccc(Cl)cc2)o1)C(=O)[O-] ZINC000577841751 341942292 /nfs/dbraw/zinc/94/22/92/341942292.db2.gz MDNBYUUNFUUSHW-OAHLLOKOSA-N -1 1 321.804 4.333 20 0 DIADMM CC(C)(C)c1ncsc1C(=O)Nc1ccc([O-])c(Cl)c1 ZINC000182863746 519118829 /nfs/dbraw/zinc/11/88/29/519118829.db2.gz DKURLNIUQVXTQI-UHFFFAOYSA-N -1 1 310.806 4.052 20 0 DIADMM CC[C@@H](c1ccncc1)N(CC)C(=O)c1ccc(Cl)cc1[O-] ZINC000157406207 523128124 /nfs/dbraw/zinc/12/81/24/523128124.db2.gz LLHYOKWNWPTPTI-HNNXBMFYSA-N -1 1 318.804 4.054 20 0 DIADMM Cc1nc(SCC(C)(C)CC(F)F)[n-]c(=O)c1C1CC1 ZINC000918463101 1052799325 /nfs/dbraw/zinc/79/93/25/1052799325.db2.gz MRRDNYYKPKVSFX-UHFFFAOYSA-N -1 1 302.390 4.142 20 0 DIADMM [O-]c1ccc(F)c(Nc2cc(F)nc(F)c2Cl)c1Cl ZINC001250229254 1060706952 /nfs/dbraw/zinc/70/69/52/1060706952.db2.gz YFJIVCKDCRJIJB-UHFFFAOYSA-N -1 1 309.074 4.255 20 0 DIADMM Cc1cccc2c1[C@@H](C)C[C@H]2CC(=O)Nc1c([O-])cccc1F ZINC000683114649 1035549037 /nfs/dbraw/zinc/54/90/37/1035549037.db2.gz LASVGHSVRUMPFV-STQMWFEESA-N -1 1 313.372 4.459 20 0 DIADMM Cc1cccc2c1[C@@H](C)C[C@@H]2CC(=O)Nc1c([O-])cccc1F ZINC000683114646 1035549599 /nfs/dbraw/zinc/54/95/99/1035549599.db2.gz LASVGHSVRUMPFV-QWHCGFSZSA-N -1 1 313.372 4.459 20 0 DIADMM Cc1cc(NC(=O)c2ccc([O-])cc2F)cc(C(F)(F)F)c1 ZINC000683120706 1035560030 /nfs/dbraw/zinc/56/00/30/1035560030.db2.gz OYULXWDVPIGWON-UHFFFAOYSA-N -1 1 313.250 4.111 20 0 DIADMM O=C(Cc1c(F)cccc1Cl)Nc1ccc([O-])c(Cl)c1 ZINC000067738950 1035594928 /nfs/dbraw/zinc/59/49/28/1035594928.db2.gz MGHMAWXXOBNJQQ-UHFFFAOYSA-N -1 1 314.143 4.019 20 0 DIADMM CCOc1cc(-c2noc([C@H]3CC34CCC4)n2)cc(Cl)c1[O-] ZINC000683589296 1036525492 /nfs/dbraw/zinc/52/54/92/1036525492.db2.gz KGHPWGXTRLVXIG-SNVBAGLBSA-N -1 1 320.776 4.152 20 0 DIADMM [O-]c1ccc(-c2noc(-c3cc4cccc(F)c4o3)n2)c(F)c1 ZINC000683592092 1036527187 /nfs/dbraw/zinc/52/71/87/1036527187.db2.gz LCWNGKWFXSECMT-UHFFFAOYSA-N -1 1 314.247 4.134 20 0 DIADMM C[C@H](c1ccc(Cl)cc1Cl)N1CC[C@@H](C(=O)[O-])[C@H](C)C1 ZINC000312558412 1036576158 /nfs/dbraw/zinc/57/61/58/1036576158.db2.gz QWPFHHJFIFFGLQ-CKYFFXLPSA-N -1 1 316.228 4.097 20 0 DIADMM O=C(Nc1cccc(F)c1[O-])c1ccc(-c2cccs2)o1 ZINC001648851217 1036640603 /nfs/dbraw/zinc/64/06/03/1036640603.db2.gz ZBDLCXPAUOTBKI-UHFFFAOYSA-N -1 1 303.314 4.105 20 0 DIADMM CCN(C(=O)c1ccc2ccccc2c1[O-])[C@H](C)c1cccnc1 ZINC000115226373 1036871815 /nfs/dbraw/zinc/87/18/15/1036871815.db2.gz VPEKNFUJGSVAET-CQSZACIVSA-N -1 1 320.392 4.164 20 0 DIADMM C[C@H](CC(=O)Nc1c([O-])cccc1F)c1c[nH]c2ccccc21 ZINC000683864204 1037043385 /nfs/dbraw/zinc/04/33/85/1037043385.db2.gz CFTUDMDXISEERE-LLVKDONJSA-N -1 1 312.344 4.145 20 0 DIADMM O=C1[N-]C(=S)SC1=Cc1cnc(-c2cccs2)s1 ZINC000083522512 1037098724 /nfs/dbraw/zinc/09/87/24/1037098724.db2.gz TYNUGIBJZUZQIN-XBXARRHUSA-N -1 1 310.450 4.201 20 0 DIADMM O=C(Nc1ccc([O-])c(Cl)c1)Nc1ccc(C2CCC2)cn1 ZINC000580521312 1037182951 /nfs/dbraw/zinc/18/29/51/1037182951.db2.gz DNXPWLRWWUXHTE-UHFFFAOYSA-N -1 1 317.776 4.352 20 0 DIADMM CC(=Cc1ccc([O-])c(Cl)c1)c1nc(=O)c2ccsc2[nH]1 ZINC000255571505 1037183624 /nfs/dbraw/zinc/18/36/24/1037183624.db2.gz ZGNSSUNTFGOKDN-SOFGYWHQSA-N -1 1 318.785 4.316 20 0 DIADMM COC(=O)c1c[n-]c(SCc2ccc(C3CCCC3)cc2)n1 ZINC000580795497 1037303718 /nfs/dbraw/zinc/30/37/18/1037303718.db2.gz QZNPMHFPLMLHNX-UHFFFAOYSA-N -1 1 316.426 4.146 20 0 DIADMM C[C@H](c1ccc(Cl)cc1)N(Cc1occc1C(=O)[O-])C1CC1 ZINC000581434793 1037639675 /nfs/dbraw/zinc/63/96/75/1037639675.db2.gz MCSWJGPSWOEFBF-LLVKDONJSA-N -1 1 319.788 4.357 20 0 DIADMM O=C([O-])c1cccc(CN2CCC(c3ccco3)CC2)c1Cl ZINC000656758061 1037842600 /nfs/dbraw/zinc/84/26/00/1037842600.db2.gz ULWHTTUVQFZPNW-UHFFFAOYSA-N -1 1 319.788 4.011 20 0 DIADMM CC(C)c1cccc(O[C@@H](C)C(=O)Nc2c([O-])cccc2F)c1 ZINC000605434727 1038516336 /nfs/dbraw/zinc/51/63/36/1038516336.db2.gz FMDBSOGNZFSXDM-LBPRGKRZSA-N -1 1 317.360 4.061 20 0 DIADMM O=C(Cc1ccc(-c2ccccc2)cc1)Nc1c([O-])cccc1F ZINC000605439138 1038516595 /nfs/dbraw/zinc/51/65/95/1038516595.db2.gz VESNXSVCXOMKEK-UHFFFAOYSA-N -1 1 321.351 4.380 20 0 DIADMM O=C(Nc1c([O-])cccc1F)c1ccc(Cl)cc1Cl ZINC000605434611 1038516875 /nfs/dbraw/zinc/51/68/75/1038516875.db2.gz ALJOOLXCEZIZAH-UHFFFAOYSA-N -1 1 300.116 4.090 20 0 DIADMM C[C@H](c1ccccc1)N(C)C(=O)c1ccc(C(F)(F)F)c([O-])c1 ZINC000684870492 1038666819 /nfs/dbraw/zinc/66/68/19/1038666819.db2.gz DZJIEOOYGZYOIU-LLVKDONJSA-N -1 1 323.314 4.244 20 0 DIADMM Cc1ccsc1S(=O)(=O)[N-]c1ccc(Cl)cc1Cl ZINC000607610651 1038705711 /nfs/dbraw/zinc/70/57/11/1038705711.db2.gz OVRCUMPKHZHDLT-UHFFFAOYSA-N -1 1 322.238 4.164 20 0 DIADMM CC[C@H](CC(=O)Nc1c([O-])cccc1F)c1ccc(C)cc1 ZINC000608366866 1038828654 /nfs/dbraw/zinc/82/86/54/1038828654.db2.gz PECGSDRKLNIBTN-CYBMUJFWSA-N -1 1 301.361 4.362 20 0 DIADMM O=C(CCc1ccc(-c2ccccc2)[nH]1)Nc1c([O-])cccc1F ZINC000608366250 1038828937 /nfs/dbraw/zinc/82/89/37/1038828937.db2.gz HALJQJLUQFNFTP-UHFFFAOYSA-N -1 1 324.355 4.098 20 0 DIADMM O=C(Nc1c([O-])cccc1F)[C@@H]1C[C@H]1c1ccc2ccccc2c1 ZINC000608366343 1038829319 /nfs/dbraw/zinc/82/93/19/1038829319.db2.gz SBWBKZUNECOKAS-JKSUJKDBSA-N -1 1 321.351 4.427 20 0 DIADMM Cc1ccc(CCC(=O)Nc2c([O-])cccc2F)cc1Cl ZINC000608367211 1038829733 /nfs/dbraw/zinc/82/97/33/1038829733.db2.gz NKEBDJBMILFMJM-UHFFFAOYSA-N -1 1 307.752 4.064 20 0 DIADMM CC(C)[C@H](CC(=O)Nc1c([O-])cccc1F)c1ccccc1 ZINC000608366872 1038829846 /nfs/dbraw/zinc/82/98/46/1038829846.db2.gz AJEBELHSRQUXMD-AWEZNQCLSA-N -1 1 301.361 4.300 20 0 DIADMM O=C(Nc1c([O-])cccc1F)[C@@H]1C[C@H]1c1cccc2ccccc21 ZINC000608367204 1038831275 /nfs/dbraw/zinc/83/12/75/1038831275.db2.gz MQMYQYNZINWIGD-JKSUJKDBSA-N -1 1 321.351 4.427 20 0 DIADMM Cc1nc(C2CCCC2)sc1C(=O)Nc1c([O-])cccc1F ZINC000608367363 1038832158 /nfs/dbraw/zinc/83/21/58/1038832158.db2.gz PGJWCEJMTNTLQV-UHFFFAOYSA-N -1 1 320.389 4.206 20 0 DIADMM O=C(Nc1c([O-])cccc1F)c1cc2c(s1)CCCCC2 ZINC000608365371 1038832544 /nfs/dbraw/zinc/83/25/44/1038832544.db2.gz DVCDNEIYENYPQD-UHFFFAOYSA-N -1 1 305.374 4.114 20 0 DIADMM O=C(Nc1c([O-])cccc1F)c1[nH]c2ccc(F)cc2c1Cl ZINC000608366437 1038832802 /nfs/dbraw/zinc/83/28/02/1038832802.db2.gz KHKKAHVEUMRHCH-UHFFFAOYSA-N -1 1 322.698 4.057 20 0 DIADMM Cc1oc([C@H](C)[N@@H+](C)Cc2ccc(Cl)cc2)cc1C(=O)[O-] ZINC000517382508 1039066779 /nfs/dbraw/zinc/06/67/79/1039066779.db2.gz XXACYVQMYAVBSH-JTQLQIEISA-N -1 1 307.777 4.133 20 0 DIADMM Cc1oc([C@H](C)N(C)Cc2ccc(Cl)cc2)cc1C(=O)[O-] ZINC000517382508 1039066797 /nfs/dbraw/zinc/06/67/97/1039066797.db2.gz XXACYVQMYAVBSH-JTQLQIEISA-N -1 1 307.777 4.133 20 0 DIADMM C[C@@H](c1ccc(Cl)c(Cl)c1)N1CC[C@@H](C(=O)[O-])[C@H](C)C1 ZINC000380191069 1039336683 /nfs/dbraw/zinc/33/66/83/1039336683.db2.gz DRVTUJAIHFVPSD-JFGNBEQYSA-N -1 1 316.228 4.097 20 0 DIADMM CN(C(=O)c1cc(F)ccc1[O-])c1ccc(-c2ccccc2)cc1 ZINC000539871630 1039376867 /nfs/dbraw/zinc/37/68/67/1039376867.db2.gz BIIWKNCTVANIGD-UHFFFAOYSA-N -1 1 321.351 4.475 20 0 DIADMM O=C(Nc1ccc([O-])c(F)c1F)c1cc2cccc(Cl)c2o1 ZINC001140651895 1039437090 /nfs/dbraw/zinc/43/70/90/1039437090.db2.gz CUULWVAWRXVFDS-UHFFFAOYSA-N -1 1 323.682 4.322 20 0 DIADMM C[C@H](Sc1nc(C(F)F)cc(=O)[n-]1)c1c(F)cccc1F ZINC000685575174 1040142750 /nfs/dbraw/zinc/14/27/50/1040142750.db2.gz VCEVCFJUMKDLDT-LURJTMIESA-N -1 1 318.295 4.251 20 0 DIADMM COC[C@H](C)[C@H](C)C(=O)Nc1cc(Cl)c([O-])c2ccccc12 ZINC000628233619 1040238953 /nfs/dbraw/zinc/23/89/53/1040238953.db2.gz MLOGPJRFWGDZGB-QWRGUYRKSA-N -1 1 321.804 4.056 20 0 DIADMM Cc1ccc2sc(C(=O)Nc3c([O-])cccc3F)cc2c1 ZINC000685743247 1040500370 /nfs/dbraw/zinc/50/03/70/1040500370.db2.gz SEOMLHVXQNCLGR-UHFFFAOYSA-N -1 1 301.342 4.307 20 0 DIADMM O=C(C[C@@]12CCCC[C@@H]1C2(F)F)Nc1ccc([O-])c(Cl)c1 ZINC000612760401 1040697464 /nfs/dbraw/zinc/69/74/64/1040697464.db2.gz VKOPUWOUVYZZHA-JSGCOSHPSA-N -1 1 315.747 4.200 20 0 DIADMM COCOc1ccc(Nc2cc(Cl)c([O-])cc2Cl)cc1 ZINC001211639795 1040955683 /nfs/dbraw/zinc/95/56/83/1040955683.db2.gz WCHMIZRIHKUHOX-UHFFFAOYSA-N -1 1 314.168 4.425 20 0 DIADMM COC(=O)c1ccc(-c2c(Cl)ccc([O-])c2F)c(C)c1F ZINC001244541420 1041395726 /nfs/dbraw/zinc/39/57/26/1041395726.db2.gz BGTGSRSJWOUVIX-UHFFFAOYSA-N -1 1 312.699 4.086 20 0 DIADMM CC[C@H]([NH2+]Cc1cccc(O)c1Cl)c1ccccc1OC ZINC000328201261 1041426893 /nfs/dbraw/zinc/42/68/93/1041426893.db2.gz GFGIMJRLBHWMPL-AWEZNQCLSA-N -1 1 305.805 4.295 20 0 DIADMM C[C@H]1CCc2c(C(=O)Nc3cc([O-])c(F)cc3F)csc2C1 ZINC001625893434 1041497309 /nfs/dbraw/zinc/49/73/09/1041497309.db2.gz IZZXSTPZFINCFC-QMMMGPOBSA-N -1 1 323.364 4.109 20 0 DIADMM O=C(Nc1cc([O-])c(F)cc1F)[C@@H]1CC[C@H]2CCCC[C@@H]2C1 ZINC001625894409 1041513384 /nfs/dbraw/zinc/51/33/84/1041513384.db2.gz WXCLGVLMMQSTED-IJLUTSLNSA-N -1 1 309.356 4.215 20 0 DIADMM Cc1ccc([C@@H](CC(=O)[O-])NCc2ccc(C3CCC3)cc2)o1 ZINC000417575817 1041687774 /nfs/dbraw/zinc/68/77/74/1041687774.db2.gz SXXHOVWUIXSFNF-QGZVFWFLSA-N -1 1 313.397 4.161 20 0 DIADMM [O-]c1cc(F)c(Cl)cc1-c1ccccc1OC[C@H]1CCOC1 ZINC000623048588 1041736208 /nfs/dbraw/zinc/73/62/08/1041736208.db2.gz DYKNPRIVWCROFT-NSHDSACASA-N -1 1 322.763 4.267 20 0 DIADMM CCc1ccc([C@H]2CCCN2[C@@H](C)c2cc(C(=O)[O-])c(C)o2)o1 ZINC000652416596 1042042651 /nfs/dbraw/zinc/04/26/51/1042042651.db2.gz UQTHBLMNHHHFEB-XHDPSFHLSA-N -1 1 317.385 4.340 20 0 DIADMM CCCCC[C@@H]1CCCCN1Cc1nc(=O)c2sccc2[n-]1 ZINC000662153913 1042073575 /nfs/dbraw/zinc/07/35/75/1042073575.db2.gz HLWQKWXUPNJDPB-CYBMUJFWSA-N -1 1 319.474 4.332 20 0 DIADMM C[C@@H](CN(C)C(=O)c1cc(Cl)ccc1[O-])C1CCCCC1 ZINC001170850697 1042090409 /nfs/dbraw/zinc/09/04/09/1042090409.db2.gz WEWKKZYCZFGMJZ-LBPRGKRZSA-N -1 1 309.837 4.334 20 0 DIADMM O=C(Nc1cc(Cl)cc(Cl)c1)c1cccc([O-])c1F ZINC001135886567 1042103387 /nfs/dbraw/zinc/10/33/87/1042103387.db2.gz GDSSWZUDJCWYGE-UHFFFAOYSA-N -1 1 300.116 4.090 20 0 DIADMM Cc1c2ccccc2oc1[C@H](C)NC(=O)c1cc(F)ccc1[O-] ZINC001136375637 1042227130 /nfs/dbraw/zinc/22/71/30/1042227130.db2.gz WWDLXKLJLYABAU-NSHDSACASA-N -1 1 313.328 4.077 20 0 DIADMM CC[C@H](c1ccc(Cl)cc1Cl)N1CCC(C(=O)[O-])CC1 ZINC000005984859 1042234862 /nfs/dbraw/zinc/23/48/62/1042234862.db2.gz ZSSWLGJQZWUEEN-CQSZACIVSA-N -1 1 316.228 4.241 20 0 DIADMM CC(C)CCOc1cccc(NC(=O)c2cc(F)ccc2[O-])c1 ZINC001136416382 1042242826 /nfs/dbraw/zinc/24/28/26/1042242826.db2.gz NNDJIFPQAJKAMR-UHFFFAOYSA-N -1 1 317.360 4.209 20 0 DIADMM C=Cc1ccc(S(=O)(=O)[N-]c2ccc3ccccc3c2)cc1 ZINC000821116414 1042242857 /nfs/dbraw/zinc/24/28/57/1042242857.db2.gz NXTUVEDWJGSTOH-UHFFFAOYSA-N -1 1 309.390 4.284 20 0 DIADMM CC[C@@H]([NH2+][C@@H](C)c1nc(C)cc(=O)[nH]1)c1ccc(Cl)s1 ZINC000279045018 1042263768 /nfs/dbraw/zinc/26/37/68/1042263768.db2.gz GJSTYWYALVKTRC-VHSXEESVSA-N -1 1 311.838 4.007 20 0 DIADMM O=C(c1ccc([O-])cc1F)N1CCCCC[C@@H]1c1ccccc1 ZINC001136510757 1042266941 /nfs/dbraw/zinc/26/69/41/1042266941.db2.gz KLAISCCMEKLTPE-GOSISDBHSA-N -1 1 313.372 4.289 20 0 DIADMM O=C(c1ccc([O-])cc1F)N1CCCCC[C@H]1c1ccccc1 ZINC001136510758 1042267069 /nfs/dbraw/zinc/26/70/69/1042267069.db2.gz KLAISCCMEKLTPE-SFHVURJKSA-N -1 1 313.372 4.289 20 0 DIADMM O=C(Nc1ccc2scnc2c1)c1cc2ccccc2cc1[O-] ZINC001136532568 1042272956 /nfs/dbraw/zinc/27/29/56/1042272956.db2.gz RBAUJMPZSAOBCG-UHFFFAOYSA-N -1 1 320.373 4.407 20 0 DIADMM Cc1sc(CC(=O)Nc2ccc([O-])c(Cl)c2)nc1C(C)C ZINC000279509582 1042319635 /nfs/dbraw/zinc/31/96/35/1042319635.db2.gz QOXGHANCMFNSLG-UHFFFAOYSA-N -1 1 324.833 4.115 20 0 DIADMM CC(C)CCN(C(=O)c1ccc(C(F)(F)F)cc1[O-])C1CC1 ZINC000436752333 1042337586 /nfs/dbraw/zinc/33/75/86/1042337586.db2.gz RCSRYYUWJMILBX-UHFFFAOYSA-N -1 1 315.335 4.062 20 0 DIADMM Cc1ccc([C@@H](NCc2cccc(Cl)c2Cl)C(=O)[O-])cc1 ZINC000426705402 1042382129 /nfs/dbraw/zinc/38/21/29/1042382129.db2.gz PBPQCNUICJGZEB-OAHLLOKOSA-N -1 1 324.207 4.217 20 0 DIADMM CCc1nc(SCc2nc(C(C)(C)C)cs2)[n-]c(=O)c1C ZINC000576173622 1042464466 /nfs/dbraw/zinc/46/44/66/1042464466.db2.gz WRNSFFGWADHPSD-UHFFFAOYSA-N -1 1 323.487 4.099 20 0 DIADMM C[C@@H]1c2cc(Cl)cc(Cl)c2CCN1CCCCC(=O)[O-] ZINC000262211153 1042535795 /nfs/dbraw/zinc/53/57/95/1042535795.db2.gz IVZUXPAYZRYEMM-SNVBAGLBSA-N -1 1 316.228 4.167 20 0 DIADMM CN(CCCOCc1ccccc1)Cc1cccc(O)c1Cl ZINC000513478659 1042546152 /nfs/dbraw/zinc/54/61/52/1042546152.db2.gz FQTYZNQFGBDQKC-UHFFFAOYSA-N -1 1 319.832 4.084 20 0 DIADMM C[C@H](CC(F)(F)F)c1nc(-c2ccc([O-])cc2Cl)no1 ZINC000420495870 1042602826 /nfs/dbraw/zinc/60/28/26/1042602826.db2.gz WWIZIBXDCSCJOO-ZCFIWIBFSA-N -1 1 306.671 4.152 20 0 DIADMM C[C@@H](CC(F)(F)F)c1nc(-c2ccc([O-])cc2Cl)no1 ZINC000420495868 1042603054 /nfs/dbraw/zinc/60/30/54/1042603054.db2.gz WWIZIBXDCSCJOO-LURJTMIESA-N -1 1 306.671 4.152 20 0 DIADMM C[C@@H]1CCC[C@H](C)CN1C(=O)c1ccc(C(F)(F)F)cc1[O-] ZINC000436751744 1042843086 /nfs/dbraw/zinc/84/30/86/1042843086.db2.gz NNHKPEDKTJEWAG-WDEREUQCSA-N -1 1 315.335 4.062 20 0 DIADMM CCCC[C@H](C(=O)[O-])N1CCC[C@H]1c1nc2ccccc2s1 ZINC000516976008 1042862127 /nfs/dbraw/zinc/86/21/27/1042862127.db2.gz REJNDUPWRTXULG-UONOGXRCSA-N -1 1 318.442 4.077 20 0 DIADMM C[C@H](C(=O)[O-])[C@H](NCc1cc(Cl)ccc1F)c1ccccc1 ZINC000426749628 1042979626 /nfs/dbraw/zinc/97/96/26/1042979626.db2.gz HHFYJCHUSOORPZ-ZBEGNZNMSA-N -1 1 321.779 4.031 20 0 DIADMM O=C(c1ccc(Cl)cc1[O-])N1CCC(c2ccsc2)CC1 ZINC000188008006 1042996435 /nfs/dbraw/zinc/99/64/35/1042996435.db2.gz YFHLQXVYRXCMOM-UHFFFAOYSA-N -1 1 321.829 4.127 20 0 DIADMM Cc1ccc([N-]S(=O)(=O)c2ccc(C(F)F)cc2)cc1C ZINC000519839014 1043004449 /nfs/dbraw/zinc/00/44/49/1043004449.db2.gz FWGQOJZADZDUKM-UHFFFAOYSA-N -1 1 311.353 4.042 20 0 DIADMM CN(Cc1ccc(Cl)s1)C(=O)c1c([O-])cccc1Cl ZINC000049085148 1043057173 /nfs/dbraw/zinc/05/71/73/1043057173.db2.gz XPQWSPYJXNQFBP-UHFFFAOYSA-N -1 1 316.209 4.033 20 0 DIADMM Cc1nc(SC[C@]2(C)CC2(Cl)Cl)[n-]c(=O)c1C1CC1 ZINC000865373157 1043088405 /nfs/dbraw/zinc/08/84/05/1043088405.db2.gz IAJGOPSLWMPKPR-LBPRGKRZSA-N -1 1 319.257 4.044 20 0 DIADMM CC(C)Sc1ccccc1[N-]C(=O)c1ncc(F)cc1F ZINC000190387258 1043178242 /nfs/dbraw/zinc/17/82/42/1043178242.db2.gz BGPNSGWUTHYMFR-UHFFFAOYSA-N -1 1 308.353 4.113 20 0 DIADMM Cc1cccc([N-]S(=O)(=O)c2ccc(C(F)F)cc2)c1C ZINC000521101246 1043359765 /nfs/dbraw/zinc/35/97/65/1043359765.db2.gz GPOXGBAQJSICRJ-UHFFFAOYSA-N -1 1 311.353 4.042 20 0 DIADMM O=C(CSc1nc2ccc(Cl)cc2o1)c1ccc([O-])cc1 ZINC000521211856 1043372726 /nfs/dbraw/zinc/37/27/26/1043372726.db2.gz UMVLUHGWARLDKM-UHFFFAOYSA-N -1 1 319.769 4.162 20 0 DIADMM CCCCN(C(=O)c1cc(Cl)c([O-])c(OC)c1)[C@H](C)CC ZINC000442974113 1043463547 /nfs/dbraw/zinc/46/35/47/1043463547.db2.gz PAIQJWOHKJHYME-LLVKDONJSA-N -1 1 313.825 4.095 20 0 DIADMM CCOc1cc(-c2nc(-c3ccccc3)no2)cc(Cl)c1[O-] ZINC000443083589 1043479462 /nfs/dbraw/zinc/47/94/62/1043479462.db2.gz DHFZVVLZLZNSMN-UHFFFAOYSA-N -1 1 316.744 4.161 20 0 DIADMM COc1ccc2cc(-c3nc4cccc(C)c4c(=O)[n-]3)ccc2c1 ZINC000522069754 1043529749 /nfs/dbraw/zinc/52/97/49/1043529749.db2.gz FCAKKKCVPVWUAY-UHFFFAOYSA-N -1 1 316.360 4.060 20 0 DIADMM CCc1ccccc1[C@@H]1C[C@H]1C(=O)Nc1ccc([O-])c(Cl)c1 ZINC000558831104 1043612450 /nfs/dbraw/zinc/61/24/50/1043612450.db2.gz OIRJNWNMPFKIFL-LSDHHAIUSA-N -1 1 315.800 4.350 20 0 DIADMM Cc1ccc(-c2ccc(C=C3SC(=O)[N-]C3=O)s2)cc1 ZINC000147721920 1043737172 /nfs/dbraw/zinc/73/71/72/1043737172.db2.gz LTRNNMQSABKYNS-JYRVWZFOSA-N -1 1 301.392 4.047 20 0 DIADMM Cc1cccc2nc(-c3ccc(O)c(Br)c3)[nH]c21 ZINC000261367511 1043756643 /nfs/dbraw/zinc/75/66/43/1043756643.db2.gz UQVKRJLBVFGOTD-UHFFFAOYSA-N -1 1 303.159 4.006 20 0 DIADMM Cc1cccc2[nH]c(-c3ccc([O-])c(Br)c3)nc21 ZINC000261367511 1043756656 /nfs/dbraw/zinc/75/66/56/1043756656.db2.gz UQVKRJLBVFGOTD-UHFFFAOYSA-N -1 1 303.159 4.006 20 0 DIADMM Cc1noc(C(C)C)c1[N-]C(=O)c1nc(C(C)(C)C)cs1 ZINC000928780019 1043772474 /nfs/dbraw/zinc/77/24/74/1043772474.db2.gz IMWQZBRWXNWCRB-UHFFFAOYSA-N -1 1 307.419 4.113 20 0 DIADMM Cc1noc(C(C)C)c1NC(=O)c1ccc(C(C)C)cc1[O-] ZINC000928786587 1043773458 /nfs/dbraw/zinc/77/34/58/1043773458.db2.gz UJHDLVMQGCYNIU-UHFFFAOYSA-N -1 1 302.374 4.188 20 0 DIADMM CN(C(=O)c1ccc([O-])cc1F)c1ccc(C(C)(C)C)cc1 ZINC000777851458 1043854272 /nfs/dbraw/zinc/85/42/72/1043854272.db2.gz OWNVBSSZDGMNAV-UHFFFAOYSA-N -1 1 301.361 4.105 20 0 DIADMM C[C@H](c1ccc(F)c(Cl)c1)N1CCC(CCC(=O)[O-])CC1 ZINC000086756155 1044235815 /nfs/dbraw/zinc/23/58/15/1044235815.db2.gz VMCQTZRDBWYMNN-LLVKDONJSA-N -1 1 313.800 4.117 20 0 DIADMM Cc1csc([C@@H](NCc2cccc([O-])c2Cl)C2CC2)n1 ZINC000293478553 1044289054 /nfs/dbraw/zinc/28/90/54/1044289054.db2.gz FOUPBPLMOVBTAQ-AWEZNQCLSA-N -1 1 308.834 4.051 20 0 DIADMM CCC(CC)c1cc(CNCc2cccc([O-])c2Cl)on1 ZINC000293539545 1044297383 /nfs/dbraw/zinc/29/73/83/1044297383.db2.gz KDIVYTVJIKIBJD-UHFFFAOYSA-N -1 1 308.809 4.227 20 0 DIADMM O=S(=O)([N-]c1ccc(Cl)cc1)c1ccc(C(F)F)cc1 ZINC000564058223 1044335300 /nfs/dbraw/zinc/33/53/00/1044335300.db2.gz PNUBLQGAOPQFTL-UHFFFAOYSA-N -1 1 317.744 4.078 20 0 DIADMM CCC/C(C)=C/C(=O)Nc1cc(C)cc(Br)c1[O-] ZINC000778447982 1044403714 /nfs/dbraw/zinc/40/37/14/1044403714.db2.gz HXVNGSLTYAXDTB-CMDGGOBGSA-N -1 1 312.207 4.148 20 0 DIADMM Cc1cc(Br)c([O-])c(NC(=O)/C=C\C(C)(C)C)c1 ZINC000778446668 1044404162 /nfs/dbraw/zinc/40/41/62/1044404162.db2.gz AVINJOPQGOEQAT-WAYWQWQTSA-N -1 1 312.207 4.004 20 0 DIADMM O=C([O-])c1occc1CN1CCCC[C@H]1c1cc2ccccc2[nH]1 ZINC000565101736 1044412311 /nfs/dbraw/zinc/41/23/11/1044412311.db2.gz VPLKDJYBUWOUKX-KRWDZBQOSA-N -1 1 324.380 4.186 20 0 DIADMM Cc1cc(CN(C)[C@H](C)c2cc3ccccc3o2)oc1C(=O)[O-] ZINC000566358567 1044484757 /nfs/dbraw/zinc/48/47/57/1044484757.db2.gz XPEUMEDUWIUTRK-GFCCVEGCSA-N -1 1 313.353 4.225 20 0 DIADMM COc1ccc(NC(=O)Nc2cc([O-])c(Cl)cc2F)c(C)c1 ZINC001202725320 1044520853 /nfs/dbraw/zinc/52/08/53/1044520853.db2.gz KOFCKCVCQLAINV-UHFFFAOYSA-N -1 1 324.739 4.146 20 0 DIADMM CCOc1cc(-c2noc(C3=CCCC3)n2)cc(Cl)c1[O-] ZINC000445409687 1044714921 /nfs/dbraw/zinc/71/49/21/1044714921.db2.gz CCWUUBSPPWUYHF-UHFFFAOYSA-N -1 1 306.749 4.062 20 0 DIADMM C[C@@H](c1cccs1)c1nc(-c2ccc([O-])cc2Cl)no1 ZINC000445450255 1044719646 /nfs/dbraw/zinc/71/96/46/1044719646.db2.gz XKJFDTRGNBTEKX-QMMMGPOBSA-N -1 1 306.774 4.309 20 0 DIADMM COc1ccc(-c2nc(-c3ccc([O-])cc3Cl)no2)c(C)c1 ZINC000445446558 1044723202 /nfs/dbraw/zinc/72/32/02/1044723202.db2.gz MGUAJSIRSKXRNP-UHFFFAOYSA-N -1 1 316.744 4.080 20 0 DIADMM CC(C)(c1cccs1)c1nc(-c2ccc([O-])cc2Cl)no1 ZINC000445443351 1044723791 /nfs/dbraw/zinc/72/37/91/1044723791.db2.gz BZJKQOHMECHVKU-UHFFFAOYSA-N -1 1 320.801 4.483 20 0 DIADMM [O-]c1ccc(-c2noc(CCc3ccc(Cl)s3)n2)c(F)c1 ZINC000445464940 1044724846 /nfs/dbraw/zinc/72/48/46/1044724846.db2.gz PJZOJLPQDORHGA-UHFFFAOYSA-N -1 1 324.764 4.081 20 0 DIADMM Cc1[nH]c2ccc(-c3nc(-c4ccc([O-])c(F)c4)no3)cc2c1C ZINC000445472312 1044727706 /nfs/dbraw/zinc/72/77/06/1044727706.db2.gz KECBKANBWWPVRL-UHFFFAOYSA-N -1 1 323.327 4.346 20 0 DIADMM Cc1ccc(SCc2nc(-c3ccc([O-])c(F)c3)no2)cc1 ZINC000445468631 1044728267 /nfs/dbraw/zinc/72/82/67/1044728267.db2.gz FKVMXHXIXDZBOQ-UHFFFAOYSA-N -1 1 316.357 4.182 20 0 DIADMM Cc1cc(-c2nc(-c3ccc([O-])c(F)c3)no2)cc(C)c1F ZINC000445479104 1044729679 /nfs/dbraw/zinc/72/96/79/1044729679.db2.gz IXSATFMADHQYHF-UHFFFAOYSA-N -1 1 302.280 4.004 20 0 DIADMM Cc1cc(-c2nc(-c3ccc([O-])c(F)c3)no2)nc2ccccc12 ZINC000445478038 1044729731 /nfs/dbraw/zinc/72/97/31/1044729731.db2.gz PJPFMGTYEIXKOT-UHFFFAOYSA-N -1 1 321.311 4.105 20 0 DIADMM [O-]c1ccc(-c2noc(/C=C/c3c(F)cccc3F)n2)cc1F ZINC000445479605 1044731081 /nfs/dbraw/zinc/73/10/81/1044731081.db2.gz GJRSRLFIKAXVAB-FNORWQNLSA-N -1 1 318.254 4.030 20 0 DIADMM C[C@@H](CCc1nc(-c2ccc([O-])c(F)c2)no1)c1ccccc1 ZINC000445484779 1044732184 /nfs/dbraw/zinc/73/21/84/1044732184.db2.gz UUJGGGQUPTXKIV-LBPRGKRZSA-N -1 1 312.344 4.318 20 0 DIADMM [O-]c1ccc(-c2noc([C@@H]3CCCc4ccccc43)n2)cc1F ZINC000445484181 1044733246 /nfs/dbraw/zinc/73/32/46/1044733246.db2.gz XUJHURIYLVLQDE-CQSZACIVSA-N -1 1 310.328 4.050 20 0 DIADMM COc1ccc(-c2nc(-c3oc4ccccc4c3C)no2)c([O-])c1 ZINC000445499675 1044734611 /nfs/dbraw/zinc/73/46/11/1044734611.db2.gz BEZDTJKYVRDVAJ-UHFFFAOYSA-N -1 1 322.320 4.172 20 0 DIADMM Cc1sc(NC(=O)c2ccccc2[O-])nc1-c1ccccc1 ZINC000006185687 1044741313 /nfs/dbraw/zinc/74/13/13/1044741313.db2.gz XSXLAQQCXGMXAH-UHFFFAOYSA-N -1 1 310.378 4.076 20 0 DIADMM Cc1nnc(-c2ccccc2NCc2cccc([O-])c2Cl)o1 ZINC000337648951 1044935368 /nfs/dbraw/zinc/93/53/68/1044935368.db2.gz JDNULBXPCOAYAK-UHFFFAOYSA-N -1 1 315.760 4.016 20 0 DIADMM O=C(Nc1ccc(C2CCC2)cc1)c1c(F)ccc([O-])c1F ZINC000574438189 1044954577 /nfs/dbraw/zinc/95/45/77/1044954577.db2.gz FGCXONAUTWVVRS-UHFFFAOYSA-N -1 1 303.308 4.190 20 0 DIADMM CC[C@H]1CCC[N@H+]([C@H](C(=O)[O-])c2ccc(Cl)c(Cl)c2)C1 ZINC000575809990 1045008673 /nfs/dbraw/zinc/00/86/73/1045008673.db2.gz HBTKTQCMVUMHSV-HZMBPMFUSA-N -1 1 316.228 4.241 20 0 DIADMM O=c1cc(CSc2ccc3c(c2)CCC3)c2ccc([O-])cc2o1 ZINC000007687872 1045391553 /nfs/dbraw/zinc/39/15/53/1045391553.db2.gz ZMIIZULWIZQBMJ-UHFFFAOYSA-N -1 1 324.401 4.280 20 0 DIADMM CC[C@@H]1CC[C@H](C(=O)Nc2cc(Cl)c([O-])c3ccccc23)O1 ZINC000529539783 1045491245 /nfs/dbraw/zinc/49/12/45/1045491245.db2.gz UGRBVTZNWAMGSF-MEBBXXQBSA-N -1 1 319.788 4.095 20 0 DIADMM CC[C@@H](C)[C@H](OC)C(=O)Nc1cc(Cl)c([O-])c2ccccc12 ZINC000529538386 1045494306 /nfs/dbraw/zinc/49/43/06/1045494306.db2.gz BQLGLKFTAKKQLF-HWPZZCPQSA-N -1 1 321.804 4.198 20 0 DIADMM CO[C@H](CC(C)C)C(=O)Nc1cc(Cl)c([O-])c2ccccc12 ZINC000529538538 1045494736 /nfs/dbraw/zinc/49/47/36/1045494736.db2.gz DDQFVNBVOKSBCP-OAHLLOKOSA-N -1 1 321.804 4.198 20 0 DIADMM O=C(Nc1cc(Cl)c([O-])c2ccccc12)[C@H]1CCCSC1 ZINC000628233436 1045552499 /nfs/dbraw/zinc/55/24/99/1045552499.db2.gz CAXKHTLNUOJLCN-JTQLQIEISA-N -1 1 321.829 4.281 20 0 DIADMM Cc1oc(C(C)(C)C)cc1CN[C@H](CC(=O)[O-])c1ccsc1 ZINC000900021308 1045590704 /nfs/dbraw/zinc/59/07/04/1045590704.db2.gz AUAWHPSKRJQJPD-CQSZACIVSA-N -1 1 321.442 4.253 20 0 DIADMM Cc1sc([C@@H](C)NCc2ccccc2C(C)C)nc1C(=O)[O-] ZINC000900078225 1045598807 /nfs/dbraw/zinc/59/88/07/1045598807.db2.gz IPUGDUUJDAGRNI-LLVKDONJSA-N -1 1 318.442 4.124 20 0 DIADMM C[C@@H]1C[C@@H](C(=O)[O-])C[C@H](C)N1Cc1cccc(Cl)c1Cl ZINC000530173438 1045614530 /nfs/dbraw/zinc/61/45/30/1045614530.db2.gz FQNZACAMFVNMMS-PEGIJTEDSA-N -1 1 316.228 4.067 20 0 DIADMM C[C@@H]1C[C@@H](C(=O)[O-])C[C@H](C)N1Cc1cc(Cl)cc(Cl)c1 ZINC000530175483 1045616322 /nfs/dbraw/zinc/61/63/22/1045616322.db2.gz PQLDDSDQOQYKEK-PEGIJTEDSA-N -1 1 316.228 4.067 20 0 DIADMM C[C@@H]1CC(C(=O)[O-])C[C@@H](C)N1Cc1cc(Cl)ccc1Cl ZINC000530174246 1045616846 /nfs/dbraw/zinc/61/68/46/1045616846.db2.gz JEXIZSGYJYOHPI-NXEZZACHSA-N -1 1 316.228 4.067 20 0 DIADMM O=C(CC1CCC(C(F)(F)F)CC1)Nc1cccc(F)c1[O-] ZINC000628959849 1045626050 /nfs/dbraw/zinc/62/60/50/1045626050.db2.gz ILEVSPKUKDQYSC-UHFFFAOYSA-N -1 1 319.298 4.229 20 0 DIADMM Cc1cccc(OCCCCC(=O)Nc2cccc(F)c2[O-])c1 ZINC000628960583 1045626352 /nfs/dbraw/zinc/62/63/52/1045626352.db2.gz KVIANHKEXDDMTD-UHFFFAOYSA-N -1 1 317.360 4.028 20 0 DIADMM CCc1cc(O)ccc1NC(=O)c1ccc2ccccc2c1[O-] ZINC000191052354 1045650009 /nfs/dbraw/zinc/65/00/09/1045650009.db2.gz DAGJMPXCRVRWMP-UHFFFAOYSA-N -1 1 307.349 4.066 20 0 DIADMM C[C@@H](C(=O)[N-]OCc1ccccc1)c1ccc2ccccc2c1 ZINC000753280090 1045744514 /nfs/dbraw/zinc/74/45/14/1045744514.db2.gz SJOKMCDUTHGETI-OAHLLOKOSA-N -1 1 305.377 4.191 20 0 DIADMM CCCCC/C(=C\c1ccccc1)CN1CC[C@](F)(C(=O)[O-])C1 ZINC000901515465 1045755302 /nfs/dbraw/zinc/75/53/02/1045755302.db2.gz MPLRGTYZRATYCK-XEYRCQSKSA-N -1 1 319.420 4.149 20 0 DIADMM C[C@H]1CC[C@@H](c2nc(=O)c3c(-c4ccccc4)csc3[n-]2)O1 ZINC000630384765 1045755327 /nfs/dbraw/zinc/75/53/27/1045755327.db2.gz HLGPHBHTOXNKPG-GWCFXTLKSA-N -1 1 312.394 4.304 20 0 DIADMM C[C@H]1CC[C@@H](c2nc(=O)c3cc(-c4ccccc4)sc3[n-]2)O1 ZINC000630384934 1045755386 /nfs/dbraw/zinc/75/53/86/1045755386.db2.gz JPHUGGMAKWTINZ-GWCFXTLKSA-N -1 1 312.394 4.304 20 0 DIADMM CCCCC/C(=C/c1ccccc1)CN1CC[C@](F)(C(=O)[O-])C1 ZINC000901515461 1045755335 /nfs/dbraw/zinc/75/53/35/1045755335.db2.gz MPLRGTYZRATYCK-BLMOFCDVSA-N -1 1 319.420 4.149 20 0 DIADMM Cc1cc(C)c(/C=C\CN[C@@H](C(=O)[O-])c2cccs2)cc1C ZINC000901598700 1045775081 /nfs/dbraw/zinc/77/50/81/1045775081.db2.gz PVXBCCFFNBMYIH-XQDHMALISA-N -1 1 315.438 4.102 20 0 DIADMM Cc1cc(C)c(/C=C/CN[C@H](C(=O)[O-])c2cccs2)c(C)c1 ZINC000901597893 1045775457 /nfs/dbraw/zinc/77/54/57/1045775457.db2.gz JPYDNIATUYAFLN-YXMMZVCTSA-N -1 1 315.438 4.102 20 0 DIADMM Cc1ccc([C@@H](C)N(C)C(=O)Cc2ccc([O-])c(Cl)c2)cc1 ZINC000630695978 1045775667 /nfs/dbraw/zinc/77/56/67/1045775667.db2.gz BXGNFCYNBFRRTR-CYBMUJFWSA-N -1 1 317.816 4.116 20 0 DIADMM CC[C@H](C)C[C@@H](NCc1ccc(-c2ccc(C)cc2)o1)C(=O)[O-] ZINC000901670724 1045790577 /nfs/dbraw/zinc/79/05/77/1045790577.db2.gz CFRIJLGFVCNKFO-SUMWQHHRSA-N -1 1 315.413 4.234 20 0 DIADMM Cc1nc(SCCCCC(F)(F)F)[n-]c(=O)c1C1CC1 ZINC000631024677 1045798496 /nfs/dbraw/zinc/79/84/96/1045798496.db2.gz XSOKRXFIPYCKFY-UHFFFAOYSA-N -1 1 306.353 4.193 20 0 DIADMM CCCCC[C@@H](NCc1cc2cccc(CC)c2o1)C(=O)[O-] ZINC000901723382 1045798568 /nfs/dbraw/zinc/79/85/68/1045798568.db2.gz WQPFFAMDNZSXAW-MRXNPFEDSA-N -1 1 303.402 4.118 20 0 DIADMM CCC[C@@H](NCc1cc(C(=O)[O-])c(CC)o1)c1ccccc1 ZINC000902072929 1045904384 /nfs/dbraw/zinc/90/43/84/1045904384.db2.gz VZXMHCSJTRCZRP-MRXNPFEDSA-N -1 1 301.386 4.171 20 0 DIADMM CCc1oc(CN[C@H](CC)c2ccc(Cl)cc2)cc1C(=O)[O-] ZINC000902089274 1045909071 /nfs/dbraw/zinc/90/90/71/1045909071.db2.gz TXLWAMWSCGRTAG-OAHLLOKOSA-N -1 1 321.804 4.435 20 0 DIADMM CC[C@@H](NCc1cc(C)c(C(=O)[O-])o1)c1ccc(Cl)cc1 ZINC000902089009 1045909765 /nfs/dbraw/zinc/90/97/65/1045909765.db2.gz QWENILJUSBIPSV-CQSZACIVSA-N -1 1 307.777 4.181 20 0 DIADMM CCc1oc(CN[C@@H](CC)c2ccc(Cl)cc2)cc1C(=O)[O-] ZINC000902089273 1045910197 /nfs/dbraw/zinc/91/01/97/1045910197.db2.gz TXLWAMWSCGRTAG-HNNXBMFYSA-N -1 1 321.804 4.435 20 0 DIADMM CCOc1cccc(/C=C/C(=O)Nc2ccc([O-])c(Cl)c2)c1 ZINC001137674354 1045929717 /nfs/dbraw/zinc/92/97/17/1045929717.db2.gz QDZXIAGGIKYSEV-RMKNXTFCSA-N -1 1 317.772 4.096 20 0 DIADMM CSc1ccc(CCC(=O)Nc2ccc([O-])c(Cl)c2)cc1 ZINC001137674458 1045930462 /nfs/dbraw/zinc/93/04/62/1045930462.db2.gz UVOPJXXVYOOYSK-UHFFFAOYSA-N -1 1 321.829 4.339 20 0 DIADMM CCSc1ccc([C@@H](C)NCc2cc(C(=O)[O-])oc2C)cc1 ZINC000902220231 1045947465 /nfs/dbraw/zinc/94/74/65/1045947465.db2.gz CNFIWRRMWKCLDC-LLVKDONJSA-N -1 1 319.426 4.249 20 0 DIADMM O=C([O-])c1occc1CN[C@H](c1ccccc1F)C1CCCC1 ZINC000902383123 1045988627 /nfs/dbraw/zinc/98/86/27/1045988627.db2.gz YJQHBRQZDJXIEO-INIZCTEOSA-N -1 1 317.360 4.138 20 0 DIADMM Cc1nc(SCc2cccc3ncccc23)[n-]c(=O)c1C1CC1 ZINC000634536243 1046074224 /nfs/dbraw/zinc/07/42/24/1046074224.db2.gz XVYJYCBMWONPTL-UHFFFAOYSA-N -1 1 323.421 4.209 20 0 DIADMM C[C@H](C[N@@H+](C)[C@H](C(=O)[O-])c1c(F)cccc1Cl)C(C)(C)C ZINC000634697143 1046085715 /nfs/dbraw/zinc/08/57/15/1046085715.db2.gz BGUNEAXNECFOON-YGRLFVJLSA-N -1 1 315.816 4.219 20 0 DIADMM C[C@H](CCNC(=O)Cc1ccc([O-])c(Cl)c1)CC(C)(C)C ZINC001138249771 1046127006 /nfs/dbraw/zinc/12/70/06/1046127006.db2.gz BGFNSDYMFCEBLP-GFCCVEGCSA-N -1 1 311.853 4.167 20 0 DIADMM CCC1(CC)CCCN(C(=O)c2ccc(Cl)cc2[O-])CC1 ZINC001138249141 1046128159 /nfs/dbraw/zinc/12/81/59/1046128159.db2.gz ZWRMIXVNOGJMSQ-UHFFFAOYSA-N -1 1 309.837 4.478 20 0 DIADMM CC[C@@]1(C(=O)[O-])CCC[N@@H+](Cc2cc(Cl)cc(Cl)c2)C1 ZINC000086784076 1046164800 /nfs/dbraw/zinc/16/48/00/1046164800.db2.gz WCNUUFSDNHIRKA-OAHLLOKOSA-N -1 1 316.228 4.070 20 0 DIADMM [O-]c1cc(F)c(Nc2ccc(Br)cc2F)cc1F ZINC001212870403 1046235973 /nfs/dbraw/zinc/23/59/73/1046235973.db2.gz AFRUIBUGISAUGJ-UHFFFAOYSA-N -1 1 318.092 4.316 20 0 DIADMM O=C([N-]c1ccccc1SCc1ccccc1)c1cnco1 ZINC000758153814 1046251660 /nfs/dbraw/zinc/25/16/60/1046251660.db2.gz CAOKJWFFFXOIHJ-UHFFFAOYSA-N -1 1 310.378 4.219 20 0 DIADMM CC(C)Oc1ccccc1[C@H](C)NCc1cccc(C(=O)[O-])c1 ZINC000666573586 1046378304 /nfs/dbraw/zinc/37/83/04/1046378304.db2.gz WQGUCCXKLUDHIH-AWEZNQCLSA-N -1 1 313.397 4.023 20 0 DIADMM O=C([O-])c1ccccc1C1CCN(Cc2ccc(Cl)o2)CC1 ZINC000666586369 1046385446 /nfs/dbraw/zinc/38/54/46/1046385446.db2.gz PITSQRPQHKZQMD-UHFFFAOYSA-N -1 1 319.788 4.011 20 0 DIADMM Cc1cc(C(=O)[N-]c2cc(Cl)ccc2SC(C)C)no1 ZINC000104483296 1046390768 /nfs/dbraw/zinc/39/07/68/1046390768.db2.gz VVQDWZFKKUYGRA-UHFFFAOYSA-N -1 1 310.806 4.389 20 0 DIADMM COc1ccc2nc(-c3ccc4ccccc4c3)[n-]c(=O)c2c1 ZINC000299834174 1046403154 /nfs/dbraw/zinc/40/31/54/1046403154.db2.gz BLHHDKLGSJTBEJ-UHFFFAOYSA-N -1 1 302.333 4.164 20 0 DIADMM CC[C@@H](CC(=O)Nc1c([O-])cccc1F)c1ccc(OC)cc1 ZINC000677000495 1046452846 /nfs/dbraw/zinc/45/28/46/1046452846.db2.gz QADBEPOMCCUIFO-LBPRGKRZSA-N -1 1 317.360 4.062 20 0 DIADMM Cc1c2ccccc2oc1C(=O)Nc1ccc(Cl)cc1[O-] ZINC000677211860 1046475341 /nfs/dbraw/zinc/47/53/41/1046475341.db2.gz CLWVKQWHEQKEND-UHFFFAOYSA-N -1 1 301.729 4.353 20 0 DIADMM C[C@@H](Cc1cccc(Cl)c1)C(=O)Nc1c([O-])cccc1F ZINC000677405235 1046494584 /nfs/dbraw/zinc/49/45/84/1046494584.db2.gz VKGUGFVCVXZEOO-JTQLQIEISA-N -1 1 307.752 4.002 20 0 DIADMM CC(C)Cc1ccc([C@H](C)C(=O)Nc2c([O-])cccc2F)cc1 ZINC000677797864 1046527644 /nfs/dbraw/zinc/52/76/44/1046527644.db2.gz GZJGYZDCUNELKJ-ZDUSSCGKSA-N -1 1 315.388 4.472 20 0 DIADMM O=C(c1cc2ccccc2cc1[O-])N1CC[C@@H]1c1cccc(F)c1 ZINC000678313934 1046617993 /nfs/dbraw/zinc/61/79/93/1046617993.db2.gz KDNQDVXZSUJWFL-GOSISDBHSA-N -1 1 321.351 4.272 20 0 DIADMM COc1ccc(Nc2cc(F)c([O-])cc2F)cc1OC(C)C ZINC001203019647 1046637809 /nfs/dbraw/zinc/63/78/09/1046637809.db2.gz FORQQSFFYSNHDH-UHFFFAOYSA-N -1 1 309.312 4.210 20 0 DIADMM Cc1ccc(OCCC(=O)Nc2ccc([O-])c(Cl)c2)c(C)c1 ZINC000533081807 1046649756 /nfs/dbraw/zinc/64/97/56/1046649756.db2.gz WINYFAWHKWINBG-UHFFFAOYSA-N -1 1 319.788 4.070 20 0 DIADMM O=C(Nc1ccc([O-])c(Cl)c1)[C@@H]1CCc2c1cccc2Cl ZINC000678862241 1046722374 /nfs/dbraw/zinc/72/23/74/1046722374.db2.gz BBCFADJKUPHHEK-GFCCVEGCSA-N -1 1 322.191 4.368 20 0 DIADMM O=C(C[C@@H]1CCCc2ccccc21)Nc1ccc([O-])c(Cl)c1 ZINC000533540109 1046749610 /nfs/dbraw/zinc/74/96/10/1046749610.db2.gz HIQOPYNZIDEWQY-ZDUSSCGKSA-N -1 1 315.800 4.494 20 0 DIADMM O=C(C[C@H]1CCCc2ccccc21)Nc1ccc([O-])c(Cl)c1 ZINC000533540108 1046749666 /nfs/dbraw/zinc/74/96/66/1046749666.db2.gz HIQOPYNZIDEWQY-CYBMUJFWSA-N -1 1 315.800 4.494 20 0 DIADMM O=C([O-])c1ccccc1CN1CCC[C@H]1c1ccc(Cl)s1 ZINC001140503763 1046756206 /nfs/dbraw/zinc/75/62/06/1046756206.db2.gz KZAPHGVSBVCJBO-ZDUSSCGKSA-N -1 1 321.829 4.437 20 0 DIADMM O=C([O-])c1ccccc1CN1CCC[C@@H]1c1cc(F)cc(F)c1 ZINC001140503911 1046756714 /nfs/dbraw/zinc/75/67/14/1046756714.db2.gz CLFLCFUMIFQVFO-QGZVFWFLSA-N -1 1 317.335 4.000 20 0 DIADMM [O-]c1cccc(CNCc2c(F)cccc2Cl)c1Cl ZINC000645151746 1046770028 /nfs/dbraw/zinc/77/00/28/1046770028.db2.gz AAOGRJFBWXZFDM-UHFFFAOYSA-N -1 1 300.160 4.128 20 0 DIADMM COc1cccc(F)c1[C@H](C)NCc1cccc([O-])c1Cl ZINC000645157046 1046769798 /nfs/dbraw/zinc/76/97/98/1046769798.db2.gz FPQQSHIOYMNIRQ-JTQLQIEISA-N -1 1 309.768 4.044 20 0 DIADMM CCc1c(NCc2cccc([O-])c2Cl)cnn1CCC(C)C ZINC000645177292 1046774884 /nfs/dbraw/zinc/77/48/84/1046774884.db2.gz SJHLWLIZLQSZEV-UHFFFAOYSA-N -1 1 321.852 4.463 20 0 DIADMM [O-]c1ccc(Cl)c(Nc2ccc(O)c(F)c2F)c1Cl ZINC001212011011 1046816850 /nfs/dbraw/zinc/81/68/50/1046816850.db2.gz MEWYGBSDVXSVHP-UHFFFAOYSA-N -1 1 306.095 4.426 20 0 DIADMM [O-]c1cc(Cl)c(Nc2ccc(O)c(F)c2F)cc1Cl ZINC001212009477 1046818728 /nfs/dbraw/zinc/81/87/28/1046818728.db2.gz QGZXORDHODCVAM-UHFFFAOYSA-N -1 1 306.095 4.426 20 0 DIADMM C[C@@H]1c2ccccc2OCCN1Cc1cccc([O-])c1Cl ZINC000646064432 1046851157 /nfs/dbraw/zinc/85/11/57/1046851157.db2.gz HMZWHSIWSLYTSP-GFCCVEGCSA-N -1 1 303.789 4.001 20 0 DIADMM CSc1c(F)cccc1C(=O)Nc1ccc([O-])c(Cl)c1 ZINC000797946855 1046910627 /nfs/dbraw/zinc/91/06/27/1046910627.db2.gz GQBWQIKUEIWBTN-UHFFFAOYSA-N -1 1 311.765 4.159 20 0 DIADMM CCN(Cc1cccnc1)Cc1cc(Cl)c([O-])c(Cl)c1 ZINC001140834657 1046923202 /nfs/dbraw/zinc/92/32/02/1046923202.db2.gz UEPJKTCOYATOGE-UHFFFAOYSA-N -1 1 311.212 4.116 20 0 DIADMM O=C(CC1CCC(C(F)(F)F)CC1)Nc1c([O-])cccc1F ZINC000680001800 1046927076 /nfs/dbraw/zinc/92/70/76/1046927076.db2.gz WJTHHTFTAKULMH-UHFFFAOYSA-N -1 1 319.298 4.229 20 0 DIADMM COc1ccccc1[C@H]1CCCN1Cc1ccc([O-])c(F)c1F ZINC001140894449 1046946203 /nfs/dbraw/zinc/94/62/03/1046946203.db2.gz YTTMNWOREMABOM-CQSZACIVSA-N -1 1 319.351 4.016 20 0 DIADMM Cc1ccccc1[C@H]1C[C@H](NC(=O)c2c([O-])cccc2Cl)C1 ZINC000799036178 1046997099 /nfs/dbraw/zinc/99/70/99/1046997099.db2.gz CLSPDTWDIWTXEP-JOCQHMNTSA-N -1 1 315.800 4.030 20 0 DIADMM Cc1cccc(O[C@H](C)c2nc(-c3ccc([O-])c(F)c3)no2)c1 ZINC000445477081 1047042742 /nfs/dbraw/zinc/04/27/42/1047042742.db2.gz AQYMOWXHAPJCRP-LLVKDONJSA-N -1 1 314.316 4.030 20 0 DIADMM CC[C@H](NC(=O)c1ccc([O-])c(F)c1)c1ccc(Cl)cc1 ZINC000681015593 1047082748 /nfs/dbraw/zinc/08/27/48/1047082748.db2.gz HGXBXZGMTGTHLQ-AWEZNQCLSA-N -1 1 307.752 4.066 20 0 DIADMM O=C(N[C@@H](c1ccc(Cl)cc1)C1CC1)c1ccc([O-])c(F)c1 ZINC000681016436 1047082789 /nfs/dbraw/zinc/08/27/89/1047082789.db2.gz WSZDQCPYQTWZKO-MRXNPFEDSA-N -1 1 319.763 4.066 20 0 DIADMM O=C(Nc1ccc(OC2CCCC2)cc1)c1ccc([O-])c(F)c1 ZINC000681016952 1047082933 /nfs/dbraw/zinc/08/29/33/1047082933.db2.gz QIJAJTPBQVZCRZ-UHFFFAOYSA-N -1 1 315.344 4.105 20 0 DIADMM CN(C(=O)c1ccc([O-])c(F)c1)C1CCC(C(C)(C)C)CC1 ZINC000681017859 1047083262 /nfs/dbraw/zinc/08/32/62/1047083262.db2.gz DXWBJEQONUQSLV-UHFFFAOYSA-N -1 1 307.409 4.208 20 0 DIADMM O=C(c1ccc([O-])c(F)c1)N1CCC[C@H]1CC1CCCCC1 ZINC000681036962 1047084404 /nfs/dbraw/zinc/08/44/04/1047084404.db2.gz JWDHVQMBXKMBOW-HNNXBMFYSA-N -1 1 305.393 4.106 20 0 DIADMM CC[C@@H](NC(=O)c1ccc([O-])c(F)c1)C(C)(C)c1ccccc1 ZINC000681050145 1047087411 /nfs/dbraw/zinc/08/74/11/1047087411.db2.gz WMZCPMHKXWQHCE-QGZVFWFLSA-N -1 1 315.388 4.018 20 0 DIADMM Cc1ccc(C)c([C@@H]2CCCN2C(=O)c2ccc([O-])c(F)c2)c1 ZINC000681056263 1047089034 /nfs/dbraw/zinc/08/90/34/1047089034.db2.gz MRGKDAVAJMBLDV-KRWDZBQOSA-N -1 1 313.372 4.125 20 0 DIADMM O=C(c1ccc([O-])c(F)c1)N1CCC[C@@H]1CCC1CCCC1 ZINC000681057732 1047089339 /nfs/dbraw/zinc/08/93/39/1047089339.db2.gz VCYJCBCXXRETMZ-OAHLLOKOSA-N -1 1 305.393 4.106 20 0 DIADMM Cc1ccc(C)c2sc(NC(=O)c3ccc([O-])cc3F)nc21 ZINC000681519460 1047129455 /nfs/dbraw/zinc/12/94/55/1047129455.db2.gz UPGYNOYVNSLGNK-UHFFFAOYSA-N -1 1 316.357 4.010 20 0 DIADMM [O-]c1ccc(-c2noc(/C=C\c3ccc(Cl)s3)n2)cc1F ZINC000445467882 1047156444 /nfs/dbraw/zinc/15/64/44/1047156444.db2.gz BPHWJMOVRSYKRX-UTCJRWHESA-N -1 1 322.748 4.467 20 0 DIADMM CC[C@@H](C(=O)[N-]OC[C@@H](C)CC)c1cccc(C(F)(F)F)c1 ZINC001141518570 1047158551 /nfs/dbraw/zinc/15/85/51/1047158551.db2.gz OLAHFWPKPMPJSP-SMDDNHRTSA-N -1 1 317.351 4.293 20 0 DIADMM CC[C@@H](C)CCCCC(=O)Nc1ccc(-c2cc(=O)[nH][n-]2)cc1 ZINC001141538700 1047171778 /nfs/dbraw/zinc/17/17/78/1047171778.db2.gz UIDCTSGTPLVAPP-CYBMUJFWSA-N -1 1 315.417 4.327 20 0 DIADMM CC(C)C[C@@H]1CCCN(C(=O)c2ccc3ccccc3c2[O-])C1 ZINC001137488004 1047183130 /nfs/dbraw/zinc/18/31/30/1047183130.db2.gz VACZELKXKCOAKP-HNNXBMFYSA-N -1 1 311.425 4.444 20 0 DIADMM C[C@@H]1CCN(C(=O)c2cc(Cl)ccc2[O-])[C@@H]2CCCC[C@H]12 ZINC001141567133 1047195097 /nfs/dbraw/zinc/19/50/97/1047195097.db2.gz GNRKBSFAHHSYRY-UXIGCNINSA-N -1 1 307.821 4.086 20 0 DIADMM CCCc1cc(C(=O)Nc2c([O-])cccc2F)ccc1Cl ZINC000682683829 1047212405 /nfs/dbraw/zinc/21/24/05/1047212405.db2.gz MGTJPGWWDPGBAD-UHFFFAOYSA-N -1 1 307.752 4.390 20 0 DIADMM CCCCN(CCCC)C(=O)c1c([O-])cnc2c(F)cccc21 ZINC001141679315 1047263177 /nfs/dbraw/zinc/26/31/77/1047263177.db2.gz VCUVTECLPZBQAI-UHFFFAOYSA-N -1 1 318.392 4.122 20 0 DIADMM CCc1cccc(S(=O)(=O)[N-]c2cccc(SC)c2C)c1 ZINC000536990341 1047460526 /nfs/dbraw/zinc/46/05/26/1047460526.db2.gz WNWQSVLKCXACNP-UHFFFAOYSA-N -1 1 321.467 4.080 20 0 DIADMM O=C(Nc1cc(F)cc(F)c1[O-])[C@@H]1CCC[C@H]1c1ccccc1 ZINC001142541759 1047466568 /nfs/dbraw/zinc/46/65/68/1047466568.db2.gz GNYDXJDVMKPHHM-UONOGXRCSA-N -1 1 317.335 4.193 20 0 DIADMM CC(C)Sc1ccc(C(=O)Nc2cc(F)cc(F)c2[O-])cc1 ZINC001142541594 1047466994 /nfs/dbraw/zinc/46/69/94/1047466994.db2.gz CUSKATQNZMGQDK-UHFFFAOYSA-N -1 1 323.364 4.423 20 0 DIADMM CC(C)(C)[C@H]1CCCC[C@@H]1CNC(=O)c1cccc([O-])c1F ZINC001142870733 1047506722 /nfs/dbraw/zinc/50/67/22/1047506722.db2.gz QIENZGGXOZENEB-OCCSQVGLSA-N -1 1 307.409 4.114 20 0 DIADMM Cc1cccc([C@@H](c2noc(-c3ccc(N)cc3[O-])n2)C(C)C)c1 ZINC000843234113 1047535102 /nfs/dbraw/zinc/53/51/02/1047535102.db2.gz LOHWQVAYTWNKAH-KRWDZBQOSA-N -1 1 323.396 4.121 20 0 DIADMM Cc1cc(C)c(NC(=O)c2cc3cccc(O)c3cc2[O-])cc1C ZINC001149651682 1047566770 /nfs/dbraw/zinc/56/67/70/1047566770.db2.gz RESOXKIBYSKYKS-UHFFFAOYSA-N -1 1 321.376 4.429 20 0 DIADMM CCC(CC)(CC)CNC(=O)c1ccc2ccc(O)cc2c1[O-] ZINC001150610449 1047579689 /nfs/dbraw/zinc/57/96/89/1047579689.db2.gz RMLWNZMHDONPKB-UHFFFAOYSA-N -1 1 315.413 4.197 20 0 DIADMM CSc1ccc([O-])c(C(=O)Nc2cc(F)cc(Cl)c2)c1 ZINC001150727016 1047582320 /nfs/dbraw/zinc/58/23/20/1047582320.db2.gz BEIDGDNHHBDNKI-UHFFFAOYSA-N -1 1 311.765 4.159 20 0 DIADMM Cc1cc(C(F)F)oc1C(=O)Nc1ccc([O-])c(Cl)c1 ZINC001151583401 1047598405 /nfs/dbraw/zinc/59/84/05/1047598405.db2.gz ZKVUOQVMESUQCI-UHFFFAOYSA-N -1 1 301.676 4.137 20 0 DIADMM C[C@@H]1CC[C@](C)(/C=C\C(=O)Nc2cccc(F)c2[O-])C1(C)C ZINC001151779720 1047601564 /nfs/dbraw/zinc/60/15/64/1047601564.db2.gz KWTCMXRVMVUEAX-GOCTYOJASA-N -1 1 305.393 4.488 20 0 DIADMM O=C(Cc1c(Cl)cccc1Cl)Nc1cccc(F)c1[O-] ZINC001151771836 1047601607 /nfs/dbraw/zinc/60/16/07/1047601607.db2.gz MZJRAOIBNHBFDY-UHFFFAOYSA-N -1 1 314.143 4.019 20 0 DIADMM O=C(Nc1ccc2occc2c1)c1ccc(C(F)(F)F)c([O-])c1 ZINC001151771309 1047601883 /nfs/dbraw/zinc/60/18/83/1047601883.db2.gz GOYUHKPEDYHYAV-UHFFFAOYSA-N -1 1 321.254 4.410 20 0 DIADMM Cc1cc(Br)c([O-])c(NC(=O)/C=C/C2CCCC2)c1 ZINC001152517001 1047612655 /nfs/dbraw/zinc/61/26/55/1047612655.db2.gz FDVOSRMGRBADTL-VOTSOKGWSA-N -1 1 324.218 4.148 20 0 DIADMM Cc1cc(O)cc(C)c1NC(=O)c1c([O-])ccc2ccccc21 ZINC001153503818 1047626837 /nfs/dbraw/zinc/62/68/37/1047626837.db2.gz HAWRGVWSDXQKCK-UHFFFAOYSA-N -1 1 307.349 4.120 20 0 DIADMM Cc1cc(F)cc(S(=O)(=O)[N-]c2c(C)cccc2C(C)C)c1 ZINC000538009110 1047652814 /nfs/dbraw/zinc/65/28/14/1047652814.db2.gz UWCSRJWRBMFELS-UHFFFAOYSA-N -1 1 321.417 4.367 20 0 DIADMM Cc1nc(SCc2csc(C3CCCC3)n2)[n-]c(=O)c1C ZINC000538516922 1047684997 /nfs/dbraw/zinc/68/49/97/1047684997.db2.gz XIBRWVXULALWGL-UHFFFAOYSA-N -1 1 321.471 4.205 20 0 DIADMM Cc1ccc(-c2cccc(NC(=O)c3ccc([O-])c(F)c3)n2)cc1 ZINC001156533100 1047716186 /nfs/dbraw/zinc/71/61/86/1047716186.db2.gz KIIONAIXIFIXQB-UHFFFAOYSA-N -1 1 322.339 4.154 20 0 DIADMM Cc1ccc(Cl)c2sc(NC(=O)c3ccccc3[O-])nc21 ZINC001157257733 1047738622 /nfs/dbraw/zinc/73/86/22/1047738622.db2.gz AGSWWTDVIQHLFQ-UHFFFAOYSA-N -1 1 318.785 4.216 20 0 DIADMM O=C(c1ccc([O-])cc1F)N1CCC(CC2CCCCC2)CC1 ZINC001157507442 1047745373 /nfs/dbraw/zinc/74/53/73/1047745373.db2.gz WVXMQIOBFMLHRI-UHFFFAOYSA-N -1 1 319.420 4.354 20 0 DIADMM O=C(Nc1cc(F)c([O-])cc1Cl)C1[C@@H]2CCCCCC[C@@H]12 ZINC001157900118 1047763508 /nfs/dbraw/zinc/76/35/08/1047763508.db2.gz RAYOTXFHIMDHER-NXEZZACHSA-N -1 1 311.784 4.340 20 0 DIADMM CCc1ccc([C@@H](C)C(=O)Nc2cc(F)c([O-])cc2Cl)cc1 ZINC001157899668 1047763557 /nfs/dbraw/zinc/76/35/57/1047763557.db2.gz LZSVXQZXUVODGU-SNVBAGLBSA-N -1 1 321.779 4.489 20 0 DIADMM CCCCOc1ccc(C(=O)Nc2cc(C)cc(F)c2)c([O-])c1 ZINC001182951761 1047864513 /nfs/dbraw/zinc/86/45/13/1047864513.db2.gz MVYXIJSVUIEIFF-UHFFFAOYSA-N -1 1 317.360 4.271 20 0 DIADMM COc1cc(Nc2cc(Cl)c(C)c(Cl)c2[O-])ccc1O ZINC001174542650 1047868682 /nfs/dbraw/zinc/86/86/82/1047868682.db2.gz AOBSJIDPEAHQCN-UHFFFAOYSA-N -1 1 314.168 4.465 20 0 DIADMM Cc1cc(O)ccc1Nc1ccc(F)c(Br)c1[O-] ZINC001174563832 1047905841 /nfs/dbraw/zinc/90/58/41/1047905841.db2.gz HZCDNJAVMMJKOD-UHFFFAOYSA-N -1 1 312.138 4.051 20 0 DIADMM CC(C)C(=O)Nc1ccc(Nc2cc([O-])c(F)c(F)c2)cc1 ZINC001198081296 1047921526 /nfs/dbraw/zinc/92/15/26/1047921526.db2.gz AVMJWJGIISKGKO-UHFFFAOYSA-N -1 1 306.312 4.009 20 0 DIADMM O=S(=O)([N-]c1ccc2sccc2c1)c1ccc(Cl)cc1 ZINC001251738961 1047928504 /nfs/dbraw/zinc/92/85/04/1047928504.db2.gz ZYSATQIKMVJRMI-UHFFFAOYSA-N -1 1 323.826 4.356 20 0 DIADMM CCCCN(C(=O)c1ccc(F)c([O-])c1)[C@@H]1CCC[C@H](C)C1 ZINC001159892572 1047942021 /nfs/dbraw/zinc/94/20/21/1047942021.db2.gz QYFPFOIMNPHORR-DZGCQCFKSA-N -1 1 307.409 4.352 20 0 DIADMM O=C([O-])c1cc(Nc2ccc3nc[nH]c3c2)cc(C(F)(F)F)c1 ZINC001160223605 1048003110 /nfs/dbraw/zinc/00/31/10/1048003110.db2.gz KZQRRBNJJPLALX-UHFFFAOYSA-N -1 1 321.258 4.024 20 0 DIADMM O=C(Nc1cccc(C(F)(F)F)c1[O-])c1ccc2c(c1)CCC2 ZINC001198774615 1048007004 /nfs/dbraw/zinc/00/70/04/1048007004.db2.gz BDXBDYZLZRAWLD-UHFFFAOYSA-N -1 1 321.298 4.152 20 0 DIADMM Cc1cc([N-]S(=O)(=O)c2ccc3occc3c2)ccc1Cl ZINC001198861407 1048014471 /nfs/dbraw/zinc/01/44/71/1048014471.db2.gz KCBYNSYDEWKRNN-UHFFFAOYSA-N -1 1 321.785 4.195 20 0 DIADMM Cc1c(Cl)cccc1NC(=O)Nc1ccc([O-])c(F)c1F ZINC001184679921 1048080993 /nfs/dbraw/zinc/08/09/93/1048080993.db2.gz LCVYFVJVXZORCW-UHFFFAOYSA-N -1 1 312.703 4.276 20 0 DIADMM O=C(Nc1cc([O-])c(F)cc1F)c1cc2ccc(F)cc2s1 ZINC001160916880 1048097602 /nfs/dbraw/zinc/09/76/02/1048097602.db2.gz OKHNUZIFALRIIC-UHFFFAOYSA-N -1 1 323.295 4.277 20 0 DIADMM O=C(Cc1ccc(-c2ccccc2)cc1)Nc1ccc(F)cc1[O-] ZINC001161035331 1048104767 /nfs/dbraw/zinc/10/47/67/1048104767.db2.gz PSYGJDRZONZQHO-UHFFFAOYSA-N -1 1 321.351 4.380 20 0 DIADMM COc1ccc(Nc2c([O-])cc(F)cc2F)cc1C(F)(F)F ZINC001175070782 1048125815 /nfs/dbraw/zinc/12/58/15/1048125815.db2.gz IAHJUDAAQYEPFT-UHFFFAOYSA-N -1 1 319.229 4.441 20 0 DIADMM CCCCCC[C@H](C)[N-]S(=O)(=O)c1sccc1Cl ZINC001185102532 1048129488 /nfs/dbraw/zinc/12/94/88/1048129488.db2.gz MYFWPPOZAFAJMB-JTQLQIEISA-N -1 1 309.884 4.039 20 0 DIADMM CCOc1ccc(Nc2cc([O-])c(F)c(F)c2)c(F)c1F ZINC001175152860 1048145410 /nfs/dbraw/zinc/14/54/10/1048145410.db2.gz YJNNVHHSIOCOMA-UHFFFAOYSA-N -1 1 301.239 4.091 20 0 DIADMM C[C@H](C(=O)[N-]OC1CCCC1)c1ccc(Cl)c(Cl)c1 ZINC000774865013 1048168833 /nfs/dbraw/zinc/16/88/33/1048168833.db2.gz FMUJTNLBLUAZKU-VIFPVBQESA-N -1 1 302.201 4.087 20 0 DIADMM [O-]c1cccnc1CN(Cc1c(Cl)cccc1Cl)C1CC1 ZINC000554848987 1048205970 /nfs/dbraw/zinc/20/59/70/1048205970.db2.gz NLMYPVSKEKNUSG-UHFFFAOYSA-N -1 1 323.223 4.259 20 0 DIADMM Cc1cc(C)cc(NC(=S)Nc2cc(F)cc(F)c2[O-])c1 ZINC001201207645 1048218151 /nfs/dbraw/zinc/21/81/51/1048218151.db2.gz RDMDZHDHDQZZQC-UHFFFAOYSA-N -1 1 308.353 4.096 20 0 DIADMM CCOc1ccc(F)c(F)c1Nc1c([O-])cc(F)cc1F ZINC001175278422 1048226677 /nfs/dbraw/zinc/22/66/77/1048226677.db2.gz RPFOAZZDNAZGDG-UHFFFAOYSA-N -1 1 301.239 4.091 20 0 DIADMM [O-]c1c(Cl)cc(Br)cc1NC1=CCSCC1 ZINC001201347396 1048246613 /nfs/dbraw/zinc/24/66/13/1048246613.db2.gz RUXOZGJXWPUJSD-UHFFFAOYSA-N -1 1 320.639 4.241 20 0 DIADMM [O-]c1ccc(F)c(Nc2ccnc(Br)c2)c1Cl ZINC001250228090 1048260310 /nfs/dbraw/zinc/26/03/10/1048260310.db2.gz KQSFEZHQTLQSJI-UHFFFAOYSA-N -1 1 317.545 4.086 20 0 DIADMM Nc1ccc(-c2ccc(NC(=O)c3ccc([O-])c(F)c3)cc2)cc1 ZINC001186226904 1048273183 /nfs/dbraw/zinc/27/31/83/1048273183.db2.gz STWUJGQCRVBEKE-UHFFFAOYSA-N -1 1 322.339 4.033 20 0 DIADMM C[S@](=O)c1ccc(Nc2c(Cl)ccc([O-])c2Cl)cc1 ZINC001175480847 1048319753 /nfs/dbraw/zinc/31/97/53/1048319753.db2.gz BVXMXOYGHOEYQG-IBGZPJMESA-N -1 1 316.209 4.180 20 0 DIADMM O=C(Nc1ccc(Cl)cc1[O-])NC12CC3CC(CC(C3)C1)C2 ZINC001186678201 1048336223 /nfs/dbraw/zinc/33/62/23/1048336223.db2.gz XBLLNRSMGOMEGM-UHFFFAOYSA-N -1 1 320.820 4.136 20 0 DIADMM CSc1ccccc1NC(=O)Nc1cc(F)c([O-])c(F)c1 ZINC001186745878 1048337958 /nfs/dbraw/zinc/33/79/58/1048337958.db2.gz KQORSYAVWRCPBY-UHFFFAOYSA-N -1 1 310.325 4.036 20 0 DIADMM Cn1cc2c(cccc2Nc2ccc(Cl)c(Cl)c2[O-])n1 ZINC001175592009 1048363101 /nfs/dbraw/zinc/36/31/01/1048363101.db2.gz OHYRCRXJYXNRAH-UHFFFAOYSA-N -1 1 308.168 4.329 20 0 DIADMM Cn1cc2ccc(Nc3c(Cl)ccc([O-])c3Cl)cc2n1 ZINC001175615479 1048397150 /nfs/dbraw/zinc/39/71/50/1048397150.db2.gz ZGNHGHQZRLYNKU-UHFFFAOYSA-N -1 1 308.168 4.329 20 0 DIADMM O=C(Nc1ccc(F)cc1F)Nc1cc([O-])c(Cl)cc1F ZINC001202020196 1048419094 /nfs/dbraw/zinc/41/90/94/1048419094.db2.gz KJUVIWNKRRYIGP-UHFFFAOYSA-N -1 1 316.666 4.107 20 0 DIADMM O=C(Nc1ccc(F)c(Cl)c1)Nc1ccc(Cl)cc1[O-] ZINC001187699574 1048429248 /nfs/dbraw/zinc/42/92/48/1048429248.db2.gz FJMFGOLXVVYNHU-UHFFFAOYSA-N -1 1 315.131 4.482 20 0 DIADMM [O-]c1cc(Nc2ccnc(Br)c2)c(F)cc1Cl ZINC001175746234 1048433547 /nfs/dbraw/zinc/43/35/47/1048433547.db2.gz DRMRWGMBOXPTOG-UHFFFAOYSA-N -1 1 317.545 4.086 20 0 DIADMM [O-]c1cc(Nc2cnn(-c3ccccc3)c2)c(F)cc1Cl ZINC001175795447 1048457229 /nfs/dbraw/zinc/45/72/29/1048457229.db2.gz ZAQJQIKUBUXYQC-UHFFFAOYSA-N -1 1 303.724 4.114 20 0 DIADMM CCCn1nc(C)cc1Nc1cc(Cl)cc(Cl)c1[O-] ZINC001175803857 1048464207 /nfs/dbraw/zinc/46/42/07/1048464207.db2.gz NJFWJLGQUZZTKK-UHFFFAOYSA-N -1 1 300.189 4.358 20 0 DIADMM CSc1ccc(NC(=O)Nc2ccc([O-])c(F)c2F)cc1 ZINC001188107617 1048475948 /nfs/dbraw/zinc/47/59/48/1048475948.db2.gz MPFORPHJSABNKT-UHFFFAOYSA-N -1 1 310.325 4.036 20 0 DIADMM CSc1ccc(NC(=O)Nc2cc(F)c([O-])cc2F)cc1 ZINC001188110504 1048478168 /nfs/dbraw/zinc/47/81/68/1048478168.db2.gz LRPMDLVPNQUKPV-UHFFFAOYSA-N -1 1 310.325 4.036 20 0 DIADMM CCCOc1cccc(CSc2nc(CCC)cc(=O)[n-]2)c1 ZINC001188163058 1048482718 /nfs/dbraw/zinc/48/27/18/1048482718.db2.gz NSULSGSSZLAUHS-UHFFFAOYSA-N -1 1 318.442 4.216 20 0 DIADMM O=C(Nc1cccc(C(F)(F)F)c1)Nc1c([O-])cccc1F ZINC001202297145 1048513916 /nfs/dbraw/zinc/51/39/16/1048513916.db2.gz VIBYRWBZDFMFSM-UHFFFAOYSA-N -1 1 314.238 4.194 20 0 DIADMM CC1(C)CC(=Nc2ccc(S(=O)(=O)[O-])cc2)CC(C)(C)C1 ZINC001175947173 1048523375 /nfs/dbraw/zinc/52/33/75/1048523375.db2.gz JSONRVMISKNGRK-UHFFFAOYSA-N -1 1 309.431 4.075 20 0 DIADMM O=C(Nc1ccc2ccccc2c1)Nc1cc(F)cc(F)c1[O-] ZINC001188615404 1048529201 /nfs/dbraw/zinc/52/92/01/1048529201.db2.gz KCXMLWMPKHNISG-UHFFFAOYSA-N -1 1 314.291 4.468 20 0 DIADMM CC(C)[C@@H]1N(c2cc(Cl)[n-]c(=O)n2)CC12CCCCCC2 ZINC001163935753 1048552754 /nfs/dbraw/zinc/55/27/54/1048552754.db2.gz GVBLRCQROWCGGF-AWEZNQCLSA-N -1 1 309.841 4.021 20 0 DIADMM O=C(Nc1ccc(F)cc1[O-])Nc1cccc(Cl)c1Cl ZINC001189220908 1048603494 /nfs/dbraw/zinc/60/34/94/1048603494.db2.gz IJXGXMQMMNNKFN-UHFFFAOYSA-N -1 1 315.131 4.482 20 0 DIADMM O=C(Nc1cccc(F)c1[O-])Nc1cccc(Cl)c1Cl ZINC001189226671 1048604827 /nfs/dbraw/zinc/60/48/27/1048604827.db2.gz NBWMTUFEWMQFHB-UHFFFAOYSA-N -1 1 315.131 4.482 20 0 DIADMM CC(C)(C)SCCCSc1nc(C(F)F)cc(=O)[n-]1 ZINC001189476448 1048628559 /nfs/dbraw/zinc/62/85/59/1048628559.db2.gz LSQYDPGSDWYWDQ-UHFFFAOYSA-N -1 1 308.419 4.134 20 0 DIADMM Cc1ccc(SCc2cc(=O)oc3cc([O-])ccc23)s1 ZINC001189546000 1048635482 /nfs/dbraw/zinc/63/54/82/1048635482.db2.gz JBJGFLMRBIDFLJ-UHFFFAOYSA-N -1 1 304.392 4.161 20 0 DIADMM O=c1cc(Nc2c(F)cc(F)c(F)c2F)n(C2CCCC2)[n-]1 ZINC001176345484 1048636255 /nfs/dbraw/zinc/63/62/55/1048636255.db2.gz BJDCXHDVBPINFP-UHFFFAOYSA-N -1 1 315.270 4.004 20 0 DIADMM CC(C)(C)c1ccccc1NC(=O)Nc1cccc(F)c1[O-] ZINC001189591259 1048640003 /nfs/dbraw/zinc/64/00/03/1048640003.db2.gz ORHOVCZFYRORHL-UHFFFAOYSA-N -1 1 302.349 4.473 20 0 DIADMM CCCc1cc(=O)[n-]c(SCc2ccc(C(C)C)nc2C)n1 ZINC001164552455 1048641096 /nfs/dbraw/zinc/64/10/96/1048641096.db2.gz XROMXEGTVDOLLP-UHFFFAOYSA-N -1 1 317.458 4.254 20 0 DIADMM CC(=O)c1ccc([N-]c2nnc(C(C)(C)C)s2)c(F)c1F ZINC001214976784 1048655970 /nfs/dbraw/zinc/65/59/70/1048655970.db2.gz JQVAFLPVEUDSOG-UHFFFAOYSA-N -1 1 311.357 4.060 20 0 DIADMM Cc1cc(Br)c([O-])c(NC(=O)[C@@H](C)C(C)(C)C)c1 ZINC000482673129 1048658261 /nfs/dbraw/zinc/65/82/61/1048658261.db2.gz MSOCIQOAYDVOAU-SECBINFHSA-N -1 1 314.223 4.084 20 0 DIADMM CCc1cccc(CC)c1NC(=O)Nc1ccc([O-])c(F)c1F ZINC001189769704 1048663721 /nfs/dbraw/zinc/66/37/21/1048663721.db2.gz QXKVRLOSDNZSRW-UHFFFAOYSA-N -1 1 320.339 4.439 20 0 DIADMM O=C(c1ccc(Cl)cc1[O-])N1CCC(C2CCCCC2)CC1 ZINC001165428166 1048688429 /nfs/dbraw/zinc/68/84/29/1048688429.db2.gz YIMLSYODYKICEQ-UHFFFAOYSA-N -1 1 321.848 4.478 20 0 DIADMM Cc1ccc(SCc2cc(=O)oc3cc([O-])ccc23)cc1C ZINC000007536292 1048702998 /nfs/dbraw/zinc/70/29/98/1048702998.db2.gz SAUSDSZDMVEJRW-UHFFFAOYSA-N -1 1 312.390 4.408 20 0 DIADMM O=c1cc(-c2ccccc2)nc(SC/C(Cl)=C/Cl)[n-]1 ZINC001190201364 1048708060 /nfs/dbraw/zinc/70/80/60/1048708060.db2.gz OPCCORLKBVRXLC-YFHOEESVSA-N -1 1 313.209 4.260 20 0 DIADMM O=S(=O)([N-]c1cccc(Cl)c1)c1ccc(C2CC2)cc1 ZINC001190463645 1048740981 /nfs/dbraw/zinc/74/09/81/1048740981.db2.gz IRICTRCUHZYDAW-UHFFFAOYSA-N -1 1 307.802 4.018 20 0 DIADMM Cc1ccnc2cc(Nc3c(F)cc(F)c([O-])c3F)ccc12 ZINC001176671308 1048754404 /nfs/dbraw/zinc/75/44/04/1048754404.db2.gz WYQJOZBVXGCUJJ-UHFFFAOYSA-N -1 1 304.271 4.410 20 0 DIADMM [O-]c1c(F)cc(F)c(Nc2cc(O)c(Cl)cc2F)c1F ZINC001176672118 1048755547 /nfs/dbraw/zinc/75/55/47/1048755547.db2.gz UGAOBJMXIJBKFI-UHFFFAOYSA-N -1 1 307.630 4.051 20 0 DIADMM [O-]c1c(F)cc(F)c(Nc2ccccc2-n2cccc2)c1F ZINC001176672350 1048755589 /nfs/dbraw/zinc/75/55/89/1048755589.db2.gz HDUXCFBNTOFUAG-UHFFFAOYSA-N -1 1 304.271 4.344 20 0 DIADMM CC(C)OCc1cccc(Nc2c(F)cc(F)c([O-])c2F)c1 ZINC001176671255 1048755618 /nfs/dbraw/zinc/75/56/18/1048755618.db2.gz VRSBOKKWQDWQJZ-UHFFFAOYSA-N -1 1 311.303 4.478 20 0 DIADMM Cc1nccn1-c1ccc(Nc2c(F)cc(F)c([O-])c2F)cc1 ZINC001176672471 1048756100 /nfs/dbraw/zinc/75/61/00/1048756100.db2.gz XBYIRIHJXSGBMV-UHFFFAOYSA-N -1 1 319.286 4.047 20 0 DIADMM [O-]c1c(F)cc(F)c(Nc2ccc(-c3ncco3)cc2)c1F ZINC001176673789 1048757384 /nfs/dbraw/zinc/75/73/84/1048757384.db2.gz LULQPWVJNFVDLQ-UHFFFAOYSA-N -1 1 306.243 4.208 20 0 DIADMM Cc1ccc(Nc2c(F)cc(F)c([O-])c2F)c(Cl)c1O ZINC001176672859 1048758405 /nfs/dbraw/zinc/75/84/05/1048758405.db2.gz MCZSFKWICSKHBZ-UHFFFAOYSA-N -1 1 303.667 4.221 20 0 DIADMM COc1cnc2c(cccc2Nc2c(F)cc(F)c([O-])c2F)c1 ZINC001176673842 1048758540 /nfs/dbraw/zinc/75/85/40/1048758540.db2.gz OKWVBYNLJYZVSA-UHFFFAOYSA-N -1 1 320.270 4.110 20 0 DIADMM CSc1ccc(C)c(C(=O)Nc2ccc([O-])c(Cl)c2)c1 ZINC000111667647 1048928116 /nfs/dbraw/zinc/92/81/16/1048928116.db2.gz HZBBJMGBOVVUNT-UHFFFAOYSA-N -1 1 307.802 4.328 20 0 DIADMM Nc1nonc1[N-]c1ccc(-c2ccc(C(F)(F)F)cc2)cc1 ZINC001203593387 1048937132 /nfs/dbraw/zinc/93/71/32/1048937132.db2.gz ZKQUEWJYVVSPNM-UHFFFAOYSA-N -1 1 320.274 4.081 20 0 DIADMM CC(C)[C@@H](Cc1ccccc1)NC(=O)c1ccc(Cl)cc1[O-] ZINC001177912391 1048960596 /nfs/dbraw/zinc/96/05/96/1048960596.db2.gz JPUFNZBLISTLLA-MRXNPFEDSA-N -1 1 317.816 4.043 20 0 DIADMM CSCCCCCCC(=O)Nc1cc(F)c([O-])cc1Cl ZINC000885680468 1048973829 /nfs/dbraw/zinc/97/38/29/1048973829.db2.gz QYLZMXVRJNEPIN-UHFFFAOYSA-N -1 1 319.829 4.437 20 0 DIADMM Cc1cc(NC(=O)Nc2cc(F)c([O-])cc2F)ccc1Cl ZINC001191770869 1048987711 /nfs/dbraw/zinc/98/77/11/1048987711.db2.gz AQQFRTJNABCZRP-UHFFFAOYSA-N -1 1 312.703 4.276 20 0 DIADMM Cc1cc(NC(=O)Nc2cc(F)c([O-])c(F)c2)ccc1Cl ZINC001191767825 1048987832 /nfs/dbraw/zinc/98/78/32/1048987832.db2.gz DPWBNNFALJBOEA-UHFFFAOYSA-N -1 1 312.703 4.276 20 0 DIADMM CCCCc1ccc([C@H](N[C@@H](C)C(=O)[O-])c2cccs2)cc1 ZINC000904203192 1049001896 /nfs/dbraw/zinc/00/18/96/1049001896.db2.gz GFRLRDGFMRIROL-GUYCJALGSA-N -1 1 317.454 4.243 20 0 DIADMM Cc1cc(-c2noc(Cc3ccc([O-])c(Cl)c3)n2)ccc1F ZINC000904400973 1049060022 /nfs/dbraw/zinc/06/00/22/1049060022.db2.gz NQLBCDIUCKUUDL-UHFFFAOYSA-N -1 1 318.735 4.134 20 0 DIADMM O=C(Nc1ccc2sccc2c1)Nc1cc(Cl)ncc1[O-] ZINC001192427285 1049095275 /nfs/dbraw/zinc/09/52/75/1049095275.db2.gz WWYOUTFZHRPLHO-UHFFFAOYSA-N -1 1 319.773 4.299 20 0 DIADMM [O-]c1ccc(Cc2nc(-c3ccccc3Cl)no2)cc1Cl ZINC000904567688 1049097868 /nfs/dbraw/zinc/09/78/68/1049097868.db2.gz UHQGLLGYENCNNI-UHFFFAOYSA-N -1 1 321.163 4.340 20 0 DIADMM O=C(Nc1ccc2cc(F)ccc2c1)c1c(F)ccc([O-])c1F ZINC001192540404 1049118293 /nfs/dbraw/zinc/11/82/93/1049118293.db2.gz MESIQVUWSUDAQL-UHFFFAOYSA-N -1 1 317.266 4.215 20 0 DIADMM O=C(Nc1cc(Cl)cc2[nH]ccc21)c1cc([O-])cc(F)c1F ZINC001192669983 1049127447 /nfs/dbraw/zinc/12/74/47/1049127447.db2.gz BFGDIXQILSQRJG-UHFFFAOYSA-N -1 1 322.698 4.057 20 0 DIADMM CC(C)(C)c1cccc(NC(=O)c2cc([O-])cc(F)c2F)c1 ZINC001192665199 1049132177 /nfs/dbraw/zinc/13/21/77/1049132177.db2.gz JWWYFFXNKPKNER-UHFFFAOYSA-N -1 1 305.324 4.220 20 0 DIADMM C[C@@H](C(=O)Nc1cc(F)c([O-])cc1Cl)c1ccccc1F ZINC001179655989 1049189296 /nfs/dbraw/zinc/18/92/96/1049189296.db2.gz LSDDTSKGICZGLY-MRVPVSSYSA-N -1 1 311.715 4.066 20 0 DIADMM CC1(c2ccccc2)CCC(Nc2cc(Cl)[n-]c(=O)n2)CC1 ZINC000858450296 1049260573 /nfs/dbraw/zinc/26/05/73/1049260573.db2.gz FFOYQMMARPFFMF-UHFFFAOYSA-N -1 1 317.820 4.148 20 0 DIADMM CSCCCCCCc1nc(-c2ccc([O-])c(F)c2)no1 ZINC000858750705 1049291809 /nfs/dbraw/zinc/29/18/09/1049291809.db2.gz LUAKWZRMWBRRSU-UHFFFAOYSA-N -1 1 310.394 4.047 20 0 DIADMM CCCCCCOC(=O)Nc1ccc(Br)cc1[O-] ZINC001194180643 1049336219 /nfs/dbraw/zinc/33/62/19/1049336219.db2.gz IIEXNHZIWWKHHG-UHFFFAOYSA-N -1 1 316.195 4.284 20 0 DIADMM CCOc1ccc(Nc2cc([O-])c(F)c(F)c2F)c(F)c1 ZINC001249964610 1049341106 /nfs/dbraw/zinc/34/11/06/1049341106.db2.gz IEOFHVHSNZOAJH-UHFFFAOYSA-N -1 1 301.239 4.091 20 0 DIADMM Cc1cccc([N-]S(=O)(=O)c2ccccc2-c2ccccc2)c1 ZINC000485789581 1049342799 /nfs/dbraw/zinc/34/27/99/1049342799.db2.gz IENMJFRLEJNHEW-UHFFFAOYSA-N -1 1 323.417 4.463 20 0 DIADMM C[C@@H](c1ccc(F)c(F)c1)N(C)Cc1ccc([O-])c(F)c1F ZINC001180523231 1049371675 /nfs/dbraw/zinc/37/16/75/1049371675.db2.gz QWISGJVFHKUCIC-VIFPVBQESA-N -1 1 313.294 4.142 20 0 DIADMM CCCOc1cccc(NC(=O)Nc2ccc([O-])c(Cl)c2)c1 ZINC000486172759 1049396451 /nfs/dbraw/zinc/39/64/51/1049396451.db2.gz HWUHELYBQNTDHR-UHFFFAOYSA-N -1 1 320.776 4.478 20 0 DIADMM Cc1cc(Cl)cc([N-]S(=O)(=O)c2c(C)cccc2C)c1 ZINC001194638682 1049400981 /nfs/dbraw/zinc/40/09/81/1049400981.db2.gz LKHLBGRXMBBKEZ-UHFFFAOYSA-N -1 1 309.818 4.066 20 0 DIADMM O=C(Nc1c(F)cc([O-])cc1F)Oc1ccc2ccccc2c1 ZINC001194660180 1049408190 /nfs/dbraw/zinc/40/81/90/1049408190.db2.gz AXPAXZNTVYWZOQ-UHFFFAOYSA-N -1 1 315.275 4.435 20 0 DIADMM CCC(CC)COC(=O)Nc1cccc(C(F)(F)F)c1[O-] ZINC001194713121 1049419346 /nfs/dbraw/zinc/41/93/46/1049419346.db2.gz NFOMPXOMCPEOMV-UHFFFAOYSA-N -1 1 305.296 4.396 20 0 DIADMM O=C(Nc1cccc(C(F)(F)F)c1[O-])Oc1ccc(F)cc1 ZINC001195043931 1049466046 /nfs/dbraw/zinc/46/60/46/1049466046.db2.gz MTBAYGCPOSBEFZ-UHFFFAOYSA-N -1 1 315.222 4.161 20 0 DIADMM CC(C)c1cccc(S(=O)(=O)[N-]c2ccccc2C2CC2)c1 ZINC001195111416 1049475555 /nfs/dbraw/zinc/47/55/55/1049475555.db2.gz LPVWPHUNGLVDPN-UHFFFAOYSA-N -1 1 315.438 4.488 20 0 DIADMM CC[C@H](CC(C)C)C(=O)Nc1cccc([O-])c1Br ZINC000908708624 1049499824 /nfs/dbraw/zinc/49/98/24/1049499824.db2.gz YSHFSCUGQVCZON-SNVBAGLBSA-N -1 1 314.223 4.166 20 0 DIADMM CC(C)c1cccc(S(=O)(=O)[N-]c2ccc3occc3c2)c1 ZINC001195160054 1049489079 /nfs/dbraw/zinc/48/90/79/1049489079.db2.gz YYRGOBHFKYMLSQ-UHFFFAOYSA-N -1 1 315.394 4.357 20 0 DIADMM O=C(Nc1scnc1C1CC1)Nc1ccc([O-])c(Cl)c1 ZINC000486939587 1049494994 /nfs/dbraw/zinc/49/49/94/1049494994.db2.gz PNLRFNGOZKYTAZ-UHFFFAOYSA-N -1 1 309.778 4.024 20 0 DIADMM CCOCc1ccc(NC(=O)Nc2ccc([O-])c(Cl)c2)cc1 ZINC000486956074 1049498915 /nfs/dbraw/zinc/49/89/15/1049498915.db2.gz MXYOXLCLPSKCJD-UHFFFAOYSA-N -1 1 320.776 4.226 20 0 DIADMM CCC[C@@](C)(CC)C(=O)Nc1cccc([O-])c1Br ZINC000908706982 1049499357 /nfs/dbraw/zinc/49/93/57/1049499357.db2.gz CFLRBYFRUDDELM-CQSZACIVSA-N -1 1 314.223 4.310 20 0 DIADMM CCC[C@H](C(=O)Nc1cccc([O-])c1Br)C(C)C ZINC000908709717 1049500406 /nfs/dbraw/zinc/50/04/06/1049500406.db2.gz SJQIFGQKWKPPHW-JTQLQIEISA-N -1 1 314.223 4.166 20 0 DIADMM O=C(Nc1cc([O-])c(F)cc1F)c1cc(C2CC2)[nH]c1C1CC1 ZINC000909973331 1049572599 /nfs/dbraw/zinc/57/25/99/1049572599.db2.gz WUSRXWBCHZLROQ-UHFFFAOYSA-N -1 1 318.323 4.006 20 0 DIADMM O=C(CC[C@@H]1CCc2ccccc21)Nc1cc([O-])c(F)cc1F ZINC000909971545 1049572680 /nfs/dbraw/zinc/57/26/80/1049572680.db2.gz FNUQJJKPGOTBEX-LBPRGKRZSA-N -1 1 317.335 4.119 20 0 DIADMM CCc1ccccc1S(=O)(=O)[N-]c1ccccc1C(C)C ZINC000488242169 1049617487 /nfs/dbraw/zinc/61/74/87/1049617487.db2.gz GRVANRNSCXDYCH-UHFFFAOYSA-N -1 1 303.427 4.173 20 0 DIADMM Cc1sc(C)c2c1[n-]c(C[C@]1(C)CC1(Cl)Cl)nc2=O ZINC000864354295 1049651461 /nfs/dbraw/zinc/65/14/61/1049651461.db2.gz DURTZBGZVXKUMS-GFCCVEGCSA-N -1 1 317.241 4.140 20 0 DIADMM O=C(Nc1cc(F)cc(F)c1[O-])c1cc(C2CC2)[nH]c1C1CC1 ZINC000910994956 1049655304 /nfs/dbraw/zinc/65/53/04/1049655304.db2.gz XGMNDPWLYUDBQT-UHFFFAOYSA-N -1 1 318.323 4.006 20 0 DIADMM [O-]c1cc(F)c(F)cc1NC(=S)Nc1ccc(Cl)cc1 ZINC001197335189 1049744803 /nfs/dbraw/zinc/74/48/03/1049744803.db2.gz HRBKLWKYTUVGMK-UHFFFAOYSA-N -1 1 314.744 4.133 20 0 DIADMM CSCCc1ccccc1NCc1ccc([O-])c(F)c1F ZINC001207075138 1049832879 /nfs/dbraw/zinc/83/28/79/1049832879.db2.gz AEDYFLKIPHLMEC-UHFFFAOYSA-N -1 1 309.381 4.188 20 0 DIADMM [O-]c1ccc(CNc2cnc3c(ccc(F)c3F)c2)c(F)c1F ZINC001207448648 1049893289 /nfs/dbraw/zinc/89/32/89/1049893289.db2.gz LPMMUASEEGWRTO-UHFFFAOYSA-N -1 1 322.261 4.109 20 0 DIADMM O=S(=O)([N-]c1cc(Cl)ccc1Oc1ccccc1)C1CC1 ZINC000589428275 1050036283 /nfs/dbraw/zinc/03/62/83/1050036283.db2.gz POVMPDKIBRRWHY-UHFFFAOYSA-N -1 1 323.801 4.036 20 0 DIADMM [O-]c1ccc(Cl)c(Nc2ccc3c(c2)NCCO3)c1Cl ZINC001209799521 1050085813 /nfs/dbraw/zinc/08/58/13/1050085813.db2.gz IWNMRONFPJPAPO-UHFFFAOYSA-N -1 1 311.168 4.247 20 0 DIADMM [O-]c1c(Cl)c(Cl)ccc1Nc1ccc(F)c(CO)c1 ZINC001209881969 1050099703 /nfs/dbraw/zinc/09/97/03/1050099703.db2.gz XRIRPZCRVFTOBZ-UHFFFAOYSA-N -1 1 302.132 4.074 20 0 DIADMM CCOc1ccc([N-]c2nnc(-c3ccco3)o2)c(Cl)c1 ZINC001209893169 1050101882 /nfs/dbraw/zinc/10/18/82/1050101882.db2.gz DXHAORNVXYSMIJ-UHFFFAOYSA-N -1 1 305.721 4.125 20 0 DIADMM O=c1cc(C(F)F)nc(SCc2ccc(Cl)s2)[n-]1 ZINC000573021135 1050116462 /nfs/dbraw/zinc/11/64/62/1050116462.db2.gz MFAJBQIRNYOCAY-UHFFFAOYSA-N -1 1 308.762 4.127 20 0 DIADMM [O-]c1cc(F)cc(F)c1Nc1ccc(O)c(C(F)(F)F)c1 ZINC001209985819 1050116878 /nfs/dbraw/zinc/11/68/78/1050116878.db2.gz LIGTYOMWZYEKFQ-UHFFFAOYSA-N -1 1 305.202 4.138 20 0 DIADMM Cc1cc(Cl)cc(Nc2cc3ccc([O-])cc3oc2=O)c1F ZINC001210025250 1050124578 /nfs/dbraw/zinc/12/45/78/1050124578.db2.gz IAKFDBDAQDNDPC-UHFFFAOYSA-N -1 1 319.719 4.343 20 0 DIADMM CC(C)Oc1ccccc1Nc1cc2ccc([O-])cc2oc1=O ZINC001210024103 1050124666 /nfs/dbraw/zinc/12/46/66/1050124666.db2.gz ZMIRJBYCBAPUPE-UHFFFAOYSA-N -1 1 311.337 4.029 20 0 DIADMM [O-]c1c(Br)c(F)ccc1NC1=CCC(F)(F)CC1 ZINC001210036658 1050126992 /nfs/dbraw/zinc/12/69/92/1050126992.db2.gz UTLFDMLUJPRLDJ-UHFFFAOYSA-N -1 1 322.124 4.409 20 0 DIADMM CC1(C)CCC(=Nc2ccc(S(=O)(=O)[O-])cc2Cl)CC1 ZINC001210168183 1050147286 /nfs/dbraw/zinc/14/72/86/1050147286.db2.gz OAIHZJAIQHBWHK-UHFFFAOYSA-N -1 1 315.822 4.093 20 0 DIADMM Cc1ccccc1[C@H](NC(=O)c1cc(Cl)ccc1[O-])C1CC1 ZINC001136762860 1050147937 /nfs/dbraw/zinc/14/79/37/1050147937.db2.gz BHKYKGPQPOXRCQ-QGZVFWFLSA-N -1 1 315.800 4.235 20 0 DIADMM Cc1ccccc1[C@H](CC(C)C)NC(=O)c1ccc(F)c([O-])c1 ZINC001136769182 1050151672 /nfs/dbraw/zinc/15/16/72/1050151672.db2.gz CXGCUQCGUCUONE-KRWDZBQOSA-N -1 1 315.388 4.357 20 0 DIADMM C[C@H](CCC1CCCCC1)NC(=O)Cc1ccc([O-])c(Cl)c1 ZINC001136774240 1050152877 /nfs/dbraw/zinc/15/28/77/1050152877.db2.gz VUMMSYHMQKDBJF-CYBMUJFWSA-N -1 1 323.864 4.453 20 0 DIADMM O=C(NC[C@@H]1CCc2ccccc21)c1ccc2ccccc2c1[O-] ZINC001136784939 1050159675 /nfs/dbraw/zinc/15/96/75/1050159675.db2.gz JCVBSTNUTIEJKG-INIZCTEOSA-N -1 1 317.388 4.005 20 0 DIADMM O=C(Nc1ccc(OC2CCCCC2)cc1)c1ccccc1[O-] ZINC001136792575 1050166001 /nfs/dbraw/zinc/16/60/01/1050166001.db2.gz FCELWSKUUZYXTM-UHFFFAOYSA-N -1 1 311.381 4.356 20 0 DIADMM [O-]c1c(Cl)c(Cl)ccc1Nc1ccc(-n2ccnn2)cc1 ZINC001210297717 1050193746 /nfs/dbraw/zinc/19/37/46/1050193746.db2.gz OHCOBEHURYSRHW-UHFFFAOYSA-N -1 1 321.167 4.023 20 0 DIADMM [O-]c1ccc(Cl)c(Nc2ccc(-n3ccnn3)cc2)c1Cl ZINC001210296901 1050193772 /nfs/dbraw/zinc/19/37/72/1050193772.db2.gz SLCQRZILNDVILI-UHFFFAOYSA-N -1 1 321.167 4.023 20 0 DIADMM C/C(=C/c1cccc(Cl)c1)C(=O)Nc1c([O-])cccc1F ZINC000770862127 1050195882 /nfs/dbraw/zinc/19/58/82/1050195882.db2.gz KQRUCKBHVOQAAU-NTMALXAHSA-N -1 1 305.736 4.227 20 0 DIADMM [O-]c1c(Cl)cc(Cl)cc1Nc1ccc(OC(F)F)nc1 ZINC001210303681 1050198487 /nfs/dbraw/zinc/19/84/87/1050198487.db2.gz PHCCYDWFSSBWIN-UHFFFAOYSA-N -1 1 321.110 4.439 20 0 DIADMM CC(C)(NC(=O)c1c([O-])cccc1Cl)c1cccc(Cl)c1 ZINC001136914006 1050230438 /nfs/dbraw/zinc/23/04/38/1050230438.db2.gz IDELNOZZUSRNOC-UHFFFAOYSA-N -1 1 324.207 4.364 20 0 DIADMM [O-]c1cc(F)cc(F)c1Nc1cccc(OCC(F)(F)F)c1 ZINC001212169623 1050233360 /nfs/dbraw/zinc/23/33/60/1050233360.db2.gz LYSIZHYMYMUNGT-UHFFFAOYSA-N -1 1 319.229 4.355 20 0 DIADMM CC(C)(O)c1cccc(NC(=O)c2ccc3ccccc3c2[O-])c1 ZINC000760901738 1050234783 /nfs/dbraw/zinc/23/47/83/1050234783.db2.gz RJWBOJPPTYUMSH-UHFFFAOYSA-N -1 1 321.376 4.025 20 0 DIADMM Cn1ccnc1-c1ccc(Nc2cc([O-])c(Cl)cc2F)cc1 ZINC001210432926 1050242992 /nfs/dbraw/zinc/24/29/92/1050242992.db2.gz GJNUYXWUCUJALV-UHFFFAOYSA-N -1 1 317.751 4.329 20 0 DIADMM Cc1ccc(CN[C@@H]2C[C@@H](C(=O)[O-])c3ccccc32)c(Cl)c1 ZINC000573729515 1050248796 /nfs/dbraw/zinc/24/87/96/1050248796.db2.gz WHHRLHVNFNYQDU-NVXWUHKLSA-N -1 1 315.800 4.051 20 0 DIADMM [O-]c1c(Cl)cc(Cl)cc1Nc1cccnc1OC(F)F ZINC001210627629 1050318246 /nfs/dbraw/zinc/31/82/46/1050318246.db2.gz JTYFXFPSQNIIAR-UHFFFAOYSA-N -1 1 321.110 4.439 20 0 DIADMM FC(F)(F)c1ncc([N-]c2nc3cc(Cl)ccc3o2)cn1 ZINC001210668246 1050333455 /nfs/dbraw/zinc/33/34/55/1050333455.db2.gz BBRNPTQLCXWUCH-UHFFFAOYSA-N -1 1 314.654 4.034 20 0 DIADMM Cc1cc(NC(=O)c2ccc(C(F)(F)F)cc2[O-])ccc1F ZINC001143769577 1050353865 /nfs/dbraw/zinc/35/38/65/1050353865.db2.gz JLNKZPZPGQREAB-UHFFFAOYSA-N -1 1 313.250 4.111 20 0 DIADMM COc1nccc(Nc2cc(Cl)c([O-])c(Cl)c2)c1Cl ZINC001210924285 1050416604 /nfs/dbraw/zinc/41/66/04/1050416604.db2.gz HHHBXLUIHAIHKJ-UHFFFAOYSA-N -1 1 319.575 4.500 20 0 DIADMM COc1cc2ccn(-c3cc(Cl)c([O-])c(Cl)c3)c2c(N)c1 ZINC001210932117 1050421798 /nfs/dbraw/zinc/42/17/98/1050421798.db2.gz ZNAIOPRUKVRPEK-UHFFFAOYSA-N -1 1 323.179 4.234 20 0 DIADMM CC(C)[C@@H](NC(=O)c1cc2ccccc2cc1[O-])c1ccccn1 ZINC000736506748 1050479718 /nfs/dbraw/zinc/47/97/18/1050479718.db2.gz CODOJXODIFETTL-LJQANCHMSA-N -1 1 320.392 4.068 20 0 DIADMM Nc1ccc(C(F)(F)F)cc1Nc1ccc(F)c(F)c1[O-] ZINC001211151741 1050502291 /nfs/dbraw/zinc/50/22/91/1050502291.db2.gz MFJLJVCFDIHQBM-UHFFFAOYSA-N -1 1 304.218 4.015 20 0 DIADMM Clc1ccncc1[N-]c1nc2cc(Br)ccc2o1 ZINC001211208082 1050518544 /nfs/dbraw/zinc/51/85/44/1050518544.db2.gz JSLAUUPKWRYCNM-UHFFFAOYSA-N -1 1 324.565 4.382 20 0 DIADMM COc1cc(Nc2cc([O-])c(F)c(F)c2)cc(C(F)(F)F)c1 ZINC001211335624 1050551032 /nfs/dbraw/zinc/55/10/32/1050551032.db2.gz UNDYKLHSOFPIMF-UHFFFAOYSA-N -1 1 319.229 4.441 20 0 DIADMM COc1cc(Nc2ccc(F)c(F)c2[O-])cc(C(F)(F)F)c1 ZINC001211336145 1050552205 /nfs/dbraw/zinc/55/22/05/1050552205.db2.gz GSDJFCYZDJEJNT-UHFFFAOYSA-N -1 1 319.229 4.441 20 0 DIADMM Cc1cc(N2CCCCC2)ncc1-c1cc(F)c([O-])cc1F ZINC001211338315 1050552329 /nfs/dbraw/zinc/55/23/29/1050552329.db2.gz CIYOBOGFGXYWNE-UHFFFAOYSA-N -1 1 304.340 4.031 20 0 DIADMM COc1ccc(-c2cc(F)c([O-])cc2F)c(OC(F)(F)F)c1 ZINC001211353087 1050554798 /nfs/dbraw/zinc/55/47/98/1050554798.db2.gz SYOUHDHBSXVXHB-UHFFFAOYSA-N -1 1 320.213 4.245 20 0 DIADMM CC(C)(C)OC(=O)Cc1ccc(-c2cc(F)c([O-])cc2F)cc1 ZINC001211360935 1050556079 /nfs/dbraw/zinc/55/60/79/1050556079.db2.gz ZUKHYJDRSHKPBX-UHFFFAOYSA-N -1 1 320.335 4.222 20 0 DIADMM CC(C)(C)OC(=O)Nc1ccc(-c2cc(F)c([O-])cc2F)cn1 ZINC001211360864 1050556432 /nfs/dbraw/zinc/55/64/32/1050556432.db2.gz YHNXINIHJDSCDQ-UHFFFAOYSA-N -1 1 322.311 4.079 20 0 DIADMM [O-]c1cc(F)c(CN2CCC[C@H]2c2ccccc2F)c(F)c1 ZINC001144555017 1050615388 /nfs/dbraw/zinc/61/53/88/1050615388.db2.gz RDCZQQIITNUKJN-KRWDZBQOSA-N -1 1 307.315 4.147 20 0 DIADMM COc1cccc(C(F)(F)F)c1Nc1c([O-])cc(F)cc1F ZINC001213343402 1050634839 /nfs/dbraw/zinc/63/48/39/1050634839.db2.gz QVEHLFJTZRWORI-UHFFFAOYSA-N -1 1 319.229 4.441 20 0 DIADMM COc1cccc(C(F)(F)F)c1Nc1cc([O-])c(F)c(F)c1 ZINC001213344874 1050635527 /nfs/dbraw/zinc/63/55/27/1050635527.db2.gz IYKICURPIZWZAP-UHFFFAOYSA-N -1 1 319.229 4.441 20 0 DIADMM [O-]c1cc(F)c(CN2CCC[C@@H]2c2ccc(F)cc2)cc1F ZINC001144647170 1050638640 /nfs/dbraw/zinc/63/86/40/1050638640.db2.gz BFSSJJXBKYPSDR-MRXNPFEDSA-N -1 1 307.315 4.147 20 0 DIADMM CSc1cccnc1[N-]C(=O)c1cc2sccc2s1 ZINC001144820201 1050720642 /nfs/dbraw/zinc/72/06/42/1050720642.db2.gz DNSCGAXPLSMLEO-UHFFFAOYSA-N -1 1 306.437 4.332 20 0 DIADMM CCCOc1cc(F)ccc1[N-]c1nnc(-c2ccco2)o1 ZINC001214077881 1050813104 /nfs/dbraw/zinc/81/31/04/1050813104.db2.gz ABKQWBIVPLZTBI-UHFFFAOYSA-N -1 1 303.293 4.001 20 0 DIADMM C[C@@H]1CC[C@@](C)(/C=C\C(=O)Nc2c([O-])cccc2F)C1(C)C ZINC001146492739 1050826193 /nfs/dbraw/zinc/82/61/93/1050826193.db2.gz PSURODJGELIEGL-WWAWELGDSA-N -1 1 305.393 4.488 20 0 DIADMM O=C(Nc1cccc2c1ccn2C(F)F)c1cccc([O-])c1F ZINC001146963607 1050853549 /nfs/dbraw/zinc/85/35/49/1050853549.db2.gz IDLMUQMQAVESOS-UHFFFAOYSA-N -1 1 320.270 4.133 20 0 DIADMM Cc1ccsc1C(=O)Nc1cccc(C(F)(F)F)c1[O-] ZINC001147113420 1050862931 /nfs/dbraw/zinc/86/29/31/1050862931.db2.gz LXSKSTIWCCCQLW-UHFFFAOYSA-N -1 1 301.289 4.033 20 0 DIADMM C[C@@H](CCC(C)(C)C)NC(=O)c1c([O-])cnc2c(F)cccc21 ZINC001147198171 1050867894 /nfs/dbraw/zinc/86/78/94/1050867894.db2.gz DELBFYDDHRSLKS-NSHDSACASA-N -1 1 318.392 4.024 20 0 DIADMM COCOc1ccc(C)c(Nc2cc([O-])c(Cl)cc2F)c1 ZINC001214366284 1050883635 /nfs/dbraw/zinc/88/36/35/1050883635.db2.gz UGCJBHSIVYSURG-UHFFFAOYSA-N -1 1 311.740 4.219 20 0 DIADMM [O-]c1cc(F)c(Nc2cc(OC(F)(F)F)ccc2O)cc1F ZINC001214384257 1050887877 /nfs/dbraw/zinc/88/78/77/1050887877.db2.gz FBBUKFKUAAWNCZ-UHFFFAOYSA-N -1 1 321.201 4.018 20 0 DIADMM COC(=O)c1c(C)csc1Nc1cc(F)c([O-])c(Cl)c1 ZINC001214482992 1050918020 /nfs/dbraw/zinc/91/80/20/1050918020.db2.gz YFCITFZXGSGOIF-UHFFFAOYSA-N -1 1 315.753 4.085 20 0 DIADMM [O-]c1c(F)cc(Nc2ccc(-n3cccn3)cc2)cc1Cl ZINC001214488867 1050919507 /nfs/dbraw/zinc/91/95/07/1050919507.db2.gz OLZNFKOVIHCKOZ-UHFFFAOYSA-N -1 1 303.724 4.114 20 0 DIADMM Cc1cccc(-n2nccc2Nc2cc(F)c([O-])c(Cl)c2)c1 ZINC001214484843 1050920259 /nfs/dbraw/zinc/92/02/59/1050920259.db2.gz QHGSNRWIIXTAOS-UHFFFAOYSA-N -1 1 317.751 4.422 20 0 DIADMM Cc1cnn(CC2CCC2)c1Nc1cc(F)c([O-])c(Cl)c1 ZINC001214485248 1050920647 /nfs/dbraw/zinc/92/06/47/1050920647.db2.gz XRTDTGXXLUMWOT-UHFFFAOYSA-N -1 1 309.772 4.233 20 0 DIADMM Cc1c2ccc(Nc3cc(F)c([O-])c(Cl)c3)cc2nn1C ZINC001214488638 1050920725 /nfs/dbraw/zinc/92/07/25/1050920725.db2.gz IYHQBBXBPVRCAG-UHFFFAOYSA-N -1 1 305.740 4.123 20 0 DIADMM [O-]c1c(F)cc(Nc2cnc(Br)s2)cc1Cl ZINC001214484855 1050920908 /nfs/dbraw/zinc/92/09/08/1050920908.db2.gz QNMNXKDFDJSTQU-UHFFFAOYSA-N -1 1 323.574 4.147 20 0 DIADMM [O-]c1c(F)cc(Nc2ccccc2-n2cccn2)cc1Cl ZINC001214486630 1050921027 /nfs/dbraw/zinc/92/10/27/1050921027.db2.gz QCLUYEYBTQXPLZ-UHFFFAOYSA-N -1 1 303.724 4.114 20 0 DIADMM Cc1cc(Nc2cc(F)c([O-])c(Cl)c2)cnc1OC(C)C ZINC001214486465 1050921079 /nfs/dbraw/zinc/92/10/79/1050921079.db2.gz JFRDGMIDFHFQAR-UHFFFAOYSA-N -1 1 310.756 4.419 20 0 DIADMM COc1cc(C(C)=O)ccc1Nc1cc(F)c([O-])c(Cl)c1 ZINC001214488643 1050921150 /nfs/dbraw/zinc/92/11/50/1050921150.db2.gz JHHPXKXHVYJDMX-UHFFFAOYSA-N -1 1 309.724 4.140 20 0 DIADMM CC(C)c1nnc2ccc(Nc3cc(F)c([O-])c(Cl)c3)cn21 ZINC001214486561 1050921304 /nfs/dbraw/zinc/92/13/04/1050921304.db2.gz MYUMKCQKGBQRSL-UHFFFAOYSA-N -1 1 320.755 4.094 20 0 DIADMM CCCOC(=O)c1ccc(Nc2cc(F)c([O-])c(Cl)c2)cc1 ZINC001214491785 1050922603 /nfs/dbraw/zinc/92/26/03/1050922603.db2.gz JMWGXDODFOYVCY-UHFFFAOYSA-N -1 1 323.751 4.495 20 0 DIADMM COC(=O)/C=C/c1ccc(Nc2cc(F)c([O-])c(Cl)c2)cc1 ZINC001214493935 1050924880 /nfs/dbraw/zinc/92/48/80/1050924880.db2.gz DAOVAUUHTRVFTK-QPJJXVBHSA-N -1 1 321.735 4.115 20 0 DIADMM COc1c(F)c(F)ccc1Nc1cc(F)c([O-])c(Cl)c1 ZINC001214494163 1050925286 /nfs/dbraw/zinc/92/52/86/1050925286.db2.gz JSGYJBQXUJYTCS-UHFFFAOYSA-N -1 1 303.667 4.215 20 0 DIADMM C[C@@H](C(=O)Nc1cc(Cl)c([O-])c2ccccc12)n1cccc1 ZINC001148251825 1050926187 /nfs/dbraw/zinc/92/61/87/1050926187.db2.gz CKNZWUMFDAUCMQ-NSHDSACASA-N -1 1 314.772 4.200 20 0 DIADMM Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2[O-])c(C)c1 ZINC001148253232 1050927125 /nfs/dbraw/zinc/92/71/25/1050927125.db2.gz ZSFLYFWXJIZOGX-UHFFFAOYSA-N -1 1 309.287 4.280 20 0 DIADMM COc1cc(Nc2c(Cl)ccc([O-])c2F)ccc1C(C)=O ZINC001214563793 1050946602 /nfs/dbraw/zinc/94/66/02/1050946602.db2.gz SQMZECCJKQODSC-UHFFFAOYSA-N -1 1 309.724 4.140 20 0 DIADMM CC(=O)c1ccc(F)c(Nc2nc3c(cccc3[O-])s2)c1F ZINC001214753841 1050993914 /nfs/dbraw/zinc/99/39/14/1050993914.db2.gz MCHCZRSEZPPTRF-UHFFFAOYSA-N -1 1 320.320 4.226 20 0 DIADMM [O-]c1ccc(Cl)c(Nc2ccc(CO)c(F)c2F)c1Cl ZINC001215038095 1051057706 /nfs/dbraw/zinc/05/77/06/1051057706.db2.gz FSUMXZJCPTWGED-UHFFFAOYSA-N -1 1 320.122 4.213 20 0 DIADMM [O-]c1c(Cl)cc(Cl)cc1Nc1ccc(CO)c(F)c1F ZINC001215038543 1051058921 /nfs/dbraw/zinc/05/89/21/1051058921.db2.gz QSDMCOLEALHCBQ-UHFFFAOYSA-N -1 1 320.122 4.213 20 0 DIADMM COCOc1cc(C)c(Nc2cc([O-])c(F)c(F)c2)c(C)c1 ZINC001215166133 1051097008 /nfs/dbraw/zinc/09/70/08/1051097008.db2.gz NZXWNFOPWCKMOH-UHFFFAOYSA-N -1 1 309.312 4.014 20 0 DIADMM CCOc1ccc(-c2nc(-c3cc(C)cc(C)c3)no2)c([O-])c1 ZINC001215241307 1051129257 /nfs/dbraw/zinc/12/92/57/1051129257.db2.gz PZPSJRUJOKHIQP-UHFFFAOYSA-N -1 1 310.353 4.125 20 0 DIADMM CCOc1ccc(-c2nc(-c3cccc(C)c3C)no2)c([O-])c1 ZINC001215241416 1051129271 /nfs/dbraw/zinc/12/92/71/1051129271.db2.gz WLHRXAICCFFTOQ-UHFFFAOYSA-N -1 1 310.353 4.125 20 0 DIADMM COCOc1ccc(Nc2ccc(F)c(F)c2[O-])cc1Cl ZINC001215263889 1051143093 /nfs/dbraw/zinc/14/30/93/1051143093.db2.gz HXYSJYMFCYZDQH-UHFFFAOYSA-N -1 1 315.703 4.050 20 0 DIADMM O=C(Nc1nc(C2CCCCC2)cs1)c1ccc([O-])c(F)c1 ZINC001171517780 1051159660 /nfs/dbraw/zinc/15/96/60/1051159660.db2.gz PQWKTWRTVUPERO-UHFFFAOYSA-N -1 1 320.389 4.288 20 0 DIADMM COc1cccc([O-])c1-c1nc(-c2cccc(Cl)c2C)no1 ZINC001215322444 1051165662 /nfs/dbraw/zinc/16/56/62/1051165662.db2.gz NVAWDDINYKXOOH-UHFFFAOYSA-N -1 1 316.744 4.080 20 0 DIADMM CCOc1ccccc1-c1noc(-c2ccc([O-])cc2Cl)n1 ZINC001215343168 1051172702 /nfs/dbraw/zinc/17/27/02/1051172702.db2.gz NNMBBRDILMVTNC-UHFFFAOYSA-N -1 1 316.744 4.161 20 0 DIADMM O=C(C[C@H]1CCC[C@@H](C(F)(F)F)C1)Nc1cccc(F)c1[O-] ZINC001171632503 1051174772 /nfs/dbraw/zinc/17/47/72/1051174772.db2.gz DBLJSVUJVNNOAJ-VHSXEESVSA-N -1 1 319.298 4.229 20 0 DIADMM CC(C)Oc1c([N-]c2nnc(C(C)(C)C)o2)ccc(F)c1F ZINC001215420814 1051198817 /nfs/dbraw/zinc/19/88/17/1051198817.db2.gz JQQXWTKUDUGEHO-UHFFFAOYSA-N -1 1 311.332 4.176 20 0 DIADMM CC(=O)c1ccc([O-])c(CCOC(=O)C[C@H](C)CC(C)(C)C)c1 ZINC000744819865 1051204303 /nfs/dbraw/zinc/20/43/03/1051204303.db2.gz AWWCKYKCWGWVOV-ZDUSSCGKSA-N -1 1 320.429 4.143 20 0 DIADMM CC(=O)c1ccc([O-])c(CCOC(=O)C[C@@H](C)CC(C)(C)C)c1 ZINC000744819862 1051204494 /nfs/dbraw/zinc/20/44/94/1051204494.db2.gz AWWCKYKCWGWVOV-CYBMUJFWSA-N -1 1 320.429 4.143 20 0 DIADMM [O-]c1cc(F)c(Nc2cc(Br)ccc2F)cc1F ZINC001215571736 1051245466 /nfs/dbraw/zinc/24/54/66/1051245466.db2.gz JKECEMYBALSGDG-UHFFFAOYSA-N -1 1 318.092 4.316 20 0 DIADMM CCCOc1ccc(F)c(Nc2cc(F)c([O-])c(F)c2)c1F ZINC001215567538 1051248010 /nfs/dbraw/zinc/24/80/10/1051248010.db2.gz CWEQWGFQJZIKOX-UHFFFAOYSA-N -1 1 315.266 4.481 20 0 DIADMM CC(=O)Nc1ccc(Cl)c(Nc2cc(F)c([O-])cc2F)c1 ZINC001215572016 1051252468 /nfs/dbraw/zinc/25/24/68/1051252468.db2.gz SACGHQYWAWZTNJ-UHFFFAOYSA-N -1 1 312.703 4.026 20 0 DIADMM [O-]c1cc(F)c(Nc2cccc(OC(F)(F)F)c2F)cc1F ZINC001215574530 1051253821 /nfs/dbraw/zinc/25/38/21/1051253821.db2.gz YHJZBDBPTQGHIU-UHFFFAOYSA-N -1 1 323.192 4.452 20 0 DIADMM [O-]c1cc(F)c(Nc2ccc(C(F)(F)F)cc2O)cc1F ZINC001212633027 1051259032 /nfs/dbraw/zinc/25/90/32/1051259032.db2.gz BNDSLDLWCDOGPN-UHFFFAOYSA-N -1 1 305.202 4.138 20 0 DIADMM [O-]c1cc(Cl)c(Nc2ccc(F)c(CO)c2F)cc1Cl ZINC001215651929 1051288747 /nfs/dbraw/zinc/28/87/47/1051288747.db2.gz PODNWRLGCGUGLC-UHFFFAOYSA-N -1 1 320.122 4.213 20 0 DIADMM CC(C)Oc1c(F)ccc(Nc2cc(F)c([O-])c(F)c2)c1F ZINC001215728509 1051329754 /nfs/dbraw/zinc/32/97/54/1051329754.db2.gz LTXFBIUCAWWYBU-UHFFFAOYSA-N -1 1 315.266 4.479 20 0 DIADMM [O-]c1cc(Nc2ccc(C3CCOCC3)cc2)cc(F)c1F ZINC001212654211 1051352997 /nfs/dbraw/zinc/35/29/97/1051352997.db2.gz QEUHLQZUKBWVGM-UHFFFAOYSA-N -1 1 305.324 4.308 20 0 DIADMM Cc1cc(Cl)ccc1-c1noc(-c2cc(F)ccc2[O-])n1 ZINC001215769569 1051358280 /nfs/dbraw/zinc/35/82/80/1051358280.db2.gz LFVYTAUVLURSJV-UHFFFAOYSA-N -1 1 304.708 4.210 20 0 DIADMM [O-]c1cc(-c2nc(-c3cccc4c3CCCC4)no2)ccc1F ZINC001215842063 1051406158 /nfs/dbraw/zinc/40/61/58/1051406158.db2.gz ALEBSEWFPCBNCF-UHFFFAOYSA-N -1 1 310.328 4.127 20 0 DIADMM Cc1cc2ccccc2nc1-c1noc(-c2ccc(F)c([O-])c2)n1 ZINC001215842730 1051407762 /nfs/dbraw/zinc/40/77/62/1051407762.db2.gz RPHDFUZDYAVEMV-UHFFFAOYSA-N -1 1 321.311 4.105 20 0 DIADMM Cc1ccc(Cl)cc1-c1noc(-c2cccc([O-])c2F)n1 ZINC001215984759 1051504105 /nfs/dbraw/zinc/50/41/05/1051504105.db2.gz XVTWQKHYMQTMAI-UHFFFAOYSA-N -1 1 304.708 4.210 20 0 DIADMM [O-]c1cccc(-c2nc(-c3ccc4ccccc4c3)no2)c1F ZINC001215988998 1051505925 /nfs/dbraw/zinc/50/59/25/1051505925.db2.gz OFBQLCXFZPWMBQ-UHFFFAOYSA-N -1 1 306.296 4.402 20 0 DIADMM COc1c(Cl)ccc(Nc2cc(F)c([O-])c(F)c2)c1F ZINC001212584810 1051516154 /nfs/dbraw/zinc/51/61/54/1051516154.db2.gz ASEPRCDHZPGPQK-UHFFFAOYSA-N -1 1 303.667 4.215 20 0 DIADMM Nc1ccc(Nc2c([O-])cc(F)cc2F)cc1C(F)(F)F ZINC001216052250 1051550574 /nfs/dbraw/zinc/55/05/74/1051550574.db2.gz IOSJXDZMEJNAFM-UHFFFAOYSA-N -1 1 304.218 4.015 20 0 DIADMM Nc1c(-c2cccc(Cl)c2)cnn1-c1ccc(Cl)c([O-])c1 ZINC001212588501 1051578770 /nfs/dbraw/zinc/57/87/70/1051578770.db2.gz RISKEOZIOAITGC-UHFFFAOYSA-N -1 1 320.179 4.134 20 0 DIADMM CCc1cc(Nc2cc(Cl)c([O-])cc2Cl)ccc1CO ZINC001216108356 1051582786 /nfs/dbraw/zinc/58/27/86/1051582786.db2.gz YZKUAWGSUWKUNC-UHFFFAOYSA-N -1 1 312.196 4.497 20 0 DIADMM CCN(CC)c1cc(F)cc(Nc2cc([O-])c(F)c(F)c2)c1 ZINC001216183064 1051617800 /nfs/dbraw/zinc/61/78/00/1051617800.db2.gz LFTOBQNAPLRJEM-UHFFFAOYSA-N -1 1 310.319 4.399 20 0 DIADMM O=c1oc2cc([O-])ccc2cc1Nc1cc2c(cccc2F)o1 ZINC001216290897 1051675820 /nfs/dbraw/zinc/67/58/20/1051675820.db2.gz AQHGUZVTTOPOAX-UHFFFAOYSA-N -1 1 311.268 4.128 20 0 DIADMM Cc1c(CO)ccc(Nc2cc([O-])c(Cl)cc2F)c1Cl ZINC001216328467 1051703136 /nfs/dbraw/zinc/70/31/36/1051703136.db2.gz RXJKTKQPGCDTMI-UHFFFAOYSA-N -1 1 316.159 4.382 20 0 DIADMM Cc1ccc(Cl)cc1-c1noc(-c2cc([O-])cc(F)c2)n1 ZINC001216339762 1051706025 /nfs/dbraw/zinc/70/60/25/1051706025.db2.gz LMYBGJMCAVVLBI-UHFFFAOYSA-N -1 1 304.708 4.210 20 0 DIADMM Cc1cc(-c2noc(-c3cc([O-])cc(F)c3)n2)ccc1Cl ZINC001216339714 1051706809 /nfs/dbraw/zinc/70/68/09/1051706809.db2.gz KEDSPZMPBNUYJV-UHFFFAOYSA-N -1 1 304.708 4.210 20 0 DIADMM CCN(c1ccc(NC(=O)c2ccc([O-])c(F)c2)cc1)C(C)C ZINC000767291358 1051785706 /nfs/dbraw/zinc/78/57/06/1051785706.db2.gz BYWVKIWEFFPQTL-UHFFFAOYSA-N -1 1 316.376 4.018 20 0 DIADMM [O-]c1c(Cl)nccc1Nc1cccc(OC(F)(F)F)c1F ZINC001216523148 1051803879 /nfs/dbraw/zinc/80/38/79/1051803879.db2.gz VSPBGDTWCYCLLA-UHFFFAOYSA-N -1 1 322.645 4.222 20 0 DIADMM [O-]c1c(OC(F)(F)F)cccc1-c1nc(-c2ccccc2)no1 ZINC001216734154 1051869783 /nfs/dbraw/zinc/86/97/83/1051869783.db2.gz ZUARRFTWPRFZML-UHFFFAOYSA-N -1 1 322.242 4.008 20 0 DIADMM COc1ccc(Nc2c(Cl)ccc([O-])c2Cl)c(OC)c1 ZINC001173891138 1051892113 /nfs/dbraw/zinc/89/21/13/1051892113.db2.gz GGQWNIBUHXJECS-UHFFFAOYSA-N -1 1 314.168 4.460 20 0 DIADMM [O-]c1ccc(C(F)(F)F)cc1-c1nc(-c2ccc(F)cc2)no1 ZINC001216831934 1051892131 /nfs/dbraw/zinc/89/21/31/1051892131.db2.gz HFNUDANWVSAZPO-UHFFFAOYSA-N -1 1 324.233 4.267 20 0 DIADMM COC(=O)c1cccc(Nc2cc(Cl)c([O-])cc2Cl)c1 ZINC001173963163 1051895379 /nfs/dbraw/zinc/89/53/79/1051895379.db2.gz KNTQFLLFHPGCRQ-UHFFFAOYSA-N -1 1 312.152 4.229 20 0 DIADMM Cc1ccc(Cl)c(-c2noc(-c3c(F)ccc([O-])c3F)n2)c1 ZINC001216921921 1051908292 /nfs/dbraw/zinc/90/82/92/1051908292.db2.gz FAIRVOCLMIQLCS-UHFFFAOYSA-N -1 1 322.698 4.349 20 0 DIADMM [O-]c1ccc(F)c(-c2nc(-c3ccc4occc4c3)no2)c1F ZINC001216922117 1051908313 /nfs/dbraw/zinc/90/83/13/1051908313.db2.gz JBZNYNRRRUCSHG-UHFFFAOYSA-N -1 1 314.247 4.134 20 0 DIADMM Cc1ccc(-c2noc(-c3c(F)ccc([O-])c3F)n2)c(C)c1 ZINC001216922113 1051909542 /nfs/dbraw/zinc/90/95/42/1051909542.db2.gz IWMNKEJPEPFYSJ-UHFFFAOYSA-N -1 1 302.280 4.004 20 0 DIADMM Cc1cc(C)cc(-c2noc(-c3c(F)ccc([O-])c3F)n2)c1 ZINC001216922408 1051910574 /nfs/dbraw/zinc/91/05/74/1051910574.db2.gz NFFBXEXCTXJRNC-UHFFFAOYSA-N -1 1 302.280 4.004 20 0 DIADMM Cc1cc(-c2noc(-c3cc([O-])cc(F)c3F)n2)ccc1Cl ZINC001216922597 1051910841 /nfs/dbraw/zinc/91/08/41/1051910841.db2.gz CKHJDHKYCJWYSG-UHFFFAOYSA-N -1 1 322.698 4.349 20 0 DIADMM Cc1ccc(-c2noc(-c3cc([O-])cc(F)c3F)n2)cc1Cl ZINC001216924034 1051911050 /nfs/dbraw/zinc/91/10/50/1051911050.db2.gz VQCMSAYXBDIZCT-UHFFFAOYSA-N -1 1 322.698 4.349 20 0 DIADMM Cc1cc(O)cc([O-])c1-c1nc(-c2cccc(Cl)c2C)no1 ZINC001216986733 1051927742 /nfs/dbraw/zinc/92/77/42/1051927742.db2.gz MNHICNOQGVLKBN-UHFFFAOYSA-N -1 1 316.744 4.085 20 0 DIADMM Cc1ccc(F)cc1-c1noc(-c2ccc3cccnc3c2[O-])n1 ZINC001217142173 1051976390 /nfs/dbraw/zinc/97/63/90/1051976390.db2.gz SMWWCRIRSADWDL-UHFFFAOYSA-N -1 1 321.311 4.105 20 0 DIADMM Cc1ccncc1Nc1cc(Br)cc(Cl)c1[O-] ZINC001174119052 1051977175 /nfs/dbraw/zinc/97/71/75/1051977175.db2.gz FSBPUMSSFGTSHG-UHFFFAOYSA-N -1 1 313.582 4.255 20 0 DIADMM Cc1ccc(-c2noc(-c3cc4cccc(O)c4cc3[O-])n2)cc1 ZINC001217159034 1051984261 /nfs/dbraw/zinc/98/42/61/1051984261.db2.gz LLLOUTGLGVTHFP-UHFFFAOYSA-N -1 1 318.332 4.276 20 0 DIADMM Cc1ccccc1-c1noc(-c2cc3cccc(O)c3cc2[O-])n1 ZINC001217158495 1051984528 /nfs/dbraw/zinc/98/45/28/1051984528.db2.gz DUVCDVQDICWBBC-UHFFFAOYSA-N -1 1 318.332 4.276 20 0 DIADMM Cc1cccc(-c2noc(-c3cc4cccc(O)c4cc3[O-])n2)c1 ZINC001217159631 1051984877 /nfs/dbraw/zinc/98/48/77/1051984877.db2.gz UYQQWQLFKXAIMT-UHFFFAOYSA-N -1 1 318.332 4.276 20 0 DIADMM COc1cc(C)ccc1NC(=O)Nc1ccc([O-])c(Cl)c1 ZINC000192207116 1052004979 /nfs/dbraw/zinc/00/49/79/1052004979.db2.gz MQWGWVYAEXZSFG-UHFFFAOYSA-N -1 1 306.749 4.007 20 0 DIADMM Cn1ccc2cccc(NC(=O)Nc3ccc([O-])c(Cl)c3)c21 ZINC000192315438 1052008697 /nfs/dbraw/zinc/00/86/97/1052008697.db2.gz BBHDCKIZQYPLJO-UHFFFAOYSA-N -1 1 315.760 4.181 20 0 DIADMM CC(C)c1nnc([N-]c2ccc(C(=O)Nc3ccccc3)cc2)o1 ZINC001174160194 1052025310 /nfs/dbraw/zinc/02/53/10/1052025310.db2.gz SDLSNTPJMYBXEP-UHFFFAOYSA-N -1 1 322.368 4.189 20 0 DIADMM CCOc1cc(C(=O)Nc2ccccc2C)cc(Cl)c1[O-] ZINC000192981816 1052026224 /nfs/dbraw/zinc/02/62/24/1052026224.db2.gz ZKXNHEOBZRIREG-UHFFFAOYSA-N -1 1 305.761 4.005 20 0 DIADMM CCc1c(Cl)cc(Nc2c(C)n[nH]c2C)c([O-])c1Cl ZINC001174214336 1052054191 /nfs/dbraw/zinc/05/41/91/1052054191.db2.gz FDLKAYJOERUWSJ-UHFFFAOYSA-N -1 1 300.189 4.345 20 0 DIADMM Cc1ccc(C)c(S(=O)(=O)[N-]c2cccc(C(F)F)c2)c1 ZINC000195451903 1052053705 /nfs/dbraw/zinc/05/37/05/1052053705.db2.gz KMUZCAGKLPVQAZ-UHFFFAOYSA-N -1 1 311.353 4.042 20 0 DIADMM Cc1nn(C)c(C)c1Nc1cc(Cl)c(C)c(Cl)c1[O-] ZINC001174229148 1052065321 /nfs/dbraw/zinc/06/53/21/1052065321.db2.gz RCKYMWQQACJOMX-UHFFFAOYSA-N -1 1 300.189 4.101 20 0 DIADMM [O-]c1c(Br)ccc(Cl)c1Nc1cncc(F)c1 ZINC001174292461 1052073544 /nfs/dbraw/zinc/07/35/44/1052073544.db2.gz TUABTSNWMPYMKF-UHFFFAOYSA-N -1 1 317.545 4.086 20 0 DIADMM Cc1cc(-c2noc(-c3ccc4sccc4c3[O-])n2)ccn1 ZINC001217514312 1052079307 /nfs/dbraw/zinc/07/93/07/1052079307.db2.gz OWIBQDSLKWQUNU-UHFFFAOYSA-N -1 1 309.350 4.027 20 0 DIADMM Cc1cc(-c2noc(-c3ccc4sccc4c3[O-])n2)cnc1C ZINC001217514832 1052079577 /nfs/dbraw/zinc/07/95/77/1052079577.db2.gz YUWLXJCFUIHZAL-UHFFFAOYSA-N -1 1 323.377 4.336 20 0 DIADMM [O-]c1cc(Nc2cccc(N3CCCCC3)c2)cc(F)c1F ZINC001174304577 1052088043 /nfs/dbraw/zinc/08/80/43/1052088043.db2.gz HNXOFVAURPCPLO-UHFFFAOYSA-N -1 1 304.340 4.404 20 0 DIADMM C[C@@H](c1ccccc1F)N(C)C(=O)c1c([O-])cccc1Cl ZINC000769671598 1052091100 /nfs/dbraw/zinc/09/11/00/1052091100.db2.gz KSAHTAMPVWFDOZ-JTQLQIEISA-N -1 1 307.752 4.018 20 0 DIADMM CN(C(=O)c1c([O-])cccc1Cl)[C@H]1CCCc2ccccc21 ZINC000769654530 1052091634 /nfs/dbraw/zinc/09/16/34/1052091634.db2.gz VVSCMBWFJYURQR-HNNXBMFYSA-N -1 1 315.800 4.195 20 0 DIADMM O=C(c1c([O-])cccc1Cl)N1CCC[C@@H]1c1cccc(F)c1 ZINC000769715713 1052096588 /nfs/dbraw/zinc/09/65/88/1052096588.db2.gz VRDVRACSNUHAPB-CQSZACIVSA-N -1 1 319.763 4.162 20 0 DIADMM CC(C)N(Cc1ccccc1F)C(=O)c1c([O-])cccc1Cl ZINC000769734912 1052102741 /nfs/dbraw/zinc/10/27/41/1052102741.db2.gz HOPRVMHOVWYYOR-UHFFFAOYSA-N -1 1 321.779 4.236 20 0 DIADMM CC(C)N(Cc1ccc(F)cc1)C(=O)c1c([O-])cccc1Cl ZINC000769735293 1052103558 /nfs/dbraw/zinc/10/35/58/1052103558.db2.gz JQVYEIHYVSZGMW-UHFFFAOYSA-N -1 1 321.779 4.236 20 0 DIADMM Cn1ncc2ccc(Nc3cc(Cl)c([O-])cc3Cl)cc21 ZINC001174340551 1052106047 /nfs/dbraw/zinc/10/60/47/1052106047.db2.gz FLJVAEMRGAPEQV-UHFFFAOYSA-N -1 1 308.168 4.329 20 0 DIADMM Cn1ncc2ccc(Nc3ccc(Cl)c(Cl)c3[O-])cc21 ZINC001174340600 1052106753 /nfs/dbraw/zinc/10/67/53/1052106753.db2.gz NPVAVWLCEQSYFU-UHFFFAOYSA-N -1 1 308.168 4.329 20 0 DIADMM CC(C)(C)OC(=O)c1ccc(Nc2cc(F)c([O-])cc2F)cc1 ZINC001174426051 1052156104 /nfs/dbraw/zinc/15/61/04/1052156104.db2.gz MGKQBBUXWDDIFR-UHFFFAOYSA-N -1 1 321.323 4.369 20 0 DIADMM O=C(Nc1ccc2cc[nH]c2c1)c1ccc([O-])c(C(F)(F)F)c1 ZINC001218940959 1052262332 /nfs/dbraw/zinc/26/23/32/1052262332.db2.gz OURIUZCMKLTAIH-UHFFFAOYSA-N -1 1 320.270 4.145 20 0 DIADMM CC(C)c1cnc(SCC(=O)c2ccc([O-])cc2)n1C(C)C ZINC000523497634 1052291610 /nfs/dbraw/zinc/29/16/10/1052291610.db2.gz XCHOXDFOARTJTB-UHFFFAOYSA-N -1 1 318.442 4.268 20 0 DIADMM CCCC[C@H]1CCC[C@H]1NC(=O)NCc1ccc([O-])c(Cl)c1 ZINC001221757813 1052411715 /nfs/dbraw/zinc/41/17/15/1052411715.db2.gz UBQDPVRTAKMHMF-DZGCQCFKSA-N -1 1 324.852 4.204 20 0 DIADMM COc1ccc(C(F)(F)F)c(-c2cc(F)c([O-])cc2F)c1 ZINC001222083046 1052439447 /nfs/dbraw/zinc/43/94/47/1052439447.db2.gz KUOKFHYYPOQRBI-UHFFFAOYSA-N -1 1 304.214 4.365 20 0 DIADMM COC(=O)c1ccc2ccc(-c3cc(F)c([O-])cc3F)cc2c1 ZINC001222086432 1052440453 /nfs/dbraw/zinc/44/04/53/1052440453.db2.gz KZSBCRYOOIBLSK-UHFFFAOYSA-N -1 1 314.287 4.277 20 0 DIADMM COc1ccc(-c2nc(C3CCC(C)(C)CC3)no2)c([O-])c1 ZINC000315847710 1052454148 /nfs/dbraw/zinc/45/41/48/1052454148.db2.gz GCQWQRZIVSCPMC-UHFFFAOYSA-N -1 1 302.374 4.135 20 0 DIADMM Cc1nc2cccc(-c3cc(C(=O)[O-])cc(C(F)(F)F)c3)c2[nH]1 ZINC001222614689 1052518456 /nfs/dbraw/zinc/51/84/56/1052518456.db2.gz OCDQNEOFBZOUAD-UHFFFAOYSA-N -1 1 320.270 4.255 20 0 DIADMM CC(C)C(=O)Nc1cccc(NCc2cccc([O-])c2Cl)c1 ZINC000328214720 1052595686 /nfs/dbraw/zinc/59/56/86/1052595686.db2.gz JPAJBLFTRHGXII-UHFFFAOYSA-N -1 1 318.804 4.252 20 0 DIADMM CC(C)Oc1cc(F)c(F)cc1Nc1cc(F)c([O-])cc1F ZINC001212227417 1052727425 /nfs/dbraw/zinc/72/74/25/1052727425.db2.gz JIXSKOBWQAXBHC-UHFFFAOYSA-N -1 1 315.266 4.479 20 0 DIADMM Cc1ccc(-c2nc3cc(Cl)ccc3c(=O)[n-]2)c(Cl)n1 ZINC000917512013 1052732893 /nfs/dbraw/zinc/73/28/93/1052732893.db2.gz WVODFXHVXAYWCL-UHFFFAOYSA-N -1 1 306.152 4.013 20 0 DIADMM CC(C)(C)c1nsc([N-]c2ccnc(Cl)c2Cl)n1 ZINC001212230546 1052763658 /nfs/dbraw/zinc/76/36/58/1052763658.db2.gz ZHNSVIUQWIHCHX-UHFFFAOYSA-N -1 1 303.218 4.281 20 0 DIADMM CC(=O)c1c(O)cc([O-])cc1O[C@@H]1CCc2cc(Cl)ccc21 ZINC001225679749 1052816039 /nfs/dbraw/zinc/81/60/39/1052816039.db2.gz RZZVGBQPFOVEDE-OAHLLOKOSA-N -1 1 318.756 4.020 20 0 DIADMM C[C@@H](CNC(=O)c1ccc2ccccc2c1[O-])c1ccccc1 ZINC000322138780 1052829876 /nfs/dbraw/zinc/82/98/76/1052829876.db2.gz AZGQFEXDDXEYRG-AWEZNQCLSA-N -1 1 305.377 4.079 20 0 DIADMM Cc1cc(C)c(C(=O)[O-])cc1NCc1cnc(-c2ccccc2)[nH]1 ZINC000556321740 1052836801 /nfs/dbraw/zinc/83/68/01/1052836801.db2.gz GFPBYALAHKWCIU-UHFFFAOYSA-N -1 1 321.380 4.004 20 0 DIADMM Cc1cc(=O)oc2cc([O-])cc(O[C@H](c3ccccc3)C3CC3)c12 ZINC001226490145 1052902676 /nfs/dbraw/zinc/90/26/76/1052902676.db2.gz NFAFRXGGBBDFKS-HXUWFJFHSA-N -1 1 322.360 4.337 20 0 DIADMM O=C(NCc1cccc2ccccc21)c1c([O-])cccc1Cl ZINC000920445175 1052939210 /nfs/dbraw/zinc/93/92/10/1052939210.db2.gz PXKMBYXLXHPOQL-UHFFFAOYSA-N -1 1 311.768 4.129 20 0 DIADMM C[C@H](NC(=O)c1c([O-])cccc1Cl)c1ccc(Cl)cc1 ZINC000920427762 1052940778 /nfs/dbraw/zinc/94/07/78/1052940778.db2.gz KBFPLWLGUSICJM-VIFPVBQESA-N -1 1 310.180 4.190 20 0 DIADMM COCC(=O)c1ccc([O-])cc1O[C@H](C)c1cccc(Cl)c1 ZINC001227171624 1052967782 /nfs/dbraw/zinc/96/77/82/1052967782.db2.gz GJHHHQMUOGNLMU-LLVKDONJSA-N -1 1 320.772 4.015 20 0 DIADMM CCC[C@@H](C)[C@H](Oc1cc([O-])ccc1C(=O)COC)C(C)C ZINC001227173222 1052968076 /nfs/dbraw/zinc/96/80/76/1052968076.db2.gz VGFABIMYTJKGJU-FZKQIMNGSA-N -1 1 308.418 4.061 20 0 DIADMM C[C@H](Oc1[n-]c(=S)ncc1F)c1ccc(C(F)(F)F)cc1 ZINC001227383825 1052986998 /nfs/dbraw/zinc/98/69/98/1052986998.db2.gz RWIVXGZIANGSQH-ZETCQYMHSA-N -1 1 318.295 4.063 20 0 DIADMM CC(=O)[C@H](Oc1cc(Cl)c([O-])cc1Cl)c1ccccc1 ZINC001227646398 1053005823 /nfs/dbraw/zinc/00/58/23/1053005823.db2.gz RZAWTYOCGOTOIT-HNNXBMFYSA-N -1 1 311.164 4.408 20 0 DIADMM C[C@@H](Oc1cc(Cl)c([O-])cc1Cl)c1cnc2ccccn21 ZINC001227640635 1053006139 /nfs/dbraw/zinc/00/61/39/1053006139.db2.gz FKWGAQBGDBXLPH-SECBINFHSA-N -1 1 323.179 4.487 20 0 DIADMM CC(C)C1CCC(Oc2[n-]c(=S)nc3cnccc32)CC1 ZINC001227880497 1053025037 /nfs/dbraw/zinc/02/50/37/1053025037.db2.gz BFNPHUJBVPZOAU-UHFFFAOYSA-N -1 1 303.431 4.281 20 0 DIADMM C[C@@H](Oc1[n-]c(=S)nc2cnccc21)c1c(F)cccc1F ZINC001227881981 1053025341 /nfs/dbraw/zinc/02/53/41/1053025341.db2.gz RZMURXWTJQVYSQ-MRVPVSSYSA-N -1 1 319.336 4.106 20 0 DIADMM C[C@H](Oc1[n-]c(=S)nc2cnccc21)c1cccc(Cl)c1 ZINC001227886695 1053025763 /nfs/dbraw/zinc/02/57/63/1053025763.db2.gz XDKSLUKLGJEEOU-VIFPVBQESA-N -1 1 317.801 4.481 20 0 DIADMM COC1=CC[C@@H](Oc2cc([O-])ccc2C(=O)c2ccccc2)CC1 ZINC001228185047 1053051258 /nfs/dbraw/zinc/05/12/58/1053051258.db2.gz CEDGLBZTHLNKKI-QGZVFWFLSA-N -1 1 324.376 4.085 20 0 DIADMM CCC(=O)c1ccccc1OC(=C([O-])c1ccco1)c1ccco1 ZINC001228453829 1053108469 /nfs/dbraw/zinc/10/84/69/1053108469.db2.gz GWGJCQPZABGINL-LJQANCHMSA-N -1 1 324.332 4.468 20 0 DIADMM C[C@@H](Oc1[n-]c(=S)nc2ccccc21)c1ccccc1F ZINC001228764096 1053177823 /nfs/dbraw/zinc/17/78/23/1053177823.db2.gz FSEREHOIVXVDAL-SNVBAGLBSA-N -1 1 300.358 4.198 20 0 DIADMM C[C@H](Oc1[n-]c(=S)nc2ccccc21)c1ccccc1F ZINC001228764095 1053177912 /nfs/dbraw/zinc/17/79/12/1053177912.db2.gz FSEREHOIVXVDAL-JTQLQIEISA-N -1 1 300.358 4.198 20 0 DIADMM C[C@@H](Oc1[n-]c(=S)nc2ccccc21)c1ccc(F)cc1 ZINC001228765688 1053178281 /nfs/dbraw/zinc/17/82/81/1053178281.db2.gz OKAYSUIEGVMXGP-SNVBAGLBSA-N -1 1 300.358 4.198 20 0 DIADMM C[C@H](Oc1[n-]c(=S)nc2ccccc21)c1cccc(F)c1 ZINC001228765266 1053178335 /nfs/dbraw/zinc/17/83/35/1053178335.db2.gz MSJPIVFAXQDFFS-JTQLQIEISA-N -1 1 300.358 4.198 20 0 DIADMM C[C@@H](Oc1[n-]c(=S)nc2ccccc21)c1cccc(F)c1F ZINC001228767460 1053179795 /nfs/dbraw/zinc/17/97/95/1053179795.db2.gz ZSGCJFVXKIGBPB-SECBINFHSA-N -1 1 318.348 4.337 20 0 DIADMM Fc1ccc2c(c1)CC[C@@H]2Oc1[n-]c(=S)nc2ccccc21 ZINC001228767433 1053180000 /nfs/dbraw/zinc/18/00/00/1053180000.db2.gz ZNPJMLWETLBNOA-HNNXBMFYSA-N -1 1 312.369 4.124 20 0 DIADMM O=C1CCc2cccc(OC(=C([O-])c3ccco3)c3ccco3)c21 ZINC001228837431 1053189538 /nfs/dbraw/zinc/18/95/38/1053189538.db2.gz JQNJYCAKCGYVCU-IBGZPJMESA-N -1 1 322.316 4.005 20 0 DIADMM Cc1ccc([C@H](C)Oc2cc([O-])cc3oc(=O)ccc23)c(C)c1 ZINC001229135560 1053255313 /nfs/dbraw/zinc/25/53/13/1053255313.db2.gz NKZYYBZRYPEKRW-ZDUSSCGKSA-N -1 1 310.349 4.255 20 0 DIADMM CC(C)[C@@H](Oc1cc([O-])cc2oc(=O)ccc12)c1ccccc1 ZINC001229135959 1053255577 /nfs/dbraw/zinc/25/55/77/1053255577.db2.gz SMWPLBZVRMJVPM-LJQANCHMSA-N -1 1 310.349 4.275 20 0 DIADMM [O-]c1cc(O[C@H]2CC(F)(F)C2(F)F)c(Cl)cc1Cl ZINC001229406581 1053316228 /nfs/dbraw/zinc/31/62/28/1053316228.db2.gz ZWJNPYGPPDYPPN-QMMMGPOBSA-N -1 1 305.054 4.121 20 0 DIADMM C[C@@H](Oc1cc([O-])c(Cl)cc1Cl)c1cccnc1F ZINC001229406196 1053316452 /nfs/dbraw/zinc/31/64/52/1053316452.db2.gz NGVDFLXCLSECMV-SSDOTTSWSA-N -1 1 302.132 4.373 20 0 DIADMM CCC[C@@H](C)Oc1cc([O-])ccc1C(=O)Cc1ccc(O)cc1 ZINC001229431831 1053319480 /nfs/dbraw/zinc/31/94/80/1053319480.db2.gz IEAOWILGYSQFLH-CYBMUJFWSA-N -1 1 314.381 4.091 20 0 DIADMM CCC(=O)c1ccc([O-])cc1O[C@H](C)c1c(F)cccc1F ZINC001229475274 1053331275 /nfs/dbraw/zinc/33/12/75/1053331275.db2.gz SOCIVZZZRHBTGP-SNVBAGLBSA-N -1 1 306.308 4.403 20 0 DIADMM CC(C)Sc1ccccc1NC(=O)c1cccc([O-])c1F ZINC001545762616 1053362541 /nfs/dbraw/zinc/36/25/41/1053362541.db2.gz QQKGEZMDZBACBY-UHFFFAOYSA-N -1 1 305.374 4.284 20 0 DIADMM [O-]c1cc(F)ccc1NC(=S)Nc1cccc2ccccc21 ZINC001200103214 1053383665 /nfs/dbraw/zinc/38/36/65/1053383665.db2.gz HJTVGHCKPYXZTO-UHFFFAOYSA-N -1 1 312.369 4.493 20 0 DIADMM CC1(C)CN(C(=O)c2ccc(Cl)cc2[O-])[C@@H]1c1ccccc1 ZINC000619054215 1053424187 /nfs/dbraw/zinc/42/41/87/1053424187.db2.gz OLQJVAVARBVVPJ-MRXNPFEDSA-N -1 1 315.800 4.269 20 0 DIADMM C[C@@H](CCNC(=O)c1cc2ccccc2cc1[O-])c1ccccc1 ZINC000324823154 1053465698 /nfs/dbraw/zinc/46/56/98/1053465698.db2.gz OBUAKYQTFMZQBR-HNNXBMFYSA-N -1 1 319.404 4.469 20 0 DIADMM C[C@H](CCNC(=O)c1cc2ccccc2cc1[O-])c1ccccc1 ZINC000324823155 1053465798 /nfs/dbraw/zinc/46/57/98/1053465798.db2.gz OBUAKYQTFMZQBR-OAHLLOKOSA-N -1 1 319.404 4.469 20 0 DIADMM Cc1ccc(NC(=S)Nc2ccc(F)cc2[O-])c(Cl)c1 ZINC001200335722 1053569869 /nfs/dbraw/zinc/56/98/69/1053569869.db2.gz BDICMOBBOJABKK-UHFFFAOYSA-N -1 1 310.781 4.302 20 0 DIADMM C[C@H](Oc1nc2c(cc(Cl)nc2Cl)[n-]1)c1cccs1 ZINC001231045007 1053660575 /nfs/dbraw/zinc/66/05/75/1053660575.db2.gz RFJSKVVBHWVUON-LURJTMIESA-N -1 1 314.197 4.466 20 0 DIADMM C[C@H](Oc1nc2cc(Cl)nc(Cl)c2[n-]1)c1cccs1 ZINC001231045007 1053660580 /nfs/dbraw/zinc/66/05/80/1053660580.db2.gz RFJSKVVBHWVUON-LURJTMIESA-N -1 1 314.197 4.466 20 0 DIADMM C[C@H](Oc1cccnc1-c1ncccc1[O-])c1ccccc1F ZINC001231200113 1053698553 /nfs/dbraw/zinc/69/85/53/1053698553.db2.gz JPEJEBIMZJZLPF-LBPRGKRZSA-N -1 1 310.328 4.128 20 0 DIADMM CCC[C@H](Oc1cccnc1-c1ncccc1[O-])[C@@H](C)CC ZINC001231199074 1053698810 /nfs/dbraw/zinc/69/88/10/1053698810.db2.gz ACUPQIHWAYQUGP-ZFWWWQNUSA-N -1 1 300.402 4.443 20 0 DIADMM O=C(c1ccc([O-])cc1)c1ccccc1O[C@H]1CCCC[C@@H]1F ZINC001231229389 1053705394 /nfs/dbraw/zinc/70/53/94/1053705394.db2.gz BXELCULPCPTWBN-WMZOPIPTSA-N -1 1 314.356 4.283 20 0 DIADMM O=C(c1ccc([O-])cc1)c1ccccc1O[C@H]1CCCC[C@H]1F ZINC001231229385 1053705529 /nfs/dbraw/zinc/70/55/29/1053705529.db2.gz BXELCULPCPTWBN-AEFFLSMTSA-N -1 1 314.356 4.283 20 0 DIADMM C[C@@H](Cc1ccco1)Oc1ccccc1C(=O)c1ccc([O-])cc1 ZINC001231229925 1053707765 /nfs/dbraw/zinc/70/77/65/1053707765.db2.gz INBBZJZARXIZSZ-AWEZNQCLSA-N -1 1 322.360 4.226 20 0 DIADMM C[C@@H](Oc1ccccc1C(=O)c1ccc([O-])cc1)c1cccnc1 ZINC001231229660 1053707783 /nfs/dbraw/zinc/70/77/83/1053707783.db2.gz WMZFJFVZNJTRPQ-CQSZACIVSA-N -1 1 319.360 4.158 20 0 DIADMM C[C@@H](Oc1ccccc1C(=O)c1ccc([O-])cc1)c1ccco1 ZINC001231229457 1053708450 /nfs/dbraw/zinc/70/84/50/1053708450.db2.gz DVFAKVURIGODAB-CYBMUJFWSA-N -1 1 308.333 4.356 20 0 DIADMM O=C([O-])c1ccc(CN2CCCC[C@@H]2c2ccccc2F)s1 ZINC001231463961 1053757078 /nfs/dbraw/zinc/75/70/78/1053757078.db2.gz XXSLUWFRXUVTJU-OAHLLOKOSA-N -1 1 319.401 4.313 20 0 DIADMM Cc1ccc(CCNC(=O)c2ccc3ccccc3c2[O-])cc1C ZINC001300527821 1053780977 /nfs/dbraw/zinc/78/09/77/1053780977.db2.gz BRUAFLOTAWLQIV-UHFFFAOYSA-N -1 1 319.404 4.135 20 0 DIADMM [O-]c1cc(CN2CCSC[C@H]2c2ccccc2)ccc1Cl ZINC001231733884 1053840022 /nfs/dbraw/zinc/84/00/22/1053840022.db2.gz KSCSZUGYMOCUHO-INIZCTEOSA-N -1 1 319.857 4.336 20 0 DIADMM CC(C)N(CC(=O)c1ccccc1)Cc1ccc(Cl)c([O-])c1 ZINC001231737908 1053846778 /nfs/dbraw/zinc/84/67/78/1053846778.db2.gz YJVMTNWCQOICJB-UHFFFAOYSA-N -1 1 317.816 4.139 20 0 DIADMM CC(C)c1scnc1[N-]C(=O)c1nc(Cl)sc1Cl ZINC000848095417 1053851046 /nfs/dbraw/zinc/85/10/46/1053851046.db2.gz PTXYOAMPWHAYSA-UHFFFAOYSA-N -1 1 322.242 4.282 20 0 DIADMM [O-]c1cccc(NC(=S)Nc2ccc(F)c(F)c2)c1Cl ZINC001200697604 1053899806 /nfs/dbraw/zinc/89/98/06/1053899806.db2.gz WAWLDGIBXUQWEU-UHFFFAOYSA-N -1 1 314.744 4.133 20 0 DIADMM CC(C)c1ccc(C(=O)Nc2cncc3c2CCCC3)c([O-])c1 ZINC001300769817 1054020077 /nfs/dbraw/zinc/02/00/77/1054020077.db2.gz LTWDGLODAJXSHE-UHFFFAOYSA-N -1 1 310.397 4.042 20 0 DIADMM [O-]c1cc(F)c(NC(=S)Nc2ccccc2Cl)c(F)c1 ZINC001200862687 1054052166 /nfs/dbraw/zinc/05/21/66/1054052166.db2.gz ZHMPMVQCAMKRPL-UHFFFAOYSA-N -1 1 314.744 4.133 20 0 DIADMM Cc1ccc2c(c1)N(C(=O)c1ccc3ccccc3c1[O-])CC2 ZINC000621978705 1054070243 /nfs/dbraw/zinc/07/02/43/1054070243.db2.gz VPZVKKFBCGFJKY-UHFFFAOYSA-N -1 1 303.361 4.057 20 0 DIADMM C[C@H](SCCC(=O)c1ccc([O-])cc1O)c1cccs1 ZINC000848430772 1054083403 /nfs/dbraw/zinc/08/34/03/1054083403.db2.gz BEWVHNQLSGDPIB-JTQLQIEISA-N -1 1 308.424 4.227 20 0 DIADMM C[C@@](NCc1ccc(Cl)cc1Cl)(C(=O)[O-])c1ccccc1 ZINC001331945552 1054101507 /nfs/dbraw/zinc/10/15/07/1054101507.db2.gz AETNDLRGZVRDGN-INIZCTEOSA-N -1 1 324.207 4.083 20 0 DIADMM CN(Cc1cccc([O-])c1Cl)[C@@H](C1CCC1)C(F)(F)F ZINC001232788738 1054122758 /nfs/dbraw/zinc/12/27/58/1054122758.db2.gz LEJXHJZBIWORTN-ZDUSSCGKSA-N -1 1 307.743 4.208 20 0 DIADMM CC(C)N(CC(=O)c1ccccc1)Cc1cccc([O-])c1Cl ZINC001232789106 1054122260 /nfs/dbraw/zinc/12/22/60/1054122260.db2.gz WEEZGOVGZCVMLV-UHFFFAOYSA-N -1 1 317.816 4.139 20 0 DIADMM Cc1ccc(C)c(NC(=O)c2ccc(C(F)(F)F)cc2[O-])c1 ZINC000622272093 1054137127 /nfs/dbraw/zinc/13/71/27/1054137127.db2.gz FSFYDNQWQUXXSA-UHFFFAOYSA-N -1 1 309.287 4.280 20 0 DIADMM CCc1ccc2nc([N-]C(=O)c3ocnc3C(F)F)sc2c1 ZINC001355469978 1054145801 /nfs/dbraw/zinc/14/58/01/1054145801.db2.gz KQEVMQDPMYTYTO-UHFFFAOYSA-N -1 1 323.324 4.037 20 0 DIADMM [O-]c1cc(CN2CCC[C@H]2c2ccc(F)cc2)cc(F)c1F ZINC001232971252 1054163128 /nfs/dbraw/zinc/16/31/28/1054163128.db2.gz ZCYSXKPTOQTLOE-HNNXBMFYSA-N -1 1 307.315 4.147 20 0 DIADMM CC(C)(C)[C@H](NC(=O)c1c([O-])cccc1F)c1ccccc1 ZINC000622315606 1054169408 /nfs/dbraw/zinc/16/94/08/1054169408.db2.gz KAYAYOVRDLYXGE-MRXNPFEDSA-N -1 1 301.361 4.049 20 0 DIADMM Oc1cnc(Cl)cc1C[N@H+]1CC[C@H](c2ccccc2Cl)C1 ZINC001233033077 1054173021 /nfs/dbraw/zinc/17/30/21/1054173021.db2.gz AMCIAVRWJWLXQF-NSHDSACASA-N -1 1 323.223 4.084 20 0 DIADMM C[C@@H](c1ccc(Cl)cc1)[N@@H+](C)Cc1cc(Cl)ncc1O ZINC001233039257 1054174361 /nfs/dbraw/zinc/17/43/61/1054174361.db2.gz RMRSRXUFKCEFMX-JTQLQIEISA-N -1 1 311.212 4.287 20 0 DIADMM CC[N@@H+](Cc1ccc(Cl)cc1)Cc1cc(Cl)ncc1O ZINC001233039230 1054174599 /nfs/dbraw/zinc/17/45/99/1054174599.db2.gz QTGBAIAOSBGUPV-UHFFFAOYSA-N -1 1 311.212 4.116 20 0 DIADMM CC(C)c1ccc(C(=O)Nc2cc(F)c(F)cc2F)c([O-])c1 ZINC000622355600 1054187128 /nfs/dbraw/zinc/18/71/28/1054187128.db2.gz LBLIVKAQCVEZED-UHFFFAOYSA-N -1 1 309.287 4.185 20 0 DIADMM CC(C)C[C@@H]1CCCN(C(=O)c2cc3ccccc3cc2[O-])C1 ZINC000622433883 1054224867 /nfs/dbraw/zinc/22/48/67/1054224867.db2.gz SNQYKXSGJRJVBJ-HNNXBMFYSA-N -1 1 311.425 4.444 20 0 DIADMM Oc1ccc(F)c(C[N@H+]2CCC[C@@H](Cc3ccccc3)C2)c1F ZINC001233395932 1054261591 /nfs/dbraw/zinc/26/15/91/1054261591.db2.gz ZYUQXDWMAKDXJA-HNNXBMFYSA-N -1 1 317.379 4.125 20 0 DIADMM Cc1cc(-c2ncccc2NC(=O)c2ccccc2[O-])cs1 ZINC001337313541 1054263209 /nfs/dbraw/zinc/26/32/09/1054263209.db2.gz QDFRLSLTEJGWHI-UHFFFAOYSA-N -1 1 310.378 4.076 20 0 DIADMM CC(C)c1oncc1[N-]C(=O)c1coc(C2CCCCC2)n1 ZINC001337357546 1054265692 /nfs/dbraw/zinc/26/56/92/1054265692.db2.gz PBSSALYQSSMUJG-UHFFFAOYSA-N -1 1 303.362 4.086 20 0 DIADMM CC(C)(C)[C@@H]1CCCN(C(=O)c2cc3ccccc3cc2[O-])C1 ZINC000622574434 1054297264 /nfs/dbraw/zinc/29/72/64/1054297264.db2.gz ODGRMUVPJIQZMG-MRXNPFEDSA-N -1 1 311.425 4.444 20 0 DIADMM CCCC(=O)c1ccc([O-])cc1O[C@@H]1CCCc2cccnc21 ZINC001233646252 1054319685 /nfs/dbraw/zinc/31/96/85/1054319685.db2.gz GMAIYRQHELHSQL-QGZVFWFLSA-N -1 1 311.381 4.226 20 0 DIADMM CCCC(=O)c1ccc([O-])cc1O[C@@H]1CCOc2ccccc21 ZINC001233650538 1054321446 /nfs/dbraw/zinc/32/14/46/1054321446.db2.gz MMERHBZRBYXBSN-GOSISDBHSA-N -1 1 312.365 4.278 20 0 DIADMM CCCC(=O)c1ccc([O-])cc1O[C@@H](C)c1ccncc1F ZINC001233650128 1054322274 /nfs/dbraw/zinc/32/22/74/1054322274.db2.gz IFEGURSOIMFEQF-NSHDSACASA-N -1 1 303.333 4.049 20 0 DIADMM O=C(N[C@H](c1ccc(Cl)cc1)C1CC1)c1c([O-])cccc1F ZINC001440667022 1054362700 /nfs/dbraw/zinc/36/27/00/1054362700.db2.gz PEZJXKWONWLOAX-INIZCTEOSA-N -1 1 319.763 4.066 20 0 DIADMM C[C@@H](c1cc2ccccc2o1)N(C)C(=O)c1ccc(F)c([O-])c1 ZINC001441008426 1054376842 /nfs/dbraw/zinc/37/68/42/1054376842.db2.gz UHCDCFYOLMHLEI-NSHDSACASA-N -1 1 313.328 4.111 20 0 DIADMM Cc1ccc([C@@H](C)N(C)C(=O)c2cc(Cl)ccc2[O-])cc1 ZINC001441177510 1054384058 /nfs/dbraw/zinc/38/40/58/1054384058.db2.gz NBLDSXSFIUJGQX-GFCCVEGCSA-N -1 1 303.789 4.187 20 0 DIADMM O=C(Cc1ccc(O[C@H]2C=CCCC2)cc1)c1ccc([O-])cc1 ZINC001233940093 1054395995 /nfs/dbraw/zinc/39/59/95/1054395995.db2.gz AJNMCWJILNKUKL-SFHVURJKSA-N -1 1 308.377 4.305 20 0 DIADMM Cc1ccccc1[C@@H]1CCCN1C(=O)c1ccc(Cl)cc1[O-] ZINC001441873996 1054400906 /nfs/dbraw/zinc/40/09/06/1054400906.db2.gz YJVQIUVGSXJORD-INIZCTEOSA-N -1 1 315.800 4.331 20 0 DIADMM O=C(Nc1ccc([O-])c(Cl)c1)c1ccccc1-c1ccncc1 ZINC001545951563 1054432151 /nfs/dbraw/zinc/43/21/51/1054432151.db2.gz YPXMXLHKKLQPKT-UHFFFAOYSA-N -1 1 324.767 4.360 20 0 DIADMM O=C(NCCCc1ccc(Cl)cc1)c1ccc(Cl)cc1[O-] ZINC001442869644 1054434772 /nfs/dbraw/zinc/43/47/72/1054434772.db2.gz OYAGREKFHZNMLM-UHFFFAOYSA-N -1 1 324.207 4.062 20 0 DIADMM Cc1cccc(C)c1NC(=O)c1ccc(C(F)(F)F)c([O-])c1 ZINC001444989741 1054494749 /nfs/dbraw/zinc/49/47/49/1054494749.db2.gz XJEZVXYGTDIRSA-UHFFFAOYSA-N -1 1 309.287 4.280 20 0 DIADMM COc1cccc([O-])c1C(=O)Nc1ccc(SC)c(Cl)c1 ZINC001445210690 1054498704 /nfs/dbraw/zinc/49/87/04/1054498704.db2.gz HENPUJVJMRFEBS-UHFFFAOYSA-N -1 1 323.801 4.028 20 0 DIADMM CC[C@@H](Cc1ccccc1)N(CC)C(=O)c1ccc(F)c([O-])c1 ZINC001445846657 1054516745 /nfs/dbraw/zinc/51/67/45/1054516745.db2.gz BLBVNKQNXZBFTN-INIZCTEOSA-N -1 1 315.388 4.015 20 0 DIADMM [O-]c1cc(F)c(Cl)cc1-c1cccc(CO[C@H]2CCOC2)c1 ZINC000623048659 1054521672 /nfs/dbraw/zinc/52/16/72/1054521672.db2.gz UZTOKLSDHZCCIC-ZDUSSCGKSA-N -1 1 322.763 4.157 20 0 DIADMM CC(C)c1ccc(C(=O)Nc2cccc(-c3ncco3)c2)c([O-])c1 ZINC001447162353 1054556942 /nfs/dbraw/zinc/55/69/42/1054556942.db2.gz CZQYHGMKNIQQTO-UHFFFAOYSA-N -1 1 322.364 4.423 20 0 DIADMM O=C(Nc1ccc(Cl)cc1O)c1ccc2ccccc2c1[O-] ZINC001447274975 1054558979 /nfs/dbraw/zinc/55/89/79/1054558979.db2.gz PGINPCORQFUUIS-UHFFFAOYSA-N -1 1 313.740 4.157 20 0 DIADMM CC(C)c1ccc([C@H]2CCCCN2C(=O)c2ncccc2[O-])cc1 ZINC001447239723 1054559777 /nfs/dbraw/zinc/55/97/77/1054559777.db2.gz WYKPHEUDWAYHDP-QGZVFWFLSA-N -1 1 324.424 4.278 20 0 DIADMM O=C([N-]c1c(F)cc(Cl)cc1F)c1cc(Cl)ncc1F ZINC001357917777 1054566857 /nfs/dbraw/zinc/56/68/57/1054566857.db2.gz IEJPXUBWDLEPLK-UHFFFAOYSA-N -1 1 321.085 4.058 20 0 DIADMM C[C@@H](NC(=O)c1ccc(F)c([O-])c1)c1cc2ccccc2s1 ZINC001447794115 1054575524 /nfs/dbraw/zinc/57/55/24/1054575524.db2.gz MBFUFGHCNAONFP-SNVBAGLBSA-N -1 1 315.369 4.237 20 0 DIADMM C[C@@H](C(=O)Nc1ccc([O-])c(F)c1F)c1ccc(Cl)s1 ZINC001449449380 1054620255 /nfs/dbraw/zinc/62/02/55/1054620255.db2.gz QQRJSFRGGPKRNQ-ZCFIWIBFSA-N -1 1 317.744 4.128 20 0 DIADMM O=C(c1ccc(Cl)cc1[O-])N1CC[C@@H](C2CCCCC2)C1 ZINC001452958234 1054723146 /nfs/dbraw/zinc/72/31/46/1054723146.db2.gz VRCFONCUEMKRIV-CYBMUJFWSA-N -1 1 307.821 4.088 20 0 DIADMM Cc1cc(C(=O)Nc2cc(Cl)c([O-])c3ccccc23)ns1 ZINC001453771636 1054747886 /nfs/dbraw/zinc/74/78/86/1054747886.db2.gz PGKBHVQBUHXWEH-UHFFFAOYSA-N -1 1 318.785 4.216 20 0 DIADMM CCCCC[C@@H]1CCCCN1C(=O)c1cc(C)cc(C=O)c1[O-] ZINC001453879664 1054749157 /nfs/dbraw/zinc/74/91/57/1054749157.db2.gz BBYORRJXXILHRQ-MRXNPFEDSA-N -1 1 317.429 4.088 20 0 DIADMM CC1(C)C[C@@]1(NC(=O)c1c([O-])cccc1Cl)c1ccccc1 ZINC001454060968 1054758177 /nfs/dbraw/zinc/75/81/77/1054758177.db2.gz OOFXCPRMFUUHMC-GOSISDBHSA-N -1 1 315.800 4.101 20 0 DIADMM Cc1sccc1NC(=O)c1ccc(C(F)(F)F)c([O-])c1 ZINC001454682034 1054778425 /nfs/dbraw/zinc/77/84/25/1054778425.db2.gz HCRKONCWGVRUOF-UHFFFAOYSA-N -1 1 301.289 4.033 20 0 DIADMM Cc1nc(-c2ccccc2)ccc1C(=O)Nc1cccc(F)c1[O-] ZINC001454756443 1054783814 /nfs/dbraw/zinc/78/38/14/1054783814.db2.gz LJQBFJDNMFXNFQ-UHFFFAOYSA-N -1 1 322.339 4.154 20 0 DIADMM CCOC(=O)c1nc2cc(-c3cccc(C4CC4)c3)ccc2[n-]1 ZINC001236087344 1054934640 /nfs/dbraw/zinc/93/46/40/1054934640.db2.gz FYIRYUSQRVYLCN-UHFFFAOYSA-N -1 1 306.365 4.284 20 0 DIADMM CCOC(=O)c1nc2ccc(-c3cccc(C4CC4)c3)cc2[n-]1 ZINC001236087344 1054934648 /nfs/dbraw/zinc/93/46/48/1054934648.db2.gz FYIRYUSQRVYLCN-UHFFFAOYSA-N -1 1 306.365 4.284 20 0 DIADMM Cc1cc2[nH]cnc2cc1-c1ccc(C(=O)[O-])c(C)c1Cl ZINC001236120510 1054959249 /nfs/dbraw/zinc/95/92/49/1054959249.db2.gz LSSWQHAGJRIFKB-UHFFFAOYSA-N -1 1 300.745 4.198 20 0 DIADMM COC(=O)c1nc2cc(C3=CC[C@@H](C(F)(F)F)CC3)ccc2[n-]1 ZINC001236253203 1055037751 /nfs/dbraw/zinc/03/77/51/1055037751.db2.gz HXZMGYAXAXCCKR-LLVKDONJSA-N -1 1 324.302 4.095 20 0 DIADMM COC(=O)c1nc2ccc(C3=CC[C@@H](C(F)(F)F)CC3)cc2[n-]1 ZINC001236253203 1055037765 /nfs/dbraw/zinc/03/77/65/1055037765.db2.gz HXZMGYAXAXCCKR-LLVKDONJSA-N -1 1 324.302 4.095 20 0 DIADMM Cc1cc(-c2c(F)ccc(C)c2[O-])nc(-c2ccsc2)n1 ZINC001236393150 1055089727 /nfs/dbraw/zinc/08/97/27/1055089727.db2.gz TYTXQKCZCRVYHP-UHFFFAOYSA-N -1 1 300.358 4.334 20 0 DIADMM CCOc1ccc(-c2ccc(-c3c(F)ccc(C)c3[O-])nn2)cc1 ZINC001236394136 1055092393 /nfs/dbraw/zinc/09/23/93/1055092393.db2.gz WWEUCXNYANFLRK-UHFFFAOYSA-N -1 1 324.355 4.362 20 0 DIADMM Cc1ccc(F)c(-c2ccnc(Cc3ccc(F)cc3)n2)c1[O-] ZINC001236394664 1055092594 /nfs/dbraw/zinc/09/25/94/1055092594.db2.gz ZLUOCHSZOOAHMZ-UHFFFAOYSA-N -1 1 312.319 4.027 20 0 DIADMM CN(C)c1c(Cl)cccc1NCc1cccc([O-])c1Cl ZINC000380829487 1055129936 /nfs/dbraw/zinc/12/99/36/1055129936.db2.gz JBXKSTCEACKMLP-UHFFFAOYSA-N -1 1 311.212 4.377 20 0 DIADMM CCOC(=O)c1nc2cc(-c3ccc(NC(C)C)cc3)ccc2[n-]1 ZINC001236485808 1055140149 /nfs/dbraw/zinc/14/01/49/1055140149.db2.gz AMXTYBHMMMANFC-UHFFFAOYSA-N -1 1 323.396 4.227 20 0 DIADMM CCOC(=O)c1nc2ccc(-c3ccc(NC(C)C)cc3)cc2[n-]1 ZINC001236485808 1055140157 /nfs/dbraw/zinc/14/01/57/1055140157.db2.gz AMXTYBHMMMANFC-UHFFFAOYSA-N -1 1 323.396 4.227 20 0 DIADMM CCC(CC)(CNC(=O)c1c([O-])cccc1F)c1ccccc1 ZINC001587136488 1055224779 /nfs/dbraw/zinc/22/47/79/1055224779.db2.gz MHESXOVOMXEWHQ-UHFFFAOYSA-N -1 1 315.388 4.019 20 0 DIADMM O=C(Nc1cccc(F)c1[O-])c1c(Cl)cc(F)cc1Cl ZINC001587389567 1055283319 /nfs/dbraw/zinc/28/33/19/1055283319.db2.gz NTDYWLXWHZPRHP-UHFFFAOYSA-N -1 1 318.106 4.230 20 0 DIADMM CC(C)c1ccc(SCC(=O)Nc2cccc(F)c2[O-])cc1 ZINC001587389958 1055284233 /nfs/dbraw/zinc/28/42/33/1055284233.db2.gz WNEQUKRKFAFCAC-UHFFFAOYSA-N -1 1 319.401 4.386 20 0 DIADMM C[C@H](Cc1cccc(Cl)c1)C(=O)Nc1cccc(F)c1[O-] ZINC001587389738 1055285002 /nfs/dbraw/zinc/28/50/02/1055285002.db2.gz QORKXZWNLAICGP-SNVBAGLBSA-N -1 1 307.752 4.002 20 0 DIADMM C[C@@H](Cc1cccc(Cl)c1)C(=O)Nc1cccc(F)c1[O-] ZINC001587389737 1055285362 /nfs/dbraw/zinc/28/53/62/1055285362.db2.gz QORKXZWNLAICGP-JTQLQIEISA-N -1 1 307.752 4.002 20 0 DIADMM COc1cc(C)ccc1NC(=O)c1ccc2ccccc2c1[O-] ZINC000383661447 1055292810 /nfs/dbraw/zinc/29/28/10/1055292810.db2.gz SMMPRILVLVCQNX-UHFFFAOYSA-N -1 1 307.349 4.115 20 0 DIADMM CCCCC[C@H](C)NC(=O)c1ccc(C(F)(F)F)c([O-])c1 ZINC001588282790 1055463842 /nfs/dbraw/zinc/46/38/42/1055463842.db2.gz FDYAGJFTISNFOZ-JTQLQIEISA-N -1 1 303.324 4.110 20 0 DIADMM C[C@@H](c1ccccc1Cl)N(C)Cc1ccccc1C(=O)[O-] ZINC000062015191 1055472961 /nfs/dbraw/zinc/47/29/61/1055472961.db2.gz QMFMLWVSKQONBM-LBPRGKRZSA-N -1 1 303.789 4.231 20 0 DIADMM Cc1oc(C(C)C)cc1C(=O)NCc1ccc([O-])c(Cl)c1 ZINC001594558747 1055566415 /nfs/dbraw/zinc/56/64/15/1055566415.db2.gz SYWFUAPCXKYBFR-UHFFFAOYSA-N -1 1 307.777 4.000 20 0 DIADMM O=C(NCc1ccc([O-])c(Cl)c1)[C@H]1CC[C@H](C2CCC2)CC1 ZINC001594565975 1055566552 /nfs/dbraw/zinc/56/65/52/1055566552.db2.gz WEYIIEWHVDTMHZ-SHTZXODSSA-N -1 1 321.848 4.268 20 0 DIADMM CC(C)c1ccc(C(=O)NCc2ccc([O-])c(Cl)c2)cc1 ZINC001594558928 1055566979 /nfs/dbraw/zinc/56/69/79/1055566979.db2.gz XKYYBUCTCJOWRA-UHFFFAOYSA-N -1 1 303.789 4.099 20 0 DIADMM C[C@@H]1CC(C)(C)C[C@](C)(NC(=O)c2ccc(Cl)cc2[O-])C1 ZINC001594717664 1055571222 /nfs/dbraw/zinc/57/12/22/1055571222.db2.gz NRNFMYXZQCNJBV-PIGZYNQJSA-N -1 1 309.837 4.380 20 0 DIADMM [O-]c1c(F)cc(CN2CC[C@@H](c3cccc(F)c3)C2)cc1Cl ZINC001237998803 1055580284 /nfs/dbraw/zinc/58/02/84/1055580284.db2.gz XIHCYJOMNKAJDY-CYBMUJFWSA-N -1 1 323.770 4.313 20 0 DIADMM O=C([O-])c1cc(F)ccc1CN1CCC[C@@H]1c1cccc(F)c1 ZINC001238233629 1055627865 /nfs/dbraw/zinc/62/78/65/1055627865.db2.gz AMMLOVIDMHAITC-QGZVFWFLSA-N -1 1 317.335 4.000 20 0 DIADMM Cc1cccc([N-]S(=O)(=O)c2cc(Cl)ccc2C)c1C ZINC000031665369 1055641902 /nfs/dbraw/zinc/64/19/02/1055641902.db2.gz MVQXMPXKFIVTGM-UHFFFAOYSA-N -1 1 309.818 4.066 20 0 DIADMM Cc1cnc(C(=O)N2CCC[C@@H]2CCC2CCCCC2)c([O-])c1 ZINC001596041098 1055661790 /nfs/dbraw/zinc/66/17/90/1055661790.db2.gz YLACQFMYUQTUIK-MRXNPFEDSA-N -1 1 316.445 4.061 20 0 DIADMM CC(C)CSCCCNC(=O)c1ccc2ccccc2c1[O-] ZINC001596332451 1055697390 /nfs/dbraw/zinc/69/73/90/1055697390.db2.gz PONDHHOFWYIIJT-UHFFFAOYSA-N -1 1 317.454 4.055 20 0 DIADMM CC(C)(C)c1ccc([C@@H]2CCCN2C(=O)c2ncccc2[O-])cc1 ZINC001596467552 1055713444 /nfs/dbraw/zinc/71/34/44/1055713444.db2.gz PNKUOIQIKGOIEH-INIZCTEOSA-N -1 1 324.424 4.062 20 0 DIADMM CC(C)c1ccc(C(=O)N2C[C@H](C)Cc3ccccc32)c([O-])c1 ZINC001565636613 1055714647 /nfs/dbraw/zinc/71/46/47/1055714647.db2.gz XKWAVFWOXSMKMT-CQSZACIVSA-N -1 1 309.409 4.355 20 0 DIADMM Cc1cccc(C(C)(C)NC(=O)c2ccc(Cl)cc2[O-])c1 ZINC001565805931 1055730352 /nfs/dbraw/zinc/73/03/52/1055730352.db2.gz TXTUCRVTMFHKGX-UHFFFAOYSA-N -1 1 303.789 4.019 20 0 DIADMM CC(C)CCOc1ccc(NC(=O)c2ccc(F)c([O-])c2)cc1 ZINC001565999637 1055739967 /nfs/dbraw/zinc/73/99/67/1055739967.db2.gz MDWQTXRLVBYWSC-UHFFFAOYSA-N -1 1 317.360 4.209 20 0 DIADMM O=C(Nc1ccc([O-])c(Cl)c1)c1ccc(C(F)F)c(F)c1 ZINC001566588807 1055776923 /nfs/dbraw/zinc/77/69/23/1055776923.db2.gz CYWOCDLAZNGGOJ-UHFFFAOYSA-N -1 1 315.678 4.375 20 0 DIADMM CCCCOc1ccc(NC(=O)c2ccc(F)c([O-])c2)c(C)c1 ZINC001597223620 1055803186 /nfs/dbraw/zinc/80/31/86/1055803186.db2.gz SAMGFTBPMGCURQ-UHFFFAOYSA-N -1 1 317.360 4.271 20 0 DIADMM C[C@]1(NC(=O)c2cc(Cl)ccc2[O-])CCCc2ccccc21 ZINC001597277842 1055810962 /nfs/dbraw/zinc/81/09/62/1055810962.db2.gz PLAOQEMHUWEHLG-SFHVURJKSA-N -1 1 315.800 4.027 20 0 DIADMM C[C@@H](NC(=O)c1cc(F)ccc1[O-])c1cc2ccccc2s1 ZINC001567648206 1055810919 /nfs/dbraw/zinc/81/09/19/1055810919.db2.gz NUJNMZZNMARLEV-SNVBAGLBSA-N -1 1 315.369 4.237 20 0 DIADMM CC(C)[C@@H](NC(=O)c1c([O-])cccc1Cl)c1ccc(F)cc1 ZINC001568130917 1055830124 /nfs/dbraw/zinc/83/01/24/1055830124.db2.gz LBIIKGNZNPIVLS-MRXNPFEDSA-N -1 1 321.779 4.312 20 0 DIADMM CC(C)CN(C(=O)c1ccc(F)c([O-])c1)c1cccc(Cl)c1 ZINC001569068701 1055854306 /nfs/dbraw/zinc/85/43/06/1055854306.db2.gz BOHQFUCDJZQTNZ-UHFFFAOYSA-N -1 1 321.779 4.488 20 0 DIADMM Cc1cccc(CN(C)C(=O)c2ccc3ccccc3c2[O-])c1C ZINC001569580450 1055864190 /nfs/dbraw/zinc/86/41/90/1055864190.db2.gz IWKSDJJDVRKUQI-UHFFFAOYSA-N -1 1 319.404 4.434 20 0 DIADMM C[C@H](NC(=O)c1ccc2ccccc2c1[O-])[C@H]1CCC[C@H](C)C1 ZINC001570370877 1055899471 /nfs/dbraw/zinc/89/94/71/1055899471.db2.gz MLSPOHCOHKEPDL-DZKIICNBSA-N -1 1 311.425 4.490 20 0 DIADMM C[C@H](NC(=O)c1ccc2ccccc2c1[O-])[C@@H]1CCC[C@@H](C)C1 ZINC001570370878 1055899625 /nfs/dbraw/zinc/89/96/25/1055899625.db2.gz MLSPOHCOHKEPDL-IJEWVQPXSA-N -1 1 311.425 4.490 20 0 DIADMM CC1(C)C[C@@H](c2ccccc2)N(C(=O)c2cc(F)ccc2[O-])C1 ZINC001570562090 1055907626 /nfs/dbraw/zinc/90/76/26/1055907626.db2.gz UJRPVXDYCRRYJF-INIZCTEOSA-N -1 1 313.372 4.145 20 0 DIADMM O=C(Cc1ccc([O-])c(Cl)c1)N[C@H](C1CCC1)C1CCCC1 ZINC001570659600 1055911622 /nfs/dbraw/zinc/91/16/22/1055911622.db2.gz SAIZZYKWGYFEDR-SFHVURJKSA-N -1 1 321.848 4.063 20 0 DIADMM CSc1ccc(S(=O)(=O)[N-]c2cccc(C(C)C)c2)cc1 ZINC000064474880 1055917941 /nfs/dbraw/zinc/91/79/41/1055917941.db2.gz AVAAJHNIHRKQLU-UHFFFAOYSA-N -1 1 321.467 4.333 20 0 DIADMM O=C(Nc1ccc(SC(F)F)cc1)c1ccc(F)c([O-])c1 ZINC001540333091 1056018183 /nfs/dbraw/zinc/01/81/83/1056018183.db2.gz XZFQKEOCWXWOGA-UHFFFAOYSA-N -1 1 313.300 4.098 20 0 DIADMM CSc1cccc(NC(=O)c2ccc(C(C)C)cc2[O-])c1 ZINC001540405607 1056027385 /nfs/dbraw/zinc/02/73/85/1056027385.db2.gz RBQVAIYWKIGEMH-UHFFFAOYSA-N -1 1 301.411 4.490 20 0 DIADMM CCCc1ccccc1NC(=O)Cc1ccc([O-])c(Cl)c1 ZINC001540525485 1056041345 /nfs/dbraw/zinc/04/13/45/1056041345.db2.gz UIWCQBDFUZSZCN-UHFFFAOYSA-N -1 1 303.789 4.179 20 0 DIADMM CC(C)C[C@@H](NC(=O)c1cc(F)ccc1[O-])c1ccccc1 ZINC001540538354 1056041950 /nfs/dbraw/zinc/04/19/50/1056041950.db2.gz HRBRERVCGFLYDM-MRXNPFEDSA-N -1 1 301.361 4.049 20 0 DIADMM CCC[C@](C)(NC(=O)c1cc(Cl)ccc1[O-])c1ccccc1 ZINC001607228946 1056045632 /nfs/dbraw/zinc/04/56/32/1056045632.db2.gz ARCPZIMNTZSWJU-SFHVURJKSA-N -1 1 317.816 4.491 20 0 DIADMM C[C@@H]1CCC[C@H](N(C)C(=O)c2ccc(C(F)(F)F)c([O-])c2)C1 ZINC001540605311 1056050126 /nfs/dbraw/zinc/05/01/26/1056050126.db2.gz YGAORONYYVIUGL-PWSUYJOCSA-N -1 1 315.335 4.062 20 0 DIADMM C[C@H]1CCN(C(=O)c2ccc([O-])cc2F)c2ccccc2S1 ZINC001540676624 1056059417 /nfs/dbraw/zinc/05/94/17/1056059417.db2.gz HTSNWWBERBJMCW-NSHDSACASA-N -1 1 317.385 4.062 20 0 DIADMM Cc1cccc(S(=O)(=O)[N-]c2ccccc2C(C)(C)C)c1 ZINC000006352433 1056060677 /nfs/dbraw/zinc/06/06/77/1056060677.db2.gz HXEMNYCBZKOTEX-UHFFFAOYSA-N -1 1 303.427 4.093 20 0 DIADMM CCN(Cc1ccccc1F)C(=O)c1cc2ccccc2cc1[O-] ZINC001540718546 1056067419 /nfs/dbraw/zinc/06/74/19/1056067419.db2.gz XTQRLTYWCHYKRR-UHFFFAOYSA-N -1 1 323.367 4.347 20 0 DIADMM CC(C)Oc1ccc(NC(=O)c2cccc([O-])c2F)cc1Cl ZINC001540766168 1056074787 /nfs/dbraw/zinc/07/47/87/1056074787.db2.gz GHDBMUONFGEPQK-UHFFFAOYSA-N -1 1 323.751 4.224 20 0 DIADMM CC(C)c1cccc(C(=O)Nc2ccc(-c3cc(=O)[nH][n-]3)cc2)c1 ZINC001540813242 1056081452 /nfs/dbraw/zinc/08/14/52/1056081452.db2.gz KRHHVVONGZHXFD-UHFFFAOYSA-N -1 1 321.380 4.158 20 0 DIADMM CCCCN(Cc1ccccc1F)C(=O)c1cccc([O-])c1F ZINC001611103604 1056109451 /nfs/dbraw/zinc/10/94/51/1056109451.db2.gz JKUAYIOJDXGIAM-UHFFFAOYSA-N -1 1 319.351 4.113 20 0 DIADMM O=C(c1cccc([O-])c1F)N(Cc1ccccc1)c1ccccc1 ZINC001542195265 1056110830 /nfs/dbraw/zinc/11/08/30/1056110830.db2.gz SESHMFJDAOFCCK-UHFFFAOYSA-N -1 1 321.351 4.378 20 0 DIADMM O=C(c1cccc([O-])c1F)N1CC2(CC=CC2)[C@H]1c1ccccc1 ZINC001583591261 1056112465 /nfs/dbraw/zinc/11/24/65/1056112465.db2.gz OIQXKKIPBGDHFZ-GOSISDBHSA-N -1 1 323.367 4.065 20 0 DIADMM CCCN(C(=O)c1cccc([O-])c1F)[C@@H]1CCc2ccccc21 ZINC001583618004 1056119636 /nfs/dbraw/zinc/11/96/36/1056119636.db2.gz GRFYVKAQJUXRRU-MRXNPFEDSA-N -1 1 313.372 4.071 20 0 DIADMM CCCN(C(=O)c1cccc([O-])c1F)[C@H]1CCc2ccccc21 ZINC001583618003 1056120181 /nfs/dbraw/zinc/12/01/81/1056120181.db2.gz GRFYVKAQJUXRRU-INIZCTEOSA-N -1 1 313.372 4.071 20 0 DIADMM CC(C)c1ccc(C(=O)Nc2ccc3ncccc3c2)c([O-])c1 ZINC001542546487 1056135495 /nfs/dbraw/zinc/13/54/95/1056135495.db2.gz QSSMBFACCLNRQX-UHFFFAOYSA-N -1 1 306.365 4.316 20 0 DIADMM O=C(NCCCCCc1ccccc1)c1ccc(Cl)cc1[O-] ZINC001611358702 1056147884 /nfs/dbraw/zinc/14/78/84/1056147884.db2.gz ZGZWSJCRZJYHKA-UHFFFAOYSA-N -1 1 317.816 4.188 20 0 DIADMM O=C(Cc1ccc([O-])c(Cl)c1)Nc1cccc(C(F)F)c1 ZINC001542670893 1056149439 /nfs/dbraw/zinc/14/94/39/1056149439.db2.gz QKFGXRGOJPAYLV-UHFFFAOYSA-N -1 1 311.715 4.164 20 0 DIADMM Cc1ccccc1C(C)(C)CNC(=O)c1cc(Cl)ccc1[O-] ZINC001542699001 1056150891 /nfs/dbraw/zinc/15/08/91/1056150891.db2.gz GTEKLFPXCFJDJV-UHFFFAOYSA-N -1 1 317.816 4.062 20 0 DIADMM CCCn1ccc2cc(NC(=O)c3ccc(OC)cc3[O-])ccc21 ZINC001583783347 1056167131 /nfs/dbraw/zinc/16/71/31/1056167131.db2.gz XRMIJIRBQVBISA-UHFFFAOYSA-N -1 1 324.380 4.018 20 0 DIADMM CCCCCN(CCCCC)C(=O)c1cc(C)cc(C=O)c1[O-] ZINC001543067923 1056174352 /nfs/dbraw/zinc/17/43/52/1056174352.db2.gz BYBQYUBMKKVPMR-UHFFFAOYSA-N -1 1 319.445 4.336 20 0 DIADMM O=C(c1ccc(F)c([O-])c1)N1CCC[C@H]1c1ccc(Cl)cc1 ZINC001543283534 1056195973 /nfs/dbraw/zinc/19/59/73/1056195973.db2.gz DXFTZYTUQVEMOC-HNNXBMFYSA-N -1 1 319.763 4.162 20 0 DIADMM CC(C)CCc1ccc(NC(=O)c2ccc([O-])cc2F)cc1 ZINC001583898595 1056199101 /nfs/dbraw/zinc/19/91/01/1056199101.db2.gz QFBRFKPGBVVTBC-UHFFFAOYSA-N -1 1 301.361 4.372 20 0 DIADMM CCc1ccc2nc(-c3ccc(CSC)cc3)[n-]c(=O)c2c1 ZINC000060797480 1056201149 /nfs/dbraw/zinc/20/11/49/1056201149.db2.gz BORZIECPXSPZBV-UHFFFAOYSA-N -1 1 310.422 4.016 20 0 DIADMM O=C(NCc1ccc2occc2c1)c1cc2ccccc2cc1[O-] ZINC001583976198 1056226817 /nfs/dbraw/zinc/22/68/17/1056226817.db2.gz TUXZXFQEKOGCIY-UHFFFAOYSA-N -1 1 317.344 4.222 20 0 DIADMM [O-]c1ccc(CNc2nc3ccc(F)cc3s2)cc1Cl ZINC001612853534 1056333231 /nfs/dbraw/zinc/33/32/31/1056333231.db2.gz OEWQAYMXPITWIU-UHFFFAOYSA-N -1 1 308.765 4.407 20 0 DIADMM CCN(C(=O)Cc1ccc([O-])c(Cl)c1)[C@@H]1CCCC[C@@H]1C ZINC001584664234 1056391168 /nfs/dbraw/zinc/39/11/68/1056391168.db2.gz CKXNMFADQMNJJN-SWLSCSKDSA-N -1 1 309.837 4.015 20 0 DIADMM CCN(C(=O)Cc1ccc([O-])c(Cl)c1)[C@H]1CCCC[C@H]1C ZINC001584664232 1056391388 /nfs/dbraw/zinc/39/13/88/1056391388.db2.gz CKXNMFADQMNJJN-DOMZBBRYSA-N -1 1 309.837 4.015 20 0 DIADMM COc1ccc(C(=O)Nc2ccccc2CCC(C)C)c([O-])c1 ZINC001544257389 1056393604 /nfs/dbraw/zinc/39/36/04/1056393604.db2.gz JUNUHZFSNULKBG-UHFFFAOYSA-N -1 1 313.397 4.242 20 0 DIADMM CCc1cccc(CSc2nc(C)c(C3CC3)c(=O)[n-]2)c1 ZINC001614793122 1056452697 /nfs/dbraw/zinc/45/26/97/1056452697.db2.gz BBKZSDRYYPGWTE-UHFFFAOYSA-N -1 1 300.427 4.223 20 0 DIADMM CCCn1ccc2ccc(NC(=O)c3ccc(OC)cc3[O-])cc21 ZINC001544598284 1056463180 /nfs/dbraw/zinc/46/31/80/1056463180.db2.gz SDEBCZIEDDQFEL-UHFFFAOYSA-N -1 1 324.380 4.018 20 0 DIADMM Cc1cc(C)nc(CSc2nc(-c3ccccc3)cc(=O)[n-]2)c1 ZINC001615016840 1056464571 /nfs/dbraw/zinc/46/45/71/1056464571.db2.gz CGEYWGJAZIXOKQ-UHFFFAOYSA-N -1 1 323.421 4.153 20 0 DIADMM O=C(/C=C\c1cccnc1)Nc1cc(Cl)c([O-])c2ccccc12 ZINC001585193034 1056504492 /nfs/dbraw/zinc/50/44/92/1056504492.db2.gz IJLVNJVRSYDURP-FPLPWBNLSA-N -1 1 324.767 4.246 20 0 DIADMM O=C(Nc1cc(Cl)c([O-])c2ccccc12)C1(F)CCCC1 ZINC001585193347 1056504620 /nfs/dbraw/zinc/50/46/20/1056504620.db2.gz VNCQGDOZDKAEEC-UHFFFAOYSA-N -1 1 307.752 4.420 20 0 DIADMM O=C(c1ccc(Cl)cc1[O-])N1CCCC[C@H]1CC1CCC1 ZINC001585376466 1056539066 /nfs/dbraw/zinc/53/90/66/1056539066.db2.gz QGJMVRCKUAVUDV-AWEZNQCLSA-N -1 1 307.821 4.231 20 0 DIADMM Cc1ccc(Cl)cc1[N-]S(=O)(=O)c1cccc(Cl)c1 ZINC000007409001 1056580114 /nfs/dbraw/zinc/58/01/14/1056580114.db2.gz MZJSZMLOCGMMIT-UHFFFAOYSA-N -1 1 316.209 4.103 20 0 DIADMM [O-]c1c(F)cc(Nc2cc(C(F)(F)F)cnc2F)cc1Cl ZINC001214486604 1056646371 /nfs/dbraw/zinc/64/63/71/1056646371.db2.gz OXTSGSDTOJCQLU-UHFFFAOYSA-N -1 1 324.636 4.481 20 0 DIADMM [O-]c1ccc(F)cc1-c1nc(-c2ccccn2)nc2sccc21 ZINC001240696688 1056647213 /nfs/dbraw/zinc/64/72/13/1056647213.db2.gz WGORFBBEUBTQJC-UHFFFAOYSA-N -1 1 323.352 4.265 20 0 DIADMM [O-]c1ccc(F)cc1-c1ncnc2c1cccc2C(F)(F)F ZINC001240695754 1056647963 /nfs/dbraw/zinc/64/79/63/1056647963.db2.gz QECXKIUYGFBDGI-UHFFFAOYSA-N -1 1 308.234 4.160 20 0 DIADMM CCOC(=O)c1ccc(Nc2cc(F)c([O-])c(Cl)c2)c(C)c1 ZINC001214486648 1056651820 /nfs/dbraw/zinc/65/18/20/1056651820.db2.gz RMOIDWFEQSAAFQ-UHFFFAOYSA-N -1 1 323.751 4.413 20 0 DIADMM [O-]c1cc(F)c(Nc2cc(F)c(OC(F)F)c(F)c2)cc1F ZINC001212454597 1056685204 /nfs/dbraw/zinc/68/52/04/1056685204.db2.gz YZTNAYMTYNYXFT-UHFFFAOYSA-N -1 1 323.192 4.294 20 0 DIADMM Cc1cc(=O)oc2cc(Nc3cc(F)c([O-])c(Cl)c3)ccc12 ZINC001214489240 1056692557 /nfs/dbraw/zinc/69/25/57/1056692557.db2.gz ZHWQFUBRMSMARV-UHFFFAOYSA-N -1 1 319.719 4.343 20 0 DIADMM CCc1nc2sc3c(c2c(-c2ccc([O-])c(F)c2)n1)CCC3 ZINC001240782486 1056695040 /nfs/dbraw/zinc/69/50/40/1056695040.db2.gz DTKLWAYPXGVVCI-UHFFFAOYSA-N -1 1 314.385 4.254 20 0 DIADMM Cc1cccc2c(-c3ccnc(-c4ccc([O-])c(F)c4)n3)c[nH]c21 ZINC001240782187 1056695840 /nfs/dbraw/zinc/69/58/40/1056695840.db2.gz TUJWPWWZURHEHO-UHFFFAOYSA-N -1 1 319.339 4.445 20 0 DIADMM CSc1ccc(C(F)(F)F)nc1-c1ccc([O-])c(F)c1 ZINC001240782214 1056696042 /nfs/dbraw/zinc/69/60/42/1056696042.db2.gz UQAFAICUGICKBM-UHFFFAOYSA-N -1 1 303.280 4.334 20 0 DIADMM [O-]c1ccc(-c2nc(C(F)(F)F)nc3ccccc32)cc1F ZINC001240782925 1056696104 /nfs/dbraw/zinc/69/61/04/1056696104.db2.gz JPYZDQKSOMKFBR-UHFFFAOYSA-N -1 1 308.234 4.160 20 0 DIADMM [O-]c1ccc(-c2ncnc3sc4c(c32)CCCC4)cc1F ZINC001240783866 1056697079 /nfs/dbraw/zinc/69/70/79/1056697079.db2.gz YYUMKBXUZQRBEJ-UHFFFAOYSA-N -1 1 300.358 4.082 20 0 DIADMM CCOc1ccc(-c2ccc(-c3ccc([O-])c(F)c3)nn2)cc1 ZINC001240785778 1056697099 /nfs/dbraw/zinc/69/70/99/1056697099.db2.gz DWAGJSUVMGFJIA-UHFFFAOYSA-N -1 1 310.328 4.054 20 0 DIADMM Cc1ccc(Oc2nc(-c3ccc([O-])c(F)c3)ncc2F)cc1 ZINC001240786459 1056697962 /nfs/dbraw/zinc/69/79/62/1056697962.db2.gz UFPZALILEZIYCP-UHFFFAOYSA-N -1 1 314.291 4.228 20 0 DIADMM CCSc1cccc(NC(=O)c2cc(SC)ccc2[O-])c1 ZINC001586317353 1056710206 /nfs/dbraw/zinc/71/02/06/1056710206.db2.gz HRCUDAOMZAEFEC-UHFFFAOYSA-N -1 1 319.451 4.478 20 0 DIADMM O=C(NC1(c2cccc(Cl)c2)CC1)c1c([O-])cccc1Cl ZINC001586443552 1056736411 /nfs/dbraw/zinc/73/64/11/1056736411.db2.gz BNARHXIRBQITFI-UHFFFAOYSA-N -1 1 322.191 4.118 20 0 DIADMM CCC(CC)[C@@H](NC(=O)c1cccc([O-])c1F)c1ccccc1 ZINC001586623989 1056769556 /nfs/dbraw/zinc/76/95/56/1056769556.db2.gz NUSRHJZOCIBMRW-GOSISDBHSA-N -1 1 315.388 4.439 20 0 DIADMM [O-]c1c(Cl)c(Cl)ccc1Nc1cc(F)cc(F)c1O ZINC001212489566 1056829471 /nfs/dbraw/zinc/82/94/71/1056829471.db2.gz RVNYPMMNJQNHJX-UHFFFAOYSA-N -1 1 306.095 4.426 20 0 DIADMM COc1ccc(-c2ccccn2)cc1-c1c(F)cc([O-])cc1F ZINC001241120581 1056905946 /nfs/dbraw/zinc/90/59/46/1056905946.db2.gz BINDETAGENMMPX-UHFFFAOYSA-N -1 1 313.303 4.408 20 0 DIADMM Cc1nc(-c2c(F)cc([O-])cc2F)cc(C2CCCCC2)n1 ZINC001241119700 1056906199 /nfs/dbraw/zinc/90/61/99/1056906199.db2.gz INSXEXQIQGQUBB-UHFFFAOYSA-N -1 1 304.340 4.484 20 0 DIADMM COc1ccc(-c2cccnc2)cc1-c1c(F)cc([O-])cc1F ZINC001241122769 1056906669 /nfs/dbraw/zinc/90/66/69/1056906669.db2.gz YEOSRBOGTDDORV-UHFFFAOYSA-N -1 1 313.303 4.408 20 0 DIADMM [O-]c1cc(F)c(-c2nc(C(F)F)nc3ccccc32)c(F)c1 ZINC001241120505 1056907105 /nfs/dbraw/zinc/90/71/05/1056907105.db2.gz XRLHXODMTNTYNC-UHFFFAOYSA-N -1 1 308.234 4.218 20 0 DIADMM [O-]c1cc(F)c(-c2ccc(O[C@@H]3CCCCO3)cc2F)c(F)c1 ZINC001241124230 1056908759 /nfs/dbraw/zinc/90/87/59/1056908759.db2.gz DJPZNEPHVFDWAH-MRXNPFEDSA-N -1 1 324.298 4.382 20 0 DIADMM Cc1ccc([C@@H]2CCCCN2C(=O)c2cc(F)ccc2[O-])cc1 ZINC001618009022 1056914135 /nfs/dbraw/zinc/91/41/35/1056914135.db2.gz INQGZEOQCICSCI-KRWDZBQOSA-N -1 1 313.372 4.207 20 0 DIADMM [O-]c1ccc(F)c(-c2nccc(Oc3ccc(F)cc3)n2)c1F ZINC001241289706 1056998457 /nfs/dbraw/zinc/99/84/57/1056998457.db2.gz BYNGHTXDWADKBH-UHFFFAOYSA-N -1 1 318.254 4.059 20 0 DIADMM [O-]c1ccc(F)c(-c2nccc3c4c([nH]c32)CCCC4)c1F ZINC001241290712 1056999203 /nfs/dbraw/zinc/99/92/03/1056999203.db2.gz DRPKEKKGXFXUSZ-UHFFFAOYSA-N -1 1 300.308 4.093 20 0 DIADMM [O-]c1ccc(F)c(-c2cc(C(F)(F)F)c3c(n2)CCC3)c1F ZINC001241291763 1056999688 /nfs/dbraw/zinc/99/96/88/1056999688.db2.gz WIHKRSFXSRQRKR-UHFFFAOYSA-N -1 1 315.241 4.240 20 0 DIADMM [O-]c1ccc(F)c(-c2cc3c(nn2)-c2ccccc2CCC3)c1F ZINC001241291085 1056999714 /nfs/dbraw/zinc/99/97/14/1056999714.db2.gz ZHTLREDJFGRGMF-UHFFFAOYSA-N -1 1 324.330 4.283 20 0 DIADMM Cc1ccnc(-c2cc(C)cc(-c3c(F)ccc([O-])c3F)n2)c1 ZINC001241293088 1056999837 /nfs/dbraw/zinc/99/98/37/1056999837.db2.gz AWQXSRMJEUFJDS-UHFFFAOYSA-N -1 1 312.319 4.411 20 0 DIADMM [O-]c1ccc(F)c(-c2cc(C3(C(F)(F)F)CC3)ccn2)c1F ZINC001241291270 1057000418 /nfs/dbraw/zinc/00/04/18/1057000418.db2.gz LGYBBDQBBWCSSV-UHFFFAOYSA-N -1 1 315.241 4.326 20 0 DIADMM Cc1nc(SCC2CCC(F)(F)CC2)[n-]c(=O)c1C1CC1 ZINC000631023814 1057002521 /nfs/dbraw/zinc/00/25/21/1057002521.db2.gz YDLSAJIOCCXILX-UHFFFAOYSA-N -1 1 314.401 4.286 20 0 DIADMM CC(C)(C)c1ccccc1C(=O)Nc1cc(F)cc(F)c1[O-] ZINC001626854359 1057002587 /nfs/dbraw/zinc/00/25/87/1057002587.db2.gz KNEPPWXTRVFOCL-UHFFFAOYSA-N -1 1 305.324 4.220 20 0 DIADMM Cc1nc(C(=O)[N-]c2cc(Cl)ccc2SC(C)C)co1 ZINC000673596999 1057042175 /nfs/dbraw/zinc/04/21/75/1057042175.db2.gz QSKYMUCPVTYTSS-UHFFFAOYSA-N -1 1 310.806 4.389 20 0 DIADMM CC(C)(C)Oc1ccc(-c2cc(C(F)(F)F)ccc2[O-])nn1 ZINC001242127481 1057271140 /nfs/dbraw/zinc/27/11/40/1057271140.db2.gz ZADYYQHTFRAJIT-UHFFFAOYSA-N -1 1 312.291 4.045 20 0 DIADMM [O-]c1ccc(C(F)(F)F)cc1-c1cnc(-c2ccco2)cn1 ZINC001242131183 1057273618 /nfs/dbraw/zinc/27/36/18/1057273618.db2.gz FSOQDOLSQFECKA-UHFFFAOYSA-N -1 1 306.243 4.128 20 0 DIADMM [O-]c1ccc(C(F)(F)F)cc1-c1ccc(OC(F)(F)F)cn1 ZINC001242131072 1057273793 /nfs/dbraw/zinc/27/37/93/1057273793.db2.gz ADCJFZFIPOTSPK-UHFFFAOYSA-N -1 1 323.192 4.372 20 0 DIADMM COc1ccc2nc(-c3cc(C(F)(F)F)ccc3[O-])cnc2c1 ZINC001242131670 1057273877 /nfs/dbraw/zinc/27/38/77/1057273877.db2.gz OHVFDNDVWPHSMH-UHFFFAOYSA-N -1 1 320.270 4.030 20 0 DIADMM [O-]c1ccc(-c2ncnc3ccc(F)cc32)cc1C(F)(F)F ZINC001242147572 1057279749 /nfs/dbraw/zinc/27/97/49/1057279749.db2.gz AORRFLJNWRNUBV-UHFFFAOYSA-N -1 1 308.234 4.160 20 0 DIADMM Cc1ccc2ncc(-c3ccc([O-])c(C(F)(F)F)c3)nc2c1 ZINC001242151387 1057280640 /nfs/dbraw/zinc/28/06/40/1057280640.db2.gz LPORUVMEARGZGD-UHFFFAOYSA-N -1 1 304.271 4.330 20 0 DIADMM COc1ccc2nc(-c3ccc([O-])c(C(F)(F)F)c3)ncc2c1 ZINC001242151961 1057280764 /nfs/dbraw/zinc/28/07/64/1057280764.db2.gz ZTFACLALLZDICE-UHFFFAOYSA-N -1 1 320.270 4.030 20 0 DIADMM COC(=O)c1cccc(-c2ccc([O-])c(C(F)(F)F)c2)c1F ZINC001242157581 1057283125 /nfs/dbraw/zinc/28/31/25/1057283125.db2.gz JNIFNXGBYDUPEE-UHFFFAOYSA-N -1 1 314.234 4.004 20 0 DIADMM COC(=O)c1ccc(F)cc1-c1ccc([O-])c(C(F)(F)F)c1 ZINC001242158146 1057283789 /nfs/dbraw/zinc/28/37/89/1057283789.db2.gz RLUUFYOSTZJSIP-UHFFFAOYSA-N -1 1 314.234 4.004 20 0 DIADMM [O-]c1ccc(-c2cc(OCC3CC3)ccn2)cc1C(F)(F)F ZINC001242157162 1057283912 /nfs/dbraw/zinc/28/39/12/1057283912.db2.gz CTFANJZHOHGTCH-UHFFFAOYSA-N -1 1 309.287 4.262 20 0 DIADMM CCN(CC)C(=O)c1ccc(-c2cccc(Cl)c2[O-])cc1 ZINC001242365020 1057347405 /nfs/dbraw/zinc/34/74/05/1057347405.db2.gz HIXNUFAMTZATRG-UHFFFAOYSA-N -1 1 303.789 4.195 20 0 DIADMM CC1(C)NC(=O)Nc2c(-c3cccc(Cl)c3[O-])cccc21 ZINC001242366156 1057347652 /nfs/dbraw/zinc/34/76/52/1057347652.db2.gz QHTZUHNJYSABNY-UHFFFAOYSA-N -1 1 302.761 4.083 20 0 DIADMM COC(=O)c1ccc2ncc(-c3cccc(Cl)c3[O-])cc2c1 ZINC001242365748 1057347779 /nfs/dbraw/zinc/34/77/79/1057347779.db2.gz JMSQXVGTUJPRPQ-UHFFFAOYSA-N -1 1 313.740 4.047 20 0 DIADMM CCOC(=O)CCc1ccccc1-c1cccc(Cl)c1[O-] ZINC001242365998 1057347885 /nfs/dbraw/zinc/34/78/85/1057347885.db2.gz CYBJXVKNWVYCOG-UHFFFAOYSA-N -1 1 304.773 4.208 20 0 DIADMM CC(C)(C)OC(=O)Nc1cc(-c2cccc(Cl)c2[O-])ccn1 ZINC001242366803 1057348485 /nfs/dbraw/zinc/34/84/85/1057348485.db2.gz UGOJNIQPLNXTHD-UHFFFAOYSA-N -1 1 320.776 4.455 20 0 DIADMM COC(=O)c1ccc2c(cccc2-c2cccc(Cl)c2[O-])n1 ZINC001242366421 1057349150 /nfs/dbraw/zinc/34/91/50/1057349150.db2.gz LYRFFCSENLSNQN-UHFFFAOYSA-N -1 1 313.740 4.047 20 0 DIADMM CCc1ncccc1-c1ccc([C@H](C)[N-]C(=O)C(F)(F)F)cc1 ZINC001242524384 1057394692 /nfs/dbraw/zinc/39/46/92/1057394692.db2.gz JKWPWHVCVYGTIB-NSHDSACASA-N -1 1 322.330 4.051 20 0 DIADMM CC(C)(C)OC(=O)c1ccc(-c2cccc([O-])c2Cl)nc1 ZINC001242797450 1057480131 /nfs/dbraw/zinc/48/01/31/1057480131.db2.gz IUFPVVSGNBOZOW-UHFFFAOYSA-N -1 1 305.761 4.063 20 0 DIADMM COC(=O)c1cccc2cnc(-c3cccc([O-])c3Cl)cc21 ZINC001242800019 1057480577 /nfs/dbraw/zinc/48/05/77/1057480577.db2.gz BJPLKAPMVHRTKN-UHFFFAOYSA-N -1 1 313.740 4.047 20 0 DIADMM CCOC(=O)c1ccc(-c2cccc([O-])c2Cl)c(OCC)c1 ZINC001242799409 1057480725 /nfs/dbraw/zinc/48/07/25/1057480725.db2.gz JVAWTJDZWRGXLF-UHFFFAOYSA-N -1 1 320.772 4.288 20 0 DIADMM CC(C)(C)C(=O)Nc1ccc(-c2cccc([O-])c2Cl)cn1 ZINC001242799308 1057480731 /nfs/dbraw/zinc/48/07/31/1057480731.db2.gz DRDREHARFQALEZ-UHFFFAOYSA-N -1 1 304.777 4.092 20 0 DIADMM [O-]c1cccc(-c2nccc(Oc3cccc(F)c3)n2)c1Cl ZINC001242800095 1057480914 /nfs/dbraw/zinc/48/09/14/1057480914.db2.gz CIFMDJNZWBLJPQ-UHFFFAOYSA-N -1 1 316.719 4.434 20 0 DIADMM COc1cc2nc(-c3cccc([O-])c3Cl)ccc2c(OC)c1 ZINC001242799580 1057480934 /nfs/dbraw/zinc/48/09/34/1057480934.db2.gz SJYIBYHMNNZCNB-UHFFFAOYSA-N -1 1 315.756 4.278 20 0 DIADMM [O-]c1cccc(-c2ccc3c(c2)C2(CN3)CCOCC2)c1Cl ZINC001242799902 1057480946 /nfs/dbraw/zinc/48/09/46/1057480946.db2.gz HOPQCLQBXFMGON-UHFFFAOYSA-N -1 1 315.800 4.186 20 0 DIADMM CC[C@@H](C)c1nc2[nH]ccc2c(-c2cccc([O-])c2Cl)n1 ZINC001242799622 1057480972 /nfs/dbraw/zinc/48/09/72/1057480972.db2.gz VBKIHFUFHNJCHB-SECBINFHSA-N -1 1 301.777 4.449 20 0 DIADMM Cc1nc(-c2cccnc2)nc(-c2cccc([O-])c2Cl)c1C ZINC001242800127 1057481154 /nfs/dbraw/zinc/48/11/54/1057481154.db2.gz FIPKHUKWTNBKLA-UHFFFAOYSA-N -1 1 311.772 4.181 20 0 DIADMM CCOc1ccc2ncnc(-c3cccc([O-])c3Cl)c2c1 ZINC001242800382 1057481810 /nfs/dbraw/zinc/48/18/10/1057481810.db2.gz GKULUISOFYETMU-UHFFFAOYSA-N -1 1 300.745 4.055 20 0 DIADMM COC(=O)c1ccc2c(cccc2-c2cccc([O-])c2Cl)n1 ZINC001242800749 1057481880 /nfs/dbraw/zinc/48/18/80/1057481880.db2.gz SLHLWXJKFYLPBN-UHFFFAOYSA-N -1 1 313.740 4.047 20 0 DIADMM Cc1cc(N2CCCCC2)ncc1-c1cccc([O-])c1Cl ZINC001242800937 1057481913 /nfs/dbraw/zinc/48/19/13/1057481913.db2.gz VDFASSBTGYVIRC-UHFFFAOYSA-N -1 1 302.805 4.406 20 0 DIADMM Cc1nc(-c2ccccn2)nc(-c2cccc([O-])c2Cl)c1C ZINC001242801381 1057481964 /nfs/dbraw/zinc/48/19/64/1057481964.db2.gz POUXRJLNAUXVCR-UHFFFAOYSA-N -1 1 311.772 4.181 20 0 DIADMM [O-]c1cccc(-c2cccc(OCC(F)(F)F)n2)c1Cl ZINC001242800591 1057482101 /nfs/dbraw/zinc/48/21/01/1057482101.db2.gz JRGIKPBXENUGCW-UHFFFAOYSA-N -1 1 303.667 4.049 20 0 DIADMM Cc1c(NC(=O)C(C)(C)C)ccnc1-c1cccc([O-])c1Cl ZINC001242800195 1057482325 /nfs/dbraw/zinc/48/23/25/1057482325.db2.gz FDFXHYMSHHZCHK-UHFFFAOYSA-N -1 1 318.804 4.401 20 0 DIADMM CC(C)C(=O)NCCc1ccc(-c2cccc([O-])c2Cl)cc1 ZINC001242801579 1057482388 /nfs/dbraw/zinc/48/23/88/1057482388.db2.gz AVSSWWGMDYFDIW-UHFFFAOYSA-N -1 1 317.816 4.027 20 0 DIADMM COC(=O)c1cc(-c2cccc([O-])c2Cl)c2cc[nH]c2c1C ZINC001242803172 1057482972 /nfs/dbraw/zinc/48/29/72/1057482972.db2.gz NIKMLPOUIIPRPT-UHFFFAOYSA-N -1 1 315.756 4.289 20 0 DIADMM CCOC(=O)c1c(F)cc(F)cc1-c1cccc([O-])c1Cl ZINC001242803107 1057483029 /nfs/dbraw/zinc/48/30/29/1057483029.db2.gz MBJAMCBMISOFKP-UHFFFAOYSA-N -1 1 312.699 4.168 20 0 DIADMM CC1(C)Cc2cccc(-c3cccc([O-])c3Cl)c2NC1=O ZINC001242802709 1057483392 /nfs/dbraw/zinc/48/33/92/1057483392.db2.gz GHCCUFZFZBNPAX-UHFFFAOYSA-N -1 1 301.773 4.233 20 0 DIADMM O=C(Nc1ccccn1)c1ccc(-c2cccc([O-])c2Cl)cc1 ZINC001242803236 1057483439 /nfs/dbraw/zinc/48/34/39/1057483439.db2.gz WSEHXDSSJLTQAI-UHFFFAOYSA-N -1 1 324.767 4.360 20 0 DIADMM CC1(C)Cc2cc(-c3cccc([O-])c3Cl)ccc2NC1=O ZINC001242803173 1057483449 /nfs/dbraw/zinc/48/34/49/1057483449.db2.gz NJIWGTGNCUBPQO-UHFFFAOYSA-N -1 1 301.773 4.233 20 0 DIADMM Cc1ccc(-c2csc3[n-]c([C@@H]4CCCO4)nc(=O)c23)s1 ZINC000676559069 1057483710 /nfs/dbraw/zinc/48/37/10/1057483710.db2.gz XXXSLBAAHYMMJE-JTQLQIEISA-N -1 1 318.423 4.285 20 0 DIADMM [O-]c1cc(-c2ncccc2OCc2ccccc2F)ccc1F ZINC001243051668 1057558822 /nfs/dbraw/zinc/55/88/22/1057558822.db2.gz XBCMPWKYICTLTN-UHFFFAOYSA-N -1 1 313.303 4.311 20 0 DIADMM [O-]c1cc(-c2nccc(-c3c[nH]c4ccccc43)n2)ccc1F ZINC001243054397 1057559484 /nfs/dbraw/zinc/55/94/84/1057559484.db2.gz OYAJUDWTTRLBPH-UHFFFAOYSA-N -1 1 305.312 4.137 20 0 DIADMM [O-]c1cc(-c2nc3ccccc3nc2C(F)(F)F)ccc1F ZINC001243054753 1057559584 /nfs/dbraw/zinc/55/95/84/1057559584.db2.gz RFIIKBVYDLMDGT-UHFFFAOYSA-N -1 1 308.234 4.160 20 0 DIADMM COC(=O)c1cc2c(cccc2-c2ccc([O-])c(F)c2F)s1 ZINC001243342115 1057652684 /nfs/dbraw/zinc/65/26/84/1057652684.db2.gz IYAPOOZPBBUMAT-UHFFFAOYSA-N -1 1 320.316 4.339 20 0 DIADMM COc1cc(OC(F)(F)F)ccc1-c1ccc([O-])c(F)c1F ZINC001243341586 1057653183 /nfs/dbraw/zinc/65/31/83/1057653183.db2.gz VDLWBEIFAPQNBF-UHFFFAOYSA-N -1 1 320.213 4.245 20 0 DIADMM CC(C)(C)OC(=O)Cc1ccc(-c2ccc([O-])c(F)c2F)cc1 ZINC001243341886 1057653424 /nfs/dbraw/zinc/65/34/24/1057653424.db2.gz ZNYQEFWTBMASNZ-UHFFFAOYSA-N -1 1 320.335 4.222 20 0 DIADMM CC(C)(C)OC(=O)c1cccc(-c2ccc([O-])c(F)c2F)c1 ZINC001243343136 1057653646 /nfs/dbraw/zinc/65/36/46/1057653646.db2.gz XEYMOGAOLIBCRE-UHFFFAOYSA-N -1 1 306.308 4.293 20 0 DIADMM COc1cc2c(cc1C)nccc2-c1ccc([O-])c(F)c1F ZINC001243345012 1057653670 /nfs/dbraw/zinc/65/36/70/1057653670.db2.gz NJBYZFIJCXQFRL-UHFFFAOYSA-N -1 1 301.292 4.203 20 0 DIADMM CC(C)Oc1c(F)c(F)ccc1-c1ccc([O-])c(F)c1F ZINC001243344195 1057654042 /nfs/dbraw/zinc/65/40/42/1057654042.db2.gz ZMCKDRGUTWMJSG-UHFFFAOYSA-N -1 1 300.251 4.403 20 0 DIADMM CCCOc1c(F)cc(-c2cc(F)cc(F)c2[O-])cc1F ZINC001243504031 1057696672 /nfs/dbraw/zinc/69/66/72/1057696672.db2.gz MBTXLYJGWAGKEC-UHFFFAOYSA-N -1 1 300.251 4.404 20 0 DIADMM CCOC(OCC)c1ccccc1-c1cc(F)cc(F)c1[O-] ZINC001243503162 1057697069 /nfs/dbraw/zinc/69/70/69/1057697069.db2.gz BYPQLYFTBPLJAG-UHFFFAOYSA-N -1 1 308.324 4.409 20 0 DIADMM COC(=O)c1ccc(-c2cc(F)cc(F)c2[O-])c2ccccc12 ZINC001243503278 1057697330 /nfs/dbraw/zinc/69/73/30/1057697330.db2.gz FRXNFDDTNJQVPB-UHFFFAOYSA-N -1 1 314.287 4.277 20 0 DIADMM COC(=O)[C@@H](c1ccc(-c2cc(F)cc(F)c2[O-])cc1)C(C)C ZINC001243504980 1057697598 /nfs/dbraw/zinc/69/75/98/1057697598.db2.gz COIQCXJGRSGFJF-MRXNPFEDSA-N -1 1 320.335 4.250 20 0 DIADMM CCOc1ccc2cc(-c3cc(F)cc(F)c3[O-])cnc2c1 ZINC001243506082 1057697726 /nfs/dbraw/zinc/69/77/26/1057697726.db2.gz PEIGKVKCPSMHII-UHFFFAOYSA-N -1 1 301.292 4.284 20 0 DIADMM [O-]c1c(F)cc(F)cc1-c1cc(F)cc(N2CCCCC2)c1 ZINC001243507057 1057698390 /nfs/dbraw/zinc/69/83/90/1057698390.db2.gz RPDNODOOZBFNNW-UHFFFAOYSA-N -1 1 307.315 4.467 20 0 DIADMM CCOc1ccc2ncnc(-c3ccc(Cl)c([O-])c3)c2c1 ZINC001243575971 1057720809 /nfs/dbraw/zinc/72/08/09/1057720809.db2.gz BKXQVDINILVDKI-UHFFFAOYSA-N -1 1 300.745 4.055 20 0 DIADMM CSc1nc2c(c(-c3ccc(Cl)c([O-])c3)n1)CCCC2 ZINC001243576639 1057720993 /nfs/dbraw/zinc/72/09/93/1057720993.db2.gz RFKWVJDULKNUHK-UHFFFAOYSA-N -1 1 306.818 4.103 20 0 DIADMM [O-]c1cc(-c2ncncc2OCc2ccccc2)ccc1Cl ZINC001243576389 1057721001 /nfs/dbraw/zinc/72/10/01/1057721001.db2.gz NAFGUQHCYCOFCO-UHFFFAOYSA-N -1 1 312.756 4.082 20 0 DIADMM COC(=O)c1ccc2ccnc(-c3ccc(Cl)c([O-])c3)c2c1 ZINC001243577287 1057721886 /nfs/dbraw/zinc/72/18/86/1057721886.db2.gz WKLUCGXQTHCLSN-UHFFFAOYSA-N -1 1 313.740 4.047 20 0 DIADMM COc1cc2cnc(-c3ccc(Cl)c([O-])c3)cc2cc1F ZINC001243579081 1057722197 /nfs/dbraw/zinc/72/21/97/1057722197.db2.gz NUJWSXQAYJFZCX-UHFFFAOYSA-N -1 1 303.720 4.409 20 0 DIADMM Cc1c(NC(=O)C(C)(C)C)ccnc1-c1ccc(Cl)c([O-])c1 ZINC001243579256 1057722600 /nfs/dbraw/zinc/72/26/00/1057722600.db2.gz QQMBYBXVTXDETE-UHFFFAOYSA-N -1 1 318.804 4.401 20 0 DIADMM CC(C)(C)OC(=O)c1cccc(-c2ccc(Cl)c([O-])c2)n1 ZINC001243579828 1057722677 /nfs/dbraw/zinc/72/26/77/1057722677.db2.gz ZIYPUZFUDHAEMU-UHFFFAOYSA-N -1 1 305.761 4.063 20 0 DIADMM CC(C)(C)OC(=O)c1ccc(-c2ccc(Cl)c([O-])c2)cn1 ZINC001243581705 1057723414 /nfs/dbraw/zinc/72/34/14/1057723414.db2.gz RVNRJPDIMLCLMJ-UHFFFAOYSA-N -1 1 305.761 4.063 20 0 DIADMM COC(=O)c1cc2cc(-c3ccc(Cl)c([O-])c3)c(F)cc2[nH]1 ZINC001243581100 1057723427 /nfs/dbraw/zinc/72/34/27/1057723427.db2.gz BRGIVPVWCUDTBS-UHFFFAOYSA-N -1 1 319.719 4.120 20 0 DIADMM [O-]c1cc(-c2ccnc(OCc3cccnc3)c2)ccc1Cl ZINC001243581937 1057723482 /nfs/dbraw/zinc/72/34/82/1057723482.db2.gz NRAFDJPRQWNAIV-UHFFFAOYSA-N -1 1 312.756 4.082 20 0 DIADMM [O-]c1cc(-c2ccc(C3N=NC(=S)O3)cc2)ccc1Cl ZINC001243584183 1057724755 /nfs/dbraw/zinc/72/47/55/1057724755.db2.gz SFMRHCLAPAZABE-UHFFFAOYSA-N -1 1 304.758 4.051 20 0 DIADMM Cc1nc2sccc2c(-c2ccc(C(F)(F)F)cc2[O-])n1 ZINC001243604590 1057730388 /nfs/dbraw/zinc/73/03/88/1057730388.db2.gz MRPJOTQISVUEHE-UHFFFAOYSA-N -1 1 310.300 4.391 20 0 DIADMM Cc1cccc2ncnc(-c3ccc(C(F)(F)F)cc3[O-])c12 ZINC001243607250 1057730925 /nfs/dbraw/zinc/73/09/25/1057730925.db2.gz OWTZLXIAZAZUTI-UHFFFAOYSA-N -1 1 304.271 4.330 20 0 DIADMM [O-]c1cc(C(F)(F)F)ccc1-c1cc(OCC2CC2)ccn1 ZINC001243610305 1057732207 /nfs/dbraw/zinc/73/22/07/1057732207.db2.gz GBEPBWPWDZXVAY-UHFFFAOYSA-N -1 1 309.287 4.262 20 0 DIADMM O=C(Nc1ccc([O-])c(Cl)c1)c1cccc(-n2cccc2)c1 ZINC000732306673 1057772321 /nfs/dbraw/zinc/77/23/21/1057772321.db2.gz MVCBUZVVHJSSEL-UHFFFAOYSA-N -1 1 312.756 4.089 20 0 DIADMM O=C(Nc1ccnn1C1CCCC1)c1ccc2ccccc2c1[O-] ZINC000733310595 1057811825 /nfs/dbraw/zinc/81/18/25/1057811825.db2.gz HULVUCSTYGDESS-UHFFFAOYSA-N -1 1 321.380 4.109 20 0 DIADMM CC(C)(C)OC(=O)Nc1cccc(-c2c([O-])cccc2Cl)n1 ZINC001244050074 1057849554 /nfs/dbraw/zinc/84/95/54/1057849554.db2.gz JVLPNGGQRPCRLM-UHFFFAOYSA-N -1 1 320.776 4.455 20 0 DIADMM [O-]c1c(F)cc(-c2cc3c4c(c2)CCCN4CCC3)cc1F ZINC001244095947 1057867423 /nfs/dbraw/zinc/86/74/23/1057867423.db2.gz DYJJNQCXBFUSGT-UHFFFAOYSA-N -1 1 301.336 4.036 20 0 DIADMM COc1cc2c(cc1C)nccc2-c1cc(F)c([O-])c(F)c1 ZINC001244098434 1057868400 /nfs/dbraw/zinc/86/84/00/1057868400.db2.gz IXWDSAFBWBRXCV-UHFFFAOYSA-N -1 1 301.292 4.203 20 0 DIADMM CCCOc1c(F)cc(-c2cc(F)c([O-])c(F)c2)cc1F ZINC001244097489 1057868583 /nfs/dbraw/zinc/86/85/83/1057868583.db2.gz VYGONZOMICQQJB-UHFFFAOYSA-N -1 1 300.251 4.404 20 0 DIADMM CCOC(=O)c1nc2ccc(-c3cc(C)cc(C)c3OC)cc2[n-]1 ZINC001244118436 1057875022 /nfs/dbraw/zinc/87/50/22/1057875022.db2.gz CVDLBMRDOXREEM-UHFFFAOYSA-N -1 1 324.380 4.032 20 0 DIADMM CCOC(=O)c1nc2cc(-c3cc(C)cc(C)c3OC)ccc2[n-]1 ZINC001244118436 1057875027 /nfs/dbraw/zinc/87/50/27/1057875027.db2.gz CVDLBMRDOXREEM-UHFFFAOYSA-N -1 1 324.380 4.032 20 0 DIADMM COC(=O)c1nc2ccc(-c3ccc(C4CC4)cc3F)cc2[n-]1 ZINC001244125946 1057878416 /nfs/dbraw/zinc/87/84/16/1057878416.db2.gz WISXGJMCADDROU-UHFFFAOYSA-N -1 1 310.328 4.033 20 0 DIADMM COC(=O)c1nc2cc(-c3ccc(C4CC4)cc3F)ccc2[n-]1 ZINC001244125946 1057878424 /nfs/dbraw/zinc/87/84/24/1057878424.db2.gz WISXGJMCADDROU-UHFFFAOYSA-N -1 1 310.328 4.033 20 0 DIADMM Cc1cncc(-c2ccc([C@H](C)[N-]C(=O)C(F)(F)F)cc2)c1C ZINC001244154793 1057888211 /nfs/dbraw/zinc/88/82/11/1057888211.db2.gz BEDPSXQCMUDNLL-LBPRGKRZSA-N -1 1 322.330 4.105 20 0 DIADMM CSc1ccnc(-c2cc(OC(F)(F)F)ccc2[O-])c1F ZINC001244455968 1057963081 /nfs/dbraw/zinc/96/30/81/1057963081.db2.gz ALQCQECXJXFMPE-UHFFFAOYSA-N -1 1 319.279 4.214 20 0 DIADMM Cc1nnc(-c2ccc(OC(F)(F)F)cc2[O-])c2ccccc12 ZINC001244461703 1057964906 /nfs/dbraw/zinc/96/49/06/1057964906.db2.gz BKJSYYGQTPHYJE-UHFFFAOYSA-N -1 1 320.270 4.209 20 0 DIADMM [O-]c1cc(OC(F)(F)F)ccc1-c1ncnc2cccc(F)c21 ZINC001244464488 1057966419 /nfs/dbraw/zinc/96/64/19/1057966419.db2.gz NZQPCNUIAGBRMO-UHFFFAOYSA-N -1 1 324.233 4.040 20 0 DIADMM Cc1cc(-c2ncnc3[nH]c4ccccc4c32)cc(Cl)c1[O-] ZINC001244531368 1057987231 /nfs/dbraw/zinc/98/72/31/1057987231.db2.gz IZZLIZNWQGKXNT-UHFFFAOYSA-N -1 1 309.756 4.446 20 0 DIADMM COc1ccc2nc(-c3cc(C)c([O-])c(Cl)c3)nc(C)c2c1 ZINC001244530774 1057987237 /nfs/dbraw/zinc/98/72/37/1057987237.db2.gz AEHGPIRVWMGMLR-UHFFFAOYSA-N -1 1 314.772 4.281 20 0 DIADMM CCOc1ccc2ncnc(-c3cc(C)c([O-])c(Cl)c3)c2c1 ZINC001244532572 1057987241 /nfs/dbraw/zinc/98/72/41/1057987241.db2.gz VTPIHPZUHCQCNT-UHFFFAOYSA-N -1 1 314.772 4.363 20 0 DIADMM Cc1cc(-c2nc(C(F)(F)F)nc(C)c2C)cc(Cl)c1[O-] ZINC001244530824 1057987332 /nfs/dbraw/zinc/98/73/32/1057987332.db2.gz AMECQUBJHNHJAB-UHFFFAOYSA-N -1 1 316.710 4.447 20 0 DIADMM Cc1cc(-c2ccc(OC(F)(F)F)cn2)cc(Cl)c1[O-] ZINC001244530211 1057987527 /nfs/dbraw/zinc/98/75/27/1057987527.db2.gz JRWWYTNZQKUZHB-UHFFFAOYSA-N -1 1 303.667 4.315 20 0 DIADMM Cc1cc(-c2nc3ccccc3c(N(C)C)n2)cc(Cl)c1[O-] ZINC001244537034 1057989278 /nfs/dbraw/zinc/98/92/78/1057989278.db2.gz SMVWIBFTCJLNNP-UHFFFAOYSA-N -1 1 313.788 4.030 20 0 DIADMM [O-]c1ccc(Cl)c(-c2cc(-c3ccccc3)cnn2)c1F ZINC001244537280 1057989350 /nfs/dbraw/zinc/98/93/50/1057989350.db2.gz AIOVEHRZDBDVCI-UHFFFAOYSA-N -1 1 300.720 4.309 20 0 DIADMM COc1cccc2nc(-c3c(Cl)ccc([O-])c3F)ccc21 ZINC001244539408 1057989818 /nfs/dbraw/zinc/98/98/18/1057989818.db2.gz UNXWXECLVJHIDE-UHFFFAOYSA-N -1 1 303.720 4.409 20 0 DIADMM COc1ccc2nc(-c3cc(C)c([O-])c(Cl)c3)c(C)nc2c1 ZINC001244538569 1057989962 /nfs/dbraw/zinc/98/99/62/1057989962.db2.gz MUNHMAUKHBGKEW-UHFFFAOYSA-N -1 1 314.772 4.281 20 0 DIADMM COc1ccc2c(ccnc2-c2c(Cl)ccc([O-])c2F)c1 ZINC001244538958 1057989988 /nfs/dbraw/zinc/98/99/88/1057989988.db2.gz SGECARLDIWHRDW-UHFFFAOYSA-N -1 1 303.720 4.409 20 0 DIADMM COc1ccc2cc(-c3c(Cl)ccc([O-])c3F)ncc2c1 ZINC001244538701 1057990001 /nfs/dbraw/zinc/99/00/01/1057990001.db2.gz ODZFKPAUYPTFOW-UHFFFAOYSA-N -1 1 303.720 4.409 20 0 DIADMM [O-]c1ccc(Cl)c(-c2cncc(OCC3CCCC3)n2)c1F ZINC001244539889 1057990460 /nfs/dbraw/zinc/99/04/60/1057990460.db2.gz MGTYVRFJFXNAQO-UHFFFAOYSA-N -1 1 322.767 4.211 20 0 DIADMM Cc1cc(-c2ccnc(Cc3ccccc3)n2)cc(Cl)c1[O-] ZINC001244539602 1057990471 /nfs/dbraw/zinc/99/04/71/1057990471.db2.gz YRVYHYCLIDJNAJ-UHFFFAOYSA-N -1 1 310.784 4.402 20 0 DIADMM [O-]c1ccc(Cl)c(-c2cc(OC(F)(F)F)ccn2)c1F ZINC001244539732 1057990481 /nfs/dbraw/zinc/99/04/81/1057990481.db2.gz FMEUJQPTKPQRBL-UHFFFAOYSA-N -1 1 307.630 4.145 20 0 DIADMM CSc1cc(-c2c(Cl)ccc([O-])c2F)nc(SC)n1 ZINC001244539686 1057990510 /nfs/dbraw/zinc/99/05/10/1057990510.db2.gz CGHCOPNPJFYXKW-UHFFFAOYSA-N -1 1 316.810 4.086 20 0 DIADMM CC1(C)Cc2cccc(-c3c(Cl)ccc([O-])c3F)c2NC1=O ZINC001244540677 1057990560 /nfs/dbraw/zinc/99/05/60/1057990560.db2.gz GINNAWLBDQSVFZ-UHFFFAOYSA-N -1 1 319.763 4.373 20 0 DIADMM [O-]c1ccc(Cl)c(-c2cncc(Oc3ccccc3)n2)c1F ZINC001244539428 1057990567 /nfs/dbraw/zinc/99/05/67/1057990567.db2.gz VFHCJLTUVKPIBV-UHFFFAOYSA-N -1 1 316.719 4.434 20 0 DIADMM Cc1cc(-c2c(Cl)ccc([O-])c2F)nc(-c2ccncc2)n1 ZINC001244540372 1057990683 /nfs/dbraw/zinc/99/06/83/1057990683.db2.gz MINKAJJCNKGDGT-UHFFFAOYSA-N -1 1 315.735 4.012 20 0 DIADMM Cc1cc(-c2cc(OC(F)(F)F)ccn2)cc(Cl)c1[O-] ZINC001244539521 1057990977 /nfs/dbraw/zinc/99/09/77/1057990977.db2.gz UVRPINAOMQQIGX-UHFFFAOYSA-N -1 1 303.667 4.315 20 0 DIADMM CC(C)(C)C(=O)Nc1cccnc1-c1c(Cl)ccc([O-])c1F ZINC001244540907 1057991606 /nfs/dbraw/zinc/99/16/06/1057991606.db2.gz ILYUQJDASASPQB-UHFFFAOYSA-N -1 1 322.767 4.231 20 0 DIADMM C=C(C(=O)OCC)c1ccc(-c2c(Cl)ccc([O-])c2F)cc1 ZINC001244541967 1057991627 /nfs/dbraw/zinc/99/16/27/1057991627.db2.gz IFINYXNNOCXPOD-UHFFFAOYSA-N -1 1 320.747 4.428 20 0 DIADMM COc1cc(-c2c(Cl)ccc([O-])c2F)cc2ncccc21 ZINC001244541362 1057991642 /nfs/dbraw/zinc/99/16/42/1057991642.db2.gz BURVCNFGJPKINM-UHFFFAOYSA-N -1 1 303.720 4.409 20 0 DIADMM Cc1cc(-c2c(Cl)ccc([O-])c2F)cc(OC(F)F)n1 ZINC001244543701 1057992114 /nfs/dbraw/zinc/99/21/14/1057992114.db2.gz YUCFQBKPXNZIEF-UHFFFAOYSA-N -1 1 303.667 4.157 20 0 DIADMM COc1cc(F)c(-c2c(Cl)ccc([O-])c2F)cc1OC ZINC001244543582 1057992351 /nfs/dbraw/zinc/99/23/51/1057992351.db2.gz UWVIJSWKLRRLEZ-UHFFFAOYSA-N -1 1 300.688 4.008 20 0 DIADMM CCOc1ccc2ncnc(-c3cc(Cl)ccc3[O-])c2c1 ZINC001245048236 1058101834 /nfs/dbraw/zinc/10/18/34/1058101834.db2.gz HLOVHSQEYBOACR-UHFFFAOYSA-N -1 1 300.745 4.055 20 0 DIADMM O=C(NC1(c2ccc(F)cc2)CC1)c1ccc2ccccc2c1[O-] ZINC001545304765 1058192848 /nfs/dbraw/zinc/19/28/48/1058192848.db2.gz QYMBHPFZNSCBHA-UHFFFAOYSA-N -1 1 321.351 4.104 20 0 DIADMM COc1cc(C(F)(F)F)cc(-c2c(F)ccc([O-])c2Cl)n1 ZINC001245826217 1058522382 /nfs/dbraw/zinc/52/23/82/1058522382.db2.gz GVRVMDLLOFEWLM-UHFFFAOYSA-N -1 1 321.657 4.274 20 0 DIADMM [O-]c1ccc(F)c(-c2cncc(-c3ccccc3)n2)c1Cl ZINC001245827547 1058522586 /nfs/dbraw/zinc/52/25/86/1058522586.db2.gz MUOLWXUNYUCPTC-UHFFFAOYSA-N -1 1 300.720 4.309 20 0 DIADMM COC(=O)CCCc1ccc(-c2c(F)ccc([O-])c2Cl)cc1 ZINC001245831090 1058527184 /nfs/dbraw/zinc/52/71/84/1058527184.db2.gz CSXDAKDBTBXROH-UHFFFAOYSA-N -1 1 322.763 4.347 20 0 DIADMM COc1ccc2nc(C)nc(-c3c(F)ccc([O-])c3Cl)c2c1 ZINC001245830544 1058527794 /nfs/dbraw/zinc/52/77/94/1058527794.db2.gz QBPNMARZKPRVIJ-UHFFFAOYSA-N -1 1 318.735 4.112 20 0 DIADMM Cc1nc(C(F)(F)F)nc(-c2c(F)ccc([O-])c2Cl)c1C ZINC001245830029 1058529443 /nfs/dbraw/zinc/52/94/43/1058529443.db2.gz GKQIZGFOWDWEKP-UHFFFAOYSA-N -1 1 320.673 4.277 20 0 DIADMM COC(=O)c1cc(-c2c(F)ccc([O-])c2Cl)cc2cc[nH]c21 ZINC001245831024 1058529801 /nfs/dbraw/zinc/52/98/01/1058529801.db2.gz GDTDBGCWYSZCAP-UHFFFAOYSA-N -1 1 319.719 4.120 20 0 DIADMM [O-]c1ccc(F)c(-c2cncc(-c3cccs3)n2)c1Cl ZINC001245831616 1058531235 /nfs/dbraw/zinc/53/12/35/1058531235.db2.gz BOZRDGOECJAGKH-UHFFFAOYSA-N -1 1 306.749 4.370 20 0 DIADMM [O-]c1ccc(F)c(-c2ccnc(-c3ccccn3)c2)c1Cl ZINC001245831966 1058532000 /nfs/dbraw/zinc/53/20/00/1058532000.db2.gz QWSINPGMKAVUED-UHFFFAOYSA-N -1 1 300.720 4.309 20 0 DIADMM CCc1cc(NC(C)=O)cc(-c2c(F)ccc([O-])c2Cl)c1 ZINC001245832229 1058532288 /nfs/dbraw/zinc/53/22/88/1058532288.db2.gz OKPXNHBQSYQEKV-UHFFFAOYSA-N -1 1 307.752 4.373 20 0 DIADMM CCc1ccc([C@@H](C)NC(=O)c2ccc(Cl)cc2[O-])cc1 ZINC001556059974 1058534966 /nfs/dbraw/zinc/53/49/66/1058534966.db2.gz QVBZHQRPDGEVHJ-LLVKDONJSA-N -1 1 303.789 4.099 20 0 DIADMM COC(=O)C1(c2ccc(-c3c(F)ccc([O-])c3Cl)cc2)CC1 ZINC001245832740 1058535939 /nfs/dbraw/zinc/53/59/39/1058535939.db2.gz UFVZQPCUQCCKTK-UHFFFAOYSA-N -1 1 320.747 4.056 20 0 DIADMM COC(=O)c1cc2cc[nH]c2c(-c2c(F)ccc([O-])c2Cl)c1 ZINC001245832727 1058537553 /nfs/dbraw/zinc/53/75/53/1058537553.db2.gz TVCLUUXAYPHNAL-UHFFFAOYSA-N -1 1 319.719 4.120 20 0 DIADMM COC(=O)c1cc(C)c(-c2c(F)ccc([O-])c2Cl)cc1C ZINC001245835017 1058539030 /nfs/dbraw/zinc/53/90/30/1058539030.db2.gz LJFALGPIJVAAPL-UHFFFAOYSA-N -1 1 308.736 4.255 20 0 DIADMM COC(=O)c1ccc(C)c(-c2c(F)ccc([O-])c2Cl)c1C ZINC001245835112 1058540885 /nfs/dbraw/zinc/54/08/85/1058540885.db2.gz PUSIAGIYEPHNES-UHFFFAOYSA-N -1 1 308.736 4.255 20 0 DIADMM O=C(c1ccc(-c2c(F)ccc([O-])c2Cl)cc1)N1CCCC1 ZINC001245836224 1058543699 /nfs/dbraw/zinc/54/36/99/1058543699.db2.gz YTZCEUYKIDCCKH-UHFFFAOYSA-N -1 1 319.763 4.088 20 0 DIADMM C[C@H]1CCC[C@H](NC(=O)c2ccc(C(F)(F)F)c([O-])c2)CC1 ZINC001556236007 1058566984 /nfs/dbraw/zinc/56/69/84/1058566984.db2.gz TZGZAVSJIVUQOY-JQWIXIFHSA-N -1 1 315.335 4.110 20 0 DIADMM Cc1cccc(C)c1C(=O)Nc1cccc([O-])c1Br ZINC001556696603 1058629902 /nfs/dbraw/zinc/62/99/02/1058629902.db2.gz UQJVPVZVDSWJFF-UHFFFAOYSA-N -1 1 320.186 4.024 20 0 DIADMM O=C(/C=C/c1ccc(Cl)s1)Nc1cc([O-])c(F)cc1F ZINC001556920278 1058670214 /nfs/dbraw/zinc/67/02/14/1058670214.db2.gz KVDCOBBLOAZJTO-DUXPYHPUSA-N -1 1 315.728 4.037 20 0 DIADMM CN(C(=O)c1ccc(Cl)cc1[O-])[C@@H]1CCC[C@@H]1C(C)(C)C ZINC001557080329 1058695991 /nfs/dbraw/zinc/69/59/91/1058695991.db2.gz AVHZLTLEEAIUMD-UONOGXRCSA-N -1 1 309.837 4.332 20 0 DIADMM CC(C)[C@H](C(=O)Nc1cc(F)cc(F)c1[O-])c1ccc(F)cc1 ZINC001557086774 1058697749 /nfs/dbraw/zinc/69/77/49/1058697749.db2.gz FGBWKWPJQSTHSD-HNNXBMFYSA-N -1 1 323.314 4.188 20 0 DIADMM Cc1ccc(C(=O)Nc2cc(F)cc(F)c2[O-])c2ccccc12 ZINC001557086948 1058698656 /nfs/dbraw/zinc/69/86/56/1058698656.db2.gz MXWVSENKUCZBOT-UHFFFAOYSA-N -1 1 313.303 4.384 20 0 DIADMM O=C(Nc1c([O-])cccc1F)c1cc(Cl)cc(Cl)c1F ZINC001557409382 1058747059 /nfs/dbraw/zinc/74/70/59/1058747059.db2.gz KBZWKDBFCSMNTB-UHFFFAOYSA-N -1 1 318.106 4.230 20 0 DIADMM C[C@H]1c2ccccc2C[C@H]1NC(=O)c1ccc2ccccc2c1[O-] ZINC001557415222 1058748069 /nfs/dbraw/zinc/74/80/69/1058748069.db2.gz NHJCCFGJRVEDSW-ORAYPTAESA-N -1 1 317.388 4.004 20 0 DIADMM C[C@H](NC(=O)c1cc2ccccc2cc1[O-])[C@@]12C[C@@H]1CCCC2 ZINC001557928196 1058813657 /nfs/dbraw/zinc/81/36/57/1058813657.db2.gz ZXDPICXZEATCBH-ZSOFBXJNSA-N -1 1 309.409 4.244 20 0 DIADMM CC[C@@H](Sc1ccccc1)C(=O)Nc1cccc(F)c1[O-] ZINC001557958012 1058818936 /nfs/dbraw/zinc/81/89/36/1058818936.db2.gz YQUAPHHYSIBMCC-CQSZACIVSA-N -1 1 305.374 4.041 20 0 DIADMM Cc1cc(NC(=O)c2ccc3ccccc3c2[O-])cc(O)c1C ZINC001558138916 1058842987 /nfs/dbraw/zinc/84/29/87/1058842987.db2.gz FXEWOPZDXZWOSN-UHFFFAOYSA-N -1 1 307.349 4.120 20 0 DIADMM Cc1cccc(CCC(=O)Nc2cc(F)c([O-])cc2Cl)c1 ZINC001558643976 1058894945 /nfs/dbraw/zinc/89/49/45/1058894945.db2.gz PNMSXQSMTUGBQB-UHFFFAOYSA-N -1 1 307.752 4.064 20 0 DIADMM CC[C@@H](C(=O)Nc1cc(F)c([O-])cc1Cl)c1ccccc1 ZINC001558643730 1058895770 /nfs/dbraw/zinc/89/57/70/1058895770.db2.gz FHGDMVCIHBARSO-LLVKDONJSA-N -1 1 307.752 4.317 20 0 DIADMM CCCCCN(C(=O)NCc1ccc([O-])c(Cl)c1)C(C)C ZINC001248410896 1059819508 /nfs/dbraw/zinc/81/95/08/1059819508.db2.gz IPCZYOBIQPLBPB-UHFFFAOYSA-N -1 1 312.841 4.156 20 0 DIADMM CC(C)[C@H]1CCCN(C(=O)NCc2ccc([O-])c(Cl)c2)CC1 ZINC001248410741 1059820464 /nfs/dbraw/zinc/82/04/64/1059820464.db2.gz GSZKHRRNJFGRCE-AWEZNQCLSA-N -1 1 324.852 4.013 20 0 DIADMM CCc1cccc(C)c1NC(=S)Nc1cc(F)c(F)cc1[O-] ZINC001249564538 1060294633 /nfs/dbraw/zinc/29/46/33/1060294633.db2.gz PPEBWEDPYAJEIZ-UHFFFAOYSA-N -1 1 322.380 4.350 20 0 DIADMM CC(C)N(Cc1ccccc1)Cc1ccc(F)c(C(=O)[O-])c1F ZINC001249758873 1060386430 /nfs/dbraw/zinc/38/64/30/1060386430.db2.gz FWVGRAPISGOFLQ-UHFFFAOYSA-N -1 1 319.351 4.074 20 0 DIADMM CC[C@H](c1ccccc1)N(C)Cc1ccc(F)c(C(=O)[O-])c1F ZINC001249777801 1060396505 /nfs/dbraw/zinc/39/65/05/1060396505.db2.gz ZBBXXVYPVRCQDK-OAHLLOKOSA-N -1 1 319.351 4.246 20 0 DIADMM COc1ccc2[nH]c(Nc3cc([O-])c(Cl)cc3F)cc2c1 ZINC001249886512 1060447135 /nfs/dbraw/zinc/44/71/35/1060447135.db2.gz VOWPMSVNBZFMEG-UHFFFAOYSA-N -1 1 306.724 4.418 20 0 DIADMM CN1Cc2c(cccc2Nc2ccc(Cl)c(Cl)c2[O-])C1=O ZINC001249944377 1060496263 /nfs/dbraw/zinc/49/62/63/1060496263.db2.gz QSNGGYWLBODTJP-UHFFFAOYSA-N -1 1 323.179 4.028 20 0 DIADMM [O-]c1cc(Nc2cc(Cl)cc(Cl)n2)c(F)c(F)c1F ZINC001249957508 1060501206 /nfs/dbraw/zinc/50/12/06/1060501206.db2.gz BIVAWSSHAWUDCD-UHFFFAOYSA-N -1 1 309.074 4.255 20 0 DIADMM Cc1ccc2nc(Nc3cc([O-])c(F)c(F)c3F)ccc2c1 ZINC001249958509 1060503546 /nfs/dbraw/zinc/50/35/46/1060503546.db2.gz OVJQMZGRNRAQJL-UHFFFAOYSA-N -1 1 304.271 4.410 20 0 DIADMM [O-]c1cc(Nc2cc(-c3cccs3)no2)c(F)c(F)c1F ZINC001249960488 1060505026 /nfs/dbraw/zinc/50/50/26/1060505026.db2.gz KGWYGUFMKODWIR-UHFFFAOYSA-N -1 1 312.272 4.270 20 0 DIADMM Nc1cc(Nc2cc([O-])c(F)c(F)c2F)cc(C(F)(F)F)c1 ZINC001249962107 1060505422 /nfs/dbraw/zinc/50/54/22/1060505422.db2.gz GOAAULPVADCUAF-UHFFFAOYSA-N -1 1 322.208 4.154 20 0 DIADMM [O-]c1cc(Nc2ccc(OC(F)(F)F)cc2)c(F)c(F)c1F ZINC001249962686 1060507561 /nfs/dbraw/zinc/50/75/61/1060507561.db2.gz MISJAPARADFGRH-UHFFFAOYSA-N -1 1 323.192 4.452 20 0 DIADMM CC1(C)Oc2ccc(Nc3cc([O-])c(F)c(F)c3F)cc2O1 ZINC001249962169 1060508555 /nfs/dbraw/zinc/50/85/55/1060508555.db2.gz HWYVGYKAXSCENW-UHFFFAOYSA-N -1 1 311.259 4.060 20 0 DIADMM [O-]c1cc(Nc2ccc(N3CCCC3)cc2)c(F)c(F)c1F ZINC001249963265 1060508992 /nfs/dbraw/zinc/50/89/92/1060508992.db2.gz URUODADKUHSYEC-UHFFFAOYSA-N -1 1 308.303 4.153 20 0 DIADMM [O-]c1cc(Nc2ccc(O)cc2C(F)(F)F)c(F)c(F)c1F ZINC001249964355 1060509219 /nfs/dbraw/zinc/50/92/19/1060509219.db2.gz AZVMBBOTGGKCCC-UHFFFAOYSA-N -1 1 323.192 4.278 20 0 DIADMM [O-]c1cc(Nc2cccc3cc(F)cnc32)c(F)c(F)c1F ZINC001249965847 1060512184 /nfs/dbraw/zinc/51/21/84/1060512184.db2.gz OMUPDCXMJPFKAH-UHFFFAOYSA-N -1 1 308.234 4.240 20 0 DIADMM COc1ccc2ccc(Nc3cc([O-])c(F)c(F)c3F)cc2n1 ZINC001249967235 1060512932 /nfs/dbraw/zinc/51/29/32/1060512932.db2.gz UETCXDUZIMFVJH-UHFFFAOYSA-N -1 1 320.270 4.110 20 0 DIADMM CC(C)Oc1c(F)cccc1Nc1cc([O-])c(F)c(F)c1F ZINC001249965956 1060514126 /nfs/dbraw/zinc/51/41/26/1060514126.db2.gz UQYYDUUBKJCJNJ-UHFFFAOYSA-N -1 1 315.266 4.479 20 0 DIADMM CCOc1c(F)cccc1Nc1cc([O-])c(F)c(F)c1F ZINC001249965653 1060514200 /nfs/dbraw/zinc/51/42/00/1060514200.db2.gz FMBLHNBCJXSRSC-UHFFFAOYSA-N -1 1 301.239 4.091 20 0 DIADMM CN1Cc2ccc(Nc3c(Cl)ccc([O-])c3Cl)cc2C1=O ZINC001249981996 1060520354 /nfs/dbraw/zinc/52/03/54/1060520354.db2.gz LBKGMEMOXMCRHW-UHFFFAOYSA-N -1 1 323.179 4.028 20 0 DIADMM CCc1c(Cl)cc(Nc2ccc3nncn3c2)c([O-])c1Cl ZINC001250010666 1060537586 /nfs/dbraw/zinc/53/75/86/1060537586.db2.gz POGFDWHBDNSKMI-UHFFFAOYSA-N -1 1 323.183 4.048 20 0 DIADMM COc1ccc2ncc(Nc3cc(Cl)c([O-])cc3F)cc2c1 ZINC001250020371 1060543838 /nfs/dbraw/zinc/54/38/38/1060543838.db2.gz SESOGMIUFDIHJE-UHFFFAOYSA-N -1 1 318.735 4.485 20 0 DIADMM Cc1cc(Nc2cc(Cl)c([O-])cc2F)n(CC2CCC2)n1 ZINC001250023139 1060547955 /nfs/dbraw/zinc/54/79/55/1060547955.db2.gz FAQUZYNQKQGFGO-UHFFFAOYSA-N -1 1 309.772 4.233 20 0 DIADMM Cn1cc(-c2ccc(Nc3cc(Cl)c([O-])cc3F)cc2)cn1 ZINC001250022633 1060548120 /nfs/dbraw/zinc/54/81/20/1060548120.db2.gz QGZRZGLVGRHFCN-UHFFFAOYSA-N -1 1 317.751 4.329 20 0 DIADMM Nc1c(F)c(F)c(Nc2cc(Cl)c([O-])cc2F)c(F)c1F ZINC001250024244 1060551166 /nfs/dbraw/zinc/55/11/66/1060551166.db2.gz VLGMPJPLQMTADU-UHFFFAOYSA-N -1 1 324.636 4.067 20 0 DIADMM CP(C)(=O)c1ccccc1Nc1cc(Cl)c([O-])cc1F ZINC001250023888 1060552342 /nfs/dbraw/zinc/55/23/42/1060552342.db2.gz GPFFTCWLJUGXKC-UHFFFAOYSA-N -1 1 313.696 4.176 20 0 DIADMM CO[C@@H]1CCOc2c(Nc3cc(Cl)c([O-])cc3F)cccc21 ZINC001250026663 1060553293 /nfs/dbraw/zinc/55/32/93/1060553293.db2.gz RSTUHVAHUBGXMZ-OAHLLOKOSA-N -1 1 323.751 4.398 20 0 DIADMM Cc1cc(Nc2cc(Cl)c([O-])cc2F)cc2snnc21 ZINC001250027270 1060555358 /nfs/dbraw/zinc/55/53/58/1060555358.db2.gz ZVBNPLMLLNGTBK-UHFFFAOYSA-N -1 1 309.753 4.241 20 0 DIADMM Cc1cc(=O)c2ccc(Nc3cc(Cl)c([O-])cc3F)cc2o1 ZINC001250027441 1060555415 /nfs/dbraw/zinc/55/54/15/1060555415.db2.gz ZBIPUSZMGKIGNK-UHFFFAOYSA-N -1 1 319.719 4.343 20 0 DIADMM COc1c(F)cc(F)cc1Nc1cc(Cl)c([O-])cc1F ZINC001250026515 1060555559 /nfs/dbraw/zinc/55/55/59/1060555559.db2.gz PQAWCJSDULPSLJ-UHFFFAOYSA-N -1 1 303.667 4.215 20 0 DIADMM COC(=O)/C=C/c1cccc(Nc2cc(Cl)c([O-])cc2F)c1 ZINC001250029805 1060557682 /nfs/dbraw/zinc/55/76/82/1060557682.db2.gz UAFZARPXWBKSFG-AATRIKPKSA-N -1 1 321.735 4.115 20 0 DIADMM [O-]c1cc(Cc2ccccc2C(F)(F)F)c(F)c(F)c1F ZINC001250100665 1060609452 /nfs/dbraw/zinc/60/94/52/1060609452.db2.gz DDYSLZJYCQNHFM-UHFFFAOYSA-N -1 1 306.205 4.419 20 0 DIADMM COc1c(F)c(Cl)ccc1Nc1cc(F)c([O-])cc1F ZINC001250194330 1060673285 /nfs/dbraw/zinc/67/32/85/1060673285.db2.gz LTIXKAXXYSLNRG-UHFFFAOYSA-N -1 1 303.667 4.215 20 0 DIADMM [O-]c1ccc(F)c(Nc2ccc(C(F)(F)F)nc2)c1Cl ZINC001250227999 1060704830 /nfs/dbraw/zinc/70/48/30/1060704830.db2.gz GRAAKWQJLDLNRJ-UHFFFAOYSA-N -1 1 306.646 4.342 20 0 DIADMM [O-]c1ccc(F)c(Nc2ccnc(C(F)(F)F)c2)c1Cl ZINC001250228174 1060704949 /nfs/dbraw/zinc/70/49/49/1060704949.db2.gz ORHMNIPKHQOBAK-UHFFFAOYSA-N -1 1 306.646 4.342 20 0 DIADMM O=c1cc(Nc2c(F)ccc([O-])c2Cl)c2ccccc2[nH]1 ZINC001250228937 1060707046 /nfs/dbraw/zinc/70/70/46/1060707046.db2.gz QCRQZRXHAYRSQE-UHFFFAOYSA-N -1 1 304.708 4.182 20 0 DIADMM COc1ccc2ncc(Nc3c(F)ccc([O-])c3Cl)cc2c1 ZINC001250228541 1060708175 /nfs/dbraw/zinc/70/81/75/1060708175.db2.gz FIANKMOJFAFAQW-UHFFFAOYSA-N -1 1 318.735 4.485 20 0 DIADMM [O-]c1ccc(F)c(Nc2cccc(C(F)(F)F)n2)c1Cl ZINC001250228218 1060709210 /nfs/dbraw/zinc/70/92/10/1060709210.db2.gz QXSPSCXKTUOQAS-UHFFFAOYSA-N -1 1 306.646 4.342 20 0 DIADMM COc1c(F)cc(F)cc1Nc1c(F)ccc([O-])c1Cl ZINC001250232310 1060710441 /nfs/dbraw/zinc/71/04/41/1060710441.db2.gz JEJUYOMFATXGRC-UHFFFAOYSA-N -1 1 303.667 4.215 20 0 DIADMM COc1c(F)ccc(Nc2c(F)ccc([O-])c2Cl)c1F ZINC001250232568 1060711018 /nfs/dbraw/zinc/71/10/18/1060711018.db2.gz RDFYLDUMOQUHOG-UHFFFAOYSA-N -1 1 303.667 4.215 20 0 DIADMM O=c1ccc2cc(Nc3c(F)ccc([O-])c3Cl)c[nH]c-2c1 ZINC001250230452 1060711091 /nfs/dbraw/zinc/71/10/91/1060711091.db2.gz YUKRYPSCWFRIAF-UHFFFAOYSA-N -1 1 304.708 4.182 20 0 DIADMM [O-]c1ccc(F)c(Nc2ccc(OC(F)(F)F)nc2)c1Cl ZINC001250230402 1060711500 /nfs/dbraw/zinc/71/15/00/1060711500.db2.gz WVORWROFQHRTCA-UHFFFAOYSA-N -1 1 322.645 4.222 20 0 DIADMM Cc1nc(-c2ccc(Nc3c(F)ccc([O-])c3Cl)cc2)no1 ZINC001250232187 1060711738 /nfs/dbraw/zinc/71/17/38/1060711738.db2.gz CQXHPEDOFPVECS-UHFFFAOYSA-N -1 1 319.723 4.287 20 0 DIADMM CC(=O)c1oc2cccnc2c1Nc1c(F)ccc([O-])c1Cl ZINC001250230017 1060711822 /nfs/dbraw/zinc/71/18/22/1060711822.db2.gz QWIUPKKSAJXYOB-UHFFFAOYSA-N -1 1 320.707 4.272 20 0 DIADMM Cc1cc(N)c(Cl)cc1Nc1c(F)ccc([O-])c1Cl ZINC001250232211 1060712198 /nfs/dbraw/zinc/71/21/98/1060712198.db2.gz DRFNLSNLBIEYQS-UHFFFAOYSA-N -1 1 301.148 4.472 20 0 DIADMM CCC(=O)Nc1cccc(Nc2c(F)ccc([O-])c2Cl)c1 ZINC001250233404 1060713345 /nfs/dbraw/zinc/71/33/45/1060713345.db2.gz PKQKUMKXVJQEKF-UHFFFAOYSA-N -1 1 308.740 4.277 20 0 DIADMM [O-]c1ccc(F)c(Nc2ccc(-n3cccn3)cc2)c1Cl ZINC001250233730 1060714292 /nfs/dbraw/zinc/71/42/92/1060714292.db2.gz VQAVDMJSIQNWMO-UHFFFAOYSA-N -1 1 303.724 4.114 20 0 DIADMM O=C1CCCc2cc(Nc3c(F)ccc([O-])c3Cl)ccc21 ZINC001250236291 1060717138 /nfs/dbraw/zinc/71/71/38/1060717138.db2.gz MUSWOCMZLKNXRC-UHFFFAOYSA-N -1 1 305.736 4.447 20 0 DIADMM O=C(Cc1cccc([O-])c1Cl)c1ccc(C(F)(F)F)cc1 ZINC001250237816 1060719046 /nfs/dbraw/zinc/71/90/46/1060719046.db2.gz OOBHOVKHNSWTCE-UHFFFAOYSA-N -1 1 314.690 4.490 20 0 DIADMM Cc1cc(Nc2c(F)ccc([O-])c2Cl)cc2snnc21 ZINC001250236862 1060719449 /nfs/dbraw/zinc/71/94/49/1060719449.db2.gz XFOBMDJRLCSQJM-UHFFFAOYSA-N -1 1 309.753 4.241 20 0 DIADMM COC(=O)/C=C/c1cccc(Nc2c(F)ccc([O-])c2Cl)c1 ZINC001250238232 1060720935 /nfs/dbraw/zinc/72/09/35/1060720935.db2.gz YLAPPKCIPQDYLW-VMPITWQZSA-N -1 1 321.735 4.115 20 0 DIADMM COc1ccc2ccc(Nc3c(F)ccc([O-])c3Cl)cc2n1 ZINC001250238251 1060721892 /nfs/dbraw/zinc/72/18/92/1060721892.db2.gz ZNMRDTKYLGDWRA-UHFFFAOYSA-N -1 1 318.735 4.485 20 0 DIADMM CCOc1nccc(Nc2cc([O-])c(Cl)cc2F)c1Cl ZINC001250248604 1060728485 /nfs/dbraw/zinc/72/84/85/1060728485.db2.gz NPYLPTMIOLJDGZ-UHFFFAOYSA-N -1 1 317.147 4.375 20 0 DIADMM [O-]c1cc(CCCCOCc2ccccc2)c(F)c(F)c1F ZINC001250251797 1060732938 /nfs/dbraw/zinc/73/29/38/1060732938.db2.gz FQDQGTVDWIABBV-UHFFFAOYSA-N -1 1 310.315 4.349 20 0 DIADMM [O-]c1ccc(Cl)c(Nc2c(F)ccc(CO)c2F)c1Cl ZINC001250257748 1060736609 /nfs/dbraw/zinc/73/66/09/1060736609.db2.gz YPWSLGVPIJRUQQ-UHFFFAOYSA-N -1 1 320.122 4.213 20 0 DIADMM COc1cc(Nc2c([O-])cc(F)cc2F)c(F)c(F)c1Cl ZINC001250266332 1060742267 /nfs/dbraw/zinc/74/22/67/1060742267.db2.gz FJIDEISDHFBDNG-UHFFFAOYSA-N -1 1 321.657 4.354 20 0 DIADMM Cc1c(Cl)cc(Nc2ccc3c(c2)NC(=O)C3)c([O-])c1Cl ZINC001250319535 1060777643 /nfs/dbraw/zinc/77/76/43/1060777643.db2.gz DUFYBFXGKLOYFS-UHFFFAOYSA-N -1 1 323.179 4.246 20 0 DIADMM CN(C)c1ccc2nc(-c3cc(Cl)cc(Cl)c3[O-])[nH]c2c1 ZINC001250457867 1060817127 /nfs/dbraw/zinc/81/71/27/1060817127.db2.gz XOQLDJNTKQVACO-UHFFFAOYSA-N -1 1 322.195 4.308 20 0 DIADMM COc1ccc(NCc2ccc([O-])c(F)c2F)c2ccccc12 ZINC001560960437 1060825694 /nfs/dbraw/zinc/82/56/94/1060825694.db2.gz YXTAFLXKALVMMH-UHFFFAOYSA-N -1 1 315.319 4.444 20 0 DIADMM Cc1ncoc1-c1ccc(NCc2ccc([O-])c(F)c2F)cc1 ZINC001561015029 1060872967 /nfs/dbraw/zinc/87/29/67/1060872967.db2.gz IZKNPOVSPYICSI-UHFFFAOYSA-N -1 1 316.307 4.246 20 0 DIADMM Cc1ccc(S(=O)(=O)[N-]c2cccc(-c3ccccc3)c2)cc1 ZINC001250537085 1060880728 /nfs/dbraw/zinc/88/07/28/1060880728.db2.gz RNFYDAAPRPSPEN-UHFFFAOYSA-N -1 1 323.417 4.463 20 0 DIADMM CCOC(=O)c1nc2ccc(Oc3ccccc3)c(Cl)c2[n-]1 ZINC001250549427 1060887664 /nfs/dbraw/zinc/88/76/64/1060887664.db2.gz DPFLUTUMYMZKCH-UHFFFAOYSA-N -1 1 316.744 4.185 20 0 DIADMM CCOC(=O)c1nc2c(ccc(Oc3ccccc3)c2Cl)[n-]1 ZINC001250549427 1060887674 /nfs/dbraw/zinc/88/76/74/1060887674.db2.gz DPFLUTUMYMZKCH-UHFFFAOYSA-N -1 1 316.744 4.185 20 0 DIADMM O=S(=O)([N-]c1cccc2c1CCC2)c1ccc2ccccc2c1 ZINC001250679902 1061009665 /nfs/dbraw/zinc/00/96/65/1061009665.db2.gz DNADAELJYHSLDB-UHFFFAOYSA-N -1 1 323.417 4.129 20 0 DIADMM CCCOc1ccc2nc(-c3cccc(F)c3[O-])n(CC)c2c1 ZINC001250683485 1061016219 /nfs/dbraw/zinc/01/62/19/1061016219.db2.gz HQEALTZYPZDWIN-UHFFFAOYSA-N -1 1 314.360 4.357 20 0 DIADMM CC(C)(C)n1c2ccc(F)cc2nc1-c1cccc(F)c1[O-] ZINC001250683966 1061016387 /nfs/dbraw/zinc/01/63/87/1061016387.db2.gz UTKKALJUDRIOEY-UHFFFAOYSA-N -1 1 302.324 4.442 20 0 DIADMM C=Cc1ccccc1[N-]S(=O)(=O)c1ccc2ccccc2c1 ZINC001250723245 1061041616 /nfs/dbraw/zinc/04/16/16/1061041616.db2.gz FOMMRODKUCMTPW-UHFFFAOYSA-N -1 1 309.390 4.284 20 0 DIADMM COc1ccc2nc(-c3ccc(Cl)cc3[O-])n(C3CC3)c2c1 ZINC001250871475 1061102817 /nfs/dbraw/zinc/10/28/17/1061102817.db2.gz AIGFDDKDADFSEW-UHFFFAOYSA-N -1 1 314.772 4.406 20 0 DIADMM CCCSc1ccc2nc(-c3ccccc3C(=O)[O-])[nH]c2c1 ZINC001250880410 1061107649 /nfs/dbraw/zinc/10/76/49/1061107649.db2.gz XRLFTFCDQSSMHO-UHFFFAOYSA-N -1 1 312.394 4.430 20 0 DIADMM Cc1cc(Cl)cc(Cl)c1[N-]S(=O)(=O)c1cccs1 ZINC001250923492 1061126791 /nfs/dbraw/zinc/12/67/91/1061126791.db2.gz YIXHWACRZSOOTI-UHFFFAOYSA-N -1 1 322.238 4.164 20 0 DIADMM CC(=O)c1ccc2[nH]c(-c3c(Cl)cc([O-])cc3Cl)nc2c1 ZINC001250956900 1061145251 /nfs/dbraw/zinc/14/52/51/1061145251.db2.gz MPXLPZPAVOVQHY-UHFFFAOYSA-N -1 1 321.163 4.445 20 0 DIADMM Cn1c2cc(F)ccc2nc1-c1c(Cl)cc([O-])cc1Cl ZINC001250957405 1061145371 /nfs/dbraw/zinc/14/53/71/1061145371.db2.gz SNLUCMJSTAFWGH-UHFFFAOYSA-N -1 1 311.143 4.392 20 0 DIADMM CCCn1c2cc(F)ccc2nc1-c1cc(F)c(F)cc1[O-] ZINC001250967089 1061149999 /nfs/dbraw/zinc/14/99/99/1061149999.db2.gz HZQNUXFMNFETLG-UHFFFAOYSA-N -1 1 306.287 4.236 20 0 DIADMM CCn1c2ccc(Cl)cc2nc1-c1cc(F)c(F)cc1[O-] ZINC001250967114 1061150905 /nfs/dbraw/zinc/15/09/05/1061150905.db2.gz JJKWQWKAXZYKDI-UHFFFAOYSA-N -1 1 308.715 4.360 20 0 DIADMM Cc1cc2nc(-c3ccc(Cl)cc3C(=O)[O-])[nH]c2c(C)c1 ZINC001250968613 1061152321 /nfs/dbraw/zinc/15/23/21/1061152321.db2.gz QRJGPFFXGFOOTG-UHFFFAOYSA-N -1 1 300.745 4.198 20 0 DIADMM CSc1ccc2nc(-c3ccc(Cl)cc3C(=O)[O-])[nH]c2c1 ZINC001250968605 1061152353 /nfs/dbraw/zinc/15/23/53/1061152353.db2.gz QEQQUKYVQHVFJI-UHFFFAOYSA-N -1 1 318.785 4.303 20 0 DIADMM [O-]c1ccc(CNc2ccc3c(c2)[C@H](O)CCCC3)c(F)c1F ZINC001462413844 1061158677 /nfs/dbraw/zinc/15/86/77/1061158677.db2.gz LNUXSVYMBABSDF-OAHLLOKOSA-N -1 1 319.351 4.042 20 0 DIADMM CC(C)n1c2ccc(F)cc2nc1-c1c(F)cc([O-])cc1F ZINC001251007175 1061178707 /nfs/dbraw/zinc/17/87/07/1061178707.db2.gz FUFMWTLEIONEDH-UHFFFAOYSA-N -1 1 306.287 4.407 20 0 DIADMM O=C(NCC[C@H]1CCCC1(F)F)c1cc2ccccc2cc1[O-] ZINC001455214137 1061211745 /nfs/dbraw/zinc/21/17/45/1061211745.db2.gz OHRWDBDYCLQXMM-CQSZACIVSA-N -1 1 319.351 4.101 20 0 DIADMM Cc1oc(C(C)(C)C)cc1C(=O)NCc1ccc([O-])c(Cl)c1 ZINC001455447633 1061221077 /nfs/dbraw/zinc/22/10/77/1061221077.db2.gz DBLPEDNUCLEUEI-UHFFFAOYSA-N -1 1 321.804 4.175 20 0 DIADMM [O-]c1ccc(CN2CCC[C@](F)(c3ccccc3)C2)c(F)c1F ZINC001462520027 1061229600 /nfs/dbraw/zinc/22/96/00/1061229600.db2.gz UBEAMDTVYIOZQV-GOSISDBHSA-N -1 1 321.342 4.131 20 0 DIADMM Cc1cc(Cl)c(Cl)cc1[N-]S(=O)(=O)c1ccccc1 ZINC001251149278 1061246318 /nfs/dbraw/zinc/24/63/18/1061246318.db2.gz SVPSJDGXXMFUEW-UHFFFAOYSA-N -1 1 316.209 4.103 20 0 DIADMM O=C([N-]c1cscc1Cl)c1cc(-c2cccc(F)c2)no1 ZINC001462555905 1061259409 /nfs/dbraw/zinc/25/94/09/1061259409.db2.gz GAXWDLQMKMNGGN-UHFFFAOYSA-N -1 1 322.748 4.448 20 0 DIADMM [O-]c1c(F)ccc(-c2nc3ccc(C(F)(F)F)cc3[nH]2)c1F ZINC001251234685 1061283577 /nfs/dbraw/zinc/28/35/77/1061283577.db2.gz HPPQFENDKCHQLO-UHFFFAOYSA-N -1 1 314.213 4.233 20 0 DIADMM Cc1cccc2nc(-c3c([O-])cc(Br)cc3F)[nH]c21 ZINC001251248135 1061288463 /nfs/dbraw/zinc/28/84/63/1061288463.db2.gz AJSLWTOLXDZDBL-UHFFFAOYSA-N -1 1 321.149 4.146 20 0 DIADMM CCCCn1c2ccccc2nc1-c1cc(Cl)ncc1[O-] ZINC001251252504 1061291653 /nfs/dbraw/zinc/29/16/53/1061291653.db2.gz XLDFQMFXVBVRJA-UHFFFAOYSA-N -1 1 301.777 4.257 20 0 DIADMM [O-]c1cnc(Cl)cc1-c1nc2c(ccc(Cl)c2Cl)[nH]1 ZINC001251251383 1061291850 /nfs/dbraw/zinc/29/18/50/1061291850.db2.gz AYIMENMLUXDCDU-UHFFFAOYSA-N -1 1 314.559 4.291 20 0 DIADMM [O-]c1c(F)c(F)ccc1-c1nc2ccc(C(F)(F)F)cc2[nH]1 ZINC001251258429 1061295256 /nfs/dbraw/zinc/29/52/56/1061295256.db2.gz ATRPGQIQXQYHJD-UHFFFAOYSA-N -1 1 314.213 4.233 20 0 DIADMM [O-]c1ccc(F)c(F)c1-c1nc2c(cccc2C(F)(F)F)[nH]1 ZINC001251321725 1061312301 /nfs/dbraw/zinc/31/23/01/1061312301.db2.gz BMFMNZVRJSGBDN-UHFFFAOYSA-N -1 1 314.213 4.233 20 0 DIADMM [O-]c1ccc(F)c(F)c1-c1nc2c(cc(Cl)c(F)c2F)[nH]1 ZINC001251321763 1061313397 /nfs/dbraw/zinc/31/33/97/1061313397.db2.gz DGRNHEDJUWEFJM-UHFFFAOYSA-N -1 1 316.641 4.145 20 0 DIADMM Cc1ccc2[nH]c(-c3cccc(C(F)(F)F)c3[O-])nc2c1F ZINC001251341083 1061323591 /nfs/dbraw/zinc/32/35/91/1061323591.db2.gz KCHFJZOXFIQBNZ-UHFFFAOYSA-N -1 1 310.250 4.402 20 0 DIADMM Cn1c2ccc(F)cc2nc1-c1cccc(C(F)(F)F)c1[O-] ZINC001251341025 1061324332 /nfs/dbraw/zinc/32/43/32/1061324332.db2.gz HJCUQSBJXKFDSS-UHFFFAOYSA-N -1 1 310.250 4.104 20 0 DIADMM CC(C)c1cc(C(=O)[N-]c2csnc2-c2ccccc2)on1 ZINC001456539214 1061330353 /nfs/dbraw/zinc/33/03/53/1061330353.db2.gz LXIXADSTILUTAA-UHFFFAOYSA-N -1 1 313.382 4.174 20 0 DIADMM CCCCCC[C@H](C)[N-]S(=O)(=O)c1cc2ccccc2o1 ZINC001462783784 1061357970 /nfs/dbraw/zinc/35/79/70/1061357970.db2.gz VLACICVBMQIKCZ-ZDUSSCGKSA-N -1 1 309.431 4.070 20 0 DIADMM [O-]c1cc(-c2nc3c(cc(F)cc3C(F)(F)F)[nH]2)ccc1F ZINC001251477565 1061373199 /nfs/dbraw/zinc/37/31/99/1061373199.db2.gz QCGHIGXXKNXWEB-UHFFFAOYSA-N -1 1 314.213 4.233 20 0 DIADMM Cn1c2ccc(F)cc2nc1-c1cc(Cl)c(Cl)cc1[O-] ZINC001251491496 1061378090 /nfs/dbraw/zinc/37/80/90/1061378090.db2.gz YXQYLWOOWYQQSG-UHFFFAOYSA-N -1 1 311.143 4.392 20 0 DIADMM COc1cc([O-])c(-c2nc3cc(F)c(C)cc3[nH]2)c(Cl)c1 ZINC001251491321 1061379250 /nfs/dbraw/zinc/37/92/50/1061379250.db2.gz PFBZAFYPDJIZFH-UHFFFAOYSA-N -1 1 306.724 4.045 20 0 DIADMM COc1ccc2[nH]c(-c3c([O-])ccc(Cl)c3Cl)nc2c1 ZINC001251531946 1061391216 /nfs/dbraw/zinc/39/12/16/1061391216.db2.gz PXAUMNCBTMXNIR-UHFFFAOYSA-N -1 1 309.152 4.251 20 0 DIADMM [O-]c1ccc(F)c(Cl)c1-c1nc2c(ccc3ncccc23)[nH]1 ZINC001251540792 1061396210 /nfs/dbraw/zinc/39/62/10/1061396210.db2.gz RWLFOXKCPVLUAV-UHFFFAOYSA-N -1 1 313.719 4.276 20 0 DIADMM CCn1c2cc(OC)ccc2nc1-c1c([O-])ccc(F)c1Cl ZINC001251540629 1061396680 /nfs/dbraw/zinc/39/66/80/1061396680.db2.gz JEVDHLWAPXJBGX-UHFFFAOYSA-N -1 1 320.751 4.230 20 0 DIADMM CSc1ccc2[nH]c(-c3c([O-])ccc(F)c3Cl)nc2c1 ZINC001251540440 1061397365 /nfs/dbraw/zinc/39/73/65/1061397365.db2.gz DOTZCCMRKJDTMJ-UHFFFAOYSA-N -1 1 308.765 4.450 20 0 DIADMM CSc1ccc2nc(-c3cc(F)c(Cl)cc3O)[nH]c2c1 ZINC001251681099 1061440758 /nfs/dbraw/zinc/44/07/58/1061440758.db2.gz NWLNLKITZMRBTQ-UHFFFAOYSA-N -1 1 308.765 4.450 20 0 DIADMM CSc1ccc2[nH]c(-c3cc(F)c(Cl)cc3[O-])nc2c1 ZINC001251681099 1061440761 /nfs/dbraw/zinc/44/07/61/1061440761.db2.gz NWLNLKITZMRBTQ-UHFFFAOYSA-N -1 1 308.765 4.450 20 0 DIADMM CSc1ccc2nc(-c3cc(Cl)c([O-])cc3F)[nH]c2c1 ZINC001251710968 1061453674 /nfs/dbraw/zinc/45/36/74/1061453674.db2.gz VKSKCPIJLZIZMW-UHFFFAOYSA-N -1 1 308.765 4.450 20 0 DIADMM CC[C@H](CC1CCCCC1)C(=O)Nc1nc(Cl)ccc1[O-] ZINC001457765690 1061496747 /nfs/dbraw/zinc/49/67/47/1061496747.db2.gz UWHLRLJCVFSNHC-GFCCVEGCSA-N -1 1 310.825 4.376 20 0 DIADMM Cc1cc2nc(-c3ccc(F)c(C(=O)[O-])c3F)[nH]c2cc1Cl ZINC001251846595 1061505814 /nfs/dbraw/zinc/50/58/14/1061505814.db2.gz NIDRJNFMFIURSE-UHFFFAOYSA-N -1 1 322.698 4.168 20 0 DIADMM O=C([O-])c1c(F)ccc(-c2nc3ccc(C(F)F)cc3[nH]2)c1F ZINC001251846685 1061506544 /nfs/dbraw/zinc/50/65/44/1061506544.db2.gz QYXODUNZGCZJRP-UHFFFAOYSA-N -1 1 324.233 4.144 20 0 DIADMM CC(C)c1ccc2nc(-c3ccc(F)c(C(=O)[O-])c3F)[nH]c2c1 ZINC001251846325 1061506645 /nfs/dbraw/zinc/50/66/45/1061506645.db2.gz IAYHJOQVULBQFG-UHFFFAOYSA-N -1 1 316.307 4.330 20 0 DIADMM O=C(Nc1ccc(SC(F)F)cc1)c1cccc([O-])c1F ZINC001463625217 1061506471 /nfs/dbraw/zinc/50/64/71/1061506471.db2.gz PECKPSBYMKAQMO-UHFFFAOYSA-N -1 1 313.300 4.098 20 0 DIADMM CCN(c1ccc(NC(=O)c2cccc([O-])c2F)cc1)C(C)C ZINC001463967236 1061539562 /nfs/dbraw/zinc/53/95/62/1061539562.db2.gz WKIOERUXBLWNJQ-UHFFFAOYSA-N -1 1 316.376 4.018 20 0 DIADMM CCCN(C(=O)c1ccc([O-])cc1F)[C@@H]1CCc2ccccc21 ZINC001464519491 1061602162 /nfs/dbraw/zinc/60/21/62/1061602162.db2.gz ILIVIDAWZAKXCX-GOSISDBHSA-N -1 1 313.372 4.071 20 0 DIADMM CC[C@@H](C)[C@@H](C)N(C(=O)Cc1ccc([O-])c(Cl)c1)C1CC1 ZINC001464993574 1061660314 /nfs/dbraw/zinc/66/03/14/1061660314.db2.gz VESFYQWYLXFMAV-VXGBXAGGSA-N -1 1 309.837 4.014 20 0 DIADMM CC[C@H](C)[C@@H](C)N(C(=O)Cc1ccc([O-])c(Cl)c1)C1CC1 ZINC001464993569 1061660387 /nfs/dbraw/zinc/66/03/87/1061660387.db2.gz VESFYQWYLXFMAV-NWDGAFQWSA-N -1 1 309.837 4.014 20 0 DIADMM [O-]c1cnccc1-c1nnc(-c2ccc(-c3ccccc3)cc2)o1 ZINC001252573210 1061666519 /nfs/dbraw/zinc/66/65/19/1061666519.db2.gz PWEUHKIXETXVLQ-UHFFFAOYSA-N -1 1 315.332 4.171 20 0 DIADMM CCc1ccc(CCNC(=O)c2ccc3ccccc3c2[O-])cc1 ZINC001465287865 1061725144 /nfs/dbraw/zinc/72/51/44/1061725144.db2.gz JQSQFRXBZQANNE-UHFFFAOYSA-N -1 1 319.404 4.080 20 0 DIADMM COc1cccc([O-])c1-c1nnc(-c2ccc(C(C)(C)C)cc2)o1 ZINC001252803549 1061726758 /nfs/dbraw/zinc/72/67/58/1061726758.db2.gz OMKFOQGSXZHTMM-UHFFFAOYSA-N -1 1 324.380 4.415 20 0 DIADMM Cc1cccc([C@@H]2CCCN2C(=O)c2cccc([O-])c2F)c1C ZINC001465330325 1061735458 /nfs/dbraw/zinc/73/54/58/1061735458.db2.gz IVBAJGWCJPONJU-INIZCTEOSA-N -1 1 313.372 4.125 20 0 DIADMM CCc1ccc(-c2nnc(Cc3ccc([O-])c(Cl)c3)o2)cc1 ZINC001252947751 1061757418 /nfs/dbraw/zinc/75/74/18/1061757418.db2.gz ZSIAJEVWJDJDJB-UHFFFAOYSA-N -1 1 314.772 4.249 20 0 DIADMM CC(C)CC(C)(C)CNC(=O)c1ccc(C(F)(F)F)c([O-])c1 ZINC001465682070 1061794485 /nfs/dbraw/zinc/79/44/85/1061794485.db2.gz OMLKQOIGRNBLRQ-UHFFFAOYSA-N -1 1 317.351 4.213 20 0 DIADMM C[C@](O)(CNc1c(Cl)ccc([O-])c1Cl)c1ccccc1 ZINC001253112283 1061812251 /nfs/dbraw/zinc/81/22/51/1061812251.db2.gz UFKRAKRVMHKDDH-HNNXBMFYSA-N -1 1 312.196 4.019 20 0 DIADMM O=C(Nc1ccc([O-])c(Cl)c1)[C@@H]1C[C@H]1c1ccc(Cl)cc1 ZINC001466225886 1061902286 /nfs/dbraw/zinc/90/22/86/1061902286.db2.gz ZDUPCDOFJFENSK-QWHCGFSZSA-N -1 1 322.191 4.441 20 0 DIADMM C[C@H]1CCC[C@@H](NC(=O)c2ccc(C(F)(F)F)cc2[O-])CC1 ZINC001466958861 1062036777 /nfs/dbraw/zinc/03/67/77/1062036777.db2.gz CFTDZZCCTSHZBR-CMPLNLGQSA-N -1 1 315.335 4.110 20 0 DIADMM Cc1cc([N-]S(=O)(=O)c2ccccc2C)c(C)cc1Cl ZINC001254592201 1062196328 /nfs/dbraw/zinc/19/63/28/1062196328.db2.gz AILGMVVGDGOHCT-UHFFFAOYSA-N -1 1 309.818 4.066 20 0 DIADMM Cc1ccccc1S(=O)(=O)[N-]c1ccc(F)c2ccccc12 ZINC001254618351 1062201799 /nfs/dbraw/zinc/20/17/99/1062201799.db2.gz FYOHZXLRZYTZPR-UHFFFAOYSA-N -1 1 315.369 4.088 20 0 DIADMM Cc1cc2[nH]c(C(=O)Nc3ccc([O-])c(F)c3F)cc2c(C)c1 ZINC001468000117 1062244951 /nfs/dbraw/zinc/24/49/51/1062244951.db2.gz SXKQUPKAPDSADJ-UHFFFAOYSA-N -1 1 316.307 4.021 20 0 DIADMM C[C@@H](C(=O)Nc1ccc([O-])c(F)c1F)c1cccc(Cl)c1 ZINC001468003810 1062247678 /nfs/dbraw/zinc/24/76/78/1062247678.db2.gz QTROCYKOBVQZQE-MRVPVSSYSA-N -1 1 311.715 4.066 20 0 DIADMM CCCCN(C(=O)c1ccc([O-])cc1F)[C@@H]1CCC[C@H](C)C1 ZINC001468504020 1062336473 /nfs/dbraw/zinc/33/64/73/1062336473.db2.gz KHPQTUMRQUNHCA-UONOGXRCSA-N -1 1 307.409 4.352 20 0 DIADMM C=Cc1ccccc1[N-]S(=O)(=O)c1ccc(CCC)cc1 ZINC001255217730 1062359948 /nfs/dbraw/zinc/35/99/48/1062359948.db2.gz SLPRZIWQECDDNO-UHFFFAOYSA-N -1 1 301.411 4.083 20 0 DIADMM CC(C)c1ccc(S(=O)(=O)[N-]c2ccccc2C2CC2)cc1 ZINC001255263055 1062367727 /nfs/dbraw/zinc/36/77/27/1062367727.db2.gz WGKHEKJQNINLTO-UHFFFAOYSA-N -1 1 315.438 4.488 20 0 DIADMM O=C(Nc1cc([O-])c(F)cc1F)c1cc2cc(F)ccc2s1 ZINC001468744781 1062392714 /nfs/dbraw/zinc/39/27/14/1062392714.db2.gz IAUPMMIQYWIMQK-UHFFFAOYSA-N -1 1 323.295 4.277 20 0 DIADMM CC(C)c1ccc(S(=O)(=O)[N-]c2ccc3occc3c2)cc1 ZINC001255335704 1062409304 /nfs/dbraw/zinc/40/93/04/1062409304.db2.gz OYMZORWRUZUPJJ-UHFFFAOYSA-N -1 1 315.394 4.357 20 0 DIADMM CC(C)[C@@H]1N(C(=O)c2cc(Cl)ccc2[O-])CC12CCCC2 ZINC001468968717 1062452605 /nfs/dbraw/zinc/45/26/05/1062452605.db2.gz DREBTGGEJAQEQM-HNNXBMFYSA-N -1 1 307.821 4.086 20 0 DIADMM C[C@H](NC(=O)c1cc2ccccc2cc1[O-])[C@@H]1CCC[C@@H](C)C1 ZINC001469046909 1062468206 /nfs/dbraw/zinc/46/82/06/1062468206.db2.gz WCRLMRSFXNDQAD-QLFBSQMISA-N -1 1 311.425 4.490 20 0 DIADMM CCCCCC(C)(C)C[N-]S(=O)(=O)c1ccc(C(F)F)o1 ZINC001475071500 1062490100 /nfs/dbraw/zinc/49/01/00/1062490100.db2.gz IWUGRUBPNTZHGP-UHFFFAOYSA-N -1 1 323.405 4.102 20 0 DIADMM C/C(=C\c1ccc(C)cc1)C(=O)Nc1cc(F)cc(F)c1[O-] ZINC001469161481 1062491122 /nfs/dbraw/zinc/49/11/22/1062491122.db2.gz OULJFPPKSMFSLE-YRNVUSSQSA-N -1 1 303.308 4.021 20 0 DIADMM O=C(N[C@H](C1CCC1)C1CCCC1)c1cc(Cl)ccc1[O-] ZINC001469360768 1062535101 /nfs/dbraw/zinc/53/51/01/1062535101.db2.gz INSCMGQOFCCXDH-INIZCTEOSA-N -1 1 307.821 4.134 20 0 DIADMM CC(=O)c1cc(NC(=O)c2ccc(C(C)C)cc2[O-])ccc1C ZINC001469524780 1062572432 /nfs/dbraw/zinc/57/24/32/1062572432.db2.gz WDZXUNBJEPZUTH-UHFFFAOYSA-N -1 1 311.381 4.279 20 0 DIADMM Cc1c(=O)[n-]n(-c2ccccc2)c1N[C@H](C)Cc1ccc(C)cc1 ZINC001255784257 1062605915 /nfs/dbraw/zinc/60/59/15/1062605915.db2.gz MAVFPDHIYOCGJX-OAHLLOKOSA-N -1 1 321.424 4.238 20 0 DIADMM Cc1cc2c(CC(=O)Nc3c([O-])cccc3F)csc2s1 ZINC001469928600 1062661370 /nfs/dbraw/zinc/66/13/70/1062661370.db2.gz JQBSARWFZBCPJV-UHFFFAOYSA-N -1 1 321.398 4.297 20 0 DIADMM O=C(Nc1c([O-])cccc1F)c1csc(C2CCCCC2)n1 ZINC001469928055 1062662149 /nfs/dbraw/zinc/66/21/49/1062662149.db2.gz AAGIDKVSXBFIBM-UHFFFAOYSA-N -1 1 320.389 4.288 20 0 DIADMM Cc1cccc(C)c1[C@@H]1CCCN1C(=O)c1ccc(F)c([O-])c1 ZINC001470021877 1062685420 /nfs/dbraw/zinc/68/54/20/1062685420.db2.gz BVQFUOQDUFLYDC-INIZCTEOSA-N -1 1 313.372 4.125 20 0 DIADMM CCCCCCc1nnc(-c2cnc(-c3ccccc3)[n-]c2=O)o1 ZINC001256377921 1062795336 /nfs/dbraw/zinc/79/53/36/1062795336.db2.gz JLMDUNPEBSAMEV-UHFFFAOYSA-N -1 1 324.384 4.022 20 0 DIADMM O=C(Nc1cccc(F)c1[O-])c1cc2c(cccc2C2CC2)[nH]1 ZINC001471170056 1062936308 /nfs/dbraw/zinc/93/63/08/1062936308.db2.gz YKRBDGLYXKUKPR-UHFFFAOYSA-N -1 1 310.328 4.142 20 0 DIADMM Cc1cc2c(CC(=O)Nc3cccc(F)c3[O-])csc2s1 ZINC001471169990 1062936621 /nfs/dbraw/zinc/93/66/21/1062936621.db2.gz XEPSEHFAVKVWJY-UHFFFAOYSA-N -1 1 321.398 4.297 20 0 DIADMM Cc1cc(Cl)cc([N-]S(=O)(=O)c2cccc(Cl)c2)c1 ZINC001256796077 1062986430 /nfs/dbraw/zinc/98/64/30/1062986430.db2.gz QGFPPCFHUBGCRE-UHFFFAOYSA-N -1 1 316.209 4.103 20 0 DIADMM CC1(C)CCCC[C@@H]1CC(=O)NCc1ccc([O-])c(Cl)c1 ZINC001471699823 1063013872 /nfs/dbraw/zinc/01/38/72/1063013872.db2.gz UMTWOSDFVQEOCY-CYBMUJFWSA-N -1 1 309.837 4.268 20 0 DIADMM CC(C)Oc1ccc(-c2nnc(-c3ccc([O-])c(F)c3)o2)cc1 ZINC001256921478 1063052396 /nfs/dbraw/zinc/05/23/96/1063052396.db2.gz OPXGIFAAEFNPEJ-UHFFFAOYSA-N -1 1 314.316 4.036 20 0 DIADMM C/C(=C/C(=O)Nc1cc(F)c([O-])cc1Cl)c1ccc(F)cc1 ZINC001472193119 1063057643 /nfs/dbraw/zinc/05/76/43/1063057643.db2.gz LZFJQKUPJIFZJJ-TWGQIWQCSA-N -1 1 323.726 4.366 20 0 DIADMM Cc1ccc2[nH]c(C(=O)Nc3cc(F)c([O-])cc3Cl)cc2c1 ZINC001472193346 1063058440 /nfs/dbraw/zinc/05/84/40/1063058440.db2.gz WQPJAQNSTBFDAF-UHFFFAOYSA-N -1 1 318.735 4.227 20 0 DIADMM COc1ccc(-c2nnc([C@@H]3C[C@H]3c3ccc(C)cc3)o2)c([O-])c1 ZINC001257211038 1063145291 /nfs/dbraw/zinc/14/52/91/1063145291.db2.gz ZEEPCBYSCYOVAP-JKSUJKDBSA-N -1 1 322.364 4.030 20 0 DIADMM Cc1ccccc1-c1nsc([N-]c2cnn(CC(C)C)c2)n1 ZINC001472710576 1063169449 /nfs/dbraw/zinc/16/94/49/1063169449.db2.gz LLJOHFBNWCVQIP-UHFFFAOYSA-N -1 1 313.430 4.110 20 0 DIADMM Cc1ccc([C@@H]2C[C@@H]2c2nnc(-c3ccc([O-])c(F)c3)o2)cc1 ZINC001257323263 1063206825 /nfs/dbraw/zinc/20/68/25/1063206825.db2.gz GUPUUWAZBRRMLA-KBPBESRZSA-N -1 1 310.328 4.161 20 0 DIADMM Cc1ccc([C@H]2C[C@H]2c2nnc(-c3ccc([O-])cc3F)o2)cc1 ZINC001257326181 1063210061 /nfs/dbraw/zinc/21/00/61/1063210061.db2.gz XBMRPEPUVNBRMJ-HUUCEWRRSA-N -1 1 310.328 4.161 20 0 DIADMM CCCc1cc(=O)[n-]c(SCc2cccc(OC(C)C)c2)n1 ZINC001472924331 1063316538 /nfs/dbraw/zinc/31/65/38/1063316538.db2.gz SLSPOULAOUYYTP-UHFFFAOYSA-N -1 1 318.442 4.214 20 0 DIADMM C=Cc1cccc([N-]S(=O)(=O)c2cccc(Cl)c2C)c1 ZINC001257620728 1063352544 /nfs/dbraw/zinc/35/25/44/1063352544.db2.gz CCOZHHQXRYNWTH-UHFFFAOYSA-N -1 1 307.802 4.092 20 0 DIADMM Cc1nocc1[N-]C(=O)c1csc(-c2ccccc2Cl)n1 ZINC001461252865 1063365706 /nfs/dbraw/zinc/36/57/06/1063365706.db2.gz HIBOJIDXPYUURI-UHFFFAOYSA-N -1 1 319.773 4.012 20 0 DIADMM O=C(N[C@@H](CC1CCC1)c1ccccc1)c1cc(F)ccc1[O-] ZINC001546282219 1063501701 /nfs/dbraw/zinc/50/17/01/1063501701.db2.gz NWWPZTQEZNTYGD-KRWDZBQOSA-N -1 1 313.372 4.193 20 0 DIADMM Cc1ccc(F)cc1S(=O)(=O)[N-]c1cc2cccccc-2c1 ZINC001258921781 1063879755 /nfs/dbraw/zinc/87/97/55/1063879755.db2.gz TYDNUHYUUJUFEH-UHFFFAOYSA-N -1 1 315.369 4.040 20 0 DIADMM CC(C)(C)c1ccc(C(=O)Nc2cc(F)cc(F)c2[O-])s1 ZINC001299580530 1063887037 /nfs/dbraw/zinc/88/70/37/1063887037.db2.gz HYOJFFJUCNGDKK-UHFFFAOYSA-N -1 1 311.353 4.282 20 0 DIADMM CC[C@H](C)c1ccccc1[N-]S(=O)(=O)c1ccc(C)c(F)c1 ZINC001259473943 1063888806 /nfs/dbraw/zinc/88/88/06/1063888806.db2.gz USNGSECUDLPXDP-LBPRGKRZSA-N -1 1 321.417 4.448 20 0 DIADMM Cc1cc(C)cc(S(=O)(=O)[N-]c2cccc(Cl)c2C)c1 ZINC001259515712 1063889930 /nfs/dbraw/zinc/88/99/30/1063889930.db2.gz AUHJDZVGSUEAGH-UHFFFAOYSA-N -1 1 309.818 4.066 20 0 DIADMM Cc1ccc(S(=O)(=O)[N-]c2cc(C(C)C)ccc2C)cc1F ZINC001259480407 1063890211 /nfs/dbraw/zinc/89/02/11/1063890211.db2.gz DNWTYTDMHLRDJH-UHFFFAOYSA-N -1 1 321.417 4.367 20 0 DIADMM Cc1cc(S(=O)(=O)[N-]c2cc3cccccc-3c2)ccc1F ZINC001260756414 1063905941 /nfs/dbraw/zinc/90/59/41/1063905941.db2.gz OTULOAFUUVGWDI-UHFFFAOYSA-N -1 1 315.369 4.040 20 0 DIADMM Cc1cc(Cl)cc([N-]S(=O)(=O)c2cccc(C)c2C)c1 ZINC001260998100 1063908287 /nfs/dbraw/zinc/90/82/87/1063908287.db2.gz LFDDZQMELSROBW-UHFFFAOYSA-N -1 1 309.818 4.066 20 0 DIADMM O=C([N-]c1c(F)cc(F)cc1F)c1ncc(Cl)cc1Cl ZINC001265601847 1064249810 /nfs/dbraw/zinc/24/98/10/1064249810.db2.gz KVPYUNNJPGTAFG-UHFFFAOYSA-N -1 1 321.085 4.058 20 0 DIADMM CC[C@@H](Cc1ccccc1C)C(=O)Nc1ccc(F)cc1[O-] ZINC001306799227 1064645802 /nfs/dbraw/zinc/64/58/02/1064645802.db2.gz KEXIROFWCRNLMI-ZDUSSCGKSA-N -1 1 301.361 4.047 20 0 DIADMM CCc1nc(NC(=O)c2ccc(C(C)C)cc2[O-])sc1C ZINC001290284169 1064688689 /nfs/dbraw/zinc/68/86/89/1064688689.db2.gz FKVAYJLAVTXUDV-UHFFFAOYSA-N -1 1 304.415 4.095 20 0 DIADMM CCC(CC)CN(CC)C(=O)c1ccc2ccc(O)cc2c1[O-] ZINC001290940304 1064720188 /nfs/dbraw/zinc/72/01/88/1064720188.db2.gz ZPLXYTBEOAWTLZ-UHFFFAOYSA-N -1 1 315.413 4.149 20 0 DIADMM CSc1ccc([O-])c(C(=O)N2CC[C@H](C)c3ccccc32)c1 ZINC001291693533 1064739967 /nfs/dbraw/zinc/73/99/67/1064739967.db2.gz UQDRJGUZBCYPKN-LBPRGKRZSA-N -1 1 313.422 4.268 20 0 DIADMM CCCCN(Cc1ccccc1F)C(=O)c1cc(F)ccc1[O-] ZINC001292644208 1064782465 /nfs/dbraw/zinc/78/24/65/1064782465.db2.gz VPJVZXCNQHPLAS-UHFFFAOYSA-N -1 1 319.351 4.113 20 0 DIADMM CCN1CCN(C(=O)c2ccc(C(C)C)cc2[O-])c2ccccc21 ZINC001292879880 1064790983 /nfs/dbraw/zinc/79/09/83/1064790983.db2.gz CNRKWNVPAFWQAP-UHFFFAOYSA-N -1 1 324.424 4.002 20 0 DIADMM CC(C)n1cc([N-]c2nc(-c3cc(F)cc(F)c3)ns2)cn1 ZINC001307154582 1064795480 /nfs/dbraw/zinc/79/54/80/1064795480.db2.gz YAGHTKBVUORXGF-UHFFFAOYSA-N -1 1 321.356 4.004 20 0 DIADMM Cc1cccc2c1CC[C@@H]2NC(=O)c1ccc2ccccc2c1[O-] ZINC001293174533 1064802045 /nfs/dbraw/zinc/80/20/45/1064802045.db2.gz WOKWRIHOCLFUGN-IBGZPJMESA-N -1 1 317.388 4.271 20 0 DIADMM O=C(NC1(c2cccc(F)c2)CC1)c1ccc2ccccc2c1[O-] ZINC001293755091 1064830894 /nfs/dbraw/zinc/83/08/94/1064830894.db2.gz HGVYHCQJDNMXEA-UHFFFAOYSA-N -1 1 321.351 4.104 20 0 DIADMM O=C(Cc1ccc([O-])c(Cl)c1)N1CCC(C2CCCC2)CC1 ZINC001294199886 1064854768 /nfs/dbraw/zinc/85/47/68/1064854768.db2.gz NWVGIKJGBUEYBR-UHFFFAOYSA-N -1 1 321.848 4.017 20 0 DIADMM C[C@@H]1CC(C)(C)CC[C@H]1NC(=O)c1ccc2ccccc2c1[O-] ZINC001294395433 1064864632 /nfs/dbraw/zinc/86/46/32/1064864632.db2.gz GURIFXJZVQALJG-CXAGYDPISA-N -1 1 311.425 4.490 20 0 DIADMM Cc1ccccc1[C@H](NC(=O)c1ccc(F)c([O-])c1)C(C)(C)C ZINC001294439685 1064868550 /nfs/dbraw/zinc/86/85/50/1064868550.db2.gz ZICRUVFDSOTZIT-KRWDZBQOSA-N -1 1 315.388 4.357 20 0 DIADMM CCC1(CC)CCN(C(=O)c2ccc(C(F)(F)F)c([O-])c2)C1 ZINC001294581532 1064874450 /nfs/dbraw/zinc/87/44/50/1064874450.db2.gz DMRPEASJGBYACS-UHFFFAOYSA-N -1 1 315.335 4.063 20 0 DIADMM CC(C)CCn1ccc(NC(=O)c2cc3ccccc3cc2[O-])n1 ZINC001294632923 1064877491 /nfs/dbraw/zinc/87/74/91/1064877491.db2.gz LJOQOUWOGIYWPY-UHFFFAOYSA-N -1 1 323.396 4.040 20 0 DIADMM CCc1ccc([C@H](C)NC(=O)c2ccc(Cl)cc2[O-])cc1 ZINC001295877249 1064932411 /nfs/dbraw/zinc/93/24/11/1064932411.db2.gz QVBZHQRPDGEVHJ-NSHDSACASA-N -1 1 303.789 4.099 20 0 DIADMM CC(C)(C)[C@H]1CCC[C@H](NC(=O)c2ccc([O-])c(F)c2)CC1 ZINC001296516013 1064950660 /nfs/dbraw/zinc/95/06/60/1064950660.db2.gz SMHMHIZZHODIRU-KBPBESRZSA-N -1 1 307.409 4.256 20 0 DIADMM O=C(Cc1ccc(C2CCC2)cc1)Nc1cc([O-])c(F)cc1F ZINC001298975744 1065026934 /nfs/dbraw/zinc/02/69/34/1065026934.db2.gz ZGFVKDZOZIYMJV-UHFFFAOYSA-N -1 1 317.335 4.119 20 0 DIADMM CC[C@@H](C(=O)Nc1cc([O-])c(F)cc1F)C1CCC(C)CC1 ZINC001298975160 1065027665 /nfs/dbraw/zinc/02/76/65/1065027665.db2.gz VOHLQKMICNAXNK-HTAVTVPLSA-N -1 1 311.372 4.461 20 0 DIADMM O=C(NCCCCCCc1ccccc1)c1ccc([O-])cc1F ZINC001300910435 1065043429 /nfs/dbraw/zinc/04/34/29/1065043429.db2.gz GXSOTKTVFJZQFE-UHFFFAOYSA-N -1 1 315.388 4.064 20 0 DIADMM COc1ccc(C(=O)Nc2cc(Cl)c([O-])c3ccccc23)o1 ZINC001301158149 1065054138 /nfs/dbraw/zinc/05/41/38/1065054138.db2.gz CBIKMTXSBYSEGZ-UHFFFAOYSA-N -1 1 317.728 4.053 20 0 DIADMM Cc1cocc1C(=O)Nc1cc(Cl)c([O-])c2ccccc12 ZINC001301158270 1065054565 /nfs/dbraw/zinc/05/45/65/1065054565.db2.gz HKGIIBXTMHGLDY-UHFFFAOYSA-N -1 1 301.729 4.353 20 0 DIADMM O=C(c1ccc2ccccc2c1[O-])N(CCC1CC1)CC1CC1 ZINC001301335619 1065061786 /nfs/dbraw/zinc/06/17/86/1065061786.db2.gz PWHBGUQXVMNKJA-UHFFFAOYSA-N -1 1 309.409 4.198 20 0 DIADMM O=C(CCCc1ccccc1Cl)Nc1cccc(F)c1[O-] ZINC001302487091 1065089997 /nfs/dbraw/zinc/08/99/97/1065089997.db2.gz VFCCGMUDGCXZOH-UHFFFAOYSA-N -1 1 307.752 4.146 20 0 DIADMM O=C(NCc1ccc([O-])c(Cl)c1)[C@@H]1CC[C@H]2CCCC[C@H]2C1 ZINC001303299192 1065113743 /nfs/dbraw/zinc/11/37/43/1065113743.db2.gz RDIWTVMYGHKBLJ-QLFBSQMISA-N -1 1 321.848 4.268 20 0 DIADMM CCc1ccc(F)cc1C(=O)Nc1cc(F)c([O-])cc1Cl ZINC001304281285 1065136299 /nfs/dbraw/zinc/13/62/99/1065136299.db2.gz FHHBFAJHJPDQHU-UHFFFAOYSA-N -1 1 311.715 4.139 20 0 DIADMM O=C(NC[C@H]1C[C@@H]1C1CCCC1)c1ccc2ccccc2c1[O-] ZINC001305873718 1065166394 /nfs/dbraw/zinc/16/63/94/1065166394.db2.gz KHTPNUHLUREAAZ-CRAIPNDOSA-N -1 1 309.409 4.102 20 0 DIADMM CC[C@H](C)c1ccc(C(=O)Nc2nc(Cl)ccc2[O-])cc1 ZINC001306825231 1065193886 /nfs/dbraw/zinc/19/38/86/1065193886.db2.gz BDNBIXLAGKXZTA-JTQLQIEISA-N -1 1 304.777 4.206 20 0 DIADMM Cc1c(-c2ccccc2)nc(SCc2cccc(N)c2)[n-]c1=O ZINC001307327788 1065342832 /nfs/dbraw/zinc/34/28/32/1065342832.db2.gz QJCDIYZGCSSHQY-UHFFFAOYSA-N -1 1 323.421 4.032 20 0 DIADMM Cc1nc(SCc2cccc(Cl)c2F)[n-]c(=O)c1C1CC1 ZINC001307381127 1065363145 /nfs/dbraw/zinc/36/31/45/1065363145.db2.gz BRNXFUBKCKUUED-UHFFFAOYSA-N -1 1 324.808 4.453 20 0 DIADMM Cc1nc(S[C@@H]2CCc3ccccc3C2)[n-]c(=O)c1C1CC1 ZINC001307381577 1065363566 /nfs/dbraw/zinc/36/35/66/1065363566.db2.gz GWAFAGVQMRYWGA-OAHLLOKOSA-N -1 1 312.438 4.018 20 0 DIADMM [O-]c1ccc(CN2CCCCC[C@@H]2c2ccco2)c(F)c1F ZINC001308572373 1066085576 /nfs/dbraw/zinc/08/55/76/1066085576.db2.gz BIOHYZOHXZZQOC-CYBMUJFWSA-N -1 1 307.340 4.381 20 0 DIADMM CCc1nc2ccc(NCc3ccc([O-])c(F)c3F)cc2s1 ZINC001308837033 1066311478 /nfs/dbraw/zinc/31/14/78/1066311478.db2.gz YGKZTJGCMCMVDX-UHFFFAOYSA-N -1 1 320.364 4.455 20 0 DIADMM C[C@H](CCC(C)(C)C)NC(=O)NCc1ccc([O-])c(Cl)c1 ZINC001312034251 1066729628 /nfs/dbraw/zinc/72/96/28/1066729628.db2.gz PANGAGLWSZTRSL-LLVKDONJSA-N -1 1 312.841 4.060 20 0 DIADMM O=S(=O)([N-]c1ccc2[nH]ccc2c1)c1cccc2ccccc21 ZINC000006416383 181339039 /nfs/dbraw/zinc/33/90/39/181339039.db2.gz CFSUZYGWUBBKFG-UHFFFAOYSA-N -1 1 322.389 4.122 20 0 DIADMM O=C([O-])C[C@H]1CCCN(Cc2cc(Cl)ccc2Cl)CC1 ZINC000299745962 229387408 /nfs/dbraw/zinc/38/74/08/229387408.db2.gz UHWQDRVIDZPTJK-NSHDSACASA-N -1 1 316.228 4.070 20 0 DIADMM O=C(Nc1ccc([O-])c(Cl)c1)[C@@H]1C[C@@H]1c1cc(F)ccc1F ZINC000173379630 332829261 /nfs/dbraw/zinc/82/92/61/332829261.db2.gz GIEUWNFQPFJSTP-ZYHUDNBSSA-N -1 1 323.726 4.066 20 0 DIADMM O=C(Nc1ccc([O-])c(Cl)c1)[C@H]1C[C@@H]1c1cc(F)ccc1F ZINC000173379640 332829300 /nfs/dbraw/zinc/82/93/00/332829300.db2.gz GIEUWNFQPFJSTP-PWSUYJOCSA-N -1 1 323.726 4.066 20 0 DIADMM O=S(=O)(Cc1ccc(-c2ccccc2)cc1)c1ccc([O-])cc1 ZINC000520078344 332112850 /nfs/dbraw/zinc/11/28/50/332112850.db2.gz WURGAAHHFHPBPG-UHFFFAOYSA-N -1 1 324.401 4.033 20 0 DIADMM O=c1cc(C(F)F)nc(S[C@@H]2CCCc3ccccc32)[n-]1 ZINC000569531526 332126304 /nfs/dbraw/zinc/12/63/04/332126304.db2.gz ASINVYYNECXCEJ-GFCCVEGCSA-N -1 1 308.353 4.290 20 0 DIADMM CCC[C@@H](C)C[C@@H](NCc1ccc(-c2ccccc2)o1)C(=O)[O-] ZINC000426794868 332154543 /nfs/dbraw/zinc/15/45/43/332154543.db2.gz VYBOBGOSXFBOJQ-RHSMWYFYSA-N -1 1 315.413 4.316 20 0 DIADMM C[C@H](CC(=O)Nc1ccc(F)cc1[O-])c1c[nH]c2ccccc21 ZINC000426993794 332164754 /nfs/dbraw/zinc/16/47/54/332164754.db2.gz XKIOCGZPBCXVIJ-LLVKDONJSA-N -1 1 312.344 4.145 20 0 DIADMM CCN(Cc1ccccc1)C(=O)c1cc2ccccc2cc1[O-] ZINC000215838071 332206336 /nfs/dbraw/zinc/20/63/36/332206336.db2.gz MOGOILYBIPYQLQ-UHFFFAOYSA-N -1 1 305.377 4.208 20 0 DIADMM O=C(Cc1cccc(Cl)c1Cl)Nc1ccc(F)cc1[O-] ZINC000559984137 332299474 /nfs/dbraw/zinc/29/94/74/332299474.db2.gz XCKMTPMXOUJRAK-UHFFFAOYSA-N -1 1 314.143 4.019 20 0 DIADMM CC1(C)CN(C(=O)c2ccc3ccccc3c2[O-])[C@H]2CCC[C@H]21 ZINC000378816222 333054901 /nfs/dbraw/zinc/05/49/01/333054901.db2.gz BXYXGQSVENUPGM-SJORKVTESA-N -1 1 309.409 4.196 20 0 DIADMM Cc1cc(S(=O)(=O)[N-]c2ccccc2C(C)C)cc(C)c1F ZINC000460410562 333080941 /nfs/dbraw/zinc/08/09/41/333080941.db2.gz GWBYENMDYPRCAG-UHFFFAOYSA-N -1 1 321.417 4.367 20 0 DIADMM O=C(c1ccc(Cl)cc1[O-])N1CCC[C@@H]1c1ccccc1 ZINC000436722981 333991088 /nfs/dbraw/zinc/99/10/88/333991088.db2.gz QZRDPEURHFUBEK-OAHLLOKOSA-N -1 1 301.773 4.023 20 0 DIADMM CC(C)Oc1ccccc1-c1nc(-c2ccc([O-])cc2F)no1 ZINC000436879034 334014275 /nfs/dbraw/zinc/01/42/75/334014275.db2.gz MDIGUZHOKGTWIA-UHFFFAOYSA-N -1 1 314.316 4.036 20 0 DIADMM C[C@@H]1CCCC[N@H+]([C@H](C(=O)[O-])c2ccc(Cl)cc2Cl)C1 ZINC000571648663 334017071 /nfs/dbraw/zinc/01/70/71/334017071.db2.gz AQPRPAQQYYIBRF-YGRLFVJLSA-N -1 1 316.228 4.241 20 0 DIADMM C[C@H]1CCCC[N@H+]([C@@H](C(=O)[O-])c2ccc(Cl)cc2Cl)C1 ZINC000571648661 334017200 /nfs/dbraw/zinc/01/72/00/334017200.db2.gz AQPRPAQQYYIBRF-IINYFYTJSA-N -1 1 316.228 4.241 20 0 DIADMM CC[C@H](C)N(CC(=O)[O-])Cc1ccc(-c2ccc(F)cc2C)o1 ZINC000414671932 334064792 /nfs/dbraw/zinc/06/47/92/334064792.db2.gz BRKVMPVLKPZHIE-ZDUSSCGKSA-N -1 1 319.376 4.079 20 0 DIADMM C[C@H](c1ccccc1)N(C)C(=O)c1ccc2ccccc2c1[O-] ZINC000394872663 334163364 /nfs/dbraw/zinc/16/33/64/334163364.db2.gz DWBWFDKITCYTLS-CQSZACIVSA-N -1 1 305.377 4.379 20 0 DIADMM CC(C)Oc1ccccc1CC(=O)Nc1ccc([O-])c(Cl)c1 ZINC000111667042 334352691 /nfs/dbraw/zinc/35/26/91/334352691.db2.gz GNGARQKLKAMHOD-UHFFFAOYSA-N -1 1 319.788 4.014 20 0 DIADMM O=C(c1cc(Cl)ccc1[O-])N1CCC(c2ccsc2)CC1 ZINC000187986812 334606954 /nfs/dbraw/zinc/60/69/54/334606954.db2.gz SSWUYRLVIARDQV-UHFFFAOYSA-N -1 1 321.829 4.127 20 0 DIADMM O=C(Nc1ccc([O-])c(Cl)c1)C1(C(F)(F)F)CCCC1 ZINC000416178012 334654077 /nfs/dbraw/zinc/65/40/77/334654077.db2.gz JVLGJZXTUULKSA-UHFFFAOYSA-N -1 1 307.699 4.107 20 0 DIADMM Cc1ccc(-c2ccncc2)cc1NC(=O)c1cc(F)ccc1[O-] ZINC000094090372 335712671 /nfs/dbraw/zinc/71/26/71/335712671.db2.gz IWPHWNQODIQDNB-UHFFFAOYSA-N -1 1 322.339 4.154 20 0 DIADMM CN(Cc1nc2c(s1)CCCC2)Cc1cccc([O-])c1Cl ZINC000351567962 336045100 /nfs/dbraw/zinc/04/51/00/336045100.db2.gz LGOBGASZPIGFDS-UHFFFAOYSA-N -1 1 322.861 4.013 20 0 DIADMM Cc1cc(-c2noc(-c3ccc4ccccc4c3[O-])n2)c(C)o1 ZINC000445861469 338513362 /nfs/dbraw/zinc/51/33/62/338513362.db2.gz LPDJFRKQDZZXPE-UHFFFAOYSA-N -1 1 306.321 4.472 20 0 DIADMM Cc1cccc(-c2cncc(C(=O)Nc3ccc(F)cc3[O-])c2)c1 ZINC000532865402 336273508 /nfs/dbraw/zinc/27/35/08/336273508.db2.gz YWTLGJJJLIXRSB-UHFFFAOYSA-N -1 1 322.339 4.154 20 0 DIADMM [O-]c1c(-c2nc(Cc3cccc(F)c3)no2)ccc2ccccc21 ZINC000324969038 336275931 /nfs/dbraw/zinc/27/59/31/336275931.db2.gz ZPGLEPLAUXGPTI-UHFFFAOYSA-N -1 1 320.323 4.325 20 0 DIADMM Cc1nc(-c2ccc(N[C@@H](C)c3ccccc3)nc2)[n-]c(=O)c1C ZINC000301330153 336300936 /nfs/dbraw/zinc/30/09/36/336300936.db2.gz ANJJGKMRRUVWAU-AWEZNQCLSA-N -1 1 320.396 4.034 20 0 DIADMM Cc1nc(-c2ccc(N[C@H](C)CCC(C)C)nc2)[n-]c(=O)c1C ZINC000302746539 336367715 /nfs/dbraw/zinc/36/77/15/336367715.db2.gz SGKWLYNKDQOCSA-GFCCVEGCSA-N -1 1 314.433 4.098 20 0 DIADMM CCCCC[C@H](C)Nc1ccc(-c2nc(C)c(C)c(=O)[n-]2)cn1 ZINC000302763040 336368055 /nfs/dbraw/zinc/36/80/55/336368055.db2.gz XXGNYCIVSCMSAU-LBPRGKRZSA-N -1 1 314.433 4.242 20 0 DIADMM C[C@@H]1c2ccsc2CCN1C(=O)c1cc2ccccc2cc1[O-] ZINC000320866376 336374706 /nfs/dbraw/zinc/37/47/06/336374706.db2.gz QQJQDSGKAVJJGL-GFCCVEGCSA-N -1 1 323.417 4.366 20 0 DIADMM CCOc1cc(C(=O)Nc2cscc2C)cc(Cl)c1[O-] ZINC000357987872 336605145 /nfs/dbraw/zinc/60/51/45/336605145.db2.gz MBVCOWMRDVUOFW-UHFFFAOYSA-N -1 1 311.790 4.067 20 0 DIADMM [O-]c1ccc(-c2noc(-c3ccc4ccccc4c3O)n2)cc1F ZINC000392329675 337203942 /nfs/dbraw/zinc/20/39/42/337203942.db2.gz PMRBTWMPINNPCV-UHFFFAOYSA-N -1 1 322.295 4.107 20 0 DIADMM [O-]c1ccc(/C=C/c2nc3ccccc3o2)cc1Br ZINC000023987043 337255174 /nfs/dbraw/zinc/25/51/74/337255174.db2.gz PLMIGASMCYZPNU-SOFGYWHQSA-N -1 1 316.154 4.466 20 0 DIADMM Cc1cc(S(=O)(=O)[N-]c2cccc(C(F)F)c2)c(C)s1 ZINC000195451758 337467022 /nfs/dbraw/zinc/46/70/22/337467022.db2.gz VOJPUKOZKUPUNV-UHFFFAOYSA-N -1 1 317.382 4.103 20 0 DIADMM [O-]c1ccc(-c2noc(CCc3ccc(Cl)cc3)n2)c(F)c1 ZINC000445464864 337769898 /nfs/dbraw/zinc/76/98/98/337769898.db2.gz VUOGIOBSGGAIBI-UHFFFAOYSA-N -1 1 318.735 4.020 20 0 DIADMM O=C(Nc1ccc([O-])c(Cl)c1)[C@@H]1C[C@H]1c1cccc(Cl)c1 ZINC000533081552 337812340 /nfs/dbraw/zinc/81/23/40/337812340.db2.gz ABWVJJLAMLOYMZ-QWHCGFSZSA-N -1 1 322.191 4.441 20 0 DIADMM CC(C)c1ccc(-c2nc(-c3ccc([O-])cc3Cl)no2)cn1 ZINC000445446813 337845446 /nfs/dbraw/zinc/84/54/46/337845446.db2.gz NALJBLYYSDDXGD-UHFFFAOYSA-N -1 1 315.760 4.281 20 0 DIADMM O=C(c1cc2ccccc2cc1[O-])N1CC[C@H](c2ccccc2)C1 ZINC000121499967 337894199 /nfs/dbraw/zinc/89/41/99/337894199.db2.gz ZBCQQKDKNYAEFY-SFHVURJKSA-N -1 1 317.388 4.175 20 0 DIADMM C[C@@H]1CCN(C(=O)c2ccc(Cl)cc2[O-])[C@H]2CCCC[C@H]12 ZINC000537645172 337952585 /nfs/dbraw/zinc/95/25/85/337952585.db2.gz GWNIVNHZSRDZCO-KYOSRNDESA-N -1 1 307.821 4.086 20 0 DIADMM CN(C(=O)c1ccc2ccccc2c1[O-])c1ccc(F)c(F)c1 ZINC000537641235 337954782 /nfs/dbraw/zinc/95/47/82/337954782.db2.gz KAVKMOOTQGPHCA-UHFFFAOYSA-N -1 1 313.303 4.100 20 0 DIADMM CC(C)c1cccc(-c2nc(-c3ccc([O-])cc3Cl)no2)n1 ZINC000445451251 338016411 /nfs/dbraw/zinc/01/64/11/338016411.db2.gz CKOXJVGAAHUYSJ-UHFFFAOYSA-N -1 1 315.760 4.281 20 0 DIADMM CCC(CC)c1cc(-c2nc(-c3ccc([O-])cc3F)no2)on1 ZINC000445455564 338017295 /nfs/dbraw/zinc/01/72/95/338017295.db2.gz PXKJMVYNXILOPQ-UHFFFAOYSA-N -1 1 317.320 4.140 20 0 DIADMM C/C(=C/c1nc(-c2ccc([O-])cc2F)no1)c1cccc(F)c1 ZINC000445456307 338017459 /nfs/dbraw/zinc/01/74/59/338017459.db2.gz NSNWUBJGRZPJCH-YFHOEESVSA-N -1 1 314.291 4.281 20 0 DIADMM [O-]c1ccc(-c2noc(Cc3ccccc3Cl)n2)c(Cl)c1 ZINC000445456714 338017585 /nfs/dbraw/zinc/01/75/85/338017585.db2.gz VRUAZSMOXZELHO-UHFFFAOYSA-N -1 1 321.163 4.340 20 0 DIADMM [O-]c1ccc(-c2noc(-c3cc(F)cc(Cl)c3)n2)c(F)c1 ZINC000445457907 338017861 /nfs/dbraw/zinc/01/78/61/338017861.db2.gz UYKJVRRVNZBYPI-UHFFFAOYSA-N -1 1 308.671 4.041 20 0 DIADMM C[C@@H](c1ccc(Cl)s1)c1nc(-c2ccc([O-])cc2F)no1 ZINC000445459178 338018361 /nfs/dbraw/zinc/01/83/61/338018361.db2.gz YICPQMKINPQUOO-ZETCQYMHSA-N -1 1 324.764 4.448 20 0 DIADMM Cc1cccc(O[C@@H](C)c2nc(-c3ccc([O-])cc3F)no2)c1 ZINC000445462632 338027641 /nfs/dbraw/zinc/02/76/41/338027641.db2.gz LXARHEPCIKZSIR-NSHDSACASA-N -1 1 314.316 4.030 20 0 DIADMM [O-]c1ccc(-c2noc(C3(c4ccccc4)CCC3)n2)c(F)c1 ZINC000445463928 338033211 /nfs/dbraw/zinc/03/32/11/338033211.db2.gz KSOPHZHYCQEJEM-UHFFFAOYSA-N -1 1 310.328 4.051 20 0 DIADMM CC[C@H](Nc1ccc(-c2nc(C)c(C)c(=O)[n-]2)cn1)C(C)(C)C ZINC000433779603 338201569 /nfs/dbraw/zinc/20/15/69/338201569.db2.gz MIGMIXXGBOOOQH-AWEZNQCLSA-N -1 1 314.433 4.098 20 0 DIADMM C[C@H]1[C@@H](c2ccccc2)[C@H]1C(=O)Nc1ccc([O-])c(Cl)c1 ZINC000435762623 338248145 /nfs/dbraw/zinc/24/81/45/338248145.db2.gz JJNZEHMDUHNETA-HNHYXYPQSA-N -1 1 301.773 4.034 20 0 DIADMM CCc1cc(=O)[n-]c(SCc2c(C)ccc3ccccc32)n1 ZINC000436199034 338261711 /nfs/dbraw/zinc/26/17/11/338261711.db2.gz RHVGYFQMHZYAAI-UHFFFAOYSA-N -1 1 310.422 4.499 20 0 DIADMM CC(=O)c1cc(-c2nc(-c3ccc([O-])cc3Cl)no2)cs1 ZINC000436522668 338274987 /nfs/dbraw/zinc/27/49/87/338274987.db2.gz WHUYHZWPOLYDFT-UHFFFAOYSA-N -1 1 320.757 4.027 20 0 DIADMM Cc1ncc(-c2ccccc2)cc1NC(=O)c1ccccc1[O-] ZINC000436522634 338275082 /nfs/dbraw/zinc/27/50/82/338275082.db2.gz VZEABNKCSUFKOP-UHFFFAOYSA-N -1 1 304.349 4.015 20 0 DIADMM C[C@@H](c1ccccc1)N(C(=O)c1ccc(Cl)cc1[O-])C1CC1 ZINC000436537511 338275919 /nfs/dbraw/zinc/27/59/19/338275919.db2.gz XRSUNIFOGGSOAU-LBPRGKRZSA-N -1 1 315.800 4.411 20 0 DIADMM O=C(c1ccccc1[O-])N(CCc1ccccc1)c1ccccc1 ZINC000436541815 338276151 /nfs/dbraw/zinc/27/61/51/338276151.db2.gz YTBUYAGUTKWOIK-UHFFFAOYSA-N -1 1 317.388 4.282 20 0 DIADMM C[C@@H]1C[C@@H]2CCCC[C@H]2N1C(=O)c1cc2ccccc2cc1[O-] ZINC000436550014 338276677 /nfs/dbraw/zinc/27/66/77/338276677.db2.gz HLLGPUWLASYOLM-RPVQJOFSSA-N -1 1 309.409 4.339 20 0 DIADMM CCC1CCC(N(C(=O)c2cc(F)ccc2[O-])C2CC2)CC1 ZINC000436550055 338276688 /nfs/dbraw/zinc/27/66/88/338276688.db2.gz HTKWSNGGUCYCHX-UHFFFAOYSA-N -1 1 305.393 4.105 20 0 DIADMM C[C@@H]1C[C@H]2CCCC[C@@H]2N1C(=O)c1ccc2ccccc2c1[O-] ZINC000436551301 338276775 /nfs/dbraw/zinc/27/67/75/338276775.db2.gz MWSYOKNRRTUXBL-SIIHOXLZSA-N -1 1 309.409 4.339 20 0 DIADMM CN(Cc1cc2ccccc2o1)C(=O)c1cc(Cl)ccc1[O-] ZINC000436571748 338277581 /nfs/dbraw/zinc/27/75/81/338277581.db2.gz CDVXITQEZZOJRQ-UHFFFAOYSA-N -1 1 315.756 4.064 20 0 DIADMM O=C(c1cc2ccccc2cc1[O-])N1CC[C@@H]1Cc1ccccc1 ZINC000436573066 338277795 /nfs/dbraw/zinc/27/77/95/338277795.db2.gz HAEOBYFBVDMIMF-GOSISDBHSA-N -1 1 317.388 4.003 20 0 DIADMM CCSCC[C@@H](C)N(C)C(=O)c1cc2ccccc2cc1[O-] ZINC000436579593 338278259 /nfs/dbraw/zinc/27/82/59/338278259.db2.gz YHJLCILEBQOBFO-CYBMUJFWSA-N -1 1 317.454 4.149 20 0 DIADMM O=C(c1ccc2ccccc2c1[O-])N1CCc2c1cccc2Cl ZINC000436582640 338278289 /nfs/dbraw/zinc/27/82/89/338278289.db2.gz BKAWCDKXOLUZQJ-UHFFFAOYSA-N -1 1 323.779 4.402 20 0 DIADMM CC(C)CN(C(=O)c1ccccc1[O-])c1ccc(Cl)cc1 ZINC000436586669 338278588 /nfs/dbraw/zinc/27/85/88/338278588.db2.gz UHUCZRRSOMQUSG-UHFFFAOYSA-N -1 1 303.789 4.348 20 0 DIADMM CC[C@H](C)n1ncc(NC(=O)c2ccc3ccccc3c2[O-])c1C ZINC000436595141 338279040 /nfs/dbraw/zinc/27/90/40/338279040.db2.gz LBRJCTNRGLZQIK-LBPRGKRZSA-N -1 1 323.396 4.274 20 0 DIADMM CC[C@@H](C)n1ncc(NC(=O)c2ccc(C(C)C)cc2[O-])c1C ZINC000436595498 338279199 /nfs/dbraw/zinc/27/91/99/338279199.db2.gz MPEOJFNRVYJQFK-GFCCVEGCSA-N -1 1 315.417 4.244 20 0 DIADMM CCCCn1ncc(NC(=O)c2ccc3ccccc3c2[O-])c1C ZINC000436597375 338279213 /nfs/dbraw/zinc/27/92/13/338279213.db2.gz UZZUCBZTLPJQGQ-UHFFFAOYSA-N -1 1 323.396 4.103 20 0 DIADMM CC(C)c1cccnc1NC(=O)c1cc2ccccc2cc1[O-] ZINC000436612262 338279881 /nfs/dbraw/zinc/27/98/81/338279881.db2.gz WZPOARNQHIGOJE-UHFFFAOYSA-N -1 1 306.365 4.316 20 0 DIADMM CN(C(=O)c1ccccc1[O-])c1ccc(Oc2ccccc2)cc1 ZINC000436719119 338283998 /nfs/dbraw/zinc/28/39/98/338283998.db2.gz NFSLULBWOSYWAW-UHFFFAOYSA-N -1 1 319.360 4.461 20 0 DIADMM CC[C@@H]1c2ccsc2CCN1C(=O)c1ccc(Cl)cc1[O-] ZINC000436723236 338284194 /nfs/dbraw/zinc/28/41/94/338284194.db2.gz MZQVRHBKVVBROT-CYBMUJFWSA-N -1 1 321.829 4.257 20 0 DIADMM C[C@H]1CCN(C(=O)c2ccc(Cl)cc2[O-])[C@H](c2ccco2)C1 ZINC000436728281 338284399 /nfs/dbraw/zinc/28/43/99/338284399.db2.gz JQVUIKZYJPLEIZ-FZMZJTMJSA-N -1 1 319.788 4.252 20 0 DIADMM C[C@@H]1CN(C(=O)c2cc3ccccc3cc2[O-])[C@@H]2CCCC[C@H]21 ZINC000436734663 338284586 /nfs/dbraw/zinc/28/45/86/338284586.db2.gz BJPRDEBQNDFBGJ-RPVQJOFSSA-N -1 1 309.409 4.196 20 0 DIADMM O=C(c1cc2ccccc2cc1[O-])N1Cc2cccc(Cl)c2C1 ZINC000436745812 338285168 /nfs/dbraw/zinc/28/51/68/338285168.db2.gz WDTBHQUMQCICFC-UHFFFAOYSA-N -1 1 323.779 4.355 20 0 DIADMM C[C@H]1CN(C(=O)c2ccc(C(F)(F)F)cc2[O-])c2ccccc21 ZINC000436750517 338285488 /nfs/dbraw/zinc/28/54/88/338285488.db2.gz GGIGHVHOBPYVRD-JTQLQIEISA-N -1 1 321.298 4.175 20 0 DIADMM C[C@@H](c1ccccc1)N(C)C(=O)c1ccc(C(F)(F)F)cc1[O-] ZINC000436762454 338286131 /nfs/dbraw/zinc/28/61/31/338286131.db2.gz DWNVWVDXBFPAOI-NSHDSACASA-N -1 1 323.314 4.244 20 0 DIADMM Cc1ccc2nc(C(=O)Nc3ccc([O-])c(Cl)c3)ccc2c1 ZINC000436774368 338286927 /nfs/dbraw/zinc/28/69/27/338286927.db2.gz AYBJMXUPEQDDPC-UHFFFAOYSA-N -1 1 312.756 4.155 20 0 DIADMM CC(C)[C@H](C)N(C(=O)c1ccc(C(F)(F)F)cc1[O-])C1CC1 ZINC000436795084 338287621 /nfs/dbraw/zinc/28/76/21/338287621.db2.gz QBPBLQHEBNPPPQ-JTQLQIEISA-N -1 1 315.335 4.060 20 0 DIADMM CC(C)[C@H]1CCCCN1C(=O)c1ccc(C(F)(F)F)cc1[O-] ZINC000436809857 338288197 /nfs/dbraw/zinc/28/81/97/338288197.db2.gz VNBZJIRKQBCMAU-CYBMUJFWSA-N -1 1 315.335 4.062 20 0 DIADMM C/C(=C/c1ccccc1)CN(C)C(=O)c1cc(Cl)ccc1[O-] ZINC000436819403 338288414 /nfs/dbraw/zinc/28/84/14/338288414.db2.gz NCPGQCDBAITJGA-RAXLEYEMSA-N -1 1 315.800 4.221 20 0 DIADMM C/C(=C\c1ccccc1)CN(C)C(=O)c1cc(Cl)ccc1[O-] ZINC000436819102 338288532 /nfs/dbraw/zinc/28/85/32/338288532.db2.gz NCPGQCDBAITJGA-JLHYYAGUSA-N -1 1 315.800 4.221 20 0 DIADMM CC(C)[C@@H]1N(C(=O)c2cc3ccccc3cc2[O-])CC12CCC2 ZINC000436827268 338288733 /nfs/dbraw/zinc/28/87/33/338288733.db2.gz NEBKLBSFGXUSDZ-SFHVURJKSA-N -1 1 309.409 4.196 20 0 DIADMM O=C(c1cc(F)ccc1[O-])N1CCCC2(CCCCC2)CC1 ZINC000436838984 338289355 /nfs/dbraw/zinc/28/93/55/338289355.db2.gz KQUIXBBRKJTRAK-UHFFFAOYSA-N -1 1 305.393 4.108 20 0 DIADMM O=C(c1ccc([O-])cc1F)N1CCCC2(CCCCC2)CC1 ZINC000436836973 338289357 /nfs/dbraw/zinc/28/93/57/338289357.db2.gz FINVYEYIZOONNE-UHFFFAOYSA-N -1 1 305.393 4.108 20 0 DIADMM O=C(N[C@@H]1CSc2ccccc21)c1cc2ccccc2cc1[O-] ZINC000436854859 338290096 /nfs/dbraw/zinc/29/00/96/338290096.db2.gz UMHRFWNGVQFADB-MRXNPFEDSA-N -1 1 321.401 4.122 20 0 DIADMM CCOc1cc(-c2noc([C@@H]3C[C@@H]3C(C)C)n2)cc(Cl)c1[O-] ZINC000436869320 338290574 /nfs/dbraw/zinc/29/05/74/338290574.db2.gz CSTMZDLJBLTKHH-GHMZBOCLSA-N -1 1 322.792 4.254 20 0 DIADMM C[C@@H](CC(C)(C)c1ccccc1)NC(=O)c1ccc([O-])cc1F ZINC000436868829 338290608 /nfs/dbraw/zinc/29/06/08/338290608.db2.gz KOCJBBOCELPTIW-ZDUSSCGKSA-N -1 1 315.388 4.018 20 0 DIADMM [O-]c1ccc(-c2noc([C@@H](F)c3ccccc3)n2)c(Cl)c1 ZINC000436869950 338290726 /nfs/dbraw/zinc/29/07/26/338290726.db2.gz FWKSSBSBDZFFQB-ZDUSSCGKSA-N -1 1 304.708 4.155 20 0 DIADMM Cc1cc(NC(=O)c2ccc([O-])cc2F)ccc1-c1ccncc1 ZINC000436871561 338290889 /nfs/dbraw/zinc/29/08/89/338290889.db2.gz QJMSINMWJJDBGX-UHFFFAOYSA-N -1 1 322.339 4.154 20 0 DIADMM C[C@@H](c1nc(-c2ccc([O-])cc2Cl)no1)c1ccccc1 ZINC000436872388 338290895 /nfs/dbraw/zinc/29/08/95/338290895.db2.gz MPTQWCGHSHRDPJ-SNVBAGLBSA-N -1 1 300.745 4.247 20 0 DIADMM CCOc1cc(-c2noc(C[C@H](C)CC)n2)cc(Cl)c1[O-] ZINC000436871927 338290970 /nfs/dbraw/zinc/29/09/70/338290970.db2.gz UUQAEJVQUOWBNB-SECBINFHSA-N -1 1 310.781 4.083 20 0 DIADMM Cc1ccc(-c2nc(-c3ccc([O-])c(F)c3)no2)c(Cl)c1 ZINC000436876912 338291288 /nfs/dbraw/zinc/29/12/88/338291288.db2.gz CISNADNVYGIBQY-UHFFFAOYSA-N -1 1 304.708 4.210 20 0 DIADMM Cc1cscc1[N-]S(=O)(=O)c1ccc(CC(C)C)cc1 ZINC000439042233 338359344 /nfs/dbraw/zinc/35/93/44/338359344.db2.gz NASVWFPCEMVNSL-UHFFFAOYSA-N -1 1 309.456 4.056 20 0 DIADMM O=C(Nc1ccc2cc[nH]c2c1)c1cc2ccccc2cc1[O-] ZINC000447647459 338562862 /nfs/dbraw/zinc/56/28/62/338562862.db2.gz VHVNTUOHTKUGHF-UHFFFAOYSA-N -1 1 302.333 4.279 20 0 DIADMM Cc1ccc(C(C)(C)CC(=O)Nc2ccc([O-])c(F)c2F)cc1 ZINC000456795974 338941202 /nfs/dbraw/zinc/94/12/02/338941202.db2.gz XAOKGMNVNAILRV-UHFFFAOYSA-N -1 1 319.351 4.285 20 0 DIADMM Cc1c(C)c(C)c(S(=O)(=O)[N-]c2ccsc2)c(C)c1C ZINC000462098342 339072021 /nfs/dbraw/zinc/07/20/21/339072021.db2.gz OTRNQYBXNLYUJJ-UHFFFAOYSA-N -1 1 309.456 4.091 20 0 DIADMM CCc1ccccc1[N-]S(=O)(=O)c1ccccc1C(C)C ZINC000468527128 339265462 /nfs/dbraw/zinc/26/54/62/339265462.db2.gz HIWLEUWLFWGYQY-UHFFFAOYSA-N -1 1 303.427 4.173 20 0 DIADMM CC(C)(C)c1csc(CSc2nc(C3CC3)cc(=O)[n-]2)n1 ZINC000470450405 339320131 /nfs/dbraw/zinc/32/01/31/339320131.db2.gz ZDHRJJLIJNCDQP-UHFFFAOYSA-N -1 1 321.471 4.106 20 0 DIADMM Cc1ccccc1S(=O)(=O)[N-]c1ccccc1SC(C)C ZINC000471127926 339337888 /nfs/dbraw/zinc/33/78/88/339337888.db2.gz UQVRUMKTVPLHMD-UHFFFAOYSA-N -1 1 321.467 4.296 20 0 DIADMM Cc1cc(N(C)C)ccc1NC(=O)Nc1ccc([O-])c(Cl)c1 ZINC000476345046 339474978 /nfs/dbraw/zinc/47/49/78/339474978.db2.gz ARMHWLDUORXBCR-UHFFFAOYSA-N -1 1 319.792 4.064 20 0 DIADMM [O-]c1ccc(F)c(/C=C/c2ncc(Br)s2)c1F ZINC000480031542 339556029 /nfs/dbraw/zinc/55/60/29/339556029.db2.gz XOQRJPYWZHCXME-DAFODLJHSA-N -1 1 318.142 4.060 20 0 DIADMM Cc1ccc2nc(-c3cccc(-c4cscn4)c3)[n-]c(=O)c2c1 ZINC000481519492 339605767 /nfs/dbraw/zinc/60/57/67/339605767.db2.gz OEKCMPKVXOEMJX-UHFFFAOYSA-N -1 1 319.389 4.434 20 0 DIADMM CCc1ccccc1S(=O)(=O)[N-]c1cc(SC)ccc1C ZINC000488220354 339773608 /nfs/dbraw/zinc/77/36/08/339773608.db2.gz KEMZJWRCOAZYIZ-UHFFFAOYSA-N -1 1 321.467 4.080 20 0 DIADMM O=C(Nc1ccc(F)cc1[O-])c1cc(Cl)c(F)cc1Cl ZINC000490648394 339836451 /nfs/dbraw/zinc/83/64/51/339836451.db2.gz LIDBEZCVHRMBBY-UHFFFAOYSA-N -1 1 318.106 4.230 20 0 DIADMM O=c1nc(-c2ccc(Cl)o2)[n-]c2sc3ccccc3c21 ZINC000507033662 340205967 /nfs/dbraw/zinc/20/59/67/340205967.db2.gz DRRVGWJXHAEGHU-UHFFFAOYSA-N -1 1 302.742 4.464 20 0 DIADMM C[C@@H]1CCc2c(sc3nc(-c4ccc(Cl)o4)[n-]c(=O)c32)C1 ZINC000507038411 340206047 /nfs/dbraw/zinc/20/60/47/340206047.db2.gz JXFCKDITRKQFDT-SSDOTTSWSA-N -1 1 320.801 4.435 20 0 DIADMM COc1ccccc1CN(Cc1cccc([O-])c1Cl)C1CC1 ZINC000507170861 340210889 /nfs/dbraw/zinc/21/08/89/340210889.db2.gz QZLGVZZLMRIVKT-UHFFFAOYSA-N -1 1 317.816 4.219 20 0 DIADMM CC[C@H](C)[C@@H](C)C(=O)Nc1cc(C)cc(Br)c1[O-] ZINC000507366336 340218062 /nfs/dbraw/zinc/21/80/62/340218062.db2.gz AYRRUDURHAWASD-VHSXEESVSA-N -1 1 314.223 4.084 20 0 DIADMM C[C@@H](C(=O)Nc1ccc([O-])c(Cl)c1)c1ccc(F)c(F)c1 ZINC000509188143 340263416 /nfs/dbraw/zinc/26/34/16/340263416.db2.gz ZNKWYXKPEMZIHB-MRVPVSSYSA-N -1 1 311.715 4.066 20 0 DIADMM CC[C@H](OC1CCCCC1)C(=O)Nc1ccc([O-])c(Cl)c1 ZINC000182869059 340485716 /nfs/dbraw/zinc/48/57/16/340485716.db2.gz HYIYOWJAWGJUQH-HNNXBMFYSA-N -1 1 311.809 4.112 20 0 DIADMM CC[C@H](C(=O)Nc1ccc([O-])c(Cl)c1)c1ccc(OC)cc1 ZINC000182873206 340485812 /nfs/dbraw/zinc/48/58/12/340485812.db2.gz KOSNAOADSCLCDS-AWEZNQCLSA-N -1 1 319.788 4.187 20 0 DIADMM CC(C)c1ccccc1S(=O)(=O)[N-]c1ccc2[nH]ccc2c1 ZINC000188933729 340523596 /nfs/dbraw/zinc/52/35/96/340523596.db2.gz BDFKUBVQRUSWMY-UHFFFAOYSA-N -1 1 314.410 4.092 20 0 DIADMM C[C@@H](Sc1nc(C2CC2)cc(=O)[n-]1)c1nc2ccccc2o1 ZINC000189440049 340536007 /nfs/dbraw/zinc/53/60/07/340536007.db2.gz OAOVCTGOLSRRTF-SECBINFHSA-N -1 1 313.382 4.054 20 0 DIADMM O=C(Nc1ccc([O-])c(Cl)c1)Nc1ccc(F)c(F)c1F ZINC000190915167 340547989 /nfs/dbraw/zinc/54/79/89/340547989.db2.gz FDXBJZANNTVWIV-UHFFFAOYSA-N -1 1 316.666 4.107 20 0 DIADMM CCc1nc(NC(=O)Nc2ccc([O-])c(Cl)c2)sc1C ZINC000192231004 340564890 /nfs/dbraw/zinc/56/48/90/340564890.db2.gz LOYIXWRPQZZGLO-UHFFFAOYSA-N -1 1 311.794 4.017 20 0 DIADMM Cc1cccc([N-]S(=O)(=O)c2ccc(Cl)s2)c1Cl ZINC000525310944 340699759 /nfs/dbraw/zinc/69/97/59/340699759.db2.gz FLVVHYBIGKBLPE-UHFFFAOYSA-N -1 1 322.238 4.164 20 0 DIADMM [O-]c1cccc(CNc2cccc(Br)c2)c1Cl ZINC000328497470 340785284 /nfs/dbraw/zinc/78/52/84/340785284.db2.gz VKYBBFFXHDTRCW-UHFFFAOYSA-N -1 1 312.594 4.420 20 0 DIADMM O=C(Nc1ccc([O-])c(Cl)c1)c1cncc(-c2ccccc2)c1 ZINC000133317900 341172436 /nfs/dbraw/zinc/17/24/36/341172436.db2.gz CIPWTMTXPCGQTO-UHFFFAOYSA-N -1 1 324.767 4.360 20 0 DIADMM C[C@@H](OC1CCCCCC1)c1nc(-c2ccc([O-])c(F)c2)no1 ZINC000556002751 341492350 /nfs/dbraw/zinc/49/23/50/341492350.db2.gz LCPKUAFAJWHHRY-LLVKDONJSA-N -1 1 320.364 4.382 20 0 DIADMM CCCn1ccc2cc(NC(=O)c3ccc([O-])cc3F)ccc21 ZINC000154633797 341592774 /nfs/dbraw/zinc/59/27/74/341592774.db2.gz IQGJQOBLNJDDQK-UHFFFAOYSA-N -1 1 312.344 4.148 20 0 DIADMM O=C(Nc1ccccc1CCC(F)(F)F)c1ccccc1[O-] ZINC000155345135 341606542 /nfs/dbraw/zinc/60/65/42/341606542.db2.gz FQYCYNALSTYYDN-UHFFFAOYSA-N -1 1 309.287 4.139 20 0 DIADMM CCc1nc(SCc2cccc(Cl)c2F)[n-]c(=O)c1C ZINC000574584611 341763101 /nfs/dbraw/zinc/76/31/01/341763101.db2.gz JFLABGIJVNGEIE-UHFFFAOYSA-N -1 1 312.797 4.138 20 0 DIADMM Cc1cnc(SCc2csc(C3CCCCC3)n2)[n-]c1=O ZINC000577888539 341946928 /nfs/dbraw/zinc/94/69/28/341946928.db2.gz WWUKNLTZVMXHND-UHFFFAOYSA-N -1 1 321.471 4.287 20 0 DIADMM CCC(CC)n1ncc(C(=O)Nc2ccc([O-])c(Cl)c2)c1C ZINC000182864094 521647907 /nfs/dbraw/zinc/64/79/07/521647907.db2.gz TXILUPJOPIHLCU-UHFFFAOYSA-N -1 1 321.808 4.164 20 0 DIADMM CC[C@H](c1ccncc1)N(CC)C(=O)c1ccc(Cl)cc1[O-] ZINC000157406360 522975220 /nfs/dbraw/zinc/97/52/20/522975220.db2.gz LLHYOKWNWPTPTI-OAHLLOKOSA-N -1 1 318.804 4.054 20 0 DIADMM Cc1c(NCc2cccc([O-])c2Cl)cnn1-c1ccccc1 ZINC000339338665 525870477 /nfs/dbraw/zinc/87/04/77/525870477.db2.gz SBTDGTSRAINNCI-UHFFFAOYSA-N -1 1 313.788 4.152 20 0 DIADMM [O-]c1cc(F)c(Nc2ncccc2Br)cc1Cl ZINC001250019120 1060541975 /nfs/dbraw/zinc/54/19/75/1060541975.db2.gz YBLAPRQHJXAVMF-UHFFFAOYSA-N -1 1 317.545 4.086 20 0 DIADMM Cc1cccc2c1[C@H](C)C[C@H]2CC(=O)Nc1c([O-])cccc1F ZINC000683114644 1035549348 /nfs/dbraw/zinc/54/93/48/1035549348.db2.gz LASVGHSVRUMPFV-OLZOCXBDSA-N -1 1 313.372 4.459 20 0 DIADMM CC(C)c1ccc(CN[C@@H](C(=O)[O-])c2cc(F)ccc2F)cc1 ZINC000683175607 1035662706 /nfs/dbraw/zinc/66/27/06/1035662706.db2.gz YDWCRBPNFUSYKP-QGZVFWFLSA-N -1 1 319.351 4.004 20 0 DIADMM Cc1cccc(S(=O)(=O)[N-]c2ccccc2-c2ccccc2)c1 ZINC000006352434 1035683347 /nfs/dbraw/zinc/68/33/47/1035683347.db2.gz WAEPUPHNSUAMOD-UHFFFAOYSA-N -1 1 323.417 4.463 20 0 DIADMM CCCN(C(=O)c1cncc([O-])c1)[C@H](C)c1cc2ccccc2o1 ZINC000339814178 1035971461 /nfs/dbraw/zinc/97/14/61/1035971461.db2.gz LGKLSBFLPUJOKH-CYBMUJFWSA-N -1 1 324.380 4.147 20 0 DIADMM O=C(/C=C/c1csc(-c2cccs2)n1)c1ccc([O-])cc1 ZINC000077563670 1036047155 /nfs/dbraw/zinc/04/71/55/1036047155.db2.gz BOFNFRYIADPLFJ-VMPITWQZSA-N -1 1 313.403 4.473 20 0 DIADMM COc1c(F)ccc(Nc2ccc(F)c(F)c2[O-])c1Cl ZINC001209806860 1036261375 /nfs/dbraw/zinc/26/13/75/1036261375.db2.gz ONVPEMRTAUICAE-UHFFFAOYSA-N -1 1 303.667 4.215 20 0 DIADMM O=C(c1cc(Cl)ccc1[O-])N1CCC[C@@H](C2CCCC2)C1 ZINC001648803933 1036384316 /nfs/dbraw/zinc/38/43/16/1036384316.db2.gz VGBHPYSWWBWNJO-CYBMUJFWSA-N -1 1 307.821 4.088 20 0 DIADMM CCC[C@H]1CCc2nc(NC(=O)c3ccccc3[O-])sc2C1 ZINC001143378421 1036576589 /nfs/dbraw/zinc/57/65/89/1036576589.db2.gz KBGOBIMCWMFXEH-NSHDSACASA-N -1 1 316.426 4.006 20 0 DIADMM CC(C)(C)c1ccc(/C=C\C(=O)Nc2cccc(F)c2[O-])cc1 ZINC001648850799 1036640411 /nfs/dbraw/zinc/64/04/11/1036640411.db2.gz MTKBFKDWWPTGRR-XFXZXTDPSA-N -1 1 313.372 4.481 20 0 DIADMM Cc1nc(-c2ccccc2)ccc1C(=O)Nc1c([O-])cccc1F ZINC000089541507 1037088047 /nfs/dbraw/zinc/08/80/47/1037088047.db2.gz FIINAVXRFQABET-UHFFFAOYSA-N -1 1 322.339 4.154 20 0 DIADMM [O-]c1cc(Nc2cnccc2Br)c(F)cc1Cl ZINC001211232972 1037221053 /nfs/dbraw/zinc/22/10/53/1037221053.db2.gz JTKOMDIWRUMVNS-UHFFFAOYSA-N -1 1 317.545 4.086 20 0 DIADMM Cc1ccc(C(=O)Nc2cc(Cl)c([O-])c3ccccc23)o1 ZINC001167440092 1037382666 /nfs/dbraw/zinc/38/26/66/1037382666.db2.gz OXJJWZLUHGZBBW-UHFFFAOYSA-N -1 1 301.729 4.353 20 0 DIADMM CCC[C@H](C)C[C@H](NCc1cc2cccc(CC)c2o1)C(=O)[O-] ZINC000656574812 1037656627 /nfs/dbraw/zinc/65/66/27/1037656627.db2.gz ZHTBVMCQMYMXLM-GUYCJALGSA-N -1 1 317.429 4.364 20 0 DIADMM O=C([O-])c1cccc(Cl)c1CN1CCC(c2ccco2)CC1 ZINC000656757479 1037842879 /nfs/dbraw/zinc/84/28/79/1037842879.db2.gz OQCCLGISVFANIC-UHFFFAOYSA-N -1 1 319.788 4.011 20 0 DIADMM CSc1cc(F)c(Nc2ccc(F)c(F)c2[O-])cc1F ZINC001215968399 1037876873 /nfs/dbraw/zinc/87/68/73/1037876873.db2.gz NNEZNCAEMNUIOI-UHFFFAOYSA-N -1 1 303.280 4.414 20 0 DIADMM C[C@@H](c1ccc(Cl)cc1Cl)N1CC[C@@H](C(=O)[O-])[C@H](C)C1 ZINC000312558416 1038400733 /nfs/dbraw/zinc/40/07/33/1038400733.db2.gz QWPFHHJFIFFGLQ-JFGNBEQYSA-N -1 1 316.228 4.097 20 0 DIADMM Cc1[nH]nc2ccc(-c3ccc(OCCCCC(=O)[O-])cc3)cc12 ZINC000657203385 1038436953 /nfs/dbraw/zinc/43/69/53/1038436953.db2.gz SZWRRVCJSXDSLX-UHFFFAOYSA-N -1 1 324.380 4.172 20 0 DIADMM Cc1ccoc1CN[C@@H](CC(=O)[O-])c1ccc(C(C)C)cc1 ZINC000277211922 1038452696 /nfs/dbraw/zinc/45/26/96/1038452696.db2.gz HGTNQZHYXFZMNB-INIZCTEOSA-N -1 1 301.386 4.017 20 0 DIADMM CCOc1cccc([N-]S(=O)(=O)c2ccc(C(C)C)cc2)c1 ZINC000071977706 1038560336 /nfs/dbraw/zinc/56/03/36/1038560336.db2.gz RDGHOVRNHJJZRF-UHFFFAOYSA-N -1 1 319.426 4.010 20 0 DIADMM Cc1cccc(NC(=O)c2ccc(C(F)(F)F)c([O-])c2)c1C ZINC000684869738 1038664711 /nfs/dbraw/zinc/66/47/11/1038664711.db2.gz YNBJVDRSNHBXHZ-UHFFFAOYSA-N -1 1 309.287 4.280 20 0 DIADMM O=C(c1ccc(C(F)(F)F)c([O-])c1)N1CCCc2ccccc21 ZINC000684868958 1038665547 /nfs/dbraw/zinc/66/55/47/1038665547.db2.gz LPFKBVJAYWPKAS-UHFFFAOYSA-N -1 1 321.298 4.004 20 0 DIADMM C[C@@H]1CCCC[C@@H]1N(C)C(=O)c1ccc(C(F)(F)F)c([O-])c1 ZINC000684870411 1038665962 /nfs/dbraw/zinc/66/59/62/1038665962.db2.gz FSIHLANIWZOXEI-MFKMUULPSA-N -1 1 315.335 4.062 20 0 DIADMM Cc1ccc(NC(=O)c2ccc(C(F)(F)F)c([O-])c2)c(C)c1 ZINC000684869495 1038666566 /nfs/dbraw/zinc/66/65/66/1038666566.db2.gz TYNKADOXFFCYGI-UHFFFAOYSA-N -1 1 309.287 4.280 20 0 DIADMM C[C@@H]1Cc2ccccc2N1C(=O)c1ccc(C(F)(F)F)c([O-])c1 ZINC000684871146 1038667666 /nfs/dbraw/zinc/66/76/66/1038667666.db2.gz WLDNGFSQBUBODG-SNVBAGLBSA-N -1 1 321.298 4.002 20 0 DIADMM CN(CC1CCCCC1)C(=O)c1ccc(C(F)(F)F)c([O-])c1 ZINC000684871022 1038668060 /nfs/dbraw/zinc/66/80/60/1038668060.db2.gz YOQRFYNYRKZSDD-UHFFFAOYSA-N -1 1 315.335 4.063 20 0 DIADMM C/C(=C\c1ccc(Cl)cc1)C(=O)Nc1ccc([O-])c(F)c1F ZINC001627447914 1038677976 /nfs/dbraw/zinc/67/79/76/1038677976.db2.gz FAJUPWMGKLFRBY-CMDGGOBGSA-N -1 1 323.726 4.366 20 0 DIADMM Cc1ccsc1S(=O)(=O)[N-]c1cc(Cl)ccc1Cl ZINC000607610690 1038705613 /nfs/dbraw/zinc/70/56/13/1038705613.db2.gz SHOZHBJRWAHUEM-UHFFFAOYSA-N -1 1 322.238 4.164 20 0 DIADMM CC(C)c1ccc(SCC(=O)Nc2c([O-])cccc2F)cc1 ZINC000608365945 1038829431 /nfs/dbraw/zinc/82/94/31/1038829431.db2.gz MBFWGPCNWRQANY-UHFFFAOYSA-N -1 1 319.401 4.386 20 0 DIADMM O=C(Nc1c([O-])cccc1F)[C@@H]1C[C@@H]1c1ccc2ccccc2c1 ZINC000608366342 1038829640 /nfs/dbraw/zinc/82/96/40/1038829640.db2.gz SBWBKZUNECOKAS-HZPDHXFCSA-N -1 1 321.351 4.427 20 0 DIADMM CCCN(CC)c1ccc(C(=O)Nc2c([O-])cccc2F)cc1 ZINC000608366837 1038830759 /nfs/dbraw/zinc/83/07/59/1038830759.db2.gz OAPWYGBLLFYCFQ-UHFFFAOYSA-N -1 1 316.376 4.020 20 0 DIADMM O=C(Nc1c([O-])cccc1F)c1ccc2c(c1)Cc1ccccc1-2 ZINC000608366664 1038831438 /nfs/dbraw/zinc/83/14/38/1038831438.db2.gz VPZXIFNDCJEEOH-UHFFFAOYSA-N -1 1 319.335 4.355 20 0 DIADMM O=C(Cc1ccc(Cl)c(Cl)c1)Nc1c([O-])cccc1F ZINC000608365207 1038831796 /nfs/dbraw/zinc/83/17/96/1038831796.db2.gz BTQLVBYSBJRHKK-UHFFFAOYSA-N -1 1 314.143 4.019 20 0 DIADMM Cc1ccc2c(CC(=O)Nc3c([O-])cccc3F)coc2c1C ZINC000608365196 1038832104 /nfs/dbraw/zinc/83/21/04/1038832104.db2.gz AUXBVDHUPNZKHH-UHFFFAOYSA-N -1 1 313.328 4.076 20 0 DIADMM O=C(Nc1ccc([O-])c(Cl)c1)c1cc2cccc(F)c2o1 ZINC000608490707 1038861106 /nfs/dbraw/zinc/86/11/06/1038861106.db2.gz AGHZQJLROFIFFY-UHFFFAOYSA-N -1 1 305.692 4.183 20 0 DIADMM O=C(C[C@@H]1CCCc2ccccc21)Nc1ccc([O-])c(F)c1F ZINC000456780394 1039076465 /nfs/dbraw/zinc/07/64/65/1039076465.db2.gz BTZZISXWMLNBON-LBPRGKRZSA-N -1 1 317.335 4.119 20 0 DIADMM [O-]c1c(F)cc(Nc2cc(F)ccc2OC(F)(F)F)cc1F ZINC001213384420 1039322957 /nfs/dbraw/zinc/32/29/57/1039322957.db2.gz LSBKLPLPBFGUKV-UHFFFAOYSA-N -1 1 323.192 4.452 20 0 DIADMM CC(C)c1ccc2nc(-c3ccc4c(n3)CCCC4)[n-]c(=O)c2c1 ZINC000539958651 1039396490 /nfs/dbraw/zinc/39/64/90/1039396490.db2.gz YDJZARPYMXDONC-UHFFFAOYSA-N -1 1 319.408 4.400 20 0 DIADMM CC[C@H](C)c1cc(C(=O)[N-]c2cc(-c3ccccc3)on2)on1 ZINC000175869446 1040054509 /nfs/dbraw/zinc/05/45/09/1040054509.db2.gz KIJZIAQPNICQPU-NSHDSACASA-N -1 1 311.341 4.095 20 0 DIADMM Cc1ccc(CCCC(=O)Nc2ccc([O-])c(Cl)c2)s1 ZINC000176575115 1040078714 /nfs/dbraw/zinc/07/87/14/1040078714.db2.gz OHBLOQNRKXSHSE-UHFFFAOYSA-N -1 1 309.818 4.377 20 0 DIADMM COc1ccc([C@@H](C)CC(=O)Nc2ccc([O-])c(Cl)c2)cc1 ZINC000176690773 1040085451 /nfs/dbraw/zinc/08/54/51/1040085451.db2.gz UKFWURIOKPWNQO-NSHDSACASA-N -1 1 319.788 4.187 20 0 DIADMM Cc1ccc(CN(C(=O)c2cc3ccccc3cc2[O-])C2CC2)o1 ZINC000612551097 1040637703 /nfs/dbraw/zinc/63/77/03/1040637703.db2.gz MVLDEIMZTVSBMX-UHFFFAOYSA-N -1 1 321.376 4.252 20 0 DIADMM COCOc1ccc(Nc2cc(Cl)cc(Cl)c2[O-])cc1 ZINC001211639361 1040859964 /nfs/dbraw/zinc/85/99/64/1040859964.db2.gz GIEJIRNVXZXGNG-UHFFFAOYSA-N -1 1 314.168 4.425 20 0 DIADMM O=C(Nc1ccc([O-])c(Cl)c1)[C@@H]1C[C@@H]1c1cccc(F)c1F ZINC000173378618 1040888004 /nfs/dbraw/zinc/88/80/04/1040888004.db2.gz XPZWTPFCOHJWAB-GHMZBOCLSA-N -1 1 323.726 4.066 20 0 DIADMM COc1cc(F)c(-c2c(Cl)ccc([O-])c2F)c(OC)c1 ZINC001244540946 1041391309 /nfs/dbraw/zinc/39/13/09/1041391309.db2.gz KVVSFJMJPFAZIN-UHFFFAOYSA-N -1 1 300.688 4.008 20 0 DIADMM [O-]c1ccc(Cl)c(-c2cnc3cc(F)c(F)cc3n2)c1F ZINC001244540414 1041391422 /nfs/dbraw/zinc/39/14/22/1041391422.db2.gz OICDRWGVNLNAKL-UHFFFAOYSA-N -1 1 310.662 4.073 20 0 DIADMM COc1ccccc1OC(=O)c1cc2cc(Cl)sc2[n-]1 ZINC000810523234 1041397987 /nfs/dbraw/zinc/39/79/87/1041397987.db2.gz FOZQVOXGQBBIBJ-UHFFFAOYSA-N -1 1 307.758 4.111 20 0 DIADMM C[C@H](c1ccc(Cl)cc1Cl)N1CCC[C@@H](CC(=O)[O-])C1 ZINC000226420085 1041398845 /nfs/dbraw/zinc/39/88/45/1041398845.db2.gz HERAGZXLIRHKEL-MNOVXSKESA-N -1 1 316.228 4.241 20 0 DIADMM O=C(CCC1CCCCC1)Nc1ccc(-c2cc(=O)[nH][n-]2)cc1 ZINC000613663746 1041413791 /nfs/dbraw/zinc/41/37/91/1041413791.db2.gz CLKROENKCGKGRH-UHFFFAOYSA-N -1 1 313.401 4.081 20 0 DIADMM COc1cc(C)cc(NC(=O)c2ccc(C(C)C)cc2[O-])c1C ZINC001170634843 1041517917 /nfs/dbraw/zinc/51/79/17/1041517917.db2.gz HAYNTXLAIQMLRI-UHFFFAOYSA-N -1 1 313.397 4.393 20 0 DIADMM CC1(C)CN(C(=O)c2ccc([O-])cc2F)c2ccc(Cl)cc21 ZINC001170649164 1041581587 /nfs/dbraw/zinc/58/15/87/1041581587.db2.gz XSYSWXWGRWNHHE-UHFFFAOYSA-N -1 1 319.763 4.123 20 0 DIADMM Cc1ccc([C@H](CC(=O)[O-])NCc2ccc(C3CCC3)cc2)o1 ZINC000417575816 1041687256 /nfs/dbraw/zinc/68/72/56/1041687256.db2.gz SXXHOVWUIXSFNF-KRWDZBQOSA-N -1 1 313.397 4.161 20 0 DIADMM COc1ccc(NCc2cccc([O-])c2Cl)cc1OC(C)C ZINC000815134292 1041923794 /nfs/dbraw/zinc/92/37/94/1041923794.db2.gz RUBVXDCFCSGAAR-UHFFFAOYSA-N -1 1 321.804 4.454 20 0 DIADMM Cc1nnc(-c2ccc(NCc3cccc([O-])c3Cl)cc2)o1 ZINC000815132246 1041924023 /nfs/dbraw/zinc/92/40/23/1041924023.db2.gz OKCUXJZEGHCKDK-UHFFFAOYSA-N -1 1 315.760 4.016 20 0 DIADMM Cc1ccc(-c2csc3[n-]c(-c4ccco4)nc(=O)c23)s1 ZINC000047681814 1041967843 /nfs/dbraw/zinc/96/78/43/1041967843.db2.gz ZLLZABYEKJHCGN-UHFFFAOYSA-N -1 1 314.391 4.282 20 0 DIADMM CC(C)c1ccc(CCNC(=O)c2c([O-])cccc2Cl)cc1 ZINC001135291782 1042008341 /nfs/dbraw/zinc/00/83/41/1042008341.db2.gz KRIWLWPBYJCFIP-UHFFFAOYSA-N -1 1 317.816 4.142 20 0 DIADMM O=C(Nc1ccc(Cl)cc1Cl)c1cccc([O-])c1F ZINC001135395696 1042025517 /nfs/dbraw/zinc/02/55/17/1042025517.db2.gz DNDNOKOEIOUDIK-UHFFFAOYSA-N -1 1 300.116 4.090 20 0 DIADMM O=C(Nc1cccc(Cl)c1)c1ccc2ccc(O)cc2c1[O-] ZINC001135679359 1042079532 /nfs/dbraw/zinc/07/95/32/1042079532.db2.gz MWCHSEWDNGJWAP-UHFFFAOYSA-N -1 1 313.740 4.157 20 0 DIADMM CC[C@H](NC(=O)c1ccc(F)c([O-])c1)c1ccc(Cl)cc1 ZINC001135957976 1042120681 /nfs/dbraw/zinc/12/06/81/1042120681.db2.gz ZZAFVCXKZYHZML-AWEZNQCLSA-N -1 1 307.752 4.066 20 0 DIADMM CC(C)Cc1cccc([C@@H](C)C(=O)[N-]OCc2ccccc2)c1 ZINC001136106477 1042139326 /nfs/dbraw/zinc/13/93/26/1042139326.db2.gz LCMHLGJQSBXZRB-MRXNPFEDSA-N -1 1 311.425 4.237 20 0 DIADMM CSc1ccc([O-])c(C(=O)Nc2cccc(-n3cccc3)c2)c1 ZINC001136162347 1042159377 /nfs/dbraw/zinc/15/93/77/1042159377.db2.gz OLFGCAOPQKISEC-UHFFFAOYSA-N -1 1 324.405 4.157 20 0 DIADMM CCN(Cc1ccc(Cl)cc1)C(=O)c1cc(Cl)ccc1[O-] ZINC001136185116 1042170863 /nfs/dbraw/zinc/17/08/63/1042170863.db2.gz OKHKBNGXMIHMAE-UHFFFAOYSA-N -1 1 324.207 4.361 20 0 DIADMM COc1cnc(C=Cc2ccc(-c3ccccc3)cc2)[n-]c1=O ZINC000821007388 1042240330 /nfs/dbraw/zinc/24/03/30/1042240330.db2.gz HTUNDNBRKLUKOE-XFXZXTDPSA-N -1 1 304.349 4.028 20 0 DIADMM COc1cnc(C=Cc2cccc(Oc3ccccc3)c2)[n-]c1=O ZINC000821009246 1042240817 /nfs/dbraw/zinc/24/08/17/1042240817.db2.gz XYBUMRJYSRKECT-ZHACJKMWSA-N -1 1 320.348 4.154 20 0 DIADMM CCCC[C@H](CC)CC(=O)Nc1ccc(-c2cc(=O)[nH][n-]2)cc1 ZINC000605021606 1042250823 /nfs/dbraw/zinc/25/08/23/1042250823.db2.gz DEMXYFILTWYRNJ-ZDUSSCGKSA-N -1 1 315.417 4.327 20 0 DIADMM O=C(c1cc(F)ccc1[O-])N1CCC[C@H]1CC1CCCCC1 ZINC001136466949 1042256187 /nfs/dbraw/zinc/25/61/87/1042256187.db2.gz KRGJREOPNXYZEO-HNNXBMFYSA-N -1 1 305.393 4.106 20 0 DIADMM CC(C)CC[C@@H]1CCC[C@H]1NC(=O)c1c([O-])cccc1Cl ZINC001136596094 1042290789 /nfs/dbraw/zinc/29/07/89/1042290789.db2.gz UNBCVWJIXDUZHW-GXTWGEPZSA-N -1 1 309.837 4.380 20 0 DIADMM CC(C)c1ccc(CCCNC(=O)c2c([O-])cccc2F)cc1 ZINC001136752434 1042336730 /nfs/dbraw/zinc/33/67/30/1042336730.db2.gz QSGYTCGOUWPJNO-UHFFFAOYSA-N -1 1 315.388 4.017 20 0 DIADMM [O-]c1ccc(-c2noc([C@H]3CC[C@@H](C(F)(F)F)C3)n2)c(F)c1 ZINC000436873609 1042337982 /nfs/dbraw/zinc/33/79/82/1042337982.db2.gz NPSGBWLNIBYXDM-JGVFFNPUSA-N -1 1 316.254 4.027 20 0 DIADMM [O-]c1ccc(-c2noc([C@@H]3CC[C@@H](C(F)(F)F)C3)n2)c(F)c1 ZINC000436873607 1042338085 /nfs/dbraw/zinc/33/80/85/1042338085.db2.gz NPSGBWLNIBYXDM-HTQZYQBOSA-N -1 1 316.254 4.027 20 0 DIADMM O=c1[n-]c(-c2ccc(Cl)cc2Cl)nc2ccc(O)cc12 ZINC000436926233 1042339432 /nfs/dbraw/zinc/33/94/32/1042339432.db2.gz LDUWJTMXNSIAQV-UHFFFAOYSA-N -1 1 307.136 4.015 20 0 DIADMM CCN(Cc1ccc(C(=O)[O-])cn1)[C@H](C)c1cc2ccccc2o1 ZINC000515305642 1042814900 /nfs/dbraw/zinc/81/49/00/1042814900.db2.gz DEFQWVYVFDGHRT-CYBMUJFWSA-N -1 1 324.380 4.109 20 0 DIADMM C[C@@H]1CC[C@H](C(=O)[O-])[C@H](C)N1Cc1c(Cl)cccc1Cl ZINC000518797654 1042921410 /nfs/dbraw/zinc/92/14/10/1042921410.db2.gz FKOHMZHQVSWZSM-VWYCJHECSA-N -1 1 316.228 4.067 20 0 DIADMM Cc1cccc2nc(-c3ccccc3Br)[n-]c(=O)c12 ZINC000519311379 1042944253 /nfs/dbraw/zinc/94/42/53/1042944253.db2.gz GCMMOROROCQAPE-UHFFFAOYSA-N -1 1 315.170 4.073 20 0 DIADMM C[C@@H](NC(=O)c1c(F)ccc([O-])c1F)c1ccc(C2CC2)cc1 ZINC000416294750 1043015433 /nfs/dbraw/zinc/01/54/33/1043015433.db2.gz YVHVFUYRPNDWHV-SNVBAGLBSA-N -1 1 317.335 4.039 20 0 DIADMM O=C([O-])CCC1CCN(Cc2c(Cl)cccc2Cl)CC1 ZINC000050926199 1043064327 /nfs/dbraw/zinc/06/43/27/1043064327.db2.gz ODADRWYWTQJSMY-UHFFFAOYSA-N -1 1 316.228 4.070 20 0 DIADMM CC[C@@H](C)CO[N-]C(=O)[C@@H](C)c1ccc2cc(OC)ccc2c1 ZINC000794848580 1043108578 /nfs/dbraw/zinc/10/85/78/1043108578.db2.gz BZMJDKLNASXRDS-KGLIPLIRSA-N -1 1 315.413 4.046 20 0 DIADMM CCCCN(C(=O)c1cc(Cl)c([O-])c(OC)c1)[C@@H](C)CC ZINC000442974115 1043464118 /nfs/dbraw/zinc/46/41/18/1043464118.db2.gz PAIQJWOHKJHYME-NSHDSACASA-N -1 1 313.825 4.095 20 0 DIADMM COc1cc(-c2nc(CC3CCCCC3)no2)cc(Cl)c1[O-] ZINC000443214689 1043512275 /nfs/dbraw/zinc/51/22/75/1043512275.db2.gz LHSQZPCYRSYUFB-UHFFFAOYSA-N -1 1 322.792 4.227 20 0 DIADMM COc1cc(-c2nc([C@H]3CCC[C@H](C)C3)no2)cc(Cl)c1[O-] ZINC000443224744 1043516193 /nfs/dbraw/zinc/51/61/93/1043516193.db2.gz PDPYQMKBKBKVQX-UWVGGRQHSA-N -1 1 322.792 4.398 20 0 DIADMM CCOc1cc(-c2nc(C3CCCC3)no2)cc(Cl)c1[O-] ZINC000191164863 1043539595 /nfs/dbraw/zinc/53/95/95/1043539595.db2.gz HSPHCFRTHDXSJP-UHFFFAOYSA-N -1 1 308.765 4.152 20 0 DIADMM Cc1ccc(-c2ccc(CN(CC(=O)[O-])CC(C)(C)C)o2)cc1 ZINC000665350195 1043599092 /nfs/dbraw/zinc/59/90/92/1043599092.db2.gz GRXLLEFTJUYAQU-UHFFFAOYSA-N -1 1 315.413 4.188 20 0 DIADMM O=C1[N-]C(=O)C(=Cc2ccc(Sc3ccccc3)cc2)S1 ZINC000874927541 1043605735 /nfs/dbraw/zinc/60/57/35/1043605735.db2.gz DLLRNLGVNJVPJS-GXDHUFHOSA-N -1 1 313.403 4.162 20 0 DIADMM O=C1[N-]C(=O)C(=Cc2cccc(-c3ccc(Cl)cc3)c2)S1 ZINC000874929988 1043606411 /nfs/dbraw/zinc/60/64/11/1043606411.db2.gz UTQKXSHJBLQTOT-NTEUORMPSA-N -1 1 315.781 4.331 20 0 DIADMM CCC(=O)Nc1ccc(NCc2c([O-])ccc(Cl)c2F)cc1 ZINC000191064939 1043708658 /nfs/dbraw/zinc/70/86/58/1043708658.db2.gz UWPXUCAFGOHFDQ-UHFFFAOYSA-N -1 1 322.767 4.145 20 0 DIADMM CCc1ccc(S(=O)(=O)[N-]c2cc(C)ccc2Cl)s1 ZINC000474296400 1043730279 /nfs/dbraw/zinc/73/02/79/1043730279.db2.gz WAIKERQRVFYYMD-UHFFFAOYSA-N -1 1 315.847 4.073 20 0 DIADMM C/C(=C\C(=O)Nc1cc([O-])c(F)cc1F)c1cccc(Cl)c1 ZINC001141833867 1043735921 /nfs/dbraw/zinc/73/59/21/1043735921.db2.gz OHPSJXYEFZKWHR-WEVVVXLNSA-N -1 1 323.726 4.366 20 0 DIADMM Cc1ccc(C(F)(F)C(=O)Nc2ccc([O-])c(Cl)c2)cc1 ZINC000780991883 1043755488 /nfs/dbraw/zinc/75/54/88/1043755488.db2.gz OPLRMBUFHHVLJH-UHFFFAOYSA-N -1 1 311.715 4.085 20 0 DIADMM CC(C)(Cc1nc(-c2ccc([O-])c(F)c2)no1)CC(F)(F)F ZINC000896221442 1043861170 /nfs/dbraw/zinc/86/11/70/1043861170.db2.gz HQRRJNVMXWDWAJ-UHFFFAOYSA-N -1 1 318.270 4.102 20 0 DIADMM O=C(N[C@H]1CCSc2ccccc21)c1c([O-])cccc1Cl ZINC000148330167 1043903979 /nfs/dbraw/zinc/90/39/79/1043903979.db2.gz MFVVZGRFQIQQRO-LBPRGKRZSA-N -1 1 319.813 4.013 20 0 DIADMM C[C@@H](C(=O)[N-]OC1CCCCC1)c1ccccc1C(F)(F)F ZINC000777961948 1043996889 /nfs/dbraw/zinc/99/68/89/1043996889.db2.gz PLJZVWSGLCHKLN-LLVKDONJSA-N -1 1 315.335 4.189 20 0 DIADMM COc1cc(C(=O)Nc2cccc(SC)c2)cc(Cl)c1[O-] ZINC000357961934 1044001620 /nfs/dbraw/zinc/00/16/20/1044001620.db2.gz BJDNIFRMSZMJEK-UHFFFAOYSA-N -1 1 323.801 4.028 20 0 DIADMM CCSc1cccc(F)c1[N-]C(=O)c1scnc1CC ZINC000291646011 1044093475 /nfs/dbraw/zinc/09/34/75/1044093475.db2.gz LLCQYZQBJSAZDP-UHFFFAOYSA-N -1 1 310.419 4.209 20 0 DIADMM CC[C@H](C)Cc1c(C)sc2nc(-c3cc(C)on3)[n-]c(=O)c12 ZINC000358838709 1044103683 /nfs/dbraw/zinc/10/36/83/1044103683.db2.gz FRHOOWVWWVZUPH-QMMMGPOBSA-N -1 1 317.414 4.257 20 0 DIADMM CC(C)(CC(=O)NCc1ccc([O-])c(Cl)c1)CC(F)(F)F ZINC000881459669 1044117353 /nfs/dbraw/zinc/11/73/53/1044117353.db2.gz GKCZRKNOIQEKPR-UHFFFAOYSA-N -1 1 323.742 4.031 20 0 DIADMM Cc1ccc2[nH]c(-c3nc(-c4ccc([O-])cc4F)no3)cc2c1 ZINC000562476753 1044118218 /nfs/dbraw/zinc/11/82/18/1044118218.db2.gz VJEATLXAUZRYFV-UHFFFAOYSA-N -1 1 309.300 4.038 20 0 DIADMM Cc1cccc([C@H]([N-]c2nnc(C(C)(C)C)o2)c2ccccn2)c1 ZINC000882143934 1044153574 /nfs/dbraw/zinc/15/35/74/1044153574.db2.gz AJZCSVSRIHQRMT-INIZCTEOSA-N -1 1 322.412 4.272 20 0 DIADMM CC(C)(C)C[C@@H]([N-]C(=O)C(F)(F)c1ccccc1)C(F)(F)F ZINC000778131195 1044169963 /nfs/dbraw/zinc/16/99/63/1044169963.db2.gz VPFYLOIQOKPXID-LLVKDONJSA-N -1 1 323.305 4.262 20 0 DIADMM COc1ccc2oc([C@@H](C)[N-]c3nnc(C(F)F)o3)c(C)c2c1 ZINC000292509652 1044178892 /nfs/dbraw/zinc/17/88/92/1044178892.db2.gz OGOLHBIILIWXER-MRVPVSSYSA-N -1 1 323.299 4.244 20 0 DIADMM C[C@@H](CSc1nc(C(F)(F)F)cc(=O)[n-]1)c1ccccc1 ZINC000522830830 1044217481 /nfs/dbraw/zinc/21/74/81/1044217481.db2.gz ZRHOPBYCVYNLHF-VIFPVBQESA-N -1 1 314.332 4.097 20 0 DIADMM O=C(Nc1ccccc1SC(F)F)c1cc(F)ccc1[O-] ZINC000132859540 1044336283 /nfs/dbraw/zinc/33/62/83/1044336283.db2.gz GROUPKLOCVKTOA-UHFFFAOYSA-N -1 1 313.300 4.098 20 0 DIADMM Cc1cc(NC(=O)c2c(F)ccc([O-])c2F)ccc1C1CC1 ZINC000565628506 1044447334 /nfs/dbraw/zinc/44/73/34/1044447334.db2.gz ZKFFPYLXDDIMSM-UHFFFAOYSA-N -1 1 303.308 4.109 20 0 DIADMM Cc1nc(C(C)C)sc1[C@@H](C)N(C)Cc1ccoc1C(=O)[O-] ZINC000566625679 1044503958 /nfs/dbraw/zinc/50/39/58/1044503958.db2.gz YAECSVHZMBBTFO-LLVKDONJSA-N -1 1 322.430 4.059 20 0 DIADMM COc1ccc(NC(=O)Nc2ccc(Cl)cc2[O-])c(C)c1 ZINC001202727016 1044523435 /nfs/dbraw/zinc/52/34/35/1044523435.db2.gz DSHJHQDHAFJHHZ-UHFFFAOYSA-N -1 1 306.749 4.007 20 0 DIADMM O=C(Nc1cccc(F)c1[O-])c1c(Cl)oc2ccccc21 ZINC001648971826 1044551337 /nfs/dbraw/zinc/55/13/37/1044551337.db2.gz AIXMTJFEVUGRAC-UHFFFAOYSA-N -1 1 305.692 4.183 20 0 DIADMM CC(C)(C)OCc1cccc(NC(=O)c2ccc([O-])cc2F)c1 ZINC000885622406 1044579333 /nfs/dbraw/zinc/57/93/33/1044579333.db2.gz WYNAZAQYMJKZQF-UHFFFAOYSA-N -1 1 317.360 4.099 20 0 DIADMM CCCCCCO[C@@H](C)C(=O)Nc1cc(F)c([O-])cc1Cl ZINC000885678098 1044585291 /nfs/dbraw/zinc/58/52/91/1044585291.db2.gz JEQRVQIQQJMLLM-JTQLQIEISA-N -1 1 317.788 4.109 20 0 DIADMM CC[C@H](Cc1ccccc1)c1nc(-c2ccc([O-])c(F)c2)no1 ZINC000568172019 1044609220 /nfs/dbraw/zinc/60/92/20/1044609220.db2.gz JEIQISMHPLXBDG-CYBMUJFWSA-N -1 1 312.344 4.318 20 0 DIADMM CC(C)(Cc1ccccc1)c1nc(-c2ccc([O-])cc2F)no1 ZINC000445465486 1044724646 /nfs/dbraw/zinc/72/46/46/1044724646.db2.gz YUTVRSREEGNYHV-UHFFFAOYSA-N -1 1 312.344 4.102 20 0 DIADMM [O-]c1ccc(-c2noc(/C=C/c3c(F)cccc3F)n2)c(F)c1 ZINC000445465896 1044725382 /nfs/dbraw/zinc/72/53/82/1044725382.db2.gz VABUZEPIZUVEPI-VOTSOKGWSA-N -1 1 318.254 4.030 20 0 DIADMM [O-]c1ccc(-c2noc(-c3ccc(F)cc3Cl)n2)cc1F ZINC000445479158 1044730853 /nfs/dbraw/zinc/73/08/53/1044730853.db2.gz FMNXPGOUVVJUAT-UHFFFAOYSA-N -1 1 308.671 4.041 20 0 DIADMM [O-]c1ccc(-c2noc(-c3cccc(F)c3Cl)n2)cc1F ZINC000445480334 1044730990 /nfs/dbraw/zinc/73/09/90/1044730990.db2.gz IILNDGMYYVALJP-UHFFFAOYSA-N -1 1 308.671 4.041 20 0 DIADMM COc1cc(-c2nc(-c3cscc3C)no2)cc(Cl)c1[O-] ZINC000445626784 1044772702 /nfs/dbraw/zinc/77/27/02/1044772702.db2.gz MFSFZFVCSJBQEX-UHFFFAOYSA-N -1 1 322.773 4.141 20 0 DIADMM O=C(CCCc1ccccc1Cl)Nc1ccc(F)cc1[O-] ZINC000572926298 1044884659 /nfs/dbraw/zinc/88/46/59/1044884659.db2.gz ROAQEGXSMVMHCJ-UHFFFAOYSA-N -1 1 307.752 4.146 20 0 DIADMM CCOc1ncc(Nc2cc(Cl)cc(Cl)c2[O-])cc1F ZINC001212832251 1044925059 /nfs/dbraw/zinc/92/50/59/1044925059.db2.gz IKRZRCFBFBKNSJ-UHFFFAOYSA-N -1 1 317.147 4.375 20 0 DIADMM Cc1cc(-c2nc(=O)c3c(-c4ccccc4)csc3[n-]2)no1 ZINC000337667207 1044935833 /nfs/dbraw/zinc/93/58/33/1044935833.db2.gz QVQHIRFYGMDXQK-UHFFFAOYSA-N -1 1 309.350 4.027 20 0 DIADMM Cc1noc(C(C)C)c1[N-]C(=O)c1coc(C2CCCCC2)n1 ZINC000928786898 1044984539 /nfs/dbraw/zinc/98/45/39/1044984539.db2.gz GPWQQLWIYHQQHJ-UHFFFAOYSA-N -1 1 317.389 4.394 20 0 DIADMM Cc1c(=O)[n-]c(S[C@@H]2CC[C@H](C)C2)nc1-c1ccccc1 ZINC000575198444 1044991112 /nfs/dbraw/zinc/99/11/12/1044991112.db2.gz JLNCVYMQYAMKRU-SMDDNHRTSA-N -1 1 300.427 4.438 20 0 DIADMM Cc1ccsc1[C@H]1C[C@@H]1C(=O)Nc1ccc([O-])c(Cl)c1 ZINC000153640589 1045060263 /nfs/dbraw/zinc/06/02/63/1045060263.db2.gz YAXZGUWEMBSTIS-QWRGUYRKSA-N -1 1 307.802 4.158 20 0 DIADMM CC[C@H](C)[C@H](OC)C(=O)Nc1cc(Cl)c([O-])c2ccccc12 ZINC000529538388 1045493938 /nfs/dbraw/zinc/49/39/38/1045493938.db2.gz BQLGLKFTAKKQLF-QFYYESIMSA-N -1 1 321.804 4.198 20 0 DIADMM C/C(=C\c1ccc(F)cc1)C(=O)Nc1ccc([O-])c(Cl)c1 ZINC000750306237 1045518393 /nfs/dbraw/zinc/51/83/93/1045518393.db2.gz XILBTYFGSNDQHW-CSKARUKUSA-N -1 1 305.736 4.227 20 0 DIADMM O=C(Nc1cc(Cl)c([O-])c2ccccc12)[C@@H]1CCCSC1 ZINC000628233437 1045550751 /nfs/dbraw/zinc/55/07/51/1045550751.db2.gz CAXKHTLNUOJLCN-SNVBAGLBSA-N -1 1 321.829 4.281 20 0 DIADMM CC(C)(C)Oc1ccc(C(=O)Nc2ccc([O-])c(Cl)c2)cc1 ZINC000750862850 1045563194 /nfs/dbraw/zinc/56/31/94/1045563194.db2.gz CGNRLQLJAMFZTQ-UHFFFAOYSA-N -1 1 319.788 4.475 20 0 DIADMM CC[C@H](CC(=O)Nc1cccc(F)c1[O-])c1ccc(OC)cc1 ZINC000530005140 1045580707 /nfs/dbraw/zinc/58/07/07/1045580707.db2.gz IJHUVONTJJMAOK-GFCCVEGCSA-N -1 1 317.360 4.062 20 0 DIADMM Cc1oc(C(C)(C)C)cc1CN[C@@H](CC(=O)[O-])c1ccsc1 ZINC000900021306 1045589895 /nfs/dbraw/zinc/58/98/95/1045589895.db2.gz AUAWHPSKRJQJPD-AWEZNQCLSA-N -1 1 321.442 4.253 20 0 DIADMM C[C@@H]1C[C@@H](C(=O)[O-])C[C@H](C)N1Cc1ccc(Cl)cc1Cl ZINC000530175191 1045616345 /nfs/dbraw/zinc/61/63/45/1045616345.db2.gz OJDIYJGGULINCL-PEGIJTEDSA-N -1 1 316.228 4.067 20 0 DIADMM COc1cccc(/C(C)=C/C(=O)Nc2ccc([O-])c(Cl)c2)c1 ZINC000751619326 1045621895 /nfs/dbraw/zinc/62/18/95/1045621895.db2.gz XGAJNHXGEKIICQ-DHZHZOJOSA-N -1 1 317.772 4.096 20 0 DIADMM CSc1ccccc1[C@@H](C)NC(=O)c1c([O-])cccc1Cl ZINC000800578154 1045641225 /nfs/dbraw/zinc/64/12/25/1045641225.db2.gz NBSMHUURUPIOEE-SNVBAGLBSA-N -1 1 321.829 4.259 20 0 DIADMM [O-]c1ccc(Cl)c(F)c1CNc1ccc(-c2cnco2)cc1 ZINC000191393878 1045694555 /nfs/dbraw/zinc/69/45/55/1045694555.db2.gz MLFFPDXBTUAOFP-UHFFFAOYSA-N -1 1 318.735 4.452 20 0 DIADMM [O-]c1ccc(Cl)c(F)c1CNc1cccc(-c2ncco2)c1 ZINC000191480739 1045712432 /nfs/dbraw/zinc/71/24/32/1045712432.db2.gz KXWPVEIWINDBCC-UHFFFAOYSA-N -1 1 318.735 4.452 20 0 DIADMM N#Cc1ccc2c(c1)CC/C(=C\c1ccc([O-])c(Cl)c1)C2=O ZINC000078696742 1045758907 /nfs/dbraw/zinc/75/89/07/1045758907.db2.gz AMRIXSHEVDENDV-VGOFMYFVSA-N -1 1 309.752 4.130 20 0 DIADMM CC(C)CN(CC(=O)[O-])Cc1ccc(-c2ccccc2Cl)o1 ZINC000901589740 1045772549 /nfs/dbraw/zinc/77/25/49/1045772549.db2.gz FCRSWDGGLRJCDL-UHFFFAOYSA-N -1 1 321.804 4.143 20 0 DIADMM Cc1cc(C)c(/C=C\CN[C@@H](C(=O)[O-])c2cccs2)c(C)c1 ZINC000901597892 1045774925 /nfs/dbraw/zinc/77/49/25/1045774925.db2.gz JPYDNIATUYAFLN-XQDHMALISA-N -1 1 315.438 4.102 20 0 DIADMM CC[C@H](C)C[C@H](NCc1ccc(-c2ccc(F)cc2)o1)C(=O)[O-] ZINC000901674418 1045792168 /nfs/dbraw/zinc/79/21/68/1045792168.db2.gz ALFVKVIMNFATJI-LRDDRELGSA-N -1 1 319.376 4.065 20 0 DIADMM Cc1cc(Cl)ncc1NC(=O)Nc1ccc([O-])c(Cl)c1 ZINC000192237072 1045794451 /nfs/dbraw/zinc/79/44/51/1045794451.db2.gz GGRCMRIKAWKESD-UHFFFAOYSA-N -1 1 312.156 4.046 20 0 DIADMM CCCCC[C@H](NCc1cc2cc(C)c(C)cc2o1)C(=O)[O-] ZINC000901721530 1045798387 /nfs/dbraw/zinc/79/83/87/1045798387.db2.gz GZJOSHWOTBZLGL-INIZCTEOSA-N -1 1 303.402 4.173 20 0 DIADMM Cc1cc(CSc2nc(C)c(C3CC3)c(=O)[n-]2)c(C)s1 ZINC000631023138 1045798878 /nfs/dbraw/zinc/79/88/78/1045798878.db2.gz JISQXZZMOAMZRU-UHFFFAOYSA-N -1 1 306.456 4.339 20 0 DIADMM Cc1nc(S[C@H](C)c2c(F)cccc2F)[n-]c(=O)c1C1CC1 ZINC000631023589 1045798955 /nfs/dbraw/zinc/79/89/55/1045798955.db2.gz BINXDQSMBPPDKE-SECBINFHSA-N -1 1 322.380 4.500 20 0 DIADMM Cc1conc1C(=O)[N-]c1cccc(Cl)c1SC(C)C ZINC000631463016 1045860535 /nfs/dbraw/zinc/86/05/35/1045860535.db2.gz ZHEMHILLBVSRPR-UHFFFAOYSA-N -1 1 310.806 4.389 20 0 DIADMM Cc1ccc(NC(=O)Nc2c(F)cc([O-])cc2F)cc1Cl ZINC001202806907 1045889694 /nfs/dbraw/zinc/88/96/94/1045889694.db2.gz AURNOUHMSCFNBS-UHFFFAOYSA-N -1 1 312.703 4.276 20 0 DIADMM CCc1ccc(NC(=O)Cc2ccc([O-])c(Cl)c2)cc1C ZINC001137589810 1045899516 /nfs/dbraw/zinc/89/95/16/1045899516.db2.gz UVEQTFUFMWHHSF-UHFFFAOYSA-N -1 1 303.789 4.098 20 0 DIADMM CCc1oc(CN[C@H](c2ccc(C)cc2)C2CC2)cc1C(=O)[O-] ZINC000902088545 1045909439 /nfs/dbraw/zinc/90/94/39/1045909439.db2.gz SEVSZTNHAZZCPO-GOSISDBHSA-N -1 1 313.397 4.090 20 0 DIADMM Cc1c2cc(Cl)ccc2oc1C(=O)Nc1ccc(F)cc1[O-] ZINC000531756333 1045914658 /nfs/dbraw/zinc/91/46/58/1045914658.db2.gz OVUFCTONKNQYCN-UHFFFAOYSA-N -1 1 319.719 4.492 20 0 DIADMM CC(C)Oc1ccccc1[C@@H](C)NCc1csc(C(=O)[O-])c1 ZINC000902115805 1045916310 /nfs/dbraw/zinc/91/63/10/1045916310.db2.gz DLDWXXJAPHJHNJ-GFCCVEGCSA-N -1 1 319.426 4.084 20 0 DIADMM O=C(/C=C/CCc1ccccc1)Nc1ccc([O-])c(Cl)c1 ZINC001137674506 1045929607 /nfs/dbraw/zinc/92/96/07/1045929607.db2.gz WIOOTFNNWCKKBN-WEVVVXLNSA-N -1 1 301.773 4.173 20 0 DIADMM Cc1cc(CN[C@@H](c2ccc(F)cc2)C2CCC2)oc1C(=O)[O-] ZINC000902223509 1045950070 /nfs/dbraw/zinc/95/00/70/1045950070.db2.gz BWYWWIJSVLMRLD-MRXNPFEDSA-N -1 1 317.360 4.056 20 0 DIADMM CCc1oc(CN[C@H](C)c2cc(C)cc(C)c2)cc1C(=O)[O-] ZINC000902236289 1045954263 /nfs/dbraw/zinc/95/42/63/1045954263.db2.gz RHAODNVUBGGQEZ-CYBMUJFWSA-N -1 1 301.386 4.008 20 0 DIADMM Cc1oc(CN[C@H]2CCCc3ccc(Cl)cc32)cc1C(=O)[O-] ZINC000902262390 1045960121 /nfs/dbraw/zinc/96/01/21/1045960121.db2.gz WHAGFYLOTYOTIL-INIZCTEOSA-N -1 1 319.788 4.107 20 0 DIADMM Cc1ccnc2ccc(C(=O)Nc3ccc([O-])c(Cl)c3)cc12 ZINC000802825032 1046052845 /nfs/dbraw/zinc/05/28/45/1046052845.db2.gz JOFZGCSCSMPDHA-UHFFFAOYSA-N -1 1 312.756 4.155 20 0 DIADMM Cc1ncc(-c2ccccc2)cc1NC(=O)c1ccc([O-])cc1F ZINC001138041394 1046069392 /nfs/dbraw/zinc/06/93/92/1046069392.db2.gz YWTNVVLBJWMZHL-UHFFFAOYSA-N -1 1 322.339 4.154 20 0 DIADMM O=C(CCCc1ccc(Cl)cc1)Nc1ccc(F)cc1[O-] ZINC000532267459 1046125638 /nfs/dbraw/zinc/12/56/38/1046125638.db2.gz YELMKDAVDMPSDR-UHFFFAOYSA-N -1 1 307.752 4.146 20 0 DIADMM Cn1ccc2ccc(NC(=O)c3ccc4ccccc4c3[O-])cc21 ZINC001138291437 1046139440 /nfs/dbraw/zinc/13/94/40/1046139440.db2.gz PERPMQMASSIRBX-UHFFFAOYSA-N -1 1 316.360 4.289 20 0 DIADMM O=C(Nc1ccc([O-])c(Cl)c1)c1cc(F)cc(Cl)c1 ZINC000756985597 1046157864 /nfs/dbraw/zinc/15/78/64/1046157864.db2.gz HWZDBUKXNNMMNR-UHFFFAOYSA-N -1 1 300.116 4.090 20 0 DIADMM C[C@H]1CCN(C(=O)c2cc(Cl)ccc2[O-])CC12CCCCC2 ZINC001138547149 1046223126 /nfs/dbraw/zinc/22/31/26/1046223126.db2.gz JIZPLTQHBOXKEG-ZDUSSCGKSA-N -1 1 321.848 4.478 20 0 DIADMM [O-]c1cc(Nc2ccc(Br)cc2F)cc(F)c1F ZINC001212871127 1046245031 /nfs/dbraw/zinc/24/50/31/1046245031.db2.gz ZLGYDRLGOWJIHC-UHFFFAOYSA-N -1 1 318.092 4.316 20 0 DIADMM C[C@H](C(=O)[O-])N(C)Cc1ccc(-c2ccc(C(C)(C)C)cc2)o1 ZINC000263417968 1046316734 /nfs/dbraw/zinc/31/67/34/1046316734.db2.gz NXBLSJSQVKOZIS-CYBMUJFWSA-N -1 1 315.413 4.149 20 0 DIADMM CC[C@]1(C)CCCN(Cc2occ(C(F)(F)F)c2C(=O)[O-])C1 ZINC000903890692 1046338141 /nfs/dbraw/zinc/33/81/41/1046338141.db2.gz CBVUWKUMBXOWCN-CQSZACIVSA-N -1 1 319.323 4.009 20 0 DIADMM CCc1ccc(Cl)cc1[N-]S(=O)(=O)c1ccccc1C ZINC001254617788 1046430448 /nfs/dbraw/zinc/43/04/48/1046430448.db2.gz ABVUHGADOVHIKV-UHFFFAOYSA-N -1 1 309.818 4.012 20 0 DIADMM CC(C)c1ccc(NC(=O)Nc2cc(F)cc(F)c2[O-])cc1 ZINC001202924645 1046435096 /nfs/dbraw/zinc/43/50/96/1046435096.db2.gz SGGWCYUKVSIWMD-UHFFFAOYSA-N -1 1 306.312 4.438 20 0 DIADMM O=C(Nc1cc(F)c([O-])c(F)c1)Nc1cccc2ccccc21 ZINC000168446782 1046553607 /nfs/dbraw/zinc/55/36/07/1046553607.db2.gz NYDRLJORSRWXGI-UHFFFAOYSA-N -1 1 314.291 4.468 20 0 DIADMM O=C(c1cc2ccccc2cc1[O-])N1CC[C@H]1c1cccc(F)c1 ZINC000678313935 1046617429 /nfs/dbraw/zinc/61/74/29/1046617429.db2.gz KDNQDVXZSUJWFL-SFHVURJKSA-N -1 1 321.351 4.272 20 0 DIADMM O=C(Nc1ccc([O-])c(Cl)c1)C1CC(c2ccc(F)cc2)C1 ZINC000644653896 1046730314 /nfs/dbraw/zinc/73/03/14/1046730314.db2.gz XXYHLTILTBPTLY-UHFFFAOYSA-N -1 1 319.763 4.317 20 0 DIADMM CCN(Cc1[nH]c(C)c(C(=O)[O-])c1C)Cc1cccc(Cl)c1 ZINC001140496365 1046754181 /nfs/dbraw/zinc/75/41/81/1046754181.db2.gz CFKNJLLVFQKHRF-UHFFFAOYSA-N -1 1 320.820 4.005 20 0 DIADMM O=C([O-])c1ccccc1CN1CCC[C@@H]1c1cc(F)ccc1F ZINC001140504479 1046755518 /nfs/dbraw/zinc/75/55/18/1046755518.db2.gz URBWAIGIPAZFLU-QGZVFWFLSA-N -1 1 317.335 4.000 20 0 DIADMM [O-]c1cccc(CNc2ccc(-c3csnn3)cc2)c1Cl ZINC000645165901 1046772755 /nfs/dbraw/zinc/77/27/55/1046772755.db2.gz MJVCNTPHNORPLI-UHFFFAOYSA-N -1 1 317.801 4.176 20 0 DIADMM [O-]c1cccc(CNc2cc(F)ccc2OC(F)F)c1Cl ZINC000645166754 1046772962 /nfs/dbraw/zinc/77/29/62/1046772962.db2.gz AGRCLNJYXUMHDC-UHFFFAOYSA-N -1 1 317.694 4.398 20 0 DIADMM [O-]c1cccc(CNc2ccc3c(cnn3C(F)F)c2)c1Cl ZINC000645169402 1046773367 /nfs/dbraw/zinc/77/33/67/1046773367.db2.gz JCAXJFIBIYCNED-UHFFFAOYSA-N -1 1 323.730 4.403 20 0 DIADMM COc1ccc(OC(C)C)c(NCc2cccc([O-])c2Cl)c1 ZINC000645166731 1046773428 /nfs/dbraw/zinc/77/34/28/1046773428.db2.gz BPPCKHJRHAREBY-UHFFFAOYSA-N -1 1 321.804 4.454 20 0 DIADMM CC(C)Cn1ncc(NCc2cccc([O-])c2Cl)c1C1CC1 ZINC000645181214 1046775207 /nfs/dbraw/zinc/77/52/07/1046775207.db2.gz LUQBDTNRLJWRGE-UHFFFAOYSA-N -1 1 319.836 4.388 20 0 DIADMM C[C@@H]1C[C@@H]1c1ccc(CCC(=O)Nc2ccc([O-])c(Cl)c2)o1 ZINC000679643831 1046886071 /nfs/dbraw/zinc/88/60/71/1046886071.db2.gz LFGAOOXDEDHZIY-MFKMUULPSA-N -1 1 319.788 4.333 20 0 DIADMM CC(=O)Oc1ccc(Nc2c(Cl)ccc([O-])c2Cl)cc1 ZINC001212079905 1046930303 /nfs/dbraw/zinc/93/03/03/1046930303.db2.gz UTHLFRIGHOWOQW-UHFFFAOYSA-N -1 1 312.152 4.368 20 0 DIADMM COc1cccc([C@@H]2CCCN2Cc2ccc([O-])c(F)c2F)c1 ZINC001140893704 1046943912 /nfs/dbraw/zinc/94/39/12/1046943912.db2.gz ZICMJYGSHGZGDP-HNNXBMFYSA-N -1 1 319.351 4.016 20 0 DIADMM [O-]c1ccc(CN2CCC(c3ccccc3F)CC2)c(F)c1F ZINC001140893730 1046944143 /nfs/dbraw/zinc/94/41/43/1046944143.db2.gz GJFBHYGLUCKFPT-UHFFFAOYSA-N -1 1 321.342 4.189 20 0 DIADMM C[C@H]1c2c(Cl)cc(Cl)cc2CCN1CCCCC(=O)[O-] ZINC000262204508 1046963498 /nfs/dbraw/zinc/96/34/98/1046963498.db2.gz HWCBTWXAFGXEDR-JTQLQIEISA-N -1 1 316.228 4.167 20 0 DIADMM CCCCOc1ccc(NC(=O)c2ccc([O-])cc2F)c(C)c1 ZINC000162490657 1046996386 /nfs/dbraw/zinc/99/63/86/1046996386.db2.gz BBNDPILDKVFIHJ-UHFFFAOYSA-N -1 1 317.360 4.271 20 0 DIADMM O=C(Nc1ccccc1OC1CCCC1)c1ccc([O-])c(F)c1 ZINC000681017987 1047081948 /nfs/dbraw/zinc/08/19/48/1047081948.db2.gz GDRRVPUMHFNSJO-UHFFFAOYSA-N -1 1 315.344 4.105 20 0 DIADMM C[C@@H](c1ccccc1Cl)N(C)C(=O)c1ccc([O-])c(F)c1 ZINC000681017019 1047082261 /nfs/dbraw/zinc/08/22/61/1047082261.db2.gz BAGDGDKLZRANEJ-JTQLQIEISA-N -1 1 307.752 4.018 20 0 DIADMM C[C@H](c1ccccc1Cl)N(C)C(=O)c1ccc([O-])c(F)c1 ZINC000681017020 1047082440 /nfs/dbraw/zinc/08/24/40/1047082440.db2.gz BAGDGDKLZRANEJ-SNVBAGLBSA-N -1 1 307.752 4.018 20 0 DIADMM CC(C)Oc1ccc(NC(=O)c2ccc([O-])c(F)c2)cc1Cl ZINC000681018884 1047085252 /nfs/dbraw/zinc/08/52/52/1047085252.db2.gz QSRUVULBJZNBDQ-UHFFFAOYSA-N -1 1 323.751 4.224 20 0 DIADMM CC[C@@H](NC(=O)c1ccc([O-])c(F)c1)c1ccc(Cl)s1 ZINC000681046126 1047086924 /nfs/dbraw/zinc/08/69/24/1047086924.db2.gz CSXOKIWWNOYLOS-SNVBAGLBSA-N -1 1 313.781 4.127 20 0 DIADMM CCC[C@H](CCc1ccccc1)NC(=O)c1ccc([O-])c(F)c1 ZINC000681048986 1047087530 /nfs/dbraw/zinc/08/75/30/1047087530.db2.gz KOGOATDTBFBRER-MRXNPFEDSA-N -1 1 315.388 4.063 20 0 DIADMM C[C@@H](NC(=O)c1ccc([O-])c(F)c1)c1cc2ccccc2s1 ZINC000681042633 1047087785 /nfs/dbraw/zinc/08/77/85/1047087785.db2.gz AEYLKXMTXVKINJ-SNVBAGLBSA-N -1 1 315.369 4.237 20 0 DIADMM CCCn1ccc2ccc(NC(=O)c3ccc([O-])c(F)c3)cc21 ZINC000681052799 1047088140 /nfs/dbraw/zinc/08/81/40/1047088140.db2.gz UOCSQDGDMVIBJH-UHFFFAOYSA-N -1 1 312.344 4.148 20 0 DIADMM Cc1ccc(C)c([C@H]2CCCN2C(=O)c2ccc([O-])c(F)c2)c1 ZINC000681056265 1047089232 /nfs/dbraw/zinc/08/92/32/1047089232.db2.gz MRGKDAVAJMBLDV-QGZVFWFLSA-N -1 1 313.372 4.125 20 0 DIADMM Cc1cc(NC(=O)c2ccc([O-])c(F)c2)ccc1C(F)(F)F ZINC000681089284 1047092218 /nfs/dbraw/zinc/09/22/18/1047092218.db2.gz HRNAZKTYVDDUHV-UHFFFAOYSA-N -1 1 313.250 4.111 20 0 DIADMM CCCCN(C(=O)c1ccc([O-])c(F)c1)[C@@H]1CCC[C@@H](C)C1 ZINC001141522734 1047159910 /nfs/dbraw/zinc/15/99/10/1047159910.db2.gz QTJYTQVYOWATSF-UKRRQHHQSA-N -1 1 307.409 4.352 20 0 DIADMM CN(Cc1cc2ccccc2[nH]1)Cc1cccc([O-])c1Cl ZINC001117760178 1047242031 /nfs/dbraw/zinc/24/20/31/1047242031.db2.gz QDROGGMOYCYUQV-UHFFFAOYSA-N -1 1 300.789 4.159 20 0 DIADMM CC(C)Cc1ccc(CC(=O)Nc2cc([O-])c(F)cc2F)cc1 ZINC001141831657 1047296555 /nfs/dbraw/zinc/29/65/55/1047296555.db2.gz UCEIOQVYENNCIY-UHFFFAOYSA-N -1 1 319.351 4.050 20 0 DIADMM Cc1ccc(C(=O)Nc2cc([O-])c(F)cc2F)c2ccccc12 ZINC001141834198 1047296568 /nfs/dbraw/zinc/29/65/68/1047296568.db2.gz WGZLGJXHMFOSJR-UHFFFAOYSA-N -1 1 313.303 4.384 20 0 DIADMM CCON(Cc1ccccc1)C(=O)c1cc2ccccc2cc1[O-] ZINC001141891721 1047305355 /nfs/dbraw/zinc/30/53/55/1047305355.db2.gz GGISOLVZPKPHGX-UHFFFAOYSA-N -1 1 321.376 4.139 20 0 DIADMM Cc1ccccc1[C@@H]1CCCN1C(=O)c1c([O-])cccc1Cl ZINC001141948921 1047315282 /nfs/dbraw/zinc/31/52/82/1047315282.db2.gz FRDBPUPAEYIYOG-HNNXBMFYSA-N -1 1 315.800 4.331 20 0 DIADMM C=COc1ccc(NC(=O)c2cc3ccccc3cc2[O-])cc1 ZINC001141978751 1047328991 /nfs/dbraw/zinc/32/89/91/1047328991.db2.gz IKZZOVUOEAKTLQ-UHFFFAOYSA-N -1 1 305.333 4.320 20 0 DIADMM CC(C)CN(CCC(=O)[O-])Cc1csc(C2CCCCC2)n1 ZINC000652460301 1047362487 /nfs/dbraw/zinc/36/24/87/1047362487.db2.gz DOWXDGMQPRQPAC-UHFFFAOYSA-N -1 1 324.490 4.124 20 0 DIADMM Cc1cccc([C@@H]2CCCN2C(=O)c2ccc(Cl)cc2[O-])c1 ZINC001142073526 1047369178 /nfs/dbraw/zinc/36/91/78/1047369178.db2.gz JIQBZGBILDYISQ-INIZCTEOSA-N -1 1 315.800 4.331 20 0 DIADMM O=C(Nc1cc(F)cc(F)c1[O-])c1ccc(C2=CCCC2)cc1 ZINC001142542262 1047466946 /nfs/dbraw/zinc/46/69/46/1047466946.db2.gz ODQIFGDUYONAOV-UHFFFAOYSA-N -1 1 315.319 4.490 20 0 DIADMM CC(C)(C)[C@@H]1CCCC[C@@H]1CNC(=O)c1cccc([O-])c1F ZINC001142870734 1047507142 /nfs/dbraw/zinc/50/71/42/1047507142.db2.gz QIENZGGXOZENEB-TZMCWYRMSA-N -1 1 307.409 4.114 20 0 DIADMM C[C@H](c1cccs1)N(C)C(=O)c1cc2ccccc2cc1[O-] ZINC000121891377 1047531666 /nfs/dbraw/zinc/53/16/66/1047531666.db2.gz USDTTYLWWWNILB-GFCCVEGCSA-N -1 1 311.406 4.440 20 0 DIADMM Cc1cc(F)c2[nH]ccc2c1Nc1ccc(-n2ccc(=O)[n-]2)cc1 ZINC001212976989 1047559991 /nfs/dbraw/zinc/55/99/91/1047559991.db2.gz NITFAGCPTGVRGY-UHFFFAOYSA-N -1 1 322.343 4.250 20 0 DIADMM CC(C)(C)C1CCC(CNC(=O)c2cc(F)ccc2[O-])CC1 ZINC001149741441 1047568335 /nfs/dbraw/zinc/56/83/35/1047568335.db2.gz JUKLKQYNDUYILL-UHFFFAOYSA-N -1 1 307.409 4.114 20 0 DIADMM O=C(c1ccc(F)c([O-])c1)N1CCC[C@@H]1CCC1CCCCC1 ZINC001150805830 1047585716 /nfs/dbraw/zinc/58/57/16/1047585716.db2.gz JNMXCULIRJGXFJ-MRXNPFEDSA-N -1 1 319.420 4.496 20 0 DIADMM C[C@]1(NC(=O)c2ccc(Cl)cc2[O-])CCCc2ccccc21 ZINC001152106161 1047606899 /nfs/dbraw/zinc/60/68/99/1047606899.db2.gz GDFHEQQXSFBOTN-SFHVURJKSA-N -1 1 315.800 4.027 20 0 DIADMM O=C(c1cc(Cl)ccc1[O-])N1CCC[C@H](C2CCC2)CC1 ZINC001152804069 1047615511 /nfs/dbraw/zinc/61/55/11/1047615511.db2.gz UFRNNUXESCLYGW-ZDUSSCGKSA-N -1 1 307.821 4.088 20 0 DIADMM O=C(Cc1ccc([O-])c(Cl)c1)Nc1ccc(C2CC2)cc1 ZINC001152847474 1047616383 /nfs/dbraw/zinc/61/63/83/1047616383.db2.gz YOSHGQOAUYIVGK-UHFFFAOYSA-N -1 1 301.773 4.104 20 0 DIADMM CC[C@H](NC(=O)c1cc(Cl)ccc1[O-])c1ccc(C)c(F)c1 ZINC001152921658 1047617408 /nfs/dbraw/zinc/61/74/08/1047617408.db2.gz BDAWOWHKCFQACK-HNNXBMFYSA-N -1 1 321.779 4.374 20 0 DIADMM Cc1ccc(C)c([C@@H](C)NC(=O)c2ncc3ccccc3c2[O-])c1 ZINC001153076653 1047619901 /nfs/dbraw/zinc/61/99/01/1047619901.db2.gz QRDRHBIFLRZJDP-CQSZACIVSA-N -1 1 320.392 4.048 20 0 DIADMM O=C(Nc1ccc(Cl)cc1[O-])c1cc(C2CCCCC2)[nH]n1 ZINC001153460089 1047625172 /nfs/dbraw/zinc/62/51/72/1047625172.db2.gz AFNVZNDCNVOLNW-UHFFFAOYSA-N -1 1 319.792 4.069 20 0 DIADMM CC(C)(C)C1CCN(C(=O)c2c([O-])ccc3ccccc32)CC1 ZINC001153497265 1047625889 /nfs/dbraw/zinc/62/58/89/1047625889.db2.gz DLNADAWJKZXFQI-UHFFFAOYSA-N -1 1 311.425 4.444 20 0 DIADMM O=C(Nc1cnccc1C1CC1)c1c([O-])ccc2ccccc21 ZINC001153498303 1047625958 /nfs/dbraw/zinc/62/59/58/1047625958.db2.gz BZGBCKWULCNWQR-UHFFFAOYSA-N -1 1 304.349 4.070 20 0 DIADMM O=C(Nc1ccc(C(F)F)cn1)c1c([O-])ccc2ccccc21 ZINC001153498744 1047625982 /nfs/dbraw/zinc/62/59/82/1047625982.db2.gz JTXUVZYWCXNATB-UHFFFAOYSA-N -1 1 314.291 4.130 20 0 DIADMM C[C@@H]1CCN(C(=O)c2c([O-])ccc3ccccc32)CCC1(F)F ZINC001153499592 1047627128 /nfs/dbraw/zinc/62/71/28/1047627128.db2.gz YWHHRCUWIWPZSK-GFCCVEGCSA-N -1 1 319.351 4.053 20 0 DIADMM Cc1ccsc1CCCC(=O)NCc1ccc([O-])c(Cl)c1 ZINC001154105921 1047640200 /nfs/dbraw/zinc/64/02/00/1047640200.db2.gz RTDOSRHHSIZKIG-UHFFFAOYSA-N -1 1 323.845 4.055 20 0 DIADMM CC(C)CC1(C(=O)NCc2ccc([O-])c(Cl)c2)CCCC1 ZINC001154105698 1047640473 /nfs/dbraw/zinc/64/04/73/1047640473.db2.gz NFVDAEZHQZGMMP-UHFFFAOYSA-N -1 1 309.837 4.268 20 0 DIADMM CC(C)[C@H]1CC[C@H](C(=O)NCc2ccc([O-])c(Cl)c2)CC1 ZINC001154105600 1047640517 /nfs/dbraw/zinc/64/05/17/1047640517.db2.gz IUVQFFCALKEFEP-HDJSIYSDSA-N -1 1 309.837 4.124 20 0 DIADMM CC(C)c1ccc2c(c1)[C@@H](NC(=O)c1cc(F)ccc1[O-])CC2 ZINC001155016480 1047665243 /nfs/dbraw/zinc/66/52/43/1047665243.db2.gz PYOAHMKXQBURHT-KRWDZBQOSA-N -1 1 313.372 4.072 20 0 DIADMM CC(C)c1ccc2c(c1)[C@@H](NC(=O)c1ccc(F)c([O-])c1)CC2 ZINC001155027287 1047665257 /nfs/dbraw/zinc/66/52/57/1047665257.db2.gz XGFCDPOIERLZLY-KRWDZBQOSA-N -1 1 313.372 4.072 20 0 DIADMM C[C@@H]1[C@@H](C(=O)Nc2cc(F)c([O-])cc2Cl)[C@@H]1c1ccccc1 ZINC001157899239 1047763167 /nfs/dbraw/zinc/76/31/67/1047763167.db2.gz DBFHZXIWFSALEX-BNGAFQBXSA-N -1 1 319.763 4.173 20 0 DIADMM C[C@@H]1[C@H](C(=O)Nc2cc(F)c([O-])cc2Cl)[C@H]1c1ccccc1 ZINC001157899240 1047763199 /nfs/dbraw/zinc/76/31/99/1047763199.db2.gz DBFHZXIWFSALEX-OBPXBXINSA-N -1 1 319.763 4.173 20 0 DIADMM C[C@@H]1[C@@H](C(=O)Nc2cc(F)c([O-])cc2Cl)[C@H]1c1ccccc1 ZINC001157899241 1047763651 /nfs/dbraw/zinc/76/36/51/1047763651.db2.gz DBFHZXIWFSALEX-OZUAJXCXSA-N -1 1 319.763 4.173 20 0 DIADMM O=C([O-])c1cc(Nc2ccc3c[nH]nc3c2)cc(C(F)(F)F)c1 ZINC001159662962 1047897118 /nfs/dbraw/zinc/89/71/18/1047897118.db2.gz NMJRYEDDFOQLRI-UHFFFAOYSA-N -1 1 321.258 4.024 20 0 DIADMM O=C([O-])c1cc(Nc2ccc3nc[nH]c3c2)c(Cl)cc1Cl ZINC001160222988 1048003266 /nfs/dbraw/zinc/00/32/66/1048003266.db2.gz CWWIYAZXNPEUNO-UHFFFAOYSA-N -1 1 322.151 4.312 20 0 DIADMM O=S(=O)([N-]c1cc2cccccc-2c1)c1ccc2occc2c1 ZINC001198826487 1048006826 /nfs/dbraw/zinc/00/68/26/1048006826.db2.gz NEHMSUHPKQOCJO-UHFFFAOYSA-N -1 1 323.373 4.338 20 0 DIADMM O=c1oc2cc([O-])ccc2cc1Nc1ccc2ccccc2c1 ZINC001174872676 1048010118 /nfs/dbraw/zinc/01/01/18/1048010118.db2.gz SIAUDAZFKADQQJ-UHFFFAOYSA-N -1 1 303.317 4.395 20 0 DIADMM Cc1cccc(Cl)c1NC(=O)Nc1cc(F)cc(F)c1[O-] ZINC001184547710 1048052947 /nfs/dbraw/zinc/05/29/47/1048052947.db2.gz YVOYRBILZOYIAD-UHFFFAOYSA-N -1 1 312.703 4.276 20 0 DIADMM Cc1c(Cl)cccc1NC(=O)Nc1cc(F)cc(F)c1[O-] ZINC001184686314 1048083396 /nfs/dbraw/zinc/08/33/96/1048083396.db2.gz QYMCZOKMUXLEEJ-UHFFFAOYSA-N -1 1 312.703 4.276 20 0 DIADMM CCOc1cc(F)c(Nc2cc(F)c([O-])cc2F)cc1F ZINC001175058818 1048086468 /nfs/dbraw/zinc/08/64/68/1048086468.db2.gz TZZNKQUTLMOHGQ-UHFFFAOYSA-N -1 1 301.239 4.091 20 0 DIADMM O=C(Nc1ccc(F)cc1[O-])[C@@H]1C[C@@H]1c1cccc2ccccc21 ZINC001161035894 1048104779 /nfs/dbraw/zinc/10/47/79/1048104779.db2.gz VDPPVAUWVPMJFK-IAGOWNOFSA-N -1 1 321.351 4.427 20 0 DIADMM C[C@@H](NC(=O)Nc1cc([O-])c(Cl)cc1F)c1ccccc1 ZINC001185013857 1048112954 /nfs/dbraw/zinc/11/29/54/1048112954.db2.gz YJUUVFRTCXDEHG-SECBINFHSA-N -1 1 308.740 4.067 20 0 DIADMM CCC[C@H](NC(=O)c1ccc(C(F)(F)F)c([O-])c1)C1CCC1 ZINC001161465831 1048132383 /nfs/dbraw/zinc/13/23/83/1048132383.db2.gz GONAFTQDMPHANH-ZDUSSCGKSA-N -1 1 315.335 4.110 20 0 DIADMM CCOc1ccc(Nc2c([O-])cc(F)cc2F)c(F)c1F ZINC001175152232 1048144633 /nfs/dbraw/zinc/14/46/33/1048144633.db2.gz LDSQUORDJNSPTQ-UHFFFAOYSA-N -1 1 301.239 4.091 20 0 DIADMM [O-]c1cc(Cl)c(Nc2cc(CO)ccc2F)cc1Cl ZINC001175131604 1048156094 /nfs/dbraw/zinc/15/60/94/1048156094.db2.gz IFFALSKVVJRXOI-UHFFFAOYSA-N -1 1 302.132 4.074 20 0 DIADMM COc1ccc(C(=O)Nc2ccc(Cl)c(SC)c2)c([O-])c1 ZINC001161854985 1048187156 /nfs/dbraw/zinc/18/71/56/1048187156.db2.gz GBTUMYBCWYXREO-UHFFFAOYSA-N -1 1 323.801 4.028 20 0 DIADMM CCc1c(Cl)cc(Nc2ccc(N)nc2F)c([O-])c1Cl ZINC001203620165 1048202263 /nfs/dbraw/zinc/20/22/63/1048202263.db2.gz BKZYIRCCULXHCK-UHFFFAOYSA-N -1 1 316.163 4.121 20 0 DIADMM Cc1cc(C)cc(NC(=S)Nc2c(F)cc([O-])cc2F)c1 ZINC001201207904 1048217393 /nfs/dbraw/zinc/21/73/93/1048217393.db2.gz CLMVVOURKKLNFU-UHFFFAOYSA-N -1 1 308.353 4.096 20 0 DIADMM CCOc1ccc(Nc2ccc(-n3ccc(=O)[n-]3)cc2)c(C)c1 ZINC001175246889 1048219952 /nfs/dbraw/zinc/21/99/52/1048219952.db2.gz GUZJHCDDRMGZDJ-UHFFFAOYSA-N -1 1 309.369 4.029 20 0 DIADMM CCCOc1c(F)c(F)c([N-]c2nc(C)co2)c(F)c1F ZINC001201300725 1048232527 /nfs/dbraw/zinc/23/25/27/1048232527.db2.gz VVXOPBPRGPYYES-UHFFFAOYSA-N -1 1 304.243 4.072 20 0 DIADMM [O-]c1ccc(Cc2c(F)cccc2C(F)(F)F)c(F)c1F ZINC001250229961 1048265858 /nfs/dbraw/zinc/26/58/58/1048265858.db2.gz NTTPVUNWEAEZMD-UHFFFAOYSA-N -1 1 306.205 4.419 20 0 DIADMM Cc1ccc(-n2cc([N-]c3nc(C(C)C)ns3)cn2)c(C)c1 ZINC001186143213 1048266961 /nfs/dbraw/zinc/26/69/61/1048266961.db2.gz AOJIQKSODVWCCZ-UHFFFAOYSA-N -1 1 313.430 4.208 20 0 DIADMM COC(=O)c1cccc(Nc2c(F)ccc([O-])c2Cl)c1C ZINC001250233045 1048269785 /nfs/dbraw/zinc/26/97/85/1048269785.db2.gz HTTYTYPZGXMNPT-UHFFFAOYSA-N -1 1 309.724 4.023 20 0 DIADMM C[C@@H]1CN(C(=O)c2ccc(C(F)(F)F)c([O-])c2)c2ccccc21 ZINC001162450692 1048281558 /nfs/dbraw/zinc/28/15/58/1048281558.db2.gz FQKPIWDIZOHMLP-SNVBAGLBSA-N -1 1 321.298 4.175 20 0 DIADMM O=c1oc2cc([O-])ccc2cc1Nc1cccc2ccsc21 ZINC001175377403 1048286321 /nfs/dbraw/zinc/28/63/21/1048286321.db2.gz LGERLIGGHFHYPR-UHFFFAOYSA-N -1 1 309.346 4.457 20 0 DIADMM CCCC[C@@H]1CCC[C@H]1[N-]S(=O)(=O)c1cc2ccccc2o1 ZINC001186540783 1048315771 /nfs/dbraw/zinc/31/57/71/1048315771.db2.gz LTINPXZHVRCJCM-UKRRQHHQSA-N -1 1 321.442 4.070 20 0 DIADMM [O-]c1ccc(Cl)c(Nc2ccc3nccnc3c2)c1Cl ZINC001175490333 1048326970 /nfs/dbraw/zinc/32/69/70/1048326970.db2.gz AGIMMHNRYYHAPP-UHFFFAOYSA-N -1 1 306.152 4.386 20 0 DIADMM [O-]c1c(Cl)cc(Cl)cc1Nc1ccc2nccnc2c1 ZINC001175490346 1048327523 /nfs/dbraw/zinc/32/75/23/1048327523.db2.gz AZMDBJVQVQAOSE-UHFFFAOYSA-N -1 1 306.152 4.386 20 0 DIADMM Cn1cc2cccc(Nc3cc(Cl)c([O-])cc3Cl)c2n1 ZINC001175459693 1048333733 /nfs/dbraw/zinc/33/37/33/1048333733.db2.gz QVCUUZBPLUUZTI-UHFFFAOYSA-N -1 1 308.168 4.329 20 0 DIADMM CC(C)(C)OC(=O)c1cccc([N-]c2nnc(C(C)(C)C)o2)c1 ZINC001175545005 1048334688 /nfs/dbraw/zinc/33/46/88/1048334688.db2.gz DXAUNYVVDTXHKT-UHFFFAOYSA-N -1 1 317.389 4.066 20 0 DIADMM CSc1ccccc1NC(=O)Nc1c(F)cc([O-])cc1F ZINC001186744168 1048337003 /nfs/dbraw/zinc/33/70/03/1048337003.db2.gz CVPXVBMGDPJKIU-UHFFFAOYSA-N -1 1 310.325 4.036 20 0 DIADMM O=C(Nc1ccccc1F)Nc1cc(Cl)c(Cl)cc1[O-] ZINC001202002992 1048427753 /nfs/dbraw/zinc/42/77/53/1048427753.db2.gz XHNHNRXOLDTSMQ-UHFFFAOYSA-N -1 1 315.131 4.482 20 0 DIADMM CC(C)(C)CCCCC(=O)Nc1ccc(-c2cc(=O)[nH][n-]2)cc1 ZINC000481564793 1048431029 /nfs/dbraw/zinc/43/10/29/1048431029.db2.gz FRGPIMYOOFIAMW-UHFFFAOYSA-N -1 1 315.417 4.327 20 0 DIADMM Cc1cscc1Nc1ccc(F)c(Br)c1[O-] ZINC001175770407 1048445711 /nfs/dbraw/zinc/44/57/11/1048445711.db2.gz JTFOSUXULLPSGJ-UHFFFAOYSA-N -1 1 302.168 4.407 20 0 DIADMM CCS(=O)(=O)c1ccc([O-])c(Nc2cccc(C(C)C)c2)c1 ZINC001175776385 1048448592 /nfs/dbraw/zinc/44/85/92/1048448592.db2.gz OOZYCCMHSNTZQJ-UHFFFAOYSA-N -1 1 319.426 4.053 20 0 DIADMM CC(C)(C)c1nsc([N-]c2cnn(C3CCCCC3)c2)n1 ZINC001175879586 1048469692 /nfs/dbraw/zinc/46/96/92/1048469692.db2.gz RNPOVDAAMOSVCF-UHFFFAOYSA-N -1 1 305.451 4.281 20 0 DIADMM c1coc(-c2nnc([N-]c3ccc(-c4cccnc4)cc3)o2)c1 ZINC001175889213 1048475133 /nfs/dbraw/zinc/47/51/33/1048475133.db2.gz VZPMWNXKURFLFN-UHFFFAOYSA-N -1 1 304.309 4.135 20 0 DIADMM CSc1ccc(NC(=O)Nc2cc([O-])c(F)cc2F)cc1 ZINC001188109382 1048475838 /nfs/dbraw/zinc/47/58/38/1048475838.db2.gz AFZKHBZEMXCVRK-UHFFFAOYSA-N -1 1 310.325 4.036 20 0 DIADMM CCCc1cc(=O)[n-]c(SCCSc2ccc(F)cc2)n1 ZINC001188154839 1048487587 /nfs/dbraw/zinc/48/75/87/1048487587.db2.gz PIJKJULGPIPCCM-UHFFFAOYSA-N -1 1 324.446 4.158 20 0 DIADMM CCCc1cc(=O)[n-]c(S[C@H](CCOC)c2ccccc2)n1 ZINC001188161421 1048488103 /nfs/dbraw/zinc/48/81/03/1048488103.db2.gz AGFCWCPNWLRCET-OAHLLOKOSA-N -1 1 318.442 4.005 20 0 DIADMM O=C(Nc1cccc(C(F)(F)F)c1)Nc1ccc(F)cc1[O-] ZINC001202296273 1048513186 /nfs/dbraw/zinc/51/31/86/1048513186.db2.gz FONFRUNTZSLWMX-UHFFFAOYSA-N -1 1 314.238 4.194 20 0 DIADMM O=C(Nc1ccc2ccccc2c1)Nc1cc([O-])c(F)cc1F ZINC001188611567 1048528585 /nfs/dbraw/zinc/52/85/85/1048528585.db2.gz PNESFXXCAZTYSI-UHFFFAOYSA-N -1 1 314.291 4.468 20 0 DIADMM O=C(Nc1ccc(Cl)cc1)Nc1cc([O-])c(Cl)cc1F ZINC001202375649 1048536094 /nfs/dbraw/zinc/53/60/94/1048536094.db2.gz FOWIZWXZJSXGBA-UHFFFAOYSA-N -1 1 315.131 4.482 20 0 DIADMM CCC(C)(C)c1ccc(CSc2nc(C(=O)OC)c[n-]2)cc1 ZINC001189166612 1048603430 /nfs/dbraw/zinc/60/34/30/1048603430.db2.gz STFBCZRFEZPQCU-UHFFFAOYSA-N -1 1 318.442 4.176 20 0 DIADMM O=c1cc(CSc2cc(F)ccc2F)c2ccc([O-])cc2o1 ZINC000007068616 1048604413 /nfs/dbraw/zinc/60/44/13/1048604413.db2.gz JNDIMPSSYVTETA-UHFFFAOYSA-N -1 1 320.316 4.069 20 0 DIADMM O=C(Nc1cccc(Cl)c1Cl)Nc1c([O-])cccc1F ZINC001189221171 1048604877 /nfs/dbraw/zinc/60/48/77/1048604877.db2.gz NJYQCRAOIHEBBA-UHFFFAOYSA-N -1 1 315.131 4.482 20 0 DIADMM COc1ccc(Nc2cc(Cl)c([O-])cc2Cl)cc1O ZINC001176259101 1048625450 /nfs/dbraw/zinc/62/54/50/1048625450.db2.gz YQCCNNFSECQJCF-UHFFFAOYSA-N -1 1 300.141 4.157 20 0 DIADMM CC(C)(C)c1ccccc1NC(=O)Nc1ccc(F)cc1[O-] ZINC001189589824 1048643185 /nfs/dbraw/zinc/64/31/85/1048643185.db2.gz ZPVSDYSXSRVRCG-UHFFFAOYSA-N -1 1 302.349 4.473 20 0 DIADMM CCC[C@@H](C)CCNC(=O)c1cc(Cl)c([O-])c(OCC)c1 ZINC001176313286 1048648239 /nfs/dbraw/zinc/64/82/39/1048648239.db2.gz VFIACCSQXIXELJ-LLVKDONJSA-N -1 1 313.825 4.000 20 0 DIADMM CCc1cccc(CC)c1NC(=O)Nc1ccc(F)cc1[O-] ZINC001189769470 1048664350 /nfs/dbraw/zinc/66/43/50/1048664350.db2.gz PDYKKNCGPIIPNJ-UHFFFAOYSA-N -1 1 302.349 4.300 20 0 DIADMM Cc1nc(SCc2cccc(F)c2Cl)[n-]c(=O)c1C1CC1 ZINC001189893097 1048676659 /nfs/dbraw/zinc/67/66/59/1048676659.db2.gz YGEOMDDHPBZLRD-UHFFFAOYSA-N -1 1 324.808 4.453 20 0 DIADMM CCc1cccc(C)c1NC(=O)Nc1cc(F)c([O-])c(F)c1 ZINC001189979177 1048686184 /nfs/dbraw/zinc/68/61/84/1048686184.db2.gz FZAVSPNICUYKHA-UHFFFAOYSA-N -1 1 306.312 4.185 20 0 DIADMM [O-]c1c(Nc2cccc(OC(F)(F)F)c2)ccc(F)c1F ZINC001176539978 1048711600 /nfs/dbraw/zinc/71/16/00/1048711600.db2.gz MULPYGXKHOBHEB-UHFFFAOYSA-N -1 1 305.202 4.313 20 0 DIADMM [O-]c1cc(Nc2cccc(OC(F)(F)F)c2)cc(F)c1F ZINC001176540684 1048711679 /nfs/dbraw/zinc/71/16/79/1048711679.db2.gz IEHRJXYYOPEMPW-UHFFFAOYSA-N -1 1 305.202 4.313 20 0 DIADMM CC(C)[C@@H](CC1CCCCC1)C(=O)[N-]Oc1ccc(F)cc1 ZINC001165800198 1048717878 /nfs/dbraw/zinc/71/78/78/1048717878.db2.gz JBCWRVQCQVJNOP-QGZVFWFLSA-N -1 1 307.409 4.478 20 0 DIADMM CC(C)[C@H](CC1CCCCC1)C(=O)[N-]Oc1ccc(F)cc1 ZINC001165800197 1048718099 /nfs/dbraw/zinc/71/80/99/1048718099.db2.gz JBCWRVQCQVJNOP-KRWDZBQOSA-N -1 1 307.409 4.478 20 0 DIADMM Cc1nc(SCC[C@H]2CCc3ccccc32)[n-]c(=O)c1C ZINC001165916565 1048724294 /nfs/dbraw/zinc/72/42/94/1048724294.db2.gz ACIBAOOLAQBYSQ-CQSZACIVSA-N -1 1 300.427 4.011 20 0 DIADMM O=c1cc(C(F)F)nc(SC[C@H]2CCCc3ccccc32)[n-]1 ZINC001166296337 1048743517 /nfs/dbraw/zinc/74/35/17/1048743517.db2.gz ZBVIKGUQPVHIGU-LLVKDONJSA-N -1 1 322.380 4.332 20 0 DIADMM CCc1nc(S[C@H](C)c2ccc3c(c2)CCC3)[n-]c(=O)c1C ZINC001166307353 1048744122 /nfs/dbraw/zinc/74/41/22/1048744122.db2.gz DDZWCRZKQDFKOY-GFCCVEGCSA-N -1 1 314.454 4.395 20 0 DIADMM O=S(=O)([N-]c1cccc(C2CC2)c1)c1ccc(C2CC2)cc1 ZINC001190506936 1048746487 /nfs/dbraw/zinc/74/64/87/1048746487.db2.gz OMACIFBOBVRAMR-UHFFFAOYSA-N -1 1 313.422 4.242 20 0 DIADMM COc1cc(C)c(C)cc1NC(=O)c1cc2ccccc2cc1[O-] ZINC001166386264 1048749130 /nfs/dbraw/zinc/74/91/30/1048749130.db2.gz QNDQQCQATNVEBH-UHFFFAOYSA-N -1 1 321.376 4.423 20 0 DIADMM Cc1cc(Nc2c(F)cc(F)c([O-])c2F)nc2ccccc12 ZINC001176663867 1048752064 /nfs/dbraw/zinc/75/20/64/1048752064.db2.gz MSAGVFTUMKDOGF-UHFFFAOYSA-N -1 1 304.271 4.410 20 0 DIADMM COc1cccc2cc(Nc3c(F)cc(F)c([O-])c3F)cnc21 ZINC001176663691 1048752881 /nfs/dbraw/zinc/75/28/81/1048752881.db2.gz KYJSIJMPNXSKKG-UHFFFAOYSA-N -1 1 320.270 4.110 20 0 DIADMM [O-]c1c(F)cc(F)c(Nc2nc(C(F)(F)F)cs2)c1F ZINC001176663853 1048753655 /nfs/dbraw/zinc/75/36/55/1048753655.db2.gz MMVGWQFEBPJJHL-UHFFFAOYSA-N -1 1 314.210 4.028 20 0 DIADMM CCOc1ccc(F)cc1Nc1c(F)cc(F)c([O-])c1F ZINC001176672446 1048754059 /nfs/dbraw/zinc/75/40/59/1048754059.db2.gz VXCZGJHVTVCSPV-UHFFFAOYSA-N -1 1 301.239 4.091 20 0 DIADMM Cc1nc2cc(Nc3c(F)cc(F)c([O-])c3F)ccc2s1 ZINC001176670209 1048754212 /nfs/dbraw/zinc/75/42/12/1048754212.db2.gz URPHHYNJLXPCEM-UHFFFAOYSA-N -1 1 310.300 4.471 20 0 DIADMM [O-]c1c(F)cc(F)c(Nc2ccsc2Br)c1F ZINC001176670521 1048754544 /nfs/dbraw/zinc/75/45/44/1048754544.db2.gz XLUUXSADHDFUIY-UHFFFAOYSA-N -1 1 324.121 4.377 20 0 DIADMM Nc1cccc(C(F)(F)F)c1Nc1c(F)cc(F)c([O-])c1F ZINC001176671399 1048755404 /nfs/dbraw/zinc/75/54/04/1048755404.db2.gz YAFXKSFYQLQWHT-UHFFFAOYSA-N -1 1 322.208 4.154 20 0 DIADMM [O-]c1c(F)cc(F)c(Nc2c(F)cc(Cl)cc2F)c1F ZINC001176672060 1048755736 /nfs/dbraw/zinc/75/57/36/1048755736.db2.gz CTJGCLBZGWIJAL-UHFFFAOYSA-N -1 1 309.621 4.485 20 0 DIADMM [O-]c1c(F)cc(F)c(Nc2cc(-c3ccccc3)cnn2)c1F ZINC001176669658 1048756199 /nfs/dbraw/zinc/75/61/99/1048756199.db2.gz JOYKXRHOSFCCMZ-UHFFFAOYSA-N -1 1 317.270 4.010 20 0 DIADMM Nc1cc(Nc2c(F)cc(F)c([O-])c2F)cc(C(F)(F)F)c1 ZINC001176671769 1048756345 /nfs/dbraw/zinc/75/63/45/1048756345.db2.gz OGNUWGRVJQKGAM-UHFFFAOYSA-N -1 1 322.208 4.154 20 0 DIADMM CC(C)Oc1cc(F)ccc1Nc1c(F)cc(F)c([O-])c1F ZINC001176674097 1048757219 /nfs/dbraw/zinc/75/72/19/1048757219.db2.gz PMPNLYMDPIKQHT-UHFFFAOYSA-N -1 1 315.266 4.479 20 0 DIADMM CCOc1ccc(Nc2c(F)cc(F)c([O-])c2F)cc1F ZINC001176674233 1048757306 /nfs/dbraw/zinc/75/73/06/1048757306.db2.gz SCOBNDZMOBYKDC-UHFFFAOYSA-N -1 1 301.239 4.091 20 0 DIADMM Cc1cc(Nc2c(F)cc(F)c([O-])c2F)n(-c2ccccc2)n1 ZINC001176661760 1048767492 /nfs/dbraw/zinc/76/74/92/1048767492.db2.gz CPYNGPGEZSTJLS-UHFFFAOYSA-N -1 1 319.286 4.047 20 0 DIADMM [O-]c1c(F)cc(F)c(Nc2cc(-c3ccccc3)no2)c1F ZINC001176663144 1048769101 /nfs/dbraw/zinc/76/91/01/1048769101.db2.gz CAPMNLDTRKJWRI-UHFFFAOYSA-N -1 1 306.243 4.208 20 0 DIADMM [O-]c1c(F)cc(F)c(Nc2cc(-c3ccncn3)cs2)c1F ZINC001176663342 1048769570 /nfs/dbraw/zinc/76/95/70/1048769570.db2.gz FTLBJUKKYZQPTI-UHFFFAOYSA-N -1 1 323.299 4.072 20 0 DIADMM [O-]c1c(F)cc(F)c(Nc2cnc(Cl)c(Cl)c2)c1F ZINC001176663260 1048769694 /nfs/dbraw/zinc/76/96/94/1048769694.db2.gz FGGLFBRMWMUQMA-UHFFFAOYSA-N -1 1 309.074 4.255 20 0 DIADMM CC(C)c1ccc(C(=O)Nc2ncsc2C2CC2)c([O-])c1 ZINC001176738665 1048775917 /nfs/dbraw/zinc/77/59/17/1048775917.db2.gz PNEKFDHFGPCFIW-UHFFFAOYSA-N -1 1 302.399 4.102 20 0 DIADMM CC[C@H](C)c1ccc(C(=O)NCc2ccc([O-])c(Cl)c2)cc1 ZINC001176987652 1048811760 /nfs/dbraw/zinc/81/17/60/1048811760.db2.gz ASBJCFVWNDHWQF-LBPRGKRZSA-N -1 1 317.816 4.489 20 0 DIADMM CC(C)(C)c1cccc(C(=O)NCc2ccc([O-])c(Cl)c2)c1 ZINC001176994454 1048813319 /nfs/dbraw/zinc/81/33/19/1048813319.db2.gz SXJKFERLBDHHTK-UHFFFAOYSA-N -1 1 317.816 4.273 20 0 DIADMM C[C@@H](C(=O)NCc1ccc([O-])c(Cl)c1)c1cccc(Cl)c1 ZINC001176988318 1048814032 /nfs/dbraw/zinc/81/40/32/1048814032.db2.gz KNJWSRMBDZQIFS-SNVBAGLBSA-N -1 1 324.207 4.119 20 0 DIADMM CC(C)(C)c1ccc(NC(=O)Nc2ccc(F)cc2[O-])cc1 ZINC001191151385 1048866225 /nfs/dbraw/zinc/86/62/25/1048866225.db2.gz IHYNQYXXKGKNHO-UHFFFAOYSA-N -1 1 302.349 4.473 20 0 DIADMM Cc1coc(CN[C@H](CC(=O)[O-])c2ccc(C(C)C)cc2)c1 ZINC000904001912 1048939956 /nfs/dbraw/zinc/93/99/56/1048939956.db2.gz JWLTWQBKYCJSEJ-QGZVFWFLSA-N -1 1 301.386 4.017 20 0 DIADMM O=C([O-])C[C@H](NCc1cccc(C2CC2)c1)c1ccccc1F ZINC000904045419 1048962036 /nfs/dbraw/zinc/96/20/36/1048962036.db2.gz JECZMMLNXQOTHN-SFHVURJKSA-N -1 1 313.372 4.009 20 0 DIADMM Cc1cccc([C@@H](CC(=O)[O-])NCc2cscc2Cl)c1 ZINC000904045114 1048962075 /nfs/dbraw/zinc/96/20/75/1048962075.db2.gz HAXMYRKBOKZSET-CQSZACIVSA-N -1 1 309.818 4.016 20 0 DIADMM [O-]c1cc(F)cc(F)c1Nc1ccc(N2CCCCC2)cc1 ZINC001203718852 1048975582 /nfs/dbraw/zinc/97/55/82/1048975582.db2.gz DXYLGNSVGYVIMZ-UHFFFAOYSA-N -1 1 304.340 4.404 20 0 DIADMM Cc1ccc(Cl)c(NC(=O)Nc2cc(F)c([O-])c(F)c2)c1 ZINC001191703051 1048980398 /nfs/dbraw/zinc/98/03/98/1048980398.db2.gz OREMOOCGLXSKFI-UHFFFAOYSA-N -1 1 312.703 4.276 20 0 DIADMM Cc1ccc(Cl)c(NC(=O)Nc2cc(F)cc(F)c2[O-])c1 ZINC001191712891 1048981760 /nfs/dbraw/zinc/98/17/60/1048981760.db2.gz LOECIMLQRBWZFK-UHFFFAOYSA-N -1 1 312.703 4.276 20 0 DIADMM Cc1cc(NC(=O)Nc2cc(F)c(F)cc2[O-])ccc1Cl ZINC001191770949 1048990293 /nfs/dbraw/zinc/99/02/93/1048990293.db2.gz FCJJPHVCQVORAB-UHFFFAOYSA-N -1 1 312.703 4.276 20 0 DIADMM Cc1cc(NC(=O)Nc2cc(Cl)ncc2[O-])ccc1Cl ZINC001191740226 1048993661 /nfs/dbraw/zinc/99/36/61/1048993661.db2.gz NDMWFJGNNXONKG-UHFFFAOYSA-N -1 1 312.156 4.046 20 0 DIADMM CC(C)Cc1ccc([C@H](N[C@@H](C)C(=O)[O-])c2cccs2)cc1 ZINC000904204253 1049001836 /nfs/dbraw/zinc/00/18/36/1049001836.db2.gz VHXUEIIFOHHAFH-GUYCJALGSA-N -1 1 317.454 4.099 20 0 DIADMM CC(C)c1ccc([C@@H](N[C@@H](C)C(=O)[O-])c2cccs2)cc1 ZINC000904204813 1049002111 /nfs/dbraw/zinc/00/21/11/1049002111.db2.gz ZMEKOEPKDJUUKF-BLLLJJGKSA-N -1 1 303.427 4.024 20 0 DIADMM CSc1ccc([O-])c(-c2nc(-c3ccc(F)c(C)c3)no2)c1 ZINC000904399498 1049058431 /nfs/dbraw/zinc/05/84/31/1049058431.db2.gz QSTWQLNDOBNDFE-UHFFFAOYSA-N -1 1 316.357 4.279 20 0 DIADMM CC(C)c1ccc(C(=O)Nc2ccc(-c3ccon3)cc2)c([O-])c1 ZINC001178641838 1049074225 /nfs/dbraw/zinc/07/42/25/1049074225.db2.gz DPYSTTJPQSFQAA-UHFFFAOYSA-N -1 1 322.364 4.423 20 0 DIADMM CC(C)c1cccnc1NC(=O)c1ccc(C(C)(C)C)cc1[O-] ZINC001192313393 1049076155 /nfs/dbraw/zinc/07/61/55/1049076155.db2.gz CWKABASGCCONLG-UHFFFAOYSA-N -1 1 312.413 4.460 20 0 DIADMM O=C([O-])c1ccc(CN2CCC[C@H]2c2ccc(F)cc2F)cc1 ZINC001204156643 1049098478 /nfs/dbraw/zinc/09/84/78/1049098478.db2.gz GZKOMMACLCERID-KRWDZBQOSA-N -1 1 317.335 4.000 20 0 DIADMM CC[C@H](C)C1CCC(NC(=O)c2c(F)ccc([O-])c2F)CC1 ZINC001192553192 1049114915 /nfs/dbraw/zinc/11/49/15/1049114915.db2.gz WXDYMDBILPPOKV-UNXYVOJBSA-N -1 1 311.372 4.005 20 0 DIADMM CC[C@H](C)C1CCC(NC(=O)c2cc([O-])cc(F)c2F)CC1 ZINC001192684718 1049128449 /nfs/dbraw/zinc/12/84/49/1049128449.db2.gz ULDZWCGIFLMXKC-UNXYVOJBSA-N -1 1 311.372 4.005 20 0 DIADMM [O-]c1cccc(CNc2cnc3c(F)cccc3c2)c1Cl ZINC001179105630 1049131799 /nfs/dbraw/zinc/13/17/99/1049131799.db2.gz KICOFKJQBWSUAE-UHFFFAOYSA-N -1 1 302.736 4.345 20 0 DIADMM C[C@H](C(=O)[N-]OC1CCCCC1)c1ccc(Cl)c(Cl)c1 ZINC000857493415 1049162858 /nfs/dbraw/zinc/16/28/58/1049162858.db2.gz ZDJCJCMRHYTGOW-JTQLQIEISA-N -1 1 316.228 4.477 20 0 DIADMM CCCC[C@H](C)NC(=O)Nc1cccc(C(F)(F)F)c1[O-] ZINC001193072626 1049173319 /nfs/dbraw/zinc/17/33/19/1049173319.db2.gz BTQIGNVHLFIESV-VIFPVBQESA-N -1 1 304.312 4.111 20 0 DIADMM C[C@@H](NC(=O)Nc1cccc([O-])c1Cl)c1ccc(F)cc1 ZINC001193143613 1049184784 /nfs/dbraw/zinc/18/47/84/1049184784.db2.gz PHIGNRGZGLFPAT-SECBINFHSA-N -1 1 308.740 4.067 20 0 DIADMM O=C(Nc1cc(F)c([O-])cc1Cl)c1cc2c(cccc2F)[nH]1 ZINC001179657045 1049188859 /nfs/dbraw/zinc/18/88/59/1049188859.db2.gz ZVDQPKZIPVZDCB-UHFFFAOYSA-N -1 1 322.698 4.057 20 0 DIADMM CCCCCNC(=O)Nc1c([O-])cc(C(F)(F)F)cc1Cl ZINC001193337132 1049199234 /nfs/dbraw/zinc/19/92/34/1049199234.db2.gz NDERIOQDIZLTSF-UHFFFAOYSA-N -1 1 324.730 4.376 20 0 DIADMM O=c1nc(N[C@@H]2CCCC[C@@H]2Cc2ccccc2)cc(Cl)[n-]1 ZINC000858389646 1049250763 /nfs/dbraw/zinc/25/07/63/1049250763.db2.gz JWMWOTJYAYEZDD-ZIAGYGMSSA-N -1 1 317.820 4.049 20 0 DIADMM CCC[C@@H](CCc1ccccc1)Nc1cc(Cl)[n-]c(=O)n1 ZINC000858422367 1049255082 /nfs/dbraw/zinc/25/50/82/1049255082.db2.gz JTBAWXOKYCVBRJ-ZDUSSCGKSA-N -1 1 305.809 4.049 20 0 DIADMM O=c1nc(NCC2(Cc3ccccc3)CCCC2)cc(Cl)[n-]1 ZINC000858470937 1049261849 /nfs/dbraw/zinc/26/18/49/1049261849.db2.gz PUDNEFIFMIJQHH-UHFFFAOYSA-N -1 1 317.820 4.051 20 0 DIADMM O=c1nc(N[C@H]2CC[C@@H](c3ccc(Cl)cc3)C2)cc(Cl)[n-]1 ZINC000858567631 1049276247 /nfs/dbraw/zinc/27/62/47/1049276247.db2.gz HJUNSXUNWCWSKG-PWSUYJOCSA-N -1 1 324.211 4.237 20 0 DIADMM CC[C@@H]1c2ccccc2CN1C(=O)c1cc(Cl)ccc1[O-] ZINC001180139990 1049284253 /nfs/dbraw/zinc/28/42/53/1049284253.db2.gz LETOAVCNNXRVAH-OAHLLOKOSA-N -1 1 301.773 4.153 20 0 DIADMM Cc1cccc(CCC(=O)Nc2cccc(C(F)(F)F)c2[O-])c1 ZINC001180166336 1049304419 /nfs/dbraw/zinc/30/44/19/1049304419.db2.gz MSWVYRJTXLMATG-UHFFFAOYSA-N -1 1 323.314 4.291 20 0 DIADMM CC(C)O[C@@H](C(=O)Nc1ccc([O-])c(Cl)c1)c1ccccc1 ZINC000485662654 1049310173 /nfs/dbraw/zinc/31/01/73/1049310173.db2.gz XIBIFXLRECWIFX-MRXNPFEDSA-N -1 1 319.788 4.150 20 0 DIADMM CCCCCCOC(=O)Nc1ccc([O-])c(Br)c1 ZINC001194185742 1049329901 /nfs/dbraw/zinc/32/99/01/1049329901.db2.gz QYPYLMZQJLMJAY-UHFFFAOYSA-N -1 1 316.195 4.284 20 0 DIADMM Cc1c(Cl)ccc(N)c1Nc1cc([O-])c(F)c(F)c1F ZINC001249964850 1049341317 /nfs/dbraw/zinc/34/13/17/1049341317.db2.gz OLWRQDPHXCLGMX-UHFFFAOYSA-N -1 1 302.683 4.097 20 0 DIADMM [O-]c1cc(Nc2c(F)ccc(Cl)c2F)c(F)c(F)c1F ZINC001249964958 1049347123 /nfs/dbraw/zinc/34/71/23/1049347123.db2.gz PUQQLUITKZYDEC-UHFFFAOYSA-N -1 1 309.621 4.485 20 0 DIADMM COC(=O)c1nc2cc(-c3cc(C)c(Cl)c(C)c3)ccc2[n-]1 ZINC001205051954 1049354439 /nfs/dbraw/zinc/35/44/39/1049354439.db2.gz CCZVKEQHCLXLBD-UHFFFAOYSA-N -1 1 314.772 4.287 20 0 DIADMM COC(=O)c1nc2ccc(-c3cc(C)c(Cl)c(C)c3)cc2[n-]1 ZINC001205051954 1049354445 /nfs/dbraw/zinc/35/44/45/1049354445.db2.gz CCZVKEQHCLXLBD-UHFFFAOYSA-N -1 1 314.772 4.287 20 0 DIADMM Cc1ccc(OC(=O)Nc2ccc([O-])c(Br)c2)cc1 ZINC001194459468 1049373608 /nfs/dbraw/zinc/37/36/08/1049373608.db2.gz RPXVYHCZAOTDAJ-UHFFFAOYSA-N -1 1 322.158 4.074 20 0 DIADMM Cc1ccc(OC(=O)Nc2ccc(Br)cc2[O-])cc1 ZINC001194457724 1049374288 /nfs/dbraw/zinc/37/42/88/1049374288.db2.gz BFQLBJIAHSONKG-UHFFFAOYSA-N -1 1 322.158 4.074 20 0 DIADMM CC[C@@H](C)c1ccc(NC(=O)c2c[n-]c(C(F)(F)F)n2)cc1 ZINC001194770874 1049428098 /nfs/dbraw/zinc/42/80/98/1049428098.db2.gz RFFAGHJVKBLFSQ-SECBINFHSA-N -1 1 311.307 4.194 20 0 DIADMM O=C(Nc1cccc(C(F)(F)F)c1[O-])[C@@H]1C[C@@H]1c1ccccc1 ZINC001181453985 1049479049 /nfs/dbraw/zinc/47/90/49/1049479049.db2.gz LJHIJLHSIPFTLI-VXGBXAGGSA-N -1 1 321.298 4.153 20 0 DIADMM CC[C@H](C)OC(=O)Nc1c([O-])cc(C(F)(F)F)cc1Cl ZINC001195127118 1049480490 /nfs/dbraw/zinc/48/04/90/1049480490.db2.gz ZZNGLRWBOVXPBC-LURJTMIESA-N -1 1 311.687 4.411 20 0 DIADMM C[C@H](NC(=O)Nc1cc([O-])c(Cl)cc1F)c1ccccc1 ZINC001202506383 1049485676 /nfs/dbraw/zinc/48/56/76/1049485676.db2.gz YJUUVFRTCXDEHG-VIFPVBQESA-N -1 1 308.740 4.067 20 0 DIADMM CCCC[C@@](C)(F)C(=O)Nc1cccc([O-])c1Br ZINC000908708179 1049499439 /nfs/dbraw/zinc/49/94/39/1049499439.db2.gz PWMASXVINQJOML-CYBMUJFWSA-N -1 1 318.186 4.012 20 0 DIADMM O=C(Nc1cccc([O-])c1Br)[C@H]1CCC=CCCC1 ZINC000908717539 1049500309 /nfs/dbraw/zinc/50/03/09/1049500309.db2.gz LCAIUYWYOKZBDA-NSHDSACASA-N -1 1 324.218 4.230 20 0 DIADMM O=C(Nc1cccc([O-])c1Br)C1CCC2(CC2)CC1 ZINC000908710394 1049500890 /nfs/dbraw/zinc/50/08/90/1049500890.db2.gz KLIYJEJFYUSJJV-UHFFFAOYSA-N -1 1 324.218 4.064 20 0 DIADMM CC[C@H](CC(=O)Nc1cccc([O-])c1Br)C(C)C ZINC000908716663 1049501597 /nfs/dbraw/zinc/50/15/97/1049501597.db2.gz KJQKYVLKGLOFBZ-SNVBAGLBSA-N -1 1 314.223 4.166 20 0 DIADMM O=C(Nc1cccc([O-])c1Br)[C@@H]1CCCC2(CC2)C1 ZINC000908711310 1049501797 /nfs/dbraw/zinc/50/17/97/1049501797.db2.gz UTWLSUQMJJDCDJ-SNVBAGLBSA-N -1 1 324.218 4.064 20 0 DIADMM CC(C)C[C@@H](C)CC(=O)Nc1cccc([O-])c1Br ZINC000908717149 1049502257 /nfs/dbraw/zinc/50/22/57/1049502257.db2.gz WSFVQNQSUJBWIN-SNVBAGLBSA-N -1 1 314.223 4.166 20 0 DIADMM CCOC(=O)NC(=S)[N-]c1cc(-c2ccccc2)ccc1C ZINC001195484562 1049534514 /nfs/dbraw/zinc/53/45/14/1049534514.db2.gz OBGTXDPBHUBADP-UHFFFAOYSA-N -1 1 314.410 4.105 20 0 DIADMM CCOC(=O)NC(=S)[N-]c1ccc(-c2ccc(C)cc2)cc1 ZINC001195490816 1049538160 /nfs/dbraw/zinc/53/81/60/1049538160.db2.gz MPBHPPRQXPQSAB-UHFFFAOYSA-N -1 1 314.410 4.105 20 0 DIADMM COc1ccc(C(C)=O)c(Nc2cc(Cl)c([O-])cc2F)c1 ZINC001250026930 1049542705 /nfs/dbraw/zinc/54/27/05/1049542705.db2.gz SHLFBAWSBWZFGB-UHFFFAOYSA-N -1 1 309.724 4.140 20 0 DIADMM Cc1ccc2nc(-c3cc(Br)c(F)cc3[O-])[nH]c2c1 ZINC001251001118 1049670486 /nfs/dbraw/zinc/67/04/86/1049670486.db2.gz WYHATBDMXDZQIW-UHFFFAOYSA-N -1 1 321.149 4.146 20 0 DIADMM [O-]c1c(Cl)cc(Br)cc1Nc1ccccc1O ZINC001206247216 1049690013 /nfs/dbraw/zinc/69/00/13/1049690013.db2.gz OGPBYVXQKOHMTB-UHFFFAOYSA-N -1 1 314.566 4.257 20 0 DIADMM CCOc1cc(C(=O)Nc2ccc(C)cc2C)cc(Cl)c1[O-] ZINC000192983175 1049945802 /nfs/dbraw/zinc/94/58/02/1049945802.db2.gz KMKKCOWOEDAJBG-UHFFFAOYSA-N -1 1 319.788 4.313 20 0 DIADMM Cc1oc(CN(C)[C@@H]2CCc3c2cccc3Cl)cc1C(=O)[O-] ZINC000572295946 1049999936 /nfs/dbraw/zinc/99/99/36/1049999936.db2.gz GYHRJCMFLCKAIT-MRXNPFEDSA-N -1 1 319.788 4.059 20 0 DIADMM Cc1cc(C=C2SC(=S)[N-]C2=O)cc(C)c1OC(F)F ZINC000056689464 1050036352 /nfs/dbraw/zinc/03/63/52/1050036352.db2.gz PEJAQBXSGOJLFQ-WEVVVXLNSA-N -1 1 315.366 4.234 20 0 DIADMM Cc1ccccc1S(=O)(=O)[N-]c1ccc2c3c(cccc31)CC2 ZINC000589429928 1050036383 /nfs/dbraw/zinc/03/63/83/1050036383.db2.gz JKWVBLCUQZTPOW-UHFFFAOYSA-N -1 1 323.417 4.048 20 0 DIADMM [O-]c1cc(Cl)c(Nc2ccc(F)c(CO)c2)cc1Cl ZINC001209878376 1050098664 /nfs/dbraw/zinc/09/86/64/1050098664.db2.gz KLGXIXIETIZFRT-UHFFFAOYSA-N -1 1 302.132 4.074 20 0 DIADMM [O-]c1c(F)c(F)ccc1Nc1ccc(O)c(C(F)(F)F)c1 ZINC001209987590 1050117444 /nfs/dbraw/zinc/11/74/44/1050117444.db2.gz VMNXFVYYEDBHRX-UHFFFAOYSA-N -1 1 305.202 4.138 20 0 DIADMM C[N@@H+](CC[C@H](C(=O)[O-])c1ccccc1)Cc1ccccc1Cl ZINC000573097862 1050134201 /nfs/dbraw/zinc/13/42/01/1050134201.db2.gz QOCREMJZWHKQEF-INIZCTEOSA-N -1 1 317.816 4.030 20 0 DIADMM Cc1cc(C)cc(CCNC(=O)c2ccc3ccccc3c2[O-])c1 ZINC001136869832 1050207652 /nfs/dbraw/zinc/20/76/52/1050207652.db2.gz YMOBKUYONFGZGS-UHFFFAOYSA-N -1 1 319.404 4.135 20 0 DIADMM CC[C@@H]1CCCCCN1C(=O)c1ccc(C(F)(F)F)c([O-])c1 ZINC001136871191 1050211033 /nfs/dbraw/zinc/21/10/33/1050211033.db2.gz XGWRDZWJXWSFAX-GFCCVEGCSA-N -1 1 315.335 4.206 20 0 DIADMM C[C@H](Cc1ccc(F)cc1)c1nc(-c2ccc([O-])cc2F)no1 ZINC000771199782 1050226160 /nfs/dbraw/zinc/22/61/60/1050226160.db2.gz NNHBNSHXOIBMRM-SNVBAGLBSA-N -1 1 316.307 4.067 20 0 DIADMM CC(C)(C)SCCCc1nc(-c2ccc([O-])cc2F)no1 ZINC000771209334 1050230828 /nfs/dbraw/zinc/23/08/28/1050230828.db2.gz CKEBAHOCECFOLX-UHFFFAOYSA-N -1 1 310.394 4.046 20 0 DIADMM [O-]c1cc(Nc2cccc(OCC(F)(F)F)c2)cc(F)c1F ZINC001212171098 1050284129 /nfs/dbraw/zinc/28/41/29/1050284129.db2.gz NJRXSDYALXKGSQ-UHFFFAOYSA-N -1 1 319.229 4.355 20 0 DIADMM Cc1oncc1[N-]c1nc2ccc(Br)cc2s1 ZINC001210579779 1050304420 /nfs/dbraw/zinc/30/44/20/1050304420.db2.gz ZWMYROUBUVPSQA-UHFFFAOYSA-N -1 1 310.176 4.099 20 0 DIADMM [O-]c1c(Cl)cc(Cl)cc1Nc1cncc(N2CCCC2)c1 ZINC001210609077 1050311178 /nfs/dbraw/zinc/31/11/78/1050311178.db2.gz CHZXPWQAPWQARF-UHFFFAOYSA-N -1 1 324.211 4.438 20 0 DIADMM CCN(C(=O)c1cc(Cl)c([O-])c(OC)c1)c1ccc(C)cc1 ZINC000785511421 1050384060 /nfs/dbraw/zinc/38/40/60/1050384060.db2.gz WEMGFYJYXRLRLN-UHFFFAOYSA-N -1 1 319.788 4.029 20 0 DIADMM [O-]c1cc(Nc2cc(O)cc(C(F)(F)F)c2)cc(F)c1F ZINC001210828011 1050384354 /nfs/dbraw/zinc/38/43/54/1050384354.db2.gz LPKBJTPZKVKHRS-UHFFFAOYSA-N -1 1 305.202 4.138 20 0 DIADMM CSc1ccc(Nc2ccc(-n3ccc(=O)[n-]3)cc2)c(F)c1 ZINC001210873257 1050402761 /nfs/dbraw/zinc/40/27/61/1050402761.db2.gz QPOWAFUJMLGYIC-UHFFFAOYSA-N -1 1 315.373 4.183 20 0 DIADMM CCc1[nH]nc2ncc(Nc3ccc(Cl)c(Cl)c3[O-])cc21 ZINC001210885731 1050407645 /nfs/dbraw/zinc/40/76/45/1050407645.db2.gz QMFIBOHSMAIQPM-UHFFFAOYSA-N -1 1 323.183 4.276 20 0 DIADMM Cc1nc2c(C)cc(Nc3cc(Cl)c([O-])c(Cl)c3)cn2n1 ZINC001210926377 1050415570 /nfs/dbraw/zinc/41/55/70/1050415570.db2.gz KDQKRPFGBBAQRT-UHFFFAOYSA-N -1 1 323.183 4.102 20 0 DIADMM COc1cc(C(F)(F)F)c(-c2cccc([O-])c2Cl)cn1 ZINC001242802517 1050416213 /nfs/dbraw/zinc/41/62/13/1050416213.db2.gz BAZGLWNXCRMKDX-UHFFFAOYSA-N -1 1 303.667 4.135 20 0 DIADMM COc1ccc(Nc2cc(Cl)c([O-])c(Cl)c2)c(Cl)n1 ZINC001210924625 1050416639 /nfs/dbraw/zinc/41/66/39/1050416639.db2.gz ORDSIJQUJWBUSO-UHFFFAOYSA-N -1 1 319.575 4.500 20 0 DIADMM O=c1cc(Nc2cc(Cl)c([O-])c(Cl)c2)cc(Cl)[nH]1 ZINC001210926202 1050416752 /nfs/dbraw/zinc/41/67/52/1050416752.db2.gz GKRMSVJLYQDJSL-UHFFFAOYSA-N -1 1 305.548 4.197 20 0 DIADMM [O-]c1c(Cl)cc(Nc2cncc(N3CCCC3)c2)cc1Cl ZINC001210927071 1050418169 /nfs/dbraw/zinc/41/81/69/1050418169.db2.gz KNVQHGVQLHBBCV-UHFFFAOYSA-N -1 1 324.211 4.438 20 0 DIADMM CC(C)n1cc2c(n1)[C@H]([N-]c1nc(-c3ccccc3)no1)CCC2 ZINC000785837367 1050418682 /nfs/dbraw/zinc/41/86/82/1050418682.db2.gz NTCAMRUWKGQZBF-OAHLLOKOSA-N -1 1 323.400 4.004 20 0 DIADMM O=C1CCCc2ccc(Nc3nc4c(cccc4[O-])s3)cc21 ZINC001210932202 1050422279 /nfs/dbraw/zinc/42/22/79/1050422279.db2.gz SANARRJAYLTDEF-UHFFFAOYSA-N -1 1 310.378 4.265 20 0 DIADMM Nc1ccc2c(c1)CCCN2c1cc(Cl)c([O-])c(Cl)c1 ZINC001210931942 1050422427 /nfs/dbraw/zinc/42/24/27/1050422427.db2.gz YBIZMNPTFMYHGA-UHFFFAOYSA-N -1 1 309.196 4.366 20 0 DIADMM [O-]c1c(Cl)nccc1Nc1ccccc1N1CCCCC1 ZINC001210960117 1050433066 /nfs/dbraw/zinc/43/30/66/1050433066.db2.gz DMUUFLBYJCUCLG-UHFFFAOYSA-N -1 1 303.793 4.175 20 0 DIADMM [O-]c1c(F)c(F)ccc1Nc1ccccc1N1CCCCC1 ZINC001210964003 1050436470 /nfs/dbraw/zinc/43/64/70/1050436470.db2.gz UXEAUIZCLLFBAN-UHFFFAOYSA-N -1 1 304.340 4.404 20 0 DIADMM Nc1ccc(C(F)(F)F)cc1Nc1cc(F)c([O-])cc1F ZINC001211151070 1050499939 /nfs/dbraw/zinc/49/99/39/1050499939.db2.gz LRXJEZAMSNLESO-UHFFFAOYSA-N -1 1 304.218 4.015 20 0 DIADMM COC(=O)c1cc(C)cc(Nc2cc([O-])c(Cl)cc2F)c1 ZINC001211175576 1050506945 /nfs/dbraw/zinc/50/69/45/1050506945.db2.gz VUWSCSHKIAMOJV-UHFFFAOYSA-N -1 1 309.724 4.023 20 0 DIADMM [O-]c1cc(F)cc(F)c1Nc1ccc(C(F)(F)F)nc1Cl ZINC001211202727 1050515885 /nfs/dbraw/zinc/51/58/85/1050515885.db2.gz ZJGYEPFXFWEXEA-UHFFFAOYSA-N -1 1 324.636 4.481 20 0 DIADMM COc1cc(Nc2ccnc(Cl)c2[O-])cc(C(F)(F)F)c1 ZINC001211335924 1050549886 /nfs/dbraw/zinc/54/98/86/1050549886.db2.gz UTPOAHAFNLFFOZ-UHFFFAOYSA-N -1 1 318.682 4.212 20 0 DIADMM COc1cc(Nc2cc(F)c([O-])cc2F)cc(C(F)(F)F)c1 ZINC001211335567 1050550874 /nfs/dbraw/zinc/55/08/74/1050550874.db2.gz RGUAJFKIJHIESU-UHFFFAOYSA-N -1 1 319.229 4.441 20 0 DIADMM [O-]c1cc(F)c(-c2ccc3nc4c(cc3c2)CCCO4)cc1F ZINC001211352447 1050554156 /nfs/dbraw/zinc/55/41/56/1050554156.db2.gz MWUUALGLSFHKME-UHFFFAOYSA-N -1 1 313.303 4.211 20 0 DIADMM COc1cc(-c2cc(F)c([O-])cc2F)cc(C(F)(F)F)c1 ZINC001211350847 1050554638 /nfs/dbraw/zinc/55/46/38/1050554638.db2.gz VMAAXIDNGUEPAP-UHFFFAOYSA-N -1 1 304.214 4.365 20 0 DIADMM [O-]c1cc(F)c(CN2CCC[C@H]2c2ccc(F)cc2)c(F)c1 ZINC001144541629 1050610986 /nfs/dbraw/zinc/61/09/86/1050610986.db2.gz IEXLGTMVEUIJJG-KRWDZBQOSA-N -1 1 307.315 4.147 20 0 DIADMM [O-]c1cc(F)c(CN2CCC(c3cccs3)CC2)c(F)c1 ZINC001144554759 1050612202 /nfs/dbraw/zinc/61/22/02/1050612202.db2.gz GMIDKHQDOCAHAZ-UHFFFAOYSA-N -1 1 309.381 4.112 20 0 DIADMM COc1cccc([C@@H]2CCCN2Cc2c(F)cc([O-])cc2F)c1 ZINC001144559618 1050618882 /nfs/dbraw/zinc/61/88/82/1050618882.db2.gz OPABUXCKTUHTGC-SFHVURJKSA-N -1 1 319.351 4.016 20 0 DIADMM COc1cc(Nc2cc(F)c([O-])c(F)c2)c(Cl)c(OC)c1 ZINC001213386434 1050644294 /nfs/dbraw/zinc/64/42/94/1050644294.db2.gz BZSCOOBRNVVALF-UHFFFAOYSA-N -1 1 315.703 4.085 20 0 DIADMM [O-]c1cc(F)c(CN2CCC[C@@H]2c2ccccc2F)cc1F ZINC001144666115 1050646074 /nfs/dbraw/zinc/64/60/74/1050646074.db2.gz GTBNLFXKEXECHX-MRXNPFEDSA-N -1 1 307.315 4.147 20 0 DIADMM Cc1cc(-c2noc(-c3cc([O-])cnc3Cl)n2)ccc1Cl ZINC001213698292 1050721192 /nfs/dbraw/zinc/72/11/92/1050721192.db2.gz UMKLGWUPWRQBGE-UHFFFAOYSA-N -1 1 322.151 4.119 20 0 DIADMM Cc1cccc2c1CC[C@@H]2NC(=O)c1cc2ccccc2cc1[O-] ZINC001144848470 1050721827 /nfs/dbraw/zinc/72/18/27/1050721827.db2.gz BCRPLYAPYRUQEU-IBGZPJMESA-N -1 1 317.388 4.271 20 0 DIADMM O=C(c1cc2ccccc2cc1[O-])N1CCCC[C@@H]1C1CCC1 ZINC001144953939 1050772446 /nfs/dbraw/zinc/77/24/46/1050772446.db2.gz WARSUFDEZUPCQL-GOSISDBHSA-N -1 1 309.409 4.340 20 0 DIADMM COc1ccc(-c2c(F)cc([O-])cc2F)c(OC(F)(F)F)c1 ZINC001241122927 1050772728 /nfs/dbraw/zinc/77/27/28/1050772728.db2.gz PIWFJUCBTLAHNB-UHFFFAOYSA-N -1 1 320.213 4.245 20 0 DIADMM O=C(c1cc2ccccc2cc1[O-])N1CCCC[C@H]1C1CCC1 ZINC001144953940 1050772682 /nfs/dbraw/zinc/77/26/82/1050772682.db2.gz WARSUFDEZUPCQL-SFHVURJKSA-N -1 1 309.409 4.340 20 0 DIADMM CN(C(=O)c1ccc(F)c([O-])c1)C1CC(C)(C)CC(C)(C)C1 ZINC001146588027 1050830975 /nfs/dbraw/zinc/83/09/75/1050830975.db2.gz ZZJDVAZAMAVLOF-UHFFFAOYSA-N -1 1 307.409 4.208 20 0 DIADMM CC(C)(CNC(=O)c1cc(Cl)ccc1[O-])Cc1ccccc1 ZINC001146669744 1050835236 /nfs/dbraw/zinc/83/52/36/1050835236.db2.gz ZSNFMXMAULSUFI-UHFFFAOYSA-N -1 1 317.816 4.044 20 0 DIADMM CC[C@@](C)(NC(=O)c1ccc(Cl)cc1[O-])c1ccccc1 ZINC001146926548 1050850757 /nfs/dbraw/zinc/85/07/57/1050850757.db2.gz NCXZPWSCKGAXGJ-QGZVFWFLSA-N -1 1 303.789 4.101 20 0 DIADMM Cc1ccc(O)c(Nc2ccc(F)c(Br)c2[O-])c1 ZINC001214231634 1050851526 /nfs/dbraw/zinc/85/15/26/1050851526.db2.gz LDAHMYHNUXBFRB-UHFFFAOYSA-N -1 1 312.138 4.051 20 0 DIADMM CC1(C)CN(C(=O)c2cc3ccccc3cc2[O-])c2ccccc21 ZINC001170113298 1050857166 /nfs/dbraw/zinc/85/71/66/1050857166.db2.gz XOCOKBDRFPLUPG-UHFFFAOYSA-N -1 1 317.388 4.483 20 0 DIADMM CCOc1cc(Nc2ccc(-n3ccc(=O)[n-]3)cc2)ccc1C ZINC001214329797 1050871940 /nfs/dbraw/zinc/87/19/40/1050871940.db2.gz QKFCXXLRYNZUNQ-UHFFFAOYSA-N -1 1 309.369 4.029 20 0 DIADMM [O-]c1cc(F)cc(F)c1Nc1ccc(OC(F)(F)F)cc1O ZINC001214392837 1050891477 /nfs/dbraw/zinc/89/14/77/1050891477.db2.gz XXDKBSXENAFKEM-UHFFFAOYSA-N -1 1 321.201 4.018 20 0 DIADMM [O-]c1c(F)cc(Nc2c(Cl)cncc2Cl)cc1Cl ZINC001214477328 1050915660 /nfs/dbraw/zinc/91/56/60/1050915660.db2.gz HDGCXNXCVKFKRT-UHFFFAOYSA-N -1 1 307.539 4.052 20 0 DIADMM [O-]c1c(F)cc(Nc2cnccc2OC(F)(F)F)cc1Cl ZINC001214484553 1050917176 /nfs/dbraw/zinc/91/71/76/1050917176.db2.gz MNVKENZLZXMTEQ-UHFFFAOYSA-N -1 1 322.645 4.222 20 0 DIADMM [O-]c1c(F)cc(Nc2ncccc2N2CCCCC2)cc1Cl ZINC001214484169 1050917733 /nfs/dbraw/zinc/91/77/33/1050917733.db2.gz BWLXBHPNQNHTAS-UHFFFAOYSA-N -1 1 321.783 4.314 20 0 DIADMM [O-]c1c(F)cc(Nc2cc(-c3ccncn3)cs2)cc1Cl ZINC001214484415 1050917968 /nfs/dbraw/zinc/91/79/68/1050917968.db2.gz JXQVLIMPRGKXDM-UHFFFAOYSA-N -1 1 321.764 4.447 20 0 DIADMM Cc1nc(Cl)c(Nc2cc(F)c([O-])c(Cl)c2)c(Cl)n1 ZINC001214482968 1050918314 /nfs/dbraw/zinc/91/83/14/1050918314.db2.gz XGMFTDROIIVYEF-UHFFFAOYSA-N -1 1 322.554 4.334 20 0 DIADMM CC(C)c1cnn2cc(Nc3cc(F)c([O-])c(Cl)c3)cnc12 ZINC001214484144 1050918550 /nfs/dbraw/zinc/91/85/50/1050918550.db2.gz BCRVELXJVWKNRF-UHFFFAOYSA-N -1 1 320.755 4.094 20 0 DIADMM [O-]c1c(F)cc(Nc2cnc3ccc(O)cc3c2)cc1Cl ZINC001214482934 1050918831 /nfs/dbraw/zinc/91/88/31/1050918831.db2.gz VKBLIJYYMPZZFH-UHFFFAOYSA-N -1 1 304.708 4.182 20 0 DIADMM COC(=O)c1c(C)cccc1Nc1cc(F)c([O-])c(Cl)c1 ZINC001214492002 1050921820 /nfs/dbraw/zinc/92/18/20/1050921820.db2.gz OWJDBSOUSOUFLS-UHFFFAOYSA-N -1 1 309.724 4.023 20 0 DIADMM O=C1CCCc2ccc(Nc3cc(F)c([O-])c(Cl)c3)cc2N1 ZINC001214490296 1050922133 /nfs/dbraw/zinc/92/21/33/1050922133.db2.gz SZDUNLCARPBNOS-UHFFFAOYSA-N -1 1 320.751 4.203 20 0 DIADMM COc1ccc2c(c1Nc1cc(F)c([O-])c(Cl)c1)C(=O)CC2 ZINC001214492242 1050923390 /nfs/dbraw/zinc/92/33/90/1050923390.db2.gz VNEFTVXMDKAIGI-UHFFFAOYSA-N -1 1 321.735 4.066 20 0 DIADMM CC1(C)C(=O)Nc2cc(Nc3cc(F)c([O-])c(Cl)c3)ccc21 ZINC001214489442 1050923502 /nfs/dbraw/zinc/92/35/02/1050923502.db2.gz DUYFYFFNHITCKH-UHFFFAOYSA-N -1 1 320.751 4.158 20 0 DIADMM [O-]c1c(F)cc(Nc2ccc(CO)cc2Cl)cc1Cl ZINC001214494183 1050924351 /nfs/dbraw/zinc/92/43/51/1050924351.db2.gz KOPQEHIAKYFNFO-UHFFFAOYSA-N -1 1 302.132 4.074 20 0 DIADMM CC(C)CCC[C@@H](C)N(CCC(C)C)C(=O)c1cncc([O-])c1 ZINC001148370858 1050936050 /nfs/dbraw/zinc/93/60/50/1050936050.db2.gz DZEUOKPVUJJUJV-MRXNPFEDSA-N -1 1 320.477 4.490 20 0 DIADMM CC(=O)c1ccnc(Cl)c1Nc1c(Cl)ccc([O-])c1F ZINC001214556017 1050942856 /nfs/dbraw/zinc/94/28/56/1050942856.db2.gz GLWLYDLCHQYRJS-UHFFFAOYSA-N -1 1 315.131 4.179 20 0 DIADMM Cc1cccc(C)c1NC(=O)c1ccc2ccc(O)cc2c1[O-] ZINC001148462424 1050943606 /nfs/dbraw/zinc/94/36/06/1050943606.db2.gz YTMYVCFWQSPVNP-UHFFFAOYSA-N -1 1 307.349 4.120 20 0 DIADMM O=C1CCCc2cc(Nc3c(Cl)ccc([O-])c3F)ccc21 ZINC001214563733 1050945970 /nfs/dbraw/zinc/94/59/70/1050945970.db2.gz PYDICUXOVNRFMJ-UHFFFAOYSA-N -1 1 305.736 4.447 20 0 DIADMM CC(C)Cc1ccccc1CNC(=O)c1ccc(Cl)cc1[O-] ZINC001148579048 1050957212 /nfs/dbraw/zinc/95/72/12/1050957212.db2.gz ICJVPSNHMCKDJX-UHFFFAOYSA-N -1 1 317.816 4.174 20 0 DIADMM [O-]c1c(Cl)cc(Cl)cc1Nc1cccc(F)c1CO ZINC001214615247 1050961793 /nfs/dbraw/zinc/96/17/93/1050961793.db2.gz QFWDKDAZUSIIEY-UHFFFAOYSA-N -1 1 302.132 4.074 20 0 DIADMM O=C(Cc1cc(Cl)ccc1Cl)Nc1c([O-])cccc1F ZINC000743415601 1051026041 /nfs/dbraw/zinc/02/60/41/1051026041.db2.gz IBXTZUDSLGWYPN-UHFFFAOYSA-N -1 1 314.143 4.019 20 0 DIADMM COc1ccc(-c2nc(-c3cccc(C)c3Cl)no2)c([O-])c1 ZINC001215149901 1051090435 /nfs/dbraw/zinc/09/04/35/1051090435.db2.gz OKPDIFXGRAKKKK-UHFFFAOYSA-N -1 1 316.744 4.080 20 0 DIADMM CC(C)Oc1ccc(F)c([N-]c2noc3cccnc23)c1F ZINC001215169950 1051098148 /nfs/dbraw/zinc/09/81/48/1051098148.db2.gz AXYPCVYQTOPKGO-UHFFFAOYSA-N -1 1 305.284 4.032 20 0 DIADMM CCOc1ccc(-c2nc(-c3ccc4occc4c3)no2)c([O-])c1 ZINC001215241121 1051129763 /nfs/dbraw/zinc/12/97/63/1051129763.db2.gz HLAGAEMUMLXFOW-UHFFFAOYSA-N -1 1 322.320 4.254 20 0 DIADMM [O-]c1cc(O)ccc1-c1nc(-c2ccc(Cl)cc2Cl)no1 ZINC001215299939 1051160006 /nfs/dbraw/zinc/16/00/06/1051160006.db2.gz IRROAXLITLDVHB-UHFFFAOYSA-N -1 1 323.135 4.122 20 0 DIADMM [O-]c1cc(O)ccc1-c1nc(-c2cc(Cl)ccc2Cl)no1 ZINC001215300305 1051160176 /nfs/dbraw/zinc/16/01/76/1051160176.db2.gz RYQOPRQVHUYJGG-UHFFFAOYSA-N -1 1 323.135 4.122 20 0 DIADMM Cc1cc(F)cc(-c2noc(-c3ccc([O-])cc3Cl)n2)c1F ZINC001215345858 1051171972 /nfs/dbraw/zinc/17/19/72/1051171972.db2.gz OADLTQGBWSHJMX-UHFFFAOYSA-N -1 1 322.698 4.349 20 0 DIADMM Cc1cccc(-c2noc(-c3ccc([O-])cc3Cl)n2)c1F ZINC001215342908 1051172730 /nfs/dbraw/zinc/17/27/30/1051172730.db2.gz GJQDZLDGDIFQDE-UHFFFAOYSA-N -1 1 304.708 4.210 20 0 DIADMM CC(C)Oc1ccc(Cl)cc1C(=O)Nc1cccc(F)c1[O-] ZINC001171632615 1051174054 /nfs/dbraw/zinc/17/40/54/1051174054.db2.gz IMOKSRKONCERHC-UHFFFAOYSA-N -1 1 323.751 4.224 20 0 DIADMM O=C(Nc1cccc(F)c1[O-])[C@H]1C[C@@H]1c1cccc2ccccc21 ZINC001171632550 1051175260 /nfs/dbraw/zinc/17/52/60/1051175260.db2.gz FSVOFEPDTQRERA-CVEARBPZSA-N -1 1 321.351 4.427 20 0 DIADMM [O-]c1c(Cl)c(Cl)ccc1Nc1ccc(F)c2n[nH]cc21 ZINC001215380005 1051181392 /nfs/dbraw/zinc/18/13/92/1051181392.db2.gz FTMSJTIDCYAFNC-UHFFFAOYSA-N -1 1 312.131 4.458 20 0 DIADMM C[C@H](Cc1ccccc1Cl)C(=O)Nc1cccc(F)c1[O-] ZINC001171638072 1051193490 /nfs/dbraw/zinc/19/34/90/1051193490.db2.gz SFJDUUSCKGAAFF-SNVBAGLBSA-N -1 1 307.752 4.002 20 0 DIADMM CCOc1c(Nc2c([O-])cc(F)cc2F)ccc(F)c1F ZINC001215415189 1051194830 /nfs/dbraw/zinc/19/48/30/1051194830.db2.gz HSSFWHBZNTXRQI-UHFFFAOYSA-N -1 1 301.239 4.091 20 0 DIADMM CC(C)[C@H](CCc1ccccc1)C(=O)Nc1cccc(F)c1[O-] ZINC001171637960 1051195122 /nfs/dbraw/zinc/19/51/22/1051195122.db2.gz QOYSMRVDFOEOLB-HNNXBMFYSA-N -1 1 315.388 4.375 20 0 DIADMM CSc1ccc(F)cc1Nc1cc2ccc([O-])cc2oc1=O ZINC001215448639 1051208448 /nfs/dbraw/zinc/20/84/48/1051208448.db2.gz VMQHKBUDEOIZJK-UHFFFAOYSA-N -1 1 317.341 4.103 20 0 DIADMM CCCOc1ccc(F)c(Nc2cc([O-])c(F)c(F)c2)c1F ZINC001215567751 1051248352 /nfs/dbraw/zinc/24/83/52/1051248352.db2.gz GKEWNLCMYXVVKG-UHFFFAOYSA-N -1 1 315.266 4.481 20 0 DIADMM [O-]c1cc(F)c(Nc2ccccc2OC(F)(F)F)cc1F ZINC001215571845 1051250746 /nfs/dbraw/zinc/25/07/46/1051250746.db2.gz NHQGLAJFUWUEAP-UHFFFAOYSA-N -1 1 305.202 4.313 20 0 DIADMM Nc1cc(Nc2cc(F)c([O-])cc2F)cc(C(F)(F)F)c1 ZINC001215572075 1051251259 /nfs/dbraw/zinc/25/12/59/1051251259.db2.gz WFZDRLQGXNLWDZ-UHFFFAOYSA-N -1 1 304.218 4.015 20 0 DIADMM [O-]c1cc(F)c(Nc2ccc(F)c(Br)c2)cc1F ZINC001215571967 1051251588 /nfs/dbraw/zinc/25/15/88/1051251588.db2.gz QTECMVSAQNPARC-UHFFFAOYSA-N -1 1 318.092 4.316 20 0 DIADMM Cc1cccc(Nc2cc(F)c([O-])cc2F)c1Br ZINC001215573735 1051253504 /nfs/dbraw/zinc/25/35/04/1051253504.db2.gz PCXYUDSKDZETCV-UHFFFAOYSA-N -1 1 314.129 4.485 20 0 DIADMM [O-]c1cc(F)c(Nc2cc(F)ccc2OC(F)(F)F)cc1F ZINC001215574332 1051254108 /nfs/dbraw/zinc/25/41/08/1051254108.db2.gz RFVPSUWRQAPADA-UHFFFAOYSA-N -1 1 323.192 4.452 20 0 DIADMM [O-]c1cc(F)c(Nc2ccc(Cc3ccccn3)cc2)cc1F ZINC001215574446 1051254661 /nfs/dbraw/zinc/25/46/61/1051254661.db2.gz UABUYAKYGZPLAO-UHFFFAOYSA-N -1 1 312.319 4.400 20 0 DIADMM [O-]c1cc(F)c(Nc2c3nsnc3ccc2Cl)cc1F ZINC001215573896 1051255095 /nfs/dbraw/zinc/25/50/95/1051255095.db2.gz SKRRRDLERPERDQ-UHFFFAOYSA-N -1 1 313.716 4.072 20 0 DIADMM COc1ccc(Nc2cc(Cl)cc(Cl)c2[O-])c2c[nH]nc21 ZINC001215751335 1051342025 /nfs/dbraw/zinc/34/20/25/1051342025.db2.gz GFFANYZWPCHSOH-UHFFFAOYSA-N -1 1 324.167 4.328 20 0 DIADMM Cc1cc(-c2noc(-c3cc(F)ccc3[O-])n2)ccc1Cl ZINC001215769800 1051358018 /nfs/dbraw/zinc/35/80/18/1051358018.db2.gz SRJLCYTUXXRIFC-UHFFFAOYSA-N -1 1 304.708 4.210 20 0 DIADMM [O-]c1c(Cl)nccc1Nc1ccnc(Oc2ccccc2)c1 ZINC001215774621 1051360055 /nfs/dbraw/zinc/36/00/55/1051360055.db2.gz NYWJWMBAUORVFG-UHFFFAOYSA-N -1 1 313.744 4.372 20 0 DIADMM Cc1cc(Cl)ccc1-c1noc(-c2ccc([O-])cc2F)n1 ZINC001215825945 1051390179 /nfs/dbraw/zinc/39/01/79/1051390179.db2.gz AHWKYBLAIPRMSO-UHFFFAOYSA-N -1 1 304.708 4.210 20 0 DIADMM [O-]c1ccc(-c2nc(-c3ccc(Cl)c(F)c3)no2)c(F)c1 ZINC001215826269 1051391204 /nfs/dbraw/zinc/39/12/04/1051391204.db2.gz IJDFAUNTDOEMID-UHFFFAOYSA-N -1 1 308.671 4.041 20 0 DIADMM [O-]c1cc(-c2nc(-c3ccc(F)cc3Cl)no2)ccc1F ZINC001215838693 1051403038 /nfs/dbraw/zinc/40/30/38/1051403038.db2.gz JECALJMKFHZYQZ-UHFFFAOYSA-N -1 1 308.671 4.041 20 0 DIADMM Cc1cccc(-c2noc(-c3ccc(F)c([O-])c3)n2)c1Cl ZINC001215842554 1051406806 /nfs/dbraw/zinc/40/68/06/1051406806.db2.gz NXBKHGGXHGNVQZ-UHFFFAOYSA-N -1 1 304.708 4.210 20 0 DIADMM CSc1ncc(Cl)cc1Nc1c([O-])cc(F)cc1F ZINC001215916504 1051453007 /nfs/dbraw/zinc/45/30/07/1051453007.db2.gz YBNUZPYQYHFBGI-UHFFFAOYSA-N -1 1 302.733 4.184 20 0 DIADMM [O-]c1c(Cl)nccc1Nc1cnc(F)c(-c2ccccc2)c1 ZINC001215960760 1051484894 /nfs/dbraw/zinc/48/48/94/1051484894.db2.gz QYZPAUPGTXFHHU-UHFFFAOYSA-N -1 1 315.735 4.385 20 0 DIADMM [O-]c1cccc(-c2nc(-c3ccc(Cl)cc3F)no2)c1F ZINC001215983975 1051502755 /nfs/dbraw/zinc/50/27/55/1051502755.db2.gz DGVWKGUYORNBKA-UHFFFAOYSA-N -1 1 308.671 4.041 20 0 DIADMM Cc1ccc(Cl)c(-c2noc(-c3cccc([O-])c3F)n2)c1 ZINC001215984486 1051502659 /nfs/dbraw/zinc/50/26/59/1051502659.db2.gz SQAYLZWRWMRYMB-UHFFFAOYSA-N -1 1 304.708 4.210 20 0 DIADMM Cc1cccc(-c2noc(-c3cccc([O-])c3F)n2)c1Cl ZINC001215984751 1051503974 /nfs/dbraw/zinc/50/39/74/1051503974.db2.gz XJIJSBFXCVFOAQ-UHFFFAOYSA-N -1 1 304.708 4.210 20 0 DIADMM CSc1ncc(Nc2cc([O-])c(F)c(F)c2)cc1Cl ZINC001216029201 1051535795 /nfs/dbraw/zinc/53/57/95/1051535795.db2.gz YJQBZRUWTLJFNZ-UHFFFAOYSA-N -1 1 302.733 4.184 20 0 DIADMM CSc1ncc(Nc2c([O-])cc(F)cc2F)cc1Cl ZINC001216028608 1051532889 /nfs/dbraw/zinc/53/28/89/1051532889.db2.gz HTTQQNVSPMWNRL-UHFFFAOYSA-N -1 1 302.733 4.184 20 0 DIADMM CCc1cc(Nc2cc(Cl)cc(Cl)c2[O-])ccc1CO ZINC001216107605 1051582399 /nfs/dbraw/zinc/58/23/99/1051582399.db2.gz HRKICDZPKYWUFH-UHFFFAOYSA-N -1 1 312.196 4.497 20 0 DIADMM CCN(CC)c1cc(F)cc(Nc2cc(F)c([O-])cc2F)c1 ZINC001216183259 1051617720 /nfs/dbraw/zinc/61/77/20/1051617720.db2.gz OPRXWVQBCHULRM-UHFFFAOYSA-N -1 1 310.319 4.399 20 0 DIADMM CCOC(=O)c1nc(C)sc1[N-]c1cc2c(cccc2F)o1 ZINC001216290910 1051675574 /nfs/dbraw/zinc/67/55/74/1051675574.db2.gz ALHSNFWDNRIKLC-UHFFFAOYSA-N -1 1 320.345 4.257 20 0 DIADMM O=c1ccn(-c2ccc(Nc3cc4c(cccc4F)o3)cc2)[n-]1 ZINC001216293345 1051678902 /nfs/dbraw/zinc/67/89/02/1051678902.db2.gz WPMXTFAEAJSXGJ-UHFFFAOYSA-N -1 1 309.300 4.207 20 0 DIADMM Oc1ccccc1-c1cc([N-]c2c(Cl)ccnc2Cl)on1 ZINC001216301246 1051685063 /nfs/dbraw/zinc/68/50/63/1051685063.db2.gz JZEXJWJNDPNGFA-UHFFFAOYSA-N -1 1 322.151 4.493 20 0 DIADMM COc1c(Cl)ccc([O-])c1-c1nc(-c2cccc(C)c2)no1 ZINC001216306968 1051688047 /nfs/dbraw/zinc/68/80/47/1051688047.db2.gz QZOCBOLNLVOEQD-UHFFFAOYSA-N -1 1 316.744 4.080 20 0 DIADMM [O-]c1cnccc1-c1nc(-c2ccc(-c3ccccc3)cc2)no1 ZINC001212721510 1051702672 /nfs/dbraw/zinc/70/26/72/1051702672.db2.gz URJKWRVZCGFZFM-UHFFFAOYSA-N -1 1 315.332 4.171 20 0 DIADMM Cc1ccc2cccc(-c3noc(-c4cc([O-])cc(F)c4)n3)c2n1 ZINC001216339514 1051706070 /nfs/dbraw/zinc/70/60/70/1051706070.db2.gz JSDSAVQZYWFLMT-UHFFFAOYSA-N -1 1 321.311 4.105 20 0 DIADMM [O-]c1cc(Nc2ccc(OCC(F)F)cc2)cc(F)c1F ZINC001213307233 1051784200 /nfs/dbraw/zinc/78/42/00/1051784200.db2.gz SBOADCISHJKHLQ-UHFFFAOYSA-N -1 1 301.239 4.058 20 0 DIADMM [O-]c1cc(Nc2cncc(OCC3CC3)c2)c(F)cc1Cl ZINC001216599651 1051835349 /nfs/dbraw/zinc/83/53/49/1051835349.db2.gz TYYBVKZYWFDDLP-UHFFFAOYSA-N -1 1 308.740 4.112 20 0 DIADMM COc1c(Nc2c([O-])cc(F)cc2F)cccc1C(F)(F)F ZINC001216635371 1051844752 /nfs/dbraw/zinc/84/47/52/1051844752.db2.gz SCHJZPFDINDMIT-UHFFFAOYSA-N -1 1 319.229 4.441 20 0 DIADMM [O-]c1c(Br)c(F)ccc1Nc1cccc(F)c1 ZINC001173837228 1051853255 /nfs/dbraw/zinc/85/32/55/1051853255.db2.gz JCGVJWMCAQKDQE-UHFFFAOYSA-N -1 1 300.102 4.177 20 0 DIADMM O=c1oc2cc([O-])ccc2cc1Nc1ccccc1C(F)(F)F ZINC001173842181 1051857651 /nfs/dbraw/zinc/85/76/51/1051857651.db2.gz DWYFEGGBTBYXNY-UHFFFAOYSA-N -1 1 321.254 4.261 20 0 DIADMM O=C(Nc1cccc(SC(F)F)c1)c1ccc([O-])c(F)c1 ZINC000767941421 1051867041 /nfs/dbraw/zinc/86/70/41/1051867041.db2.gz QVHWBAQZCCFXMV-UHFFFAOYSA-N -1 1 313.300 4.098 20 0 DIADMM CC(C)(C)OC(=O)c1cccc(-c2c([O-])cccc2Cl)n1 ZINC001244037260 1051887976 /nfs/dbraw/zinc/88/79/76/1051887976.db2.gz QQAZAWHUEWJSAJ-UHFFFAOYSA-N -1 1 305.761 4.063 20 0 DIADMM [O-]c1ccc(F)c(-c2nc(-c3cccc4ccoc43)no2)c1F ZINC001216920543 1051908567 /nfs/dbraw/zinc/90/85/67/1051908567.db2.gz RTOKFCHNHJJXDH-UHFFFAOYSA-N -1 1 314.247 4.134 20 0 DIADMM Cc1cc(C)cc(-c2noc(-c3cc([O-])cc(F)c3F)n2)c1 ZINC001216924023 1051910301 /nfs/dbraw/zinc/91/03/01/1051910301.db2.gz UYUAFLXZPFYFTD-UHFFFAOYSA-N -1 1 302.280 4.004 20 0 DIADMM Cc1cc(Cl)cc(-c2noc(-c3cc([O-])cc(F)c3F)n2)c1 ZINC001216923356 1051911782 /nfs/dbraw/zinc/91/17/82/1051911782.db2.gz MNYGPUQKUJVSRR-UHFFFAOYSA-N -1 1 322.698 4.349 20 0 DIADMM CC(C)CN(C(=O)c1ccc([O-])c(F)c1)c1ccc(Cl)cc1 ZINC000768271463 1051913062 /nfs/dbraw/zinc/91/30/62/1051913062.db2.gz KQVISWBGDYNGFA-UHFFFAOYSA-N -1 1 321.779 4.488 20 0 DIADMM [O-]c1c(Br)c(F)ccc1Nc1cccc(F)c1F ZINC001173948427 1051913505 /nfs/dbraw/zinc/91/35/05/1051913505.db2.gz VZPYDIVPQGVFID-UHFFFAOYSA-N -1 1 318.092 4.316 20 0 DIADMM CC(=O)Nc1ccccc1Nc1ccc(Cl)c(Cl)c1[O-] ZINC001173995289 1051923071 /nfs/dbraw/zinc/92/30/71/1051923071.db2.gz VROUAEKGIZEWEN-UHFFFAOYSA-N -1 1 311.168 4.401 20 0 DIADMM CC(=O)Nc1ccccc1Nc1cc(Cl)c([O-])cc1Cl ZINC001173996272 1051924468 /nfs/dbraw/zinc/92/44/68/1051924468.db2.gz QDUDDXPJNVVFLJ-UHFFFAOYSA-N -1 1 311.168 4.401 20 0 DIADMM Cc1ccc(Nc2ccc(F)c(Br)c2[O-])cc1F ZINC001174021078 1051953515 /nfs/dbraw/zinc/95/35/15/1051953515.db2.gz MVVGDBMEBDACQU-UHFFFAOYSA-N -1 1 314.129 4.485 20 0 DIADMM Cc1cc(-c2noc(-c3ccc4ccccc4c3[O-])n2)cnc1C ZINC001217129552 1051966554 /nfs/dbraw/zinc/96/65/54/1051966554.db2.gz DLMSZOAQQZGCRZ-UHFFFAOYSA-N -1 1 317.348 4.274 20 0 DIADMM CCc1ccc(-c2noc(-c3ccc4cccnc4c3[O-])n2)cc1 ZINC001217143007 1051976640 /nfs/dbraw/zinc/97/66/40/1051976640.db2.gz PHAUBRNNZTULHN-UHFFFAOYSA-N -1 1 317.348 4.220 20 0 DIADMM [O-]c1cc2c(O)cccc2cc1-c1nc(-c2ccccc2F)no1 ZINC001217161369 1051983809 /nfs/dbraw/zinc/98/38/09/1051983809.db2.gz NGSXADUQQIOUEW-UHFFFAOYSA-N -1 1 322.295 4.107 20 0 DIADMM Cc1ccc(-c2noc(-c3cc(O)c4ccccc4c3[O-])n2)cc1 ZINC001217159423 1051984812 /nfs/dbraw/zinc/98/48/12/1051984812.db2.gz QIGFOXLMUKMVHA-UHFFFAOYSA-N -1 1 318.332 4.276 20 0 DIADMM CC(C)Oc1cccc(Nc2cc3ccc([O-])cc3oc2=O)c1 ZINC001174113037 1051987189 /nfs/dbraw/zinc/98/71/89/1051987189.db2.gz QJFPSCXVMYZGQM-UHFFFAOYSA-N -1 1 311.337 4.029 20 0 DIADMM COc1cccc([O-])c1-c1nc(-c2cccc3ccccc32)no1 ZINC000405471376 1052022614 /nfs/dbraw/zinc/02/26/14/1052022614.db2.gz LATJWLAVUOSWOP-UHFFFAOYSA-N -1 1 318.332 4.271 20 0 DIADMM Cc1ccc(-c2noc(-c3ccc4sccc4c3[O-])n2)nc1 ZINC001217514743 1052079684 /nfs/dbraw/zinc/07/96/84/1052079684.db2.gz WGRDYVYAQAKFOO-UHFFFAOYSA-N -1 1 309.350 4.027 20 0 DIADMM O=C(c1c([O-])cccc1Cl)N1CCC[C@@H]1c1ccc(F)cc1 ZINC000769642201 1052086725 /nfs/dbraw/zinc/08/67/25/1052086725.db2.gz LLBCOFIEMKQEMY-CQSZACIVSA-N -1 1 319.763 4.162 20 0 DIADMM O=C(c1c([O-])cccc1Cl)N1CCC[C@H]1c1cccs1 ZINC000769616771 1052089246 /nfs/dbraw/zinc/08/92/46/1052089246.db2.gz XQJOOHBNQQPXNL-NSHDSACASA-N -1 1 307.802 4.084 20 0 DIADMM CN(C(=O)c1cc(F)ccc1[O-])c1ccc(C(C)(C)C)cc1 ZINC000769717345 1052096614 /nfs/dbraw/zinc/09/66/14/1052096614.db2.gz WSBSAVTXUBVWOZ-UHFFFAOYSA-N -1 1 301.361 4.105 20 0 DIADMM C[C@@H](c1ccco1)N(C(=O)c1c([O-])cccc1Cl)C1CC1 ZINC000769722906 1052097567 /nfs/dbraw/zinc/09/75/67/1052097567.db2.gz SLCWINSHNQTYOP-JTQLQIEISA-N -1 1 305.761 4.004 20 0 DIADMM C[C@@H]1CCN(C(=O)c2c([O-])cccc2Cl)[C@H](c2ccco2)C1 ZINC000769931972 1052134142 /nfs/dbraw/zinc/13/41/42/1052134142.db2.gz HODALSPLWUCBQX-YPMHNXCESA-N -1 1 319.788 4.252 20 0 DIADMM COc1ccc(F)c(F)c1Nc1cc([O-])c(Cl)cc1F ZINC001174424142 1052153152 /nfs/dbraw/zinc/15/31/52/1052153152.db2.gz ODZBEXUWZCYUPX-UHFFFAOYSA-N -1 1 303.667 4.215 20 0 DIADMM CC(C)(C)OC(=O)Cc1cccc(-c2cc(F)c([O-])cc2F)c1 ZINC001222083288 1052439241 /nfs/dbraw/zinc/43/92/41/1052439241.db2.gz YEGZUUKGNIBKMC-UHFFFAOYSA-N -1 1 320.335 4.222 20 0 DIADMM CC(C)Oc1cc(F)c(F)cc1-c1cc(F)c([O-])cc1F ZINC001222082155 1052439270 /nfs/dbraw/zinc/43/92/70/1052439270.db2.gz AFLFWFXDAOODLI-UHFFFAOYSA-N -1 1 300.251 4.403 20 0 DIADMM CCOC(=O)C(C)(C)c1ccc(-c2cc(F)c([O-])cc2F)cc1 ZINC001222083041 1052439800 /nfs/dbraw/zinc/43/98/00/1052439800.db2.gz KCDOHDFYBYKTPK-UHFFFAOYSA-N -1 1 320.335 4.178 20 0 DIADMM COC(=O)c1nc2cc(-c3cc(OC(C)C)ccc3C)ccc2[n-]1 ZINC001222143930 1052450400 /nfs/dbraw/zinc/45/04/00/1052450400.db2.gz YCRGKLOCOXYCDM-UHFFFAOYSA-N -1 1 324.380 4.112 20 0 DIADMM COC(=O)c1nc2ccc(-c3cc(OC(C)C)ccc3C)cc2[n-]1 ZINC001222143930 1052450406 /nfs/dbraw/zinc/45/04/06/1052450406.db2.gz YCRGKLOCOXYCDM-UHFFFAOYSA-N -1 1 324.380 4.112 20 0 DIADMM [O-]c1ccc(-c2nc(C3(c4ccccc4)CCC3)no2)c(F)c1 ZINC000322846983 1052498664 /nfs/dbraw/zinc/49/86/64/1052498664.db2.gz TYTPZMHSFOZTGR-UHFFFAOYSA-N -1 1 310.328 4.051 20 0 DIADMM CCOc1cccc(NC(=O)c2ccc3ccccc3c2[O-])c1 ZINC000320579360 1052534149 /nfs/dbraw/zinc/53/41/49/1052534149.db2.gz OLNYEBQQZIQWQI-UHFFFAOYSA-N -1 1 307.349 4.196 20 0 DIADMM CCCc1cc(=O)[n-]c(SCc2csc(C(C)C)n2)n1 ZINC000642358227 1052552500 /nfs/dbraw/zinc/55/25/00/1052552500.db2.gz PIYWKMUXSQTACJ-UHFFFAOYSA-N -1 1 309.460 4.007 20 0 DIADMM Cc1ccc(S(=O)(=O)[N-]c2cc(Cl)ccc2Cl)s1 ZINC000032531874 1052561708 /nfs/dbraw/zinc/56/17/08/1052561708.db2.gz YHJZYTYPFXFKQM-UHFFFAOYSA-N -1 1 322.238 4.164 20 0 DIADMM O=C(Nc1cc(F)c(F)c(F)c1)c1ccc2ccccc2c1[O-] ZINC000321324267 1052674088 /nfs/dbraw/zinc/67/40/88/1052674088.db2.gz ONPNVYVUALZAIO-UHFFFAOYSA-N -1 1 317.266 4.215 20 0 DIADMM CC[C@H](c1ccncc1)N(C)C(=O)c1ccc2ccccc2c1[O-] ZINC000128031728 1052707896 /nfs/dbraw/zinc/70/78/96/1052707896.db2.gz VIFABOKCUGEIHF-GOSISDBHSA-N -1 1 320.392 4.164 20 0 DIADMM CCCCC[C@@H](OCCCC[P@](=O)([O-])O)[C@H](C)CCC ZINC001225019616 1052745194 /nfs/dbraw/zinc/74/51/94/1052745194.db2.gz YXEYVNOOMDHSDZ-HUUCEWRRSA-N -1 1 308.399 4.346 20 0 DIADMM Cc1ccc(F)cc1S(=O)(=O)[N-]c1ccc2ccccc2c1 ZINC000917716630 1052752596 /nfs/dbraw/zinc/75/25/96/1052752596.db2.gz XSSDPOIFBRUAAD-UHFFFAOYSA-N -1 1 315.369 4.088 20 0 DIADMM Cc1ccc(S(=O)(=O)[N-]c2ccc3ccccc3c2)cc1F ZINC000917716192 1052752600 /nfs/dbraw/zinc/75/26/00/1052752600.db2.gz DDGLXACSNCULRK-UHFFFAOYSA-N -1 1 315.369 4.088 20 0 DIADMM O=C(Nc1cccc(COc2ccccc2)c1)c1ccccc1[O-] ZINC000917852832 1052761627 /nfs/dbraw/zinc/76/16/27/1052761627.db2.gz BQWKYOANZIBZPV-UHFFFAOYSA-N -1 1 319.360 4.224 20 0 DIADMM O=C(Nc1ccc([O-])c(Cl)c1)C1(c2ccc(Cl)cc2)CC1 ZINC000129532898 1052794023 /nfs/dbraw/zinc/79/40/23/1052794023.db2.gz DDKNWHPXAVPIGS-UHFFFAOYSA-N -1 1 322.191 4.369 20 0 DIADMM CC(=O)c1ccc([O-])cc1OCc1cc(C)ccc1OC(C)C ZINC001225616514 1052808601 /nfs/dbraw/zinc/80/86/01/1052808601.db2.gz KEGYHZDVGHLCOH-UHFFFAOYSA-N -1 1 314.381 4.269 20 0 DIADMM CC(=O)c1ccc([O-])cc1O[C@H]1CC[C@H](C(F)(F)F)CC1 ZINC001225616984 1052808754 /nfs/dbraw/zinc/80/87/54/1052808754.db2.gz RZMXLZHMSOXGHA-UMSPYCQHSA-N -1 1 302.292 4.095 20 0 DIADMM CC(=O)c1ccc([O-])cc1O[C@@H]1CCc2cc(Cl)ccc21 ZINC001225616726 1052809195 /nfs/dbraw/zinc/80/91/95/1052809195.db2.gz ONRKWRVPEZNZPH-MRXNPFEDSA-N -1 1 302.757 4.315 20 0 DIADMM CC(=O)c1c(O)cc([O-])cc1O[C@@H](C)c1cccc(Cl)c1 ZINC001225679560 1052815721 /nfs/dbraw/zinc/81/57/21/1052815721.db2.gz QIWTYROZTQKFJD-JTQLQIEISA-N -1 1 306.745 4.094 20 0 DIADMM CC(=O)c1c(O)cc([O-])cc1O[C@H]1Cc2cccc3cccc1c23 ZINC001225678290 1052815884 /nfs/dbraw/zinc/81/58/84/1052815884.db2.gz FXBZQOLZCFLGHX-KRWDZBQOSA-N -1 1 320.344 4.130 20 0 DIADMM O=C(Nc1ccc([O-])c(Cl)c1)[C@H]1CCCc2ccccc21 ZINC000070333854 1052818483 /nfs/dbraw/zinc/81/84/83/1052818483.db2.gz XALYPWCTSXVRSU-AWEZNQCLSA-N -1 1 301.773 4.104 20 0 DIADMM C[C@H](CNC(=O)c1ccc2ccccc2c1[O-])c1ccccc1 ZINC000322138781 1052829915 /nfs/dbraw/zinc/82/99/15/1052829915.db2.gz AZGQFEXDDXEYRG-CQSZACIVSA-N -1 1 305.377 4.079 20 0 DIADMM C[C@H](Oc1ccc(C(=O)c2ccc([O-])cc2)cc1)c1ccccn1 ZINC001225809172 1052833756 /nfs/dbraw/zinc/83/37/56/1052833756.db2.gz YPOGIHXOEXZVMU-AWEZNQCLSA-N -1 1 319.360 4.158 20 0 DIADMM Cc1ccc(-c2cc(C(=O)O[C@H](C)c3ccccc3F)[nH]n2)o1 ZINC000919323838 1052863309 /nfs/dbraw/zinc/86/33/09/1052863309.db2.gz BRKJQFHQUKERCF-LLVKDONJSA-N -1 1 314.316 4.035 20 0 DIADMM COc1cnc(=S)[n-]c1O[C@@H](C)c1cc2ccccc2s1 ZINC001226242574 1052879866 /nfs/dbraw/zinc/87/98/66/1052879866.db2.gz QCRSQYKNLAIYHZ-VIFPVBQESA-N -1 1 318.423 4.129 20 0 DIADMM COc1cnc(=S)[n-]c1O[C@H](C)c1cc2ccccc2s1 ZINC001226242571 1052880087 /nfs/dbraw/zinc/88/00/87/1052880087.db2.gz QCRSQYKNLAIYHZ-SECBINFHSA-N -1 1 318.423 4.129 20 0 DIADMM Cc1cc(=O)oc2cc([O-])cc(O[C@@H]3CCCc4ccccc43)c12 ZINC001226484819 1052901056 /nfs/dbraw/zinc/90/10/56/1052901056.db2.gz HLFZZAWADDUCSU-MRXNPFEDSA-N -1 1 322.360 4.263 20 0 DIADMM O=C(N[C@H]1CCc2cc(Cl)ccc21)c1c([O-])cccc1Cl ZINC000920463472 1052940888 /nfs/dbraw/zinc/94/08/88/1052940888.db2.gz PXRNLBPVGIXAKK-ZDUSSCGKSA-N -1 1 322.191 4.116 20 0 DIADMM CC(C)(CCNC(=O)c1c([O-])cccc1Cl)c1ccccc1 ZINC000920462997 1052941010 /nfs/dbraw/zinc/94/10/10/1052941010.db2.gz QZICFYOHKBVQGT-UHFFFAOYSA-N -1 1 317.816 4.143 20 0 DIADMM CCc1ccc([C@H](C)NC(=O)c2c([O-])cccc2Cl)cc1 ZINC000920427596 1052941095 /nfs/dbraw/zinc/94/10/95/1052941095.db2.gz GEMIRZGFYWOZOR-NSHDSACASA-N -1 1 303.789 4.099 20 0 DIADMM Cc1nc(=O)[n-]c(O[C@H](C)c2cc3ccccc3s2)c1Cl ZINC001227116241 1052962119 /nfs/dbraw/zinc/96/21/19/1052962119.db2.gz KRBBWTXMYSRFDY-SECBINFHSA-N -1 1 320.801 4.499 20 0 DIADMM C[C@@H](Oc1[n-]c(=S)ncc1F)c1ccc2ccccc2c1 ZINC001227385077 1052986860 /nfs/dbraw/zinc/98/68/60/1052986860.db2.gz IUVALJPQCLZOSH-SNVBAGLBSA-N -1 1 300.358 4.198 20 0 DIADMM C[C@@H](Oc1[n-]c(=S)ncc1F)c1cccc(C(F)(F)F)c1 ZINC001227383039 1052987113 /nfs/dbraw/zinc/98/71/13/1052987113.db2.gz IRHCRXYPOPOREG-SSDOTTSWSA-N -1 1 318.295 4.063 20 0 DIADMM C[C@@H](Oc1cc(Cl)c([O-])cc1Cl)c1cccnc1F ZINC001227645297 1053005960 /nfs/dbraw/zinc/00/59/60/1053005960.db2.gz HJRXBUYTPMCEQT-SSDOTTSWSA-N -1 1 302.132 4.373 20 0 DIADMM CCCC[C@H](Oc1[n-]c(=O)nc2c1CO[C@@H]2C)c1ccccc1 ZINC001227715031 1053010090 /nfs/dbraw/zinc/01/00/90/1053010090.db2.gz XXEKGMMAUUIGTB-DOMZBBRYSA-N -1 1 314.385 4.084 20 0 DIADMM Cc1cccc2c1[C@H](Oc1[n-]c(=S)nc3cnccc31)CC2 ZINC001227882615 1053025207 /nfs/dbraw/zinc/02/52/07/1053025207.db2.gz YMHUXUPSXVMPCW-CQSZACIVSA-N -1 1 309.394 4.062 20 0 DIADMM CC[C@@H](Oc1[n-]c(=S)nc2cnccc21)c1ccccc1F ZINC001227885289 1053025943 /nfs/dbraw/zinc/02/59/43/1053025943.db2.gz MBACCKLDWGNXLF-CQSZACIVSA-N -1 1 315.373 4.357 20 0 DIADMM C[C@H](Cc1ccco1)Oc1cc([O-])ccc1C(=O)c1ccccc1 ZINC001228184972 1053051309 /nfs/dbraw/zinc/05/13/09/1053051309.db2.gz ALVFWOUTSSVQEQ-CQSZACIVSA-N -1 1 322.360 4.226 20 0 DIADMM CC1(C)CN(C(=O)NCc2ccc([O-])c(Cl)c2)CC(C)(C)C1 ZINC001313237265 1053095429 /nfs/dbraw/zinc/09/54/29/1053095429.db2.gz UOLBEJHSTLOQNQ-UHFFFAOYSA-N -1 1 324.852 4.013 20 0 DIADMM CCC[C@]1(C)CCCN(C(=O)NCc2ccc([O-])c(Cl)c2)C1 ZINC001313237254 1053097174 /nfs/dbraw/zinc/09/71/74/1053097174.db2.gz UHKDVAGMHNOXNI-QGZVFWFLSA-N -1 1 324.852 4.157 20 0 DIADMM CN(C(=O)NCc1ccc([O-])c(Cl)c1)C1CCCCCCC1 ZINC001313236013 1053097635 /nfs/dbraw/zinc/09/76/35/1053097635.db2.gz HUZBDZLWNOJVQM-UHFFFAOYSA-N -1 1 324.852 4.300 20 0 DIADMM O=C(c1ccc2ccccc2c1[O-])N1CCC(c2ccco2)CC1 ZINC000617379670 1053129884 /nfs/dbraw/zinc/12/98/84/1053129884.db2.gz KZICEUXGCLHDMB-UHFFFAOYSA-N -1 1 321.376 4.158 20 0 DIADMM CCC(=O)c1c(O)cc([O-])cc1O[C@@H](c1ccccc1)C(C)C ZINC001228556349 1053133729 /nfs/dbraw/zinc/13/37/29/1053133729.db2.gz NVISKFHFTJZUTC-LJQANCHMSA-N -1 1 314.381 4.467 20 0 DIADMM CCC(=O)c1c(O)cc([O-])cc1O[C@H]1CCc2ccc(C)cc21 ZINC001228560327 1053134211 /nfs/dbraw/zinc/13/42/11/1053134211.db2.gz NEPOMTSRKUWICA-KRWDZBQOSA-N -1 1 312.365 4.065 20 0 DIADMM Cc1ccc(C(C)(C)C)cc1S(=O)(=O)[N-]c1ccsc1 ZINC001318765994 1053189696 /nfs/dbraw/zinc/18/96/96/1053189696.db2.gz SBFVSPUFQGINIO-UHFFFAOYSA-N -1 1 309.456 4.155 20 0 DIADMM Cc1ccc(S(=O)(=O)[N-]c2cccc3cc(C)ccc32)cc1 ZINC000150285639 1053252738 /nfs/dbraw/zinc/25/27/38/1053252738.db2.gz IIHDMUBYEAGJRR-UHFFFAOYSA-N -1 1 311.406 4.257 20 0 DIADMM CC[C@H](Oc1cc([O-])cc2oc(=O)ccc12)c1ccccc1F ZINC001229133888 1053254617 /nfs/dbraw/zinc/25/46/17/1053254617.db2.gz CQZRMZIWCAZICW-HNNXBMFYSA-N -1 1 314.312 4.168 20 0 DIADMM C[C@H](Oc1cc([O-])cc2oc(=O)ccc12)c1csc(Cl)c1 ZINC001229134711 1053255640 /nfs/dbraw/zinc/25/56/40/1053255640.db2.gz IXMSUXFDNYAITQ-QMMMGPOBSA-N -1 1 322.769 4.354 20 0 DIADMM CC[C@H](C[C@@H](C)CC)Oc1c([O-])c(OC)cc2ccc(=O)oc21 ZINC001229217150 1053275234 /nfs/dbraw/zinc/27/52/34/1053275234.db2.gz YDHZSPJRBLJDSB-WCQYABFASA-N -1 1 320.385 4.101 20 0 DIADMM CCC[C@@H](C)[C@H](CC)Oc1c([O-])c(OC)cc2ccc(=O)oc21 ZINC001229216407 1053275850 /nfs/dbraw/zinc/27/58/50/1053275850.db2.gz QHGQLHUIFYBMFD-YPMHNXCESA-N -1 1 320.385 4.101 20 0 DIADMM CCC[C@H](C)[C@H](CC)Oc1c([O-])c(OC)cc2ccc(=O)oc21 ZINC001229216403 1053276436 /nfs/dbraw/zinc/27/64/36/1053276436.db2.gz QHGQLHUIFYBMFD-AAEUAGOBSA-N -1 1 320.385 4.101 20 0 DIADMM CC(C)CN(C(=O)c1ccc(O)cc1[O-])c1ccc(Cl)cc1 ZINC001319948977 1053288688 /nfs/dbraw/zinc/28/86/88/1053288688.db2.gz CWNRCLCHAQZOKQ-UHFFFAOYSA-N -1 1 319.788 4.054 20 0 DIADMM CC(C)C[C@H](C)Oc1cc(O)ccc1C(=O)c1ccc([O-])cc1 ZINC001229294586 1053293572 /nfs/dbraw/zinc/29/35/72/1053293572.db2.gz QTGMRGZRCZQXMM-ZDUSSCGKSA-N -1 1 314.381 4.142 20 0 DIADMM CC1(C)C(=O)CCC[C@@H]1Oc1cc([O-])c(Cl)cc1Cl ZINC001229406371 1053316996 /nfs/dbraw/zinc/31/69/96/1053316996.db2.gz SGUOTBMPEVVVKZ-ZDUSSCGKSA-N -1 1 303.185 4.226 20 0 DIADMM CCC(CC)Oc1cc([O-])ccc1C(=O)Cc1ccc(O)cc1 ZINC001229431838 1053320330 /nfs/dbraw/zinc/32/03/30/1053320330.db2.gz IPHSHLQPBJTWEF-UHFFFAOYSA-N -1 1 314.381 4.091 20 0 DIADMM CCC(=O)c1ccc([O-])cc1O[C@H]1CC[C@H](C(F)(F)F)CC1 ZINC001229474901 1053330503 /nfs/dbraw/zinc/33/05/03/1053330503.db2.gz MJMAHBKRMUKSGH-UMSPYCQHSA-N -1 1 316.319 4.485 20 0 DIADMM CCc1ccc(C(=O)Nc2sc(C)nc2CC(C)C)c([O-])c1 ZINC001545742001 1053363417 /nfs/dbraw/zinc/36/34/17/1053363417.db2.gz BCFDCENXQYGNDA-UHFFFAOYSA-N -1 1 318.442 4.170 20 0 DIADMM CC(=O)c1cccc(C)c1OC(=C([O-])c1ccco1)c1ccco1 ZINC001230319795 1053518871 /nfs/dbraw/zinc/51/88/71/1053518871.db2.gz YIGRWDOKCWFYKL-LJQANCHMSA-N -1 1 324.332 4.387 20 0 DIADMM O=C(Nc1ccc([O-])c(Cl)c1)c1ccc(F)c(Cl)c1F ZINC000182873146 1053535612 /nfs/dbraw/zinc/53/56/12/1053535612.db2.gz OGDOLWDVQUCITQ-UHFFFAOYSA-N -1 1 318.106 4.230 20 0 DIADMM O=C([N-]c1csnc1-c1ccccc1)c1nc(Cl)cs1 ZINC001353833669 1053679830 /nfs/dbraw/zinc/67/98/30/1053679830.db2.gz DNAGAOYNTCKCTF-UHFFFAOYSA-N -1 1 321.814 4.172 20 0 DIADMM CCC(CC)[C@H](CC)Oc1cccnc1-c1ncccc1[O-] ZINC001231200477 1053699155 /nfs/dbraw/zinc/69/91/55/1053699155.db2.gz OLCWEGDTCCOOER-HNNXBMFYSA-N -1 1 300.402 4.443 20 0 DIADMM CC[C@@H](C)C[C@H](CC)Oc1cccnc1-c1ncccc1[O-] ZINC001231200419 1053699611 /nfs/dbraw/zinc/69/96/11/1053699611.db2.gz NGKSZKDQSONRIY-KGLIPLIRSA-N -1 1 300.402 4.443 20 0 DIADMM CCC[C@H](C)[C@H](CC)Oc1cccnc1-c1ncccc1[O-] ZINC001231201678 1053701122 /nfs/dbraw/zinc/70/11/22/1053701122.db2.gz BSIZFLCYLCJEIT-ZFWWWQNUSA-N -1 1 300.402 4.443 20 0 DIADMM CC[C@@H](C)CC[C@@H](C)Oc1cccnc1-c1ncccc1[O-] ZINC001231204891 1053701578 /nfs/dbraw/zinc/70/15/78/1053701578.db2.gz UZXVWYMZSAKDLW-ZIAGYGMSSA-N -1 1 300.402 4.443 20 0 DIADMM [O-]c1cccnc1-c1ncccc1O[C@H](c1ccccc1)C1CC1 ZINC001231201459 1053702419 /nfs/dbraw/zinc/70/24/19/1053702419.db2.gz LAMGGBMDUASXOD-HXUWFJFHSA-N -1 1 318.376 4.379 20 0 DIADMM C[C@@H](Oc1ccccc1C(=O)c1ccc([O-])cc1)c1ccncc1 ZINC001231228988 1053705070 /nfs/dbraw/zinc/70/50/70/1053705070.db2.gz MAPDRANBRHUCAB-CQSZACIVSA-N -1 1 319.360 4.158 20 0 DIADMM O=C([O-])c1ccc(F)c(CN2CCCC[C@H]2c2ccccc2)c1 ZINC001231457222 1053755056 /nfs/dbraw/zinc/75/50/56/1053755056.db2.gz PFPJAOXKPBSBNC-SFHVURJKSA-N -1 1 313.372 4.251 20 0 DIADMM Cc1ccc(C(=O)Nc2ccc(Br)c([O-])c2)c(C)c1 ZINC001326204350 1053762042 /nfs/dbraw/zinc/76/20/42/1053762042.db2.gz QAIDTFGJCBSDCA-UHFFFAOYSA-N -1 1 320.186 4.024 20 0 DIADMM [O-]c1cc(CN2Cc3ccccc3C(F)(F)C2)ccc1Cl ZINC001231733316 1053842298 /nfs/dbraw/zinc/84/22/98/1053842298.db2.gz RPSUMBSDDLTSDP-UHFFFAOYSA-N -1 1 309.743 4.153 20 0 DIADMM C[C@H]1CN(Cc2ccc(Cl)c([O-])c2)[C@@H](c2ccccc2)CO1 ZINC001231735090 1053846517 /nfs/dbraw/zinc/84/65/17/1053846517.db2.gz JBBUQJIFCQVURS-SUMWQHHRSA-N -1 1 317.816 4.008 20 0 DIADMM O=C([N-]c1c(F)ccnc1F)c1ccc(-c2ccccc2F)o1 ZINC001327649857 1053870966 /nfs/dbraw/zinc/87/09/66/1053870966.db2.gz ICKKUALNYDSKQB-UHFFFAOYSA-N -1 1 318.254 4.011 20 0 DIADMM CCN(Cc1ccccc1C)C(=O)c1c([O-])cccc1Cl ZINC000763645922 1053923942 /nfs/dbraw/zinc/92/39/42/1053923942.db2.gz ZCHLMDNSYLKIOM-UHFFFAOYSA-N -1 1 303.789 4.016 20 0 DIADMM O=C(Nc1ccc(O)cc1Cl)c1cc2ccccc2cc1[O-] ZINC001300696408 1053944854 /nfs/dbraw/zinc/94/48/54/1053944854.db2.gz HFUKGFMJZOFMAI-UHFFFAOYSA-N -1 1 313.740 4.157 20 0 DIADMM O=C(Nc1ccc(Br)c([O-])c1)C1CCC2(CC2)CC1 ZINC001328676458 1053948386 /nfs/dbraw/zinc/94/83/86/1053948386.db2.gz LTLLSCCINIYAKQ-UHFFFAOYSA-N -1 1 324.218 4.064 20 0 DIADMM Cc1nocc1[N-]C(=O)c1sc2cc(F)ccc2c1Cl ZINC001437293289 1054028275 /nfs/dbraw/zinc/02/82/75/1054028275.db2.gz QFYAVTQNTHUOJA-UHFFFAOYSA-N -1 1 310.737 4.243 20 0 DIADMM [O-]c1c(NC(=S)Nc2ccccc2)cccc1C(F)(F)F ZINC001200842846 1054030635 /nfs/dbraw/zinc/03/06/35/1054030635.db2.gz YUVHQNYZXGXVAW-UHFFFAOYSA-N -1 1 312.316 4.220 20 0 DIADMM [O-]c1cc(NC(=S)Nc2ccccc2Cl)c(F)cc1F ZINC001200857165 1054045343 /nfs/dbraw/zinc/04/53/43/1054045343.db2.gz LWOKPQQDRJCFIL-UHFFFAOYSA-N -1 1 314.744 4.133 20 0 DIADMM [O-]c1cc(F)c(NC(=S)Nc2ccccc2Cl)cc1F ZINC001200861406 1054050695 /nfs/dbraw/zinc/05/06/95/1054050695.db2.gz KMWPZZOGWWWDHF-UHFFFAOYSA-N -1 1 314.744 4.133 20 0 DIADMM [O-]c1c(F)cc(F)cc1NC(=S)Nc1ccccc1Cl ZINC001200863000 1054051535 /nfs/dbraw/zinc/05/15/35/1054051535.db2.gz STQYYWXIHUHLCV-UHFFFAOYSA-N -1 1 314.744 4.133 20 0 DIADMM COc1ccccc1[C@@H](C)N(C)Cc1cccc([O-])c1Cl ZINC001232788559 1054121464 /nfs/dbraw/zinc/12/14/64/1054121464.db2.gz CFYOBWFGNWPZEB-GFCCVEGCSA-N -1 1 305.805 4.247 20 0 DIADMM [O-]c1cccc(CN2CCSc3ccccc3C2)c1Cl ZINC001232789529 1054122649 /nfs/dbraw/zinc/12/26/49/1054122649.db2.gz LMMGCXIHXIEFMU-UHFFFAOYSA-N -1 1 305.830 4.154 20 0 DIADMM Cc1cc(C(=O)Nc2cc(F)c([O-])cc2Cl)c(C)n1C1CC1 ZINC001333510731 1054157663 /nfs/dbraw/zinc/15/76/63/1054157663.db2.gz HIIRWQWWHDESQR-UHFFFAOYSA-N -1 1 322.767 4.190 20 0 DIADMM [O-]c1cc(CN2CCC[C@H]2c2cccc(F)c2)cc(F)c1F ZINC001232970191 1054161356 /nfs/dbraw/zinc/16/13/56/1054161356.db2.gz BBJKKCPDAQETJY-HNNXBMFYSA-N -1 1 307.315 4.147 20 0 DIADMM Oc1cnc(Cl)cc1C[N@H+]1CC[C@H](c2cccc(Cl)c2)C1 ZINC001233038866 1054172916 /nfs/dbraw/zinc/17/29/16/1054172916.db2.gz HZSNVZAUACDCBD-LBPRGKRZSA-N -1 1 323.223 4.084 20 0 DIADMM Cc1ccc(C)c([C@H]2CCCN2C(=O)c2cc(F)ccc2[O-])c1 ZINC000622440396 1054229245 /nfs/dbraw/zinc/22/92/45/1054229245.db2.gz DAFJFXPVPXNVPE-QGZVFWFLSA-N -1 1 313.372 4.125 20 0 DIADMM Oc1ccc(F)c(CN2CCC[C@@H](c3ccccc3)CC2)c1F ZINC001233396061 1054260324 /nfs/dbraw/zinc/26/03/24/1054260324.db2.gz HQNNSNAGMMPRDL-OAHLLOKOSA-N -1 1 317.379 4.440 20 0 DIADMM O=C(NC1CCC(C(F)F)CC1)c1cc2ccccc2cc1[O-] ZINC000622695832 1054330254 /nfs/dbraw/zinc/33/02/54/1054330254.db2.gz RLBUJXBTOXWNJI-UHFFFAOYSA-N -1 1 319.351 4.099 20 0 DIADMM O=C(Nc1ccc(SC(F)F)cc1)c1cc(F)ccc1[O-] ZINC001440521038 1054355823 /nfs/dbraw/zinc/35/58/23/1054355823.db2.gz PACMQFNLGPXVAJ-UHFFFAOYSA-N -1 1 313.300 4.098 20 0 DIADMM CCCCCC[C@](C)(CC)C(=O)Nc1n[n-]c(C(F)(F)F)n1 ZINC001340812846 1054367319 /nfs/dbraw/zinc/36/73/19/1054367319.db2.gz RPNXOISWLDSKFR-ZDUSSCGKSA-N -1 1 320.359 4.149 20 0 DIADMM Cc1ccccc1[C@H]1CCCN1C(=O)c1ccc(Cl)cc1[O-] ZINC001441874003 1054401601 /nfs/dbraw/zinc/40/16/01/1054401601.db2.gz YJVQIUVGSXJORD-MRXNPFEDSA-N -1 1 315.800 4.331 20 0 DIADMM Cc1cccc(CN(CC(C)C)C(=O)c2ccc([O-])cc2F)c1 ZINC001442381366 1054419230 /nfs/dbraw/zinc/41/92/30/1054419230.db2.gz ZZDRSQMPXWBVMW-UHFFFAOYSA-N -1 1 315.388 4.138 20 0 DIADMM CCCCN(C(=O)c1ccc([O-])cc1F)[C@H](C)c1ccc(C)o1 ZINC001442409390 1054420869 /nfs/dbraw/zinc/42/08/69/1054420869.db2.gz GHRJBDRSDGYALQ-CYBMUJFWSA-N -1 1 319.376 4.436 20 0 DIADMM O=C(c1cc(F)ccc1[O-])N1CCCCC[C@H]1c1ccccc1 ZINC001442744596 1054431531 /nfs/dbraw/zinc/43/15/31/1054431531.db2.gz OFVGVOMUUXHMIE-KRWDZBQOSA-N -1 1 313.372 4.289 20 0 DIADMM Cc1ccc(C(=O)Nc2ccc(Br)c([O-])c2)cc1C ZINC001343525357 1054448409 /nfs/dbraw/zinc/44/84/09/1054448409.db2.gz FGSSPVORINKUDJ-UHFFFAOYSA-N -1 1 320.186 4.024 20 0 DIADMM Cc1cnc(C(=O)N2CCCC[C@H]2c2cccc(C)c2C)c([O-])c1 ZINC001444746179 1054486468 /nfs/dbraw/zinc/48/64/68/1054486468.db2.gz WLAAOIQSCNKAHT-KRWDZBQOSA-N -1 1 324.424 4.080 20 0 DIADMM Cc1ccc([C@@H]2C[C@H](C)CCN2C(=O)c2ccc(F)c([O-])c2)o1 ZINC001444887744 1054490668 /nfs/dbraw/zinc/49/06/68/1054490668.db2.gz UACQYUVVCMOWPX-ABAIWWIYSA-N -1 1 317.360 4.046 20 0 DIADMM C[C@@H](NC(=O)c1ccc2ccccc2c1[O-])[C@@H](C)c1ccccc1 ZINC001445149809 1054497012 /nfs/dbraw/zinc/49/70/12/1054497012.db2.gz FCMRGTBWJXMPOC-HUUCEWRRSA-N -1 1 319.404 4.467 20 0 DIADMM O=C(c1cccc([O-])c1F)N1CCC[C@@H]1CCC1CCCC1 ZINC001446122359 1054525994 /nfs/dbraw/zinc/52/59/94/1054525994.db2.gz ZXWQHGMUSYUKGE-CQSZACIVSA-N -1 1 305.393 4.106 20 0 DIADMM C[C@@H]1C[C@@H](c2ccccc2)N(C(=O)c2cc(Cl)ccc2[O-])C1 ZINC001449201347 1054614483 /nfs/dbraw/zinc/61/44/83/1054614483.db2.gz HMALQLCIXVTTAQ-WBMJQRKESA-N -1 1 315.800 4.269 20 0 DIADMM O=C(Nc1ccc([O-])c(F)c1F)c1cc(Cl)cc(Cl)c1 ZINC001449450616 1054620462 /nfs/dbraw/zinc/62/04/62/1054620462.db2.gz XJCNVQJPDPMFML-UHFFFAOYSA-N -1 1 318.106 4.230 20 0 DIADMM CCSc1ccccc1C(=O)Nc1ccc([O-])c(F)c1F ZINC001449445667 1054621286 /nfs/dbraw/zinc/62/12/86/1054621286.db2.gz JHSGALCBZHERRM-UHFFFAOYSA-N -1 1 309.337 4.035 20 0 DIADMM C/C(=C\c1cccc(Cl)c1)C(=O)Nc1ccc([O-])c(F)c1F ZINC001449451984 1054622141 /nfs/dbraw/zinc/62/21/41/1054622141.db2.gz XPMVCTUTFADJKK-VQHVLOKHSA-N -1 1 323.726 4.366 20 0 DIADMM CC(C)(C)C(C)(C)CNC(=O)c1ccc2ccc(O)cc2c1[O-] ZINC001450192209 1054640547 /nfs/dbraw/zinc/64/05/47/1054640547.db2.gz NBJIECPTFRZOGM-UHFFFAOYSA-N -1 1 315.413 4.053 20 0 DIADMM C=COc1ccc(NC(=O)c2ccc3ccc(O)cc3c2[O-])cc1 ZINC001451143986 1054669872 /nfs/dbraw/zinc/66/98/72/1054669872.db2.gz LQAUHXJVPXWEDE-UHFFFAOYSA-N -1 1 321.332 4.026 20 0 DIADMM CC(C)(C)[C@@H]1CCC[C@H]1NC(=O)c1cc2ccccc2cc1[O-] ZINC001451294573 1054673686 /nfs/dbraw/zinc/67/36/86/1054673686.db2.gz JQHNTZCHZYXZDS-IAGOWNOFSA-N -1 1 311.425 4.490 20 0 DIADMM CCCCNc1ccccc1C(=O)Nc1cc(F)cc(F)c1[O-] ZINC001451737752 1054685522 /nfs/dbraw/zinc/68/55/22/1054685522.db2.gz AMVCASUPRVNAJX-UHFFFAOYSA-N -1 1 320.339 4.135 20 0 DIADMM CC1(C)CCC[C@@H]1[C@H]1CCN(C(=O)c2cc(Cl)ccc2[O-])C1 ZINC001452131015 1054692887 /nfs/dbraw/zinc/69/28/87/1054692887.db2.gz KNCRUYHBWTVPGL-SWLSCSKDSA-N -1 1 321.848 4.334 20 0 DIADMM Cc1ccc(N(CC(C)C)C(=O)c2ccc(F)c([O-])c2)c(C)c1 ZINC001452892137 1054719754 /nfs/dbraw/zinc/71/97/54/1054719754.db2.gz YODVZNSVGMHAKH-UHFFFAOYSA-N -1 1 315.388 4.451 20 0 DIADMM C[C@H]1CC[C@@](C)(CNC(=O)Cc2ccc([O-])c(Cl)c2)C1(C)C ZINC001453047739 1054729024 /nfs/dbraw/zinc/72/90/24/1054729024.db2.gz JBXDTBBXMCPEJB-SGTLLEGYSA-N -1 1 323.864 4.167 20 0 DIADMM CC(C)c1cccc(O[C@@H](C)C(=O)Nc2cccc(F)c2[O-])c1 ZINC001454754157 1054783705 /nfs/dbraw/zinc/78/37/05/1054783705.db2.gz HHXAQBAFIFMORD-LBPRGKRZSA-N -1 1 317.360 4.061 20 0 DIADMM Cc1cc2[nH]ccc2c(-c2ccc(C(=O)[O-])c(C)c2Cl)n1 ZINC001236115174 1054957274 /nfs/dbraw/zinc/95/72/74/1054957274.db2.gz YZTXEAZSJDMGAO-UHFFFAOYSA-N -1 1 300.745 4.198 20 0 DIADMM CSc1nc2ccccc2c(-c2c(F)ccc(C)c2[O-])n1 ZINC001236389929 1055089579 /nfs/dbraw/zinc/08/95/79/1055089579.db2.gz BMVLVCLJDIFSNF-UHFFFAOYSA-N -1 1 300.358 4.172 20 0 DIADMM Cc1ccc(F)c(-c2ccc(NC(=O)OC(C)(C)C)cn2)c1[O-] ZINC001236392154 1055089703 /nfs/dbraw/zinc/08/97/03/1055089703.db2.gz QBPKEQCVLZKCLO-UHFFFAOYSA-N -1 1 318.348 4.249 20 0 DIADMM Cc1ccc(F)c(-c2nc3ccccc3nc2N2CCCC2)c1[O-] ZINC001236390433 1055089987 /nfs/dbraw/zinc/08/99/87/1055089987.db2.gz KRSQKODNPYAKQL-UHFFFAOYSA-N -1 1 323.371 4.050 20 0 DIADMM Cc1ccc(F)c(-c2ncnc3sc4c(c32)CCCC4)c1[O-] ZINC001236391530 1055090143 /nfs/dbraw/zinc/09/01/43/1055090143.db2.gz JNZBNLSGIZCZSJ-UHFFFAOYSA-N -1 1 314.385 4.390 20 0 DIADMM COc1cc2ccnc(-c3c(F)ccc(C)c3[O-])c2cc1OC ZINC001236389721 1055090199 /nfs/dbraw/zinc/09/01/99/1055090199.db2.gz BHHVVYNLGYPZME-UHFFFAOYSA-N -1 1 313.328 4.072 20 0 DIADMM Cc1ccc(F)c(-c2nc(C(F)(F)F)cc3cc[nH]c32)c1[O-] ZINC001236393994 1055090434 /nfs/dbraw/zinc/09/04/34/1055090434.db2.gz ZLANHJAZESMNFU-UHFFFAOYSA-N -1 1 310.250 4.402 20 0 DIADMM Cc1ccc(F)c(-c2cccc(N3CCCC[C@H]3C)n2)c1[O-] ZINC001236389518 1055090824 /nfs/dbraw/zinc/09/08/24/1055090824.db2.gz FBJOZOJGUAPSIK-CYBMUJFWSA-N -1 1 300.377 4.281 20 0 DIADMM Cc1ccc(F)c(-c2cncc(OC3CCCCC3)n2)c1[O-] ZINC001236393827 1055092250 /nfs/dbraw/zinc/09/22/50/1055092250.db2.gz UZFFIXUKIVQUGB-UHFFFAOYSA-N -1 1 302.349 4.008 20 0 DIADMM CC1(C)CCC(C)(NC(=O)c2ncc3ccccc3c2[O-])CC1 ZINC001587350557 1055271264 /nfs/dbraw/zinc/27/12/64/1055271264.db2.gz XUBVAONSBMOJNU-UHFFFAOYSA-N -1 1 312.413 4.029 20 0 DIADMM Cc1cc(NC(=O)c2ccc(C(C)C)cc2[O-])cnc1Cl ZINC001587408443 1055291522 /nfs/dbraw/zinc/29/15/22/1055291522.db2.gz IAMWURZHEZQWGK-UHFFFAOYSA-N -1 1 304.777 4.125 20 0 DIADMM O=C(N[C@@H]1CC[C@H]2CCCC[C@@H]2C1)c1ccc(Cl)cc1[O-] ZINC001587543205 1055324698 /nfs/dbraw/zinc/32/46/98/1055324698.db2.gz OLHKJZHYHXNTJM-YRGRVCCFSA-N -1 1 307.821 4.134 20 0 DIADMM CC(C)CCC[C@H](C)NC(=O)c1c([O-])cnc2c(F)cccc21 ZINC001588042145 1055419331 /nfs/dbraw/zinc/41/93/31/1055419331.db2.gz YPCHIVHQZUAIMZ-LBPRGKRZSA-N -1 1 318.392 4.024 20 0 DIADMM CCN(C(=O)c1cc(SC)ccc1[O-])c1cccc(Cl)c1 ZINC001588308865 1055468676 /nfs/dbraw/zinc/46/86/76/1055468676.db2.gz PYIDAWJMWFJUPY-UHFFFAOYSA-N -1 1 321.829 4.434 20 0 DIADMM C[C@H](c1ccccc1Cl)N(C)Cc1ccccc1C(=O)[O-] ZINC000062015192 1055472878 /nfs/dbraw/zinc/47/28/78/1055472878.db2.gz QMFMLWVSKQONBM-GFCCVEGCSA-N -1 1 303.789 4.231 20 0 DIADMM CCN(Cc1cccc(F)c1)C(=O)c1cc2ccccc2cc1[O-] ZINC000023745507 1055504105 /nfs/dbraw/zinc/50/41/05/1055504105.db2.gz XBNMRJLAFLTPCR-UHFFFAOYSA-N -1 1 323.367 4.347 20 0 DIADMM CCC[C@@H](NC(=O)NCc1ccc([O-])c(Cl)c1)C(C)(C)C ZINC001564780808 1055598546 /nfs/dbraw/zinc/59/85/46/1055598546.db2.gz OFGIHCTYEISIFV-CQSZACIVSA-N -1 1 312.841 4.060 20 0 DIADMM CN(Cc1cc(Cl)c([O-])cc1F)[C@H]1CCc2ccccc21 ZINC001238151256 1055611269 /nfs/dbraw/zinc/61/12/69/1055611269.db2.gz AKTFQCUOMWSNRX-INIZCTEOSA-N -1 1 305.780 4.304 20 0 DIADMM O=C([O-])c1cc(F)ccc1CN1CCC[C@H]1c1ccccc1F ZINC001238236142 1055627666 /nfs/dbraw/zinc/62/76/66/1055627666.db2.gz QHAQXGZCBNSADB-KRWDZBQOSA-N -1 1 317.335 4.000 20 0 DIADMM O=C(N[C@H]1CCSc2ccccc21)c1cc(Cl)ccc1[O-] ZINC000032742447 1055654783 /nfs/dbraw/zinc/65/47/83/1055654783.db2.gz KCOCFDQVPZTQFG-ZDUSSCGKSA-N -1 1 319.813 4.013 20 0 DIADMM O=C(Nc1ccc2ccccc2n1)c1cc2ccccc2cc1[O-] ZINC001596046302 1055662488 /nfs/dbraw/zinc/66/24/88/1055662488.db2.gz PWLFSZBLCHGJBN-UHFFFAOYSA-N -1 1 314.344 4.346 20 0 DIADMM Cc1cccc([C@H](C)NC(=O)c2ccc(Cl)cc2[O-])c1C ZINC001565704856 1055720250 /nfs/dbraw/zinc/72/02/50/1055720250.db2.gz VEQRKKRTCWXJPF-LBPRGKRZSA-N -1 1 303.789 4.153 20 0 DIADMM CCC(CC)[C@H](NC(=O)c1cc(F)ccc1[O-])c1ccccc1 ZINC001565884417 1055735244 /nfs/dbraw/zinc/73/52/44/1055735244.db2.gz QYMRHRWQNSVTNW-SFHVURJKSA-N -1 1 315.388 4.439 20 0 DIADMM Cc1ccc([C@@H]2[C@@H](C)CCCN2C(=O)c2ncc(C)cc2[O-])cc1 ZINC001565973444 1055738469 /nfs/dbraw/zinc/73/84/69/1055738469.db2.gz USQYFJLPRNPTBV-KXBFYZLASA-N -1 1 324.424 4.017 20 0 DIADMM CCOC(=O)c1nc2cc(-c3ccc(C4CC4)cc3)ccc2[n-]1 ZINC001238838084 1055760261 /nfs/dbraw/zinc/76/02/61/1055760261.db2.gz MTDAIKGJJMYLNT-UHFFFAOYSA-N -1 1 306.365 4.284 20 0 DIADMM CCOC(=O)c1nc2ccc(-c3ccc(C4CC4)cc3)cc2[n-]1 ZINC001238838084 1055760272 /nfs/dbraw/zinc/76/02/72/1055760272.db2.gz MTDAIKGJJMYLNT-UHFFFAOYSA-N -1 1 306.365 4.284 20 0 DIADMM Cc1ccc(C)c([C@H]2CCCN2C(=O)c2cccc([O-])c2F)c1 ZINC001566377806 1055767364 /nfs/dbraw/zinc/76/73/64/1055767364.db2.gz NRLIZULOROKBCH-MRXNPFEDSA-N -1 1 313.372 4.125 20 0 DIADMM C[C@@]1(NC(=O)c2cc(Cl)ccc2[O-])CCCc2ccccc21 ZINC001597277841 1055809752 /nfs/dbraw/zinc/80/97/52/1055809752.db2.gz PLAOQEMHUWEHLG-GOSISDBHSA-N -1 1 315.800 4.027 20 0 DIADMM CC(C)c1cccc(CNC(=O)c2c([O-])cccc2Cl)c1 ZINC001567756728 1055816074 /nfs/dbraw/zinc/81/60/74/1055816074.db2.gz ZKFFNVUXVBQDTD-UHFFFAOYSA-N -1 1 303.789 4.099 20 0 DIADMM C[C@H]1C[C@H](c2ccccc2)N(C(=O)c2ccc(Cl)cc2[O-])C1 ZINC001568779846 1055845451 /nfs/dbraw/zinc/84/54/51/1055845451.db2.gz FLYDYVSQSNUTHV-BLLLJJGKSA-N -1 1 315.800 4.269 20 0 DIADMM C[C@H](NC(=O)c1c([O-])cccc1Cl)c1cccc(C2CC2)c1 ZINC001569654994 1055867583 /nfs/dbraw/zinc/86/75/83/1055867583.db2.gz IGGZYKZENIBJPF-NSHDSACASA-N -1 1 315.800 4.414 20 0 DIADMM O=C(Nc1ccc2sccc2c1)c1c(F)ccc([O-])c1F ZINC001539603283 1055867999 /nfs/dbraw/zinc/86/79/99/1055867999.db2.gz BJCJPIIBSOOILS-UHFFFAOYSA-N -1 1 305.305 4.137 20 0 DIADMM C[C@@H](NC(=O)c1cc(Cl)ccc1[O-])c1cccc(C2CC2)c1 ZINC001569655950 1055868332 /nfs/dbraw/zinc/86/83/32/1055868332.db2.gz SYBJAYDYYQVMOU-LLVKDONJSA-N -1 1 315.800 4.414 20 0 DIADMM C[C@@H]1C[C@H](C(C)(C)C)CCN1C(=O)Cc1ccc([O-])c(Cl)c1 ZINC001569936638 1055879865 /nfs/dbraw/zinc/87/98/65/1055879865.db2.gz VYAMYILSCRIJAZ-TZMCWYRMSA-N -1 1 323.864 4.261 20 0 DIADMM CC[C@H](NC(=O)c1cccc([O-])c1F)c1ccc(Cl)cc1 ZINC001539788812 1055903178 /nfs/dbraw/zinc/90/31/78/1055903178.db2.gz PBQJZZSYSGWPRT-ZDUSSCGKSA-N -1 1 307.752 4.066 20 0 DIADMM O=C(Nc1cc(F)cc(F)c1[O-])c1cc2c(s1)CCCCC2 ZINC001570464942 1055904251 /nfs/dbraw/zinc/90/42/51/1055904251.db2.gz VYXZGZQPRGSXTJ-UHFFFAOYSA-N -1 1 323.364 4.253 20 0 DIADMM CCN(C(=O)c1ccccc1[O-])c1cccc(C(F)(F)F)c1 ZINC001570582134 1055909384 /nfs/dbraw/zinc/90/93/84/1055909384.db2.gz XQWREHQYAOKMMY-UHFFFAOYSA-N -1 1 309.287 4.078 20 0 DIADMM Cc1ccccc1C1(NC(=O)c2cc3ccccc3cc2[O-])CC1 ZINC001570629789 1055910942 /nfs/dbraw/zinc/91/09/42/1055910942.db2.gz UMHCBNBIZQLYQA-UHFFFAOYSA-N -1 1 317.388 4.273 20 0 DIADMM CC(C)c1ccc(C(=O)Nc2ccc3c(c2)CCCC3=O)c([O-])c1 ZINC001570651619 1055911061 /nfs/dbraw/zinc/91/10/61/1055911061.db2.gz HPRNAMKMOXHBDU-UHFFFAOYSA-N -1 1 323.392 4.287 20 0 DIADMM O=C(N[C@@H](C1CCC1)C1CCCCC1)c1ccc(F)c([O-])c1 ZINC001570664982 1055913169 /nfs/dbraw/zinc/91/31/69/1055913169.db2.gz FOLAGUOPLCBGKQ-QGZVFWFLSA-N -1 1 305.393 4.010 20 0 DIADMM CC(C)CCc1cc(NC(=O)c2ccc(C(C)C)cc2[O-])n[nH]1 ZINC001570765644 1055915553 /nfs/dbraw/zinc/91/55/53/1055915553.db2.gz FWLHPRRFKDTFTF-UHFFFAOYSA-N -1 1 315.417 4.080 20 0 DIADMM Cc1cccc(C(C)(C)CNC(=O)c2cc(Cl)ccc2[O-])c1 ZINC001598181801 1055924015 /nfs/dbraw/zinc/92/40/15/1055924015.db2.gz ORPKOTRURXAJJV-UHFFFAOYSA-N -1 1 317.816 4.062 20 0 DIADMM O=C(Cc1ccc([O-])c(Cl)c1)Nc1ccc(C(F)F)cc1 ZINC001598321918 1055938761 /nfs/dbraw/zinc/93/87/61/1055938761.db2.gz JMKKMNAHASIPLF-UHFFFAOYSA-N -1 1 311.715 4.164 20 0 DIADMM COC(=O)c1nc2cc(-c3cc(C(C)C)ccc3OC)ccc2[n-]1 ZINC001239659345 1056005998 /nfs/dbraw/zinc/00/59/98/1056005998.db2.gz AYNKKUPDGQWOAI-UHFFFAOYSA-N -1 1 324.380 4.149 20 0 DIADMM COC(=O)c1nc2ccc(-c3cc(C(C)C)ccc3OC)cc2[n-]1 ZINC001239659345 1056006013 /nfs/dbraw/zinc/00/60/13/1056006013.db2.gz AYNKKUPDGQWOAI-UHFFFAOYSA-N -1 1 324.380 4.149 20 0 DIADMM CC(C)c1ccc(C(=O)N2CCc3cc(Cl)ccc32)c([O-])c1 ZINC001603367875 1056024956 /nfs/dbraw/zinc/02/49/56/1056024956.db2.gz FJXBKZWFCXTDRL-UHFFFAOYSA-N -1 1 315.800 4.372 20 0 DIADMM CSc1ccc([O-])c(C(=O)Nc2ccc(C)c(Cl)c2)c1 ZINC001540437295 1056030952 /nfs/dbraw/zinc/03/09/52/1056030952.db2.gz MLAASUAQWFNAOU-UHFFFAOYSA-N -1 1 307.802 4.328 20 0 DIADMM O=C(Nc1ccc2c(c1)CCC2)c1ccc(C(F)(F)F)cc1[O-] ZINC001540463110 1056034618 /nfs/dbraw/zinc/03/46/18/1056034618.db2.gz XPWCUZUACZAQHJ-UHFFFAOYSA-N -1 1 321.298 4.152 20 0 DIADMM CC[C@@H](NC(=O)c1ncc2ccccc2c1[O-])C1CCCCC1 ZINC001607365599 1056048801 /nfs/dbraw/zinc/04/88/01/1056048801.db2.gz XFHNXZVHINXJME-MRXNPFEDSA-N -1 1 312.413 4.029 20 0 DIADMM CC(C)Cc1cccc([C@@H](C)C(=O)Nc2c([O-])cccc2F)c1 ZINC000671784878 1056066720 /nfs/dbraw/zinc/06/67/20/1056066720.db2.gz BTJHEYHGRJMBDQ-CYBMUJFWSA-N -1 1 315.388 4.472 20 0 DIADMM CC1CCC(N(C(=O)c2ncc3ccccc3c2[O-])C2CC2)CC1 ZINC001583582619 1056109509 /nfs/dbraw/zinc/10/95/09/1056109509.db2.gz CVCVQWNSEMEDCI-UHFFFAOYSA-N -1 1 324.424 4.124 20 0 DIADMM Cc1cccc([C@@H](NC(=O)c2c([O-])cccc2F)C(C)(C)C)c1 ZINC001542214535 1056110638 /nfs/dbraw/zinc/11/06/38/1056110638.db2.gz VYHPHKPMLLZITN-QGZVFWFLSA-N -1 1 315.388 4.357 20 0 DIADMM C[C@@H](CNC(=O)c1ccc2ccccc2c1[O-])c1ccc(F)cc1 ZINC001542627952 1056145540 /nfs/dbraw/zinc/14/55/40/1056145540.db2.gz UWSVPLOFBSLUNH-ZDUSSCGKSA-N -1 1 323.367 4.218 20 0 DIADMM CC(C)CCc1ccccc1NC(=O)c1ccc(F)c([O-])c1 ZINC001583708454 1056147917 /nfs/dbraw/zinc/14/79/17/1056147917.db2.gz SHULPJPUCDTHPR-UHFFFAOYSA-N -1 1 301.361 4.372 20 0 DIADMM CC[C@@H](Cc1ccccc1)NC(=O)c1cc2ccccc2cc1[O-] ZINC001542777687 1056154269 /nfs/dbraw/zinc/15/42/69/1056154269.db2.gz HXUNKPBHJLIWDH-SFHVURJKSA-N -1 1 319.404 4.297 20 0 DIADMM CC[C@H](Cc1ccccc1)NC(=O)c1cc2ccccc2cc1[O-] ZINC001542777686 1056154909 /nfs/dbraw/zinc/15/49/09/1056154909.db2.gz HXUNKPBHJLIWDH-GOSISDBHSA-N -1 1 319.404 4.297 20 0 DIADMM Cc1cc(C)cc([C@H](C)NC(=O)c2cc(Cl)ccc2[O-])c1 ZINC001543103817 1056176149 /nfs/dbraw/zinc/17/61/49/1056176149.db2.gz KRDRLYMSJJDHAU-LBPRGKRZSA-N -1 1 303.789 4.153 20 0 DIADMM Cc1ccc(N(Cc2ccco2)C(=O)c2ccccc2[O-])cc1C ZINC001543117906 1056179584 /nfs/dbraw/zinc/17/95/84/1056179584.db2.gz RXWUPBSDWISVBK-UHFFFAOYSA-N -1 1 321.376 4.449 20 0 DIADMM CCC(C)(C)C1CCC(NC(=O)c2c([O-])cccc2F)CC1 ZINC001543159735 1056180998 /nfs/dbraw/zinc/18/09/98/1056180998.db2.gz VYUKIKLPVFNQJR-UHFFFAOYSA-N -1 1 307.409 4.256 20 0 DIADMM Cc1sc(NC(=O)c2ccccc2[O-])nc1-c1ccc(C)cc1 ZINC001543208904 1056188702 /nfs/dbraw/zinc/18/87/02/1056188702.db2.gz WQMQLNKZEYTRSR-UHFFFAOYSA-N -1 1 324.405 4.385 20 0 DIADMM Cc1cccc([C@@H](C)NC(=O)c2ncc3ccccc3c2[O-])c1C ZINC001543319376 1056202211 /nfs/dbraw/zinc/20/22/11/1056202211.db2.gz JWOUBEQZFMAOBZ-CQSZACIVSA-N -1 1 320.392 4.048 20 0 DIADMM CCCC[C@H](CC)CNC(=O)c1ccc2ccc(O)cc2c1[O-] ZINC001543336400 1056205001 /nfs/dbraw/zinc/20/50/01/1056205001.db2.gz SNSHCXFBJAOAFY-ZDUSSCGKSA-N -1 1 315.413 4.197 20 0 DIADMM Cc1c([N-]c2nc(C3CCCCC3)ns2)cnn1CC(C)C ZINC001612152153 1056247859 /nfs/dbraw/zinc/24/78/59/1056247859.db2.gz UBZUIVIRVVDHGI-UHFFFAOYSA-N -1 1 319.478 4.490 20 0 DIADMM CCCN(Cc1ccc(F)cc1)C(=O)c1c([O-])cccc1Cl ZINC001543547934 1056247654 /nfs/dbraw/zinc/24/76/54/1056247654.db2.gz ZUXJDALQTRRMFQ-UHFFFAOYSA-N -1 1 321.779 4.237 20 0 DIADMM O=C(c1c(F)ccc([O-])c1F)N1CCC[C@@H](C2CCCCC2)C1 ZINC001301405334 1056263646 /nfs/dbraw/zinc/26/36/46/1056263646.db2.gz GISJAKWTQBGISE-CYBMUJFWSA-N -1 1 323.383 4.103 20 0 DIADMM [O-]c1c(-c2nc(C3CCSCC3)no2)ccc2ccccc21 ZINC000402337404 1056340163 /nfs/dbraw/zinc/34/01/63/1056340163.db2.gz VLWPFPAPJGJLPF-UHFFFAOYSA-N -1 1 312.394 4.206 20 0 DIADMM CCCc1cc(=O)[n-]c(SCc2ccccc2OC(C)C)n1 ZINC001613234462 1056361838 /nfs/dbraw/zinc/36/18/38/1056361838.db2.gz KVTULXMZQNHGRV-UHFFFAOYSA-N -1 1 318.442 4.214 20 0 DIADMM CC1(C)CC[C@H](NC(=O)c2cccc([O-])c2F)c2ccccc21 ZINC001544257819 1056393859 /nfs/dbraw/zinc/39/38/59/1056393859.db2.gz NIQNFMSPIVXJSG-HNNXBMFYSA-N -1 1 313.372 4.074 20 0 DIADMM CCCCc1ccc(S(=O)(=O)[N-]c2cc(F)ccc2C)cc1 ZINC000013948437 1056432189 /nfs/dbraw/zinc/43/21/89/1056432189.db2.gz TUWIVGZEVGQXOD-UHFFFAOYSA-N -1 1 321.417 4.278 20 0 DIADMM COC(=O)c1sc(C)cc1Nc1cc(F)c([O-])c(Cl)c1 ZINC001214480623 1056544417 /nfs/dbraw/zinc/54/44/17/1056544417.db2.gz VNBVYQIGMUTZPW-UHFFFAOYSA-N -1 1 315.753 4.085 20 0 DIADMM CCCCN(C)c1ccc(NC(=O)c2cccc([O-])c2F)cc1 ZINC001585512866 1056568160 /nfs/dbraw/zinc/56/81/60/1056568160.db2.gz CGOQUBLTCVNQIL-UHFFFAOYSA-N -1 1 316.376 4.020 20 0 DIADMM [O-]c1c(F)cc(Nc2cnc(Cl)nc2Cl)cc1Cl ZINC001214483023 1056574717 /nfs/dbraw/zinc/57/47/17/1056574717.db2.gz YZEKOEIGEIYUTL-UHFFFAOYSA-N -1 1 308.527 4.025 20 0 DIADMM COc1cccc2cc(C(=O)Nc3ccc([O-])c(Cl)c3)oc21 ZINC000111667688 1056588906 /nfs/dbraw/zinc/58/89/06/1056588906.db2.gz RSGXYMCVJGSCBU-UHFFFAOYSA-N -1 1 317.728 4.053 20 0 DIADMM O=C(NC1CCC2(CCCCC2)CC1)c1ccc([O-])c(F)c1 ZINC001616340218 1056637601 /nfs/dbraw/zinc/63/76/01/1056637601.db2.gz KPJYRRPIPLLWRJ-UHFFFAOYSA-N -1 1 305.393 4.154 20 0 DIADMM O=C1CCCN1c1ccc(Nc2cc(F)c([O-])c(Cl)c2)cc1 ZINC001214486567 1056644195 /nfs/dbraw/zinc/64/41/95/1056644195.db2.gz NGTXIPULFQJUFI-UHFFFAOYSA-N -1 1 320.751 4.055 20 0 DIADMM [O-]c1ccc(F)cc1-c1nc(C(F)F)nc2ccc(F)cc21 ZINC001240696144 1056647796 /nfs/dbraw/zinc/64/77/96/1056647796.db2.gz CYDGKPCFXUINFH-UHFFFAOYSA-N -1 1 308.234 4.218 20 0 DIADMM [O-]c1ccc(F)cc1-c1nc(-c2ccccn2)nc2ccccc21 ZINC001240695392 1056648222 /nfs/dbraw/zinc/64/82/22/1056648222.db2.gz JLXTYUFPKCQIIA-UHFFFAOYSA-N -1 1 317.323 4.204 20 0 DIADMM CC(C)c1ccc(C(=O)Nc2ccc3ccn(C)c3c2)c([O-])c1 ZINC001616574723 1056680023 /nfs/dbraw/zinc/68/00/23/1056680023.db2.gz LSURBOVPYIGXRE-UHFFFAOYSA-N -1 1 308.381 4.260 20 0 DIADMM CCCCN(C)c1ccc(NC(=O)c2ccc(F)c([O-])c2)cc1 ZINC001616648236 1056694141 /nfs/dbraw/zinc/69/41/41/1056694141.db2.gz BYVCGJCDBNPCJG-UHFFFAOYSA-N -1 1 316.376 4.020 20 0 DIADMM [O-]c1ccc(-c2nc(-c3ccncc3)nc3ccccc32)cc1F ZINC001240782736 1056695074 /nfs/dbraw/zinc/69/50/74/1056695074.db2.gz HFMAGDMRENJFJN-UHFFFAOYSA-N -1 1 317.323 4.204 20 0 DIADMM [O-]c1ccc(-c2ncc3ccc(C(F)(F)F)cc3n2)cc1F ZINC001240782335 1056695716 /nfs/dbraw/zinc/69/57/16/1056695716.db2.gz WHABGVXARYDCJL-UHFFFAOYSA-N -1 1 308.234 4.160 20 0 DIADMM Cc1nc2sc3c(c2c(-c2ccc([O-])c(F)c2)n1)CCC3 ZINC001240782775 1056695736 /nfs/dbraw/zinc/69/57/36/1056695736.db2.gz IYJYSBIFJDACHW-UHFFFAOYSA-N -1 1 300.358 4.000 20 0 DIADMM CC(C)[C@@H]1CCC[C@@H](NC(=O)c2cc3ccccc3cc2[O-])C1 ZINC001616662382 1056697255 /nfs/dbraw/zinc/69/72/55/1056697255.db2.gz VWHSMYLSJHLRPG-RHSMWYFYSA-N -1 1 311.425 4.490 20 0 DIADMM [O-]c1ccc(-c2cnc3ccc(C(F)(F)F)cc3n2)cc1F ZINC001240783486 1056697391 /nfs/dbraw/zinc/69/73/91/1056697391.db2.gz SLLDWRQFBAZCJL-UHFFFAOYSA-N -1 1 308.234 4.160 20 0 DIADMM C[C@@H]1CCN(C(=O)Cc2ccc([O-])c(Cl)c2)c2ccccc21 ZINC001626066115 1056715875 /nfs/dbraw/zinc/71/58/75/1056715875.db2.gz ZCTYCGHGEVAZCK-GFCCVEGCSA-N -1 1 315.800 4.129 20 0 DIADMM Cc1cc(Nc2cc(F)c([O-])c(Cl)c2)cc2snnc21 ZINC001214492011 1056720784 /nfs/dbraw/zinc/72/07/84/1056720784.db2.gz PLFDJHUMNCINOB-UHFFFAOYSA-N -1 1 309.753 4.241 20 0 DIADMM CCn1ncc2cc(Nc3cc(F)c([O-])c(Cl)c3)ccc21 ZINC001214492220 1056726017 /nfs/dbraw/zinc/72/60/17/1056726017.db2.gz UDFHJAXGSGRDGH-UHFFFAOYSA-N -1 1 305.740 4.298 20 0 DIADMM O=C(N[C@H]1C[C@H]1C1CCCCC1)c1cc2ccccc2cc1[O-] ZINC001587112002 1056860349 /nfs/dbraw/zinc/86/03/49/1056860349.db2.gz HFGJIEIEXTWLBL-WMZOPIPTSA-N -1 1 309.409 4.244 20 0 DIADMM COc1ccc2nc(-c3c(F)cc([O-])cc3F)c(C)cc2c1 ZINC001241117413 1056904663 /nfs/dbraw/zinc/90/46/63/1056904663.db2.gz NPDPWAWCBQYHJM-UHFFFAOYSA-N -1 1 301.292 4.203 20 0 DIADMM Cc1cc(-c2c(F)cc([O-])cc2F)nc(-c2cccs2)n1 ZINC001241118934 1056905013 /nfs/dbraw/zinc/90/50/13/1056905013.db2.gz IVBAFLRTXFCUNI-UHFFFAOYSA-N -1 1 304.321 4.164 20 0 DIADMM Cc1sc2nc(C)nc(-c3c(F)cc([O-])cc3F)c2c1C ZINC001241118677 1056905042 /nfs/dbraw/zinc/90/50/42/1056905042.db2.gz UTDGRWNUVDYQMS-UHFFFAOYSA-N -1 1 306.337 4.267 20 0 DIADMM Cc1cc(-c2c(F)cc([O-])cc2F)nc(-c2ccsc2)n1 ZINC001241118297 1056905438 /nfs/dbraw/zinc/90/54/38/1056905438.db2.gz BOVYXHBHXPQRHX-UHFFFAOYSA-N -1 1 304.321 4.164 20 0 DIADMM [O-]c1cc(F)c(-c2cccc(-c3cc[nH]c(=S)n3)c2)c(F)c1 ZINC001241121445 1056906820 /nfs/dbraw/zinc/90/68/20/1056906820.db2.gz KECMEFSNTACBHO-UHFFFAOYSA-N -1 1 316.332 4.083 20 0 DIADMM Cc1nc2sc3c(c2c(-c2c(F)cc([O-])cc2F)n1)CCC3 ZINC001241120418 1056907077 /nfs/dbraw/zinc/90/70/77/1056907077.db2.gz UAGDRLBHPNVXPJ-UHFFFAOYSA-N -1 1 318.348 4.139 20 0 DIADMM [O-]c1cc(F)c(-c2ccc(-c3nc4cc[nH]cc-4n3)cc2)c(F)c1 ZINC001241122675 1056907582 /nfs/dbraw/zinc/90/75/82/1056907582.db2.gz UQYYHROSKNZDAJ-UHFFFAOYSA-N -1 1 323.302 4.276 20 0 DIADMM CC(C)Oc1cc(F)c(F)cc1-c1c(F)cc([O-])cc1F ZINC001241124698 1056910381 /nfs/dbraw/zinc/91/03/81/1056910381.db2.gz JZJKLYXURUWVOQ-UHFFFAOYSA-N -1 1 300.251 4.403 20 0 DIADMM Cc1ccnc(CSc2nc(-c3ccccc3)c(C)c(=O)[n-]2)c1 ZINC000682859266 1056920989 /nfs/dbraw/zinc/92/09/89/1056920989.db2.gz KQUQOFOKCWICDO-UHFFFAOYSA-N -1 1 323.421 4.153 20 0 DIADMM CCOC(=O)c1nc2cc(-c3cc(C)ccc3OCC)ccc2[n-]1 ZINC001241149185 1056927700 /nfs/dbraw/zinc/92/77/00/1056927700.db2.gz TZJBRLHUGPPWSP-UHFFFAOYSA-N -1 1 324.380 4.114 20 0 DIADMM CCOC(=O)c1nc2ccc(-c3cc(C)ccc3OCC)cc2[n-]1 ZINC001241149185 1056927705 /nfs/dbraw/zinc/92/77/05/1056927705.db2.gz TZJBRLHUGPPWSP-UHFFFAOYSA-N -1 1 324.380 4.114 20 0 DIADMM Cc1ccccc1[C@@H](c1noc(-c2ccc(N)cc2[O-])n1)C(C)C ZINC000843233273 1056981510 /nfs/dbraw/zinc/98/15/10/1056981510.db2.gz INHMBGBFLUMBOX-KRWDZBQOSA-N -1 1 323.396 4.121 20 0 DIADMM O=C(c1ccc([O-])cc1F)N1CCC[C@@H]1c1cccc(Cl)c1 ZINC001626073138 1056991476 /nfs/dbraw/zinc/99/14/76/1056991476.db2.gz GCAIWCDMYPWUOW-MRXNPFEDSA-N -1 1 319.763 4.162 20 0 DIADMM CSc1nc2sccc2c(-c2c(F)ccc([O-])c2F)n1 ZINC001241290903 1056999990 /nfs/dbraw/zinc/99/99/90/1056999990.db2.gz QYSPBSHJKOQZBE-UHFFFAOYSA-N -1 1 310.350 4.064 20 0 DIADMM C[C@H]1CN(C(=O)c2cc3ccccc3cc2[O-])Cc2ccccc21 ZINC000922317664 1057006074 /nfs/dbraw/zinc/00/60/74/1057006074.db2.gz ADTSDWYWQRXGPM-AWEZNQCLSA-N -1 1 317.388 4.305 20 0 DIADMM CSc1ccc(Cl)cc1[N-]C(=O)c1cnc(C2CC2)o1 ZINC000888445252 1057032128 /nfs/dbraw/zinc/03/21/28/1057032128.db2.gz GIVFNQXLCKUDBK-UHFFFAOYSA-N -1 1 308.790 4.180 20 0 DIADMM O=C([O-])c1cc(F)cc(-c2ccc3nc(C(F)(F)F)[nH]c3c2)c1 ZINC001241829139 1057179249 /nfs/dbraw/zinc/17/92/49/1057179249.db2.gz VIYHMHSQOXZBGS-UHFFFAOYSA-N -1 1 324.233 4.086 20 0 DIADMM C[C@H](C1CCCCC1)N(C)C(=O)Cc1ccc([O-])c(Cl)c1 ZINC001626097678 1057185721 /nfs/dbraw/zinc/18/57/21/1057185721.db2.gz YVEQYPOKJIVRGD-GFCCVEGCSA-N -1 1 309.837 4.015 20 0 DIADMM [O-]c1ccc(C(F)(F)F)cc1-c1cc(OC(F)F)ccn1 ZINC001242131145 1057274052 /nfs/dbraw/zinc/27/40/52/1057274052.db2.gz DLROHAJDUNKGDH-UHFFFAOYSA-N -1 1 305.202 4.074 20 0 DIADMM Cc1cccc2ncc(-c3cc(C(F)(F)F)ccc3[O-])nc12 ZINC001242131357 1057274069 /nfs/dbraw/zinc/27/40/69/1057274069.db2.gz IJGNUOVJOLAQFK-UHFFFAOYSA-N -1 1 304.271 4.330 20 0 DIADMM [O-]c1ccc(C(F)(F)F)cc1-c1nncc2cc(F)ccc21 ZINC001242132092 1057274505 /nfs/dbraw/zinc/27/45/05/1057274505.db2.gz VEWLXTMYWCGLDG-UHFFFAOYSA-N -1 1 308.234 4.160 20 0 DIADMM CC(C)OCc1ccc(-c2cc(C(F)(F)F)ccc2[O-])nc1 ZINC001242134229 1057274580 /nfs/dbraw/zinc/27/45/80/1057274580.db2.gz ULNBSHHTEIRCMK-UHFFFAOYSA-N -1 1 311.303 4.398 20 0 DIADMM [O-]c1ccc(C(F)(F)F)cc1-c1ncnc2cccc(F)c21 ZINC001242132606 1057274939 /nfs/dbraw/zinc/27/49/39/1057274939.db2.gz VSLZLSTZOAMOCU-UHFFFAOYSA-N -1 1 308.234 4.160 20 0 DIADMM Cc1ccc2nc(-c3cc(C(F)(F)F)ccc3[O-])ccc2n1 ZINC001242132107 1057275038 /nfs/dbraw/zinc/27/50/38/1057275038.db2.gz VQJSUCXRZKAVOJ-UHFFFAOYSA-N -1 1 304.271 4.330 20 0 DIADMM COc1nnc(-c2cc(C(F)(F)F)ccc2[O-])c2ccccc21 ZINC001242131723 1057275049 /nfs/dbraw/zinc/27/50/49/1057275049.db2.gz JRWYYJWDQQJPIK-UHFFFAOYSA-N -1 1 320.270 4.030 20 0 DIADMM Cc1cccc2c1ncnc2-c1cc(C(F)(F)F)ccc1[O-] ZINC001242131794 1057275058 /nfs/dbraw/zinc/27/50/58/1057275058.db2.gz PTLALBVGQHWTJL-UHFFFAOYSA-N -1 1 304.271 4.330 20 0 DIADMM CCOC(=O)c1nc2cc(-c3cccc(Cl)c3)ccc2[n-]1 ZINC001242145655 1057279244 /nfs/dbraw/zinc/27/92/44/1057279244.db2.gz FUMCDVIIEJPZEB-UHFFFAOYSA-N -1 1 300.745 4.060 20 0 DIADMM CCOC(=O)c1nc2ccc(-c3cccc(Cl)c3)cc2[n-]1 ZINC001242145655 1057279251 /nfs/dbraw/zinc/27/92/51/1057279251.db2.gz FUMCDVIIEJPZEB-UHFFFAOYSA-N -1 1 300.745 4.060 20 0 DIADMM [O-]c1ccc(C(F)(F)F)cc1-c1cnc(OCC2CCC2)cn1 ZINC001242145144 1057279376 /nfs/dbraw/zinc/27/93/76/1057279376.db2.gz DQSNXWKVBVHFLG-UHFFFAOYSA-N -1 1 324.302 4.047 20 0 DIADMM [O-]c1ccc(-c2cccc(C(F)(F)F)n2)cc1C(F)(F)F ZINC001242148415 1057279984 /nfs/dbraw/zinc/27/99/84/1057279984.db2.gz XLUAMSDRBSDZLY-UHFFFAOYSA-N -1 1 307.193 4.492 20 0 DIADMM Cc1csc2ncnc(-c3ccc([O-])c(C(F)(F)F)c3)c12 ZINC001242147564 1057280182 /nfs/dbraw/zinc/28/01/82/1057280182.db2.gz AJHIHBGKPCAPSF-UHFFFAOYSA-N -1 1 310.300 4.391 20 0 DIADMM COc1cccc2cnc(-c3ccc([O-])c(C(F)(F)F)c3)nc21 ZINC001242150935 1057280854 /nfs/dbraw/zinc/28/08/54/1057280854.db2.gz AFKVVTHGBCJMCW-UHFFFAOYSA-N -1 1 320.270 4.030 20 0 DIADMM Cc1csc2nc(-c3ccc([O-])c(C(F)(F)F)c3)ncc12 ZINC001242151899 1057280882 /nfs/dbraw/zinc/28/08/82/1057280882.db2.gz YFDYBMRFVSSYBE-UHFFFAOYSA-N -1 1 310.300 4.391 20 0 DIADMM [O-]c1ccc(-c2cnc3ccc(F)cc3n2)cc1C(F)(F)F ZINC001242151650 1057280966 /nfs/dbraw/zinc/28/09/66/1057280966.db2.gz SQRJEECBYUSXLI-UHFFFAOYSA-N -1 1 308.234 4.160 20 0 DIADMM COc1nc2ccccc2nc1-c1ccc([O-])c(C(F)(F)F)c1 ZINC001242151879 1057281084 /nfs/dbraw/zinc/28/10/84/1057281084.db2.gz XHMNNSIZNTVSGJ-UHFFFAOYSA-N -1 1 320.270 4.030 20 0 DIADMM COc1ccc2cnc(-c3ccc([O-])c(C(F)(F)F)c3)nc2c1 ZINC001242151291 1057281094 /nfs/dbraw/zinc/28/10/94/1057281094.db2.gz JGGAXVZRXCQMOO-UHFFFAOYSA-N -1 1 320.270 4.030 20 0 DIADMM [O-]c1ccc(-c2ncnc3cccc(F)c32)cc1C(F)(F)F ZINC001242151390 1057281131 /nfs/dbraw/zinc/28/11/31/1057281131.db2.gz LTCCQFOMHPSEAJ-UHFFFAOYSA-N -1 1 308.234 4.160 20 0 DIADMM [O-]c1ccc(-c2ncc3cc(F)ccc3n2)cc1C(F)(F)F ZINC001242153344 1057281532 /nfs/dbraw/zinc/28/15/32/1057281532.db2.gz VHVJWHGULGQKKP-UHFFFAOYSA-N -1 1 308.234 4.160 20 0 DIADMM [O-]c1ccc(-c2cc(-c3ccco3)ncn2)cc1C(F)(F)F ZINC001242157710 1057283201 /nfs/dbraw/zinc/28/32/01/1057283201.db2.gz LPQFESCICYELIK-UHFFFAOYSA-N -1 1 306.243 4.128 20 0 DIADMM Cc1cc2ccncc2nc1-c1ccc([O-])c(C(F)(F)F)c1 ZINC001242157249 1057283503 /nfs/dbraw/zinc/28/35/03/1057283503.db2.gz FHNPPEMCEJPSBQ-UHFFFAOYSA-N -1 1 304.271 4.330 20 0 DIADMM [O-]c1ccc(-c2nc(C3CC3)nc3[nH]ccc32)cc1C(F)(F)F ZINC001242158334 1057284502 /nfs/dbraw/zinc/28/45/02/1057284502.db2.gz YXOISXOZMRZLEA-UHFFFAOYSA-N -1 1 319.286 4.178 20 0 DIADMM CCOc1cc(Nc2cc(F)c([O-])c(F)c2)c(F)cc1F ZINC001212531865 1057326861 /nfs/dbraw/zinc/32/68/61/1057326861.db2.gz WYCLPKRITJNWMM-UHFFFAOYSA-N -1 1 301.239 4.091 20 0 DIADMM Cc1cccc(-c2nc(C)c(Cc3ccccc3)c(C)n2)c1[O-] ZINC001242344812 1057340217 /nfs/dbraw/zinc/34/02/17/1057340217.db2.gz FDQPRCVLWQLNFY-UHFFFAOYSA-N -1 1 304.393 4.365 20 0 DIADMM Cc1cccc(-c2ncc(F)c(Oc3ccccc3F)n2)c1[O-] ZINC001242345447 1057340636 /nfs/dbraw/zinc/34/06/36/1057340636.db2.gz QQFWCMINNLRXJF-UHFFFAOYSA-N -1 1 314.291 4.228 20 0 DIADMM COC(=O)c1cccc(C(F)(F)F)c1-c1cccc(F)c1[O-] ZINC001242350225 1057342941 /nfs/dbraw/zinc/34/29/41/1057342941.db2.gz DOUCNEZHQADCIM-UHFFFAOYSA-N -1 1 314.234 4.004 20 0 DIADMM COC(=O)c1cc(C(F)(F)F)ccc1-c1cccc(F)c1[O-] ZINC001242352307 1057343020 /nfs/dbraw/zinc/34/30/20/1057343020.db2.gz RBAADPBHNXFPFH-UHFFFAOYSA-N -1 1 314.234 4.004 20 0 DIADMM CCOC(=O)c1cc2ccc(-c3cccc(Cl)c3[O-])cn2c1 ZINC001242364823 1057347259 /nfs/dbraw/zinc/34/72/59/1057347259.db2.gz QSAWLXRHIXVIFO-UHFFFAOYSA-N -1 1 315.756 4.142 20 0 DIADMM O=C1NCCC/C1=C\c1cccc(-c2cccc(Cl)c2[O-])c1 ZINC001242366230 1057347569 /nfs/dbraw/zinc/34/75/69/1057347569.db2.gz SHNAVLZJNGTAKD-SDNWHVSQSA-N -1 1 313.784 4.006 20 0 DIADMM COC(=O)CCCc1ccc(-c2cccc(Cl)c2[O-])cc1 ZINC001242366518 1057348196 /nfs/dbraw/zinc/34/81/96/1057348196.db2.gz YXQNCPJIOAAANU-UHFFFAOYSA-N -1 1 304.773 4.208 20 0 DIADMM COC(=O)c1nc2cccc(-c3cccc(Cl)c3[O-])c2s1 ZINC001242368307 1057348300 /nfs/dbraw/zinc/34/83/00/1057348300.db2.gz YGTOBCWOPKDVEP-UHFFFAOYSA-N -1 1 319.769 4.109 20 0 DIADMM CCOC(=O)c1cc(-c2cccc(Cl)c2[O-])cc2cc[nH]c21 ZINC001242366608 1057348402 /nfs/dbraw/zinc/34/84/02/1057348402.db2.gz BGJNVRCAXJFDRJ-UHFFFAOYSA-N -1 1 315.756 4.371 20 0 DIADMM [O-]c1c(Cl)cccc1-c1ccc(OCC(F)(F)F)nc1 ZINC001242366470 1057348583 /nfs/dbraw/zinc/34/85/83/1057348583.db2.gz YDIJFMKBPNZNIX-UHFFFAOYSA-N -1 1 303.667 4.049 20 0 DIADMM COC(=O)c1ccc(C2CC2)c(-c2cccc(Cl)c2[O-])c1 ZINC001242368256 1057348896 /nfs/dbraw/zinc/34/88/96/1057348896.db2.gz WGRJSKNDZSJUHM-UHFFFAOYSA-N -1 1 302.757 4.377 20 0 DIADMM [O-]c1cccc(-c2ncncc2OCc2ccccc2)c1Cl ZINC001242797478 1057480142 /nfs/dbraw/zinc/48/01/42/1057480142.db2.gz JESMMYMGSINLKN-UHFFFAOYSA-N -1 1 312.756 4.082 20 0 DIADMM [O-]c1cccc(-c2ncnc3[nH]c4cc(F)ccc4c32)c1Cl ZINC001242799672 1057480662 /nfs/dbraw/zinc/48/06/62/1057480662.db2.gz XJOJZBQARPJKNE-UHFFFAOYSA-N -1 1 313.719 4.276 20 0 DIADMM CC(C)(C)NC(=O)c1ccc(-c2cccc([O-])c2Cl)cc1 ZINC001242799712 1057480953 /nfs/dbraw/zinc/48/09/53/1057480953.db2.gz YWXGSNQSJBPPIB-UHFFFAOYSA-N -1 1 303.789 4.241 20 0 DIADMM COC(=O)c1cnc2ccc(-c3cccc([O-])c3Cl)cc2c1 ZINC001242800701 1057481729 /nfs/dbraw/zinc/48/17/29/1057481729.db2.gz LDMBJEIZXZBEDG-UHFFFAOYSA-N -1 1 313.740 4.047 20 0 DIADMM COC(=O)c1cc2c(cncc2-c2cccc([O-])c2Cl)s1 ZINC001242801314 1057481804 /nfs/dbraw/zinc/48/18/04/1057481804.db2.gz XZOQUMPXFDVYNC-UHFFFAOYSA-N -1 1 319.769 4.109 20 0 DIADMM O=C(c1cccc(-c2cccc([O-])c2Cl)c1)N1CCCCC1 ZINC001242800472 1057482023 /nfs/dbraw/zinc/48/20/23/1057482023.db2.gz INZQADVWLMRGPG-UHFFFAOYSA-N -1 1 315.800 4.339 20 0 DIADMM [O-]c1cccc(-c2nccc(Oc3ccc(F)cc3)n2)c1Cl ZINC001242800612 1057482059 /nfs/dbraw/zinc/48/20/59/1057482059.db2.gz IYISYNLKTCVUTC-UHFFFAOYSA-N -1 1 316.719 4.434 20 0 DIADMM [O-]c1cccc(-c2ccc3nc(C(F)(F)F)[nH]c3n2)c1Cl ZINC001242801390 1057482252 /nfs/dbraw/zinc/48/22/52/1057482252.db2.gz PXDJKWCTXMZLGP-UHFFFAOYSA-N -1 1 313.666 4.003 20 0 DIADMM CC(C)(C)C(=O)Nc1cccnc1-c1cccc([O-])c1Cl ZINC001242800793 1057482279 /nfs/dbraw/zinc/48/22/79/1057482279.db2.gz UAXRZMCCHJUUOT-UHFFFAOYSA-N -1 1 304.777 4.092 20 0 DIADMM COCCCOc1cc(-c2cccc([O-])c2Cl)ccc1OC ZINC001242800772 1057482376 /nfs/dbraw/zinc/48/23/76/1057482376.db2.gz ONIZOABYTASCMX-UHFFFAOYSA-N -1 1 322.788 4.137 20 0 DIADMM CCOC(=O)c1c(F)cc(-c2cccc([O-])c2Cl)cc1F ZINC001242803296 1057482916 /nfs/dbraw/zinc/48/29/16/1057482916.db2.gz YPIQDYVTBRFBQV-UHFFFAOYSA-N -1 1 312.699 4.168 20 0 DIADMM [O-]c1cccc(-c2cccc(-c3cc[nH]c(=S)n3)c2)c1Cl ZINC001242802143 1057482978 /nfs/dbraw/zinc/48/29/78/1057482978.db2.gz SOUOSKJAUJPTRR-UHFFFAOYSA-N -1 1 314.797 4.458 20 0 DIADMM COc1ccc(C(F)(F)F)nc1-c1cccc([O-])c1Cl ZINC001242801831 1057483081 /nfs/dbraw/zinc/48/30/81/1057483081.db2.gz YFMGESAMHMDQQK-UHFFFAOYSA-N -1 1 303.667 4.135 20 0 DIADMM [O-]c1cccc(-c2ccc(OCc3ccccn3)nc2)c1Cl ZINC001242802186 1057483087 /nfs/dbraw/zinc/48/30/87/1057483087.db2.gz VGYKWWWQKPUMQW-UHFFFAOYSA-N -1 1 312.756 4.082 20 0 DIADMM COC(=O)c1nc2cccc(-c3cccc([O-])c3Cl)c2s1 ZINC001242802857 1057483383 /nfs/dbraw/zinc/48/33/83/1057483383.db2.gz JURHFOJKEKFNTI-UHFFFAOYSA-N -1 1 319.769 4.109 20 0 DIADMM Cc1cc(-c2ccc(C(=O)[O-])c(C(F)(F)F)c2)cc2nc[nH]c21 ZINC001243156346 1057588764 /nfs/dbraw/zinc/58/87/64/1057588764.db2.gz UJNYEPBDWSFTDD-UHFFFAOYSA-N -1 1 320.270 4.255 20 0 DIADMM Cc1nc2cccc(-c3ccc(C(=O)[O-])c(C(F)(F)F)c3)c2[nH]1 ZINC001243158290 1057589275 /nfs/dbraw/zinc/58/92/75/1057589275.db2.gz ZCYYBTDZHSNFTP-UHFFFAOYSA-N -1 1 320.270 4.255 20 0 DIADMM C[C@H]1CCCCN1c1cccc(-c2ccc([O-])c(F)c2F)n1 ZINC001243338923 1057652432 /nfs/dbraw/zinc/65/24/32/1057652432.db2.gz KTNRORAWERMSNE-NSHDSACASA-N -1 1 304.340 4.111 20 0 DIADMM COc1ccc(-c2ccc([O-])c(F)c2F)c2ccc(C)nc12 ZINC001243342867 1057652721 /nfs/dbraw/zinc/65/27/21/1057652721.db2.gz NITBCANRBCODGL-UHFFFAOYSA-N -1 1 301.292 4.203 20 0 DIADMM [O-]c1ccc(-c2ccc(-c3c[nH]c(=S)[nH]3)cc2)c(F)c1F ZINC001243342781 1057653126 /nfs/dbraw/zinc/65/31/26/1057653126.db2.gz UEKUXUXRVBMSLA-UHFFFAOYSA-N -1 1 304.321 4.016 20 0 DIADMM [O-]c1ccc(-c2ccnc(C3(C(F)(F)F)CC3)c2)c(F)c1F ZINC001243342146 1057653341 /nfs/dbraw/zinc/65/33/41/1057653341.db2.gz AHDNONLEFDLXKX-UHFFFAOYSA-N -1 1 315.241 4.326 20 0 DIADMM [O-]c1ccc(-c2ccc(O[C@H]3CCCCO3)cc2)c(F)c1F ZINC001243343520 1057654142 /nfs/dbraw/zinc/65/41/42/1057654142.db2.gz ZOBUGGUXXSFNLW-HNNXBMFYSA-N -1 1 306.308 4.243 20 0 DIADMM [O-]c1c(F)cc(F)cc1-c1ccc(OCc2ccccc2)nc1 ZINC001243501804 1057697042 /nfs/dbraw/zinc/69/70/42/1057697042.db2.gz CDXLESCOWZPNOJ-UHFFFAOYSA-N -1 1 313.303 4.311 20 0 DIADMM [O-]c1c(F)cc(F)cc1-c1ccc2nc(C(F)(F)F)cn2c1 ZINC001243503319 1057697075 /nfs/dbraw/zinc/69/70/75/1057697075.db2.gz VBBYHCNBNWGVAV-UHFFFAOYSA-N -1 1 314.213 4.004 20 0 DIADMM Cc1ccc2c(F)c(F)cc(-c3cc(F)cc(F)c3[O-])c2n1 ZINC001243503154 1057697340 /nfs/dbraw/zinc/69/73/40/1057697340.db2.gz BQQQAYBGOWWUSS-UHFFFAOYSA-N -1 1 307.246 4.472 20 0 DIADMM [O-]c1c(F)cc(F)cc1-c1ccc2nc3c(cc2c1)CCCO3 ZINC001243506008 1057697935 /nfs/dbraw/zinc/69/79/35/1057697935.db2.gz OEWXZDZKOJTLCS-UHFFFAOYSA-N -1 1 313.303 4.211 20 0 DIADMM COc1c(F)ccc(SC)c1-c1cc(F)cc(F)c1[O-] ZINC001243506678 1057698027 /nfs/dbraw/zinc/69/80/27/1057698027.db2.gz IOBIVOWEZPNKNQ-UHFFFAOYSA-N -1 1 300.301 4.207 20 0 DIADMM COC(=O)c1cccc2cc(-c3cc(F)cc(F)c3[O-])ccc21 ZINC001243507615 1057698673 /nfs/dbraw/zinc/69/86/73/1057698673.db2.gz ZTDDVEOWZHMKRA-UHFFFAOYSA-N -1 1 314.287 4.277 20 0 DIADMM COc1cc2ccnc(-c3ccc(Cl)c([O-])c3)c2cc1OC ZINC001243575982 1057720865 /nfs/dbraw/zinc/72/08/65/1057720865.db2.gz CKHJCRBGUVVVPY-UHFFFAOYSA-N -1 1 315.756 4.278 20 0 DIADMM COc1cc2ccc(-c3ccc(Cl)c([O-])c3)nc2cc1OC ZINC001243576997 1057720900 /nfs/dbraw/zinc/72/09/00/1057720900.db2.gz YSHVSWKWZSTPHJ-UHFFFAOYSA-N -1 1 315.756 4.278 20 0 DIADMM COC(=O)c1ccc2cc(-c3ccc(Cl)c([O-])c3)ncc2c1 ZINC001243578225 1057721433 /nfs/dbraw/zinc/72/14/33/1057721433.db2.gz FEYHDHOEBOVZQN-UHFFFAOYSA-N -1 1 313.740 4.047 20 0 DIADMM [O-]c1cc(-c2ccnc(CCc3ccccc3)n2)ccc1Cl ZINC001243579401 1057722395 /nfs/dbraw/zinc/72/23/95/1057722395.db2.gz SWNYDGCEGAZHLX-UHFFFAOYSA-N -1 1 310.784 4.288 20 0 DIADMM Cc1nc(C)c(-c2ccc(-c3ccc(Cl)c([O-])c3)nn2)s1 ZINC001243579094 1057722535 /nfs/dbraw/zinc/72/25/35/1057722535.db2.gz OJIDPDINFPOVAT-UHFFFAOYSA-N -1 1 317.801 4.243 20 0 DIADMM CC1(C)CC(=O)Nc2ccc(-c3ccc(Cl)c([O-])c3)cc21 ZINC001243578823 1057722570 /nfs/dbraw/zinc/72/25/70/1057722570.db2.gz UDSWUHIZVFRNKL-UHFFFAOYSA-N -1 1 301.773 4.332 20 0 DIADMM COc1ccc(-c2cc(-c3ccc(Cl)c([O-])c3)ncn2)cc1 ZINC001243579607 1057722582 /nfs/dbraw/zinc/72/25/82/1057722582.db2.gz VSXWMRWVLVIOLJ-UHFFFAOYSA-N -1 1 312.756 4.178 20 0 DIADMM [O-]c1cc(-c2nnc3c(c2C(F)(F)F)CCC3)ccc1Cl ZINC001243579730 1057722688 /nfs/dbraw/zinc/72/26/88/1057722688.db2.gz YLBXHFHYISYTEB-UHFFFAOYSA-N -1 1 314.694 4.010 20 0 DIADMM [O-]c1cc(-c2ncc(F)c(-c3ccsc3)n2)ccc1Cl ZINC001243579971 1057722743 /nfs/dbraw/zinc/72/27/43/1057722743.db2.gz YTBQKXVVZVGVBH-UHFFFAOYSA-N -1 1 306.749 4.370 20 0 DIADMM CCOC(=O)c1cc2c(cccc2-c2ccc(Cl)c([O-])c2)[nH]1 ZINC001243581037 1057722977 /nfs/dbraw/zinc/72/29/77/1057722977.db2.gz KADPKGDMLSDAEK-UHFFFAOYSA-N -1 1 315.756 4.371 20 0 DIADMM O=C(Nc1ccccn1)c1ccc(-c2ccc(Cl)c([O-])c2)cc1 ZINC001243581829 1057723394 /nfs/dbraw/zinc/72/33/94/1057723394.db2.gz IZLQZKYYISAYEL-UHFFFAOYSA-N -1 1 324.767 4.360 20 0 DIADMM CC1(C)Cc2ccc(-c3ccc(Cl)c([O-])c3)cc2NC1=O ZINC001243581605 1057723420 /nfs/dbraw/zinc/72/34/20/1057723420.db2.gz KDOCZBYVIYAVDY-UHFFFAOYSA-N -1 1 301.773 4.233 20 0 DIADMM CC(=O)N1CCCc2cc(-c3ccc(Cl)c([O-])c3)ccc21 ZINC001243580382 1057723442 /nfs/dbraw/zinc/72/34/42/1057723442.db2.gz BPAANICUEOUVRI-UHFFFAOYSA-N -1 1 301.773 4.012 20 0 DIADMM O=c1ccc(-c2ccc(Cl)c([O-])c2)cn1-c1cccc(F)c1 ZINC001243582972 1057723763 /nfs/dbraw/zinc/72/37/63/1057723763.db2.gz GHRVZCYTZZXZCA-UHFFFAOYSA-N -1 1 315.731 4.003 20 0 DIADMM CCOC(=O)c1noc2cccc(-c3ccc(Cl)c([O-])c3)c21 ZINC001243582685 1057723857 /nfs/dbraw/zinc/72/38/57/1057723857.db2.gz CQWFJQJDSNOAGR-UHFFFAOYSA-N -1 1 317.728 4.031 20 0 DIADMM COC(=O)c1ccc(-c2ccc(Cl)c([O-])c2)c2cccnc12 ZINC001243582176 1057723874 /nfs/dbraw/zinc/72/38/74/1057723874.db2.gz ZNOUSAPPBMYSDV-UHFFFAOYSA-N -1 1 313.740 4.047 20 0 DIADMM COC(=O)c1cc(-c2ccc(Cl)c([O-])c2)c2cc[nH]c2c1C ZINC001243582425 1057724117 /nfs/dbraw/zinc/72/41/17/1057724117.db2.gz SFYXZGZHWYLAEZ-UHFFFAOYSA-N -1 1 315.756 4.289 20 0 DIADMM COc1ncc(C(F)(F)F)cc1-c1ccc(Cl)c([O-])c1 ZINC001243583463 1057724213 /nfs/dbraw/zinc/72/42/13/1057724213.db2.gz OQATWBJRXXTTOL-UHFFFAOYSA-N -1 1 303.667 4.135 20 0 DIADMM CC(C)C(=O)NCCc1ccc(-c2ccc(Cl)c([O-])c2)cc1 ZINC001243583857 1057724239 /nfs/dbraw/zinc/72/42/39/1057724239.db2.gz MLNIAJMUKWJDLY-UHFFFAOYSA-N -1 1 317.816 4.027 20 0 DIADMM [O-]c1cc(-c2ccc3nnc(-c4ccccc4)n3c2)ccc1Cl ZINC001243584373 1057724742 /nfs/dbraw/zinc/72/47/42/1057724742.db2.gz PKVXZJATLSRYEG-UHFFFAOYSA-N -1 1 321.767 4.422 20 0 DIADMM Cc1cc(-c2ccc(Cl)c([O-])c2)cnc1C(=O)OC(C)(C)C ZINC001243584369 1057724824 /nfs/dbraw/zinc/72/48/24/1057724824.db2.gz PIBWGRXCPNHOSQ-UHFFFAOYSA-N -1 1 319.788 4.371 20 0 DIADMM CC(C)(C)Oc1ccc(-c2ccc(C(F)(F)F)cc2[O-])nn1 ZINC001243609426 1057732501 /nfs/dbraw/zinc/73/25/01/1057732501.db2.gz SLWNMKLWWPUYPB-UHFFFAOYSA-N -1 1 312.291 4.045 20 0 DIADMM CC(C)OCc1ccc(-c2ccc(C(F)(F)F)cc2[O-])nc1 ZINC001243611123 1057733334 /nfs/dbraw/zinc/73/33/34/1057733334.db2.gz ZXMAIPYUXWRHPU-UHFFFAOYSA-N -1 1 311.303 4.398 20 0 DIADMM [O-]c1cc(C(F)(F)F)ccc1-c1ccc(-n2cccc2)cn1 ZINC001243610672 1057733363 /nfs/dbraw/zinc/73/33/63/1057733363.db2.gz NMXZXKZNUNISBQ-UHFFFAOYSA-N -1 1 304.271 4.264 20 0 DIADMM CC(C)COc1ccc(C(=O)Nc2ccc([O-])c(Cl)c2)cc1 ZINC000732308861 1057772505 /nfs/dbraw/zinc/77/25/05/1057772505.db2.gz FPEUXOPEKJMHSF-UHFFFAOYSA-N -1 1 319.788 4.333 20 0 DIADMM COc1cc2ccnc(-c3c([O-])cccc3Cl)c2cc1OC ZINC001244031394 1057843745 /nfs/dbraw/zinc/84/37/45/1057843745.db2.gz UGZZQVPMNDPVBQ-UHFFFAOYSA-N -1 1 315.756 4.278 20 0 DIADMM COC(=O)c1cc(-c2c([O-])cccc2Cl)nc2ccccc21 ZINC001244033651 1057844002 /nfs/dbraw/zinc/84/40/02/1057844002.db2.gz GQEGMEZYOQCGRX-UHFFFAOYSA-N -1 1 313.740 4.047 20 0 DIADMM Cc1cc(N2CCCCC2)ncc1-c1cc(F)c([O-])c(F)c1 ZINC001244094508 1057866836 /nfs/dbraw/zinc/86/68/36/1057866836.db2.gz TYPVQRUEDNASFE-UHFFFAOYSA-N -1 1 304.340 4.031 20 0 DIADMM COC(=O)c1ccc(C(C)C)c(-c2cc(F)c([O-])c(F)c2)c1 ZINC001244096091 1057867334 /nfs/dbraw/zinc/86/73/34/1057867334.db2.gz KGPGQIMMDFOUJW-UHFFFAOYSA-N -1 1 306.308 4.247 20 0 DIADMM COc1cccc2c(-c3cc(F)c([O-])c(F)c3)cc(C)nc12 ZINC001244097426 1057867939 /nfs/dbraw/zinc/86/79/39/1057867939.db2.gz POHZPXWYGRWKJW-UHFFFAOYSA-N -1 1 301.292 4.203 20 0 DIADMM [O-]c1c(F)cc(-c2ccnc(C3(C(F)(F)F)CC3)c2)cc1F ZINC001244097055 1057868039 /nfs/dbraw/zinc/86/80/39/1057868039.db2.gz MIRQUDCUFDIMAH-UHFFFAOYSA-N -1 1 315.241 4.326 20 0 DIADMM CCOC(OCC)c1ccccc1-c1cc(F)c([O-])c(F)c1 ZINC001244098082 1057868778 /nfs/dbraw/zinc/86/87/78/1057868778.db2.gz WYYHPFRRSRJUIN-UHFFFAOYSA-N -1 1 308.324 4.409 20 0 DIADMM CC(C)(C)OC(=O)c1ccc(-c2cc(F)c([O-])c(F)c2)cc1 ZINC001244097570 1057868806 /nfs/dbraw/zinc/86/88/06/1057868806.db2.gz RCQLRRWIAKCPGD-UHFFFAOYSA-N -1 1 306.308 4.293 20 0 DIADMM CCOC(=O)c1ccc(-c2cc(F)c([O-])c(F)c2)c(C)c1C ZINC001244098556 1057868811 /nfs/dbraw/zinc/86/88/11/1057868811.db2.gz KRWJRPYQCZWJCR-UHFFFAOYSA-N -1 1 306.308 4.131 20 0 DIADMM CCOC(=O)c1nc2cc(-c3cc(C(C)C)ccc3N)ccc2[n-]1 ZINC001244230663 1057904425 /nfs/dbraw/zinc/90/44/25/1057904425.db2.gz WGWUHSCOEOTEOM-UHFFFAOYSA-N -1 1 323.396 4.112 20 0 DIADMM CCOC(=O)c1nc2ccc(-c3cc(C(C)C)ccc3N)cc2[n-]1 ZINC001244230663 1057904429 /nfs/dbraw/zinc/90/44/29/1057904429.db2.gz WGWUHSCOEOTEOM-UHFFFAOYSA-N -1 1 323.396 4.112 20 0 DIADMM Cc1ccc([O-])c(-c2nccc(-c3cn(C)c4ccccc34)n2)c1 ZINC001244402082 1057951432 /nfs/dbraw/zinc/95/14/32/1057951432.db2.gz BFEQKILSWYAMJW-UHFFFAOYSA-N -1 1 315.376 4.316 20 0 DIADMM [O-]c1ccc(OC(F)(F)F)cc1-c1cnc(-c2ccco2)cn1 ZINC001244454988 1057962292 /nfs/dbraw/zinc/96/22/92/1057962292.db2.gz DYYAUJNBIROVGP-UHFFFAOYSA-N -1 1 322.242 4.008 20 0 DIADMM Cc1nnc(-c2cc(OC(F)(F)F)ccc2[O-])c2ccccc12 ZINC001244458313 1057963851 /nfs/dbraw/zinc/96/38/51/1057963851.db2.gz GOXHRLZCUPQXNA-UHFFFAOYSA-N -1 1 320.270 4.209 20 0 DIADMM [O-]c1ccc(OC(F)(F)F)cc1-c1ccc(-c2ccco2)nn1 ZINC001244458517 1057963897 /nfs/dbraw/zinc/96/38/97/1057963897.db2.gz QBVNSWAYRDIROF-UHFFFAOYSA-N -1 1 322.242 4.008 20 0 DIADMM Cc1nc2ccccc2nc1-c1ccc(OC(F)(F)F)cc1[O-] ZINC001244463486 1057965552 /nfs/dbraw/zinc/96/55/52/1057965552.db2.gz HXTBHEILFPQFIM-UHFFFAOYSA-N -1 1 320.270 4.209 20 0 DIADMM Cc1cc2nc(-c3ccc(OC(F)(F)F)cc3[O-])ccc2[nH]1 ZINC001244464994 1057965970 /nfs/dbraw/zinc/96/59/70/1057965970.db2.gz SNCCHXBGZHEKOW-UHFFFAOYSA-N -1 1 308.259 4.143 20 0 DIADMM [O-]c1cc(OC(F)(F)F)ccc1-c1ncccc1C(F)(F)F ZINC001244463622 1057966007 /nfs/dbraw/zinc/96/60/07/1057966007.db2.gz JZDQRHPSVPWGIF-UHFFFAOYSA-N -1 1 323.192 4.372 20 0 DIADMM CC(C)Oc1ccnc(-c2ccc(OC(F)(F)F)cc2[O-])c1 ZINC001244464795 1057966224 /nfs/dbraw/zinc/96/62/24/1057966224.db2.gz PIHOBEMVEDXMGF-UHFFFAOYSA-N -1 1 313.275 4.140 20 0 DIADMM CCCCc1cc(-c2ccc(OC(F)(F)F)cc2[O-])ncn1 ZINC001244464729 1057966301 /nfs/dbraw/zinc/96/63/01/1057966301.db2.gz NJMGFISJLXXYTR-UHFFFAOYSA-N -1 1 312.291 4.090 20 0 DIADMM CC(C)(C)c1cc(-c2ccc(OC(F)(F)F)cc2[O-])ncn1 ZINC001244464237 1057966425 /nfs/dbraw/zinc/96/64/25/1057966425.db2.gz YAQSPGUICFZKSS-UHFFFAOYSA-N -1 1 312.291 4.045 20 0 DIADMM CC(C)Oc1cccnc1-c1ccc(OC(F)(F)F)cc1[O-] ZINC001244465415 1057966957 /nfs/dbraw/zinc/96/69/57/1057966957.db2.gz WEQVUFWUOZRQHZ-UHFFFAOYSA-N -1 1 313.275 4.140 20 0 DIADMM Cc1cc(-c2cc(C)c([O-])c(Cl)c2)nc(C(F)(F)F)n1 ZINC001244531326 1057987250 /nfs/dbraw/zinc/98/72/50/1057987250.db2.gz YCNHUZXCCSUURG-UHFFFAOYSA-N -1 1 302.683 4.138 20 0 DIADMM Cc1nc2cc(F)ccc2c(-c2cc(C)c([O-])c(Cl)c2)n1 ZINC001244529936 1057987362 /nfs/dbraw/zinc/98/73/62/1057987362.db2.gz GNNMUOBKVAZYLC-UHFFFAOYSA-N -1 1 302.736 4.412 20 0 DIADMM [O-]c1ccc(Cl)c(-c2ncnc3cc(F)c(F)cc32)c1F ZINC001244537406 1057989368 /nfs/dbraw/zinc/98/93/68/1057989368.db2.gz DQYONIDLXODVKX-UHFFFAOYSA-N -1 1 310.662 4.073 20 0 DIADMM COc1ccc2ccnc(-c3c(Cl)ccc([O-])c3F)c2c1 ZINC001244538822 1057989543 /nfs/dbraw/zinc/98/95/43/1057989543.db2.gz PEXKDCPONSLVNI-UHFFFAOYSA-N -1 1 303.720 4.409 20 0 DIADMM [O-]c1ccc(Cl)c(-c2cc(-c3ccncc3)ccn2)c1F ZINC001244538962 1057989685 /nfs/dbraw/zinc/98/96/85/1057989685.db2.gz SJKZYCOVUZALPC-UHFFFAOYSA-N -1 1 300.720 4.309 20 0 DIADMM Cc1cc(-c2cc(-c3cccnc3)nc(C)n2)cc(Cl)c1[O-] ZINC001244537776 1057989773 /nfs/dbraw/zinc/98/97/73/1057989773.db2.gz GLYYQJBMZGRFRE-UHFFFAOYSA-N -1 1 311.772 4.181 20 0 DIADMM Cc1cc(-c2nc(C(C)C)nc3[nH]ccc32)cc(Cl)c1[O-] ZINC001244539293 1057989851 /nfs/dbraw/zinc/98/98/51/1057989851.db2.gz TZIUEFVGNWXYNK-UHFFFAOYSA-N -1 1 301.777 4.367 20 0 DIADMM [O-]c1ccc(Cl)c(-c2ccnc(-c3ccccc3)n2)c1F ZINC001244538966 1057989932 /nfs/dbraw/zinc/98/99/32/1057989932.db2.gz SOZMIRYYRPGZES-UHFFFAOYSA-N -1 1 300.720 4.309 20 0 DIADMM COc1ccc2nc(-c3c(Cl)ccc([O-])c3F)nc(C)c2c1 ZINC001244539433 1057990462 /nfs/dbraw/zinc/99/04/62/1057990462.db2.gz VIRQJALSBPJEMJ-UHFFFAOYSA-N -1 1 318.735 4.112 20 0 DIADMM Cc1cc(-c2ccc3c(n2)NC(=O)CC3(C)C)cc(Cl)c1[O-] ZINC001244539558 1057990492 /nfs/dbraw/zinc/99/04/92/1057990492.db2.gz WMISSKUSWUVMHW-UHFFFAOYSA-N -1 1 316.788 4.036 20 0 DIADMM COC(=O)c1cc(-c2c(Cl)ccc([O-])c2F)c(C)cc1F ZINC001244540479 1057990503 /nfs/dbraw/zinc/99/05/03/1057990503.db2.gz WKBOCDAOZRUZNQ-UHFFFAOYSA-N -1 1 312.699 4.086 20 0 DIADMM [O-]c1ccc(Cl)c(-c2ncncc2-c2ccccc2)c1F ZINC001244540106 1057990959 /nfs/dbraw/zinc/99/09/59/1057990959.db2.gz HOTQRRWWJSWHMZ-UHFFFAOYSA-N -1 1 300.720 4.309 20 0 DIADMM O=C1CCCc2cc(-c3c(Cl)ccc([O-])c3F)ccc2N1 ZINC001244541398 1057991071 /nfs/dbraw/zinc/99/10/71/1057991071.db2.gz CFNCEHWHYAQXGS-UHFFFAOYSA-N -1 1 305.736 4.127 20 0 DIADMM COC(=O)c1cc(-c2c(Cl)ccc([O-])c2F)cc2[nH]ccc21 ZINC001244541318 1057991153 /nfs/dbraw/zinc/99/11/53/1057991153.db2.gz OAHBPHYMHWBYKA-UHFFFAOYSA-N -1 1 319.719 4.120 20 0 DIADMM COc1ncc(C(F)(F)F)cc1-c1c(Cl)ccc([O-])c1F ZINC001244542714 1057991342 /nfs/dbraw/zinc/99/13/42/1057991342.db2.gz KDYZGDIKHUSKPU-UHFFFAOYSA-N -1 1 321.657 4.274 20 0 DIADMM COc1cnc2cc(-c3c(Cl)ccc([O-])c3F)ccc2c1 ZINC001244541552 1057991484 /nfs/dbraw/zinc/99/14/84/1057991484.db2.gz DUIKZMSRYIAGQE-UHFFFAOYSA-N -1 1 303.720 4.409 20 0 DIADMM COC(=O)c1cc2[nH]ccc2c(-c2c(Cl)ccc([O-])c2F)c1 ZINC001244542412 1057991489 /nfs/dbraw/zinc/99/14/89/1057991489.db2.gz WMGMYQHXCJRMNC-UHFFFAOYSA-N -1 1 319.719 4.120 20 0 DIADMM O=C(c1cccc(-c2c(Cl)ccc([O-])c2F)c1)N1CCCC1 ZINC001244542113 1057991557 /nfs/dbraw/zinc/99/15/57/1057991557.db2.gz IIENHPLUEQZENG-UHFFFAOYSA-N -1 1 319.763 4.088 20 0 DIADMM CC(C)(C)OC(=O)c1ccc(-c2c(Cl)ccc([O-])c2F)cn1 ZINC001244543356 1057991946 /nfs/dbraw/zinc/99/19/46/1057991946.db2.gz TVYVLODJTHUDEN-UHFFFAOYSA-N -1 1 323.751 4.202 20 0 DIADMM CCOC(=O)c1ccc(OC)cc1-c1c(Cl)ccc([O-])c1F ZINC001244543543 1057991978 /nfs/dbraw/zinc/99/19/78/1057991978.db2.gz WCFNVSTUOZVEQU-UHFFFAOYSA-N -1 1 324.735 4.037 20 0 DIADMM [O-]c1ccc(Cl)c(-c2cc(C3OCCO3)ccc2F)c1F ZINC001244543077 1057992255 /nfs/dbraw/zinc/99/22/55/1057992255.db2.gz SMZNHQNEAKCDHP-UHFFFAOYSA-N -1 1 312.699 4.036 20 0 DIADMM COc1cccc2ncc(-c3c(Cl)ccc([O-])c3F)cc21 ZINC001244542979 1057992485 /nfs/dbraw/zinc/99/24/85/1057992485.db2.gz QMLQTAUOMKDWIA-UHFFFAOYSA-N -1 1 303.720 4.409 20 0 DIADMM COC(=O)c1ccc(-c2cc(C)c([O-])c(Cl)c2)c(F)c1F ZINC001244554587 1057994135 /nfs/dbraw/zinc/99/41/35/1057994135.db2.gz KYFIYAHSRNMCQH-UHFFFAOYSA-N -1 1 312.699 4.086 20 0 DIADMM Cc1cc(-c2ccccc2)ccc1-c1ccc([P@@](=O)([O-])O)cc1 ZINC001244838409 1058056910 /nfs/dbraw/zinc/05/69/10/1058056910.db2.gz MFYVEYZYHRYYMR-UHFFFAOYSA-N -1 1 324.316 4.132 20 0 DIADMM Cc1cc(-c2ccccc2)ccc1-c1ccc([P@](=O)([O-])O)cc1 ZINC001244838409 1058056912 /nfs/dbraw/zinc/05/69/12/1058056912.db2.gz MFYVEYZYHRYYMR-UHFFFAOYSA-N -1 1 324.316 4.132 20 0 DIADMM CCOC(=O)c1nc2cc(-c3cccc(Cl)c3C)ccc2[n-]1 ZINC001244966114 1058082638 /nfs/dbraw/zinc/08/26/38/1058082638.db2.gz UPJATAKLVCVTDA-UHFFFAOYSA-N -1 1 314.772 4.368 20 0 DIADMM CCOC(=O)c1nc2ccc(-c3cccc(Cl)c3C)cc2[n-]1 ZINC001244966114 1058082640 /nfs/dbraw/zinc/08/26/40/1058082640.db2.gz UPJATAKLVCVTDA-UHFFFAOYSA-N -1 1 314.772 4.368 20 0 DIADMM COC(=O)c1nc2cc(-c3cccc(C4CCC4)c3)ccc2[n-]1 ZINC001244979708 1058085503 /nfs/dbraw/zinc/08/55/03/1058085503.db2.gz JQFAUDIDJRRDHP-UHFFFAOYSA-N -1 1 306.365 4.284 20 0 DIADMM COC(=O)c1nc2ccc(-c3cccc(C4CCC4)c3)cc2[n-]1 ZINC001244979708 1058085505 /nfs/dbraw/zinc/08/55/05/1058085505.db2.gz JQFAUDIDJRRDHP-UHFFFAOYSA-N -1 1 306.365 4.284 20 0 DIADMM CC(C)c1noc(-c2ccnc(-c3cc(Cl)ccc3[O-])c2)n1 ZINC001245049178 1058102391 /nfs/dbraw/zinc/10/23/91/1058102391.db2.gz HVPUWNPORMDRHW-UHFFFAOYSA-N -1 1 315.760 4.281 20 0 DIADMM Cc1nc2ccc(-c3cc(Cl)ccc3[O-])nc2n1C(C)C ZINC001245049391 1058102848 /nfs/dbraw/zinc/10/28/48/1058102848.db2.gz OQVQLFBKFFBJKE-UHFFFAOYSA-N -1 1 301.777 4.347 20 0 DIADMM COc1cc2cnc(-c3cc(Cl)ccc3[O-])cc2cc1OC ZINC001245050653 1058103515 /nfs/dbraw/zinc/10/35/15/1058103515.db2.gz YIOXEJCKJKRIIT-UHFFFAOYSA-N -1 1 315.756 4.278 20 0 DIADMM Cc1c(C(=O)[O-])cccc1-c1cccc2nc(C(F)(F)F)[nH]c21 ZINC001245304469 1058143517 /nfs/dbraw/zinc/14/35/17/1058143517.db2.gz VDSSLGKRGLOGRQ-UHFFFAOYSA-N -1 1 320.270 4.255 20 0 DIADMM CC(C)C1CCC(NC(=O)c2ccc3ccccc3c2[O-])CC1 ZINC001545488823 1058205983 /nfs/dbraw/zinc/20/59/83/1058205983.db2.gz ZTESGDOAQINXDC-UHFFFAOYSA-N -1 1 311.425 4.490 20 0 DIADMM O=C(Nc1ccc([O-])c(F)c1F)[C@H]1CC[C@@H](c2ccccc2)C1 ZINC001552665799 1058445091 /nfs/dbraw/zinc/44/50/91/1058445091.db2.gz VDEBCXRELCXHCQ-OLZOCXBDSA-N -1 1 317.335 4.193 20 0 DIADMM O=C(Nc1ccc([O-])c(F)c1F)[C@@H]1CC[C@H](c2ccccc2)C1 ZINC001552665800 1058445711 /nfs/dbraw/zinc/44/57/11/1058445711.db2.gz VDEBCXRELCXHCQ-QWHCGFSZSA-N -1 1 317.335 4.193 20 0 DIADMM [O-]c1ccc(F)c(-c2ccnc(-c3ccccc3)n2)c1Cl ZINC001245825457 1058518581 /nfs/dbraw/zinc/51/85/81/1058518581.db2.gz AAYQPKDJYNFMGF-UHFFFAOYSA-N -1 1 300.720 4.309 20 0 DIADMM CC(C)(C)C(=O)Nc1cccc(-c2c(F)ccc([O-])c2Cl)n1 ZINC001245825540 1058519142 /nfs/dbraw/zinc/51/91/42/1058519142.db2.gz CDUCXWLVUNGPGZ-UHFFFAOYSA-N -1 1 322.767 4.231 20 0 DIADMM CC(C)(C)OC(=O)c1cccnc1-c1c(F)ccc([O-])c1Cl ZINC001245828272 1058524309 /nfs/dbraw/zinc/52/43/09/1058524309.db2.gz RKEKLDIOTWLVJN-UHFFFAOYSA-N -1 1 323.751 4.202 20 0 DIADMM COc1cccc2nc(-c3c(F)ccc([O-])c3Cl)ccc21 ZINC001245829728 1058526372 /nfs/dbraw/zinc/52/63/72/1058526372.db2.gz ALKDPHIIYJBBCG-UHFFFAOYSA-N -1 1 303.720 4.409 20 0 DIADMM Cc1cc(-c2c(F)ccc([O-])c2Cl)nc(-c2ccco2)n1 ZINC001245830092 1058527102 /nfs/dbraw/zinc/52/71/02/1058527102.db2.gz INADYNIMVSMXAX-UHFFFAOYSA-N -1 1 304.708 4.210 20 0 DIADMM COC(=O)c1c(C)cc(F)cc1-c1c(F)ccc([O-])c1Cl ZINC001245831083 1058528671 /nfs/dbraw/zinc/52/86/71/1058528671.db2.gz CMRJUVIDSFUTQG-UHFFFAOYSA-N -1 1 312.699 4.086 20 0 DIADMM CCCN(CCC)c1cncc(-c2c(F)ccc([O-])c2Cl)n1 ZINC001245830059 1058529263 /nfs/dbraw/zinc/52/92/63/1058529263.db2.gz GWDFQAZKPLHDKD-UHFFFAOYSA-N -1 1 323.799 4.268 20 0 DIADMM COc1ccc2cc(-c3c(F)ccc([O-])c3Cl)ncc2c1 ZINC001245830032 1058529361 /nfs/dbraw/zinc/52/93/61/1058529361.db2.gz GODJCPYGTYRYGA-UHFFFAOYSA-N -1 1 303.720 4.409 20 0 DIADMM CCc1cc2ncnc(-c3c(F)ccc([O-])c3Cl)c2s1 ZINC001245830062 1058530150 /nfs/dbraw/zinc/53/01/50/1058530150.db2.gz GXHXIHGIIVPEGT-UHFFFAOYSA-N -1 1 308.765 4.419 20 0 DIADMM [O-]c1ccc(F)c(-c2cnc(Oc3ccccc3)nc2)c1Cl ZINC001245832358 1058531318 /nfs/dbraw/zinc/53/13/18/1058531318.db2.gz VQYRGONBLYLCJL-UHFFFAOYSA-N -1 1 316.719 4.434 20 0 DIADMM CC(=O)Nc1cc(F)c(-c2c(F)ccc([O-])c2Cl)cc1C ZINC001245831965 1058531607 /nfs/dbraw/zinc/53/16/07/1058531607.db2.gz GGJJCCRGLTTZDS-UHFFFAOYSA-N -1 1 311.715 4.258 20 0 DIADMM COC(=O)c1cc(F)c(C)c(-c2c(F)ccc([O-])c2Cl)c1 ZINC001245832430 1058532127 /nfs/dbraw/zinc/53/21/27/1058532127.db2.gz WFXDQURBEWKGBS-UHFFFAOYSA-N -1 1 312.699 4.086 20 0 DIADMM Cc1cc(-c2c(F)ccc([O-])c2Cl)cc2c1NC(=O)CC2 ZINC001245831744 1058532474 /nfs/dbraw/zinc/53/24/74/1058532474.db2.gz OPDPZRDCZSROAG-UHFFFAOYSA-N -1 1 305.736 4.045 20 0 DIADMM COC(=O)[C@@H](C)c1ccc(-c2c(F)ccc([O-])c2Cl)cc1 ZINC001245832642 1058533406 /nfs/dbraw/zinc/53/34/06/1058533406.db2.gz RAWNRNHRFGVOBN-VIFPVBQESA-N -1 1 308.736 4.128 20 0 DIADMM CC(=O)Nc1cc(C)c(C)cc1-c1c(F)ccc([O-])c1Cl ZINC001245831765 1058533567 /nfs/dbraw/zinc/53/35/67/1058533567.db2.gz IMNGULLJSHDKAV-UHFFFAOYSA-N -1 1 307.752 4.427 20 0 DIADMM CC(C)C(=O)Nc1cccc(-c2c(F)ccc([O-])c2Cl)c1 ZINC001245831791 1058534841 /nfs/dbraw/zinc/53/48/41/1058534841.db2.gz JAYSWKVXUVAIRY-UHFFFAOYSA-N -1 1 307.752 4.446 20 0 DIADMM [O-]c1ccc(F)c(-c2cccc(Cc3ccncc3)n2)c1Cl ZINC001245832861 1058535579 /nfs/dbraw/zinc/53/55/79/1058535579.db2.gz ONBKOFACJNJCQK-UHFFFAOYSA-N -1 1 314.747 4.233 20 0 DIADMM COc1nccc2cc(-c3c(F)ccc([O-])c3Cl)ccc21 ZINC001245832870 1058536664 /nfs/dbraw/zinc/53/66/64/1058536664.db2.gz ORUVMDPBGANDGE-UHFFFAOYSA-N -1 1 303.720 4.409 20 0 DIADMM CC1(C)CC(=O)Nc2cc(-c3c(F)ccc([O-])c3Cl)ccc21 ZINC001245834381 1058537277 /nfs/dbraw/zinc/53/72/77/1058537277.db2.gz HKAXEEXITISMOE-UHFFFAOYSA-N -1 1 319.763 4.472 20 0 DIADMM O=c1ccc(-c2c(F)ccc([O-])c2Cl)cn1-c1ccccc1 ZINC001245834182 1058538170 /nfs/dbraw/zinc/53/81/70/1058538170.db2.gz DXFZCVNDHVVEHR-UHFFFAOYSA-N -1 1 315.731 4.003 20 0 DIADMM CC1(C)CC(=O)Nc2c(-c3c(F)ccc([O-])c3Cl)cccc21 ZINC001245834672 1058540235 /nfs/dbraw/zinc/54/02/35/1058540235.db2.gz JMJJRJNJLGGZDC-UHFFFAOYSA-N -1 1 319.763 4.472 20 0 DIADMM CCOC(=O)c1c(OC)cccc1-c1c(F)ccc([O-])c1Cl ZINC001245835340 1058540277 /nfs/dbraw/zinc/54/02/77/1058540277.db2.gz PBYKEGXJLHXKFN-UHFFFAOYSA-N -1 1 324.735 4.037 20 0 DIADMM CCOc1cc(F)c(-c2c(F)ccc([O-])c2Cl)cc1OC ZINC001245834401 1058540615 /nfs/dbraw/zinc/54/06/15/1058540615.db2.gz GTTDDLQRYYHTJD-UHFFFAOYSA-N -1 1 314.715 4.398 20 0 DIADMM CCOC(=O)c1ccc(-c2c(F)ccc([O-])c2Cl)cc1OC ZINC001245836645 1058542526 /nfs/dbraw/zinc/54/25/26/1058542526.db2.gz VSUDKRWMGLHHJN-UHFFFAOYSA-N -1 1 324.735 4.037 20 0 DIADMM Cc1oc2ccccc2c1CNC(=O)c1ccc(Cl)cc1[O-] ZINC001556104345 1058544343 /nfs/dbraw/zinc/54/43/43/1058544343.db2.gz PNEUPLKLQSVCPV-UHFFFAOYSA-N -1 1 315.756 4.030 20 0 DIADMM CCc1ccc(C(=O)N2CCC[C@H](C)c3ccccc32)c([O-])c1 ZINC001556131784 1058548576 /nfs/dbraw/zinc/54/85/76/1058548576.db2.gz VZKJWHDKNRVXIA-AWEZNQCLSA-N -1 1 309.409 4.499 20 0 DIADMM Cc1cc2c(cc1C)N(C(=O)c1cc3ccccc3cc1[O-])CC2 ZINC001556550889 1058611108 /nfs/dbraw/zinc/61/11/08/1058611108.db2.gz JEEMWKQBOGKZQX-UHFFFAOYSA-N -1 1 317.388 4.365 20 0 DIADMM O=C(Nc1ccc([O-])c(F)c1F)c1cc2cc(F)ccc2s1 ZINC001556591668 1058616023 /nfs/dbraw/zinc/61/60/23/1058616023.db2.gz GRWIBLZFQJXEOT-UHFFFAOYSA-N -1 1 323.295 4.277 20 0 DIADMM O=c1cc(CCC2CCCC2)[n-]n1-c1ccc2cccnc2c1 ZINC001245937598 1058636461 /nfs/dbraw/zinc/63/64/61/1058636461.db2.gz PCACOYNUOPNKHR-UHFFFAOYSA-N -1 1 307.397 4.249 20 0 DIADMM CC[C@H](C)CO[N-]C(=O)[C@@H](C)c1ccc(Cl)c(Cl)c1 ZINC001556803583 1058641808 /nfs/dbraw/zinc/64/18/08/1058641808.db2.gz FTSCWWAOIFXSKZ-UWVGGRQHSA-N -1 1 304.217 4.191 20 0 DIADMM CC(C)CC1(C)CCN(C(=O)c2ccc(Cl)cc2[O-])CC1 ZINC001556888872 1058663451 /nfs/dbraw/zinc/66/34/51/1058663451.db2.gz NVCVJSWMEIMKIL-UHFFFAOYSA-N -1 1 309.837 4.334 20 0 DIADMM C[C@H]1CCCC[C@]1(C)NC(=O)c1ccc(C(F)(F)F)c([O-])c1 ZINC001556916788 1058666922 /nfs/dbraw/zinc/66/69/22/1058666922.db2.gz WJMYEGHFYBMGFO-BONVTDFDSA-N -1 1 315.335 4.110 20 0 DIADMM CSc1ccccc1[N-]C(=O)c1oc(C2CC2)nc1C(F)F ZINC001520710058 1058669351 /nfs/dbraw/zinc/66/93/51/1058669351.db2.gz QLUAZSNFFUZMQI-UHFFFAOYSA-N -1 1 324.352 4.464 20 0 DIADMM CC(C)[C@@H](C(=O)Nc1cc(F)cc(F)c1[O-])c1ccc(F)cc1 ZINC001557086775 1058698277 /nfs/dbraw/zinc/69/82/77/1058698277.db2.gz FGBWKWPJQSTHSD-OAHLLOKOSA-N -1 1 323.314 4.188 20 0 DIADMM Cc1ccc2c(c1)[C@@H](NC(=O)c1ccc(Cl)cc1[O-])[C@H](C)C2 ZINC001557492717 1058756569 /nfs/dbraw/zinc/75/65/69/1058756569.db2.gz MYUADPLSUOGXMS-DIFFPNOSSA-N -1 1 315.800 4.017 20 0 DIADMM C[C@@]1(C(=O)Nc2cc(Cl)c([O-])c3ccccc23)C=CCC1 ZINC001557589692 1058773295 /nfs/dbraw/zinc/77/32/95/1058773295.db2.gz SILSLCCPEVZMCW-QGZVFWFLSA-N -1 1 301.773 4.494 20 0 DIADMM Cc1ccccc1[C@@H](C)NC(=O)c1ccc2ccc(O)cc2c1[O-] ZINC001557746658 1058789473 /nfs/dbraw/zinc/78/94/73/1058789473.db2.gz FUHNXHMWFODMCE-CYBMUJFWSA-N -1 1 321.376 4.050 20 0 DIADMM CC1(C)CCC(C)(NC(=O)Cc2ccc([O-])c(Cl)c2)CC1 ZINC001557944638 1058814917 /nfs/dbraw/zinc/81/49/17/1058814917.db2.gz GFIJLFDSRYNWCP-UHFFFAOYSA-N -1 1 309.837 4.063 20 0 DIADMM CC[C@H](Sc1ccccc1)C(=O)Nc1cccc(F)c1[O-] ZINC001557958011 1058817174 /nfs/dbraw/zinc/81/71/74/1058817174.db2.gz YQUAPHHYSIBMCC-AWEZNQCLSA-N -1 1 305.374 4.041 20 0 DIADMM O=C(Nc1cccc(F)c1[O-])[C@@H]1CCCC[C@@H]1c1ccccc1 ZINC001557956747 1058817344 /nfs/dbraw/zinc/81/73/44/1058817344.db2.gz OGCLWRBXCKDBAM-HUUCEWRRSA-N -1 1 313.372 4.444 20 0 DIADMM O=C(CCc1ccc2ccccc2c1)Nc1cccc(F)c1[O-] ZINC001557955889 1058818399 /nfs/dbraw/zinc/81/83/99/1058818399.db2.gz GVMIXYSEJUFENH-UHFFFAOYSA-N -1 1 309.340 4.256 20 0 DIADMM C[C@]1(C2CCCCC2)CCN1C(=O)c1c([O-])cccc1Cl ZINC001558069706 1058833356 /nfs/dbraw/zinc/83/33/56/1058833356.db2.gz MEGBKVPYXDAOBV-QGZVFWFLSA-N -1 1 307.821 4.231 20 0 DIADMM CCc1ccc2ccccc2c1CNC(=O)c1cc(F)ccc1[O-] ZINC001558262451 1058856435 /nfs/dbraw/zinc/85/64/35/1058856435.db2.gz MBJWUIZGJPJVLS-UHFFFAOYSA-N -1 1 323.367 4.177 20 0 DIADMM C[C@H]1CCN(C(=O)c2cc(Cl)ccc2[O-])[C@H]1c1ccccc1 ZINC001558302917 1058861402 /nfs/dbraw/zinc/86/14/02/1058861402.db2.gz FAGQFDUAZWCWKD-YVEFUNNKSA-N -1 1 315.800 4.269 20 0 DIADMM C[C@@H](C(=O)Nc1cc(F)c([O-])cc1Cl)[C@H](C)C(C)(C)C ZINC001558644259 1058895015 /nfs/dbraw/zinc/89/50/15/1058895015.db2.gz BZFZIEULZCPYFN-BDAKNGLRSA-N -1 1 301.789 4.442 20 0 DIADMM C/C(=C/C(=O)Nc1cc(F)c([O-])cc1Cl)c1cccc(F)c1 ZINC001558644098 1058895637 /nfs/dbraw/zinc/89/56/37/1058895637.db2.gz UXUGNVNWPMSLNX-UITAMQMPSA-N -1 1 323.726 4.366 20 0 DIADMM C/C(=C/C(=O)Nc1cc(F)c([O-])cc1Cl)c1ccccc1 ZINC001558643865 1058896007 /nfs/dbraw/zinc/89/60/07/1058896007.db2.gz KRJDONOYWCCBJW-YFHOEESVSA-N -1 1 305.736 4.227 20 0 DIADMM CC(C)c1cncc(NC(=O)c2cc3ccccc3cc2[O-])c1 ZINC001558647354 1058896235 /nfs/dbraw/zinc/89/62/35/1058896235.db2.gz CZOHKYVBOUUWDL-UHFFFAOYSA-N -1 1 306.365 4.316 20 0 DIADMM C[C@@H](C(=O)Nc1cc(F)c([O-])cc1Cl)[C@@H](C)C(C)(C)C ZINC001558644262 1058896625 /nfs/dbraw/zinc/89/66/25/1058896625.db2.gz BZFZIEULZCPYFN-RKDXNWHRSA-N -1 1 301.789 4.442 20 0 DIADMM O=C(c1ccc(F)c([O-])c1)N1CCCCC12CCCCCC2 ZINC001558818630 1058916115 /nfs/dbraw/zinc/91/61/15/1058916115.db2.gz JQSSFLONIPOPAI-UHFFFAOYSA-N -1 1 305.393 4.250 20 0 DIADMM CC(C)Cc1ccc(CCC(=O)Nc2ccc(F)cc2[O-])cc1 ZINC001558956078 1058927401 /nfs/dbraw/zinc/92/74/01/1058927401.db2.gz XIICLICFWSUCKX-UHFFFAOYSA-N -1 1 315.388 4.301 20 0 DIADMM O=C(C[C@H]1CCC[C@@H](C(F)(F)F)C1)Nc1ccc(F)cc1[O-] ZINC001558955792 1058927562 /nfs/dbraw/zinc/92/75/62/1058927562.db2.gz JPXDHQPJHNMJPG-VHSXEESVSA-N -1 1 319.298 4.229 20 0 DIADMM O=C(Nc1ccc(F)cc1[O-])c1cc2c(ccnc2Cl)s1 ZINC001558955927 1058928794 /nfs/dbraw/zinc/92/87/94/1058928794.db2.gz PPTPTLGDUJIFBD-UHFFFAOYSA-N -1 1 322.748 4.047 20 0 DIADMM CCCc1cc(=O)[n-]c(SC[C@H](C)c2ccc(OC)cc2)n1 ZINC001559324377 1059162694 /nfs/dbraw/zinc/16/26/94/1059162694.db2.gz OFHPKBPDVIKYEU-LBPRGKRZSA-N -1 1 318.442 4.039 20 0 DIADMM CCc1ccc(NC(=S)Nc2cc([O-])c(F)cc2F)cc1 ZINC001247331825 1059380875 /nfs/dbraw/zinc/38/08/75/1059380875.db2.gz ANOIOUZETQAYQV-UHFFFAOYSA-N -1 1 308.353 4.042 20 0 DIADMM CCc1ccc(NC(=S)Nc2cc(F)c(F)cc2[O-])cc1 ZINC001247339231 1059385807 /nfs/dbraw/zinc/38/58/07/1059385807.db2.gz OZQZXWLUNRAWTB-UHFFFAOYSA-N -1 1 308.353 4.042 20 0 DIADMM CCc1cccc(-c2noc(Cc3ccc([O-])c(Cl)c3)n2)c1 ZINC001247587201 1059564857 /nfs/dbraw/zinc/56/48/57/1059564857.db2.gz IDGBUHFLZJSPSX-UHFFFAOYSA-N -1 1 314.772 4.249 20 0 DIADMM Cc1cc(C)c(NC(=S)Nc2ccc(F)cc2[O-])c(C)c1 ZINC001249733314 1060379482 /nfs/dbraw/zinc/37/94/82/1060379482.db2.gz QQZIIBXKAQVQDW-UHFFFAOYSA-N -1 1 304.390 4.265 20 0 DIADMM CCCCC1CCN(Cc2ccc(F)c(C(=O)[O-])c2F)CC1 ZINC001249763973 1060390428 /nfs/dbraw/zinc/39/04/28/1060390428.db2.gz MVLSYYFYUHUVAC-UHFFFAOYSA-N -1 1 311.372 4.065 20 0 DIADMM CC[C@@H](c1ccccc1)N(C)Cc1ccc(F)c(C(=O)[O-])c1F ZINC001249777799 1060395778 /nfs/dbraw/zinc/39/57/78/1060395778.db2.gz ZBBXXVYPVRCQDK-HNNXBMFYSA-N -1 1 319.351 4.246 20 0 DIADMM [O-]c1cc(Nc2ccnc(Cl)c2Cl)c(F)c(F)c1F ZINC001249957365 1060500064 /nfs/dbraw/zinc/50/00/64/1060500064.db2.gz FAHNWPAWSHYXCD-UHFFFAOYSA-N -1 1 309.074 4.255 20 0 DIADMM [O-]c1cc(Nc2cnc3cccc(F)c3c2)c(F)c(F)c1F ZINC001249961152 1060503819 /nfs/dbraw/zinc/50/38/19/1060503819.db2.gz IOTAQTJNFCXXGU-UHFFFAOYSA-N -1 1 308.234 4.240 20 0 DIADMM CC(C)c1c(Cl)ncnc1Nc1cc([O-])c(F)c(F)c1F ZINC001249961183 1060504571 /nfs/dbraw/zinc/50/45/71/1060504571.db2.gz JTWFUTDWZVVCIC-UHFFFAOYSA-N -1 1 317.698 4.120 20 0 DIADMM Cc1cc(Nc2cc([O-])c(F)c(F)c2F)cnc1OC(C)C ZINC001249961439 1060505101 /nfs/dbraw/zinc/50/51/01/1060505101.db2.gz PXXYOGKUOSFZMV-UHFFFAOYSA-N -1 1 312.291 4.044 20 0 DIADMM [O-]c1cc(Nc2cc(-c3ccc(F)cc3)no2)c(F)c(F)c1F ZINC001249958591 1060506331 /nfs/dbraw/zinc/50/63/31/1060506331.db2.gz ORFYQBZODSJWMY-UHFFFAOYSA-N -1 1 324.233 4.347 20 0 DIADMM COc1ccc(F)c(Nc2cc([O-])c(F)c(F)c2F)c1Cl ZINC001249964986 1060506827 /nfs/dbraw/zinc/50/68/27/1060506827.db2.gz QMYNAYZYKCUASN-UHFFFAOYSA-N -1 1 321.657 4.354 20 0 DIADMM COc1ccc(Nc2cc([O-])c(F)c(F)c2F)c(Cl)c1 ZINC001249965030 1060507184 /nfs/dbraw/zinc/50/71/84/1060507184.db2.gz RPUOKBQRJRKMOI-UHFFFAOYSA-N -1 1 303.667 4.215 20 0 DIADMM [O-]c1cc(Nc2cc(O)c(Cl)cc2F)c(F)c(F)c1F ZINC001249963305 1060507421 /nfs/dbraw/zinc/50/74/21/1060507421.db2.gz LIZATIOAPILEHQ-UHFFFAOYSA-N -1 1 307.630 4.051 20 0 DIADMM COc1cc(Cl)ccc1Nc1cc([O-])c(F)c(F)c1F ZINC001249964008 1060508200 /nfs/dbraw/zinc/50/82/00/1060508200.db2.gz VTFTZOLPQIDWHL-UHFFFAOYSA-N -1 1 303.667 4.215 20 0 DIADMM [O-]c1cc(Nc2cccc(-c3cnco3)c2)c(F)c(F)c1F ZINC001249962173 1060508406 /nfs/dbraw/zinc/50/84/06/1060508406.db2.gz BQAQQTYBGJCIPK-UHFFFAOYSA-N -1 1 306.243 4.208 20 0 DIADMM [O-]c1cc(Nc2ccccc2-c2cnco2)c(F)c(F)c1F ZINC001249965121 1060510556 /nfs/dbraw/zinc/51/05/56/1060510556.db2.gz WJSKZCBEHAEDLI-UHFFFAOYSA-N -1 1 306.243 4.208 20 0 DIADMM CC(C)Oc1cccc(CN(C)Cc2cccc([O-])c2Cl)c1 ZINC001560676132 1060512495 /nfs/dbraw/zinc/51/24/95/1060512495.db2.gz SOBSZCXUHOVFJR-UHFFFAOYSA-N -1 1 319.832 4.465 20 0 DIADMM Nc1cccc(C(F)(F)F)c1Nc1cc([O-])c(F)c(F)c1F ZINC001249965805 1060513404 /nfs/dbraw/zinc/51/34/04/1060513404.db2.gz MNLNWCMHNPYUSW-UHFFFAOYSA-N -1 1 322.208 4.154 20 0 DIADMM Cc1c(C)c(Nc2cc([O-])c(F)c(F)c2F)c(C)c(C)c1N ZINC001249965892 1060514378 /nfs/dbraw/zinc/51/43/78/1060514378.db2.gz QTEVOZFUTSUIFR-UHFFFAOYSA-N -1 1 310.319 4.369 20 0 DIADMM Cc1cc2c(ncnc2Nc2cc(Cl)c([O-])cc2F)s1 ZINC001250018006 1060542089 /nfs/dbraw/zinc/54/20/89/1060542089.db2.gz LEVBPXWEJWDKIS-UHFFFAOYSA-N -1 1 309.753 4.241 20 0 DIADMM [O-]c1cc(F)c(Nc2nc(-c3ccncc3)cs2)cc1Cl ZINC001250019142 1060544311 /nfs/dbraw/zinc/54/43/11/1060544311.db2.gz YUBSNRRRTHOLDE-UHFFFAOYSA-N -1 1 321.764 4.447 20 0 DIADMM [O-]c1cc(F)c(Nc2cccnc2OC(F)(F)F)cc1Cl ZINC001250023551 1060546102 /nfs/dbraw/zinc/54/61/02/1060546102.db2.gz OOUSVNHGFGXKJD-UHFFFAOYSA-N -1 1 322.645 4.222 20 0 DIADMM [O-]c1cc(F)c(Nc2ccc(Cn3ccnc3)cc2)cc1Cl ZINC001250022864 1060546259 /nfs/dbraw/zinc/54/62/59/1060546259.db2.gz XABOTUXOFSGYTJ-UHFFFAOYSA-N -1 1 317.751 4.173 20 0 DIADMM [O-]c1cc(F)c(Nc2ccnn2-c2ccccc2F)cc1Cl ZINC001250023460 1060548165 /nfs/dbraw/zinc/54/81/65/1060548165.db2.gz KDTZOOSDQUBLMS-UHFFFAOYSA-N -1 1 321.714 4.253 20 0 DIADMM CC(C)c1nnc2ccc(Nc3cc(Cl)c([O-])cc3F)cn21 ZINC001250023479 1060548346 /nfs/dbraw/zinc/54/83/46/1060548346.db2.gz KWRNOVYTWPMMLU-UHFFFAOYSA-N -1 1 320.755 4.094 20 0 DIADMM COc1cc(C(C)=O)ccc1Nc1cc(Cl)c([O-])cc1F ZINC001250023834 1060552203 /nfs/dbraw/zinc/55/22/03/1060552203.db2.gz CXXSVYHHRMELDX-UHFFFAOYSA-N -1 1 309.724 4.140 20 0 DIADMM COc1ccc2ccc(Nc3cc(Cl)c([O-])cc3F)cc2n1 ZINC001250025594 1060552516 /nfs/dbraw/zinc/55/25/16/1060552516.db2.gz HIVDMVKWDINIHO-UHFFFAOYSA-N -1 1 318.735 4.485 20 0 DIADMM O=c1ccc2cc(Nc3cc(Cl)c([O-])cc3F)ccc2o1 ZINC001250026648 1060554513 /nfs/dbraw/zinc/55/45/13/1060554513.db2.gz RGELBIIKVAMTGY-UHFFFAOYSA-N -1 1 305.692 4.035 20 0 DIADMM COc1c(Cl)ccc(F)c1Nc1cc([O-])c(F)c(F)c1 ZINC001250106615 1060614681 /nfs/dbraw/zinc/61/46/81/1060614681.db2.gz YCEVZBLSQYSMMU-UHFFFAOYSA-N -1 1 303.667 4.215 20 0 DIADMM O=c1oc2cc([O-])ccc2cc1Nc1ccc(Cl)c(F)c1F ZINC001250112943 1060617997 /nfs/dbraw/zinc/61/79/97/1060617997.db2.gz WPFCAJKQSBBZRW-UHFFFAOYSA-N -1 1 323.682 4.174 20 0 DIADMM COc1c(F)c(Cl)ccc1Nc1cc(F)c([O-])c(F)c1 ZINC001250194190 1060672898 /nfs/dbraw/zinc/67/28/98/1060672898.db2.gz GMHSZNXEOORLEL-UHFFFAOYSA-N -1 1 303.667 4.215 20 0 DIADMM [O-]c1ccc(F)c(Nc2cccnc2Br)c1Cl ZINC001250227889 1060705159 /nfs/dbraw/zinc/70/51/59/1060705159.db2.gz BCNNHYDQZWFWEV-UHFFFAOYSA-N -1 1 317.545 4.086 20 0 DIADMM [O-]c1ccc(Cc2ccc(F)cc2C(F)(F)F)c(F)c1F ZINC001250215587 1060695940 /nfs/dbraw/zinc/69/59/40/1060695940.db2.gz JPFRDSDNHFNKNK-UHFFFAOYSA-N -1 1 306.205 4.419 20 0 DIADMM [O-]c1c(F)cc(Cc2ccc(F)cc2C(F)(F)F)cc1F ZINC001250216161 1060696703 /nfs/dbraw/zinc/69/67/03/1060696703.db2.gz RGGZVYDCAWSNIY-UHFFFAOYSA-N -1 1 306.205 4.419 20 0 DIADMM Cc1nc2sccc2c(Nc2c(F)ccc([O-])c2Cl)n1 ZINC001250228106 1060704707 /nfs/dbraw/zinc/70/47/07/1060704707.db2.gz LPUKOPLPPPEETH-UHFFFAOYSA-N -1 1 309.753 4.241 20 0 DIADMM [O-]c1ccc(F)c(Nc2cnn(Cc3ccccc3)c2)c1Cl ZINC001250228173 1060705463 /nfs/dbraw/zinc/70/54/63/1060705463.db2.gz OQTIKUKHYZQRER-UHFFFAOYSA-N -1 1 317.751 4.173 20 0 DIADMM [O-]c1ccc(F)c(Nc2ccnn2-c2ccccc2)c1Cl ZINC001250228658 1060707503 /nfs/dbraw/zinc/70/75/03/1060707503.db2.gz JFAGBAVGOQPORN-UHFFFAOYSA-N -1 1 303.724 4.114 20 0 DIADMM [O-]c1ccc(F)c(Nc2cc(-c3ccccc3O)no2)c1Cl ZINC001250229199 1060707874 /nfs/dbraw/zinc/70/78/74/1060707874.db2.gz CWRGJSSOIAUYKH-UHFFFAOYSA-N -1 1 320.707 4.289 20 0 DIADMM [O-]c1ccc(F)c(Nc2cc(-c3cccnc3)ccn2)c1Cl ZINC001250228363 1060708148 /nfs/dbraw/zinc/70/81/48/1060708148.db2.gz YSKJALBBPMZWOC-UHFFFAOYSA-N -1 1 315.735 4.385 20 0 DIADMM CCOC(=O)c1ccsc1Nc1c(F)ccc([O-])c1Cl ZINC001250228333 1060708396 /nfs/dbraw/zinc/70/83/96/1060708396.db2.gz XGVSVTFEVAAMQY-UHFFFAOYSA-N -1 1 315.753 4.167 20 0 DIADMM COc1cc(F)c(Nc2c(F)ccc([O-])c2Cl)c(F)c1 ZINC001250233834 1060714150 /nfs/dbraw/zinc/71/41/50/1060714150.db2.gz WUBXOMHXUHAHGJ-UHFFFAOYSA-N -1 1 303.667 4.215 20 0 DIADMM COc1ccc(F)c(Nc2cc([O-])c(F)c(F)c2)c1Cl ZINC001250308502 1060774326 /nfs/dbraw/zinc/77/43/26/1060774326.db2.gz HBBKRMVMFYOILB-UHFFFAOYSA-N -1 1 303.667 4.215 20 0 DIADMM Fc1c2nc(-c3nc4ccccc4s3)[n-]c2c(F)c(F)c1F ZINC001250634486 1060968245 /nfs/dbraw/zinc/96/82/45/1060968245.db2.gz RHUZHGUFQRZQTO-UHFFFAOYSA-N -1 1 323.274 4.396 20 0 DIADMM O=c1[nH]c2ccccc2cc1-c1nc2cc(Cl)cc(F)c2[n-]1 ZINC001250645413 1060985858 /nfs/dbraw/zinc/98/58/58/1060985858.db2.gz OJXICZBYRSEVAL-UHFFFAOYSA-N -1 1 313.719 4.276 20 0 DIADMM O=c1[nH]c2ccccc2cc1-c1nc2c(cc(Cl)cc2F)[n-]1 ZINC001250645413 1060985874 /nfs/dbraw/zinc/98/58/74/1060985874.db2.gz OJXICZBYRSEVAL-UHFFFAOYSA-N -1 1 313.719 4.276 20 0 DIADMM CC(C)(C)n1c2cc(F)ccc2nc1-c1cccc(F)c1[O-] ZINC001250684096 1061014015 /nfs/dbraw/zinc/01/40/15/1061014015.db2.gz ZNDDRRNDDDDJON-UHFFFAOYSA-N -1 1 302.324 4.442 20 0 DIADMM CCn1c2ccc3ncccc3c2nc1-c1cccc(F)c1[O-] ZINC001250683511 1061015730 /nfs/dbraw/zinc/01/57/30/1061015730.db2.gz JAUIVWUDYOEQLQ-UHFFFAOYSA-N -1 1 307.328 4.116 20 0 DIADMM Cc1ccc2[nH]c(-c3cccc([O-])c3Br)nc2c1C ZINC001250880037 1061107690 /nfs/dbraw/zinc/10/76/90/1061107690.db2.gz DOVNXSAHEXPGLH-UHFFFAOYSA-N -1 1 317.186 4.315 20 0 DIADMM [O-]c1ccc(-c2nc3ccc(F)c(F)c3n2C2CC2)c(F)c1F ZINC001250915182 1061124833 /nfs/dbraw/zinc/12/48/33/1061124833.db2.gz RCCLPJARAKXEBA-UHFFFAOYSA-N -1 1 322.261 4.300 20 0 DIADMM Cc1cc(F)cc2[nH]c(-c3ccc(Cl)cc3C(=O)[O-])nc21 ZINC001250968978 1061153252 /nfs/dbraw/zinc/15/32/52/1061153252.db2.gz UTBALCPIYZUPJX-UHFFFAOYSA-N -1 1 304.708 4.029 20 0 DIADMM [O-]c1cc(-c2nc3c([nH]2)c(F)c(F)c(F)c3F)ccc1Cl ZINC001251036558 1061193917 /nfs/dbraw/zinc/19/39/17/1061193917.db2.gz FRFHIBXKCDEZRC-UHFFFAOYSA-N -1 1 316.641 4.145 20 0 DIADMM C[C@@]1(C2CCCCC2)CCN1C(=O)c1cc(Cl)ccc1[O-] ZINC001455118569 1061209030 /nfs/dbraw/zinc/20/90/30/1061209030.db2.gz UVYIOQNRGFMJSM-KRWDZBQOSA-N -1 1 307.821 4.231 20 0 DIADMM Cc1ccccc1-c1cccc([N-]S(=O)(=O)c2ccccc2)c1 ZINC001251146366 1061250078 /nfs/dbraw/zinc/25/00/78/1061250078.db2.gz UYFHHRWDYKSRSX-UHFFFAOYSA-N -1 1 323.417 4.463 20 0 DIADMM [O-]c1cccc(-c2nc3c([nH]2)c(F)c(F)c(F)c3F)c1Cl ZINC001251204197 1061267973 /nfs/dbraw/zinc/26/79/73/1061267973.db2.gz ZSPGZHFJEXMESZ-UHFFFAOYSA-N -1 1 316.641 4.145 20 0 DIADMM COc1cc(Cl)cc2[nH]c(-c3cccc([O-])c3Cl)nc21 ZINC001251203821 1061269372 /nfs/dbraw/zinc/26/93/72/1061269372.db2.gz QRGAVVBQGWRQCA-UHFFFAOYSA-N -1 1 309.152 4.251 20 0 DIADMM COc1ccc2nc(-c3cccc([O-])c3Cl)n(C3CC3)c2c1 ZINC001251203222 1061270057 /nfs/dbraw/zinc/27/00/57/1061270057.db2.gz FQEMWKWNUIDVPB-UHFFFAOYSA-N -1 1 314.772 4.406 20 0 DIADMM [O-]c1cnc(Cl)cc1-c1nc2cc(C(F)(F)F)ccc2[nH]1 ZINC001251252358 1061292673 /nfs/dbraw/zinc/29/26/73/1061292673.db2.gz ULHDXYOABCSMLF-UHFFFAOYSA-N -1 1 313.666 4.003 20 0 DIADMM [O-]c1cnc(Cl)cc1-c1nc2ccc(C(F)(F)F)cc2[nH]1 ZINC001251252358 1061292707 /nfs/dbraw/zinc/29/27/07/1061292707.db2.gz ULHDXYOABCSMLF-UHFFFAOYSA-N -1 1 313.666 4.003 20 0 DIADMM CCCOc1ccc2nc(-c3c([O-])ccc(F)c3F)n(C)c2c1 ZINC001251322428 1061312589 /nfs/dbraw/zinc/31/25/89/1061312589.db2.gz STVUUEMHMJBCGV-UHFFFAOYSA-N -1 1 318.323 4.013 20 0 DIADMM [O-]c1c(-c2nc3cc(F)c(F)cc3[nH]2)cccc1C(F)(F)F ZINC001251341242 1061323702 /nfs/dbraw/zinc/32/37/02/1061323702.db2.gz UKUMKBRJQDICNV-UHFFFAOYSA-N -1 1 314.213 4.233 20 0 DIADMM COc1cc2nc(-c3cccc(C(F)(F)F)c3[O-])[nH]c2cc1C ZINC001251341204 1061325054 /nfs/dbraw/zinc/32/50/54/1061325054.db2.gz RFMFRFVGUJJVID-UHFFFAOYSA-N -1 1 322.286 4.271 20 0 DIADMM CC(=O)c1ccc2[nH]c(-c3cccc(C(F)(F)F)c3[O-])nc2c1 ZINC001251341214 1061325984 /nfs/dbraw/zinc/32/59/84/1061325984.db2.gz SBWFQTQDTHXZFS-UHFFFAOYSA-N -1 1 320.270 4.157 20 0 DIADMM Cc1ccc2nc(-c3cc(F)cc(Br)c3[O-])[nH]c2c1 ZINC001251406843 1061343925 /nfs/dbraw/zinc/34/39/25/1061343925.db2.gz SNKYFEVJNQFYHB-UHFFFAOYSA-N -1 1 321.149 4.146 20 0 DIADMM CC(=O)c1ccc2[nH]c(-c3cc(Cl)c(Cl)cc3[O-])nc2c1 ZINC001251491239 1061376801 /nfs/dbraw/zinc/37/68/01/1061376801.db2.gz JPHLUHHFBISZNX-UHFFFAOYSA-N -1 1 321.163 4.445 20 0 DIADMM COc1cc([O-])c(-c2nc3c(cccc3Cl)[nH]2)c(Cl)c1 ZINC001251491039 1061378171 /nfs/dbraw/zinc/37/81/71/1061378171.db2.gz FQJJDKBKKWRGJM-UHFFFAOYSA-N -1 1 309.152 4.251 20 0 DIADMM Cc1cc2nc(-c3cc(Cl)nc(Cl)c3[O-])[nH]c2cc1F ZINC001251613523 1061419858 /nfs/dbraw/zinc/41/98/58/1061419858.db2.gz JFAKRRJPHARFPI-UHFFFAOYSA-N -1 1 312.131 4.085 20 0 DIADMM Cn1c(-c2cc(F)c(Cl)cc2[O-])nc2cccc(Cl)c21 ZINC001251681322 1061439931 /nfs/dbraw/zinc/43/99/31/1061439931.db2.gz SZMQHSQYFOEPGA-UHFFFAOYSA-N -1 1 311.143 4.392 20 0 DIADMM CC(C)Cc1ccccc1[N-]S(=O)(=O)c1ccc(Cl)cc1 ZINC001251738423 1061464124 /nfs/dbraw/zinc/46/41/24/1061464124.db2.gz LHMUCDWHMAZKLJ-UHFFFAOYSA-N -1 1 323.845 4.339 20 0 DIADMM O=C(CCCCCc1cccs1)Nc1nc(Cl)ccc1[O-] ZINC001457764007 1061496557 /nfs/dbraw/zinc/49/65/57/1061496557.db2.gz PZWQTCAQIGYHFO-UHFFFAOYSA-N -1 1 324.833 4.244 20 0 DIADMM CCOc1ccc(-c2nnc(-c3ccc([O-])cc3Cl)o2)cc1 ZINC001252050909 1061563528 /nfs/dbraw/zinc/56/35/28/1061563528.db2.gz YFKUKUKMPRAMGT-UHFFFAOYSA-N -1 1 316.744 4.161 20 0 DIADMM CC(C)c1ccc2c(c1)CCCN2C(=O)c1ccc(F)c([O-])c1 ZINC001464286402 1061569341 /nfs/dbraw/zinc/56/93/41/1061569341.db2.gz YZAYBANYKJGARW-UHFFFAOYSA-N -1 1 313.372 4.248 20 0 DIADMM O=C(c1ccc([O-])cc1F)N1CCC[C@@H]1CC1CCCCC1 ZINC001464558293 1061604044 /nfs/dbraw/zinc/60/40/44/1061604044.db2.gz IAULNWAYTULRNV-CQSZACIVSA-N -1 1 305.393 4.106 20 0 DIADMM O=C(N[C@H](c1ccccc1)C1CCCC1)c1cc(F)ccc1[O-] ZINC001464598473 1061610793 /nfs/dbraw/zinc/61/07/93/1061610793.db2.gz IBDXVDBMXLZEPC-GOSISDBHSA-N -1 1 313.372 4.193 20 0 DIADMM CC(C)CCc1ccc(NC(=O)c2cccc([O-])c2F)cc1 ZINC001464591992 1061610991 /nfs/dbraw/zinc/61/09/91/1061610991.db2.gz YUFZRMQRBXHOLW-UHFFFAOYSA-N -1 1 301.361 4.372 20 0 DIADMM O=C(N[C@@H](CC1CCCCC1)c1ccccc1)c1ccc([O-])cn1 ZINC001464685300 1061623499 /nfs/dbraw/zinc/62/34/99/1061623499.db2.gz GWDLDMORJWPHNJ-IBGZPJMESA-N -1 1 324.424 4.229 20 0 DIADMM O=C(N[C@H](CC1CCCCC1)c1ccccc1)c1ccc([O-])cn1 ZINC001464685309 1061623663 /nfs/dbraw/zinc/62/36/63/1061623663.db2.gz GWDLDMORJWPHNJ-LJQANCHMSA-N -1 1 324.424 4.229 20 0 DIADMM CCCCN(C)c1ccc(NC(=O)c2cc(F)ccc2[O-])cc1 ZINC001464957718 1061657258 /nfs/dbraw/zinc/65/72/58/1061657258.db2.gz NWNOUQDDDFCJJA-UHFFFAOYSA-N -1 1 316.376 4.020 20 0 DIADMM CCSc1ccc([C@H](C)NC(=O)c2cc(F)ccc2[O-])cc1 ZINC001464996312 1061663246 /nfs/dbraw/zinc/66/32/46/1061663246.db2.gz KJUWDGRGCBCCAJ-NSHDSACASA-N -1 1 319.401 4.134 20 0 DIADMM O=C(Nc1nc(/C=C/c2ccccc2)cs1)c1ccccc1[O-] ZINC001465081697 1061675727 /nfs/dbraw/zinc/67/57/27/1061675727.db2.gz OOFVWTTWWDJFJF-ZHACJKMWSA-N -1 1 322.389 4.271 20 0 DIADMM [O-]c1ccc(-c2nnc(-c3ccc(Cl)cc3)o2)c(Cl)c1 ZINC001252715653 1061701955 /nfs/dbraw/zinc/70/19/55/1061701955.db2.gz PTEUZLGOVDZZDO-UHFFFAOYSA-N -1 1 307.136 4.416 20 0 DIADMM C[C@H](CCC(C)(C)C)NC(=O)c1ccc2ccc(O)cc2c1[O-] ZINC001465257698 1061720990 /nfs/dbraw/zinc/72/09/90/1061720990.db2.gz NBLPGCLOLPZKKL-GFCCVEGCSA-N -1 1 315.413 4.196 20 0 DIADMM CCCc1nsc([N-]c2cnn([C@@H](C)c3ccccc3)c2)n1 ZINC001458452210 1061771017 /nfs/dbraw/zinc/77/10/17/1061771017.db2.gz LLAVRWFWCNTSQG-LBPRGKRZSA-N -1 1 313.430 4.040 20 0 DIADMM O=C(Nc1ccc([O-])c(Cl)c1)c1[nH]ccc1-c1ccccc1 ZINC001466225683 1061900716 /nfs/dbraw/zinc/90/07/16/1061900716.db2.gz OZWUUBZVISJTTN-UHFFFAOYSA-N -1 1 312.756 4.293 20 0 DIADMM CCCCCC[C@@H](O)CCC(=O)Nc1ccc([O-])c(Cl)c1 ZINC001466225459 1061901473 /nfs/dbraw/zinc/90/14/73/1061901473.db2.gz FAAHAAIXDFMHQP-CYBMUJFWSA-N -1 1 313.825 4.096 20 0 DIADMM CCCCCC(CCCCC)NC(=O)c1ncc(C)cc1[O-] ZINC001466403899 1061932975 /nfs/dbraw/zinc/93/29/75/1061932975.db2.gz HVQHSNNIOYZCIU-UHFFFAOYSA-N -1 1 306.450 4.355 20 0 DIADMM CC(C)(C)C[C@H](NC(=O)c1ccc(Cl)cc1[O-])C(F)(F)F ZINC001466490535 1061950337 /nfs/dbraw/zinc/95/03/37/1061950337.db2.gz XGTOWGCGJCFKSN-NSHDSACASA-N -1 1 323.742 4.143 20 0 DIADMM COc1cc(-c2nnc(-c3cccc(C)c3)o2)cc(Cl)c1[O-] ZINC001253710548 1061956273 /nfs/dbraw/zinc/95/62/73/1061956273.db2.gz IOKDIFAMVGAZEG-UHFFFAOYSA-N -1 1 316.744 4.080 20 0 DIADMM CC(C)(C)[C@H]1CCC[C@H](NC(=O)c2ccc(F)c([O-])c2)CC1 ZINC001466943530 1062030964 /nfs/dbraw/zinc/03/09/64/1062030964.db2.gz GJAYNONVKZEZSG-KBPBESRZSA-N -1 1 307.409 4.256 20 0 DIADMM CC(C)Oc1ccc(NC(=O)c2cccc([O-])c2F)c(Cl)c1 ZINC001466959389 1062035131 /nfs/dbraw/zinc/03/51/31/1062035131.db2.gz GXSUHZDUQODPSJ-UHFFFAOYSA-N -1 1 323.751 4.224 20 0 DIADMM Cc1nc(SCc2cc(F)ccc2Cl)[n-]c(=O)c1C1CC1 ZINC001459209164 1062043205 /nfs/dbraw/zinc/04/32/05/1062043205.db2.gz AAXXFYLDCTUCNR-UHFFFAOYSA-N -1 1 324.808 4.453 20 0 DIADMM [O-]c1ccc(-c2nnc([C@H]3C[C@@H]3c3ccccc3)o2)c(Cl)c1 ZINC001254511617 1062152852 /nfs/dbraw/zinc/15/28/52/1062152852.db2.gz CZOKPPOJSJVDNU-KGLIPLIRSA-N -1 1 312.756 4.367 20 0 DIADMM Cc1ccccc1S(=O)(=O)[N-]c1cccc2sccc21 ZINC001254611352 1062199580 /nfs/dbraw/zinc/19/95/80/1062199580.db2.gz MOEVCNYGGFLQPU-UHFFFAOYSA-N -1 1 303.408 4.011 20 0 DIADMM Cn1cc(NCc2ccc([O-])c(F)c2F)c(C2CCCCC2)n1 ZINC001474537385 1062226677 /nfs/dbraw/zinc/22/66/77/1062226677.db2.gz KWYKWRZWWGRSLN-UHFFFAOYSA-N -1 1 321.371 4.064 20 0 DIADMM CC[C@H](C)Oc1cccc(NCc2ccc([O-])c(F)c2F)c1 ZINC001474546607 1062241783 /nfs/dbraw/zinc/24/17/83/1062241783.db2.gz MYXABIBPKBAZQE-NSHDSACASA-N -1 1 307.340 4.460 20 0 DIADMM Cc1ccc(C)c(S(=O)(=O)[N-]c2ccccc2C(F)F)c1 ZINC001254771832 1062248521 /nfs/dbraw/zinc/24/85/21/1062248521.db2.gz FOLCIHDIDHMVRB-UHFFFAOYSA-N -1 1 311.353 4.042 20 0 DIADMM CCc1ccc(Cl)cc1[N-]S(=O)(=O)c1cc(C)ccc1C ZINC001254794624 1062251778 /nfs/dbraw/zinc/25/17/78/1062251778.db2.gz YHRZTXZUQOMQJH-UHFFFAOYSA-N -1 1 323.845 4.320 20 0 DIADMM CCC1CCC(CNC(=O)NCc2ccc([O-])c(Cl)c2)CC1 ZINC001468299439 1062295924 /nfs/dbraw/zinc/29/59/24/1062295924.db2.gz SFDDEQFQNKAMEV-UHFFFAOYSA-N -1 1 324.852 4.061 20 0 DIADMM O=C(Nc1c(O)cccc1Cl)c1ccc2ccccc2c1[O-] ZINC001468455055 1062328994 /nfs/dbraw/zinc/32/89/94/1062328994.db2.gz HXYODGVRHVTJSZ-UHFFFAOYSA-N -1 1 313.740 4.157 20 0 DIADMM CCCCN(C(=O)c1cc(F)ccc1[O-])[C@H]1CCC[C@@H](C)C1 ZINC001468507149 1062339166 /nfs/dbraw/zinc/33/91/66/1062339166.db2.gz YPDORWVJMVIGRO-HIFRSBDPSA-N -1 1 307.409 4.352 20 0 DIADMM O=C(NCc1ccc2sccc2c1)c1c([O-])cccc1Cl ZINC001468684897 1062380654 /nfs/dbraw/zinc/38/06/54/1062380654.db2.gz OLASLNSYMIGHKS-UHFFFAOYSA-N -1 1 317.797 4.190 20 0 DIADMM CC(C)[C@@H](Cc1ccccc1)C(=O)Nc1cc([O-])c(F)cc1F ZINC001468748587 1062392241 /nfs/dbraw/zinc/39/22/41/1062392241.db2.gz YVAIOXGEFGTAFI-CYBMUJFWSA-N -1 1 319.351 4.124 20 0 DIADMM Cc1cc(Cl)ccc1-c1nnc(-c2ccc([O-])c(F)c2)o1 ZINC001255346777 1062411616 /nfs/dbraw/zinc/41/16/16/1062411616.db2.gz NKPHNRUDOGKRLS-UHFFFAOYSA-N -1 1 304.708 4.210 20 0 DIADMM Cc1ccc(CCCCC(=O)Nc2cc(F)cc(F)c2[O-])cc1 ZINC001469163299 1062492299 /nfs/dbraw/zinc/49/22/99/1062492299.db2.gz XIUBDXYAIIQVPE-UHFFFAOYSA-N -1 1 319.351 4.330 20 0 DIADMM Cc1cc2ccccc2cc1[N-]S(=O)(=O)c1cccc(F)c1 ZINC001255654224 1062499201 /nfs/dbraw/zinc/49/92/01/1062499201.db2.gz LXGZWJAGGCBVLK-UHFFFAOYSA-N -1 1 315.369 4.088 20 0 DIADMM O=C(c1ccc2ccccc2c1[O-])N1CC[C@H](C2CCCC2)C1 ZINC001469194553 1062500446 /nfs/dbraw/zinc/50/04/46/1062500446.db2.gz DEJGBKSNASPSIS-INIZCTEOSA-N -1 1 309.409 4.198 20 0 DIADMM O=C(c1cc2ccccc2cc1[O-])N1CC[C@H]1c1ccc(F)cc1 ZINC001469935859 1062663143 /nfs/dbraw/zinc/66/31/43/1062663143.db2.gz IJKQAUSPKORIQF-SFHVURJKSA-N -1 1 321.351 4.272 20 0 DIADMM Cc1ccccc1C(F)(F)c1nc(-c2ccc([O-])c(F)c2)no1 ZINC001255959716 1062669915 /nfs/dbraw/zinc/66/99/15/1062669915.db2.gz AUOXQLMFODTLBV-UHFFFAOYSA-N -1 1 320.270 4.030 20 0 DIADMM [O-]c1ccc(F)cc1-c1nnc(-c2ccc3ccccc3c2)o1 ZINC001256048697 1062688341 /nfs/dbraw/zinc/68/83/41/1062688341.db2.gz OITFHFISLAZHSW-UHFFFAOYSA-N -1 1 306.296 4.402 20 0 DIADMM CCCOc1ccc(-c2nnc(-c3ccc([O-])c(F)c3)o2)cc1 ZINC001256301515 1062766947 /nfs/dbraw/zinc/76/69/47/1062766947.db2.gz DYLUYTKDTJPCGM-UHFFFAOYSA-N -1 1 314.316 4.037 20 0 DIADMM CCCOc1ccc(NC(=O)c2c(F)ccc([O-])c2F)cc1C ZINC001470742519 1062848960 /nfs/dbraw/zinc/84/89/60/1062848960.db2.gz RYJQJVUIAZHGMS-UHFFFAOYSA-N -1 1 321.323 4.020 20 0 DIADMM Cc1ccc(-c2nnc(-c3ccc([O-])cc3Cl)o2)cc1C ZINC001256532175 1062853742 /nfs/dbraw/zinc/85/37/42/1062853742.db2.gz ZZTMPVBCAUGCFW-UHFFFAOYSA-N -1 1 300.745 4.379 20 0 DIADMM Cc1ccc2sc(NC(=O)c3cccc([O-])c3F)nc2c1C ZINC001471143793 1062927724 /nfs/dbraw/zinc/92/77/24/1062927724.db2.gz RPIANUUDWGDEDK-UHFFFAOYSA-N -1 1 316.357 4.010 20 0 DIADMM O=C(Nc1cccc(F)c1[O-])c1ccc(Oc2ccccc2)o1 ZINC001471166237 1062930539 /nfs/dbraw/zinc/93/05/39/1062930539.db2.gz FKWHRCGLMAFAML-UHFFFAOYSA-N -1 1 313.284 4.169 20 0 DIADMM Cc1ccc2[nH]c(C(=O)Nc3cccc(F)c3[O-])c(Cl)c2c1 ZINC001471166242 1062931392 /nfs/dbraw/zinc/93/13/92/1062931392.db2.gz FSAQIKOKORPSCX-UHFFFAOYSA-N -1 1 318.735 4.227 20 0 DIADMM O=C(Nc1cccc(F)c1[O-])[C@H]1C[C@@H]1c1ccc2ccccc2c1 ZINC001471166845 1062932720 /nfs/dbraw/zinc/93/27/20/1062932720.db2.gz SOYRPXBIJPPVSQ-CVEARBPZSA-N -1 1 321.351 4.427 20 0 DIADMM C[C@@H]1CCC[C@H](C2CN(C(=O)c3cc4ccccc4cc3[O-])C2)C1 ZINC001471317632 1062963944 /nfs/dbraw/zinc/96/39/44/1062963944.db2.gz SRFDYCWBQNSAAD-CABCVRRESA-N -1 1 323.436 4.444 20 0 DIADMM [O-]c1cnc(Cl)c(-c2nnc(CCC3CCCCC3)o2)c1 ZINC001256842052 1063012224 /nfs/dbraw/zinc/01/22/24/1063012224.db2.gz MCIFPWNZACWWJA-UHFFFAOYSA-N -1 1 307.781 4.004 20 0 DIADMM O=C([N-]Oc1ccccc1F)C1CCC(c2ccccc2)CC1 ZINC001471718397 1063015435 /nfs/dbraw/zinc/01/54/35/1063015435.db2.gz JYOCZZBDIBPTSX-UHFFFAOYSA-N -1 1 313.372 4.210 20 0 DIADMM CC[C@@H]1CCCc2sc(NC(=O)c3ccc([O-])cc3F)nc21 ZINC001472220035 1063061507 /nfs/dbraw/zinc/06/15/07/1063061507.db2.gz LGGUBEYYRSZBIF-SECBINFHSA-N -1 1 320.389 4.070 20 0 DIADMM COc1ccc(-c2nnc([C@@H]3C[C@@H]3c3ccc(C)cc3)o2)c([O-])c1 ZINC001257211037 1063142509 /nfs/dbraw/zinc/14/25/09/1063142509.db2.gz ZEEPCBYSCYOVAP-HZPDHXFCSA-N -1 1 322.364 4.030 20 0 DIADMM Cc1ccc([C@@H]2C[C@@H]2c2nnc(-c3cccc([O-])c3F)o2)cc1 ZINC001257325487 1063209395 /nfs/dbraw/zinc/20/93/95/1063209395.db2.gz RUNIHZZJPSLKOE-KBPBESRZSA-N -1 1 310.328 4.161 20 0 DIADMM Cc1ccc([C@H]2C[C@H]2c2nnc(-c3cc([O-])cc(F)c3)o2)cc1 ZINC001257325932 1063210956 /nfs/dbraw/zinc/21/09/56/1063210956.db2.gz VGPGMOQIPLYQMD-HZPDHXFCSA-N -1 1 310.328 4.161 20 0 DIADMM CCc1cc(=O)[n-]c(SCc2c(Cl)oc3ccccc32)n1 ZINC001473019318 1063359422 /nfs/dbraw/zinc/35/94/22/1063359422.db2.gz PXQVEAPSTZSQRA-UHFFFAOYSA-N -1 1 320.801 4.437 20 0 DIADMM CC(C)C[C@H]1CCCN(C(=O)NCc2ccc([O-])c(Cl)c2)C1 ZINC001479210983 1063400776 /nfs/dbraw/zinc/40/07/76/1063400776.db2.gz BMNBNXACYMTCBS-CQSZACIVSA-N -1 1 324.852 4.013 20 0 DIADMM CC(C)(C)CC(C)(C)NC(=O)NCc1ccc([O-])c(Cl)c1 ZINC001479211721 1063401290 /nfs/dbraw/zinc/40/12/90/1063401290.db2.gz PRHKSBSJEQZXJE-UHFFFAOYSA-N -1 1 312.841 4.060 20 0 DIADMM Cc1ccc(F)cc1S(=O)(=O)[N-]c1ccc2sccc2c1 ZINC001258926706 1063881113 /nfs/dbraw/zinc/88/11/13/1063881113.db2.gz KIXNHPVVVIYNEZ-UHFFFAOYSA-N -1 1 321.398 4.150 20 0 DIADMM CC[C@@H](C)c1ccccc1[N-]S(=O)(=O)c1cccc(OC)c1 ZINC001259182947 1063884745 /nfs/dbraw/zinc/88/47/45/1063884745.db2.gz XULBYDQLFUUUDD-CYBMUJFWSA-N -1 1 319.426 4.010 20 0 DIADMM CC[C@H](C)c1ccc([N-]S(=O)(=O)c2cccc(OC)c2)cc1 ZINC001259182925 1063884935 /nfs/dbraw/zinc/88/49/35/1063884935.db2.gz VHRKLVIATIWMLX-ZDUSSCGKSA-N -1 1 319.426 4.010 20 0 DIADMM O=C(Nc1cc(F)cc(F)c1[O-])c1cccc(-c2ccoc2)c1 ZINC001299580760 1063888209 /nfs/dbraw/zinc/88/82/09/1063888209.db2.gz JDUASPNPHWSDJB-UHFFFAOYSA-N -1 1 315.275 4.183 20 0 DIADMM Cc1cc2cc([N-]S(=O)(=O)c3cc(C)cc(C)c3)ccc2o1 ZINC001259524444 1063888867 /nfs/dbraw/zinc/88/88/67/1063888867.db2.gz RQXFPHPPJKAFEK-UHFFFAOYSA-N -1 1 315.394 4.159 20 0 DIADMM CCc1ccc(Cl)cc1[N-]S(=O)(=O)c1cc(C)cc(C)c1 ZINC001259524721 1063889685 /nfs/dbraw/zinc/88/96/85/1063889685.db2.gz GSPFKSUZTYCRMI-UHFFFAOYSA-N -1 1 323.845 4.320 20 0 DIADMM O=S(=O)([N-]c1cc(-c2ccccc2)cs1)C1CCCC1 ZINC001259793856 1063893968 /nfs/dbraw/zinc/89/39/68/1063893968.db2.gz JHTBHZPAPWTMOJ-UHFFFAOYSA-N -1 1 307.440 4.099 20 0 DIADMM Cc1cc(S(=O)(=O)[N-]c2ccc3sccc3c2)ccc1F ZINC001260760483 1063906672 /nfs/dbraw/zinc/90/66/72/1063906672.db2.gz MBMQCYZOUZHCHZ-UHFFFAOYSA-N -1 1 321.398 4.150 20 0 DIADMM Cc1cccc(S(=O)(=O)[N-]c2ccccc2C(F)F)c1C ZINC001260998672 1063908848 /nfs/dbraw/zinc/90/88/48/1063908848.db2.gz PGDOTBYALWLVLT-UHFFFAOYSA-N -1 1 311.353 4.042 20 0 DIADMM Cc1cccc(S(=O)(=O)[N-]c2cc(Cl)ccc2C)c1C ZINC001260997621 1063909155 /nfs/dbraw/zinc/90/91/55/1063909155.db2.gz CRXQPGXGRASBIL-UHFFFAOYSA-N -1 1 309.818 4.066 20 0 DIADMM O=C(NC[C@H]1CCCCC1(F)F)c1ccc2ccccc2c1[O-] ZINC000391042517 1064179043 /nfs/dbraw/zinc/17/90/43/1064179043.db2.gz RDTUBKNCDRBLER-CYBMUJFWSA-N -1 1 319.351 4.101 20 0 DIADMM CC(C)(C)[C@@H]1CCC[C@]([N-]C(=O)C(F)F)(C(F)(F)F)CC1 ZINC001288625779 1064559434 /nfs/dbraw/zinc/55/94/34/1064559434.db2.gz RZACKGNRFBCKEG-NOZJJQNGSA-N -1 1 315.326 4.295 20 0 DIADMM CC(C)(C)[C@@H]1CCC[C@@]([N-]C(=O)C(F)F)(C(F)(F)F)CC1 ZINC001288625781 1064559765 /nfs/dbraw/zinc/55/97/65/1064559765.db2.gz RZACKGNRFBCKEG-RNCFNFMXSA-N -1 1 315.326 4.295 20 0 DIADMM O=C(Nc1cccc(Cl)c1)c1ccc(C(F)(F)F)cc1[O-] ZINC001290162478 1064683752 /nfs/dbraw/zinc/68/37/52/1064683752.db2.gz WMTCFQLNLWWSBC-UHFFFAOYSA-N -1 1 315.678 4.317 20 0 DIADMM CCc1nc2cc(NC(=O)c3ccc(C(C)C)cc3[O-])ccc2o1 ZINC001291758142 1064743338 /nfs/dbraw/zinc/74/33/38/1064743338.db2.gz GHEDWVAOFBOQRH-UHFFFAOYSA-N -1 1 324.380 4.472 20 0 DIADMM Cc1cccc(C(C)(C)CNC(=O)c2ccc(Cl)cc2[O-])c1 ZINC001292334925 1064766771 /nfs/dbraw/zinc/76/67/71/1064766771.db2.gz INYHEIHOUHIHAH-UHFFFAOYSA-N -1 1 317.816 4.062 20 0 DIADMM O=C(N[C@@H](c1ccccc1)C1CCCC1)c1cccc([O-])c1F ZINC001292390384 1064770730 /nfs/dbraw/zinc/77/07/30/1064770730.db2.gz WKBTYWLZVSQKNX-SFHVURJKSA-N -1 1 313.372 4.193 20 0 DIADMM C[C@H](NC(=O)c1c([O-])cccc1Cl)C(C)(C)c1ccccc1 ZINC001292725178 1064785245 /nfs/dbraw/zinc/78/52/45/1064785245.db2.gz RJHXNYAQPGKDJF-LBPRGKRZSA-N -1 1 317.816 4.142 20 0 DIADMM C[C@@H]1CC(C)(C)CC[C@@H]1NC(=O)c1ccc2ccccc2c1[O-] ZINC001294395434 1064865515 /nfs/dbraw/zinc/86/55/15/1064865515.db2.gz GURIFXJZVQALJG-DYVFJYSZSA-N -1 1 311.425 4.490 20 0 DIADMM CC(C)CC1CCN(C(=O)c2ccc3ccccc3c2[O-])CC1 ZINC001294505969 1064870448 /nfs/dbraw/zinc/87/04/48/1064870448.db2.gz OGMZEKISHYFQHB-UHFFFAOYSA-N -1 1 311.425 4.444 20 0 DIADMM CC(C)CC[C@H]1CCCCN1C(=O)Cc1ccc([O-])c(Cl)c1 ZINC001295003731 1064893443 /nfs/dbraw/zinc/89/34/43/1064893443.db2.gz FRCCNZGNZZJWCP-OAHLLOKOSA-N -1 1 323.864 4.405 20 0 DIADMM CCCC[C@H](NC(=O)Cc1ccc([O-])c(Cl)c1)C1CCC1 ZINC001295062166 1064898020 /nfs/dbraw/zinc/89/80/20/1064898020.db2.gz YYCBQYRKVYMHLV-HNNXBMFYSA-N -1 1 309.837 4.063 20 0 DIADMM CCC(=O)c1cccc(NC(=O)c2ccc3ccccc3c2[O-])c1 ZINC001295227628 1064904813 /nfs/dbraw/zinc/90/48/13/1064904813.db2.gz AMMDEOVSXSOLIY-UHFFFAOYSA-N -1 1 319.360 4.390 20 0 DIADMM O=C(Nc1cccc2cc[nH]c21)c1ccc(C(F)(F)F)c([O-])c1 ZINC001296784631 1064961623 /nfs/dbraw/zinc/96/16/23/1064961623.db2.gz YFCXQBCIMLVNHS-UHFFFAOYSA-N -1 1 320.270 4.145 20 0 DIADMM C/C(=C/c1ccccc1Cl)C(=O)Nc1cc([O-])c(F)cc1F ZINC001298975661 1065026866 /nfs/dbraw/zinc/02/68/66/1065026866.db2.gz YOQSFYYFHJXKKD-TWGQIWQCSA-N -1 1 323.726 4.366 20 0 DIADMM CC[C@@H](CC(=O)Nc1cc([O-])c(F)cc1F)c1ccccc1 ZINC001298975759 1065027268 /nfs/dbraw/zinc/02/72/68/1065027268.db2.gz ZXZCIJNYYGSWBS-NSHDSACASA-N -1 1 305.324 4.193 20 0 DIADMM Cc1cccc(C2(NC(=O)c3ccc(Cl)cc3[O-])CCC2)c1 ZINC001299864537 1065038415 /nfs/dbraw/zinc/03/84/15/1065038415.db2.gz ZBMBPIUOPSKWOR-UHFFFAOYSA-N -1 1 315.800 4.163 20 0 DIADMM O=C(Nc1cccc(C2CCCCC2)c1)C(=O)c1ccc([O-])cc1 ZINC001301498346 1065068400 /nfs/dbraw/zinc/06/84/00/1065068400.db2.gz PFDJRBGLROZCIX-UHFFFAOYSA-N -1 1 323.392 4.261 20 0 DIADMM Cc1ccc(N(CC2CC2)C(=O)c2cc(F)ccc2[O-])cc1F ZINC001302034053 1065077273 /nfs/dbraw/zinc/07/72/73/1065077273.db2.gz CYYFLUAUTBOJGY-UHFFFAOYSA-N -1 1 317.335 4.036 20 0 DIADMM CC(C)CCOc1ccc(C(=O)Nc2cccc(F)c2[O-])cc1 ZINC001302481649 1065088431 /nfs/dbraw/zinc/08/84/31/1065088431.db2.gz AZRMOHPJNPEDJY-UHFFFAOYSA-N -1 1 317.360 4.209 20 0 DIADMM O=C(Nc1cccc(F)c1[O-])c1ccc(Cl)c2occc21 ZINC001302484465 1065090772 /nfs/dbraw/zinc/09/07/72/1065090772.db2.gz CXOKTHXSTVQJOG-UHFFFAOYSA-N -1 1 305.692 4.183 20 0 DIADMM Cc1cc(F)ccc1[C@@H](C)NC(=O)c1cc2ccccc2cc1[O-] ZINC001303404883 1065116661 /nfs/dbraw/zinc/11/66/61/1065116661.db2.gz WBENNDRZQIHBEH-CYBMUJFWSA-N -1 1 323.367 4.484 20 0 DIADMM CC(C)c1ccc(C(=O)Nc2ccc3c(c2)C[C@@H](C)O3)c([O-])c1 ZINC001304220393 1065132897 /nfs/dbraw/zinc/13/28/97/1065132897.db2.gz SXCVSWBISVVBGV-GFCCVEGCSA-N -1 1 311.381 4.091 20 0 DIADMM Cc1csc2nc(C)nc(NCc3ccc([O-])c(Cl)c3)c12 ZINC001307200195 1065299551 /nfs/dbraw/zinc/29/95/51/1065299551.db2.gz AGURLRGWDWXOMQ-UHFFFAOYSA-N -1 1 319.817 4.279 20 0 DIADMM Cc1nc(S[C@H]2CCCCc3ccccc32)[n-]c(=O)c1C ZINC001307323003 1065340916 /nfs/dbraw/zinc/34/09/16/1065340916.db2.gz JLNWXRZGYQQBPA-HNNXBMFYSA-N -1 1 300.427 4.359 20 0 DIADMM CCc1nc(SCc2c(C)cc(C)cc2C)[n-]c(=O)c1C ZINC001307354462 1065353304 /nfs/dbraw/zinc/35/33/04/1065353304.db2.gz MEHFNXPCFAQBOZ-UHFFFAOYSA-N -1 1 302.443 4.271 20 0 DIADMM C[C@@H]1C[C@@H](c2cccc(F)c2)N(Cc2ccc([O-])c(F)c2F)C1 ZINC001308574426 1066086907 /nfs/dbraw/zinc/08/69/07/1066086907.db2.gz VSZLETLKCNGSAN-ABAIWWIYSA-N -1 1 321.342 4.393 20 0 DIADMM C[C@@H]1C[C@H](c2ccccc2F)N(Cc2ccc([O-])c(F)c2F)C1 ZINC001308573636 1066088125 /nfs/dbraw/zinc/08/81/25/1066088125.db2.gz PUKYYWPIJGGMNN-IAQYHMDHSA-N -1 1 321.342 4.393 20 0 DIADMM CC[C@H]1CN(Cc2cccc([O-])c2Cl)c2ccccc2O1 ZINC001308703402 1066188892 /nfs/dbraw/zinc/18/88/92/1066188892.db2.gz ATTFPNRFARNOQO-ZDUSSCGKSA-N -1 1 303.789 4.223 20 0 DIADMM CCCC[C@@H]1CCC[C@@H]1[N-]S(=O)(=O)c1sccc1Cl ZINC001309150887 1066444297 /nfs/dbraw/zinc/44/42/97/1066444297.db2.gz FSPHVKGXJCZDTN-PWSUYJOCSA-N -1 1 321.895 4.039 20 0 DIADMM CCCCCCOc1cc(C)ccc1C[N-]C(=O)C(F)(F)F ZINC001309285210 1066450266 /nfs/dbraw/zinc/45/02/66/1066450266.db2.gz XIZXJURXSJOIEO-UHFFFAOYSA-N -1 1 317.351 4.133 20 0 DIADMM O=C(Nc1nc2ccccc2s1)c1cc2ccccc2cc1[O-] ZINC000001759745 180894929 /nfs/dbraw/zinc/89/49/29/180894929.db2.gz KBTWKIAWLXVDPZ-UHFFFAOYSA-N -1 1 320.373 4.407 20 0 DIADMM O=C([O-])CC[C@@H](NCc1ccsc1Cl)c1ccccc1 ZINC000417599316 335004899 /nfs/dbraw/zinc/00/48/99/335004899.db2.gz HJPZPGIHGHTBBK-CYBMUJFWSA-N -1 1 309.818 4.097 20 0 DIADMM CN(Cc1ccc(Cl)s1)C(=O)c1cc(Cl)ccc1[O-] ZINC000042268260 183248411 /nfs/dbraw/zinc/24/84/11/183248411.db2.gz BKSMIGJMLFDVAE-UHFFFAOYSA-N -1 1 316.209 4.033 20 0 DIADMM O=C(c1ccc(-c2ccc(Cl)c([O-])c2)cc1)N1CCCCC1 ZINC000065343686 184325234 /nfs/dbraw/zinc/32/52/34/184325234.db2.gz PDYOBDOWAJXVNO-UHFFFAOYSA-N -1 1 315.800 4.339 20 0 DIADMM Cc1noc(-c2ccccc2)c1[N-]C(=O)c1oc(C2CC2)nc1C ZINC000274646735 130251947 /nfs/dbraw/zinc/25/19/47/130251947.db2.gz SDUZZNLJCDWPBV-UHFFFAOYSA-N -1 1 323.352 4.076 20 0 DIADMM O=C(Nc1ccc([O-])c(Cl)c1)[C@@H]1C[C@H]1c1cc(F)ccc1F ZINC000173379656 332829284 /nfs/dbraw/zinc/82/92/84/332829284.db2.gz GIEUWNFQPFJSTP-CMPLNLGQSA-N -1 1 323.726 4.066 20 0 DIADMM Cc1ccc(-c2csc3[n-]c(-c4ccco4)nc(=O)c23)cc1 ZINC000047682003 331591049 /nfs/dbraw/zinc/59/10/49/331591049.db2.gz GEDGKROLIFWIFL-UHFFFAOYSA-N -1 1 308.362 4.220 20 0 DIADMM Cc1cc(S(=O)(=O)[N-]c2cc(C)ccc2Cl)sc1C ZINC000557299921 331781275 /nfs/dbraw/zinc/78/12/75/331781275.db2.gz HPQSERIXKQVXPY-UHFFFAOYSA-N -1 1 315.847 4.128 20 0 DIADMM CCc1ccc(-c2ccc(CN[C@H](C(=O)[O-])[C@H](C)CC)o2)cc1 ZINC000426775914 332093692 /nfs/dbraw/zinc/09/36/92/332093692.db2.gz VODFBRBQCDDAHU-ACJLOTCBSA-N -1 1 315.413 4.098 20 0 DIADMM C[C@H](c1cc2ccccc2o1)c1nc(-c2ccc([O-])c(F)c2)no1 ZINC000445484039 332145297 /nfs/dbraw/zinc/14/52/97/332145297.db2.gz UTOCHCOYFCQOII-SNVBAGLBSA-N -1 1 324.311 4.479 20 0 DIADMM Cc1ccccc1[C@@H](CC(=O)[O-])NCc1cccc(Cl)c1F ZINC000426789103 332153533 /nfs/dbraw/zinc/15/35/33/332153533.db2.gz RQJREVKDVUQLLC-OAHLLOKOSA-N -1 1 321.779 4.093 20 0 DIADMM CCC[C@H](C)C[C@H](NCc1cc2cc(C)c(C)cc2o1)C(=O)[O-] ZINC000426828439 332156095 /nfs/dbraw/zinc/15/60/95/332156095.db2.gz YYLUIOOTDLIRSM-SJCJKPOMSA-N -1 1 317.429 4.419 20 0 DIADMM CCOc1cc(-c2noc([C@H]3C[C@@H]3C3CC3)n2)cc(Cl)c1[O-] ZINC000559979711 332298648 /nfs/dbraw/zinc/29/86/48/332298648.db2.gz NPHRCFNDKSYJJN-MNOVXSKESA-N -1 1 320.776 4.008 20 0 DIADMM Cc1cc(CSc2nc(C(F)(F)F)cc(=O)[n-]2)c(C)s1 ZINC000561849574 332506788 /nfs/dbraw/zinc/50/67/88/332506788.db2.gz XOCRBRQURDFUHP-UHFFFAOYSA-N -1 1 320.361 4.172 20 0 DIADMM CC[C@H](NC(=O)c1ccc([O-])cc1F)c1ccc(Cl)cc1 ZINC000181085676 333029472 /nfs/dbraw/zinc/02/94/72/333029472.db2.gz HFUOVBYYGJYWHA-HNNXBMFYSA-N -1 1 307.752 4.066 20 0 DIADMM CC[C@H](C)c1ccc(S(=O)(=O)[N-]c2c(C)ccnc2C)cc1 ZINC000460545867 333102889 /nfs/dbraw/zinc/10/28/89/333102889.db2.gz BBBLWUBAOHMIAL-LBPRGKRZSA-N -1 1 318.442 4.013 20 0 DIADMM C[C@H](Sc1nc(C(F)F)cc(=O)[n-]1)c1ccc(F)cc1 ZINC000582090857 333209506 /nfs/dbraw/zinc/20/95/06/333209506.db2.gz QQCWZCBYTARKBY-ZETCQYMHSA-N -1 1 300.305 4.112 20 0 DIADMM CC[C@@H](C)Oc1cccc(NC(=O)c2c(F)ccc([O-])c2F)c1 ZINC000497631767 333272500 /nfs/dbraw/zinc/27/25/00/333272500.db2.gz DLWAQEQEYNPOHG-SNVBAGLBSA-N -1 1 321.323 4.100 20 0 DIADMM CCN(C(=O)c1ccc2ccccc2c1[O-])c1ccc(F)cc1 ZINC000390584397 333303913 /nfs/dbraw/zinc/30/39/13/333303913.db2.gz FFDPQCSHTDNIQY-UHFFFAOYSA-N -1 1 309.340 4.351 20 0 DIADMM CC(C)[C@@H]1CCCCN1C(=O)c1ccc(C(F)(F)F)cc1[O-] ZINC000436809858 334001062 /nfs/dbraw/zinc/00/10/62/334001062.db2.gz VNBZJIRKQBCMAU-ZDUSSCGKSA-N -1 1 315.335 4.062 20 0 DIADMM C[C@H]1CCCC[N@H+]([C@H](C(=O)[O-])c2ccc(Cl)cc2Cl)C1 ZINC000571648660 334017095 /nfs/dbraw/zinc/01/70/95/334017095.db2.gz AQPRPAQQYYIBRF-HZMBPMFUSA-N -1 1 316.228 4.241 20 0 DIADMM C[C@@H](SCc1ccccc1)C(=O)Nc1ccc([O-])c(Cl)c1 ZINC000111668300 334352944 /nfs/dbraw/zinc/35/29/44/334352944.db2.gz MOMGPLIMOBCFEP-LLVKDONJSA-N -1 1 321.829 4.306 20 0 DIADMM C[C@@H](CC(=O)Nc1ccc([O-])c(Cl)c1)c1ccccc1F ZINC000111668676 334352995 /nfs/dbraw/zinc/35/29/95/334352995.db2.gz DETDJGMQHHHACD-JTQLQIEISA-N -1 1 307.752 4.317 20 0 DIADMM Cc1c(C(=O)Nc2ccc(F)cc2[O-])oc2c1c(C)ccc2C ZINC000532012469 334371632 /nfs/dbraw/zinc/37/16/32/334371632.db2.gz WUSOAFWAUSKIBA-UHFFFAOYSA-N -1 1 313.328 4.455 20 0 DIADMM CC[C@H](C)c1cc(C(=O)[N-]c2c(OC)cccc2SC)on1 ZINC000416118235 334652153 /nfs/dbraw/zinc/65/21/53/334652153.db2.gz AYHDLQVWIDMQSI-JTQLQIEISA-N -1 1 320.414 4.171 20 0 DIADMM [O-]c1ccc(-c2noc(CCc3ccccc3Cl)n2)cc1F ZINC000445480733 338496363 /nfs/dbraw/zinc/49/63/63/338496363.db2.gz NBWAPRABZJXVSB-UHFFFAOYSA-N -1 1 318.735 4.020 20 0 DIADMM C/C(=C\c1ccc(C)cc1)c1nc(-c2ccc([O-])c(F)c2)no1 ZINC000445479616 338496374 /nfs/dbraw/zinc/49/63/74/338496374.db2.gz JXYXOLCEGCSBKF-FMIVXFBMSA-N -1 1 310.328 4.450 20 0 DIADMM Cc1ccsc1[C@@H]1C[C@H]1c1nc(-c2ccc([O-])c(F)c2)no1 ZINC000445481227 338496451 /nfs/dbraw/zinc/49/64/51/338496451.db2.gz LYQJFQWFBIZDOF-GHMZBOCLSA-N -1 1 316.357 4.222 20 0 DIADMM O=C(Nc1ccc([O-])c(Cl)c1)[C@@H]1C[C@H]1c1ccc(F)cc1F ZINC000113460979 335745540 /nfs/dbraw/zinc/74/55/40/335745540.db2.gz NCOQMTCONJPBOV-NWDGAFQWSA-N -1 1 323.726 4.066 20 0 DIADMM C[C@H](Cc1cccc(Cl)c1)C(=O)Nc1ccc(F)cc1[O-] ZINC000535986458 335806933 /nfs/dbraw/zinc/80/69/33/335806933.db2.gz NVYUFJWUWPTFTQ-SNVBAGLBSA-N -1 1 307.752 4.002 20 0 DIADMM O=C(Nc1ccc(F)cc1[O-])c1ccc2[nH]c3c(c2c1)CCCC3 ZINC000532266406 335927675 /nfs/dbraw/zinc/92/76/75/335927675.db2.gz ACJCRZAYENMOTO-UHFFFAOYSA-N -1 1 324.355 4.144 20 0 DIADMM CN(Cc1ccc(Cl)s1)C(=O)c1ccc(Cl)cc1[O-] ZINC000042268253 336238406 /nfs/dbraw/zinc/23/84/06/336238406.db2.gz BKCWRNJHRKGVEG-UHFFFAOYSA-N -1 1 316.209 4.033 20 0 DIADMM [O-]c1cccc(CNc2ccc(Br)cc2)c1Cl ZINC000328488846 336254127 /nfs/dbraw/zinc/25/41/27/336254127.db2.gz RUNSJZPTILXXDT-UHFFFAOYSA-N -1 1 312.594 4.420 20 0 DIADMM Cc1ccc(OCCC(=O)Nc2ccc([O-])c(Cl)c2)cc1C ZINC000532749661 336269639 /nfs/dbraw/zinc/26/96/39/336269639.db2.gz BGVJOHVHFWEAND-UHFFFAOYSA-N -1 1 319.788 4.070 20 0 DIADMM CC(C)(C)c1nc([N-][C@H](c2nccs2)c2ccccc2)no1 ZINC000302153652 336351163 /nfs/dbraw/zinc/35/11/63/336351163.db2.gz VEEMAZVQRBEPDI-LBPRGKRZSA-N -1 1 314.414 4.025 20 0 DIADMM CCc1cnccc1-c1noc(-c2ccc3ccccc3c2[O-])n1 ZINC000392052713 336382341 /nfs/dbraw/zinc/38/23/41/336382341.db2.gz JEOSAGZUIRWPSO-UHFFFAOYSA-N -1 1 317.348 4.220 20 0 DIADMM CC(F)(F)c1ccc(-c2nc3cc(F)c(F)cc3c(=O)[n-]2)cc1 ZINC000356881758 336564688 /nfs/dbraw/zinc/56/46/88/336564688.db2.gz ITDBTGDANBKBLE-UHFFFAOYSA-N -1 1 322.261 4.392 20 0 DIADMM Cc1cc(-c2noc(-c3ccc([O-])cc3F)n2)nc2ccccc12 ZINC000392301373 337202183 /nfs/dbraw/zinc/20/21/83/337202183.db2.gz AHKYNQNKTQDBPQ-UHFFFAOYSA-N -1 1 321.311 4.105 20 0 DIADMM CCc1nc(SCc2ccc(Cl)c(OC)c2)[n-]c(=O)c1C ZINC000583095372 337240313 /nfs/dbraw/zinc/24/03/13/337240313.db2.gz IGEIYENRCQBENL-UHFFFAOYSA-N -1 1 324.833 4.007 20 0 DIADMM CCOc1cc(C(=O)Nc2c(C)cccc2C)cc(Cl)c1[O-] ZINC000186840155 337260631 /nfs/dbraw/zinc/26/06/31/337260631.db2.gz SNMGQWQSKWDSAS-UHFFFAOYSA-N -1 1 319.788 4.313 20 0 DIADMM CC[C@@H](CC(F)F)c1nc(-c2ccc([O-])cc2Cl)no1 ZINC000420494655 337503532 /nfs/dbraw/zinc/50/35/32/337503532.db2.gz SLEGLEWHCQSWOK-ZETCQYMHSA-N -1 1 302.708 4.244 20 0 DIADMM CC/C=C(\C)c1nc(-c2cc(Cl)c([O-])c(OCC)c2)no1 ZINC000445402106 337659590 /nfs/dbraw/zinc/65/95/90/337659590.db2.gz MHKRURYZHPDDPH-RMKNXTFCSA-N -1 1 308.765 4.308 20 0 DIADMM CCOc1cc(-c2noc(C(F)=C(C)C)n2)cc(Cl)c1[O-] ZINC000445413193 337682973 /nfs/dbraw/zinc/68/29/73/337682973.db2.gz RQASTFFYLYKBAC-UHFFFAOYSA-N -1 1 312.728 4.215 20 0 DIADMM CCC(=O)c1ccc(-c2nc3ccc(C(C)C)cc3c(=O)[n-]2)cc1 ZINC000446149331 338521858 /nfs/dbraw/zinc/52/18/58/338521858.db2.gz KBLQEUXXOMBEDR-UHFFFAOYSA-N -1 1 320.392 4.306 20 0 DIADMM [O-]c1ccc(-c2noc(CSc3ccccc3)n2)c(Cl)c1 ZINC000445444359 337838554 /nfs/dbraw/zinc/83/85/54/337838554.db2.gz IWJWAQKROVCYBT-UHFFFAOYSA-N -1 1 318.785 4.388 20 0 DIADMM C[C@@H](Cc1nc(-c2ccc([O-])cc2Cl)no1)c1ccccc1 ZINC000445448528 337854064 /nfs/dbraw/zinc/85/40/64/337854064.db2.gz RUGCXQUUZBYXIV-NSHDSACASA-N -1 1 314.772 4.442 20 0 DIADMM [O-]c1ccc(-c2noc(-c3csc(C4CC4)n3)n2)c(Cl)c1 ZINC000445448761 337856065 /nfs/dbraw/zinc/85/60/65/337856065.db2.gz WZWREKSJBAKHPN-UHFFFAOYSA-N -1 1 319.773 4.097 20 0 DIADMM [O-]c1ccc(-c2noc(-c3cc(F)ccc3F)n2)c(Cl)c1 ZINC000445448945 337857598 /nfs/dbraw/zinc/85/75/98/337857598.db2.gz MRZNAURPDVNYSQ-UHFFFAOYSA-N -1 1 308.671 4.041 20 0 DIADMM C[C@H](c1nc(-c2ccc([O-])cc2Cl)no1)c1ccccc1F ZINC000445448981 337857603 /nfs/dbraw/zinc/85/76/03/337857603.db2.gz XKOKWHMKMOCQRM-VIFPVBQESA-N -1 1 318.735 4.387 20 0 DIADMM Cc1ccc(-c2nc(-c3ccc([O-])cc3Cl)no2)c(O)c1C ZINC000445449135 337858547 /nfs/dbraw/zinc/85/85/47/337858547.db2.gz UAGZXRBRYBSJGP-UHFFFAOYSA-N -1 1 316.744 4.085 20 0 DIADMM [O-]c1ccc(-c2noc(-c3ccccc3Cl)n2)c(Cl)c1 ZINC000445450779 338015522 /nfs/dbraw/zinc/01/55/22/338015522.db2.gz WLXNKISEDVLZSJ-UHFFFAOYSA-N -1 1 307.136 4.416 20 0 DIADMM C[C@H](OC1CCCCCC1)c1nc(-c2ccc([O-])cc2F)no1 ZINC000445454621 338017270 /nfs/dbraw/zinc/01/72/70/338017270.db2.gz GWFFXTUPGZEWHX-NSHDSACASA-N -1 1 320.364 4.382 20 0 DIADMM C[C@@H](Cc1ccccc1F)c1nc(-c2ccc([O-])cc2F)no1 ZINC000445456350 338017474 /nfs/dbraw/zinc/01/74/74/338017474.db2.gz IQTKKAZSKPPGBG-JTQLQIEISA-N -1 1 316.307 4.067 20 0 DIADMM C[C@@H](Cc1nc(-c2ccc([O-])cc2F)no1)c1ccc(F)cc1 ZINC000445459092 338018161 /nfs/dbraw/zinc/01/81/61/338018161.db2.gz XNTACIHIHQIPIV-JTQLQIEISA-N -1 1 316.307 4.067 20 0 DIADMM C[C@H](Cc1nc(-c2ccc([O-])cc2F)no1)c1ccc(F)cc1 ZINC000445459093 338018182 /nfs/dbraw/zinc/01/81/82/338018182.db2.gz XNTACIHIHQIPIV-SNVBAGLBSA-N -1 1 316.307 4.067 20 0 DIADMM C[C@H](c1ccc(Cl)s1)c1nc(-c2ccc([O-])cc2F)no1 ZINC000445459176 338018412 /nfs/dbraw/zinc/01/84/12/338018412.db2.gz YICPQMKINPQUOO-SSDOTTSWSA-N -1 1 324.764 4.448 20 0 DIADMM Cc1ccc(O[C@H](C)c2nc(-c3ccc([O-])cc3F)no2)cc1 ZINC000445459722 338018612 /nfs/dbraw/zinc/01/86/12/338018612.db2.gz GLKUQMREYAOPTR-LLVKDONJSA-N -1 1 314.316 4.030 20 0 DIADMM [O-]c1ccc(-c2noc(Cc3ccc4ccccc4c3)n2)c(F)c1 ZINC000445460485 338020424 /nfs/dbraw/zinc/02/04/24/338020424.db2.gz AWJRDDWKGMZCEJ-UHFFFAOYSA-N -1 1 320.323 4.325 20 0 DIADMM C[C@@H](c1nc(-c2ccc([O-])cc2F)no1)c1ccc(F)c(F)c1 ZINC000445462188 338024407 /nfs/dbraw/zinc/02/44/07/338024407.db2.gz JNKYDDHTUKGNPO-MRVPVSSYSA-N -1 1 320.270 4.011 20 0 DIADMM Cc1cccc([C@H](NCc2ccc(Cl)cc2F)C(=O)[O-])c1C ZINC000426722466 338039190 /nfs/dbraw/zinc/03/91/90/338039190.db2.gz VURQPHOENPFEQF-INIZCTEOSA-N -1 1 321.779 4.011 20 0 DIADMM C=Cc1ccc(S(=O)(=O)[N-]c2cccc(Cl)c2C)cc1 ZINC000436475413 338273578 /nfs/dbraw/zinc/27/35/78/338273578.db2.gz BFENQMLCIZEYNC-UHFFFAOYSA-N -1 1 307.802 4.092 20 0 DIADMM C=Cc1ccc(S(=O)(=O)[N-]c2ccccc2C(C)C)cc1 ZINC000436480921 338273669 /nfs/dbraw/zinc/27/36/69/338273669.db2.gz YKDGXRKACICQTA-UHFFFAOYSA-N -1 1 301.411 4.254 20 0 DIADMM CCN(C(=O)c1ccc(Cl)cc1[O-])[C@@H](C)c1ccc(F)cc1 ZINC000436490902 338274038 /nfs/dbraw/zinc/27/40/38/338274038.db2.gz PRHJVXJGBSXMPA-NSHDSACASA-N -1 1 321.779 4.408 20 0 DIADMM CN(CCCCc1ccccc1)C(=O)c1cc(Cl)ccc1[O-] ZINC000436492384 338274180 /nfs/dbraw/zinc/27/41/80/338274180.db2.gz RHZXRQIUUDTCIB-UHFFFAOYSA-N -1 1 317.816 4.141 20 0 DIADMM [O-]c1ccc(Oc2ccccc2)cc1-c1nc(-c2ccco2)no1 ZINC000436510538 338274633 /nfs/dbraw/zinc/27/46/33/338274633.db2.gz DRRGRVBURIRUJH-UHFFFAOYSA-N -1 1 320.304 4.495 20 0 DIADMM Cc1cc(N(C)C)ccc1NC(=O)c1cc2ccccc2cc1[O-] ZINC000436529674 338275325 /nfs/dbraw/zinc/27/53/25/338275325.db2.gz SLXJVEGQFZJNGC-UHFFFAOYSA-N -1 1 320.392 4.172 20 0 DIADMM O=C(c1cc2ccccc2cc1[O-])N1CC[C@H]1c1ccccc1 ZINC000436533922 338275674 /nfs/dbraw/zinc/27/56/74/338275674.db2.gz ZDJSAAJCJIIJLG-SFHVURJKSA-N -1 1 303.361 4.133 20 0 DIADMM O=C(c1ccc2ccccc2c1[O-])N1CCc2ccc(Cl)cc21 ZINC000436538741 338276046 /nfs/dbraw/zinc/27/60/46/338276046.db2.gz JVJXTUNRBOXJHF-UHFFFAOYSA-N -1 1 323.779 4.402 20 0 DIADMM CCCCCN(C(=O)c1cc(Cl)c([O-])c(OC)c1)C(C)C ZINC000436542869 338276312 /nfs/dbraw/zinc/27/63/12/338276312.db2.gz FLWTXEHQLMSTIQ-UHFFFAOYSA-N -1 1 313.825 4.095 20 0 DIADMM C[C@@H]1C[C@@H](c2ccccc2)CN1C(=O)c1cc(Cl)ccc1[O-] ZINC000436549720 338276769 /nfs/dbraw/zinc/27/67/69/338276769.db2.gz VQIWSUXTPCJTHN-TZMCWYRMSA-N -1 1 315.800 4.064 20 0 DIADMM Cc1cccc([C@@H]2CCCN2C(=O)c2cc(F)ccc2[O-])c1C ZINC000436565243 338277214 /nfs/dbraw/zinc/27/72/14/338277214.db2.gz ULNVAARFTGNVCV-KRWDZBQOSA-N -1 1 313.372 4.125 20 0 DIADMM Cc1csc2[nH]c(C=Cc3ccc([O-])c(Cl)c3)nc(=O)c12 ZINC000436563658 338277342 /nfs/dbraw/zinc/27/73/42/338277342.db2.gz IBFMYRHVWQKHFT-HYXAFXHYSA-N -1 1 318.785 4.235 20 0 DIADMM CC[C@@H](Cc1ccccc1)N(C)C(=O)c1ccc(Cl)cc1[O-] ZINC000436592015 338278980 /nfs/dbraw/zinc/27/89/80/338278980.db2.gz SCHRFYTYGFWECR-HNNXBMFYSA-N -1 1 317.816 4.139 20 0 DIADMM O=C(c1cc(F)ccc1[O-])N(Cc1ccoc1)C1CCCCC1 ZINC000436591003 338279024 /nfs/dbraw/zinc/27/90/24/338279024.db2.gz OVPIRYNOHGXINJ-UHFFFAOYSA-N -1 1 317.360 4.099 20 0 DIADMM CC[C@@H](C)n1ncc(NC(=O)c2ccc3ccccc3c2[O-])c1C ZINC000436595138 338279052 /nfs/dbraw/zinc/27/90/52/338279052.db2.gz LBRJCTNRGLZQIK-GFCCVEGCSA-N -1 1 323.396 4.274 20 0 DIADMM CC1(C2CC2)CCN(C(=O)c2cc3ccccc3cc2[O-])CC1 ZINC000436601716 338279419 /nfs/dbraw/zinc/27/94/19/338279419.db2.gz DIBHXCKDNSNTAH-UHFFFAOYSA-N -1 1 309.409 4.198 20 0 DIADMM CCC[C@H](CCc1ccccc1)NC(=O)c1ccc([O-])cc1F ZINC000436608133 338279742 /nfs/dbraw/zinc/27/97/42/338279742.db2.gz PEIKMVHOZDXTCR-OAHLLOKOSA-N -1 1 315.388 4.063 20 0 DIADMM CC(C)Oc1cccc(-c2noc(-c3ccc([O-])cc3F)n2)c1 ZINC000436685403 338282852 /nfs/dbraw/zinc/28/28/52/338282852.db2.gz APSFZZSHWSCMHX-UHFFFAOYSA-N -1 1 314.316 4.036 20 0 DIADMM COc1c(F)cc(NC(=O)c2ccc(C(C)C)cc2[O-])cc1F ZINC000436687644 338282866 /nfs/dbraw/zinc/28/28/66/338282866.db2.gz RWXWHRJANDOIBA-UHFFFAOYSA-N -1 1 321.323 4.055 20 0 DIADMM O=C(c1ccccc1[O-])N1CCc2c1cccc2-c1ccccc1 ZINC000436690571 338282920 /nfs/dbraw/zinc/28/29/20/338282920.db2.gz ZQYUKCQCUOOXBU-UHFFFAOYSA-N -1 1 315.372 4.262 20 0 DIADMM CC(C)Oc1ccc(-c2noc(-c3ccc([O-])cc3F)n2)cc1 ZINC000436689965 338282953 /nfs/dbraw/zinc/28/29/53/338282953.db2.gz PLZWNEJPEJRIGR-UHFFFAOYSA-N -1 1 314.316 4.036 20 0 DIADMM Cc1ccccc1C[C@H](C)N(C)C(=O)c1ccc(Cl)cc1[O-] ZINC000436707277 338283535 /nfs/dbraw/zinc/28/35/35/338283535.db2.gz FMNFXBYMJTWDII-ZDUSSCGKSA-N -1 1 317.816 4.057 20 0 DIADMM CCc1ccc(C(=O)N(C)c2cc(Cl)ccc2C)c([O-])c1 ZINC000436708410 338283618 /nfs/dbraw/zinc/28/36/18/338283618.db2.gz UUFBSSBVOVMZAP-UHFFFAOYSA-N -1 1 303.789 4.193 20 0 DIADMM O=C(Nc1ccccc1Nc1ccccc1)c1ccc(O)cc1[O-] ZINC000436736186 338284848 /nfs/dbraw/zinc/28/48/48/338284848.db2.gz FKZNYJVQVBMUHX-UHFFFAOYSA-N -1 1 320.348 4.094 20 0 DIADMM O=C(Nc1ncc(C2CCCCC2)s1)c1ccc([O-])cc1F ZINC000436749028 338285174 /nfs/dbraw/zinc/28/51/74/338285174.db2.gz RHHBGYTXARBCEF-UHFFFAOYSA-N -1 1 320.389 4.288 20 0 DIADMM CCC1(C)CCN(C(=O)c2ccc(C(F)(F)F)cc2[O-])CC1 ZINC000436763106 338286150 /nfs/dbraw/zinc/28/61/50/338286150.db2.gz IWWDNWHSRMHMMT-UHFFFAOYSA-N -1 1 315.335 4.063 20 0 DIADMM CCN(C(=O)c1ccc(C(C)C)cc1[O-])c1cccc(OC)c1 ZINC000436763779 338286394 /nfs/dbraw/zinc/28/63/94/338286394.db2.gz ZMMZNMKMOQBJPW-UHFFFAOYSA-N -1 1 313.397 4.191 20 0 DIADMM CC(C)[C@@H](C)N(C(=O)c1ccc(C(F)(F)F)cc1[O-])C1CC1 ZINC000436795088 338287660 /nfs/dbraw/zinc/28/76/60/338287660.db2.gz QBPBLQHEBNPPPQ-SNVBAGLBSA-N -1 1 315.335 4.060 20 0 DIADMM O=C(Nc1ccccc1COc1ccccc1)c1ccccc1[O-] ZINC000436817639 338288494 /nfs/dbraw/zinc/28/84/94/338288494.db2.gz YBUSLWLCFBUSNG-UHFFFAOYSA-N -1 1 319.360 4.224 20 0 DIADMM O=C(Nc1ccc(-c2ccco2)cc1F)c1ccc([O-])cc1F ZINC000436821528 338288569 /nfs/dbraw/zinc/28/85/69/338288569.db2.gz LGYSYXIUSYZQIL-UHFFFAOYSA-N -1 1 315.275 4.183 20 0 DIADMM CC(=O)c1cc(NC(=O)c2ccc(C(C)C)cc2[O-])ccc1F ZINC000436859533 338290166 /nfs/dbraw/zinc/29/01/66/338290166.db2.gz YHTSAEGDLHSKAB-UHFFFAOYSA-N -1 1 315.344 4.110 20 0 DIADMM O=C(c1ccccc1[O-])N1C[C@@H](c2ccccc2)c2ccccc21 ZINC000436857692 338290239 /nfs/dbraw/zinc/29/02/39/338290239.db2.gz BRSXAMWCALBXID-SFHVURJKSA-N -1 1 315.372 4.185 20 0 DIADMM CCOc1cc(-c2noc([C@H]3C[C@H]3C(C)C)n2)cc(Cl)c1[O-] ZINC000436869324 338290591 /nfs/dbraw/zinc/29/05/91/338290591.db2.gz CSTMZDLJBLTKHH-QWRGUYRKSA-N -1 1 322.792 4.254 20 0 DIADMM [O-]c1ccc(-c2noc(-c3ccoc3C3CC3)n2)c(Cl)c1 ZINC000436867585 338290683 /nfs/dbraw/zinc/29/06/83/338290683.db2.gz CZMNHURGKNVCGA-UHFFFAOYSA-N -1 1 302.717 4.233 20 0 DIADMM CC(C)Oc1ccccc1-c1nc(-c2ccc([O-])c(F)c2)no1 ZINC000436870783 338290791 /nfs/dbraw/zinc/29/07/91/338290791.db2.gz FXETYBXEUJAUAU-UHFFFAOYSA-N -1 1 314.316 4.036 20 0 DIADMM CC[C@H]1CCCC[C@H]1OCc1nc(-c2ccc([O-])cc2F)no1 ZINC000436871800 338291006 /nfs/dbraw/zinc/29/10/06/338291006.db2.gz IJBXVBIBLLBNRQ-XHDPSFHLSA-N -1 1 320.364 4.067 20 0 DIADMM CC[C@H]1CCCC[C@@H]1OCc1nc(-c2ccc([O-])cc2F)no1 ZINC000436871799 338291030 /nfs/dbraw/zinc/29/10/30/338291030.db2.gz IJBXVBIBLLBNRQ-NHYWBVRUSA-N -1 1 320.364 4.067 20 0 DIADMM CCC1CCC(N(C(=O)c2ccc([O-])cc2F)C2CC2)CC1 ZINC000436878400 338291294 /nfs/dbraw/zinc/29/12/94/338291294.db2.gz CJTMQOOVOINGKC-UHFFFAOYSA-N -1 1 305.393 4.105 20 0 DIADMM Cc1cccc(Cl)c1Cc1nc(-c2ccc([O-])c(F)c2)no1 ZINC000436879431 338291428 /nfs/dbraw/zinc/29/14/28/338291428.db2.gz NMTZWTDPDKLMTQ-UHFFFAOYSA-N -1 1 318.735 4.134 20 0 DIADMM Cc1ccnc2ccc(-c3nc(-c4ccc([O-])cc4F)no3)cc12 ZINC000436881122 338291662 /nfs/dbraw/zinc/29/16/62/338291662.db2.gz VOZCVVABARXADG-UHFFFAOYSA-N -1 1 321.311 4.105 20 0 DIADMM [O-]c1ccc(Oc2ccccc2)cc1-c1nc([C@H]2CCCO2)no1 ZINC000436935724 338294419 /nfs/dbraw/zinc/29/44/19/338294419.db2.gz LIQMEIHGJBFJMG-MRXNPFEDSA-N -1 1 324.336 4.086 20 0 DIADMM CCCc1cc(-c2nc(-c3ccc([O-])cc3Cl)no2)ccn1 ZINC000436955886 338295736 /nfs/dbraw/zinc/29/57/36/338295736.db2.gz JRGZKJHHNDAXCD-UHFFFAOYSA-N -1 1 315.760 4.110 20 0 DIADMM CC[C@H](CC(F)(F)F)NC(=O)c1cc2ccccc2cc1[O-] ZINC000436976968 338296504 /nfs/dbraw/zinc/29/65/04/338296504.db2.gz CIIIJKPHQUYAAG-GFCCVEGCSA-N -1 1 311.303 4.006 20 0 DIADMM CCC[C@@H]1CCCCN1C(=O)c1ccc(C(F)(F)F)cc1[O-] ZINC000436989107 338296944 /nfs/dbraw/zinc/29/69/44/338296944.db2.gz NMMANQYZYZLDNS-GFCCVEGCSA-N -1 1 315.335 4.206 20 0 DIADMM O=C([N-]c1cc(Cl)cc(F)c1F)c1c(F)ccc(F)c1F ZINC000441577281 338417066 /nfs/dbraw/zinc/41/70/66/338417066.db2.gz RVYYTCTXTVNCCO-UHFFFAOYSA-N -1 1 321.632 4.288 20 0 DIADMM Cc1c2ccccc2oc1[C@H](C)NC(=O)c1ccc([O-])cc1F ZINC000162358416 338601688 /nfs/dbraw/zinc/60/16/88/338601688.db2.gz WMPVZNSWIGCKLX-NSHDSACASA-N -1 1 313.328 4.077 20 0 DIADMM O=C(c1ccc(Cl)cc1[O-])N1CC2(CCC2)[C@H]1c1ccco1 ZINC000456579610 338934815 /nfs/dbraw/zinc/93/48/15/338934815.db2.gz XLUODRGKOAVURR-OAHLLOKOSA-N -1 1 317.772 4.006 20 0 DIADMM O=C(Nc1ccc([O-])c(F)c1F)[C@@H]1CC[C@H]2CCCC[C@@H]2C1 ZINC000456789108 338940857 /nfs/dbraw/zinc/94/08/57/338940857.db2.gz SQDNIDJKNPKNMS-IJLUTSLNSA-N -1 1 309.356 4.215 20 0 DIADMM CC(C)CCc1ccc(S(=O)(=O)[N-]c2ccsc2)cc1 ZINC000462104596 339072223 /nfs/dbraw/zinc/07/22/23/339072223.db2.gz RSNUHQRRWBSGJU-UHFFFAOYSA-N -1 1 309.456 4.138 20 0 DIADMM CC[C@@H](C)c1ccc(S(=O)(=O)[N-]c2cccc(F)c2C)cc1 ZINC000467080957 339225894 /nfs/dbraw/zinc/22/58/94/339225894.db2.gz JJEIDSHDXIZNPP-GFCCVEGCSA-N -1 1 321.417 4.448 20 0 DIADMM Cc1c(F)cccc1[N-]S(=O)(=O)c1ccccc1C(C)C ZINC000468353658 339260380 /nfs/dbraw/zinc/26/03/80/339260380.db2.gz RWJFBZVPVMODBN-UHFFFAOYSA-N -1 1 307.390 4.058 20 0 DIADMM Cc1ccc(C)c([N-]S(=O)(=O)c2ccccc2C(C)C)c1 ZINC000468535056 339265670 /nfs/dbraw/zinc/26/56/70/339265670.db2.gz FRWDAZOQLWWIKA-UHFFFAOYSA-N -1 1 303.427 4.228 20 0 DIADMM CCCCc1nc(CSc2nc(C3CC3)cc(=O)[n-]2)cs1 ZINC000470461121 339320285 /nfs/dbraw/zinc/32/02/85/339320285.db2.gz XRBJVDKYFLVTBS-UHFFFAOYSA-N -1 1 321.471 4.151 20 0 DIADMM O=C(Nc1ccc(F)cc1[O-])c1cc(F)ccc1-c1ccoc1 ZINC000472437384 339371774 /nfs/dbraw/zinc/37/17/74/339371774.db2.gz CGFDWTQQKIFBGC-UHFFFAOYSA-N -1 1 315.275 4.183 20 0 DIADMM CC[C@H](C)Oc1ccc(-c2nc3ccc(C)cc3c(=O)[n-]2)cc1 ZINC000481201299 339598387 /nfs/dbraw/zinc/59/83/87/339598387.db2.gz UKMIHFJTEMEBTM-ZDUSSCGKSA-N -1 1 308.381 4.076 20 0 DIADMM CCc1nc(C(C)C)ccc1C(=O)Nc1ccc([O-])c(Cl)c1 ZINC000485656197 339708469 /nfs/dbraw/zinc/70/84/69/339708469.db2.gz JAOIMUNRYYMARC-UHFFFAOYSA-N -1 1 318.804 4.379 20 0 DIADMM O=C([N-]c1c(F)cc(F)cc1F)c1coc(C2CCCCC2)n1 ZINC000486433029 339727167 /nfs/dbraw/zinc/72/71/67/339727167.db2.gz INTGUCDJPYYBLJ-UHFFFAOYSA-N -1 1 324.302 4.392 20 0 DIADMM Cc1ccccc1[N-]S(=O)(=O)c1cccc(-c2ccccc2)c1 ZINC000506548436 340196575 /nfs/dbraw/zinc/19/65/75/340196575.db2.gz VUHCDLYQCPUCPJ-UHFFFAOYSA-N -1 1 323.417 4.463 20 0 DIADMM CC[C@@H](C)[C@H](C)C(=O)Nc1cc(C)cc(Br)c1[O-] ZINC000507366337 340218102 /nfs/dbraw/zinc/21/81/02/340218102.db2.gz AYRRUDURHAWASD-ZJUUUORDSA-N -1 1 314.223 4.084 20 0 DIADMM C[C@@H]1CO[C@@H](c2ccccc2)CN1Cc1cccc([O-])c1Cl ZINC000508171142 340240057 /nfs/dbraw/zinc/24/00/57/340240057.db2.gz CZSVIZISECDXDT-CXAGYDPISA-N -1 1 317.816 4.008 20 0 DIADMM C[C@@H]1CO[C@H](c2ccccc2)CN1Cc1cccc([O-])c1Cl ZINC000508171143 340240088 /nfs/dbraw/zinc/24/00/88/340240088.db2.gz CZSVIZISECDXDT-DYVFJYSZSA-N -1 1 317.816 4.008 20 0 DIADMM CCC[N@H+](Cc1cccc([O-])c1Cl)[C@@H]1[C@H]2CCO[C@@H]2C1(C)C ZINC000508718444 340251384 /nfs/dbraw/zinc/25/13/84/340251384.db2.gz LEMLAULSOYEAEN-XYPHTWIQSA-N -1 1 323.864 4.071 20 0 DIADMM [O-]c1cccc(CN(CC2CCC2)CC(F)(F)F)c1Cl ZINC000509022327 340258525 /nfs/dbraw/zinc/25/85/25/340258525.db2.gz PILKWWXIYSWNLK-UHFFFAOYSA-N -1 1 307.743 4.210 20 0 DIADMM Cc1cc2c([n-]c([C@H](F)c3ccc(Cl)cc3)nc2=O)s1 ZINC000509074505 340260543 /nfs/dbraw/zinc/26/05/43/340260543.db2.gz LFAWENBIGKSUHE-LLVKDONJSA-N -1 1 308.765 4.418 20 0 DIADMM CCSc1ccc(CC(=O)Nc2ccc([O-])c(Cl)c2)cc1 ZINC000509162593 340262841 /nfs/dbraw/zinc/26/28/41/340262841.db2.gz CCQVHZNHQSAGGQ-UHFFFAOYSA-N -1 1 321.829 4.339 20 0 DIADMM O=C(Nc1ccc([O-])c(Cl)c1)[C@H]1CCSc2ccccc21 ZINC000509167101 340262933 /nfs/dbraw/zinc/26/29/33/340262933.db2.gz MZWYAVRRYALAAT-LBPRGKRZSA-N -1 1 319.813 4.264 20 0 DIADMM C[C@@]1(C(=O)Nc2ccc([O-])c(Cl)c2)CCc2ccccc2C1 ZINC000509185956 340263360 /nfs/dbraw/zinc/26/33/60/340263360.db2.gz QDVMBCAMVVRCOT-GOSISDBHSA-N -1 1 315.800 4.179 20 0 DIADMM O=C(Nc1ccccc1SC1CCCC1)c1cncc([O-])c1 ZINC000316017005 340677919 /nfs/dbraw/zinc/67/79/19/340677919.db2.gz KPBWBDOBUKYZGQ-UHFFFAOYSA-N -1 1 314.410 4.074 20 0 DIADMM O=C(Nc1cc(Cl)c([O-])c2ccccc12)C1CC(F)(F)C1 ZINC000529540245 340761108 /nfs/dbraw/zinc/76/11/08/340761108.db2.gz WIMADRVHSOZMQL-UHFFFAOYSA-N -1 1 311.715 4.183 20 0 DIADMM CN(C(=O)c1ccc(Cl)cc1[O-])[C@@H]1CCCc2ccccc21 ZINC000539848725 340905661 /nfs/dbraw/zinc/90/56/61/340905661.db2.gz ZRMJJWZWRDPXAJ-MRXNPFEDSA-N -1 1 315.800 4.195 20 0 DIADMM CC[C@@H](NC(=O)c1cc2ccccc2cc1[O-])c1c(C)noc1C ZINC000129688475 340981030 /nfs/dbraw/zinc/98/10/30/340981030.db2.gz GZOLBGWAFIORLZ-MRXNPFEDSA-N -1 1 324.380 4.031 20 0 DIADMM CC(C)c1ccc2nc(-c3c[nH]c4ccccc34)[n-]c(=O)c2c1 ZINC000130618549 341033016 /nfs/dbraw/zinc/03/30/16/341033016.db2.gz LUUIENZBDTYLND-UHFFFAOYSA-N -1 1 303.365 4.195 20 0 DIADMM CN(C(=O)c1ccc(O)cc1[O-])c1ccc(-c2ccccc2)cc1 ZINC000543744762 341056414 /nfs/dbraw/zinc/05/64/14/341056414.db2.gz MITWALSXPCVNEG-UHFFFAOYSA-N -1 1 319.360 4.041 20 0 DIADMM O=C([N-]c1c(F)cc(F)cc1F)c1csc(-c2ccoc2)n1 ZINC000072507306 341088080 /nfs/dbraw/zinc/08/80/80/341088080.db2.gz JKZSDWDXXYGSLP-UHFFFAOYSA-N -1 1 324.283 4.073 20 0 DIADMM C[C@@H](c1cccc(Cl)c1)N(C)C(=O)c1cc(F)ccc1[O-] ZINC000132892595 341148645 /nfs/dbraw/zinc/14/86/45/341148645.db2.gz KXCYNDACOKXRFM-JTQLQIEISA-N -1 1 307.752 4.018 20 0 DIADMM COc1cc(C(=O)Nc2cccc(C(C)C)c2)cc(Cl)c1[O-] ZINC000546593792 341173741 /nfs/dbraw/zinc/17/37/41/341173741.db2.gz UBVQETKCKZVDPC-UHFFFAOYSA-N -1 1 319.788 4.430 20 0 DIADMM CC(C)c1ccc(S(=O)(=O)[N-]c2ccc3[nH]ccc3c2)cc1 ZINC000078677396 341246017 /nfs/dbraw/zinc/24/60/17/341246017.db2.gz SSXHHNOSIZBFLB-UHFFFAOYSA-N -1 1 314.410 4.092 20 0 DIADMM C[C@H](c1ccc(F)cc1)N(C)C(=O)c1ccc(Cl)cc1[O-] ZINC000136046558 341251516 /nfs/dbraw/zinc/25/15/16/341251516.db2.gz BYAVOQZUILVANL-SNVBAGLBSA-N -1 1 307.752 4.018 20 0 DIADMM O=C(Nc1ccc([O-])c(Cl)c1)[C@H]1CCCC[C@H]1C(F)(F)F ZINC000136121688 341253100 /nfs/dbraw/zinc/25/31/00/341253100.db2.gz YYVGYOPHAJVBMB-VHSXEESVSA-N -1 1 321.726 4.353 20 0 DIADMM O=C(Nc1nc2ccccc2s1)Nc1ccc([O-])c(Cl)c1 ZINC000139979619 341358666 /nfs/dbraw/zinc/35/86/66/341358666.db2.gz CIRCOFJNQRZRLK-UHFFFAOYSA-N -1 1 319.773 4.299 20 0 DIADMM O=C(Nc1ccccc1OC1CCCC1)c1ccc([O-])cc1F ZINC000181893085 527430379 /nfs/dbraw/zinc/43/03/79/527430379.db2.gz FEUXWVPELOGNBV-UHFFFAOYSA-N -1 1 315.344 4.105 20 0 DIADMM O=C(Nc1c([O-])cccc1F)c1cc(Cl)cc(Cl)c1 ZINC000605440622 1038515995 /nfs/dbraw/zinc/51/59/95/1038515995.db2.gz XDMHJXLCWDDDDD-UHFFFAOYSA-N -1 1 300.116 4.090 20 0 DIADMM COc1ccc(O)cc1Nc1cc(Cl)c([O-])cc1Cl ZINC001176579113 1048733460 /nfs/dbraw/zinc/73/34/60/1048733460.db2.gz JOEXDWVGCIJJFA-UHFFFAOYSA-N -1 1 300.141 4.157 20 0 DIADMM CCSc1cccc(F)c1[N-]C(=O)c1cnc(CC)s1 ZINC000583969932 1035703608 /nfs/dbraw/zinc/70/36/08/1035703608.db2.gz ZFTTVVSFSFYATA-UHFFFAOYSA-N -1 1 310.419 4.209 20 0 DIADMM Cc1ccc([N-]S(=O)(=O)c2ccc(F)c3ccccc32)cc1 ZINC000164157264 1036252352 /nfs/dbraw/zinc/25/23/52/1036252352.db2.gz WXRJBMBGDRDSSR-UHFFFAOYSA-N -1 1 315.369 4.088 20 0 DIADMM CC(C)(C)[C@H]1CN(C(=O)c2ccc([O-])c(F)c2)c2ccccc21 ZINC000683517661 1036435837 /nfs/dbraw/zinc/43/58/37/1036435837.db2.gz OQDHLECXMILGMJ-AWEZNQCLSA-N -1 1 313.372 4.321 20 0 DIADMM CC(C)Oc1ccc(-c2nc(-c3ccc([O-])cc3F)no2)cc1 ZINC000683592220 1036526560 /nfs/dbraw/zinc/52/65/60/1036526560.db2.gz TTYOQWKTRYBCHO-UHFFFAOYSA-N -1 1 314.316 4.036 20 0 DIADMM [O-]c1ccc(-c2noc(-c3cc4occc4s3)n2)c(F)c1 ZINC000683592117 1036528175 /nfs/dbraw/zinc/52/81/75/1036528175.db2.gz MBLQBWALZSRFQP-UHFFFAOYSA-N -1 1 302.286 4.056 20 0 DIADMM CC=C(C)Nc1cccc(C([O-])(C(F)(F)F)C(F)(F)F)c1 ZINC001210797371 1036982831 /nfs/dbraw/zinc/98/28/31/1036982831.db2.gz IZFHBGRYAFSXNY-FPYGCLRLSA-N -1 1 313.241 4.334 20 0 DIADMM O=c1[nH]ccc(Nc2cc(Cl)c([O-])c(Cl)c2)c1Cl ZINC001210926642 1037060030 /nfs/dbraw/zinc/06/00/30/1037060030.db2.gz FKQFNCIFMUOCTE-UHFFFAOYSA-N -1 1 305.548 4.197 20 0 DIADMM O=C(Nc1ccc([O-])c(Cl)c1)C1(c2ccc(F)cc2)CCC1 ZINC000129625197 1037067460 /nfs/dbraw/zinc/06/74/60/1037067460.db2.gz XKMGKRCTKZOBSY-UHFFFAOYSA-N -1 1 319.763 4.245 20 0 DIADMM Cc1c2cc(F)ccc2sc1C(=O)Nc1c([O-])cccc1F ZINC000089541435 1037087219 /nfs/dbraw/zinc/08/72/19/1037087219.db2.gz NBMFWPUPWXRDGN-UHFFFAOYSA-N -1 1 319.332 4.446 20 0 DIADMM Cc1ccc(SCCC(=O)Nc2c([O-])cccc2F)cc1C ZINC000089541588 1037087389 /nfs/dbraw/zinc/08/73/89/1037087389.db2.gz SZAQDCZNUYHXAC-UHFFFAOYSA-N -1 1 319.401 4.269 20 0 DIADMM Cc1ncccc1C(=O)Nc1cc(Cl)c([O-])c2ccccc12 ZINC001167439822 1037381192 /nfs/dbraw/zinc/38/11/92/1037381192.db2.gz ILOMSRBUICXVSJ-UHFFFAOYSA-N -1 1 312.756 4.155 20 0 DIADMM C=COc1ccc(NC(=O)c2ccc(C(F)(F)F)c([O-])c2)cc1 ZINC001299157956 1038223550 /nfs/dbraw/zinc/22/35/50/1038223550.db2.gz SLBCPTMRKKBHSO-UHFFFAOYSA-N -1 1 323.270 4.186 20 0 DIADMM Nc1ccc(Nc2cc([O-])c(F)c(F)c2)c(C(F)(F)F)c1 ZINC001216133723 1038249545 /nfs/dbraw/zinc/24/95/45/1038249545.db2.gz KJWOMTIZOGUSLP-UHFFFAOYSA-N -1 1 304.218 4.015 20 0 DIADMM C[C@H](c1ccc(Cl)cc1Cl)N1CC[C@H](C(=O)[O-])[C@H](C)C1 ZINC000312558415 1038401069 /nfs/dbraw/zinc/40/10/69/1038401069.db2.gz QWPFHHJFIFFGLQ-FOGDFJRCSA-N -1 1 316.228 4.097 20 0 DIADMM Cc1ccoc1CN[C@H](CC(=O)[O-])c1ccc(C(C)C)cc1 ZINC000277211927 1038452618 /nfs/dbraw/zinc/45/26/18/1038452618.db2.gz HGTNQZHYXFZMNB-MRXNPFEDSA-N -1 1 301.386 4.017 20 0 DIADMM Cc1ccc(CN[C@@H](CC(=O)[O-])c2ccc(C(C)C)cc2)o1 ZINC000277224647 1038457863 /nfs/dbraw/zinc/45/78/63/1038457863.db2.gz ICCDOVAMOXJKRK-KRWDZBQOSA-N -1 1 301.386 4.017 20 0 DIADMM CCc1nc(SCc2ccc(F)c(Cl)c2)[n-]c(=O)c1C ZINC000657263758 1038479074 /nfs/dbraw/zinc/47/90/74/1038479074.db2.gz DNFIMFGQCRKGMG-UHFFFAOYSA-N -1 1 312.797 4.138 20 0 DIADMM CCc1nc(SCc2ccsc2Cl)[n-]c(=O)c1C ZINC000657264669 1038481189 /nfs/dbraw/zinc/48/11/89/1038481189.db2.gz XEIUFCPWODTZDV-UHFFFAOYSA-N -1 1 300.836 4.060 20 0 DIADMM O=C([O-])CC[C@H]1CCCN(Cc2cc(Cl)ccc2Cl)C1 ZINC000087761519 1038501776 /nfs/dbraw/zinc/50/17/76/1038501776.db2.gz UPUJHXAQGFPRBM-LLVKDONJSA-N -1 1 316.228 4.070 20 0 DIADMM O=C(CCc1ccc2ccccc2c1)Nc1c([O-])cccc1F ZINC000605440732 1038515685 /nfs/dbraw/zinc/51/56/85/1038515685.db2.gz ZMDAHSAZRKYNJP-UHFFFAOYSA-N -1 1 309.340 4.256 20 0 DIADMM Cc1c(C(=O)Nc2c([O-])cccc2F)oc2c1c(C)ccc2C ZINC000605440350 1038516861 /nfs/dbraw/zinc/51/68/61/1038516861.db2.gz PTUMHMIEQBNTNA-UHFFFAOYSA-N -1 1 313.328 4.455 20 0 DIADMM Cc1ccc([C@H]2CCCN2[C@H](C)c2cc(C(=O)[O-])c(C)o2)o1 ZINC000515489335 1038609074 /nfs/dbraw/zinc/60/90/74/1038609074.db2.gz BSTGUXAZWBPHLP-BXUZGUMPSA-N -1 1 303.358 4.086 20 0 DIADMM O=C(NCCC1=CCCCC1)c1ccc(C(F)(F)F)c([O-])c1 ZINC000684869964 1038664689 /nfs/dbraw/zinc/66/46/89/1038664689.db2.gz CTLMJKPQULRSCF-UHFFFAOYSA-N -1 1 313.319 4.031 20 0 DIADMM Cc1cc(F)ccc1NC(=O)c1ccc(C(F)(F)F)c([O-])c1 ZINC000684870167 1038664854 /nfs/dbraw/zinc/66/48/54/1038664854.db2.gz QDDCFGBPWIEZAK-UHFFFAOYSA-N -1 1 313.250 4.111 20 0 DIADMM Cc1ccc(C)c(NC(=O)c2ccc(C(F)(F)F)c([O-])c2)c1 ZINC000684869235 1038666440 /nfs/dbraw/zinc/66/64/40/1038666440.db2.gz PMQOFCSSNIQEFM-UHFFFAOYSA-N -1 1 309.287 4.280 20 0 DIADMM CCc1ccccc1NC(=O)c1ccc(C(F)(F)F)c([O-])c1 ZINC000684870830 1038667428 /nfs/dbraw/zinc/66/74/28/1038667428.db2.gz LSIHRESZSMRPMA-UHFFFAOYSA-N -1 1 309.287 4.226 20 0 DIADMM CC(C)[C@H](C)N(C(=O)c1ccc(C(F)(F)F)c([O-])c1)C1CC1 ZINC000684874424 1038670033 /nfs/dbraw/zinc/67/00/33/1038670033.db2.gz NTVZLNHAJIHANB-JTQLQIEISA-N -1 1 315.335 4.060 20 0 DIADMM CCCCc1ccc(CC(=O)Nc2c([O-])cccc2F)cc1 ZINC000608365736 1038829275 /nfs/dbraw/zinc/82/92/75/1038829275.db2.gz ILLCLYARTMMPFR-UHFFFAOYSA-N -1 1 301.361 4.055 20 0 DIADMM CC1(C)CCC[C@H]1CCNC(=O)c1ccc2ccccc2c1[O-] ZINC001167621129 1038949647 /nfs/dbraw/zinc/94/96/47/1038949647.db2.gz FRJXTWFLPQXPJJ-HNNXBMFYSA-N -1 1 311.425 4.492 20 0 DIADMM C[C@@H]1CCc2c(C(=O)Nc3ccc([O-])c(F)c3F)csc2C1 ZINC000456794426 1039077631 /nfs/dbraw/zinc/07/76/31/1039077631.db2.gz PDCWVJUVEUUWQI-MRVPVSSYSA-N -1 1 323.364 4.109 20 0 DIADMM CC(C)C[C@H](C(=O)Nc1ccc([O-])c(F)c1F)c1ccccc1 ZINC000456787022 1039078344 /nfs/dbraw/zinc/07/83/44/1039078344.db2.gz PLSSHCGZMUHEKO-ZDUSSCGKSA-N -1 1 319.351 4.439 20 0 DIADMM COCOc1ccccc1Nc1c(Cl)ccc([O-])c1Cl ZINC001211564766 1039092816 /nfs/dbraw/zinc/09/28/16/1039092816.db2.gz UNLXLTWSPHFPRH-UHFFFAOYSA-N -1 1 314.168 4.425 20 0 DIADMM CC(=O)[C@@H](C)CCCCc1nc(-c2ccc([O-])cc2Cl)no1 ZINC000278093137 1039151104 /nfs/dbraw/zinc/15/11/04/1039151104.db2.gz HJFRJQLNJMAYBF-JTQLQIEISA-N -1 1 322.792 4.034 20 0 DIADMM Cc1ccc(C(=O)/C=C/c2ccc([O-])c(Br)c2)s1 ZINC000032531709 1039312153 /nfs/dbraw/zinc/31/21/53/1039312153.db2.gz NULLCUKAGCAIOO-GQCTYLIASA-N -1 1 323.211 4.421 20 0 DIADMM O=C([O-])c1ccoc1CN1CCCC[C@H]1c1cc2ccccc2[nH]1 ZINC000583505267 1039353054 /nfs/dbraw/zinc/35/30/54/1039353054.db2.gz YTDDQKNIOCIJGX-KRWDZBQOSA-N -1 1 324.380 4.186 20 0 DIADMM O=C(CCc1cccc(Cl)c1)Nc1ccc([O-])c(Cl)c1 ZINC000541887723 1039755261 /nfs/dbraw/zinc/75/52/61/1039755261.db2.gz LACZKHINPJFLKV-UHFFFAOYSA-N -1 1 310.180 4.270 20 0 DIADMM CSc1ccc(Cl)cc1[N-]C(=O)c1noc2c1CCCC2 ZINC000141689567 1039943667 /nfs/dbraw/zinc/94/36/67/1039943667.db2.gz DWVUGICZAMMTIL-UHFFFAOYSA-N -1 1 322.817 4.181 20 0 DIADMM COc1cccc([C@H](C)CC(=O)Nc2ccc([O-])c(Cl)c2)c1 ZINC000176045912 1040065324 /nfs/dbraw/zinc/06/53/24/1040065324.db2.gz VEPWMIHBQIHXJJ-LLVKDONJSA-N -1 1 319.788 4.187 20 0 DIADMM O=C([N-]c1ncsc1C1CC1)c1snc(Cl)c1Cl ZINC000914118807 1040084841 /nfs/dbraw/zinc/08/48/41/1040084841.db2.gz IKZSCBVGQRZDNX-UHFFFAOYSA-N -1 1 320.226 4.036 20 0 DIADMM COc1cc(O)ccc1Nc1cc(Cl)c([O-])cc1Cl ZINC001213097808 1040444704 /nfs/dbraw/zinc/44/47/04/1040444704.db2.gz YXVABLJVJVPXRO-UHFFFAOYSA-N -1 1 300.141 4.157 20 0 DIADMM Cc1ccc(CN(C(=O)c2ccc3ccccc3c2[O-])C2CC2)o1 ZINC000612549888 1040634758 /nfs/dbraw/zinc/63/47/58/1040634758.db2.gz VZVUIRVXGJJHBL-UHFFFAOYSA-N -1 1 321.376 4.252 20 0 DIADMM O=C(Nc1ccc([O-])c(Cl)c1)C1(C(F)(F)F)CCCCC1 ZINC000612760476 1040697581 /nfs/dbraw/zinc/69/75/81/1040697581.db2.gz WPBVGINZEZASOB-UHFFFAOYSA-N -1 1 321.726 4.497 20 0 DIADMM C[C@@H]([N-]C(=O)C(F)(F)C(F)F)c1ccc(F)c2ccccc21 ZINC000809306818 1041132329 /nfs/dbraw/zinc/13/23/29/1041132329.db2.gz VQTZHUJDTLASKV-MRVPVSSYSA-N -1 1 317.257 4.057 20 0 DIADMM CSc1cccc(-c2ccc(OC(F)(F)F)cc2[O-])n1 ZINC001244464257 1041248161 /nfs/dbraw/zinc/24/81/61/1041248161.db2.gz ZCEZSNRBYVQJGD-UHFFFAOYSA-N -1 1 301.289 4.075 20 0 DIADMM COc1nc(-c2cc(C)c([O-])c(Cl)c2)nc2ccsc21 ZINC001244530829 1041380927 /nfs/dbraw/zinc/38/09/27/1041380927.db2.gz ANTOSPYSIPOBBK-UHFFFAOYSA-N -1 1 306.774 4.034 20 0 DIADMM Cc1cc(-c2ncc(C(F)(F)F)cc2N)cc(Cl)c1[O-] ZINC001244535861 1041384890 /nfs/dbraw/zinc/38/48/90/1041384890.db2.gz CRWNONPZUFRYQM-UHFFFAOYSA-N -1 1 302.683 4.017 20 0 DIADMM Cc1ccccc1[C@@H](C)CC(=O)Nc1cc([O-])c(F)cc1F ZINC001625893034 1041490961 /nfs/dbraw/zinc/49/09/61/1041490961.db2.gz DNTKZVCJIGONPG-NSHDSACASA-N -1 1 305.324 4.111 20 0 DIADMM O=C(CC/C=C\c1ccccc1)Nc1cc([O-])c(F)cc1F ZINC001625894074 1041501184 /nfs/dbraw/zinc/50/11/84/1041501184.db2.gz QRASSASFFGZIOI-YWEYNIOJSA-N -1 1 303.308 4.103 20 0 DIADMM C/C(=C\C(=O)Nc1cc([O-])c(F)cc1F)c1ccccc1Cl ZINC001625894091 1041501812 /nfs/dbraw/zinc/50/18/12/1041501812.db2.gz RNNQBNVOAZPAAE-RMKNXTFCSA-N -1 1 323.726 4.366 20 0 DIADMM O=C(Nc1cc([O-])c(F)cc1F)c1coc2ccc(Cl)cc21 ZINC001625896398 1041641443 /nfs/dbraw/zinc/64/14/43/1041641443.db2.gz LGDRZZAAIRTHIO-UHFFFAOYSA-N -1 1 323.682 4.322 20 0 DIADMM CC(C)(C)Oc1cccc(C(=O)Nc2cc([O-])c(F)cc2F)c1 ZINC001625896414 1041643856 /nfs/dbraw/zinc/64/38/56/1041643856.db2.gz LVYWHHOSSSUZMK-UHFFFAOYSA-N -1 1 321.323 4.100 20 0 DIADMM CC(C)N(Cc1ccccc1)C(=O)c1ccc(Cl)cc1[O-] ZINC000019231796 1041705663 /nfs/dbraw/zinc/70/56/63/1041705663.db2.gz RYUJMDXPKMYQRM-UHFFFAOYSA-N -1 1 303.789 4.096 20 0 DIADMM CCN(Cc1ccc(Cl)s1)[C@@H](C)c1ccc(C(=O)[O-])o1 ZINC000652376747 1042031523 /nfs/dbraw/zinc/03/15/23/1042031523.db2.gz DHIJKTBBLXKPCK-VIFPVBQESA-N -1 1 313.806 4.276 20 0 DIADMM COc1ccc(C(C)(C)C)cc1NC(=O)c1ccc(F)c([O-])c1 ZINC001135487084 1042036476 /nfs/dbraw/zinc/03/64/76/1042036476.db2.gz PNJBZMFIRBUNSY-UHFFFAOYSA-N -1 1 317.360 4.090 20 0 DIADMM O=C([O-])C[C@H]1CCCCN1Cc1nc(C2CCCCC2)cs1 ZINC000652463875 1042052566 /nfs/dbraw/zinc/05/25/66/1042052566.db2.gz YLSFKCDIUAOABV-CQSZACIVSA-N -1 1 322.474 4.020 20 0 DIADMM O=C(N[C@H](c1ccc(Cl)cc1)C1CC1)c1ccc(F)c([O-])c1 ZINC001135689556 1042080800 /nfs/dbraw/zinc/08/08/00/1042080800.db2.gz HOIUZOWNTHLCRZ-INIZCTEOSA-N -1 1 319.763 4.066 20 0 DIADMM O=C(N[C@@H](c1ccc(Cl)cc1)C1CC1)c1ccc(F)c([O-])c1 ZINC001135689557 1042081042 /nfs/dbraw/zinc/08/10/42/1042081042.db2.gz HOIUZOWNTHLCRZ-MRXNPFEDSA-N -1 1 319.763 4.066 20 0 DIADMM C[C@H](CN(C)C(=O)c1cc(Cl)ccc1[O-])C1CCCCC1 ZINC001170850695 1042090357 /nfs/dbraw/zinc/09/03/57/1042090357.db2.gz WEWKKZYCZFGMJZ-GFCCVEGCSA-N -1 1 309.837 4.334 20 0 DIADMM Cc1ccc(NC(=O)c2ccc(F)c([O-])c2)cc1C(F)(F)F ZINC001135860292 1042101481 /nfs/dbraw/zinc/10/14/81/1042101481.db2.gz YVFPNGVMSYLSFR-UHFFFAOYSA-N -1 1 313.250 4.111 20 0 DIADMM CC[C@@H](NC(=O)c1cccc([O-])c1F)c1cccc(Cl)c1 ZINC001136183068 1042166017 /nfs/dbraw/zinc/16/60/17/1042166017.db2.gz PMUVHPZQBDKUDQ-CYBMUJFWSA-N -1 1 307.752 4.066 20 0 DIADMM O=C(NC1(c2ccccc2)CCC1)c1ccc2ccccc2c1[O-] ZINC001136180411 1042167467 /nfs/dbraw/zinc/16/74/67/1042167467.db2.gz XGZRGOPPGOCXHK-UHFFFAOYSA-N -1 1 317.388 4.355 20 0 DIADMM CC(C)(C)[C@@H]1CCCC[C@H]1NC(=O)c1ccc(Cl)cc1[O-] ZINC001136181124 1042168431 /nfs/dbraw/zinc/16/84/31/1042168431.db2.gz CKBPPUBEHMSGPX-ZIAGYGMSSA-N -1 1 309.837 4.380 20 0 DIADMM O=C(c1cc(Cl)ccc1[O-])N1CCC[C@H]1C1CCCCC1 ZINC001136310601 1042207995 /nfs/dbraw/zinc/20/79/95/1042207995.db2.gz ORMVUZJZDMUJAT-HNNXBMFYSA-N -1 1 307.821 4.231 20 0 DIADMM O=C(N[C@@H](c1ccccc1)C1CCC1)c1c([O-])cccc1Cl ZINC001136690308 1042317744 /nfs/dbraw/zinc/31/77/44/1042317744.db2.gz HWWOEUSIGWFZFG-KRWDZBQOSA-N -1 1 315.800 4.317 20 0 DIADMM C[C@@H](c1cc(Cl)ccc1Cl)N1CC[C@H](C(=O)[O-])[C@H](C)C1 ZINC000312830682 1042363656 /nfs/dbraw/zinc/36/36/56/1042363656.db2.gz JSIQEWIXPKYLQV-SCVCMEIPSA-N -1 1 316.228 4.097 20 0 DIADMM CCOc1cc(F)c(F)cc1Nc1cc([O-])c(F)c(F)c1 ZINC001211803429 1042455578 /nfs/dbraw/zinc/45/55/78/1042455578.db2.gz JHXDNUKHUYMWCQ-UHFFFAOYSA-N -1 1 301.239 4.091 20 0 DIADMM CSc1ccccc1CN(C)Cc1cccc([O-])c1Cl ZINC000513344089 1042535828 /nfs/dbraw/zinc/53/58/28/1042535828.db2.gz VCQYSWFPRDSRSK-UHFFFAOYSA-N -1 1 307.846 4.400 20 0 DIADMM CCOc1cc(-c2noc(C3CC4(CC4)C3)n2)cc(Cl)c1[O-] ZINC000664843985 1042977418 /nfs/dbraw/zinc/97/74/18/1042977418.db2.gz CJNIDJNFAYJFFV-UHFFFAOYSA-N -1 1 320.776 4.152 20 0 DIADMM CCOc1cc(-c2noc([C@H]3C[C@H]4C[C@H]4C3)n2)cc(Cl)c1[O-] ZINC000664847165 1042978494 /nfs/dbraw/zinc/97/84/94/1042978494.db2.gz WINVAAFCNBIYBG-JZYVYDRUSA-N -1 1 320.776 4.008 20 0 DIADMM CCCCN(C(=O)c1ncccc1[O-])[C@H](CC)c1ccccc1 ZINC000427463066 1042988884 /nfs/dbraw/zinc/98/88/84/1042988884.db2.gz QJSFTBVPDIAORA-MRXNPFEDSA-N -1 1 312.413 4.181 20 0 DIADMM CSc1ccc([O-])c(-c2nc([C@@H]3CCC[C@@H]4C[C@@H]43)no2)c1 ZINC000664915880 1042994628 /nfs/dbraw/zinc/99/46/28/1042994628.db2.gz ITNYJWDENQKJKQ-JLLWLGSASA-N -1 1 302.399 4.068 20 0 DIADMM O=C([O-])CC[C@H]1CCCCN1Cc1ccc(Cl)c(Cl)c1 ZINC000050924535 1043063666 /nfs/dbraw/zinc/06/36/66/1043063666.db2.gz LDHKJHFKVJHFOO-GFCCVEGCSA-N -1 1 316.228 4.213 20 0 DIADMM COc1cc(-c2nc([C@@H]3CCC[C@H](C)C3)no2)cc(Cl)c1[O-] ZINC000443224746 1043515805 /nfs/dbraw/zinc/51/58/05/1043515805.db2.gz PDPYQMKBKBKVQX-VHSXEESVSA-N -1 1 322.792 4.398 20 0 DIADMM C[C@@H](c1cc2ccccc2o1)N(C)C(=O)c1cc(F)ccc1[O-] ZINC000093923164 1043591047 /nfs/dbraw/zinc/59/10/47/1043591047.db2.gz KUMHWSGZKBYLQX-NSHDSACASA-N -1 1 313.328 4.111 20 0 DIADMM Cc1cc(C)cc(-c2ccc(C=C3SC(=O)[N-]C3=O)cc2)c1 ZINC000874927257 1043606544 /nfs/dbraw/zinc/60/65/44/1043606544.db2.gz FZACUYPKVNEDOJ-MHWRWJLKSA-N -1 1 309.390 4.294 20 0 DIADMM CC(C)(C)c1csc(C(=O)[N-]c2c(F)cc(F)cc2F)n1 ZINC000875381226 1043622024 /nfs/dbraw/zinc/62/20/24/1043622024.db2.gz XQIOBARKDCPUSK-UHFFFAOYSA-N -1 1 314.332 4.110 20 0 DIADMM O=C(Nc1ccc([O-])c(Cl)c1)[C@H]1C[C@H]1c1ccc(F)cc1F ZINC000113460982 1043641460 /nfs/dbraw/zinc/64/14/60/1043641460.db2.gz NCOQMTCONJPBOV-RYUDHWBXSA-N -1 1 323.726 4.066 20 0 DIADMM Cc1ccc(-c2ccc(C=C3SC(=O)[N-]C3=O)s2)cc1 ZINC000147721724 1043738477 /nfs/dbraw/zinc/73/84/77/1043738477.db2.gz LTRNNMQSABKYNS-MDWZMJQESA-N -1 1 301.392 4.047 20 0 DIADMM C[C@H](C(=O)[N-]OC1CCCCC1)c1ccccc1C(F)(F)F ZINC000777961949 1043995730 /nfs/dbraw/zinc/99/57/30/1043995730.db2.gz PLJZVWSGLCHKLN-NSHDSACASA-N -1 1 315.335 4.189 20 0 DIADMM O=c1cc(C(F)F)nc(SCc2ccc(F)cc2Cl)[n-]1 ZINC000562044047 1044053785 /nfs/dbraw/zinc/05/37/85/1044053785.db2.gz YOXAIDDABJGQEB-UHFFFAOYSA-N -1 1 320.723 4.205 20 0 DIADMM Cc1nc(C(C)C)oc1-c1nc(-c2ccc([O-])cc2Cl)no1 ZINC000291880036 1044112093 /nfs/dbraw/zinc/11/20/93/1044112093.db2.gz JLXMEXVIGVOGQH-UHFFFAOYSA-N -1 1 319.748 4.182 20 0 DIADMM CCc1noc(C)c1-c1noc(-c2ccc3ccccc3c2[O-])n1 ZINC000562561843 1044129590 /nfs/dbraw/zinc/12/95/90/1044129590.db2.gz LNFGHIOVDLNXPD-UHFFFAOYSA-N -1 1 321.336 4.121 20 0 DIADMM O=C(Nc1ccc([O-])c(Cl)c1)c1ccccc1OC1CCC1 ZINC000129618782 1044167179 /nfs/dbraw/zinc/16/71/79/1044167179.db2.gz IMNURZGXCCUZCJ-UHFFFAOYSA-N -1 1 317.772 4.229 20 0 DIADMM CCC1(C(=O)Nc2ccc(-c3cc(=O)[nH][n-]3)cc2)CCCCC1 ZINC000359825834 1044205043 /nfs/dbraw/zinc/20/50/43/1044205043.db2.gz GEQPDDTYBLTFLL-UHFFFAOYSA-N -1 1 313.401 4.081 20 0 DIADMM Cc1c2ccccc2nc(CN(C)[C@@H](C)c2ccco2)c1C(=O)[O-] ZINC000565103022 1044415191 /nfs/dbraw/zinc/41/51/91/1044415191.db2.gz LGVANKHEWXWQPV-ZDUSSCGKSA-N -1 1 324.380 4.027 20 0 DIADMM CC(C)c1scnc1[N-]C(=O)c1c(F)c(F)cc(F)c1F ZINC000565268738 1044423154 /nfs/dbraw/zinc/42/31/54/1044423154.db2.gz CTRKQQGDPNDRTQ-UHFFFAOYSA-N -1 1 318.295 4.075 20 0 DIADMM C[C@H]([NH2+]Cc1ncccc1O)c1cc(F)c(Cl)cc1Cl ZINC000565567015 1044442679 /nfs/dbraw/zinc/44/26/79/1044442679.db2.gz RFGHHTIZSSTNSE-QMMMGPOBSA-N -1 1 315.175 4.084 20 0 DIADMM C[C@@H](NC(=O)c1c(F)ccc([O-])c1F)c1cccc(C2CC2)c1 ZINC000295592257 1044544568 /nfs/dbraw/zinc/54/45/68/1044544568.db2.gz OIRAYDRENPGRKA-SNVBAGLBSA-N -1 1 317.335 4.039 20 0 DIADMM Cc1ccc(C(=O)Nc2cc(F)c([O-])cc2Cl)c(C2CC2)n1 ZINC000885677907 1044585065 /nfs/dbraw/zinc/58/50/65/1044585065.db2.gz CSCUVJGSLPCEAV-UHFFFAOYSA-N -1 1 320.751 4.018 20 0 DIADMM O=C1[N-]C(=S)SC1=Cc1ccc(CSC(F)F)o1 ZINC000043078783 1044656813 /nfs/dbraw/zinc/65/68/13/1044656813.db2.gz PRUARROSAJBIII-CLTKARDFSA-N -1 1 307.368 4.065 20 0 DIADMM [O-]c1ccc(-c2noc(/C=C\c3ccsc3)n2)c(Cl)c1 ZINC000445448799 1044719783 /nfs/dbraw/zinc/71/97/83/1044719783.db2.gz MKLHSFOKJLOKSF-RJRFIUFISA-N -1 1 304.758 4.328 20 0 DIADMM C[C@@H](Cc1nc(-c2ccc([O-])c(F)c2)no1)c1ccccc1F ZINC000445477718 1044729942 /nfs/dbraw/zinc/72/99/42/1044729942.db2.gz PCNOLWRELIIMCE-JTQLQIEISA-N -1 1 316.307 4.067 20 0 DIADMM C/C(=C\c1nc(-c2ccc([O-])c(F)c2)no1)c1ccc(F)cc1 ZINC000445477353 1044730262 /nfs/dbraw/zinc/73/02/62/1044730262.db2.gz NKZQGMNBOFPIMX-CSKARUKUSA-N -1 1 314.291 4.281 20 0 DIADMM C[C@H](Cc1nc(-c2ccc([O-])c(F)c2)no1)c1cccc(F)c1 ZINC000445478658 1044730340 /nfs/dbraw/zinc/73/03/40/1044730340.db2.gz HRZKBJZWGSRJTA-SNVBAGLBSA-N -1 1 316.307 4.067 20 0 DIADMM C[C@H](Sc1ccccc1)c1nc(-c2ccc([O-])c(F)c2)no1 ZINC000445479333 1044730375 /nfs/dbraw/zinc/73/03/75/1044730375.db2.gz VPBGPGZFOSZUMO-JTQLQIEISA-N -1 1 316.357 4.435 20 0 DIADMM [O-]c1ccc(-c2noc(Cc3ccc4ccccc4c3)n2)cc1F ZINC000445478617 1044730671 /nfs/dbraw/zinc/73/06/71/1044730671.db2.gz HOGCDVSOLHNBFK-UHFFFAOYSA-N -1 1 320.323 4.325 20 0 DIADMM [O-]c1ccc(-c2noc(-c3cc(F)cc(Cl)c3)n2)cc1F ZINC000445484101 1044732373 /nfs/dbraw/zinc/73/23/73/1044732373.db2.gz VMISNZXTFVFHEI-UHFFFAOYSA-N -1 1 308.671 4.041 20 0 DIADMM [O-]c1ccc(-c2noc(C3(c4ccccc4)CCC3)n2)cc1F ZINC000445484055 1044733077 /nfs/dbraw/zinc/73/30/77/1044733077.db2.gz VQQYCWYROUZPDF-UHFFFAOYSA-N -1 1 310.328 4.051 20 0 DIADMM Cc1c(=O)[n-]c(S[C@@H]2CC[C@@H](C)C2)nc1-c1ccccc1 ZINC000575198441 1044990659 /nfs/dbraw/zinc/99/06/59/1044990659.db2.gz JLNCVYMQYAMKRU-BXUZGUMPSA-N -1 1 300.427 4.438 20 0 DIADMM CCCc1nc(-c2nc(=O)c3c(C(C)C)csc3[n-]2)co1 ZINC000576456270 1045058971 /nfs/dbraw/zinc/05/89/71/1045058971.db2.gz FMYRGPIFNJTIDH-UHFFFAOYSA-N -1 1 303.387 4.128 20 0 DIADMM CCc1ccc(C([O-])=C(C#N)c2ccc3ccccc3n2)s1 ZINC000048854697 1045279242 /nfs/dbraw/zinc/27/92/42/1045279242.db2.gz PCBSWCDRWSOTGY-AWEZNQCLSA-N -1 1 306.390 4.349 20 0 DIADMM CCc1ccc(C([O-])=C(C#N)c2ccc3ccccc3n2)s1 ZINC000048854700 1045279939 /nfs/dbraw/zinc/27/99/39/1045279939.db2.gz PCBSWCDRWSOTGY-CQSZACIVSA-N -1 1 306.390 4.349 20 0 DIADMM Cc1cccc(C)c1[N-]S(=O)(=O)c1cccc(C(F)F)c1 ZINC000780364924 1045317482 /nfs/dbraw/zinc/31/74/82/1045317482.db2.gz HFTGZJWDXLBQLB-UHFFFAOYSA-N -1 1 311.353 4.042 20 0 DIADMM C[C@]1(C(=O)Nc2cc(Cl)c([O-])c3ccccc23)CC1(F)F ZINC000529538693 1045491099 /nfs/dbraw/zinc/49/10/99/1045491099.db2.gz JTMYUXISWXLVTN-CQSZACIVSA-N -1 1 311.715 4.183 20 0 DIADMM C/C(=C/C(=O)Nc1c([O-])cccc1F)c1cccc(Cl)c1 ZINC000750240949 1045517097 /nfs/dbraw/zinc/51/70/97/1045517097.db2.gz AQBQSWLBQYZKJX-NTMALXAHSA-N -1 1 305.736 4.227 20 0 DIADMM O=C(Nc1cc(Cl)c([O-])c2ccccc12)[C@H]1C[C@H]2C[C@H]2C1 ZINC000628233683 1045549814 /nfs/dbraw/zinc/54/98/14/1045549814.db2.gz PTSFCCNQQDIIAA-URLYPYJESA-N -1 1 301.773 4.183 20 0 DIADMM O=C(c1c([O-])cccc1Cl)N1CCC[C@@H]1C1CCCCC1 ZINC001626154405 1045562940 /nfs/dbraw/zinc/56/29/40/1045562940.db2.gz LJHOPNQYFZBONQ-CQSZACIVSA-N -1 1 307.821 4.231 20 0 DIADMM CC(C)(C)O[C@H](C(=O)Nc1cccc(F)c1[O-])c1ccccc1 ZINC000530004127 1045579101 /nfs/dbraw/zinc/57/91/01/1045579101.db2.gz BKUAPAYISTUQKY-INIZCTEOSA-N -1 1 317.360 4.026 20 0 DIADMM Cc1sc([C@H](C)NCc2ccccc2C(C)C)nc1C(=O)[O-] ZINC000900078226 1045598294 /nfs/dbraw/zinc/59/82/94/1045598294.db2.gz IPUGDUUJDAGRNI-NSHDSACASA-N -1 1 318.442 4.124 20 0 DIADMM CCCc1ccc(CN[C@@H](C)c2nc(C(=O)[O-])c(C)s2)s1 ZINC000900077075 1045598902 /nfs/dbraw/zinc/59/89/02/1045598902.db2.gz ALYNMXHQDQYZSU-VIFPVBQESA-N -1 1 324.471 4.015 20 0 DIADMM C[C@H]1[C@@H](c2ccccc2)CCN1C(=O)c1c([O-])cccc1Cl ZINC000751426304 1045605479 /nfs/dbraw/zinc/60/54/79/1045605479.db2.gz QHCVTOGZCNXMRS-JSGCOSHPSA-N -1 1 315.800 4.064 20 0 DIADMM Cc1nc2ccc(NCc3c([O-])ccc(Cl)c3F)cc2o1 ZINC000191380272 1045691555 /nfs/dbraw/zinc/69/15/55/1045691555.db2.gz TZWPBDZAGGHDSB-UHFFFAOYSA-N -1 1 306.724 4.246 20 0 DIADMM CCCCC/C(=C/c1ccccc1)CN1CC[C@@](F)(C(=O)[O-])C1 ZINC000901515463 1045754104 /nfs/dbraw/zinc/75/41/04/1045754104.db2.gz MPLRGTYZRATYCK-LYDJUCFBSA-N -1 1 319.420 4.149 20 0 DIADMM CC[C@@H](C)[C@@H](NCc1ccc(-c2ccc(Cl)cc2)o1)C(=O)[O-] ZINC000630478593 1045765483 /nfs/dbraw/zinc/76/54/83/1045765483.db2.gz AUNZHKIFUWVWRX-BDJLRTHQSA-N -1 1 321.804 4.189 20 0 DIADMM Cc1cc(C)c(/C=C\CN[C@H](C(=O)[O-])c2cccs2)cc1C ZINC000901598698 1045775165 /nfs/dbraw/zinc/77/51/65/1045775165.db2.gz PVXBCCFFNBMYIH-AATOQMJSSA-N -1 1 315.438 4.102 20 0 DIADMM O=C(Cc1ccc([O-])c(Cl)c1)N1CCC[C@H]1c1ccsc1 ZINC000630744931 1045777668 /nfs/dbraw/zinc/77/76/68/1045777668.db2.gz AYPHQVFRCLBURV-AWEZNQCLSA-N -1 1 321.829 4.013 20 0 DIADMM Cc1conc1C(=O)[N-]c1cc(Cl)ccc1SC(C)C ZINC000630929743 1045792142 /nfs/dbraw/zinc/79/21/42/1045792142.db2.gz WACMSPJLENJZAI-UHFFFAOYSA-N -1 1 310.806 4.389 20 0 DIADMM CCCCC[C@@H](NCc1ccc(-c2ccc(F)cc2)o1)C(=O)[O-] ZINC000901722688 1045797100 /nfs/dbraw/zinc/79/71/00/1045797100.db2.gz BXRHNOWEJVIPBA-MRXNPFEDSA-N -1 1 319.376 4.209 20 0 DIADMM Cc1nc(S[C@H](C)c2ccc(F)c(F)c2)[n-]c(=O)c1C1CC1 ZINC000631024423 1045797897 /nfs/dbraw/zinc/79/78/97/1045797897.db2.gz SNUCLKIUKIHBMN-SECBINFHSA-N -1 1 322.380 4.500 20 0 DIADMM CCCCC[C@H](NCc1ccc(-c2ccccc2)o1)C(=O)[O-] ZINC000901722787 1045798638 /nfs/dbraw/zinc/79/86/38/1045798638.db2.gz DKEQLHJKMBASHS-INIZCTEOSA-N -1 1 301.386 4.070 20 0 DIADMM COc1cccc([C@H](C)Sc2nc(C)c(C3CC3)c(=O)[n-]2)c1 ZINC000631023628 1045798767 /nfs/dbraw/zinc/79/87/67/1045798767.db2.gz CKECLUWKWCOOMF-NSHDSACASA-N -1 1 316.426 4.230 20 0 DIADMM Cc1cc(CNC/C=C\c2cc(C)c(C)cc2C)oc1C(=O)[O-] ZINC000901938330 1045873532 /nfs/dbraw/zinc/87/35/32/1045873532.db2.gz NDWNAPVZPVMAGN-WAYWQWQTSA-N -1 1 313.397 4.014 20 0 DIADMM O=C(Nc1ccc([O-])c(Cl)c1)[C@H]1CC[C@@H]1c1ccc(F)cc1 ZINC001137674423 1045929908 /nfs/dbraw/zinc/92/99/08/1045929908.db2.gz TXOQFGUUPPJRBV-KGLIPLIRSA-N -1 1 319.763 4.317 20 0 DIADMM CC(C)Sc1ccc([C@H](C)NCc2ccc(C(=O)[O-])o2)cc1 ZINC000902221181 1045948670 /nfs/dbraw/zinc/94/86/70/1045948670.db2.gz OMCYUOLJTLOFPH-LBPRGKRZSA-N -1 1 319.426 4.329 20 0 DIADMM CCSc1ccc([C@H](C)NCc2cc(C)c(C(=O)[O-])o2)cc1 ZINC000902221133 1045948715 /nfs/dbraw/zinc/94/87/15/1045948715.db2.gz MSNQEDCHOUWGNL-LBPRGKRZSA-N -1 1 319.426 4.249 20 0 DIADMM CC(C)Sc1ccc([C@@H](C)NCc2cc(C(=O)[O-])co2)cc1 ZINC000902222244 1045949739 /nfs/dbraw/zinc/94/97/39/1045949739.db2.gz XWAORCKPPNRABP-GFCCVEGCSA-N -1 1 319.426 4.329 20 0 DIADMM CCc1oc(CN[C@@H]2CC(C)(C)c3ccccc32)cc1C(=O)[O-] ZINC000902263559 1045959277 /nfs/dbraw/zinc/95/92/77/1045959277.db2.gz WPSCUWLLOYOFMK-MRXNPFEDSA-N -1 1 313.397 4.052 20 0 DIADMM CC(C)[C@H](NCc1ccoc1C(=O)[O-])c1ccccc1Cl ZINC000902267809 1045960279 /nfs/dbraw/zinc/96/02/79/1045960279.db2.gz DYILVIBTHLPIKQ-AWEZNQCLSA-N -1 1 307.777 4.118 20 0 DIADMM CC(F)(F)C(C)(C)c1nc(-c2ccc([O-])cc2Cl)no1 ZINC000453186404 1045972441 /nfs/dbraw/zinc/97/24/41/1045972441.db2.gz ZRYOZYAGRUFSKP-UHFFFAOYSA-N -1 1 302.708 4.028 20 0 DIADMM CCc1oc(CN[C@@H](C)c2ccccc2SC)cc1C(=O)[O-] ZINC000902379464 1045985858 /nfs/dbraw/zinc/98/58/58/1045985858.db2.gz DWKWSUSGWDCPOR-NSHDSACASA-N -1 1 319.426 4.113 20 0 DIADMM CC(C)[C@H]1CCc2[n-]n(Cc3cccc4cccnc43)c(=O)c2C1 ZINC000634592676 1046078386 /nfs/dbraw/zinc/07/83/86/1046078386.db2.gz QULPUDAORXCMAF-RDJZCZTQSA-N -1 1 321.424 4.005 20 0 DIADMM CC(C)[C@H]1CCc2[n-]n(Cc3cnc4ccccc4c3)c(=O)c2C1 ZINC000634618157 1046080102 /nfs/dbraw/zinc/08/01/02/1046080102.db2.gz IOSLFVYZUBXSQQ-RDJZCZTQSA-N -1 1 321.424 4.005 20 0 DIADMM CC(C)[C@@H]1CCc2[n-]n(Cc3cnc4ccccc4c3)c(=O)c2C1 ZINC000634618156 1046081045 /nfs/dbraw/zinc/08/10/45/1046081045.db2.gz IOSLFVYZUBXSQQ-NVXWUHKLSA-N -1 1 321.424 4.005 20 0 DIADMM CC(C)C[C@@H](C(=O)Nc1nc(Cl)ccc1[O-])c1ccccc1 ZINC001161179789 1046109338 /nfs/dbraw/zinc/10/93/38/1046109338.db2.gz TYQJDIOHNSFQAY-CYBMUJFWSA-N -1 1 318.804 4.209 20 0 DIADMM CC[C@]1(C(=O)[O-])CCC[N@@H+](Cc2cccc(Cl)c2Cl)C1 ZINC000086784305 1046164491 /nfs/dbraw/zinc/16/44/91/1046164491.db2.gz MYEJUVFKCWVASP-HNNXBMFYSA-N -1 1 316.228 4.070 20 0 DIADMM Cc1cc(NC(=O)Cc2ccc([O-])c(Cl)c2)ccc1C1CC1 ZINC001138409201 1046170188 /nfs/dbraw/zinc/17/01/88/1046170188.db2.gz LVBQGKOKXDDOFG-UHFFFAOYSA-N -1 1 315.800 4.413 20 0 DIADMM O=C1c2cc(F)ccc2OCC/C1=C/c1ccc([O-])c(Cl)c1 ZINC000207716031 1046200264 /nfs/dbraw/zinc/20/02/64/1046200264.db2.gz NJOOFDADIHMWBP-XFFZJAGNSA-N -1 1 318.731 4.234 20 0 DIADMM CN(C(=O)c1c([O-])cccc1Cl)C(C)(C)c1ccccc1 ZINC000803615709 1046286099 /nfs/dbraw/zinc/28/60/99/1046286099.db2.gz DAJXFVQMNOTEHG-UHFFFAOYSA-N -1 1 303.789 4.053 20 0 DIADMM CCCN1C(=O)c2ccccc2N[C@@H]1c1cccc([O-])c1Cl ZINC000639431331 1046399373 /nfs/dbraw/zinc/39/93/73/1046399373.db2.gz PBVBZSHMSPVFBE-INIZCTEOSA-N -1 1 316.788 4.022 20 0 DIADMM O=C(Nc1ccc(Cl)cc1[O-])c1cc2cccc(F)c2o1 ZINC000677213258 1046474698 /nfs/dbraw/zinc/47/46/98/1046474698.db2.gz NJJWYPTWXVPGNT-UHFFFAOYSA-N -1 1 305.692 4.183 20 0 DIADMM C[C@H](Cc1cccc(Cl)c1)C(=O)Nc1c([O-])cccc1F ZINC000677405236 1046494788 /nfs/dbraw/zinc/49/47/88/1046494788.db2.gz VKGUGFVCVXZEOO-SNVBAGLBSA-N -1 1 307.752 4.002 20 0 DIADMM COCOc1cccc(Nc2c(Cl)ccc([O-])c2Cl)c1 ZINC001212901197 1046502875 /nfs/dbraw/zinc/50/28/75/1046502875.db2.gz UNTIGWWALCHWBE-UHFFFAOYSA-N -1 1 314.168 4.425 20 0 DIADMM O=C(c1ccc2ccccc2c1[O-])N(C1CC1)C1CCCCC1 ZINC000642061609 1046552391 /nfs/dbraw/zinc/55/23/91/1046552391.db2.gz FHOMHRAUIOGSMV-UHFFFAOYSA-N -1 1 309.409 4.483 20 0 DIADMM O=C(c1ccc2ccccc2c1[O-])N1CC[C@@H]1c1cccc(F)c1 ZINC000678314020 1046618040 /nfs/dbraw/zinc/61/80/40/1046618040.db2.gz PIVBHQONCTZMRF-GOSISDBHSA-N -1 1 321.351 4.272 20 0 DIADMM COc1ccc(Nc2ccc(F)c(F)c2[O-])cc1OC(C)C ZINC001203020546 1046641105 /nfs/dbraw/zinc/64/11/05/1046641105.db2.gz ZWFSZJMYKBRELU-UHFFFAOYSA-N -1 1 309.312 4.210 20 0 DIADMM O=C([O-])c1ccccc1CN1CCC[C@@H]1c1c(F)cccc1F ZINC001140503288 1046756125 /nfs/dbraw/zinc/75/61/25/1046756125.db2.gz TWNXOZUSMSSHCQ-MRXNPFEDSA-N -1 1 317.335 4.000 20 0 DIADMM Cn1nc(C2CCCCC2)cc1NCc1cccc([O-])c1Cl ZINC000645163895 1046772052 /nfs/dbraw/zinc/77/20/52/1046772052.db2.gz RDNAZZPDBLURII-UHFFFAOYSA-N -1 1 319.836 4.439 20 0 DIADMM Cn1ccnc1-c1cccc(NCc2cccc([O-])c2Cl)c1 ZINC000645165910 1046774140 /nfs/dbraw/zinc/77/41/40/1046774140.db2.gz TYFUYSOSNZKEFV-UHFFFAOYSA-N -1 1 313.788 4.058 20 0 DIADMM COc1c2ccccc2oc1CNCc1cccc([O-])c1Cl ZINC000645176864 1046774767 /nfs/dbraw/zinc/77/47/67/1046774767.db2.gz JWGYIWHLZQTPOH-UHFFFAOYSA-N -1 1 317.772 4.090 20 0 DIADMM CC(C)Sc1ccc(C(=O)Nc2ccc([O-])c(F)c2F)cc1 ZINC001140652136 1046834014 /nfs/dbraw/zinc/83/40/14/1046834014.db2.gz GXPHWBUKDZOYQE-UHFFFAOYSA-N -1 1 323.364 4.423 20 0 DIADMM CC1(C)CCCC[C@H]1NC(=O)c1ccc(C(F)(F)F)c([O-])c1 ZINC001137373435 1046841835 /nfs/dbraw/zinc/84/18/35/1046841835.db2.gz ZEBFIDPDUITGAV-CYBMUJFWSA-N -1 1 315.335 4.110 20 0 DIADMM C[C@H]1c2ccccc2OCCN1Cc1cccc([O-])c1Cl ZINC000646064433 1046853312 /nfs/dbraw/zinc/85/33/12/1046853312.db2.gz HMZWHSIWSLYTSP-LBPRGKRZSA-N -1 1 303.789 4.001 20 0 DIADMM Cc1cccc(C2(C(=O)Nc3ccc([O-])c(Cl)c3)CCC2)c1 ZINC000679643988 1046886830 /nfs/dbraw/zinc/88/68/30/1046886830.db2.gz MXXCBWNERLJQFC-UHFFFAOYSA-N -1 1 315.800 4.414 20 0 DIADMM COc1ccc([C@H]2CCCN2Cc2ccc([O-])c(F)c2F)cc1 ZINC001140893079 1046943205 /nfs/dbraw/zinc/94/32/05/1046943205.db2.gz FFFRMWHTXZQASG-OAHLLOKOSA-N -1 1 319.351 4.016 20 0 DIADMM Cc1ccccc1[C@@H]1CCC[N@H+]1Cc1ccc(O)c(F)c1F ZINC001140887947 1046943533 /nfs/dbraw/zinc/94/35/33/1046943533.db2.gz JVQJKNXIQFZHNE-HNNXBMFYSA-N -1 1 303.352 4.316 20 0 DIADMM O=C(Nc1cccc(F)c1[O-])c1cc(C2CC2)oc1C1CC1 ZINC000827448170 1046992946 /nfs/dbraw/zinc/99/29/46/1046992946.db2.gz POVQJEFFBKDXCX-UHFFFAOYSA-N -1 1 301.317 4.131 20 0 DIADMM Cc1ccsc1S(=O)(=O)[N-]c1c(C)cc(C)cc1Cl ZINC000680854816 1047054909 /nfs/dbraw/zinc/05/49/09/1047054909.db2.gz BOMCYCHCOZMKPQ-UHFFFAOYSA-N -1 1 315.847 4.128 20 0 DIADMM O=C(Nc1ccc(Cl)c(Cl)c1)c1ccc([O-])c(F)c1 ZINC000681015185 1047081592 /nfs/dbraw/zinc/08/15/92/1047081592.db2.gz LZEOJQAIVCCEKO-UHFFFAOYSA-N -1 1 300.116 4.090 20 0 DIADMM Cc1ccc(NC(=O)c2ccc([O-])c(F)c2)cc1C(F)(F)F ZINC000681015698 1047081996 /nfs/dbraw/zinc/08/19/96/1047081996.db2.gz LOIGPNUDRCXCDW-UHFFFAOYSA-N -1 1 313.250 4.111 20 0 DIADMM O=C(Nc1ccccc1-c1ccccc1)c1ccc([O-])c(F)c1 ZINC000681015609 1047083234 /nfs/dbraw/zinc/08/32/34/1047083234.db2.gz HSKRVKMOGPIQNN-UHFFFAOYSA-N -1 1 307.324 4.451 20 0 DIADMM O=C(c1ccc([O-])c(F)c1)N1CCC[C@@H]1CC1CCCCC1 ZINC000681036963 1047084247 /nfs/dbraw/zinc/08/42/47/1047084247.db2.gz JWDHVQMBXKMBOW-OAHLLOKOSA-N -1 1 305.393 4.106 20 0 DIADMM O=C(N[C@H](c1ccccc1)C1CCCC1)c1ccc([O-])c(F)c1 ZINC000681018433 1047084648 /nfs/dbraw/zinc/08/46/48/1047084648.db2.gz BTWWDJKCPOPOJG-GOSISDBHSA-N -1 1 313.372 4.193 20 0 DIADMM Cc1c(=O)[n-]c(S[C@H](C)c2ccncc2)nc1-c1ccccc1 ZINC000681023331 1047084717 /nfs/dbraw/zinc/08/47/17/1047084717.db2.gz HHHBYOIRZMGTJR-CYBMUJFWSA-N -1 1 323.421 4.406 20 0 DIADMM CC(C)CCc1ccccc1NC(=O)c1ccc([O-])c(F)c1 ZINC000681036820 1047085864 /nfs/dbraw/zinc/08/58/64/1047085864.db2.gz BQINDDKXDJRKSM-UHFFFAOYSA-N -1 1 301.361 4.372 20 0 DIADMM Cc1ccc([C@H]2C[C@H](C)CCN2C(=O)c2ccc([O-])c(F)c2)o1 ZINC000681052324 1047086545 /nfs/dbraw/zinc/08/65/45/1047086545.db2.gz ONPWNWPYBHXSSL-IAQYHMDHSA-N -1 1 317.360 4.046 20 0 DIADMM CC[C@H](NC(=O)c1ccc([O-])c(F)c1)C(C)(C)c1ccccc1 ZINC000681050143 1047087069 /nfs/dbraw/zinc/08/70/69/1047087069.db2.gz WMZCPMHKXWQHCE-KRWDZBQOSA-N -1 1 315.388 4.018 20 0 DIADMM CCCn1ccc2cc(NC(=O)c3ccc([O-])c(F)c3)ccc21 ZINC000681038006 1047087303 /nfs/dbraw/zinc/08/73/03/1047087303.db2.gz SYPSRWGWPGDTKP-UHFFFAOYSA-N -1 1 312.344 4.148 20 0 DIADMM CCC[C@H](NC(=O)c1ccc([O-])c(F)c1)c1ccc(F)cc1F ZINC000681056177 1047089683 /nfs/dbraw/zinc/08/96/83/1047089683.db2.gz WCJXBOSZVKIMRX-HNNXBMFYSA-N -1 1 323.314 4.081 20 0 DIADMM O=C(N[C@H](C1CCC1)C1CCCCC1)c1c(F)ccc([O-])c1F ZINC000649111963 1047106354 /nfs/dbraw/zinc/10/63/54/1047106354.db2.gz ITXBRUDKKDGNDA-KRWDZBQOSA-N -1 1 323.383 4.149 20 0 DIADMM Cc1cc(C)c(CNC(=O)c2ccc3ccccc3c2[O-])c(C)c1 ZINC001141510359 1047152126 /nfs/dbraw/zinc/15/21/26/1047152126.db2.gz GYJQSARMUXTZIV-UHFFFAOYSA-N -1 1 319.404 4.401 20 0 DIADMM CC(C)CC1(CNC(=O)c2c(F)ccc([O-])c2F)CCCC1 ZINC000537286377 1047159116 /nfs/dbraw/zinc/15/91/16/1047159116.db2.gz WEGWKGGPASCLLE-UHFFFAOYSA-N -1 1 311.372 4.007 20 0 DIADMM CCCCN(CCCC)C(=O)c1ccc(C(F)(F)F)cc1[O-] ZINC001141679427 1047263025 /nfs/dbraw/zinc/26/30/25/1047263025.db2.gz YPWVNAAHJJGOCC-UHFFFAOYSA-N -1 1 317.351 4.453 20 0 DIADMM Cc1cc(F)cc(S(=O)(=O)[N-]c2ccccc2C(C)C)c1 ZINC000476247079 1047270903 /nfs/dbraw/zinc/27/09/03/1047270903.db2.gz CIXCBRJJEWDGPM-UHFFFAOYSA-N -1 1 307.390 4.058 20 0 DIADMM CC(C)[C@@H](C(=O)Nc1cc([O-])c(F)cc1F)c1ccccc1 ZINC001141834233 1047296400 /nfs/dbraw/zinc/29/64/00/1047296400.db2.gz XWVQJXXHGXHJFI-MRXNPFEDSA-N -1 1 305.324 4.049 20 0 DIADMM Cc1ccccc1[C@H]1CCCN1C(=O)c1c([O-])cccc1Cl ZINC001141948922 1047315328 /nfs/dbraw/zinc/31/53/28/1047315328.db2.gz FRDBPUPAEYIYOG-OAHLLOKOSA-N -1 1 315.800 4.331 20 0 DIADMM CC[C@@H](Cc1ccccc1C)C(=O)Nc1cc(F)cc(F)c1[O-] ZINC001142545887 1047329692 /nfs/dbraw/zinc/32/96/92/1047329692.db2.gz LQEKFTPVNJNMPL-LBPRGKRZSA-N -1 1 319.351 4.186 20 0 DIADMM CCCc1cc(=O)[n-]c(S[C@@H](C)c2ncc(C(C)(C)C)o2)n1 ZINC000476504080 1047452221 /nfs/dbraw/zinc/45/22/21/1047452221.db2.gz KCMGBGIMTVKLPV-JTQLQIEISA-N -1 1 321.446 4.274 20 0 DIADMM CCCn1ccc2cc(NC(=O)c3cc(F)ccc3[O-])ccc21 ZINC001142589289 1047471215 /nfs/dbraw/zinc/47/12/15/1047471215.db2.gz UVKMNGDOJIUONA-UHFFFAOYSA-N -1 1 312.344 4.148 20 0 DIADMM O=C(C[C@]12CCCC[C@H]1C2(F)F)Nc1ccc([O-])c(Cl)c1 ZINC000612760403 1047493823 /nfs/dbraw/zinc/49/38/23/1047493823.db2.gz VKOPUWOUVYZZHA-TZMCWYRMSA-N -1 1 315.747 4.200 20 0 DIADMM CC[C@@H](NC(=O)c1cc(Cl)ccc1[O-])c1ccc(C)cc1 ZINC001143083881 1047529219 /nfs/dbraw/zinc/52/92/19/1047529219.db2.gz IAZSMMRQISTLTD-OAHLLOKOSA-N -1 1 303.789 4.235 20 0 DIADMM O=C(Cc1ccc(F)c(Cl)c1)Nc1ccc([O-])c(Cl)c1 ZINC001151583396 1047598454 /nfs/dbraw/zinc/59/84/54/1047598454.db2.gz ZHXCNEVRYSXXNO-UHFFFAOYSA-N -1 1 314.143 4.019 20 0 DIADMM O=C(Nc1ccc([O-])c(Cl)c1)c1nc(Cl)sc1Cl ZINC001151582316 1047598627 /nfs/dbraw/zinc/59/86/27/1047598627.db2.gz FYFWTZAZWMSVOT-UHFFFAOYSA-N -1 1 323.588 4.061 20 0 DIADMM C/C(=C/c1cccc(Cl)c1)C(=O)Nc1cccc(F)c1[O-] ZINC001151771852 1047601411 /nfs/dbraw/zinc/60/14/11/1047601411.db2.gz NIWKVYMHRWARRR-NTMALXAHSA-N -1 1 305.736 4.227 20 0 DIADMM CC(C)(Cc1ccc(Cl)cc1)C(=O)Nc1cccc(F)c1[O-] ZINC001151779571 1047601756 /nfs/dbraw/zinc/60/17/56/1047601756.db2.gz GUQIYTCCOAOHKR-UHFFFAOYSA-N -1 1 321.779 4.392 20 0 DIADMM CC[C@H](NC(=O)c1c([O-])cccc1F)c1cc(C)ccc1C ZINC001151785731 1047601854 /nfs/dbraw/zinc/60/18/54/1047601854.db2.gz LGKZNKVNPPLZST-HNNXBMFYSA-N -1 1 301.361 4.029 20 0 DIADMM CCc1ccc([C@H](C)NC(=O)c2cc(Cl)ccc2[O-])cc1 ZINC001153155570 1047620916 /nfs/dbraw/zinc/62/09/16/1047620916.db2.gz AICHJWGZRWONCN-NSHDSACASA-N -1 1 303.789 4.099 20 0 DIADMM Cc1ccc(C(F)(F)C(=O)Nc2ccc(Cl)cc2[O-])cc1 ZINC001153460445 1047625311 /nfs/dbraw/zinc/62/53/11/1047625311.db2.gz FVROECMNMPKEMZ-UHFFFAOYSA-N -1 1 311.715 4.085 20 0 DIADMM O=C(Nc1nc(C2CC2)cs1)c1c([O-])ccc2ccccc21 ZINC001153497068 1047626096 /nfs/dbraw/zinc/62/60/96/1047626096.db2.gz BBQHVWNEFBOFGH-UHFFFAOYSA-N -1 1 310.378 4.132 20 0 DIADMM CC(C)c1cccnc1NC(=O)c1c(O)cc2ccccc2c1[O-] ZINC001154023132 1047637800 /nfs/dbraw/zinc/63/78/00/1047637800.db2.gz OCMFBPIRNVVQQO-UHFFFAOYSA-N -1 1 322.364 4.022 20 0 DIADMM CC(C)[C@H]1CCC[C@@H](NC(=O)c2c([O-])cccc2Cl)CC1 ZINC001154883080 1047660836 /nfs/dbraw/zinc/66/08/36/1047660836.db2.gz DEKVWRIUFPYPQY-QWHCGFSZSA-N -1 1 309.837 4.380 20 0 DIADMM CCN(C(=O)c1cc(SC)ccc1[O-])c1cccc(C)c1C ZINC000667109785 1047689461 /nfs/dbraw/zinc/68/94/61/1047689461.db2.gz MJDWGDMVZHJFIB-UHFFFAOYSA-N -1 1 315.438 4.398 20 0 DIADMM CCc1ccc([C@H](C)C(=O)Nc2cc(F)c([O-])cc2Cl)cc1 ZINC001157899666 1047763180 /nfs/dbraw/zinc/76/31/80/1047763180.db2.gz LZSVXQZXUVODGU-JTQLQIEISA-N -1 1 321.779 4.489 20 0 DIADMM O=C(Nc1cc(F)c([O-])cc1Cl)c1cccc(Cl)c1F ZINC001157899171 1047763264 /nfs/dbraw/zinc/76/32/64/1047763264.db2.gz AYEORQXNOCGDRE-UHFFFAOYSA-N -1 1 318.106 4.230 20 0 DIADMM O=C(Nc1ccc(F)cc1[O-])c1cc2sccc2nc1Cl ZINC001183054621 1047884945 /nfs/dbraw/zinc/88/49/45/1047884945.db2.gz QAAIMPOBMWKRHP-UHFFFAOYSA-N -1 1 322.748 4.047 20 0 DIADMM Cc1cccc(CC(=O)Nc2cccc(C(F)(F)F)c2[O-])c1C ZINC001183259638 1047913708 /nfs/dbraw/zinc/91/37/08/1047913708.db2.gz FRXSTMHEXPFDTJ-UHFFFAOYSA-N -1 1 323.314 4.209 20 0 DIADMM Cc1ccc(NC(=S)Nc2cc(F)c([O-])c(F)c2)c(C)c1 ZINC001197987122 1047916661 /nfs/dbraw/zinc/91/66/61/1047916661.db2.gz RFHQJPRNQYNHCO-UHFFFAOYSA-N -1 1 308.353 4.096 20 0 DIADMM Cc1ccc(NC(=S)Nc2cc(F)c(F)cc2[O-])c(C)c1 ZINC001197994637 1047917960 /nfs/dbraw/zinc/91/79/60/1047917960.db2.gz FVGVQJUUTPQUGI-UHFFFAOYSA-N -1 1 308.353 4.096 20 0 DIADMM Cc1ccc(NC(=S)Nc2cc(F)cc(F)c2[O-])c(C)c1 ZINC001197997610 1047918188 /nfs/dbraw/zinc/91/81/88/1047918188.db2.gz UURSQQZGLGEHIO-UHFFFAOYSA-N -1 1 308.353 4.096 20 0 DIADMM Cc1cccc(C)c1NC(=S)Nc1cc(F)c([O-])cc1F ZINC001198361428 1047952347 /nfs/dbraw/zinc/95/23/47/1047952347.db2.gz DSZLZHSRWXSCPA-UHFFFAOYSA-N -1 1 308.353 4.096 20 0 DIADMM O=c1ccn(-c2ccc(Nc3ccc(C(F)(F)F)cc3)cc2)[n-]1 ZINC001174775600 1047968899 /nfs/dbraw/zinc/96/88/99/1047968899.db2.gz YJSTVXDHBSEQFV-UHFFFAOYSA-N -1 1 319.286 4.340 20 0 DIADMM COc1ccc(C(F)(F)F)cc1Nc1cc(F)c([O-])c(F)c1 ZINC001174778717 1047970063 /nfs/dbraw/zinc/97/00/63/1047970063.db2.gz HZKUHCKCCCKGIP-UHFFFAOYSA-N -1 1 319.229 4.441 20 0 DIADMM [O-]c1cc(Nc2cncc(C(F)(F)F)c2)c(F)cc1Cl ZINC001174744036 1047973619 /nfs/dbraw/zinc/97/36/19/1047973619.db2.gz YIHAEZSYDQMFRC-UHFFFAOYSA-N -1 1 306.646 4.342 20 0 DIADMM Cc1cccc(Cl)c1NC(=O)Nc1cc(F)c([O-])c(F)c1 ZINC001184533794 1048049135 /nfs/dbraw/zinc/04/91/35/1048049135.db2.gz KPLRDFKEQRJSFH-UHFFFAOYSA-N -1 1 312.703 4.276 20 0 DIADMM Cc1cccc(Cl)c1NC(=O)Nc1cc(F)c([O-])cc1F ZINC001184540344 1048050220 /nfs/dbraw/zinc/05/02/20/1048050220.db2.gz FBIWJCQSCLBDGP-UHFFFAOYSA-N -1 1 312.703 4.276 20 0 DIADMM C[C@H]1CCC[C@H](C(=O)Nc2cccc(C(F)(F)F)c2[O-])C1 ZINC001184512504 1048054142 /nfs/dbraw/zinc/05/41/42/1048054142.db2.gz ODDBDNBRFWCTHP-UWVGGRQHSA-N -1 1 301.308 4.176 20 0 DIADMM CCc1ccc(C(=O)Nc2cc(-c3ccccc3)ns2)c([O-])c1 ZINC001160865040 1048092548 /nfs/dbraw/zinc/09/25/48/1048092548.db2.gz FGELLISBUKBLTI-UHFFFAOYSA-N -1 1 324.405 4.330 20 0 DIADMM C/C(=C\C(=O)Nc1cc([O-])c(F)cc1F)c1ccccc1C ZINC001160917909 1048097487 /nfs/dbraw/zinc/09/74/87/1048097487.db2.gz VTEBCVUUKVCFGU-YRNVUSSQSA-N -1 1 303.308 4.021 20 0 DIADMM CC(C)Sc1ccc(C(=O)Nc2cc([O-])c(F)cc2F)cc1 ZINC001160917355 1048098052 /nfs/dbraw/zinc/09/80/52/1048098052.db2.gz ROSKOLXEGZWFRP-UHFFFAOYSA-N -1 1 323.364 4.423 20 0 DIADMM COc1cc(Nc2cc(Cl)c([O-])cc2Cl)cc(OC)c1 ZINC001175111861 1048122240 /nfs/dbraw/zinc/12/22/40/1048122240.db2.gz XGVUHWXUGFQXRX-UHFFFAOYSA-N -1 1 314.168 4.460 20 0 DIADMM O=C(Nc1ccc(F)c(F)c1)Nc1cc([O-])c(Cl)cc1F ZINC001185090349 1048125243 /nfs/dbraw/zinc/12/52/43/1048125243.db2.gz VNTXOBYQCRKCIE-UHFFFAOYSA-N -1 1 316.666 4.107 20 0 DIADMM CCC[C@@H](NC(=O)c1ccc(C(F)(F)F)c([O-])c1)C1CCC1 ZINC001161465830 1048133101 /nfs/dbraw/zinc/13/31/01/1048133101.db2.gz GONAFTQDMPHANH-CYBMUJFWSA-N -1 1 315.335 4.110 20 0 DIADMM Cc1c(Cl)cc(Nc2cc(CO)ccc2F)c([O-])c1Cl ZINC001175133098 1048158209 /nfs/dbraw/zinc/15/82/09/1048158209.db2.gz MJNQKIIFZBCRIP-UHFFFAOYSA-N -1 1 316.159 4.382 20 0 DIADMM CCOc1ccc(Nc2ccc(-n3ccc(=O)[n-]3)cc2)cc1C ZINC001175171630 1048180492 /nfs/dbraw/zinc/18/04/92/1048180492.db2.gz ATSJOWYMHXXNGR-UHFFFAOYSA-N -1 1 309.369 4.029 20 0 DIADMM CCOc1ccc(F)c(F)c1[N-]c1nnc(C(C)(C)C)s1 ZINC001175281255 1048227815 /nfs/dbraw/zinc/22/78/15/1048227815.db2.gz ULDLDPRWNPTKAJ-UHFFFAOYSA-N -1 1 313.373 4.256 20 0 DIADMM [O-]c1c(Br)ccc(Cl)c1N=C1CCSCC1 ZINC001201346827 1048245632 /nfs/dbraw/zinc/24/56/32/1048245632.db2.gz IWXFIYZCGPAUEH-UHFFFAOYSA-N -1 1 320.639 4.241 20 0 DIADMM [O-]c1c(Br)ccc(Cl)c1NC1=CCSCC1 ZINC001201346827 1048245640 /nfs/dbraw/zinc/24/56/40/1048245640.db2.gz IWXFIYZCGPAUEH-UHFFFAOYSA-N -1 1 320.639 4.241 20 0 DIADMM Cc1c2cc(F)ccc2oc1C(=O)Nc1cc(F)cc(F)c1[O-] ZINC001162290649 1048257207 /nfs/dbraw/zinc/25/72/07/1048257207.db2.gz DYOMRVVRVOLSOV-UHFFFAOYSA-N -1 1 321.254 4.116 20 0 DIADMM [O-]c1ccc(F)c(Nc2nc(Cl)cnc2Cl)c1Cl ZINC001250230013 1048265270 /nfs/dbraw/zinc/26/52/70/1048265270.db2.gz QNYHCAIAJTUBAS-UHFFFAOYSA-N -1 1 308.527 4.025 20 0 DIADMM [O-]c1ccc(Cl)c(Nc2cnc3cccnc3c2)c1Cl ZINC001175359796 1048277117 /nfs/dbraw/zinc/27/71/17/1048277117.db2.gz YPKPEKATNGBWFI-UHFFFAOYSA-N -1 1 306.152 4.386 20 0 DIADMM O=C(Nc1ccc2sc(Cl)nc2c1)c1ccc([O-])cc1F ZINC001186329685 1048288610 /nfs/dbraw/zinc/28/86/10/1048288610.db2.gz ULHHNYOAPQMDPP-UHFFFAOYSA-N -1 1 322.748 4.047 20 0 DIADMM O=C(Nc1ccc([O-])c(Cl)c1)N[C@H]1CCCc2ccccc21 ZINC001186459078 1048311301 /nfs/dbraw/zinc/31/13/01/1048311301.db2.gz XKAIJKCPGGWNRN-HNNXBMFYSA-N -1 1 316.788 4.245 20 0 DIADMM C=Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2[O-])cc1 ZINC001186526002 1048314711 /nfs/dbraw/zinc/31/47/11/1048314711.db2.gz HLNIDMVSTWDQPM-UHFFFAOYSA-N -1 1 307.271 4.306 20 0 DIADMM CCOc1nccc([N-]c2nc(C(C)(C)C)ns2)c1Cl ZINC001250247237 1048321481 /nfs/dbraw/zinc/32/14/81/1048321481.db2.gz ZCASOCCZWYACMQ-UHFFFAOYSA-N -1 1 312.826 4.026 20 0 DIADMM CC(C)(C)OC(=O)c1cccc(Nc2ccc(F)c(F)c2[O-])c1 ZINC001175545034 1048333884 /nfs/dbraw/zinc/33/38/84/1048333884.db2.gz DWKQVAVBKCIWEY-UHFFFAOYSA-N -1 1 321.323 4.369 20 0 DIADMM Cn1cc2cccc(Nc3c(Cl)ccc([O-])c3Cl)c2n1 ZINC001175459509 1048334719 /nfs/dbraw/zinc/33/47/19/1048334719.db2.gz MTRPDPVMSMIZAR-UHFFFAOYSA-N -1 1 308.168 4.329 20 0 DIADMM CSc1cccc(NC(=O)Nc2ccc(Cl)cc2[O-])c1 ZINC001188047757 1048464025 /nfs/dbraw/zinc/46/40/25/1048464025.db2.gz QENMXGJDQCNOBT-UHFFFAOYSA-N -1 1 308.790 4.412 20 0 DIADMM CCCn1nc(C)cc1Nc1ccc(Cl)c(Cl)c1[O-] ZINC001175805343 1048464673 /nfs/dbraw/zinc/46/46/73/1048464673.db2.gz FQZIWKJJMUXFDR-UHFFFAOYSA-N -1 1 300.189 4.358 20 0 DIADMM CC(=O)OCc1cccc(C)c1Nc1cc([O-])c(Cl)cc1F ZINC001212771581 1048465852 /nfs/dbraw/zinc/46/58/52/1048465852.db2.gz ZELHDDCYZZLARA-UHFFFAOYSA-N -1 1 323.751 4.300 20 0 DIADMM CSc1ccc(NC(=O)Nc2ccc(Cl)cc2[O-])cc1 ZINC001188110432 1048477438 /nfs/dbraw/zinc/47/74/38/1048477438.db2.gz TWOPOVDEACCHGQ-UHFFFAOYSA-N -1 1 308.790 4.412 20 0 DIADMM CCCc1cc(=O)[n-]c(S[C@@H](CCOC)c2ccccc2)n1 ZINC001188161419 1048488670 /nfs/dbraw/zinc/48/86/70/1048488670.db2.gz AGFCWCPNWLRCET-HNNXBMFYSA-N -1 1 318.442 4.005 20 0 DIADMM O=C(Nc1cccc(F)c1)Nc1cc(Cl)c(Cl)cc1[O-] ZINC001202231094 1048497815 /nfs/dbraw/zinc/49/78/15/1048497815.db2.gz YPTVJTNCKVECDJ-UHFFFAOYSA-N -1 1 315.131 4.482 20 0 DIADMM CCc1cc(C)cc(CC)c1[N-]S(=O)(=O)c1cccc(F)c1 ZINC000481865265 1048508831 /nfs/dbraw/zinc/50/88/31/1048508831.db2.gz INHIRLQEAHNIOF-UHFFFAOYSA-N -1 1 321.417 4.060 20 0 DIADMM O=C(Nc1cccc(Cl)c1F)Nc1c(F)cc([O-])cc1F ZINC001188412342 1048513218 /nfs/dbraw/zinc/51/32/18/1048513218.db2.gz ZTMQUPJYISRBMU-UHFFFAOYSA-N -1 1 316.666 4.107 20 0 DIADMM c1coc(-c2nnc([N-]c3ccc(-c4ccccn4)cc3)o2)c1 ZINC001176037816 1048539588 /nfs/dbraw/zinc/53/95/88/1048539588.db2.gz YHPCYSRNRRBLHM-UHFFFAOYSA-N -1 1 304.309 4.135 20 0 DIADMM c1coc(-c2nnc([N-]c3cccc(OC4CCCC4)c3)o2)c1 ZINC001176097509 1048553279 /nfs/dbraw/zinc/55/32/79/1048553279.db2.gz OSWKCCNDZAAFKY-UHFFFAOYSA-N -1 1 311.341 4.395 20 0 DIADMM O=C(Nc1cc(Cl)ccc1Cl)Nc1c([O-])cccc1F ZINC001188993359 1048578336 /nfs/dbraw/zinc/57/83/36/1048578336.db2.gz SBPMXQFHPIZWTG-UHFFFAOYSA-N -1 1 315.131 4.482 20 0 DIADMM O=C(Nc1cccc(F)c1[O-])Nc1cc(Cl)ccc1Cl ZINC001188995678 1048579166 /nfs/dbraw/zinc/57/91/66/1048579166.db2.gz DJZQWDRXSZOUFT-UHFFFAOYSA-N -1 1 315.131 4.482 20 0 DIADMM Cc1nc(SC/C=C\c2ccc(Cl)cc2)[n-]c(=O)c1C ZINC001189062498 1048588523 /nfs/dbraw/zinc/58/85/23/1048588523.db2.gz XILJESCVPDESHH-ARJAWSKDSA-N -1 1 306.818 4.258 20 0 DIADMM CCCOc1ccc(Nc2ccc(F)c(F)c2[O-])c(F)c1F ZINC001203697028 1048592715 /nfs/dbraw/zinc/59/27/15/1048592715.db2.gz ZLISARVASNKRHF-UHFFFAOYSA-N -1 1 315.266 4.481 20 0 DIADMM Cc1cccc(-c2nsc([N-]c3cnn(C4CCC4)c3)n2)c1 ZINC001164233966 1048610843 /nfs/dbraw/zinc/61/08/43/1048610843.db2.gz FRVAVBYVUTXAQJ-UHFFFAOYSA-N -1 1 311.414 4.179 20 0 DIADMM CCCCOc1ccc(NC(=O)Nc2ccc(F)cc2[O-])cc1 ZINC001189314800 1048617208 /nfs/dbraw/zinc/61/72/08/1048617208.db2.gz XAPLENDITIWJML-UHFFFAOYSA-N -1 1 318.348 4.354 20 0 DIADMM COc1ccc(Nc2cc(F)c([O-])cc2F)c(C(F)(F)F)c1 ZINC001213050948 1048617602 /nfs/dbraw/zinc/61/76/02/1048617602.db2.gz VWPTYWOXZDNPKY-UHFFFAOYSA-N -1 1 319.229 4.441 20 0 DIADMM O=C(Nc1ccccc1-c1ccccc1)Nc1ncccc1[O-] ZINC001189695989 1048651229 /nfs/dbraw/zinc/65/12/29/1048651229.db2.gz FRRRBOWHKXTUGO-UHFFFAOYSA-N -1 1 305.337 4.098 20 0 DIADMM [O-]c1cc(Nc2c(F)cc(F)c(F)c2F)c(F)cc1Cl ZINC001176349489 1048656391 /nfs/dbraw/zinc/65/63/91/1048656391.db2.gz ZGGUHQMUYMESRZ-UHFFFAOYSA-N -1 1 309.621 4.485 20 0 DIADMM Cc1cc(Br)c([O-])c(NC(=O)[C@H](C)C(C)(C)C)c1 ZINC000482673130 1048657619 /nfs/dbraw/zinc/65/76/19/1048657619.db2.gz MSOCIQOAYDVOAU-VIFPVBQESA-N -1 1 314.223 4.084 20 0 DIADMM CCc1cccc(CC)c1NC(=O)Nc1cc(F)c([O-])c(F)c1 ZINC001189770022 1048663968 /nfs/dbraw/zinc/66/39/68/1048663968.db2.gz XOZQPMFYRVIMRE-UHFFFAOYSA-N -1 1 320.339 4.439 20 0 DIADMM CCc1cccc(CC)c1NC(=O)Nc1c(F)cc([O-])cc1F ZINC001189775687 1048665757 /nfs/dbraw/zinc/66/57/57/1048665757.db2.gz JJFYYFVECXXYNH-UHFFFAOYSA-N -1 1 320.339 4.439 20 0 DIADMM [O-]c1c(Cl)nccc1Nc1ccc(Oc2ccccc2)nc1 ZINC001176377621 1048668447 /nfs/dbraw/zinc/66/84/47/1048668447.db2.gz XKLFVEMIMFZWAG-UHFFFAOYSA-N -1 1 313.744 4.372 20 0 DIADMM [O-]c1cc(Nc2cc(F)cc(N3CCCC3)c2)cc(F)c1F ZINC001176421982 1048684709 /nfs/dbraw/zinc/68/47/09/1048684709.db2.gz XCXDKTODAKLISB-UHFFFAOYSA-N -1 1 308.303 4.153 20 0 DIADMM CC(C)Oc1cc([N-]c2nc3ccc(F)cc3o2)c(F)cn1 ZINC001176481262 1048693456 /nfs/dbraw/zinc/69/34/56/1048693456.db2.gz WYEYRMALEMWIKK-UHFFFAOYSA-N -1 1 305.284 4.032 20 0 DIADMM [O-]c1c(Cl)nccc1Nc1cccc(OC(F)(F)F)c1 ZINC001176537375 1048710092 /nfs/dbraw/zinc/71/00/92/1048710092.db2.gz HVCDKDOKKGEUQA-UHFFFAOYSA-N -1 1 304.655 4.083 20 0 DIADMM COc1ccc(O)cc1Nc1cc(Cl)c(C)c(Cl)c1[O-] ZINC001176582588 1048715742 /nfs/dbraw/zinc/71/57/42/1048715742.db2.gz VMRREANQPLOTLW-UHFFFAOYSA-N -1 1 314.168 4.465 20 0 DIADMM Cn1cc(Nc2cc([O-])c(Cl)cc2F)c(-c2ccccc2)n1 ZINC001176569794 1048730682 /nfs/dbraw/zinc/73/06/82/1048730682.db2.gz SKUUYHDCHBXFKV-UHFFFAOYSA-N -1 1 317.751 4.329 20 0 DIADMM Cc1cc([N-]S(=O)(=O)c2ccc(C3CC3)cc2)ccc1Cl ZINC001190501211 1048743604 /nfs/dbraw/zinc/74/36/04/1048743604.db2.gz YHUHFMLECRLVQB-UHFFFAOYSA-N -1 1 321.829 4.327 20 0 DIADMM Cc1ccc2nc(Nc3c(F)cc(F)c([O-])c3F)ccc2c1 ZINC001176664085 1048751722 /nfs/dbraw/zinc/75/17/22/1048751722.db2.gz SUNGIJOCXMNVRY-UHFFFAOYSA-N -1 1 304.271 4.410 20 0 DIADMM Cc1nc(C(F)(F)F)ccc1Nc1c(F)cc(F)c([O-])c1F ZINC001176664937 1048752933 /nfs/dbraw/zinc/75/29/33/1048752933.db2.gz ZIBMKSMHCTWRIB-UHFFFAOYSA-N -1 1 322.208 4.275 20 0 DIADMM Cc1cn(-c2ccc(Nc3c(F)cc(F)c([O-])c3F)cc2)cn1 ZINC001176670127 1048755153 /nfs/dbraw/zinc/75/51/53/1048755153.db2.gz SQFYPMXNQMYPRV-UHFFFAOYSA-N -1 1 319.286 4.047 20 0 DIADMM [O-]c1c(F)cc(F)c(Nc2ccc(F)c3cccnc23)c1F ZINC001176670677 1048755496 /nfs/dbraw/zinc/75/54/96/1048755496.db2.gz KLQLAYKPJUXPLB-UHFFFAOYSA-N -1 1 308.234 4.240 20 0 DIADMM [O-]c1c(F)cc(F)c(Nc2cccc(Br)c2)c1F ZINC001176672137 1048755637 /nfs/dbraw/zinc/75/56/37/1048755637.db2.gz UIZNUNKAOJGFHT-UHFFFAOYSA-N -1 1 318.092 4.316 20 0 DIADMM Cc1cccc2sc(Nc3c(F)cc(F)c([O-])c3F)nc21 ZINC001176662194 1048766786 /nfs/dbraw/zinc/76/67/86/1048766786.db2.gz JHPQZTVURBPYFC-UHFFFAOYSA-N -1 1 310.300 4.471 20 0 DIADMM CCCN(Cc1ccccc1F)C(=O)c1c([O-])cccc1Cl ZINC001166898820 1048810447 /nfs/dbraw/zinc/81/04/47/1048810447.db2.gz UEHFUKGITXHRHU-UHFFFAOYSA-N -1 1 321.779 4.237 20 0 DIADMM O=C(c1cccc(Nc2cc(F)c([O-])c(F)c2)c1)C(F)(F)F ZINC001203344877 1048874247 /nfs/dbraw/zinc/87/42/47/1048874247.db2.gz QCUUOWDRPHXDAZ-UHFFFAOYSA-N -1 1 317.213 4.159 20 0 DIADMM CNc1ccc(Nc2cc(Cl)c(C)c(Cl)c2[O-])c(F)n1 ZINC001203361360 1048881305 /nfs/dbraw/zinc/88/13/05/1048881305.db2.gz CUCQEJZYEXQUPJ-UHFFFAOYSA-N -1 1 316.163 4.327 20 0 DIADMM [O-]c1c(Cl)nccc1Nc1cncc(Oc2ccccc2)c1 ZINC001203555210 1048926645 /nfs/dbraw/zinc/92/66/45/1048926645.db2.gz BQSGYELVGFDHIB-UHFFFAOYSA-N -1 1 313.744 4.372 20 0 DIADMM Cc1cc2cc(CN[C@@H](CCCC(C)C)C(=O)[O-])oc2cc1C ZINC000904035338 1048955226 /nfs/dbraw/zinc/95/52/26/1048955226.db2.gz CSIAPDWREOELPK-KRWDZBQOSA-N -1 1 317.429 4.419 20 0 DIADMM O=C([O-])C[C@H](NCc1ccc(C2CC2)cc1)c1ccccc1F ZINC000904046225 1048961841 /nfs/dbraw/zinc/96/18/41/1048961841.db2.gz XTQLCCGFBIYEBD-SFHVURJKSA-N -1 1 313.372 4.009 20 0 DIADMM CCC[C@@H](C(=O)Nc1cc(F)c([O-])cc1Cl)c1ccccn1 ZINC000885678969 1048967702 /nfs/dbraw/zinc/96/77/02/1048967702.db2.gz ZRXZGENVRKSBDX-SNVBAGLBSA-N -1 1 322.767 4.102 20 0 DIADMM CCCOc1ccc(Nc2cc([O-])c(F)c(F)c2)c(F)c1F ZINC001203696616 1048967678 /nfs/dbraw/zinc/96/76/78/1048967678.db2.gz JEHRVSDGWVQSEG-UHFFFAOYSA-N -1 1 315.266 4.481 20 0 DIADMM Cc1ccc(Cl)c(NC(=O)Nc2cc(F)c([O-])cc2F)c1 ZINC001191707783 1048982246 /nfs/dbraw/zinc/98/22/46/1048982246.db2.gz PMAVEMYYDKFIDQ-UHFFFAOYSA-N -1 1 312.703 4.276 20 0 DIADMM CSc1ccc([O-])c(-c2nc(-c3cccc(Cl)c3)no2)c1 ZINC000904289102 1049012845 /nfs/dbraw/zinc/01/28/45/1049012845.db2.gz YOJHISBNAZTIBS-UHFFFAOYSA-N -1 1 318.785 4.485 20 0 DIADMM CCc1cc(=O)[n-]c(S[C@@H](C)c2ccc3ccccc3c2)n1 ZINC000195063695 1049051652 /nfs/dbraw/zinc/05/16/52/1049051652.db2.gz LXPFFFJGJOATOB-LBPRGKRZSA-N -1 1 310.422 4.339 20 0 DIADMM CC[C@]1(C(=O)[O-])CCCN(Cc2csc(Cl)c2Cl)C1 ZINC000904400655 1049059870 /nfs/dbraw/zinc/05/98/70/1049059870.db2.gz JOPYEVFOTAPMAH-ZDUSSCGKSA-N -1 1 322.257 4.132 20 0 DIADMM CC[C@@H](C)c1ccc(NC(=O)c2c(F)ccc([O-])c2F)cc1 ZINC001192520619 1049113031 /nfs/dbraw/zinc/11/30/31/1049113031.db2.gz QKSQWHFJGHWXMR-SNVBAGLBSA-N -1 1 305.324 4.436 20 0 DIADMM O=C(Nc1cc2ccccc2s1)c1cc([O-])cc(F)c1F ZINC001192651231 1049123346 /nfs/dbraw/zinc/12/33/46/1049123346.db2.gz CCZZZMDXKRUPBR-UHFFFAOYSA-N -1 1 305.305 4.137 20 0 DIADMM Nc1ccccc1Nc1c([O-])c(Br)ccc1Cl ZINC001206375641 1049151488 /nfs/dbraw/zinc/15/14/88/1049151488.db2.gz NWWNDZSCAKBAPU-UHFFFAOYSA-N -1 1 313.582 4.134 20 0 DIADMM CC(C)[C@@H](CNc1ccc(-n2ccc(=O)[n-]2)cc1)c1ccccc1 ZINC001179307773 1049153108 /nfs/dbraw/zinc/15/31/08/1049153108.db2.gz CCBZOWNKFQDSKQ-LJQANCHMSA-N -1 1 321.424 4.430 20 0 DIADMM COc1c(F)cc(F)cc1NC(=O)c1ccc(C(C)C)cc1[O-] ZINC000857469742 1049155721 /nfs/dbraw/zinc/15/57/21/1049155721.db2.gz WFJINVGKKVTDCX-UHFFFAOYSA-N -1 1 321.323 4.055 20 0 DIADMM CC(C)c1ncsc1NC(=O)c1ccc(C(C)C)cc1[O-] ZINC000857526914 1049169687 /nfs/dbraw/zinc/16/96/87/1049169687.db2.gz OMNPEHFRLUDKTH-UHFFFAOYSA-N -1 1 304.415 4.348 20 0 DIADMM C[C@@H](NC(=O)Nc1ccc(Cl)cc1[O-])c1ccc(F)cc1 ZINC001193143435 1049184877 /nfs/dbraw/zinc/18/48/77/1049184877.db2.gz ZSXDXPAKAQMFPR-SECBINFHSA-N -1 1 308.740 4.067 20 0 DIADMM Cc1coc([N-]c2c(F)c(F)c(OC(C)C)c(F)c2F)n1 ZINC001193292039 1049194758 /nfs/dbraw/zinc/19/47/58/1049194758.db2.gz RLINQXBTKDFKSF-UHFFFAOYSA-N -1 1 304.243 4.070 20 0 DIADMM C[C@@H](CC(C)(C)c1ccccc1)Nc1cc(Cl)[n-]c(=O)n1 ZINC000858364667 1049246870 /nfs/dbraw/zinc/24/68/70/1049246870.db2.gz GVQHHNXHUJZGPU-NSHDSACASA-N -1 1 305.809 4.004 20 0 DIADMM O=c1nc(Cl)cc(Oc2ccc(OC3CCCCC3)cc2)[n-]1 ZINC000858395776 1049253103 /nfs/dbraw/zinc/25/31/03/1049253103.db2.gz QWRPBYGJKCGEBB-UHFFFAOYSA-N -1 1 320.776 4.339 20 0 DIADMM Cc1ccc(S(=O)(=O)[N-]c2cccc(F)c2)c2ccccc12 ZINC001193824230 1049269298 /nfs/dbraw/zinc/26/92/98/1049269298.db2.gz DTEFMMSDTKDYIS-UHFFFAOYSA-N -1 1 315.369 4.088 20 0 DIADMM CCCC[C@H](CC)COC(=O)Nc1cc(F)c([O-])cc1F ZINC001193969522 1049288464 /nfs/dbraw/zinc/28/84/64/1049288464.db2.gz YXBZGKMJPVUBKJ-JTQLQIEISA-N -1 1 301.333 4.435 20 0 DIADMM CSCCCCCCc1nc(-c2ccc([O-])cc2F)no1 ZINC000858749957 1049290800 /nfs/dbraw/zinc/29/08/00/1049290800.db2.gz FVFJGCJCEGUPQD-UHFFFAOYSA-N -1 1 310.394 4.047 20 0 DIADMM O=C(Nc1cccc(C(F)(F)F)c1[O-])[C@H](F)c1ccccc1 ZINC001180148442 1049299564 /nfs/dbraw/zinc/29/95/64/1049299564.db2.gz HIOFSZTVLFAEAQ-GFCCVEGCSA-N -1 1 313.250 4.060 20 0 DIADMM O=C(Nc1cccc(C(F)(F)F)c1[O-])[C@@H](F)c1ccccc1 ZINC001180148444 1049300140 /nfs/dbraw/zinc/30/01/40/1049300140.db2.gz HIOFSZTVLFAEAQ-LBPRGKRZSA-N -1 1 313.250 4.060 20 0 DIADMM [O-]c1cc(Nc2cc(Cl)nc(Cl)c2)c(F)c(F)c1F ZINC001249958554 1049308824 /nfs/dbraw/zinc/30/88/24/1049308824.db2.gz NXASNLYJCADJPA-UHFFFAOYSA-N -1 1 309.074 4.255 20 0 DIADMM O=C(Nc1cc(F)c(F)cc1[O-])Oc1ccc2ccccc2c1 ZINC001194657498 1049405276 /nfs/dbraw/zinc/40/52/76/1049405276.db2.gz NVCVFIURMLUOSF-UHFFFAOYSA-N -1 1 315.275 4.435 20 0 DIADMM O=C(Nc1cc(F)cc(F)c1[O-])Oc1ccc2ccccc2c1 ZINC001194661598 1049408411 /nfs/dbraw/zinc/40/84/11/1049408411.db2.gz NRUGBUZWCXYVJH-UHFFFAOYSA-N -1 1 315.275 4.435 20 0 DIADMM C=Cc1ccc([N-]S(=O)(=O)c2cccc(C(C)C)c2)cc1 ZINC001195154121 1049487387 /nfs/dbraw/zinc/48/73/87/1049487387.db2.gz UIKIOPHODVCQCY-UHFFFAOYSA-N -1 1 301.411 4.254 20 0 DIADMM O=C(Nc1cccc([O-])c1Br)C1(C2CCC2)CCC1 ZINC000908706983 1049498554 /nfs/dbraw/zinc/49/85/54/1049498554.db2.gz GNEUKSPYKJLAKX-UHFFFAOYSA-N -1 1 324.218 4.064 20 0 DIADMM CC1=C(C)C[C@@H](C(=O)Nc2cccc([O-])c2Br)CC1 ZINC000908707478 1049498762 /nfs/dbraw/zinc/49/87/62/1049498762.db2.gz IPTQHFGFTSYTMD-NSHDSACASA-N -1 1 324.218 4.230 20 0 DIADMM CC(C)C[C@H](C)CC(=O)Nc1cccc([O-])c1Br ZINC000908717148 1049500377 /nfs/dbraw/zinc/50/03/77/1049500377.db2.gz WSFVQNQSUJBWIN-JTQLQIEISA-N -1 1 314.223 4.166 20 0 DIADMM O=C(CC1CCCCC1)Nc1cccc([O-])c1Br ZINC000908717768 1049501250 /nfs/dbraw/zinc/50/12/50/1049501250.db2.gz ODGVIQBAZOFHHB-UHFFFAOYSA-N -1 1 312.207 4.064 20 0 DIADMM Cc1ccc([O-])c(C(=O)N2CCCC[C@H]2c2ccc(C)c(C)c2)n1 ZINC001195327254 1049509390 /nfs/dbraw/zinc/50/93/90/1049509390.db2.gz YMXMNPHSAIOPPJ-KRWDZBQOSA-N -1 1 324.424 4.080 20 0 DIADMM CC(C)c1ccc([C@@H](C)NC(=O)c2cc([O-])cnc2Cl)cc1 ZINC001195315851 1049516339 /nfs/dbraw/zinc/51/63/39/1049516339.db2.gz UHCVSBYAOAPBFH-LLVKDONJSA-N -1 1 318.804 4.055 20 0 DIADMM Cc1cc2cc[nH]c2cc1NC(=O)Nc1ccc([O-])c(Cl)c1 ZINC000487196173 1049527987 /nfs/dbraw/zinc/52/79/87/1049527987.db2.gz YQFYQYKKZGZRFG-UHFFFAOYSA-N -1 1 315.760 4.479 20 0 DIADMM COc1ccc(F)c(F)c1Nc1cc(Cl)c([O-])cc1F ZINC001250023918 1049530176 /nfs/dbraw/zinc/53/01/76/1049530176.db2.gz IFNACQOOMYDPON-UHFFFAOYSA-N -1 1 303.667 4.215 20 0 DIADMM CC(C)c1ccc(C(=O)Nc2cc(-c3ccccc3)on2)c([O-])c1 ZINC001182736352 1049708725 /nfs/dbraw/zinc/70/87/25/1049708725.db2.gz IQPCTUKZZLVVJJ-UHFFFAOYSA-N -1 1 322.364 4.423 20 0 DIADMM [O-]c1ccc(NC(=S)Nc2ccc(Cl)cc2)c(F)c1F ZINC001197328175 1049743714 /nfs/dbraw/zinc/74/37/14/1049743714.db2.gz KGKVRBAPNJYOCH-UHFFFAOYSA-N -1 1 314.744 4.133 20 0 DIADMM O=C(Nc1nsc2ccccc21)Nc1ccc([O-])c(Cl)c1 ZINC001207294107 1049875655 /nfs/dbraw/zinc/87/56/55/1049875655.db2.gz VDCYLKXVZHVDJD-UHFFFAOYSA-N -1 1 319.773 4.299 20 0 DIADMM CCC(=O)c1ccc(NC(=O)Nc2ccc([O-])c(Cl)c2)cc1 ZINC001207666336 1049923754 /nfs/dbraw/zinc/92/37/54/1049923754.db2.gz ZGSXSCHDJDGGJK-UHFFFAOYSA-N -1 1 318.760 4.282 20 0 DIADMM O=C(Nc1cccc(NC2CCCC2)c1)c1ccc(F)c([O-])c1 ZINC001168394272 1050058382 /nfs/dbraw/zinc/05/83/82/1050058382.db2.gz YNIQCPLYKRUIAU-UHFFFAOYSA-N -1 1 314.360 4.138 20 0 DIADMM CO[C@H](C)c1cccc(Nc2ccc(-n3ccc(=O)[n-]3)cc2)c1 ZINC001209955290 1050111655 /nfs/dbraw/zinc/11/16/55/1050111655.db2.gz OJMOGDSHWYBRLQ-CYBMUJFWSA-N -1 1 309.369 4.029 20 0 DIADMM Cc1cc(Cl)cc([N-]c2nnc(Br)s2)c1F ZINC001210023310 1050124101 /nfs/dbraw/zinc/12/41/01/1050124101.db2.gz DLGOGKYUMURJOW-UHFFFAOYSA-N -1 1 322.590 4.145 20 0 DIADMM O=C(Nc1ccc([O-])c(Cl)c1)c1ccc(F)c(Cl)c1 ZINC000157280425 1050140307 /nfs/dbraw/zinc/14/03/07/1050140307.db2.gz IZXHQVCFUXMXEH-UHFFFAOYSA-N -1 1 300.116 4.090 20 0 DIADMM Cc1cc(C)c(N=C2CCC(C)(C)CC2)c(S(=O)(=O)[O-])c1 ZINC001210165421 1050145920 /nfs/dbraw/zinc/14/59/20/1050145920.db2.gz DOPNSUWGLZHZOJ-UHFFFAOYSA-N -1 1 309.431 4.056 20 0 DIADMM O=C(OCC1CCC(C(F)(F)F)CC1)c1ccc([O-])cc1F ZINC000770409197 1050156346 /nfs/dbraw/zinc/15/63/46/1050156346.db2.gz XJZNGKQHXVZDCT-UHFFFAOYSA-N -1 1 320.282 4.057 20 0 DIADMM Nc1c(-c2cccc(Cl)c2)cnn1-c1cccc(Cl)c1[O-] ZINC001210217156 1050161371 /nfs/dbraw/zinc/16/13/71/1050161371.db2.gz TZNDJEWUHLSKLW-UHFFFAOYSA-N -1 1 320.179 4.134 20 0 DIADMM CC(C)c1cnc(NC(=O)c2ccc(C(C)C)cc2[O-])s1 ZINC001136839513 1050191716 /nfs/dbraw/zinc/19/17/16/1050191716.db2.gz LNOVRXPKFYRZBF-UHFFFAOYSA-N -1 1 304.415 4.348 20 0 DIADMM CCc1ccc(C(=O)Nc2sc3c(c2C)CCCC3)c([O-])c1 ZINC001136839926 1050191769 /nfs/dbraw/zinc/19/17/69/1050191769.db2.gz XZFBBKDIUDRXAZ-UHFFFAOYSA-N -1 1 315.438 4.456 20 0 DIADMM C/C(=C\c1ccccc1Cl)C(=O)Nc1c([O-])cccc1F ZINC000770863660 1050196403 /nfs/dbraw/zinc/19/64/03/1050196403.db2.gz SWMUWPWYJCWDAD-MDZDMXLPSA-N -1 1 305.736 4.227 20 0 DIADMM Cc1cc(C)cc(CCNC(=O)c2cc3ccccc3cc2[O-])c1 ZINC001136869775 1050209837 /nfs/dbraw/zinc/20/98/37/1050209837.db2.gz WJAHRBOGVOPAAR-UHFFFAOYSA-N -1 1 319.404 4.135 20 0 DIADMM Cc1ccc(CN[C@@H]2C[C@H](C(=O)[O-])c3ccccc32)c(Cl)c1 ZINC000573729514 1050248276 /nfs/dbraw/zinc/24/82/76/1050248276.db2.gz WHHRLHVNFNYQDU-DOTOQJQBSA-N -1 1 315.800 4.051 20 0 DIADMM Cc1cc(C)c(N=C2CCCCCCC2)c(S(=O)(=O)[O-])c1 ZINC001210448197 1050249073 /nfs/dbraw/zinc/24/90/73/1050249073.db2.gz CXUPUVMNPDSJKS-UHFFFAOYSA-N -1 1 309.431 4.200 20 0 DIADMM Cc1ccc([C@@H]2CCCCCN2C(=O)c2cccc([O-])c2F)o1 ZINC001136941623 1050249683 /nfs/dbraw/zinc/24/96/83/1050249683.db2.gz YTKBCGRAAHDKOI-AWEZNQCLSA-N -1 1 317.360 4.190 20 0 DIADMM COc1ccc(-c2nc(-c3cccc(C(F)F)c3)no2)c([O-])c1 ZINC000771517632 1050261345 /nfs/dbraw/zinc/26/13/45/1050261345.db2.gz MSLFLHCAFBIIKN-UHFFFAOYSA-N -1 1 318.279 4.055 20 0 DIADMM Cc1ccc(CC[C@@H](C)NC(=O)c2ccc3ccccc3c2[O-])o1 ZINC001136978623 1050268697 /nfs/dbraw/zinc/26/86/97/1050268697.db2.gz LNEDMFTWPAOJEO-CYBMUJFWSA-N -1 1 323.392 4.198 20 0 DIADMM CCC[C@H](C)c1noc(-c2cc(Cl)c([O-])c(OCC)c2)n1 ZINC000785586410 1050390721 /nfs/dbraw/zinc/39/07/21/1050390721.db2.gz YGPDIIDXERPHPT-VIFPVBQESA-N -1 1 310.781 4.398 20 0 DIADMM CSc1ccc(Nc2cc3ccc([O-])cc3oc2=O)c(F)c1 ZINC001210876879 1050404031 /nfs/dbraw/zinc/40/40/31/1050404031.db2.gz KUAZAUPTMXABQB-UHFFFAOYSA-N -1 1 317.341 4.103 20 0 DIADMM [O-]c1cc(Nc2ccccc2N2CCCCC2)cc(F)c1F ZINC001210964567 1050436078 /nfs/dbraw/zinc/43/60/78/1050436078.db2.gz VMPCORSCHSYEBE-UHFFFAOYSA-N -1 1 304.340 4.404 20 0 DIADMM [O-]c1cc(F)c(Nc2ccccc2N2CCCCC2)cc1F ZINC001210963706 1050436385 /nfs/dbraw/zinc/43/63/85/1050436385.db2.gz BJJRDKAFDMWWBU-UHFFFAOYSA-N -1 1 304.340 4.404 20 0 DIADMM CSc1ccc(Nc2cc3ccc([O-])cc3oc2=O)cc1F ZINC001211108334 1050476524 /nfs/dbraw/zinc/47/65/24/1050476524.db2.gz QVGNLPFQYPFEFC-UHFFFAOYSA-N -1 1 317.341 4.103 20 0 DIADMM O=C([O-])c1ccc(CN2CCC[C@@H]2c2ccsc2)cc1Cl ZINC000574643956 1050502775 /nfs/dbraw/zinc/50/27/75/1050502775.db2.gz FZSUOBUYYVYQJW-OAHLLOKOSA-N -1 1 321.829 4.437 20 0 DIADMM CC(C)Oc1c(F)cc(-c2cc(F)c([O-])cc2F)cc1F ZINC001211338707 1050552062 /nfs/dbraw/zinc/55/20/62/1050552062.db2.gz HXBAIKZYAJPMBY-UHFFFAOYSA-N -1 1 300.251 4.403 20 0 DIADMM [O-]c1cc(F)c(-c2ccc(F)c(OC(F)(F)F)c2)cc1F ZINC001211349810 1050552850 /nfs/dbraw/zinc/55/28/50/1050552850.db2.gz HDOZNURMHPPRBA-UHFFFAOYSA-N -1 1 308.177 4.375 20 0 DIADMM COc1cc(O)ccc1Nc1ccc(Cl)c(Cl)c1[O-] ZINC001213098166 1050588497 /nfs/dbraw/zinc/58/84/97/1050588497.db2.gz FCIPHLIYFGSOMG-UHFFFAOYSA-N -1 1 300.141 4.157 20 0 DIADMM Cc1ccc([C@H]2CCCN2Cc2c(F)cc([O-])cc2F)cc1 ZINC001144554888 1050613832 /nfs/dbraw/zinc/61/38/32/1050613832.db2.gz LCSOCKZOPYGJKI-GOSISDBHSA-N -1 1 303.352 4.316 20 0 DIADMM COc1ccc([C@H]2CCCN2Cc2c(F)cc([O-])cc2F)cc1 ZINC001144555175 1050614635 /nfs/dbraw/zinc/61/46/35/1050614635.db2.gz YKFZGKCXRISPLS-GOSISDBHSA-N -1 1 319.351 4.016 20 0 DIADMM [O-]c1cc(F)c(CN(Cc2ccccc2)C2CCC2)c(F)c1 ZINC001144560948 1050618238 /nfs/dbraw/zinc/61/82/38/1050618238.db2.gz CVGOFHPJMFWSOE-UHFFFAOYSA-N -1 1 303.352 4.225 20 0 DIADMM CC(C)COc1ccccc1Nc1ccc(-n2ccc(=O)[n-]2)cc1 ZINC001213255871 1050618411 /nfs/dbraw/zinc/61/84/11/1050618411.db2.gz DFMHUSJAFXGOGC-UHFFFAOYSA-N -1 1 323.396 4.356 20 0 DIADMM [O-]c1c(F)cc(Nc2ccc(Cl)c3nsnc32)cc1F ZINC001213386818 1050644192 /nfs/dbraw/zinc/64/41/92/1050644192.db2.gz XCJJJRISKMQNJS-UHFFFAOYSA-N -1 1 313.716 4.072 20 0 DIADMM Nc1cccc(C(F)(F)F)c1Nc1cc(F)c([O-])c(F)c1 ZINC001213386487 1050644629 /nfs/dbraw/zinc/64/46/29/1050644629.db2.gz FWQBDOYYCWMIGU-UHFFFAOYSA-N -1 1 304.218 4.015 20 0 DIADMM O=C([O-])c1ccsc1CN1CCC[C@@H]1c1cc(F)cc(F)c1 ZINC001144685021 1050657116 /nfs/dbraw/zinc/65/71/16/1050657116.db2.gz ULKVVNPAFGDXQM-CQSZACIVSA-N -1 1 323.364 4.062 20 0 DIADMM CC(C)c1ccc(-c2noc(-c3cnc(C(F)(F)F)[n-]3)n2)cc1 ZINC001213589564 1050688592 /nfs/dbraw/zinc/68/85/92/1050688592.db2.gz HQZCGJHACCNQOA-UHFFFAOYSA-N -1 1 322.290 4.269 20 0 DIADMM CC(C)c1ccc(-c2noc(-c3c[n-]c(C(F)(F)F)n3)n2)cc1 ZINC001213589564 1050688606 /nfs/dbraw/zinc/68/86/06/1050688606.db2.gz HQZCGJHACCNQOA-UHFFFAOYSA-N -1 1 322.290 4.269 20 0 DIADMM Cc1cc(Cl)ccc1-c1noc(-c2cc([O-])cnc2Cl)n1 ZINC001213696144 1050720181 /nfs/dbraw/zinc/72/01/81/1050720181.db2.gz IMMPGOZWCLPAJO-UHFFFAOYSA-N -1 1 322.151 4.119 20 0 DIADMM [O-]c1cnc(Cl)c(-c2nc(-c3cccc4ccccc43)no2)c1 ZINC001213697848 1050720693 /nfs/dbraw/zinc/72/06/93/1050720693.db2.gz GQPCMDFURIIYLB-UHFFFAOYSA-N -1 1 323.739 4.311 20 0 DIADMM O=C1c2cc(F)ccc2OCC/C1=C\c1ccc([O-])c(Cl)c1 ZINC000060132740 1050737297 /nfs/dbraw/zinc/73/72/97/1050737297.db2.gz NJOOFDADIHMWBP-YRNVUSSQSA-N -1 1 318.731 4.234 20 0 DIADMM Cc1ncc(C(F)(F)F)cc1Nc1c([O-])cc(F)cc1F ZINC001213830940 1050756867 /nfs/dbraw/zinc/75/68/67/1050756867.db2.gz SSEFKXYBOXVMPW-UHFFFAOYSA-N -1 1 304.218 4.136 20 0 DIADMM [O-]c1cc(Nc2ccc(N3CCCC3)cc2F)cc(F)c1F ZINC001213851115 1050764050 /nfs/dbraw/zinc/76/40/50/1050764050.db2.gz AIWXYTKKDOWPNX-UHFFFAOYSA-N -1 1 308.303 4.153 20 0 DIADMM Cc1ccc(-c2ccc(-n3[n-]c(=O)c4ccc(N)cc43)cc2)cc1 ZINC001213924851 1050783339 /nfs/dbraw/zinc/78/33/39/1050783339.db2.gz UMHDKTASQDNSNM-UHFFFAOYSA-N -1 1 315.376 4.289 20 0 DIADMM Cc1ccc(C[C@@H](C)NC(=O)c2cc(Cl)ccc2[O-])c(C)c1 ZINC001146459559 1050823858 /nfs/dbraw/zinc/82/38/58/1050823858.db2.gz USDGAKOXABGPMA-CYBMUJFWSA-N -1 1 317.816 4.023 20 0 DIADMM CC[C@H]1CCC[C@H](NC(=O)c2ccc(C(F)(F)F)cc2[O-])C1 ZINC001147264029 1050873454 /nfs/dbraw/zinc/87/34/54/1050873454.db2.gz ZKBUVBFDMZDFLY-JQWIXIFHSA-N -1 1 315.335 4.110 20 0 DIADMM CC(C)C[C@H]1CCCCCN1C(=O)c1ccc(Cl)cc1[O-] ZINC001147275962 1050873621 /nfs/dbraw/zinc/87/36/21/1050873621.db2.gz FMIIDZUERQVITO-CQSZACIVSA-N -1 1 309.837 4.477 20 0 DIADMM COCOc1ccc(Cl)cc1Nc1cc(F)c([O-])c(F)c1 ZINC001214424091 1050899938 /nfs/dbraw/zinc/89/99/38/1050899938.db2.gz QOYNCLQDHJENOB-UHFFFAOYSA-N -1 1 315.703 4.050 20 0 DIADMM [O-]c1c(F)cc(Nc2cnc3cccc(O)c3c2)cc1Cl ZINC001214484228 1050917568 /nfs/dbraw/zinc/91/75/68/1050917568.db2.gz GHRDLMVGJMUZCH-UHFFFAOYSA-N -1 1 304.708 4.182 20 0 DIADMM [O-]c1c(F)cc(Nc2ccc(OC(F)(F)F)nc2)cc1Cl ZINC001214484624 1050918391 /nfs/dbraw/zinc/91/83/91/1050918391.db2.gz NTZMRPKSARGWPQ-UHFFFAOYSA-N -1 1 322.645 4.222 20 0 DIADMM COC(=O)c1scc(C)c1Nc1cc(F)c([O-])c(Cl)c1 ZINC001214480230 1050918481 /nfs/dbraw/zinc/91/84/81/1050918481.db2.gz PWLFPKYYHMVRCR-UHFFFAOYSA-N -1 1 315.753 4.085 20 0 DIADMM CC(C)c1cc2ncc(Nc3cc(F)c([O-])c(Cl)c3)cn2n1 ZINC001214484650 1050920085 /nfs/dbraw/zinc/92/00/85/1050920085.db2.gz OMYPYYASXRCCLN-UHFFFAOYSA-N -1 1 320.755 4.094 20 0 DIADMM [O-]c1c(F)cc(Nc2cc(OC(F)(F)F)ccn2)cc1Cl ZINC001214486734 1050920532 /nfs/dbraw/zinc/92/05/32/1050920532.db2.gz XCGPNAFKGCIPQO-UHFFFAOYSA-N -1 1 322.645 4.222 20 0 DIADMM [O-]c1c(F)cc(Nc2cccc(-n3ccnc3)c2)cc1Cl ZINC001214486337 1050920671 /nfs/dbraw/zinc/92/06/71/1050920671.db2.gz BKZSZCBPCPTHKK-UHFFFAOYSA-N -1 1 303.724 4.114 20 0 DIADMM [O-]c1c(F)cc(Nc2ccc3c(c2)OCCCO3)cc1Cl ZINC001214486780 1050920875 /nfs/dbraw/zinc/92/08/75/1050920875.db2.gz YTHCLYUIXJKGPS-UHFFFAOYSA-N -1 1 309.724 4.090 20 0 DIADMM CC(C)c1nc2ccc(Nc3cc(F)c([O-])c(Cl)c3)cn2n1 ZINC001214486537 1050921043 /nfs/dbraw/zinc/92/10/43/1050921043.db2.gz LWZPWSKMBOKHRN-UHFFFAOYSA-N -1 1 320.755 4.094 20 0 DIADMM CN1CCCc2ccc(Nc3cc(F)c([O-])c(Cl)c3)cc21 ZINC001214488886 1050921184 /nfs/dbraw/zinc/92/11/84/1050921184.db2.gz OXILORGMYWWSAH-UHFFFAOYSA-N -1 1 306.768 4.311 20 0 DIADMM COc1ccc(F)c(F)c1Nc1cc(F)c([O-])c(Cl)c1 ZINC001214490176 1050921973 /nfs/dbraw/zinc/92/19/73/1050921973.db2.gz PVASFOZDHRMPOX-UHFFFAOYSA-N -1 1 303.667 4.215 20 0 DIADMM Cc1cc(=O)c2ccc(Nc3cc(F)c([O-])c(Cl)c3)cc2o1 ZINC001214492334 1050922774 /nfs/dbraw/zinc/92/27/74/1050922774.db2.gz ZHHZSITZAYAFOA-UHFFFAOYSA-N -1 1 319.719 4.343 20 0 DIADMM COC(=O)c1cc(C)c(Nc2cc(F)c([O-])c(Cl)c2)c(C)c1 ZINC001214490025 1050923227 /nfs/dbraw/zinc/92/32/27/1050923227.db2.gz NGOFEIOBCJHVOT-UHFFFAOYSA-N -1 1 323.751 4.332 20 0 DIADMM [O-]c1c(F)cc(Nc2cc(Cl)ccc2CO)cc1Cl ZINC001214491595 1050923457 /nfs/dbraw/zinc/92/34/57/1050923457.db2.gz DSPKNIJUFOSAOB-UHFFFAOYSA-N -1 1 302.132 4.074 20 0 DIADMM CO[C@@H]1CCOc2c(Nc3cc(F)c([O-])c(Cl)c3)cccc21 ZINC001214492119 1050923619 /nfs/dbraw/zinc/92/36/19/1050923619.db2.gz QUEXWMSJQGZNLP-CQSZACIVSA-N -1 1 323.751 4.398 20 0 DIADMM Nc1cc(F)cc(Nc2cc(F)c([O-])c(Cl)c2)c1Cl ZINC001214493985 1050924828 /nfs/dbraw/zinc/92/48/28/1050924828.db2.gz GUWIKZYSSPNUAU-UHFFFAOYSA-N -1 1 305.111 4.303 20 0 DIADMM [O-]c1cc(Nc2cccc(Cl)c2CO)c(F)cc1Cl ZINC001214650149 1050970472 /nfs/dbraw/zinc/97/04/72/1050970472.db2.gz QRWHEGBHULMECR-UHFFFAOYSA-N -1 1 302.132 4.074 20 0 DIADMM CN(C[C@H]1CC1(C)C)C(=O)c1cccc(-c2ccccc2)c1[O-] ZINC001148866425 1050980228 /nfs/dbraw/zinc/98/02/28/1050980228.db2.gz ILINNTMGBZCKGB-OAHLLOKOSA-N -1 1 309.409 4.177 20 0 DIADMM C[C@@H]1CCCCN(C(=O)c2cccc(-c3ccccc3)c2[O-])C1 ZINC001148867016 1050980266 /nfs/dbraw/zinc/98/02/66/1050980266.db2.gz KEUCDSOVVZEGFH-OAHLLOKOSA-N -1 1 309.409 4.321 20 0 DIADMM O=C(Nc1ccc([O-])c(Cl)c1)c1ccc(OC2CCC2)cc1 ZINC000743822654 1051068339 /nfs/dbraw/zinc/06/83/39/1051068339.db2.gz JTINECWQMFGPPT-UHFFFAOYSA-N -1 1 317.772 4.229 20 0 DIADMM CC(C)Oc1ccc(F)c(F)c1Nc1c([O-])cc(F)cc1F ZINC001215076422 1051071666 /nfs/dbraw/zinc/07/16/66/1051071666.db2.gz MVZKZMCGDXRKFQ-UHFFFAOYSA-N -1 1 315.266 4.479 20 0 DIADMM CC(C)Oc1ccc(F)c(F)c1Nc1ccc(F)c(F)c1[O-] ZINC001215078844 1051073289 /nfs/dbraw/zinc/07/32/89/1051073289.db2.gz JNHWWKNMTFDKRF-UHFFFAOYSA-N -1 1 315.266 4.479 20 0 DIADMM COCOc1cc(C)c(Nc2ccc(F)c(F)c2[O-])c(C)c1 ZINC001215168650 1051098773 /nfs/dbraw/zinc/09/87/73/1051098773.db2.gz WVCLRNNPUNDLTL-UHFFFAOYSA-N -1 1 309.312 4.014 20 0 DIADMM CC(C)Oc1ccc(F)c(Nc2cc(F)c([O-])c(F)c2)c1F ZINC001215176599 1051105072 /nfs/dbraw/zinc/10/50/72/1051105072.db2.gz QRMGXEJFMHZJQN-UHFFFAOYSA-N -1 1 315.266 4.479 20 0 DIADMM COc1cccc([O-])c1-c1nc(-c2ccc(C)cc2Cl)no1 ZINC001215322265 1051165292 /nfs/dbraw/zinc/16/52/92/1051165292.db2.gz DVQRPSRZAIYMRO-UHFFFAOYSA-N -1 1 316.744 4.080 20 0 DIADMM COc1cc(C)cc(-c2noc(-c3ccc([O-])cc3Cl)n2)c1 ZINC001215342846 1051170435 /nfs/dbraw/zinc/17/04/35/1051170435.db2.gz BPCVIJGHGHDFFV-UHFFFAOYSA-N -1 1 316.744 4.080 20 0 DIADMM Cc1cc(F)cc(-c2noc(-c3ccc([O-])cc3Cl)n2)c1 ZINC001215343276 1051172757 /nfs/dbraw/zinc/17/27/57/1051172757.db2.gz RFCHSRVXAFJKLE-UHFFFAOYSA-N -1 1 304.708 4.210 20 0 DIADMM [O-]c1ccc(-c2nc(-c3ccc(F)c(F)c3)no2)c(Cl)c1 ZINC001215343246 1051172809 /nfs/dbraw/zinc/17/28/09/1051172809.db2.gz QCOYMDWUYCUEDR-UHFFFAOYSA-N -1 1 308.671 4.041 20 0 DIADMM Cc1ccc(-c2noc(-c3ccc([O-])cc3Cl)n2)c(C)c1 ZINC001215342869 1051172852 /nfs/dbraw/zinc/17/28/52/1051172852.db2.gz CVPMOGBQTDYTDT-UHFFFAOYSA-N -1 1 300.745 4.379 20 0 DIADMM [O-]c1ccc(-c2nc(-c3cc(F)ccc3F)no2)c(Cl)c1 ZINC001215342978 1051173194 /nfs/dbraw/zinc/17/31/94/1051173194.db2.gz ITCRAIFNLUIGMH-UHFFFAOYSA-N -1 1 308.671 4.041 20 0 DIADMM CCCCN(C)c1ccc(C(=O)Nc2cccc(F)c2[O-])cc1 ZINC001171632843 1051174325 /nfs/dbraw/zinc/17/43/25/1051174325.db2.gz SQWRNFJOBKXRHK-UHFFFAOYSA-N -1 1 316.376 4.020 20 0 DIADMM C[C@H](c1ccccc1F)N(C)C(=O)c1cc(Cl)ccc1[O-] ZINC000063240162 1051189006 /nfs/dbraw/zinc/18/90/06/1051189006.db2.gz ALIXBMFHPIRZCT-SNVBAGLBSA-N -1 1 307.752 4.018 20 0 DIADMM CC(C)[C@@H](CCc1ccccc1)C(=O)Nc1cccc(F)c1[O-] ZINC001171637961 1051194972 /nfs/dbraw/zinc/19/49/72/1051194972.db2.gz QOYSMRVDFOEOLB-OAHLLOKOSA-N -1 1 315.388 4.375 20 0 DIADMM CCCOc1ccc(F)c([N-]c2noc3cccnc32)c1F ZINC001215569058 1051248796 /nfs/dbraw/zinc/24/87/96/1051248796.db2.gz VYEJKJCCERYCHU-UHFFFAOYSA-N -1 1 305.284 4.033 20 0 DIADMM [O-]c1cc(F)c(Nc2ccc(F)cc2Br)cc1F ZINC001215571577 1051252168 /nfs/dbraw/zinc/25/21/68/1051252168.db2.gz HUHLNBNYCHTHCK-UHFFFAOYSA-N -1 1 318.092 4.316 20 0 DIADMM COc1cc(Nc2cc(F)c([O-])cc2F)c(OC)cc1Cl ZINC001215571740 1051252339 /nfs/dbraw/zinc/25/23/39/1051252339.db2.gz JRNCYAHXBKCKLS-UHFFFAOYSA-N -1 1 315.703 4.085 20 0 DIADMM Cc1ccc(Nc2cc(F)c([O-])cc2F)cc1OC(F)F ZINC001215574313 1051253465 /nfs/dbraw/zinc/25/34/65/1051253465.db2.gz QHLRVXPKSNOSAN-UHFFFAOYSA-N -1 1 301.239 4.324 20 0 DIADMM CC(=O)n1ccc2cc(Nc3cc(F)c([O-])cc3F)ccc21 ZINC001215575721 1051253973 /nfs/dbraw/zinc/25/39/73/1051253973.db2.gz DCFPMTZFQRDXAJ-UHFFFAOYSA-N -1 1 302.280 4.029 20 0 DIADMM [O-]c1ccc(Cl)c(Nc2cc(F)c(O)cc2F)c1Cl ZINC001215573466 1051254091 /nfs/dbraw/zinc/25/40/91/1051254091.db2.gz KTOCDOLNTKIMGQ-UHFFFAOYSA-N -1 1 306.095 4.426 20 0 DIADMM COc1cc(F)c(Cl)cc1Nc1cc(F)c([O-])cc1F ZINC001215576217 1051254775 /nfs/dbraw/zinc/25/47/75/1051254775.db2.gz ORGHNPTYNCLPDJ-UHFFFAOYSA-N -1 1 303.667 4.215 20 0 DIADMM [O-]c1cc(F)c(Nc2cccc(C(F)(F)F)c2O)cc1F ZINC001215577240 1051255059 /nfs/dbraw/zinc/25/50/59/1051255059.db2.gz VVUQDUPBJFFBPB-UHFFFAOYSA-N -1 1 305.202 4.138 20 0 DIADMM [O-]c1c(F)cc(Nc2ccc(C(F)(F)F)cc2O)cc1F ZINC001212633308 1051257932 /nfs/dbraw/zinc/25/79/32/1051257932.db2.gz MTMZMZIPMLNJKU-UHFFFAOYSA-N -1 1 305.202 4.138 20 0 DIADMM CC(C)Oc1c(F)ccc(Nc2cc([O-])c(F)c(F)c2)c1F ZINC001215731237 1051332379 /nfs/dbraw/zinc/33/23/79/1051332379.db2.gz TZJIDCJIUHTDBA-UHFFFAOYSA-N -1 1 315.266 4.479 20 0 DIADMM [O-]c1ccc(F)cc1-c1nc(-c2cc(Cl)ccc2F)no1 ZINC001215765831 1051355869 /nfs/dbraw/zinc/35/58/69/1051355869.db2.gz POEQBABDPGEBIL-UHFFFAOYSA-N -1 1 308.671 4.041 20 0 DIADMM CC(C)(C)C(=O)Nc1ccccc1[N-]c1nnc(C(C)(C)C)o1 ZINC001215831682 1051395418 /nfs/dbraw/zinc/39/54/18/1051395418.db2.gz QDLZROBBSOKPBM-UHFFFAOYSA-N -1 1 316.405 4.095 20 0 DIADMM CSc1ccc(F)c(Nc2cc(F)c([O-])cc2F)c1F ZINC001215841004 1051404319 /nfs/dbraw/zinc/40/43/19/1051404319.db2.gz HORWWPFXAVOUQP-UHFFFAOYSA-N -1 1 303.280 4.414 20 0 DIADMM CC(C)c1cc(Nc2ccc(-n3ccc(=O)[n-]3)cc2)ccc1O ZINC001215849100 1051412234 /nfs/dbraw/zinc/41/22/34/1051412234.db2.gz OIYSPJROXKBNCI-UHFFFAOYSA-N -1 1 309.369 4.151 20 0 DIADMM CSc1cccc(Nc2cc3ccc([O-])cc3oc2=O)c1F ZINC001215867952 1051423828 /nfs/dbraw/zinc/42/38/28/1051423828.db2.gz YJVQGQIBRSJHIQ-UHFFFAOYSA-N -1 1 317.341 4.103 20 0 DIADMM CSc1cc(F)cc(Nc2cc3ccc([O-])cc3oc2=O)c1 ZINC001215903693 1051442751 /nfs/dbraw/zinc/44/27/51/1051442751.db2.gz YNSXIFYIWLJVLP-UHFFFAOYSA-N -1 1 317.341 4.103 20 0 DIADMM CC[C@@H](C)CCCCC(=O)Nc1ccc(-n2ccc(=O)[n-]2)cc1 ZINC001168914863 1051466158 /nfs/dbraw/zinc/46/61/58/1051466158.db2.gz PKLRXLQCNXNDJK-CQSZACIVSA-N -1 1 315.417 4.123 20 0 DIADMM Nc1c(F)c(F)c(F)cc1Nc1cc(Cl)cc(Cl)c1[O-] ZINC001216011072 1051522666 /nfs/dbraw/zinc/52/26/66/1051522666.db2.gz RHRNBGCBBXZXQQ-UHFFFAOYSA-N -1 1 323.101 4.442 20 0 DIADMM Cc1cnc([N-]c2c(F)c(Cl)cc(Br)c2F)o1 ZINC001216026368 1051531880 /nfs/dbraw/zinc/53/18/80/1051531880.db2.gz YNXBCRCRLVTZHE-UHFFFAOYSA-N -1 1 323.524 4.421 20 0 DIADMM Nc1ccc(Nc2ccc(F)c(F)c2[O-])cc1C(F)(F)F ZINC001216054490 1051552566 /nfs/dbraw/zinc/55/25/66/1051552566.db2.gz XLXBQVKVCIEXKR-UHFFFAOYSA-N -1 1 304.218 4.015 20 0 DIADMM O=C(Nc1cc(F)c([O-])cc1Cl)C1[C@H]2CCCCCC[C@H]12 ZINC001157900120 1051587654 /nfs/dbraw/zinc/58/76/54/1051587654.db2.gz RAYOTXFHIMDHER-UWVGGRQHSA-N -1 1 311.784 4.340 20 0 DIADMM [O-]c1c(Cl)nccc1Nc1cc(F)cc(N2CCCCC2)c1 ZINC001216179908 1051614758 /nfs/dbraw/zinc/61/47/58/1051614758.db2.gz LZMSTEAATPNVJA-UHFFFAOYSA-N -1 1 321.783 4.314 20 0 DIADMM CCOc1ccc(C)c(Nc2ccc(-n3ccc(=O)[n-]3)cc2)c1 ZINC001216237150 1051644539 /nfs/dbraw/zinc/64/45/39/1051644539.db2.gz KJFNVZJGCMEYFE-UHFFFAOYSA-N -1 1 309.369 4.029 20 0 DIADMM COc1ccc(C(C)=O)c(Nc2ccc(Cl)c([O-])c2)c1OC ZINC001212592232 1051665944 /nfs/dbraw/zinc/66/59/44/1051665944.db2.gz FULSTYNYYRSZLL-UHFFFAOYSA-N -1 1 321.760 4.009 20 0 DIADMM [O-]c1ccc(Cl)c(Nc2ccc(CO)cc2F)c1Cl ZINC001216274530 1051668815 /nfs/dbraw/zinc/66/88/15/1051668815.db2.gz ZSYNPGNFYDTGMQ-UHFFFAOYSA-N -1 1 302.132 4.074 20 0 DIADMM Cc1nocc1[N-]C(=O)c1sc2cccc(F)c2c1Cl ZINC001130356825 1051682297 /nfs/dbraw/zinc/68/22/97/1051682297.db2.gz FGFWKOWGOCTDMJ-UHFFFAOYSA-N -1 1 310.737 4.243 20 0 DIADMM O=C1CCCc2nc([N-]c3c(Cl)ccnc3Cl)sc21 ZINC001216300414 1051682696 /nfs/dbraw/zinc/68/26/96/1051682696.db2.gz OLGXNGFXZGNALQ-UHFFFAOYSA-N -1 1 314.197 4.108 20 0 DIADMM [O-]c1cc(F)cc(-c2nc(-c3cc(F)cc(Cl)c3)no2)c1 ZINC001216336174 1051705744 /nfs/dbraw/zinc/70/57/44/1051705744.db2.gz MHBSVDAJGTXAKG-UHFFFAOYSA-N -1 1 308.671 4.041 20 0 DIADMM [O-]c1cc(F)cc(-c2nc(-c3ccc(F)cc3Cl)no2)c1 ZINC001216335729 1051706367 /nfs/dbraw/zinc/70/63/67/1051706367.db2.gz BCOQHDJMTIRUJI-UHFFFAOYSA-N -1 1 308.671 4.041 20 0 DIADMM CS[C@@H](C(=O)Nc1ccc([O-])c(Cl)c1)c1ccccc1 ZINC000182860830 1051706414 /nfs/dbraw/zinc/70/64/14/1051706414.db2.gz MBYWLIZTGYZKDK-CQSZACIVSA-N -1 1 307.802 4.088 20 0 DIADMM [O-]c1cc(F)cc(-c2nc(-c3cccc(C(F)(F)F)c3)no2)c1 ZINC001216339490 1051706596 /nfs/dbraw/zinc/70/65/96/1051706596.db2.gz JEULBJKCSDWTFV-UHFFFAOYSA-N -1 1 324.233 4.267 20 0 DIADMM [O-]c1cc(F)cc(-c2nc(-c3ccc4ccccc4c3)no2)c1 ZINC001216339405 1051706756 /nfs/dbraw/zinc/70/67/56/1051706756.db2.gz HIIKYCNRPSKDEO-UHFFFAOYSA-N -1 1 306.296 4.402 20 0 DIADMM [O-]c1cc(F)cc(-c2nc(-c3ccc4sccc4c3)no2)c1 ZINC001216339782 1051707170 /nfs/dbraw/zinc/70/71/70/1051707170.db2.gz MHFVDLXFMAXNDO-UHFFFAOYSA-N -1 1 312.325 4.463 20 0 DIADMM O=C(c1cccc(Nc2c(F)cc([O-])cc2F)c1)C(F)(F)F ZINC001203347026 1051734257 /nfs/dbraw/zinc/73/42/57/1051734257.db2.gz NZHOBBPTFLRUBV-UHFFFAOYSA-N -1 1 317.213 4.159 20 0 DIADMM COc1cc(Nc2cc(Cl)c(C)c(Cl)c2[O-])cnc1F ZINC001216423844 1051758563 /nfs/dbraw/zinc/75/85/63/1051758563.db2.gz MZUSRGBDGHTOHV-UHFFFAOYSA-N -1 1 317.147 4.294 20 0 DIADMM CC(C)c1ccc2c(c1)CCCN2C(=O)c1ccc([O-])c(F)c1 ZINC000767301578 1051784702 /nfs/dbraw/zinc/78/47/02/1051784702.db2.gz VTKHTHYHZZAKKV-UHFFFAOYSA-N -1 1 313.372 4.248 20 0 DIADMM O=C(Nc1ccccc1SC(F)F)c1ccc([O-])c(F)c1 ZINC000767289829 1051784731 /nfs/dbraw/zinc/78/47/31/1051784731.db2.gz FHGIYUJWWIMMAK-UHFFFAOYSA-N -1 1 313.300 4.098 20 0 DIADMM C[C@@H]1CCN(C(=O)c2ccc([O-])c(F)c2)c2ccccc2S1 ZINC000767292302 1051785508 /nfs/dbraw/zinc/78/55/08/1051785508.db2.gz IFFHBSCJTFCFND-LLVKDONJSA-N -1 1 317.385 4.062 20 0 DIADMM [O-]c1c(Nc2cccc(OC(F)(F)F)c2F)ccc(F)c1F ZINC001216524075 1051803514 /nfs/dbraw/zinc/80/35/14/1051803514.db2.gz IFMXEBQEUIAIHT-UHFFFAOYSA-N -1 1 323.192 4.452 20 0 DIADMM CC(C)Oc1ncc(Nc2ccc(Cl)c(Cl)c2[O-])cn1 ZINC001216622755 1051840617 /nfs/dbraw/zinc/84/06/17/1051840617.db2.gz RSCWEQALOBTFCF-UHFFFAOYSA-N -1 1 314.172 4.020 20 0 DIADMM O=c1ccn(-c2ccc(Nc3cccc(C(F)(F)F)c3)cc2)[n-]1 ZINC001173825133 1051845947 /nfs/dbraw/zinc/84/59/47/1051845947.db2.gz WRYLGHOOBSYCDR-UHFFFAOYSA-N -1 1 319.286 4.340 20 0 DIADMM COc1cccc(Nc2ccc(F)c(Br)c2[O-])c1 ZINC001173827020 1051847941 /nfs/dbraw/zinc/84/79/41/1051847941.db2.gz IUZPTUGKAUMDKR-UHFFFAOYSA-N -1 1 312.138 4.046 20 0 DIADMM COc1ccc(Nc2c(Cl)ccc([O-])c2Cl)cc1OC ZINC001173889328 1051890558 /nfs/dbraw/zinc/89/05/58/1051890558.db2.gz CSBGVEAYZFCCIT-UHFFFAOYSA-N -1 1 314.168 4.460 20 0 DIADMM Cc1c(Cl)cccc1-c1noc(-c2c(F)ccc([O-])c2F)n1 ZINC001216921873 1051909157 /nfs/dbraw/zinc/90/91/57/1051909157.db2.gz CGSSTBNEARPSMP-UHFFFAOYSA-N -1 1 322.698 4.349 20 0 DIADMM Cc1cc(-c2noc(-c3c(C)cc(O)cc3[O-])n2)ccc1Cl ZINC001216987517 1051926760 /nfs/dbraw/zinc/92/67/60/1051926760.db2.gz VLNWVXRKJREIMK-UHFFFAOYSA-N -1 1 316.744 4.085 20 0 DIADMM Cc1cc(O)cc([O-])c1-c1nc(-c2cccc3c2CCCC3)no1 ZINC001216987088 1051927725 /nfs/dbraw/zinc/92/77/25/1051927725.db2.gz QCSHMQSVNCUYRW-UHFFFAOYSA-N -1 1 322.364 4.002 20 0 DIADMM CC(=O)Nc1ccc(Nc2c(Cl)ccc([O-])c2Cl)cc1 ZINC001173978432 1051939811 /nfs/dbraw/zinc/93/98/11/1051939811.db2.gz SHBHWRBCJUOYNX-UHFFFAOYSA-N -1 1 311.168 4.401 20 0 DIADMM COc1cccc(Nc2ccc(Cl)c(Cl)c2[O-])c1OC ZINC001174019075 1051952033 /nfs/dbraw/zinc/95/20/33/1051952033.db2.gz QWXZOBUQBFBTID-UHFFFAOYSA-N -1 1 314.168 4.460 20 0 DIADMM O=C(Nc1ccc([O-])c(Cl)c1)Nc1cc(Cl)ccc1F ZINC000190923539 1051953979 /nfs/dbraw/zinc/95/39/79/1051953979.db2.gz QMINKZCERACBQT-UHFFFAOYSA-N -1 1 315.131 4.482 20 0 DIADMM O=C(Nc1ccc([O-])c(Cl)c1)Nc1cc(F)c(F)c(F)c1 ZINC000190967809 1051956910 /nfs/dbraw/zinc/95/69/10/1051956910.db2.gz PHPAYRVKFNYEDM-UHFFFAOYSA-N -1 1 316.666 4.107 20 0 DIADMM COc1ccc2cc([N-]c3nnc(-c4ccco4)o3)ccc2c1 ZINC001174030705 1051957746 /nfs/dbraw/zinc/95/77/46/1051957746.db2.gz VULRZJLLCOGONJ-UHFFFAOYSA-N -1 1 307.309 4.235 20 0 DIADMM [O-]c1c(-c2nc(-c3cccc(F)c3)no2)cc(O)c2ccccc12 ZINC001217159431 1051984724 /nfs/dbraw/zinc/98/47/24/1051984724.db2.gz QKNARCYHTNAGSL-UHFFFAOYSA-N -1 1 322.295 4.107 20 0 DIADMM CC(C)Oc1ccc(Nc2ccc(-n3ccc(=O)[n-]3)cc2)cc1 ZINC001174110541 1051984992 /nfs/dbraw/zinc/98/49/92/1051984992.db2.gz KWWKUQQIBBZGHD-UHFFFAOYSA-N -1 1 309.369 4.109 20 0 DIADMM O=C(Nc1ccc2scnc2c1)Nc1ccc([O-])c(Cl)c1 ZINC000192211055 1052004780 /nfs/dbraw/zinc/00/47/80/1052004780.db2.gz CQVXLNLGRNYZMD-UHFFFAOYSA-N -1 1 319.773 4.299 20 0 DIADMM CCc1cccnc1-c1noc(-c2ccc3sccc3c2[O-])n1 ZINC001217514370 1052078936 /nfs/dbraw/zinc/07/89/36/1052078936.db2.gz PLAMHACANGQBCZ-UHFFFAOYSA-N -1 1 323.377 4.281 20 0 DIADMM O=C(c1c([O-])cccc1Cl)N1CCC[C@@H]1c1ccsc1 ZINC000769689081 1052091910 /nfs/dbraw/zinc/09/19/10/1052091910.db2.gz IUMVZKNCRRJAKS-GFCCVEGCSA-N -1 1 307.802 4.084 20 0 DIADMM CCOc1ccc(N(C)C(=O)c2ccc(C(C)C)cc2[O-])cc1 ZINC000769908524 1052120256 /nfs/dbraw/zinc/12/02/56/1052120256.db2.gz XDZHSWNWGQEIMU-UHFFFAOYSA-N -1 1 313.397 4.191 20 0 DIADMM C[C@H]1CCN(C(=O)c2c([O-])cccc2Cl)[C@H](c2ccco2)C1 ZINC000769931969 1052133119 /nfs/dbraw/zinc/13/31/19/1052133119.db2.gz HODALSPLWUCBQX-AAEUAGOBSA-N -1 1 319.788 4.252 20 0 DIADMM C[C@H]1CCN(C(=O)c2c([O-])cccc2Cl)[C@@H](c2ccco2)C1 ZINC000769931971 1052133252 /nfs/dbraw/zinc/13/32/52/1052133252.db2.gz HODALSPLWUCBQX-WCQYABFASA-N -1 1 319.788 4.252 20 0 DIADMM CCCN(C(=O)c1ncc(C)cc1[O-])[C@H](CC)c1ccccc1 ZINC000494823090 1052137851 /nfs/dbraw/zinc/13/78/51/1052137851.db2.gz WRPAQRQMCUAKDG-MRXNPFEDSA-N -1 1 312.413 4.099 20 0 DIADMM CC(C)(C)OC(=O)c1ccc(Nc2cc([O-])c(F)c(F)c2)cc1 ZINC001174425610 1052154511 /nfs/dbraw/zinc/15/45/11/1052154511.db2.gz FAQYWXVNOHYYHL-UHFFFAOYSA-N -1 1 321.323 4.369 20 0 DIADMM CCCC[C@@H]1CCC[C@@H]1NC(=O)NCc1ccc([O-])c(Cl)c1 ZINC001221757814 1052411820 /nfs/dbraw/zinc/41/18/20/1052411820.db2.gz UBQDPVRTAKMHMF-HIFRSBDPSA-N -1 1 324.852 4.204 20 0 DIADMM COc1cc(-c2cc(F)c([O-])cc2F)ccc1-c1cnc(C)o1 ZINC001222083101 1052439503 /nfs/dbraw/zinc/43/95/03/1052439503.db2.gz NSSMTRZLZCOCSP-UHFFFAOYSA-N -1 1 317.291 4.309 20 0 DIADMM [O-]c1cc(F)c(-c2cccc(-c3ncc4ncccn43)c2)cc1F ZINC001222083141 1052439669 /nfs/dbraw/zinc/43/96/69/1052439669.db2.gz PODLCJGPRYLJES-UHFFFAOYSA-N -1 1 323.302 4.047 20 0 DIADMM CCCOc1ccc(C)c(-c2ccc3[n-]c(C(=O)OC)nc3c2)c1 ZINC001222178979 1052457833 /nfs/dbraw/zinc/45/78/33/1052457833.db2.gz HHAWHUKYZPPPGE-UHFFFAOYSA-N -1 1 324.380 4.114 20 0 DIADMM CCCOc1ccc(C)c(-c2ccc3nc(C(=O)OC)[n-]c3c2)c1 ZINC001222178979 1052457838 /nfs/dbraw/zinc/45/78/38/1052457838.db2.gz HHAWHUKYZPPPGE-UHFFFAOYSA-N -1 1 324.380 4.114 20 0 DIADMM CC1(C)CN(C(=O)c2cc3ccccc3cc2[O-])[C@@H]2CCC[C@H]21 ZINC000393442028 1052484085 /nfs/dbraw/zinc/48/40/85/1052484085.db2.gz OHDUAXLXHXIYPC-IAGOWNOFSA-N -1 1 309.409 4.196 20 0 DIADMM CCC(CC)(OC)c1noc(-c2ccc3ccccc3c2[O-])n1 ZINC000322536225 1052489820 /nfs/dbraw/zinc/48/98/20/1052489820.db2.gz YAUCXLWHCOVHQW-UHFFFAOYSA-N -1 1 312.369 4.257 20 0 DIADMM [O-]c1ccc(-c2nc([C@@H]3CCCc4ccccc43)no2)c(F)c1 ZINC000322836267 1052498055 /nfs/dbraw/zinc/49/80/55/1052498055.db2.gz OUYISFDJRDHHAU-CQSZACIVSA-N -1 1 310.328 4.050 20 0 DIADMM O=C(Nc1ccc2c(c1)Cc1ccccc1-2)c1ccc([O-])cc1F ZINC000325977959 1052505555 /nfs/dbraw/zinc/50/55/55/1052505555.db2.gz ZOVSBZQBFYHLFX-UHFFFAOYSA-N -1 1 319.335 4.355 20 0 DIADMM CCCCCC(C)(C)C(=O)Nc1ccc(-c2cc(=O)[nH][n-]2)cc1 ZINC000763224018 1052548745 /nfs/dbraw/zinc/54/87/45/1052548745.db2.gz ISKQVBQOQNBASL-UHFFFAOYSA-N -1 1 315.417 4.327 20 0 DIADMM CCCN(C(=O)c1ncccc1[O-])[C@H](C)c1cc2ccccc2o1 ZINC000123448568 1052622236 /nfs/dbraw/zinc/62/22/36/1052622236.db2.gz ZHAGDIMAAYONCA-CYBMUJFWSA-N -1 1 324.380 4.147 20 0 DIADMM Oc1c(F)cc(F)c(-c2ccc3sc(=S)[n-]c3c2)c1F ZINC001235998378 1052650392 /nfs/dbraw/zinc/65/03/92/1052650392.db2.gz MRLSYBXTIGUZKB-UHFFFAOYSA-N -1 1 313.325 4.375 20 0 DIADMM O=C(Cc1cccc2ccccc21)Nc1ccc([O-])c(Cl)c1 ZINC000067738975 1052710079 /nfs/dbraw/zinc/71/00/79/1052710079.db2.gz WRYNNMVKIVUFCA-UHFFFAOYSA-N -1 1 311.768 4.380 20 0 DIADMM CC[C@H](c1ccncc1)N(C)C(=O)c1cc2ccccc2cc1[O-] ZINC000128207981 1052712955 /nfs/dbraw/zinc/71/29/55/1052712955.db2.gz VFLOHMONWUGYGC-GOSISDBHSA-N -1 1 320.392 4.164 20 0 DIADMM CCc1cc(=O)[n-]c(SCc2nc(C)c(C(C)(C)C)s2)n1 ZINC000917513005 1052732821 /nfs/dbraw/zinc/73/28/21/1052732821.db2.gz LHXMVTWZQKYJNB-UHFFFAOYSA-N -1 1 323.487 4.099 20 0 DIADMM CC(C)C[C@@H](C)C[C@@H](CC(C)C)OCCCC[P@](=O)([O-])O ZINC001225023676 1052744615 /nfs/dbraw/zinc/74/46/15/1052744615.db2.gz ZPYPMXGKMCVLJR-HZPDHXFCSA-N -1 1 322.426 4.448 20 0 DIADMM CC(=O)c1ccc([O-])cc1O[C@H](c1ccccc1)c1ccccn1 ZINC001225619854 1052809109 /nfs/dbraw/zinc/80/91/09/1052809109.db2.gz YEIJUZBGBNNVKD-HXUWFJFHSA-N -1 1 319.360 4.158 20 0 DIADMM CCOc1ccc([C@H](C)Oc2cc([O-])ccc2C(C)=O)cc1 ZINC001225619155 1052809201 /nfs/dbraw/zinc/80/92/01/1052809201.db2.gz MBNSRJWCKSQADG-ZDUSSCGKSA-N -1 1 300.354 4.134 20 0 DIADMM CC(=O)c1c(O)cc([O-])cc1O[C@H]1CCc2ccc(Cl)cc21 ZINC001225675529 1052815746 /nfs/dbraw/zinc/81/57/46/1052815746.db2.gz XIGHKCAPFZUAGM-HNNXBMFYSA-N -1 1 318.756 4.020 20 0 DIADMM C[C@@H](Oc1ccc(C(=O)c2ccc([O-])cc2)cc1)c1ccco1 ZINC001225807320 1052833601 /nfs/dbraw/zinc/83/36/01/1052833601.db2.gz HHGBOVXHYLIPBL-CYBMUJFWSA-N -1 1 308.333 4.356 20 0 DIADMM C[C@H](Cc1ccco1)Oc1ccc(C(=O)c2ccc([O-])cc2)cc1 ZINC001225808115 1052833700 /nfs/dbraw/zinc/83/37/00/1052833700.db2.gz LMXDYZUTULHXOB-CQSZACIVSA-N -1 1 322.360 4.226 20 0 DIADMM Cc1ccccc1[C@@H](C)Oc1cc([O-])cc2oc(=O)cc(C)c12 ZINC001226487628 1052901780 /nfs/dbraw/zinc/90/17/80/1052901780.db2.gz ZTVGSXCJWFPGJT-CYBMUJFWSA-N -1 1 310.349 4.255 20 0 DIADMM CC[C@@H](Oc1cc([O-])cc2oc(=O)cc(C)c12)c1ccccc1 ZINC001226487704 1052901926 /nfs/dbraw/zinc/90/19/26/1052901926.db2.gz CAEAZFOMWKXKOY-OAHLLOKOSA-N -1 1 310.349 4.337 20 0 DIADMM Cc1cccc2c1CC[C@@H]2Oc1cc([O-])cc2oc(=O)cc(C)c12 ZINC001226487648 1052901947 /nfs/dbraw/zinc/90/19/47/1052901947.db2.gz BFUIUIVMJOIIJG-INIZCTEOSA-N -1 1 322.360 4.182 20 0 DIADMM Cc1cc(=O)oc2cc([O-])cc(O[C@H](C)c3ccc(F)cc3)c12 ZINC001226490351 1052902620 /nfs/dbraw/zinc/90/26/20/1052902620.db2.gz QELLRCQKKZPFSH-LLVKDONJSA-N -1 1 314.312 4.086 20 0 DIADMM Cc1cc(=O)oc2cc([O-])cc(O[C@@H](C)c3cccc(F)c3)c12 ZINC001226488904 1052902692 /nfs/dbraw/zinc/90/26/92/1052902692.db2.gz JGEIBYCZLFFBCL-NSHDSACASA-N -1 1 314.312 4.086 20 0 DIADMM CCOc1ccc(N(C)C(=O)c2cc3ccccc3cc2[O-])cc1 ZINC000155145310 1052905843 /nfs/dbraw/zinc/90/58/43/1052905843.db2.gz CHUVGAUXDVZBAI-UHFFFAOYSA-N -1 1 321.376 4.221 20 0 DIADMM O=C(NCc1cc2ccccc2s1)c1c([O-])cccc1Cl ZINC000920465717 1052941142 /nfs/dbraw/zinc/94/11/42/1052941142.db2.gz XJQXZWQIIXKUGZ-UHFFFAOYSA-N -1 1 317.797 4.190 20 0 DIADMM C[C@H](Oc1[n-]c(=S)ncc1F)c1cccc2ccccc21 ZINC001227383648 1052986878 /nfs/dbraw/zinc/98/68/78/1052986878.db2.gz 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/nfs/dbraw/zinc/02/54/44/1053025444.db2.gz APUVWFIXQWQMCS-QWRGUYRKSA-N -1 1 303.431 4.281 20 0 DIADMM Cc1ccc2c(c1)CC[C@@H]2Oc1[n-]c(=S)nc2cnccc21 ZINC001227880827 1053025465 /nfs/dbraw/zinc/02/54/65/1053025465.db2.gz FYBBPEWBMVRULL-HNNXBMFYSA-N -1 1 309.394 4.062 20 0 DIADMM Cc1ccc2c(c1)[C@H](Oc1[n-]c(=S)nc3cnccc31)CC2 ZINC001227882145 1053025511 /nfs/dbraw/zinc/02/55/11/1053025511.db2.gz UCMJSHJWVRRQNC-OAHLLOKOSA-N -1 1 309.394 4.062 20 0 DIADMM CC(C)[C@@H](Oc1[n-]c(=S)nc2cnccc21)c1ccccc1 ZINC001227884968 1053025811 /nfs/dbraw/zinc/02/58/11/1053025811.db2.gz JSQNGGYODWRLAN-OAHLLOKOSA-N -1 1 311.410 4.463 20 0 DIADMM CC[C@@H](Oc1[n-]c(=S)nc2cnccc21)C1CCCCC1 ZINC001227884999 1053025838 /nfs/dbraw/zinc/02/58/38/1053025838.db2.gz KABCTUKRYFPMOU-CQSZACIVSA-N -1 1 303.431 4.425 20 0 DIADMM C[C@@H](Oc1cc([O-])ccc1C(=O)c1ccccc1)c1ccccn1 ZINC001228185197 1053051473 /nfs/dbraw/zinc/05/14/73/1053051473.db2.gz GKDQKMGORHTGRJ-CQSZACIVSA-N -1 1 319.360 4.158 20 0 DIADMM CC[C@H](C)[C@@H](C)N(C(=O)NCc1ccc([O-])c(Cl)c1)C1CC1 ZINC001313236708 1053096929 /nfs/dbraw/zinc/09/69/29/1053096929.db2.gz OLWLNUOJIRMBLD-NWDGAFQWSA-N -1 1 324.852 4.154 20 0 DIADMM CCC(=O)c1c(O)cc([O-])cc1O[C@@H](CC)c1ccccc1F ZINC001228557559 1053134246 /nfs/dbraw/zinc/13/42/46/1053134246.db2.gz XQUBSYHVAZEPLM-INIZCTEOSA-N -1 1 318.344 4.360 20 0 DIADMM CCC(=O)c1c(O)cc([O-])cc1O[C@H](C)c1cccc(F)c1F ZINC001228556826 1053134665 /nfs/dbraw/zinc/13/46/65/1053134665.db2.gz RYBUKWGGIAEOSX-SECBINFHSA-N -1 1 322.307 4.109 20 0 DIADMM CCC(=O)c1c(O)cc([O-])cc1O[C@@H]1CCc2ccc(C)cc21 ZINC001228560328 1053134702 /nfs/dbraw/zinc/13/47/02/1053134702.db2.gz NEPOMTSRKUWICA-QGZVFWFLSA-N -1 1 312.365 4.065 20 0 DIADMM C[C@@H](Oc1[n-]c(=S)nc2ccccc21)c1ccc(F)c(F)c1 ZINC001228764163 1053178261 /nfs/dbraw/zinc/17/82/61/1053178261.db2.gz GSGCAHHLECRBON-SECBINFHSA-N -1 1 318.348 4.337 20 0 DIADMM O=S(=O)([N-]c1ccccc1)c1ccccc1-c1ccccc1 ZINC000196156995 1053182157 /nfs/dbraw/zinc/18/21/57/1053182157.db2.gz LRCSAKWKGRDYTN-UHFFFAOYSA-N -1 1 309.390 4.154 20 0 DIADMM CCc1ccc2nc(-c3ccnc(OC(C)(C)C)c3)[n-]c(=O)c2c1 ZINC001319678665 1053263152 /nfs/dbraw/zinc/26/31/52/1053263152.db2.gz LZPCZLOFNWIPSZ-UHFFFAOYSA-N -1 1 323.396 4.137 20 0 DIADMM CCC[C@@H](Oc1c([O-])c(OC)cc2ccc(=O)oc21)[C@@H](C)CC ZINC001229215578 1053275894 /nfs/dbraw/zinc/27/58/94/1053275894.db2.gz MAKPMNQGNJXJGV-WCQYABFASA-N -1 1 320.385 4.101 20 0 DIADMM O=C1C[C@@H](c2ccccc2)Oc2cc([O-])cc(O[C@@H]3C=CCC3)c21 ZINC001229231220 1053279620 /nfs/dbraw/zinc/27/96/20/1053279620.db2.gz UDUYTSUDBNWACR-WBVHZDCISA-N -1 1 322.360 4.196 20 0 DIADMM CC[C@@H](Oc1cc(O)ccc1C(=O)c1ccc([O-])cc1)C(C)C ZINC001229296180 1053295675 /nfs/dbraw/zinc/29/56/75/1053295675.db2.gz FRQYQPFEHILNLJ-QGZVFWFLSA-N -1 1 314.381 4.142 20 0 DIADMM [O-]c1cc(OC[C@H]2Cc3ccccc3O2)c(Cl)cc1Cl ZINC001229411522 1053315522 /nfs/dbraw/zinc/31/55/22/1053315522.db2.gz RASULPJZYQKVQX-SNVBAGLBSA-N -1 1 311.164 4.082 20 0 DIADMM C[C@H](Oc1cc([O-])c(Cl)cc1Cl)c1cnc2ccccn21 ZINC001229409137 1053315809 /nfs/dbraw/zinc/31/58/09/1053315809.db2.gz CYABKMRQZAHAOJ-VIFPVBQESA-N -1 1 323.179 4.487 20 0 DIADMM C[C@@H](CC(=O)OC(C)(C)C)Oc1cc([O-])c(Cl)cc1Cl ZINC001229410632 1053316375 /nfs/dbraw/zinc/31/63/75/1053316375.db2.gz LELQYXFOQJKTSR-QMMMGPOBSA-N -1 1 321.200 4.198 20 0 DIADMM O=C(c1ccc(F)c([O-])c1)N1CCC[C@H]1CCC1CCCC1 ZINC001545762757 1053363611 /nfs/dbraw/zinc/36/36/11/1053363611.db2.gz VSMJBRJPFCWJJU-HNNXBMFYSA-N -1 1 305.393 4.106 20 0 DIADMM [O-]c1c(F)cccc1NC(=S)Nc1cccc2ccccc21 ZINC001200102389 1053381761 /nfs/dbraw/zinc/38/17/61/1053381761.db2.gz FHTMXPSSFNDVFQ-UHFFFAOYSA-N -1 1 312.369 4.493 20 0 DIADMM CC1(C)CN(C(=O)c2ccc(Cl)cc2[O-])[C@H]1c1ccccc1 ZINC000619054213 1053423987 /nfs/dbraw/zinc/42/39/87/1053423987.db2.gz OLQJVAVARBVVPJ-INIZCTEOSA-N -1 1 315.800 4.269 20 0 DIADMM Cc1noc(-c2ccccc2)c1[N-]C(=O)c1cc2ncccc2o1 ZINC001435812253 1053690050 /nfs/dbraw/zinc/69/00/50/1053690050.db2.gz STDMXAWMBZTXHO-UHFFFAOYSA-N -1 1 319.320 4.044 20 0 DIADMM CCC[C@H](C)[C@@H](CC)Oc1cccnc1-c1ncccc1[O-] ZINC001231201671 1053700503 /nfs/dbraw/zinc/70/05/03/1053700503.db2.gz BSIZFLCYLCJEIT-DZGCQCFKSA-N -1 1 300.402 4.443 20 0 DIADMM CC[C@@H](C)CC[C@H](C)Oc1cccnc1-c1ncccc1[O-] ZINC001231204886 1053701900 /nfs/dbraw/zinc/70/19/00/1053701900.db2.gz UZXVWYMZSAKDLW-KGLIPLIRSA-N -1 1 300.402 4.443 20 0 DIADMM C[C@H](Oc1ccccc1C(=O)c1ccc([O-])cc1)c1ccccn1 ZINC001231230446 1053708317 /nfs/dbraw/zinc/70/83/17/1053708317.db2.gz LPLSYRUVUXOYSO-AWEZNQCLSA-N -1 1 319.360 4.158 20 0 DIADMM Oc1ccc(C[N@@H+]2CCC[C@H]2c2cccnc2)cc1C(F)(F)F ZINC001231522459 1053777891 /nfs/dbraw/zinc/77/78/91/1053777891.db2.gz GEYBKEJQZPBVJC-HNNXBMFYSA-N -1 1 322.330 4.143 20 0 DIADMM Oc1ccc(C[N@@H+]2CCC[C@@H]2c2cccnc2)cc1C(F)(F)F ZINC001231521977 1053778326 /nfs/dbraw/zinc/77/83/26/1053778326.db2.gz GEYBKEJQZPBVJC-OAHLLOKOSA-N -1 1 322.330 4.143 20 0 DIADMM CC(C)c1nc(CN(C)Cc2ccc(Cl)c([O-])c2)cs1 ZINC001231737453 1053846285 /nfs/dbraw/zinc/84/62/85/1053846285.db2.gz QYPHRGZXMMWKDP-UHFFFAOYSA-N -1 1 310.850 4.258 20 0 DIADMM [O-]c1cc(F)c(F)cc1NC(=S)Nc1ccccc1Cl ZINC001200861786 1054050544 /nfs/dbraw/zinc/05/05/44/1054050544.db2.gz TWBJZBWRGOHMNX-UHFFFAOYSA-N -1 1 314.744 4.133 20 0 DIADMM CCN(C(=O)c1ccc(OC)cc1[O-])c1cccc2ccccc21 ZINC000324164575 1054060633 /nfs/dbraw/zinc/06/06/33/1054060633.db2.gz NPWHUUIJCYZYGO-UHFFFAOYSA-N -1 1 321.376 4.221 20 0 DIADMM [O-]c1c(Cl)ccc(CN2CCC[C@H]3CCC[C@H]32)c1Cl ZINC001232626755 1054088746 /nfs/dbraw/zinc/08/87/46/1054088746.db2.gz AFQHTEZCSBEARK-ZWNOBZJWSA-N -1 1 300.229 4.464 20 0 DIADMM [O-]c1c(Cl)ccc(CN2CCCC3(CCC3)C2)c1Cl ZINC001232628910 1054088790 /nfs/dbraw/zinc/08/87/90/1054088790.db2.gz JFOUBEGHFCPSMU-UHFFFAOYSA-N -1 1 300.229 4.465 20 0 DIADMM C[C@@H]1CCCCCN1Cc1cc(F)c([O-])c(Br)c1 ZINC001232640888 1054092466 /nfs/dbraw/zinc/09/24/66/1054092466.db2.gz SWYUJLPLQGNKCO-SNVBAGLBSA-N -1 1 316.214 4.058 20 0 DIADMM CN(CCc1ccccc1)Cc1ccc(Cl)c([O-])c1Cl ZINC001232624435 1054086975 /nfs/dbraw/zinc/08/69/75/1054086975.db2.gz PDEUAJNYBRLRNM-UHFFFAOYSA-N -1 1 310.224 4.374 20 0 DIADMM [O-]c1c(Cl)ccc(CN2CCC[C@H]3CCC[C@@H]32)c1Cl ZINC001232626754 1054087872 /nfs/dbraw/zinc/08/78/72/1054087872.db2.gz AFQHTEZCSBEARK-MFKMUULPSA-N -1 1 300.229 4.464 20 0 DIADMM [O-]c1c(Cl)ccc(CN2CCc3ccccc3CC2)c1Cl ZINC001232631984 1054087995 /nfs/dbraw/zinc/08/79/95/1054087995.db2.gz UAXBVGPFEWJDDA-UHFFFAOYSA-N -1 1 322.235 4.300 20 0 DIADMM COC(C)(C)[C@H]1CCCN1Cc1ccc(Cl)c([O-])c1Cl ZINC001232631603 1054088171 /nfs/dbraw/zinc/08/81/71/1054088171.db2.gz OCUHVKRYXOPOGA-GFCCVEGCSA-N -1 1 318.244 4.088 20 0 DIADMM COc1ccccc1[C@H](C)N(C)Cc1cccc([O-])c1Cl ZINC001232788560 1054121335 /nfs/dbraw/zinc/12/13/35/1054121335.db2.gz CFYOBWFGNWPZEB-LBPRGKRZSA-N -1 1 305.805 4.247 20 0 DIADMM [O-]c1c(F)ccc(CN2CCC(c3ccccc3F)CC2)c1F ZINC001232935817 1054150092 /nfs/dbraw/zinc/15/00/92/1054150092.db2.gz NDELJOHUDPHUEL-UHFFFAOYSA-N -1 1 321.342 4.189 20 0 DIADMM COc1ccc([C@@H]2CCCN2Cc2ccc(F)c([O-])c2F)cc1 ZINC001232936865 1054153695 /nfs/dbraw/zinc/15/36/95/1054153695.db2.gz YAWROUGIFQOWQZ-INIZCTEOSA-N -1 1 319.351 4.016 20 0 DIADMM CCN(Cc1ccc(Cl)cc1)Cc1ccc(F)c([O-])c1F ZINC001232936949 1054153929 /nfs/dbraw/zinc/15/39/29/1054153929.db2.gz ISFVARBQEAQAKM-UHFFFAOYSA-N -1 1 311.759 4.346 20 0 DIADMM COc1cccc([C@@H]2CCCN2Cc2cc([O-])c(F)c(F)c2)c1 ZINC001232972928 1054161252 /nfs/dbraw/zinc/16/12/52/1054161252.db2.gz HAIAVBMPMPSOHG-INIZCTEOSA-N -1 1 319.351 4.016 20 0 DIADMM Cc1ccc([C@H]2CCC[N@H+]2Cc2cc(Cl)ncc2O)cc1 ZINC001233035514 1054174259 /nfs/dbraw/zinc/17/42/59/1054174259.db2.gz FAAGGIFAMBZGQS-OAHLLOKOSA-N -1 1 302.805 4.086 20 0 DIADMM O=C(Nc1cc(Cl)c([O-])c2ccccc12)C1(CF)CCC1 ZINC001335313804 1054214413 /nfs/dbraw/zinc/21/44/13/1054214413.db2.gz LNQQOSZBPIUUHD-UHFFFAOYSA-N -1 1 307.752 4.277 20 0 DIADMM Cc1ccc(C)c([C@@H]2CCCN2C(=O)c2cc(F)ccc2[O-])c1 ZINC000622440395 1054228501 /nfs/dbraw/zinc/22/85/01/1054228501.db2.gz DAFJFXPVPXNVPE-KRWDZBQOSA-N -1 1 313.372 4.125 20 0 DIADMM CC(C)(C)Oc1c(F)cc(NC(=O)c2ccccc2[O-])cc1F ZINC000622501915 1054253655 /nfs/dbraw/zinc/25/36/55/1054253655.db2.gz ATVGHFOBYFSCFL-UHFFFAOYSA-N -1 1 321.323 4.100 20 0 DIADMM Oc1ccc(F)c(C[NH+]2CCC(Cc3ccccc3)CC2)c1F ZINC001233393097 1054260869 /nfs/dbraw/zinc/26/08/69/1054260869.db2.gz APCUZMSDBCOKJK-UHFFFAOYSA-N -1 1 317.379 4.125 20 0 DIADMM CCC(C)(C)c1ccc(C(=O)Nc2nc(-c3ccco3)n[nH]2)cc1 ZINC001439509061 1054276769 /nfs/dbraw/zinc/27/67/69/1054276769.db2.gz HXONUIJJSYMVPQ-UHFFFAOYSA-N -1 1 324.384 4.005 20 0 DIADMM O=C(NC1CCCCCCC1)c1ccc(C(F)(F)F)c([O-])c1 ZINC001440469784 1054353974 /nfs/dbraw/zinc/35/39/74/1054353974.db2.gz HDPAAOKNYWJCQN-UHFFFAOYSA-N -1 1 315.335 4.254 20 0 DIADMM CCCCCC[C@@](C)(CC)C(=O)Nc1n[n-]c(C(F)(F)F)n1 ZINC001340812844 1054367892 /nfs/dbraw/zinc/36/78/92/1054367892.db2.gz RPNXOISWLDSKFR-CYBMUJFWSA-N -1 1 320.359 4.149 20 0 DIADMM CCC[C@H](CC(C)C)C(=O)Nc1ccc(-c2cc(=O)[nH][n-]2)cc1 ZINC001441194299 1054386873 /nfs/dbraw/zinc/38/68/73/1054386873.db2.gz PTJBOIXRKDSRHX-CQSZACIVSA-N -1 1 315.417 4.183 20 0 DIADMM CCC[C@@H](CC(C)C)C(=O)Nc1ccc(-c2cc(=O)[nH][n-]2)cc1 ZINC001441194296 1054387709 /nfs/dbraw/zinc/38/77/09/1054387709.db2.gz PTJBOIXRKDSRHX-AWEZNQCLSA-N -1 1 315.417 4.183 20 0 DIADMM O=C(Cc1ccc(O[C@H]2C[C@H]3C=C[C@@H]2C3)cc1)c1ccc([O-])cc1 ZINC001233940079 1054394468 /nfs/dbraw/zinc/39/44/68/1054394468.db2.gz AAIKSABKNWKNMV-XPIZARPCSA-N -1 1 320.388 4.161 20 0 DIADMM CSc1ccc([O-])c(C(=O)Nc2c(C)cc(C)cc2C)c1 ZINC001441972326 1054405831 /nfs/dbraw/zinc/40/58/31/1054405831.db2.gz UZPVUYDCCYZPHG-UHFFFAOYSA-N -1 1 301.411 4.292 20 0 DIADMM C[C@H](Cc1ccccc1F)NC(=O)c1cc2ccccc2cc1[O-] ZINC001442095244 1054409646 /nfs/dbraw/zinc/40/96/46/1054409646.db2.gz PHSVTUZZNSAWDG-CYBMUJFWSA-N -1 1 323.367 4.046 20 0 DIADMM CCCC1CCC(NC(=O)c2ncc3ccccc3c2[O-])CC1 ZINC001442217966 1054414367 /nfs/dbraw/zinc/41/43/67/1054414367.db2.gz CDFDLRILEYGABE-UHFFFAOYSA-N -1 1 312.413 4.029 20 0 DIADMM O=C(Nc1ccc([O-])c(Cl)c1)C1CCc2ccccc2CC1 ZINC001545951091 1054430062 /nfs/dbraw/zinc/43/00/62/1054430062.db2.gz FBEVXHWBGVFKFR-UHFFFAOYSA-N -1 1 315.800 4.179 20 0 DIADMM O=C(Nc1cccc(SC(F)F)c1)c1ccc(F)c([O-])c1 ZINC001443168533 1054442993 /nfs/dbraw/zinc/44/29/93/1054442993.db2.gz UHVBVTGUSRZIRB-UHFFFAOYSA-N -1 1 313.300 4.098 20 0 DIADMM O=C(Nc1ccc([O-])c(Cl)c1)c1ccc(F)cc1Cl ZINC000082193088 1054484494 /nfs/dbraw/zinc/48/44/94/1054484494.db2.gz FRJDEJJFDYMYQS-UHFFFAOYSA-N -1 1 300.116 4.090 20 0 DIADMM O=C(N[C@@H]1C[C@H]1C1CCCCC1)c1ccc2ccccc2c1[O-] ZINC001444973881 1054492860 /nfs/dbraw/zinc/49/28/60/1054492860.db2.gz IIIMQMLPZBHWMQ-ZWKOTPCHSA-N -1 1 309.409 4.244 20 0 DIADMM [O-]c1cc(F)c(Cl)cc1-c1ccc(O[C@@H]2CCOC2)cc1 ZINC000623048606 1054522074 /nfs/dbraw/zinc/52/20/74/1054522074.db2.gz JPBLLUBPFZIWRO-GFCCVEGCSA-N -1 1 308.736 4.019 20 0 DIADMM Cc1cc(Br)c([O-])c(NC(=O)C=C2CCCCC2)c1 ZINC001446843378 1054546649 /nfs/dbraw/zinc/54/66/49/1054546649.db2.gz UXYXHSJJNMSJAW-UHFFFAOYSA-N -1 1 324.218 4.292 20 0 DIADMM O=C(Nc1ccc(-c2ccco2)cc1F)c1ccc(F)c([O-])c1 ZINC001448384120 1054594355 /nfs/dbraw/zinc/59/43/55/1054594355.db2.gz GSXXVVUXXLNEDG-UHFFFAOYSA-N -1 1 315.275 4.183 20 0 DIADMM CSc1ccc([O-])c(C(=O)Nc2nc(C3CCC3)cs2)c1 ZINC001448577938 1054600749 /nfs/dbraw/zinc/60/07/49/1054600749.db2.gz JTVJZWMKGBYZQV-UHFFFAOYSA-N -1 1 320.439 4.090 20 0 DIADMM Clc1ccnc2c1CCC[C@@H]2Oc1nc2sccc2[n-]1 ZINC001234856142 1054605536 /nfs/dbraw/zinc/60/55/36/1054605536.db2.gz WJKDSSDCWLVILD-NSHDSACASA-N -1 1 305.790 4.129 20 0 DIADMM CCc1ccc(C(=O)Nc2ccc([O-])c(F)c2F)cc1CC ZINC001449447437 1054620527 /nfs/dbraw/zinc/62/05/27/1054620527.db2.gz LUHLEHWRWGWSHQ-UHFFFAOYSA-N -1 1 305.324 4.048 20 0 DIADMM O=C(CC(C1CCC1)C1CCC1)Nc1cc([O-])c(F)cc1F ZINC001450897463 1054664073 /nfs/dbraw/zinc/66/40/73/1054664073.db2.gz OTWXVNBLVAMSPX-UHFFFAOYSA-N -1 1 309.356 4.215 20 0 DIADMM CC1(C)CCC[C@@H]1[C@@H]1CCN(C(=O)c2cc(Cl)ccc2[O-])C1 ZINC001452131014 1054693861 /nfs/dbraw/zinc/69/38/61/1054693861.db2.gz KNCRUYHBWTVPGL-IUODEOHRSA-N -1 1 321.848 4.334 20 0 DIADMM Cc1ccc(C(=O)Nc2c([O-])cccc2F)c(Cl)c1Cl ZINC001453020338 1054726304 /nfs/dbraw/zinc/72/63/04/1054726304.db2.gz ZCOVAZWCJYDDQZ-UHFFFAOYSA-N -1 1 314.143 4.399 20 0 DIADMM CCCCC[C@H]1CCCCN1C(=O)c1cc(C)cc(C=O)c1[O-] ZINC001453879663 1054749464 /nfs/dbraw/zinc/74/94/64/1054749464.db2.gz BBYORRJXXILHRQ-INIZCTEOSA-N -1 1 317.429 4.088 20 0 DIADMM CC1(C)C[C@]1(NC(=O)c1c([O-])cccc1Cl)c1ccccc1 ZINC001454060975 1054758047 /nfs/dbraw/zinc/75/80/47/1054758047.db2.gz OOFXCPRMFUUHMC-SFHVURJKSA-N -1 1 315.800 4.101 20 0 DIADMM O=C(N[C@H]1CCc2ccc(Cl)cc21)c1ccc(Cl)cc1[O-] ZINC001454343005 1054764458 /nfs/dbraw/zinc/76/44/58/1054764458.db2.gz ASULTZGFJDXRTB-AWEZNQCLSA-N -1 1 322.191 4.116 20 0 DIADMM CC1(C)CN(C(=O)c2cc3ccccc3cc2[O-])[C@H]1c1ccco1 ZINC001454611154 1054775120 /nfs/dbraw/zinc/77/51/20/1054775120.db2.gz AUZWVIRZQIEHKU-SFHVURJKSA-N -1 1 321.376 4.362 20 0 DIADMM Cc1cccc(-c2cncc(C(=O)Nc3cccc(F)c3[O-])c2)c1 ZINC001454759217 1054783382 /nfs/dbraw/zinc/78/33/82/1054783382.db2.gz TUTWEHNSMVGORM-UHFFFAOYSA-N -1 1 322.339 4.154 20 0 DIADMM CSc1ccccc1[N-]C(=O)c1scnc1C(F)F ZINC001350028248 1054853471 /nfs/dbraw/zinc/85/34/71/1054853471.db2.gz OYHTVQWYWBBXIL-UHFFFAOYSA-N -1 1 300.355 4.055 20 0 DIADMM Cc1nc2cc(-c3ccc(Cl)c(C(=O)[O-])c3F)ccc2[nH]1 ZINC001236152720 1054971531 /nfs/dbraw/zinc/97/15/31/1054971531.db2.gz MSPCWVYSCMLWSY-UHFFFAOYSA-N -1 1 304.708 4.029 20 0 DIADMM COc1cc(F)cc2ccc(-c3c(F)ccc(C)c3[O-])nc21 ZINC001236391612 1055090052 /nfs/dbraw/zinc/09/00/52/1055090052.db2.gz PPSCOHVAISPYCF-UHFFFAOYSA-N -1 1 301.292 4.203 20 0 DIADMM Cc1ccc(F)c(-c2cc(Oc3cccc(F)c3)ncn2)c1[O-] ZINC001236392523 1055090306 /nfs/dbraw/zinc/09/03/06/1055090306.db2.gz RZGWYVSTJRMQEQ-UHFFFAOYSA-N -1 1 314.291 4.228 20 0 DIADMM COc1cc2ccnc(-c3c(F)ccc(C)c3[O-])c2cc1F ZINC001236390700 1055090700 /nfs/dbraw/zinc/09/07/00/1055090700.db2.gz GUQMNFXVBZNEBX-UHFFFAOYSA-N -1 1 301.292 4.203 20 0 DIADMM CSc1nc(-c2c(F)ccc(C)c2[O-])cc(C(F)(F)F)n1 ZINC001236394241 1055091052 /nfs/dbraw/zinc/09/10/52/1055091052.db2.gz VLHMPADNKBMBDC-UHFFFAOYSA-N -1 1 318.295 4.037 20 0 DIADMM Cc1ccc(F)c(-c2cccc(NC(=O)OC(C)(C)C)n2)c1[O-] ZINC001236403605 1055096054 /nfs/dbraw/zinc/09/60/54/1055096054.db2.gz KFPJGIZIBJFKTK-UHFFFAOYSA-N -1 1 318.348 4.249 20 0 DIADMM Cc1ccc(NC(=O)c2ccc(C(F)(F)F)cc2[O-])c(C)c1 ZINC001587124068 1055220908 /nfs/dbraw/zinc/22/09/08/1055220908.db2.gz NKQISARZQREZBR-UHFFFAOYSA-N -1 1 309.287 4.280 20 0 DIADMM CC(C)(C)[C@@H]1Cc2ccccc2N(C(=O)c2ccccc2[O-])C1 ZINC001587317603 1055266667 /nfs/dbraw/zinc/26/66/67/1055266667.db2.gz RMTSACPVSUGUGH-OAHLLOKOSA-N -1 1 309.409 4.257 20 0 DIADMM C[C@@H](NC(=O)c1cc2ccccc2cc1[O-])[C@@H](C)c1ccccc1 ZINC001587332439 1055270583 /nfs/dbraw/zinc/27/05/83/1055270583.db2.gz ORKVHLTUDXFINU-HUUCEWRRSA-N -1 1 319.404 4.467 20 0 DIADMM O=C(N[C@@H]1CC[C@@H]2CCCC[C@@H]2C1)c1ccc(Cl)cc1[O-] ZINC001587543203 1055323666 /nfs/dbraw/zinc/32/36/66/1055323666.db2.gz OLHKJZHYHXNTJM-OUCADQQQSA-N -1 1 307.821 4.134 20 0 DIADMM CCC(F)(F)c1ccccc1NC(=O)c1cccc([O-])c1F ZINC001587752891 1055359826 /nfs/dbraw/zinc/35/98/26/1055359826.db2.gz ZXQXXMOGZSAATC-UHFFFAOYSA-N -1 1 309.287 4.285 20 0 DIADMM CC(C)c1ccc([C@@H](NC(=O)c2ncccc2[O-])C(C)C)cc1 ZINC001587811194 1055370928 /nfs/dbraw/zinc/37/09/28/1055370928.db2.gz VTVJFXQNDYISGZ-KRWDZBQOSA-N -1 1 312.413 4.038 20 0 DIADMM C[C@@H](c1cc2ccccc2o1)N(C)C(=O)c1cccc([O-])c1F ZINC001588172496 1055440468 /nfs/dbraw/zinc/44/04/68/1055440468.db2.gz PPAONYQSBQWFIA-NSHDSACASA-N -1 1 313.328 4.111 20 0 DIADMM CC1(C)C[C@@H](NC(=O)c2ccc(Cl)cc2[O-])c2ccccc21 ZINC001588297531 1055467567 /nfs/dbraw/zinc/46/75/67/1055467567.db2.gz YFQOFNOXJUQTFA-OAHLLOKOSA-N -1 1 315.800 4.198 20 0 DIADMM O=C(CC(C1CCC1)C1CCC1)NCc1ccc([O-])c(Cl)c1 ZINC001594566062 1055566450 /nfs/dbraw/zinc/56/64/50/1055566450.db2.gz XWFKPLILVJMHRW-UHFFFAOYSA-N -1 1 321.848 4.268 20 0 DIADMM CCC(F)(F)C(=O)[N-][C@H](C)c1cc(Cl)cc(Cl)c1F ZINC001595110950 1055578849 /nfs/dbraw/zinc/57/88/49/1055578849.db2.gz IDCPPKNIRLPEOX-ZCFIWIBFSA-N -1 1 314.134 4.355 20 0 DIADMM CCC[C@H](NC(=O)NCc1ccc([O-])c(Cl)c1)C(C)(C)C ZINC001564780807 1055597347 /nfs/dbraw/zinc/59/73/47/1055597347.db2.gz OFGIHCTYEISIFV-AWEZNQCLSA-N -1 1 312.841 4.060 20 0 DIADMM C[C@@H]1CCN(C(=O)Cc2ccc([O-])c(Cl)c2)[C@@H]2CCCC[C@@H]12 ZINC001595533605 1055607643 /nfs/dbraw/zinc/60/76/43/1055607643.db2.gz OWQLCLORPHAIDQ-IVMMDQJWSA-N -1 1 321.848 4.015 20 0 DIADMM C[C@@H]1CCN(C(=O)Cc2ccc([O-])c(Cl)c2)[C@H]2CCCC[C@H]12 ZINC001595533607 1055607817 /nfs/dbraw/zinc/60/78/17/1055607817.db2.gz OWQLCLORPHAIDQ-XPKDYRNWSA-N -1 1 321.848 4.015 20 0 DIADMM Cc1cnc(C(=O)N2CCC[C@H]2CCC2CCCCC2)c([O-])c1 ZINC001596041097 1055661278 /nfs/dbraw/zinc/66/12/78/1055661278.db2.gz YLACQFMYUQTUIK-INIZCTEOSA-N -1 1 316.445 4.061 20 0 DIADMM CCC1(CNC(=O)c2ccc(C(F)(F)F)cc2[O-])CCCC1 ZINC001596099578 1055670683 /nfs/dbraw/zinc/67/06/83/1055670683.db2.gz RZUDDVPBVMQPEM-UHFFFAOYSA-N -1 1 315.335 4.111 20 0 DIADMM CN(CCC1CCCCC1)C(=O)NCc1ccc([O-])c(Cl)c1 ZINC001565296871 1055688211 /nfs/dbraw/zinc/68/82/11/1055688211.db2.gz NWDSKOAYTUEDMI-UHFFFAOYSA-N -1 1 324.852 4.157 20 0 DIADMM CC(C)(C)c1ccc([C@H]2CCCN2C(=O)c2ncccc2[O-])cc1 ZINC001596467553 1055713072 /nfs/dbraw/zinc/71/30/72/1055713072.db2.gz PNKUOIQIKGOIEH-MRXNPFEDSA-N -1 1 324.424 4.062 20 0 DIADMM CC(C)[C@H]1CCC[C@@H](NC(=O)c2ccc3ccccc3c2[O-])C1 ZINC001565659307 1055715873 /nfs/dbraw/zinc/71/58/73/1055715873.db2.gz OLEQBFUZEJKPRD-JKSUJKDBSA-N -1 1 311.425 4.490 20 0 DIADMM CC[C@@H](C)N(Cc1ccccc1)C(=O)c1c([O-])cccc1Cl ZINC001565660864 1055716475 /nfs/dbraw/zinc/71/64/75/1055716475.db2.gz LJJLZBLTXSBOHW-CYBMUJFWSA-N -1 1 317.816 4.487 20 0 DIADMM CSc1ccc([O-])c(C(=O)N(C)c2ccc(C)c(Cl)c2)c1 ZINC001565687025 1055719149 /nfs/dbraw/zinc/71/91/49/1055719149.db2.gz YXUZOFBZBFQKQZ-UHFFFAOYSA-N -1 1 321.829 4.353 20 0 DIADMM CC(C)(NC(=O)c1ccc2ccccc2c1[O-])c1cccc(F)c1 ZINC001565738620 1055724231 /nfs/dbraw/zinc/72/42/31/1055724231.db2.gz CYHCZCRUPQGTCP-UHFFFAOYSA-N -1 1 323.367 4.350 20 0 DIADMM CC[C@@H](C)[C@@H]1CCCCN1C(=O)Cc1ccc([O-])c(Cl)c1 ZINC001565889569 1055734537 /nfs/dbraw/zinc/73/45/37/1055734537.db2.gz NZGYSFOFHSBKOI-DOMZBBRYSA-N -1 1 309.837 4.015 20 0 DIADMM CC[C@@H](C)n1nc(NC(=O)c2ccc3ccccc3c2[O-])cc1C ZINC001566870664 1055785633 /nfs/dbraw/zinc/78/56/33/1055785633.db2.gz GTOFIHRAIMWDJK-GFCCVEGCSA-N -1 1 323.396 4.274 20 0 DIADMM CCCc1csc(NC(=O)c2ccc(C(C)C)cc2[O-])n1 ZINC001567197740 1055794230 /nfs/dbraw/zinc/79/42/30/1055794230.db2.gz OQSIFTMXCUAHKJ-UHFFFAOYSA-N -1 1 304.415 4.177 20 0 DIADMM CC(C)c1ccc(C(=O)Nc2cnc3c(c2)CCCC3)c([O-])c1 ZINC001567519470 1055806745 /nfs/dbraw/zinc/80/67/45/1055806745.db2.gz RGRDISJXFHBWBQ-UHFFFAOYSA-N -1 1 310.397 4.042 20 0 DIADMM Cc1c2ccccc2oc1[C@@H](C)NC(=O)c1ccc(F)c([O-])c1 ZINC001567561999 1055807402 /nfs/dbraw/zinc/80/74/02/1055807402.db2.gz MKYUTFVDIQPLJD-LLVKDONJSA-N -1 1 313.328 4.077 20 0 DIADMM CC1(C)CCC[C@@H](NC(=O)c2ccc(C(F)(F)F)cc2[O-])C1 ZINC001567700366 1055813688 /nfs/dbraw/zinc/81/36/88/1055813688.db2.gz IOBZRSWJLQEQEF-LLVKDONJSA-N -1 1 315.335 4.110 20 0 DIADMM C[C@H]1C[C@H](C(C)(C)C)CCN1C(=O)Cc1ccc([O-])c(Cl)c1 ZINC001569936635 1055880360 /nfs/dbraw/zinc/88/03/60/1055880360.db2.gz VYAMYILSCRIJAZ-GXTWGEPZSA-N -1 1 323.864 4.261 20 0 DIADMM CC(C)CN(C(=O)Cc1ccc([O-])c(Cl)c1)C1CCCC1 ZINC001597854733 1055885177 /nfs/dbraw/zinc/88/51/77/1055885177.db2.gz JQHQUZSCQJDKKH-UHFFFAOYSA-N -1 1 309.837 4.015 20 0 DIADMM C[C@@H](C(=O)Nc1cc([O-])c(F)cc1F)c1cccc(Cl)c1 ZINC001570101791 1055886702 /nfs/dbraw/zinc/88/67/02/1055886702.db2.gz LAWSWZXUROHZDF-MRVPVSSYSA-N -1 1 311.715 4.066 20 0 DIADMM O=C(Nc1cc([O-])c(F)cc1F)c1cc2ccc(Cl)cc2[nH]1 ZINC001570101386 1055887158 /nfs/dbraw/zinc/88/71/58/1055887158.db2.gz GPSPJQHWVGWZJI-UHFFFAOYSA-N -1 1 322.698 4.057 20 0 DIADMM Cc1ccc(/C=C\CC(=O)Nc2cc([O-])c(F)cc2F)cc1 ZINC001570101379 1055887218 /nfs/dbraw/zinc/88/72/18/1055887218.db2.gz GMBYDHGRVSMHGO-IHWYPQMZSA-N -1 1 303.308 4.021 20 0 DIADMM C[C@@H](CCC(=O)Nc1cc([O-])c(F)cc1F)c1ccccc1 ZINC001570101538 1055887372 /nfs/dbraw/zinc/88/73/72/1055887372.db2.gz IOSHAVOQOHENJT-NSHDSACASA-N -1 1 305.324 4.193 20 0 DIADMM CC[C@@H](C)[C@H](C(=O)Nc1cc([O-])c(F)cc1F)c1ccccc1 ZINC001570102207 1055887735 /nfs/dbraw/zinc/88/77/35/1055887735.db2.gz VKMQNUHJIOFSCQ-DIFFPNOSSA-N -1 1 319.351 4.439 20 0 DIADMM C[C@H](NC(=O)c1ccc2ccccc2c1[O-])[C@H]1CCC[C@@H](C)C1 ZINC001570370880 1055898498 /nfs/dbraw/zinc/89/84/98/1055898498.db2.gz MLSPOHCOHKEPDL-YCPHGPKFSA-N -1 1 311.425 4.490 20 0 DIADMM CC(C)CCc1ccccc1NC(=O)c1ccc([O-])cc1F ZINC001597959144 1055898796 /nfs/dbraw/zinc/89/87/96/1055898796.db2.gz WALJOVUPIIKIAQ-UHFFFAOYSA-N -1 1 301.361 4.372 20 0 DIADMM Cc1oc(C(C)(C)C)cc1C(=O)Nc1cc(F)cc(F)c1[O-] ZINC001570465832 1055903633 /nfs/dbraw/zinc/90/36/33/1055903633.db2.gz QYZGBTVKDUJUFT-UHFFFAOYSA-N -1 1 309.312 4.122 20 0 DIADMM Cc1cc(C)c(C(=O)Nc2cc(F)c([O-])cc2Cl)c(C)c1 ZINC001598583101 1055957878 /nfs/dbraw/zinc/95/78/78/1055957878.db2.gz XECISXMCSSGMAF-UHFFFAOYSA-N -1 1 307.752 4.362 20 0 DIADMM O=C(Nc1cc(F)c([O-])cc1Cl)c1cc(Cl)cs1 ZINC001598582785 1055958260 /nfs/dbraw/zinc/95/82/60/1055958260.db2.gz OBWMFRRALYUIIV-UHFFFAOYSA-N -1 1 306.145 4.152 20 0 DIADMM O=C(Nc1cc(F)c([O-])cc1Cl)[C@H](F)CC1CCCCC1 ZINC001598591150 1055958960 /nfs/dbraw/zinc/95/89/60/1055958960.db2.gz YPIWNCWXSVEDHI-GFCCVEGCSA-N -1 1 317.763 4.432 20 0 DIADMM Cc1cccc2c(C(=O)Nc3cc(F)c([O-])cc3Cl)coc21 ZINC001598582596 1055959063 /nfs/dbraw/zinc/95/90/63/1055959063.db2.gz FVCUVJRULKCZIH-UHFFFAOYSA-N -1 1 319.719 4.492 20 0 DIADMM Cc1ccc2c(c1)scc2C(=O)Nc1cccc(F)c1[O-] ZINC001587389717 1056003735 /nfs/dbraw/zinc/00/37/35/1056003735.db2.gz PZASSTATDKYJPS-UHFFFAOYSA-N -1 1 301.342 4.307 20 0 DIADMM CC(C)c1ccc(NC(=O)Cc2ccc([O-])c(Cl)c2)cc1 ZINC001540431269 1056029156 /nfs/dbraw/zinc/02/91/56/1056029156.db2.gz XWGFSZDLUZYOKW-UHFFFAOYSA-N -1 1 303.789 4.350 20 0 DIADMM O=C(Cc1ccc([O-])c(Cl)c1)Nc1cccc2ccccc21 ZINC001540508553 1056038791 /nfs/dbraw/zinc/03/87/91/1056038791.db2.gz FEMIONJIRPGKHK-UHFFFAOYSA-N -1 1 311.768 4.380 20 0 DIADMM Cc1ccc(CCCNC(=O)c2cc(Cl)ccc2[O-])c(C)c1 ZINC001540505209 1056038835 /nfs/dbraw/zinc/03/88/35/1056038835.db2.gz WBXJYLMOEBWUBA-UHFFFAOYSA-N -1 1 317.816 4.025 20 0 DIADMM Cc1ccc([C@H](NC(=O)c2cc(Cl)ccc2[O-])C2CC2)cc1 ZINC001540555190 1056042691 /nfs/dbraw/zinc/04/26/91/1056042691.db2.gz AGVYDHXTPWMWOB-KRWDZBQOSA-N -1 1 315.800 4.235 20 0 DIADMM CCc1ccc([C@H](NC(=O)c2cc(F)ccc2[O-])C(C)C)cc1 ZINC001540633467 1056053247 /nfs/dbraw/zinc/05/32/47/1056053247.db2.gz JJJIBZXMJMEYMX-GOSISDBHSA-N -1 1 315.388 4.221 20 0 DIADMM CCc1ccc([C@H](NC(=O)c2ccc([O-])c(F)c2)C(C)C)cc1 ZINC001540633698 1056053470 /nfs/dbraw/zinc/05/34/70/1056053470.db2.gz PSAZPLTXAYRMID-GOSISDBHSA-N -1 1 315.388 4.221 20 0 DIADMM Cc1ccc2c(CC(=O)Nc3ccc([O-])c(Cl)c3)coc2c1 ZINC000111668180 1056057783 /nfs/dbraw/zinc/05/77/83/1056057783.db2.gz VDOLUYHHOAEUME-UHFFFAOYSA-N -1 1 315.756 4.281 20 0 DIADMM CC(C)c1ccc(C(=O)Nc2ccnn2C2CCCC2)c([O-])c1 ZINC001610324509 1056072672 /nfs/dbraw/zinc/07/26/72/1056072672.db2.gz XWHHMFTWERNXHJ-UHFFFAOYSA-N -1 1 313.401 4.080 20 0 DIADMM CCN(C(=O)c1ccc(C(F)(F)F)c([O-])c1)c1cccc(C)c1 ZINC001540769922 1056073801 /nfs/dbraw/zinc/07/38/01/1056073801.db2.gz DRBPUJMSOQMVQQ-UHFFFAOYSA-N -1 1 323.314 4.386 20 0 DIADMM CC[C@H](NC(=O)c1ccc(Cl)cc1[O-])c1ccc(C)cc1 ZINC001610934667 1056080916 /nfs/dbraw/zinc/08/09/16/1056080916.db2.gz MNXCOHALDPJQFO-HNNXBMFYSA-N -1 1 303.789 4.235 20 0 DIADMM Cc1cnc(C(=O)N[C@H](CC(C)(C)C)c2ccccc2)c([O-])c1 ZINC001541069451 1056090535 /nfs/dbraw/zinc/09/05/35/1056090535.db2.gz UGNKNVXOZVGNMY-OAHLLOKOSA-N -1 1 312.413 4.003 20 0 DIADMM C/C(=C/C1CCC(C)CC1)C(=O)Nc1nc(Cl)ccc1[O-] ZINC001611166905 1056120137 /nfs/dbraw/zinc/12/01/37/1056120137.db2.gz QAUSAROUJILBJG-LUAWRHEFSA-N -1 1 308.809 4.152 20 0 DIADMM Cc1cc([N-]S(=O)(=O)c2cccc(F)c2)ccc1C(C)C ZINC000006352365 1056123648 /nfs/dbraw/zinc/12/36/48/1056123648.db2.gz FOMJCOFUPQFDJO-UHFFFAOYSA-N -1 1 307.390 4.058 20 0 DIADMM CN(C(=O)c1cc(Cl)ccc1[O-])[C@H]1CCCc2ccccc21 ZINC001542538957 1056131757 /nfs/dbraw/zinc/13/17/57/1056131757.db2.gz IJXQJQOVPLHKFQ-INIZCTEOSA-N -1 1 315.800 4.195 20 0 DIADMM CC(C)(C)CC(C)(C)NC(=O)c1c([O-])cnc2c(F)cccc21 ZINC001542548755 1056135511 /nfs/dbraw/zinc/13/55/11/1056135511.db2.gz BKTCNEOIWBAIOG-UHFFFAOYSA-N -1 1 318.392 4.024 20 0 DIADMM CC(C)CN(Cc1ccccc1)C(=O)c1ccc(Cl)cc1[O-] ZINC001583718389 1056151779 /nfs/dbraw/zinc/15/17/79/1056151779.db2.gz XOEKBVSCJWFNSD-UHFFFAOYSA-N -1 1 317.816 4.344 20 0 DIADMM CCC(C)(C)C1CCC(NC(=O)c2ccc([O-])cc2F)CC1 ZINC001543158616 1056180803 /nfs/dbraw/zinc/18/08/03/1056180803.db2.gz DLKDDGAWBSFORR-UHFFFAOYSA-N -1 1 307.409 4.256 20 0 DIADMM C[C@@H](CC(C)(C)c1ccccc1)NC(=O)c1c([O-])cccc1F ZINC001583901655 1056199496 /nfs/dbraw/zinc/19/94/96/1056199496.db2.gz LKBAREYCOYFTNF-ZDUSSCGKSA-N -1 1 315.388 4.018 20 0 DIADMM CC(C)Oc1c(Cl)cccc1NC(=O)c1ccc(F)c([O-])c1 ZINC001543340607 1056204758 /nfs/dbraw/zinc/20/47/58/1056204758.db2.gz UOFWJDFBIKAWNC-UHFFFAOYSA-N -1 1 323.751 4.224 20 0 DIADMM CCCCC[C@@H](CC)C(=O)Nc1ccc(-c2cc(=O)[nH][n-]2)cc1 ZINC001543591310 1056259363 /nfs/dbraw/zinc/25/93/63/1056259363.db2.gz JDSGUOPPYIHVBD-CYBMUJFWSA-N -1 1 315.417 4.327 20 0 DIADMM CC(C)C[C@H]1CCCCCN1C(=O)c1cc(Cl)ccc1[O-] ZINC001544064385 1056352726 /nfs/dbraw/zinc/35/27/26/1056352726.db2.gz IJKJDXNLMSHIRF-CQSZACIVSA-N -1 1 309.837 4.477 20 0 DIADMM CCCc1cc(=O)[n-]c(SCc2ccc(Cl)cc2OC)n1 ZINC001613234886 1056361134 /nfs/dbraw/zinc/36/11/34/1056361134.db2.gz UBKLHSQMNMJSTP-UHFFFAOYSA-N -1 1 324.833 4.089 20 0 DIADMM Cc1ccccc1[N-]S(=O)(=O)c1ccc(C)c2ccccc21 ZINC000012291065 1056395907 /nfs/dbraw/zinc/39/59/07/1056395907.db2.gz RXBMGMCHEVZJSC-UHFFFAOYSA-N -1 1 311.406 4.257 20 0 DIADMM COc1cccc([O-])c1C(=O)Nc1ccc2c(c1)C=CCCC2 ZINC001584727940 1056405287 /nfs/dbraw/zinc/40/52/87/1056405287.db2.gz ADTZKOWHWILFKD-UHFFFAOYSA-N -1 1 309.365 4.003 20 0 DIADMM Cc1cnc(SC(c2ccccc2)c2ccccc2)[n-]c1=O ZINC001613808070 1056410000 /nfs/dbraw/zinc/41/00/00/1056410000.db2.gz DBEVIXHBHJGXDV-UHFFFAOYSA-N -1 1 308.406 4.372 20 0 DIADMM CCN(C(=O)c1ccc(F)c([O-])c1)c1ccc2ccccc2c1 ZINC001544609586 1056465806 /nfs/dbraw/zinc/46/58/06/1056465806.db2.gz SWKVWJREKORHGU-UHFFFAOYSA-N -1 1 309.340 4.351 20 0 DIADMM CCCC[C@H](CC)CCCN(C)C(=O)c1ncc(C)cc1[O-] ZINC001585044644 1056472406 /nfs/dbraw/zinc/47/24/06/1056472406.db2.gz XSZTYGQHYFEHOM-HNNXBMFYSA-N -1 1 306.450 4.164 20 0 DIADMM O=C(NC1CCC(C2CCC2)CC1)c1cc(Cl)ccc1[O-] ZINC001585066822 1056479326 /nfs/dbraw/zinc/47/93/26/1056479326.db2.gz HVJSFVZOYYWDTJ-UHFFFAOYSA-N -1 1 307.821 4.134 20 0 DIADMM CCn1cccc1C(=O)Nc1cc(Cl)c([O-])c2ccccc12 ZINC001585193177 1056504403 /nfs/dbraw/zinc/50/44/03/1056504403.db2.gz NRXZJTOCMHQKAD-UHFFFAOYSA-N -1 1 314.772 4.273 20 0 DIADMM [O-]c1c(F)cc(Nc2cnccc2Br)cc1Cl ZINC001214482651 1056554144 /nfs/dbraw/zinc/55/41/44/1056554144.db2.gz GWEBGECKZAJDHJ-UHFFFAOYSA-N -1 1 317.545 4.086 20 0 DIADMM [O-]c1c(F)cc(Nc2cccnc2C(F)(F)F)cc1Cl ZINC001214482724 1056556912 /nfs/dbraw/zinc/55/69/12/1056556912.db2.gz KNZKKGAZIXXLRD-UHFFFAOYSA-N -1 1 306.646 4.342 20 0 DIADMM [O-]c1ccc(F)cc1-c1ccc(-c2c[nH]c3ccccc32)nn1 ZINC001240693666 1056645657 /nfs/dbraw/zinc/64/56/57/1056645657.db2.gz FJLOBWOVTILMGW-UHFFFAOYSA-N -1 1 305.312 4.137 20 0 DIADMM [O-]c1ccc(F)cc1-c1nc(C(F)(F)F)nc2ccccc21 ZINC001240694156 1056645748 /nfs/dbraw/zinc/64/57/48/1056645748.db2.gz OUMKTMLSFBDMLH-UHFFFAOYSA-N -1 1 308.234 4.160 20 0 DIADMM [O-]c1ccc(F)cc1-c1nc(-c2cccnc2)nc2sccc21 ZINC001240696267 1056648032 /nfs/dbraw/zinc/64/80/32/1056648032.db2.gz KRJVYVBQHKYFNG-UHFFFAOYSA-N -1 1 323.352 4.265 20 0 DIADMM CC(C)[C@@H]1CCCCN1C(=O)c1ccc(C(F)(F)F)c([O-])c1 ZINC001586091155 1056669355 /nfs/dbraw/zinc/66/93/55/1056669355.db2.gz LBWLOFYSHHVHIB-ZDUSSCGKSA-N -1 1 315.335 4.062 20 0 DIADMM CCOc1cc(C(=O)Nc2ccc(C)c(C)c2)cc(Cl)c1[O-] ZINC000215926516 1056673054 /nfs/dbraw/zinc/67/30/54/1056673054.db2.gz AEJVPYIELBQQJI-UHFFFAOYSA-N -1 1 319.788 4.313 20 0 DIADMM [O-]c1c(F)cc(Nc2cc(O)c(Cl)cc2F)cc1Cl ZINC001214489209 1056691769 /nfs/dbraw/zinc/69/17/69/1056691769.db2.gz XXMMYXXGLUSECV-UHFFFAOYSA-N -1 1 306.095 4.426 20 0 DIADMM CC[C@H]1c2ccccc2CCN1C(=O)c1cc(Cl)ccc1[O-] ZINC001586204844 1056692295 /nfs/dbraw/zinc/69/22/95/1056692295.db2.gz NYARRNDYHDVNCY-INIZCTEOSA-N -1 1 315.800 4.195 20 0 DIADMM COC(=O)c1cccc(Nc2cc(F)c([O-])c(Cl)c2)c1C ZINC001214489208 1056692599 /nfs/dbraw/zinc/69/25/99/1056692599.db2.gz XWEWAVIPPVULMV-UHFFFAOYSA-N -1 1 309.724 4.023 20 0 DIADMM CC[C@@H](C)[C@H]([N-]C(=O)C(F)(F)c1ccccc1C)C(F)(F)F ZINC001586211950 1056694134 /nfs/dbraw/zinc/69/41/34/1056694134.db2.gz HQLJVYZJANWZIX-SKDRFNHKSA-N -1 1 323.305 4.180 20 0 DIADMM [O-]c1ccc(-c2ccc(Oc3ccc(F)cc3F)nn2)cc1F ZINC001240783684 1056696869 /nfs/dbraw/zinc/69/68/69/1056696869.db2.gz XSYLVGKAIPSPDA-UHFFFAOYSA-N -1 1 318.254 4.059 20 0 DIADMM CC(C)[C@H]1CCC[C@@H](NC(=O)c2cc3ccccc3cc2[O-])C1 ZINC001616662383 1056696837 /nfs/dbraw/zinc/69/68/37/1056696837.db2.gz VWHSMYLSJHLRPG-WMLDXEAASA-N -1 1 311.425 4.490 20 0 DIADMM [O-]c1ccc(-c2ncc(F)c(Oc3cccc(F)c3)n2)cc1F ZINC001240786646 1056697506 /nfs/dbraw/zinc/69/75/06/1056697506.db2.gz YCUZPVLKVUHFNA-UHFFFAOYSA-N -1 1 318.254 4.059 20 0 DIADMM [O-]c1ccc(-c2ncccc2OCc2ccc(F)cc2)cc1F ZINC001240785682 1056697542 /nfs/dbraw/zinc/69/75/42/1056697542.db2.gz APGLVYIYUWGBTF-UHFFFAOYSA-N -1 1 313.303 4.311 20 0 DIADMM CC(C)C[C@@H](NCc1ccc(-c2ccc(Cl)cc2)o1)C(=O)[O-] ZINC000113401663 1056719285 /nfs/dbraw/zinc/71/92/85/1056719285.db2.gz MXVXGKZOSGKVDJ-OAHLLOKOSA-N -1 1 321.804 4.189 20 0 DIADMM COC(=O)[C@H](C)c1ccc(Nc2cc(F)c([O-])c(Cl)c2)cc1 ZINC001214491638 1056726156 /nfs/dbraw/zinc/72/61/56/1056726156.db2.gz HGXOSXISRDWMIO-SECBINFHSA-N -1 1 323.751 4.205 20 0 DIADMM O=C([O-])c1ccc(-c2ccc(F)c(CN3CCCCC3)c2)s1 ZINC001240849455 1056728386 /nfs/dbraw/zinc/72/83/86/1056728386.db2.gz RARGTAGNRLIZHH-UHFFFAOYSA-N -1 1 319.401 4.238 20 0 DIADMM CCOC(=O)Cc1cccc(Nc2cc(F)c([O-])c(Cl)c2)c1 ZINC001214494716 1056737110 /nfs/dbraw/zinc/73/71/10/1056737110.db2.gz XSDBYNDXAXGCNO-UHFFFAOYSA-N -1 1 323.751 4.034 20 0 DIADMM CC(C)c1ccc(CCNC(=O)c2ccc(Cl)cc2[O-])cc1 ZINC001586860955 1056820902 /nfs/dbraw/zinc/82/09/02/1056820902.db2.gz BCPOFSTVWRUXLE-UHFFFAOYSA-N -1 1 317.816 4.142 20 0 DIADMM CC(C)[C@@H](NC(=O)c1ccc([O-])cc1F)c1ccccc1Cl ZINC001617416956 1056829816 /nfs/dbraw/zinc/82/98/16/1056829816.db2.gz RKQLXTIOIZSTNL-MRXNPFEDSA-N -1 1 321.779 4.312 20 0 DIADMM Cc1ccc(-c2ncc(F)c(Oc3ccccc3F)n2)c([O-])c1 ZINC001241036414 1056834297 /nfs/dbraw/zinc/83/42/97/1056834297.db2.gz XJZUCMQERJTKBR-UHFFFAOYSA-N -1 1 314.291 4.228 20 0 DIADMM Cc1cc(C)cc(NC(=O)c2ccc(C(F)(F)F)c([O-])c2)c1 ZINC001586957121 1056838292 /nfs/dbraw/zinc/83/82/92/1056838292.db2.gz LODLWYSDMYRFKV-UHFFFAOYSA-N -1 1 309.287 4.280 20 0 DIADMM CSc1nc2ccccc2c(-c2c(F)cc([O-])cc2F)n1 ZINC001241118104 1056904406 /nfs/dbraw/zinc/90/44/06/1056904406.db2.gz HLQRMWDQYXKTGY-UHFFFAOYSA-N -1 1 304.321 4.003 20 0 DIADMM COc1ccc2c(C)cc(-c3c(F)cc([O-])cc3F)nc2c1 ZINC001241118047 1056904831 /nfs/dbraw/zinc/90/48/31/1056904831.db2.gz DOZRDZSQRAYPIX-UHFFFAOYSA-N -1 1 301.292 4.203 20 0 DIADMM [O-]c1cc(F)c(-c2ccnc(OCc3ccccc3)c2)c(F)c1 ZINC001241119471 1056904886 /nfs/dbraw/zinc/90/48/86/1056904886.db2.gz PBUNOHHYKQLCFO-UHFFFAOYSA-N -1 1 313.303 4.311 20 0 DIADMM Cc1ccc2c(F)c(F)cc(-c3c(F)cc([O-])cc3F)c2n1 ZINC001241120928 1056906632 /nfs/dbraw/zinc/90/66/32/1056906632.db2.gz SPYNBZITCKVJAS-UHFFFAOYSA-N -1 1 307.246 4.472 20 0 DIADMM [O-]c1cc(F)c(-c2nccc3c4c([nH]c32)CCCC4)c(F)c1 ZINC001241120324 1056907088 /nfs/dbraw/zinc/90/70/88/1056907088.db2.gz ZRARHQRGQNNQKS-UHFFFAOYSA-N -1 1 300.308 4.093 20 0 DIADMM [O-]c1cc(F)c(-c2ccc(OCc3ccccc3)nc2)c(F)c1 ZINC001241120623 1056907110 /nfs/dbraw/zinc/90/71/10/1056907110.db2.gz DBXDUAWFAZGQDV-UHFFFAOYSA-N -1 1 313.303 4.311 20 0 DIADMM [O-]c1cc(F)c(-c2cncc(OCc3ccccc3)c2)c(F)c1 ZINC001241121049 1056907167 /nfs/dbraw/zinc/90/71/67/1056907167.db2.gz ZUOBLZIHPQPQIS-UHFFFAOYSA-N -1 1 313.303 4.311 20 0 DIADMM CSc1ncc2cc(-c3c(F)cc([O-])cc3F)ccc2n1 ZINC001241120598 1056907379 /nfs/dbraw/zinc/90/73/79/1056907379.db2.gz CCLJJICIGRPYJM-UHFFFAOYSA-N -1 1 304.321 4.003 20 0 DIADMM COc1cc2ccnc(-c3c(F)cc([O-])cc3F)c2cc1F ZINC001241120282 1056907465 /nfs/dbraw/zinc/90/74/65/1056907465.db2.gz XZUMCCYXDOQIPY-UHFFFAOYSA-N -1 1 305.255 4.033 20 0 DIADMM [O-]c1cc(F)c(-c2ccc3nnc(-c4ccccc4)n3c2)c(F)c1 ZINC001241122208 1056907561 /nfs/dbraw/zinc/90/75/61/1056907561.db2.gz XCSSAXHDPUCCQJ-UHFFFAOYSA-N -1 1 323.302 4.047 20 0 DIADMM C[C@H](CC1CCCCC1)NC(=O)c1ncc2ccccc2c1[O-] ZINC001618191683 1056931133 /nfs/dbraw/zinc/93/11/33/1056931133.db2.gz KMEALUVXRISKGI-CYBMUJFWSA-N -1 1 312.413 4.029 20 0 DIADMM Cc1ccc([C@H](c2noc(-c3ccc(N)cc3[O-])n2)C(C)C)cc1 ZINC000843230929 1056966977 /nfs/dbraw/zinc/96/69/77/1056966977.db2.gz ULCDGDYAUWDQKT-QGZVFWFLSA-N -1 1 323.396 4.121 20 0 DIADMM Cc1ccc([C@@H](c2noc(-c3ccc(N)cc3[O-])n2)C(C)C)cc1 ZINC000843230927 1056967316 /nfs/dbraw/zinc/96/73/16/1056967316.db2.gz ULCDGDYAUWDQKT-KRWDZBQOSA-N -1 1 323.396 4.121 20 0 DIADMM O=C([O-])c1cc(-c2ccc3nc(C(F)(F)F)[nH]c3c2)ccc1F ZINC001241245015 1056978141 /nfs/dbraw/zinc/97/81/41/1056978141.db2.gz COMLJTKQLWLOFJ-UHFFFAOYSA-N -1 1 324.233 4.086 20 0 DIADMM [O-]c1cc(F)cc(-c2ncc3ccc(C(F)(F)F)cc3n2)c1 ZINC001241256079 1056982895 /nfs/dbraw/zinc/98/28/95/1056982895.db2.gz MHDICCJEBGPCNW-UHFFFAOYSA-N -1 1 308.234 4.160 20 0 DIADMM Cc1cc(-c2ccccc2F)nnc1-c1c(F)ccc([O-])c1F ZINC001241290745 1056998512 /nfs/dbraw/zinc/99/85/12/1056998512.db2.gz FPXCWRANDXWTAI-UHFFFAOYSA-N -1 1 316.282 4.242 20 0 DIADMM Cc1ccc(-c2ccc(-c3c(F)ccc([O-])c3F)nn2)s1 ZINC001241290015 1056998685 /nfs/dbraw/zinc/99/86/85/1056998685.db2.gz JEXFDGRBKAGQSH-UHFFFAOYSA-N -1 1 304.321 4.164 20 0 DIADMM CCc1cc(-c2c(F)ccc([O-])c2F)nnc1-c1ccccc1 ZINC001241289741 1056998716 /nfs/dbraw/zinc/99/87/16/1056998716.db2.gz CLHDMEQLZTZBIH-UHFFFAOYSA-N -1 1 312.319 4.357 20 0 DIADMM [O-]c1ccc(F)c(-c2cc(Oc3cccc(F)c3)ncn2)c1F ZINC001241289128 1056998804 /nfs/dbraw/zinc/99/88/04/1056998804.db2.gz LTHFHIIIQNYREU-UHFFFAOYSA-N -1 1 318.254 4.059 20 0 DIADMM CSc1ccc(C(F)(F)F)nc1-c1c(F)ccc([O-])c1F ZINC001241289095 1056998991 /nfs/dbraw/zinc/99/89/91/1056998991.db2.gz KLJFFJXXRGCFLU-UHFFFAOYSA-N -1 1 321.270 4.473 20 0 DIADMM [O-]c1ccc(F)c(-c2ncc(F)c(Oc3ccccc3)n2)c1F ZINC001241291848 1056999851 /nfs/dbraw/zinc/99/98/51/1056999851.db2.gz ZQKKZELPFIBSGV-UHFFFAOYSA-N -1 1 318.254 4.059 20 0 DIADMM CC(C)(C)[C@@H]1CCc2nnc(-c3c(F)ccc([O-])c3F)cc2C1 ZINC001241291585 1056999873 /nfs/dbraw/zinc/99/98/73/1056999873.db2.gz RHWDCLCAEXISIR-LLVKDONJSA-N -1 1 318.367 4.278 20 0 DIADMM CC(C)(C)OC(=O)Nc1cccc(-c2c(F)ccc([O-])c2F)n1 ZINC001241293309 1057000980 /nfs/dbraw/zinc/00/09/80/1057000980.db2.gz RLGUNRPBKJOMMN-UHFFFAOYSA-N -1 1 322.311 4.079 20 0 DIADMM CCOC(=O)c1nc2ccc(-c3cc(Cl)ccc3F)cc2[n-]1 ZINC001241333105 1057017480 /nfs/dbraw/zinc/01/74/80/1057017480.db2.gz WNNRBPJSKMITEY-UHFFFAOYSA-N -1 1 318.735 4.199 20 0 DIADMM CCOC(=O)c1nc2cc(-c3cc(Cl)ccc3F)ccc2[n-]1 ZINC001241333105 1057017483 /nfs/dbraw/zinc/01/74/83/1057017483.db2.gz WNNRBPJSKMITEY-UHFFFAOYSA-N -1 1 318.735 4.199 20 0 DIADMM CCOC(=O)c1nc2cc(-c3cc(C)c(C)cc3C)ccc2[n-]1 ZINC001241635756 1057116986 /nfs/dbraw/zinc/11/69/86/1057116986.db2.gz XUQVSYKMYHDUAD-UHFFFAOYSA-N -1 1 308.381 4.332 20 0 DIADMM CCOC(=O)c1nc2ccc(-c3cc(C)c(C)cc3C)cc2[n-]1 ZINC001241635756 1057117002 /nfs/dbraw/zinc/11/70/02/1057117002.db2.gz XUQVSYKMYHDUAD-UHFFFAOYSA-N -1 1 308.381 4.332 20 0 DIADMM O=C(/C=C\c1ccccc1Cl)Nc1ccc([O-])c(Cl)c1 ZINC000701177048 1057245949 /nfs/dbraw/zinc/24/59/49/1057245949.db2.gz RROHIQWVEIWZLV-YVMONPNESA-N -1 1 308.164 4.351 20 0 DIADMM Cc1cccc2nc(-c3ccc(OC(C)(C)C)cc3)[n-]c(=O)c12 ZINC000485351219 1057269337 /nfs/dbraw/zinc/26/93/37/1057269337.db2.gz URDMBVOXSYYUPI-UHFFFAOYSA-N -1 1 308.381 4.076 20 0 DIADMM COc1ccc2ncc(-c3cc(C(F)(F)F)ccc3[O-])nc2c1 ZINC001242131109 1057273649 /nfs/dbraw/zinc/27/36/49/1057273649.db2.gz BSFYMLBUGXSUPB-UHFFFAOYSA-N -1 1 320.270 4.030 20 0 DIADMM Cc1nc2ccccc2c(-c2cc(C(F)(F)F)ccc2[O-])n1 ZINC001242131566 1057273785 /nfs/dbraw/zinc/27/37/85/1057273785.db2.gz MZCDMQNMWFESEQ-UHFFFAOYSA-N -1 1 304.271 4.330 20 0 DIADMM Cc1cc(-c2cc(C(F)(F)F)ccc2[O-])nc(-c2ccco2)n1 ZINC001242133876 1057274765 /nfs/dbraw/zinc/27/47/65/1057274765.db2.gz MKWMAPTXEBNTPG-UHFFFAOYSA-N -1 1 320.270 4.436 20 0 DIADMM [O-]c1ccc(C(F)(F)F)cc1-c1cc(-c2ccco2)ncn1 ZINC001242134103 1057274840 /nfs/dbraw/zinc/27/48/40/1057274840.db2.gz SRUHXJJNSZGVED-UHFFFAOYSA-N -1 1 306.243 4.128 20 0 DIADMM Cn1cccc1-c1ccc(-c2cc(C(F)(F)F)ccc2[O-])nc1 ZINC001242133911 1057274999 /nfs/dbraw/zinc/27/49/99/1057274999.db2.gz NXPVEESWRPRWNI-UHFFFAOYSA-N -1 1 318.298 4.479 20 0 DIADMM Cc1nc(-c2ccc([O-])c(C(F)(F)F)c2)cc(C(F)(F)F)n1 ZINC001242151448 1057280700 /nfs/dbraw/zinc/28/07/00/1057280700.db2.gz OOXSCNMKBMZSAT-UHFFFAOYSA-N -1 1 322.208 4.195 20 0 DIADMM Cc1nc2ccccc2c(-c2ccc([O-])c(C(F)(F)F)c2)n1 ZINC001242151621 1057281103 /nfs/dbraw/zinc/28/11/03/1057281103.db2.gz SCGXWLGTUUBLLR-UHFFFAOYSA-N -1 1 304.271 4.330 20 0 DIADMM COc1ccc2ncc(-c3ccc([O-])c(C(F)(F)F)c3)nc2c1 ZINC001242151072 1057281121 /nfs/dbraw/zinc/28/11/21/1057281121.db2.gz FRNGGECWIBSFSQ-UHFFFAOYSA-N -1 1 320.270 4.030 20 0 DIADMM [O-]c1cc(F)ccc1-c1ccc(O[C@@H]2CCCCO2)cc1F ZINC001242219896 1057298068 /nfs/dbraw/zinc/29/80/68/1057298068.db2.gz WGGSVXVCZJITLS-QGZVFWFLSA-N -1 1 306.308 4.243 20 0 DIADMM Cc1cccc(-c2ncc(F)c(Oc3ccccc3C)n2)c1[O-] ZINC001242345268 1057340182 /nfs/dbraw/zinc/34/01/82/1057340182.db2.gz NNQWYZNIBYVVFQ-UHFFFAOYSA-N -1 1 310.328 4.397 20 0 DIADMM COc1cc(C(=O)OC(C)(C)C)ccc1-c1cccc(F)c1[O-] ZINC001242352894 1057342149 /nfs/dbraw/zinc/34/21/49/1057342149.db2.gz UUSUZADXDLBGFZ-UHFFFAOYSA-N -1 1 318.344 4.162 20 0 DIADMM COc1ccc(OC(F)(F)F)c(-c2cccc(F)c2[O-])c1 ZINC001242353279 1057342755 /nfs/dbraw/zinc/34/27/55/1057342755.db2.gz YAFXRBWWGORPBJ-UHFFFAOYSA-N -1 1 302.223 4.106 20 0 DIADMM COCCCOc1cc(-c2cccc(Cl)c2[O-])ccc1OC ZINC001242366650 1057348719 /nfs/dbraw/zinc/34/87/19/1057348719.db2.gz RJVDJUKBZNLVFB-UHFFFAOYSA-N -1 1 322.788 4.137 20 0 DIADMM [O-]c1c(Cl)cccc1-c1cnc2nc(C(F)(F)F)oc2c1 ZINC001242367178 1057348813 /nfs/dbraw/zinc/34/88/13/1057348813.db2.gz YGCNAZIUVUKGDP-UHFFFAOYSA-N -1 1 314.650 4.268 20 0 DIADMM COC(=O)c1ccc2cc(-c3cccc(Cl)c3[O-])ccc2n1 ZINC001242367715 1057349040 /nfs/dbraw/zinc/34/90/40/1057349040.db2.gz QPGLXLJISWSBEV-UHFFFAOYSA-N -1 1 313.740 4.047 20 0 DIADMM COc1cc(-c2cccc([O-])c2Cl)nc(-c2ccccc2)n1 ZINC001242796842 1057478893 /nfs/dbraw/zinc/47/88/93/1057478893.db2.gz BFIGCIWZGZDKGL-UHFFFAOYSA-N -1 1 312.756 4.178 20 0 DIADMM [O-]c1cccc(-c2nccc(-c3ccc(F)cc3)n2)c1Cl ZINC001242798774 1057481192 /nfs/dbraw/zinc/48/11/92/1057481192.db2.gz ZHTJGECMIIRFJO-UHFFFAOYSA-N -1 1 300.720 4.309 20 0 DIADMM COc1ncc(-c2cccc([O-])c2Cl)cc1C(F)(F)F ZINC001242800674 1057481765 /nfs/dbraw/zinc/48/17/65/1057481765.db2.gz QSVUYIOYIDSFQG-UHFFFAOYSA-N -1 1 303.667 4.135 20 0 DIADMM [O-]c1cccc(-c2nc(-c3ccncc3)nc3c2CCC3)c1Cl ZINC001242800845 1057481799 /nfs/dbraw/zinc/48/17/99/1057481799.db2.gz KDBWXYHURYDBTI-UHFFFAOYSA-N -1 1 323.783 4.053 20 0 DIADMM CC(=O)N1CCCc2cc(-c3cccc([O-])c3Cl)ccc21 ZINC001242800306 1057482238 /nfs/dbraw/zinc/48/22/38/1057482238.db2.gz GBBWJBHLYULMPJ-UHFFFAOYSA-N -1 1 301.773 4.012 20 0 DIADMM COc1ccc(-c2ccnc(-c3cccc([O-])c3Cl)n2)cc1 ZINC001242800593 1057482274 /nfs/dbraw/zinc/48/22/74/1057482274.db2.gz JUFIGJNDFBRDLB-UHFFFAOYSA-N -1 1 312.756 4.178 20 0 DIADMM CCc1cc(-c2cccc([O-])c2Cl)nc(-c2ccccn2)n1 ZINC001242801475 1057482310 /nfs/dbraw/zinc/48/23/10/1057482310.db2.gz RJSOACUQPCAROK-UHFFFAOYSA-N -1 1 311.772 4.127 20 0 DIADMM [O-]c1cccc(-c2ccnc(OCc3cccnc3)c2)c1Cl ZINC001242803189 1057482944 /nfs/dbraw/zinc/48/29/44/1057482944.db2.gz OOVHVUSVYZOALY-UHFFFAOYSA-N -1 1 312.756 4.082 20 0 DIADMM Cc1cc(-c2cccc([O-])c2Cl)cnc1C(=O)OC(C)(C)C ZINC001242803219 1057482951 /nfs/dbraw/zinc/48/29/51/1057482951.db2.gz WAIXUZUAZRBJTJ-UHFFFAOYSA-N -1 1 319.788 4.371 20 0 DIADMM CC(C)(C)OC(=O)Nc1ccc(-c2cccc([O-])c2Cl)cn1 ZINC001242802605 1057483033 /nfs/dbraw/zinc/48/30/33/1057483033.db2.gz MZYZIARGMCBWLX-UHFFFAOYSA-N -1 1 320.776 4.455 20 0 DIADMM Cc1cc2nc[nH]c2cc1-c1ccc(C(=O)[O-])c(C(F)(F)F)c1 ZINC001243155376 1057588323 /nfs/dbraw/zinc/58/83/23/1057588323.db2.gz JXEFMBDHFDJCBH-UHFFFAOYSA-N -1 1 320.270 4.255 20 0 DIADMM [O-]c1ccc(-c2ccc(SC(F)(F)F)cn2)c(F)c1F ZINC001243338231 1057651476 /nfs/dbraw/zinc/65/14/76/1057651476.db2.gz CSUCHLFVRAYVJQ-UHFFFAOYSA-N -1 1 307.243 4.344 20 0 DIADMM [O-]c1ccc(-c2cc(C(F)(F)F)c3c(n2)CCC3)c(F)c1F ZINC001243338913 1057652191 /nfs/dbraw/zinc/65/21/91/1057652191.db2.gz KNQUSWLKDDMZGW-UHFFFAOYSA-N -1 1 315.241 4.240 20 0 DIADMM COC(=O)c1cc2ccc(-c3ccc([O-])c(F)c3F)cc2s1 ZINC001243342748 1057652709 /nfs/dbraw/zinc/65/27/09/1057652709.db2.gz SGNRDMRKTDCOFD-UHFFFAOYSA-N -1 1 320.316 4.339 20 0 DIADMM [O-]c1ccc(-c2cnc3[nH]c(-c4ccccc4)nc3c2)c(F)c1F ZINC001243342674 1057652886 /nfs/dbraw/zinc/65/28/86/1057652886.db2.gz OAPMFRHSZHRORI-UHFFFAOYSA-N -1 1 323.302 4.276 20 0 DIADMM COc1cc(-c2ccc([O-])c(F)c2F)ccc1C(F)(F)F ZINC001243342566 1057653054 /nfs/dbraw/zinc/65/30/54/1057653054.db2.gz ISOQBOWJMDMFLT-UHFFFAOYSA-N -1 1 304.214 4.365 20 0 DIADMM COc1ccc(-c2ccc([O-])c(F)c2F)c(OC(F)(F)F)c1 ZINC001243342853 1057653066 /nfs/dbraw/zinc/65/30/66/1057653066.db2.gz MNHVUNXLBDDYQI-UHFFFAOYSA-N -1 1 320.213 4.245 20 0 DIADMM COc1cc(F)cc2ccc(-c3ccc([O-])c(F)c3F)nc21 ZINC001243341670 1057653217 /nfs/dbraw/zinc/65/32/17/1057653217.db2.gz PHSFTQFCDRMIOF-UHFFFAOYSA-N -1 1 305.255 4.033 20 0 DIADMM COC(=O)c1ccc(C(C)C)c(-c2ccc([O-])c(F)c2F)c1 ZINC001243344001 1057654070 /nfs/dbraw/zinc/65/40/70/1057654070.db2.gz VMUDEOBOPAWHJZ-UHFFFAOYSA-N -1 1 306.308 4.247 20 0 DIADMM COc1cccc(-c2ccc([O-])c(F)c2F)c1C(F)(F)F ZINC001243344271 1057654166 /nfs/dbraw/zinc/65/41/66/1057654166.db2.gz BOMMBOWRVXTFJD-UHFFFAOYSA-N -1 1 304.214 4.365 20 0 DIADMM COC(=O)c1ccc(C2CC2)c(-c2ccc([O-])c(F)c2F)c1 ZINC001243345371 1057655060 /nfs/dbraw/zinc/65/50/60/1057655060.db2.gz PQMGIHZYPCWYSS-UHFFFAOYSA-N -1 1 304.292 4.001 20 0 DIADMM COC(=O)c1nc2cc(-c3ccc(C)cc3SC)ccc2[n-]1 ZINC001243384618 1057666068 /nfs/dbraw/zinc/66/60/68/1057666068.db2.gz BDGZQPAXBHANQT-UHFFFAOYSA-N -1 1 312.394 4.047 20 0 DIADMM COC(=O)c1nc2ccc(-c3ccc(C)cc3SC)cc2[n-]1 ZINC001243384618 1057666070 /nfs/dbraw/zinc/66/60/70/1057666070.db2.gz BDGZQPAXBHANQT-UHFFFAOYSA-N -1 1 312.394 4.047 20 0 DIADMM [O-]c1c(F)cc(F)cc1-c1ccc(-c2nc3cc[nH]cc-3n2)cc1 ZINC001243501938 1057696786 /nfs/dbraw/zinc/69/67/86/1057696786.db2.gz GEPOPZAYHQPLJO-UHFFFAOYSA-N -1 1 323.302 4.276 20 0 DIADMM CN(C)c1ccc(-c2cc(F)cc(F)c2[O-])c(C(F)(F)F)c1 ZINC001243503266 1057697047 /nfs/dbraw/zinc/69/70/47/1057697047.db2.gz FJSLHSRVNWETSB-UHFFFAOYSA-N -1 1 317.257 4.422 20 0 DIADMM CCOC(OCC)c1ccc(-c2cc(F)cc(F)c2[O-])cc1 ZINC001243506459 1057697837 /nfs/dbraw/zinc/69/78/37/1057697837.db2.gz WNBXPVMOGJXDMF-UHFFFAOYSA-N -1 1 308.324 4.409 20 0 DIADMM COc1ccc2nc(C)cc(-c3cc(F)cc(F)c3[O-])c2c1 ZINC001243505012 1057697850 /nfs/dbraw/zinc/69/78/50/1057697850.db2.gz FCQCQHSJFJLRQM-UHFFFAOYSA-N -1 1 301.292 4.203 20 0 DIADMM CC(C)(C)OC(=O)c1ccc(-c2cc(F)cc(F)c2[O-])cc1 ZINC001243504744 1057698044 /nfs/dbraw/zinc/69/80/44/1057698044.db2.gz PIGMEVUHHYCCSG-UHFFFAOYSA-N -1 1 306.308 4.293 20 0 DIADMM [O-]c1c(F)cc(F)cc1-c1ccc(O[C@@H]2CCCCO2)cc1F ZINC001243506998 1057698519 /nfs/dbraw/zinc/69/85/19/1057698519.db2.gz QFDKWCIVFJKWIS-MRXNPFEDSA-N -1 1 324.298 4.382 20 0 DIADMM CCOC(=O)c1ccc(-c2cc(F)cc(F)c2[O-])c(C)c1C ZINC001243507275 1057698580 /nfs/dbraw/zinc/69/85/80/1057698580.db2.gz VQWYFHCBIODEHR-UHFFFAOYSA-N -1 1 306.308 4.131 20 0 DIADMM COc1ccc(-c2ccnc(-c3ccc(Cl)c([O-])c3)n2)cc1 ZINC001243576856 1057720916 /nfs/dbraw/zinc/72/09/16/1057720916.db2.gz 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/nfs/dbraw/zinc/72/24/32/1057722432.db2.gz KBBNLRRQUODOEW-UHFFFAOYSA-N -1 1 315.756 4.371 20 0 DIADMM CC[C@H](C)c1nc2[nH]ccc2c(-c2ccc(Cl)c([O-])c2)n1 ZINC001243579413 1057722540 /nfs/dbraw/zinc/72/25/40/1057722540.db2.gz UBTFODXFMCWBHC-VIFPVBQESA-N -1 1 301.777 4.449 20 0 DIADMM [O-]c1cc(-c2ccc3nc(C(F)(F)F)[nH]c3n2)ccc1Cl ZINC001243579277 1057722635 /nfs/dbraw/zinc/72/26/35/1057722635.db2.gz RROZDXRMXJXZCK-UHFFFAOYSA-N -1 1 313.666 4.003 20 0 DIADMM Cc1csc(-c2cc(C)nnc2-c2ccc(Cl)c([O-])c2)n1 ZINC001243579959 1057722651 /nfs/dbraw/zinc/72/26/51/1057722651.db2.gz YJPBBFXASCFRME-UHFFFAOYSA-N -1 1 317.801 4.243 20 0 DIADMM COC(=O)c1ccc2c(cccc2-c2ccc(Cl)c([O-])c2)n1 ZINC001243581221 1057723021 /nfs/dbraw/zinc/72/30/21/1057723021.db2.gz MSRSHVXKYLXVPS-UHFFFAOYSA-N -1 1 313.740 4.047 20 0 DIADMM CC1(C)CC(=O)Nc2c(-c3ccc(Cl)c([O-])c3)cccc21 ZINC001243581957 1057723135 /nfs/dbraw/zinc/72/31/35/1057723135.db2.gz OOACIZAGVRBWAJ-UHFFFAOYSA-N -1 1 301.773 4.332 20 0 DIADMM CC1(C)Cc2cc(-c3ccc(Cl)c([O-])c3)ccc2NC1=O ZINC001243581160 1057723500 /nfs/dbraw/zinc/72/35/00/1057723500.db2.gz GEKZOJUIDVFZHH-UHFFFAOYSA-N -1 1 301.773 4.233 20 0 DIADMM CC1(C)Cc2cccc(-c3ccc(Cl)c([O-])c3)c2NC1=O ZINC001243582528 1057723852 /nfs/dbraw/zinc/72/38/52/1057723852.db2.gz UTVCNHKPJXPUNU-UHFFFAOYSA-N -1 1 301.773 4.233 20 0 DIADMM O=C(Nc1ccc(-c2ccc(Cl)c([O-])c2)cc1)c1ccccn1 ZINC001243582370 1057724039 /nfs/dbraw/zinc/72/40/39/1057724039.db2.gz QSBDKDSWGFJHFU-UHFFFAOYSA-N -1 1 324.767 4.360 20 0 DIADMM COC(=O)C1(c2ccc(-c3ccc(Cl)c([O-])c3)cc2)CCC1 ZINC001243584078 1057724156 /nfs/dbraw/zinc/72/41/56/1057724156.db2.gz QLRHXQPBQZVFNP-UHFFFAOYSA-N -1 1 316.784 4.307 20 0 DIADMM COC(=O)c1cnc2cc(-c3ccc(Cl)c([O-])c3)ccc2c1 ZINC001243583480 1057724316 /nfs/dbraw/zinc/72/43/16/1057724316.db2.gz PATVUBQVZAMBLR-UHFFFAOYSA-N -1 1 313.740 4.047 20 0 DIADMM CC[C@H](C(=O)OC)c1ccc(-c2ccc(Cl)c([O-])c2)cc1 ZINC001243584159 1057724879 /nfs/dbraw/zinc/72/48/79/1057724879.db2.gz RMWRAWUCCFFJDG-AWEZNQCLSA-N -1 1 304.773 4.379 20 0 DIADMM [O-]c1cc(C(F)(F)F)ccc1-c1ncnc2c(F)cccc21 ZINC001243608524 1057731508 /nfs/dbraw/zinc/73/15/08/1057731508.db2.gz KACDIMKHJRNDQM-UHFFFAOYSA-N -1 1 308.234 4.160 20 0 DIADMM Cc1nsc2nc(-c3ccc(C(F)(F)F)cc3[O-])ccc12 ZINC001243608841 1057731577 /nfs/dbraw/zinc/73/15/77/1057731577.db2.gz XJVOFYZBXOITEG-UHFFFAOYSA-N -1 1 310.300 4.391 20 0 DIADMM COc1cccc2c1ncnc2-c1ccc(C(F)(F)F)cc1[O-] ZINC001243609025 1057731620 /nfs/dbraw/zinc/73/16/20/1057731620.db2.gz LPEOAZKGJXBYRR-UHFFFAOYSA-N -1 1 320.270 4.030 20 0 DIADMM Cc1cccc2c1ncnc2-c1ccc(C(F)(F)F)cc1[O-] ZINC001243609401 1057732123 /nfs/dbraw/zinc/73/21/23/1057732123.db2.gz RSPPBOBSIRMYQW-UHFFFAOYSA-N -1 1 304.271 4.330 20 0 DIADMM [O-]c1cc(C(F)(F)F)ccc1-c1cnc(OCC2CCC2)cn1 ZINC001243611578 1057732869 /nfs/dbraw/zinc/73/28/69/1057732869.db2.gz MUXRFQSHSDIXDB-UHFFFAOYSA-N -1 1 324.302 4.047 20 0 DIADMM C[C@H](OC(=O)c1ccc(Cl)c(Cl)c1[O-])c1cccnc1 ZINC000733490522 1057823284 /nfs/dbraw/zinc/82/32/84/1057823284.db2.gz QQXIMRUGKCFRCI-QMMMGPOBSA-N -1 1 312.152 4.012 20 0 DIADMM COc1cc(OC)c2ccnc(-c3c([O-])cccc3Cl)c2c1 ZINC001244031308 1057843405 /nfs/dbraw/zinc/84/34/05/1057843405.db2.gz RWTJUOXUXWSUAC-UHFFFAOYSA-N -1 1 315.756 4.278 20 0 DIADMM COc1cc2ccc(-c3c([O-])cccc3Cl)nc2cc1OC ZINC001244034439 1057844290 /nfs/dbraw/zinc/84/42/90/1057844290.db2.gz IVGGVFFFSBMXGS-UHFFFAOYSA-N -1 1 315.756 4.278 20 0 DIADMM CCOC(=O)c1cc2cc(-c3cc(F)c([O-])c(F)c3)ccc2o1 ZINC001244093561 1057866596 /nfs/dbraw/zinc/86/65/96/1057866596.db2.gz IGWJQBJWWYHHLU-UHFFFAOYSA-N -1 1 318.275 4.260 20 0 DIADMM [O-]c1c(F)cc(-c2cnc3[nH]c(-c4ccccc4)nc3c2)cc1F ZINC001244093257 1057867089 /nfs/dbraw/zinc/86/70/89/1057867089.db2.gz FBRLSNROZPWZIZ-UHFFFAOYSA-N -1 1 323.302 4.276 20 0 DIADMM [O-]c1c(F)cc(-c2ccc3nc4c(cc3c2)CCCO4)cc1F ZINC001244095433 1057867908 /nfs/dbraw/zinc/86/79/08/1057867908.db2.gz ATHRUWIAAZZRTH-UHFFFAOYSA-N -1 1 313.303 4.211 20 0 DIADMM COC(=O)c1cc2c(cccc2-c2cc(F)c([O-])c(F)c2)s1 ZINC001244097121 1057868031 /nfs/dbraw/zinc/86/80/31/1057868031.db2.gz RLJLUVMOYTXJMS-UHFFFAOYSA-N -1 1 320.316 4.339 20 0 DIADMM [O-]c1c(F)cc(-c2ccc(O[C@@H]3CCCCO3)cc2)cc1F ZINC001244098138 1057868711 /nfs/dbraw/zinc/86/87/11/1057868711.db2.gz YRLKNRXSPVNSTP-MRXNPFEDSA-N -1 1 306.308 4.243 20 0 DIADMM CC(C)(C)OC(=O)Cc1ccc(-c2cc(F)c([O-])c(F)c2)cc1 ZINC001244097806 1057868834 /nfs/dbraw/zinc/86/88/34/1057868834.db2.gz RJBXSKREURQOOD-UHFFFAOYSA-N -1 1 320.335 4.222 20 0 DIADMM COc1cc(-c2cc(F)c([O-])c(F)c2)ccc1-c1cnc(C)o1 ZINC001244098807 1057868911 /nfs/dbraw/zinc/86/89/11/1057868911.db2.gz SHECEJRIXVYKOI-UHFFFAOYSA-N -1 1 317.291 4.309 20 0 DIADMM Cc1ccc([O-])c(-c2ncc3ccc(C(F)(F)F)cc3n2)c1 ZINC001244402867 1057951406 /nfs/dbraw/zinc/95/14/06/1057951406.db2.gz NAFVZHPCPFRERH-UHFFFAOYSA-N -1 1 304.271 4.330 20 0 DIADMM Cc1ccc2ncc(-c3ccc(OC(F)(F)F)cc3[O-])nc2c1 ZINC001244463452 1057965510 /nfs/dbraw/zinc/96/55/10/1057965510.db2.gz HNGPKKDWDBSHMS-UHFFFAOYSA-N -1 1 320.270 4.209 20 0 DIADMM CSc1ccc(-c2ccc(OC(F)(F)F)cc2[O-])nc1 ZINC001244462880 1057965588 /nfs/dbraw/zinc/96/55/88/1057965588.db2.gz FWPDUCVYQWXGGZ-UHFFFAOYSA-N -1 1 301.289 4.075 20 0 DIADMM Cc1cnc(-c2ccc(OC(F)(F)F)cc2[O-])c2[nH]ccc21 ZINC001244463169 1057965626 /nfs/dbraw/zinc/96/56/26/1057965626.db2.gz BQBCEDQUDCQFDM-UHFFFAOYSA-N -1 1 308.259 4.143 20 0 DIADMM Cc1nc(-c2ccc(OC(F)(F)F)cc2[O-])cc(C(C)C)n1 ZINC001244464575 1057966407 /nfs/dbraw/zinc/96/64/07/1057966407.db2.gz SNRCJGWWRTXLQL-UHFFFAOYSA-N -1 1 312.291 4.180 20 0 DIADMM [O-]c1cc(OC(F)(F)F)ccc1-c1cc(C2CCC2)ncn1 ZINC001244465510 1057966564 /nfs/dbraw/zinc/96/65/64/1057966564.db2.gz XVJLTEMETLMFIL-UHFFFAOYSA-N -1 1 310.275 4.015 20 0 DIADMM O=c1c(-c2ccc(Cl)cc2[O-])cccn1-c1ccc(F)cc1 ZINC001244473681 1057969842 /nfs/dbraw/zinc/96/98/42/1057969842.db2.gz WQTFSUDMCDSSOJ-UHFFFAOYSA-N -1 1 315.731 4.003 20 0 DIADMM Cc1cc(-c2ncnc3cc(F)c(F)cc32)cc(Cl)c1[O-] ZINC001244529946 1057987219 /nfs/dbraw/zinc/98/72/19/1057987219.db2.gz GRIXSKOYSWQTOE-UHFFFAOYSA-N -1 1 306.699 4.242 20 0 DIADMM Cc1cc(-c2ncc(C(=O)OC(C)C)cc2C)cc(Cl)c1[O-] ZINC001244531967 1057987246 /nfs/dbraw/zinc/98/72/46/1057987246.db2.gz RGVPSTWSKAJBOT-UHFFFAOYSA-N -1 1 319.788 4.290 20 0 DIADMM Cc1cc(-c2cccc(OCC(F)(F)F)n2)cc(Cl)c1[O-] ZINC001244532558 1057987281 /nfs/dbraw/zinc/98/72/81/1057987281.db2.gz VEEBSDBJQTZIAC-UHFFFAOYSA-N -1 1 317.694 4.357 20 0 DIADMM Cc1cc(-c2cccc(NC(=O)C(C)(C)C)n2)cc(Cl)c1[O-] ZINC001244530823 1057987319 /nfs/dbraw/zinc/98/73/19/1057987319.db2.gz UJQAMBDXJPVISL-UHFFFAOYSA-N -1 1 318.804 4.401 20 0 DIADMM Cc1nc2ccc(F)cc2c(-c2c(Cl)ccc([O-])c2F)n1 ZINC001244538458 1057989868 /nfs/dbraw/zinc/98/98/68/1057989868.db2.gz OABHAKDOHAFLHG-UHFFFAOYSA-N -1 1 306.699 4.242 20 0 DIADMM [O-]c1ccc(Cl)c(-c2nccc(Oc3ccccc3)n2)c1F ZINC001244538952 1057989944 /nfs/dbraw/zinc/98/99/44/1057989944.db2.gz RWMPQGZTRPJUGC-UHFFFAOYSA-N -1 1 316.719 4.434 20 0 DIADMM Cc1cc(-c2cc(-c3ccncc3)nc(C)n2)cc(Cl)c1[O-] ZINC001244539343 1057989972 /nfs/dbraw/zinc/98/99/72/1057989972.db2.gz ULPHCEPHAPEYSO-UHFFFAOYSA-N -1 1 311.772 4.181 20 0 DIADMM Cc1nc(-c2cccnc2)cc(-c2c(Cl)ccc([O-])c2F)n1 ZINC001244540337 1057990431 /nfs/dbraw/zinc/99/04/31/1057990431.db2.gz KUVRQPQFSGNYPJ-UHFFFAOYSA-N -1 1 315.735 4.012 20 0 DIADMM CCc1nc2sccc2c(-c2c(Cl)ccc([O-])c2F)n1 ZINC001244540397 1057990458 /nfs/dbraw/zinc/99/04/58/1057990458.db2.gz NMSZJJQBMMEIBA-UHFFFAOYSA-N -1 1 308.765 4.419 20 0 DIADMM CC(=O)Nc1cc(F)c(-c2c(Cl)ccc([O-])c2F)cc1C ZINC001244540471 1057990486 /nfs/dbraw/zinc/99/04/86/1057990486.db2.gz WCBIKSMZFLGVFK-UHFFFAOYSA-N -1 1 311.715 4.258 20 0 DIADMM COC(=O)c1cc2cc(-c3c(Cl)ccc([O-])c3F)ccc2[nH]1 ZINC001244539911 1057990645 /nfs/dbraw/zinc/99/06/45/1057990645.db2.gz NGBPDNFWQOGJOB-UHFFFAOYSA-N -1 1 319.719 4.120 20 0 DIADMM COc1ccc2ccc(-c3c(Cl)ccc([O-])c3F)cc2n1 ZINC001244539921 1057990822 /nfs/dbraw/zinc/99/08/22/1057990822.db2.gz NOLWQIFEUSRTPP-UHFFFAOYSA-N -1 1 303.720 4.409 20 0 DIADMM [O-]c1ccc(Cl)c(-c2nc(C3CCC3)nc3[nH]ccc32)c1F ZINC001244540488 1057990884 /nfs/dbraw/zinc/99/08/84/1057990884.db2.gz WYWMHNCJIWAPGF-UHFFFAOYSA-N -1 1 317.751 4.342 20 0 DIADMM Cc1nnc(-c2ccc(-c3c(Cl)ccc([O-])c3F)cc2)o1 ZINC001244540624 1057990928 /nfs/dbraw/zinc/99/09/28/1057990928.db2.gz DHVPXYQDUHKJID-UHFFFAOYSA-N -1 1 304.708 4.210 20 0 DIADMM [O-]c1ccc(Cl)c(-c2cnc(-c3ccccc3)cn2)c1F ZINC001244540401 1057990936 /nfs/dbraw/zinc/99/09/36/1057990936.db2.gz NPSVFFUEGVIOFF-UHFFFAOYSA-N -1 1 300.720 4.309 20 0 DIADMM Cc1cc(-c2c(Cl)ccc([O-])c2F)nc(-c2ccco2)n1 ZINC001244540134 1057990964 /nfs/dbraw/zinc/99/09/64/1057990964.db2.gz IIVRKQWRDHJIMI-UHFFFAOYSA-N -1 1 304.708 4.210 20 0 DIADMM COC(=O)c1ccc(-c2c(Cl)ccc([O-])c2F)c(C)c1C ZINC001244541453 1057991052 /nfs/dbraw/zinc/99/10/52/1057991052.db2.gz CWRSMKCNUQRYHP-UHFFFAOYSA-N -1 1 308.736 4.255 20 0 DIADMM CCOC(=O)c1ccc(OC)c(-c2c(Cl)ccc([O-])c2F)c1 ZINC001244541783 1057991124 /nfs/dbraw/zinc/99/11/24/1057991124.db2.gz FUIVNOFAKXXJEF-UHFFFAOYSA-N -1 1 324.735 4.037 20 0 DIADMM CC(=O)Nc1ccc(-c2c(Cl)ccc([O-])c2F)c(C)c1C ZINC001244541322 1057991253 /nfs/dbraw/zinc/99/12/53/1057991253.db2.gz ASRKRMHKUXXYSY-UHFFFAOYSA-N -1 1 307.752 4.427 20 0 DIADMM [O-]c1ccc(Cl)c(-c2cccnc2OCC(F)(F)F)c1F ZINC001244541575 1057991266 /nfs/dbraw/zinc/99/12/66/1057991266.db2.gz FIDPBKUOHLYTCJ-UHFFFAOYSA-N -1 1 321.657 4.188 20 0 DIADMM COc1ccc2cccc(-c3c(Cl)ccc([O-])c3F)c2n1 ZINC001244541522 1057991274 /nfs/dbraw/zinc/99/12/74/1057991274.db2.gz CHICJIFVBKMULY-UHFFFAOYSA-N -1 1 303.720 4.409 20 0 DIADMM COc1cc(C(F)(F)F)c(-c2c(Cl)ccc([O-])c2F)cn1 ZINC001244542108 1057991349 /nfs/dbraw/zinc/99/13/49/1057991349.db2.gz KBNLJMKICTZCRJ-UHFFFAOYSA-N -1 1 321.657 4.274 20 0 DIADMM CC[S@](=N)(=O)c1ccc(-c2c(Cl)ccc([O-])c2F)cc1 ZINC001244542096 1057991400 /nfs/dbraw/zinc/99/14/00/1057991400.db2.gz IFQWJSULHSPVMI-FQEVSTJZSA-N -1 1 313.781 4.277 20 0 DIADMM COC(=O)c1cc(C)c(-c2c(Cl)ccc([O-])c2F)cc1C ZINC001244541952 1057991666 /nfs/dbraw/zinc/99/16/66/1057991666.db2.gz HYYXBVQMQXKYRX-UHFFFAOYSA-N -1 1 308.736 4.255 20 0 DIADMM CC1(C)C(=O)Nc2cc(-c3c(Cl)ccc([O-])c3F)ccc21 ZINC001244542678 1057991876 /nfs/dbraw/zinc/99/18/76/1057991876.db2.gz NZLZUVJMCCULCM-UHFFFAOYSA-N -1 1 305.736 4.081 20 0 DIADMM COC(=O)c1c[nH]c2cc(-c3c(Cl)ccc([O-])c3F)ccc21 ZINC001244543109 1057991926 /nfs/dbraw/zinc/99/19/26/1057991926.db2.gz TTYGATNVQCATAY-UHFFFAOYSA-N -1 1 319.719 4.120 20 0 DIADMM COC(=O)[C@@H](C)c1ccc(-c2c(Cl)ccc([O-])c2F)cc1 ZINC001244542737 1057991989 /nfs/dbraw/zinc/99/19/89/1057991989.db2.gz KYTXIACFVJZKKC-VIFPVBQESA-N -1 1 308.736 4.128 20 0 DIADMM CCOC(=O)c1cc(F)ccc1-c1c(Cl)ccc([O-])c1F ZINC001244542682 1057992135 /nfs/dbraw/zinc/99/21/35/1057992135.db2.gz OOEYSHSWADLWAY-UHFFFAOYSA-N -1 1 312.699 4.168 20 0 DIADMM COC(=O)c1c(C)cc(F)cc1-c1c(Cl)ccc([O-])c1F ZINC001244543005 1057992331 /nfs/dbraw/zinc/99/23/31/1057992331.db2.gz RBGMGGRRHHNRQS-UHFFFAOYSA-N -1 1 312.699 4.086 20 0 DIADMM COC(=O)c1c(F)ccc(F)c1-c1cc(C)c([O-])c(Cl)c1 ZINC001244555035 1057994991 /nfs/dbraw/zinc/99/49/91/1057994991.db2.gz PYUFOUMITPJTCK-UHFFFAOYSA-N -1 1 312.699 4.086 20 0 DIADMM COC(=O)c1nc2cc(-c3ccc(C4CCC4)cc3)ccc2[n-]1 ZINC001244944198 1058077665 /nfs/dbraw/zinc/07/76/65/1058077665.db2.gz QMCWSKIJCONJFR-UHFFFAOYSA-N -1 1 306.365 4.284 20 0 DIADMM COC(=O)c1nc2ccc(-c3ccc(C4CCC4)cc3)cc2[n-]1 ZINC001244944198 1058077667 /nfs/dbraw/zinc/07/76/67/1058077667.db2.gz QMCWSKIJCONJFR-UHFFFAOYSA-N -1 1 306.365 4.284 20 0 DIADMM CCc1cc(-c2cc(Cl)ccc2[O-])nc(-c2ccccn2)n1 ZINC001245048878 1058102340 /nfs/dbraw/zinc/10/23/40/1058102340.db2.gz BQOFDRRFZHDMFJ-UHFFFAOYSA-N -1 1 311.772 4.127 20 0 DIADMM CCCN(CCC)c1cc(-c2cc(Cl)ccc2[O-])ncn1 ZINC001245049457 1058102466 /nfs/dbraw/zinc/10/24/66/1058102466.db2.gz VAWNSOZHOGUVNW-UHFFFAOYSA-N -1 1 305.809 4.129 20 0 DIADMM COc1cc(F)cc2ccc(-c3cc(Cl)ccc3[O-])nc21 ZINC001245049288 1058102551 /nfs/dbraw/zinc/10/25/51/1058102551.db2.gz UNNGPMATVGDRRY-UHFFFAOYSA-N -1 1 303.720 4.409 20 0 DIADMM [O-]c1ccc(Cl)cc1-c1nc(-c2cccnc2)nc2c1CCC2 ZINC001245050148 1058102673 /nfs/dbraw/zinc/10/26/73/1058102673.db2.gz PGDJTEAQCTVSJM-UHFFFAOYSA-N -1 1 323.783 4.053 20 0 DIADMM [O-]c1ccc(Cl)cc1-c1ccnc(CCc2ccccc2)n1 ZINC001245050359 1058102853 /nfs/dbraw/zinc/10/28/53/1058102853.db2.gz SQLXBDHXEIJXHK-UHFFFAOYSA-N -1 1 310.784 4.288 20 0 DIADMM CSc1nc(-c2cc(Cl)ccc2[O-])cc(C(F)(F)F)n1 ZINC001245051643 1058103096 /nfs/dbraw/zinc/10/30/96/1058103096.db2.gz MQOPXDFSFNITAC-UHFFFAOYSA-N -1 1 320.723 4.243 20 0 DIADMM COc1cc(C(F)(F)F)cc(-c2cc(Cl)ccc2[O-])n1 ZINC001245051020 1058103472 /nfs/dbraw/zinc/10/34/72/1058103472.db2.gz AEJPOHJWAIVSFK-UHFFFAOYSA-N -1 1 303.667 4.135 20 0 DIADMM Cc1ccc(C(F)(F)F)cc1NC(=O)c1cccc([O-])c1F ZINC001545237893 1058189637 /nfs/dbraw/zinc/18/96/37/1058189637.db2.gz CQGQAXVIIWYVSH-UHFFFAOYSA-N -1 1 313.250 4.111 20 0 DIADMM [O-]c1ccc(F)c(-c2ncnc3cc(F)c(F)cc32)c1Cl ZINC001245827496 1058520903 /nfs/dbraw/zinc/52/09/03/1058520903.db2.gz MDASMNGGECMVES-UHFFFAOYSA-N -1 1 310.662 4.073 20 0 DIADMM COc1ccc2c(ccnc2-c2c(F)ccc([O-])c2Cl)c1 ZINC001245827558 1058521935 /nfs/dbraw/zinc/52/19/35/1058521935.db2.gz NBUJMTXLVFJOMV-UHFFFAOYSA-N -1 1 303.720 4.409 20 0 DIADMM [O-]c1ccc(F)c(-c2ccc(-c3ccccc3)nn2)c1Cl ZINC001245828598 1058524902 /nfs/dbraw/zinc/52/49/02/1058524902.db2.gz WFIKVLXCYNFZMF-UHFFFAOYSA-N -1 1 300.720 4.309 20 0 DIADMM CC(C)(C)OC(=O)c1cncc(-c2c(F)ccc([O-])c2Cl)c1 ZINC001245831000 1058527832 /nfs/dbraw/zinc/52/78/32/1058527832.db2.gz DDKBNWRYJAZAFY-UHFFFAOYSA-N -1 1 323.751 4.202 20 0 DIADMM [O-]c1ccc(F)c(-c2ncnc3cc(F)cc(F)c32)c1Cl ZINC001245830339 1058528840 /nfs/dbraw/zinc/52/88/40/1058528840.db2.gz MACFALZIUGGQDB-UHFFFAOYSA-N -1 1 310.662 4.073 20 0 DIADMM CSc1nc(-c2c(F)ccc([O-])c2Cl)cc(C(F)F)n1 ZINC001245830480 1058529525 /nfs/dbraw/zinc/52/95/25/1058529525.db2.gz PDTKPJBHTVLWSX-UHFFFAOYSA-N -1 1 320.723 4.301 20 0 DIADMM [O-]c1ccc(F)c(-c2ncnc3sc4c(c32)CCC4)c1Cl ZINC001245830912 1058530598 /nfs/dbraw/zinc/53/05/98/1058530598.db2.gz ZCTPCAVQWFXCCA-UHFFFAOYSA-N -1 1 320.776 4.345 20 0 DIADMM COc1cccc2nccc(-c3c(F)ccc([O-])c3Cl)c21 ZINC001245832568 1058533521 /nfs/dbraw/zinc/53/35/21/1058533521.db2.gz PXDDSKLNRJVPRE-UHFFFAOYSA-N -1 1 303.720 4.409 20 0 DIADMM COc1cc(-c2c(F)ccc([O-])c2Cl)ccc1OC(F)F ZINC001245832082 1058533832 /nfs/dbraw/zinc/53/38/32/1058533832.db2.gz LIANDWOWLABIGR-UHFFFAOYSA-N -1 1 318.678 4.462 20 0 DIADMM CC(=O)Nc1c(C)cc(-c2c(F)ccc([O-])c2Cl)cc1C ZINC001245832009 1058534298 /nfs/dbraw/zinc/53/42/98/1058534298.db2.gz RWXZQBUVORHXMF-UHFFFAOYSA-N -1 1 307.752 4.427 20 0 DIADMM COc1cccc2c(-c3c(F)ccc([O-])c3Cl)ccnc12 ZINC001245832548 1058534628 /nfs/dbraw/zinc/53/46/28/1058534628.db2.gz YKOFBQKLZYLOMV-UHFFFAOYSA-N -1 1 303.720 4.409 20 0 DIADMM CC(=O)Oc1c[nH]c2ccc(-c3c(F)ccc([O-])c3Cl)cc12 ZINC001245832952 1058536608 /nfs/dbraw/zinc/53/66/08/1058536608.db2.gz VYBUXKWWDMGIRT-UHFFFAOYSA-N -1 1 319.719 4.258 20 0 DIADMM COc1c(F)ccc(-c2c(F)ccc([O-])c2Cl)c1OC ZINC001245834039 1058538017 /nfs/dbraw/zinc/53/80/17/1058538017.db2.gz BVQAHJCFTHGNMX-UHFFFAOYSA-N -1 1 300.688 4.008 20 0 DIADMM COC(=O)[C@H](C)c1cccc(-c2c(F)ccc([O-])c2Cl)c1 ZINC001245834543 1058540955 /nfs/dbraw/zinc/54/09/55/1058540955.db2.gz IKDDMRPIIOHTLU-SECBINFHSA-N -1 1 308.736 4.128 20 0 DIADMM COC(=O)c1ccc(-c2c(F)ccc([O-])c2Cl)c(C)c1C ZINC001245836343 1058541990 /nfs/dbraw/zinc/54/19/90/1058541990.db2.gz ZZATZDWTVLPGBI-UHFFFAOYSA-N -1 1 308.736 4.255 20 0 DIADMM O=C(c1ccc(F)c([O-])c1)N1CCCC2(CCCCC2)CC1 ZINC001556213218 1058559234 /nfs/dbraw/zinc/55/92/34/1058559234.db2.gz RYXGRYVJPRSFQH-UHFFFAOYSA-N -1 1 305.393 4.108 20 0 DIADMM CC(C)Cc1cc(=O)n(-c2ccc(C=Cc3ccccn3)cc2)[n-]1 ZINC001245932747 1058633743 /nfs/dbraw/zinc/63/37/43/1058633743.db2.gz NPFVYMZJBJBETR-RMKNXTFCSA-N -1 1 319.408 4.342 20 0 DIADMM C[C@@H](c1ccc(Cl)cc1)n1[n-]c(-c2ccc(N)cc2)cc1=O ZINC001245936299 1058637764 /nfs/dbraw/zinc/63/77/64/1058637764.db2.gz JCTVOVBRYPSJJD-NSHDSACASA-N -1 1 313.788 4.101 20 0 DIADMM CCC[C@H]1CCCC[C@H]1CNC(=O)c1cc(Cl)ccc1[O-] ZINC001557028108 1058687427 /nfs/dbraw/zinc/68/74/27/1058687427.db2.gz IIEMUMUXKCNJFT-STQMWFEESA-N -1 1 309.837 4.382 20 0 DIADMM C[C@@H]1CN(C(=O)c2ccc3ccc(O)cc3c2[O-])c2ccccc21 ZINC001557103521 1058700674 /nfs/dbraw/zinc/70/06/74/1058700674.db2.gz OMIHMKFNZFQQPQ-GFCCVEGCSA-N -1 1 319.360 4.015 20 0 DIADMM Cc1ccc(C(=O)Nc2ccc(C(=O)C(C)C)cc2)c([O-])c1C ZINC001557275443 1058722854 /nfs/dbraw/zinc/72/28/54/1058722854.db2.gz RIMXRSXIQUPDNC-UHFFFAOYSA-N -1 1 311.381 4.100 20 0 DIADMM O=C(c1cc(Cl)ccc1[O-])N1CCC(C2CCCCC2)CC1 ZINC001557381529 1058741104 /nfs/dbraw/zinc/74/11/04/1058741104.db2.gz HKXABBXWTDGTSZ-UHFFFAOYSA-N -1 1 321.848 4.478 20 0 DIADMM CC(C)[C@H](NC(=O)c1c([O-])cccc1Cl)c1ccccc1F ZINC001557400380 1058741224 /nfs/dbraw/zinc/74/12/24/1058741224.db2.gz PUVLQVMIZGWJRH-INIZCTEOSA-N -1 1 321.779 4.312 20 0 DIADMM O=C(Nc1cccc2c1ccn2C(F)F)c1cc(F)ccc1[O-] ZINC001557448342 1058751932 /nfs/dbraw/zinc/75/19/32/1058751932.db2.gz HCNGDKQEMAYTAA-UHFFFAOYSA-N -1 1 320.270 4.133 20 0 DIADMM CC(C)Cc1ccc(CCC(=O)Nc2cccc(F)c2[O-])cc1 ZINC001557956159 1058816807 /nfs/dbraw/zinc/81/68/07/1058816807.db2.gz IKXAOCCFPDTMIM-UHFFFAOYSA-N -1 1 315.388 4.301 20 0 DIADMM CC(C)CCCCNC(=O)c1c([O-])cnc2ccc(Cl)cc21 ZINC001558939088 1058923575 /nfs/dbraw/zinc/92/35/75/1058923575.db2.gz HNQGLGUOSFIEKL-UHFFFAOYSA-N -1 1 320.820 4.150 20 0 DIADMM CCCc1cc(C(=O)Nc2ccc(F)cc2[O-])ccc1Cl ZINC001558955715 1058928760 /nfs/dbraw/zinc/92/87/60/1058928760.db2.gz GLRDGKBUXRAXDV-UHFFFAOYSA-N -1 1 307.752 4.390 20 0 DIADMM Cc1cccc2cc(C(=O)Nc3nc(Cl)ccc3[O-])sc21 ZINC001558966551 1058930599 /nfs/dbraw/zinc/93/05/99/1058930599.db2.gz QSWUMRXSLFYFMI-UHFFFAOYSA-N -1 1 318.785 4.216 20 0 DIADMM CCCc1cc(=O)[n-]c(SCc2cc(OC)ccc2Cl)n1 ZINC001559324488 1059162766 /nfs/dbraw/zinc/16/27/66/1059162766.db2.gz TVVCIHCVDQDULM-UHFFFAOYSA-N -1 1 324.833 4.089 20 0 DIADMM Cc1nc(S[C@H]2CCCc3c(Cl)ccnc32)[n-]c(=O)c1C ZINC001559393062 1059202809 /nfs/dbraw/zinc/20/28/09/1059202809.db2.gz KAICIFUDJPVUIH-LBPRGKRZSA-N -1 1 321.833 4.017 20 0 DIADMM CCc1nc(SCC[C@@H]2CCc3ccccc32)[n-]c(=O)c1C ZINC001559422751 1059220299 /nfs/dbraw/zinc/22/02/99/1059220299.db2.gz PBDJUKCJFOJALJ-AWEZNQCLSA-N -1 1 314.454 4.265 20 0 DIADMM Cc1ccc(-c2noc(Cc3ccc([O-])c(Cl)c3)n2)c(F)c1 ZINC001247587457 1059564899 /nfs/dbraw/zinc/56/48/99/1059564899.db2.gz GOQQFXWMJQQJEB-UHFFFAOYSA-N -1 1 318.735 4.134 20 0 DIADMM Cc1ccc(-c2noc(Cc3ccc([O-])c(Cl)c3)n2)c(C)c1 ZINC001247588559 1059567083 /nfs/dbraw/zinc/56/70/83/1059567083.db2.gz ZGBDMWACRGAYSY-UHFFFAOYSA-N -1 1 314.772 4.303 20 0 DIADMM CC(C)[C@@H]1CCCN(C(=O)NCc2ccc([O-])c(Cl)c2)CC1 ZINC001248410742 1059817691 /nfs/dbraw/zinc/81/76/91/1059817691.db2.gz GSZKHRRNJFGRCE-CQSZACIVSA-N -1 1 324.852 4.013 20 0 DIADMM CCC[C@H](C)[C@@H]1CCCN1C(=O)NCc1ccc([O-])c(Cl)c1 ZINC001248411184 1059819606 /nfs/dbraw/zinc/81/96/06/1059819606.db2.gz MUMPWEULMCHCTN-WFASDCNBSA-N -1 1 324.852 4.156 20 0 DIADMM CCc1cccc(C)c1NC(=S)Nc1cc(F)c([O-])cc1F ZINC001249565487 1060293554 /nfs/dbraw/zinc/29/35/54/1060293554.db2.gz VFURRIQMKJOIDM-UHFFFAOYSA-N -1 1 322.380 4.350 20 0 DIADMM Cc1c(N)c(F)ccc1Nc1cc(Cl)c([O-])cc1Cl ZINC001249641687 1060324858 /nfs/dbraw/zinc/32/48/58/1060324858.db2.gz RZERRLWBKYRJNG-UHFFFAOYSA-N -1 1 301.148 4.472 20 0 DIADMM Cc1cc(C)c(NC(=S)Nc2cc(Cl)ncc2[O-])c(C)c1 ZINC001249723282 1060372933 /nfs/dbraw/zinc/37/29/33/1060372933.db2.gz RMOGSLHNUGTJHY-UHFFFAOYSA-N -1 1 321.833 4.175 20 0 DIADMM O=C([O-])c1c(F)ccc(CN2CCC[C@H]2c2ccccc2)c1F ZINC001249774256 1060392156 /nfs/dbraw/zinc/39/21/56/1060392156.db2.gz UQRCVHFITBLGOV-HNNXBMFYSA-N -1 1 317.335 4.000 20 0 DIADMM Cc1cc(C(F)(F)F)ncc1Nc1cc([O-])c(F)c(F)c1F ZINC001249957396 1060501157 /nfs/dbraw/zinc/50/11/57/1060501157.db2.gz FJGPDJRQSYIILD-UHFFFAOYSA-N -1 1 322.208 4.275 20 0 DIADMM Cc1nc(C(F)(F)F)ccc1Nc1cc([O-])c(F)c(F)c1F ZINC001249958795 1060503123 /nfs/dbraw/zinc/50/31/23/1060503123.db2.gz POGFXNBCVFBKOY-UHFFFAOYSA-N -1 1 322.208 4.275 20 0 DIADMM COc1cccc2cc(Nc3cc([O-])c(F)c(F)c3F)cnc21 ZINC001249961118 1060503445 /nfs/dbraw/zinc/50/34/45/1060503445.db2.gz GMNVXDBZEACOPQ-UHFFFAOYSA-N -1 1 320.270 4.110 20 0 DIADMM Cc1cn(-c2ccc(Nc3cc([O-])c(F)c(F)c3F)cc2)cn1 ZINC001249961791 1060504847 /nfs/dbraw/zinc/50/48/47/1060504847.db2.gz GCRVBABBBKNUNB-UHFFFAOYSA-N -1 1 319.286 4.047 20 0 DIADMM COc1ccc2cc(Nc3cc([O-])c(F)c(F)c3F)cnc2c1 ZINC001249960756 1060504974 /nfs/dbraw/zinc/50/49/74/1060504974.db2.gz SHUNQOXEQFLLRH-UHFFFAOYSA-N -1 1 320.270 4.110 20 0 DIADMM [O-]c1cc(Nc2cnc3cc(F)ccc3c2)c(F)c(F)c1F ZINC001249961275 1060505134 /nfs/dbraw/zinc/50/51/34/1060505134.db2.gz OJBLKCGUYBOSEU-UHFFFAOYSA-N -1 1 308.234 4.240 20 0 DIADMM [O-]c1cc(Nc2cnc(Cl)cc2Cl)c(F)c(F)c1F ZINC001249960504 1060505761 /nfs/dbraw/zinc/50/57/61/1060505761.db2.gz KZQBDTLUBXVFDO-UHFFFAOYSA-N -1 1 309.074 4.255 20 0 DIADMM Cc1cccc2sc(Nc3cc([O-])c(F)c(F)c3F)nc21 ZINC001249958407 1060505981 /nfs/dbraw/zinc/50/59/81/1060505981.db2.gz NECXNIOARVGDGL-UHFFFAOYSA-N -1 1 310.300 4.471 20 0 DIADMM [O-]c1cc(Nc2nc3cc(Cl)ccc3o2)c(F)c(F)c1F ZINC001249958162 1060506193 /nfs/dbraw/zinc/50/61/93/1060506193.db2.gz JHQKSYFCHSCJMM-UHFFFAOYSA-N -1 1 314.650 4.348 20 0 DIADMM COc1ccc(Cl)c(Nc2cc([O-])c(F)c(F)c2F)c1 ZINC001249963512 1060506700 /nfs/dbraw/zinc/50/67/00/1060506700.db2.gz ZDAOCWJDUNLBFB-UHFFFAOYSA-N -1 1 303.667 4.215 20 0 DIADMM [O-]c1cc(Nc2ccccc2Br)c(F)c(F)c1F ZINC001249962771 1060508735 /nfs/dbraw/zinc/50/87/35/1060508735.db2.gz NQPGELYVJFGXQS-UHFFFAOYSA-N -1 1 318.092 4.316 20 0 DIADMM Cc1ccc(Nc2cc([O-])c(F)c(F)c2F)c2cccnc12 ZINC001249962643 1060510483 /nfs/dbraw/zinc/51/04/83/1060510483.db2.gz LVBKOOXNRDOSGE-UHFFFAOYSA-N -1 1 304.271 4.410 20 0 DIADMM Cc1ccc(Nc2cc([O-])c(F)c(F)c2F)cc1OC(F)F ZINC001249964763 1060510520 /nfs/dbraw/zinc/51/05/20/1060510520.db2.gz LZARCTSZLQLUTA-UHFFFAOYSA-N -1 1 319.229 4.463 20 0 DIADMM CC(C)n1ncc2cc(Nc3cc([O-])c(F)c(F)c3F)ccc21 ZINC001249965748 1060512649 /nfs/dbraw/zinc/51/26/49/1060512649.db2.gz KAFDOJFKEOBTJO-UHFFFAOYSA-N -1 1 321.302 4.484 20 0 DIADMM CCOc1cccc(F)c1Nc1cc([O-])c(F)c(F)c1F ZINC001249965579 1060513848 /nfs/dbraw/zinc/51/38/48/1060513848.db2.gz BATHMDLICQMEDV-UHFFFAOYSA-N -1 1 301.239 4.091 20 0 DIADMM [O-]c1cc(F)c(Nc2cnnc(Cl)c2Cl)cc1Cl ZINC001250023752 1060547045 /nfs/dbraw/zinc/54/70/45/1060547045.db2.gz ZJSMWOHETSWVOW-UHFFFAOYSA-N -1 1 308.527 4.025 20 0 DIADMM [O-]c1cc(Cc2cccc(C(F)(F)F)c2)c(F)c(F)c1F ZINC001249996743 1060530228 /nfs/dbraw/zinc/53/02/28/1060530228.db2.gz UCNSITLGBMYNGO-UHFFFAOYSA-N -1 1 306.205 4.419 20 0 DIADMM Cn1nc(-c2ccccc2)cc1Nc1cc(Cl)c([O-])cc1F ZINC001250020225 1060542737 /nfs/dbraw/zinc/54/27/37/1060542737.db2.gz FWBCZLCMMKXUJO-UHFFFAOYSA-N -1 1 317.751 4.329 20 0 DIADMM Cc1nc(Cl)c(Nc2cc(Cl)c([O-])cc2F)c(Cl)n1 ZINC001250020326 1060542994 /nfs/dbraw/zinc/54/29/94/1060542994.db2.gz QAGTUBAISQITOJ-UHFFFAOYSA-N -1 1 322.554 4.334 20 0 DIADMM [O-]c1cc(F)c(Nc2cccnc2C(F)(F)F)cc1Cl ZINC001250019776 1060545075 /nfs/dbraw/zinc/54/50/75/1060545075.db2.gz DYJJINDIWKFEAJ-UHFFFAOYSA-N -1 1 306.646 4.342 20 0 DIADMM [O-]c1cc(F)c(Nc2snnc2-c2ccccc2)cc1Cl ZINC001250020391 1060545202 /nfs/dbraw/zinc/54/52/02/1060545202.db2.gz TWEQFXZIPASOAK-UHFFFAOYSA-N -1 1 321.764 4.447 20 0 DIADMM O=c1ccc2cc(Nc3cc(Cl)c([O-])cc3F)c[nH]c-2c1 ZINC001250023555 1060547920 /nfs/dbraw/zinc/54/79/20/1060547920.db2.gz OWIKYMMXLQFXJK-UHFFFAOYSA-N -1 1 304.708 4.182 20 0 DIADMM [O-]c1cc(F)c(Nc2cccnc2-c2ccccn2)cc1Cl ZINC001250023743 1060549254 /nfs/dbraw/zinc/54/92/54/1060549254.db2.gz YUOWWTRSYMZZTR-UHFFFAOYSA-N -1 1 315.735 4.385 20 0 DIADMM CCOC(=O)c1cccc(Nc2cc(Cl)c([O-])cc2F)c1 ZINC001250023861 1060550088 /nfs/dbraw/zinc/55/00/88/1060550088.db2.gz FLJCOAPVQWDPEW-UHFFFAOYSA-N -1 1 309.724 4.105 20 0 DIADMM [O-]c1cc(F)c(Nc2ccc(-c3ccncn3)cc2)cc1Cl ZINC001250026013 1060550246 /nfs/dbraw/zinc/55/02/46/1060550246.db2.gz JZMBNUIQRFNYDO-UHFFFAOYSA-N -1 1 315.735 4.385 20 0 DIADMM CN1CCCc2ccc(Nc3cc(Cl)c([O-])cc3F)cc21 ZINC001250024057 1060550614 /nfs/dbraw/zinc/55/06/14/1060550614.db2.gz OTVBAGBTHZJHBQ-UHFFFAOYSA-N -1 1 306.768 4.311 20 0 DIADMM Cc1c2ccc(Nc3cc(Cl)c([O-])cc3F)cc2nn1C ZINC001250024128 1060552020 /nfs/dbraw/zinc/55/20/20/1060552020.db2.gz SPTRUBSUZUUQKX-UHFFFAOYSA-N -1 1 305.740 4.123 20 0 DIADMM [O-]c1cc(F)c(Nc2cc(Cl)ccc2CO)cc1Cl ZINC001250025920 1060552313 /nfs/dbraw/zinc/55/23/13/1060552313.db2.gz IMZNRNHQPBXKRL-UHFFFAOYSA-N -1 1 302.132 4.074 20 0 DIADMM O=c1ccc2c(Nc3cc(Cl)c([O-])cc3F)cccc2[nH]1 ZINC001250026894 1060555300 /nfs/dbraw/zinc/55/53/00/1060555300.db2.gz QWWNMJVYCWKTKT-UHFFFAOYSA-N -1 1 304.708 4.182 20 0 DIADMM Nc1cc(F)cc(Nc2cc(Cl)c([O-])cc2F)c1Cl ZINC001250029815 1060557217 /nfs/dbraw/zinc/55/72/17/1060557217.db2.gz UIOSLXIFXHJBBT-UHFFFAOYSA-N -1 1 305.111 4.303 20 0 DIADMM COc1c(Cl)ccc(F)c1Nc1c([O-])cc(F)cc1F ZINC001250102145 1060609868 /nfs/dbraw/zinc/60/98/68/1060609868.db2.gz IYJUOICEVUJDMG-UHFFFAOYSA-N -1 1 303.667 4.215 20 0 DIADMM COc1c(Cl)ccc(F)c1Nc1cc(F)c([O-])cc1F ZINC001250107242 1060614624 /nfs/dbraw/zinc/61/46/24/1060614624.db2.gz PUBCSWCDGIYNDJ-UHFFFAOYSA-N -1 1 303.667 4.215 20 0 DIADMM COC(=O)c1c(C)scc1Nc1c(F)ccc([O-])c1Cl ZINC001250229787 1060707987 /nfs/dbraw/zinc/70/79/87/1060707987.db2.gz NXFGUOUBKUZXQR-UHFFFAOYSA-N -1 1 315.753 4.085 20 0 DIADMM CCOC(=O)c1cccc(Nc2c(F)ccc([O-])c2Cl)c1 ZINC001250232451 1060710994 /nfs/dbraw/zinc/71/09/94/1060710994.db2.gz LYWUVFAXINTYQV-UHFFFAOYSA-N -1 1 309.724 4.105 20 0 DIADMM [O-]c1ccc(F)c(Nc2cnc3ccc(O)cc3c2)c1Cl ZINC001250230420 1060711463 /nfs/dbraw/zinc/71/14/63/1060711463.db2.gz XTYPPTWFRIMPOZ-UHFFFAOYSA-N -1 1 304.708 4.182 20 0 DIADMM Cc1cn(-c2ccc(Nc3c(F)ccc([O-])c3Cl)cc2)cn1 ZINC001250233944 1060713607 /nfs/dbraw/zinc/71/36/07/1060713607.db2.gz GVMIBMKSBIUZJT-UHFFFAOYSA-N -1 1 317.751 4.422 20 0 DIADMM [O-]c1cc(Nc2c(F)ccc(O)c2Cl)c(F)cc1Cl ZINC001250233874 1060714916 /nfs/dbraw/zinc/71/49/16/1060714916.db2.gz YCNQIBGULVOBTC-UHFFFAOYSA-N -1 1 306.095 4.426 20 0 DIADMM COC(=O)c1ccc(Nc2c(F)ccc([O-])c2Cl)cc1C ZINC001250234255 1060715109 /nfs/dbraw/zinc/71/51/09/1060715109.db2.gz NBRNCWFEOVLPQY-UHFFFAOYSA-N -1 1 309.724 4.023 20 0 DIADMM CC(=O)c1cc(Nc2c(F)ccc([O-])c2Cl)cc(C(C)=O)c1 ZINC001250236325 1060716859 /nfs/dbraw/zinc/71/68/59/1060716859.db2.gz ORVFNNPEXHRLJB-UHFFFAOYSA-N -1 1 321.735 4.334 20 0 DIADMM COc1ccc(C(C)=O)c(Nc2c(F)ccc([O-])c2Cl)c1 ZINC001250236540 1060717347 /nfs/dbraw/zinc/71/73/47/1060717347.db2.gz SUMOZSPWRAAPNV-UHFFFAOYSA-N -1 1 309.724 4.140 20 0 DIADMM [O-]c1c(F)cc(F)c(CCCCOCc2ccccc2)c1F ZINC001250253637 1060733405 /nfs/dbraw/zinc/73/34/05/1060733405.db2.gz WFNUYLDOGRWETM-UHFFFAOYSA-N -1 1 310.315 4.349 20 0 DIADMM [O-]c1cc(Nc2ccc(CO)c(F)c2Cl)c(F)cc1Cl ZINC001250298276 1060765912 /nfs/dbraw/zinc/76/59/12/1060765912.db2.gz NLSZWOZZUGHAAC-UHFFFAOYSA-N -1 1 320.122 4.213 20 0 DIADMM COc1ccc(F)c(Nc2ccc(F)c(F)c2[O-])c1Cl ZINC001250308800 1060773501 /nfs/dbraw/zinc/77/35/01/1060773501.db2.gz NITLXGSWAKMDKU-UHFFFAOYSA-N -1 1 303.667 4.215 20 0 DIADMM C=Cc1cccc([N-]S(=O)(=O)c2cccc3ccccc32)c1 ZINC001250618122 1060948473 /nfs/dbraw/zinc/94/84/73/1060948473.db2.gz DHLQZIKEUVTXKP-UHFFFAOYSA-N -1 1 309.390 4.284 20 0 DIADMM O=S(=O)([N-]c1ccc2occc2c1)c1cccc2ccccc21 ZINC001250619434 1060949761 /nfs/dbraw/zinc/94/97/61/1060949761.db2.gz QTMYGOAYNKOSNY-UHFFFAOYSA-N -1 1 323.373 4.387 20 0 DIADMM CSCCCn1c2ccccc2nc1-c1c([O-])cccc1F ZINC001250674814 1061007458 /nfs/dbraw/zinc/00/74/58/1061007458.db2.gz VYJIWYDJKXNOIZ-UHFFFAOYSA-N -1 1 316.401 4.301 20 0 DIADMM Cc1cc2[nH]c(-c3c([O-])cccc3F)nc2cc1C(F)(F)F ZINC001250674037 1061007861 /nfs/dbraw/zinc/00/78/61/1061007861.db2.gz IZHXLGSYYUZODN-UHFFFAOYSA-N -1 1 310.250 4.402 20 0 DIADMM COc1ccc2nc(-c3cc(Cl)c([O-])c(Cl)c3)[nH]c2c1 ZINC001250911797 1061122500 /nfs/dbraw/zinc/12/25/00/1061122500.db2.gz OENCHFHZVPWCPX-UHFFFAOYSA-N -1 1 309.152 4.251 20 0 DIADMM COc1ccc2nc(-c3ccc([O-])c(F)c3F)n(C3CC3)c2c1 ZINC001250915214 1061123816 /nfs/dbraw/zinc/12/38/16/1061123816.db2.gz UGNYDDZQSIOHQL-UHFFFAOYSA-N -1 1 316.307 4.031 20 0 DIADMM CCCOc1ccc2nc(-c3ccc([O-])c(F)c3F)n(C)c2c1 ZINC001250914862 1061124467 /nfs/dbraw/zinc/12/44/67/1061124467.db2.gz JEMNGGZQLKIHPY-UHFFFAOYSA-N -1 1 318.323 4.013 20 0 DIADMM CCCn1c2cc(OC)ccc2nc1-c1ccc([O-])c(F)c1F ZINC001250914570 1061124529 /nfs/dbraw/zinc/12/45/29/1061124529.db2.gz DCIOWUQWQNSQIG-UHFFFAOYSA-N -1 1 318.323 4.106 20 0 DIADMM [O-]c1cc(Cl)c(-c2nc3cc4c(cc3[nH]2)CCO4)c(Cl)c1 ZINC001250957658 1061145978 /nfs/dbraw/zinc/14/59/78/1061145978.db2.gz WRIQLYLANSZQBH-UHFFFAOYSA-N -1 1 321.163 4.177 20 0 DIADMM Cn1c(-c2c(Cl)cc([O-])cc2Cl)nc2cccc(F)c21 ZINC001250956532 1061146071 /nfs/dbraw/zinc/14/60/71/1061146071.db2.gz DGKBSQJKNRCVNT-UHFFFAOYSA-N -1 1 311.143 4.392 20 0 DIADMM [O-]c1cc(F)c(F)cc1-c1nc2c(cccc2C(F)(F)F)[nH]1 ZINC001250966628 1061151038 /nfs/dbraw/zinc/15/10/38/1061151038.db2.gz FSAWXYICWFOXGJ-UHFFFAOYSA-N -1 1 314.213 4.233 20 0 DIADMM CCCn1c2ccc(F)cc2nc1-c1cc(F)c(F)cc1[O-] ZINC001250966609 1061151498 /nfs/dbraw/zinc/15/14/98/1061151498.db2.gz DGTUWBJCSYSAQN-UHFFFAOYSA-N -1 1 306.287 4.236 20 0 DIADMM Cc1cccc2nc(-c3cc(F)c(F)cc3[O-])n(C3CC3)c21 ZINC001250967572 1061152406 /nfs/dbraw/zinc/15/24/06/1061152406.db2.gz VISUASSJPNRCNF-UHFFFAOYSA-N -1 1 300.308 4.330 20 0 DIADMM [O-]c1cc(F)c(F)cc1-c1nc2cc(C(F)(F)F)ccc2[nH]1 ZINC001250967655 1061153620 /nfs/dbraw/zinc/15/36/20/1061153620.db2.gz YVZDAMOQICQGPP-UHFFFAOYSA-N -1 1 314.213 4.233 20 0 DIADMM [O-]c1cc(F)c(-c2nc3cc(F)ccc3n2C2CC2)c(F)c1 ZINC001251007123 1061178793 /nfs/dbraw/zinc/17/87/93/1061178793.db2.gz DJEXMHNVQZUTFU-UHFFFAOYSA-N -1 1 304.271 4.161 20 0 DIADMM C[C@H]1c2sccc2CCN1C(=O)c1ccc2ccccc2c1[O-] ZINC001455293219 1061216687 /nfs/dbraw/zinc/21/66/87/1061216687.db2.gz MLSMTWVCLPYNFE-LBPRGKRZSA-N -1 1 323.417 4.366 20 0 DIADMM CC(C)(C)Sc1ccccc1[N-]S(=O)(=O)c1ccccc1 ZINC001251151687 1061248953 /nfs/dbraw/zinc/24/89/53/1061248953.db2.gz HULQHANLSJFHFK-UHFFFAOYSA-N -1 1 321.467 4.378 20 0 DIADMM Cc1cccc(C(C)(C)C)c1[N-]S(=O)(=O)c1ccccc1 ZINC001251151680 1061249768 /nfs/dbraw/zinc/24/97/68/1061249768.db2.gz HIWNPOKRJJFRPT-UHFFFAOYSA-N -1 1 303.427 4.093 20 0 DIADMM Cc1ccc2nc(-c3c([O-])cc(Br)cc3F)[nH]c2c1 ZINC001251248162 1061288058 /nfs/dbraw/zinc/28/80/58/1061288058.db2.gz BNONQEICIKZEQX-UHFFFAOYSA-N -1 1 321.149 4.146 20 0 DIADMM CC(C)(C)n1c2cc(F)ccc2nc1-c1cc(Cl)ncc1[O-] ZINC001251252537 1061292744 /nfs/dbraw/zinc/29/27/44/1061292744.db2.gz YZXFISJFZRVYSE-UHFFFAOYSA-N -1 1 319.767 4.351 20 0 DIADMM CCCCn1c2cc(F)ccc2nc1-c1cc(Cl)ncc1[O-] ZINC001251252397 1061293032 /nfs/dbraw/zinc/29/30/32/1061293032.db2.gz VNFSKQJDQRFMSD-UHFFFAOYSA-N -1 1 319.767 4.397 20 0 DIADMM CC(C)(C)n1c2ccccc2nc1-c1c(F)ccc([O-])c1F ZINC001251336035 1061321169 /nfs/dbraw/zinc/32/11/69/1061321169.db2.gz YPVSUGQMTCZKTP-UHFFFAOYSA-N -1 1 302.324 4.442 20 0 DIADMM [O-]c1ccc(F)c(-c2nc3c(cc(F)c(Cl)c3F)[nH]2)c1F ZINC001251336026 1061322686 /nfs/dbraw/zinc/32/26/86/1061322686.db2.gz XYORGYHKEFFHGH-UHFFFAOYSA-N -1 1 316.641 4.145 20 0 DIADMM COc1cc(C)cc(C(=O)Nc2cc(F)c([O-])cc2Cl)c1C ZINC001456617886 1061345078 /nfs/dbraw/zinc/34/50/78/1061345078.db2.gz KNSPFBAOBMAIJC-UHFFFAOYSA-N -1 1 323.751 4.062 20 0 DIADMM Cc1cc(Br)c([O-])c(-c2nc3c(cccc3F)[nH]2)c1 ZINC001251469825 1061368502 /nfs/dbraw/zinc/36/85/02/1061368502.db2.gz CHDYSFCPOXQAFL-UHFFFAOYSA-N -1 1 321.149 4.146 20 0 DIADMM Cc1cc(Br)c([O-])c(-c2nc3ccccc3[nH]2)c1 ZINC001251469995 1061369167 /nfs/dbraw/zinc/36/91/67/1061369167.db2.gz GZJFZYLZSBXXIW-UHFFFAOYSA-N -1 1 303.159 4.006 20 0 DIADMM COc1cc([O-])c(-c2nc3cc(Cl)ccc3[nH]2)c(Cl)c1 ZINC001251491397 1061378343 /nfs/dbraw/zinc/37/83/43/1061378343.db2.gz TXCZYUUFBANNAU-UHFFFAOYSA-N -1 1 309.152 4.251 20 0 DIADMM [O-]c1cc(Cl)c(Cl)cc1-c1nc2cc3c(cc2[nH]1)CCO3 ZINC001251491295 1061378917 /nfs/dbraw/zinc/37/89/17/1061378917.db2.gz NLDPKUJWAUVBEW-UHFFFAOYSA-N -1 1 321.163 4.177 20 0 DIADMM COc1cccc2c1nc(-c1cc(Cl)c(Cl)cc1[O-])n2C ZINC001251491284 1061379372 /nfs/dbraw/zinc/37/93/72/1061379372.db2.gz MXQWEOYGHSFJGD-UHFFFAOYSA-N -1 1 323.179 4.261 20 0 DIADMM O=C(NC1(C2CCCCC2)CC1)c1ccc2ccccc2c1[O-] ZINC001456989824 1061396117 /nfs/dbraw/zinc/39/61/17/1061396117.db2.gz XHAGGXGJVMWUIJ-UHFFFAOYSA-N -1 1 309.409 4.388 20 0 DIADMM Cn1c(-c2c([O-])ccc(F)c2Cl)nc2cccc(Cl)c21 ZINC001251540722 1061396984 /nfs/dbraw/zinc/39/69/84/1061396984.db2.gz OMLWWOINNDXKAB-UHFFFAOYSA-N -1 1 311.143 4.392 20 0 DIADMM CC[C@@H]1c2ccccc2CN1C(=O)c1ncc2ccccc2c1[O-] ZINC001457010081 1061399903 /nfs/dbraw/zinc/39/99/03/1061399903.db2.gz RDCRIFMKQRTTDS-QGZVFWFLSA-N -1 1 318.376 4.048 20 0 DIADMM Fc1cc2[n-]c(C3OC=CC3=S)nc2c(C(F)(F)F)c1 ZINC001251546948 1061401571 /nfs/dbraw/zinc/40/15/71/1061401571.db2.gz WLHSAFFKEASHPE-UHFFFAOYSA-N -1 1 302.252 4.270 20 0 DIADMM O=S(=O)([N-]c1ccccc1C1CC1)c1ccc(Cl)cc1 ZINC001251701787 1061447964 /nfs/dbraw/zinc/44/79/64/1061447964.db2.gz CPEJPIMIPVERJB-UHFFFAOYSA-N -1 1 307.802 4.018 20 0 DIADMM C[C@@]1(NC(=O)c2c([O-])cccc2Cl)CCCc2ccccc21 ZINC001546090442 1061447934 /nfs/dbraw/zinc/44/79/34/1061447934.db2.gz RQFFGOGZKFTDBN-GOSISDBHSA-N -1 1 315.800 4.027 20 0 DIADMM Cc1c2[nH]c(-c3ccc(F)cc3C(=O)[O-])nc2ccc1Cl ZINC001251725161 1061459599 /nfs/dbraw/zinc/45/95/99/1061459599.db2.gz UJVMBEQGRKQQFS-UHFFFAOYSA-N -1 1 304.708 4.029 20 0 DIADMM O=S(=O)([N-]c1cccc2sccc21)c1ccc(Cl)cc1 ZINC001251738730 1061463491 /nfs/dbraw/zinc/46/34/91/1061463491.db2.gz TVPBLDBKOJJVDI-UHFFFAOYSA-N -1 1 323.826 4.356 20 0 DIADMM O=S(=O)([N-]c1ccc(C2CC2)cc1)c1ccc(Cl)cc1 ZINC001251738693 1061464319 /nfs/dbraw/zinc/46/43/19/1061464319.db2.gz QNSPKJKJUFMATO-UHFFFAOYSA-N -1 1 307.802 4.018 20 0 DIADMM Cc1cccc(C2CC2)c1[N-]S(=O)(=O)c1ccc(Cl)cc1 ZINC001251744116 1061466772 /nfs/dbraw/zinc/46/67/72/1061466772.db2.gz OSHXSBSWTZAITO-UHFFFAOYSA-N -1 1 321.829 4.327 20 0 DIADMM CC[C@H](CC(=O)Nc1ccc(F)cc1[O-])c1ccc(C)cc1 ZINC001457712334 1061487861 /nfs/dbraw/zinc/48/78/61/1061487861.db2.gz AECHJRICCFPDLC-CYBMUJFWSA-N -1 1 301.361 4.362 20 0 DIADMM Cc1c2[nH]c(-c3ccc(F)c(C(=O)[O-])c3F)nc2ccc1Cl ZINC001251846653 1061506086 /nfs/dbraw/zinc/50/60/86/1061506086.db2.gz QCXLOCJGBVJAPL-UHFFFAOYSA-N -1 1 322.698 4.168 20 0 DIADMM CCc1ccc([C@@H](NC(=O)c2c([O-])cccc2F)C(C)C)cc1 ZINC001463890764 1061529675 /nfs/dbraw/zinc/52/96/75/1061529675.db2.gz OPCJMMLBBZGOEU-SFHVURJKSA-N -1 1 315.388 4.221 20 0 DIADMM CCc1ccc([C@H](NC(=O)c2c([O-])cccc2F)C(C)C)cc1 ZINC001463890763 1061530597 /nfs/dbraw/zinc/53/05/97/1061530597.db2.gz OPCJMMLBBZGOEU-GOSISDBHSA-N -1 1 315.388 4.221 20 0 DIADMM CC(C)(C)[C@H](NC(=O)c1ccc(F)c([O-])c1)c1ccc(F)cc1 ZINC001464214249 1061565331 /nfs/dbraw/zinc/56/53/31/1061565331.db2.gz HSOWILCYYNYHSR-MRXNPFEDSA-N -1 1 319.351 4.188 20 0 DIADMM CC1(C)CN(C(=O)c2c([O-])cccc2Cl)[C@@H]1c1ccccc1 ZINC001464466397 1061597535 /nfs/dbraw/zinc/59/75/35/1061597535.db2.gz KYGZZUXWMMEFSE-MRXNPFEDSA-N -1 1 315.800 4.269 20 0 DIADMM Cc1ccc(S(=O)(=O)[N-]c2cccc3sccc32)cc1 ZINC001252190238 1061606879 /nfs/dbraw/zinc/60/68/79/1061606879.db2.gz OFXFYQNJLSFCSA-UHFFFAOYSA-N -1 1 303.408 4.011 20 0 DIADMM C[C@H]([N-]C(=O)C(C)(F)F)c1ccc(Cl)c(Cl)c1Cl ZINC001464989924 1061659479 /nfs/dbraw/zinc/65/94/79/1061659479.db2.gz OJXIPUOWGDIAKP-YFKPBYRVSA-N -1 1 316.562 4.479 20 0 DIADMM Cc1cc(=NC(=O)c2cc(C(C)C)cc(C(C)C)c2[O-])cc[nH]1 ZINC001465145081 1061691541 /nfs/dbraw/zinc/69/15/41/1061691541.db2.gz OJYVIEXGFHQDTI-UHFFFAOYSA-N -1 1 312.413 4.017 20 0 DIADMM C[C@@H](CCC(C)(C)C)NC(=O)c1ccc2ccc(O)cc2c1[O-] ZINC001465257700 1061720586 /nfs/dbraw/zinc/72/05/86/1061720586.db2.gz NBLPGCLOLPZKKL-LBPRGKRZSA-N -1 1 315.413 4.196 20 0 DIADMM CC(C)(NC(=O)c1cc(Cl)ccc1[O-])c1cccc(Cl)c1 ZINC001465337568 1061735128 /nfs/dbraw/zinc/73/51/28/1061735128.db2.gz GKUFOSQUHSQIGJ-UHFFFAOYSA-N -1 1 324.207 4.364 20 0 DIADMM [O-]c1cccc(-c2nnc(-c3ccc(C(F)(F)F)cc3)o2)c1F ZINC001252926118 1061754225 /nfs/dbraw/zinc/75/42/25/1061754225.db2.gz PGMLMCKNBBISEQ-UHFFFAOYSA-N -1 1 324.233 4.267 20 0 DIADMM [O-]c1ccc(-c2nnc(-c3ccc(C(F)(F)F)cc3)o2)cc1F ZINC001252926742 1061756009 /nfs/dbraw/zinc/75/60/09/1061756009.db2.gz WJBOJOLLBFSXOY-UHFFFAOYSA-N -1 1 324.233 4.267 20 0 DIADMM [O-]c1ccc(-c2nnc(-c3ccc(C(F)(F)F)cc3)o2)c(F)c1 ZINC001252925661 1061756209 /nfs/dbraw/zinc/75/62/09/1061756209.db2.gz FULGEKQSXDKTFX-UHFFFAOYSA-N -1 1 324.233 4.267 20 0 DIADMM O=S(=O)(/C=C/c1ccccc1)[N-]c1cc2ccccc2s1 ZINC001252958370 1061762022 /nfs/dbraw/zinc/76/20/22/1061762022.db2.gz QZPMHQPWHHOKRO-ZHACJKMWSA-N -1 1 315.419 4.314 20 0 DIADMM [O-]c1cc(C(F)(F)F)ccc1-c1nnc(-c2ccccc2)o1 ZINC001253046719 1061791528 /nfs/dbraw/zinc/79/15/28/1061791528.db2.gz AIBIOBFZQGMXQZ-UHFFFAOYSA-N -1 1 306.243 4.128 20 0 DIADMM O=C(c1ccc([O-])c(F)c1)N1CCC[C@H]1CCC1CCCCC1 ZINC001466052676 1061865854 /nfs/dbraw/zinc/86/58/54/1061865854.db2.gz XBNQSSPDIRBAII-INIZCTEOSA-N -1 1 319.420 4.496 20 0 DIADMM O=C(Nc1cc(Cl)ccc1O)c1ccc2ccccc2c1[O-] ZINC001466257970 1061907311 /nfs/dbraw/zinc/90/73/11/1061907311.db2.gz MNKVOWHEHMLPAJ-UHFFFAOYSA-N -1 1 313.740 4.157 20 0 DIADMM CCCC[C@H](C)C(=O)Nc1cc(C)cc(Br)c1[O-] ZINC001466423213 1061938047 /nfs/dbraw/zinc/93/80/47/1061938047.db2.gz NKJDJKRFKRDVGF-JTQLQIEISA-N -1 1 314.223 4.228 20 0 DIADMM [O-]c1ccc(-c2nnc(-c3cccc(Cl)c3)o2)c(Cl)c1 ZINC001253734276 1061966069 /nfs/dbraw/zinc/96/60/69/1061966069.db2.gz BIIHLPHDOJVZLG-UHFFFAOYSA-N -1 1 307.136 4.416 20 0 DIADMM O=C(Nc1ccc(Br)c([O-])c1)[C@H]1CCC=CCCC1 ZINC001466898463 1062020124 /nfs/dbraw/zinc/02/01/24/1062020124.db2.gz NQBMWTDTORIMLB-NSHDSACASA-N -1 1 324.218 4.230 20 0 DIADMM CC(C)(C)[C@@H]1CCC[C@H](NC(=O)c2cccc([O-])c2F)CC1 ZINC001466945409 1062030677 /nfs/dbraw/zinc/03/06/77/1062030677.db2.gz RSUJNZQTBWNYRM-OLZOCXBDSA-N -1 1 307.409 4.256 20 0 DIADMM CC(C)(C)[C@@H]1CCC[C@@H](NC(=O)c2ccc(F)c([O-])c2)CC1 ZINC001466943533 1062031075 /nfs/dbraw/zinc/03/10/75/1062031075.db2.gz GJAYNONVKZEZSG-ZIAGYGMSSA-N -1 1 307.409 4.256 20 0 DIADMM CC(C)(C)[C@H]1CCC[C@@H](NC(=O)c2ccc(F)c([O-])c2)CC1 ZINC001466943532 1062031821 /nfs/dbraw/zinc/03/18/21/1062031821.db2.gz GJAYNONVKZEZSG-UONOGXRCSA-N -1 1 307.409 4.256 20 0 DIADMM [O-]c1ccc(C(F)(F)F)cc1-c1nnc(-c2cccc(F)c2)o1 ZINC001254209775 1062049224 /nfs/dbraw/zinc/04/92/24/1062049224.db2.gz RLYIBXRDAVQCLJ-UHFFFAOYSA-N -1 1 324.233 4.267 20 0 DIADMM CSc1ccc(CNC(=O)c2ccc3ccccc3c2[O-])cc1 ZINC001467244054 1062094330 /nfs/dbraw/zinc/09/43/30/1062094330.db2.gz IWEXHTGDPHNLFC-UHFFFAOYSA-N -1 1 323.417 4.197 20 0 DIADMM [O-]c1ccc(-c2nnc(Cc3cccc(Cl)c3)o2)c(Cl)c1 ZINC001254415485 1062096438 /nfs/dbraw/zinc/09/64/38/1062096438.db2.gz QMCWZOVMTTUVLV-UHFFFAOYSA-N -1 1 321.163 4.340 20 0 DIADMM CC[C@@H](C)c1ccccc1[N-]S(=O)(=O)c1ccccc1C ZINC001254497747 1062143588 /nfs/dbraw/zinc/14/35/88/1062143588.db2.gz NTQIPAXVSWUELY-CYBMUJFWSA-N -1 1 303.427 4.309 20 0 DIADMM [O-]c1ccc(-c2nnc([C@@H]3C[C@@H]3c3ccccc3)o2)c(Cl)c1 ZINC001254511619 1062154127 /nfs/dbraw/zinc/15/41/27/1062154127.db2.gz CZOKPPOJSJVDNU-ZIAGYGMSSA-N -1 1 312.756 4.367 20 0 DIADMM C[C@H]1C[C@@H](CCNC(=O)c2cc(F)ccc2[O-])CC(C)(C)C1 ZINC001467635713 1062167524 /nfs/dbraw/zinc/16/75/24/1062167524.db2.gz FEABMYVIBZOQKK-QWHCGFSZSA-N -1 1 307.409 4.114 20 0 DIADMM O=C(Nc1ccc([O-])c(F)c1F)c1ccc(Cl)c(Cl)c1 ZINC001467999858 1062243355 /nfs/dbraw/zinc/24/33/55/1062243355.db2.gz RBPDAKOIKBKDMA-UHFFFAOYSA-N -1 1 318.106 4.230 20 0 DIADMM CC[C@H](Sc1ccccc1)C(=O)Nc1ccc([O-])c(F)c1F ZINC001468003047 1062244613 /nfs/dbraw/zinc/24/46/13/1062244613.db2.gz FCJGPIAHTYLQBH-ZDUSSCGKSA-N -1 1 323.364 4.180 20 0 DIADMM Cc1ccc(C)c(S(=O)(=O)[N-]c2c(C)cccc2C2CC2)c1 ZINC001254800231 1062250286 /nfs/dbraw/zinc/25/02/86/1062250286.db2.gz LTTVCXOKJGECBV-UHFFFAOYSA-N -1 1 315.438 4.290 20 0 DIADMM CC(C)CN(C(=O)c1ccc([O-])cc1F)c1cccc(Cl)c1 ZINC001468050186 1062253465 /nfs/dbraw/zinc/25/34/65/1062253465.db2.gz DMSURXKKNFQMBS-UHFFFAOYSA-N -1 1 321.779 4.488 20 0 DIADMM CC(C)c1ccc(-c2nnc(-c3nc(C(F)(F)F)c[n-]3)o2)cc1 ZINC001254872626 1062268784 /nfs/dbraw/zinc/26/87/84/1062268784.db2.gz CRCHAYSJUCJSKM-UHFFFAOYSA-N -1 1 322.290 4.269 20 0 DIADMM CC(C)c1ccc(-c2nnc(-c3ncc(C(F)(F)F)[n-]3)o2)cc1 ZINC001254872626 1062268802 /nfs/dbraw/zinc/26/88/02/1062268802.db2.gz CRCHAYSJUCJSKM-UHFFFAOYSA-N -1 1 322.290 4.269 20 0 DIADMM O=C(Nc1cccc(C2CC2)n1)c1cc2ccccc2cc1[O-] ZINC001468309192 1062297243 /nfs/dbraw/zinc/29/72/43/1062297243.db2.gz UUXNYAWOMRSKCX-UHFFFAOYSA-N -1 1 304.349 4.070 20 0 DIADMM CCc1ccc(S(=O)(=O)[N-]c2cc3cccccc-3c2)cc1 ZINC001255028439 1062305803 /nfs/dbraw/zinc/30/58/03/1062305803.db2.gz GBRVAKHSHHNXLK-UHFFFAOYSA-N -1 1 311.406 4.155 20 0 DIADMM CCc1cccc(N(C)C(=O)c2cc3ccccc3cc2[O-])c1 ZINC001468796082 1062403807 /nfs/dbraw/zinc/40/38/07/1062403807.db2.gz JAIZKVSOZUWVQU-UHFFFAOYSA-N -1 1 305.377 4.384 20 0 DIADMM CC(C)c1ccc(S(=O)(=O)[N-]c2cccc3occc32)cc1 ZINC001255335324 1062409408 /nfs/dbraw/zinc/40/94/08/1062409408.db2.gz CBRMMPFNTAPEPN-UHFFFAOYSA-N -1 1 315.394 4.357 20 0 DIADMM Cc1cc(Cl)ccc1-c1nnc(-c2ccc(F)c([O-])c2)o1 ZINC001255346793 1062412256 /nfs/dbraw/zinc/41/22/56/1062412256.db2.gz OBJKBPVFDSWZGU-UHFFFAOYSA-N -1 1 304.708 4.210 20 0 DIADMM CC(C)(C)C[C@@H]1CCN(C(=O)c2cccc([O-])c2F)C1(C)C ZINC001468926868 1062439101 /nfs/dbraw/zinc/43/91/01/1062439101.db2.gz DHSYEHUFNFRXSS-LBPRGKRZSA-N -1 1 307.409 4.208 20 0 DIADMM C[C@H](NC(=O)c1cc2ccccc2cc1[O-])[C@@H]1CCC[C@H](C)C1 ZINC001469046910 1062469370 /nfs/dbraw/zinc/46/93/70/1062469370.db2.gz WCRLMRSFXNDQAD-SOUVJXGZSA-N -1 1 311.425 4.490 20 0 DIADMM Cc1cccc(C(C)(C)C)c1[N-]S(=O)(=O)c1cccc(F)c1 ZINC001255653879 1062497293 /nfs/dbraw/zinc/49/72/93/1062497293.db2.gz BRKYEOWAJORYSN-UHFFFAOYSA-N -1 1 321.417 4.232 20 0 DIADMM C[C@@H](CC1CCCCC1)[N-]S(=O)(=O)c1cc2ccccc2o1 ZINC001475263708 1062500431 /nfs/dbraw/zinc/50/04/31/1062500431.db2.gz FPWMYGNKDHGBOF-ZDUSSCGKSA-N -1 1 321.442 4.070 20 0 DIADMM CC(C)CCOc1ccccc1NC(=O)c1cccc([O-])c1F ZINC001469495073 1062568725 /nfs/dbraw/zinc/56/87/25/1062568725.db2.gz YRXIDUPAKORMDK-UHFFFAOYSA-N -1 1 317.360 4.209 20 0 DIADMM O=C(Nc1ccc2ccn(C(F)F)c2c1)c1cccc([O-])c1F ZINC001469906698 1062653147 /nfs/dbraw/zinc/65/31/47/1062653147.db2.gz FILGBDBWIVEINH-UHFFFAOYSA-N -1 1 320.270 4.133 20 0 DIADMM Cc1ccc2c(c1)CN(C(=O)c1cc3ccccc3cc1[O-])CC2 ZINC001469902909 1062653236 /nfs/dbraw/zinc/65/32/36/1062653236.db2.gz GDPMGJQSBKHBJQ-UHFFFAOYSA-N -1 1 317.388 4.052 20 0 DIADMM [O-]c1ccc(-c2nnc(-c3ccc4ccccc4c3)o2)c(F)c1 ZINC001256052773 1062689138 /nfs/dbraw/zinc/68/91/38/1062689138.db2.gz HHCYJHLBWHTGHG-UHFFFAOYSA-N -1 1 306.296 4.402 20 0 DIADMM O=C(c1ccc2ccccc2c1[O-])N1CCC[C@@H](C2CCC2)C1 ZINC001470264863 1062736239 /nfs/dbraw/zinc/73/62/39/1062736239.db2.gz LJEVOGQYNPCUAS-MRXNPFEDSA-N -1 1 309.409 4.198 20 0 DIADMM O=C(Nc1cccc(F)c1[O-])c1ccc(SC(F)F)cc1 ZINC001471166748 1062931045 /nfs/dbraw/zinc/93/10/45/1062931045.db2.gz PPWZQMLJDCZEAH-UHFFFAOYSA-N -1 1 313.300 4.098 20 0 DIADMM CC[C@@H](NC(=O)c1ccc(F)c([O-])c1)c1cc(C)ccc1C ZINC001471167826 1062931549 /nfs/dbraw/zinc/93/15/49/1062931549.db2.gz HWCVUYVIEPNQQI-MRXNPFEDSA-N -1 1 301.361 4.029 20 0 DIADMM O=C(Nc1cccc(F)c1[O-])[C@@H]1C[C@@H]1c1ccc2ccccc2c1 ZINC001471166847 1062931697 /nfs/dbraw/zinc/93/16/97/1062931697.db2.gz SOYRPXBIJPPVSQ-HZPDHXFCSA-N -1 1 321.351 4.427 20 0 DIADMM O=C(Nc1cccc(F)c1[O-])[C@@H]1C[C@H]1c1ccc2ccccc2c1 ZINC001471166848 1062932178 /nfs/dbraw/zinc/93/21/78/1062932178.db2.gz SOYRPXBIJPPVSQ-JKSUJKDBSA-N -1 1 321.351 4.427 20 0 DIADMM Cc1cc([N-]S(=O)(=O)c2cccc(Cl)c2)ccc1Cl ZINC001256790284 1062980667 /nfs/dbraw/zinc/98/06/67/1062980667.db2.gz JHDRWQQNGQYGDU-UHFFFAOYSA-N -1 1 316.209 4.103 20 0 DIADMM CC1(C)CCCC[C@H]1CC(=O)NCc1ccc([O-])c(Cl)c1 ZINC001471699824 1063014415 /nfs/dbraw/zinc/01/44/15/1063014415.db2.gz UMTWOSDFVQEOCY-ZDUSSCGKSA-N -1 1 309.837 4.268 20 0 DIADMM Cc1cccc(S(=O)(=O)[N-]c2cccc(-c3ccccc3)c2)c1 ZINC001256924720 1063051701 /nfs/dbraw/zinc/05/17/01/1063051701.db2.gz WCTZWFFPJMHNNN-UHFFFAOYSA-N -1 1 323.417 4.463 20 0 DIADMM O=C(Nc1cc(F)c([O-])cc1Cl)c1nccc2ccsc21 ZINC001472193799 1063057048 /nfs/dbraw/zinc/05/70/48/1063057048.db2.gz BDVMTHPAJQRCER-UHFFFAOYSA-N -1 1 322.748 4.047 20 0 DIADMM CC(C)(CC(=O)Nc1nc(Cl)ccc1[O-])C1CCCCC1 ZINC001472545367 1063100837 /nfs/dbraw/zinc/10/08/37/1063100837.db2.gz AXYMDXPTQOPUGK-UHFFFAOYSA-N -1 1 310.825 4.376 20 0 DIADMM Cc1ccc([C@@H]2C[C@@H]2c2nnc(-c3cc(F)ccc3[O-])o2)cc1 ZINC001257322861 1063202567 /nfs/dbraw/zinc/20/25/67/1063202567.db2.gz BMRIQLRXNLCVTG-KBPBESRZSA-N -1 1 310.328 4.161 20 0 DIADMM Cc1c(Cl)cccc1S(=O)(=O)[N-]c1ccccc1C1CC1 ZINC001257543410 1063328751 /nfs/dbraw/zinc/32/87/51/1063328751.db2.gz DTULUCZIHCIZIV-UHFFFAOYSA-N -1 1 321.829 4.327 20 0 DIADMM CCC[C@H](C)CCCSc1nc([O-])cc(=O)n1C1CCCC1 ZINC001472975737 1063336117 /nfs/dbraw/zinc/33/61/17/1063336117.db2.gz KAVZQLAAKYYFPA-ZDUSSCGKSA-N -1 1 324.490 4.373 20 0 DIADMM CCCCN(Cc1ccccc1F)C(=O)c1ccc(F)c([O-])c1 ZINC001546230915 1063438653 /nfs/dbraw/zinc/43/86/53/1063438653.db2.gz IWAGKSVEAJCXEP-UHFFFAOYSA-N -1 1 319.351 4.113 20 0 DIADMM [O-]c1c2ccsc2ccc1-c1nnc(CC2CCCC2)o1 ZINC001258618610 1063713457 /nfs/dbraw/zinc/71/34/57/1063713457.db2.gz XVBYMLKNKRBWHH-UHFFFAOYSA-N -1 1 300.383 4.390 20 0 DIADMM C[C@@H](CCC(=O)Nc1cc(F)cc(F)c1[O-])c1ccccc1 ZINC001299580094 1063887457 /nfs/dbraw/zinc/88/74/57/1063887457.db2.gz CELIBTYKIHVGNT-NSHDSACASA-N -1 1 305.324 4.193 20 0 DIADMM O=C(c1cc2ccccc2cc1[O-])N1CC[C@H](C2CCCC2)C1 ZINC001299651843 1063900263 /nfs/dbraw/zinc/90/02/63/1063900263.db2.gz YNVCURWARIRNAL-KRWDZBQOSA-N -1 1 309.409 4.198 20 0 DIADMM O=S(=O)(Cc1ccccc1Cl)[N-]c1cccc2occc21 ZINC001260696721 1063903379 /nfs/dbraw/zinc/90/33/79/1063903379.db2.gz JNZOTLQYTBIEJE-UHFFFAOYSA-N -1 1 321.785 4.028 20 0 DIADMM C=Cc1cccc([N-]S(=O)(=O)c2ccc3c(c2)CCCC3)c1 ZINC001260982726 1063907140 /nfs/dbraw/zinc/90/71/40/1063907140.db2.gz DKQIFGJBZJKEFE-UHFFFAOYSA-N -1 1 313.422 4.009 20 0 DIADMM Cc1cccc(S(=O)(=O)[N-]c2c(C)cccc2C2CC2)c1C ZINC001261000171 1063908763 /nfs/dbraw/zinc/90/87/63/1063908763.db2.gz SCBORYUREGMSIN-UHFFFAOYSA-N -1 1 315.438 4.290 20 0 DIADMM CC[C@@H](CC(=O)Nc1ccc(Br)c([O-])c1)C(C)C ZINC001261361411 1063920423 /nfs/dbraw/zinc/92/04/23/1063920423.db2.gz RALYVTGDQKXSOE-JTQLQIEISA-N -1 1 314.223 4.166 20 0 DIADMM Cc1cc([N-]S(=O)(=O)c2cccc3ccccc32)ccc1F ZINC000389763682 1064138519 /nfs/dbraw/zinc/13/85/19/1064138519.db2.gz UHZKTJGQXGEPHP-UHFFFAOYSA-N -1 1 315.369 4.088 20 0 DIADMM [O-]c1ccc(-c2nc(-c3cccc4ccccc43)no2)c(F)c1 ZINC000391613046 1064196137 /nfs/dbraw/zinc/19/61/37/1064196137.db2.gz OVTQPYBZTHSBKC-UHFFFAOYSA-N -1 1 306.296 4.402 20 0 DIADMM CC(C)(C)[C@H]1CCC[C@@]([N-]C(=O)C(F)F)(C(F)(F)F)CC1 ZINC001288625784 1064559296 /nfs/dbraw/zinc/55/92/96/1064559296.db2.gz RZACKGNRFBCKEG-ZANVPECISA-N -1 1 315.326 4.295 20 0 DIADMM CN(Cc1ccc(C(C)(C)C)cc1)C(=O)c1ccc(F)c([O-])c1 ZINC001289982606 1064674192 /nfs/dbraw/zinc/67/41/92/1064674192.db2.gz NIYWMTDNSVOPFK-UHFFFAOYSA-N -1 1 315.388 4.101 20 0 DIADMM O=C(Cc1ccc([O-])c(Cl)c1)N[C@@H]1CC[C@@H]2CCCC[C@@H]2C1 ZINC001290366517 1064691959 /nfs/dbraw/zinc/69/19/59/1064691959.db2.gz MWTRZMIDHKHNMQ-RRFJBIMHSA-N -1 1 321.848 4.063 20 0 DIADMM CC(C)c1ccc(C(=O)Nc2cccc(OC(F)F)c2)c([O-])c1 ZINC001290995401 1064720293 /nfs/dbraw/zinc/72/02/93/1064720293.db2.gz YPDRSLDYYFHVSY-UHFFFAOYSA-N -1 1 321.323 4.369 20 0 DIADMM Cc1cccc([C@@H](NC(=O)c2cccc([O-])c2F)C(C)(C)C)c1 ZINC001291928487 1064751791 /nfs/dbraw/zinc/75/17/91/1064751791.db2.gz LGGIWPDZFWBCFY-QGZVFWFLSA-N -1 1 315.388 4.357 20 0 DIADMM CCCCOc1ccc(NC(=O)c2cccc([O-])c2F)c(C)c1 ZINC001291959915 1064752572 /nfs/dbraw/zinc/75/25/72/1064752572.db2.gz KXLHTUOUIVCDRZ-UHFFFAOYSA-N -1 1 317.360 4.271 20 0 DIADMM CC(C)(NC(=O)c1ccc(C(F)(F)F)c([O-])c1)c1ccccc1 ZINC001292359188 1064771079 /nfs/dbraw/zinc/77/10/79/1064771079.db2.gz OYWJIIOOKHQZBC-UHFFFAOYSA-N -1 1 323.314 4.076 20 0 DIADMM CC(C)(NC(=O)c1cc2ccccc2cc1[O-])c1cccc(F)c1 ZINC001293422687 1064813731 /nfs/dbraw/zinc/81/37/31/1064813731.db2.gz QBPQWTIBHUETDD-UHFFFAOYSA-N -1 1 323.367 4.350 20 0 DIADMM CC[C@H]1c2ccccc2CCN1C(=O)c1c([O-])cccc1Cl ZINC001293503343 1064819083 /nfs/dbraw/zinc/81/90/83/1064819083.db2.gz BKYKUCGVJPVWOX-HNNXBMFYSA-N -1 1 315.800 4.195 20 0 DIADMM O=C(N[C@H](CC1CC1)c1ccccc1)c1cc(Cl)ccc1[O-] ZINC001293598899 1064822829 /nfs/dbraw/zinc/82/28/29/1064822829.db2.gz UADCTCVNXGJQEE-MRXNPFEDSA-N -1 1 315.800 4.317 20 0 DIADMM Cc1ccccc1[C@@H](NC(=O)c1ccc(F)c([O-])c1)C(C)(C)C ZINC001294439686 1064868969 /nfs/dbraw/zinc/86/89/69/1064868969.db2.gz ZICRUVFDSOTZIT-QGZVFWFLSA-N -1 1 315.388 4.357 20 0 DIADMM CCCC[C@@H](NC(=O)Cc1ccc([O-])c(Cl)c1)C1CCC1 ZINC001295062167 1064897015 /nfs/dbraw/zinc/89/70/15/1064897015.db2.gz YYCBQYRKVYMHLV-OAHLLOKOSA-N -1 1 309.837 4.063 20 0 DIADMM Cc1cc(Cl)cc(C)c1NC(=O)Cc1ccc([O-])c(Cl)c1 ZINC001295940213 1064931964 /nfs/dbraw/zinc/93/19/64/1064931964.db2.gz RLWDSUOPPZCXLA-UHFFFAOYSA-N -1 1 324.207 4.497 20 0 DIADMM C[C@@H](NC(=O)c1cc(Cl)ccc1[O-])c1ccc2c(c1)CCC2 ZINC001295907463 1064932006 /nfs/dbraw/zinc/93/20/06/1064932006.db2.gz JEZWUNVUCYNKMU-LLVKDONJSA-N -1 1 315.800 4.025 20 0 DIADMM CCCC[C@@](C)(F)C(=O)Nc1ccc(Br)c([O-])c1 ZINC001296434489 1064945335 /nfs/dbraw/zinc/94/53/35/1064945335.db2.gz QUVVKEDGUINDBL-CYBMUJFWSA-N -1 1 318.186 4.012 20 0 DIADMM Cc1ccc2c(c1)scc2C(=O)Nc1ccc([O-])c(F)c1F ZINC001297819957 1064991960 /nfs/dbraw/zinc/99/19/60/1064991960.db2.gz DGYUMPMYMACRBC-UHFFFAOYSA-N -1 1 319.332 4.446 20 0 DIADMM O=C(Nc1cc([O-])c(F)cc1F)c1cc2c(s1)CCCCC2 ZINC001298973103 1065026895 /nfs/dbraw/zinc/02/68/95/1065026895.db2.gz WPNKWGUFGYLULU-UHFFFAOYSA-N -1 1 323.364 4.253 20 0 DIADMM O=C(Nc1cc([O-])c(F)cc1F)[C@@H]1CCC[C@H]1c1ccccc1 ZINC001298972532 1065027909 /nfs/dbraw/zinc/02/79/09/1065027909.db2.gz GLCREZSKOFQKPS-QWHCGFSZSA-N -1 1 317.335 4.193 20 0 DIADMM O=C(Nc1cccc(F)c1[O-])c1sc2ncccc2c1Cl ZINC001302485735 1065089850 /nfs/dbraw/zinc/08/98/50/1065089850.db2.gz KUULYRAMMWGMPX-UHFFFAOYSA-N -1 1 322.748 4.047 20 0 DIADMM C/C(=C\c1ccccc1Cl)C(=O)Nc1cccc(F)c1[O-] ZINC001302487781 1065090136 /nfs/dbraw/zinc/09/01/36/1065090136.db2.gz YEXNBHIPIQOAQD-MDZDMXLPSA-N -1 1 305.736 4.227 20 0 DIADMM C/C(=C\c1ccc(Cl)cc1)C(=O)Nc1cccc(F)c1[O-] ZINC001302486628 1065090340 /nfs/dbraw/zinc/09/03/40/1065090340.db2.gz RJZYSSYIZVVQCI-MDZDMXLPSA-N -1 1 305.736 4.227 20 0 DIADMM CCC(F)(F)c1ccccc1NC(=O)c1cc(F)ccc1[O-] ZINC001302704489 1065095862 /nfs/dbraw/zinc/09/58/62/1065095862.db2.gz YVTYTTPKPVBBTQ-UHFFFAOYSA-N -1 1 309.287 4.285 20 0 DIADMM C[C@@H](CN(C)C(=O)c1ccc(C(F)(F)F)cc1[O-])C(C)(C)C ZINC001303376130 1065115329 /nfs/dbraw/zinc/11/53/29/1065115329.db2.gz XWRYNHAJLMXPOF-JTQLQIEISA-N -1 1 317.351 4.165 20 0 DIADMM O=C(Cc1ccccc1Cl)Nc1cc(F)c([O-])cc1Cl ZINC001304284334 1065136418 /nfs/dbraw/zinc/13/64/18/1065136418.db2.gz LBTVFYIECJTKKP-UHFFFAOYSA-N -1 1 314.143 4.019 20 0 DIADMM CCc1ccc2c(c1)CCN2C(=O)c1ccc2ccccc2c1[O-] ZINC001305109234 1065151843 /nfs/dbraw/zinc/15/18/43/1065151843.db2.gz SSFQUGDIXHGFFI-UHFFFAOYSA-N -1 1 317.388 4.311 20 0 DIADMM O=C(NC[C@H]1C[C@@H]1C1CCCC1)c1cc2ccccc2cc1[O-] ZINC001305873030 1065166767 /nfs/dbraw/zinc/16/67/67/1065166767.db2.gz FNCDJLNYAWKIMQ-IAGOWNOFSA-N -1 1 309.409 4.102 20 0 DIADMM CCCc1cc(=O)[n-]c(SC[C@H]2CCCCC2(F)F)n1 ZINC001307253835 1065314916 /nfs/dbraw/zinc/31/49/16/1065314916.db2.gz RANZFMGHSUMEMR-SNVBAGLBSA-N -1 1 302.390 4.052 20 0 DIADMM Cc1nc(SCc2cc(Cl)ccc2Cl)[n-]c(=O)c1C ZINC001307323157 1065340482 /nfs/dbraw/zinc/34/04/82/1065340482.db2.gz PJSAUDKMNMHRFZ-UHFFFAOYSA-N -1 1 315.225 4.398 20 0 DIADMM C[C@@H]1C[C@H](c2cccc(F)c2)N(Cc2ccc([O-])c(F)c2F)C1 ZINC001308574427 1066087465 /nfs/dbraw/zinc/08/74/65/1066087465.db2.gz VSZLETLKCNGSAN-IAQYHMDHSA-N -1 1 321.342 4.393 20 0 DIADMM [O-]c1ccc(CNCc2c(Cl)oc3ccccc32)c(F)c1F ZINC001308862704 1066342090 /nfs/dbraw/zinc/34/20/90/1066342090.db2.gz DCHOSZNNQMGHTP-UHFFFAOYSA-N -1 1 323.726 4.360 20 0 DIADMM C[C@H](NC(=O)NCc1ccc([O-])c(Cl)c1)[C@H]1CCC[C@@H](C)C1 ZINC001312872103 1066875542 /nfs/dbraw/zinc/87/55/42/1066875542.db2.gz FIEVYYVMBZMBJT-DYEKYZERSA-N -1 1 324.852 4.060 20 0 DIADMM O=C(Cc1c(Cl)cccc1Cl)Nc1c([O-])cccc1F ZINC000078807037 185113073 /nfs/dbraw/zinc/11/30/73/185113073.db2.gz GLRQACOXPPZFHS-UHFFFAOYSA-N -1 1 314.143 4.019 20 0 DIADMM C[C@H](Sc1nc(C2CC2)cc(=O)[n-]1)c1ncc(C(C)(C)C)o1 ZINC000188140069 200200512 /nfs/dbraw/zinc/20/05/12/200200512.db2.gz FRTGFRRYWWNWFI-VIFPVBQESA-N -1 1 319.430 4.198 20 0 DIADMM Cc1ccsc1[C@H]1C[C@@H]1c1nc(-c2ccc([O-])c(F)c2)no1 ZINC000445481229 331524460 /nfs/dbraw/zinc/52/44/60/331524460.db2.gz LYQJFQWFBIZDOF-QWRGUYRKSA-N -1 1 316.357 4.222 20 0 DIADMM O=C(Nc1ccc([O-])c(Cl)c1)Nc1ccc(Cl)cc1F ZINC000190917194 332008972 /nfs/dbraw/zinc/00/89/72/332008972.db2.gz FWPDPWSFBDFKFB-UHFFFAOYSA-N -1 1 315.131 4.482 20 0 DIADMM CCCOc1cccc(-c2nc(-c3ccc([O-])c(F)c3)no2)c1 ZINC000445483502 332091632 /nfs/dbraw/zinc/09/16/32/332091632.db2.gz WLJBQRLSTAUGQX-UHFFFAOYSA-N -1 1 314.316 4.037 20 0 DIADMM CCc1ccc(-c2ccc(CN[C@@H](C(=O)[O-])[C@H](C)CC)o2)cc1 ZINC000426775915 332093677 /nfs/dbraw/zinc/09/36/77/332093677.db2.gz VODFBRBQCDDAHU-FZKQIMNGSA-N -1 1 315.413 4.098 20 0 DIADMM C[C@H](c1cccc(O)c1)N(C)C(=O)c1cc2ccccc2cc1[O-] ZINC000092602215 332135971 /nfs/dbraw/zinc/13/59/71/332135971.db2.gz BLDCDMWUULQQRB-CYBMUJFWSA-N -1 1 321.376 4.084 20 0 DIADMM C[C@H](c1cccc(O)c1)N(C)C(=O)c1ccc2ccccc2c1[O-] ZINC000092602230 332136084 /nfs/dbraw/zinc/13/60/84/332136084.db2.gz MCQZHVRUTUHWFY-CYBMUJFWSA-N -1 1 321.376 4.084 20 0 DIADMM Cc1cc(Br)c([O-])c(NC(=O)C[C@@H]2C=CCCC2)c1 ZINC000428026776 332640805 /nfs/dbraw/zinc/64/08/05/332640805.db2.gz FTXGNBSTDSNZIC-LLVKDONJSA-N -1 1 324.218 4.148 20 0 DIADMM CC(C)c1scnc1NC(=O)c1ccc2ccccc2c1[O-] ZINC000572637620 332714596 /nfs/dbraw/zinc/71/45/96/332714596.db2.gz OLNNFWSUDCSKNK-UHFFFAOYSA-N -1 1 312.394 4.378 20 0 DIADMM CC(C)Sc1ccccc1NC(=O)c1ccc([O-])cc1F ZINC000182038607 333036582 /nfs/dbraw/zinc/03/65/82/333036582.db2.gz UAJNBVNWZYLPOM-UHFFFAOYSA-N -1 1 305.374 4.284 20 0 DIADMM Cc1ccc([N-]S(=O)(=O)c2cccc(C(C)C)c2)cc1F ZINC000460432299 333085908 /nfs/dbraw/zinc/08/59/08/333085908.db2.gz YZGPLZMUXWSWMO-UHFFFAOYSA-N -1 1 307.390 4.058 20 0 DIADMM Cc1ccc(C)c([N-]S(=O)(=O)c2cccc(C(C)C)c2)c1 ZINC000460440792 333088232 /nfs/dbraw/zinc/08/82/32/333088232.db2.gz ZCBRZEDMVKINLX-UHFFFAOYSA-N -1 1 303.427 4.228 20 0 DIADMM C[C@@H](Sc1nc(C(F)F)cc(=O)[n-]1)c1ccc(F)cc1 ZINC000582090856 333209568 /nfs/dbraw/zinc/20/95/68/333209568.db2.gz QQCWZCBYTARKBY-SSDOTTSWSA-N -1 1 300.305 4.112 20 0 DIADMM O=C(c1cc2ccccc2cc1[O-])N1CCC[C@H]2CCCC[C@@H]21 ZINC000319660469 333394117 /nfs/dbraw/zinc/39/41/17/333394117.db2.gz GPKQXQBUJLFYDR-KDOFPFPSSA-N -1 1 309.409 4.340 20 0 DIADMM CCc1nc(SC[C@H]2CCC3(CCCCC3)O2)[n-]c(=O)c1C ZINC000563439129 333605859 /nfs/dbraw/zinc/60/58/59/333605859.db2.gz FRGQUHBMHRFXRW-CYBMUJFWSA-N -1 1 322.474 4.027 20 0 DIADMM Cc1cccc(OCCC(=O)Nc2ccc([O-])c(Cl)c2)c1C ZINC000571234211 333687251 /nfs/dbraw/zinc/68/72/51/333687251.db2.gz LETXSDCKHZMJKV-UHFFFAOYSA-N -1 1 319.788 4.070 20 0 DIADMM COc1cc(-c2nc([C@@H]3CCC[C@@H](C)C3)no2)cc(Cl)c1[O-] ZINC000443224742 338448084 /nfs/dbraw/zinc/44/80/84/338448084.db2.gz PDPYQMKBKBKVQX-NXEZZACHSA-N -1 1 322.792 4.398 20 0 DIADMM CC(C)CC1(C)CCN(Cc2nc(=O)c3sccc3[n-]2)CC1 ZINC000343987710 335205808 /nfs/dbraw/zinc/20/58/08/335205808.db2.gz AXJRPLLRCZDWLR-UHFFFAOYSA-N -1 1 319.474 4.045 20 0 DIADMM Cc1ccc(/C=C\Cc2nc(-c3ccc([O-])c(F)c3)no2)cc1 ZINC000445475409 338495966 /nfs/dbraw/zinc/49/59/66/338495966.db2.gz UIYFOXAAAQMXHH-IHWYPQMZSA-N -1 1 310.328 4.146 20 0 DIADMM [O-]c1ccc(-c2noc(/C=C\c3c(F)cccc3F)n2)cc1F ZINC000445479603 338496379 /nfs/dbraw/zinc/49/63/79/338496379.db2.gz GJRSRLFIKAXVAB-ALCCZGGFSA-N -1 1 318.254 4.030 20 0 DIADMM Cc1cnc(-c2nc(=O)c3c4c(sc3[n-]2)CCCCC4)s1 ZINC000333223364 336200046 /nfs/dbraw/zinc/20/00/46/336200046.db2.gz XABKCLAOZQFCGO-UHFFFAOYSA-N -1 1 317.439 4.098 20 0 DIADMM CSc1ccc(Cl)cc1[N-]C(=O)c1ccc(C(C)=O)o1 ZINC000446020388 338517994 /nfs/dbraw/zinc/51/79/94/338517994.db2.gz LKVSYFSAKOEWJL-UHFFFAOYSA-N -1 1 309.774 4.110 20 0 DIADMM Cc1csc([C@@H](C)[N-]c2nc(-c3cccc(Cl)c3)no2)n1 ZINC000301196227 336294461 /nfs/dbraw/zinc/29/44/61/336294461.db2.gz OANHQFZHXJMZHC-SECBINFHSA-N -1 1 320.805 4.328 20 0 DIADMM C[C@@H](C1CC1)n1cc([N-]c2nc(-c3ccccc3)ns2)cn1 ZINC000302487765 336359743 /nfs/dbraw/zinc/35/97/43/336359743.db2.gz YUOLUVKKPQRLSS-NSHDSACASA-N -1 1 311.414 4.116 20 0 DIADMM CCC[C@H](C)N(C)Cc1csc(-c2ccc(C(=O)[O-])cc2)n1 ZINC000582246691 336393359 /nfs/dbraw/zinc/39/33/59/336393359.db2.gz MRWKOSZHTPJWKE-LBPRGKRZSA-N -1 1 318.442 4.129 20 0 DIADMM CC[C@H](NCc1ccc(-c2ccc(C(C)(C)C)cc2)o1)C(=O)[O-] ZINC000362346908 336793335 /nfs/dbraw/zinc/79/33/35/336793335.db2.gz PJFMYQMNKDFFFZ-INIZCTEOSA-N -1 1 315.413 4.197 20 0 DIADMM CCc1cccc(-c2nc(-c3ccc([O-])cc3Cl)no2)c1O ZINC000583182948 337258941 /nfs/dbraw/zinc/25/89/41/337258941.db2.gz IASPXKSRSMRCAI-UHFFFAOYSA-N -1 1 316.744 4.031 20 0 DIADMM Cc1ccc(-c2nnco2)cc1NCc1cccc([O-])c1Cl ZINC000393324695 337574789 /nfs/dbraw/zinc/57/47/89/337574789.db2.gz RRRWYXKYYJJEQN-UHFFFAOYSA-N -1 1 315.760 4.016 20 0 DIADMM CCOc1cc(-c2noc([C@H]3CC3(C)C)n2)cc(Cl)c1[O-] ZINC000445414333 337682681 /nfs/dbraw/zinc/68/26/81/337682681.db2.gz ZQXDLPZRCVVRON-SECBINFHSA-N -1 1 308.765 4.008 20 0 DIADMM Cc1ccc(CCC(=O)Nc2ccc([O-])c(Cl)c2)c(C)c1 ZINC000533081371 337811308 /nfs/dbraw/zinc/81/13/08/337811308.db2.gz NHJSOIGTYQPDJB-UHFFFAOYSA-N -1 1 303.789 4.234 20 0 DIADMM C[C@H](c1ccsc1)c1nc(-c2ccc([O-])cc2Cl)no1 ZINC000445443160 337835807 /nfs/dbraw/zinc/83/58/07/337835807.db2.gz BGRHSWHHCLTFER-MRVPVSSYSA-N -1 1 306.774 4.309 20 0 DIADMM CCc1ccc(-c2nc(-c3ccc([O-])cc3Cl)no2)c(C)n1 ZINC000445443650 337837704 /nfs/dbraw/zinc/83/77/04/337837704.db2.gz CWDQNTRCMQFZHX-UHFFFAOYSA-N -1 1 315.760 4.028 20 0 DIADMM [O-]c1ccc(-c2noc(-c3nccc4ccccc43)n2)c(Cl)c1 ZINC000445446151 337844119 /nfs/dbraw/zinc/84/41/19/337844119.db2.gz CQGRMXIMMFQYHK-UHFFFAOYSA-N -1 1 323.739 4.311 20 0 DIADMM [O-]c1ccc(-c2noc(CCc3ccc(F)cc3)n2)c(Cl)c1 ZINC000445446821 337845374 /nfs/dbraw/zinc/84/53/74/337845374.db2.gz NAQNFPBQYDCBCU-UHFFFAOYSA-N -1 1 318.735 4.020 20 0 DIADMM [O-]c1ccc(-c2noc(-c3ccc(F)cc3F)n2)c(Cl)c1 ZINC000445447063 337845579 /nfs/dbraw/zinc/84/55/79/337845579.db2.gz QWKJKEDHEZUZOS-UHFFFAOYSA-N -1 1 308.671 4.041 20 0 DIADMM O=C(c1cc(Cl)ccc1[O-])N1CCC2(CCCCC2)CC1 ZINC000061559089 337945098 /nfs/dbraw/zinc/94/50/98/337945098.db2.gz BVXOTVSRLQPZEN-UHFFFAOYSA-N -1 1 307.821 4.232 20 0 DIADMM CCc1nc(SCc2cccc(C(F)F)c2)[n-]c(=O)c1C ZINC000515312908 337984795 /nfs/dbraw/zinc/98/47/95/337984795.db2.gz UPRXCZHQKGOEQE-UHFFFAOYSA-N -1 1 310.369 4.283 20 0 DIADMM Cc1cccc(C)c1[N-]S(=O)(=O)c1cccc2ccccc21 ZINC000084460575 338002456 /nfs/dbraw/zinc/00/24/56/338002456.db2.gz RJJDZTSCTVMXOZ-UHFFFAOYSA-N -1 1 311.406 4.257 20 0 DIADMM CC(C)(C)[C@@H](NC(=O)Nc1ccc([O-])c(Cl)c1)C(F)(F)F ZINC000516526020 338014688 /nfs/dbraw/zinc/01/46/88/338014688.db2.gz XHHQVUILBVGERP-SNVBAGLBSA-N -1 1 324.730 4.144 20 0 DIADMM CC(C)C[C@H](C)OCCc1nc(-c2ccc([O-])cc2Cl)no1 ZINC000445451785 338016561 /nfs/dbraw/zinc/01/65/61/338016561.db2.gz KIWRBYOPTDCZSD-NSHDSACASA-N -1 1 324.808 4.089 20 0 DIADMM [O-]c1ccc(-c2noc(-c3cccc4cc[nH]c43)n2)c(Cl)c1 ZINC000445454530 338017252 /nfs/dbraw/zinc/01/72/52/338017252.db2.gz LLLMFLLKMYXVPB-UHFFFAOYSA-N -1 1 311.728 4.244 20 0 DIADMM C[C@@H](OC1CCCCCC1)c1nc(-c2ccc([O-])cc2F)no1 ZINC000445454620 338017273 /nfs/dbraw/zinc/01/72/73/338017273.db2.gz GWFFXTUPGZEWHX-LLVKDONJSA-N -1 1 320.364 4.382 20 0 DIADMM Cc1cc(Cl)ccc1-c1nc(-c2ccc([O-])cc2F)no1 ZINC000445455523 338017285 /nfs/dbraw/zinc/01/72/85/338017285.db2.gz KZBXJVVMRIIPES-UHFFFAOYSA-N -1 1 304.708 4.210 20 0 DIADMM Cc1cc(-c2nc(-c3ccc([O-])cc3F)no2)nc2ccccc12 ZINC000445456499 338017507 /nfs/dbraw/zinc/01/75/07/338017507.db2.gz OMZFTMRRGQMMKR-UHFFFAOYSA-N -1 1 321.311 4.105 20 0 DIADMM CC(C)(c1nc(-c2ccc([O-])cc2F)no1)c1cccc(F)c1 ZINC000445457945 338017880 /nfs/dbraw/zinc/01/78/80/338017880.db2.gz VFDVYFOKDAJCSB-UHFFFAOYSA-N -1 1 316.307 4.046 20 0 DIADMM Cc1ccc(Cl)cc1-c1nc(-c2ccc([O-])cc2F)no1 ZINC000445460948 338021097 /nfs/dbraw/zinc/02/10/97/338021097.db2.gz UXFMHJXCZNJHKM-UHFFFAOYSA-N -1 1 304.708 4.210 20 0 DIADMM Cc1ccc([C@@H](NCc2cc3ccccc3s2)C(=O)[O-])cc1 ZINC000426702144 338038634 /nfs/dbraw/zinc/03/86/34/338038634.db2.gz DYJNZQSIMBEMNA-QGZVFWFLSA-N -1 1 311.406 4.125 20 0 DIADMM Cc1ccc([C@H](NCc2cccc(Cl)c2Cl)C(=O)[O-])cc1 ZINC000426705401 338038638 /nfs/dbraw/zinc/03/86/38/338038638.db2.gz PBPQCNUICJGZEB-HNNXBMFYSA-N -1 1 324.207 4.217 20 0 DIADMM Cc1ccccc1CN[C@H](C(=O)[O-])c1c(Cl)cccc1Cl ZINC000426756088 338040864 /nfs/dbraw/zinc/04/08/64/338040864.db2.gz HWKHVWBYQFWICD-HNNXBMFYSA-N -1 1 324.207 4.217 20 0 DIADMM C[C@@H](C(=O)[O-])[C@@H](NCc1cccc(Cl)c1F)c1ccccc1 ZINC000426754906 338040930 /nfs/dbraw/zinc/04/09/30/338040930.db2.gz VAXVLVYISPCPNY-BDJLRTHQSA-N -1 1 321.779 4.031 20 0 DIADMM C=Cc1ccc(S(=O)(=O)[N-]c2cccc(C(F)F)c2)cc1 ZINC000436475079 338273489 /nfs/dbraw/zinc/27/34/89/338273489.db2.gz FJMBRQJHQVKTMV-UHFFFAOYSA-N -1 1 309.337 4.068 20 0 DIADMM C=Cc1ccc(S(=O)(=O)[N-]c2c(C)cccc2CC)cc1 ZINC000436477564 338273536 /nfs/dbraw/zinc/27/35/36/338273536.db2.gz IIMRCOMOFAUTKK-UHFFFAOYSA-N -1 1 301.411 4.001 20 0 DIADMM CCN(C(=O)c1ccc2ccccc2c1[O-])c1ccccc1OC ZINC000436531384 338275516 /nfs/dbraw/zinc/27/55/16/338275516.db2.gz HQDRZIYPMUBIFV-UHFFFAOYSA-N -1 1 321.376 4.221 20 0 DIADMM C[C@H](c1ccccc1)N(C(=O)c1ccc(Cl)cc1[O-])C1CC1 ZINC000436537506 338276011 /nfs/dbraw/zinc/27/60/11/338276011.db2.gz XRSUNIFOGGSOAU-GFCCVEGCSA-N -1 1 315.800 4.411 20 0 DIADMM C[C@@H]1C[C@H](c2ccccc2)CN1C(=O)c1ccc(Cl)cc1[O-] ZINC000436547580 338276434 /nfs/dbraw/zinc/27/64/34/338276434.db2.gz NUKFZXRHXJBVAZ-OCCSQVGLSA-N -1 1 315.800 4.064 20 0 DIADMM C[C@@H]1C[C@@H]2CCCC[C@H]2N1C(=O)c1ccc2ccccc2c1[O-] ZINC000436551300 338276692 /nfs/dbraw/zinc/27/66/92/338276692.db2.gz MWSYOKNRRTUXBL-QIIPPGSGSA-N -1 1 309.409 4.339 20 0 DIADMM Cc1ccc([C@H]2CCCN2C(=O)c2ccc(Cl)cc2[O-])s1 ZINC000436549569 338276731 /nfs/dbraw/zinc/27/67/31/338276731.db2.gz XONAUVMDGFIQPR-CYBMUJFWSA-N -1 1 321.829 4.393 20 0 DIADMM O=C(c1cc(F)ccc1[O-])N1CCC[C@@H]1c1cccc(Cl)c1 ZINC000436565267 338277192 /nfs/dbraw/zinc/27/71/92/338277192.db2.gz UTHQIJJZMARHJR-OAHLLOKOSA-N -1 1 319.763 4.162 20 0 DIADMM O=C(c1cc(F)ccc1[O-])N1CCC[C@@H]1c1ccccc1Cl ZINC000436565219 338277340 /nfs/dbraw/zinc/27/73/40/338277340.db2.gz UDUHZRLJRYSATH-OAHLLOKOSA-N -1 1 319.763 4.162 20 0 DIADMM O=C(c1cc(F)ccc1[O-])N1CC2(CCCC2)c2ccccc21 ZINC000436584098 338278467 /nfs/dbraw/zinc/27/84/67/338278467.db2.gz IUFNJGFXRGSHBS-UHFFFAOYSA-N -1 1 311.356 4.004 20 0 DIADMM Cc1ccc(NC(=O)c2cc3ccccc3cc2[O-])c(C)c1O ZINC000436588822 338278748 /nfs/dbraw/zinc/27/87/48/338278748.db2.gz OBZSZEXQEYFWAE-UHFFFAOYSA-N -1 1 307.349 4.120 20 0 DIADMM CC[C@H]1CCCC[C@@H]1c1noc(-c2ccc(OC)cc2[O-])n1 ZINC000436592878 338278978 /nfs/dbraw/zinc/27/89/78/338278978.db2.gz AITWWHMXQFBXBB-AAEUAGOBSA-N -1 1 302.374 4.135 20 0 DIADMM O=C(c1ccccc1[O-])N1CCc2cc(-c3ccccc3)ccc21 ZINC000436594942 338279060 /nfs/dbraw/zinc/27/90/60/338279060.db2.gz KNTGNZGNPPPEIT-UHFFFAOYSA-N -1 1 315.372 4.262 20 0 DIADMM CCc1ccnc(-c2noc(-c3ccc4ccccc4c3[O-])n2)c1 ZINC000436596194 338279148 /nfs/dbraw/zinc/27/91/48/338279148.db2.gz LJVZPBDWZSOZMU-UHFFFAOYSA-N -1 1 317.348 4.220 20 0 DIADMM O=C(Nc1cccc(Nc2ccccc2)c1)c1ccc(O)cc1[O-] ZINC000436672055 338282358 /nfs/dbraw/zinc/28/23/58/338282358.db2.gz XWAYGVJXRPWGPQ-UHFFFAOYSA-N -1 1 320.348 4.094 20 0 DIADMM [O-]c1ccc(-c2nc(Cc3cccc4ccccc43)no2)c(F)c1 ZINC000436691456 338283018 /nfs/dbraw/zinc/28/30/18/338283018.db2.gz SPRBTPWCBZNMAO-UHFFFAOYSA-N -1 1 320.323 4.325 20 0 DIADMM O=C(c1ccc(Cl)cc1[O-])N1CCC[C@]2(CC=CCC2)C1 ZINC000436717532 338283932 /nfs/dbraw/zinc/28/39/32/338283932.db2.gz HAKPEFUVCHZOLA-QGZVFWFLSA-N -1 1 305.805 4.008 20 0 DIADMM CC(C)Oc1c(Cl)cccc1NC(=O)c1ccccc1[O-] ZINC000436720635 338283945 /nfs/dbraw/zinc/28/39/45/338283945.db2.gz UJLNNQSWYVJKBH-UHFFFAOYSA-N -1 1 305.761 4.085 20 0 DIADMM Cc1ccc(CN(C(=O)c2ccc(Cl)cc2[O-])C(C)C)s1 ZINC000436726003 338284330 /nfs/dbraw/zinc/28/43/30/338284330.db2.gz UISLESKPBUERER-UHFFFAOYSA-N -1 1 323.845 4.466 20 0 DIADMM CC(C)CCn1ncc(NC(=O)c2ccccc2[O-])c1C(C)C ZINC000436738498 338284865 /nfs/dbraw/zinc/28/48/65/338284865.db2.gz LVNQZDGJNFHKLX-UHFFFAOYSA-N -1 1 315.417 4.011 20 0 DIADMM CCCC[C@@H](CC)CNC(=O)c1cc(Cl)c([O-])c(OC)c1 ZINC000436751644 338285349 /nfs/dbraw/zinc/28/53/49/338285349.db2.gz UFEYRXJIRNDDFF-LLVKDONJSA-N -1 1 313.825 4.000 20 0 DIADMM CCN(C(=O)c1ccc2ccccc2c1[O-])c1ccc(OC)cc1 ZINC000436755333 338285788 /nfs/dbraw/zinc/28/57/88/338285788.db2.gz KXGZOIBCMSXFCN-UHFFFAOYSA-N -1 1 321.376 4.221 20 0 DIADMM CCN(C(=O)c1cc2ccccc2cc1[O-])c1cccc(OC)c1 ZINC000436762674 338286252 /nfs/dbraw/zinc/28/62/52/338286252.db2.gz SUPJRVNKXHCZME-UHFFFAOYSA-N -1 1 321.376 4.221 20 0 DIADMM CC(C)C[C@H]1CCCN1C(=O)c1ccc(C(F)(F)F)cc1[O-] ZINC000436767624 338286557 /nfs/dbraw/zinc/28/65/57/338286557.db2.gz GQHOHIAIUKFGFC-GFCCVEGCSA-N -1 1 315.335 4.062 20 0 DIADMM CC(F)(F)c1ccc(-c2nc(-c3ccc([O-])c(F)c3)no2)cc1 ZINC000436783544 338287082 /nfs/dbraw/zinc/28/70/82/338287082.db2.gz MPYAFHJLNFYVSM-UHFFFAOYSA-N -1 1 320.270 4.360 20 0 DIADMM CCN(C(=O)c1ccc(Cl)cc1[O-])[C@H](C)Cc1ccsc1 ZINC000436783113 338287147 /nfs/dbraw/zinc/28/71/47/338287147.db2.gz QNHMMHIJODAOJR-LLVKDONJSA-N -1 1 323.845 4.200 20 0 DIADMM CCN(C(=O)c1ccc(Cl)cc1[O-])[C@@H](C)Cc1ccsc1 ZINC000436783114 338287231 /nfs/dbraw/zinc/28/72/31/338287231.db2.gz QNHMMHIJODAOJR-NSHDSACASA-N -1 1 323.845 4.200 20 0 DIADMM Cc1nc2ccc(NC(=O)c3ccc(C(C)C)cc3[O-])cc2o1 ZINC000436848142 338289770 /nfs/dbraw/zinc/28/97/70/338289770.db2.gz TZFKUTWFYPFKPY-UHFFFAOYSA-N -1 1 310.353 4.218 20 0 DIADMM CC[C@H]1CCCC[C@H]1OCc1nc(-c2ccc([O-])c(F)c2)no1 ZINC000436870859 338290728 /nfs/dbraw/zinc/29/07/28/338290728.db2.gz GKNFQUPXLBQMHO-XHDPSFHLSA-N -1 1 320.364 4.067 20 0 DIADMM C[C@@H](Cc1ccccc1)c1nc(-c2ccc([O-])cc2Cl)no1 ZINC000436871428 338290746 /nfs/dbraw/zinc/29/07/46/338290746.db2.gz SPEFXUNCPVJDEO-NSHDSACASA-N -1 1 314.772 4.442 20 0 DIADMM Cc1csc(-c2nc(-c3ccc([O-])c(F)c3)no2)c1Cl ZINC000436869916 338290809 /nfs/dbraw/zinc/29/08/09/338290809.db2.gz CIFMIXHKDHHUKY-UHFFFAOYSA-N -1 1 310.737 4.272 20 0 DIADMM O=C(c1ccc([O-])cc1F)N1CCC[C@@H]1c1ccccc1Cl ZINC000436871432 338290855 /nfs/dbraw/zinc/29/08/55/338290855.db2.gz SRABYGLRSZOBGM-MRXNPFEDSA-N -1 1 319.763 4.162 20 0 DIADMM CC[C@@H]1CCCC[C@@H]1OCc1nc(-c2ccc([O-])cc2F)no1 ZINC000436871795 338290937 /nfs/dbraw/zinc/29/09/37/338290937.db2.gz IJBXVBIBLLBNRQ-ABAIWWIYSA-N -1 1 320.364 4.067 20 0 DIADMM C[C@@H]1[C@@H](c2ccccc2)[C@H]1c1nc(-c2ccc([O-])c(F)c2)no1 ZINC000436875236 338291074 /nfs/dbraw/zinc/29/10/74/338291074.db2.gz UBGRKOZHWIGLBP-VFVAKGGASA-N -1 1 310.328 4.098 20 0 DIADMM [O-]c1ccc(-c2noc(/C=C\c3ccc(F)c(F)c3)n2)c(F)c1 ZINC000436876519 338291359 /nfs/dbraw/zinc/29/13/59/338291359.db2.gz ZWRDIEWFSMAPSJ-KXFIGUGUSA-N -1 1 318.254 4.030 20 0 DIADMM O=C(N[C@@H]1CCSc2ccccc21)c1ccc(Cl)cc1[O-] ZINC000436879732 338291423 /nfs/dbraw/zinc/29/14/23/338291423.db2.gz HPSJUBNWASQLBU-CYBMUJFWSA-N -1 1 319.813 4.013 20 0 DIADMM [O-]c1ccc(/C=C\c2ncc(Br)s2)cc1Cl ZINC000436921374 338293074 /nfs/dbraw/zinc/29/30/74/338293074.db2.gz JPYDHUXWOOEYDX-RQOWECAXSA-N -1 1 316.607 4.435 20 0 DIADMM [O-]c1ccc(/C=C/c2ncc(Br)s2)cc1Cl ZINC000436921373 338293488 /nfs/dbraw/zinc/29/34/88/338293488.db2.gz JPYDHUXWOOEYDX-DUXPYHPUSA-N -1 1 316.607 4.435 20 0 DIADMM C[C@H](c1noc(-c2cc(F)ccc2[O-])n1)c1c(F)cccc1F ZINC000436932713 338294164 /nfs/dbraw/zinc/29/41/64/338294164.db2.gz QVTBJOYOBJECJI-QMMMGPOBSA-N -1 1 320.270 4.011 20 0 DIADMM CCOc1cc(-c2nc(-c3ccoc3C)no2)cc(Cl)c1[O-] ZINC000436955046 338295792 /nfs/dbraw/zinc/29/57/92/338295792.db2.gz CQKSMNKIDBOEIN-UHFFFAOYSA-N -1 1 320.732 4.063 20 0 DIADMM Cc1ccc(S(=O)(=O)[N-]c2c(C)c(C)ccc2Cl)s1 ZINC000446958813 338541866 /nfs/dbraw/zinc/54/18/66/338541866.db2.gz GWSIXMATJQTYEA-UHFFFAOYSA-N -1 1 315.847 4.128 20 0 DIADMM COc1cc(C)ccc1NC(=O)c1cc2ccccc2cc1[O-] ZINC000195705304 338914362 /nfs/dbraw/zinc/91/43/62/338914362.db2.gz HNNOVXCFGZLFCF-UHFFFAOYSA-N -1 1 307.349 4.115 20 0 DIADMM Cc1cc(Br)c([O-])c(NC(=O)[C@@H](C)CC(C)C)c1 ZINC000462761660 339087372 /nfs/dbraw/zinc/08/73/72/339087372.db2.gz AVCORQGKBVECQT-JTQLQIEISA-N -1 1 314.223 4.084 20 0 DIADMM CCCc1cc(=O)[n-]c(S[C@H](C)c2ncc(C(C)(C)C)o2)n1 ZINC000476504082 339477765 /nfs/dbraw/zinc/47/77/65/339477765.db2.gz KCMGBGIMTVKLPV-SNVBAGLBSA-N -1 1 321.446 4.274 20 0 DIADMM Cc1ccc(C[C@@H](C)C(=O)Nc2ccc([O-])c(Cl)c2)cc1 ZINC000486776835 339733826 /nfs/dbraw/zinc/73/38/26/339733826.db2.gz UWWBIWJNHJHJQC-GFCCVEGCSA-N -1 1 303.789 4.171 20 0 DIADMM COCC[N@H+](Cc1cccc(O)c1Cl)[C@H](C)c1ccccc1 ZINC000507392863 340218502 /nfs/dbraw/zinc/21/85/02/340218502.db2.gz QXCFNNYIYAMUEC-CQSZACIVSA-N -1 1 319.832 4.255 20 0 DIADMM C[C@H]1CO[C@@H](c2ccccc2)CN1Cc1cccc([O-])c1Cl ZINC000508171145 340240105 /nfs/dbraw/zinc/24/01/05/340240105.db2.gz CZSVIZISECDXDT-SUMWQHHRSA-N -1 1 317.816 4.008 20 0 DIADMM CSc1cccc(S(=O)(=O)[N-]c2c(C)cc(C)cc2C)c1 ZINC000509101208 340261242 /nfs/dbraw/zinc/26/12/42/340261242.db2.gz YBYLBIYKQFUQOQ-UHFFFAOYSA-N -1 1 321.467 4.135 20 0 DIADMM O=C(Nc1ccc([O-])c(Cl)c1)c1c[nH]cc1-c1ccccc1 ZINC000509159515 340262719 /nfs/dbraw/zinc/26/27/19/340262719.db2.gz XSGOYXQQYBCZAL-UHFFFAOYSA-N -1 1 312.756 4.293 20 0 DIADMM O=C(C/C=C\c1cccc(F)c1)Nc1ccc([O-])c(Cl)c1 ZINC000509176396 340263162 /nfs/dbraw/zinc/26/31/62/340263162.db2.gz AHGUAFPTYNYMPV-RQOWECAXSA-N -1 1 305.736 4.227 20 0 DIADMM Cc1c(C(=O)Nc2ccc([O-])c(Cl)c2)cnc2ccccc12 ZINC000509183413 340263254 /nfs/dbraw/zinc/26/32/54/340263254.db2.gz KFMWCKXTCRNUDT-UHFFFAOYSA-N -1 1 312.756 4.155 20 0 DIADMM CC(C)c1cccc(S(=O)(=O)[N-]c2ccc3[nH]ccc3c2)c1 ZINC000172883975 340346062 /nfs/dbraw/zinc/34/60/62/340346062.db2.gz UPMSYRUWXVTPDC-UHFFFAOYSA-N -1 1 314.410 4.092 20 0 DIADMM O=C(Nc1ccc(OC2CCCC2)c(F)c1)c1ccccc1[O-] ZINC000303945296 340355496 /nfs/dbraw/zinc/35/54/96/340355496.db2.gz GTNVVEUMLIWDOB-UHFFFAOYSA-N -1 1 315.344 4.105 20 0 DIADMM O=C(Nc1ccc([O-])c(Cl)c1)c1cccn1C1CCCC1 ZINC000182873327 340485806 /nfs/dbraw/zinc/48/58/06/340485806.db2.gz DSVIAVMHPLQMEC-UHFFFAOYSA-N -1 1 304.777 4.215 20 0 DIADMM CN(C(=O)c1cc2ccccc2cc1[O-])[C@@H]1CCc2ccccc21 ZINC000218879815 340499470 /nfs/dbraw/zinc/49/94/70/340499470.db2.gz OXVPYRPRPGVQNI-LJQANCHMSA-N -1 1 317.388 4.305 20 0 DIADMM O=C(Nc1nc2c(s1)CCCC2)Nc1ccc([O-])c(Cl)c1 ZINC000192169292 340563761 /nfs/dbraw/zinc/56/37/61/340563761.db2.gz UBXLWJVZFCTDJI-UHFFFAOYSA-N -1 1 323.805 4.025 20 0 DIADMM C[C@@]1(C(=O)Nc2cc(Cl)c([O-])c3ccccc23)CC1(F)F ZINC000529538692 340761076 /nfs/dbraw/zinc/76/10/76/340761076.db2.gz JTMYUXISWXLVTN-AWEZNQCLSA-N -1 1 311.715 4.183 20 0 DIADMM CN(C(=O)c1ccc(Cl)cc1[O-])[C@H]1CCCc2ccccc21 ZINC000539848724 340905612 /nfs/dbraw/zinc/90/56/12/340905612.db2.gz ZRMJJWZWRDPXAJ-INIZCTEOSA-N -1 1 315.800 4.195 20 0 DIADMM CC(C)(C(=O)Nc1ccc([O-])c(Cl)c1)c1ccccc1F ZINC000129616905 340976500 /nfs/dbraw/zinc/97/65/00/340976500.db2.gz KFIDPQWSBBBDNS-UHFFFAOYSA-N -1 1 307.752 4.101 20 0 DIADMM [O-]c1ccc(-c2noc(C3(C(F)F)CCCC3)n2)c(Cl)c1 ZINC000564368669 341311336 /nfs/dbraw/zinc/31/13/36/341311336.db2.gz KASHJGKVSJUQHD-UHFFFAOYSA-N -1 1 314.719 4.173 20 0 DIADMM CCCCc1nc(CSc2nc(CC)c(C)c(=O)[n-]2)cs1 ZINC000565241845 341521072 /nfs/dbraw/zinc/52/10/72/341521072.db2.gz JGAOZKJQHYUPNZ-UHFFFAOYSA-N -1 1 323.487 4.144 20 0 DIADMM CCSCc1cccc(NC(=O)c2c(F)ccc([O-])c2F)c1 ZINC000573960523 341744321 /nfs/dbraw/zinc/74/43/21/341744321.db2.gz AOEWLFWCCKGVHM-UHFFFAOYSA-N -1 1 323.364 4.176 20 0 DIADMM O=S(=O)([N-]c1cc(C(F)F)ccc1Cl)c1cccs1 ZINC000580597855 341884172 /nfs/dbraw/zinc/88/41/72/341884172.db2.gz KHCWLDGXUYOEMH-UHFFFAOYSA-N -1 1 323.773 4.140 20 0 DIADMM CCC(CC)n1nc(C)cc1C(=O)Nc1ccc([O-])c(Cl)c1 ZINC000182878267 521645611 /nfs/dbraw/zinc/64/56/11/521645611.db2.gz ICXANOMNIXZSNS-UHFFFAOYSA-N -1 1 321.808 4.164 20 0 DIADMM O=C([O-])c1cccc(CNCc2c(Cl)oc3ccccc32)c1 ZINC000683176950 1035668968 /nfs/dbraw/zinc/66/89/68/1035668968.db2.gz YZMXVFQBQRWIPQ-UHFFFAOYSA-N -1 1 315.756 4.074 20 0 DIADMM COc1cccc(C(F)(F)F)c1Nc1ccc(F)c(F)c1[O-] ZINC001213344671 1035712312 /nfs/dbraw/zinc/71/23/12/1035712312.db2.gz ATJBKDSEZVGNIM-UHFFFAOYSA-N -1 1 319.229 4.441 20 0 DIADMM CC(C)(C)[C@@H]1CN(C(=O)c2ccc([O-])c(F)c2)c2ccccc21 ZINC000683517664 1036435536 /nfs/dbraw/zinc/43/55/36/1036435536.db2.gz OQDHLECXMILGMJ-CQSZACIVSA-N -1 1 313.372 4.321 20 0 DIADMM CCOc1cc(-c2noc([C@@H]3CC34CCC4)n2)cc(Cl)c1[O-] ZINC000683589295 1036525195 /nfs/dbraw/zinc/52/51/95/1036525195.db2.gz KGHPWGXTRLVXIG-JTQLQIEISA-N -1 1 320.776 4.152 20 0 DIADMM [O-]c1ccc(-c2noc(-c3cc4occc4s3)n2)cc1F ZINC000683593015 1036532542 /nfs/dbraw/zinc/53/25/42/1036532542.db2.gz GCOLJWAHSHKAQT-UHFFFAOYSA-N -1 1 302.286 4.056 20 0 DIADMM O=C(Nc1cccc(F)c1[O-])c1cc2cccc(Cl)c2o1 ZINC001648850328 1036632721 /nfs/dbraw/zinc/63/27/21/1036632721.db2.gz GXYGFYRPOSTWRW-UHFFFAOYSA-N -1 1 305.692 4.183 20 0 DIADMM CC(C)(C)n1cc(Nc2cc(Cl)c([O-])c(Cl)c2)cn1 ZINC001210924524 1037053884 /nfs/dbraw/zinc/05/38/84/1037053884.db2.gz MEVZCFNGBQHHKP-UHFFFAOYSA-N -1 1 300.189 4.394 20 0 DIADMM Cc1cc2occ(CC(=O)Nc3c([O-])cccc3F)c2cc1C ZINC000089541260 1037086593 /nfs/dbraw/zinc/08/65/93/1037086593.db2.gz VAMKIBFVRHSHEJ-UHFFFAOYSA-N -1 1 313.328 4.076 20 0 DIADMM Cc1c(C(=O)Nc2c([O-])cccc2F)sc2cccc(F)c12 ZINC000089541500 1037088159 /nfs/dbraw/zinc/08/81/59/1037088159.db2.gz AILYAJQZXCQLOJ-UHFFFAOYSA-N -1 1 319.332 4.446 20 0 DIADMM [O-]c1cc(F)c(-c2ccc(OC(F)(F)F)c(F)c2)cc1F ZINC001211338276 1037302373 /nfs/dbraw/zinc/30/23/73/1037302373.db2.gz BYXWQPXZZOXZRU-UHFFFAOYSA-N -1 1 308.177 4.375 20 0 DIADMM COc1ccc(-c2cc(F)c([O-])cc2F)cc1C(F)(F)F ZINC001211339092 1037304632 /nfs/dbraw/zinc/30/46/32/1037304632.db2.gz LETKYNVSUIRMON-UHFFFAOYSA-N -1 1 304.214 4.365 20 0 DIADMM CCOC(=O)[C@H](CC)c1ccc(-c2cc(F)c([O-])cc2F)cc1 ZINC001211353571 1037311046 /nfs/dbraw/zinc/31/10/46/1037311046.db2.gz XVVKDSOTOVOGKX-CYBMUJFWSA-N -1 1 320.335 4.394 20 0 DIADMM CCc1cccc2cc(CN[C@@H](CC3CCCC3)C(=O)[O-])oc21 ZINC000656572341 1037658871 /nfs/dbraw/zinc/65/88/71/1037658871.db2.gz HSUJDORNSYCQFS-KRWDZBQOSA-N -1 1 315.413 4.118 20 0 DIADMM O=C(Nc1ccc(F)c(F)c1F)c1cc2ccccc2cc1[O-] ZINC000390732107 1037848856 /nfs/dbraw/zinc/84/88/56/1037848856.db2.gz NZSUFAJUHJPYNR-UHFFFAOYSA-N -1 1 317.266 4.215 20 0 DIADMM C[C@@H](c1ccc(Cl)cc1Cl)N1CCC(CC(=O)[O-])CC1 ZINC000093682459 1037931154 /nfs/dbraw/zinc/93/11/54/1037931154.db2.gz UWODBNRBVURDOE-JTQLQIEISA-N -1 1 316.228 4.241 20 0 DIADMM Cc1ccc(-c2cccnc2)cc1NC(=O)c1ccc([O-])c(F)c1 ZINC000684507468 1038193754 /nfs/dbraw/zinc/19/37/54/1038193754.db2.gz FPIUEDYGBHTBDB-UHFFFAOYSA-N -1 1 322.339 4.154 20 0 DIADMM C[C@@H](CSCc1ccccc1)C(=O)Nc1c([O-])cccc1F ZINC000610967278 1038409552 /nfs/dbraw/zinc/40/95/52/1038409552.db2.gz MIAYBMSZXNNKAI-LBPRGKRZSA-N -1 1 319.401 4.039 20 0 DIADMM O=C(Nc1c([O-])cccc1F)c1cc2cc(F)ccc2s1 ZINC000605439224 1038515716 /nfs/dbraw/zinc/51/57/16/1038515716.db2.gz VLCYFZIKZZYGKW-UHFFFAOYSA-N -1 1 305.305 4.137 20 0 DIADMM CC(C)c1cccc(O[C@H](C)C(=O)Nc2c([O-])cccc2F)c1 ZINC000605434725 1038515813 /nfs/dbraw/zinc/51/58/13/1038515813.db2.gz FMDBSOGNZFSXDM-GFCCVEGCSA-N -1 1 317.360 4.061 20 0 DIADMM CCCc1ccc(S(=O)(=O)[N-]c2cc(Cl)ccc2C)cc1 ZINC000014257074 1038538657 /nfs/dbraw/zinc/53/86/57/1038538657.db2.gz VJEIVFRBQVEAEA-UHFFFAOYSA-N -1 1 323.845 4.402 20 0 DIADMM Cc1ccc(F)c(NC(=O)c2ccc(C(F)(F)F)c([O-])c2)c1 ZINC000684870906 1038668097 /nfs/dbraw/zinc/66/80/97/1038668097.db2.gz PTAFUSCUWRNQPN-UHFFFAOYSA-N -1 1 313.250 4.111 20 0 DIADMM C/C(=C/c1ccc(Cl)cc1)C(=O)Nc1ccc([O-])c(F)c1F ZINC001627447915 1038678556 /nfs/dbraw/zinc/67/85/56/1038678556.db2.gz FAJUPWMGKLFRBY-HJWRWDBZSA-N -1 1 323.726 4.366 20 0 DIADMM CCc1ccc([C@@H](C)CC(=O)Nc2c([O-])cccc2F)cc1 ZINC000608365260 1038830360 /nfs/dbraw/zinc/83/03/60/1038830360.db2.gz DHDITXUMYSZBAG-LBPRGKRZSA-N -1 1 301.361 4.226 20 0 DIADMM Cc1oc([C@@H](C)[N@@H+](C)Cc2ccc(Cl)cc2)cc1C(=O)[O-] ZINC000517382509 1039067175 /nfs/dbraw/zinc/06/71/75/1039067175.db2.gz XXACYVQMYAVBSH-SNVBAGLBSA-N -1 1 307.777 4.133 20 0 DIADMM Cc1oc([C@@H](C)N(C)Cc2ccc(Cl)cc2)cc1C(=O)[O-] ZINC000517382509 1039067192 /nfs/dbraw/zinc/06/71/92/1039067192.db2.gz XXACYVQMYAVBSH-SNVBAGLBSA-N -1 1 307.777 4.133 20 0 DIADMM CC(C)C[C@@H](C(=O)Nc1ccc([O-])c(F)c1F)c1ccccc1 ZINC000456787015 1039078121 /nfs/dbraw/zinc/07/81/21/1039078121.db2.gz PLSSHCGZMUHEKO-CYBMUJFWSA-N -1 1 319.351 4.439 20 0 DIADMM CC(C)[C@H](Cc1ccccc1)C(=O)Nc1ccc([O-])c(F)c1F ZINC000456788195 1039078237 /nfs/dbraw/zinc/07/82/37/1039078237.db2.gz REQRYPWTGZFROC-ZDUSSCGKSA-N -1 1 319.351 4.124 20 0 DIADMM COCOc1ccccc1Nc1ccc(Cl)c(Cl)c1[O-] ZINC001211566429 1039140829 /nfs/dbraw/zinc/14/08/29/1039140829.db2.gz HRQAOJPSQOCPQF-UHFFFAOYSA-N -1 1 314.168 4.425 20 0 DIADMM Cc1cc(-c2nnco2)ccc1NCc1cccc([O-])c1Cl ZINC000393243528 1039247972 /nfs/dbraw/zinc/24/79/72/1039247972.db2.gz MVFRXZSKSOHKNX-UHFFFAOYSA-N -1 1 315.760 4.016 20 0 DIADMM CC(C)(C)c1ccc([C@@H]2CCCN2C(=O)c2cncc([O-])c2)cc1 ZINC000348797320 1039765924 /nfs/dbraw/zinc/76/59/24/1039765924.db2.gz CPBOCXSKYPVNDJ-SFHVURJKSA-N -1 1 324.424 4.062 20 0 DIADMM O=C([O-])CC[C@H]1CCCCN1Cc1cccc(Cl)c1Cl ZINC000086755028 1040039538 /nfs/dbraw/zinc/03/95/38/1040039538.db2.gz XHVFDPXAGSTBLN-GFCCVEGCSA-N -1 1 316.228 4.213 20 0 DIADMM Cc1cc(C(=O)Nc2ccc([O-])c(Cl)c2)c2ccccc2n1 ZINC000171881287 1040101714 /nfs/dbraw/zinc/10/17/14/1040101714.db2.gz NMEVIGMBWLQCBX-UHFFFAOYSA-N -1 1 312.756 4.155 20 0 DIADMM C[C@@H](c1ccc(Cl)c(Cl)c1)N1CC[C@@H](C)[C@@H](C(=O)[O-])C1 ZINC000647367787 1040256043 /nfs/dbraw/zinc/25/60/43/1040256043.db2.gz OADCVEXITSTLAR-SCVCMEIPSA-N -1 1 316.228 4.097 20 0 DIADMM COc1cc(O)ccc1Nc1c(Cl)ccc([O-])c1Cl ZINC001213097736 1040419207 /nfs/dbraw/zinc/41/92/07/1040419207.db2.gz WQEKXDVSEONQOS-UHFFFAOYSA-N -1 1 300.141 4.157 20 0 DIADMM O=C(c1cc2ccccc2cc1[O-])N1CC2(CC2)c2ccccc21 ZINC000172431867 1040860981 /nfs/dbraw/zinc/86/09/81/1040860981.db2.gz BUMRTYMMTKWJEN-UHFFFAOYSA-N -1 1 315.372 4.237 20 0 DIADMM COCOc1ccc(Nc2ccc(Cl)c(Cl)c2[O-])cc1 ZINC001211643861 1041285764 /nfs/dbraw/zinc/28/57/64/1041285764.db2.gz KQSKJLOSPIXKRA-UHFFFAOYSA-N -1 1 314.168 4.425 20 0 DIADMM O=C(Nc1ccc(Cl)c(Cl)c1)c1ccc([O-])cc1F ZINC000181826723 1041367239 /nfs/dbraw/zinc/36/72/39/1041367239.db2.gz UTDFQZRHCBZFJR-UHFFFAOYSA-N -1 1 300.116 4.090 20 0 DIADMM CC(C)c1ccc(C(=O)Nc2ccc(-c3cc(=O)[nH][n-]3)cc2)cc1 ZINC000613664406 1041413538 /nfs/dbraw/zinc/41/35/38/1041413538.db2.gz NENYCHGCEDEKTL-UHFFFAOYSA-N -1 1 321.380 4.158 20 0 DIADMM C/C(=C/C(=O)Nc1cc([O-])c(F)cc1F)c1ccccc1Cl ZINC001625894092 1041501492 /nfs/dbraw/zinc/50/14/92/1041501492.db2.gz RNNQBNVOAZPAAE-TWGQIWQCSA-N -1 1 323.726 4.366 20 0 DIADMM CC(C)(C)OC(=O)c1cccc(-c2cc(Cl)ccc2[O-])n1 ZINC001245047821 1041716484 /nfs/dbraw/zinc/71/64/84/1041716484.db2.gz AVTOYTKCXRGGRK-UHFFFAOYSA-N -1 1 305.761 4.063 20 0 DIADMM Cc1ccc(C)c(OCCC(=O)Nc2ccc([O-])c(Cl)c2)c1 ZINC000109014007 1041938686 /nfs/dbraw/zinc/93/86/86/1041938686.db2.gz WWISFVRTMJBHNY-UHFFFAOYSA-N -1 1 319.788 4.070 20 0 DIADMM CC1(C)CCCN([C@@H](C(=O)[O-])c2ccc(Cl)cc2Cl)C1 ZINC000652397395 1042036669 /nfs/dbraw/zinc/03/66/69/1042036669.db2.gz RTBMVMKPIGNSGU-CYBMUJFWSA-N -1 1 316.228 4.241 20 0 DIADMM [O-]c1cccc(CN2CCC[C@H](O)c3cc(F)ccc32)c1Cl ZINC000816589993 1042065864 /nfs/dbraw/zinc/06/58/64/1042065864.db2.gz OPBYZFIVRQSYFV-HNNXBMFYSA-N -1 1 321.779 4.019 20 0 DIADMM O=C(c1c([O-])cccc1Cl)N1CCC[C@@H](c2ccccc2)C1 ZINC000817107018 1042094150 /nfs/dbraw/zinc/09/41/50/1042094150.db2.gz OUZQFFVDVQEAQC-CQSZACIVSA-N -1 1 315.800 4.065 20 0 DIADMM O=C(N[C@@H]1CC[C@H]2CCCC[C@@H]2C1)c1cc(Cl)ccc1[O-] ZINC001136019226 1042125462 /nfs/dbraw/zinc/12/54/62/1042125462.db2.gz MWLHZOLOWLMNQV-YRGRVCCFSA-N -1 1 307.821 4.134 20 0 DIADMM COc1ncc(-c2c(F)ccc([O-])c2Cl)cc1C(F)F ZINC001245833905 1042142779 /nfs/dbraw/zinc/14/27/79/1042142779.db2.gz FBMMYPMOVLABDE-UHFFFAOYSA-N -1 1 303.667 4.193 20 0 DIADMM Cc1ccc([C@H](C)N(C)C(=O)c2ncc3ccccc3c2[O-])cc1 ZINC001136186247 1042169661 /nfs/dbraw/zinc/16/96/61/1042169661.db2.gz GSGNEALBOYVFET-AWEZNQCLSA-N -1 1 320.392 4.082 20 0 DIADMM CCc1cccc(C)c1NC(=O)Cc1ccc([O-])c(Cl)c1 ZINC001136344545 1042219133 /nfs/dbraw/zinc/21/91/33/1042219133.db2.gz KLXRHMYCJGBJPK-UHFFFAOYSA-N -1 1 303.789 4.098 20 0 DIADMM COc1cnc(C=Cc2cc(-c3ccccc3)cs2)[n-]c1=O ZINC000821013409 1042240607 /nfs/dbraw/zinc/24/06/07/1042240607.db2.gz ZYMMSVWGRGDLDS-BQYQJAHWSA-N -1 1 310.378 4.090 20 0 DIADMM CC(C)[C@H]1CC[C@@H](C)C[C@H]1CNC(=O)c1cc(Cl)ccc1[O-] ZINC001136487107 1042263801 /nfs/dbraw/zinc/26/38/01/1042263801.db2.gz AQEYEJSHVILWJH-VNHYZAJKSA-N -1 1 323.864 4.484 20 0 DIADMM CC[C@@H](NC(=O)Cc1ccc([O-])c(Cl)c1)c1ccc(C)cc1 ZINC001136536116 1042273829 /nfs/dbraw/zinc/27/38/29/1042273829.db2.gz RNJIWKORMXCKPS-MRXNPFEDSA-N -1 1 317.816 4.164 20 0 DIADMM O=C(N[C@H](c1ccccc1)C1CCC1)c1c([O-])cccc1Cl ZINC001136690309 1042318013 /nfs/dbraw/zinc/31/80/13/1042318013.db2.gz HWWOEUSIGWFZFG-QGZVFWFLSA-N -1 1 315.800 4.317 20 0 DIADMM [O-]c1ccc(-c2noc([C@H]3CC[C@@H](C(F)(F)F)C3)n2)cc1F ZINC000436871250 1042338174 /nfs/dbraw/zinc/33/81/74/1042338174.db2.gz GUICCSPJALVOCB-DTWKUNHWSA-N -1 1 316.254 4.027 20 0 DIADMM O=C(Nc1ccc([O-])c(Cl)c1)C1CCC(C(F)(F)F)CC1 ZINC000216398610 1042353015 /nfs/dbraw/zinc/35/30/15/1042353015.db2.gz QFLSAUFJKUAGSJ-UHFFFAOYSA-N -1 1 321.726 4.353 20 0 DIADMM [O-]c1cccc(CNc2ccc(SCCCO)cc2)c1Cl ZINC000645166835 1042454360 /nfs/dbraw/zinc/45/43/60/1042454360.db2.gz MKZBYPZMLRYNOA-UHFFFAOYSA-N -1 1 323.845 4.132 20 0 DIADMM CCc1cccc(C)c1[N-]S(=O)(=O)c1cc(Cl)ccc1C ZINC000031665510 1042721240 /nfs/dbraw/zinc/72/12/40/1042721240.db2.gz RJLLCTCRABVQGK-UHFFFAOYSA-N -1 1 323.845 4.320 20 0 DIADMM CC(C)COC[C@@H](NCc1cccc([O-])c1Cl)c1ccco1 ZINC000293679945 1042903775 /nfs/dbraw/zinc/90/37/75/1042903775.db2.gz VMXXUBRMNJUVTL-CQSZACIVSA-N -1 1 323.820 4.142 20 0 DIADMM O=c1cc(C(F)(F)F)nc(SC/C=C\c2ccccc2)[n-]1 ZINC000518868161 1042923106 /nfs/dbraw/zinc/92/31/06/1042923106.db2.gz SBMCBRKGJURNFX-DAXSKMNVSA-N -1 1 312.316 4.007 20 0 DIADMM Cc1cc([C@H](C)NC(=O)Cc2ccc([O-])c(Cl)c2)c(C)s1 ZINC001141555383 1042923316 /nfs/dbraw/zinc/92/33/16/1042923316.db2.gz GNBITDXPQDTCBS-JTQLQIEISA-N -1 1 323.845 4.144 20 0 DIADMM Cc1oc(CN(C)[C@H]2CCc3ccc(Cl)cc32)cc1C(=O)[O-] ZINC000518990577 1042928324 /nfs/dbraw/zinc/92/83/24/1042928324.db2.gz KWNKZIWUTUSWOO-INIZCTEOSA-N -1 1 319.788 4.059 20 0 DIADMM CCc1ccc(-c2ccc(CN[C@H](C(=O)[O-])C(C)(C)C)o2)cc1 ZINC000426771100 1042979792 /nfs/dbraw/zinc/97/97/92/1042979792.db2.gz YULDYYGALJVQIF-QGZVFWFLSA-N -1 1 315.413 4.098 20 0 DIADMM Cc1ccc([C@@H](CC(=O)[O-])NCc2ccc(C(C)(C)C)cc2)o1 ZINC000426770401 1042979894 /nfs/dbraw/zinc/97/98/94/1042979894.db2.gz RNJHXMOPKRBDGD-MRXNPFEDSA-N -1 1 315.413 4.191 20 0 DIADMM CC[C@H](C)c1cc(C(=O)[N-]c2cc(Cl)cc(F)c2F)on1 ZINC000441565374 1043217808 /nfs/dbraw/zinc/21/78/08/1043217808.db2.gz LJQZHAUCAAGHNT-ZETCQYMHSA-N -1 1 314.719 4.372 20 0 DIADMM O=C1[N-]C(=S)SC1=Cc1ccc(OC(F)F)c(Cl)c1 ZINC000067427848 1043240973 /nfs/dbraw/zinc/24/09/73/1043240973.db2.gz BDJTXVPNPJGXJE-YWEYNIOJSA-N -1 1 321.757 4.271 20 0 DIADMM O=C1[N-]C(=S)SC1=Cc1csc(-c2ccc(F)cc2)n1 ZINC000017699949 1043319936 /nfs/dbraw/zinc/31/99/36/1043319936.db2.gz ZEQSNISPSPXJDT-YHYXMXQVSA-N -1 1 322.411 4.278 20 0 DIADMM O=S(=O)([N-]c1ccc2ccoc2c1)c1ccc2ccccc2c1 ZINC000442853598 1043443992 /nfs/dbraw/zinc/44/39/92/1043443992.db2.gz UWTOUFXRBCNGGR-UHFFFAOYSA-N -1 1 323.373 4.387 20 0 DIADMM O=c1cc(C(F)F)nc(SCc2ccc(Cl)cc2)[n-]1 ZINC000558462874 1043513769 /nfs/dbraw/zinc/51/37/69/1043513769.db2.gz PXAPVDDRQVGGRX-UHFFFAOYSA-N -1 1 302.733 4.066 20 0 DIADMM Cc1nc(SCc2ccccc2Cl)[n-]c(=O)c1C1CC1 ZINC000631023078 1043550073 /nfs/dbraw/zinc/55/00/73/1043550073.db2.gz GUZJIOZEZXYCMP-UHFFFAOYSA-N -1 1 306.818 4.314 20 0 DIADMM Cc1cccc2c1CCN(C(=O)c1ccc3ccccc3c1[O-])C2 ZINC000729538405 1043614604 /nfs/dbraw/zinc/61/46/04/1043614604.db2.gz SSHYEXJKQGQGQR-UHFFFAOYSA-N -1 1 317.388 4.052 20 0 DIADMM CC(C)(Cc1nc(-c2ccc([O-])cc2F)no1)CC(F)(F)F ZINC000896218588 1043864538 /nfs/dbraw/zinc/86/45/38/1043864538.db2.gz LLXHJPATOPVQPJ-UHFFFAOYSA-N -1 1 318.270 4.102 20 0 DIADMM O=C(Cc1ccc([O-])c(Cl)c1)N(CC1CC1)c1ccccc1 ZINC001137171207 1044142373 /nfs/dbraw/zinc/14/23/73/1044142373.db2.gz FCGLGDYMGWLHCH-UHFFFAOYSA-N -1 1 315.800 4.031 20 0 DIADMM C[C@H](c1ccc(Cl)c(Cl)c1)N1CCC[C@H](CC(=O)[O-])C1 ZINC000086757203 1044236149 /nfs/dbraw/zinc/23/61/49/1044236149.db2.gz NTAHZRFXDLNWHZ-GHMZBOCLSA-N -1 1 316.228 4.241 20 0 DIADMM C[C@@H](c1cc(Cl)ccc1Cl)N1CCC(C)(C(=O)[O-])CC1 ZINC000086776885 1044241486 /nfs/dbraw/zinc/24/14/86/1044241486.db2.gz RIKWFBKOTOHIQY-JTQLQIEISA-N -1 1 316.228 4.241 20 0 DIADMM CC[C@H](c1ccc(F)cc1)N(C)Cc1cc(C(=O)[O-])c(C)o1 ZINC000563282607 1044243890 /nfs/dbraw/zinc/24/38/90/1044243890.db2.gz RJLCDGGRXFAMHO-MRXNPFEDSA-N -1 1 305.349 4.008 20 0 DIADMM CCc1nc(SC[C@@H]2CCC3(CCCCC3)O2)[n-]c(=O)c1C ZINC000563439147 1044261891 /nfs/dbraw/zinc/26/18/91/1044261891.db2.gz FRGQUHBMHRFXRW-ZDUSSCGKSA-N -1 1 322.474 4.027 20 0 DIADMM C[C@H](C(=O)[N-]OC1CCCCC1)c1ccc(C(F)(F)F)cc1 ZINC000798997241 1044266582 /nfs/dbraw/zinc/26/65/82/1044266582.db2.gz VMOXIVCPCIRJEM-NSHDSACASA-N -1 1 315.335 4.189 20 0 DIADMM CC(C)[C@H](NC(=O)c1ccc(Cl)cc1[O-])c1ccc(F)cc1 ZINC001626143266 1044538230 /nfs/dbraw/zinc/53/82/30/1044538230.db2.gz CHSAJCIXSKDZHJ-INIZCTEOSA-N -1 1 321.779 4.312 20 0 DIADMM Cc1c(C(=O)Nc2cc(F)c([O-])cc2Cl)ccn1C(C)C ZINC000885678609 1044583952 /nfs/dbraw/zinc/58/39/52/1044583952.db2.gz SRJSBNIHLZVAGM-UHFFFAOYSA-N -1 1 310.756 4.128 20 0 DIADMM C[C@H](c1cc(Cl)ccc1Cl)N1CC[C@@H](C)[C@H](C(=O)[O-])C1 ZINC000567856532 1044588410 /nfs/dbraw/zinc/58/84/10/1044588410.db2.gz LYPYORBNWHQBLQ-GIPNMCIBSA-N -1 1 316.228 4.097 20 0 DIADMM O=C(NC1(c2ccc(F)cc2)CC1)c1cc2ccccc2cc1[O-] ZINC001137222520 1044596856 /nfs/dbraw/zinc/59/68/56/1044596856.db2.gz UHOLYWZBQBWSRL-UHFFFAOYSA-N -1 1 321.351 4.104 20 0 DIADMM CC[C@@H](Cc1ccccc1)c1nc(-c2ccc([O-])c(F)c2)no1 ZINC000568172020 1044609283 /nfs/dbraw/zinc/60/92/83/1044609283.db2.gz JEIQISMHPLXBDG-ZDUSSCGKSA-N -1 1 312.344 4.318 20 0 DIADMM CC(C)(C)SCCCC(=O)Nc1ccc([O-])c(Cl)c1 ZINC000155538853 1044702694 /nfs/dbraw/zinc/70/26/94/1044702694.db2.gz NNKQTUSWNJDLIJ-UHFFFAOYSA-N -1 1 301.839 4.296 20 0 DIADMM CCOc1cc(-c2noc(C3=C(C)CCC3)n2)cc(Cl)c1[O-] ZINC000445422725 1044714487 /nfs/dbraw/zinc/71/44/87/1044714487.db2.gz PXKOQKUKOYWFAT-UHFFFAOYSA-N -1 1 320.776 4.452 20 0 DIADMM CCOc1cc(-c2noc(-c3ccc(C)o3)n2)cc(Cl)c1[O-] ZINC000445430126 1044716488 /nfs/dbraw/zinc/71/64/88/1044716488.db2.gz FGQBWHVRRWAWFW-UHFFFAOYSA-N -1 1 320.732 4.063 20 0 DIADMM CCOc1cc(-c2noc([C@@H](C)C3CC3)n2)cc(Cl)c1[O-] ZINC000445430031 1044716926 /nfs/dbraw/zinc/71/69/26/1044716926.db2.gz HLFNSEHDIQTJFA-QMMMGPOBSA-N -1 1 308.765 4.008 20 0 DIADMM [O-]c1ccc(-c2noc(-c3cccc4cnccc43)n2)c(Cl)c1 ZINC000445449152 1044718632 /nfs/dbraw/zinc/71/86/32/1044718632.db2.gz NWXLAWJTTLYJHW-UHFFFAOYSA-N -1 1 323.739 4.311 20 0 DIADMM CCc1ccc(O)c(-c2nc(-c3ccc([O-])cc3Cl)no2)c1 ZINC000445448347 1044719970 /nfs/dbraw/zinc/71/99/70/1044719970.db2.gz KWUKLMSJQGIHKU-UHFFFAOYSA-N -1 1 316.744 4.031 20 0 DIADMM [O-]c1ccc(-c2noc(CSc3ccc(F)cc3)n2)cc1F ZINC000445469640 1044727004 /nfs/dbraw/zinc/72/70/04/1044727004.db2.gz BRIWTRPDRCZROA-UHFFFAOYSA-N -1 1 320.320 4.013 20 0 DIADMM Cc1ccc(O[C@@H](C)c2nc(-c3ccc([O-])c(F)c3)no2)cc1 ZINC000445479604 1044729251 /nfs/dbraw/zinc/72/92/51/1044729251.db2.gz WLFCEBJMPLYCCM-NSHDSACASA-N -1 1 314.316 4.030 20 0 DIADMM C/C(=C/c1ccc(C)cc1)c1nc(-c2ccc([O-])c(F)c2)no1 ZINC000445479624 1044731178 /nfs/dbraw/zinc/73/11/78/1044731178.db2.gz JXYXOLCEGCSBKF-XFXZXTDPSA-N -1 1 310.328 4.450 20 0 DIADMM [O-]c1ccc(-c2noc(C3(Cc4ccccc4)CCC3)n2)cc1F ZINC000445484970 1044731979 /nfs/dbraw/zinc/73/19/79/1044731979.db2.gz ZGLPJDWYCLIOHK-UHFFFAOYSA-N -1 1 324.355 4.246 20 0 DIADMM C[C@H](CCc1nc(-c2ccc([O-])c(F)c2)no1)c1ccccc1 ZINC000445484777 1044732262 /nfs/dbraw/zinc/73/22/62/1044732262.db2.gz UUJGGGQUPTXKIV-GFCCVEGCSA-N -1 1 312.344 4.318 20 0 DIADMM [O-]c1ccc(-c2noc(CCc3cc4ccccc4o3)n2)cc1F ZINC000445476709 1044735573 /nfs/dbraw/zinc/73/55/73/1044735573.db2.gz HIOMHIQBDAAZLW-UHFFFAOYSA-N -1 1 324.311 4.113 20 0 DIADMM C[C@@H]1CC[C@H](C(=O)[O-])[C@H](C)N1Cc1ccc(Cl)cc1Cl ZINC000576479577 1045058892 /nfs/dbraw/zinc/05/88/92/1045058892.db2.gz GSSSQVAOOSMYCI-NRUUGDAUSA-N -1 1 316.228 4.067 20 0 DIADMM Cc1ccsc1[C@H]1C[C@H]1C(=O)Nc1ccc([O-])c(Cl)c1 ZINC000153640789 1045059842 /nfs/dbraw/zinc/05/98/42/1045059842.db2.gz YAXZGUWEMBSTIS-WDEREUQCSA-N -1 1 307.802 4.158 20 0 DIADMM CC(C)c1ccc2nc(-c3ccc4cnn(C)c4c3)[n-]c(=O)c2c1 ZINC000446997614 1045080886 /nfs/dbraw/zinc/08/08/86/1045080886.db2.gz AEZSGTSUOILXIW-UHFFFAOYSA-N -1 1 318.380 4.013 20 0 DIADMM Cc1c(=O)[n-]c(SCCCCCF)nc1-c1ccccc1 ZINC000577488939 1045126579 /nfs/dbraw/zinc/12/65/79/1045126579.db2.gz BUNHMAPQIIUJAD-UHFFFAOYSA-N -1 1 306.406 4.390 20 0 DIADMM Cc1cc(Oc2ccccc2)ccc1NC(=O)c1cncc([O-])c1 ZINC000601007578 1045173554 /nfs/dbraw/zinc/17/35/54/1045173554.db2.gz WZXRZIQJYGDMLW-UHFFFAOYSA-N -1 1 320.348 4.140 20 0 DIADMM Cc1oc([C@@H](C)N(C)Cc2cc3ccccc3o2)cc1C(=O)[O-] ZINC000579484379 1045317611 /nfs/dbraw/zinc/31/76/11/1045317611.db2.gz MILOJVIEEFAILH-LLVKDONJSA-N -1 1 313.353 4.225 20 0 DIADMM O=C(CC[C@H]1CCCO1)Nc1cc(Cl)c([O-])c2ccccc12 ZINC000529540256 1045491401 /nfs/dbraw/zinc/49/14/01/1045491401.db2.gz WRRYLYKQIBBSSY-LLVKDONJSA-N -1 1 319.788 4.097 20 0 DIADMM CC[C@H](C)c1ccc(S(=O)(=O)[N-]c2cc(O)ccc2C)cc1 ZINC000530144680 1045604153 /nfs/dbraw/zinc/60/41/53/1045604153.db2.gz JVJPNZDBVPXAEV-LBPRGKRZSA-N -1 1 319.426 4.015 20 0 DIADMM CC(=O)Nc1cc(NCc2c([O-])ccc(Cl)c2F)ccc1C ZINC000190819285 1045614379 /nfs/dbraw/zinc/61/43/79/1045614379.db2.gz JUSUKECXPYZOHG-UHFFFAOYSA-N -1 1 322.767 4.064 20 0 DIADMM CC(C)c1csc2[n-]c(-c3coc(C4CC4)n3)nc(=O)c12 ZINC000630385316 1045755150 /nfs/dbraw/zinc/75/51/50/1045755150.db2.gz OSYJIHPOTWTRKV-UHFFFAOYSA-N -1 1 301.371 4.053 20 0 DIADMM Cc1cc(C)c(/C=C\CN[C@H](C(=O)[O-])c2cccs2)c(C)c1 ZINC000901597890 1045775609 /nfs/dbraw/zinc/77/56/09/1045775609.db2.gz JPYDNIATUYAFLN-AATOQMJSSA-N -1 1 315.438 4.102 20 0 DIADMM O=c1cc(-c2ccccc2)nc(SC[C@H]2CCC(F)(F)C2)[n-]1 ZINC000901615498 1045778256 /nfs/dbraw/zinc/77/82/56/1045778256.db2.gz FIYSDPMFIBAAIV-NSHDSACASA-N -1 1 322.380 4.377 20 0 DIADMM CC(C)(C)OCCCSc1nc(-c2ccccc2)cc(=O)[n-]1 ZINC000901618736 1045779805 /nfs/dbraw/zinc/77/98/05/1045779805.db2.gz JAMMVCJACLEJPM-UHFFFAOYSA-N -1 1 318.442 4.147 20 0 DIADMM Cc1ccc(CSc2nc(C)c(C3CC3)c(=O)[n-]2)cc1F ZINC000631023801 1045798191 /nfs/dbraw/zinc/79/81/91/1045798191.db2.gz XQIRKNBLMRFEMZ-UHFFFAOYSA-N -1 1 304.390 4.108 20 0 DIADMM O=C([O-])CN(Cc1ccc(-c2cccc(Cl)c2)s1)C1CC1 ZINC000901971677 1045878696 /nfs/dbraw/zinc/87/86/96/1045878696.db2.gz OSQMFQSBLDWCCQ-UHFFFAOYSA-N -1 1 321.829 4.118 20 0 DIADMM Cc1oc(CN[C@H](c2ccccc2)C(C)(C)C)cc1C(=O)[O-] ZINC000902123805 1045917727 /nfs/dbraw/zinc/91/77/27/1045917727.db2.gz ORHRTYGIFKDZGA-MRXNPFEDSA-N -1 1 301.386 4.163 20 0 DIADMM O=C(Nc1ccc([O-])c(Cl)c1)[C@H]1CC[C@H]1c1ccc(F)cc1 ZINC001137674422 1045930607 /nfs/dbraw/zinc/93/06/07/1045930607.db2.gz TXOQFGUUPPJRBV-KBPBESRZSA-N -1 1 319.763 4.317 20 0 DIADMM Cc1oc(CN[C@H](c2ccc(F)cc2)C2CCC2)cc1C(=O)[O-] ZINC000902224296 1045950966 /nfs/dbraw/zinc/95/09/66/1045950966.db2.gz HTQILRGYDFITMP-KRWDZBQOSA-N -1 1 317.360 4.056 20 0 DIADMM CC(C)[C@@H](NCc1ccoc1C(=O)[O-])c1ccccc1Cl ZINC000902267810 1045959154 /nfs/dbraw/zinc/95/91/54/1045959154.db2.gz DYILVIBTHLPIKQ-CQSZACIVSA-N -1 1 307.777 4.118 20 0 DIADMM CCc1oc(CN(C)C/C(C)=C/c2ccccc2)cc1C(=O)[O-] ZINC000902271085 1045961359 /nfs/dbraw/zinc/96/13/59/1045961359.db2.gz IUZOPTXPMSNIGS-GXDHUFHOSA-N -1 1 313.397 4.076 20 0 DIADMM CC(C)(C)c1ccc(CNCc2ccc(/C=C\C(=O)[O-])o2)s1 ZINC000902418468 1045994541 /nfs/dbraw/zinc/99/45/41/1045994541.db2.gz GLCOZTMNVKYLIB-TWGQIWQCSA-N -1 1 319.426 4.026 20 0 DIADMM CC(C)c1ccc(C(=O)Nc2cccc(-c3cn[nH]c3)c2)c([O-])c1 ZINC001138006125 1046052054 /nfs/dbraw/zinc/05/20/54/1046052054.db2.gz KYMOASFCIYLUBZ-UHFFFAOYSA-N -1 1 321.380 4.158 20 0 DIADMM Cc1ccc(-c2cncc(C(=O)Nc3ccc(F)cc3[O-])c2)cc1 ZINC000532266701 1046125740 /nfs/dbraw/zinc/12/57/40/1046125740.db2.gz UIOFOTQKGGIAQH-UHFFFAOYSA-N -1 1 322.339 4.154 20 0 DIADMM CSc1ccc(Cl)c(C(=O)Nc2ccc(F)cc2[O-])c1 ZINC000532267302 1046126780 /nfs/dbraw/zinc/12/67/80/1046126780.db2.gz VMMDZKBSTAXUDR-UHFFFAOYSA-N -1 1 311.765 4.159 20 0 DIADMM C[C@H](NC(=O)c1cccc([O-])c1F)c1cc2ccccc2s1 ZINC001138264617 1046131617 /nfs/dbraw/zinc/13/16/17/1046131617.db2.gz WRQOLLZCQMWSKR-JTQLQIEISA-N -1 1 315.369 4.237 20 0 DIADMM CC1(C)CCC[C@@H](CNC(=O)c2ccc3ccccc3c2[O-])C1 ZINC001142301172 1046152290 /nfs/dbraw/zinc/15/22/90/1046152290.db2.gz KUAMRXGWBXDVST-CQSZACIVSA-N -1 1 311.425 4.492 20 0 DIADMM CC(C)(C)c1ccc2c(c1)CCN2C(=O)c1ccc([O-])cc1F ZINC001138568141 1046227832 /nfs/dbraw/zinc/22/78/32/1046227832.db2.gz HFOLBVGYXCRKER-UHFFFAOYSA-N -1 1 313.372 4.032 20 0 DIADMM O=S(=O)([N-]c1ccc2ccccc2c1)c1cccc(Cl)c1 ZINC000007053602 1046274281 /nfs/dbraw/zinc/27/42/81/1046274281.db2.gz MRIFRQBMANPTQT-UHFFFAOYSA-N -1 1 317.797 4.294 20 0 DIADMM CCC[C@H]1CCCN(Cc2occ(C(F)(F)F)c2C(=O)[O-])C1 ZINC000903894082 1046338457 /nfs/dbraw/zinc/33/84/57/1046338457.db2.gz NYEIUDYSPBVOTI-JTQLQIEISA-N -1 1 319.323 4.009 20 0 DIADMM CCC[C@@H](C(=O)[N-]OCCC(F)(F)F)c1ccc(Cl)cc1 ZINC000832552840 1046347641 /nfs/dbraw/zinc/34/76/41/1046347641.db2.gz IEOHQJHGIKAQND-GFCCVEGCSA-N -1 1 323.742 4.224 20 0 DIADMM Cc1cc(C(=O)[N-]c2cc(Cl)ccc2SC(C)C)on1 ZINC000104483565 1046390621 /nfs/dbraw/zinc/39/06/21/1046390621.db2.gz RBQNSYUVXTUXDW-UHFFFAOYSA-N -1 1 310.806 4.389 20 0 DIADMM CCOc1ccc(NC(=O)Nc2ccc(Cl)cc2[O-])cc1 ZINC001202909419 1046417343 /nfs/dbraw/zinc/41/73/43/1046417343.db2.gz UDSPOSKESZKKAW-UHFFFAOYSA-N -1 1 306.749 4.088 20 0 DIADMM CC(C)c1ccc(NC(=O)Nc2cc(F)c([O-])cc2F)cc1 ZINC001202924230 1046431507 /nfs/dbraw/zinc/43/15/07/1046431507.db2.gz MEBZCAAMYCUDPC-UHFFFAOYSA-N -1 1 306.312 4.438 20 0 DIADMM C[C@H]1C[C@H](CCNC(=O)c2ccc(F)c([O-])c2)CC(C)(C)C1 ZINC001139605849 1046484424 /nfs/dbraw/zinc/48/44/24/1046484424.db2.gz SGLFLDLOMMDIIA-STQMWFEESA-N -1 1 307.409 4.114 20 0 DIADMM Cc1cc(C)c(NC(=O)Nc2ccc([O-])c(F)c2F)c(C)c1 ZINC001202958974 1046497544 /nfs/dbraw/zinc/49/75/44/1046497544.db2.gz WYFAJDJMXQFQSV-UHFFFAOYSA-N -1 1 306.312 4.240 20 0 DIADMM COc1nccc(Nc2cc(Cl)cc(Cl)c2[O-])c1Cl ZINC001211952765 1046544991 /nfs/dbraw/zinc/54/49/91/1046544991.db2.gz UTRHEQDAANRRIO-UHFFFAOYSA-N -1 1 319.575 4.500 20 0 DIADMM CCCN(Cc1ccccc1F)C(=O)c1ccc(Cl)cc1[O-] ZINC000642065791 1046555177 /nfs/dbraw/zinc/55/51/77/1046555177.db2.gz WRHOOOFPJXEFNS-UHFFFAOYSA-N -1 1 321.779 4.237 20 0 DIADMM CCC(CC)N(CC)C(=O)c1ccc(C(F)(F)F)c([O-])c1 ZINC000644536121 1046719344 /nfs/dbraw/zinc/71/93/44/1046719344.db2.gz JGTDGCVJMPTASF-UHFFFAOYSA-N -1 1 303.324 4.062 20 0 DIADMM O=C([O-])c1ccccc1CN1CCC[C@@H]1c1ccc(F)cc1F ZINC001140502967 1046756441 /nfs/dbraw/zinc/75/64/41/1046756441.db2.gz JFDZTEFUJXBWQB-QGZVFWFLSA-N -1 1 317.335 4.000 20 0 DIADMM Cc1ccnn1-c1ccccc1NCc1cccc([O-])c1Cl ZINC000645172036 1046773863 /nfs/dbraw/zinc/77/38/63/1046773863.db2.gz ZXOGYMPNHPXFNJ-UHFFFAOYSA-N -1 1 313.788 4.152 20 0 DIADMM O=C1CCCCc2c(Nc3ccc([O-])c(F)c3F)cccc21 ZINC001212013936 1046820772 /nfs/dbraw/zinc/82/07/72/1046820772.db2.gz QKZLPZHRTKGWTQ-UHFFFAOYSA-N -1 1 303.308 4.323 20 0 DIADMM O=C(Nc1ccc([O-])c(F)c1F)c1cccc2c1CCCCC2 ZINC001140656787 1046841323 /nfs/dbraw/zinc/84/13/23/1046841323.db2.gz BXLIFZZXPQLRMH-UHFFFAOYSA-N -1 1 317.335 4.192 20 0 DIADMM C[C@H]1C[C@H]1c1ccc(CCC(=O)Nc2ccc([O-])c(Cl)c2)o1 ZINC000679643826 1046887731 /nfs/dbraw/zinc/88/77/31/1046887731.db2.gz LFGAOOXDEDHZIY-GXFFZTMASA-N -1 1 319.788 4.333 20 0 DIADMM CN(Cc1ccc(F)cc1)Cc1cc(Cl)c([O-])c(Cl)c1 ZINC001140829415 1046917741 /nfs/dbraw/zinc/91/77/41/1046917741.db2.gz IWKUHDPMWWOBMZ-UHFFFAOYSA-N -1 1 314.187 4.470 20 0 DIADMM [O-]c1c(Cl)cc(CN2CCC3(CCC3)CC2)cc1Cl ZINC001140835384 1046924515 /nfs/dbraw/zinc/92/45/15/1046924515.db2.gz VOAXURARSFFCEB-UHFFFAOYSA-N -1 1 300.229 4.465 20 0 DIADMM C[C@H](c1cc(Cl)ccc1Cl)N1CCC(CC(=O)[O-])CC1 ZINC000093682314 1046964229 /nfs/dbraw/zinc/96/42/29/1046964229.db2.gz SJTYONQBNGCHJY-SNVBAGLBSA-N -1 1 316.228 4.241 20 0 DIADMM [O-]c1c(F)cc(CN2CCC[C@@H]2c2ccc(F)cc2)cc1F ZINC001140987765 1046970979 /nfs/dbraw/zinc/97/09/79/1046970979.db2.gz CNKIOVHRIMOTKR-MRXNPFEDSA-N -1 1 307.315 4.147 20 0 DIADMM CCC[C@H](NC(=O)c1c([O-])cnc2c(F)cccc21)C(C)(C)C ZINC001141013554 1046978689 /nfs/dbraw/zinc/97/86/89/1046978689.db2.gz NHNBADROISFUJN-AWEZNQCLSA-N -1 1 318.392 4.024 20 0 DIADMM CCC(CC)(Cc1nc2ccccc2s1)C(=O)[N-]OC(C)C ZINC000836799430 1046988105 /nfs/dbraw/zinc/98/81/05/1046988105.db2.gz SOLPVDDCFTZDLL-UHFFFAOYSA-N -1 1 320.458 4.101 20 0 DIADMM CCC[N@@H+](CC(=O)[O-])Cc1c(Cl)cccc1SC(C)C ZINC000263404867 1046988753 /nfs/dbraw/zinc/98/87/53/1046988753.db2.gz JHSVTFFHFRXIML-UHFFFAOYSA-N -1 1 315.866 4.137 20 0 DIADMM Cc1c(CN2CCCC[C@@H]2C(=O)[O-])sc2c1cccc2Cl ZINC000263413680 1046989820 /nfs/dbraw/zinc/98/98/20/1046989820.db2.gz MIKYMQWWJOYHNI-CYBMUJFWSA-N -1 1 323.845 4.302 20 0 DIADMM O=C1c2ccccc2SC/C1=C/c1ccc([O-])c(Cl)c1 ZINC000207712170 1047022400 /nfs/dbraw/zinc/02/24/00/1047022400.db2.gz WAXHMWALEUHACI-XFFZJAGNSA-N -1 1 302.782 4.418 20 0 DIADMM O=C(Nc1ccc2c(c1)Cc1ccccc1-2)c1ccc([O-])c(F)c1 ZINC000681015430 1047081894 /nfs/dbraw/zinc/08/18/94/1047081894.db2.gz PGKODHTVLFMUFW-UHFFFAOYSA-N -1 1 319.335 4.355 20 0 DIADMM C[C@@H](c1cc2ccccc2o1)N(C)C(=O)c1ccc([O-])c(F)c1 ZINC000681016711 1047081917 /nfs/dbraw/zinc/08/19/17/1047081917.db2.gz BANZQBMGDRBMSR-NSHDSACASA-N -1 1 313.328 4.111 20 0 DIADMM CC[C@H](NC(=O)c1ccc([O-])c(F)c1)c1cccc(Cl)c1 ZINC000681017446 1047082291 /nfs/dbraw/zinc/08/22/91/1047082291.db2.gz YYKZHCDKYLFJGL-AWEZNQCLSA-N -1 1 307.752 4.066 20 0 DIADMM O=C(Nc1ccccc1Cc1ccccc1)c1ccc([O-])c(F)c1 ZINC000681015677 1047082998 /nfs/dbraw/zinc/08/29/98/1047082998.db2.gz KIWVCLCZDGVKAE-UHFFFAOYSA-N -1 1 321.351 4.374 20 0 DIADMM CCCOc1ccc(Cl)cc1NC(=O)c1ccc([O-])c(F)c1 ZINC000681019632 1047085223 /nfs/dbraw/zinc/08/52/23/1047085223.db2.gz YDUIHJUXEHRZHO-UHFFFAOYSA-N -1 1 323.751 4.226 20 0 DIADMM Cc1ccc([C@@H]2CCCCCN2C(=O)c2ccc([O-])c(F)c2)o1 ZINC000681048675 1047088335 /nfs/dbraw/zinc/08/83/35/1047088335.db2.gz NCZANTFCFFUMKC-HNNXBMFYSA-N -1 1 317.360 4.190 20 0 DIADMM O=C(N[C@@H](CC1CCC1)c1ccccc1)c1ccc([O-])c(F)c1 ZINC000681064757 1047089288 /nfs/dbraw/zinc/08/92/88/1047089288.db2.gz NXTABUMFUSSYOU-KRWDZBQOSA-N -1 1 313.372 4.193 20 0 DIADMM CC[C@@H](Cc1ccccc1)N(CC)C(=O)c1ccc([O-])c(F)c1 ZINC000681055997 1047089748 /nfs/dbraw/zinc/08/97/48/1047089748.db2.gz SRCKNRYPXWERKV-INIZCTEOSA-N -1 1 315.388 4.015 20 0 DIADMM CCCCN(C(=O)c1ccc([O-])c(F)c1)[C@H]1CCC[C@@H](C)C1 ZINC001141522733 1047159535 /nfs/dbraw/zinc/15/95/35/1047159535.db2.gz QTJYTQVYOWATSF-HIFRSBDPSA-N -1 1 307.409 4.352 20 0 DIADMM Cc1cc([C@@H](C)NC(=O)c2ccc3ccccc3c2[O-])ccc1F ZINC001141588085 1047206072 /nfs/dbraw/zinc/20/60/72/1047206072.db2.gz FXLIFMOIHPWCQJ-CYBMUJFWSA-N -1 1 323.367 4.484 20 0 DIADMM Cc1ccc(S(=O)(=O)[N-]c2c(C)cccc2C(C)C)cc1F ZINC000476285766 1047277015 /nfs/dbraw/zinc/27/70/15/1047277015.db2.gz LGDSJTDTWNJGTD-UHFFFAOYSA-N -1 1 321.417 4.367 20 0 DIADMM Cc1ccc(F)cc1S(=O)(=O)[N-]c1c(C)cccc1C(C)C ZINC000476318295 1047283391 /nfs/dbraw/zinc/28/33/91/1047283391.db2.gz QFYXERBPOXIVOK-UHFFFAOYSA-N -1 1 321.417 4.367 20 0 DIADMM CC[C@@H](C)c1ccc(C(=O)Nc2cc([O-])c(F)cc2F)cc1 ZINC001141833747 1047295696 /nfs/dbraw/zinc/29/56/96/1047295696.db2.gz LEVFOXLCAKWEBZ-SNVBAGLBSA-N -1 1 305.324 4.436 20 0 DIADMM O=C(Cc1ccc2ccccc2c1)Nc1cc([O-])c(F)cc1F ZINC001141831252 1047295968 /nfs/dbraw/zinc/29/59/68/1047295968.db2.gz HEFJWLWCDLMOPH-UHFFFAOYSA-N -1 1 313.303 4.005 20 0 DIADMM O=C(Nc1cc([O-])c(F)cc1F)c1ccc(C2CCC2)cc1 ZINC001141833403 1047296090 /nfs/dbraw/zinc/29/60/90/1047296090.db2.gz DTEGVLUSTZFGSY-UHFFFAOYSA-N -1 1 303.308 4.190 20 0 DIADMM Cc1ccc(CN(Cc2ccc(C(=O)[O-])c(Cl)c2)C2CC2)o1 ZINC000652387757 1047356204 /nfs/dbraw/zinc/35/62/04/1047356204.db2.gz RUHNCKAWXGUPKR-UHFFFAOYSA-N -1 1 319.788 4.104 20 0 DIADMM O=C(c1ccccc1[O-])N(Cc1ccsc1)c1ccccc1 ZINC001143112833 1047532790 /nfs/dbraw/zinc/53/27/90/1047532790.db2.gz BUVLAJLEEMGPRZ-UHFFFAOYSA-N -1 1 309.390 4.301 20 0 DIADMM CCOc1cc(C(=O)Nc2cc(F)ccc2C)cc(Cl)c1[O-] ZINC000192599969 1047538671 /nfs/dbraw/zinc/53/86/71/1047538671.db2.gz GEVGBXHAFROIRQ-UHFFFAOYSA-N -1 1 323.751 4.144 20 0 DIADMM CC(C)c1cccc(NC(=O)c2cc3cccc(O)c3cc2[O-])n1 ZINC001149645151 1047567032 /nfs/dbraw/zinc/56/70/32/1047567032.db2.gz JYEMVXRAOXFBSX-UHFFFAOYSA-N -1 1 322.364 4.022 20 0 DIADMM CCc1ccc([C@H](C)NC(=O)Cc2ccc([O-])c(Cl)c2)cc1 ZINC001153157536 1047620873 /nfs/dbraw/zinc/62/08/73/1047620873.db2.gz NRSHGPJDMYIOKX-LBPRGKRZSA-N -1 1 317.816 4.028 20 0 DIADMM C[C@@H]1c2ccccc2CCN1C(=O)c1c([O-])ccc2ccccc21 ZINC001153497584 1047625949 /nfs/dbraw/zinc/62/59/49/1047625949.db2.gz FENRUFGHJGMBQW-CQSZACIVSA-N -1 1 317.388 4.305 20 0 DIADMM O=C(Nc1ccc(C(F)F)nc1)c1c([O-])ccc2ccccc21 ZINC001153499410 1047626201 /nfs/dbraw/zinc/62/62/01/1047626201.db2.gz VTPPMOGMEPSGAA-UHFFFAOYSA-N -1 1 314.291 4.130 20 0 DIADMM CC(=O)c1cccc(NC(=O)c2c([O-])ccc3ccccc32)c1C ZINC001153504333 1047626875 /nfs/dbraw/zinc/62/68/75/1047626875.db2.gz KTHJXXIYZNTYKX-UHFFFAOYSA-N -1 1 319.360 4.309 20 0 DIADMM CC(C)[C@H](NC(=O)c1c([O-])ccc2ccccc21)c1cccnc1 ZINC001153509817 1047627132 /nfs/dbraw/zinc/62/71/32/1047627132.db2.gz FIJWZJGZUWMYNV-IBGZPJMESA-N -1 1 320.392 4.068 20 0 DIADMM CC1(C)CCC(=CC(=O)NCc2ccc([O-])c(Cl)c2)CC1 ZINC001154105741 1047640499 /nfs/dbraw/zinc/64/04/99/1047640499.db2.gz OSBQLGWZNMYYTA-UHFFFAOYSA-N -1 1 307.821 4.188 20 0 DIADMM COc1cc(Cl)ccc1NC(=O)c1cc(SC)ccc1[O-] ZINC001154965341 1047663667 /nfs/dbraw/zinc/66/36/67/1047663667.db2.gz VDRUJGPFQMJNDC-UHFFFAOYSA-N -1 1 323.801 4.028 20 0 DIADMM CCC(C)(C)c1ccc(NC(=O)c2ccc([O-])c(F)c2)cc1 ZINC001156818438 1047723909 /nfs/dbraw/zinc/72/39/09/1047723909.db2.gz MQVMUKZXLBEEMF-UHFFFAOYSA-N -1 1 301.361 4.471 20 0 DIADMM CC(C)[C@@H]1[C@@H](C(C)C)CN1C(=O)c1cc2ccccc2cc1[O-] ZINC001157778642 1047754918 /nfs/dbraw/zinc/75/49/18/1047754918.db2.gz VCBLWRQYTMYDQD-IEBWSBKVSA-N -1 1 311.425 4.298 20 0 DIADMM O=C(Nc1cc(F)c([O-])cc1Cl)c1ccc(Cl)cc1F ZINC001157893479 1047762631 /nfs/dbraw/zinc/76/26/31/1047762631.db2.gz JFMDBSFWWDCCDV-UHFFFAOYSA-N -1 1 318.106 4.230 20 0 DIADMM Cc1cncc(Nc2cc(Br)cc(Cl)c2[O-])c1 ZINC001174763595 1047964746 /nfs/dbraw/zinc/96/47/46/1047964746.db2.gz YOXXOTHEJCCDMB-UHFFFAOYSA-N -1 1 313.582 4.255 20 0 DIADMM Nc1nc2ccc(Nc3cc(Cl)c([O-])cc3F)cc2s1 ZINC001159821691 1047931535 /nfs/dbraw/zinc/93/15/35/1047931535.db2.gz BOHMDSQXKXKDPS-UHFFFAOYSA-N -1 1 309.753 4.120 20 0 DIADMM CCCCN(C(=O)c1ccc(F)c([O-])c1)[C@@H]1CCC[C@@H](C)C1 ZINC001159892574 1047941963 /nfs/dbraw/zinc/94/19/63/1047941963.db2.gz QYFPFOIMNPHORR-UKRRQHHQSA-N -1 1 307.409 4.352 20 0 DIADMM CCO[C@@H](C)n1cc(Nc2cc(Cl)cc(Cl)c2[O-])cn1 ZINC001174698313 1047944120 /nfs/dbraw/zinc/94/41/20/1047944120.db2.gz GOTKTQNXLXNNCS-QMMMGPOBSA-N -1 1 316.188 4.194 20 0 DIADMM CCO[C@H](C)n1cc(Nc2c(Cl)ccc([O-])c2Cl)cn1 ZINC001174704932 1047947334 /nfs/dbraw/zinc/94/73/34/1047947334.db2.gz UVBZMDKYWXZIKP-MRVPVSSYSA-N -1 1 316.188 4.194 20 0 DIADMM Cc1cccc(C)c1NC(=S)Nc1c(F)cc([O-])cc1F ZINC001198367692 1047948629 /nfs/dbraw/zinc/94/86/29/1047948629.db2.gz RWLKYGLAXTYUBV-UHFFFAOYSA-N -1 1 308.353 4.096 20 0 DIADMM Cc1cccc(C)c1NC(=S)Nc1cccc([O-])c1Cl ZINC001198358190 1047952132 /nfs/dbraw/zinc/95/21/32/1047952132.db2.gz XDNJHRUKWNBUKJ-UHFFFAOYSA-N -1 1 306.818 4.471 20 0 DIADMM Cc1cccc(C)c1NC(=S)Nc1cc(F)c(F)cc1[O-] ZINC001198357266 1047952379 /nfs/dbraw/zinc/95/23/79/1047952379.db2.gz ITWSLONYKUYPCL-UHFFFAOYSA-N -1 1 308.353 4.096 20 0 DIADMM CCc1ccc(C(=O)N2c3ccc(Cl)cc3C[C@H]2C)c([O-])c1 ZINC001159959666 1047958378 /nfs/dbraw/zinc/95/83/78/1047958378.db2.gz NNHLOLPPCRPLRK-LLVKDONJSA-N -1 1 315.800 4.199 20 0 DIADMM CCc1ccc(C(=O)N2c3ccc(Cl)cc3C[C@@H]2C)c([O-])c1 ZINC001159959667 1047958532 /nfs/dbraw/zinc/95/85/32/1047958532.db2.gz NNHLOLPPCRPLRK-NSHDSACASA-N -1 1 315.800 4.199 20 0 DIADMM COc1ccc(C(F)(F)F)cc1Nc1c([O-])cc(F)cc1F ZINC001174777421 1047970414 /nfs/dbraw/zinc/97/04/14/1047970414.db2.gz XXFSUWHJUBASPN-UHFFFAOYSA-N -1 1 319.229 4.441 20 0 DIADMM Cc1c(Cl)cc(Nc2ccc3c(c2)OCO3)c([O-])c1Cl ZINC001174867321 1048008016 /nfs/dbraw/zinc/00/80/16/1048008016.db2.gz GZYZCGKYZFEPIN-UHFFFAOYSA-N -1 1 312.152 4.480 20 0 DIADMM Cc1cc([N-]S(=O)(=O)c2ccc3occc3c2)cc(C)c1C ZINC001198859129 1048012357 /nfs/dbraw/zinc/01/23/57/1048012357.db2.gz QCCORSBGZSPVRV-UHFFFAOYSA-N -1 1 315.394 4.159 20 0 DIADMM O=S(=O)([N-]c1cccc(C(F)F)c1)c1ccc2occc2c1 ZINC001198854067 1048012435 /nfs/dbraw/zinc/01/24/35/1048012435.db2.gz AHLFXSGDQJAPID-UHFFFAOYSA-N -1 1 323.320 4.171 20 0 DIADMM CCCCC1(C(=O)Nc2cccc([O-])c2Br)CC1 ZINC000821375239 1048019816 /nfs/dbraw/zinc/01/98/16/1048019816.db2.gz PHLDPCKKIISULB-UHFFFAOYSA-N -1 1 312.207 4.064 20 0 DIADMM Cc1cccc(Cl)c1NC(=O)Nc1ccc([O-])c(F)c1F ZINC001184533828 1048049116 /nfs/dbraw/zinc/04/91/16/1048049116.db2.gz LDMUJMPQPDGYRP-UHFFFAOYSA-N -1 1 312.703 4.276 20 0 DIADMM Cc1c(Cl)cccc1NC(=O)Nc1cc(F)c([O-])c(F)c1 ZINC001184680084 1048081076 /nfs/dbraw/zinc/08/10/76/1048081076.db2.gz QCQASEXBKDLIMQ-UHFFFAOYSA-N -1 1 312.703 4.276 20 0 DIADMM Cc1c(Cl)cccc1NC(=O)Nc1c(F)cc([O-])cc1F ZINC001184685574 1048082722 /nfs/dbraw/zinc/08/27/22/1048082722.db2.gz IKBPJTUGPYDWHX-UHFFFAOYSA-N -1 1 312.703 4.276 20 0 DIADMM C[C@H](C(=O)Nc1cc([O-])c(F)cc1F)c1ccc(Cl)cc1 ZINC001160917445 1048096368 /nfs/dbraw/zinc/09/63/68/1048096368.db2.gz URMGFZXGKUOXCV-QMMMGPOBSA-N -1 1 311.715 4.066 20 0 DIADMM C[C@@H](CCc1ccccc1F)C(=O)Nc1cc([O-])c(F)cc1F ZINC001160916874 1048096460 /nfs/dbraw/zinc/09/64/60/1048096460.db2.gz OGOCJMPLAJKJSB-JTQLQIEISA-N -1 1 323.314 4.017 20 0 DIADMM C[C@H](CCc1ccccc1F)C(=O)Nc1cc([O-])c(F)cc1F ZINC001160916875 1048097288 /nfs/dbraw/zinc/09/72/88/1048097288.db2.gz OGOCJMPLAJKJSB-SNVBAGLBSA-N -1 1 323.314 4.017 20 0 DIADMM CCCCOc1ccc(C(=O)Nc2ccc3cc[nH]c3c2)c([O-])c1 ZINC001161251426 1048117105 /nfs/dbraw/zinc/11/71/05/1048117105.db2.gz WYRDHOXJIBSROU-UHFFFAOYSA-N -1 1 324.380 4.305 20 0 DIADMM COc1c(C)ccc(NC(=O)c2ccc3ccccc3c2[O-])c1C ZINC000554503803 1048121683 /nfs/dbraw/zinc/12/16/83/1048121683.db2.gz WMFGUHBUZOXQGW-UHFFFAOYSA-N -1 1 321.376 4.423 20 0 DIADMM COc1ccc(Nc2ccc(F)c(F)c2[O-])cc1C(F)(F)F ZINC001175073664 1048128514 /nfs/dbraw/zinc/12/85/14/1048128514.db2.gz UZCRVGUXWLPJBK-UHFFFAOYSA-N -1 1 319.229 4.441 20 0 DIADMM [O-]c1ccc(Cl)c(Nc2c(F)cc(O)cc2F)c1Cl ZINC001175096895 1048142634 /nfs/dbraw/zinc/14/26/34/1048142634.db2.gz LEMFBFUIXUOUNV-UHFFFAOYSA-N -1 1 306.095 4.426 20 0 DIADMM CCOc1ccc(Nc2ccc(F)c(F)c2[O-])c(F)c1F ZINC001175152881 1048145751 /nfs/dbraw/zinc/14/57/51/1048145751.db2.gz YPCQBXDZTKDYEZ-UHFFFAOYSA-N -1 1 301.239 4.091 20 0 DIADMM Cc1ccc(C)c([N-]S(=O)(=O)c2ccc(C(F)F)cc2)c1 ZINC000554685615 1048150982 /nfs/dbraw/zinc/15/09/82/1048150982.db2.gz KRUHBOQSTAAYSM-UHFFFAOYSA-N -1 1 311.353 4.042 20 0 DIADMM O=S(=O)([N-]c1ccccc1Cl)c1cc2ccccc2s1 ZINC001185421923 1048175724 /nfs/dbraw/zinc/17/57/24/1048175724.db2.gz WXYLXRRFRDZLKO-UHFFFAOYSA-N -1 1 323.826 4.356 20 0 DIADMM Cc1cc(S(=O)(=O)[N-]c2ccccc2C2CC2)ccc1Cl ZINC001185484209 1048186947 /nfs/dbraw/zinc/18/69/47/1048186947.db2.gz BGPALNUCEVIMCJ-UHFFFAOYSA-N -1 1 321.829 4.327 20 0 DIADMM [O-]c1cc(F)c(NC(=S)Nc2cccc(Cl)c2)cc1F ZINC001201105401 1048191657 /nfs/dbraw/zinc/19/16/57/1048191657.db2.gz MSJPOEDVIARWON-UHFFFAOYSA-N -1 1 314.744 4.133 20 0 DIADMM CCc1ccccc1NC(=S)Nc1c(F)cc([O-])cc1F ZINC001201152013 1048201780 /nfs/dbraw/zinc/20/17/80/1048201780.db2.gz KZAMTAFAZQJVTA-UHFFFAOYSA-N -1 1 308.353 4.042 20 0 DIADMM CSc1ccc(NC(=S)Nc2ccc(F)cc2[O-])cc1 ZINC001201182312 1048211707 /nfs/dbraw/zinc/21/17/07/1048211707.db2.gz AYPTZAYBNNOXJM-UHFFFAOYSA-N -1 1 308.403 4.062 20 0 DIADMM C[C@H](NC(=O)c1ccc([O-])cc1F)c1csc2ccccc21 ZINC000776141691 1048222301 /nfs/dbraw/zinc/22/23/01/1048222301.db2.gz OYEOYQDPKYBDME-JTQLQIEISA-N -1 1 315.369 4.237 20 0 DIADMM CCOc1ccc(F)c(F)c1Nc1ccc(F)c(F)c1[O-] ZINC001175281231 1048227993 /nfs/dbraw/zinc/22/79/93/1048227993.db2.gz IERNIPGHTGGGCU-UHFFFAOYSA-N -1 1 301.239 4.091 20 0 DIADMM CCOc1ccc(F)c(F)c1[N-]c1nc2ccc(F)cc2o1 ZINC001175279605 1048228267 /nfs/dbraw/zinc/22/82/67/1048228267.db2.gz AKEVFVUBFAGIKX-UHFFFAOYSA-N -1 1 308.259 4.387 20 0 DIADMM Cc1c(F)cccc1S(=O)(=O)[N-]c1ccccc1C(C)(C)C ZINC001185829661 1048231787 /nfs/dbraw/zinc/23/17/87/1048231787.db2.gz VZPNLDJPHAORJO-UHFFFAOYSA-N -1 1 321.417 4.232 20 0 DIADMM Cc1nc2cc(Nc3ccc(-n4ccc(=O)[n-]4)cc3)ccc2s1 ZINC001213039256 1048250553 /nfs/dbraw/zinc/25/05/53/1048250553.db2.gz STPJUYASVYQBSK-UHFFFAOYSA-N -1 1 322.393 4.240 20 0 DIADMM O=C(Nc1ccc2sc(Cl)nc2c1)c1ccc([O-])c(F)c1 ZINC001186225396 1048274061 /nfs/dbraw/zinc/27/40/61/1048274061.db2.gz BTTSYFDXYFSPJF-UHFFFAOYSA-N -1 1 322.748 4.047 20 0 DIADMM [O-]c1c(Cl)cc(Cl)cc1Nc1cnc2cccnc2c1 ZINC001175358474 1048275405 /nfs/dbraw/zinc/27/54/05/1048275405.db2.gz NZPKNTXGCFUMAM-UHFFFAOYSA-N -1 1 306.152 4.386 20 0 DIADMM Cc1nc2cc(NC(=O)c3ccc([O-])cc3F)c(C)cc2s1 ZINC001186328521 1048281678 /nfs/dbraw/zinc/28/16/78/1048281678.db2.gz FMOZTNRLIHQXMP-UHFFFAOYSA-N -1 1 316.357 4.010 20 0 DIADMM CC(C)Cc1ccc([C@H](C)NC(=O)c2ccc([O-])cc2F)cc1 ZINC001186349111 1048284604 /nfs/dbraw/zinc/28/46/04/1048284604.db2.gz XHNUNGLZNQBFEF-ZDUSSCGKSA-N -1 1 315.388 4.221 20 0 DIADMM O=C(N[C@@H](c1ccccc1)C1CCCC1)c1ccc([O-])cc1F ZINC001186339664 1048289573 /nfs/dbraw/zinc/28/95/73/1048289573.db2.gz NOESBTOMBFQFCR-SFHVURJKSA-N -1 1 313.372 4.193 20 0 DIADMM CCc1c(Cl)cc(Nc2cnc3n[nH]cc3c2)c([O-])c1Cl ZINC001175405865 1048298382 /nfs/dbraw/zinc/29/83/82/1048298382.db2.gz NJZDFHPXQASJSH-UHFFFAOYSA-N -1 1 323.183 4.276 20 0 DIADMM Cn1ncc2cc(Nc3c(Cl)ccc([O-])c3Cl)ccc21 ZINC001175421001 1048301536 /nfs/dbraw/zinc/30/15/36/1048301536.db2.gz LEBZIXVTZWVSND-UHFFFAOYSA-N -1 1 308.168 4.329 20 0 DIADMM Cn1ncc2c1cccc2Nc1c(Cl)ccc([O-])c1Cl ZINC001175437733 1048306813 /nfs/dbraw/zinc/30/68/13/1048306813.db2.gz FYTCSJMNRDSRNP-UHFFFAOYSA-N -1 1 308.168 4.329 20 0 DIADMM Cn1ncc2c1cccc2Nc1ccc(Cl)c(Cl)c1[O-] ZINC001175438163 1048306886 /nfs/dbraw/zinc/30/68/86/1048306886.db2.gz GAULWIRBVOVVQK-UHFFFAOYSA-N -1 1 308.168 4.329 20 0 DIADMM O=C(Nc1ccc(Cl)cc1[O-])N[C@@H]1CCCc2ccccc21 ZINC001186457659 1048309738 /nfs/dbraw/zinc/30/97/38/1048309738.db2.gz OLCHQXNQLWOPJN-CQSZACIVSA-N -1 1 316.788 4.245 20 0 DIADMM C[S@@](=O)c1ccc(Nc2c(Cl)ccc([O-])c2Cl)cc1 ZINC001175480848 1048318842 /nfs/dbraw/zinc/31/88/42/1048318842.db2.gz BVXMXOYGHOEYQG-LJQANCHMSA-N -1 1 316.209 4.180 20 0 DIADMM [O-]c1c(Cl)c(Cl)ccc1Nc1ccc2nccnc2c1 ZINC001175494702 1048326996 /nfs/dbraw/zinc/32/69/96/1048326996.db2.gz SHKNBHMHKVDZJM-UHFFFAOYSA-N -1 1 306.152 4.386 20 0 DIADMM CCc1c(Cl)cc(Nc2cccc(CO)c2)c([O-])c1Cl ZINC001175518833 1048350940 /nfs/dbraw/zinc/35/09/40/1048350940.db2.gz SMUHZOAAQDUKJZ-UHFFFAOYSA-N -1 1 312.196 4.497 20 0 DIADMM CSC[C@@H](C)C(=O)Nc1cc(Cl)c([O-])c2ccccc12 ZINC000600135022 1048371436 /nfs/dbraw/zinc/37/14/36/1048371436.db2.gz AXVYUIQYFQCYDM-SECBINFHSA-N -1 1 309.818 4.136 20 0 DIADMM O=C(CSC1CC1)Nc1cc(Cl)c([O-])c2ccccc12 ZINC000600136684 1048372586 /nfs/dbraw/zinc/37/25/86/1048372586.db2.gz WKOMWMXJEGFYRU-UHFFFAOYSA-N -1 1 307.802 4.033 20 0 DIADMM CSCCCC(=O)Nc1cc(Cl)c([O-])c2ccccc12 ZINC000600135450 1048372614 /nfs/dbraw/zinc/37/26/14/1048372614.db2.gz HXTCHAUPCODGOL-UHFFFAOYSA-N -1 1 309.818 4.281 20 0 DIADMM CCc1c(Cl)cc(Nc2ccc(CO)cc2)c([O-])c1Cl ZINC001175568304 1048372911 /nfs/dbraw/zinc/37/29/11/1048372911.db2.gz DVMMFYGTXIPGIU-UHFFFAOYSA-N -1 1 312.196 4.497 20 0 DIADMM O=C(Nc1cc(Cl)cc(Cl)c1)Nc1c([O-])cccc1F ZINC001187148336 1048379259 /nfs/dbraw/zinc/37/92/59/1048379259.db2.gz QFLRJVYASULZTA-UHFFFAOYSA-N -1 1 315.131 4.482 20 0 DIADMM O=C(N[C@@H](C1CCC1)C1CCCCC1)c1c([O-])cccc1F ZINC001163039405 1048407890 /nfs/dbraw/zinc/40/78/90/1048407890.db2.gz ISMMQLXQZDJXHS-QGZVFWFLSA-N -1 1 305.393 4.010 20 0 DIADMM O=C(Nc1cccc(F)c1[O-])Nc1c(Cl)cccc1Cl ZINC001202103445 1048452516 /nfs/dbraw/zinc/45/25/16/1048452516.db2.gz OVHHCPWYFBXAQL-UHFFFAOYSA-N -1 1 315.131 4.482 20 0 DIADMM CSc1cccc(NC(=O)Nc2cc(F)c(F)cc2[O-])c1 ZINC001188049995 1048463887 /nfs/dbraw/zinc/46/38/87/1048463887.db2.gz BEBFODWLOADONV-UHFFFAOYSA-N -1 1 310.325 4.036 20 0 DIADMM CSc1cccc(NC(=O)Nc2cc(F)c([O-])c(F)c2)c1 ZINC001188047363 1048464197 /nfs/dbraw/zinc/46/41/97/1048464197.db2.gz BKPRWGAQZUCFFI-UHFFFAOYSA-N -1 1 310.325 4.036 20 0 DIADMM CCCc1cc(=O)[n-]c(SCC[C@H]2CCCC2(F)F)n1 ZINC001188163097 1048482621 /nfs/dbraw/zinc/48/26/21/1048482621.db2.gz NZSWBYJADBFFBE-SNVBAGLBSA-N -1 1 302.390 4.052 20 0 DIADMM FC(F)Oc1ccc(-c2cc([N-]c3cscn3)on2)cc1 ZINC001175937499 1048490361 /nfs/dbraw/zinc/49/03/61/1048490361.db2.gz JOOYGIUTHUCBMX-UHFFFAOYSA-N -1 1 309.297 4.143 20 0 DIADMM Brc1ccc(-c2cnoc2[N-]c2cscn2)cc1 ZINC001175940931 1048491927 /nfs/dbraw/zinc/49/19/27/1048491927.db2.gz NURSPYYPEMJBFA-UHFFFAOYSA-N -1 1 322.187 4.304 20 0 DIADMM Cc1ccc2ccccc2c1NC(=O)c1ncc(C(F)(F)F)[n-]1 ZINC001188277765 1048496540 /nfs/dbraw/zinc/49/65/40/1048496540.db2.gz KTSPJLBYIWWCRB-UHFFFAOYSA-N -1 1 319.286 4.142 20 0 DIADMM Cc1ccc2ccccc2c1NC(=O)c1nc(C(F)(F)F)c[n-]1 ZINC001188277765 1048496548 /nfs/dbraw/zinc/49/65/48/1048496548.db2.gz KTSPJLBYIWWCRB-UHFFFAOYSA-N -1 1 319.286 4.142 20 0 DIADMM O=C(Nc1cccc(Cl)c1F)Nc1cccc([O-])c1Cl ZINC001188411687 1048513869 /nfs/dbraw/zinc/51/38/69/1048513869.db2.gz YSDKWNVBLYRBSP-UHFFFAOYSA-N -1 1 315.131 4.482 20 0 DIADMM O=C(Nc1cccc2cc[nH]c21)c1ccc([O-])c(C(F)(F)F)c1 ZINC001188588737 1048533186 /nfs/dbraw/zinc/53/31/86/1048533186.db2.gz HYLTWOVOBQKSEG-UHFFFAOYSA-N -1 1 320.270 4.145 20 0 DIADMM O=C(Nc1ccc(C(F)(F)F)cc1)Nc1ccc(F)cc1[O-] ZINC001202411553 1048544657 /nfs/dbraw/zinc/54/46/57/1048544657.db2.gz SOLZOTQAWHKISL-UHFFFAOYSA-N -1 1 314.238 4.194 20 0 DIADMM O=C(Nc1ccc([O-])c(F)c1F)Nc1cccc2ccccc21 ZINC001188936565 1048568887 /nfs/dbraw/zinc/56/88/87/1048568887.db2.gz LEWLLTHXWOINQF-UHFFFAOYSA-N -1 1 314.291 4.468 20 0 DIADMM COc1ccc(Nc2cc([O-])c(F)c(F)c2)c(C(F)(F)F)c1 ZINC001213049897 1048572786 /nfs/dbraw/zinc/57/27/86/1048572786.db2.gz NXTHMOFWZHJUSD-UHFFFAOYSA-N -1 1 319.229 4.441 20 0 DIADMM Cc1nc(SC/C=C/c2ccc(Cl)cc2)[n-]c(=O)c1C ZINC001189062500 1048589383 /nfs/dbraw/zinc/58/93/83/1048589383.db2.gz XILJESCVPDESHH-ONEGZZNKSA-N -1 1 306.818 4.258 20 0 DIADMM CCc1nc(SCc2cccc3ccccc32)[n-]c(=O)c1C ZINC001189495680 1048630364 /nfs/dbraw/zinc/63/03/64/1048630364.db2.gz MGGJEVCFEYMTTE-UHFFFAOYSA-N -1 1 310.422 4.499 20 0 DIADMM CC(C)(C)c1ccccc1NC(=O)Nc1cc(Cl)ncc1[O-] ZINC001189562895 1048637918 /nfs/dbraw/zinc/63/79/18/1048637918.db2.gz BEYQXPNFZATAKW-UHFFFAOYSA-N -1 1 319.792 4.382 20 0 DIADMM O=C(CCCCCc1cccs1)Nc1cccc(F)c1[O-] ZINC001151772738 1048639105 /nfs/dbraw/zinc/63/91/05/1048639105.db2.gz SWOATHOPBFWIHY-UHFFFAOYSA-N -1 1 307.390 4.334 20 0 DIADMM O=C(Cc1ccc(Cl)cc1Cl)Nc1cccc(F)c1[O-] ZINC001151772734 1048639247 /nfs/dbraw/zinc/63/92/47/1048639247.db2.gz SLVGUJZBTGAWTM-UHFFFAOYSA-N -1 1 314.143 4.019 20 0 DIADMM COc1c(F)cc(Nc2c([O-])cc(F)cc2F)cc1Cl ZINC001214971653 1048655496 /nfs/dbraw/zinc/65/54/96/1048655496.db2.gz CLZGQPKUTOCFNX-UHFFFAOYSA-N -1 1 303.667 4.215 20 0 DIADMM [O-]c1cc(F)cc(F)c1Nc1cc(F)cc(N2CCCC2)c1 ZINC001176418736 1048681847 /nfs/dbraw/zinc/68/18/47/1048681847.db2.gz IVHOSUFFLSEPCH-UHFFFAOYSA-N -1 1 308.303 4.153 20 0 DIADMM CCc1cccc(C)c1NC(=O)Nc1c(F)cc([O-])cc1F ZINC001189986917 1048687312 /nfs/dbraw/zinc/68/73/12/1048687312.db2.gz XMOGXRITOVMTGK-UHFFFAOYSA-N -1 1 306.312 4.185 20 0 DIADMM CC(C)(C)c1ccc(/C=C/C(=O)Nc2c([O-])cccc2F)cc1 ZINC001165758425 1048714973 /nfs/dbraw/zinc/71/49/73/1048714973.db2.gz HGTUQRSULVNDCZ-FMIVXFBMSA-N -1 1 313.372 4.481 20 0 DIADMM COc1ccc(C(C)C)cc1CSc1nc(C)c(C)c(=O)[n-]1 ZINC001165917984 1048724411 /nfs/dbraw/zinc/72/44/11/1048724411.db2.gz QRUNVFJJMWYAEL-UHFFFAOYSA-N -1 1 318.442 4.223 20 0 DIADMM Cc1cnc(SCc2ccc(C3CCCC3)cc2)[n-]c1=O ZINC001166227405 1048740921 /nfs/dbraw/zinc/74/09/21/1048740921.db2.gz GADZXKUOFVCSFG-UHFFFAOYSA-N -1 1 300.427 4.441 20 0 DIADMM CCc1nc(S[C@@H](C)c2ccc3c(c2)CCC3)[n-]c(=O)c1C ZINC001166307355 1048743689 /nfs/dbraw/zinc/74/36/89/1048743689.db2.gz DDZWCRZKQDFKOY-LBPRGKRZSA-N -1 1 314.454 4.395 20 0 DIADMM CSc1ccccc1[N-]S(=O)(=O)c1ccc(C2CC2)cc1 ZINC001190500485 1048744494 /nfs/dbraw/zinc/74/44/94/1048744494.db2.gz PDRFDCUKXBLRLS-UHFFFAOYSA-N -1 1 319.451 4.087 20 0 DIADMM O=S(=O)([N-]c1cccc2occc21)c1ccc(C2CC2)cc1 ZINC001190506843 1048747186 /nfs/dbraw/zinc/74/71/86/1048747186.db2.gz NHNMZSFLNBMNQI-UHFFFAOYSA-N -1 1 313.378 4.111 20 0 DIADMM [O-]c1c(F)cc(F)c(Nc2ccccc2Br)c1F ZINC001176669278 1048751624 /nfs/dbraw/zinc/75/16/24/1048751624.db2.gz GCZGIVRUDYJOIE-UHFFFAOYSA-N -1 1 318.092 4.316 20 0 DIADMM Cc1c2ccccc2oc1[C@@H](C)NC(=O)c1ccc([O-])cc1F ZINC000162358281 1048752827 /nfs/dbraw/zinc/75/28/27/1048752827.db2.gz WMPVZNSWIGCKLX-LLVKDONJSA-N -1 1 313.328 4.077 20 0 DIADMM CC(C)(C)Cc1cc(Nc2c(F)cc(F)c([O-])c2F)on1 ZINC001176663810 1048753248 /nfs/dbraw/zinc/75/32/48/1048753248.db2.gz MHYWBDTXHOYMRN-UHFFFAOYSA-N -1 1 300.280 4.130 20 0 DIADMM CC(C)n1ncc2cc(Nc3c(F)cc(F)c([O-])c3F)ccc21 ZINC001176670629 1048755207 /nfs/dbraw/zinc/75/52/07/1048755207.db2.gz ISOSCLCGDPVGTO-UHFFFAOYSA-N -1 1 321.302 4.484 20 0 DIADMM CCN(CC)c1ccc(Nc2c(F)cc(F)c([O-])c2F)cc1 ZINC001176670129 1048756162 /nfs/dbraw/zinc/75/61/62/1048756162.db2.gz SRTOSDNGVCRHOL-UHFFFAOYSA-N -1 1 310.319 4.399 20 0 DIADMM [O-]c1c(F)cc(F)c(Nc2cc(-c3ccc(F)cc3)no2)c1F ZINC001176663156 1048769201 /nfs/dbraw/zinc/76/92/01/1048769201.db2.gz CSRSZEUTENQZOA-UHFFFAOYSA-N -1 1 324.233 4.347 20 0 DIADMM [O-]c1cc(Nc2ccnn2Cc2ccccc2)c(F)cc1Cl ZINC001176706012 1048782023 /nfs/dbraw/zinc/78/20/23/1048782023.db2.gz USIADQAICOGFLX-UHFFFAOYSA-N -1 1 317.751 4.173 20 0 DIADMM CC(C)Oc1ncc(Cl)cc1Nc1ccnc(Cl)c1[O-] ZINC001203314279 1048865520 /nfs/dbraw/zinc/86/55/20/1048865520.db2.gz QZSGYKNNFKGUDW-UHFFFAOYSA-N -1 1 314.172 4.020 20 0 DIADMM Cc1cccc([C@H](CC(=O)[O-])NCc2ccsc2Cl)c1 ZINC000904044486 1048962461 /nfs/dbraw/zinc/96/24/61/1048962461.db2.gz BANVMWSMKOSIGS-ZDUSSCGKSA-N -1 1 309.818 4.016 20 0 DIADMM Cc1cccc([C@H](CC(=O)[O-])NCc2sccc2Cl)c1 ZINC000904044458 1048962845 /nfs/dbraw/zinc/96/28/45/1048962845.db2.gz AJRIJPYTUOZVBF-ZDUSSCGKSA-N -1 1 309.818 4.016 20 0 DIADMM [O-]c1cccc(CNc2ccc(OC3CCCC3)nc2)c1Cl ZINC001178259563 1049016345 /nfs/dbraw/zinc/01/63/45/1049016345.db2.gz UERKNUOYGUZXTQ-UHFFFAOYSA-N -1 1 318.804 4.374 20 0 DIADMM CCc1nc(SCc2cc(Cl)ccc2F)[n-]c(=O)c1C ZINC000568653991 1049065360 /nfs/dbraw/zinc/06/53/60/1049065360.db2.gz LCUBGBIVHPFTQJ-UHFFFAOYSA-N -1 1 312.797 4.138 20 0 DIADMM CCc1ccc(-c2noc(-c3cc(SC)ccc3[O-])n2)cc1 ZINC000904575409 1049106610 /nfs/dbraw/zinc/10/66/10/1049106610.db2.gz ZSYLGIMWZMVHHS-UHFFFAOYSA-N -1 1 312.394 4.394 20 0 DIADMM O=C(NCCCCC1CCCCC1)c1cc([O-])cc(F)c1F ZINC001192684429 1049128533 /nfs/dbraw/zinc/12/85/33/1049128533.db2.gz QQDHMZVEAHYDJW-UHFFFAOYSA-N -1 1 311.372 4.151 20 0 DIADMM CC(C)=CCC/C(C)=C/CNC(=O)c1cc([O-])cc(F)c1F ZINC001192678478 1049128727 /nfs/dbraw/zinc/12/87/27/1049128727.db2.gz CSTGLQKQFULHGG-KPKJPENVSA-N -1 1 309.356 4.093 20 0 DIADMM CCc1cccc(CC)c1NC(=O)c1cc([O-])cc(F)c1F ZINC001192664936 1049132325 /nfs/dbraw/zinc/13/23/25/1049132325.db2.gz HYHVRQVMTQKWKH-UHFFFAOYSA-N -1 1 305.324 4.048 20 0 DIADMM CCCN(C(=O)c1cc(F)ccc1[O-])c1ccc(CC)cc1 ZINC000857526137 1049168926 /nfs/dbraw/zinc/16/89/26/1049168926.db2.gz FTDCZXZWROTMAL-UHFFFAOYSA-N -1 1 301.361 4.151 20 0 DIADMM CC(C)c1ncsc1NC(=O)c1cc2ccccc2cc1[O-] ZINC000857527182 1049170165 /nfs/dbraw/zinc/17/01/65/1049170165.db2.gz WETNZVQGZIXASH-UHFFFAOYSA-N -1 1 312.394 4.378 20 0 DIADMM [O-]c1cccc(CNc2cnc3c(ccc(F)c3F)c2)c1Cl ZINC001179516402 1049172977 /nfs/dbraw/zinc/17/29/77/1049172977.db2.gz YLAGVEFFOAVFJN-UHFFFAOYSA-N -1 1 320.726 4.484 20 0 DIADMM CCCC[C@H](C)NC(=O)Nc1cc(Cl)c(Cl)cc1[O-] ZINC001193061270 1049177580 /nfs/dbraw/zinc/17/75/80/1049177580.db2.gz UVIGYMXBPUVXTK-QMMMGPOBSA-N -1 1 305.205 4.399 20 0 DIADMM Cc1cc([N-]S(=O)(=O)c2ccc3ccccc3c2)ccc1F ZINC000485099294 1049186160 /nfs/dbraw/zinc/18/61/60/1049186160.db2.gz KDNJUIBJRBLPRV-UHFFFAOYSA-N -1 1 315.369 4.088 20 0 DIADMM O=C(Nc1cc(F)c([O-])cc1Cl)c1ccc2c(c1)CCC=C2 ZINC001179660072 1049188751 /nfs/dbraw/zinc/18/87/51/1049188751.db2.gz KYJJJNSBSJKBLZ-UHFFFAOYSA-N -1 1 317.747 4.396 20 0 DIADMM CC(C)N(Cc1ccccc1F)Cc1ccc([O-])c(F)c1F ZINC001179913692 1049237529 /nfs/dbraw/zinc/23/75/29/1049237529.db2.gz DTNBEFHZVYSRBO-UHFFFAOYSA-N -1 1 309.331 4.220 20 0 DIADMM O=c1nc(N[C@H]2CCCC[C@H]2Cc2ccccc2)cc(Cl)[n-]1 ZINC000858389643 1049251442 /nfs/dbraw/zinc/25/14/42/1049251442.db2.gz JWMWOTJYAYEZDD-KBPBESRZSA-N -1 1 317.820 4.049 20 0 DIADMM O=c1nc(NCC2CCC(c3ccccc3)CC2)cc(Cl)[n-]1 ZINC000858403256 1049252888 /nfs/dbraw/zinc/25/28/88/1049252888.db2.gz YSJMIHWIHYFVJX-UHFFFAOYSA-N -1 1 317.820 4.222 20 0 DIADMM C[C@@H](NC(=O)c1cc(Cl)ccc1[O-])c1ccccc1Cl ZINC000070134237 1049260510 /nfs/dbraw/zinc/26/05/10/1049260510.db2.gz YXBPVEJOUWRCTN-SECBINFHSA-N -1 1 310.180 4.190 20 0 DIADMM COc1c(Cl)cccc1Nc1cc([O-])c(F)c(F)c1F ZINC001249962100 1049317896 /nfs/dbraw/zinc/31/78/96/1049317896.db2.gz GGVQJBAZEOJXHT-UHFFFAOYSA-N -1 1 303.667 4.215 20 0 DIADMM [O-]c1ccc(CN2CC=C(c3ccc(F)cc3)CC2)c(F)c1F ZINC001205122946 1049386331 /nfs/dbraw/zinc/38/63/31/1049386331.db2.gz GUKCXXBZXSSGBH-UHFFFAOYSA-N -1 1 319.326 4.099 20 0 DIADMM Cc1cccc(C)c1S(=O)(=O)[N-]c1ccc2ccccc2c1 ZINC001194638833 1049401156 /nfs/dbraw/zinc/40/11/56/1049401156.db2.gz NOWIZARRJVOUPP-UHFFFAOYSA-N -1 1 311.406 4.257 20 0 DIADMM Cc1cccc(C)c1S(=O)(=O)[N-]c1cccc2sccc21 ZINC001194644476 1049403275 /nfs/dbraw/zinc/40/32/75/1049403275.db2.gz UELXAOQEBHRRBR-UHFFFAOYSA-N -1 1 317.435 4.319 20 0 DIADMM O=C(Nc1cc([O-])c(F)cc1F)Oc1ccc2ccccc2c1 ZINC001194657661 1049405058 /nfs/dbraw/zinc/40/50/58/1049405058.db2.gz QSJHNQGIOJVMGW-UHFFFAOYSA-N -1 1 315.275 4.435 20 0 DIADMM CN(Cc1ccc([O-])c(F)c1F)Cc1c(F)cccc1Cl ZINC001205216420 1049410444 /nfs/dbraw/zinc/41/04/44/1049410444.db2.gz UOOUKNSNKZGEKN-UHFFFAOYSA-N -1 1 315.722 4.095 20 0 DIADMM Cc1cc(C)c(NC(=O)Nc2cc(F)c([O-])cc2F)c(C)c1 ZINC001181265212 1049456259 /nfs/dbraw/zinc/45/62/59/1049456259.db2.gz HITMRNHGQYCOBZ-UHFFFAOYSA-N -1 1 306.312 4.240 20 0 DIADMM CCCCCCC(=O)Nc1cccc([O-])c1Br ZINC000908713820 1049501552 /nfs/dbraw/zinc/50/15/52/1049501552.db2.gz CLKHWEIVXWUUQW-UHFFFAOYSA-N -1 1 300.196 4.064 20 0 DIADMM [O-]c1ccc(CN2Cc3ccccc3C3(CCC3)C2)c(F)c1F ZINC001181654555 1049498992 /nfs/dbraw/zinc/49/89/92/1049498992.db2.gz DDFKYERQLCRBSW-UHFFFAOYSA-N -1 1 315.363 4.108 20 0 DIADMM O=C([O-])c1sccc1-c1ccc2[nH]c(C(F)(F)F)nc2c1 ZINC001205579564 1049503304 /nfs/dbraw/zinc/50/33/04/1049503304.db2.gz PGVGOKXGQACKDL-UHFFFAOYSA-N -1 1 312.272 4.008 20 0 DIADMM CCCOc1ccc(NC(=O)Nc2ccc([O-])c(Cl)c2)cc1 ZINC000487211259 1049530643 /nfs/dbraw/zinc/53/06/43/1049530643.db2.gz PYLKTEXKOWFDJP-UHFFFAOYSA-N -1 1 320.776 4.478 20 0 DIADMM CCC1(CC)C[C@H]1C(=O)Nc1cccc(C(F)(F)F)c1[O-] ZINC001181885814 1049539649 /nfs/dbraw/zinc/53/96/49/1049539649.db2.gz BCIPBNBEFAXMTE-JTQLQIEISA-N -1 1 301.308 4.176 20 0 DIADMM Cc1cccc2c(-c3ccnc(-c4ccc([O-])cc4F)n3)c[nH]c21 ZINC001206030078 1049634462 /nfs/dbraw/zinc/63/44/62/1049634462.db2.gz OGQCGMXQHIYQEU-UHFFFAOYSA-N -1 1 319.339 4.445 20 0 DIADMM Cc1sc(C)c2c1[n-]c(CC[C@@H]1CC1(Cl)Cl)nc2=O ZINC000864355633 1049651339 /nfs/dbraw/zinc/65/13/39/1049651339.db2.gz NWTKLJORNUNUOK-MRVPVSSYSA-N -1 1 317.241 4.140 20 0 DIADMM CCSCc1cccc(NC(=O)c2ccc([O-])cc2F)c1 ZINC000164017633 1049803559 /nfs/dbraw/zinc/80/35/59/1049803559.db2.gz VKGDVCKRQUGTGH-UHFFFAOYSA-N -1 1 305.374 4.037 20 0 DIADMM CCOc1cc(C(=O)Nc2ccc(F)cc2C)cc(Cl)c1[O-] ZINC000192982998 1049945520 /nfs/dbraw/zinc/94/55/20/1049945520.db2.gz LYFZDFGPRUBILC-UHFFFAOYSA-N -1 1 323.751 4.144 20 0 DIADMM CCOc1cc(C(=O)Nc2cccc(C)c2C)cc(Cl)c1[O-] ZINC000192982234 1049947300 /nfs/dbraw/zinc/94/73/00/1049947300.db2.gz FDPPFKPITFERFO-UHFFFAOYSA-N -1 1 319.788 4.313 20 0 DIADMM CCC[C@H]1CCCC[C@H]1[N-]S(=O)(=O)c1sccc1Cl ZINC001209229590 1050046147 /nfs/dbraw/zinc/04/61/47/1050046147.db2.gz BIEFGNRGZSXGIN-CMPLNLGQSA-N -1 1 321.895 4.039 20 0 DIADMM [O-]c1c(Br)ccc(Cl)c1Nc1ncccc1F ZINC001209813674 1050088674 /nfs/dbraw/zinc/08/86/74/1050088674.db2.gz VODJJZRVNRREMQ-UHFFFAOYSA-N -1 1 317.545 4.086 20 0 DIADMM [O-]c1c(Cl)cc(Br)cc1Nc1ncccc1F ZINC001209813629 1050088717 /nfs/dbraw/zinc/08/87/17/1050088717.db2.gz USSLLNBOZAPTQR-UHFFFAOYSA-N -1 1 317.545 4.086 20 0 DIADMM COc1ccc2ccccc2c1Nc1ccnc(Cl)c1[O-] ZINC001210169472 1050148396 /nfs/dbraw/zinc/14/83/96/1050148396.db2.gz CVCHQRKYHDHPTK-UHFFFAOYSA-N -1 1 300.745 4.346 20 0 DIADMM C[C@@H](CCC1CCCCC1)NC(=O)Cc1ccc([O-])c(Cl)c1 ZINC001136774241 1050153459 /nfs/dbraw/zinc/15/34/59/1050153459.db2.gz VUMMSYHMQKDBJF-ZDUSSCGKSA-N -1 1 323.864 4.453 20 0 DIADMM C/C(=C/c1ccc(Cl)cc1)C(=O)Nc1c([O-])cccc1F ZINC000770863838 1050196168 /nfs/dbraw/zinc/19/61/68/1050196168.db2.gz VNDCGCUNNXKHHL-KTKRTIGZSA-N -1 1 305.736 4.227 20 0 DIADMM CCC[C@@H](CCc1ccccc1)NC(=O)c1cccc([O-])c1F ZINC001136957771 1050254252 /nfs/dbraw/zinc/25/42/52/1050254252.db2.gz WOYZQHQALPXHQM-HNNXBMFYSA-N -1 1 315.388 4.063 20 0 DIADMM Cc1cc(Cl)cc(Nc2cc3ccc([O-])cc3oc2=O)c1 ZINC001210461825 1050256935 /nfs/dbraw/zinc/25/69/35/1050256935.db2.gz GTVXMSJMGWTJLB-UHFFFAOYSA-N -1 1 301.729 4.204 20 0 DIADMM [O-]c1ccc(F)cc1-c1nc(-c2cccc(C(F)F)c2)no1 ZINC000771513133 1050260983 /nfs/dbraw/zinc/26/09/83/1050260983.db2.gz GZAPGYCWSVMWOW-UHFFFAOYSA-N -1 1 306.243 4.186 20 0 DIADMM COCOc1ccc(Nc2cc([O-])c(Cl)cc2F)c(C)c1 ZINC001210491734 1050266470 /nfs/dbraw/zinc/26/64/70/1050266470.db2.gz VDXDUHBLZYZTJM-UHFFFAOYSA-N -1 1 311.740 4.219 20 0 DIADMM Cc1ccc(CC[C@H](C)NC(=O)c2ccc3ccccc3c2[O-])o1 ZINC001136978624 1050268036 /nfs/dbraw/zinc/26/80/36/1050268036.db2.gz LNEDMFTWPAOJEO-ZDUSSCGKSA-N -1 1 323.392 4.198 20 0 DIADMM CC[C@H](Cc1ccccc1)N(C)C(=O)c1cc(Cl)ccc1[O-] ZINC001137039404 1050306973 /nfs/dbraw/zinc/30/69/73/1050306973.db2.gz XKWZVVOVXWEEHX-OAHLLOKOSA-N -1 1 317.816 4.139 20 0 DIADMM [O-]c1c(Cl)c(Cl)ccc1Nc1cncc(N2CCCC2)c1 ZINC001210610134 1050313663 /nfs/dbraw/zinc/31/36/63/1050313663.db2.gz QHDYEHFESXMHDW-UHFFFAOYSA-N -1 1 324.211 4.438 20 0 DIADMM [O-]c1c(Nc2cccnc2OC(F)F)ccc(Cl)c1Cl ZINC001210628809 1050319120 /nfs/dbraw/zinc/31/91/20/1050319120.db2.gz JGDRVUZCMZZQDG-UHFFFAOYSA-N -1 1 321.110 4.439 20 0 DIADMM CC(C)CC[C@@H]1CCC[C@H]1NC(=O)c1ccc(Cl)cc1[O-] ZINC001143640624 1050326091 /nfs/dbraw/zinc/32/60/91/1050326091.db2.gz BKPWUMYELCGDID-SWLSCSKDSA-N -1 1 309.837 4.380 20 0 DIADMM [O-]c1cc(Nc2ccc(OC(F)(F)F)nc2)c(F)cc1Cl ZINC001210821125 1050378882 /nfs/dbraw/zinc/37/88/82/1050378882.db2.gz FVLATAYXBCRKSY-UHFFFAOYSA-N -1 1 322.645 4.222 20 0 DIADMM [O-]c1cc(F)cc(F)c1Nc1cc(O)cc(C(F)(F)F)c1 ZINC001210825219 1050382146 /nfs/dbraw/zinc/38/21/46/1050382146.db2.gz CQQIERKXNCPSQK-UHFFFAOYSA-N -1 1 305.202 4.138 20 0 DIADMM [O-]c1ccc(-c2nc(C(F)(F)F)nc3ccsc32)cc1F ZINC001240783440 1050404428 /nfs/dbraw/zinc/40/44/28/1050404428.db2.gz QQSYTYUBFABTJW-UHFFFAOYSA-N -1 1 314.263 4.222 20 0 DIADMM CCc1cc2ncc(Nc3cc(Cl)c([O-])c(Cl)c3)cn2n1 ZINC001210926875 1050416149 /nfs/dbraw/zinc/41/61/49/1050416149.db2.gz JRQJNDDUKCUIBD-UHFFFAOYSA-N -1 1 323.183 4.048 20 0 DIADMM Cn1ccc2cc(Nc3cc(Cl)c([O-])c(Cl)c3)cnc21 ZINC001210924664 1050416538 /nfs/dbraw/zinc/41/65/38/1050416538.db2.gz QKNGJRCPIQTRFW-UHFFFAOYSA-N -1 1 308.168 4.329 20 0 DIADMM Nc1ccc(F)c2ccn(-c3cc(Cl)c([O-])c(Cl)c3)c21 ZINC001210931313 1050419994 /nfs/dbraw/zinc/41/99/94/1050419994.db2.gz RWAXPGZMZPVXPH-UHFFFAOYSA-N -1 1 311.143 4.364 20 0 DIADMM O=C(Nc1c([O-])cccc1F)c1ccc(-c2ccccc2)cc1 ZINC000735925531 1050438431 /nfs/dbraw/zinc/43/84/31/1050438431.db2.gz VHVOSSDCFHJWIT-UHFFFAOYSA-N -1 1 307.324 4.451 20 0 DIADMM Cc1ccc(N(CC(C)C)C(=O)c2ccc(O)cc2[O-])c(C)c1 ZINC000844665022 1050483441 /nfs/dbraw/zinc/48/34/41/1050483441.db2.gz ZVJVVLMLDISRQE-UHFFFAOYSA-N -1 1 313.397 4.017 20 0 DIADMM [O-]c1c(F)c(F)ccc1Nc1ccc(C(F)(F)F)nc1Cl ZINC001211202794 1050516437 /nfs/dbraw/zinc/51/64/37/1050516437.db2.gz CHDUHBHINVTIKN-UHFFFAOYSA-N -1 1 324.636 4.481 20 0 DIADMM CCc1ccc(C(=O)N(C)c2ccc(C)c(Cl)c2)c([O-])c1 ZINC000786980880 1050536380 /nfs/dbraw/zinc/53/63/80/1050536380.db2.gz URHFMSQBVSSHGB-UHFFFAOYSA-N -1 1 303.789 4.193 20 0 DIADMM [O-]c1cc(F)c(-c2cnc3[nH]c(-c4ccccc4)nc3c2)cc1F ZINC001211349323 1050553036 /nfs/dbraw/zinc/55/30/36/1050553036.db2.gz DCQCMOKYVMEXHP-UHFFFAOYSA-N -1 1 323.302 4.276 20 0 DIADMM COC(=O)c1ccc2cc(-c3cc(F)c([O-])cc3F)ccc2c1 ZINC001211338382 1050553159 /nfs/dbraw/zinc/55/31/59/1050553159.db2.gz CVACNPQJZRBCFX-UHFFFAOYSA-N -1 1 314.287 4.277 20 0 DIADMM [O-]c1cc(F)c(-c2ccc(O[C@H]3CCCCO3)cc2)cc1F ZINC001211352977 1050554557 /nfs/dbraw/zinc/55/45/57/1050554557.db2.gz PSOIQOUSWGZQKU-KRWDZBQOSA-N -1 1 306.308 4.243 20 0 DIADMM COc1cccc2c(-c3cc(F)c([O-])cc3F)cc(C)nc12 ZINC001211352146 1050554935 /nfs/dbraw/zinc/55/49/35/1050554935.db2.gz IFDFCRLRSJOROS-UHFFFAOYSA-N -1 1 301.292 4.203 20 0 DIADMM CCN(Cc1ccc(Cl)cc1)Cc1cc(F)c([O-])cc1F ZINC001144657954 1050643312 /nfs/dbraw/zinc/64/33/12/1050643312.db2.gz ONKGLFHVLSLAFZ-UHFFFAOYSA-N -1 1 311.759 4.346 20 0 DIADMM [O-]c1c(F)cc(Nc2ccccc2OC(F)(F)F)cc1F ZINC001213379264 1050644842 /nfs/dbraw/zinc/64/48/42/1050644842.db2.gz JQEGKUCMPQJXIV-UHFFFAOYSA-N -1 1 305.202 4.313 20 0 DIADMM [O-]c1c(F)cc(Nc2cc(OC(F)(F)F)ccc2O)cc1F ZINC001213388884 1050646436 /nfs/dbraw/zinc/64/64/36/1050646436.db2.gz QZNRDFRALCYGDL-UHFFFAOYSA-N -1 1 321.201 4.018 20 0 DIADMM COc1ccc([C@H]2CCCN2Cc2cc(F)c([O-])cc2F)cc1 ZINC001144667068 1050646421 /nfs/dbraw/zinc/64/64/21/1050646421.db2.gz QTBCNHHUNQZPFJ-QGZVFWFLSA-N -1 1 319.351 4.016 20 0 DIADMM C/C(=C\CN1CCC[C@@H]1c1ccc(Cl)c(Cl)c1)C(=O)[O-] ZINC000846237271 1050700567 /nfs/dbraw/zinc/70/05/67/1050700567.db2.gz CEFFOEDEAJMXDX-OAUONFCTSA-N -1 1 314.212 4.161 20 0 DIADMM COc1ccccc1-c1ccc([C@H](C)[N-]C(=O)C(F)(F)F)cc1 ZINC000741726603 1050732868 /nfs/dbraw/zinc/73/28/68/1050732868.db2.gz BFCFXSRGRSVFHE-NSHDSACASA-N -1 1 323.314 4.102 20 0 DIADMM CC(C)c1ccccc1CNCc1ccc(C(=O)[O-])c(C2CC2)n1 ZINC000846778818 1050749126 /nfs/dbraw/zinc/74/91/26/1050749126.db2.gz BKPYYALTAXPBDA-UHFFFAOYSA-N -1 1 324.424 4.070 20 0 DIADMM [O-]c1c(Br)c(F)ccc1Nc1cnccc1C1CC1 ZINC001213881421 1050773579 /nfs/dbraw/zinc/77/35/79/1050773579.db2.gz WCBOYBOPQTZQMH-UHFFFAOYSA-N -1 1 323.165 4.310 20 0 DIADMM [O-]c1cc(Cl)c(Nc2c(F)cc(CO)cc2F)cc1Cl ZINC001214096655 1050818875 /nfs/dbraw/zinc/81/88/75/1050818875.db2.gz DLZKOYKYTUZJQQ-UHFFFAOYSA-N -1 1 320.122 4.213 20 0 DIADMM CC(C)(CNC(=O)c1cc2ccccc2cc1[O-])c1ccccc1 ZINC001146467222 1050823075 /nfs/dbraw/zinc/82/30/75/1050823075.db2.gz ZPYXZNTZSKYQLD-UHFFFAOYSA-N -1 1 319.404 4.253 20 0 DIADMM Cc1ccc([C@H](C)CNC(=O)c2ccc3ccccc3c2[O-])cc1 ZINC001147211550 1050866855 /nfs/dbraw/zinc/86/68/55/1050866855.db2.gz WUPXPLLTAWPFCC-OAHLLOKOSA-N -1 1 319.404 4.387 20 0 DIADMM Cc1cccc([C@@H]2CCCN2C(=O)c2ccc(F)c([O-])c2)c1C ZINC001147538088 1050892633 /nfs/dbraw/zinc/89/26/33/1050892633.db2.gz KFUBIQCNGNTVJQ-KRWDZBQOSA-N -1 1 313.372 4.125 20 0 DIADMM [O-]c1c(F)cc(Nc2cccc(Cl)c2CO)cc1Cl ZINC001214492212 1050922967 /nfs/dbraw/zinc/92/29/67/1050922967.db2.gz TVWPQIOHWKUWKU-UHFFFAOYSA-N -1 1 302.132 4.074 20 0 DIADMM [O-]c1c(F)cc(Nc2cnn(Cc3ccccc3)c2)cc1Cl ZINC001214480489 1050917458 /nfs/dbraw/zinc/91/74/58/1050917458.db2.gz SHNVREHIJCOJQR-UHFFFAOYSA-N -1 1 317.751 4.173 20 0 DIADMM [O-]c1c(F)cc(Nc2ccnn2-c2ccccc2F)cc1Cl ZINC001214484457 1050917755 /nfs/dbraw/zinc/91/77/55/1050917755.db2.gz LAMQIGJJJWMISJ-UHFFFAOYSA-N -1 1 321.714 4.253 20 0 DIADMM Cc1nc(Cl)nc(Cl)c1Nc1cc(F)c([O-])c(Cl)c1 ZINC001214479706 1050918504 /nfs/dbraw/zinc/91/85/04/1050918504.db2.gz DQFDMVBUFOJMIY-UHFFFAOYSA-N -1 1 322.554 4.334 20 0 DIADMM COc1cccc(C(C)=O)c1Nc1cc(F)c([O-])c(Cl)c1 ZINC001214489296 1050919888 /nfs/dbraw/zinc/91/98/88/1050919888.db2.gz APUWLHDKCXPTKX-UHFFFAOYSA-N -1 1 309.724 4.140 20 0 DIADMM [O-]c1c(F)cc(Nc2c(Cl)cccc2CO)cc1Cl ZINC001214488601 1050920216 /nfs/dbraw/zinc/92/02/16/1050920216.db2.gz HYMSTLCMEMRNHM-UHFFFAOYSA-N -1 1 302.132 4.074 20 0 DIADMM COc1cccc2cc(Nc3cc(F)c([O-])c(Cl)c3)cnc21 ZINC001214484874 1050920709 /nfs/dbraw/zinc/92/07/09/1050920709.db2.gz QXCLVWAARUIYAF-UHFFFAOYSA-N -1 1 318.735 4.485 20 0 DIADMM [O-]c1c(F)cc(Nc2ccc(-c3ccccn3)nc2)cc1Cl ZINC001214486720 1050920932 /nfs/dbraw/zinc/92/09/32/1050920932.db2.gz WLOHCMDQDVXKAS-UHFFFAOYSA-N -1 1 315.735 4.385 20 0 DIADMM COc1ccc(C(C)=O)c(Nc2cc(F)c([O-])c(Cl)c2)c1 ZINC001214492325 1050921869 /nfs/dbraw/zinc/92/18/69/1050921869.db2.gz ZDOALVUVQIQGSZ-UHFFFAOYSA-N -1 1 309.724 4.140 20 0 DIADMM CC(C)c1nnc([N-]c2cc(Cl)cc(OC(F)(F)F)c2)o1 ZINC001214523219 1050932179 /nfs/dbraw/zinc/93/21/79/1050932179.db2.gz MSTMKQACCYPINI-UHFFFAOYSA-N -1 1 321.686 4.489 20 0 DIADMM Cc1csc(NC(=O)c2ccc(C(F)(F)F)cc2[O-])c1 ZINC001148790517 1050972390 /nfs/dbraw/zinc/97/23/90/1050972390.db2.gz NYHGRRAXLOFEIY-UHFFFAOYSA-N -1 1 301.289 4.033 20 0 DIADMM C[C@H]1CCCCN(C(=O)c2cccc(-c3ccccc3)c2[O-])C1 ZINC001148867015 1050979156 /nfs/dbraw/zinc/97/91/56/1050979156.db2.gz KEUCDSOVVZEGFH-HNNXBMFYSA-N -1 1 309.409 4.321 20 0 DIADMM O=C(N[C@@H]1CCCC[C@H]1F)c1cccc(-c2ccccc2)c1[O-] ZINC001148868897 1050979931 /nfs/dbraw/zinc/97/99/31/1050979931.db2.gz FFKCIPAASILLPI-IAGOWNOFSA-N -1 1 313.372 4.070 20 0 DIADMM CN(C[C@@H]1CC1(C)C)C(=O)c1cccc(-c2ccccc2)c1[O-] ZINC001148866424 1050980059 /nfs/dbraw/zinc/98/00/59/1050980059.db2.gz ILINNTMGBZCKGB-HNNXBMFYSA-N -1 1 309.409 4.177 20 0 DIADMM CCCC[C@@H](CCC)NC(=O)c1ncc2ccccc2c1[O-] ZINC001148998775 1050983403 /nfs/dbraw/zinc/98/34/03/1050983403.db2.gz ZRJRCIDNVLEWOT-CQSZACIVSA-N -1 1 300.402 4.029 20 0 DIADMM Cc1c(Cl)cc(F)c([N-]C(=O)c2nc(Cl)cs2)c1F ZINC000790964482 1051011178 /nfs/dbraw/zinc/01/11/78/1051011178.db2.gz RCEVRPKHTFGDRZ-UHFFFAOYSA-N -1 1 323.151 4.289 20 0 DIADMM CC(=O)c1cccc(NC(=O)c2cc3sccc3c([O-])c2)c1 ZINC000791291771 1051038542 /nfs/dbraw/zinc/03/85/42/1051038542.db2.gz CLRXJKQNVGCVJG-UHFFFAOYSA-N -1 1 311.362 4.062 20 0 DIADMM COc1cc(C(F)(F)F)ccc1-c1ccc([O-])c(F)c1F ZINC001243342314 1051068323 /nfs/dbraw/zinc/06/83/23/1051068323.db2.gz GOHORRIDDPQBBS-UHFFFAOYSA-N -1 1 304.214 4.365 20 0 DIADMM CCOc1ccc(-c2nc(-c3cccc(CC)c3)no2)c([O-])c1 ZINC001215241456 1051129937 /nfs/dbraw/zinc/12/99/37/1051129937.db2.gz YNBHSMPHCRATSB-UHFFFAOYSA-N -1 1 310.353 4.070 20 0 DIADMM O=C(C[C@@H]1CCC[C@H](C(F)(F)F)C1)Nc1cccc(F)c1[O-] ZINC001171632504 1051174238 /nfs/dbraw/zinc/17/42/38/1051174238.db2.gz DBLJSVUJVNNOAJ-ZJUUUORDSA-N -1 1 319.298 4.229 20 0 DIADMM O=C(C[C@@H]1CCC[C@@H](C(F)(F)F)C1)Nc1cccc(F)c1[O-] ZINC001171632501 1051174461 /nfs/dbraw/zinc/17/44/61/1051174461.db2.gz DBLJSVUJVNNOAJ-NXEZZACHSA-N -1 1 319.298 4.229 20 0 DIADMM CC(C)=CCOc1cccc(C(=O)Nc2cccc(F)c2[O-])c1 ZINC001171632601 1051175504 /nfs/dbraw/zinc/17/55/04/1051175504.db2.gz HXILBXHDAJTYLJ-UHFFFAOYSA-N -1 1 315.344 4.129 20 0 DIADMM C[C@@H](Cc1ccccc1Cl)C(=O)Nc1cccc(F)c1[O-] ZINC001171638071 1051193677 /nfs/dbraw/zinc/19/36/77/1051193677.db2.gz SFJDUUSCKGAAFF-JTQLQIEISA-N -1 1 307.752 4.002 20 0 DIADMM CC(C)(CCC(=O)Nc1cccc(F)c1[O-])c1ccccc1 ZINC001171638266 1051195105 /nfs/dbraw/zinc/19/51/05/1051195105.db2.gz UKBLUCIAFISUAG-UHFFFAOYSA-N -1 1 301.361 4.228 20 0 DIADMM CCOc1c(Nc2cc(F)c([O-])c(F)c2)ccc(F)c1F ZINC001215417478 1051195107 /nfs/dbraw/zinc/19/51/07/1051195107.db2.gz MKVYODKSBCESIF-UHFFFAOYSA-N -1 1 301.239 4.091 20 0 DIADMM [O-]c1cc(F)c(Nc2cc(Cl)c(Cl)cc2O)cc1F ZINC001215573978 1051254476 /nfs/dbraw/zinc/25/44/76/1051254476.db2.gz URUOWFWHHGPUNB-UHFFFAOYSA-N -1 1 306.095 4.426 20 0 DIADMM Cc1cc(Br)cc(Nc2cc(F)c([O-])cc2F)c1 ZINC001215573559 1051254904 /nfs/dbraw/zinc/25/49/04/1051254904.db2.gz MVGWXPDPPNJHAN-UHFFFAOYSA-N -1 1 314.129 4.485 20 0 DIADMM Cc1c(Br)cccc1Nc1cc(F)c([O-])cc1F ZINC001215571490 1051250691 /nfs/dbraw/zinc/25/06/91/1051250691.db2.gz FIAZNHVNBMGWFX-UHFFFAOYSA-N -1 1 314.129 4.485 20 0 DIADMM [O-]c1cc(F)c(Nc2ccc(Br)c(F)c2)cc1F ZINC001215572046 1051252518 /nfs/dbraw/zinc/25/25/18/1051252518.db2.gz UKQRZEWMNNHPGL-UHFFFAOYSA-N -1 1 318.092 4.316 20 0 DIADMM CC1(C)CC(=O)Nc2cc(Nc3cc(F)c([O-])cc3F)ccc21 ZINC001215574416 1051253350 /nfs/dbraw/zinc/25/33/50/1051253350.db2.gz SNECMXQFJMXROX-UHFFFAOYSA-N -1 1 318.323 4.034 20 0 DIADMM [O-]c1cc(F)c(Nc2ccc(Cl)c3nsnc32)cc1F ZINC001215576416 1051253648 /nfs/dbraw/zinc/25/36/48/1051253648.db2.gz ZVVDOMYSRLHIRJ-UHFFFAOYSA-N -1 1 313.716 4.072 20 0 DIADMM Nc1cc(F)c(C(F)(F)F)cc1Nc1cc(F)c([O-])cc1F ZINC001215574531 1051254137 /nfs/dbraw/zinc/25/41/37/1051254137.db2.gz YJFYLOHIWCKMFI-UHFFFAOYSA-N -1 1 322.208 4.154 20 0 DIADMM CCCOc1c(F)cc(F)c([N-]c2noc3cccnc32)c1F ZINC001212647363 1051324043 /nfs/dbraw/zinc/32/40/43/1051324043.db2.gz XRQUITLVSJSOIV-UHFFFAOYSA-N -1 1 323.274 4.173 20 0 DIADMM [O-]c1c(Cl)nccc1Nc1ccc(C2CCOCC2)cc1 ZINC001212652176 1051347185 /nfs/dbraw/zinc/34/71/85/1051347185.db2.gz BACMYVSZKDBHEB-UHFFFAOYSA-N -1 1 304.777 4.078 20 0 DIADMM [O-]c1ccc(F)cc1-c1nc(-c2ccc(Cl)c(F)c2)no1 ZINC001215769785 1051357782 /nfs/dbraw/zinc/35/77/82/1051357782.db2.gz RSZQSJXHRNUXIC-UHFFFAOYSA-N -1 1 308.671 4.041 20 0 DIADMM CC(C)Oc1cnc(F)c(Nc2cc([O-])c(Cl)cc2F)c1 ZINC001215782391 1051366755 /nfs/dbraw/zinc/36/67/55/1051366755.db2.gz WYULDZKVKBBIBC-UHFFFAOYSA-N -1 1 314.719 4.250 20 0 DIADMM CCCOc1ccccc1[C@H](CC(C)C)[N-]C(=O)C(F)(F)F ZINC000746360787 1051383583 /nfs/dbraw/zinc/38/35/83/1051383583.db2.gz MWOFZCMJSYFMED-ZDUSSCGKSA-N -1 1 317.351 4.241 20 0 DIADMM Cc1cccc(-c2noc(-c3ccc([O-])cc3F)n2)c1Cl ZINC001215826057 1051390401 /nfs/dbraw/zinc/39/04/01/1051390401.db2.gz DVNINIOICUVPSR-UHFFFAOYSA-N -1 1 304.708 4.210 20 0 DIADMM CSc1ccc(F)c(Nc2cc(F)c([O-])c(F)c2)c1F ZINC001215838288 1051402383 /nfs/dbraw/zinc/40/23/83/1051402383.db2.gz DDGAGEZTUPVXJI-UHFFFAOYSA-N -1 1 303.280 4.414 20 0 DIADMM [O-]c1cc(-c2nc(-c3cc(Cl)ccc3F)no2)ccc1F ZINC001215839409 1051402448 /nfs/dbraw/zinc/40/24/48/1051402448.db2.gz RIAAGMLYMCFNPZ-UHFFFAOYSA-N -1 1 308.671 4.041 20 0 DIADMM [O-]c1cc(-c2nc(-c3ccccc3C(F)(F)F)no2)ccc1F ZINC001215838459 1051402999 /nfs/dbraw/zinc/40/29/99/1051402999.db2.gz DHCJCDVDOIUDSE-UHFFFAOYSA-N -1 1 324.233 4.267 20 0 DIADMM Cc1cc(Cl)cc(-c2noc(-c3ccc(F)c([O-])c3)n2)c1 ZINC001215842520 1051407718 /nfs/dbraw/zinc/40/77/18/1051407718.db2.gz MDIWYSZWPJUVPV-UHFFFAOYSA-N -1 1 304.708 4.210 20 0 DIADMM COc1cc(Nc2ccc(-n3ccc(=O)[n-]3)cc2)ccc1C1CC1 ZINC001216254195 1051660212 /nfs/dbraw/zinc/66/02/12/1051660212.db2.gz BPRGLQBTAVNLOU-UHFFFAOYSA-N -1 1 321.380 4.208 20 0 DIADMM [O-]c1c(Cl)cc(Cl)cc1Nc1ccc(CO)cc1F ZINC001216273827 1051668160 /nfs/dbraw/zinc/66/81/60/1051668160.db2.gz HDKLJDRSTPSNLA-UHFFFAOYSA-N -1 1 302.132 4.074 20 0 DIADMM Cc1c(Cl)cc(Nc2ccc(CO)cc2F)c([O-])c1Cl ZINC001216276680 1051670499 /nfs/dbraw/zinc/67/04/99/1051670499.db2.gz LSXONSTUQWBGCS-UHFFFAOYSA-N -1 1 316.159 4.382 20 0 DIADMM Cc1nocc1[N-]C(=O)c1csc(-c2ccc(Cl)cc2)n1 ZINC001130354063 1051682125 /nfs/dbraw/zinc/68/21/25/1051682125.db2.gz BWTLGFWYXFYWOW-UHFFFAOYSA-N -1 1 319.773 4.012 20 0 DIADMM CC(C)Oc1ccccc1-c1noc(-c2cc([O-])cc(F)c2)n1 ZINC001216339392 1051706508 /nfs/dbraw/zinc/70/65/08/1051706508.db2.gz HAOCDDGVBKUBOR-UHFFFAOYSA-N -1 1 314.316 4.036 20 0 DIADMM Cc1ccc(Cl)c(-c2noc(-c3cc([O-])cc(F)c3)n2)c1 ZINC001216339784 1051708893 /nfs/dbraw/zinc/70/88/93/1051708893.db2.gz MKIPCSSYNGBSRG-UHFFFAOYSA-N -1 1 304.708 4.210 20 0 DIADMM CCc1cc(=O)[n-]c(SCc2ccc(CC(C)C)cc2)n1 ZINC000767057247 1051750729 /nfs/dbraw/zinc/75/07/29/1051750729.db2.gz HYMOUDSWLVFBTD-UHFFFAOYSA-N -1 1 302.443 4.235 20 0 DIADMM O=C(Nc1ccc(-c2ccccc2)cc1)c1ccc([O-])c(F)c1 ZINC000767245570 1051782433 /nfs/dbraw/zinc/78/24/33/1051782433.db2.gz IFLUTAPYAWMMQW-UHFFFAOYSA-N -1 1 307.324 4.451 20 0 DIADMM O=C(Nc1ccc(SC(F)F)cc1)c1ccc([O-])c(F)c1 ZINC000767249107 1051783214 /nfs/dbraw/zinc/78/32/14/1051783214.db2.gz RRUQGDLMZHXEPV-UHFFFAOYSA-N -1 1 313.300 4.098 20 0 DIADMM CCn1ncc2cc(Nc3cc([O-])c(Cl)cc3F)ccc21 ZINC001216590394 1051830447 /nfs/dbraw/zinc/83/04/47/1051830447.db2.gz CTSUCXKYWDOGKJ-UHFFFAOYSA-N -1 1 305.740 4.298 20 0 DIADMM [O-]c1c(Br)c(F)ccc1Nc1ccc(F)c(F)c1 ZINC001173869319 1051840705 /nfs/dbraw/zinc/84/07/05/1051840705.db2.gz MBMRZKGXAFJVEX-UHFFFAOYSA-N -1 1 318.092 4.316 20 0 DIADMM [O-]c1c(Br)c(F)ccc1NC=Cc1ccccc1 ZINC001173872820 1051842802 /nfs/dbraw/zinc/84/28/02/1051842802.db2.gz AIKYLLLHMVDKDZ-CMDGGOBGSA-N -1 1 308.150 4.377 20 0 DIADMM CC(=O)c1ccc(Nc2ccc(F)c(Br)c2[O-])cc1 ZINC001173898950 1051864667 /nfs/dbraw/zinc/86/46/67/1051864667.db2.gz TUJOOLXZUGVWNS-UHFFFAOYSA-N -1 1 324.149 4.240 20 0 DIADMM COc1ccc(Nc2ccc(Cl)c(Cl)c2[O-])cc1OC ZINC001173887823 1051890350 /nfs/dbraw/zinc/89/03/50/1051890350.db2.gz BTYZLMKHGZUHNH-UHFFFAOYSA-N -1 1 314.168 4.460 20 0 DIADMM Cc1ccc(-c2noc(-c3c(F)ccc([O-])c3F)n2)cc1Cl ZINC001216923313 1051910505 /nfs/dbraw/zinc/91/05/05/1051910505.db2.gz ZRIDNIBWRDPHIB-UHFFFAOYSA-N -1 1 322.698 4.349 20 0 DIADMM Cc1cc(-c2noc(-c3c(F)ccc([O-])c3F)n2)cc(C)c1F ZINC001216922811 1051911687 /nfs/dbraw/zinc/91/16/87/1051911687.db2.gz TVOWPQIULOXKHT-UHFFFAOYSA-N -1 1 320.270 4.143 20 0 DIADMM CC(=O)Nc1ccccc1Nc1cc(Cl)cc(Cl)c1[O-] ZINC001173996208 1051924253 /nfs/dbraw/zinc/92/42/53/1051924253.db2.gz MOBOWRVEHWJYBN-UHFFFAOYSA-N -1 1 311.168 4.401 20 0 DIADMM Cc1cccc(-c2noc(-c3c(C)cc(O)cc3[O-])n2)c1Cl ZINC001216986704 1051927371 /nfs/dbraw/zinc/92/73/71/1051927371.db2.gz LGHODQWPEMNDHQ-UHFFFAOYSA-N -1 1 316.744 4.085 20 0 DIADMM CSc1c(F)cccc1[N-]C(=O)c1ccc(C(F)F)o1 ZINC001131059601 1051931215 /nfs/dbraw/zinc/93/12/15/1051931215.db2.gz ZAZVUVXFUOACAE-UHFFFAOYSA-N -1 1 301.289 4.331 20 0 DIADMM CC(C)Oc1ccccc1NC(=O)Nc1ccc([O-])c(Cl)c1 ZINC000190938086 1051954955 /nfs/dbraw/zinc/95/49/55/1051954955.db2.gz ZCHQZMCUNDCQAV-UHFFFAOYSA-N -1 1 320.776 4.477 20 0 DIADMM CCOc1cccc(NC(=O)Nc2ccc([O-])c(Cl)c2)c1 ZINC000190947789 1051955532 /nfs/dbraw/zinc/95/55/32/1051955532.db2.gz QWNQTGXUXOUJBP-UHFFFAOYSA-N -1 1 306.749 4.088 20 0 DIADMM CCOc1ccc(NC(=O)Nc2ccc([O-])c(Cl)c2)cc1 ZINC000190907024 1051955571 /nfs/dbraw/zinc/95/55/71/1051955571.db2.gz DTNKUNPVINCQEM-UHFFFAOYSA-N -1 1 306.749 4.088 20 0 DIADMM O=C(Nc1ccc([O-])c(Cl)c1)Nc1cc(F)c(F)cc1F ZINC000192214615 1052004836 /nfs/dbraw/zinc/00/48/36/1052004836.db2.gz VZRYZFSSNFKPFN-UHFFFAOYSA-N -1 1 316.666 4.107 20 0 DIADMM COc1c(C)ccc(NC(=O)Nc2ccc([O-])c(Cl)c2)c1C ZINC000192194032 1052005328 /nfs/dbraw/zinc/00/53/28/1052005328.db2.gz YJTYWVVJHOQQOX-UHFFFAOYSA-N -1 1 320.776 4.315 20 0 DIADMM [O-]c1c2ccsc2ccc1-c1nc(-c2cccc(F)c2)no1 ZINC001217514482 1052079180 /nfs/dbraw/zinc/07/91/80/1052079180.db2.gz RSPCSIAVLJVBSR-UHFFFAOYSA-N -1 1 312.325 4.463 20 0 DIADMM Cc1cncc(-c2noc(-c3ccc4sccc4c3[O-])n2)c1 ZINC001217513861 1052079396 /nfs/dbraw/zinc/07/93/96/1052079396.db2.gz BQEUKYDRPYHOKE-UHFFFAOYSA-N -1 1 309.350 4.027 20 0 DIADMM [O-]c1c(F)c(F)ccc1Nc1cccc(N2CCCCC2)c1 ZINC001174304637 1052088292 /nfs/dbraw/zinc/08/82/92/1052088292.db2.gz KJLHSLGPYSRKEV-UHFFFAOYSA-N -1 1 304.340 4.404 20 0 DIADMM C[C@@H]1CCN(C(=O)c2c([O-])cccc2Cl)[C@H]2CCCC[C@H]12 ZINC000769690941 1052092961 /nfs/dbraw/zinc/09/29/61/1052092961.db2.gz ZXHZQBKQHWTJNY-BZPMIXESSA-N -1 1 307.821 4.086 20 0 DIADMM [O-]c1cc(Nc2ccc(C(F)(F)F)nc2)c(F)cc1Cl ZINC001174312175 1052093107 /nfs/dbraw/zinc/09/31/07/1052093107.db2.gz XFKJYCGCWZZYQP-UHFFFAOYSA-N -1 1 306.646 4.342 20 0 DIADMM Cc1cc(Cl)ncc1NC(=O)c1cc2ccccc2cc1[O-] ZINC000769724196 1052098061 /nfs/dbraw/zinc/09/80/61/1052098061.db2.gz VOHXVISNOHEZCN-UHFFFAOYSA-N -1 1 312.756 4.155 20 0 DIADMM Cc1ccc2ccc(-c3nc(-c4ccccc4F)no3)c([O-])c2n1 ZINC001217582986 1052100848 /nfs/dbraw/zinc/10/08/48/1052100848.db2.gz BQMMWGJCVUNFPV-UHFFFAOYSA-N -1 1 321.311 4.105 20 0 DIADMM Cc1ccc2ccc(-c3nc(-c4ccc(F)cc4)no3)c([O-])c2n1 ZINC001217581300 1052100933 /nfs/dbraw/zinc/10/09/33/1052100933.db2.gz BKWHQBQEOJCBOI-UHFFFAOYSA-N -1 1 321.311 4.105 20 0 DIADMM Cn1cnc2ccc(Nc3c(Cl)ccc([O-])c3Cl)cc21 ZINC001174348696 1052113522 /nfs/dbraw/zinc/11/35/22/1052113522.db2.gz LGGKECUKMZXMCG-UHFFFAOYSA-N -1 1 308.168 4.329 20 0 DIADMM Cc1noc(-c2ccccc2)c1[N-]C(=O)c1ncoc1C(C)C ZINC000770012835 1052133690 /nfs/dbraw/zinc/13/36/90/1052133690.db2.gz QOJQAGUCVIZTTP-UHFFFAOYSA-N -1 1 311.341 4.014 20 0 DIADMM C=COc1ccc(NC(=O)Nc2ccc([O-])c(Cl)c2)cc1 ZINC001219079695 1052271463 /nfs/dbraw/zinc/27/14/63/1052271463.db2.gz ICALAGNNWORTNJ-UHFFFAOYSA-N -1 1 304.733 4.212 20 0 DIADMM Cc1csc(C(=O)Nc2ccc([O-])c(Cl)c2)c1Cl ZINC000235966913 1052421393 /nfs/dbraw/zinc/42/13/93/1052421393.db2.gz TWAPPEMVOGURRJ-UHFFFAOYSA-N -1 1 302.182 4.321 20 0 DIADMM COc1cccc(-c2cc(F)c([O-])cc2F)c1C(F)(F)F ZINC001222082702 1052439309 /nfs/dbraw/zinc/43/93/09/1052439309.db2.gz GONZEUVUWQSXOE-UHFFFAOYSA-N -1 1 304.214 4.365 20 0 DIADMM [O-]c1cc(F)c(-c2ccc(O[C@H]3CCCCO3)cc2F)cc1F ZINC001222083283 1052439927 /nfs/dbraw/zinc/43/99/27/1052439927.db2.gz XXFBHQMSLMTFKV-KRWDZBQOSA-N -1 1 324.298 4.382 20 0 DIADMM Cc1ccc(S(=O)(=O)[N-]c2ccccc2C(C)C)cc1F ZINC000055551488 1052533596 /nfs/dbraw/zinc/53/35/96/1052533596.db2.gz RLBLMJRBZDMIEW-UHFFFAOYSA-N -1 1 307.390 4.058 20 0 DIADMM CCCCC[C@@H](OCCCC[P@](=O)([O-])O)c1ccccc1 ZINC001225019136 1052744854 /nfs/dbraw/zinc/74/48/54/1052744854.db2.gz SOQYOABMNSNZMD-MRXNPFEDSA-N -1 1 314.362 4.283 20 0 DIADMM CCN(c1ccc(NC(=O)c2ccc([O-])cc2F)cc1)C(C)C ZINC000154622330 1052775373 /nfs/dbraw/zinc/77/53/73/1052775373.db2.gz GATCIDHHZPCJEK-UHFFFAOYSA-N -1 1 316.376 4.018 20 0 DIADMM O=C(c1ccc([O-])cc1)c1ccc(OC(C2CC2)C2CC2)cc1 ZINC001225806932 1052833628 /nfs/dbraw/zinc/83/36/28/1052833628.db2.gz FVHSLAINVJHFFJ-UHFFFAOYSA-N -1 1 308.377 4.191 20 0 DIADMM O=C(c1ccc([O-])cc1)c1ccc(O[C@@H]2CCC(F)(F)C2)cc1 ZINC001225808698 1052833845 /nfs/dbraw/zinc/83/38/45/1052833845.db2.gz QSOXFPAOKBARSO-MRXNPFEDSA-N -1 1 318.319 4.190 20 0 DIADMM CC[C@@H](C)Oc1cc([O-])ccc1C(=O)Cc1ccc(OC)cc1 ZINC001226544596 1052909653 /nfs/dbraw/zinc/90/96/53/1052909653.db2.gz RUJPHEVNPPLNPR-CYBMUJFWSA-N -1 1 314.381 4.004 20 0 DIADMM Cc1ccc([C@@H](C)NC(=O)c2c([O-])cccc2Cl)c(C)c1 ZINC000920444821 1052939473 /nfs/dbraw/zinc/93/94/73/1052939473.db2.gz LROACRWAQGICJZ-GFCCVEGCSA-N -1 1 303.789 4.153 20 0 DIADMM Cc1ccc(CCCNC(=O)c2c([O-])cccc2Cl)c(C)c1 ZINC000920429901 1052940988 /nfs/dbraw/zinc/94/09/88/1052940988.db2.gz LHCYZWXABACHGA-UHFFFAOYSA-N -1 1 317.816 4.025 20 0 DIADMM C[C@H](Oc1[n-]c(=S)ncc1F)c1cc2ccccc2s1 ZINC001227385332 1052986943 /nfs/dbraw/zinc/98/69/43/1052986943.db2.gz JYWOQMIAELMWEE-QMMMGPOBSA-N -1 1 306.387 4.259 20 0 DIADMM C[C@H](Oc1cc(Cl)c([O-])cc1Cl)c1cnc2ccccn21 ZINC001227640636 1053006152 /nfs/dbraw/zinc/00/61/52/1053006152.db2.gz FKWGAQBGDBXLPH-VIFPVBQESA-N -1 1 323.179 4.487 20 0 DIADMM C[C@H](Oc1[n-]c(=O)nc2c1CO[C@@H]2C)c1cccc2ccccc21 ZINC001227712933 1053010077 /nfs/dbraw/zinc/01/00/77/1053010077.db2.gz MVPXXOUHOAGXFV-NWDGAFQWSA-N -1 1 322.364 4.067 20 0 DIADMM CC1(C)[C@@H]2CC[C@@]1(C)[C@H](Oc1[n-]c(=S)nc3cnccc31)C2 ZINC001227881702 1053025124 /nfs/dbraw/zinc/02/51/24/1053025124.db2.gz NUCHYARJTTVHLD-JUKMUDQWSA-N -1 1 315.442 4.281 20 0 DIADMM Cc1ccc([C@@H]2C[C@H]2C(=O)Nc2ccc([O-])c(F)c2F)cc1C ZINC000616101736 1053045664 /nfs/dbraw/zinc/04/56/64/1053045664.db2.gz UDNLSONBCJFSPV-QWHCGFSZSA-N -1 1 317.335 4.029 20 0 DIADMM C[C@H](Oc1cc([O-])ccc1C(=O)c1ccccc1)c1ccncc1 ZINC001228184738 1053051334 /nfs/dbraw/zinc/05/13/34/1053051334.db2.gz WINHGYFPFNBSJS-AWEZNQCLSA-N -1 1 319.360 4.158 20 0 DIADMM CCCC[C@H](NC(=O)NCc1ccc([O-])c(Cl)c1)C1CCC1 ZINC001313235482 1053097108 /nfs/dbraw/zinc/09/71/08/1053097108.db2.gz BGERKOZHLPUPRG-HNNXBMFYSA-N -1 1 324.852 4.204 20 0 DIADMM CCc1cc2c(CNc3cc(C)cc(C)c3)cc(=O)oc2cc1[O-] ZINC000069056047 1053103572 /nfs/dbraw/zinc/10/35/72/1053103572.db2.gz NDVTVBFPNPBOHB-UHFFFAOYSA-N -1 1 323.392 4.290 20 0 DIADMM CCC(=O)c1c(O)cc([O-])cc1O[C@H](C)c1ccc(C)cc1C ZINC001228553381 1053133078 /nfs/dbraw/zinc/13/30/78/1053133078.db2.gz BORUXIIYMMCBLB-CYBMUJFWSA-N -1 1 314.381 4.447 20 0 DIADMM CCC(=O)c1c(O)cc([O-])cc1O[C@H](c1ccccc1)C(C)C ZINC001228556347 1053134283 /nfs/dbraw/zinc/13/42/83/1053134283.db2.gz NVISKFHFTJZUTC-IBGZPJMESA-N -1 1 314.381 4.467 20 0 DIADMM CCC(=O)c1c(O)cc([O-])cc1O[C@@H](C)c1ccccc1C ZINC001228556552 1053134644 /nfs/dbraw/zinc/13/46/44/1053134644.db2.gz PWXOIHXNYYTZRJ-LBPRGKRZSA-N -1 1 300.354 4.139 20 0 DIADMM CC(=O)c1c(C)cccc1OC(=C([O-])c1ccco1)c1ccco1 ZINC001228994598 1053220256 /nfs/dbraw/zinc/22/02/56/1053220256.db2.gz ZWFHLMFDPSYSSW-IBGZPJMESA-N -1 1 324.332 4.387 20 0 DIADMM CCc1ccc2nc(-c3ccc4sccc4c3)[n-]c(=O)c2c1 ZINC001319163351 1053223398 /nfs/dbraw/zinc/22/33/98/1053223398.db2.gz IKDZDHDPDRXWHU-UHFFFAOYSA-N -1 1 306.390 4.367 20 0 DIADMM O=C([N-]c1csnc1-c1ccccc1)c1scnc1Cl ZINC001360451704 1053228353 /nfs/dbraw/zinc/22/83/53/1053228353.db2.gz XAPBLQNNDVJIKI-UHFFFAOYSA-N -1 1 321.814 4.172 20 0 DIADMM CC(C)[C@H](Oc1cc([O-])cc2oc(=O)ccc12)c1ccccc1 ZINC001229135956 1053255556 /nfs/dbraw/zinc/25/55/56/1053255556.db2.gz SMWPLBZVRMJVPM-IBGZPJMESA-N -1 1 310.349 4.275 20 0 DIADMM COc1cc2ccc(=O)oc2c(O[C@@H](C)CCCC(C)C)c1[O-] ZINC001229214221 1053275587 /nfs/dbraw/zinc/27/55/87/1053275587.db2.gz CMAYDUWTSUNNEZ-LBPRGKRZSA-N -1 1 320.385 4.101 20 0 DIADMM O=C1C[C@@H](c2ccccc2)Oc2cc([O-])cc(OC3CCCC3)c21 ZINC001229230904 1053279870 /nfs/dbraw/zinc/27/98/70/1053279870.db2.gz RLEYDAZRGYBPPM-KRWDZBQOSA-N -1 1 324.376 4.420 20 0 DIADMM CCC[C@H](CC)Oc1cc(O)ccc1C(=O)c1ccc([O-])cc1 ZINC001229295085 1053294522 /nfs/dbraw/zinc/29/45/22/1053294522.db2.gz VIEXYCXNIDXJJW-INIZCTEOSA-N -1 1 314.381 4.286 20 0 DIADMM CCCC1(C(=O)Nc2ccc(Br)c([O-])c2)CCC1 ZINC001321147228 1053395033 /nfs/dbraw/zinc/39/50/33/1053395033.db2.gz AESHMKUWCKOHEP-UHFFFAOYSA-N -1 1 312.207 4.064 20 0 DIADMM Cc1cccc(Cl)c1NC(=S)Nc1cccc(F)c1[O-] ZINC001200195835 1053453895 /nfs/dbraw/zinc/45/38/95/1053453895.db2.gz HMGIOWIHQWSKTD-UHFFFAOYSA-N -1 1 310.781 4.302 20 0 DIADMM CSc1cc(NC(=O)Cc2ccc([O-])c(Cl)c2)ccc1C ZINC001300209554 1053488290 /nfs/dbraw/zinc/48/82/90/1053488290.db2.gz ZNRUNBFUPMOGTD-UHFFFAOYSA-N -1 1 321.829 4.257 20 0 DIADMM Cc1ccc(NC(=S)Nc2cccc(F)c2[O-])c(Cl)c1 ZINC001200335878 1053569712 /nfs/dbraw/zinc/56/97/12/1053569712.db2.gz CCKCZRRLEWFCGK-UHFFFAOYSA-N -1 1 310.781 4.302 20 0 DIADMM [O-]c1cccc(CNc2ccn(C3CCCCC3)n2)c1Cl ZINC001324272392 1053639955 /nfs/dbraw/zinc/63/99/55/1053639955.db2.gz MPDFDTTVQSFUIZ-UHFFFAOYSA-N -1 1 305.809 4.359 20 0 DIADMM Cc1cccc2c1[C@H](Oc1cccnc1-c1ncccc1[O-])CC2 ZINC001231199804 1053699094 /nfs/dbraw/zinc/69/90/94/1053699094.db2.gz FRVYSUHHMJDXML-MRXNPFEDSA-N -1 1 318.376 4.224 20 0 DIADMM CC(C)CCC[C@@H](C)Oc1cccnc1-c1ncccc1[O-] ZINC001231200656 1053700710 /nfs/dbraw/zinc/70/07/10/1053700710.db2.gz RNASUNAJAZLDBO-CQSZACIVSA-N -1 1 300.402 4.443 20 0 DIADMM Cc1ccc2c(c1)[C@@H](Oc1cccnc1-c1ncccc1[O-])CC2 ZINC001231201928 1053700824 /nfs/dbraw/zinc/70/08/24/1053700824.db2.gz OVSNOWASQPQMDK-KRWDZBQOSA-N -1 1 318.376 4.224 20 0 DIADMM C[C@H](CCc1ccccc1)Oc1cccnc1-c1ncccc1[O-] ZINC001231200887 1053701197 /nfs/dbraw/zinc/70/11/97/1053701197.db2.gz TVYXAJYVHOEXST-OAHLLOKOSA-N -1 1 320.392 4.249 20 0 DIADMM O=C(Nc1c([O-])cccc1F)c1ccc(SC2CC2)cc1 ZINC001300487856 1053745794 /nfs/dbraw/zinc/74/57/94/1053745794.db2.gz GEBZXJUXORKVCH-UHFFFAOYSA-N -1 1 303.358 4.038 20 0 DIADMM [O-]c1cc(F)ccc1NC(=S)Nc1ccc(F)c(Cl)c1 ZINC001200587269 1053792595 /nfs/dbraw/zinc/79/25/95/1053792595.db2.gz DKOSGXBERKGDDL-UHFFFAOYSA-N -1 1 314.744 4.133 20 0 DIADMM CC1(CC(=O)Nc2ccc(Br)c([O-])c2)CCCC1 ZINC001327667932 1053869904 /nfs/dbraw/zinc/86/99/04/1053869904.db2.gz FLBBBNHZNVXIIO-UHFFFAOYSA-N -1 1 312.207 4.064 20 0 DIADMM CCC(CC)[C@H](C)C(=O)Nc1ccc(Br)c([O-])c1 ZINC001331336632 1054072803 /nfs/dbraw/zinc/07/28/03/1054072803.db2.gz YKWUNHKNWIVENQ-VIFPVBQESA-N -1 1 314.223 4.166 20 0 DIADMM [O-]c1c(Cl)ccc(CN2CCC[C@@H]3CCC[C@@H]32)c1Cl ZINC001232626751 1054089421 /nfs/dbraw/zinc/08/94/21/1054089421.db2.gz AFQHTEZCSBEARK-GWCFXTLKSA-N -1 1 300.229 4.464 20 0 DIADMM CN(Cc1cccc([O-])c1Cl)[C@H](C1CCC1)C(F)(F)F ZINC001232788737 1054122569 /nfs/dbraw/zinc/12/25/69/1054122569.db2.gz LEJXHJZBIWORTN-CYBMUJFWSA-N -1 1 307.743 4.208 20 0 DIADMM Cc1ccc(F)cc1NC(=O)c1ccc(C(F)(F)F)cc1[O-] ZINC000622275786 1054140469 /nfs/dbraw/zinc/14/04/69/1054140469.db2.gz REIBNPQCSWXQBI-UHFFFAOYSA-N -1 1 313.250 4.111 20 0 DIADMM CC[C@@H]1c2ccccc2CCN1Cc1cc([O-])c(F)c(F)c1 ZINC001232975194 1054163567 /nfs/dbraw/zinc/16/35/67/1054163567.db2.gz GHXMRHUDMZQLCJ-MRXNPFEDSA-N -1 1 303.352 4.180 20 0 DIADMM C[N@H+](Cc1cccc2ccccc21)Cc1cc(Cl)ncc1[O-] ZINC001233036542 1054173121 /nfs/dbraw/zinc/17/31/21/1054173121.db2.gz RRUDMOOANDMYGV-UHFFFAOYSA-N -1 1 312.800 4.226 20 0 DIADMM Fc1ccc([C@H]2CSCCN2Cc2ccc([S-])cc2)cc1 ZINC001233261081 1054218952 /nfs/dbraw/zinc/21/89/52/1054218952.db2.gz ARZRLYDVXPOCBK-QGZVFWFLSA-N -1 1 319.470 4.405 20 0 DIADMM CN(Cc1ccc([S-])cc1)Cc1ncccc1C(F)(F)F ZINC001233259099 1054218999 /nfs/dbraw/zinc/21/89/99/1054218999.db2.gz GMNINSYBRBIEJH-UHFFFAOYSA-N -1 1 312.360 4.021 20 0 DIADMM CC(C)CN(C(=O)c1cc(F)ccc1[O-])c1ccc(Cl)cc1 ZINC000622440494 1054228416 /nfs/dbraw/zinc/22/84/16/1054228416.db2.gz FVRVRHZZNGZSJY-UHFFFAOYSA-N -1 1 321.779 4.488 20 0 DIADMM C[N@@H+](Cc1c(F)ccc(O)c1F)C(C)(C)Cc1ccccc1 ZINC001233396647 1054260444 /nfs/dbraw/zinc/26/04/44/1054260444.db2.gz OBQIQHWCAFEBAE-UHFFFAOYSA-N -1 1 305.368 4.124 20 0 DIADMM Oc1ccc(F)c(CN2CCC[C@H](c3ccccc3)CC2)c1F ZINC001233396060 1054261510 /nfs/dbraw/zinc/26/15/10/1054261510.db2.gz HQNNSNAGMMPRDL-HNNXBMFYSA-N -1 1 317.379 4.440 20 0 DIADMM CCCC(=O)c1ccc([O-])cc1O[C@@H](C)c1ncccc1F ZINC001233649865 1054319574 /nfs/dbraw/zinc/31/95/74/1054319574.db2.gz DRLDRULEAPFYSO-NSHDSACASA-N -1 1 303.333 4.049 20 0 DIADMM CCCC(=O)c1ccc([O-])cc1O[C@@H](C)c1cnc2ccccn21 ZINC001233649142 1054320218 /nfs/dbraw/zinc/32/02/18/1054320218.db2.gz WZIWSTJXFFNBHV-ZDUSSCGKSA-N -1 1 324.380 4.163 20 0 DIADMM CCCC(=O)c1ccc([O-])cc1O[C@H](C)c1cnc2ccccn21 ZINC001233649139 1054320304 /nfs/dbraw/zinc/32/03/04/1054320304.db2.gz WZIWSTJXFFNBHV-CYBMUJFWSA-N -1 1 324.380 4.163 20 0 DIADMM CCCC(=O)c1ccc([O-])cc1O[C@H](C(C)C)C(F)(F)F ZINC001233650210 1054321737 /nfs/dbraw/zinc/32/17/37/1054321737.db2.gz JEHNCBOEXJTPMH-CQSZACIVSA-N -1 1 304.308 4.341 20 0 DIADMM CCCC(=O)c1ccc([O-])cc1O[C@H](c1cccnc1)C1CC1 ZINC001233650165 1054321791 /nfs/dbraw/zinc/32/17/91/1054321791.db2.gz IRLXMGFSTIKYJV-IBGZPJMESA-N -1 1 311.381 4.300 20 0 DIADMM CCCC(=O)c1ccc([O-])cc1O[C@@H](c1cccnc1)C1CC1 ZINC001233650167 1054322695 /nfs/dbraw/zinc/32/26/95/1054322695.db2.gz IRLXMGFSTIKYJV-LJQANCHMSA-N -1 1 311.381 4.300 20 0 DIADMM CC(C)(C)C[C@@H]1CCN(C(=O)c2cc(F)ccc2[O-])C1(C)C ZINC000622710156 1054342896 /nfs/dbraw/zinc/34/28/96/1054342896.db2.gz WWJZVFMLKGXJEP-LBPRGKRZSA-N -1 1 307.409 4.208 20 0 DIADMM O=C(N[C@@H](c1cccs1)C1CC1)c1ccc2ccccc2c1[O-] ZINC001440882545 1054373815 /nfs/dbraw/zinc/37/38/15/1054373815.db2.gz IXNPYAOJVMKPNG-QGZVFWFLSA-N -1 1 323.417 4.488 20 0 DIADMM O=C(N[C@H](c1ccccc1)C1CC1)c1cc2ccccc2cc1[O-] ZINC001441013399 1054379475 /nfs/dbraw/zinc/37/94/75/1054379475.db2.gz SRPMVPIDAAJTQI-HXUWFJFHSA-N -1 1 317.388 4.427 20 0 DIADMM CC(C)CCCCCCNC(=O)Cc1ccc([O-])c(Cl)c1 ZINC001441069661 1054381344 /nfs/dbraw/zinc/38/13/44/1054381344.db2.gz SYRJDLNEYVODQU-UHFFFAOYSA-N -1 1 311.853 4.311 20 0 DIADMM O=C(Nc1cccc(OC2CCCC2)c1)c1cc(F)ccc1[O-] ZINC001441073190 1054381622 /nfs/dbraw/zinc/38/16/22/1054381622.db2.gz JZIOCXQZIKMRRL-UHFFFAOYSA-N -1 1 315.344 4.105 20 0 DIADMM CCN(Cc1ccc2ccccc2c1)C(=O)c1cccc([O-])c1F ZINC001441116283 1054382938 /nfs/dbraw/zinc/38/29/38/1054382938.db2.gz HHOIIHLPMAZQCD-UHFFFAOYSA-N -1 1 323.367 4.347 20 0 DIADMM CCCOc1cccc(NC(=O)Cc2ccc([O-])c(Cl)c2)c1 ZINC001441236210 1054386841 /nfs/dbraw/zinc/38/68/41/1054386841.db2.gz JCLHHXATZSNYBC-UHFFFAOYSA-N -1 1 319.788 4.016 20 0 DIADMM CC(C)(CCNC(=O)c1ccc(Cl)cc1[O-])c1ccccc1 ZINC001442114215 1054412391 /nfs/dbraw/zinc/41/23/91/1054412391.db2.gz WCUGJUDQBQYDQM-UHFFFAOYSA-N -1 1 317.816 4.143 20 0 DIADMM O=C([N-]c1cnoc1)c1ccc(Sc2ccc(Cl)cc2)o1 ZINC001443021910 1054439761 /nfs/dbraw/zinc/43/97/61/1054439761.db2.gz ZVGMQEGFGXLUCN-UHFFFAOYSA-N -1 1 320.757 4.325 20 0 DIADMM O=C(NCCCc1cccc(F)c1)c1ccc2ccccc2c1[O-] ZINC001443540957 1054451896 /nfs/dbraw/zinc/45/18/96/1054451896.db2.gz CHGXJMVCDIJMRN-UHFFFAOYSA-N -1 1 323.367 4.047 20 0 DIADMM O=C(N[C@H]1C[C@@H]1C1CCCCC1)c1ccc2ccccc2c1[O-] ZINC001444973878 1054492671 /nfs/dbraw/zinc/49/26/71/1054492671.db2.gz IIIMQMLPZBHWMQ-MSOLQXFVSA-N -1 1 309.409 4.244 20 0 DIADMM [O-]c1cc(F)c(Cl)cc1-c1cccc(CO[C@@H]2CCOC2)c1 ZINC000623048658 1054521787 /nfs/dbraw/zinc/52/17/87/1054521787.db2.gz UZTOKLSDHZCCIC-CYBMUJFWSA-N -1 1 322.763 4.157 20 0 DIADMM Cc1cccc([C@H](C)NC(=O)c2ccc(C(F)(F)F)c([O-])c2)c1 ZINC001446675999 1054542280 /nfs/dbraw/zinc/54/22/80/1054542280.db2.gz LTRFDDKNXJTEEW-NSHDSACASA-N -1 1 323.314 4.210 20 0 DIADMM CSc1ccc(C)c(NC(=O)c2cc(SC)ccc2[O-])c1 ZINC001446809735 1054547127 /nfs/dbraw/zinc/54/71/27/1054547127.db2.gz WFINPVYCBDEXJC-UHFFFAOYSA-N -1 1 319.451 4.397 20 0 DIADMM Cc1cc(Br)c([O-])c(NC(=O)C2CCC=CCC2)c1 ZINC001446850992 1054549030 /nfs/dbraw/zinc/54/90/30/1054549030.db2.gz VRGCREZEELVHCH-UHFFFAOYSA-N -1 1 324.218 4.148 20 0 DIADMM C[C@H](CCc1ccc(F)cc1)C(=O)Nc1cc([O-])c(F)cc1F ZINC001450899659 1054663365 /nfs/dbraw/zinc/66/33/65/1054663365.db2.gz RWLSRXZPRQMFEP-SNVBAGLBSA-N -1 1 323.314 4.017 20 0 DIADMM CC/C(=C\C(=O)Nc1cc(F)cc(F)c1[O-])c1ccc(C)cc1 ZINC001451740216 1054685960 /nfs/dbraw/zinc/68/59/60/1054685960.db2.gz GRECGLFJZBSMEW-XYOKQWHBSA-N -1 1 317.335 4.411 20 0 DIADMM O=C(Nc1cc(F)cc(F)c1[O-])[C@@H]1CC[C@@H]2CCCC[C@H]2C1 ZINC001451760578 1054686946 /nfs/dbraw/zinc/68/69/46/1054686946.db2.gz WKXOOTFOCNRDNP-SDDRHHMPSA-N -1 1 309.356 4.215 20 0 DIADMM O=C(Nc1cc(F)cc(F)c1[O-])c1cc2cc(Cl)ccc2[nH]1 ZINC001451745414 1054687539 /nfs/dbraw/zinc/68/75/39/1054687539.db2.gz RIWIBNATYIDWCN-UHFFFAOYSA-N -1 1 322.698 4.057 20 0 DIADMM Cc1ccc(N(CC(C)C)C(=O)c2cccc([O-])c2F)c(C)c1 ZINC001452885650 1054720159 /nfs/dbraw/zinc/72/01/59/1054720159.db2.gz LQTSPCJVOOOMTB-UHFFFAOYSA-N -1 1 315.388 4.451 20 0 DIADMM Cc1cc(NC(=O)c2cccc([O-])c2F)cc(C(F)(F)F)c1 ZINC001452983046 1054721409 /nfs/dbraw/zinc/72/14/09/1054721409.db2.gz GVKQJJPKQOWMJA-UHFFFAOYSA-N -1 1 313.250 4.111 20 0 DIADMM O=C(Nc1c([O-])cccc1F)c1ccc(-c2cccs2)o1 ZINC001453011695 1054726264 /nfs/dbraw/zinc/72/62/64/1054726264.db2.gz IFZPUICEAPSLHM-UHFFFAOYSA-N -1 1 303.314 4.105 20 0 DIADMM O=C(c1cc(Cl)ccc1[O-])N1CCC[C@@H](C2CCCCC2)C1 ZINC001454039268 1054755915 /nfs/dbraw/zinc/75/59/15/1054755915.db2.gz RWYVRQJWVKEEKG-CQSZACIVSA-N -1 1 321.848 4.478 20 0 DIADMM CC(C)(NC(=O)c1c([O-])cccc1F)c1ccc2ccccc2c1 ZINC001454356357 1054766272 /nfs/dbraw/zinc/76/62/72/1054766272.db2.gz UBRPLJJZYDZHKN-UHFFFAOYSA-N -1 1 323.367 4.350 20 0 DIADMM Cc1c(Cl)c(-c2cc3nc[nH]c3cc2F)ccc1C(=O)[O-] ZINC001236129502 1054962761 /nfs/dbraw/zinc/96/27/61/1054962761.db2.gz SEAWRYHSHXJBFF-UHFFFAOYSA-N -1 1 304.708 4.029 20 0 DIADMM Cc1nc2cccc(-c3ccc(C(=O)[O-])c(C)c3Cl)c2[nH]1 ZINC001236130130 1054964592 /nfs/dbraw/zinc/96/45/92/1054964592.db2.gz YFPGNIHJZFBXDF-UHFFFAOYSA-N -1 1 300.745 4.198 20 0 DIADMM Cc1noc(-c2ccccc2)c1[N-]C(=O)c1cc(F)ccc1F ZINC000183372471 1055044421 /nfs/dbraw/zinc/04/44/21/1055044421.db2.gz AGOJXFGCSUJACK-UHFFFAOYSA-N -1 1 314.291 4.181 20 0 DIADMM Cc1ccc(F)c(-c2nc(C)nc3sc4c(c32)CCC4)c1[O-] ZINC001236392291 1055089555 /nfs/dbraw/zinc/08/95/55/1055089555.db2.gz QMWAYESQGNFILF-UHFFFAOYSA-N -1 1 314.385 4.309 20 0 DIADMM COc1cc(OC)c2ccnc(-c3c(F)ccc(C)c3[O-])c2c1 ZINC001236390022 1055089651 /nfs/dbraw/zinc/08/96/51/1055089651.db2.gz CJMTXIHPRNANDD-UHFFFAOYSA-N -1 1 313.328 4.072 20 0 DIADMM Cc1sc2nc(C)nc(-c3c(F)ccc(C)c3[O-])c2c1C ZINC001236394706 1055091616 /nfs/dbraw/zinc/09/16/16/1055091616.db2.gz ZPKUNCONKPLAQN-UHFFFAOYSA-N -1 1 302.374 4.437 20 0 DIADMM COC(=O)c1nc2cc(-c3cc(C)cc(C)c3Cl)ccc2[n-]1 ZINC001236549656 1055177918 /nfs/dbraw/zinc/17/79/18/1055177918.db2.gz VKPUSUWPGCPWCC-UHFFFAOYSA-N -1 1 314.772 4.287 20 0 DIADMM COC(=O)c1nc2ccc(-c3cc(C)cc(C)c3Cl)cc2[n-]1 ZINC001236549656 1055177923 /nfs/dbraw/zinc/17/79/23/1055177923.db2.gz VKPUSUWPGCPWCC-UHFFFAOYSA-N -1 1 314.772 4.287 20 0 DIADMM Cc1ccc(SCCC(=O)Nc2cccc(F)c2[O-])cc1C ZINC001587385629 1055282987 /nfs/dbraw/zinc/28/29/87/1055282987.db2.gz YDZJRXMBFYUIKT-UHFFFAOYSA-N -1 1 319.401 4.269 20 0 DIADMM O=C(Nc1cccc(F)c1[O-])c1nc2ccccc2cc1C1CC1 ZINC001587394437 1055285061 /nfs/dbraw/zinc/28/50/61/1055285061.db2.gz XCDRIZGFFKWZPI-UHFFFAOYSA-N -1 1 322.339 4.209 20 0 DIADMM CC(C)CC(C)(C)CNC(=O)c1ccc(C(F)(F)F)cc1[O-] ZINC001587580884 1055328270 /nfs/dbraw/zinc/32/82/70/1055328270.db2.gz ZMMRSYRUKQLIKD-UHFFFAOYSA-N -1 1 317.351 4.213 20 0 DIADMM CCCCCC[C@@H](C)NC(=O)c1ccc(C(F)(F)F)c([O-])c1 ZINC001587878140 1055386690 /nfs/dbraw/zinc/38/66/90/1055386690.db2.gz RJVXPBBGAKMQKM-LLVKDONJSA-N -1 1 317.351 4.500 20 0 DIADMM CCCCCC[C@H](C)NC(=O)c1c([O-])cnc2c(F)cccc21 ZINC001587877490 1055386964 /nfs/dbraw/zinc/38/69/64/1055386964.db2.gz HBFIAOGWPXWOET-LBPRGKRZSA-N -1 1 318.392 4.168 20 0 DIADMM CCN(Cc1cccs1)C(=O)c1ccc2ccccc2c1[O-] ZINC000386013966 1055403583 /nfs/dbraw/zinc/40/35/83/1055403583.db2.gz QVWIIYCKFKPMRF-UHFFFAOYSA-N -1 1 311.406 4.269 20 0 DIADMM CC(C)(C)CC(C)(C)NC(=O)c1ccc(C(F)(F)F)cc1[O-] ZINC001588073588 1055426429 /nfs/dbraw/zinc/42/64/29/1055426429.db2.gz LUBGIFGERXMIBP-UHFFFAOYSA-N -1 1 317.351 4.356 20 0 DIADMM Cc1ccc(CN(C)C(=O)c2cc3ccccc3cc2[O-])cc1 ZINC000023602316 1055501841 /nfs/dbraw/zinc/50/18/41/1055501841.db2.gz WUMUHPVIFGSLAZ-UHFFFAOYSA-N -1 1 305.377 4.126 20 0 DIADMM Cc1noc(C(C)C)c1[N-]C(=O)c1coc(-c2ccccc2)n1 ZINC001538092843 1055527051 /nfs/dbraw/zinc/52/70/51/1055527051.db2.gz SHDBKEOVKAXLII-UHFFFAOYSA-N -1 1 311.341 4.014 20 0 DIADMM CC(C)(C)c1ccc(CNC(=O)c2cc(Cl)ccc2[O-])s1 ZINC001594963307 1055574732 /nfs/dbraw/zinc/57/47/32/1055574732.db2.gz VOYXEWZNVJDPPM-UHFFFAOYSA-N -1 1 323.845 4.335 20 0 DIADMM C[C@@H]1CCN(C(=O)Cc2ccc([O-])c(Cl)c2)[C@@H]2CCCC[C@H]12 ZINC001595533606 1055607668 /nfs/dbraw/zinc/60/76/68/1055607668.db2.gz OWQLCLORPHAIDQ-XNRPHZJLSA-N -1 1 321.848 4.015 20 0 DIADMM CCCc1ccccc1[N-]S(=O)(=O)c1cc(C)ccc1C ZINC000032098394 1055648610 /nfs/dbraw/zinc/64/86/10/1055648610.db2.gz VLEQEONXGKSZMN-UHFFFAOYSA-N -1 1 303.427 4.057 20 0 DIADMM CCC(CC)CN(CC)C(=O)c1ccc(C(F)(F)F)c([O-])c1 ZINC001595966539 1055655582 /nfs/dbraw/zinc/65/55/82/1055655582.db2.gz YTVSCUIIJLDJIM-UHFFFAOYSA-N -1 1 317.351 4.309 20 0 DIADMM CCCCC[C@@H]1CCCN1C(=O)NCc1ccc([O-])c(Cl)c1 ZINC001565296861 1055688401 /nfs/dbraw/zinc/68/84/01/1055688401.db2.gz NGFDOYNWZZZDPX-CQSZACIVSA-N -1 1 324.852 4.300 20 0 DIADMM CCC[C@]1(C)CCCN(C(=O)Cc2ccc([O-])c(Cl)c2)C1 ZINC001566099348 1055742276 /nfs/dbraw/zinc/74/22/76/1055742276.db2.gz KOPUWSMYGVREST-QGZVFWFLSA-N -1 1 309.837 4.017 20 0 DIADMM CN(C(=O)c1ccc(F)c([O-])c1)c1ccc(-c2ccccc2)cc1 ZINC001566159083 1055745825 /nfs/dbraw/zinc/74/58/25/1055745825.db2.gz RXUBRRITNKXTIW-UHFFFAOYSA-N -1 1 321.351 4.475 20 0 DIADMM O=C([N-]c1cscc1Cl)c1c(F)c(F)cc(F)c1F ZINC001596888121 1055756394 /nfs/dbraw/zinc/75/63/94/1055756394.db2.gz NOJXSEWPYFWSJX-UHFFFAOYSA-N -1 1 309.671 4.210 20 0 DIADMM CCC1(CNC(=O)c2ccc(C(F)(F)F)c([O-])c2)CCCC1 ZINC001566410627 1055770318 /nfs/dbraw/zinc/77/03/18/1055770318.db2.gz HDBCANITLIYDDC-UHFFFAOYSA-N -1 1 315.335 4.111 20 0 DIADMM Cc1ccc(-c2cccc(NC(=O)c3ccccc3[O-])n2)cc1 ZINC001597242993 1055806182 /nfs/dbraw/zinc/80/61/82/1055806182.db2.gz ZFALXUCNYNIIKY-UHFFFAOYSA-N -1 1 304.349 4.015 20 0 DIADMM CCc1ccc(N(CC2CC2)C(=O)c2ccc([O-])cc2F)cc1 ZINC001569305267 1055858743 /nfs/dbraw/zinc/85/87/43/1055858743.db2.gz GCHRXUSBPYTCKU-UHFFFAOYSA-N -1 1 313.372 4.151 20 0 DIADMM CCC[C@@H](C)CC(=O)Nc1cc(C)cc(Br)c1[O-] ZINC001597673925 1055861581 /nfs/dbraw/zinc/86/15/81/1055861581.db2.gz FWNMBEGFHJXTLP-SECBINFHSA-N -1 1 314.223 4.228 20 0 DIADMM CC[C@@H](C)[C@@H](C(=O)Nc1cc([O-])c(F)cc1F)c1ccccc1 ZINC001570102209 1055886794 /nfs/dbraw/zinc/88/67/94/1055886794.db2.gz VKMQNUHJIOFSCQ-PIGZYNQJSA-N -1 1 319.351 4.439 20 0 DIADMM COC(=O)c1nc2cc(-c3cccc4ccccc43)ccc2[n-]1 ZINC001239471347 1055897439 /nfs/dbraw/zinc/89/74/39/1055897439.db2.gz IYKZEDIUJMFLIA-UHFFFAOYSA-N -1 1 302.333 4.170 20 0 DIADMM COC(=O)c1nc2ccc(-c3cccc4ccccc43)cc2[n-]1 ZINC001239471347 1055897447 /nfs/dbraw/zinc/89/74/47/1055897447.db2.gz IYKZEDIUJMFLIA-UHFFFAOYSA-N -1 1 302.333 4.170 20 0 DIADMM Cc1ccc(-c2ccc([C@H](C)[N-]C(=O)C(F)(F)F)cc2)cc1 ZINC001239481937 1055901381 /nfs/dbraw/zinc/90/13/81/1055901381.db2.gz JBLJTCVBVNBFLR-LBPRGKRZSA-N -1 1 307.315 4.402 20 0 DIADMM CCC[C@@H](C)c1cc(NC(=O)c2cc3ccccc3cc2[O-])n[nH]1 ZINC001570725209 1055914469 /nfs/dbraw/zinc/91/44/69/1055914469.db2.gz OLKWIZVIUSMPRP-GFCCVEGCSA-N -1 1 323.396 4.424 20 0 DIADMM CCc1oc(CN[C@H](C)c2ccccc2SC)cc1C(=O)[O-] ZINC000902379463 1055922943 /nfs/dbraw/zinc/92/29/43/1055922943.db2.gz DWKWSUSGWDCPOR-LLVKDONJSA-N -1 1 319.426 4.113 20 0 DIADMM O=C(Nc1cc(F)c([O-])cc1Cl)c1cc2cc(F)ccc2[nH]1 ZINC001598583021 1055959040 /nfs/dbraw/zinc/95/90/40/1055959040.db2.gz UKLLXOKIDSYACJ-UHFFFAOYSA-N -1 1 322.698 4.057 20 0 DIADMM O=C(NCCCC1CCCC1)c1ccc(C(F)(F)F)c([O-])c1 ZINC001540242258 1055998408 /nfs/dbraw/zinc/99/84/08/1055998408.db2.gz UUTVKWNVJPUWPR-UHFFFAOYSA-N -1 1 315.335 4.111 20 0 DIADMM CCCCCc1ccc(NC(=O)c2c([O-])cccc2OC)cc1 ZINC001540292767 1056009865 /nfs/dbraw/zinc/00/98/65/1056009865.db2.gz QSDIGOUTIQKQPG-UHFFFAOYSA-N -1 1 313.397 4.386 20 0 DIADMM CC(C)c1cncc(NC(=O)c2ccc3ccccc3c2[O-])c1 ZINC001602678474 1056015100 /nfs/dbraw/zinc/01/51/00/1056015100.db2.gz PZVCPBFLUQBGKD-UHFFFAOYSA-N -1 1 306.365 4.316 20 0 DIADMM Cc1c2ccccc2oc1[C@H](C)NC(=O)c1ccc(F)c([O-])c1 ZINC001583172170 1056032692 /nfs/dbraw/zinc/03/26/92/1056032692.db2.gz MKYUTFVDIQPLJD-NSHDSACASA-N -1 1 313.328 4.077 20 0 DIADMM CC[C@H](NC(=O)c1ncc2ccccc2c1[O-])C1CCCCC1 ZINC001607365598 1056048884 /nfs/dbraw/zinc/04/88/84/1056048884.db2.gz XFHNXZVHINXJME-INIZCTEOSA-N -1 1 312.413 4.029 20 0 DIADMM CC(C)C[C@H](NC(=O)c1ccc(F)c([O-])c1)c1ccccc1 ZINC001540618531 1056052274 /nfs/dbraw/zinc/05/22/74/1056052274.db2.gz ULWTVEDYXGVPBF-INIZCTEOSA-N -1 1 301.361 4.049 20 0 DIADMM O=C(NCc1cccc(Cl)c1)c1cc2ccccc2cc1[O-] ZINC000006584463 1056060245 /nfs/dbraw/zinc/06/02/45/1056060245.db2.gz LBMYRSCZQSYLKT-UHFFFAOYSA-N -1 1 311.768 4.129 20 0 DIADMM CCN(c1ccc(NC(=O)c2ccc(F)c([O-])c2)cc1)C(C)C ZINC001540707345 1056064106 /nfs/dbraw/zinc/06/41/06/1056064106.db2.gz FWNCZKGDRISJSF-UHFFFAOYSA-N -1 1 316.376 4.018 20 0 DIADMM Cc1cc2cc(NC(=O)Cc3ccc([O-])c(Cl)c3)ccc2[nH]1 ZINC001540768483 1056074003 /nfs/dbraw/zinc/07/40/03/1056074003.db2.gz YDWJKYDPVDFXLE-UHFFFAOYSA-N -1 1 314.772 4.017 20 0 DIADMM CC[C@H](NC(=O)c1ccc(F)c([O-])c1)c1cccc(Cl)c1 ZINC001540797453 1056078968 /nfs/dbraw/zinc/07/89/68/1056078968.db2.gz YXECNUBNXIDQIF-AWEZNQCLSA-N -1 1 307.752 4.066 20 0 DIADMM Cc1ccc2c(c1)[C@@H](NC(=O)c1ccc3ccccc3c1[O-])CC2 ZINC001583457461 1056089015 /nfs/dbraw/zinc/08/90/15/1056089015.db2.gz SLGVDSLABILFST-IBGZPJMESA-N -1 1 317.388 4.271 20 0 DIADMM C[C@@H](CC(C)(C)c1ccccc1)NC(=O)c1cc(F)ccc1[O-] ZINC001542484216 1056126658 /nfs/dbraw/zinc/12/66/58/1056126658.db2.gz ODNNPSJDFJGCSK-ZDUSSCGKSA-N -1 1 315.388 4.018 20 0 DIADMM CN(C(=O)c1cc(Cl)ccc1[O-])[C@@H]1CCCc2ccccc21 ZINC001542538958 1056131834 /nfs/dbraw/zinc/13/18/34/1056131834.db2.gz IJXQJQOVPLHKFQ-MRXNPFEDSA-N -1 1 315.800 4.195 20 0 DIADMM O=C(c1cccc([O-])c1F)N1CCCCC[C@@H]1c1ccccc1 ZINC001542627748 1056145588 /nfs/dbraw/zinc/14/55/88/1056145588.db2.gz QBZBEIAXUQVUTB-MRXNPFEDSA-N -1 1 313.372 4.289 20 0 DIADMM Cc1ccc(C)c2sc(NC(=O)c3ccc(F)c([O-])c3)nc21 ZINC001542964023 1056165217 /nfs/dbraw/zinc/16/52/17/1056165217.db2.gz TVPLGLJHDDDYKM-UHFFFAOYSA-N -1 1 316.357 4.010 20 0 DIADMM O=C(N[C@H](c1ccccc1)C1CC1)c1ccc2ccccc2c1[O-] ZINC001543122648 1056179957 /nfs/dbraw/zinc/17/99/57/1056179957.db2.gz WYHPNHAULWMJHC-LJQANCHMSA-N -1 1 317.388 4.427 20 0 DIADMM O=c1nc(Cl)cc(Oc2ccc(Cc3ccccc3)cc2)[n-]1 ZINC001611924127 1056209482 /nfs/dbraw/zinc/20/94/82/1056209482.db2.gz VZWIUQILFPKWHV-UHFFFAOYSA-N -1 1 312.756 4.219 20 0 DIADMM Cc1cc(C)c(NC(=O)c2ccc3ccc(O)cc3c2[O-])c(C)c1 ZINC001543398332 1056214610 /nfs/dbraw/zinc/21/46/10/1056214610.db2.gz AXKUUPDHLRKYNY-UHFFFAOYSA-N -1 1 321.376 4.429 20 0 DIADMM Cc1ccc([C@@H](C)NC(=O)c2ccc(C(F)(F)F)c([O-])c2)cc1 ZINC001543479625 1056233038 /nfs/dbraw/zinc/23/30/38/1056233038.db2.gz GECVJXPVFAZCHO-LLVKDONJSA-N -1 1 323.314 4.210 20 0 DIADMM CC1(C)CC[C@@H](NC(=O)c2cccc([O-])c2F)c2ccccc21 ZINC001544257821 1056393210 /nfs/dbraw/zinc/39/32/10/1056393210.db2.gz NIQNFMSPIVXJSG-OAHLLOKOSA-N -1 1 313.372 4.074 20 0 DIADMM Cc1c(=O)[n-]c(SC[Si](C)(C)C)nc1-c1ccccc1 ZINC001613699316 1056399299 /nfs/dbraw/zinc/39/92/99/1056399299.db2.gz XLFYUFMWUJNNFO-UHFFFAOYSA-N -1 1 304.491 4.127 20 0 DIADMM O=C(NCCCCCCc1ccccc1)c1ccc([O-])c(F)c1 ZINC001584718567 1056404077 /nfs/dbraw/zinc/40/40/77/1056404077.db2.gz VIXRYLNFIPLJRC-UHFFFAOYSA-N -1 1 315.388 4.064 20 0 DIADMM Cc1cnc(SCc2c(Cl)oc3ccccc32)[n-]c1=O ZINC001613808432 1056410398 /nfs/dbraw/zinc/41/03/98/1056410398.db2.gz KNHQVWZJXPZRJY-UHFFFAOYSA-N -1 1 306.774 4.183 20 0 DIADMM O=C(N[C@H](c1ccccc1)C1CCCC1)c1ccc(F)c([O-])c1 ZINC001544547342 1056452809 /nfs/dbraw/zinc/45/28/09/1056452809.db2.gz OLEOMJORKGADGI-GOSISDBHSA-N -1 1 313.372 4.193 20 0 DIADMM O=c1cc(-c2ccccc2)nc(SCCc2cccs2)[n-]1 ZINC001615017172 1056464068 /nfs/dbraw/zinc/46/40/68/1056464068.db2.gz NIPGSIOWJHGQCF-UHFFFAOYSA-N -1 1 314.435 4.246 20 0 DIADMM [O-]c1c(F)cc(Nc2ccnc(Br)c2)cc1Cl ZINC001214479856 1056539307 /nfs/dbraw/zinc/53/93/07/1056539307.db2.gz GWJFXKMADLTONC-UHFFFAOYSA-N -1 1 317.545 4.086 20 0 DIADMM CCc1cc(C(=O)Nc2cc(Cl)c([O-])c3ccccc23)no1 ZINC001585192936 1056503905 /nfs/dbraw/zinc/50/39/05/1056503905.db2.gz DZLRUCJQBHOGNG-UHFFFAOYSA-N -1 1 316.744 4.002 20 0 DIADMM CCSc1cccc(F)c1[N-]C(=O)c1nccc2occc21 ZINC001544919630 1056528015 /nfs/dbraw/zinc/52/80/15/1056528015.db2.gz GNMAODZTTXRYNS-UHFFFAOYSA-N -1 1 316.357 4.331 20 0 DIADMM CC(C)N(C(=O)c1ccc(C(F)(F)F)c([O-])c1)C1CCCC1 ZINC001585365455 1056538520 /nfs/dbraw/zinc/53/85/20/1056538520.db2.gz CBRDVIXXUFUNAN-UHFFFAOYSA-N -1 1 315.335 4.204 20 0 DIADMM Cc1ccc([N-]S(=O)(=O)c2cccc(Cl)c2)cc1Cl ZINC000007402381 1056576671 /nfs/dbraw/zinc/57/66/71/1056576671.db2.gz XQTQOWSSVIRVRS-UHFFFAOYSA-N -1 1 316.209 4.103 20 0 DIADMM C[C@@H](NC(=O)c1cc(Cl)ccc1[O-])c1cc2ccccc2o1 ZINC001616311154 1056631824 /nfs/dbraw/zinc/63/18/24/1056631824.db2.gz MXMNPDHKHCTMCL-SNVBAGLBSA-N -1 1 315.756 4.283 20 0 DIADMM CC1(C)CC=C(C(=O)Nc2ccc(Br)c([O-])c2)CC1 ZINC001616324846 1056635302 /nfs/dbraw/zinc/63/53/02/1056635302.db2.gz NSUVTYUWSVGQLM-UHFFFAOYSA-N -1 1 324.218 4.230 20 0 DIADMM Nc1cc(F)c(Cl)cc1Nc1cc(F)c([O-])c(Cl)c1 ZINC001214488975 1056683840 /nfs/dbraw/zinc/68/38/40/1056683840.db2.gz RIJPTLMJEIDJLT-UHFFFAOYSA-N -1 1 305.111 4.303 20 0 DIADMM [O-]c1ccc(F)cc1-c1nc(N2CCCC2)cc2ccccc21 ZINC001240695197 1056645878 /nfs/dbraw/zinc/64/58/78/1056645878.db2.gz DXPNSSAVQFQCIE-UHFFFAOYSA-N -1 1 308.356 4.347 20 0 DIADMM CSc1ccc(C(F)(F)F)nc1-c1cc(F)ccc1[O-] ZINC001240693744 1056646058 /nfs/dbraw/zinc/64/60/58/1056646058.db2.gz HOGDQQQQVUKATF-UHFFFAOYSA-N -1 1 303.280 4.334 20 0 DIADMM CC(C)(C)[C@@H]1CCc2nnc(-c3cc(F)ccc3[O-])cc2C1 ZINC001240696357 1056647537 /nfs/dbraw/zinc/64/75/37/1056647537.db2.gz NOXAHCLSWKDTDI-GFCCVEGCSA-N -1 1 300.377 4.139 20 0 DIADMM [O-]c1ccc(F)cc1-c1ncccc1OCc1ccccc1F ZINC001240696001 1056648342 /nfs/dbraw/zinc/64/83/42/1056648342.db2.gz VRZSHGQQQXMGDZ-UHFFFAOYSA-N -1 1 313.303 4.311 20 0 DIADMM [O-]c1c(F)cc(Nc2cncc(OC(F)(F)F)c2)cc1Cl ZINC001214486802 1056664121 /nfs/dbraw/zinc/66/41/21/1056664121.db2.gz ZTDVVILZWPXNLC-UHFFFAOYSA-N -1 1 322.645 4.222 20 0 DIADMM CC(C)Oc1ccc(NC(=O)c2ccc(F)c([O-])c2)c(Cl)c1 ZINC001616589389 1056683063 /nfs/dbraw/zinc/68/30/63/1056683063.db2.gz CAIGJMUJUWZZND-UHFFFAOYSA-N -1 1 323.751 4.224 20 0 DIADMM COc1cc(F)c(Nc2cc(F)c([O-])c(Cl)c2)c(F)c1 ZINC001214489171 1056690215 /nfs/dbraw/zinc/69/02/15/1056690215.db2.gz WBLMETHHHVQNTC-UHFFFAOYSA-N -1 1 303.667 4.215 20 0 DIADMM [O-]c1ccc(-c2ncnc3cc(OC(F)(F)F)ccc32)cc1F ZINC001240781947 1056695896 /nfs/dbraw/zinc/69/58/96/1056695896.db2.gz MFTAAQIZIHIQHX-UHFFFAOYSA-N -1 1 324.233 4.040 20 0 DIADMM [O-]c1ccc(-c2nc(C(F)F)nc3ccc(F)cc32)cc1F ZINC001240786053 1056697445 /nfs/dbraw/zinc/69/74/45/1056697445.db2.gz JHTUHBGBSQYUEK-UHFFFAOYSA-N -1 1 308.234 4.218 20 0 DIADMM [O-]c1ccc(-c2nc(-c3ccncc3)nc3sccc32)cc1F ZINC001240786650 1056697920 /nfs/dbraw/zinc/69/79/20/1056697920.db2.gz YEXSMNHDWNATKC-UHFFFAOYSA-N -1 1 323.352 4.265 20 0 DIADMM CCOC(=O)Cc1ccc(Nc2cc(F)c([O-])c(Cl)c2)cc1 ZINC001214489733 1056704205 /nfs/dbraw/zinc/70/42/05/1056704205.db2.gz JAGWJQFEIKFDIC-UHFFFAOYSA-N -1 1 323.751 4.034 20 0 DIADMM CCC(CC)(CC)NC(=O)c1ccc(C(F)(F)F)cc1[O-] ZINC001586397950 1056727004 /nfs/dbraw/zinc/72/70/04/1056727004.db2.gz XIEIBJQWDSSXKV-UHFFFAOYSA-N -1 1 303.324 4.110 20 0 DIADMM Cc1oc2ccc(NC(=O)c3c(F)ccc([O-])c3F)cc2c1C ZINC001616893476 1056735787 /nfs/dbraw/zinc/73/57/87/1056735787.db2.gz LGZBRRRMDRVYQY-UHFFFAOYSA-N -1 1 317.291 4.286 20 0 DIADMM Cc1nc2ccc(-c3nc4cccc(C)c4c(=O)[n-]3)cc2s1 ZINC000478161177 1056751705 /nfs/dbraw/zinc/75/17/05/1056751705.db2.gz NWZCWHYVFBKQAI-UHFFFAOYSA-N -1 1 307.378 4.229 20 0 DIADMM O=C(c1cc(Cl)ccc1[O-])N1CCC[C@@H]1c1cccs1 ZINC001586844015 1056817838 /nfs/dbraw/zinc/81/78/38/1056817838.db2.gz READXLRGVPTSPO-GFCCVEGCSA-N -1 1 307.802 4.084 20 0 DIADMM Cc1ccc(-c2nccc(-c3c[nH]c4ccccc43)n2)c([O-])c1 ZINC001241030805 1056830684 /nfs/dbraw/zinc/83/06/84/1056830684.db2.gz UOUZFLNEOUDOMS-UHFFFAOYSA-N -1 1 301.349 4.306 20 0 DIADMM O=C(N[C@@H]1CC[C@@H]2CCC[C@@H]2C1)c1cc2ccccc2cc1[O-] ZINC001617426310 1056831397 /nfs/dbraw/zinc/83/13/97/1056831397.db2.gz OWQVKLJOTMIMRF-JJRVBVJISA-N -1 1 309.409 4.244 20 0 DIADMM C[C@H]1CCC[C@H](C)N(C(=O)c2ccc(C(F)(F)F)c([O-])c2)C1 ZINC001617797403 1056882793 /nfs/dbraw/zinc/88/27/93/1056882793.db2.gz NEOCZJLKBLUUMY-QWRGUYRKSA-N -1 1 315.335 4.062 20 0 DIADMM COc1cc(F)cc2ccc(-c3c(F)cc([O-])cc3F)nc21 ZINC001241118631 1056905288 /nfs/dbraw/zinc/90/52/88/1056905288.db2.gz SOQYVUUTINHZFZ-UHFFFAOYSA-N -1 1 305.255 4.033 20 0 DIADMM [O-]c1cc(F)c(-c2ccc(OCC(F)(F)F)cc2)c(F)c1 ZINC001241122668 1056905989 /nfs/dbraw/zinc/90/59/89/1056905989.db2.gz KOJLYVCLCKTHBF-UHFFFAOYSA-N -1 1 304.214 4.279 20 0 DIADMM CC(C)(C)C(=O)Nc1cc(F)ccc1-c1c(F)cc([O-])cc1F ZINC001241122605 1056907236 /nfs/dbraw/zinc/90/72/36/1056907236.db2.gz HPSGUNLIVFUADA-UHFFFAOYSA-N -1 1 323.314 4.461 20 0 DIADMM CC(C)(C)OC(=O)Nc1cccc(-c2c(F)cc([O-])cc2F)n1 ZINC001241120995 1056907635 /nfs/dbraw/zinc/90/76/35/1056907635.db2.gz XEZVZMZFTICWQL-UHFFFAOYSA-N -1 1 322.311 4.079 20 0 DIADMM [O-]c1cc(F)cc(-c2ncc(F)c(Oc3ccccc3F)n2)c1 ZINC001241262246 1056985994 /nfs/dbraw/zinc/98/59/94/1056985994.db2.gz YJRKTNASPUKILX-UHFFFAOYSA-N -1 1 318.254 4.059 20 0 DIADMM CCOC(=O)c1nc2cc(-c3ccc(OCC)cc3C)ccc2[n-]1 ZINC001241273433 1056991259 /nfs/dbraw/zinc/99/12/59/1056991259.db2.gz MTEORJYIMLHGGD-UHFFFAOYSA-N -1 1 324.380 4.114 20 0 DIADMM CCOC(=O)c1nc2ccc(-c3ccc(OCC)cc3C)cc2[n-]1 ZINC001241273433 1056991264 /nfs/dbraw/zinc/99/12/64/1056991264.db2.gz MTEORJYIMLHGGD-UHFFFAOYSA-N -1 1 324.380 4.114 20 0 DIADMM [O-]c1ccc(F)c(-c2ncccc2OCc2ccccc2)c1F ZINC001241290523 1056998769 /nfs/dbraw/zinc/99/87/69/1056998769.db2.gz UGXFGWYTFXQMFL-UHFFFAOYSA-N -1 1 313.303 4.311 20 0 DIADMM Cc1cc(-c2cccc(F)c2)nnc1-c1c(F)ccc([O-])c1F ZINC001241291294 1056999708 /nfs/dbraw/zinc/99/97/08/1056999708.db2.gz LWOCGJWYMZTUDE-UHFFFAOYSA-N -1 1 316.282 4.242 20 0 DIADMM CC(C)CCc1ccc(NC(=O)c2ccc(F)c([O-])c2)cc1 ZINC001626086264 1057063001 /nfs/dbraw/zinc/06/30/01/1057063001.db2.gz VYAGHIUUKRJZLI-UHFFFAOYSA-N -1 1 301.361 4.372 20 0 DIADMM O=C(Nc1c([O-])cccc1F)c1ccc(Oc2ccccc2)o1 ZINC000674015889 1057180751 /nfs/dbraw/zinc/18/07/51/1057180751.db2.gz XAEWMIDOMLOHFX-UHFFFAOYSA-N -1 1 313.284 4.169 20 0 DIADMM C[C@@H](C1CCCCC1)N(C)C(=O)Cc1ccc([O-])c(Cl)c1 ZINC001626097679 1057185648 /nfs/dbraw/zinc/18/56/48/1057185648.db2.gz YVEQYPOKJIVRGD-LBPRGKRZSA-N -1 1 309.837 4.015 20 0 DIADMM COc1ccc(-c2ccc3c(c2)C(C(C)C)=NCC3)cc1C(=O)[O-] ZINC001241880512 1057199000 /nfs/dbraw/zinc/19/90/00/1057199000.db2.gz PQWORPPJIBKKAL-UHFFFAOYSA-N -1 1 323.392 4.062 20 0 DIADMM CCC[C@@H](C)S(=O)(=O)[N-]c1sc(-c2ccccc2)nc1C ZINC000519534372 1057209972 /nfs/dbraw/zinc/20/99/72/1057209972.db2.gz BYCCZPJHNBNYNH-LLVKDONJSA-N -1 1 324.471 4.049 20 0 DIADMM O=C(/C=C\c1ccc(Cl)s1)Nc1ccc([O-])c(Cl)c1 ZINC000701148176 1057244490 /nfs/dbraw/zinc/24/44/90/1057244490.db2.gz LSAGJBLOJFAVKV-UTCJRWHESA-N -1 1 314.193 4.412 20 0 DIADMM COc1ccc2c(c1)ncnc2-c1cc(C(F)(F)F)ccc1[O-] ZINC001242131334 1057273407 /nfs/dbraw/zinc/27/34/07/1057273407.db2.gz HTEDKOAHXLKOPY-UHFFFAOYSA-N -1 1 320.270 4.030 20 0 DIADMM [O-]c1ccc(C(F)(F)F)cc1-c1cccc(COCC2CC2)n1 ZINC001242133022 1057274393 /nfs/dbraw/zinc/27/43/93/1057274393.db2.gz BIBIXGGDNDTKQI-UHFFFAOYSA-N -1 1 323.314 4.400 20 0 DIADMM Cc1cc2ncnc(-c3cc(C(F)(F)F)ccc3[O-])c2s1 ZINC001242132304 1057274454 /nfs/dbraw/zinc/27/44/54/1057274454.db2.gz QBGOXIHWWKTDCE-UHFFFAOYSA-N -1 1 310.300 4.391 20 0 DIADMM COc1ccc2ncnc(-c3cc(C(F)(F)F)ccc3[O-])c2c1 ZINC001242131841 1057274494 /nfs/dbraw/zinc/27/44/94/1057274494.db2.gz SKTRIPOTKCOBPQ-UHFFFAOYSA-N -1 1 320.270 4.030 20 0 DIADMM [O-]c1ccc(C(F)(F)F)cc1-c1ccc2ncc(F)cc2n1 ZINC001242132372 1057274606 /nfs/dbraw/zinc/27/46/06/1057274606.db2.gz UHRJLUXRQXKCDB-UHFFFAOYSA-N -1 1 308.234 4.160 20 0 DIADMM CC(C)Sc1ccc(-c2cc(C(F)(F)F)ccc2[O-])nn1 ZINC001242134236 1057275031 /nfs/dbraw/zinc/27/50/31/1057275031.db2.gz UVQHSNNYYSMZDF-UHFFFAOYSA-N -1 1 314.332 4.369 20 0 DIADMM [O-]c1ccc(-c2ncccc2OC(F)(F)F)cc1C(F)(F)F ZINC001242151855 1057280478 /nfs/dbraw/zinc/28/04/78/1057280478.db2.gz WAPFQBXRUXGAIH-UHFFFAOYSA-N -1 1 323.192 4.372 20 0 DIADMM COc1ccc2ncnc(-c3ccc([O-])c(C(F)(F)F)c3)c2c1 ZINC001242151208 1057280757 /nfs/dbraw/zinc/28/07/57/1057280757.db2.gz HQCCAIAWQRAQRP-UHFFFAOYSA-N -1 1 320.270 4.030 20 0 DIADMM [O-]c1ccc(-c2nncc3cc(F)ccc32)cc1C(F)(F)F ZINC001242151231 1057280860 /nfs/dbraw/zinc/28/08/60/1057280860.db2.gz HYHNMWMQNRTODW-UHFFFAOYSA-N -1 1 308.234 4.160 20 0 DIADMM CSc1cc(-c2ccc([O-])c(C(F)(F)F)c2)ncc1F ZINC001242151906 1057280889 /nfs/dbraw/zinc/28/08/89/1057280889.db2.gz YPEGUERPIDPVNK-UHFFFAOYSA-N -1 1 303.280 4.334 20 0 DIADMM CC(C)n1ccc2c1ncnc2-c1ccc([O-])c(C(F)(F)F)c1 ZINC001242153150 1057281559 /nfs/dbraw/zinc/28/15/59/1057281559.db2.gz SDZSWCULRLGUGJ-UHFFFAOYSA-N -1 1 321.302 4.404 20 0 DIADMM [O-]c1ccc(-c2ccc(-c3ccco3)nn2)cc1C(F)(F)F ZINC001242157816 1057283157 /nfs/dbraw/zinc/28/31/57/1057283157.db2.gz NOHLPVHCMAJSCJ-UHFFFAOYSA-N -1 1 306.243 4.128 20 0 DIADMM [O-]c1ccc(-c2cccc(COCC3CC3)n2)cc1C(F)(F)F ZINC001242157560 1057283268 /nfs/dbraw/zinc/28/32/68/1057283268.db2.gz INRSXSBKIBUNAM-UHFFFAOYSA-N -1 1 323.314 4.400 20 0 DIADMM COc1cc(C(=O)OC(C)(C)C)ccc1-c1ccc(F)cc1[O-] ZINC001242219335 1057297970 /nfs/dbraw/zinc/29/79/70/1057297970.db2.gz DTWHYUHCAMETEU-UHFFFAOYSA-N -1 1 318.344 4.162 20 0 DIADMM CCOC(=O)c1noc2cccc(-c3cccc(Cl)c3[O-])c21 ZINC001242365330 1057347691 /nfs/dbraw/zinc/34/76/91/1057347691.db2.gz ALQLXKFBTREWFG-UHFFFAOYSA-N -1 1 317.728 4.031 20 0 DIADMM CC1(C)C(=O)Nc2cc(F)c(-c3cccc(Cl)c3[O-])cc21 ZINC001242365412 1057347832 /nfs/dbraw/zinc/34/78/32/1057347832.db2.gz BYXABYQZVHIUMJ-UHFFFAOYSA-N -1 1 305.736 4.081 20 0 DIADMM COC(=O)c1nc2c(cccc2-c2cccc(Cl)c2[O-])s1 ZINC001242367693 1057349029 /nfs/dbraw/zinc/34/90/29/1057349029.db2.gz QFIOAXBWDQORBH-UHFFFAOYSA-N -1 1 319.769 4.109 20 0 DIADMM CC1(C)CC(=O)Nc2cccc(-c3cccc(Cl)c3[O-])c21 ZINC001242367042 1057349046 /nfs/dbraw/zinc/34/90/46/1057349046.db2.gz GQXFUSDURCNZSO-UHFFFAOYSA-N -1 1 301.773 4.332 20 0 DIADMM [O-]c1cccc(-c2nccnc2C2SCCCS2)c1Cl ZINC001242798340 1057479922 /nfs/dbraw/zinc/47/99/22/1057479922.db2.gz SPAOCRUQEQHQCD-UHFFFAOYSA-N -1 1 324.858 4.371 20 0 DIADMM CC(C)(C)OC(=O)c1ccnc(-c2cccc([O-])c2Cl)c1 ZINC001242799096 1057480856 /nfs/dbraw/zinc/48/08/56/1057480856.db2.gz SZFJMCORIVGUJJ-UHFFFAOYSA-N -1 1 305.761 4.063 20 0 DIADMM [O-]c1cccc(-c2ccnc(CCc3ccccc3)n2)c1Cl ZINC001242800008 1057481041 /nfs/dbraw/zinc/48/10/41/1057481041.db2.gz BPUWYVUZTIELLK-UHFFFAOYSA-N -1 1 310.784 4.288 20 0 DIADMM CC[C@H](C)c1nc2[nH]ccc2c(-c2cccc([O-])c2Cl)n1 ZINC001242799623 1057481046 /nfs/dbraw/zinc/48/10/46/1057481046.db2.gz VBKIHFUFHNJCHB-VIFPVBQESA-N -1 1 301.777 4.449 20 0 DIADMM CCN(CC)C(=O)c1ccc(-c2cccc([O-])c2Cl)cc1 ZINC001242799377 1057481100 /nfs/dbraw/zinc/48/11/00/1057481100.db2.gz HYIHJNNHFGASLZ-UHFFFAOYSA-N -1 1 303.789 4.195 20 0 DIADMM CCCN(CCC)c1cc(-c2cccc([O-])c2Cl)ncn1 ZINC001242800288 1057481698 /nfs/dbraw/zinc/48/16/98/1057481698.db2.gz FQZJKCMKABYYSW-UHFFFAOYSA-N -1 1 305.809 4.129 20 0 DIADMM C[C@@H]1CCCCN1c1cccc(-c2cccc([O-])c2Cl)n1 ZINC001242801655 1057481821 /nfs/dbraw/zinc/48/18/21/1057481821.db2.gz VHNWRXICDNPHRB-GFCCVEGCSA-N -1 1 302.805 4.486 20 0 DIADMM CC(C)(C)OC(=O)Nc1cccc(-c2cccc([O-])c2Cl)n1 ZINC001242800359 1057481904 /nfs/dbraw/zinc/48/19/04/1057481904.db2.gz GZNYFYRSRQQNRD-UHFFFAOYSA-N -1 1 320.776 4.455 20 0 DIADMM [O-]c1cccc(-c2ccc(-c3ccc(F)cc3)nn2)c1Cl ZINC001242801720 1057481945 /nfs/dbraw/zinc/48/19/45/1057481945.db2.gz WJDCFYZBZGUXBZ-UHFFFAOYSA-N -1 1 300.720 4.309 20 0 DIADMM [O-]c1cccc(-c2cnc3nc(C(F)(F)F)oc3c2)c1Cl ZINC001242800811 1057481954 /nfs/dbraw/zinc/48/19/54/1057481954.db2.gz PAOXAZUPPDGAKP-UHFFFAOYSA-N -1 1 314.650 4.268 20 0 DIADMM O=c1ccc(-c2cccc([O-])c2Cl)cn1-c1ccccc1F ZINC001242801572 1057482151 /nfs/dbraw/zinc/48/21/51/1057482151.db2.gz ARQMHLFYTNNCBP-UHFFFAOYSA-N -1 1 315.731 4.003 20 0 DIADMM [O-]c1cccc(-c2cc3c(nn2)-c2ccccc2OC3)c1Cl ZINC001242801788 1057482792 /nfs/dbraw/zinc/48/27/92/1057482792.db2.gz ZCWISPUYOCAHNM-UHFFFAOYSA-N -1 1 310.740 4.062 20 0 DIADMM O=C1NCCC/C1=C\c1cccc(-c2cccc([O-])c2Cl)c1 ZINC001242802448 1057482986 /nfs/dbraw/zinc/48/29/86/1057482986.db2.gz HXAMJRZCRVRDMW-SDNWHVSQSA-N -1 1 313.784 4.006 20 0 DIADMM CCOC(=O)/C=C/c1ccc(-c2cccc([O-])c2Cl)c(F)c1 ZINC001242802491 1057483204 /nfs/dbraw/zinc/48/32/04/1057483204.db2.gz JRPQKZCVTJBZTE-VQHVLOKHSA-N -1 1 320.747 4.428 20 0 DIADMM C=C(c1ccccc1)c1ccc([C@H](C)[N-]C(=O)C(F)(F)F)cc1 ZINC001242894257 1057514206 /nfs/dbraw/zinc/51/42/06/1057514206.db2.gz NQBQQMAOSAIMJM-ZDUSSCGKSA-N -1 1 319.326 4.488 20 0 DIADMM COC(=O)c1nc2cc(-c3c(C)ccc4ccccc43)ccc2[n-]1 ZINC001242981639 1057534792 /nfs/dbraw/zinc/53/47/92/1057534792.db2.gz KEANQZQXRGBIQE-UHFFFAOYSA-N -1 1 316.360 4.478 20 0 DIADMM COC(=O)c1nc2ccc(-c3c(C)ccc4ccccc43)cc2[n-]1 ZINC001242981639 1057534794 /nfs/dbraw/zinc/53/47/94/1057534794.db2.gz KEANQZQXRGBIQE-UHFFFAOYSA-N -1 1 316.360 4.478 20 0 DIADMM Cc1nc(-c2ccc(F)c([O-])c2)nc(C)c1Cc1ccccc1 ZINC001243048721 1057556862 /nfs/dbraw/zinc/55/68/62/1057556862.db2.gz HHWMXUHHWAOVDQ-UHFFFAOYSA-N -1 1 308.356 4.196 20 0 DIADMM [O-]c1cc(-c2ncccc2OCc2ccc(F)cc2)ccc1F ZINC001243050596 1057558285 /nfs/dbraw/zinc/55/82/85/1057558285.db2.gz QBEUUAJRWNXPMY-UHFFFAOYSA-N -1 1 313.303 4.311 20 0 DIADMM [O-]c1cc(-c2nc3ccccc3nc2N2CCCCC2)ccc1F ZINC001243051004 1057558480 /nfs/dbraw/zinc/55/84/80/1057558480.db2.gz ZKQMOXOOKCOIDW-UHFFFAOYSA-N -1 1 323.371 4.132 20 0 DIADMM CC(C)(C)n1cc(Nc2cc(Cl)cc(Cl)c2[O-])cn1 ZINC001212572297 1057628446 /nfs/dbraw/zinc/62/84/46/1057628446.db2.gz VDXJJANESDEIMY-UHFFFAOYSA-N -1 1 300.189 4.394 20 0 DIADMM CC(C)(C)C(=O)Nc1cc(F)ccc1-c1ccc([O-])c(F)c1F ZINC001243342830 1057652905 /nfs/dbraw/zinc/65/29/05/1057652905.db2.gz LIIFPSYAFMCGQR-UHFFFAOYSA-N -1 1 323.314 4.461 20 0 DIADMM CCOC(=O)CCCc1cccc(-c2ccc([O-])c(F)c2F)c1 ZINC001243341479 1057652922 /nfs/dbraw/zinc/65/29/22/1057652922.db2.gz RCITYTWCYFLBBO-UHFFFAOYSA-N -1 1 320.335 4.223 20 0 DIADMM CCOC(OCC)c1ccc(-c2ccc([O-])c(F)c2F)cc1 ZINC001243343330 1057653741 /nfs/dbraw/zinc/65/37/41/1057653741.db2.gz VUVYJQRSTGCDPS-UHFFFAOYSA-N -1 1 308.324 4.409 20 0 DIADMM CC[C@H](C(=O)OC)c1ccc(-c2ccc([O-])c(F)c2F)cc1 ZINC001243343243 1057653751 /nfs/dbraw/zinc/65/37/51/1057653751.db2.gz UGRFLJUFTRGMIJ-LBPRGKRZSA-N -1 1 306.308 4.004 20 0 DIADMM CC(C)(C)OC(=O)c1ccc(-c2ccc([O-])c(F)c2F)cc1 ZINC001243343182 1057653910 /nfs/dbraw/zinc/65/39/10/1057653910.db2.gz YHNAONDFQCFSJK-UHFFFAOYSA-N -1 1 306.308 4.293 20 0 DIADMM COC(=O)c1cc2cc(-c3ccc([O-])c(F)c3F)ccc2s1 ZINC001243343047 1057653971 /nfs/dbraw/zinc/65/39/71/1057653971.db2.gz WHHCLJVFFPQAPC-UHFFFAOYSA-N -1 1 320.316 4.339 20 0 DIADMM Cc1c2cccc(Cl)c2oc1C(=O)Nc1ccc(F)cc1[O-] ZINC000532012745 1057672066 /nfs/dbraw/zinc/67/20/66/1057672066.db2.gz FIMDDUPBPJCFQV-UHFFFAOYSA-N -1 1 319.719 4.492 20 0 DIADMM CC(C)(C)OC(=O)Nc1cc(-c2cc(F)cc(F)c2[O-])ccn1 ZINC001243501827 1057696722 /nfs/dbraw/zinc/69/67/22/1057696722.db2.gz COFPTAXMFFHRRN-UHFFFAOYSA-N -1 1 322.311 4.079 20 0 DIADMM COc1cc(C(F)(F)F)ccc1-c1cc(F)cc(F)c1[O-] ZINC001243502667 1057697283 /nfs/dbraw/zinc/69/72/83/1057697283.db2.gz NGODSINZDIKSJD-UHFFFAOYSA-N -1 1 304.214 4.365 20 0 DIADMM [O-]c1c(F)cc(F)cc1-c1cccc(-c2cc[nH]c(=S)n2)c1 ZINC001243504229 1057697303 /nfs/dbraw/zinc/69/73/03/1057697303.db2.gz KAEBBYVJJDSQDF-UHFFFAOYSA-N -1 1 316.332 4.083 20 0 DIADMM [O-]c1c(F)cc(F)cc1-c1ccc2nnc(-c3ccccc3)n2c1 ZINC001243504271 1057697344 /nfs/dbraw/zinc/69/73/44/1057697344.db2.gz KLZPBDHDGDIPLD-UHFFFAOYSA-N -1 1 323.302 4.047 20 0 DIADMM CCOC(=O)c1cc(C)c(-c2cc(F)cc(F)c2[O-])cc1C ZINC001243505080 1057697906 /nfs/dbraw/zinc/69/79/06/1057697906.db2.gz BGQRWPGUTHRLPP-UHFFFAOYSA-N -1 1 306.308 4.131 20 0 DIADMM CC(C)Oc1cc(F)c(F)cc1-c1cc(F)cc(F)c1[O-] ZINC001243507307 1057698556 /nfs/dbraw/zinc/69/85/56/1057698556.db2.gz WQTVUHQFKKWLBK-UHFFFAOYSA-N -1 1 300.251 4.403 20 0 DIADMM O=C(Nc1ccccc1)c1ccnc(-c2ccc(Cl)c([O-])c2)c1 ZINC001243576647 1057720679 /nfs/dbraw/zinc/72/06/79/1057720679.db2.gz RKBCDXSUKOXMPY-UHFFFAOYSA-N -1 1 324.767 4.360 20 0 DIADMM CC(C)(C)OC(=O)c1ccnc(-c2ccc(Cl)c([O-])c2)c1 ZINC001243577115 1057720725 /nfs/dbraw/zinc/72/07/25/1057720725.db2.gz UAZVXLWJIVKTFY-UHFFFAOYSA-N -1 1 305.761 4.063 20 0 DIADMM CSc1nc2sccc2c(-c2ccc(Cl)c([O-])c2)n1 ZINC001243576431 1057721058 /nfs/dbraw/zinc/72/10/58/1057721058.db2.gz GQHGJYNXFIJXIZ-UHFFFAOYSA-N -1 1 308.815 4.439 20 0 DIADMM COc1cc2nccc(-c3ccc(Cl)c([O-])c3)c2cc1OC ZINC001243578066 1057721629 /nfs/dbraw/zinc/72/16/29/1057721629.db2.gz KYTLGWSBMCTZIW-UHFFFAOYSA-N -1 1 315.756 4.278 20 0 DIADMM [O-]c1cc(-c2cc3c(nn2)-c2ccccc2OC3)ccc1Cl ZINC001243578557 1057721769 /nfs/dbraw/zinc/72/17/69/1057721769.db2.gz HWPUMSTYLSLSKE-UHFFFAOYSA-N -1 1 310.740 4.062 20 0 DIADMM CSc1ncc2cc(-c3ccc(Cl)c([O-])c3)ccc2n1 ZINC001243581696 1057723029 /nfs/dbraw/zinc/72/30/29/1057723029.db2.gz RKIQMVXOMHGWGA-UHFFFAOYSA-N -1 1 302.786 4.378 20 0 DIADMM CCOC(=O)c1cc(F)c(F)cc1-c1ccc(Cl)c([O-])c1 ZINC001243582725 1057724078 /nfs/dbraw/zinc/72/40/78/1057724078.db2.gz DZPRZDNVUFDFHJ-UHFFFAOYSA-N -1 1 312.699 4.168 20 0 DIADMM CC(C)(C)OC(=O)Nc1ccc(-c2ccc(Cl)c([O-])c2)cn1 ZINC001243583474 1057724251 /nfs/dbraw/zinc/72/42/51/1057724251.db2.gz OWUFHLYQPNGOKH-UHFFFAOYSA-N -1 1 320.776 4.455 20 0 DIADMM Cc1nc2ccccc2nc1-c1ccc(C(F)(F)F)cc1[O-] ZINC001243604301 1057730364 /nfs/dbraw/zinc/73/03/64/1057730364.db2.gz BUCKMZOXJFIEAS-UHFFFAOYSA-N -1 1 304.271 4.330 20 0 DIADMM [O-]c1cc(C(F)(F)F)ccc1-c1cccc(C(F)(F)F)n1 ZINC001243605673 1057730444 /nfs/dbraw/zinc/73/04/44/1057730444.db2.gz VUJUWFPNDPENHS-UHFFFAOYSA-N -1 1 307.193 4.492 20 0 DIADMM [O-]c1cc(C(F)(F)F)ccc1-c1ncnc2cccc(F)c21 ZINC001243607136 1057730783 /nfs/dbraw/zinc/73/07/83/1057730783.db2.gz NQUHHBVJZKYSAH-UHFFFAOYSA-N -1 1 308.234 4.160 20 0 DIADMM [O-]c1cc(C(F)(F)F)ccc1-c1cc(OC(F)F)ccn1 ZINC001243609068 1057731756 /nfs/dbraw/zinc/73/17/56/1057731756.db2.gz MIMQLKMYPQQOMW-UHFFFAOYSA-N -1 1 305.202 4.074 20 0 DIADMM [O-]c1cc(C(F)(F)F)ccc1-c1cccc(OC(F)F)n1 ZINC001243609009 1057731832 /nfs/dbraw/zinc/73/18/32/1057731832.db2.gz LJNTTXFRVFMHOL-UHFFFAOYSA-N -1 1 305.202 4.074 20 0 DIADMM Cc1nc(-c2ccc(C(F)(F)F)cc2[O-])cc(C(F)(F)F)n1 ZINC001243609931 1057732114 /nfs/dbraw/zinc/73/21/14/1057732114.db2.gz YERXGASBEOOZLE-UHFFFAOYSA-N -1 1 322.208 4.195 20 0 DIADMM Cc1nc2ccc(-c3c([O-])cccc3Cl)nc2n1C(C)C ZINC001244031181 1057843336 /nfs/dbraw/zinc/84/33/36/1057843336.db2.gz OKYRKAWSKKSNBT-UHFFFAOYSA-N -1 1 301.777 4.347 20 0 DIADMM [O-]c1cccc(Cl)c1-c1ccc2nc(C(F)(F)F)[nH]c2n1 ZINC001244038621 1057846056 /nfs/dbraw/zinc/84/60/56/1057846056.db2.gz VKCCIKYQUHUIRB-UHFFFAOYSA-N -1 1 313.666 4.003 20 0 DIADMM COC(=O)c1ccc(C2CC2)c(-c2cc(F)c([O-])c(F)c2)c1 ZINC001244098597 1057868549 /nfs/dbraw/zinc/86/85/49/1057868549.db2.gz MTVVNUCEAYJQIS-UHFFFAOYSA-N -1 1 304.292 4.001 20 0 DIADMM CCOC(=O)c1cc(C)c(-c2cc(F)c([O-])c(F)c2)cc1C ZINC001244098590 1057868860 /nfs/dbraw/zinc/86/88/60/1057868860.db2.gz MLWCKOBEYCCSNY-UHFFFAOYSA-N -1 1 306.308 4.131 20 0 DIADMM CCOC(OCC)c1ccc(-c2cc(F)c([O-])c(F)c2)cc1 ZINC001244098221 1057868931 /nfs/dbraw/zinc/86/89/31/1057868931.db2.gz ZRCOCOJSVHONBH-UHFFFAOYSA-N -1 1 308.324 4.409 20 0 DIADMM [O-]c1cc(OC(F)(F)F)ccc1-c1ncccc1C(F)F ZINC001244462858 1057965325 /nfs/dbraw/zinc/96/53/25/1057965325.db2.gz OFZWWBFLVOCLBF-UHFFFAOYSA-N -1 1 305.202 4.290 20 0 DIADMM Cc1cc(-c2ccc(OC(F)(F)F)cc2[O-])nc2[nH]ccc21 ZINC001244463291 1057965491 /nfs/dbraw/zinc/96/54/91/1057965491.db2.gz FAFAMLOCKSFDQD-UHFFFAOYSA-N -1 1 308.259 4.143 20 0 DIADMM [O-]c1cc(OC(F)(F)F)ccc1-c1ncccc1-n1cccc1 ZINC001244464427 1057965943 /nfs/dbraw/zinc/96/59/43/1057965943.db2.gz LABHIZKFFQUDGN-UHFFFAOYSA-N -1 1 320.270 4.144 20 0 DIADMM CSc1cccnc1-c1ccc(OC(F)(F)F)cc1[O-] ZINC001244464472 1057965950 /nfs/dbraw/zinc/96/59/50/1057965950.db2.gz NEVKZFGNVYGKKU-UHFFFAOYSA-N -1 1 301.289 4.075 20 0 DIADMM Cc1cc2cc(-c3ccc(OC(F)(F)F)cc3[O-])ncc2[nH]1 ZINC001244465000 1057966033 /nfs/dbraw/zinc/96/60/33/1057966033.db2.gz SUFJIVYQBXBRQE-UHFFFAOYSA-N -1 1 308.259 4.143 20 0 DIADMM O=c1c(-c2ccc(Cl)cc2[O-])cccn1-c1cccc(F)c1 ZINC001244472225 1057969580 /nfs/dbraw/zinc/96/95/80/1057969580.db2.gz OYLSTBHZKGGVNJ-UHFFFAOYSA-N -1 1 315.731 4.003 20 0 DIADMM O=C([O-])c1cc(Cl)c(-c2cccc3nc[nH]c32)c(Cl)c1 ZINC001244515365 1057983406 /nfs/dbraw/zinc/98/34/06/1057983406.db2.gz QBKWGHRYNFFSDT-UHFFFAOYSA-N -1 1 307.136 4.235 20 0 DIADMM Cc1ccc(-c2cnnc(-c3cc(C)c([O-])c(Cl)c3)n2)cc1 ZINC001244531658 1057987271 /nfs/dbraw/zinc/98/72/71/1057987271.db2.gz OHYYYXSHMUEVDC-UHFFFAOYSA-N -1 1 311.772 4.181 20 0 DIADMM Cc1cc(-c2cc(-c3ccccn3)nc(C)n2)cc(Cl)c1[O-] ZINC001244536236 1057988794 /nfs/dbraw/zinc/98/87/94/1057988794.db2.gz GKFBYRIPWBHBIP-UHFFFAOYSA-N -1 1 311.772 4.181 20 0 DIADMM Cc1cc(-c2ncnc3c2ccn3C(C)C)cc(Cl)c1[O-] ZINC001244536776 1057989171 /nfs/dbraw/zinc/98/91/71/1057989171.db2.gz PJFDIAPVKZMMGF-UHFFFAOYSA-N -1 1 301.777 4.347 20 0 DIADMM CSc1nc2c(c(-c3c(Cl)ccc([O-])c3F)n1)CCCC2 ZINC001244538899 1057989588 /nfs/dbraw/zinc/98/95/88/1057989588.db2.gz PKRUEAVNGKTSBV-UHFFFAOYSA-N -1 1 324.808 4.242 20 0 DIADMM Cc1cc(-c2cc3c(nn2)-c2ccccc2OC3)cc(Cl)c1[O-] ZINC001244537718 1057989623 /nfs/dbraw/zinc/98/96/23/1057989623.db2.gz CTEMPEFOUCNWCQ-UHFFFAOYSA-N -1 1 324.767 4.370 20 0 DIADMM CCCN(CCC)c1cncc(-c2c(Cl)ccc([O-])c2F)n1 ZINC001244539074 1057989887 /nfs/dbraw/zinc/98/98/87/1057989887.db2.gz QGGXYPQSBTTXKR-UHFFFAOYSA-N -1 1 323.799 4.268 20 0 DIADMM Cc1cc(C(=O)OC(C)C)cnc1-c1c(Cl)ccc([O-])c1F ZINC001244539510 1057990370 /nfs/dbraw/zinc/99/03/70/1057990370.db2.gz ZOGJVVIVIXHYKG-UHFFFAOYSA-N -1 1 323.751 4.120 20 0 DIADMM CSc1nc(-c2cc(C)c([O-])c(Cl)c2)cc(C(F)F)n1 ZINC001244539524 1057990518 /nfs/dbraw/zinc/99/05/18/1057990518.db2.gz VAIUFYYSCIAVEN-UHFFFAOYSA-N -1 1 316.760 4.471 20 0 DIADMM [O-]c1ccc(Cl)c(-c2ncnc3sc4c(c32)CCC4)c1F ZINC001244540430 1057990703 /nfs/dbraw/zinc/99/07/03/1057990703.db2.gz OLYACVHTZBGLJX-UHFFFAOYSA-N -1 1 320.776 4.345 20 0 DIADMM Cc1cc(-c2c(Cl)ccc([O-])c2F)cc2c1NC(=O)CC2 ZINC001244541365 1057991379 /nfs/dbraw/zinc/99/13/79/1057991379.db2.gz BVCFEGFOAJGNNU-UHFFFAOYSA-N -1 1 305.736 4.045 20 0 DIADMM CC1(C)CC(=O)Nc2ccc(-c3c(Cl)ccc([O-])c3F)cc21 ZINC001244541846 1057991477 /nfs/dbraw/zinc/99/14/77/1057991477.db2.gz UQCBHKTVSZMOKH-UHFFFAOYSA-N -1 1 319.763 4.472 20 0 DIADMM COC(=O)c1cc(F)cc(-c2c(Cl)ccc([O-])c2F)c1C ZINC001244541435 1057991681 /nfs/dbraw/zinc/99/16/81/1057991681.db2.gz CQCYKTZGPQGCPR-UHFFFAOYSA-N -1 1 312.699 4.086 20 0 DIADMM Cn1cncc1-c1ccc(-c2c(Cl)ccc([O-])c2F)cc1 ZINC001244543168 1057992310 /nfs/dbraw/zinc/99/23/10/1057992310.db2.gz VABDLQXTGZCGRW-UHFFFAOYSA-N -1 1 302.736 4.252 20 0 DIADMM [O-]c1ccc(Cl)c(-c2ccc(OC(F)(F)F)nc2)c1F ZINC001244543753 1057992387 /nfs/dbraw/zinc/99/23/87/1057992387.db2.gz VFSFMXVQCOPAJO-UHFFFAOYSA-N -1 1 307.630 4.145 20 0 DIADMM Cc1nc2cccc(-c3cc(C(=O)[O-])c(Cl)cc3F)c2[nH]1 ZINC001244613473 1058010045 /nfs/dbraw/zinc/01/00/45/1058010045.db2.gz MZAXPXVCVKVBMX-UHFFFAOYSA-N -1 1 304.708 4.029 20 0 DIADMM O=C([O-])c1cc(-c2cccc3nc[nH]c32)c(Cl)cc1Cl ZINC001245002011 1058089683 /nfs/dbraw/zinc/08/96/83/1058089683.db2.gz QRXRLBPMVUCVCA-UHFFFAOYSA-N -1 1 307.136 4.235 20 0 DIADMM COC(=O)c1cccc2cnc(-c3cc(Cl)ccc3[O-])cc21 ZINC001245048768 1058102714 /nfs/dbraw/zinc/10/27/14/1058102714.db2.gz MSLIZLFUVDMDDP-UHFFFAOYSA-N -1 1 313.740 4.047 20 0 DIADMM Cc1ccc(Cl)cc1NC(=S)Nc1cccc(F)c1[O-] ZINC001245170293 1058123502 /nfs/dbraw/zinc/12/35/02/1058123502.db2.gz SZILNDUWTXOULK-UHFFFAOYSA-N -1 1 310.781 4.302 20 0 DIADMM C[C@H](NC(=S)Nc1cccc([O-])c1Cl)c1ccccc1 ZINC001245517535 1058193176 /nfs/dbraw/zinc/19/31/76/1058193176.db2.gz AQKGBOQCUZWUDT-JTQLQIEISA-N -1 1 306.818 4.093 20 0 DIADMM CC(C)(C)OCc1ccc(NC(=O)c2cccc([O-])c2F)cc1 ZINC001545337726 1058195692 /nfs/dbraw/zinc/19/56/92/1058195692.db2.gz BBOWWAGAXOPKMZ-UHFFFAOYSA-N -1 1 317.360 4.099 20 0 DIADMM CC(C)C[C@@H]1CCCCN1C(=O)Cc1ccc([O-])c(Cl)c1 ZINC001545543212 1058211354 /nfs/dbraw/zinc/21/13/54/1058211354.db2.gz SMXBITHFBLPSLW-AWEZNQCLSA-N -1 1 309.837 4.015 20 0 DIADMM CC(C)CC[C@@H]1CCCN1C(=O)Cc1ccc([O-])c(Cl)c1 ZINC001545627095 1058216226 /nfs/dbraw/zinc/21/62/26/1058216226.db2.gz HPDXCVLPUWIIJC-AWEZNQCLSA-N -1 1 309.837 4.015 20 0 DIADMM Oc1cc(-c2ccc3[n-]c(=S)sc3c2)c(F)c(F)c1F ZINC001245636965 1058303259 /nfs/dbraw/zinc/30/32/59/1058303259.db2.gz HECFPJCLUWEOCZ-UHFFFAOYSA-N -1 1 313.325 4.375 20 0 DIADMM [O-]c1ccc(F)c(-c2ncccc2OC(F)(F)F)c1Cl ZINC001245826105 1058521171 /nfs/dbraw/zinc/52/11/71/1058521171.db2.gz BWKFYJCHVOUQTI-UHFFFAOYSA-N -1 1 307.630 4.145 20 0 DIADMM [O-]c1ccc(F)c(-c2nc(C(F)(F)F)ccc2F)c1Cl ZINC001245827217 1058522496 /nfs/dbraw/zinc/52/24/96/1058522496.db2.gz NBDHSMCMBNQPFM-UHFFFAOYSA-N -1 1 309.621 4.405 20 0 DIADMM [O-]c1ccc(F)c(-c2cc(-c3cccs3)ncn2)c1Cl ZINC001245829687 1058524407 /nfs/dbraw/zinc/52/44/07/1058524407.db2.gz FALFORDYGSAFLX-UHFFFAOYSA-N -1 1 306.749 4.370 20 0 DIADMM COc1ccc2nc(-c3c(F)ccc([O-])c3Cl)ccc2c1 ZINC001245828713 1058524857 /nfs/dbraw/zinc/52/48/57/1058524857.db2.gz ZXARYGFXBNEVHE-UHFFFAOYSA-N -1 1 303.720 4.409 20 0 DIADMM CCOC(=O)CCc1ccccc1-c1c(F)ccc([O-])c1Cl ZINC001245831232 1058527230 /nfs/dbraw/zinc/52/72/30/1058527230.db2.gz AQAGHPHVSKOGQK-UHFFFAOYSA-N -1 1 322.763 4.347 20 0 DIADMM COc1cnc(-c2c(F)ccc([O-])c2Cl)c2ccccc12 ZINC001245830399 1058527874 /nfs/dbraw/zinc/52/78/74/1058527874.db2.gz MQOXMZPTBJDYIM-UHFFFAOYSA-N -1 1 303.720 4.409 20 0 DIADMM [O-]c1ccc(F)c(-c2ccnc(Cc3ccccc3)n2)c1Cl ZINC001245830665 1058528076 /nfs/dbraw/zinc/52/80/76/1058528076.db2.gz SGIJJKPRTOKWLI-UHFFFAOYSA-N -1 1 314.747 4.233 20 0 DIADMM CCc1nc2sccc2c(-c2c(F)ccc([O-])c2Cl)n1 ZINC001245830925 1058528236 /nfs/dbraw/zinc/52/82/36/1058528236.db2.gz ZTSVRAKPVBBVRS-UHFFFAOYSA-N -1 1 308.765 4.419 20 0 DIADMM CCOC(=O)c1ccc(OC)cc1-c1c(F)ccc([O-])c1Cl ZINC001245831291 1058528348 /nfs/dbraw/zinc/52/83/48/1058528348.db2.gz IZNSXWIKXARDHS-UHFFFAOYSA-N -1 1 324.735 4.037 20 0 DIADMM [O-]c1ccc(F)c(-c2cc(C3CC3)nc(C3CC3)n2)c1Cl ZINC001245830890 1058529230 /nfs/dbraw/zinc/52/92/30/1058529230.db2.gz YBXOPUZPSIBONX-UHFFFAOYSA-N -1 1 304.752 4.397 20 0 DIADMM Cc1nc(-c2ccccn2)cc(-c2c(F)ccc([O-])c2Cl)n1 ZINC001245830371 1058529713 /nfs/dbraw/zinc/52/97/13/1058529713.db2.gz LXMNJNCINHKZCK-UHFFFAOYSA-N -1 1 315.735 4.012 20 0 DIADMM COc1ccc2ccnc(-c3c(F)ccc([O-])c3Cl)c2c1 ZINC001245830441 1058530008 /nfs/dbraw/zinc/53/00/08/1058530008.db2.gz NYBLHIJMUKVYKS-UHFFFAOYSA-N -1 1 303.720 4.409 20 0 DIADMM COC(=O)c1cc2[nH]ccc2c(-c2c(F)ccc([O-])c2Cl)c1 ZINC001245831400 1058531648 /nfs/dbraw/zinc/53/16/48/1058531648.db2.gz KXDVTADMJCMRNZ-UHFFFAOYSA-N -1 1 319.719 4.120 20 0 DIADMM [O-]c1ccc(F)c(-c2ccnc(N3CCCCC3)c2)c1Cl ZINC001245831726 1058534338 /nfs/dbraw/zinc/53/43/38/1058534338.db2.gz DGLGHAZIHSAMHL-UHFFFAOYSA-N -1 1 306.768 4.237 20 0 DIADMM [O-]c1ccc(F)c(-c2ncnc3c(F)c(F)ccc32)c1Cl ZINC001245833006 1058535899 /nfs/dbraw/zinc/53/58/99/1058535899.db2.gz RPSAXWHGNYMVCV-UHFFFAOYSA-N -1 1 310.662 4.073 20 0 DIADMM COC(=O)c1c(F)cc(C)cc1-c1c(F)ccc([O-])c1Cl ZINC001245833785 1058536001 /nfs/dbraw/zinc/53/60/01/1058536001.db2.gz BYLLISKKFHLNCB-UHFFFAOYSA-N -1 1 312.699 4.086 20 0 DIADMM [O-]c1ccc(F)c(-c2cccc(COCC3CC3)n2)c1Cl ZINC001245833242 1058536429 /nfs/dbraw/zinc/53/64/29/1058536429.db2.gz WJYLOTUIBUJWEE-UHFFFAOYSA-N -1 1 307.752 4.173 20 0 DIADMM Cc1cc(-c2c(F)ccc([O-])c2Cl)cc(OC(F)F)n1 ZINC001245834026 1058536927 /nfs/dbraw/zinc/53/69/27/1058536927.db2.gz BQHHSERMGSRDNR-UHFFFAOYSA-N -1 1 303.667 4.157 20 0 DIADMM COc1ccc2ccc(-c3c(F)ccc([O-])c3Cl)cc2n1 ZINC001245833374 1058538340 /nfs/dbraw/zinc/53/83/40/1058538340.db2.gz YYFLQAJSHGXSHW-UHFFFAOYSA-N -1 1 303.720 4.409 20 0 DIADMM Cc1ccc(NC(=S)Nc2cccc(F)c2[O-])cc1Cl ZINC001245847738 1058552981 /nfs/dbraw/zinc/55/29/81/1058552981.db2.gz ZJPZHSUARAQYSR-UHFFFAOYSA-N -1 1 310.781 4.302 20 0 DIADMM C[C@H]1CCC[C@@H](NC(=O)c2ccc(C(F)(F)F)c([O-])c2)CC1 ZINC001556236006 1058565710 /nfs/dbraw/zinc/56/57/10/1058565710.db2.gz TZGZAVSJIVUQOY-CMPLNLGQSA-N -1 1 315.335 4.110 20 0 DIADMM CC[C@@H](NC(=O)c1ccc(C(F)(F)F)c([O-])c1)C1CCCC1 ZINC001556592149 1058617170 /nfs/dbraw/zinc/61/71/70/1058617170.db2.gz ZKPCXUIGXMDKED-CYBMUJFWSA-N -1 1 315.335 4.110 20 0 DIADMM O=C(Nc1ccc([O-])c(F)c1F)c1cccc2ccsc21 ZINC001556591843 1058618684 /nfs/dbraw/zinc/61/86/84/1058618684.db2.gz MODYWJCSUBFHQB-UHFFFAOYSA-N -1 1 305.305 4.137 20 0 DIADMM CCc1ccc(C(=O)Nc2ccnn2[C@H](C)CC(C)C)c([O-])c1 ZINC001556872534 1058660745 /nfs/dbraw/zinc/66/07/45/1058660745.db2.gz SJZYFTBBYCDTLR-CYBMUJFWSA-N -1 1 315.417 4.011 20 0 DIADMM O=C(Nc1cc([O-])c(F)cc1F)c1csc2ccccc12 ZINC001556919734 1058669605 /nfs/dbraw/zinc/66/96/05/1058669605.db2.gz NLBHPYVVDQBHIZ-UHFFFAOYSA-N -1 1 305.305 4.137 20 0 DIADMM C[C@H](C(=O)Nc1cc(F)cc(F)c1[O-])c1cccc(Cl)c1 ZINC001557086116 1058697100 /nfs/dbraw/zinc/69/71/00/1058697100.db2.gz HYXPYKRQUKILPP-QMMMGPOBSA-N -1 1 311.715 4.066 20 0 DIADMM O=C(c1ncc2ccccc2c1[O-])N1CCC[C@H]1CC1CCCC1 ZINC001557291695 1058728634 /nfs/dbraw/zinc/72/86/34/1058728634.db2.gz CTWPINVAGWWMCB-INIZCTEOSA-N -1 1 324.424 4.125 20 0 DIADMM O=C(CCCc1ccc(C2CC2)cc1)Nc1c([O-])cccc1F ZINC001557409857 1058746392 /nfs/dbraw/zinc/74/63/92/1058746392.db2.gz ZBPSPJWKTLJARW-UHFFFAOYSA-N -1 1 313.372 4.370 20 0 DIADMM CSc1cc(Cl)ccc1NC(=O)c1ccc([O-])c(F)c1 ZINC001557448597 1058750644 /nfs/dbraw/zinc/75/06/44/1058750644.db2.gz QFJAPPBICDODKC-UHFFFAOYSA-N -1 1 311.765 4.159 20 0 DIADMM O=C(N[C@@H]1CCCC12CCCCC2)c1ncc2ccccc2c1[O-] ZINC001557484331 1058755735 /nfs/dbraw/zinc/75/57/35/1058755735.db2.gz MMDYPNNHRKRPOY-MRXNPFEDSA-N -1 1 324.424 4.173 20 0 DIADMM O=C(Nc1cccc(F)c1[O-])c1cccc(Cl)c1Cl ZINC001557956058 1058818446 /nfs/dbraw/zinc/81/84/46/1058818446.db2.gz JGVFZZPACPMXGP-UHFFFAOYSA-N -1 1 300.116 4.090 20 0 DIADMM O=C(CCc1ccc(C(F)F)cc1)Nc1cccc(F)c1[O-] ZINC001557956749 1058818826 /nfs/dbraw/zinc/81/88/26/1058818826.db2.gz OHYKXHUJCWYGMM-UHFFFAOYSA-N -1 1 309.287 4.040 20 0 DIADMM Cc1c2ccccc2oc1C(=O)NCc1ccc([O-])c(Cl)c1 ZINC001558209323 1058852737 /nfs/dbraw/zinc/85/27/37/1058852737.db2.gz RFIFBDWZLASDAR-UHFFFAOYSA-N -1 1 315.756 4.030 20 0 DIADMM Cc1ccc(C(=O)Nc2nc(Cl)ccc2[O-])c2ccccc12 ZINC001558966312 1058929738 /nfs/dbraw/zinc/92/97/38/1058929738.db2.gz HZHHXDIMHCKACA-UHFFFAOYSA-N -1 1 312.756 4.155 20 0 DIADMM CCCCc1ccc(C(=O)Nc2nc(Cl)ccc2[O-])cc1 ZINC001558966286 1058930172 /nfs/dbraw/zinc/93/01/72/1058930172.db2.gz GVTYWOMDALBGGM-UHFFFAOYSA-N -1 1 304.777 4.036 20 0 DIADMM Cc1nc(S[C@@H]2CCCc3c(Cl)ccnc32)[n-]c(=O)c1C ZINC001559393060 1059203544 /nfs/dbraw/zinc/20/35/44/1059203544.db2.gz KAICIFUDJPVUIH-GFCCVEGCSA-N -1 1 321.833 4.017 20 0 DIADMM Cc1cc(F)cc(-c2noc(Cc3ccc([O-])c(Cl)c3)n2)c1 ZINC001247587408 1059565180 /nfs/dbraw/zinc/56/51/80/1059565180.db2.gz CRHGNHJVTHKMMR-UHFFFAOYSA-N -1 1 318.735 4.134 20 0 DIADMM CCC(CC)CN(CC)C(=O)NCc1ccc([O-])c(Cl)c1 ZINC001248407896 1059817413 /nfs/dbraw/zinc/81/74/13/1059817413.db2.gz ZTEPFBZOBGNGSG-UHFFFAOYSA-N -1 1 312.841 4.013 20 0 DIADMM CCc1cccc(CC)c1NC(=S)Nc1ccc(F)cc1[O-] ZINC001248668687 1059928450 /nfs/dbraw/zinc/92/84/50/1059928450.db2.gz GWQCGROSIRYIAM-UHFFFAOYSA-N -1 1 318.417 4.465 20 0 DIADMM CCc1cccc(C)c1NC(=S)Nc1cc(F)cc(F)c1[O-] ZINC001249567013 1060294421 /nfs/dbraw/zinc/29/44/21/1060294421.db2.gz ZFDMTGLIUDVUTA-UHFFFAOYSA-N -1 1 322.380 4.350 20 0 DIADMM Cc1cc(C)c(NC(=S)Nc2cc(F)c(F)cc2[O-])c(C)c1 ZINC001249733907 1060377895 /nfs/dbraw/zinc/37/78/95/1060377895.db2.gz WWPUSZQZBFMUJX-UHFFFAOYSA-N -1 1 322.380 4.405 20 0 DIADMM Cc1cc(C)c(NC(=S)Nc2cc([O-])c(F)cc2F)c(C)c1 ZINC001249732295 1060379674 /nfs/dbraw/zinc/37/96/74/1060379674.db2.gz WERKFHBBPOMQTF-UHFFFAOYSA-N -1 1 322.380 4.405 20 0 DIADMM [O-]c1cc(Nc2nc(C(F)(F)F)cs2)c(F)c(F)c1F ZINC001249957577 1060499892 /nfs/dbraw/zinc/49/98/92/1060499892.db2.gz CUVCPMNDAMOSJG-UHFFFAOYSA-N -1 1 314.210 4.028 20 0 DIADMM [O-]c1cc(Nc2cnc(-c3ccccc3)cn2)c(F)c(F)c1F ZINC001249958461 1060503260 /nfs/dbraw/zinc/50/32/60/1060503260.db2.gz ODPPUPJRRJVZJM-UHFFFAOYSA-N -1 1 317.270 4.010 20 0 DIADMM [O-]c1cc(Nc2cccnc2-c2ccccn2)c(F)c(F)c1F ZINC001249961527 1060503630 /nfs/dbraw/zinc/50/36/30/1060503630.db2.gz SIRSMANCQAVSAP-UHFFFAOYSA-N -1 1 317.270 4.010 20 0 DIADMM [O-]c1cc(Nc2cnc(Cl)c(Cl)c2)c(F)c(F)c1F ZINC001249958790 1060504354 /nfs/dbraw/zinc/50/43/54/1060504354.db2.gz PNYMNKTUUVNJCX-UHFFFAOYSA-N -1 1 309.074 4.255 20 0 DIADMM [O-]c1cc(Nc2cc(-c3ccncn3)cs2)c(F)c(F)c1F ZINC001249960318 1060504888 /nfs/dbraw/zinc/50/48/88/1060504888.db2.gz BFFKCUPONAVYCA-UHFFFAOYSA-N -1 1 323.299 4.072 20 0 DIADMM [O-]c1cc(Nc2ccc(Cl)nc2Cl)c(F)c(F)c1F ZINC001249958116 1060505307 /nfs/dbraw/zinc/50/53/07/1060505307.db2.gz JKNABZGWPFIYSG-UHFFFAOYSA-N -1 1 309.074 4.255 20 0 DIADMM [O-]c1cc(Nc2nc(Cl)ccc2Cl)c(F)c(F)c1F ZINC001249961476 1060505799 /nfs/dbraw/zinc/50/57/99/1060505799.db2.gz QURDRNLRNOIONB-UHFFFAOYSA-N -1 1 309.074 4.255 20 0 DIADMM COc1nc(Nc2cc([O-])c(F)c(F)c2F)cc2ccccc21 ZINC001249961235 1060506048 /nfs/dbraw/zinc/50/60/48/1060506048.db2.gz MEGUOFQEWKHFAA-UHFFFAOYSA-N -1 1 320.270 4.110 20 0 DIADMM [O-]c1cc(Nc2c(O)ccc3ccccc32)c(F)c(F)c1F ZINC001249962809 1060509980 /nfs/dbraw/zinc/50/99/80/1060509980.db2.gz GULMAULNKROJEL-UHFFFAOYSA-N -1 1 305.255 4.412 20 0 DIADMM CC(C)Oc1cc(F)ccc1Nc1cc([O-])c(F)c(F)c1F ZINC001249966056 1060511789 /nfs/dbraw/zinc/51/17/89/1060511789.db2.gz ZGLCVMFCWVDEAH-UHFFFAOYSA-N -1 1 315.266 4.479 20 0 DIADMM Cc1cc(Cl)c(Nc2cc([O-])c(F)c(F)c2F)cc1O ZINC001249965998 1060513061 /nfs/dbraw/zinc/51/30/61/1060513061.db2.gz WRDHTYQEEQCCOT-UHFFFAOYSA-N -1 1 303.667 4.221 20 0 DIADMM CN1Cc2ccc(Nc3cc(Cl)cc(Cl)c3[O-])cc2C1=O ZINC001249981955 1060519285 /nfs/dbraw/zinc/51/92/85/1060519285.db2.gz IVFIQVDNLKEIRE-UHFFFAOYSA-N -1 1 323.179 4.028 20 0 DIADMM [O-]c1cc(Cc2ccc(C(F)(F)F)cc2)c(F)c(F)c1F ZINC001249997699 1060532857 /nfs/dbraw/zinc/53/28/57/1060532857.db2.gz UFEIPFGPQKRACQ-UHFFFAOYSA-N -1 1 306.205 4.419 20 0 DIADMM [O-]c1cc(F)c(Nc2ccnn2-c2ccc(F)cc2)cc1Cl ZINC001250020344 1060542676 /nfs/dbraw/zinc/54/26/76/1060542676.db2.gz QVQABDHNOFAENR-UHFFFAOYSA-N -1 1 321.714 4.253 20 0 DIADMM [O-]c1cc(F)c(Nc2ccc(Br)cn2)cc1Cl ZINC001250018041 1060543883 /nfs/dbraw/zinc/54/38/83/1060543883.db2.gz MRCYDSKRYBAAFE-UHFFFAOYSA-N -1 1 317.545 4.086 20 0 DIADMM [O-]c1cc(F)c(Nc2ccnn2-c2ccccc2)cc1Cl ZINC001250019707 1060544745 /nfs/dbraw/zinc/54/47/45/1060544745.db2.gz AQJYYUSUWAHDAS-UHFFFAOYSA-N -1 1 303.724 4.114 20 0 DIADMM Nc1cc(F)c(Cl)cc1Nc1cc(Cl)c([O-])cc1F ZINC001250022804 1060547505 /nfs/dbraw/zinc/54/75/05/1060547505.db2.gz VVFARAZLCPZYQI-UHFFFAOYSA-N -1 1 305.111 4.303 20 0 DIADMM [O-]c1cc(F)c(Nc2cc(-c3ccccc3)cnn2)cc1Cl ZINC001250022931 1060548978 /nfs/dbraw/zinc/54/89/78/1060548978.db2.gz ZGJPWNVPPMZWCW-UHFFFAOYSA-N -1 1 315.735 4.385 20 0 DIADMM COc1cc(Nc2cc(Cl)c([O-])cc2F)cc(F)c1F ZINC001250025234 1060551208 /nfs/dbraw/zinc/55/12/08/1060551208.db2.gz FNMDQLDOHJLRGW-UHFFFAOYSA-N -1 1 303.667 4.215 20 0 DIADMM COc1c(F)c(F)ccc1Nc1cc(Cl)c([O-])cc1F ZINC001250026258 1060551585 /nfs/dbraw/zinc/55/15/85/1060551585.db2.gz PUGMTWUUWVPSDM-UHFFFAOYSA-N -1 1 303.667 4.215 20 0 DIADMM COC(=O)[C@@H](C)c1ccc(Nc2cc(Cl)c([O-])cc2F)cc1 ZINC001250025214 1060551822 /nfs/dbraw/zinc/55/18/22/1060551822.db2.gz DRBRYHFISLMURL-VIFPVBQESA-N -1 1 323.751 4.205 20 0 DIADMM O=c1[nH]ccc2c(Nc3cc(Cl)c([O-])cc3F)cccc12 ZINC001250024084 1060552277 /nfs/dbraw/zinc/55/22/77/1060552277.db2.gz PUSBAFZAOXUFJR-UHFFFAOYSA-N -1 1 304.708 4.182 20 0 DIADMM COc1ccc(Nc2cc(Cl)c([O-])cc2F)c2ccncc12 ZINC001250026734 1060554969 /nfs/dbraw/zinc/55/49/69/1060554969.db2.gz ULAWWHORVBOCNZ-UHFFFAOYSA-N -1 1 318.735 4.485 20 0 DIADMM Cc1c(Cl)ccc(N)c1Nc1cc(Cl)c([O-])cc1F ZINC001250026890 1060555472 /nfs/dbraw/zinc/55/54/72/1060555472.db2.gz QRAPILUBJWARTL-UHFFFAOYSA-N -1 1 301.148 4.472 20 0 DIADMM COc1c(F)c(Cl)ccc1Nc1cc([O-])c(F)c(F)c1 ZINC001250194235 1060673511 /nfs/dbraw/zinc/67/35/11/1060673511.db2.gz HZDSEMBZUAFMSD-UHFFFAOYSA-N -1 1 303.667 4.215 20 0 DIADMM [O-]c1ccc(F)c(Nc2cncc(Br)c2)c1Cl ZINC001250228179 1060705433 /nfs/dbraw/zinc/70/54/33/1060705433.db2.gz PDHYXQGQTTWSRF-UHFFFAOYSA-N -1 1 317.545 4.086 20 0 DIADMM COC(=O)c1sc(C)cc1Nc1c(F)ccc([O-])c1Cl ZINC001250228368 1060708504 /nfs/dbraw/zinc/70/85/04/1060708504.db2.gz YZIKFQAOZKKSBM-UHFFFAOYSA-N -1 1 315.753 4.085 20 0 DIADMM CC(=O)c1ccnc(Cl)c1Nc1c(F)ccc([O-])c1Cl ZINC001250228687 1060709582 /nfs/dbraw/zinc/70/95/82/1060709582.db2.gz KOPTXZYPNVSBIB-UHFFFAOYSA-N -1 1 315.131 4.179 20 0 DIADMM CCOC(=O)Cc1ccc(Nc2c(F)ccc([O-])c2Cl)cc1 ZINC001250232611 1060711434 /nfs/dbraw/zinc/71/14/34/1060711434.db2.gz SGHHMOINYQINPT-UHFFFAOYSA-N -1 1 323.751 4.034 20 0 DIADMM [O-]c1ccc(F)c(Nc2cccc(Cn3cccn3)c2)c1Cl ZINC001250233729 1060713675 /nfs/dbraw/zinc/71/36/75/1060713675.db2.gz VNJZOCSGGKAPHN-UHFFFAOYSA-N -1 1 317.751 4.173 20 0 DIADMM [O-]c1ccc(F)c(Nc2cc(OC(F)(F)F)ccn2)c1Cl ZINC001250234227 1060713882 /nfs/dbraw/zinc/71/38/82/1060713882.db2.gz LVDYNUJEDGQJOA-UHFFFAOYSA-N -1 1 322.645 4.222 20 0 DIADMM CC1(C)Oc2ccc(Nc3c(F)ccc([O-])c3Cl)cc2O1 ZINC001250233197 1060714263 /nfs/dbraw/zinc/71/42/63/1060714263.db2.gz KBWDCSBDBFJBKM-UHFFFAOYSA-N -1 1 309.724 4.436 20 0 DIADMM [O-]c1ccc(F)c(Nc2cccc(-n3ccnc3)c2)c1Cl ZINC001250234232 1060714330 /nfs/dbraw/zinc/71/43/30/1060714330.db2.gz MCJHERFRMAXXRW-UHFFFAOYSA-N -1 1 303.724 4.114 20 0 DIADMM [O-]c1ccc(F)c(Nc2csc(-c3ccncc3)n2)c1Cl ZINC001250233985 1060714627 /nfs/dbraw/zinc/71/46/27/1060714627.db2.gz IDFIRLKCLBWMFU-UHFFFAOYSA-N -1 1 321.764 4.447 20 0 DIADMM [O-]c1ccc(F)c(Nc2cccnc2OC(F)(F)F)c1Cl ZINC001250234749 1060716010 /nfs/dbraw/zinc/71/60/10/1060716010.db2.gz WRSZOTCCADWHAV-UHFFFAOYSA-N -1 1 322.645 4.222 20 0 DIADMM COc1ccc(Nc2c(F)ccc([O-])c2Cl)c(OC)c1F ZINC001250236410 1060717246 /nfs/dbraw/zinc/71/72/46/1060717246.db2.gz PCARHXLSTGKZRQ-UHFFFAOYSA-N -1 1 315.703 4.085 20 0 DIADMM COc1cnc2c(cccc2Nc2c(F)ccc([O-])c2Cl)c1 ZINC001250236056 1060717879 /nfs/dbraw/zinc/71/78/79/1060717879.db2.gz GTYGTBRQEYJFHK-UHFFFAOYSA-N -1 1 318.735 4.485 20 0 DIADMM Cc1ccc(CCCO)c(Nc2c(F)ccc([O-])c2Cl)c1 ZINC001250236852 1060718478 /nfs/dbraw/zinc/71/84/78/1060718478.db2.gz WYZOOGLMCDNHAW-UHFFFAOYSA-N -1 1 309.768 4.162 20 0 DIADMM [O-]c1ccc(F)c(Nc2ccc(CO)cc2Cl)c1Cl ZINC001250237135 1060720129 /nfs/dbraw/zinc/72/01/29/1060720129.db2.gz BTHFNSYUFBSFCV-UHFFFAOYSA-N -1 1 302.132 4.074 20 0 DIADMM CC(C)(C)[C@@H](C(=O)[O-])c1ccc(Nc2ccc3cncn3c2)cc1 ZINC001250331750 1060782750 /nfs/dbraw/zinc/78/27/50/1060782750.db2.gz BREGNCBGDKHMFJ-QGZVFWFLSA-N -1 1 323.396 4.292 20 0 DIADMM CC(C)c1ccc2c(c1)CN(Cc1ccc([O-])c(F)c1F)CC2 ZINC001560922296 1060785642 /nfs/dbraw/zinc/78/56/42/1060785642.db2.gz PZYLRUULMLTRSR-UHFFFAOYSA-N -1 1 317.379 4.352 20 0 DIADMM CCCC[C@H](CCC)C[N-]S(=O)(=O)c1cc2ccccc2o1 ZINC001561360491 1060927074 /nfs/dbraw/zinc/92/70/74/1060927074.db2.gz QMLPAGRTJZAIPM-AWEZNQCLSA-N -1 1 323.458 4.318 20 0 DIADMM CCCn1c(-c2c([O-])cccc2F)nc2ccc(F)c(F)c21 ZINC001250674512 1061006932 /nfs/dbraw/zinc/00/69/32/1061006932.db2.gz SDHTXAFBBPUVHD-UHFFFAOYSA-N -1 1 306.287 4.236 20 0 DIADMM Cc1cc2nc(-c3cccc([O-])c3Br)[nH]c2cc1C ZINC001250881405 1061107160 /nfs/dbraw/zinc/10/71/60/1061107160.db2.gz VLOOSMWTDNPVFS-UHFFFAOYSA-N -1 1 317.186 4.315 20 0 DIADMM [O-]c1cccc(-c2nc3cc(Cl)ccc3[nH]2)c1Br ZINC001250880977 1061107668 /nfs/dbraw/zinc/10/76/68/1061107668.db2.gz OUBHNHKMJBNBNL-UHFFFAOYSA-N -1 1 323.577 4.351 20 0 DIADMM Cc1cc2[nH]c(-c3cccc([O-])c3Br)nc2c(C)c1 ZINC001250880575 1061107755 /nfs/dbraw/zinc/10/77/55/1061107755.db2.gz NGVRZDKVHPNXQA-UHFFFAOYSA-N -1 1 317.186 4.315 20 0 DIADMM CN(C)c1ccc2nc(-c3cc(Cl)c([O-])c(Cl)c3)[nH]c2c1 ZINC001250911239 1061122484 /nfs/dbraw/zinc/12/24/84/1061122484.db2.gz DTZJVMUXGVTCEO-UHFFFAOYSA-N -1 1 322.195 4.308 20 0 DIADMM [O-]c1ccc(-c2nc3ccccc3n2CC2CC2)c(F)c1F ZINC001250915397 1061124803 /nfs/dbraw/zinc/12/48/03/1061124803.db2.gz ZIYFRQBPNWSOEH-UHFFFAOYSA-N -1 1 300.308 4.097 20 0 DIADMM [O-]c1ccc(-c2nc3c(cc(Cl)c(F)c3F)[nH]2)c(F)c1F ZINC001250915190 1061124898 /nfs/dbraw/zinc/12/48/98/1061124898.db2.gz RSSAWYPFLMDPDE-UHFFFAOYSA-N -1 1 316.641 4.145 20 0 DIADMM Cc1ccc(Cl)c(Cl)c1[N-]S(=O)(=O)c1cccs1 ZINC001250931672 1061131512 /nfs/dbraw/zinc/13/15/12/1061131512.db2.gz LBDXHPHIUFAKGJ-UHFFFAOYSA-N -1 1 322.238 4.164 20 0 DIADMM [O-]c1cc(F)c(F)cc1-c1nc2ccccc2n1CC1CC1 ZINC001250967349 1061153212 /nfs/dbraw/zinc/15/32/12/1061153212.db2.gz NDNBUJJZSJNHEB-UHFFFAOYSA-N -1 1 300.308 4.097 20 0 DIADMM [O-]c1cc(F)c(-c2nc3c(cc(Cl)c(F)c3F)[nH]2)c(F)c1 ZINC001251007923 1061178862 /nfs/dbraw/zinc/17/88/62/1061178862.db2.gz SGXNNVMXKGXSJX-UHFFFAOYSA-N -1 1 316.641 4.145 20 0 DIADMM Cc1c2[nH]c(-c3cc(C(=O)[O-])ccc3F)nc2ccc1Cl ZINC001251014173 1061183384 /nfs/dbraw/zinc/18/33/84/1061183384.db2.gz BRKOFQAMXPDCKP-UHFFFAOYSA-N -1 1 304.708 4.029 20 0 DIADMM Cn1c2ccc3ncccc3c2nc1-c1ccc(Cl)c([O-])c1 ZINC001251037691 1061194717 /nfs/dbraw/zinc/19/47/17/1061194717.db2.gz YLFRPNZPNFAFCX-UHFFFAOYSA-N -1 1 309.756 4.148 20 0 DIADMM COc1ccc(-c2nc3ccc(C(C)C)cc3[nH]2)cc1C(=O)[O-] ZINC001251038886 1061197531 /nfs/dbraw/zinc/19/75/31/1061197531.db2.gz QYIXCRBHCAHDBZ-UHFFFAOYSA-N -1 1 310.353 4.060 20 0 DIADMM CCSc1ccc(CNC(=O)c2cc(Cl)ccc2[O-])cc1 ZINC001455227766 1061213781 /nfs/dbraw/zinc/21/37/81/1061213781.db2.gz QERJUMYISPSYRX-UHFFFAOYSA-N -1 1 321.829 4.088 20 0 DIADMM CC(C)n1c2ccc(F)cc2nc1-c1cc(Cl)c([O-])cc1O ZINC001251082517 1061225816 /nfs/dbraw/zinc/22/58/16/1061225816.db2.gz JFUOHAWKQQFASY-UHFFFAOYSA-N -1 1 320.751 4.488 20 0 DIADMM CCc1ccc2ccccc2c1CNC(=O)c1c([O-])cccc1F ZINC001455552864 1061228794 /nfs/dbraw/zinc/22/87/94/1061228794.db2.gz JUYUPMQQGJMLPK-UHFFFAOYSA-N -1 1 323.367 4.177 20 0 DIADMM CCCn1c2cc(OC)ccc2nc1-c1cccc([O-])c1Cl ZINC001251203743 1061269185 /nfs/dbraw/zinc/26/91/85/1061269185.db2.gz OIIYMLYCYJVGJK-UHFFFAOYSA-N -1 1 316.788 4.481 20 0 DIADMM Cc1ccc2c(c1)nc(-c1c([O-])ccc(F)c1F)n2CC1CC1 ZINC001251322466 1061311951 /nfs/dbraw/zinc/31/19/51/1061311951.db2.gz VFXWDQCCFIVXGF-UHFFFAOYSA-N -1 1 314.335 4.406 20 0 DIADMM [O-]c1ccc(F)c(F)c1-c1nc2cc(-c3ccncc3)ccc2[nH]1 ZINC001251322398 1061312451 /nfs/dbraw/zinc/31/24/51/1061312451.db2.gz SDFSWVHWMWQERZ-UHFFFAOYSA-N -1 1 323.302 4.276 20 0 DIADMM CCCn1c2ccc(F)cc2nc1-c1c([O-])ccc(F)c1F ZINC001251321799 1061313607 /nfs/dbraw/zinc/31/36/07/1061313607.db2.gz FOFOQOWLSPYMTN-UHFFFAOYSA-N -1 1 306.287 4.236 20 0 DIADMM Cn1c(-c2cccc(C(F)(F)F)c2[O-])nc2cccc(F)c21 ZINC001251341131 1061325195 /nfs/dbraw/zinc/32/51/95/1061325195.db2.gz NAXQPNDKSUZONH-UHFFFAOYSA-N -1 1 310.250 4.104 20 0 DIADMM [O-]c1c(-c2nc3c(ccc(F)c3F)[nH]2)cccc1C(F)(F)F ZINC001251341286 1061325775 /nfs/dbraw/zinc/32/57/75/1061325775.db2.gz WYVSZJHWMAKHON-UHFFFAOYSA-N -1 1 314.213 4.233 20 0 DIADMM Cc1ccc2oc(C(=O)Nc3cc(F)c([O-])cc3Cl)cc2c1 ZINC001456604164 1061343397 /nfs/dbraw/zinc/34/33/97/1061343397.db2.gz IRRICHUMQJJSSL-UHFFFAOYSA-N -1 1 319.719 4.492 20 0 DIADMM Cc1cccc2nc(-c3cc(F)cc(Br)c3[O-])[nH]c21 ZINC001251406745 1061343748 /nfs/dbraw/zinc/34/37/48/1061343748.db2.gz OYMNRGIAKAJBBA-UHFFFAOYSA-N -1 1 321.149 4.146 20 0 DIADMM Cc1c2nc(-c3ccc(Br)c([O-])c3)[nH]c2ccc1F ZINC001251473990 1061372095 /nfs/dbraw/zinc/37/20/95/1061372095.db2.gz XUDUCFSEEBURFE-UHFFFAOYSA-N -1 1 321.149 4.146 20 0 DIADMM [O-]c1cc(-c2nc3cc(F)c(C(F)(F)F)cc3[nH]2)ccc1F ZINC001251477567 1061375174 /nfs/dbraw/zinc/37/51/74/1061375174.db2.gz QDBVTZZWHNTORM-UHFFFAOYSA-N -1 1 314.213 4.233 20 0 DIADMM COc1ccc(-c2nc3ccc(Cl)cc3[nH]2)c([O-])c1Cl ZINC001251490872 1061377691 /nfs/dbraw/zinc/37/76/91/1061377691.db2.gz ANUDIYSDQHKQEI-UHFFFAOYSA-N -1 1 309.152 4.251 20 0 DIADMM CCn1c2cc(C)ccc2nc1-c1c([O-])cc(OC)cc1Cl ZINC001251490893 1061378518 /nfs/dbraw/zinc/37/85/18/1061378518.db2.gz BGQSVAZDAHZXIQ-UHFFFAOYSA-N -1 1 316.788 4.399 20 0 DIADMM CCOc1ccc2nc(-c3c([O-])ccc(F)c3Cl)n(C)c2c1 ZINC001251540697 1061396487 /nfs/dbraw/zinc/39/64/87/1061396487.db2.gz MYUPSMZSGPTOFN-UHFFFAOYSA-N -1 1 320.751 4.137 20 0 DIADMM Cc1ccc2nc(-c3cc(Cl)nc(Cl)c3[O-])[nH]c2c1C ZINC001251613635 1061418574 /nfs/dbraw/zinc/41/85/74/1061418574.db2.gz LMBMTZMYMHXCAV-UHFFFAOYSA-N -1 1 308.168 4.254 20 0 DIADMM COc1cc2[nH]c(-c3cc(F)c([O-])c(Cl)c3)nc2cc1C ZINC001251692879 1061446234 /nfs/dbraw/zinc/44/62/34/1061446234.db2.gz VVANNLABUBFIHG-UHFFFAOYSA-N -1 1 306.724 4.045 20 0 DIADMM COc1cc2[nH]c(-c3cc(Cl)c([O-])cc3F)nc2cc1C ZINC001251711124 1061453361 /nfs/dbraw/zinc/45/33/61/1061453361.db2.gz XYIZOORQDGKIPY-UHFFFAOYSA-N -1 1 306.724 4.045 20 0 DIADMM Cc1cc([N-]S(=O)(=O)c2ccc(Cl)cc2)cc(C)c1C ZINC001251735120 1061464236 /nfs/dbraw/zinc/46/42/36/1061464236.db2.gz BEXJGOBBUVLUJF-UHFFFAOYSA-N -1 1 309.818 4.066 20 0 DIADMM O=C(CCc1cccc2ccccc21)Nc1ccc(F)cc1[O-] ZINC001457716166 1061487381 /nfs/dbraw/zinc/48/73/81/1061487381.db2.gz PRHQOLOCKKQRKR-UHFFFAOYSA-N -1 1 309.340 4.256 20 0 DIADMM O=C(CCCCCc1ccc(F)cc1)Nc1ccc(F)cc1[O-] ZINC001457717117 1061489577 /nfs/dbraw/zinc/48/95/77/1061489577.db2.gz WJKHYOUTXXZOGO-UHFFFAOYSA-N -1 1 319.351 4.412 20 0 DIADMM C[C@@H](CCCc1ccccc1)C(=O)Nc1nc(Cl)ccc1[O-] ZINC001457763867 1061496930 /nfs/dbraw/zinc/49/69/30/1061496930.db2.gz ORBZTOCYBGRASS-LBPRGKRZSA-N -1 1 318.804 4.038 20 0 DIADMM COc1cc2[nH]c(-c3cc([O-])c(Cl)c(F)c3F)nc2cc1C ZINC001251865271 1061516750 /nfs/dbraw/zinc/51/67/50/1061516750.db2.gz LDYTWEQJKPOJBE-UHFFFAOYSA-N -1 1 324.714 4.184 20 0 DIADMM CC(C)c1ccc([C@H](NC(=O)c2cncc([O-])c2)C(C)C)cc1 ZINC001463886856 1061529561 /nfs/dbraw/zinc/52/95/61/1061529561.db2.gz FRQBOEWHKFZEDB-GOSISDBHSA-N -1 1 312.413 4.038 20 0 DIADMM CSc1ccc([O-])c(C(=O)Nc2ccc(OC(C)C)cc2)c1 ZINC001464248115 1061568501 /nfs/dbraw/zinc/56/85/01/1061568501.db2.gz UFOWPXVTOAGHFU-UHFFFAOYSA-N -1 1 317.410 4.154 20 0 DIADMM O=C(c1ccc(F)c([O-])c1)N1CCC[C@H]1CC1CCCCC1 ZINC001464557189 1061606090 /nfs/dbraw/zinc/60/60/90/1061606090.db2.gz FRQNEILVFRITLP-HNNXBMFYSA-N -1 1 305.393 4.106 20 0 DIADMM CC[C@H](c1ccccc1)N(CC)C(=O)c1ccc(F)c([O-])c1 ZINC001464575202 1061608871 /nfs/dbraw/zinc/60/88/71/1061608871.db2.gz SHIYRFWRNCMAOO-MRXNPFEDSA-N -1 1 301.361 4.145 20 0 DIADMM Cc1ccc(N(C)C(=O)c2ccc3ccc(O)cc3c2[O-])cc1C ZINC001464606801 1061615006 /nfs/dbraw/zinc/61/50/06/1061615006.db2.gz FDACGEFRGHJBSG-UHFFFAOYSA-N -1 1 321.376 4.144 20 0 DIADMM CO[C@H](C)c1cccc(NC(=O)c2cc(SC)ccc2[O-])c1 ZINC001464709256 1061625949 /nfs/dbraw/zinc/62/59/49/1061625949.db2.gz VIFUVOXQGZJYLF-LLVKDONJSA-N -1 1 317.410 4.074 20 0 DIADMM Cc1cnc(C(=O)N(Cc2ccccc2)C2CCCCC2)c([O-])c1 ZINC001464866480 1061642928 /nfs/dbraw/zinc/64/29/28/1061642928.db2.gz DKPFPVXRSCJVSY-UHFFFAOYSA-N -1 1 324.424 4.071 20 0 DIADMM [O-]c1ccc(-c2nnc(-c3ccc(-c4ccccc4)cc3)o2)nn1 ZINC001252563956 1061667670 /nfs/dbraw/zinc/66/76/70/1061667670.db2.gz VZNHLNWIQVIUEK-UHFFFAOYSA-N -1 1 316.320 4.127 20 0 DIADMM Cc1ccc2c(c1)N(C(=O)c1ccc(C(C)C)cc1[O-])CCC2 ZINC001465065883 1061673128 /nfs/dbraw/zinc/67/31/28/1061673128.db2.gz ZDNUFFOVAYXRTM-UHFFFAOYSA-N -1 1 309.409 4.417 20 0 DIADMM CC(C)(C)[C@H]1CCCN(C(=O)Cc2ccc([O-])c(Cl)c2)CC1 ZINC001465143717 1061688757 /nfs/dbraw/zinc/68/87/57/1061688757.db2.gz SZXWSJAAWYYIFL-AWEZNQCLSA-N -1 1 323.864 4.263 20 0 DIADMM CCc1ccc(-c2nnc(-c3cccc([O-])c3Cl)o2)cc1 ZINC001253027145 1061787702 /nfs/dbraw/zinc/78/77/02/1061787702.db2.gz RUNINVDEVGAKEX-UHFFFAOYSA-N -1 1 300.745 4.325 20 0 DIADMM C[C@@](O)(CNc1c(Cl)ccc([O-])c1Cl)c1ccccc1 ZINC001253112284 1061812391 /nfs/dbraw/zinc/81/23/91/1061812391.db2.gz UFKRAKRVMHKDDH-OAHLLOKOSA-N -1 1 312.196 4.019 20 0 DIADMM COc1cccc(-c2nnc(-c3ccc4sccc4c3[O-])o2)c1 ZINC001253270607 1061863967 /nfs/dbraw/zinc/86/39/67/1061863967.db2.gz JONHPHFMDHFIEG-UHFFFAOYSA-N -1 1 324.361 4.333 20 0 DIADMM [O-]c1c(-c2nnc(Cc3ccccc3)o2)ccc2ccccc21 ZINC001253489349 1061902172 /nfs/dbraw/zinc/90/21/72/1061902172.db2.gz REOIPLQCMMFJKT-UHFFFAOYSA-N -1 1 302.333 4.186 20 0 DIADMM CCCc1cc(=O)[n-]c(SCC/C=C\c2ccccc2)n1 ZINC001458795906 1061907666 /nfs/dbraw/zinc/90/76/66/1061907666.db2.gz SBTAXSHJHSMIBU-WDZFZDKYSA-N -1 1 300.427 4.330 20 0 DIADMM Cc1cnc(SCCOc2ccc(C(C)C)c(C)c2)[n-]c1=O ZINC001459092113 1062005360 /nfs/dbraw/zinc/00/53/60/1062005360.db2.gz JUDGGFJVUUENOG-UHFFFAOYSA-N -1 1 318.442 4.094 20 0 DIADMM C[C@H](CCNC(=O)c1ncc2ccccc2c1[O-])CC(C)(C)C ZINC001466906476 1062023222 /nfs/dbraw/zinc/02/32/22/1062023222.db2.gz MDBIPCVGCIRZMO-CYBMUJFWSA-N -1 1 314.429 4.133 20 0 DIADMM O=C(NCC1CCC(F)(F)CC1)c1ccc2ccccc2c1[O-] ZINC001467455814 1062132335 /nfs/dbraw/zinc/13/23/35/1062132335.db2.gz CDUSFHLQHMUTSI-UHFFFAOYSA-N -1 1 319.351 4.101 20 0 DIADMM Cc1ccc(C)c(S(=O)(=O)[N-]c2cc(C)c(Cl)cc2C)c1 ZINC001254772009 1062246940 /nfs/dbraw/zinc/24/69/40/1062246940.db2.gz LLEMWQZGOOATHT-UHFFFAOYSA-N -1 1 323.845 4.374 20 0 DIADMM COc1cccc2c1CCCCN2Cc1ccc([O-])c(F)c1F ZINC001474554426 1062254060 /nfs/dbraw/zinc/25/40/60/1062254060.db2.gz JWJOJVACHQOVFA-UHFFFAOYSA-N -1 1 319.351 4.022 20 0 DIADMM O=C(c1ccc2ccc(O)cc2c1[O-])N1CCCCCCCC1 ZINC001468124141 1062265240 /nfs/dbraw/zinc/26/52/40/1062265240.db2.gz VIVKTNPEBIFLDF-UHFFFAOYSA-N -1 1 313.397 4.047 20 0 DIADMM CCCCN(C(=O)c1ccc([O-])cc1F)[C@H]1CCC[C@@H](C)C1 ZINC001468504018 1062336184 /nfs/dbraw/zinc/33/61/84/1062336184.db2.gz KHPQTUMRQUNHCA-KGLIPLIRSA-N -1 1 307.409 4.352 20 0 DIADMM Cc1cc(NC(=O)c2ccc(F)c([O-])c2)ccc1-c1ccncc1 ZINC001468540633 1062345442 /nfs/dbraw/zinc/34/54/42/1062345442.db2.gz WTEXYJDIRAQPLF-UHFFFAOYSA-N -1 1 322.339 4.154 20 0 DIADMM C=Cc1cccc([N-]S(=O)(=O)c2ccc(C(C)C)cc2)c1 ZINC001255335672 1062409643 /nfs/dbraw/zinc/40/96/43/1062409643.db2.gz NPTINSLAOAUXJA-UHFFFAOYSA-N -1 1 301.411 4.254 20 0 DIADMM Cc1nc2cc(NCc3ccc([O-])c(F)c3F)ccc2s1 ZINC001474718746 1062445567 /nfs/dbraw/zinc/44/55/67/1062445567.db2.gz HXGZXVDYSXPGAO-UHFFFAOYSA-N -1 1 306.337 4.201 20 0 DIADMM O=C(Nc1cc(F)cc(F)c1[O-])c1ccc(-c2ccccc2)o1 ZINC001469161877 1062490678 /nfs/dbraw/zinc/49/06/78/1062490678.db2.gz RINTZNIBDYVPFI-UHFFFAOYSA-N -1 1 315.275 4.183 20 0 DIADMM CC(C)C[C@H](C(=O)Nc1cc(F)cc(F)c1[O-])c1ccccc1 ZINC001469161519 1062492340 /nfs/dbraw/zinc/49/23/40/1062492340.db2.gz MINJQFSTWPOCSW-AWEZNQCLSA-N -1 1 319.351 4.439 20 0 DIADMM CC[C@H](NC(=O)c1ccc(Cl)cc1[O-])c1ccccc1F ZINC001469771157 1062624934 /nfs/dbraw/zinc/62/49/34/1062624934.db2.gz DZSNYCPILFVVSB-AWEZNQCLSA-N -1 1 307.752 4.066 20 0 DIADMM C[C@H](c1nc(-c2ccc([O-])cc2F)no1)c1ccc(F)cc1F ZINC001255960632 1062674927 /nfs/dbraw/zinc/67/49/27/1062674927.db2.gz PPAOSARKKIVXGB-QMMMGPOBSA-N -1 1 320.270 4.011 20 0 DIADMM CCOc1cc(C(=O)N(C)c2ccccc2C)cc(Cl)c1[O-] ZINC001470418691 1062775452 /nfs/dbraw/zinc/77/54/52/1062775452.db2.gz IFROIALHEXETCO-UHFFFAOYSA-N -1 1 319.788 4.029 20 0 DIADMM CCCCCCc1nnc(-c2cc(Cl)c([O-])c(OC)c2)o1 ZINC001256395033 1062801362 /nfs/dbraw/zinc/80/13/62/1062801362.db2.gz AHVRNOFCTUOKNK-UHFFFAOYSA-N -1 1 310.781 4.227 20 0 DIADMM Cc1ccc(-c2nnc(Cc3ccc([O-])c(Cl)c3)o2)cc1C ZINC001256525113 1062848968 /nfs/dbraw/zinc/84/89/68/1062848968.db2.gz JTYZVWDVZMEJLG-UHFFFAOYSA-N -1 1 314.772 4.303 20 0 DIADMM O=C(Nc1cccc(F)c1[O-])c1cc2ccc(F)cc2s1 ZINC001471166400 1062930401 /nfs/dbraw/zinc/93/04/01/1062930401.db2.gz IRWKUZHPKPMNDR-UHFFFAOYSA-N -1 1 305.305 4.137 20 0 DIADMM Cc1c2cccc(Cl)c2[nH]c1C(=O)Nc1cccc(F)c1[O-] ZINC001471168717 1062934789 /nfs/dbraw/zinc/93/47/89/1062934789.db2.gz RDVPYHQLTJEFAJ-UHFFFAOYSA-N -1 1 318.735 4.227 20 0 DIADMM Cc1cccc2c1[C@@H](C)C[C@@H]2CC(=O)Nc1cccc(F)c1[O-] ZINC001471168509 1062934981 /nfs/dbraw/zinc/93/49/81/1062934981.db2.gz QZULPUZKDQOPOU-QWHCGFSZSA-N -1 1 313.372 4.459 20 0 DIADMM CC(C)(C)C1CCN(C(=O)NCc2ccc([O-])c(Cl)c2)CC1 ZINC001471235226 1062952299 /nfs/dbraw/zinc/95/22/99/1062952299.db2.gz LSSAMPJOIREKTG-UHFFFAOYSA-N -1 1 324.852 4.013 20 0 DIADMM C[C@H]1CCC[C@@H](C2CN(C(=O)c3cc4ccccc4cc3[O-])C2)C1 ZINC001471317637 1062963737 /nfs/dbraw/zinc/96/37/37/1062963737.db2.gz SRFDYCWBQNSAAD-LSDHHAIUSA-N -1 1 323.436 4.444 20 0 DIADMM CC[C@@H](CC(=O)NCc1ccc([O-])c(Cl)c1)c1ccccc1 ZINC001471699536 1063013996 /nfs/dbraw/zinc/01/39/96/1063013996.db2.gz ILYAOHJPBPGCQM-AWEZNQCLSA-N -1 1 317.816 4.246 20 0 DIADMM [O-]c1cc(F)c(F)c(-c2nnc(CCC3CCCCC3)o2)c1 ZINC001256854190 1063017221 /nfs/dbraw/zinc/01/72/21/1063017221.db2.gz FPCQNOHVMXZYKB-UHFFFAOYSA-N -1 1 308.328 4.233 20 0 DIADMM Cc1cccc(S(=O)(=O)[N-]c2c(C)ccc3ccccc32)c1 ZINC001256855132 1063019778 /nfs/dbraw/zinc/01/97/78/1063019778.db2.gz IACMFNSCMDCKGR-UHFFFAOYSA-N -1 1 311.406 4.257 20 0 DIADMM CC(C)(NC(=O)c1ccc2ccccc2c1[O-])c1ccc(F)cc1 ZINC001471890091 1063028631 /nfs/dbraw/zinc/02/86/31/1063028631.db2.gz AIBSSQRDOURPBB-UHFFFAOYSA-N -1 1 323.367 4.350 20 0 DIADMM CCc1ccc(C(=O)N(CC)c2ccc(Cl)cc2)c([O-])c1 ZINC001472015819 1063043027 /nfs/dbraw/zinc/04/30/27/1063043027.db2.gz AUHCLEGUYNLAQI-UHFFFAOYSA-N -1 1 303.789 4.275 20 0 DIADMM CC(C)=C[C@H]1[C@@H](C(=O)Nc2cc(F)c([O-])cc2Cl)C1(C)C ZINC001472193255 1063056560 /nfs/dbraw/zinc/05/65/60/1063056560.db2.gz RXODYLVMQFMIJY-XPTSAGLGSA-N -1 1 311.784 4.362 20 0 DIADMM CC(C)=C[C@@H]1[C@@H](C(=O)Nc2cc(F)c([O-])cc2Cl)C1(C)C ZINC001472193254 1063057092 /nfs/dbraw/zinc/05/70/92/1063057092.db2.gz RXODYLVMQFMIJY-OTYXRUKQSA-N -1 1 311.784 4.362 20 0 DIADMM CC(C)Oc1ccc(-c2nnc(-c3cc([O-])cc(F)c3)o2)cc1 ZINC001256927373 1063056937 /nfs/dbraw/zinc/05/69/37/1063056937.db2.gz VYCDYFJFPZGTMN-UHFFFAOYSA-N -1 1 314.316 4.036 20 0 DIADMM O=C(Cc1cc2ccccc2o1)Nc1cc(F)c([O-])cc1Cl ZINC001472192979 1063057177 /nfs/dbraw/zinc/05/71/77/1063057177.db2.gz FUOQTGSFQJYTQV-UHFFFAOYSA-N -1 1 319.719 4.112 20 0 DIADMM C/C(=C\C(=O)Nc1cc(F)c([O-])cc1Cl)c1cccs1 ZINC001472193868 1063058642 /nfs/dbraw/zinc/05/86/42/1063058642.db2.gz CPEGWUGZFVRBMA-VMPITWQZSA-N -1 1 311.765 4.288 20 0 DIADMM Cc1cccc2c1[C@@H](C)C[C@@H]2CC(=O)Nc1ccc(F)cc1[O-] ZINC001472534330 1063098685 /nfs/dbraw/zinc/09/86/85/1063098685.db2.gz IWNJKOSXJUCJPV-QWHCGFSZSA-N -1 1 313.372 4.459 20 0 DIADMM CC(C)CC1(CNC(=O)NCc2ccc([O-])c(Cl)c2)CCC1 ZINC001478210848 1063108120 /nfs/dbraw/zinc/10/81/20/1063108120.db2.gz KZFKKZPSQAJSBZ-UHFFFAOYSA-N -1 1 324.852 4.061 20 0 DIADMM COc1cccc([O-])c1-c1nnc([C@@H]2C[C@H]2c2ccc(C)cc2)o1 ZINC001257208666 1063136251 /nfs/dbraw/zinc/13/62/51/1063136251.db2.gz CYOURJVOWADCBZ-UONOGXRCSA-N -1 1 322.364 4.030 20 0 DIADMM Cn1cc([N-]c2nc3ccc(F)cc3o2)c(C2CCCCC2)n1 ZINC001472788422 1063235409 /nfs/dbraw/zinc/23/54/09/1063235409.db2.gz CMHOGOFPNSTCRV-UHFFFAOYSA-N -1 1 314.364 4.492 20 0 DIADMM Cc1cc([O-])c(-c2nnc(C3CCCC3)o2)cc1Br ZINC001257593040 1063347894 /nfs/dbraw/zinc/34/78/94/1063347894.db2.gz MWWBKIOOJUMLPL-UHFFFAOYSA-N -1 1 323.190 4.171 20 0 DIADMM Cc1cccc(C2(NC(=O)c3ccc([O-])c(F)c3)CCCC2)c1 ZINC001546343957 1063565382 /nfs/dbraw/zinc/56/53/82/1063565382.db2.gz LZVJSTLHYQHSMO-UHFFFAOYSA-N -1 1 313.372 4.039 20 0 DIADMM CSC(C)(C)C[C@H](C)Nc1c(C)c(=O)[n-]n1-c1ccccc1 ZINC001258332124 1063615561 /nfs/dbraw/zinc/61/55/61/1063615561.db2.gz UBVWVKFELLUZDC-LBPRGKRZSA-N -1 1 319.474 4.218 20 0 DIADMM Cc1ccc(S(=O)(=O)[N-]c2cccc3sccc32)cc1C ZINC001259167925 1063884811 /nfs/dbraw/zinc/88/48/11/1063884811.db2.gz LYMSCPWJIBNEOK-UHFFFAOYSA-N -1 1 317.435 4.319 20 0 DIADMM CCc1oc2ccccc2c1C(=O)Nc1cc(F)cc(F)c1[O-] ZINC001299581463 1063887758 /nfs/dbraw/zinc/88/77/58/1063887758.db2.gz RKRDOXGSPJCKNN-UHFFFAOYSA-N -1 1 317.291 4.231 20 0 DIADMM Cc1cc(C)cc(S(=O)(=O)[N-]c2ccccc2CC(C)C)c1 ZINC001259524397 1063890313 /nfs/dbraw/zinc/89/03/13/1063890313.db2.gz POVHSAVONLSBJS-UHFFFAOYSA-N -1 1 317.454 4.303 20 0 DIADMM O=C(CC[C@H]1CCc2ccccc21)Nc1cc(F)cc(F)c1[O-] ZINC001299587316 1063890464 /nfs/dbraw/zinc/89/04/64/1063890464.db2.gz UJINFUHGPVQNAI-GFCCVEGCSA-N -1 1 317.335 4.119 20 0 DIADMM Cc1cc(C)cc(S(=O)(=O)[N-]c2cccc3sccc32)c1 ZINC001259524129 1063890511 /nfs/dbraw/zinc/89/05/11/1063890511.db2.gz BDTHYZSCVDSIKQ-UHFFFAOYSA-N -1 1 317.435 4.319 20 0 DIADMM Cc1cc(C)cc(S(=O)(=O)[N-]c2cc(C)c(Cl)cc2C)c1 ZINC001259522535 1063890691 /nfs/dbraw/zinc/89/06/91/1063890691.db2.gz OLMAOTSOFSBOQR-UHFFFAOYSA-N -1 1 323.845 4.374 20 0 DIADMM O=C(NC1(c2ccc(Cl)cc2)CC1)c1cc(Cl)ccc1[O-] ZINC001299665669 1063900320 /nfs/dbraw/zinc/90/03/20/1063900320.db2.gz PIUSXUGRSGCDTB-UHFFFAOYSA-N -1 1 322.191 4.118 20 0 DIADMM O=S(=O)(Cc1cccc(Cl)c1)[N-]c1cccc2occc21 ZINC001260834159 1063906044 /nfs/dbraw/zinc/90/60/44/1063906044.db2.gz DRPDDCNRBLEUNI-UHFFFAOYSA-N -1 1 321.785 4.028 20 0 DIADMM Cc1cccc(S(=O)(=O)[N-]c2ccc(C)c(Cl)c2)c1C ZINC001260991617 1063906966 /nfs/dbraw/zinc/90/69/66/1063906966.db2.gz ODRCLJFYAHLBGT-UHFFFAOYSA-N -1 1 309.818 4.066 20 0 DIADMM Cc1cccc(S(=O)(=O)[N-]c2ccc(Cl)cc2C)c1C ZINC001260992001 1063909109 /nfs/dbraw/zinc/90/91/09/1063909109.db2.gz VCSPSQHKGCCFPG-UHFFFAOYSA-N -1 1 309.818 4.066 20 0 DIADMM Cc1cccc(S(=O)(=O)[N-]c2cccc3ccccc32)c1C ZINC001260997664 1063909259 /nfs/dbraw/zinc/90/92/59/1063909259.db2.gz BLTCRWDMFGLDFH-UHFFFAOYSA-N -1 1 311.406 4.257 20 0 DIADMM O=C(Nc1ccccc1SC(F)F)c1cccc([O-])c1F ZINC001290282170 1064688511 /nfs/dbraw/zinc/68/85/11/1064688511.db2.gz LCFDBOJKJPJZPS-UHFFFAOYSA-N -1 1 313.300 4.098 20 0 DIADMM O=C(Nc1ccc(OC2CCCC2)cc1)c1cc(F)ccc1[O-] ZINC001290687181 1064705103 /nfs/dbraw/zinc/70/51/03/1064705103.db2.gz JBCFQTOAOMZPNU-UHFFFAOYSA-N -1 1 315.344 4.105 20 0 DIADMM Cc1ccc(CNC(=O)c2cc3ccccc3cc2[O-])c(C)c1 ZINC001290743347 1064708675 /nfs/dbraw/zinc/70/86/75/1064708675.db2.gz OUOFBLQYYAPJNR-UHFFFAOYSA-N -1 1 305.377 4.092 20 0 DIADMM CCOc1cc(F)ccc1NC(=O)c1ccc(C(C)C)cc1[O-] ZINC001291632281 1064738534 /nfs/dbraw/zinc/73/85/34/1064738534.db2.gz RGCVWBBQMJXJSQ-UHFFFAOYSA-N -1 1 317.360 4.306 20 0 DIADMM CC(C)[C@H]1CC[C@@H](C)C[C@@H]1CNC(=O)c1c([O-])cccc1Cl ZINC001292405368 1064772793 /nfs/dbraw/zinc/77/27/93/1064772793.db2.gz JSUPVCVNHUKUKJ-MGPQQGTHSA-N -1 1 323.864 4.484 20 0 DIADMM Cc1ccc([C@@H]2C[C@@H](C)CCN2C(=O)c2cccc([O-])c2F)o1 ZINC001294078000 1064847450 /nfs/dbraw/zinc/84/74/50/1064847450.db2.gz ONGJYXRZMNTRPB-FZMZJTMJSA-N -1 1 317.360 4.046 20 0 DIADMM CC[C@@H](NC(=O)c1cc(Cl)ccc1[O-])c1ccc(F)cc1 ZINC001295462880 1064912114 /nfs/dbraw/zinc/91/21/14/1064912114.db2.gz PFZCNBVCXOAAGP-CQSZACIVSA-N -1 1 307.752 4.066 20 0 DIADMM CCCc1cnc(NC(=O)c2ccc(C(C)C)cc2[O-])s1 ZINC001295699146 1064923435 /nfs/dbraw/zinc/92/34/35/1064923435.db2.gz VGMBCJKQUPPGLM-UHFFFAOYSA-N -1 1 304.415 4.177 20 0 DIADMM CC1(C)CN(C(=O)c2ccc3ccccc3c2[O-])CC(C)(C)C1 ZINC001296076240 1064935844 /nfs/dbraw/zinc/93/58/44/1064935844.db2.gz GZLRUDFMAMNGPC-UHFFFAOYSA-N -1 1 311.425 4.444 20 0 DIADMM CC[C@H](CC(=O)Nc1cc([O-])c(F)cc1F)c1ccccc1 ZINC001298975758 1065027556 /nfs/dbraw/zinc/02/75/56/1065027556.db2.gz ZXZCIJNYYGSWBS-LLVKDONJSA-N -1 1 305.324 4.193 20 0 DIADMM CC(C)[C@@H](CC(=O)Nc1cc([O-])c(F)cc1F)c1ccccc1 ZINC001298975760 1065027642 /nfs/dbraw/zinc/02/76/42/1065027642.db2.gz ZZRTUEAHTYIFJF-CYBMUJFWSA-N -1 1 319.351 4.439 20 0 DIADMM CCc1c2ccccc2oc1C(=O)Nc1cc([O-])c(F)cc1F ZINC001298973441 1065028024 /nfs/dbraw/zinc/02/80/24/1065028024.db2.gz KMHGTRVNHLDDJF-UHFFFAOYSA-N -1 1 317.291 4.231 20 0 DIADMM O=C(Cc1ccc([O-])c(Cl)c1)N(c1ccccc1)C1CCC1 ZINC001301684818 1065069368 /nfs/dbraw/zinc/06/93/68/1065069368.db2.gz JCQZROISDYKZEN-UHFFFAOYSA-N -1 1 315.800 4.174 20 0 DIADMM Cc1cccc([C@@H](NC(=O)c2c([O-])cccc2Cl)C(C)C)c1 ZINC001302170769 1065080084 /nfs/dbraw/zinc/08/00/84/1065080084.db2.gz FGXFZLRMSRCPRA-KRWDZBQOSA-N -1 1 317.816 4.481 20 0 DIADMM CCc1ccc(C(C)(C)C(=O)Nc2cccc(F)c2[O-])cc1 ZINC001302486506 1065090178 /nfs/dbraw/zinc/09/01/78/1065090178.db2.gz QDILRDGYIMQVEZ-UHFFFAOYSA-N -1 1 301.361 4.010 20 0 DIADMM CCc1ccc(C(=O)N(CC2CC2)c2cccc(F)c2)c([O-])c1 ZINC001302495343 1065090797 /nfs/dbraw/zinc/09/07/97/1065090797.db2.gz RSTVSKKZOQVPAO-UHFFFAOYSA-N -1 1 313.372 4.151 20 0 DIADMM O=C(Nc1cc(F)c([O-])cc1Cl)[C@H](c1ccccc1)C1CC1 ZINC001304284322 1065135783 /nfs/dbraw/zinc/13/57/83/1065135783.db2.gz KTFITQFLPYLTPR-MRXNPFEDSA-N -1 1 319.763 4.317 20 0 DIADMM CCCn1ncc([N-]c2nc3ccc(F)cc3o2)c1C1CC1 ZINC001307122377 1065272442 /nfs/dbraw/zinc/27/24/42/1065272442.db2.gz ITBGRZJOXSVUHM-UHFFFAOYSA-N -1 1 300.337 4.194 20 0 DIADMM CCCc1cc(=O)[n-]c(SCc2cccc(C(F)F)c2)n1 ZINC001307252368 1065315537 /nfs/dbraw/zinc/31/55/37/1065315537.db2.gz DZJZXADIWJGMKF-UHFFFAOYSA-N -1 1 310.369 4.365 20 0 DIADMM CC[C@@H]1CN(Cc2cccc([O-])c2Cl)c2ccccc2O1 ZINC001308703400 1066189079 /nfs/dbraw/zinc/18/90/79/1066189079.db2.gz ATTFPNRFARNOQO-CYBMUJFWSA-N -1 1 303.789 4.223 20 0 DIADMM CC(C)([N-]S(=O)(=O)c1sccc1Cl)C1CCCCC1 ZINC001309148324 1066444963 /nfs/dbraw/zinc/44/49/63/1066444963.db2.gz CJKQABRUIYKLCG-UHFFFAOYSA-N -1 1 321.895 4.039 20 0 DIADMM CCCC[C@H]1CCC[C@H]1[N-]S(=O)(=O)c1sccc1Cl ZINC001309150885 1066444981 /nfs/dbraw/zinc/44/49/81/1066444981.db2.gz FSPHVKGXJCZDTN-CMPLNLGQSA-N -1 1 321.895 4.039 20 0 DIADMM C[C@@H](CCC(C)(C)C)NC(=O)NCc1ccc([O-])c(Cl)c1 ZINC001312034253 1066729507 /nfs/dbraw/zinc/72/95/07/1066729507.db2.gz PANGAGLWSZTRSL-NSHDSACASA-N -1 1 312.841 4.060 20 0 DIADMM Cc1ccccc1CN(C)C(=O)c1cc2ccccc2cc1[O-] ZINC000023599107 182363874 /nfs/dbraw/zinc/36/38/74/182363874.db2.gz QUQDBGSKWGWMLW-UHFFFAOYSA-N -1 1 305.377 4.126 20 0 DIADMM O=C([O-])CC[C@@H]1CCCN(Cc2ccc(Cl)cc2Cl)C1 ZINC000043585429 132156170 /nfs/dbraw/zinc/15/61/70/132156170.db2.gz WUWBMLWZHZGKNI-NSHDSACASA-N -1 1 316.228 4.070 20 0 DIADMM O=C(c1ccc2ccccc2c1[O-])N1CC2(CC2)c2ccccc21 ZINC000172430661 332818856 /nfs/dbraw/zinc/81/88/56/332818856.db2.gz OONVNVNDZOUASI-UHFFFAOYSA-N -1 1 315.372 4.237 20 0 DIADMM O=C(Nc1ccc(Cl)cc1[O-])c1cc2cc(F)ccc2o1 ZINC000533615931 331607951 /nfs/dbraw/zinc/60/79/51/331607951.db2.gz AMQWJHXKOXOQQT-UHFFFAOYSA-N -1 1 305.692 4.183 20 0 DIADMM CCN(C(=O)c1ccc2ccccc2c1[O-])[C@@H](C)c1cccnc1 ZINC000115226371 331695350 /nfs/dbraw/zinc/69/53/50/331695350.db2.gz VPEKNFUJGSVAET-AWEZNQCLSA-N -1 1 320.392 4.164 20 0 DIADMM O=C(/C=C\SCc1ccco1)Nc1ccc([O-])c(Cl)c1 ZINC000255862854 331810395 /nfs/dbraw/zinc/81/03/95/331810395.db2.gz XDXUQNKJPUSFMV-ALCCZGGFSA-N -1 1 309.774 4.024 20 0 DIADMM O=C(Nc1ccc([O-])c(Cl)c1)[C@@H]1C[C@H]1c1ccccc1Cl ZINC000558325196 331896822 /nfs/dbraw/zinc/89/68/22/331896822.db2.gz BZZZQNUPYWNJOG-NWDGAFQWSA-N -1 1 322.191 4.441 20 0 DIADMM CC[C@H](Sc1nc(C(F)(F)F)cc(=O)[n-]1)c1ccccc1 ZINC000518336798 332015490 /nfs/dbraw/zinc/01/54/90/332015490.db2.gz NQGDHOJMNCSFHG-JTQLQIEISA-N -1 1 314.332 4.444 20 0 DIADMM Cc1ccc([C@H](CC(=O)[O-])NCc2csc3ccccc23)o1 ZINC000426777054 332135620 /nfs/dbraw/zinc/13/56/20/332135620.db2.gz KBBPXUNESFAAQF-AWEZNQCLSA-N -1 1 315.394 4.108 20 0 DIADMM CCc1ccc(CN[C@@H](CC(=O)[O-])c2ccc(C(C)C)cc2)o1 ZINC000426808855 332152169 /nfs/dbraw/zinc/15/21/69/332152169.db2.gz OKAPECHXFMDTRE-SFHVURJKSA-N -1 1 315.413 4.271 20 0 DIADMM CCC[C@@H](C)C[C@H](NCc1cc2cc(C)c(C)cc2o1)C(=O)[O-] ZINC000426828438 332155944 /nfs/dbraw/zinc/15/59/44/332155944.db2.gz YYLUIOOTDLIRSM-PXAZEXFGSA-N -1 1 317.429 4.419 20 0 DIADMM Cc1cc2cc(CN[C@H](CC(C)(C)C)C(=O)[O-])oc2cc1C ZINC000426826129 332158199 /nfs/dbraw/zinc/15/81/99/332158199.db2.gz CXBIMHOYMRKDKT-OAHLLOKOSA-N -1 1 303.402 4.029 20 0 DIADMM O=C([O-])CC[C@@H]1CCCN(Cc2c(Cl)cccc2Cl)C1 ZINC000049842186 332329472 /nfs/dbraw/zinc/32/94/72/332329472.db2.gz NUZRCSPKXAMYNP-NSHDSACASA-N -1 1 316.228 4.070 20 0 DIADMM CC(C)[C@@H](C)C(=O)Nc1c([O-])cc(Br)cc1Cl ZINC000560505437 332347674 /nfs/dbraw/zinc/34/76/74/332347674.db2.gz NFZLQLTUMGHQKP-SSDOTTSWSA-N -1 1 320.614 4.039 20 0 DIADMM O=C([O-])c1cccc(CN2CCC[C@H]2c2cccs2)c1Cl ZINC000566359780 332377383 /nfs/dbraw/zinc/37/73/83/332377383.db2.gz XZKNBYZPVXUZFQ-ZDUSSCGKSA-N -1 1 321.829 4.437 20 0 DIADMM Cc1cc2nc(-c3ccc([O-])c(Br)c3)[nH]c2cc1C ZINC000169964891 332631335 /nfs/dbraw/zinc/63/13/35/332631335.db2.gz AYVCHFQHIPEJOI-UHFFFAOYSA-N -1 1 317.186 4.315 20 0 DIADMM O=c1cc(C(F)F)nc(SCc2c(F)cccc2Cl)[n-]1 ZINC000584320247 332670878 /nfs/dbraw/zinc/67/08/78/332670878.db2.gz JVFVVNNULUSUJQ-UHFFFAOYSA-N -1 1 320.723 4.205 20 0 DIADMM C[C@@H](Sc1nc(C(F)F)cc(=O)[n-]1)c1nc2ccccc2o1 ZINC000580261189 333043090 /nfs/dbraw/zinc/04/30/90/333043090.db2.gz WUDHUCONBJFSJX-SSDOTTSWSA-N -1 1 323.324 4.114 20 0 DIADMM Cc1c(=O)[n-]c(SCCc2ccccc2)nc1-c1ccccc1 ZINC000460426736 333084532 /nfs/dbraw/zinc/08/45/32/333084532.db2.gz KXTUAOHGXOWOMM-UHFFFAOYSA-N -1 1 322.433 4.492 20 0 DIADMM O=C([O-])[C@@H](NCc1ccc(-c2ccccc2)s1)c1ccccc1 ZINC000390700101 333315868 /nfs/dbraw/zinc/31/58/68/333315868.db2.gz SUJRALLJFCLOFM-SFHVURJKSA-N -1 1 323.417 4.331 20 0 DIADMM CSCc1ccc(-c2nc(-c3ccc([O-])cc3F)no2)cc1 ZINC000445464895 333376318 /nfs/dbraw/zinc/37/63/18/333376318.db2.gz WIVMSHIQEURJKG-UHFFFAOYSA-N -1 1 316.357 4.111 20 0 DIADMM O=C(c1cc2ccccc2cc1[O-])N1CCC[C@@H]2CCCC[C@@H]21 ZINC000319660473 333393918 /nfs/dbraw/zinc/39/39/18/333393918.db2.gz GPKQXQBUJLFYDR-KSSFIOAISA-N -1 1 309.409 4.340 20 0 DIADMM Cc1ccc(CN(C)C(=O)c2ccc3ccccc3c2[O-])cc1 ZINC000320249924 333462786 /nfs/dbraw/zinc/46/27/86/333462786.db2.gz AYTFXOQFIMMAQM-UHFFFAOYSA-N -1 1 305.377 4.126 20 0 DIADMM CC(C)[C@H](C(=O)Nc1ccc(F)cc1[O-])c1ccc(F)cc1 ZINC000533970645 333552558 /nfs/dbraw/zinc/55/25/58/333552558.db2.gz HRRMKVXOGKMRAT-INIZCTEOSA-N -1 1 305.324 4.049 20 0 DIADMM C[C@H](N[C@@H](CCC(C)(C)C)C(=O)[O-])c1cc2ccccc2o1 ZINC000414667925 334063572 /nfs/dbraw/zinc/06/35/72/334063572.db2.gz WYJVZLPPHAOATK-JSGCOSHPSA-N -1 1 303.402 4.363 20 0 DIADMM CCc1ccc(-c2ccc(CN(CC(=O)[O-])[C@@H](C)CC)o2)cc1 ZINC000414685856 334068915 /nfs/dbraw/zinc/06/89/15/334068915.db2.gz USCNAAGCEXBQSF-AWEZNQCLSA-N -1 1 315.413 4.194 20 0 DIADMM CC[C@H](C)N(CC(=O)[O-])Cc1ccc(-c2cccc(F)c2C)o1 ZINC000414687700 334069367 /nfs/dbraw/zinc/06/93/67/334069367.db2.gz XHYKEMGECRCTRO-LBPRGKRZSA-N -1 1 319.376 4.079 20 0 DIADMM CC[C@@](C)(NCc1cccc([O-])c1Cl)c1nc(C)cs1 ZINC000293694111 334201099 /nfs/dbraw/zinc/20/10/99/334201099.db2.gz WNBTVWQHADBYFL-OAHLLOKOSA-N -1 1 310.850 4.226 20 0 DIADMM Cc1ccc(S(=O)(=O)[N-]c2cccc(Cl)c2)cc1Cl ZINC000048652461 334291062 /nfs/dbraw/zinc/29/10/62/334291062.db2.gz MLHVIIUNTKGWHB-UHFFFAOYSA-N -1 1 316.209 4.103 20 0 DIADMM O=C(Nc1ccc(F)cc1[O-])c1cccc(OC2CCCC2)c1 ZINC000532012340 334371551 /nfs/dbraw/zinc/37/15/51/334371551.db2.gz MBCAKVDXKPSLLT-UHFFFAOYSA-N -1 1 315.344 4.105 20 0 DIADMM Cc1nc(-c2nc(=O)c3c([n-]2)sc(C)c3-c2ccccc2)co1 ZINC000345217216 335309257 /nfs/dbraw/zinc/30/92/57/335309257.db2.gz ZRZHLKHUGSHLEK-UHFFFAOYSA-N -1 1 323.377 4.336 20 0 DIADMM CC(C)(C)c1ccc([C@H]2CCCN2C(=O)c2cncc([O-])c2)cc1 ZINC000348797318 335610648 /nfs/dbraw/zinc/61/06/48/335610648.db2.gz CPBOCXSKYPVNDJ-GOSISDBHSA-N -1 1 324.424 4.062 20 0 DIADMM C[C@H](c1cc2ccccc2o1)N(C)C(=O)c1cc(F)ccc1[O-] ZINC000093923165 335689625 /nfs/dbraw/zinc/68/96/25/335689625.db2.gz KUMHWSGZKBYLQX-LLVKDONJSA-N -1 1 313.328 4.111 20 0 DIADMM Cc1ccc(/C=C/Cc2nc(-c3ccc([O-])c(F)c3)no2)cc1 ZINC000445475411 338496061 /nfs/dbraw/zinc/49/60/61/338496061.db2.gz UIYFOXAAAQMXHH-NSCUHMNNSA-N -1 1 310.328 4.146 20 0 DIADMM [O-]c1ccc(-c2noc(-c3ccccc3C(F)(F)F)n2)cc1F ZINC000445478995 338496241 /nfs/dbraw/zinc/49/62/41/338496241.db2.gz ULXAXVGWRSAFOR-UHFFFAOYSA-N -1 1 324.233 4.267 20 0 DIADMM [O-]c1ccc(-c2noc(-c3ccc(C(F)(F)F)cc3)n2)cc1F ZINC000445478753 338496303 /nfs/dbraw/zinc/49/63/03/338496303.db2.gz SDPGAIKMILHGAG-UHFFFAOYSA-N -1 1 324.233 4.267 20 0 DIADMM [O-]c1ccc(-c2noc(-c3ccc4sccc4c3)n2)cc1F ZINC000445482439 338496384 /nfs/dbraw/zinc/49/63/84/338496384.db2.gz PTCXRXCZXXPBFH-UHFFFAOYSA-N -1 1 312.325 4.463 20 0 DIADMM Cc1ccsc1CCCc1nc(-c2ccc([O-])c(F)c2)no1 ZINC000445483002 338496440 /nfs/dbraw/zinc/49/64/40/338496440.db2.gz UNAYTVVUVCXJFN-UHFFFAOYSA-N -1 1 318.373 4.127 20 0 DIADMM CCSCCCc1noc(-c2ccc3ccccc3c2[O-])n1 ZINC000445759305 338507784 /nfs/dbraw/zinc/50/77/84/338507784.db2.gz SHKYYWGKIMNZDP-UHFFFAOYSA-N -1 1 314.410 4.281 20 0 DIADMM O=C(Nc1ccc2ncccc2c1)c1cc2ccccc2cc1[O-] ZINC000324621288 336234503 /nfs/dbraw/zinc/23/45/03/336234503.db2.gz PSGDJADUAZBWIR-UHFFFAOYSA-N -1 1 314.344 4.346 20 0 DIADMM C[C@H](CSc1ccc(F)cc1)C(=O)Nc1ccc(F)cc1[O-] ZINC000532863696 336273384 /nfs/dbraw/zinc/27/33/84/336273384.db2.gz ANWTYTLDTSQUNZ-SNVBAGLBSA-N -1 1 323.364 4.037 20 0 DIADMM CCc1nc2c(s1)[C@@H]([N@@H+](C)Cc1cc(O)cc(F)c1)CCC2 ZINC000186250810 337254954 /nfs/dbraw/zinc/25/49/54/337254954.db2.gz IGVUTDMDRDEFPC-HNNXBMFYSA-N -1 1 320.433 4.060 20 0 DIADMM Cc1ccccc1S(=O)(=O)[N-]c1ccccc1-c1ccccc1 ZINC000321689125 337284475 /nfs/dbraw/zinc/28/44/75/337284475.db2.gz RKNIKYJEEAZREM-UHFFFAOYSA-N -1 1 323.417 4.463 20 0 DIADMM CC[C@H](CC(F)F)c1nc(-c2ccc([O-])cc2Cl)no1 ZINC000420494654 337503514 /nfs/dbraw/zinc/50/35/14/337503514.db2.gz SLEGLEWHCQSWOK-SSDOTTSWSA-N -1 1 302.708 4.244 20 0 DIADMM CC/C=C(/C)c1nc(-c2cc(Cl)c([O-])c(OCC)c2)no1 ZINC000445402113 337659567 /nfs/dbraw/zinc/65/95/67/337659567.db2.gz MHKRURYZHPDDPH-TWGQIWQCSA-N -1 1 308.765 4.308 20 0 DIADMM CCOc1cc(-c2noc([C@@H]3CC=CCC3)n2)cc(Cl)c1[O-] ZINC000445413148 337682981 /nfs/dbraw/zinc/68/29/81/337682981.db2.gz QWUQTAPKHKSZJI-SNVBAGLBSA-N -1 1 320.776 4.318 20 0 DIADMM Cc1ccc([N-]S(=O)(=O)c2cc(Cl)ccc2C)c(C)c1 ZINC000031665381 337731400 /nfs/dbraw/zinc/73/14/00/337731400.db2.gz LKXKAMHUSYDNHB-UHFFFAOYSA-N -1 1 309.818 4.066 20 0 DIADMM [O-]c1ccc(-c2noc([C@@H]3CCc4ccccc43)n2)c(Cl)c1 ZINC000445445780 337842773 /nfs/dbraw/zinc/84/27/73/337842773.db2.gz KHGPMMMFJFSTEZ-CYBMUJFWSA-N -1 1 312.756 4.174 20 0 DIADMM CCCc1ncc(-c2nc(-c3ccc([O-])cc3Cl)no2)s1 ZINC000445448582 337854973 /nfs/dbraw/zinc/85/49/73/337854973.db2.gz LLFPFHQPWWFELH-UHFFFAOYSA-N -1 1 321.789 4.172 20 0 DIADMM CCOc1ccccc1N(C)C(=O)c1ccc2ccccc2c1[O-] ZINC000121281245 337890200 /nfs/dbraw/zinc/89/02/00/337890200.db2.gz ZUMZGKXEJZAHCF-UHFFFAOYSA-N -1 1 321.376 4.221 20 0 DIADMM C[C@@H]1CCN(C(=O)c2ccc(Cl)cc2[O-])[C@H]2CCCC[C@@H]12 ZINC000537645175 337952607 /nfs/dbraw/zinc/95/26/07/337952607.db2.gz GWNIVNHZSRDZCO-ZLDLUXBVSA-N -1 1 307.821 4.086 20 0 DIADMM Cc1ccc(S(=O)(=O)[N-]c2cccc3ccccc32)cc1F ZINC000515620342 337994891 /nfs/dbraw/zinc/99/48/91/337994891.db2.gz QDTRZDJALNJAMC-UHFFFAOYSA-N -1 1 315.369 4.088 20 0 DIADMM [O-]c1ccc(-c2noc(-c3ccc(C(F)(F)F)cc3)n2)c(F)c1 ZINC000445454573 338017246 /nfs/dbraw/zinc/01/72/46/338017246.db2.gz MCRKDOOMQBGLND-UHFFFAOYSA-N -1 1 324.233 4.267 20 0 DIADMM [O-]c1ccc(-c2noc(-c3cccc(Cl)c3F)n2)c(F)c1 ZINC000445459733 338018599 /nfs/dbraw/zinc/01/85/99/338018599.db2.gz GOFVATFZDANOGC-UHFFFAOYSA-N -1 1 308.671 4.041 20 0 DIADMM [O-]c1ccc(-c2noc(-c3cccc(F)c3Cl)n2)c(F)c1 ZINC000445460732 338020736 /nfs/dbraw/zinc/02/07/36/338020736.db2.gz COPKAOFDOSUSQF-UHFFFAOYSA-N -1 1 308.671 4.041 20 0 DIADMM C[C@H](Cc1nc(-c2ccc([O-])cc2F)no1)c1ccccc1F ZINC000445460666 338020803 /nfs/dbraw/zinc/02/08/03/338020803.db2.gz SOEAQOXAHCPJDR-SNVBAGLBSA-N -1 1 316.307 4.067 20 0 DIADMM [O-]c1ccc(-c2noc([C@H]3CCCc4ccccc43)n2)c(F)c1 ZINC000445461012 338021396 /nfs/dbraw/zinc/02/13/96/338021396.db2.gz DRQVBFCPIOZHJF-AWEZNQCLSA-N -1 1 310.328 4.050 20 0 DIADMM COC[C@H](c1ccc(Cl)cc1)[N@H+](C)Cc1cc(O)cc(F)c1 ZINC000426543175 338034419 /nfs/dbraw/zinc/03/44/19/338034419.db2.gz WZXXUAFPZVTIAM-QGZVFWFLSA-N -1 1 323.795 4.004 20 0 DIADMM Cc1ccc(-c2ccc(CNCc3ccc(C(=O)[O-])cc3)o2)cc1 ZINC000426691044 338038185 /nfs/dbraw/zinc/03/81/85/338038185.db2.gz FRXBKZQBPMURMC-UHFFFAOYSA-N -1 1 321.376 4.243 20 0 DIADMM Cc1cc(C)cc([C@H](NCc2ccc(F)cc2Cl)C(=O)[O-])c1 ZINC000426754055 338040810 /nfs/dbraw/zinc/04/08/10/338040810.db2.gz NFITZFRADRVASO-INIZCTEOSA-N -1 1 321.779 4.011 20 0 DIADMM C[C@H](C(=O)[O-])[C@H](NCc1cccc(Cl)c1F)c1ccccc1 ZINC000426754909 338040897 /nfs/dbraw/zinc/04/08/97/338040897.db2.gz VAXVLVYISPCPNY-ZBEGNZNMSA-N -1 1 321.779 4.031 20 0 DIADMM Cc1cc(C)cc([C@@H](NCc2cccc(Cl)c2F)C(=O)[O-])c1 ZINC000426757619 338041024 /nfs/dbraw/zinc/04/10/24/338041024.db2.gz PKOCJVIMDCWQOR-MRXNPFEDSA-N -1 1 321.779 4.011 20 0 DIADMM C[C@@H](C(=O)[O-])[C@H](NCc1ccc(F)cc1Cl)c1ccccc1 ZINC000426758008 338041075 /nfs/dbraw/zinc/04/10/75/338041075.db2.gz GJNALKCUEVPOAD-BZNIZROVSA-N -1 1 321.779 4.031 20 0 DIADMM CCc1cc(=O)[n-]c(S[C@H]2CCc3ccc(Cl)cc32)n1 ZINC000436208788 338261945 /nfs/dbraw/zinc/26/19/45/338261945.db2.gz JZNCKNBHJYOQPU-ZDUSSCGKSA-N -1 1 306.818 4.178 20 0 DIADMM CC(C)(C)c1nc(CSc2nc(C3CC3)cc(=O)[n-]2)cs1 ZINC000436244751 338263205 /nfs/dbraw/zinc/26/32/05/338263205.db2.gz DCEPOMALFYEROE-UHFFFAOYSA-N -1 1 321.471 4.106 20 0 DIADMM Cc1ccc2nc(-c3nc(-c4ccc([O-])c(F)c4)no3)ccc2c1 ZINC000436521311 338275052 /nfs/dbraw/zinc/27/50/52/338275052.db2.gz LLMNZFYCQSXAME-UHFFFAOYSA-N -1 1 321.311 4.105 20 0 DIADMM O=C(c1cc2ccccc2cc1[O-])N1CCc2ccc(Cl)cc21 ZINC000436539892 338276066 /nfs/dbraw/zinc/27/60/66/338276066.db2.gz PYTVXTZLWCGGNB-UHFFFAOYSA-N -1 1 323.779 4.402 20 0 DIADMM CC(C)c1cnc(-c2ccc(NC(=O)c3ccccc3[O-])cc2)o1 ZINC000436547048 338276416 /nfs/dbraw/zinc/27/64/16/338276416.db2.gz IUMJGKQZFMFBER-UHFFFAOYSA-N -1 1 322.364 4.423 20 0 DIADMM CCOc1cc(-c2nc(CC3CCCC3)no2)cc(Cl)c1[O-] ZINC000436566230 338277533 /nfs/dbraw/zinc/27/75/33/338277533.db2.gz WECULUOYRWREDN-UHFFFAOYSA-N -1 1 322.792 4.227 20 0 DIADMM O=C(c1cc2ccccc2cc1[O-])N1CC[C@H]1Cc1ccccc1 ZINC000436573068 338277745 /nfs/dbraw/zinc/27/77/45/338277745.db2.gz HAEOBYFBVDMIMF-SFHVURJKSA-N -1 1 317.388 4.003 20 0 DIADMM O=C(c1cc(F)ccc1[O-])N1CCCC[C@H]1c1ccc(F)cc1 ZINC000436573922 338277864 /nfs/dbraw/zinc/27/78/64/338277864.db2.gz JNOAPTUEPNTRPX-INIZCTEOSA-N -1 1 317.335 4.038 20 0 DIADMM O=C(c1cc(F)ccc1[O-])N1CCCC[C@@H]1c1ccc(F)cc1 ZINC000436573924 338277866 /nfs/dbraw/zinc/27/78/66/338277866.db2.gz JNOAPTUEPNTRPX-MRXNPFEDSA-N -1 1 317.335 4.038 20 0 DIADMM CCSCC[C@H](C)N(C)C(=O)c1cc2ccccc2cc1[O-] ZINC000436579595 338278231 /nfs/dbraw/zinc/27/82/31/338278231.db2.gz YHJLCILEBQOBFO-ZDUSSCGKSA-N -1 1 317.454 4.149 20 0 DIADMM Cc1cc(N2CCCC[C@H]2C)ccc1NC(=O)c1ccccc1[O-] ZINC000436584206 338278469 /nfs/dbraw/zinc/27/84/69/338278469.db2.gz GTACOKGVGPMJFW-OAHLLOKOSA-N -1 1 324.424 4.332 20 0 DIADMM C[C@@H]1[C@H](c2ccccc2)CCN1C(=O)c1cc(Cl)ccc1[O-] ZINC000436590929 338278992 /nfs/dbraw/zinc/27/89/92/338278992.db2.gz UWTGFGHXMAUTND-IUODEOHRSA-N -1 1 315.800 4.064 20 0 DIADMM O=C(Nc1ccc(Sc2ccncc2)cc1)c1ccccc1[O-] ZINC000436602982 338279524 /nfs/dbraw/zinc/27/95/24/338279524.db2.gz LWHHQDABUSEOMP-UHFFFAOYSA-N -1 1 322.389 4.191 20 0 DIADMM CC(C)[C@H](NC(=O)c1ccc([O-])cc1F)c1ccc(Cl)cc1 ZINC000436606825 338279549 /nfs/dbraw/zinc/27/95/49/338279549.db2.gz NKIMMNOSSAYFAC-INIZCTEOSA-N -1 1 321.779 4.312 20 0 DIADMM CC(C)[C@@H](NC(=O)c1ccc([O-])cc1F)c1ccc(Cl)cc1 ZINC000436606828 338279688 /nfs/dbraw/zinc/27/96/88/338279688.db2.gz NKIMMNOSSAYFAC-MRXNPFEDSA-N -1 1 321.779 4.312 20 0 DIADMM CCOC(=O)c1sc(/C=C/c2ccc([O-])c(Cl)c2)nc1C ZINC000436614360 338280093 /nfs/dbraw/zinc/28/00/93/338280093.db2.gz WTECWFFVIYMBHQ-FNORWQNLSA-N -1 1 323.801 4.158 20 0 DIADMM O=C(c1ccc2ccccc2c1[O-])N(CC(F)F)CC1CCC1 ZINC000436667862 338282184 /nfs/dbraw/zinc/28/21/84/338282184.db2.gz ZZCBYYYUZNAUOM-UHFFFAOYSA-N -1 1 319.351 4.053 20 0 DIADMM O=C(NCC1(C(F)(F)F)CCC1)c1cc2ccccc2cc1[O-] ZINC000436685177 338282831 /nfs/dbraw/zinc/28/28/31/338282831.db2.gz KNMKMOXCZMLRIH-UHFFFAOYSA-N -1 1 323.314 4.008 20 0 DIADMM Cc1ccc(Cl)cc1-c1noc(-c2ccc([O-])cc2F)n1 ZINC000436689511 338282962 /nfs/dbraw/zinc/28/29/62/338282962.db2.gz OENGZTHMMXJMPZ-UHFFFAOYSA-N -1 1 304.708 4.210 20 0 DIADMM O=C(NCC1(C(F)(F)F)CCC1)c1ccc2ccccc2c1[O-] ZINC000436688650 338283037 /nfs/dbraw/zinc/28/30/37/338283037.db2.gz UNMFQBYFNJMLJQ-UHFFFAOYSA-N -1 1 323.314 4.008 20 0 DIADMM C[C@@H](c1noc(-c2ccc([O-])cc2F)n1)c1c(F)cccc1F ZINC000436692780 338283220 /nfs/dbraw/zinc/28/32/20/338283220.db2.gz YDRCUKPVPDCBSJ-MRVPVSSYSA-N -1 1 320.270 4.011 20 0 DIADMM C[C@H]1CCN(C(=O)c2cc3ccccc3cc2[O-])CC12CCC2 ZINC000436717869 338283966 /nfs/dbraw/zinc/28/39/66/338283966.db2.gz YITSNHJBSQYSNV-AWEZNQCLSA-N -1 1 309.409 4.198 20 0 DIADMM C[C@@H](CN(C)C(=O)c1cc2ccccc2cc1[O-])c1ccccc1 ZINC000436741290 338285053 /nfs/dbraw/zinc/28/50/53/338285053.db2.gz SFAPWOYOFXTMIO-HNNXBMFYSA-N -1 1 319.404 4.421 20 0 DIADMM O=C(Nc1ccc2[nH]ccc2c1)c1cc2ccccc2cc1[O-] ZINC000436752509 338285395 /nfs/dbraw/zinc/28/53/95/338285395.db2.gz AMUPMXLIGYZEJY-UHFFFAOYSA-N -1 1 302.333 4.279 20 0 DIADMM CCN(C(=O)c1ccc2ccccc2c1[O-])c1cccc(OC)c1 ZINC000436760339 338286270 /nfs/dbraw/zinc/28/62/70/338286270.db2.gz BDNXAXHETZQRSH-UHFFFAOYSA-N -1 1 321.376 4.221 20 0 DIADMM C[C@H]1Cc2ccccc2N1C(=O)c1ccc(C(F)(F)F)cc1[O-] ZINC000436794938 338287636 /nfs/dbraw/zinc/28/76/36/338287636.db2.gz PQRZQPNIKNQFII-JTQLQIEISA-N -1 1 321.298 4.002 20 0 DIADMM CC(C)CN(CC(C)C)C(=O)c1ccc(C(F)(F)F)cc1[O-] ZINC000436816506 338288509 /nfs/dbraw/zinc/28/85/09/338288509.db2.gz DVSPJIZQIUUMFQ-UHFFFAOYSA-N -1 1 317.351 4.165 20 0 DIADMM CCc1cc(NC(=O)c2cc(Cl)c([O-])c(OC)c2)ccc1F ZINC000436844093 338289642 /nfs/dbraw/zinc/28/96/42/338289642.db2.gz LUUKBLUAXXSEJF-UHFFFAOYSA-N -1 1 323.751 4.008 20 0 DIADMM CC(=O)c1cc(NC(=O)c2cc3ccccc3cc2[O-])ccc1F ZINC000436855785 338289973 /nfs/dbraw/zinc/28/99/73/338289973.db2.gz JWJQRXIPCVAWME-UHFFFAOYSA-N -1 1 323.323 4.139 20 0 DIADMM CC(C)C[C@H](NC(=O)c1ccc([O-])cc1F)c1ccccc1 ZINC000436861537 338290318 /nfs/dbraw/zinc/29/03/18/338290318.db2.gz KVLMBFIMDZKMPO-KRWDZBQOSA-N -1 1 301.361 4.049 20 0 DIADMM CCOc1cc(-c2noc(C[C@@H](C)CC)n2)cc(Cl)c1[O-] ZINC000436871928 338290928 /nfs/dbraw/zinc/29/09/28/338290928.db2.gz UUQAEJVQUOWBNB-VIFPVBQESA-N -1 1 310.781 4.083 20 0 DIADMM Cc1ncsc1/C=C/c1nc(-c2ccc([O-])cc2Cl)no1 ZINC000436871810 338290979 /nfs/dbraw/zinc/29/09/79/338290979.db2.gz LEBGILQKMQPQSE-SNAWJCMRSA-N -1 1 319.773 4.031 20 0 DIADMM CC[C@@H]1CCCC[C@H]1OCc1nc(-c2ccc([O-])cc2F)no1 ZINC000436871797 338291028 /nfs/dbraw/zinc/29/10/28/338291028.db2.gz IJBXVBIBLLBNRQ-IAQYHMDHSA-N -1 1 320.364 4.067 20 0 DIADMM Cc1ccc([C@@H]2C[C@H](C)CCN2C(=O)c2ccc([O-])cc2F)o1 ZINC000436877622 338291202 /nfs/dbraw/zinc/29/12/02/338291202.db2.gz BLDIFDXHENWAOZ-BZNIZROVSA-N -1 1 317.360 4.046 20 0 DIADMM [O-]c1ccc(-c2noc(-c3coc4cc(F)ccc34)n2)c(F)c1 ZINC000436877821 338291233 /nfs/dbraw/zinc/29/12/33/338291233.db2.gz HVCSSQAGSXNJAC-UHFFFAOYSA-N -1 1 314.247 4.134 20 0 DIADMM C[C@H]1[C@@H](c2nc(-c3ccc([O-])cc3F)no2)[C@@H]1c1ccccc1 ZINC000436878139 338291323 /nfs/dbraw/zinc/29/13/23/338291323.db2.gz IMTFVBJBGHEHCJ-HPEXNQPKSA-N -1 1 310.328 4.098 20 0 DIADMM CC(C)[C@@H](c1ccccc1)N(C)C(=O)c1ccc([O-])cc1F ZINC000436878612 338291367 /nfs/dbraw/zinc/29/13/67/338291367.db2.gz GBMZOLNDGRTNFV-KRWDZBQOSA-N -1 1 301.361 4.001 20 0 DIADMM COc1cccc([C@H](C)NC(=O)c2cc3ccccc3cc2[O-])c1 ZINC000436885999 338291760 /nfs/dbraw/zinc/29/17/60/338291760.db2.gz IWYJIQVMMYGCPK-ZDUSSCGKSA-N -1 1 321.376 4.045 20 0 DIADMM CCCOC1(c2noc(-c3cc(F)ccc3[O-])n2)CCCCC1 ZINC000436882937 338291858 /nfs/dbraw/zinc/29/18/58/338291858.db2.gz YDUSGAZQULHTEZ-UHFFFAOYSA-N -1 1 320.364 4.167 20 0 DIADMM Cc1ccc(-c2ccc(C)c(NC(=O)c3ccc(O)cc3[O-])c2)o1 ZINC000436889045 338291891 /nfs/dbraw/zinc/29/18/91/338291891.db2.gz AGAZUSORCVXBPP-UHFFFAOYSA-N -1 1 323.348 4.227 20 0 DIADMM [O-]c1ccc(F)cc1-c1nc(Cc2cccc3ccccc32)no1 ZINC000436891327 338292133 /nfs/dbraw/zinc/29/21/33/338292133.db2.gz XBVIPVDGQHLWBJ-UHFFFAOYSA-N -1 1 320.323 4.325 20 0 DIADMM [O-]c1ccc(Oc2ccccc2)cc1-c1nc(CC2CC2)no1 ZINC000436892802 338292234 /nfs/dbraw/zinc/29/22/34/338292234.db2.gz NJPXZMAGSWJSOU-UHFFFAOYSA-N -1 1 308.337 4.187 20 0 DIADMM [O-]c1ccc(F)cc1-c1nc(-c2ccc(C(F)(F)F)cc2)no1 ZINC000436896534 338292603 /nfs/dbraw/zinc/29/26/03/338292603.db2.gz ZEGQLUWROKJVDH-UHFFFAOYSA-N -1 1 324.233 4.267 20 0 DIADMM C[C@@H](c1noc(-c2cc(F)ccc2[O-])n1)c1c(F)cccc1F ZINC000436932712 338294212 /nfs/dbraw/zinc/29/42/12/338294212.db2.gz QVTBJOYOBJECJI-MRVPVSSYSA-N -1 1 320.270 4.011 20 0 DIADMM CC(F)(F)c1ccc(-c2noc(-c3ccc([O-])cc3F)n2)cc1 ZINC000436954983 338295671 /nfs/dbraw/zinc/29/56/71/338295671.db2.gz BODFYPOKQLHXFV-UHFFFAOYSA-N -1 1 320.270 4.360 20 0 DIADMM Cc1c(F)cccc1S(=O)(=O)[N-]c1cccc2ccccc21 ZINC000438793495 338352185 /nfs/dbraw/zinc/35/21/85/338352185.db2.gz GQKRIABHWJVVNM-UHFFFAOYSA-N -1 1 315.369 4.088 20 0 DIADMM Cc1c(F)cccc1S(=O)(=O)[N-]c1cccc(C(C)C)c1 ZINC000438792308 338352226 /nfs/dbraw/zinc/35/22/26/338352226.db2.gz IJLIPDZIEHRTED-UHFFFAOYSA-N -1 1 307.390 4.058 20 0 DIADMM O=C(CCCC1CCCC1)Nc1ccc(-c2cc(=O)[nH][n-]2)cc1 ZINC000439071795 338360258 /nfs/dbraw/zinc/36/02/58/338360258.db2.gz PPWFEEIFXLESFE-UHFFFAOYSA-N -1 1 313.401 4.081 20 0 DIADMM O=C([O-])c1cccc2oc(/C=C/c3ccc(O)c(Cl)c3)nc21 ZINC000439271927 338365641 /nfs/dbraw/zinc/36/56/41/338365641.db2.gz HIHMVRDOTLVFBE-FNORWQNLSA-N -1 1 315.712 4.055 20 0 DIADMM Cc1cc(Br)c([O-])c(NC(=O)C(C)(C)C(C)C)c1 ZINC000439748646 338377087 /nfs/dbraw/zinc/37/70/87/338377087.db2.gz RFOXTHSXXYUXGA-UHFFFAOYSA-N -1 1 314.223 4.084 20 0 DIADMM O=C(c1ccc(Cl)cc1[O-])N1CC2(CCC2)[C@@H]1c1ccco1 ZINC000456579607 338934841 /nfs/dbraw/zinc/93/48/41/338934841.db2.gz XLUODRGKOAVURR-HNNXBMFYSA-N -1 1 317.772 4.006 20 0 DIADMM O=C(Nc1ccc([O-])c(F)c1F)C1(Cc2ccccc2)CCC1 ZINC000456782974 338940450 /nfs/dbraw/zinc/94/04/50/338940450.db2.gz LAWUBISATFTECG-UHFFFAOYSA-N -1 1 317.335 4.022 20 0 DIADMM O=C(Nc1ccc([O-])c(F)c1F)[C@@H]1CCC[C@@H]1c1ccccc1 ZINC000456790070 338940816 /nfs/dbraw/zinc/94/08/16/338940816.db2.gz VJZYJIGMQMAUEL-CHWSQXEVSA-N -1 1 317.335 4.193 20 0 DIADMM Cc1cccc(Cl)c1[N-]S(=O)(=O)c1ccc(Cl)s1 ZINC000461160998 339059863 /nfs/dbraw/zinc/05/98/63/339059863.db2.gz LHIBNXJZZIEQFK-UHFFFAOYSA-N -1 1 322.238 4.164 20 0 DIADMM Cc1cc(Br)c([O-])c(NC(=O)[C@H](C)CC(C)C)c1 ZINC000462761661 339087352 /nfs/dbraw/zinc/08/73/52/339087352.db2.gz AVCORQGKBVECQT-SNVBAGLBSA-N -1 1 314.223 4.084 20 0 DIADMM Cc1cccc([C@@H](C)Sc2nc(C(F)(F)F)cc(=O)[n-]2)c1 ZINC000463261220 339112475 /nfs/dbraw/zinc/11/24/75/339112475.db2.gz HOJILZDLJJJUPO-SECBINFHSA-N -1 1 314.332 4.363 20 0 DIADMM Cc1c(F)cccc1[N-]S(=O)(=O)c1ccc2ccccc2c1 ZINC000467072295 339225723 /nfs/dbraw/zinc/22/57/23/339225723.db2.gz AXMSUOXHLUJGQF-UHFFFAOYSA-N -1 1 315.369 4.088 20 0 DIADMM Cc1ccc(Oc2ccccc2)c(NC(=O)c2cncc([O-])c2)c1 ZINC000469718102 339296513 /nfs/dbraw/zinc/29/65/13/339296513.db2.gz PLBVFCVLSXQHPM-UHFFFAOYSA-N -1 1 320.348 4.140 20 0 DIADMM CCc1ccc(S(=O)(=O)[N-]c2c(C)cccc2SC)cc1 ZINC000471987912 339358901 /nfs/dbraw/zinc/35/89/01/339358901.db2.gz FDNPGHHDJVXKDK-UHFFFAOYSA-N -1 1 321.467 4.080 20 0 DIADMM O=C(C[C@@H]1CCc2ccccc2C1)Nc1ccc([O-])c(Cl)c1 ZINC000481201159 339598419 /nfs/dbraw/zinc/59/84/19/339598419.db2.gz SVXUQEWKKPBFDH-GFCCVEGCSA-N -1 1 315.800 4.179 20 0 DIADMM Cc1ccc(C(=O)Nc2cc(C)cc(Br)c2[O-])cc1 ZINC000482575286 339636574 /nfs/dbraw/zinc/63/65/74/339636574.db2.gz KNCLRDBDXOUCKI-UHFFFAOYSA-N -1 1 320.186 4.024 20 0 DIADMM [O-]c1cccc(CN2CCc3[nH]c4ccccc4c3C2)c1Cl ZINC000507067392 340206471 /nfs/dbraw/zinc/20/64/71/340206471.db2.gz JJCIRWYHMRVBHW-UHFFFAOYSA-N -1 1 312.800 4.085 20 0 DIADMM C[C@H]1CO[C@H](c2ccccc2)CN1Cc1cccc([O-])c1Cl ZINC000508171144 340240052 /nfs/dbraw/zinc/24/00/52/340240052.db2.gz CZSVIZISECDXDT-GUYCJALGSA-N -1 1 317.816 4.008 20 0 DIADMM C[C@H]1CN(Cc2cccc([O-])c2Cl)[C@H](c2ccccc2)CO1 ZINC000508750292 340252312 /nfs/dbraw/zinc/25/23/12/340252312.db2.gz YVGIPOIZYJFAAN-BBRMVZONSA-N -1 1 317.816 4.008 20 0 DIADMM C[C@H]1CN(Cc2cccc([O-])c2Cl)[C@@H](c2ccccc2)CO1 ZINC000508750296 340252412 /nfs/dbraw/zinc/25/24/12/340252412.db2.gz YVGIPOIZYJFAAN-XJKSGUPXSA-N -1 1 317.816 4.008 20 0 DIADMM Cc1cc(C)cc(C2(C(=O)Nc3ccc([O-])c(Cl)c3)CC2)c1 ZINC000509165530 340262814 /nfs/dbraw/zinc/26/28/14/340262814.db2.gz KJAZJALVYFKXLE-UHFFFAOYSA-N -1 1 315.800 4.333 20 0 DIADMM O=C(c1cc(Cl)ccc1[O-])N1CCC[C@]2(CC=CCC2)C1 ZINC000303582383 340335755 /nfs/dbraw/zinc/33/57/55/340335755.db2.gz PGZASXJKQLDRJC-QGZVFWFLSA-N -1 1 305.805 4.008 20 0 DIADMM CC(C)c1cccc(S(=O)(=O)[N-]c2cccc3[nH]ccc32)c1 ZINC000172891048 340346230 /nfs/dbraw/zinc/34/62/30/340346230.db2.gz XXXOXNZMCPZDNY-UHFFFAOYSA-N -1 1 314.410 4.092 20 0 DIADMM CCC1(c2noc(-c3cc(Cl)c([O-])c(OC)c3)n2)CCCC1 ZINC000516845503 340457102 /nfs/dbraw/zinc/45/71/02/340457102.db2.gz RVGSXTCGRXOHGP-UHFFFAOYSA-N -1 1 322.792 4.326 20 0 DIADMM CCOc1cc(F)ccc1NC(=O)Nc1ccc([O-])c(Cl)c1 ZINC000190944035 340548297 /nfs/dbraw/zinc/54/82/97/340548297.db2.gz BNSQTLUAXLKXNE-UHFFFAOYSA-N -1 1 324.739 4.227 20 0 DIADMM [O-]c1c(-c2nc(CCC(F)(F)F)no2)ccc2ccccc21 ZINC000317023325 340699746 /nfs/dbraw/zinc/69/97/46/340699746.db2.gz PSKCWWKGHZPKMY-UHFFFAOYSA-N -1 1 308.259 4.090 20 0 DIADMM CC[C@@H]1CC[C@@H](C(=O)Nc2cc(Cl)c([O-])c3ccccc23)O1 ZINC000529539781 340761142 /nfs/dbraw/zinc/76/11/42/340761142.db2.gz UGRBVTZNWAMGSF-BMIGLBTASA-N -1 1 319.788 4.095 20 0 DIADMM CCc1cccc(S(=O)(=O)[N-]c2c(C)cccc2C(C)C)c1 ZINC000538010818 340807307 /nfs/dbraw/zinc/80/73/07/340807307.db2.gz WMIOEHVAQCPRHN-UHFFFAOYSA-N -1 1 317.454 4.482 20 0 DIADMM CC(C)c1cccc(N(C)C(=O)c2c(F)ccc([O-])c2F)c1 ZINC000540545873 340935617 /nfs/dbraw/zinc/93/56/17/340935617.db2.gz TXCXQRRPCLLKCH-UHFFFAOYSA-N -1 1 305.324 4.070 20 0 DIADMM O=C(C/C=C/c1ccc(F)cc1)Nc1ccc([O-])c(Cl)c1 ZINC000129582990 340972812 /nfs/dbraw/zinc/97/28/12/340972812.db2.gz VNXHVAOSVJFXKD-OWOJBTEDSA-N -1 1 305.736 4.227 20 0 DIADMM CC(C)(C(=O)Nc1ccc([O-])c(Cl)c1)c1ccc(F)cc1 ZINC000129587645 340972961 /nfs/dbraw/zinc/97/29/61/340972961.db2.gz BAICLLKCLHQAAS-UHFFFAOYSA-N -1 1 307.752 4.101 20 0 DIADMM O=C(Cc1csc2ccccc12)Nc1ccc([O-])c(Cl)c1 ZINC000543745412 341056463 /nfs/dbraw/zinc/05/64/63/341056463.db2.gz WEAIFPQFKBHAPP-UHFFFAOYSA-N -1 1 317.797 4.442 20 0 DIADMM O=C([N-]c1c(F)cc(F)cc1F)c1cnc(-c2ccco2)s1 ZINC000072506241 341087573 /nfs/dbraw/zinc/08/75/73/341087573.db2.gz PIQSTNGNRGSOIM-UHFFFAOYSA-N -1 1 324.283 4.073 20 0 DIADMM CCOc1cc(C(=O)NC(CC)(CC)CC)cc(Cl)c1[O-] ZINC000545147419 341110257 /nfs/dbraw/zinc/11/02/57/341110257.db2.gz DZGBRVDFUKVXMT-UHFFFAOYSA-N -1 1 313.825 4.143 20 0 DIADMM Cc1cc(Cl)c([N-]S(=O)(=O)c2cccs2)cc1Cl ZINC000133600527 341179644 /nfs/dbraw/zinc/17/96/44/341179644.db2.gz OOOBJAGBZQJAHB-UHFFFAOYSA-N -1 1 322.238 4.164 20 0 DIADMM Cc1noc(C2CC2)c1[N-]C(=O)c1coc(C2CCCCC2)n1 ZINC000548273681 341253717 /nfs/dbraw/zinc/25/37/17/341253717.db2.gz IOQFMFNTVWBZFV-UHFFFAOYSA-N -1 1 315.373 4.148 20 0 DIADMM CC(C)CCC(=O)Nc1c([O-])cc(Br)cc1Cl ZINC000552022633 341362419 /nfs/dbraw/zinc/36/24/19/341362419.db2.gz ZRLOOMXRBZORFL-UHFFFAOYSA-N -1 1 320.614 4.183 20 0 DIADMM CC(C)(C)CC(=O)Nc1c([O-])cc(Br)cc1Cl ZINC000552027077 341362719 /nfs/dbraw/zinc/36/27/19/341362719.db2.gz USXCNOJXSJXRDK-UHFFFAOYSA-N -1 1 320.614 4.183 20 0 DIADMM Cc1noc(C2CC2)c1[N-]C(=O)c1cc(F)c(Cl)cc1F ZINC000152900502 341510630 /nfs/dbraw/zinc/51/06/30/341510630.db2.gz HXIDCYYAEQHOEB-UHFFFAOYSA-N -1 1 312.703 4.044 20 0 DIADMM C/C=C\c1ccc([N-]S(=O)(=O)c2ccc(C(F)F)cc2)cc1 ZINC000568403915 341670142 /nfs/dbraw/zinc/67/01/42/341670142.db2.gz WSVRYYHXRKVIJJ-IHWYPQMZSA-N -1 1 323.364 4.458 20 0 DIADMM O=C(Nc1ccc([O-])c(Cl)c1)c1cnc(-c2ccco2)s1 ZINC000171881450 341787315 /nfs/dbraw/zinc/78/73/15/341787315.db2.gz PCIFDGHQUPHKQO-UHFFFAOYSA-N -1 1 320.757 4.014 20 0 DIADMM [O-]c1cc(F)c(Nc2cccc(Br)n2)cc1Cl ZINC001250018154 1060542021 /nfs/dbraw/zinc/54/20/21/1060542021.db2.gz OHZCVYHMNBSLIK-UHFFFAOYSA-N -1 1 317.545 4.086 20 0 DIADMM CC(C)c1ccc(CN[C@H](C(=O)[O-])c2cc(F)ccc2F)cc1 ZINC000683175606 1035662247 /nfs/dbraw/zinc/66/22/47/1035662247.db2.gz YDWCRBPNFUSYKP-KRWDZBQOSA-N -1 1 319.351 4.004 20 0 DIADMM CCCN(C(=O)c1cncc([O-])c1)[C@@H](C)c1cc2ccccc2o1 ZINC000339814181 1035971128 /nfs/dbraw/zinc/97/11/28/1035971128.db2.gz LGKLSBFLPUJOKH-ZDUSSCGKSA-N -1 1 324.380 4.147 20 0 DIADMM CCc1cc(=O)[n-]c(SCc2cc(C(C)C)ccc2OC)n1 ZINC000655500554 1036042971 /nfs/dbraw/zinc/04/29/71/1036042971.db2.gz XHJOKHOIIOYNBA-UHFFFAOYSA-N -1 1 318.442 4.169 20 0 DIADMM O=C(Nc1ccc2ncsc2c1)c1cc2ccccc2cc1[O-] ZINC000322989486 1036126130 /nfs/dbraw/zinc/12/61/30/1036126130.db2.gz HCNLZKBVTIRJRE-UHFFFAOYSA-N -1 1 320.373 4.407 20 0 DIADMM O=C(CCc1ccc(-c2ccccc2)[nH]1)Nc1cccc(F)c1[O-] ZINC001648846884 1036628086 /nfs/dbraw/zinc/62/80/86/1036628086.db2.gz HYHUOZIGOCBPPS-UHFFFAOYSA-N -1 1 324.355 4.098 20 0 DIADMM CC(C)[C@H]1N(C(=O)c2ccc([O-])cc2F)CC12CCCCCC2 ZINC001648893822 1036674591 /nfs/dbraw/zinc/67/45/91/1036674591.db2.gz CKHXKABEXVTMGR-QGZVFWFLSA-N -1 1 319.420 4.352 20 0 DIADMM CC(C)[C@@H]1N(C(=O)c2ccc([O-])cc2F)CC12CCCCCC2 ZINC001648893721 1036674627 /nfs/dbraw/zinc/67/46/27/1036674627.db2.gz CKHXKABEXVTMGR-KRWDZBQOSA-N -1 1 319.420 4.352 20 0 DIADMM Cc1oncc1[N-]c1cc(-c2ccc(Br)cc2)no1 ZINC001210579736 1036829301 /nfs/dbraw/zinc/82/93/01/1036829301.db2.gz ZOFUQZXUOVEYKJ-UHFFFAOYSA-N -1 1 320.146 4.144 20 0 DIADMM CCOC(=O)c1nc(C)sc1[N-]c1cc2cc(F)ccc2o1 ZINC001210726672 1036926016 /nfs/dbraw/zinc/92/60/16/1036926016.db2.gz RRQZAHJRBKCZGS-UHFFFAOYSA-N -1 1 320.345 4.257 20 0 DIADMM Cc1ccc2oc([N-][C@H](C[C@H]3CCCO3)C(F)(F)F)nc2c1 ZINC000656224568 1037147084 /nfs/dbraw/zinc/14/70/84/1037147084.db2.gz MJXNXGVCMCNTKC-ZWNOBZJWSA-N -1 1 314.307 4.048 20 0 DIADMM CCCc1nc(-c2nc(=O)c3c4ccccc4sc3[n-]2)co1 ZINC000580480089 1037156880 /nfs/dbraw/zinc/15/68/80/1037156880.db2.gz NYOAKTZFQQQKLN-UHFFFAOYSA-N -1 1 311.366 4.158 20 0 DIADMM CCc1cccc2cc(CN[C@@H](CCC(C)(C)C)C(=O)[O-])oc21 ZINC000656573442 1037660782 /nfs/dbraw/zinc/66/07/82/1037660782.db2.gz PJYOBOTYLXETDI-INIZCTEOSA-N -1 1 317.429 4.364 20 0 DIADMM CC[C@@H](C)CC(=O)Nc1c([O-])cc(Br)cc1Cl ZINC000581682522 1037903517 /nfs/dbraw/zinc/90/35/17/1037903517.db2.gz VRXYMWTUDBKLME-SSDOTTSWSA-N -1 1 320.614 4.183 20 0 DIADMM CC(C)c1ccc(C(=O)Nc2cccc(N3CCCC3)c2)c([O-])c1 ZINC000065073763 1038245204 /nfs/dbraw/zinc/24/52/04/1038245204.db2.gz AUBNHAFSMYPVGS-UHFFFAOYSA-N -1 1 324.424 4.368 20 0 DIADMM [O-]c1cc(Nc2cnc(Br)s2)c(F)cc1Cl ZINC001216267350 1038463726 /nfs/dbraw/zinc/46/37/26/1038463726.db2.gz SAGGXKMOQSUJOM-UHFFFAOYSA-N -1 1 323.574 4.147 20 0 DIADMM CCc1nc(SCc2cccc(SC)c2)[n-]c(=O)c1C ZINC000657264131 1038480235 /nfs/dbraw/zinc/48/02/35/1038480235.db2.gz FZLRAEFBZFRUFJ-UHFFFAOYSA-N -1 1 306.456 4.067 20 0 DIADMM O=C(Nc1c([O-])cccc1F)c1ccc(-c2ccc(F)cc2)o1 ZINC000605435864 1038516158 /nfs/dbraw/zinc/51/61/58/1038516158.db2.gz IVFPVCAJPTZGEN-UHFFFAOYSA-N -1 1 315.275 4.183 20 0 DIADMM O=C(Nc1c([O-])cccc1F)c1cc(Cl)sc1Cl ZINC000605434817 1038516967 /nfs/dbraw/zinc/51/69/67/1038516967.db2.gz CMYVDRSOBMEFGE-UHFFFAOYSA-N -1 1 306.145 4.152 20 0 DIADMM C[C@@H](Sc1nc(C(F)(F)F)cc(=O)[n-]1)c1cccc(F)c1 ZINC000605446902 1038517501 /nfs/dbraw/zinc/51/75/01/1038517501.db2.gz QSYGDUGRCIVJDY-SSDOTTSWSA-N -1 1 318.295 4.193 20 0 DIADMM CN(C(=O)c1ccc(C(F)(F)F)c([O-])c1)C1CCCCCC1 ZINC000684870980 1038668138 /nfs/dbraw/zinc/66/81/38/1038668138.db2.gz VZOODTRDALBWKA-UHFFFAOYSA-N -1 1 315.335 4.206 20 0 DIADMM O=C(Nc1cccc2[nH]ccc21)c1ccc(C(F)(F)F)c([O-])c1 ZINC000684872259 1038669272 /nfs/dbraw/zinc/66/92/72/1038669272.db2.gz GZVRJXABUNQYFM-UHFFFAOYSA-N -1 1 320.270 4.145 20 0 DIADMM O=C(Nc1c([O-])cccc1F)[C@@H]1C[C@@H]1c1cccc2ccccc21 ZINC000608367203 1038829570 /nfs/dbraw/zinc/82/95/70/1038829570.db2.gz MQMYQYNZINWIGD-HZPDHXFCSA-N -1 1 321.351 4.427 20 0 DIADMM CCc1ccc([C@@H](C)CC(=O)Nc2ccc([O-])c(F)c2F)cc1 ZINC000456762141 1039074898 /nfs/dbraw/zinc/07/48/98/1039074898.db2.gz AMASNEHQQHPBPK-NSHDSACASA-N -1 1 319.351 4.365 20 0 DIADMM CCc1ccc(C(C)(C)C(=O)Nc2ccc([O-])c(F)c2F)cc1 ZINC000456792028 1039078656 /nfs/dbraw/zinc/07/86/56/1039078656.db2.gz ZLHYWTIQUVLQSI-UHFFFAOYSA-N -1 1 319.351 4.149 20 0 DIADMM CC(C)c1ccccc1OCCC(=O)Nc1c([O-])cccc1F ZINC000092551674 1039281469 /nfs/dbraw/zinc/28/14/69/1039281469.db2.gz CBOIAIJSYSCHKU-UHFFFAOYSA-N -1 1 317.360 4.062 20 0 DIADMM C[C@@H](c1ccc(Cl)c(Cl)c1)N1CC[C@H](C(=O)[O-])[C@H](C)C1 ZINC000380191071 1039336299 /nfs/dbraw/zinc/33/62/99/1039336299.db2.gz DRVTUJAIHFVPSD-SCVCMEIPSA-N -1 1 316.228 4.097 20 0 DIADMM O=C([O-])c1ccoc1CN1CCCC[C@@H]1c1cc2ccccc2[nH]1 ZINC000583505268 1039352661 /nfs/dbraw/zinc/35/26/61/1039352661.db2.gz YTDDQKNIOCIJGX-QGZVFWFLSA-N -1 1 324.380 4.186 20 0 DIADMM O=C(CCc1cc2ccccc2o1)Nc1ccc([O-])c(Cl)c1 ZINC000541887466 1039756526 /nfs/dbraw/zinc/75/65/26/1039756526.db2.gz QOKNUHBXKWZSLM-UHFFFAOYSA-N -1 1 315.756 4.363 20 0 DIADMM CC[C@H](Cc1ccccc1)C(=O)Nc1ccc([O-])c(Cl)c1 ZINC000541887683 1039756869 /nfs/dbraw/zinc/75/68/69/1039756869.db2.gz FMYTZPGCMHLXQB-CYBMUJFWSA-N -1 1 303.789 4.253 20 0 DIADMM O=S(=O)([N-]c1ccccc1)c1cccc(-c2ccccc2)c1 ZINC000149436178 1039960735 /nfs/dbraw/zinc/96/07/35/1039960735.db2.gz YLCQPVZBJCLNJG-UHFFFAOYSA-N -1 1 309.390 4.154 20 0 DIADMM C[C@@H](Sc1nc(C(F)F)cc(=O)[n-]1)c1c(F)cccc1F ZINC000685575175 1040141714 /nfs/dbraw/zinc/14/17/14/1040141714.db2.gz VCEVCFJUMKDLDT-ZCFIWIBFSA-N -1 1 318.295 4.251 20 0 DIADMM C[C@@H](Sc1nc(C(F)F)cc(=O)[n-]1)c1ccccc1F ZINC000685574994 1040142050 /nfs/dbraw/zinc/14/20/50/1040142050.db2.gz WWIWUCVPLYBYIB-SSDOTTSWSA-N -1 1 300.305 4.112 20 0 DIADMM CCC[C@H](OCC)C(=O)Nc1cc(Cl)c([O-])c2ccccc12 ZINC000628233775 1040241315 /nfs/dbraw/zinc/24/13/15/1040241315.db2.gz UPXJCKOVRPHMJP-HNNXBMFYSA-N -1 1 321.804 4.343 20 0 DIADMM C[C@H](c1ccc(Cl)c(Cl)c1)N1CC[C@@H](C)[C@H](C(=O)[O-])C1 ZINC000647367784 1040254853 /nfs/dbraw/zinc/25/48/53/1040254853.db2.gz OADCVEXITSTLAR-CKYFFXLPSA-N -1 1 316.228 4.097 20 0 DIADMM C[C@@H](c1ccc(Cl)c(Cl)c1)N1CC[C@@H](C)[C@H](C(=O)[O-])C1 ZINC000647367786 1040255324 /nfs/dbraw/zinc/25/53/24/1040255324.db2.gz OADCVEXITSTLAR-JFGNBEQYSA-N -1 1 316.228 4.097 20 0 DIADMM COCC(C)(C)CC(=O)Nc1cc(Cl)c([O-])c2ccccc12 ZINC000628233744 1040522136 /nfs/dbraw/zinc/52/21/36/1040522136.db2.gz SIZWXFAHMRQFLN-UHFFFAOYSA-N -1 1 321.804 4.200 20 0 DIADMM CCOc1ccc(/C=C/C(=O)c2ccc([O-])cc2)cc1OCC ZINC000065999134 1040656251 /nfs/dbraw/zinc/65/62/51/1040656251.db2.gz BRYAIDNPRRJSCI-VZUCSPMQSA-N -1 1 312.365 4.086 20 0 DIADMM CCN(Cc1cc(Cl)c([O-])c(Cl)c1)Cc1ccccn1 ZINC001140832826 1041136913 /nfs/dbraw/zinc/13/69/13/1041136913.db2.gz JXCQEAUASSINJK-UHFFFAOYSA-N -1 1 311.212 4.116 20 0 DIADMM CCOc1cc(C(=O)N(CC)c2ccccc2)cc(Cl)c1[O-] ZINC000186583946 1041158120 /nfs/dbraw/zinc/15/81/20/1041158120.db2.gz CIZAAZBTFSJWJH-UHFFFAOYSA-N -1 1 319.788 4.111 20 0 DIADMM CCOc1cc(C(=O)Nc2c(C)cccc2F)cc(Cl)c1[O-] ZINC000186987766 1041206366 /nfs/dbraw/zinc/20/63/66/1041206366.db2.gz ZMDXLYZRNZLXAK-UHFFFAOYSA-N -1 1 323.751 4.144 20 0 DIADMM CCCc1ccc(S(=O)(=O)[N-]c2cccc(SC)c2)cc1 ZINC000007053481 1041290789 /nfs/dbraw/zinc/29/07/89/1041290789.db2.gz RIASVMHCZQYBLX-UHFFFAOYSA-N -1 1 321.467 4.162 20 0 DIADMM C[C@H](C(=O)Nc1c([O-])cccc1F)c1ccc2ccccc2c1 ZINC000084631936 1041341693 /nfs/dbraw/zinc/34/16/93/1041341693.db2.gz YRPXOQLCKZFIGZ-LBPRGKRZSA-N -1 1 309.340 4.427 20 0 DIADMM O=C(Nc1ccc2c3c(cccc31)CC2)c1ccc([O-])cc1F ZINC000181908444 1041369906 /nfs/dbraw/zinc/36/99/06/1041369906.db2.gz AJBQHWNRHMOORJ-UHFFFAOYSA-N -1 1 307.324 4.035 20 0 DIADMM O=C(Nc1cc([O-])c(F)cc1F)[C@@H]1CC[C@@H]2CCCC[C@@H]2C1 ZINC001625894410 1041513869 /nfs/dbraw/zinc/51/38/69/1041513869.db2.gz WXCLGVLMMQSTED-QJPTWQEYSA-N -1 1 309.356 4.215 20 0 DIADMM [O-]c1cccc(CNc2ccc(OC(F)F)cc2F)c1Cl ZINC000815138916 1041925712 /nfs/dbraw/zinc/92/57/12/1041925712.db2.gz LNYOLAOKEIGKJI-UHFFFAOYSA-N -1 1 317.694 4.398 20 0 DIADMM Cc1c(Cl)cccc1S(=O)(=O)[N-]c1ccc(Cl)cc1 ZINC000048652549 1042019851 /nfs/dbraw/zinc/01/98/51/1042019851.db2.gz VNKFYVOSBCTQJV-UHFFFAOYSA-N -1 1 316.209 4.103 20 0 DIADMM C[N@@H+](CCCCCC(=O)[O-])Cc1ccc(Cl)cc1Cl ZINC000652373863 1042028576 /nfs/dbraw/zinc/02/85/76/1042028576.db2.gz CDCGYVRZVUTZJE-UHFFFAOYSA-N -1 1 304.217 4.070 20 0 DIADMM CN(CCCCCC(=O)[O-])Cc1ccc(Cl)cc1Cl ZINC000652373863 1042028587 /nfs/dbraw/zinc/02/85/87/1042028587.db2.gz CDCGYVRZVUTZJE-UHFFFAOYSA-N -1 1 304.217 4.070 20 0 DIADMM CSc1ccc([O-])c(C(=O)Nc2cccc(C(C)C)c2)c1 ZINC001135505299 1042038382 /nfs/dbraw/zinc/03/83/82/1042038382.db2.gz JGSDOCSQZNNRRN-UHFFFAOYSA-N -1 1 301.411 4.490 20 0 DIADMM CCc1ccc([C@@H]2CCCN2[C@@H](C)c2cc(C(=O)[O-])c(C)o2)o1 ZINC000652416595 1042043335 /nfs/dbraw/zinc/04/33/35/1042043335.db2.gz UQTHBLMNHHHFEB-NHYWBVRUSA-N -1 1 317.385 4.340 20 0 DIADMM O=C([O-])C[C@@H]1CCCCN1Cc1nc(C2CCCCC2)cs1 ZINC000652463874 1042052532 /nfs/dbraw/zinc/05/25/32/1042052532.db2.gz YLSFKCDIUAOABV-AWEZNQCLSA-N -1 1 322.474 4.020 20 0 DIADMM Cc1cc(CN(C)[C@H](C)c2cccc(Cl)c2)oc1C(=O)[O-] ZINC000062015280 1042107624 /nfs/dbraw/zinc/10/76/24/1042107624.db2.gz MVVUTIQGVLSXTF-LLVKDONJSA-N -1 1 307.777 4.133 20 0 DIADMM CC(C)[C@H](NC(=O)c1c([O-])cccc1Cl)c1ccccc1 ZINC001135977873 1042121892 /nfs/dbraw/zinc/12/18/92/1042121892.db2.gz BEZFHRTWAFXREE-INIZCTEOSA-N -1 1 303.789 4.173 20 0 DIADMM CC(C)(C)[C@H]1CCCC[C@H]1NC(=O)c1ccc(Cl)cc1[O-] ZINC001136181123 1042168235 /nfs/dbraw/zinc/16/82/35/1042168235.db2.gz CKBPPUBEHMSGPX-UONOGXRCSA-N -1 1 309.837 4.380 20 0 DIADMM CC(C)[C@@H](CNC(=O)c1cc(Cl)ccc1[O-])c1ccccc1 ZINC001136188091 1042170974 /nfs/dbraw/zinc/17/09/74/1042170974.db2.gz WQQHQXYCYWVOOZ-MRXNPFEDSA-N -1 1 317.816 4.215 20 0 DIADMM COc1cnc(C=Cc2ccc(-c3ccccc3)cc2)[n-]c1=O ZINC000821007386 1042240825 /nfs/dbraw/zinc/24/08/25/1042240825.db2.gz HTUNDNBRKLUKOE-FMIVXFBMSA-N -1 1 304.349 4.028 20 0 DIADMM O=C(Nc1cc([O-])c(F)cc1F)c1cc(C2CC2)oc1C1CC1 ZINC000822543158 1042291040 /nfs/dbraw/zinc/29/10/40/1042291040.db2.gz OLJPIOYRDXTRMS-UHFFFAOYSA-N -1 1 319.307 4.271 20 0 DIADMM Cc1ccc2c(c1)N(C(=O)c1ccc3ccccc3c1[O-])CCC2 ZINC001136753912 1042336352 /nfs/dbraw/zinc/33/63/52/1042336352.db2.gz CFXCPOCNYNAOAP-UHFFFAOYSA-N -1 1 317.388 4.447 20 0 DIADMM CCOc1cc(-c2noc(C(F)=C3CCC3)n2)cc(Cl)c1[O-] ZINC000424355993 1042736816 /nfs/dbraw/zinc/73/68/16/1042736816.db2.gz KIWIMSDMUVODTL-UHFFFAOYSA-N -1 1 324.739 4.359 20 0 DIADMM CCN(Cc1ccc(C(=O)[O-])cn1)[C@@H](C)c1cc2ccccc2o1 ZINC000515305643 1042814678 /nfs/dbraw/zinc/81/46/78/1042814678.db2.gz DEFQWVYVFDGHRT-ZDUSSCGKSA-N -1 1 324.380 4.109 20 0 DIADMM Cc1cnc(SCc2ccc(SC(C)C)cc2)[n-]c1=O ZINC000516785660 1042853874 /nfs/dbraw/zinc/85/38/74/1042853874.db2.gz RGLQSEMKWFLATK-UHFFFAOYSA-N -1 1 306.456 4.283 20 0 DIADMM O=S(=O)([N-]c1ccc2ccccc2c1)c1ccc2c(c1)CCC2 ZINC000007053620 1042885731 /nfs/dbraw/zinc/88/57/31/1042885731.db2.gz GLYSTAPMLPPPGY-UHFFFAOYSA-N -1 1 323.417 4.129 20 0 DIADMM Cc1ccc(C(F)(F)F)cc1NC(=O)c1cc(F)ccc1[O-] ZINC000388520401 1042893803 /nfs/dbraw/zinc/89/38/03/1042893803.db2.gz QGLMDZYEWBJWJE-UHFFFAOYSA-N -1 1 313.250 4.111 20 0 DIADMM Cc1c(Cl)cc(F)c([N-]C(=O)c2cc(C3CC3)no2)c1F ZINC000441057251 1043017836 /nfs/dbraw/zinc/01/78/36/1043017836.db2.gz CYDXOTUPWBCJSP-UHFFFAOYSA-N -1 1 312.703 4.044 20 0 DIADMM Cc1nc(SC[C@@]2(C)CC2(Cl)Cl)[n-]c(=O)c1C1CC1 ZINC000865373156 1043089107 /nfs/dbraw/zinc/08/91/07/1043089107.db2.gz IAJGOPSLWMPKPR-GFCCVEGCSA-N -1 1 319.257 4.044 20 0 DIADMM COc1cc(C(=O)Nc2ccsc2Cl)cc(Cl)c1[O-] ZINC000442801463 1043426366 /nfs/dbraw/zinc/42/63/66/1043426366.db2.gz MTVYXQPTQIEMNX-UHFFFAOYSA-N -1 1 318.181 4.021 20 0 DIADMM Cc1ccc2c(c1)[C@H]([NH2+]Cc1c(F)ccc(O)c1F)CCC2 ZINC000353529645 1043613238 /nfs/dbraw/zinc/61/32/38/1043613238.db2.gz JZYRZKIZPVYBIY-MRXNPFEDSA-N -1 1 303.352 4.146 20 0 DIADMM C/C(=C/C(=O)Nc1cc([O-])c(F)cc1F)c1cccc(Cl)c1 ZINC001141833866 1043735011 /nfs/dbraw/zinc/73/50/11/1043735011.db2.gz OHPSJXYEFZKWHR-UITAMQMPSA-N -1 1 323.726 4.366 20 0 DIADMM CCON(CC1CCCCC1)C(=O)c1cc(Cl)ccc1[O-] ZINC001299178293 1043906668 /nfs/dbraw/zinc/90/66/68/1043906668.db2.gz YTBVGDHOKSQSGV-UHFFFAOYSA-N -1 1 311.809 4.020 20 0 DIADMM Cc1cc(-c2nc(=O)c3cc(-c4ccccc4)sc3[n-]2)no1 ZINC000358853131 1044106333 /nfs/dbraw/zinc/10/63/33/1044106333.db2.gz YJXOYCGMVVTOCI-UHFFFAOYSA-N -1 1 309.350 4.027 20 0 DIADMM Cc1ccc([C@H]([N-]c2nnc(C(C)(C)C)o2)c2ccccn2)cc1 ZINC000882286308 1044162318 /nfs/dbraw/zinc/16/23/18/1044162318.db2.gz FQCQCXWMKAJRPN-INIZCTEOSA-N -1 1 322.412 4.272 20 0 DIADMM [O-]c1cccc(CNc2ccc([C@H]3CCOC3)cc2)c1Cl ZINC000292984086 1044236039 /nfs/dbraw/zinc/23/60/39/1044236039.db2.gz LMZMUNNUDILWLX-AWEZNQCLSA-N -1 1 303.789 4.162 20 0 DIADMM COCCCOc1ccccc1NCc1cccc([O-])c1Cl ZINC000293163327 1044253747 /nfs/dbraw/zinc/25/37/47/1044253747.db2.gz FSDORGPWDMMBLJ-UHFFFAOYSA-N -1 1 321.804 4.073 20 0 DIADMM [O-]c1c(-c2nc(CC3CC(F)(F)C3)no2)ccc2ccccc21 ZINC000563598707 1044286334 /nfs/dbraw/zinc/28/63/34/1044286334.db2.gz HSBMAHFMTCBQRG-UHFFFAOYSA-N -1 1 316.307 4.183 20 0 DIADMM CCc1nc(S[C@@H](C)c2cc(F)ccc2F)[n-]c(=O)c1C ZINC000564585975 1044392015 /nfs/dbraw/zinc/39/20/15/1044392015.db2.gz NTMNIQUYNMDELY-VIFPVBQESA-N -1 1 310.369 4.185 20 0 DIADMM O=C([N-]c1cc(F)cc(F)c1F)c1cc(-c2ccccc2)on1 ZINC000565441001 1044434824 /nfs/dbraw/zinc/43/48/24/1044434824.db2.gz SVLUQRXKOZWWOM-UHFFFAOYSA-N -1 1 318.254 4.011 20 0 DIADMM CC(C)c1ccc(CN(C)C(=O)c2c(F)ccc([O-])c2F)cc1 ZINC000566646664 1044504290 /nfs/dbraw/zinc/50/42/90/1044504290.db2.gz YWTAZVUXBZCYJV-UHFFFAOYSA-N -1 1 319.351 4.066 20 0 DIADMM CC(C)CC(CC(C)C)C(=O)NCc1ccc([O-])c(Cl)c1 ZINC001154105475 1044535689 /nfs/dbraw/zinc/53/56/89/1044535689.db2.gz CXXXECBXQXYQBA-UHFFFAOYSA-N -1 1 311.853 4.370 20 0 DIADMM C[C@H](NC(=O)c1c(F)ccc([O-])c1F)c1cccc(C2CC2)c1 ZINC000295592255 1044544155 /nfs/dbraw/zinc/54/41/55/1044544155.db2.gz OIRAYDRENPGRKA-JTQLQIEISA-N -1 1 317.335 4.039 20 0 DIADMM CC(C)(C)OCc1cccc(NC(=O)c2ccc([O-])c(F)c2)c1 ZINC000885619704 1044579474 /nfs/dbraw/zinc/57/94/74/1044579474.db2.gz ZZQQHLIHWHXECD-UHFFFAOYSA-N -1 1 317.360 4.099 20 0 DIADMM CC(C)c1ncc(-c2nc(-c3ccc([O-])cc3Cl)no2)s1 ZINC000445450333 1044718361 /nfs/dbraw/zinc/71/83/61/1044718361.db2.gz XZBKGMPCAHNENU-UHFFFAOYSA-N -1 1 321.789 4.343 20 0 DIADMM [O-]c1ccc(-c2noc(/C=C/c3ccsc3)n2)c(Cl)c1 ZINC000445448797 1044719484 /nfs/dbraw/zinc/71/94/84/1044719484.db2.gz MKLHSFOKJLOKSF-DAFODLJHSA-N -1 1 304.758 4.328 20 0 DIADMM CC(C)(c1nc(-c2ccc([O-])c(F)c2)no1)c1ccccc1F ZINC000445479735 1044730718 /nfs/dbraw/zinc/73/07/18/1044730718.db2.gz WZWLQVYVRRLDOM-UHFFFAOYSA-N -1 1 316.307 4.046 20 0 DIADMM [O-]c1ccc(-c2noc(CCc3ccc(Cl)s3)n2)cc1F ZINC000445476586 1044735080 /nfs/dbraw/zinc/73/50/80/1044735080.db2.gz FFWFQUINMVQCAT-UHFFFAOYSA-N -1 1 324.764 4.081 20 0 DIADMM Cc1ccc(NC(=O)Nc2cc([O-])c(Cl)cc2F)c(C)c1 ZINC001202746769 1044780074 /nfs/dbraw/zinc/78/00/74/1044780074.db2.gz GIPNXLYYVQVWRM-UHFFFAOYSA-N -1 1 308.740 4.446 20 0 DIADMM Cc1cc(C(=O)[N-]c2cccc(Cl)c2SC(F)F)no1 ZINC000157464873 1044912697 /nfs/dbraw/zinc/91/26/97/1044912697.db2.gz CJFRNMKDLKLQDV-UHFFFAOYSA-N -1 1 318.732 4.203 20 0 DIADMM [O-]c1ccc(-c2noc(-c3cnc(C4CC4)s3)n2)c(Cl)c1 ZINC000574026576 1044937147 /nfs/dbraw/zinc/93/71/47/1044937147.db2.gz ZNMNFHCREVFSSU-UHFFFAOYSA-N -1 1 319.773 4.097 20 0 DIADMM C[C@H](NC(=O)c1c(F)ccc([O-])c1F)[C@@H](C)C1CCCCC1 ZINC000577562291 1045137729 /nfs/dbraw/zinc/13/77/29/1045137729.db2.gz YBPMBCROKBJTNQ-MNOVXSKESA-N -1 1 311.372 4.005 20 0 DIADMM Cc1cccc(C2(C(=O)Nc3ccc([O-])c(F)c3F)CCC2)c1 ZINC000654308935 1045539794 /nfs/dbraw/zinc/53/97/94/1045539794.db2.gz VJPYHLLCYDJXCT-UHFFFAOYSA-N -1 1 317.335 4.039 20 0 DIADMM O=C(c1c([O-])cccc1Cl)N1CCC[C@H]1C1CCCCC1 ZINC001626154404 1045564079 /nfs/dbraw/zinc/56/40/79/1045564079.db2.gz LJHOPNQYFZBONQ-AWEZNQCLSA-N -1 1 307.821 4.231 20 0 DIADMM O=C([N-]c1cccc(Cl)c1SC(F)F)c1cncs1 ZINC000751230017 1045593097 /nfs/dbraw/zinc/59/30/97/1045593097.db2.gz ULUNHZFANVEBJM-UHFFFAOYSA-N -1 1 320.773 4.364 20 0 DIADMM Cc1sc([C@@H](C)NCc2ccc(C(C)C)cc2)nc1C(=O)[O-] ZINC000900075311 1045598450 /nfs/dbraw/zinc/59/84/50/1045598450.db2.gz QBQKJYWQDWWCIG-LLVKDONJSA-N -1 1 318.442 4.124 20 0 DIADMM C[C@@H]1C[C@@H](C(=O)[O-])C[C@H](C)N1Cc1c(Cl)cccc1Cl ZINC000530179623 1045617104 /nfs/dbraw/zinc/61/71/04/1045617104.db2.gz NJPDMTQFFNOIKN-JGPRNRPPSA-N -1 1 316.228 4.067 20 0 DIADMM [O-]c1ccc(Cl)c(F)c1CNc1cccc(OCCF)c1 ZINC000191442367 1045707183 /nfs/dbraw/zinc/70/71/83/1045707183.db2.gz DNRFGLFNWFDWHS-UHFFFAOYSA-N -1 1 313.731 4.145 20 0 DIADMM C[C@H](C(=O)[N-]OCc1ccccc1)c1ccc2ccccc2c1 ZINC000753280088 1045744944 /nfs/dbraw/zinc/74/49/44/1045744944.db2.gz SJOKMCDUTHGETI-HNNXBMFYSA-N -1 1 305.377 4.191 20 0 DIADMM C[C@@H]1CC[C@@H](c2nc(=O)c3c(-c4ccccc4)csc3[n-]2)O1 ZINC000630384767 1045755905 /nfs/dbraw/zinc/75/59/05/1045755905.db2.gz HLGPHBHTOXNKPG-MFKMUULPSA-N -1 1 312.394 4.304 20 0 DIADMM C[C@@H]1CC[C@@H](c2nc(=O)c3cc(-c4ccccc4)sc3[n-]2)O1 ZINC000630384936 1045756333 /nfs/dbraw/zinc/75/63/33/1045756333.db2.gz JPHUGGMAKWTINZ-MFKMUULPSA-N -1 1 312.394 4.304 20 0 DIADMM C[C@H]1CC[C@H](c2nc(=O)c3c(-c4ccccc4)csc3[n-]2)O1 ZINC000630384766 1045756503 /nfs/dbraw/zinc/75/65/03/1045756503.db2.gz HLGPHBHTOXNKPG-GXFFZTMASA-N -1 1 312.394 4.304 20 0 DIADMM O=C(Cc1ccc([O-])c(Cl)c1)N1CCC[C@H]1c1cccs1 ZINC000630497272 1045766477 /nfs/dbraw/zinc/76/64/77/1045766477.db2.gz JHQPZCABKVXGAE-ZDUSSCGKSA-N -1 1 321.829 4.013 20 0 DIADMM C[C@@H](CSc1nc(-c2ccccc2)cc(=O)[n-]1)C(F)(F)F ZINC000901619165 1045778499 /nfs/dbraw/zinc/77/84/99/1045778499.db2.gz LQJOSWQUZKXOON-VIFPVBQESA-N -1 1 314.332 4.140 20 0 DIADMM CC(C)(C)SCSc1nc(-c2ccccc2)cc(=O)[n-]1 ZINC000901615776 1045779592 /nfs/dbraw/zinc/77/95/92/1045779592.db2.gz HYJUKPWLWGRUKV-UHFFFAOYSA-N -1 1 306.456 4.431 20 0 DIADMM CC[C@@H](C)C[C@H](NCc1ccc(-c2ccc(C)cc2)o1)C(=O)[O-] ZINC000901670722 1045790755 /nfs/dbraw/zinc/79/07/55/1045790755.db2.gz CFRIJLGFVCNKFO-DYVFJYSZSA-N -1 1 315.413 4.234 20 0 DIADMM CC[C@@H](C)C[C@H](NCc1ccc(-c2ccc(F)cc2)o1)C(=O)[O-] ZINC000901674421 1045792359 /nfs/dbraw/zinc/79/23/59/1045792359.db2.gz ALFVKVIMNFATJI-WBMJQRKESA-N -1 1 319.376 4.065 20 0 DIADMM Cc1nc(SCc2ccsc2Cl)[n-]c(=O)c1C1CC1 ZINC000631022868 1045796614 /nfs/dbraw/zinc/79/66/14/1045796614.db2.gz BQYFYKLMEUGHCY-UHFFFAOYSA-N -1 1 312.847 4.375 20 0 DIADMM CSc1cccc(CSc2nc(C)c(C3CC3)c(=O)[n-]2)c1 ZINC000631023229 1045797142 /nfs/dbraw/zinc/79/71/42/1045797142.db2.gz MSXXQEITHREHKB-UHFFFAOYSA-N -1 1 318.467 4.382 20 0 DIADMM CCCCC[C@@H](NCc1ccc(-c2ccccc2)o1)C(=O)[O-] ZINC000901722788 1045797164 /nfs/dbraw/zinc/79/71/64/1045797164.db2.gz DKEQLHJKMBASHS-MRXNPFEDSA-N -1 1 301.386 4.070 20 0 DIADMM CCOc1ccccc1CSc1nc(C)c(C2CC2)c(=O)[n-]1 ZINC000631024412 1045798073 /nfs/dbraw/zinc/79/80/73/1045798073.db2.gz SGUDDBVCRYZMBO-UHFFFAOYSA-N -1 1 316.426 4.059 20 0 DIADMM Cc1nc(SCc2cc3ccccc3o2)[n-]c(=O)c1C1CC1 ZINC000631024246 1045798218 /nfs/dbraw/zinc/79/82/18/1045798218.db2.gz PYHNMBCFLQFMAZ-UHFFFAOYSA-N -1 1 312.394 4.407 20 0 DIADMM CSc1ccc(CSc2nc(C)c(C3CC3)c(=O)[n-]2)cc1 ZINC000631026059 1045798737 /nfs/dbraw/zinc/79/87/37/1045798737.db2.gz ZNKXZOOMYKCPOP-UHFFFAOYSA-N -1 1 318.467 4.382 20 0 DIADMM CC(C)(C)C[C@H](NCc1ccc(-c2ccc(F)cc2)o1)C(=O)[O-] ZINC000901808743 1045828372 /nfs/dbraw/zinc/82/83/72/1045828372.db2.gz LEGLEAQRNYKOKP-HNNXBMFYSA-N -1 1 319.376 4.065 20 0 DIADMM CC[C@@H](C)N(CC(=O)[O-])Cc1ccc(-c2ccc(Cl)cc2)o1 ZINC000901989532 1045883402 /nfs/dbraw/zinc/88/34/02/1045883402.db2.gz RTUGMZXMINUIHA-GFCCVEGCSA-N -1 1 321.804 4.285 20 0 DIADMM CCc1oc(CN[C@H](CC(C)C)c2ccccc2)cc1C(=O)[O-] ZINC000902072768 1045904469 /nfs/dbraw/zinc/90/44/69/1045904469.db2.gz UVCDVAIMPQQYRI-QGZVFWFLSA-N -1 1 315.413 4.417 20 0 DIADMM CC[C@H](NCc1cc(C(=O)[O-])c(C)o1)c1ccc(Cl)cc1 ZINC000902087787 1045909374 /nfs/dbraw/zinc/90/93/74/1045909374.db2.gz DFYACVDYWDOVJQ-HNNXBMFYSA-N -1 1 307.777 4.181 20 0 DIADMM Cc1ccccc1C[C@@H](C)C(=O)Nc1ccc([O-])c(Cl)c1 ZINC001137674226 1045929850 /nfs/dbraw/zinc/92/98/50/1045929850.db2.gz LQSMNEBYYCTOGH-GFCCVEGCSA-N -1 1 303.789 4.171 20 0 DIADMM CCc1oc(CNC(C)(C)c2cccc(Cl)c2)cc1C(=O)[O-] ZINC000902287070 1045963917 /nfs/dbraw/zinc/96/39/17/1045963917.db2.gz RZCLEELNKLVNPK-UHFFFAOYSA-N -1 1 321.804 4.219 20 0 DIADMM Cc1cc(Br)c([O-])c(NC(=O)/C=C2\CC[C@@H](C)C2)c1 ZINC001137838847 1045979619 /nfs/dbraw/zinc/97/96/19/1045979619.db2.gz XHCIATQQNHVHTF-FJUNDMEASA-N -1 1 324.218 4.148 20 0 DIADMM Cc1cc(Br)c([O-])c(NC(=O)C2=CC[C@@H](C)CC2)c1 ZINC001137838161 1045980494 /nfs/dbraw/zinc/98/04/94/1045980494.db2.gz IPTBQZWGDWOPMA-SECBINFHSA-N -1 1 324.218 4.148 20 0 DIADMM CCc1oc(CN[C@H](c2ccccc2F)C(C)C)cc1C(=O)[O-] ZINC000902382700 1045987883 /nfs/dbraw/zinc/98/78/83/1045987883.db2.gz SZHDCNWWKBWLHR-KRWDZBQOSA-N -1 1 319.376 4.166 20 0 DIADMM CC(C)(C)[C@H](NCc1ccoc1C(=O)[O-])c1ccc(F)cc1F ZINC000902382279 1045988330 /nfs/dbraw/zinc/98/83/30/1045988330.db2.gz SQXHSXFUAGSRDM-OAHLLOKOSA-N -1 1 323.339 4.133 20 0 DIADMM CC(C)(C)C(F)(F)CN[C@@H]1CCC[C@@H](CCCC(=O)[O-])C1 ZINC000902470948 1046003541 /nfs/dbraw/zinc/00/35/41/1046003541.db2.gz VQZINYJEUVOUEN-QWHCGFSZSA-N -1 1 305.409 4.071 20 0 DIADMM CCc1oc(CNCc2ccc(C3CCC3)cc2)cc1C(=O)[O-] ZINC000902446627 1045998309 /nfs/dbraw/zinc/99/83/09/1045998309.db2.gz ZIDCBLVFWWKEHO-UHFFFAOYSA-N -1 1 313.397 4.098 20 0 DIADMM Cc1cccc2oc(C(=O)Nc3ccc(Cl)cc3[O-])cc21 ZINC001138014981 1046056333 /nfs/dbraw/zinc/05/63/33/1046056333.db2.gz LOJKVZZPCAZQOO-UHFFFAOYSA-N -1 1 301.729 4.353 20 0 DIADMM CC(C)[C@@H]1CCc2[n-]n(Cc3cnc4ccccc4c3)c(=O)c2C1 ZINC000634618158 1046080876 /nfs/dbraw/zinc/08/08/76/1046080876.db2.gz IOSLFVYZUBXSQQ-WBVHZDCISA-N -1 1 321.424 4.005 20 0 DIADMM Cc1ncoc1C(=O)[N-]c1cccc(Cl)c1SC(F)F ZINC000081649738 1046103415 /nfs/dbraw/zinc/10/34/15/1046103415.db2.gz CLZILXZTUJPWLM-UHFFFAOYSA-N -1 1 318.732 4.203 20 0 DIADMM O=C([O-])CC[C@H]1CCC[N@@H+](Cc2cccc(Cl)c2Cl)C1 ZINC000086809478 1046165529 /nfs/dbraw/zinc/16/55/29/1046165529.db2.gz UDCTYTMFSIZFKR-LLVKDONJSA-N -1 1 316.228 4.070 20 0 DIADMM O=C([O-])CC[C@H]1CCCN(Cc2cccc(Cl)c2Cl)C1 ZINC000086809478 1046165541 /nfs/dbraw/zinc/16/55/41/1046165541.db2.gz UDCTYTMFSIZFKR-LLVKDONJSA-N -1 1 316.228 4.070 20 0 DIADMM C/C(=C\c1ccccc1)CN(C)C(=O)c1c([O-])cccc1Cl ZINC000757645387 1046197631 /nfs/dbraw/zinc/19/76/31/1046197631.db2.gz LPDWBJLKTBVKNE-ACCUITESSA-N -1 1 315.800 4.221 20 0 DIADMM Cc1ccc(S(=O)(=O)[N-]c2ccc(C)c(C)c2)c(Cl)c1 ZINC000025365186 1046268434 /nfs/dbraw/zinc/26/84/34/1046268434.db2.gz VMGOZYIEOAYUKW-UHFFFAOYSA-N -1 1 309.818 4.066 20 0 DIADMM CC(C)Oc1ccccc1[C@H](C)NCc1ccc(C(=O)[O-])s1 ZINC000903677134 1046299538 /nfs/dbraw/zinc/29/95/38/1046299538.db2.gz KPHPSENGJZMLMP-LBPRGKRZSA-N -1 1 319.426 4.084 20 0 DIADMM CCc1noc(C)c1[N-]C(=O)c1ccc(SC(F)(F)F)o1 ZINC000866968592 1046306288 /nfs/dbraw/zinc/30/62/88/1046306288.db2.gz QANMQHCPUCLFGM-UHFFFAOYSA-N -1 1 320.292 4.003 20 0 DIADMM CCC[C@@H]1CCCN(Cc2occ(C(F)(F)F)c2C(=O)[O-])C1 ZINC000903894083 1046337838 /nfs/dbraw/zinc/33/78/38/1046337838.db2.gz NYEIUDYSPBVOTI-SNVBAGLBSA-N -1 1 319.323 4.009 20 0 DIADMM CC[C@@H]1CC[C@@H](C)N(Cc2occ(C(F)(F)F)c2C(=O)[O-])C1 ZINC000903906675 1046341185 /nfs/dbraw/zinc/34/11/85/1046341185.db2.gz MWTKZKSYXDAVHS-NXEZZACHSA-N -1 1 319.323 4.007 20 0 DIADMM C[C@H](c1cc(Cl)ccc1Cl)[N@H+]1CCC[C@@H](CC(=O)[O-])C1 ZINC000226420771 1046396230 /nfs/dbraw/zinc/39/62/30/1046396230.db2.gz SYJBBXCMZPOPLK-MNOVXSKESA-N -1 1 316.228 4.241 20 0 DIADMM C[C@H](c1cc(Cl)ccc1Cl)N1CCC[C@@H](CC(=O)[O-])C1 ZINC000226420771 1046396244 /nfs/dbraw/zinc/39/62/44/1046396244.db2.gz SYJBBXCMZPOPLK-MNOVXSKESA-N -1 1 316.228 4.241 20 0 DIADMM CC/C(C)=C(\C)C(=O)Nc1cc(C)cc(Br)c1[O-] ZINC000781022052 1046416393 /nfs/dbraw/zinc/41/63/93/1046416393.db2.gz VPGZFEWFVDKAMV-MDZDMXLPSA-N -1 1 312.207 4.148 20 0 DIADMM CCSc1ccccc1C(=O)Nc1ccc([O-])c(Cl)c1 ZINC000780991514 1046416247 /nfs/dbraw/zinc/41/62/47/1046416247.db2.gz AEMRKKJITHPISI-UHFFFAOYSA-N -1 1 307.802 4.410 20 0 DIADMM O=C(Nc1ccc2cc[nH]c2c1)c1ccc(C(F)(F)F)cc1[O-] ZINC001139298030 1046427843 /nfs/dbraw/zinc/42/78/43/1046427843.db2.gz BJLNJFOXKCJHLL-UHFFFAOYSA-N -1 1 320.270 4.145 20 0 DIADMM CCc1ccc(NC(=O)Nc2cc([O-])c(Cl)cc2F)cc1 ZINC001202940230 1046456191 /nfs/dbraw/zinc/45/61/91/1046456191.db2.gz BWFQLVXYWFCULU-UHFFFAOYSA-N -1 1 308.740 4.391 20 0 DIADMM COCOc1cccc(Nc2cc(Cl)c([O-])cc2Cl)c1 ZINC001212900867 1046500961 /nfs/dbraw/zinc/50/09/61/1046500961.db2.gz AUSARWQNFLPRRU-UHFFFAOYSA-N -1 1 314.168 4.425 20 0 DIADMM Cc1c(Cl)cc(Nc2ccc(CCO)cc2)c([O-])c1Cl ZINC001212931765 1046547506 /nfs/dbraw/zinc/54/75/06/1046547506.db2.gz VWSCTMFBGQQSNC-UHFFFAOYSA-N -1 1 312.196 4.286 20 0 DIADMM CCOC(=O)[C@@H](CC(C)C)Oc1cc([O-])c(Cl)cc1Cl ZINC001229409088 1046586286 /nfs/dbraw/zinc/58/62/86/1046586286.db2.gz BIUAROVFZVAGEX-CYBMUJFWSA-N -1 1 321.200 4.056 20 0 DIADMM CC(C)c1ccc(C(=O)N(C)c2ccc(F)c(F)c2)c([O-])c1 ZINC000678308865 1046617124 /nfs/dbraw/zinc/61/71/24/1046617124.db2.gz IAPGXXPMLOZQKT-UHFFFAOYSA-N -1 1 305.324 4.070 20 0 DIADMM [O-]c1ccc(-c2noc(-c3cccc(C(F)(F)F)c3)n2)cc1F ZINC000445476432 1046697765 /nfs/dbraw/zinc/69/77/65/1046697765.db2.gz CLRGNUVDDZBFAV-UHFFFAOYSA-N -1 1 324.233 4.267 20 0 DIADMM O=C(Nc1ccc([O-])c(Cl)c1)[C@H]1CCc2c1cccc2Cl ZINC000678862242 1046721809 /nfs/dbraw/zinc/72/18/09/1046721809.db2.gz BBCFADJKUPHHEK-LBPRGKRZSA-N -1 1 322.191 4.368 20 0 DIADMM CCCC[C@H](C)N(C)C(=O)c1ccc(C(F)(F)F)c([O-])c1 ZINC000644646248 1046730191 /nfs/dbraw/zinc/73/01/91/1046730191.db2.gz UHWJTCLXWFXVHM-JTQLQIEISA-N -1 1 303.324 4.062 20 0 DIADMM O=C([O-])c1ccccc1CN1CCC[C@@H]1c1ccc(Cl)s1 ZINC001140503762 1046755618 /nfs/dbraw/zinc/75/56/18/1046755618.db2.gz KZAPHGVSBVCJBO-CYBMUJFWSA-N -1 1 321.829 4.437 20 0 DIADMM [O-]c1cccc(CN[C@H](c2ccccc2)c2ccncc2)c1Cl ZINC000645150597 1046771458 /nfs/dbraw/zinc/77/14/58/1046771458.db2.gz HPPAILIWMJVPSL-LJQANCHMSA-N -1 1 324.811 4.320 20 0 DIADMM CCOc1ccc(OC)cc1NCc1cccc([O-])c1Cl ZINC000645166732 1046772730 /nfs/dbraw/zinc/77/27/30/1046772730.db2.gz DCZIAWKKAFQOAU-UHFFFAOYSA-N -1 1 307.777 4.065 20 0 DIADMM CO[C@@H]1CCOc2c(NCc3cccc([O-])c3Cl)cccc21 ZINC000645178052 1046776640 /nfs/dbraw/zinc/77/66/40/1046776640.db2.gz NICWOGXSGAODTO-OAHLLOKOSA-N -1 1 319.788 4.128 20 0 DIADMM O=C([N-]c1cnoc1)c1csc(-c2cccc3ccccc32)n1 ZINC000679187411 1046790492 /nfs/dbraw/zinc/79/04/92/1046790492.db2.gz KNMQEDUHCMNVSY-UHFFFAOYSA-N -1 1 321.361 4.204 20 0 DIADMM [O-]c1c(Cl)cc(CN2CC[C@@H](c3ccccn3)C2)cc1Cl ZINC001140834530 1046922608 /nfs/dbraw/zinc/92/26/08/1046922608.db2.gz OQKUTUDGZMRNHV-GFCCVEGCSA-N -1 1 323.223 4.084 20 0 DIADMM CC(=O)Oc1ccc(Nc2ccc(Cl)c(Cl)c2[O-])cc1 ZINC001212082160 1046932000 /nfs/dbraw/zinc/93/20/00/1046932000.db2.gz OGNQMMQQIBEQES-UHFFFAOYSA-N -1 1 312.152 4.368 20 0 DIADMM CC[C@@H]1c2ccccc2CCN1Cc1ccc([O-])c(F)c1F ZINC001140892881 1046943837 /nfs/dbraw/zinc/94/38/37/1046943837.db2.gz CVDOTKRHBCHFPR-OAHLLOKOSA-N -1 1 303.352 4.180 20 0 DIADMM Cc1ccccc1[C@H]1CCC[N@H+]1Cc1ccc(O)c(F)c1F ZINC001140887948 1046944289 /nfs/dbraw/zinc/94/42/89/1046944289.db2.gz JVQJKNXIQFZHNE-OAHLLOKOSA-N -1 1 303.352 4.316 20 0 DIADMM [O-]c1c(F)cc(CN2CCC[C@@H]2c2ccccc2F)cc1F ZINC001140990904 1046970191 /nfs/dbraw/zinc/97/01/91/1046970191.db2.gz CHBGAEXEWLDTAS-MRXNPFEDSA-N -1 1 307.315 4.147 20 0 DIADMM CCCC[C@@H](NCc1ccc(-c2cccc(F)c2C)o1)C(=O)[O-] ZINC000262698916 1046973667 /nfs/dbraw/zinc/97/36/67/1046973667.db2.gz JDMLCQUACGNVAQ-MRXNPFEDSA-N -1 1 319.376 4.127 20 0 DIADMM O=C(N[C@H](c1ccc(Cl)cc1)C1CC1)c1ccc([O-])c(F)c1 ZINC000681016435 1047082833 /nfs/dbraw/zinc/08/28/33/1047082833.db2.gz WSZDQCPYQTWZKO-INIZCTEOSA-N -1 1 319.763 4.066 20 0 DIADMM CC(C)CCOc1cccc(NC(=O)c2ccc([O-])c(F)c2)c1 ZINC000681022595 1047084008 /nfs/dbraw/zinc/08/40/08/1047084008.db2.gz ODWNLNVKKYLRMK-UHFFFAOYSA-N -1 1 317.360 4.209 20 0 DIADMM CN(Cc1csc2ccccc12)C(=O)c1ccc([O-])c(F)c1 ZINC000681018950 1047084914 /nfs/dbraw/zinc/08/49/14/1047084914.db2.gz AOJDRMTUAHWAEU-UHFFFAOYSA-N -1 1 315.369 4.018 20 0 DIADMM O=C(c1ccc([O-])c(F)c1)N1CCC[C@H]1c1ccccc1Cl ZINC000681018439 1047085318 /nfs/dbraw/zinc/08/53/18/1047085318.db2.gz BWLIAEDADGNUNB-HNNXBMFYSA-N -1 1 319.763 4.162 20 0 DIADMM Cc1c(NC(=O)c2ccc([O-])c(F)c2)sc2c1CCCC2 ZINC000681050347 1047086159 /nfs/dbraw/zinc/08/61/59/1047086159.db2.gz ZPWFGNCSJQYXDU-UHFFFAOYSA-N -1 1 305.374 4.032 20 0 DIADMM O=C(c1ccc([O-])c(F)c1)N1CCCC[C@@H]1c1ccc(F)cc1 ZINC000681053005 1047087840 /nfs/dbraw/zinc/08/78/40/1047087840.db2.gz GSDAVMUSBFTWJC-MRXNPFEDSA-N -1 1 317.335 4.038 20 0 DIADMM CC(C)CCOc1ccc(NC(=O)c2ccc([O-])c(F)c2)cc1 ZINC000681052136 1047088478 /nfs/dbraw/zinc/08/84/78/1047088478.db2.gz HFWJZMBZEAQSTL-UHFFFAOYSA-N -1 1 317.360 4.209 20 0 DIADMM C[C@@H]1CCN(C(=O)c2ccc(F)c([O-])c2)c2ccccc2S1 ZINC001141334741 1047095832 /nfs/dbraw/zinc/09/58/32/1047095832.db2.gz XOTIFIHWLGBWMR-LLVKDONJSA-N -1 1 317.385 4.062 20 0 DIADMM CCCCN(C(=O)c1ncc(C)cc1[O-])[C@@H](C)c1ccc(C)o1 ZINC000681718358 1047143278 /nfs/dbraw/zinc/14/32/78/1047143278.db2.gz GNRYAYFHVIJRAU-AWEZNQCLSA-N -1 1 316.401 4.001 20 0 DIADMM CCCCN(C(=O)c1ccc([O-])c(F)c1)[C@@H]1CCC[C@H](C)C1 ZINC001141522732 1047160093 /nfs/dbraw/zinc/16/00/93/1047160093.db2.gz QTJYTQVYOWATSF-DZGCQCFKSA-N -1 1 307.409 4.352 20 0 DIADMM C/C(=C/c1ccc(C)cc1)C(=O)Nc1cc([O-])c(F)cc1F ZINC001141834236 1047296459 /nfs/dbraw/zinc/29/64/59/1047296459.db2.gz XZPIMGHKEZJQIK-XFFZJAGNSA-N -1 1 303.308 4.021 20 0 DIADMM CC1(C)C[C@@H](c2noc(-c3ccc4ccccc4c3[O-])n2)CCO1 ZINC000651441954 1047314322 /nfs/dbraw/zinc/31/43/22/1047314322.db2.gz ABZGHMKDILGPHV-ZDUSSCGKSA-N -1 1 324.380 4.268 20 0 DIADMM O=C(Nc1ccc2c(c1)CCC2)Nc1ccc([O-])c(Cl)c1 ZINC000476353295 1047352301 /nfs/dbraw/zinc/35/23/01/1047352301.db2.gz KTBHDNGSIZRXOO-UHFFFAOYSA-N -1 1 302.761 4.178 20 0 DIADMM Oc1cc(Cl)c(C[N@@H+]2C[C@@H]3CC(F)(F)C[C@@H]3C2)c(Cl)c1 ZINC001142105589 1047381660 /nfs/dbraw/zinc/38/16/60/1047381660.db2.gz GPVQKKZUDJVUMV-DTORHVGOSA-N -1 1 322.182 4.176 20 0 DIADMM O=C(C[C@H]1CCCc2ccccc21)Nc1cc(F)cc(F)c1[O-] ZINC001142541625 1047466826 /nfs/dbraw/zinc/46/68/26/1047466826.db2.gz FFJIGSXBSFQUKP-GFCCVEGCSA-N -1 1 317.335 4.119 20 0 DIADMM O=C(c1ccc2ccccc2c1[O-])N1CC[C@@H](c2ccccc2)C1 ZINC000121539613 1047521631 /nfs/dbraw/zinc/52/16/31/1047521631.db2.gz YZRKNLPAIWFFNU-QGZVFWFLSA-N -1 1 317.388 4.175 20 0 DIADMM O=C(N[C@@H](C1CCC1)C1CCCCC1)c1ccc([O-])cc1F ZINC001143080171 1047528574 /nfs/dbraw/zinc/52/85/74/1047528574.db2.gz LQSIBSPFMIVZDS-QGZVFWFLSA-N -1 1 305.393 4.010 20 0 DIADMM CC(C)c1ccc2nc(-c3cnc4ccsc4c3)[n-]c(=O)c2c1 ZINC000121959037 1047532980 /nfs/dbraw/zinc/53/29/80/1047532980.db2.gz CAVJEZIOWQFOSB-UHFFFAOYSA-N -1 1 321.405 4.323 20 0 DIADMM CCCCc1ccc(N(C)C(=O)c2cc(F)ccc2[O-])cc1 ZINC001149251479 1047558156 /nfs/dbraw/zinc/55/81/56/1047558156.db2.gz VAGPCLCZPMMNFH-UHFFFAOYSA-N -1 1 301.361 4.151 20 0 DIADMM O=C(Nc1cccc(SC(F)(F)F)c1)c1ccccc1[O-] ZINC001150573835 1047579519 /nfs/dbraw/zinc/57/95/19/1047579519.db2.gz JKWJCNNJLUNHOA-UHFFFAOYSA-N -1 1 313.300 4.256 20 0 DIADMM CC(C)c1ccc(C(=O)N(C)c2cccc3cc[nH]c32)c([O-])c1 ZINC001151024079 1047590230 /nfs/dbraw/zinc/59/02/30/1047590230.db2.gz PDEKLZLUEKUEMD-UHFFFAOYSA-N -1 1 308.381 4.274 20 0 DIADMM Cc1cccc2c(C(=O)Nc3ccc([O-])c(Cl)c3)coc21 ZINC001151582791 1047598563 /nfs/dbraw/zinc/59/85/63/1047598563.db2.gz NJZGGLOCXKWDDI-UHFFFAOYSA-N -1 1 301.729 4.353 20 0 DIADMM C[C@H](C(=O)Nc1ccc([O-])c(Cl)c1)c1ccc(Cl)cc1 ZINC001151582727 1047598937 /nfs/dbraw/zinc/59/89/37/1047598937.db2.gz MENYMXKZMXYZIA-VIFPVBQESA-N -1 1 310.180 4.441 20 0 DIADMM CSc1ccc(CCCC(=O)Nc2cccc(F)c2[O-])cc1 ZINC001151779642 1047601818 /nfs/dbraw/zinc/60/18/18/1047601818.db2.gz IUNPCILIADYKDR-UHFFFAOYSA-N -1 1 319.401 4.215 20 0 DIADMM Cc1cccc(C2(C(=O)Nc3cccc(F)c3[O-])CCCC2)c1 ZINC001151772658 1047601952 /nfs/dbraw/zinc/60/19/52/1047601952.db2.gz RGWFIWKDFRTACY-UHFFFAOYSA-N -1 1 313.372 4.290 20 0 DIADMM CCc1ccc([C@@H](C)NC(=O)Cc2ccc([O-])c(Cl)c2)cc1 ZINC001153218042 1047620851 /nfs/dbraw/zinc/62/08/51/1047620851.db2.gz NRSHGPJDMYIOKX-GFCCVEGCSA-N -1 1 317.816 4.028 20 0 DIADMM Cc1cnc(Cl)c(NC(=O)c2c([O-])ccc3ccccc32)c1 ZINC001153497673 1047626108 /nfs/dbraw/zinc/62/61/08/1047626108.db2.gz HJSODRZOJRSFPI-UHFFFAOYSA-N -1 1 312.756 4.155 20 0 DIADMM C[C@H]1CN(C(=O)c2c([O-])ccc3ccccc32)Cc2ccccc21 ZINC001153498978 1047626368 /nfs/dbraw/zinc/62/63/68/1047626368.db2.gz KIORYPXZFMNPHY-AWEZNQCLSA-N -1 1 317.388 4.305 20 0 DIADMM CN(C(=O)c1c([O-])ccc2ccccc21)[C@H]1CCc2ccccc21 ZINC001153505901 1047626935 /nfs/dbraw/zinc/62/69/35/1047626935.db2.gz OPQIOZOKEQLBHD-SFHVURJKSA-N -1 1 317.388 4.305 20 0 DIADMM CS[C@@H](CNC(=O)c1ccc2ccccc2c1[O-])C(C)(C)C ZINC001154125687 1047640375 /nfs/dbraw/zinc/64/03/75/1047640375.db2.gz GDPQYOLKVUOOLH-HNNXBMFYSA-N -1 1 317.454 4.053 20 0 DIADMM Cc1ccc(CCCC(=O)NCc2ccc([O-])c(Cl)c2)s1 ZINC001154105424 1047640541 /nfs/dbraw/zinc/64/05/41/1047640541.db2.gz AZJLUIYBBPVRHB-UHFFFAOYSA-N -1 1 323.845 4.055 20 0 DIADMM CC[C@@H](CC(C)C)C(=O)Nc1ccc(Br)c([O-])c1 ZINC001154321162 1047645594 /nfs/dbraw/zinc/64/55/94/1047645594.db2.gz CQDNUGGRQUVZGO-JTQLQIEISA-N -1 1 314.223 4.166 20 0 DIADMM CC(C)(C)[C@H]1CCC[C@H](NC(=O)c2c([O-])cccc2F)CC1 ZINC001154445052 1047648896 /nfs/dbraw/zinc/64/88/96/1047648896.db2.gz NGOYYBFXFJJUPC-STQMWFEESA-N -1 1 307.409 4.256 20 0 DIADMM CSc1ccc([O-])c(C(=O)Nc2cccc3c(C)nccc23)c1 ZINC001154605749 1047651316 /nfs/dbraw/zinc/65/13/16/1047651316.db2.gz MKNWMARZGMUEQS-UHFFFAOYSA-N -1 1 324.405 4.223 20 0 DIADMM CC(C)[C@@H]1CCC[C@H](NC(=O)c2c([O-])cccc2Cl)CC1 ZINC001154882746 1047660601 /nfs/dbraw/zinc/66/06/01/1047660601.db2.gz DEKVWRIUFPYPQY-OLZOCXBDSA-N -1 1 309.837 4.380 20 0 DIADMM CC(C)c1ccc2c(c1)[C@@H](NC(=O)c1c([O-])cccc1F)CC2 ZINC001155027198 1047665426 /nfs/dbraw/zinc/66/54/26/1047665426.db2.gz VIRBZTNFAYDRPF-INIZCTEOSA-N -1 1 313.372 4.072 20 0 DIADMM O=C(Cc1ccc([O-])c(Cl)c1)Nc1ccc(C2CCC2)cc1 ZINC001156101934 1047700663 /nfs/dbraw/zinc/70/06/63/1047700663.db2.gz JQMMOOFQAMCICP-UHFFFAOYSA-N -1 1 315.800 4.494 20 0 DIADMM CC(F)(F)c1ccc(C(=O)Nc2ccc([O-])c(F)c2F)cc1 ZINC001157811691 1047755340 /nfs/dbraw/zinc/75/53/40/1047755340.db2.gz ODNZIODXDBZQMR-UHFFFAOYSA-N -1 1 313.250 4.034 20 0 DIADMM CCSCc1ccc(NC(=O)c2ccc(F)c([O-])c2)cc1 ZINC001158325246 1047774074 /nfs/dbraw/zinc/77/40/74/1047774074.db2.gz PQVSDMOLRXDDGO-UHFFFAOYSA-N -1 1 305.374 4.037 20 0 DIADMM C[C@H]1C[C@H](CC(=O)Nc2nc(Cl)ccc2[O-])CC(C)(C)C1 ZINC001183210782 1047909068 /nfs/dbraw/zinc/90/90/68/1047909068.db2.gz YFMRETBQZMNMJG-WDEREUQCSA-N -1 1 310.825 4.232 20 0 DIADMM O=c1oc2cc([O-])ccc2cc1Nc1cccc(C(F)F)c1 ZINC001174622845 1047910021 /nfs/dbraw/zinc/91/00/21/1047910021.db2.gz XSZJBWJWBIDFJJ-UHFFFAOYSA-N -1 1 303.264 4.180 20 0 DIADMM CCCSc1cccc(NCc2ccc([O-])c(F)c2F)n1 ZINC001183255387 1047911705 /nfs/dbraw/zinc/91/17/05/1047911705.db2.gz AHMQFVFVGGSZDR-UHFFFAOYSA-N -1 1 310.369 4.180 20 0 DIADMM C=CS(=O)(=O)[N-]c1cc(Cl)ccc1Oc1ccccc1 ZINC001198567847 1047973523 /nfs/dbraw/zinc/97/35/23/1047973523.db2.gz WPIXHISQAZYVRB-UHFFFAOYSA-N -1 1 309.774 4.018 20 0 DIADMM CC(C)c1ccc(NC(=S)Nc2cc(Cl)ncc2[O-])cc1 ZINC001198593921 1047981518 /nfs/dbraw/zinc/98/15/18/1047981518.db2.gz DWGDCLLFKCPISX-UHFFFAOYSA-N -1 1 321.833 4.373 20 0 DIADMM CC(C)OC(=O)c1cccc(Nc2cc([O-])c(Cl)cc2F)c1 ZINC001174916028 1048027118 /nfs/dbraw/zinc/02/71/18/1048027118.db2.gz QBYXLUAEGQPMCN-UHFFFAOYSA-N -1 1 323.751 4.494 20 0 DIADMM CCCCOc1ccc(C(=O)Nc2ccc(C)c(C)c2)c([O-])c1 ZINC001160336029 1048036075 /nfs/dbraw/zinc/03/60/75/1048036075.db2.gz JFLDUDVJWNNTBA-UHFFFAOYSA-N -1 1 313.397 4.440 20 0 DIADMM Cc1cccc(Cl)c1NC(=O)Nc1cc([O-])c(F)cc1F ZINC001184533033 1048049249 /nfs/dbraw/zinc/04/92/49/1048049249.db2.gz BXVNMVPSGZFECC-UHFFFAOYSA-N -1 1 312.703 4.276 20 0 DIADMM Cc1c(Cl)cc(NC(=O)c2ccc([O-])c(F)c2)cc1Cl ZINC001160502370 1048059649 /nfs/dbraw/zinc/05/96/49/1048059649.db2.gz CZCFTDBGAFQRIC-UHFFFAOYSA-N -1 1 314.143 4.399 20 0 DIADMM CCOc1cc(F)c(Nc2cc(F)c([O-])c(F)c2)cc1F ZINC001175057016 1048082932 /nfs/dbraw/zinc/08/29/32/1048082932.db2.gz WYKRZFOCCZRLHG-UHFFFAOYSA-N -1 1 301.239 4.091 20 0 DIADMM Cc1c(Cl)cccc1NC(=O)Nc1cc(F)c(F)cc1[O-] ZINC001184682715 1048083487 /nfs/dbraw/zinc/08/34/87/1048083487.db2.gz FTQZXCOVNJOBKY-UHFFFAOYSA-N -1 1 312.703 4.276 20 0 DIADMM O=C(Nc1cc([O-])c(F)cc1F)c1ccc(SC2CC2)cc1 ZINC001160916028 1048096915 /nfs/dbraw/zinc/09/69/15/1048096915.db2.gz CRQJZRPQVNQRNY-UHFFFAOYSA-N -1 1 321.348 4.177 20 0 DIADMM O=C(Nc1ccc(F)cc1[O-])[C@H]1C[C@H]1c1cccc2ccccc21 ZINC001161035896 1048104653 /nfs/dbraw/zinc/10/46/53/1048104653.db2.gz VDPPVAUWVPMJFK-IRXDYDNUSA-N -1 1 321.351 4.427 20 0 DIADMM O=C(Cc1cc(Cl)cc(Cl)c1)Nc1ccc(F)cc1[O-] ZINC001161045269 1048105161 /nfs/dbraw/zinc/10/51/61/1048105161.db2.gz AGEFINRWDCXKKO-UHFFFAOYSA-N -1 1 314.143 4.019 20 0 DIADMM C[C@H](NC(=O)Cc1ccc([O-])c(Cl)c1)c1ccc(Cl)cc1 ZINC001161115547 1048111067 /nfs/dbraw/zinc/11/10/67/1048111067.db2.gz WATXLRXTRCOIHL-JTQLQIEISA-N -1 1 324.207 4.119 20 0 DIADMM [O-]c1cc(Cl)c(Nc2c(F)cc(O)cc2F)cc1Cl ZINC001175097696 1048142564 /nfs/dbraw/zinc/14/25/64/1048142564.db2.gz UQZTZUNJOGMGTJ-UHFFFAOYSA-N -1 1 306.095 4.426 20 0 DIADMM CCOc1ccc(Nc2cc(F)c([O-])c(F)c2)c(F)c1F ZINC001175151911 1048144179 /nfs/dbraw/zinc/14/41/79/1048144179.db2.gz FRGTZGTZCGTHLP-UHFFFAOYSA-N -1 1 301.239 4.091 20 0 DIADMM [O-]c1cccc(NC(=S)Nc2ccc(F)cc2F)c1Cl ZINC001200928107 1048159947 /nfs/dbraw/zinc/15/99/47/1048159947.db2.gz MUZPBSANIAOVQM-UHFFFAOYSA-N -1 1 314.744 4.133 20 0 DIADMM O=C(Nc1ccc(Cl)cc1[O-])Nc1ccc(F)c(F)c1F ZINC001185330576 1048167080 /nfs/dbraw/zinc/16/70/80/1048167080.db2.gz YNQBJQZGBTWHHM-UHFFFAOYSA-N -1 1 316.666 4.107 20 0 DIADMM CCc1ccccc1NC(=S)Nc1cc(F)cc(F)c1[O-] ZINC001201150973 1048203083 /nfs/dbraw/zinc/20/30/83/1048203083.db2.gz HEOJIXQHUKXWNG-UHFFFAOYSA-N -1 1 308.353 4.042 20 0 DIADMM CC(=O)c1ccc(Nc2cccc([O-])c2Br)cc1F ZINC001175234343 1048209509 /nfs/dbraw/zinc/20/95/09/1048209509.db2.gz UAABMEJKYDDCPB-UHFFFAOYSA-N -1 1 324.149 4.240 20 0 DIADMM CCOc1ccc(F)c(F)c1Nc1cc(F)c([O-])cc1F ZINC001175282282 1048229464 /nfs/dbraw/zinc/22/94/64/1048229464.db2.gz SXASKYLJTPQLIE-UHFFFAOYSA-N -1 1 301.239 4.091 20 0 DIADMM Cc1c(F)cccc1S(=O)(=O)[N-]c1ccc2sccc2c1 ZINC001185836446 1048233609 /nfs/dbraw/zinc/23/36/09/1048233609.db2.gz MQAZKPVUUQFUHA-UHFFFAOYSA-N -1 1 321.398 4.150 20 0 DIADMM O=C(c1ccc(Nc2c(F)ccc([O-])c2F)cc1)C(F)(F)F ZINC001175268351 1048247055 /nfs/dbraw/zinc/24/70/55/1048247055.db2.gz KTINPTJWYBUZEV-UHFFFAOYSA-N -1 1 317.213 4.159 20 0 DIADMM Cc1ccc2c(c1)scc2C(=O)Nc1cc(F)cc(F)c1[O-] ZINC001162290563 1048256972 /nfs/dbraw/zinc/25/69/72/1048256972.db2.gz ALYBEFDMHYYVKQ-UHFFFAOYSA-N -1 1 319.332 4.446 20 0 DIADMM C[S@](=O)c1ccccc1Nc1ccc(Cl)c(Cl)c1[O-] ZINC001175311457 1048258734 /nfs/dbraw/zinc/25/87/34/1048258734.db2.gz RIKDDLDJZLFTCG-IBGZPJMESA-N -1 1 316.209 4.180 20 0 DIADMM CC(C)Cc1ccc([C@@H](C)NC(=O)c2ccc([O-])cc2F)cc1 ZINC001186349109 1048284659 /nfs/dbraw/zinc/28/46/59/1048284659.db2.gz XHNUNGLZNQBFEF-CYBMUJFWSA-N -1 1 315.388 4.221 20 0 DIADMM Fc1c(F)c(F)c([N-]c2cc(-c3ccco3)no2)c(F)c1F ZINC001175383366 1048289695 /nfs/dbraw/zinc/28/96/95/1048289695.db2.gz WXRHHMPDBMQPEW-UHFFFAOYSA-N -1 1 316.185 4.374 20 0 DIADMM Cn1ncc2cc(Nc3ccc(Cl)c(Cl)c3[O-])ccc21 ZINC001175422939 1048303237 /nfs/dbraw/zinc/30/32/37/1048303237.db2.gz SVFVUBOAZQIAKE-UHFFFAOYSA-N -1 1 308.168 4.329 20 0 DIADMM C[S@](=O)c1ccc(Nc2cc(Cl)c([O-])cc2Cl)cc1 ZINC001175484953 1048322067 /nfs/dbraw/zinc/32/20/67/1048322067.db2.gz SAJRDBCUVRUVEE-IBGZPJMESA-N -1 1 316.209 4.180 20 0 DIADMM O=C(C[C@H]1CCc2ccccc2C1)Nc1ccc([O-])c(Cl)c1 ZINC000481201160 1048330433 /nfs/dbraw/zinc/33/04/33/1048330433.db2.gz SVXUQEWKKPBFDH-LBPRGKRZSA-N -1 1 315.800 4.179 20 0 DIADMM [O-]c1c(Cl)cc(Cl)cc1Nc1c(F)ccc(CO)c1F ZINC001250256312 1048335747 /nfs/dbraw/zinc/33/57/47/1048335747.db2.gz AZCQKIUWUVBDFV-UHFFFAOYSA-N -1 1 320.122 4.213 20 0 DIADMM CSc1ccccc1NC(=O)Nc1cc([O-])c(F)cc1F ZINC001186747977 1048338571 /nfs/dbraw/zinc/33/85/71/1048338571.db2.gz YYULCCYPBCXDRR-UHFFFAOYSA-N -1 1 310.325 4.036 20 0 DIADMM CC(C)c1nsc([N-]c2cnn([C@@H](C)c3ccccc3)c2)n1 ZINC001186791840 1048346314 /nfs/dbraw/zinc/34/63/14/1048346314.db2.gz PAGVKYZVEDWSIX-LBPRGKRZSA-N -1 1 313.430 4.211 20 0 DIADMM [O-]c1c(Br)c(F)ccc1Nc1ccc(C2CC2)nc1 ZINC001201719681 1048354467 /nfs/dbraw/zinc/35/44/67/1048354467.db2.gz WIMHJRXEYKZXDP-UHFFFAOYSA-N -1 1 323.165 4.310 20 0 DIADMM O=c1ccn(-c2ccc(NC=Cc3ccc(Cl)cc3)cc2)[n-]1 ZINC001175598615 1048366456 /nfs/dbraw/zinc/36/64/56/1048366456.db2.gz NDWUGWCFZJBQMC-PKNBQFBNSA-N -1 1 311.772 4.314 20 0 DIADMM Cc1ccc(-c2ccc(S(=O)(=O)[N-]c3ccccc3)cc2)cc1 ZINC000200763924 1048408847 /nfs/dbraw/zinc/40/88/47/1048408847.db2.gz DBZYBRYQZYRVFF-UHFFFAOYSA-N -1 1 323.417 4.463 20 0 DIADMM CCc1ccccc1NC(=O)Nc1cc([O-])c(Cl)cc1F ZINC001187636428 1048417604 /nfs/dbraw/zinc/41/76/04/1048417604.db2.gz PBWMMSPKFMQEGL-UHFFFAOYSA-N -1 1 308.740 4.391 20 0 DIADMM C[C@H]1CN(Cc2ccc(Cl)cc2C(=O)[O-])Cc2ccccc21 ZINC001142643185 1048418484 /nfs/dbraw/zinc/41/84/84/1048418484.db2.gz JVQULFGJKZZYPC-LBPRGKRZSA-N -1 1 315.800 4.158 20 0 DIADMM O=C(Nc1ccccc1C(F)(F)F)Nc1c([O-])cccc1F ZINC001202167952 1048470622 /nfs/dbraw/zinc/47/06/22/1048470622.db2.gz HMWLHMFGUYUZCM-UHFFFAOYSA-N -1 1 314.238 4.194 20 0 DIADMM CSc1ccc(NC(=O)Nc2c(F)cc([O-])cc2F)cc1 ZINC001188110525 1048477229 /nfs/dbraw/zinc/47/72/29/1048477229.db2.gz MGGRRNGYBJZUOX-UHFFFAOYSA-N -1 1 310.325 4.036 20 0 DIADMM Cc1ccc(Oc2ccccc2[N-]S(=O)(=O)C2CCC2)cc1 ZINC001188130387 1048478935 /nfs/dbraw/zinc/47/89/35/1048478935.db2.gz JVMPXLKRZJRTOO-UHFFFAOYSA-N -1 1 317.410 4.082 20 0 DIADMM Cc1cccc([N-]S(=O)(=O)C2CCC2)c1Oc1ccccc1 ZINC001188130944 1048479092 /nfs/dbraw/zinc/47/90/92/1048479092.db2.gz RVAKMXWMBKPIHK-UHFFFAOYSA-N -1 1 317.410 4.082 20 0 DIADMM [O-]c1c(Cl)cc(Br)cc1Nc1ccc(F)cn1 ZINC001175854314 1048479602 /nfs/dbraw/zinc/47/96/02/1048479602.db2.gz XQQKLSDVWHHDBB-UHFFFAOYSA-N -1 1 317.545 4.086 20 0 DIADMM CCCc1cc(=O)[n-]c(SCC[C@@H]2CCCC2(F)F)n1 ZINC001188163096 1048482701 /nfs/dbraw/zinc/48/27/01/1048482701.db2.gz NZSWBYJADBFFBE-JTQLQIEISA-N -1 1 302.390 4.052 20 0 DIADMM COc1ccc([N-]c2nnc(C(C)(C)C)o2)c(C(F)(F)F)c1 ZINC001213046783 1048499257 /nfs/dbraw/zinc/49/92/57/1048499257.db2.gz ZQIHUSXURLNRJD-UHFFFAOYSA-N -1 1 315.295 4.138 20 0 DIADMM O=C(Nc1cccc(Cl)c1F)Nc1ccc([O-])c(F)c1F ZINC001188403898 1048511586 /nfs/dbraw/zinc/51/15/86/1048511586.db2.gz LAKUCDFGQGRMIU-UHFFFAOYSA-N -1 1 316.666 4.107 20 0 DIADMM O=C(Nc1ccc(Cl)cc1[O-])Nc1cccc(Cl)c1F ZINC001188410096 1048514174 /nfs/dbraw/zinc/51/41/74/1048514174.db2.gz XOPSBOGEUZSZFZ-UHFFFAOYSA-N -1 1 315.131 4.482 20 0 DIADMM Cc1ccc(Cl)cc1NC(=O)Nc1cc(F)c(F)cc1[O-] ZINC001188733749 1048549922 /nfs/dbraw/zinc/54/99/22/1048549922.db2.gz DWLREFIGSJQRSC-UHFFFAOYSA-N -1 1 312.703 4.276 20 0 DIADMM Cc1ccc(Cl)cc1NC(=O)Nc1cc(F)cc(F)c1[O-] ZINC001188735895 1048550275 /nfs/dbraw/zinc/55/02/75/1048550275.db2.gz LEXCSODZDTWISY-UHFFFAOYSA-N -1 1 312.703 4.276 20 0 DIADMM Cc1ccc2ccc(F)c(Nc3ccnc(Cl)c3[O-])c2n1 ZINC001176115131 1048570799 /nfs/dbraw/zinc/57/07/99/1048570799.db2.gz HHYCISKDKHIHBF-UHFFFAOYSA-N -1 1 303.724 4.180 20 0 DIADMM Cc1ccc2ccc(F)c(Nc3cc(F)c([O-])cc3F)c2n1 ZINC001176116608 1048572157 /nfs/dbraw/zinc/57/21/57/1048572157.db2.gz IYVPXTTVLNENSK-UHFFFAOYSA-N -1 1 304.271 4.410 20 0 DIADMM [O-]c1cc(F)c(Nc2ccc(O)cc2C(F)(F)F)cc1F ZINC001176341531 1048632834 /nfs/dbraw/zinc/63/28/34/1048632834.db2.gz JPHXIWQNZKSPPH-UHFFFAOYSA-N -1 1 305.202 4.138 20 0 DIADMM CCc1cccc(C)c1NC(=O)Nc1cc(F)c(F)cc1[O-] ZINC001189981443 1048686069 /nfs/dbraw/zinc/68/60/69/1048686069.db2.gz BAQJZJPIYMNVBH-UHFFFAOYSA-N -1 1 306.312 4.185 20 0 DIADMM CCN(C)C(=O)c1cccc(Nc2cc([O-])c(Cl)cc2F)c1 ZINC001176465063 1048691435 /nfs/dbraw/zinc/69/14/35/1048691435.db2.gz DTLUFVZSPREFAL-UHFFFAOYSA-N -1 1 322.767 4.020 20 0 DIADMM Cc1cc(Nc2cc3ccc([O-])cc3oc2=O)c(F)cc1Cl ZINC001176522613 1048707624 /nfs/dbraw/zinc/70/76/24/1048707624.db2.gz DBUZCMHSDGJZGR-UHFFFAOYSA-N -1 1 319.719 4.343 20 0 DIADMM [O-]c1cc(F)c(Nc2cccc(OC(F)(F)F)c2)cc1F ZINC001176539955 1048712366 /nfs/dbraw/zinc/71/23/66/1048712366.db2.gz MACWCVZHESTXHT-UHFFFAOYSA-N -1 1 305.202 4.313 20 0 DIADMM Cc1c(N)c(F)ccc1Nc1ccc(Cl)c(Cl)c1[O-] ZINC001249641782 1048715151 /nfs/dbraw/zinc/71/51/51/1048715151.db2.gz HEGWIOLOFHYCKY-UHFFFAOYSA-N -1 1 301.148 4.472 20 0 DIADMM Cc1cccc(C)c1[C@@H]1CCCN1C(=O)c1cccc([O-])c1F ZINC001166233606 1048741932 /nfs/dbraw/zinc/74/19/32/1048741932.db2.gz ZNPQTXYUANXKKF-HNNXBMFYSA-N -1 1 313.372 4.125 20 0 DIADMM O=c1cc(C(F)F)nc(SCC[C@H]2CCc3ccccc32)[n-]1 ZINC001166294490 1048742790 /nfs/dbraw/zinc/74/27/90/1048742790.db2.gz IVZWIUXIJSOFDP-LLVKDONJSA-N -1 1 322.380 4.332 20 0 DIADMM CCc1nc(SCc2ccc(C)cc2Cl)[n-]c(=O)c1C ZINC001166308052 1048744041 /nfs/dbraw/zinc/74/40/41/1048744041.db2.gz QKWAHUFRWYDWKS-UHFFFAOYSA-N -1 1 308.834 4.307 20 0 DIADMM [O-]c1cc(Nc2ccc(OC(F)(F)F)cc2)cc(F)c1F ZINC001176643327 1048747418 /nfs/dbraw/zinc/74/74/18/1048747418.db2.gz VFHGREDSYWEAGC-UHFFFAOYSA-N -1 1 305.202 4.313 20 0 DIADMM CCOc1cc([N-]c2nc3cc(Cl)ccc3o2)c(F)cn1 ZINC001176600016 1048750049 /nfs/dbraw/zinc/75/00/49/1048750049.db2.gz WSWIABAVKIIEHT-UHFFFAOYSA-N -1 1 307.712 4.158 20 0 DIADMM Cc1ccc2nc(Nc3c(F)cc(F)c([O-])c3F)sc2c1 ZINC001176664431 1048751387 /nfs/dbraw/zinc/75/13/87/1048751387.db2.gz ZJAWGGWSYSXZSD-UHFFFAOYSA-N -1 1 310.300 4.471 20 0 DIADMM [O-]c1c(F)cc(F)c(Nc2cc(-c3cccc(F)c3)no2)c1F ZINC001176664679 1048751498 /nfs/dbraw/zinc/75/14/98/1048751498.db2.gz XBCVPIPLVZSLGK-UHFFFAOYSA-N -1 1 324.233 4.347 20 0 DIADMM CCCCOc1cc(Nc2c(F)cc(F)c([O-])c2F)ccn1 ZINC001176663759 1048751554 /nfs/dbraw/zinc/75/15/54/1048751554.db2.gz HSHJHVXHXYMXFF-UHFFFAOYSA-N -1 1 312.291 4.127 20 0 DIADMM [O-]c1c(F)cc(F)c(Nc2cnc(Cl)cc2Cl)c1F ZINC001176664936 1048753170 /nfs/dbraw/zinc/75/31/70/1048753170.db2.gz ZIBFOUIZTLDUAI-UHFFFAOYSA-N -1 1 309.074 4.255 20 0 DIADMM COc1nc(Nc2c(F)cc(F)c([O-])c2F)cc2ccccc21 ZINC001176669010 1048753629 /nfs/dbraw/zinc/75/36/29/1048753629.db2.gz BPXXMBKXFQCYDG-UHFFFAOYSA-N -1 1 320.270 4.110 20 0 DIADMM [O-]c1c(F)cc(F)c(Nc2ccc3ccc(O)cc3c2)c1F ZINC001176672069 1048754740 /nfs/dbraw/zinc/75/47/40/1048754740.db2.gz SETXNOUMVRWMKJ-UHFFFAOYSA-N -1 1 305.255 4.412 20 0 DIADMM Cc1ccc2cccnc2c1Nc1c(F)cc(F)c([O-])c1F ZINC001176671785 1048754802 /nfs/dbraw/zinc/75/48/02/1048754802.db2.gz OWKYRXOKUFIRMP-UHFFFAOYSA-N -1 1 304.271 4.410 20 0 DIADMM Cc1cc(=O)[nH]c2cc(Nc3c(F)cc(F)c([O-])c3F)ccc12 ZINC001176672388 1048755453 /nfs/dbraw/zinc/75/54/53/1048755453.db2.gz IUWLDEIMPUAQLI-UHFFFAOYSA-N -1 1 320.270 4.115 20 0 DIADMM [O-]c1c(F)cc(F)c(Nc2cc(F)cc3cccnc32)c1F ZINC001176671254 1048756046 /nfs/dbraw/zinc/75/60/46/1048756046.db2.gz VRMWAXDLSOLHNZ-UHFFFAOYSA-N -1 1 308.234 4.240 20 0 DIADMM [O-]c1c(F)cc(F)c(Nc2ccc(O)c3ccccc23)c1F ZINC001176671793 1048756511 /nfs/dbraw/zinc/75/65/11/1048756511.db2.gz PHVBSHWGPRTOQF-UHFFFAOYSA-N -1 1 305.255 4.412 20 0 DIADMM Cc1cc(Cl)c(Nc2c(F)cc(F)c([O-])c2F)cc1O ZINC001176670666 1048756625 /nfs/dbraw/zinc/75/66/25/1048756625.db2.gz JZWQNYWMIRMFIZ-UHFFFAOYSA-N -1 1 303.667 4.221 20 0 DIADMM CCOc1cccc(F)c1Nc1c(F)cc(F)c([O-])c1F ZINC001176674838 1048757051 /nfs/dbraw/zinc/75/70/51/1048757051.db2.gz XYMLHQNWDKHGAH-UHFFFAOYSA-N -1 1 301.239 4.091 20 0 DIADMM Cc1ccc2c(cccc2Nc2c(F)cc(F)c([O-])c2F)n1 ZINC001176672930 1048757920 /nfs/dbraw/zinc/75/79/20/1048757920.db2.gz OEXWJZTUIJFKTC-UHFFFAOYSA-N -1 1 304.271 4.410 20 0 DIADMM [O-]c1c(F)cc(F)c(Nc2cc(Cl)cc3ncoc32)c1F ZINC001176673796 1048758272 /nfs/dbraw/zinc/75/82/72/1048758272.db2.gz LZKNPNZHCUZZOE-UHFFFAOYSA-N -1 1 314.650 4.348 20 0 DIADMM [O-]c1c(F)cc(F)c(Nc2ccccc2OCC2CC2)c1F ZINC001176673516 1048758459 /nfs/dbraw/zinc/75/84/59/1048758459.db2.gz IZRTYRPDLPASML-UHFFFAOYSA-N -1 1 309.287 4.342 20 0 DIADMM c1coc(-c2nnc([N-]c3ccc(-c4ccncc4)cc3)o2)c1 ZINC001176694719 1048759709 /nfs/dbraw/zinc/75/97/09/1048759709.db2.gz UBMWBKCGJVNKDJ-UHFFFAOYSA-N -1 1 304.309 4.135 20 0 DIADMM CC(C)(C)c1csc(Nc2c(F)cc(F)c([O-])c2F)n1 ZINC001176662413 1048767459 /nfs/dbraw/zinc/76/74/59/1048767459.db2.gz OUUSRAHTWDXBAF-UHFFFAOYSA-N -1 1 302.321 4.307 20 0 DIADMM O=C(NCc1ccc([O-])c(Cl)c1)/C(F)=C\C1CCCCC1 ZINC001176994267 1048815613 /nfs/dbraw/zinc/81/56/13/1048815613.db2.gz OUGNTNAMJHQMIW-NTEUORMPSA-N -1 1 311.784 4.096 20 0 DIADMM O=C(NCCCCCCc1ccccc1)c1c([O-])cccc1F ZINC001166949642 1048818637 /nfs/dbraw/zinc/81/86/37/1048818637.db2.gz FMEDZWDWWRFVDJ-UHFFFAOYSA-N -1 1 315.388 4.064 20 0 DIADMM CC(C)(C)c1ccc(NC(=O)Nc2cccc(F)c2[O-])cc1 ZINC001191153259 1048865555 /nfs/dbraw/zinc/86/55/55/1048865555.db2.gz XEMJEZKDIKFESY-UHFFFAOYSA-N -1 1 302.349 4.473 20 0 DIADMM O=C(c1cccc(Nc2ccc(F)c(F)c2[O-])c1)C(F)(F)F ZINC001203347407 1048877477 /nfs/dbraw/zinc/87/74/77/1048877477.db2.gz WDMNSHINUPLMTD-UHFFFAOYSA-N -1 1 317.213 4.159 20 0 DIADMM O=C([O-])c1coc(CN2CCCC[C@H]2c2cc3ccccc3[nH]2)c1 ZINC000568402677 1048906908 /nfs/dbraw/zinc/90/69/08/1048906908.db2.gz QGLHDWDZQZDGBU-SFHVURJKSA-N -1 1 324.380 4.186 20 0 DIADMM CC(C)CCC[C@@H](NCc1ccc(-c2ccccc2)o1)C(=O)[O-] ZINC000904039328 1048959560 /nfs/dbraw/zinc/95/95/60/1048959560.db2.gz XTWZWAKOVVZIRY-QGZVFWFLSA-N -1 1 315.413 4.316 20 0 DIADMM CC(C)CCC[C@H](NCc1ccc(-c2ccccc2)o1)C(=O)[O-] ZINC000904039327 1048959887 /nfs/dbraw/zinc/95/98/87/1048959887.db2.gz XTWZWAKOVVZIRY-KRWDZBQOSA-N -1 1 315.413 4.316 20 0 DIADMM CC(C)[C@H](Cc1ccccc1)NC(=O)c1ccc(Cl)cc1[O-] ZINC001177912386 1048960480 /nfs/dbraw/zinc/96/04/80/1048960480.db2.gz JPUFNZBLISTLLA-INIZCTEOSA-N -1 1 317.816 4.043 20 0 DIADMM Cc1ccc(Cl)c(NC(=O)Nc2cc(Cl)ncc2[O-])c1 ZINC001191676570 1048975547 /nfs/dbraw/zinc/97/55/47/1048975547.db2.gz LLZGHUOVPRWCNZ-UHFFFAOYSA-N -1 1 312.156 4.046 20 0 DIADMM CC(C)c1ccc([C@@H](N[C@H](C)C(=O)[O-])c2cccs2)cc1 ZINC000904204815 1049002378 /nfs/dbraw/zinc/00/23/78/1049002378.db2.gz ZMEKOEPKDJUUKF-MLGOLLRUSA-N -1 1 303.427 4.024 20 0 DIADMM C[C@H]1CC[C@H](NC(=O)Nc2cccc(C(F)(F)F)c2[O-])CC1 ZINC001191825783 1049009114 /nfs/dbraw/zinc/00/91/14/1049009114.db2.gz PLQDKQGJPIPTFE-MGCOHNPYSA-N -1 1 316.323 4.111 20 0 DIADMM Cc1ccc2c(c1)CCN2C(=O)c1ccc2ccccc2c1[O-] ZINC000773739010 1049017655 /nfs/dbraw/zinc/01/76/55/1049017655.db2.gz WKHMRWAXZFARIF-UHFFFAOYSA-N -1 1 303.361 4.057 20 0 DIADMM O=C(Nc1cnn(C2CCCC2)c1)c1ccc2ccccc2c1[O-] ZINC001178316962 1049019525 /nfs/dbraw/zinc/01/95/25/1049019525.db2.gz ISOIFJDSHLGWNR-UHFFFAOYSA-N -1 1 321.380 4.109 20 0 DIADMM Cc1ccc(-c2cccc(NC(=O)c3ccc(F)c([O-])c3)n2)cc1 ZINC001178662639 1049072884 /nfs/dbraw/zinc/07/28/84/1049072884.db2.gz UGBZZYAEVXKVKN-UHFFFAOYSA-N -1 1 322.339 4.154 20 0 DIADMM O=C([O-])c1ccc(C[N@H+]2CCC[C@@H]2c2cc(F)ccc2F)cc1 ZINC001204154009 1049097612 /nfs/dbraw/zinc/09/76/12/1049097612.db2.gz AUAUYRPJAQBSAS-QGZVFWFLSA-N -1 1 317.335 4.000 20 0 DIADMM O=C([O-])c1ccc(CN2CCC[C@@H]2c2cc(F)ccc2F)cc1 ZINC001204154009 1049097625 /nfs/dbraw/zinc/09/76/25/1049097625.db2.gz AUAUYRPJAQBSAS-QGZVFWFLSA-N -1 1 317.335 4.000 20 0 DIADMM O=C([O-])c1ccc(C[N@H+]2CCCC[C@@H]2c2ccccc2F)cc1 ZINC001204154384 1049098686 /nfs/dbraw/zinc/09/86/86/1049098686.db2.gz HHSTVHMBNXANTI-GOSISDBHSA-N -1 1 313.372 4.251 20 0 DIADMM CC(C)=CCC/C(C)=C/CNC(=O)c1c(F)ccc([O-])c1F ZINC001192553239 1049115204 /nfs/dbraw/zinc/11/52/04/1049115204.db2.gz YBISGRFTIZJEMJ-FMIVXFBMSA-N -1 1 309.356 4.093 20 0 DIADMM O=C(Nc1cc2ccccc2s1)c1c(F)ccc([O-])c1F ZINC001192524702 1049116186 /nfs/dbraw/zinc/11/61/86/1049116186.db2.gz OVQICABAUNLBPP-UHFFFAOYSA-N -1 1 305.305 4.137 20 0 DIADMM CC(C)C[C@H](NC(=O)c1c(F)ccc([O-])c1F)c1ccccc1 ZINC001192539527 1049118069 /nfs/dbraw/zinc/11/80/69/1049118069.db2.gz LKAOPUMHNJUKBQ-AWEZNQCLSA-N -1 1 319.351 4.188 20 0 DIADMM CCCCN(Cc1ccccc1)C(=O)c1cc([O-])cc(F)c1F ZINC001192663142 1049132583 /nfs/dbraw/zinc/13/25/83/1049132583.db2.gz ABCCLAIPDSJLHS-UHFFFAOYSA-N -1 1 319.351 4.113 20 0 DIADMM CC(C)(C)c1ccc2c(c1)CCN2C(=O)c1cc(F)ccc1[O-] ZINC000857443939 1049149189 /nfs/dbraw/zinc/14/91/89/1049149189.db2.gz LTQMJENXMAPHJM-UHFFFAOYSA-N -1 1 313.372 4.032 20 0 DIADMM CCC[C@H](CCc1ccccc1)Nc1cc(Cl)[n-]c(=O)n1 ZINC000858422366 1049254856 /nfs/dbraw/zinc/25/48/56/1049254856.db2.gz JTBAWXOKYCVBRJ-CYBMUJFWSA-N -1 1 305.809 4.049 20 0 DIADMM CC[C@H](C)c1ccc(NC(=O)c2c[n-]c(C(F)(F)F)n2)cc1 ZINC001194770875 1049427717 /nfs/dbraw/zinc/42/77/17/1049427717.db2.gz RFFAGHJVKBLFSQ-VIFPVBQESA-N -1 1 311.307 4.194 20 0 DIADMM O=C(Nc1ccc(Oc2ccccc2)cc1)c1ccccc1[O-] ZINC000084831009 1049459219 /nfs/dbraw/zinc/45/92/19/1049459219.db2.gz SPBDIVKIHWMXBI-UHFFFAOYSA-N -1 1 305.333 4.437 20 0 DIADMM CC(C)c1cccc(S(=O)(=O)[N-]c2cccc(C3CC3)c2)c1 ZINC001195160066 1049488579 /nfs/dbraw/zinc/48/85/79/1049488579.db2.gz ZJRMCQQZNWNIRS-UHFFFAOYSA-N -1 1 315.438 4.488 20 0 DIADMM C/C(=C/C(C)(C)C)C(=O)Nc1cccc([O-])c1Br ZINC000908708747 1049498575 /nfs/dbraw/zinc/49/85/75/1049498575.db2.gz CPJWLEMVZGTUID-HJWRWDBZSA-N -1 1 312.207 4.086 20 0 DIADMM CC(C)CC(C)(C)C(=O)Nc1cccc([O-])c1Br ZINC000908708781 1049499062 /nfs/dbraw/zinc/49/90/62/1049499062.db2.gz AJECDKJIZSLXRM-UHFFFAOYSA-N -1 1 314.223 4.166 20 0 DIADMM C/C(=C\C(C)(C)C)C(=O)Nc1cccc([O-])c1Br ZINC000908708746 1049499929 /nfs/dbraw/zinc/49/99/29/1049499929.db2.gz CPJWLEMVZGTUID-CMDGGOBGSA-N -1 1 312.207 4.086 20 0 DIADMM Cc1ccc([O-])c(C(=O)N(C)[C@H](C)c2cccc3ccccc32)n1 ZINC001195326075 1049510577 /nfs/dbraw/zinc/51/05/77/1049510577.db2.gz LTLVKQSLROLYOF-CQSZACIVSA-N -1 1 320.392 4.082 20 0 DIADMM Cc1ccc2ccccc2c1NC(=O)c1cc([O-])cnc1Cl ZINC001195297916 1049511949 /nfs/dbraw/zinc/51/19/49/1049511949.db2.gz RGSCLYJNQJQVSI-UHFFFAOYSA-N -1 1 312.756 4.155 20 0 DIADMM C[C@H](NC(=O)Nc1cccc(C(F)(F)F)c1[O-])c1ccccc1 ZINC001202507556 1049515432 /nfs/dbraw/zinc/51/54/32/1049515432.db2.gz BDIAYQZJXRYJSA-JTQLQIEISA-N -1 1 324.302 4.294 20 0 DIADMM Cc1cc(C)c([N-]S(=O)(=O)c2c(C)cccc2Cl)cc1C ZINC001195316757 1049516413 /nfs/dbraw/zinc/51/64/13/1049516413.db2.gz HEXIBMHWYWKKNY-UHFFFAOYSA-N -1 1 323.845 4.374 20 0 DIADMM O=C(Nc1cc([O-])c(F)cc1F)C1(c2ccccc2)CCCC1 ZINC000909975681 1049573093 /nfs/dbraw/zinc/57/30/93/1049573093.db2.gz TZJVQDGPTYRRMW-UHFFFAOYSA-N -1 1 317.335 4.121 20 0 DIADMM Cc1ccc(N(CC2CC2)C(=O)c2ccc([O-])c(F)c2)cc1F ZINC000863601120 1049574523 /nfs/dbraw/zinc/57/45/23/1049574523.db2.gz OIJPLHVELNEELR-UHFFFAOYSA-N -1 1 317.335 4.036 20 0 DIADMM Cc1ccc(C2(C(=O)Nc3cc([O-])c(F)cc3F)CCC2)cc1 ZINC000909987843 1049576472 /nfs/dbraw/zinc/57/64/72/1049576472.db2.gz LDDVXWGGIQNXLQ-UHFFFAOYSA-N -1 1 317.335 4.039 20 0 DIADMM CCc1c(Cl)cc(Nc2cnn3cccnc23)c([O-])c1Cl ZINC001205997411 1049624468 /nfs/dbraw/zinc/62/44/68/1049624468.db2.gz PGYVERQTODNGOK-UHFFFAOYSA-N -1 1 323.183 4.048 20 0 DIADMM [O-]c1ccc(-c2nccc(SCc3ccccc3)n2)c(F)c1 ZINC001206044234 1049639369 /nfs/dbraw/zinc/63/93/69/1049639369.db2.gz GFFKRLOINXZPBZ-UHFFFAOYSA-N -1 1 312.369 4.281 20 0 DIADMM Cc1ccc2c(c1)SCCCN2Cc1ccc([O-])c(F)c1F ZINC001206098883 1049653592 /nfs/dbraw/zinc/65/35/92/1049653592.db2.gz HWYYFBVWDJSIKG-UHFFFAOYSA-N -1 1 321.392 4.481 20 0 DIADMM CCC[C@@H]1[C@@H](C)CCCN1C(=O)Cc1ccc([O-])c(Cl)c1 ZINC001294211256 1049680784 /nfs/dbraw/zinc/68/07/84/1049680784.db2.gz DPCDZLFDRSDWOF-SWLSCSKDSA-N -1 1 309.837 4.015 20 0 DIADMM COc1cc(C)cc(NC(=O)Nc2ccc([O-])c(Cl)c2)c1C ZINC000489757817 1049780347 /nfs/dbraw/zinc/78/03/47/1049780347.db2.gz XPILTJRULDEXAS-UHFFFAOYSA-N -1 1 320.776 4.315 20 0 DIADMM CCCC1CCC([N-]S(=O)(=O)c2sccc2Cl)CC1 ZINC001208518594 1049995402 /nfs/dbraw/zinc/99/54/02/1049995402.db2.gz ASCNYSALZUJMLN-UHFFFAOYSA-N -1 1 321.895 4.039 20 0 DIADMM Fc1cccnc1[N-]c1nc2ccc(Br)cc2s1 ZINC001209805488 1050087579 /nfs/dbraw/zinc/08/75/79/1050087579.db2.gz UTZIHHLHYJTUAE-UHFFFAOYSA-N -1 1 324.178 4.337 20 0 DIADMM Cc1c(Cl)cc(Nc2ccc3[nH]nc(N)c3c2)c([O-])c1Cl ZINC001209861280 1050096486 /nfs/dbraw/zinc/09/64/86/1050096486.db2.gz ALRJNULEHVNPBW-UHFFFAOYSA-N -1 1 323.183 4.210 20 0 DIADMM C[N@@H+](CC[C@@H](C(=O)[O-])c1ccccc1)Cc1ccccc1Cl ZINC000573097871 1050134009 /nfs/dbraw/zinc/13/40/09/1050134009.db2.gz QOCREMJZWHKQEF-MRXNPFEDSA-N -1 1 317.816 4.030 20 0 DIADMM [O-]c1c(Nc2ccc(OC(F)F)nc2)ccc(Cl)c1Cl ZINC001210305943 1050199962 /nfs/dbraw/zinc/19/99/62/1050199962.db2.gz NIKAYPCKROWXSY-UHFFFAOYSA-N -1 1 321.110 4.439 20 0 DIADMM O=C([N-]C1(C(F)(F)F)CCCCC1)C(F)(F)c1ccccc1 ZINC000733968359 1050210203 /nfs/dbraw/zinc/21/02/03/1050210203.db2.gz SSMOKYBEXMYSCS-UHFFFAOYSA-N -1 1 321.289 4.160 20 0 DIADMM CC[C@H]1CCCCCN1C(=O)c1ccc(C(F)(F)F)c([O-])c1 ZINC001136871192 1050212116 /nfs/dbraw/zinc/21/21/16/1050212116.db2.gz XGWRDZWJXWSFAX-LBPRGKRZSA-N -1 1 315.335 4.206 20 0 DIADMM CCC[C@H](CCc1ccccc1)NC(=O)c1cccc([O-])c1F ZINC001136957772 1050256239 /nfs/dbraw/zinc/25/62/39/1050256239.db2.gz WOYZQHQALPXHQM-OAHLLOKOSA-N -1 1 315.388 4.063 20 0 DIADMM Cc1c(CNC(=O)c2c([O-])cccc2Cl)oc2ccccc12 ZINC000734550996 1050286474 /nfs/dbraw/zinc/28/64/74/1050286474.db2.gz BWHXQKCSBVVYKN-UHFFFAOYSA-N -1 1 315.756 4.030 20 0 DIADMM C[C@@H]1C[C@@H](c2ccccc2)CN1C(=O)c1c([O-])cccc1Cl ZINC000734555356 1050289011 /nfs/dbraw/zinc/28/90/11/1050289011.db2.gz PYDJKHGCLPGCCF-TZMCWYRMSA-N -1 1 315.800 4.064 20 0 DIADMM O=C(Cc1ccc([O-])c(Cl)c1)NCCCCC1CCCC1 ZINC001137029742 1050303023 /nfs/dbraw/zinc/30/30/23/1050303023.db2.gz KYHLQXNNKHPWOP-UHFFFAOYSA-N -1 1 309.837 4.065 20 0 DIADMM CC(C)(C)[C@@H]1CCCN(C(=O)c2c([O-])cccc2Cl)CC1 ZINC000734872571 1050326869 /nfs/dbraw/zinc/32/68/69/1050326869.db2.gz OUZMBMQOWKSUGP-GFCCVEGCSA-N -1 1 309.837 4.334 20 0 DIADMM CC/C(C)=C\C(=O)Nc1c([O-])cc(Br)cc1Cl ZINC000843887446 1050330136 /nfs/dbraw/zinc/33/01/36/1050330136.db2.gz WDZHIYBZHVNPHE-DAXSKMNVSA-N -1 1 318.598 4.103 20 0 DIADMM CC(C)=C(C)C(=O)Nc1c([O-])cc(Br)cc1Cl ZINC000843885364 1050330422 /nfs/dbraw/zinc/33/04/22/1050330422.db2.gz GWZVIIFRJBRKDM-UHFFFAOYSA-N -1 1 318.598 4.103 20 0 DIADMM CCOc1cc(C(=O)Nc2ccc(C)cc2F)cc(Cl)c1[O-] ZINC000178124100 1050331310 /nfs/dbraw/zinc/33/13/10/1050331310.db2.gz OEYXYUWRZNFDDE-UHFFFAOYSA-N -1 1 323.751 4.144 20 0 DIADMM [O-]c1c(Cl)cc(Cl)cc1Nc1cnc(C(F)(F)F)nc1 ZINC001210670985 1050333571 /nfs/dbraw/zinc/33/35/71/1050333571.db2.gz UGUYWHVRXFEMFL-UHFFFAOYSA-N -1 1 324.089 4.251 20 0 DIADMM [O-]c1c(Cl)c(Cl)ccc1Nc1ccnc(OC2CC2)c1 ZINC001210749660 1050360936 /nfs/dbraw/zinc/36/09/36/1050360936.db2.gz KXYAMBLJKVQJBB-UHFFFAOYSA-N -1 1 311.168 4.379 20 0 DIADMM CCCSc1ncnc(-c2cccc([O-])c2Cl)c1OC ZINC001242799316 1050409121 /nfs/dbraw/zinc/40/91/21/1050409121.db2.gz FBHPFYZFORNOJH-UHFFFAOYSA-N -1 1 310.806 4.013 20 0 DIADMM CC(C)(C)OC(=O)c1ccc(-c2cccc([O-])c2Cl)cn1 ZINC001242800829 1050413581 /nfs/dbraw/zinc/41/35/81/1050413581.db2.gz PQLGNPDBYFUSES-UHFFFAOYSA-N -1 1 305.761 4.063 20 0 DIADMM COC(=O)c1cc(Nc2cc(Cl)c([O-])c(Cl)c2)cs1 ZINC001210924274 1050416428 /nfs/dbraw/zinc/41/64/28/1050416428.db2.gz GMOZGNONBLPODG-UHFFFAOYSA-N -1 1 318.181 4.291 20 0 DIADMM O=C(c1ccc2ccccc2c1[O-])N1CCCc2sccc2C1 ZINC000593421977 1050416738 /nfs/dbraw/zinc/41/67/38/1050416738.db2.gz CQWMXSNJJSJDSY-UHFFFAOYSA-N -1 1 323.417 4.196 20 0 DIADMM CC(C)n1cc2c(n1)[C@@H]([N-]c1nc(-c3ccccc3)no1)CCC2 ZINC000785837362 1050417441 /nfs/dbraw/zinc/41/74/41/1050417441.db2.gz NTCAMRUWKGQZBF-HNNXBMFYSA-N -1 1 323.400 4.004 20 0 DIADMM [O-]c1cc(F)cc(F)c1Nc1ccccc1N1CCCCC1 ZINC001210962829 1050435193 /nfs/dbraw/zinc/43/51/93/1050435193.db2.gz GCVXDZNCRUJWRB-UHFFFAOYSA-N -1 1 304.340 4.404 20 0 DIADMM O=C(Nc1c([O-])cccc1F)c1cc2c(cccc2F)s1 ZINC000735924559 1050439405 /nfs/dbraw/zinc/43/94/05/1050439405.db2.gz CWFSTGPTPFHNBT-UHFFFAOYSA-N -1 1 305.305 4.137 20 0 DIADMM C[C@H](C(=O)[N-]OCc1ccccc1)c1ccc(Cl)c(Cl)c1 ZINC000746582307 1050475673 /nfs/dbraw/zinc/47/56/73/1050475673.db2.gz UIKUOJMGOTXQLT-NSHDSACASA-N -1 1 324.207 4.345 20 0 DIADMM CC[C@H](C)c1ccc(S(=O)(=O)[N-]c2ccnc(Cl)c2)cc1 ZINC000226511597 1050481319 /nfs/dbraw/zinc/48/13/19/1050481319.db2.gz SAYAPQIHVBDHEY-NSHDSACASA-N -1 1 324.833 4.049 20 0 DIADMM O=C(c1ccc([O-])cc1F)N1Cc2ccccc2-c2ccccc21 ZINC001144212521 1050496110 /nfs/dbraw/zinc/49/61/10/1050496110.db2.gz WBTGSNXWWQOVFR-UHFFFAOYSA-N -1 1 319.335 4.359 20 0 DIADMM CC1(C[N-]S(=O)(=O)c2sccc2Cl)CCCCCC1 ZINC001211289172 1050538764 /nfs/dbraw/zinc/53/87/64/1050538764.db2.gz OSPRHPCDGKOQLD-UHFFFAOYSA-N -1 1 321.895 4.040 20 0 DIADMM COc1cc(Nc2c([O-])cc(F)cc2F)cc(C(F)(F)F)c1 ZINC001211335891 1050550072 /nfs/dbraw/zinc/55/00/72/1050550072.db2.gz RZMWEQSTPFMFRG-UHFFFAOYSA-N -1 1 319.229 4.441 20 0 DIADMM COc1cc(C(F)(F)F)ccc1-c1cc(F)c([O-])cc1F ZINC001211350936 1050554354 /nfs/dbraw/zinc/55/43/54/1050554354.db2.gz ZGNAWAULUYDBDG-UHFFFAOYSA-N -1 1 304.214 4.365 20 0 DIADMM [O-]c1cc(F)c(-c2cncc(-c3nc4ccccc4[nH]3)c2)cc1F ZINC001211353722 1050555227 /nfs/dbraw/zinc/55/52/27/1050555227.db2.gz ZADDCVDYHQOJSF-UHFFFAOYSA-N -1 1 323.302 4.276 20 0 DIADMM [O-]c1c(Cl)cc(Cl)cc1Nc1cccc(CO)c1F ZINC001211440162 1050569262 /nfs/dbraw/zinc/56/92/62/1050569262.db2.gz ZZJIRZQGCCCHTQ-UHFFFAOYSA-N -1 1 302.132 4.074 20 0 DIADMM O=C1CCCc2cc(Nc3cc([O-])c(Cl)cc3F)ccc21 ZINC001213105098 1050589428 /nfs/dbraw/zinc/58/94/28/1050589428.db2.gz YGQDRCUYMLXESJ-UHFFFAOYSA-N -1 1 305.736 4.447 20 0 DIADMM Cc1ccc([C@@H]2CCCN2Cc2c(F)cc([O-])cc2F)cc1 ZINC001144554889 1050612276 /nfs/dbraw/zinc/61/22/76/1050612276.db2.gz LCSOCKZOPYGJKI-SFHVURJKSA-N -1 1 303.352 4.316 20 0 DIADMM Cc1ccc(N(CC2CC2)C(=O)c2ccc(F)c([O-])c2)cc1F ZINC001170080176 1050631211 /nfs/dbraw/zinc/63/12/11/1050631211.db2.gz JMGFKBAALKNZFB-UHFFFAOYSA-N -1 1 317.335 4.036 20 0 DIADMM [O-]c1ccc(Cl)c(Nc2cc(F)c(O)c(F)c2)c1Cl ZINC001213384283 1050644333 /nfs/dbraw/zinc/64/43/33/1050644333.db2.gz CSTXTVFBVJUFTG-UHFFFAOYSA-N -1 1 306.095 4.426 20 0 DIADMM [O-]c1c(F)cc(Nc2ccccc2OCC(F)(F)F)cc1F ZINC001213386414 1050644503 /nfs/dbraw/zinc/64/45/03/1050644503.db2.gz BERRBAUJRLDMKO-UHFFFAOYSA-N -1 1 319.229 4.355 20 0 DIADMM [O-]c1c(Cl)cc(Cl)cc1Nc1cc(F)c(O)c(F)c1 ZINC001213382023 1050644674 /nfs/dbraw/zinc/64/46/74/1050644674.db2.gz VMVUHGHQXPTJFK-UHFFFAOYSA-N -1 1 306.095 4.426 20 0 DIADMM [O-]c1cc(F)c(CN2CCC(c3ccccc3F)CC2)cc1F ZINC001144667671 1050646202 /nfs/dbraw/zinc/64/62/02/1050646202.db2.gz XPJHMQFNGKFYRX-UHFFFAOYSA-N -1 1 321.342 4.189 20 0 DIADMM CC(C)Oc1c(F)cc(Nc2ccc(F)c(F)c2[O-])cc1F ZINC001213426072 1050653658 /nfs/dbraw/zinc/65/36/58/1050653658.db2.gz XMMOMABBRBQQGS-UHFFFAOYSA-N -1 1 315.266 4.479 20 0 DIADMM Cc1cc(C)c(Nc2ccc(F)c(Br)c2[O-])cn1 ZINC001213518568 1050678717 /nfs/dbraw/zinc/67/87/17/1050678717.db2.gz VRSAUQYPTFMROI-UHFFFAOYSA-N -1 1 311.154 4.049 20 0 DIADMM Cc1cccc(-c2noc(-c3cc([O-])cnc3Cl)n2)c1Cl ZINC001213696297 1050721164 /nfs/dbraw/zinc/72/11/64/1050721164.db2.gz QBALXGQEUKLKMA-UHFFFAOYSA-N -1 1 322.151 4.119 20 0 DIADMM CC(C)c1ccc(-c2noc(-c3cc([O-])cnc3Cl)n2)cc1 ZINC001213696411 1050721531 /nfs/dbraw/zinc/72/15/31/1050721531.db2.gz VRFUNTZHUDQOEY-UHFFFAOYSA-N -1 1 315.760 4.281 20 0 DIADMM COc1ccccc1-c1ccc([C@@H](C)[N-]C(=O)C(F)(F)F)cc1 ZINC000741726602 1050732829 /nfs/dbraw/zinc/73/28/29/1050732829.db2.gz BFCFXSRGRSVFHE-LLVKDONJSA-N -1 1 323.314 4.102 20 0 DIADMM CCSc1ccc([C@H](C)NC(=O)c2c([O-])cccc2F)cc1 ZINC001144865441 1050733128 /nfs/dbraw/zinc/73/31/28/1050733128.db2.gz REOJALOIEREMSU-NSHDSACASA-N -1 1 319.401 4.134 20 0 DIADMM COc1cccc(Nc2ccc(-n3ccc(=O)[n-]3)cc2)c1C1CC1 ZINC001213812211 1050749612 /nfs/dbraw/zinc/74/96/12/1050749612.db2.gz RZENHLOQPCDTKW-UHFFFAOYSA-N -1 1 321.380 4.208 20 0 DIADMM O=C(N[C@@H]1CCc2cc(Cl)ccc21)c1cc(Cl)ccc1[O-] ZINC001171263731 1050806641 /nfs/dbraw/zinc/80/66/41/1050806641.db2.gz WXWHPJKHEMYYKO-CQSZACIVSA-N -1 1 322.191 4.116 20 0 DIADMM COc1cc(F)c(Nc2ccc(F)c(F)c2[O-])cc1Cl ZINC001214067930 1050809273 /nfs/dbraw/zinc/80/92/73/1050809273.db2.gz VFRUTQZJQWLYFO-UHFFFAOYSA-N -1 1 303.667 4.215 20 0 DIADMM [O-]c1c(Cl)c(Cl)ccc1Nc1c(F)cc(CO)cc1F ZINC001214099106 1050819143 /nfs/dbraw/zinc/81/91/43/1050819143.db2.gz NXELOQGXXJLKAZ-UHFFFAOYSA-N -1 1 320.122 4.213 20 0 DIADMM Cc1ccccc1[C@@H](CC(C)C)NC(=O)c1c([O-])cccc1F ZINC001146489229 1050827053 /nfs/dbraw/zinc/82/70/53/1050827053.db2.gz RYTRGESKLQXQOQ-MRXNPFEDSA-N -1 1 315.388 4.357 20 0 DIADMM Cc1c(Cl)cc(Nc2cc(F)ccc2N)c([O-])c1Cl ZINC001214213826 1050848191 /nfs/dbraw/zinc/84/81/91/1050848191.db2.gz XLCWZRRFZSBKRB-UHFFFAOYSA-N -1 1 301.148 4.472 20 0 DIADMM CC(C)C[C@@H]1CCCCCN1C(=O)c1ccc(Cl)cc1[O-] ZINC001147275961 1050873599 /nfs/dbraw/zinc/87/35/99/1050873599.db2.gz FMIIDZUERQVITO-AWEZNQCLSA-N -1 1 309.837 4.477 20 0 DIADMM Cc1ccc(O)cc1Nc1ccc(F)c(Br)c1[O-] ZINC001214352452 1050880501 /nfs/dbraw/zinc/88/05/01/1050880501.db2.gz GTXJTWAIEGHWDG-UHFFFAOYSA-N -1 1 312.138 4.051 20 0 DIADMM CCOc1cc(C(=O)NCCCCC(C)C)cc(Cl)c1[O-] ZINC001147477841 1050881962 /nfs/dbraw/zinc/88/19/62/1050881962.db2.gz KPMUYKCMEBOFDP-UHFFFAOYSA-N -1 1 313.825 4.000 20 0 DIADMM [O-]c1c(Nc2cc(OC(F)(F)F)ccc2O)ccc(F)c1F ZINC001214384535 1050888776 /nfs/dbraw/zinc/88/87/76/1050888776.db2.gz HPNBLZHDFSIRBQ-UHFFFAOYSA-N -1 1 321.201 4.018 20 0 DIADMM CC(C)(C)c1nnc(Nc2cc(F)c([O-])c(Cl)c2)s1 ZINC001214479869 1050918777 /nfs/dbraw/zinc/91/87/77/1050918777.db2.gz HKMICQWRCKBMFS-UHFFFAOYSA-N -1 1 301.774 4.077 20 0 DIADMM Cn1nc(-c2ccccc2)cc1Nc1cc(F)c([O-])c(Cl)c1 ZINC001214480676 1050917694 /nfs/dbraw/zinc/91/76/94/1050917694.db2.gz XYJVAYNNIQRPCY-UHFFFAOYSA-N -1 1 317.751 4.329 20 0 DIADMM [O-]c1c(F)cc(Nc2cccc(C(F)(F)F)n2)cc1Cl ZINC001214479654 1050918260 /nfs/dbraw/zinc/91/82/60/1050918260.db2.gz CMEROJOPSLWNCR-UHFFFAOYSA-N -1 1 306.646 4.342 20 0 DIADMM [O-]c1c(F)cc(Nc2cccnc2OC(F)(F)F)cc1Cl ZINC001214484320 1050918921 /nfs/dbraw/zinc/91/89/21/1050918921.db2.gz HTZYTEQFUDBLHW-UHFFFAOYSA-N -1 1 322.645 4.222 20 0 DIADMM CC(=O)Nc1cc(Nc2cc(F)c([O-])c(Cl)c2)ccc1C ZINC001214488672 1050919644 /nfs/dbraw/zinc/91/96/44/1050919644.db2.gz KPSYAUSPKIITKO-UHFFFAOYSA-N -1 1 308.740 4.195 20 0 DIADMM [O-]c1c(F)cc(Nc2cccc(-n3cccn3)c2)cc1Cl ZINC001214489229 1050920280 /nfs/dbraw/zinc/92/02/80/1050920280.db2.gz YOBDMTCWYINRNN-UHFFFAOYSA-N -1 1 303.724 4.114 20 0 DIADMM [O-]c1c(F)cc(Nc2cccc(Cn3cccn3)c2)cc1Cl ZINC001214488300 1050920375 /nfs/dbraw/zinc/92/03/75/1050920375.db2.gz AZEWKMGYUHDWQQ-UHFFFAOYSA-N -1 1 317.751 4.173 20 0 DIADMM CCC(=O)Nc1cccc(Nc2cc(F)c([O-])c(Cl)c2)c1 ZINC001214488851 1050920584 /nfs/dbraw/zinc/92/05/84/1050920584.db2.gz NYLPFUQBDVVLAU-UHFFFAOYSA-N -1 1 308.740 4.277 20 0 DIADMM COC(=O)c1ccc(Nc2cc(F)c([O-])c(Cl)c2)cc1C ZINC001214486713 1050920621 /nfs/dbraw/zinc/92/06/21/1050920621.db2.gz VXKADLCIRORVRY-UHFFFAOYSA-N -1 1 309.724 4.023 20 0 DIADMM CCOC(=O)c1cccc(Nc2cc(F)c([O-])c(Cl)c2)c1 ZINC001214490282 1050921841 /nfs/dbraw/zinc/92/18/41/1050921841.db2.gz SQJGTDMJHVKBHX-UHFFFAOYSA-N -1 1 309.724 4.105 20 0 DIADMM [O-]c1c(F)cc(Nc2ccc(CO)c(Cl)c2)cc1Cl ZINC001214492158 1050922028 /nfs/dbraw/zinc/92/20/28/1050922028.db2.gz ROZMLYOXLHCWEN-UHFFFAOYSA-N -1 1 302.132 4.074 20 0 DIADMM CC(C)OC(=O)c1cccc(Nc2cc(F)c([O-])c(Cl)c2)c1 ZINC001214490460 1050922924 /nfs/dbraw/zinc/92/29/24/1050922924.db2.gz WDNHHVQBPXFKNO-UHFFFAOYSA-N -1 1 323.751 4.494 20 0 DIADMM Cc1c(Cl)ccc(N)c1Nc1cc(F)c([O-])c(Cl)c1 ZINC001214490554 1050923084 /nfs/dbraw/zinc/92/30/84/1050923084.db2.gz XSRXSAODCDXRMV-UHFFFAOYSA-N -1 1 301.148 4.472 20 0 DIADMM [O-]c1c(F)cc(Nc2ccc3c(c2)[C@H](O)CCC3)cc1Cl ZINC001214492054 1050923435 /nfs/dbraw/zinc/92/34/35/1050923435.db2.gz PXLNDQBOVMNJAA-OAHLLOKOSA-N -1 1 307.752 4.298 20 0 DIADMM C=CC(=O)Nc1cccc(Nc2cc(F)c([O-])c(Cl)c2)c1 ZINC001214494410 1050925080 /nfs/dbraw/zinc/92/50/80/1050925080.db2.gz PYYJZMMPTNEVLV-UHFFFAOYSA-N -1 1 306.724 4.053 20 0 DIADMM O=C(Nc1ccc(-c2cc(=O)[nH][n-]2)cc1)C1CCCCCCC1 ZINC000743309801 1051012470 /nfs/dbraw/zinc/01/24/70/1051012470.db2.gz CYYBRKDMQCYWPE-UHFFFAOYSA-N -1 1 313.401 4.081 20 0 DIADMM CCCCCC[C@@H](C)C(=O)Nc1ccc(-c2cc(=O)[nH][n-]2)cc1 ZINC000743309599 1051012498 /nfs/dbraw/zinc/01/24/98/1051012498.db2.gz ATTPBGVXRHUSRG-CYBMUJFWSA-N -1 1 315.417 4.327 20 0 DIADMM CCCCCC[C@H](C)C(=O)Nc1ccc(-c2cc(=O)[nH][n-]2)cc1 ZINC000743309601 1051013143 /nfs/dbraw/zinc/01/31/43/1051013143.db2.gz ATTPBGVXRHUSRG-ZDUSSCGKSA-N -1 1 315.417 4.327 20 0 DIADMM COc1c(F)cc(Nc2cc(F)c([O-])cc2F)cc1Cl ZINC001214974704 1051041125 /nfs/dbraw/zinc/04/11/25/1051041125.db2.gz KWQHQAYOGOQWFX-UHFFFAOYSA-N -1 1 303.667 4.215 20 0 DIADMM CC(C)Oc1ccc(F)c(F)c1Nc1cc([O-])c(F)c(F)c1 ZINC001215078963 1051073673 /nfs/dbraw/zinc/07/36/73/1051073673.db2.gz PCCBFFGNJSAFDY-UHFFFAOYSA-N -1 1 315.266 4.479 20 0 DIADMM COCOc1cc(C)c(Nc2cc(F)c([O-])cc2F)c(C)c1 ZINC001215168565 1051098334 /nfs/dbraw/zinc/09/83/34/1051098334.db2.gz RPFJNGXUVVDYQY-UHFFFAOYSA-N -1 1 309.312 4.014 20 0 DIADMM O=C([O-])c1cccc(NCc2cc(Cl)cc(Cl)c2O)c1 ZINC000036891067 1051101989 /nfs/dbraw/zinc/10/19/89/1051101989.db2.gz KPAOCYFOIUXZLE-UHFFFAOYSA-N -1 1 312.152 4.009 20 0 DIADMM [O-]c1cc(O)ccc1-c1nc(-c2ccc3sccc3c2)no1 ZINC001215299795 1051157652 /nfs/dbraw/zinc/15/76/52/1051157652.db2.gz GSCSIOOWPQECRD-UHFFFAOYSA-N -1 1 310.334 4.030 20 0 DIADMM [O-]c1cc(O)ccc1-c1nc(-c2cccc(Cl)c2Cl)no1 ZINC001215299698 1051158004 /nfs/dbraw/zinc/15/80/04/1051158004.db2.gz ADCLHXWXKOJFPX-UHFFFAOYSA-N -1 1 323.135 4.122 20 0 DIADMM CC(C)(C)c1ccc(-c2noc(-c3ccc(O)cc3[O-])n2)cc1 ZINC001215300177 1051159586 /nfs/dbraw/zinc/15/95/86/1051159586.db2.gz QJHWESYSCXMNJQ-UHFFFAOYSA-N -1 1 310.353 4.112 20 0 DIADMM COc1cccc([O-])c1-c1nc(-c2cccc(C)c2Cl)no1 ZINC001215322205 1051165390 /nfs/dbraw/zinc/16/53/90/1051165390.db2.gz BJIGNKFEOSWHCJ-UHFFFAOYSA-N -1 1 316.744 4.080 20 0 DIADMM COc1cccc([O-])c1-c1nc(-c2ccc(C(C)(C)C)cc2)no1 ZINC001215322491 1051165487 /nfs/dbraw/zinc/16/54/87/1051165487.db2.gz QVHYPHPCINNUSZ-UHFFFAOYSA-N -1 1 324.380 4.415 20 0 DIADMM COc1cccc([O-])c1-c1nc(-c2cc(Cl)ccc2C)no1 ZINC001215322380 1051165536 /nfs/dbraw/zinc/16/55/36/1051165536.db2.gz JVRNNHBFXJQQQI-UHFFFAOYSA-N -1 1 316.744 4.080 20 0 DIADMM Cc1cccc(-c2noc(-c3ccc([O-])cc3Cl)n2)c1C ZINC001215342835 1051172294 /nfs/dbraw/zinc/17/22/94/1051172294.db2.gz ASGRHSIXQDEZCS-UHFFFAOYSA-N -1 1 300.745 4.379 20 0 DIADMM CC(=O)c1ccc([O-])c(CCOC(=O)CCC2CCCCC2)c1 ZINC000744464151 1051176519 /nfs/dbraw/zinc/17/65/19/1051176519.db2.gz MKQJCDTVLUJSMO-UHFFFAOYSA-N -1 1 318.413 4.041 20 0 DIADMM CC(C)Oc1c(Nc2ccc(F)c(F)c2[O-])ccc(F)c1F ZINC001215426153 1051200425 /nfs/dbraw/zinc/20/04/25/1051200425.db2.gz DEXOSZXIQIYOSF-UHFFFAOYSA-N -1 1 315.266 4.479 20 0 DIADMM CC(C)Oc1c(Nc2cc(F)c([O-])cc2F)ccc(F)c1F ZINC001215426176 1051201154 /nfs/dbraw/zinc/20/11/54/1051201154.db2.gz DWBJBJBHYBEVRE-UHFFFAOYSA-N -1 1 315.266 4.479 20 0 DIADMM Cc1c(Cl)ccc([N-]c2nnc(Br)s2)c1F ZINC001215521982 1051229579 /nfs/dbraw/zinc/22/95/79/1051229579.db2.gz FPZCXCGFRCQRCR-UHFFFAOYSA-N -1 1 322.590 4.145 20 0 DIADMM Cc1ccc(Nc2cc(F)c([O-])cc2F)cc1Br ZINC001215573082 1051251050 /nfs/dbraw/zinc/25/10/50/1051251050.db2.gz BGJZKBQPEFDWFZ-UHFFFAOYSA-N -1 1 314.129 4.485 20 0 DIADMM COc1c(N)cc(C(C)(C)C)cc1Nc1cc(F)c([O-])cc1F ZINC001215576972 1051253428 /nfs/dbraw/zinc/25/34/28/1051253428.db2.gz PFMXHWRJXCBMQD-UHFFFAOYSA-N -1 1 322.355 4.302 20 0 DIADMM [O-]c1cc(F)c(Nc2ccc(F)c(OC(F)(F)F)c2)cc1F ZINC001215574105 1051254567 /nfs/dbraw/zinc/25/45/67/1051254567.db2.gz XHBAVJURPWYLOI-UHFFFAOYSA-N -1 1 323.192 4.452 20 0 DIADMM [O-]c1cc(F)c(Nc2c(O)cccc2C(F)(F)F)cc1F ZINC001215574495 1051254675 /nfs/dbraw/zinc/25/46/75/1051254675.db2.gz VTRCHXBKBZNYNF-UHFFFAOYSA-N -1 1 305.202 4.138 20 0 DIADMM Cc1cc(C)n(-c2ccc(Nc3cc(F)c([O-])cc3F)cc2)n1 ZINC001215573766 1051255150 /nfs/dbraw/zinc/25/51/50/1051255150.db2.gz IEFGNLWXKVEEQO-UHFFFAOYSA-N -1 1 315.323 4.217 20 0 DIADMM Cc1cc(Nc2cc(F)c([O-])cc2F)ccc1Br ZINC001215573461 1051255170 /nfs/dbraw/zinc/25/51/70/1051255170.db2.gz KQSCGAPUYCKZIX-UHFFFAOYSA-N -1 1 314.129 4.485 20 0 DIADMM Cc1ccc(Cl)c(-c2noc(-c3cc(F)ccc3[O-])n2)c1 ZINC001215769994 1051357452 /nfs/dbraw/zinc/35/74/52/1051357452.db2.gz ZIHBHAXXKHVBFT-UHFFFAOYSA-N -1 1 304.708 4.210 20 0 DIADMM CSc1cccc(F)c1Nc1cc2ccc([O-])cc2oc1=O ZINC001215823943 1051389397 /nfs/dbraw/zinc/38/93/97/1051389397.db2.gz AHYVFUCRVQTLSK-UHFFFAOYSA-N -1 1 317.341 4.103 20 0 DIADMM [O-]c1ccc(-c2nc(-c3cccc(F)c3Cl)no2)c(F)c1 ZINC001215825993 1051391198 /nfs/dbraw/zinc/39/11/98/1051391198.db2.gz BKKCINQWFPVLLP-UHFFFAOYSA-N -1 1 308.671 4.041 20 0 DIADMM [O-]c1ccc(-c2nc(-c3ccc4sccc4c3)no2)c(F)c1 ZINC001215826794 1051392672 /nfs/dbraw/zinc/39/26/72/1051392672.db2.gz RWCDWKBQTFUOPZ-UHFFFAOYSA-N -1 1 312.325 4.463 20 0 DIADMM CSc1cc(F)c(Nc2cc([O-])c(F)c(F)c2)c(F)c1 ZINC001215843446 1051407328 /nfs/dbraw/zinc/40/73/28/1051407328.db2.gz AZUIBOFHZVIBSU-UHFFFAOYSA-N -1 1 303.280 4.414 20 0 DIADMM CSc1c(F)cc(Nc2cc([O-])c(F)c(F)c2)cc1F ZINC001215924187 1051460333 /nfs/dbraw/zinc/46/03/33/1051460333.db2.gz CLXUTGPXBYSOJG-UHFFFAOYSA-N -1 1 303.280 4.414 20 0 DIADMM CC(F)(F)c1ccc(Nc2ccc(-n3ccc(=O)[n-]3)cc2)cc1 ZINC001212678131 1051479730 /nfs/dbraw/zinc/47/97/30/1051479730.db2.gz IDMHNAKBHHZHOL-UHFFFAOYSA-N -1 1 315.323 4.433 20 0 DIADMM CC(C)(C)c1nc([N-]c2cnc(F)c(-c3ccccc3)c2)no1 ZINC001215958418 1051483378 /nfs/dbraw/zinc/48/33/78/1051483378.db2.gz OMORTMYPYVHJCT-UHFFFAOYSA-N -1 1 312.348 4.312 20 0 DIADMM CSc1cc(F)c(Nc2c([O-])cc(F)cc2F)cc1F ZINC001215968641 1051491992 /nfs/dbraw/zinc/49/19/92/1051491992.db2.gz OYFOPQYVVVFZND-UHFFFAOYSA-N -1 1 303.280 4.414 20 0 DIADMM [O-]c1cccc(-c2nc(-c3ccc(Cl)c(F)c3)no2)c1F ZINC001215984239 1051502348 /nfs/dbraw/zinc/50/23/48/1051502348.db2.gz MGSNHQGBYGICOW-UHFFFAOYSA-N -1 1 308.671 4.041 20 0 DIADMM [O-]c1cccc(-c2nc(-c3cccc4c3CCCC4)no2)c1F ZINC001215989072 1051506319 /nfs/dbraw/zinc/50/63/19/1051506319.db2.gz PPCWWYSIXTYPKQ-UHFFFAOYSA-N -1 1 310.328 4.127 20 0 DIADMM COc1c(Cl)ccc(Nc2cc([O-])c(F)c(F)c2)c1F ZINC001212586442 1051544544 /nfs/dbraw/zinc/54/45/44/1051544544.db2.gz WWSDTIUTMSCJLO-UHFFFAOYSA-N -1 1 303.667 4.215 20 0 DIADMM Nc1ccc(Nc2cc(F)c([O-])cc2F)cc1C(F)(F)F ZINC001216052366 1051551047 /nfs/dbraw/zinc/55/10/47/1051551047.db2.gz WPCRFTIRAOAMSE-UHFFFAOYSA-N -1 1 304.218 4.015 20 0 DIADMM [O-]c1cc(Nc2ccc(Cn3ccnc3)cc2)c(F)cc1Cl ZINC001212696940 1051588247 /nfs/dbraw/zinc/58/82/47/1051588247.db2.gz WHEAJGONKADASS-UHFFFAOYSA-N -1 1 317.751 4.173 20 0 DIADMM CCOC(=O)c1c(-c2ccco2)csc1[N-]c1conc1C ZINC001212719239 1051676183 /nfs/dbraw/zinc/67/61/83/1051676183.db2.gz BSRAPDRUTDDUTI-UHFFFAOYSA-N -1 1 318.354 4.225 20 0 DIADMM COc1c(Cl)ccc([O-])c1-c1nc(-c2ccc(C)cc2)no1 ZINC001216306577 1051688661 /nfs/dbraw/zinc/68/86/61/1051688661.db2.gz KWFCHOSQYMKQPT-UHFFFAOYSA-N -1 1 316.744 4.080 20 0 DIADMM [O-]c1cc(F)cc(-c2nc(-c3cccc4ccccc43)no2)c1 ZINC001216339441 1051706243 /nfs/dbraw/zinc/70/62/43/1051706243.db2.gz IIWUCNIESFDBOR-UHFFFAOYSA-N -1 1 306.296 4.402 20 0 DIADMM COc1c(Nc2ccnc(Cl)c2[O-])cccc1C(F)(F)F ZINC001216635766 1051844804 /nfs/dbraw/zinc/84/48/04/1051844804.db2.gz HQXRZEFPJUZWKE-UHFFFAOYSA-N -1 1 318.682 4.212 20 0 DIADMM C[C@H](NC(=O)c1ccc([O-])c(F)c1)c1csc2ccccc21 ZINC000767982134 1051870803 /nfs/dbraw/zinc/87/08/03/1051870803.db2.gz JWTMWMREEVIUEJ-JTQLQIEISA-N -1 1 315.369 4.237 20 0 DIADMM COc1ccc(C(C)C)cc1Nc1ccc(-n2ccc(=O)[n-]2)cc1 ZINC001173915591 1051875563 /nfs/dbraw/zinc/87/55/63/1051875563.db2.gz CJUAWGGFKZNDKZ-UHFFFAOYSA-N -1 1 323.396 4.454 20 0 DIADMM [O-]c1ccc(C(F)(F)F)cc1-c1nc(-c2ccccc2F)no1 ZINC001216831576 1051889464 /nfs/dbraw/zinc/88/94/64/1051889464.db2.gz SEBKEFNCNJYMDN-UHFFFAOYSA-N -1 1 324.233 4.267 20 0 DIADMM Cc1ccccc1-c1noc(-c2cc(C(F)(F)F)ccc2[O-])n1 ZINC001216832882 1051892060 /nfs/dbraw/zinc/89/20/60/1051892060.db2.gz ZSLDXDXQEFERNV-UHFFFAOYSA-N -1 1 320.270 4.436 20 0 DIADMM [O-]c1ccc(F)c(-c2nc(-c3cccc4occc43)no2)c1F ZINC001216920315 1051909262 /nfs/dbraw/zinc/90/92/62/1051909262.db2.gz NMVUPIUKYVDJEY-UHFFFAOYSA-N -1 1 314.247 4.134 20 0 DIADMM Cc1ccc(Cl)c(-c2noc(-c3cc([O-])cc(F)c3F)n2)c1 ZINC001216922659 1051910329 /nfs/dbraw/zinc/91/03/29/1051910329.db2.gz FESZWMITHVLDMN-UHFFFAOYSA-N -1 1 322.698 4.349 20 0 DIADMM [O-]c1cc(F)c(F)c(-c2nc(-c3ccc4occc4c3)no2)c1 ZINC001216922504 1051910537 /nfs/dbraw/zinc/91/05/37/1051910537.db2.gz ABTGCWDLWCQETG-UHFFFAOYSA-N -1 1 314.247 4.134 20 0 DIADMM [O-]c1ccc(F)c(-c2nc(-c3cccc(Cl)c3)no2)c1F ZINC001216922392 1051910799 /nfs/dbraw/zinc/91/07/99/1051910799.db2.gz MNRHMFZIIOIRCY-UHFFFAOYSA-N -1 1 308.671 4.041 20 0 DIADMM Cc1ccc(-c2noc(-c3c(C)cc(O)cc3[O-])n2)cc1Cl ZINC001216987178 1051926676 /nfs/dbraw/zinc/92/66/76/1051926676.db2.gz TVHXGCURZJOQIX-UHFFFAOYSA-N -1 1 316.744 4.085 20 0 DIADMM Cc1ccc(Cl)cc1-c1noc(-c2c(C)cc(O)cc2[O-])n1 ZINC001216987555 1051926918 /nfs/dbraw/zinc/92/69/18/1051926918.db2.gz WZLPURGVKOIKAL-UHFFFAOYSA-N -1 1 316.744 4.085 20 0 DIADMM O=C(Nc1ccc([O-])c(Cl)c1)Nc1ccc(F)cc1Cl ZINC000190916316 1051954449 /nfs/dbraw/zinc/95/44/49/1051954449.db2.gz LOGMCPFABWTHAJ-UHFFFAOYSA-N -1 1 315.131 4.482 20 0 DIADMM CO[C@H](C)c1cccc(NC(=O)Nc2ccc([O-])c(Cl)c2)c1 ZINC000190958617 1051955342 /nfs/dbraw/zinc/95/53/42/1051955342.db2.gz HDLFFZXEKNMTMO-SNVBAGLBSA-N -1 1 320.776 4.397 20 0 DIADMM CSc1ccccc1NC(=O)Nc1ccc([O-])c(Cl)c1 ZINC000190918641 1051955759 /nfs/dbraw/zinc/95/57/59/1051955759.db2.gz JUNUYYFSUMNTCV-UHFFFAOYSA-N -1 1 308.790 4.412 20 0 DIADMM Cc1ccc(-c2noc(-c3ccc4cccnc4c3[O-])n2)cc1F ZINC001217141600 1051976728 /nfs/dbraw/zinc/97/67/28/1051976728.db2.gz HHDLQURQCSKNCN-UHFFFAOYSA-N -1 1 321.311 4.105 20 0 DIADMM Cc1ccncc1Nc1c(Cl)ccc(Br)c1[O-] ZINC001174119204 1051986914 /nfs/dbraw/zinc/98/69/14/1051986914.db2.gz KDBSQNXPPIEWPP-UHFFFAOYSA-N -1 1 313.582 4.255 20 0 DIADMM CC(C)c1csc(NC(=O)Nc2ccc([O-])c(Cl)c2)n1 ZINC000192179023 1052002583 /nfs/dbraw/zinc/00/25/83/1052002583.db2.gz YDJBFUDDBNHLTL-UHFFFAOYSA-N -1 1 311.794 4.270 20 0 DIADMM Cc1cc2cc(NC(=O)Nc3ccc([O-])c(Cl)c3)ccc2[nH]1 ZINC000192214000 1052006101 /nfs/dbraw/zinc/00/61/01/1052006101.db2.gz VADBFMBIUSCRSQ-UHFFFAOYSA-N -1 1 315.760 4.479 20 0 DIADMM O=C(Nc1ccc2[nH]ccc2c1)Nc1ccc([O-])c(Cl)c1 ZINC000192210861 1052006181 /nfs/dbraw/zinc/00/61/81/1052006181.db2.gz OOMYQWYJJOJJRF-UHFFFAOYSA-N -1 1 301.733 4.171 20 0 DIADMM Cc1ccc(S(=O)(=O)[N-]c2cccc(C(F)F)c2)cc1C ZINC000195451912 1052054906 /nfs/dbraw/zinc/05/49/06/1052054906.db2.gz OFHLFOMIVKSWFC-UHFFFAOYSA-N -1 1 311.353 4.042 20 0 DIADMM [O-]c1c2ccccc2cc(O)c1-c1nc(-c2ccccc2F)no1 ZINC001217452977 1052060337 /nfs/dbraw/zinc/06/03/37/1052060337.db2.gz LPZKFBGXZNURFD-UHFFFAOYSA-N -1 1 322.295 4.107 20 0 DIADMM Cc1ccnc(-c2noc(-c3ccc4sccc4c3[O-])n2)c1 ZINC001217514555 1052078745 /nfs/dbraw/zinc/07/87/45/1052078745.db2.gz RLMYQQQXIAYJGP-UHFFFAOYSA-N -1 1 309.350 4.027 20 0 DIADMM [O-]c1c2ccsc2ccc1-c1nc(-c2ccc(F)cc2)no1 ZINC001217513850 1052079075 /nfs/dbraw/zinc/07/90/75/1052079075.db2.gz AWSOMMBYNIVNMH-UHFFFAOYSA-N -1 1 312.325 4.463 20 0 DIADMM CC[C@H](c1ccncc1)N(CC)C(=O)c1c([O-])cccc1Cl ZINC000769902756 1052120030 /nfs/dbraw/zinc/12/00/30/1052120030.db2.gz AOHUASMIBWNFEW-CQSZACIVSA-N -1 1 318.804 4.054 20 0 DIADMM CC[C@@H](c1ccncc1)N(CC)C(=O)c1c([O-])cccc1Cl ZINC000769902755 1052120544 /nfs/dbraw/zinc/12/05/44/1052120544.db2.gz AOHUASMIBWNFEW-AWEZNQCLSA-N -1 1 318.804 4.054 20 0 DIADMM O=C(c1c([O-])cccc1Cl)N1CC[C@H]1c1ccc(Cl)cc1 ZINC000769913106 1052120777 /nfs/dbraw/zinc/12/07/77/1052120777.db2.gz ABCMTTRCTKHASX-ZDUSSCGKSA-N -1 1 322.191 4.286 20 0 DIADMM CC(C)(C)c1ccc(C(=O)Nc2c(N)cccc2Cl)c([O-])c1 ZINC001218909038 1052262825 /nfs/dbraw/zinc/26/28/25/1052262825.db2.gz KVZUFFYOTDRBSA-UHFFFAOYSA-N -1 1 318.804 4.178 20 0 DIADMM Cc1c(Cl)cc(F)c([N-]C(=O)c2scnc2Cl)c1F ZINC000761957694 1052277472 /nfs/dbraw/zinc/27/74/72/1052277472.db2.gz PCBVWCWUJZUVHJ-UHFFFAOYSA-N -1 1 323.151 4.289 20 0 DIADMM CCCCC[C@@H](C)NC(=O)c1cc(Cl)c([O-])c(OCC)c1 ZINC000762576162 1052401254 /nfs/dbraw/zinc/40/12/54/1052401254.db2.gz CQJLSNIYLBGXCL-LLVKDONJSA-N -1 1 313.825 4.143 20 0 DIADMM CSCc1cccc(-c2nc3cccc(F)c3c(=O)[n-]2)c1 ZINC000609224137 1052456610 /nfs/dbraw/zinc/45/66/10/1052456610.db2.gz JDJFNVWLIKYJHP-UHFFFAOYSA-N -1 1 300.358 4.005 20 0 DIADMM CC1(C)CN(C(=O)c2cc3ccccc3cc2[O-])[C@H]2CCC[C@H]21 ZINC000393442031 1052483618 /nfs/dbraw/zinc/48/36/18/1052483618.db2.gz OHDUAXLXHXIYPC-SJORKVTESA-N -1 1 309.409 4.196 20 0 DIADMM CCCC1CCC(NC(=O)NCc2ccc([O-])c(Cl)c2)CC1 ZINC001224752848 1052722992 /nfs/dbraw/zinc/72/29/92/1052722992.db2.gz XVBOIZOQEOFUGA-UHFFFAOYSA-N -1 1 324.852 4.204 20 0 DIADMM CC(C)Oc1cc(F)c(F)cc1Nc1ccc(F)c(F)c1[O-] ZINC001212227467 1052725761 /nfs/dbraw/zinc/72/57/61/1052725761.db2.gz LJKOZOYSNRBIRC-UHFFFAOYSA-N -1 1 315.266 4.479 20 0 DIADMM CC(C)Oc1cc(F)c(F)cc1Nc1cc([O-])c(F)c(F)c1 ZINC001212227595 1052727207 /nfs/dbraw/zinc/72/72/07/1052727207.db2.gz RLKOBNQCRQCZNN-UHFFFAOYSA-N -1 1 315.266 4.479 20 0 DIADMM CCCCCC1CCC(OCCCC[P@](=O)([O-])O)CC1 ZINC001225022758 1052744965 /nfs/dbraw/zinc/74/49/65/1052744965.db2.gz RQVUMQLJJTVMMK-UHFFFAOYSA-N -1 1 306.383 4.100 20 0 DIADMM O=C(Nc1ccc([O-])c(Cl)c1)[C@H]1SCCc2ccccc21 ZINC000129602625 1052797799 /nfs/dbraw/zinc/79/77/99/1052797799.db2.gz DSSBFHRSQVFLMZ-HNNXBMFYSA-N -1 1 319.813 4.015 20 0 DIADMM CC(=O)c1ccc([O-])cc1O[C@@H]1CCCc2c(Cl)ccnc21 ZINC001225619183 1052808983 /nfs/dbraw/zinc/80/89/83/1052808983.db2.gz MSXSESXCHUXKMU-OAHLLOKOSA-N -1 1 317.772 4.100 20 0 DIADMM CC(=O)c1ccc([O-])cc1O[C@H]1Cc2cccc3cccc1c23 ZINC001225617000 1052809097 /nfs/dbraw/zinc/80/90/97/1052809097.db2.gz SKSJHUGWNMTTGT-SFHVURJKSA-N -1 1 304.345 4.424 20 0 DIADMM CC(=O)c1ccc([O-])cc1O[C@@H]1Cc2cccc3cccc1c23 ZINC001225616998 1052809190 /nfs/dbraw/zinc/80/91/90/1052809190.db2.gz SKSJHUGWNMTTGT-GOSISDBHSA-N -1 1 304.345 4.424 20 0 DIADMM CC(=O)c1ccc([O-])cc1O[C@@H](C)c1cc(-c2ccccc2)no1 ZINC001225618630 1052809366 /nfs/dbraw/zinc/80/93/66/1052809366.db2.gz GOPHAJXNVIJKBJ-ZDUSSCGKSA-N -1 1 323.348 4.390 20 0 DIADMM CCC[C@@H](Oc1cc([O-])cc(O)c1C(C)=O)c1ccccc1 ZINC001225673904 1052815535 /nfs/dbraw/zinc/81/55/35/1052815535.db2.gz BAPIATRQZQRAQE-MRXNPFEDSA-N -1 1 300.354 4.221 20 0 DIADMM CC(=O)c1c(O)cc([O-])cc1O[C@@H]1CC[C@@H]2CCCC[C@H]2C1 ZINC001225679977 1052815662 /nfs/dbraw/zinc/81/56/62/1052815662.db2.gz SZIZRKXZFJXEOV-KCQAQPDRSA-N -1 1 304.386 4.038 20 0 DIADMM CC(=O)c1c(O)cc([O-])cc1O[C@@H](C)c1ccc(C)cc1C ZINC001225674155 1052815994 /nfs/dbraw/zinc/81/59/94/1052815994.db2.gz CPOPWSCNONMRKI-ZDUSSCGKSA-N -1 1 300.354 4.057 20 0 DIADMM COC1=CC[C@@H](Oc2ccc(C(=O)c3ccc([O-])cc3)cc2)CC1 ZINC001225807290 1052833863 /nfs/dbraw/zinc/83/38/63/1052833863.db2.gz HAPFEGYUCZZOQM-LJQANCHMSA-N -1 1 324.376 4.085 20 0 DIADMM CSc1cc(F)ccc1[N-]C(=O)c1c(F)cc(F)cc1F ZINC001277094995 1052863905 /nfs/dbraw/zinc/86/39/05/1052863905.db2.gz ORBOUHMVZLWYDD-UHFFFAOYSA-N -1 1 315.291 4.217 20 0 DIADMM CCc1cccc(C)c1[N-]S(=O)(=O)c1ccc(C)c(Cl)c1 ZINC000071974007 1052864309 /nfs/dbraw/zinc/86/43/09/1052864309.db2.gz DUAWXDJKSUOVDF-UHFFFAOYSA-N -1 1 323.845 4.320 20 0 DIADMM Cc1cc(=O)oc2cc([O-])cc(O[C@@H](C)c3cccs3)c12 ZINC001226488781 1052901765 /nfs/dbraw/zinc/90/17/65/1052901765.db2.gz HXLKBUDKUWWSBK-JTQLQIEISA-N -1 1 302.351 4.009 20 0 DIADMM C[C@@H](Oc1[n-]c(=S)ncc1F)c1cc(Cl)ccc1Cl ZINC001227386262 1052987800 /nfs/dbraw/zinc/98/78/00/1052987800.db2.gz OSLYFOXGDINYOH-ZCFIWIBFSA-N -1 1 319.188 4.351 20 0 DIADMM CC(C)CCOC(=O)[C@H](C)Oc1cc(Cl)c([O-])cc1Cl ZINC001227647379 1053005896 /nfs/dbraw/zinc/00/58/96/1053005896.db2.gz YAQNANLHJZJPHN-VIFPVBQESA-N -1 1 321.200 4.056 20 0 DIADMM C[C@@H]1c2cnccc2C[C@@H]1Oc1cc(Cl)c([O-])cc1Cl ZINC001227647541 1053006046 /nfs/dbraw/zinc/00/60/46/1053006046.db2.gz ZDTUJFNKDPCDAF-CLAHSXSESA-N -1 1 310.180 4.201 20 0 DIADMM [O-]c1cc(Cl)c(O[C@@H]2CC(F)(F)C2(F)F)cc1Cl ZINC001227644708 1053006184 /nfs/dbraw/zinc/00/61/84/1053006184.db2.gz CFCUDNNBLMOYGR-MRVPVSSYSA-N -1 1 305.054 4.121 20 0 DIADMM CC1(C)[C@H](Oc2[n-]c(=S)nc3cnccc32)[C@]2(C)CC[C@H]1C2 ZINC001227880366 1053025024 /nfs/dbraw/zinc/02/50/24/1053025024.db2.gz AMOTYINSVYNUHU-RMLVOYDJSA-N -1 1 315.442 4.281 20 0 DIADMM CCC1(C(=O)Nc2ccc([O-])c(F)c2F)CCC(F)(F)CC1 ZINC000616101052 1053045612 /nfs/dbraw/zinc/04/56/12/1053045612.db2.gz LVKXYIWWABDRRL-UHFFFAOYSA-N -1 1 319.298 4.215 20 0 DIADMM CCc1nc(SCCSc2ccccc2F)[n-]c(=O)c1C ZINC000849920933 1053117654 /nfs/dbraw/zinc/11/76/54/1053117654.db2.gz HWCSZMBXNHKBKE-UHFFFAOYSA-N -1 1 324.446 4.077 20 0 DIADMM CSc1c(F)cccc1[N-]C(=O)c1coc(C2CCC2)n1 ZINC000617274588 1053119337 /nfs/dbraw/zinc/11/93/37/1053119337.db2.gz BOOXLBYXQPMLMN-UHFFFAOYSA-N -1 1 306.362 4.055 20 0 DIADMM CCC(=O)c1c(O)cc([O-])cc1O[C@H]1CCc2cccc(C)c21 ZINC001228557817 1053134065 /nfs/dbraw/zinc/13/40/65/1053134065.db2.gz CVBHPHSSBLMBNL-INIZCTEOSA-N -1 1 312.365 4.065 20 0 DIADMM CCC(=O)c1c(O)cc([O-])cc1O[C@@H]1CCc2cccc(C)c21 ZINC001228557818 1053134537 /nfs/dbraw/zinc/13/45/37/1053134537.db2.gz CVBHPHSSBLMBNL-MRXNPFEDSA-N -1 1 312.365 4.065 20 0 DIADMM O=C1CC[C@@H](Oc2[n-]c(=S)nc3ccccc32)c2ccccc21 ZINC001228766969 1053178010 /nfs/dbraw/zinc/17/80/10/1053178010.db2.gz XYQUQEZTONRXOH-MRXNPFEDSA-N -1 1 322.389 4.015 20 0 DIADMM COc1ccc([C@H](C)Oc2[n-]c(=S)nc3ccccc32)cc1 ZINC001228766397 1053178122 /nfs/dbraw/zinc/17/81/22/1053178122.db2.gz RYUOGAOWHIBLFN-NSHDSACASA-N -1 1 312.394 4.067 20 0 DIADMM CC1(C)CC(Oc2[n-]c(=S)nc3ccccc32)CC(C)(C)O1 ZINC001228764555 1053178230 /nfs/dbraw/zinc/17/82/30/1053178230.db2.gz JJTDBXFHPRPUQI-UHFFFAOYSA-N -1 1 318.442 4.034 20 0 DIADMM C[C@H](Oc1[n-]c(=S)nc2ccccc21)c1cccnc1Cl ZINC001228764150 1053178392 /nfs/dbraw/zinc/17/83/92/1053178392.db2.gz GMZDORPERVFVPA-VIFPVBQESA-N -1 1 317.801 4.107 20 0 DIADMM C[C@H](Oc1[n-]c(=S)nc2ccccc21)c1cccc(F)c1F ZINC001228767461 1053179612 /nfs/dbraw/zinc/17/96/12/1053179612.db2.gz ZSGCJFVXKIGBPB-VIFPVBQESA-N -1 1 318.348 4.337 20 0 DIADMM CCc1ccc2nc(-c3ccc(O[C@H](C)CC)cc3)[n-]c(=O)c2c1 ZINC001318874050 1053199743 /nfs/dbraw/zinc/19/97/43/1053199743.db2.gz YKSKXEHMIMRFMM-CYBMUJFWSA-N -1 1 322.408 4.330 20 0 DIADMM CC[C@@H](C)C[C@@H](CC)Oc1c([O-])c(OC)cc2ccc(=O)oc21 ZINC001229217148 1053275782 /nfs/dbraw/zinc/27/57/82/1053275782.db2.gz YDHZSPJRBLJDSB-DGCLKSJQSA-N -1 1 320.385 4.101 20 0 DIADMM CC[C@@H](C)CC[C@H](C)Oc1c([O-])c(OC)cc2ccc(=O)oc21 ZINC001229216358 1053276279 /nfs/dbraw/zinc/27/62/79/1053276279.db2.gz PTOFYSGJFGRJCO-NEPJUHHUSA-N -1 1 320.385 4.101 20 0 DIADMM CCCC[C@H](C)Oc1cc(O)ccc1C(=O)c1ccc([O-])cc1 ZINC001229293677 1053293532 /nfs/dbraw/zinc/29/35/32/1053293532.db2.gz GYQJSTMHSVHSQB-ZDUSSCGKSA-N -1 1 314.381 4.286 20 0 DIADMM Cc1ccccc1C(F)(F)C(=O)Nc1ccc([O-])c(Cl)c1 ZINC001320065755 1053299436 /nfs/dbraw/zinc/29/94/36/1053299436.db2.gz NNCRXTLLCYAVCV-UHFFFAOYSA-N -1 1 311.715 4.085 20 0 DIADMM [O-]c1cc(O[C@H]2COCc3ccccc32)c(Cl)cc1Cl ZINC001229409588 1053316567 /nfs/dbraw/zinc/31/65/67/1053316567.db2.gz FMRDTEFYNODUGH-HNNXBMFYSA-N -1 1 311.164 4.349 20 0 DIADMM CCC(=O)c1ccc([O-])cc1O[C@@H]1CCc2c1nccc2Cl ZINC001229474907 1053331770 /nfs/dbraw/zinc/33/17/70/1053331770.db2.gz MQGZAKYEGYLPOO-OAHLLOKOSA-N -1 1 317.772 4.100 20 0 DIADMM CCC(=O)c1ccc([O-])cc1O[C@H]1CCc2c1cc(F)cc2F ZINC001229477906 1053332383 /nfs/dbraw/zinc/33/23/83/1053332383.db2.gz RDCFFASEZRUOTJ-KRWDZBQOSA-N -1 1 318.319 4.329 20 0 DIADMM CCC(=O)c1ccc([O-])cc1O[C@@H](C)COc1ccc(C)cc1 ZINC001229477566 1053334242 /nfs/dbraw/zinc/33/42/42/1053334242.db2.gz OMASAWBUKIUEHE-AWEZNQCLSA-N -1 1 314.381 4.140 20 0 DIADMM O=C(c1ccc(F)c([O-])c1)N1CCC[C@@H]1CCC1CCCC1 ZINC001545762758 1053363708 /nfs/dbraw/zinc/36/37/08/1053363708.db2.gz VSMJBRJPFCWJJU-OAHLLOKOSA-N -1 1 305.393 4.106 20 0 DIADMM CC(C)(C)Oc1cc(F)ccc1NC(=O)c1cccc([O-])c1F ZINC001545813821 1053366504 /nfs/dbraw/zinc/36/65/04/1053366504.db2.gz PCRCPQLWJGUFHO-UHFFFAOYSA-N -1 1 321.323 4.100 20 0 DIADMM CCC[C@@H](C(=O)Nc1ccc(Br)c([O-])c1)C(C)C ZINC001320950189 1053377375 /nfs/dbraw/zinc/37/73/75/1053377375.db2.gz ZABCRTXLHMCQHL-LLVKDONJSA-N -1 1 314.223 4.166 20 0 DIADMM C/C(=C\C(C)(C)C)C(=O)Nc1ccc(Br)c([O-])c1 ZINC001321277896 1053404634 /nfs/dbraw/zinc/40/46/34/1053404634.db2.gz PXDCVDHVELGRPP-CMDGGOBGSA-N -1 1 312.207 4.086 20 0 DIADMM O=C(/C=C/c1ccc(Cl)cc1)Nc1ccc([O-])c(Cl)c1 ZINC000070286533 1053425467 /nfs/dbraw/zinc/42/54/67/1053425467.db2.gz HNCJSSSRTUZGKB-FPYGCLRLSA-N -1 1 308.164 4.351 20 0 DIADMM Clc1cc2[n-]c(O[C@H]3CCc4ccccc43)nc2c(Cl)n1 ZINC001231045381 1053661560 /nfs/dbraw/zinc/66/15/60/1053661560.db2.gz VUWJFOYIGNVWTE-NSHDSACASA-N -1 1 320.179 4.331 20 0 DIADMM Clc1cc2nc(O[C@H]3CCc4ccccc43)[n-]c2c(Cl)n1 ZINC001231045381 1053661566 /nfs/dbraw/zinc/66/15/66/1053661566.db2.gz VUWJFOYIGNVWTE-NSHDSACASA-N -1 1 320.179 4.331 20 0 DIADMM CC(C)[C@H]1CC[C@H](Oc2cccnc2-c2ncccc2[O-])CC1 ZINC001231204059 1053700748 /nfs/dbraw/zinc/70/07/48/1053700748.db2.gz NCFVJPPCKYBETH-SHTZXODSSA-N -1 1 312.413 4.443 20 0 DIADMM C[C@@H](CCc1ccccc1)Oc1cccnc1-c1ncccc1[O-] ZINC001231200886 1053702339 /nfs/dbraw/zinc/70/23/39/1053702339.db2.gz TVYXAJYVHOEXST-HNNXBMFYSA-N -1 1 320.392 4.249 20 0 DIADMM CCC(CC)c1cc(C(=O)[N-]c2cc(F)c(F)cc2F)on1 ZINC000154533869 1053739699 /nfs/dbraw/zinc/73/96/99/1053739699.db2.gz IWVTVQVRXNKDKG-UHFFFAOYSA-N -1 1 312.291 4.248 20 0 DIADMM CC[C@H](NC(=O)c1ccc([O-])cc1F)c1cccc(Cl)c1 ZINC000154785423 1053750967 /nfs/dbraw/zinc/75/09/67/1053750967.db2.gz WEKIMYFFZWDCCY-HNNXBMFYSA-N -1 1 307.752 4.066 20 0 DIADMM CCN(Cc1ccc(Cl)cc1)Cc1cc(C(=O)[O-])ccc1F ZINC001231461622 1053757259 /nfs/dbraw/zinc/75/72/59/1053757259.db2.gz YGTLBHIGNNYFLD-UHFFFAOYSA-N -1 1 321.779 4.199 20 0 DIADMM O=C([O-])c1ccc(F)c(CN(Cc2ccccc2)C2CCC2)c1 ZINC001231461336 1053758870 /nfs/dbraw/zinc/75/88/70/1053758870.db2.gz ZAWHAHRKYGCQQU-UHFFFAOYSA-N -1 1 313.372 4.079 20 0 DIADMM CCOc1ccc2c(c1)CN(Cc1cccc([O-])c1Cl)CC2 ZINC001326326624 1053774853 /nfs/dbraw/zinc/77/48/53/1053774853.db2.gz BITRXGCYVQLAPX-UHFFFAOYSA-N -1 1 317.816 4.003 20 0 DIADMM [O-]c1cc(CN2CCc3cccc(Cl)c3C2)ccc1Cl ZINC001231737810 1053845606 /nfs/dbraw/zinc/84/56/06/1053845606.db2.gz VYZKCXBKLIDNIL-UHFFFAOYSA-N -1 1 308.208 4.257 20 0 DIADMM [O-]c1cccc(NC(=S)Nc2cc(F)cc(F)c2)c1Cl ZINC001200670060 1053871633 /nfs/dbraw/zinc/87/16/33/1053871633.db2.gz RLXXWAIOWBZSOK-UHFFFAOYSA-N -1 1 314.744 4.133 20 0 DIADMM Cc1nc(S[C@@H]2CCc3c2cccc3F)[n-]c(=O)c1C1CC1 ZINC001329274817 1053978385 /nfs/dbraw/zinc/97/83/85/1053978385.db2.gz VVXRDDBBXIXOML-CQSZACIVSA-N -1 1 316.401 4.287 20 0 DIADMM [O-]c1cccc(CN2CCc3c4ccccc4oc3C2)c1Cl ZINC001232788615 1054122805 /nfs/dbraw/zinc/12/28/05/1054122805.db2.gz GZEMFCRVBUINOD-UHFFFAOYSA-N -1 1 313.784 4.350 20 0 DIADMM C[N@@H+](Cc1ccc2ccccc2c1)Cc1cc(Cl)ncc1O ZINC001233037656 1054174506 /nfs/dbraw/zinc/17/45/06/1054174506.db2.gz GCJRBELVYOSVHR-UHFFFAOYSA-N -1 1 312.800 4.226 20 0 DIADMM CC[N@@H+](Cc1ccccc1)Cc1ccc(OC)c(O)c1Cl ZINC001233397255 1054259130 /nfs/dbraw/zinc/25/91/30/1054259130.db2.gz QWPAWYBLUJOKME-UHFFFAOYSA-N -1 1 305.805 4.076 20 0 DIADMM CCc1nc(C)c(NC(=O)c2ccc(C(C)C)cc2[O-])s1 ZINC000622524011 1054259789 /nfs/dbraw/zinc/25/97/89/1054259789.db2.gz BOGDYLRTOMOUDN-UHFFFAOYSA-N -1 1 304.415 4.095 20 0 DIADMM Cc1ccccc1[C@@H]1CCC[N@H+]1Cc1c(F)ccc(O)c1F ZINC001233394045 1054260395 /nfs/dbraw/zinc/26/03/95/1054260395.db2.gz XHVCLQXVZFLIOH-INIZCTEOSA-N -1 1 303.352 4.316 20 0 DIADMM Oc1ccc(F)c(CN2CCC[C@H](c3ccccc3)C2)c1F ZINC001233395694 1054261195 /nfs/dbraw/zinc/26/11/95/1054261195.db2.gz JWLSIKCZZUWSMY-AWEZNQCLSA-N -1 1 303.352 4.050 20 0 DIADMM Cc1nc(S[C@H]2CCCc3ccc(F)cc32)[n-]c(=O)c1C ZINC001473011120 1054280099 /nfs/dbraw/zinc/28/00/99/1054280099.db2.gz ILWMZFNRBVMZKL-AWEZNQCLSA-N -1 1 304.390 4.108 20 0 DIADMM CCC1(CC)CCCN(C(=O)c2c(F)ccc([O-])c2F)CC1 ZINC000622550031 1054285544 /nfs/dbraw/zinc/28/55/44/1054285544.db2.gz WFZSMAULDBXDMS-UHFFFAOYSA-N -1 1 311.372 4.103 20 0 DIADMM CCCC(=O)c1ccc([O-])cc1OC[C@H](OC)c1ccccc1 ZINC001233650622 1054321940 /nfs/dbraw/zinc/32/19/40/1054321940.db2.gz NDELEJSYYUHTCW-IBGZPJMESA-N -1 1 314.381 4.142 20 0 DIADMM C[C@@H](c1ccccc1)N(C)C(=O)c1ccc2ccc(O)cc2c1[O-] ZINC001440667963 1054363241 /nfs/dbraw/zinc/36/32/41/1054363241.db2.gz UDWACWVQLXQEBA-ZDUSSCGKSA-N -1 1 321.376 4.084 20 0 DIADMM O=C(Nc1ccc([O-])c(Cl)c1)c1cc(-c2cccs2)on1 ZINC000171881346 1054394685 /nfs/dbraw/zinc/39/46/85/1054394685.db2.gz IZDBMVAYIFGMEN-UHFFFAOYSA-N -1 1 320.757 4.014 20 0 DIADMM C[C@H](Oc1ccc(CC(=O)c2ccc([O-])cc2)cc1)C1CCC1 ZINC001233940103 1054396382 /nfs/dbraw/zinc/39/63/82/1054396382.db2.gz AQNXQQBHJONVFF-AWEZNQCLSA-N -1 1 310.393 4.385 20 0 DIADMM Cc1cccc([C@H](NC(=O)c2cc(F)ccc2[O-])C(C)(C)C)c1 ZINC001442058329 1054407855 /nfs/dbraw/zinc/40/78/55/1054407855.db2.gz ZHMXJYVVSGYTPQ-KRWDZBQOSA-N -1 1 315.388 4.357 20 0 DIADMM Cc1ccc2c(c1)S[C@@H](C(=O)Nc1ccc([O-])c(Cl)c1)C2 ZINC001342033400 1054414987 /nfs/dbraw/zinc/41/49/87/1054414987.db2.gz BGTUFRDLKCIHNU-OAHLLOKOSA-N -1 1 319.813 4.010 20 0 DIADMM CCNc1ccc(C)cc1C(=O)Nc1ccc([O-])c(Cl)c1 ZINC001545953652 1054439019 /nfs/dbraw/zinc/43/90/19/1054439019.db2.gz CUXQPUHIXANKMV-UHFFFAOYSA-N -1 1 304.777 4.038 20 0 DIADMM CC(C)(C)C[C@@H]([N-]C(=O)C(F)(F)C(F)F)c1ccc(F)cc1 ZINC001357334882 1054462776 /nfs/dbraw/zinc/46/27/76/1054462776.db2.gz ZDGQZFGFLREWAH-LLVKDONJSA-N -1 1 323.305 4.320 20 0 DIADMM CC[C@@H](C)C[C@@H](NCc1cc2cc(C)c(C)cc2o1)C(=O)[O-] ZINC000901675232 1054466925 /nfs/dbraw/zinc/46/69/25/1054466925.db2.gz MQEAGPLLRUYAJP-BDJLRTHQSA-N -1 1 303.402 4.029 20 0 DIADMM C[C@@H]1CCCC[C@H]1CCNC(=O)c1ccc2ccccc2c1[O-] ZINC001444069494 1054468460 /nfs/dbraw/zinc/46/84/60/1054468460.db2.gz PAGTVRPHXXTPJJ-CABCVRRESA-N -1 1 311.425 4.492 20 0 DIADMM O=C(Nc1ccc([O-])c(Cl)c1)c1ccc(Cl)cc1F ZINC000082193100 1054483426 /nfs/dbraw/zinc/48/34/26/1054483426.db2.gz LTZUGQHMBMYKSJ-UHFFFAOYSA-N -1 1 300.116 4.090 20 0 DIADMM C[C@@H](NC(=O)c1ccc2ccccc2c1[O-])[C@H](C)c1ccccc1 ZINC001445149812 1054497778 /nfs/dbraw/zinc/49/77/78/1054497778.db2.gz FCMRGTBWJXMPOC-LSDHHAIUSA-N -1 1 319.404 4.467 20 0 DIADMM CCCCCC(C)(C)CNC(=O)Cc1ccc([O-])c(Cl)c1 ZINC001445534593 1054509163 /nfs/dbraw/zinc/50/91/63/1054509163.db2.gz WIABKHXNECOISK-UHFFFAOYSA-N -1 1 311.853 4.311 20 0 DIADMM CCC[C@@H](NC(=O)c1cccc([O-])c1F)c1ccc(F)cc1F ZINC001446090709 1054526719 /nfs/dbraw/zinc/52/67/19/1054526719.db2.gz FRIMEPJENOUWLC-CQSZACIVSA-N -1 1 323.314 4.081 20 0 DIADMM C/C(=C\C(=O)Nc1ccc([O-])c(Cl)c1)c1ccccc1C ZINC001446467319 1054535283 /nfs/dbraw/zinc/53/52/83/1054535283.db2.gz LYNOZQJUWZDUQH-FMIVXFBMSA-N -1 1 301.773 4.396 20 0 DIADMM CC(C)(CC(=O)Nc1ccc([O-])c(Cl)c1)c1ccc(F)cc1 ZINC001446468436 1054536489 /nfs/dbraw/zinc/53/64/89/1054536489.db2.gz UDZAFISJAYHAJG-UHFFFAOYSA-N -1 1 321.779 4.491 20 0 DIADMM Cc1[nH]nc2ccc(-c3csc4ccc(C(=O)[O-])cc43)cc12 ZINC000623329318 1054560737 /nfs/dbraw/zinc/56/07/37/1054560737.db2.gz PEJYUASCMAKMQQ-UHFFFAOYSA-N -1 1 308.362 4.451 20 0 DIADMM CC[C@@H]1Cc2ccccc2CN1C(=O)c1cc(Cl)ccc1[O-] ZINC001447372286 1054562147 /nfs/dbraw/zinc/56/21/47/1054562147.db2.gz BQCLVRJBRUDZLL-OAHLLOKOSA-N -1 1 315.800 4.023 20 0 DIADMM C[C@H](NC(=O)c1ccc(F)c([O-])c1)c1cc2ccccc2s1 ZINC001447794113 1054574871 /nfs/dbraw/zinc/57/48/71/1054574871.db2.gz MBFUFGHCNAONFP-JTQLQIEISA-N -1 1 315.369 4.237 20 0 DIADMM CCSCc1ccc(NC(=O)c2cc(F)ccc2[O-])cc1 ZINC001449730700 1054627163 /nfs/dbraw/zinc/62/71/63/1054627163.db2.gz ISHKDNFVGHUDPM-UHFFFAOYSA-N -1 1 305.374 4.037 20 0 DIADMM CC(C)C[C@H](C(=O)[N-]OCCC1CC1)c1ccc(Cl)cc1 ZINC001450208272 1054640517 /nfs/dbraw/zinc/64/05/17/1054640517.db2.gz GCOGBBWMMLTPJH-INIZCTEOSA-N -1 1 309.837 4.318 20 0 DIADMM CC[C@@H]1CCCC[C@@H]1CNC(=O)c1cc2ccccc2cc1[O-] ZINC001450397592 1054648067 /nfs/dbraw/zinc/64/80/67/1054648067.db2.gz DUDNITQBXNUGLG-RHSMWYFYSA-N -1 1 311.425 4.492 20 0 DIADMM O=C(Nc1cc(F)cc(F)c1[O-])[C@@H]1CC[C@@H]2CCCC[C@@H]2C1 ZINC001451760565 1054687450 /nfs/dbraw/zinc/68/74/50/1054687450.db2.gz WKXOOTFOCNRDNP-QJPTWQEYSA-N -1 1 309.356 4.215 20 0 DIADMM C[C@H](NC(=O)c1ccc(C(F)(F)F)cc1[O-])C1CCCCC1 ZINC001452005907 1054693981 /nfs/dbraw/zinc/69/39/81/1054693981.db2.gz XKANCUZXAXZFMG-JTQLQIEISA-N -1 1 315.335 4.110 20 0 DIADMM CSc1ccc(Cl)c(NC(=O)c2ccc([O-])cc2F)c1 ZINC001453322437 1054732274 /nfs/dbraw/zinc/73/22/74/1054732274.db2.gz OBKPGXANWHKQKR-UHFFFAOYSA-N -1 1 311.765 4.159 20 0 DIADMM COc1ccc(C(=O)Nc2ccc(Cl)cc2C(C)C)c([O-])c1 ZINC001453677165 1054740914 /nfs/dbraw/zinc/74/09/14/1054740914.db2.gz RUBKQKSRZRRXTI-UHFFFAOYSA-N -1 1 319.788 4.430 20 0 DIADMM CC(C)[C@@H]1C[C@H]1C(=O)Nc1cc(Cl)c([O-])c2ccccc12 ZINC001453774220 1054747274 /nfs/dbraw/zinc/74/72/74/1054747274.db2.gz ZEYRTCPYXKKZRG-QWHCGFSZSA-N -1 1 303.789 4.429 20 0 DIADMM CC(C)(C)CCCCC(=O)Nc1ccc(-n2ccc(=O)[n-]2)cc1 ZINC001454279688 1054761522 /nfs/dbraw/zinc/76/15/22/1054761522.db2.gz BXYRMZRUSNBPNH-UHFFFAOYSA-N -1 1 315.417 4.123 20 0 DIADMM Cc1c2cc(Cl)ccc2oc1C(=O)Nc1cccc(F)c1[O-] ZINC001454752107 1054783892 /nfs/dbraw/zinc/78/38/92/1054783892.db2.gz CCLILPVARFOPLR-UHFFFAOYSA-N -1 1 319.719 4.492 20 0 DIADMM [O-]c1cccc(CNC2(c3c(F)cccc3F)CCC2)c1Cl ZINC000623844114 1054790180 /nfs/dbraw/zinc/79/01/80/1054790180.db2.gz GSLGBLGUCDIAKF-UHFFFAOYSA-N -1 1 323.770 4.493 20 0 DIADMM Cc1ccc(F)c(-c2nc(C(F)(F)F)nc3ccccc32)c1[O-] ZINC001236394426 1055091753 /nfs/dbraw/zinc/09/17/53/1055091753.db2.gz WAVFGRWFETXBMN-UHFFFAOYSA-N -1 1 322.261 4.469 20 0 DIADMM COc1cc2cnc(-c3c(F)ccc(C)c3[O-])cc2cc1F ZINC001236403062 1055095442 /nfs/dbraw/zinc/09/54/42/1055095442.db2.gz PIHZIBREJDXHEL-UHFFFAOYSA-N -1 1 301.292 4.203 20 0 DIADMM Cc1ccc(CN[C@@H](CC(=O)[O-])c2cccs2)c(Cl)c1 ZINC000404557240 1055118530 /nfs/dbraw/zinc/11/85/30/1055118530.db2.gz PILXIHBGYZDCHL-ZDUSSCGKSA-N -1 1 309.818 4.016 20 0 DIADMM Cc1ccc(CN[C@H](CC(=O)[O-])c2cccs2)c(Cl)c1 ZINC000404557234 1055118672 /nfs/dbraw/zinc/11/86/72/1055118672.db2.gz PILXIHBGYZDCHL-CYBMUJFWSA-N -1 1 309.818 4.016 20 0 DIADMM CC(C)N(Cc1ccccc1)Cc1cccc(C(=O)[O-])c1Cl ZINC000381795227 1055181297 /nfs/dbraw/zinc/18/12/97/1055181297.db2.gz BJWHUJXBNRBDSM-UHFFFAOYSA-N -1 1 317.816 4.449 20 0 DIADMM O=C(NCc1ccc2ccccc2c1)c1ccc(Cl)cc1[O-] ZINC001587161289 1055230901 /nfs/dbraw/zinc/23/09/01/1055230901.db2.gz ODAAXDADDMIPEN-UHFFFAOYSA-N -1 1 311.768 4.129 20 0 DIADMM O=C(Nc1cccc(F)c1[O-])c1cc2cc(F)ccc2s1 ZINC001587389902 1055284204 /nfs/dbraw/zinc/28/42/04/1055284204.db2.gz TZZDPTFCJQRCIA-UHFFFAOYSA-N -1 1 305.305 4.137 20 0 DIADMM O=c1[nH]c(Cl)c(C[N@H+]2CCCC[C@H]2c2ccccc2)s1 ZINC001237153329 1055385812 /nfs/dbraw/zinc/38/58/12/1055385812.db2.gz FDJANBXFIJEFBD-LBPRGKRZSA-N -1 1 308.834 4.229 20 0 DIADMM CCCCCC[C@@H](C)NC(=O)c1c([O-])cnc2c(F)cccc21 ZINC001587877489 1055386898 /nfs/dbraw/zinc/38/68/98/1055386898.db2.gz HBFIAOGWPXWOET-GFCCVEGCSA-N -1 1 318.392 4.168 20 0 DIADMM CCCCCC[C@H](C)NC(=O)c1ccc(C(F)(F)F)c([O-])c1 ZINC001587878141 1055387449 /nfs/dbraw/zinc/38/74/49/1055387449.db2.gz RJVXPBBGAKMQKM-NSHDSACASA-N -1 1 317.351 4.500 20 0 DIADMM C[C@H]1CCN(C(=O)c2cccc([O-])c2F)c2ccccc2S1 ZINC001587972877 1055407126 /nfs/dbraw/zinc/40/71/26/1055407126.db2.gz LUJDNPDDEJISGE-NSHDSACASA-N -1 1 317.385 4.062 20 0 DIADMM CC1(C)C[C@H](NC(=O)c2ccc(Cl)cc2[O-])c2ccccc21 ZINC001588297530 1055467357 /nfs/dbraw/zinc/46/73/57/1055467357.db2.gz YFQOFNOXJUQTFA-HNNXBMFYSA-N -1 1 315.800 4.198 20 0 DIADMM O=C(/C=C/C1CCCCCC1)NCc1ccc([O-])c(Cl)c1 ZINC001594565611 1055566243 /nfs/dbraw/zinc/56/62/43/1055566243.db2.gz MTOVAMHWAMOVIA-CSKARUKUSA-N -1 1 307.821 4.188 20 0 DIADMM Cc1nc2cc(NC(=O)c3cc4ccccc4cc3[O-])ccc2o1 ZINC000029796083 1055623036 /nfs/dbraw/zinc/62/30/36/1055623036.db2.gz ODSAHPFGCNIRDO-UHFFFAOYSA-N -1 1 318.332 4.247 20 0 DIADMM CC(C)(CNC(=O)c1cc2ccccc2cc1[O-])C1CCCC1 ZINC001596342869 1055699614 /nfs/dbraw/zinc/69/96/14/1055699614.db2.gz DQQJTFACJFXKLT-UHFFFAOYSA-N -1 1 311.425 4.492 20 0 DIADMM O=C(NCCCCC1CCCC1)c1ncc2ccccc2c1[O-] ZINC001566097293 1055742178 /nfs/dbraw/zinc/74/21/78/1055742178.db2.gz TUNOPGLKBBNCSX-UHFFFAOYSA-N -1 1 312.413 4.031 20 0 DIADMM Cc1cccc(Oc2ccc(NC(=O)c3ccc([O-])cn3)cc2)c1 ZINC001538878002 1055742468 /nfs/dbraw/zinc/74/24/68/1055742468.db2.gz GVPXHIAPMHRVEV-UHFFFAOYSA-N -1 1 320.348 4.140 20 0 DIADMM O=C(Nc1ccc([O-])c(Cl)c1)c1cc(Cl)nc(C2CC2)c1 ZINC001596819497 1055750579 /nfs/dbraw/zinc/75/05/79/1055750579.db2.gz HPGWVQSIEAEAFQ-UHFFFAOYSA-N -1 1 323.179 4.224 20 0 DIADMM CCc1ccc(C(C)(C)NC(=O)c2c([O-])cccc2Cl)cc1 ZINC001566215300 1055750707 /nfs/dbraw/zinc/75/07/07/1055750707.db2.gz HJZANKLTPJRILY-UHFFFAOYSA-N -1 1 317.816 4.273 20 0 DIADMM Cc1occ(C(F)(F)F)c1C(=O)Nc1ccc([O-])c(Cl)c1 ZINC001596819483 1055751582 /nfs/dbraw/zinc/75/15/82/1055751582.db2.gz HHOIXQOMOVRVSM-UHFFFAOYSA-N -1 1 319.666 4.218 20 0 DIADMM CCCCOc1cc(C=C2SC(=S)[N-]C2=O)ccc1OC ZINC000056678123 1055767951 /nfs/dbraw/zinc/76/79/51/1055767951.db2.gz UIFHTERXQAOVOW-UKTHLTGXSA-N -1 1 323.439 4.203 20 0 DIADMM Cc1ccc(F)c2oc(C(=O)Nc3ccc(Cl)cc3[O-])cc21 ZINC001567234810 1055795436 /nfs/dbraw/zinc/79/54/36/1055795436.db2.gz OCQNFAURWPVFNM-UHFFFAOYSA-N -1 1 319.719 4.492 20 0 DIADMM CCc1ccc(C(=O)Nc2nc3c(cccc3C)s2)c([O-])c1 ZINC001539164532 1055795694 /nfs/dbraw/zinc/79/56/94/1055795694.db2.gz SMJYDTKLQJTBMU-UHFFFAOYSA-N -1 1 312.394 4.125 20 0 DIADMM COc1ccc2[nH]c(NC(=O)c3ccc(C(C)C)cc3[O-])cc2c1 ZINC001567530854 1055806332 /nfs/dbraw/zinc/80/63/32/1055806332.db2.gz OQLNMHFOUQGWEW-UHFFFAOYSA-N -1 1 324.380 4.258 20 0 DIADMM CC(C)(C)c1ccc2c(c1)CCN2C(=O)c1ccc(F)c([O-])c1 ZINC001567870657 1055823557 /nfs/dbraw/zinc/82/35/57/1055823557.db2.gz HOQGSKMGDRJSOW-UHFFFAOYSA-N -1 1 313.372 4.032 20 0 DIADMM CC(C)c1ccc2nc(-c3cnc4ccccc4c3)[n-]c(=O)c2c1 ZINC000060797374 1055849997 /nfs/dbraw/zinc/84/99/97/1055849997.db2.gz JHHZASHHNWMRRW-UHFFFAOYSA-N -1 1 315.376 4.262 20 0 DIADMM O=C([O-])c1ccc(-c2ccc3[nH]c(C(F)(F)F)nc3c2)c(F)c1 ZINC001239257340 1055855361 /nfs/dbraw/zinc/85/53/61/1055855361.db2.gz ZKINKCZPVPAOEQ-UHFFFAOYSA-N -1 1 324.233 4.086 20 0 DIADMM CC(C)C1=NCCc2ccc(-c3ccc(C(=O)[O-])cc3F)cc21 ZINC001239267357 1055856226 /nfs/dbraw/zinc/85/62/26/1055856226.db2.gz UQFNQAHUIDRVNU-UHFFFAOYSA-N -1 1 311.356 4.192 20 0 DIADMM CC(C)C[C@@]1(C)CCCN1C(=O)Cc1ccc([O-])c(Cl)c1 ZINC001569418010 1055860541 /nfs/dbraw/zinc/86/05/41/1055860541.db2.gz MRJSSXIQSZHQKZ-QGZVFWFLSA-N -1 1 309.837 4.015 20 0 DIADMM C[C@@H](NC(=O)c1c([O-])cccc1Cl)c1cccc(C2CC2)c1 ZINC001569654993 1055868063 /nfs/dbraw/zinc/86/80/63/1055868063.db2.gz IGGZYKZENIBJPF-LLVKDONJSA-N -1 1 315.800 4.414 20 0 DIADMM CC[C@@H](NC(=O)c1cc(Cl)ccc1[O-])c1ccc(C)c(F)c1 ZINC001597775990 1055874044 /nfs/dbraw/zinc/87/40/44/1055874044.db2.gz BDAWOWHKCFQACK-OAHLLOKOSA-N -1 1 321.779 4.374 20 0 DIADMM C[C@H]1C[C@@H](C(C)(C)C)CCN1C(=O)Cc1ccc([O-])c(Cl)c1 ZINC001569936636 1055880579 /nfs/dbraw/zinc/88/05/79/1055880579.db2.gz VYAMYILSCRIJAZ-JSGCOSHPSA-N -1 1 323.864 4.261 20 0 DIADMM CC[C@H](C)[C@H](C(=O)Nc1cc([O-])c(F)cc1F)c1ccccc1 ZINC001570102208 1055887103 /nfs/dbraw/zinc/88/71/03/1055887103.db2.gz VKMQNUHJIOFSCQ-GTNSWQLSSA-N -1 1 319.351 4.439 20 0 DIADMM O=C(Nc1cc(F)cc(F)c1[O-])[C@@H]1CCC[C@H]2CCCC[C@@H]21 ZINC001570465947 1055903585 /nfs/dbraw/zinc/90/35/85/1055903585.db2.gz WLNWBIYFLUNCJM-KGYLQXTDSA-N -1 1 309.356 4.215 20 0 DIADMM O=C(Nc1cc(F)cc(F)c1[O-])[C@@H]1CCC[C@@H]2CCCC[C@@H]12 ZINC001570465946 1055904956 /nfs/dbraw/zinc/90/49/56/1055904956.db2.gz WLNWBIYFLUNCJM-CYZMBNFOSA-N -1 1 309.356 4.215 20 0 DIADMM CC1(C)C[C@H](c2ccccc2)N(C(=O)c2cc(F)ccc2[O-])C1 ZINC001570562091 1055907504 /nfs/dbraw/zinc/90/75/04/1055907504.db2.gz UJRPVXDYCRRYJF-MRXNPFEDSA-N -1 1 313.372 4.145 20 0 DIADMM Cc1ccc(NC(=O)Cc2ccc([O-])c(Cl)c2)c(Cl)c1C ZINC001570670662 1055912345 /nfs/dbraw/zinc/91/23/45/1055912345.db2.gz SXQDNSSYXKYOLC-UHFFFAOYSA-N -1 1 324.207 4.497 20 0 DIADMM O=C(N[C@H](C1CCC1)C1CCCCC1)c1ccc(F)c([O-])c1 ZINC001570664981 1055913430 /nfs/dbraw/zinc/91/34/30/1055913430.db2.gz FOLAGUOPLCBGKQ-KRWDZBQOSA-N -1 1 305.393 4.010 20 0 DIADMM CCC[C@H](C)c1cc(NC(=O)c2cc3ccccc3cc2[O-])n[nH]1 ZINC001570725210 1055914100 /nfs/dbraw/zinc/91/41/00/1055914100.db2.gz OLKWIZVIUSMPRP-LBPRGKRZSA-N -1 1 323.396 4.424 20 0 DIADMM O=C(Nc1cc(F)c([O-])cc1Cl)c1nsc2ccccc21 ZINC001598591025 1055958651 /nfs/dbraw/zinc/95/86/51/1055958651.db2.gz SWWVINVAOQMVMR-UHFFFAOYSA-N -1 1 322.748 4.047 20 0 DIADMM Cc1ccc(C(=O)Nc2cc(F)c([O-])cc2Cl)c(Cl)c1 ZINC001598591019 1055959269 /nfs/dbraw/zinc/95/92/69/1055959269.db2.gz SORVUFYUVYPPCA-UHFFFAOYSA-N -1 1 314.143 4.399 20 0 DIADMM O=C(c1cc2ccccc2cc1[O-])N1CC2C[C@@H]3CC1C[C@H](C2)C3 ZINC000065814905 1055963169 /nfs/dbraw/zinc/96/31/69/1055963169.db2.gz SIGNOUZDJQJDGR-FLOBVVSRSA-N -1 1 321.420 4.196 20 0 DIADMM O=C(Cc1ccc([O-])c(Cl)c1)N1CCC[C@H]1CC1CCCC1 ZINC001583184800 1056034645 /nfs/dbraw/zinc/03/46/45/1056034645.db2.gz OPGTUKLEQRWLJT-HNNXBMFYSA-N -1 1 321.848 4.159 20 0 DIADMM CC[C@@H](NC(=O)Cc1ccc([O-])c(Cl)c1)C1CCCCC1 ZINC001607365010 1056048323 /nfs/dbraw/zinc/04/83/23/1056048323.db2.gz KLXBIUGMXOCPBK-OAHLLOKOSA-N -1 1 309.837 4.063 20 0 DIADMM Cc1ccc(SCC(=O)Nc2ccc([O-])c(Cl)c2)cc1 ZINC000111668432 1056057841 /nfs/dbraw/zinc/05/78/41/1056057841.db2.gz GMTOXKXGKPVJKR-UHFFFAOYSA-N -1 1 307.802 4.085 20 0 DIADMM C[C@H](CSc1ccccc1)C(=O)Nc1ccc([O-])c(Cl)c1 ZINC000111667564 1056058606 /nfs/dbraw/zinc/05/86/06/1056058606.db2.gz QRYYUSKFIPGPQI-LLVKDONJSA-N -1 1 321.829 4.413 20 0 DIADMM CCCOc1ccccc1NC(=O)Cc1ccc([O-])c(Cl)c1 ZINC001540679765 1056059862 /nfs/dbraw/zinc/05/98/62/1056059862.db2.gz JSCQMQPGPZGZNV-UHFFFAOYSA-N -1 1 319.788 4.016 20 0 DIADMM CCC(C)(C)C1CCC(NC(=O)c2ccc([O-])c(F)c2)CC1 ZINC001540731464 1056069453 /nfs/dbraw/zinc/06/94/53/1056069453.db2.gz MLBDSLRYVDJWGT-UHFFFAOYSA-N -1 1 307.409 4.256 20 0 DIADMM O=C(Nc1ccc(-c2ccccc2)cc1F)c1ccccc1[O-] ZINC001540822841 1056082632 /nfs/dbraw/zinc/08/26/32/1056082632.db2.gz NGLZSAGPZHMQNC-UHFFFAOYSA-N -1 1 307.324 4.451 20 0 DIADMM O=C(/C=C/c1ccc2[nH]ccc2c1)Nc1ccc([O-])c(Cl)c1 ZINC000765799412 1056093972 /nfs/dbraw/zinc/09/39/72/1056093972.db2.gz XLMBITXAXWMVBW-QHHAFSJGSA-N -1 1 312.756 4.179 20 0 DIADMM Cc1cc(C)cc([C@H](C)NC(=O)c2ncc3ccccc3c2[O-])c1 ZINC001543103731 1056177612 /nfs/dbraw/zinc/17/76/12/1056177612.db2.gz HWLBOIXVFHMQSC-AWEZNQCLSA-N -1 1 320.392 4.048 20 0 DIADMM CN(C(=O)c1ccc(Cl)cc1[O-])C(C)(C)c1ccccc1 ZINC000671893489 1056218461 /nfs/dbraw/zinc/21/84/61/1056218461.db2.gz HFTSJAGLPGNMKA-UHFFFAOYSA-N -1 1 303.789 4.053 20 0 DIADMM CC(C)[C@H](CNC(=O)c1ccc(Cl)cc1[O-])c1ccccc1 ZINC001543565139 1056253418 /nfs/dbraw/zinc/25/34/18/1056253418.db2.gz GBSBSRBNHLHVLI-INIZCTEOSA-N -1 1 317.816 4.215 20 0 DIADMM O=c1nc(Cl)cc(Oc2ccc(SC(F)(F)F)cc2)[n-]1 ZINC001612362504 1056276739 /nfs/dbraw/zinc/27/67/39/1056276739.db2.gz SALXUMHMMCLMTG-UHFFFAOYSA-N -1 1 322.695 4.240 20 0 DIADMM Cc1ccc2c(c1)CC[C@@H]2NC(=O)c1cc2ccccc2cc1[O-] ZINC001543738201 1056289225 /nfs/dbraw/zinc/28/92/25/1056289225.db2.gz UPEPXEIOACFYEX-IBGZPJMESA-N -1 1 317.388 4.271 20 0 DIADMM CCCN(C(=O)c1ccc([O-])cn1)[C@@H](C)c1cc2ccccc2o1 ZINC001543809588 1056303007 /nfs/dbraw/zinc/30/30/07/1056303007.db2.gz NWOQNWHFKCUCBJ-ZDUSSCGKSA-N -1 1 324.380 4.147 20 0 DIADMM CC(C)c1cnc(NC(=O)c2ccc3ccccc3c2[O-])s1 ZINC001543968620 1056334372 /nfs/dbraw/zinc/33/43/72/1056334372.db2.gz FZFXMNXEENLMLX-UHFFFAOYSA-N -1 1 312.394 4.378 20 0 DIADMM CC(C)(C)C[C@@H](NC(=O)c1cccc([O-])c1F)c1ccccc1 ZINC001544013716 1056344061 /nfs/dbraw/zinc/34/40/61/1056344061.db2.gz PFFUHZBUOOLALQ-OAHLLOKOSA-N -1 1 315.388 4.439 20 0 DIADMM Cc1ccc(NC(=O)c2cc(Br)ccc2[O-])cc1C ZINC000011639321 1056361227 /nfs/dbraw/zinc/36/12/27/1056361227.db2.gz VSICYXGCUIFZRB-UHFFFAOYSA-N -1 1 320.186 4.024 20 0 DIADMM CSc1cc(F)ccc1[N-]C(=O)c1c(C)noc1C(F)F ZINC001584637201 1056386633 /nfs/dbraw/zinc/38/66/33/1056386633.db2.gz ASKYXOFLDBJCBT-UHFFFAOYSA-N -1 1 316.304 4.034 20 0 DIADMM Cc1noc(C(C)C)c1[N-]C(=O)c1cc(-c2ccccc2)on1 ZINC001584754873 1056410066 /nfs/dbraw/zinc/41/00/66/1056410066.db2.gz HYLCXRLSSWLTQK-UHFFFAOYSA-N -1 1 311.341 4.014 20 0 DIADMM O=C(Nc1ccc(SC(F)(F)F)cc1)c1ccccc1[O-] ZINC001544369933 1056414917 /nfs/dbraw/zinc/41/49/17/1056414917.db2.gz AEMJVBMFJKIISI-UHFFFAOYSA-N -1 1 313.300 4.256 20 0 DIADMM CCOC(=O)c1nc2cc(-c3ccc4ncsc4c3)ccc2[n-]1 ZINC001240344909 1056438887 /nfs/dbraw/zinc/43/88/87/1056438887.db2.gz GTBJRKSMFCYCES-UHFFFAOYSA-N -1 1 323.377 4.016 20 0 DIADMM CCOC(=O)c1nc2ccc(-c3ccc4ncsc4c3)cc2[n-]1 ZINC001240344909 1056438897 /nfs/dbraw/zinc/43/88/97/1056438897.db2.gz GTBJRKSMFCYCES-UHFFFAOYSA-N -1 1 323.377 4.016 20 0 DIADMM Cc1nc(C)c(C(=O)Nc2cc(Cl)c([O-])c3ccccc23)o1 ZINC001585192990 1056504808 /nfs/dbraw/zinc/50/48/08/1056504808.db2.gz HCYAKQBXLVHJFC-UHFFFAOYSA-N -1 1 316.744 4.056 20 0 DIADMM CCSc1cccc(F)c1[N-]C(=O)c1csc(C(C)=O)c1 ZINC001544920814 1056528330 /nfs/dbraw/zinc/52/83/30/1056528330.db2.gz RICVCCPVUSBIJN-UHFFFAOYSA-N -1 1 323.414 4.454 20 0 DIADMM Cc1cc(C)cc(N(C)C(=O)c2ccc3ccc(O)cc3c2[O-])c1 ZINC001544942723 1056533475 /nfs/dbraw/zinc/53/34/75/1056533475.db2.gz WPCOULYCBKCMTE-UHFFFAOYSA-N -1 1 321.376 4.144 20 0 DIADMM [O-]c1c(F)cc(Nc2ncc(C(F)(F)F)cc2F)cc1Cl ZINC001214480421 1056545278 /nfs/dbraw/zinc/54/52/78/1056545278.db2.gz PYEVBELBEWOPJE-UHFFFAOYSA-N -1 1 324.636 4.481 20 0 DIADMM Cc1nc2sccc2c(Nc2cc(F)c([O-])c(Cl)c2)n1 ZINC001214480156 1056545736 /nfs/dbraw/zinc/54/57/36/1056545736.db2.gz MRJFSQMWGNNWEJ-UHFFFAOYSA-N -1 1 309.753 4.241 20 0 DIADMM CC[C@@H](C)c1ccc(S(=O)(=O)[N-]c2cccc(OC)c2)cc1 ZINC000007052967 1056566758 /nfs/dbraw/zinc/56/67/58/1056566758.db2.gz WJPQZNXEJQUKDM-CYBMUJFWSA-N -1 1 319.426 4.010 20 0 DIADMM O=S(=O)([N-]c1cccc2ccccc21)c1cccc(Cl)c1 ZINC000007053572 1056566883 /nfs/dbraw/zinc/56/68/83/1056566883.db2.gz OPUGASZPKUCXCT-UHFFFAOYSA-N -1 1 317.797 4.294 20 0 DIADMM CC[C@H](C)c1ccc(S(=O)(=O)[N-]c2cccc(OC)c2)cc1 ZINC000007052968 1056566907 /nfs/dbraw/zinc/56/69/07/1056566907.db2.gz WJPQZNXEJQUKDM-ZDUSSCGKSA-N -1 1 319.426 4.010 20 0 DIADMM C[C@@H]1CC[C@@H](c2ccccc2)N(C(=O)c2ccc([O-])c(F)c2)C1 ZINC000672228013 1056573746 /nfs/dbraw/zinc/57/37/46/1056573746.db2.gz OSQPHPOKHOTOGR-DYVFJYSZSA-N -1 1 313.372 4.145 20 0 DIADMM Cc1cc(Cl)ccc1[N-]S(=O)(=O)c1cccc(Cl)c1 ZINC000007402722 1056579182 /nfs/dbraw/zinc/57/91/82/1056579182.db2.gz HEXIZQBNELKGSW-UHFFFAOYSA-N -1 1 316.209 4.103 20 0 DIADMM CC[C@@H]1CCCN(C(=O)c2ccc(C(F)(F)F)c([O-])c2)CC1 ZINC001585899202 1056637631 /nfs/dbraw/zinc/63/76/31/1056637631.db2.gz RMGAWTHFAOZPBT-LLVKDONJSA-N -1 1 315.335 4.063 20 0 DIADMM [O-]c1ccc(F)cc1-c1ncnc2scc(-c3ccco3)c21 ZINC001240696068 1056647269 /nfs/dbraw/zinc/64/72/69/1056647269.db2.gz YHMGSTVEHGYJAK-UHFFFAOYSA-N -1 1 312.325 4.463 20 0 DIADMM [O-]c1ccc(F)cc1-c1ncccc1OCc1ccc(F)cc1 ZINC001240695587 1056647452 /nfs/dbraw/zinc/64/74/52/1056647452.db2.gz NIFBFSLSHXDWCQ-UHFFFAOYSA-N -1 1 313.303 4.311 20 0 DIADMM [O-]c1ccc(F)cc1-c1nc(-c2cccnc2)nc2ccccc21 ZINC001240696030 1056647469 /nfs/dbraw/zinc/64/74/69/1056647469.db2.gz WTVJVHIYPSRLCV-UHFFFAOYSA-N -1 1 317.323 4.204 20 0 DIADMM Cc1nc2sc3c(c2c(-c2cc(F)ccc2[O-])n1)CCCC3 ZINC001240695378 1056647786 /nfs/dbraw/zinc/64/77/86/1056647786.db2.gz IRMCHUIUQLOKGJ-UHFFFAOYSA-N -1 1 314.385 4.390 20 0 DIADMM Cc1c(CNC(=O)c2cc(Cl)ccc2[O-])oc2ccccc12 ZINC001586076605 1056667893 /nfs/dbraw/zinc/66/78/93/1056667893.db2.gz KJJNSAWQQIRKJU-UHFFFAOYSA-N -1 1 315.756 4.030 20 0 DIADMM Cc1nccn1-c1ccc(Nc2cc(F)c([O-])c(Cl)c2)cc1 ZINC001214488961 1056675253 /nfs/dbraw/zinc/67/52/53/1056675253.db2.gz RFHIMBHCQXQNQG-UHFFFAOYSA-N -1 1 317.751 4.422 20 0 DIADMM [O-]c1c(Nc2cc(F)c(OC(F)F)c(F)c2)ccc(F)c1F ZINC001212454162 1056681927 /nfs/dbraw/zinc/68/19/27/1056681927.db2.gz DTNCZRVXOVKHME-UHFFFAOYSA-N -1 1 323.192 4.294 20 0 DIADMM [O-]c1ccc(-c2nc3ccccc3nc2N2CCCCC2)cc1F ZINC001240782919 1056695422 /nfs/dbraw/zinc/69/54/22/1056695422.db2.gz KTSFCHMDFQFZQI-UHFFFAOYSA-N -1 1 323.371 4.132 20 0 DIADMM [O-]c1ccc(-c2ncnc3cc(C(F)(F)F)ccc32)cc1F ZINC001240782876 1056695774 /nfs/dbraw/zinc/69/57/74/1056695774.db2.gz HVWRTYCJXMVMIM-UHFFFAOYSA-N -1 1 308.234 4.160 20 0 DIADMM C[C@H]1CCc2c(sc3ncnc(-c4ccc([O-])c(F)c4)c23)C1 ZINC001240782199 1056696205 /nfs/dbraw/zinc/69/62/05/1056696205.db2.gz UGUMNZWDKWCLRY-VIFPVBQESA-N -1 1 314.385 4.328 20 0 DIADMM CC(C)[C@@H]1CCC[C@H](NC(=O)c2cc3ccccc3cc2[O-])C1 ZINC001616662381 1056697240 /nfs/dbraw/zinc/69/72/40/1056697240.db2.gz VWHSMYLSJHLRPG-PBHICJAKSA-N -1 1 311.425 4.490 20 0 DIADMM [O-]c1ccc(-c2ncnc3scc(-c4ccco4)c32)cc1F ZINC001240783929 1056697374 /nfs/dbraw/zinc/69/73/74/1056697374.db2.gz ZSZWZVPCHOSQKA-UHFFFAOYSA-N -1 1 312.325 4.463 20 0 DIADMM O=c1ccc2cc(Nc3cc(F)c([O-])c(Cl)c3)ccc2o1 ZINC001214494357 1056729069 /nfs/dbraw/zinc/72/90/69/1056729069.db2.gz OEIOIZMBPQRWLR-UHFFFAOYSA-N -1 1 305.692 4.035 20 0 DIADMM COC(=O)c1cc(C)c(C)c(Nc2cc(F)c([O-])c(Cl)c2)c1 ZINC001214494358 1056729732 /nfs/dbraw/zinc/72/97/32/1056729732.db2.gz OENJUTPMKCRNHY-UHFFFAOYSA-N -1 1 323.751 4.332 20 0 DIADMM O=[P@@]([O-])(O)c1ccc(-c2cccc3c4ccccc4oc32)cc1 ZINC001240890677 1056743797 /nfs/dbraw/zinc/74/37/97/1056743797.db2.gz KVOBZCXZALYARB-UHFFFAOYSA-N -1 1 324.272 4.056 20 0 DIADMM O=[P@]([O-])(O)c1ccc(-c2cccc3c4ccccc4oc32)cc1 ZINC001240890677 1056743805 /nfs/dbraw/zinc/74/38/05/1056743805.db2.gz KVOBZCXZALYARB-UHFFFAOYSA-N -1 1 324.272 4.056 20 0 DIADMM CCC(CC)[C@@H](NC(=O)c1c([O-])cccc1F)c1ccccc1 ZINC001586620487 1056768038 /nfs/dbraw/zinc/76/80/38/1056768038.db2.gz XYZABQGIYMTLIS-GOSISDBHSA-N -1 1 315.388 4.439 20 0 DIADMM Cc1ccc(C(=O)[O-])cc1-c1ccc2nc(C(F)(F)F)[nH]c2c1 ZINC001241000972 1056806382 /nfs/dbraw/zinc/80/63/82/1056806382.db2.gz PKGPJOUZTKGCJW-UHFFFAOYSA-N -1 1 320.270 4.255 20 0 DIADMM CC(C)[C@H](NC(=O)c1ccc([O-])cc1F)c1ccccc1Cl ZINC001617416955 1056828849 /nfs/dbraw/zinc/82/88/49/1056828849.db2.gz RKQLXTIOIZSTNL-INIZCTEOSA-N -1 1 321.779 4.312 20 0 DIADMM Cc1ccc(-c2nccc(-c3cn(C)c4ccccc34)n2)c([O-])c1 ZINC001241030117 1056830464 /nfs/dbraw/zinc/83/04/64/1056830464.db2.gz FJGLELHLUHWHLY-UHFFFAOYSA-N -1 1 315.376 4.316 20 0 DIADMM COc1c(F)ccc(Nc2cc([O-])c(Cl)cc2F)c1F ZINC001212500872 1056875976 /nfs/dbraw/zinc/87/59/76/1056875976.db2.gz AVGGCKOXPIHGPU-UHFFFAOYSA-N -1 1 303.667 4.215 20 0 DIADMM O=C(c1cc(Cl)ccc1[O-])N1CCCCC[C@@H]1c1ccco1 ZINC001617913356 1056900785 /nfs/dbraw/zinc/90/07/85/1056900785.db2.gz MXYWZNHKYHHXMF-CQSZACIVSA-N -1 1 319.788 4.396 20 0 DIADMM [O-]c1cc(F)c(-c2ccc3c(C(F)(F)F)c[nH]c3n2)c(F)c1 ZINC001241118081 1056904636 /nfs/dbraw/zinc/90/46/36/1056904636.db2.gz GMPPTJRENNVVOW-UHFFFAOYSA-N -1 1 314.213 4.233 20 0 DIADMM COc1nc(-c2c(F)cc([O-])cc2F)cc2cc(F)ccc21 ZINC001241118370 1056905373 /nfs/dbraw/zinc/90/53/73/1056905373.db2.gz DFPNYCXHFAOSAQ-UHFFFAOYSA-N -1 1 305.255 4.033 20 0 DIADMM Cc1ccc(C)c(-c2ccc(-c3c(F)cc([O-])cc3F)nn2)c1 ZINC001241119043 1056905534 /nfs/dbraw/zinc/90/55/34/1056905534.db2.gz DDWAEBUANIGRGG-UHFFFAOYSA-N -1 1 312.319 4.411 20 0 DIADMM CC(C)(C)OC(=O)Nc1cc(-c2c(F)cc([O-])cc2F)ccn1 ZINC001241121037 1056907511 /nfs/dbraw/zinc/90/75/11/1056907511.db2.gz ZCBCHXKSDYEZGA-UHFFFAOYSA-N -1 1 322.311 4.079 20 0 DIADMM O=C([O-])c1ccc(-c2cccc3nc(C(F)(F)F)[nH]c32)cc1F ZINC001241186512 1056951349 /nfs/dbraw/zinc/95/13/49/1056951349.db2.gz BAALPEMVJLOOLZ-UHFFFAOYSA-N -1 1 324.233 4.086 20 0 DIADMM Cc1nc(-c2cc([O-])cc(F)c2)nc(C)c1Cc1ccccc1 ZINC001241260969 1056984900 /nfs/dbraw/zinc/98/49/00/1056984900.db2.gz DMIGMWHQPKGJPO-UHFFFAOYSA-N -1 1 308.356 4.196 20 0 DIADMM [O-]c1cc(F)cc(-c2ncc(F)c(Oc3ccc(F)cc3)n2)c1 ZINC001241262027 1056985380 /nfs/dbraw/zinc/98/53/80/1056985380.db2.gz VDGWHPPMMDLMBA-UHFFFAOYSA-N -1 1 318.254 4.059 20 0 DIADMM [O-]c1ccc(F)c(-c2ncnc3c2ccn3C2CCCC2)c1F ZINC001241289608 1056998730 /nfs/dbraw/zinc/99/87/30/1056998730.db2.gz WJIAZUFVYVXPCM-UHFFFAOYSA-N -1 1 315.323 4.197 20 0 DIADMM [O-]c1ccc(F)c(-c2ccc(-c3c(F)cccc3F)nn2)c1F ZINC001241290821 1057000384 /nfs/dbraw/zinc/00/03/84/1057000384.db2.gz UQDUQCORJFUARN-UHFFFAOYSA-N -1 1 320.245 4.073 20 0 DIADMM O=S(=O)([N-]c1ccc(C2CC2)cc1)c1ccc(C(F)F)cc1 ZINC000673480418 1057004485 /nfs/dbraw/zinc/00/44/85/1057004485.db2.gz MLNLZNQYDAEJNF-UHFFFAOYSA-N -1 1 323.364 4.302 20 0 DIADMM Cc1cccc2nc(-c3cccc(-c4cscn4)c3)[n-]c(=O)c12 ZINC000481545482 1057024081 /nfs/dbraw/zinc/02/40/81/1057024081.db2.gz JFJBQWJBLIRKBT-UHFFFAOYSA-N -1 1 319.389 4.434 20 0 DIADMM COc1cccc([O-])c1C(=O)Nc1ccc(CCC(C)C)cc1 ZINC001626086369 1057062538 /nfs/dbraw/zinc/06/25/38/1057062538.db2.gz ZXNLDSLCICDFLA-UHFFFAOYSA-N -1 1 313.397 4.242 20 0 DIADMM CCOC(=O)c1nc2cc(-c3ccc4scnc4c3)ccc2[n-]1 ZINC001241869469 1057196736 /nfs/dbraw/zinc/19/67/36/1057196736.db2.gz LEHQWTIJODEUPT-UHFFFAOYSA-N -1 1 323.377 4.016 20 0 DIADMM CCOC(=O)c1nc2ccc(-c3ccc4scnc4c3)cc2[n-]1 ZINC001241869469 1057196739 /nfs/dbraw/zinc/19/67/39/1057196739.db2.gz LEHQWTIJODEUPT-UHFFFAOYSA-N -1 1 323.377 4.016 20 0 DIADMM CCOC(=O)c1nc2cc(-c3cccc([C@H](C)OC)c3)ccc2[n-]1 ZINC001242042127 1057248231 /nfs/dbraw/zinc/24/82/31/1057248231.db2.gz YTFTTZHMSCGUSB-LBPRGKRZSA-N -1 1 324.380 4.114 20 0 DIADMM CCOC(=O)c1nc2ccc(-c3cccc([C@H](C)OC)c3)cc2[n-]1 ZINC001242042127 1057248233 /nfs/dbraw/zinc/24/82/33/1057248233.db2.gz YTFTTZHMSCGUSB-LBPRGKRZSA-N -1 1 324.380 4.114 20 0 DIADMM Cc1nc2sccc2c(-c2cc(C(F)(F)F)ccc2[O-])n1 ZINC001242126153 1057271243 /nfs/dbraw/zinc/27/12/43/1057271243.db2.gz HJRUWAUUBAOBHT-UHFFFAOYSA-N -1 1 310.300 4.391 20 0 DIADMM Cc1csc2ncnc(-c3cc(C(F)(F)F)ccc3[O-])c12 ZINC001242126647 1057271506 /nfs/dbraw/zinc/27/15/06/1057271506.db2.gz PPVJYROEIDODNJ-UHFFFAOYSA-N -1 1 310.300 4.391 20 0 DIADMM Cc1ccc2ncnc(-c3cc(C(F)(F)F)ccc3[O-])c2c1 ZINC001242131284 1057273452 /nfs/dbraw/zinc/27/34/52/1057273452.db2.gz GRCPPWKDBIXCLT-UHFFFAOYSA-N -1 1 304.271 4.330 20 0 DIADMM [O-]c1ccc(C(F)(F)F)cc1-c1cccc(OC(F)F)n1 ZINC001242131077 1057273833 /nfs/dbraw/zinc/27/38/33/1057273833.db2.gz AHXZZALNESRUHS-UHFFFAOYSA-N -1 1 305.202 4.074 20 0 DIADMM [O-]c1ccc(C(F)(F)F)cc1-c1nncc2ccc(F)cc21 ZINC001242131882 1057274409 /nfs/dbraw/zinc/27/44/09/1057274409.db2.gz LACOFMVOTKLLBU-UHFFFAOYSA-N -1 1 308.234 4.160 20 0 DIADMM CC(C)c1nc2[nH]ccc2c(-c2cc(C(F)(F)F)ccc2[O-])n1 ZINC001242134306 1057274888 /nfs/dbraw/zinc/27/48/88/1057274888.db2.gz XZGCGUCNTJOHIB-UHFFFAOYSA-N -1 1 321.302 4.424 20 0 DIADMM Cc1cccc2ncnc(-c3cc(C(F)(F)F)ccc3[O-])c12 ZINC001242131815 1057274933 /nfs/dbraw/zinc/27/49/33/1057274933.db2.gz RHMYBDIJXJAEEM-UHFFFAOYSA-N -1 1 304.271 4.330 20 0 DIADMM Cc1ccc(-c2ccc(-c3cc(C(F)(F)F)ccc3[O-])nn2)o1 ZINC001242134255 1057275008 /nfs/dbraw/zinc/27/50/08/1057275008.db2.gz VNBGBWJDBZQEOX-UHFFFAOYSA-N -1 1 320.270 4.436 20 0 DIADMM Cc1cc(-c2ccc([O-])c(C(F)(F)F)c2)nc(C(F)(F)F)n1 ZINC001242148050 1057279848 /nfs/dbraw/zinc/27/98/48/1057279848.db2.gz KJQOQSHUOMJCTB-UHFFFAOYSA-N -1 1 322.208 4.195 20 0 DIADMM Cc1nc2cc(F)ccc2c(-c2ccc([O-])c(C(F)(F)F)c2)n1 ZINC001242151191 1057280836 /nfs/dbraw/zinc/28/08/36/1057280836.db2.gz HEEFBGLYFUTWCF-UHFFFAOYSA-N -1 1 322.261 4.469 20 0 DIADMM CC(C)(C)Oc1ccnc(-c2ccc([O-])c(C(F)(F)F)c2)n1 ZINC001242151465 1057280846 /nfs/dbraw/zinc/28/08/46/1057280846.db2.gz OZEOQVHQFXJHCF-UHFFFAOYSA-N -1 1 312.291 4.045 20 0 DIADMM [O-]c1ccc(-c2ccc3ncc(F)cc3n2)cc1C(F)(F)F ZINC001242152632 1057281667 /nfs/dbraw/zinc/28/16/67/1057281667.db2.gz HUMSFIXSHYWWAL-UHFFFAOYSA-N -1 1 308.234 4.160 20 0 DIADMM Cc1cc(C(F)(F)F)c(-c2ccc([O-])c(C(F)(F)F)c2)nn1 ZINC001242153460 1057281898 /nfs/dbraw/zinc/28/18/98/1057281898.db2.gz XZTYFAQCAPIVPD-UHFFFAOYSA-N -1 1 322.208 4.195 20 0 DIADMM CC(C)Sc1ccc(-c2ccc([O-])c(C(F)(F)F)c2)nn1 ZINC001242157558 1057283824 /nfs/dbraw/zinc/28/38/24/1057283824.db2.gz IJGDQHVHEICRGE-UHFFFAOYSA-N -1 1 314.332 4.369 20 0 DIADMM Cc1cc2cccnc2c(-c2ccc([O-])c(C(F)(F)F)c2)n1 ZINC001242158144 1057283898 /nfs/dbraw/zinc/28/38/98/1057283898.db2.gz TVXAFPZIKKPMSI-UHFFFAOYSA-N -1 1 304.271 4.330 20 0 DIADMM [O-]c1ccc(-c2cccnc2OC(F)F)cc1C(F)(F)F ZINC001242168817 1057285614 /nfs/dbraw/zinc/28/56/14/1057285614.db2.gz UUWHJKUYOVXOLH-UHFFFAOYSA-N -1 1 305.202 4.074 20 0 DIADMM [O-]c1cc(F)ccc1-c1ccc(OC(F)(F)F)c(F)c1F ZINC001242221996 1057298694 /nfs/dbraw/zinc/29/86/94/1057298694.db2.gz ZMOLKNDRZONVQK-UHFFFAOYSA-N -1 1 308.177 4.375 20 0 DIADMM COC(=O)c1nc2ccc(-c3cc(Cl)cc(C)c3F)cc2[n-]1 ZINC001242225692 1057300510 /nfs/dbraw/zinc/30/05/10/1057300510.db2.gz FVZCCKFGXIKGLF-UHFFFAOYSA-N -1 1 318.735 4.117 20 0 DIADMM COC(=O)c1nc2cc(-c3cc(Cl)cc(C)c3F)ccc2[n-]1 ZINC001242225692 1057300515 /nfs/dbraw/zinc/30/05/15/1057300515.db2.gz FVZCCKFGXIKGLF-UHFFFAOYSA-N -1 1 318.735 4.117 20 0 DIADMM CCOc1cc([N-]c2nc(C(C)(C)C)ns2)c(F)cc1F ZINC001212528844 1057314162 /nfs/dbraw/zinc/31/41/62/1057314162.db2.gz RGVCMNWCEJZBIU-UHFFFAOYSA-N -1 1 313.373 4.256 20 0 DIADMM [O-]c1c(Cl)cccc1-c1ccc(-c2c[nH]c(=S)[nH]2)cc1 ZINC001242364115 1057346166 /nfs/dbraw/zinc/34/61/66/1057346166.db2.gz CKKNITOLJXTJNZ-UHFFFAOYSA-N -1 1 302.786 4.391 20 0 DIADMM Cc1cc(N2CCCCC2)ncc1-c1cccc(Cl)c1[O-] ZINC001242364151 1057346386 /nfs/dbraw/zinc/34/63/86/1057346386.db2.gz FAQBJLRCGNDFCT-UHFFFAOYSA-N -1 1 302.805 4.406 20 0 DIADMM O=C(c1cccc(-c2cccc(Cl)c2[O-])c1)N1CCCCC1 ZINC001242366329 1057347086 /nfs/dbraw/zinc/34/70/86/1057347086.db2.gz KFDHCLHFMGHHIL-UHFFFAOYSA-N -1 1 315.800 4.339 20 0 DIADMM CCOC(=O)CCc1ccc(-c2cccc(Cl)c2[O-])c(F)c1 ZINC001242365377 1057347662 /nfs/dbraw/zinc/34/76/62/1057347662.db2.gz BNKDPAAAVGCKEI-UHFFFAOYSA-N -1 1 322.763 4.347 20 0 DIADMM COc1cc(C(F)(F)F)c(-c2cccc(Cl)c2[O-])cn1 ZINC001242367780 1057348378 /nfs/dbraw/zinc/34/83/78/1057348378.db2.gz SPIIQQVPTQSLOT-UHFFFAOYSA-N -1 1 303.667 4.135 20 0 DIADMM COC(=O)c1cc(-c2cccc(Cl)c2[O-])c2cc[nH]c2c1C ZINC001242368023 1057348641 /nfs/dbraw/zinc/34/86/41/1057348641.db2.gz UAWDYKBVMRHAMT-UHFFFAOYSA-N -1 1 315.756 4.289 20 0 DIADMM [O-]c1c(Cl)cccc1-c1ccc(OCc2cccnc2)nc1 ZINC001242368146 1057348659 /nfs/dbraw/zinc/34/86/59/1057348659.db2.gz YVOWSCWZHMLCEU-UHFFFAOYSA-N -1 1 312.756 4.082 20 0 DIADMM CNC(=O)c1ccc2cc(-c3cccc(Cl)c3[O-])ccc2c1 ZINC001242367746 1057349035 /nfs/dbraw/zinc/34/90/35/1057349035.db2.gz RDOKUOGUGMQQAD-UHFFFAOYSA-N -1 1 311.768 4.225 20 0 DIADMM COc1cc(-c2cccc(Cl)c2[O-])ccc1OC(F)F ZINC001242366609 1057349220 /nfs/dbraw/zinc/34/92/20/1057349220.db2.gz BHCPLXMBZZEBSE-UHFFFAOYSA-N -1 1 300.688 4.323 20 0 DIADMM CCOc1cc(Nc2cc([O-])c(Cl)cc2F)ccc1OC ZINC001212542386 1057351717 /nfs/dbraw/zinc/35/17/17/1057351717.db2.gz KEPLVUPWWRGRAO-UHFFFAOYSA-N -1 1 311.740 4.336 20 0 DIADMM Cc1cc(-c2ccc([C@H](C)[N-]C(=O)C(F)(F)F)cc2)c(C)o1 ZINC001242406744 1057360215 /nfs/dbraw/zinc/36/02/15/1057360215.db2.gz CAFLMOJUCOVLHB-JTQLQIEISA-N -1 1 311.303 4.303 20 0 DIADMM CCOC(=O)c1nc2cc(-c3cc(C)cc(Cl)c3)ccc2[n-]1 ZINC001242519859 1057392982 /nfs/dbraw/zinc/39/29/82/1057392982.db2.gz HJJXCWXVAGGULR-UHFFFAOYSA-N -1 1 314.772 4.368 20 0 DIADMM CCOC(=O)c1nc2ccc(-c3cc(C)cc(Cl)c3)cc2[n-]1 ZINC001242519859 1057392985 /nfs/dbraw/zinc/39/29/85/1057392985.db2.gz HJJXCWXVAGGULR-UHFFFAOYSA-N -1 1 314.772 4.368 20 0 DIADMM COC(=O)c1cc(-c2cccc([O-])c2Cl)nc(C(C)(C)C)c1 ZINC001242799489 1057480713 /nfs/dbraw/zinc/48/07/13/1057480713.db2.gz NTIXCURNPBZXOS-UHFFFAOYSA-N -1 1 319.788 4.192 20 0 DIADMM [O-]c1cccc(-c2ccc(OCc3ccncc3)nc2)c1Cl ZINC001242801573 1057481832 /nfs/dbraw/zinc/48/18/32/1057481832.db2.gz ARSRBGROQLKFGF-UHFFFAOYSA-N -1 1 312.756 4.082 20 0 DIADMM CNC(=O)c1ccc2cc(-c3cccc([O-])c3Cl)ccc2c1 ZINC001242801222 1057481850 /nfs/dbraw/zinc/48/18/50/1057481850.db2.gz UTELQNKEAXHQGS-UHFFFAOYSA-N -1 1 311.768 4.225 20 0 DIADMM [O-]c1cccc(-c2cc(-c3nc(C4CC4)no3)ccn2)c1Cl ZINC001242801495 1057481854 /nfs/dbraw/zinc/48/18/54/1057481854.db2.gz RXHSLZIUCMBJFC-UHFFFAOYSA-N -1 1 313.744 4.035 20 0 DIADMM Cc1nc(C)c(-c2ccc(-c3cccc([O-])c3Cl)nn2)s1 ZINC001242800631 1057481865 /nfs/dbraw/zinc/48/18/65/1057481865.db2.gz JRMIEMSLYDEINE-UHFFFAOYSA-N -1 1 317.801 4.243 20 0 DIADMM [O-]c1cccc(-c2ncc3c(n2)-c2ccccc2OC3)c1Cl ZINC001242800539 1057481872 /nfs/dbraw/zinc/48/18/72/1057481872.db2.gz IORXSOMVGDFLHF-UHFFFAOYSA-N -1 1 310.740 4.062 20 0 DIADMM COC(=O)c1cccc2nc(-c3cccc([O-])c3Cl)ccc21 ZINC001242801555 1057481896 /nfs/dbraw/zinc/48/18/96/1057481896.db2.gz SXFTUHOJWJLYHM-UHFFFAOYSA-N -1 1 313.740 4.047 20 0 DIADMM COC(=O)c1cccc2c(-c3cccc([O-])c3Cl)ccnc12 ZINC001242802782 1057482889 /nfs/dbraw/zinc/48/28/89/1057482889.db2.gz QNIPERBOGRQFQN-UHFFFAOYSA-N -1 1 313.740 4.047 20 0 DIADMM CN1C(=O)CC(C)(C)c2ccc(-c3cccc([O-])c3Cl)cc21 ZINC001242803026 1057483118 /nfs/dbraw/zinc/48/31/18/1057483118.db2.gz LIYDHMAUEYTRME-UHFFFAOYSA-N -1 1 315.800 4.357 20 0 DIADMM CCOC(=O)c1noc2cccc(-c3cccc([O-])c3Cl)c21 ZINC001242802045 1057483222 /nfs/dbraw/zinc/48/32/22/1057483222.db2.gz NYECMSMMRJYZNV-UHFFFAOYSA-N -1 1 317.728 4.031 20 0 DIADMM COC(=O)c1nc2c(cccc2-c2cccc([O-])c2Cl)s1 ZINC001242802560 1057483333 /nfs/dbraw/zinc/48/33/33/1057483333.db2.gz BVAGZFNTSYGDQR-UHFFFAOYSA-N -1 1 319.769 4.109 20 0 DIADMM [O-]c1cc(-c2ncc(F)c(Oc3cccc(F)c3)n2)ccc1F ZINC001243051708 1057558443 /nfs/dbraw/zinc/55/84/43/1057558443.db2.gz YCONQIFNFCAOJM-UHFFFAOYSA-N -1 1 318.254 4.059 20 0 DIADMM Cc1cc(C(=O)[O-])cc(-c2cccc3nc(C(F)(F)F)[nH]c32)c1 ZINC001243181511 1057595004 /nfs/dbraw/zinc/59/50/04/1057595004.db2.gz PUEUXAYBZDTETR-UHFFFAOYSA-N -1 1 320.270 4.255 20 0 DIADMM Cc1cc(C(=O)[O-])ccc1-c1ccc2nc(C(F)(F)F)[nH]c2c1 ZINC001243203744 1057603883 /nfs/dbraw/zinc/60/38/83/1057603883.db2.gz HMRNSTZKXNVOLR-UHFFFAOYSA-N -1 1 320.270 4.255 20 0 DIADMM COc1cc2ccnc(-c3ccc([O-])c(F)c3F)c2cc1F ZINC001243338569 1057651237 /nfs/dbraw/zinc/65/12/37/1057651237.db2.gz GPNZRXRMWRHXQF-UHFFFAOYSA-N -1 1 305.255 4.033 20 0 DIADMM COc1ccc2nc(-c3ccc([O-])c(F)c3F)c(C)cc2c1 ZINC001243339181 1057652143 /nfs/dbraw/zinc/65/21/43/1057652143.db2.gz OIWBFDONBHODIY-UHFFFAOYSA-N -1 1 301.292 4.203 20 0 DIADMM COc1ccc2nc(-c3ccc([O-])c(F)c3F)cc(C)c2c1 ZINC001243341347 1057653381 /nfs/dbraw/zinc/65/33/81/1057653381.db2.gz IZQUTVUOMFOXEB-UHFFFAOYSA-N -1 1 301.292 4.203 20 0 DIADMM COc1ncc(-c2ccccc2)cc1-c1ccc([O-])c(F)c1F ZINC001243343886 1057653717 /nfs/dbraw/zinc/65/37/17/1057653717.db2.gz RXOSBSICMLAUEG-UHFFFAOYSA-N -1 1 313.303 4.408 20 0 DIADMM [O-]c1ccc(-c2ccc(O[C@H]3CCCCO3)cc2F)c(F)c1F ZINC001243343703 1057653814 /nfs/dbraw/zinc/65/38/14/1057653814.db2.gz NQDKQGMNGDLGCH-HNNXBMFYSA-N -1 1 324.298 4.382 20 0 DIADMM COC(=O)c1nc2cc(-c3ccc(OCC(C)C)cc3)ccc2[n-]1 ZINC001243432036 1057681661 /nfs/dbraw/zinc/68/16/61/1057681661.db2.gz LQYMXFZTOZUYFX-UHFFFAOYSA-N -1 1 324.380 4.051 20 0 DIADMM COC(=O)c1nc2ccc(-c3ccc(OCC(C)C)cc3)cc2[n-]1 ZINC001243432036 1057681663 /nfs/dbraw/zinc/68/16/63/1057681663.db2.gz LQYMXFZTOZUYFX-UHFFFAOYSA-N -1 1 324.380 4.051 20 0 DIADMM CC(C)(C)OC(=O)Nc1ccc(-c2cc(F)cc(F)c2[O-])cn1 ZINC001243506497 1057697551 /nfs/dbraw/zinc/69/75/51/1057697551.db2.gz WZSTZTYXJUOSKV-UHFFFAOYSA-N -1 1 322.311 4.079 20 0 DIADMM COC(=O)c1cc(-c2cc(F)cc(F)c2[O-])cc2ccccc21 ZINC001243506001 1057697912 /nfs/dbraw/zinc/69/79/12/1057697912.db2.gz OAYZRXABKGPRMC-UHFFFAOYSA-N -1 1 314.287 4.277 20 0 DIADMM [O-]c1c(F)cc(F)cc1-c1ccc(O[C@H]2CCCCO2)cc1F ZINC001243506996 1057698729 /nfs/dbraw/zinc/69/87/29/1057698729.db2.gz QFDKWCIVFJKWIS-INIZCTEOSA-N -1 1 324.298 4.382 20 0 DIADMM CC(C)Oc1c(F)c(F)ccc1-c1cc(F)cc(F)c1[O-] ZINC001243506900 1057698743 /nfs/dbraw/zinc/69/87/43/1057698743.db2.gz NSRXLKZSOVKSNO-UHFFFAOYSA-N -1 1 300.251 4.403 20 0 DIADMM COC(=O)c1ccc2nc(-c3ccc(Cl)c([O-])c3)ccc2c1 ZINC001243576600 1057720832 /nfs/dbraw/zinc/72/08/32/1057720832.db2.gz QADPMQPYKUOBRN-UHFFFAOYSA-N -1 1 313.740 4.047 20 0 DIADMM [O-]c1cc(-c2nccc(-c3ccc(F)cc3)n2)ccc1Cl ZINC001243576868 1057721126 /nfs/dbraw/zinc/72/11/26/1057721126.db2.gz WEHMOOBKQDVZSZ-UHFFFAOYSA-N -1 1 300.720 4.309 20 0 DIADMM COC(=O)c1ccc2c(ccnc2-c2ccc(Cl)c([O-])c2)c1 ZINC001243577281 1057721581 /nfs/dbraw/zinc/72/15/81/1057721581.db2.gz WHGBPBQPPXGART-UHFFFAOYSA-N -1 1 313.740 4.047 20 0 DIADMM CC(=O)N1CCCc2ccc(-c3ccc(Cl)c([O-])c3)cc21 ZINC001243578353 1057721741 /nfs/dbraw/zinc/72/17/41/1057721741.db2.gz NWZCZFMELYWGFO-UHFFFAOYSA-N -1 1 301.773 4.012 20 0 DIADMM COc1ccc(-c2nccc(-c3ccc(Cl)c([O-])c3)n2)cc1 ZINC001243578208 1057721793 /nfs/dbraw/zinc/72/17/93/1057721793.db2.gz DNCWAQPLUKYCRU-UHFFFAOYSA-N -1 1 312.756 4.178 20 0 DIADMM [O-]c1cc(-c2cc(-c3nc(C4CC4)no3)ccn2)ccc1Cl ZINC001243578930 1057722163 /nfs/dbraw/zinc/72/21/63/1057722163.db2.gz LXEFPCFCULJZAD-UHFFFAOYSA-N -1 1 313.744 4.035 20 0 DIADMM [O-]c1cc(-c2ccc(-c3ccc(F)cc3F)nn2)ccc1Cl ZINC001243579411 1057722289 /nfs/dbraw/zinc/72/22/89/1057722289.db2.gz UAZBLQZUMKJNIU-UHFFFAOYSA-N -1 1 318.710 4.448 20 0 DIADMM [O-]c1cc(-c2nc(-c3ccncc3)nc3c2CCC3)ccc1Cl ZINC001243579374 1057722406 /nfs/dbraw/zinc/72/24/06/1057722406.db2.gz RURKOBJVIAMQDV-UHFFFAOYSA-N -1 1 323.783 4.053 20 0 DIADMM CSc1nc(-c2ccc(Cl)c([O-])c2)cc(C(F)F)n1 ZINC001243578913 1057722471 /nfs/dbraw/zinc/72/24/71/1057722471.db2.gz LTNKJUQNBADWFB-UHFFFAOYSA-N -1 1 302.733 4.162 20 0 DIADMM [O-]c1cc(-c2cc(-c3ccc(F)cc3)ncn2)ccc1Cl ZINC001243579034 1057722483 /nfs/dbraw/zinc/72/24/83/1057722483.db2.gz PFWCMLYAOIRKCW-UHFFFAOYSA-N -1 1 300.720 4.309 20 0 DIADMM COC(=O)c1ccc(C2CC2)c(-c2ccc(Cl)c([O-])c2)c1 ZINC001243581972 1057723001 /nfs/dbraw/zinc/72/30/01/1057723001.db2.gz PDKNBJSCOFOHFE-UHFFFAOYSA-N -1 1 302.757 4.377 20 0 DIADMM COC(=O)c1cccc2c(-c3ccc(Cl)c([O-])c3)ccnc12 ZINC001243583110 1057724095 /nfs/dbraw/zinc/72/40/95/1057724095.db2.gz IOABHCIPWHPCEU-UHFFFAOYSA-N -1 1 313.740 4.047 20 0 DIADMM Cc1noc(-c2ccc(-c3ccc(Cl)c([O-])c3)cc2F)n1 ZINC001243582173 1057724131 /nfs/dbraw/zinc/72/41/31/1057724131.db2.gz ZLOLFASGRHKERZ-UHFFFAOYSA-N -1 1 304.708 4.210 20 0 DIADMM CCOC(=O)c1cc(-c2ccc(Cl)c([O-])c2)cc2cc[nH]c21 ZINC001243584148 1057724552 /nfs/dbraw/zinc/72/45/52/1057724552.db2.gz RKAKYGPMMOMDIM-UHFFFAOYSA-N -1 1 315.756 4.371 20 0 DIADMM COc1ccc2c(c1)ncnc2-c1ccc(C(F)(F)F)cc1[O-] ZINC001243608547 1057731774 /nfs/dbraw/zinc/73/17/74/1057731774.db2.gz KLOOZROHUVAYLS-UHFFFAOYSA-N -1 1 320.270 4.030 20 0 DIADMM COc1ccc2nc(-c3ccc(C(F)(F)F)cc3[O-])cnc2c1 ZINC001243609369 1057731846 /nfs/dbraw/zinc/73/18/46/1057731846.db2.gz PZSRXEATENPGEW-UHFFFAOYSA-N -1 1 320.270 4.030 20 0 DIADMM [O-]c1cc(C(F)(F)F)ccc1-c1nc(C2CC2)nc2[nH]ccc21 ZINC001243610872 1057733103 /nfs/dbraw/zinc/73/31/03/1057733103.db2.gz VUGNTEICZBMHQP-UHFFFAOYSA-N -1 1 319.286 4.178 20 0 DIADMM O=C(/C=C/Sc1ccccc1)Nc1ccc([O-])c(Cl)c1 ZINC000732309278 1057771990 /nfs/dbraw/zinc/77/19/90/1057771990.db2.gz NMDXEUSCIKCHOW-CMDGGOBGSA-N -1 1 305.786 4.290 20 0 DIADMM CC(C)Oc1ccc(C(=O)Nc2ccc([O-])c(Cl)c2)cc1 ZINC000732308865 1057772284 /nfs/dbraw/zinc/77/22/84/1057772284.db2.gz FWPWNJMQDPZQLP-UHFFFAOYSA-N -1 1 305.761 4.085 20 0 DIADMM C/C(=C\C(=O)Nc1ccc([O-])c(Cl)c1)c1cccc(F)c1 ZINC000732309297 1057772540 /nfs/dbraw/zinc/77/25/40/1057772540.db2.gz OKOHVTKNUCMFSA-JXMROGBWSA-N -1 1 305.736 4.227 20 0 DIADMM COc1cc2cnc(-c3c([O-])cccc3Cl)cc2cc1F ZINC001244033779 1057844197 /nfs/dbraw/zinc/84/41/97/1057844197.db2.gz QDDFLWPBFFXVPC-UHFFFAOYSA-N -1 1 303.720 4.409 20 0 DIADMM [O-]c1cccc(Cl)c1-c1cc(-c2nc(C3CC3)no2)ccn1 ZINC001244035223 1057844650 /nfs/dbraw/zinc/84/46/50/1057844650.db2.gz CFYQFFOGSZVPTD-UHFFFAOYSA-N -1 1 313.744 4.035 20 0 DIADMM CC(C)(C)OC(=O)Nc1ccc(-c2c([O-])cccc2Cl)nc1 ZINC001244033320 1057844656 /nfs/dbraw/zinc/84/46/56/1057844656.db2.gz BUVMRVHZGITQOF-UHFFFAOYSA-N -1 1 320.776 4.455 20 0 DIADMM [O-]c1c(F)cc(-c2cnc3[nH]cc(C(F)(F)F)c3c2)cc1F ZINC001244096283 1057867881 /nfs/dbraw/zinc/86/78/81/1057867881.db2.gz GVBHZQKQMDXDJA-UHFFFAOYSA-N -1 1 314.213 4.233 20 0 DIADMM COc1cc(-c2cc(F)c([O-])c(F)c2)ccc1OC(F)(F)F ZINC001244097923 1057868465 /nfs/dbraw/zinc/86/84/65/1057868465.db2.gz AKUHWTQOFXOLLA-UHFFFAOYSA-N -1 1 320.213 4.245 20 0 DIADMM CC(C)(C)OC(=O)Cc1cccc(-c2cc(F)c([O-])c(F)c2)c1 ZINC001244098772 1057868501 /nfs/dbraw/zinc/86/85/01/1057868501.db2.gz QWQUOPQWURRGOL-UHFFFAOYSA-N -1 1 320.335 4.222 20 0 DIADMM [O-]c1c(F)cc(-c2ccc(O[C@H]3CCCCO3)cc2)cc1F ZINC001244098136 1057868726 /nfs/dbraw/zinc/86/87/26/1057868726.db2.gz YRLKNRXSPVNSTP-INIZCTEOSA-N -1 1 306.308 4.243 20 0 DIADMM COC(=O)c1nc2ccc(-c3c(F)cccc3C3CC3)cc2[n-]1 ZINC001244119785 1057875681 /nfs/dbraw/zinc/87/56/81/1057875681.db2.gz JCMCTZYQNUZFET-UHFFFAOYSA-N -1 1 310.328 4.033 20 0 DIADMM COC(=O)c1nc2cc(-c3c(F)cccc3C3CC3)ccc2[n-]1 ZINC001244119785 1057875684 /nfs/dbraw/zinc/87/56/84/1057875684.db2.gz JCMCTZYQNUZFET-UHFFFAOYSA-N -1 1 310.328 4.033 20 0 DIADMM Cc1ccc2c(c1)ncnc2-c1ccc(OC(F)(F)F)cc1[O-] ZINC001244463146 1057965263 /nfs/dbraw/zinc/96/52/63/1057965263.db2.gz BIFQSCOJASPOBT-UHFFFAOYSA-N -1 1 320.270 4.209 20 0 DIADMM [O-]c1cc(OC(F)(F)F)ccc1-c1nncc2cc(F)ccc21 ZINC001244463108 1057965275 /nfs/dbraw/zinc/96/52/75/1057965275.db2.gz AMDCZJDWQXAJFQ-UHFFFAOYSA-N -1 1 324.233 4.040 20 0 DIADMM [O-]c1cc(OC(F)(F)F)ccc1-c1cnc(-c2ccco2)cn1 ZINC001244463055 1057965351 /nfs/dbraw/zinc/96/53/51/1057965351.db2.gz DHMFLDFRYQGVAY-UHFFFAOYSA-N -1 1 322.242 4.008 20 0 DIADMM [O-]c1cc(OC(F)(F)F)ccc1-c1cnc2cc(F)ccc2n1 ZINC001244464982 1057966057 /nfs/dbraw/zinc/96/60/57/1057966057.db2.gz ZLCYYPYFHKIWAW-UHFFFAOYSA-N -1 1 324.233 4.040 20 0 DIADMM Cc1cc(-c2ccc(OC(F)(F)F)cc2[O-])nc2cc[nH]c21 ZINC001244464493 1057966065 /nfs/dbraw/zinc/96/60/65/1057966065.db2.gz OFZDITQVDFPETK-UHFFFAOYSA-N -1 1 308.259 4.143 20 0 DIADMM CCOC(=O)c1c(C)cc(-c2cc(C)c([O-])c(Cl)c2)nc1C ZINC001244532026 1057987100 /nfs/dbraw/zinc/98/71/00/1057987100.db2.gz USUNHHRQRYNZKZ-UHFFFAOYSA-N -1 1 319.788 4.210 20 0 DIADMM COc1ccc2nc(C)nc(-c3cc(C)c([O-])c(Cl)c3)c2c1 ZINC001244532011 1057987169 /nfs/dbraw/zinc/98/71/69/1057987169.db2.gz UJDXRGMWENRYKO-UHFFFAOYSA-N -1 1 314.772 4.281 20 0 DIADMM Cc1cc(-c2ncccc2OC(F)(F)F)cc(Cl)c1[O-] ZINC001244530422 1057987186 /nfs/dbraw/zinc/98/71/86/1057987186.db2.gz NJYKLCSNOJSNJL-UHFFFAOYSA-N -1 1 303.667 4.315 20 0 DIADMM Cc1cc(-c2ncccc2C(=O)OC(C)(C)C)cc(Cl)c1[O-] ZINC001244531189 1057987535 /nfs/dbraw/zinc/98/75/35/1057987535.db2.gz HDNXIZPDXDUCJF-UHFFFAOYSA-N -1 1 319.788 4.371 20 0 DIADMM Cc1cc(-c2cc(C)c([O-])c(Cl)c2)nc(-c2cccnc2)n1 ZINC001244535939 1057988343 /nfs/dbraw/zinc/98/83/43/1057988343.db2.gz DXYQMBKMVWERLN-UHFFFAOYSA-N -1 1 311.772 4.181 20 0 DIADMM Cc1cc(-c2cccc(C(=O)OC(C)(C)C)n2)cc(Cl)c1[O-] ZINC001244535907 1057988619 /nfs/dbraw/zinc/98/86/19/1057988619.db2.gz DUYXCTFTLULYLI-UHFFFAOYSA-N -1 1 319.788 4.371 20 0 DIADMM [O-]c1ccc(Cl)c(-c2cccc(-c3ccccn3)n2)c1F ZINC001244537281 1057988886 /nfs/dbraw/zinc/98/88/86/1057988886.db2.gz AKZGSWZJFGBGSG-UHFFFAOYSA-N -1 1 300.720 4.309 20 0 DIADMM CCOc1nnc(-c2cc(C)c([O-])c(Cl)c2)c2ccccc21 ZINC001244536863 1057989086 /nfs/dbraw/zinc/98/90/86/1057989086.db2.gz PZCMWVIZSVXZHA-UHFFFAOYSA-N -1 1 314.772 4.363 20 0 DIADMM COc1cnc(-c2c(Cl)ccc([O-])c2F)c2ccccc12 ZINC001244537654 1057989364 /nfs/dbraw/zinc/98/93/64/1057989364.db2.gz CYKBNLGUVWGRNK-UHFFFAOYSA-N -1 1 303.720 4.409 20 0 DIADMM COc1ccc(C(F)(F)F)nc1-c1c(Cl)ccc([O-])c1F ZINC001244538547 1057989499 /nfs/dbraw/zinc/98/94/99/1057989499.db2.gz MTBUOLKOVSWYMS-UHFFFAOYSA-N -1 1 321.657 4.274 20 0 DIADMM Cc1cc(-c2c(Cl)ccc([O-])c2F)nc(-c2ccccn2)n1 ZINC001244540004 1057990591 /nfs/dbraw/zinc/99/05/91/1057990591.db2.gz DQGPTKLFWTZCJX-UHFFFAOYSA-N -1 1 315.735 4.012 20 0 DIADMM COc1ncc(-c2c(Cl)ccc([O-])c2F)c2ccccc21 ZINC001244541161 1057991385 /nfs/dbraw/zinc/99/13/85/1057991385.db2.gz LQEPXGNYBIHIOJ-UHFFFAOYSA-N -1 1 303.720 4.409 20 0 DIADMM [O-]c1ccc(Cl)c(-c2ccc(-c3ccccn3)nc2)c1F ZINC001244541164 1057991416 /nfs/dbraw/zinc/99/14/16/1057991416.db2.gz LSBZQHFUZOPKKB-UHFFFAOYSA-N -1 1 300.720 4.309 20 0 DIADMM CCOC(=O)c1c(OC)cccc1-c1c(Cl)ccc([O-])c1F ZINC001244542180 1057991445 /nfs/dbraw/zinc/99/14/45/1057991445.db2.gz XVLMAEWSSXZJDN-UHFFFAOYSA-N -1 1 324.735 4.037 20 0 DIADMM COc1ccc2cc(-c3c(Cl)ccc([O-])c3F)cnc2c1 ZINC001244542143 1057991520 /nfs/dbraw/zinc/99/15/20/1057991520.db2.gz ISCJSGAJWCDIAW-UHFFFAOYSA-N -1 1 303.720 4.409 20 0 DIADMM CCOC(=O)c1ccc(C)c(-c2c(Cl)ccc([O-])c2F)c1 ZINC001244541592 1057991621 /nfs/dbraw/zinc/99/16/21/1057991621.db2.gz FOUARNFFXNNMLP-UHFFFAOYSA-N -1 1 308.736 4.337 20 0 DIADMM CCOc1cc(F)c(-c2c(Cl)ccc([O-])c2F)cc1OC ZINC001244540734 1057991658 /nfs/dbraw/zinc/99/16/58/1057991658.db2.gz IFNUCLABOFBKNA-UHFFFAOYSA-N -1 1 314.715 4.398 20 0 DIADMM COC(=O)c1c(F)c(C)ccc1-c1c(Cl)ccc([O-])c1F ZINC001244543628 1057992107 /nfs/dbraw/zinc/99/21/07/1057992107.db2.gz WIGABIAKKKJLBK-UHFFFAOYSA-N -1 1 312.699 4.086 20 0 DIADMM Cc1noc(-c2ccc(-c3c(Cl)ccc([O-])c3F)cc2)c1N ZINC001244543098 1057992118 /nfs/dbraw/zinc/99/21/18/1057992118.db2.gz SWDWLBUCSXVZCI-UHFFFAOYSA-N -1 1 318.735 4.397 20 0 DIADMM CC(C)C(=O)Nc1cccc(-c2c(Cl)ccc([O-])c2F)c1 ZINC001244543333 1057992139 /nfs/dbraw/zinc/99/21/39/1057992139.db2.gz SFPCRRWTXCWFKC-UHFFFAOYSA-N -1 1 307.752 4.446 20 0 DIADMM CC1(C)C(=O)Nc2ccc(-c3c(Cl)ccc([O-])c3F)cc21 ZINC001244543126 1057992244 /nfs/dbraw/zinc/99/22/44/1057992244.db2.gz PAOYEFDJJVBXNL-UHFFFAOYSA-N -1 1 305.736 4.081 20 0 DIADMM O=c1ccc(-c2c(F)c([O-])ccc2Cl)cn1-c1ccccc1 ZINC001244543590 1057992327 /nfs/dbraw/zinc/99/23/27/1057992327.db2.gz UYPHIKSQVFHCOJ-UHFFFAOYSA-N -1 1 315.731 4.003 20 0 DIADMM CC1(C)CC(=O)Nc2cccc(-c3c(Cl)ccc([O-])c3F)c21 ZINC001244542675 1057992335 /nfs/dbraw/zinc/99/23/35/1057992335.db2.gz NYPFSWJWFRKAQG-UHFFFAOYSA-N -1 1 319.763 4.472 20 0 DIADMM CC(=O)Oc1c[nH]c2cc(-c3c(Cl)ccc([O-])c3F)ccc12 ZINC001244542767 1057992360 /nfs/dbraw/zinc/99/23/60/1057992360.db2.gz MDANZUNMEOITQZ-UHFFFAOYSA-N -1 1 319.719 4.258 20 0 DIADMM COc1ccnc2ccc(-c3c(Cl)ccc([O-])c3F)cc21 ZINC001244543287 1057992472 /nfs/dbraw/zinc/99/24/72/1057992472.db2.gz QXEKSPWQUKYQRU-UHFFFAOYSA-N -1 1 303.720 4.409 20 0 DIADMM Cc1cc(-c2cccnc2OCC(F)(F)F)cc(Cl)c1[O-] ZINC001244551264 1057993779 /nfs/dbraw/zinc/99/37/79/1057993779.db2.gz VSSNCZBSYLZLCI-UHFFFAOYSA-N -1 1 317.694 4.357 20 0 DIADMM COc1cc2ccnc(-c3cc(Cl)ccc3[O-])c2cc1OC ZINC001245048273 1058101691 /nfs/dbraw/zinc/10/16/91/1058101691.db2.gz IEOCGLJTDAZBSH-UHFFFAOYSA-N -1 1 315.756 4.278 20 0 DIADMM [O-]c1ccc(Cl)cc1-c1ccnc(Cc2ccc(F)cc2)n1 ZINC001245049722 1058102366 /nfs/dbraw/zinc/10/23/66/1058102366.db2.gz LKVUDOGZLSRSQR-UHFFFAOYSA-N -1 1 314.747 4.233 20 0 DIADMM [O-]c1ccc(Cl)cc1-c1cc(N2CCc3ccccc32)ncn1 ZINC001245049763 1058102685 /nfs/dbraw/zinc/10/26/85/1058102685.db2.gz MEWJIIAGYMSDTM-UHFFFAOYSA-N -1 1 323.783 4.197 20 0 DIADMM CN(c1ccccc1)c1cc(-c2cc(Cl)ccc2[O-])ncn1 ZINC001245049781 1058102831 /nfs/dbraw/zinc/10/28/31/1058102831.db2.gz MMYJUYDQYWKROK-UHFFFAOYSA-N -1 1 311.772 4.271 20 0 DIADMM [O-]c1ccc(Cl)cc1-c1nc(-c2ccccn2)nc2c1CCC2 ZINC001245050571 1058103136 /nfs/dbraw/zinc/10/31/36/1058103136.db2.gz VLMIMCWGALCSHH-UHFFFAOYSA-N -1 1 323.783 4.053 20 0 DIADMM CCOC(=O)c1nc2ccc(-c3cccc4ccoc43)cc2[n-]1 ZINC001245617821 1058290145 /nfs/dbraw/zinc/29/01/45/1058290145.db2.gz VFRAYDPBZVSAKB-UHFFFAOYSA-N -1 1 306.321 4.153 20 0 DIADMM CCOC(=O)c1nc2cc(-c3cccc4ccoc43)ccc2[n-]1 ZINC001245617821 1058290163 /nfs/dbraw/zinc/29/01/63/1058290163.db2.gz VFRAYDPBZVSAKB-UHFFFAOYSA-N -1 1 306.321 4.153 20 0 DIADMM O=C([O-])c1ccc(-c2ccc(-c3cccn4cncc34)cc2)cc1 ZINC001245665081 1058317208 /nfs/dbraw/zinc/31/72/08/1058317208.db2.gz AJCXJISPJVAJLV-UHFFFAOYSA-N -1 1 314.344 4.367 20 0 DIADMM [O-]c1ccc(F)c(-c2cncc(N3CCCCCC3)n2)c1Cl ZINC001245830181 1058526900 /nfs/dbraw/zinc/52/69/00/1058526900.db2.gz KBEBWBGTOOMJFX-UHFFFAOYSA-N -1 1 321.783 4.022 20 0 DIADMM COC(=O)c1c(C)cc(-c2c(F)ccc([O-])c2Cl)cc1F ZINC001245831106 1058527673 /nfs/dbraw/zinc/52/76/73/1058527673.db2.gz DHQVQCKLDWHXCA-UHFFFAOYSA-N -1 1 312.699 4.086 20 0 DIADMM [O-]c1ccc(F)c(-c2ccc(-c3ccncc3)cn2)c1Cl ZINC001245830758 1058528150 /nfs/dbraw/zinc/52/81/50/1058528150.db2.gz XKSMCZYRDPUYCE-UHFFFAOYSA-N -1 1 300.720 4.309 20 0 DIADMM COc1ccc2nc(-c3c(F)ccc([O-])c3Cl)c(C)nc2c1 ZINC001245830608 1058528307 /nfs/dbraw/zinc/52/83/07/1058528307.db2.gz PXYQGYOXIJUNMU-UHFFFAOYSA-N -1 1 318.735 4.112 20 0 DIADMM COc1cc(F)c(-c2c(F)ccc([O-])c2Cl)c(OC)c1 ZINC001245830993 1058528752 /nfs/dbraw/zinc/52/87/52/1058528752.db2.gz CVHOXNGAQVHSLF-UHFFFAOYSA-N -1 1 300.688 4.008 20 0 DIADMM [O-]c1ccc(F)c(-c2nc(C3CC3)nc3c2CCC3)c1Cl ZINC001245830876 1058529190 /nfs/dbraw/zinc/52/91/90/1058529190.db2.gz XMAKSSXMYHNDHQ-UHFFFAOYSA-N -1 1 304.752 4.008 20 0 DIADMM Cc1csc2nc(C)nc(-c3c(F)ccc([O-])c3Cl)c12 ZINC001245830143 1058529612 /nfs/dbraw/zinc/52/96/12/1058529612.db2.gz JHZDASHKEQYISF-UHFFFAOYSA-N -1 1 308.765 4.473 20 0 DIADMM [O-]c1ccc(F)c(-c2ncnc3[nH]c4ccccc4c32)c1Cl ZINC001245829770 1058530185 /nfs/dbraw/zinc/53/01/85/1058530185.db2.gz COQLBAAPUNXCIP-UHFFFAOYSA-N -1 1 313.719 4.276 20 0 DIADMM COC(OC)c1ccc(-c2c(F)ccc([O-])c2Cl)cc1F ZINC001245831603 1058531163 /nfs/dbraw/zinc/53/11/63/1058531163.db2.gz GFDJTIFRPUDSSR-UHFFFAOYSA-N -1 1 314.715 4.282 20 0 DIADMM [O-]c1ccc(F)c(-c2cncc(-c3ccc(F)cc3)n2)c1Cl ZINC001245831721 1058531844 /nfs/dbraw/zinc/53/18/44/1058531844.db2.gz DAOZPVDZRNRYAY-UHFFFAOYSA-N -1 1 318.710 4.448 20 0 DIADMM CC1(C)C(=O)Nc2ccc(-c3c(F)ccc([O-])c3Cl)cc21 ZINC001245832536 1058531889 /nfs/dbraw/zinc/53/18/89/1058531889.db2.gz PMHKBAFYDUTEIJ-UHFFFAOYSA-N -1 1 305.736 4.081 20 0 DIADMM CCc1cc(-c2c(F)ccc([O-])c2Cl)ccc1NC(C)=O ZINC001245831421 1058532812 /nfs/dbraw/zinc/53/28/12/1058532812.db2.gz FUGRZBAKDDBYPQ-UHFFFAOYSA-N -1 1 307.752 4.373 20 0 DIADMM CC(C)(C)NC(=O)c1ccc(-c2c(F)ccc([O-])c2Cl)cc1 ZINC001245832660 1058533156 /nfs/dbraw/zinc/53/31/56/1058533156.db2.gz MPMJLUOQORBODY-UHFFFAOYSA-N -1 1 321.779 4.380 20 0 DIADMM COc1ccc(-c2c(F)ccc([O-])c2Cl)c2ccncc12 ZINC001245834360 1058537080 /nfs/dbraw/zinc/53/70/80/1058537080.db2.gz GGATZDWIOFAHRK-UHFFFAOYSA-N -1 1 303.720 4.409 20 0 DIADMM CCOc1ccc(-c2c(F)ccc([O-])c2Cl)c(OCC)n1 ZINC001245836048 1058538874 /nfs/dbraw/zinc/53/88/74/1058538874.db2.gz WSYJKWCPBTYAHZ-UHFFFAOYSA-N -1 1 311.740 4.044 20 0 DIADMM [O-]c1ccc(F)c(-c2cncc(OC(F)(F)F)c2)c1Cl ZINC001245834402 1058539136 /nfs/dbraw/zinc/53/91/36/1058539136.db2.gz HUXREQHVWLJOFD-UHFFFAOYSA-N -1 1 307.630 4.145 20 0 DIADMM CCOC(=O)c1ccc(OC)c(-c2c(F)ccc([O-])c2Cl)c1 ZINC001245836609 1058539421 /nfs/dbraw/zinc/53/94/21/1058539421.db2.gz VGHDGJSVHMTRGD-UHFFFAOYSA-N -1 1 324.735 4.037 20 0 DIADMM CC(C)(CC1CCCCCC1)NC(=O)c1c([O-])cccc1F ZINC001556225158 1058561255 /nfs/dbraw/zinc/56/12/55/1058561255.db2.gz YWVRGDFFRHVMLR-UHFFFAOYSA-N -1 1 307.409 4.400 20 0 DIADMM Cc1cc(N2CCCCCC2)ccc1NC(=O)c1ccccc1[O-] ZINC001556532975 1058608239 /nfs/dbraw/zinc/60/82/39/1058608239.db2.gz NMXIEDHFCBOJEF-UHFFFAOYSA-N -1 1 324.424 4.333 20 0 DIADMM CC(C)c1occc1C(=O)Nc1cccc([O-])c1Br ZINC001556697210 1058629006 /nfs/dbraw/zinc/62/90/06/1058629006.db2.gz TTXKICKLXBVMPV-UHFFFAOYSA-N -1 1 324.174 4.123 20 0 DIADMM C[C@H](c1ccc(Cl)cc1)n1[n-]c(-c2ccc(N)cc2)cc1=O ZINC001245936298 1058636487 /nfs/dbraw/zinc/63/64/87/1058636487.db2.gz JCTVOVBRYPSJJD-LLVKDONJSA-N -1 1 313.788 4.101 20 0 DIADMM O=C(Nc1cc2c(cn1)CCCC2)c1ccc2ccccc2c1[O-] ZINC001556773989 1058639758 /nfs/dbraw/zinc/63/97/58/1058639758.db2.gz MBQPBTBWZXQUIU-UHFFFAOYSA-N -1 1 318.376 4.072 20 0 DIADMM C[C@@H](Cn1[n-]c(-c2ccc(N(C)C)cc2)cc1=O)c1ccccc1 ZINC001245944219 1058641036 /nfs/dbraw/zinc/64/10/36/1058641036.db2.gz PCKRRFNPNPJFOU-HNNXBMFYSA-N -1 1 321.424 4.125 20 0 DIADMM O=c1cc(CC2CC2)[n-]n1-c1ccc(C=Cc2ccccn2)cc1 ZINC001245953182 1058650624 /nfs/dbraw/zinc/65/06/24/1058650624.db2.gz LONUHKDCIUGBGW-RMKNXTFCSA-N -1 1 317.392 4.096 20 0 DIADMM CN(C(=O)c1ccc(Cl)cc1[O-])[C@@H]1CCC[C@H]1C(C)(C)C ZINC001557080330 1058694757 /nfs/dbraw/zinc/69/47/57/1058694757.db2.gz AVHZLTLEEAIUMD-ZIAGYGMSSA-N -1 1 309.837 4.332 20 0 DIADMM CN(C(=O)c1ccc(Cl)cc1[O-])[C@H]1CCC[C@H]1C(C)(C)C ZINC001557080328 1058695593 /nfs/dbraw/zinc/69/55/93/1058695593.db2.gz AVHZLTLEEAIUMD-KGLIPLIRSA-N -1 1 309.837 4.332 20 0 DIADMM O=C(Nc1cc(F)cc(F)c1[O-])[C@H]1CC[C@H](C2CCC2)CC1 ZINC001557086946 1058696926 /nfs/dbraw/zinc/69/69/26/1058696926.db2.gz MUEMOJSIFOHCAE-HAQNSBGRSA-N -1 1 309.356 4.215 20 0 DIADMM CC[C@@H](C)Oc1ccc(C(=O)Nc2cc(F)cc(F)c2[O-])cc1 ZINC001557086234 1058697795 /nfs/dbraw/zinc/69/77/95/1058697795.db2.gz MBZADFNRBMLRND-SNVBAGLBSA-N -1 1 321.323 4.100 20 0 DIADMM CCCSc1cccc(NC(=O)c2ccc(CC)cc2[O-])n1 ZINC001557876573 1058807009 /nfs/dbraw/zinc/80/70/09/1058807009.db2.gz HWECNSWAQLKIOY-UHFFFAOYSA-N -1 1 316.426 4.104 20 0 DIADMM O=C(Cc1cc(Cl)cc(Cl)c1)Nc1cccc(F)c1[O-] ZINC001557955508 1058817935 /nfs/dbraw/zinc/81/79/35/1058817935.db2.gz BUOLCGHCRCANBA-UHFFFAOYSA-N -1 1 314.143 4.019 20 0 DIADMM O=C(c1ccc([O-])c(F)c1)N1CCC(CC2CCCCC2)CC1 ZINC001558600810 1058887911 /nfs/dbraw/zinc/88/79/11/1058887911.db2.gz AVMSGLCGNZQQLF-UHFFFAOYSA-N -1 1 319.420 4.354 20 0 DIADMM Cc1ccc(C[C@H](C)C(=O)Nc2cc(F)c([O-])cc2Cl)cc1 ZINC001558644250 1058896429 /nfs/dbraw/zinc/89/64/29/1058896429.db2.gz BMPXULLQKYODTP-NSHDSACASA-N -1 1 321.779 4.310 20 0 DIADMM Cc1cc(C)c2cc(C(=O)Nc3ccc(F)cc3[O-])sc2n1 ZINC001558956010 1058926867 /nfs/dbraw/zinc/92/68/67/1058926867.db2.gz SVXKZDVGQXNBFZ-UHFFFAOYSA-N -1 1 316.357 4.010 20 0 DIADMM CCCN(CC)c1ccc(C(=O)Nc2ccc(F)cc2[O-])cc1 ZINC001558955886 1058928483 /nfs/dbraw/zinc/92/84/83/1058928483.db2.gz OBBXPQVIWKKMNY-UHFFFAOYSA-N -1 1 316.376 4.020 20 0 DIADMM O=C(C[C@H]1CCC[C@H](C(F)(F)F)C1)Nc1ccc(F)cc1[O-] ZINC001558955791 1058928646 /nfs/dbraw/zinc/92/86/46/1058928646.db2.gz JPXDHQPJHNMJPG-UWVGGRQHSA-N -1 1 319.298 4.229 20 0 DIADMM Cc1nocc1[N-]C(=O)c1cnc(-c2ccccc2Cl)s1 ZINC001530847720 1059163619 /nfs/dbraw/zinc/16/36/19/1059163619.db2.gz YMMFMHXGWYECMF-UHFFFAOYSA-N -1 1 319.773 4.012 20 0 DIADMM [O-]c1cccc(NC(=S)Nc2c(F)cccc2F)c1Cl ZINC001247079641 1059290297 /nfs/dbraw/zinc/29/02/97/1059290297.db2.gz CLTCLLOIJITSSB-UHFFFAOYSA-N -1 1 314.744 4.133 20 0 DIADMM CCC[C@H](C)[C@H]1CCCN1C(=O)NCc1ccc([O-])c(Cl)c1 ZINC001248411183 1059820002 /nfs/dbraw/zinc/82/00/02/1059820002.db2.gz MUMPWEULMCHCTN-SWLSCSKDSA-N -1 1 324.852 4.156 20 0 DIADMM Cc1cc(Cl)ccc1NC(=S)Nc1cccc(F)c1[O-] ZINC001248415293 1059823030 /nfs/dbraw/zinc/82/30/30/1059823030.db2.gz MWPWBICJDAFMJA-UHFFFAOYSA-N -1 1 310.781 4.302 20 0 DIADMM CC(=O)OCc1cc(Nc2cc([O-])c(Cl)cc2F)ccc1C ZINC001248579043 1059901520 /nfs/dbraw/zinc/90/15/20/1059901520.db2.gz SFYHIFSQVRJLNL-UHFFFAOYSA-N -1 1 323.751 4.300 20 0 DIADMM CCc1cccc(CC)c1NC(=S)Nc1cccc(F)c1[O-] ZINC001248673785 1059932741 /nfs/dbraw/zinc/93/27/41/1059932741.db2.gz SMAFOORAYRTPGI-UHFFFAOYSA-N -1 1 318.417 4.465 20 0 DIADMM Cn1cc(Nc2cc(Cl)cc(Cl)c2[O-])c2ccncc21 ZINC001249698930 1060355376 /nfs/dbraw/zinc/35/53/76/1060355376.db2.gz UHELPKKLQYUIBQ-UHFFFAOYSA-N -1 1 308.168 4.329 20 0 DIADMM CC(C)Oc1cc(F)c(Nc2cc(F)c([O-])cc2F)c(F)c1 ZINC001249779326 1060398867 /nfs/dbraw/zinc/39/88/67/1060398867.db2.gz YQIUOGQHBCTXFE-UHFFFAOYSA-N -1 1 315.266 4.479 20 0 DIADMM [O-]c1cc(Nc2cc(-c3cccnc3)ccn2)c(F)c(F)c1F ZINC001249957641 1060499736 /nfs/dbraw/zinc/49/97/36/1060499736.db2.gz DHDYOWSCDJCDCY-UHFFFAOYSA-N -1 1 317.270 4.010 20 0 DIADMM [O-]c1cc(Nc2c(Cl)ccnc2Cl)c(F)c(F)c1F ZINC001249958467 1060502931 /nfs/dbraw/zinc/50/29/31/1060502931.db2.gz MYHVADJGZDMGQC-UHFFFAOYSA-N -1 1 309.074 4.255 20 0 DIADMM [O-]c1cc(Nc2snnc2-c2ccccc2)c(F)c(F)c1F ZINC001249959173 1060504484 /nfs/dbraw/zinc/50/44/84/1060504484.db2.gz UCVCKSUQACHCAZ-UHFFFAOYSA-N -1 1 323.299 4.072 20 0 DIADMM [O-]c1cc(Nc2cncc(-c3ccccn3)c2)c(F)c(F)c1F ZINC001249961286 1060504808 /nfs/dbraw/zinc/50/48/08/1060504808.db2.gz OROIUTNWUARUDO-UHFFFAOYSA-N -1 1 317.270 4.010 20 0 DIADMM Cc1cc(Nc2cc([O-])c(F)c(F)c2F)c2ccsc2n1 ZINC001249961075 1060506090 /nfs/dbraw/zinc/50/60/90/1060506090.db2.gz DVZIUGIZPDOMCZ-UHFFFAOYSA-N -1 1 310.300 4.471 20 0 DIADMM Cc1cc(OC(F)F)ccc1Nc1cc([O-])c(F)c(F)c1F ZINC001249962916 1060507604 /nfs/dbraw/zinc/50/76/04/1060507604.db2.gz IBPOUWZSKITUTG-UHFFFAOYSA-N -1 1 319.229 4.463 20 0 DIADMM COc1cccc(Cl)c1Nc1cc([O-])c(F)c(F)c1F ZINC001249964560 1060509894 /nfs/dbraw/zinc/50/98/94/1060509894.db2.gz GQSMYAFWRUHBQA-UHFFFAOYSA-N -1 1 303.667 4.215 20 0 DIADMM COc1cc2cccnc2c(Nc2cc([O-])c(F)c(F)c2F)c1 ZINC001249964163 1060510016 /nfs/dbraw/zinc/51/00/16/1060510016.db2.gz ZUMXXSZBMORMOB-UHFFFAOYSA-N -1 1 320.270 4.110 20 0 DIADMM COc1ccc(Nc2cc([O-])c(F)c(F)c2F)cc1Cl ZINC001249962631 1060510199 /nfs/dbraw/zinc/51/01/99/1060510199.db2.gz LNSCDDGXUFXUEN-UHFFFAOYSA-N -1 1 303.667 4.215 20 0 DIADMM Cc1ccc(Nc2cc([O-])c(F)c(F)c2F)c(Cl)c1O ZINC001249965004 1060510362 /nfs/dbraw/zinc/51/03/62/1060510362.db2.gz RAXDYOFCUHBRKJ-UHFFFAOYSA-N -1 1 303.667 4.221 20 0 DIADMM Cc1ccnc2cc(Nc3cc([O-])c(F)c(F)c3F)ccc12 ZINC001249965153 1060510592 /nfs/dbraw/zinc/51/05/92/1060510592.db2.gz XTKBRAKFSVFABI-UHFFFAOYSA-N -1 1 304.271 4.410 20 0 DIADMM COc1cc(F)c(Cl)cc1Nc1cc([O-])c(F)c(F)c1F ZINC001249965700 1060513095 /nfs/dbraw/zinc/51/30/95/1060513095.db2.gz HIWUBLKRZMFAHE-UHFFFAOYSA-N -1 1 321.657 4.354 20 0 DIADMM [O-]c1cc(F)c(Nc2cc(-c3cccnc3)ccn2)cc1Cl ZINC001250020936 1060543110 /nfs/dbraw/zinc/54/31/10/1060543110.db2.gz UXQPCQLETCGQOI-UHFFFAOYSA-N -1 1 315.735 4.385 20 0 DIADMM Cc1cc(Nc2cc(Cl)c([O-])cc2F)n(-c2ccccc2)n1 ZINC001250018215 1060543319 /nfs/dbraw/zinc/54/33/19/1060543319.db2.gz OQXPGLAYXFGEOV-UHFFFAOYSA-N -1 1 317.751 4.422 20 0 DIADMM COC(=O)c1scc(C)c1Nc1cc(Cl)c([O-])cc1F ZINC001250020758 1060545157 /nfs/dbraw/zinc/54/51/57/1060545157.db2.gz QLTAHYGGODAFBN-UHFFFAOYSA-N -1 1 315.753 4.085 20 0 DIADMM Cc1ccccc1-n1nccc1Nc1cc(Cl)c([O-])cc1F ZINC001250023309 1060548878 /nfs/dbraw/zinc/54/88/78/1060548878.db2.gz IEVAQVOUQUXEAL-UHFFFAOYSA-N -1 1 317.751 4.422 20 0 DIADMM Cc1nccn1-c1ccc(Nc2cc(Cl)c([O-])cc2F)cc1 ZINC001250022863 1060549153 /nfs/dbraw/zinc/54/91/53/1060549153.db2.gz WZTXDWZIMSNFGN-UHFFFAOYSA-N -1 1 317.751 4.422 20 0 DIADMM CCn1cc2cc(Nc3cc(Cl)c([O-])cc3F)ccc2n1 ZINC001250023938 1060551634 /nfs/dbraw/zinc/55/16/34/1060551634.db2.gz IVARYHMMGZWMOT-UHFFFAOYSA-N -1 1 305.740 4.298 20 0 DIADMM CC(C)OC(=O)c1cccc(Nc2cc(Cl)c([O-])cc2F)c1 ZINC001250027446 1060554111 /nfs/dbraw/zinc/55/41/11/1060554111.db2.gz ZHDJJAQBBXPJGB-UHFFFAOYSA-N -1 1 323.751 4.494 20 0 DIADMM [O-]c1cc(F)c(Nc2ccc3c(c2)[C@H](O)CCC3)cc1Cl ZINC001250026959 1060554385 /nfs/dbraw/zinc/55/43/85/1060554385.db2.gz UUNHHVPZPAQAPU-OAHLLOKOSA-N -1 1 307.752 4.298 20 0 DIADMM CC(=O)c1c(F)cc(F)cc1Nc1cc(Cl)c([O-])cc1F ZINC001250026873 1060554936 /nfs/dbraw/zinc/55/49/36/1060554936.db2.gz QAKQTKDTZCXUTP-UHFFFAOYSA-N -1 1 315.678 4.409 20 0 DIADMM [O-]c1cc(F)c(Nc2cccc(Cl)c2CO)cc1Cl ZINC001250026432 1060555000 /nfs/dbraw/zinc/55/50/00/1060555000.db2.gz NEPSXDQISJFMKO-UHFFFAOYSA-N -1 1 302.132 4.074 20 0 DIADMM CO[C@H]1CCOc2c(Nc3cc(Cl)c([O-])cc3F)cccc21 ZINC001250026662 1060555162 /nfs/dbraw/zinc/55/51/62/1060555162.db2.gz RSTUHVAHUBGXMZ-HNNXBMFYSA-N -1 1 323.751 4.398 20 0 DIADMM COc1cc(OC)c(Nc2c([O-])cc(F)cc2F)cc1Cl ZINC001250097187 1060604690 /nfs/dbraw/zinc/60/46/90/1060604690.db2.gz LGHHQDHPPYCYGQ-UHFFFAOYSA-N -1 1 315.703 4.085 20 0 DIADMM CSc1ccc(F)c(Nc2ccc(-n3ccc(=O)[n-]3)cc2)c1 ZINC001250125744 1060630483 /nfs/dbraw/zinc/63/04/83/1060630483.db2.gz OXPWFOJDTRJDAA-UHFFFAOYSA-N -1 1 315.373 4.183 20 0 DIADMM CCc1nnc([N-]c2cnc(Cl)c(Cl)c2Cl)s1 ZINC001250195334 1060668384 /nfs/dbraw/zinc/66/83/84/1060668384.db2.gz LWWROVBPCVKZLI-UHFFFAOYSA-N -1 1 309.609 4.199 20 0 DIADMM C[C@@H]1CN(C)c2ccccc2N(Cc2cccc([O-])c2Cl)C1 ZINC001560829940 1060686374 /nfs/dbraw/zinc/68/63/74/1060686374.db2.gz MFXMVCBYCGYYNZ-CYBMUJFWSA-N -1 1 316.832 4.138 20 0 DIADMM C[C@H]1CN(C)c2ccccc2N(Cc2cccc([O-])c2Cl)C1 ZINC001560829941 1060687440 /nfs/dbraw/zinc/68/74/40/1060687440.db2.gz MFXMVCBYCGYYNZ-ZDUSSCGKSA-N -1 1 316.832 4.138 20 0 DIADMM [O-]c1ccc(F)c(Nc2c(Cl)cncc2Cl)c1Cl ZINC001250228285 1060709317 /nfs/dbraw/zinc/70/93/17/1060709317.db2.gz UWJKQNPEMARXSC-UHFFFAOYSA-N -1 1 307.539 4.052 20 0 DIADMM [O-]c1ccc(F)c(Nc2cnccc2Br)c1Cl ZINC001250228670 1060707189 /nfs/dbraw/zinc/70/71/89/1060707189.db2.gz JRRZDKIIPMQRLF-UHFFFAOYSA-N -1 1 317.545 4.086 20 0 DIADMM COC(=O)c1cc(C)sc1Nc1c(F)ccc([O-])c1Cl ZINC001250229126 1060708228 /nfs/dbraw/zinc/70/82/28/1060708228.db2.gz UWUHPNMNZQGUGC-UHFFFAOYSA-N -1 1 315.753 4.085 20 0 DIADMM Cc1cc2c(ncnc2Nc2c(F)ccc([O-])c2Cl)s1 ZINC001250228324 1060708652 /nfs/dbraw/zinc/70/86/52/1060708652.db2.gz WUNVOXBPBNRIAN-UHFFFAOYSA-N -1 1 309.753 4.241 20 0 DIADMM Nc1cc(Cl)nc(Cl)c1Nc1c(F)ccc([O-])c1Cl ZINC001250228958 1060708867 /nfs/dbraw/zinc/70/88/67/1060708867.db2.gz QMTCUWRWKPDOSG-UHFFFAOYSA-N -1 1 322.554 4.212 20 0 DIADMM [O-]c1ccc(F)c(Nc2cncc(C(F)(F)F)c2)c1Cl ZINC001250228969 1060709540 /nfs/dbraw/zinc/70/95/40/1060709540.db2.gz QPNUCFBEBLKZJP-UHFFFAOYSA-N -1 1 306.646 4.342 20 0 DIADMM COc1cccc2ncc(Nc3c(F)ccc([O-])c3Cl)cc21 ZINC001250230042 1060711076 /nfs/dbraw/zinc/71/10/76/1060711076.db2.gz RYHVLEGKMUDGFD-UHFFFAOYSA-N -1 1 318.735 4.485 20 0 DIADMM O=c1[nH]ccc2c(Nc3c(F)ccc([O-])c3Cl)cccc12 ZINC001250232295 1060712324 /nfs/dbraw/zinc/71/23/24/1060712324.db2.gz IKUSARZCXQMMOO-UHFFFAOYSA-N -1 1 304.708 4.182 20 0 DIADMM CP(C)(=O)c1ccccc1Nc1c(F)ccc([O-])c1Cl ZINC001250232490 1060712559 /nfs/dbraw/zinc/71/25/59/1060712559.db2.gz NZWRKQYCJWCXGF-UHFFFAOYSA-N -1 1 313.696 4.176 20 0 DIADMM COc1cc(Nc2c(F)ccc([O-])c2Cl)ccc1C(C)=O ZINC001250232159 1060712591 /nfs/dbraw/zinc/71/25/91/1060712591.db2.gz BRDFHSLLINOOPJ-UHFFFAOYSA-N -1 1 309.724 4.140 20 0 DIADMM [O-]c1ccc(F)c(Nc2ccccc2-n2cccn2)c1Cl ZINC001250234622 1060713637 /nfs/dbraw/zinc/71/36/37/1060713637.db2.gz TWIFHEMPWGKZCM-UHFFFAOYSA-N -1 1 303.724 4.114 20 0 DIADMM CCOC(=O)c1ccc(Nc2c(F)ccc([O-])c2Cl)cc1 ZINC001250233084 1060713911 /nfs/dbraw/zinc/71/39/11/1060713911.db2.gz ILGSPFWZWZISAK-UHFFFAOYSA-N -1 1 309.724 4.105 20 0 DIADMM COc1cc(OC)c(Nc2c(F)ccc([O-])c2Cl)cc1F ZINC001250233201 1060714374 /nfs/dbraw/zinc/71/43/74/1060714374.db2.gz KFOHESGXWPQSJO-UHFFFAOYSA-N -1 1 315.703 4.085 20 0 DIADMM [O-]c1ccc(F)c(Nc2cc(F)c(F)c(F)c2F)c1Cl ZINC001250233895 1060714700 /nfs/dbraw/zinc/71/47/00/1060714700.db2.gz ZIGQEZHNHNXIFF-UHFFFAOYSA-N -1 1 309.621 4.485 20 0 DIADMM CC(C)c1nc2ccc(Nc3c(F)ccc([O-])c3Cl)cn2n1 ZINC001250233734 1060714785 /nfs/dbraw/zinc/71/47/85/1060714785.db2.gz CXZLTYVEKQKKIR-UHFFFAOYSA-N -1 1 320.755 4.094 20 0 DIADMM Nc1cc(Cl)cc2ccn(-c3c(F)ccc([O-])c3Cl)c21 ZINC001250237177 1060718739 /nfs/dbraw/zinc/71/87/39/1060718739.db2.gz DMKMMBRZYAWPCT-UHFFFAOYSA-N -1 1 311.143 4.364 20 0 DIADMM O=C(Cc1ccc(Cl)c([O-])c1)c1ccc(C(F)(F)F)cc1 ZINC001250238738 1060721199 /nfs/dbraw/zinc/72/11/99/1060721199.db2.gz JMNFLISFVGLONO-UHFFFAOYSA-N -1 1 314.690 4.490 20 0 DIADMM COc1ccc(F)c(Nc2c([O-])cc(F)cc2F)c1Cl ZINC001250306509 1060770743 /nfs/dbraw/zinc/77/07/43/1060770743.db2.gz LOSYLAMPTXRACC-UHFFFAOYSA-N -1 1 303.667 4.215 20 0 DIADMM CCCC[C@H]([N-]S(=O)(=O)c1cc2ccccc2o1)C1CCC1 ZINC001561381420 1060929319 /nfs/dbraw/zinc/92/93/19/1060929319.db2.gz CMKGBKGBQAKIQQ-HNNXBMFYSA-N -1 1 321.442 4.070 20 0 DIADMM [O-]c1cccc(F)c1-c1nc2c(ccc3ncccc23)n1C1CC1 ZINC001250674341 1061005066 /nfs/dbraw/zinc/00/50/66/1061005066.db2.gz ORWQLRCMXJKHFX-UHFFFAOYSA-N -1 1 319.339 4.431 20 0 DIADMM [O-]c1cccc(F)c1-c1nc2ccc(F)c(F)c2n1C1CC1 ZINC001250674104 1061007423 /nfs/dbraw/zinc/00/74/23/1061007423.db2.gz LEEUTLUGDQHDDV-UHFFFAOYSA-N -1 1 304.271 4.161 20 0 DIADMM CCCCn1c2cc(F)ccc2nc1-c1cccc(F)c1[O-] ZINC001250683575 1061014059 /nfs/dbraw/zinc/01/40/59/1061014059.db2.gz LOJYILQJDGCBFS-UHFFFAOYSA-N -1 1 302.324 4.487 20 0 DIADMM [O-]c1c(F)cccc1-c1nc2c(ccc3ncccc23)n1C1CC1 ZINC001250683814 1061014799 /nfs/dbraw/zinc/01/47/99/1061014799.db2.gz RAKNSEBIIVONTO-UHFFFAOYSA-N -1 1 319.339 4.431 20 0 DIADMM CCCn1c2cc(OCC)ccc2nc1-c1cccc(F)c1[O-] ZINC001250683529 1061016865 /nfs/dbraw/zinc/01/68/65/1061016865.db2.gz JZKOSQDOIPLFRC-UHFFFAOYSA-N -1 1 314.360 4.357 20 0 DIADMM [O-]c1ccc(-c2nc3cc(C(F)(F)F)ccc3[nH]2)c(F)c1F ZINC001250912728 1061122384 /nfs/dbraw/zinc/12/23/84/1061122384.db2.gz KMMYWHAPIPNKEN-UHFFFAOYSA-N -1 1 314.213 4.233 20 0 DIADMM Cc1cc([N-]S(=O)(=O)c2cccs2)c(Cl)cc1Cl ZINC001250916162 1061124384 /nfs/dbraw/zinc/12/43/84/1061124384.db2.gz RJBCGQNHPHNRSM-UHFFFAOYSA-N -1 1 322.238 4.164 20 0 DIADMM O=C([O-])c1ccc(-c2nc3ccc(-c4cccs4)cc3[nH]2)o1 ZINC001250922958 1061127013 /nfs/dbraw/zinc/12/70/13/1061127013.db2.gz QHICYDAEXASJJN-UHFFFAOYSA-N -1 1 310.334 4.250 20 0 DIADMM [O-]c1c(F)cc(-c2nc3ccc(-c4ccncc4)cc3[nH]2)cc1F ZINC001250925016 1061129168 /nfs/dbraw/zinc/12/91/68/1061129168.db2.gz RMQGZPSQCLFBDL-UHFFFAOYSA-N -1 1 323.302 4.276 20 0 DIADMM [O-]c1cc(F)c(F)cc1-c1nc2ccc(F)cc2n1C1CC1 ZINC001250967635 1061152800 /nfs/dbraw/zinc/15/28/00/1061152800.db2.gz XXKBTVQMYWAJRG-UHFFFAOYSA-N -1 1 304.271 4.161 20 0 DIADMM CC(C)(C)n1c2ccccc2nc1-c1cc(F)c(F)cc1[O-] ZINC001250967629 1061153685 /nfs/dbraw/zinc/15/36/85/1061153685.db2.gz XSBMNMUUCGPGTQ-UHFFFAOYSA-N -1 1 302.324 4.442 20 0 DIADMM COc1cc(Cl)cc2[nH]c(-c3ccc(Cl)c([O-])c3)nc21 ZINC001251036955 1061193023 /nfs/dbraw/zinc/19/30/23/1061193023.db2.gz NJCIUZDWRPGVOZ-UHFFFAOYSA-N -1 1 309.152 4.251 20 0 DIADMM C/C(=C/c1ccc(C)cc1)C(=O)NCc1ccc([O-])c(Cl)c1 ZINC001455450158 1061221913 /nfs/dbraw/zinc/22/19/13/1061221913.db2.gz MZYRHGYHZYSWAS-LCYFTJDESA-N -1 1 315.800 4.074 20 0 DIADMM Cc1cccc2nc(-c3cc(Cl)c([O-])cc3O)n(C3CC3)c21 ZINC001251082667 1061228570 /nfs/dbraw/zinc/22/85/70/1061228570.db2.gz LSBZQXBUWLINGK-UHFFFAOYSA-N -1 1 314.772 4.411 20 0 DIADMM Cc1ccc(-c2ccc([N-]S(=O)(=O)c3ccccc3)cc2)cc1 ZINC001251146373 1061250918 /nfs/dbraw/zinc/25/09/18/1061250918.db2.gz VPLOPTHHKQITKD-UHFFFAOYSA-N -1 1 323.417 4.463 20 0 DIADMM CC(C)(C)c1ccc2[nH]c(-c3cc(Cl)ncc3[O-])nc2c1 ZINC001251252258 1061293091 /nfs/dbraw/zinc/29/30/91/1061293091.db2.gz RIQCAMPTTVDXPG-UHFFFAOYSA-N -1 1 301.777 4.281 20 0 DIADMM CC(C)(C)c1ccc2nc(-c3cc(Cl)ncc3[O-])[nH]c2c1 ZINC001251252258 1061293110 /nfs/dbraw/zinc/29/31/10/1061293110.db2.gz RIQCAMPTTVDXPG-UHFFFAOYSA-N -1 1 301.777 4.281 20 0 DIADMM CC(C)Cn1c2ccccc2nc1-c1c([O-])ccc(F)c1F ZINC001251322522 1061313851 /nfs/dbraw/zinc/31/38/51/1061313851.db2.gz YFRVZMYWFLFWQG-UHFFFAOYSA-N -1 1 302.324 4.343 20 0 DIADMM CCOc1ccc2nc(-c3c(F)ccc([O-])c3F)n(CC)c2c1 ZINC001251335373 1061317934 /nfs/dbraw/zinc/31/79/34/1061317934.db2.gz DUABTHNCLMWEKP-UHFFFAOYSA-N -1 1 318.323 4.106 20 0 DIADMM [O-]c1ccc(F)c(-c2nc3ccc(F)cc3n2C2CC2)c1F ZINC001251335566 1061317973 /nfs/dbraw/zinc/31/79/73/1061317973.db2.gz JUZYFMBVONXJJD-UHFFFAOYSA-N -1 1 304.271 4.161 20 0 DIADMM CCCn1c(-c2c(F)ccc([O-])c2F)nc2ccc(F)c(F)c21 ZINC001251335558 1061318862 /nfs/dbraw/zinc/31/88/62/1061318862.db2.gz JMCJVELOKPRPHR-UHFFFAOYSA-N -1 1 324.277 4.375 20 0 DIADMM CCCOc1ccc2nc(-c3c(F)ccc([O-])c3F)n(C)c2c1 ZINC001251335546 1061319670 /nfs/dbraw/zinc/31/96/70/1061319670.db2.gz IYOORLBQUWGDIZ-UHFFFAOYSA-N -1 1 318.323 4.013 20 0 DIADMM CCCn1c2cc(F)ccc2nc1-c1c(F)ccc([O-])c1F ZINC001251335598 1061319821 /nfs/dbraw/zinc/31/98/21/1061319821.db2.gz LLAZVAYMBCFGPP-UHFFFAOYSA-N -1 1 306.287 4.236 20 0 DIADMM Cc1ccc2c(c1)nc(-c1c(F)ccc([O-])c1F)n2CC1CC1 ZINC001251335889 1061322810 /nfs/dbraw/zinc/32/28/10/1061322810.db2.gz UHDLHJKRXIJXSE-UHFFFAOYSA-N -1 1 314.335 4.406 20 0 DIADMM Cc1cc(C(=O)Nc2cc(F)c([O-])cc2Cl)ccc1Cl ZINC001456598289 1061343289 /nfs/dbraw/zinc/34/32/89/1061343289.db2.gz BZNZHZYXWZPMHX-UHFFFAOYSA-N -1 1 314.143 4.399 20 0 DIADMM O=C(C/C=C/Cc1ccccc1)Nc1cc(F)c([O-])cc1Cl ZINC001456610295 1061345040 /nfs/dbraw/zinc/34/50/40/1061345040.db2.gz ZHOMVKVQOCRQKD-SNAWJCMRSA-N -1 1 319.763 4.312 20 0 DIADMM O=C(Nc1cc(F)c([O-])cc1Cl)c1cc(F)cc2ccoc21 ZINC001456620376 1061345556 /nfs/dbraw/zinc/34/55/56/1061345556.db2.gz ZZDNKXUHJGEXCO-UHFFFAOYSA-N -1 1 323.682 4.322 20 0 DIADMM Cc1cccc2c1nc(-c1ccc(Br)c([O-])c1)n2C ZINC001251473771 1061371371 /nfs/dbraw/zinc/37/13/71/1061371371.db2.gz PXYZCAHZNRKAGU-UHFFFAOYSA-N -1 1 317.186 4.017 20 0 DIADMM Cc1cc(C)c(S(=O)(=O)[N-]c2cccc3occc32)c(C)c1 ZINC001251496516 1061381696 /nfs/dbraw/zinc/38/16/96/1061381696.db2.gz HOSJZDDBCJUHPT-UHFFFAOYSA-N -1 1 315.394 4.159 20 0 DIADMM Cc1cc2ccccc2cc1[N-]S(=O)(=O)c1ccc(F)cc1 ZINC001251665407 1061438207 /nfs/dbraw/zinc/43/82/07/1061438207.db2.gz ZZECBSDRKVMBCZ-UHFFFAOYSA-N -1 1 315.369 4.088 20 0 DIADMM Cn1c(-c2cc(F)c(Cl)cc2[O-])nc2ccc(F)c(F)c21 ZINC001251680414 1061440828 /nfs/dbraw/zinc/44/08/28/1061440828.db2.gz BEWSCSQKGWBWCY-UHFFFAOYSA-N -1 1 312.678 4.017 20 0 DIADMM CSc1ccc2nc(-c3cc(F)c([O-])c(Cl)c3)[nH]c2c1 ZINC001251692790 1061445928 /nfs/dbraw/zinc/44/59/28/1061445928.db2.gz RBXCBIRKXASDCK-UHFFFAOYSA-N -1 1 308.765 4.450 20 0 DIADMM Cc1cc(C(=O)[O-])ccc1-c1nc2cc(F)cc(Cl)c2[nH]1 ZINC001251710790 1061453507 /nfs/dbraw/zinc/45/35/07/1061453507.db2.gz QRHUAXMVPKIGFT-UHFFFAOYSA-N -1 1 304.708 4.029 20 0 DIADMM CC(C)(C)c1ccc2nc(-c3ccc(F)cc3C(=O)[O-])[nH]c2c1 ZINC001251725147 1061458976 /nfs/dbraw/zinc/45/89/76/1061458976.db2.gz SKJPACXLDCHPEI-UHFFFAOYSA-N -1 1 312.344 4.365 20 0 DIADMM Cc1cc2nc(-c3ccc(F)cc3C(=O)[O-])[nH]c2cc1Cl ZINC001251725289 1061459467 /nfs/dbraw/zinc/45/94/67/1061459467.db2.gz XYFJJAWQAWEJGN-UHFFFAOYSA-N -1 1 304.708 4.029 20 0 DIADMM C/C(=C\c1cccc(Cl)c1)C(=O)Nc1ccc(F)cc1[O-] ZINC001457716163 1061487475 /nfs/dbraw/zinc/48/74/75/1061487475.db2.gz PMNDSCFQUIALOJ-JXMROGBWSA-N -1 1 305.736 4.227 20 0 DIADMM CCC[C@H](NC(=O)NCc1ccc([O-])c(Cl)c1)C1CCCC1 ZINC001251802035 1061494598 /nfs/dbraw/zinc/49/45/98/1061494598.db2.gz PTACYCORCNRHFR-HNNXBMFYSA-N -1 1 324.852 4.204 20 0 DIADMM CCC[C@@H](NC(=O)NCc1ccc([O-])c(Cl)c1)C1CCCC1 ZINC001251802037 1061494711 /nfs/dbraw/zinc/49/47/11/1061494711.db2.gz PTACYCORCNRHFR-OAHLLOKOSA-N -1 1 324.852 4.204 20 0 DIADMM O=C(Nc1ccc(Cl)c(Cl)c1)c1cccc([O-])c1F ZINC001463666611 1061512025 /nfs/dbraw/zinc/51/20/25/1061512025.db2.gz JTDGIOLSZULUNK-UHFFFAOYSA-N -1 1 300.116 4.090 20 0 DIADMM O=C(Nc1ccccc1Cc1ccccc1)c1ccc(F)c([O-])c1 ZINC001463860152 1061526912 /nfs/dbraw/zinc/52/69/12/1061526912.db2.gz DOJYSJPKUFELDW-UHFFFAOYSA-N -1 1 321.351 4.374 20 0 DIADMM Cc1ccc([C@@H](C)NC(=O)c2ccc(C(F)(F)F)cc2[O-])cc1 ZINC001464051034 1061549443 /nfs/dbraw/zinc/54/94/43/1061549443.db2.gz GEOJLQZOAPIGAU-LLVKDONJSA-N -1 1 323.314 4.210 20 0 DIADMM CCN(C(=O)c1cc(SC)ccc1[O-])c1cc(C)cc(C)c1 ZINC001464371851 1061585072 /nfs/dbraw/zinc/58/50/72/1061585072.db2.gz JIDZTFZBJPBCLH-UHFFFAOYSA-N -1 1 315.438 4.398 20 0 DIADMM [O-]c1c(-c2nnc(-c3ccc(F)cc3)o2)ccc2ccccc21 ZINC001252170898 1061602422 /nfs/dbraw/zinc/60/24/22/1061602422.db2.gz SPASZMDMHMKRSQ-UHFFFAOYSA-N -1 1 306.296 4.402 20 0 DIADMM [O-]c1c2ccsc2ccc1-c1nnc(-c2ccc(F)cc2)o1 ZINC001252180036 1061605760 /nfs/dbraw/zinc/60/57/60/1061605760.db2.gz OVXHQUWUPKTSGX-UHFFFAOYSA-N -1 1 312.325 4.463 20 0 DIADMM CCc1ccc(Cl)cc1[N-]S(=O)(=O)c1ccc(C)cc1 ZINC001252198038 1061605984 /nfs/dbraw/zinc/60/59/84/1061605984.db2.gz HWRGNTWQXLQCED-UHFFFAOYSA-N -1 1 309.818 4.012 20 0 DIADMM O=C(N[C@@H](c1ccccc1)C1CCCC1)c1cc(F)ccc1[O-] ZINC001464598484 1061610605 /nfs/dbraw/zinc/61/06/05/1061610605.db2.gz IBDXVDBMXLZEPC-SFHVURJKSA-N -1 1 313.372 4.193 20 0 DIADMM CC(C)[C@@H]1CC[C@@H](C)C[C@H]1CNC(=O)c1ccc(Cl)cc1[O-] ZINC001464598231 1061610763 /nfs/dbraw/zinc/61/07/63/1061610763.db2.gz ROIXQXCCWNZMKO-IPYPFGDCSA-N -1 1 323.864 4.484 20 0 DIADMM CC(C)[C@@H]1CC[C@@H](C)C[C@@H]1CNC(=O)c1ccc(Cl)cc1[O-] ZINC001464598234 1061612576 /nfs/dbraw/zinc/61/25/76/1061612576.db2.gz ROIXQXCCWNZMKO-NFAWXSAZSA-N -1 1 323.864 4.484 20 0 DIADMM COc1cc(-c2nnc(-c3ccc(C)cc3)o2)cc(Cl)c1[O-] ZINC001252690353 1061696096 /nfs/dbraw/zinc/69/60/96/1061696096.db2.gz JEKCRBMUZAMUGD-UHFFFAOYSA-N -1 1 316.744 4.080 20 0 DIADMM Cc1ccc(-c2nnc(-c3cc(C(F)(F)F)ccc3[O-])o2)cc1 ZINC001252690272 1061696357 /nfs/dbraw/zinc/69/63/57/1061696357.db2.gz HSLDYRKXOHTROQ-UHFFFAOYSA-N -1 1 320.270 4.436 20 0 DIADMM CN(C(=O)Cc1ccc([O-])c(Cl)c1)C1CCC(C)(C)CC1 ZINC001465809909 1061816085 /nfs/dbraw/zinc/81/60/85/1061816085.db2.gz QQIYIPYDEROKEM-UHFFFAOYSA-N -1 1 309.837 4.015 20 0 DIADMM CC(C)c1ccc(C[C@@H](C)NC(=O)c2cc(F)ccc2[O-])cc1 ZINC001466093499 1061874296 /nfs/dbraw/zinc/87/42/96/1061874296.db2.gz ISHOVXGAUBPUGQ-CYBMUJFWSA-N -1 1 315.388 4.016 20 0 DIADMM C[C@H]1CCN(Cc2ccc([O-])c(F)c2F)[C@@H](c2ccco2)C1 ZINC001474319929 1061898866 /nfs/dbraw/zinc/89/88/66/1061898866.db2.gz SYLFNOKOVDBUES-WCQYABFASA-N -1 1 307.340 4.237 20 0 DIADMM CCOc1cc(NC(=O)Nc2ccc([O-])c(Cl)c2)ccc1C ZINC001466521997 1061956640 /nfs/dbraw/zinc/95/66/40/1061956640.db2.gz VRSIWJYMUZWSLU-UHFFFAOYSA-N -1 1 320.776 4.397 20 0 DIADMM CC(C)(C)[C@H](O)CNc1cc(Cl)c(Cl)c(Cl)c1[O-] ZINC001253739517 1061968764 /nfs/dbraw/zinc/96/87/64/1061968764.db2.gz FLDHEDCHMMHRSZ-MRVPVSSYSA-N -1 1 312.624 4.171 20 0 DIADMM Cc1nc(SC[C@@H](OC(C)C)c2ccccc2)[n-]c(=O)c1C ZINC001459012663 1061974584 /nfs/dbraw/zinc/97/45/84/1061974584.db2.gz BHAGNNJJTQMJKD-OAHLLOKOSA-N -1 1 318.442 4.057 20 0 DIADMM [O-]c1c(-c2nnc(-c3cccc(F)c3)o2)cc(O)c2ccccc12 ZINC001254140844 1062030077 /nfs/dbraw/zinc/03/00/77/1062030077.db2.gz RFLVUCQTTSOHEM-UHFFFAOYSA-N -1 1 322.295 4.107 20 0 DIADMM CC(C)(C)[C@H]1CCC[C@H](NC(=O)c2cccc([O-])c2F)CC1 ZINC001466945414 1062032166 /nfs/dbraw/zinc/03/21/66/1062032166.db2.gz RSUJNZQTBWNYRM-STQMWFEESA-N -1 1 307.409 4.256 20 0 DIADMM Cc1c2cc(C)ccc2[nH]c1C(=O)Nc1ccc([O-])c(F)c1F ZINC001468003762 1062247975 /nfs/dbraw/zinc/24/79/75/1062247975.db2.gz PFXOSLHDLUZIKB-UHFFFAOYSA-N -1 1 316.307 4.021 20 0 DIADMM COc1ccc2c(c1)N(Cc1ccc([O-])c(F)c1F)CCCC2 ZINC001474591398 1062305318 /nfs/dbraw/zinc/30/53/18/1062305318.db2.gz IUAFTMHSMHOJBU-UHFFFAOYSA-N -1 1 319.351 4.022 20 0 DIADMM COc1ccc(-c2nnc(-c3ccc(Cl)cc3C)o2)c([O-])c1 ZINC001255268679 1062373012 /nfs/dbraw/zinc/37/30/12/1062373012.db2.gz UXWOKAGZZANAPQ-UHFFFAOYSA-N -1 1 316.744 4.080 20 0 DIADMM C/C(=C\c1cccc(Cl)c1)C(=O)Nc1cc([O-])c(F)cc1F ZINC001468747664 1062392099 /nfs/dbraw/zinc/39/20/99/1062392099.db2.gz KEQXFXOYGLSNOJ-WEVVVXLNSA-N -1 1 323.726 4.366 20 0 DIADMM CC1(C)CCc2cccc(NCc3ccc([O-])c(F)c3F)c2O1 ZINC001474717078 1062442795 /nfs/dbraw/zinc/44/27/95/1062442795.db2.gz FQRPJNQEKKTKQR-UHFFFAOYSA-N -1 1 319.351 4.386 20 0 DIADMM Cc1cc(C)c(/C=C/C(=O)Nc2cc(F)cc(F)c2[O-])cc1C ZINC001469159177 1062490817 /nfs/dbraw/zinc/49/08/17/1062490817.db2.gz CGJYEXUOHWLWJD-SNAWJCMRSA-N -1 1 317.335 4.248 20 0 DIADMM O=C(Nc1cc(F)cc(F)c1[O-])c1ccc(C(F)(F)F)s1 ZINC001469162033 1062492092 /nfs/dbraw/zinc/49/20/92/1062492092.db2.gz SEZHWVGIFGLRAY-UHFFFAOYSA-N -1 1 323.242 4.003 20 0 DIADMM CCCC[C@H](CCC)C[N-]S(=O)(=O)c1sccc1Cl ZINC001475079718 1062492353 /nfs/dbraw/zinc/49/23/53/1062492353.db2.gz VYDGSRXYFHCSSV-NSHDSACASA-N -1 1 323.911 4.286 20 0 DIADMM Cc1ccc([N-]S(=O)(=O)c2cccc(F)c2)c2ccccc12 ZINC001255647618 1062497977 /nfs/dbraw/zinc/49/79/77/1062497977.db2.gz IELSDRYRVYOCTR-UHFFFAOYSA-N -1 1 315.369 4.088 20 0 DIADMM CC(C)(CNC(=O)NCc1ccc([O-])c(Cl)c1)C1CCCC1 ZINC001469432078 1062552590 /nfs/dbraw/zinc/55/25/90/1062552590.db2.gz QKFBTBDMALFBMA-UHFFFAOYSA-N -1 1 324.852 4.061 20 0 DIADMM CC(=O)c1cc(NC(=O)c2ccc3ccccc3c2[O-])ccc1C ZINC001469525092 1062573852 /nfs/dbraw/zinc/57/38/52/1062573852.db2.gz XYYDKRNSUKCHRT-UHFFFAOYSA-N -1 1 319.360 4.309 20 0 DIADMM CCc1cccc(C(=O)Nc2ccc(C(=O)C(C)C)cc2)c1[O-] ZINC001469615674 1062588246 /nfs/dbraw/zinc/58/82/46/1062588246.db2.gz NAKYAHPUFIBKTJ-UHFFFAOYSA-N -1 1 311.381 4.046 20 0 DIADMM CCCc1ccc(CCCC(=O)Nc2c([O-])cccc2F)cc1 ZINC001469929966 1062660813 /nfs/dbraw/zinc/66/08/13/1062660813.db2.gz XPPUGMPFXWTUQO-UHFFFAOYSA-N -1 1 315.388 4.445 20 0 DIADMM CC1(C)CC(CNC(=O)c2cc(F)ccc2[O-])CC(C)(C)C1 ZINC001469933675 1062664324 /nfs/dbraw/zinc/66/43/24/1062664324.db2.gz NGWTYCNSKAIBFD-UHFFFAOYSA-N -1 1 307.409 4.114 20 0 DIADMM CCCCCC[C@H](C)NC(=O)NCc1ccc([O-])c(Cl)c1 ZINC001477306961 1062836414 /nfs/dbraw/zinc/83/64/14/1062836414.db2.gz MQNRRANLNTXHFH-LBPRGKRZSA-N -1 1 312.841 4.204 20 0 DIADMM Cc1ccc(-c2nnc(-c3ccc4cccnc4c3[O-])o2)cc1C ZINC001256538480 1062864396 /nfs/dbraw/zinc/86/43/96/1062864396.db2.gz KMBKSNICDNJBGD-UHFFFAOYSA-N -1 1 317.348 4.274 20 0 DIADMM C[C@H](NC(=O)c1ccc2ccccc2c1[O-])[C@]12C[C@H]1CCCC2 ZINC001471098118 1062924711 /nfs/dbraw/zinc/92/47/11/1062924711.db2.gz KVEVWWPJMKPXAR-AGKSTNPPSA-N -1 1 309.409 4.244 20 0 DIADMM O=C(Nc1nc(C2CCCCC2)cs1)c1ccc(F)c([O-])c1 ZINC001471136233 1062929300 /nfs/dbraw/zinc/92/93/00/1062929300.db2.gz ZLJMHKQURBNGEN-UHFFFAOYSA-N -1 1 320.389 4.288 20 0 DIADMM Cc1ccc(-c2ccc(C(=O)Nc3cccc(F)c3[O-])s2)o1 ZINC001471166377 1062931640 /nfs/dbraw/zinc/93/16/40/1062931640.db2.gz HTLKUBSYRGAKKC-UHFFFAOYSA-N -1 1 317.341 4.414 20 0 DIADMM O=S(=O)([N-]c1ccccc1C1CC1)c1cccc(Cl)c1 ZINC001256699944 1062948355 /nfs/dbraw/zinc/94/83/55/1062948355.db2.gz NJCGBNRGOGKYBQ-UHFFFAOYSA-N -1 1 307.802 4.018 20 0 DIADMM O=S(=O)([N-]c1ccc(C2CC2)cc1)c1cccc(Cl)c1 ZINC001256795257 1062982874 /nfs/dbraw/zinc/98/28/74/1062982874.db2.gz CCMZBHPWULHNSU-UHFFFAOYSA-N -1 1 307.802 4.018 20 0 DIADMM CC(C)Cc1ccccc1[N-]S(=O)(=O)c1cccc(Cl)c1 ZINC001256804309 1062990237 /nfs/dbraw/zinc/99/02/37/1062990237.db2.gz RDDARJRPCPTWJK-UHFFFAOYSA-N -1 1 323.845 4.339 20 0 DIADMM Cc1cc(F)ccc1[C@@H](C)NC(=O)c1ccc2ccccc2c1[O-] ZINC001471755216 1063019557 /nfs/dbraw/zinc/01/95/57/1063019557.db2.gz WESINKCBDIZRCB-CYBMUJFWSA-N -1 1 323.367 4.484 20 0 DIADMM CC(C)Oc1ccc(-c2nnc(-c3cc(F)ccc3[O-])o2)cc1 ZINC001256921221 1063050306 /nfs/dbraw/zinc/05/03/06/1063050306.db2.gz JQSRFNCYYYEECE-UHFFFAOYSA-N -1 1 314.316 4.036 20 0 DIADMM Cc1cccc(S(=O)(=O)[N-]c2ccc(-c3ccco3)cc2)c1 ZINC001256929465 1063054801 /nfs/dbraw/zinc/05/48/01/1063054801.db2.gz UIEUNOMIEPEBPK-UHFFFAOYSA-N -1 1 313.378 4.056 20 0 DIADMM CCCCc1ccccc1[N-]S(=O)(=O)c1cccc(C)c1 ZINC001256947346 1063057751 /nfs/dbraw/zinc/05/77/51/1063057751.db2.gz XORXPHZYAJTIRB-UHFFFAOYSA-N -1 1 303.427 4.138 20 0 DIADMM O=C(Nc1cc(F)c([O-])cc1Cl)c1cc2cc(F)ccc2o1 ZINC001472193325 1063058500 /nfs/dbraw/zinc/05/85/00/1063058500.db2.gz VSNNZWOAJJQAQC-UHFFFAOYSA-N -1 1 323.682 4.322 20 0 DIADMM CC[C@@H]1c2ccccc2CN1C(=O)c1ccc(Cl)cc1[O-] ZINC001472273622 1063064583 /nfs/dbraw/zinc/06/45/83/1063064583.db2.gz KNIOGMQAQFUMPE-OAHLLOKOSA-N -1 1 301.773 4.153 20 0 DIADMM Cc1ccc([C@H]2C[C@@H]2c2nnc(-c3cc([O-])cc(F)c3)o2)cc1 ZINC001257325930 1063208852 /nfs/dbraw/zinc/20/88/52/1063208852.db2.gz VGPGMOQIPLYQMD-CVEARBPZSA-N -1 1 310.328 4.161 20 0 DIADMM Cc1ccc([C@@H]2C[C@H]2c2nnc(-c3ccc([O-])cc3F)o2)cc1 ZINC001257326182 1063209585 /nfs/dbraw/zinc/20/95/85/1063209585.db2.gz XBMRPEPUVNBRMJ-LSDHHAIUSA-N -1 1 310.328 4.161 20 0 DIADMM O=C(NCc1ccc([O-])c(Cl)c1)N1CCCC12CCCCC2 ZINC001479211673 1063399583 /nfs/dbraw/zinc/39/95/83/1063399583.db2.gz OHFHTGPJQKIQCX-UHFFFAOYSA-N -1 1 322.836 4.054 20 0 DIADMM CC(C)(C)Cc1nnc(-c2cc(C(F)(F)F)ccc2[O-])o1 ZINC001257899570 1063433603 /nfs/dbraw/zinc/43/36/03/1063433603.db2.gz XBGCZNHJEKPVBT-UHFFFAOYSA-N -1 1 300.280 4.050 20 0 DIADMM [O-]c1c(-c2nnc(Cc3cccc(F)c3)o2)ccc2ccccc21 ZINC001258494106 1063673426 /nfs/dbraw/zinc/67/34/26/1063673426.db2.gz YFMXLYYKYWMMIA-UHFFFAOYSA-N -1 1 320.323 4.325 20 0 DIADMM Cc1ccc(-c2nnc(-c3ccc([O-])cc3Cl)o2)cc1F ZINC001258719267 1063774649 /nfs/dbraw/zinc/77/46/49/1063774649.db2.gz SZMXVUGXWLNXNG-UHFFFAOYSA-N -1 1 304.708 4.210 20 0 DIADMM Cc1ccc(S(=O)(=O)[N-]c2ccc3occc3c2)cc1Cl ZINC001259135950 1063885539 /nfs/dbraw/zinc/88/55/39/1063885539.db2.gz JYUOTSINPKVPBH-UHFFFAOYSA-N -1 1 321.785 4.195 20 0 DIADMM Cc1ccc(S(=O)(=O)[N-]c2cccc3occc32)cc1Cl ZINC001259136730 1063885735 /nfs/dbraw/zinc/88/57/35/1063885735.db2.gz NNMNQGHAJLUIMV-UHFFFAOYSA-N -1 1 321.785 4.195 20 0 DIADMM CC(C)(C)c1cccc(C(=O)Nc2cc(F)cc(F)c2[O-])c1 ZINC001299582246 1063888009 /nfs/dbraw/zinc/88/80/09/1063888009.db2.gz ZVIDGYDNUAXAKG-UHFFFAOYSA-N -1 1 305.324 4.220 20 0 DIADMM Cc1cc(C)cc(S(=O)(=O)[N-]c2ccc(C)c(Cl)c2)c1 ZINC001259516305 1063889796 /nfs/dbraw/zinc/88/97/96/1063889796.db2.gz KSHPSLJHOUNBFP-UHFFFAOYSA-N -1 1 309.818 4.066 20 0 DIADMM Cc1cc(C)cc(S(=O)(=O)[N-]c2ccc(Cl)c(C)c2)c1 ZINC001259522212 1063890650 /nfs/dbraw/zinc/89/06/50/1063890650.db2.gz HCAFTLFBKUQORP-UHFFFAOYSA-N -1 1 309.818 4.066 20 0 DIADMM Cc1ccsc1S(=O)(=O)[N-]c1c(F)cccc1C(C)C ZINC001260069743 1063897342 /nfs/dbraw/zinc/89/73/42/1063897342.db2.gz ULKMHKZOWHFTBI-UHFFFAOYSA-N -1 1 313.419 4.120 20 0 DIADMM CC[C@H](C)S(=O)(=O)[N-]c1ccccc1Oc1ccc(F)cc1 ZINC001260723241 1063903740 /nfs/dbraw/zinc/90/37/40/1063903740.db2.gz KWJQYDBPLKKGJP-LBPRGKRZSA-N -1 1 323.389 4.158 20 0 DIADMM Cc1cccc(S(=O)(=O)[N-]c2cccc(C(F)F)c2)c1C ZINC001260997559 1063907677 /nfs/dbraw/zinc/90/76/77/1063907677.db2.gz BJEYZNGBEIYCOT-UHFFFAOYSA-N -1 1 311.353 4.042 20 0 DIADMM Cc1cccc(S(=O)(=O)[N-]c2ccccc2CC(C)C)c1C ZINC001260998706 1063908223 /nfs/dbraw/zinc/90/82/23/1063908223.db2.gz KPRAOFRPCPXESN-UHFFFAOYSA-N -1 1 317.454 4.303 20 0 DIADMM O=C(NC[C@@H]1CCCCC1(F)F)c1ccc2ccccc2c1[O-] ZINC000391042518 1064179213 /nfs/dbraw/zinc/17/92/13/1064179213.db2.gz RDTUBKNCDRBLER-ZDUSSCGKSA-N -1 1 319.351 4.101 20 0 DIADMM O=C(Nc1cccc2ccncc21)c1cc2ccccc2cc1[O-] ZINC000391698723 1064198537 /nfs/dbraw/zinc/19/85/37/1064198537.db2.gz WMQOAOGCJNNCIX-UHFFFAOYSA-N -1 1 314.344 4.346 20 0 DIADMM Cc1cc(-c2noc(-c3ccc4ccccc4c3[O-])n2)cc(C)n1 ZINC000392353348 1064228726 /nfs/dbraw/zinc/22/87/26/1064228726.db2.gz LKRHIBDZXLUCSL-UHFFFAOYSA-N -1 1 317.348 4.274 20 0 DIADMM CN(Cc1ccc(C(C)(C)C)cc1)C(=O)c1cccc([O-])c1F ZINC001289982689 1064674023 /nfs/dbraw/zinc/67/40/23/1064674023.db2.gz PARGGZUEKNYMMC-UHFFFAOYSA-N -1 1 315.388 4.101 20 0 DIADMM O=C(Nc1cc(Cl)cc(Cl)c1)c1ccc(F)c([O-])c1 ZINC001290431938 1064694206 /nfs/dbraw/zinc/69/42/06/1064694206.db2.gz UBAJZMXUJZSFOW-UHFFFAOYSA-N -1 1 300.116 4.090 20 0 DIADMM O=C(c1ccc([O-])cc1F)N1CCC[C@H]1c1ccc(Cl)cc1 ZINC001290673490 1064704115 /nfs/dbraw/zinc/70/41/15/1064704115.db2.gz HWIFJFYCSWSZLJ-INIZCTEOSA-N -1 1 319.763 4.162 20 0 DIADMM CCCCN(CCCC)C(=O)c1ccc(C(F)(F)F)c([O-])c1 ZINC001290936385 1064717596 /nfs/dbraw/zinc/71/75/96/1064717596.db2.gz HGMLMLJDMRWDFD-UHFFFAOYSA-N -1 1 317.351 4.453 20 0 DIADMM CC(C)[C@@H]1CC[C@@H](C)C[C@@H]1CNC(=O)c1c([O-])cccc1Cl ZINC001292405366 1064773062 /nfs/dbraw/zinc/77/30/62/1064773062.db2.gz JSUPVCVNHUKUKJ-MCIONIFRSA-N -1 1 323.864 4.484 20 0 DIADMM Cc1ccc(C(C)(C)CNC(=O)c2cc(Cl)ccc2[O-])cc1 ZINC001292928439 1064793186 /nfs/dbraw/zinc/79/31/86/1064793186.db2.gz FDMGLGKTOKXVSA-UHFFFAOYSA-N -1 1 317.816 4.062 20 0 DIADMM CC(C)CCOc1ccc(NC(=O)c2cccc([O-])c2F)cc1 ZINC001293948369 1064840019 /nfs/dbraw/zinc/84/00/19/1064840019.db2.gz ATMKINUFKFXHSU-UHFFFAOYSA-N -1 1 317.360 4.209 20 0 DIADMM CC1(C)C[C@H](NC(=O)c2c([O-])cccc2Cl)c2ccccc21 ZINC001294741975 1064883034 /nfs/dbraw/zinc/88/30/34/1064883034.db2.gz NFDJEVDWUPJHTE-AWEZNQCLSA-N -1 1 315.800 4.198 20 0 DIADMM CSc1ccc([O-])c(C(=O)Nc2cccc(SC)c2C)c1 ZINC001295734073 1064925531 /nfs/dbraw/zinc/92/55/31/1064925531.db2.gz RFLSFYSRMLMTNQ-UHFFFAOYSA-N -1 1 319.451 4.397 20 0 DIADMM CC(C)(C)[C@@H]1CN(C(=O)c2ccc(F)c([O-])c2)c2ccccc21 ZINC001297186931 1064971668 /nfs/dbraw/zinc/97/16/68/1064971668.db2.gz UCDKSPAHTNQXNH-CQSZACIVSA-N -1 1 313.372 4.321 20 0 DIADMM O=C(Cc1cccc2ccccc21)Nc1ccc([O-])c(F)c1F ZINC001297821540 1064991688 /nfs/dbraw/zinc/99/16/88/1064991688.db2.gz VZRDYIRKZJCVNB-UHFFFAOYSA-N -1 1 313.303 4.005 20 0 DIADMM O=C(Nc1cc(C2CC2)ccn1)c1cc2ccccc2cc1[O-] ZINC001298765589 1065019972 /nfs/dbraw/zinc/01/99/72/1065019972.db2.gz WEUXBAFVNRYXAA-UHFFFAOYSA-N -1 1 304.349 4.070 20 0 DIADMM O=C(Nc1cc([O-])c(F)cc1F)[C@H]1CCC[C@H]1c1ccccc1 ZINC001298972535 1065027082 /nfs/dbraw/zinc/02/70/82/1065027082.db2.gz GLCREZSKOFQKPS-STQMWFEESA-N -1 1 317.335 4.193 20 0 DIADMM C/C(=C\c1ccccc1Cl)C(=O)Nc1cc([O-])c(F)cc1F ZINC001298975659 1065027541 /nfs/dbraw/zinc/02/75/41/1065027541.db2.gz YOQSFYYFHJXKKD-RMKNXTFCSA-N -1 1 323.726 4.366 20 0 DIADMM O=C(Nc1cc([O-])c(F)cc1F)c1cc2ccccc2s1 ZINC001298971283 1065027823 /nfs/dbraw/zinc/02/78/23/1065027823.db2.gz PXMLCXOCWDDWMK-UHFFFAOYSA-N -1 1 305.305 4.137 20 0 DIADMM O=C(Cc1ccsc1)Nc1cc(Cl)c([O-])c2ccccc12 ZINC001301157659 1065054068 /nfs/dbraw/zinc/05/40/68/1065054068.db2.gz SPONUQNKWLMCAJ-UHFFFAOYSA-N -1 1 317.797 4.442 20 0 DIADMM CCOc1cc(C(=O)Nc2ccsc2C)cc(Cl)c1[O-] ZINC001302368008 1065085104 /nfs/dbraw/zinc/08/51/04/1065085104.db2.gz RTPFZLWLMMSDIM-UHFFFAOYSA-N -1 1 311.790 4.067 20 0 DIADMM O=C(Nc1cccc(F)c1[O-])c1ccccc1Cc1ccccc1 ZINC001302482263 1065089410 /nfs/dbraw/zinc/08/94/10/1065089410.db2.gz UQHULVVIQHNINH-UHFFFAOYSA-N -1 1 321.351 4.374 20 0 DIADMM O=C(Nc1cccc(F)c1[O-])C1(c2cccs2)CCCCC1 ZINC001302484429 1065089747 /nfs/dbraw/zinc/08/97/47/1065089747.db2.gz CGXMUOXRSXXLKL-UHFFFAOYSA-N -1 1 319.401 4.433 20 0 DIADMM O=C(Nc1cccc(F)c1[O-])C(c1ccccc1)c1ccccc1 ZINC001302482344 1065090513 /nfs/dbraw/zinc/09/05/13/1065090513.db2.gz YHFDMRPPLWMPNV-UHFFFAOYSA-N -1 1 321.351 4.302 20 0 DIADMM CC(C)[C@@H](CCc1ccccc1)C(=O)[N-]Oc1ccccc1F ZINC001303333175 1065113299 /nfs/dbraw/zinc/11/32/99/1065113299.db2.gz WWGLRIHYRMGGKY-MRXNPFEDSA-N -1 1 315.388 4.141 20 0 DIADMM Cc1cccc(C)c1CN(C)C(=O)c1cc2ccccc2cc1[O-] ZINC001304180975 1065131560 /nfs/dbraw/zinc/13/15/60/1065131560.db2.gz DNZRRHGAFNLHKI-UHFFFAOYSA-N -1 1 319.404 4.434 20 0 DIADMM CC(C)(C)c1ccc(C(=O)Nc2cc(F)c([O-])cc2Cl)nc1 ZINC001304284888 1065135529 /nfs/dbraw/zinc/13/55/29/1065135529.db2.gz RRHZBHDVSSLXAU-UHFFFAOYSA-N -1 1 322.767 4.130 20 0 DIADMM CC(C)(C)c1coc(NC(=O)c2ccc3ccccc3c2[O-])n1 ZINC001305249716 1065152688 /nfs/dbraw/zinc/15/26/88/1065152688.db2.gz IRRBGCKQWQAJPM-UHFFFAOYSA-N -1 1 310.353 4.083 20 0 DIADMM CCCc1cc(=O)[n-]c(SC[C@@H]2CCCCC2(F)F)n1 ZINC001307253834 1065315758 /nfs/dbraw/zinc/31/57/58/1065315758.db2.gz RANZFMGHSUMEMR-JTQLQIEISA-N -1 1 302.390 4.052 20 0 DIADMM Cc1c(=O)[n-]c(SC[C@@H]2C[C@H]3C=C[C@@H]2C3)nc1-c1ccccc1 ZINC001307327614 1065343103 /nfs/dbraw/zinc/34/31/03/1065343103.db2.gz OCRHASIZVDOFST-IMJJTQAJSA-N -1 1 324.449 4.462 20 0 DIADMM CC[C@@H]([N-]S(=O)(=O)c1sccc1Cl)C1CCCCC1 ZINC001309130231 1066444676 /nfs/dbraw/zinc/44/46/76/1066444676.db2.gz LERINCOWJISVAC-GFCCVEGCSA-N -1 1 321.895 4.039 20 0 DIADMM Cc1oc(C(C)C)nc1-c1nc(-c2ccc([O-])cc2Cl)no1 ZINC000289150305 131362500 /nfs/dbraw/zinc/36/25/00/131362500.db2.gz SWTZMXJFQYKZTO-UHFFFAOYSA-N -1 1 319.748 4.182 20 0 DIADMM O=C([O-])CC[C@H]1CCCN(Cc2ccc(Cl)cc2Cl)C1 ZINC000043585428 132155631 /nfs/dbraw/zinc/15/56/31/132155631.db2.gz WUWBMLWZHZGKNI-LLVKDONJSA-N -1 1 316.228 4.070 20 0 DIADMM O=C(Nc1ccc([O-])c(Cl)c1)[C@@H]1C[C@H]1c1cccc(F)c1F ZINC000173378602 332829020 /nfs/dbraw/zinc/82/90/20/332829020.db2.gz XPZWTPFCOHJWAB-WDEREUQCSA-N -1 1 323.726 4.066 20 0 DIADMM COC(C)(C)CCSc1nc(-c2ccccc2)c(C)c(=O)[n-]1 ZINC000556339728 331671597 /nfs/dbraw/zinc/67/15/97/331671597.db2.gz OACRGBAWQDVHDK-UHFFFAOYSA-N -1 1 318.442 4.065 20 0 DIADMM O=C(Nc1ccc([O-])c(Cl)c1)[C@H]1CCCc2sccc21 ZINC000130050478 332022222 /nfs/dbraw/zinc/02/22/22/332022222.db2.gz FPXVICNXITYSSS-NSHDSACASA-N -1 1 307.802 4.166 20 0 DIADMM CCSc1cccc(CN[C@@H](CC(=O)[O-])c2ccc(C)o2)c1 ZINC000426783234 332152691 /nfs/dbraw/zinc/15/26/91/332152691.db2.gz KFSDLKBJJFOTDR-HNNXBMFYSA-N -1 1 319.426 4.006 20 0 DIADMM O=C([O-])C[C@H](NCc1ccccc1Cl)c1cccc(Cl)c1 ZINC000426819875 332157611 /nfs/dbraw/zinc/15/76/11/332157611.db2.gz WTVSGUUPBNHXNK-HNNXBMFYSA-N -1 1 324.207 4.299 20 0 DIADMM Cc1cnc(C(=O)N(CC2CCC2)[C@H](C)c2ccccc2)c([O-])c1 ZINC000427465169 332431443 /nfs/dbraw/zinc/43/14/43/332431443.db2.gz LQSXPEULSMKJGJ-OAHLLOKOSA-N -1 1 324.424 4.099 20 0 DIADMM Cc1cccc([N-]S(=O)(=O)c2cccc(C(C)C)c2)c1C ZINC000460414312 333081712 /nfs/dbraw/zinc/08/17/12/333081712.db2.gz WPBOWAOTZJWTAS-UHFFFAOYSA-N -1 1 303.427 4.228 20 0 DIADMM CCSc1ccc(-c2noc(-c3cc(F)ccc3[O-])n2)cc1 ZINC000318675111 333201198 /nfs/dbraw/zinc/20/11/98/333201198.db2.gz KKIMHAVZOJXHAC-UHFFFAOYSA-N -1 1 316.357 4.360 20 0 DIADMM CCc1ccccc1[N-]S(=O)(=O)c1cccc2ccccc21 ZINC000319377855 333289693 /nfs/dbraw/zinc/28/96/93/333289693.db2.gz JXYXBDMEVZAICY-UHFFFAOYSA-N -1 1 311.406 4.203 20 0 DIADMM O=C([O-])[C@H](NCc1ccc(-c2ccccc2)s1)c1ccccc1 ZINC000390700100 333315958 /nfs/dbraw/zinc/31/59/58/333315958.db2.gz SUJRALLJFCLOFM-GOSISDBHSA-N -1 1 323.417 4.331 20 0 DIADMM O=C(c1ccc2ccccc2c1[O-])N1CCC2(C1)CCCCC2 ZINC000391921731 335135882 /nfs/dbraw/zinc/13/58/82/335135882.db2.gz RYHQKWJYZRSSME-UHFFFAOYSA-N -1 1 309.409 4.342 20 0 DIADMM C[C@H](NC(=O)c1ccc([O-])cc1F)c1cc2ccccc2s1 ZINC000185436548 333369889 /nfs/dbraw/zinc/36/98/89/333369889.db2.gz NQEYTNBVWGAAET-JTQLQIEISA-N -1 1 315.369 4.237 20 0 DIADMM O=C(Nc1ccc([O-])c(Cl)c1)[C@@H]1CCC[C@H](C(F)(F)F)C1 ZINC000096482089 333482253 /nfs/dbraw/zinc/48/22/53/333482253.db2.gz LTDXBYKHLBYLRT-BDAKNGLRSA-N -1 1 321.726 4.353 20 0 DIADMM C[C@@H](c1nc(-c2ccc([O-])c(F)c2)no1)c1cccc(Cl)c1 ZINC000445486097 333515760 /nfs/dbraw/zinc/51/57/60/333515760.db2.gz IITQVGDVRBCJKS-SECBINFHSA-N -1 1 318.735 4.387 20 0 DIADMM Cc1nc(-c2nc(=O)c3c(C)c(-c4ccccc4)sc3[n-]2)co1 ZINC000571200925 333681062 /nfs/dbraw/zinc/68/10/62/333681062.db2.gz CPGZNMNFUZMEAE-UHFFFAOYSA-N -1 1 323.377 4.336 20 0 DIADMM CSCc1cccc(-c2noc(-c3cc(F)ccc3[O-])n2)c1 ZINC000436932296 334018245 /nfs/dbraw/zinc/01/82/45/334018245.db2.gz NBSIEVFGZMKXKU-UHFFFAOYSA-N -1 1 316.357 4.111 20 0 DIADMM Cc1cc2cc(NC(=O)c3c[nH]nc3-c3ccsc3)ccc2[nH]1 ZINC000187849572 334276056 /nfs/dbraw/zinc/27/60/56/334276056.db2.gz OECHDNUYCXMRKU-UHFFFAOYSA-N -1 1 322.393 4.180 20 0 DIADMM Cc1ccc(C)c([N-]S(=O)(=O)c2cccc(Cl)c2C)c1 ZINC000048652034 334290955 /nfs/dbraw/zinc/29/09/55/334290955.db2.gz AIFRVKCCHIDZGI-UHFFFAOYSA-N -1 1 309.818 4.066 20 0 DIADMM CCc1ccccc1[N-]S(=O)(=O)c1cccc(Cl)c1C ZINC000048653425 334291274 /nfs/dbraw/zinc/29/12/74/334291274.db2.gz YXZGUNQPJDSOQA-UHFFFAOYSA-N -1 1 309.818 4.012 20 0 DIADMM CCC(CC)(CC)CNC(=O)c1cc(Cl)c([O-])c(OC)c1 ZINC000443049335 338442405 /nfs/dbraw/zinc/44/24/05/338442405.db2.gz LDDLRXPFLRMCKM-UHFFFAOYSA-N -1 1 313.825 4.000 20 0 DIADMM C[C@@H](CC(=O)Nc1ccc([O-])c(Cl)c1)c1ccc(F)cc1 ZINC000111666961 334352600 /nfs/dbraw/zinc/35/26/00/334352600.db2.gz COQWQXRJRJGMJX-JTQLQIEISA-N -1 1 307.752 4.317 20 0 DIADMM O=C(CCSc1ccccc1)Nc1ccc([O-])c(Cl)c1 ZINC000111666895 334352698 /nfs/dbraw/zinc/35/26/98/334352698.db2.gz KOZRWNYGZKLZNZ-UHFFFAOYSA-N -1 1 307.802 4.167 20 0 DIADMM Cc1c(C(=O)Nc2ccc(F)cc2[O-])sc2nccc(C)c12 ZINC000532012657 334373674 /nfs/dbraw/zinc/37/36/74/334373674.db2.gz FVHDSKHMSZOWBD-UHFFFAOYSA-N -1 1 316.357 4.010 20 0 DIADMM O=C(Nc1ccc(F)cc1[O-])c1ccc(Cl)cc1Cl ZINC000532012998 334373839 /nfs/dbraw/zinc/37/38/39/334373839.db2.gz XVIPPDFLMKIOFK-UHFFFAOYSA-N -1 1 300.116 4.090 20 0 DIADMM CC[C@H](C)Sc1ccc(NC(=O)c2cncc([O-])c2)c(C)c1 ZINC000518879344 335664097 /nfs/dbraw/zinc/66/40/97/335664097.db2.gz UXJVASMFVAULCY-LBPRGKRZSA-N -1 1 316.426 4.239 20 0 DIADMM Cc1c(Cl)cc(F)c([N-]C(=O)c2cc(C(C)C)no2)c1F ZINC000535642583 335701937 /nfs/dbraw/zinc/70/19/37/335701937.db2.gz LPDLAQCHXWOMHO-UHFFFAOYSA-N -1 1 314.719 4.290 20 0 DIADMM [O-]c1ccc(-c2noc([C@@H]3CCCc4sccc43)n2)cc1F ZINC000445475776 338495962 /nfs/dbraw/zinc/49/59/62/338495962.db2.gz VLYBQFYBPWNUKE-LLVKDONJSA-N -1 1 316.357 4.111 20 0 DIADMM CSc1cc(-c2nc(-c3ccc([O-])c(F)c3)no2)ccc1F ZINC000445481324 338496456 /nfs/dbraw/zinc/49/64/56/338496456.db2.gz MWTBISVNPSZNMK-UHFFFAOYSA-N -1 1 320.320 4.109 20 0 DIADMM [O-]c1ccc(-c2noc(-c3cccn3C3CCCC3)n2)cc1F ZINC000445483133 338496458 /nfs/dbraw/zinc/49/64/58/338496458.db2.gz RGHQNWHSCOQFJW-UHFFFAOYSA-N -1 1 313.332 4.165 20 0 DIADMM O=S(=O)([N-]c1ccc2[nH]ccc2c1)c1ccc2ccccc2c1 ZINC000033912666 335792169 /nfs/dbraw/zinc/79/21/69/335792169.db2.gz ZIHYEEVILKUGGV-UHFFFAOYSA-N -1 1 322.389 4.122 20 0 DIADMM [O-]c1c(-c2nc(Cc3ccc(F)cc3)no2)ccc2ccccc21 ZINC000324709245 336249767 /nfs/dbraw/zinc/24/97/67/336249767.db2.gz BUUCITNTCAXSCC-UHFFFAOYSA-N -1 1 320.323 4.325 20 0 DIADMM O=C(Nc1ccc(Cl)cc1[O-])c1cc(-c2cccs2)on1 ZINC000532838262 336272612 /nfs/dbraw/zinc/27/26/12/336272612.db2.gz VHPFGCDZISGVPC-UHFFFAOYSA-N -1 1 320.757 4.014 20 0 DIADMM Cc1nc(-c2ccc(N[C@H](C)c3ccccc3)nc2)[n-]c(=O)c1C ZINC000301330156 336300957 /nfs/dbraw/zinc/30/09/57/336300957.db2.gz ANJJGKMRRUVWAU-CQSZACIVSA-N -1 1 320.396 4.034 20 0 DIADMM Cc1cnc([C@H](C)[N-]c2nc(-c3cccc(Cl)c3)no2)s1 ZINC000301542206 336313606 /nfs/dbraw/zinc/31/36/06/336313606.db2.gz KDFGCLHEOMJFKW-VIFPVBQESA-N -1 1 320.805 4.328 20 0 DIADMM CCCCC[C@@H](C)Nc1ccc(-c2nc(C)c(C)c(=O)[n-]2)cn1 ZINC000302763039 336368104 /nfs/dbraw/zinc/36/81/04/336368104.db2.gz XXGNYCIVSCMSAU-GFCCVEGCSA-N -1 1 314.433 4.242 20 0 DIADMM CCSc1cccc(F)c1[N-]C(=O)c1occ2c1CCC2 ZINC000362185828 336787147 /nfs/dbraw/zinc/78/71/47/336787147.db2.gz XCBWIAVNZDKFBX-UHFFFAOYSA-N -1 1 305.374 4.272 20 0 DIADMM C[C@H](C(=O)[O-])[C@H](NCc1ccc(Cl)cc1F)c1ccccc1 ZINC000426747155 336904860 /nfs/dbraw/zinc/90/48/60/336904860.db2.gz NGIWESWMMRYITD-ZBEGNZNMSA-N -1 1 321.779 4.031 20 0 DIADMM O=C(c1cc2ccccc2cc1[O-])N1CCC=C(c2ccco2)C1 ZINC000376031604 337025739 /nfs/dbraw/zinc/02/57/39/337025739.db2.gz XAFRYRFJFMROTI-UHFFFAOYSA-N -1 1 319.360 4.068 20 0 DIADMM CCc1ccc(CN(C)C(=O)c2cc3ccccc3cc2[O-])cc1 ZINC000023595587 337197088 /nfs/dbraw/zinc/19/70/88/337197088.db2.gz ZSTUDBFGBNSICX-UHFFFAOYSA-N -1 1 319.404 4.380 20 0 DIADMM CCOc1cc(-c2noc([C@@H]3C[C@H]3C3CC3)n2)cc(Cl)c1[O-] ZINC000583122915 337244213 /nfs/dbraw/zinc/24/42/13/337244213.db2.gz NPHRCFNDKSYJJN-WDEREUQCSA-N -1 1 320.776 4.008 20 0 DIADMM CCOc1cc(-c2noc([C@H]3CC=CCC3)n2)cc(Cl)c1[O-] ZINC000445413147 337682964 /nfs/dbraw/zinc/68/29/64/337682964.db2.gz QWUQTAPKHKSZJI-JTQLQIEISA-N -1 1 320.776 4.318 20 0 DIADMM O=C(Nc1ccc([O-])c(Cl)c1)[C@H]1C[C@H]1c1cccc(Cl)c1 ZINC000533081553 337812309 /nfs/dbraw/zinc/81/23/09/337812309.db2.gz ABWVJJLAMLOYMZ-STQMWFEESA-N -1 1 322.191 4.441 20 0 DIADMM [O-]c1ccc(-c2noc(-c3cccc(F)c3F)n2)c(Cl)c1 ZINC000445444433 337838977 /nfs/dbraw/zinc/83/89/77/337838977.db2.gz FUQMDWKCNVAXDG-UHFFFAOYSA-N -1 1 308.671 4.041 20 0 DIADMM CSc1ccc(-c2nc(-c3ccc([O-])cc3Cl)no2)cc1 ZINC000445446540 337844810 /nfs/dbraw/zinc/84/48/10/337844810.db2.gz MDWNAUMZSFFGTA-UHFFFAOYSA-N -1 1 318.785 4.485 20 0 DIADMM O=C(c1cc2ccccc2cc1[O-])N1CC[C@@H](c2ccccc2)C1 ZINC000121499812 337894197 /nfs/dbraw/zinc/89/41/97/337894197.db2.gz ZBCQQKDKNYAEFY-GOSISDBHSA-N -1 1 317.388 4.175 20 0 DIADMM [O-]c1ccc(-c2noc(-c3cc(F)cc(F)c3)n2)c(Cl)c1 ZINC000445451013 338016150 /nfs/dbraw/zinc/01/61/50/338016150.db2.gz ZNLOCAOOEJVGAK-UHFFFAOYSA-N -1 1 308.671 4.041 20 0 DIADMM CC(C)(c1nc(-c2ccc([O-])cc2F)no1)c1ccc(F)cc1 ZINC000445456616 338017616 /nfs/dbraw/zinc/01/76/16/338017616.db2.gz OTGYOCNMMSMWCO-UHFFFAOYSA-N -1 1 316.307 4.046 20 0 DIADMM C/C(=C/c1ccc(F)cc1)c1nc(-c2ccc([O-])cc2F)no1 ZINC000445458492 338018090 /nfs/dbraw/zinc/01/80/90/338018090.db2.gz YGFGAORWZNOLAI-NTMALXAHSA-N -1 1 314.291 4.281 20 0 DIADMM Cc1ccc(/C=C/Cc2nc(-c3ccc([O-])cc3F)no2)cc1 ZINC000445459322 338018373 /nfs/dbraw/zinc/01/83/73/338018373.db2.gz ZPIUESLVOPJWGA-NSCUHMNNSA-N -1 1 310.328 4.146 20 0 DIADMM [O-]c1ccc(Oc2ccccc2)cc1-c1nc(-c2ccoc2)no1 ZINC000445464015 338034919 /nfs/dbraw/zinc/03/49/19/338034919.db2.gz SEJCYQSPBIQULL-UHFFFAOYSA-N -1 1 320.304 4.495 20 0 DIADMM O=C([O-])c1ccc(CNCc2ccc(Oc3ccccc3)o2)cc1 ZINC000426707073 338038761 /nfs/dbraw/zinc/03/87/61/338038761.db2.gz ZNGDBUKUUDGTLV-UHFFFAOYSA-N -1 1 323.348 4.060 20 0 DIADMM Cc1cc2cc(CN[C@@H](CC3CCCC3)C(=O)[O-])oc2cc1C ZINC000426742309 338040204 /nfs/dbraw/zinc/04/02/04/338040204.db2.gz OXBZQYGZTVDFKA-KRWDZBQOSA-N -1 1 315.413 4.173 20 0 DIADMM C[C@@H](C(=O)[O-])[C@@H](NCc1cc(Cl)ccc1F)c1ccccc1 ZINC000426749625 338040617 /nfs/dbraw/zinc/04/06/17/338040617.db2.gz HHFYJCHUSOORPZ-BDJLRTHQSA-N -1 1 321.779 4.031 20 0 DIADMM CC(C)c1ccc2nc(-c3ccc4cc[nH]c4n3)[n-]c(=O)c2c1 ZINC000429567991 338084477 /nfs/dbraw/zinc/08/44/77/338084477.db2.gz MYCWOKOTFOHKBH-UHFFFAOYSA-N -1 1 304.353 4.002 20 0 DIADMM COC(=O)c1c[n-]c(S[C@@H](C)c2ccc(C(C)C)cc2)n1 ZINC000432658239 338161781 /nfs/dbraw/zinc/16/17/81/338161781.db2.gz MYBMVUMTFOCKKX-NSHDSACASA-N -1 1 304.415 4.173 20 0 DIADMM CC[C@@H](Nc1ccc(-c2nc(C)c(C)c(=O)[n-]2)cn1)C(C)(C)C ZINC000433779604 338201561 /nfs/dbraw/zinc/20/15/61/338201561.db2.gz MIGMIXXGBOOOQH-CQSZACIVSA-N -1 1 314.433 4.098 20 0 DIADMM CC(C)c1ccc(C(=O)N2CC3(CC3)c3ccccc32)c([O-])c1 ZINC000436533221 338275485 /nfs/dbraw/zinc/27/54/85/338275485.db2.gz XLMKDFRUVPLBOY-UHFFFAOYSA-N -1 1 307.393 4.208 20 0 DIADMM [O-]c1ccc(-c2nc(-c3ccc(Cl)cc3F)no2)c(F)c1 ZINC000436536963 338276013 /nfs/dbraw/zinc/27/60/13/338276013.db2.gz WRCYJAYATRCFDX-UHFFFAOYSA-N -1 1 308.671 4.041 20 0 DIADMM CCCN(C(=O)c1cc(F)ccc1[O-])[C@H]1CCc2ccccc21 ZINC000436541568 338276219 /nfs/dbraw/zinc/27/62/19/338276219.db2.gz WBUGLBVSEYCRLR-KRWDZBQOSA-N -1 1 313.372 4.071 20 0 DIADMM O=C(c1cc(F)ccc1[O-])N1CCC[C@H]1c1cccc(Cl)c1 ZINC000436565266 338277250 /nfs/dbraw/zinc/27/72/50/338277250.db2.gz UTHQIJJZMARHJR-HNNXBMFYSA-N -1 1 319.763 4.162 20 0 DIADMM CCSCC[C@@H](C)N(C)C(=O)c1ccc2ccccc2c1[O-] ZINC000436572996 338277735 /nfs/dbraw/zinc/27/77/35/338277735.db2.gz GNGLFAQKJNCALA-CYBMUJFWSA-N -1 1 317.454 4.149 20 0 DIADMM Cc1ccc([C@@H]2C[C@@H](C)CCN2C(=O)c2cc(F)ccc2[O-])o1 ZINC000436576387 338278032 /nfs/dbraw/zinc/27/80/32/338278032.db2.gz QZQHIOQQRCVDGP-NHYWBVRUSA-N -1 1 317.360 4.046 20 0 DIADMM Cc1ccc([C@H]2C[C@@H](C)CCN2C(=O)c2cc(F)ccc2[O-])o1 ZINC000436576388 338278058 /nfs/dbraw/zinc/27/80/58/338278058.db2.gz QZQHIOQQRCVDGP-XHDPSFHLSA-N -1 1 317.360 4.046 20 0 DIADMM O=C(Nc1cccc(CCC(F)(F)F)c1)c1ccccc1[O-] ZINC000436584099 338278365 /nfs/dbraw/zinc/27/83/65/338278365.db2.gz IUSFOCNHRYYEJS-UHFFFAOYSA-N -1 1 309.287 4.139 20 0 DIADMM CC[C@@H]1CCCC[C@@H]1c1noc(-c2ccc(OC)cc2[O-])n1 ZINC000436592881 338278921 /nfs/dbraw/zinc/27/89/21/338278921.db2.gz AITWWHMXQFBXBB-YPMHNXCESA-N -1 1 302.374 4.135 20 0 DIADMM CC[C@@H]1CCCC[C@H]1c1noc(-c2ccc(OC)cc2[O-])n1 ZINC000436592879 338279008 /nfs/dbraw/zinc/27/90/08/338279008.db2.gz AITWWHMXQFBXBB-DGCLKSJQSA-N -1 1 302.374 4.135 20 0 DIADMM CCCCn1ncc(NC(=O)c2cc3ccccc3cc2[O-])c1C ZINC000436604936 338279576 /nfs/dbraw/zinc/27/95/76/338279576.db2.gz OQDOEZKHPSEDSB-UHFFFAOYSA-N -1 1 323.396 4.103 20 0 DIADMM Cc1ccc(-c2cncc(F)c2)cc1NC(=O)c1ccccc1[O-] ZINC000436629033 338280629 /nfs/dbraw/zinc/28/06/29/338280629.db2.gz HQDQINPUIUDNCX-UHFFFAOYSA-N -1 1 322.339 4.154 20 0 DIADMM Cc1nc(-c2ccccc2)c(NC(=O)c2ccccc2[O-])s1 ZINC000436648917 338281540 /nfs/dbraw/zinc/28/15/40/338281540.db2.gz NPPAGTDTRPGMAA-UHFFFAOYSA-N -1 1 310.378 4.076 20 0 DIADMM CCCN(CCc1cccs1)C(=O)c1ccc(Cl)cc1[O-] ZINC000436691100 338283044 /nfs/dbraw/zinc/28/30/44/338283044.db2.gz XCRQPORUWKTUBB-UHFFFAOYSA-N -1 1 323.845 4.202 20 0 DIADMM Cc1ccccc1C[C@@H](C)N(C)C(=O)c1ccc(Cl)cc1[O-] ZINC000436707275 338283559 /nfs/dbraw/zinc/28/35/59/338283559.db2.gz FMNFXBYMJTWDII-CYBMUJFWSA-N -1 1 317.816 4.057 20 0 DIADMM Cc1csc(-c2ccc(NC(=O)c3ccccc3[O-])cc2)n1 ZINC000436719640 338284036 /nfs/dbraw/zinc/28/40/36/338284036.db2.gz PGFRMPPWSKUUMJ-UHFFFAOYSA-N -1 1 310.378 4.076 20 0 DIADMM O=C(c1ccc(Cl)cc1[O-])N1CCC[C@H]1c1cccc(F)c1 ZINC000436721327 338284227 /nfs/dbraw/zinc/28/42/27/338284227.db2.gz IZZHJKFKBWRIJC-HNNXBMFYSA-N -1 1 319.763 4.162 20 0 DIADMM C[C@@H](CN(C)C(=O)c1ccc2ccccc2c1[O-])c1ccccc1 ZINC000436743140 338285094 /nfs/dbraw/zinc/28/50/94/338285094.db2.gz WYCXVTMMHHUZEA-HNNXBMFYSA-N -1 1 319.404 4.421 20 0 DIADMM O=C(c1ccc2ccccc2c1[O-])N1Cc2cccc(Cl)c2C1 ZINC000436744243 338285285 /nfs/dbraw/zinc/28/52/85/338285285.db2.gz KTNAWGCNLNKLJX-UHFFFAOYSA-N -1 1 323.779 4.355 20 0 DIADMM CC[C@@H]1CCCCCN1C(=O)c1ccc(C(F)(F)F)cc1[O-] ZINC000436750209 338285299 /nfs/dbraw/zinc/28/52/99/338285299.db2.gz FAYRGDBQBUNFDG-GFCCVEGCSA-N -1 1 315.335 4.206 20 0 DIADMM O=C(c1ccc(Cl)cc1[O-])N1CCC[C@@H]1c1ccc(F)cc1 ZINC000436755252 338285551 /nfs/dbraw/zinc/28/55/51/338285551.db2.gz MDOZSCZTGCBCSF-OAHLLOKOSA-N -1 1 319.763 4.162 20 0 DIADMM Cc1ccc([C@H](C)N(C)C(=O)c2ccc(Cl)cc2[O-])cc1 ZINC000436753395 338285571 /nfs/dbraw/zinc/28/55/71/338285571.db2.gz DIBUJUWPXCRONV-LBPRGKRZSA-N -1 1 303.789 4.187 20 0 DIADMM CC1CCC(N(C)C(=O)c2ccc(C(F)(F)F)cc2[O-])CC1 ZINC000436764928 338286314 /nfs/dbraw/zinc/28/63/14/338286314.db2.gz VHNHKOAZQKPABQ-UHFFFAOYSA-N -1 1 315.335 4.062 20 0 DIADMM Cc1cc(C)cc(N(C)C(=O)c2ccc(C(F)(F)F)cc2[O-])c1 ZINC000436795469 338287612 /nfs/dbraw/zinc/28/76/12/338287612.db2.gz REAXKEZNFQDGQA-UHFFFAOYSA-N -1 1 323.314 4.304 20 0 DIADMM CC(C)Oc1ccc(Cl)cc1NC(=O)c1ccc([O-])cc1F ZINC000436796910 338287834 /nfs/dbraw/zinc/28/78/34/338287834.db2.gz XSJPKBJMQCOKKU-UHFFFAOYSA-N -1 1 323.751 4.224 20 0 DIADMM CC(C)N(C(=O)c1ccc(C(F)(F)F)cc1[O-])C1CCCC1 ZINC000436816872 338288390 /nfs/dbraw/zinc/28/83/90/338288390.db2.gz GPNGUFWNXFTBBE-UHFFFAOYSA-N -1 1 315.335 4.204 20 0 DIADMM COc1ccccc1-c1cccc(NC(=O)c2ccccc2[O-])c1 ZINC000436866095 338290489 /nfs/dbraw/zinc/29/04/89/338290489.db2.gz WOJOBYFJNUDWOI-UHFFFAOYSA-N -1 1 319.360 4.320 20 0 DIADMM O=C(c1ccc([O-])cc1F)N1CCCC2(C1)CCCCCC2 ZINC000436867413 338290561 /nfs/dbraw/zinc/29/05/61/338290561.db2.gz CCWNTBHOMDXDTR-UHFFFAOYSA-N -1 1 305.393 4.108 20 0 DIADMM C[C@H](CC(C)(C)c1ccccc1)NC(=O)c1ccc([O-])cc1F ZINC000436868828 338290696 /nfs/dbraw/zinc/29/06/96/338290696.db2.gz KOCJBBOCELPTIW-CYBMUJFWSA-N -1 1 315.388 4.018 20 0 DIADMM Cc1c(Cl)cccc1-c1nc(-c2ccc([O-])c(F)c2)no1 ZINC000436871847 338290917 /nfs/dbraw/zinc/29/09/17/338290917.db2.gz IYTWPZFOJRXUCT-UHFFFAOYSA-N -1 1 304.708 4.210 20 0 DIADMM C[C@H]1[C@@H](c2nc(-c3ccc([O-])c(F)c3)no2)[C@@H]1c1ccccc1 ZINC000436875234 338291185 /nfs/dbraw/zinc/29/11/85/338291185.db2.gz UBGRKOZHWIGLBP-HPEXNQPKSA-N -1 1 310.328 4.098 20 0 DIADMM CCc1ccc(C(=O)N2CC3(CCC3)c3ccccc32)c([O-])c1 ZINC000436891321 338292250 /nfs/dbraw/zinc/29/22/50/338292250.db2.gz XBHAJJKDGSKZKU-UHFFFAOYSA-N -1 1 307.393 4.037 20 0 DIADMM O=C(N[C@H](CC1CCC1)c1ccccc1)c1ccc([O-])cc1F ZINC000436896484 338292588 /nfs/dbraw/zinc/29/25/88/338292588.db2.gz YZGSVEXQAJTEQC-GOSISDBHSA-N -1 1 313.372 4.193 20 0 DIADMM CCc1ccc(CN(C)C(=O)c2ccc3ccccc3c2[O-])cc1 ZINC000436901107 338292652 /nfs/dbraw/zinc/29/26/52/338292652.db2.gz PYUKHTZWSVUZMO-UHFFFAOYSA-N -1 1 319.404 4.380 20 0 DIADMM Cc1nc(-c2ccccc2NC(=O)c2ccccc2[O-])cs1 ZINC000436902249 338292777 /nfs/dbraw/zinc/29/27/77/338292777.db2.gz POYYWUDHVLSOIP-UHFFFAOYSA-N -1 1 310.378 4.076 20 0 DIADMM CC(C)Oc1ccc(-c2noc(-c3cc(F)ccc3[O-])n2)cc1 ZINC000436903782 338292907 /nfs/dbraw/zinc/29/29/07/338292907.db2.gz VADGNLKENAYDLY-UHFFFAOYSA-N -1 1 314.316 4.036 20 0 DIADMM CCN(Cc1ccccc1Cl)C(=O)c1ccc(Cl)cc1[O-] ZINC000436929609 338293997 /nfs/dbraw/zinc/29/39/97/338293997.db2.gz ZTWFSZPMEQRCAQ-UHFFFAOYSA-N -1 1 324.207 4.361 20 0 DIADMM [O-]c1ccc(Oc2ccccc2)cc1-c1nc([C@@H]2CCCO2)no1 ZINC000436935721 338294445 /nfs/dbraw/zinc/29/44/45/338294445.db2.gz LIQMEIHGJBFJMG-INIZCTEOSA-N -1 1 324.336 4.086 20 0 DIADMM Cc1ccc(Cl)cc1-c1noc(-c2cc(F)ccc2[O-])n1 ZINC000436938499 338294698 /nfs/dbraw/zinc/29/46/98/338294698.db2.gz LXLGMUYLQUDFQU-UHFFFAOYSA-N -1 1 304.708 4.210 20 0 DIADMM COC[C@@H](C)n1c2ccccc2nc1-c1ccc([O-])c(Cl)c1 ZINC000436989237 338296934 /nfs/dbraw/zinc/29/69/34/338296934.db2.gz NMLQGLDCQPOAGA-LLVKDONJSA-N -1 1 316.788 4.270 20 0 DIADMM Cc1ccc(F)c(CN(C)C(=O)c2ccc3ccccc3c2[O-])c1 ZINC000437003173 338297411 /nfs/dbraw/zinc/29/74/11/338297411.db2.gz RLADSVYTAPGAAV-UHFFFAOYSA-N -1 1 323.367 4.265 20 0 DIADMM CCOCc1ccc(NC(=O)c2cc3ccccc3cc2[O-])cc1 ZINC000440815241 338397988 /nfs/dbraw/zinc/39/79/88/338397988.db2.gz HUQDMEBLKAOZBN-UHFFFAOYSA-N -1 1 321.376 4.334 20 0 DIADMM C[C@]1(C(=O)Nc2ccc([O-])c(Cl)c2)CCCc2ccccc21 ZINC000440940719 338400119 /nfs/dbraw/zinc/40/01/19/338400119.db2.gz AEHRJTINPZPKCE-SFHVURJKSA-N -1 1 315.800 4.278 20 0 DIADMM O=C(c1ccc(Cl)cc1[O-])N1CCC[C@@H]1c1cccs1 ZINC000194584215 338572901 /nfs/dbraw/zinc/57/29/01/338572901.db2.gz LPNQHJUJILMMAY-GFCCVEGCSA-N -1 1 307.802 4.084 20 0 DIADMM CC(C)(CCC(=O)Nc1ccc([O-])c(F)c1F)c1ccccc1 ZINC000456781841 338940404 /nfs/dbraw/zinc/94/04/04/338940404.db2.gz JSWSJZMDCHPPES-UHFFFAOYSA-N -1 1 319.351 4.367 20 0 DIADMM CC(C)(C)c1ccc(CC(=O)Nc2ccc([O-])c(F)c2F)cc1 ZINC000456784732 338940652 /nfs/dbraw/zinc/94/06/52/338940652.db2.gz MMMWZOAAJKRTLE-UHFFFAOYSA-N -1 1 319.351 4.149 20 0 DIADMM CCN(C(=O)c1ncc(C)cc1[O-])[C@H](C)c1cc2ccccc2o1 ZINC000460208411 339039267 /nfs/dbraw/zinc/03/92/67/339039267.db2.gz BSCLAACDNPBRHC-CYBMUJFWSA-N -1 1 324.380 4.065 20 0 DIADMM Cc1c(F)cccc1[N-]S(=O)(=O)c1ccc(C(C)(C)C)cc1 ZINC000467084998 339225921 /nfs/dbraw/zinc/22/59/21/339225921.db2.gz KJSHDABGKHTUKJ-UHFFFAOYSA-N -1 1 321.417 4.232 20 0 DIADMM Cc1cccc([N-]S(=O)(=O)c2ccccc2C(C)C)c1C ZINC000468547594 339265848 /nfs/dbraw/zinc/26/58/48/339265848.db2.gz KDHUCEKBMCEXBQ-UHFFFAOYSA-N -1 1 303.427 4.228 20 0 DIADMM O=C(Nc1ccc([O-])c(Cl)c1)Nc1ccc(F)c(Cl)c1 ZINC000476343599 339474895 /nfs/dbraw/zinc/47/48/95/339474895.db2.gz TWLIZVNETXMAIZ-UHFFFAOYSA-N -1 1 315.131 4.482 20 0 DIADMM CCOc1cc(C)ccc1NC(=O)Nc1ccc([O-])c(Cl)c1 ZINC000476375828 339475628 /nfs/dbraw/zinc/47/56/28/339475628.db2.gz IPNREZOPHHVAJU-UHFFFAOYSA-N -1 1 320.776 4.397 20 0 DIADMM [O-]c1cccc(CN2CCSC[C@@H]2c2ccccc2)c1Cl ZINC000507133027 340209054 /nfs/dbraw/zinc/20/90/54/340209054.db2.gz RRUAOMBXDSAIJX-OAHLLOKOSA-N -1 1 319.857 4.336 20 0 DIADMM CC[C@@H](C)[C@@H](C)C(=O)Nc1cc(C)cc(Br)c1[O-] ZINC000507366334 340218128 /nfs/dbraw/zinc/21/81/28/340218128.db2.gz AYRRUDURHAWASD-NXEZZACHSA-N -1 1 314.223 4.084 20 0 DIADMM COCC[N@H+](Cc1cccc(O)c1Cl)[C@@H](C)c1ccccc1 ZINC000507392862 340218486 /nfs/dbraw/zinc/21/84/86/340218486.db2.gz QXCFNNYIYAMUEC-AWEZNQCLSA-N -1 1 319.832 4.255 20 0 DIADMM C[C@H]1CN(Cc2cccc([O-])c2Cl)C[C@@H](c2ccccc2)O1 ZINC000507783999 340231439 /nfs/dbraw/zinc/23/14/39/340231439.db2.gz HHTTZIOMMUZNHW-GUYCJALGSA-N -1 1 317.816 4.008 20 0 DIADMM Oc1cccc(C[N@H+]2CC[C@H](c3cccc(F)c3)C2)c1Cl ZINC000508251836 340241474 /nfs/dbraw/zinc/24/14/74/340241474.db2.gz YDPOLLCYUKLICN-ZDUSSCGKSA-N -1 1 305.780 4.174 20 0 DIADMM C[C@@H]1CN(Cc2cccc([O-])c2Cl)[C@@H](c2ccccc2)CO1 ZINC000508750295 340252360 /nfs/dbraw/zinc/25/23/60/340252360.db2.gz YVGIPOIZYJFAAN-CZUORRHYSA-N -1 1 317.816 4.008 20 0 DIADMM C[C@H](CC(=O)Nc1ccc([O-])c(Cl)c1)Cc1cccc(F)c1 ZINC000509172874 340263003 /nfs/dbraw/zinc/26/30/03/340263003.db2.gz PQDAWFIAHZMPTP-NSHDSACASA-N -1 1 321.779 4.392 20 0 DIADMM O=C(Nc1ccc([O-])c(Cl)c1)C1(c2ccccc2)CCCC1 ZINC000509177255 340263117 /nfs/dbraw/zinc/26/31/17/340263117.db2.gz GVLDXWWVWUVKRQ-UHFFFAOYSA-N -1 1 315.800 4.496 20 0 DIADMM O=C(Nc1ccc([O-])c(Cl)c1)C1(Cc2ccccc2)CCC1 ZINC000509185465 340263352 /nfs/dbraw/zinc/26/33/52/340263352.db2.gz OKHZHTJRLMRMEW-UHFFFAOYSA-N -1 1 315.800 4.397 20 0 DIADMM Cc1ccc(C)c([N-]S(=O)(=O)c2cc(Cl)ccc2C)c1 ZINC000000367656 340367108 /nfs/dbraw/zinc/36/71/08/340367108.db2.gz XUYWXXZYOFMQDU-UHFFFAOYSA-N -1 1 309.818 4.066 20 0 DIADMM Cc1nc(CC(C)C)c(C(=O)Nc2ccc([O-])c(Cl)c2)s1 ZINC000182865235 340485720 /nfs/dbraw/zinc/48/57/20/340485720.db2.gz YINLBIUEBBMPTD-UHFFFAOYSA-N -1 1 324.833 4.261 20 0 DIADMM CC1(C(=O)Nc2ccc([O-])c(Cl)c2)CCC(F)(F)CC1 ZINC000528873903 340737727 /nfs/dbraw/zinc/73/77/27/340737727.db2.gz DHEMRGCBZCUSDP-UHFFFAOYSA-N -1 1 303.736 4.200 20 0 DIADMM C[C@H]1CC(C(=O)[O-])C[C@H](C)N1Cc1cc(Cl)cc(Cl)c1 ZINC000530175485 340781760 /nfs/dbraw/zinc/78/17/60/340781760.db2.gz PQLDDSDQOQYKEK-UWVGGRQHSA-N -1 1 316.228 4.067 20 0 DIADMM O=C(Nc1ccc([O-])c(Cl)c1)[C@@H]1CCCc2ccccc21 ZINC000070333856 340993632 /nfs/dbraw/zinc/99/36/32/340993632.db2.gz XALYPWCTSXVRSU-CQSZACIVSA-N -1 1 301.773 4.104 20 0 DIADMM CC(C)(C)[C@@H]1CCCN(C(=O)c2cc(Cl)ccc2[O-])CC1 ZINC000071202740 341025486 /nfs/dbraw/zinc/02/54/86/341025486.db2.gz OREWSIHFGMTYPJ-GFCCVEGCSA-N -1 1 309.837 4.334 20 0 DIADMM CCSc1ccc(Cl)cc1[N-]C(=O)c1coc(CC)n1 ZINC000543421596 341043585 /nfs/dbraw/zinc/04/35/85/341043585.db2.gz DBXMWEQAZLMKSK-UHFFFAOYSA-N -1 1 310.806 4.255 20 0 DIADMM C[C@@H](CCC(C)(C)C)C(=O)Nc1ccc(-c2cc(=O)[nH][n-]2)cc1 ZINC000544610249 341088926 /nfs/dbraw/zinc/08/89/26/341088926.db2.gz WIQXTUPOSGIOBA-LBPRGKRZSA-N -1 1 315.417 4.183 20 0 DIADMM Cc1nc(CC(C)C)sc1C(=O)Nc1ccc([O-])c(Cl)c1 ZINC000135907505 341248136 /nfs/dbraw/zinc/24/81/36/341248136.db2.gz ACONIPDFSZQZGR-UHFFFAOYSA-N -1 1 324.833 4.261 20 0 DIADMM CCc1ccc(NC(=O)c2c(F)ccc([O-])c2F)cc1Cl ZINC000553233245 341421182 /nfs/dbraw/zinc/42/11/82/341421182.db2.gz WKUGXWQKUFRBGA-UHFFFAOYSA-N -1 1 311.715 4.139 20 0 DIADMM CCc1nc(S[C@H](C)c2ncc(C(C)(C)C)o2)[n-]c(=O)c1C ZINC000568272214 341662808 /nfs/dbraw/zinc/66/28/08/341662808.db2.gz SADPFFZQWOPEEJ-SNVBAGLBSA-N -1 1 321.446 4.192 20 0 DIADMM C[C@H]1CCN(C(=O)c2c(F)ccc([O-])c2F)CC12CCCCC2 ZINC000575908858 341814108 /nfs/dbraw/zinc/81/41/08/341814108.db2.gz PDQSEQMHLIZIGG-LBPRGKRZSA-N -1 1 323.383 4.103 20 0 DIADMM CC(C)c1noc([N-][C@@H](C)c2nc3ccccc3n2C(F)F)n1 ZINC000267198365 519906222 /nfs/dbraw/zinc/90/62/22/519906222.db2.gz ISZDKICJYZDUDN-VIFPVBQESA-N -1 1 321.331 4.111 20 0 DIADMM CC[C@H]([N-]c1nc(C(C)C)no1)c1nc(C(F)(F)F)cs1 ZINC000266756035 522778794 /nfs/dbraw/zinc/77/87/94/522778794.db2.gz UJTCQWKNYVRSEV-ZETCQYMHSA-N -1 1 320.340 4.232 20 0 DIADMM Cc1ccc(-c2cccnc2)cc1NC(=O)c1ccc([O-])cc1F ZINC000366540623 525759193 /nfs/dbraw/zinc/75/91/93/525759193.db2.gz ORXKUDWZVXZASE-UHFFFAOYSA-N -1 1 322.339 4.154 20 0 DIADMM [O-]c1cccc(CNCc2csc(-c3ccco3)n2)c1Cl ZINC000339304203 526361499 /nfs/dbraw/zinc/36/14/99/526361499.db2.gz SFPHGZFGGKAHFO-UHFFFAOYSA-N -1 1 320.801 4.052 20 0 DIADMM Cc1cc(NC(=O)c2ccc([O-])c(F)c2)cc(C(F)(F)F)c1 ZINC000683119635 1035557507 /nfs/dbraw/zinc/55/75/07/1035557507.db2.gz DFICKKVVUHFNHK-UHFFFAOYSA-N -1 1 313.250 4.111 20 0 DIADMM CN(CCCc1ccccc1)C(=O)c1cc2ccccc2cc1[O-] ZINC000047163754 1035788915 /nfs/dbraw/zinc/78/89/15/1035788915.db2.gz QKPHOLSLXBNATC-UHFFFAOYSA-N -1 1 319.404 4.250 20 0 DIADMM CC(C)CCOc1ccccc1NC(=O)c1ccc([O-])cc1F ZINC000655228901 1035822731 /nfs/dbraw/zinc/82/27/31/1035822731.db2.gz CQPUUXMNEDFWCZ-UHFFFAOYSA-N -1 1 317.360 4.209 20 0 DIADMM CCCCN(C(=O)c1cncc([O-])c1)[C@@H](CC)c1ccccc1 ZINC000339951994 1036091120 /nfs/dbraw/zinc/09/11/20/1036091120.db2.gz FHOAQHIRLVGSIQ-SFHVURJKSA-N -1 1 312.413 4.181 20 0 DIADMM O=c1nc(-c2ccco2)[n-]c2scc(-c3ccc(F)cc3)c21 ZINC000047681829 1036166696 /nfs/dbraw/zinc/16/66/96/1036166696.db2.gz BTCNBUFUPFCRFU-UHFFFAOYSA-N -1 1 312.325 4.051 20 0 DIADMM [O-]c1ccc(Cl)c(Nc2cc(F)ccc2CO)c1Cl ZINC001210185862 1036465048 /nfs/dbraw/zinc/46/50/48/1036465048.db2.gz XQJGJYMYUNKWJT-UHFFFAOYSA-N -1 1 302.132 4.074 20 0 DIADMM CC(C)c1ccc2cc(C(=O)Nc3cccc(F)c3[O-])[nH]c2c1 ZINC001648848072 1036629564 /nfs/dbraw/zinc/62/95/64/1036629564.db2.gz YTDHRSGSQKYIFN-UHFFFAOYSA-N -1 1 312.344 4.388 20 0 DIADMM O=C(Nc1cccc(F)c1[O-])C1(c2ccccc2F)CCCC1 ZINC001648847176 1036630136 /nfs/dbraw/zinc/63/01/36/1036630136.db2.gz LJLDALDBZRJURD-UHFFFAOYSA-N -1 1 317.335 4.121 20 0 DIADMM O=C(Nc1cccc(F)c1[O-])C1(Cc2cccc(F)c2)CCC1 ZINC001648851223 1036639882 /nfs/dbraw/zinc/63/98/82/1036639882.db2.gz ZHWNZFLRUVKMNC-UHFFFAOYSA-N -1 1 317.335 4.022 20 0 DIADMM C[C@@H](CC(=O)Nc1c([O-])cccc1F)c1c[nH]c2ccccc21 ZINC000683864205 1037043354 /nfs/dbraw/zinc/04/33/54/1037043354.db2.gz CFTUDMDXISEERE-NSHDSACASA-N -1 1 312.344 4.145 20 0 DIADMM Cc1ccc2oc([N-][C@@H](C[C@@H]3CCCO3)C(F)(F)F)nc2c1 ZINC000656224565 1037148558 /nfs/dbraw/zinc/14/85/58/1037148558.db2.gz MJXNXGVCMCNTKC-GWCFXTLKSA-N -1 1 314.307 4.048 20 0 DIADMM [O-]c1cc(F)c(-c2ccc3nc(C(F)(F)F)cn3c2)cc1F ZINC001211339838 1037304736 /nfs/dbraw/zinc/30/47/36/1037304736.db2.gz PXIMYRJRCMDZOY-UHFFFAOYSA-N -1 1 314.213 4.004 20 0 DIADMM CCOC(=O)[C@@H](CC)c1ccc(-c2cc(F)c([O-])cc2F)cc1 ZINC001211353578 1037310483 /nfs/dbraw/zinc/31/04/83/1037310483.db2.gz XVVKDSOTOVOGKX-ZDUSSCGKSA-N -1 1 320.335 4.394 20 0 DIADMM COc1cc(OC)c(Nc2cc(F)c([O-])cc2F)cc1Cl ZINC001215571401 1037383446 /nfs/dbraw/zinc/38/34/46/1037383446.db2.gz CCLZWVPZBBUFCH-UHFFFAOYSA-N -1 1 315.703 4.085 20 0 DIADMM O=C(Nc1ccc(F)c(F)c1F)c1ccc2ccccc2c1[O-] ZINC000390224833 1037640555 /nfs/dbraw/zinc/64/05/55/1037640555.db2.gz IXVNICLDCKXEQC-UHFFFAOYSA-N -1 1 317.266 4.215 20 0 DIADMM CCC[C@@H](C)C[C@H](NCc1cc2cccc(CC)c2o1)C(=O)[O-] ZINC000656574811 1037656922 /nfs/dbraw/zinc/65/69/22/1037656922.db2.gz ZHTBVMCQMYMXLM-DYVFJYSZSA-N -1 1 317.429 4.364 20 0 DIADMM [O-]c1ccc(-c2noc([C@@H]3CC34CCSCC4)n2)c(Cl)c1 ZINC000581649103 1037836055 /nfs/dbraw/zinc/83/60/55/1037836055.db2.gz CMTDRORULFOCGO-NSHDSACASA-N -1 1 322.817 4.096 20 0 DIADMM C=COc1ccc(NC(=O)c2ccc3ccccc3c2[O-])cc1 ZINC001299158901 1038278164 /nfs/dbraw/zinc/27/81/64/1038278164.db2.gz ZBINCYNDLWICFX-UHFFFAOYSA-N -1 1 305.333 4.320 20 0 DIADMM Cc1ccc(CN[C@H](CC(=O)[O-])c2ccc(C(C)C)cc2)o1 ZINC000277224654 1038456906 /nfs/dbraw/zinc/45/69/06/1038456906.db2.gz ICCDOVAMOXJKRK-QGZVFWFLSA-N -1 1 301.386 4.017 20 0 DIADMM O=C(Nc1ccc2[nH]ccc2c1)c1ccc(C(F)(F)F)c([O-])c1 ZINC000684870341 1038666536 /nfs/dbraw/zinc/66/65/36/1038666536.db2.gz ATJCYDXYNLWRJK-UHFFFAOYSA-N -1 1 320.270 4.145 20 0 DIADMM O=C(Nc1c([O-])cccc1F)[C@H]1C[C@H]1c1ccc2ccccc2c1 ZINC000608366341 1038830532 /nfs/dbraw/zinc/83/05/32/1038830532.db2.gz SBWBKZUNECOKAS-HOTGVXAUSA-N -1 1 321.351 4.427 20 0 DIADMM O=C(c1cc(Cl)ccc1[O-])N1CCC(C2CCCC2)CC1 ZINC000608475271 1038851980 /nfs/dbraw/zinc/85/19/80/1038851980.db2.gz SNOISTLCKJGTJC-UHFFFAOYSA-N -1 1 307.821 4.088 20 0 DIADMM Cc1ccc(-c2nc(C=C3SC(=S)[N-]C3=O)cs2)cc1 ZINC000048837540 1039128149 /nfs/dbraw/zinc/12/81/49/1039128149.db2.gz STNGZWINKDQZKX-WDZFZDKYSA-N -1 1 318.448 4.448 20 0 DIADMM CCc1ccc(S(=O)(=O)[N-]c2cccc(SC)c2C)cc1 ZINC000540289882 1039471035 /nfs/dbraw/zinc/47/10/35/1039471035.db2.gz XSIOKWDODPGKGU-UHFFFAOYSA-N -1 1 321.467 4.080 20 0 DIADMM Cc1cccc(C)c1OCCC(=O)Nc1ccc([O-])c(Cl)c1 ZINC000541887309 1039754050 /nfs/dbraw/zinc/75/40/50/1039754050.db2.gz CVPVGHKJOYZADS-UHFFFAOYSA-N -1 1 319.788 4.070 20 0 DIADMM Cc1ccc(S[C@H](C)C(=O)Nc2ccc([O-])c(Cl)c2)cc1 ZINC000541887586 1039757309 /nfs/dbraw/zinc/75/73/09/1039757309.db2.gz NWDBWPTVBURZSV-LLVKDONJSA-N -1 1 321.829 4.473 20 0 DIADMM O=C(CCCc1ccccc1Cl)Nc1c([O-])cccc1F ZINC000685742945 1040504743 /nfs/dbraw/zinc/50/47/43/1040504743.db2.gz KIZNRUVAMIVRKC-UHFFFAOYSA-N -1 1 307.752 4.146 20 0 DIADMM COc1cc(O)ccc1Nc1cc(Cl)c(C)c(Cl)c1[O-] ZINC001213098341 1040515718 /nfs/dbraw/zinc/51/57/18/1040515718.db2.gz OLHBDPPKOWKOIO-UHFFFAOYSA-N -1 1 314.168 4.465 20 0 DIADMM CCOC1(C(=O)Nc2cc(Cl)c([O-])c3ccccc23)CCC1 ZINC000628233699 1040523975 /nfs/dbraw/zinc/52/39/75/1040523975.db2.gz QMKDJTNOQDONNW-UHFFFAOYSA-N -1 1 319.788 4.097 20 0 DIADMM COc1ccc(NC(=O)c2cc3ccccc3cc2[O-])c(C)c1 ZINC000002510343 1041548930 /nfs/dbraw/zinc/54/89/30/1041548930.db2.gz BPLTYDPIHLNUAR-UHFFFAOYSA-N -1 1 307.349 4.115 20 0 DIADMM CC1(C)C[C@H](c2noc(-c3ccc4ccccc4c3[O-])n2)CCO1 ZINC000651441953 1041691039 /nfs/dbraw/zinc/69/10/39/1041691039.db2.gz ABZGHMKDILGPHV-CYBMUJFWSA-N -1 1 324.380 4.268 20 0 DIADMM [O-]c1cccc(CNc2ccc(OCC3CC3)cc2)c1Cl ZINC000815126073 1041916330 /nfs/dbraw/zinc/91/63/30/1041916330.db2.gz GCDKWDXKFMXHNZ-UHFFFAOYSA-N -1 1 303.789 4.447 20 0 DIADMM CN1CCCc2cc(NCc3cccc([O-])c3Cl)ccc21 ZINC000815130675 1041918513 /nfs/dbraw/zinc/91/85/13/1041918513.db2.gz DVXBYIFRDARKRY-UHFFFAOYSA-N -1 1 302.805 4.040 20 0 DIADMM CCc1cccc(NC(=O)c2ccc3ccc(O)cc3c2[O-])c1 ZINC001135304688 1042007823 /nfs/dbraw/zinc/00/78/23/1042007823.db2.gz QAARLMKLAISDME-UHFFFAOYSA-N -1 1 307.349 4.066 20 0 DIADMM CC(C)c1ccc(C(=O)Nc2ccc(OC(F)F)cc2)c([O-])c1 ZINC001135338290 1042014206 /nfs/dbraw/zinc/01/42/06/1042014206.db2.gz BKRZRCHDXRIHAB-UHFFFAOYSA-N -1 1 321.323 4.369 20 0 DIADMM CCN(Cc1ccc(Cl)s1)[C@H](C)c1ccc(C(=O)[O-])o1 ZINC000652376746 1042031365 /nfs/dbraw/zinc/03/13/65/1042031365.db2.gz DHIJKTBBLXKPCK-SECBINFHSA-N -1 1 313.806 4.276 20 0 DIADMM Cc1sc(C(=O)[O-])cc1CN([C@H](C)c1ccco1)C1CC1 ZINC000652401438 1042037749 /nfs/dbraw/zinc/03/77/49/1042037749.db2.gz FAADWSHHFHNZHE-SNVBAGLBSA-N -1 1 305.399 4.073 20 0 DIADMM C[C@H](NC(=O)c1c([O-])cccc1F)c1cccc2ccccc21 ZINC001135509220 1042042292 /nfs/dbraw/zinc/04/22/92/1042042292.db2.gz NAXIJYSTZRJYMX-LBPRGKRZSA-N -1 1 309.340 4.176 20 0 DIADMM CC(C)c1cccc(CNCc2ccc(C(=O)[O-])c(C3CC3)n2)c1 ZINC000663262087 1042090749 /nfs/dbraw/zinc/09/07/49/1042090749.db2.gz HSUJFGYHHPXFCX-UHFFFAOYSA-N -1 1 324.424 4.070 20 0 DIADMM [O-]c1ccc(F)c(-c2ccc(OCC(F)(F)F)nc2)c1Cl ZINC001245831178 1042139836 /nfs/dbraw/zinc/13/98/36/1042139836.db2.gz GOAXYLCMBKSBJZ-UHFFFAOYSA-N -1 1 321.657 4.188 20 0 DIADMM CCCN(Cc1ccc(C)cc1)C(=O)c1c([O-])cccc1Cl ZINC001136136959 1042150844 /nfs/dbraw/zinc/15/08/44/1042150844.db2.gz ZPCIYHMHUUCLMV-UHFFFAOYSA-N -1 1 317.816 4.406 20 0 DIADMM CC(C)(C)[C@H]1CCCC[C@@H]1NC(=O)c1ccc(Cl)cc1[O-] ZINC001136181121 1042168685 /nfs/dbraw/zinc/16/86/85/1042168685.db2.gz CKBPPUBEHMSGPX-KBPBESRZSA-N -1 1 309.837 4.380 20 0 DIADMM CC[C@H]1c2ccsc2CCN1C(=O)c1cc(Cl)ccc1[O-] ZINC001136210666 1042178494 /nfs/dbraw/zinc/17/84/94/1042178494.db2.gz NFIGXAMZSKELQV-ZDUSSCGKSA-N -1 1 321.829 4.257 20 0 DIADMM C[C@H](Cc1ccccc1Cl)NC(=O)c1ccc(Cl)cc1[O-] ZINC001136263949 1042195419 /nfs/dbraw/zinc/19/54/19/1042195419.db2.gz BLODRMRBGFTJLP-SNVBAGLBSA-N -1 1 324.207 4.060 20 0 DIADMM O=C(c1cc(Cl)ccc1[O-])N1CCC[C@@H]1C1CCCCC1 ZINC001136310602 1042207646 /nfs/dbraw/zinc/20/76/46/1042207646.db2.gz ORMVUZJZDMUJAT-OAHLLOKOSA-N -1 1 307.821 4.231 20 0 DIADMM CC(C)(C)c1ccc([C@@H]([N-]C(=O)C(C)(F)F)C(F)(F)F)cc1 ZINC001136401838 1042237365 /nfs/dbraw/zinc/23/73/65/1042237365.db2.gz DXCWREWZQBOFGA-LLVKDONJSA-N -1 1 323.305 4.359 20 0 DIADMM O=C(c1cc(F)ccc1[O-])N1CCC[C@@H]1CC1CCCCC1 ZINC001136466950 1042256663 /nfs/dbraw/zinc/25/66/63/1042256663.db2.gz KRGJREOPNXYZEO-OAHLLOKOSA-N -1 1 305.393 4.106 20 0 DIADMM CC(C)(C)[C@H]1CCCC[C@H]1CNC(=O)c1ccc(F)c([O-])c1 ZINC001136512868 1042268102 /nfs/dbraw/zinc/26/81/02/1042268102.db2.gz KRLWDEAINRQIGV-KBPBESRZSA-N -1 1 307.409 4.114 20 0 DIADMM [O-]c1ccc(-c2noc([C@@H]3CC[C@H](C(F)(F)F)C3)n2)c(F)c1 ZINC000436873612 1042338030 /nfs/dbraw/zinc/33/80/30/1042338030.db2.gz NPSGBWLNIBYXDM-SFYZADRCSA-N -1 1 316.254 4.027 20 0 DIADMM [O-]c1ccc(-c2noc([C@H]3CC[C@H](C(F)(F)F)C3)n2)c(F)c1 ZINC000436873615 1042338349 /nfs/dbraw/zinc/33/83/49/1042338349.db2.gz NPSGBWLNIBYXDM-YUMQZZPRSA-N -1 1 316.254 4.027 20 0 DIADMM COc1ccc(NC(=O)c2ccc3ccccc3c2[O-])c(C)c1 ZINC000320284472 1042357945 /nfs/dbraw/zinc/35/79/45/1042357945.db2.gz OPHMTGCHHZBXOZ-UHFFFAOYSA-N -1 1 307.349 4.115 20 0 DIADMM Cc1cccc2nc(-c3ccc(F)c(C(F)(F)F)c3)[n-]c(=O)c12 ZINC000446992318 1042383791 /nfs/dbraw/zinc/38/37/91/1042383791.db2.gz CAPRLXNKAVSDTA-UHFFFAOYSA-N -1 1 322.261 4.469 20 0 DIADMM O=c1nc(-c2ccccc2)[n-]c2cc(-c3ccc(F)cc3)sc21 ZINC000614112993 1042410289 /nfs/dbraw/zinc/41/02/89/1042410289.db2.gz YQSCTQUIRBYYDP-UHFFFAOYSA-N -1 1 322.364 4.458 20 0 DIADMM CCCC[C@@H](CC)CSc1nc([O-])cc(=O)n1C1CCCC1 ZINC000515288925 1042814546 /nfs/dbraw/zinc/81/45/46/1042814546.db2.gz GAFOUGLYNGRXOK-CYBMUJFWSA-N -1 1 324.490 4.373 20 0 DIADMM Cc1ccc(CSc2nc(C(F)F)cc(=O)[n-]2)c(Cl)c1 ZINC000515409584 1042819037 /nfs/dbraw/zinc/81/90/37/1042819037.db2.gz CPIPJOZFEDIHGI-UHFFFAOYSA-N -1 1 316.760 4.374 20 0 DIADMM O=C(c1ccc(Cl)cc1[O-])N(Cc1ccco1)C1CCCC1 ZINC000436720204 1042842093 /nfs/dbraw/zinc/84/20/93/1042842093.db2.gz DVDOUBSDPPYALB-UHFFFAOYSA-N -1 1 319.788 4.224 20 0 DIADMM C[C@H]1CCCC[C@H]1N(C)C(=O)c1ccc(C(F)(F)F)cc1[O-] ZINC000436762181 1042842878 /nfs/dbraw/zinc/84/28/78/1042842878.db2.gz CMBXNDWPSAGMIK-GXFFZTMASA-N -1 1 315.335 4.062 20 0 DIADMM O=C(c1ccc(Cl)cc1[O-])N1CCC[C@H]1c1ccccc1 ZINC000436722979 1042843300 /nfs/dbraw/zinc/84/33/00/1042843300.db2.gz QZRDPEURHFUBEK-HNNXBMFYSA-N -1 1 301.773 4.023 20 0 DIADMM CCOc1cc(-c2noc(C=C3CCCC3)n2)cc(Cl)c1[O-] ZINC000519071761 1042932441 /nfs/dbraw/zinc/93/24/41/1042932441.db2.gz ZCEKOBLNUNALPS-UHFFFAOYSA-N -1 1 320.776 4.452 20 0 DIADMM O=C(N[C@@H]1CCCCC12CCCC2)c1c([O-])cccc1Cl ZINC001141558470 1042950066 /nfs/dbraw/zinc/95/00/66/1042950066.db2.gz VFTQJWWOTVVPHL-CQSZACIVSA-N -1 1 307.821 4.278 20 0 DIADMM CC(C)(C)c1ccc(CN[C@H](C(=O)[O-])c2ccccc2F)cc1 ZINC000426770721 1042980129 /nfs/dbraw/zinc/98/01/29/1042980129.db2.gz VHPUPDDTJRJYAP-KRWDZBQOSA-N -1 1 315.388 4.039 20 0 DIADMM CCn1c2ccccc2c2cc(C=C3SC(=O)[N-]C3=O)ccc21 ZINC000007154838 1042984486 /nfs/dbraw/zinc/98/44/86/1042984486.db2.gz MXRTWMVXDVMZJB-YBEGLDIGSA-N -1 1 322.389 4.138 20 0 DIADMM Cc1cnc(C(=O)N(CC2CCC2)[C@@H](C)c2ccccc2)c([O-])c1 ZINC000427465168 1042989104 /nfs/dbraw/zinc/98/91/04/1042989104.db2.gz LQSXPEULSMKJGJ-HNNXBMFYSA-N -1 1 324.424 4.099 20 0 DIADMM O=C(Nc1ccc([O-])c(Cl)c1)c1cc2ccc(Cl)cc2[nH]1 ZINC000440944543 1043014255 /nfs/dbraw/zinc/01/42/55/1043014255.db2.gz MNFOWXSRXXGRLM-UHFFFAOYSA-N -1 1 321.163 4.433 20 0 DIADMM O=C([O-])CC[C@H]1CCCCN1Cc1ccc(Cl)cc1Cl ZINC000050924953 1043062965 /nfs/dbraw/zinc/06/29/65/1043062965.db2.gz XTRFVACOTSAHPM-CYBMUJFWSA-N -1 1 316.228 4.213 20 0 DIADMM Cc1nc(SCC[C@H]2CC2(Cl)Cl)[n-]c(=O)c1C1CC1 ZINC000865373110 1043088454 /nfs/dbraw/zinc/08/84/54/1043088454.db2.gz GHRVMRZWCSPAQE-VIFPVBQESA-N -1 1 319.257 4.044 20 0 DIADMM C[C@H](c1ccco1)N(Cc1ccc(C(=O)[O-])c(Cl)c1)C1CC1 ZINC000520594403 1043230799 /nfs/dbraw/zinc/23/07/99/1043230799.db2.gz KERNVLLKTZWHKO-LLVKDONJSA-N -1 1 319.788 4.357 20 0 DIADMM COc1c(Cl)cc(Cl)cc1C=C1SC(=S)[N-]C1=O ZINC000049391059 1043315780 /nfs/dbraw/zinc/31/57/80/1043315780.db2.gz HBMTYWBFPTYJAG-BAQGIRSFSA-N -1 1 320.222 4.331 20 0 DIADMM Cc1sccc1CN[C@@H](CC(=O)[O-])c1ccccc1Cl ZINC000871883441 1043412283 /nfs/dbraw/zinc/41/22/83/1043412283.db2.gz NJVVERKZHUCGSG-AWEZNQCLSA-N -1 1 309.818 4.016 20 0 DIADMM CCc1cc(NC(=O)c2cc(Cl)c([O-])c(OC)c2)ccc1C ZINC000443135725 1043497451 /nfs/dbraw/zinc/49/74/51/1043497451.db2.gz YFWVKUTXZPXPJU-UHFFFAOYSA-N -1 1 319.788 4.177 20 0 DIADMM O=C(Cc1ccc([O-])c(Cl)c1)Nc1ccccc1C(F)F ZINC001299752591 1043579766 /nfs/dbraw/zinc/57/97/66/1043579766.db2.gz FPUDEQXHBOVWEM-UHFFFAOYSA-N -1 1 311.715 4.164 20 0 DIADMM O=C1[N-]C(=O)C(=Cc2cccc(-c3ccc(Cl)cc3)c2)S1 ZINC000874929989 1043605493 /nfs/dbraw/zinc/60/54/93/1043605493.db2.gz UTQKXSHJBLQTOT-ZROIWOOFSA-N -1 1 315.781 4.331 20 0 DIADMM Cc1cc(C)cc(-c2ccc(C=C3SC(=O)[N-]C3=O)cc2)c1 ZINC000874927262 1043606369 /nfs/dbraw/zinc/60/63/69/1043606369.db2.gz FZACUYPKVNEDOJ-YBEGLDIGSA-N -1 1 309.390 4.294 20 0 DIADMM Cc1nc(C(C)C)ccc1CSc1nc(C2CC2)cc(=O)[n-]1 ZINC000558854487 1043617733 /nfs/dbraw/zinc/61/77/33/1043617733.db2.gz OTIYYEFMJLVYJT-UHFFFAOYSA-N -1 1 315.442 4.179 20 0 DIADMM CCCCCC[C@@H](C)NC(=O)c1cc(Cl)c([O-])c(OC)c1 ZINC000881466558 1044118523 /nfs/dbraw/zinc/11/85/23/1044118523.db2.gz ZRWMDDDJOWCCHU-LLVKDONJSA-N -1 1 313.825 4.143 20 0 DIADMM [O-]c1ccc(-c2noc(CCc3cccc(Cl)c3)n2)cc1F ZINC000562556098 1044129681 /nfs/dbraw/zinc/12/96/81/1044129681.db2.gz ULRBFXATZDYLDP-UHFFFAOYSA-N -1 1 318.735 4.020 20 0 DIADMM C[C@@H](c1ccc(Cl)c(Cl)c1)N1CCC[C@H](CC(=O)[O-])C1 ZINC000086757202 1044236819 /nfs/dbraw/zinc/23/68/19/1044236819.db2.gz NTAHZRFXDLNWHZ-WDEREUQCSA-N -1 1 316.228 4.241 20 0 DIADMM C[C@H](c1ccc(Cl)cc1Cl)N1CCC(C)(C(=O)[O-])CC1 ZINC000086776640 1044242085 /nfs/dbraw/zinc/24/20/85/1044242085.db2.gz KHTUFNXUWNTVLC-SNVBAGLBSA-N -1 1 316.228 4.241 20 0 DIADMM [O-]c1cccc(CN[C@H]2c3ccccc3CC[C@@H]2F)c1Cl ZINC000883381202 1044294436 /nfs/dbraw/zinc/29/44/36/1044294436.db2.gz IPJGYRKGPAASOO-YOEHRIQHSA-N -1 1 305.780 4.161 20 0 DIADMM CC(C)(C)C[C@H](NC(=O)c1c([O-])cccc1Cl)C(F)(F)F ZINC000778458283 1044409646 /nfs/dbraw/zinc/40/96/46/1044409646.db2.gz VTXFDESBOJOESB-JTQLQIEISA-N -1 1 323.742 4.143 20 0 DIADMM O=C([O-])c1occc1CN1CCCC[C@@H]1c1cc2ccccc2[nH]1 ZINC000565101737 1044412970 /nfs/dbraw/zinc/41/29/70/1044412970.db2.gz VPLKDJYBUWOUKX-QGZVFWFLSA-N -1 1 324.380 4.186 20 0 DIADMM Cc1oc(C(=O)[O-])cc1CN(C)[C@H](C)c1cc2ccccc2o1 ZINC000565104791 1044414270 /nfs/dbraw/zinc/41/42/70/1044414270.db2.gz WAZLJNHFFNXSMJ-LLVKDONJSA-N -1 1 313.353 4.225 20 0 DIADMM CSc1ccccc1CSc1nc(C(F)F)cc(=O)[n-]1 ZINC000566589921 1044501987 /nfs/dbraw/zinc/50/19/87/1044501987.db2.gz PJHCWHACPBOVLA-UHFFFAOYSA-N -1 1 314.382 4.134 20 0 DIADMM CCCCS[C@@H](C)C(=O)Nc1cc(F)c([O-])cc1Cl ZINC000885674961 1044584605 /nfs/dbraw/zinc/58/46/05/1044584605.db2.gz XEALLNPVPOHJRH-QMMMGPOBSA-N -1 1 305.802 4.045 20 0 DIADMM CCCCSCCC(=O)Nc1cc(F)c([O-])cc1Cl ZINC000885676730 1044585607 /nfs/dbraw/zinc/58/56/07/1044585607.db2.gz TUODFTDNIVLWEH-UHFFFAOYSA-N -1 1 305.802 4.047 20 0 DIADMM CCc1nc(S[C@@H](C)c2ncc(C(C)(C)C)o2)[n-]c(=O)c1C ZINC000568272213 1044612451 /nfs/dbraw/zinc/61/24/51/1044612451.db2.gz SADPFFZQWOPEEJ-JTQLQIEISA-N -1 1 321.446 4.192 20 0 DIADMM CCc1nc(SCc2ccc(Cl)c(F)c2)[n-]c(=O)c1C ZINC000568273485 1044613778 /nfs/dbraw/zinc/61/37/78/1044613778.db2.gz SNKZFEYXBGCBCQ-UHFFFAOYSA-N -1 1 312.797 4.138 20 0 DIADMM C/C=C/c1ccc([N-]S(=O)(=O)c2ccc(C(F)F)cc2)cc1 ZINC000568403916 1044621463 /nfs/dbraw/zinc/62/14/63/1044621463.db2.gz WSVRYYHXRKVIJJ-NSCUHMNNSA-N -1 1 323.364 4.458 20 0 DIADMM [O-]c1ccc(-c2noc(C3(C(F)(F)F)CCC3)n2)c(Cl)c1 ZINC000296770269 1044647395 /nfs/dbraw/zinc/64/73/95/1044647395.db2.gz KKOOCDUIBDMZLO-UHFFFAOYSA-N -1 1 318.682 4.080 20 0 DIADMM O=C1[N-]C(=S)SC1=Cc1cc(Cl)ccc1OC(F)F ZINC000044013048 1044729160 /nfs/dbraw/zinc/72/91/60/1044729160.db2.gz BRXACGVECOQQJD-YWEYNIOJSA-N -1 1 321.757 4.271 20 0 DIADMM CCOc1cc(-c2noc(CCC(C)C)n2)cc(Cl)c1[O-] ZINC000445432220 1044717663 /nfs/dbraw/zinc/71/76/63/1044717663.db2.gz ULUYDURUPKUZNL-UHFFFAOYSA-N -1 1 310.781 4.083 20 0 DIADMM [O-]c1ccc(-c2noc(/C=C/c3cccs3)n2)c(Cl)c1 ZINC000445450261 1044718202 /nfs/dbraw/zinc/71/82/02/1044718202.db2.gz XLQSFTRXOIOJIZ-GQCTYLIASA-N -1 1 304.758 4.328 20 0 DIADMM [O-]c1ccc(-c2noc(-c3cc4ccccc4[nH]3)n2)c(Cl)c1 ZINC000445450295 1044718707 /nfs/dbraw/zinc/71/87/07/1044718707.db2.gz RVKNVJUNYZVWSU-UHFFFAOYSA-N -1 1 311.728 4.244 20 0 DIADMM [O-]c1ccc(-c2noc([C@H]3CCc4ccccc43)n2)c(Cl)c1 ZINC000445445783 1044723966 /nfs/dbraw/zinc/72/39/66/1044723966.db2.gz KHGPMMMFJFSTEZ-ZDUSSCGKSA-N -1 1 312.756 4.174 20 0 DIADMM [O-]c1ccc(-c2noc(Cc3cccc(Cl)c3)n2)c(Cl)c1 ZINC000445447681 1044725417 /nfs/dbraw/zinc/72/54/17/1044725417.db2.gz ISRJEZHUYUNIKT-UHFFFAOYSA-N -1 1 321.163 4.340 20 0 DIADMM Cc1ccc2cc(-c3nc(-c4ccc([O-])c(F)c4)no3)[nH]c2c1 ZINC000445477237 1044729782 /nfs/dbraw/zinc/72/97/82/1044729782.db2.gz BEVNMXXYZNSUGC-UHFFFAOYSA-N -1 1 309.300 4.038 20 0 DIADMM CC(C)(Cc1ccccc1)c1nc(-c2ccc([O-])c(F)c2)no1 ZINC000445479805 1044730127 /nfs/dbraw/zinc/73/01/27/1044730127.db2.gz KOUZRHCLLYUESE-UHFFFAOYSA-N -1 1 312.344 4.102 20 0 DIADMM Cc1cccc(O[C@@H](C)c2nc(-c3ccc([O-])c(F)c3)no2)c1 ZINC000445477082 1044731303 /nfs/dbraw/zinc/73/13/03/1044731303.db2.gz AQYMOWXHAPJCRP-NSHDSACASA-N -1 1 314.316 4.030 20 0 DIADMM CCn1cc(-c2nc(-c3ccc([O-])c(F)c3)no2)c2ccccc21 ZINC000445483101 1044732893 /nfs/dbraw/zinc/73/28/93/1044732893.db2.gz VHMQNEOXIFFLIJ-UHFFFAOYSA-N -1 1 323.327 4.223 20 0 DIADMM [O-]c1ccc(-c2nc3cnc(C(F)(F)F)cc3[nH]2)cc1Cl ZINC000446146941 1044902606 /nfs/dbraw/zinc/90/26/06/1044902606.db2.gz YQNFXYCNIGLQFR-UHFFFAOYSA-N -1 1 313.666 4.003 20 0 DIADMM Oc1ccc(-c2nc3cc(C(F)(F)F)ncc3[nH]2)cc1Cl ZINC000446146941 1044902601 /nfs/dbraw/zinc/90/26/01/1044902601.db2.gz YQNFXYCNIGLQFR-UHFFFAOYSA-N -1 1 313.666 4.003 20 0 DIADMM O=C(CSc1nc(-c2ccccc2)co1)c1ccc([O-])cc1 ZINC000574022779 1044936105 /nfs/dbraw/zinc/93/61/05/1044936105.db2.gz NKEKMHBXWZMENQ-UHFFFAOYSA-N -1 1 311.362 4.022 20 0 DIADMM C[C@@H]1CCN(C(=O)c2c(F)ccc([O-])c2F)CC12CCCCC2 ZINC000575908857 1045018732 /nfs/dbraw/zinc/01/87/32/1045018732.db2.gz PDQSEQMHLIZIGG-GFCCVEGCSA-N -1 1 323.383 4.103 20 0 DIADMM CC(C)(C)Sc1cc(C(=O)Nc2ccc(F)cc2[O-])ccn1 ZINC000778942915 1045059891 /nfs/dbraw/zinc/05/98/91/1045059891.db2.gz VNGQZFFLWFPOEI-UHFFFAOYSA-N -1 1 320.389 4.069 20 0 DIADMM CCN(Cc1cc(C(=O)[O-])c(C)o1)[C@@H](C)c1ccc(F)cc1 ZINC000577404204 1045121121 /nfs/dbraw/zinc/12/11/21/1045121121.db2.gz GJEOTWNGRHCJMO-NSHDSACASA-N -1 1 305.349 4.008 20 0 DIADMM CCc1ccc([C@H](C)C(=O)Nc2ccc([O-])c(Cl)c2)cc1 ZINC000601052660 1045179649 /nfs/dbraw/zinc/17/96/49/1045179649.db2.gz YKERHWQWUFWBAH-NSHDSACASA-N -1 1 303.789 4.350 20 0 DIADMM O=C(Nc1nc(Cl)ccc1[O-])c1cc(Cl)sc1Cl ZINC000188346048 1045336639 /nfs/dbraw/zinc/33/66/39/1045336639.db2.gz ITFMHRRSAMPGMA-UHFFFAOYSA-N -1 1 323.588 4.061 20 0 DIADMM [O-]c1cccc(CN2CC3(CCC3)[C@@H]2c2ccco2)c1Cl ZINC000449634358 1045424676 /nfs/dbraw/zinc/42/46/76/1045424676.db2.gz ACMBVOKSKSHMEQ-INIZCTEOSA-N -1 1 303.789 4.366 20 0 DIADMM O=C(Nc1cc(Cl)c([O-])c2ccccc12)[C@@H]1CCCS1 ZINC000628233331 1045548502 /nfs/dbraw/zinc/54/85/02/1045548502.db2.gz WLNMDPKBIQSUBK-ZDUSSCGKSA-N -1 1 307.802 4.033 20 0 DIADMM COC[C@@H](C)[C@@H](C)C(=O)Nc1cc(Cl)c([O-])c2ccccc12 ZINC000628233617 1045549409 /nfs/dbraw/zinc/54/94/09/1045549409.db2.gz MLOGPJRFWGDZGB-GHMZBOCLSA-N -1 1 321.804 4.056 20 0 DIADMM CCN(C(=O)c1c([O-])cccc1Cl)[C@@H](C)Cc1ccsc1 ZINC000779334939 1045598693 /nfs/dbraw/zinc/59/86/93/1045598693.db2.gz SZBHVFNULJKPLY-NSHDSACASA-N -1 1 323.845 4.200 20 0 DIADMM CCCOc1ccc(Cl)cc1NC(=O)c1ccccc1[O-] ZINC000614809000 1045622022 /nfs/dbraw/zinc/62/20/22/1045622022.db2.gz ZXVNESFJHDPJHX-UHFFFAOYSA-N -1 1 305.761 4.087 20 0 DIADMM CCc1cc(O)ccc1NC(=O)c1cc2ccccc2cc1[O-] ZINC000191052286 1045650522 /nfs/dbraw/zinc/65/05/22/1045650522.db2.gz JTPVCZIDHHHHMU-UHFFFAOYSA-N -1 1 307.349 4.066 20 0 DIADMM O=C([N-][C@@H](C1CCCC1)C(F)(F)F)C(F)(F)c1ccccc1 ZINC000752470045 1045681783 /nfs/dbraw/zinc/68/17/83/1045681783.db2.gz NOSRDKQJSHCAKM-LBPRGKRZSA-N -1 1 321.289 4.016 20 0 DIADMM CC(C)(CC(=O)Nc1ccc([O-])c(Cl)c1)CC(F)(F)F ZINC000901162401 1045699828 /nfs/dbraw/zinc/69/98/28/1045699828.db2.gz KNWNDXKFLHYJDS-UHFFFAOYSA-N -1 1 309.715 4.353 20 0 DIADMM CC[C@@H](C)c1ccc(S(=O)(=O)[N-]c2ccc(C)nc2C)cc1 ZINC000530800590 1045730568 /nfs/dbraw/zinc/73/05/68/1045730568.db2.gz ROSTUUOPXNJBJI-GFCCVEGCSA-N -1 1 318.442 4.013 20 0 DIADMM CC(C)c1ccc2nc(-c3coc(C4CCC4)n3)[n-]c(=O)c2c1 ZINC000630384505 1045756433 /nfs/dbraw/zinc/75/64/33/1045756433.db2.gz AHVAHLIOXRFDHL-UHFFFAOYSA-N -1 1 309.369 4.381 20 0 DIADMM Cc1ccccc1[C@H](C)N(C)C(=O)Cc1ccc([O-])c(Cl)c1 ZINC000630699906 1045776324 /nfs/dbraw/zinc/77/63/24/1045776324.db2.gz VZQWVUIJMXCFHH-ZDUSSCGKSA-N -1 1 317.816 4.116 20 0 DIADMM CCN(CCC(=O)[O-])Cc1c(Cl)cccc1SC(C)C ZINC000901602429 1045777635 /nfs/dbraw/zinc/77/76/35/1045777635.db2.gz RXDKFGHEIVZKGN-UHFFFAOYSA-N -1 1 315.866 4.137 20 0 DIADMM CC(C)(C)CCOCSc1nc(-c2ccccc2)cc(=O)[n-]1 ZINC000901616837 1045778393 /nfs/dbraw/zinc/77/83/93/1045778393.db2.gz RGFTWTQRVFKHFK-UHFFFAOYSA-N -1 1 318.442 4.352 20 0 DIADMM CC[C@H](C)C[C@H](NCc1ccc(-c2ccc(C)cc2)o1)C(=O)[O-] ZINC000901670723 1045791384 /nfs/dbraw/zinc/79/13/84/1045791384.db2.gz CFRIJLGFVCNKFO-GUYCJALGSA-N -1 1 315.413 4.234 20 0 DIADMM CC[C@H](C)C[C@@H](NCc1cc2cc(C)c(C)cc2o1)C(=O)[O-] ZINC000901675234 1045793083 /nfs/dbraw/zinc/79/30/83/1045793083.db2.gz MQEAGPLLRUYAJP-MEDUHNTESA-N -1 1 303.402 4.029 20 0 DIADMM Cc1nc(S[C@@H](C)c2ccccc2F)[n-]c(=O)c1C1CC1 ZINC000631023669 1045798588 /nfs/dbraw/zinc/79/85/88/1045798588.db2.gz DEBIBJRKWXFAKZ-JTQLQIEISA-N -1 1 304.390 4.360 20 0 DIADMM Cc1nc(S[C@H](C)c2ccc(F)cc2F)[n-]c(=O)c1C1CC1 ZINC000631024475 1045798716 /nfs/dbraw/zinc/79/87/16/1045798716.db2.gz VBWHITCCQAFLGG-SECBINFHSA-N -1 1 322.380 4.500 20 0 DIADMM CCCCCc1nnc(-c2ccc(C(F)(F)F)cc2[O-])o1 ZINC001256073155 1045814139 /nfs/dbraw/zinc/81/41/39/1045814139.db2.gz IRJNWEBVNFMGOK-UHFFFAOYSA-N -1 1 300.280 4.194 20 0 DIADMM CCCCn1nc(C)c(/C=C\C(=O)c2ccc([O-])cc2)c1Cl ZINC000211367251 1045835986 /nfs/dbraw/zinc/83/59/86/1045835986.db2.gz NPEAQOYPWOLEFP-KTKRTIGZSA-N -1 1 318.804 4.247 20 0 DIADMM CC[C@H](C)N(CC(=O)[O-])Cc1ccc(-c2ccc(Cl)cc2)o1 ZINC000901989533 1045883949 /nfs/dbraw/zinc/88/39/49/1045883949.db2.gz RTUGMZXMINUIHA-LBPRGKRZSA-N -1 1 321.804 4.285 20 0 DIADMM CC(C)c1ccc(C[C@H](C)NC(=O)c2ccc([O-])cc2F)cc1 ZINC001137561663 1045897676 /nfs/dbraw/zinc/89/76/76/1045897676.db2.gz WXSCGTQANKOKOX-ZDUSSCGKSA-N -1 1 315.388 4.016 20 0 DIADMM CC(C)Sc1ccc(C(=O)Nc2ccc(F)cc2[O-])cc1 ZINC000531756380 1045915728 /nfs/dbraw/zinc/91/57/28/1045915728.db2.gz YQRZAAQVAHOKRW-UHFFFAOYSA-N -1 1 305.374 4.284 20 0 DIADMM CCc1oc(CN[C@H](C)c2cc(C)sc2C)cc1C(=O)[O-] ZINC000902112835 1045916361 /nfs/dbraw/zinc/91/63/61/1045916361.db2.gz PEVDAJKUIQPCHI-SNVBAGLBSA-N -1 1 307.415 4.069 20 0 DIADMM CCC(C)(C)c1ccc(CNC(=O)c2cc(F)ccc2[O-])cc1 ZINC001137726782 1045949105 /nfs/dbraw/zinc/94/91/05/1045949105.db2.gz XBMCXMWINASLDG-UHFFFAOYSA-N -1 1 315.388 4.149 20 0 DIADMM Cc1cc(CN[C@H]2CCCc3ccc(Cl)cc32)oc1C(=O)[O-] ZINC000902262351 1045959473 /nfs/dbraw/zinc/95/94/73/1045959473.db2.gz VTQRRKXRIMRITK-HNNXBMFYSA-N -1 1 319.788 4.107 20 0 DIADMM Cc1cc(CNC2(c3ccc(Cl)cc3)CCC2)oc1C(=O)[O-] ZINC000902371406 1045987006 /nfs/dbraw/zinc/98/70/06/1045987006.db2.gz ABALMPWWBOCLRN-UHFFFAOYSA-N -1 1 319.788 4.109 20 0 DIADMM CC(C)[C@@H]1CCc2[n-]n(Cc3cccc4cccnc43)c(=O)c2C1 ZINC000634592677 1046077383 /nfs/dbraw/zinc/07/73/83/1046077383.db2.gz QULPUDAORXCMAF-WBVHZDCISA-N -1 1 321.424 4.005 20 0 DIADMM CC(C)[C@@H]1CCc2[n-]n(Cc3cccc4cccnc43)c(=O)c2C1 ZINC000634592675 1046078037 /nfs/dbraw/zinc/07/80/37/1046078037.db2.gz QULPUDAORXCMAF-NVXWUHKLSA-N -1 1 321.424 4.005 20 0 DIADMM O=C(Nc1ccc(F)cc1[O-])c1cc(Cl)sc1Cl ZINC000532266441 1046126312 /nfs/dbraw/zinc/12/63/12/1046126312.db2.gz BZCAYCMJMXFTKQ-UHFFFAOYSA-N -1 1 306.145 4.152 20 0 DIADMM CC(C)(CC1CCCCCC1)NC(=O)c1ccc(F)c([O-])c1 ZINC001138278466 1046135723 /nfs/dbraw/zinc/13/57/23/1046135723.db2.gz RDZOWEQGUGNVIC-UHFFFAOYSA-N -1 1 307.409 4.400 20 0 DIADMM O=C(Nc1c([O-])cccc1F)c1cc2cccc(Cl)c2o1 ZINC000084631944 1046145760 /nfs/dbraw/zinc/14/57/60/1046145760.db2.gz XHNCUHLNWFVFFJ-UHFFFAOYSA-N -1 1 305.692 4.183 20 0 DIADMM C[N@@H+](Cc1ccc(Oc2ccccc2)cc1)Cc1ncccc1O ZINC001138394193 1046161774 /nfs/dbraw/zinc/16/17/74/1046161774.db2.gz JHEIUNXRYQNSCZ-UHFFFAOYSA-N -1 1 320.392 4.212 20 0 DIADMM [O-]c1c(F)c(F)ccc1Nc1ccc(Br)cc1F ZINC001212870938 1046240980 /nfs/dbraw/zinc/24/09/80/1046240980.db2.gz RSBPWPWUSHUDMQ-UHFFFAOYSA-N -1 1 318.092 4.316 20 0 DIADMM C[C@@H](O[N-]C(=O)CCC1CCCCC1)c1ncc(C(C)(C)C)o1 ZINC000089126803 1046253428 /nfs/dbraw/zinc/25/34/28/1046253428.db2.gz AHGOOBRKSWGLRD-CYBMUJFWSA-N -1 1 322.449 4.441 20 0 DIADMM O=C([O-])[C@H]1CCCCN1Cc1ccc(-c2ccccc2Cl)o1 ZINC000263387649 1046311516 /nfs/dbraw/zinc/31/15/16/1046311516.db2.gz DJFFIVUZQXROJU-OAHLLOKOSA-N -1 1 319.788 4.039 20 0 DIADMM CCC[C@H]1CCCCN1Cc1occ(C(F)(F)F)c1C(=O)[O-] ZINC000903894167 1046337802 /nfs/dbraw/zinc/33/78/02/1046337802.db2.gz PHSATFBMHYWNOL-JTQLQIEISA-N -1 1 319.323 4.151 20 0 DIADMM Cc1cc(C)cc([N-]S(=O)(=O)c2cccc(C(F)F)c2)c1 ZINC000780364747 1046383064 /nfs/dbraw/zinc/38/30/64/1046383064.db2.gz CXQKEILZWAROHA-UHFFFAOYSA-N -1 1 311.353 4.042 20 0 DIADMM CC(C)c1ccc(NC(=O)Nc2cc(F)c([O-])c(F)c2)cc1 ZINC001202924223 1046431464 /nfs/dbraw/zinc/43/14/64/1046431464.db2.gz FTQQKZHNXUESMP-UHFFFAOYSA-N -1 1 306.312 4.438 20 0 DIADMM C[C@@H]1CCC[C@@H](CNC(=O)c2ccc3ccccc3c2[O-])[C@H]1C ZINC001139524617 1046462660 /nfs/dbraw/zinc/46/26/60/1046462660.db2.gz SFAIHEJQOLRWGE-YCPHGPKFSA-N -1 1 311.425 4.348 20 0 DIADMM C[C@@H]1C[C@@H](CCNC(=O)c2ccc(F)c([O-])c2)CC(C)(C)C1 ZINC001139605846 1046484747 /nfs/dbraw/zinc/48/47/47/1046484747.db2.gz SGLFLDLOMMDIIA-CHWSQXEVSA-N -1 1 307.409 4.114 20 0 DIADMM CCCN(Cc1ccccc1F)C(=O)c1cc(Cl)ccc1[O-] ZINC000642065640 1046554702 /nfs/dbraw/zinc/55/47/02/1046554702.db2.gz IVSYJFLQDGGRJD-UHFFFAOYSA-N -1 1 321.779 4.237 20 0 DIADMM Cc1cc(C)cc(OCCC(=O)Nc2ccc([O-])c(Cl)c2)c1 ZINC000533082162 1046649857 /nfs/dbraw/zinc/64/98/57/1046649857.db2.gz XCMLLMSRYONPMJ-UHFFFAOYSA-N -1 1 319.788 4.070 20 0 DIADMM CC(C)c1ccsc1C(=O)NCc1ccc([O-])c(Cl)c1 ZINC000834833997 1046679881 /nfs/dbraw/zinc/67/98/81/1046679881.db2.gz SIXVWGYMHAPESO-UHFFFAOYSA-N -1 1 309.818 4.161 20 0 DIADMM O=C([O-])c1ccccc1CN1CCC[C@H]1c1c(F)cccc1F ZINC001140503287 1046756917 /nfs/dbraw/zinc/75/69/17/1046756917.db2.gz TWNXOZUSMSSHCQ-INIZCTEOSA-N -1 1 317.335 4.000 20 0 DIADMM [O-]c1cccc(CNc2ccc(F)cc2OC(F)F)c1Cl ZINC000645170522 1046772994 /nfs/dbraw/zinc/77/29/94/1046772994.db2.gz ATQOMZNFWBFPDP-UHFFFAOYSA-N -1 1 317.694 4.398 20 0 DIADMM [O-]c1cccc(CNC2(c3ccc(F)cc3F)CCC2)c1Cl ZINC000645170062 1046774004 /nfs/dbraw/zinc/77/40/04/1046774004.db2.gz UVALWMCWBCSBJQ-UHFFFAOYSA-N -1 1 323.770 4.493 20 0 DIADMM [O-]c1c(Cl)cc(Cl)cc1Nc1ccc(O)c(F)c1F ZINC001212008833 1046814072 /nfs/dbraw/zinc/81/40/72/1046814072.db2.gz FKYFFIWIPSAXLL-UHFFFAOYSA-N -1 1 306.095 4.426 20 0 DIADMM CC[C@@H]1CC[C@H](C)N(C(=O)c2ccc(C(F)(F)F)cc2[O-])C1 ZINC001140679444 1046848465 /nfs/dbraw/zinc/84/84/65/1046848465.db2.gz RQPLBZJEHHWFIG-WDEREUQCSA-N -1 1 315.335 4.062 20 0 DIADMM CCc1nc2cc(NCc3cccc([O-])c3Cl)ccc2o1 ZINC000393294082 1046868658 /nfs/dbraw/zinc/86/86/58/1046868658.db2.gz SWQCXSGFIFCWNP-UHFFFAOYSA-N -1 1 302.761 4.361 20 0 DIADMM Cc1ccc(-c2ccc(C(=O)Nc3c([O-])cccc3F)s2)o1 ZINC000679811398 1046904387 /nfs/dbraw/zinc/90/43/87/1046904387.db2.gz DOOSIEJZDHVNIG-UHFFFAOYSA-N -1 1 317.341 4.414 20 0 DIADMM CCc1ccc(N(CC2CC2)C(=O)c2cc(F)ccc2[O-])cc1 ZINC001141122859 1047020271 /nfs/dbraw/zinc/02/02/71/1047020271.db2.gz BLBSQXMWAMYHHA-UHFFFAOYSA-N -1 1 313.372 4.151 20 0 DIADMM COc1ccc(C(C)(C)C)cc1NC(=O)c1ccc([O-])c(F)c1 ZINC000681016092 1047083025 /nfs/dbraw/zinc/08/30/25/1047083025.db2.gz WXOFDTBLTKLIEG-UHFFFAOYSA-N -1 1 317.360 4.090 20 0 DIADMM CC1(C)CN(C(=O)c2ccc([O-])c(F)c2)c2cccc(Cl)c21 ZINC000681037098 1047083894 /nfs/dbraw/zinc/08/38/94/1047083894.db2.gz SVXDGFKENPARCF-UHFFFAOYSA-N -1 1 319.763 4.123 20 0 DIADMM CCC1CCC(N(C(=O)c2ccc([O-])c(F)c2)C2CC2)CC1 ZINC000681023848 1047084118 /nfs/dbraw/zinc/08/41/18/1047084118.db2.gz DPEAIWBPJZWKNS-UHFFFAOYSA-N -1 1 305.393 4.105 20 0 DIADMM CCCOc1ccc(NC(=O)c2ccc([O-])c(F)c2)cc1Cl ZINC000681020182 1047084606 /nfs/dbraw/zinc/08/46/06/1047084606.db2.gz VWERSFTZDVGUKI-UHFFFAOYSA-N -1 1 323.751 4.226 20 0 DIADMM O=C(c1ccc([O-])c(F)c1)N1CCC[C@@H]1c1ccccc1Cl ZINC000681018440 1047085362 /nfs/dbraw/zinc/08/53/62/1047085362.db2.gz BWLIAEDADGNUNB-OAHLLOKOSA-N -1 1 319.763 4.162 20 0 DIADMM CCCCN(C(=O)c1ccc([O-])c(F)c1)[C@H](C)c1ccc(C)o1 ZINC000681036728 1047085789 /nfs/dbraw/zinc/08/57/89/1047085789.db2.gz XJVKPQNDDFTBNN-CYBMUJFWSA-N -1 1 319.376 4.436 20 0 DIADMM Cc1ccc([C@H]2CCCCN2C(=O)c2ccc([O-])c(F)c2)cc1 ZINC000681049484 1047086814 /nfs/dbraw/zinc/08/68/14/1047086814.db2.gz OPBSXAMYXISNRY-QGZVFWFLSA-N -1 1 313.372 4.207 20 0 DIADMM O=C(Nc1ccc(Cl)cc1[O-])c1csc(-c2ccco2)n1 ZINC001116376442 1047134361 /nfs/dbraw/zinc/13/43/61/1047134361.db2.gz AINOCBVJYBLJRF-UHFFFAOYSA-N -1 1 320.757 4.014 20 0 DIADMM Cc1ccccc1C(F)(F)c1nc(-c2ccc([O-])cc2F)no1 ZINC001116809036 1047179434 /nfs/dbraw/zinc/17/94/34/1047179434.db2.gz LRVHCGSAKMIEKC-UHFFFAOYSA-N -1 1 320.270 4.030 20 0 DIADMM CC(C)c1ccoc1C(=O)Nc1ccc(Br)c([O-])c1 ZINC001117122673 1047195568 /nfs/dbraw/zinc/19/55/68/1047195568.db2.gz JJHANTHFSMGSGG-UHFFFAOYSA-N -1 1 324.174 4.123 20 0 DIADMM CCCOc1cccc(NC(=O)c2cc(SC)ccc2[O-])c1 ZINC001141571600 1047197133 /nfs/dbraw/zinc/19/71/33/1047197133.db2.gz AQKVKSYDYMZWIO-UHFFFAOYSA-N -1 1 317.410 4.155 20 0 DIADMM O=C(Nc1cccc2cnccc21)c1cc2ccccc2cc1[O-] ZINC000391838119 1047305959 /nfs/dbraw/zinc/30/59/59/1047305959.db2.gz KMIBLFGJIFVTAS-UHFFFAOYSA-N -1 1 314.344 4.346 20 0 DIADMM O=C([N-][C@@H](CCc1ccccc1)c1ccccc1)C(F)(F)F ZINC000725887559 1047322894 /nfs/dbraw/zinc/32/28/94/1047322894.db2.gz OLELFLLNTDCDOX-HNNXBMFYSA-N -1 1 307.315 4.039 20 0 DIADMM CC[C@H](Cc1ccccc1C)C(=O)Nc1cc(F)cc(F)c1[O-] ZINC001142545885 1047329959 /nfs/dbraw/zinc/32/99/59/1047329959.db2.gz LQEKFTPVNJNMPL-GFCCVEGCSA-N -1 1 319.351 4.186 20 0 DIADMM C[C@@H](Cc1ccccc1F)NC(=O)c1ccc2ccccc2c1[O-] ZINC001142079544 1047371130 /nfs/dbraw/zinc/37/11/30/1047371130.db2.gz WCCJKZDNWFNOKQ-ZDUSSCGKSA-N -1 1 323.367 4.046 20 0 DIADMM CC(C)CCOc1cccc(NC(=O)c2ccc(F)c([O-])c2)c1 ZINC001142340033 1047433270 /nfs/dbraw/zinc/43/32/70/1047433270.db2.gz QKASPDVXSRKWNP-UHFFFAOYSA-N -1 1 317.360 4.209 20 0 DIADMM CC1CCC(N(C(=O)Cc2ccc([O-])c(Cl)c2)C2CC2)CC1 ZINC001142428681 1047446037 /nfs/dbraw/zinc/44/60/37/1047446037.db2.gz XGDIHEDVLPEYDA-UHFFFAOYSA-N -1 1 321.848 4.158 20 0 DIADMM CC(C)(C)Oc1ccc(C(=O)Nc2cc(F)cc(F)c2[O-])cc1 ZINC001142541587 1047466501 /nfs/dbraw/zinc/46/65/01/1047466501.db2.gz CMMXKATZUNMGLD-UHFFFAOYSA-N -1 1 321.323 4.100 20 0 DIADMM CCc1ccc(C(C)(C)C(=O)Nc2cc(F)cc(F)c2[O-])cc1 ZINC001142542337 1047467021 /nfs/dbraw/zinc/46/70/21/1047467021.db2.gz PRWLIRUUQCEIHB-UHFFFAOYSA-N -1 1 319.351 4.149 20 0 DIADMM CC(C)c1ccccc1NC(=O)c1ccc2cccnc2c1[O-] ZINC001149314590 1047560153 /nfs/dbraw/zinc/56/01/53/1047560153.db2.gz JYYUHGURVYIWKJ-UHFFFAOYSA-N -1 1 306.365 4.316 20 0 DIADMM O=C(NCC1CCC2(CC2)CC1)c1ccc2ccccc2c1[O-] ZINC001149948191 1047572163 /nfs/dbraw/zinc/57/21/63/1047572163.db2.gz DMHRGHCENSQHFS-UHFFFAOYSA-N -1 1 309.409 4.246 20 0 DIADMM CCC[C@H](NC(=O)c1ccc(F)c([O-])c1)c1ccc(F)cc1F ZINC001150827451 1047585649 /nfs/dbraw/zinc/58/56/49/1047585649.db2.gz NBMHTZFCGJZLHE-HNNXBMFYSA-N -1 1 323.314 4.081 20 0 DIADMM Cc1ccc(-c2ccccc2NC(=O)c2ccc([O-])cn2)s1 ZINC001151523695 1047597873 /nfs/dbraw/zinc/59/78/73/1047597873.db2.gz MHPASGQLZLDLCM-UHFFFAOYSA-N -1 1 310.378 4.076 20 0 DIADMM Cc1ccc(Nc2ccc(F)c(Br)c2[O-])c(C)n1 ZINC001203375863 1047610302 /nfs/dbraw/zinc/61/03/02/1047610302.db2.gz DFFWQJFGPVABRD-UHFFFAOYSA-N -1 1 311.154 4.049 20 0 DIADMM CN(CCCc1ccccc1)C(=O)c1c([O-])ccc2ccccc21 ZINC001153505866 1047627047 /nfs/dbraw/zinc/62/70/47/1047627047.db2.gz PDFNBCTYNUHMSR-UHFFFAOYSA-N -1 1 319.404 4.250 20 0 DIADMM O=C(Nc1ccc2c(c1)N=NC2)c1c(O)cc2ccccc2c1[O-] ZINC001154027912 1047637871 /nfs/dbraw/zinc/63/78/71/1047637871.db2.gz HPVLGSKPQMNTQK-UHFFFAOYSA-N -1 1 319.320 4.101 20 0 DIADMM CS[C@H](CNC(=O)c1ccc2ccccc2c1[O-])C(C)(C)C ZINC001154125754 1047640311 /nfs/dbraw/zinc/64/03/11/1047640311.db2.gz GDPQYOLKVUOOLH-OAHLLOKOSA-N -1 1 317.454 4.053 20 0 DIADMM C[C@H](NC(=O)c1c([O-])cccc1F)c1cc2ccccc2s1 ZINC001154391653 1047647294 /nfs/dbraw/zinc/64/72/94/1047647294.db2.gz SBRXDKKDMSNZOG-JTQLQIEISA-N -1 1 315.369 4.237 20 0 DIADMM C[C@@H](OC(=O)c1ccc(Cl)c(Cl)c1[O-])c1ccncc1 ZINC000757714955 1047655398 /nfs/dbraw/zinc/65/53/98/1047655398.db2.gz KBBQJFRSXPLQJC-MRVPVSSYSA-N -1 1 312.152 4.012 20 0 DIADMM CSc1ccc(C)c([N-]S(=O)(=O)c2ccc(C)c(C)c2)c1 ZINC000538296705 1047667420 /nfs/dbraw/zinc/66/74/20/1047667420.db2.gz OQROADPGYAXSRX-UHFFFAOYSA-N -1 1 321.467 4.135 20 0 DIADMM CSc1ccc(C)c([N-]S(=O)(=O)c2cc(C)ccc2C)c1 ZINC000539398321 1047752597 /nfs/dbraw/zinc/75/25/97/1047752597.db2.gz XRKOJVFICNGLKW-UHFFFAOYSA-N -1 1 321.467 4.135 20 0 DIADMM O=C(Nc1ccc([O-])c(F)c1F)c1cccc(C2CCC2)c1 ZINC001157811560 1047755858 /nfs/dbraw/zinc/75/58/58/1047755858.db2.gz HTOWBYLCSVUWMW-UHFFFAOYSA-N -1 1 303.308 4.190 20 0 DIADMM CC[C@H](Cc1cccc(C)c1)C(=O)Nc1ccc([O-])c(F)c1F ZINC001157811728 1047755878 /nfs/dbraw/zinc/75/58/78/1047755878.db2.gz PVVOJXRFTPLDIF-CYBMUJFWSA-N -1 1 319.351 4.186 20 0 DIADMM Cc1ccc(CCC(=O)Nc2cc(F)c([O-])cc2Cl)c(C)c1 ZINC001157893299 1047762561 /nfs/dbraw/zinc/76/25/61/1047762561.db2.gz FXYAPGBHCSINMT-UHFFFAOYSA-N -1 1 321.779 4.373 20 0 DIADMM CSc1ccc([O-])c(C(=O)Nc2ccccc2C(C)(F)F)c1 ZINC001158439902 1047780275 /nfs/dbraw/zinc/78/02/75/1047780275.db2.gz ZMMWPFGFVZXPMR-UHFFFAOYSA-N -1 1 323.364 4.478 20 0 DIADMM [O-]c1c(Cl)cc(Cl)cc1Nc1c[nH]c2ncc(F)cc12 ZINC001159591058 1047874603 /nfs/dbraw/zinc/87/46/03/1047874603.db2.gz HEMFHZMPEFKWPX-UHFFFAOYSA-N -1 1 312.131 4.458 20 0 DIADMM CC(C)(O)c1cncc(Nc2ccc(Cl)c(Cl)c2[O-])c1 ZINC001174594205 1047898519 /nfs/dbraw/zinc/89/85/19/1047898519.db2.gz WCLHZNDISLZJCD-UHFFFAOYSA-N -1 1 313.184 4.065 20 0 DIADMM CC(C)=CNc1cc(Br)c([O-])c(Br)c1 ZINC001174557303 1047904066 /nfs/dbraw/zinc/90/40/66/1047904066.db2.gz ZZAULCSDRQVNHY-UHFFFAOYSA-N -1 1 321.012 4.253 20 0 DIADMM O=C(Nc1nc(Cl)ccc1[O-])c1cccc(C2CCCC2)c1 ZINC001183218453 1047904858 /nfs/dbraw/zinc/90/48/58/1047904858.db2.gz KMRGABAJPUYBTF-UHFFFAOYSA-N -1 1 316.788 4.351 20 0 DIADMM O=c1oc2cc([O-])ccc2cc1Nc1ccc(C(F)F)cc1 ZINC001174714473 1047950560 /nfs/dbraw/zinc/95/05/60/1047950560.db2.gz UKYXWYNPCPMGOI-UHFFFAOYSA-N -1 1 303.264 4.180 20 0 DIADMM Nc1nc2cc(Nc3cc(Cl)c([O-])cc3F)ccc2s1 ZINC001160006230 1047967335 /nfs/dbraw/zinc/96/73/35/1047967335.db2.gz RTMNUVRKXUSCJE-UHFFFAOYSA-N -1 1 309.753 4.120 20 0 DIADMM CSc1cnc(F)c(Nc2cc([O-])c(Cl)cc2F)c1 ZINC001250140501 1047995218 /nfs/dbraw/zinc/99/52/18/1047995218.db2.gz QEOCESZZVBKMMJ-UHFFFAOYSA-N -1 1 302.733 4.184 20 0 DIADMM [O-]c1c(Cl)nccc1Nc1ccc(Oc2cccnc2)cc1 ZINC001174849568 1047998592 /nfs/dbraw/zinc/99/85/92/1047998592.db2.gz PSGCJFNQXXTFIX-UHFFFAOYSA-N -1 1 313.744 4.372 20 0 DIADMM Cc1c(Cl)cccc1NC(=O)Nc1cc(F)c([O-])cc1F ZINC001184682390 1048083924 /nfs/dbraw/zinc/08/39/24/1048083924.db2.gz CFTGBUFAWQSBEP-UHFFFAOYSA-N -1 1 312.703 4.276 20 0 DIADMM O=C(Nc1cc([O-])c(F)cc1F)[C@@H]1CCC[C@H]2CCCC[C@H]21 ZINC001160916192 1048097968 /nfs/dbraw/zinc/09/79/68/1048097968.db2.gz GGGBZWUCYLVFAN-IJLUTSLNSA-N -1 1 309.356 4.215 20 0 DIADMM CCOc1ccc(F)c(Nc2c([O-])cc(F)cc2F)c1F ZINC001175038829 1048103602 /nfs/dbraw/zinc/10/36/02/1048103602.db2.gz ZZQSGQBLJCDLKA-UHFFFAOYSA-N -1 1 301.239 4.091 20 0 DIADMM [O-]c1ccc(Cl)c(Nc2cccnc2N2CCCC2)c1Cl ZINC001184968464 1048107347 /nfs/dbraw/zinc/10/73/47/1048107347.db2.gz MOKMLXZMBWSGCQ-UHFFFAOYSA-N -1 1 324.211 4.438 20 0 DIADMM [O-]c1c(Cl)cc(Cl)cc1Nc1cccnc1N1CCCC1 ZINC001184969012 1048108152 /nfs/dbraw/zinc/10/81/52/1048108152.db2.gz VCMAPHCPJMPYED-UHFFFAOYSA-N -1 1 324.211 4.438 20 0 DIADMM O=C1CCCCc2c(Nc3c(F)cc([O-])cc3F)cccc21 ZINC001175099431 1048114134 /nfs/dbraw/zinc/11/41/34/1048114134.db2.gz GOIJCLKSCQCVFV-UHFFFAOYSA-N -1 1 303.308 4.323 20 0 DIADMM [O-]c1c(Cl)nccc1Nc1ccc(F)cc1C(F)(F)F ZINC001175100822 1048116242 /nfs/dbraw/zinc/11/62/42/1048116242.db2.gz FONVZMXTYYZFRE-UHFFFAOYSA-N -1 1 306.646 4.342 20 0 DIADMM COc1ccc(Nc2ccnc(Cl)c2[O-])cc1C(F)(F)F ZINC001175071468 1048127127 /nfs/dbraw/zinc/12/71/27/1048127127.db2.gz NZINFTCCWGVTHH-UHFFFAOYSA-N -1 1 318.682 4.212 20 0 DIADMM COc1ccc(Nc2cc(F)c([O-])cc2F)cc1C(F)(F)F ZINC001175072383 1048127868 /nfs/dbraw/zinc/12/78/68/1048127868.db2.gz GWXKKLYKLLPICY-UHFFFAOYSA-N -1 1 319.229 4.441 20 0 DIADMM [O-]c1c(Cl)nccc1Nc1ccc(F)c(C(F)(F)F)c1 ZINC001175074828 1048129229 /nfs/dbraw/zinc/12/92/29/1048129229.db2.gz FGKWDKILOBYXCT-UHFFFAOYSA-N -1 1 306.646 4.342 20 0 DIADMM [O-]c1c(Cl)nccc1Nc1cc(C(F)(F)F)ccc1F ZINC001175076536 1048130206 /nfs/dbraw/zinc/13/02/06/1048130206.db2.gz ZHDDLOSXDISXDC-UHFFFAOYSA-N -1 1 306.646 4.342 20 0 DIADMM CCC[C@@H](NC(=O)c1ccc(C(F)(F)F)cc1[O-])C1CCC1 ZINC001161465832 1048132176 /nfs/dbraw/zinc/13/21/76/1048132176.db2.gz GPFUWLUPNPVKKU-CYBMUJFWSA-N -1 1 315.335 4.110 20 0 DIADMM CC(C)(C)C[C@@H]1CCN(C(=O)c2ccc([O-])cc2F)C1(C)C ZINC001161555284 1048138191 /nfs/dbraw/zinc/13/81/91/1048138191.db2.gz ZVKDMIHQOHKWRK-LBPRGKRZSA-N -1 1 307.409 4.208 20 0 DIADMM [O-]c1c(Cl)c(Cl)ccc1Nc1cc(CO)ccc1F ZINC001175132778 1048158301 /nfs/dbraw/zinc/15/83/01/1048158301.db2.gz GMBWZFHSOCTRHR-UHFFFAOYSA-N -1 1 302.132 4.074 20 0 DIADMM O=C(Nc1ccc(F)c(F)c1F)Nc1cccc([O-])c1Cl ZINC001185331530 1048166989 /nfs/dbraw/zinc/16/69/89/1048166989.db2.gz TVPOZAMRUAYYES-UHFFFAOYSA-N -1 1 316.666 4.107 20 0 DIADMM CCCCCCNC(=S)Nc1cc([O-])c(Cl)cc1F ZINC001200953774 1048170730 /nfs/dbraw/zinc/17/07/30/1048170730.db2.gz BJGYYTRPCZPJCT-UHFFFAOYSA-N -1 1 304.818 4.051 20 0 DIADMM [O-]c1cc(F)cc(F)c1Nc1cccc(O[C@@H]2CCCCO2)c1 ZINC001175187090 1048190297 /nfs/dbraw/zinc/19/02/97/1048190297.db2.gz USJLHWGDSCOOIN-MRXNPFEDSA-N -1 1 321.323 4.319 20 0 DIADMM C=Cc1ccc([N-]S(=O)(=O)c2ccc(Cl)c(C)c2)cc1 ZINC001185524141 1048192222 /nfs/dbraw/zinc/19/22/22/1048192222.db2.gz BNXIDKNJECEGQZ-UHFFFAOYSA-N -1 1 307.802 4.092 20 0 DIADMM Cc1cc(C)cc(NC(=S)Nc2ccc([O-])c(F)c2F)c1 ZINC001201206818 1048217457 /nfs/dbraw/zinc/21/74/57/1048217457.db2.gz VVQUDWHMTFKPKA-UHFFFAOYSA-N -1 1 308.353 4.096 20 0 DIADMM Cc1nsc([N-]c2c(F)cccc2OCc2ccccc2)n1 ZINC001175279288 1048227278 /nfs/dbraw/zinc/22/72/78/1048227278.db2.gz UVEMHKLGCPDOJG-UHFFFAOYSA-N -1 1 315.373 4.308 20 0 DIADMM Cc1ccc(C(C)C)cc1[N-]S(=O)(=O)c1cccc(F)c1C ZINC001185828748 1048231647 /nfs/dbraw/zinc/23/16/47/1048231647.db2.gz IRUADUDQQCYWJB-UHFFFAOYSA-N -1 1 321.417 4.367 20 0 DIADMM Cc1c(F)cccc1S(=O)(=O)[N-]c1ccccc1CC(C)C ZINC001185836219 1048232647 /nfs/dbraw/zinc/23/26/47/1048232647.db2.gz IZHPPDMJCNUVFU-UHFFFAOYSA-N -1 1 321.417 4.133 20 0 DIADMM O=C(Nc1c([O-])cc(C(F)(F)F)cc1Cl)NC1CCCC1 ZINC001185902848 1048240034 /nfs/dbraw/zinc/24/00/34/1048240034.db2.gz OGAKQQOHDGLZLG-UHFFFAOYSA-N -1 1 322.714 4.129 20 0 DIADMM Cc1nonc1[N-]c1ccc(C(F)(F)F)cc1C(F)(F)F ZINC001201350880 1048246961 /nfs/dbraw/zinc/24/69/61/1048246961.db2.gz LSPHXTSBOTYFKV-UHFFFAOYSA-N -1 1 311.185 4.159 20 0 DIADMM C/C(=C\c1ccc(Cl)cc1)C(=O)Nc1cc(F)cc(F)c1[O-] ZINC001162290588 1048258104 /nfs/dbraw/zinc/25/81/04/1048258104.db2.gz BEMWLOQRGPOKDP-RMKNXTFCSA-N -1 1 323.726 4.366 20 0 DIADMM O=C(Nc1cc(F)cc(F)c1[O-])[C@@H]1C[C@H]1c1cccc(Cl)c1 ZINC001162295496 1048258867 /nfs/dbraw/zinc/25/88/67/1048258867.db2.gz HVSSQNYERHVCIZ-NWDGAFQWSA-N -1 1 323.726 4.066 20 0 DIADMM Cc1nc2cc(NC(=O)c3ccc([O-])c(F)c3)c(C)cc2s1 ZINC001186226936 1048273985 /nfs/dbraw/zinc/27/39/85/1048273985.db2.gz VFBSCOYKNBWVHG-UHFFFAOYSA-N -1 1 316.357 4.010 20 0 DIADMM CC(C)N(C(=O)c1ccc([O-])c(F)c1)[C@@H](C)c1ccccc1 ZINC001186219158 1048276867 /nfs/dbraw/zinc/27/68/67/1048276867.db2.gz MPLMELMOVVCMSJ-ZDUSSCGKSA-N -1 1 301.361 4.143 20 0 DIADMM COc1ncc([N-]c2cc(-c3ccccc3Cl)no2)s1 ZINC001175387048 1048295213 /nfs/dbraw/zinc/29/52/13/1048295213.db2.gz LZOAUQQMWIEGLX-UHFFFAOYSA-N -1 1 307.762 4.204 20 0 DIADMM C[S@@](=O)c1ccc(Nc2ccc(Cl)c(Cl)c2[O-])cc1 ZINC001175477288 1048317708 /nfs/dbraw/zinc/31/77/08/1048317708.db2.gz AAZCDTPSCOGATG-LJQANCHMSA-N -1 1 316.209 4.180 20 0 DIADMM O=C(NCC1CCCCC1)Nc1cc(Cl)c(Cl)cc1[O-] ZINC001186881226 1048351038 /nfs/dbraw/zinc/35/10/38/1048351038.db2.gz YWLVRPKDAATDLN-UHFFFAOYSA-N -1 1 317.216 4.401 20 0 DIADMM Cn1cc2c(cccc2Nc2cc(Cl)c([O-])cc2Cl)n1 ZINC001175592896 1048362242 /nfs/dbraw/zinc/36/22/42/1048362242.db2.gz CVNUHLSNLPEJRL-UHFFFAOYSA-N -1 1 308.168 4.329 20 0 DIADMM O=C(Nc1ccc(F)c(Cl)c1)Nc1ccc([O-])c(F)c1F ZINC001187696472 1048429111 /nfs/dbraw/zinc/42/91/11/1048429111.db2.gz SPONWDGNJHUBMF-UHFFFAOYSA-N -1 1 316.666 4.107 20 0 DIADMM O=C(Nc1ccc(F)cc1[O-])Nc1c(Cl)cccc1Cl ZINC001202104508 1048451798 /nfs/dbraw/zinc/45/17/98/1048451798.db2.gz MACAPJGMDYYLHJ-UHFFFAOYSA-N -1 1 315.131 4.482 20 0 DIADMM Cc1ccc(NC(=O)Nc2cc([O-])c(Cl)cc2F)cc1F ZINC001187985631 1048458070 /nfs/dbraw/zinc/45/80/70/1048458070.db2.gz GZAOSDPYYDCXKW-UHFFFAOYSA-N -1 1 312.703 4.276 20 0 DIADMM CSc1ccc(NC(=O)Nc2cc(F)c([O-])c(F)c2)cc1 ZINC001188109988 1048476692 /nfs/dbraw/zinc/47/66/92/1048476692.db2.gz PBGIIEHNJFXBII-UHFFFAOYSA-N -1 1 310.325 4.036 20 0 DIADMM CCCc1cc(=O)[n-]c(S[C@@H](C)c2ccc3c(c2)CCC3)n1 ZINC001188161555 1048487790 /nfs/dbraw/zinc/48/77/90/1048487790.db2.gz AYVAFIIRUDZWDQ-LBPRGKRZSA-N -1 1 314.454 4.477 20 0 DIADMM O=C(Nc1cc([O-])c(F)cc1F)Nc1cccc(Cl)c1F ZINC001188410110 1048513403 /nfs/dbraw/zinc/51/34/03/1048513403.db2.gz YEVTZYKETPRXJG-UHFFFAOYSA-N -1 1 316.666 4.107 20 0 DIADMM Cc1csc(NC(=O)c2ccc([O-])c(C(F)(F)F)c2)c1 ZINC001188563325 1048521809 /nfs/dbraw/zinc/52/18/09/1048521809.db2.gz JTGDVBMPGKDUCW-UHFFFAOYSA-N -1 1 301.289 4.033 20 0 DIADMM Cc1cccc(NC(=O)Nc2cccc(C(F)(F)F)c2[O-])c1 ZINC001202316879 1048522192 /nfs/dbraw/zinc/52/21/92/1048522192.db2.gz CZLCAKPCRGSPDH-UHFFFAOYSA-N -1 1 310.275 4.363 20 0 DIADMM CC(C)c1cccnc1NC(=O)c1ccc([O-])c(C(F)(F)F)c1 ZINC001188572619 1048522442 /nfs/dbraw/zinc/52/24/42/1048522442.db2.gz RSZXJEPJLWEULA-UHFFFAOYSA-N -1 1 324.302 4.182 20 0 DIADMM CN(C)C(=O)c1cccc(N=C2CC(C)(C)CC(C)(C)C2)c1[O-] ZINC001175947662 1048523880 /nfs/dbraw/zinc/52/38/80/1048523880.db2.gz OYBGIEYCFWBMOZ-UHFFFAOYSA-N -1 1 316.445 4.236 20 0 DIADMM O=C(Nc1ccc2ccccc2c1)Nc1cc(F)c([O-])cc1F ZINC001188608808 1048527328 /nfs/dbraw/zinc/52/73/28/1048527328.db2.gz KESJAWDIVCCGNW-UHFFFAOYSA-N -1 1 314.291 4.468 20 0 DIADMM [O-]c1ccc(CNc2nc(Cl)nc3ccccc32)cc1Cl ZINC001164060414 1048574032 /nfs/dbraw/zinc/57/40/32/1048574032.db2.gz FYCXXAQTNRREDT-UHFFFAOYSA-N -1 1 320.179 4.254 20 0 DIADMM CCc1cc(=O)[n-]c(SCc2cccc(C(C)(C)C)c2)n1 ZINC001189174144 1048603474 /nfs/dbraw/zinc/60/34/74/1048603474.db2.gz QHIVXGUBMRQIRG-UHFFFAOYSA-N -1 1 302.443 4.334 20 0 DIADMM CCCCOc1ccc(NC(=O)Nc2cccc(F)c2[O-])cc1 ZINC001189315138 1048616316 /nfs/dbraw/zinc/61/63/16/1048616316.db2.gz OJZJSNYKQXRFOC-UHFFFAOYSA-N -1 1 318.348 4.354 20 0 DIADMM COc1ccc(Nc2ccc(Cl)c(Cl)c2[O-])cc1O ZINC001176259973 1048625420 /nfs/dbraw/zinc/62/54/20/1048625420.db2.gz XZPUYLPHEPCOAM-UHFFFAOYSA-N -1 1 300.141 4.157 20 0 DIADMM CCSc1ccccc1CSc1nc(CC)c(C)c(=O)[n-]1 ZINC001189495932 1048630710 /nfs/dbraw/zinc/63/07/10/1048630710.db2.gz SQCSAQFVTHCAMA-UHFFFAOYSA-N -1 1 320.483 4.457 20 0 DIADMM Cc1cccc(C(=O)Nc2cc(C)cc(Br)c2[O-])c1 ZINC000482577715 1048638639 /nfs/dbraw/zinc/63/86/39/1048638639.db2.gz OUIRBHPSHUNAJH-UHFFFAOYSA-N -1 1 320.186 4.024 20 0 DIADMM CCCc1cc(=O)[n-]c(S[C@H]2CCc3ccc(F)cc32)n1 ZINC001164551059 1048640465 /nfs/dbraw/zinc/64/04/65/1048640465.db2.gz GCYGNEJKFMUTLX-AWEZNQCLSA-N -1 1 304.390 4.053 20 0 DIADMM CCCc1cc(=O)[n-]c(SCc2cc(F)ccc2Cl)n1 ZINC001164551129 1048640514 /nfs/dbraw/zinc/64/05/14/1048640514.db2.gz HPJBZLYLEHWMFH-UHFFFAOYSA-N -1 1 312.797 4.220 20 0 DIADMM CCCc1cc(=O)[n-]c(S[C@@H](C)c2ccc(F)c(F)c2)n1 ZINC001164552260 1048641430 /nfs/dbraw/zinc/64/14/30/1048641430.db2.gz UDBWCBVOGHMZIK-VIFPVBQESA-N -1 1 310.369 4.266 20 0 DIADMM CCc1cccc(CC)c1NC(=O)Nc1cc([O-])c(F)cc1F ZINC001189770052 1048664189 /nfs/dbraw/zinc/66/41/89/1048664189.db2.gz ZBMYEMJJPKNCFC-UHFFFAOYSA-N -1 1 320.339 4.439 20 0 DIADMM Cc1c(Cl)cc(Nc2ccc3c(c2)CC(=O)N3)c([O-])c1Cl ZINC001176432845 1048670171 /nfs/dbraw/zinc/67/01/71/1048670171.db2.gz NBQSMDMYIIFISX-UHFFFAOYSA-N -1 1 323.179 4.246 20 0 DIADMM [O-]c1c(F)c(F)ccc1Nc1cc(F)cc(N2CCCC2)c1 ZINC001176420061 1048682969 /nfs/dbraw/zinc/68/29/69/1048682969.db2.gz QWUMNAJSOCJPPM-UHFFFAOYSA-N -1 1 308.303 4.153 20 0 DIADMM Cc1cc([N-]c2nnc(Br)s2)c(F)cc1Cl ZINC001176523239 1048707833 /nfs/dbraw/zinc/70/78/33/1048707833.db2.gz ZMQKAVJNWWSGOP-UHFFFAOYSA-N -1 1 322.590 4.145 20 0 DIADMM COc1ccc(O)cc1Nc1ccc(Cl)c(Cl)c1[O-] ZINC001176581615 1048715655 /nfs/dbraw/zinc/71/56/55/1048715655.db2.gz LFOQWVZDFBNSKC-UHFFFAOYSA-N -1 1 300.141 4.157 20 0 DIADMM CC(C)c1ccccc1[N-]S(=O)(=O)c1ccc(C2CC2)cc1 ZINC001190464085 1048740739 /nfs/dbraw/zinc/74/07/39/1048740739.db2.gz KSDLWJTVDJKLOR-UHFFFAOYSA-N -1 1 315.438 4.488 20 0 DIADMM CC(C)c1cccc([N-]S(=O)(=O)c2ccc(C3CC3)cc2)c1 ZINC001190464933 1048744418 /nfs/dbraw/zinc/74/44/18/1048744418.db2.gz ZJOPTKUDAPVEMA-UHFFFAOYSA-N -1 1 315.438 4.488 20 0 DIADMM [O-]c1cc(F)c(Nc2ccc(OC(F)(F)F)cc2)cc1F ZINC001176642725 1048747496 /nfs/dbraw/zinc/74/74/96/1048747496.db2.gz GQAXERUFBJERKY-UHFFFAOYSA-N -1 1 305.202 4.313 20 0 DIADMM Cc1cc(C(F)(F)F)ncc1Nc1c(F)cc(F)c([O-])c1F ZINC001176663539 1048751524 /nfs/dbraw/zinc/75/15/24/1048751524.db2.gz IUZUVSHFIOTNLA-UHFFFAOYSA-N -1 1 322.208 4.275 20 0 DIADMM [O-]c1c(F)cc(F)c(Nc2ccc(O)cc2C(F)(F)F)c1F ZINC001176670842 1048754607 /nfs/dbraw/zinc/75/46/07/1048754607.db2.gz NFOCPSQTKFRUNQ-UHFFFAOYSA-N -1 1 323.192 4.278 20 0 DIADMM COc1ccc(Cl)c(Nc2c(F)cc(F)c([O-])c2F)c1 ZINC001176669828 1048755238 /nfs/dbraw/zinc/75/52/38/1048755238.db2.gz LOGHUZQYTVRYPO-UHFFFAOYSA-N -1 1 303.667 4.215 20 0 DIADMM [O-]c1c(F)cc(F)c(Nc2ccc(OC(F)(F)F)cc2)c1F ZINC001176671778 1048755322 /nfs/dbraw/zinc/75/53/22/1048755322.db2.gz OQAJDGUNAWTDOM-UHFFFAOYSA-N -1 1 323.192 4.452 20 0 DIADMM [O-]c1c(F)cc(F)c(Nc2cc(F)c(F)cc2Cl)c1F ZINC001176672176 1048755812 /nfs/dbraw/zinc/75/58/12/1048755812.db2.gz GGCFSYHUDUOPGY-UHFFFAOYSA-N -1 1 309.621 4.485 20 0 DIADMM [O-]c1c(F)cc(F)c(Nc2ccc(-c3ccncn3)cc2)c1F ZINC001176670151 1048756140 /nfs/dbraw/zinc/75/61/40/1048756140.db2.gz AMEASNCABRSABQ-UHFFFAOYSA-N -1 1 317.270 4.010 20 0 DIADMM Cc1c(Cl)ccc(N)c1Nc1c(F)cc(F)c([O-])c1F ZINC001176670841 1048756320 /nfs/dbraw/zinc/75/63/20/1048756320.db2.gz NDXKZGOOGNWXFX-UHFFFAOYSA-N -1 1 302.683 4.097 20 0 DIADMM CCOc1c(F)cccc1Nc1c(F)cc(F)c([O-])c1F ZINC001176673513 1048756976 /nfs/dbraw/zinc/75/69/76/1048756976.db2.gz IVYQLZIQNDBXAD-UHFFFAOYSA-N -1 1 301.239 4.091 20 0 DIADMM [O-]c1c(F)cc(F)c(Nc2cc(F)c(Cl)cc2F)c1F ZINC001176673029 1048757268 /nfs/dbraw/zinc/75/72/68/1048757268.db2.gz CVWOEFWVHZASLL-UHFFFAOYSA-N -1 1 309.621 4.485 20 0 DIADMM Nc1cc(Cl)c(Cl)cc1Nc1c(F)cc(F)c([O-])c1F ZINC001176673290 1048758287 /nfs/dbraw/zinc/75/82/87/1048758287.db2.gz RXEDTGADDUYBOZ-UHFFFAOYSA-N -1 1 323.101 4.442 20 0 DIADMM CCC[C@@H](C)c1cc(Nc2c(F)cc(F)c([O-])c2F)on1 ZINC001176663193 1048768889 /nfs/dbraw/zinc/76/88/89/1048768889.db2.gz CVCQDUHIBJPDQE-SSDOTTSWSA-N -1 1 300.280 4.445 20 0 DIADMM COCOc1ccc(F)cc1Nc1cc([O-])c(Cl)cc1F ZINC001176719522 1048785695 /nfs/dbraw/zinc/78/56/95/1048785695.db2.gz IHQIZAIEHBDVGT-UHFFFAOYSA-N -1 1 315.703 4.050 20 0 DIADMM COc1cc(C(=O)Nc2cc(C)c(C)cc2C)cc(Cl)c1[O-] ZINC001191148747 1048866571 /nfs/dbraw/zinc/86/65/71/1048866571.db2.gz RCMGCUUKRVLBLT-UHFFFAOYSA-N -1 1 319.788 4.232 20 0 DIADMM COc1ncc(Nc2cc(Cl)c(C)c(Cl)c2[O-])cc1F ZINC001203413532 1048896502 /nfs/dbraw/zinc/89/65/02/1048896502.db2.gz JANGUHQXVKESCJ-UHFFFAOYSA-N -1 1 317.147 4.294 20 0 DIADMM O=C(Nc1ccc([O-])c(Cl)c1)c1cc(F)c(F)cc1Cl ZINC000111666838 1048928238 /nfs/dbraw/zinc/92/82/38/1048928238.db2.gz LAZHIJVJBUGOOR-UHFFFAOYSA-N -1 1 318.106 4.230 20 0 DIADMM CCN(C(=O)c1ccc(C(F)(F)F)cc1[O-])c1ccc(C)cc1 ZINC000776703665 1048934174 /nfs/dbraw/zinc/93/41/74/1048934174.db2.gz ZMPHPLQVVRZOFR-UHFFFAOYSA-N -1 1 323.314 4.386 20 0 DIADMM O=S(=O)(CC1CCCC1)[N-]c1cc(-c2ccccc2)cs1 ZINC001191487778 1048953130 /nfs/dbraw/zinc/95/31/30/1048953130.db2.gz CLOQIPDQNVCOKT-UHFFFAOYSA-N -1 1 321.467 4.347 20 0 DIADMM Cc1cccc([C@H](CC(=O)[O-])NCc2cscc2Cl)c1 ZINC000904045113 1048962354 /nfs/dbraw/zinc/96/23/54/1048962354.db2.gz HAXMYRKBOKZSET-AWEZNQCLSA-N -1 1 309.818 4.016 20 0 DIADMM CC(C)(CC(=O)Nc1cc(F)c([O-])cc1Cl)CC(F)F ZINC000885680378 1048972353 /nfs/dbraw/zinc/97/23/53/1048972353.db2.gz QDYUOTMWAIQCAG-UHFFFAOYSA-N -1 1 309.715 4.195 20 0 DIADMM Cc1cc(NC(=O)Nc2cc(F)cc(F)c2[O-])ccc1Cl ZINC001191770770 1048988042 /nfs/dbraw/zinc/98/80/42/1048988042.db2.gz PZVVTJQEPKUVDY-UHFFFAOYSA-N -1 1 312.703 4.276 20 0 DIADMM CCCCCCNC(=O)Nc1cc(Cl)c(Cl)cc1[O-] ZINC001191980378 1049028684 /nfs/dbraw/zinc/02/86/84/1049028684.db2.gz RFWFZYVLTRJGPX-UHFFFAOYSA-N -1 1 305.205 4.401 20 0 DIADMM Cc1ccc2c(c1)CCN2C(=O)c1cc2ccccc2cc1[O-] ZINC000773759026 1049064947 /nfs/dbraw/zinc/06/49/47/1049064947.db2.gz YMXLZTSSXWOFLE-UHFFFAOYSA-N -1 1 303.361 4.057 20 0 DIADMM Cc1[nH]c2c(cccc2NC(=O)c2cc([O-])cc(F)c2F)c1C ZINC001192671242 1049127476 /nfs/dbraw/zinc/12/74/76/1049127476.db2.gz YSATZSXPNIFAJS-UHFFFAOYSA-N -1 1 316.307 4.021 20 0 DIADMM CC(C)C[C@H](NC(=O)c1cc([O-])cc(F)c1F)c1ccccc1 ZINC001192678583 1049128268 /nfs/dbraw/zinc/12/82/68/1049128268.db2.gz HNCXYOPOQYKFEQ-INIZCTEOSA-N -1 1 319.351 4.188 20 0 DIADMM CC[C@@H](NC(=O)c1cc([O-])cc(F)c1F)c1ccc(C)cc1C ZINC001192683515 1049128613 /nfs/dbraw/zinc/12/86/13/1049128613.db2.gz FJXMZQMGNMEYSX-MRXNPFEDSA-N -1 1 319.351 4.168 20 0 DIADMM CC(C)c1ccc([C@@H](C)NC(=O)c2cc([O-])cc(F)c2F)cc1 ZINC001192684709 1049128946 /nfs/dbraw/zinc/12/89/46/1049128946.db2.gz UEIPPFBRYIDCND-LLVKDONJSA-N -1 1 319.351 4.285 20 0 DIADMM O=C(NC(C1CCCC1)C1CCCC1)c1c(F)ccc([O-])c1F ZINC000857452716 1049150691 /nfs/dbraw/zinc/15/06/91/1049150691.db2.gz LUEFLVQHRKFGBV-UHFFFAOYSA-N -1 1 323.383 4.149 20 0 DIADMM CCCc1ccc(CNc2ccc(-n3ccc(=O)[n-]3)cc2)s1 ZINC001179307776 1049153317 /nfs/dbraw/zinc/15/33/17/1049153317.db2.gz CEOLJPGLFVUURO-UHFFFAOYSA-N -1 1 313.426 4.204 20 0 DIADMM O=C(/C=C\Sc1ccccc1)Nc1cc(F)c([O-])cc1Cl ZINC001179660014 1049188413 /nfs/dbraw/zinc/18/84/13/1049188413.db2.gz KFINSSKCUIMHAF-SREVYHEPSA-N -1 1 323.776 4.429 20 0 DIADMM O=C(Nc1cccc(C(F)(F)F)c1[O-])OC1CCCCC1 ZINC001193635568 1049234819 /nfs/dbraw/zinc/23/48/19/1049234819.db2.gz XEQYFAIUFMHHFS-UHFFFAOYSA-N -1 1 303.280 4.292 20 0 DIADMM Cc1cccnc1[C@@H](NCc1csc(C(=O)[O-])c1)C(C)(C)C ZINC000905800752 1049253763 /nfs/dbraw/zinc/25/37/63/1049253763.db2.gz ZZVRGNYGLMWNQF-OAHLLOKOSA-N -1 1 318.442 4.027 20 0 DIADMM [O-]c1cc(Nc2cncc(Cl)c2Cl)c(F)c(F)c1F ZINC001249960486 1049312936 /nfs/dbraw/zinc/31/29/36/1049312936.db2.gz JZZRPOIAABXDAB-UHFFFAOYSA-N -1 1 309.074 4.255 20 0 DIADMM CC(C)(C)C[C@H](NCc1ccc([O-])c(F)c1F)C(F)(F)F ZINC001204999903 1049336157 /nfs/dbraw/zinc/33/61/57/1049336157.db2.gz GMPIHLZVONMZNE-JTQLQIEISA-N -1 1 311.294 4.127 20 0 DIADMM Cc1cccc(CC(=O)Nc2ccc([O-])c(Cl)c2)c1Cl ZINC000485788047 1049341757 /nfs/dbraw/zinc/34/17/57/1049341757.db2.gz UNCJGITXEYFEAG-UHFFFAOYSA-N -1 1 310.180 4.189 20 0 DIADMM Cc1cccc(C)c1S(=O)(=O)[N-]c1cc2cccccc-2c1 ZINC001194609618 1049394031 /nfs/dbraw/zinc/39/40/31/1049394031.db2.gz AYIJTKSSMDVWFH-UHFFFAOYSA-N -1 1 311.406 4.209 20 0 DIADMM CCC[C@](C)(NC(=O)c1c([O-])cccc1Cl)c1ccccc1 ZINC001180681203 1049398225 /nfs/dbraw/zinc/39/82/25/1049398225.db2.gz DVDAVKHAAZSJTO-SFHVURJKSA-N -1 1 317.816 4.491 20 0 DIADMM CCC(CC)COC(=O)Nc1ccc([O-])c(Br)c1 ZINC001194707113 1049418983 /nfs/dbraw/zinc/41/89/83/1049418983.db2.gz QYJPQUSARJCFPZ-UHFFFAOYSA-N -1 1 316.195 4.139 20 0 DIADMM Cc1cc(C)c(NC(=O)Nc2c(F)cc([O-])cc2F)c(C)c1 ZINC001181509789 1049486419 /nfs/dbraw/zinc/48/64/19/1049486419.db2.gz SWQYGJQXRGCZMV-UHFFFAOYSA-N -1 1 306.312 4.240 20 0 DIADMM Cc1cc(F)cc([N-]S(=O)(=O)c2cccc(C(C)C)c2)c1 ZINC001195156812 1049489002 /nfs/dbraw/zinc/48/90/02/1049489002.db2.gz SFEQOSIWCXJQGH-UHFFFAOYSA-N -1 1 307.390 4.058 20 0 DIADMM C=Cc1ccccc1[N-]S(=O)(=O)c1cccc(C(C)C)c1 ZINC001195158743 1049489234 /nfs/dbraw/zinc/48/92/34/1049489234.db2.gz GAEXEBIPOVAGIR-UHFFFAOYSA-N -1 1 301.411 4.254 20 0 DIADMM CC(C)c1cccc(S(=O)(=O)[N-]c2ccc(C3CC3)cc2)c1 ZINC001195159010 1049489575 /nfs/dbraw/zinc/48/95/75/1049489575.db2.gz KDEVXRJDKVAARJ-UHFFFAOYSA-N -1 1 315.438 4.488 20 0 DIADMM CC1=CC[C@@](C)(C(=O)Nc2cccc([O-])c2Br)CC1 ZINC000908710499 1049501103 /nfs/dbraw/zinc/50/11/03/1049501103.db2.gz KNVWAOXJBYZZSC-OAHLLOKOSA-N -1 1 324.218 4.230 20 0 DIADMM [O-]c1ccc(CNc2ccc(OC(F)F)cc2F)c(F)c1F ZINC001205527228 1049493135 /nfs/dbraw/zinc/49/31/35/1049493135.db2.gz SJJSGVRQPDRADB-UHFFFAOYSA-N -1 1 319.229 4.023 20 0 DIADMM CCC(CC)[C@H](C)C(=O)Nc1cccc([O-])c1Br ZINC000908709697 1049502137 /nfs/dbraw/zinc/50/21/37/1049502137.db2.gz RVSMEZOPLDWKQK-VIFPVBQESA-N -1 1 314.223 4.166 20 0 DIADMM O=C(Nc1cccc(C(F)(F)F)c1[O-])[C@H]1CCc2ccccc21 ZINC001181761804 1049514365 /nfs/dbraw/zinc/51/43/65/1049514365.db2.gz VATDEBFNLGYFMJ-LBPRGKRZSA-N -1 1 321.298 4.080 20 0 DIADMM CCOC(=O)NC(=S)[N-]c1ccc(C2CCCCC2)cc1 ZINC001195449174 1049528310 /nfs/dbraw/zinc/52/83/10/1049528310.db2.gz IUDAEWLLJXSMTO-UHFFFAOYSA-N -1 1 306.431 4.177 20 0 DIADMM O=c1cc(CSC2=Nc3ccccc3C2)c2ccc([O-])cc2o1 ZINC000119277014 1049533007 /nfs/dbraw/zinc/53/30/07/1049533007.db2.gz SARZJGUDANJMSZ-UHFFFAOYSA-N -1 1 323.373 4.018 20 0 DIADMM COC(=O)c1ccc(Nc2cc(Cl)c([O-])cc2F)cc1C ZINC001250022559 1049535221 /nfs/dbraw/zinc/53/52/21/1049535221.db2.gz MSCZJUBSDUJSKM-UHFFFAOYSA-N -1 1 309.724 4.023 20 0 DIADMM O=C(Nc1cccc(C(F)(F)F)c1[O-])[C@@H]1CC12CCCCC2 ZINC001181908124 1049545427 /nfs/dbraw/zinc/54/54/27/1049545427.db2.gz KKGBGJANXWHACD-NSHDSACASA-N -1 1 313.319 4.320 20 0 DIADMM Cc1ccc(F)cc1NC(=S)Nc1cccc([O-])c1Cl ZINC001195913779 1049589813 /nfs/dbraw/zinc/58/98/13/1049589813.db2.gz XYLYFELWWONFBZ-UHFFFAOYSA-N -1 1 310.781 4.302 20 0 DIADMM CCc1cc(=O)[n-]c(SC[C@H](OC(C)C)c2ccccc2)n1 ZINC000488269462 1049624895 /nfs/dbraw/zinc/62/48/95/1049624895.db2.gz YMUUKBCXBBDFRI-HNNXBMFYSA-N -1 1 318.442 4.003 20 0 DIADMM CCc1ccccc1S(=O)(=O)[N-]c1cccc(Cl)c1C ZINC000488298295 1049632331 /nfs/dbraw/zinc/63/23/31/1049632331.db2.gz PAYVBKPUPLMQHM-UHFFFAOYSA-N -1 1 309.818 4.012 20 0 DIADMM CCc1ccccc1S(=O)(=O)[N-]c1c(C)cccc1C(C)C ZINC000488411650 1049649528 /nfs/dbraw/zinc/64/95/28/1049649528.db2.gz JYFHYUHEWDBSOS-UHFFFAOYSA-N -1 1 317.454 4.482 20 0 DIADMM COC(=O)c1nc2cc(-c3ccc(SC)cc3C)ccc2[n-]1 ZINC001206091331 1049651720 /nfs/dbraw/zinc/65/17/20/1049651720.db2.gz VSBPXMAQCHDRML-UHFFFAOYSA-N -1 1 312.394 4.047 20 0 DIADMM COC(=O)c1nc2ccc(-c3ccc(SC)cc3C)cc2[n-]1 ZINC001206091331 1049651729 /nfs/dbraw/zinc/65/17/29/1049651729.db2.gz VSBPXMAQCHDRML-UHFFFAOYSA-N -1 1 312.394 4.047 20 0 DIADMM CC(C)=CC[C@@H](NCc1ccc(-c2ccc(C)cc2)o1)C(=O)[O-] ZINC000864526988 1049665630 /nfs/dbraw/zinc/66/56/30/1049665630.db2.gz ACHCTSCKSFMOKB-QGZVFWFLSA-N -1 1 313.397 4.154 20 0 DIADMM COc1cc(C)c(C)cc1NC(=O)Nc1ccc([O-])c(Cl)c1 ZINC001207593324 1049914169 /nfs/dbraw/zinc/91/41/69/1049914169.db2.gz OHAUNVGLLULYGI-UHFFFAOYSA-N -1 1 320.776 4.315 20 0 DIADMM O=S(=O)([N-]c1cccc(-c2ccsc2)c1)c1ccccc1 ZINC000588632780 1049988540 /nfs/dbraw/zinc/98/85/40/1049988540.db2.gz CRCSRNLHLOSLMZ-UHFFFAOYSA-N -1 1 315.419 4.216 20 0 DIADMM COc1c(F)ccc(Nc2c([O-])cc(F)cc2F)c1Cl ZINC001209803413 1050086559 /nfs/dbraw/zinc/08/65/59/1050086559.db2.gz XRUCAQHJGHMTBK-UHFFFAOYSA-N -1 1 303.667 4.215 20 0 DIADMM [O-]c1c(Cl)cc(Cl)cc1Nc1ccc(F)c(CO)c1 ZINC001209878334 1050098376 /nfs/dbraw/zinc/09/83/76/1050098376.db2.gz JXZDNGHSXYYQAN-UHFFFAOYSA-N -1 1 302.132 4.074 20 0 DIADMM [O-]c1c(Cl)nccc1Nc1cccc(OCC(F)(F)F)c1 ZINC001212167511 1050137935 /nfs/dbraw/zinc/13/79/35/1050137935.db2.gz YWRFRPLEAOHNEP-UHFFFAOYSA-N -1 1 318.682 4.125 20 0 DIADMM [O-]c1c(Cl)nccc1Nc1c(F)cccc1C(F)(F)F ZINC001210128071 1050140922 /nfs/dbraw/zinc/14/09/22/1050140922.db2.gz DIJYFADIZYPYPI-UHFFFAOYSA-N -1 1 306.646 4.342 20 0 DIADMM Cc1ccccc1[C@@H](NC(=O)c1cc(Cl)ccc1[O-])C1CC1 ZINC001136762859 1050147988 /nfs/dbraw/zinc/14/79/88/1050147988.db2.gz BHKYKGPQPOXRCQ-KRWDZBQOSA-N -1 1 315.800 4.235 20 0 DIADMM Cc1cccc(Nc2ccc(F)c(Br)c2[O-])c1O ZINC001210195042 1050153372 /nfs/dbraw/zinc/15/33/72/1050153372.db2.gz YMGVNWGYFUBJPF-UHFFFAOYSA-N -1 1 312.138 4.051 20 0 DIADMM [O-]c1cc(Nc2cccnc2C(F)(F)F)c(F)cc1Cl ZINC001210234671 1050172417 /nfs/dbraw/zinc/17/24/17/1050172417.db2.gz VKBVQFDRZVEJDZ-UHFFFAOYSA-N -1 1 306.646 4.342 20 0 DIADMM [O-]c1c(Cl)c(Cl)ccc1Nc1cnn(C(F)(F)F)c1 ZINC001210364700 1050217606 /nfs/dbraw/zinc/21/76/06/1050217606.db2.gz ILMPBBLFPHKPPL-UHFFFAOYSA-N -1 1 312.078 4.115 20 0 DIADMM [O-]c1ccc(Cl)c(Nc2cccc3c2OCCO3)c1Cl ZINC001210372752 1050219304 /nfs/dbraw/zinc/21/93/04/1050219304.db2.gz MXDQAANLSBTFFQ-UHFFFAOYSA-N -1 1 312.152 4.214 20 0 DIADMM [O-]c1c(Cl)c(Cl)ccc1Nc1cccc2c1OCCO2 ZINC001210372751 1050220008 /nfs/dbraw/zinc/22/00/08/1050220008.db2.gz MWLATIVIFANELQ-UHFFFAOYSA-N -1 1 312.152 4.214 20 0 DIADMM [O-]c1c(Cl)cc(Cl)cc1Nc1cc(F)c(CO)c(F)c1 ZINC001214034697 1050231529 /nfs/dbraw/zinc/23/15/29/1050231529.db2.gz CDCSBUUVFAGSAP-UHFFFAOYSA-N -1 1 320.122 4.213 20 0 DIADMM CCc1c(Cl)cc(Nc2c[nH]c(=O)c(F)c2)c([O-])c1Cl ZINC001210606809 1050310816 /nfs/dbraw/zinc/31/08/16/1050310816.db2.gz HSDDRVDWYMGUNF-UHFFFAOYSA-N -1 1 317.147 4.245 20 0 DIADMM CC=C(C)Nc1cc(Br)c([O-])c(Br)c1 ZINC001210794223 1050370024 /nfs/dbraw/zinc/37/00/24/1050370024.db2.gz FJQGQSGHPHHFSO-ZZXKWVIFSA-N -1 1 321.012 4.253 20 0 DIADMM CC(C)CC[C@H]1CCC[C@@H]1NC(=O)c1ccc(Cl)cc1[O-] ZINC001143640620 1050326030 /nfs/dbraw/zinc/32/60/30/1050326030.db2.gz BKPWUMYELCGDID-DOMZBBRYSA-N -1 1 309.837 4.380 20 0 DIADMM [O-]c1cc(Nc2ccccc2-n2cccn2)c(F)cc1Cl ZINC001210733742 1050353920 /nfs/dbraw/zinc/35/39/20/1050353920.db2.gz HFTXKAFUCRSNCM-UHFFFAOYSA-N -1 1 303.724 4.114 20 0 DIADMM O=c1oc2cc([O-])ccc2cc1Nc1cc(F)c(Cl)c(F)c1 ZINC001210842078 1050388385 /nfs/dbraw/zinc/38/83/85/1050388385.db2.gz GDUGIXHDVHLCMY-UHFFFAOYSA-N -1 1 323.682 4.174 20 0 DIADMM [O-]c1c(Cl)cc(Nc2cnc(C(F)(F)F)nc2)cc1Cl ZINC001210924930 1050416373 /nfs/dbraw/zinc/41/63/73/1050416373.db2.gz XXYVTMKSALYOQO-UHFFFAOYSA-N -1 1 324.089 4.251 20 0 DIADMM Nc1cc2c(ccn2-c2cc(Cl)c([O-])c(Cl)c2)c(F)c1 ZINC001210928778 1050418442 /nfs/dbraw/zinc/41/84/42/1050418442.db2.gz KXEXPZNWURSESS-UHFFFAOYSA-N -1 1 311.143 4.364 20 0 DIADMM COc1cc2c(ccn2-c2cc(Cl)c([O-])c(Cl)c2)c(N)c1 ZINC001210930032 1050419954 /nfs/dbraw/zinc/41/99/54/1050419954.db2.gz DOZWTSMGPLEPHS-UHFFFAOYSA-N -1 1 323.179 4.234 20 0 DIADMM COC(=O)c1ccc(Nc2cc([O-])c(Cl)cc2F)cc1C ZINC001211172832 1050505765 /nfs/dbraw/zinc/50/57/65/1050505765.db2.gz SKCQXCMRMMSWKG-UHFFFAOYSA-N -1 1 309.724 4.023 20 0 DIADMM CCCCOC(=O)c1cccc([N-]c2nnc(C(C)(C)C)o2)c1 ZINC001211280512 1050533284 /nfs/dbraw/zinc/53/32/84/1050533284.db2.gz PZEBFFDLBVLEEK-UHFFFAOYSA-N -1 1 317.389 4.068 20 0 DIADMM COc1ccc(-c2cncc(-c3cc(F)c([O-])cc3F)c2)cc1 ZINC001211349844 1050555461 /nfs/dbraw/zinc/55/54/61/1050555461.db2.gz IXWBFUOPMPWGFY-UHFFFAOYSA-N -1 1 313.303 4.408 20 0 DIADMM [O-]c1cc(F)c(CN2CCC[C@@H]2c2ccc(F)cc2)c(F)c1 ZINC001144541630 1050611529 /nfs/dbraw/zinc/61/15/29/1050611529.db2.gz IEXLGTMVEUIJJG-QGZVFWFLSA-N -1 1 307.315 4.147 20 0 DIADMM [O-]c1cc(F)c(CN2CCC[C@H]2c2cccc(F)c2)c(F)c1 ZINC001144554633 1050612393 /nfs/dbraw/zinc/61/23/93/1050612393.db2.gz CUGFCMDJLPAPIS-KRWDZBQOSA-N -1 1 307.315 4.147 20 0 DIADMM COc1ccc([C@@H]2CCCN2Cc2c(F)cc([O-])cc2F)cc1 ZINC001144555176 1050615683 /nfs/dbraw/zinc/61/56/83/1050615683.db2.gz YKFZGKCXRISPLS-SFHVURJKSA-N -1 1 319.351 4.016 20 0 DIADMM Cc1nsc([N-]c2cc(OCc3ccccc3)ccc2F)n1 ZINC001213272252 1050619899 /nfs/dbraw/zinc/61/98/99/1050619899.db2.gz CLNKPTTZHLGFEI-UHFFFAOYSA-N -1 1 315.373 4.308 20 0 DIADMM COc1cc(Nc2cc(F)c([O-])c(F)c2)c(OC)cc1Cl ZINC001213379186 1050642620 /nfs/dbraw/zinc/64/26/20/1050642620.db2.gz CVUPSTPGYDBEKJ-UHFFFAOYSA-N -1 1 315.703 4.085 20 0 DIADMM [O-]c1c(F)cc(Nc2cc(Br)ccc2F)cc1F ZINC001213379223 1050644895 /nfs/dbraw/zinc/64/48/95/1050644895.db2.gz GTBJYBZLRDRBFA-UHFFFAOYSA-N -1 1 318.092 4.316 20 0 DIADMM COc1ccccc1[C@@H]1CCCN1Cc1cc(F)c([O-])cc1F ZINC001144667073 1050645441 /nfs/dbraw/zinc/64/54/41/1050645441.db2.gz RDJIUHIHZLAKKB-INIZCTEOSA-N -1 1 319.351 4.016 20 0 DIADMM O=C([O-])c1ccsc1CN1CCC[C@@H]1c1ccc(F)cc1F ZINC001144680433 1050652812 /nfs/dbraw/zinc/65/28/12/1050652812.db2.gz NMTYGRPHOKJSMF-CQSZACIVSA-N -1 1 323.364 4.062 20 0 DIADMM [O-]c1cnc(Cl)c(-c2nc(-c3ccc4ccccc4c3)no2)c1 ZINC001213697873 1050721341 /nfs/dbraw/zinc/72/13/41/1050721341.db2.gz IBJJOUMPXNKFLS-UHFFFAOYSA-N -1 1 323.739 4.311 20 0 DIADMM O=c1ccc2cc(Nc3cc(Cl)c([O-])cc3Cl)ccc2[nH]1 ZINC001213777011 1050738016 /nfs/dbraw/zinc/73/80/16/1050738016.db2.gz FYNZQZSIMITWDB-UHFFFAOYSA-N -1 1 321.163 4.284 20 0 DIADMM COc1cccc(Nc2cc3ccc([O-])cc3oc2=O)c1C1CC1 ZINC001213802933 1050747076 /nfs/dbraw/zinc/74/70/76/1050747076.db2.gz JNPUFOIYGFIXOY-UHFFFAOYSA-N -1 1 323.348 4.128 20 0 DIADMM [O-]c1c(F)c(F)ccc1Nc1ccc(N2CCCC2)cc1F ZINC001213853242 1050766326 /nfs/dbraw/zinc/76/63/26/1050766326.db2.gz HYWMJZLAVVFYGL-UHFFFAOYSA-N -1 1 308.303 4.153 20 0 DIADMM O=c1oc2cc([O-])ccc2cc1Nc1c(Cl)ccc(F)c1F ZINC001213945689 1050788358 /nfs/dbraw/zinc/78/83/58/1050788358.db2.gz OBBFDOXLYWMSDU-UHFFFAOYSA-N -1 1 323.682 4.174 20 0 DIADMM [O-]c1ccc(Cl)c(Nc2cc(F)c(CO)c(F)c2)c1Cl ZINC001214035205 1050801453 /nfs/dbraw/zinc/80/14/53/1050801453.db2.gz YRPDLXUEPLHIDK-UHFFFAOYSA-N -1 1 320.122 4.213 20 0 DIADMM COc1cc(F)c(Nc2cc([O-])c(F)c(F)c2)cc1Cl ZINC001214067743 1050809900 /nfs/dbraw/zinc/80/99/00/1050809900.db2.gz OXGBSEGMEJGBAB-UHFFFAOYSA-N -1 1 303.667 4.215 20 0 DIADMM Cc1cccc([C@@H](C)NC(=O)Cc2ccc([O-])c(Cl)c2)c1C ZINC001146225231 1050819487 /nfs/dbraw/zinc/81/94/87/1050819487.db2.gz AASXNRUBXPNTNB-CYBMUJFWSA-N -1 1 317.816 4.082 20 0 DIADMM Cc1ccc(C[C@H](C)NC(=O)c2cc(Cl)ccc2[O-])c(C)c1 ZINC001146459560 1050824717 /nfs/dbraw/zinc/82/47/17/1050824717.db2.gz USDGAKOXABGPMA-ZDUSSCGKSA-N -1 1 317.816 4.023 20 0 DIADMM COCOc1ccc(C)cc1Nc1cc([O-])c(Cl)cc1F ZINC001214243659 1050853279 /nfs/dbraw/zinc/85/32/79/1050853279.db2.gz HCAIFHFQMHWVGY-UHFFFAOYSA-N -1 1 311.740 4.219 20 0 DIADMM Cc1ccc([C@@H](C)CNC(=O)c2ccc3ccccc3c2[O-])cc1 ZINC001147211549 1050868013 /nfs/dbraw/zinc/86/80/13/1050868013.db2.gz WUPXPLLTAWPFCC-HNNXBMFYSA-N -1 1 319.404 4.387 20 0 DIADMM CC(C)c1cc(-n2[n-]c(=O)c3ccc(N)cc32)ccc1Cl ZINC001214319166 1050868704 /nfs/dbraw/zinc/86/87/04/1050868704.db2.gz VFLQSGLBVLBINY-UHFFFAOYSA-N -1 1 301.777 4.090 20 0 DIADMM [O-]c1cc(Nc2cc(OC(F)(F)F)ccc2O)cc(F)c1F ZINC001214382340 1050888674 /nfs/dbraw/zinc/88/86/74/1050888674.db2.gz MHXRHHPUQPXFML-UHFFFAOYSA-N -1 1 321.201 4.018 20 0 DIADMM [O-]c1cc(F)c(Nc2ccc(OC(F)(F)F)cc2O)cc1F ZINC001214395754 1050891795 /nfs/dbraw/zinc/89/17/95/1050891795.db2.gz YRNDQDPYYWHGCZ-UHFFFAOYSA-N -1 1 321.201 4.018 20 0 DIADMM [O-]c1c(F)cc(Nc2cc(Cl)cc(CO)c2)cc1Cl ZINC001214489738 1050922563 /nfs/dbraw/zinc/92/25/63/1050922563.db2.gz JDLOOPGVRWROCL-UHFFFAOYSA-N -1 1 302.132 4.074 20 0 DIADMM [O-]c1c(F)cc(Nc2ccc(C(F)(F)F)cn2)cc1Cl ZINC001214477528 1050917060 /nfs/dbraw/zinc/91/70/60/1050917060.db2.gz UIUAJSHSXHDYLW-UHFFFAOYSA-N -1 1 306.646 4.342 20 0 DIADMM Nc1cc(Cl)nc(Cl)c1Nc1cc(F)c([O-])c(Cl)c1 ZINC001214482912 1050917153 /nfs/dbraw/zinc/91/71/53/1050917153.db2.gz UZOBZGNTPKBRJS-UHFFFAOYSA-N -1 1 322.554 4.212 20 0 DIADMM [O-]c1c(F)cc(Nc2ccc(C(F)(F)F)nc2)cc1Cl ZINC001214480531 1050918123 /nfs/dbraw/zinc/91/81/23/1050918123.db2.gz USFDFVGSAOPDHK-UHFFFAOYSA-N -1 1 306.646 4.342 20 0 DIADMM COc1ccc2ncc(Nc3cc(F)c([O-])c(Cl)c3)cc2c1 ZINC001214482755 1050918984 /nfs/dbraw/zinc/91/89/84/1050918984.db2.gz MBLNAEUYZARMJK-UHFFFAOYSA-N -1 1 318.735 4.485 20 0 DIADMM COc1nc(Nc2cc(F)c([O-])c(Cl)c2)cc2ccccc21 ZINC001214486737 1050919394 /nfs/dbraw/zinc/91/93/94/1050919394.db2.gz XGGBKASFIBTKFA-UHFFFAOYSA-N -1 1 318.735 4.485 20 0 DIADMM [O-]c1c(F)cc(Nc2cncc(N3CCCCC3)c2)cc1Cl ZINC001214484823 1050920200 /nfs/dbraw/zinc/92/02/00/1050920200.db2.gz PTLNVFFAWHPUQG-UHFFFAOYSA-N -1 1 321.783 4.314 20 0 DIADMM [O-]c1c(F)cc(Nc2cnnc(Cl)c2Cl)cc1Cl ZINC001214484665 1050920548 /nfs/dbraw/zinc/92/05/48/1050920548.db2.gz OXJNMBDEHVUIQU-UHFFFAOYSA-N -1 1 308.527 4.025 20 0 DIADMM Cc1cc2c(cccc2Nc2cc(F)c([O-])c(Cl)c2)nn1 ZINC001214488828 1050920898 /nfs/dbraw/zinc/92/08/98/1050920898.db2.gz MSSKUPCCZRCOEZ-UHFFFAOYSA-N -1 1 303.724 4.180 20 0 DIADMM O=C1CCCc2cc(Nc3cc(F)c([O-])c(Cl)c3)ccc2N1 ZINC001214492226 1050922325 /nfs/dbraw/zinc/92/23/25/1050922325.db2.gz UNXXHSLUQVZLIV-UHFFFAOYSA-N -1 1 320.751 4.203 20 0 DIADMM COC(=O)c1cc(C)cc(Nc2cc(F)c([O-])c(Cl)c2)c1 ZINC001214491546 1050922875 /nfs/dbraw/zinc/92/28/75/1050922875.db2.gz BDIDELGFRGHHRS-UHFFFAOYSA-N -1 1 309.724 4.023 20 0 DIADMM CO[C@H]1CCOc2c(Nc3cc(F)c([O-])c(Cl)c3)cccc21 ZINC001214492117 1050922945 /nfs/dbraw/zinc/92/29/45/1050922945.db2.gz QUEXWMSJQGZNLP-AWEZNQCLSA-N -1 1 323.751 4.398 20 0 DIADMM COc1ccc(C(C)=O)c(Nc2cc(F)c([O-])c(Cl)c2)c1C ZINC001214489371 1050923049 /nfs/dbraw/zinc/92/30/49/1050923049.db2.gz BPTLZKWKRBFHDK-UHFFFAOYSA-N -1 1 323.751 4.448 20 0 DIADMM COc1ccc(Nc2cc(F)c([O-])c(Cl)c2)c(C(C)=O)c1 ZINC001214493931 1050924503 /nfs/dbraw/zinc/92/45/03/1050924503.db2.gz CRLYONAYWMESKC-UHFFFAOYSA-N -1 1 309.724 4.140 20 0 DIADMM CCc1ncoc1C(=O)Nc1cc(Cl)c([O-])c2ccccc12 ZINC001148252626 1050928525 /nfs/dbraw/zinc/92/85/25/1050928525.db2.gz MTONFRCAQYKFKV-UHFFFAOYSA-N -1 1 316.744 4.002 20 0 DIADMM Cc1nc(Cl)ccc1NC(=O)c1cc2ccccc2cc1[O-] ZINC000790251638 1050933131 /nfs/dbraw/zinc/93/31/31/1050933131.db2.gz BUMLWPQWDPQMOH-UHFFFAOYSA-N -1 1 312.756 4.155 20 0 DIADMM O=C1CCCc2cccc(Nc3c(Cl)ccc([O-])c3F)c21 ZINC001214564444 1050947337 /nfs/dbraw/zinc/94/73/37/1050947337.db2.gz CJBCAEGPEXNDCE-UHFFFAOYSA-N -1 1 305.736 4.447 20 0 DIADMM Cc1cc(F)ncc1NC(=O)c1cccc(-c2ccccc2)c1[O-] ZINC001148861095 1050980907 /nfs/dbraw/zinc/98/09/07/1050980907.db2.gz KXQBZDJJWMJXSU-UHFFFAOYSA-N -1 1 322.339 4.154 20 0 DIADMM COc1ccc(F)c(Nc2cc([O-])c(Cl)cc2F)c1OC ZINC001214697692 1050981526 /nfs/dbraw/zinc/98/15/26/1050981526.db2.gz OIYWOHYMENKQLQ-UHFFFAOYSA-N -1 1 315.703 4.085 20 0 DIADMM COc1ccc(-c2nc(-c3cc(C)cc(Cl)c3)no2)c([O-])c1 ZINC001215150127 1051091223 /nfs/dbraw/zinc/09/12/23/1051091223.db2.gz UZJPNKSKRBSZQK-UHFFFAOYSA-N -1 1 316.744 4.080 20 0 DIADMM CC(C)Oc1ccc(F)c(Nc2cc([O-])c(F)c(F)c2)c1F ZINC001215176109 1051102959 /nfs/dbraw/zinc/10/29/59/1051102959.db2.gz CMLPGNIDODHCRD-UHFFFAOYSA-N -1 1 315.266 4.479 20 0 DIADMM CC(C)Oc1ccc(F)c(Nc2ccc(F)c(F)c2[O-])c1F ZINC001215178737 1051105029 /nfs/dbraw/zinc/10/50/29/1051105029.db2.gz RERZFHVWJNLOLX-UHFFFAOYSA-N -1 1 315.266 4.479 20 0 DIADMM O=C([N-]OCC(F)(F)F)C1(C2CCCCC2)CCCCC1 ZINC000792236408 1051129152 /nfs/dbraw/zinc/12/91/52/1051129152.db2.gz LVASPNBPPZDAOH-UHFFFAOYSA-N -1 1 307.356 4.127 20 0 DIADMM Cc1ccc(-c2noc(-c3ccc(O)cc3[O-])n2)c2ccccc12 ZINC001215299937 1051158409 /nfs/dbraw/zinc/15/84/09/1051158409.db2.gz IQJRNWLOVUVVHS-UHFFFAOYSA-N -1 1 318.332 4.276 20 0 DIADMM [O-]c1ccc(-c2nc(-c3cccc(Cl)c3)no2)c(Cl)c1 ZINC001215343039 1051171821 /nfs/dbraw/zinc/17/18/21/1051171821.db2.gz KSGSMKSLFWFWNN-UHFFFAOYSA-N -1 1 307.136 4.416 20 0 DIADMM [O-]c1ccc(-c2nc(-c3ncccc3C3CC3)no2)c(Cl)c1 ZINC001215345745 1051172320 /nfs/dbraw/zinc/17/23/20/1051172320.db2.gz IDCHCHWBBIOLCZ-UHFFFAOYSA-N -1 1 313.744 4.035 20 0 DIADMM [O-]c1ccc(-c2nc(-c3cccc(F)c3F)no2)c(Cl)c1 ZINC001215343220 1051172479 /nfs/dbraw/zinc/17/24/79/1051172479.db2.gz PCVBUXXBZVAVRQ-UHFFFAOYSA-N -1 1 308.671 4.041 20 0 DIADMM [O-]c1ccc(-c2nc(-c3cccc4cnccc43)no2)c(Cl)c1 ZINC001215343532 1051172631 /nfs/dbraw/zinc/17/26/31/1051172631.db2.gz XSHOERYHFGVOTE-UHFFFAOYSA-N -1 1 323.739 4.311 20 0 DIADMM Cc1cc(F)c(-c2noc(-c3ccc([O-])cc3Cl)n2)cc1F ZINC001215345852 1051172660 /nfs/dbraw/zinc/17/26/60/1051172660.db2.gz NUBGOZWHOAFJIE-UHFFFAOYSA-N -1 1 322.698 4.349 20 0 DIADMM Cc1cc(-c2noc(-c3ccc([O-])cc3Cl)n2)c(F)cc1F ZINC001215345646 1051172867 /nfs/dbraw/zinc/17/28/67/1051172867.db2.gz BQERFNDUIBWPMJ-UHFFFAOYSA-N -1 1 322.698 4.349 20 0 DIADMM CCc1ccc(-c2noc(-c3ccc([O-])cc3Cl)n2)cc1 ZINC001215345647 1051173127 /nfs/dbraw/zinc/17/31/27/1051173127.db2.gz BQFVDWIGWXBYKC-UHFFFAOYSA-N -1 1 300.745 4.325 20 0 DIADMM Cc1ccc(F)c(-c2noc(-c3ccc([O-])cc3Cl)n2)c1 ZINC001215343069 1051173238 /nfs/dbraw/zinc/17/32/38/1051173238.db2.gz LSAGYXBLIFFHBD-UHFFFAOYSA-N -1 1 304.708 4.210 20 0 DIADMM CC[C@@H](NC(=O)c1ccc([O-])c(F)c1)c1cc(C)ccc1C ZINC001171637542 1051194151 /nfs/dbraw/zinc/19/41/51/1051194151.db2.gz NIWLRLKJGKSCAY-MRXNPFEDSA-N -1 1 301.361 4.029 20 0 DIADMM CC(C)Oc1c(Nc2c([O-])cc(F)cc2F)ccc(F)c1F ZINC001215425123 1051201004 /nfs/dbraw/zinc/20/10/04/1051201004.db2.gz UROCBICPRIZSHN-UHFFFAOYSA-N -1 1 315.266 4.479 20 0 DIADMM Nc1ccc(Nc2cc(F)c([O-])cc2F)c(C(F)(F)F)c1 ZINC001215572070 1051250895 /nfs/dbraw/zinc/25/08/95/1051250895.db2.gz VXGHXMKNOKMZBC-UHFFFAOYSA-N -1 1 304.218 4.015 20 0 DIADMM [O-]c1cc(F)c(Nc2cc(OC(F)(F)F)ccc2F)cc1F ZINC001215571395 1051252645 /nfs/dbraw/zinc/25/26/45/1051252645.db2.gz BWTYXHISCOSIOX-UHFFFAOYSA-N -1 1 323.192 4.452 20 0 DIADMM [O-]c1cc(F)c(Nc2ccc3ncnc(Cl)c3c2)cc1F ZINC001215577241 1051254691 /nfs/dbraw/zinc/25/46/91/1051254691.db2.gz VWLKVVJPSRSGPF-UHFFFAOYSA-N -1 1 307.687 4.011 20 0 DIADMM Cc1c(F)ccc(-c2noc(-c3cc(F)ccc3[O-])n2)c1Cl ZINC001215769985 1051358029 /nfs/dbraw/zinc/35/80/29/1051358029.db2.gz YWAKRNUNGBJEOV-UHFFFAOYSA-N -1 1 322.698 4.349 20 0 DIADMM Cc1cc2ccccc2nc1-c1noc(-c2cc(F)ccc2[O-])n1 ZINC001215769787 1051358313 /nfs/dbraw/zinc/35/83/13/1051358313.db2.gz RVSBBCDVQMLUFU-UHFFFAOYSA-N -1 1 321.311 4.105 20 0 DIADMM CC(F)(F)c1ccc(C(=O)Nc2ccc([O-])c(Cl)c2)cc1 ZINC000794246463 1051363460 /nfs/dbraw/zinc/36/34/60/1051363460.db2.gz KSWQKZPRJBPEPU-UHFFFAOYSA-N -1 1 311.715 4.410 20 0 DIADMM CCOc1cc([N-]c2nnc(-c3ccco3)o2)ccc1Cl ZINC001212578037 1051388120 /nfs/dbraw/zinc/38/81/20/1051388120.db2.gz JAHYPCXKVIFGQO-UHFFFAOYSA-N -1 1 305.721 4.125 20 0 DIADMM [O-]c1ccc(-c2nc(-c3cc(F)cc(Cl)c3)no2)c(F)c1 ZINC001215826076 1051391046 /nfs/dbraw/zinc/39/10/46/1051391046.db2.gz FPFSGIFWKOWTAQ-UHFFFAOYSA-N -1 1 308.671 4.041 20 0 DIADMM CCCOc1ccc(-c2noc(-c3ccc([O-])cc3F)n2)cc1 ZINC001215826110 1051391084 /nfs/dbraw/zinc/39/10/84/1051391084.db2.gz GLEKVWJBCTULBM-UHFFFAOYSA-N -1 1 314.316 4.037 20 0 DIADMM Cc1ccc(-c2noc(-c3ccc(F)c([O-])c3)n2)c(Cl)c1 ZINC001215842533 1051407006 /nfs/dbraw/zinc/40/70/06/1051407006.db2.gz MVSYPZIHYIHEMV-UHFFFAOYSA-N -1 1 304.708 4.210 20 0 DIADMM CSc1ncc(Cl)cc1Nc1ccc(F)c(F)c1[O-] ZINC001215916902 1051454866 /nfs/dbraw/zinc/45/48/66/1051454866.db2.gz JZTLJLZOXPJOFX-UHFFFAOYSA-N -1 1 302.733 4.184 20 0 DIADMM Cc1cc(-c2noc(-c3cccc([O-])c3F)n2)ccc1Cl ZINC001215984448 1051501665 /nfs/dbraw/zinc/50/16/65/1051501665.db2.gz RJKZBNSPQGEJOH-UHFFFAOYSA-N -1 1 304.708 4.210 20 0 DIADMM [O-]c1cccc(-c2nc(-c3cccc4ccccc43)no2)c1F ZINC001215988848 1051504971 /nfs/dbraw/zinc/50/49/71/1051504971.db2.gz JBBOKWRGFLGAGC-UHFFFAOYSA-N -1 1 306.296 4.402 20 0 DIADMM Cc1cc(Cl)cc(-c2noc(-c3cccc([O-])c3F)n2)c1 ZINC001215988622 1051505554 /nfs/dbraw/zinc/50/55/54/1051505554.db2.gz AXXXAWHQCTWKPY-UHFFFAOYSA-N -1 1 304.708 4.210 20 0 DIADMM Cc1cc(-c2ccccc2)ccc1-n1[n-]c(=O)c2ccc(N)cc21 ZINC001216196879 1051626021 /nfs/dbraw/zinc/62/60/21/1051626021.db2.gz KTYFGFOZOUYZQT-UHFFFAOYSA-N -1 1 315.376 4.289 20 0 DIADMM Cc1cc(-c2ccccc2)ccc1-n1[n-]c(=O)c2cc(N)ccc21 ZINC001216197521 1051626662 /nfs/dbraw/zinc/62/66/62/1051626662.db2.gz YCQQATHZJJUCCH-UHFFFAOYSA-N -1 1 315.376 4.289 20 0 DIADMM COc1cc(Nc2ccc(Cl)c([O-])c2)c(C(C)=O)cc1OC ZINC001212591482 1051645943 /nfs/dbraw/zinc/64/59/43/1051645943.db2.gz OUMGLWPMNAJOPV-UHFFFAOYSA-N -1 1 321.760 4.009 20 0 DIADMM Cc1cc(-c2noc(-c3cc([O-])cc(F)c3)n2)cc(C)c1F ZINC001216340097 1051708124 /nfs/dbraw/zinc/70/81/24/1051708124.db2.gz SBIOHVOHEYJQSR-UHFFFAOYSA-N -1 1 302.280 4.004 20 0 DIADMM COc1c(O)cccc1Nc1ccc(Cl)c(Cl)c1[O-] ZINC001216351545 1051713632 /nfs/dbraw/zinc/71/36/32/1051713632.db2.gz URJIUTFVRYPTBB-UHFFFAOYSA-N -1 1 300.141 4.157 20 0 DIADMM COc1c(O)cccc1Nc1cc(Cl)c(C)c(Cl)c1[O-] ZINC001216350883 1051714852 /nfs/dbraw/zinc/71/48/52/1051714852.db2.gz FYEZUQSDIBCQRF-UHFFFAOYSA-N -1 1 314.168 4.465 20 0 DIADMM COc1c(O)cccc1Nc1c(Cl)ccc([O-])c1Cl ZINC001216352113 1051716638 /nfs/dbraw/zinc/71/66/38/1051716638.db2.gz JQIPOKNBRKPLFZ-UHFFFAOYSA-N -1 1 300.141 4.157 20 0 DIADMM O=C([O-])c1cc(Nc2ccc3nccn3c2)c(Cl)cc1Cl ZINC001216358515 1051718786 /nfs/dbraw/zinc/71/87/86/1051718786.db2.gz UENPELOMMBGOGU-UHFFFAOYSA-N -1 1 322.151 4.083 20 0 DIADMM COc1c(Nc2ccc(F)c(F)c2[O-])cccc1C(F)(F)F ZINC001216637318 1051844621 /nfs/dbraw/zinc/84/46/21/1051844621.db2.gz ROUBCIKYNOVGLX-UHFFFAOYSA-N -1 1 319.229 4.441 20 0 DIADMM CC(=O)Nc1cccc(Nc2cc(Cl)cc(Cl)c2[O-])c1 ZINC001173833696 1051851653 /nfs/dbraw/zinc/85/16/53/1051851653.db2.gz PQKPWEUNHMIVKO-UHFFFAOYSA-N -1 1 311.168 4.401 20 0 DIADMM CC(=O)Nc1cccc(Nc2c(Cl)ccc([O-])c2Cl)c1 ZINC001173834037 1051851806 /nfs/dbraw/zinc/85/18/06/1051851806.db2.gz VEBXPGSEOAYYHY-UHFFFAOYSA-N -1 1 311.168 4.401 20 0 DIADMM CCC[C@H](C)c1cc([N-]c2ccn(C(=O)OC(C)(C)C)n2)on1 ZINC001216670925 1051858729 /nfs/dbraw/zinc/85/87/29/1051858729.db2.gz HBSBQGCZBVIFNS-NSHDSACASA-N -1 1 320.393 4.302 20 0 DIADMM CCCCc1ccc(-c2noc(-c3ccc(OC)cc3[O-])n2)cc1 ZINC001216740867 1051870570 /nfs/dbraw/zinc/87/05/70/1051870570.db2.gz USXSLGGNNJNBRC-UHFFFAOYSA-N -1 1 324.380 4.460 20 0 DIADMM COc1ccc(OC)c(Nc2cc(Cl)cc(Cl)c2[O-])c1 ZINC001173919720 1051878584 /nfs/dbraw/zinc/87/85/84/1051878584.db2.gz LODBNZRIAAGKEM-UHFFFAOYSA-N -1 1 314.168 4.460 20 0 DIADMM Cc1ccc(Cl)cc1-c1noc(-c2cc([O-])cc(F)c2F)n1 ZINC001216924110 1051911016 /nfs/dbraw/zinc/91/10/16/1051911016.db2.gz ZTIUCWJMQCSSHR-UHFFFAOYSA-N -1 1 322.698 4.349 20 0 DIADMM Cc1cc(Cl)ccc1-c1noc(-c2cc([O-])cc(F)c2F)n1 ZINC001216922601 1051911520 /nfs/dbraw/zinc/91/15/20/1051911520.db2.gz CNULCAYZQDZZDU-UHFFFAOYSA-N -1 1 322.698 4.349 20 0 DIADMM [O-]c1cc(F)c(F)c(-c2nc(-c3cccc4occc43)no2)c1 ZINC001216924890 1051911833 /nfs/dbraw/zinc/91/18/33/1051911833.db2.gz XJVHEHAKXJSOTL-UHFFFAOYSA-N -1 1 314.247 4.134 20 0 DIADMM C[C@H](Sc1nc(C2CC2)cc(=O)[n-]1)c1nc2ccccc2o1 ZINC000189440029 1051914270 /nfs/dbraw/zinc/91/42/70/1051914270.db2.gz OAOVCTGOLSRRTF-VIFPVBQESA-N -1 1 313.382 4.054 20 0 DIADMM Cc1ccc(-c2noc(-c3c(C)cc(O)cc3[O-])n2)c(Cl)c1 ZINC001216987525 1051927563 /nfs/dbraw/zinc/92/75/63/1051927563.db2.gz VPIVSINQKNROQD-UHFFFAOYSA-N -1 1 316.744 4.085 20 0 DIADMM Cc1cc(O)cc([O-])c1-c1nc(-c2ccc(C(C)C)cc2)no1 ZINC001216987574 1051927853 /nfs/dbraw/zinc/92/78/53/1051927853.db2.gz XZUANKKMSWOMEI-UHFFFAOYSA-N -1 1 310.353 4.247 20 0 DIADMM CC(=O)Nc1ccc(Nc2ccc(Cl)c(Cl)c2[O-])cc1 ZINC001173977987 1051939926 /nfs/dbraw/zinc/93/99/26/1051939926.db2.gz XXEQDGFFECVNOH-UHFFFAOYSA-N -1 1 311.168 4.401 20 0 DIADMM Cc1nc2cc(NC(=O)Nc3ccc([O-])c(Cl)c3)ccc2o1 ZINC000190979134 1051957309 /nfs/dbraw/zinc/95/73/09/1051957309.db2.gz NQDCJLHYOVOWMY-UHFFFAOYSA-N -1 1 317.732 4.139 20 0 DIADMM Cc1cccc(-c2noc(-c3ccc4cccnc4c3[O-])n2)c1F ZINC001217142281 1051976651 /nfs/dbraw/zinc/97/66/51/1051976651.db2.gz ZBOANAXCRATQLB-UHFFFAOYSA-N -1 1 321.311 4.105 20 0 DIADMM Cc1cc(F)cc(-c2noc(-c3ccc4cccnc4c3[O-])n2)c1 ZINC001217141939 1051976685 /nfs/dbraw/zinc/97/66/85/1051976685.db2.gz ORXKPRLQPLUBPF-UHFFFAOYSA-N -1 1 321.311 4.105 20 0 DIADMM [O-]c1cc2c(O)cccc2cc1-c1nc(-c2ccc(F)cc2)no1 ZINC001217159122 1051984858 /nfs/dbraw/zinc/98/48/58/1051984858.db2.gz NMYCBIFIXYZRDL-UHFFFAOYSA-N -1 1 322.295 4.107 20 0 DIADMM [O-]c1cc(Nc2cnn(Cc3ccccc3)c2)c(F)cc1Cl ZINC001174133383 1052010939 /nfs/dbraw/zinc/01/09/39/1052010939.db2.gz MUFRUGYSRPDFCC-UHFFFAOYSA-N -1 1 317.751 4.173 20 0 DIADMM CCCn1cc(Nc2cc(Cl)c(C)c(Cl)c2[O-])cn1 ZINC001174220661 1052058468 /nfs/dbraw/zinc/05/84/68/1052058468.db2.gz DGKFIGLHEAJMGX-UHFFFAOYSA-N -1 1 300.189 4.358 20 0 DIADMM CCc1c(Cl)cc(Nc2c(C)nn(C)c2C)c([O-])c1Cl ZINC001174229217 1052064681 /nfs/dbraw/zinc/06/46/81/1052064681.db2.gz URJXWPNZAGFNMC-UHFFFAOYSA-N -1 1 314.216 4.355 20 0 DIADMM Cc1cnccc1-c1noc(-c2ccc3sccc3c2[O-])n1 ZINC001217513926 1052078605 /nfs/dbraw/zinc/07/86/05/1052078605.db2.gz GOLRFCVWIPPRSO-UHFFFAOYSA-N -1 1 309.350 4.027 20 0 DIADMM [O-]c1cc(F)cc(F)c1Nc1cccc(N2CCCCC2)c1 ZINC001174303333 1052080699 /nfs/dbraw/zinc/08/06/99/1052080699.db2.gz UJLXOKUVAPHNJT-UHFFFAOYSA-N -1 1 304.340 4.404 20 0 DIADMM O=C(c1c([O-])cccc1Cl)N1CCC[C@@H]1c1cccs1 ZINC000769616769 1052089372 /nfs/dbraw/zinc/08/93/72/1052089372.db2.gz XQJOOHBNQQPXNL-LLVKDONJSA-N -1 1 307.802 4.084 20 0 DIADMM O=C(c1c([O-])cccc1Cl)N1CCC[C@H]1c1ccsc1 ZINC000769689084 1052090865 /nfs/dbraw/zinc/09/08/65/1052090865.db2.gz IUMVZKNCRRJAKS-LBPRGKRZSA-N -1 1 307.802 4.084 20 0 DIADMM CC(C)N(Cc1cccs1)C(=O)c1c([O-])cccc1Cl ZINC000769732513 1052093016 /nfs/dbraw/zinc/09/30/16/1052093016.db2.gz QQWOTFFGRXHXBM-UHFFFAOYSA-N -1 1 309.818 4.158 20 0 DIADMM C[C@@H]1CCN(C(=O)c2c([O-])cccc2Cl)[C@H]2CCCC[C@@H]12 ZINC000769690945 1052093740 /nfs/dbraw/zinc/09/37/40/1052093740.db2.gz ZXHZQBKQHWTJNY-DYEKYZERSA-N -1 1 307.821 4.086 20 0 DIADMM Cn1ncc2ccc(Nc3c(Cl)ccc([O-])c3Cl)cc21 ZINC001174340950 1052108716 /nfs/dbraw/zinc/10/87/16/1052108716.db2.gz MKMZMIOMXLCHID-UHFFFAOYSA-N -1 1 308.168 4.329 20 0 DIADMM O=C(c1c([O-])cccc1Cl)N1CC[C@@H]1c1ccc(Cl)cc1 ZINC000769913105 1052120843 /nfs/dbraw/zinc/12/08/43/1052120843.db2.gz ABCMTTRCTKHASX-CYBMUJFWSA-N -1 1 322.191 4.286 20 0 DIADMM CCc1c(Cl)cc(Nc2ccc3ncnn3c2)c([O-])c1Cl ZINC001174375684 1052135850 /nfs/dbraw/zinc/13/58/50/1052135850.db2.gz LWIWWOAXKYCZHE-UHFFFAOYSA-N -1 1 323.183 4.048 20 0 DIADMM Cc1c(Cl)cc(Nc2ccc(N)cc2F)c([O-])c1Cl ZINC001174483725 1052168826 /nfs/dbraw/zinc/16/88/26/1052168826.db2.gz WMVSVNHOWHLHJK-UHFFFAOYSA-N -1 1 301.148 4.472 20 0 DIADMM O=C(Nc1ccc2cc[nH]c2c1)c1c([O-])ccc2ccccc21 ZINC001218947969 1052263564 /nfs/dbraw/zinc/26/35/64/1052263564.db2.gz XQHWZXHZBRUCDE-UHFFFAOYSA-N -1 1 302.333 4.279 20 0 DIADMM CCCC[C@@H]1CCC[C@H]1NC(=O)NCc1ccc([O-])c(Cl)c1 ZINC001221757815 1052412108 /nfs/dbraw/zinc/41/21/08/1052412108.db2.gz UBQDPVRTAKMHMF-UKRRQHHQSA-N -1 1 324.852 4.204 20 0 DIADMM O=C(Nc1ccc(O)cc1Cl)c1ccc2ccccc2c1[O-] ZINC000316137044 1052456957 /nfs/dbraw/zinc/45/69/57/1052456957.db2.gz KEWYWIXDXFFNTH-UHFFFAOYSA-N -1 1 313.740 4.157 20 0 DIADMM CC(C)C(=O)Nc1ccc(NCc2cccc([O-])c2Cl)cc1 ZINC000328376362 1052622001 /nfs/dbraw/zinc/62/20/01/1052622001.db2.gz RCIGPUHEIAKDQK-UHFFFAOYSA-N -1 1 318.804 4.252 20 0 DIADMM C[C@@H](OC1CCCCCC1)C(=O)Nc1ccc([O-])c(Cl)c1 ZINC000125214230 1052646869 /nfs/dbraw/zinc/64/68/69/1052646869.db2.gz YGVQIPLDJHKUKW-LLVKDONJSA-N -1 1 311.809 4.112 20 0 DIADMM O=C(Nc1ccc([O-])c(Cl)c1)C1(c2ccccc2)CCC1 ZINC000129533128 1052794174 /nfs/dbraw/zinc/79/41/74/1052794174.db2.gz QCCPBIQYQMKKEB-UHFFFAOYSA-N -1 1 301.773 4.106 20 0 DIADMM O=C(Nc1ccc([O-])c(Cl)c1)C1(c2cccc(Cl)c2)CC1 ZINC000129611661 1052798593 /nfs/dbraw/zinc/79/85/93/1052798593.db2.gz SYJQTPUPCUEGAB-UHFFFAOYSA-N -1 1 322.191 4.369 20 0 DIADMM CC[C@H](NC(=O)c1cc2ccccc2cc1[O-])c1c(C)noc1C ZINC000129688259 1052803306 /nfs/dbraw/zinc/80/33/06/1052803306.db2.gz GZOLBGWAFIORLZ-INIZCTEOSA-N -1 1 324.380 4.031 20 0 DIADMM CC(=O)c1ccccc1OC(=C([O-])c1ccco1)c1ccco1 ZINC001225572658 1052803528 /nfs/dbraw/zinc/80/35/28/1052803528.db2.gz NDRLOLZKSOUOLZ-GOSISDBHSA-N -1 1 310.305 4.078 20 0 DIADMM CC(=O)c1ccc([O-])cc1O[C@H](c1ccccc1)C(F)(F)F ZINC001225617173 1052808720 /nfs/dbraw/zinc/80/87/20/1052808720.db2.gz VFFUTOQHCWDETG-OAHLLOKOSA-N -1 1 310.271 4.277 20 0 DIADMM CC(=O)c1ccc([O-])cc1O[C@@H](c1ccccc1)c1ccccn1 ZINC001225619853 1052808815 /nfs/dbraw/zinc/80/88/15/1052808815.db2.gz YEIJUZBGBNNVKD-FQEVSTJZSA-N -1 1 319.360 4.158 20 0 DIADMM CC(=O)c1ccc([O-])cc1O[C@@H](c1ccccc1)C(F)(F)F ZINC001225617172 1052809067 /nfs/dbraw/zinc/80/90/67/1052809067.db2.gz VFFUTOQHCWDETG-HNNXBMFYSA-N -1 1 310.271 4.277 20 0 DIADMM CC(=O)c1ccc([O-])cc1OCc1ccc(OC(C)C)c(C)c1 ZINC001225620239 1052809128 /nfs/dbraw/zinc/80/91/28/1052809128.db2.gz ZAMVWJDQFGNXBZ-UHFFFAOYSA-N -1 1 314.381 4.269 20 0 DIADMM CCOc1ccc([C@@H](C)Oc2cc([O-])ccc2C(C)=O)cc1 ZINC001225619154 1052809291 /nfs/dbraw/zinc/80/92/91/1052809291.db2.gz MBNSRJWCKSQADG-CYBMUJFWSA-N -1 1 300.354 4.134 20 0 DIADMM CC(=O)c1c(O)cc([O-])cc1O[C@@H](C)c1ccc(Cl)cc1 ZINC001225678834 1052815649 /nfs/dbraw/zinc/81/56/49/1052815649.db2.gz KPCALGXRGGCSSM-JTQLQIEISA-N -1 1 306.745 4.094 20 0 DIADMM CC[C@@H](Oc1cc([O-])cc(O)c1C(C)=O)c1cccc(F)c1C ZINC001225678527 1052815818 /nfs/dbraw/zinc/81/58/18/1052815818.db2.gz IHPSUCKNJJHGMB-MRXNPFEDSA-N -1 1 318.344 4.278 20 0 DIADMM CC(=O)c1c(O)cc([O-])cc1O[C@H](C)c1ccccc1Cl ZINC001225677450 1052816067 /nfs/dbraw/zinc/81/60/67/1052816067.db2.gz PRQLQDLXQKNYTD-SNVBAGLBSA-N -1 1 306.745 4.094 20 0 DIADMM O=C(c1ccc([O-])cc1)c1ccc(O[C@H]2CCC(F)(F)C2)cc1 ZINC001225808696 1052833529 /nfs/dbraw/zinc/83/35/29/1052833529.db2.gz QSOXFPAOKBARSO-INIZCTEOSA-N -1 1 318.319 4.190 20 0 DIADMM CCOc1ccc(N(C)C(=O)c2ccc3ccccc3c2[O-])cc1 ZINC000155113542 1052896118 /nfs/dbraw/zinc/89/61/18/1052896118.db2.gz PYJCDMIONDEGGG-UHFFFAOYSA-N -1 1 321.376 4.221 20 0 DIADMM Cc1cccc([C@H](C)Oc2cc([O-])cc3oc(=O)cc(C)c23)c1 ZINC001226484872 1052901299 /nfs/dbraw/zinc/90/12/99/1052901299.db2.gz JANIJPMMYHHZDA-ZDUSSCGKSA-N -1 1 310.349 4.255 20 0 DIADMM Cc1cccc2c1CC[C@H]2Oc1cc([O-])cc2oc(=O)cc(C)c12 ZINC001226487649 1052902006 /nfs/dbraw/zinc/90/20/06/1052902006.db2.gz BFUIUIVMJOIIJG-MRXNPFEDSA-N -1 1 322.360 4.182 20 0 DIADMM CC[C@H](C)Oc1cc([O-])ccc1C(=O)Cc1ccc(OC)cc1 ZINC001226544597 1052909607 /nfs/dbraw/zinc/90/96/07/1052909607.db2.gz RUJPHEVNPPLNPR-ZDUSSCGKSA-N -1 1 314.381 4.004 20 0 DIADMM O=C(NCc1ccc2ccccc2c1)c1c([O-])cccc1Cl ZINC000920444789 1052939375 /nfs/dbraw/zinc/93/93/75/1052939375.db2.gz LCAWIMOPVCIQOF-UHFFFAOYSA-N -1 1 311.768 4.129 20 0 DIADMM Cc1nc(=O)[n-]c(OC2c3ccccc3-c3ccccc32)c1Cl ZINC001227111682 1052962172 /nfs/dbraw/zinc/96/21/72/1052962172.db2.gz PCVVMFXRYKEZPN-UHFFFAOYSA-N -1 1 324.767 4.293 20 0 DIADMM CC(=O)c1ccc(C)cc1OC(=C([O-])c1ccco1)c1ccco1 ZINC001227115419 1052962264 /nfs/dbraw/zinc/96/22/64/1052962264.db2.gz URVAXAJWTXNFKG-IBGZPJMESA-N -1 1 324.332 4.387 20 0 DIADMM COCC(=O)c1ccc([O-])cc1O[C@@H](C)c1cccc(Cl)c1 ZINC001227171625 1052968113 /nfs/dbraw/zinc/96/81/13/1052968113.db2.gz GJHHHQMUOGNLMU-NSHDSACASA-N -1 1 320.772 4.015 20 0 DIADMM CCC[C@H](C)[C@@H](Oc1cc([O-])ccc1C(=O)COC)C(C)C ZINC001227173227 1052968324 /nfs/dbraw/zinc/96/83/24/1052968324.db2.gz VGFABIMYTJKGJU-UGSOOPFHSA-N -1 1 308.418 4.061 20 0 DIADMM C[C@H](Oc1[n-]c(=S)ncc1F)c1cccc(C(F)(F)F)c1 ZINC001227383041 1052986952 /nfs/dbraw/zinc/98/69/52/1052986952.db2.gz IRHCRXYPOPOREG-ZETCQYMHSA-N -1 1 318.295 4.063 20 0 DIADMM CC(=O)[C@@H](Oc1cc(Cl)c([O-])cc1Cl)c1ccccc1 ZINC001227646399 1053005901 /nfs/dbraw/zinc/00/59/01/1053005901.db2.gz RZAWTYOCGOTOIT-OAHLLOKOSA-N -1 1 311.164 4.408 20 0 DIADMM O=C(c1ccccc1)c1ccc([O-])cc1O[C@H]1CCC(F)(F)C1 ZINC001228185127 1053051485 /nfs/dbraw/zinc/05/14/85/1053051485.db2.gz FFYVLXUMVVDBQD-AWEZNQCLSA-N -1 1 318.319 4.190 20 0 DIADMM CCC(=O)c1c(O)cc([O-])cc1O[C@@H](C)c1cccc(C)c1 ZINC001228554878 1053133929 /nfs/dbraw/zinc/13/39/29/1053133929.db2.gz NFLCAOAZWANAFX-LBPRGKRZSA-N -1 1 300.354 4.139 20 0 DIADMM O=C1CCc2cccc(OC(=C([O-])c3ccco3)c3ccco3)c21 ZINC001228837432 1053189385 /nfs/dbraw/zinc/18/93/85/1053189385.db2.gz JQNJYCAKCGYVCU-LJQANCHMSA-N -1 1 322.316 4.005 20 0 DIADMM C[C@@H](Oc1cc([O-])cc2oc(=O)ccc12)c1ccccc1Cl ZINC001229129038 1053253323 /nfs/dbraw/zinc/25/33/23/1053253323.db2.gz HLWATHAXTBGLSK-SNVBAGLBSA-N -1 1 316.740 4.292 20 0 DIADMM CCC[C@H](Oc1c([O-])c(OC)cc2ccc(=O)oc21)[C@H](C)CC ZINC001229215591 1053275210 /nfs/dbraw/zinc/27/52/10/1053275210.db2.gz MAKPMNQGNJXJGV-YPMHNXCESA-N -1 1 320.385 4.101 20 0 DIADMM CCCC[C@H](CCC)Oc1c([O-])c(OC)cc2ccc(=O)oc21 ZINC001229215984 1053275572 /nfs/dbraw/zinc/27/55/72/1053275572.db2.gz NVYDAOCXUBNYMG-ZDUSSCGKSA-N -1 1 320.385 4.245 20 0 DIADMM CCCC/C=C/[C@@H](C)Oc1c([O-])c(OC)cc2ccc(=O)oc21 ZINC001229214178 1053275759 /nfs/dbraw/zinc/27/57/59/1053275759.db2.gz CEHGBSPJOXSWEV-ABZNLYFFSA-N -1 1 318.369 4.021 20 0 DIADMM CCC[C@@H](Oc1c([O-])c(OC)cc2ccc(=O)oc21)C(C)(C)C ZINC001229217198 1053276014 /nfs/dbraw/zinc/27/60/14/1053276014.db2.gz ZHUCIHDRPGTDGW-CYBMUJFWSA-N -1 1 320.385 4.101 20 0 DIADMM CC(C)C[C@@H](C)Oc1cc(O)ccc1C(=O)c1ccc([O-])cc1 ZINC001229294584 1053293499 /nfs/dbraw/zinc/29/34/99/1053293499.db2.gz QTGMRGZRCZQXMM-CYBMUJFWSA-N -1 1 314.381 4.142 20 0 DIADMM O=S(=O)([N-]c1ccccc1)c1ccc(Cl)c2ccccc21 ZINC001200003575 1053311008 /nfs/dbraw/zinc/31/10/08/1053311008.db2.gz CATPLEFYMRLACG-UHFFFAOYSA-N -1 1 317.797 4.294 20 0 DIADMM Cc1cn2c(n1)[C@@H](Oc1cc([O-])c(Cl)cc1Cl)CCC2 ZINC001229405771 1053314201 /nfs/dbraw/zinc/31/42/01/1053314201.db2.gz AXVWOYUZBUALHU-LBPRGKRZSA-N -1 1 313.184 4.118 20 0 DIADMM CC1(C)CC(=O)CC[C@H]1Oc1cc([O-])c(Cl)cc1Cl ZINC001229411883 1053315191 /nfs/dbraw/zinc/31/51/91/1053315191.db2.gz WIRLZWRFYABAJV-CYBMUJFWSA-N -1 1 303.185 4.226 20 0 DIADMM COc1ccc([C@@H](C)Oc2cc([O-])c(Cl)cc2Cl)cn1 ZINC001229410712 1053316109 /nfs/dbraw/zinc/31/61/09/1053316109.db2.gz MFHXUFFIQXGGHZ-MRVPVSSYSA-N -1 1 314.168 4.243 20 0 DIADMM CCC(=O)c1ccc([O-])cc1O[C@@H](C)c1c(F)cccc1F ZINC001229475273 1053331832 /nfs/dbraw/zinc/33/18/32/1053331832.db2.gz SOCIVZZZRHBTGP-JTQLQIEISA-N -1 1 306.308 4.403 20 0 DIADMM CCC(=O)c1ccc([O-])cc1O[C@@H](C)c1ccc(OC)cc1 ZINC001229475334 1053331974 /nfs/dbraw/zinc/33/19/74/1053331974.db2.gz UVBZAALCKCDDSS-LBPRGKRZSA-N -1 1 300.354 4.134 20 0 DIADMM CCC(=O)c1ccc([O-])cc1O[C@@H]1CCc2cc(F)ccc21 ZINC001229477923 1053332706 /nfs/dbraw/zinc/33/27/06/1053332706.db2.gz RWDVYRLNAFHZCH-QGZVFWFLSA-N -1 1 300.329 4.190 20 0 DIADMM CCC(=O)c1ccc([O-])cc1O[C@@H](C)c1cccc(N(C)C)c1 ZINC001229477480 1053333669 /nfs/dbraw/zinc/33/36/69/1053333669.db2.gz NOIIDCMVGDUYFV-ZDUSSCGKSA-N -1 1 313.397 4.191 20 0 DIADMM O=C(Nc1cccc2ncccc21)c1cc2ccccc2cc1[O-] ZINC000325006812 1053465728 /nfs/dbraw/zinc/46/57/28/1053465728.db2.gz ASGJPZULFUCNKM-UHFFFAOYSA-N -1 1 314.344 4.346 20 0 DIADMM Cc1ccc2c(c1)[C@@H](NC(=O)c1cc3ccccc3cc1[O-])CC2 ZINC001300225673 1053506404 /nfs/dbraw/zinc/50/64/04/1053506404.db2.gz GGAHFNKQMJRHNQ-IBGZPJMESA-N -1 1 317.388 4.271 20 0 DIADMM CC(=O)c1cccc(C)c1OC(=C([O-])c1ccco1)c1ccco1 ZINC001230319793 1053519155 /nfs/dbraw/zinc/51/91/55/1053519155.db2.gz YIGRWDOKCWFYKL-IBGZPJMESA-N -1 1 324.332 4.387 20 0 DIADMM [O-]c1cccc(CNCc2cccc(Cl)c2F)c1Cl ZINC001324491119 1053656836 /nfs/dbraw/zinc/65/68/36/1053656836.db2.gz XLPKBNVJDKXUGE-UHFFFAOYSA-N -1 1 300.160 4.128 20 0 DIADMM C[C@H](Oc1nc2c(cc(Cl)nc2Cl)[n-]1)c1ccccc1 ZINC001231044467 1053659397 /nfs/dbraw/zinc/65/93/97/1053659397.db2.gz JPGVAMBWCAWQJV-QMMMGPOBSA-N -1 1 308.168 4.405 20 0 DIADMM C[C@H](Oc1nc2cc(Cl)nc(Cl)c2[n-]1)c1ccccc1 ZINC001231044467 1053659403 /nfs/dbraw/zinc/65/94/03/1053659403.db2.gz JPGVAMBWCAWQJV-QMMMGPOBSA-N -1 1 308.168 4.405 20 0 DIADMM O=C(Nc1ccc(Cl)cc1[O-])c1csc(-c2ccoc2)n1 ZINC000153560110 1053696932 /nfs/dbraw/zinc/69/69/32/1053696932.db2.gz LGBLLUWDHBFDGU-UHFFFAOYSA-N -1 1 320.757 4.014 20 0 DIADMM COc1cnc(C=Cc2ccc(-c3ccccc3)s2)[n-]c1=O ZINC001325089107 1053698241 /nfs/dbraw/zinc/69/82/41/1053698241.db2.gz KWKNIOOOXKNENW-CSKARUKUSA-N -1 1 310.378 4.090 20 0 DIADMM Cc1cccc2c1[C@@H](Oc1cccnc1-c1ncccc1[O-])CC2 ZINC001231199801 1053698479 /nfs/dbraw/zinc/69/84/79/1053698479.db2.gz FRVYSUHHMJDXML-INIZCTEOSA-N -1 1 318.376 4.224 20 0 DIADMM CCC[C@H](Oc1cccnc1-c1ncccc1[O-])[C@H](C)CC ZINC001231199071 1053698933 /nfs/dbraw/zinc/69/89/33/1053698933.db2.gz ACUPQIHWAYQUGP-HIFRSBDPSA-N -1 1 300.402 4.443 20 0 DIADMM CC[C@H](C)CC[C@H](C)Oc1cccnc1-c1ncccc1[O-] ZINC001231204883 1053701749 /nfs/dbraw/zinc/70/17/49/1053701749.db2.gz UZXVWYMZSAKDLW-KBPBESRZSA-N -1 1 300.402 4.443 20 0 DIADMM O=C([O-])c1ccc(CN2CCC[C@@H]2c2ccc(Cl)cc2)s1 ZINC001231463930 1053757644 /nfs/dbraw/zinc/75/76/44/1053757644.db2.gz VWAVZFQZSBIBQH-CQSZACIVSA-N -1 1 321.829 4.437 20 0 DIADMM O=C([O-])c1ccc(F)c(CN2CCC[C@H]2c2ccc(F)cc2)c1 ZINC001231457473 1053757840 /nfs/dbraw/zinc/75/78/40/1053757840.db2.gz UADXXTFYEDPMCT-KRWDZBQOSA-N -1 1 317.335 4.000 20 0 DIADMM CN(Cc1cc(C(=O)[O-])ccc1F)Cc1cccc2ccccc21 ZINC001231458350 1053759187 /nfs/dbraw/zinc/75/91/87/1053759187.db2.gz VKIUFNSJNNZYDV-UHFFFAOYSA-N -1 1 323.367 4.309 20 0 DIADMM Cc1noc(C2CC2)c1[N-]C(=O)c1ccc(Oc2ccccc2)o1 ZINC000156534476 1053813743 /nfs/dbraw/zinc/81/37/43/1053813743.db2.gz AYHNGVZKXNUNFD-UHFFFAOYSA-N -1 1 324.336 4.498 20 0 DIADMM [O-]c1cc(CN2CCCC[C@H]2c2cccnc2)ccc1Cl ZINC001231736496 1053843976 /nfs/dbraw/zinc/84/39/76/1053843976.db2.gz HVIPOWHEEJRHPY-INIZCTEOSA-N -1 1 302.805 4.168 20 0 DIADMM [O-]c1cc(CN2CCSc3ccccc3C2)ccc1Cl ZINC001231734575 1053846459 /nfs/dbraw/zinc/84/64/59/1053846459.db2.gz BYTAIDMEVYTUIU-UHFFFAOYSA-N -1 1 305.830 4.154 20 0 DIADMM [O-]c1c(NC(=S)NC2CCCCC2)cccc1C(F)(F)F ZINC001200654858 1053855262 /nfs/dbraw/zinc/85/52/62/1053855262.db2.gz LQLDLUIBOPKONB-UHFFFAOYSA-N -1 1 318.364 4.030 20 0 DIADMM O=C(c1cc(Cl)ccc1[O-])N1CCCC2(CCCC2)CC1 ZINC001300707566 1053958776 /nfs/dbraw/zinc/95/87/76/1053958776.db2.gz DRMSPUCGUNFRLG-UHFFFAOYSA-N -1 1 307.821 4.232 20 0 DIADMM Cc1nc(S[C@H]2CCc3c2cccc3F)[n-]c(=O)c1C1CC1 ZINC001329274816 1053977061 /nfs/dbraw/zinc/97/70/61/1053977061.db2.gz VVXRDDBBXIXOML-AWEZNQCLSA-N -1 1 316.401 4.287 20 0 DIADMM Cc1nocc1[N-]C(=O)c1occc1CSc1ccccc1 ZINC001437253815 1054023514 /nfs/dbraw/zinc/02/35/14/1054023514.db2.gz PAZOIPOWOOXOJT-UHFFFAOYSA-N -1 1 314.366 4.121 20 0 DIADMM C[C@H]1CCCCCN1Cc1cc(F)c([O-])c(Br)c1 ZINC001232640886 1054092547 /nfs/dbraw/zinc/09/25/47/1054092547.db2.gz SWYUJLPLQGNKCO-JTQLQIEISA-N -1 1 316.214 4.058 20 0 DIADMM CC[C@@H]1c2ccccc2CCN1Cc1ccc(F)c([O-])c1F ZINC001232936462 1054150662 /nfs/dbraw/zinc/15/06/62/1054150662.db2.gz CWTFUWADUJJSAX-MRXNPFEDSA-N -1 1 303.352 4.180 20 0 DIADMM CN(C(=O)c1cc(F)ccc1[O-])C1CCC(C(C)(C)C)CC1 ZINC000622300342 1054159774 /nfs/dbraw/zinc/15/97/74/1054159774.db2.gz JXDVAPDDZMONRP-UHFFFAOYSA-N -1 1 307.409 4.208 20 0 DIADMM [O-]c1cc(CN2CCC[C@@H]2c2ccccc2F)cc(F)c1F ZINC001232972209 1054162922 /nfs/dbraw/zinc/16/29/22/1054162922.db2.gz WNJYFKINMRHJPD-OAHLLOKOSA-N -1 1 307.315 4.147 20 0 DIADMM Cc1cc(C)cc([C@@H]2CCC[N@H+]2Cc2cc(Cl)ncc2O)c1 ZINC001233038049 1054174042 /nfs/dbraw/zinc/17/40/42/1054174042.db2.gz MSHIJTKCYVLFAZ-INIZCTEOSA-N -1 1 316.832 4.395 20 0 DIADMM Oc1cnc(Cl)cc1C[N@H+]1CC[C@@H](c2ccccc2Cl)C1 ZINC001233033076 1054175105 /nfs/dbraw/zinc/17/51/05/1054175105.db2.gz AMCIAVRWJWLXQF-LLVKDONJSA-N -1 1 323.223 4.084 20 0 DIADMM Fc1ccc([C@@H]2CSCCN2Cc2ccc([S-])cc2)cc1 ZINC001233261080 1054219283 /nfs/dbraw/zinc/21/92/83/1054219283.db2.gz ARZRLYDVXPOCBK-KRWDZBQOSA-N -1 1 319.470 4.405 20 0 DIADMM O=C(c1cc(F)ccc1[O-])N1CCC[C@@H]1CCC1CCCC1 ZINC000622447150 1054239812 /nfs/dbraw/zinc/23/98/12/1054239812.db2.gz ANXPWEBALOMFPI-OAHLLOKOSA-N -1 1 305.393 4.106 20 0 DIADMM CC(C)c1ccc([C@H]2CCCCN2C(=O)c2cncc([O-])c2)cc1 ZINC000622471945 1054242619 /nfs/dbraw/zinc/24/26/19/1054242619.db2.gz NOGGPYLAMTVOOU-LJQANCHMSA-N -1 1 324.424 4.278 20 0 DIADMM CCSc1ccc(Cl)cc1[N-]C(=O)c1ocnc1CC ZINC001337125213 1054257044 /nfs/dbraw/zinc/25/70/44/1054257044.db2.gz ZEMYMYZHDHYHQP-UHFFFAOYSA-N -1 1 310.806 4.255 20 0 DIADMM Oc1ccc(F)c(C[N@H+]2CC[C@@H](c3ccc(Cl)cc3)C2)c1F ZINC001233396164 1054259703 /nfs/dbraw/zinc/25/97/03/1054259703.db2.gz NCFXYNHNLJAJOR-GFCCVEGCSA-N -1 1 323.770 4.313 20 0 DIADMM O=C(NCC1CCC(F)(F)CC1)c1cc2ccccc2cc1[O-] ZINC000622583991 1054292996 /nfs/dbraw/zinc/29/29/96/1054292996.db2.gz MQUQEARAEFFFIR-UHFFFAOYSA-N -1 1 319.351 4.101 20 0 DIADMM CC(C)(C)[C@H]1CCCN(C(=O)c2cc3ccccc3cc2[O-])C1 ZINC000622574433 1054298609 /nfs/dbraw/zinc/29/86/09/1054298609.db2.gz ODGRMUVPJIQZMG-INIZCTEOSA-N -1 1 311.425 4.444 20 0 DIADMM O=C(Nc1cccc([O-])c1Br)C12CCC(CC1)CC2 ZINC001339029825 1054319704 /nfs/dbraw/zinc/31/97/04/1054319704.db2.gz OUHHDRISKYANFS-UHFFFAOYSA-N -1 1 324.218 4.064 20 0 DIADMM CCCC(=O)c1ccc([O-])cc1O[C@H](C)c1ccncc1F ZINC001233650127 1054322052 /nfs/dbraw/zinc/32/20/52/1054322052.db2.gz IFEGURSOIMFEQF-LLVKDONJSA-N -1 1 303.333 4.049 20 0 DIADMM CCCC(=O)c1ccc([O-])cc1OC[C@@H](C)Oc1ccccc1 ZINC001233650497 1054322661 /nfs/dbraw/zinc/32/26/61/1054322661.db2.gz LEGNEJMIONDFEI-CQSZACIVSA-N -1 1 314.381 4.221 20 0 DIADMM CC(C)(C)C[C@H]1CCN(C(=O)c2cc(F)ccc2[O-])C1(C)C ZINC000622710155 1054342344 /nfs/dbraw/zinc/34/23/44/1054342344.db2.gz WWJZVFMLKGXJEP-GFCCVEGCSA-N -1 1 307.409 4.208 20 0 DIADMM CC(C)CCn1nccc1NC(=O)c1ccc(C(C)C)cc1[O-] ZINC001440703311 1054365477 /nfs/dbraw/zinc/36/54/77/1054365477.db2.gz FYPFQVSFRQZTQR-UHFFFAOYSA-N -1 1 315.417 4.011 20 0 DIADMM O=C(Nc1cc(Cl)cc(Cl)c1)c1c(F)ccc([O-])c1F ZINC001440753305 1054367282 /nfs/dbraw/zinc/36/72/82/1054367282.db2.gz GBTKGHWVIMMEKM-UHFFFAOYSA-N -1 1 318.106 4.230 20 0 DIADMM O=C(Cc1ccc(O[C@@H]2C=CCCC2)cc1)c1ccc([O-])cc1 ZINC001233940092 1054395309 /nfs/dbraw/zinc/39/53/09/1054395309.db2.gz AJNMCWJILNKUKL-GOSISDBHSA-N -1 1 308.377 4.305 20 0 DIADMM O=C(Cc1ccc(OC(C2CC2)C2CC2)cc1)c1ccc([O-])cc1 ZINC001233941968 1054395373 /nfs/dbraw/zinc/39/53/73/1054395373.db2.gz OBSBUTGOSHBPCD-UHFFFAOYSA-N -1 1 322.404 4.385 20 0 DIADMM O=C(Cc1ccc([O-])c(Cl)c1)N(CC1CC1)C1CCCCC1 ZINC001443189165 1054443240 /nfs/dbraw/zinc/44/32/40/1054443240.db2.gz PGZGLANRQGRLOV-UHFFFAOYSA-N -1 1 321.848 4.159 20 0 DIADMM CC(C)(C)CCCCNC(=O)c1ccc2ccc(O)cc2c1[O-] ZINC001443721274 1054455548 /nfs/dbraw/zinc/45/55/48/1054455548.db2.gz BUXCAFIJPWZXLC-UHFFFAOYSA-N -1 1 315.413 4.197 20 0 DIADMM CC[C@@H]1c2ccccc2CCN1C(=O)c1ccc(Cl)cc1[O-] ZINC001444130077 1054470341 /nfs/dbraw/zinc/47/03/41/1054470341.db2.gz BXNYHJWCWMXLMM-MRXNPFEDSA-N -1 1 315.800 4.195 20 0 DIADMM Cc1ccc(C(=O)Nc2ccc(C(=O)C(C)(C)C)cc2)c([O-])c1 ZINC001444906285 1054490417 /nfs/dbraw/zinc/49/04/17/1054490417.db2.gz LXQHAMWTELRANG-UHFFFAOYSA-N -1 1 311.381 4.182 20 0 DIADMM Cc1ccc(C)c([C@H]2CCCN2C(=O)c2ccc([O-])cc2F)c1 ZINC001445999911 1054522987 /nfs/dbraw/zinc/52/29/87/1054522987.db2.gz LGPZWUOOJLAYBJ-GOSISDBHSA-N -1 1 313.372 4.125 20 0 DIADMM CC(C)(CNC(=O)c1cc(Cl)ccc1[O-])C1CCCCC1 ZINC001446273653 1054534209 /nfs/dbraw/zinc/53/42/09/1054534209.db2.gz DIPHBBWLDHKYHY-UHFFFAOYSA-N -1 1 309.837 4.382 20 0 DIADMM O=C([O-])c1ccc2scc(-c3cc(C(F)(F)F)n[nH]3)c2c1 ZINC000623329316 1054560799 /nfs/dbraw/zinc/56/07/99/1054560799.db2.gz OWWMYCFLRQJYIU-UHFFFAOYSA-N -1 1 312.272 4.008 20 0 DIADMM C[C@@H](Oc1nc2sccc2[n-]1)c1cc(-c2ccccc2)no1 ZINC001234855008 1054603064 /nfs/dbraw/zinc/60/30/64/1054603064.db2.gz PITOZZYNHJOHAF-SNVBAGLBSA-N -1 1 311.366 4.419 20 0 DIADMM C[C@H](Oc1nc2sccc2[n-]1)c1cc(-c2ccccc2)no1 ZINC001234854999 1054603411 /nfs/dbraw/zinc/60/34/11/1054603411.db2.gz PITOZZYNHJOHAF-JTQLQIEISA-N -1 1 311.366 4.419 20 0 DIADMM O=C(CC/C=C/c1ccccc1)Nc1ccc([O-])c(F)c1F ZINC001449452062 1054622459 /nfs/dbraw/zinc/62/24/59/1054622459.db2.gz YPKRMZHSAJQEHI-XBXARRHUSA-N -1 1 303.308 4.103 20 0 DIADMM CC[C@H]1CCCC[C@@H]1CNC(=O)c1cc2ccccc2cc1[O-] ZINC001450397597 1054647199 /nfs/dbraw/zinc/64/71/99/1054647199.db2.gz DUDNITQBXNUGLG-WMLDXEAASA-N -1 1 311.425 4.492 20 0 DIADMM CCCCCC[C@@H](C)CC(=O)n1[n-]c(=O)c2ccc(OC)cc21 ZINC001450568049 1054653601 /nfs/dbraw/zinc/65/36/01/1054653601.db2.gz OYRMGWSNUOHAEE-CYBMUJFWSA-N -1 1 318.417 4.387 20 0 DIADMM CCCc1cc(C(=O)Nc2cc([O-])c(F)cc2F)sc1C ZINC001450905957 1054663599 /nfs/dbraw/zinc/66/35/99/1054663599.db2.gz YCRUAMPGSQTGCG-UHFFFAOYSA-N -1 1 311.353 4.245 20 0 DIADMM O=C(NC1(c2ccccc2Cl)CC1)c1c([O-])cccc1Cl ZINC001452137915 1054694992 /nfs/dbraw/zinc/69/49/92/1054694992.db2.gz RZOUOUHASXIPHW-UHFFFAOYSA-N -1 1 322.191 4.118 20 0 DIADMM O=C(N[C@H](C1CCC1)C1CCCCC1)c1cccc([O-])c1F ZINC001452182569 1054697283 /nfs/dbraw/zinc/69/72/83/1054697283.db2.gz GGRIEEFOBZCZEM-KRWDZBQOSA-N -1 1 305.393 4.010 20 0 DIADMM O=C(c1c([O-])cccc1Cl)N1CCC[C@@H]1CC1CCCC1 ZINC001452664587 1054711781 /nfs/dbraw/zinc/71/17/81/1054711781.db2.gz KQMDSGGXZJBRBN-CYBMUJFWSA-N -1 1 307.821 4.231 20 0 DIADMM CCCCCOc1ccc(C(=O)Nc2cccc(F)c2[O-])cc1 ZINC001454757898 1054782572 /nfs/dbraw/zinc/78/25/72/1054782572.db2.gz NLUHCDOIQNRTMO-UHFFFAOYSA-N -1 1 317.360 4.353 20 0 DIADMM O=C(Nc1cccc(F)c1[O-])c1cc(Cl)cc(Cl)c1F ZINC001454771271 1054783232 /nfs/dbraw/zinc/78/32/32/1054783232.db2.gz QGAWGTYNHFVVHK-UHFFFAOYSA-N -1 1 318.106 4.230 20 0 DIADMM CC(C)c1cccc(O[C@H](C)C(=O)Nc2cccc(F)c2[O-])c1 ZINC001454754152 1054783637 /nfs/dbraw/zinc/78/36/37/1054783637.db2.gz HHXAQBAFIFMORD-GFCCVEGCSA-N -1 1 317.360 4.061 20 0 DIADMM COC(=O)c1nc2ccc(-c3ccc(Cl)cc3Cl)cc2[n-]1 ZINC001235964067 1054875067 /nfs/dbraw/zinc/87/50/67/1054875067.db2.gz VMNREASKODLIIX-UHFFFAOYSA-N -1 1 321.163 4.323 20 0 DIADMM COC(=O)c1nc2cc(-c3ccc(Cl)cc3Cl)ccc2[n-]1 ZINC001235964067 1054875079 /nfs/dbraw/zinc/87/50/79/1054875079.db2.gz VMNREASKODLIIX-UHFFFAOYSA-N -1 1 321.163 4.323 20 0 DIADMM Cc1ccc(F)c(-c2nc(-c3ccccc3)nc3[nH]ccc32)c1[O-] ZINC001236389235 1055088626 /nfs/dbraw/zinc/08/86/26/1055088626.db2.gz BNTQWUGYAYIIFY-UHFFFAOYSA-N -1 1 319.339 4.397 20 0 DIADMM Cc1ccc(F)c(-c2cccc(N3CCCC[C@@H]3C)n2)c1[O-] ZINC001236389520 1055090673 /nfs/dbraw/zinc/09/06/73/1055090673.db2.gz FBJOZOJGUAPSIK-ZDUSSCGKSA-N -1 1 300.377 4.281 20 0 DIADMM Cc1ccc(F)c(-c2ccc(OCc3ccccc3)cn2)c1[O-] ZINC001236394406 1055092961 /nfs/dbraw/zinc/09/29/61/1055092961.db2.gz XRAHYNSTVIQUFW-UHFFFAOYSA-N -1 1 309.340 4.481 20 0 DIADMM Cc1ccsc1CN(C)Cc1cccc(C(=O)[O-])c1Cl ZINC000383803679 1055304687 /nfs/dbraw/zinc/30/46/87/1055304687.db2.gz JEQJRDNEMMEHSA-UHFFFAOYSA-N -1 1 309.818 4.040 20 0 DIADMM O=C(N[C@@H]1CC[C@H]2CCCC[C@@H]2C1)c1c([O-])cccc1Cl ZINC001587542806 1055324112 /nfs/dbraw/zinc/32/41/12/1055324112.db2.gz GAGBLYGCEXXVPJ-JHJVBQTASA-N -1 1 307.821 4.134 20 0 DIADMM C[C@@H]1c2ccccc2CCN1C(=O)c1cc2ccccc2cc1[O-] ZINC001587674518 1055344083 /nfs/dbraw/zinc/34/40/83/1055344083.db2.gz DADHBJXBXMPWQW-CQSZACIVSA-N -1 1 317.388 4.305 20 0 DIADMM CCC[C@H](NC(=O)c1cc(Cl)ccc1[O-])c1ccccc1 ZINC001587935112 1055401432 /nfs/dbraw/zinc/40/14/32/1055401432.db2.gz TUQZGSSQGHUBAQ-HNNXBMFYSA-N -1 1 303.789 4.317 20 0 DIADMM C[C@]1(C2CCCCC2)CCN1C(=O)c1ncc2ccccc2c1[O-] ZINC001588180019 1055443658 /nfs/dbraw/zinc/44/36/58/1055443658.db2.gz XINNJURBHGUCHS-HXUWFJFHSA-N -1 1 324.424 4.125 20 0 DIADMM [O-]c1c(CN2CCCc3ccccc3C2)cc(Cl)nc1Cl ZINC001237536042 1055470031 /nfs/dbraw/zinc/47/00/31/1055470031.db2.gz WVOALBDJJAAYSL-UHFFFAOYSA-N -1 1 323.223 4.042 20 0 DIADMM CC(C)(C)c1ccc(NC(=O)c2c(F)ccc([O-])c2F)cc1F ZINC001593661801 1055557996 /nfs/dbraw/zinc/55/79/96/1055557996.db2.gz CMFXJFWKOKRAMF-UHFFFAOYSA-N -1 1 323.314 4.359 20 0 DIADMM [O-]c1c(F)cc(CN2CCC3(CC(F)(F)C3)CC2)cc1Cl ZINC001237983176 1055574648 /nfs/dbraw/zinc/57/46/48/1055574648.db2.gz CYRZDSRWKADNPK-UHFFFAOYSA-N -1 1 319.754 4.196 20 0 DIADMM [O-]c1cc(F)c(CN2CC[C@@H](c3ccc(F)cc3)C2)cc1Cl ZINC001238149679 1055612013 /nfs/dbraw/zinc/61/20/13/1055612013.db2.gz MCTVMJWBWLOOJD-GFCCVEGCSA-N -1 1 323.770 4.313 20 0 DIADMM [O-]c1cc(F)c(CN2CCC3(CC[C@H](F)C3)CC2)cc1Cl ZINC001238150060 1055615439 /nfs/dbraw/zinc/61/54/39/1055615439.db2.gz QCKHUCIHFLILMM-LBPRGKRZSA-N -1 1 315.791 4.289 20 0 DIADMM O=C(c1cc(Cl)ccc1[O-])N1CCC(c2ccccc2)CC1 ZINC000032745949 1055655003 /nfs/dbraw/zinc/65/50/03/1055655003.db2.gz KRQVPRVMVBPSDD-UHFFFAOYSA-N -1 1 315.800 4.065 20 0 DIADMM COc1cc(F)c(NC(=O)c2ccc(C(C)C)cc2[O-])cc1F ZINC001596079206 1055667040 /nfs/dbraw/zinc/66/70/40/1055667040.db2.gz DOYRJCBCXSUTSX-UHFFFAOYSA-N -1 1 321.323 4.055 20 0 DIADMM CC(C)(C)c1ccc([C@@H]2CCCN2C(=O)c2ccc([O-])cn2)cc1 ZINC001596474040 1055714806 /nfs/dbraw/zinc/71/48/06/1055714806.db2.gz JHPUEYYBHYMGCY-SFHVURJKSA-N -1 1 324.424 4.062 20 0 DIADMM CSc1cc(Cl)ccc1[N-]C(=O)c1ccc(C(C)=O)o1 ZINC001538793114 1055717549 /nfs/dbraw/zinc/71/75/49/1055717549.db2.gz NOGPKGFHZXTDJX-UHFFFAOYSA-N -1 1 309.774 4.110 20 0 DIADMM O=C(N[C@@H]1CCc2cccc3cccc1c32)c1ccc([O-])cc1F ZINC001596898666 1055757422 /nfs/dbraw/zinc/75/74/22/1055757422.db2.gz UDSZKUMQTOMULW-GOSISDBHSA-N -1 1 321.351 4.102 20 0 DIADMM CC(C)CC1(CNC(=O)Cc2ccc([O-])c(Cl)c2)CCCC1 ZINC001566299294 1055759753 /nfs/dbraw/zinc/75/97/53/1055759753.db2.gz GWKYTAXYZSGTEV-UHFFFAOYSA-N -1 1 323.864 4.311 20 0 DIADMM CCC(CC)CC(=O)Nc1cc(C)cc(Br)c1[O-] ZINC001566887792 1055786009 /nfs/dbraw/zinc/78/60/09/1055786009.db2.gz KILRTQXAUDTIAD-UHFFFAOYSA-N -1 1 314.223 4.228 20 0 DIADMM Cc1cc(C(=O)Nc2ccc(Cl)cc2[O-])nc2ccccc12 ZINC001567231514 1055795993 /nfs/dbraw/zinc/79/59/93/1055795993.db2.gz BOSKFTQAKGBYMT-UHFFFAOYSA-N -1 1 312.756 4.155 20 0 DIADMM Cc1cccc([C@H](C)NC(=O)c2ccc3ccccc3c2[O-])c1 ZINC001597284489 1055811916 /nfs/dbraw/zinc/81/19/16/1055811916.db2.gz VPUNWVWNDQTNSD-AWEZNQCLSA-N -1 1 305.377 4.345 20 0 DIADMM CC(C)Cc1cccc([C@H](C)C(=O)[N-]OC2CCCCC2)c1 ZINC001567889852 1055824523 /nfs/dbraw/zinc/82/45/23/1055824523.db2.gz PTWDEEGVAOIJLE-HNNXBMFYSA-N -1 1 303.446 4.369 20 0 DIADMM Cc1cc(Br)c([O-])c(NC(=O)C[C@@H]2CC=CCC2)c1 ZINC001597675081 1055862212 /nfs/dbraw/zinc/86/22/12/1055862212.db2.gz ZWSKVKHFKVZNGH-LLVKDONJSA-N -1 1 324.218 4.148 20 0 DIADMM O=C(Nc1ccc([O-])c(F)c1F)[C@@H]1C[C@H]1c1cccc(Cl)c1 ZINC001569012890 1055851861 /nfs/dbraw/zinc/85/18/61/1055851861.db2.gz RFNKRGQJDPOBFZ-WDEREUQCSA-N -1 1 323.726 4.066 20 0 DIADMM O=C(Nc1nccc2ccccc21)c1cc2ccccc2cc1[O-] ZINC001569031122 1055853310 /nfs/dbraw/zinc/85/33/10/1055853310.db2.gz UHGPVJRVKPFDNK-UHFFFAOYSA-N -1 1 314.344 4.346 20 0 DIADMM O=C(Nc1cc([O-])c(F)cc1F)c1cc2sccc2s1 ZINC001570101542 1055886559 /nfs/dbraw/zinc/88/65/59/1055886559.db2.gz IQUFBIVKOVDTEX-UHFFFAOYSA-N -1 1 311.334 4.199 20 0 DIADMM CCCCN(C(=O)c1cccc([O-])c1F)[C@H](C)c1ccc(C)o1 ZINC001597922381 1055892595 /nfs/dbraw/zinc/89/25/95/1055892595.db2.gz YBHLWHHSYIESRG-CYBMUJFWSA-N -1 1 319.376 4.436 20 0 DIADMM O=C(Nc1cc(F)cc(F)c1[O-])c1ccc(F)c2ccccc12 ZINC001570464551 1055903918 /nfs/dbraw/zinc/90/39/18/1055903918.db2.gz HDTBWKKQUGPBOJ-UHFFFAOYSA-N -1 1 317.266 4.215 20 0 DIADMM CCc1c2ccccc2oc1C(=O)Nc1cc(F)cc(F)c1[O-] ZINC001570465679 1055904892 /nfs/dbraw/zinc/90/48/92/1055904892.db2.gz KJEPAFGEMYNTQQ-UHFFFAOYSA-N -1 1 317.291 4.231 20 0 DIADMM Cc1cccc(-c2ccc([C@H](C)[N-]C(=O)C(F)(F)F)cc2)c1 ZINC001239491990 1055906819 /nfs/dbraw/zinc/90/68/19/1055906819.db2.gz MAIXMXAAZQSVHZ-LBPRGKRZSA-N -1 1 307.315 4.402 20 0 DIADMM Cc1cccc(C2(NC(=O)c3c([O-])cccc3Cl)CCC2)c1 ZINC001570674288 1055913357 /nfs/dbraw/zinc/91/33/57/1055913357.db2.gz SXKNVGBVJIPODR-UHFFFAOYSA-N -1 1 315.800 4.163 20 0 DIADMM Cc1ccc(C)c([C@@H](C)NC(=O)c2cc(Cl)ccc2[O-])c1 ZINC001598203396 1055924733 /nfs/dbraw/zinc/92/47/33/1055924733.db2.gz AGGNTZBQBZYHJI-GFCCVEGCSA-N -1 1 303.789 4.153 20 0 DIADMM CSc1ccccc1[N-]C(=O)c1ncc(Cc2ccccc2)o1 ZINC001539895630 1055926539 /nfs/dbraw/zinc/92/65/39/1055926539.db2.gz OEGAENLIKYURPA-UHFFFAOYSA-N -1 1 324.405 4.240 20 0 DIADMM Cc1ccc(N(C)C(=O)c2ccc(C(F)(F)F)c([O-])c2)cc1C ZINC001598381918 1055944909 /nfs/dbraw/zinc/94/49/09/1055944909.db2.gz FPTYYTJXOHVJOI-UHFFFAOYSA-N -1 1 323.314 4.304 20 0 DIADMM Cc1ccc([C@H](C)N(C)C(=O)c2ccc(Cl)cc2[O-])c(C)c1 ZINC001540721092 1056067471 /nfs/dbraw/zinc/06/74/71/1056067471.db2.gz RPSLCJHQVXYYLV-ZDUSSCGKSA-N -1 1 317.816 4.496 20 0 DIADMM O=C(Nc1ccc(F)cc1[O-])c1ccc(Cl)c2occc21 ZINC001611074326 1056105162 /nfs/dbraw/zinc/10/51/62/1056105162.db2.gz NAPVXROHOIVPFC-UHFFFAOYSA-N -1 1 305.692 4.183 20 0 DIADMM Cc1ccc(CN(C(=O)c2cc(Cl)ccc2[O-])C(C)C)s1 ZINC001542262083 1056113978 /nfs/dbraw/zinc/11/39/78/1056113978.db2.gz ALUXEBFIQMGZDD-UHFFFAOYSA-N -1 1 323.845 4.466 20 0 DIADMM O=C(Nc1ccc2c3c(cccc31)CC2)c1cccc([O-])c1F ZINC001542321598 1056117305 /nfs/dbraw/zinc/11/73/05/1056117305.db2.gz CDPKEYRGAGHNNI-UHFFFAOYSA-N -1 1 307.324 4.035 20 0 DIADMM CCC(C)(C)c1ccccc1C(=O)Nc1nc(Cl)ccc1[O-] ZINC001611166672 1056119876 /nfs/dbraw/zinc/11/98/76/1056119876.db2.gz MSZLHLYKIPRWHG-UHFFFAOYSA-N -1 1 318.804 4.381 20 0 DIADMM CC(C)CCN(C(=O)Cc1ccc([O-])c(Cl)c1)C1CCCC1 ZINC001542404263 1056121169 /nfs/dbraw/zinc/12/11/69/1056121169.db2.gz ADBWNOCKUONMJN-UHFFFAOYSA-N -1 1 323.864 4.405 20 0 DIADMM CC[C@@H](c1ccccc1)N(CC)C(=O)c1cccc([O-])c1F ZINC001542469528 1056124382 /nfs/dbraw/zinc/12/43/82/1056124382.db2.gz HIHVVAWVCRXNOZ-HNNXBMFYSA-N -1 1 301.361 4.145 20 0 DIADMM O=C(N[C@H](c1ccccc1)C1CCCC1)c1c([O-])cccc1F ZINC001542495147 1056127483 /nfs/dbraw/zinc/12/74/83/1056127483.db2.gz NGPJSNNDBNWONH-GOSISDBHSA-N -1 1 313.372 4.193 20 0 DIADMM CC(C)CCc1ccccc1NC(=O)c1cc(F)ccc1[O-] ZINC001583708641 1056148277 /nfs/dbraw/zinc/14/82/77/1056148277.db2.gz VKTDNLQBUQOVHB-UHFFFAOYSA-N -1 1 301.361 4.372 20 0 DIADMM O=C(Nc1ncc(C2CCCCC2)s1)c1cccc([O-])c1F ZINC001611457543 1056162809 /nfs/dbraw/zinc/16/28/09/1056162809.db2.gz XWIXUCAPDLLLEN-UHFFFAOYSA-N -1 1 320.389 4.288 20 0 DIADMM C[C@@H]1C[C@H]1c1ccc(CNC(=O)c2ccc3ccccc3c2[O-])o1 ZINC001543208715 1056188506 /nfs/dbraw/zinc/18/85/06/1056188506.db2.gz UIBNBNXFUFKJRQ-SJKOYZFVSA-N -1 1 321.376 4.192 20 0 DIADMM C[C@@H]1C[C@@H]1c1ccc(CNC(=O)c2ccc3ccccc3c2[O-])o1 ZINC001543208710 1056189056 /nfs/dbraw/zinc/18/90/56/1056189056.db2.gz UIBNBNXFUFKJRQ-PXAZEXFGSA-N -1 1 321.376 4.192 20 0 DIADMM CC(C)[C@@H](c1ccccc1)N(C)C(=O)c1cccc([O-])c1F ZINC001543317514 1056201639 /nfs/dbraw/zinc/20/16/39/1056201639.db2.gz WKWOPNDQKNXQKQ-KRWDZBQOSA-N -1 1 301.361 4.001 20 0 DIADMM Cc1ccccc1[C@@H](CC(C)C)NC(=O)c1cccc([O-])c1F ZINC001543422609 1056216020 /nfs/dbraw/zinc/21/60/20/1056216020.db2.gz NTZPZPGAEDFCIK-MRXNPFEDSA-N -1 1 315.388 4.357 20 0 DIADMM CC[C@@H](NC(=O)c1cc(F)ccc1[O-])c1cccc(Cl)c1 ZINC001543528395 1056244502 /nfs/dbraw/zinc/24/45/02/1056244502.db2.gz FJGCPGVVHQPRQP-CQSZACIVSA-N -1 1 307.752 4.066 20 0 DIADMM CN(C(=O)c1ccc(F)c([O-])c1)c1ccc(C(C)(C)C)cc1 ZINC001543567231 1056256762 /nfs/dbraw/zinc/25/67/62/1056256762.db2.gz FVJVNDVFLAXEPY-UHFFFAOYSA-N -1 1 301.361 4.105 20 0 DIADMM CC[C@@H](NC(=O)c1ccc([O-])cc1F)c1ccc(Cl)s1 ZINC001543690877 1056280534 /nfs/dbraw/zinc/28/05/34/1056280534.db2.gz FJLSENAHUBNQCJ-LLVKDONJSA-N -1 1 313.781 4.127 20 0 DIADMM CC(C)(NC(=O)c1ccc2ccccc2c1[O-])c1cccs1 ZINC001543707755 1056282473 /nfs/dbraw/zinc/28/24/73/1056282473.db2.gz QUWPWIKWVPHYLR-UHFFFAOYSA-N -1 1 311.406 4.272 20 0 DIADMM CC1(C)CC[C@H](NC(=O)c2ccc([O-])c(F)c2)c2ccccc21 ZINC001544257778 1056394192 /nfs/dbraw/zinc/39/41/92/1056394192.db2.gz MEOVPBLKCSCICP-INIZCTEOSA-N -1 1 313.372 4.074 20 0 DIADMM O=C(Nc1cc(Cl)cc(C(F)(F)F)c1)c1ccccc1[O-] ZINC000169198344 1056485180 /nfs/dbraw/zinc/48/51/80/1056485180.db2.gz DZXAAQXWCSFWLD-UHFFFAOYSA-N -1 1 315.678 4.317 20 0 DIADMM O=C(c1ncc2ccccc2c1[O-])N1CCCC[C@H]1CC1CCC1 ZINC001585375892 1056539195 /nfs/dbraw/zinc/53/91/95/1056539195.db2.gz GFSKULQRHSXNSE-INIZCTEOSA-N -1 1 324.424 4.125 20 0 DIADMM [O-]c1c(F)cc(Nc2ccc(Br)nc2)cc1Cl ZINC001214479546 1056542483 /nfs/dbraw/zinc/54/24/83/1056542483.db2.gz ABKVQYGRKVYSAD-UHFFFAOYSA-N -1 1 317.545 4.086 20 0 DIADMM CC(C)c1ccccc1[N-]S(=O)(=O)c1cccc(Cl)c1 ZINC000007056169 1056566248 /nfs/dbraw/zinc/56/62/48/1056566248.db2.gz TXBORFDMDRPLNN-UHFFFAOYSA-N -1 1 309.818 4.264 20 0 DIADMM [O-]c1c(F)cc(Nc2cc(F)nc(F)c2Cl)cc1Cl ZINC001214482859 1056571114 /nfs/dbraw/zinc/57/11/14/1056571114.db2.gz RVPGOOZHYHBJJZ-UHFFFAOYSA-N -1 1 309.074 4.255 20 0 DIADMM COC(=O)c1c(C)scc1Nc1cc(F)c([O-])c(Cl)c1 ZINC001214484914 1056582932 /nfs/dbraw/zinc/58/29/32/1056582932.db2.gz SEIHOLYXGJDNLF-UHFFFAOYSA-N -1 1 315.753 4.085 20 0 DIADMM CC1=CC[C@@](C)(C(=O)Nc2ccc(Br)c([O-])c2)CC1 ZINC001616324840 1056635349 /nfs/dbraw/zinc/63/53/49/1056635349.db2.gz NPERAZCPMJTACW-OAHLLOKOSA-N -1 1 324.218 4.230 20 0 DIADMM [O-]c1ccc(F)cc1-c1cncc(SCc2ccccc2)n1 ZINC001240695331 1056645392 /nfs/dbraw/zinc/64/53/92/1056645392.db2.gz HUNRWMRCSLEDMK-UHFFFAOYSA-N -1 1 312.369 4.281 20 0 DIADMM [O-]c1cc(Nc2cc(F)c(OC(F)F)c(F)c2)cc(F)c1F ZINC001212452180 1056672967 /nfs/dbraw/zinc/67/29/67/1056672967.db2.gz PWKFRSRXSCMELY-UHFFFAOYSA-N -1 1 323.192 4.294 20 0 DIADMM CSc1ccc([O-])c(C(=O)N(c2ccccc2)C2CCC2)c1 ZINC001586161142 1056683798 /nfs/dbraw/zinc/68/37/98/1056683798.db2.gz JSNNOZHNFNFKRF-UHFFFAOYSA-N -1 1 313.422 4.313 20 0 DIADMM C[C@@H]1CCc2c(sc3ncnc(-c4ccc([O-])c(F)c4)c23)C1 ZINC001240782196 1056695662 /nfs/dbraw/zinc/69/56/62/1056695662.db2.gz UGUMNZWDKWCLRY-SECBINFHSA-N -1 1 314.385 4.328 20 0 DIADMM [O-]c1ccc(-c2ncc(F)c(Oc3ccccc3F)n2)cc1F ZINC001240786696 1056698061 /nfs/dbraw/zinc/69/80/61/1056698061.db2.gz ZZXQQKSEVDDAQR-UHFFFAOYSA-N -1 1 318.254 4.059 20 0 DIADMM Cc1ccc(C[C@@H](C)NC(=O)c2ccc(Cl)cc2[O-])c(C)c1 ZINC001617252623 1056802317 /nfs/dbraw/zinc/80/23/17/1056802317.db2.gz IZNWCUCJEMVVIV-CYBMUJFWSA-N -1 1 317.816 4.023 20 0 DIADMM Cc1c2ccc(F)cc2sc1C(=O)Nc1c([O-])cccc1F ZINC000672901417 1056805678 /nfs/dbraw/zinc/80/56/78/1056805678.db2.gz UPGAOLZRVBXWNH-UHFFFAOYSA-N -1 1 319.332 4.446 20 0 DIADMM Cc1ccc(-c2ncc(F)c(Oc3cccc(F)c3)n2)c([O-])c1 ZINC001241035610 1056834963 /nfs/dbraw/zinc/83/49/63/1056834963.db2.gz CRCSYKKAGRAEEK-UHFFFAOYSA-N -1 1 314.291 4.228 20 0 DIADMM Cc1ccc(-c2ncc(F)c(Oc3ccccc3C)n2)c([O-])c1 ZINC001241036473 1056835898 /nfs/dbraw/zinc/83/58/98/1056835898.db2.gz YUFDIXVGSYNFDK-UHFFFAOYSA-N -1 1 310.328 4.397 20 0 DIADMM CC[C@](C)(NC(=O)c1cc(Cl)ccc1[O-])c1ccccc1 ZINC001617664146 1056866328 /nfs/dbraw/zinc/86/63/28/1056866328.db2.gz CSOZXQCWDNPGGA-KRWDZBQOSA-N -1 1 303.789 4.101 20 0 DIADMM CC(C)c1ccc2c(c1)[C@H](NC(=O)c1ccc([O-])c(F)c1)CC2 ZINC000681762429 1056879785 /nfs/dbraw/zinc/87/97/85/1056879785.db2.gz OTJCZGIAPAWBHV-QGZVFWFLSA-N -1 1 313.372 4.072 20 0 DIADMM C[C@@H]1CCC[C@H](C)CN1C(=O)c1ccc(C(F)(F)F)c([O-])c1 ZINC001617797404 1056885003 /nfs/dbraw/zinc/88/50/03/1056885003.db2.gz NEOCZJLKBLUUMY-WDEREUQCSA-N -1 1 315.335 4.062 20 0 DIADMM C[C@@H]1CCCCN1c1cccc(-c2c(F)cc([O-])cc2F)n1 ZINC001241118426 1056904215 /nfs/dbraw/zinc/90/42/15/1056904215.db2.gz DWPHAJAHLPSHHH-LLVKDONJSA-N -1 1 304.340 4.111 20 0 DIADMM CSc1nc2ccnc(-c3c(F)cc([O-])cc3F)c2s1 ZINC001241117677 1056905213 /nfs/dbraw/zinc/90/52/13/1056905213.db2.gz UYQGFECCFBYVQY-UHFFFAOYSA-N -1 1 310.350 4.064 20 0 DIADMM COc1ccc(-c2c(F)cc([O-])cc2F)c2ccc(C)nc12 ZINC001241120987 1056905966 /nfs/dbraw/zinc/90/59/66/1056905966.db2.gz WSYZTQVDRFYLRO-UHFFFAOYSA-N -1 1 301.292 4.203 20 0 DIADMM CC(C)(C)[C@@H]1CCc2nnc(-c3c(F)cc([O-])cc3F)cc2C1 ZINC001241120316 1056906361 /nfs/dbraw/zinc/90/63/61/1056906361.db2.gz ZNLAJPVVQVFMHA-LLVKDONJSA-N -1 1 318.367 4.278 20 0 DIADMM [O-]c1cc(F)c(-c2cc(F)c(OC(F)F)c(F)c2)c(F)c1 ZINC001241120607 1056906439 /nfs/dbraw/zinc/90/64/39/1056906439.db2.gz CLPUEPIZJRKHTP-UHFFFAOYSA-N -1 1 308.177 4.217 20 0 DIADMM [O-]c1cc(F)c(-c2ccc3nc(C(F)(F)F)cn3c2)c(F)c1 ZINC001241122034 1056906949 /nfs/dbraw/zinc/90/69/49/1056906949.db2.gz JJSQHAULYFLOGE-UHFFFAOYSA-N -1 1 314.213 4.004 20 0 DIADMM CSc1cnc(-c2c(F)cc([O-])cc2F)c(C(F)(F)F)c1 ZINC001241120522 1056907058 /nfs/dbraw/zinc/90/70/58/1056907058.db2.gz YNBYQQRWDXJZJE-UHFFFAOYSA-N -1 1 321.270 4.473 20 0 DIADMM [O-]c1cc(F)c(-c2ccnc(C3(C(F)(F)F)CC3)c2)c(F)c1 ZINC001241122468 1056907119 /nfs/dbraw/zinc/90/71/19/1056907119.db2.gz FRAYQXASVKCAAB-UHFFFAOYSA-N -1 1 315.241 4.326 20 0 DIADMM CC[C@@H](C)c1nc2[nH]ccc2c(-c2c(F)cc([O-])cc2F)n1 ZINC001241120141 1056907343 /nfs/dbraw/zinc/90/73/43/1056907343.db2.gz VBXZUGPAXKHGAL-MRVPVSSYSA-N -1 1 303.312 4.074 20 0 DIADMM CCOC(OCC)c1cccc(-c2c(F)cc([O-])cc2F)c1 ZINC001241121053 1056907836 /nfs/dbraw/zinc/90/78/36/1056907836.db2.gz ZWUFOAMSUBPLQW-UHFFFAOYSA-N -1 1 308.324 4.409 20 0 DIADMM COc1c(F)ccc(SC)c1-c1c(F)cc([O-])cc1F ZINC001241124227 1056908363 /nfs/dbraw/zinc/90/83/63/1056908363.db2.gz DHNADXLZTQSFCV-UHFFFAOYSA-N -1 1 300.301 4.207 20 0 DIADMM COC(=O)[C@@H](c1ccc(-c2c(F)cc([O-])cc2F)cc1)C(C)C ZINC001241123220 1056908587 /nfs/dbraw/zinc/90/85/87/1056908587.db2.gz WFFBWGNESIPGFD-MRXNPFEDSA-N -1 1 320.335 4.250 20 0 DIADMM COC(=O)c1ccc(C2CC2)c(-c2c(F)cc([O-])cc2F)c1 ZINC001241125543 1056910231 /nfs/dbraw/zinc/91/02/31/1056910231.db2.gz ZYCJDUBQSIOXLL-UHFFFAOYSA-N -1 1 304.292 4.001 20 0 DIADMM [O-]c1cc(F)c(-c2cccc(-c3ncc4ncccn43)c2)c(F)c1 ZINC001241124733 1056910295 /nfs/dbraw/zinc/91/02/95/1056910295.db2.gz LKKWXVLSZTVTLU-UHFFFAOYSA-N -1 1 323.302 4.047 20 0 DIADMM O=C([O-])c1ccc(-c2ccc3nc(C(F)(F)F)[nH]c3c2)cc1F ZINC001241185837 1056950246 /nfs/dbraw/zinc/95/02/46/1056950246.db2.gz ZTPSBANJDZXBCC-UHFFFAOYSA-N -1 1 324.233 4.086 20 0 DIADMM Cc1ccccc1[C@H](c1noc(-c2ccc(N)cc2[O-])n1)C(C)C ZINC000843233275 1056981199 /nfs/dbraw/zinc/98/11/99/1056981199.db2.gz INHMBGBFLUMBOX-QGZVFWFLSA-N -1 1 323.396 4.121 20 0 DIADMM Cc1cccc2c(-c3ccnc(-c4cc([O-])cc(F)c4)n3)c[nH]c21 ZINC001241256527 1056983109 /nfs/dbraw/zinc/98/31/09/1056983109.db2.gz XFYVNUSZZWBQGI-UHFFFAOYSA-N -1 1 319.339 4.445 20 0 DIADMM Cc1ccc(Oc2nc(-c3cc([O-])cc(F)c3)ncc2F)cc1 ZINC001241261916 1056985329 /nfs/dbraw/zinc/98/53/29/1056985329.db2.gz TUOZLGCGVCRBIF-UHFFFAOYSA-N -1 1 314.291 4.228 20 0 DIADMM CSc1nc2ccccc2c(-c2c(F)ccc([O-])c2F)n1 ZINC001241289331 1056998755 /nfs/dbraw/zinc/99/87/55/1056998755.db2.gz QPGLHPPCYRAYDE-UHFFFAOYSA-N -1 1 304.321 4.003 20 0 DIADMM COc1nc(-c2c(F)ccc([O-])c2F)cc2cc(F)ccc21 ZINC001241290685 1056998776 /nfs/dbraw/zinc/99/87/76/1056998776.db2.gz DGDIGCTVAUZWIQ-UHFFFAOYSA-N -1 1 305.255 4.033 20 0 DIADMM [O-]c1ccc(F)c(-c2ccc(SC(F)(F)F)cn2)c1F ZINC001241291417 1056999747 /nfs/dbraw/zinc/99/97/47/1056999747.db2.gz OJIPMJVXRNCIQT-UHFFFAOYSA-N -1 1 307.243 4.344 20 0 DIADMM [O-]c1ccc(F)c(-c2ncnc3sc4ccccc4c32)c1F ZINC001241291563 1056999781 /nfs/dbraw/zinc/99/97/81/1056999781.db2.gz QCKVVFOYGSBEBS-UHFFFAOYSA-N -1 1 314.316 4.495 20 0 DIADMM CC(C)(C)c1nc(-c2c(F)ccc([O-])c2F)nc(C(C)(C)C)n1 ZINC001241291911 1056999808 /nfs/dbraw/zinc/99/98/08/1056999808.db2.gz XLHRNEWIZOYIAX-UHFFFAOYSA-N -1 1 321.371 4.117 20 0 DIADMM CCCCOc1cccc(-c2ccc3[n-]c(C(=O)OC)nc3c2)c1 ZINC001241292203 1056999944 /nfs/dbraw/zinc/99/99/44/1056999944.db2.gz MUGKVACYBGQTOA-UHFFFAOYSA-N -1 1 324.380 4.195 20 0 DIADMM CCCCOc1cccc(-c2ccc3nc(C(=O)OC)[n-]c3c2)c1 ZINC001241292203 1056999949 /nfs/dbraw/zinc/99/99/49/1056999949.db2.gz MUGKVACYBGQTOA-UHFFFAOYSA-N -1 1 324.380 4.195 20 0 DIADMM [O-]c1ccc(F)c(-c2ccc(-c3ccc(F)cc3F)nn2)c1F ZINC001241290843 1057000255 /nfs/dbraw/zinc/00/02/55/1057000255.db2.gz VNPBGRONWLPOQV-UHFFFAOYSA-N -1 1 320.245 4.073 20 0 DIADMM C[C@@H]1CN(C(=O)c2cc3ccccc3cc2[O-])Cc2ccccc21 ZINC000922317665 1057005917 /nfs/dbraw/zinc/00/59/17/1057005917.db2.gz ADTSDWYWQRXGPM-CQSZACIVSA-N -1 1 317.388 4.305 20 0 DIADMM CCOC(=O)c1nc2cc(-c3cccc(SC)c3)ccc2[n-]1 ZINC001241316055 1057010590 /nfs/dbraw/zinc/01/05/90/1057010590.db2.gz XRHFWDKGYGQKSK-UHFFFAOYSA-N -1 1 312.394 4.129 20 0 DIADMM CCOC(=O)c1nc2ccc(-c3cccc(SC)c3)cc2[n-]1 ZINC001241316055 1057010592 /nfs/dbraw/zinc/01/05/92/1057010592.db2.gz XRHFWDKGYGQKSK-UHFFFAOYSA-N -1 1 312.394 4.129 20 0 DIADMM COc1cccc2c1ncnc2-c1cc(C(F)(F)F)ccc1[O-] ZINC001242131150 1057273932 /nfs/dbraw/zinc/27/39/32/1057273932.db2.gz DQEOUCSSMGALFJ-UHFFFAOYSA-N -1 1 320.270 4.030 20 0 DIADMM Cc1ccc2c(c1)ncnc2-c1cc(C(F)(F)F)ccc1[O-] ZINC001242131778 1057274646 /nfs/dbraw/zinc/27/46/46/1057274646.db2.gz PDYZEECAIOCPOZ-UHFFFAOYSA-N -1 1 304.271 4.330 20 0 DIADMM [O-]c1ccc(C(F)(F)F)cc1-c1cc(OC(F)(F)F)ccn1 ZINC001242133082 1057274669 /nfs/dbraw/zinc/27/46/69/1057274669.db2.gz FDEAJIISJYKGAT-UHFFFAOYSA-N -1 1 323.192 4.372 20 0 DIADMM Cc1nc2c(c(-c3cc(C(F)(F)F)ccc3[O-])n1)CCCC2 ZINC001242132261 1057274688 /nfs/dbraw/zinc/27/46/88/1057274688.db2.gz OYZBQPZDOFCKIB-UHFFFAOYSA-N -1 1 308.303 4.055 20 0 DIADMM [O-]c1ccc(C(F)(F)F)cc1-c1ncnc2c1CCCCC2 ZINC001242134283 1057274922 /nfs/dbraw/zinc/27/49/22/1057274922.db2.gz WSWSAMKCXQZPAM-UHFFFAOYSA-N -1 1 308.303 4.137 20 0 DIADMM [O-]c1ccc(-c2ncccc2OC(F)F)cc1C(F)(F)F ZINC001242151404 1057280804 /nfs/dbraw/zinc/28/08/04/1057280804.db2.gz MHXBVQIWPXNZHX-UHFFFAOYSA-N -1 1 305.202 4.074 20 0 DIADMM Cc1cccc2c1ncnc2-c1ccc([O-])c(C(F)(F)F)c1 ZINC001242151221 1057281071 /nfs/dbraw/zinc/28/10/71/1057281071.db2.gz HTPWCCPIUABTLK-UHFFFAOYSA-N -1 1 304.271 4.330 20 0 DIADMM Cc1nnc(-c2ccc([O-])c(C(F)(F)F)c2)c2ccccc12 ZINC001242153494 1057282018 /nfs/dbraw/zinc/28/20/18/1057282018.db2.gz YXOMQIJYMLSHCR-UHFFFAOYSA-N -1 1 304.271 4.330 20 0 DIADMM [O-]c1ccc(-c2ncccc2C2CCOCC2)cc1C(F)(F)F ZINC001242157690 1057283209 /nfs/dbraw/zinc/28/32/09/1057283209.db2.gz LGUVBHWYXYWYLM-UHFFFAOYSA-N -1 1 323.314 4.367 20 0 DIADMM COC(=O)c1ccc(F)c(-c2ccc([O-])c(C(F)(F)F)c2)c1 ZINC001242157160 1057283447 /nfs/dbraw/zinc/28/34/47/1057283447.db2.gz CTBPOBXZDUZLSA-UHFFFAOYSA-N -1 1 314.234 4.004 20 0 DIADMM Cc1cc(-c2ccc([O-])c(C(F)(F)F)c2)nc(C(C)(C)C)n1 ZINC001242158242 1057283463 /nfs/dbraw/zinc/28/34/63/1057283463.db2.gz ULHMHYXHMDQCPP-UHFFFAOYSA-N -1 1 310.319 4.474 20 0 DIADMM Cc1ncc(-c2ccc([O-])c(C(F)(F)F)c2)c(C(F)(F)F)n1 ZINC001242168875 1057285261 /nfs/dbraw/zinc/28/52/61/1057285261.db2.gz WFFZKGBFSHQCTP-UHFFFAOYSA-N -1 1 322.208 4.195 20 0 DIADMM Cc1cccc(-c2ncc(F)c(Oc3cccc(F)c3)n2)c1[O-] ZINC001242345475 1057340155 /nfs/dbraw/zinc/34/01/55/1057340155.db2.gz SHIVUOLUSQQWAV-UHFFFAOYSA-N -1 1 314.291 4.228 20 0 DIADMM Cc1cccc(-c2ccc([C@H](C)[N-]C(=O)C(F)(F)F)cc2)c1O ZINC001242348088 1057341371 /nfs/dbraw/zinc/34/13/71/1057341371.db2.gz KGWBEHADISKEJY-NSHDSACASA-N -1 1 323.314 4.107 20 0 DIADMM [O-]c1c(F)cccc1-c1ccc(O[C@@H]2CCCCO2)cc1F ZINC001242352993 1057343059 /nfs/dbraw/zinc/34/30/59/1057343059.db2.gz JULJAMUSWIIVPM-MRXNPFEDSA-N -1 1 306.308 4.243 20 0 DIADMM Cc1cc(-c2cccc(Cl)c2[O-])cnc1C(=O)OC(C)(C)C ZINC001242365826 1057347518 /nfs/dbraw/zinc/34/75/18/1057347518.db2.gz KVMXZDLHUVDGME-UHFFFAOYSA-N -1 1 319.788 4.371 20 0 DIADMM CCOC(=O)c1c[nH]c2c1cccc2-c1cccc(Cl)c1[O-] ZINC001242365483 1057347936 /nfs/dbraw/zinc/34/79/36/1057347936.db2.gz DUPWMFWASKEYRT-UHFFFAOYSA-N -1 1 315.756 4.371 20 0 DIADMM CC1(C)Cc2c(cccc2-c2cccc(Cl)c2[O-])NC1=O ZINC001242368045 1057348282 /nfs/dbraw/zinc/34/82/82/1057348282.db2.gz UHBVXFAZEQLSEA-UHFFFAOYSA-N -1 1 301.773 4.233 20 0 DIADMM COC(=O)c1cnc2cc(-c3cccc(Cl)c3[O-])ccc2c1 ZINC001242367775 1057348457 /nfs/dbraw/zinc/34/84/57/1057348457.db2.gz RYMQIOFIHANRBZ-UHFFFAOYSA-N -1 1 313.740 4.047 20 0 DIADMM [O-]c1c(Cl)cccc1-c1ccnc(OCc2ccncc2)c1 ZINC001242367471 1057348697 /nfs/dbraw/zinc/34/86/97/1057348697.db2.gz MWZQTEQFIHCDSL-UHFFFAOYSA-N -1 1 312.756 4.082 20 0 DIADMM CC1(C)Cc2cc(-c3cccc(Cl)c3[O-])ccc2NC1=O ZINC001242367327 1057348879 /nfs/dbraw/zinc/34/88/79/1057348879.db2.gz KMGNJAOHOCBFPY-UHFFFAOYSA-N -1 1 301.773 4.233 20 0 DIADMM CCOC(=O)c1noc2ccc(-c3cccc(Cl)c3[O-])cc21 ZINC001242368163 1057349001 /nfs/dbraw/zinc/34/90/01/1057349001.db2.gz ZKXZSBOPJDIRBI-UHFFFAOYSA-N -1 1 317.728 4.031 20 0 DIADMM O=[P@@]([O-])(O)c1ccc(-c2ccc3oc4ccccc4c3c2)cc1 ZINC001242641916 1057433547 /nfs/dbraw/zinc/43/35/47/1057433547.db2.gz PRAQHWKMJORXKS-UHFFFAOYSA-N -1 1 324.272 4.056 20 0 DIADMM O=[P@]([O-])(O)c1ccc(-c2ccc3oc4ccccc4c3c2)cc1 ZINC001242641916 1057433549 /nfs/dbraw/zinc/43/35/49/1057433549.db2.gz PRAQHWKMJORXKS-UHFFFAOYSA-N -1 1 324.272 4.056 20 0 DIADMM CSc1nc2ccsc2c(-c2cccc([O-])c2Cl)n1 ZINC001242797958 1057480229 /nfs/dbraw/zinc/48/02/29/1057480229.db2.gz PKJFQYOFNFQGCH-UHFFFAOYSA-N -1 1 308.815 4.439 20 0 DIADMM CSc1nc2ccccc2c(-c2cccc([O-])c2Cl)n1 ZINC001242799912 1057481144 /nfs/dbraw/zinc/48/11/44/1057481144.db2.gz AGNDPSUYEYMTMV-UHFFFAOYSA-N -1 1 302.786 4.378 20 0 DIADMM COc1nc(-c2cccc([O-])c2Cl)cc2cc(F)ccc21 ZINC001242799385 1057481186 /nfs/dbraw/zinc/48/11/86/1057481186.db2.gz ILENXBFOAYRHGU-UHFFFAOYSA-N -1 1 303.720 4.409 20 0 DIADMM Cc1noc(-c2ccc(-c3cccc([O-])c3Cl)cc2F)n1 ZINC001242801301 1057481687 /nfs/dbraw/zinc/48/16/87/1057481687.db2.gz XHADAPMLZXDBIA-UHFFFAOYSA-N -1 1 304.708 4.210 20 0 DIADMM CC(C)(C)OC(=O)c1cccc(-c2cccc([O-])c2Cl)n1 ZINC001242800196 1057481892 /nfs/dbraw/zinc/48/18/92/1057481892.db2.gz FERPDVWCQDSMGN-UHFFFAOYSA-N -1 1 305.761 4.063 20 0 DIADMM Cc1nc(C(F)(F)F)nc(-c2cccc([O-])c2Cl)c1C ZINC001242801546 1057481923 /nfs/dbraw/zinc/48/19/23/1057481923.db2.gz VPIIREFSLRFDNY-UHFFFAOYSA-N -1 1 302.683 4.138 20 0 DIADMM COc1ccc(-c2ccc(-c3cccc([O-])c3Cl)nn2)cc1 ZINC001242801700 1057481938 /nfs/dbraw/zinc/48/19/38/1057481938.db2.gz VXUFIYSDDDUGJE-UHFFFAOYSA-N -1 1 312.756 4.178 20 0 DIADMM CCOC(=O)c1cc2cccc(-c3cccc([O-])c3Cl)c2[nH]1 ZINC001242801056 1057482181 /nfs/dbraw/zinc/48/21/81/1057482181.db2.gz XCLAFBOLCKZUEI-UHFFFAOYSA-N -1 1 315.756 4.371 20 0 DIADMM COC(=O)c1ccc2cc(-c3cccc([O-])c3Cl)ncc2c1 ZINC001242801446 1057482428 /nfs/dbraw/zinc/48/24/28/1057482428.db2.gz SEHJTZQAQOEZSR-UHFFFAOYSA-N -1 1 313.740 4.047 20 0 DIADMM CC1(C)NC(=O)Nc2c(-c3cccc([O-])c3Cl)cccc21 ZINC001242802303 1057482899 /nfs/dbraw/zinc/48/28/99/1057482899.db2.gz WAINKQSCYWDYKH-UHFFFAOYSA-N -1 1 302.761 4.083 20 0 DIADMM COc1ncc(C(F)(F)F)cc1-c1cccc([O-])c1Cl ZINC001242802408 1057483060 /nfs/dbraw/zinc/48/30/60/1057483060.db2.gz FXOMRYVEYQHLCX-UHFFFAOYSA-N -1 1 303.667 4.135 20 0 DIADMM [O-]c1cccc(-c2cccc(-c3ncc4ncccn43)c2)c1Cl ZINC001242803635 1057483150 /nfs/dbraw/zinc/48/31/50/1057483150.db2.gz VTGXNUAYMADHLC-UHFFFAOYSA-N -1 1 321.767 4.422 20 0 DIADMM [O-]c1cccc(-c2ccc(C3N=NC(=S)O3)cc2)c1Cl ZINC001242803216 1057483182 /nfs/dbraw/zinc/48/31/82/1057483182.db2.gz VUKZIHZXAOFMGH-UHFFFAOYSA-N -1 1 304.758 4.051 20 0 DIADMM CCOC(=O)CCc1ccc(-c2cccc([O-])c2Cl)c(F)c1 ZINC001242802422 1057483307 /nfs/dbraw/zinc/48/33/07/1057483307.db2.gz GNPKQBGNEYVWCD-UHFFFAOYSA-N -1 1 322.763 4.347 20 0 DIADMM Cc1noc(-c2ccc(-c3cccc([O-])c3Cl)cc2)c1N ZINC001242802755 1057483349 /nfs/dbraw/zinc/48/33/49/1057483349.db2.gz PHTVVFVNWUEJTP-UHFFFAOYSA-N -1 1 300.745 4.258 20 0 DIADMM Cc1ccccc1-c1nc2c(ncnc2-c2ccc(F)c([O-])c2)o1 ZINC001243046174 1057556937 /nfs/dbraw/zinc/55/69/37/1057556937.db2.gz BVLLUIABGGMVNV-UHFFFAOYSA-N -1 1 321.311 4.105 20 0 DIADMM Cc1ccc(-c2ccc([C@H](C)[N-]C(=O)C(F)(F)F)cc2)cc1O ZINC001243233032 1057615391 /nfs/dbraw/zinc/61/53/91/1057615391.db2.gz MCCJQJRJBFSNDI-NSHDSACASA-N -1 1 323.314 4.107 20 0 DIADMM Cc1ccc2c(F)c(F)cc(-c3ccc([O-])c(F)c3F)c2n1 ZINC001243342222 1057652698 /nfs/dbraw/zinc/65/26/98/1057652698.db2.gz GAMMGXKQCLIANJ-UHFFFAOYSA-N -1 1 307.246 4.472 20 0 DIADMM [O-]c1ccc(-c2cncc(-c3nc4ccccc4[nH]3)c2)c(F)c1F ZINC001243342876 1057652745 /nfs/dbraw/zinc/65/27/45/1057652745.db2.gz NTYVOAVZKQCBIV-UHFFFAOYSA-N -1 1 323.302 4.276 20 0 DIADMM [O-]c1ccc(-c2cccnc2OCc2ccccc2)c(F)c1F ZINC001243342991 1057652832 /nfs/dbraw/zinc/65/28/32/1057652832.db2.gz UDLQKNXWPIMQBO-UHFFFAOYSA-N -1 1 313.303 4.311 20 0 DIADMM [O-]c1ccc(-c2ccc3nc(C(F)(F)F)[nH]c3c2)c(F)c1F ZINC001243342761 1057652871 /nfs/dbraw/zinc/65/28/71/1057652871.db2.gz SOUMJQBAHPCKJO-UHFFFAOYSA-N -1 1 314.213 4.233 20 0 DIADMM [O-]c1ccc(-c2ccc3[nH]c(C(F)(F)F)nc3c2)c(F)c1F ZINC001243342761 1057652875 /nfs/dbraw/zinc/65/28/75/1057652875.db2.gz SOUMJQBAHPCKJO-UHFFFAOYSA-N -1 1 314.213 4.233 20 0 DIADMM COc1ccc(-c2ccc([O-])c(F)c2F)cc1C(F)(F)F ZINC001243342415 1057652949 /nfs/dbraw/zinc/65/29/49/1057652949.db2.gz MWUCUUXUPNEUNF-UHFFFAOYSA-N -1 1 304.214 4.365 20 0 DIADMM COc1ccc(-c2cccnc2)cc1-c1ccc([O-])c(F)c1F ZINC001243342381 1057653020 /nfs/dbraw/zinc/65/30/20/1057653020.db2.gz IEOIJEVHVFGIFJ-UHFFFAOYSA-N -1 1 313.303 4.408 20 0 DIADMM [O-]c1c(F)cc(F)cc1-c1cccc(-c2ncc3ncccn32)c1 ZINC001243505109 1057697767 /nfs/dbraw/zinc/69/77/67/1057697767.db2.gz CRVWJNFCRMJOAC-UHFFFAOYSA-N -1 1 323.302 4.047 20 0 DIADMM CCOC(=O)CCCc1ccc(-c2cc(F)cc(F)c2[O-])cc1 ZINC001243506101 1057697773 /nfs/dbraw/zinc/69/77/73/1057697773.db2.gz XAHZVCORLQMYBC-UHFFFAOYSA-N -1 1 320.335 4.223 20 0 DIADMM CC(C)(C)OC(=O)c1ccc(F)cc1-c1cc(F)cc(F)c1[O-] ZINC001243506372 1057697824 /nfs/dbraw/zinc/69/78/24/1057697824.db2.gz UJZUZYCRKYLIEF-UHFFFAOYSA-N -1 1 324.298 4.432 20 0 DIADMM CC[C@H](C(=O)OC)c1ccc(-c2cc(F)cc(F)c2[O-])cc1 ZINC001243506268 1057697829 /nfs/dbraw/zinc/69/78/29/1057697829.db2.gz RQPFPBNMGOBKLG-ZDUSSCGKSA-N -1 1 306.308 4.004 20 0 DIADMM COc1ccc(-c2ccccn2)cc1-c1cc(F)cc(F)c1[O-] ZINC001243505551 1057697924 /nfs/dbraw/zinc/69/79/24/1057697924.db2.gz UCMFUVOEXUBFAI-UHFFFAOYSA-N -1 1 313.303 4.408 20 0 DIADMM [O-]c1cccc(-c2ncc(F)c(Oc3cccc(F)c3)n2)c1F ZINC001243546449 1057709485 /nfs/dbraw/zinc/70/94/85/1057709485.db2.gz NGYIGNKCECDPAS-UHFFFAOYSA-N -1 1 318.254 4.059 20 0 DIADMM COc1cccc(-c2ccnc(-c3ccc(Cl)c([O-])c3)n2)c1 ZINC001243576399 1057720984 /nfs/dbraw/zinc/72/09/84/1057720984.db2.gz NLWTZZZMUBKNIF-UHFFFAOYSA-N -1 1 312.756 4.178 20 0 DIADMM [O-]c1cc(-c2cncc(OCc3ccccc3)n2)ccc1Cl ZINC001243577435 1057721441 /nfs/dbraw/zinc/72/14/41/1057721441.db2.gz ZSJWMFWWIGILFO-UHFFFAOYSA-N -1 1 312.756 4.082 20 0 DIADMM COc1cc2cnc(-c3ccc(Cl)c([O-])c3)cc2cc1OC ZINC001243578713 1057722146 /nfs/dbraw/zinc/72/21/46/1057722146.db2.gz JBEGREJXFLCJSH-UHFFFAOYSA-N -1 1 315.756 4.278 20 0 DIADMM CC[C@@H](C)c1nc2[nH]ccc2c(-c2ccc(Cl)c([O-])c2)n1 ZINC001243579412 1057722320 /nfs/dbraw/zinc/72/23/20/1057722320.db2.gz UBTFODXFMCWBHC-SECBINFHSA-N -1 1 301.777 4.449 20 0 DIADMM Cc1nc(-c2ccncc2)nc(-c2ccc(Cl)c([O-])c2)c1C ZINC001243579895 1057722352 /nfs/dbraw/zinc/72/23/52/1057722352.db2.gz WWAIITDAQQMRCF-UHFFFAOYSA-N -1 1 311.772 4.181 20 0 DIADMM CC1(C)Cc2c(cccc2-c2ccc(Cl)c([O-])c2)NC1=O ZINC001243582358 1057723805 /nfs/dbraw/zinc/72/38/05/1057723805.db2.gz QDOAKJIJDJFJSC-UHFFFAOYSA-N -1 1 301.773 4.233 20 0 DIADMM CCOC(=O)CCc1cccc(-c2ccc(Cl)c([O-])c2)c1 ZINC001243584729 1057724528 /nfs/dbraw/zinc/72/45/28/1057724528.db2.gz YSMNYFRBIKNMGP-UHFFFAOYSA-N -1 1 304.773 4.208 20 0 DIADMM Cc1noc(-c2ccc(-c3ccc(Cl)c([O-])c3)cc2)c1N ZINC001243584136 1057724838 /nfs/dbraw/zinc/72/48/38/1057724838.db2.gz RHZVUZKJUFLKBZ-UHFFFAOYSA-N -1 1 300.745 4.258 20 0 DIADMM [O-]c1cc(C(F)(F)F)ccc1-c1ncccc1C(F)(F)F ZINC001243604574 1057730488 /nfs/dbraw/zinc/73/04/88/1057730488.db2.gz LSAJQFGZXODCBV-UHFFFAOYSA-N -1 1 307.193 4.492 20 0 DIADMM [O-]c1cc(C(F)(F)F)ccc1-c1ncnc2cc(F)ccc21 ZINC001243608496 1057731615 /nfs/dbraw/zinc/73/16/15/1057731615.db2.gz JUOZLDMYIHBLPX-UHFFFAOYSA-N -1 1 308.234 4.160 20 0 DIADMM [O-]c1cc(C(F)(F)F)ccc1-c1ncnc2ccc(F)cc21 ZINC001243609868 1057732090 /nfs/dbraw/zinc/73/20/90/1057732090.db2.gz VSQLRUPNFWAGIP-UHFFFAOYSA-N -1 1 308.234 4.160 20 0 DIADMM CC(C)COc1cccc(C(=O)Nc2ccc([O-])c(Cl)c2)c1 ZINC000732306633 1057772043 /nfs/dbraw/zinc/77/20/43/1057772043.db2.gz JJLZQTGQOCYPAR-UHFFFAOYSA-N -1 1 319.788 4.333 20 0 DIADMM O=C(/C=C\Sc1ccccc1)Nc1ccc([O-])c(Cl)c1 ZINC000732309279 1057772175 /nfs/dbraw/zinc/77/21/75/1057772175.db2.gz NMDXEUSCIKCHOW-HJWRWDBZSA-N -1 1 305.786 4.290 20 0 DIADMM C[C@@H]1CCCCN1c1cccc(-c2c([O-])cccc2Cl)n1 ZINC001244036050 1057845210 /nfs/dbraw/zinc/84/52/10/1057845210.db2.gz HYQUVTTUNFAYDS-GFCCVEGCSA-N -1 1 302.805 4.486 20 0 DIADMM CCOc1ccc(-c2ccc3[n-]c(C(=O)OC)nc3c2)c(C)c1C ZINC001244060597 1057854295 /nfs/dbraw/zinc/85/42/95/1057854295.db2.gz VPPZWOIULLKRPU-UHFFFAOYSA-N -1 1 324.380 4.032 20 0 DIADMM CCOc1ccc(-c2ccc3nc(C(=O)OC)[n-]c3c2)c(C)c1C ZINC001244060597 1057854297 /nfs/dbraw/zinc/85/42/97/1057854297.db2.gz VPPZWOIULLKRPU-UHFFFAOYSA-N -1 1 324.380 4.032 20 0 DIADMM CC[C@H](C(=O)OC)c1ccc(-c2cc(F)c([O-])c(F)c2)cc1 ZINC001244097309 1057867636 /nfs/dbraw/zinc/86/76/36/1057867636.db2.gz OONJPFWSDQVIMV-ZDUSSCGKSA-N -1 1 306.308 4.004 20 0 DIADMM COc1ccc(-c2cc(F)c([O-])c(F)c2)c2ccc(C)nc12 ZINC001244096242 1057867955 /nfs/dbraw/zinc/86/79/55/1057867955.db2.gz GNLUEXZKFGIKEL-UHFFFAOYSA-N -1 1 301.292 4.203 20 0 DIADMM COC(=O)c1nc2cc(-c3cccc(OCC(C)C)c3)ccc2[n-]1 ZINC001244192554 1057896785 /nfs/dbraw/zinc/89/67/85/1057896785.db2.gz OPLFMJMJWYLILJ-UHFFFAOYSA-N -1 1 324.380 4.051 20 0 DIADMM COC(=O)c1nc2ccc(-c3cccc(OCC(C)C)c3)cc2[n-]1 ZINC001244192554 1057896788 /nfs/dbraw/zinc/89/67/88/1057896788.db2.gz OPLFMJMJWYLILJ-UHFFFAOYSA-N -1 1 324.380 4.051 20 0 DIADMM Cc1ccc(-c2ccc(-c3ccc([P@@](=O)([O-])O)cc3)cc2)cc1 ZINC001244296668 1057925432 /nfs/dbraw/zinc/92/54/32/1057925432.db2.gz CIFPRXLEDGIGEI-UHFFFAOYSA-N -1 1 324.316 4.132 20 0 DIADMM Cc1ccc(-c2ccc(-c3ccc([P@](=O)([O-])O)cc3)cc2)cc1 ZINC001244296668 1057925434 /nfs/dbraw/zinc/92/54/34/1057925434.db2.gz CIFPRXLEDGIGEI-UHFFFAOYSA-N -1 1 324.316 4.132 20 0 DIADMM Cc1ccc([O-])c(-c2nccc(SCc3ccccc3)n2)c1 ZINC001244403568 1057951929 /nfs/dbraw/zinc/95/19/29/1057951929.db2.gz USZOALPLIXZCDU-UHFFFAOYSA-N -1 1 308.406 4.450 20 0 DIADMM [O-]c1ccc(OC(F)(F)F)cc1-c1ncnc2cccc(F)c21 ZINC001244456922 1057963251 /nfs/dbraw/zinc/96/32/51/1057963251.db2.gz KDYCPIIWWAEWSP-UHFFFAOYSA-N -1 1 324.233 4.040 20 0 DIADMM CSc1ccnc(-c2ccc(OC(F)(F)F)cc2[O-])c1 ZINC001244462931 1057965560 /nfs/dbraw/zinc/96/55/60/1057965560.db2.gz PXQQPOGEKQMHIW-UHFFFAOYSA-N -1 1 301.289 4.075 20 0 DIADMM CC(C)Oc1ccc(-c2ccc(OC(F)(F)F)cc2[O-])nc1 ZINC001244463286 1057965649 /nfs/dbraw/zinc/96/56/49/1057965649.db2.gz DYVXHBBDDIMLIV-UHFFFAOYSA-N -1 1 313.275 4.140 20 0 DIADMM [O-]c1cc(OC(F)(F)F)ccc1-c1cnc2ccc(F)cc2n1 ZINC001244464607 1057965862 /nfs/dbraw/zinc/96/58/62/1057965862.db2.gz UVMVCPFKZLCAPZ-UHFFFAOYSA-N -1 1 324.233 4.040 20 0 DIADMM CSCc1ccnc(-c2ccc(OC(F)(F)F)cc2[O-])c1 ZINC001244464054 1057966048 /nfs/dbraw/zinc/96/60/48/1057966048.db2.gz GHARLDKBQZLQDV-UHFFFAOYSA-N -1 1 315.316 4.216 20 0 DIADMM Cc1c[nH]c2nc(-c3ccc(OC(F)(F)F)cc3[O-])ccc12 ZINC001244464562 1057966105 /nfs/dbraw/zinc/96/61/05/1057966105.db2.gz SBNUBWFEORCUGL-UHFFFAOYSA-N -1 1 308.259 4.143 20 0 DIADMM [O-]c1cc(OC(F)(F)F)ccc1-c1ccc(C(F)F)cn1 ZINC001244464404 1057966380 /nfs/dbraw/zinc/96/63/80/1057966380.db2.gz UHBXFJTVDOIAEW-UHFFFAOYSA-N -1 1 305.202 4.290 20 0 DIADMM CC(C)Oc1cccc(-c2ccc(OC(F)(F)F)cc2[O-])n1 ZINC001244465606 1057966908 /nfs/dbraw/zinc/96/69/08/1057966908.db2.gz ZNOKPZRHWGAJCX-UHFFFAOYSA-N -1 1 313.275 4.140 20 0 DIADMM O=C([O-])c1cc(Cl)c(-c2cccc3cncn32)c(Cl)c1 ZINC001244518006 1057983909 /nfs/dbraw/zinc/98/39/09/1057983909.db2.gz GKBUXKJKMWERPV-UHFFFAOYSA-N -1 1 307.136 4.006 20 0 DIADMM COc1ccc2nc(C)nc(-c3c(Cl)ccc([O-])c3F)c2c1 ZINC001244537532 1057988807 /nfs/dbraw/zinc/98/88/07/1057988807.db2.gz AFUIANMAERUDAM-UHFFFAOYSA-N -1 1 318.735 4.112 20 0 DIADMM CSc1nc2ncnc(-c3cc(C)c([O-])c(Cl)c3)c2s1 ZINC001244536318 1057988856 /nfs/dbraw/zinc/98/88/56/1057988856.db2.gz IXNUGCWDQUSQPU-UHFFFAOYSA-N -1 1 323.830 4.143 20 0 DIADMM [O-]c1ccc(Cl)c(-c2ncc(C(F)(F)F)cc2F)c1F ZINC001244537411 1057988867 /nfs/dbraw/zinc/98/88/67/1057988867.db2.gz DSXFJEXZKZGIBE-UHFFFAOYSA-N -1 1 309.621 4.405 20 0 DIADMM CCCSc1ncnc(-c2cc(C)c([O-])c(Cl)c2)c1OC ZINC001244539244 1057990004 /nfs/dbraw/zinc/99/00/04/1057990004.db2.gz SANNOTYMIQIRIR-UHFFFAOYSA-N -1 1 324.833 4.322 20 0 DIADMM Cc1cc(-c2nc(C3CC3)nc3c2CCC3)cc(Cl)c1[O-] ZINC001244538258 1057990021 /nfs/dbraw/zinc/99/00/21/1057990021.db2.gz LECVKBDPSDVNLB-UHFFFAOYSA-N -1 1 300.789 4.177 20 0 DIADMM Cc1cc(C)c2ccc(-c3c(Cl)ccc([O-])c3F)nc2n1 ZINC001244539955 1057990329 /nfs/dbraw/zinc/99/03/29/1057990329.db2.gz BBFIQAFYIZHXFB-UHFFFAOYSA-N -1 1 302.736 4.412 20 0 DIADMM [O-]c1ccc(Cl)c(-c2cc(-c3ccc(F)cc3)ncn2)c1F ZINC001244540074 1057990411 /nfs/dbraw/zinc/99/04/11/1057990411.db2.gz GTCBVHDNRAPTGH-UHFFFAOYSA-N -1 1 318.710 4.448 20 0 DIADMM CC(C)(C)OC(=O)c1cccnc1-c1c(Cl)ccc([O-])c1F ZINC001244539361 1057990477 /nfs/dbraw/zinc/99/04/77/1057990477.db2.gz XTPJDALFHUZWDM-UHFFFAOYSA-N -1 1 323.751 4.202 20 0 DIADMM COC(=O)[C@@H](C)c1cccc(-c2c(Cl)ccc([O-])c2F)c1 ZINC001244540648 1057990576 /nfs/dbraw/zinc/99/05/76/1057990576.db2.gz FJSMXHXYOORVHD-VIFPVBQESA-N -1 1 308.736 4.128 20 0 DIADMM [O-]c1ccc(Cl)c(-c2ccc(COCC3CC3)cn2)c1F ZINC001244539950 1057990668 /nfs/dbraw/zinc/99/06/68/1057990668.db2.gz AWEQDQFTMJVATN-UHFFFAOYSA-N -1 1 307.752 4.173 20 0 DIADMM O=C(c1ccccc1-c1c(Cl)ccc([O-])c1F)N1CCCC1 ZINC001244540426 1057990757 /nfs/dbraw/zinc/99/07/57/1057990757.db2.gz UUWHVBDHRMENDZ-UHFFFAOYSA-N -1 1 319.763 4.088 20 0 DIADMM COc1ccc(-c2c(Cl)ccc([O-])c2F)c2ccncc12 ZINC001244540266 1057990892 /nfs/dbraw/zinc/99/08/92/1057990892.db2.gz BKXKEASTQOBDCZ-UHFFFAOYSA-N -1 1 303.720 4.409 20 0 DIADMM [O-]c1ccc(Cl)c(-c2ccnc(-c3ccccn3)c2)c1F ZINC001244541918 1057991094 /nfs/dbraw/zinc/99/10/94/1057991094.db2.gz JRBGTQLPSDYMMM-UHFFFAOYSA-N -1 1 300.720 4.309 20 0 DIADMM CCOC(=O)c1c(F)cccc1-c1c(Cl)ccc([O-])c1F ZINC001244541561 1057991134 /nfs/dbraw/zinc/99/11/34/1057991134.db2.gz CPRFOBICFRYHOU-UHFFFAOYSA-N -1 1 312.699 4.168 20 0 DIADMM CC1(C)C(=O)Nc2cc(F)c(-c3c(Cl)ccc([O-])c3F)cc21 ZINC001244541841 1057991165 /nfs/dbraw/zinc/99/11/65/1057991165.db2.gz IDKIHNZUEGBEJQ-UHFFFAOYSA-N -1 1 323.726 4.221 20 0 DIADMM CSc1nc(-c2c(Cl)ccc([O-])c2F)cc(C(F)F)n1 ZINC001244540879 1057991320 /nfs/dbraw/zinc/99/13/20/1057991320.db2.gz UDCQLKBECVPNQO-UHFFFAOYSA-N -1 1 320.723 4.301 20 0 DIADMM COC(=O)c1c[nH]c2ccc(-c3c(Cl)ccc([O-])c3F)cc21 ZINC001244540938 1057991423 /nfs/dbraw/zinc/99/14/23/1057991423.db2.gz KJTHFKDCQWBJSE-UHFFFAOYSA-N -1 1 319.719 4.120 20 0 DIADMM COc1ncc(-c2c(Cl)ccc([O-])c2F)cc1C(F)F ZINC001244541145 1057991631 /nfs/dbraw/zinc/99/16/31/1057991631.db2.gz NZWOTMSEHWNVMK-UHFFFAOYSA-N -1 1 303.667 4.193 20 0 DIADMM COC(=O)c1cc(F)c(C)c(-c2c(Cl)ccc([O-])c2F)c1 ZINC001244541328 1057991688 /nfs/dbraw/zinc/99/16/88/1057991688.db2.gz BCQNUFDXUSOBOX-UHFFFAOYSA-N -1 1 312.699 4.086 20 0 DIADMM COC(=O)c1c(C)cc(-c2c(Cl)ccc([O-])c2F)cc1F ZINC001244542540 1057991958 /nfs/dbraw/zinc/99/19/58/1057991958.db2.gz MPTASLBHMDVLLY-UHFFFAOYSA-N -1 1 312.699 4.086 20 0 DIADMM COC(=O)c1c[nH]c2c1cccc2-c1c(Cl)ccc([O-])c1F ZINC001244542604 1057992110 /nfs/dbraw/zinc/99/21/10/1057992110.db2.gz NZYXKIRJTHTAFZ-UHFFFAOYSA-N -1 1 319.719 4.120 20 0 DIADMM COC(=O)c1cc2cccc(-c3c(Cl)ccc([O-])c3F)c2[nH]1 ZINC001244542483 1057992394 /nfs/dbraw/zinc/99/23/94/1057992394.db2.gz YCYXRJHSMRIOLF-UHFFFAOYSA-N -1 1 319.719 4.120 20 0 DIADMM COC(=O)c1cc(F)c(-c2cc(C)c([O-])c(Cl)c2)cc1F ZINC001244550359 1057993792 /nfs/dbraw/zinc/99/37/92/1057993792.db2.gz BXVFWZAPIHOBBM-UHFFFAOYSA-N -1 1 312.699 4.086 20 0 DIADMM Cc1c(O)cccc1-c1ccc([C@H](C)[N-]C(=O)C(F)(F)F)cc1 ZINC001244960694 1058081463 /nfs/dbraw/zinc/08/14/63/1058081463.db2.gz LCCOJIZZRTWBGN-NSHDSACASA-N -1 1 323.314 4.107 20 0 DIADMM O=C([O-])c1cc(-c2ccc3cncn3c2)c(Cl)cc1Cl ZINC001245001458 1058089790 /nfs/dbraw/zinc/08/97/90/1058089790.db2.gz MGKBPWWZSSPRRX-UHFFFAOYSA-N -1 1 307.136 4.006 20 0 DIADMM [O-]c1ccc(Cl)cc1-c1cccc(OCC(F)(F)F)n1 ZINC001245047946 1058101906 /nfs/dbraw/zinc/10/19/06/1058101906.db2.gz FDCUFMNAMHRXJE-UHFFFAOYSA-N -1 1 303.667 4.049 20 0 DIADMM [O-]c1ccc(Cl)cc1-c1cc(OCC(F)(F)F)ccn1 ZINC001245049538 1058102398 /nfs/dbraw/zinc/10/23/98/1058102398.db2.gz QLWXNDYOBSXHGC-UHFFFAOYSA-N -1 1 303.667 4.049 20 0 DIADMM [O-]c1ccc(Cl)cc1-c1cc(-c2ccc(F)cc2)ncn1 ZINC001245048932 1058102790 /nfs/dbraw/zinc/10/27/90/1058102790.db2.gz CGLCQFXSQCYSRZ-UHFFFAOYSA-N -1 1 300.720 4.309 20 0 DIADMM COC(=O)c1nc2cc(-c3c(C)cc(F)cc3Cl)ccc2[n-]1 ZINC001245059816 1058104739 /nfs/dbraw/zinc/10/47/39/1058104739.db2.gz OZMSEMOXDGXVQE-UHFFFAOYSA-N -1 1 318.735 4.117 20 0 DIADMM COC(=O)c1nc2ccc(-c3c(C)cc(F)cc3Cl)cc2[n-]1 ZINC001245059816 1058104740 /nfs/dbraw/zinc/10/47/40/1058104740.db2.gz OZMSEMOXDGXVQE-UHFFFAOYSA-N -1 1 318.735 4.117 20 0 DIADMM CC(C)CC1(CNC(=O)c2c([O-])cccc2Cl)CCCC1 ZINC001545485531 1058205392 /nfs/dbraw/zinc/20/53/92/1058205392.db2.gz OFRZIOPNHZVLIV-UHFFFAOYSA-N -1 1 309.837 4.382 20 0 DIADMM COC(=O)c1nc2ccc(-c3c(Cl)cccc3Cl)cc2[n-]1 ZINC001245676094 1058335855 /nfs/dbraw/zinc/33/58/55/1058335855.db2.gz SERJUSMVYYBLAR-UHFFFAOYSA-N -1 1 321.163 4.323 20 0 DIADMM COC(=O)c1nc2cc(-c3c(Cl)cccc3Cl)ccc2[n-]1 ZINC001245676094 1058335870 /nfs/dbraw/zinc/33/58/70/1058335870.db2.gz SERJUSMVYYBLAR-UHFFFAOYSA-N -1 1 321.163 4.323 20 0 DIADMM [O-]c1ccc(F)c(-c2cc(-c3ccccc3)cnn2)c1Cl ZINC001245827461 1058521890 /nfs/dbraw/zinc/52/18/90/1058521890.db2.gz LUYYHMIRUQNROT-UHFFFAOYSA-N -1 1 300.720 4.309 20 0 DIADMM [O-]c1ccc(F)c(-c2cc(-c3ccncc3)ccn2)c1Cl ZINC001245828317 1058523762 /nfs/dbraw/zinc/52/37/62/1058523762.db2.gz SGWDBVHPDMYBNX-UHFFFAOYSA-N -1 1 300.720 4.309 20 0 DIADMM Cc1nc(-c2ccncc2)cc(-c2c(F)ccc([O-])c2Cl)n1 ZINC001245830884 1058527067 /nfs/dbraw/zinc/52/70/67/1058527067.db2.gz XVFJPMLYFAJEMB-UHFFFAOYSA-N -1 1 315.735 4.012 20 0 DIADMM CCOc1ccc2ncnc(-c3c(F)ccc([O-])c3Cl)c2c1 ZINC001245830104 1058527323 /nfs/dbraw/zinc/52/73/23/1058527323.db2.gz HLNXNBRNDFSLNH-UHFFFAOYSA-N -1 1 318.735 4.194 20 0 DIADMM CC(C)n1ccc2c1ncnc2-c1c(F)ccc([O-])c1Cl ZINC001245830740 1058527616 /nfs/dbraw/zinc/52/76/16/1058527616.db2.gz WEQGUUKDSDJREZ-UHFFFAOYSA-N -1 1 305.740 4.177 20 0 DIADMM [O-]c1ccc(F)c(-c2cc(-c3ccc(F)cc3)ncn2)c1Cl ZINC001245830394 1058527995 /nfs/dbraw/zinc/52/79/95/1058527995.db2.gz MZTMLOBETDGMQE-UHFFFAOYSA-N -1 1 318.710 4.448 20 0 DIADMM CC(C)[S@](=O)c1ccc(-c2c(F)ccc([O-])c2Cl)cc1 ZINC001245831292 1058528193 /nfs/dbraw/zinc/52/81/93/1058528193.db2.gz ITPCWIBHIBQLSG-FQEVSTJZSA-N -1 1 312.793 4.368 20 0 DIADMM [O-]c1ccc(F)c(-c2ccc(-c3ccc(F)cc3)nn2)c1Cl ZINC001245830655 1058529401 /nfs/dbraw/zinc/52/94/01/1058529401.db2.gz SAIHHWHNIWAZNZ-UHFFFAOYSA-N -1 1 318.710 4.448 20 0 DIADMM COc1cc(-c2c(F)ccc([O-])c2Cl)nc2ccccc21 ZINC001245830787 1058529568 /nfs/dbraw/zinc/52/95/68/1058529568.db2.gz ZAYNXUCKRWRKOB-UHFFFAOYSA-N -1 1 303.720 4.409 20 0 DIADMM CC(C)(C)C(=O)Nc1cccnc1-c1c(F)ccc([O-])c1Cl ZINC001245832424 1058533276 /nfs/dbraw/zinc/53/32/76/1058533276.db2.gz XOAYCKAYUFVENH-UHFFFAOYSA-N -1 1 322.767 4.231 20 0 DIADMM CC1(c2cccc(-c3c(F)ccc([O-])c3Cl)c2)OCCO1 ZINC001245832659 1058533326 /nfs/dbraw/zinc/53/33/26/1058533326.db2.gz RGIJIYGKDRTSCW-UHFFFAOYSA-N -1 1 308.736 4.071 20 0 DIADMM COC(=O)c1c[nH]c2c1cccc2-c1c(F)ccc([O-])c1Cl ZINC001245831532 1058533691 /nfs/dbraw/zinc/53/36/91/1058533691.db2.gz MMQITGNQWWJSCQ-UHFFFAOYSA-N -1 1 319.719 4.120 20 0 DIADMM CC(C)(C)C(=O)Nc1ccc(-c2c(F)ccc([O-])c2Cl)cn1 ZINC001245832035 1058534006 /nfs/dbraw/zinc/53/40/06/1058534006.db2.gz HAINACXRCVHUNK-UHFFFAOYSA-N -1 1 322.767 4.231 20 0 DIADMM COC(=O)c1cc(C)c(C)cc1-c1c(F)ccc([O-])c1Cl ZINC001245833049 1058536283 /nfs/dbraw/zinc/53/62/83/1058536283.db2.gz SBYGEGRCYTYWCS-UHFFFAOYSA-N -1 1 308.736 4.255 20 0 DIADMM O=c1c(-c2c(F)ccc([O-])c2Cl)cccn1-c1ccccc1 ZINC001245834545 1058539522 /nfs/dbraw/zinc/53/95/22/1058539522.db2.gz JVMGQOXFHIPQJE-UHFFFAOYSA-N -1 1 315.731 4.003 20 0 DIADMM COc1cc(C(F)(F)F)c(-c2c(F)ccc([O-])c2Cl)cn1 ZINC001245835984 1058539749 /nfs/dbraw/zinc/53/97/49/1058539749.db2.gz REYSEFFPYADKCX-UHFFFAOYSA-N -1 1 321.657 4.274 20 0 DIADMM COC(=O)[C@@H](C)c1cccc(-c2c(F)ccc([O-])c2Cl)c1 ZINC001245834546 1058541321 /nfs/dbraw/zinc/54/13/21/1058541321.db2.gz IKDDMRPIIOHTLU-VIFPVBQESA-N -1 1 308.736 4.128 20 0 DIADMM CCc1ccc(C(=O)N2CCC[C@@H](C)c3ccccc32)c([O-])c1 ZINC001556131785 1058548548 /nfs/dbraw/zinc/54/85/48/1058548548.db2.gz VZKJWHDKNRVXIA-CQSZACIVSA-N -1 1 309.409 4.499 20 0 DIADMM CSCc1ccccc1NC(=O)c1cc(SC)ccc1[O-] ZINC001556142027 1058552725 /nfs/dbraw/zinc/55/27/25/1058552725.db2.gz JUAVYUIXVJCTMN-UHFFFAOYSA-N -1 1 319.451 4.229 20 0 DIADMM O=C(Nc1cc(Cl)c(F)c(Cl)c1)c1ccc(F)c([O-])c1 ZINC001556497960 1058603265 /nfs/dbraw/zinc/60/32/65/1058603265.db2.gz QKYLPGMXYYFCEJ-UHFFFAOYSA-N -1 1 318.106 4.230 20 0 DIADMM CC[C@@H]1CC[C@H](C)N(C(=O)c2ccc(C(F)(F)F)c([O-])c2)C1 ZINC001556596750 1058617886 /nfs/dbraw/zinc/61/78/86/1058617886.db2.gz TURZYEYKKHWFEA-WDEREUQCSA-N -1 1 315.335 4.062 20 0 DIADMM CCc1cc(=O)n(-c2cc(C(F)(F)F)cc(C(F)(F)F)c2)[n-]1 ZINC001245916785 1058622237 /nfs/dbraw/zinc/62/22/37/1058622237.db2.gz YBHRGFWRKCJGOX-UHFFFAOYSA-N -1 1 324.224 4.178 20 0 DIADMM C[C@@H](NC(=O)Cc1ccc([O-])c(Cl)c1)c1ccc(Cl)cc1 ZINC001556942253 1058671963 /nfs/dbraw/zinc/67/19/63/1058671963.db2.gz WATXLRXTRCOIHL-SNVBAGLBSA-N -1 1 324.207 4.119 20 0 DIADMM O=C(c1cc(Cl)ccc1[O-])N1CCC[C@H]1CC1CCCC1 ZINC001557292405 1058729240 /nfs/dbraw/zinc/72/92/40/1058729240.db2.gz NBFAJPGAKSRPRZ-AWEZNQCLSA-N -1 1 307.821 4.231 20 0 DIADMM CC(C)[C@@H](NC(=O)c1c([O-])cccc1Cl)c1ccccc1F ZINC001557400381 1058740556 /nfs/dbraw/zinc/74/05/56/1058740556.db2.gz PUVLQVMIZGWJRH-MRXNPFEDSA-N -1 1 321.779 4.312 20 0 DIADMM O=C(Nc1cccc2c1ccn2C(F)F)c1ccc([O-])cc1F ZINC001557449861 1058752522 /nfs/dbraw/zinc/75/25/22/1058752522.db2.gz YLZOTFHWLXEKMU-UHFFFAOYSA-N -1 1 320.270 4.133 20 0 DIADMM O=C(N[C@H]1CCCC12CCCCC2)c1ncc2ccccc2c1[O-] ZINC001557484329 1058757099 /nfs/dbraw/zinc/75/70/99/1058757099.db2.gz MMDYPNNHRKRPOY-INIZCTEOSA-N -1 1 324.424 4.173 20 0 DIADMM C[C@H](CCCc1ccccc1)C(=O)Nc1cccc(F)c1[O-] ZINC001557955504 1058817011 /nfs/dbraw/zinc/81/70/11/1058817011.db2.gz BTQSGOBMAZGQEW-CYBMUJFWSA-N -1 1 301.361 4.129 20 0 DIADMM CC(C)C[C@H](C(=O)[N-]OCCCC(F)(F)F)c1ccccc1 ZINC001558056708 1058834476 /nfs/dbraw/zinc/83/44/76/1058834476.db2.gz PVDMDTJZVPPIRM-AWEZNQCLSA-N -1 1 317.351 4.207 20 0 DIADMM O=C(NCc1ccc([O-])c(Cl)c1)C1(C2CCCCC2)CC1 ZINC001558208312 1058848282 /nfs/dbraw/zinc/84/82/82/1058848282.db2.gz AQYPHQFZONADMX-UHFFFAOYSA-N -1 1 307.821 4.022 20 0 DIADMM O=C(Nc1cnn(C2CCCC2)c1)c1cc2ccccc2cc1[O-] ZINC001558440377 1058870929 /nfs/dbraw/zinc/87/09/29/1058870929.db2.gz KTQHRDRZTLNEDJ-UHFFFAOYSA-N -1 1 321.380 4.109 20 0 DIADMM Cc1cccc(NC(=O)c2c([O-])cnc3ccc(Cl)cc32)c1 ZINC001558892593 1058919295 /nfs/dbraw/zinc/91/92/95/1058919295.db2.gz FVBUBAMFAOCANL-UHFFFAOYSA-N -1 1 312.756 4.155 20 0 DIADMM CCCc1nsc([N-]c2cnn(-c3ccc(C)cc3C)c2)n1 ZINC001559167823 1059054057 /nfs/dbraw/zinc/05/40/57/1059054057.db2.gz FEDNMLMXTWEWTF-UHFFFAOYSA-N -1 1 313.430 4.037 20 0 DIADMM CCCc1cc(=O)[n-]c(SCc2cccc(F)c2Cl)n1 ZINC001559324547 1059162637 /nfs/dbraw/zinc/16/26/37/1059162637.db2.gz WEMREICZLMPMLC-UHFFFAOYSA-N -1 1 312.797 4.220 20 0 DIADMM Cc1nc(SCCCOc2cccc(Cl)c2)[n-]c(=O)c1C ZINC001559392601 1059202464 /nfs/dbraw/zinc/20/24/64/1059202464.db2.gz AFORDUIFFKPTRW-UHFFFAOYSA-N -1 1 324.833 4.014 20 0 DIADMM Cc1nc(SCc2ccccc2CC(C)C)[n-]c(=O)c1C ZINC001559392794 1059203054 /nfs/dbraw/zinc/20/30/54/1059203054.db2.gz DAIXJKJNDDBASN-UHFFFAOYSA-N -1 1 302.443 4.290 20 0 DIADMM CCc1nc(SCC[C@H]2CCc3ccccc32)[n-]c(=O)c1C ZINC001559422752 1059220862 /nfs/dbraw/zinc/22/08/62/1059220862.db2.gz PBDJUKCJFOJALJ-CQSZACIVSA-N -1 1 314.454 4.265 20 0 DIADMM CC(C)(C)SCCSc1nc(-c2ccccc2)cc(=O)[n-]1 ZINC001559473179 1059251522 /nfs/dbraw/zinc/25/15/22/1059251522.db2.gz KSNOPMGNHGRWRZ-UHFFFAOYSA-N -1 1 320.483 4.473 20 0 DIADMM CCc1ccc(NC(=S)Nc2cccc([O-])c2Cl)cc1 ZINC001247339606 1059383814 /nfs/dbraw/zinc/38/38/14/1059383814.db2.gz XZEPTQQAMFLSJQ-UHFFFAOYSA-N -1 1 306.818 4.417 20 0 DIADMM CCc1cccc(C)c1NC(=S)Nc1ccc(F)cc1[O-] ZINC001249553717 1060289617 /nfs/dbraw/zinc/28/96/17/1060289617.db2.gz YKTKIBYZCLNIIP-UHFFFAOYSA-N -1 1 304.390 4.211 20 0 DIADMM [O-]c1cc(F)cc(F)c1Nc1cccc(Br)c1F ZINC001249687720 1060350872 /nfs/dbraw/zinc/35/08/72/1060350872.db2.gz LVWXJHUBLWZPCW-UHFFFAOYSA-N -1 1 318.092 4.316 20 0 DIADMM Cc1cc(C)c(NC(=S)Nc2c(F)cc([O-])cc2F)c(C)c1 ZINC001249734751 1060378728 /nfs/dbraw/zinc/37/87/28/1060378728.db2.gz SSSKOBCKMWFOPF-UHFFFAOYSA-N -1 1 322.380 4.405 20 0 DIADMM O=C1CCCCc2ccc(Nc3ncc(Cl)cc3[O-])cc21 ZINC001249890854 1060453791 /nfs/dbraw/zinc/45/37/91/1060453791.db2.gz VZLIQJLBDFOCAA-UHFFFAOYSA-N -1 1 302.761 4.093 20 0 DIADMM Cc1cccc2ccc(Nc3cc([O-])c(F)c(F)c3F)nc12 ZINC001249957495 1060498728 /nfs/dbraw/zinc/49/87/28/1060498728.db2.gz BAVNKKTYQYJUAU-UHFFFAOYSA-N -1 1 304.271 4.410 20 0 DIADMM Cc1cc(Nc2cc([O-])c(F)c(F)c2F)n(-c2ccccc2)n1 ZINC001249957739 1060500702 /nfs/dbraw/zinc/50/07/02/1060500702.db2.gz FSYBNEPBLOOBHO-UHFFFAOYSA-N -1 1 319.286 4.047 20 0 DIADMM Nc1ccc(C(F)(F)F)cc1Nc1cc([O-])c(F)c(F)c1F ZINC001249961789 1060504412 /nfs/dbraw/zinc/50/44/12/1060504412.db2.gz GBZWORIDYUUNOL-UHFFFAOYSA-N -1 1 322.208 4.154 20 0 DIADMM [O-]c1cc(Nc2ccc3ccc(O)cc3c2)c(F)c(F)c1F ZINC001249964047 1060506783 /nfs/dbraw/zinc/50/67/83/1060506783.db2.gz XEZRXOYUSRZWLO-UHFFFAOYSA-N -1 1 305.255 4.412 20 0 DIADMM [O-]c1cc(Nc2ccc(-c3ccncn3)cc2)c(F)c(F)c1F ZINC001249964636 1060506941 /nfs/dbraw/zinc/50/69/41/1060506941.db2.gz JOCHGNVLRUJWBT-UHFFFAOYSA-N -1 1 317.270 4.010 20 0 DIADMM [O-]c1cc(Nc2cc(Cl)c(F)cc2F)c(F)c(F)c1F ZINC001249964376 1060507921 /nfs/dbraw/zinc/50/79/21/1060507921.db2.gz BTMHUUAXYJJEGA-UHFFFAOYSA-N -1 1 309.621 4.485 20 0 DIADMM CCN(CC)c1ccc(Nc2cc([O-])c(F)c(F)c2F)cc1 ZINC001249963238 1060508282 /nfs/dbraw/zinc/50/82/82/1060508282.db2.gz TWBFAFBDUFYEOQ-UHFFFAOYSA-N -1 1 310.319 4.399 20 0 DIADMM COc1cc(Nc2cc([O-])c(F)c(F)c2F)ccc1SC ZINC001249963052 1060510136 /nfs/dbraw/zinc/51/01/36/1060510136.db2.gz QOAXSTFIORXXQY-UHFFFAOYSA-N -1 1 315.316 4.284 20 0 DIADMM CC(=O)c1ccc(Cl)c(Nc2cc([O-])c(F)c(F)c2F)c1 ZINC001249963772 1060510641 /nfs/dbraw/zinc/51/06/41/1060510641.db2.gz UNJYECSVCLNDNF-UHFFFAOYSA-N -1 1 315.678 4.409 20 0 DIADMM [O-]c1cc(Nc2cccc3cc(O)ccc32)c(F)c(F)c1F ZINC001249965893 1060511993 /nfs/dbraw/zinc/51/19/93/1060511993.db2.gz QTGOAKRSIUGDFC-UHFFFAOYSA-N -1 1 305.255 4.412 20 0 DIADMM COc1cnc2c(cccc2Nc2cc([O-])c(F)c(F)c2F)c1 ZINC001249965724 1060512373 /nfs/dbraw/zinc/51/23/73/1060512373.db2.gz ISESNIXCFGYJPZ-UHFFFAOYSA-N -1 1 320.270 4.110 20 0 DIADMM COc1ccc(Nc2cc([O-])c(F)c(F)c2F)c2ccncc12 ZINC001249965660 1060512559 /nfs/dbraw/zinc/51/25/59/1060512559.db2.gz FSOFUDCJQAUBSL-UHFFFAOYSA-N -1 1 320.270 4.110 20 0 DIADMM Nc1cc(Cl)nc(Cl)c1Nc1cc(Cl)c([O-])cc1F ZINC001250019778 1060544267 /nfs/dbraw/zinc/54/42/67/1060544267.db2.gz FAQGZVBYRVMBIM-UHFFFAOYSA-N -1 1 322.554 4.212 20 0 DIADMM [O-]c1cc(F)c(Nc2csc(Br)n2)cc1Cl ZINC001250020496 1060545114 /nfs/dbraw/zinc/54/51/14/1060545114.db2.gz WFBURHQVYCLQKD-UHFFFAOYSA-N -1 1 323.574 4.147 20 0 DIADMM COC(=O)c1ccc(C)c(Nc2cc(Cl)c([O-])cc2F)c1 ZINC001250023788 1060545981 /nfs/dbraw/zinc/54/59/81/1060545981.db2.gz AWTGUALBEDLDGW-UHFFFAOYSA-N -1 1 309.724 4.023 20 0 DIADMM O=C1CCCN1c1ccc(Nc2cc(Cl)c([O-])cc2F)cc1 ZINC001250022362 1060546063 /nfs/dbraw/zinc/54/60/63/1060546063.db2.gz KUASRCTUIDAOQN-UHFFFAOYSA-N -1 1 320.751 4.055 20 0 DIADMM COc1cccc2cc(Nc3cc(Cl)c([O-])cc3F)cnc21 ZINC001250023121 1060546176 /nfs/dbraw/zinc/54/61/76/1060546176.db2.gz DBSNOOSINJVMHH-UHFFFAOYSA-N -1 1 318.735 4.485 20 0 DIADMM [O-]c1cc(F)c(Nc2cccc(Cn3cccn3)c2)cc1Cl ZINC001250022582 1060546499 /nfs/dbraw/zinc/54/64/99/1060546499.db2.gz NTPTZGAKCWOXID-UHFFFAOYSA-N -1 1 317.751 4.173 20 0 DIADMM [O-]c1cc(F)c(Nc2ccc(-n3cccn3)cc2)cc1Cl ZINC001250022039 1060548739 /nfs/dbraw/zinc/54/87/39/1060548739.db2.gz FANYDTYWLNPWLX-UHFFFAOYSA-N -1 1 303.724 4.114 20 0 DIADMM [O-]c1cc(F)c(Nc2c(Cl)cccc2CO)cc1Cl ZINC001250024083 1060550375 /nfs/dbraw/zinc/55/03/75/1060550375.db2.gz PUOFMYRTDXXGOZ-UHFFFAOYSA-N -1 1 302.132 4.074 20 0 DIADMM CC(C)NC(=O)c1ccc(Nc2cc(Cl)c([O-])cc2F)cc1 ZINC001250023817 1060552684 /nfs/dbraw/zinc/55/26/84/1060552684.db2.gz BYJYZMKPFYUHRX-UHFFFAOYSA-N -1 1 322.767 4.067 20 0 DIADMM COc1cc(OC)c(Nc2cc(Cl)c([O-])cc2F)cc1F ZINC001250024295 1060552719 /nfs/dbraw/zinc/55/27/19/1060552719.db2.gz WSLYBSYMFJDLEW-UHFFFAOYSA-N -1 1 315.703 4.085 20 0 DIADMM Cc1cc(N)c(Cl)cc1Nc1cc(Cl)c([O-])cc1F ZINC001250026397 1060555527 /nfs/dbraw/zinc/55/55/27/1060555527.db2.gz LUNBTJGFJSBXNU-UHFFFAOYSA-N -1 1 301.148 4.472 20 0 DIADMM [O-]c1cccc(CN2CC[C@](F)(c3ccccc3)C2)c1Cl ZINC001560786219 1060646969 /nfs/dbraw/zinc/64/69/69/1060646969.db2.gz TVWAMVQMIDIQOF-QGZVFWFLSA-N -1 1 305.780 4.116 20 0 DIADMM Cc1cccc(-n2nccc2Nc2c(F)ccc([O-])c2Cl)c1 ZINC001250229481 1060707155 /nfs/dbraw/zinc/70/71/55/1060707155.db2.gz KLEXMUDSRBCNAY-UHFFFAOYSA-N -1 1 317.751 4.422 20 0 DIADMM [O-]c1ccc(F)c(Nc2cc(Cl)c3nccn3c2)c1Cl ZINC001250229726 1060707216 /nfs/dbraw/zinc/70/72/16/1060707216.db2.gz MKBRTHUFZNWDHC-UHFFFAOYSA-N -1 1 312.131 4.229 20 0 DIADMM [O-]c1ccc(F)c(Nc2cnc(Br)s2)c1Cl ZINC001250229412 1060707905 /nfs/dbraw/zinc/70/79/05/1060707905.db2.gz GGZGTWLUIPHQHH-UHFFFAOYSA-N -1 1 323.574 4.147 20 0 DIADMM [O-]c1ccc(F)c(Nc2ncccc2C(F)(F)F)c1Cl ZINC001250228379 1060708059 /nfs/dbraw/zinc/70/80/59/1060708059.db2.gz ZXGMLHNHUZDUET-UHFFFAOYSA-N -1 1 306.646 4.342 20 0 DIADMM [O-]c1ccc(F)c(Nc2cccnc2N2CCCCC2)c1Cl ZINC001250229293 1060708751 /nfs/dbraw/zinc/70/87/51/1060708751.db2.gz ZGUDQEHJWYBHQM-UHFFFAOYSA-N -1 1 321.783 4.314 20 0 DIADMM [O-]c1ccc(F)c(Nc2snnc2-c2ccccc2)c1Cl ZINC001250228431 1060709047 /nfs/dbraw/zinc/70/90/47/1060709047.db2.gz ATSNPKRUAJTPFJ-UHFFFAOYSA-N -1 1 321.764 4.447 20 0 DIADMM Cc1ccccc1-n1nccc1Nc1c(F)ccc([O-])c1Cl ZINC001250229788 1060709468 /nfs/dbraw/zinc/70/94/68/1060709468.db2.gz ODCVXNLDNQYSOG-UHFFFAOYSA-N -1 1 317.751 4.422 20 0 DIADMM O=C1CCCc2ccc(Nc3c(F)ccc([O-])c3Cl)cc2N1 ZINC001250232514 1060710588 /nfs/dbraw/zinc/71/05/88/1060710588.db2.gz PEDLMIQMUQNONY-UHFFFAOYSA-N -1 1 320.751 4.203 20 0 DIADMM [O-]c1ccc(F)c(Nc2ccc(-c3ccncn3)cc2)c1Cl ZINC001250232234 1060710696 /nfs/dbraw/zinc/71/06/96/1060710696.db2.gz FUROKZOWJMBUNR-UHFFFAOYSA-N -1 1 315.735 4.385 20 0 DIADMM O=c1ccc2c(Nc3c(F)ccc([O-])c3Cl)cccc2[nH]1 ZINC001250232904 1060710936 /nfs/dbraw/zinc/71/09/36/1060710936.db2.gz YUVNALZDAZUACV-UHFFFAOYSA-N -1 1 304.708 4.182 20 0 DIADMM [O-]c1c(F)cc(Cc2c(F)cccc2C(F)(F)F)cc1F ZINC001250229949 1060710967 /nfs/dbraw/zinc/71/09/67/1060710967.db2.gz NFNHDNLBSAUBBQ-UHFFFAOYSA-N -1 1 306.205 4.419 20 0 DIADMM COc1c(F)cc(Nc2c(F)ccc([O-])c2Cl)cc1F ZINC001250232184 1060711341 /nfs/dbraw/zinc/71/13/41/1060711341.db2.gz CNFKZGAXMHVJFN-UHFFFAOYSA-N -1 1 303.667 4.215 20 0 DIADMM COc1ccc(F)c(Nc2c(F)ccc([O-])c2Cl)c1F ZINC001250232335 1060711611 /nfs/dbraw/zinc/71/16/11/1060711611.db2.gz JPUKMHZYSDCJPN-UHFFFAOYSA-N -1 1 303.667 4.215 20 0 DIADMM Cc1cc2c(ccc(N)c2F)n1-c1c(F)ccc([O-])c1Cl ZINC001250232399 1060711758 /nfs/dbraw/zinc/71/17/58/1060711758.db2.gz KRPHSZKVMRUPKA-UHFFFAOYSA-N -1 1 308.715 4.158 20 0 DIADMM CCOC(=O)Nc1ccc(Nc2c(F)ccc([O-])c2Cl)cc1 ZINC001250232513 1060712355 /nfs/dbraw/zinc/71/23/55/1060712355.db2.gz PECAXPLUGPWCMH-UHFFFAOYSA-N -1 1 324.739 4.497 20 0 DIADMM O=C1CCCN1c1ccc(Nc2c(F)ccc([O-])c2Cl)cc1 ZINC001250234220 1060713159 /nfs/dbraw/zinc/71/31/59/1060713159.db2.gz LKXICWWBWNUFLZ-UHFFFAOYSA-N -1 1 320.751 4.055 20 0 DIADMM CC(C)NC(=O)c1cccc(Nc2c(F)ccc([O-])c2Cl)c1 ZINC001250233118 1060713191 /nfs/dbraw/zinc/71/31/91/1060713191.db2.gz IQFWTPIGMZUIHG-UHFFFAOYSA-N -1 1 322.767 4.067 20 0 DIADMM [O-]c1ccc(F)c(Nc2ccc(-c3ccccn3)nc2)c1Cl ZINC001250233947 1060713267 /nfs/dbraw/zinc/71/32/67/1060713267.db2.gz GWUIQUDATPMXRY-UHFFFAOYSA-N -1 1 315.735 4.385 20 0 DIADMM CC(=O)Nc1cc(Nc2c(F)ccc([O-])c2Cl)ccc1C ZINC001250233350 1060714030 /nfs/dbraw/zinc/71/40/30/1060714030.db2.gz NHMFXKFCXLZGMX-UHFFFAOYSA-N -1 1 308.740 4.195 20 0 DIADMM O=c1[nH]c2ccc(Nc3c(F)ccc([O-])c3Cl)cc2s1 ZINC001250233908 1060714452 /nfs/dbraw/zinc/71/44/52/1060714452.db2.gz ZTTHAFXPRPHHHA-UHFFFAOYSA-N -1 1 310.737 4.244 20 0 DIADMM [O-]c1ccc(F)c(Nc2cc(-c3ccccc3)cnn2)c1Cl ZINC001250233951 1060714867 /nfs/dbraw/zinc/71/48/67/1060714867.db2.gz HGXJEPBCMUPPKC-UHFFFAOYSA-N -1 1 315.735 4.385 20 0 DIADMM Nc1cc(Cl)c(Cl)nc1Nc1c(F)ccc([O-])c1Cl ZINC001250234102 1060715247 /nfs/dbraw/zinc/71/52/47/1060715247.db2.gz KXTWYDOQDFXCEW-UHFFFAOYSA-N -1 1 322.554 4.212 20 0 DIADMM [O-]c1ccc(F)c(Nc2cc(C(F)(F)F)cnc2F)c1Cl ZINC001250234694 1060715354 /nfs/dbraw/zinc/71/53/54/1060715354.db2.gz UYHXLMKHUTUKFK-UHFFFAOYSA-N -1 1 324.636 4.481 20 0 DIADMM CC(C)c1cnn2cc(Nc3c(F)ccc([O-])c3Cl)cnc12 ZINC001250233813 1060715482 /nfs/dbraw/zinc/71/54/82/1060715482.db2.gz FGXZEMUCDYCKOK-UHFFFAOYSA-N -1 1 320.755 4.094 20 0 DIADMM O=C1CCCc2cc(Nc3c(F)ccc([O-])c3Cl)ccc2N1 ZINC001250236271 1060716492 /nfs/dbraw/zinc/71/64/92/1060716492.db2.gz MBLWDXLAVILHDE-UHFFFAOYSA-N -1 1 320.751 4.203 20 0 DIADMM [O-]c1ccc(F)c(Nc2ccc3c(c2)[C@H](O)CCC3)c1Cl ZINC001250236299 1060716602 /nfs/dbraw/zinc/71/66/02/1060716602.db2.gz NIKKOKGMCOPQPQ-CYBMUJFWSA-N -1 1 307.752 4.298 20 0 DIADMM COC(=O)[C@@H](C)c1ccc(Nc2c(F)ccc([O-])c2Cl)cc1 ZINC001250236494 1060716652 /nfs/dbraw/zinc/71/66/52/1060716652.db2.gz ROWPRKJHZDKRAH-VIFPVBQESA-N -1 1 323.751 4.205 20 0 DIADMM O=C(Cc1c(F)cc([O-])cc1F)c1ccc(C(F)(F)F)cc1 ZINC001250237634 1060719714 /nfs/dbraw/zinc/71/97/14/1060719714.db2.gz IIRQGDZRTPZRBB-UHFFFAOYSA-N -1 1 316.225 4.115 20 0 DIADMM COc1cc(Nc2ccnc(Cl)c2[O-])c(F)c(F)c1Cl ZINC001250262122 1060737964 /nfs/dbraw/zinc/73/79/64/1060737964.db2.gz FPHMDADIYGQEFL-UHFFFAOYSA-N -1 1 321.110 4.124 20 0 DIADMM COc1ccc2nc(-c3cc(Cl)cc(Cl)c3[O-])[nH]c2c1 ZINC001250457358 1060815962 /nfs/dbraw/zinc/81/59/62/1060815962.db2.gz MNUQSIVEYWHUEQ-UHFFFAOYSA-N -1 1 309.152 4.251 20 0 DIADMM [O-]c1c(Cl)cc(Cl)cc1-c1nc2cc3c(cc2[nH]1)OCC3 ZINC001250457270 1060817253 /nfs/dbraw/zinc/81/72/53/1060817253.db2.gz JLOHXBKEEAAFRC-UHFFFAOYSA-N -1 1 321.163 4.177 20 0 DIADMM Cc1cc2nc(-c3ccc(C(=O)[O-])cc3)[nH]c2cc1C(F)(F)F ZINC001250479855 1060835844 /nfs/dbraw/zinc/83/58/44/1060835844.db2.gz NEWWWODYYRKSRD-UHFFFAOYSA-N -1 1 320.270 4.255 20 0 DIADMM O=S(=O)([N-]c1cccc2c1CCC2)c1cccc2ccccc21 ZINC001250585687 1060919213 /nfs/dbraw/zinc/91/92/13/1060919213.db2.gz PFKFUZZZXLOXTQ-UHFFFAOYSA-N -1 1 323.417 4.129 20 0 DIADMM O=S(=O)([N-]c1ccc2occc2c1)c1ccc2ccccc2c1 ZINC001250721815 1061041271 /nfs/dbraw/zinc/04/12/71/1061041271.db2.gz LRCCGSPBYQFBNU-UHFFFAOYSA-N -1 1 323.373 4.387 20 0 DIADMM COc1cc(Cl)cc2[nH]c(-c3ccc(Cl)cc3[O-])nc21 ZINC001250872002 1061103058 /nfs/dbraw/zinc/10/30/58/1061103058.db2.gz KKCKOUOPGJBLBU-UHFFFAOYSA-N -1 1 309.152 4.251 20 0 DIADMM O=C([O-])c1ccccc1-c1nc2cc(F)cc(C(F)(F)F)c2[nH]1 ZINC001250878817 1061105224 /nfs/dbraw/zinc/10/52/24/1061105224.db2.gz FSXFJAJGYZNBSJ-UHFFFAOYSA-N -1 1 324.233 4.086 20 0 DIADMM Cc1ccc2[nH]c(-c3cccc([O-])c3Br)nc2c1F ZINC001250879996 1061107449 /nfs/dbraw/zinc/10/74/49/1061107449.db2.gz BBKLLOGELCEHIO-UHFFFAOYSA-N -1 1 321.149 4.146 20 0 DIADMM [O-]c1cc(F)cc(F)c1-c1nc2ccc(-c3ccncc3)cc2[nH]1 ZINC001250887285 1061109678 /nfs/dbraw/zinc/10/96/78/1061109678.db2.gz LHNDWDIPMWFSMR-UHFFFAOYSA-N -1 1 323.302 4.276 20 0 DIADMM [O-]c1ccc(-c2nc3c(cccc3C(F)(F)F)[nH]2)c(F)c1F ZINC001250913192 1061121524 /nfs/dbraw/zinc/12/15/24/1061121524.db2.gz YGMHDGQUQIAKFB-UHFFFAOYSA-N -1 1 314.213 4.233 20 0 DIADMM CCCn1c2ccc(F)cc2nc1-c1ccc([O-])c(F)c1F ZINC001250915014 1061124194 /nfs/dbraw/zinc/12/41/94/1061124194.db2.gz NANLNJBENDMAFJ-UHFFFAOYSA-N -1 1 306.287 4.236 20 0 DIADMM [O-]c1ccc(-c2nc3ccc(F)cc3n2C2CC2)c(F)c1F ZINC001250914615 1061124736 /nfs/dbraw/zinc/12/47/36/1061124736.db2.gz FSISHLZMIVFMEV-UHFFFAOYSA-N -1 1 304.271 4.161 20 0 DIADMM O=C([O-])c1ccc(-c2nc3ccc(Oc4ccccc4)cc3[nH]2)o1 ZINC001250922131 1061127257 /nfs/dbraw/zinc/12/72/57/1061127257.db2.gz CNCQYQHRSCMNPR-UHFFFAOYSA-N -1 1 320.304 4.313 20 0 DIADMM COc1ccc2[nH]c(-c3c(Cl)cc([O-])cc3Cl)nc2c1 ZINC001250956699 1061145757 /nfs/dbraw/zinc/14/57/57/1061145757.db2.gz JABCEBAJYSMOMC-UHFFFAOYSA-N -1 1 309.152 4.251 20 0 DIADMM Cc1ccc2c(c1)nc(-c1cc(F)c(F)cc1[O-])n2CC1CC1 ZINC001250967531 1061153855 /nfs/dbraw/zinc/15/38/55/1061153855.db2.gz 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/nfs/dbraw/zinc/19/35/96/1061193596.db2.gz IKEBWIGOAKKZPH-UHFFFAOYSA-N -1 1 313.788 4.189 20 0 DIADMM COc1ccc2nc(-c3ccc(Cl)c([O-])c3)n(C3CC3)c2c1 ZINC001251037439 1061194547 /nfs/dbraw/zinc/19/45/47/1061194547.db2.gz VIJKDTIBZVIRRR-UHFFFAOYSA-N -1 1 314.772 4.406 20 0 DIADMM C[C@@]1(c2ccccc2)CCCN1C(=O)c1cc(Cl)ccc1[O-] ZINC001455225358 1061213853 /nfs/dbraw/zinc/21/38/53/1061213853.db2.gz NBEBJKKZKGCQGA-SFHVURJKSA-N -1 1 315.800 4.197 20 0 DIADMM O=C(CC/C=C/c1ccccc1)NCc1ccc([O-])c(Cl)c1 ZINC001455448995 1061223696 /nfs/dbraw/zinc/22/36/96/1061223696.db2.gz JLBBBLGOGAONJG-XBXARRHUSA-N -1 1 315.800 4.155 20 0 DIADMM CC1(c2ccccc2C(=O)NCc2ccc([O-])c(Cl)c2)CC1 ZINC001455454884 1061223977 /nfs/dbraw/zinc/22/39/77/1061223977.db2.gz XLCLNADHMACFBA-UHFFFAOYSA-N -1 1 315.800 4.027 20 0 DIADMM CCc1ccc2ccccc2c1CNC(=O)c1ccc([O-])cc1F ZINC001455555448 1061227321 /nfs/dbraw/zinc/22/73/21/1061227321.db2.gz PFUVGAHCBAPOOM-UHFFFAOYSA-N -1 1 323.367 4.177 20 0 DIADMM CCn1c2cc(C)ccc2nc1-c1cc(Cl)c([O-])cc1O 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Cc1cccc2nc(-c3cc(Br)cc(F)c3[O-])[nH]c21 ZINC001251389958 1061341080 /nfs/dbraw/zinc/34/10/80/1061341080.db2.gz SAKCLDTZDIDQST-UHFFFAOYSA-N -1 1 321.149 4.146 20 0 DIADMM O=S(=O)([N-]CCCC1CCCCC1)c1sccc1Cl ZINC001462823027 1061365230 /nfs/dbraw/zinc/36/52/30/1061365230.db2.gz CEJDTAXWGRLAGF-UHFFFAOYSA-N -1 1 321.895 4.040 20 0 DIADMM CCCn1c(-c2ccc(F)c([O-])c2)nc2ccc(F)c(F)c21 ZINC001251477478 1061372026 /nfs/dbraw/zinc/37/20/26/1061372026.db2.gz NBYLNHKGDIIWOU-UHFFFAOYSA-N -1 1 306.287 4.236 20 0 DIADMM [O-]c1cc(-c2nc3c(ccc4ncccc34)n2C2CC2)ccc1F ZINC001251477528 1061373449 /nfs/dbraw/zinc/37/34/49/1061373449.db2.gz OLNNSPLUZCFXRW-UHFFFAOYSA-N -1 1 319.339 4.431 20 0 DIADMM COc1cc([O-])c(-c2nc3ccc(Cl)cc3n2C)c(Cl)c1 ZINC001251491050 1061377490 /nfs/dbraw/zinc/37/74/90/1061377490.db2.gz FXLFIRDILDLUFQ-UHFFFAOYSA-N -1 1 323.179 4.261 20 0 DIADMM Fc1cc2nc(C3OC=CC3=S)[n-]c2cc1C(F)(F)F ZINC001251546947 1061401750 /nfs/dbraw/zinc/40/17/50/1061401750.db2.gz WKUQNFBSDIWWBN-UHFFFAOYSA-N -1 1 302.252 4.270 20 0 DIADMM CCOc1ccc2nc(-c3cc(Cl)nc(Cl)c3[O-])[nH]c2c1 ZINC001251614038 1061418668 /nfs/dbraw/zinc/41/86/68/1061418668.db2.gz XEZNGTQNUKDEOM-UHFFFAOYSA-N -1 1 324.167 4.036 20 0 DIADMM Cc1c2[nH]c(-c3cc(Cl)nc(Cl)c3[O-])nc2ccc1F ZINC001251613813 1061419447 /nfs/dbraw/zinc/41/94/47/1061419447.db2.gz PLRPEESXEOVFGE-UHFFFAOYSA-N -1 1 312.131 4.085 20 0 DIADMM Cc1ccc2cccc([N-]S(=O)(=O)c3ccc(F)cc3)c2c1 ZINC001251661618 1061434193 /nfs/dbraw/zinc/43/41/93/1061434193.db2.gz RZQRSJAWJHNFBK-UHFFFAOYSA-N -1 1 315.369 4.088 20 0 DIADMM Cc1ccc2c(cccc2[N-]S(=O)(=O)c2ccc(F)cc2)c1 ZINC001251668146 1061436866 /nfs/dbraw/zinc/43/68/66/1061436866.db2.gz JOQPJCWVZYKEPZ-UHFFFAOYSA-N -1 1 315.369 4.088 20 0 DIADMM CCn1c2ccc(F)cc2nc1-c1cc(F)c(Cl)cc1[O-] ZINC001251681235 1061440207 /nfs/dbraw/zinc/44/02/07/1061440207.db2.gz QCQPYWBNILSMRM-UHFFFAOYSA-N -1 1 308.715 4.360 20 0 DIADMM [O-]c1cc(Cl)c(F)cc1-c1nc2c(cc(F)c(F)c2F)[nH]1 ZINC001251681603 1061442772 /nfs/dbraw/zinc/44/27/72/1061442772.db2.gz YKNYUUANNXQNBC-UHFFFAOYSA-N -1 1 316.641 4.145 20 0 DIADMM C[C@H]([N-]C(=O)C(F)(F)F)c1ccccc1OCc1ccccc1 ZINC001463460059 1061483199 /nfs/dbraw/zinc/48/31/99/1061483199.db2.gz YYVMIIIPFMDGDG-LBPRGKRZSA-N -1 1 323.314 4.005 20 0 DIADMM O=C(Nc1nc(Cl)ccc1[O-])c1ccc(C2CCCC2)cc1 ZINC001457760571 1061497263 /nfs/dbraw/zinc/49/72/63/1061497263.db2.gz JSOKQDJMMLYJDO-UHFFFAOYSA-N -1 1 316.788 4.351 20 0 DIADMM COc1ccc(C(C)(C)C)cc1NC(=O)c1cccc([O-])c1F ZINC001463572247 1061499933 /nfs/dbraw/zinc/49/99/33/1061499933.db2.gz COIDHDILLMGJTA-UHFFFAOYSA-N -1 1 317.360 4.090 20 0 DIADMM CCOc1ccc2nc(-c3cc([O-])c(Cl)c(F)c3F)[nH]c2c1 ZINC001251865861 1061517658 /nfs/dbraw/zinc/51/76/58/1061517658.db2.gz YQUOHJNPFCNEHC-UHFFFAOYSA-N -1 1 324.714 4.266 20 0 DIADMM CCc1ccc([C@H](NC(=O)c2ccc(F)c([O-])c2)C(C)C)cc1 ZINC001463888148 1061529763 /nfs/dbraw/zinc/52/97/63/1061529763.db2.gz IEKSGDAKJWVITJ-GOSISDBHSA-N -1 1 315.388 4.221 20 0 DIADMM Cc1ccc([C@H](C)NC(=O)c2ccc(C(F)(F)F)cc2[O-])cc1 ZINC001464051046 1061549378 /nfs/dbraw/zinc/54/93/78/1061549378.db2.gz GEOJLQZOAPIGAU-NSHDSACASA-N -1 1 323.314 4.210 20 0 DIADMM C[C@@H](Cc1ccccc1Cl)NC(=O)c1cc(Cl)ccc1[O-] ZINC001464237346 1061566262 /nfs/dbraw/zinc/56/62/62/1061566262.db2.gz SWMIZHBFJUADIG-JTQLQIEISA-N -1 1 324.207 4.060 20 0 DIADMM CC1(C)CCC(C)([N-]S(=O)(=O)c2cc3ccccc3o2)CC1 ZINC001464257658 1061570117 /nfs/dbraw/zinc/57/01/17/1061570117.db2.gz XIAFADARFLWHGE-UHFFFAOYSA-N -1 1 321.442 4.070 20 0 DIADMM CCCOc1ccc(NC(=O)c2ccc(F)c([O-])c2)cc1Cl ZINC001464322581 1061575151 /nfs/dbraw/zinc/57/51/51/1061575151.db2.gz WIMGWICNSYOMEI-UHFFFAOYSA-N -1 1 323.751 4.226 20 0 DIADMM CC[C@@H](c1ccccc1)N(CC)C(=O)c1ccc(F)c([O-])c1 ZINC001464575193 1061607077 /nfs/dbraw/zinc/60/70/77/1061607077.db2.gz SHIYRFWRNCMAOO-INIZCTEOSA-N -1 1 301.361 4.145 20 0 DIADMM Cc1ccc(N(C)C(=O)Cc2ccc([O-])c(Cl)c2)cc1Cl ZINC001465008690 1061662074 /nfs/dbraw/zinc/66/20/74/1061662074.db2.gz FZHJZDQWHIHDRJ-UHFFFAOYSA-N -1 1 324.207 4.213 20 0 DIADMM [O-]c1ccc(F)c(-c2nnc(-c3ccc(Cl)cc3)o2)c1F ZINC001252786284 1061716824 /nfs/dbraw/zinc/71/68/24/1061716824.db2.gz DLEYOXGBBQLSIS-UHFFFAOYSA-N -1 1 308.671 4.041 20 0 DIADMM [O-]c1cc(F)cc(-c2nnc(-c3ccc(C(F)(F)F)cc3)o2)c1 ZINC001252933714 1061754388 /nfs/dbraw/zinc/75/43/88/1061754388.db2.gz KFVLWKSSBUXJGO-UHFFFAOYSA-N -1 1 324.233 4.267 20 0 DIADMM CCc1ccc(-c2nnc(-c3ccc4cccnc4c3[O-])o2)cc1 ZINC001252954108 1061760070 /nfs/dbraw/zinc/76/00/70/1061760070.db2.gz RQCCZZWKVSQONY-UHFFFAOYSA-N -1 1 317.348 4.220 20 0 DIADMM CCCc1nsc([N-]c2cnn([C@H](C)c3ccccc3)c2)n1 ZINC001458452202 1061772308 /nfs/dbraw/zinc/77/23/08/1061772308.db2.gz LLAVRWFWCNTSQG-GFCCVEGCSA-N -1 1 313.430 4.040 20 0 DIADMM CC(C)(NCc1cccc([O-])c1Cl)c1ccc(F)cc1F ZINC001474269223 1061835193 /nfs/dbraw/zinc/83/51/93/1061835193.db2.gz WJUOAOPFTXVSKO-UHFFFAOYSA-N -1 1 311.759 4.349 20 0 DIADMM O=C(c1ccc([O-])c(F)c1)N1CCC[C@@H]1CCC1CCCCC1 ZINC001466052677 1061865340 /nfs/dbraw/zinc/86/53/40/1061865340.db2.gz XBNQSSPDIRBAII-MRXNPFEDSA-N -1 1 319.420 4.496 20 0 DIADMM C[C@H]1CCN(Cc2ccc([O-])c(F)c2F)[C@H](c2ccco2)C1 ZINC001474319927 1061897780 /nfs/dbraw/zinc/89/77/80/1061897780.db2.gz SYLFNOKOVDBUES-AAEUAGOBSA-N -1 1 307.340 4.237 20 0 DIADMM O=C(Nc1ccc(Cl)cc1[O-])c1cc(-c2ccccc2)ccn1 ZINC001466630889 1061977278 /nfs/dbraw/zinc/97/72/78/1061977278.db2.gz CPDWDQSAHOJYHL-UHFFFAOYSA-N -1 1 324.767 4.360 20 0 DIADMM [O-]c1cc(F)c(F)c(-c2nnc(-c3cccc(Cl)c3)o2)c1 ZINC001253807102 1061987963 /nfs/dbraw/zinc/98/79/63/1061987963.db2.gz UMEIQBXSVQQIDV-UHFFFAOYSA-N -1 1 308.671 4.041 20 0 DIADMM CCCc1ccc(CSc2nc(CC)c(C)c(=O)[n-]2)cc1 ZINC001459112752 1062013452 /nfs/dbraw/zinc/01/34/52/1062013452.db2.gz NTWFEYWJHMFBOC-UHFFFAOYSA-N -1 1 302.443 4.298 20 0 DIADMM [O-]c1c2ccccc2cc(O)c1-c1nnc(-c2cccc(F)c2)o1 ZINC001254149794 1062033024 /nfs/dbraw/zinc/03/30/24/1062033024.db2.gz GGJXIOMPQYDEJX-UHFFFAOYSA-N -1 1 322.295 4.107 20 0 DIADMM CCc1ccccc1CCSc1nc(C)c(C2CC2)c(=O)[n-]1 ZINC001459212321 1062044940 /nfs/dbraw/zinc/04/49/40/1062044940.db2.gz MRVGRYPCRPQMPR-UHFFFAOYSA-N -1 1 314.454 4.265 20 0 DIADMM [O-]c1ccc(-c2nnc(Cc3ccc(Cl)cc3)o2)c(Cl)c1 ZINC001254228245 1062060077 /nfs/dbraw/zinc/06/00/77/1062060077.db2.gz GUNYZKPIFDNVJI-UHFFFAOYSA-N -1 1 321.163 4.340 20 0 DIADMM CCOc1ccc(-c2nnc([C@H]3C[C@H]3c3ccccc3)o2)c([O-])c1 ZINC001254513076 1062153253 /nfs/dbraw/zinc/15/32/53/1062153253.db2.gz MWNICIVYEHZQMG-HOTGVXAUSA-N -1 1 322.364 4.112 20 0 DIADMM [O-]c1ccc(-c2nnc([C@H]3C[C@H]3c3ccccc3)o2)c(Cl)c1 ZINC001254511616 1062154044 /nfs/dbraw/zinc/15/40/44/1062154044.db2.gz CZOKPPOJSJVDNU-KBPBESRZSA-N -1 1 312.756 4.367 20 0 DIADMM CC(C)CCC[C@H](C)NC(=O)NCc1ccc([O-])c(Cl)c1 ZINC001467629929 1062164819 /nfs/dbraw/zinc/16/48/19/1062164819.db2.gz KCGAJEOWBJEHIS-LBPRGKRZSA-N -1 1 312.841 4.060 20 0 DIADMM CC[C@@H](Sc1ccccc1)C(=O)Nc1ccc([O-])c(F)c1F ZINC001468003043 1062245258 /nfs/dbraw/zinc/24/52/58/1062245258.db2.gz FCJGPIAHTYLQBH-CYBMUJFWSA-N -1 1 323.364 4.180 20 0 DIADMM Cc1ccc(C)c(S(=O)(=O)[N-]c2cccc3sccc32)c1 ZINC001254794287 1062251899 /nfs/dbraw/zinc/25/18/99/1062251899.db2.gz MVJQEOOCKSJDPY-UHFFFAOYSA-N -1 1 317.435 4.319 20 0 DIADMM CCc1ccc(S(=O)(=O)[N-]c2ccc3oc(C)cc3c2)cc1 ZINC001255081404 1062306665 /nfs/dbraw/zinc/30/66/65/1062306665.db2.gz ZVBGFYWMXGFCHX-UHFFFAOYSA-N -1 1 315.394 4.104 20 0 DIADMM CCCc1ccc(S(=O)(=O)[N-]c2ccccc2C2CC2)cc1 ZINC001255136785 1062327770 /nfs/dbraw/zinc/32/77/70/1062327770.db2.gz OTXZOIMWPBNVGQ-UHFFFAOYSA-N -1 1 315.438 4.317 20 0 DIADMM C=Cc1cccc([N-]S(=O)(=O)c2ccc(CCC)cc2)c1 ZINC001255216583 1062357423 /nfs/dbraw/zinc/35/74/23/1062357423.db2.gz AJQRJDJLYLCDCR-UHFFFAOYSA-N -1 1 301.411 4.083 20 0 DIADMM CCCc1ccc(S(=O)(=O)[N-]c2ccc3c(c2)N=NC3)cc1 ZINC001255222517 1062359813 /nfs/dbraw/zinc/35/98/13/1062359813.db2.gz AALGWFMNABJXHZ-UHFFFAOYSA-N -1 1 315.398 4.037 20 0 DIADMM CC(C)[C@H](Cc1ccccc1)C(=O)Nc1cc([O-])c(F)cc1F ZINC001468748588 1062392911 /nfs/dbraw/zinc/39/29/11/1062392911.db2.gz YVAIOXGEFGTAFI-ZDUSSCGKSA-N -1 1 319.351 4.124 20 0 DIADMM C/C(=C/c1cccc(Cl)c1)C(=O)Nc1cc([O-])c(F)cc1F ZINC001468747662 1062393328 /nfs/dbraw/zinc/39/33/28/1062393328.db2.gz KEQXFXOYGLSNOJ-UITAMQMPSA-N -1 1 323.726 4.366 20 0 DIADMM Cc1cc(Cl)ccc1-c1nnc(-c2cccc([O-])c2F)o1 ZINC001255346576 1062411833 /nfs/dbraw/zinc/41/18/33/1062411833.db2.gz DDSOPSLDBAJTPP-UHFFFAOYSA-N -1 1 304.708 4.210 20 0 DIADMM C[C@H](NC(=O)c1cc2ccccc2cc1[O-])[C@H]1CCC[C@H](C)C1 ZINC001469046908 1062467526 /nfs/dbraw/zinc/46/75/26/1062467526.db2.gz WCRLMRSFXNDQAD-KKUMJFAQSA-N -1 1 311.425 4.490 20 0 DIADMM C[C@H](NC(=O)c1cc2ccccc2cc1[O-])[C@H]1CCC[C@@H](C)C1 ZINC001469046907 1062467782 /nfs/dbraw/zinc/46/77/82/1062467782.db2.gz WCRLMRSFXNDQAD-ILXRZTDVSA-N -1 1 311.425 4.490 20 0 DIADMM O=C(Nc1cc(F)cc(F)c1[O-])c1cccc2c1CCCCC2 ZINC001469159886 1062491189 /nfs/dbraw/zinc/49/11/89/1062491189.db2.gz GTKJCSAHQZIOTB-UHFFFAOYSA-N -1 1 317.335 4.192 20 0 DIADMM O=C(CCCCc1ccccc1)Nc1cc(F)cc(F)c1[O-] ZINC001469162914 1062491699 /nfs/dbraw/zinc/49/16/99/1062491699.db2.gz ZTSGDBKSXINVFY-UHFFFAOYSA-N -1 1 305.324 4.022 20 0 DIADMM C[C@@H]([N-]S(=O)(=O)c1sccc1Cl)C1CCCCCC1 ZINC001475182323 1062496082 /nfs/dbraw/zinc/49/60/82/1062496082.db2.gz UGZCGKCPDXSICH-SNVBAGLBSA-N -1 1 321.895 4.039 20 0 DIADMM Cc1cc2scc(CC(=O)Nc3c([O-])cccc3F)c2s1 ZINC001469929582 1062662081 /nfs/dbraw/zinc/66/20/81/1062662081.db2.gz UKMIMDZEHBSLQM-UHFFFAOYSA-N -1 1 321.398 4.297 20 0 DIADMM CCCOc1ccc(-c2nnc(-c3ccc(F)c([O-])c3)o2)cc1 ZINC001256302709 1062766898 /nfs/dbraw/zinc/76/68/98/1062766898.db2.gz VQUBKRKCJXOFKM-UHFFFAOYSA-N -1 1 314.316 4.037 20 0 DIADMM O=C(Nc1ncsc1C1CC1)Nc1ccc([O-])c(Cl)c1 ZINC001477050381 1062776584 /nfs/dbraw/zinc/77/65/84/1062776584.db2.gz ZWFNGDHMFGRADA-UHFFFAOYSA-N -1 1 309.778 4.024 20 0 DIADMM CC(C)(C)c1ccc(NC(=O)Nc2ccc([O-])c(Cl)c2)cn1 ZINC001477179343 1062802889 /nfs/dbraw/zinc/80/28/89/1062802889.db2.gz GNJKVPSQBYOZNJ-UHFFFAOYSA-N -1 1 319.792 4.382 20 0 DIADMM CC[C@@](C)(NC(=O)c1cc(Cl)ccc1[O-])c1ccc(F)cc1 ZINC001471018846 1062912002 /nfs/dbraw/zinc/91/20/02/1062912002.db2.gz WGEHRDKNKNTGCH-QGZVFWFLSA-N -1 1 321.779 4.240 20 0 DIADMM O=C(Nc1cccc(F)c1[O-])c1ccc(OC2CCCC2)cc1 ZINC001471166586 1062930597 /nfs/dbraw/zinc/93/05/97/1062930597.db2.gz MFGXVRGPYZPNQN-UHFFFAOYSA-N -1 1 315.344 4.105 20 0 DIADMM O=C(Nc1cccc(F)c1[O-])c1c(Cl)cccc1Cl ZINC001471166158 1062933156 /nfs/dbraw/zinc/93/31/56/1062933156.db2.gz AQMRDBZLJZUCSD-UHFFFAOYSA-N -1 1 300.116 4.090 20 0 DIADMM O=C(Nc1cccc(F)c1[O-])c1ccc(-c2ccccc2F)o1 ZINC001471167173 1062933479 /nfs/dbraw/zinc/93/34/79/1062933479.db2.gz ZRDFJFILTVALCT-UHFFFAOYSA-N -1 1 315.275 4.183 20 0 DIADMM CC(C)[C@H]1N(C(=O)c2cc(F)ccc2[O-])CC12CCCCCC2 ZINC001471199345 1062941048 /nfs/dbraw/zinc/94/10/48/1062941048.db2.gz VTXSOJPRQHATMR-QGZVFWFLSA-N -1 1 319.420 4.352 20 0 DIADMM CC(C)CC1CCN(C(=O)NCc2ccc([O-])c(Cl)c2)CC1 ZINC001471235993 1062951253 /nfs/dbraw/zinc/95/12/53/1062951253.db2.gz PKKFAHWXNASBKP-UHFFFAOYSA-N -1 1 324.852 4.013 20 0 DIADMM CCSc1ccccc1C(=O)NCc1ccc([O-])c(Cl)c1 ZINC001471699512 1063016383 /nfs/dbraw/zinc/01/63/83/1063016383.db2.gz HMMFGBZUPZVYJF-UHFFFAOYSA-N -1 1 321.829 4.088 20 0 DIADMM CC(C)Oc1ccc(-c2nnc(-c3ccc([O-])cc3F)o2)cc1 ZINC001256921627 1063050937 /nfs/dbraw/zinc/05/09/37/1063050937.db2.gz WSEHASJUWVGJKZ-UHFFFAOYSA-N -1 1 314.316 4.036 20 0 DIADMM Cc1cccc(S(=O)(=O)[N-]c2cccc3ccc(C)cc32)c1 ZINC001256946942 1063058768 /nfs/dbraw/zinc/05/87/68/1063058768.db2.gz WCICSZZFZAYPSR-UHFFFAOYSA-N -1 1 311.406 4.257 20 0 DIADMM O=C(Nc1ccc([O-])c(F)c1F)c1c(Cl)oc2ccccc21 ZINC001472562422 1063104154 /nfs/dbraw/zinc/10/41/54/1063104154.db2.gz GMVRVWPMBBNUAB-UHFFFAOYSA-N -1 1 323.682 4.322 20 0 DIADMM Cc1ccc([C@H]2C[C@H]2c2nnc(-c3cccc([O-])c3F)o2)cc1 ZINC001257325490 1063208900 /nfs/dbraw/zinc/20/89/00/1063208900.db2.gz RUNIHZZJPSLKOE-ZIAGYGMSSA-N -1 1 310.328 4.161 20 0 DIADMM Cc1ccc([C@@H]2C[C@H]2c2nnc(-c3cc([O-])cc(F)c3)o2)cc1 ZINC001257325933 1063208947 /nfs/dbraw/zinc/20/89/47/1063208947.db2.gz VGPGMOQIPLYQMD-JKSUJKDBSA-N -1 1 310.328 4.161 20 0 DIADMM CC[C@H](OCCSc1nc(C)c(C)c(=O)[n-]1)c1ccccc1 ZINC001473010590 1063355299 /nfs/dbraw/zinc/35/52/99/1063355299.db2.gz ASAZBKBVBGBIEY-HNNXBMFYSA-N -1 1 318.442 4.059 20 0 DIADMM CC1(C)CCC(C)(NC(=O)NCc2ccc([O-])c(Cl)c2)CC1 ZINC001479212423 1063399255 /nfs/dbraw/zinc/39/92/55/1063399255.db2.gz SIFFEHLEECULAG-UHFFFAOYSA-N -1 1 324.852 4.204 20 0 DIADMM O=C(N[C@H](CC1CCC1)c1ccccc1)c1cc(F)ccc1[O-] ZINC001546282220 1063502065 /nfs/dbraw/zinc/50/20/65/1063502065.db2.gz NWWPZTQEZNTYGD-QGZVFWFLSA-N -1 1 313.372 4.193 20 0 DIADMM CC(C)CCc1nnc(-c2ccc(C(F)(F)F)cc2[O-])o1 ZINC001258270817 1063582871 /nfs/dbraw/zinc/58/28/71/1063582871.db2.gz TXINXDCJWHVBTM-UHFFFAOYSA-N -1 1 300.280 4.050 20 0 DIADMM Cc1ccc(-c2nc(C(=O)[N-]c3cnoc3C(C)C)cs2)o1 ZINC001514579663 1063594482 /nfs/dbraw/zinc/59/44/82/1063594482.db2.gz BXQHRYGCPQOJNU-UHFFFAOYSA-N -1 1 317.370 4.075 20 0 DIADMM Cc1ccc(-c2nnc(-c3ccc4cccnc4c3[O-])o2)cc1F ZINC001258719428 1063775008 /nfs/dbraw/zinc/77/50/08/1063775008.db2.gz XFZBGYSOPGNQDT-UHFFFAOYSA-N -1 1 321.311 4.105 20 0 DIADMM Cc1ccc(S(=O)(=O)[N-]c2cc3cccccc-3c2)c(C)c1 ZINC001259097087 1063882591 /nfs/dbraw/zinc/88/25/91/1063882591.db2.gz YSIKOBOBOARATQ-UHFFFAOYSA-N -1 1 311.406 4.209 20 0 DIADMM Cc1cc2cc([N-]S(=O)(=O)c3ccc(C)c(C)c3)ccc2o1 ZINC001259167549 1063885578 /nfs/dbraw/zinc/88/55/78/1063885578.db2.gz ASQNUZOGNNQONT-UHFFFAOYSA-N -1 1 315.394 4.159 20 0 DIADMM Cc1ccc([C@@H]2C[C@H]2C(=O)Nc2cc(F)cc(F)c2[O-])cc1C ZINC001299581044 1063887785 /nfs/dbraw/zinc/88/77/85/1063887785.db2.gz MIDQQWXAURBUPG-UONOGXRCSA-N -1 1 317.335 4.029 20 0 DIADMM O=C(Nc1cc(F)cc(F)c1[O-])c1cc2ccccc2s1 ZINC001299580238 1063887989 /nfs/dbraw/zinc/88/79/89/1063887989.db2.gz OOFUZANUKXTNOT-UHFFFAOYSA-N -1 1 305.305 4.137 20 0 DIADMM CC[C@@H](C)c1ccccc1[N-]S(=O)(=O)c1ccc(C)c(F)c1 ZINC001259473942 1063889446 /nfs/dbraw/zinc/88/94/46/1063889446.db2.gz USNGSECUDLPXDP-GFCCVEGCSA-N -1 1 321.417 4.448 20 0 DIADMM Cc1ccc(S(=O)(=O)[N-]c2ccccc2CC(C)C)cc1F ZINC001259480842 1063889577 /nfs/dbraw/zinc/88/95/77/1063889577.db2.gz WWKGXCOCVAEYRO-UHFFFAOYSA-N -1 1 321.417 4.133 20 0 DIADMM Cc1cc(F)ccc1S(=O)(=O)[N-]c1ccc2sccc2c1 ZINC001259491332 1063889711 /nfs/dbraw/zinc/88/97/11/1063889711.db2.gz VHTAIYUPJYAZJV-UHFFFAOYSA-N -1 1 321.398 4.150 20 0 DIADMM CC[C@@H](C)S(=O)(=O)[N-]c1ccccc1Oc1ccccc1C ZINC001260738902 1063904086 /nfs/dbraw/zinc/90/40/86/1063904086.db2.gz SBXACGHLEZMNRZ-CQSZACIVSA-N -1 1 319.426 4.328 20 0 DIADMM CC[C@@H](C)S(=O)(=O)[N-]c1ccccc1Oc1ccc(F)cc1 ZINC001260723240 1063904763 /nfs/dbraw/zinc/90/47/63/1063904763.db2.gz KWJQYDBPLKKGJP-GFCCVEGCSA-N -1 1 323.389 4.158 20 0 DIADMM C=Cc1ccccc1[N-]S(=O)(=O)c1ccc2c(c1)CCCC2 ZINC001260982540 1063905909 /nfs/dbraw/zinc/90/59/09/1063905909.db2.gz QFMMARJADIQVMY-UHFFFAOYSA-N -1 1 313.422 4.009 20 0 DIADMM Cc1cccc(S(=O)(=O)[N-]c2cc(C)c(Cl)cc2C)c1C ZINC001260998147 1063908016 /nfs/dbraw/zinc/90/80/16/1063908016.db2.gz MLTPPFXEQRXVRR-UHFFFAOYSA-N -1 1 323.845 4.374 20 0 DIADMM CCc1nc(NC(=O)c2ccc3ccccc3c2[O-])sc1C ZINC000386010389 1064033384 /nfs/dbraw/zinc/03/33/84/1064033384.db2.gz NQCJWFSVWONDQO-UHFFFAOYSA-N -1 1 312.394 4.125 20 0 DIADMM CC[C@@H](C)N(Cc1ccccc1)C(=O)c1ccc(Cl)cc1[O-] ZINC000387271768 1064069888 /nfs/dbraw/zinc/06/98/88/1064069888.db2.gz MYBLDBGNAIBDMR-CYBMUJFWSA-N -1 1 317.816 4.487 20 0 DIADMM CC(C)(C)[C@H]1CCC[C@]([N-]C(=O)C(F)F)(C(F)(F)F)CC1 ZINC001288625782 1064559219 /nfs/dbraw/zinc/55/92/19/1064559219.db2.gz RZACKGNRFBCKEG-TVQRCGJNSA-N -1 1 315.326 4.295 20 0 DIADMM O=C(Nc1ccccc1SC1CCCC1)c1ccc([O-])cn1 ZINC001290817324 1064712668 /nfs/dbraw/zinc/71/26/68/1064712668.db2.gz BBMLLCJJOATYTP-UHFFFAOYSA-N -1 1 314.410 4.074 20 0 DIADMM CC(C)c1ccc(C(=O)Nc2ccc3c(c2)CCCO3)c([O-])c1 ZINC001292581972 1064780974 /nfs/dbraw/zinc/78/09/74/1064780974.db2.gz SPQVRLZRGICOIJ-UHFFFAOYSA-N -1 1 311.381 4.093 20 0 DIADMM Cc1ccccc1[C@@H](CC(C)C)NC(=O)c1cc(F)ccc1[O-] ZINC001293385117 1064811664 /nfs/dbraw/zinc/81/16/64/1064811664.db2.gz CTIWGFPMFQWNRU-QGZVFWFLSA-N -1 1 315.388 4.357 20 0 DIADMM C[C@@H]1Cc2ccccc2CN1C(=O)c1cc2ccccc2cc1[O-] ZINC001294184029 1064853121 /nfs/dbraw/zinc/85/31/21/1064853121.db2.gz PCSZIYLEJZUJIX-CQSZACIVSA-N -1 1 317.388 4.132 20 0 DIADMM C[C@@H]1Cc2ccccc2CN1C(=O)c1ccc2ccccc2c1[O-] ZINC001294184750 1064855259 /nfs/dbraw/zinc/85/52/59/1064855259.db2.gz VNVCMHQAOLFDMJ-CQSZACIVSA-N -1 1 317.388 4.132 20 0 DIADMM O=C(c1ccc([O-])cc1F)N1CC2(CCCC2)c2ccccc21 ZINC001294422511 1064867015 /nfs/dbraw/zinc/86/70/15/1064867015.db2.gz RFAINKHAMVLRJA-UHFFFAOYSA-N -1 1 311.356 4.004 20 0 DIADMM O=C(Nc1ccc([O-])c(Cl)c1)c1c(F)ccc(F)c1Cl ZINC001295295353 1064908819 /nfs/dbraw/zinc/90/88/19/1064908819.db2.gz LRRNTEBXZALUDZ-UHFFFAOYSA-N -1 1 318.106 4.230 20 0 DIADMM O=C(NC1CCC2(CCCCC2)CC1)c1cccc([O-])c1F ZINC001296445839 1064946323 /nfs/dbraw/zinc/94/63/23/1064946323.db2.gz VTSXZSDIJUAGRF-UHFFFAOYSA-N -1 1 305.393 4.154 20 0 DIADMM C[C@@H](CSc1ccccc1)C(=O)Nc1ccc([O-])c(F)c1F ZINC001297821934 1064991204 /nfs/dbraw/zinc/99/12/04/1064991204.db2.gz ZMBXONXZEAVBCK-JTQLQIEISA-N -1 1 323.364 4.037 20 0 DIADMM CSc1ccc([O-])c(C(=O)Nc2cccc(OC(C)C)c2)c1 ZINC001298242893 1065000294 /nfs/dbraw/zinc/00/02/94/1065000294.db2.gz HADNBUMKDVLOQW-UHFFFAOYSA-N -1 1 317.410 4.154 20 0 DIADMM C/C=C\C[C@@H]1CCCN(C(=O)c2cc3ccccc3cc2[O-])C1 ZINC001301885498 1065075799 /nfs/dbraw/zinc/07/57/99/1065075799.db2.gz YNHUERXPXVMUTD-MPNWYJEXSA-N -1 1 309.409 4.364 20 0 DIADMM C[C@H](C(=O)Nc1cccc(F)c1[O-])c1ccc2ccccc2c1 ZINC001302487731 1065089610 /nfs/dbraw/zinc/08/96/10/1065089610.db2.gz WTNAIGGLPQOGRB-LBPRGKRZSA-N -1 1 309.340 4.427 20 0 DIADMM CCSCc1ccc(C(=O)Nc2cccc(F)c2[O-])cc1 ZINC001302485120 1065089770 /nfs/dbraw/zinc/08/97/70/1065089770.db2.gz JSMURDQYTWAONH-UHFFFAOYSA-N -1 1 305.374 4.037 20 0 DIADMM CC(C)[C@H](C(=O)NCc1ccc([O-])c(Cl)c1)c1ccccc1 ZINC001303298689 1065113514 /nfs/dbraw/zinc/11/35/14/1065113514.db2.gz HTKSACCEFZMWLH-KRWDZBQOSA-N -1 1 317.816 4.102 20 0 DIADMM Cc1ccc(F)c(C(=O)Nc2cc(F)c([O-])cc2Cl)c1F ZINC001304284882 1065135895 /nfs/dbraw/zinc/13/58/95/1065135895.db2.gz RQPOVDCFZASTAN-UHFFFAOYSA-N -1 1 315.678 4.024 20 0 DIADMM O=C(Nc1cc(F)c([O-])cc1Cl)[C@H]1C[C@@]1(F)c1ccccc1 ZINC001304283324 1065135978 /nfs/dbraw/zinc/13/59/78/1065135978.db2.gz WQRBMVZFRCFQGK-QLJPJBMISA-N -1 1 323.726 4.008 20 0 DIADMM C[C@@H](NC(=O)c1ccc(F)c([O-])c1)c1cccc2ccccc21 ZINC001304767391 1065144067 /nfs/dbraw/zinc/14/40/67/1065144067.db2.gz FVVHEBPHVOTJHG-GFCCVEGCSA-N -1 1 309.340 4.176 20 0 DIADMM CCCCOc1ccc(C(=O)Nc2ccc(C)c(F)c2)c([O-])c1 ZINC001306167571 1065172879 /nfs/dbraw/zinc/17/28/79/1065172879.db2.gz BOQCPKAMFKWHHM-UHFFFAOYSA-N -1 1 317.360 4.271 20 0 DIADMM CCCCCC[C@H](C)[N-]S(=O)(=O)c1cc(Cl)ccc1F ZINC001309037167 1066440363 /nfs/dbraw/zinc/44/03/63/1066440363.db2.gz NLFJEVDKHNJUCV-NSHDSACASA-N -1 1 321.845 4.116 20 0 DIADMM Cc1c(=O)[n-]c(SCCC(F)(F)F)nc1-c1ccccc1 ZINC000274328262 130226974 /nfs/dbraw/zinc/22/69/74/130226974.db2.gz KEOVRFKEGIYXPB-UHFFFAOYSA-N -1 1 314.332 4.202 20 0 DIADMM CSc1ccc(Cl)cc1[N-]C(=O)c1ocnc1C1CC1 ZINC000289153368 131362575 /nfs/dbraw/zinc/36/25/75/131362575.db2.gz LCAXUQZGEFNTLW-UHFFFAOYSA-N -1 1 308.790 4.180 20 0 DIADMM [O-]c1c(-c2nc(-c3ccc(F)cc3)no2)ccc2ccccc21 ZINC000320503603 335065824 /nfs/dbraw/zinc/06/58/24/335065824.db2.gz XJCQLCYVBYCJJO-UHFFFAOYSA-N -1 1 306.296 4.402 20 0 DIADMM O=C([N-]c1c(F)cc(F)cc1F)c1coc(-c2ccccc2)n1 ZINC000175307331 332885463 /nfs/dbraw/zinc/88/54/63/332885463.db2.gz KAFNMYVMLAXOJJ-UHFFFAOYSA-N -1 1 318.254 4.011 20 0 DIADMM O=C([O-])CCC1CCN(Cc2cc(Cl)ccc2Cl)CC1 ZINC000087761543 331791575 /nfs/dbraw/zinc/79/15/75/331791575.db2.gz GNQCKJCPZCRLEB-UHFFFAOYSA-N -1 1 316.228 4.070 20 0 DIADMM CC[C@@H](Sc1nc(C(F)(F)F)cc(=O)[n-]1)c1ccccc1 ZINC000518336799 332015480 /nfs/dbraw/zinc/01/54/80/332015480.db2.gz NQGDHOJMNCSFHG-SNVBAGLBSA-N -1 1 314.332 4.444 20 0 DIADMM CC(C)(c1nc(-c2ccc([O-])c(F)c2)no1)c1cccc(F)c1 ZINC000445483530 332107584 /nfs/dbraw/zinc/10/75/84/332107584.db2.gz SGPULMYROGRSHM-UHFFFAOYSA-N -1 1 316.307 4.046 20 0 DIADMM O=c1cc(C(F)F)nc(S[C@H]2CCCc3ccccc32)[n-]1 ZINC000569531528 332126338 /nfs/dbraw/zinc/12/63/38/332126338.db2.gz ASINVYYNECXCEJ-LBPRGKRZSA-N -1 1 308.353 4.290 20 0 DIADMM Cc1ccccc1[C@H](CC(=O)[O-])NCc1cccc(Cl)c1F ZINC000426789102 332153490 /nfs/dbraw/zinc/15/34/90/332153490.db2.gz RQJREVKDVUQLLC-HNNXBMFYSA-N -1 1 321.779 4.093 20 0 DIADMM CC(C)c1ccc([C@H](CC(=O)[O-])NCc2ccccc2F)cc1 ZINC000426805983 332155651 /nfs/dbraw/zinc/15/56/51/332155651.db2.gz HPCXQBKAFNIXPZ-SFHVURJKSA-N -1 1 315.388 4.255 20 0 DIADMM CC[C@@H](NC(=O)c1ccc([O-])cc1F)c1ccc(Cl)cc1 ZINC000181085692 333029560 /nfs/dbraw/zinc/02/95/60/333029560.db2.gz HFUOVBYYGJYWHA-OAHLLOKOSA-N -1 1 307.752 4.066 20 0 DIADMM Cc1c(NC(=O)c2ccc([O-])cc2F)sc2c1CCCC2 ZINC000181234183 333029680 /nfs/dbraw/zinc/02/96/80/333029680.db2.gz FGCHFWFTMKSXMA-UHFFFAOYSA-N -1 1 305.374 4.032 20 0 DIADMM CC(C)c1cccc(S(=O)(=O)[N-]c2ccc(Cl)cc2)c1 ZINC000460432572 333085890 /nfs/dbraw/zinc/08/58/90/333085890.db2.gz UKYATHQWDJIIAB-UHFFFAOYSA-N -1 1 309.818 4.264 20 0 DIADMM Cc1ccc(C)c([N-]S(=O)(=O)c2ccccc2C(C)(C)C)c1 ZINC000460437659 333087090 /nfs/dbraw/zinc/08/70/90/333087090.db2.gz MQIBNPAROMPQIZ-UHFFFAOYSA-N -1 1 317.454 4.402 20 0 DIADMM CC(C)(C)C1=CCN(C(=O)c2ccc3ccccc3c2[O-])CC1 ZINC000323390311 333107261 /nfs/dbraw/zinc/10/72/61/333107261.db2.gz IQAORWCMWDGHPV-UHFFFAOYSA-N -1 1 309.409 4.364 20 0 DIADMM O=C([N-]c1ccsc1Cl)c1cc(-c2ccccc2)no1 ZINC000186927707 333381925 /nfs/dbraw/zinc/38/19/25/333381925.db2.gz PEACYOKFXRJASC-UHFFFAOYSA-N -1 1 304.758 4.309 20 0 DIADMM O=C(c1ccc2ccccc2c1[O-])N1CCCc2ccccc21 ZINC000319819392 333410346 /nfs/dbraw/zinc/41/03/46/333410346.db2.gz LSEUILLGJGVSJS-UHFFFAOYSA-N -1 1 303.361 4.138 20 0 DIADMM O=c1cc(C(F)F)nc(SCC2CCC(F)(F)CC2)[n-]1 ZINC000413002034 333824820 /nfs/dbraw/zinc/82/48/20/333824820.db2.gz MRRAZIJUKUJNBH-UHFFFAOYSA-N -1 1 310.316 4.037 20 0 DIADMM CCc1cc(=O)[n-]c(S[C@@H](C)c2ccc3c(c2)CCC3)n1 ZINC000413004028 333825068 /nfs/dbraw/zinc/82/50/68/333825068.db2.gz JSLWASWQGYXGBQ-NSHDSACASA-N -1 1 300.427 4.087 20 0 DIADMM C[C@@H](N[C@@H](CCC(C)(C)C)C(=O)[O-])c1cc2ccccc2o1 ZINC000414667926 334063542 /nfs/dbraw/zinc/06/35/42/334063542.db2.gz WYJVZLPPHAOATK-OCCSQVGLSA-N -1 1 303.402 4.363 20 0 DIADMM CCOc1cc(-c2nc(CCC(C)C)no2)cc(Cl)c1[O-] ZINC000443085608 338443858 /nfs/dbraw/zinc/44/38/58/338443858.db2.gz LOUYLKOTHBWJDR-UHFFFAOYSA-N -1 1 310.781 4.083 20 0 DIADMM O=C(Nc1ccc(F)cc1[O-])[C@H]1C[C@@H]1c1c(F)cccc1Cl ZINC000532012884 334373812 /nfs/dbraw/zinc/37/38/12/334373812.db2.gz MPZQNLAETATVPN-UWVGGRQHSA-N -1 1 323.726 4.066 20 0 DIADMM O=C(Nc1ccc([O-])c(Cl)c1)C1(Cc2ccccc2F)CC1 ZINC000188967803 334879560 /nfs/dbraw/zinc/87/95/60/334879560.db2.gz YVMYCVHGIKJIMW-UHFFFAOYSA-N -1 1 319.763 4.146 20 0 DIADMM Cc1cc(-c2nc(-c3ccc([O-])c(F)c3)no2)c(Cl)cc1F ZINC000445470244 338495726 /nfs/dbraw/zinc/49/57/26/338495726.db2.gz DNSMOXGSQZJCNW-UHFFFAOYSA-N -1 1 322.698 4.349 20 0 DIADMM [O-]c1ccc(-c2noc([C@H]3CCCc4sccc43)n2)cc1F ZINC000445475777 338496022 /nfs/dbraw/zinc/49/60/22/338496022.db2.gz VLYBQFYBPWNUKE-NSHDSACASA-N -1 1 316.357 4.111 20 0 DIADMM [O-]c1cccc(CN(Cc2ccco2)Cc2ccco2)c1Cl ZINC000350278399 335742524 /nfs/dbraw/zinc/74/25/24/335742524.db2.gz LMIDRVCIMMHDAA-UHFFFAOYSA-N -1 1 317.772 4.434 20 0 DIADMM C[C@H]1CN(Cc2cccc([O-])c2Cl)C[C@@H](c2ccsc2)O1 ZINC000351686359 336058204 /nfs/dbraw/zinc/05/82/04/336058204.db2.gz QSNSDIHPZXDNFL-NHYWBVRUSA-N -1 1 323.845 4.069 20 0 DIADMM C[C@H](CC(=O)Nc1ccc([O-])c(Cl)c1)c1cccc(F)c1 ZINC000116469404 336251037 /nfs/dbraw/zinc/25/10/37/336251037.db2.gz SMKNYLULHRWOQR-SNVBAGLBSA-N -1 1 307.752 4.317 20 0 DIADMM O=C(Nc1ccc([O-])c(Cl)c1)[C@H]1C[C@H]1c1c(F)cccc1F ZINC000116469378 336251061 /nfs/dbraw/zinc/25/10/61/336251061.db2.gz PEEBZIFGKOHPGX-ZJUUUORDSA-N -1 1 323.726 4.066 20 0 DIADMM O=C(Nc1ccc(F)cc1[O-])c1cc2c(ccc3ccccc23)[nH]1 ZINC000532621067 336257168 /nfs/dbraw/zinc/25/71/68/336257168.db2.gz PPTZRJUBMPLWQO-UHFFFAOYSA-N -1 1 320.323 4.418 20 0 DIADMM Cc1cccc(OCCCCC(=O)Nc2ccc(F)cc2[O-])c1 ZINC000532621111 336257195 /nfs/dbraw/zinc/25/71/95/336257195.db2.gz YNAIJGJAWHPCNO-UHFFFAOYSA-N -1 1 317.360 4.028 20 0 DIADMM COc1cc(-c2nc(C3CCC(C)CC3)no2)cc(Cl)c1[O-] ZINC000443224290 336961846 /nfs/dbraw/zinc/96/18/46/336961846.db2.gz OJPQYCDVZNGUOS-UHFFFAOYSA-N -1 1 322.792 4.398 20 0 DIADMM CSc1ccc(C(=O)[N-]c2c(C)noc2-c2ccccc2)o1 ZINC000122625206 337016796 /nfs/dbraw/zinc/01/67/96/337016796.db2.gz JRNOSEBTARURHT-UHFFFAOYSA-N -1 1 314.366 4.217 20 0 DIADMM CCC(C)(C)CC[N@@H+](CCC(=O)[O-])Cc1cccc(F)c1F ZINC000582612421 337114449 /nfs/dbraw/zinc/11/44/49/337114449.db2.gz UFOQVMSQKXVTIX-UHFFFAOYSA-N -1 1 313.388 4.068 20 0 DIADMM Cc1cc(C(=O)Nc2ccc([O-])c(Cl)c2)c(C)n1C1CC1 ZINC000182869759 337190415 /nfs/dbraw/zinc/19/04/15/337190415.db2.gz CUBALCIXWBAMJM-UHFFFAOYSA-N -1 1 304.777 4.051 20 0 DIADMM CC(C)(C)Oc1ccc(NC(=O)c2c(F)ccc([O-])c2F)cc1 ZINC000584556713 337360661 /nfs/dbraw/zinc/36/06/61/337360661.db2.gz QVVHRJIGKMGLFB-UHFFFAOYSA-N -1 1 321.323 4.100 20 0 DIADMM C/C=C/c1ccc([N-]S(=O)(=O)c2ccccc2SC)cc1 ZINC000564062034 337450977 /nfs/dbraw/zinc/45/09/77/337450977.db2.gz QEKBKPWLHREKDD-ZZXKWVIFSA-N -1 1 319.451 4.242 20 0 DIADMM CCOc1cc(-c2noc([C@@H]3CC[C@H](C)C3)n2)cc(Cl)c1[O-] ZINC000445429493 337729653 /nfs/dbraw/zinc/72/96/53/337729653.db2.gz ABDJSFGHOWPDFP-VHSXEESVSA-N -1 1 322.792 4.398 20 0 DIADMM Cc1ccc(CCCC(=O)Nc2ccc([O-])c(Cl)c2)cc1 ZINC000533081600 337812355 /nfs/dbraw/zinc/81/23/55/337812355.db2.gz MHKRXEIYXFFVEM-UHFFFAOYSA-N -1 1 303.789 4.315 20 0 DIADMM O=C(Nc1ccc([O-])c(Cl)c1)[C@@H]1C[C@@H]1c1cccc(Cl)c1 ZINC000533081550 337812374 /nfs/dbraw/zinc/81/23/74/337812374.db2.gz ABWVJJLAMLOYMZ-CHWSQXEVSA-N -1 1 322.191 4.441 20 0 DIADMM CC(C)(C)[C@H](NC(=O)Nc1ccc([O-])c(Cl)c1)C(F)(F)F ZINC000516526019 338014627 /nfs/dbraw/zinc/01/46/27/338014627.db2.gz XHHQVUILBVGERP-JTQLQIEISA-N -1 1 324.730 4.144 20 0 DIADMM Cc1ccc2cc(-c3nc(-c4ccc([O-])cc4F)no3)ccc2n1 ZINC000445456215 338017504 /nfs/dbraw/zinc/01/75/04/338017504.db2.gz NGODHZMHOOYYEC-UHFFFAOYSA-N -1 1 321.311 4.105 20 0 DIADMM C[C@H](Cc1nc(-c2ccc([O-])cc2F)no1)c1cccc(F)c1 ZINC000445456656 338017605 /nfs/dbraw/zinc/01/76/05/338017605.db2.gz PKNOWGJTROQYLS-SNVBAGLBSA-N -1 1 316.307 4.067 20 0 DIADMM C[C@@H](c1cc2ccccc2o1)c1nc(-c2ccc([O-])cc2F)no1 ZINC000445457401 338018283 /nfs/dbraw/zinc/01/82/83/338018283.db2.gz NHMMSRJKEBRKIZ-JTQLQIEISA-N -1 1 324.311 4.479 20 0 DIADMM [O-]c1ccc(-c2noc([C@H](c3ccccc3)C3CC3)n2)c(F)c1 ZINC000445459952 338018758 /nfs/dbraw/zinc/01/87/58/338018758.db2.gz KKGNNNWGSGEQRH-MRXNPFEDSA-N -1 1 310.328 4.123 20 0 DIADMM C[C@H](c1nc(-c2ccc([O-])cc2F)no1)c1ccc(F)c(F)c1 ZINC000445462189 338024426 /nfs/dbraw/zinc/02/44/26/338024426.db2.gz JNKYDDHTUKGNPO-QMMMGPOBSA-N -1 1 320.270 4.011 20 0 DIADMM [O-]c1ccc(-c2noc(CC/C=C/c3ccccc3)n2)c(F)c1 ZINC000445462927 338028955 /nfs/dbraw/zinc/02/89/55/338028955.db2.gz MQCLNRFDGPRVPW-XBXARRHUSA-N -1 1 310.328 4.227 20 0 DIADMM Cc1cccc([C@@H](NCc2ccc(Cl)cc2F)C(=O)[O-])c1C ZINC000426722467 338039174 /nfs/dbraw/zinc/03/91/74/338039174.db2.gz VURQPHOENPFEQF-MRXNPFEDSA-N -1 1 321.779 4.011 20 0 DIADMM Cc1cccc([C@H](NCc2ccc(F)cc2Cl)C(=O)[O-])c1C ZINC000426738885 338040101 /nfs/dbraw/zinc/04/01/01/338040101.db2.gz ZMNOCVJELAYSHT-INIZCTEOSA-N -1 1 321.779 4.011 20 0 DIADMM Cc1cc(C)c(S(=O)(=O)[N-]c2cc(C)ccc2Cl)s1 ZINC000431179205 338125064 /nfs/dbraw/zinc/12/50/64/338125064.db2.gz MKMFZRWHPYMNJN-UHFFFAOYSA-N -1 1 315.847 4.128 20 0 DIADMM COC(=O)c1c[n-]c(S[C@H](C)c2ccc(C(C)C)cc2)n1 ZINC000432658238 338161792 /nfs/dbraw/zinc/16/17/92/338161792.db2.gz MYBMVUMTFOCKKX-LLVKDONJSA-N -1 1 304.415 4.173 20 0 DIADMM COC(=O)c1c[n-]c(SCc2ccc(-c3ccccc3)cc2)n1 ZINC000432669569 338162019 /nfs/dbraw/zinc/16/20/19/338162019.db2.gz LYHOEGNJJHGHTH-UHFFFAOYSA-N -1 1 324.405 4.156 20 0 DIADMM CCc1cccc(S(=O)(=O)[N-]c2ccccc2C(C)C)c1 ZINC000433804280 338202419 /nfs/dbraw/zinc/20/24/19/338202419.db2.gz HHPRUANHGYBOFD-UHFFFAOYSA-N -1 1 303.427 4.173 20 0 DIADMM CCc1cccc(S(=O)(=O)[N-]c2ccc(Cl)cc2C)c1 ZINC000433807440 338202481 /nfs/dbraw/zinc/20/24/81/338202481.db2.gz HCZQTKGROZYNPI-UHFFFAOYSA-N -1 1 309.818 4.012 20 0 DIADMM CCc1cc(=O)[n-]c(S[C@@H]2CCc3ccc(Cl)cc32)n1 ZINC000436208787 338261986 /nfs/dbraw/zinc/26/19/86/338261986.db2.gz JZNCKNBHJYOQPU-CYBMUJFWSA-N -1 1 306.818 4.178 20 0 DIADMM C=Cc1ccc(S(=O)(=O)[N-]c2ccc(Cl)cc2C)cc1 ZINC000436476394 338273598 /nfs/dbraw/zinc/27/35/98/338273598.db2.gz FIJRNZLTHGNTDN-UHFFFAOYSA-N -1 1 307.802 4.092 20 0 DIADMM CO[C@H](C)c1cccc(NC(=O)c2ccc(C(C)C)cc2[O-])c1 ZINC000436509383 338274467 /nfs/dbraw/zinc/27/44/67/338274467.db2.gz BGTXIGAYMXJPMV-CYBMUJFWSA-N -1 1 313.397 4.475 20 0 DIADMM Cc1ccc2nc(-c3nc(-c4ccc([O-])cc4F)no3)ccc2c1 ZINC000436521856 338275068 /nfs/dbraw/zinc/27/50/68/338275068.db2.gz PDYCROLBWZYWDE-UHFFFAOYSA-N -1 1 321.311 4.105 20 0 DIADMM O=C(c1ccc2ccccc2c1[O-])N1CC[C@@H]1c1ccccc1 ZINC000436530871 338275560 /nfs/dbraw/zinc/27/55/60/338275560.db2.gz RGLXKRQAFWZMLM-GOSISDBHSA-N -1 1 303.361 4.133 20 0 DIADMM O=C(c1cc2ccccc2cc1[O-])N1CC[C@@H]1c1ccccc1 ZINC000436533919 338275792 /nfs/dbraw/zinc/27/57/92/338275792.db2.gz ZDJSAAJCJIIJLG-GOSISDBHSA-N -1 1 303.361 4.133 20 0 DIADMM CCCN(C(=O)c1cc(F)ccc1[O-])[C@@H]1CCc2ccccc21 ZINC000436541570 338276102 /nfs/dbraw/zinc/27/61/02/338276102.db2.gz WBUGLBVSEYCRLR-QGZVFWFLSA-N -1 1 313.372 4.071 20 0 DIADMM C[C@H]1C[C@@H](c2ccccc2)CN1C(=O)c1ccc(Cl)cc1[O-] ZINC000436547224 338276526 /nfs/dbraw/zinc/27/65/26/338276526.db2.gz NUKFZXRHXJBVAZ-GXTWGEPZSA-N -1 1 315.800 4.064 20 0 DIADMM O=C(c1ccc2ccccc2c1[O-])N1CCc2cc(Cl)ccc21 ZINC000436554929 338276815 /nfs/dbraw/zinc/27/68/15/338276815.db2.gz KTGXFOKNUUVSFU-UHFFFAOYSA-N -1 1 323.779 4.402 20 0 DIADMM CC[C@H](CN(CC)C(=O)c1cc(F)ccc1[O-])c1ccccc1 ZINC000436567052 338277548 /nfs/dbraw/zinc/27/75/48/338277548.db2.gz RQEQAYMTTOSAME-CQSZACIVSA-N -1 1 315.388 4.187 20 0 DIADMM C[C@@H]1CN(C(=O)c2cc3ccccc3cc2[O-])[C@H]1c1ccccc1 ZINC000436574036 338277894 /nfs/dbraw/zinc/27/78/94/338277894.db2.gz KVUCEZOHTNUXKV-JLTOFOAXSA-N -1 1 317.388 4.379 20 0 DIADMM C[C@H]1[C@@H](c2ccccc2)CCN1C(=O)c1ccc(Cl)cc1[O-] ZINC000436588021 338278532 /nfs/dbraw/zinc/27/85/32/338278532.db2.gz RCLQHVYPHQSFLS-WFASDCNBSA-N -1 1 315.800 4.064 20 0 DIADMM C[C@H]1[C@H](c2ccccc2)CCN1C(=O)c1ccc(Cl)cc1[O-] ZINC000436588020 338278607 /nfs/dbraw/zinc/27/86/07/338278607.db2.gz RCLQHVYPHQSFLS-SWLSCSKDSA-N -1 1 315.800 4.064 20 0 DIADMM C[C@@H]1[C@@H](c2ccccc2)CCN1C(=O)c1cc(Cl)ccc1[O-] ZINC000436590928 338279002 /nfs/dbraw/zinc/27/90/02/338279002.db2.gz UWTGFGHXMAUTND-DOMZBBRYSA-N -1 1 315.800 4.064 20 0 DIADMM CC1(C2CC2)CCN(C(=O)c2ccc3ccccc3c2[O-])CC1 ZINC000436603371 338279470 /nfs/dbraw/zinc/27/94/70/338279470.db2.gz HVBBJJCDFNAUIK-UHFFFAOYSA-N -1 1 309.409 4.198 20 0 DIADMM CCOc1ccccc1N(C)C(=O)c1ccc(C(C)C)cc1[O-] ZINC000436609578 338279800 /nfs/dbraw/zinc/27/98/00/338279800.db2.gz SFTDFVHJOLSCDI-UHFFFAOYSA-N -1 1 313.397 4.191 20 0 DIADMM CCOc1cc(-c2nc3cnccc3s2)cc(Cl)c1[O-] ZINC000436656100 338281931 /nfs/dbraw/zinc/28/19/31/338281931.db2.gz LMMJEONJRYBMGE-UHFFFAOYSA-N -1 1 306.774 4.116 20 0 DIADMM COc1ccc(-c2nc([C@H]3CCCC(C)(C)C3)no2)c([O-])c1 ZINC000436685427 338282750 /nfs/dbraw/zinc/28/27/50/338282750.db2.gz AUOPVPHNEDPSIZ-NSHDSACASA-N -1 1 302.374 4.135 20 0 DIADMM [O-]c1ccc(-c2nc(-c3ccccc3C(F)(F)F)no2)c(F)c1 ZINC000436688236 338283025 /nfs/dbraw/zinc/28/30/25/338283025.db2.gz KDWLQFKSZJEKNI-UHFFFAOYSA-N -1 1 324.233 4.267 20 0 DIADMM C[C@H](c1noc(-c2ccc([O-])cc2F)n1)c1c(F)cccc1F ZINC000436692782 338283173 /nfs/dbraw/zinc/28/31/73/338283173.db2.gz YDRCUKPVPDCBSJ-QMMMGPOBSA-N -1 1 320.270 4.011 20 0 DIADMM C[C@@H]1CC[C@]2(CCN(C(=O)c3cc4ccccc4cc3[O-])C2)C1 ZINC000436702165 338283393 /nfs/dbraw/zinc/28/33/93/338283393.db2.gz DHHYVYWOAPGINI-VLIAUNLRSA-N -1 1 309.409 4.198 20 0 DIADMM CC(C)c1ccc(CN(C)C(=O)c2ccc(Cl)cc2[O-])cc1 ZINC000436711115 338283759 /nfs/dbraw/zinc/28/37/59/338283759.db2.gz DCJLYPOQOSBGBT-UHFFFAOYSA-N -1 1 317.816 4.441 20 0 DIADMM O=C(c1ccc(Cl)cc1[O-])N1CCC[C@@]2(CC=CCC2)C1 ZINC000436717531 338283877 /nfs/dbraw/zinc/28/38/77/338283877.db2.gz HAKPEFUVCHZOLA-KRWDZBQOSA-N -1 1 305.805 4.008 20 0 DIADMM C[C@H]1CCN(C(=O)c2ccc3ccccc3c2[O-])CC12CCC2 ZINC000436718288 338284053 /nfs/dbraw/zinc/28/40/53/338284053.db2.gz ZIFNUKKFFASDRT-AWEZNQCLSA-N -1 1 309.409 4.198 20 0 DIADMM CCC1(CC)CCN(C(=O)c2ccc(C(F)(F)F)cc2[O-])C1 ZINC000436750049 338285428 /nfs/dbraw/zinc/28/54/28/338285428.db2.gz DUNHYMIIQDIITD-UHFFFAOYSA-N -1 1 315.335 4.063 20 0 DIADMM C[C@H]1c2ccccc2CN1C(=O)c1ccc(C(F)(F)F)cc1[O-] ZINC000436753836 338285655 /nfs/dbraw/zinc/28/56/55/338285655.db2.gz WCYIKGMBHZEDEU-JTQLQIEISA-N -1 1 321.298 4.128 20 0 DIADMM CC(C)c1cccnc1NC(=O)c1ccc(C(F)(F)F)cc1[O-] ZINC000436763297 338286152 /nfs/dbraw/zinc/28/61/52/338286152.db2.gz JRARVALXZQBCBL-UHFFFAOYSA-N -1 1 324.302 4.182 20 0 DIADMM C[C@H](c1ccccc1)N(C)C(=O)c1ccc(C(F)(F)F)cc1[O-] ZINC000436762453 338286176 /nfs/dbraw/zinc/28/61/76/338286176.db2.gz DWNVWVDXBFPAOI-LLVKDONJSA-N -1 1 323.314 4.244 20 0 DIADMM Cc1ccc2snc(C(=O)Nc3ccc([O-])c(Cl)c3)c2c1 ZINC000436775590 338286872 /nfs/dbraw/zinc/28/68/72/338286872.db2.gz FUGZTTVOCGURQG-UHFFFAOYSA-N -1 1 318.785 4.216 20 0 DIADMM CC(F)(F)c1ccc(-c2nc(-c3ccc([O-])cc3F)no2)cc1 ZINC000436783030 338287196 /nfs/dbraw/zinc/28/71/96/338287196.db2.gz KQDNVSYZZUKEIY-UHFFFAOYSA-N -1 1 320.270 4.360 20 0 DIADMM CC(C)c1ccc(C(=O)Nc2cccc(-c3cnco3)c2)c([O-])c1 ZINC000436787360 338287384 /nfs/dbraw/zinc/28/73/84/338287384.db2.gz VQNOIEZSEZZLJT-UHFFFAOYSA-N -1 1 322.364 4.423 20 0 DIADMM Cc1cccc(C)c1NC(=O)c1ccc(C(F)(F)F)cc1[O-] ZINC000436809781 338288206 /nfs/dbraw/zinc/28/82/06/338288206.db2.gz UXWJZMCPDNKLIB-UHFFFAOYSA-N -1 1 309.287 4.280 20 0 DIADMM CCCC[C@H](C)N(C)C(=O)c1cc(Cl)c([O-])c(OCC)c1 ZINC000436819296 338288423 /nfs/dbraw/zinc/28/84/23/338288423.db2.gz HSKSLPOKPXQSAB-NSHDSACASA-N -1 1 313.825 4.095 20 0 DIADMM Cc1ccc2snc(C(=O)Nc3ccc(Cl)cc3[O-])c2c1 ZINC000436821699 338288659 /nfs/dbraw/zinc/28/86/59/338288659.db2.gz XKWALGQIQDVJNH-UHFFFAOYSA-N -1 1 318.785 4.216 20 0 DIADMM CC1(C)CN(C(=O)c2ccc(Cl)cc2[O-])[C@@H]1c1cccs1 ZINC000436847582 338289885 /nfs/dbraw/zinc/28/98/85/338289885.db2.gz QZHCWGZSVDFPMQ-CQSZACIVSA-N -1 1 321.829 4.330 20 0 DIADMM O=C(N[C@H]1CSc2ccccc21)c1cc2ccccc2cc1[O-] ZINC000436854855 338290055 /nfs/dbraw/zinc/29/00/55/338290055.db2.gz UMHRFWNGVQFADB-INIZCTEOSA-N -1 1 321.401 4.122 20 0 DIADMM O=C(c1ccc(Cl)cc1[O-])N1CCC[C@H](c2ccccc2)C1 ZINC000436853807 338290059 /nfs/dbraw/zinc/29/00/59/338290059.db2.gz SQJBZBRMNHWUCW-AWEZNQCLSA-N -1 1 315.800 4.065 20 0 DIADMM O=C(c1ccc(Cl)cc1[O-])N(CC1CC1)C1CCCCC1 ZINC000436864949 338290457 /nfs/dbraw/zinc/29/04/57/338290457.db2.gz PKKVSBVRQPFMPE-UHFFFAOYSA-N -1 1 307.821 4.231 20 0 DIADMM O=C(c1ccccc1[O-])N1CC2(CCCC2)c2cccc(F)c21 ZINC000436865483 338290521 /nfs/dbraw/zinc/29/05/21/338290521.db2.gz RSSMJENAGJNBCY-UHFFFAOYSA-N -1 1 311.356 4.004 20 0 DIADMM CCc1ccccc1[C@@H]1C[C@H]1c1nc(-c2ccc([O-])c(F)c2)no1 ZINC000436875201 338291163 /nfs/dbraw/zinc/29/11/63/338291163.db2.gz SWNOWBALVSTLIH-LSDHHAIUSA-N -1 1 324.355 4.415 20 0 DIADMM CCCc1nc(-c2noc(-c3ccc4ccccc4c3[O-])n2)co1 ZINC000436877977 338291345 /nfs/dbraw/zinc/29/13/45/338291345.db2.gz AKIOWDITAXQTHL-UHFFFAOYSA-N -1 1 321.336 4.203 20 0 DIADMM Cc1ccc([C@H]2C[C@@H](C)CCN2C(=O)c2ccc([O-])cc2F)o1 ZINC000436877623 338291349 /nfs/dbraw/zinc/29/13/49/338291349.db2.gz BLDIFDXHENWAOZ-MEDUHNTESA-N -1 1 317.360 4.046 20 0 DIADMM [O-]c1ccc(-c2noc(CC3CC(c4ccccc4)C3)n2)cc1F ZINC000436879749 338291464 /nfs/dbraw/zinc/29/14/64/338291464.db2.gz NTXHVEFKWUTUBI-UHFFFAOYSA-N -1 1 324.355 4.318 20 0 DIADMM Cc1ccnc2ccc(-c3nc(-c4ccc([O-])c(F)c4)no3)cc12 ZINC000436878664 338291477 /nfs/dbraw/zinc/29/14/77/338291477.db2.gz LCPLNOBAGOGYMM-UHFFFAOYSA-N -1 1 321.311 4.105 20 0 DIADMM [O-]c1ccc(-c2noc(-c3cccc4ccsc43)n2)cc1F ZINC000436881010 338291555 /nfs/dbraw/zinc/29/15/55/338291555.db2.gz UXBQKAFHRUHLMG-UHFFFAOYSA-N -1 1 312.325 4.463 20 0 DIADMM Cc1cccc(C2(NC(=O)c3ccc([O-])cc3F)CCCC2)c1 ZINC000436880654 338291659 /nfs/dbraw/zinc/29/16/59/338291659.db2.gz OVBNWEDISFBBNH-UHFFFAOYSA-N -1 1 313.372 4.039 20 0 DIADMM CCN(Cc1cccc(F)c1)C(=O)c1ccc2ccccc2c1[O-] ZINC000436898290 338292522 /nfs/dbraw/zinc/29/25/22/338292522.db2.gz XLKBBFYNTNMYFV-UHFFFAOYSA-N -1 1 323.367 4.347 20 0 DIADMM O=C(c1ccc2ccccc2c1[O-])N(CC1CC1)CC1CCC1 ZINC000436929179 338293986 /nfs/dbraw/zinc/29/39/86/338293986.db2.gz DKPOEKNYMNDGSI-UHFFFAOYSA-N -1 1 309.409 4.198 20 0 DIADMM CCC(C)(C)OCc1ccccc1NC(=O)c1ccccc1[O-] ZINC000436933070 338294198 /nfs/dbraw/zinc/29/41/98/338294198.db2.gz AWQYTHNEPUSGIB-UHFFFAOYSA-N -1 1 313.397 4.350 20 0 DIADMM CC(C)c1scnc1-c1nc(-c2ccc([O-])cc2Cl)no1 ZINC000436957715 338295870 /nfs/dbraw/zinc/29/58/70/338295870.db2.gz WSWNWKVYLXWPPI-UHFFFAOYSA-N -1 1 321.789 4.343 20 0 DIADMM O=C(c1ccc2ccccc2c1[O-])N1CCCC2(CCCC2)C1 ZINC000438681378 338350895 /nfs/dbraw/zinc/35/08/95/338350895.db2.gz OXGDLLMGRQDPAR-UHFFFAOYSA-N -1 1 309.409 4.342 20 0 DIADMM CC(C)c1ccc2nc(-c3ccc(O)cc3Cl)[n-]c(=O)c2c1 ZINC000438873459 338354515 /nfs/dbraw/zinc/35/45/15/338354515.db2.gz COIVLUFNMRENHF-UHFFFAOYSA-N -1 1 314.772 4.485 20 0 DIADMM CC(C)c1ccc(C(=O)Nc2ccccc2-c2cn[nH]c2)c([O-])c1 ZINC000439745195 338376979 /nfs/dbraw/zinc/37/69/79/338376979.db2.gz MUOMMNWATOLHFK-UHFFFAOYSA-N -1 1 321.380 4.158 20 0 DIADMM C[C@H](CCc1ccccc1F)C(=O)Nc1ccc([O-])c(Cl)c1 ZINC000440783614 338397270 /nfs/dbraw/zinc/39/72/70/338397270.db2.gz YAIGXNLGTVKARZ-LLVKDONJSA-N -1 1 321.779 4.392 20 0 DIADMM CCOCc1ccc(NC(=O)c2ccc3ccccc3c2[O-])cc1 ZINC000440816162 338397973 /nfs/dbraw/zinc/39/79/73/338397973.db2.gz LJJAGSVTSFQTHF-UHFFFAOYSA-N -1 1 321.376 4.334 20 0 DIADMM CC(C)[C@@H](C(=O)Nc1ccc([O-])c(Cl)c1)c1ccccc1 ZINC000440950038 338400241 /nfs/dbraw/zinc/40/02/41/338400241.db2.gz QFNGVTJSOOUGLE-MRXNPFEDSA-N -1 1 303.789 4.424 20 0 DIADMM Cc1cc(C)cc(N(C)C(=O)c2cc3ccccc3cc2[O-])c1 ZINC000195711884 338914360 /nfs/dbraw/zinc/91/43/60/338914360.db2.gz SCFBBQSTUFXLGA-UHFFFAOYSA-N -1 1 305.377 4.439 20 0 DIADMM O=C(Nc1ccc([O-])c(F)c1F)[C@@H]1CC[C@@H]2CCCC[C@@H]2C1 ZINC000456789110 338940883 /nfs/dbraw/zinc/94/08/83/338940883.db2.gz SQDNIDJKNPKNMS-QJPTWQEYSA-N -1 1 309.356 4.215 20 0 DIADMM CC(C)[C@@H](CC(=O)Nc1ccc([O-])c(F)c1F)c1ccccc1 ZINC000456795777 338941083 /nfs/dbraw/zinc/94/10/83/338941083.db2.gz UPGSCHXUGXLQDA-CYBMUJFWSA-N -1 1 319.351 4.439 20 0 DIADMM CCOc1cc(CN(C)Cc2cccs2)cc(Cl)c1O ZINC000459290777 339019572 /nfs/dbraw/zinc/01/95/72/339019572.db2.gz LNAOKOVRKPQNGP-UHFFFAOYSA-N -1 1 311.834 4.138 20 0 DIADMM CC[C@@H](C)c1ccc(S(=O)(=O)[N-]c2ccc(C)c(O)c2)cc1 ZINC000462104271 339072254 /nfs/dbraw/zinc/07/22/54/339072254.db2.gz SRQKTVXPHWLVLY-GFCCVEGCSA-N -1 1 319.426 4.015 20 0 DIADMM CCSc1cccc(F)c1[N-]C(=O)c1cccc(F)c1F ZINC000484921110 339695546 /nfs/dbraw/zinc/69/55/46/339695546.db2.gz OMDBLKGIMLHUNT-UHFFFAOYSA-N -1 1 311.328 4.468 20 0 DIADMM O=c1[nH]c(-c2cc([O-])cc(Cl)c2)nc2ccc(Cl)cc12 ZINC000487507052 339755285 /nfs/dbraw/zinc/75/52/85/339755285.db2.gz XJAOFKXNJILPAH-UHFFFAOYSA-N -1 1 307.136 4.015 20 0 DIADMM C[C@@H](c1ccc(C(C)(C)C)cc1)S(=O)(=O)c1ccc([O-])cc1 ZINC000488938497 339797474 /nfs/dbraw/zinc/79/74/74/339797474.db2.gz RUPQQFVSDJOFBK-ZDUSSCGKSA-N -1 1 318.438 4.225 20 0 DIADMM Cc1cccc(-c2nc3ccc(-c4ccccc4)cc3c(=O)[n-]2)n1 ZINC000498765834 340022999 /nfs/dbraw/zinc/02/29/99/340022999.db2.gz QCOYUTXORZDDHB-UHFFFAOYSA-N -1 1 313.360 4.373 20 0 DIADMM CCSc1cccc([N-]S(=O)(=O)c2ccc(C)c(C)c2)c1 ZINC000505310766 340166048 /nfs/dbraw/zinc/16/60/48/340166048.db2.gz HPVMNTAPBXHWDK-UHFFFAOYSA-N -1 1 321.467 4.216 20 0 DIADMM CC[C@@H](CC(=O)Nc1ccc(F)cc1[O-])c1ccc(OC)cc1 ZINC000505620344 340173280 /nfs/dbraw/zinc/17/32/80/340173280.db2.gz NQIUCOWENFWMHM-LBPRGKRZSA-N -1 1 317.360 4.062 20 0 DIADMM [O-]c1cccc(CN2CCSC[C@H]2c2ccccc2)c1Cl ZINC000507133026 340208922 /nfs/dbraw/zinc/20/89/22/340208922.db2.gz RRUAOMBXDSAIJX-HNNXBMFYSA-N -1 1 319.857 4.336 20 0 DIADMM O=S(=O)([N-]c1cccc2[nH]ccc21)c1ccc2ccccc2c1 ZINC000508450932 340243983 /nfs/dbraw/zinc/24/39/83/340243983.db2.gz PXJSVPMEVLBLPZ-UHFFFAOYSA-N -1 1 322.389 4.122 20 0 DIADMM CSc1cccc(S(=O)(=O)[N-]c2ccccc2C(C)C)c1 ZINC000509089852 340260982 /nfs/dbraw/zinc/26/09/82/340260982.db2.gz ORKBYHMZMCUYAI-UHFFFAOYSA-N -1 1 321.467 4.333 20 0 DIADMM Cc1cc(F)cc2[nH]c(C(=O)Nc3ccc([O-])c(Cl)c3)cc21 ZINC000509166264 340262848 /nfs/dbraw/zinc/26/28/48/340262848.db2.gz JQLFESVVZUNXGM-UHFFFAOYSA-N -1 1 318.735 4.227 20 0 DIADMM CC(C)(Cc1ccccc1)C(=O)Nc1ccc([O-])c(Cl)c1 ZINC000509186087 340263322 /nfs/dbraw/zinc/26/33/22/340263322.db2.gz RDPWUAFOAKQZLC-UHFFFAOYSA-N -1 1 303.789 4.253 20 0 DIADMM CS[C@H](C(=O)Nc1ccc([O-])c(Cl)c1)c1ccccc1 ZINC000182860816 340485673 /nfs/dbraw/zinc/48/56/73/340485673.db2.gz MBYWLIZTGYZKDK-AWEZNQCLSA-N -1 1 307.802 4.088 20 0 DIADMM CC[C@@H](OC1CCCCC1)C(=O)Nc1ccc([O-])c(Cl)c1 ZINC000182869076 340485718 /nfs/dbraw/zinc/48/57/18/340485718.db2.gz HYIYOWJAWGJUQH-OAHLLOKOSA-N -1 1 311.809 4.112 20 0 DIADMM CCOc1ccc(NC(=O)Nc2ccc([O-])c(Cl)c2)c(C)c1 ZINC000190948243 340548447 /nfs/dbraw/zinc/54/84/47/340548447.db2.gz HFZWSJBLNKMEES-UHFFFAOYSA-N -1 1 320.776 4.397 20 0 DIADMM CCCc1cnc(NC(=O)Nc2ccc([O-])c(Cl)c2)s1 ZINC000192254209 340565460 /nfs/dbraw/zinc/56/54/60/340565460.db2.gz ZDXUZZZYYPLGRI-UHFFFAOYSA-N -1 1 311.794 4.099 20 0 DIADMM [O-]c1ccc(F)cc1-c1nc(C2(c3ccccc3)CCC2)no1 ZINC000322367917 340704326 /nfs/dbraw/zinc/70/43/26/340704326.db2.gz CYGSIXCPUHNJDL-UHFFFAOYSA-N -1 1 310.328 4.051 20 0 DIADMM Cc1cc(S(=O)(=O)[N-]c2cccc(Cl)c2C)c(C)s1 ZINC000032531897 340715079 /nfs/dbraw/zinc/71/50/79/340715079.db2.gz NNOJLRUZWVJCSB-UHFFFAOYSA-N -1 1 315.847 4.128 20 0 DIADMM CC[C@H](C)[C@@H](OC)C(=O)Nc1cc(Cl)c([O-])c2ccccc12 ZINC000529538387 340760802 /nfs/dbraw/zinc/76/08/02/340760802.db2.gz BQLGLKFTAKKQLF-MGPLVRAMSA-N -1 1 321.804 4.198 20 0 DIADMM O=C(Nc1cc(Cl)c([O-])c2ccccc12)[C@@]12C[C@@H]1CCC2 ZINC000529538359 340760812 /nfs/dbraw/zinc/76/08/12/340760812.db2.gz BDZWUYCSPDZCHA-BTDLBPIBSA-N -1 1 301.773 4.328 20 0 DIADMM O=C(Nc1cc(Cl)c([O-])c2ccccc12)[C@]12C[C@H]1CCC2 ZINC000529538358 340760886 /nfs/dbraw/zinc/76/08/86/340760886.db2.gz BDZWUYCSPDZCHA-BMLIUANNSA-N -1 1 301.773 4.328 20 0 DIADMM C[C@H](C(=O)Nc1cc(Cl)c([O-])c2ccccc12)C(C)(F)F ZINC000529538827 340760959 /nfs/dbraw/zinc/76/09/59/340760959.db2.gz KYXBBGDDOHLKGH-MRVPVSSYSA-N -1 1 313.731 4.429 20 0 DIADMM Cc1nc(C2CCCC2)sc1C(=O)Nc1cccc(F)c1[O-] ZINC000530006014 340775938 /nfs/dbraw/zinc/77/59/38/340775938.db2.gz QXBBYCCDGIHRFU-UHFFFAOYSA-N -1 1 320.389 4.206 20 0 DIADMM CCc1ccc(S(=O)(=O)[N-]c2cc(SC)ccc2C)cc1 ZINC000539399719 340883884 /nfs/dbraw/zinc/88/38/84/340883884.db2.gz ZFOZWSHEZWKATC-UHFFFAOYSA-N -1 1 321.467 4.080 20 0 DIADMM Cc1cc(C)c(CC(=O)Nc2ccc([O-])c(Cl)c2)c(C)c1 ZINC000541887585 340987581 /nfs/dbraw/zinc/98/75/81/340987581.db2.gz NKUUUNLGADMIOQ-UHFFFAOYSA-N -1 1 303.789 4.152 20 0 DIADMM O=C([N-]c1c(F)cc(F)cc1F)c1ccc(F)c(Cl)c1F ZINC000544852945 341096573 /nfs/dbraw/zinc/09/65/73/341096573.db2.gz SFUQDPRYZVPVNS-UHFFFAOYSA-N -1 1 321.632 4.288 20 0 DIADMM C[C@@H](c1ccccc1Cl)N(C)C(=O)c1cc(F)ccc1[O-] ZINC000132892151 341148703 /nfs/dbraw/zinc/14/87/03/341148703.db2.gz RFOQWNDJSADXGA-JTQLQIEISA-N -1 1 307.752 4.018 20 0 DIADMM C[C@H]1C[C@H]1c1noc(-c2cc(Oc3ccccc3)ccc2[O-])n1 ZINC000547187795 341200396 /nfs/dbraw/zinc/20/03/96/341200396.db2.gz UOCYAUBYVOHESX-SMDDNHRTSA-N -1 1 308.337 4.358 20 0 DIADMM CCOc1cc(C(=O)NCCCC(C)(C)C)cc(Cl)c1[O-] ZINC000547270518 341203269 /nfs/dbraw/zinc/20/32/69/341203269.db2.gz XWYBFLAUMBHRCM-UHFFFAOYSA-N -1 1 313.825 4.000 20 0 DIADMM O=C(Nc1ccc(Cl)cc1[O-])c1coc(C2CCCCC2)n1 ZINC000547949355 341240241 /nfs/dbraw/zinc/24/02/41/341240241.db2.gz CLNFQUURZUEAJP-UHFFFAOYSA-N -1 1 320.776 4.334 20 0 DIADMM O=C(Nc1ccc([O-])c(Cl)c1)[C@@H]1CCCC[C@@H]1C(F)(F)F ZINC000136121566 341253117 /nfs/dbraw/zinc/25/31/17/341253117.db2.gz YYVGYOPHAJVBMB-ZJUUUORDSA-N -1 1 321.726 4.353 20 0 DIADMM O=c1cc(C(F)F)nc(SCc2cc3ccccc3o2)[n-]1 ZINC000564391870 341393713 /nfs/dbraw/zinc/39/37/13/341393713.db2.gz NOWHICOATJZJNG-UHFFFAOYSA-N -1 1 308.309 4.158 20 0 DIADMM O=c1cc(C(F)F)nc(SCc2ccc(C(F)F)cc2)[n-]1 ZINC000564392216 341395220 /nfs/dbraw/zinc/39/52/20/341395220.db2.gz WDCNPMXQNYRLQL-UHFFFAOYSA-N -1 1 318.295 4.350 20 0 DIADMM O=C(Cc1ccc(F)cc1Cl)Nc1ccc([O-])c(Cl)c1 ZINC000157281665 341635802 /nfs/dbraw/zinc/63/58/02/341635802.db2.gz RBTDXJWZLDHOJY-UHFFFAOYSA-N -1 1 314.143 4.019 20 0 DIADMM O=c1cc(C(F)F)nc(SCc2cccc(Cl)c2)[n-]1 ZINC000576987865 341873868 /nfs/dbraw/zinc/87/38/68/341873868.db2.gz ZMFSXTYLTKRUMB-UHFFFAOYSA-N -1 1 302.733 4.066 20 0 DIADMM CCC(CC)n1nc(C(=O)Nc2ccc([O-])c(Cl)c2)cc1C ZINC000182878295 521643033 /nfs/dbraw/zinc/64/30/33/521643033.db2.gz TWDQHHHQZHDIEN-UHFFFAOYSA-N -1 1 321.808 4.164 20 0 DIADMM CCSCc1ccnc(NCc2cccc([O-])c2Cl)c1 ZINC000339333348 521719666 /nfs/dbraw/zinc/71/96/66/521719666.db2.gz XBDMOJOOVIZCHP-UHFFFAOYSA-N -1 1 308.834 4.306 20 0 DIADMM [O-]c1cccc(CNCc2coc(-c3cccs3)n2)c1Cl ZINC000339200501 526360694 /nfs/dbraw/zinc/36/06/94/526360694.db2.gz INHZLZSVJDRCIY-UHFFFAOYSA-N -1 1 320.801 4.052 20 0 DIADMM C[S@@](=O)c1ccccc1Nc1cc(Cl)cc(Cl)c1[O-] ZINC001175308678 1048256696 /nfs/dbraw/zinc/25/66/96/1048256696.db2.gz JAARCQSURTZBLC-LJQANCHMSA-N -1 1 316.209 4.180 20 0 DIADMM [O-]c1cccc(CN2CCCCC[C@@H]2C(F)(F)F)c1Cl ZINC001561007257 1060864794 /nfs/dbraw/zinc/86/47/94/1060864794.db2.gz OVVDQKXRWNBBHP-GFCCVEGCSA-N -1 1 307.743 4.353 20 0 DIADMM O=C([O-])c1cccc(CNCc2ccc(Oc3ccccc3)o2)c1 ZINC000683176149 1035665240 /nfs/dbraw/zinc/66/52/40/1035665240.db2.gz IKKGKOPNMMVOPF-UHFFFAOYSA-N -1 1 323.348 4.060 20 0 DIADMM C[C@@H](Sc1nc(C(F)(F)F)cc(=O)[n-]1)c1ccccc1F ZINC000261430567 1035869851 /nfs/dbraw/zinc/86/98/51/1035869851.db2.gz QMTKVAYPPGPATC-SSDOTTSWSA-N -1 1 318.295 4.193 20 0 DIADMM O=C(/C=C\c1ccnc2ccccc12)Nc1ccc([O-])c(Cl)c1 ZINC000255008967 1035946562 /nfs/dbraw/zinc/94/65/62/1035946562.db2.gz ACDBSDUFUPCWDT-YVMONPNESA-N -1 1 324.767 4.246 20 0 DIADMM COc1cc(C(F)(F)F)ccc1Nc1cc([O-])c(F)c(F)c1 ZINC001209884076 1036286401 /nfs/dbraw/zinc/28/64/01/1036286401.db2.gz MKGCMIJYIQKKHJ-UHFFFAOYSA-N -1 1 319.229 4.441 20 0 DIADMM CCC[C@@H]1CCc2nc(NC(=O)c3ccccc3[O-])sc2C1 ZINC001143378420 1036575847 /nfs/dbraw/zinc/57/58/47/1036575847.db2.gz KBGOBIMCWMFXEH-LLVKDONJSA-N -1 1 316.426 4.006 20 0 DIADMM [O-]c1c(Cl)cc(Cl)cc1Nc1cnn(C(F)(F)F)c1 ZINC001210362179 1036644893 /nfs/dbraw/zinc/64/48/93/1036644893.db2.gz HFBXPWSPHDTXCX-UHFFFAOYSA-N -1 1 312.078 4.115 20 0 DIADMM O=C(NCc1ccc(Cl)s1)c1ccc2ccccc2c1[O-] ZINC000071309333 1036687817 /nfs/dbraw/zinc/68/78/17/1036687817.db2.gz QXEDHGHLUWNQQD-UHFFFAOYSA-N -1 1 317.797 4.190 20 0 DIADMM O=S(=O)([O-])c1ccc(Cl)c(N=C2CCCCCCC2)c1 ZINC001210449617 1036710838 /nfs/dbraw/zinc/71/08/38/1036710838.db2.gz LWIISSIESXXGEB-UHFFFAOYSA-N -1 1 315.822 4.237 20 0 DIADMM Cc1oncc1[N-]c1cc(-c2cccc(Br)c2)no1 ZINC001210578747 1036826995 /nfs/dbraw/zinc/82/69/95/1036826995.db2.gz IYTAGOAGDLSENW-UHFFFAOYSA-N -1 1 320.146 4.144 20 0 DIADMM COc1cc(-c2nc([C@@H]3CCC[C@@H]4C[C@@H]43)no2)cc(Cl)c1[O-] ZINC000656048865 1036844989 /nfs/dbraw/zinc/84/49/89/1036844989.db2.gz JLKDZYLNEOLXSE-IEBDPFPHSA-N -1 1 320.776 4.008 20 0 DIADMM COCc1cncc(Nc2cc(Cl)c(C)c(Cl)c2[O-])c1 ZINC001211081334 1037144720 /nfs/dbraw/zinc/14/47/20/1037144720.db2.gz DBJOUGWATPVHAG-UHFFFAOYSA-N -1 1 313.184 4.292 20 0 DIADMM Oc1cc(F)c(-c2ccc3[nH]c(C(F)(F)F)nc3c2)cc1F ZINC001211339883 1037304970 /nfs/dbraw/zinc/30/49/70/1037304970.db2.gz QDFRRJPYNILKKM-UHFFFAOYSA-N -1 1 314.213 4.233 20 0 DIADMM [O-]c1cc(F)c(-c2ccc3nc(C(F)(F)F)[nH]c3c2)cc1F ZINC001211339883 1037304986 /nfs/dbraw/zinc/30/49/86/1037304986.db2.gz QDFRRJPYNILKKM-UHFFFAOYSA-N -1 1 314.213 4.233 20 0 DIADMM [O-]c1cc(F)c(-c2ccc3[nH]c(C(F)(F)F)nc3c2)cc1F ZINC001211339883 1037305001 /nfs/dbraw/zinc/30/50/01/1037305001.db2.gz QDFRRJPYNILKKM-UHFFFAOYSA-N -1 1 314.213 4.233 20 0 DIADMM [O-]c1cc(F)c(-c2ccc(-c3c[nH]c(=S)[nH]3)cc2)cc1F ZINC001211339287 1037306265 /nfs/dbraw/zinc/30/62/65/1037306265.db2.gz MFIKUJLJVAFFCR-UHFFFAOYSA-N -1 1 304.321 4.016 20 0 DIADMM CCOC(=O)c1cc2cc(-c3cc(F)c([O-])cc3F)ccc2o1 ZINC001211340197 1037308590 /nfs/dbraw/zinc/30/85/90/1037308590.db2.gz TYYNZYKILPWYOX-UHFFFAOYSA-N -1 1 318.275 4.260 20 0 DIADMM [O-]c1cc(F)c(Nc2cccc(Br)c2)cc1F ZINC001215571332 1037381928 /nfs/dbraw/zinc/38/19/28/1037381928.db2.gz ABOQTCDVVLMXJU-UHFFFAOYSA-N -1 1 300.102 4.177 20 0 DIADMM C[C@H](CC[N-]S(=O)(=O)c1sccc1Cl)CC(C)(C)C ZINC001211525928 1038250256 /nfs/dbraw/zinc/25/02/56/1038250256.db2.gz JQJYUZQCKMLQKE-SNVBAGLBSA-N -1 1 323.911 4.142 20 0 DIADMM Cc1cccc(Oc2ccc(NC(=O)c3cncc([O-])c3)cc2)c1 ZINC000599296213 1038265858 /nfs/dbraw/zinc/26/58/58/1038265858.db2.gz YPRFOLFMZGXBOO-UHFFFAOYSA-N -1 1 320.348 4.140 20 0 DIADMM CCc1nc(SCc2cc3ccccc3o2)[n-]c(=O)c1C ZINC000657263757 1038478463 /nfs/dbraw/zinc/47/84/63/1038478463.db2.gz DGQSMCVMZINNAB-UHFFFAOYSA-N -1 1 300.383 4.092 20 0 DIADMM CC(C)CCOc1ccc(C(=O)Nc2c([O-])cccc2F)cc1 ZINC000605440328 1038515970 /nfs/dbraw/zinc/51/59/70/1038515970.db2.gz OIOAFOQZJGEBOE-UHFFFAOYSA-N -1 1 317.360 4.209 20 0 DIADMM O=C(Nc1c([O-])cccc1F)c1cc(F)c(Cl)cc1Cl ZINC000605440339 1038516452 /nfs/dbraw/zinc/51/64/52/1038516452.db2.gz OYDYWVMFGQVKCR-UHFFFAOYSA-N -1 1 318.106 4.230 20 0 DIADMM CCCc1sc(C(=O)Nc2c([O-])cccc2F)cc1CC ZINC000605440726 1038516957 /nfs/dbraw/zinc/51/69/57/1038516957.db2.gz ZFIYIEPBAVRKAU-UHFFFAOYSA-N -1 1 307.390 4.360 20 0 DIADMM Cc1cccc(OCCCCC(=O)Nc2c([O-])cccc2F)c1 ZINC000605438163 1038517009 /nfs/dbraw/zinc/51/70/09/1038517009.db2.gz RPOQWINUERFKTQ-UHFFFAOYSA-N -1 1 317.360 4.028 20 0 DIADMM CCc1cccc(C)c1[N-]S(=O)(=O)c1cccc(Cl)c1C ZINC000071974002 1038555789 /nfs/dbraw/zinc/55/57/89/1038555789.db2.gz TULMUBOAJXMPKT-UHFFFAOYSA-N -1 1 323.845 4.320 20 0 DIADMM [O-]c1c(Cl)ccc(CN2CC[C@H]3CCC[C@H]3C2)c1Cl ZINC001232626113 1038607175 /nfs/dbraw/zinc/60/71/75/1038607175.db2.gz VSJGIWJNLGQSNT-MNOVXSKESA-N -1 1 300.229 4.321 20 0 DIADMM CC[N@@H+](Cc1cccc(F)c1)[C@@H](C)c1cc(C(=O)[O-])c(C)o1 ZINC000515855542 1038645099 /nfs/dbraw/zinc/64/50/99/1038645099.db2.gz HMTRXCIPDWJFRJ-NSHDSACASA-N -1 1 305.349 4.008 20 0 DIADMM CCN(Cc1cccc(F)c1)[C@@H](C)c1cc(C(=O)[O-])c(C)o1 ZINC000515855542 1038645102 /nfs/dbraw/zinc/64/51/02/1038645102.db2.gz HMTRXCIPDWJFRJ-NSHDSACASA-N -1 1 305.349 4.008 20 0 DIADMM Cc1ccc(NC(=O)c2ccc(C(F)(F)F)c([O-])c2)c(F)c1 ZINC000684870724 1038667717 /nfs/dbraw/zinc/66/77/17/1038667717.db2.gz LJZKGPVRGQGQCE-UHFFFAOYSA-N -1 1 313.250 4.111 20 0 DIADMM Cc1cc(C)cc(N(C)C(=O)c2ccc(C(F)(F)F)c([O-])c2)c1 ZINC000684872352 1038668987 /nfs/dbraw/zinc/66/89/87/1038668987.db2.gz CGDOJHIAKZVFSA-UHFFFAOYSA-N -1 1 323.314 4.304 20 0 DIADMM CC(C)CN(CC(C)C)C(=O)c1ccc(C(F)(F)F)c([O-])c1 ZINC000684873656 1038669773 /nfs/dbraw/zinc/66/97/73/1038669773.db2.gz AZTFCRMJQQPXTK-UHFFFAOYSA-N -1 1 317.351 4.165 20 0 DIADMM O=C(CC12CC3CC(CC(C3)C1)C2)Nc1c([O-])cccc1F ZINC000608365312 1038831383 /nfs/dbraw/zinc/83/13/83/1038831383.db2.gz CWQAXHGCLRDZAT-UHFFFAOYSA-N -1 1 303.377 4.076 20 0 DIADMM O=C(Nc1c([O-])cccc1F)c1cccc(OC2CCCC2)c1 ZINC000608365656 1038832625 /nfs/dbraw/zinc/83/26/25/1038832625.db2.gz IBFXWIKNUOFIIB-UHFFFAOYSA-N -1 1 315.344 4.105 20 0 DIADMM CC1(C)CCC[C@@H]1CCNC(=O)c1ccc2ccccc2c1[O-] ZINC001167621136 1038950676 /nfs/dbraw/zinc/95/06/76/1038950676.db2.gz FRJXTWFLPQXPJJ-OAHLLOKOSA-N -1 1 311.425 4.492 20 0 DIADMM CC(C)c1ccc(CCC(=O)Nc2ccc([O-])c(F)c2F)cc1 ZINC000456792678 1039079300 /nfs/dbraw/zinc/07/93/00/1039079300.db2.gz JKWSEHMTVDPVQQ-UHFFFAOYSA-N -1 1 319.351 4.365 20 0 DIADMM Cc1c(C(=O)Nc2c([O-])cccc2F)cccc1-c1ccccn1 ZINC000092551261 1039280305 /nfs/dbraw/zinc/28/03/05/1039280305.db2.gz AJUDSMPZLDPIRR-UHFFFAOYSA-N -1 1 322.339 4.154 20 0 DIADMM CCC(CC)N(C(=O)c1ccc(C(F)(F)F)cc1[O-])C1CC1 ZINC000539624765 1039303657 /nfs/dbraw/zinc/30/36/57/1039303657.db2.gz NDPOPLRDDHSHJC-UHFFFAOYSA-N -1 1 315.335 4.204 20 0 DIADMM [O-]c1c(F)cc(Nc2cccc(OC(F)(F)F)c2F)cc1F ZINC001213384269 1039324159 /nfs/dbraw/zinc/32/41/59/1039324159.db2.gz BJRKUJKATAFYJF-UHFFFAOYSA-N -1 1 323.192 4.452 20 0 DIADMM COc1c(Nc2cc(F)c([O-])c(F)c2)cccc1C(F)(F)F ZINC001213384429 1039325173 /nfs/dbraw/zinc/32/51/73/1039325173.db2.gz LYDJPCFTWGLFMB-UHFFFAOYSA-N -1 1 319.229 4.441 20 0 DIADMM Cc1nc(-c2nc3ccc(Oc4ccccc4)cc3c(=O)[n-]2)co1 ZINC000685189935 1039436196 /nfs/dbraw/zinc/43/61/96/1039436196.db2.gz RIHJUROZODPOHT-UHFFFAOYSA-N -1 1 319.320 4.091 20 0 DIADMM CCOc1ccccc1NC(=O)c1ccc2ccccc2c1[O-] ZINC000168316772 1039506324 /nfs/dbraw/zinc/50/63/24/1039506324.db2.gz WKSRMBBGHMBTKY-UHFFFAOYSA-N -1 1 307.349 4.196 20 0 DIADMM Cc1ccc(NC(=O)c2ccc([O-])cc2F)cc1C(F)(F)F ZINC000317939307 1039510816 /nfs/dbraw/zinc/51/08/16/1039510816.db2.gz NGAPMBDKYBKOGU-UHFFFAOYSA-N -1 1 313.250 4.111 20 0 DIADMM Cc1nc(C(C)C)sc1C(=O)Nc1ccc([O-])c(Cl)c1 ZINC000540958768 1039596717 /nfs/dbraw/zinc/59/67/17/1039596717.db2.gz MBSDCJLZLVHREG-UHFFFAOYSA-N -1 1 310.806 4.186 20 0 DIADMM CC(C)COCCC(=O)Nc1cc(Cl)c([O-])c2ccccc12 ZINC000628232543 1040225685 /nfs/dbraw/zinc/22/56/85/1040225685.db2.gz CEVRQQUNZHCHNK-UHFFFAOYSA-N -1 1 321.804 4.200 20 0 DIADMM CCCCO[C@H](C)C(=O)Nc1cc(Cl)c([O-])c2ccccc12 ZINC000628233393 1040244507 /nfs/dbraw/zinc/24/45/07/1040244507.db2.gz ZKURGNLYTIKCPV-LLVKDONJSA-N -1 1 321.804 4.343 20 0 DIADMM O=C(Nc1ccc([O-])c(Cl)c1)[C@H]1C[C@H]1c1cccc(F)c1F ZINC000173378573 1040889431 /nfs/dbraw/zinc/88/94/31/1040889431.db2.gz XPZWTPFCOHJWAB-QWRGUYRKSA-N -1 1 323.726 4.066 20 0 DIADMM C[C@H]([N-]C(=O)C(F)(F)C(F)F)c1ccc(F)c2ccccc21 ZINC000809306819 1041132244 /nfs/dbraw/zinc/13/22/44/1041132244.db2.gz VQTZHUJDTLASKV-QMMMGPOBSA-N -1 1 317.257 4.057 20 0 DIADMM CCOc1cc(NCc2cccc([O-])c2Cl)ccc1OC ZINC000328188513 1041426184 /nfs/dbraw/zinc/42/61/84/1041426184.db2.gz CGYAJYSAHQJICT-UHFFFAOYSA-N -1 1 307.777 4.065 20 0 DIADMM CC[C@@H]([NH2+]Cc1cccc(O)c1Cl)c1ccccc1OC ZINC000328201263 1041426677 /nfs/dbraw/zinc/42/66/77/1041426677.db2.gz GFGIMJRLBHWMPL-CQSZACIVSA-N -1 1 305.805 4.295 20 0 DIADMM CCOC(=O)Nc1ccc(NCc2cccc([O-])c2Cl)cc1 ZINC000328270381 1041429210 /nfs/dbraw/zinc/42/92/10/1041429210.db2.gz WVSBHFDNUQMWOH-UHFFFAOYSA-N -1 1 320.776 4.226 20 0 DIADMM CCOc1ccc(NCc2cccc([O-])c2Cl)cc1OCC ZINC000328474615 1041439707 /nfs/dbraw/zinc/43/97/07/1041439707.db2.gz ODZUKMMLDILRLJ-UHFFFAOYSA-N -1 1 321.804 4.455 20 0 DIADMM CCCCC1CCC(NC(=O)Cc2ccc([O-])c(Cl)c2)CC1 ZINC001626555280 1041501638 /nfs/dbraw/zinc/50/16/38/1041501638.db2.gz KRVZWQRFRCWGHJ-UHFFFAOYSA-N -1 1 323.864 4.453 20 0 DIADMM O=C([N-]c1cscc1Cl)c1scnc1C(F)(F)F ZINC001133070833 1041580047 /nfs/dbraw/zinc/58/00/47/1041580047.db2.gz NXLHNLVAHNYIAN-UHFFFAOYSA-N -1 1 312.725 4.129 20 0 DIADMM O=C([N-]OC/C=C\Cl)C1(Cc2cccs2)CCCCC1 ZINC000812409280 1041621538 /nfs/dbraw/zinc/62/15/38/1041621538.db2.gz OZTGUFPDDZHJOY-UITAMQMPSA-N -1 1 313.850 4.041 20 0 DIADMM CC(C)c1ccc(CCNC(=O)c2cc(Cl)ccc2[O-])cc1 ZINC001135292034 1042008975 /nfs/dbraw/zinc/00/89/75/1042008975.db2.gz VPCBKDPFVBAANG-UHFFFAOYSA-N -1 1 317.816 4.142 20 0 DIADMM CCc1ccc(S(=O)(=O)[N-]c2ccc(C)cc2Cl)s1 ZINC000048652675 1042019782 /nfs/dbraw/zinc/01/97/82/1042019782.db2.gz JCQRKLKISQSQOC-UHFFFAOYSA-N -1 1 315.847 4.073 20 0 DIADMM O=C(NC1CCCCCCC1)c1ccc2ccc(O)cc2c1[O-] ZINC001135372401 1042020789 /nfs/dbraw/zinc/02/07/89/1042020789.db2.gz BMQZFPQHBIZGTH-UHFFFAOYSA-N -1 1 313.397 4.094 20 0 DIADMM CCCN(CCCCCC(=O)[O-])Cc1c(F)cccc1Cl ZINC000652393627 1042036596 /nfs/dbraw/zinc/03/65/96/1042036596.db2.gz KFAXXDKJOXXFLI-UHFFFAOYSA-N -1 1 315.816 4.336 20 0 DIADMM O=C(Cc1ccc([O-])c(Cl)c1)Nc1ccc(F)c(Cl)c1 ZINC001135543375 1042042987 /nfs/dbraw/zinc/04/29/87/1042042987.db2.gz DUWXNCKTLIHAPE-UHFFFAOYSA-N -1 1 314.143 4.019 20 0 DIADMM CCCCC[C@H]1CCCCN1Cc1nc(=O)c2sccc2[n-]1 ZINC000662153914 1042073672 /nfs/dbraw/zinc/07/36/72/1042073672.db2.gz HLWQKWXUPNJDPB-ZDUSSCGKSA-N -1 1 319.474 4.332 20 0 DIADMM Cc1cc(NC(=O)c2ccc([O-])c(F)c2)ccc1-c1ccncc1 ZINC000816834156 1042083112 /nfs/dbraw/zinc/08/31/12/1042083112.db2.gz IHSTVVSLASZPQH-UHFFFAOYSA-N -1 1 322.339 4.154 20 0 DIADMM CCCCCC[C@H](C)NC(=O)c1ccc(C(F)(F)F)cc1[O-] ZINC001136023440 1042125389 /nfs/dbraw/zinc/12/53/89/1042125389.db2.gz YEVFPBAIMYPTBU-NSHDSACASA-N -1 1 317.351 4.500 20 0 DIADMM [O-]c1ccc(F)c(-c2cc(OCC(F)(F)F)ccn2)c1Cl ZINC001245826058 1042137227 /nfs/dbraw/zinc/13/72/27/1042137227.db2.gz AADRKZAVUWULLE-UHFFFAOYSA-N -1 1 321.657 4.188 20 0 DIADMM CC[S@](=N)(=O)c1ccc(-c2c(F)ccc([O-])c2Cl)cc1 ZINC001245831565 1042138643 /nfs/dbraw/zinc/13/86/43/1042138643.db2.gz NKQOOLIQJRHLCN-FQEVSTJZSA-N -1 1 313.781 4.277 20 0 DIADMM CCc1ccc(S(=O)(=O)[N-]c2ccc3ccccc3c2)cc1 ZINC000005133646 1042164106 /nfs/dbraw/zinc/16/41/06/1042164106.db2.gz HKHRUCRYTPMZOT-UHFFFAOYSA-N -1 1 311.406 4.203 20 0 DIADMM CC[C@@H](CC(=O)Nc1ccc(-c2cc(=O)[nH][n-]2)cc1)C(C)(C)C ZINC001136190605 1042173565 /nfs/dbraw/zinc/17/35/65/1042173565.db2.gz KFOXVDMYHIUHOX-ZDUSSCGKSA-N -1 1 315.417 4.183 20 0 DIADMM Cc1ccc(C(=O)CCC(=O)Nc2ccc([O-])c(Cl)c2)s1 ZINC000111667457 1042229110 /nfs/dbraw/zinc/22/91/10/1042229110.db2.gz MKFBWDOIKMRDLE-UHFFFAOYSA-N -1 1 323.801 4.017 20 0 DIADMM O=C(Nc1ccc([O-])c(Cl)c1)c1csc(-c2ccoc2)n1 ZINC000111666953 1042229298 /nfs/dbraw/zinc/22/92/98/1042229298.db2.gz MVUPWYMYMXMTDP-UHFFFAOYSA-N -1 1 320.757 4.014 20 0 DIADMM CC(C)(C)c1ccc([C@H]([N-]C(=O)C(C)(F)F)C(F)(F)F)cc1 ZINC001136401839 1042237328 /nfs/dbraw/zinc/23/73/28/1042237328.db2.gz DXCWREWZQBOFGA-NSHDSACASA-N -1 1 323.305 4.359 20 0 DIADMM COc1cnc(C=Cc2cc(-c3ccccc3)cs2)[n-]c1=O ZINC000821013413 1042240357 /nfs/dbraw/zinc/24/03/57/1042240357.db2.gz ZYMMSVWGRGDLDS-FPLPWBNLSA-N -1 1 310.378 4.090 20 0 DIADMM CC(C)(C)[C@@H]1CCCC[C@@H]1CNC(=O)c1cc(F)ccc1[O-] ZINC001136512633 1042267755 /nfs/dbraw/zinc/26/77/55/1042267755.db2.gz FOXYFMQTFSSKFO-IUODEOHRSA-N -1 1 307.409 4.114 20 0 DIADMM O=C(Nc1ccc([O-])c(F)c1F)C1(CCc2ccccc2)CC1 ZINC000821980213 1042270517 /nfs/dbraw/zinc/27/05/17/1042270517.db2.gz LHMNSRBRRXZFFG-UHFFFAOYSA-N -1 1 317.335 4.022 20 0 DIADMM CC1CCC(C)(NC(=O)c2ccc(C(F)(F)F)c([O-])c2)CC1 ZINC001136547016 1042275791 /nfs/dbraw/zinc/27/57/91/1042275791.db2.gz GKBVYZJRJWYKEH-UHFFFAOYSA-N -1 1 315.335 4.110 20 0 DIADMM O=C(Nc1cc(F)cc(F)c1[O-])c1cc(C2CC2)oc1C1CC1 ZINC000822972710 1042307984 /nfs/dbraw/zinc/30/79/84/1042307984.db2.gz XNKKUHYYEVBQNT-UHFFFAOYSA-N -1 1 319.307 4.271 20 0 DIADMM O=C(Nc1ccc(Cl)cc1-n1cccc1)c1ccccc1[O-] ZINC001136658169 1042309500 /nfs/dbraw/zinc/30/95/00/1042309500.db2.gz PCQZENKJTPCBNY-UHFFFAOYSA-N -1 1 312.756 4.089 20 0 DIADMM CC(C)[C@H]1CCCN(C(=O)c2ccc3ccccc3c2[O-])CC1 ZINC000391312867 1042318373 /nfs/dbraw/zinc/31/83/73/1042318373.db2.gz KFEODFOVITZOPR-HNNXBMFYSA-N -1 1 311.425 4.444 20 0 DIADMM [O-]c1cccc(CNc2ccc(-c3ncco3)cc2)c1Cl ZINC000645171220 1042328189 /nfs/dbraw/zinc/32/81/89/1042328189.db2.gz LWHDVUYFMRDWOE-UHFFFAOYSA-N -1 1 300.745 4.313 20 0 DIADMM Cc1ccc(-c2nc3cc(C(F)(F)F)ccc3c(=O)[n-]2)cc1F ZINC000614117444 1042411602 /nfs/dbraw/zinc/41/16/02/1042411602.db2.gz YRCPEVTUFOVTAS-UHFFFAOYSA-N -1 1 322.261 4.469 20 0 DIADMM Cc1cc(OC(C)C)ccc1Nc1ccc(-n2ccc(=O)[n-]2)cc1 ZINC001211818685 1042475118 /nfs/dbraw/zinc/47/51/18/1042475118.db2.gz WXQHPPNDPJUKFT-UHFFFAOYSA-N -1 1 323.396 4.417 20 0 DIADMM CCCC[C@H](NCc1ccc(-c2ccc(F)cc2C)o1)C(=O)[O-] ZINC000262700334 1042543695 /nfs/dbraw/zinc/54/36/95/1042543695.db2.gz KCQQCWTYRXPPEF-INIZCTEOSA-N -1 1 319.376 4.127 20 0 DIADMM Cc1c(NC(=O)c2c(F)ccc([O-])c2F)sc2c1CCCC2 ZINC000280656667 1042577408 /nfs/dbraw/zinc/57/74/08/1042577408.db2.gz AGTKWGPHWOWXGA-UHFFFAOYSA-N -1 1 323.364 4.171 20 0 DIADMM O=C([N-]c1c(F)cccc1Cl)c1cc(-c2ccccc2)no1 ZINC001268961392 1042598083 /nfs/dbraw/zinc/59/80/83/1042598083.db2.gz BVOXHCRSGVZOAX-UHFFFAOYSA-N -1 1 316.719 4.386 20 0 DIADMM C[C@H]1CCCC[C@@H]1N(C)C(=O)c1ccc(C(F)(F)F)cc1[O-] ZINC000436762180 1042843120 /nfs/dbraw/zinc/84/31/20/1042843120.db2.gz CMBXNDWPSAGMIK-GWCFXTLKSA-N -1 1 315.335 4.062 20 0 DIADMM CSc1ccc([O-])c(-c2nc([C@H]3CCC(F)(F)C3)no2)c1 ZINC000664866368 1042983536 /nfs/dbraw/zinc/98/35/36/1042983536.db2.gz CZAIPHAPYHXDEJ-QMMMGPOBSA-N -1 1 312.341 4.067 20 0 DIADMM Cc1ccc2sc(C(=O)Nc3ccc(F)cc3[O-])cc2c1 ZINC000519604013 1042984807 /nfs/dbraw/zinc/98/48/07/1042984807.db2.gz BMELZSWGMRESNV-UHFFFAOYSA-N -1 1 301.342 4.307 20 0 DIADMM CC[C@@H](C)[C@H](NC(=O)Nc1ccc([O-])c(Cl)c1)C(F)(F)F ZINC000520331379 1043034729 /nfs/dbraw/zinc/03/47/29/1043034729.db2.gz ABSBKZFTAIPVKW-HQJQHLMTSA-N -1 1 324.730 4.144 20 0 DIADMM O=C(Nc1ccc([O-])c(Cl)c1)c1scnc1C1CCCC1 ZINC000184015950 1043177542 /nfs/dbraw/zinc/17/75/42/1043177542.db2.gz VHSRNFYXPFHFAB-UHFFFAOYSA-N -1 1 322.817 4.412 20 0 DIADMM COc1cc(C(=O)Nc2c(C)cc(C)cc2C)cc(Cl)c1[O-] ZINC000349809865 1043523767 /nfs/dbraw/zinc/52/37/67/1043523767.db2.gz XIAPRAFGPBZANF-UHFFFAOYSA-N -1 1 319.788 4.232 20 0 DIADMM O=C(Nc1c([O-])cccc1F)c1cc2c(ccc3ccccc23)[nH]1 ZINC000608365405 1043573855 /nfs/dbraw/zinc/57/38/55/1043573855.db2.gz FLBFMPWQSLBQBE-UHFFFAOYSA-N -1 1 320.323 4.418 20 0 DIADMM CC(C)(C)CN(CC(=O)[O-])Cc1ccc(-c2ccccc2F)o1 ZINC000665349682 1043596923 /nfs/dbraw/zinc/59/69/23/1043596923.db2.gz QUBOADSSNKBXPE-UHFFFAOYSA-N -1 1 319.376 4.018 20 0 DIADMM Cc1ccc(Oc2ccc(NC(=O)c3ccccc3[O-])cn2)cc1 ZINC001141789629 1043661927 /nfs/dbraw/zinc/66/19/27/1043661927.db2.gz KXWZRSXRRRLIHF-UHFFFAOYSA-N -1 1 320.348 4.140 20 0 DIADMM C[C@@H](CCNC(=O)Cc1ccc([O-])c(Cl)c1)CC(C)(C)C ZINC001138249772 1043821153 /nfs/dbraw/zinc/82/11/53/1043821153.db2.gz BGFNSDYMFCEBLP-LBPRGKRZSA-N -1 1 311.853 4.167 20 0 DIADMM C[C@H](Oc1[n-]c(=S)ncc1F)c1c(Cl)cccc1Cl ZINC001227386912 1044220516 /nfs/dbraw/zinc/22/05/16/1044220516.db2.gz QJVMLFGAACGJNK-LURJTMIESA-N -1 1 319.188 4.351 20 0 DIADMM O=C([O-])c1cccc(CN2CCC[C@@H]2c2ccsc2)c1Cl ZINC000563279519 1044242845 /nfs/dbraw/zinc/24/28/45/1044242845.db2.gz VWNMKZNIWUHQCH-CQSZACIVSA-N -1 1 321.829 4.437 20 0 DIADMM O=C([O-])CC[C@@H]1CCCN(Cc2cc(Cl)cc(Cl)c2)C1 ZINC000086809236 1044252935 /nfs/dbraw/zinc/25/29/35/1044252935.db2.gz HKABCAUDARVKFW-NSHDSACASA-N -1 1 316.228 4.070 20 0 DIADMM Cc1csc(C2(NCc3cccc([O-])c3Cl)CCCC2)n1 ZINC000293633936 1044306593 /nfs/dbraw/zinc/30/65/93/1044306593.db2.gz RHLLXGYASYNXSE-UHFFFAOYSA-N -1 1 322.861 4.370 20 0 DIADMM CC(C)c1scnc1NC(=O)Nc1ccc([O-])c(Cl)c1 ZINC000564180767 1044354923 /nfs/dbraw/zinc/35/49/23/1044354923.db2.gz UEVCVFIIUVLWPT-UHFFFAOYSA-N -1 1 311.794 4.270 20 0 DIADMM Cc1nc([C@@H]2CCCN2Cc2cccc([O-])c2Cl)cs1 ZINC000294493469 1044427465 /nfs/dbraw/zinc/42/74/65/1044427465.db2.gz BGFOVCXXDMKFIY-ZDUSSCGKSA-N -1 1 308.834 4.148 20 0 DIADMM C[C@H](c1cc(Cl)ccc1Cl)N1CC[C@@H](C)[C@@H](C(=O)[O-])C1 ZINC000567856530 1044587210 /nfs/dbraw/zinc/58/72/10/1044587210.db2.gz LYPYORBNWHQBLQ-BREBYQMCSA-N -1 1 316.228 4.097 20 0 DIADMM Cc1cc(C)cc([N-]S(=O)(=O)c2ccc(C(F)F)cc2)c1 ZINC000568926453 1044660684 /nfs/dbraw/zinc/66/06/84/1044660684.db2.gz ZRSFLQGZVJRHJG-UHFFFAOYSA-N -1 1 311.353 4.042 20 0 DIADMM Cc1nc(C)c([C@@H](C)[N@@H+](C)Cc2cc(C(=O)[O-])sc2C)s1 ZINC000568990899 1044664713 /nfs/dbraw/zinc/66/47/13/1044664713.db2.gz NSGRQQJDAXAWDO-SECBINFHSA-N -1 1 324.471 4.021 20 0 DIADMM Cc1nc(C)c([C@@H](C)N(C)Cc2cc(C(=O)[O-])sc2C)s1 ZINC000568990899 1044664718 /nfs/dbraw/zinc/66/47/18/1044664718.db2.gz NSGRQQJDAXAWDO-SECBINFHSA-N -1 1 324.471 4.021 20 0 DIADMM CCOc1cc(-c2noc(/C=C/C3CCC3)n2)cc(Cl)c1[O-] ZINC000445411390 1044711759 /nfs/dbraw/zinc/71/17/59/1044711759.db2.gz JHMYNWXMQOJXJT-VOTSOKGWSA-N -1 1 320.776 4.308 20 0 DIADMM CCCCCc1nc(-c2cc(Cl)c([O-])c(OCC)c2)no1 ZINC000445423192 1044714670 /nfs/dbraw/zinc/71/46/70/1044714670.db2.gz UKTGYHXZYPHDFB-UHFFFAOYSA-N -1 1 310.781 4.227 20 0 DIADMM CCOc1cc(-c2noc([C@@H]3CC3(C)C)n2)cc(Cl)c1[O-] ZINC000445414334 1044715911 /nfs/dbraw/zinc/71/59/11/1044715911.db2.gz ZQXDLPZRCVVRON-VIFPVBQESA-N -1 1 308.765 4.008 20 0 DIADMM Cc1scc(-c2nc(-c3ccc([O-])cc3Cl)no2)c1C ZINC000445446204 1044723903 /nfs/dbraw/zinc/72/39/03/1044723903.db2.gz LGKUUCJPVLBMNU-UHFFFAOYSA-N -1 1 306.774 4.441 20 0 DIADMM C/C(=C/c1nc(-c2ccc([O-])c(F)c2)no1)c1ccc(F)cc1 ZINC000445477354 1044728855 /nfs/dbraw/zinc/72/88/55/1044728855.db2.gz NKZQGMNBOFPIMX-NTMALXAHSA-N -1 1 314.291 4.281 20 0 DIADMM CC(C)(C)c1ncc(-c2nc(-c3ccc([O-])c(F)c3)no2)s1 ZINC000445484254 1044733345 /nfs/dbraw/zinc/73/33/45/1044733345.db2.gz WWVHRARRVRNEMT-UHFFFAOYSA-N -1 1 319.361 4.002 20 0 DIADMM Cc1cc(Cl)ccc1Cc1noc(-c2cc(F)ccc2[O-])n1 ZINC000445598511 1044771416 /nfs/dbraw/zinc/77/14/16/1044771416.db2.gz BKCGZRGXQLEUQL-UHFFFAOYSA-N -1 1 318.735 4.134 20 0 DIADMM CCSCc1cccc([N-]S(=O)(=O)c2ccccc2C)c1 ZINC000524640766 1044893380 /nfs/dbraw/zinc/89/33/80/1044893380.db2.gz RKYBTMGTIKGINE-UHFFFAOYSA-N -1 1 321.467 4.049 20 0 DIADMM Cc1noc(C(C)C)c1[N-]C(=O)c1cnc(-c2ccco2)s1 ZINC000928787555 1044981687 /nfs/dbraw/zinc/98/16/87/1044981687.db2.gz OBNQTBSWBGFPGA-UHFFFAOYSA-N -1 1 317.370 4.075 20 0 DIADMM CCc1ccc([C@@H](C)C(=O)Nc2ccc([O-])c(Cl)c2)cc1 ZINC000601052658 1045180069 /nfs/dbraw/zinc/18/00/69/1045180069.db2.gz YKERHWQWUFWBAH-LLVKDONJSA-N -1 1 303.789 4.350 20 0 DIADMM CC(C)[C@@H](c1ccc(F)cc1)N(C)C(=O)c1cc(F)ccc1[O-] ZINC000447860496 1045183967 /nfs/dbraw/zinc/18/39/67/1045183967.db2.gz HDNVCVGPZNUNKI-KRWDZBQOSA-N -1 1 319.351 4.140 20 0 DIADMM CC1(C)CC(NC(=O)c2c(F)ccc([O-])c2F)CC(C)(C)C1 ZINC000557520618 1045194471 /nfs/dbraw/zinc/19/44/71/1045194471.db2.gz CQNMRPWPPOORLH-UHFFFAOYSA-N -1 1 311.372 4.005 20 0 DIADMM CC(C)(C(=O)Nc1cc(Cl)c([O-])c2ccccc12)C(F)F ZINC000529539812 1045491560 /nfs/dbraw/zinc/49/15/60/1045491560.db2.gz VCIBLNUXPRJQPH-UHFFFAOYSA-N -1 1 313.731 4.429 20 0 DIADMM CC[C@H](C)Oc1ccc(C(=O)Nc2ccc([O-])c(Cl)c2)cc1 ZINC000750305583 1045518600 /nfs/dbraw/zinc/51/86/00/1045518600.db2.gz IJHMKVBVZWQMFX-NSHDSACASA-N -1 1 319.788 4.475 20 0 DIADMM O=C(Nc1cc(Cl)c([O-])c2ccccc12)C1CCSCC1 ZINC000628233160 1045548754 /nfs/dbraw/zinc/54/87/54/1045548754.db2.gz KIDZXFCGJFQUTI-UHFFFAOYSA-N -1 1 321.829 4.281 20 0 DIADMM Cc1sc([C@H](C)NCc2ccc(C(C)C)cc2)nc1C(=O)[O-] ZINC000900075312 1045598168 /nfs/dbraw/zinc/59/81/68/1045598168.db2.gz QBQKJYWQDWWCIG-NSHDSACASA-N -1 1 318.442 4.124 20 0 DIADMM [O-]c1ccc(Cl)c(F)c1CNc1ccccc1N1CCCC1 ZINC000190807000 1045612711 /nfs/dbraw/zinc/61/27/11/1045612711.db2.gz BSWJXZJYJKUVLD-UHFFFAOYSA-N -1 1 320.795 4.397 20 0 DIADMM Cc1cc(NC(=O)Nc2ccc([O-])c(Cl)c2)ccc1N(C)C ZINC000190933635 1045632451 /nfs/dbraw/zinc/63/24/51/1045632451.db2.gz MWTBUSSODDIAEM-UHFFFAOYSA-N -1 1 319.792 4.064 20 0 DIADMM CC[C@@H](CSc1nc(C)c(C2CC2)c(=O)[n-]1)CC(F)F ZINC000631023822 1045797413 /nfs/dbraw/zinc/79/74/13/1045797413.db2.gz YNHTVNSDIGXQSC-SECBINFHSA-N -1 1 302.390 4.142 20 0 DIADMM O=c1cc(-c2ccccc2)nc(SCOC2CCCCC2)[n-]1 ZINC000901615884 1045779199 /nfs/dbraw/zinc/77/91/99/1045779199.db2.gz JSBSILPBDXKFSZ-UHFFFAOYSA-N -1 1 316.426 4.248 20 0 DIADMM O=c1cc(-c2ccccc2)nc(SC[C@@H]2CCC(F)(F)C2)[n-]1 ZINC000901615497 1045780190 /nfs/dbraw/zinc/78/01/90/1045780190.db2.gz FIYSDPMFIBAAIV-LLVKDONJSA-N -1 1 322.380 4.377 20 0 DIADMM C[C@@H](CN1Cc2ccc(C(=O)[O-])cc2C1)c1cccc(Cl)c1 ZINC000901646520 1045783353 /nfs/dbraw/zinc/78/33/53/1045783353.db2.gz PXNRBESIJPUDAD-LBPRGKRZSA-N -1 1 315.800 4.158 20 0 DIADMM Cc1nc(SCCCCC2CCOCC2)[n-]c(=O)c1C1CC1 ZINC000631023913 1045797074 /nfs/dbraw/zinc/79/70/74/1045797074.db2.gz ZOCIMNPVIBFZNZ-UHFFFAOYSA-N -1 1 322.474 4.057 20 0 DIADMM Cc1nc(SCc2sccc2Cl)[n-]c(=O)c1C1CC1 ZINC000631023104 1045797087 /nfs/dbraw/zinc/79/70/87/1045797087.db2.gz HWGVJEKPCGQUIB-UHFFFAOYSA-N -1 1 312.847 4.375 20 0 DIADMM Cc1nc(S[C@H](C)c2ccccc2F)[n-]c(=O)c1C1CC1 ZINC000631023670 1045797547 /nfs/dbraw/zinc/79/75/47/1045797547.db2.gz DEBIBJRKWXFAKZ-SNVBAGLBSA-N -1 1 304.390 4.360 20 0 DIADMM Cc1nc(SCCO[C@@H]2CCCC[C@@H]2C)[n-]c(=O)c1C1CC1 ZINC000631024582 1045798163 /nfs/dbraw/zinc/79/81/63/1045798163.db2.gz BVIRFCQFZDTNFW-SMDDNHRTSA-N -1 1 322.474 4.055 20 0 DIADMM Cc1nc(SCCO[C@H]2CCCC[C@@H]2C)[n-]c(=O)c1C1CC1 ZINC000631024577 1045798428 /nfs/dbraw/zinc/79/84/28/1045798428.db2.gz BVIRFCQFZDTNFW-FZMZJTMJSA-N -1 1 322.474 4.055 20 0 DIADMM Cc1ccc(NC(=O)Nc2cc(F)cc(F)c2[O-])cc1Cl ZINC001202807018 1045889295 /nfs/dbraw/zinc/88/92/95/1045889295.db2.gz DNXIULNQJKLCNF-UHFFFAOYSA-N -1 1 312.703 4.276 20 0 DIADMM C[C@H]1C[C@H]1c1ccc(CNCc2ccc(C(=O)[O-])c(Cl)c2)o1 ZINC000902107972 1045914151 /nfs/dbraw/zinc/91/41/51/1045914151.db2.gz IDCBRPACRPONJK-IINYFYTJSA-N -1 1 319.788 4.044 20 0 DIADMM O=C(Nc1ccc(F)cc1[O-])c1ccc(Oc2ccccc2)o1 ZINC000531756379 1045915052 /nfs/dbraw/zinc/91/50/52/1045915052.db2.gz YMSLXNGLTBUDNQ-UHFFFAOYSA-N -1 1 313.284 4.169 20 0 DIADMM CCc1oc(CN[C@H](C)c2cccc(C)c2C)cc1C(=O)[O-] ZINC000902267008 1045959648 /nfs/dbraw/zinc/95/96/48/1045959648.db2.gz AQYIKAQSPVURCW-CYBMUJFWSA-N -1 1 301.386 4.008 20 0 DIADMM CCc1oc(CNC2(c3ccccc3C)CCC2)cc1C(=O)[O-] ZINC000902309525 1045971360 /nfs/dbraw/zinc/97/13/60/1045971360.db2.gz ORJSUQCUIAAOFI-UHFFFAOYSA-N -1 1 313.397 4.018 20 0 DIADMM CCc1oc(CNCc2ccc(C(C)(C)C)s2)cc1C(=O)[O-] ZINC000902419091 1045994056 /nfs/dbraw/zinc/99/40/56/1045994056.db2.gz JNFRBRRJUKKXSG-UHFFFAOYSA-N -1 1 321.442 4.189 20 0 DIADMM O=S(=O)([N-]c1ccc(Cl)c2cccnc12)C1=CCCCC1 ZINC000829691725 1045999304 /nfs/dbraw/zinc/99/93/04/1045999304.db2.gz AOGIMNMPCOCZIY-UHFFFAOYSA-N -1 1 322.817 4.088 20 0 DIADMM Cc1ccc(-c2cccc(CNCc3ccc(C(=O)[O-])o3)c2)cc1 ZINC000756285872 1046063683 /nfs/dbraw/zinc/06/36/83/1046063683.db2.gz QMPSDJIMDJXGFK-UHFFFAOYSA-N -1 1 321.376 4.243 20 0 DIADMM Cc1ccc2c(c1)scc2C(=O)Nc1nc(Cl)ccc1[O-] ZINC001161178849 1046082049 /nfs/dbraw/zinc/08/20/49/1046082049.db2.gz AWLXSJDMWQYHNW-UHFFFAOYSA-N -1 1 318.785 4.216 20 0 DIADMM CC1(C)CCC[C@H](CNC(=O)c2ccc3ccccc3c2[O-])C1 ZINC001142301169 1046152505 /nfs/dbraw/zinc/15/25/05/1046152505.db2.gz KUAMRXGWBXDVST-AWEZNQCLSA-N -1 1 311.425 4.492 20 0 DIADMM O=C(NC1(Cc2ccccc2)CC1)c1ccc2ccccc2c1[O-] ZINC001138369867 1046159201 /nfs/dbraw/zinc/15/92/01/1046159201.db2.gz YDBWKCIAHIGAIP-UHFFFAOYSA-N -1 1 317.388 4.051 20 0 DIADMM O=C([O-])CC[C@@H]1CCCC[N@H+]1Cc1cc(Cl)cc(Cl)c1 ZINC000086754855 1046164935 /nfs/dbraw/zinc/16/49/35/1046164935.db2.gz CHZKXSDLFYLZRK-AWEZNQCLSA-N -1 1 316.228 4.213 20 0 DIADMM CCC[C@@H]1CCCCN1Cc1occ(C(F)(F)F)c1C(=O)[O-] ZINC000903894168 1046336981 /nfs/dbraw/zinc/33/69/81/1046336981.db2.gz PHSATFBMHYWNOL-SNVBAGLBSA-N -1 1 319.323 4.151 20 0 DIADMM CCC(C)(C)c1ccc(C(=O)Nc2c([O-])cccc2F)cc1 ZINC000677123571 1046466048 /nfs/dbraw/zinc/46/60/48/1046466048.db2.gz HTRCYOHRYTYHIE-UHFFFAOYSA-N -1 1 301.361 4.471 20 0 DIADMM COc1nccc(Nc2c(Cl)ccc([O-])c2Cl)c1Cl ZINC001211952513 1046545204 /nfs/dbraw/zinc/54/52/04/1046545204.db2.gz FBPCFLHWDBPMKS-UHFFFAOYSA-N -1 1 319.575 4.500 20 0 DIADMM O=C(c1cc2ccccc2cc1[O-])N(C1CC1)C1CCCCC1 ZINC000642061384 1046552409 /nfs/dbraw/zinc/55/24/09/1046552409.db2.gz CCSBQCDUXRIIGF-UHFFFAOYSA-N -1 1 309.409 4.483 20 0 DIADMM Cc1ccc(C2(C(=O)Nc3ccc([O-])c(F)c3F)CCC2)cc1 ZINC000644737537 1046741393 /nfs/dbraw/zinc/74/13/93/1046741393.db2.gz ISCPNWFZTXLOKG-UHFFFAOYSA-N -1 1 317.335 4.039 20 0 DIADMM [O-]c1cccc(CNc2cccc(-c3ncco3)c2)c1Cl ZINC000645170961 1046772189 /nfs/dbraw/zinc/77/21/89/1046772189.db2.gz MVGHHWFCCRLFHF-UHFFFAOYSA-N -1 1 300.745 4.313 20 0 DIADMM CO[C@H]1CCOc2c(NCc3cccc([O-])c3Cl)cccc21 ZINC000645178051 1046775686 /nfs/dbraw/zinc/77/56/86/1046775686.db2.gz NICWOGXSGAODTO-HNNXBMFYSA-N -1 1 319.788 4.128 20 0 DIADMM COc1cc(SC)ccc1NCc1cccc([O-])c1Cl ZINC000645177534 1046776612 /nfs/dbraw/zinc/77/66/12/1046776612.db2.gz PWCDWLKAYYNFOV-UHFFFAOYSA-N -1 1 309.818 4.388 20 0 DIADMM C[C@@H]1C[C@H]1c1ccc(CCC(=O)Nc2ccc([O-])c(Cl)c2)o1 ZINC000679643833 1046885677 /nfs/dbraw/zinc/88/56/77/1046885677.db2.gz LFGAOOXDEDHZIY-ZWNOBZJWSA-N -1 1 319.788 4.333 20 0 DIADMM [O-]c1c(Cl)cc(CN2CC[C@@H](c3cccnc3)C2)cc1Cl ZINC001140833646 1046920943 /nfs/dbraw/zinc/92/09/43/1046920943.db2.gz DVLHPXLUZGIGPN-CYBMUJFWSA-N -1 1 323.223 4.084 20 0 DIADMM [O-]c1c(Cl)cc(CN2C[C@H]3[C@H](CCC3(F)F)C2)cc1Cl ZINC001140834887 1046923620 /nfs/dbraw/zinc/92/36/20/1046923620.db2.gz GYTHZKKMNXJCBZ-ZJUUUORDSA-N -1 1 322.182 4.176 20 0 DIADMM [O-]c1c(Cl)cc(CN2CCCC3(CCC3)C2)cc1Cl ZINC001140836036 1046923698 /nfs/dbraw/zinc/92/36/98/1046923698.db2.gz JNJFGWOKDHCLDN-UHFFFAOYSA-N -1 1 300.229 4.465 20 0 DIADMM CN(Cc1ccsc1)Cc1cc(Cl)c([O-])c(Cl)c1 ZINC001140834787 1046923921 /nfs/dbraw/zinc/92/39/21/1046923921.db2.gz ZBJNMBXZPYZLPQ-UHFFFAOYSA-N -1 1 302.226 4.393 20 0 DIADMM COc1ccccc1[C@@H]1CCCN1Cc1ccc([O-])c(F)c1F ZINC001140894448 1046945848 /nfs/dbraw/zinc/94/58/48/1046945848.db2.gz YTTMNWOREMABOM-AWEZNQCLSA-N -1 1 319.351 4.016 20 0 DIADMM C[C@@H]1c2c(Cl)cc(Cl)cc2CCN1CCCCC(=O)[O-] ZINC000262204510 1046963570 /nfs/dbraw/zinc/96/35/70/1046963570.db2.gz HWCBTWXAFGXEDR-SNVBAGLBSA-N -1 1 316.228 4.167 20 0 DIADMM Cc1nnc(-c2ccc(Nc3cc([O-])c(Cl)cc3F)cc2)o1 ZINC001203096571 1047022362 /nfs/dbraw/zinc/02/23/62/1047022362.db2.gz YAFHUVVCVGBFON-UHFFFAOYSA-N -1 1 319.723 4.287 20 0 DIADMM Cc1sc(NC(=O)c2ccccc2[O-])nc1C1CCCCC1 ZINC001141140636 1047025353 /nfs/dbraw/zinc/02/53/53/1047025353.db2.gz MRGYMICRPNXIPC-UHFFFAOYSA-N -1 1 316.426 4.457 20 0 DIADMM CCSc1ccc([C@H](C)NC(=O)c2ccc([O-])c(F)c2)cc1 ZINC000681041695 1047088444 /nfs/dbraw/zinc/08/84/44/1047088444.db2.gz CPDMGVRUIRTUQU-NSHDSACASA-N -1 1 319.401 4.134 20 0 DIADMM CC(C)Sc1ccccc1NC(=O)c1ccc([O-])c(F)c1 ZINC000681055559 1047089261 /nfs/dbraw/zinc/08/92/61/1047089261.db2.gz BWOOBEUMMUXZLA-UHFFFAOYSA-N -1 1 305.374 4.284 20 0 DIADMM CCC[C@@H](NC(=O)c1ccc([O-])c(F)c1)c1ccc(F)cc1F ZINC000681056178 1047090015 /nfs/dbraw/zinc/09/00/15/1047090015.db2.gz WCJXBOSZVKIMRX-OAHLLOKOSA-N -1 1 323.314 4.081 20 0 DIADMM CCCNc1ccc(Cl)cc1NC(=O)c1ccc([O-])c(F)c1 ZINC000681056518 1047090166 /nfs/dbraw/zinc/09/01/66/1047090166.db2.gz LKSKQOJUUYHWFU-UHFFFAOYSA-N -1 1 322.767 4.259 20 0 DIADMM O=C(Nc1cccc(NC2CCCC2)c1)c1ccc([O-])c(F)c1 ZINC000681090649 1047095049 /nfs/dbraw/zinc/09/50/49/1047095049.db2.gz WWDSWLMDKSRYOM-UHFFFAOYSA-N -1 1 314.360 4.138 20 0 DIADMM O=C(c1ccc([O-])c(F)c1)N1CC2(CC=CC2)[C@@H]1c1ccccc1 ZINC000649154418 1047112385 /nfs/dbraw/zinc/11/23/85/1047112385.db2.gz NPBFASUYIVJLCU-SFHVURJKSA-N -1 1 323.367 4.065 20 0 DIADMM O=C(c1ccc([O-])cc1F)N1CC2(CC=CC2)[C@@H]1c1ccccc1 ZINC000649154314 1047112453 /nfs/dbraw/zinc/11/24/53/1047112453.db2.gz KPNVGOLMFRNATI-SFHVURJKSA-N -1 1 323.367 4.065 20 0 DIADMM CC[C@H](CN(CC)C(=O)c1ccc([O-])c(F)c1)c1ccccc1 ZINC000681492507 1047125986 /nfs/dbraw/zinc/12/59/86/1047125986.db2.gz QLTONUKJANFMIM-CQSZACIVSA-N -1 1 315.388 4.187 20 0 DIADMM CCCCN(C(=O)c1ncc(C)cc1[O-])[C@H](C)c1ccc(C)o1 ZINC000681718359 1047143716 /nfs/dbraw/zinc/14/37/16/1047143716.db2.gz GNRYAYFHVIJRAU-CQSZACIVSA-N -1 1 316.401 4.001 20 0 DIADMM O=C([N-]c1c(F)cc(Cl)cc1F)c1c(F)cccc1F ZINC000537145894 1047143795 /nfs/dbraw/zinc/14/37/95/1047143795.db2.gz CLSRLROYYLWGKC-UHFFFAOYSA-N -1 1 303.642 4.149 20 0 DIADMM CC(C)C[C@H]1CCCN(C(=O)c2ccc3ccccc3c2[O-])C1 ZINC001137488005 1047183252 /nfs/dbraw/zinc/18/32/52/1047183252.db2.gz VACZELKXKCOAKP-OAHLLOKOSA-N -1 1 311.425 4.444 20 0 DIADMM CCCC(CCC)C(=O)Nc1ccc(Br)c([O-])c1 ZINC001116886865 1047186553 /nfs/dbraw/zinc/18/65/53/1047186553.db2.gz XOQYAEJMNBJSNM-UHFFFAOYSA-N -1 1 314.223 4.310 20 0 DIADMM CCCc1ccccc1[N-]S(=O)(=O)c1cccc(Cl)c1 ZINC000032098396 1047206194 /nfs/dbraw/zinc/20/61/94/1047206194.db2.gz ZNXMZUHMFVLBBE-UHFFFAOYSA-N -1 1 309.818 4.093 20 0 DIADMM CC(C)C[C@@H](C(=O)Nc1cc([O-])c(F)cc1F)c1ccccc1 ZINC001141833820 1047296650 /nfs/dbraw/zinc/29/66/50/1047296650.db2.gz NDNOECPOTVHLCI-CYBMUJFWSA-N -1 1 319.351 4.439 20 0 DIADMM O=C([N-][C@H](CCCc1ccccc1)c1ccccc1)C(F)(F)F ZINC000725879253 1047323163 /nfs/dbraw/zinc/32/31/63/1047323163.db2.gz FEJFKZRLTCPAAZ-MRXNPFEDSA-N -1 1 321.342 4.429 20 0 DIADMM C[C@@H]([N-]C(=O)C(F)(F)F)c1ccccc1OCc1ccccc1 ZINC000725890615 1047325805 /nfs/dbraw/zinc/32/58/05/1047325805.db2.gz YYVMIIIPFMDGDG-GFCCVEGCSA-N -1 1 323.314 4.005 20 0 DIADMM O=C([N-]CC1(c2ccc(Cl)cc2)CCCCC1)C(F)(F)F ZINC000725899684 1047329684 /nfs/dbraw/zinc/32/96/84/1047329684.db2.gz OGSXWQBREAHXLA-UHFFFAOYSA-N -1 1 319.754 4.220 20 0 DIADMM Cc1ccccc1C(C)(C)CNC(=O)c1c([O-])cccc1Cl ZINC000725899894 1047330238 /nfs/dbraw/zinc/33/02/38/1047330238.db2.gz MBGFHRNHFDTGHR-UHFFFAOYSA-N -1 1 317.816 4.062 20 0 DIADMM Cc1ccc(-c2csc(NC(=O)c3ccccc3[O-])n2)cc1C ZINC001142033516 1047355575 /nfs/dbraw/zinc/35/55/75/1047355575.db2.gz DYCFLGGOPVATLM-UHFFFAOYSA-N -1 1 324.405 4.385 20 0 DIADMM CCC[C@@H](NC(=O)Cc1ccc([O-])c(Cl)c1)C1CCCC1 ZINC001142043208 1047358249 /nfs/dbraw/zinc/35/82/49/1047358249.db2.gz OIRASIPMQNZDPP-OAHLLOKOSA-N -1 1 309.837 4.063 20 0 DIADMM Oc1cc(Cl)c(C[NH+]2CCC3(CC(F)C3)CC2)c(Cl)c1 ZINC001142105672 1047380712 /nfs/dbraw/zinc/38/07/12/1047380712.db2.gz JSHLJYDCFPDXOG-UHFFFAOYSA-N -1 1 318.219 4.413 20 0 DIADMM CCCCC1CCC(CNC(=O)c2ccc([O-])cc2F)CC1 ZINC001142226621 1047406176 /nfs/dbraw/zinc/40/61/76/1047406176.db2.gz YPKHSZUORDXYBJ-UHFFFAOYSA-N -1 1 307.409 4.258 20 0 DIADMM Cc1ccc(CC(C)(C)NC(=O)c2ccc(Cl)cc2[O-])cc1 ZINC001142506009 1047463914 /nfs/dbraw/zinc/46/39/14/1047463914.db2.gz HBIVJZNSWXUGMN-UHFFFAOYSA-N -1 1 317.816 4.105 20 0 DIADMM Cc1cc(S(=O)(=O)[N-]c2c(C)cc(C)cc2C)c(C)s1 ZINC000120489207 1047493799 /nfs/dbraw/zinc/49/37/99/1047493799.db2.gz DVUCTNPZOQOREC-UHFFFAOYSA-N -1 1 309.456 4.091 20 0 DIADMM C[C@@H]1CCN(C(=O)c2ccc(Cl)cc2[O-])[C@@H]2CCCC[C@H]12 ZINC000537645174 1047555864 /nfs/dbraw/zinc/55/58/64/1047555864.db2.gz GWNIVNHZSRDZCO-UXIGCNINSA-N -1 1 307.821 4.086 20 0 DIADMM Cc1cc(C)c(NC(=O)c2ccc3cccnc3c2[O-])cc1C ZINC001149322731 1047559406 /nfs/dbraw/zinc/55/94/06/1047559406.db2.gz QVQOJGMYDNNQHG-UHFFFAOYSA-N -1 1 306.365 4.118 20 0 DIADMM O=C(Nc1ccccc1C(F)F)c1ccc2cccnc2c1[O-] ZINC001149323114 1047559496 /nfs/dbraw/zinc/55/94/96/1047559496.db2.gz UVHXFFMTZXFSNK-UHFFFAOYSA-N -1 1 314.291 4.130 20 0 DIADMM C=Cc1ccc(NC(=O)c2cc3cccc(O)c3cc2[O-])cc1 ZINC001149651351 1047566810 /nfs/dbraw/zinc/56/68/10/1047566810.db2.gz JZOBJMKAOCGZQM-UHFFFAOYSA-N -1 1 305.333 4.146 20 0 DIADMM O=C(c1ccc(F)c([O-])c1)N1CCC[C@H]1CCC1CCCCC1 ZINC001150805829 1047585478 /nfs/dbraw/zinc/58/54/78/1047585478.db2.gz JNMXCULIRJGXFJ-INIZCTEOSA-N -1 1 319.420 4.496 20 0 DIADMM O=C(Nc1cccc(F)c1[O-])c1cc(Cl)cc(Cl)c1 ZINC001151772423 1047601807 /nfs/dbraw/zinc/60/18/07/1047601807.db2.gz QHFWJMRWPOGBOE-UHFFFAOYSA-N -1 1 300.116 4.090 20 0 DIADMM CC[C@@H](NC(=O)c1c([O-])cccc1Cl)c1ccc(F)cc1 ZINC001152049537 1047606999 /nfs/dbraw/zinc/60/69/99/1047606999.db2.gz HOZCHXCSALONPA-CYBMUJFWSA-N -1 1 307.752 4.066 20 0 DIADMM O=C(c1c([O-])cccc1Cl)N1CCC[C@H](C2CCC2)CC1 ZINC001152802837 1047615492 /nfs/dbraw/zinc/61/54/92/1047615492.db2.gz FQMZEFQRAOXQID-ZDUSSCGKSA-N -1 1 307.821 4.088 20 0 DIADMM O=C(N[C@H](CC1CCC1)c1ccccc1)c1c([O-])cccc1F ZINC001152853127 1047616370 /nfs/dbraw/zinc/61/63/70/1047616370.db2.gz WGQMWHBBLYHNDM-MRXNPFEDSA-N -1 1 313.372 4.193 20 0 DIADMM CCSc1ccc(CNC(=O)c2c([O-])cccc2Cl)cc1 ZINC001153396756 1047623585 /nfs/dbraw/zinc/62/35/85/1047623585.db2.gz JGEDLUHXSNSHQZ-UHFFFAOYSA-N -1 1 321.829 4.088 20 0 DIADMM O=C(Nc1ccc2[nH]ccc2c1)c1c([O-])ccc2ccccc21 ZINC001153499078 1047625796 /nfs/dbraw/zinc/62/57/96/1047625796.db2.gz YRMOFEBWIOQACG-UHFFFAOYSA-N -1 1 302.333 4.279 20 0 DIADMM O=C(Nc1nc2ccc(F)cc2o1)c1c([O-])ccc2ccccc21 ZINC001153498182 1047626126 /nfs/dbraw/zinc/62/61/26/1047626126.db2.gz MXURLANDTBTRTK-UHFFFAOYSA-N -1 1 322.295 4.078 20 0 DIADMM O=C(Nc1scnc1C1CC1)c1c([O-])ccc2ccccc21 ZINC001153499607 1047626916 /nfs/dbraw/zinc/62/69/16/1047626916.db2.gz ZNKDVZGWYLHSGI-UHFFFAOYSA-N -1 1 310.378 4.132 20 0 DIADMM C[C@@H]1CC(C)(C)C[C@](C)(NC(=O)c2cc(Cl)ccc2[O-])C1 ZINC001154198525 1047642452 /nfs/dbraw/zinc/64/24/52/1047642452.db2.gz JGLYZIQZTHZOGT-PIGZYNQJSA-N -1 1 309.837 4.380 20 0 DIADMM C[C@@H](NC(=O)c1c([O-])cccc1F)c1cc2ccccc2s1 ZINC001154391654 1047646934 /nfs/dbraw/zinc/64/69/34/1047646934.db2.gz SBRXDKKDMSNZOG-SNVBAGLBSA-N -1 1 315.369 4.237 20 0 DIADMM CC(C)(C)[C@@H]1CCC[C@@H](NC(=O)c2c([O-])cccc2F)CC1 ZINC001154445049 1047648744 /nfs/dbraw/zinc/64/87/44/1047648744.db2.gz NGOYYBFXFJJUPC-CHWSQXEVSA-N -1 1 307.409 4.256 20 0 DIADMM Cc1ccc2ncc([O-])c(C(=O)Nc3ccc4c(c3)N=NC4)c2c1 ZINC001154532276 1047650433 /nfs/dbraw/zinc/65/04/33/1047650433.db2.gz LQCFGIFQHDVSAH-UHFFFAOYSA-N -1 1 318.336 4.098 20 0 DIADMM CC[C@@H](C)c1ncc(NC(=O)c2ccc(C(C)C)cc2[O-])cn1 ZINC001155551629 1047684258 /nfs/dbraw/zinc/68/42/58/1047684258.db2.gz IBIBIDUSUFWVDZ-GFCCVEGCSA-N -1 1 313.401 4.071 20 0 DIADMM O=C(NCCCc1cccc(Cl)c1)c1ccc(Cl)cc1[O-] ZINC001156493570 1047714625 /nfs/dbraw/zinc/71/46/25/1047714625.db2.gz XEXOERHWMAXDLW-UHFFFAOYSA-N -1 1 324.207 4.062 20 0 DIADMM C[C@H]1C[C@H](c2ccccc2)N(C(=O)c2c([O-])cccc2Cl)C1 ZINC001157232102 1047737770 /nfs/dbraw/zinc/73/77/70/1047737770.db2.gz KPUMTGLPRYVPSF-SWLSCSKDSA-N -1 1 315.800 4.269 20 0 DIADMM CC(C)[C@@H]1CN(C(=O)c2cc3ccccc3cc2[O-])[C@@H]1C(C)C ZINC001157778644 1047754890 /nfs/dbraw/zinc/75/48/90/1047754890.db2.gz VCBLWRQYTMYDQD-PKOBYXMFSA-N -1 1 311.425 4.298 20 0 DIADMM [O-]c1cc(Nc2ccnc(OCC3CC3)c2)c(F)cc1Cl ZINC001213017301 1047824059 /nfs/dbraw/zinc/82/40/59/1047824059.db2.gz MYTZKKRLQBZYFT-UHFFFAOYSA-N -1 1 308.740 4.112 20 0 DIADMM CC(C)=CNc1ccc(C([O-])(C(F)(F)F)C(F)(F)F)cc1 ZINC001174556550 1047903660 /nfs/dbraw/zinc/90/36/60/1047903660.db2.gz UZJNNHDIMSRNKE-UHFFFAOYSA-N -1 1 313.241 4.334 20 0 DIADMM CC(C)C(=O)Nc1ccc(Nc2c([O-])cc(F)cc2F)cc1 ZINC001198083341 1047923778 /nfs/dbraw/zinc/92/37/78/1047923778.db2.gz RUYQHUHDMHPYNF-UHFFFAOYSA-N -1 1 306.312 4.009 20 0 DIADMM COc1ccc(C(F)(F)F)cc1Nc1ccc(F)c(F)c1[O-] ZINC001174778451 1047969853 /nfs/dbraw/zinc/96/98/53/1047969853.db2.gz BVSSWJBXIBNAIC-UHFFFAOYSA-N -1 1 319.229 4.441 20 0 DIADMM [O-]c1c(Cl)nccc1Nc1ccc(OC(F)(F)F)c(F)c1 ZINC001213020300 1047974270 /nfs/dbraw/zinc/97/42/70/1047974270.db2.gz WIZQTYSHKHETFR-UHFFFAOYSA-N -1 1 322.645 4.222 20 0 DIADMM CC(C)c1ccc(NC(=S)Nc2ccc(F)cc2[O-])cc1 ZINC001198614587 1047984675 /nfs/dbraw/zinc/98/46/75/1047984675.db2.gz QIUXXJOMLWOADA-UHFFFAOYSA-N -1 1 304.390 4.464 20 0 DIADMM CCc1c(Cl)cc(Nc2cc(C)nn2C)c([O-])c1Cl ZINC001174831900 1047986373 /nfs/dbraw/zinc/98/63/73/1047986373.db2.gz YDKMJRUICRMHEZ-UHFFFAOYSA-N -1 1 300.189 4.047 20 0 DIADMM CCCc1ccccc1[N-]S(=O)(=O)c1ccc2occc2c1 ZINC001198858763 1048012995 /nfs/dbraw/zinc/01/29/95/1048012995.db2.gz IZBUFNJYVXQBAP-UHFFFAOYSA-N -1 1 315.394 4.186 20 0 DIADMM [O-]c1c(Br)ccc(Cl)c1Nc1cccc(O)c1 ZINC001174895404 1048015289 /nfs/dbraw/zinc/01/52/89/1048015289.db2.gz UNOVWOALRWLRFE-UHFFFAOYSA-N -1 1 314.566 4.257 20 0 DIADMM COc1cc(F)c(Nc2cc([O-])c(Cl)cc2F)cc1F ZINC001174926114 1048033604 /nfs/dbraw/zinc/03/36/04/1048033604.db2.gz AIVUTLHDXJXIBO-UHFFFAOYSA-N -1 1 303.667 4.215 20 0 DIADMM C[C@@H]1CCC[C@@H](C(=O)Nc2cccc(C(F)(F)F)c2[O-])C1 ZINC001184512503 1048053808 /nfs/dbraw/zinc/05/38/08/1048053808.db2.gz ODDBDNBRFWCTHP-NXEZZACHSA-N -1 1 301.308 4.176 20 0 DIADMM CC(C)c1ccc(CCC(=O)Nc2ccc(F)cc2[O-])cc1 ZINC001161034683 1048105173 /nfs/dbraw/zinc/10/51/73/1048105173.db2.gz CHBHJTYNKTXBFY-UHFFFAOYSA-N -1 1 301.361 4.226 20 0 DIADMM CCOc1cc(F)c(Nc2c([O-])cc(F)cc2F)cc1F ZINC001175055696 1048113470 /nfs/dbraw/zinc/11/34/70/1048113470.db2.gz CVIFOFBKRYOOSC-UHFFFAOYSA-N -1 1 301.239 4.091 20 0 DIADMM COc1ccc(F)c([N-]c2snnc2-c2ccccc2)c1F ZINC001175118018 1048130311 /nfs/dbraw/zinc/13/03/11/1048130311.db2.gz UFFXCXSYIPUKSM-UHFFFAOYSA-N -1 1 319.336 4.236 20 0 DIADMM CC1(C)CC[C@H](C(=O)Nc2cccc(C(F)(F)F)c2[O-])C1 ZINC001185172357 1048140989 /nfs/dbraw/zinc/14/09/89/1048140989.db2.gz HMKQHHBNIMQYFB-VIFPVBQESA-N -1 1 301.308 4.176 20 0 DIADMM [O-]c1c(Cl)nccc1Nc1cccc(C(F)(F)F)c1F ZINC001175134074 1048159105 /nfs/dbraw/zinc/15/91/05/1048159105.db2.gz HNFCQPGLONEAEN-UHFFFAOYSA-N -1 1 306.646 4.342 20 0 DIADMM Cc1cc(C(C)(C)C)cc(C)c1[N-]S(=O)(=O)c1ccsc1 ZINC001185384835 1048169331 /nfs/dbraw/zinc/16/93/31/1048169331.db2.gz ZREVECMEPFGYHL-UHFFFAOYSA-N -1 1 323.483 4.463 20 0 DIADMM [O-]c1c(Cl)nccc1Nc1cccc(O[C@H]2CCCCO2)c1 ZINC001175188597 1048192447 /nfs/dbraw/zinc/19/24/47/1048192447.db2.gz VLMIYPLIDQPIFJ-AWEZNQCLSA-N -1 1 320.776 4.090 20 0 DIADMM [O-]c1c(Cl)nccc1Nc1cccc(O[C@@H]2CCCCO2)c1 ZINC001175188598 1048192469 /nfs/dbraw/zinc/19/24/69/1048192469.db2.gz VLMIYPLIDQPIFJ-CQSZACIVSA-N -1 1 320.776 4.090 20 0 DIADMM [O-]c1c(F)cc(F)cc1NC(=S)Nc1cccc(Cl)c1 ZINC001201105793 1048193401 /nfs/dbraw/zinc/19/34/01/1048193401.db2.gz FXEOYVVIDKZLIS-UHFFFAOYSA-N -1 1 314.744 4.133 20 0 DIADMM [O-]c1cc(F)c(NC(=S)Nc2cccc(Cl)c2)c(F)c1 ZINC001201105739 1048193462 /nfs/dbraw/zinc/19/34/62/1048193462.db2.gz BWHIIMYPKHHUEV-UHFFFAOYSA-N -1 1 314.744 4.133 20 0 DIADMM CSc1ccc(NC(=S)Nc2cccc(F)c2[O-])cc1 ZINC001201187844 1048212945 /nfs/dbraw/zinc/21/29/45/1048212945.db2.gz PNCHOALJQJGAEO-UHFFFAOYSA-N -1 1 308.403 4.062 20 0 DIADMM Cc1cc(C)cc(NC(=S)Nc2cc(F)c(F)cc2[O-])c1 ZINC001201204598 1048216247 /nfs/dbraw/zinc/21/62/47/1048216247.db2.gz BITVJTQWPYPTJE-UHFFFAOYSA-N -1 1 308.353 4.096 20 0 DIADMM CCOc1ccc(F)c(F)c1Nc1cc([O-])c(F)c(F)c1 ZINC001175282367 1048227326 /nfs/dbraw/zinc/22/73/26/1048227326.db2.gz GBAUWRGEPQHASB-UHFFFAOYSA-N -1 1 301.239 4.091 20 0 DIADMM CCc1cc([N-]S(=O)(=O)c2cccc(F)c2C)c(C)cc1C ZINC001185837062 1048232443 /nfs/dbraw/zinc/23/24/43/1048232443.db2.gz SHNAFFACIOBUKB-UHFFFAOYSA-N -1 1 321.417 4.114 20 0 DIADMM [O-]c1ccc(Cl)c(Nc2c(F)ccc(O)c2F)c1Cl ZINC001175268785 1048246121 /nfs/dbraw/zinc/24/61/21/1048246121.db2.gz VPIFIWUJGXQFHB-UHFFFAOYSA-N -1 1 306.095 4.426 20 0 DIADMM O=C(c1ccccc1Nc1c(F)ccc([O-])c1F)C(F)(F)F ZINC001175271155 1048248903 /nfs/dbraw/zinc/24/89/03/1048248903.db2.gz UGRGZSOOZYGKMW-UHFFFAOYSA-N -1 1 317.213 4.159 20 0 DIADMM Cc1cc(=O)oc2cc(Nc3c(F)ccc([O-])c3Cl)ccc12 ZINC001250233516 1048272067 /nfs/dbraw/zinc/27/20/67/1048272067.db2.gz PZNCZNROWLBPJK-UHFFFAOYSA-N -1 1 319.719 4.343 20 0 DIADMM O=C(Nc1ccc(Cl)cc1[O-])N[C@H]1CCCc2ccccc21 ZINC001186457658 1048308814 /nfs/dbraw/zinc/30/88/14/1048308814.db2.gz OLCHQXNQLWOPJN-AWEZNQCLSA-N -1 1 316.788 4.245 20 0 DIADMM C[S@](=O)c1ccc(Nc2ccc(Cl)c(Cl)c2[O-])cc1 ZINC001175477287 1048317279 /nfs/dbraw/zinc/31/72/79/1048317279.db2.gz AAZCDTPSCOGATG-IBGZPJMESA-N -1 1 316.209 4.180 20 0 DIADMM CC[C@@H](C)Oc1ccc(-c2nc3cccc(C)c3c(=O)[n-]2)cc1 ZINC000481199089 1048327855 /nfs/dbraw/zinc/32/78/55/1048327855.db2.gz OZFMTCGSVAWVKB-CYBMUJFWSA-N -1 1 308.381 4.076 20 0 DIADMM Cn1cc2cc(Nc3ccc(Cl)c(Cl)c3[O-])ccc2n1 ZINC001175622639 1048378062 /nfs/dbraw/zinc/37/80/62/1048378062.db2.gz AAEYTJRDZQILJY-UHFFFAOYSA-N -1 1 308.168 4.329 20 0 DIADMM O=C(Nc1c([O-])cccc1F)Nc1c(Cl)cccc1Cl ZINC001202103102 1048450922 /nfs/dbraw/zinc/45/09/22/1048450922.db2.gz GURWKPSCARCEJC-UHFFFAOYSA-N -1 1 315.131 4.482 20 0 DIADMM CCOc1ccccc1NC(=O)Nc1ccc(Cl)cc1[O-] ZINC001202148043 1048463279 /nfs/dbraw/zinc/46/32/79/1048463279.db2.gz PRUFUGZLZKXHHT-UHFFFAOYSA-N -1 1 306.749 4.088 20 0 DIADMM CSc1cccc(NC(=O)Nc2ccc([O-])c(F)c2F)c1 ZINC001188044409 1048464215 /nfs/dbraw/zinc/46/42/15/1048464215.db2.gz NHGRINJSHDNJLO-UHFFFAOYSA-N -1 1 310.325 4.036 20 0 DIADMM Cc1cccc(NC(=O)Nc2cccc([O-])c2Br)c1 ZINC001202317360 1048521944 /nfs/dbraw/zinc/52/19/44/1048521944.db2.gz KOTUSSVFHFFQTC-UHFFFAOYSA-N -1 1 321.174 4.107 20 0 DIADMM O=C(Nc1ccc2ccccc2c1)Nc1ccc([O-])c(F)c1F ZINC001188611087 1048529113 /nfs/dbraw/zinc/52/91/13/1048529113.db2.gz LJHPCSMGPUQJEZ-UHFFFAOYSA-N -1 1 314.291 4.468 20 0 DIADMM CCCC[C@@H](O)CNc1cc(Cl)c(Cl)c(Cl)c1[O-] ZINC001252105532 1048545331 /nfs/dbraw/zinc/54/53/31/1048545331.db2.gz QDYINUSVTBZNEO-SSDOTTSWSA-N -1 1 312.624 4.315 20 0 DIADMM COc1ccc(Nc2ccnc(Cl)c2[O-])c(C(F)(F)F)c1 ZINC001213048675 1048551797 /nfs/dbraw/zinc/55/17/97/1048551797.db2.gz ZKAZBULPRWORLX-UHFFFAOYSA-N -1 1 318.682 4.212 20 0 DIADMM O=C(Nc1cccc2ccccc21)Nc1c(F)cc([O-])cc1F ZINC001188942013 1048568432 /nfs/dbraw/zinc/56/84/32/1048568432.db2.gz FBFWFXMYYZDSFB-UHFFFAOYSA-N -1 1 314.291 4.468 20 0 DIADMM O=C(Nc1ccc(F)cc1[O-])Nc1cc(Cl)ccc1Cl ZINC001188992821 1048578726 /nfs/dbraw/zinc/57/87/26/1048578726.db2.gz LAVLBIMGQUPTAG-UHFFFAOYSA-N -1 1 315.131 4.482 20 0 DIADMM O=c1cc(CSc2ccccc2Cl)c2ccc([O-])cc2o1 ZINC000006351846 1048583676 /nfs/dbraw/zinc/58/36/76/1048583676.db2.gz HGYXDBVHYCWPAK-UHFFFAOYSA-N -1 1 318.781 4.444 20 0 DIADMM Cc1ccccc1[N-]S(=O)(=O)c1ccc(F)c2ccccc21 ZINC001189347513 1048617312 /nfs/dbraw/zinc/61/73/12/1048617312.db2.gz IMNZRDXSTXQFIJ-UHFFFAOYSA-N -1 1 315.369 4.088 20 0 DIADMM Cc1ncc([N-]c2cc(-c3ccc(OC(F)F)cc3)no2)s1 ZINC001212125632 1048621480 /nfs/dbraw/zinc/62/14/80/1048621480.db2.gz GABZDZSWVQEINH-UHFFFAOYSA-N -1 1 323.324 4.452 20 0 DIADMM Cc1cnc(SCCc2c(Cl)cccc2Cl)[n-]c1=O ZINC001189399202 1048625596 /nfs/dbraw/zinc/62/55/96/1048625596.db2.gz GZQUNGCLFVUBOP-UHFFFAOYSA-N -1 1 315.225 4.132 20 0 DIADMM CCc1nc(S[C@@H]2CCc3c2cccc3Cl)[n-]c(=O)c1C ZINC001189494918 1048630913 /nfs/dbraw/zinc/63/09/13/1048630913.db2.gz AUJSCJNIWGUGJT-CQSZACIVSA-N -1 1 320.845 4.486 20 0 DIADMM CCc1cccc(CC)c1NC(=O)Nc1cc(Cl)ncc1[O-] ZINC001189749709 1048658410 /nfs/dbraw/zinc/65/84/10/1048658410.db2.gz ZFBNRIKBBHLCPT-UHFFFAOYSA-N -1 1 319.792 4.209 20 0 DIADMM CCc1cccc(CC)c1NC(=O)Nc1cccc(F)c1[O-] ZINC001189772927 1048663571 /nfs/dbraw/zinc/66/35/71/1048663571.db2.gz RGXDBZSDHJHTRH-UHFFFAOYSA-N -1 1 302.349 4.300 20 0 DIADMM CCc1cccc(CC)c1NC(=O)Nc1cc(F)c(F)cc1[O-] ZINC001189772591 1048663657 /nfs/dbraw/zinc/66/36/57/1048663657.db2.gz NRTXXAQWQOFNOA-UHFFFAOYSA-N -1 1 320.339 4.439 20 0 DIADMM CC(C)(C)c1nnc([N-]c2ccc(Oc3ccccc3)nc2)o1 ZINC001176376210 1048667008 /nfs/dbraw/zinc/66/70/08/1048667008.db2.gz SADQBEMJOWPYKE-UHFFFAOYSA-N -1 1 310.357 4.298 20 0 DIADMM CCc1cccc(C)c1NC(=O)Nc1ccc([O-])c(F)c1F ZINC001189975135 1048678537 /nfs/dbraw/zinc/67/85/37/1048678537.db2.gz FBQNZZHHUZFGHZ-UHFFFAOYSA-N -1 1 306.312 4.185 20 0 DIADMM [O-]c1cc(F)c(Nc2cc(F)cc(N3CCCC3)c2)cc1F ZINC001176419894 1048682852 /nfs/dbraw/zinc/68/28/52/1048682852.db2.gz OETUQEYXKQRRJI-UHFFFAOYSA-N -1 1 308.303 4.153 20 0 DIADMM O=S(=O)([N-]c1ccccc1C1CC1)c1ccc(C2CC2)cc1 ZINC001190463642 1048741246 /nfs/dbraw/zinc/74/12/46/1048741246.db2.gz IJLRJUKCUQHCPZ-UHFFFAOYSA-N -1 1 313.422 4.242 20 0 DIADMM CC(C)(C)Oc1ccc(Nc2ccc(-n3ccc(=O)[n-]3)cc2)cc1 ZINC001176638368 1048743928 /nfs/dbraw/zinc/74/39/28/1048743928.db2.gz SGIWBIPFEJFRBB-UHFFFAOYSA-N -1 1 323.396 4.499 20 0 DIADMM CSc1cccc([N-]S(=O)(=O)c2ccc(C3CC3)cc2)c1 ZINC001190501244 1048744705 /nfs/dbraw/zinc/74/47/05/1048744705.db2.gz ZYWABKUTGDEWHF-UHFFFAOYSA-N -1 1 319.451 4.087 20 0 DIADMM [O-]c1c(F)cc(F)c(Nc2cccc(OC(F)(F)F)c2)c1F ZINC001176669090 1048752337 /nfs/dbraw/zinc/75/23/37/1048752337.db2.gz DDTRZEJOUHGSKC-UHFFFAOYSA-N -1 1 323.192 4.452 20 0 DIADMM Cc1ccccc1-n1nccc1Nc1c(F)cc(F)c([O-])c1F ZINC001176664299 1048752460 /nfs/dbraw/zinc/75/24/60/1048752460.db2.gz SYCOZYKKDOCLMI-UHFFFAOYSA-N -1 1 319.286 4.047 20 0 DIADMM COc1cccc2ncc(Nc3c(F)cc(F)c([O-])c3F)cc21 ZINC001176664316 1048753431 /nfs/dbraw/zinc/75/34/31/1048753431.db2.gz UFXJJHCIVMIQEW-UHFFFAOYSA-N -1 1 320.270 4.110 20 0 DIADMM Cc1cc(Nc2c(F)cc(F)c([O-])c2F)c2ccsc2n1 ZINC001176669025 1048753571 /nfs/dbraw/zinc/75/35/71/1048753571.db2.gz CHWSNKXDLKIDIF-UHFFFAOYSA-N -1 1 310.300 4.471 20 0 DIADMM COc1cc2cccnc2c(Nc2c(F)cc(F)c([O-])c2F)c1 ZINC001176672039 1048754145 /nfs/dbraw/zinc/75/41/45/1048754145.db2.gz RRNPSSJEXGGQKS-UHFFFAOYSA-N -1 1 320.270 4.110 20 0 DIADMM Cc1cncc2cccc(Nc3c(F)cc(F)c([O-])c3F)c12 ZINC001176672383 1048754871 /nfs/dbraw/zinc/75/48/71/1048754871.db2.gz IOYBVWSQFNEZDY-UHFFFAOYSA-N -1 1 304.271 4.410 20 0 DIADMM COc1cc(Cl)cc(Nc2c(F)cc(F)c([O-])c2F)c1 ZINC001176672422 1048755175 /nfs/dbraw/zinc/75/51/75/1048755175.db2.gz KECKPVNVFUUIKP-UHFFFAOYSA-N -1 1 303.667 4.215 20 0 DIADMM [O-]c1c(F)cc(F)c(Nc2c(F)ccc(Cl)c2F)c1F ZINC001176672070 1048756703 /nfs/dbraw/zinc/75/67/03/1048756703.db2.gz CZAPWLDAHXFZOS-UHFFFAOYSA-N -1 1 309.621 4.485 20 0 DIADMM COc1ccc(F)c(Nc2c(F)cc(F)c([O-])c2F)c1Cl ZINC001176673255 1048756906 /nfs/dbraw/zinc/75/69/06/1048756906.db2.gz QNJDPVIOQYYYGW-UHFFFAOYSA-N -1 1 321.657 4.354 20 0 DIADMM [O-]c1c(F)cc(F)c(Nc2ccc(F)c3cnccc23)c1F ZINC001176674107 1048758025 /nfs/dbraw/zinc/75/80/25/1048758025.db2.gz PXXYQJDDEFIBLH-UHFFFAOYSA-N -1 1 308.234 4.240 20 0 DIADMM Cc1cc(Nc2c(F)cc(F)c([O-])c2F)cc2scnc21 ZINC001176673027 1048758055 /nfs/dbraw/zinc/75/80/55/1048758055.db2.gz CVJCVDGUDAILOO-UHFFFAOYSA-N -1 1 310.300 4.471 20 0 DIADMM Cc1ccc(C(=O)NCc2ccc([O-])c(Cl)c2)c(Cl)c1C ZINC001176988928 1048811062 /nfs/dbraw/zinc/81/10/62/1048811062.db2.gz VFAHZMSRWDDVAW-UHFFFAOYSA-N -1 1 324.207 4.246 20 0 DIADMM CC(C)Oc1ncc(Cl)cc1Nc1cc([O-])c(F)c(F)c1 ZINC001203315501 1048867397 /nfs/dbraw/zinc/86/73/97/1048867397.db2.gz OQPULFBROFCZBB-UHFFFAOYSA-N -1 1 314.719 4.250 20 0 DIADMM O=C([O-])c1coc(CN2CCCC[C@@H]2c2cc3ccccc3[nH]2)c1 ZINC000568402676 1048907233 /nfs/dbraw/zinc/90/72/33/1048907233.db2.gz QGLHDWDZQZDGBU-GOSISDBHSA-N -1 1 324.380 4.186 20 0 DIADMM CCCOc1ccc([N-]c2noc(C(C)(C)C)n2)c(F)c1F ZINC001203692322 1048965302 /nfs/dbraw/zinc/96/53/02/1048965302.db2.gz WNPUYGWHRICGPS-UHFFFAOYSA-N -1 1 311.332 4.178 20 0 DIADMM [O-]c1ccc(Cl)c(Nc2ccc3cncnc3c2)c1Cl ZINC001203708601 1048971127 /nfs/dbraw/zinc/97/11/27/1048971127.db2.gz VCCFUUNTDVHYFK-UHFFFAOYSA-N -1 1 306.152 4.386 20 0 DIADMM CCCCc1ccc([C@H](N[C@H](C)C(=O)[O-])c2cccs2)cc1 ZINC000904203191 1049001717 /nfs/dbraw/zinc/00/17/17/1049001717.db2.gz GFRLRDGFMRIROL-DYVFJYSZSA-N -1 1 317.454 4.243 20 0 DIADMM CC[C@H](C)c1ccc([C@H](N[C@H](C)C(=O)[O-])c2cccs2)cc1 ZINC000904203158 1049002668 /nfs/dbraw/zinc/00/26/68/1049002668.db2.gz FFDHFWTUVUMHRY-AHIWAGSCSA-N -1 1 317.454 4.414 20 0 DIADMM O=C([O-])c1ccc(C[N@H+]2CCC[C@H]2c2cc(F)ccc2F)cc1 ZINC001204154008 1049097010 /nfs/dbraw/zinc/09/70/10/1049097010.db2.gz AUAUYRPJAQBSAS-KRWDZBQOSA-N -1 1 317.335 4.000 20 0 DIADMM O=C([O-])c1ccc(CN2CCC[C@H]2c2cc(F)ccc2F)cc1 ZINC001204154008 1049097021 /nfs/dbraw/zinc/09/70/21/1049097021.db2.gz AUAUYRPJAQBSAS-KRWDZBQOSA-N -1 1 317.335 4.000 20 0 DIADMM O=C(Nc1ccc2sccc2c1)Nc1c([O-])cccc1F ZINC001192448848 1049105652 /nfs/dbraw/zinc/10/56/52/1049105652.db2.gz NCUHUJCOTVDIGX-UHFFFAOYSA-N -1 1 302.330 4.390 20 0 DIADMM Cc1ccc2ccccc2c1NC(=O)c1c(F)ccc([O-])c1F ZINC001192520846 1049112667 /nfs/dbraw/zinc/11/26/67/1049112667.db2.gz WYNBCPMUHTYDCW-UHFFFAOYSA-N -1 1 313.303 4.384 20 0 DIADMM CC[C@@H](C)C1CCC(NC(=O)c2c(F)ccc([O-])c2F)CC1 ZINC001192553194 1049114952 /nfs/dbraw/zinc/11/49/52/1049114952.db2.gz WXDYMDBILPPOKV-VOMCLLRMSA-N -1 1 311.372 4.005 20 0 DIADMM Cc1ccc(OC(C)C)cc1NC(=O)c1c(F)ccc([O-])c1F ZINC001192539087 1049118637 /nfs/dbraw/zinc/11/86/37/1049118637.db2.gz FFPIWZNUWBHWKW-UHFFFAOYSA-N -1 1 321.323 4.018 20 0 DIADMM CC[C@@H](C)C1CCC(NC(=O)c2cc([O-])cc(F)c2F)CC1 ZINC001192684719 1049128346 /nfs/dbraw/zinc/12/83/46/1049128346.db2.gz ULDZWCGIFLMXKC-VOMCLLRMSA-N -1 1 311.372 4.005 20 0 DIADMM CC(C)(C)[C@H]1CC[C@@H](NC(=O)c2cc([O-])cc(F)c2F)CC1 ZINC001192683579 1049129353 /nfs/dbraw/zinc/12/93/53/1049129353.db2.gz GEYFNMZOKSHUHI-PHIMTYICSA-N -1 1 311.372 4.005 20 0 DIADMM CN(Cc1ccc(Cl)c(F)c1)Cc1ccc([O-])c(F)c1F ZINC001204325037 1049142388 /nfs/dbraw/zinc/14/23/88/1049142388.db2.gz VZWQXLUWBNMXPC-UHFFFAOYSA-N -1 1 315.722 4.095 20 0 DIADMM CC(C)CC[N@H+](Cc1cccc(O)c1Br)C1CC1 ZINC001204410178 1049157958 /nfs/dbraw/zinc/15/79/58/1049157958.db2.gz AKNGIQXTSWAQLD-UHFFFAOYSA-N -1 1 312.251 4.165 20 0 DIADMM CCc1cccc(C(=O)Nc2cccc(C(F)(F)F)c2[O-])c1 ZINC001192974213 1049161708 /nfs/dbraw/zinc/16/17/08/1049161708.db2.gz PEFCDYAIDKIIPG-UHFFFAOYSA-N -1 1 309.287 4.226 20 0 DIADMM O=C(Nc1ccc([O-])c(Br)c1)OC1CCCCC1 ZINC001193629060 1049233745 /nfs/dbraw/zinc/23/37/45/1049233745.db2.gz BSCWTQDNNZXXTI-UHFFFAOYSA-N -1 1 314.179 4.036 20 0 DIADMM O=C(Nc1ccc(Br)cc1[O-])OC1CCCCC1 ZINC001193629095 1049233945 /nfs/dbraw/zinc/23/39/45/1049233945.db2.gz DWSDMJNJCBUBFN-UHFFFAOYSA-N -1 1 314.179 4.036 20 0 DIADMM O=c1nc(N[C@@H]2CC[C@H](c3ccc(Cl)cc3)C2)cc(Cl)[n-]1 ZINC000858567629 1049276003 /nfs/dbraw/zinc/27/60/03/1049276003.db2.gz HJUNSXUNWCWSKG-CMPLNLGQSA-N -1 1 324.211 4.237 20 0 DIADMM Cc1nn(C)c2ccc(Nc3cc([O-])c(Cl)cc3F)cc12 ZINC001204870555 1049290617 /nfs/dbraw/zinc/29/06/17/1049290617.db2.gz RCWSFPDLLXQUQG-UHFFFAOYSA-N -1 1 305.740 4.123 20 0 DIADMM CCC[C@@](C)(NC(=O)c1c([O-])cccc1Cl)c1ccccc1 ZINC001180681200 1049397894 /nfs/dbraw/zinc/39/78/94/1049397894.db2.gz DVDAVKHAAZSJTO-GOSISDBHSA-N -1 1 317.816 4.491 20 0 DIADMM CCC(CC)COC(=O)Nc1cccc([O-])c1Br ZINC001194713244 1049419139 /nfs/dbraw/zinc/41/91/39/1049419139.db2.gz RKSBBFFPFGXKBN-UHFFFAOYSA-N -1 1 316.195 4.139 20 0 DIADMM [O-]c1ccc(-c2nc(-c3ccc(-c4ccccc4)cc3)no2)nn1 ZINC001205293079 1049431636 /nfs/dbraw/zinc/43/16/36/1049431636.db2.gz AXFZGWMWWNHDAK-UHFFFAOYSA-N -1 1 316.320 4.127 20 0 DIADMM CCc1cc(NC(=O)Nc2ccc([O-])c(Cl)c2)ccc1F ZINC000486784509 1049474706 /nfs/dbraw/zinc/47/47/06/1049474706.db2.gz CLZUEBJFTJSILK-UHFFFAOYSA-N -1 1 308.740 4.391 20 0 DIADMM COCOc1cc(C)ccc1Nc1cc([O-])c(Cl)cc1F ZINC001205468279 1049477780 /nfs/dbraw/zinc/47/77/80/1049477780.db2.gz GNJGWEWNIXFTHS-UHFFFAOYSA-N -1 1 311.740 4.219 20 0 DIADMM C[C@@]1(C(=O)Nc2cc(Cl)c([O-])c3ccccc23)CCCCO1 ZINC000862295538 1049486521 /nfs/dbraw/zinc/48/65/21/1049486521.db2.gz LTOUHDHZSMHFDA-KRWDZBQOSA-N -1 1 319.788 4.097 20 0 DIADMM O=C(Nc1cccc([O-])c1Br)[C@H]1CCCC2(CC2)C1 ZINC000908711309 1049501076 /nfs/dbraw/zinc/50/10/76/1049501076.db2.gz UTWLSUQMJJDCDJ-JTQLQIEISA-N -1 1 324.218 4.064 20 0 DIADMM CCCC(C)(C)CC(=O)Nc1cccc([O-])c1Br ZINC000908707725 1049498673 /nfs/dbraw/zinc/49/86/73/1049498673.db2.gz IQCHNDSCNFQBKC-UHFFFAOYSA-N -1 1 314.223 4.310 20 0 DIADMM CC1(C)CC=C(C(=O)Nc2cccc([O-])c2Br)CC1 ZINC000908707901 1049498735 /nfs/dbraw/zinc/49/87/35/1049498735.db2.gz OJQPURBSPQRULZ-UHFFFAOYSA-N -1 1 324.218 4.230 20 0 DIADMM O=C(CCC1CCCC1)Nc1cccc([O-])c1Br ZINC000908716238 1049501027 /nfs/dbraw/zinc/50/10/27/1049501027.db2.gz BVJXDTYTKAFSBL-UHFFFAOYSA-N -1 1 312.207 4.064 20 0 DIADMM CCOC(=O)NC(=S)[N-]c1ccc(C)cc1-c1ccccc1 ZINC001195493141 1049538559 /nfs/dbraw/zinc/53/85/59/1049538559.db2.gz WTMGGFSTVQCHMK-UHFFFAOYSA-N -1 1 314.410 4.105 20 0 DIADMM CCC1(CC)C[C@@H]1C(=O)Nc1cccc(C(F)(F)F)c1[O-] ZINC001181885815 1049538967 /nfs/dbraw/zinc/53/89/67/1049538967.db2.gz BCIPBNBEFAXMTE-SNVBAGLBSA-N -1 1 301.308 4.176 20 0 DIADMM Cn1ccc2cc(Nc3ccc(Cl)c(Cl)c3[O-])cnc21 ZINC001205766063 1049558298 /nfs/dbraw/zinc/55/82/98/1049558298.db2.gz YTZVVKKIJDCUSN-UHFFFAOYSA-N -1 1 308.168 4.329 20 0 DIADMM CCc1cc(-c2ccc3[n-]c(C(=O)OC)nc3c2)ccc1Cl ZINC001205807346 1049568554 /nfs/dbraw/zinc/56/85/54/1049568554.db2.gz DBZRWGYFSVZHBS-UHFFFAOYSA-N -1 1 314.772 4.232 20 0 DIADMM CCc1cc(-c2ccc3nc(C(=O)OC)[n-]c3c2)ccc1Cl ZINC001205807346 1049568565 /nfs/dbraw/zinc/56/85/65/1049568565.db2.gz DBZRWGYFSVZHBS-UHFFFAOYSA-N -1 1 314.772 4.232 20 0 DIADMM CCC1(C(=O)Nc2cc([O-])c(F)cc2F)CCC(F)(F)CC1 ZINC000909988763 1049576620 /nfs/dbraw/zinc/57/66/20/1049576620.db2.gz ZGLJCQWRCPFQQU-UHFFFAOYSA-N -1 1 319.298 4.215 20 0 DIADMM CS(C)(=O)=Nc1cccc(NCc2cccc([O-])c2Cl)c1 ZINC000864015155 1049621468 /nfs/dbraw/zinc/62/14/68/1049621468.db2.gz HAKHLVOEXMGTTP-UHFFFAOYSA-N -1 1 324.833 4.017 20 0 DIADMM [O-]c1ccc(-c2nccc(-c3c[nH]c4ccccc43)n2)c(F)c1 ZINC001206030267 1049633772 /nfs/dbraw/zinc/63/37/72/1049633772.db2.gz SOJZCFMIJXFQSS-UHFFFAOYSA-N -1 1 305.312 4.137 20 0 DIADMM Cc1cccc(NC(=S)Nc2cc([O-])c(F)cc2F)c1C ZINC001196418140 1049655904 /nfs/dbraw/zinc/65/59/04/1049655904.db2.gz OXUAUORVTSAHID-UHFFFAOYSA-N -1 1 308.353 4.096 20 0 DIADMM O=C([O-])c1cc(-c2ccc3nc(C(F)(F)F)[nH]c3c2)cs1 ZINC001206279082 1049698712 /nfs/dbraw/zinc/69/87/12/1049698712.db2.gz 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/nfs/dbraw/zinc/21/13/76/1050211376.db2.gz NEMKAUDZDYMWFL-CQSZACIVSA-N -1 1 313.397 4.046 20 0 DIADMM CCOc1cc(-c2noc(C[C@@H](C)C3CC3)n2)cc(Cl)c1[O-] ZINC000771107190 1050221487 /nfs/dbraw/zinc/22/14/87/1050221487.db2.gz DKPWQACQGFSQBS-SECBINFHSA-N -1 1 322.792 4.083 20 0 DIADMM CCCC[C@@H](OCCCC[P@](=O)([O-])O)C1CCCCC1 ZINC001225018964 1050225383 /nfs/dbraw/zinc/22/53/83/1050225383.db2.gz NFAFLMLOHUHDPD-OAHLLOKOSA-N -1 1 306.383 4.100 20 0 DIADMM C[C@@H](Cc1ccc(F)cc1)c1nc(-c2ccc([O-])c(F)c2)no1 ZINC000771220621 1050231780 /nfs/dbraw/zinc/23/17/80/1050231780.db2.gz BCIXZSBOMZWIPT-JTQLQIEISA-N -1 1 316.307 4.067 20 0 DIADMM [O-]c1c(Cl)cc(Cl)cc1Nc1ccc2ncncc2c1 ZINC001210457010 1050252669 /nfs/dbraw/zinc/25/26/69/1050252669.db2.gz JFRVHPITMRJIIV-UHFFFAOYSA-N -1 1 306.152 4.386 20 0 DIADMM [O-]c1cc(F)c(Nc2cccc(OCC(F)(F)F)c2)cc1F ZINC001212171405 1050301484 /nfs/dbraw/zinc/30/14/84/1050301484.db2.gz RJVYBLDCBGMPRD-UHFFFAOYSA-N -1 1 319.229 4.355 20 0 DIADMM CC[C@@H](Cc1ccccc1)N(C)C(=O)c1cc(Cl)ccc1[O-] ZINC001137039403 1050308166 /nfs/dbraw/zinc/30/81/66/1050308166.db2.gz XKWZVVOVXWEEHX-HNNXBMFYSA-N -1 1 317.816 4.139 20 0 DIADMM O=c1oc2cc([O-])ccc2cc1Nc1cc2cc(F)ccc2o1 ZINC001210727262 1050350642 /nfs/dbraw/zinc/35/06/42/1050350642.db2.gz CJQTVOHQDUZDRK-UHFFFAOYSA-N -1 1 311.268 4.128 20 0 DIADMM [O-]c1cc(F)cc(F)c1Nc1ccc(OCC(F)(F)F)cc1 ZINC001210742830 1050356703 /nfs/dbraw/zinc/35/67/03/1050356703.db2.gz MEIYOVARPCUIPS-UHFFFAOYSA-N -1 1 319.229 4.355 20 0 DIADMM [O-]c1cc(Nc2ccc(OCC(F)(F)F)cc2)cc(F)c1F ZINC001210743709 1050358393 /nfs/dbraw/zinc/35/83/93/1050358393.db2.gz MBPONKIJVDOLKW-UHFFFAOYSA-N -1 1 319.229 4.355 20 0 DIADMM COc1cc(Nc2cccc([O-])c2Cl)c(C(C)=O)cc1OC ZINC001210854247 1050392109 /nfs/dbraw/zinc/39/21/09/1050392109.db2.gz KKUKFRJCDKMKME-UHFFFAOYSA-N -1 1 321.760 4.009 20 0 DIADMM CCc1[nH]nc2ncc(Nc3c(Cl)ccc([O-])c3Cl)cc21 ZINC001210885259 1050405829 /nfs/dbraw/zinc/40/58/29/1050405829.db2.gz NEGPIGAYCNAQQZ-UHFFFAOYSA-N -1 1 323.183 4.276 20 0 DIADMM COC(=O)c1sccc1Nc1cc(Cl)c([O-])c(Cl)c1 ZINC001210924063 1050415528 /nfs/dbraw/zinc/41/55/28/1050415528.db2.gz DPCNMZXHIKZJMV-UHFFFAOYSA-N -1 1 318.181 4.291 20 0 DIADMM COc1cc(Nc2cc(Cl)c([O-])c(Cl)c2)cnc1Cl ZINC001210926791 1050415909 /nfs/dbraw/zinc/41/59/09/1050415909.db2.gz OGGHCQRUFAQCBP-UHFFFAOYSA-N -1 1 319.575 4.500 20 0 DIADMM [O-]c1c(Cl)cc(Nc2cccnc2-n2cccn2)cc1Cl ZINC001210923439 1050416704 /nfs/dbraw/zinc/41/67/04/1050416704.db2.gz UAJRNCYGMBFYSU-UHFFFAOYSA-N -1 1 321.167 4.023 20 0 DIADMM CCN(C)c1ccc(Nc2cc(Cl)c([O-])c(Cl)c2)cn1 ZINC001210927691 1050418275 /nfs/dbraw/zinc/41/82/75/1050418275.db2.gz UCARKCNDYFKYFG-UHFFFAOYSA-N -1 1 312.200 4.294 20 0 DIADMM Nc1ccccc1-c1nccn1-c1cc(Cl)c([O-])c(Cl)c1 ZINC001210930200 1050420608 /nfs/dbraw/zinc/42/06/08/1050420608.db2.gz IPECZLWARWXHMG-UHFFFAOYSA-N -1 1 320.179 4.134 20 0 DIADMM CC(C)(C)c1ccc(CCC(=O)Nc2c([O-])cccc2F)cc1 ZINC000735925453 1050438172 /nfs/dbraw/zinc/43/81/72/1050438172.db2.gz 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/nfs/dbraw/zinc/55/48/75/1050554875.db2.gz UMBRHXLOYCMCRD-UHFFFAOYSA-N -1 1 304.214 4.279 20 0 DIADMM [O-]c1cc(F)c(-c2ccnc(C3(C(F)(F)F)CC3)c2)cc1F ZINC001211353026 1050554910 /nfs/dbraw/zinc/55/49/10/1050554910.db2.gz QYONSQLDCJNZJP-UHFFFAOYSA-N -1 1 315.241 4.326 20 0 DIADMM Cc1ccc([C@@H](C)C(=O)Nc2cccc(C(F)(F)F)c2[O-])cc1 ZINC001144456159 1050588764 /nfs/dbraw/zinc/58/87/64/1050588764.db2.gz XVNYZJKHJDJBJR-LLVKDONJSA-N -1 1 323.314 4.462 20 0 DIADMM CN(Cc1cccc2ccccc21)Cc1c(F)cc([O-])cc1F ZINC001144553688 1050612519 /nfs/dbraw/zinc/61/25/19/1050612519.db2.gz MTNZXDPYGRLFNH-UHFFFAOYSA-N -1 1 313.347 4.456 20 0 DIADMM [O-]c1cc(F)c(CN2CCC(c3ccccc3F)CC2)c(F)c1 ZINC001144554811 1050613876 /nfs/dbraw/zinc/61/38/76/1050613876.db2.gz IMNZSXXWTIYEJT-UHFFFAOYSA-N -1 1 321.342 4.189 20 0 DIADMM [O-]c1c(F)cc(Nc2c(O)cccc2C(F)(F)F)cc1F ZINC001213386714 1050645138 /nfs/dbraw/zinc/64/51/38/1050645138.db2.gz RCJTULLJSHLYGV-UHFFFAOYSA-N -1 1 305.202 4.138 20 0 DIADMM [O-]c1cc(F)c(CN2CCC[C@@H]2c2cccc(F)c2)cc1F ZINC001144659518 1050648460 /nfs/dbraw/zinc/64/84/60/1050648460.db2.gz LNMFKMFKQLYVPE-MRXNPFEDSA-N -1 1 307.315 4.147 20 0 DIADMM CC(C)Oc1c(F)cc(Nc2c([O-])cc(F)cc2F)cc1F ZINC001213421631 1050651189 /nfs/dbraw/zinc/65/11/89/1050651189.db2.gz GJUYUCBWXGNXFZ-UHFFFAOYSA-N -1 1 315.266 4.479 20 0 DIADMM C/C(=C/CN(C)[C@@H](C)c1ccc(Cl)cc1Cl)C(=O)[O-] ZINC000846240828 1050702406 /nfs/dbraw/zinc/70/24/06/1050702406.db2.gz ZTUQGCNDAWMVJI-MBACFSSFSA-N -1 1 302.201 4.017 20 0 DIADMM Cc1c(Cl)cccc1-c1noc(-c2cc([O-])cnc2Cl)n1 ZINC001213696091 1050720383 /nfs/dbraw/zinc/72/03/83/1050720383.db2.gz FLHIRYGCVMUNGT-UHFFFAOYSA-N -1 1 322.151 4.119 20 0 DIADMM Cc1ccc(-c2noc(-c3cc([O-])cnc3Cl)n2)cc1Cl ZINC001213698439 1050720955 /nfs/dbraw/zinc/72/09/55/1050720955.db2.gz WYALMEFRNSFXGU-UHFFFAOYSA-N -1 1 322.151 4.119 20 0 DIADMM Cc1nn(C)c2cc(Nc3cc([O-])c(Cl)cc3F)ccc12 ZINC001213760353 1050731267 /nfs/dbraw/zinc/73/12/67/1050731267.db2.gz HRQVBLMEEWQVJW-UHFFFAOYSA-N 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CCC1(CC)CCCN(C(=O)Cc2ccc([O-])c(Cl)c2)C1 ZINC001147335820 1050875514 /nfs/dbraw/zinc/87/55/14/1050875514.db2.gz MCHRVHWLZPWKHT-UHFFFAOYSA-N -1 1 309.837 4.017 20 0 DIADMM Cc1ccc2c(c1)[C@@H](NC(=O)c1cc(Cl)ccc1[O-])[C@H](C)C2 ZINC001147340045 1050875587 /nfs/dbraw/zinc/87/55/87/1050875587.db2.gz ASFNFAVIWQLKOF-DIFFPNOSSA-N -1 1 315.800 4.017 20 0 DIADMM COCOc1ccc(Cl)cc1Nc1ccc(F)c(F)c1[O-] ZINC001214426058 1050901842 /nfs/dbraw/zinc/90/18/42/1050901842.db2.gz PSWDYZGJYKZSGU-UHFFFAOYSA-N -1 1 315.703 4.050 20 0 DIADMM COc1ccc2cc(Nc3cc(F)c([O-])c(Cl)c3)cnc2c1 ZINC001214482969 1050917329 /nfs/dbraw/zinc/91/73/29/1050917329.db2.gz XGNVFABJVIWMQZ-UHFFFAOYSA-N -1 1 318.735 4.485 20 0 DIADMM [O-]c1c(F)cc(Nc2ncc(Cl)nc2Cl)cc1Cl ZINC001214480645 1050918218 /nfs/dbraw/zinc/91/82/18/1050918218.db2.gz WOHCXOZGALLIDX-UHFFFAOYSA-N -1 1 308.527 4.025 20 0 DIADMM Nc1cc(Cl)c(Cl)nc1Nc1cc(F)c([O-])c(Cl)c1 ZINC001214486398 1050919617 /nfs/dbraw/zinc/91/96/17/1050919617.db2.gz DYAXBNBFQDPESE-UHFFFAOYSA-N -1 1 322.554 4.212 20 0 DIADMM COc1cc2cccnc2c(Nc2cc(F)c([O-])c(Cl)c2)c1 ZINC001214488327 1050920831 /nfs/dbraw/zinc/92/08/31/1050920831.db2.gz CARVTZPNBNFHER-UHFFFAOYSA-N -1 1 318.735 4.485 20 0 DIADMM COc1cc(OC)c(Nc2cc(F)c([O-])c(Cl)c2)cc1F ZINC001214488564 1050920902 /nfs/dbraw/zinc/92/09/02/1050920902.db2.gz GTHUXXMCHROTNY-UHFFFAOYSA-N -1 1 315.703 4.085 20 0 DIADMM [O-]c1c(F)cc(Nc2ccc3c(c2)[C@@H](O)CCC3)cc1Cl ZINC001214492053 1050921806 /nfs/dbraw/zinc/92/18/06/1050921806.db2.gz PXLNDQBOVMNJAA-HNNXBMFYSA-N -1 1 307.752 4.298 20 0 DIADMM Cc1ccc(CCCO)c(Nc2cc(F)c([O-])c(Cl)c2)c1 ZINC001214492169 1050922459 /nfs/dbraw/zinc/92/24/59/1050922459.db2.gz RWFVABWXKFPMIY-UHFFFAOYSA-N -1 1 309.768 4.162 20 0 DIADMM COc1ccc(Nc2cc(F)c([O-])c(Cl)c2)c2ccncc12 ZINC001214492303 1050923526 /nfs/dbraw/zinc/92/35/26/1050923526.db2.gz XZUIGMIOWWLKCX-UHFFFAOYSA-N -1 1 318.735 4.485 20 0 DIADMM COC(=O)/C=C/c1cccc(Nc2cc(F)c([O-])c(Cl)c2)c1 ZINC001214494558 1050924951 /nfs/dbraw/zinc/92/49/51/1050924951.db2.gz VBJNRPRIXVTSPU-AATRIKPKSA-N -1 1 321.735 4.115 20 0 DIADMM CCc1ccccc1C(=O)Nc1cccc(C(F)(F)F)c1[O-] ZINC001148416316 1050939240 /nfs/dbraw/zinc/93/92/40/1050939240.db2.gz JPCQUHAOHKDSDT-UHFFFAOYSA-N -1 1 309.287 4.226 20 0 DIADMM O=C(NC1(CC2CC2)CC1)c1cccc(-c2ccccc2)c1[O-] ZINC001148872498 1050980100 /nfs/dbraw/zinc/98/01/00/1050980100.db2.gz JIXLHJQEHCNHJF-UHFFFAOYSA-N -1 1 307.393 4.122 20 0 DIADMM C[C@H]1CCC[C@H](C)N1C(=O)c1cccc(-c2ccccc2)c1[O-] ZINC001148861052 1050980287 /nfs/dbraw/zinc/98/02/87/1050980287.db2.gz IQKZOCYPOKIHIC-GJZGRUSLSA-N -1 1 309.409 4.462 20 0 DIADMM CCCCC[C@H](C)CC(=O)Nc1ccc(-c2cc(=O)[nH][n-]2)cc1 ZINC000743311712 1051012788 /nfs/dbraw/zinc/01/27/88/1051012788.db2.gz QLJHTYTWAUEECV-ZDUSSCGKSA-N -1 1 315.417 4.327 20 0 DIADMM CCCCC[C@@H](C)CC(=O)Nc1ccc(-c2cc(=O)[nH][n-]2)cc1 ZINC000743311710 1051012882 /nfs/dbraw/zinc/01/28/82/1051012882.db2.gz QLJHTYTWAUEECV-CYBMUJFWSA-N -1 1 315.417 4.327 20 0 DIADMM COCOc1c(C)cccc1Nc1cc([O-])c(Cl)cc1F ZINC001214853160 1051015068 /nfs/dbraw/zinc/01/50/68/1051015068.db2.gz JFWKFXVUIBOJLD-UHFFFAOYSA-N -1 1 311.740 4.219 20 0 DIADMM CC(C)c1ccc2cc(C(=O)Nc3c([O-])cccc3F)[nH]c2c1 ZINC000743415435 1051026241 /nfs/dbraw/zinc/02/62/41/1051026241.db2.gz AJKIWOGEHZHFCX-UHFFFAOYSA-N -1 1 312.344 4.388 20 0 DIADMM COc1ccc(-c2nc(-c3ccc(C(C)(C)C)cc3)no2)c([O-])c1 ZINC001215147581 1051088156 /nfs/dbraw/zinc/08/81/56/1051088156.db2.gz DKPAIPIWZHOGDQ-UHFFFAOYSA-N -1 1 324.380 4.415 20 0 DIADMM CCOc1ccc(-c2nc(-c3cccc4occc43)no2)c([O-])c1 ZINC001215241158 1051129394 /nfs/dbraw/zinc/12/93/94/1051129394.db2.gz JCFGLZBATLILEP-UHFFFAOYSA-N -1 1 322.320 4.254 20 0 DIADMM CCOc1ccc(-c2nc(-c3ccccc3Cl)no2)c([O-])c1 ZINC001215241002 1051129952 /nfs/dbraw/zinc/12/99/52/1051129952.db2.gz APPJITSVYWEPCD-UHFFFAOYSA-N -1 1 316.744 4.161 20 0 DIADMM COCOc1ccc(Nc2c([O-])cc(F)cc2F)cc1Cl ZINC001215259490 1051139408 /nfs/dbraw/zinc/13/94/08/1051139408.db2.gz UNXJUSVAQJLTSE-UHFFFAOYSA-N -1 1 315.703 4.050 20 0 DIADMM COc1cccc([O-])c1-c1nc(-c2ccc3sccc3c2)no1 ZINC001215322448 1051165252 /nfs/dbraw/zinc/16/52/52/1051165252.db2.gz NYDZTFCPHGBXRJ-UHFFFAOYSA-N -1 1 324.361 4.333 20 0 DIADMM [O-]c1ccc(-c2nc(-c3ccc4ccccc4n3)no2)c(Cl)c1 ZINC001215345951 1051171715 /nfs/dbraw/zinc/17/17/15/1051171715.db2.gz UVRZNUAMDYDVJI-UHFFFAOYSA-N -1 1 323.739 4.311 20 0 DIADMM CCOc1ccc(-c2noc(-c3ccc([O-])cc3Cl)n2)cc1 ZINC001215343057 1051172880 /nfs/dbraw/zinc/17/28/80/1051172880.db2.gz LAXVBFRBYREVSK-UHFFFAOYSA-N -1 1 316.744 4.161 20 0 DIADMM Cc1cc(C)cc(-c2noc(-c3ccc([O-])cc3Cl)n2)c1 ZINC001215343545 1051172923 /nfs/dbraw/zinc/17/29/23/1051172923.db2.gz YCHPXEBARYIHDX-UHFFFAOYSA-N -1 1 300.745 4.379 20 0 DIADMM O=C(Nc1cccc(F)c1[O-])[C@@H]1C[C@@H]1c1cccc2ccccc21 ZINC001171632552 1051174699 /nfs/dbraw/zinc/17/46/99/1051174699.db2.gz FSVOFEPDTQRERA-HZPDHXFCSA-N -1 1 321.351 4.427 20 0 DIADMM O=C(Nc1cccc(F)c1[O-])c1cc2ccnc(Cl)c2s1 ZINC001171637624 1051194180 /nfs/dbraw/zinc/19/41/80/1051194180.db2.gz OODBZWJRLRVMQY-UHFFFAOYSA-N -1 1 322.748 4.047 20 0 DIADMM CC[C@@H](Cc1cccc(C)c1)C(=O)Nc1cccc(F)c1[O-] ZINC001171637702 1051194265 /nfs/dbraw/zinc/19/42/65/1051194265.db2.gz QAQWSLUJYUCCOZ-AWEZNQCLSA-N -1 1 301.361 4.047 20 0 DIADMM CCOc1c(Nc2cc(F)c([O-])cc2F)ccc(F)c1F ZINC001215417243 1051195329 /nfs/dbraw/zinc/19/53/29/1051195329.db2.gz BHPKVUWAXGJLAZ-UHFFFAOYSA-N -1 1 301.239 4.091 20 0 DIADMM CC(C)Oc1c(F)c(F)ccc1Nc1ccnc(Cl)c1[O-] ZINC001215422585 1051198483 /nfs/dbraw/zinc/19/84/83/1051198483.db2.gz OOUUQHRBMDEXTM-UHFFFAOYSA-N -1 1 314.719 4.250 20 0 DIADMM [O-]c1c(-c2nc(-c3ccccn3)no2)cccc1-c1ccccc1 ZINC001215445962 1051205634 /nfs/dbraw/zinc/20/56/34/1051205634.db2.gz ULRBONZZPXACBY-UHFFFAOYSA-N -1 1 315.332 4.171 20 0 DIADMM CSc1ccc(Nc2cc3ccc([O-])cc3oc2=O)c(C)c1 ZINC001215475453 1051214871 /nfs/dbraw/zinc/21/48/71/1051214871.db2.gz HJJJKCUAVFXVCG-UHFFFAOYSA-N -1 1 313.378 4.273 20 0 DIADMM Cc1cc(NC(=O)c2cncc([O-])c2)ccc1-c1ccccc1 ZINC000792834172 1051217341 /nfs/dbraw/zinc/21/73/41/1051217341.db2.gz DCVDRZOEHJKLAO-UHFFFAOYSA-N -1 1 304.349 4.015 20 0 DIADMM Cc1cc(O)cc(Nc2ccc(F)c(Br)c2[O-])c1 ZINC001215519703 1051228868 /nfs/dbraw/zinc/22/88/68/1051228868.db2.gz LRUBFMJDGRCACW-UHFFFAOYSA-N -1 1 312.138 4.051 20 0 DIADMM CCCOc1ccc(F)c(Nc2ccc(F)c(F)c2[O-])c1F ZINC001215567523 1051247640 /nfs/dbraw/zinc/24/76/40/1051247640.db2.gz CBZKOZUDFQLBNM-UHFFFAOYSA-N -1 1 315.266 4.481 20 0 DIADMM Cc1cc(Br)ccc1Nc1cc(F)c([O-])cc1F ZINC001215571524 1051250528 /nfs/dbraw/zinc/25/05/28/1051250528.db2.gz GGUZYHCVTIYKGH-UHFFFAOYSA-N -1 1 314.129 4.485 20 0 DIADMM [O-]c1cc(Cl)c(Nc2cc(F)c(O)cc2F)cc1Cl ZINC001215573104 1051252237 /nfs/dbraw/zinc/25/22/37/1051252237.db2.gz CQIIIDQMLUSHPJ-UHFFFAOYSA-N -1 1 306.095 4.426 20 0 DIADMM [O-]c1cc(F)c(Nc2cc3nsnc3cc2Cl)cc1F ZINC001215576244 1051253603 /nfs/dbraw/zinc/25/36/03/1051253603.db2.gz QCXLTUHUCNWLLB-UHFFFAOYSA-N -1 1 313.716 4.072 20 0 DIADMM CC1(C)CC(=O)Nc2ccc(Nc3cc(F)c([O-])cc3F)cc21 ZINC001215576613 1051254071 /nfs/dbraw/zinc/25/40/71/1051254071.db2.gz FHNZHKDRTRERFO-UHFFFAOYSA-N -1 1 318.323 4.034 20 0 DIADMM [O-]c1cc(F)c(Nc2ccccc2OCC(F)(F)F)cc1F ZINC001215574328 1051254831 /nfs/dbraw/zinc/25/48/31/1051254831.db2.gz RBCAJZMOFYIUHU-UHFFFAOYSA-N -1 1 319.229 4.355 20 0 DIADMM Nc1cc(Cl)c(Nc2cc(F)c([O-])cc2F)cc1Cl ZINC001215573764 1051254962 /nfs/dbraw/zinc/25/49/62/1051254962.db2.gz IDFWOXGHRZRYEP-UHFFFAOYSA-N -1 1 305.111 4.303 20 0 DIADMM [O-]c1c(F)c(F)ccc1Nc1ccc(C2CCOCC2)cc1 ZINC001212655136 1051360397 /nfs/dbraw/zinc/36/03/97/1051360397.db2.gz RXKZXPYSMHNIMO-UHFFFAOYSA-N -1 1 305.324 4.308 20 0 DIADMM Cc1cc(OCc2ccccc2)ncc1[N-]c1nnc(C(C)C)o1 ZINC001215777642 1051362869 /nfs/dbraw/zinc/36/28/69/1051362869.db2.gz XGEICLLCLMEFEX-UHFFFAOYSA-N -1 1 324.384 4.219 20 0 DIADMM O=C([N-]c1c(F)cc(Cl)cc1F)c1coc(C2CCC2)n1 ZINC000194824399 1051379515 /nfs/dbraw/zinc/37/95/15/1051379515.db2.gz RGUYLABCXLITGB-UHFFFAOYSA-N -1 1 312.703 4.126 20 0 DIADMM COc1cnc(F)cc1Nc1cc(Cl)c(C)c(Cl)c1[O-] ZINC001215808684 1051383661 /nfs/dbraw/zinc/38/36/61/1051383661.db2.gz QVVIMEXLYYZISK-UHFFFAOYSA-N -1 1 317.147 4.294 20 0 DIADMM Cc1ccc(-c2noc(-c3ccc([O-])cc3F)n2)c(Cl)c1 ZINC001215826165 1051390556 /nfs/dbraw/zinc/39/05/56/1051390556.db2.gz HGRYYKCYUFSSFA-UHFFFAOYSA-N -1 1 304.708 4.210 20 0 DIADMM Cc1c(Cl)cccc1-c1noc(-c2ccc([O-])cc2F)n1 ZINC001215826810 1051392619 /nfs/dbraw/zinc/39/26/19/1051392619.db2.gz SLVBIJSBHCIEHT-UHFFFAOYSA-N -1 1 304.708 4.210 20 0 DIADMM [O-]c1cc(-c2nc(-c3cccc(Cl)c3F)no2)ccc1F ZINC001215838719 1051402725 /nfs/dbraw/zinc/40/27/25/1051402725.db2.gz JPAYQRFYTJMMRP-UHFFFAOYSA-N -1 1 308.671 4.041 20 0 DIADMM CSc1ccc(F)c(Nc2ccc(F)c(F)c2[O-])c1F ZINC001215840605 1051404787 /nfs/dbraw/zinc/40/47/87/1051404787.db2.gz BFKJODFLFOFIEV-UHFFFAOYSA-N -1 1 303.280 4.414 20 0 DIADMM COc1cc(F)c(-c2ccc([O-])c(C(F)(F)F)c2)c(OC)c1 ZINC001242161728 1051420914 /nfs/dbraw/zinc/42/09/14/1051420914.db2.gz ABSBZUFJZHRUPO-UHFFFAOYSA-N -1 1 316.250 4.234 20 0 DIADMM CSc1cc(C)ccc1Nc1cc2ccc([O-])cc2oc1=O ZINC001215871850 1051426673 /nfs/dbraw/zinc/42/66/73/1051426673.db2.gz DDHAJUWAVATCSQ-UHFFFAOYSA-N -1 1 313.378 4.273 20 0 DIADMM Cc1ccc(Nc2ccc(-n3ccc(=O)[n-]3)cc2)c(OC(C)C)c1 ZINC001215880034 1051435823 /nfs/dbraw/zinc/43/58/23/1051435823.db2.gz FRZIGARHDWABAG-UHFFFAOYSA-N -1 1 323.396 4.417 20 0 DIADMM COc1nccc(SC)c1Nc1cc([O-])c(Cl)cc1F ZINC001215930613 1051465090 /nfs/dbraw/zinc/46/50/90/1051465090.db2.gz INIYKGUGEYMOTB-UHFFFAOYSA-N -1 1 314.769 4.054 20 0 DIADMM Cc1cc(-c2noc(-c3cccc([O-])c3F)n2)cc(C)c1F ZINC001215988815 1051505530 /nfs/dbraw/zinc/50/55/30/1051505530.db2.gz GYZBMYAWWGFXCD-UHFFFAOYSA-N -1 1 302.280 4.004 20 0 DIADMM Cc1ccc(-c2noc(-c3cccc([O-])c3F)n2)c(Cl)c1 ZINC001215989048 1051505964 /nfs/dbraw/zinc/50/59/64/1051505964.db2.gz PCHHPZHPGNLOKS-UHFFFAOYSA-N -1 1 304.708 4.210 20 0 DIADMM Cc1ccc(-c2noc(-c3cccc([O-])c3F)n2)cc1Cl ZINC001215988885 1051506231 /nfs/dbraw/zinc/50/62/31/1051506231.db2.gz KPEGPNPCJJVSNS-UHFFFAOYSA-N -1 1 304.708 4.210 20 0 DIADMM Nc1c(F)c(F)c(F)cc1Nc1cc(Cl)c([O-])cc1Cl ZINC001216011260 1051522856 /nfs/dbraw/zinc/52/28/56/1051522856.db2.gz WGQAINCATRQYLN-UHFFFAOYSA-N -1 1 323.101 4.442 20 0 DIADMM COc1c(Cl)ccc(Nc2cc(F)c([O-])cc2F)c1F ZINC001212586176 1051548656 /nfs/dbraw/zinc/54/86/56/1051548656.db2.gz ODSUUDVXTAPZAN-UHFFFAOYSA-N -1 1 303.667 4.215 20 0 DIADMM CC(=O)Nc1ccc(Nc2cc([O-])c(Cl)cc2F)cc1F ZINC001212705791 1051616072 /nfs/dbraw/zinc/61/60/72/1051616072.db2.gz XZRWFCIJAPEWLJ-UHFFFAOYSA-N -1 1 312.703 4.026 20 0 DIADMM CCN(CC)c1cc(F)cc(Nc2ccc(F)c(F)c2[O-])c1 ZINC001216184008 1051619705 /nfs/dbraw/zinc/61/97/05/1051619705.db2.gz JBVQHALKIGHZRL-UHFFFAOYSA-N -1 1 310.319 4.399 20 0 DIADMM [O-]c1cc(F)cc(-c2nc(-c3cc(F)ccc3Cl)no2)c1 ZINC001216340062 1051708816 /nfs/dbraw/zinc/70/88/16/1051708816.db2.gz QOQHNVZHQVIAKP-UHFFFAOYSA-N -1 1 308.671 4.041 20 0 DIADMM Cc1cc(Cl)ccc1Nc1cc2ccc([O-])cc2oc1=O ZINC001216432315 1051762744 /nfs/dbraw/zinc/76/27/44/1051762744.db2.gz DSSLJFDEGBAINV-UHFFFAOYSA-N -1 1 301.729 4.204 20 0 DIADMM CC(=O)c1ccc(Nc2cccc([O-])c2Br)cc1 ZINC001173898354 1051863025 /nfs/dbraw/zinc/86/30/25/1051863025.db2.gz OFMZISMUKVDGOX-UHFFFAOYSA-N -1 1 306.159 4.101 20 0 DIADMM C[C@@H](NC(=O)c1ccc([O-])c(F)c1)c1csc2ccccc21 ZINC000767982140 1051869906 /nfs/dbraw/zinc/86/99/06/1051869906.db2.gz JWTMWMREEVIUEJ-SNVBAGLBSA-N -1 1 315.369 4.237 20 0 DIADMM COc1ccc(C(=O)Nc2ccc([O-])c(Cl)c2)cc1C1CC1 ZINC000768093123 1051880598 /nfs/dbraw/zinc/88/05/98/1051880598.db2.gz DBQWWINGTWOSDM-UHFFFAOYSA-N -1 1 317.772 4.184 20 0 DIADMM [O-]c1ccc(C(F)(F)F)cc1-c1nc(-c2ccccc2)no1 ZINC001216831721 1051889992 /nfs/dbraw/zinc/88/99/92/1051889992.db2.gz ZQUHIQGGKXDKKO-UHFFFAOYSA-N -1 1 306.243 4.128 20 0 DIADMM COC(=O)c1cccc(Nc2c(Cl)ccc([O-])c2Cl)c1 ZINC001173963701 1051897490 /nfs/dbraw/zinc/89/74/90/1051897490.db2.gz OKKWYFSBIABQNO-UHFFFAOYSA-N -1 1 312.152 4.229 20 0 DIADMM Fc1ccc(-c2ccc(C[N-]c3nnc(C(F)F)o3)o2)cc1 ZINC000189281901 1051908099 /nfs/dbraw/zinc/90/80/99/1051908099.db2.gz OMEMTOGHTCJOJX-UHFFFAOYSA-N -1 1 309.247 4.018 20 0 DIADMM [O-]c1cc(F)c(F)c(-c2nc(-c3ccc(Cl)cc3)no2)c1 ZINC001216924084 1051911349 /nfs/dbraw/zinc/91/13/49/1051911349.db2.gz YDTLDAUXTVDXLR-UHFFFAOYSA-N -1 1 308.671 4.041 20 0 DIADMM CC(=O)Nc1ccccc1Nc1c(Cl)ccc([O-])c1Cl ZINC001173996158 1051924997 /nfs/dbraw/zinc/92/49/97/1051924997.db2.gz KOQFPVJPMQJLAQ-UHFFFAOYSA-N -1 1 311.168 4.401 20 0 DIADMM Cc1cc(O)cc([O-])c1-c1nc(-c2cccc3ccccc32)no1 ZINC001216987183 1051927306 /nfs/dbraw/zinc/92/73/06/1051927306.db2.gz UBGBSCBAUGPYKZ-UHFFFAOYSA-N -1 1 318.332 4.276 20 0 DIADMM Cc1cc(O)cc([O-])c1-c1nc(-c2ccc3ccccc3c2)no1 ZINC001216986017 1051927443 /nfs/dbraw/zinc/92/74/43/1051927443.db2.gz GYWUSTRNADXXTL-UHFFFAOYSA-N -1 1 318.332 4.276 20 0 DIADMM Cc1nc2ccc(NC(=O)Nc3ccc([O-])c(Cl)c3)cc2o1 ZINC000190930896 1051955392 /nfs/dbraw/zinc/95/53/92/1051955392.db2.gz ASQDJIDZIHAXOF-UHFFFAOYSA-N -1 1 317.732 4.139 20 0 DIADMM CCCc1csc(NC(=O)Nc2ccc([O-])c(Cl)c2)n1 ZINC000190985841 1051957456 /nfs/dbraw/zinc/95/74/56/1051957456.db2.gz JAQUPGRJBFVSRK-UHFFFAOYSA-N -1 1 311.794 4.099 20 0 DIADMM COc1ccc2cc(Nc3ccnc(Cl)c3[O-])ccc2c1 ZINC001174030822 1051957698 /nfs/dbraw/zinc/95/76/98/1051957698.db2.gz PCHCWGIPLCAEEY-UHFFFAOYSA-N -1 1 300.745 4.346 20 0 DIADMM Cc1cccc(-c2noc(-c3ccc4cccnc4c3[O-])n2)c1C ZINC001217142189 1051975950 /nfs/dbraw/zinc/97/59/50/1051975950.db2.gz UBIRSJQMJQWIEM-UHFFFAOYSA-N -1 1 317.348 4.274 20 0 DIADMM Cc1ccc(Nc2cc(Br)cc(Cl)c2[O-])cn1 ZINC001174285622 1052071580 /nfs/dbraw/zinc/07/15/80/1052071580.db2.gz ZZHZWRWRLNEEBC-UHFFFAOYSA-N -1 1 313.582 4.255 20 0 DIADMM CC1CCC(N(C(=O)c2c([O-])cccc2Cl)C2CC2)CC1 ZINC000769729642 1052092671 /nfs/dbraw/zinc/09/26/71/1052092671.db2.gz ZAIDIVCMHFHCQL-UHFFFAOYSA-N -1 1 307.821 4.229 20 0 DIADMM O=C(c1c([O-])cccc1Cl)N1CCC[C@H]1c1cccc(F)c1 ZINC000769715712 1052098016 /nfs/dbraw/zinc/09/80/16/1052098016.db2.gz VRDVRACSNUHAPB-AWEZNQCLSA-N -1 1 319.763 4.162 20 0 DIADMM Cc1ccc(C[C@H](C)N(C)C(=O)c2c([O-])cccc2Cl)cc1 ZINC000769897418 1052118597 /nfs/dbraw/zinc/11/85/97/1052118597.db2.gz QCBWZRUQKNIFKU-ZDUSSCGKSA-N -1 1 317.816 4.057 20 0 DIADMM CC[C@@H](Cc1ccccc1)N(C)C(=O)c1c([O-])cccc1Cl ZINC000769920236 1052123029 /nfs/dbraw/zinc/12/30/29/1052123029.db2.gz HLVJLFMSSIHRDC-AWEZNQCLSA-N -1 1 317.816 4.139 20 0 DIADMM [O-]c1cc(Nc2ccnc(C(F)(F)F)c2)c(F)cc1Cl ZINC001174361093 1052125942 /nfs/dbraw/zinc/12/59/42/1052125942.db2.gz AAAGKEBDYKLKSU-UHFFFAOYSA-N -1 1 306.646 4.342 20 0 DIADMM O=C(c1c([O-])cccc1Cl)N1CCCCC[C@H]1c1ccco1 ZINC000769886219 1052126546 /nfs/dbraw/zinc/12/65/46/1052126546.db2.gz BCLVAIJNPSSSHQ-ZDUSSCGKSA-N -1 1 319.788 4.396 20 0 DIADMM Cc1cc(N)ccc1NC(=O)c1cccc(-c2ccccc2)c1[O-] ZINC001219321330 1052282649 /nfs/dbraw/zinc/28/26/49/1052282649.db2.gz MPUYEIRDZQOHEK-UHFFFAOYSA-N -1 1 318.376 4.202 20 0 DIADMM [O-]c1ccc(F)cc1-c1nc(-c2cccc(C(F)(F)F)c2)no1 ZINC000322572928 1052491425 /nfs/dbraw/zinc/49/14/25/1052491425.db2.gz GGBVVYATRZLCOS-UHFFFAOYSA-N -1 1 324.233 4.267 20 0 DIADMM [O-]c1ccc(-c2nc(-c3cccc(C(F)(F)F)c3)no2)c(F)c1 ZINC000322755892 1052496370 /nfs/dbraw/zinc/49/63/70/1052496370.db2.gz BIVOVNJLNLAISJ-UHFFFAOYSA-N -1 1 324.233 4.267 20 0 DIADMM Cc1cc(S(=O)(=O)[N-]c2cccc(C(C)C)c2)c(C)s1 ZINC000032532558 1052561298 /nfs/dbraw/zinc/56/12/98/1052561298.db2.gz OAKKNAQXIRVGHJ-UHFFFAOYSA-N -1 1 309.456 4.289 20 0 DIADMM CCC(=O)Nc1ccc(C)c(NCc2cccc([O-])c2Cl)c1 ZINC000328217358 1052595090 /nfs/dbraw/zinc/59/50/90/1052595090.db2.gz KMKOIZBXIPKEAL-UHFFFAOYSA-N -1 1 318.804 4.315 20 0 DIADMM CC[C@@H](c1ccncc1)N(C)C(=O)c1ccc2ccccc2c1[O-] ZINC000128031490 1052707969 /nfs/dbraw/zinc/70/79/69/1052707969.db2.gz VIFABOKCUGEIHF-SFHVURJKSA-N -1 1 320.392 4.164 20 0 DIADMM CC(C)C[C@H](C[C@@H](C)CC(C)C)OCCCC[P@](=O)([O-])O ZINC001225023679 1052745151 /nfs/dbraw/zinc/74/51/51/1052745151.db2.gz ZPYPMXGKMCVLJR-JKSUJKDBSA-N -1 1 322.426 4.448 20 0 DIADMM O=C(Nc1ccc([O-])c(Cl)c1)[C@@H]1SCCc2ccccc21 ZINC000129602836 1052797047 /nfs/dbraw/zinc/79/70/47/1052797047.db2.gz DSSBFHRSQVFLMZ-OAHLLOKOSA-N -1 1 319.813 4.015 20 0 DIADMM CC(=O)c1c(O)cc([O-])cc1O[C@H](C)c1cccc(Cl)c1 ZINC001225675011 1052815736 /nfs/dbraw/zinc/81/57/36/1052815736.db2.gz QIWTYROZTQKFJD-SNVBAGLBSA-N -1 1 306.745 4.094 20 0 DIADMM CC(=O)c1c(O)cc([O-])cc1O[C@@H]1CCc2ccc(Cl)cc21 ZINC001225675533 1052815910 /nfs/dbraw/zinc/81/59/10/1052815910.db2.gz XIGHKCAPFZUAGM-OAHLLOKOSA-N -1 1 318.756 4.020 20 0 DIADMM C[C@@H](Oc1ccc(C(=O)c2ccc([O-])cc2)cc1)c1ccccn1 ZINC001225809173 1052833672 /nfs/dbraw/zinc/83/36/72/1052833672.db2.gz YPOGIHXOEXZVMU-CQSZACIVSA-N -1 1 319.360 4.158 20 0 DIADMM Cc1ccc2c(c1)[C@@H](Oc1cc([O-])cc3oc(=O)cc(C)c13)CC2 ZINC001226490882 1052902740 /nfs/dbraw/zinc/90/27/40/1052902740.db2.gz SWQJLDKALMNWTF-INIZCTEOSA-N -1 1 322.360 4.182 20 0 DIADMM Cc1cc(=O)oc2cc([O-])cc(O[C@@H](C)c3ccccc3F)c12 ZINC001226491030 1052902836 /nfs/dbraw/zinc/90/28/36/1052902836.db2.gz VDCIYBBLUJVNKC-NSHDSACASA-N -1 1 314.312 4.086 20 0 DIADMM Cc1nc(=O)[n-]c(O[C@@H](C)c2cc3ccccc3s2)c1Cl ZINC001227116243 1052961996 /nfs/dbraw/zinc/96/19/96/1052961996.db2.gz KRBBWTXMYSRFDY-VIFPVBQESA-N -1 1 320.801 4.499 20 0 DIADMM CCC[C@H](Oc1[n-]c(=O)nc(C)c1Cl)c1ccc(OC)cc1 ZINC001227112972 1052962179 /nfs/dbraw/zinc/96/21/79/1052962179.db2.gz RMQMWKBZOMPAKO-ZDUSSCGKSA-N -1 1 322.792 4.073 20 0 DIADMM CCC[C@H](Oc1cc([O-])ccc1C(=O)COC)c1ccccc1 ZINC001227172556 1052968004 /nfs/dbraw/zinc/96/80/04/1052968004.db2.gz PEULXADTXQEOER-SFHVURJKSA-N -1 1 314.381 4.142 20 0 DIADMM C[C@@H](Oc1[n-]c(=S)ncc1F)c1cc2ccccc2s1 ZINC001227385328 1052986955 /nfs/dbraw/zinc/98/69/55/1052986955.db2.gz JYWOQMIAELMWEE-MRVPVSSYSA-N -1 1 306.387 4.259 20 0 DIADMM C[C@H](Oc1cc(Cl)c([O-])cc1Cl)c1ccncc1F ZINC001227644724 1053005714 /nfs/dbraw/zinc/00/57/14/1053005714.db2.gz CMHOGTUFTCRXDG-ZETCQYMHSA-N -1 1 302.132 4.373 20 0 DIADMM S=c1nc2cnccc2c(O[C@@H](c2ccccc2)C2CC2)[n-]1 ZINC001227881358 1053025251 /nfs/dbraw/zinc/02/52/51/1053025251.db2.gz LPDUJPVQVYLFPB-HNNXBMFYSA-N -1 1 309.394 4.217 20 0 DIADMM Cc1ccc2c(c1)CC[C@H]2Oc1[n-]c(=S)nc2cnccc21 ZINC001227880829 1053025470 /nfs/dbraw/zinc/02/54/70/1053025470.db2.gz FYBBPEWBMVRULL-OAHLLOKOSA-N -1 1 309.394 4.062 20 0 DIADMM C[C@@H]1C[C@H](Oc2[n-]c(=S)nc3cnccc32)CC(C)(C)C1 ZINC001227880391 1053025499 /nfs/dbraw/zinc/02/54/99/1053025499.db2.gz APUVWFIXQWQMCS-MNOVXSKESA-N -1 1 303.431 4.281 20 0 DIADMM O=C(Nc1ccc([O-])c(F)c1F)C1(C(F)(F)F)CCCCC1 ZINC000616099537 1053045593 /nfs/dbraw/zinc/04/55/93/1053045593.db2.gz BNDOWZCDXXZGED-UHFFFAOYSA-N -1 1 323.261 4.122 20 0 DIADMM CC(C)C[C@H]1CCCCN1C(=O)NCc1ccc([O-])c(Cl)c1 ZINC001313237467 1053096359 /nfs/dbraw/zinc/09/63/59/1053096359.db2.gz VSTCQJQZYBICSK-CQSZACIVSA-N -1 1 324.852 4.156 20 0 DIADMM CSc1c(F)cccc1[N-]C(=O)c1coc(C2CCCC2)n1 ZINC000617274974 1053118744 /nfs/dbraw/zinc/11/87/44/1053118744.db2.gz OTBXKUQPTHOJCR-UHFFFAOYSA-N -1 1 320.389 4.446 20 0 DIADMM CCC(=O)c1c(O)cc([O-])cc1O[C@@H]1CCc2c1cccc2C ZINC001228560158 1053133858 /nfs/dbraw/zinc/13/38/58/1053133858.db2.gz KMIITZFMMRBYPC-QGZVFWFLSA-N -1 1 312.365 4.065 20 0 DIADMM O=C1CC[C@H](Oc2[n-]c(=S)nc3ccccc32)c2ccccc21 ZINC001228766964 1053178891 /nfs/dbraw/zinc/17/88/91/1053178891.db2.gz XYQUQEZTONRXOH-INIZCTEOSA-N -1 1 322.389 4.015 20 0 DIADMM Cc1ccc(S(=O)(=O)[N-]c2cccc3ccc(C)cc32)cc1 ZINC000150286105 1053252477 /nfs/dbraw/zinc/25/24/77/1053252477.db2.gz WNHRVEFDFWWIJF-UHFFFAOYSA-N -1 1 311.406 4.257 20 0 DIADMM C[C@@H](Oc1cc([O-])cc2oc(=O)ccc12)c1csc(Cl)c1 ZINC001229134710 1053254983 /nfs/dbraw/zinc/25/49/83/1053254983.db2.gz IXMSUXFDNYAITQ-MRVPVSSYSA-N -1 1 322.769 4.354 20 0 DIADMM CCC[C@@H](Oc1cc([O-])cc2oc(=O)ccc12)c1ccccc1 ZINC001229134189 1053255161 /nfs/dbraw/zinc/25/51/61/1053255161.db2.gz FWDBSJSRKDNHFJ-MRXNPFEDSA-N -1 1 310.349 4.419 20 0 DIADMM CCC[C@H](Oc1c([O-])c(OC)cc2ccc(=O)oc21)C(C)(C)C ZINC001229217200 1053275371 /nfs/dbraw/zinc/27/53/71/1053275371.db2.gz ZHUCIHDRPGTDGW-ZDUSSCGKSA-N -1 1 320.385 4.101 20 0 DIADMM CCC(CC)[C@@H](CC)Oc1c([O-])c(OC)cc2ccc(=O)oc21 ZINC001229217186 1053275967 /nfs/dbraw/zinc/27/59/67/1053275967.db2.gz ZCFLSDCPVIOHMF-CYBMUJFWSA-N -1 1 320.385 4.101 20 0 DIADMM CC[C@H](C)Oc1cc([O-])cc2c1C(=O)C[C@@H](c1ccccc1)O2 ZINC001229230284 1053279414 /nfs/dbraw/zinc/27/94/14/1053279414.db2.gz OZTHWCJNSINMES-LRDDRELGSA-N -1 1 312.365 4.276 20 0 DIADMM CC[C@@H](C)[C@H](C)Oc1cc(O)ccc1C(=O)c1ccc([O-])cc1 ZINC001229296254 1053295880 /nfs/dbraw/zinc/29/58/80/1053295880.db2.gz GSWVUHZJDDLUNY-OLZOCXBDSA-N -1 1 314.381 4.142 20 0 DIADMM CC[C@H](C)[C@H](C)Oc1cc(O)ccc1C(=O)c1ccc([O-])cc1 ZINC001229296261 1053295974 /nfs/dbraw/zinc/29/59/74/1053295974.db2.gz GSWVUHZJDDLUNY-STQMWFEESA-N -1 1 314.381 4.142 20 0 DIADMM CC(=O)[C@H](Oc1cc([O-])c(Cl)cc1Cl)c1ccccc1 ZINC001229406334 1053315923 /nfs/dbraw/zinc/31/59/23/1053315923.db2.gz RCLAHJGYKXTGDR-HNNXBMFYSA-N -1 1 311.164 4.408 20 0 DIADMM [O-]c1cc(O[C@@H]2CC(F)(F)C2(F)F)c(Cl)cc1Cl ZINC001229406580 1053316077 /nfs/dbraw/zinc/31/60/77/1053316077.db2.gz ZWJNPYGPPDYPPN-MRVPVSSYSA-N -1 1 305.054 4.121 20 0 DIADMM CCC(=O)c1ccc([O-])cc1O[C@H](C)c1ccc(F)c(F)c1 ZINC001229475591 1053330428 /nfs/dbraw/zinc/33/04/28/1053330428.db2.gz AGRJFDKXFUDBLA-SNVBAGLBSA-N -1 1 306.308 4.403 20 0 DIADMM CCC(=O)c1ccc([O-])cc1O[C@H](C)c1cccc(F)c1F ZINC001229475664 1053333202 /nfs/dbraw/zinc/33/32/02/1053333202.db2.gz DDCHZUKCGIBJIF-SNVBAGLBSA-N -1 1 306.308 4.403 20 0 DIADMM CCC(=O)c1ccc([O-])cc1O[C@H](C)c1ccc(OC)cc1F ZINC001229478793 1053333276 /nfs/dbraw/zinc/33/32/76/1053333276.db2.gz XCCZUQLPUFZQOP-LLVKDONJSA-N -1 1 318.344 4.273 20 0 DIADMM CCC(=O)c1ccc([O-])cc1O[C@@H](C)c1ccc(OC)cc1F ZINC001229478799 1053333326 /nfs/dbraw/zinc/33/33/26/1053333326.db2.gz XCCZUQLPUFZQOP-NSHDSACASA-N -1 1 318.344 4.273 20 0 DIADMM CCC(=O)c1ccc([O-])cc1O[C@@H](C)COc1cccc(C)c1 ZINC001229477499 1053334013 /nfs/dbraw/zinc/33/40/13/1053334013.db2.gz NTMVQGBIXZJPQN-AWEZNQCLSA-N -1 1 314.381 4.140 20 0 DIADMM Cc1cccc(C(=O)Nc2ccc(Br)c([O-])c2)c1C ZINC001320661017 1053352979 /nfs/dbraw/zinc/35/29/79/1053352979.db2.gz HEBCSBDBKXYZBF-UHFFFAOYSA-N -1 1 320.186 4.024 20 0 DIADMM CC(C)CC[C@H]1CCCCN1C(=O)c1cc(Cl)ccc1[O-] ZINC001545742310 1053363869 /nfs/dbraw/zinc/36/38/69/1053363869.db2.gz KMZQVEMRJGSZTB-CQSZACIVSA-N -1 1 309.837 4.477 20 0 DIADMM C=Cc1ccc(C(=O)Nc2ccc(Br)c([O-])c2)cc1 ZINC001320978000 1053378655 /nfs/dbraw/zinc/37/86/55/1053378655.db2.gz BXNGJUHOQZQTCL-UHFFFAOYSA-N -1 1 318.170 4.050 20 0 DIADMM CC(C)C[C@H](C)CC(=O)Nc1ccc(Br)c([O-])c1 ZINC001321276974 1053405382 /nfs/dbraw/zinc/40/53/82/1053405382.db2.gz MAYLHYCBNZTPEJ-JTQLQIEISA-N -1 1 314.223 4.166 20 0 DIADMM CCCC[C@H](CC)C(=O)Nc1ccc(Br)c([O-])c1 ZINC001321816989 1053434508 /nfs/dbraw/zinc/43/45/08/1053434508.db2.gz HWXNXUNCLUFNCP-JTQLQIEISA-N -1 1 314.223 4.310 20 0 DIADMM [O-]c1ccc(-c2noc(CSCc3cccs3)n2)c(F)c1 ZINC001322066226 1053452033 /nfs/dbraw/zinc/45/20/33/1053452033.db2.gz LLOUHZBHTCRXSQ-UHFFFAOYSA-N -1 1 322.386 4.076 20 0 DIADMM CC[C@H](C)CNC(=S)Nc1cc(Cl)c(Cl)cc1[O-] ZINC001200253882 1053501365 /nfs/dbraw/zinc/50/13/65/1053501365.db2.gz KYFRGMDXNHDSHC-ZETCQYMHSA-N -1 1 307.246 4.032 20 0 DIADMM COC(=O)c1c[n-]c(O[C@H](C)c2ccc(-c3ccccc3)cc2)n1 ZINC001230282610 1053511266 /nfs/dbraw/zinc/51/12/66/1053511266.db2.gz WWOWXVRTEOZXHH-CYBMUJFWSA-N -1 1 322.364 4.003 20 0 DIADMM Cc1oc(-c2cccs2)nc1C(=O)[N-]c1cnoc1C(C)C ZINC001353787375 1053668571 /nfs/dbraw/zinc/66/85/71/1053668571.db2.gz BAGHXHVHPBOZNT-UHFFFAOYSA-N -1 1 317.370 4.075 20 0 DIADMM CC[C@H](C)C[C@H](CC)Oc1cccnc1-c1ncccc1[O-] ZINC001231200418 1053699038 /nfs/dbraw/zinc/69/90/38/1053699038.db2.gz NGKSZKDQSONRIY-KBPBESRZSA-N -1 1 300.402 4.443 20 0 DIADMM [O-]c1cccnc1-c1ncccc1O[C@@H]1CCCc2ccccc21 ZINC001231199219 1053699075 /nfs/dbraw/zinc/69/90/75/1053699075.db2.gz CYTCZMPBPXRGHK-QGZVFWFLSA-N -1 1 318.376 4.306 20 0 DIADMM CC(C)C1CCC(Oc2cccnc2-c2ncccc2[O-])CC1 ZINC001231200415 1053699248 /nfs/dbraw/zinc/69/92/48/1053699248.db2.gz NCFVJPPCKYBETH-UHFFFAOYSA-N -1 1 312.413 4.443 20 0 DIADMM CC[C@H](C)CC[C@@H](C)Oc1cccnc1-c1ncccc1[O-] ZINC001231204888 1053700471 /nfs/dbraw/zinc/70/04/71/1053700471.db2.gz UZXVWYMZSAKDLW-UONOGXRCSA-N -1 1 300.402 4.443 20 0 DIADMM [O-]c1cccnc1-c1ncccc1O[C@@H]1CCc2cc(F)ccc21 ZINC001231204141 1053700686 /nfs/dbraw/zinc/70/06/86/1053700686.db2.gz NZOTUVLSEASXFF-MRXNPFEDSA-N -1 1 322.339 4.055 20 0 DIADMM [O-]c1cccnc1-c1ncccc1O[C@H]1CCc2cc(F)ccc21 ZINC001231204136 1053702029 /nfs/dbraw/zinc/70/20/29/1053702029.db2.gz NZOTUVLSEASXFF-INIZCTEOSA-N -1 1 322.339 4.055 20 0 DIADMM CC[C@@H](C)Oc1cc(Br)c([O-])cc1Br ZINC001231243957 1053708423 /nfs/dbraw/zinc/70/84/23/1053708423.db2.gz VDRNZXJFEQUBOP-ZCFIWIBFSA-N -1 1 324.012 4.095 20 0 DIADMM C[C@@H](Oc1ccccc1C(=O)c1ccc([O-])cc1)c1ccccn1 ZINC001231230447 1053708767 /nfs/dbraw/zinc/70/87/67/1053708767.db2.gz LPLSYRUVUXOYSO-CQSZACIVSA-N -1 1 319.360 4.158 20 0 DIADMM [O-]c1cc(CN2CCSC[C@@H]2c2ccccc2)ccc1Cl ZINC001231733885 1053841858 /nfs/dbraw/zinc/84/18/58/1053841858.db2.gz KSCSZUGYMOCUHO-MRXNPFEDSA-N -1 1 319.857 4.336 20 0 DIADMM C/C(=C/C(=O)Nc1ccc(Br)c([O-])c1)C(C)(C)C ZINC001327329338 1053852303 /nfs/dbraw/zinc/85/23/03/1053852303.db2.gz WTNRJPNDXPDEJS-CLFYSBASSA-N -1 1 312.207 4.086 20 0 DIADMM Cc1cccc2c(CC(=O)Nc3ccc([O-])c(Cl)c3)c[nH]c21 ZINC000157819707 1053871480 /nfs/dbraw/zinc/87/14/80/1053871480.db2.gz PVIGJRXDNVKDAC-UHFFFAOYSA-N -1 1 314.772 4.017 20 0 DIADMM CC1(C)CN(C(=O)c2cc(Cl)ccc2[O-])[C@@H]1c1ccccc1 ZINC000621173328 1053888286 /nfs/dbraw/zinc/88/82/86/1053888286.db2.gz XJSMWNRGUOULMY-MRXNPFEDSA-N -1 1 315.800 4.269 20 0 DIADMM Cc1cccc2c1CCN2C(=O)c1cc2ccccc2cc1[O-] ZINC000621615078 1053989425 /nfs/dbraw/zinc/98/94/25/1053989425.db2.gz YMOJSGUUAUPSBY-UHFFFAOYSA-N -1 1 303.361 4.057 20 0 DIADMM Cc1nocc1[N-]C(=O)c1nc(-c2ccccc2)oc1C(C)C ZINC001437298214 1054030673 /nfs/dbraw/zinc/03/06/73/1054030673.db2.gz WQNAPRDGGRLUDC-UHFFFAOYSA-N -1 1 311.341 4.014 20 0 DIADMM O=C(Nc1ccc(Br)c([O-])c1)[C@@H]1CCCC2(CC2)C1 ZINC001330788346 1054052815 /nfs/dbraw/zinc/05/28/15/1054052815.db2.gz RJGBKANSCVEXFS-SNVBAGLBSA-N -1 1 324.218 4.064 20 0 DIADMM Cc1ccc2c(c1)N(C(=O)c1cc3ccccc3cc1[O-])CC2 ZINC000621978540 1054069352 /nfs/dbraw/zinc/06/93/52/1054069352.db2.gz MBNOLCMDPLTWLB-UHFFFAOYSA-N -1 1 303.361 4.057 20 0 DIADMM [O-]c1c(Cl)ccc(CN2C[C@@H]3CC(F)(F)C[C@@H]3C2)c1Cl ZINC001232625657 1054088071 /nfs/dbraw/zinc/08/80/71/1054088071.db2.gz OLWKZTWKBBQCDJ-AOOOYVTPSA-N -1 1 322.182 4.176 20 0 DIADMM COc1ccccc1[C@H]1CCCN1Cc1ccc(F)c([O-])c1F ZINC001232935571 1054150330 /nfs/dbraw/zinc/15/03/30/1054150330.db2.gz UCZLVKOFNBWLSQ-OAHLLOKOSA-N -1 1 319.351 4.016 20 0 DIADMM CCCOc1ccc(Cl)cc1NC(=O)c1cc(F)ccc1[O-] ZINC000622316438 1054169865 /nfs/dbraw/zinc/16/98/65/1054169865.db2.gz UEWHCPOQJNGHPV-UHFFFAOYSA-N -1 1 323.751 4.226 20 0 DIADMM Cc1ccccc1[C@H]1CCC[N@H+]1Cc1cc(Cl)ncc1[O-] ZINC001233035254 1054175598 /nfs/dbraw/zinc/17/55/98/1054175598.db2.gz DBOQYFPKEONVLN-OAHLLOKOSA-N -1 1 302.805 4.086 20 0 DIADMM CC[C@@H](NC(=O)c1cc(F)ccc1[O-])c1ccc(Cl)s1 ZINC000622372476 1054189515 /nfs/dbraw/zinc/18/95/15/1054189515.db2.gz NNRUNZXRFVLPCU-SNVBAGLBSA-N -1 1 313.781 4.127 20 0 DIADMM O=C([N-][C@@H](c1ccccc1F)C1CCCC1)C(F)(F)C(F)F ZINC001355648500 1054194480 /nfs/dbraw/zinc/19/44/80/1054194480.db2.gz DEJLKPFGLYMGFB-GFCCVEGCSA-N -1 1 321.289 4.074 20 0 DIADMM O=C(Nc1cc(Cl)ccc1NC1CC1)c1cc(F)ccc1[O-] ZINC000622406015 1054204799 /nfs/dbraw/zinc/20/47/99/1054204799.db2.gz DYYQNZPWMJZQME-UHFFFAOYSA-N -1 1 320.751 4.011 20 0 DIADMM CC(C)c1oncc1[N-]C(=O)c1ccc(SC(F)(F)F)o1 ZINC001336087164 1054232488 /nfs/dbraw/zinc/23/24/88/1054232488.db2.gz AHWGKWUTWNYTNN-UHFFFAOYSA-N -1 1 320.292 4.255 20 0 DIADMM CC(C)c1nsc([N-]C(=O)c2ccc(-c3cccs3)o2)n1 ZINC001439089976 1054237474 /nfs/dbraw/zinc/23/74/74/1054237474.db2.gz VXXYQXCPDWDJIB-UHFFFAOYSA-N -1 1 319.411 4.235 20 0 DIADMM O=C(c1cc(F)ccc1[O-])N1CCC[C@H]1CCC1CCCC1 ZINC000622447149 1054240592 /nfs/dbraw/zinc/24/05/92/1054240592.db2.gz ANXPWEBALOMFPI-HNNXBMFYSA-N -1 1 305.393 4.106 20 0 DIADMM CC(C)C1(C)CCN(C(=O)c2cc3ccccc3cc2[O-])CC1 ZINC000622525013 1054273648 /nfs/dbraw/zinc/27/36/48/1054273648.db2.gz ONPUINNMBSGLKC-UHFFFAOYSA-N -1 1 311.425 4.444 20 0 DIADMM O=C(NC[C@H]1CCCC(F)(F)C1)c1cc2ccccc2cc1[O-] ZINC000622583078 1054292845 /nfs/dbraw/zinc/29/28/45/1054292845.db2.gz JUCICYCQENWRTM-LBPRGKRZSA-N -1 1 319.351 4.101 20 0 DIADMM O=C(c1ccc([O-])c(F)c1)N1CCC[C@H]1c1cccc(Cl)c1 ZINC001338051162 1054294999 /nfs/dbraw/zinc/29/49/99/1054294999.db2.gz FMXMHJJDEJOKGI-HNNXBMFYSA-N -1 1 319.763 4.162 20 0 DIADMM O=C(c1ccc([O-])c(F)c1)N1CCC[C@@H]1c1cccc(Cl)c1 ZINC001338051163 1054295229 /nfs/dbraw/zinc/29/52/29/1054295229.db2.gz FMXMHJJDEJOKGI-OAHLLOKOSA-N -1 1 319.763 4.162 20 0 DIADMM CCCC(=O)c1ccc([O-])cc1O[C@H](C)c1cccnc1F ZINC001233650971 1054321301 /nfs/dbraw/zinc/32/13/01/1054321301.db2.gz UZOLOTZQQCUFRJ-LLVKDONJSA-N -1 1 303.333 4.049 20 0 DIADMM CC(C)c1ccc(C(=O)Nc2cccc3ncccc32)c([O-])c1 ZINC001440584456 1054359258 /nfs/dbraw/zinc/35/92/58/1054359258.db2.gz JVCXADCJLKMUDB-UHFFFAOYSA-N -1 1 306.365 4.316 20 0 DIADMM COc1c(C)ccc(NC(=O)c2ccc(C(C)C)cc2[O-])c1C ZINC001441248981 1054389206 /nfs/dbraw/zinc/38/92/06/1054389206.db2.gz KRVCUSHWCOEWLV-UHFFFAOYSA-N -1 1 313.397 4.393 20 0 DIADMM C[C@@H](Oc1ccc(CC(=O)c2ccc([O-])cc2)cc1)C(F)(F)F ZINC001233942545 1054395572 /nfs/dbraw/zinc/39/55/72/1054395572.db2.gz ZOVNSCSCTSBTNE-LLVKDONJSA-N -1 1 324.298 4.147 20 0 DIADMM CCc1ccc(C(=O)N(Cc2ccco2)c2ccccc2)c([O-])c1 ZINC001443236207 1054442490 /nfs/dbraw/zinc/44/24/90/1054442490.db2.gz IGEMLRPNCNIISY-UHFFFAOYSA-N -1 1 321.376 4.395 20 0 DIADMM CC[C@H]1c2ccccc2CCN1C(=O)c1ccc(Cl)cc1[O-] ZINC001444130068 1054469812 /nfs/dbraw/zinc/46/98/12/1054469812.db2.gz BXNYHJWCWMXLMM-INIZCTEOSA-N -1 1 315.800 4.195 20 0 DIADMM Cc1ccc([C@H]2C[C@H](C)CCN2C(=O)c2ccc(F)c([O-])c2)o1 ZINC001444887749 1054490750 /nfs/dbraw/zinc/49/07/50/1054490750.db2.gz UACQYUVVCMOWPX-IAQYHMDHSA-N -1 1 317.360 4.046 20 0 DIADMM Cc1ccc([C@@H]2C[C@@H](C)CCN2C(=O)c2ccc(F)c([O-])c2)o1 ZINC001444887752 1054490865 /nfs/dbraw/zinc/49/08/65/1054490865.db2.gz UACQYUVVCMOWPX-NHYWBVRUSA-N -1 1 317.360 4.046 20 0 DIADMM C[C@]1(c2ccccc2)C[C@H]1NC(=O)c1ccc2ccccc2c1[O-] ZINC001444954541 1054493503 /nfs/dbraw/zinc/49/35/03/1054493503.db2.gz KYOGJWJMWGQIAC-WIYYLYMNSA-N -1 1 317.388 4.005 20 0 DIADMM CC(C)c1ccc(C(=O)Nc2cccc(OCCF)c2)c([O-])c1 ZINC001445679320 1054515260 /nfs/dbraw/zinc/51/52/60/1054515260.db2.gz NWNTZBGNUZCHQA-UHFFFAOYSA-N -1 1 317.360 4.116 20 0 DIADMM COc1ccc(C(=O)Nc2ccccc2SC(C)C)c([O-])c1 ZINC001446116675 1054526937 /nfs/dbraw/zinc/52/69/37/1054526937.db2.gz SYNSUVBNSSPBRD-UHFFFAOYSA-N -1 1 317.410 4.154 20 0 DIADMM CSc1ccc([O-])c(C(=O)Nc2cc(Cl)cc(C)c2O)c1 ZINC001447088370 1054554473 /nfs/dbraw/zinc/55/44/73/1054554473.db2.gz UATUXKGZIMFPEI-UHFFFAOYSA-N -1 1 323.801 4.034 20 0 DIADMM CC(C)c1ccc([C@@H]2CCCCN2C(=O)c2ncccc2[O-])cc1 ZINC001447239717 1054559271 /nfs/dbraw/zinc/55/92/71/1054559271.db2.gz WYKPHEUDWAYHDP-KRWDZBQOSA-N -1 1 324.424 4.278 20 0 DIADMM CC1=C(C)C[C@@H](C(=O)Nc2ccc(Br)c([O-])c2)CC1 ZINC001447737247 1054573321 /nfs/dbraw/zinc/57/33/21/1054573321.db2.gz ZDJYZTDTOGWIIW-NSHDSACASA-N -1 1 324.218 4.230 20 0 DIADMM Cc1cnc(CN[C@@H](C)c2ccc(Cl)c(Cl)c2[O-])s1 ZINC000185569412 1054582914 /nfs/dbraw/zinc/58/29/14/1054582914.db2.gz DDHHXZLJPOLOKO-QMMMGPOBSA-N -1 1 317.241 4.315 20 0 DIADMM c1cc2[n-]c(O[C@@H](c3ccccc3)c3ccccn3)nc2s1 ZINC001234847277 1054598613 /nfs/dbraw/zinc/59/86/13/1054598613.db2.gz HMXODDMFGFNJFC-HNNXBMFYSA-N -1 1 307.378 4.188 20 0 DIADMM C[C@@H](NC(=O)Cc1ccc([O-])c(Cl)c1)c1ccccc1Cl ZINC001448934721 1054609290 /nfs/dbraw/zinc/60/92/90/1054609290.db2.gz KJAZBFVEDDCQLZ-SNVBAGLBSA-N -1 1 324.207 4.119 20 0 DIADMM C[C@H]1C[C@@H](c2ccccc2)N(C(=O)c2cc(Cl)ccc2[O-])C1 ZINC001449201340 1054615052 /nfs/dbraw/zinc/61/50/52/1054615052.db2.gz HMALQLCIXVTTAQ-LRDDRELGSA-N -1 1 315.800 4.269 20 0 DIADMM O=C(NCC1CCCCCC1)c1ccc(C(F)(F)F)c([O-])c1 ZINC001449662987 1054626840 /nfs/dbraw/zinc/62/68/40/1054626840.db2.gz VFKPMYOMFFGOJN-UHFFFAOYSA-N -1 1 315.335 4.111 20 0 DIADMM Cc1cc(C)cc(C(=O)Nc2cccc([O-])c2Br)c1 ZINC001449931173 1054633303 /nfs/dbraw/zinc/63/33/03/1054633303.db2.gz CAOITBXNKGCTRA-UHFFFAOYSA-N -1 1 320.186 4.024 20 0 DIADMM Cc1ccccc1C(C)(C)NC(=O)c1c([O-])cccc1Cl ZINC001450163522 1054638010 /nfs/dbraw/zinc/63/80/10/1054638010.db2.gz SUXKFMPEZHBITJ-UHFFFAOYSA-N -1 1 303.789 4.019 20 0 DIADMM CCCCCC[C@H](C)CC(=O)n1[n-]c(=O)c2ccc(OC)cc21 ZINC001450568054 1054653432 /nfs/dbraw/zinc/65/34/32/1054653432.db2.gz OYRMGWSNUOHAEE-ZDUSSCGKSA-N -1 1 318.417 4.387 20 0 DIADMM C[C@H](C(=O)Nc1cc([O-])c(F)cc1F)c1ccc(Cl)s1 ZINC001450899204 1054664139 /nfs/dbraw/zinc/66/41/39/1054664139.db2.gz QRRQXWXFZZPTHG-LURJTMIESA-N -1 1 317.744 4.128 20 0 DIADMM CC(C)(C)[C@@H]1CCC[C@@H]1NC(=O)c1cc2ccccc2cc1[O-] ZINC001451295403 1054673352 /nfs/dbraw/zinc/67/33/52/1054673352.db2.gz JQHNTZCHZYXZDS-SJORKVTESA-N -1 1 311.425 4.490 20 0 DIADMM CCC[C@@H]1CCCC[C@@H]1CNC(=O)c1ccc(Cl)cc1[O-] ZINC001451465562 1054678899 /nfs/dbraw/zinc/67/88/99/1054678899.db2.gz RUNFPKNGEQKGNQ-CHWSQXEVSA-N -1 1 309.837 4.382 20 0 DIADMM CC(C)Cc1ccc(CC(=O)Nc2cc(F)cc(F)c2[O-])cc1 ZINC001451748586 1054687881 /nfs/dbraw/zinc/68/78/81/1054687881.db2.gz XRAAGTUJIVQGGZ-UHFFFAOYSA-N -1 1 319.351 4.050 20 0 DIADMM O=C(c1ccc(Cl)cc1[O-])N1CC[C@H](C2CCCCC2)C1 ZINC001452958236 1054722745 /nfs/dbraw/zinc/72/27/45/1054722745.db2.gz VRCFONCUEMKRIV-ZDUSSCGKSA-N -1 1 307.821 4.088 20 0 DIADMM CC(C)[C@@H](NC(=O)c1cc(Cl)ccc1[O-])c1ccccc1F ZINC001452988360 1054723753 /nfs/dbraw/zinc/72/37/53/1054723753.db2.gz XBSHNWQQKAFKNJ-MRXNPFEDSA-N -1 1 321.779 4.312 20 0 DIADMM CC(C)[C@H](NC(=O)c1cc(Cl)ccc1[O-])c1ccccc1F ZINC001452988359 1054723934 /nfs/dbraw/zinc/72/39/34/1054723934.db2.gz XBSHNWQQKAFKNJ-INIZCTEOSA-N -1 1 321.779 4.312 20 0 DIADMM O=C(c1ccc2ccccc2c1[O-])N1CCC(C2CCC2)CC1 ZINC001452996678 1054724436 /nfs/dbraw/zinc/72/44/36/1054724436.db2.gz JNFPSBYQGMKSJK-UHFFFAOYSA-N -1 1 309.409 4.198 20 0 DIADMM O=C(Cc1ccc([O-])c(Cl)c1)N[C@H]1CCCC12CCCCC2 ZINC001453401812 1054735734 /nfs/dbraw/zinc/73/57/34/1054735734.db2.gz TYSQCDFSMXTDIB-INIZCTEOSA-N -1 1 321.848 4.207 20 0 DIADMM CC[C@@H](C(=O)[N-]OCC1CCC1)c1cccc(C(F)(F)F)c1 ZINC001453744021 1054745790 /nfs/dbraw/zinc/74/57/90/1054745790.db2.gz VRWIUKPFNFINAL-CQSZACIVSA-N -1 1 315.335 4.047 20 0 DIADMM CC1(C)CN(C(=O)c2cc3ccccc3cc2[O-])[C@@H]1c1ccco1 ZINC001454611150 1054775331 /nfs/dbraw/zinc/77/53/31/1054775331.db2.gz AUZWVIRZQIEHKU-GOSISDBHSA-N -1 1 321.376 4.362 20 0 DIADMM CC(C)[C@@H]1N(C(=O)c2ccc([O-])c(F)c2)CC12CCCCCC2 ZINC001454819244 1054784814 /nfs/dbraw/zinc/78/48/14/1054784814.db2.gz DTACOCHSXBAVET-KRWDZBQOSA-N -1 1 319.420 4.352 20 0 DIADMM O=C(Nc1ccc(NC2CCCCC2)cc1)c1ccccc1[O-] ZINC000623833851 1054786938 /nfs/dbraw/zinc/78/69/38/1054786938.db2.gz VMYUIGJOCOEYMA-UHFFFAOYSA-N -1 1 310.397 4.389 20 0 DIADMM O=C(CCc1ccc2[nH]ccc2c1)Nc1ccc([O-])c(Cl)c1 ZINC000181510571 1054920308 /nfs/dbraw/zinc/92/03/08/1054920308.db2.gz RVLBXPHCCNRMPV-UHFFFAOYSA-N -1 1 314.772 4.098 20 0 DIADMM Cc1c(Cl)c(-c2cc(N3CCCC3)ccn2)ccc1C(=O)[O-] ZINC001236112272 1054954219 /nfs/dbraw/zinc/95/42/19/1054954219.db2.gz DXBGIGBUNLPSEQ-UHFFFAOYSA-N -1 1 316.788 4.009 20 0 DIADMM Cc1nc(-c2ccc(C(=O)[O-])c(C)c2Cl)cc2[nH]ccc21 ZINC001236115917 1054956714 /nfs/dbraw/zinc/95/67/14/1054956714.db2.gz RWSDEVZIHUFSKM-UHFFFAOYSA-N -1 1 300.745 4.198 20 0 DIADMM Cc1c(C(=O)[O-])ccc(-c2ccc(CN(C)C)c(F)c2)c1Cl ZINC001236128075 1054961582 /nfs/dbraw/zinc/96/15/82/1054961582.db2.gz JMYKJAPKIVFFOU-UHFFFAOYSA-N -1 1 321.779 4.214 20 0 DIADMM COC(=O)c1nc2cc(C3=CC[C@H](C(F)(F)F)CC3)ccc2[n-]1 ZINC001236253204 1055037209 /nfs/dbraw/zinc/03/72/09/1055037209.db2.gz HXZMGYAXAXCCKR-NSHDSACASA-N -1 1 324.302 4.095 20 0 DIADMM COC(=O)c1nc2ccc(C3=CC[C@H](C(F)(F)F)CC3)cc2[n-]1 ZINC001236253204 1055037217 /nfs/dbraw/zinc/03/72/17/1055037217.db2.gz HXZMGYAXAXCCKR-NSHDSACASA-N -1 1 324.302 4.095 20 0 DIADMM Cc1ccc(F)c(-c2cc(OCc3ccccc3)ccn2)c1[O-] ZINC001236391301 1055089226 /nfs/dbraw/zinc/08/92/26/1055089226.db2.gz IHTNVHPUJHBZPI-UHFFFAOYSA-N -1 1 309.340 4.481 20 0 DIADMM Cc1cc(-c2c(F)ccc(C)c2[O-])nc(-c2cccs2)n1 ZINC001236391755 1055089832 /nfs/dbraw/zinc/08/98/32/1055089832.db2.gz OXARSGLMNJDWPY-UHFFFAOYSA-N -1 1 300.358 4.334 20 0 DIADMM Cc1ccc(F)c(-c2nccc(NC(=O)C(C)(C)C)c2C)c1[O-] ZINC001236393779 1055090173 /nfs/dbraw/zinc/09/01/73/1055090173.db2.gz YEMQALFMRLHXCQ-UHFFFAOYSA-N -1 1 316.376 4.195 20 0 DIADMM Cc1ccc(F)c(-c2ccc(-c3c(F)cccc3F)nn2)c1[O-] ZINC001236389431 1055091290 /nfs/dbraw/zinc/09/12/90/1055091290.db2.gz CSLCPDVTXBWSFQ-UHFFFAOYSA-N -1 1 316.282 4.242 20 0 DIADMM Cc1ccc(F)c(-c2ncnc3cc(C(F)(F)F)ccc32)c1[O-] ZINC001236394622 1055092113 /nfs/dbraw/zinc/09/21/13/1055092113.db2.gz YQBSCLFVDRVIFP-UHFFFAOYSA-N -1 1 322.261 4.469 20 0 DIADMM Cc1c(C(=O)Nc2cccc(F)c2[O-])sc2cccc(F)c12 ZINC001587385241 1055282643 /nfs/dbraw/zinc/28/26/43/1055282643.db2.gz NFEKUMMKTLLTBT-UHFFFAOYSA-N -1 1 319.332 4.446 20 0 DIADMM Cc1cc(CCCC(=O)Nc2cccc(F)c2[O-])c(C)s1 ZINC001587389520 1055285100 /nfs/dbraw/zinc/28/51/00/1055285100.db2.gz LUKJWYSPUFDARF-UHFFFAOYSA-N -1 1 307.390 4.171 20 0 DIADMM CSc1cc(F)ccc1[N-]C(=O)c1scnc1C(F)F ZINC001537377995 1055296308 /nfs/dbraw/zinc/29/63/08/1055296308.db2.gz HCMRJBRUFXFHBF-UHFFFAOYSA-N -1 1 318.345 4.194 20 0 DIADMM CCCc1nc(C)c(C(=O)Nc2ccc([O-])c(Cl)c2)s1 ZINC000171881213 1055373096 /nfs/dbraw/zinc/37/30/96/1055373096.db2.gz DTCJZVASIFQBNJ-UHFFFAOYSA-N -1 1 310.806 4.015 20 0 DIADMM C[C@@H]1CCN(C(=O)c2cccc([O-])c2F)c2ccccc2S1 ZINC001587972876 1055406930 /nfs/dbraw/zinc/40/69/30/1055406930.db2.gz LUJDNPDDEJISGE-LLVKDONJSA-N -1 1 317.385 4.062 20 0 DIADMM O=C(c1ccc(Cl)cc1[O-])N1CCC[C@H](C2CCC2)CC1 ZINC001588097397 1055428883 /nfs/dbraw/zinc/42/88/83/1055428883.db2.gz ZXCQKPIIODRXSW-ZDUSSCGKSA-N -1 1 307.821 4.088 20 0 DIADMM [O-]c1c(-c2nc(Cc3cccs3)no2)ccc2ccccc21 ZINC000387326946 1055565491 /nfs/dbraw/zinc/56/54/91/1055565491.db2.gz UFWZMZJYFROYEP-UHFFFAOYSA-N -1 1 308.362 4.248 20 0 DIADMM C/C(=C/C(=O)NCc1ccc([O-])c(Cl)c1)c1ccccc1C ZINC001594558074 1055567861 /nfs/dbraw/zinc/56/78/61/1055567861.db2.gz DKTNQKMYUGVVPY-LCYFTJDESA-N -1 1 315.800 4.074 20 0 DIADMM Cc1cc(F)ccc1[C@H](C)NC(=O)c1ccc2ccccc2c1[O-] ZINC001595105018 1055579589 /nfs/dbraw/zinc/57/95/89/1055579589.db2.gz WESINKCBDIZRCB-ZDUSSCGKSA-N -1 1 323.367 4.484 20 0 DIADMM CC(C)Cc1ccc(NC(=O)Cc2ccc([O-])c(Cl)c2)cc1 ZINC001595328385 1055587730 /nfs/dbraw/zinc/58/77/30/1055587730.db2.gz YINLSBNDQLEYSC-UHFFFAOYSA-N -1 1 317.816 4.425 20 0 DIADMM C[C@@H]1CCN(C(=O)Cc2ccc([O-])c(Cl)c2)[C@H]2CCCC[C@@H]12 ZINC001595533604 1055607805 /nfs/dbraw/zinc/60/78/05/1055607805.db2.gz OWQLCLORPHAIDQ-INWMFGNUSA-N -1 1 321.848 4.015 20 0 DIADMM [O-]c1cc(F)c(CN2CC[C@H](c3ccc(F)cc3)C2)cc1Cl ZINC001238149680 1055611730 /nfs/dbraw/zinc/61/17/30/1055611730.db2.gz MCTVMJWBWLOOJD-LBPRGKRZSA-N -1 1 323.770 4.313 20 0 DIADMM CC(C)(C)C[C@@H](NC(=O)c1ccc(F)c([O-])c1)c1ccccc1 ZINC001595933340 1055651094 /nfs/dbraw/zinc/65/10/94/1055651094.db2.gz SAUNAXHHIPHJBA-MRXNPFEDSA-N -1 1 315.388 4.439 20 0 DIADMM O=C(NCc1csc2ccccc12)c1ccc(Cl)cc1[O-] ZINC001596032640 1055661786 /nfs/dbraw/zinc/66/17/86/1055661786.db2.gz IYVAHMMHQUBHRR-UHFFFAOYSA-N -1 1 317.797 4.190 20 0 DIADMM Cc1cccc([C@@H](C)NC(=O)c2ccc(Cl)cc2[O-])c1C ZINC001565704855 1055721062 /nfs/dbraw/zinc/72/10/62/1055721062.db2.gz VEQRKKRTCWXJPF-GFCCVEGCSA-N -1 1 303.789 4.153 20 0 DIADMM COc1ccc(Cl)cc1NC(=O)c1cc(SC)ccc1[O-] ZINC001538817383 1055726954 /nfs/dbraw/zinc/72/69/54/1055726954.db2.gz VHLMBCCHPHNNQE-UHFFFAOYSA-N -1 1 323.801 4.028 20 0 DIADMM CC[C@H](C)[C@H]1CCCCN1C(=O)Cc1ccc([O-])c(Cl)c1 ZINC001565889571 1055734897 /nfs/dbraw/zinc/73/48/97/1055734897.db2.gz NZGYSFOFHSBKOI-SWLSCSKDSA-N -1 1 309.837 4.015 20 0 DIADMM CC[C@]1(C)CCCN(C(=O)c2ccc(C(F)(F)F)c([O-])c2)C1 ZINC001566002623 1055739995 /nfs/dbraw/zinc/73/99/95/1055739995.db2.gz FXTHEMUOHYRUDA-OAHLLOKOSA-N -1 1 315.335 4.063 20 0 DIADMM CC1(C)CCCN(C(=O)c2ccc(C(F)(F)F)c([O-])c2)CC1 ZINC001566145386 1055743713 /nfs/dbraw/zinc/74/37/13/1055743713.db2.gz QQISEFBIRQEWRW-UHFFFAOYSA-N -1 1 315.335 4.063 20 0 DIADMM CCc1ccc(C(C)(C)NC(=O)c2cc(Cl)ccc2[O-])cc1 ZINC001566215260 1055750055 /nfs/dbraw/zinc/75/00/55/1055750055.db2.gz GKGLYIYDORWLLO-UHFFFAOYSA-N -1 1 317.816 4.273 20 0 DIADMM O=C(N[C@H]1CCc2cccc3cccc1c32)c1ccc([O-])cc1F ZINC001596898667 1055757777 /nfs/dbraw/zinc/75/77/77/1055757777.db2.gz UDSZKUMQTOMULW-SFHVURJKSA-N -1 1 321.351 4.102 20 0 DIADMM CCCC1(CNC(=O)c2ccc(C(F)(F)F)cc2[O-])CCC1 ZINC001566392733 1055768443 /nfs/dbraw/zinc/76/84/43/1055768443.db2.gz HPGWURAKEORVNX-UHFFFAOYSA-N -1 1 315.335 4.111 20 0 DIADMM CCc1ccc(C(=O)Nc2cnc(-c3ccccc3)s2)c([O-])c1 ZINC001566416821 1055771631 /nfs/dbraw/zinc/77/16/31/1055771631.db2.gz CKJRTLCEQPMOLH-UHFFFAOYSA-N -1 1 324.405 4.330 20 0 DIADMM CCC1(CC)CCCN(C(=O)c2c([O-])cccc2Cl)CC1 ZINC001567618139 1055808422 /nfs/dbraw/zinc/80/84/22/1055808422.db2.gz CLEZERZXPHUTFX-UHFFFAOYSA-N -1 1 309.837 4.478 20 0 DIADMM CC(C)n1ccc(-c2ccc([C@H](C)[N-]C(=O)C(F)(F)F)cc2)c1 ZINC001239079045 1055838641 /nfs/dbraw/zinc/83/86/41/1055838641.db2.gz POWVYFLAIGVMRX-LBPRGKRZSA-N -1 1 324.346 4.476 20 0 DIADMM O=C(N[C@@H]1CC[C@@H]2CCCC[C@@H]2C1)c1ncc2ccccc2c1[O-] ZINC001539461149 1055848558 /nfs/dbraw/zinc/84/85/58/1055848558.db2.gz XODDSZYEBCDZJI-SQWLQELKSA-N -1 1 324.424 4.029 20 0 DIADMM O=C(N[C@@H]1CC[C@@H]2CCCC[C@H]2C1)c1ncc2ccccc2c1[O-] ZINC001539461147 1055848929 /nfs/dbraw/zinc/84/89/29/1055848929.db2.gz XODDSZYEBCDZJI-OFQRWUPVSA-N -1 1 324.424 4.029 20 0 DIADMM O=C(Nc1ccc([O-])c(F)c1F)c1ccc(Cl)c2occc21 ZINC001569012778 1055852499 /nfs/dbraw/zinc/85/24/99/1055852499.db2.gz MXSJTIBZIAVBKQ-UHFFFAOYSA-N -1 1 323.682 4.322 20 0 DIADMM C[C@H](C(=O)Nc1cc([O-])c(F)cc1F)c1cccc(Cl)c1 ZINC001570101792 1055887757 /nfs/dbraw/zinc/88/77/57/1055887757.db2.gz LAWSWZXUROHZDF-QMMMGPOBSA-N -1 1 311.715 4.066 20 0 DIADMM CCOC(=O)c1nc2cc(-c3c(C)cc(C)cc3C)ccc2[n-]1 ZINC001239549720 1055947625 /nfs/dbraw/zinc/94/76/25/1055947625.db2.gz HAFOIERMWNYUSH-UHFFFAOYSA-N -1 1 308.381 4.332 20 0 DIADMM CCOC(=O)c1nc2ccc(-c3c(C)cc(C)cc3C)cc2[n-]1 ZINC001239549720 1055947628 /nfs/dbraw/zinc/94/76/28/1055947628.db2.gz HAFOIERMWNYUSH-UHFFFAOYSA-N -1 1 308.381 4.332 20 0 DIADMM O=C([N-]c1c(F)cccc1F)c1cc(-c2ccccc2F)on1 ZINC000615914815 1055980554 /nfs/dbraw/zinc/98/05/54/1055980554.db2.gz HUSPIZGPEYOCQP-UHFFFAOYSA-N -1 1 318.254 4.011 20 0 DIADMM Cc1nc2ccccc2cc1C(=O)Nc1ccc([O-])c(Cl)c1 ZINC000111666324 1056057653 /nfs/dbraw/zinc/05/76/53/1056057653.db2.gz KMZFUEJWXAXFNH-UHFFFAOYSA-N -1 1 312.756 4.155 20 0 DIADMM CC(C)Oc1cccc(CC(=O)Nc2ccc([O-])c(Cl)c2)c1 ZINC000111667286 1056058579 /nfs/dbraw/zinc/05/85/79/1056058579.db2.gz NILYWEICJQHJPR-UHFFFAOYSA-N -1 1 319.788 4.014 20 0 DIADMM C[C@@H]1CCN(C(=O)c2ccc([O-])cc2F)c2ccccc2S1 ZINC001540676623 1056059968 /nfs/dbraw/zinc/05/99/68/1056059968.db2.gz HTSNWWBERBJMCW-LLVKDONJSA-N -1 1 317.385 4.062 20 0 DIADMM CC(C)CCN(CCC(C)C)C(=O)c1c(F)ccc([O-])c1F ZINC001540707088 1056064522 /nfs/dbraw/zinc/06/45/22/1056064522.db2.gz SVLGPBLVVGVQJB-UHFFFAOYSA-N -1 1 313.388 4.205 20 0 DIADMM CC(C)(C)c1csc(C(=O)Nc2ccc(Cl)cc2[O-])n1 ZINC001610899632 1056076220 /nfs/dbraw/zinc/07/62/20/1056076220.db2.gz JHFXNQNTEPUCLM-UHFFFAOYSA-N -1 1 310.806 4.052 20 0 DIADMM Cc1cnc(C(=O)N[C@@H](CC(C)(C)C)c2ccccc2)c([O-])c1 ZINC001541069448 1056089553 /nfs/dbraw/zinc/08/95/53/1056089553.db2.gz UGNKNVXOZVGNMY-HNNXBMFYSA-N -1 1 312.413 4.003 20 0 DIADMM CC(C)(C)C[C@@H](NC(=O)c1cc(F)ccc1[O-])c1ccccc1 ZINC001541069188 1056090403 /nfs/dbraw/zinc/09/04/03/1056090403.db2.gz QBMAULBXANLEEC-MRXNPFEDSA-N -1 1 315.388 4.439 20 0 DIADMM CCc1ccc2occ(C(=O)Nc3nc(Cl)ccc3[O-])c2c1 ZINC001611166004 1056119852 /nfs/dbraw/zinc/11/98/52/1056119852.db2.gz DWTKDGCWJYAXJN-UHFFFAOYSA-N -1 1 316.744 4.002 20 0 DIADMM O=C(N[C@@H](c1ccccc1)C1CCCC1)c1c([O-])cccc1F ZINC001542495148 1056126523 /nfs/dbraw/zinc/12/65/23/1056126523.db2.gz NGPJSNNDBNWONH-SFHVURJKSA-N -1 1 313.372 4.193 20 0 DIADMM CCSc1ccc(Cl)cc1NC(=O)c1ccccc1[O-] ZINC001543193806 1056185100 /nfs/dbraw/zinc/18/51/00/1056185100.db2.gz NFUZJNGZIZRJDZ-UHFFFAOYSA-N -1 1 307.802 4.410 20 0 DIADMM C[C@H](CC(C)(C)c1ccccc1)NC(=O)c1c([O-])cccc1F ZINC001583901654 1056199440 /nfs/dbraw/zinc/19/94/40/1056199440.db2.gz LKBAREYCOYFTNF-CYBMUJFWSA-N -1 1 315.388 4.018 20 0 DIADMM CCc1cccc2c1N(C(=O)c1ccc3ccccc3c1[O-])CC2 ZINC001543322991 1056202873 /nfs/dbraw/zinc/20/28/73/1056202873.db2.gz VXIJMFHTAAYQCG-UHFFFAOYSA-N -1 1 317.388 4.311 20 0 DIADMM CCOC(=O)c1nc2cc(-c3cccc(OC(C)C)c3)ccc2[n-]1 ZINC001239970914 1056211895 /nfs/dbraw/zinc/21/18/95/1056211895.db2.gz UWUCDZNJZUIRGR-UHFFFAOYSA-N -1 1 324.380 4.194 20 0 DIADMM CCOC(=O)c1nc2ccc(-c3cccc(OC(C)C)c3)cc2[n-]1 ZINC001239970914 1056211910 /nfs/dbraw/zinc/21/19/10/1056211910.db2.gz UWUCDZNJZUIRGR-UHFFFAOYSA-N -1 1 324.380 4.194 20 0 DIADMM Cc1ccccc1[C@H](CC(C)C)NC(=O)c1cccc([O-])c1F ZINC001543422608 1056216452 /nfs/dbraw/zinc/21/64/52/1056216452.db2.gz NTZPZPGAEDFCIK-INIZCTEOSA-N -1 1 315.388 4.357 20 0 DIADMM CC(C)(C)[C@H]1CCCC[C@@H]1NC(=O)c1cc(Cl)ccc1[O-] ZINC001543514570 1056241583 /nfs/dbraw/zinc/24/15/83/1056241583.db2.gz VUTYTQHBPGUALN-KBPBESRZSA-N -1 1 309.837 4.380 20 0 DIADMM CC(C)[C@@H](CNC(=O)c1ccc(Cl)cc1[O-])c1ccccc1 ZINC001543565142 1056253821 /nfs/dbraw/zinc/25/38/21/1056253821.db2.gz GBSBSRBNHLHVLI-MRXNPFEDSA-N -1 1 317.816 4.215 20 0 DIADMM CC(C)Oc1ccc(NC(=O)c2cc(F)ccc2[O-])cc1Cl ZINC001543769479 1056295083 /nfs/dbraw/zinc/29/50/83/1056295083.db2.gz WRPPKICCMAFIDE-UHFFFAOYSA-N -1 1 323.751 4.224 20 0 DIADMM CCOC(=O)c1nc2ccc(-c3c4cc[nH]c4ccc3F)cc2[n-]1 ZINC001240219788 1056375890 /nfs/dbraw/zinc/37/58/90/1056375890.db2.gz PJDDHRQCENIWCM-UHFFFAOYSA-N -1 1 323.327 4.027 20 0 DIADMM CCOC(=O)c1nc2cc(-c3c4cc[nH]c4ccc3F)ccc2[n-]1 ZINC001240219788 1056375906 /nfs/dbraw/zinc/37/59/06/1056375906.db2.gz PJDDHRQCENIWCM-UHFFFAOYSA-N -1 1 323.327 4.027 20 0 DIADMM CC(C)CC[C@@H]1CCC[C@H]1NC(=O)c1cc(Cl)ccc1[O-] ZINC001584729952 1056405417 /nfs/dbraw/zinc/40/54/17/1056405417.db2.gz MQVKGSGSYXETLZ-SWLSCSKDSA-N -1 1 309.837 4.380 20 0 DIADMM CCOC(=O)c1nc2cc(-c3cc(C)sc3C)ccc2[n-]1 ZINC001240431575 1056503072 /nfs/dbraw/zinc/50/30/72/1056503072.db2.gz BBIXRVCYPVEZLR-UHFFFAOYSA-N -1 1 300.383 4.085 20 0 DIADMM CCOC(=O)c1nc2ccc(-c3cc(C)sc3C)cc2[n-]1 ZINC001240431575 1056503086 /nfs/dbraw/zinc/50/30/86/1056503086.db2.gz BBIXRVCYPVEZLR-UHFFFAOYSA-N -1 1 300.383 4.085 20 0 DIADMM O=c1cc(C(F)(F)F)[nH]cc1Nc1cc(F)c([O-])c(Cl)c1 ZINC001214482641 1056551627 /nfs/dbraw/zinc/55/16/27/1056551627.db2.gz GJTZMCTUPDSWFQ-UHFFFAOYSA-N -1 1 322.645 4.048 20 0 DIADMM O=C(N[C@H](c1ccccc1)C1CCC1)c1cc(Cl)ccc1[O-] ZINC001585424494 1056552449 /nfs/dbraw/zinc/55/24/49/1056552449.db2.gz ZGAKUGYXNJABGI-QGZVFWFLSA-N -1 1 315.800 4.317 20 0 DIADMM Cc1cc(C)cc([C@H](C)NC(=O)Cc2ccc([O-])c(Cl)c2)c1 ZINC001585476017 1056561310 /nfs/dbraw/zinc/56/13/10/1056561310.db2.gz WCENTLQTIXPLQF-ZDUSSCGKSA-N -1 1 317.816 4.082 20 0 DIADMM O=S(=O)([N-]c1cccc2ccccc21)c1ccc2c(c1)CCC2 ZINC000007053594 1056565093 /nfs/dbraw/zinc/56/50/93/1056565093.db2.gz UHQIJZRZGJQIKR-UHFFFAOYSA-N -1 1 323.417 4.129 20 0 DIADMM COc1ccc(CCCC(=O)Nc2ccc([O-])c(Cl)c2)cc1 ZINC000111667024 1056588455 /nfs/dbraw/zinc/58/84/55/1056588455.db2.gz PPJOQRSCEQGGNS-UHFFFAOYSA-N -1 1 319.788 4.016 20 0 DIADMM CC(C)Sc1ccc(Cl)cc1NC(=O)c1ccc([O-])cn1 ZINC001585631357 1056597344 /nfs/dbraw/zinc/59/73/44/1056597344.db2.gz JEWDJUCJZMAEBK-UHFFFAOYSA-N -1 1 322.817 4.193 20 0 DIADMM Cc1cc(O)ccc1-c1ccc([C@H](C)[N-]C(=O)C(F)(F)F)cc1 ZINC001240645583 1056623300 /nfs/dbraw/zinc/62/33/00/1056623300.db2.gz RWJNRXYFBCFRTE-NSHDSACASA-N -1 1 323.314 4.107 20 0 DIADMM CCOC(=O)c1nc2cc(-c3cccc(C(F)F)c3)ccc2[n-]1 ZINC001240692777 1056643715 /nfs/dbraw/zinc/64/37/15/1056643715.db2.gz KMZPXRPCBLIKCM-UHFFFAOYSA-N -1 1 316.307 4.344 20 0 DIADMM CCOC(=O)c1nc2ccc(-c3cccc(C(F)F)c3)cc2[n-]1 ZINC001240692777 1056643724 /nfs/dbraw/zinc/64/37/24/1056643724.db2.gz KMZPXRPCBLIKCM-UHFFFAOYSA-N -1 1 316.307 4.344 20 0 DIADMM [O-]c1ccc(F)cc1-c1nc2ccccc2nc1C(F)(F)F ZINC001240693411 1056645359 /nfs/dbraw/zinc/64/53/59/1056645359.db2.gz APMDTJFITGXOSB-UHFFFAOYSA-N -1 1 308.234 4.160 20 0 DIADMM C[C@H]1CCc2c(sc3ncnc(-c4cc(F)ccc4[O-])c23)C1 ZINC001240693273 1056645782 /nfs/dbraw/zinc/64/57/82/1056645782.db2.gz KMGIZNQYAKEJMP-VIFPVBQESA-N -1 1 314.385 4.328 20 0 DIADMM [O-]c1ccc(F)cc1-c1ncnc2cc(OC(F)(F)F)ccc21 ZINC001240694030 1056645845 /nfs/dbraw/zinc/64/58/45/1056645845.db2.gz MVTPGIPRTSRTCS-UHFFFAOYSA-N -1 1 324.233 4.040 20 0 DIADMM [O-]c1ccc(F)cc1-c1ncnc2c(-c3ccccc3)nsc21 ZINC001240696044 1056647335 /nfs/dbraw/zinc/64/73/35/1056647335.db2.gz XGYWAQVRHGXXDN-UHFFFAOYSA-N -1 1 323.352 4.265 20 0 DIADMM Cc1nc2sc3c(c2c(-c2cc(F)ccc2[O-])n1)CCC3 ZINC001240696002 1056647376 /nfs/dbraw/zinc/64/73/76/1056647376.db2.gz VSDJWJUPASJISO-UHFFFAOYSA-N -1 1 300.358 4.000 20 0 DIADMM [O-]c1ccc(-c2nccc(-c3c[nH]c4ccccc43)n2)cc1F ZINC001240782383 1056695147 /nfs/dbraw/zinc/69/51/47/1056695147.db2.gz YMJFBMGASKLOMG-UHFFFAOYSA-N -1 1 305.312 4.137 20 0 DIADMM [O-]c1ccc(-c2cc3c(nn2)-c2ccccc2CCC3)cc1F ZINC001240782742 1056696172 /nfs/dbraw/zinc/69/61/72/1056696172.db2.gz HITIFAYICAYDNQ-UHFFFAOYSA-N -1 1 306.340 4.144 20 0 DIADMM [O-]c1ccc(-c2cc(SCc3ccccc3)ncn2)cc1F ZINC001240786468 1056697038 /nfs/dbraw/zinc/69/70/38/1056697038.db2.gz URHUBYHBPKZJBP-UHFFFAOYSA-N -1 1 312.369 4.281 20 0 DIADMM COC(=O)c1cc(C)ccc1Nc1cc(F)c([O-])c(Cl)c1 ZINC001214490591 1056713061 /nfs/dbraw/zinc/71/30/61/1056713061.db2.gz YHJWSKUHFHZACN-UHFFFAOYSA-N -1 1 309.724 4.023 20 0 DIADMM CCC(CC)[C@H](NC(=O)c1c([O-])cccc1F)c1ccccc1 ZINC001586620488 1056767749 /nfs/dbraw/zinc/76/77/49/1056767749.db2.gz XYZABQGIYMTLIS-SFHVURJKSA-N -1 1 315.388 4.439 20 0 DIADMM CCC(CC)[C@@H](NC(=O)c1ccc([O-])cc1F)c1ccccc1 ZINC001586619860 1056768337 /nfs/dbraw/zinc/76/83/37/1056768337.db2.gz OLZAYEMAZUYIEL-GOSISDBHSA-N -1 1 315.388 4.439 20 0 DIADMM CC(C)[C@@H](c1ccccc1)N(C)C(=O)c1ccc(F)c([O-])c1 ZINC001617064936 1056770572 /nfs/dbraw/zinc/77/05/72/1056770572.db2.gz DYBMZROCKKXGIB-KRWDZBQOSA-N -1 1 301.361 4.001 20 0 DIADMM Cc1cccc([C@H](C)NC(=O)c2cc(Cl)ccc2[O-])c1C ZINC001617074076 1056771778 /nfs/dbraw/zinc/77/17/78/1056771778.db2.gz SKJFWLLOTMFGBS-LBPRGKRZSA-N -1 1 303.789 4.153 20 0 DIADMM CC[C@@H](NC(=O)c1ccc(F)c([O-])c1)C(C)(C)c1ccccc1 ZINC001586671670 1056779266 /nfs/dbraw/zinc/77/92/66/1056779266.db2.gz PLBROZLSFWASNV-QGZVFWFLSA-N -1 1 315.388 4.018 20 0 DIADMM [O-]c1cc(Cl)c(Nc2cc(F)cc(F)c2O)cc1Cl ZINC001212487204 1056817940 /nfs/dbraw/zinc/81/79/40/1056817940.db2.gz BFUCIPROOJEXPJ-UHFFFAOYSA-N -1 1 306.095 4.426 20 0 DIADMM O=C(N[C@@H]1CC[C@@H]2CCC[C@H]2C1)c1cc2ccccc2cc1[O-] ZINC001617426309 1056830716 /nfs/dbraw/zinc/83/07/16/1056830716.db2.gz OWQVKLJOTMIMRF-GRDNDAEWSA-N -1 1 309.409 4.244 20 0 DIADMM O=C(N[C@@H]1CC[C@@H]2CCC[C@H]2C1)c1ccc2ccccc2c1[O-] ZINC001617425273 1056831175 /nfs/dbraw/zinc/83/11/75/1056831175.db2.gz HLAKSSRNHJHZSU-CWRNSKLLSA-N -1 1 309.409 4.244 20 0 DIADMM Cc1c(NC(=O)c2ccc([O-])c(F)c2)cccc1C(F)(F)F ZINC000681056429 1056846796 /nfs/dbraw/zinc/84/67/96/1056846796.db2.gz QHSQDUGACOVWGC-UHFFFAOYSA-N -1 1 313.250 4.111 20 0 DIADMM O=C(Nc1ccc(-c2ccccc2)cc1)c1cccc([O-])c1F ZINC001587001854 1056848209 /nfs/dbraw/zinc/84/82/09/1056848209.db2.gz XFNCQSYJJXXDKP-UHFFFAOYSA-N -1 1 307.324 4.451 20 0 DIADMM C[C@@H](CN(C)C(=O)c1ccc(Cl)cc1[O-])C1CCCCC1 ZINC001587021262 1056851215 /nfs/dbraw/zinc/85/12/15/1056851215.db2.gz JUAZDUYIXWSRPD-LBPRGKRZSA-N -1 1 309.837 4.334 20 0 DIADMM CSc1ccc2ncnc(-c3c(F)cc([O-])cc3F)c2c1 ZINC001241118421 1056904081 /nfs/dbraw/zinc/90/40/81/1056904081.db2.gz DUHUMEUJBNOSDL-UHFFFAOYSA-N -1 1 304.321 4.003 20 0 DIADMM CSc1ccc(C(F)(F)F)nc1-c1c(F)cc([O-])cc1F ZINC001241117971 1056905202 /nfs/dbraw/zinc/90/52/02/1056905202.db2.gz AIOMKYQAIIOSON-UHFFFAOYSA-N -1 1 321.270 4.473 20 0 DIADMM [O-]c1cc(F)c(-c2ncccc2OCc2ccccc2)c(F)c1 ZINC001241119098 1056905455 /nfs/dbraw/zinc/90/54/55/1056905455.db2.gz FKZRIOPXOMQLTF-UHFFFAOYSA-N -1 1 313.303 4.311 20 0 DIADMM CC(C)(C)OC(=O)Nc1ccc(-c2c(F)cc([O-])cc2F)cn1 ZINC001241122839 1056906311 /nfs/dbraw/zinc/90/63/11/1056906311.db2.gz NTHZQHLXMKHJMY-UHFFFAOYSA-N -1 1 322.311 4.079 20 0 DIADMM COc1ccc(C(F)(F)F)cc1-c1c(F)cc([O-])cc1F ZINC001241120569 1056907048 /nfs/dbraw/zinc/90/70/48/1056907048.db2.gz ATGFCCBRRDLQSB-UHFFFAOYSA-N -1 1 304.214 4.365 20 0 DIADMM COc1ncc(-c2ccccc2)cc1-c1c(F)cc([O-])cc1F ZINC001241124435 1056908648 /nfs/dbraw/zinc/90/86/48/1056908648.db2.gz FVMSIDBFNBJCRV-UHFFFAOYSA-N -1 1 313.303 4.408 20 0 DIADMM COC(=O)[C@H](c1ccc(-c2c(F)cc([O-])cc2F)cc1)C(C)C ZINC001241123219 1056908962 /nfs/dbraw/zinc/90/89/62/1056908962.db2.gz WFFBWGNESIPGFD-INIZCTEOSA-N -1 1 320.335 4.250 20 0 DIADMM CC(C)c1ccc(C(=O)Nc2nc3ccsc3s2)c([O-])c1 ZINC001618159621 1056928738 /nfs/dbraw/zinc/92/87/38/1056928738.db2.gz UJGNUHICYJDGRS-UHFFFAOYSA-N -1 1 318.423 4.439 20 0 DIADMM [O-]c1cc(F)cc(-c2nccc(-c3c[nH]c4ccccc43)n2)c1 ZINC001241256481 1056983269 /nfs/dbraw/zinc/98/32/69/1056983269.db2.gz WUIHPAUNXJGQNH-UHFFFAOYSA-N -1 1 305.312 4.137 20 0 DIADMM [O-]c1cc(F)cc(-c2nccc(SCc3ccccc3)n2)c1 ZINC001241261460 1056985396 /nfs/dbraw/zinc/98/53/96/1056985396.db2.gz OSRHMKJROYYQQT-UHFFFAOYSA-N -1 1 312.369 4.281 20 0 DIADMM Cc1nc2c3ccccc3oc2c(-c2c(F)ccc([O-])c2F)n1 ZINC001241288966 1056998403 /nfs/dbraw/zinc/99/84/03/1056998403.db2.gz DDEMNWGPEWBOIC-UHFFFAOYSA-N -1 1 312.275 4.335 20 0 DIADMM CC(C)(C)OC(=O)Nc1ccc(-c2c(F)ccc([O-])c2F)nc1 ZINC001241290006 1056998853 /nfs/dbraw/zinc/99/88/53/1056998853.db2.gz IXQGGXCJRHZODP-UHFFFAOYSA-N -1 1 322.311 4.079 20 0 DIADMM Cc1nc(-c2c(F)ccc([O-])c2F)cc(C2CCCCC2)n1 ZINC001241288922 1056999041 /nfs/dbraw/zinc/99/90/41/1056999041.db2.gz BJXKAFGSGDHOCS-UHFFFAOYSA-N -1 1 304.340 4.484 20 0 DIADMM [O-]c1ccc(F)c(-c2ncnc3sc4c(c32)CCCC4)c1F ZINC001241291171 1056999557 /nfs/dbraw/zinc/99/95/57/1056999557.db2.gz HKZIKJVZVIZGNX-UHFFFAOYSA-N -1 1 318.348 4.221 20 0 DIADMM [O-]c1ccc(F)c(-c2nccc(-c3c[nH]c4ccccc43)n2)c1F ZINC001241291155 1057000197 /nfs/dbraw/zinc/00/01/97/1057000197.db2.gz GNOXMYQJSKLRHU-UHFFFAOYSA-N -1 1 323.302 4.276 20 0 DIADMM O=C(/C=C/c1ccccc1Cl)Nc1ccc([O-])c(Cl)c1 ZINC000701177047 1057246063 /nfs/dbraw/zinc/24/60/63/1057246063.db2.gz RROHIQWVEIWZLV-VMPITWQZSA-N -1 1 308.164 4.351 20 0 DIADMM [O-]c1ccc(C(F)(F)F)cc1-c1ncccc1C(F)(F)F ZINC001242126442 1057270941 /nfs/dbraw/zinc/27/09/41/1057270941.db2.gz LFNVTELDBRJNEH-UHFFFAOYSA-N -1 1 307.193 4.492 20 0 DIADMM Cc1cc(-c2cc(C(F)(F)F)ccc2[O-])nc(C(F)(F)F)n1 ZINC001242126186 1057271017 /nfs/dbraw/zinc/27/10/17/1057271017.db2.gz JFZZRKNNQGVREC-UHFFFAOYSA-N -1 1 322.208 4.195 20 0 DIADMM Cc1cc(-c2ccc([C@H](C)[N-]C(=O)C(F)(F)F)cc2)ccc1O ZINC001242126782 1057271603 /nfs/dbraw/zinc/27/16/03/1057271603.db2.gz QWYMBKIACWEIBY-NSHDSACASA-N -1 1 323.314 4.107 20 0 DIADMM [O-]c1ccc(C(F)(F)F)cc1-c1ncnc2c(F)cccc21 ZINC001242131365 1057273823 /nfs/dbraw/zinc/27/38/23/1057273823.db2.gz IKUHFHCXVOGXBE-UHFFFAOYSA-N -1 1 308.234 4.160 20 0 DIADMM Cc1cc2ncccc2nc1-c1cc(C(F)(F)F)ccc1[O-] ZINC001242134284 1057274552 /nfs/dbraw/zinc/27/45/52/1057274552.db2.gz WWEFXNMVBTWHLJ-UHFFFAOYSA-N -1 1 304.271 4.330 20 0 DIADMM [O-]c1ccc(C(F)(F)F)cc1-c1ncccc1C1CCOCC1 ZINC001242133438 1057274654 /nfs/dbraw/zinc/27/46/54/1057274654.db2.gz HKMQVMIFACDCFZ-UHFFFAOYSA-N -1 1 323.314 4.367 20 0 DIADMM CSc1ccnc(-c2cc(C(F)(F)F)ccc2[O-])c1F ZINC001242132612 1057274968 /nfs/dbraw/zinc/27/49/68/1057274968.db2.gz WDDIXBQUXNMPJL-UHFFFAOYSA-N -1 1 303.280 4.334 20 0 DIADMM CC[C@H](C)Oc1nccnc1-c1cc(C(F)(F)F)ccc1[O-] ZINC001242133013 1057275076 /nfs/dbraw/zinc/27/50/76/1057275076.db2.gz AXWFITUPAYPMRW-VIFPVBQESA-N -1 1 312.291 4.045 20 0 DIADMM [O-]c1ccc(-c2cc(C(F)(F)F)ccn2)cc1C(F)(F)F ZINC001242148418 1057280172 /nfs/dbraw/zinc/28/01/72/1057280172.db2.gz XOASEGQBCYYQCU-UHFFFAOYSA-N -1 1 307.193 4.492 20 0 DIADMM Cc1nc2ccc(F)cc2c(-c2ccc([O-])c(C(F)(F)F)c2)n1 ZINC001242151842 1057280679 /nfs/dbraw/zinc/28/06/79/1057280679.db2.gz VQBWIFCXTLOXCQ-UHFFFAOYSA-N -1 1 322.261 4.469 20 0 DIADMM CSc1ccnc(-c2ccc([O-])c(C(F)(F)F)c2)c1F ZINC001242152336 1057282028 /nfs/dbraw/zinc/28/20/28/1057282028.db2.gz DAXPHQHVTLQPRX-UHFFFAOYSA-N -1 1 303.280 4.334 20 0 DIADMM CC(C)c1nc2[nH]ccc2c(-c2ccc([O-])c(C(F)(F)F)c2)n1 ZINC001242156957 1057283080 /nfs/dbraw/zinc/28/30/80/1057283080.db2.gz ACFRTVKMGSXBJI-UHFFFAOYSA-N -1 1 321.302 4.424 20 0 DIADMM [O-]c1ccc(-c2cnccc2C(F)(F)F)cc1C(F)(F)F ZINC001242157462 1057283689 /nfs/dbraw/zinc/28/36/89/1057283689.db2.gz GQFYPEVQPLHZKK-UHFFFAOYSA-N -1 1 307.193 4.492 20 0 DIADMM Cc1nc(C2CC2)nc(-c2ccc([O-])c(C(F)(F)F)c2)c1F ZINC001242157836 1057283881 /nfs/dbraw/zinc/28/38/81/1057283881.db2.gz NZAHQPIAQJZETH-UHFFFAOYSA-N -1 1 312.266 4.193 20 0 DIADMM Cn1cccc1-c1ccc(-c2ccc([O-])c(C(F)(F)F)c2)nc1 ZINC001242158333 1057284230 /nfs/dbraw/zinc/28/42/30/1057284230.db2.gz YWCGUXWCXQHSEC-UHFFFAOYSA-N -1 1 318.298 4.479 20 0 DIADMM COC(=O)c1ccc(-c2ccc(F)cc2[O-])c(C(F)(F)F)c1 ZINC001242218237 1057297081 /nfs/dbraw/zinc/29/70/81/1057297081.db2.gz YMJZUNPICBGCKT-UHFFFAOYSA-N -1 1 314.234 4.004 20 0 DIADMM COc1ccc(OC(F)(F)F)c(-c2ccc(F)cc2[O-])c1 ZINC001242219247 1057297989 /nfs/dbraw/zinc/29/79/89/1057297989.db2.gz PASYKMMNZNNESQ-UHFFFAOYSA-N -1 1 302.223 4.106 20 0 DIADMM [O-]c1cc(F)ccc1-c1ccc(O[C@H]2CCCCO2)cc1F ZINC001242219895 1057298054 /nfs/dbraw/zinc/29/80/54/1057298054.db2.gz WGGSVXVCZJITLS-KRWDZBQOSA-N -1 1 306.308 4.243 20 0 DIADMM COC(=O)c1ccc(-c2cccc(F)c2[O-])c(C(F)(F)F)c1 ZINC001242350729 1057342928 /nfs/dbraw/zinc/34/29/28/1057342928.db2.gz JFEVAFKHMXIBBE-UHFFFAOYSA-N -1 1 314.234 4.004 20 0 DIADMM COC(=O)C(C)(C)c1cccc(-c2cccc(Cl)c2[O-])c1 ZINC001242364499 1057346440 /nfs/dbraw/zinc/34/64/40/1057346440.db2.gz LBNYDPXFACWNRC-UHFFFAOYSA-N -1 1 304.773 4.163 20 0 DIADMM COC(=O)c1ccc(-c2cccc(Cl)c2[O-])c2cccnc12 ZINC001242366068 1057347436 /nfs/dbraw/zinc/34/74/36/1057347436.db2.gz FVJCODDTCOZJSH-UHFFFAOYSA-N -1 1 313.740 4.047 20 0 DIADMM CCOC(=O)c1cc2cc(-c3cccc(Cl)c3[O-])ccc2[nH]1 ZINC001242365385 1057347560 /nfs/dbraw/zinc/34/75/60/1057347560.db2.gz MOCXZAQFJMVMMZ-UHFFFAOYSA-N -1 1 315.756 4.371 20 0 DIADMM CN1C(=O)CC(C)(C)c2ccc(-c3cccc(Cl)c3[O-])cc21 ZINC001242368247 1057348733 /nfs/dbraw/zinc/34/87/33/1057348733.db2.gz VYYCZKLZSNMINA-UHFFFAOYSA-N -1 1 315.800 4.357 20 0 DIADMM COC(=O)C1(c2ccc(-c3cccc(Cl)c3[O-])cc2)CCC1 ZINC001242367056 1057349068 /nfs/dbraw/zinc/34/90/68/1057349068.db2.gz HQTXMYQOYSMMOX-UHFFFAOYSA-N -1 1 316.784 4.307 20 0 DIADMM CC[C@H](C(=O)OC)c1ccc(-c2cccc(Cl)c2[O-])cc1 ZINC001242367462 1057349160 /nfs/dbraw/zinc/34/91/60/1057349160.db2.gz NJNYIGIVGJNWSR-ZDUSSCGKSA-N -1 1 304.773 4.379 20 0 DIADMM O=C(Nc1ccc(F)cc1[O-])c1ccc(-c2ccco2)s1 ZINC000676055782 1057444747 /nfs/dbraw/zinc/44/47/47/1057444747.db2.gz OECWYDGEVDFTLB-UHFFFAOYSA-N -1 1 303.314 4.105 20 0 DIADMM [O-]c1cccc(-c2nccc(OCc3ccccc3)n2)c1Cl ZINC001242798395 1057479898 /nfs/dbraw/zinc/47/98/98/1057479898.db2.gz VHLGIIDWTKNHPI-UHFFFAOYSA-N -1 1 312.756 4.082 20 0 DIADMM [O-]c1cccc(-c2cncc(OCC3CCCC3)n2)c1Cl ZINC001242799372 1057480785 /nfs/dbraw/zinc/48/07/85/1057480785.db2.gz HTJFNFHKIUEPBY-UHFFFAOYSA-N -1 1 304.777 4.072 20 0 DIADMM COC(=O)c1ccc2ccnc(-c3cccc([O-])c3Cl)c2c1 ZINC001242798761 1057480829 /nfs/dbraw/zinc/48/08/29/1057480829.db2.gz YJRSJGUVQDQKBP-UHFFFAOYSA-N -1 1 313.740 4.047 20 0 DIADMM COC(=O)c1nc2ccc(-c3cccc([O-])c3Cl)cc2s1 ZINC001242800143 1057480903 /nfs/dbraw/zinc/48/09/03/1057480903.db2.gz CNVLRPFMXHITLU-UHFFFAOYSA-N -1 1 319.769 4.109 20 0 DIADMM COc1ccc(-c2cnc(-c3cccc([O-])c3Cl)nc2)cc1 ZINC001242798641 1057481021 /nfs/dbraw/zinc/48/10/21/1057481021.db2.gz NODFAQKAHITWDH-UHFFFAOYSA-N -1 1 312.756 4.178 20 0 DIADMM CC(C)(C)c1nc2[nH]ccc2c(-c2cccc([O-])c2Cl)n1 ZINC001242799886 1057481121 /nfs/dbraw/zinc/48/11/21/1057481121.db2.gz AAMBULYFESSZJF-UHFFFAOYSA-N -1 1 301.777 4.233 20 0 DIADMM [O-]c1cccc(-c2ccc(-c3cccc(F)c3)nn2)c1Cl ZINC001242801497 1057481791 /nfs/dbraw/zinc/48/17/91/1057481791.db2.gz RXSWRBMNFWUXRM-UHFFFAOYSA-N -1 1 300.720 4.309 20 0 DIADMM [O-]c1cccc(-c2nnc3c(c2C(F)(F)F)CCC3)c1Cl ZINC001242800383 1057481816 /nfs/dbraw/zinc/48/18/16/1057481816.db2.gz GKYJCWMJXLWERV-UHFFFAOYSA-N -1 1 314.694 4.010 20 0 DIADMM [O-]c1cccc(-c2ncc3c(n2)-c2ccccc2CC3)c1Cl ZINC001242800868 1057481843 /nfs/dbraw/zinc/48/18/43/1057481843.db2.gz LJEZWMIWENWRJX-UHFFFAOYSA-N -1 1 308.768 4.268 20 0 DIADMM COC(=O)c1ccc(-c2cccc([O-])c2Cl)c2cccnc12 ZINC001242801146 1057481885 /nfs/dbraw/zinc/48/18/85/1057481885.db2.gz TXFCOKKUXFSCLS-UHFFFAOYSA-N -1 1 313.740 4.047 20 0 DIADMM O=C(c1ccc(-c2cccc([O-])c2Cl)cc1)N1CCCCC1 ZINC001242800416 1057482140 /nfs/dbraw/zinc/48/21/40/1057482140.db2.gz IHJOQAALBPIUDL-UHFFFAOYSA-N -1 1 315.800 4.339 20 0 DIADMM COC(=O)c1cc2ccccc2c(-c2cccc([O-])c2Cl)n1 ZINC001242801786 1057482879 /nfs/dbraw/zinc/48/28/79/1057482879.db2.gz ZCGIAPZHGNGUAD-UHFFFAOYSA-N -1 1 313.740 4.047 20 0 DIADMM CC(=O)Oc1c[nH]c2cc(-c3cccc([O-])c3Cl)ccc12 ZINC001242802581 1057482999 /nfs/dbraw/zinc/48/29/99/1057482999.db2.gz LWXDSODDJOMGSL-UHFFFAOYSA-N -1 1 301.729 4.119 20 0 DIADMM CC1(C)Cc2c(cccc2-c2cccc([O-])c2Cl)NC1=O ZINC001242803047 1057483011 /nfs/dbraw/zinc/48/30/11/1057483011.db2.gz LNQYQIYQEJNOPR-UHFFFAOYSA-N -1 1 301.773 4.233 20 0 DIADMM COC(=O)CCCc1ccc(-c2cccc([O-])c2Cl)cc1 ZINC001242802153 1057483071 /nfs/dbraw/zinc/48/30/71/1057483071.db2.gz TVADFKQBUVMJFA-UHFFFAOYSA-N -1 1 304.773 4.208 20 0 DIADMM [O-]c1cccc(-c2cnc(OCc3ccccc3)nc2)c1Cl ZINC001242802693 1057483252 /nfs/dbraw/zinc/48/32/52/1057483252.db2.gz OLISPKRKTSQXEF-UHFFFAOYSA-N -1 1 312.756 4.082 20 0 DIADMM CCOC(=O)c1nc2cc(-c3c(C)cccc3CC)ccc2[n-]1 ZINC001242817780 1057490919 /nfs/dbraw/zinc/49/09/19/1057490919.db2.gz CYTXWOKFHDLCLO-UHFFFAOYSA-N -1 1 308.381 4.277 20 0 DIADMM CCOC(=O)c1nc2ccc(-c3c(C)cccc3CC)cc2[n-]1 ZINC001242817780 1057490922 /nfs/dbraw/zinc/49/09/22/1057490922.db2.gz CYTXWOKFHDLCLO-UHFFFAOYSA-N -1 1 308.381 4.277 20 0 DIADMM COc1cc2[nH]cnc2cc1-c1cc(Cl)c([O-])c(Cl)c1 ZINC001242853045 1057499547 /nfs/dbraw/zinc/49/95/47/1057499547.db2.gz DVPPHEYVGXRPFV-UHFFFAOYSA-N -1 1 309.152 4.251 20 0 DIADMM Cc1cn(C2CCCCC2)nc1NCc1cccc([O-])c1Cl ZINC000645172023 1057544647 /nfs/dbraw/zinc/54/46/47/1057544647.db2.gz YQRXZTNHAKVURG-UHFFFAOYSA-N -1 1 319.836 4.668 20 0 DIADMM Cc1ccc(Oc2nc(-c3ccc(F)c([O-])c3)ncc2F)cc1 ZINC001243048575 1057557210 /nfs/dbraw/zinc/55/72/10/1057557210.db2.gz GKLZAEUBVHHONQ-UHFFFAOYSA-N -1 1 314.291 4.228 20 0 DIADMM Cc1cccc(Oc2nc(-c3ccc(F)c([O-])c3)ncc2F)c1 ZINC001243050716 1057558689 /nfs/dbraw/zinc/55/86/89/1057558689.db2.gz RQOJMZBCAAKVFW-UHFFFAOYSA-N -1 1 314.291 4.228 20 0 DIADMM O=C([O-])c1ccc(-c2cc3nc[nH]c3cc2F)cc1C(F)(F)F ZINC001243160514 1057590033 /nfs/dbraw/zinc/59/00/33/1057590033.db2.gz CRLAVOJBXLLBCD-UHFFFAOYSA-N -1 1 324.233 4.086 20 0 DIADMM Cc1cc(C(=O)[O-])ccc1-c1cccc2nc(C(F)(F)F)[nH]c21 ZINC001243212741 1057606913 /nfs/dbraw/zinc/60/69/13/1057606913.db2.gz LEMFNDOVFGBTIM-UHFFFAOYSA-N -1 1 320.270 4.255 20 0 DIADMM [O-]c1ccc(-c2ccc(-c3nc4ccccc4[nH]3)cn2)c(F)c1F ZINC001243338346 1057651153 /nfs/dbraw/zinc/65/11/53/1057651153.db2.gz DZLDOAPWMUSXJF-UHFFFAOYSA-N -1 1 323.302 4.276 20 0 DIADMM C[C@@H]1CCCCN1c1cccc(-c2ccc([O-])c(F)c2F)n1 ZINC001243338922 1057651871 /nfs/dbraw/zinc/65/18/71/1057651871.db2.gz KTNRORAWERMSNE-LLVKDONJSA-N -1 1 304.340 4.111 20 0 DIADMM COc1ccc2nc(C)cc(-c3ccc([O-])c(F)c3F)c2c1 ZINC001243341635 1057652928 /nfs/dbraw/zinc/65/29/28/1057652928.db2.gz VZSFMMDMBQKSQF-UHFFFAOYSA-N -1 1 301.292 4.203 20 0 DIADMM CC(C)(C)OC(=O)Nc1cccc(-c2ccc([O-])c(F)c2F)n1 ZINC001243343168 1057653729 /nfs/dbraw/zinc/65/37/29/1057653729.db2.gz XZXLVHZKLAYKOS-UHFFFAOYSA-N -1 1 322.311 4.079 20 0 DIADMM CC(C)(C)OC(=O)Cc1cccc(-c2ccc([O-])c(F)c2F)c1 ZINC001243343542 1057653989 /nfs/dbraw/zinc/65/39/89/1057653989.db2.gz GWVNMIZTDRXDNL-UHFFFAOYSA-N -1 1 320.335 4.222 20 0 DIADMM CCOC(=O)C(C)(C)c1ccc(-c2ccc([O-])c(F)c2F)cc1 ZINC001243343393 1057654008 /nfs/dbraw/zinc/65/40/08/1057654008.db2.gz AUGNRSAJWQXCIR-UHFFFAOYSA-N -1 1 320.335 4.178 20 0 DIADMM CCC[C@@H](Cc1ccccc1)NC(=O)c1c([O-])cccc1Cl ZINC000727860696 1057678798 /nfs/dbraw/zinc/67/87/98/1057678798.db2.gz GKUPMJVRLLQJKM-AWEZNQCLSA-N -1 1 317.816 4.187 20 0 DIADMM COc1cc(-c2cc(F)cc(F)c2[O-])cc(C(F)(F)F)c1 ZINC001243504039 1057696741 /nfs/dbraw/zinc/69/67/41/1057696741.db2.gz XNDRBGCCZOFAJV-UHFFFAOYSA-N -1 1 304.214 4.365 20 0 DIADMM [O-]c1c(F)cc(F)cc1-c1cnc2[nH]c(-c3ccccc3)nc2c1 ZINC001243502289 1057696936 /nfs/dbraw/zinc/69/69/36/1057696936.db2.gz JVXSIGOHBGRAEH-UHFFFAOYSA-N -1 1 323.302 4.276 20 0 DIADMM COC(=O)c1cc2cc(-c3cc(F)cc(F)c3[O-])ccc2s1 ZINC001243504133 1057696964 /nfs/dbraw/zinc/69/69/64/1057696964.db2.gz YUVPJDBDYXYXRK-UHFFFAOYSA-N -1 1 320.316 4.339 20 0 DIADMM CCOC(=O)CCCc1cccc(-c2cc(F)cc(F)c2[O-])c1 ZINC001243505552 1057697582 /nfs/dbraw/zinc/69/75/82/1057697582.db2.gz SKHYRLNNQJNNMB-UHFFFAOYSA-N -1 1 320.335 4.223 20 0 DIADMM [O-]c1c(F)cc(F)cc1-c1cncc(-c2nc3ccccc3[nH]2)c1 ZINC001243505573 1057697882 /nfs/dbraw/zinc/69/78/82/1057697882.db2.gz UNFFHJWDCXIESL-UHFFFAOYSA-N -1 1 323.302 4.276 20 0 DIADMM CSc1ncc2cc(-c3cc(F)cc(F)c3[O-])ccc2n1 ZINC001243504631 1057697899 /nfs/dbraw/zinc/69/78/99/1057697899.db2.gz NMQPXFMIWZRTOA-UHFFFAOYSA-N -1 1 304.321 4.003 20 0 DIADMM [O-]c1c(F)cc(F)cc1-c1ccnc(C2(C(F)(F)F)CC2)c1 ZINC001243505590 1057697902 /nfs/dbraw/zinc/69/79/02/1057697902.db2.gz IDFQNSZMYFBYJA-UHFFFAOYSA-N -1 1 315.241 4.326 20 0 DIADMM Cn1cc(-c2ccnc(-c3cccc([O-])c3F)n2)c2ccccc21 ZINC001243541125 1057708409 /nfs/dbraw/zinc/70/84/09/1057708409.db2.gz DZTUHAGYKSVENU-UHFFFAOYSA-N -1 1 319.339 4.147 20 0 DIADMM [O-]c1cccc(-c2ncc(F)c(Oc3ccccc3F)n2)c1F ZINC001243546403 1057709230 /nfs/dbraw/zinc/70/92/30/1057709230.db2.gz LWYISSSROGOSDA-UHFFFAOYSA-N -1 1 318.254 4.059 20 0 DIADMM Cc1cc(C)cc([C@@H](C)NC(=O)c2c([O-])cccc2Cl)c1 ZINC000730591715 1057718834 /nfs/dbraw/zinc/71/88/34/1057718834.db2.gz BVLTVMAMPHTXLN-GFCCVEGCSA-N -1 1 303.789 4.153 20 0 DIADMM CSc1nc2ccnc(-c3ccc(Cl)c([O-])c3)c2s1 ZINC001243576466 1057720690 /nfs/dbraw/zinc/72/06/90/1057720690.db2.gz HMLCOTJMBKVQDL-UHFFFAOYSA-N -1 1 308.815 4.439 20 0 DIADMM COc1cc(F)cc2ccc(-c3ccc(Cl)c([O-])c3)nc21 ZINC001243578134 1057721390 /nfs/dbraw/zinc/72/13/90/1057721390.db2.gz BEBTWOTYDRKEFA-UHFFFAOYSA-N -1 1 303.720 4.409 20 0 DIADMM Cc1cc(N2CCCCC2)ncc1-c1ccc(Cl)c([O-])c1 ZINC001243578412 1057721417 /nfs/dbraw/zinc/72/14/17/1057721417.db2.gz PGFKYXVBPYVPRK-UHFFFAOYSA-N -1 1 302.805 4.406 20 0 DIADMM [O-]c1cc(-c2cncc(-c3ccc(F)cc3)n2)ccc1Cl ZINC001243577902 1057721669 /nfs/dbraw/zinc/72/16/69/1057721669.db2.gz CINVCPUJCJGZOM-UHFFFAOYSA-N -1 1 300.720 4.309 20 0 DIADMM [O-]c1cc(-c2ccc3c(c2)C2(CN3)CCOCC2)ccc1Cl ZINC001243578798 1057722220 /nfs/dbraw/zinc/72/22/20/1057722220.db2.gz SDVZBNBLOXZNOX-UHFFFAOYSA-N -1 1 315.800 4.186 20 0 DIADMM [O-]c1cc(-c2ccc(-c3c(F)cccc3F)nn2)ccc1Cl ZINC001243579426 1057722589 /nfs/dbraw/zinc/72/25/89/1057722589.db2.gz ULSYDQSISJWZJM-UHFFFAOYSA-N -1 1 318.710 4.448 20 0 DIADMM COCCCOc1cc(-c2ccc(Cl)c([O-])c2)ccc1OC ZINC001243581062 1057723205 /nfs/dbraw/zinc/72/32/05/1057723205.db2.gz LKFVKXPJLVYEMN-UHFFFAOYSA-N -1 1 322.788 4.137 20 0 DIADMM CC(C)(C)OC(=O)Nc1cccc(-c2ccc(Cl)c([O-])c2)n1 ZINC001243581737 1057723231 /nfs/dbraw/zinc/72/32/31/1057723231.db2.gz SSJRRSRFMQLNAR-UHFFFAOYSA-N -1 1 320.776 4.455 20 0 DIADMM CC(C)(C)OC(=O)c1nc(F)ccc1-c1ccc(Cl)c([O-])c1 ZINC001243581484 1057723366 /nfs/dbraw/zinc/72/33/66/1057723366.db2.gz GNKXXPWPGOVKRW-UHFFFAOYSA-N -1 1 323.751 4.202 20 0 DIADMM O=C(c1cccc(-c2ccc(Cl)c([O-])c2)c1)N1CCCCC1 ZINC001243581327 1057723416 /nfs/dbraw/zinc/72/34/16/1057723416.db2.gz OOHWJEIGWCKGJP-UHFFFAOYSA-N -1 1 315.800 4.339 20 0 DIADMM COC(=O)c1ccc2cc(-c3ccc(Cl)c([O-])c3)ccc2n1 ZINC001243581709 1057723418 /nfs/dbraw/zinc/72/34/18/1057723418.db2.gz SDHVZWQHVACMOK-UHFFFAOYSA-N -1 1 313.740 4.047 20 0 DIADMM COC(=O)c1cc(-c2ccc(Cl)c([O-])c2)cc2cccnc21 ZINC001243582961 1057723830 /nfs/dbraw/zinc/72/38/30/1057723830.db2.gz GCLPSRVIZMMQIK-UHFFFAOYSA-N -1 1 313.740 4.047 20 0 DIADMM O=c1cc(-c2ccc(Cl)c([O-])c2)ccn1-c1ccccc1F ZINC001243582633 1057724066 /nfs/dbraw/zinc/72/40/66/1057724066.db2.gz BLQXKJYJJOJKNT-UHFFFAOYSA-N -1 1 315.731 4.003 20 0 DIADMM Cc1cc2c(ncnc2-c2ccc(C(F)(F)F)cc2[O-])s1 ZINC001243605076 1057730538 /nfs/dbraw/zinc/73/05/38/1057730538.db2.gz QPRKDLNPLLTPEN-UHFFFAOYSA-N -1 1 310.300 4.391 20 0 DIADMM [O-]c1cc(C(F)(F)F)ccc1-c1cccc(COCC2CC2)n1 ZINC001243604833 1057730558 /nfs/dbraw/zinc/73/05/58/1057730558.db2.gz BQMQVQQYKDTFEC-UHFFFAOYSA-N -1 1 323.314 4.400 20 0 DIADMM COc1ccc2ncc(-c3ccc(C(F)(F)F)cc3[O-])nc2c1 ZINC001243607703 1057731443 /nfs/dbraw/zinc/73/14/43/1057731443.db2.gz QKVJQJNTVCIKKA-UHFFFAOYSA-N -1 1 320.270 4.030 20 0 DIADMM Cc1ccc(-c2ccc(-c3ccc(C(F)(F)F)cc3[O-])nn2)o1 ZINC001243610877 1057733255 /nfs/dbraw/zinc/73/32/55/1057733255.db2.gz VUKYDWORPRYRSL-UHFFFAOYSA-N -1 1 320.270 4.436 20 0 DIADMM O=C(Nc1ccc([O-])c(Cl)c1)c1ccc(-n2cccc2)cc1 ZINC000732309822 1057772031 /nfs/dbraw/zinc/77/20/31/1057772031.db2.gz ZCZJNSRQXWMZKF-UHFFFAOYSA-N -1 1 312.756 4.089 20 0 DIADMM O=C1[N-]C(=O)C(=Cc2ccc(-c3ccc(Cl)cc3)s2)S1 ZINC000732579105 1057780859 /nfs/dbraw/zinc/78/08/59/1057780859.db2.gz AOFTXTKTQLTHCF-KPKJPENVSA-N -1 1 321.810 4.392 20 0 DIADMM C[C@H]1CN(C(=O)c2ccc3ccccc3c2[O-])Cc2ccccc21 ZINC000733303311 1057811176 /nfs/dbraw/zinc/81/11/76/1057811176.db2.gz MIDVNHDBZAVARS-AWEZNQCLSA-N -1 1 317.388 4.305 20 0 DIADMM CC[C@@H](C(=O)OC)c1ccc(-c2cc(F)c([O-])c(F)c2)cc1 ZINC001244097306 1057867857 /nfs/dbraw/zinc/86/78/57/1057867857.db2.gz OONJPFWSDQVIMV-CYBMUJFWSA-N -1 1 306.308 4.004 20 0 DIADMM COC(=O)[C@H](c1ccc(-c2cc(F)c([O-])c(F)c2)cc1)C(C)C ZINC001244097556 1057868265 /nfs/dbraw/zinc/86/82/65/1057868265.db2.gz QUZHMRCOFATIAV-INIZCTEOSA-N -1 1 320.335 4.250 20 0 DIADMM [O-]c1c(F)cc(-c2cccc(-c3ncc4ncccn43)c2)cc1F ZINC001244098388 1057868569 /nfs/dbraw/zinc/86/85/69/1057868569.db2.gz GVHBHZOPXBIYCL-UHFFFAOYSA-N -1 1 323.302 4.047 20 0 DIADMM COC(=O)c1ccc2ccc(-c3cc(F)c([O-])c(F)c3)cc2c1 ZINC001244098672 1057868791 /nfs/dbraw/zinc/86/87/91/1057868791.db2.gz PQIDPVOPXUATQP-UHFFFAOYSA-N -1 1 314.287 4.277 20 0 DIADMM CCOC(=O)c1nc2ccc(-c3c(F)cccc3C3CC3)cc2[n-]1 ZINC001244120036 1057875735 /nfs/dbraw/zinc/87/57/35/1057875735.db2.gz LJNGGBQSRAJXNK-UHFFFAOYSA-N -1 1 324.355 4.423 20 0 DIADMM CCOC(=O)c1nc2cc(-c3c(F)cccc3C3CC3)ccc2[n-]1 ZINC001244120036 1057875741 /nfs/dbraw/zinc/87/57/41/1057875741.db2.gz LJNGGBQSRAJXNK-UHFFFAOYSA-N -1 1 324.355 4.423 20 0 DIADMM Cc1ccc([O-])c(-c2nccc(-c3c[nH]c4ccccc43)n2)c1 ZINC001244402866 1057951266 /nfs/dbraw/zinc/95/12/66/1057951266.db2.gz NABSKJCLOIIPOM-UHFFFAOYSA-N -1 1 301.349 4.306 20 0 DIADMM CCOC(=O)c1nc2cc(-c3ccc(C)c(OCC)c3)ccc2[n-]1 ZINC001244442146 1057959140 /nfs/dbraw/zinc/95/91/40/1057959140.db2.gz DCMXPLUOYCAIDY-UHFFFAOYSA-N -1 1 324.380 4.114 20 0 DIADMM CCOC(=O)c1nc2ccc(-c3ccc(C)c(OCC)c3)cc2[n-]1 ZINC001244442146 1057959145 /nfs/dbraw/zinc/95/91/45/1057959145.db2.gz DCMXPLUOYCAIDY-UHFFFAOYSA-N -1 1 324.380 4.114 20 0 DIADMM Cc1cc2c(ccnc2-c2ccc(OC(F)(F)F)cc2[O-])o1 ZINC001244462837 1057965291 /nfs/dbraw/zinc/96/52/91/1057965291.db2.gz NFZBWUWGOGQJDN-UHFFFAOYSA-N -1 1 309.243 4.407 20 0 DIADMM O=c1c(-c2ccc(Cl)cc2[O-])cccn1-c1ccccc1F ZINC001244472193 1057969314 /nfs/dbraw/zinc/96/93/14/1057969314.db2.gz NMQSLBWNDDGLFZ-UHFFFAOYSA-N -1 1 315.731 4.003 20 0 DIADMM Cc1cc(-c2cc(OCC(F)(F)F)ccn2)cc(Cl)c1[O-] ZINC001244531159 1057987210 /nfs/dbraw/zinc/98/72/10/1057987210.db2.gz GVDTUGFUPLSZBW-UHFFFAOYSA-N -1 1 317.694 4.357 20 0 DIADMM Cc1cc(-c2cc(N)cc(C(F)(F)F)n2)cc(Cl)c1[O-] ZINC001244530780 1057987339 /nfs/dbraw/zinc/98/73/39/1057987339.db2.gz AEVSYCNWHBGOKR-UHFFFAOYSA-N -1 1 302.683 4.017 20 0 DIADMM COC(OC)c1cc(C)cnc1-c1cc(C)c([O-])c(Cl)c1 ZINC001244535767 1057988360 /nfs/dbraw/zinc/98/83/60/1057988360.db2.gz AGVQZEPVVAMIBP-UHFFFAOYSA-N -1 1 307.777 4.016 20 0 DIADMM Cc1ccc(-c2cnnc(-c3c(Cl)ccc([O-])c3F)n2)cc1 ZINC001244537319 1057988978 /nfs/dbraw/zinc/98/89/78/1057988978.db2.gz CBWTXNQHNXBBQC-UHFFFAOYSA-N -1 1 315.735 4.012 20 0 DIADMM CSc1ncc2ccc(-c3cc(C)c([O-])c(Cl)c3)nc2n1 ZINC001244537051 1057989031 /nfs/dbraw/zinc/98/90/31/1057989031.db2.gz TYHQHXWTBICMJP-UHFFFAOYSA-N -1 1 317.801 4.081 20 0 DIADMM Cc1cc(-c2cccc(Cc3ccncc3)n2)cc(Cl)c1[O-] ZINC001244538628 1057989578 /nfs/dbraw/zinc/98/95/78/1057989578.db2.gz OADIFQWSTHLZGW-UHFFFAOYSA-N -1 1 310.784 4.402 20 0 DIADMM Cc1cc(-c2ccc(COC3CCC3)cn2)cc(Cl)c1[O-] ZINC001244538696 1057989630 /nfs/dbraw/zinc/98/96/30/1057989630.db2.gz OSSPQOWZNHJXTQ-UHFFFAOYSA-N -1 1 303.789 4.485 20 0 DIADMM [O-]c1ccc(Cl)c(-c2nc(C(F)(F)F)ccc2F)c1F ZINC001244538127 1057989840 /nfs/dbraw/zinc/98/98/40/1057989840.db2.gz JPOJFCIHQUJFJW-UHFFFAOYSA-N -1 1 309.621 4.405 20 0 DIADMM COc1cccc2ccc(-c3c(Cl)ccc([O-])c3F)nc21 ZINC001244538909 1057989984 /nfs/dbraw/zinc/98/99/84/1057989984.db2.gz PWXRQIQYVFDFDI-UHFFFAOYSA-N -1 1 303.720 4.409 20 0 DIADMM [O-]c1ccc(Cl)c(-c2cc(Oc3ccccc3)ncn2)c1F ZINC001244537814 1057989995 /nfs/dbraw/zinc/98/99/95/1057989995.db2.gz GKHIQNZJYAHJEV-UHFFFAOYSA-N -1 1 316.719 4.434 20 0 DIADMM CCOC(=O)c1ccc(F)c(-c2c(Cl)ccc([O-])c2F)c1 ZINC001244539825 1057990359 /nfs/dbraw/zinc/99/03/59/1057990359.db2.gz JPCAUZGCMXEGNH-UHFFFAOYSA-N -1 1 312.699 4.168 20 0 DIADMM [O-]c1ccc(Cl)c(-c2cncc(-c3ccc(F)cc3)n2)c1F ZINC001244540035 1057990488 /nfs/dbraw/zinc/99/04/88/1057990488.db2.gz OBACBKIDWBVLIK-UHFFFAOYSA-N -1 1 318.710 4.448 20 0 DIADMM [O-]c1ccc(Cl)c(-c2ccnc(Cc3ccccc3)n2)c1F ZINC001244540345 1057990526 /nfs/dbraw/zinc/99/05/26/1057990526.db2.gz LGLHSPTVHSTOAA-UHFFFAOYSA-N -1 1 314.747 4.233 20 0 DIADMM [O-]c1ccc(Cl)c(-c2ccc(-c3cccnc3)nc2)c1F ZINC001244540804 1057990534 /nfs/dbraw/zinc/99/05/34/1057990534.db2.gz GJLXQQYPCPZROK-UHFFFAOYSA-N -1 1 300.720 4.309 20 0 DIADMM CCOC(=O)c1ccc(-c2c(Cl)ccc([O-])c2F)c(F)c1 ZINC001244542228 1057991078 /nfs/dbraw/zinc/99/10/78/1057991078.db2.gz JUXSQPFUIHZTAA-UHFFFAOYSA-N -1 1 312.699 4.168 20 0 DIADMM [O-]c1ccc(Cl)c(-c2nc(C3CC3)nc3c2CCC3)c1F ZINC001244541087 1057991311 /nfs/dbraw/zinc/99/13/11/1057991311.db2.gz XTNFFGGSWZVAJC-UHFFFAOYSA-N -1 1 304.752 4.008 20 0 DIADMM COc1ccc2nc(-c3c(Cl)ccc([O-])c3F)c(C)nc2c1 ZINC001244541121 1057991405 /nfs/dbraw/zinc/99/14/05/1057991405.db2.gz YYICQENWXMTGBE-UHFFFAOYSA-N -1 1 318.735 4.112 20 0 DIADMM CC1(C)Cc2c(cccc2-c2c(Cl)ccc([O-])c2F)NC1=O ZINC001244541650 1057991429 /nfs/dbraw/zinc/99/14/29/1057991429.db2.gz UBCCEKNJGLDVAG-UHFFFAOYSA-N -1 1 319.763 4.373 20 0 DIADMM COC(OC)c1ccc(-c2c(Cl)ccc([O-])c2F)cc1F ZINC001244541974 1057991663 /nfs/dbraw/zinc/99/16/63/1057991663.db2.gz GUPKMSAGKSCIHM-UHFFFAOYSA-N -1 1 314.715 4.282 20 0 DIADMM CCOC(=O)c1ccc(-c2c(Cl)ccc([O-])c2F)cc1F ZINC001244542755 1057992014 /nfs/dbraw/zinc/99/20/14/1057992014.db2.gz LSTJKSPUBJYKNZ-UHFFFAOYSA-N -1 1 312.699 4.168 20 0 DIADMM [O-]c1ccc(Cl)c(-c2ccc3nnc(C4CCC4)n3c2)c1F ZINC001244542617 1057992034 /nfs/dbraw/zinc/99/20/34/1057992034.db2.gz LXQQZSBZJHEWDE-UHFFFAOYSA-N -1 1 317.751 4.162 20 0 DIADMM CCOc1ccc(-c2c(Cl)ccc([O-])c2F)c(OCC)n1 ZINC001244542601 1057992228 /nfs/dbraw/zinc/99/22/28/1057992228.db2.gz LGTSTKCUEWCYEJ-UHFFFAOYSA-N -1 1 311.740 4.044 20 0 DIADMM O=c1c(-c2c(F)c([O-])ccc2Cl)cccn1-c1ccccc1 ZINC001244543236 1057992270 /nfs/dbraw/zinc/99/22/70/1057992270.db2.gz TUICBISDGXVLKP-UHFFFAOYSA-N -1 1 315.731 4.003 20 0 DIADMM O=C(c1ccc(-c2c(Cl)ccc([O-])c2F)cc1)N1CCCC1 ZINC001244542728 1057992367 /nfs/dbraw/zinc/99/23/67/1057992367.db2.gz PNVHNPAEYGLMPP-UHFFFAOYSA-N -1 1 319.763 4.088 20 0 DIADMM CCOC(=O)c1cc(F)cc(-c2c(Cl)ccc([O-])c2F)c1 ZINC001244542995 1057992450 /nfs/dbraw/zinc/99/24/50/1057992450.db2.gz QXQHQHQGPIQQKD-UHFFFAOYSA-N -1 1 312.699 4.168 20 0 DIADMM Cc1cc2[nH]ccc2c(-c2cc(C(=O)[O-])c(Cl)cc2F)n1 ZINC001244609461 1058008928 /nfs/dbraw/zinc/00/89/28/1058008928.db2.gz CWJVYFOREJIXTE-UHFFFAOYSA-N -1 1 304.708 4.029 20 0 DIADMM Cc1cc2[nH]cnc2cc1-c1cc(C(=O)[O-])c(Cl)cc1F ZINC001244614528 1058010183 /nfs/dbraw/zinc/01/01/83/1058010183.db2.gz ZKJFEQVRHHPWMX-UHFFFAOYSA-N -1 1 304.708 4.029 20 0 DIADMM CCOC(=O)c1nc2ccc(-c3cc4c(cccc4F)o3)cc2[n-]1 ZINC001244928968 1058073376 /nfs/dbraw/zinc/07/33/76/1058073376.db2.gz PMLCZIDRLXXPRR-UHFFFAOYSA-N -1 1 324.311 4.292 20 0 DIADMM Cc1nc(-c2ccncc2)nc(-c2cc(Cl)ccc2[O-])c1C ZINC001245050535 1058102494 /nfs/dbraw/zinc/10/24/94/1058102494.db2.gz UNTBDDZNAMFPDD-UHFFFAOYSA-N -1 1 311.772 4.181 20 0 DIADMM CC(C)(C)OC(=O)c1ccnc(-c2cc(Cl)ccc2[O-])c1 ZINC001245049013 1058102795 /nfs/dbraw/zinc/10/27/95/1058102795.db2.gz JSLAMOUTPXZHSE-UHFFFAOYSA-N -1 1 305.761 4.063 20 0 DIADMM Cc1ccccc1[C@H](NC(=O)c1cccc([O-])c1F)C(C)(C)C ZINC001545295033 1058194018 /nfs/dbraw/zinc/19/40/18/1058194018.db2.gz CTPYXLQVVXENGT-KRWDZBQOSA-N -1 1 315.388 4.357 20 0 DIADMM CC(C)CC[C@H]1CCCN1C(=O)Cc1ccc([O-])c(Cl)c1 ZINC001545627096 1058215035 /nfs/dbraw/zinc/21/50/35/1058215035.db2.gz HPDXCVLPUWIIJC-CQSZACIVSA-N -1 1 309.837 4.015 20 0 DIADMM CCC(CC)[C@@H]([N-]C(=O)C(F)(F)C(F)F)c1cccs1 ZINC001527790859 1058244253 /nfs/dbraw/zinc/24/42/53/1058244253.db2.gz XJOMDXPREDULIT-SNVBAGLBSA-N -1 1 311.344 4.242 20 0 DIADMM CC(C)(C)OC(=O)c1ccnc(-c2c(F)ccc([O-])c2Cl)c1 ZINC001245825469 1058520032 /nfs/dbraw/zinc/52/00/32/1058520032.db2.gz AGTAYAITFQLDIL-UHFFFAOYSA-N -1 1 323.751 4.202 20 0 DIADMM Cc1nc(-c2cccnc2)cc(-c2c(F)ccc([O-])c2Cl)n1 ZINC001245829596 1058524645 /nfs/dbraw/zinc/52/46/45/1058524645.db2.gz BCQJJGLAAYNFPL-UHFFFAOYSA-N -1 1 315.735 4.012 20 0 DIADMM COC(=O)c1nc2cc(-c3ccc(C)c(Cl)c3C)ccc2[n-]1 ZINC001245827730 1058525724 /nfs/dbraw/zinc/52/57/24/1058525724.db2.gz ZFJQWOWWNVDWGP-UHFFFAOYSA-N -1 1 314.772 4.287 20 0 DIADMM COC(=O)c1nc2ccc(-c3ccc(C)c(Cl)c3C)cc2[n-]1 ZINC001245827730 1058525741 /nfs/dbraw/zinc/52/57/41/1058525741.db2.gz ZFJQWOWWNVDWGP-UHFFFAOYSA-N -1 1 314.772 4.287 20 0 DIADMM CCOC(=O)c1cc(F)cc(-c2c(F)ccc([O-])c2Cl)c1 ZINC001245831065 1058526832 /nfs/dbraw/zinc/52/68/32/1058526832.db2.gz BNJJKTKDNNMBBF-UHFFFAOYSA-N -1 1 312.699 4.168 20 0 DIADMM O=C1CCCc2cc(-c3c(F)ccc([O-])c3Cl)ccc2N1 ZINC001245831061 1058528940 /nfs/dbraw/zinc/52/89/40/1058528940.db2.gz BHJSHKFZFHKXLP-UHFFFAOYSA-N -1 1 305.736 4.127 20 0 DIADMM CCOc1nnc(-c2c(F)ccc([O-])c2Cl)c2ccccc21 ZINC001245830393 1058530563 /nfs/dbraw/zinc/53/05/63/1058530563.db2.gz MXQDICGIACNYJF-UHFFFAOYSA-N -1 1 318.735 4.194 20 0 DIADMM CCN(CC)C(=O)c1ccc(-c2c(F)ccc([O-])c2Cl)cc1 ZINC001245831663 1058531491 /nfs/dbraw/zinc/53/14/91/1058531491.db2.gz CODUQBIGPRONDF-UHFFFAOYSA-N -1 1 321.779 4.334 20 0 DIADMM COc1cccc2cc(-c3c(F)ccc([O-])c3Cl)cnc21 ZINC001245832560 1058532701 /nfs/dbraw/zinc/53/27/01/1058532701.db2.gz PVFLYHGFVRYLDZ-UHFFFAOYSA-N -1 1 303.720 4.409 20 0 DIADMM [O-]c1ccc(F)c(-c2cc(C3OCCO3)ccc2F)c1Cl ZINC001245831304 1058532998 /nfs/dbraw/zinc/53/29/98/1058532998.db2.gz JFXXSSKIECWZTP-UHFFFAOYSA-N -1 1 312.699 4.036 20 0 DIADMM Cn1cccc1-c1ccc(-c2c(F)ccc([O-])c2Cl)nc1 ZINC001245831567 1058533607 /nfs/dbraw/zinc/53/36/07/1058533607.db2.gz APAYCIKJLCEALX-UHFFFAOYSA-N -1 1 302.736 4.252 20 0 DIADMM COc1cc(-c2c(F)ccc([O-])c2Cl)cc2ncccc21 ZINC001245831521 1058533872 /nfs/dbraw/zinc/53/38/72/1058533872.db2.gz MDIDQXQMUAQHBH-UHFFFAOYSA-N -1 1 303.720 4.409 20 0 DIADMM Cc1noc(-c2ccc(-c3c(F)ccc([O-])c3Cl)cc2F)n1 ZINC001245832675 1058534160 /nfs/dbraw/zinc/53/41/60/1058534160.db2.gz RNBFGAVTGRSDFS-UHFFFAOYSA-N -1 1 322.698 4.349 20 0 DIADMM [O-]c1ccc(F)c(-c2ccc(-c3cccnc3)nc2)c1Cl ZINC001245831441 1058534423 /nfs/dbraw/zinc/53/44/23/1058534423.db2.gz LSZUBUTUTHJOKM-UHFFFAOYSA-N -1 1 300.720 4.309 20 0 DIADMM COC(=O)c1cc(-c2c(F)ccc([O-])c2Cl)c(C)cc1C ZINC001245832177 1058534735 /nfs/dbraw/zinc/53/47/35/1058534735.db2.gz ITHPHFWOMZTRKA-UHFFFAOYSA-N -1 1 308.736 4.255 20 0 DIADMM CCOC(=O)CCc1ccc(-c2c(F)ccc([O-])c2Cl)cc1 ZINC001245831838 1058534819 /nfs/dbraw/zinc/53/48/19/1058534819.db2.gz PVELSXHRCKXUSY-UHFFFAOYSA-N -1 1 322.763 4.347 20 0 DIADMM O=C(c1cccc(-c2c(F)ccc([O-])c2Cl)c1)N1CCCC1 ZINC001245833107 1058535624 /nfs/dbraw/zinc/53/56/24/1058535624.db2.gz YZOTXKOGPKOJRW-UHFFFAOYSA-N -1 1 319.763 4.088 20 0 DIADMM COc1ccc2cc(-c3c(F)ccc([O-])c3Cl)ccc2n1 ZINC001245832714 1058538050 /nfs/dbraw/zinc/53/80/50/1058538050.db2.gz NQJQKTVGEOXTPB-UHFFFAOYSA-N -1 1 303.720 4.409 20 0 DIADMM COC(=O)/C=C/c1ccc(-c2c(F)ccc([O-])c2Cl)cc1 ZINC001245835164 1058539630 /nfs/dbraw/zinc/53/96/30/1058539630.db2.gz LUYAVADPTKGVBV-RUDMXATFSA-N -1 1 306.720 4.038 20 0 DIADMM COc1cc(F)c(-c2c(F)ccc([O-])c2Cl)cc1OC ZINC001245834396 1058541181 /nfs/dbraw/zinc/54/11/81/1058541181.db2.gz HSLOAYHMZGPAQI-UHFFFAOYSA-N -1 1 300.688 4.008 20 0 DIADMM [O-]c1ccc(F)c(-c2cccc(-c3cccnc3)n2)c1Cl ZINC001245836629 1058543658 /nfs/dbraw/zinc/54/36/58/1058543658.db2.gz VLQZHLKCNIQFFG-UHFFFAOYSA-N -1 1 300.720 4.309 20 0 DIADMM C[C@@H]1CCC[C@H](NC(=O)c2ccc(C(F)(F)F)c([O-])c2)CC1 ZINC001556236008 1058566855 /nfs/dbraw/zinc/56/68/55/1058566855.db2.gz TZGZAVSJIVUQOY-PWSUYJOCSA-N -1 1 315.335 4.110 20 0 DIADMM CSc1ccc(CNC(=O)c2cc3ccccc3cc2[O-])cc1 ZINC001556253766 1058569738 /nfs/dbraw/zinc/56/97/38/1058569738.db2.gz XYPWVUYCCPRHER-UHFFFAOYSA-N -1 1 323.417 4.197 20 0 DIADMM CC(C)(C)[C@@H]1CCCN(C(=O)c2ccc3ccccc3c2[O-])C1 ZINC001556357197 1058581811 /nfs/dbraw/zinc/58/18/11/1058581811.db2.gz UKJYNVAVJMGFSX-OAHLLOKOSA-N -1 1 311.425 4.444 20 0 DIADMM O=c1cc(CC2CC2)[n-]n1-c1ccc(SC(F)(F)F)cc1 ZINC001245953201 1058649464 /nfs/dbraw/zinc/64/94/64/1058649464.db2.gz MMIZPGFDFPCPIP-UHFFFAOYSA-N -1 1 314.332 4.142 20 0 DIADMM O=c1cc(CC2CC2)[n-]n1-c1cccc(OCc2ccccc2)c1 ZINC001245952561 1058650262 /nfs/dbraw/zinc/65/02/62/1058650262.db2.gz BLYAGEYKFVSJQV-UHFFFAOYSA-N -1 1 320.392 4.109 20 0 DIADMM C[C@H]1CCCC[C@@]1(C)NC(=O)c1ccc(C(F)(F)F)c([O-])c1 ZINC001556916790 1058667510 /nfs/dbraw/zinc/66/75/10/1058667510.db2.gz WJMYEGHFYBMGFO-ZUZCIYMTSA-N -1 1 315.335 4.110 20 0 DIADMM Cc1ccc2c(c1)CCN(C(=O)c1cc3ccccc3cc1[O-])C2 ZINC001557100452 1058702090 /nfs/dbraw/zinc/70/20/90/1058702090.db2.gz RXNOBYGRJUTJMZ-UHFFFAOYSA-N -1 1 317.388 4.052 20 0 DIADMM O=C(NC1(c2ccccc2Cl)CC1)c1cc(Cl)ccc1[O-] ZINC001557160420 1058709300 /nfs/dbraw/zinc/70/93/00/1058709300.db2.gz VRHYEKRZLSVWFG-UHFFFAOYSA-N -1 1 322.191 4.118 20 0 DIADMM O=C(c1cc(Cl)ccc1[O-])N1CCC[C@@H]1CC1CCCC1 ZINC001557292406 1058728390 /nfs/dbraw/zinc/72/83/90/1058728390.db2.gz NBFAJPGAKSRPRZ-CQSZACIVSA-N -1 1 307.821 4.231 20 0 DIADMM CC[C@H](C)c1cccc(NC(=O)c2c(F)ccc([O-])c2F)c1 ZINC001557559430 1058767486 /nfs/dbraw/zinc/76/74/86/1058767486.db2.gz BOPXTJOZPAKONJ-JTQLQIEISA-N -1 1 305.324 4.436 20 0 DIADMM Cc1ccccc1[C@@H](C)N(C)C(=O)c1ncc2ccccc2c1[O-] ZINC001557764983 1058789559 /nfs/dbraw/zinc/78/95/59/1058789559.db2.gz LAOFXMQHHWBWGF-CQSZACIVSA-N -1 1 320.392 4.082 20 0 DIADMM O=C(N[C@H]1CCc2ccc(Cl)cc21)c1cc(Cl)ccc1[O-] ZINC001557770559 1058793961 /nfs/dbraw/zinc/79/39/61/1058793961.db2.gz MVBTUUBTQBNLQS-AWEZNQCLSA-N -1 1 322.191 4.116 20 0 DIADMM O=C(Nc1cccc(F)c1[O-])c1ccc(SC2CC2)cc1 ZINC001557957101 1058818617 /nfs/dbraw/zinc/81/86/17/1058818617.db2.gz QRPQXHUUNSPQJR-UHFFFAOYSA-N -1 1 303.358 4.038 20 0 DIADMM CC(C)c1ccccc1C(=O)NCc1ccc([O-])c(Cl)c1 ZINC001558208957 1058849883 /nfs/dbraw/zinc/84/98/83/1058849883.db2.gz JUKSZJJPDQYYMO-UHFFFAOYSA-N -1 1 303.789 4.099 20 0 DIADMM C[C@H](CC1CCCCC1)C(=O)NCc1ccc([O-])c(Cl)c1 ZINC001558208965 1058851126 /nfs/dbraw/zinc/85/11/26/1058851126.db2.gz KFROKFAVXFDVRY-GFCCVEGCSA-N -1 1 309.837 4.268 20 0 DIADMM C/C(=C\C(=O)Nc1cc(F)c([O-])cc1Cl)c1cccc(F)c1 ZINC001558644099 1058895951 /nfs/dbraw/zinc/89/59/51/1058895951.db2.gz UXUGNVNWPMSLNX-WEVVVXLNSA-N -1 1 323.726 4.366 20 0 DIADMM CCCCOc1ccc(C(=O)Nc2cc(C)ccc2F)c([O-])c1 ZINC001558907198 1058921352 /nfs/dbraw/zinc/92/13/52/1058921352.db2.gz JQNSDSLSQFPLLY-UHFFFAOYSA-N -1 1 317.360 4.271 20 0 DIADMM Cc1nc(S[C@H]2CCc3c2cccc3Cl)[n-]c(=O)c1C ZINC001559393505 1059201974 /nfs/dbraw/zinc/20/19/74/1059201974.db2.gz QNPMEPSRYXRZPD-ZDUSSCGKSA-N -1 1 306.818 4.232 20 0 DIADMM CC[C@H](C)[C@@H]([N-]C(=O)C(F)(F)c1ccc(C)cc1)C(F)(F)F ZINC001524463308 1059527553 /nfs/dbraw/zinc/52/75/53/1059527553.db2.gz FEUALILSRPKDGF-CMPLNLGQSA-N -1 1 323.305 4.180 20 0 DIADMM Cc1ccc(F)c(-c2noc(Cc3ccc([O-])c(Cl)c3)n2)c1 ZINC001247587906 1059568037 /nfs/dbraw/zinc/56/80/37/1059568037.db2.gz MWZQJWVXDALKGC-UHFFFAOYSA-N -1 1 318.735 4.134 20 0 DIADMM CCc1cccc(C)c1NC(=S)Nc1cc([O-])c(F)cc1F ZINC001249561108 1060290024 /nfs/dbraw/zinc/29/00/24/1060290024.db2.gz PRKSFLXLVNMSFQ-UHFFFAOYSA-N -1 1 322.380 4.350 20 0 DIADMM [O-]c1cc(Nc2cccc(Br)c2F)cc(F)c1F ZINC001249688018 1060349771 /nfs/dbraw/zinc/34/97/71/1060349771.db2.gz RDYQXGZKBHIOGR-UHFFFAOYSA-N -1 1 318.092 4.316 20 0 DIADMM Cc1cc(C)c(NC(=S)Nc2cc(F)c([O-])c(F)c2)c(C)c1 ZINC001249731040 1060376153 /nfs/dbraw/zinc/37/61/53/1060376153.db2.gz KEOPQWQHQWZULU-UHFFFAOYSA-N -1 1 322.380 4.405 20 0 DIADMM Cc1cc(C)c(NC(=S)Nc2cccc(F)c2[O-])c(C)c1 ZINC001249732365 1060379267 /nfs/dbraw/zinc/37/92/67/1060379267.db2.gz XLCAFDKMEUVJJN-UHFFFAOYSA-N -1 1 304.390 4.265 20 0 DIADMM CC(C)Oc1cc(F)c(Nc2cc(F)c([O-])c(F)c2)c(F)c1 ZINC001249778690 1060396050 /nfs/dbraw/zinc/39/60/50/1060396050.db2.gz LQDUFEFNOHUHHX-UHFFFAOYSA-N -1 1 315.266 4.479 20 0 DIADMM O=C1CCCCc2ccc(Nc3cc([O-])c(F)c(F)c3)cc21 ZINC001249893144 1060455805 /nfs/dbraw/zinc/45/58/05/1060455805.db2.gz KQCABHJWJHBNTI-UHFFFAOYSA-N -1 1 303.308 4.323 20 0 DIADMM CC(C)(C)c1csc(Nc2cc([O-])c(F)c(F)c2F)n1 ZINC001249957489 1060501977 /nfs/dbraw/zinc/50/19/77/1060501977.db2.gz AUDIBAZIXXEKBE-UHFFFAOYSA-N -1 1 302.321 4.307 20 0 DIADMM CC(C)(C)c1cc(Nc2cc([O-])c(F)c(F)c2F)sn1 ZINC001249960792 1060504772 /nfs/dbraw/zinc/50/47/72/1060504772.db2.gz UYYSDYBWBNXOEL-UHFFFAOYSA-N -1 1 302.321 4.307 20 0 DIADMM Cc1cccc(-n2nccc2Nc2cc([O-])c(F)c(F)c2F)c1 ZINC001249961238 1060506234 /nfs/dbraw/zinc/50/62/34/1060506234.db2.gz MGPZHJLQVLWICN-UHFFFAOYSA-N -1 1 319.286 4.047 20 0 DIADMM [O-]c1cc(Nc2cc(C(F)(F)F)ccc2O)c(F)c(F)c1F ZINC001249964018 1060507964 /nfs/dbraw/zinc/50/79/64/1060507964.db2.gz WBDCOWWZQSWULO-UHFFFAOYSA-N -1 1 323.192 4.278 20 0 DIADMM [O-]c1cc(Nc2cccc(OC(F)F)c2)c(F)c(F)c1F ZINC001249963347 1060508026 /nfs/dbraw/zinc/50/80/26/1060508026.db2.gz NLPQXFNYIPPOLS-UHFFFAOYSA-N -1 1 305.202 4.155 20 0 DIADMM Cc1nccn1-c1ccc(Nc2cc([O-])c(F)c(F)c2F)cc1 ZINC001249962300 1060509033 /nfs/dbraw/zinc/50/90/33/1060509033.db2.gz JRFJFKGTLBRSBH-UHFFFAOYSA-N -1 1 319.286 4.047 20 0 DIADMM [O-]c1cc(Nc2cccc3ccc(O)cc32)c(F)c(F)c1F ZINC001249963352 1060509724 /nfs/dbraw/zinc/50/97/24/1060509724.db2.gz NYKKBSDQEBKBNY-UHFFFAOYSA-N -1 1 305.255 4.412 20 0 DIADMM [O-]c1cc(Nc2cccc3ncc(F)cc32)c(F)c(F)c1F ZINC001249965566 1060510101 /nfs/dbraw/zinc/51/01/01/1060510101.db2.gz ANHBWLPIXFVEII-UHFFFAOYSA-N -1 1 308.234 4.240 20 0 DIADMM [O-]c1cc(Nc2cc(F)cc3cccnc32)c(F)c(F)c1F ZINC001249965192 1060510712 /nfs/dbraw/zinc/51/07/12/1060510712.db2.gz ZXMVRNUZDUUWAC-UHFFFAOYSA-N -1 1 308.234 4.240 20 0 DIADMM [O-]c1cc(Nc2cc(Cl)cc3ncoc32)c(F)c(F)c1F ZINC001249966760 1060511165 /nfs/dbraw/zinc/51/11/65/1060511165.db2.gz LMNUQXCVEQLLGL-UHFFFAOYSA-N -1 1 314.650 4.348 20 0 DIADMM CC(C)Oc1ccc(Nc2cc([O-])c(F)c(F)c2F)cc1F ZINC001249965713 1060511425 /nfs/dbraw/zinc/51/14/25/1060511425.db2.gz IDXBISHINIKPQC-UHFFFAOYSA-N -1 1 315.266 4.479 20 0 DIADMM CSc1ccc(Nc2cc([O-])c(F)c(F)c2F)c(F)c1 ZINC001249966492 1060511633 /nfs/dbraw/zinc/51/16/33/1060511633.db2.gz GTVFBTHNZHSBIU-UHFFFAOYSA-N -1 1 303.280 4.414 20 0 DIADMM [O-]c1cc(F)c(Nc2ncc(Cl)nc2Cl)cc1Cl ZINC001250021087 1060547080 /nfs/dbraw/zinc/54/70/80/1060547080.db2.gz YACBEVNEELNRKC-UHFFFAOYSA-N -1 1 308.527 4.025 20 0 DIADMM CCOC(=O)c1ccsc1Nc1cc(Cl)c([O-])cc1F ZINC001250018429 1060542396 /nfs/dbraw/zinc/54/23/96/1060542396.db2.gz PTYNWXUCBPMSNA-UHFFFAOYSA-N -1 1 315.753 4.167 20 0 DIADMM [O-]c1cc(F)c(Nc2cccnc2Br)cc1Cl ZINC001250020966 1060544113 /nfs/dbraw/zinc/54/41/13/1060544113.db2.gz VFJFFTNVIZGYEN-UHFFFAOYSA-N -1 1 317.545 4.086 20 0 DIADMM [O-]c1cc(F)c(Nc2cnc(-c3ccccc3)cn2)cc1Cl ZINC001250017721 1060544884 /nfs/dbraw/zinc/54/48/84/1060544884.db2.gz GTZJDPYUUNPKNG-UHFFFAOYSA-N -1 1 315.735 4.385 20 0 DIADMM [O-]c1cc(F)c(Nc2cnc(Cl)nc2Cl)cc1Cl ZINC001250020035 1060544920 /nfs/dbraw/zinc/54/49/20/1060544920.db2.gz BRRUOZOMHUNSGE-UHFFFAOYSA-N -1 1 308.527 4.025 20 0 DIADMM [O-]c1cc(F)c(Nc2csc(-c3ccncc3)n2)cc1Cl ZINC001250023238 1060545938 /nfs/dbraw/zinc/54/59/38/1060545938.db2.gz FQQMIYHBXMAYDP-UHFFFAOYSA-N -1 1 321.764 4.447 20 0 DIADMM [O-]c1cc(F)c(Nc2cc(-c3ccccc3O)no2)cc1Cl ZINC001250023079 1060546970 /nfs/dbraw/zinc/54/69/70/1060546970.db2.gz BPAUDWRSIFBZBX-UHFFFAOYSA-N -1 1 320.707 4.289 20 0 DIADMM [O-]c1cc(F)c(Nc2ccc(OCC3CC3)nc2)cc1Cl ZINC001250023515 1060547273 /nfs/dbraw/zinc/54/72/73/1060547273.db2.gz MSTFJIULQPPPLL-UHFFFAOYSA-N -1 1 308.740 4.112 20 0 DIADMM C[C@@H]1CCc2cc(N)ccc2N1c1cc(Cl)c([O-])cc1F ZINC001250022288 1060547311 /nfs/dbraw/zinc/54/73/11/1060547311.db2.gz HNYULXUAAVVOIZ-SECBINFHSA-N -1 1 306.768 4.240 20 0 DIADMM [O-]c1cc(F)c(Nc2ccc(-n3ccnc3)cc2)cc1Cl ZINC001250021975 1060547419 /nfs/dbraw/zinc/54/74/19/1060547419.db2.gz ASFRWGAIFUEKHI-UHFFFAOYSA-N -1 1 303.724 4.114 20 0 DIADMM CC1(C)Oc2ccc(Nc3cc(Cl)c([O-])cc3F)cc2O1 ZINC001250022657 1060548942 /nfs/dbraw/zinc/54/89/42/1060548942.db2.gz RANDUUZNXDYADB-UHFFFAOYSA-N -1 1 309.724 4.436 20 0 DIADMM Cc1ccc(-n2nccc2Nc2cc(Cl)c([O-])cc2F)cc1 ZINC001250023730 1060549070 /nfs/dbraw/zinc/54/90/70/1060549070.db2.gz YHPKBZCOMYNFOF-UHFFFAOYSA-N -1 1 317.751 4.422 20 0 DIADMM CN(c1cc(Cl)ccc1N)c1cc(Cl)c([O-])cc1F ZINC001250025921 1060550206 /nfs/dbraw/zinc/55/02/06/1060550206.db2.gz IOYSHNDDQYHCAA-UHFFFAOYSA-N -1 1 301.148 4.188 20 0 DIADMM O=C1CCCc2cc(Nc3cc(Cl)c([O-])cc3F)ccc2N1 ZINC001250026382 1060551464 /nfs/dbraw/zinc/55/14/64/1060551464.db2.gz LHNIYHBOYSMTOV-UHFFFAOYSA-N -1 1 320.751 4.203 20 0 DIADMM COc1cc(F)c(Nc2cc(Cl)c([O-])cc2F)c(F)c1 ZINC001250024090 1060552826 /nfs/dbraw/zinc/55/28/26/1060552826.db2.gz PZQSNIIUASJAST-UHFFFAOYSA-N -1 1 303.667 4.215 20 0 DIADMM COC(=O)CCc1ccc(Nc2cc(Cl)c([O-])cc2F)cc1 ZINC001250027404 1060554210 /nfs/dbraw/zinc/55/42/10/1060554210.db2.gz XRQWCAIKMTYQRK-UHFFFAOYSA-N -1 1 323.751 4.034 20 0 DIADMM CCOC(=O)Cc1cccc(Nc2cc(Cl)c([O-])cc2F)c1 ZINC001250027269 1060554730 /nfs/dbraw/zinc/55/47/30/1060554730.db2.gz ZUHRUEPSWUUPHW-UHFFFAOYSA-N -1 1 323.751 4.034 20 0 DIADMM Cc1nc(-c2ccc(Nc3cc(Cl)c([O-])cc3F)cc2)no1 ZINC001250026921 1060554849 /nfs/dbraw/zinc/55/48/49/1060554849.db2.gz RYIGTZUCAMCPDY-UHFFFAOYSA-N -1 1 319.723 4.287 20 0 DIADMM C=CC(=O)Nc1cccc(Nc2cc(Cl)c([O-])cc2F)c1 ZINC001250029499 1060556289 /nfs/dbraw/zinc/55/62/89/1060556289.db2.gz LVCJUZUHYUFLNX-UHFFFAOYSA-N -1 1 306.724 4.053 20 0 DIADMM Cc1c(Nc2cc(Cl)c([O-])cc2F)ccc2c1OCCO2 ZINC001250029239 1060556738 /nfs/dbraw/zinc/55/67/38/1060556738.db2.gz DEILEZYUMUQUCT-UHFFFAOYSA-N -1 1 309.724 4.008 20 0 DIADMM COc1c(Cl)ccc(F)c1Nc1ccc(F)c(F)c1[O-] ZINC001250107188 1060613555 /nfs/dbraw/zinc/61/35/55/1060613555.db2.gz OHUBWMCXVHTWHF-UHFFFAOYSA-N -1 1 303.667 4.215 20 0 DIADMM [O-]c1ccc(F)c(Nc2ccnn2Cc2ccccc2)c1Cl ZINC001250228860 1060708304 /nfs/dbraw/zinc/70/83/04/1060708304.db2.gz NWSACVHWBYIHPW-UHFFFAOYSA-N -1 1 317.751 4.173 20 0 DIADMM COc1ccc(Nc2c(F)ccc([O-])c2Cl)c2ncccc12 ZINC001250232289 1060711043 /nfs/dbraw/zinc/71/10/43/1060711043.db2.gz ICKMPMQJQRWPLZ-UHFFFAOYSA-N -1 1 318.735 4.485 20 0 DIADMM [O-]c1ccc(F)c(Nc2ccnn2-c2ccccc2F)c1Cl ZINC001250230004 1060711189 /nfs/dbraw/zinc/71/11/89/1060711189.db2.gz QIHWAPNHYMNGJR-UHFFFAOYSA-N -1 1 321.714 4.253 20 0 DIADMM [O-]c1ccc(F)c(Nc2cc(-c3ccncn3)cs2)c1Cl ZINC001250230067 1060711934 /nfs/dbraw/zinc/71/19/34/1060711934.db2.gz TUTOXXMJPXGYKU-UHFFFAOYSA-N -1 1 321.764 4.447 20 0 DIADMM Nc1c(F)c(F)c(Nc2c(F)ccc([O-])c2Cl)c(F)c1F ZINC001250232138 1060712100 /nfs/dbraw/zinc/71/21/00/1060712100.db2.gz ALNIIWBAWUCZNG-UHFFFAOYSA-N -1 1 324.636 4.067 20 0 DIADMM COC(=O)c1ccc(C)c(Nc2c(F)ccc([O-])c2Cl)c1 ZINC001250233877 1060713301 /nfs/dbraw/zinc/71/33/01/1060713301.db2.gz YGTPUPNEJFKWDC-UHFFFAOYSA-N -1 1 309.724 4.023 20 0 DIADMM Cc1cnn(CC2CCC2)c1Nc1c(F)ccc([O-])c1Cl ZINC001250234546 1060714065 /nfs/dbraw/zinc/71/40/65/1060714065.db2.gz ROGHAWUDOCSDPV-UHFFFAOYSA-N -1 1 309.772 4.233 20 0 DIADMM COc1cc2cccnc2c(Nc2c(F)ccc([O-])c2Cl)c1 ZINC001250233721 1060714488 /nfs/dbraw/zinc/71/44/88/1060714488.db2.gz VJMVFUZBTMPYQC-UHFFFAOYSA-N -1 1 318.735 4.485 20 0 DIADMM COc1ccc(Nc2c(F)ccc([O-])c2Cl)c2ccncc12 ZINC001250236278 1060716151 /nfs/dbraw/zinc/71/61/51/1060716151.db2.gz MKGXKMNZWNTGLZ-UHFFFAOYSA-N -1 1 318.735 4.485 20 0 DIADMM Cc1c(C)n(-c2c(F)ccc([O-])c2Cl)c2c1cccc2N ZINC001250237735 1060719143 /nfs/dbraw/zinc/71/91/43/1060719143.db2.gz NUFDKDAIIPQOQT-UHFFFAOYSA-N -1 1 304.752 4.328 20 0 DIADMM [O-]c1ccc(F)c(Nc2ccc(Cl)c(CO)c2)c1Cl ZINC001250236961 1060719944 /nfs/dbraw/zinc/71/99/44/1060719944.db2.gz ZMZHTESOXZPUOY-UHFFFAOYSA-N -1 1 302.132 4.074 20 0 DIADMM C=CC(=O)Nc1cccc(Nc2c(F)ccc([O-])c2Cl)c1 ZINC001250237162 1060720013 /nfs/dbraw/zinc/72/00/13/1060720013.db2.gz CTUWZQBDFKTBRT-UHFFFAOYSA-N -1 1 306.724 4.053 20 0 DIADMM [O-]c1cc(Cl)c(Nc2c(F)ccc(CO)c2F)cc1Cl ZINC001250256435 1060735776 /nfs/dbraw/zinc/73/57/76/1060735776.db2.gz FGPVNBUCEXZPLR-UHFFFAOYSA-N -1 1 320.122 4.213 20 0 DIADMM COc1cc(Nc2ccc(F)c(F)c2[O-])c(F)c(F)c1Cl ZINC001250267085 1060744397 /nfs/dbraw/zinc/74/43/97/1060744397.db2.gz BSLHOFHCZSFTIQ-UHFFFAOYSA-N -1 1 321.657 4.354 20 0 DIADMM [O-]c1ccc(F)c(Cc2cccc(OC(F)F)c2)c1Cl ZINC001250268915 1060745510 /nfs/dbraw/zinc/74/55/10/1060745510.db2.gz MKECEWBWUDSQRU-UHFFFAOYSA-N -1 1 302.679 4.377 20 0 DIADMM [O-]c1ccc(-c2ccc(C(F)(F)F)cn2)cc1C(F)(F)F ZINC001250449509 1060809058 /nfs/dbraw/zinc/80/90/58/1060809058.db2.gz QUJBKSNOMHZQLP-UHFFFAOYSA-N -1 1 307.193 4.492 20 0 DIADMM O=c1[nH]c2ccccc2cc1-c1nc2cc(F)cc(Cl)c2[n-]1 ZINC001250645172 1060985290 /nfs/dbraw/zinc/98/52/90/1060985290.db2.gz CWEWZHQYDMFODC-UHFFFAOYSA-N -1 1 313.719 4.276 20 0 DIADMM O=c1[nH]c2ccccc2cc1-c1nc2c(cc(F)cc2Cl)[n-]1 ZINC001250645172 1060985311 /nfs/dbraw/zinc/98/53/11/1060985311.db2.gz CWEWZHQYDMFODC-UHFFFAOYSA-N -1 1 313.719 4.276 20 0 DIADMM CCn1c2ccc3ncccc3c2nc1-c1c([O-])cccc1F ZINC001250674843 1061006187 /nfs/dbraw/zinc/00/61/87/1061006187.db2.gz XLTZJYLQSUJTHE-UHFFFAOYSA-N -1 1 307.328 4.116 20 0 DIADMM CCCCn1c2cc(F)ccc2nc1-c1c([O-])cccc1F ZINC001250674842 1061007663 /nfs/dbraw/zinc/00/76/63/1061007663.db2.gz XJVUOCWZTYXHGZ-UHFFFAOYSA-N -1 1 302.324 4.487 20 0 DIADMM C=Cc1cccc([N-]S(=O)(=O)c2ccc3ccccc3c2)c1 ZINC001250722765 1061040944 /nfs/dbraw/zinc/04/09/44/1061040944.db2.gz XNPUBYMULYSWCL-UHFFFAOYSA-N -1 1 309.390 4.284 20 0 DIADMM CCOc1ccc(Cl)c(NCc2ccc([O-])c(F)c2F)c1 ZINC001462263064 1061059222 /nfs/dbraw/zinc/05/92/22/1061059222.db2.gz YOMZJPARWJZPQR-UHFFFAOYSA-N -1 1 313.731 4.335 20 0 DIADMM Cn1c2ccc3ncccc3c2nc1-c1ccc(Cl)cc1[O-] ZINC001250872992 1061104457 /nfs/dbraw/zinc/10/44/57/1061104457.db2.gz ZDZPXEPAHNAVRB-UHFFFAOYSA-N -1 1 309.756 4.148 20 0 DIADMM COCCCn1c2ccccc2nc1-c1ccc(Cl)cc1[O-] ZINC001250872956 1061104595 /nfs/dbraw/zinc/10/45/95/1061104595.db2.gz YQVRZGRPIIJXIG-UHFFFAOYSA-N -1 1 316.788 4.099 20 0 DIADMM Cc1cccc2nc(-c3ccc([O-])c(F)c3F)n(C3CC3)c21 ZINC001250915226 1061124923 /nfs/dbraw/zinc/12/49/23/1061124923.db2.gz UWQONKVBFGQKLM-UHFFFAOYSA-N -1 1 300.308 4.330 20 0 DIADMM [O-]c1ccc(CNc2ccc3ccnc(Cl)c3c2)c(F)c1F ZINC001462385267 1061141895 /nfs/dbraw/zinc/14/18/95/1061141895.db2.gz LUBVFFRXKJNGOE-UHFFFAOYSA-N -1 1 320.726 4.484 20 0 DIADMM COc1ccc2c(c1)nc(-c1c(Cl)cc([O-])cc1Cl)n2C ZINC001250957080 1061145148 /nfs/dbraw/zinc/14/51/48/1061145148.db2.gz QVWUDMJJCUBOBC-UHFFFAOYSA-N -1 1 323.179 4.261 20 0 DIADMM COc1ccc2nc(-c3c(Cl)cc([O-])cc3Cl)n(C)c2c1 ZINC001250956542 1061145342 /nfs/dbraw/zinc/14/53/42/1061145342.db2.gz DUHZHENMAQNSPH-UHFFFAOYSA-N -1 1 323.179 4.261 20 0 DIADMM [O-]c1cc(F)c(F)cc1-c1nc2cc(-c3ccncc3)ccc2[nH]1 ZINC001250967129 1061151265 /nfs/dbraw/zinc/15/12/65/1061151265.db2.gz KODFLMZJZWTVHM-UHFFFAOYSA-N -1 1 323.302 4.276 20 0 DIADMM [O-]c1cc(F)c(F)cc1-c1nc2ccc(-c3ccncc3)cc2[nH]1 ZINC001250967129 1061151288 /nfs/dbraw/zinc/15/12/88/1061151288.db2.gz KODFLMZJZWTVHM-UHFFFAOYSA-N -1 1 323.302 4.276 20 0 DIADMM CC(C)n1c2cc(F)ccc2nc1-c1c(F)cc([O-])cc1F ZINC001251007063 1061178826 /nfs/dbraw/zinc/17/88/26/1061178826.db2.gz CDNIDYUDERAMCC-UHFFFAOYSA-N -1 1 306.287 4.407 20 0 DIADMM CCCCc1ccc2nc(-c3sccc3C(=O)[O-])[nH]c2c1 ZINC001251010994 1061180458 /nfs/dbraw/zinc/18/04/58/1061180458.db2.gz HLUUPDUKVREDCA-UHFFFAOYSA-N -1 1 300.383 4.332 20 0 DIADMM [O-]c1cc(F)c(-c2nc3ccc(-c4ccncc4)cc3[nH]2)cc1F ZINC001251010965 1061181033 /nfs/dbraw/zinc/18/10/33/1061181033.db2.gz GFUNCYHUJXQXDN-UHFFFAOYSA-N -1 1 323.302 4.276 20 0 DIADMM [O-]c1cc(O)c(-c2nc3c(cc(Cl)cc3F)[nH]2)cc1Cl ZINC001251083373 1061227616 /nfs/dbraw/zinc/22/76/16/1061227616.db2.gz TYKGLZZDVPRRKM-UHFFFAOYSA-N -1 1 313.115 4.087 20 0 DIADMM CC(C)n1c2cc(F)ccc2nc1-c1cc(Cl)c([O-])cc1O ZINC001251083837 1061229647 /nfs/dbraw/zinc/22/96/47/1061229647.db2.gz WZQLFLLKVXXBJE-UHFFFAOYSA-N -1 1 320.751 4.488 20 0 DIADMM CCn1c(-c2cc(Cl)c([O-])cc2O)nc2ccc(F)c(F)c21 ZINC001251083540 1061230196 /nfs/dbraw/zinc/23/01/96/1061230196.db2.gz VIICMNDTSOLKBR-UHFFFAOYSA-N -1 1 324.714 4.066 20 0 DIADMM O=S(=O)([N-]c1ccc(-c2cccs2)cc1)c1ccccc1 ZINC001251137260 1061249148 /nfs/dbraw/zinc/24/91/48/1061249148.db2.gz PRYDYZPEJNUDKI-UHFFFAOYSA-N -1 1 315.419 4.216 20 0 DIADMM Cc1cc([N-]S(=O)(=O)c2ccccc2)cc(Cl)c1Cl ZINC001251154751 1061252003 /nfs/dbraw/zinc/25/20/03/1061252003.db2.gz BNHPWYFVFBIQNF-UHFFFAOYSA-N -1 1 316.209 4.103 20 0 DIADMM COc1ccc2nc(-c3ccc(Cl)c([O-])c3Cl)[nH]c2c1 ZINC001251168697 1061258146 /nfs/dbraw/zinc/25/81/46/1061258146.db2.gz OQPHLBPRMMRMML-UHFFFAOYSA-N -1 1 309.152 4.251 20 0 DIADMM COc1cc2nc(-c3cccc([O-])c3Cl)[nH]c2cc1Cl ZINC001251203863 1061270132 /nfs/dbraw/zinc/27/01/32/1061270132.db2.gz SFYDSPHPBHWRPZ-UHFFFAOYSA-N -1 1 309.152 4.251 20 0 DIADMM [O-]c1cccc(-c2nc3cc(N4CCCC4)ccc3[nH]2)c1Cl ZINC001251204151 1061270254 /nfs/dbraw/zinc/27/02/54/1061270254.db2.gz YAJZDLBKSZJQBF-UHFFFAOYSA-N -1 1 313.788 4.189 20 0 DIADMM CCSc1ccc(Cl)cc1[N-]C(=O)c1cc(CC)on1 ZINC001456178013 1061283517 /nfs/dbraw/zinc/28/35/17/1061283517.db2.gz IRIZWPUFAKKXJF-UHFFFAOYSA-N -1 1 310.806 4.255 20 0 DIADMM [O-]c1cnc(Cl)cc1-c1nc2cc(Cl)c(Cl)cc2[nH]1 ZINC001251252346 1061290836 /nfs/dbraw/zinc/29/08/36/1061290836.db2.gz UIHUZASSFUNWKZ-UHFFFAOYSA-N -1 1 314.559 4.291 20 0 DIADMM CCCn1c2cc(F)ccc2nc1-c1cc(Cl)ncc1[O-] ZINC001251252386 1061290979 /nfs/dbraw/zinc/29/09/79/1061290979.db2.gz VLNSNCPTMWKNQU-UHFFFAOYSA-N -1 1 305.740 4.006 20 0 DIADMM COc1ccc2nc(-c3c([O-])ccc(F)c3F)n(C3CC3)c2c1 ZINC001251321978 1061313956 /nfs/dbraw/zinc/31/39/56/1061313956.db2.gz KLWGTTWFTSANIO-UHFFFAOYSA-N -1 1 316.307 4.031 20 0 DIADMM [O-]c1ccc(F)c(-c2nc3ccccc3n2CC2CC2)c1F ZINC001251335871 1061321902 /nfs/dbraw/zinc/32/19/02/1061321902.db2.gz TUNMAMAUXXGSJZ-UHFFFAOYSA-N -1 1 300.308 4.097 20 0 DIADMM Cc1cccc2c1nc(-c1cccc(C(F)(F)F)c1[O-])n2C ZINC001251341320 1061325654 /nfs/dbraw/zinc/32/56/54/1061325654.db2.gz YXVWCKPPEDWTPI-UHFFFAOYSA-N -1 1 306.287 4.273 20 0 DIADMM C[C@]1(c2ccccc2)C[C@H]1C(=O)Nc1cc(F)c([O-])cc1Cl ZINC001456615495 1061346172 /nfs/dbraw/zinc/34/61/72/1061346172.db2.gz CDEHUTMOIHDEAT-APPDUMDISA-N -1 1 319.763 4.101 20 0 DIADMM Cc1cc2[nH]c(-c3ccc(Br)c([O-])c3)nc2cc1F ZINC001251473721 1061371504 /nfs/dbraw/zinc/37/15/04/1061371504.db2.gz MWZUUPMTUCQYIV-UHFFFAOYSA-N -1 1 321.149 4.146 20 0 DIADMM Cn1c2ccc(C(F)(F)F)cc2nc1-c1ccc(F)c([O-])c1 ZINC001251477699 1061375023 /nfs/dbraw/zinc/37/50/23/1061375023.db2.gz SEEUQSQWFXNNRD-UHFFFAOYSA-N -1 1 310.250 4.104 20 0 DIADMM COc1ccc(-c2nc3ccc(SC)cc3[nH]2)c([O-])c1Cl ZINC001251491400 1061376695 /nfs/dbraw/zinc/37/66/95/1061376695.db2.gz UDERVQACMDBVLC-UHFFFAOYSA-N -1 1 320.801 4.319 20 0 DIADMM COc1cc([O-])c(-c2nc3cc4c(cc3[nH]2)CCC4)c(Cl)c1 ZINC001251491268 1061378121 /nfs/dbraw/zinc/37/81/21/1061378121.db2.gz LQMDCRKFLCDNFN-UHFFFAOYSA-N -1 1 314.772 4.086 20 0 DIADMM [O-]c1ccc(Cl)c(Cl)c1-c1nc2cc3c(cc2[nH]1)CCO3 ZINC001251532010 1061391044 /nfs/dbraw/zinc/39/10/44/1061391044.db2.gz UGQACAVHYBMSSS-UHFFFAOYSA-N -1 1 321.163 4.177 20 0 DIADMM CC(=O)c1ccc2[nH]c(-c3c([O-])ccc(Cl)c3Cl)nc2c1 ZINC001251531805 1061392888 /nfs/dbraw/zinc/39/28/88/1061392888.db2.gz HTXBHZXHEOARAN-UHFFFAOYSA-N -1 1 321.163 4.445 20 0 DIADMM CCOc1ccc2nc(-c3cc(F)c(Cl)cc3[O-])n(C)c2c1 ZINC001251684410 1061443186 /nfs/dbraw/zinc/44/31/86/1061443186.db2.gz HTVXKRADVNQMHC-UHFFFAOYSA-N -1 1 320.751 4.137 20 0 DIADMM Cc1cc(C(=O)[O-])ccc1-c1nc2ccc(C(F)F)cc2[nH]1 ZINC001251710920 1061454029 /nfs/dbraw/zinc/45/40/29/1061454029.db2.gz SCOAAGZQCVEBRU-UHFFFAOYSA-N -1 1 302.280 4.174 20 0 DIADMM CCCCc1ccc2nc(-c3ccc(F)cc3C(=O)[O-])[nH]c2c1 ZINC001251724718 1061458805 /nfs/dbraw/zinc/45/88/05/1061458805.db2.gz LXDOVBZIQVSASX-UHFFFAOYSA-N -1 1 312.344 4.410 20 0 DIADMM CCCCOc1ccc(C(=O)Nc2cc(C)cc(C)c2)c([O-])c1 ZINC001457461170 1061459332 /nfs/dbraw/zinc/45/93/32/1061459332.db2.gz CGYCLRZGIHRHGS-UHFFFAOYSA-N -1 1 313.397 4.440 20 0 DIADMM O=S(=O)([N-]c1ccccc1C(F)F)c1ccc(Cl)cc1 ZINC001251732843 1061461704 /nfs/dbraw/zinc/46/17/04/1061461704.db2.gz DPYMDZKHCRWVTD-UHFFFAOYSA-N -1 1 317.744 4.078 20 0 DIADMM CCC1(C[N-]S(=O)(=O)c2sccc2Cl)CCCCC1 ZINC001463466506 1061482838 /nfs/dbraw/zinc/48/28/38/1061482838.db2.gz MQPYWSWOKBACFU-UHFFFAOYSA-N -1 1 321.895 4.040 20 0 DIADMM O=C(NCCCC1CCCC1)c1ccc(C(F)(F)F)cc1[O-] ZINC001463525797 1061495055 /nfs/dbraw/zinc/49/50/55/1061495055.db2.gz OJEFSXPHNWKSLY-UHFFFAOYSA-N -1 1 315.335 4.111 20 0 DIADMM CSc1ccc([O-])c(C(=O)Nc2ccc(Cl)cc2C)c1 ZINC001463740312 1061515401 /nfs/dbraw/zinc/51/54/01/1061515401.db2.gz CLMSJFPAEZNYEO-UHFFFAOYSA-N -1 1 307.802 4.328 20 0 DIADMM Cc1cnc(C(=O)N(Cc2ccc(C(C)C)cc2)C2CC2)c([O-])c1 ZINC001463735100 1061516894 /nfs/dbraw/zinc/51/68/94/1061516894.db2.gz MWOCMMYNTCXELF-UHFFFAOYSA-N -1 1 324.424 4.024 20 0 DIADMM Cc1ccc2nc(-c3cc([O-])c(Cl)c(F)c3F)[nH]c2c1C ZINC001251865247 1061517465 /nfs/dbraw/zinc/51/74/65/1061517465.db2.gz KMXQFVXEGHKWRD-UHFFFAOYSA-N -1 1 308.715 4.484 20 0 DIADMM Cc1cc(F)cc2[nH]c(-c3cc([O-])c(Cl)c(F)c3F)nc21 ZINC001251865204 1061517785 /nfs/dbraw/zinc/51/77/85/1061517785.db2.gz JWNJBTOSEMXHHT-UHFFFAOYSA-N -1 1 312.678 4.315 20 0 DIADMM CCC[C@H]([N-]S(=O)(=O)c1cc2ccccc2o1)C1CCCC1 ZINC001463853386 1061525393 /nfs/dbraw/zinc/52/53/93/1061525393.db2.gz HWLCFKBPGSTWON-HNNXBMFYSA-N -1 1 321.442 4.070 20 0 DIADMM O=C(NCCCCc1ccccc1)c1cc2ccccc2cc1[O-] ZINC001463864554 1061527185 /nfs/dbraw/zinc/52/71/85/1061527185.db2.gz XIPPCOQJQSXEKL-UHFFFAOYSA-N -1 1 319.404 4.298 20 0 DIADMM CCCc1ccccc1NC(=O)c1cc(SC)ccc1[O-] ZINC001463857110 1061527455 /nfs/dbraw/zinc/52/74/55/1061527455.db2.gz PWTNQWBKWOZZAM-UHFFFAOYSA-N -1 1 301.411 4.319 20 0 DIADMM Cc1ccc(Oc2ccccc2CC[N-]C(=O)C(F)(F)F)cc1 ZINC001463889969 1061529977 /nfs/dbraw/zinc/52/99/77/1061529977.db2.gz ULIVSKNMLVGWRQ-UHFFFAOYSA-N -1 1 323.314 4.008 20 0 DIADMM COc1ccc(-c2nnc(-c3ccc4sccc4c3[O-])o2)cc1 ZINC001251965170 1061541321 /nfs/dbraw/zinc/54/13/21/1061541321.db2.gz MYFMCPTXDXKGNQ-UHFFFAOYSA-N -1 1 324.361 4.333 20 0 DIADMM CCc1ccc(C(=O)Nc2ncc(-c3ccccc3)s2)c([O-])c1 ZINC001464288347 1061573386 /nfs/dbraw/zinc/57/33/86/1061573386.db2.gz BEEJQGXLFCUSLI-UHFFFAOYSA-N -1 1 324.405 4.330 20 0 DIADMM Cc1ccc(-c2nnc(-c3ccc(C(F)(F)F)cc3[O-])o2)cc1 ZINC001252608235 1061676866 /nfs/dbraw/zinc/67/68/66/1061676866.db2.gz JKCGKJZJVRXGDI-UHFFFAOYSA-N -1 1 320.270 4.436 20 0 DIADMM [O-]c1ccc(Cc2nnc(-c3ccc(Cl)cc3)o2)cc1Cl ZINC001252709457 1061698092 /nfs/dbraw/zinc/69/80/92/1061698092.db2.gz KTXZCNISRVGXDN-UHFFFAOYSA-N -1 1 321.163 4.340 20 0 DIADMM COc1ccc(-c2nnc(-c3ccc(C(C)(C)C)cc3)o2)c([O-])c1 ZINC001252803569 1061728103 /nfs/dbraw/zinc/72/81/03/1061728103.db2.gz PWTODXNGXLZUOP-UHFFFAOYSA-N -1 1 324.380 4.415 20 0 DIADMM [O-]c1cc(-c2nnc(-c3ccc(C(F)(F)F)cc3)o2)ccc1F ZINC001252925480 1061755839 /nfs/dbraw/zinc/75/58/39/1061755839.db2.gz BIWCHFIQUASVAG-UHFFFAOYSA-N -1 1 324.233 4.267 20 0 DIADMM C[C@@]1(c2ccccc2)C[C@@H]1NC(=O)c1cc2ccccc2cc1[O-] ZINC001465513237 1061767935 /nfs/dbraw/zinc/76/79/35/1061767935.db2.gz GRLWONTVQBHQKO-FPOVZHCZSA-N -1 1 317.388 4.005 20 0 DIADMM O=c1ccn(-c2ccc(NCc3ccc(C(F)F)cc3)cc2)[n-]1 ZINC001474229273 1061791916 /nfs/dbraw/zinc/79/19/16/1061791916.db2.gz OVVYMZHDQRNFNR-UHFFFAOYSA-N -1 1 315.323 4.128 20 0 DIADMM CCCc1cc(=O)[n-]c(SCCCc2ccc(C)cc2)n1 ZINC001458791920 1061904153 /nfs/dbraw/zinc/90/41/53/1061904153.db2.gz HHBOFRMCGYDNPR-UHFFFAOYSA-N -1 1 302.443 4.168 20 0 DIADMM CCCc1cc(=O)[n-]c(SCCCCc2ccccc2)n1 ZINC001458791002 1061904252 /nfs/dbraw/zinc/90/42/52/1061904252.db2.gz DIMPRBWAIWNEGK-UHFFFAOYSA-N -1 1 302.443 4.250 20 0 DIADMM CCCc1cc(=O)[n-]c(SCC/C=C/c2ccccc2)n1 ZINC001458795904 1061906059 /nfs/dbraw/zinc/90/60/59/1061906059.db2.gz SBTAXSHJHSMIBU-IZZDOVSWSA-N -1 1 300.427 4.330 20 0 DIADMM Cc1nc(S[C@H](C)c2ccc3c(c2)CCC3)[n-]c(=O)c1C ZINC001459019559 1061977948 /nfs/dbraw/zinc/97/79/48/1061977948.db2.gz WTGWJRRMJARWMM-GFCCVEGCSA-N -1 1 300.427 4.141 20 0 DIADMM Cc1c2ccccc2oc1[C@@H](C)NC(=O)c1c([O-])cccc1F ZINC001466860946 1062014596 /nfs/dbraw/zinc/01/45/96/1062014596.db2.gz SPESINKBCUIESH-LLVKDONJSA-N -1 1 313.328 4.077 20 0 DIADMM O=C(Nc1ccc(Br)c([O-])c1)[C@@H]1CCC=CCCC1 ZINC001466898462 1062019818 /nfs/dbraw/zinc/01/98/18/1062019818.db2.gz NQBMWTDTORIMLB-LLVKDONJSA-N -1 1 324.218 4.230 20 0 DIADMM C[C@@H](CCNC(=O)c1ncc2ccccc2c1[O-])CC(C)(C)C ZINC001466906477 1062023308 /nfs/dbraw/zinc/02/33/08/1062023308.db2.gz MDBIPCVGCIRZMO-ZDUSSCGKSA-N -1 1 314.429 4.133 20 0 DIADMM CC(=O)c1cc(NC(=O)Nc2ccc([O-])c(Cl)c2)ccc1C ZINC001466962109 1062036014 /nfs/dbraw/zinc/03/60/14/1062036014.db2.gz XOQBPKPZXWJPTM-UHFFFAOYSA-N -1 1 318.760 4.201 20 0 DIADMM C[C@@H]1CCC[C@@H](NC(=O)c2ccc(C(F)(F)F)cc2[O-])CC1 ZINC001466958866 1062037023 /nfs/dbraw/zinc/03/70/23/1062037023.db2.gz CFTDZZCCTSHZBR-ZYHUDNBSSA-N -1 1 315.335 4.110 20 0 DIADMM CN(Cc1cccc([O-])c1Cl)Cc1c(F)cccc1Cl ZINC001474415380 1062082273 /nfs/dbraw/zinc/08/22/73/1062082273.db2.gz RBSKERBTUOQIPW-UHFFFAOYSA-N -1 1 314.187 4.470 20 0 DIADMM Cc1ccccc1[C@@]1(F)CCN(Cc2cccc([O-])c2Cl)C1 ZINC001474473009 1062150330 /nfs/dbraw/zinc/15/03/30/1062150330.db2.gz JBCKKUZPRGSERE-GOSISDBHSA-N -1 1 319.807 4.425 20 0 DIADMM CCC1(CC)CCC(NC(=O)Cc2ccc([O-])c(Cl)c2)CC1 ZINC001467684134 1062180557 /nfs/dbraw/zinc/18/05/57/1062180557.db2.gz OBBDJWOUQJVDLB-UHFFFAOYSA-N -1 1 323.864 4.453 20 0 DIADMM Cc1ccccc1S(=O)(=O)[N-]c1ccccc1-c1ccco1 ZINC001254619327 1062201731 /nfs/dbraw/zinc/20/17/31/1062201731.db2.gz QFMGEWCPEOWANV-UHFFFAOYSA-N -1 1 313.378 4.056 20 0 DIADMM Cc1ccc(C)c(S(=O)(=O)[N-]c2ccc(Cl)c(C)c2)c1 ZINC001254772226 1062247811 /nfs/dbraw/zinc/24/78/11/1062247811.db2.gz ODQBSMISIKEGFR-UHFFFAOYSA-N -1 1 309.818 4.066 20 0 DIADMM C[C@H](CCc1cccc(F)c1)C(=O)Nc1ccc([O-])c(F)c1F ZINC001468003961 1062248603 /nfs/dbraw/zinc/24/86/03/1062248603.db2.gz SYGJJZQDBRLHIZ-SNVBAGLBSA-N -1 1 323.314 4.017 20 0 DIADMM CCc1ccc(S(=O)(=O)[N-]c2cccc3sccc32)cc1 ZINC001255084702 1062306873 /nfs/dbraw/zinc/30/68/73/1062306873.db2.gz CCXRMKQMPZOOKF-UHFFFAOYSA-N -1 1 317.435 4.265 20 0 DIADMM CCc1ccc(S(=O)(=O)[N-]c2cc(Cl)ccc2CC)cc1 ZINC001255085387 1062310627 /nfs/dbraw/zinc/31/06/27/1062310627.db2.gz YCCICDDKSLMFOO-UHFFFAOYSA-N -1 1 323.845 4.266 20 0 DIADMM CCSc1ccccc1C(=O)Nc1cc([O-])c(F)cc1F ZINC001468744426 1062392804 /nfs/dbraw/zinc/39/28/04/1062392804.db2.gz CIGFFXGKJNPGQX-UHFFFAOYSA-N -1 1 309.337 4.035 20 0 DIADMM Cc1cc(F)cc([N-]S(=O)(=O)c2ccc(C(C)C)cc2)c1 ZINC001255331099 1062405950 /nfs/dbraw/zinc/40/59/50/1062405950.db2.gz NIOKERIAEXCGLK-UHFFFAOYSA-N -1 1 307.390 4.058 20 0 DIADMM Cc1cc(Cl)ccc1-c1nnc(-c2cc([O-])cnc2Cl)o1 ZINC001255332826 1062406887 /nfs/dbraw/zinc/40/68/87/1062406887.db2.gz DWFIAQCQEISGBL-UHFFFAOYSA-N -1 1 322.151 4.119 20 0 DIADMM Cc1cc(Cl)ccc1-c1nnc(-c2cc(F)ccc2[O-])o1 ZINC001255347038 1062411639 /nfs/dbraw/zinc/41/16/39/1062411639.db2.gz UKYXASWOAZXCNI-UHFFFAOYSA-N -1 1 304.708 4.210 20 0 DIADMM CC(C)[C@H]1N(C(=O)c2c([O-])cccc2Cl)CC12CCCC2 ZINC001468969728 1062451885 /nfs/dbraw/zinc/45/18/85/1062451885.db2.gz VFMVVLBTBGQIRT-OAHLLOKOSA-N -1 1 307.821 4.086 20 0 DIADMM CSc1cc(NC(=O)c2cccc([O-])c2F)ccc1Cl ZINC001469020670 1062462698 /nfs/dbraw/zinc/46/26/98/1062462698.db2.gz CEFNOWBCQFSLMI-UHFFFAOYSA-N -1 1 311.765 4.159 20 0 DIADMM O=C(Nc1cc(F)cc(F)c1[O-])c1coc2ccc(Cl)cc21 ZINC001469162549 1062491663 /nfs/dbraw/zinc/49/16/63/1062491663.db2.gz WLIPXJBDLDMAIP-UHFFFAOYSA-N -1 1 323.682 4.322 20 0 DIADMM O=C(c1cccc([O-])c1F)N1Cc2ccccc2-c2ccccc21 ZINC001469661667 1062599508 /nfs/dbraw/zinc/59/95/08/1062599508.db2.gz OKJUAQIDVFNHLJ-UHFFFAOYSA-N -1 1 319.335 4.359 20 0 DIADMM CCCOc1ccc(-c2nnc(-c3cc(F)ccc3[O-])o2)cc1 ZINC001256301710 1062767873 /nfs/dbraw/zinc/76/78/73/1062767873.db2.gz IRARVLNCLOZRJT-UHFFFAOYSA-N -1 1 314.316 4.037 20 0 DIADMM CC[C@H](NC(=O)c1cccc([O-])c1F)c1cc(C)ccc1C ZINC001471167819 1062930919 /nfs/dbraw/zinc/93/09/19/1062930919.db2.gz HRVUWJSQMGXKOH-HNNXBMFYSA-N -1 1 301.361 4.029 20 0 DIADMM C/C(=C/C(=O)Nc1cccc(F)c1[O-])c1ccccc1Cl ZINC001471167017 1062932079 /nfs/dbraw/zinc/93/20/79/1062932079.db2.gz WFFRSYXPWFYEQL-KTKRTIGZSA-N -1 1 305.736 4.227 20 0 DIADMM O=S(=O)([N-]c1ccc2sccc2c1)c1cccc(Cl)c1 ZINC001256803839 1062992261 /nfs/dbraw/zinc/99/22/61/1062992261.db2.gz KYICHLQGKHLMJT-UHFFFAOYSA-N -1 1 323.826 4.356 20 0 DIADMM C[C@@]1(c2ccccc2)CCCN1C(=O)c1c([O-])cccc1Cl ZINC001471563376 1063002670 /nfs/dbraw/zinc/00/26/70/1063002670.db2.gz WHYVJNHRDAPSRM-SFHVURJKSA-N -1 1 315.800 4.197 20 0 DIADMM C[C@H]1CCCC[C@@H]1CCNC(=O)NCc1ccc([O-])c(Cl)c1 ZINC001477900888 1063014361 /nfs/dbraw/zinc/01/43/61/1063014361.db2.gz XIWGWZWIVSZOQY-GXTWGEPZSA-N -1 1 324.852 4.061 20 0 DIADMM O=C(NC(C1CCCC1)C1CCCC1)c1c([O-])cccc1F ZINC001471997670 1063041067 /nfs/dbraw/zinc/04/10/67/1063041067.db2.gz MEVZIIWRGPJUBP-UHFFFAOYSA-N -1 1 305.393 4.010 20 0 DIADMM Cc1cccc2oc(C(=O)Nc3cc(F)c([O-])cc3Cl)cc21 ZINC001472194557 1063057955 /nfs/dbraw/zinc/05/79/55/1063057955.db2.gz PQIFTWXLWCCARP-UHFFFAOYSA-N -1 1 319.719 4.492 20 0 DIADMM Cc1cccc(S(=O)(=O)[N-]c2ccc(F)c3ccccc23)c1 ZINC001256954311 1063059517 /nfs/dbraw/zinc/05/95/17/1063059517.db2.gz OGRYXXBWBUHQMQ-UHFFFAOYSA-N -1 1 315.369 4.088 20 0 DIADMM CC[C@H]1c2ccccc2CN1C(=O)c1ccc(Cl)cc1[O-] ZINC001472273621 1063068817 /nfs/dbraw/zinc/06/88/17/1063068817.db2.gz KNIOGMQAQFUMPE-HNNXBMFYSA-N -1 1 301.773 4.153 20 0 DIADMM Cc1ccc([C@@H]2C[C@H]2c2nnc(-c3cccc([O-])c3F)o2)cc1 ZINC001257325489 1063211725 /nfs/dbraw/zinc/21/17/25/1063211725.db2.gz RUNIHZZJPSLKOE-UONOGXRCSA-N -1 1 310.328 4.161 20 0 DIADMM CCC[C@@H](C)CCCSc1nc([O-])cc(=O)n1C1CCCC1 ZINC001472975736 1063336327 /nfs/dbraw/zinc/33/63/27/1063336327.db2.gz KAVZQLAAKYYFPA-CYBMUJFWSA-N -1 1 324.490 4.373 20 0 DIADMM CCOc1ccc(-c2nnc(CCCc3ccccc3)o2)c([O-])c1 ZINC001257746819 1063379895 /nfs/dbraw/zinc/37/98/95/1063379895.db2.gz JUMVFLUKGWFFRD-UHFFFAOYSA-N -1 1 324.380 4.016 20 0 DIADMM Cc1cc(C)cc(CSc2nc(C)c(C3CC3)c(=O)[n-]2)c1 ZINC001473070550 1063384264 /nfs/dbraw/zinc/38/42/64/1063384264.db2.gz QGXJLDSVFOCDHN-UHFFFAOYSA-N -1 1 300.427 4.277 20 0 DIADMM [O-]c1ccc(-c2nnc(-c3ccc4c(c3)CCC4)o2)c(Cl)c1 ZINC001258175462 1063547095 /nfs/dbraw/zinc/54/70/95/1063547095.db2.gz VQSAYPUAAHAUNJ-UHFFFAOYSA-N -1 1 312.756 4.251 20 0 DIADMM [O-]c1cccc(-c2nnc(-c3ccc4c(c3)CCC4)o2)c1Cl ZINC001258242457 1063579968 /nfs/dbraw/zinc/57/99/68/1063579968.db2.gz LZPHXGQXELGFAH-UHFFFAOYSA-N -1 1 312.756 4.251 20 0 DIADMM [O-]c1ccc(C(F)(F)F)cc1-c1nnc(CC2CCCC2)o1 ZINC001258691077 1063753806 /nfs/dbraw/zinc/75/38/06/1063753806.db2.gz OYTXRTWYTYIFBE-UHFFFAOYSA-N -1 1 312.291 4.194 20 0 DIADMM Cc1ccc(S(=O)(=O)[N-]c2ccccc2C(F)F)cc1C ZINC001259166886 1063884372 /nfs/dbraw/zinc/88/43/72/1063884372.db2.gz ASSGAXPGZBSKNC-UHFFFAOYSA-N -1 1 311.353 4.042 20 0 DIADMM Cc1cc(Cl)cc([N-]S(=O)(=O)c2ccc(C)c(C)c2)c1 ZINC001259167400 1063884456 /nfs/dbraw/zinc/88/44/56/1063884456.db2.gz SUQCCWSXESDLMS-UHFFFAOYSA-N -1 1 309.818 4.066 20 0 DIADMM Cc1cc(C(=O)Nc2cc(F)cc(F)c2[O-])c(C)cc1Cl ZINC001299581488 1063887973 /nfs/dbraw/zinc/88/79/73/1063887973.db2.gz SLUNJVLPUIBYQB-UHFFFAOYSA-N -1 1 311.715 4.193 20 0 DIADMM CCCc1cc(C(=O)Nc2cc(F)cc(F)c2[O-])sc1C ZINC001299580456 1063888027 /nfs/dbraw/zinc/88/80/27/1063888027.db2.gz GRTFNBXLJXMYCI-UHFFFAOYSA-N -1 1 311.353 4.245 20 0 DIADMM Cc1cc(C)cc(S(=O)(=O)[N-]c2c(C)cccc2C2CC2)c1 ZINC001259524808 1063889158 /nfs/dbraw/zinc/88/91/58/1063889158.db2.gz KFLZVSAPYZLTTD-UHFFFAOYSA-N -1 1 315.438 4.290 20 0 DIADMM Cc1cc(C)cc(S(=O)(=O)[N-]c2ccc(F)c(C3CC3)c2)c1 ZINC001259524694 1063889349 /nfs/dbraw/zinc/88/93/49/1063889349.db2.gz DYXKIXQACZSSLQ-UHFFFAOYSA-N -1 1 319.401 4.121 20 0 DIADMM Cc1ccc(S(=O)(=O)[N-]c2cc3cccccc-3c2)cc1F ZINC001259474873 1063889975 /nfs/dbraw/zinc/88/99/75/1063889975.db2.gz SZYSSJZYAGJWGA-UHFFFAOYSA-N -1 1 315.369 4.040 20 0 DIADMM Cc1cc(F)ccc1S(=O)(=O)[N-]c1cc2cccccc-2c1 ZINC001259485040 1063890734 /nfs/dbraw/zinc/89/07/34/1063890734.db2.gz SJMNFSNNHVVXCY-UHFFFAOYSA-N -1 1 315.369 4.040 20 0 DIADMM Cc1ccccc1CS(=O)(=O)[N-]c1cc2ccccc2s1 ZINC001260016211 1063897926 /nfs/dbraw/zinc/89/79/26/1063897926.db2.gz DWLIHVGTDLJCAM-UHFFFAOYSA-N -1 1 317.435 4.152 20 0 DIADMM Cc1cc(S(=O)(=O)[N-]c2cccc3sccc32)ccc1F ZINC001260760679 1063907114 /nfs/dbraw/zinc/90/71/14/1063907114.db2.gz ZEPXMNQQMDUTQD-UHFFFAOYSA-N -1 1 321.398 4.150 20 0 DIADMM CCCc1ccccc1[N-]S(=O)(=O)c1cccc(C)c1C ZINC001260999009 1063907597 /nfs/dbraw/zinc/90/75/97/1063907597.db2.gz LYCOLPJJZJOVDQ-UHFFFAOYSA-N -1 1 303.427 4.057 20 0 DIADMM Cc1cccc(S(=O)(=O)[N-]c2ccc3ccccc3c2)c1C ZINC001260998790 1063908326 /nfs/dbraw/zinc/90/83/26/1063908326.db2.gz VFVMPYJHXQTCNJ-UHFFFAOYSA-N -1 1 311.406 4.257 20 0 DIADMM Cc1nc(SCc2cccc(Cl)c2Cl)[n-]c(=O)c1C ZINC001307323044 1063991983 /nfs/dbraw/zinc/99/19/83/1063991983.db2.gz KVTHQFGXRNOKAV-UHFFFAOYSA-N -1 1 315.225 4.398 20 0 DIADMM CCc1ccc([N-]S(=O)(=O)c2cccc3ccccc32)cc1 ZINC000389623005 1064133007 /nfs/dbraw/zinc/13/30/07/1064133007.db2.gz FPRXCALBPCWDDL-UHFFFAOYSA-N -1 1 311.406 4.203 20 0 DIADMM O=C(c1ccc([O-])cc1F)N1CCC[C@@H]1c1ccc(Cl)cc1 ZINC001290673491 1064703525 /nfs/dbraw/zinc/70/35/25/1064703525.db2.gz HWIFJFYCSWSZLJ-MRXNPFEDSA-N -1 1 319.763 4.162 20 0 DIADMM Cc1cccc([C@H](NC(=O)c2cccc([O-])c2F)C(C)(C)C)c1 ZINC001291928486 1064750616 /nfs/dbraw/zinc/75/06/16/1064750616.db2.gz LGGIWPDZFWBCFY-KRWDZBQOSA-N -1 1 315.388 4.357 20 0 DIADMM CC(C)[C@@H]1CC[C@@H](C)C[C@H]1CNC(=O)c1c([O-])cccc1Cl ZINC001292405370 1064772717 /nfs/dbraw/zinc/77/27/17/1064772717.db2.gz JSUPVCVNHUKUKJ-RDBSUJKOSA-N -1 1 323.864 4.484 20 0 DIADMM CC(C)(CCc1ccccc1)NC(=O)c1c([O-])cccc1Cl ZINC001292715899 1064784360 /nfs/dbraw/zinc/78/43/60/1064784360.db2.gz UFTKMZSCKXYQRI-UHFFFAOYSA-N -1 1 317.816 4.187 20 0 DIADMM Cc1ccc(-c2csc(NC(=O)c3ccccc3[O-])n2)c(C)c1 ZINC001293040202 1064796218 /nfs/dbraw/zinc/79/62/18/1064796218.db2.gz ZRSNUFQRLMEXTB-UHFFFAOYSA-N -1 1 324.405 4.385 20 0 DIADMM Cc1c(NC(=O)c2cc(F)ccc2[O-])sc2c1CCCC2 ZINC001293652544 1064824774 /nfs/dbraw/zinc/82/47/74/1064824774.db2.gz YUEMQTDGHQGXAF-UHFFFAOYSA-N -1 1 305.374 4.032 20 0 DIADMM Cc1ccc([C@H]2C[C@H](C)CCN2C(=O)c2cccc([O-])c2F)o1 ZINC001294077999 1064846452 /nfs/dbraw/zinc/84/64/52/1064846452.db2.gz ONGJYXRZMNTRPB-BXUZGUMPSA-N -1 1 317.360 4.046 20 0 DIADMM CCC[C@H]1[C@H](C)CCCN1C(=O)Cc1ccc([O-])c(Cl)c1 ZINC001294211254 1064854895 /nfs/dbraw/zinc/85/48/95/1064854895.db2.gz DPCDZLFDRSDWOF-DOMZBBRYSA-N -1 1 309.837 4.015 20 0 DIADMM Cc1cc2ccccc2nc1C(=O)Nc1ccc(Cl)cc1[O-] ZINC001295972809 1064934266 /nfs/dbraw/zinc/93/42/66/1064934266.db2.gz QZKQBHBNYXTLKS-UHFFFAOYSA-N -1 1 312.756 4.155 20 0 DIADMM O=C(Nc1ccc([O-])c(F)c1F)c1[nH]c2ccccc2c1Cl ZINC001297820542 1064992066 /nfs/dbraw/zinc/99/20/66/1064992066.db2.gz PPZGIQKERLETLW-UHFFFAOYSA-N -1 1 322.698 4.057 20 0 DIADMM O=C(NCc1cc2ccccc2s1)c1ccc(Cl)cc1[O-] ZINC001298459215 1065006145 /nfs/dbraw/zinc/00/61/45/1065006145.db2.gz MWYOQAHNJZRTFN-UHFFFAOYSA-N -1 1 317.797 4.190 20 0 DIADMM CC(C)(C)c1ccc(C(=O)Nc2cc([O-])c(F)cc2F)cc1 ZINC001298969808 1065027380 /nfs/dbraw/zinc/02/73/80/1065027380.db2.gz FKLKBXOYJLIWGZ-UHFFFAOYSA-N -1 1 305.324 4.220 20 0 DIADMM O=C(NC[C@@H]1C[C@H]1c1ccccc1)c1cc2ccccc2cc1[O-] ZINC001299885930 1065037182 /nfs/dbraw/zinc/03/71/82/1065037182.db2.gz JYCXSWCTWXZQED-ROUUACIJSA-N -1 1 317.388 4.079 20 0 DIADMM O=C(Nc1cccc(F)c1[O-])c1cc(Cl)ccc1Cl ZINC001302482081 1065088777 /nfs/dbraw/zinc/08/87/77/1065088777.db2.gz QYQISZJIEPLPMB-UHFFFAOYSA-N -1 1 300.116 4.090 20 0 DIADMM CSc1ccc(Cl)c(C(=O)Nc2cccc(F)c2[O-])c1 ZINC001302482090 1065089808 /nfs/dbraw/zinc/08/98/08/1065089808.db2.gz RJTXENUHJFEDAO-UHFFFAOYSA-N -1 1 311.765 4.159 20 0 DIADMM CCC(CC)(CNC(=O)c1c([O-])cccc1Cl)C(F)(F)F ZINC001302640614 1065095388 /nfs/dbraw/zinc/09/53/88/1065095388.db2.gz GZWVEWCCJPYKCE-UHFFFAOYSA-N -1 1 323.742 4.144 20 0 DIADMM Cc1ccccc1[C@@H]1C[C@H]1C(=O)Nc1cc(F)c([O-])cc1Cl ZINC001304283955 1065136437 /nfs/dbraw/zinc/13/64/37/1065136437.db2.gz GOPWQIVFKGMXTO-NWDGAFQWSA-N -1 1 319.763 4.235 20 0 DIADMM O=C(NC[C@@H]1C[C@@H]1C1CCCC1)c1cc2ccccc2cc1[O-] ZINC001305873028 1065167126 /nfs/dbraw/zinc/16/71/26/1065167126.db2.gz FNCDJLNYAWKIMQ-DLBZAZTESA-N -1 1 309.409 4.102 20 0 DIADMM CC[C@@H](C)c1ccc(C(=O)Nc2nc(Cl)ccc2[O-])cc1 ZINC001306825232 1065193977 /nfs/dbraw/zinc/19/39/77/1065193977.db2.gz BDNBIXLAGKXZTA-SNVBAGLBSA-N -1 1 304.777 4.206 20 0 DIADMM Cc1c(=O)[n-]c(SCCCC2CC2)nc1-c1ccccc1 ZINC001307327820 1065343014 /nfs/dbraw/zinc/34/30/14/1065343014.db2.gz RPGZDOIFVAHUCM-UHFFFAOYSA-N -1 1 300.427 4.440 20 0 DIADMM Cc1nc(SCc2ccc(Cl)c(F)c2)[n-]c(=O)c1C1CC1 ZINC001307381141 1065363026 /nfs/dbraw/zinc/36/30/26/1065363026.db2.gz BXGNPZPPRJCVKR-UHFFFAOYSA-N -1 1 324.808 4.453 20 0 DIADMM Cc1cc(C)c(CNc2ccc(-n3ccc(=O)[n-]3)cc2)cc1C ZINC001308483547 1066019719 /nfs/dbraw/zinc/01/97/19/1066019719.db2.gz CGSGZEFWACPXBX-UHFFFAOYSA-N -1 1 307.397 4.115 20 0 DIADMM C[C@H]1C[C@H](c2cccc(F)c2)N(Cc2ccc([O-])c(F)c2F)C1 ZINC001308574429 1066086957 /nfs/dbraw/zinc/08/69/57/1066086957.db2.gz VSZLETLKCNGSAN-XHDPSFHLSA-N -1 1 321.342 4.393 20 0 DIADMM [O-]c1cccc(CN2CCN(C3CC3)c3ccccc32)c1Cl ZINC001308709155 1066192360 /nfs/dbraw/zinc/19/23/60/1066192360.db2.gz KPAZGRXFKCZLOQ-UHFFFAOYSA-N -1 1 314.816 4.035 20 0 DIADMM Cc1ccc(C)c(S(=O)(=O)[N-]c2ccccc2C(C)(C)C)c1 ZINC000007056492 181435480 /nfs/dbraw/zinc/43/54/80/181435480.db2.gz IGBLTCCOVISLBV-UHFFFAOYSA-N -1 1 317.454 4.402 20 0 DIADMM O=C(Nc1ccc([O-])c(Cl)c1)NC12CC3CC(CC(C3)C1)C2 ZINC000038606267 183004732 /nfs/dbraw/zinc/00/47/32/183004732.db2.gz GNSAGANLDWZFQU-UHFFFAOYSA-N -1 1 320.820 4.136 20 0 DIADMM O=C([O-])CC[C@H]1CCCN(Cc2ccc(Cl)c(Cl)c2)C1 ZINC000043585244 132156259 /nfs/dbraw/zinc/15/62/59/132156259.db2.gz WGTUZPDZBDTXRW-LLVKDONJSA-N -1 1 316.228 4.070 20 0 DIADMM Cc1nc(C(C)C)sc1-c1nc(-c2ccc([O-])c(F)c2)no1 ZINC000518302472 332009513 /nfs/dbraw/zinc/00/95/13/332009513.db2.gz YDCCNTIBUQXFFX-UHFFFAOYSA-N -1 1 319.361 4.137 20 0 DIADMM C[C@@H](c1cccc(O)c1)N(C)C(=O)c1ccc2ccccc2c1[O-] ZINC000092602229 332136051 /nfs/dbraw/zinc/13/60/51/332136051.db2.gz MCQZHVRUTUHWFY-ZDUSSCGKSA-N -1 1 321.376 4.084 20 0 DIADMM Cc1ccc(-c2ccc(CN[C@@H](CC(C)(C)C)C(=O)[O-])o2)cc1 ZINC000426829676 332155948 /nfs/dbraw/zinc/15/59/48/332155948.db2.gz QUEVKHKJDIKUDP-INIZCTEOSA-N -1 1 315.413 4.234 20 0 DIADMM Cc1ccc(F)c(CN[C@H](CC(=O)[O-])c2cccc(Cl)c2)c1 ZINC000426812845 332157159 /nfs/dbraw/zinc/15/71/59/332157159.db2.gz SHFHXCIFJHISDO-MRXNPFEDSA-N -1 1 321.779 4.093 20 0 DIADMM O=C(Cc1cccc(Cl)c1F)Nc1ccc([O-])c(Cl)c1 ZINC000564501629 332393751 /nfs/dbraw/zinc/39/37/51/332393751.db2.gz AAWHGYPGPPEHFC-UHFFFAOYSA-N -1 1 314.143 4.019 20 0 DIADMM CCc1nc(S[C@@H](CC)c2ccc(F)cc2)[n-]c(=O)c1C ZINC000566498613 332458031 /nfs/dbraw/zinc/45/80/31/332458031.db2.gz KRCMMAAULSVQSF-AWEZNQCLSA-N -1 1 306.406 4.436 20 0 DIADMM CCc1nc(SCc2ccc(C(C)C)nc2C)[n-]c(=O)c1C ZINC000566498308 332458257 /nfs/dbraw/zinc/45/82/57/332458257.db2.gz DRARCUWNBIRNES-UHFFFAOYSA-N -1 1 317.458 4.172 20 0 DIADMM CC[C@H](C)Oc1ccc(NC(=O)c2c(F)ccc([O-])c2F)cc1 ZINC000569649372 332653845 /nfs/dbraw/zinc/65/38/45/332653845.db2.gz LNSGTAJFLUOXRO-JTQLQIEISA-N -1 1 321.323 4.100 20 0 DIADMM C[C@@H](c1cc2ccccc2o1)N(C)C(=O)c1ccc([O-])cc1F ZINC000181106587 333029496 /nfs/dbraw/zinc/02/94/96/333029496.db2.gz ICBWOLLFUINAPC-NSHDSACASA-N -1 1 313.328 4.111 20 0 DIADMM C[C@H](c1cc2ccccc2o1)N(C)C(=O)c1ccc([O-])cc1F ZINC000181106606 333029498 /nfs/dbraw/zinc/02/94/98/333029498.db2.gz ICBWOLLFUINAPC-LLVKDONJSA-N -1 1 313.328 4.111 20 0 DIADMM Cc1[nH]c2ccc(Cl)cc2c1C(=O)Nc1ccc(F)cc1[O-] ZINC000533970597 333552372 /nfs/dbraw/zinc/55/23/72/333552372.db2.gz ZRHKWVSTAGTQEA-UHFFFAOYSA-N -1 1 318.735 4.227 20 0 DIADMM C/C=C\c1ccc([N-]S(=O)(=O)c2cccc(SC)c2)cc1 ZINC000571153382 333671042 /nfs/dbraw/zinc/67/10/42/333671042.db2.gz BNHQYGVROJIYLS-HYXAFXHYSA-N -1 1 319.451 4.242 20 0 DIADMM C[C@@H]1CCCC[C@@H]1N(C)C(=O)c1ccc(C(F)(F)F)cc1[O-] ZINC000436762182 333998409 /nfs/dbraw/zinc/99/84/09/333998409.db2.gz CMBXNDWPSAGMIK-MFKMUULPSA-N -1 1 315.335 4.062 20 0 DIADMM CC(C)[C@H](c1ccccc1)N(C)C(=O)c1ccc([O-])cc1F ZINC000436878613 334013374 /nfs/dbraw/zinc/01/33/74/334013374.db2.gz GBMZOLNDGRTNFV-QGZVFWFLSA-N -1 1 301.361 4.001 20 0 DIADMM CC1CCC(OCc2nc(-c3ccc([O-])cc3Cl)no2)CC1 ZINC000436872869 334013410 /nfs/dbraw/zinc/01/34/10/334013410.db2.gz NVMHKPVRDITRLO-UHFFFAOYSA-N -1 1 322.792 4.191 20 0 DIADMM CSc1nc(=O)c2sc(-c3cccc(Cl)c3)cc2[n-]1 ZINC000049068658 334306945 /nfs/dbraw/zinc/30/69/45/334306945.db2.gz GPFWWYOHZGMQLV-UHFFFAOYSA-N -1 1 308.815 4.027 20 0 DIADMM O=C(Nc1ccc(F)cc1[O-])[C@H]1C[C@H]1c1c(F)cccc1Cl ZINC000532012887 334373891 /nfs/dbraw/zinc/37/38/91/334373891.db2.gz MPZQNLAETATVPN-ZJUUUORDSA-N -1 1 323.726 4.066 20 0 DIADMM COc1cc(-c2nc([C@H]3CCCC[C@@H]3C)no2)cc(Cl)c1[O-] ZINC000443201997 338446940 /nfs/dbraw/zinc/44/69/40/338446940.db2.gz WGMSENXNXIGOLF-ONGXEEELSA-N -1 1 322.792 4.398 20 0 DIADMM Cc1nc(-c2nc(=O)c3c(-c4ccccc4)csc3[n-]2)co1 ZINC000345187117 335306342 /nfs/dbraw/zinc/30/63/42/335306342.db2.gz HVGPLAAFIPBJMA-UHFFFAOYSA-N -1 1 309.350 4.027 20 0 DIADMM Cc1ccsc1[C@@H]1C[C@@H]1c1nc(-c2ccc([O-])c(F)c2)no1 ZINC000445481228 338496486 /nfs/dbraw/zinc/49/64/86/338496486.db2.gz LYQJFQWFBIZDOF-MNOVXSKESA-N -1 1 316.357 4.222 20 0 DIADMM O=C(Cc1cc(Cl)ccc1Cl)Nc1ccc(F)cc1[O-] ZINC000532267227 335927741 /nfs/dbraw/zinc/92/77/41/335927741.db2.gz SDSCOFMQYZNTHL-UHFFFAOYSA-N -1 1 314.143 4.019 20 0 DIADMM CC(C)c1ccc2nc(-c3ccc4c(c3)C(=O)CC4)[n-]c(=O)c2c1 ZINC000520558673 335988669 /nfs/dbraw/zinc/98/86/69/335988669.db2.gz YKTVKKNIWHBJCG-UHFFFAOYSA-N -1 1 318.376 4.255 20 0 DIADMM O=C([N-]c1ccsc1Cl)c1cc(-c2cccc(F)c2)no1 ZINC000526098987 336092097 /nfs/dbraw/zinc/09/20/97/336092097.db2.gz XDGZDPCOFOIIRB-UHFFFAOYSA-N -1 1 322.748 4.448 20 0 DIADMM C[C@@H](CC(=O)Nc1ccc([O-])c(Cl)c1)c1cccc(F)c1 ZINC000116469402 336251035 /nfs/dbraw/zinc/25/10/35/336251035.db2.gz SMKNYLULHRWOQR-JTQLQIEISA-N -1 1 307.752 4.317 20 0 DIADMM O=C(Nc1ccc(F)cc1[O-])c1cc(Cl)ccc1Cl ZINC000532620858 336257078 /nfs/dbraw/zinc/25/70/78/336257078.db2.gz WJGAJXOQJCIFPO-UHFFFAOYSA-N -1 1 300.116 4.090 20 0 DIADMM O=C(Nc1ccc(F)cc1[O-])c1cc(Cl)cc(Cl)c1 ZINC000532620775 336257177 /nfs/dbraw/zinc/25/71/77/336257177.db2.gz OKSPTFOJKSTQHO-UHFFFAOYSA-N -1 1 300.116 4.090 20 0 DIADMM Cc1cnc([C@@H](C)[N-]c2nc(-c3cccc(Cl)c3)no2)s1 ZINC000301542205 336313638 /nfs/dbraw/zinc/31/36/38/336313638.db2.gz KDFGCLHEOMJFKW-SECBINFHSA-N -1 1 320.805 4.328 20 0 DIADMM C[C@H]1c2ccsc2CCN1C(=O)c1ccc2ccccc2c1[O-] ZINC000320938736 336387061 /nfs/dbraw/zinc/38/70/61/336387061.db2.gz WWZDKGVHMXLUIZ-LBPRGKRZSA-N -1 1 323.417 4.366 20 0 DIADMM Cc1ccc(Cl)c([N-]S(=O)(=O)c2ccc(Cl)s2)c1 ZINC000474310540 339409137 /nfs/dbraw/zinc/40/91/37/339409137.db2.gz KQQVATVSRAFMAL-UHFFFAOYSA-N -1 1 322.238 4.164 20 0 DIADMM O=C(c1ccc2ccccc2c1[O-])N1CCC=C(c2ccco2)C1 ZINC000376027838 337025588 /nfs/dbraw/zinc/02/55/88/337025588.db2.gz ZEPPOQDBYGWCTO-UHFFFAOYSA-N -1 1 319.360 4.068 20 0 DIADMM Cc1cccc(C)c1[N-]S(=O)(=O)c1ccc(C(F)F)cc1 ZINC000584522209 337355036 /nfs/dbraw/zinc/35/50/36/337355036.db2.gz XEHBEXPBIFODQV-UHFFFAOYSA-N -1 1 311.353 4.042 20 0 DIADMM C[C@H](Cc1nc(-c2ccc([O-])cc2Cl)no1)c1ccccc1 ZINC000445448526 337854015 /nfs/dbraw/zinc/85/40/15/337854015.db2.gz RUGCXQUUZBYXIV-LLVKDONJSA-N -1 1 314.772 4.442 20 0 DIADMM [O-]c1ccc(-c2noc(-c3ccc(C4CC4)cn3)n2)c(Cl)c1 ZINC000445450338 337986097 /nfs/dbraw/zinc/98/60/97/337986097.db2.gz YACHOYKPNBKCTA-UHFFFAOYSA-N -1 1 313.744 4.035 20 0 DIADMM COC(=O)c1c[n-]c(S[C@@H](C)c2cccc3ccccc32)n1 ZINC000516138254 338005003 /nfs/dbraw/zinc/00/50/03/338005003.db2.gz XVEIPKFQNDWHBU-NSHDSACASA-N -1 1 312.394 4.203 20 0 DIADMM [O-]c1ccc(-c2noc(-c3cncc4ccccc43)n2)c(Cl)c1 ZINC000445452246 338016519 /nfs/dbraw/zinc/01/65/19/338016519.db2.gz BGAWQDGYVBYZNQ-UHFFFAOYSA-N -1 1 323.739 4.311 20 0 DIADMM C[C@@H](Sc1ccccc1)c1nc(-c2ccc([O-])cc2F)no1 ZINC000445454532 338017199 /nfs/dbraw/zinc/01/71/99/338017199.db2.gz GNEPJVSGVUKMNF-SNVBAGLBSA-N -1 1 316.357 4.435 20 0 DIADMM [O-]c1ccc(-c2noc(/C=C\c3ccc4[nH]ccc4c3)n2)c(F)c1 ZINC000445455324 338017332 /nfs/dbraw/zinc/01/73/32/338017332.db2.gz CVIWLIXJLYCVBJ-KXFIGUGUSA-N -1 1 321.311 4.233 20 0 DIADMM Cc1ccc(O[C@@H](C)c2nc(-c3ccc([O-])cc3F)no2)cc1 ZINC000445459723 338018661 /nfs/dbraw/zinc/01/86/61/338018661.db2.gz GLKUQMREYAOPTR-NSHDSACASA-N -1 1 314.316 4.030 20 0 DIADMM [O-]c1ccc(-c2noc(-c3cc4ccccc4cc3O)n2)c(F)c1 ZINC000445460210 338019348 /nfs/dbraw/zinc/01/93/48/338019348.db2.gz OMXLWWRZVZDREP-UHFFFAOYSA-N -1 1 322.295 4.107 20 0 DIADMM C/C(=C/c1nc(-c2ccc([O-])cc2F)no1)c1ccc(F)cc1 ZINC000445462450 338026513 /nfs/dbraw/zinc/02/65/13/338026513.db2.gz CYYDVHUBGDHQAP-NTMALXAHSA-N -1 1 314.291 4.281 20 0 DIADMM CCc1ccc(-c2ccc(CN[C@@H](CC(C)C)C(=O)[O-])o2)cc1 ZINC000426647689 338036896 /nfs/dbraw/zinc/03/68/96/338036896.db2.gz QAIFKOUKEYAYFQ-KRWDZBQOSA-N -1 1 315.413 4.098 20 0 DIADMM C[C@@H](C(=O)[O-])[C@@H](NCc1ccc(Cl)cc1F)c1ccccc1 ZINC000426747152 338040555 /nfs/dbraw/zinc/04/05/55/338040555.db2.gz NGIWESWMMRYITD-BDJLRTHQSA-N -1 1 321.779 4.031 20 0 DIADMM Cc1ccccc1CN[C@@H](C(=O)[O-])c1c(Cl)cccc1Cl ZINC000426756089 338040924 /nfs/dbraw/zinc/04/09/24/338040924.db2.gz HWKHVWBYQFWICD-OAHLLOKOSA-N -1 1 324.207 4.217 20 0 DIADMM CCc1cccc(S(=O)(=O)[N-]c2cc(Cl)ccc2C)c1 ZINC000433812834 338202626 /nfs/dbraw/zinc/20/26/26/338202626.db2.gz WXTRLICDEQEBMQ-UHFFFAOYSA-N -1 1 309.818 4.012 20 0 DIADMM CCCc1ccccc1[N-]S(=O)(=O)c1ccccc1SC ZINC000436030901 338256240 /nfs/dbraw/zinc/25/62/40/338256240.db2.gz WSLSKHAJKGFIHA-UHFFFAOYSA-N -1 1 321.467 4.162 20 0 DIADMM CCc1cc(=O)[n-]c(SCCCc2ccc(Cl)cc2)n1 ZINC000436188710 338261207 /nfs/dbraw/zinc/26/12/07/338261207.db2.gz OSENQZWKJQKZHN-UHFFFAOYSA-N -1 1 308.834 4.123 20 0 DIADMM CCc1cc(=O)[n-]c(SCCCc2ccccc2Cl)n1 ZINC000436193828 338261444 /nfs/dbraw/zinc/26/14/44/338261444.db2.gz MHFDOUZJLJXHFO-UHFFFAOYSA-N -1 1 308.834 4.123 20 0 DIADMM CC(C)N(Cc1ccccc1F)C(=O)c1ccc(Cl)cc1[O-] ZINC000436536981 338275855 /nfs/dbraw/zinc/27/58/55/338275855.db2.gz WWHHDDJFBPBEOH-UHFFFAOYSA-N -1 1 321.779 4.236 20 0 DIADMM CC(C)N(Cc1cccc(Cl)c1)C(=O)c1cc(F)ccc1[O-] ZINC000436547635 338276431 /nfs/dbraw/zinc/27/64/31/338276431.db2.gz OZHOSIUVWPVMDK-UHFFFAOYSA-N -1 1 321.779 4.236 20 0 DIADMM C[C@H]1C[C@H](c2ccccc2)CN1C(=O)c1ccc(Cl)cc1[O-] ZINC000436547227 338276463 /nfs/dbraw/zinc/27/64/63/338276463.db2.gz NUKFZXRHXJBVAZ-JSGCOSHPSA-N -1 1 315.800 4.064 20 0 DIADMM CCOc1cc(-c2nc3cccc(C)c3[nH]2)cc(Cl)c1O ZINC000436557403 338276861 /nfs/dbraw/zinc/27/68/61/338276861.db2.gz NUTKPVUUISYAIY-UHFFFAOYSA-N -1 1 302.761 4.296 20 0 DIADMM Cc1cccc([C@H]2CCCN2C(=O)c2cc(F)ccc2[O-])c1C ZINC000436565244 338277212 /nfs/dbraw/zinc/27/72/12/338277212.db2.gz ULNVAARFTGNVCV-QGZVFWFLSA-N -1 1 313.372 4.125 20 0 DIADMM C[C@@H]1CN(C(=O)c2ccc3ccccc3c2[O-])[C@H]1c1ccccc1 ZINC000436574000 338277903 /nfs/dbraw/zinc/27/79/03/338277903.db2.gz KSDIFGFSRCYLBY-AUUYWEPGSA-N -1 1 317.388 4.379 20 0 DIADMM CC[C@@H](Cc1ccccc1)N(CC)C(=O)c1cc(F)ccc1[O-] ZINC000436583423 338278297 /nfs/dbraw/zinc/27/82/97/338278297.db2.gz KFWQLFUWCHDGAM-INIZCTEOSA-N -1 1 315.388 4.015 20 0 DIADMM C[C@H]1c2ccccc2CN1C(=O)c1ccc2ccccc2c1[O-] ZINC000436582419 338278419 /nfs/dbraw/zinc/27/84/19/338278419.db2.gz IBUBRNPEJNVRGS-ZDUSSCGKSA-N -1 1 303.361 4.262 20 0 DIADMM O=C(Nc1ccc(CCC(F)(F)F)cc1)c1ccccc1[O-] ZINC000436584335 338278633 /nfs/dbraw/zinc/27/86/33/338278633.db2.gz MMVPZOABJWZFQZ-UHFFFAOYSA-N -1 1 309.287 4.139 20 0 DIADMM CC[C@H](C)n1ncc(NC(=O)c2ccc(C(C)C)cc2[O-])c1C ZINC000436595501 338279058 /nfs/dbraw/zinc/27/90/58/338279058.db2.gz MPEOJFNRVYJQFK-LBPRGKRZSA-N -1 1 315.417 4.244 20 0 DIADMM Cc1ccc2c(c1)CN(C(=O)c1ccc3ccccc3c1[O-])C2 ZINC000436605492 338279580 /nfs/dbraw/zinc/27/95/80/338279580.db2.gz POQMTRFVKDKQTN-UHFFFAOYSA-N -1 1 303.361 4.010 20 0 DIADMM [O-]c1ccc(F)cc1-c1nc(-c2ccc(O)c3ccccc23)no1 ZINC000436613624 338279911 /nfs/dbraw/zinc/27/99/11/338279911.db2.gz RHALPJACYIFUPL-UHFFFAOYSA-N -1 1 322.295 4.107 20 0 DIADMM Cc1nc2cc(NC(=O)c3ccc(C(C)C)cc3[O-])ccc2o1 ZINC000436648804 338281557 /nfs/dbraw/zinc/28/15/57/338281557.db2.gz NAMSUWJARFPXMR-UHFFFAOYSA-N -1 1 310.353 4.218 20 0 DIADMM C[C@@H]1CC[C@]2(CCN(C(=O)c3ccc4ccccc4c3[O-])C2)C1 ZINC000436702095 338283302 /nfs/dbraw/zinc/28/33/02/338283302.db2.gz CYMOPIQTADSLQJ-VLIAUNLRSA-N -1 1 309.409 4.198 20 0 DIADMM C[C@H]1CC[C@]2(CCN(C(=O)c3ccc4ccccc4c3[O-])C2)C1 ZINC000436702097 338283325 /nfs/dbraw/zinc/28/33/25/338283325.db2.gz CYMOPIQTADSLQJ-XOBRGWDASA-N -1 1 309.409 4.198 20 0 DIADMM C[C@@H]1CC[C@@]2(CCN(C(=O)c3cc4ccccc4cc3[O-])C2)C1 ZINC000436702158 338283409 /nfs/dbraw/zinc/28/34/09/338283409.db2.gz DHHYVYWOAPGINI-JLTOFOAXSA-N -1 1 309.409 4.198 20 0 DIADMM C[C@H]1CC[C@@]2(CCN(C(=O)c3cc4ccccc4cc3[O-])C2)C1 ZINC000436702162 338283434 /nfs/dbraw/zinc/28/34/34/338283434.db2.gz DHHYVYWOAPGINI-VBKZILBWSA-N -1 1 309.409 4.198 20 0 DIADMM CC[C@H]1c2ccsc2CCN1C(=O)c1ccc(Cl)cc1[O-] ZINC000436723242 338284164 /nfs/dbraw/zinc/28/41/64/338284164.db2.gz MZQVRHBKVVBROT-ZDUSSCGKSA-N -1 1 321.829 4.257 20 0 DIADMM C[C@H]1CCN(C(=O)c2ccc(Cl)cc2[O-])[C@@H](c2ccco2)C1 ZINC000436728283 338284563 /nfs/dbraw/zinc/28/45/63/338284563.db2.gz JQVUIKZYJPLEIZ-SMDDNHRTSA-N -1 1 319.788 4.252 20 0 DIADMM CC[C@@H]1CCCN(C(=O)c2ccc(C(F)(F)F)cc2[O-])CC1 ZINC000436751532 338285468 /nfs/dbraw/zinc/28/54/68/338285468.db2.gz MADFJCKSMUJQKE-LLVKDONJSA-N -1 1 315.335 4.063 20 0 DIADMM CCN(C(=O)c1cc2ccccc2cc1[O-])c1ccc(OC)cc1 ZINC000436753406 338285496 /nfs/dbraw/zinc/28/54/96/338285496.db2.gz DLYYHPSMLQWLTE-UHFFFAOYSA-N -1 1 321.376 4.221 20 0 DIADMM CCN(C(=O)c1ccc(C(C)C)cc1[O-])c1ccc(F)cc1 ZINC000436755278 338285676 /nfs/dbraw/zinc/28/56/76/338285676.db2.gz MQZLBBNNIDODSV-UHFFFAOYSA-N -1 1 301.361 4.321 20 0 DIADMM O=C(c1ccc(C(F)(F)F)cc1[O-])N1CCCc2ccccc21 ZINC000436762764 338286196 /nfs/dbraw/zinc/28/61/96/338286196.db2.gz GYYUSFPKWSLHAH-UHFFFAOYSA-N -1 1 321.298 4.004 20 0 DIADMM CCC(CC)N(CC)C(=O)c1ccc(C(F)(F)F)cc1[O-] ZINC000436765131 338286280 /nfs/dbraw/zinc/28/62/80/338286280.db2.gz BCIZKUQETCHRLR-UHFFFAOYSA-N -1 1 303.324 4.062 20 0 DIADMM C[C@@H]1CCC[C@@H](N(C)C(=O)c2ccc(C(F)(F)F)cc2[O-])C1 ZINC000436764686 338286412 /nfs/dbraw/zinc/28/64/12/338286412.db2.gz SMWCYMBGHOMXHO-ZYHUDNBSSA-N -1 1 315.335 4.062 20 0 DIADMM [O-]c1c(F)cc(-c2nc3ccc(C(F)(F)F)cc3[nH]2)cc1F ZINC000436777221 338286955 /nfs/dbraw/zinc/28/69/55/338286955.db2.gz BVCYFJFIZKLMES-UHFFFAOYSA-N -1 1 314.213 4.233 20 0 DIADMM Cc1nsc(C)c1-c1noc(-c2ccc3ccccc3c2[O-])n1 ZINC000436786109 338287257 /nfs/dbraw/zinc/28/72/57/338287257.db2.gz RPQHEXNDKPRJPS-UHFFFAOYSA-N -1 1 323.377 4.336 20 0 DIADMM C[C@@H]1Cc2ccccc2N1C(=O)c1ccc(C(F)(F)F)cc1[O-] ZINC000436794939 338287690 /nfs/dbraw/zinc/28/76/90/338287690.db2.gz PQRZQPNIKNQFII-SNVBAGLBSA-N -1 1 321.298 4.002 20 0 DIADMM CC(C)(C)[C@H]1CCCN1C(=O)c1ccc(C(F)(F)F)cc1[O-] ZINC000436803983 338287914 /nfs/dbraw/zinc/28/79/14/338287914.db2.gz ABMBOQWPMJCLDH-CYBMUJFWSA-N -1 1 315.335 4.062 20 0 DIADMM O=C(N[C@@H]1CSc2ccccc21)c1ccc2ccccc2c1[O-] ZINC000436852468 338289937 /nfs/dbraw/zinc/28/99/37/338289937.db2.gz OSKOTNIYBCLVDK-MRXNPFEDSA-N -1 1 321.401 4.122 20 0 DIADMM Cc1cc(C(=O)Nc2ccc([O-])c(Cl)c2)nc2ccccc12 ZINC000436862293 338290361 /nfs/dbraw/zinc/29/03/61/338290361.db2.gz GXOOHPQGUVPGBP-UHFFFAOYSA-N -1 1 312.756 4.155 20 0 DIADMM CCOc1cc(-c2noc(C3=CCCCC3)n2)cc(Cl)c1[O-] ZINC000436868599 338290641 /nfs/dbraw/zinc/29/06/41/338290641.db2.gz AKNRZWRLUHEICZ-UHFFFAOYSA-N -1 1 320.776 4.452 20 0 DIADMM O=C(c1ccc([O-])cc1F)N(Cc1ccoc1)C1CCCCC1 ZINC000436875344 338291105 /nfs/dbraw/zinc/29/11/05/338291105.db2.gz CSIOEODFQZXQBG-UHFFFAOYSA-N -1 1 317.360 4.099 20 0 DIADMM CC(C)(C)[C@@H](NC(=O)c1ccc([O-])cc1F)c1ccccc1 ZINC000436881051 338291628 /nfs/dbraw/zinc/29/16/28/338291628.db2.gz QRAIDINGKFGDHJ-INIZCTEOSA-N -1 1 301.361 4.049 20 0 DIADMM Cc1ccc(-c2cccnc2)cc1NC(=O)c1ccccc1[O-] ZINC000436893371 338292414 /nfs/dbraw/zinc/29/24/14/338292414.db2.gz ACMPSGLVFGNZQO-UHFFFAOYSA-N -1 1 304.349 4.015 20 0 DIADMM CCCOc1ccc(-c2noc(-c3cc(F)ccc3[O-])n2)cc1 ZINC000436905188 338292970 /nfs/dbraw/zinc/29/29/70/338292970.db2.gz ZVROPDOXWLMBPZ-UHFFFAOYSA-N -1 1 314.316 4.037 20 0 DIADMM CC(C)Oc1cccc(-c2noc(-c3cc(F)ccc3[O-])n2)c1 ZINC000436916794 338293234 /nfs/dbraw/zinc/29/32/34/338293234.db2.gz XSMKHXVWNUJLHU-UHFFFAOYSA-N -1 1 314.316 4.036 20 0 DIADMM Cc1ccc(CCc2nc(-c3ccc([O-])cc3Cl)no2)s1 ZINC000436954186 338295674 /nfs/dbraw/zinc/29/56/74/338295674.db2.gz DUGRLGAUZXVYAS-UHFFFAOYSA-N -1 1 320.801 4.251 20 0 DIADMM CC[C@@H](CC(F)(F)F)NC(=O)c1ccc2ccccc2c1[O-] ZINC000436979784 338296576 /nfs/dbraw/zinc/29/65/76/338296576.db2.gz LPEJIIJGNSAMQV-NSHDSACASA-N -1 1 311.303 4.006 20 0 DIADMM CC(C)c1ccc(C(=O)N(C)c2ccc3cc[nH]c3c2)c([O-])c1 ZINC000437002379 338297305 /nfs/dbraw/zinc/29/73/05/338297305.db2.gz XOWVRUSAMVDYQS-UHFFFAOYSA-N -1 1 308.381 4.274 20 0 DIADMM CC(C)[C@H](c1ccc(F)cc1)N(C)C(=O)c1cc(F)ccc1[O-] ZINC000447860497 338569766 /nfs/dbraw/zinc/56/97/66/338569766.db2.gz HDNVCVGPZNUNKI-QGZVFWFLSA-N -1 1 319.351 4.140 20 0 DIADMM CCCc1cc(C(=O)[N-]c2cc(Cl)ccc2SC)no1 ZINC000448797600 338575262 /nfs/dbraw/zinc/57/52/62/338575262.db2.gz JNXMIICQSSEIHZ-UHFFFAOYSA-N -1 1 310.806 4.255 20 0 DIADMM O=C(c1cc2ccccc2cc1[O-])N1CCC[C@@H]1C1CCCC1 ZINC000195535395 338906088 /nfs/dbraw/zinc/90/60/88/338906088.db2.gz JFOJQBJFABDJAA-GOSISDBHSA-N -1 1 309.409 4.340 20 0 DIADMM C[C@@H]1CCc2sc(C(=O)Nc3ccc([O-])c(F)c3F)cc2C1 ZINC000456781440 338940435 /nfs/dbraw/zinc/94/04/35/338940435.db2.gz DFDDJVJWFXJHEM-MRVPVSSYSA-N -1 1 323.364 4.109 20 0 DIADMM O=C(Nc1ccc([O-])c(F)c1F)[C@@H]1CCC[C@@H]2CCCC[C@@H]12 ZINC000456781767 338940472 /nfs/dbraw/zinc/94/04/72/338940472.db2.gz JOZLMMBFXXSTHO-QJPTWQEYSA-N -1 1 309.356 4.215 20 0 DIADMM O=C(Nc1ccc([O-])c(F)c1F)[C@H]1CCC[C@H]1c1ccccc1 ZINC000456790076 338940834 /nfs/dbraw/zinc/94/08/34/338940834.db2.gz VJZYJIGMQMAUEL-STQMWFEESA-N -1 1 317.335 4.193 20 0 DIADMM C[C@H]1CCc2c(C(=O)Nc3ccc([O-])c(F)c3F)csc2C1 ZINC000456794427 338941111 /nfs/dbraw/zinc/94/11/11/338941111.db2.gz PDCWVJUVEUUWQI-QMMMGPOBSA-N -1 1 323.364 4.109 20 0 DIADMM Cc1c(F)cccc1[N-]S(=O)(=O)c1ccc(C(C)C)cc1 ZINC000467072917 339225769 /nfs/dbraw/zinc/22/57/69/339225769.db2.gz DASLOFFLGVKOBZ-UHFFFAOYSA-N -1 1 307.390 4.058 20 0 DIADMM C[C@@H](NCc1cc(O)cc(F)c1)c1ccccc1C(F)(F)F ZINC000472050518 339360795 /nfs/dbraw/zinc/36/07/95/339360795.db2.gz ZXIMLINPOSQKRP-SNVBAGLBSA-N -1 1 313.294 4.401 20 0 DIADMM Cc1ccccc1C1(C(=O)Nc2ccc([O-])c(Cl)c2)CCC1 ZINC000473074337 339380967 /nfs/dbraw/zinc/38/09/67/339380967.db2.gz RAUNVZLHRLMCGK-UHFFFAOYSA-N -1 1 315.800 4.414 20 0 DIADMM CCc1nc(C)c(NC(=O)Nc2ccc([O-])c(Cl)c2)s1 ZINC000487186281 339745597 /nfs/dbraw/zinc/74/55/97/339745597.db2.gz KGTDDQWOBZSWME-UHFFFAOYSA-N -1 1 311.794 4.017 20 0 DIADMM Cc1ccc2nc(-c3cc(C)c4ccccc4n3)[n-]c(=O)c2c1 ZINC000487502515 339755158 /nfs/dbraw/zinc/75/51/58/339755158.db2.gz MUIQJZZWWLCEGU-UHFFFAOYSA-N -1 1 301.349 4.167 20 0 DIADMM O=c1[nH]c(-c2cc([O-])cc(Cl)c2)nc2cc(Cl)ccc12 ZINC000487516130 339755485 /nfs/dbraw/zinc/75/54/85/339755485.db2.gz QEYMSOOJCYIHCM-UHFFFAOYSA-N -1 1 307.136 4.015 20 0 DIADMM CCc1ccccc1S(=O)(=O)[N-]c1ccc(Cl)cc1C ZINC000488285652 339775563 /nfs/dbraw/zinc/77/55/63/339775563.db2.gz YPFFMSDXEHTREM-UHFFFAOYSA-N -1 1 309.818 4.012 20 0 DIADMM CCC[N@H+](Cc1cccc([O-])c1Cl)[C@@H]1[C@@H]2CCO[C@H]2C1(C)C ZINC000508718433 340251358 /nfs/dbraw/zinc/25/13/58/340251358.db2.gz LEMLAULSOYEAEN-IAOVAPTHSA-N -1 1 323.864 4.071 20 0 DIADMM C[C@H](C(=O)Nc1ccc([O-])c(Cl)c1)c1cccc(Cl)c1 ZINC000509153400 340262473 /nfs/dbraw/zinc/26/24/73/340262473.db2.gz GORAEXQXYIJHFO-VIFPVBQESA-N -1 1 310.180 4.441 20 0 DIADMM O=C(Nc1ccc([O-])c(Cl)c1)c1sccc1-n1cccc1 ZINC000509179937 340263096 /nfs/dbraw/zinc/26/30/96/340263096.db2.gz BSZZPVUUSDZHFM-UHFFFAOYSA-N -1 1 318.785 4.150 20 0 DIADMM Cc1cc(NC(=O)c2ccccc2[O-])ccc1Oc1cccnc1 ZINC000303066551 340299860 /nfs/dbraw/zinc/29/98/60/340299860.db2.gz YWXYZTBMYUKSJJ-UHFFFAOYSA-N -1 1 320.348 4.140 20 0 DIADMM O=C(c1cc(Cl)ccc1[O-])N1CCC[C@@]2(CC=CCC2)C1 ZINC000303582382 340335731 /nfs/dbraw/zinc/33/57/31/340335731.db2.gz PGZASXJKQLDRJC-KRWDZBQOSA-N -1 1 305.805 4.008 20 0 DIADMM CC1(C(=O)Nc2ccc(-c3cc(=O)[nH][n-]3)cc2)CCCCCC1 ZINC000512349165 340358283 /nfs/dbraw/zinc/35/82/83/340358283.db2.gz ZPMJAWWAQAPCHM-UHFFFAOYSA-N -1 1 313.401 4.081 20 0 DIADMM COc1cccc([C@@H](C)CC(=O)Nc2ccc([O-])c(Cl)c2)c1 ZINC000176045894 340424786 /nfs/dbraw/zinc/42/47/86/340424786.db2.gz VEPWMIHBQIHXJJ-NSHDSACASA-N -1 1 319.788 4.187 20 0 DIADMM Cc1ccccc1C(C)(C)C(=O)Nc1ccc([O-])c(Cl)c1 ZINC000182863350 340485659 /nfs/dbraw/zinc/48/56/59/340485659.db2.gz YVIFSWVKIBKIMO-UHFFFAOYSA-N -1 1 303.789 4.270 20 0 DIADMM O=C(CC[C@@H]1CCCO1)Nc1cc(Cl)c([O-])c2ccccc12 ZINC000529540257 340761150 /nfs/dbraw/zinc/76/11/50/340761150.db2.gz WRRYLYKQIBBSSY-NSHDSACASA-N -1 1 319.788 4.097 20 0 DIADMM C[C@H]1CC(C(=O)[O-])C[C@H](C)N1Cc1c(Cl)cccc1Cl ZINC000530179630 340781825 /nfs/dbraw/zinc/78/18/25/340781825.db2.gz NJPDMTQFFNOIKN-UWVGGRQHSA-N -1 1 316.228 4.067 20 0 DIADMM CN(C(=O)c1ccccc1[O-])c1ccc(-c2ccccc2)cc1 ZINC000538775102 340850307 /nfs/dbraw/zinc/85/03/07/340850307.db2.gz LAKLXBCTXUFESO-UHFFFAOYSA-N -1 1 303.361 4.336 20 0 DIADMM O=C(Nc1ccc(Cl)cc1Cl)c1cc(F)ccc1[O-] ZINC000128592369 340899238 /nfs/dbraw/zinc/89/92/38/340899238.db2.gz VZLLPJWNLXNFNN-UHFFFAOYSA-N -1 1 300.116 4.090 20 0 DIADMM Cc1cccc(CSCC(=O)Nc2ccc([O-])c(Cl)c2)c1 ZINC000540959153 340953404 /nfs/dbraw/zinc/95/34/04/340953404.db2.gz MQYTYFJWZHYWPW-UHFFFAOYSA-N -1 1 321.829 4.226 20 0 DIADMM O=C(Nc1ccc(F)cc1[O-])c1ccc(SC2CC2)cc1 ZINC000544024415 341067097 /nfs/dbraw/zinc/06/70/97/341067097.db2.gz RRBBVQCVPIGNSE-UHFFFAOYSA-N -1 1 303.358 4.038 20 0 DIADMM C[C@H](c1ccc(Cl)cc1)N(C)C(=O)c1cc(F)ccc1[O-] ZINC000132891932 341148673 /nfs/dbraw/zinc/14/86/73/341148673.db2.gz ZVEPHLFZVZFSIT-SNVBAGLBSA-N -1 1 307.752 4.018 20 0 DIADMM C[C@@H](c1ccc(F)cc1)N(C)C(=O)c1ccc(Cl)cc1[O-] ZINC000136046528 341251496 /nfs/dbraw/zinc/25/14/96/341251496.db2.gz BYAVOQZUILVANL-JTQLQIEISA-N -1 1 307.752 4.018 20 0 DIADMM CCC(CC)C(=O)Nc1c([O-])cc(Br)cc1Cl ZINC000552195783 341377643 /nfs/dbraw/zinc/37/76/43/341377643.db2.gz LWIPYHGWDHKCRW-UHFFFAOYSA-N -1 1 320.614 4.183 20 0 DIADMM CC[C@@H](C)C[C@H](C)Nc1ccc(-c2nc(C)c(C)c(=O)[n-]2)cn1 ZINC000566389021 341556306 /nfs/dbraw/zinc/55/63/06/341556306.db2.gz ZYVITHWIQCJKLS-NEPJUHHUSA-N -1 1 314.433 4.098 20 0 DIADMM Cc1ccsc1S(=O)(=O)[N-]c1cccc(Cl)c1Cl ZINC000566964176 341572795 /nfs/dbraw/zinc/57/27/95/341572795.db2.gz NQUIXOCCVMKOLQ-UHFFFAOYSA-N -1 1 322.238 4.164 20 0 DIADMM C[C@@H](CCc1ccccc1)Sc1nc(C(F)F)cc(=O)[n-]1 ZINC000575909555 341814033 /nfs/dbraw/zinc/81/40/33/341814033.db2.gz JKTVFMJNNGCLHS-JTQLQIEISA-N -1 1 310.369 4.233 20 0 DIADMM Cc1nc(CNCc2ccc(C3CCCC3)cc2)ccc1C(=O)[O-] ZINC000580631866 341889359 /nfs/dbraw/zinc/88/93/59/341889359.db2.gz RNVBJSSYRLXYND-UHFFFAOYSA-N -1 1 324.424 4.036 20 0 DIADMM CCOc1ccccc1N(C)C(=O)c1cc2ccccc2cc1[O-] ZINC000121282060 517736927 /nfs/dbraw/zinc/73/69/27/517736927.db2.gz OHQWWKFITJGJRX-UHFFFAOYSA-N -1 1 321.376 4.221 20 0 DIADMM Cc1sc(CNCc2cccc([O-])c2Cl)nc1C(C)C ZINC000339255325 526877527 /nfs/dbraw/zinc/87/75/27/526877527.db2.gz RTHVAJSACTUEQL-UHFFFAOYSA-N -1 1 310.850 4.224 20 0 DIADMM O=C(Nc1cncc2ccccc21)c1cc2ccccc2cc1[O-] ZINC000396480841 1035514488 /nfs/dbraw/zinc/51/44/88/1035514488.db2.gz XNTKCJZYFAYZAA-UHFFFAOYSA-N -1 1 314.344 4.346 20 0 DIADMM Cc1ccccc1[C@@H](C)CC(=O)Nc1ccc([O-])c(Cl)c1 ZINC000533540143 1036111384 /nfs/dbraw/zinc/11/13/84/1036111384.db2.gz SGZBBCWRIAOAMK-LBPRGKRZSA-N -1 1 303.789 4.486 20 0 DIADMM CC[C@H](C)N(CC(=O)[O-])Cc1sc2ccccc2c1Cl ZINC000037599169 1036119772 /nfs/dbraw/zinc/11/97/72/1036119772.db2.gz NMMXHZABCAEIFQ-JTQLQIEISA-N -1 1 311.834 4.240 20 0 DIADMM O=C(Nc1ccc(F)cc1[O-])c1cc2cc(F)ccc2s1 ZINC000340330987 1036362114 /nfs/dbraw/zinc/36/21/14/1036362114.db2.gz XLPUTAHNFXEHHH-UHFFFAOYSA-N -1 1 305.305 4.137 20 0 DIADMM CCOc1cc(-c2nc(-c3ccc(C)o3)no2)cc(Cl)c1[O-] ZINC000683590374 1036529919 /nfs/dbraw/zinc/52/99/19/1036529919.db2.gz AZUIVKNNYPVENN-UHFFFAOYSA-N -1 1 320.732 4.063 20 0 DIADMM [O-]c1ccc(-c2noc(-c3cc4cccc(F)c4o3)n2)cc1F ZINC000683594032 1036533725 /nfs/dbraw/zinc/53/37/25/1036533725.db2.gz SUBQJRLUHVHZCG-UHFFFAOYSA-N -1 1 314.247 4.134 20 0 DIADMM FC(F)(F)c1cccc2nc([N-]c3coc4ccccc34)nn21 ZINC001203154370 1036683963 /nfs/dbraw/zinc/68/39/63/1036683963.db2.gz MRJMYZGKLSCWCH-UHFFFAOYSA-N -1 1 318.258 4.238 20 0 DIADMM COc1cc(-c2nc([C@@H]3CCC[C@H]4C[C@H]43)no2)cc(Cl)c1[O-] ZINC000656048866 1036843750 /nfs/dbraw/zinc/84/37/50/1036843750.db2.gz JLKDZYLNEOLXSE-JMJZKYOTSA-N -1 1 320.776 4.008 20 0 DIADMM Cc1noc(C(C)C)c1NC(=O)Nc1ccc([O-])c(Cl)c1 ZINC000932855796 1036907514 /nfs/dbraw/zinc/90/75/14/1036907514.db2.gz NPMUMIVIYBHQKL-UHFFFAOYSA-N -1 1 309.753 4.109 20 0 DIADMM Nc1c(F)cc(Nc2cc(Cl)c([O-])cc2Cl)cc1F ZINC001210909510 1037036322 /nfs/dbraw/zinc/03/63/22/1037036322.db2.gz LWZZRAUUVPQADU-UHFFFAOYSA-N -1 1 305.111 4.303 20 0 DIADMM [O-]c1c(Cl)cc(Nc2cc(Cl)ncc2O)cc1Cl ZINC001210925953 1037056681 /nfs/dbraw/zinc/05/66/81/1037056681.db2.gz FJIXXCNAAHYBKU-UHFFFAOYSA-N -1 1 305.548 4.197 20 0 DIADMM Cc1cnc(SC[C@@H]2CC[C@@H](c3ccccc3)C2)[n-]c1=O ZINC000580903781 1037346560 /nfs/dbraw/zinc/34/65/60/1037346560.db2.gz XJTMPCAGSWHLQW-UKRRQHHQSA-N -1 1 300.427 4.167 20 0 DIADMM O=C(Nc1ccc([O-])c(Cl)c1)Nc1cccc2cc[nH]c21 ZINC000569177587 1037424616 /nfs/dbraw/zinc/42/46/16/1037424616.db2.gz ADAJGQVWHSGFCP-UHFFFAOYSA-N -1 1 301.733 4.171 20 0 DIADMM O=C(NC1CCC2(CCCCC2)CC1)c1c(F)ccc([O-])c1F ZINC000581218256 1037480777 /nfs/dbraw/zinc/48/07/77/1037480777.db2.gz MAPCDQZVTISWAK-UHFFFAOYSA-N -1 1 323.383 4.293 20 0 DIADMM CCCOc1cccc(-c2nc(=O)c3sc(C)cc3[n-]2)c1 ZINC000656492224 1037544169 /nfs/dbraw/zinc/54/41/69/1037544169.db2.gz ZOAHWBVNTMJGIH-UHFFFAOYSA-N -1 1 300.383 4.161 20 0 DIADMM Cc1cc2[n-]c(-c3cccc(OC(C)C)c3)nc(=O)c2s1 ZINC000656490951 1037544318 /nfs/dbraw/zinc/54/43/18/1037544318.db2.gz IGKODAFBMXJZHS-UHFFFAOYSA-N -1 1 300.383 4.160 20 0 DIADMM [O-]c1ccc(-c2noc([C@H]3CC34CCSCC4)n2)c(Cl)c1 ZINC000581649102 1037835966 /nfs/dbraw/zinc/83/59/66/1037835966.db2.gz CMTDRORULFOCGO-LLVKDONJSA-N -1 1 322.817 4.096 20 0 DIADMM O=C([O-])c1ccc(CN2CCC(c3ccco3)CC2)cc1Cl ZINC000656757455 1037840946 /nfs/dbraw/zinc/84/09/46/1037840946.db2.gz ODPHGKKPERVVHP-UHFFFAOYSA-N -1 1 319.788 4.011 20 0 DIADMM CCc1cccc2cc(C[N-]c3nnc(C(F)(F)F)o3)oc21 ZINC000656773674 1037859778 /nfs/dbraw/zinc/85/97/78/1037859778.db2.gz YJFRBBXHTUCAJD-UHFFFAOYSA-N -1 1 311.263 4.009 20 0 DIADMM O=C(/C=C\c1ccc2ccccc2n1)Nc1ccc([O-])c(Cl)c1 ZINC000255385740 1038132122 /nfs/dbraw/zinc/13/21/22/1038132122.db2.gz TWDRCDIAQIGRAP-NTMALXAHSA-N -1 1 324.767 4.246 20 0 DIADMM C[C@@H](CC[N-]S(=O)(=O)c1sccc1Cl)CC(C)(C)C ZINC001211525927 1038250479 /nfs/dbraw/zinc/25/04/79/1038250479.db2.gz JQJYUZQCKMLQKE-JTQLQIEISA-N -1 1 323.911 4.142 20 0 DIADMM C[C@@H](c1ccc(Cl)cc1Cl)N1CC[C@H](C(=O)[O-])[C@H](C)C1 ZINC000312558418 1038400839 /nfs/dbraw/zinc/40/08/39/1038400839.db2.gz QWPFHHJFIFFGLQ-SCVCMEIPSA-N -1 1 316.228 4.097 20 0 DIADMM O=C(Nc1c([O-])cccc1F)c1ccc(OC2CCCC2)cc1 ZINC000605440293 1038517054 /nfs/dbraw/zinc/51/70/54/1038517054.db2.gz NWIOXJMZQBRQJK-UHFFFAOYSA-N -1 1 315.344 4.105 20 0 DIADMM [O-]c1c(Cl)ccc(CN2CC[C@@H]3CCC[C@H]3C2)c1Cl ZINC001232626114 1038608411 /nfs/dbraw/zinc/60/84/11/1038608411.db2.gz VSJGIWJNLGQSNT-QWRGUYRKSA-N -1 1 300.229 4.321 20 0 DIADMM Cc1ccc([C@H]2CCCN2[C@@H](C)c2cc(C(=O)[O-])c(C)o2)o1 ZINC000515489343 1038609825 /nfs/dbraw/zinc/60/98/25/1038609825.db2.gz BSTGUXAZWBPHLP-SMDDNHRTSA-N -1 1 303.358 4.086 20 0 DIADMM CCN(C(=O)c1ccc(C(F)(F)F)c([O-])c1)C1CCCCC1 ZINC000684870789 1038667977 /nfs/dbraw/zinc/66/79/77/1038667977.db2.gz PQURXIIKBFAQSJ-UHFFFAOYSA-N -1 1 315.335 4.206 20 0 DIADMM CC(C)[C@@H](CC(=O)Nc1c([O-])cccc1F)c1ccccc1 ZINC000608366873 1038832219 /nfs/dbraw/zinc/83/22/19/1038832219.db2.gz AJEBELHSRQUXMD-CQSZACIVSA-N -1 1 301.361 4.300 20 0 DIADMM CCc1cccc(CC)c1S(=O)(=O)[N-]c1cccc(F)c1C ZINC000608755424 1038913859 /nfs/dbraw/zinc/91/38/59/1038913859.db2.gz BMCGRLGWQOZIBN-UHFFFAOYSA-N -1 1 321.417 4.060 20 0 DIADMM O=C(Nc1ccc([O-])c(Cl)c1)c1cccc(F)c1Cl ZINC000091439116 1038937791 /nfs/dbraw/zinc/93/77/91/1038937791.db2.gz IQYFKCLLHYXZGD-UHFFFAOYSA-N -1 1 300.116 4.090 20 0 DIADMM O=C(Nc1ccc([O-])c(F)c1F)c1cc2c(s1)CCCCC2 ZINC000456792810 1039078313 /nfs/dbraw/zinc/07/83/13/1039078313.db2.gz KUTFGSBZILVWFB-UHFFFAOYSA-N -1 1 323.364 4.253 20 0 DIADMM C[C@@H](CCCc1ccccc1)C(=O)Nc1ccc([O-])c(F)c1F ZINC000456790832 1039078577 /nfs/dbraw/zinc/07/85/77/1039078577.db2.gz WLDRDVWMPSGWKG-LBPRGKRZSA-N -1 1 319.351 4.268 20 0 DIADMM CCCc1cc(C(=O)Nc2ccc([O-])c(F)c2F)sc1C ZINC000456792805 1039079517 /nfs/dbraw/zinc/07/95/17/1039079517.db2.gz KQPUBABAIKNXHR-UHFFFAOYSA-N -1 1 311.353 4.245 20 0 DIADMM Cc1nc(-c2nc(=O)c3c(C4CCCCC4)csc3[n-]2)co1 ZINC000685189937 1039437395 /nfs/dbraw/zinc/43/73/95/1039437395.db2.gz UTQHHQPFGRDYQA-UHFFFAOYSA-N -1 1 315.398 4.408 20 0 DIADMM Cc1ccc(-c2ccc(C(=O)Nc3ccc(F)cc3[O-])s2)o1 ZINC000541032698 1039614822 /nfs/dbraw/zinc/61/48/22/1039614822.db2.gz GHZKHTNBROLQSZ-UHFFFAOYSA-N -1 1 317.341 4.414 20 0 DIADMM O=C(Nc1ccc([O-])c(Cl)c1)Nc1c(F)cc(F)cc1F ZINC000192230863 1040119842 /nfs/dbraw/zinc/11/98/42/1040119842.db2.gz SSALMAPUINLQIX-UHFFFAOYSA-N -1 1 316.666 4.107 20 0 DIADMM COC[C@H](C)[C@@H](C)C(=O)Nc1cc(Cl)c([O-])c2ccccc12 ZINC000628233620 1040239123 /nfs/dbraw/zinc/23/91/23/1040239123.db2.gz MLOGPJRFWGDZGB-WDEREUQCSA-N -1 1 321.804 4.056 20 0 DIADMM CC(C)Oc1c(F)cc([N-]c2nnc(-c3ccco3)o2)cc1F ZINC001213417300 1040316776 /nfs/dbraw/zinc/31/67/76/1040316776.db2.gz INGIRNYOSCBWTB-UHFFFAOYSA-N -1 1 321.283 4.139 20 0 DIADMM CC(C)Oc1c(F)cc(Nc2cc(F)c([O-])cc2F)cc1F ZINC001213425904 1041037802 /nfs/dbraw/zinc/03/78/02/1041037802.db2.gz UVEPOYHDMTUQTQ-UHFFFAOYSA-N -1 1 315.266 4.479 20 0 DIADMM CCOc1cc(-c2noc([C@H](F)C(C)C)n2)cc(Cl)c1[O-] ZINC000809466226 1041164870 /nfs/dbraw/zinc/16/48/70/1041164870.db2.gz LBESLOFAOSCAPT-LLVKDONJSA-N -1 1 314.744 4.161 20 0 DIADMM C[C@@H](C(=O)Nc1c([O-])cccc1F)c1ccc2ccccc2c1 ZINC000084631937 1041340517 /nfs/dbraw/zinc/34/05/17/1041340517.db2.gz YRPXOQLCKZFIGZ-GFCCVEGCSA-N -1 1 309.340 4.427 20 0 DIADMM COCOc1ccc(-c2c(Cl)ccc([O-])c2F)c(C)c1C ZINC001244541198 1041392074 /nfs/dbraw/zinc/39/20/74/1041392074.db2.gz ABECDOIDUMQSBO-UHFFFAOYSA-N -1 1 310.752 4.451 20 0 DIADMM C[C@@H]1CCc2c(C(=O)Nc3cc([O-])c(F)cc3F)csc2C1 ZINC001625893433 1041496780 /nfs/dbraw/zinc/49/67/80/1041496780.db2.gz IZZXSTPZFINCFC-MRVPVSSYSA-N -1 1 323.364 4.109 20 0 DIADMM CCc1cc(=O)[n-]c(SCCO[C@H](CC)c2ccccc2)n1 ZINC000651194190 1041497530 /nfs/dbraw/zinc/49/75/30/1041497530.db2.gz WWIXKAJITUHMHM-OAHLLOKOSA-N -1 1 318.442 4.005 20 0 DIADMM O=C(Nc1cc([O-])c(F)cc1F)[C@@H]1CC[C@@H]2CCCC[C@H]2C1 ZINC001625894411 1041513686 /nfs/dbraw/zinc/51/36/86/1041513686.db2.gz WXCLGVLMMQSTED-SDDRHHMPSA-N -1 1 309.356 4.215 20 0 DIADMM Cc1cc(Cl)ncc1NC(=O)c1ccc2ccccc2c1[O-] ZINC000318919335 1041641578 /nfs/dbraw/zinc/64/15/78/1041641578.db2.gz CSZKYLYURDNVEE-UHFFFAOYSA-N -1 1 312.756 4.155 20 0 DIADMM COc1ccc(NCc2cccc([O-])c2Cl)c2ncccc12 ZINC000815136236 1041924975 /nfs/dbraw/zinc/92/49/75/1041924975.db2.gz SCSIAINRMJOKIF-UHFFFAOYSA-N -1 1 314.772 4.215 20 0 DIADMM Cc1ccc(C)c([N-]S(=O)(=O)c2ccc(C)c(Cl)c2)c1 ZINC000048652040 1042019086 /nfs/dbraw/zinc/01/90/86/1042019086.db2.gz SLXNXFONPSFORD-UHFFFAOYSA-N -1 1 309.818 4.066 20 0 DIADMM CCCC[N@@H+](CC)Cc1csc(-c2ccc(C(=O)[O-])cc2)n1 ZINC000652369107 1042026807 /nfs/dbraw/zinc/02/68/07/1042026807.db2.gz HLLQVYULEGCQNK-UHFFFAOYSA-N -1 1 318.442 4.130 20 0 DIADMM CCCCN(CC)Cc1csc(-c2ccc(C(=O)[O-])cc2)n1 ZINC000652369107 1042026813 /nfs/dbraw/zinc/02/68/13/1042026813.db2.gz HLLQVYULEGCQNK-UHFFFAOYSA-N -1 1 318.442 4.130 20 0 DIADMM C[C@@H](NC(=O)c1c([O-])cccc1F)c1cccc2ccccc21 ZINC001135509219 1042042375 /nfs/dbraw/zinc/04/23/75/1042042375.db2.gz NAXIJYSTZRJYMX-GFCCVEGCSA-N -1 1 309.340 4.176 20 0 DIADMM Cc1oc(CN(C)[C@@H](C)c2ccc(Cl)cc2)cc1C(=O)[O-] ZINC000062015129 1042107418 /nfs/dbraw/zinc/10/74/18/1042107418.db2.gz XETLUVVZYSWRDM-JTQLQIEISA-N -1 1 307.777 4.133 20 0 DIADMM Cc1cc(CN(C)[C@@H](C)c2cccc(Cl)c2)oc1C(=O)[O-] ZINC000062015279 1042107645 /nfs/dbraw/zinc/10/76/45/1042107645.db2.gz MVVUTIQGVLSXTF-NSHDSACASA-N -1 1 307.777 4.133 20 0 DIADMM CC[C@H](C(=O)[N-]OCCC1CC1)c1cccc(C(F)(F)F)c1 ZINC000817437835 1042110299 /nfs/dbraw/zinc/11/02/99/1042110299.db2.gz SAQBAASBDSEZCF-AWEZNQCLSA-N -1 1 315.335 4.047 20 0 DIADMM CC[C@@H](NC(=O)c1ccc(F)c([O-])c1)c1ccc(Cl)cc1 ZINC001135957977 1042120815 /nfs/dbraw/zinc/12/08/15/1042120815.db2.gz ZZAFVCXKZYHZML-CQSZACIVSA-N -1 1 307.752 4.066 20 0 DIADMM O=C(N[C@@H]1CC[C@@H]2CCCC[C@@H]2C1)c1cc(Cl)ccc1[O-] ZINC001136019224 1042125380 /nfs/dbraw/zinc/12/53/80/1042125380.db2.gz MWLHZOLOWLMNQV-OUCADQQQSA-N -1 1 307.821 4.134 20 0 DIADMM CN(C(=O)c1ccc([O-])cc1F)C1CCC(C(C)(C)C)CC1 ZINC001136111211 1042139268 /nfs/dbraw/zinc/13/92/68/1042139268.db2.gz NASODKKMOJNQPA-UHFFFAOYSA-N -1 1 307.409 4.208 20 0 DIADMM CC[C@H](NC(=O)c1cccc([O-])c1F)c1cccc(Cl)c1 ZINC001136183069 1042166199 /nfs/dbraw/zinc/16/61/99/1042166199.db2.gz PMUVHPZQBDKUDQ-ZDUSSCGKSA-N -1 1 307.752 4.066 20 0 DIADMM Cc1ccc([C@@H](C)N(C)C(=O)c2ncc3ccccc3c2[O-])cc1 ZINC001136186248 1042169424 /nfs/dbraw/zinc/16/94/24/1042169424.db2.gz GSGNEALBOYVFET-CQSZACIVSA-N -1 1 320.392 4.082 20 0 DIADMM CSc1ccc([O-])c(C(=O)N(C)c2cc(C)cc(C)c2)c1 ZINC001136341047 1042216724 /nfs/dbraw/zinc/21/67/24/1042216724.db2.gz NCHUWGWCVOYYTN-UHFFFAOYSA-N -1 1 301.411 4.008 20 0 DIADMM CC1(C)CC[C@@H](NC(=O)c2ccc(F)c([O-])c2)c2ccccc21 ZINC001136448225 1042251795 /nfs/dbraw/zinc/25/17/95/1042251795.db2.gz YCJWNRSMLYYTSD-MRXNPFEDSA-N -1 1 313.372 4.074 20 0 DIADMM CC[C@@H]([NH2+][C@H](C)c1nc(C)cc(=O)[nH]1)c1ccc(Cl)s1 ZINC000279045008 1042263066 /nfs/dbraw/zinc/26/30/66/1042263066.db2.gz GJSTYWYALVKTRC-NXEZZACHSA-N -1 1 311.838 4.007 20 0 DIADMM CC(C)(C)[C@@H]1CCCC[C@H]1CNC(=O)c1cc(F)ccc1[O-] ZINC001136512634 1042268091 /nfs/dbraw/zinc/26/80/91/1042268091.db2.gz FOXYFMQTFSSKFO-SWLSCSKDSA-N -1 1 307.409 4.114 20 0 DIADMM CC(C)(C)[C@H]1CCCC[C@@H]1CNC(=O)c1ccc(F)c([O-])c1 ZINC001136512869 1042268114 /nfs/dbraw/zinc/26/81/14/1042268114.db2.gz KRLWDEAINRQIGV-KGLIPLIRSA-N -1 1 307.409 4.114 20 0 DIADMM CC[C@H](NC(=O)Cc1ccc([O-])c(Cl)c1)c1ccc(C)cc1 ZINC001136536115 1042274171 /nfs/dbraw/zinc/27/41/71/1042274171.db2.gz RNJIWKORMXCKPS-INIZCTEOSA-N -1 1 317.816 4.164 20 0 DIADMM CC1CCC(C)(NC(=O)c2ccc(C(F)(F)F)cc2[O-])CC1 ZINC001136547061 1042275851 /nfs/dbraw/zinc/27/58/51/1042275851.db2.gz HVCGVRWWIOMEOP-UHFFFAOYSA-N -1 1 315.335 4.110 20 0 DIADMM CC(C)CC[C@H]1CCC[C@@H]1NC(=O)c1c([O-])cccc1Cl ZINC001136596096 1042291457 /nfs/dbraw/zinc/29/14/57/1042291457.db2.gz UNBCVWJIXDUZHW-OCCSQVGLSA-N -1 1 309.837 4.380 20 0 DIADMM CCCCN(C(=O)c1ccc(C(F)(F)F)c([O-])c1)[C@@H](C)CC ZINC001136636087 1042302975 /nfs/dbraw/zinc/30/29/75/1042302975.db2.gz LIVJGWKCAJAGKQ-NSHDSACASA-N -1 1 317.351 4.452 20 0 DIADMM [O-]c1ccc(-c2noc([C@@H]3CC[C@@H](C(F)(F)F)C3)n2)cc1F ZINC000436871254 1042338326 /nfs/dbraw/zinc/33/83/26/1042338326.db2.gz GUICCSPJALVOCB-RKDXNWHRSA-N -1 1 316.254 4.027 20 0 DIADMM O=C(Nc1ccccc1-c1ccccc1)c1cc(F)ccc1[O-] ZINC000391386698 1042339154 /nfs/dbraw/zinc/33/91/54/1042339154.db2.gz DKRSNJDDQDAXJI-UHFFFAOYSA-N -1 1 307.324 4.451 20 0 DIADMM CSc1c(F)cccc1[N-]C(=O)c1cc(C(C)(C)C)on1 ZINC000617275647 1042344883 /nfs/dbraw/zinc/34/48/83/1042344883.db2.gz FUWKJMYKHBFQLY-UHFFFAOYSA-N -1 1 308.378 4.085 20 0 DIADMM CSc1ccc([O-])c(C(=O)N2CCCCc3sccc32)c1 ZINC000614374050 1042484821 /nfs/dbraw/zinc/48/48/21/1042484821.db2.gz XQBDMMQOHOVJJW-UHFFFAOYSA-N -1 1 319.451 4.159 20 0 DIADMM CC(C)COC[C@H](NCc1cccc([O-])c1Cl)c1ccco1 ZINC000293679942 1042903847 /nfs/dbraw/zinc/90/38/47/1042903847.db2.gz VMXXUBRMNJUVTL-AWEZNQCLSA-N -1 1 323.820 4.142 20 0 DIADMM Cc1cc([C@@H](C)NC(=O)Cc2ccc([O-])c(Cl)c2)c(C)s1 ZINC001141555384 1042923558 /nfs/dbraw/zinc/92/35/58/1042923558.db2.gz GNBITDXPQDTCBS-SNVBAGLBSA-N -1 1 323.845 4.144 20 0 DIADMM Cc1ccc([C@@H](CC(=O)[O-])NCc2ccc(C(C)C)cc2)o1 ZINC000426769037 1042979930 /nfs/dbraw/zinc/97/99/30/1042979930.db2.gz FKKZVNFIGSMMND-MRXNPFEDSA-N -1 1 301.386 4.017 20 0 DIADMM CC[C@H](Oc1ccccc1C)C(=O)Nc1ccc([O-])c(Cl)c1 ZINC000440940726 1043014265 /nfs/dbraw/zinc/01/42/65/1043014265.db2.gz AHCCRHRKYQHGJN-HNNXBMFYSA-N -1 1 319.788 4.150 20 0 DIADMM Cc1cnc(-c2nc(=O)c3cc(C(C)(C)C)sc3[n-]2)s1 ZINC000416409814 1043015941 /nfs/dbraw/zinc/01/59/41/1043015941.db2.gz CVZZFQCCDJSTFR-UHFFFAOYSA-N -1 1 305.428 4.126 20 0 DIADMM [O-]c1ccc(Cl)c(Nc2c(F)cc(CO)cc2F)c1Cl ZINC001214096758 1043196166 /nfs/dbraw/zinc/19/61/66/1043196166.db2.gz JIAZUONIJYUFPZ-UHFFFAOYSA-N -1 1 320.122 4.213 20 0 DIADMM CC[C@@H](C)c1cc(C(=O)[N-]c2cc(Cl)cc(F)c2F)on1 ZINC000441565373 1043217467 /nfs/dbraw/zinc/21/74/67/1043217467.db2.gz LJQZHAUCAAGHNT-SSDOTTSWSA-N -1 1 314.719 4.372 20 0 DIADMM COc1cc(-c2nc(-c3cccc(C)c3)no2)cc(Cl)c1[O-] ZINC000443216567 1043513558 /nfs/dbraw/zinc/51/35/58/1043513558.db2.gz UOGBVJIYEKKVNO-UHFFFAOYSA-N -1 1 316.744 4.080 20 0 DIADMM CC[C@@H](c1ccc(Cl)cc1Cl)N1CCC(C(=O)[O-])CC1 ZINC000005984589 1043667243 /nfs/dbraw/zinc/66/72/43/1043667243.db2.gz ZSSWLGJQZWUEEN-AWEZNQCLSA-N -1 1 316.228 4.241 20 0 DIADMM [O-]c1cc(Cl)c(Nc2cccc(F)c2CO)cc1Cl ZINC001214614883 1043761336 /nfs/dbraw/zinc/76/13/36/1043761336.db2.gz ADAIDHBTSYACOS-UHFFFAOYSA-N -1 1 302.132 4.074 20 0 DIADMM Cc1ccc(F)cc1[N-]S(=O)(=O)c1ccc(CC(C)C)cc1 ZINC000013948438 1043912352 /nfs/dbraw/zinc/91/23/52/1043912352.db2.gz NJNBPINQJTWQOT-UHFFFAOYSA-N -1 1 321.417 4.133 20 0 DIADMM O=C(CC[C@H]1CCc2ccccc21)Nc1ccc([O-])c(F)c1F ZINC000880237018 1044022977 /nfs/dbraw/zinc/02/29/77/1044022977.db2.gz OMJZQBKQEVLNBU-GFCCVEGCSA-N -1 1 317.335 4.119 20 0 DIADMM CCSc1cccc(F)c1[N-]C(=O)c1nc(C)sc1C ZINC000291637922 1044090812 /nfs/dbraw/zinc/09/08/12/1044090812.db2.gz KJHRQOMIXHECTH-UHFFFAOYSA-N -1 1 310.419 4.263 20 0 DIADMM CC(C)Oc1ccccc1C(=O)Nc1ccc([O-])c(Cl)c1 ZINC000129588114 1044165035 /nfs/dbraw/zinc/16/50/35/1044165035.db2.gz GJMYIALTJGZPGG-UHFFFAOYSA-N -1 1 305.761 4.085 20 0 DIADMM O=C(Nc1cnn(C2CCCC2)c1)Nc1ccc([O-])c(Cl)c1 ZINC000932883817 1044174076 /nfs/dbraw/zinc/17/40/76/1044174076.db2.gz ICBKKEJSYINMPC-UHFFFAOYSA-N -1 1 320.780 4.001 20 0 DIADMM Cc1noc(-c2ccccc2)c1[N-]C(=O)c1c(C)noc1C1CC1 ZINC000131084693 1044225040 /nfs/dbraw/zinc/22/50/40/1044225040.db2.gz FWDCDLUSDGFPRL-UHFFFAOYSA-N -1 1 323.352 4.076 20 0 DIADMM COCCCCc1ccc[nH+]c1NCc1cccc(O)c1Cl ZINC000293127599 1044251219 /nfs/dbraw/zinc/25/12/19/1044251219.db2.gz ZOBMALKXMVRHMH-UHFFFAOYSA-N -1 1 320.820 4.022 20 0 DIADMM CC1(C)CN(Cc2cccc([O-])c2Cl)[C@H]1c1ccncc1 ZINC000293810550 1044332365 /nfs/dbraw/zinc/33/23/65/1044332365.db2.gz FCLZIEUESAVRFZ-INIZCTEOSA-N -1 1 302.805 4.024 20 0 DIADMM Cc1nc(C(C)C)[n-]c(=O)c1C(=O)Nc1ccc2ccccc2c1 ZINC000883955135 1044369258 /nfs/dbraw/zinc/36/92/58/1044369258.db2.gz MBQSTJKXVSAQKW-UHFFFAOYSA-N -1 1 321.380 4.020 20 0 DIADMM O=C(Nc1cc(Cl)c(Cl)cc1[O-])NC1CCCCC1 ZINC001202614850 1044374000 /nfs/dbraw/zinc/37/40/00/1044374000.db2.gz BGTBCWUYDNUZFQ-UHFFFAOYSA-N -1 1 303.189 4.153 20 0 DIADMM CC(C(=O)Nc1cc(C)cc(Br)c1[O-])=C1CCCC1 ZINC000778447736 1044405174 /nfs/dbraw/zinc/40/51/74/1044405174.db2.gz DWINJZCGYSMNRX-UHFFFAOYSA-N -1 1 324.218 4.292 20 0 DIADMM COc1c(F)c(F)ccc1Nc1cc([O-])c(Cl)cc1F ZINC001211897929 1044428198 /nfs/dbraw/zinc/42/81/98/1044428198.db2.gz VJEIYSLFJKJPTG-UHFFFAOYSA-N -1 1 303.667 4.215 20 0 DIADMM O=C(Nc1cc(F)ccc1F)Nc1cc([O-])c(Cl)cc1F ZINC001202658747 1044446553 /nfs/dbraw/zinc/44/65/53/1044446553.db2.gz WALGYXKCDNYBRA-UHFFFAOYSA-N -1 1 316.666 4.107 20 0 DIADMM O=C([O-])c1ccc(CN2CCCC[C@@H]2c2cc3ccccc3[nH]2)o1 ZINC000565956607 1044467730 /nfs/dbraw/zinc/46/77/30/1044467730.db2.gz IJKZHDYETKYOLC-QGZVFWFLSA-N -1 1 324.380 4.186 20 0 DIADMM Cc1cc(CN(C)[C@@H](C)c2cc3ccccc3o2)oc1C(=O)[O-] ZINC000566358570 1044485751 /nfs/dbraw/zinc/48/57/51/1044485751.db2.gz XPEUMEDUWIUTRK-LBPRGKRZSA-N -1 1 313.353 4.225 20 0 DIADMM Cc1c(=O)[n-]c(SCC2CC(F)(F)C2)nc1-c1ccccc1 ZINC000295293356 1044508029 /nfs/dbraw/zinc/50/80/29/1044508029.db2.gz JMCVFZLJCMEEBM-UHFFFAOYSA-N -1 1 322.380 4.295 20 0 DIADMM Cc1nc(C)c([C@@H](C)N(C)Cc2cccc([O-])c2Cl)s1 ZINC000295332953 1044509185 /nfs/dbraw/zinc/50/91/85/1044509185.db2.gz MAPMIFGPJSVTBN-SNVBAGLBSA-N -1 1 310.850 4.312 20 0 DIADMM Cc1nc(C)c([C@H](C)N(C)Cc2cccc([O-])c2Cl)s1 ZINC000295332946 1044509440 /nfs/dbraw/zinc/50/94/40/1044509440.db2.gz MAPMIFGPJSVTBN-JTQLQIEISA-N -1 1 310.850 4.312 20 0 DIADMM O=C(Nc1cc(F)c([O-])cc1Cl)C12CC3CC(CC(C3)C1)C2 ZINC000885674840 1044583857 /nfs/dbraw/zinc/58/38/57/1044583857.db2.gz WPZOWQLIAHDKJE-UHFFFAOYSA-N -1 1 323.795 4.340 20 0 DIADMM Cc1oc(C(C)C)cc1C(=O)Nc1cc(F)c([O-])cc1Cl ZINC000885678508 1044585404 /nfs/dbraw/zinc/58/54/04/1044585404.db2.gz REQPBIHJKSLGMV-UHFFFAOYSA-N -1 1 311.740 4.462 20 0 DIADMM CC(C)n1cc(Cl)c(NCc2cccc([O-])c2Cl)n1 ZINC000886366900 1044635787 /nfs/dbraw/zinc/63/57/87/1044635787.db2.gz AMBWMFPTZYHTIM-UHFFFAOYSA-N -1 1 300.189 4.089 20 0 DIADMM CC(C)(C)C(=O)CCCc1nc(-c2ccc([O-])cc2Cl)no1 ZINC000296874239 1044651350 /nfs/dbraw/zinc/65/13/50/1044651350.db2.gz NYUKYUBWQUOVGX-UHFFFAOYSA-N -1 1 322.792 4.034 20 0 DIADMM O=S(=O)([N-]c1cccc(Cl)c1)c1cccc(C(F)F)c1 ZINC000780362833 1044658640 /nfs/dbraw/zinc/65/86/40/1044658640.db2.gz GYHAZNRZUXUVLD-UHFFFAOYSA-N -1 1 317.744 4.078 20 0 DIADMM C[C@@H](c1nc(-c2ccc([O-])cc2Cl)no1)c1ccccc1F ZINC000445448978 1044718744 /nfs/dbraw/zinc/71/87/44/1044718744.db2.gz XKOKWHMKMOCQRM-SECBINFHSA-N -1 1 318.735 4.387 20 0 DIADMM [O-]c1ccc(-c2noc(-c3ccc4ccccc4n3)n2)c(Cl)c1 ZINC000445449735 1044719532 /nfs/dbraw/zinc/71/95/32/1044719532.db2.gz PFOIDCPCLXIVPA-UHFFFAOYSA-N -1 1 323.739 4.311 20 0 DIADMM CC(C)c1nc(-c2nc(-c3ccc([O-])cc3Cl)no2)cs1 ZINC000445447999 1044719581 /nfs/dbraw/zinc/71/95/81/1044719581.db2.gz JWTWPCWABXYPNM-UHFFFAOYSA-N -1 1 321.789 4.343 20 0 DIADMM Cc1cc(F)ccc1-c1nc(-c2ccc([O-])cc2Cl)no1 ZINC000445448258 1044719849 /nfs/dbraw/zinc/71/98/49/1044719849.db2.gz RKGSPGWYQFXOSS-UHFFFAOYSA-N -1 1 304.708 4.210 20 0 DIADMM [O-]c1ccc(-c2noc(Cc3cccc4ccccc43)n2)c(F)c1 ZINC000445464759 1044724997 /nfs/dbraw/zinc/72/49/97/1044724997.db2.gz WCOIOLGJGIJSIH-UHFFFAOYSA-N -1 1 320.323 4.325 20 0 DIADMM [O-]c1ccc(-c2noc([C@@H](F)Cc3ccccc3)n2)c(Cl)c1 ZINC000445446085 1044725073 /nfs/dbraw/zinc/72/50/73/1044725073.db2.gz CIWBPOIPFMJOQK-AWEZNQCLSA-N -1 1 318.735 4.349 20 0 DIADMM Cc1ccsc1[C@@H]1C[C@H]1c1nc(-c2ccc([O-])cc2F)no1 ZINC000445464874 1044726401 /nfs/dbraw/zinc/72/64/01/1044726401.db2.gz VXADHQUPMJPZRO-VXGBXAGGSA-N -1 1 316.357 4.222 20 0 DIADMM Cc1ccc2cc(-c3nc(-c4ccc([O-])c(F)c4)no3)ccc2n1 ZINC000445470540 1044727377 /nfs/dbraw/zinc/72/73/77/1044727377.db2.gz FECGRTFJUAYBOS-UHFFFAOYSA-N -1 1 321.311 4.105 20 0 DIADMM C/C(=C/c1ccc(F)cc1)c1nc(-c2ccc([O-])c(F)c2)no1 ZINC000445472304 1044728337 /nfs/dbraw/zinc/72/83/37/1044728337.db2.gz KBOSMKPKFRPJPP-NTMALXAHSA-N -1 1 314.291 4.281 20 0 DIADMM [O-]c1ccc(-c2noc(-c3ccc(Cl)cc3F)n2)cc1F ZINC000445479038 1044729433 /nfs/dbraw/zinc/72/94/33/1044729433.db2.gz UPKBLFNNQFPFEP-UHFFFAOYSA-N -1 1 308.671 4.041 20 0 DIADMM C[C@H](Cc1ccccc1F)c1nc(-c2ccc([O-])c(F)c2)no1 ZINC000445477413 1044729518 /nfs/dbraw/zinc/72/95/18/1044729518.db2.gz NZMHEJKCHOTQDF-SNVBAGLBSA-N -1 1 316.307 4.067 20 0 DIADMM Cc1c2cc(C)ccc2[nH]c1-c1nc(-c2ccc([O-])c(F)c2)no1 ZINC000445486265 1044731810 /nfs/dbraw/zinc/73/18/10/1044731810.db2.gz KLHZLRDYHOFNDC-UHFFFAOYSA-N -1 1 323.327 4.346 20 0 DIADMM [O-]c1ccc(-c2noc(-c3cc(Cl)ccc3F)n2)cc1F ZINC000445482972 1044732485 /nfs/dbraw/zinc/73/24/85/1044732485.db2.gz UKCBUAIKXKLOQD-UHFFFAOYSA-N -1 1 308.671 4.041 20 0 DIADMM COc1ccc(-c2nc(-c3cc4cc(C)ccc4o3)no2)c([O-])c1 ZINC000445774674 1044819700 /nfs/dbraw/zinc/81/97/00/1044819700.db2.gz OMYUVDYGVKFAPR-UHFFFAOYSA-N -1 1 322.320 4.172 20 0 DIADMM [O-]c1ccc(-c2noc(-c3cc4cc(F)ccc4o3)n2)c(F)c1 ZINC000573907505 1044932278 /nfs/dbraw/zinc/93/22/78/1044932278.db2.gz XUMBCJIOIUOLBW-UHFFFAOYSA-N -1 1 314.247 4.134 20 0 DIADMM COc1ccc(/C(C)=C\C(=O)Nc2ccc([O-])c(Cl)c2)cc1 ZINC001295291768 1044988253 /nfs/dbraw/zinc/98/82/53/1044988253.db2.gz AEAMBISEHWQCRT-LUAWRHEFSA-N -1 1 317.772 4.096 20 0 DIADMM Cc1c(=O)[n-]c(S[C@H]2CC[C@H](C)C2)nc1-c1ccccc1 ZINC000575198442 1044990533 /nfs/dbraw/zinc/99/05/33/1044990533.db2.gz JLNCVYMQYAMKRU-FZMZJTMJSA-N -1 1 300.427 4.438 20 0 DIADMM C[C@H](CCc1ccccc1)Sc1nc(C(F)F)cc(=O)[n-]1 ZINC000575909556 1045018066 /nfs/dbraw/zinc/01/80/66/1045018066.db2.gz JKTVFMJNNGCLHS-SNVBAGLBSA-N -1 1 310.369 4.233 20 0 DIADMM C[C@@H](NC(=O)c1c(F)ccc([O-])c1F)[C@H](C)C1CCCCC1 ZINC000577562293 1045136748 /nfs/dbraw/zinc/13/67/48/1045136748.db2.gz YBPMBCROKBJTNQ-WDEREUQCSA-N -1 1 311.372 4.005 20 0 DIADMM O=C(Nc1ccc2cc[nH]c2c1)c1ccc2ccccc2c1[O-] ZINC000447649659 1045166283 /nfs/dbraw/zinc/16/62/83/1045166283.db2.gz ZZZXRTFGVXQEPA-UHFFFAOYSA-N -1 1 302.333 4.279 20 0 DIADMM CC(C)[C@H](c1ccc(F)cc1)N(C)C(=O)c1ccc([O-])cc1F ZINC000447861066 1045183995 /nfs/dbraw/zinc/18/39/95/1045183995.db2.gz MNGJTWWKUQAMOG-QGZVFWFLSA-N -1 1 319.351 4.140 20 0 DIADMM CC1(C)C[C@@H](c2nc(-c3ccc([O-])cc3Cl)no2)C(C)(C)O1 ZINC000528168159 1045317391 /nfs/dbraw/zinc/31/73/91/1045317391.db2.gz KPPIEHHTPGOOQO-NSHDSACASA-N -1 1 322.792 4.157 20 0 DIADMM CC1(C)CC[C@H](C(=O)Nc2cc(Cl)c([O-])c3ccccc23)O1 ZINC000529538905 1045490216 /nfs/dbraw/zinc/49/02/16/1045490216.db2.gz NFUFVWLHSBBPLO-CQSZACIVSA-N -1 1 319.788 4.095 20 0 DIADMM CO[C@@H](CC(C)C)C(=O)Nc1cc(Cl)c([O-])c2ccccc12 ZINC000529538537 1045495272 /nfs/dbraw/zinc/49/52/72/1045495272.db2.gz DDQFVNBVOKSBCP-HNNXBMFYSA-N -1 1 321.804 4.198 20 0 DIADMM COCCC[C@H](C)C(=O)Nc1cc(Cl)c([O-])c2ccccc12 ZINC000628233112 1045549135 /nfs/dbraw/zinc/54/91/35/1045549135.db2.gz GZTZPIQITKZVMW-NSHDSACASA-N -1 1 321.804 4.200 20 0 DIADMM O=C(Nc1cc(Cl)c([O-])c2ccccc12)C1CC2(CC2)C1 ZINC000628233717 1045549543 /nfs/dbraw/zinc/54/95/43/1045549543.db2.gz RLRSYPPDVFRINJ-UHFFFAOYSA-N -1 1 301.773 4.328 20 0 DIADMM CC(C)CO[C@@H](C)C(=O)Nc1cc(Cl)c([O-])c2ccccc12 ZINC000628233262 1045549576 /nfs/dbraw/zinc/54/95/76/1045549576.db2.gz RUOWUXAXCZALHU-NSHDSACASA-N -1 1 321.804 4.198 20 0 DIADMM O=C([N-][C@@H]1CCc2ccc(-c3ccccc3)cc21)C(F)(F)F ZINC000779303538 1045563708 /nfs/dbraw/zinc/56/37/08/1045563708.db2.gz CYCNQKXQSUFISV-OAHLLOKOSA-N -1 1 305.299 4.019 20 0 DIADMM CCCc1ccc(CN[C@H](C)c2nc(C(=O)[O-])c(C)s2)s1 ZINC000900077074 1045598008 /nfs/dbraw/zinc/59/80/08/1045598008.db2.gz ALYNMXHQDQYZSU-SECBINFHSA-N -1 1 324.471 4.015 20 0 DIADMM Cc1sc([C@@H](C)NCc2cccc(C(C)C)c2)nc1C(=O)[O-] ZINC000900078498 1045598257 /nfs/dbraw/zinc/59/82/57/1045598257.db2.gz KIQCPVHDSQPTIZ-LLVKDONJSA-N -1 1 318.442 4.124 20 0 DIADMM CC(C)N(C(=O)c1ccc2ccc(O)cc2c1[O-])C1CCCC1 ZINC000900565175 1045647273 /nfs/dbraw/zinc/64/72/73/1045647273.db2.gz ICTXKUBZRISSCU-UHFFFAOYSA-N -1 1 313.397 4.044 20 0 DIADMM CCc1oc(CN(Cc2ccco2)C2CCCC2)cc1C(=O)[O-] ZINC000901417229 1045725247 /nfs/dbraw/zinc/72/52/47/1045725247.db2.gz IVKIQVAXKMWWCR-UHFFFAOYSA-N -1 1 317.385 4.078 20 0 DIADMM CCN(CC(=O)[O-])Cc1ccc(-c2ccc(C(C)(C)C)cc2)o1 ZINC000901427022 1045731124 /nfs/dbraw/zinc/73/11/24/1045731124.db2.gz YMXQEHZJXZXYLF-UHFFFAOYSA-N -1 1 315.413 4.151 20 0 DIADMM CC(C)Cc1csc2nc(-c3coc(C4CC4)n3)[n-]c(=O)c12 ZINC000630384508 1045755638 /nfs/dbraw/zinc/75/56/38/1045755638.db2.gz ALEDSIAQEPVIJU-UHFFFAOYSA-N -1 1 315.398 4.128 20 0 DIADMM C[C@@H]1CC[C@H](c2nc(=O)c3cc(-c4ccccc4)sc3[n-]2)O1 ZINC000630384937 1045755964 /nfs/dbraw/zinc/75/59/64/1045755964.db2.gz JPHUGGMAKWTINZ-ZWNOBZJWSA-N -1 1 312.394 4.304 20 0 DIADMM CC(F)(F)CCCSc1nc(-c2ccccc2)cc(=O)[n-]1 ZINC000901616816 1045780006 /nfs/dbraw/zinc/78/00/06/1045780006.db2.gz QMFSFBDNBZNFSM-UHFFFAOYSA-N -1 1 310.369 4.377 20 0 DIADMM C[C@H](CSc1nc(-c2ccccc2)cc(=O)[n-]1)C(F)(F)F ZINC000901619164 1045780133 /nfs/dbraw/zinc/78/01/33/1045780133.db2.gz LQJOSWQUZKXOON-SECBINFHSA-N -1 1 314.332 4.140 20 0 DIADMM CC[C@@H](C)C[C@@H](NCc1ccc(-c2ccc(F)cc2)o1)C(=O)[O-] ZINC000901674419 1045791700 /nfs/dbraw/zinc/79/17/00/1045791700.db2.gz ALFVKVIMNFATJI-MLGOLLRUSA-N -1 1 319.376 4.065 20 0 DIADMM Cc1nc(SCc2ccc3ccccc3n2)[n-]c(=O)c1C1CC1 ZINC000631025598 1045797216 /nfs/dbraw/zinc/79/72/16/1045797216.db2.gz VODKHMXIEFJNBL-UHFFFAOYSA-N -1 1 323.421 4.209 20 0 DIADMM COc1cccc([C@@H](C)Sc2nc(C)c(C3CC3)c(=O)[n-]2)c1 ZINC000631023626 1045797524 /nfs/dbraw/zinc/79/75/24/1045797524.db2.gz CKECLUWKWCOOMF-LLVKDONJSA-N -1 1 316.426 4.230 20 0 DIADMM Cc1ccc(F)c(CSc2nc(C)c(C3CC3)c(=O)[n-]2)c1 ZINC000631023205 1045798641 /nfs/dbraw/zinc/79/86/41/1045798641.db2.gz LUPFTGVZRFGJPE-UHFFFAOYSA-N -1 1 304.390 4.108 20 0 DIADMM Cc1nc(S[C@@H](C)c2ccc(F)cc2F)[n-]c(=O)c1C1CC1 ZINC000631024476 1045798655 /nfs/dbraw/zinc/79/86/55/1045798655.db2.gz VBWHITCCQAFLGG-VIFPVBQESA-N -1 1 322.380 4.500 20 0 DIADMM CC(C)(C)C[C@@H](NCc1ccc(-c2ccc(F)cc2)o1)C(=O)[O-] ZINC000901808746 1045828561 /nfs/dbraw/zinc/82/85/61/1045828561.db2.gz LEGLEAQRNYKOKP-OAHLLOKOSA-N -1 1 319.376 4.065 20 0 DIADMM Cc1cc(CNC/C=C\c2c(C)cc(C)cc2C)oc1C(=O)[O-] ZINC000901939550 1045872299 /nfs/dbraw/zinc/87/22/99/1045872299.db2.gz UTLDPPVIEXTCIA-WAYWQWQTSA-N -1 1 313.397 4.014 20 0 DIADMM CCc1oc(CN[C@@H](c2ccc(C)cc2)C2CC2)cc1C(=O)[O-] ZINC000902088547 1045909671 /nfs/dbraw/zinc/90/96/71/1045909671.db2.gz SEVSZTNHAZZCPO-SFHVURJKSA-N -1 1 313.397 4.090 20 0 DIADMM CCOc1ccccc1[C@@H](CC)NCc1csc(C(=O)[O-])c1 ZINC000902119085 1045917157 /nfs/dbraw/zinc/91/71/57/1045917157.db2.gz PWRKKKLORCOZRZ-CQSZACIVSA-N -1 1 319.426 4.086 20 0 DIADMM CCC1(CC)CN(C(=O)c2ccc([O-])cc2F)c2ccccc21 ZINC001137712016 1045944129 /nfs/dbraw/zinc/94/41/29/1045944129.db2.gz NHRZGGOZHKWRDT-UHFFFAOYSA-N -1 1 313.372 4.250 20 0 DIADMM CC[C@@H](CC(F)(F)F)c1nc(-c2ccc([O-])c(F)c2)no1 ZINC000453185051 1045972209 /nfs/dbraw/zinc/97/22/09/1045972209.db2.gz WWNLENJAGWSDHA-ZETCQYMHSA-N -1 1 304.243 4.027 20 0 DIADMM CCc1oc(CNC2(c3ccc(C)cc3)CCC2)cc1C(=O)[O-] ZINC000902309777 1045972425 /nfs/dbraw/zinc/97/24/25/1045972425.db2.gz XLMVKOLEZOVJGY-UHFFFAOYSA-N -1 1 313.397 4.018 20 0 DIADMM Cc1cc(Br)c([O-])c(NC(=O)C2=CC[C@H](C)CC2)c1 ZINC001137838162 1045980883 /nfs/dbraw/zinc/98/08/83/1045980883.db2.gz IPTBQZWGDWOPMA-VIFPVBQESA-N -1 1 324.218 4.148 20 0 DIADMM Cc1oc(CNC2(c3ccc(Cl)cc3)CCC2)cc1C(=O)[O-] ZINC000902374139 1045986377 /nfs/dbraw/zinc/98/63/77/1045986377.db2.gz XWSNEIUSBBBTRY-UHFFFAOYSA-N -1 1 319.788 4.109 20 0 DIADMM O=C([O-])c1occc1CN[C@@H](c1ccccc1F)C1CCCC1 ZINC000902383126 1045988352 /nfs/dbraw/zinc/98/83/52/1045988352.db2.gz YJQHBRQZDJXIEO-MRXNPFEDSA-N -1 1 317.360 4.138 20 0 DIADMM CC(C)(C)C(F)(F)CN[C@H]1CCC[C@H](CCCC(=O)[O-])C1 ZINC000902470947 1046002138 /nfs/dbraw/zinc/00/21/38/1046002138.db2.gz VQZINYJEUVOUEN-OLZOCXBDSA-N -1 1 305.409 4.071 20 0 DIADMM CCc1oc(CN[C@H]2CCCc3c(C)cccc32)cc1C(=O)[O-] ZINC000902466701 1046002384 /nfs/dbraw/zinc/00/23/84/1046002384.db2.gz RXTHCTXPSBSKGV-KRWDZBQOSA-N -1 1 313.397 4.016 20 0 DIADMM O=C([O-])c1ccc(CNCc2cccc(Oc3ccccc3)c2)o1 ZINC000756286680 1046062406 /nfs/dbraw/zinc/06/24/06/1046062406.db2.gz UIYOZTBTMKYULF-UHFFFAOYSA-N -1 1 323.348 4.060 20 0 DIADMM CC(C)[C@H]1CCc2[n-]n(Cc3cnc4ccccc4c3)c(=O)c2C1 ZINC000634618155 1046079847 /nfs/dbraw/zinc/07/98/47/1046079847.db2.gz IOSLFVYZUBXSQQ-DOTOQJQBSA-N -1 1 321.424 4.005 20 0 DIADMM C[C@H](C(=O)Nc1ccc(F)cc1[O-])c1ccc2ccccc2c1 ZINC000532266801 1046125357 /nfs/dbraw/zinc/12/53/57/1046125357.db2.gz VAKCFXLPYSPKHK-LBPRGKRZSA-N -1 1 309.340 4.427 20 0 DIADMM CC(C)c1cccc(O[C@@H](C)C(=O)Nc2ccc(F)cc2[O-])c1 ZINC000532266771 1046126611 /nfs/dbraw/zinc/12/66/11/1046126611.db2.gz ZZQOARBLMAHDSS-LBPRGKRZSA-N -1 1 317.360 4.061 20 0 DIADMM Oc1cccnc1C[N@H+]1CC[C@@H](c2cccc(Cl)c2Cl)C1 ZINC001138394301 1046162001 /nfs/dbraw/zinc/16/20/01/1046162001.db2.gz NAQXGVBPJVIOPI-LLVKDONJSA-N -1 1 323.223 4.084 20 0 DIADMM Cc1ccc(C(F)(F)C(=O)[N-][C@@H](C(C)(C)C)C(F)(F)F)cc1 ZINC000779963805 1046178989 /nfs/dbraw/zinc/17/89/89/1046178989.db2.gz NJZOGYMKZDAZCU-NSHDSACASA-N -1 1 323.305 4.180 20 0 DIADMM CC(C)Oc1ccccc1[C@@H](C)NCc1ccc(C(=O)[O-])s1 ZINC000903677133 1046298848 /nfs/dbraw/zinc/29/88/48/1046298848.db2.gz KPHPSENGJZMLMP-GFCCVEGCSA-N -1 1 319.426 4.084 20 0 DIADMM Cc1ccc([N-]S(=O)(=O)c2cccc(C(F)F)c2)cc1C ZINC000780362374 1046382133 /nfs/dbraw/zinc/38/21/33/1046382133.db2.gz BELMJVWPZPRRGC-UHFFFAOYSA-N -1 1 311.353 4.042 20 0 DIADMM C[C@@H]1CCC[C@H](CNC(=O)c2ccc3ccccc3c2[O-])[C@@H]1C ZINC001139524515 1046463676 /nfs/dbraw/zinc/46/36/76/1046463676.db2.gz SFAIHEJQOLRWGE-IIAWOOMASA-N -1 1 311.425 4.348 20 0 DIADMM Cc1c2cccc(F)c2oc1C(=O)Nc1ccc(Cl)cc1[O-] ZINC000677212375 1046474610 /nfs/dbraw/zinc/47/46/10/1046474610.db2.gz NARHNJPEFKCUCG-UHFFFAOYSA-N -1 1 319.719 4.492 20 0 DIADMM CCc1ccc(N(CC(C)C)C(=O)c2cccc([O-])c2F)cc1 ZINC001139989605 1046562870 /nfs/dbraw/zinc/56/28/70/1046562870.db2.gz RPODHTIRYBLUJO-UHFFFAOYSA-N -1 1 315.388 4.397 20 0 DIADMM Cn1cc(NCc2cccc([O-])c2Cl)c(-c2ccccc2)n1 ZINC000645171912 1046775591 /nfs/dbraw/zinc/77/55/91/1046775591.db2.gz OLUFQCLDMZXBQL-UHFFFAOYSA-N -1 1 313.788 4.058 20 0 DIADMM CSc1cccc(F)c1CNCc1cccc([O-])c1Cl ZINC000645180771 1046776346 /nfs/dbraw/zinc/77/63/46/1046776346.db2.gz WDJPSKSKQPMEMQ-UHFFFAOYSA-N -1 1 311.809 4.196 20 0 DIADMM [O-]c1c(Cl)c(Cl)ccc1Nc1ccc(O)c(F)c1F ZINC001212013632 1046820054 /nfs/dbraw/zinc/82/00/54/1046820054.db2.gz BDEJKTDMZYAQAW-UHFFFAOYSA-N -1 1 306.095 4.426 20 0 DIADMM C[C@H](C(=O)Nc1ccc([O-])c(F)c1F)c1ccc(Cl)cc1 ZINC001140657129 1046838672 /nfs/dbraw/zinc/83/86/72/1046838672.db2.gz KPZHXHZAFGOERI-QMMMGPOBSA-N -1 1 311.715 4.066 20 0 DIADMM Cc1cc(O)c(C(C)C)cc1NC(=O)c1c(F)ccc([O-])c1F ZINC000798302068 1046946138 /nfs/dbraw/zinc/94/61/38/1046946138.db2.gz XTJXRGAAKRWCTG-UHFFFAOYSA-N -1 1 321.323 4.060 20 0 DIADMM CCCN(C(=O)c1cccc([O-])c1F)c1ccc(CC)cc1 ZINC001141069647 1046995516 /nfs/dbraw/zinc/99/55/16/1046995516.db2.gz XITMMMWLEOOWII-UHFFFAOYSA-N -1 1 301.361 4.151 20 0 DIADMM CSc1ccccc1NC(=O)c1ccc(C(C)C)cc1[O-] ZINC001141287358 1047076648 /nfs/dbraw/zinc/07/66/48/1047076648.db2.gz SKVKBTVBINRJKS-UHFFFAOYSA-N -1 1 301.411 4.490 20 0 DIADMM CC[C@@H](NC(=O)c1ccc([O-])c(F)c1)c1cccc(Cl)c1 ZINC000681017447 1047083640 /nfs/dbraw/zinc/08/36/40/1047083640.db2.gz YYKZHCDKYLFJGL-CQSZACIVSA-N -1 1 307.752 4.066 20 0 DIADMM CC(C)Oc1c(Cl)cccc1NC(=O)c1ccc([O-])c(F)c1 ZINC000681048350 1047086652 /nfs/dbraw/zinc/08/66/52/1047086652.db2.gz UOXNVVNZHBIBND-UHFFFAOYSA-N -1 1 323.751 4.224 20 0 DIADMM Cc1ccc([C@H]2C[C@@H](C)CCN2C(=O)c2ccc([O-])c(F)c2)o1 ZINC000681052327 1047088376 /nfs/dbraw/zinc/08/83/76/1047088376.db2.gz ONPWNWPYBHXSSL-XHDPSFHLSA-N -1 1 317.360 4.046 20 0 DIADMM CCC(C)(CC)C(=O)Nc1cc(C)cc(Br)c1[O-] ZINC000681065363 1047088968 /nfs/dbraw/zinc/08/89/68/1047088968.db2.gz TZGTXAGPYRJZFJ-UHFFFAOYSA-N -1 1 314.223 4.228 20 0 DIADMM CC(C)c1ccc(C[C@@H](C)NC(=O)c2ccc([O-])c(F)c2)cc1 ZINC000681066083 1047089580 /nfs/dbraw/zinc/08/95/80/1047089580.db2.gz LYRWIJFMALMCJE-CYBMUJFWSA-N -1 1 315.388 4.016 20 0 DIADMM CCCC[C@@H](C)N(CCCC)C(=O)c1cc(C)cc(C=O)c1[O-] ZINC001141324040 1047090228 /nfs/dbraw/zinc/09/02/28/1047090228.db2.gz RVWHPKUMCDDNRI-OAHLLOKOSA-N -1 1 319.445 4.334 20 0 DIADMM CCc1ccc2nc(-c3cccc(OC(C)C)c3)[n-]c(=O)c2c1 ZINC001116077047 1047106259 /nfs/dbraw/zinc/10/62/59/1047106259.db2.gz YONBJMWAWQCCSW-UHFFFAOYSA-N -1 1 308.381 4.352 20 0 DIADMM CCC[C@H](C)[C@@H]1CCCN1C(=O)Cc1ccc([O-])c(Cl)c1 ZINC001137435592 1047112767 /nfs/dbraw/zinc/11/27/67/1047112767.db2.gz AGOWRCHLFUKQRS-WFASDCNBSA-N -1 1 309.837 4.015 20 0 DIADMM CC(C)(CC(F)(F)F)NC(=O)c1ccc2ccccc2c1[O-] ZINC000682020269 1047162451 /nfs/dbraw/zinc/16/24/51/1047162451.db2.gz HEMKSJGBCXNQQV-UHFFFAOYSA-N -1 1 311.303 4.006 20 0 DIADMM O=C(Nc1ccc(Br)c([O-])c1)C1CCCCCC1 ZINC001116737429 1047174176 /nfs/dbraw/zinc/17/41/76/1047174176.db2.gz SIZDIGSVGCJOAI-UHFFFAOYSA-N -1 1 312.207 4.064 20 0 DIADMM C[C@@H](c1ccccc1)N(C(=O)c1c([O-])cccc1Cl)C1CC1 ZINC001117256444 1047221314 /nfs/dbraw/zinc/22/13/14/1047221314.db2.gz RRGOGIFAISNCOQ-LBPRGKRZSA-N -1 1 315.800 4.411 20 0 DIADMM Cc1nc(NC(=O)c2cc(F)ccc2[O-])ccc1-c1ccccc1 ZINC001141615384 1047225596 /nfs/dbraw/zinc/22/55/96/1047225596.db2.gz GMUAAOVVJQQHPC-UHFFFAOYSA-N -1 1 322.339 4.154 20 0 DIADMM CCc1ccc(NC(=O)Nc2ccc([O-])c(Cl)c2)cc1F ZINC000476135625 1047231822 /nfs/dbraw/zinc/23/18/22/1047231822.db2.gz GFIHZQMMEJYGIO-UHFFFAOYSA-N -1 1 308.740 4.391 20 0 DIADMM CC[C@H](C)c1ccc(C(=O)Nc2cc([O-])c(F)cc2F)cc1 ZINC001141833746 1047295982 /nfs/dbraw/zinc/29/59/82/1047295982.db2.gz LEVFOXLCAKWEBZ-JTQLQIEISA-N -1 1 305.324 4.436 20 0 DIADMM CC1(C)CC[C@H](NC(=O)c2c([O-])cccc2F)c2ccccc21 ZINC001142531966 1047320005 /nfs/dbraw/zinc/32/00/05/1047320005.db2.gz RMTPTEYLXWNIRE-HNNXBMFYSA-N -1 1 313.372 4.074 20 0 DIADMM O=C(c1ccc([O-])c(F)c1)N(Cc1ccccc1)c1ccccc1 ZINC001142019842 1047348034 /nfs/dbraw/zinc/34/80/34/1047348034.db2.gz WMTKWMQBSVHLBE-UHFFFAOYSA-N -1 1 321.351 4.378 20 0 DIADMM O=C([O-])C[N@@H+](Cc1c(Cl)cccc1Cl)C1CCCCC1 ZINC000652482459 1047362693 /nfs/dbraw/zinc/36/26/93/1047362693.db2.gz BIEWMZMAMQZADW-UHFFFAOYSA-N -1 1 316.228 4.213 20 0 DIADMM Cc1cccc([C@H]2CCCN2C(=O)c2ccc(Cl)cc2[O-])c1 ZINC001142073527 1047369827 /nfs/dbraw/zinc/36/98/27/1047369827.db2.gz JIQBZGBILDYISQ-MRXNPFEDSA-N -1 1 315.800 4.331 20 0 DIADMM O=C(c1c([O-])cccc1Cl)N1CCC2(CCCCC2)CC1 ZINC000726627941 1047371419 /nfs/dbraw/zinc/37/14/19/1047371419.db2.gz QPDGHPFEWZOHNB-UHFFFAOYSA-N -1 1 307.821 4.232 20 0 DIADMM CCCN(C)c1ccc(C(=O)Nc2ccc([O-])c(Cl)c2)cc1 ZINC000749391479 1047415951 /nfs/dbraw/zinc/41/59/51/1047415951.db2.gz BDHRAXYRZPSIIA-UHFFFAOYSA-N -1 1 318.804 4.144 20 0 DIADMM O=C(Nc1cc(F)cc(F)c1[O-])[C@H]1CCC[C@@H]1c1ccccc1 ZINC001142541758 1047466522 /nfs/dbraw/zinc/46/65/22/1047466522.db2.gz GNYDXJDVMKPHHM-KGLIPLIRSA-N -1 1 317.335 4.193 20 0 DIADMM O=C(Nc1cc(F)cc(F)c1[O-])[C@H]1CCC[C@H]1c1ccccc1 ZINC001142541757 1047466534 /nfs/dbraw/zinc/46/65/34/1047466534.db2.gz GNYDXJDVMKPHHM-KBPBESRZSA-N -1 1 317.335 4.193 20 0 DIADMM O=C(Nc1cc(F)cc(F)c1[O-])[C@@H]1CCC[C@@H]1c1ccccc1 ZINC001142541760 1047466739 /nfs/dbraw/zinc/46/67/39/1047466739.db2.gz GNYDXJDVMKPHHM-ZIAGYGMSSA-N -1 1 317.335 4.193 20 0 DIADMM CC(C)(C)c1ccc(CC(=O)Nc2cc(F)cc(F)c2[O-])cc1 ZINC001142541738 1047466834 /nfs/dbraw/zinc/46/68/34/1047466834.db2.gz FZGVCUMWKRGBGX-UHFFFAOYSA-N -1 1 319.351 4.149 20 0 DIADMM Cc1cccc([C@H](c2noc(-c3ccc(N)cc3[O-])n2)C(C)C)c1 ZINC000843234117 1047534948 /nfs/dbraw/zinc/53/49/48/1047534948.db2.gz LOHWQVAYTWNKAH-QGZVFWFLSA-N -1 1 323.396 4.121 20 0 DIADMM Cc1ccc2sc(NC(=O)c3cc(F)ccc3[O-])nc2c1C ZINC001151686948 1047599948 /nfs/dbraw/zinc/59/99/48/1047599948.db2.gz FECSBWISPBVYRD-UHFFFAOYSA-N -1 1 316.357 4.010 20 0 DIADMM CC[C@@H](NC(=O)c1c([O-])cccc1F)c1cc(C)ccc1C ZINC001151785735 1047601513 /nfs/dbraw/zinc/60/15/13/1047601513.db2.gz LGKZNKVNPPLZST-OAHLLOKOSA-N -1 1 301.361 4.029 20 0 DIADMM O=C(c1c([O-])cccc1Cl)N1CCC[C@@H](C2CCC2)CC1 ZINC001152802836 1047615683 /nfs/dbraw/zinc/61/56/83/1047615683.db2.gz FQMZEFQRAOXQID-CYBMUJFWSA-N -1 1 307.821 4.088 20 0 DIADMM CC(C)c1ccc(C(=O)Nc2cncc3ccccc32)c([O-])c1 ZINC001153244242 1047620613 /nfs/dbraw/zinc/62/06/13/1047620613.db2.gz OORXCLKEZYDILU-UHFFFAOYSA-N -1 1 306.365 4.316 20 0 DIADMM O=C(Nc1ccc2c(c1)N=NC2)c1c([O-])ccc2ccccc21 ZINC001153505405 1047626742 /nfs/dbraw/zinc/62/67/42/1047626742.db2.gz WUQWJDKPURAMBS-UHFFFAOYSA-N -1 1 303.321 4.395 20 0 DIADMM C[C@H]1CCN(C(=O)c2c([O-])ccc3ccccc32)CCC1(F)F ZINC001153499593 1047627152 /nfs/dbraw/zinc/62/71/52/1047627152.db2.gz YWHHRCUWIWPZSK-LBPRGKRZSA-N -1 1 319.351 4.053 20 0 DIADMM Cc1cc(C)c(NC(=O)c2c(O)cc3ccccc3c2[O-])cc1C ZINC001154027821 1047638169 /nfs/dbraw/zinc/63/81/69/1047638169.db2.gz CXDDXOGLEMXGFS-UHFFFAOYSA-N -1 1 321.376 4.429 20 0 DIADMM CC(=O)c1ccc(-c2nc3ccc(C(C)C)cc3c(=O)[n-]2)c(F)c1 ZINC000538509779 1047685132 /nfs/dbraw/zinc/68/51/32/1047685132.db2.gz QVFHIGCMFWMSCG-UHFFFAOYSA-N -1 1 324.355 4.468 20 0 DIADMM Cc1ccc2ccc(C(=O)Nc3ccc4c(c3)N=NC4)c([O-])c2n1 ZINC001155660618 1047686167 /nfs/dbraw/zinc/68/61/67/1047686167.db2.gz VDMROFNBJDOVKN-UHFFFAOYSA-N -1 1 318.336 4.098 20 0 DIADMM CSc1cccc([N-]S(=O)(=O)c2ccc(C)c(C)c2)c1C ZINC000539190350 1047741003 /nfs/dbraw/zinc/74/10/03/1047741003.db2.gz RDXLFRLSONRCOK-UHFFFAOYSA-N -1 1 321.467 4.135 20 0 DIADMM O=C(Nc1nccc2ccccc21)c1ccc2ccccc2c1[O-] ZINC001157872472 1047760760 /nfs/dbraw/zinc/76/07/60/1047760760.db2.gz HAQGRFNCNWIBBO-UHFFFAOYSA-N -1 1 314.344 4.346 20 0 DIADMM CC(C)(C)c1ccc(NC(=O)c2ccc3ccccc3c2[O-])cn1 ZINC001158447465 1047780378 /nfs/dbraw/zinc/78/03/78/1047780378.db2.gz GZYFCYODOSZPLP-UHFFFAOYSA-N -1 1 320.392 4.490 20 0 DIADMM C=Cc1ccc(CCNC(=O)c2cc3ccccc3cc2[O-])cc1 ZINC001159079340 1047811079 /nfs/dbraw/zinc/81/10/79/1047811079.db2.gz WHARIIBEUSUUPG-UHFFFAOYSA-N -1 1 317.388 4.161 20 0 DIADMM Fc1ccc2oc([N-]c3cc([C@@H]4CCCCN4)no3)cc2c1 ZINC001159312630 1047831527 /nfs/dbraw/zinc/83/15/27/1047831527.db2.gz DAPGQMAXZZJGOO-LBPRGKRZSA-N -1 1 301.321 4.118 20 0 DIADMM CC(C)=CNc1cccc(C([O-])(C(F)(F)F)C(F)(F)F)c1 ZINC001174558471 1047904273 /nfs/dbraw/zinc/90/42/73/1047904273.db2.gz KFGRENAKWQDRNW-UHFFFAOYSA-N -1 1 313.241 4.334 20 0 DIADMM Cc1ccc(NC(=S)Nc2cc([O-])c(F)cc2F)c(C)c1 ZINC001197986554 1047916238 /nfs/dbraw/zinc/91/62/38/1047916238.db2.gz AELXHLSDSXSARH-UHFFFAOYSA-N -1 1 308.353 4.096 20 0 DIADMM CCO[C@@H](C)n1cc(Nc2c(Cl)ccc([O-])c2Cl)cn1 ZINC001174704933 1047946857 /nfs/dbraw/zinc/94/68/57/1047946857.db2.gz UVBZMDKYWXZIKP-QMMMGPOBSA-N -1 1 316.188 4.194 20 0 DIADMM COc1ccc(C(F)(F)F)cc1Nc1ccnc(Cl)c1[O-] ZINC001174777479 1047970357 /nfs/dbraw/zinc/97/03/57/1047970357.db2.gz ZGTXZYDLXIPDNQ-UHFFFAOYSA-N -1 1 318.682 4.212 20 0 DIADMM CC(C)c1cccc([N-]S(=O)(=O)c2ccc3occc3c2)c1 ZINC001198816701 1048009200 /nfs/dbraw/zinc/00/92/00/1048009200.db2.gz MTCXSGDDVPKFHI-UHFFFAOYSA-N -1 1 315.394 4.357 20 0 DIADMM CC(C)C(=O)Nc1ccc(Nc2ccc(F)c(F)c2[O-])cc1 ZINC001199074736 1048033293 /nfs/dbraw/zinc/03/32/93/1048033293.db2.gz FJMVJWFKMQWXJD-UHFFFAOYSA-N -1 1 306.312 4.009 20 0 DIADMM Cc1c(NC(=O)c2cc3ccccc3cc2[O-])cccc1N(C)C ZINC000775987904 1048076748 /nfs/dbraw/zinc/07/67/48/1048076748.db2.gz FNGRLBQUPPSIGK-UHFFFAOYSA-N -1 1 320.392 4.172 20 0 DIADMM Fc1ccc(F)c([N-]c2snnc2-c2ccccc2)c1F ZINC001175025815 1048079333 /nfs/dbraw/zinc/07/93/33/1048079333.db2.gz MNEBPUAPDGMZSU-UHFFFAOYSA-N -1 1 307.300 4.366 20 0 DIADMM CC(C)(C)c1nnc([N-]c2cc(F)cc(C(F)(F)F)c2)o1 ZINC001175060899 1048088477 /nfs/dbraw/zinc/08/84/77/1048088477.db2.gz QZYHNGXEUSMTCF-UHFFFAOYSA-N -1 1 303.259 4.269 20 0 DIADMM C[C@H](CCCc1ccccc1)C(=O)Nc1cc([O-])c(F)cc1F ZINC001160916596 1048097435 /nfs/dbraw/zinc/09/74/35/1048097435.db2.gz LEZDHIXROPAYDZ-GFCCVEGCSA-N -1 1 319.351 4.268 20 0 DIADMM CC(C)(C)c1ccc(CCC(=O)Nc2ccc(F)cc2[O-])cc1 ZINC001161035842 1048105323 /nfs/dbraw/zinc/10/53/23/1048105323.db2.gz UJQKZZLQIMXRHO-UHFFFAOYSA-N -1 1 315.388 4.400 20 0 DIADMM [O-]c1c(Br)ccc(Cl)c1Nc1ccc(O)cc1 ZINC001175047713 1048108419 /nfs/dbraw/zinc/10/84/19/1048108419.db2.gz NHFBGPABAXFCIN-UHFFFAOYSA-N -1 1 314.566 4.257 20 0 DIADMM O=C(Nc1nc(Cl)ccc1[O-])c1c(Cl)oc2ccccc21 ZINC001161179391 1048112598 /nfs/dbraw/zinc/11/25/98/1048112598.db2.gz LYXXQGQFJNILHG-UHFFFAOYSA-N -1 1 323.135 4.093 20 0 DIADMM CC(C)[C@@H]1N(C(=O)c2c(F)ccc([O-])c2F)CC12CCCCC2 ZINC001161238342 1048117396 /nfs/dbraw/zinc/11/73/96/1048117396.db2.gz SUISCYGFXKFEJE-INIZCTEOSA-N -1 1 323.383 4.101 20 0 DIADMM CCc1c(Cl)cc(Nc2ccnn2CC)c([O-])c1Cl ZINC001205323787 1048133109 /nfs/dbraw/zinc/13/31/09/1048133109.db2.gz YUDDKMPXIUOCGU-UHFFFAOYSA-N -1 1 300.189 4.221 20 0 DIADMM CCCCCCNC(=S)Nc1cccc(C(F)(F)F)c1[O-] ZINC001200956300 1048170323 /nfs/dbraw/zinc/17/03/23/1048170323.db2.gz BJNRLOWIMBDSEQ-UHFFFAOYSA-N -1 1 320.380 4.278 20 0 DIADMM [O-]c1ccc(NC(=S)Nc2cccc(Cl)c2)c(F)c1F ZINC001201104998 1048191362 /nfs/dbraw/zinc/19/13/62/1048191362.db2.gz XJAXNCARLZHQJS-UHFFFAOYSA-N -1 1 314.744 4.133 20 0 DIADMM CCOc1ccc(F)c(F)c1Nc1cc(F)c([O-])c(F)c1 ZINC001175282403 1048230008 /nfs/dbraw/zinc/23/00/08/1048230008.db2.gz GZFQEWQJBXOOAO-UHFFFAOYSA-N -1 1 301.239 4.091 20 0 DIADMM Cc1cccc(C2CC2)c1[N-]S(=O)(=O)c1cccc(F)c1C ZINC001185836468 1048232984 /nfs/dbraw/zinc/23/29/84/1048232984.db2.gz JPIRHLBAVQVYGZ-UHFFFAOYSA-N -1 1 319.401 4.121 20 0 DIADMM O=C(Nc1cccc(C(F)(F)F)c1[O-])c1cccc2cc[nH]c21 ZINC001201321951 1048238304 /nfs/dbraw/zinc/23/83/04/1048238304.db2.gz HUMKBXVYDPBTHT-UHFFFAOYSA-N -1 1 320.270 4.145 20 0 DIADMM O=C1CCCCc2cc(Nc3c(F)ccc([O-])c3F)ccc21 ZINC001175268124 1048245510 /nfs/dbraw/zinc/24/55/10/1048245510.db2.gz KVNRBQFKRQYMPP-UHFFFAOYSA-N -1 1 303.308 4.323 20 0 DIADMM CC(=O)c1cc(Cl)c(F)cc1Nc1c(F)ccc([O-])c1F ZINC001175270054 1048248785 /nfs/dbraw/zinc/24/87/85/1048248785.db2.gz ULSZRSFQFJWCJT-UHFFFAOYSA-N -1 1 315.678 4.409 20 0 DIADMM C[S@](=O)c1ccccc1Nc1c(Cl)ccc([O-])c1Cl ZINC001175310169 1048256771 /nfs/dbraw/zinc/25/67/71/1048256771.db2.gz PTSIQFYQXHRLBI-IBGZPJMESA-N -1 1 316.209 4.180 20 0 DIADMM Cc1cc(Cl)c(C(=O)Nc2cc(F)cc(F)c2[O-])cc1C ZINC001162290781 1048258130 /nfs/dbraw/zinc/25/81/30/1048258130.db2.gz IKNCRFAJGMXJFA-UHFFFAOYSA-N -1 1 311.715 4.193 20 0 DIADMM O=C(Nc1cc(F)cc(F)c1[O-])c1ccc(Cl)c(Cl)c1 ZINC001162291756 1048258052 /nfs/dbraw/zinc/25/80/52/1048258052.db2.gz POKNGTORDVNHSY-UHFFFAOYSA-N -1 1 318.106 4.230 20 0 DIADMM O=C(Nc1cc(F)cc(F)c1[O-])c1csc(C(F)(F)F)c1 ZINC001162295451 1048258960 /nfs/dbraw/zinc/25/89/60/1048258960.db2.gz FUGCBZYEJQMSQG-UHFFFAOYSA-N -1 1 323.242 4.003 20 0 DIADMM O=C(CC(C1CCC1)C1CCC1)Nc1cc(F)cc(F)c1[O-] ZINC001162295532 1048259553 /nfs/dbraw/zinc/25/95/53/1048259553.db2.gz JJEVUZFQJDDKCH-UHFFFAOYSA-N -1 1 309.356 4.215 20 0 DIADMM [O-]c1ccc(F)c(Nc2c(Cl)cnnc2Cl)c1Cl ZINC001250230012 1048264793 /nfs/dbraw/zinc/26/47/93/1048264793.db2.gz QMWVREVHNFEBRR-UHFFFAOYSA-N -1 1 308.527 4.025 20 0 DIADMM Nc1ccccc1N(C(=O)c1ccc([O-])c(F)c1)c1ccccc1 ZINC001186226538 1048274212 /nfs/dbraw/zinc/27/42/12/1048274212.db2.gz QRYKVWAFCHGMPA-UHFFFAOYSA-N -1 1 322.339 4.092 20 0 DIADMM Nc1ccc(-c2ccc(NC(=O)c3ccc([O-])cc3F)cc2)cc1 ZINC001186329210 1048281040 /nfs/dbraw/zinc/28/10/40/1048281040.db2.gz ODIGVKOWSLKWCO-UHFFFAOYSA-N -1 1 322.339 4.033 20 0 DIADMM O=C(Nc1ccc(-c2cccc(O)c2)cc1)c1ccc([O-])cc1F ZINC001186337853 1048290980 /nfs/dbraw/zinc/29/09/80/1048290980.db2.gz WWAMEBZWBDXINH-UHFFFAOYSA-N -1 1 323.323 4.156 20 0 DIADMM C[C@H](NC(=O)Nc1cc([O-])c(Cl)cc1F)C1CCCCC1 ZINC001186389053 1048294088 /nfs/dbraw/zinc/29/40/88/1048294088.db2.gz HSBDJFPWPTZWKB-VIFPVBQESA-N -1 1 314.788 4.275 20 0 DIADMM CC(C)CC(CC(C)C)[N-]S(=O)(=O)c1sccc1Cl ZINC001186665699 1048325438 /nfs/dbraw/zinc/32/54/38/1048325438.db2.gz AMGZADUTFUSDRD-UHFFFAOYSA-N -1 1 323.911 4.141 20 0 DIADMM CSC1(C(=O)Nc2cc(Cl)c([O-])c3ccccc23)CC1 ZINC000600135007 1048371468 /nfs/dbraw/zinc/37/14/68/1048371468.db2.gz AJZJCJSJVUAYQI-UHFFFAOYSA-N -1 1 307.802 4.033 20 0 DIADMM Cn1cc2cc(Nc3cc(Cl)cc(Cl)c3[O-])ccc2n1 ZINC001175624877 1048378628 /nfs/dbraw/zinc/37/86/28/1048378628.db2.gz NLCZLJYRFUSRHE-UHFFFAOYSA-N -1 1 308.168 4.329 20 0 DIADMM O=C(N[C@H](C1CCC1)C1CCCCC1)c1c([O-])cccc1F ZINC001163039404 1048407563 /nfs/dbraw/zinc/40/75/63/1048407563.db2.gz ISMMQLXQZDJXHS-KRWDZBQOSA-N -1 1 305.393 4.010 20 0 DIADMM O=C(Nc1ccc(F)c(Cl)c1)Nc1cc(F)cc(F)c1[O-] ZINC001187704939 1048430894 /nfs/dbraw/zinc/43/08/94/1048430894.db2.gz PEIRUBXCWPMXRT-UHFFFAOYSA-N -1 1 316.666 4.107 20 0 DIADMM CCOc1ccccc1NC(=O)Nc1cc([O-])c(Cl)cc1F ZINC001202145240 1048462000 /nfs/dbraw/zinc/46/20/00/1048462000.db2.gz QWAKDEJQZMXXIQ-UHFFFAOYSA-N -1 1 324.739 4.227 20 0 DIADMM CSc1cccc(NC(=O)Nc2cccc([O-])c2Cl)c1 ZINC001188050019 1048463523 /nfs/dbraw/zinc/46/35/23/1048463523.db2.gz CMDFIUBUAIYGLR-UHFFFAOYSA-N -1 1 308.790 4.412 20 0 DIADMM CSc1cccc(NC(=O)Nc2cc([O-])c(F)cc2F)c1 ZINC001188047801 1048464096 /nfs/dbraw/zinc/46/40/96/1048464096.db2.gz SRSQFTKBSCCCHL-UHFFFAOYSA-N -1 1 310.325 4.036 20 0 DIADMM [O-]c1c(Br)ccc(Cl)c1Nc1ccc(F)cn1 ZINC001175853201 1048478801 /nfs/dbraw/zinc/47/88/01/1048478801.db2.gz HKRBFKLDUCIJCO-UHFFFAOYSA-N -1 1 317.545 4.086 20 0 DIADMM Cc1ccccc1Oc1ccccc1[N-]S(=O)(=O)C1CCC1 ZINC001188131192 1048479197 /nfs/dbraw/zinc/47/91/97/1048479197.db2.gz WKUBYRWJDXRJCZ-UHFFFAOYSA-N -1 1 317.410 4.082 20 0 DIADMM CCCc1cc(=O)[n-]c(SCc2ccc(C)cc2Cl)n1 ZINC001188163395 1048482896 /nfs/dbraw/zinc/48/28/96/1048482896.db2.gz 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/nfs/dbraw/zinc/63/03/92/1048630392.db2.gz AUJSCJNIWGUGJT-AWEZNQCLSA-N -1 1 320.845 4.486 20 0 DIADMM CN(C)c1cc(F)cc(NC(=O)c2cc3ccccc3cc2[O-])c1 ZINC001164531281 1048640619 /nfs/dbraw/zinc/64/06/19/1048640619.db2.gz ZBQWIPGXVGJYFZ-UHFFFAOYSA-N -1 1 324.355 4.003 20 0 DIADMM CCCc1cc(=O)[n-]c(SC[C@H]2CCCc3ccccc32)n1 ZINC001164551495 1048641129 /nfs/dbraw/zinc/64/11/29/1048641129.db2.gz KUBQXIKTQRVWNU-CQSZACIVSA-N -1 1 314.454 4.347 20 0 DIADMM CCCc1cc(=O)[n-]c(SCc2ccccc2C2CC2)n1 ZINC001164552474 1048641354 /nfs/dbraw/zinc/64/13/54/1048641354.db2.gz YGTBGZMYMXPFAR-UHFFFAOYSA-N -1 1 300.427 4.304 20 0 DIADMM CC(C)Cc1ccc([C@H](C)C(=O)Nc2cccc(F)c2[O-])cc1 ZINC001151779389 1048643785 /nfs/dbraw/zinc/64/37/85/1048643785.db2.gz ANCFOHUNRKPKSE-ZDUSSCGKSA-N -1 1 315.388 4.472 20 0 DIADMM [O-]c1c(Cl)cc(Cl)cc1Nc1ccc2cncnc2c1 ZINC001203707956 1048649931 /nfs/dbraw/zinc/64/99/31/1048649931.db2.gz MXKHKGZSOWJXBN-UHFFFAOYSA-N -1 1 306.152 4.386 20 0 DIADMM CCc1cccc(CC)c1NC(=O)Nc1cc(F)cc(F)c1[O-] ZINC001189776113 1048665049 /nfs/dbraw/zinc/66/50/49/1048665049.db2.gz QINNHXAQBXVIEH-UHFFFAOYSA-N -1 1 320.339 4.439 20 0 DIADMM C[C@@H](CC1CCCCC1)[N-]S(=O)(=O)c1sccc1Cl ZINC001189937999 1048678477 /nfs/dbraw/zinc/67/84/77/1048678477.db2.gz WXGQNWCANZXMMA-JTQLQIEISA-N -1 1 321.895 4.039 20 0 DIADMM O=S(=O)([N-]c1cc2cccccc-2c1)c1ccc(C2CC2)cc1 ZINC001190471360 1048742997 /nfs/dbraw/zinc/74/29/97/1048742997.db2.gz GAKXDHQAKNBGCE-UHFFFAOYSA-N -1 1 323.417 4.470 20 0 DIADMM O=c1cc(C(F)F)nc(SC[C@@H]2CCCc3ccccc32)[n-]1 ZINC001166296338 1048743232 /nfs/dbraw/zinc/74/32/32/1048743232.db2.gz ZBVIKGUQPVHIGU-NSHDSACASA-N -1 1 322.380 4.332 20 0 DIADMM CCc1nc(S[C@@H](C)CCc2ccccc2)[n-]c(=O)c1C ZINC001166308019 1048744382 /nfs/dbraw/zinc/74/43/82/1048744382.db2.gz PDXQIAXXRHJXCP-LBPRGKRZSA-N -1 1 302.443 4.166 20 0 DIADMM [O-]c1c(F)cc(F)c(Nc2cnc3c(F)cccc3c2)c1F ZINC001176664726 1048751314 /nfs/dbraw/zinc/75/13/14/1048751314.db2.gz YWWVXOYEPGVTPK-UHFFFAOYSA-N -1 1 308.234 4.240 20 0 DIADMM [O-]c1c(F)cc(F)c(Nc2nc(Cl)ccc2Cl)c1F ZINC001176663707 1048753496 /nfs/dbraw/zinc/75/34/96/1048753496.db2.gz LMRHLIZSFBMVHW-UHFFFAOYSA-N -1 1 309.074 4.255 20 0 DIADMM Nc1cc(Cl)c(Nc2c(F)cc(F)c([O-])c2F)cc1Cl ZINC001176672120 1048754116 /nfs/dbraw/zinc/75/41/16/1048754116.db2.gz FBRYJLGCFATXLG-UHFFFAOYSA-N -1 1 323.101 4.442 20 0 DIADMM Cc1ccc(Nc2c(F)cc(F)c([O-])c2F)c2cccnc12 ZINC001176671614 1048754307 /nfs/dbraw/zinc/75/43/07/1048754307.db2.gz KBFAUPJGAOUVOY-UHFFFAOYSA-N -1 1 304.271 4.410 20 0 DIADMM [O-]c1c(F)cc(F)c(Nc2c(O)ccc3ccccc32)c1F ZINC001176672056 1048754666 /nfs/dbraw/zinc/75/46/66/1048754666.db2.gz CSIBZCAYQAHTTC-UHFFFAOYSA-N -1 1 305.255 4.412 20 0 DIADMM CC(C)(C)c1ccc(N)c(Nc2c(F)cc(F)c([O-])c2F)c1 ZINC001176671998 1048755684 /nfs/dbraw/zinc/75/56/84/1048755684.db2.gz CGAHZVQLMWMSEW-UHFFFAOYSA-N -1 1 310.319 4.433 20 0 DIADMM Cc1ccnc2c(Nc3c(F)cc(F)c([O-])c3F)cccc12 ZINC001176670988 1048755864 /nfs/dbraw/zinc/75/58/64/1048755864.db2.gz PHHWBLDOEITYDF-UHFFFAOYSA-N -1 1 304.271 4.410 20 0 DIADMM Cc1ccc(Nc2c(F)cc(F)c([O-])c2F)cc1OC(F)F ZINC001176670616 1048756485 /nfs/dbraw/zinc/75/64/85/1048756485.db2.gz IHNTYESENUJCQM-UHFFFAOYSA-N -1 1 319.229 4.463 20 0 DIADMM CC(C)Oc1ccc(F)cc1Nc1c(F)cc(F)c([O-])c1F ZINC001176673119 1048758134 /nfs/dbraw/zinc/75/81/34/1048758134.db2.gz DWZXTVKNCVVERY-UHFFFAOYSA-N -1 1 315.266 4.479 20 0 DIADMM CC(=O)c1ccc(Cl)c(Nc2c(F)cc(F)c([O-])c2F)c1 ZINC001176673402 1048758234 /nfs/dbraw/zinc/75/82/34/1048758234.db2.gz VAKXEZLLYGDAHU-UHFFFAOYSA-N -1 1 315.678 4.409 20 0 DIADMM C[C@H](C(=O)NCc1ccc([O-])c(Cl)c1)c1cccc(Cl)c1 ZINC001176988317 1048814628 /nfs/dbraw/zinc/81/46/28/1048814628.db2.gz KNJWSRMBDZQIFS-JTQLQIEISA-N -1 1 324.207 4.119 20 0 DIADMM CC(C)(C)c1ccc(NC(=O)Nc2c([O-])cccc2F)cc1 ZINC001191152985 1048866615 /nfs/dbraw/zinc/86/66/15/1048866615.db2.gz TUZZFFPPPDSQHP-UHFFFAOYSA-N -1 1 302.349 4.473 20 0 DIADMM Cc1cc(SC(C)(C)C)ccc1NC(=O)c1cncc([O-])c1 ZINC000111594117 1048924476 /nfs/dbraw/zinc/92/44/76/1048924476.db2.gz CTDIQVWQXSDHFX-UHFFFAOYSA-N -1 1 316.426 4.239 20 0 DIADMM O=C(/C=C/c1ccc2ccccc2n1)Nc1ccc([O-])c(Cl)c1 ZINC000111666804 1048927765 /nfs/dbraw/zinc/92/77/65/1048927765.db2.gz TWDRCDIAQIGRAP-CSKARUKUSA-N -1 1 324.767 4.246 20 0 DIADMM Cc1ccc(F)cc1NC(=O)Nc1cc([O-])c(Cl)cc1F ZINC001191410469 1048940259 /nfs/dbraw/zinc/94/02/59/1048940259.db2.gz HISTZTZTRZEAQC-UHFFFAOYSA-N -1 1 312.703 4.276 20 0 DIADMM O=C([O-])C[C@@H](NCc1ccc(C2CC2)cc1)c1ccccc1F ZINC000904046224 1048962432 /nfs/dbraw/zinc/96/24/32/1048962432.db2.gz XTQLCCGFBIYEBD-GOSISDBHSA-N -1 1 313.372 4.009 20 0 DIADMM [O-]c1c(Cl)c(Cl)ccc1Nc1ccc2cncnc2c1 ZINC001203711354 1048973962 /nfs/dbraw/zinc/97/39/62/1048973962.db2.gz IYEAYKYUGNFDKV-UHFFFAOYSA-N -1 1 306.152 4.386 20 0 DIADMM Cc1cc(NC(=O)Nc2ccc([O-])c(F)c2F)ccc1Cl ZINC001191767790 1048988486 /nfs/dbraw/zinc/98/84/86/1048988486.db2.gz BWRWKCMXUDQVRY-UHFFFAOYSA-N -1 1 312.703 4.276 20 0 DIADMM CC[C@H](C)c1ccc([C@H](N[C@@H](C)C(=O)[O-])c2cccs2)cc1 ZINC000904203159 1049001540 /nfs/dbraw/zinc/00/15/40/1049001540.db2.gz FFDHFWTUVUMHRY-DCGLDWPTSA-N -1 1 317.454 4.414 20 0 DIADMM CSc1ccc([O-])c(-c2nc(-c3ccc(F)c(F)c3)no2)c1 ZINC000904370695 1049049702 /nfs/dbraw/zinc/04/97/02/1049049702.db2.gz GCYJEOXPYRQDLG-UHFFFAOYSA-N -1 1 320.320 4.109 20 0 DIADMM CC(C)c1ccccc1NC(=O)Nc1cc(F)c([O-])c(F)c1 ZINC001192252654 1049059494 /nfs/dbraw/zinc/05/94/94/1049059494.db2.gz UEWSOQKDZHCATB-UHFFFAOYSA-N -1 1 306.312 4.438 20 0 DIADMM CC(C)c1ccccc1NC(=O)Nc1ccc([O-])c(F)c1F ZINC001192251927 1049059601 /nfs/dbraw/zinc/05/96/01/1049059601.db2.gz CXOULAYBZAGSTM-UHFFFAOYSA-N -1 1 306.312 4.438 20 0 DIADMM CC(C)(C)c1ccc(C(=O)Nc2ccc(C(F)F)cn2)c([O-])c1 ZINC001192314241 1049076911 /nfs/dbraw/zinc/07/69/11/1049076911.db2.gz LVBLXWUILLRULN-UHFFFAOYSA-N -1 1 320.339 4.275 20 0 DIADMM O=C([O-])c1ccc(C[N@H+]2CCC[C@H]2c2ccc(Cl)cc2)cc1 ZINC001204154763 1049097341 /nfs/dbraw/zinc/09/73/41/1049097341.db2.gz MXVYLWHPZFDQPO-KRWDZBQOSA-N -1 1 315.800 4.375 20 0 DIADMM O=C([O-])c1ccc(CN2CCC[C@@H]2c2ccc(F)cc2F)cc1 ZINC001204156645 1049097969 /nfs/dbraw/zinc/09/79/69/1049097969.db2.gz GZKOMMACLCERID-QGZVFWFLSA-N -1 1 317.335 4.000 20 0 DIADMM O=C([O-])c1ccc(C[N@H+]2CCC[C@@H]2c2ccc(Cl)cc2)cc1 ZINC001204154764 1049098753 /nfs/dbraw/zinc/09/87/53/1049098753.db2.gz MXVYLWHPZFDQPO-QGZVFWFLSA-N -1 1 315.800 4.375 20 0 DIADMM O=C(NCCCCC1CCCCC1)c1c(F)ccc([O-])c1F ZINC001192556124 1049114528 /nfs/dbraw/zinc/11/45/28/1049114528.db2.gz ORIYEODBUSCCAO-UHFFFAOYSA-N -1 1 311.372 4.151 20 0 DIADMM CC[C@@H](NC(=O)c1c(F)ccc([O-])c1F)c1ccc(C)cc1C ZINC001192556503 1049115168 /nfs/dbraw/zinc/11/51/68/1049115168.db2.gz WSJZGCAWPZONNV-CQSZACIVSA-N -1 1 319.351 4.168 20 0 DIADMM CC(C)CC1CCN(C(=O)c2cc3ccccc3cc2[O-])CC1 ZINC000857468282 1049156430 /nfs/dbraw/zinc/15/64/30/1049156430.db2.gz FHLNIVCMHDGOKV-UHFFFAOYSA-N -1 1 311.425 4.444 20 0 DIADMM Cc1c(NC(=O)c2ccc(C(C)C)cc2[O-])cccc1N(C)C ZINC000857480405 1049159643 /nfs/dbraw/zinc/15/96/43/1049159643.db2.gz HNMLLPMBLRMZPB-UHFFFAOYSA-N -1 1 312.413 4.142 20 0 DIADMM Cc1c2cc(F)ccc2oc1C(=O)Nc1ccc(Cl)cc1[O-] ZINC000339007912 1049203319 /nfs/dbraw/zinc/20/33/19/1049203319.db2.gz ZHCUAVZNOPGMRC-UHFFFAOYSA-N -1 1 319.719 4.492 20 0 DIADMM O=c1nc(N2CCC[C@H]2CCC2CCCCC2)cc(Cl)[n-]1 ZINC000858451580 1049259998 /nfs/dbraw/zinc/25/99/98/1049259998.db2.gz ZWCVNXAUTFEFAL-ZDUSSCGKSA-N -1 1 309.841 4.165 20 0 DIADMM C[C@@H](NC(=O)c1cc(Cl)ccc1[O-])c1ccc(Cl)cc1 ZINC000070134297 1049260116 /nfs/dbraw/zinc/26/01/16/1049260116.db2.gz XICIUNSBJPDYQT-SECBINFHSA-N -1 1 310.180 4.190 20 0 DIADMM O=c1nc(NC2CCC(c3ccc(F)cc3)CC2)cc(Cl)[n-]1 ZINC000858477132 1049262562 /nfs/dbraw/zinc/26/25/62/1049262562.db2.gz GSVFVTBUHKKENX-UHFFFAOYSA-N -1 1 321.783 4.113 20 0 DIADMM C[C@@H]1C[C@@H](Nc2cc(Cl)[n-]c(=O)n2)C[C@@H](c2ccccc2)C1 ZINC000858569978 1049277541 /nfs/dbraw/zinc/27/75/41/1049277541.db2.gz DQUORQKLUAZZGW-FPMFFAJLSA-N -1 1 317.820 4.220 20 0 DIADMM CCCC[C@H](CC)COC(=O)Nc1c(F)cc([O-])cc1F ZINC001193968142 1049287452 /nfs/dbraw/zinc/28/74/52/1049287452.db2.gz MULSABAIOQPIIX-JTQLQIEISA-N -1 1 301.333 4.435 20 0 DIADMM CCCC[C@H](CC)COC(=O)Nc1ccc([O-])c(F)c1F ZINC001193968643 1049288444 /nfs/dbraw/zinc/28/84/44/1049288444.db2.gz PFNPZSLBYGOSCI-JTQLQIEISA-N -1 1 301.333 4.435 20 0 DIADMM [O-]c1cc(Nc2ccc(OC(F)F)cc2)c(F)c(F)c1F ZINC001249962130 1049318342 /nfs/dbraw/zinc/31/83/42/1049318342.db2.gz HEAZNCXCOKWTJI-UHFFFAOYSA-N -1 1 305.202 4.155 20 0 DIADMM Cc1cccc(C)c1S(=O)(=O)[N-]c1ccccc1C(F)F ZINC001194633673 1049401513 /nfs/dbraw/zinc/40/15/13/1049401513.db2.gz DPPXVBQQSAEJFM-UHFFFAOYSA-N -1 1 311.353 4.042 20 0 DIADMM Cc1ncccc1Nc1c(Cl)ccc(Br)c1[O-] ZINC001205430018 1049469228 /nfs/dbraw/zinc/46/92/28/1049469228.db2.gz UWAZWGVXSBUBFB-UHFFFAOYSA-N -1 1 313.582 4.255 20 0 DIADMM O=C(Nc1cc(Cl)c([O-])c2ccccc12)[C@H]1C[C@@H]1C(F)F ZINC000862295288 1049486417 /nfs/dbraw/zinc/48/64/17/1049486417.db2.gz CKWNSJBVIPBRGC-UWVGGRQHSA-N -1 1 311.715 4.039 20 0 DIADMM Cc1ccccc1[C@@]1(F)CCN(Cc2ccc([O-])c(F)c2F)C1 ZINC001205516916 1049489432 /nfs/dbraw/zinc/48/94/32/1049489432.db2.gz AOWXJNBGFWQLLS-GOSISDBHSA-N -1 1 321.342 4.050 20 0 DIADMM CC1=C(C)C[C@H](C(=O)Nc2cccc([O-])c2Br)CC1 ZINC000908707477 1049498476 /nfs/dbraw/zinc/49/84/76/1049498476.db2.gz IPTQHFGFTSYTMD-LLVKDONJSA-N -1 1 324.218 4.230 20 0 DIADMM C/C(=C/C(=O)Nc1cccc([O-])c1Br)C(C)(C)C ZINC000908710630 1049500861 /nfs/dbraw/zinc/50/08/61/1049500861.db2.gz MJCADVAHQMYXRK-HJWRWDBZSA-N -1 1 312.207 4.086 20 0 DIADMM CCCC1(C(=O)Nc2cccc([O-])c2Br)CCC1 ZINC000908709793 1049501408 /nfs/dbraw/zinc/50/14/08/1049501408.db2.gz UAJNXPGAOYGQGF-UHFFFAOYSA-N -1 1 312.207 4.064 20 0 DIADMM CCOC(=O)NC(=S)[N-]c1cccc2c3ccccc3oc21 ZINC001195492680 1049538272 /nfs/dbraw/zinc/53/82/72/1049538272.db2.gz ORPOPBMTSDAVLO-UHFFFAOYSA-N -1 1 314.366 4.029 20 0 DIADMM Cn1ccc2cc(Nc3c(Cl)ccc([O-])c3Cl)cnc21 ZINC001205735884 1049547095 /nfs/dbraw/zinc/54/70/95/1049547095.db2.gz QYCYSJSGAPZQBG-UHFFFAOYSA-N -1 1 308.168 4.329 20 0 DIADMM Cc1ccccc1C1(C(=O)Nc2cc([O-])c(F)cc2F)CCC1 ZINC000909985403 1049573444 /nfs/dbraw/zinc/57/34/44/1049573444.db2.gz JORUBSBSUORWCW-UHFFFAOYSA-N -1 1 317.335 4.039 20 0 DIADMM O=C(Nc1cc([O-])c(F)cc1F)c1scnc1C1CCCC1 ZINC000909985840 1049574051 /nfs/dbraw/zinc/57/40/51/1049574051.db2.gz QZFIPPXMKLUZHL-UHFFFAOYSA-N -1 1 324.352 4.037 20 0 DIADMM CCc1ccccc1S(=O)(=O)[N-]c1c(C)cccc1SC ZINC000488306087 1049633083 /nfs/dbraw/zinc/63/30/83/1049633083.db2.gz ZZCKVTLICJGYLH-UHFFFAOYSA-N -1 1 321.467 4.080 20 0 DIADMM Cc1sc(C)c2c1[n-]c(C[C@@]1(C)CC1(Cl)Cl)nc2=O ZINC000864354304 1049651704 /nfs/dbraw/zinc/65/17/04/1049651704.db2.gz DURTZBGZVXKUMS-LBPRGKRZSA-N -1 1 317.241 4.140 20 0 DIADMM Cc1cccc(NC(=S)Nc2ccc([O-])c(F)c2F)c1C ZINC001196414966 1049654479 /nfs/dbraw/zinc/65/44/79/1049654479.db2.gz VTHXKXLCUINTKQ-UHFFFAOYSA-N -1 1 308.353 4.096 20 0 DIADMM Cc1cccc(NC(=S)Nc2cc(F)c(F)cc2[O-])c1C ZINC001196421009 1049656346 /nfs/dbraw/zinc/65/63/46/1049656346.db2.gz PVINQYMIOAQLDO-UHFFFAOYSA-N -1 1 308.353 4.096 20 0 DIADMM [O-]c1cc(NC(=S)Nc2ccc(F)cc2)c(F)cc1Cl ZINC001196942038 1049706038 /nfs/dbraw/zinc/70/60/38/1049706038.db2.gz JMWHJAGSDGGWJD-UHFFFAOYSA-N -1 1 314.744 4.133 20 0 DIADMM O=C([O-])c1cc(-c2cccc3nc(C(F)(F)F)[nH]c32)cs1 ZINC001206303269 1049706105 /nfs/dbraw/zinc/70/61/05/1049706105.db2.gz JAWDEOQEOFBJHH-UHFFFAOYSA-N -1 1 312.272 4.008 20 0 DIADMM Cc1cc([C@H](C)N(C)Cc2cccc(Cl)c2)oc1C(=O)[O-] ZINC000572296168 1050000060 /nfs/dbraw/zinc/00/00/60/1050000060.db2.gz RANAZEUPEXSAJK-NSHDSACASA-N -1 1 307.777 4.133 20 0 DIADMM Cc1cc([C@@H](C)NC(=O)c2c([O-])cccc2Cl)c(C)s1 ZINC000057307722 1050083127 /nfs/dbraw/zinc/08/31/27/1050083127.db2.gz RMAIMYJOXFIFBN-SECBINFHSA-N -1 1 309.818 4.215 20 0 DIADMM COc1c(F)ccc(Nc2cc(F)c([O-])cc2F)c1Cl ZINC001209806448 1050088043 /nfs/dbraw/zinc/08/80/43/1050088043.db2.gz CXSGIHDHHUKKTH-UHFFFAOYSA-N -1 1 303.667 4.215 20 0 DIADMM CCc1nc(SCc2cccc(F)c2Cl)[n-]c(=O)c1C ZINC000572976531 1050094988 /nfs/dbraw/zinc/09/49/88/1050094988.db2.gz RASNGCGPHLFHTP-UHFFFAOYSA-N -1 1 312.797 4.138 20 0 DIADMM [O-]c1ccc(Cl)c(Nc2ccc(F)c(CO)c2)c1Cl ZINC001209878008 1050098735 /nfs/dbraw/zinc/09/87/35/1050098735.db2.gz FCVQIPRFUCMRHQ-UHFFFAOYSA-N -1 1 302.132 4.074 20 0 DIADMM Cc1c(Cl)cc(Nc2ccc(F)c(CO)c2)c([O-])c1Cl ZINC001209879937 1050099304 /nfs/dbraw/zinc/09/93/04/1050099304.db2.gz HUMOPURGOXQZJH-UHFFFAOYSA-N -1 1 316.159 4.382 20 0 DIADMM CCC[C@@H](NC(=O)c1cc2ccccc2cc1[O-])c1ccccn1 ZINC000591672003 1050188402 /nfs/dbraw/zinc/18/84/02/1050188402.db2.gz DDGGEZLVXMROLS-GOSISDBHSA-N -1 1 320.392 4.212 20 0 DIADMM Cc1cc(Nc2ccc(F)c(Br)c2[O-])c(C)o1 ZINC001210286203 1050189327 /nfs/dbraw/zinc/18/93/27/1050189327.db2.gz YXUNBEREFWMUHT-UHFFFAOYSA-N -1 1 300.127 4.247 20 0 DIADMM [O-]c1c(Cl)cc(Cl)cc1Nc1cccc2c1OCCO2 ZINC001210369559 1050219574 /nfs/dbraw/zinc/21/95/74/1050219574.db2.gz MZJDDAZOBLXPRG-UHFFFAOYSA-N -1 1 312.152 4.214 20 0 DIADMM Cc1c(Cl)cc(Nc2cncc(N(C)C)c2)c([O-])c1Cl ZINC001210478299 1050260746 /nfs/dbraw/zinc/26/07/46/1050260746.db2.gz QPVUHMHSMPUNTH-UHFFFAOYSA-N -1 1 312.200 4.212 20 0 DIADMM COc1cc2ccccc2c(Nc2ccnc(Cl)c2[O-])c1 ZINC001210587946 1050307186 /nfs/dbraw/zinc/30/71/86/1050307186.db2.gz NCVBECORXPIWAG-UHFFFAOYSA-N -1 1 300.745 4.346 20 0 DIADMM [O-]c1c(Cl)c(Cl)ccc1Nc1cnc(C(F)(F)F)nc1 ZINC001210671817 1050332252 /nfs/dbraw/zinc/33/22/52/1050332252.db2.gz JPUDTNYLCMBYQS-UHFFFAOYSA-N -1 1 324.089 4.251 20 0 DIADMM CC(=O)c1cc(NC(=O)c2cc3ccccc3cc2[O-])ccc1C ZINC001143669329 1050333169 /nfs/dbraw/zinc/33/31/69/1050333169.db2.gz OOXYLSHPEPBOPG-UHFFFAOYSA-N -1 1 319.360 4.309 20 0 DIADMM [O-]c1cc(F)c(Nc2ccc(OCC(F)(F)F)cc2)cc1F ZINC001210743019 1050358841 /nfs/dbraw/zinc/35/88/41/1050358841.db2.gz FBHZGBQLVXIOIO-UHFFFAOYSA-N -1 1 319.229 4.355 20 0 DIADMM COc1cc(C(C)=O)c(Nc2cccc([O-])c2Cl)cc1F ZINC001210859463 1050395105 /nfs/dbraw/zinc/39/51/05/1050395105.db2.gz IPVCZXGJYAGOPX-UHFFFAOYSA-N -1 1 309.724 4.140 20 0 DIADMM CSc1nc2c(c(-c3cccc([O-])c3Cl)n1)CCCC2 ZINC001242796830 1050405166 /nfs/dbraw/zinc/40/51/66/1050405166.db2.gz AZKLGMFNLSPDMC-UHFFFAOYSA-N -1 1 306.818 4.103 20 0 DIADMM CCCn1nccc1Nc1cc(Cl)c(C)c(Cl)c1[O-] ZINC001210917857 1050412028 /nfs/dbraw/zinc/41/20/28/1050412028.db2.gz FTOAFPDEMKUPAT-UHFFFAOYSA-N -1 1 300.189 4.358 20 0 DIADMM CCOc1ncc(Nc2cc(Cl)c([O-])c(Cl)c2)cc1F ZINC001210924654 1050415658 /nfs/dbraw/zinc/41/56/58/1050415658.db2.gz QGGHSKHSFGOMTH-UHFFFAOYSA-N -1 1 317.147 4.375 20 0 DIADMM [O-]c1c(Cl)cc(Nc2cncc(OC(F)F)c2)cc1Cl ZINC001210926881 1050416715 /nfs/dbraw/zinc/41/67/15/1050416715.db2.gz JXAQPARBKGTGED-UHFFFAOYSA-N -1 1 321.110 4.439 20 0 DIADMM [O-]c1c(Cl)cc(Nc2ccc(OC(F)F)nc2)cc1Cl ZINC001210927559 1050418288 /nfs/dbraw/zinc/41/82/88/1050418288.db2.gz WKNJMGQUCDVGGC-UHFFFAOYSA-N -1 1 321.110 4.439 20 0 DIADMM O=C1CCCc2ccc(Nc3cc([O-])c(Cl)cc3F)cc21 ZINC001210934212 1050424141 /nfs/dbraw/zinc/42/41/41/1050424141.db2.gz IIZIAWJZIPENGJ-UHFFFAOYSA-N -1 1 305.736 4.447 20 0 DIADMM [O-]c1c(Br)ccc(Cl)c1Nc1nccs1 ZINC001210996407 1050441686 /nfs/dbraw/zinc/44/16/86/1050441686.db2.gz KYUXVSFBPSXHQN-UHFFFAOYSA-N -1 1 305.584 4.008 20 0 DIADMM CC(C)[C@H](NC(=O)c1ccc2ccccc2c1[O-])c1ccccn1 ZINC000736508678 1050478451 /nfs/dbraw/zinc/47/84/51/1050478451.db2.gz LZNDSSRYMNVOMW-SFHVURJKSA-N -1 1 320.392 4.068 20 0 DIADMM Nc1ccc(C(F)(F)F)cc1Nc1c([O-])cc(F)cc1F ZINC001211149669 1050499015 /nfs/dbraw/zinc/49/90/15/1050499015.db2.gz PFVIUISISGGIKR-UHFFFAOYSA-N -1 1 304.218 4.015 20 0 DIADMM [O-]c1c(Cl)nccc1Nc1ccc(C(F)(F)F)nc1Cl ZINC001211199608 1050515291 /nfs/dbraw/zinc/51/52/91/1050515291.db2.gz OKIFEDPMJCMQSH-UHFFFAOYSA-N -1 1 324.089 4.251 20 0 DIADMM CCOC(OCC)c1cccc(-c2cc(F)c([O-])cc2F)c1 ZINC001211349866 1050553735 /nfs/dbraw/zinc/55/37/35/1050553735.db2.gz JSKJSIYWZYKJMS-UHFFFAOYSA-N -1 1 308.324 4.409 20 0 DIADMM CCOC(OCC)c1ccccc1-c1cc(F)c([O-])cc1F ZINC001211350861 1050553884 /nfs/dbraw/zinc/55/38/84/1050553884.db2.gz WCHRZCLGKMZSJB-UHFFFAOYSA-N -1 1 308.324 4.409 20 0 DIADMM CCCOc1ccccc1Nc1cc2ccc([O-])cc2oc1=O ZINC001211381136 1050559117 /nfs/dbraw/zinc/55/91/17/1050559117.db2.gz VQWZFAHLATZZIS-UHFFFAOYSA-N -1 1 311.337 4.031 20 0 DIADMM COc1cc(O)ccc1Nc1cc(Cl)cc(Cl)c1[O-] ZINC001213097340 1050587940 /nfs/dbraw/zinc/58/79/40/1050587940.db2.gz KRCQWNYMSYHRKA-UHFFFAOYSA-N -1 1 300.141 4.157 20 0 DIADMM COc1cccc(C(F)(F)F)c1Nc1ccnc(Cl)c1[O-] ZINC001213343604 1050635469 /nfs/dbraw/zinc/63/54/69/1050635469.db2.gz XHEKUKSPCNTVEG-UHFFFAOYSA-N -1 1 318.682 4.212 20 0 DIADMM COc1cccc(C(F)(F)F)c1Nc1cc(F)c([O-])c(F)c1 ZINC001213345438 1050636642 /nfs/dbraw/zinc/63/66/42/1050636642.db2.gz SXNVDKYMNPGIAV-UHFFFAOYSA-N -1 1 319.229 4.441 20 0 DIADMM [O-]c1c(F)cc(Nc2c3nsnc3ccc2Cl)cc1F ZINC001213381910 1050644912 /nfs/dbraw/zinc/64/49/12/1050644912.db2.gz OZLILTXRYKPKEF-UHFFFAOYSA-N -1 1 313.716 4.072 20 0 DIADMM CC(=O)Nc1ccc(Cl)c(Nc2cc(F)c([O-])c(F)c2)c1 ZINC001213382000 1050645021 /nfs/dbraw/zinc/64/50/21/1050645021.db2.gz UTHJWKZGLIPILZ-UHFFFAOYSA-N -1 1 312.703 4.026 20 0 DIADMM COc1ccc(F)c(Nc2cc(F)c([O-])c(F)c2)c1Cl ZINC001213384284 1050645121 /nfs/dbraw/zinc/64/51/21/1050645121.db2.gz CUFMMSUBLCSVEV-UHFFFAOYSA-N -1 1 303.667 4.215 20 0 DIADMM O=c1oc2cc([O-])ccc2cc1Nc1c(F)cccc1C1CC1 ZINC001213450073 1050658330 /nfs/dbraw/zinc/65/83/30/1050658330.db2.gz WJWVJGQRVNVZMS-UHFFFAOYSA-N -1 1 311.312 4.259 20 0 DIADMM C/C(=C/CN(C)[C@H](C)c1ccc(Cl)cc1Cl)C(=O)[O-] ZINC000846240827 1050701975 /nfs/dbraw/zinc/70/19/75/1050701975.db2.gz ZTUQGCNDAWMVJI-ABRRARGCSA-N -1 1 302.201 4.017 20 0 DIADMM O=c1ccc2cc(Nc3c(Cl)ccc([O-])c3Cl)ccc2[nH]1 ZINC001213776947 1050738495 /nfs/dbraw/zinc/73/84/95/1050738495.db2.gz BQDFNLBFYXIOJS-UHFFFAOYSA-N -1 1 321.163 4.284 20 0 DIADMM COc1cccc(C2CC2)c1Nc1cc2ccc([O-])cc2oc1=O ZINC001213813369 1050749730 /nfs/dbraw/zinc/74/97/30/1050749730.db2.gz BUOWHXCJEWMQMN-UHFFFAOYSA-N -1 1 323.348 4.128 20 0 DIADMM COc1cccc(C2CC2)c1Nc1ccc(-n2ccc(=O)[n-]2)cc1 ZINC001213822739 1050753957 /nfs/dbraw/zinc/75/39/57/1050753957.db2.gz OBBRIXVHIQVPCW-UHFFFAOYSA-N -1 1 321.380 4.208 20 0 DIADMM CSc1nc2ccsc2c(-c2c(F)cc([O-])cc2F)n1 ZINC001241118003 1050757234 /nfs/dbraw/zinc/75/72/34/1050757234.db2.gz BYEVTKGJDXLQHH-UHFFFAOYSA-N -1 1 310.350 4.064 20 0 DIADMM [O-]c1c(Cl)nccc1Nc1ccc(N2CCCCC2)cc1F ZINC001213840315 1050760659 /nfs/dbraw/zinc/76/06/59/1050760659.db2.gz ZVTXYDKWCHOHRX-UHFFFAOYSA-N -1 1 321.783 4.314 20 0 DIADMM [O-]c1cc(F)c(Nc2ccc(N3CCCC3)cc2F)cc1F ZINC001213853200 1050765547 /nfs/dbraw/zinc/76/55/47/1050765547.db2.gz FZXNRHWMEFSSKR-UHFFFAOYSA-N -1 1 308.303 4.153 20 0 DIADMM O=c1ccc2c(Nc3cc([O-])c(Cl)cc3F)cccc2[nH]1 ZINC001213974557 1050793049 /nfs/dbraw/zinc/79/30/49/1050793049.db2.gz KHHSRUPWTJKWCQ-UHFFFAOYSA-N -1 1 304.708 4.182 20 0 DIADMM O=C(c1ccc2ccccc2c1[O-])N1CC[C@H]1c1ccc(F)cc1 ZINC001146530740 1050829138 /nfs/dbraw/zinc/82/91/38/1050829138.db2.gz SZBORHBGPXANGD-SFHVURJKSA-N -1 1 321.351 4.272 20 0 DIADMM CC[C@H](NC(=O)c1ccc(F)c([O-])c1)c1ccc(Cl)s1 ZINC001146875656 1050848494 /nfs/dbraw/zinc/84/84/94/1050848494.db2.gz DMMRRUPVPHPPEL-JTQLQIEISA-N -1 1 313.781 4.127 20 0 DIADMM CC[C@](C)(NC(=O)Cc1ccc([O-])c(Cl)c1)c1ccccc1 ZINC001146927446 1050850085 /nfs/dbraw/zinc/85/00/85/1050850085.db2.gz ZYBRJJBARZMNOO-SFHVURJKSA-N -1 1 317.816 4.030 20 0 DIADMM C[C@@H](CCC(C)(C)C)NC(=O)c1ccc(C(F)(F)F)cc1[O-] ZINC001147199031 1050867964 /nfs/dbraw/zinc/86/79/64/1050867964.db2.gz MXRQFQSHJPVJHV-JTQLQIEISA-N -1 1 317.351 4.356 20 0 DIADMM [O-]c1c(F)cc(Nc2cnccc2C(F)(F)F)cc1Cl ZINC001214479905 1050917305 /nfs/dbraw/zinc/91/73/05/1050917305.db2.gz JLAPLCREYBGEIB-UHFFFAOYSA-N -1 1 306.646 4.342 20 0 DIADMM COC(=O)c1csc(C)c1Nc1cc(F)c([O-])c(Cl)c1 ZINC001214484360 1050917889 /nfs/dbraw/zinc/91/78/89/1050917889.db2.gz ILCGOVILHGVDCG-UHFFFAOYSA-N -1 1 315.753 4.085 20 0 DIADMM [O-]c1c(F)cc(Nc2cnc(-c3ccccc3)cn2)cc1Cl ZINC001214479927 1050918458 /nfs/dbraw/zinc/91/84/58/1050918458.db2.gz KWMOTHSOLIMLCY-UHFFFAOYSA-N -1 1 315.735 4.385 20 0 DIADMM [O-]c1c(F)cc(Nc2cncc(Br)c2)cc1Cl ZINC001214480468 1050918573 /nfs/dbraw/zinc/91/85/73/1050918573.db2.gz RIQUMOORGPORAS-UHFFFAOYSA-N -1 1 317.545 4.086 20 0 DIADMM [O-]c1c(F)cc(Nc2cncc(C(F)(F)F)c2)cc1Cl ZINC001214482541 1050918816 /nfs/dbraw/zinc/91/88/16/1050918816.db2.gz ALDSPRVGIQTWML-UHFFFAOYSA-N -1 1 306.646 4.342 20 0 DIADMM O=c1[nH]c2ccc(Nc3cc(F)c([O-])c(Cl)c3)cc2s1 ZINC001214488656 1050919861 /nfs/dbraw/zinc/91/98/61/1050919861.db2.gz JTBDHFWGRUATDM-UHFFFAOYSA-N -1 1 310.737 4.244 20 0 DIADMM [O-]c1c(F)cc(Nc2cncc(-c3ccccn3)c2)cc1Cl ZINC001214486613 1050920111 /nfs/dbraw/zinc/92/01/11/1050920111.db2.gz PKTYALOQZFOYES-UHFFFAOYSA-N -1 1 315.735 4.385 20 0 DIADMM CC(=O)c1oc2cccnc2c1Nc1cc(F)c([O-])c(Cl)c1 ZINC001214484853 1050920139 /nfs/dbraw/zinc/92/01/39/1050920139.db2.gz QMXZBKKSXGRMJG-UHFFFAOYSA-N -1 1 320.707 4.272 20 0 DIADMM COC(=O)c1cccc(C)c1Nc1cc(F)c([O-])c(Cl)c1 ZINC001214488659 1050920863 /nfs/dbraw/zinc/92/08/63/1050920863.db2.gz JXCZTFSLZMWBCS-UHFFFAOYSA-N -1 1 309.724 4.023 20 0 DIADMM Cn1cc(-c2ccc(Nc3cc(F)c([O-])c(Cl)c3)cc2)cn1 ZINC001214486518 1050921216 /nfs/dbraw/zinc/92/12/16/1050921216.db2.gz LJRPPGYOMCIBSG-UHFFFAOYSA-N -1 1 317.751 4.329 20 0 DIADMM CCOC(=O)c1cccc(Nc2cc(F)c([O-])c(Cl)c2)c1C ZINC001214489974 1050922181 /nfs/dbraw/zinc/92/21/81/1050922181.db2.gz LGZLWNUPPXCXDV-UHFFFAOYSA-N -1 1 323.751 4.413 20 0 DIADMM COc1ccc2cc(Nc3cc(F)c([O-])c(Cl)c3)ccc2n1 ZINC001214490239 1050922753 /nfs/dbraw/zinc/92/27/53/1050922753.db2.gz RPWYCGYBUVXLFO-UHFFFAOYSA-N -1 1 318.735 4.485 20 0 DIADMM Cc1nn(C)c2cc(Nc3cc(F)c([O-])c(Cl)c3)ccc12 ZINC001214490169 1050922793 /nfs/dbraw/zinc/92/27/93/1050922793.db2.gz PMLFWUXYBYZHFQ-UHFFFAOYSA-N -1 1 305.740 4.123 20 0 DIADMM Cc1cc(=O)[nH]c2cc(Nc3cc(F)c([O-])c(Cl)c3)ccc12 ZINC001214489997 1050922899 /nfs/dbraw/zinc/92/28/99/1050922899.db2.gz MDSDWYAIPJEBAC-UHFFFAOYSA-N -1 1 318.735 4.491 20 0 DIADMM COC(=O)c1cc(C)c(Nc2cc(F)c([O-])c(Cl)c2)cc1C ZINC001214492151 1050923011 /nfs/dbraw/zinc/92/30/11/1050923011.db2.gz RHBHWVZRHVIJGP-UHFFFAOYSA-N -1 1 323.751 4.332 20 0 DIADMM CC1(c2ccc(Nc3cc(F)c([O-])c(Cl)c3)cc2)COC1 ZINC001214493908 1050924023 /nfs/dbraw/zinc/92/40/23/1050924023.db2.gz AWHOIKHBUVHWBD-UHFFFAOYSA-N -1 1 307.752 4.216 20 0 DIADMM CC(=O)c1oc2cccnc2c1Nc1c(Cl)ccc([O-])c1F ZINC001214557771 1050942907 /nfs/dbraw/zinc/94/29/07/1050942907.db2.gz JSGSOPXLRTZOKL-UHFFFAOYSA-N -1 1 320.707 4.272 20 0 DIADMM COc1cccc(C(C)=O)c1Nc1c(Cl)ccc([O-])c1F ZINC001214563640 1050944005 /nfs/dbraw/zinc/94/40/05/1050944005.db2.gz KRUZDZIUWRUWBA-UHFFFAOYSA-N -1 1 309.724 4.140 20 0 DIADMM O=C(Nc1ccc2c(c1)N=NC2)c1ccc(C(F)(F)F)cc1[O-] ZINC001148798810 1050976143 /nfs/dbraw/zinc/97/61/43/1050976143.db2.gz DWHPVNJIKJTMJT-UHFFFAOYSA-N -1 1 321.258 4.261 20 0 DIADMM CC1(C)C[C@]1(NC(=O)c1cc(Cl)ccc1[O-])c1ccccc1 ZINC001148887901 1050982145 /nfs/dbraw/zinc/98/21/45/1050982145.db2.gz PJDFQKOXAKVBCY-SFHVURJKSA-N -1 1 315.800 4.101 20 0 DIADMM Cc1cc(C)cc(C[C@@H](C)NC(=O)c2c([O-])cccc2Cl)c1 ZINC000743716355 1051058249 /nfs/dbraw/zinc/05/82/49/1051058249.db2.gz HQBDWTRNFLPXPX-CYBMUJFWSA-N -1 1 317.816 4.023 20 0 DIADMM CC(C)Oc1ccc(F)c(Nc2c([O-])cc(F)cc2F)c1F ZINC001215174747 1051103561 /nfs/dbraw/zinc/10/35/61/1051103561.db2.gz KXNIXURQOCFCBP-UHFFFAOYSA-N -1 1 315.266 4.479 20 0 DIADMM COc1ccccc1[C@H](C)NC(=O)c1ccc2ccccc2c1[O-] ZINC001649159945 1051114153 /nfs/dbraw/zinc/11/41/53/1051114153.db2.gz SAAWNGDZIKDGDY-ZDUSSCGKSA-N -1 1 321.376 4.045 20 0 DIADMM Cc1ccccc1C[C@H](C)N(C)C(=O)c1c([O-])cccc1Cl ZINC000773211563 1051115991 /nfs/dbraw/zinc/11/59/91/1051115991.db2.gz GKBFCDHQQOKXDP-ZDUSSCGKSA-N -1 1 317.816 4.057 20 0 DIADMM CCOc1ccc(-c2nc(-c3ccc(C)c(C)c3)no2)c([O-])c1 ZINC001215241045 1051129484 /nfs/dbraw/zinc/12/94/84/1051129484.db2.gz CRDKQNNBTJQUIE-UHFFFAOYSA-N -1 1 310.353 4.125 20 0 DIADMM CCCCc1ccc(-c2noc(-c3ccc(O)cc3[O-])n2)cc1 ZINC001215299996 1051160635 /nfs/dbraw/zinc/16/06/35/1051160635.db2.gz MIPPSHICBFVCOW-UHFFFAOYSA-N -1 1 310.353 4.157 20 0 DIADMM Cc1ccc(-c2noc(-c3ccc([O-])cc3Cl)n2)cc1F ZINC001215342829 1051170869 /nfs/dbraw/zinc/17/08/69/1051170869.db2.gz AGULWIWBMCHEKS-UHFFFAOYSA-N -1 1 304.708 4.210 20 0 DIADMM COc1cc(-c2noc(-c3ccc([O-])cc3Cl)n2)ccc1C ZINC001215342948 1051172387 /nfs/dbraw/zinc/17/23/87/1051172387.db2.gz IBHYBOYPTXZPCA-UHFFFAOYSA-N -1 1 316.744 4.080 20 0 DIADMM O=C(C[C@H]1CCC[C@H](C(F)(F)F)C1)Nc1cccc(F)c1[O-] ZINC001171632502 1051175655 /nfs/dbraw/zinc/17/56/55/1051175655.db2.gz DBLJSVUJVNNOAJ-UWVGGRQHSA-N -1 1 319.298 4.229 20 0 DIADMM O=C(Nc1cccc(F)c1[O-])c1csc(C2CCCCC2)n1 ZINC001171637144 1051194053 /nfs/dbraw/zinc/19/40/53/1051194053.db2.gz LDWXKJMDWUUUDU-UHFFFAOYSA-N -1 1 320.389 4.288 20 0 DIADMM CC(C)Oc1c(Nc2cc(F)c([O-])c(F)c2)ccc(F)c1F ZINC001215426350 1051201893 /nfs/dbraw/zinc/20/18/93/1051201893.db2.gz MERVLTXWIHYJLJ-UHFFFAOYSA-N -1 1 315.266 4.479 20 0 DIADMM CCCOc1ccc(F)c(Nc2cc(F)c([O-])cc2F)c1F ZINC001215567427 1051247498 /nfs/dbraw/zinc/24/74/98/1051247498.db2.gz ADARRDQUJWANSP-UHFFFAOYSA-N -1 1 315.266 4.481 20 0 DIADMM Cc1cccc(Br)c1Nc1cc(F)c([O-])cc1F ZINC001215572096 1051251474 /nfs/dbraw/zinc/25/14/74/1051251474.db2.gz YBJKVFJXFDKRQU-UHFFFAOYSA-N -1 1 314.129 4.485 20 0 DIADMM COc1c(Nc2cc(F)c([O-])cc2F)cccc1C(F)(F)F ZINC001215573338 1051251514 /nfs/dbraw/zinc/25/15/14/1051251514.db2.gz FWTXHWDNZVAQIL-UHFFFAOYSA-N -1 1 319.229 4.441 20 0 DIADMM [O-]c1cc(F)c(Nc2cc(F)ccc2Br)cc1F ZINC001215571733 1051251890 /nfs/dbraw/zinc/25/18/90/1051251890.db2.gz JFRNXNCTOFFWSA-UHFFFAOYSA-N -1 1 318.092 4.316 20 0 DIADMM [O-]c1cc(F)c(Nc2cccc(Br)c2F)cc1F ZINC001215574080 1051252066 /nfs/dbraw/zinc/25/20/66/1051252066.db2.gz WFYACJKXXVPCCE-UHFFFAOYSA-N -1 1 318.092 4.316 20 0 DIADMM Cc1cc(OC(F)F)ccc1Nc1cc(F)c([O-])cc1F ZINC001215573460 1051255036 /nfs/dbraw/zinc/25/50/36/1051255036.db2.gz KOFWVVALJOXMGN-UHFFFAOYSA-N -1 1 301.239 4.324 20 0 DIADMM [O-]c1c(Cl)cc(Cl)cc1Nc1ccc(F)c(CO)c1F ZINC001215651462 1051285685 /nfs/dbraw/zinc/28/56/85/1051285685.db2.gz BHSGWTLQFIIALK-UHFFFAOYSA-N -1 1 320.122 4.213 20 0 DIADMM [O-]c1c(Cl)c(Cl)ccc1Nc1ccc(F)c(CO)c1F ZINC001215654435 1051288142 /nfs/dbraw/zinc/28/81/42/1051288142.db2.gz UKPZEPCWAMHVFT-UHFFFAOYSA-N -1 1 320.122 4.213 20 0 DIADMM CC(C)Oc1c(F)ccc(Nc2ccc(F)c(F)c2[O-])c1F ZINC001215730601 1051329541 /nfs/dbraw/zinc/32/95/41/1051329541.db2.gz AMIXTJQZKOBBLC-UHFFFAOYSA-N -1 1 315.266 4.479 20 0 DIADMM CC(C)Oc1ccccc1-c1noc(-c2cc(F)ccc2[O-])n1 ZINC001215769416 1051355937 /nfs/dbraw/zinc/35/59/37/1051355937.db2.gz HKVUUGSOGKINMA-UHFFFAOYSA-N -1 1 314.316 4.036 20 0 DIADMM Cc1ccc(-c2noc(-c3cc(F)ccc3[O-])n2)c(Cl)c1 ZINC001215769364 1051356435 /nfs/dbraw/zinc/35/64/35/1051356435.db2.gz FLEMXGSVQLAJQD-UHFFFAOYSA-N -1 1 304.708 4.210 20 0 DIADMM CCOCc1cncc(Nc2c(Cl)ccc([O-])c2Cl)c1 ZINC001215789671 1051371327 /nfs/dbraw/zinc/37/13/27/1051371327.db2.gz CCKRRAJBGMXOPY-UHFFFAOYSA-N -1 1 313.184 4.374 20 0 DIADMM CSc1cc(Nc2ccc(-n3ccc(=O)[n-]3)cc2)ccc1F ZINC001215796925 1051375365 /nfs/dbraw/zinc/37/53/65/1051375365.db2.gz IYUBTOKXHDEBPG-UHFFFAOYSA-N -1 1 315.373 4.183 20 0 DIADMM CC(C)(C)C(=O)Nc1ccccc1Nc1cc(F)c([O-])cc1F ZINC001215835759 1051399133 /nfs/dbraw/zinc/39/91/33/1051399133.db2.gz BEFKUTHSYBFGTD-UHFFFAOYSA-N -1 1 320.339 4.399 20 0 DIADMM CSc1cc(F)c(Nc2ccnc(Cl)c2[O-])c(F)c1 ZINC001215840499 1051404640 /nfs/dbraw/zinc/40/46/40/1051404640.db2.gz ADRDUSSYTVTHAQ-UHFFFAOYSA-N -1 1 302.733 4.184 20 0 DIADMM CC(C)Oc1ccccc1-c1noc(-c2ccc(F)c([O-])c2)n1 ZINC001215842075 1051405896 /nfs/dbraw/zinc/40/58/96/1051405896.db2.gz AXZXKXASMFAZRA-UHFFFAOYSA-N -1 1 314.316 4.036 20 0 DIADMM CC(C)Oc1cccc(-c2noc(-c3ccc(F)c([O-])c3)n2)c1 ZINC001215842264 1051407314 /nfs/dbraw/zinc/40/73/14/1051407314.db2.gz GLBGQDUYXVYEBB-UHFFFAOYSA-N -1 1 314.316 4.036 20 0 DIADMM COc1cc(Nc2cc(Cl)cc3[nH]ncc32)ccc1[S-] ZINC001215862165 1051419775 /nfs/dbraw/zinc/41/97/75/1051419775.db2.gz RMLYVPFBDVGNQF-UHFFFAOYSA-N -1 1 305.790 4.257 20 0 DIADMM CSc1ncc(Cl)cc1[N-]c1nnc(C(C)(C)C)s1 ZINC001215914924 1051451614 /nfs/dbraw/zinc/45/16/14/1051451614.db2.gz ZMNQOUQSNHZABW-UHFFFAOYSA-N -1 1 314.867 4.350 20 0 DIADMM CSc1cc(F)c(Nc2cc(F)c([O-])c(F)c2)cc1F ZINC001215968072 1051491405 /nfs/dbraw/zinc/49/14/05/1051491405.db2.gz ZXNQFCQPUXQQOP-UHFFFAOYSA-N -1 1 303.280 4.414 20 0 DIADMM [O-]c1cccc(-c2nc(-c3cccc(Cl)c3F)no2)c1F ZINC001215984280 1051501568 /nfs/dbraw/zinc/50/15/68/1051501568.db2.gz NULHBOBIPIHQGF-UHFFFAOYSA-N -1 1 308.671 4.041 20 0 DIADMM CC(C)Oc1ccccc1-c1noc(-c2cccc([O-])c2F)n1 ZINC001215989213 1051507734 /nfs/dbraw/zinc/50/77/34/1051507734.db2.gz VCQWESZNCYGWSE-UHFFFAOYSA-N -1 1 314.316 4.036 20 0 DIADMM CCOC(=O)c1nc(C)oc1[N-]c1c(F)ccc(C2CC2)c1F ZINC001215992677 1051510660 /nfs/dbraw/zinc/51/06/60/1051510660.db2.gz GBOWJDIORYZBDY-UHFFFAOYSA-N -1 1 322.311 4.059 20 0 DIADMM COc1ccc(Nc2ccc(-n3ccc(=O)[n-]3)cc2)cc1C(C)C ZINC001216003069 1051519031 /nfs/dbraw/zinc/51/90/31/1051519031.db2.gz IGTAPRZCOQMBJW-UHFFFAOYSA-N -1 1 323.396 4.454 20 0 DIADMM O=C(Nc1ccc(NCc2cccc([O-])c2Cl)cc1)C1CC1 ZINC000393344607 1051571003 /nfs/dbraw/zinc/57/10/03/1051571003.db2.gz DFTCKJOKKLCGCO-UHFFFAOYSA-N -1 1 316.788 4.006 20 0 DIADMM Cc1cc(Cl)c(N)c(Nc2cc([O-])c(Cl)cc2F)c1 ZINC001216092985 1051575843 /nfs/dbraw/zinc/57/58/43/1051575843.db2.gz XLNXLUQKWZRGAS-UHFFFAOYSA-N -1 1 301.148 4.472 20 0 DIADMM O=C(Nc1cc(F)c([O-])cc1Cl)c1cccc(C(F)F)c1 ZINC001157893292 1051577421 /nfs/dbraw/zinc/57/74/21/1051577421.db2.gz FTUDMNIDFMAVDY-UHFFFAOYSA-N -1 1 315.678 4.375 20 0 DIADMM O=C(Nc1cc(F)c([O-])cc1Cl)[C@H]1[C@@H]2CCCCCC[C@@H]21 ZINC001157900119 1051587964 /nfs/dbraw/zinc/58/79/64/1051587964.db2.gz RAYOTXFHIMDHER-RTUWITSCSA-N -1 1 311.784 4.340 20 0 DIADMM CSc1cc(F)ccc1[N-]C(=O)c1c(F)ccc(F)c1F ZINC001130090903 1051611053 /nfs/dbraw/zinc/61/10/53/1051611053.db2.gz UCLCPKKWNOHPIO-UHFFFAOYSA-N -1 1 315.291 4.217 20 0 DIADMM COc1cc(Nc2ccc(F)c(F)c2[O-])ccc1OC(C)C ZINC001216247310 1051653240 /nfs/dbraw/zinc/65/32/40/1051653240.db2.gz CJYKRMVQXCCNKI-UHFFFAOYSA-N -1 1 309.312 4.210 20 0 DIADMM [O-]c1c(Cl)c(Cl)ccc1Nc1ccc(CO)cc1F ZINC001216275986 1051668945 /nfs/dbraw/zinc/66/89/45/1051668945.db2.gz AKQNJLMOHWKNQJ-UHFFFAOYSA-N -1 1 302.132 4.074 20 0 DIADMM O=c1oc2cc([O-])ccc2cc1Nc1ccc(F)c2ccoc21 ZINC001216296414 1051680791 /nfs/dbraw/zinc/68/07/91/1051680791.db2.gz PUNAZPAIXXVYTJ-UHFFFAOYSA-N -1 1 311.268 4.128 20 0 DIADMM CC(C)Oc1cccc(-c2noc(-c3cc([O-])cc(F)c3)n2)c1 ZINC001216339188 1051706194 /nfs/dbraw/zinc/70/61/94/1051706194.db2.gz COCPCGGUXNRPSZ-UHFFFAOYSA-N -1 1 314.316 4.036 20 0 DIADMM CCCOc1ccc(-c2noc(-c3cc([O-])cc(F)c3)n2)cc1 ZINC001216339169 1051707394 /nfs/dbraw/zinc/70/73/94/1051707394.db2.gz BWCVOMHTIXPBCR-UHFFFAOYSA-N -1 1 314.316 4.037 20 0 DIADMM [O-]c1cc(Nc2c(Cl)cc(CO)cc2Cl)cc(F)c1F ZINC001216364878 1051721541 /nfs/dbraw/zinc/72/15/41/1051721541.db2.gz QBWXBBZWYBHCMS-UHFFFAOYSA-N -1 1 320.122 4.213 20 0 DIADMM [O-]c1c(F)cc(Nc2c(Cl)cc(CO)cc2Cl)cc1F ZINC001216363940 1051722550 /nfs/dbraw/zinc/72/25/50/1051722550.db2.gz SYVWBGUBTCCCSU-UHFFFAOYSA-N -1 1 320.122 4.213 20 0 DIADMM CN(C(=O)c1cc2ccccc2cc1[O-])[C@H]1CCc2ccccc21 ZINC000218879891 1051759179 /nfs/dbraw/zinc/75/91/79/1051759179.db2.gz OXVPYRPRPGVQNI-IBGZPJMESA-N -1 1 317.388 4.305 20 0 DIADMM COc1c(F)cc(SC)cc1Nc1cc([O-])c(F)c(F)c1 ZINC001216582850 1051824711 /nfs/dbraw/zinc/82/47/11/1051824711.db2.gz FNWGYUPXJHJSDT-UHFFFAOYSA-N -1 1 315.316 4.284 20 0 DIADMM COc1c(F)cc(SC)cc1Nc1cc(F)c([O-])cc1F ZINC001216583614 1051826864 /nfs/dbraw/zinc/82/68/64/1051826864.db2.gz AWMBSXOCFRZHMM-UHFFFAOYSA-N -1 1 315.316 4.284 20 0 DIADMM CC(C)(C)c1ccc2c(c1)CCN2C(=O)c1ccc([O-])c(F)c1 ZINC000767929885 1051866528 /nfs/dbraw/zinc/86/65/28/1051866528.db2.gz BPFARHIBPRSCQY-UHFFFAOYSA-N -1 1 313.372 4.032 20 0 DIADMM COc1ccc(OC)c(Nc2ccc(Cl)c(Cl)c2[O-])c1 ZINC001173920762 1051879976 /nfs/dbraw/zinc/87/99/76/1051879976.db2.gz RSCKSMAVPXZACX-UHFFFAOYSA-N -1 1 314.168 4.460 20 0 DIADMM COc1cccc(OC)c1Nc1cc(Cl)c([O-])cc1Cl ZINC001173924075 1051881737 /nfs/dbraw/zinc/88/17/37/1051881737.db2.gz DATSPGXSGBMOIH-UHFFFAOYSA-N -1 1 314.168 4.460 20 0 DIADMM COc1ccc(Nc2cc(Cl)cc(Cl)c2[O-])c(OC)c1 ZINC001173891160 1051891943 /nfs/dbraw/zinc/89/19/43/1051891943.db2.gz HHQVVZHXQGRPML-UHFFFAOYSA-N -1 1 314.168 4.460 20 0 DIADMM Cc1ccc(NC(=O)c2c(F)ccc([O-])c2F)cc1OC(C)C ZINC000572528373 1051895652 /nfs/dbraw/zinc/89/56/52/1051895652.db2.gz OIBBBCQNPGVYAP-UHFFFAOYSA-N -1 1 321.323 4.018 20 0 DIADMM [O-]c1c(F)cc(-c2cc(F)c(OC(F)F)c(F)c2)cc1F ZINC001244093620 1051909191 /nfs/dbraw/zinc/90/91/91/1051909191.db2.gz JNQDQYROYQFELC-UHFFFAOYSA-N -1 1 308.177 4.217 20 0 DIADMM [O-]c1cc(F)c(F)c(-c2nc(-c3cccc(Cl)c3)no2)c1 ZINC001216922595 1051911245 /nfs/dbraw/zinc/91/12/45/1051911245.db2.gz CKFXBXWTEPNGHT-UHFFFAOYSA-N -1 1 308.671 4.041 20 0 DIADMM CCc1cccc(CC)c1[N-]S(=O)(=O)c1cc(F)ccc1C ZINC000494538878 1051916135 /nfs/dbraw/zinc/91/61/35/1051916135.db2.gz YBAZWRCUPYMSNQ-UHFFFAOYSA-N -1 1 321.417 4.060 20 0 DIADMM Cc1cc(Cl)cc(-c2noc(-c3c(C)cc(O)cc3[O-])n2)c1 ZINC001216987603 1051927958 /nfs/dbraw/zinc/92/79/58/1051927958.db2.gz ZNAHEGYMHLAHLF-UHFFFAOYSA-N -1 1 316.744 4.085 20 0 DIADMM Cc1c(F)cccc1-c1noc(-c2ccc3cccnc3c2[O-])n1 ZINC001217141566 1051976069 /nfs/dbraw/zinc/97/60/69/1051976069.db2.gz GFELDHQVOIBIRL-UHFFFAOYSA-N -1 1 321.311 4.105 20 0 DIADMM Cc1cc(C)cc(-c2noc(-c3ccc4cccnc4c3[O-])n2)c1 ZINC001217142190 1051976615 /nfs/dbraw/zinc/97/66/15/1051976615.db2.gz UDGHXGCFXVOHOF-UHFFFAOYSA-N -1 1 317.348 4.274 20 0 DIADMM CC/C=C(\C)C(=O)Nc1c([O-])cc(Br)cc1Cl ZINC000808113084 1051978106 /nfs/dbraw/zinc/97/81/06/1051978106.db2.gz WOSWCZAYLLPZLC-QPJJXVBHSA-N -1 1 318.598 4.103 20 0 DIADMM Cn1ccc2ccc(NC(=O)Nc3ccc([O-])c(Cl)c3)cc21 ZINC000192221445 1052004672 /nfs/dbraw/zinc/00/46/72/1052004672.db2.gz WMUFZLXUNDDFKY-UHFFFAOYSA-N -1 1 315.760 4.181 20 0 DIADMM COc1cccc([O-])c1-c1nc(-c2ccc3ccccc3c2)no1 ZINC000405437365 1052016606 /nfs/dbraw/zinc/01/66/06/1052016606.db2.gz CPQPUCBWKWNNPW-UHFFFAOYSA-N -1 1 318.332 4.271 20 0 DIADMM COc1cccc([O-])c1-c1nc(-c2ccc(C(C)C)cc2)no1 ZINC000405452008 1052019291 /nfs/dbraw/zinc/01/92/91/1052019291.db2.gz GTNDTYMWYCSZNU-UHFFFAOYSA-N -1 1 310.353 4.241 20 0 DIADMM Cc1ccc(Nc2c(Cl)ccc(Br)c2[O-])cn1 ZINC001174284471 1052072030 /nfs/dbraw/zinc/07/20/30/1052072030.db2.gz GVVWFKDCEKLJIK-UHFFFAOYSA-N -1 1 313.582 4.255 20 0 DIADMM Cc1ccncc1-c1noc(-c2ccc3sccc3c2[O-])n1 ZINC001217514584 1052079329 /nfs/dbraw/zinc/07/93/29/1052079329.db2.gz SXWZQHAMZOMNIF-UHFFFAOYSA-N -1 1 309.350 4.027 20 0 DIADMM C[C@@H](c1ccc(F)cc1)N(C)C(=O)c1c([O-])cccc1Cl ZINC000769639488 1052085459 /nfs/dbraw/zinc/08/54/59/1052085459.db2.gz YMSLAAPLDNDMIW-JTQLQIEISA-N -1 1 307.752 4.018 20 0 DIADMM FC(F)(F)c1ccc([S-])c(Nc2ccc3nccn3c2)c1 ZINC001174276949 1052086838 /nfs/dbraw/zinc/08/68/38/1052086838.db2.gz YUYBIBFQKDEHCZ-UHFFFAOYSA-N -1 1 309.316 4.385 20 0 DIADMM C[C@H](c1ccco1)N(C(=O)c1c([O-])cccc1Cl)C1CC1 ZINC000769722907 1052096661 /nfs/dbraw/zinc/09/66/61/1052096661.db2.gz SLCWINSHNQTYOP-SNVBAGLBSA-N -1 1 305.761 4.004 20 0 DIADMM O=C(c1c([O-])cccc1Cl)N(CC1CC1)C1CCCCC1 ZINC000769758923 1052098466 /nfs/dbraw/zinc/09/84/66/1052098466.db2.gz KSXANSJRWSMTKG-UHFFFAOYSA-N -1 1 307.821 4.231 20 0 DIADMM Cc1ccc(-c2noc(-c3ccc4ccc(C)nc4c3[O-])n2)cc1 ZINC001217583476 1052102522 /nfs/dbraw/zinc/10/25/22/1052102522.db2.gz QWECPJUKYFDDQQ-UHFFFAOYSA-N -1 1 317.348 4.274 20 0 DIADMM [O-]c1c(Cl)nccc1Nc1cc(F)ccc1C(F)(F)F ZINC001174484304 1052169952 /nfs/dbraw/zinc/16/99/52/1052169952.db2.gz BZSJVGNUGSEABU-UHFFFAOYSA-N -1 1 306.646 4.342 20 0 DIADMM O=C(Nc1cccc(C(F)(F)F)c1[O-])c1cccc2[nH]ccc21 ZINC001219312301 1052282151 /nfs/dbraw/zinc/28/21/51/1052282151.db2.gz BDISJFSCSPJXST-UHFFFAOYSA-N -1 1 320.270 4.145 20 0 DIADMM CC(C)(C)C1CCN(C(=O)c2ccc3ccccc3c2[O-])CC1 ZINC000320303459 1052500338 /nfs/dbraw/zinc/50/03/38/1052500338.db2.gz TWTWSPBAGZFALU-UHFFFAOYSA-N -1 1 311.425 4.444 20 0 DIADMM CCOC(=O)c1nc2ccc(-c3ccccc3Cl)cc2[n-]1 ZINC001222445064 1052500770 /nfs/dbraw/zinc/50/07/70/1052500770.db2.gz BABCFAPIMIEDFN-UHFFFAOYSA-N -1 1 300.745 4.060 20 0 DIADMM CCOC(=O)c1nc2cc(-c3ccccc3Cl)ccc2[n-]1 ZINC001222445064 1052500777 /nfs/dbraw/zinc/50/07/77/1052500777.db2.gz BABCFAPIMIEDFN-UHFFFAOYSA-N -1 1 300.745 4.060 20 0 DIADMM CCCCc1oc2ccccc2c1C=C1SC(=O)[N-]C1=O ZINC000917359761 1052723821 /nfs/dbraw/zinc/72/38/21/1052723821.db2.gz RFFMYMCMUXCEFC-ZROIWOOFSA-N -1 1 301.367 4.099 20 0 DIADMM O=C(CCc1cc(Cl)cs1)Nc1ccc([O-])c(Cl)c1 ZINC000129436242 1052789457 /nfs/dbraw/zinc/78/94/57/1052789457.db2.gz DAPIJYZMNVACGR-UHFFFAOYSA-N -1 1 316.209 4.332 20 0 DIADMM Cc1cc(=O)oc2cc([O-])cc(O[C@@H](C)CCc3ccccc3)c12 ZINC001226483102 1052901283 /nfs/dbraw/zinc/90/12/83/1052901283.db2.gz AICGFCQEDAMFQP-AWEZNQCLSA-N -1 1 324.376 4.207 20 0 DIADMM Cc1ccccc1[C@H](C)Oc1cc([O-])cc2oc(=O)cc(C)c12 ZINC001226487629 1052901797 /nfs/dbraw/zinc/90/17/97/1052901797.db2.gz ZTVGSXCJWFPGJT-ZDUSSCGKSA-N -1 1 310.349 4.255 20 0 DIADMM Cc1cc(=O)oc2cc([O-])cc(O[C@H](C)c3cccs3)c12 ZINC001226488789 1052901845 /nfs/dbraw/zinc/90/18/45/1052901845.db2.gz HXLKBUDKUWWSBK-SNVBAGLBSA-N -1 1 302.351 4.009 20 0 DIADMM Cc1cc(=O)oc2cc([O-])cc(O[C@H](C)c3ccccc3F)c12 ZINC001226487094 1052901911 /nfs/dbraw/zinc/90/19/11/1052901911.db2.gz VDCIYBBLUJVNKC-LLVKDONJSA-N -1 1 314.312 4.086 20 0 DIADMM Cc1ccc2c(c1)[C@H](Oc1cc([O-])cc3oc(=O)cc(C)c13)CC2 ZINC001226490887 1052902565 /nfs/dbraw/zinc/90/25/65/1052902565.db2.gz SWQJLDKALMNWTF-MRXNPFEDSA-N -1 1 322.360 4.182 20 0 DIADMM Cc1ccc([C@H](C)NC(=O)c2c([O-])cccc2Cl)cc1C ZINC000920445091 1052939359 /nfs/dbraw/zinc/93/93/59/1052939359.db2.gz LJCIXUBMGDOXGD-LBPRGKRZSA-N -1 1 303.789 4.153 20 0 DIADMM O=C(N[C@H]1CCc2c1cccc2Cl)c1c([O-])cccc1Cl ZINC000920462705 1052940626 /nfs/dbraw/zinc/94/06/26/1052940626.db2.gz HYPRINWHCHGXET-ZDUSSCGKSA-N -1 1 322.191 4.116 20 0 DIADMM C[C@H](Oc1cc(Cl)c([O-])cc1Cl)c1cccnc1F ZINC001227645299 1053006131 /nfs/dbraw/zinc/00/61/31/1053006131.db2.gz HJRXBUYTPMCEQT-ZETCQYMHSA-N -1 1 302.132 4.373 20 0 DIADMM C[C@@H](Oc1[n-]c(=O)nc2c1CO[C@H]2C)c1ccc2ccccc2c1 ZINC001227710038 1053009393 /nfs/dbraw/zinc/00/93/93/1053009393.db2.gz ILOKVSVDHBTVKQ-NEPJUHHUSA-N -1 1 322.364 4.067 20 0 DIADMM S=c1nc2cnccc2c(O[C@H](c2ccccc2)C2CC2)[n-]1 ZINC001227881361 1053025322 /nfs/dbraw/zinc/02/53/22/1053025322.db2.gz LPDUJPVQVYLFPB-OAHLLOKOSA-N -1 1 309.394 4.217 20 0 DIADMM S=c1nc2cnccc2c(O[C@H]2CCCc3ccccc32)[n-]1 ZINC001227881925 1053025387 /nfs/dbraw/zinc/02/53/87/1053025387.db2.gz RQMIMUIAFXUOMT-HNNXBMFYSA-N -1 1 309.394 4.144 20 0 DIADMM S=c1nc2cnccc2c(O[C@@H]2CC[C@H]3CCCC[C@H]3C2)[n-]1 ZINC001227885615 1053025672 /nfs/dbraw/zinc/02/56/72/1053025672.db2.gz NFBBCLSVXDWJDC-FRRDWIJNSA-N -1 1 315.442 4.425 20 0 DIADMM CC[C@H](Oc1[n-]c(=S)nc2cnccc21)C1CCCCC1 ZINC001227884994 1053025880 /nfs/dbraw/zinc/02/58/80/1053025880.db2.gz KABCTUKRYFPMOU-AWEZNQCLSA-N -1 1 303.431 4.425 20 0 DIADMM CC(C)[C@H]1CC[C@H](Oc2[n-]c(=S)nc3cnccc32)CC1 ZINC001227883594 1053025926 /nfs/dbraw/zinc/02/59/26/1053025926.db2.gz BFNPHUJBVPZOAU-HAQNSBGRSA-N -1 1 303.431 4.281 20 0 DIADMM CCC[C@@]1(C)CCCN(C(=O)NCc2ccc([O-])c(Cl)c2)C1 ZINC001313237253 1053097245 /nfs/dbraw/zinc/09/72/45/1053097245.db2.gz UHKDVAGMHNOXNI-KRWDZBQOSA-N -1 1 324.852 4.157 20 0 DIADMM CCc1nc(SCCSc2ccc(F)cc2)[n-]c(=O)c1C ZINC000849921701 1053117936 /nfs/dbraw/zinc/11/79/36/1053117936.db2.gz SNUVXCFQNNSRFJ-UHFFFAOYSA-N -1 1 324.446 4.077 20 0 DIADMM Cc1noc(C(C)C)c1[N-]C(=O)c1csc(-c2ccco2)n1 ZINC001351005442 1053127382 /nfs/dbraw/zinc/12/73/82/1053127382.db2.gz XQPXLBPSSAQNRM-UHFFFAOYSA-N -1 1 317.370 4.075 20 0 DIADMM CCC(=O)c1c(O)cc([O-])cc1O[C@H](c1ccccc1)C1CC1 ZINC001228560848 1053134135 /nfs/dbraw/zinc/13/41/35/1053134135.db2.gz USVXMSQXFFHISH-LJQANCHMSA-N -1 1 312.365 4.221 20 0 DIADMM CCC(=O)c1c(O)cc([O-])cc1O[C@H]1CCc2cc(C)ccc21 ZINC001228560187 1053134555 /nfs/dbraw/zinc/13/45/55/1053134555.db2.gz KZOOOUKTDJPRQP-KRWDZBQOSA-N -1 1 312.365 4.065 20 0 DIADMM CCC(=O)c1c(O)cc([O-])cc1O[C@@H](C)c1cccc(Cl)c1 ZINC001228557057 1053134610 /nfs/dbraw/zinc/13/46/10/1053134610.db2.gz SWVYBVWEVZUSES-JTQLQIEISA-N -1 1 320.772 4.484 20 0 DIADMM C[C@@H](Oc1[n-]c(=S)nc2ccccc21)c1cccc(F)c1 ZINC001228765270 1053178177 /nfs/dbraw/zinc/17/81/77/1053178177.db2.gz MSJPIVFAXQDFFS-SNVBAGLBSA-N -1 1 300.358 4.198 20 0 DIADMM O=c1ccc2c(O[C@@H](c3ccccc3)C3CC3)cc([O-])cc2o1 ZINC001229128786 1053253764 /nfs/dbraw/zinc/25/37/64/1053253764.db2.gz DDPKSNBFYYOMHC-IBGZPJMESA-N -1 1 308.333 4.029 20 0 DIADMM C[C@H](Oc1cc([O-])cc2oc(=O)ccc12)c1ccc(Cl)cc1 ZINC001229134704 1053255009 /nfs/dbraw/zinc/25/50/09/1053255009.db2.gz ISCAEVHDXIXNIR-JTQLQIEISA-N -1 1 316.740 4.292 20 0 DIADMM CCC[C@H](C)[C@@H](CC)Oc1c([O-])c(OC)cc2ccc(=O)oc21 ZINC001229216406 1053275011 /nfs/dbraw/zinc/27/50/11/1053275011.db2.gz QHGQLHUIFYBMFD-WCQYABFASA-N -1 1 320.385 4.101 20 0 DIADMM COc1cc2ccc(=O)oc2c(O[C@@H](C)CCC=C(C)C)c1[O-] ZINC001229216854 1053275264 /nfs/dbraw/zinc/27/52/64/1053275264.db2.gz WAMLNSXUEKYERV-LBPRGKRZSA-N -1 1 318.369 4.021 20 0 DIADMM O=C1C[C@@H](c2ccccc2)Oc2cc([O-])cc(OC3CCC3)c21 ZINC001229230369 1053279304 /nfs/dbraw/zinc/27/93/04/1053279304.db2.gz QEZQDXGFTDJROK-INIZCTEOSA-N -1 1 310.349 4.030 20 0 DIADMM C[C@@H](Oc1cc([O-])ccc1C(=O)Cc1ccccc1)C(F)(F)F ZINC001229258453 1053285762 /nfs/dbraw/zinc/28/57/62/1053285762.db2.gz FNJIEYUXHRTEQK-LLVKDONJSA-N -1 1 324.298 4.147 20 0 DIADMM CC[C@H](Oc1cc(O)ccc1C(=O)c1ccc([O-])cc1)C(C)C ZINC001229296176 1053296313 /nfs/dbraw/zinc/29/63/13/1053296313.db2.gz FRQYQPFEHILNLJ-KRWDZBQOSA-N -1 1 314.381 4.142 20 0 DIADMM CC1(C)CC(=O)CC[C@@H]1Oc1cc([O-])c(Cl)cc1Cl ZINC001229411884 1053316142 /nfs/dbraw/zinc/31/61/42/1053316142.db2.gz WIRLZWRFYABAJV-ZDUSSCGKSA-N -1 1 303.185 4.226 20 0 DIADMM CCC[C@H](CC(=O)OCC)Oc1cc([O-])c(Cl)cc1Cl ZINC001229411584 1053316965 /nfs/dbraw/zinc/31/69/65/1053316965.db2.gz TUSABUCCJURWMB-SECBINFHSA-N -1 1 321.200 4.200 20 0 DIADMM O=C(Cc1ccc(O)cc1)c1ccc([O-])cc1O[C@@H]1C=CCCC1 ZINC001229434555 1053320022 /nfs/dbraw/zinc/32/00/22/1053320022.db2.gz WFCIXXKUHRMBCM-QGZVFWFLSA-N -1 1 324.376 4.011 20 0 DIADMM CCC(=O)c1ccc([O-])cc1O[C@@H](C)c1cccc(OC)c1 ZINC001229475255 1053330460 /nfs/dbraw/zinc/33/04/60/1053330460.db2.gz RVQYBKQDJMYUEN-LBPRGKRZSA-N -1 1 300.354 4.134 20 0 DIADMM CCC(=O)c1ccc([O-])cc1OC1CCC(C(F)(F)F)CC1 ZINC001229474900 1053330708 /nfs/dbraw/zinc/33/07/08/1053330708.db2.gz MJMAHBKRMUKSGH-UHFFFAOYSA-N -1 1 316.319 4.485 20 0 DIADMM CCCC1(CNC(=O)c2ccc(C(F)(F)F)c([O-])c2)CCC1 ZINC001545732381 1053361705 /nfs/dbraw/zinc/36/17/05/1053361705.db2.gz BYWNDXQAIIOMPB-UHFFFAOYSA-N -1 1 315.335 4.111 20 0 DIADMM CCC[C@](C)(CC)C(=O)Nc1ccc(Br)c([O-])c1 ZINC001321109446 1053390263 /nfs/dbraw/zinc/39/02/63/1053390263.db2.gz IJFBNVBMHLKKOZ-AWEZNQCLSA-N -1 1 314.223 4.310 20 0 DIADMM O=C(Nc1ccc([O-])c(Cl)c1)c1ccccc1C(F)(F)F ZINC000070333845 1053436173 /nfs/dbraw/zinc/43/61/73/1053436173.db2.gz JRXAVQOGYFJDJQ-UHFFFAOYSA-N -1 1 315.678 4.317 20 0 DIADMM Cc1ccccc1C1(NC(=O)c2c([O-])cccc2Cl)CCC1 ZINC001300233272 1053513842 /nfs/dbraw/zinc/51/38/42/1053513842.db2.gz RKLYTFLNOZGJJQ-UHFFFAOYSA-N -1 1 315.800 4.163 20 0 DIADMM FC1(F)CCC(Oc2nc3c(cc(Cl)nc3Cl)[n-]2)CC1 ZINC001231043462 1053658144 /nfs/dbraw/zinc/65/81/44/1053658144.db2.gz AAPRPHBJCJUICB-UHFFFAOYSA-N -1 1 322.142 4.221 20 0 DIADMM FC1(F)CCC(Oc2nc3cc(Cl)nc(Cl)c3[n-]2)CC1 ZINC001231043462 1053658155 /nfs/dbraw/zinc/65/81/55/1053658155.db2.gz AAPRPHBJCJUICB-UHFFFAOYSA-N -1 1 322.142 4.221 20 0 DIADMM O=C(c1c([O-])cccc1Cl)N1CC[C@@H](C2CCCCC2)C1 ZINC001300414775 1053674800 /nfs/dbraw/zinc/67/48/00/1053674800.db2.gz UDCBDRZVXXOKNT-CYBMUJFWSA-N -1 1 307.821 4.088 20 0 DIADMM CC[C@@H](C)C[C@@H](CC)Oc1cccnc1-c1ncccc1[O-] ZINC001231200421 1053698718 /nfs/dbraw/zinc/69/87/18/1053698718.db2.gz NGKSZKDQSONRIY-ZIAGYGMSSA-N -1 1 300.402 4.443 20 0 DIADMM C[C@H](Oc1cccnc1-c1ncccc1[O-])c1ccc(F)cc1 ZINC001231200225 1053698758 /nfs/dbraw/zinc/69/87/58/1053698758.db2.gz KDVMDQCMIPFWCZ-LBPRGKRZSA-N -1 1 310.328 4.128 20 0 DIADMM CCC[C@@H](Oc1cccnc1-c1ncccc1[O-])[C@@H](C)CC ZINC001231199069 1053699440 /nfs/dbraw/zinc/69/94/40/1053699440.db2.gz ACUPQIHWAYQUGP-DZGCQCFKSA-N -1 1 300.402 4.443 20 0 DIADMM CCCN1C(=O)c2ccccc2N[C@H]1c1ccc([O-])c(Cl)c1 ZINC000620753274 1053726869 /nfs/dbraw/zinc/72/68/69/1053726869.db2.gz NUDGYARFTMVVDE-MRXNPFEDSA-N -1 1 316.788 4.022 20 0 DIADMM O=C(CCc1ccc(C(F)F)cc1)Nc1c([O-])cccc1F ZINC001300487580 1053745708 /nfs/dbraw/zinc/74/57/08/1053745708.db2.gz DQYCQOMLNFLYPO-UHFFFAOYSA-N -1 1 309.287 4.040 20 0 DIADMM CCN(Cc1cccc(Cl)c1)Cc1cc(C(=O)[O-])ccc1F ZINC001231461343 1053758430 /nfs/dbraw/zinc/75/84/30/1053758430.db2.gz ZMLFXTURQFWYRZ-UHFFFAOYSA-N -1 1 321.779 4.199 20 0 DIADMM CC1(C)CCN(C(=O)Cc2ccc([O-])c(Cl)c2)CC(C)(C)C1 ZINC001300581941 1053831639 /nfs/dbraw/zinc/83/16/39/1053831639.db2.gz RISXNLHOMKGQMG-UHFFFAOYSA-N -1 1 323.864 4.263 20 0 DIADMM [O-]c1cc(CN2CCc3cc(Cl)ccc3C2)ccc1Cl ZINC001231736694 1053846851 /nfs/dbraw/zinc/84/68/51/1053846851.db2.gz JVNVONRBTBTXEX-UHFFFAOYSA-N -1 1 308.208 4.257 20 0 DIADMM COC1(c2noc(-c3ccc4ccccc4c3[O-])n2)CCCC1 ZINC000273927419 1053856817 /nfs/dbraw/zinc/85/68/17/1053856817.db2.gz JTICOXJHJBFCCO-UHFFFAOYSA-N -1 1 310.353 4.011 20 0 DIADMM [O-]c1c(-c2nc([C@@H]3Cc4ccccc43)no2)ccc2ccccc21 ZINC000325678775 1054080684 /nfs/dbraw/zinc/08/06/84/1054080684.db2.gz NDLJPMABUCGEDB-QGZVFWFLSA-N -1 1 314.344 4.283 20 0 DIADMM CC(C)(C)[N@@H+](Cc1ccccc1)Cc1ccc(F)c(O)c1F ZINC001232933448 1054149695 /nfs/dbraw/zinc/14/96/95/1054149695.db2.gz KGOQLFVJUYQOAU-UHFFFAOYSA-N -1 1 305.368 4.471 20 0 DIADMM Cc1ccc([C@@H]2CCC[N@H+]2Cc2cc(Cl)ncc2O)cc1 ZINC001233035513 1054175288 /nfs/dbraw/zinc/17/52/88/1054175288.db2.gz FAAGGIFAMBZGQS-HNNXBMFYSA-N -1 1 302.805 4.086 20 0 DIADMM Cc1ccccc1[C@@H]1CCC[N@H+]1Cc1cc(Cl)ncc1[O-] ZINC001233035253 1054175513 /nfs/dbraw/zinc/17/55/13/1054175513.db2.gz DBOQYFPKEONVLN-HNNXBMFYSA-N -1 1 302.805 4.086 20 0 DIADMM CCCNc1ccc(Cl)cc1NC(=O)c1ccccc1[O-] ZINC000622442175 1054215877 /nfs/dbraw/zinc/21/58/77/1054215877.db2.gz DKFRZYOSVKFJKH-UHFFFAOYSA-N -1 1 304.777 4.120 20 0 DIADMM Oc1ccc(F)c(C[N@H+]2CC[C@H](c3ccc(Cl)cc3)C2)c1F ZINC001233396165 1054260725 /nfs/dbraw/zinc/26/07/25/1054260725.db2.gz NCFXYNHNLJAJOR-LBPRGKRZSA-N -1 1 323.770 4.313 20 0 DIADMM CCCC(=O)c1ccc([O-])cc1O[C@@H](C(C)=O)c1ccccc1 ZINC001233650120 1054321253 /nfs/dbraw/zinc/32/12/53/1054321253.db2.gz ICMYLBASVQUXJT-IBGZPJMESA-N -1 1 312.365 4.084 20 0 DIADMM CCCC(=O)c1ccc([O-])cc1O[C@H](C)c1cc(C)cnc1F ZINC001233650463 1054321323 /nfs/dbraw/zinc/32/13/23/1054321323.db2.gz KJLCEWAZLUENFT-GFCCVEGCSA-N -1 1 317.360 4.358 20 0 DIADMM CC(C)CN(C(=O)c1cc(F)ccc1[O-])c1cccc(Cl)c1 ZINC000622666408 1054321558 /nfs/dbraw/zinc/32/15/58/1054321558.db2.gz XWTCPSHKOZKEPY-UHFFFAOYSA-N -1 1 321.779 4.488 20 0 DIADMM CN(Cc1ccc(C(C)(C)C)cc1)C(=O)c1ccc([O-])c(F)c1 ZINC001440348036 1054349442 /nfs/dbraw/zinc/34/94/42/1054349442.db2.gz MKLCXKNWNFMZJQ-UHFFFAOYSA-N -1 1 315.388 4.101 20 0 DIADMM C[C@H](c1ccccc1)N(C)C(=O)c1ccc2ccc(O)cc2c1[O-] ZINC001440667961 1054363569 /nfs/dbraw/zinc/36/35/69/1054363569.db2.gz UDWACWVQLXQEBA-CYBMUJFWSA-N -1 1 321.376 4.084 20 0 DIADMM CCN(c1ccc(NC(=O)c2cc(F)ccc2[O-])cc1)C(C)C ZINC001440973995 1054377677 /nfs/dbraw/zinc/37/76/77/1054377677.db2.gz DEPLNBBLNNNHOI-UHFFFAOYSA-N -1 1 316.376 4.018 20 0 DIADMM C[C@H](c1cc2ccccc2o1)N(C)C(=O)c1ccc(F)c([O-])c1 ZINC001441008420 1054377708 /nfs/dbraw/zinc/37/77/08/1054377708.db2.gz UHCDCFYOLMHLEI-LLVKDONJSA-N -1 1 313.328 4.111 20 0 DIADMM C[C@H](NC(=O)NCc1ccc([O-])c(Cl)c1)C1CCCCCC1 ZINC001233901094 1054384107 /nfs/dbraw/zinc/38/41/07/1054384107.db2.gz LBCQVKDCMXJOMF-LBPRGKRZSA-N -1 1 324.852 4.204 20 0 DIADMM C[C@H](Oc1ccc(CC(=O)c2ccc([O-])cc2)cc1)C(F)(F)F ZINC001233942546 1054395251 /nfs/dbraw/zinc/39/52/51/1054395251.db2.gz ZOVNSCSCTSBTNE-NSHDSACASA-N -1 1 324.298 4.147 20 0 DIADMM CCN(C(=O)c1cc(Cl)ccc1[O-])[C@@H](C)c1ccc(F)cc1 ZINC001441816141 1054399502 /nfs/dbraw/zinc/39/95/02/1054399502.db2.gz VISPPGZROFSDRL-NSHDSACASA-N -1 1 321.779 4.408 20 0 DIADMM O=C(c1ccc(Cl)cc1[O-])N(CC1CCCCC1)C1CC1 ZINC001441895731 1054402901 /nfs/dbraw/zinc/40/29/01/1054402901.db2.gz RXOFYIQWQBWHGM-UHFFFAOYSA-N -1 1 307.821 4.231 20 0 DIADMM O=C(c1cc(F)ccc1[O-])N1CCCCC[C@@H]1c1ccccc1 ZINC001442744616 1054431624 /nfs/dbraw/zinc/43/16/24/1054431624.db2.gz OFVGVOMUUXHMIE-QGZVFWFLSA-N -1 1 313.372 4.289 20 0 DIADMM O=C(NC1(c2ccccc2F)CC1)c1cc2ccccc2cc1[O-] ZINC001444318508 1054473416 /nfs/dbraw/zinc/47/34/16/1054473416.db2.gz GMNIQEQTHWETSA-UHFFFAOYSA-N -1 1 321.351 4.104 20 0 DIADMM CCC[C@H](CCc1ccccc1)NC(=O)c1c([O-])cccc1F ZINC001444678008 1054483320 /nfs/dbraw/zinc/48/33/20/1054483320.db2.gz VDCWZZIPPDTPFU-OAHLLOKOSA-N -1 1 315.388 4.063 20 0 DIADMM Cc1ccc(C2(C(=O)Nc3ccc([O-])c(Cl)c3)CCC2)cc1 ZINC001446467312 1054535782 /nfs/dbraw/zinc/53/57/82/1054535782.db2.gz LSVNMRFMRONHNB-UHFFFAOYSA-N -1 1 315.800 4.414 20 0 DIADMM CC1(C)CC(NC(=O)Cc2ccc([O-])c(Cl)c2)CC(C)(C)C1 ZINC001446909294 1054551294 /nfs/dbraw/zinc/55/12/94/1054551294.db2.gz YMJRPKCDSSURDH-UHFFFAOYSA-N -1 1 323.864 4.309 20 0 DIADMM Cc1cc(C(F)F)oc1C(=O)Nc1ccc(Cl)cc1[O-] ZINC001447287163 1054557776 /nfs/dbraw/zinc/55/77/76/1054557776.db2.gz JPJQETMFEILHSA-UHFFFAOYSA-N -1 1 301.676 4.137 20 0 DIADMM COc1ccc(C(=O)Nc2ccc3oc(C)c(C)c3c2)c([O-])c1 ZINC001447995126 1054583229 /nfs/dbraw/zinc/58/32/29/1054583229.db2.gz OCOHJFCIDFEUDT-UHFFFAOYSA-N -1 1 311.337 4.016 20 0 DIADMM c1cc2[n-]c(O[C@H](c3ccccc3)c3ccccn3)nc2s1 ZINC001234847280 1054598902 /nfs/dbraw/zinc/59/89/02/1054598902.db2.gz HMXODDMFGFNJFC-OAHLLOKOSA-N -1 1 307.378 4.188 20 0 DIADMM COc1cc(NCc2cccc(Cl)c2[O-])ccc1OC(C)C ZINC000185633839 1054605317 /nfs/dbraw/zinc/60/53/17/1054605317.db2.gz ABZJJRDUGQZDNC-UHFFFAOYSA-N -1 1 321.804 4.454 20 0 DIADMM Cc1c2ccccc2oc1[C@H](C)NC(=O)c1cccc([O-])c1F ZINC001449052945 1054612924 /nfs/dbraw/zinc/61/29/24/1054612924.db2.gz UJPNUSZEGKLSLC-NSHDSACASA-N -1 1 313.328 4.077 20 0 DIADMM CC(C)Sc1ccccc1C(=O)Nc1ccc([O-])c(F)c1F ZINC001449449240 1054620609 /nfs/dbraw/zinc/62/06/09/1054620609.db2.gz PXMDTOFHEGCKHV-UHFFFAOYSA-N -1 1 323.364 4.423 20 0 DIADMM O=C([N-][C@H](c1ccc(F)cc1)C1CCCC1)C(F)(F)C(F)F ZINC001358279566 1054642340 /nfs/dbraw/zinc/64/23/40/1054642340.db2.gz BVBGODAMJFCBRL-LBPRGKRZSA-N -1 1 321.289 4.074 20 0 DIADMM O=C([N-][C@@H](c1ccc(F)cc1)C1CCCC1)C(F)(F)C(F)F ZINC001358279564 1054642407 /nfs/dbraw/zinc/64/24/07/1054642407.db2.gz BVBGODAMJFCBRL-GFCCVEGCSA-N -1 1 321.289 4.074 20 0 DIADMM C/C(=C/c1ccc(Cl)cc1)C(=O)Nc1cc([O-])c(F)cc1F ZINC001450899845 1054663855 /nfs/dbraw/zinc/66/38/55/1054663855.db2.gz SPXDDIMWQPZWNU-TWGQIWQCSA-N -1 1 323.726 4.366 20 0 DIADMM O=C(Nc1cc([O-])c(F)cc1F)c1ccc(-c2ccccc2)o1 ZINC001450901411 1054664257 /nfs/dbraw/zinc/66/42/57/1054664257.db2.gz TVABTXYCLXIJCF-UHFFFAOYSA-N -1 1 315.275 4.183 20 0 DIADMM CSc1cc(NC(=O)c2ccc([O-])cc2F)ccc1Cl ZINC001451481105 1054681609 /nfs/dbraw/zinc/68/16/09/1054681609.db2.gz CQWDZAOOZNXBHS-UHFFFAOYSA-N -1 1 311.765 4.159 20 0 DIADMM O=C(Cc1ccc([O-])c(Cl)c1)N[C@@H]1CCCC12CCCCC2 ZINC001453401815 1054734582 /nfs/dbraw/zinc/73/45/82/1054734582.db2.gz TYSQCDFSMXTDIB-MRXNPFEDSA-N -1 1 321.848 4.207 20 0 DIADMM C[C@@H]1C[C@@H]1[C@@H]1C[C@@H]1C(=O)Nc1cc(Cl)c([O-])c2ccccc12 ZINC001453779906 1054747083 /nfs/dbraw/zinc/74/70/83/1054747083.db2.gz GGRAOOUPSPEUPY-HYNSBDGHSA-N -1 1 315.800 4.429 20 0 DIADMM CC(C)[C@H]1C[C@H]1C(=O)Nc1cc(Cl)c([O-])c2ccccc12 ZINC001453774212 1054747785 /nfs/dbraw/zinc/74/77/85/1054747785.db2.gz ZEYRTCPYXKKZRG-CHWSQXEVSA-N -1 1 303.789 4.429 20 0 DIADMM CC(F)(F)c1c(F)cccc1NC(=O)c1ccc([O-])c(F)c1 ZINC001455020669 1054791388 /nfs/dbraw/zinc/79/13/88/1054791388.db2.gz GEWNMBLEHKBMST-UHFFFAOYSA-N -1 1 313.250 4.034 20 0 DIADMM COC(=O)c1nc2cc(-c3ccc(OC(C)(C)C)cc3)ccc2[n-]1 ZINC001235927203 1054851453 /nfs/dbraw/zinc/85/14/53/1054851453.db2.gz IAAFIIJKEBFTJI-UHFFFAOYSA-N -1 1 324.380 4.194 20 0 DIADMM COC(=O)c1nc2ccc(-c3ccc(OC(C)(C)C)cc3)cc2[n-]1 ZINC001235927203 1054851461 /nfs/dbraw/zinc/85/14/61/1054851461.db2.gz IAAFIIJKEBFTJI-UHFFFAOYSA-N -1 1 324.380 4.194 20 0 DIADMM Cc1cc2[nH]ccc2c(-c2ccc(Cl)c(C(=O)[O-])c2F)n1 ZINC001236142932 1054967698 /nfs/dbraw/zinc/96/76/98/1054967698.db2.gz IZPBEYJTIKAAIC-UHFFFAOYSA-N -1 1 304.708 4.029 20 0 DIADMM Cc1c2[nH]cnc2ccc1-c1ccc(Cl)c(C(=O)[O-])c1F ZINC001236157508 1054973483 /nfs/dbraw/zinc/97/34/83/1054973483.db2.gz FOCKZBVCWNEPNT-UHFFFAOYSA-N -1 1 304.708 4.029 20 0 DIADMM Cc1ccc(F)c(-c2ccc3c(C(F)(F)F)c[nH]c3n2)c1[O-] ZINC001236393303 1055089162 /nfs/dbraw/zinc/08/91/62/1055089162.db2.gz RPEJNHLVKJMCAS-UHFFFAOYSA-N -1 1 310.250 4.402 20 0 DIADMM Cc1ccc(F)c(-c2ccc(-c3nc4ccccc4[nH]3)cn2)c1[O-] ZINC001236391557 1055089879 /nfs/dbraw/zinc/08/98/79/1055089879.db2.gz OUKHKLUKGJGFHX-UHFFFAOYSA-N -1 1 319.339 4.445 20 0 DIADMM Cc1ccc(F)c(-c2cc(C(=O)Nc3ccccc3)ccn2)c1[O-] ZINC001236391414 1055090032 /nfs/dbraw/zinc/09/00/32/1055090032.db2.gz ITUTZIFGFOLYGE-UHFFFAOYSA-N -1 1 322.339 4.154 20 0 DIADMM Cc1ccc(-c2ccc(-c3c(F)ccc(C)c3[O-])nn2)s1 ZINC001236394216 1055092767 /nfs/dbraw/zinc/09/27/67/1055092767.db2.gz XZPLRBUOAYSZOL-UHFFFAOYSA-N -1 1 300.358 4.334 20 0 DIADMM O=C(c1cccc([O-])c1F)N1CCCC2(C1)CCCCCC2 ZINC001587234196 1055247615 /nfs/dbraw/zinc/24/76/15/1055247615.db2.gz VXDOBDMAQUVIRM-UHFFFAOYSA-N -1 1 305.393 4.108 20 0 DIADMM CC(C)[C@H](NC(=O)c1c([O-])cccc1F)c1ccc(Cl)cc1 ZINC001587809995 1055370250 /nfs/dbraw/zinc/37/02/50/1055370250.db2.gz NAXAHESGUIPKJP-INIZCTEOSA-N -1 1 321.779 4.312 20 0 DIADMM CC(C)[C@@H](NC(=O)c1c([O-])cccc1F)c1ccc(Cl)cc1 ZINC001587809996 1055370367 /nfs/dbraw/zinc/37/03/67/1055370367.db2.gz NAXAHESGUIPKJP-MRXNPFEDSA-N -1 1 321.779 4.312 20 0 DIADMM CCCN(Cc1ccccc1)C(=O)c1c([O-])cccc1Cl ZINC001587927359 1055399623 /nfs/dbraw/zinc/39/96/23/1055399623.db2.gz CWKGEHMDVRSQCO-UHFFFAOYSA-N -1 1 303.789 4.098 20 0 DIADMM [O-]c1c(F)cc(CN2CC[C@H](c3cccc(F)c3)C2)cc1Cl ZINC001237998806 1055581278 /nfs/dbraw/zinc/58/12/78/1055581278.db2.gz XIHCYJOMNKAJDY-ZDUSSCGKSA-N -1 1 323.770 4.313 20 0 DIADMM CC(C)c1oncc1[N-]C(=O)c1nc(-c2ccccc2)cs1 ZINC001595924261 1055649660 /nfs/dbraw/zinc/64/96/60/1055649660.db2.gz ZXKXFGVTIDADCZ-UHFFFAOYSA-N -1 1 313.382 4.174 20 0 DIADMM C[C@@H](NC(=O)c1cccc([O-])c1F)c1cccc2ccccc21 ZINC001538543218 1055654920 /nfs/dbraw/zinc/65/49/20/1055654920.db2.gz VQMLUEKVPPLFGZ-GFCCVEGCSA-N -1 1 309.340 4.176 20 0 DIADMM CC(C)[C@@H]1CCC[C@H](NC(=O)c2ccc3ccccc3c2[O-])C1 ZINC001565659304 1055716585 /nfs/dbraw/zinc/71/65/85/1055716585.db2.gz OLEQBFUZEJKPRD-CVEARBPZSA-N -1 1 311.425 4.490 20 0 DIADMM Cc1cccc(C(C)(C)NC(=O)c2c([O-])cccc2Cl)c1 ZINC001565805365 1055730881 /nfs/dbraw/zinc/73/08/81/1055730881.db2.gz ALPPTIXMGICDOM-UHFFFAOYSA-N -1 1 303.789 4.019 20 0 DIADMM O=C(Nc1nc2ccccc2n1C1CCCC1)c1ccccc1[O-] ZINC001565824988 1055734004 /nfs/dbraw/zinc/73/40/04/1055734004.db2.gz SNVNCPDGRSMYOW-UHFFFAOYSA-N -1 1 321.380 4.109 20 0 DIADMM CC[C@@]1(C)CCCN(C(=O)c2ccc(C(F)(F)F)c([O-])c2)C1 ZINC001566002622 1055739083 /nfs/dbraw/zinc/73/90/83/1055739083.db2.gz FXTHEMUOHYRUDA-HNNXBMFYSA-N -1 1 315.335 4.063 20 0 DIADMM CCc1ccc(-c2cc(C(=O)[N-]c3nocc3C3CC3)no2)cc1 ZINC001596874686 1055755455 /nfs/dbraw/zinc/75/54/55/1055755455.db2.gz SSACCVJHMBYFNO-UHFFFAOYSA-N -1 1 323.352 4.022 20 0 DIADMM CCCC(C)(C)C(=O)Nc1cc(C)cc(Br)c1[O-] ZINC001566891636 1055786158 /nfs/dbraw/zinc/78/61/58/1055786158.db2.gz VWPFAKPOIUPAJO-UHFFFAOYSA-N -1 1 314.223 4.228 20 0 DIADMM CC1(CNC(=O)Cc2ccc([O-])c(Cl)c2)CCCCCC1 ZINC001566907773 1055787595 /nfs/dbraw/zinc/78/75/95/1055787595.db2.gz DXCIPTAMXNZGOX-UHFFFAOYSA-N -1 1 309.837 4.065 20 0 DIADMM CN(C(=O)c1ccc(C(F)(F)F)c([O-])c1)[C@@H]1CCC(C)(C)C1 ZINC001568573396 1055840586 /nfs/dbraw/zinc/84/05/86/1055840586.db2.gz WBVVTIIHJZPEDD-LLVKDONJSA-N -1 1 315.335 4.062 20 0 DIADMM C[C@@H]1C[C@H](c2ccccc2)N(C(=O)c2ccc(Cl)cc2[O-])C1 ZINC001568779848 1055845149 /nfs/dbraw/zinc/84/51/49/1055845149.db2.gz FLYDYVSQSNUTHV-MLGOLLRUSA-N -1 1 315.800 4.269 20 0 DIADMM C[C@@H]1C[C@@H](C(C)(C)C)CCN1Cc1nc(=O)c2sccc2[n-]1 ZINC000347575794 1055847225 /nfs/dbraw/zinc/84/72/25/1055847225.db2.gz DCUDNCQMTWCNNR-NEPJUHHUSA-N -1 1 319.474 4.044 20 0 DIADMM C[C@H](C(=O)Nc1ccc([O-])c(F)c1F)c1cc2ccccc2o1 ZINC001569010810 1055851940 /nfs/dbraw/zinc/85/19/40/1055851940.db2.gz NSHGYXQNJQBTOT-VIFPVBQESA-N -1 1 317.291 4.159 20 0 DIADMM CC(C)(CC(=O)Nc1ccc([O-])c(F)c1F)c1ccc(F)cc1 ZINC001569012988 1055852729 /nfs/dbraw/zinc/85/27/29/1055852729.db2.gz WXBYKZHPJDAHJJ-UHFFFAOYSA-N -1 1 323.314 4.116 20 0 DIADMM Cc1ccccc1C(C)(C)NC(=O)c1ccc(Cl)cc1[O-] ZINC001569558251 1055865086 /nfs/dbraw/zinc/86/50/86/1055865086.db2.gz SRDJHKPMMYLLJZ-UHFFFAOYSA-N -1 1 303.789 4.019 20 0 DIADMM Cc1nc(NC(=O)c2ccccc2[O-])ccc1-c1ccccc1 ZINC001569879593 1055877171 /nfs/dbraw/zinc/87/71/71/1055877171.db2.gz HUJZFBUKHGKELW-UHFFFAOYSA-N -1 1 304.349 4.015 20 0 DIADMM CCSc1cccc(CNC(=O)c2ccc(Cl)cc2[O-])c1 ZINC001570041005 1055883285 /nfs/dbraw/zinc/88/32/85/1055883285.db2.gz WMDHPYQNADWQPB-UHFFFAOYSA-N -1 1 321.829 4.088 20 0 DIADMM CCCCN(C(=O)c1cccc([O-])c1F)[C@@H](C)c1ccc(C)o1 ZINC001597922382 1055892786 /nfs/dbraw/zinc/89/27/86/1055892786.db2.gz YBHLWHHSYIESRG-ZDUSSCGKSA-N -1 1 319.376 4.436 20 0 DIADMM C[C@H](NC(=O)c1ccc2ccccc2c1[O-])[C@@H]1CCC[C@H](C)C1 ZINC001570370879 1055898722 /nfs/dbraw/zinc/89/87/22/1055898722.db2.gz MLSPOHCOHKEPDL-OFQRWUPVSA-N -1 1 311.425 4.490 20 0 DIADMM CN(C(=O)c1c([O-])cccc1Cl)[C@H]1CCC[C@H]1C(C)(C)C ZINC001570457569 1055904859 /nfs/dbraw/zinc/90/48/59/1055904859.db2.gz YEIZREMXECBDIY-YPMHNXCESA-N -1 1 309.837 4.332 20 0 DIADMM O=C(Nc1cc(F)c([O-])cc1Cl)[C@@H]1C[C@@H]1c1ccc(F)cc1 ZINC001598582789 1055957996 /nfs/dbraw/zinc/95/79/96/1055957996.db2.gz OGOCMZAODCGTIF-GHMZBOCLSA-N -1 1 323.726 4.066 20 0 DIADMM O=C(Nc1cc(F)c([O-])cc1Cl)c1sccc1Cl ZINC001598590656 1055958409 /nfs/dbraw/zinc/95/84/09/1055958409.db2.gz DEONBYOAOUNPEN-UHFFFAOYSA-N -1 1 306.145 4.152 20 0 DIADMM Cc1cccc(C(=O)Nc2cccc(F)c2[O-])c1C(F)(F)F ZINC001587394008 1056003755 /nfs/dbraw/zinc/00/37/55/1056003755.db2.gz PNHMRCANGYLSSM-UHFFFAOYSA-N -1 1 313.250 4.111 20 0 DIADMM O=C(NC1CCCCCCC1)c1ccc(C(F)(F)F)cc1[O-] ZINC001540310740 1056012408 /nfs/dbraw/zinc/01/24/08/1056012408.db2.gz BSRJMFQKRAYLMJ-UHFFFAOYSA-N -1 1 315.335 4.254 20 0 DIADMM CC(C)c1cc(C(=O)[N-]c2ccccc2SC(F)F)on1 ZINC000072646723 1056033204 /nfs/dbraw/zinc/03/32/04/1056033204.db2.gz WUINQDMHCRUGRN-UHFFFAOYSA-N -1 1 312.341 4.365 20 0 DIADMM C[C@@H](c1ccc(F)cc1)N(C)C(=O)c1cc(Cl)ccc1[O-] ZINC001540569994 1056044783 /nfs/dbraw/zinc/04/47/83/1056044783.db2.gz JRIPBMXZQQMZDL-JTQLQIEISA-N -1 1 307.752 4.018 20 0 DIADMM O=C(N[C@H]1CCc2c1cccc2Cl)c1cc(Cl)ccc1[O-] ZINC001583258914 1056049242 /nfs/dbraw/zinc/04/92/42/1056049242.db2.gz MLHDZZMYYWNUPT-AWEZNQCLSA-N -1 1 322.191 4.116 20 0 DIADMM CCc1ccc([C@@H](NC(=O)c2cc(F)ccc2[O-])C(C)C)cc1 ZINC001540633468 1056054014 /nfs/dbraw/zinc/05/40/14/1056054014.db2.gz JJJIBZXMJMEYMX-SFHVURJKSA-N -1 1 315.388 4.221 20 0 DIADMM O=C(Nc1nc2c(s1)CCCC2)c1ccc2ccccc2c1[O-] ZINC000006244030 1056058795 /nfs/dbraw/zinc/05/87/95/1056058795.db2.gz NJIBFLWTNMTAJY-UHFFFAOYSA-N -1 1 324.405 4.133 20 0 DIADMM Cc1ccc([C@@H](C)N(C)C(=O)c2cc(Cl)ccc2[O-])c(C)c1 ZINC001540804672 1056079221 /nfs/dbraw/zinc/07/92/21/1056079221.db2.gz FJAKVKYYPAAEAK-CYBMUJFWSA-N -1 1 317.816 4.496 20 0 DIADMM CC(C)(C)CCCNC(=O)c1c([O-])cnc2ccc(Cl)cc21 ZINC001610938084 1056082267 /nfs/dbraw/zinc/08/22/67/1056082267.db2.gz KIESLMWJHJHXLY-UHFFFAOYSA-N -1 1 320.820 4.150 20 0 DIADMM O=C(c1c([O-])cccc1Cl)N(CC1CCCCC1)C1CC1 ZINC001542160541 1056106360 /nfs/dbraw/zinc/10/63/60/1056106360.db2.gz YLOIGMBOVFZXLI-UHFFFAOYSA-N -1 1 307.821 4.231 20 0 DIADMM C/C(=C\C1CCC(C)CC1)C(=O)Nc1nc(Cl)ccc1[O-] ZINC001611166906 1056120092 /nfs/dbraw/zinc/12/00/92/1056120092.db2.gz QAUSAROUJILBJG-PKNBQFBNSA-N -1 1 308.809 4.152 20 0 DIADMM CCCn1ccc2cc(NC(=O)c3ccc(F)c([O-])c3)ccc21 ZINC001542439876 1056123402 /nfs/dbraw/zinc/12/34/02/1056123402.db2.gz FERIAUCNIPMFKC-UHFFFAOYSA-N -1 1 312.344 4.148 20 0 DIADMM CC[C@H](C)Sc1ccc(NC(=O)c2ccc([O-])cn2)c(C)c1 ZINC001542476848 1056124491 /nfs/dbraw/zinc/12/44/91/1056124491.db2.gz QTGOYMPZOHWJHJ-LBPRGKRZSA-N -1 1 316.426 4.239 20 0 DIADMM C[C@H](CC(C)(C)c1ccccc1)NC(=O)c1cc(F)ccc1[O-] ZINC001542484215 1056126830 /nfs/dbraw/zinc/12/68/30/1056126830.db2.gz ODNNPSJDFJGCSK-CYBMUJFWSA-N -1 1 315.388 4.018 20 0 DIADMM CC(C)(NC(=O)c1ncc2ccccc2c1[O-])C1CCCCC1 ZINC001611439347 1056160326 /nfs/dbraw/zinc/16/03/26/1056160326.db2.gz WPGBWWWNPKYUKD-UHFFFAOYSA-N -1 1 312.413 4.029 20 0 DIADMM O=C(N[C@H](c1ccccc1)C1CCC1)c1ccc(Cl)cc1[O-] ZINC001543082850 1056173450 /nfs/dbraw/zinc/17/34/50/1056173450.db2.gz VUIWVQDFEWCNNM-QGZVFWFLSA-N -1 1 315.800 4.317 20 0 DIADMM CC[C@@H](c1ccccc1)N(CC)C(=O)c1ccc([O-])cc1F ZINC001583865578 1056189716 /nfs/dbraw/zinc/18/97/16/1056189716.db2.gz RNLFELGEWQGEER-KRWDZBQOSA-N -1 1 301.361 4.145 20 0 DIADMM CCOC(=O)c1nc2cc(-c3ccc(OC(C)C)cc3)ccc2[n-]1 ZINC001239960959 1056199940 /nfs/dbraw/zinc/19/99/40/1056199940.db2.gz FMAYELNQMYHTBM-UHFFFAOYSA-N -1 1 324.380 4.194 20 0 DIADMM CCOC(=O)c1nc2ccc(-c3ccc(OC(C)C)cc3)cc2[n-]1 ZINC001239960959 1056199946 /nfs/dbraw/zinc/19/99/46/1056199946.db2.gz FMAYELNQMYHTBM-UHFFFAOYSA-N -1 1 324.380 4.194 20 0 DIADMM CN(C(=O)c1cc(Cl)ccc1[O-])C(C)(C)c1ccccc1 ZINC000671893514 1056217291 /nfs/dbraw/zinc/21/72/91/1056217291.db2.gz JWBNFTDSWXMSAK-UHFFFAOYSA-N -1 1 303.789 4.053 20 0 DIADMM CCCC(=CC(=O)Nc1ccc(-c2cc(=O)[nH][n-]2)cc1)CCC ZINC001543591855 1056259557 /nfs/dbraw/zinc/25/95/57/1056259557.db2.gz RJCLMLYFTVNBCK-UHFFFAOYSA-N -1 1 313.401 4.247 20 0 DIADMM CCc1ccc(C(=O)Nc2nc(C(C)C)c(C)s2)c([O-])c1 ZINC001584243746 1056296466 /nfs/dbraw/zinc/29/64/66/1056296466.db2.gz PIMRLDKKMDMMKC-UHFFFAOYSA-N -1 1 304.415 4.095 20 0 DIADMM CCc1cc2c(ncnc2NCc2ccc([O-])c(Cl)c2)s1 ZINC001612853303 1056332458 /nfs/dbraw/zinc/33/24/58/1056332458.db2.gz MTCJVBATKUXEMA-UHFFFAOYSA-N -1 1 319.817 4.225 20 0 DIADMM Cc1ccccc1CC(C)(C)NC(=O)c1c([O-])cccc1Cl ZINC001584601648 1056379061 /nfs/dbraw/zinc/37/90/61/1056379061.db2.gz HYYQIWSIXWVYIJ-UHFFFAOYSA-N -1 1 317.816 4.105 20 0 DIADMM O=C([N-]c1ccnc(Cl)c1F)c1c(F)ccc(F)c1Cl ZINC001584757441 1056411585 /nfs/dbraw/zinc/41/15/85/1056411585.db2.gz RUUKDXMXOCJLIS-UHFFFAOYSA-N -1 1 321.085 4.058 20 0 DIADMM CCc1nc(SCc2ccc(Cl)cc2C)[n-]c(=O)c1C ZINC001613845049 1056413455 /nfs/dbraw/zinc/41/34/55/1056413455.db2.gz RMJMQZPFUKCVPO-UHFFFAOYSA-N -1 1 308.834 4.307 20 0 DIADMM CCc1nc(SCCCc2ccc(Cl)cc2)[n-]c(=O)c1C ZINC001613844579 1056413921 /nfs/dbraw/zinc/41/39/21/1056413921.db2.gz BPWBAFNFTXJBFA-UHFFFAOYSA-N -1 1 322.861 4.431 20 0 DIADMM Cc1ccc(F)c(CSc2nc(C)c(C3CC3)c(=O)[n-]2)c1F ZINC001614794372 1056452186 /nfs/dbraw/zinc/45/21/86/1056452186.db2.gz VOSHEGLBVLUMNA-UHFFFAOYSA-N -1 1 322.380 4.247 20 0 DIADMM Cc1ccc(CCSc2nc(C)c(C3CC3)c(=O)[n-]2)cc1 ZINC001614793801 1056452291 /nfs/dbraw/zinc/45/22/91/1056452291.db2.gz LVFMFMGKEURWNG-UHFFFAOYSA-N -1 1 300.427 4.011 20 0 DIADMM C[C@H](SCc1cc(=O)oc2cc([O-])ccc12)c1ccccc1 ZINC001614828325 1056454665 /nfs/dbraw/zinc/45/46/65/1056454665.db2.gz ZORMXDORJWUPGW-LBPRGKRZSA-N -1 1 312.390 4.493 20 0 DIADMM Cc1cc(Oc2ccccc2)ccc1NC(=O)c1ccc([O-])cn1 ZINC001615208681 1056476904 /nfs/dbraw/zinc/47/69/04/1056476904.db2.gz FALTZDAMYIRQFG-UHFFFAOYSA-N -1 1 320.348 4.140 20 0 DIADMM CCOC(=O)c1nc2cc(-c3ccc4occc4c3)ccc2[n-]1 ZINC001240425430 1056500469 /nfs/dbraw/zinc/50/04/69/1056500469.db2.gz UWCRMCNSDOJWAP-UHFFFAOYSA-N -1 1 306.321 4.153 20 0 DIADMM CCOC(=O)c1nc2ccc(-c3ccc4occc4c3)cc2[n-]1 ZINC001240425430 1056500480 /nfs/dbraw/zinc/50/04/80/1056500480.db2.gz UWCRMCNSDOJWAP-UHFFFAOYSA-N -1 1 306.321 4.153 20 0 DIADMM Cc1cccnc1C(=O)Nc1cc(Cl)c([O-])c2ccccc12 ZINC001585193407 1056503520 /nfs/dbraw/zinc/50/35/20/1056503520.db2.gz YEUQCBSZZRAENV-UHFFFAOYSA-N -1 1 312.756 4.155 20 0 DIADMM O=C(c1ccc(F)c([O-])c1)N1CCC[C@@H]1c1ccccc1Cl ZINC001544805742 1056504326 /nfs/dbraw/zinc/50/43/26/1056504326.db2.gz IASDHMODTYAHAP-OAHLLOKOSA-N -1 1 319.763 4.162 20 0 DIADMM CCOc1ccc(NC(=O)c2ccc(C(C)C)cc2[O-])cc1F ZINC001544896956 1056524423 /nfs/dbraw/zinc/52/44/23/1056524423.db2.gz IXBHZVHFBURWDV-UHFFFAOYSA-N -1 1 317.360 4.306 20 0 DIADMM O=C(c1ccc(Cl)cc1[O-])N1CCCC[C@@H]1CC1CCC1 ZINC001585376467 1056538685 /nfs/dbraw/zinc/53/86/85/1056538685.db2.gz QGJMVRCKUAVUDV-CQSZACIVSA-N -1 1 307.821 4.231 20 0 DIADMM O=C(c1ncc2ccccc2c1[O-])N1CCCC[C@@H]1CC1CCC1 ZINC001585375893 1056540067 /nfs/dbraw/zinc/54/00/67/1056540067.db2.gz GFSKULQRHSXNSE-MRXNPFEDSA-N -1 1 324.424 4.125 20 0 DIADMM Cc1ccc(F)cc1[N-]S(=O)(=O)c1c(C)c(C)cc(C)c1C ZINC000006866530 1056555944 /nfs/dbraw/zinc/55/59/44/1056555944.db2.gz PJPNAZLNTBEWGH-UHFFFAOYSA-N -1 1 321.417 4.169 20 0 DIADMM CC[C@@H](C)c1ccc(S(=O)(=O)[N-]c2cc(F)ccc2C)cc1 ZINC000007405629 1056579579 /nfs/dbraw/zinc/57/95/79/1056579579.db2.gz XSAPSEXBSUJUKD-GFCCVEGCSA-N -1 1 321.417 4.448 20 0 DIADMM Cc1ccc([N-]S(=O)(=O)c2ccc3ccccc3c2)cc1F ZINC000007405747 1056580019 /nfs/dbraw/zinc/58/00/19/1056580019.db2.gz SDMPSZCDNFUHIJ-UHFFFAOYSA-N -1 1 315.369 4.088 20 0 DIADMM Cc1cc(Nc2cc(F)c([O-])c(Cl)c2)n(CC2CCC2)n1 ZINC001214484255 1056581721 /nfs/dbraw/zinc/58/17/21/1056581721.db2.gz HDCFJHCDPXVAOJ-UHFFFAOYSA-N -1 1 309.772 4.233 20 0 DIADMM CC(C)N(Cc1cccc(Cl)c1)C(=O)c1ccc(F)c([O-])c1 ZINC001615883885 1056590287 /nfs/dbraw/zinc/59/02/87/1056590287.db2.gz IUOMZWYCHVXNNG-UHFFFAOYSA-N -1 1 321.779 4.236 20 0 DIADMM CCc1nc2sc3c(c2c(-c2cc(F)ccc2[O-])n1)CCC3 ZINC001240695010 1056645242 /nfs/dbraw/zinc/64/52/42/1056645242.db2.gz ADIFCRPXYPJJKA-UHFFFAOYSA-N -1 1 314.385 4.254 20 0 DIADMM O=C(Nc1ccccc1)Nc1ccnc(-c2cc(F)ccc2[O-])c1 ZINC001240693209 1056645524 /nfs/dbraw/zinc/64/55/24/1056645524.db2.gz HAHKDBZBKYXOHT-UHFFFAOYSA-N -1 1 323.327 4.237 20 0 DIADMM [O-]c1ccc(F)cc1-c1nc(-c2ccncc2)nc2ccccc21 ZINC001240695214 1056645665 /nfs/dbraw/zinc/64/56/65/1056645665.db2.gz FOENCKFDENNXIH-UHFFFAOYSA-N -1 1 317.323 4.204 20 0 DIADMM CCOc1cc(C(=O)Nc2ccc(CC)cc2)cc(Cl)c1[O-] ZINC000215957669 1056677835 /nfs/dbraw/zinc/67/78/35/1056677835.db2.gz DPHKVWXDXWYTSV-UHFFFAOYSA-N -1 1 319.788 4.259 20 0 DIADMM [O-]c1ccc(-c2ncnc3ccc(C(F)(F)F)cc32)cc1F ZINC001240783135 1056695003 /nfs/dbraw/zinc/69/50/03/1056695003.db2.gz LTAAJWAXFHCVQD-UHFFFAOYSA-N -1 1 308.234 4.160 20 0 DIADMM [O-]c1ccc(-c2ncnc3c(-c4ccccc4)nsc32)cc1F ZINC001240782518 1056695442 /nfs/dbraw/zinc/69/54/42/1056695442.db2.gz FZIDIWUEBDWYJB-UHFFFAOYSA-N -1 1 323.352 4.265 20 0 DIADMM [O-]c1ccc(-c2nc3ccccc3nc2C(F)(F)F)cc1F ZINC001240782341 1056695460 /nfs/dbraw/zinc/69/54/60/1056695460.db2.gz WLRIGEXPLJDRIU-UHFFFAOYSA-N -1 1 308.234 4.160 20 0 DIADMM Cc1cccc(Sc2cncc(-c3ccc([O-])c(F)c3)n2)c1 ZINC001240782452 1056696060 /nfs/dbraw/zinc/69/60/60/1056696060.db2.gz BSHQAERRSGVQDQ-UHFFFAOYSA-N -1 1 312.369 4.448 20 0 DIADMM CC(C)(C)[C@H]1CCc2nnc(-c3ccc([O-])c(F)c3)cc2C1 ZINC001240786439 1056697709 /nfs/dbraw/zinc/69/77/09/1056697709.db2.gz STFWVTHCQLSDFP-ZDUSSCGKSA-N -1 1 300.377 4.139 20 0 DIADMM Cc1ccc(-c2nc3c(ncnc3-c3ccc([O-])c(F)c3)o2)cc1 ZINC001240783586 1056697935 /nfs/dbraw/zinc/69/79/35/1056697935.db2.gz WDCZCYMEPUCHCP-UHFFFAOYSA-N -1 1 321.311 4.105 20 0 DIADMM COc1cc(F)c(F)cc1Nc1cc(F)c([O-])c(Cl)c1 ZINC001214489691 1056698396 /nfs/dbraw/zinc/69/83/96/1056698396.db2.gz HMZMBAMMCFFPHI-UHFFFAOYSA-N -1 1 303.667 4.215 20 0 DIADMM CCOC(=O)c1ccc(C)c(Nc2cc(F)c([O-])c(Cl)c2)c1 ZINC001214490338 1056715046 /nfs/dbraw/zinc/71/50/46/1056715046.db2.gz UIVVKEYZNWWASD-UHFFFAOYSA-N -1 1 323.751 4.413 20 0 DIADMM CCSc1ccc([C@H](C)NC(=O)c2cccc([O-])c2F)cc1 ZINC001616792650 1056718548 /nfs/dbraw/zinc/71/85/48/1056718548.db2.gz DCQYKYRBPHZBFV-NSHDSACASA-N -1 1 319.401 4.134 20 0 DIADMM O=C([O-])c1ccc(-c2cccc3nc(C(F)(F)F)[nH]c32)s1 ZINC001240849913 1056729422 /nfs/dbraw/zinc/72/94/22/1056729422.db2.gz YZUXSQPHBFVZJO-UHFFFAOYSA-N -1 1 312.272 4.008 20 0 DIADMM Cc1ccc(C[C@H](C)NC(=O)c2ccc(Cl)cc2[O-])c(C)c1 ZINC001617252624 1056802354 /nfs/dbraw/zinc/80/23/54/1056802354.db2.gz IZNWCUCJEMVVIV-ZDUSSCGKSA-N -1 1 317.816 4.023 20 0 DIADMM COC(=O)c1nc2cc(-c3ccc(C)c4ccccc43)ccc2[n-]1 ZINC001241005557 1056809831 /nfs/dbraw/zinc/80/98/31/1056809831.db2.gz VXHUMIGVUMQDPN-UHFFFAOYSA-N -1 1 316.360 4.478 20 0 DIADMM COC(=O)c1nc2ccc(-c3ccc(C)c4ccccc43)cc2[n-]1 ZINC001241005557 1056809839 /nfs/dbraw/zinc/80/98/39/1056809839.db2.gz VXHUMIGVUMQDPN-UHFFFAOYSA-N -1 1 316.360 4.478 20 0 DIADMM C[C@H](CN(C)C(=O)c1ccc(Cl)cc1[O-])C1CCCCC1 ZINC001587021261 1056850381 /nfs/dbraw/zinc/85/03/81/1056850381.db2.gz JUAZDUYIXWSRPD-GFCCVEGCSA-N -1 1 309.837 4.334 20 0 DIADMM CC[C@@](C)(NC(=O)c1cc(Cl)ccc1[O-])c1ccccc1 ZINC001617664149 1056866650 /nfs/dbraw/zinc/86/66/50/1056866650.db2.gz CSOZXQCWDNPGGA-QGZVFWFLSA-N -1 1 303.789 4.101 20 0 DIADMM CC(C)(C)[C@H]1CCc2nnc(-c3c(F)cc([O-])cc3F)cc2C1 ZINC001241120317 1056907096 /nfs/dbraw/zinc/90/70/96/1056907096.db2.gz ZNLAJPVVQVFMHA-NSHDSACASA-N -1 1 318.367 4.278 20 0 DIADMM [O-]c1cc(F)c(-c2ccc(SC(F)(F)F)cn2)c(F)c1 ZINC001241120201 1056907114 /nfs/dbraw/zinc/90/71/14/1056907114.db2.gz WCQNVSXVRMTMQM-UHFFFAOYSA-N -1 1 307.243 4.344 20 0 DIADMM [O-]c1cc(F)c(-c2cc(F)ccc2OC(F)(F)F)c(F)c1 ZINC001241122213 1056907265 /nfs/dbraw/zinc/90/72/65/1056907265.db2.gz XFJJESPPFBEJBO-UHFFFAOYSA-N -1 1 308.177 4.375 20 0 DIADMM CC(C)(C)OC(=O)Cc1ccc(-c2c(F)cc([O-])cc2F)cc1 ZINC001241122948 1056907720 /nfs/dbraw/zinc/90/77/20/1056907720.db2.gz PLEANUZUSJNDJL-UHFFFAOYSA-N -1 1 320.335 4.222 20 0 DIADMM [O-]c1cc(F)c(-c2ccc3nc4c(cc3c2)CCCO4)c(F)c1 ZINC001241123214 1056908325 /nfs/dbraw/zinc/90/83/25/1056908325.db2.gz VSZGOQAEMTYQNE-UHFFFAOYSA-N -1 1 313.303 4.211 20 0 DIADMM COc1cc(-c2c(F)cc([O-])cc2F)ccc1-c1ccncc1 ZINC001241124071 1056909163 /nfs/dbraw/zinc/90/91/63/1056909163.db2.gz BFCYBRJLMRNUJB-UHFFFAOYSA-N -1 1 313.303 4.408 20 0 DIADMM CCOC(=O)C(C)(C)c1ccc(-c2c(F)cc([O-])cc2F)cc1 ZINC001241124557 1056910188 /nfs/dbraw/zinc/91/01/88/1056910188.db2.gz IFJWXBJTRGCOHH-UHFFFAOYSA-N -1 1 320.335 4.178 20 0 DIADMM COc1cc(-c2c(F)cc([O-])cc2F)ccc1OC(F)(F)F ZINC001241124548 1056910346 /nfs/dbraw/zinc/91/03/46/1056910346.db2.gz HXGLQVKGGUGSPD-UHFFFAOYSA-N -1 1 320.213 4.245 20 0 DIADMM CCOC(=O)c1nc2cc(-c3ccc(Cl)c(F)c3)ccc2[n-]1 ZINC001241232815 1056971884 /nfs/dbraw/zinc/97/18/84/1056971884.db2.gz UCOMIJFFSRMYJM-UHFFFAOYSA-N -1 1 318.735 4.199 20 0 DIADMM CCOC(=O)c1nc2ccc(-c3ccc(Cl)c(F)c3)cc2[n-]1 ZINC001241232815 1056971890 /nfs/dbraw/zinc/97/18/90/1056971890.db2.gz UCOMIJFFSRMYJM-UHFFFAOYSA-N -1 1 318.735 4.199 20 0 DIADMM Cc1cnc(-c2cc([O-])cc(F)c2)nc1-c1c(F)cccc1F ZINC001241261448 1056985416 /nfs/dbraw/zinc/98/54/16/1056985416.db2.gz OIWQOFNDIKIJRH-UHFFFAOYSA-N -1 1 316.282 4.242 20 0 DIADMM CC(C)c1ccc2ncnc(-c3c(F)ccc([O-])c3F)c2c1 ZINC001241290335 1056998877 /nfs/dbraw/zinc/99/88/77/1056998877.db2.gz PYDAYEIOMHEVOK-UHFFFAOYSA-N -1 1 300.308 4.404 20 0 DIADMM COc1ccc2nc(-c3c(F)ccc([O-])c3F)c(C)cc2c1 ZINC001241289586 1056999083 /nfs/dbraw/zinc/99/90/83/1056999083.db2.gz BVTMYPXBXAGTCM-UHFFFAOYSA-N -1 1 301.292 4.203 20 0 DIADMM CSc1ccc2ncnc(-c3c(F)ccc([O-])c3F)c2c1 ZINC001241291564 1057000243 /nfs/dbraw/zinc/00/02/43/1057000243.db2.gz QGRLEYDGOPSUQE-UHFFFAOYSA-N -1 1 304.321 4.003 20 0 DIADMM CC(C)(C)C1CCN(C(=O)c2cc3ccccc3cc2[O-])CC1 ZINC000390631946 1057048791 /nfs/dbraw/zinc/04/87/91/1057048791.db2.gz FJHDJDDQANLCNK-UHFFFAOYSA-N -1 1 311.425 4.444 20 0 DIADMM CCOc1cc(C(=O)N(C)c2ccc(C)cc2)cc(Cl)c1[O-] ZINC000186757207 1057117643 /nfs/dbraw/zinc/11/76/43/1057117643.db2.gz IVCMEAXSQCDNDV-UHFFFAOYSA-N -1 1 319.788 4.029 20 0 DIADMM CC(C)(C)C[C@H]1CCN(C(=O)c2cc3ccccc3cc2[O-])C1 ZINC000307770531 1057186519 /nfs/dbraw/zinc/18/65/19/1057186519.db2.gz FXDQXVFKOWDCNM-CQSZACIVSA-N -1 1 311.425 4.444 20 0 DIADMM Cc1nc2ccsc2c(-c2cc(C(F)(F)F)ccc2[O-])n1 ZINC001242125983 1057271082 /nfs/dbraw/zinc/27/10/82/1057271082.db2.gz DOGLKWRKRUEOAI-UHFFFAOYSA-N -1 1 310.300 4.391 20 0 DIADMM CC(C)n1ccc2c1ncnc2-c1cc(C(F)(F)F)ccc1[O-] ZINC001242131371 1057273604 /nfs/dbraw/zinc/27/36/04/1057273604.db2.gz DGMRVTLVDPBSBM-UHFFFAOYSA-N -1 1 321.302 4.404 20 0 DIADMM [O-]c1ccc(C(F)(F)F)cc1-c1nc(C2CC2)nc2c1CCC2 ZINC001242133840 1057274613 /nfs/dbraw/zinc/27/46/13/1057274613.db2.gz KPDVRJLDDMYMRF-UHFFFAOYSA-N -1 1 320.314 4.234 20 0 DIADMM Cc1cc(-c2cc(C(F)(F)F)ccc2[O-])nc(C(C)(C)C)n1 ZINC001242133000 1057274952 /nfs/dbraw/zinc/27/49/52/1057274952.db2.gz AGIVZMVZDBQVDE-UHFFFAOYSA-N -1 1 310.319 4.474 20 0 DIADMM COc1c(C)nc(C2CC2)nc1-c1cc(C(F)(F)F)ccc1[O-] ZINC001242133024 1057275026 /nfs/dbraw/zinc/27/50/26/1057275026.db2.gz BKTHHKKTRIOPOY-UHFFFAOYSA-N -1 1 324.302 4.062 20 0 DIADMM [O-]c1ccc(-c2ncc3ccc(F)cc3n2)cc1C(F)(F)F ZINC001242147665 1057279712 /nfs/dbraw/zinc/27/97/12/1057279712.db2.gz CRXTXMMHTLHLIH-UHFFFAOYSA-N -1 1 308.234 4.160 20 0 DIADMM Cc1nc2ccsc2c(-c2ccc([O-])c(C(F)(F)F)c2)n1 ZINC001242148305 1057280223 /nfs/dbraw/zinc/28/02/23/1057280223.db2.gz SEGHRZQNKMACLP-UHFFFAOYSA-N -1 1 310.300 4.391 20 0 DIADMM Cc1ccc2nc(-c3ccc([O-])c(C(F)(F)F)c3)ccc2n1 ZINC001242151422 1057280595 /nfs/dbraw/zinc/28/05/95/1057280595.db2.gz NJJXENMEVFLYJL-UHFFFAOYSA-N -1 1 304.271 4.330 20 0 DIADMM Cc1cc(C(F)(F)F)nc(-c2ccc([O-])c(C(F)(F)F)c2)n1 ZINC001242151675 1057280653 /nfs/dbraw/zinc/28/06/53/1057280653.db2.gz TZMBWGBDZFXRML-UHFFFAOYSA-N -1 1 322.208 4.195 20 0 DIADMM COc1ccc2c(c1)ncnc2-c1ccc([O-])c(C(F)(F)F)c1 ZINC001242151576 1057280709 /nfs/dbraw/zinc/28/07/09/1057280709.db2.gz QBERXBSWDWCYKQ-UHFFFAOYSA-N -1 1 320.270 4.030 20 0 DIADMM COc1cccc2c(-c3ccc([O-])c(C(F)(F)F)c3)ncnc12 ZINC001242151457 1057280813 /nfs/dbraw/zinc/28/08/13/1057280813.db2.gz OWSJQUMFTYOWPZ-UHFFFAOYSA-N -1 1 320.270 4.030 20 0 DIADMM [O-]c1ccc(-c2cnc(-c3ccco3)cn2)cc1C(F)(F)F ZINC001242151219 1057281169 /nfs/dbraw/zinc/28/11/69/1057281169.db2.gz HSOGICMHNKOSAA-UHFFFAOYSA-N -1 1 306.243 4.128 20 0 DIADMM Cc1nsc2nc(-c3ccc([O-])c(C(F)(F)F)c3)ccc12 ZINC001242153415 1057281451 /nfs/dbraw/zinc/28/14/51/1057281451.db2.gz XCWQZBVZPAGPTE-UHFFFAOYSA-N -1 1 310.300 4.391 20 0 DIADMM COC(=O)c1ccc(-c2ccc([O-])c(C(F)(F)F)c2)c(F)c1 ZINC001242156966 1057283633 /nfs/dbraw/zinc/28/36/33/1057283633.db2.gz AGCLFTDPNRMFNW-UHFFFAOYSA-N -1 1 314.234 4.004 20 0 DIADMM CC[C@H](C)Oc1nccnc1-c1ccc([O-])c(C(F)(F)F)c1 ZINC001242158291 1057284784 /nfs/dbraw/zinc/28/47/84/1057284784.db2.gz WUBXSVRCOFMDPU-VIFPVBQESA-N -1 1 312.291 4.045 20 0 DIADMM Cc1cccc(Oc2nc(-c3cccc(C)c3[O-])ncc2F)c1 ZINC001242345048 1057340484 /nfs/dbraw/zinc/34/04/84/1057340484.db2.gz HXDWQBGPVYDNAD-UHFFFAOYSA-N -1 1 310.328 4.397 20 0 DIADMM CC(C)(C)OC(=O)c1ccc(-c2cccc(Cl)c2[O-])cn1 ZINC001242366278 1057347131 /nfs/dbraw/zinc/34/71/31/1057347131.db2.gz IKKJDMYPQSSFBE-UHFFFAOYSA-N -1 1 305.761 4.063 20 0 DIADMM CC(=O)N1CCCc2ccc(-c3cccc(Cl)c3[O-])cc21 ZINC001242365060 1057347223 /nfs/dbraw/zinc/34/72/23/1057347223.db2.gz VECFADGUPCAKRY-UHFFFAOYSA-N -1 1 301.773 4.012 20 0 DIADMM CC(C)(C)c1nnc2ccc(-c3cccc(Cl)c3[O-])cn21 ZINC001242366052 1057347715 /nfs/dbraw/zinc/34/77/15/1057347715.db2.gz ORJQTUBDDOYYJT-UHFFFAOYSA-N -1 1 301.777 4.053 20 0 DIADMM COC(=O)c1nc2ccc(-c3cccc(Cl)c3[O-])cc2s1 ZINC001242368041 1057348254 /nfs/dbraw/zinc/34/82/54/1057348254.db2.gz VRHLVHQTMFDRPK-UHFFFAOYSA-N -1 1 319.769 4.109 20 0 DIADMM CCOC(=O)C1(c2ccc(-c3cccc(Cl)c3[O-])cc2)CC1 ZINC001242368173 1057348516 /nfs/dbraw/zinc/34/85/16/1057348516.db2.gz XNWUUUZFRFDQQD-UHFFFAOYSA-N -1 1 316.784 4.307 20 0 DIADMM [O-]c1c(Cl)cccc1-c1cccc(-c2ncc3ncccn32)c1 ZINC001242367638 1057348533 /nfs/dbraw/zinc/34/85/33/1057348533.db2.gz PSTQJKMYAOUJGS-UHFFFAOYSA-N -1 1 321.767 4.422 20 0 DIADMM [O-]c1c(Cl)cccc1-c1ccc(N2CCSCC2)cc1 ZINC001242367553 1057348605 /nfs/dbraw/zinc/34/86/05/1057348605.db2.gz LUIZGBIUAYTELC-UHFFFAOYSA-N -1 1 305.830 4.266 20 0 DIADMM CCOC(=O)CCc1ccc(-c2cccc(Cl)c2[O-])cc1 ZINC001242367092 1057349084 /nfs/dbraw/zinc/34/90/84/1057349084.db2.gz WNDCEFKWROUZOM-UHFFFAOYSA-N -1 1 304.773 4.208 20 0 DIADMM CC(C)(C)OC(=O)c1cccnc1-c1cccc([O-])c1Cl ZINC001242797812 1057479577 /nfs/dbraw/zinc/47/95/77/1057479577.db2.gz MZSJFANOQAQWRB-UHFFFAOYSA-N -1 1 305.761 4.063 20 0 DIADMM [O-]c1cccc(-c2cncc(OCc3ccccc3)n2)c1Cl ZINC001242797105 1057479666 /nfs/dbraw/zinc/47/96/66/1057479666.db2.gz GFJHXUZXYJMSME-UHFFFAOYSA-N -1 1 312.756 4.082 20 0 DIADMM CSc1nc(-c2cccc([O-])c2Cl)cc(C(F)(F)F)n1 ZINC001242798192 1057479801 /nfs/dbraw/zinc/47/98/01/1057479801.db2.gz ITMDOMQIAWGZSD-UHFFFAOYSA-N -1 1 320.723 4.243 20 0 DIADMM [O-]c1cccc(-c2ncc(OCc3ccccc3)cn2)c1Cl ZINC001242797660 1057479948 /nfs/dbraw/zinc/47/99/48/1057479948.db2.gz LKNUWQQFPWYENC-UHFFFAOYSA-N -1 1 312.756 4.082 20 0 DIADMM [O-]c1cccc(-c2cc(OCC(F)(F)F)ccn2)c1Cl ZINC001242797629 1057480044 /nfs/dbraw/zinc/48/00/44/1057480044.db2.gz LDTAHKLWCICNNL-UHFFFAOYSA-N -1 1 303.667 4.049 20 0 DIADMM CC1(C)CCCN(c2ccnc(-c3cccc([O-])c3Cl)n2)C1 ZINC001242799984 1057480978 /nfs/dbraw/zinc/48/09/78/1057480978.db2.gz BDMXMWYPMCENJU-UHFFFAOYSA-N -1 1 317.820 4.129 20 0 DIADMM [O-]c1cccc(-c2ccc3nc(C(F)(F)F)cn3c2)c1Cl ZINC001242799881 1057481001 /nfs/dbraw/zinc/48/10/01/1057481001.db2.gz HAFCJNHGWRCMBY-UHFFFAOYSA-N -1 1 312.678 4.379 20 0 DIADMM [O-]c1cccc(-c2cc(Oc3cccc(F)c3)ncn2)c1Cl ZINC001242800191 1057481709 /nfs/dbraw/zinc/48/17/09/1057481709.db2.gz DYUWWNSUTFDHHN-UHFFFAOYSA-N -1 1 316.719 4.434 20 0 DIADMM CCOC(=O)c1cc2ccc(-c3cccc([O-])c3Cl)cc2[nH]1 ZINC001242800792 1057481974 /nfs/dbraw/zinc/48/19/74/1057481974.db2.gz UAWVTVAGCALMQP-UHFFFAOYSA-N -1 1 315.756 4.371 20 0 DIADMM CCOC(=O)c1noc2cc(-c3cccc([O-])c3Cl)ccc21 ZINC001242800796 1057481985 /nfs/dbraw/zinc/48/19/85/1057481985.db2.gz ORMWVTPDBSKQBA-UHFFFAOYSA-N -1 1 317.728 4.031 20 0 DIADMM COc1ccccc1-c1ccnc(-c2cccc([O-])c2Cl)n1 ZINC001242801625 1057482108 /nfs/dbraw/zinc/48/21/08/1057482108.db2.gz ULBWPRGXIQYXMT-UHFFFAOYSA-N -1 1 312.756 4.178 20 0 DIADMM CC1(C)CC(=O)Nc2ccc(-c3cccc([O-])c3Cl)cc21 ZINC001242800644 1057482258 /nfs/dbraw/zinc/48/22/58/1057482258.db2.gz PBDQDQVTGQIELW-UHFFFAOYSA-N -1 1 301.773 4.332 20 0 DIADMM COc1ccccc1-c1ccc(-c2cccc([O-])c2Cl)nn1 ZINC001242800912 1057482399 /nfs/dbraw/zinc/48/23/99/1057482399.db2.gz MCDWLCJIGGSLPN-UHFFFAOYSA-N -1 1 312.756 4.178 20 0 DIADMM O=c1ccc(-c2cccc([O-])c2Cl)cn1-c1cccc(F)c1 ZINC001242801590 1057482416 /nfs/dbraw/zinc/48/24/16/1057482416.db2.gz BJARNJRMBGETLB-UHFFFAOYSA-N -1 1 315.731 4.003 20 0 DIADMM CCOC(=O)c1noc2ccc(-c3cccc([O-])c3Cl)cc21 ZINC001242803682 1057482904 /nfs/dbraw/zinc/48/29/04/1057482904.db2.gz XUOFASFJRIFELA-UHFFFAOYSA-N -1 1 317.728 4.031 20 0 DIADMM CN1C(=O)CC(C)(C)c2cc(-c3cccc([O-])c3Cl)ccc21 ZINC001242802610 1057482957 /nfs/dbraw/zinc/48/29/57/1057482957.db2.gz CJKBFZFPRDFWGS-UHFFFAOYSA-N -1 1 315.800 4.357 20 0 DIADMM O=c1c(-c2cccc([O-])c2Cl)cccn1-c1ccccc1F ZINC001242802006 1057483260 /nfs/dbraw/zinc/48/32/60/1057483260.db2.gz LVSORIWPAVEFKI-UHFFFAOYSA-N -1 1 315.731 4.003 20 0 DIADMM [O-]c1cccc(-c2cccnc2OCC(F)(F)F)c1Cl 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[O-]c1ccc(-c2cnc3[nH]cc(C(F)(F)F)c3c2)c(F)c1F ZINC001243342817 1057653435 /nfs/dbraw/zinc/65/34/35/1057653435.db2.gz KTJQQSMMJMHGEQ-UHFFFAOYSA-N -1 1 314.213 4.233 20 0 DIADMM CCOC(=O)c1ccc(-c2ccc([O-])c(F)c2F)c(C)c1C ZINC001243343408 1057653786 /nfs/dbraw/zinc/65/37/86/1057653786.db2.gz AZVYHPDLRQULDV-UHFFFAOYSA-N -1 1 306.308 4.131 20 0 DIADMM CC(C)Oc1cc(F)c(F)cc1-c1ccc([O-])c(F)c1F ZINC001243343541 1057653840 /nfs/dbraw/zinc/65/38/40/1057653840.db2.gz GWSSXYUXXANNJF-UHFFFAOYSA-N -1 1 300.251 4.403 20 0 DIADMM COC(=O)c1cc(-c2ccc([O-])c(F)c2F)cc2ccccc21 ZINC001243343206 1057653944 /nfs/dbraw/zinc/65/39/44/1057653944.db2.gz SOGXXQDMQLVFMT-UHFFFAOYSA-N -1 1 314.287 4.277 20 0 DIADMM COc1cc(-c2ccc([O-])c(F)c2F)ccc1-c1cnc(C)o1 ZINC001243345530 1057654537 /nfs/dbraw/zinc/65/45/37/1057654537.db2.gz UKUWGLVYJIJSPQ-UHFFFAOYSA-N -1 1 317.291 4.309 20 0 DIADMM CC(C)Oc1c(F)cc(-c2cc(F)cc(F)c2[O-])cc1F ZINC001243504098 1057696904 /nfs/dbraw/zinc/69/69/04/1057696904.db2.gz 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COc1cc(F)cc2ccc(-c3c([O-])cccc3Cl)nc21 ZINC001244038509 1057846107 /nfs/dbraw/zinc/84/61/07/1057846107.db2.gz VMCXQPWJDRCZLC-UHFFFAOYSA-N -1 1 303.720 4.409 20 0 DIADMM [O-]c1c(F)cc(-c2cccc(-c3cc[nH]c(=S)n3)c2)cc1F ZINC001244097763 1057868905 /nfs/dbraw/zinc/86/89/05/1057868905.db2.gz XRMCJOBZVJSTFG-UHFFFAOYSA-N -1 1 316.332 4.083 20 0 DIADMM CC(C)(C)C(=O)Nc1cc(F)ccc1-c1cc(F)c([O-])c(F)c1 ZINC001244097639 1057869015 /nfs/dbraw/zinc/86/90/15/1057869015.db2.gz RQUDHEPQSBMDBR-UHFFFAOYSA-N -1 1 323.314 4.461 20 0 DIADMM Cc1ccc(Oc2nc(-c3cc(C)ccc3[O-])ncc2F)cc1 ZINC001244402807 1057951184 /nfs/dbraw/zinc/95/11/84/1057951184.db2.gz JFEGSSSNICFNME-UHFFFAOYSA-N -1 1 310.328 4.397 20 0 DIADMM Cc1ccc([O-])c(-c2ncc(F)c(Oc3cccc(F)c3)n2)c1 ZINC001244402730 1057951424 /nfs/dbraw/zinc/95/14/24/1057951424.db2.gz HCKSIAFBLMIGQU-UHFFFAOYSA-N -1 1 314.291 4.228 20 0 DIADMM COC(=O)c1nc2cc(-c3ccc(C)c(OC(C)C)c3)ccc2[n-]1 ZINC001244442988 1057959640 /nfs/dbraw/zinc/95/96/40/1057959640.db2.gz 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/nfs/dbraw/zinc/98/85/21/1057988521.db2.gz APQVOVWMYRQFPK-UHFFFAOYSA-N -1 1 306.818 4.022 20 0 DIADMM COc1ccc(C(F)(F)F)c(-c2c(Cl)ccc([O-])c2F)n1 ZINC001244537389 1057988900 /nfs/dbraw/zinc/98/89/00/1057988900.db2.gz DEOQUANWZLSPCB-UHFFFAOYSA-N -1 1 321.657 4.274 20 0 DIADMM COc1ccc2nc(-c3c(Cl)ccc([O-])c3F)ccc2c1 ZINC001244537401 1057989262 /nfs/dbraw/zinc/98/92/62/1057989262.db2.gz DMGVUMIYVUBUPZ-UHFFFAOYSA-N -1 1 303.720 4.409 20 0 DIADMM Cc1cc(-c2cc(C)c([O-])c(Cl)c2)nc(-c2ccccn2)n1 ZINC001244537052 1057989376 /nfs/dbraw/zinc/98/93/76/1057989376.db2.gz UAFCGINVGWCRHN-UHFFFAOYSA-N -1 1 311.772 4.181 20 0 DIADMM [O-]c1ccc(Cl)c(-c2cc(N3CCCCC3)ccn2)c1F ZINC001244538128 1057989513 /nfs/dbraw/zinc/98/95/13/1057989513.db2.gz IVITUYLIMWRBDM-UHFFFAOYSA-N -1 1 306.768 4.237 20 0 DIADMM [O-]c1ccc(Cl)c(-c2cc(OCC(F)(F)F)ccn2)c1F ZINC001244537988 1057989669 /nfs/dbraw/zinc/98/96/69/1057989669.db2.gz IIZHGEDWSORLCA-UHFFFAOYSA-N -1 1 321.657 4.188 20 0 DIADMM [O-]c1ccc(Cl)c(-c2cccc(Cc3ccncc3)n2)c1F ZINC001244540576 1057990554 /nfs/dbraw/zinc/99/05/54/1057990554.db2.gz ZOLWPYAUZKHJAZ-UHFFFAOYSA-N -1 1 314.747 4.233 20 0 DIADMM [O-]c1ccc(Cl)c(-c2ccnc(N3CCCCC3)c2)c1F ZINC001244540175 1057990614 /nfs/dbraw/zinc/99/06/14/1057990614.db2.gz RWLJHPROYSGFJI-UHFFFAOYSA-N -1 1 306.768 4.237 20 0 DIADMM COc1c(C)nc(C2CC2)nc1-c1cc(C)c([O-])c(Cl)c1 ZINC001244539350 1057990738 /nfs/dbraw/zinc/99/07/38/1057990738.db2.gz UORBORBCPAVFPL-UHFFFAOYSA-N -1 1 304.777 4.005 20 0 DIADMM [O-]c1ccc(Cl)c(-c2ncccc2C2CCOCC2)c1F ZINC001244540500 1057990748 /nfs/dbraw/zinc/99/07/48/1057990748.db2.gz XHETXHSCZUAGBS-UHFFFAOYSA-N -1 1 307.752 4.141 20 0 DIADMM [O-]c1ccc(Cl)c(-c2nccc3c4c([nH]c32)CCC4)c1F ZINC001244540123 1057990808 /nfs/dbraw/zinc/99/08/08/1057990808.db2.gz QJXWLLZWKHRDKK-UHFFFAOYSA-N -1 1 302.736 4.217 20 0 DIADMM [O-]c1ccc(Cl)c(-c2ncnc3[nH]c4ccccc4c32)c1F ZINC001244539458 1057990830 /nfs/dbraw/zinc/99/08/30/1057990830.db2.gz XAADWYXMSHXQTJ-UHFFFAOYSA-N -1 1 313.719 4.276 20 0 DIADMM COC(=O)c1cc2c(cccc2-c2c(Cl)ccc([O-])c2F)[nH]1 ZINC001244540933 1057991065 /nfs/dbraw/zinc/99/10/65/1057991065.db2.gz KAPRDUPTTRDULI-UHFFFAOYSA-N -1 1 319.719 4.120 20 0 DIADMM [O-]c1ccc(Cl)c(-c2ccc(-c3cccc(F)c3)nn2)c1F ZINC001244541129 1057991114 /nfs/dbraw/zinc/99/11/14/1057991114.db2.gz ZCBUTEUTVOIOGD-UHFFFAOYSA-N -1 1 318.710 4.448 20 0 DIADMM [O-]c1ccc(Cl)c(-c2cccc(-c3ccncc3)n2)c1F ZINC001244541584 1057991438 /nfs/dbraw/zinc/99/14/38/1057991438.db2.gz FJLPPPFXFBYVJK-UHFFFAOYSA-N -1 1 300.720 4.309 20 0 DIADMM COc1cccc2c1ccnc2-c1c(Cl)ccc([O-])c1F ZINC001244541049 1057991676 /nfs/dbraw/zinc/99/16/76/1057991676.db2.gz WLDRFCPTDHIYFD-UHFFFAOYSA-N -1 1 303.720 4.409 20 0 DIADMM [O-]c1ccc(Cl)c(-c2cncc(OC(F)(F)F)c2)c1F ZINC001244542524 1057991916 /nfs/dbraw/zinc/99/19/16/1057991916.db2.gz LZFXIXXLMFGNQK-UHFFFAOYSA-N -1 1 307.630 4.145 20 0 DIADMM CCc1cc(-c2cc(Cl)ccc2[O-])nc(-c2ccncc2)n1 ZINC001245049153 1058102478 /nfs/dbraw/zinc/10/24/78/1058102478.db2.gz HQOWWJVDNZBROT-UHFFFAOYSA-N -1 1 311.772 4.127 20 0 DIADMM COc1ccc(-c2nccc(-c3cc(Cl)ccc3[O-])n2)cc1 ZINC001245048867 1058102802 /nfs/dbraw/zinc/10/28/02/1058102802.db2.gz BHUUCONXSRSHOF-UHFFFAOYSA-N -1 1 312.756 4.178 20 0 DIADMM COC(=O)c1ccc2nc(-c3cc(Cl)ccc3[O-])ccc2c1 ZINC001245049972 1058102820 /nfs/dbraw/zinc/10/28/20/1058102820.db2.gz ZUYDPTJCUTUJQT-UHFFFAOYSA-N -1 1 313.740 4.047 20 0 DIADMM Cc1c(C(=O)[O-])cccc1-c1ccc2nc(C(F)(F)F)[nH]c2c1 ZINC001245301331 1058143123 /nfs/dbraw/zinc/14/31/23/1058143123.db2.gz RUQVLNCLYFFXRU-UHFFFAOYSA-N -1 1 320.270 4.255 20 0 DIADMM COC(=O)c1nc2cc(-c3ccc(Cl)c(C)c3C)ccc2[n-]1 ZINC001245687565 1058350664 /nfs/dbraw/zinc/35/06/64/1058350664.db2.gz JLPQEMGRLDPREF-UHFFFAOYSA-N -1 1 314.772 4.287 20 0 DIADMM COC(=O)c1nc2ccc(-c3ccc(Cl)c(C)c3C)cc2[n-]1 ZINC001245687565 1058350680 /nfs/dbraw/zinc/35/06/80/1058350680.db2.gz JLPQEMGRLDPREF-UHFFFAOYSA-N -1 1 314.772 4.287 20 0 DIADMM O=C(Nc1cc([O-])c(F)cc1F)[C@H]1CC[C@@H](c2ccccc2)C1 ZINC001552982777 1058459980 /nfs/dbraw/zinc/45/99/80/1058459980.db2.gz VXIOYSWTKXIRMX-OLZOCXBDSA-N -1 1 317.335 4.193 20 0 DIADMM COc1ccc2ccc(-c3c(F)ccc([O-])c3Cl)nc2c1 ZINC001245829718 1058525160 /nfs/dbraw/zinc/52/51/60/1058525160.db2.gz AEHYVBPPOJSUBH-UHFFFAOYSA-N -1 1 303.720 4.409 20 0 DIADMM COc1ccc(C(F)(F)F)c(-c2c(F)ccc([O-])c2Cl)n1 ZINC001245828722 1058525502 /nfs/dbraw/zinc/52/55/02/1058525502.db2.gz ZYQYHWPULIQSPB-UHFFFAOYSA-N -1 1 321.657 4.274 20 0 DIADMM Cc1cc(-c2c(F)ccc([O-])c2Cl)nc(-c2ccncc2)n1 ZINC001245829680 1058525650 /nfs/dbraw/zinc/52/56/50/1058525650.db2.gz DUTURPQVAWIHKK-UHFFFAOYSA-N -1 1 315.735 4.012 20 0 DIADMM [O-]c1ccc(F)c(-c2cc(-c3ccccc3)ncn2)c1Cl ZINC001245830459 1058527711 /nfs/dbraw/zinc/52/77/11/1058527711.db2.gz NYPBTDGLQXYPKC-UHFFFAOYSA-N -1 1 300.720 4.309 20 0 DIADMM [O-]c1ccc(F)c(-c2cnc(-c3ccccc3)cn2)c1Cl ZINC001245830601 1058528504 /nfs/dbraw/zinc/52/85/04/1058528504.db2.gz PTHDTWOZVNCMPP-UHFFFAOYSA-N -1 1 300.720 4.309 20 0 DIADMM COC(=O)[C@H](C)c1ccc(-c2c(F)ccc([O-])c2Cl)cc1 ZINC001245832639 1058531359 /nfs/dbraw/zinc/53/13/59/1058531359.db2.gz RAWNRNHRFGVOBN-SECBINFHSA-N -1 1 308.736 4.128 20 0 DIADMM COc1ccc2c(c1)nccc2-c1c(F)ccc([O-])c1Cl ZINC001245832583 1058532430 /nfs/dbraw/zinc/53/24/30/1058532430.db2.gz QGNSPGHOLIJRLV-UHFFFAOYSA-N -1 1 303.720 4.409 20 0 DIADMM COC(=O)c1ccc(-c2c(F)ccc([O-])c2Cl)c2cc[nH]c21 ZINC001245832650 1058534125 /nfs/dbraw/zinc/53/41/25/1058534125.db2.gz REYDTRAXWPPGOI-UHFFFAOYSA-N -1 1 319.719 4.120 20 0 DIADMM CCOC(=O)c1c(F)cccc1-c1c(F)ccc([O-])c1Cl ZINC001245832222 1058534192 /nfs/dbraw/zinc/53/41/92/1058534192.db2.gz OBMGGUOMNBFTAA-UHFFFAOYSA-N -1 1 312.699 4.168 20 0 DIADMM Cc1nnc(-c2ccc(-c3c(F)ccc([O-])c3Cl)cc2)o1 ZINC001245832337 1058534694 /nfs/dbraw/zinc/53/46/94/1058534694.db2.gz VDLYMUCNEYUJCO-UHFFFAOYSA-N -1 1 304.708 4.210 20 0 DIADMM COc1cc(-n2ccnc2)ccc1-c1c(F)ccc([O-])c1Cl ZINC001245834084 1058535445 /nfs/dbraw/zinc/53/54/45/1058535445.db2.gz CEJTVANONLRMIR-UHFFFAOYSA-N -1 1 318.735 4.046 20 0 DIADMM [O-]c1ccc(F)c(-c2cc(OC(F)(F)F)ccn2)c1Cl ZINC001245833250 1058536168 /nfs/dbraw/zinc/53/61/68/1058536168.db2.gz WOVGQHGQHSPCDX-UHFFFAOYSA-N -1 1 307.630 4.145 20 0 DIADMM CCOC(=O)c1cccc(F)c1-c1c(F)ccc([O-])c1Cl ZINC001245835060 1058540565 /nfs/dbraw/zinc/54/05/65/1058540565.db2.gz NWMFEBRCGNDUEO-UHFFFAOYSA-N -1 1 312.699 4.168 20 0 DIADMM Cc1nc(C(=O)OC(C)C)ccc1-c1c(F)ccc([O-])c1Cl ZINC001245835035 1058540773 /nfs/dbraw/zinc/54/07/73/1058540773.db2.gz MQFVOLDEZGNNHG-UHFFFAOYSA-N -1 1 323.751 4.120 20 0 DIADMM O=C(NC1CC(c2ccccc2)C1)c1ccc2ccccc2c1[O-] ZINC001556359407 1058582758 /nfs/dbraw/zinc/58/27/58/1058582758.db2.gz SBMBYJQHAZOYQL-UHFFFAOYSA-N -1 1 317.388 4.221 20 0 DIADMM CC(C)[C@H](C(=O)Nc1ccc([O-])c(F)c1F)c1ccc(F)cc1 ZINC001556591926 1058617635 /nfs/dbraw/zinc/61/76/35/1058617635.db2.gz QAUICNMQTKTNKL-AWEZNQCLSA-N -1 1 323.314 4.188 20 0 DIADMM CCC1(NC(=O)c2ccc(C(F)(F)F)cc2[O-])CCCCC1 ZINC001556689449 1058628344 /nfs/dbraw/zinc/62/83/44/1058628344.db2.gz SWMUQWFKZOJMGV-UHFFFAOYSA-N -1 1 315.335 4.254 20 0 DIADMM O=C(Nc1cc([O-])c(F)cc1F)c1cccc(-c2ccoc2)c1 ZINC001556919678 1058669827 /nfs/dbraw/zinc/66/98/27/1058669827.db2.gz LFRQSOQPEKWDGP-UHFFFAOYSA-N -1 1 315.275 4.183 20 0 DIADMM CN(C(=O)c1ccc(Cl)cc1[O-])[C@H]1CCC[C@@H]1C(C)(C)C ZINC001557080327 1058694902 /nfs/dbraw/zinc/69/49/02/1058694902.db2.gz AVHZLTLEEAIUMD-KBPBESRZSA-N -1 1 309.837 4.332 20 0 DIADMM C[C@H]1CCc2sc(C(=O)Nc3cc(F)cc(F)c3[O-])cc2C1 ZINC001557086452 1058698591 /nfs/dbraw/zinc/69/85/91/1058698591.db2.gz RPDHHAPLCFBPSU-QMMMGPOBSA-N -1 1 323.364 4.109 20 0 DIADMM CCCCc1ccc(C(=O)Nc2cc(F)cc(F)c2[O-])cc1 ZINC001557086344 1058698695 /nfs/dbraw/zinc/69/86/95/1058698695.db2.gz OQEKABQQKJFOMI-UHFFFAOYSA-N -1 1 305.324 4.265 20 0 DIADMM CC(C)(CNC(=O)c1ccc2ccccc2c1[O-])c1ccccc1 ZINC001557406542 1058743856 /nfs/dbraw/zinc/74/38/56/1058743856.db2.gz UMRFUZCHJFLHGX-UHFFFAOYSA-N -1 1 319.404 4.253 20 0 DIADMM O=C(Nc1c([O-])cccc1F)c1cc2ccnc(Cl)c2s1 ZINC001557408871 1058746757 /nfs/dbraw/zinc/74/67/57/1058746757.db2.gz AHCBOFXWSKCELI-UHFFFAOYSA-N -1 1 322.748 4.047 20 0 DIADMM O=C(Nc1cccc2c1ccn2C(F)F)c1ccc([O-])c(F)c1 ZINC001557448317 1058751555 /nfs/dbraw/zinc/75/15/55/1058751555.db2.gz GCMXBJNRDBHNOL-UHFFFAOYSA-N -1 1 320.270 4.133 20 0 DIADMM CCCC[C@H](CC)CCCN(C)C(=O)C(=O)c1ccc([O-])cc1 ZINC001557560323 1058769270 /nfs/dbraw/zinc/76/92/70/1058769270.db2.gz FLONXAGVLJWEON-HNNXBMFYSA-N -1 1 319.445 4.030 20 0 DIADMM C[C@]1(C(=O)Nc2cc(Cl)c([O-])c3ccccc23)C=CCC1 ZINC001557589690 1058772469 /nfs/dbraw/zinc/77/24/69/1058772469.db2.gz SILSLCCPEVZMCW-KRWDZBQOSA-N -1 1 301.773 4.494 20 0 DIADMM CC1(C)CN(C(=O)c2ccc([O-])c(F)c2)c2ccc(Cl)cc21 ZINC001557873465 1058803505 /nfs/dbraw/zinc/80/35/05/1058803505.db2.gz OXLLRWORAUHZFY-UHFFFAOYSA-N -1 1 319.763 4.123 20 0 DIADMM C[C@@H](CCCc1ccccc1)C(=O)Nc1cccc(F)c1[O-] ZINC001557955506 1058819074 /nfs/dbraw/zinc/81/90/74/1058819074.db2.gz BTQSGOBMAZGQEW-ZDUSSCGKSA-N -1 1 301.361 4.129 20 0 DIADMM COc1ccc2cc(C(=O)Nc3cccc(F)c3[O-])sc2c1 ZINC001557956942 1058819585 /nfs/dbraw/zinc/81/95/85/1058819585.db2.gz ORNCXSDQJRUSJL-UHFFFAOYSA-N -1 1 317.341 4.007 20 0 DIADMM C[C@@H](CC1CCCCC1)C(=O)NCc1ccc([O-])c(Cl)c1 ZINC001558208966 1058850187 /nfs/dbraw/zinc/85/01/87/1058850187.db2.gz KFROKFAVXFDVRY-LBPRGKRZSA-N -1 1 309.837 4.268 20 0 DIADMM O=C(Nc1cc(F)c([O-])cc1Cl)c1sccc1C1CC1 ZINC001558643793 1058896286 /nfs/dbraw/zinc/89/62/86/1058896286.db2.gz HRJBKJHUSFFSBU-UHFFFAOYSA-N -1 1 311.765 4.376 20 0 DIADMM CC[C@H](C(=O)Nc1cc(F)c([O-])cc1Cl)c1ccccc1 ZINC001558643731 1058896659 /nfs/dbraw/zinc/89/66/59/1058896659.db2.gz FHGDMVCIHBARSO-NSHDSACASA-N -1 1 307.752 4.317 20 0 DIADMM CC(C)(C)c1cc(C(=O)Nc2ccc(F)cc2[O-])cc(Cl)n1 ZINC001558955627 1058926642 /nfs/dbraw/zinc/92/66/42/1058926642.db2.gz AZZJLCGWBLPRSF-UHFFFAOYSA-N -1 1 322.767 4.130 20 0 DIADMM CCCc1ccc(CSc2nc(C(F)F)cc(=O)[n-]2)cc1 ZINC001559421729 1059220448 /nfs/dbraw/zinc/22/04/48/1059220448.db2.gz VZKQFWNGUYYEJO-UHFFFAOYSA-N -1 1 310.369 4.365 20 0 DIADMM CCc1ccc(NC(=S)Nc2cc(F)cc(F)c2[O-])cc1 ZINC001247341119 1059384796 /nfs/dbraw/zinc/38/47/96/1059384796.db2.gz LZSKUJPNUSGNEP-UHFFFAOYSA-N -1 1 308.353 4.042 20 0 DIADMM CCc1ccc(NC(=S)Nc2ccc([O-])c(F)c2F)cc1 ZINC001247334250 1059385353 /nfs/dbraw/zinc/38/53/53/1059385353.db2.gz UWOMWVFONKCEBK-UHFFFAOYSA-N -1 1 308.353 4.042 20 0 DIADMM CC[C@@H](C)[C@H]([N-]C(=O)C(F)(F)c1ccc(C)cc1)C(F)(F)F ZINC001524463314 1059526711 /nfs/dbraw/zinc/52/67/11/1059526711.db2.gz FEUALILSRPKDGF-PWSUYJOCSA-N -1 1 323.305 4.180 20 0 DIADMM [O-]c1ccc(Cc2nc(-c3ccc(Cl)cc3)no2)cc1Cl ZINC001247588251 1059567392 /nfs/dbraw/zinc/56/73/92/1059567392.db2.gz SXHFXDUOPVFITP-UHFFFAOYSA-N -1 1 321.163 4.340 20 0 DIADMM Cc1ccc(F)cc1-c1noc(Cc2ccc([O-])c(Cl)c2)n1 ZINC001247588566 1059567639 /nfs/dbraw/zinc/56/76/39/1059567639.db2.gz ZNWFYYKMYDUWEF-UHFFFAOYSA-N -1 1 318.735 4.134 20 0 DIADMM C[C@H](NC(=S)Nc1cccc([O-])c1Cl)c1ccc(F)cc1 ZINC001249607139 1060313494 /nfs/dbraw/zinc/31/34/94/1060313494.db2.gz NEYHQEMJLWKYGK-VIFPVBQESA-N -1 1 324.808 4.232 20 0 DIADMM [O-]c1c(F)c(F)ccc1Nc1cccc(Br)c1F ZINC001249690288 1060352607 /nfs/dbraw/zinc/35/26/07/1060352607.db2.gz OSOMJQSTHFKZHY-UHFFFAOYSA-N -1 1 318.092 4.316 20 0 DIADMM CN1Cc2c(cccc2Nc2c(Cl)ccc([O-])c2Cl)C1=O ZINC001249945532 1060496314 /nfs/dbraw/zinc/49/63/14/1060496314.db2.gz YRGHGWKXJDSGEX-UHFFFAOYSA-N -1 1 323.179 4.028 20 0 DIADMM Cc1ccc2nc(Nc3cc([O-])c(F)c(F)c3F)sc2c1 ZINC001249958497 1060503010 /nfs/dbraw/zinc/50/30/10/1060503010.db2.gz ONUZZXOYNJOPAX-UHFFFAOYSA-N -1 1 310.300 4.471 20 0 DIADMM Cc1cc(Nc2cc([O-])c(F)c(F)c2F)nc2ccccc12 ZINC001249958498 1060503709 /nfs/dbraw/zinc/50/37/09/1060503709.db2.gz ONXIGMDDZYTYHY-UHFFFAOYSA-N -1 1 304.271 4.410 20 0 DIADMM Cc1ccc2cccnc2c1Nc1cc([O-])c(F)c(F)c1F ZINC001249962894 1060506654 /nfs/dbraw/zinc/50/66/54/1060506654.db2.gz PCPSFJKJKKWMLS-UHFFFAOYSA-N -1 1 304.271 4.410 20 0 DIADMM [O-]c1cc(Nc2ccc(OCC3CC3)cc2)c(F)c(F)c1F ZINC001249964949 1060506982 /nfs/dbraw/zinc/50/69/82/1060506982.db2.gz PHBWMYHWVAMLGM-UHFFFAOYSA-N -1 1 309.287 4.342 20 0 DIADMM [O-]c1cc(Nc2cc3ccccc3cc2O)c(F)c(F)c1F ZINC001249962856 1060507070 /nfs/dbraw/zinc/50/70/70/1060507070.db2.gz HFAXQCOZDTXOSL-UHFFFAOYSA-N -1 1 305.255 4.412 20 0 DIADMM Nc1cc(Cl)cc(Cl)c1Nc1cc([O-])c(F)c(F)c1F ZINC001249964417 1060510736 /nfs/dbraw/zinc/51/07/36/1060510736.db2.gz DFAMMQPHELLXJR-UHFFFAOYSA-N -1 1 323.101 4.442 20 0 DIADMM [O-]c1cc(Nc2cccc3cncc(F)c32)c(F)c(F)c1F ZINC001249965869 1060511752 /nfs/dbraw/zinc/51/17/52/1060511752.db2.gz PQDVLIGBNODUQB-UHFFFAOYSA-N -1 1 308.234 4.240 20 0 DIADMM [O-]c1cc(Nc2ccccc2OCC2CC2)c(F)c(F)c1F ZINC001249967617 1060512735 /nfs/dbraw/zinc/51/27/35/1060512735.db2.gz WGLAHLKJHMVNQM-UHFFFAOYSA-N -1 1 309.287 4.342 20 0 DIADMM CC(C)Oc1ccc(F)cc1Nc1cc([O-])c(F)c(F)c1F ZINC001249965864 1060513236 /nfs/dbraw/zinc/51/32/36/1060513236.db2.gz PLOSNLXCZAPBGV-UHFFFAOYSA-N -1 1 315.266 4.479 20 0 DIADMM [O-]c1cc(F)c(Nc2cc(Cl)nnc2Cl)cc1Cl ZINC001250020237 1060542521 /nfs/dbraw/zinc/54/25/21/1060542521.db2.gz GPJPYIHWZOBNTJ-UHFFFAOYSA-N -1 1 308.527 4.025 20 0 DIADMM [O-]c1cc(F)c(Nc2cc(F)nc(F)c2Cl)cc1Cl ZINC001250019726 1060542476 /nfs/dbraw/zinc/54/24/76/1060542476.db2.gz BVFHPEMNGWPHAF-UHFFFAOYSA-N -1 1 309.074 4.255 20 0 DIADMM CC(C)(C)c1nnc(Nc2cc(Cl)c([O-])cc2F)s1 ZINC001250019050 1060543720 /nfs/dbraw/zinc/54/37/20/1060543720.db2.gz XEIVWEQRPDWHIQ-UHFFFAOYSA-N -1 1 301.774 4.077 20 0 DIADMM COC(=O)c1c(C)csc1Nc1cc(Cl)c([O-])cc1F ZINC001250020443 1060544782 /nfs/dbraw/zinc/54/47/82/1060544782.db2.gz VPUVRKHYLAFHDW-UHFFFAOYSA-N -1 1 315.753 4.085 20 0 DIADMM CNc1ccnc(Cl)c1Nc1cc(Cl)c([O-])cc1F ZINC001250020263 1060544992 /nfs/dbraw/zinc/54/49/92/1060544992.db2.gz HXGBISWJUZMSJT-UHFFFAOYSA-N -1 1 302.136 4.018 20 0 DIADMM [O-]c1cc(F)c(Nc2ncccc2OC(F)(F)F)cc1Cl ZINC001250020676 1060545264 /nfs/dbraw/zinc/54/52/64/1060545264.db2.gz ZAVVPLAJSXVCTO-UHFFFAOYSA-N -1 1 322.645 4.222 20 0 DIADMM [O-]c1cc(F)c(Nc2cc(F)c(F)c(F)c2F)cc1Cl ZINC001250022695 1060546026 /nfs/dbraw/zinc/54/60/26/1060546026.db2.gz SWUHLSBUWSIOBQ-UHFFFAOYSA-N -1 1 309.621 4.485 20 0 DIADMM C[C@H]1CCc2cc(N)ccc2N1c1cc(Cl)c([O-])cc1F ZINC001250022289 1060548083 /nfs/dbraw/zinc/54/80/83/1060548083.db2.gz HNYULXUAAVVOIZ-VIFPVBQESA-N -1 1 306.768 4.240 20 0 DIADMM CC(=O)c1oc2cccnc2c1Nc1cc(Cl)c([O-])cc1F ZINC001250023125 1060548841 /nfs/dbraw/zinc/54/88/41/1060548841.db2.gz DKKXVXPBUCTREB-UHFFFAOYSA-N -1 1 320.707 4.272 20 0 DIADMM COc1ccc2cc(Nc3cc(Cl)c([O-])cc3F)ccc2n1 ZINC001250023819 1060550764 /nfs/dbraw/zinc/55/07/64/1060550764.db2.gz CDGYVYPBAUPCNS-UHFFFAOYSA-N -1 1 318.735 4.485 20 0 DIADMM COc1cc2cccnc2c(Nc2cc(Cl)c([O-])cc2F)c1 ZINC001250024145 1060550803 /nfs/dbraw/zinc/55/08/03/1060550803.db2.gz TVVVIAQFMPEBSY-UHFFFAOYSA-N -1 1 318.735 4.485 20 0 DIADMM COc1cc(F)c(F)cc1Nc1cc(Cl)c([O-])cc1F ZINC001250023922 1060551329 /nfs/dbraw/zinc/55/13/29/1060551329.db2.gz IHVZJUUGACXJFC-UHFFFAOYSA-N -1 1 303.667 4.215 20 0 DIADMM COc1ccc2c(c1Nc1cc(Cl)c([O-])cc1F)C(=O)CC2 ZINC001250025904 1060552551 /nfs/dbraw/zinc/55/25/51/1060552551.db2.gz HXFJQCVXSRHHPY-UHFFFAOYSA-N -1 1 321.735 4.066 20 0 DIADMM [O-]c1cc(F)c(Nc2cc(Cl)cc(CO)c2)cc1Cl ZINC001250027308 1060553809 /nfs/dbraw/zinc/55/38/09/1060553809.db2.gz WIYGVICXXVSPBO-UHFFFAOYSA-N -1 1 302.132 4.074 20 0 DIADMM CCOC(=O)Nc1ccc(Nc2cc(Cl)c([O-])cc2F)cc1 ZINC001250026399 1060554169 /nfs/dbraw/zinc/55/41/69/1060554169.db2.gz LYAJVAIWZLALHT-UHFFFAOYSA-N -1 1 324.739 4.497 20 0 DIADMM COc1cnc2c(cccc2Nc2cc(Cl)c([O-])cc2F)c1 ZINC001250027150 1060555270 /nfs/dbraw/zinc/55/52/70/1060555270.db2.gz YBBSBPZZKVSBIL-UHFFFAOYSA-N -1 1 318.735 4.485 20 0 DIADMM CCOc1cc(F)c([N-]c2noc(C(C)(C)C)n2)cc1Cl ZINC001250063891 1060577705 /nfs/dbraw/zinc/57/77/05/1060577705.db2.gz ZWCDGHCWVUVURM-UHFFFAOYSA-N -1 1 313.760 4.302 20 0 DIADMM [O-]c1cccc(CN(Cc2ccc(F)cc2F)C2CC2)c1Cl ZINC001560729971 1060598299 /nfs/dbraw/zinc/59/82/99/1060598299.db2.gz YSZNJDKFAUXJQF-UHFFFAOYSA-N -1 1 323.770 4.488 20 0 DIADMM Cn1nc(-c2ccccc2)cc1Nc1c(F)ccc([O-])c1Cl ZINC001250228004 1060704736 /nfs/dbraw/zinc/70/47/36/1060704736.db2.gz GXEXXGXALRVCDU-UHFFFAOYSA-N -1 1 317.751 4.329 20 0 DIADMM [O-]c1ccc(F)c(Nc2ncccc2Br)c1Cl ZINC001250228316 1060708202 /nfs/dbraw/zinc/70/82/02/1060708202.db2.gz WFIPDMQKVNMFPF-UHFFFAOYSA-N -1 1 317.545 4.086 20 0 DIADMM [O-]c1ccc(F)c(Nc2ccc(N3CCCCC3)nc2)c1Cl ZINC001250229051 1060708282 /nfs/dbraw/zinc/70/82/82/1060708282.db2.gz SZKAPTGDZOBDQG-UHFFFAOYSA-N -1 1 321.783 4.314 20 0 DIADMM [O-]c1ccc(F)c(Nc2ncc(Cl)nc2Cl)c1Cl ZINC001250228248 1060708605 /nfs/dbraw/zinc/70/86/05/1060708605.db2.gz SLEBSIYRICZFPY-UHFFFAOYSA-N -1 1 308.527 4.025 20 0 DIADMM Cc1ccc(-n2nccc2Nc2c(F)ccc([O-])c2Cl)cc1 ZINC001250229414 1060709438 /nfs/dbraw/zinc/70/94/38/1060709438.db2.gz GIHHRBKXKPFYLB-UHFFFAOYSA-N -1 1 317.751 4.422 20 0 DIADMM COc1ccc(F)c(F)c1Nc1c(F)ccc([O-])c1Cl ZINC001250232271 1060710628 /nfs/dbraw/zinc/71/06/28/1060710628.db2.gz HKYBYXNQZZJPPH-UHFFFAOYSA-N -1 1 303.667 4.215 20 0 DIADMM Cc1c2ccc(Nc3c(F)ccc([O-])c3Cl)cc2nn1C ZINC001250232789 1060710785 /nfs/dbraw/zinc/71/07/85/1060710785.db2.gz DTARWMUDYNYCII-UHFFFAOYSA-N -1 1 305.740 4.123 20 0 DIADMM [O-]c1ccc(F)c(Nc2cccc(Cl)c2CO)c1Cl ZINC001250232167 1060711275 /nfs/dbraw/zinc/71/12/75/1060711275.db2.gz BXPFELBKCPSTON-UHFFFAOYSA-N -1 1 302.132 4.074 20 0 DIADMM [O-]c1ccc(F)c(Nc2ccnn2-c2cccc(F)c2)c1Cl ZINC001250230410 1060712027 /nfs/dbraw/zinc/71/20/27/1060712027.db2.gz XIPKMOYNHRIWLH-UHFFFAOYSA-N -1 1 321.714 4.253 20 0 DIADMM CC(C)OC(=O)c1ccc(Nc2c(F)ccc([O-])c2Cl)cc1 ZINC001250233226 1060712991 /nfs/dbraw/zinc/71/29/91/1060712991.db2.gz LFONRNSUUYFQFG-UHFFFAOYSA-N -1 1 323.751 4.494 20 0 DIADMM CC(C)c1c(Cl)ncnc1Nc1c(F)ccc([O-])c1Cl ZINC001250233995 1060714103 /nfs/dbraw/zinc/71/41/03/1060714103.db2.gz IXMIWZLNUGBRNN-UHFFFAOYSA-N -1 1 316.163 4.495 20 0 DIADMM Cn1cc(-c2ccc(Nc3c(F)ccc([O-])c3Cl)cc2)cn1 ZINC001250234601 1060714731 /nfs/dbraw/zinc/71/47/31/1060714731.db2.gz SUSFNGGGTPZPHB-UHFFFAOYSA-N -1 1 317.751 4.329 20 0 DIADMM CCn1ncc2cc(Nc3c(F)ccc([O-])c3Cl)ccc21 ZINC001250236733 1060716267 /nfs/dbraw/zinc/71/62/67/1060716267.db2.gz UOEKYGFMSAGRNC-UHFFFAOYSA-N -1 1 305.740 4.298 20 0 DIADMM [O-]c1ccc(F)c(Nc2cccnc2-c2ccccn2)c1Cl ZINC001250234841 1060717105 /nfs/dbraw/zinc/71/71/05/1060717105.db2.gz ZNOXVJYBBZQGKD-UHFFFAOYSA-N -1 1 315.735 4.385 20 0 DIADMM Cc1cc(=O)c2ccc(Nc3c(F)ccc([O-])c3Cl)cc2o1 ZINC001250236301 1060717159 /nfs/dbraw/zinc/71/71/59/1060717159.db2.gz NIVPXYFZUMYDKJ-UHFFFAOYSA-N -1 1 319.719 4.343 20 0 DIADMM O=C(Cc1cccc(Cl)c1[O-])c1ccc(C(F)(F)F)cc1 ZINC001250237576 1060719826 /nfs/dbraw/zinc/71/98/26/1060719826.db2.gz GRCAVUMKFKCEKX-UHFFFAOYSA-N -1 1 314.690 4.490 20 0 DIADMM Cc1nsc([N-]c2cc(F)cc(C(F)(F)F)c2Cl)n1 ZINC001250239739 1060723382 /nfs/dbraw/zinc/72/33/82/1060723382.db2.gz BWVVLSIJADDJTQ-UHFFFAOYSA-N -1 1 311.691 4.401 20 0 DIADMM COc1cc(Nc2cc(F)c([O-])cc2F)c(F)c(F)c1Cl ZINC001250265356 1060740376 /nfs/dbraw/zinc/74/03/76/1060740376.db2.gz FSBSEBSDKHOAFQ-UHFFFAOYSA-N -1 1 321.657 4.354 20 0 DIADMM C[C@H](CC1CCCCC1)[N-]S(=O)(=O)c1sccc1Cl ZINC001561519568 1060937245 /nfs/dbraw/zinc/93/72/45/1060937245.db2.gz WXGQNWCANZXMMA-SNVBAGLBSA-N -1 1 321.895 4.039 20 0 DIADMM C=Cc1ccc([N-]S(=O)(=O)c2cccc3ccccc32)cc1 ZINC001250611224 1060938703 /nfs/dbraw/zinc/93/87/03/1060938703.db2.gz MDVFZHVJNZQYSE-UHFFFAOYSA-N -1 1 309.390 4.284 20 0 DIADMM CC(C)(C)n1c2cc(F)ccc2nc1-c1c([O-])cccc1F ZINC001250673792 1061007492 /nfs/dbraw/zinc/00/74/92/1061007492.db2.gz GKUVGIJLNUJKRO-UHFFFAOYSA-N -1 1 302.324 4.442 20 0 DIADMM [O-]c1cccc(F)c1-c1nc2cc(F)c(C(F)(F)F)cc2[nH]1 ZINC001250674346 1061007556 /nfs/dbraw/zinc/00/75/56/1061007556.db2.gz OXNPWHOYXOSHMX-UHFFFAOYSA-N -1 1 314.213 4.233 20 0 DIADMM Cc1c2nc(-c3cccc([O-])c3Br)[nH]c2ccc1F ZINC001250881011 1061106826 /nfs/dbraw/zinc/10/68/26/1061106826.db2.gz QHAHIZCQQCJKTN-UHFFFAOYSA-N -1 1 321.149 4.146 20 0 DIADMM CCCn1c(-c2ccc([O-])c(F)c2F)nc2ccc(F)c(F)c21 ZINC001250914470 1061124711 /nfs/dbraw/zinc/12/47/11/1061124711.db2.gz AZOUCKMSHZZMBQ-UHFFFAOYSA-N -1 1 324.277 4.375 20 0 DIADMM CCn1c2ccc(Cl)cc2nc1-c1ccc([O-])c(F)c1F ZINC001250914837 1061124786 /nfs/dbraw/zinc/12/47/86/1061124786.db2.gz HYWGKZXIQKRRLE-UHFFFAOYSA-N -1 1 308.715 4.360 20 0 DIADMM [O-]c1cc(F)c(F)cc1-c1nc2ccc(F)c(F)c2n1C1CC1 ZINC001250967424 1061152674 /nfs/dbraw/zinc/15/26/74/1061152674.db2.gz QOWIQEUNUBMMEW-UHFFFAOYSA-N -1 1 322.261 4.300 20 0 DIADMM Cc1cc2nc(-c3ccc(Cl)cc3C(=O)[O-])[nH]c2cc1F ZINC001250968474 1061153598 /nfs/dbraw/zinc/15/35/98/1061153598.db2.gz NOQCWBLHGQTFMP-UHFFFAOYSA-N -1 1 304.708 4.029 20 0 DIADMM Cc1c2[nH]c(-c3ccc(Cl)cc3C(=O)[O-])nc2ccc1F ZINC001250968030 1061153808 /nfs/dbraw/zinc/15/38/08/1061153808.db2.gz IHJKSNFREGBOMJ-UHFFFAOYSA-N -1 1 304.708 4.029 20 0 DIADMM [O-]c1cc(F)c(-c2nc3cc(C(F)(F)F)ccc3[nH]2)c(F)c1 ZINC001251008024 1061178377 /nfs/dbraw/zinc/17/83/77/1061178377.db2.gz YNKYEKBQQDLPAR-UHFFFAOYSA-N -1 1 314.213 4.233 20 0 DIADMM [O-]c1cc(F)c(-c2nc3ccccc3n2CC2CC2)c(F)c1 ZINC001251007994 1061178759 /nfs/dbraw/zinc/17/87/59/1061178759.db2.gz XHESIEQCFCESRR-UHFFFAOYSA-N -1 1 300.308 4.097 20 0 DIADMM O=C([O-])c1ccsc1-c1nc2ccc(-c3ccncc3)cc2[nH]1 ZINC001251009693 1061181529 /nfs/dbraw/zinc/18/15/29/1061181529.db2.gz RIOZAGZOQQEQCR-UHFFFAOYSA-N -1 1 321.361 4.052 20 0 DIADMM O=C([O-])c1ccc(-c2nc3cc(Cl)cc(Cl)c3[nH]2)s1 ZINC001251014852 1061183303 /nfs/dbraw/zinc/18/33/03/1061183303.db2.gz KLQIYMHJRZKRGW-UHFFFAOYSA-N -1 1 313.165 4.296 20 0 DIADMM COc1cc2nc(-c3ccc(Cl)c([O-])c3)[nH]c2cc1Cl ZINC001251037397 1061193136 /nfs/dbraw/zinc/19/31/36/1061193136.db2.gz SMYCXMXEFJVYNE-UHFFFAOYSA-N -1 1 309.152 4.251 20 0 DIADMM COc1cc2[nH]c(-c3ccc(Cl)c([O-])c3)nc2cc1Cl ZINC001251037397 1061193160 /nfs/dbraw/zinc/19/31/60/1061193160.db2.gz SMYCXMXEFJVYNE-UHFFFAOYSA-N -1 1 309.152 4.251 20 0 DIADMM O=C(NCC[C@@H]1CCCC1(F)F)c1cc2ccccc2cc1[O-] ZINC001455214132 1061210102 /nfs/dbraw/zinc/21/01/02/1061210102.db2.gz OHRWDBDYCLQXMM-AWEZNQCLSA-N -1 1 319.351 4.101 20 0 DIADMM [O-]c1ccc(CN2CCC[C@@](F)(c3ccccc3)C2)c(F)c1F ZINC001462520028 1061229530 /nfs/dbraw/zinc/22/95/30/1061229530.db2.gz UBEAMDTVYIOZQV-SFHVURJKSA-N -1 1 321.342 4.131 20 0 DIADMM C[C@@H]1CCN(C(=O)c2ccc(Cl)cc2[O-])[C@@H]1c1ccccc1 ZINC001455647164 1061232320 /nfs/dbraw/zinc/23/23/20/1061232320.db2.gz FFFKWWSTYXSAJH-PXAZEXFGSA-N -1 1 315.800 4.269 20 0 DIADMM Cc1ccccc1-c1ccc([N-]S(=O)(=O)c2ccccc2)cc1 ZINC001251146175 1061249909 /nfs/dbraw/zinc/24/99/09/1061249909.db2.gz JFPSSMBQCCOIGI-UHFFFAOYSA-N -1 1 323.417 4.463 20 0 DIADMM Cc1cccc2nc(-c3cc(F)c([O-])c(Br)c3)[nH]c21 ZINC001251168301 1061257492 /nfs/dbraw/zinc/25/74/92/1061257492.db2.gz BZRZSAOZCJQUMZ-UHFFFAOYSA-N -1 1 321.149 4.146 20 0 DIADMM [O-]c1cc(-c2nc3ccc(C(F)(F)F)cc3[nH]2)cc(F)c1F ZINC001251240231 1061285831 /nfs/dbraw/zinc/28/58/31/1061285831.db2.gz YOQZKHONVOUBST-UHFFFAOYSA-N -1 1 314.213 4.233 20 0 DIADMM CC(C)(C)n1c2ccc(F)cc2nc1-c1cc(Cl)ncc1[O-] ZINC001251251509 1061290875 /nfs/dbraw/zinc/29/08/75/1061290875.db2.gz GTCDXOFYWAQYHZ-UHFFFAOYSA-N -1 1 319.767 4.351 20 0 DIADMM CCCn1c(-c2cc(Cl)ncc2[O-])nc2ccc(F)c(F)c21 ZINC001251252520 1061291955 /nfs/dbraw/zinc/29/19/55/1061291955.db2.gz YDWVKFAFXXYCPT-UHFFFAOYSA-N -1 1 323.730 4.146 20 0 DIADMM CC(C)Cn1c2ccccc2nc1-c1cc(Cl)ncc1[O-] ZINC001251251892 1061292000 /nfs/dbraw/zinc/29/20/00/1061292000.db2.gz LJXLLQKDNMJPJB-UHFFFAOYSA-N -1 1 301.777 4.113 20 0 DIADMM CCn1c2ccc(Cl)cc2nc1-c1c([O-])ccc(F)c1F ZINC001251322405 1061312654 /nfs/dbraw/zinc/31/26/54/1061312654.db2.gz SFLGYDXKBWAOCM-UHFFFAOYSA-N -1 1 308.715 4.360 20 0 DIADMM CC(C)n1c2ccc(F)cc2nc1-c1c(F)ccc([O-])c1F ZINC001251335381 1061319028 /nfs/dbraw/zinc/31/90/28/1061319028.db2.gz FNYOZPIMNUYLMW-UHFFFAOYSA-N -1 1 306.287 4.407 20 0 DIADMM CC(C)c1nc(C(=O)Nc2cc(F)c([O-])cc2Cl)cs1 ZINC001456601178 1061344446 /nfs/dbraw/zinc/34/44/46/1061344446.db2.gz DMOVYVJHXWGAST-UHFFFAOYSA-N -1 1 314.769 4.017 20 0 DIADMM O=C(C/C=C\Cc1ccccc1)Nc1cc(F)c([O-])cc1Cl ZINC001456610292 1061346568 /nfs/dbraw/zinc/34/65/68/1061346568.db2.gz ZHOMVKVQOCRQKD-PLNGDYQASA-N -1 1 319.763 4.312 20 0 DIADMM Cc1cc(Br)c([O-])c(-c2nc3c(cccc3C)[nH]2)c1 ZINC001251469878 1061369964 /nfs/dbraw/zinc/36/99/64/1061369964.db2.gz FMSXWPKIDSAEQZ-UHFFFAOYSA-N -1 1 317.186 4.315 20 0 DIADMM Cc1cc(Br)c([O-])c(-c2nc3ccccc3n2C)c1 ZINC001251470456 1061370081 /nfs/dbraw/zinc/37/00/81/1061370081.db2.gz UYEOUYQRYAMMCQ-UHFFFAOYSA-N -1 1 317.186 4.017 20 0 DIADMM CC(C)(C)n1c2ccc(F)cc2nc1-c1ccc(F)c([O-])c1 ZINC001251477671 1061375298 /nfs/dbraw/zinc/37/52/98/1061375298.db2.gz RFMKSWLCFQRQBK-UHFFFAOYSA-N -1 1 302.324 4.442 20 0 DIADMM COc1cccc2[nH]c(-c3cc(Cl)c(Cl)cc3[O-])nc21 ZINC001251491428 1061376974 /nfs/dbraw/zinc/37/69/74/1061376974.db2.gz VOERHSCAHCWDFL-UHFFFAOYSA-N -1 1 309.152 4.251 20 0 DIADMM CCn1c2ccc(C)cc2nc1-c1c([O-])cc(OC)cc1Cl ZINC001251491488 1061377575 /nfs/dbraw/zinc/37/75/75/1061377575.db2.gz YMDBVZMLGWKWBM-UHFFFAOYSA-N -1 1 316.788 4.399 20 0 DIADMM COc1ccc(-c2nc3cc(C)cc(C)c3[nH]2)c([O-])c1Cl ZINC001251491035 1061379909 /nfs/dbraw/zinc/37/99/09/1061379909.db2.gz FPLLDXAGNYILFP-UHFFFAOYSA-N -1 1 302.761 4.214 20 0 DIADMM COc1ccc2c(c1)nc(-c1c([O-])ccc(Cl)c1Cl)n2C ZINC001251531903 1061392316 /nfs/dbraw/zinc/39/23/16/1061392316.db2.gz NVHNWSZHMRRDRP-UHFFFAOYSA-N -1 1 323.179 4.261 20 0 DIADMM COc1cc2nc(-c3c([O-])ccc(F)c3Cl)[nH]c2cc1C ZINC001251540639 1061396339 /nfs/dbraw/zinc/39/63/39/1061396339.db2.gz KAFPRPCHQCKXTE-UHFFFAOYSA-N -1 1 306.724 4.045 20 0 DIADMM [O-]c1ccc(F)c(Cl)c1-c1nc2cc3c(cc2[nH]1)CCC3 ZINC001251540706 1061396528 /nfs/dbraw/zinc/39/65/28/1061396528.db2.gz NQJLSUXWWQWULD-UHFFFAOYSA-N -1 1 302.736 4.217 20 0 DIADMM Cn1c2cc(Cl)ccc2nc1-c1c([O-])ccc(F)c1Cl ZINC001251540594 1061398338 /nfs/dbraw/zinc/39/83/38/1061398338.db2.gz HVSDLARKAYILQA-UHFFFAOYSA-N -1 1 311.143 4.392 20 0 DIADMM [O-]c1ccc(F)c(Cl)c1-c1nc2c(cc(F)c(F)c2F)[nH]1 ZINC001251540907 1061399935 /nfs/dbraw/zinc/39/99/35/1061399935.db2.gz ZFCUJDVXDYNEBP-UHFFFAOYSA-N -1 1 316.641 4.145 20 0 DIADMM Cc1cc2nc(-c3cc(Cl)nc(Cl)c3[O-])[nH]c2c(C)c1 ZINC001251613327 1061417031 /nfs/dbraw/zinc/41/70/31/1061417031.db2.gz DGRGWCHVAWOOCE-UHFFFAOYSA-N -1 1 308.168 4.254 20 0 DIADMM [O-]c1c(Cl)nc(Cl)cc1-c1nc2ccc(Cl)cc2[nH]1 ZINC001251613984 1061419832 /nfs/dbraw/zinc/41/98/32/1061419832.db2.gz ULJAYFXXMDZICE-UHFFFAOYSA-N -1 1 314.559 4.291 20 0 DIADMM Cc1cc2nc(-c3ccc(C(=O)[O-])cc3C)[nH]c2cc1Cl ZINC001251710759 1061454103 /nfs/dbraw/zinc/45/41/03/1061454103.db2.gz OPQHZCSJHRGGOH-UHFFFAOYSA-N -1 1 300.745 4.198 20 0 DIADMM O=C([O-])c1cc(F)ccc1-c1nc2ccc(C(F)(F)F)cc2[nH]1 ZINC001251723993 1061459411 /nfs/dbraw/zinc/45/94/11/1061459411.db2.gz BCZKEAYVDXRDMI-UHFFFAOYSA-N -1 1 324.233 4.086 20 0 DIADMM Cc1cc(Cl)cc([N-]S(=O)(=O)c2ccc(Cl)cc2)c1 ZINC001251735667 1061460927 /nfs/dbraw/zinc/46/09/27/1061460927.db2.gz UBNRQFACUFCXLB-UHFFFAOYSA-N -1 1 316.209 4.103 20 0 DIADMM CC[C@@H](C)CN(CC)C(=O)c1c([O-])cnc2ccc(Cl)cc21 ZINC001457679244 1061483240 /nfs/dbraw/zinc/48/32/40/1061483240.db2.gz CRJCHVXGVJOEIK-LLVKDONJSA-N -1 1 320.820 4.102 20 0 DIADMM CC[C@@H](CC(=O)Nc1ccc(F)cc1[O-])c1ccc(C)cc1 ZINC001457712338 1061487797 /nfs/dbraw/zinc/48/77/97/1061487797.db2.gz AECHJRICCFPDLC-ZDUSSCGKSA-N -1 1 301.361 4.362 20 0 DIADMM CC(C)c1ccc([C@@H](NC(=O)c2cncc([O-])c2)C(C)C)cc1 ZINC001463886861 1061530361 /nfs/dbraw/zinc/53/03/61/1061530361.db2.gz FRQBOEWHKFZEDB-SFHVURJKSA-N -1 1 312.413 4.038 20 0 DIADMM COc1ccc(-c2nnc(-c3ccc4ccccc4c3[O-])o2)cc1 ZINC001251959819 1061542031 /nfs/dbraw/zinc/54/20/31/1061542031.db2.gz SOINSZBYDMHIIU-UHFFFAOYSA-N -1 1 318.332 4.271 20 0 DIADMM O=C(c1cccc([O-])c1F)N1CCC[C@H]1c1ccc(Cl)cc1 ZINC001464019881 1061545029 /nfs/dbraw/zinc/54/50/29/1061545029.db2.gz TXXJHPDRBIVXPE-AWEZNQCLSA-N -1 1 319.763 4.162 20 0 DIADMM CCOc1cc(C)ccc1NC(=O)c1ccc(C(C)C)cc1[O-] ZINC001464313030 1061576264 /nfs/dbraw/zinc/57/62/64/1061576264.db2.gz OLZWAMXMKALXKT-UHFFFAOYSA-N -1 1 313.397 4.475 20 0 DIADMM O=C(Cc1ccc([O-])c(Cl)c1)N(CC1CCCCC1)C1CC1 ZINC001464337028 1061579195 /nfs/dbraw/zinc/57/91/95/1061579195.db2.gz CMZUHGOLWDKQIG-UHFFFAOYSA-N -1 1 321.848 4.159 20 0 DIADMM CCOc1ccc(-c2nnc(-c3cccc([O-])c3Cl)o2)cc1 ZINC001252137889 1061594727 /nfs/dbraw/zinc/59/47/27/1061594727.db2.gz SATRXIGEWMUJIH-UHFFFAOYSA-N -1 1 316.744 4.161 20 0 DIADMM [O-]c1cc(C(F)(F)F)ccc1-c1nnc(-c2ccc(F)cc2)o1 ZINC001252163926 1061603825 /nfs/dbraw/zinc/60/38/25/1061603825.db2.gz UTTJVALNXISUJN-UHFFFAOYSA-N -1 1 324.233 4.267 20 0 DIADMM Cc1ccc(S(=O)(=O)[N-]c2ccc(F)c3ccccc23)cc1 ZINC001252197474 1061604990 /nfs/dbraw/zinc/60/49/90/1061604990.db2.gz CPNFPJDJEUDTLV-UHFFFAOYSA-N -1 1 315.369 4.088 20 0 DIADMM CO[C@@H](C)c1cccc(NC(=O)c2cc(SC)ccc2[O-])c1 ZINC001464709258 1061626577 /nfs/dbraw/zinc/62/65/77/1061626577.db2.gz VIFUVOXQGZJYLF-NSHDSACASA-N -1 1 317.410 4.074 20 0 DIADMM [O-]c1cccnc1-c1nnc(-c2ccc(-c3ccccc3)cc2)o1 ZINC001252521090 1061655294 /nfs/dbraw/zinc/65/52/94/1061655294.db2.gz AAYLOHNOUGAGSW-UHFFFAOYSA-N -1 1 315.332 4.171 20 0 DIADMM CCCNc1ccc(Cl)cc1NC(=O)c1cc(F)ccc1[O-] ZINC001466059665 1061868495 /nfs/dbraw/zinc/86/84/95/1061868495.db2.gz UZARNOLGGRPZAM-UHFFFAOYSA-N -1 1 322.767 4.259 20 0 DIADMM C[C@@H]1CCN(Cc2ccc([O-])c(F)c2F)[C@H](c2ccco2)C1 ZINC001474319930 1061894788 /nfs/dbraw/zinc/89/47/88/1061894788.db2.gz SYLFNOKOVDBUES-YPMHNXCESA-N -1 1 307.340 4.237 20 0 DIADMM CC1(c2ccccc2C(=O)Nc2ccc([O-])c(Cl)c2)CC1 ZINC001466225517 1061900553 /nfs/dbraw/zinc/90/05/53/1061900553.db2.gz INDBZPHXERGCTN-UHFFFAOYSA-N -1 1 301.773 4.349 20 0 DIADMM O=C(CC[C@H]1CCc2ccccc21)Nc1ccc([O-])c(Cl)c1 ZINC001466225528 1061901311 /nfs/dbraw/zinc/90/13/11/1061901311.db2.gz IYQCRBADABIJIK-CYBMUJFWSA-N -1 1 315.800 4.494 20 0 DIADMM Cc1cccc(-c2nnc(-c3c(O)cc4ccccc4c3[O-])o2)c1 ZINC001253627738 1061940494 /nfs/dbraw/zinc/94/04/94/1061940494.db2.gz GVODPQAGFCPMKS-UHFFFAOYSA-N -1 1 318.332 4.276 20 0 DIADMM O=C(Nc1ccc(COc2ccccc2)cc1)c1ccccc1[O-] ZINC001466492849 1061951199 /nfs/dbraw/zinc/95/11/99/1061951199.db2.gz GALQAMPVVCASDM-UHFFFAOYSA-N -1 1 319.360 4.224 20 0 DIADMM CCCCS(=O)(=O)[N-]c1ccccc1Oc1ccc(F)cc1 ZINC001253770467 1061978517 /nfs/dbraw/zinc/97/85/17/1061978517.db2.gz KHVNCNYSHSFAAK-UHFFFAOYSA-N -1 1 323.389 4.160 20 0 DIADMM [O-]c1cccc(-c2nnc(-c3cccc(Cl)c3)o2)c1Cl ZINC001253806822 1061987032 /nfs/dbraw/zinc/98/70/32/1061987032.db2.gz MJNGJPOZOHLRFH-UHFFFAOYSA-N -1 1 307.136 4.416 20 0 DIADMM CC(C)(C)[C@@H]1CCC[C@@H](NC(=O)c2cccc([O-])c2F)CC1 ZINC001466945408 1062030802 /nfs/dbraw/zinc/03/08/02/1062030802.db2.gz RSUJNZQTBWNYRM-CHWSQXEVSA-N -1 1 307.409 4.256 20 0 DIADMM Cc1cc(C)c2c(c1)N(Cc1ccc([O-])c(F)c1F)CCC2 ZINC001474429549 1062103083 /nfs/dbraw/zinc/10/30/83/1062103083.db2.gz MZZFIHVJXRJMQO-UHFFFAOYSA-N -1 1 303.352 4.240 20 0 DIADMM CC[C@H](C)c1ccccc1[N-]S(=O)(=O)c1ccccc1C ZINC001254497753 1062141980 /nfs/dbraw/zinc/14/19/80/1062141980.db2.gz NTQIPAXVSWUELY-ZDUSSCGKSA-N -1 1 303.427 4.309 20 0 DIADMM COc1cc(NC(=O)c2cc(SC)ccc2[O-])ccc1Cl ZINC001467589318 1062148947 /nfs/dbraw/zinc/14/89/47/1062148947.db2.gz XEVCWKUBQGENLE-UHFFFAOYSA-N -1 1 323.801 4.028 20 0 DIADMM [O-]c1cccc(-c2nnc([C@@H]3C[C@H]3c3ccccc3)o2)c1Cl ZINC001254693374 1062233409 /nfs/dbraw/zinc/23/34/09/1062233409.db2.gz CVMPWFVZUQVOME-QWHCGFSZSA-N -1 1 312.756 4.367 20 0 DIADMM [O-]c1cccc(-c2nnc([C@@H]3C[C@@H]3c3ccccc3)o2)c1Cl ZINC001254693372 1062233497 /nfs/dbraw/zinc/23/34/97/1062233497.db2.gz CVMPWFVZUQVOME-CHWSQXEVSA-N -1 1 312.756 4.367 20 0 DIADMM [O-]c1cccc(-c2nnc([C@H]3C[C@@H]3c3ccccc3)o2)c1Cl ZINC001254693373 1062234038 /nfs/dbraw/zinc/23/40/38/1062234038.db2.gz CVMPWFVZUQVOME-OLZOCXBDSA-N -1 1 312.756 4.367 20 0 DIADMM O=C(Nc1ccc([O-])c(F)c1F)c1cc2ccccc2s1 ZINC001467999678 1062243434 /nfs/dbraw/zinc/24/34/34/1062243434.db2.gz OKNIFITWQWYEQB-UHFFFAOYSA-N -1 1 305.305 4.137 20 0 DIADMM O=C(NCc1coc2ccccc12)c1cc2ccccc2cc1[O-] ZINC001468338718 1062304330 /nfs/dbraw/zinc/30/43/30/1062304330.db2.gz XELKXURKWIECPR-UHFFFAOYSA-N -1 1 317.344 4.222 20 0 DIADMM CCCCN(C(=O)c1cc(F)ccc1[O-])[C@@H]1CCC[C@@H](C)C1 ZINC001468507150 1062339311 /nfs/dbraw/zinc/33/93/11/1062339311.db2.gz YPDORWVJMVIGRO-UKRRQHHQSA-N -1 1 307.409 4.352 20 0 DIADMM O=C(Nc1cc([O-])c(F)cc1F)c1cccc2ccsc21 ZINC001468747924 1062391139 /nfs/dbraw/zinc/39/11/39/1062391139.db2.gz ODGTWYGNWGDGSB-UHFFFAOYSA-N -1 1 305.305 4.137 20 0 DIADMM CC[C@@H](C)Oc1ccc(C(=O)Nc2cc([O-])c(F)cc2F)cc1 ZINC001468747191 1062393192 /nfs/dbraw/zinc/39/31/92/1062393192.db2.gz DKHGQKFSRVPPBL-SNVBAGLBSA-N -1 1 321.323 4.100 20 0 DIADMM Cc1cc(Cl)ccc1-c1nnc(-c2cc([O-])cc(F)c2)o1 ZINC001255346693 1062411156 /nfs/dbraw/zinc/41/11/56/1062411156.db2.gz JBEGDSGDYOOTBR-UHFFFAOYSA-N -1 1 304.708 4.210 20 0 DIADMM Cc1ccc(CN(C)C(=O)c2ccc3ccccc3c2[O-])cc1C ZINC001469004354 1062458418 /nfs/dbraw/zinc/45/84/18/1062458418.db2.gz GZSADENUEJVUJP-UHFFFAOYSA-N -1 1 319.404 4.434 20 0 DIADMM O=C(NC[C@@H]1C[C@H]1c1ccccc1)c1ccc2ccccc2c1[O-] ZINC001469406066 1062546256 /nfs/dbraw/zinc/54/62/56/1062546256.db2.gz NXWCACSBNRSETK-LPHOPBHVSA-N -1 1 317.388 4.079 20 0 DIADMM O=C(NC[C@H]1C[C@@H]1c1ccccc1)c1cc2ccccc2cc1[O-] ZINC001469407555 1062546531 /nfs/dbraw/zinc/54/65/31/1062546531.db2.gz JYCXSWCTWXZQED-QZTJIDSGSA-N -1 1 317.388 4.079 20 0 DIADMM CCc1ccc(C(=O)Nc2nccc3ccc(C)cc32)c([O-])c1 ZINC001469627434 1062590905 /nfs/dbraw/zinc/59/09/05/1062590905.db2.gz WDNAGCSQHRRGES-UHFFFAOYSA-N -1 1 306.365 4.064 20 0 DIADMM Cc1c(=O)[n-]n(-c2ccccc2)c1N[C@@H](C)Cc1ccc(C)cc1 ZINC001255784252 1062605597 /nfs/dbraw/zinc/60/55/97/1062605597.db2.gz MAVFPDHIYOCGJX-HNNXBMFYSA-N -1 1 321.424 4.238 20 0 DIADMM O=C(Nc1ccc([O-])c(Cl)c1)Nc1c(F)cccc1Cl ZINC001476386906 1062643661 /nfs/dbraw/zinc/64/36/61/1062643661.db2.gz JPKQRKNFZBXLDB-UHFFFAOYSA-N -1 1 315.131 4.482 20 0 DIADMM [O-]c1cccc(-c2nnc(-c3ccc4ccccc4c3)o2)c1F ZINC001256052919 1062688798 /nfs/dbraw/zinc/68/87/98/1062688798.db2.gz OBCKPSDFOSNNQB-UHFFFAOYSA-N -1 1 306.296 4.402 20 0 DIADMM CCCOc1ccc(-c2nnc(-c3cc([O-])cc(F)c3)o2)cc1 ZINC001256302293 1062768249 /nfs/dbraw/zinc/76/82/49/1062768249.db2.gz QCBBICLVQSXZQO-UHFFFAOYSA-N -1 1 314.316 4.037 20 0 DIADMM Cc1ccc(-c2nnc(-c3c(F)ccc([O-])c3F)o2)cc1C ZINC001256599613 1062909561 /nfs/dbraw/zinc/90/95/61/1062909561.db2.gz XAFYAOVFLZOMBZ-UHFFFAOYSA-N -1 1 302.280 4.004 20 0 DIADMM C[C@H](NC(=O)c1ccc2ccccc2c1[O-])[C@@]12C[C@@H]1CCCC2 ZINC001471098121 1062922964 /nfs/dbraw/zinc/92/29/64/1062922964.db2.gz KVEVWWPJMKPXAR-ZQGRQUNCSA-N -1 1 309.409 4.244 20 0 DIADMM O=C(Nc1nc(C2CCCCC2)cs1)c1cccc([O-])c1F ZINC001471131287 1062925095 /nfs/dbraw/zinc/92/50/95/1062925095.db2.gz DAXWCXSAKKXIKQ-UHFFFAOYSA-N -1 1 320.389 4.288 20 0 DIADMM Cc1cccc2c1[C@H](C)C[C@@H]2CC(=O)Nc1cccc(F)c1[O-] ZINC001471168507 1062932979 /nfs/dbraw/zinc/93/29/79/1062932979.db2.gz QZULPUZKDQOPOU-CHWSQXEVSA-N -1 1 313.372 4.459 20 0 DIADMM Cc1cc([N-]S(=O)(=O)c2cccc(Cl)c2)cc(C)c1C ZINC001256796134 1062983927 /nfs/dbraw/zinc/98/39/27/1062983927.db2.gz UPXNIKMNSVIOHQ-UHFFFAOYSA-N -1 1 309.818 4.066 20 0 DIADMM CC(C)(C)OCc1ccccc1NC(=O)c1ccc(F)c([O-])c1 ZINC001471937754 1063035379 /nfs/dbraw/zinc/03/53/79/1063035379.db2.gz QVNLKNHCMNIENY-UHFFFAOYSA-N -1 1 317.360 4.099 20 0 DIADMM Cc1cccc(S(=O)(=O)[N-]c2cccc3cc(C)ccc32)c1 ZINC001256958689 1063058810 /nfs/dbraw/zinc/05/88/10/1063058810.db2.gz QGQPGBMBNBWTJE-UHFFFAOYSA-N -1 1 311.406 4.257 20 0 DIADMM Cc1cccc(S(=O)(=O)[N-]c2cc(C(C)C)ccc2C)c1 ZINC001256946070 1063059262 /nfs/dbraw/zinc/05/92/62/1063059262.db2.gz IVWBFJQOMDOAPG-UHFFFAOYSA-N -1 1 303.427 4.228 20 0 DIADMM O=C(Cc1coc2cc(Cl)ccc12)Nc1ccc(F)cc1[O-] ZINC001472534925 1063096632 /nfs/dbraw/zinc/09/66/32/1063096632.db2.gz NEJWAHPFOKCNTP-UHFFFAOYSA-N -1 1 319.719 4.112 20 0 DIADMM Cc1cccc2c1[C@@H](C)C[C@H]2CC(=O)Nc1ccc(F)cc1[O-] ZINC001472534331 1063096928 /nfs/dbraw/zinc/09/69/28/1063096928.db2.gz IWNJKOSXJUCJPV-STQMWFEESA-N -1 1 313.372 4.459 20 0 DIADMM COc1ccc(-c2nnc([C@H]3C[C@@H]3c3ccc(C)cc3)o2)c([O-])c1 ZINC001257211035 1063143406 /nfs/dbraw/zinc/14/34/06/1063143406.db2.gz ZEEPCBYSCYOVAP-CVEARBPZSA-N -1 1 322.364 4.030 20 0 DIADMM Cc1cccc(-c2nsc([N-]c3cnn(C(C)(C)C)c3)n2)c1 ZINC001472678575 1063144733 /nfs/dbraw/zinc/14/47/33/1063144733.db2.gz KEQNTLQPUDUUNF-UHFFFAOYSA-N -1 1 313.430 4.209 20 0 DIADMM CCCc1cc(=O)[n-]c(S[C@H](C)CCc2ccccc2)n1 ZINC001472923545 1063317987 /nfs/dbraw/zinc/31/79/87/1063317987.db2.gz GBCLFJRXBBXPIU-CYBMUJFWSA-N -1 1 302.443 4.248 20 0 DIADMM CCCc1cc(=O)[n-]c(S[C@@H](C)CCc2ccccc2)n1 ZINC001472923546 1063318637 /nfs/dbraw/zinc/31/86/37/1063318637.db2.gz GBCLFJRXBBXPIU-ZDUSSCGKSA-N -1 1 302.443 4.248 20 0 DIADMM Cc1c(Cl)cccc1S(=O)(=O)[N-]c1ccc2c(c1)N=NC2 ZINC001257628370 1063353102 /nfs/dbraw/zinc/35/31/02/1063353102.db2.gz MKFIFGWDJXWHIR-UHFFFAOYSA-N -1 1 321.789 4.047 20 0 DIADMM CC[C@@H](OCCSc1nc(C)c(C)c(=O)[n-]1)c1ccccc1 ZINC001473010591 1063355705 /nfs/dbraw/zinc/35/57/05/1063355705.db2.gz ASAZBKBVBGBIEY-OAHLLOKOSA-N -1 1 318.442 4.059 20 0 DIADMM [O-]c1cccc(-c2nnc(CCCc3ccccc3)o2)c1Cl ZINC001257819526 1063392985 /nfs/dbraw/zinc/39/29/85/1063392985.db2.gz URHCIZCBTGDUBJ-UHFFFAOYSA-N -1 1 314.772 4.271 20 0 DIADMM CC(C)(C)[C@@H]1CCCN(C(=O)NCc2ccc([O-])c(Cl)c2)C1 ZINC001479211671 1063399955 /nfs/dbraw/zinc/39/99/55/1063399955.db2.gz OGNLPZLJFBQZFM-CYBMUJFWSA-N -1 1 324.852 4.013 20 0 DIADMM [O-]c1cc(C(F)(F)F)ccc1-c1nnc(CC2CCCC2)o1 ZINC001258601616 1063705589 /nfs/dbraw/zinc/70/55/89/1063705589.db2.gz DXLGZDSXZABZTK-UHFFFAOYSA-N -1 1 312.291 4.194 20 0 DIADMM Cc1ccc(F)cc1S(=O)(=O)[N-]c1c(C)cccc1C1CC1 ZINC001258927772 1063880900 /nfs/dbraw/zinc/88/09/00/1063880900.db2.gz UKMDFTKSLHOEKJ-UHFFFAOYSA-N -1 1 319.401 4.121 20 0 DIADMM Cc1ccc(C(C)C)cc1[N-]S(=O)(=O)c1cc(F)ccc1C ZINC001258926772 1063881185 /nfs/dbraw/zinc/88/11/85/1063881185.db2.gz BLBBZVKXAFQVRT-UHFFFAOYSA-N -1 1 321.417 4.367 20 0 DIADMM Cc1ccc(CS(=O)(=O)[N-]c2cc3ccccc3s2)cc1 ZINC001259258783 1063886425 /nfs/dbraw/zinc/88/64/25/1063886425.db2.gz CAYLBMMGKGPYND-UHFFFAOYSA-N -1 1 317.435 4.152 20 0 DIADMM CCCc1ccccc1[N-]S(=O)(=O)c1cc(C)cc(C)c1 ZINC001259524131 1063889054 /nfs/dbraw/zinc/88/90/54/1063889054.db2.gz BGHXUBYHTSBSCS-UHFFFAOYSA-N -1 1 303.427 4.057 20 0 DIADMM Cc1cc(C)cc(S(=O)(=O)[N-]c2ccc(Cl)cc2C)c1 ZINC001259516166 1063889769 /nfs/dbraw/zinc/88/97/69/1063889769.db2.gz HGGINXIVXDFNGT-UHFFFAOYSA-N -1 1 309.818 4.066 20 0 DIADMM CC[C@H](C)S(=O)(=O)[N-]c1ccccc1Oc1ccc(C)cc1 ZINC001260737852 1063903872 /nfs/dbraw/zinc/90/38/72/1063903872.db2.gz AGOWQUYCYDIEED-AWEZNQCLSA-N -1 1 319.426 4.328 20 0 DIADMM Cc1cccc(S(=O)(=O)[N-]c2ccccc2C(C)C)c1C ZINC001260991382 1063906885 /nfs/dbraw/zinc/90/68/85/1063906885.db2.gz IBBXPOLXFQZAMF-UHFFFAOYSA-N -1 1 303.427 4.228 20 0 DIADMM O=C(Cc1ccc([O-])c(Cl)c1)N[C@@H]1CC[C@@H]2CCCC[C@H]2C1 ZINC001290366519 1064692251 /nfs/dbraw/zinc/69/22/51/1064692251.db2.gz MWTRZMIDHKHNMQ-SOUVJXGZSA-N -1 1 321.848 4.063 20 0 DIADMM CCN(C(=O)c1cc(SC)ccc1[O-])c1cccc(C)c1 ZINC001290705816 1064707709 /nfs/dbraw/zinc/70/77/09/1064707709.db2.gz DYSPVQHDOYJGSV-UHFFFAOYSA-N -1 1 301.411 4.089 20 0 DIADMM Cc1cccc([C@@H](NC(=O)c2ccc([O-])c(F)c2)C(C)(C)C)c1 ZINC001291927853 1064751022 /nfs/dbraw/zinc/75/10/22/1064751022.db2.gz FHSRPXZBWTZPHE-QGZVFWFLSA-N -1 1 315.388 4.357 20 0 DIADMM CCSc1ccc(Cl)cc1NC(=O)c1ccc(O)cc1[O-] ZINC001293183949 1064802722 /nfs/dbraw/zinc/80/27/22/1064802722.db2.gz KQPWGRBLJRVMRR-UHFFFAOYSA-N -1 1 323.801 4.116 20 0 DIADMM CSc1ccc(NC(=O)c2cc(F)ccc2[O-])cc1Cl ZINC001294325228 1064862601 /nfs/dbraw/zinc/86/26/01/1064862601.db2.gz ODAGFQJQAWZHAS-UHFFFAOYSA-N -1 1 311.765 4.159 20 0 DIADMM CC(C)(C)C1CCC(CNC(=O)c2ccc(F)c([O-])c2)CC1 ZINC001294633742 1064878003 /nfs/dbraw/zinc/87/80/03/1064878003.db2.gz PJOAACRWYZAFQN-UHFFFAOYSA-N -1 1 307.409 4.114 20 0 DIADMM O=C(c1c([O-])cccc1Cl)N1CCCC[C@H]1c1ccccc1 ZINC001296046002 1064936013 /nfs/dbraw/zinc/93/60/13/1064936013.db2.gz HPRAQHUAYBCIRG-HNNXBMFYSA-N -1 1 315.800 4.413 20 0 DIADMM CCCC[C@](C)(F)C(=O)Nc1ccc(Br)c([O-])c1 ZINC001296434490 1064944385 /nfs/dbraw/zinc/94/43/85/1064944385.db2.gz QUVVKEDGUINDBL-ZDUSSCGKSA-N -1 1 318.186 4.012 20 0 DIADMM CC(C)(C)[C@H]1CN(C(=O)c2cc(F)ccc2[O-])c2ccccc21 ZINC001297186826 1064971950 /nfs/dbraw/zinc/97/19/50/1064971950.db2.gz QPPFYSYKQRBBTM-HNNXBMFYSA-N -1 1 313.372 4.321 20 0 DIADMM Cc1ccc(-c2cccnc2)cc1NC(=O)c1ccc(F)c([O-])c1 ZINC001297454171 1064981478 /nfs/dbraw/zinc/98/14/78/1064981478.db2.gz BDOYNAURESLCRN-UHFFFAOYSA-N -1 1 322.339 4.154 20 0 DIADMM CC(C)CN(C(=O)Cc1ccc([O-])c(Cl)c1)c1ccccc1 ZINC001297634707 1064985519 /nfs/dbraw/zinc/98/55/19/1064985519.db2.gz GIJYTSXAABAJLE-UHFFFAOYSA-N -1 1 317.816 4.277 20 0 DIADMM CC(C)(C)c1ccc(C(=O)Nc2ccc([O-])c(F)c2F)cc1 ZINC001297819741 1064990796 /nfs/dbraw/zinc/99/07/96/1064990796.db2.gz CWUTWQZYDCLVPH-UHFFFAOYSA-N -1 1 305.324 4.220 20 0 DIADMM CCCCNc1ccccc1C(=O)Nc1ccc([O-])c(F)c1F ZINC001297821502 1064991087 /nfs/dbraw/zinc/99/10/87/1064991087.db2.gz VHOFMCLQWBIPSB-UHFFFAOYSA-N -1 1 320.339 4.135 20 0 DIADMM CC[C@H](CCc1ccccc1)NC(=O)c1cc(Cl)ccc1[O-] ZINC001300846768 1065044428 /nfs/dbraw/zinc/04/44/28/1065044428.db2.gz FXFQOYYLUHKLKH-OAHLLOKOSA-N -1 1 317.816 4.187 20 0 DIADMM C[C@H](CC(=O)NCc1ccc([O-])c(Cl)c1)C1CCCCC1 ZINC001303297560 1065111947 /nfs/dbraw/zinc/11/19/47/1065111947.db2.gz ZMEHSGDVUUOGDY-GFCCVEGCSA-N -1 1 309.837 4.268 20 0 DIADMM CC(C)[C@H](CCc1ccccc1)C(=O)[N-]Oc1ccccc1F ZINC001303333173 1065112574 /nfs/dbraw/zinc/11/25/74/1065112574.db2.gz WWGLRIHYRMGGKY-INIZCTEOSA-N -1 1 315.388 4.141 20 0 DIADMM C[C@@H](CC(=O)NCc1ccc([O-])c(Cl)c1)C1CCCCC1 ZINC001303297561 1065113186 /nfs/dbraw/zinc/11/31/86/1065113186.db2.gz ZMEHSGDVUUOGDY-LBPRGKRZSA-N -1 1 309.837 4.268 20 0 DIADMM CCN(C(=O)c1cc(SC)ccc1[O-])c1ccc(F)c(C)c1 ZINC001303362647 1065114724 /nfs/dbraw/zinc/11/47/24/1065114724.db2.gz DVNKXLXFSBQZHH-UHFFFAOYSA-N -1 1 319.401 4.228 20 0 DIADMM C[C@H](c1ccc(Cl)cc1)N(C)C(=O)c1ccc(F)c([O-])c1 ZINC001303371345 1065114827 /nfs/dbraw/zinc/11/48/27/1065114827.db2.gz SLCRHQUQXCDFOG-SNVBAGLBSA-N -1 1 307.752 4.018 20 0 DIADMM O=C(NC[C@H]1C[C@H]1C1CCCC1)c1ccc2ccccc2c1[O-] ZINC001305873721 1065167097 /nfs/dbraw/zinc/16/70/97/1065167097.db2.gz KHTPNUHLUREAAZ-QAPCUYQASA-N -1 1 309.409 4.102 20 0 DIADMM CCCc1cc(=O)[n-]c(SCc2nc(C(C)(C)C)cs2)n1 ZINC001307252594 1065314800 /nfs/dbraw/zinc/31/48/00/1065314800.db2.gz HQMNRGLIYBLKAY-UHFFFAOYSA-N -1 1 323.487 4.181 20 0 DIADMM Cc1nc(S[C@@H]2CCCCc3ccccc32)[n-]c(=O)c1C ZINC001307323004 1065341220 /nfs/dbraw/zinc/34/12/20/1065341220.db2.gz JLNWXRZGYQQBPA-OAHLLOKOSA-N -1 1 300.427 4.359 20 0 DIADMM Cc1nc(S[C@H]2CCc3ccccc3C2)[n-]c(=O)c1C1CC1 ZINC001307381576 1065362838 /nfs/dbraw/zinc/36/28/38/1065362838.db2.gz GWAFAGVQMRYWGA-HNNXBMFYSA-N -1 1 312.438 4.018 20 0 DIADMM Cc1nc(SCCCCc2ccccc2)[n-]c(=O)c1C1CC1 ZINC001307382565 1065363399 /nfs/dbraw/zinc/36/33/99/1065363399.db2.gz PZFQRCRJTRLKHN-UHFFFAOYSA-N -1 1 314.454 4.483 20 0 DIADMM C[C@@H]1C[C@@H](c2ccccc2F)N(Cc2ccc([O-])c(F)c2F)C1 ZINC001308573635 1066087213 /nfs/dbraw/zinc/08/72/13/1066087213.db2.gz PUKYYWPIJGGMNN-ABAIWWIYSA-N -1 1 321.342 4.393 20 0 DIADMM CC[C@@H]1c2ccsc2CCN1Cc1ccc([O-])c(F)c1F ZINC001308628082 1066125256 /nfs/dbraw/zinc/12/52/56/1066125256.db2.gz PLXCXLFYDMLIJW-GFCCVEGCSA-N -1 1 309.381 4.241 20 0 DIADMM Cc1cccc2c1CC(C)(C)N(Cc1ccc([O-])c(F)c1F)C2 ZINC001308777232 1066251474 /nfs/dbraw/zinc/25/14/74/1066251474.db2.gz MQUPLKRSOUQGPB-UHFFFAOYSA-N -1 1 317.379 4.316 20 0 DIADMM COc1ccc2c(c1)N(Cc1cccc([O-])c1Cl)CCCC2 ZINC001308830146 1066308138 /nfs/dbraw/zinc/30/81/38/1066308138.db2.gz ILQWOAXCYJADDU-UHFFFAOYSA-N -1 1 317.816 4.397 20 0 DIADMM CC[C@@H]([N-]S(=O)(=O)c1cc2ccccc2o1)C1CCCCC1 ZINC001309130306 1066444574 /nfs/dbraw/zinc/44/45/74/1066444574.db2.gz MFGDHNQNQZGSIE-OAHLLOKOSA-N -1 1 321.442 4.070 20 0 DIADMM