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371.436 4.424 20 0 FIADRM O=C([O-])C[C@H](NC(=O)c1ccc(-c2ccccc2)[nH]1)c1ccc(Cl)cc1 ZINC000537369612 1101702123 /nfs/dbraw/zinc/70/21/23/1101702123.db2.gz VJBPZPQHFIJQCD-SFHVURJKSA-N -1 0 368.820 4.281 20 0 FIADRM COc1ccc(CCCCCC(=O)N2C[C@H](C(=O)[O-])c3ccccc32)cc1 ZINC000439700778 1101702534 /nfs/dbraw/zinc/70/25/34/1101702534.db2.gz UAFCQEMCDGLFJU-IBGZPJMESA-N -1 0 367.445 4.013 20 0 FIADRM O=C([O-])[C@H]1CC=CC[C@@H]1C(=O)Nc1ccc2cc(Br)ccc2c1 ZINC000321194725 1101709578 /nfs/dbraw/zinc/70/95/78/1101709578.db2.gz NMIHAZVGETYATO-HOTGVXAUSA-N -1 0 374.234 4.208 20 0 FIADRM CC[C@@H](CC(=O)Nc1ccc([C@H](C)C(=O)[O-])cc1)c1ccc(OC)cc1 ZINC000263037871 1101717401 /nfs/dbraw/zinc/71/74/01/1101717401.db2.gz CRJGFXXGJQZOHF-GJZGRUSLSA-N -1 0 355.434 4.406 20 0 FIADRM O=C(N=c1nc(-c2ccccc2Cl)[n-]s1)c1cccc2c1CCC2 ZINC000518901562 1101718176 /nfs/dbraw/zinc/71/81/76/1101718176.db2.gz YICPTFHLUGJXEU-UHFFFAOYSA-N -1 0 355.850 4.021 20 0 FIADRM C[C@H]1C[C@@H](C(=O)[O-])CN(C(=O)Nc2ccc3c(c2)oc2ccccc23)C1 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1101877128 /nfs/dbraw/zinc/87/71/28/1101877128.db2.gz ZVNAXBNEUROJLN-JXFKEZNVSA-N -1 0 361.441 4.003 20 0 FIADRM O=C([O-])COc1ccc(NC(=O)c2ccc(C3CCC3)cc2)cc1Cl ZINC000439906349 1101882442 /nfs/dbraw/zinc/88/24/42/1101882442.db2.gz XVYDRIJYRFQGGT-UHFFFAOYSA-N -1 0 359.809 4.323 20 0 FIADRM Cc1ccc(Cl)cc1C(=O)N(CCC(=O)[O-])Cc1cccc(F)c1F ZINC000439907711 1101883769 /nfs/dbraw/zinc/88/37/69/1101883769.db2.gz FWRFZJIAPMVGLF-UHFFFAOYSA-N -1 0 367.779 4.044 20 0 FIADRM Fc1cc(F)cc(Oc2ccc(CN=c3[n-]nc(C(F)F)o3)cc2)c1 ZINC000469462990 1101884654 /nfs/dbraw/zinc/88/46/54/1101884654.db2.gz PPXHFQCGYHEIDX-UHFFFAOYSA-N -1 0 353.275 4.112 20 0 FIADRM O=C([O-])c1ccn(-c2ccccc2NC(=O)c2ccc(C3CCC3)cc2)n1 ZINC000439945017 1101913535 /nfs/dbraw/zinc/91/35/35/1101913535.db2.gz UVUWXWBOKPIKKZ-UHFFFAOYSA-N -1 0 361.401 4.090 20 0 FIADRM CCc1cc(C(=O)Nc2cccc(CSCCC(=O)[O-])c2)oc1CC ZINC000439934894 1101917290 /nfs/dbraw/zinc/91/72/90/1101917290.db2.gz LLWVIUKQKPULKT-UHFFFAOYSA-N -1 0 361.463 4.365 20 0 FIADRM 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C[C@H](Oc1cccc(C(C)(C)C)c1)C(=O)Nc1ccc(F)c(C(=O)[O-])c1 ZINC000916047834 1121392456 /nfs/dbraw/zinc/39/24/56/1121392456.db2.gz VXGRMANJZOIIMU-LBPRGKRZSA-N -1 0 359.397 4.227 20 0 FIADRM CCc1cccc(Oc2ccc(NC(=O)c3ccc(C(=O)[O-])s3)cn2)c1 ZINC000916088343 1121408089 /nfs/dbraw/zinc/40/80/89/1121408089.db2.gz GLDRJTIMYUPDLT-UHFFFAOYSA-N -1 0 368.414 4.448 20 0 FIADRM O=S(=O)(/C=C\c1ccc(Cl)cc1)[N-]c1nc2c(s1)CCCC2 ZINC000916110091 1121416136 /nfs/dbraw/zinc/41/61/36/1121416136.db2.gz UKYPMAWVVGEZJC-KTKRTIGZSA-N -1 0 354.884 4.088 20 0 FIADRM Cc1cc(S(=O)(=O)N[C@H]2CCCCC2(C)C)sc1Br ZINC000094541874 1121426428 /nfs/dbraw/zinc/42/64/28/1121426428.db2.gz DDHNIOJMTQFXAE-JTQLQIEISA-N -1 0 366.346 4.066 20 0 FIADRM CCCc1ccc(S(=O)(=O)Nc2ccc([C@H](C)CC(=O)[O-])cc2)cc1 ZINC000328292207 1121515188 /nfs/dbraw/zinc/51/51/88/1121515188.db2.gz KZXOHTXAGXECTQ-CQSZACIVSA-N -1 0 361.463 4.018 20 0 FIADRM CSc1ccc(Cl)cc1[N-]S(=O)(=O)c1cccc(C(C)=O)c1 ZINC000064374935 1121608710 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FIADRM COc1cccc([C@H](C)CC(=O)[N-]S(=O)(=O)[C@H](C)c2ccccc2)c1 ZINC000084695264 1121978505 /nfs/dbraw/zinc/97/85/05/1121978505.db2.gz PUEUBHNVIPTFSX-HUUCEWRRSA-N -1 0 361.463 4.236 20 0 FIADRM CO[C@@H](C)c1nc(=N[C@H]2CCCc3c4cc(Cl)ccc4[nH]c32)s[n-]1 ZINC000624675168 1122093298 /nfs/dbraw/zinc/09/32/98/1122093298.db2.gz MOLVQVRPOVFWFH-XPTSAGLGSA-N -1 0 362.886 4.292 20 0 FIADRM O=C([O-])c1csc(C=C(Cl)c2nc3ccc(Cl)cc3c(=O)[nH]2)c1 ZINC000765822576 1122218646 /nfs/dbraw/zinc/21/86/46/1122218646.db2.gz ARLACILPBVJAOS-WZUFQYTHSA-N -1 0 367.213 4.073 20 0 FIADRM CC[C@H](C(=O)[N-]OCc1cccc(C)n1)c1cccc(C(F)(F)F)c1 ZINC001168633696 1122241582 /nfs/dbraw/zinc/24/15/82/1122241582.db2.gz FQJJWCDZCWHPBK-INIZCTEOSA-N -1 0 352.356 4.150 20 0 FIADRM C[C@H](NC(=O)N(C)[C@@H]1CCC[C@H]1c1ccccc1)[C@@H]1C[C@H](C(=O)[O-])C1(C)C ZINC000655899601 1122260922 /nfs/dbraw/zinc/26/09/22/1122260922.db2.gz IHCJAYGYFALELX-GPFWEFOESA-N -1 0 372.509 4.100 20 0 FIADRM CC(=O)Nc1ccc(C)cc1[N-]S(=O)(=O)c1cc(Cl)ccc1Cl 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374.462 4.286 20 0 FIADRM Cc1cc(S(=O)(=O)[N-]c2nc(-c3sccc3C)ns2)c(C)s1 ZINC000129051370 1122512570 /nfs/dbraw/zinc/51/25/70/1122512570.db2.gz BBYUHKIBGBUVLO-UHFFFAOYSA-N -1 0 371.534 4.054 20 0 FIADRM Cc1ccc(Cl)c(S(=O)(=O)[N-]c2ccc3nn(C(C)C)cc3c2)c1 ZINC000498015680 1122527144 /nfs/dbraw/zinc/52/71/44/1122527144.db2.gz MRCIPYLAOKVTIA-UHFFFAOYSA-N -1 0 363.870 4.380 20 0 FIADRM Cc1ccc(Cl)c(S(=O)(=O)[N-]c2ccc3nc(C4CC4)oc3c2)c1 ZINC000498020122 1122528326 /nfs/dbraw/zinc/52/83/26/1122528326.db2.gz XBCFQUYLMQSNJH-UHFFFAOYSA-N -1 0 362.838 4.468 20 0 FIADRM Cc1ccc(Br)c(S(=O)(=O)[N-]c2cc(C)cc(F)c2)c1 ZINC000498020316 1122529141 /nfs/dbraw/zinc/52/91/41/1122529141.db2.gz ZIFBMZAHFQDCKL-UHFFFAOYSA-N -1 0 358.232 4.006 20 0 FIADRM Cc1ccc(CCC2CCN(C(=O)[C@H]3CC[C@H](C(=O)[O-])CC3)CC2)cc1 ZINC000262703150 1122536767 /nfs/dbraw/zinc/53/67/67/1122536767.db2.gz IRBZLJKMUGEHSN-MXVIHJGJSA-N -1 0 357.494 4.057 20 0 FIADRM Cc1c(COc2ccccc2)cccc1NC(=O)[C@H]1CC[C@H](C(=O)[O-])CC1 ZINC000262708321 1122538971 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FIADRM O=C([O-])C1(CC(=O)NCc2ccc(OC3CCCC3)cc2)CCCCC1 ZINC000556275405 1122784057 /nfs/dbraw/zinc/78/40/57/1122784057.db2.gz XCRMZNLFQBTRQD-UHFFFAOYSA-N -1 0 359.466 4.049 20 0 FIADRM CCCCOc1ccc(CNc2cc(C(=O)[O-])cc(OC)c2OC)cc1 ZINC000556321571 1122802793 /nfs/dbraw/zinc/80/27/93/1122802793.db2.gz CVGLVXUFEXELBE-UHFFFAOYSA-N -1 0 359.422 4.193 20 0 FIADRM COc1ccc(-c2n[nH]cc2CNc2cc(C(=O)[O-])c(C)cc2C)cc1 ZINC000556322727 1122809045 /nfs/dbraw/zinc/80/90/45/1122809045.db2.gz YHSKQXVBROIOSE-UHFFFAOYSA-N -1 0 351.406 4.012 20 0 FIADRM Cc1ccc(NCc2cc(Br)cc3c2OCC3)cc1C(=O)[O-] ZINC000556323506 1122809505 /nfs/dbraw/zinc/80/95/05/1122809505.db2.gz SDMPTQIZGVZZFR-UHFFFAOYSA-N -1 0 362.223 4.003 20 0 FIADRM Cc1ccn(-c2ccc([N-]S(=O)(=O)c3cc(C)c(Cl)s3)cc2)n1 ZINC000556332937 1122815352 /nfs/dbraw/zinc/81/53/52/1122815352.db2.gz RPTSADPOXYXUGQ-UHFFFAOYSA-N -1 0 367.883 4.005 20 0 FIADRM CCCc1ccc(Cl)c(S(=O)(=O)[N-]c2ccccc2COC)c1 ZINC000556346228 1122825538 /nfs/dbraw/zinc/82/55/38/1122825538.db2.gz BPJCBKWJSSOPOI-UHFFFAOYSA-N -1 0 353.871 4.240 20 0 FIADRM O=S(=O)([N-]c1ccc2nc(C3CC3)oc2c1)c1cc(Cl)ccc1F ZINC000556350942 1122829517 /nfs/dbraw/zinc/82/95/17/1122829517.db2.gz PQSVNPUICHHJAS-UHFFFAOYSA-N -1 0 366.801 4.299 20 0 FIADRM C[C@]1(NC(=O)c2cc(-c3ccccn3)ccc2Cl)CCCC[C@H]1C(=O)[O-] ZINC000262821274 1122899482 /nfs/dbraw/zinc/89/94/82/1122899482.db2.gz PPIYVBWZRBTOCT-YWZLYKJASA-N -1 0 372.852 4.165 20 0 FIADRM CC(C)(NC(=O)[C@H]1CCC[C@H](C(=O)[O-])C1)c1ccc(Cl)c(Cl)c1 ZINC000498613877 1122907250 /nfs/dbraw/zinc/90/72/50/1122907250.db2.gz HBNCFRLUBGLTMT-QWRGUYRKSA-N -1 0 358.265 4.236 20 0 FIADRM O=C([O-])[C@@H]1CCC[C@H](C(=O)N[C@H](c2ccccc2)c2cccc(Cl)c2)C1 ZINC000498619719 1122917333 /nfs/dbraw/zinc/91/73/33/1122917333.db2.gz BOGWJEOLVNRSTF-YQVWRLOYSA-N -1 0 371.864 4.437 20 0 FIADRM Cc1ccsc1[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCC[C@H](C(=O)[O-])C1 ZINC000498634449 1122920344 /nfs/dbraw/zinc/92/03/44/1122920344.db2.gz KETYGQZFKZJZRD-SQNIBIBYSA-N -1 0 371.502 4.348 20 0 FIADRM CC(C)c1cnc(-c2ccc(NC(=O)[C@@H]3CCC[C@@H](C(=O)[O-])C3)cc2)o1 ZINC000498635800 1122924078 /nfs/dbraw/zinc/92/40/78/1122924078.db2.gz RKHPGFGKYJYBIP-HUUCEWRRSA-N -1 0 356.422 4.295 20 0 FIADRM O=C([O-])[C@@H]1CCC[C@@H](C(=O)N(CCc2ccc(Cl)cc2)CC2CC2)C1 ZINC000498641716 1122927996 /nfs/dbraw/zinc/92/79/96/1122927996.db2.gz YTEHGTJGMAUQDV-IAGOWNOFSA-N -1 0 363.885 4.012 20 0 FIADRM O=C([O-])[C@@H]1CCC[C@@H](C(=O)NCc2ccc(Oc3ccc(F)cc3)cc2)C1 ZINC000498650312 1122929605 /nfs/dbraw/zinc/92/96/05/1122929605.db2.gz YILBTHJCOFXXPQ-HZPDHXFCSA-N -1 0 371.408 4.125 20 0 FIADRM Cc1ccc(C(=O)N2CC[C@H](C(=O)[O-])[C@H](C)C2)c(Sc2ccccc2)c1 ZINC000262895592 1123028503 /nfs/dbraw/zinc/02/85/03/1123028503.db2.gz HSKFIFDMTJWAAY-WBVHZDCISA-N -1 0 369.486 4.329 20 0 FIADRM Cc1nc([C@H](C)NC(=O)C(C)(C)CCCc2ccccc2)sc1C(=O)[O-] ZINC000237538327 1123036540 /nfs/dbraw/zinc/03/65/40/1123036540.db2.gz DBCPMYWRPZDVPC-AWEZNQCLSA-N -1 0 374.506 4.376 20 0 FIADRM O=C([O-])[C@H]1CC[C@H](C(=O)Nc2ccc(Oc3ccc(Cl)cc3)nc2)CC1 ZINC000262945587 1123102851 /nfs/dbraw/zinc/10/28/51/1123102851.db2.gz OBSLNNAWCAJAJY-JOCQHMNTSA-N -1 0 374.824 4.357 20 0 FIADRM O=C([O-])c1cccc(NC(=O)c2csc(-c3ccc(Cl)s3)n2)c1 ZINC000556846031 1123138881 /nfs/dbraw/zinc/13/88/81/1123138881.db2.gz ZXFNIUNXPFDWTC-UHFFFAOYSA-N -1 0 364.835 4.476 20 0 FIADRM C[C@H](c1ccccc1C(F)(F)F)[C@H](C)NC(=O)CC(C)(C)CC(=O)[O-] ZINC000499033278 1123149817 /nfs/dbraw/zinc/14/98/17/1123149817.db2.gz RLJKVIIMRPHUMH-RYUDHWBXSA-N -1 0 359.388 4.205 20 0 FIADRM Cc1ccc(S([O-])=CC(=O)N[C@H](c2cccs2)C(C)(C)C)cc1C ZINC000132335027 1123244358 /nfs/dbraw/zinc/24/43/58/1123244358.db2.gz TZATUCGHIDYMPG-KOSHJBKYSA-N -1 0 363.548 4.376 20 0 FIADRM Cc1ccc(C)c(S([O-])=CC(=O)N[C@@H](c2cccs2)C(C)(C)C)c1 ZINC000132405774 1123252189 /nfs/dbraw/zinc/25/21/89/1123252189.db2.gz WZDHEUNLWOLKAP-UUOWRZLLSA-N -1 0 363.548 4.376 20 0 FIADRM CCSc1ccc(Cl)cc1C(=O)Nc1ccc(OCC(=O)[O-])cc1 ZINC000499167775 1123303551 /nfs/dbraw/zinc/30/35/51/1123303551.db2.gz IBESEPKQAOGNDQ-UHFFFAOYSA-N -1 0 365.838 4.168 20 0 FIADRM CC(C)Oc1ccc(Cl)cc1C(=O)Nc1ccc(F)c(C(=O)[O-])c1 ZINC000920003103 1123305439 /nfs/dbraw/zinc/30/54/39/1123305439.db2.gz PNLOVPMAFRKCGB-UHFFFAOYSA-N -1 0 351.761 4.217 20 0 FIADRM CCc1ccc(-c2ccc(C(=O)Nc3ccc(OCC(=O)[O-])cc3)o2)cc1 ZINC000499172419 1123305533 /nfs/dbraw/zinc/30/55/33/1123305533.db2.gz UNYFDCVSDHKMTE-UHFFFAOYSA-N -1 0 365.385 4.225 20 0 FIADRM O=C([O-])/C=C/c1ccc(NC(=O)CCc2ccc(-c3ccccc3)[nH]2)cc1 ZINC000920003609 1123305537 /nfs/dbraw/zinc/30/55/37/1123305537.db2.gz ZNLZUEUQICEVBS-OVCLIPMQSA-N -1 0 360.413 4.351 20 0 FIADRM O=C([O-])[C@@H]1CCC[C@@H](C(=O)N(CCc2cccc(F)c2)C2CCCC2)C1 ZINC000499170637 1123305647 /nfs/dbraw/zinc/30/56/47/1123305647.db2.gz ADGDYZKXXKPWQL-IAGOWNOFSA-N -1 0 361.457 4.030 20 0 FIADRM CC(C)c1ccc([C@H](C)CC(=O)Nc2ccc(OCC(=O)[O-])cc2)cc1 ZINC000499184545 1123312435 /nfs/dbraw/zinc/31/24/35/1123312435.db2.gz CSOKXTDCJHLHPM-OAHLLOKOSA-N -1 0 355.434 4.406 20 0 FIADRM Cc1nc([C@H](C)NC(=O)C[C@@H]2C[C@H](C)CC(C)(C)C2)sc1C(=O)[O-] ZINC000499204137 1123323360 /nfs/dbraw/zinc/32/33/60/1123323360.db2.gz UEAAQUQPEUYYAA-DRZSPHRISA-N -1 0 352.500 4.179 20 0 FIADRM Cc1c(Cl)cccc1S(=O)(=O)[N-]c1cnn(CC(C)C)c1C(C)C ZINC000499275539 1123397587 /nfs/dbraw/zinc/39/75/87/1123397587.db2.gz UWPJTYJPZSOPHY-UHFFFAOYSA-N -1 0 369.918 4.425 20 0 FIADRM CSc1ccc(CCCC(=O)N[C@@H](CC(=O)[O-])c2cccs2)cc1 ZINC000649240134 1123410567 /nfs/dbraw/zinc/41/05/67/1123410567.db2.gz FAFMJKWTBLLUDB-HNNXBMFYSA-N -1 0 363.504 4.125 20 0 FIADRM Cc1cc(OCC(=O)[O-])ccc1NC(=O)c1ccccc1SC(C)C ZINC000263040143 1123412377 /nfs/dbraw/zinc/41/23/77/1123412377.db2.gz VQGGTPCATMOGQP-UHFFFAOYSA-N -1 0 359.447 4.211 20 0 FIADRM O=C([N-]c1nnc(SCc2cccs2)s1)c1scnc1Cl ZINC000920300111 1123436012 /nfs/dbraw/zinc/43/60/12/1123436012.db2.gz GUHCNBHTQBFTRX-UHFFFAOYSA-N -1 0 374.925 4.254 20 0 FIADRM O=C(Nc1ncc(Cc2ccccc2F)s1)c1c([O-])cccc1Cl ZINC000920455315 1123459537 /nfs/dbraw/zinc/45/95/37/1123459537.db2.gz SFIDNDXWHSHFOA-UHFFFAOYSA-N -1 0 362.813 4.484 20 0 FIADRM CC(C)c1ccc(-c2nc(C(=O)N3CC[C@H](C(=O)[O-])[C@H](C)C3)cs2)cc1 ZINC000263100066 1123511487 /nfs/dbraw/zinc/51/14/87/1123511487.db2.gz VWWAOWAEOJDHDG-CJNGLKHVSA-N -1 0 372.490 4.116 20 0 FIADRM CC(C)Oc1ccc(Cl)cc1C(=O)Nc1ccc(CCC(=O)[O-])cc1 ZINC000236651638 1123543186 /nfs/dbraw/zinc/54/31/86/1123543186.db2.gz PRCUFEHBNSCYKB-UHFFFAOYSA-N -1 0 361.825 4.397 20 0 FIADRM CC(C)[C@@H](NC(=O)c1ccc(C(=O)[O-])o1)c1cccc(C(F)(F)F)c1 ZINC000236661867 1123544453 /nfs/dbraw/zinc/54/44/53/1123544453.db2.gz MPDMJNGGUMBYOC-CQSZACIVSA-N -1 0 355.312 4.124 20 0 FIADRM CC(C)c1ccc(C2(C(=O)NC3CCC(C(=O)[O-])CC3)CCCC2)cc1 ZINC000236705890 1123552048 /nfs/dbraw/zinc/55/20/48/1123552048.db2.gz DTNZLYXGANQKGP-UHFFFAOYSA-N -1 0 357.494 4.381 20 0 FIADRM CCC(CC)n1nccc1C(=O)Nc1ccc2sc(C(=O)[O-])cc2c1 ZINC000236739255 1123558319 /nfs/dbraw/zinc/55/83/19/1123558319.db2.gz BZGCAWROHCDTFO-UHFFFAOYSA-N -1 0 357.435 4.409 20 0 FIADRM CCC(CC)(CNC(=O)C[C@H](C)c1ccc(C(F)(F)F)cc1)C(=O)[O-] ZINC000236845327 1123574387 /nfs/dbraw/zinc/57/43/87/1123574387.db2.gz ZLBOIIYZXKRAMK-LBPRGKRZSA-N -1 0 359.388 4.206 20 0 FIADRM CCC(CC)(CNC(=O)[C@@H]1C[C@@H]1c1cccc(Cl)c1Cl)C(=O)[O-] ZINC000236860862 1123578456 /nfs/dbraw/zinc/57/84/56/1123578456.db2.gz ASSCQIJTALCIKG-VXGBXAGGSA-N -1 0 358.265 4.104 20 0 FIADRM CCC(CC)(CNC(=O)[C@H]1C[C@@H]1c1cccc(Cl)c1Cl)C(=O)[O-] ZINC000236870138 1123579995 /nfs/dbraw/zinc/57/99/95/1123579995.db2.gz ASSCQIJTALCIKG-NEPJUHHUSA-N -1 0 358.265 4.104 20 0 FIADRM CC[C@H](CC(=O)Nc1ccc(OCCCC(=O)[O-])cc1)c1ccccc1 ZINC000236939182 1123584976 /nfs/dbraw/zinc/58/49/76/1123584976.db2.gz KMNYAQFJDIZIBS-MRXNPFEDSA-N -1 0 355.434 4.453 20 0 FIADRM CCC(CC)(CC(=O)Nc1c(C)cc(C)cc1Br)C(=O)[O-] ZINC000134032270 1123585917 /nfs/dbraw/zinc/58/59/17/1123585917.db2.gz WOAQVQHBPPNWFZ-UHFFFAOYSA-N -1 0 356.260 4.286 20 0 FIADRM CC[C@@H](C)N(CC(=O)[O-])C(=O)c1cc(SC)c(Cl)cc1Cl ZINC000237056071 1123592211 /nfs/dbraw/zinc/59/22/11/1123592211.db2.gz ZNBFFWBLBNHRBF-MRVPVSSYSA-N -1 0 350.267 4.041 20 0 FIADRM CN(Cc1cc(Cl)cc(Cl)c1)C(=O)CCc1ccc(C(=O)[O-])cc1 ZINC000237253341 1123609424 /nfs/dbraw/zinc/60/94/24/1123609424.db2.gz ASVZNZGGFZZYPF-UHFFFAOYSA-N -1 0 366.244 4.283 20 0 FIADRM CSc1ccc([C@H](CC(=O)[O-])NC(=O)c2ccc(Cl)s2)cc1 ZINC000237362617 1123622945 /nfs/dbraw/zinc/62/29/45/1123622945.db2.gz FRPQZQJOGWNMJB-NSHDSACASA-N -1 0 355.868 4.069 20 0 FIADRM Cc1nc(-c2ccc(C)cc2C)sc1C(=O)N(C[C@@H](C)C(=O)[O-])C1CC1 ZINC000237390359 1123627342 /nfs/dbraw/zinc/62/73/42/1123627342.db2.gz KCEDSHRCHVQKHM-CYBMUJFWSA-N -1 0 372.490 4.061 20 0 FIADRM C[C@@H](Oc1cc(Cl)cc(Cl)c1)C(=O)Nc1cc(C(=O)[O-])ccc1F ZINC000237435304 1123629811 /nfs/dbraw/zinc/62/98/11/1123629811.db2.gz UJJWMDGQCXGISP-MRVPVSSYSA-N -1 0 372.179 4.237 20 0 FIADRM Cc1cccc([C@H](C)C(=O)N[C@H](CC(=O)[O-])c2ccc(Cl)c(F)c2)c1 ZINC000237445425 1123630558 /nfs/dbraw/zinc/63/05/58/1123630558.db2.gz BIQSOAMIYFPRMG-YVEFUNNKSA-N -1 0 363.816 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1123658203 /nfs/dbraw/zinc/65/82/03/1123658203.db2.gz UFOIGOVFOHNXLE-UHFFFAOYSA-N -1 0 354.431 4.264 20 0 FIADRM Cc1ccc2[nH]cc(CCC(=O)Nc3ccc(CCC(=O)[O-])cc3)c2c1 ZINC000237862743 1123662461 /nfs/dbraw/zinc/66/24/61/1123662461.db2.gz WICQGYOCWDKRIP-UHFFFAOYSA-N -1 0 350.418 4.065 20 0 FIADRM O=C([O-])CCCN(Cc1ccccc1)C(=O)Cc1cccc2ccccc21 ZINC000237937277 1123669439 /nfs/dbraw/zinc/66/94/39/1123669439.db2.gz AWJFWONNHUVTEG-UHFFFAOYSA-N -1 0 361.441 4.276 20 0 FIADRM O=C([O-])C[C@H](NC(=O)Cc1ccccc1Cl)c1ccc(Cl)c(F)c1 ZINC000237943097 1123669589 /nfs/dbraw/zinc/66/95/89/1123669589.db2.gz MQVHNBZBOXAMHU-HNNXBMFYSA-N -1 0 370.207 4.007 20 0 FIADRM O=C([O-])CCCN(Cc1ccccc1)C(=O)c1cc2ccc(Cl)cc2[nH]1 ZINC000237950486 1123670164 /nfs/dbraw/zinc/67/01/64/1123670164.db2.gz XOZYUTJPSQLKBM-UHFFFAOYSA-N -1 0 370.836 4.329 20 0 FIADRM O=C([O-])COc1ccc(NC(=O)c2ccccc2C(F)(F)F)cc1Cl ZINC000237966691 1123671456 /nfs/dbraw/zinc/67/14/56/1123671456.db2.gz GRBMVFPKSGXYNP-UHFFFAOYSA-N -1 0 373.714 4.075 20 0 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Cc1cc(C(=O)NCCCCCCC(=O)[O-])c(C)n1[C@H](C)c1ccccc1 ZINC000237766525 1124065214 /nfs/dbraw/zinc/06/52/14/1124065214.db2.gz BXWJTOBHQAHYJN-QGZVFWFLSA-N -1 0 370.493 4.479 20 0 FIADRM Cc1cc(OCc2ccccc2)ccc1NC(=O)CC(C)(C)CC(=O)[O-] ZINC000237776478 1124072432 /nfs/dbraw/zinc/07/24/32/1124072432.db2.gz LNXAFDVAKAKXOD-UHFFFAOYSA-N -1 0 355.434 4.404 20 0 FIADRM Cc1[nH]c2ccccc2c1C(=O)C(C#N)=C([O-])c1ccc(C2(C#N)CC2)cc1 ZINC000179833495 1124115481 /nfs/dbraw/zinc/11/54/81/1124115481.db2.gz MZMGWSKWJGOTPD-SFHVURJKSA-N -1 0 367.408 4.237 20 0 FIADRM CC(C)(C)OCc1cc(C(=O)Nc2cscc2Br)no1 ZINC000615734683 1124116498 /nfs/dbraw/zinc/11/64/98/1124116498.db2.gz NIFMNSBJLJNLOW-UHFFFAOYSA-N -1 0 359.245 4.066 20 0 FIADRM C[C@H](c1ccco1)N(C)C(=O)N=c1nc(-c2cccc(Cl)c2)[n-]s1 ZINC000542729068 1124167786 /nfs/dbraw/zinc/16/77/86/1124167786.db2.gz OVUTYTVSPCSFHA-SNVBAGLBSA-N -1 0 362.842 4.098 20 0 FIADRM Cc1nc(-c2ccccc2)sc1[C@H](C)NC(=O)[C@H]1CCC[C@H](C(=O)[O-])C1 ZINC000179980215 1124168644 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/nfs/dbraw/zinc/92/64/50/1090926450.db2.gz MTUYGWVCVDKQJM-HNNXBMFYSA-N -1 0 350.871 4.288 20 0 FIADRM CCCn1c(CNc2ccc(CCCC(=O)[O-])cc2)nc2ccccc21 ZINC000417580898 1090930892 /nfs/dbraw/zinc/93/08/92/1090930892.db2.gz FARXCUHJPJGAMY-UHFFFAOYSA-N -1 0 351.450 4.466 20 0 FIADRM COc1cccc([C@H](CC(=O)[O-])NCc2cc(Cl)sc2Cl)c1 ZINC000417581090 1090931682 /nfs/dbraw/zinc/93/16/82/1090931682.db2.gz GWDOTZZWYKMRGN-LBPRGKRZSA-N -1 0 360.262 4.369 20 0 FIADRM COc1cc2c(c(CNc3ccc([C@H](C)CC(=O)[O-])cc3)c1)O[C@H](C)C2 ZINC000417606321 1090937029 /nfs/dbraw/zinc/93/70/29/1090937029.db2.gz DIELUBVHKLIGBR-ZIAGYGMSSA-N -1 0 355.434 4.209 20 0 FIADRM COc1cc(CNc2ccc(C[C@H](C)C(=O)[O-])cc2)ccc1OC(F)F ZINC000417607361 1090937796 /nfs/dbraw/zinc/93/77/96/1090937796.db2.gz GMXHSGGRWQDBSQ-LBPRGKRZSA-N -1 0 365.376 4.172 20 0 FIADRM CSc1cc2c(cc1CNc1ccc(C[C@H](C)C(=O)[O-])cc1)OCCO2 ZINC000417607587 1090937929 /nfs/dbraw/zinc/93/79/29/1090937929.db2.gz GROKDBWWQBJKKG-ZDUSSCGKSA-N -1 0 373.474 4.055 20 0 FIADRM C[C@@H](Cc1ccc(NCc2cc(Br)cs2)cc1)C(=O)[O-] ZINC000417608178 1090938261 /nfs/dbraw/zinc/93/82/61/1090938261.db2.gz IBWCSXDQXXFWCK-JTQLQIEISA-N -1 0 354.269 4.386 20 0 FIADRM COc1cccc(CNc2ccc(C[C@H](C)C(=O)[O-])cc2)c1OC(C)C ZINC000417609607 1090938346 /nfs/dbraw/zinc/93/83/46/1090938346.db2.gz LNYJJCTXYYAMJV-HNNXBMFYSA-N -1 0 357.450 4.358 20 0 FIADRM C[C@@H](Cc1ccc(NCc2ccc(Br)s2)cc1)C(=O)[O-] ZINC000417609618 1090938521 /nfs/dbraw/zinc/93/85/21/1090938521.db2.gz LOVXNWZVSXJZGX-JTQLQIEISA-N -1 0 354.269 4.386 20 0 FIADRM COc1cc2c(c(CNc3ccccc3CCCC(=O)[O-])c1)O[C@H](C)C2 ZINC000417620751 1090941287 /nfs/dbraw/zinc/94/12/87/1090941287.db2.gz JURAKKAEKGGEKL-CQSZACIVSA-N -1 0 355.434 4.038 20 0 FIADRM COc1ccc(CCC(=O)[O-])cc1NCC1CCC(C(F)(F)F)CC1 ZINC000417620606 1090941539 /nfs/dbraw/zinc/94/15/39/1090941539.db2.gz DGADTFPJBGTVIW-UHFFFAOYSA-N -1 0 359.388 4.493 20 0 FIADRM C[C@@H](Cc1ccc(NCc2nc3cc(Cl)ccc3n2C)cc1)C(=O)[O-] ZINC000417614411 1090943869 /nfs/dbraw/zinc/94/38/69/1090943869.db2.gz VPAZOLHOXRJPGY-LBPRGKRZSA-N -1 0 357.841 4.102 20 0 FIADRM COc1cc(CNc2ccc(C[C@@H](C)C(=O)[O-])cc2)cc(Cl)c1OC ZINC000417614826 1090943940 /nfs/dbraw/zinc/94/39/40/1090943940.db2.gz VWCPVCLGJTVOOJ-GFCCVEGCSA-N -1 0 363.841 4.233 20 0 FIADRM C[C@@H](Cc1ccc(NCc2cn(C)nc2-c2cccs2)cc1)C(=O)[O-] ZINC000417616364 1090944404 /nfs/dbraw/zinc/94/44/04/1090944404.db2.gz YTWJEIBBQVXFDQ-ZDUSSCGKSA-N -1 0 355.463 4.024 20 0 FIADRM CC(C)=CCSC[C@H](NCc1csc(-c2cccs2)n1)C(=O)[O-] ZINC000417631678 1090945634 /nfs/dbraw/zinc/94/56/34/1090945634.db2.gz WAASELHGPWGVQY-ZDUSSCGKSA-N -1 0 368.549 4.114 20 0 FIADRM O=C([O-])c1csc(Cc2ccc(NCc3csc(C4CC4)n3)cc2)n1 ZINC000417626012 1090947612 /nfs/dbraw/zinc/94/76/12/1090947612.db2.gz SHTPKJORNSDREA-UHFFFAOYSA-N -1 0 371.487 4.378 20 0 FIADRM O=C([O-])c1ccc(CNCc2ccc(Cl)cc2Cl)nc1C1CC1 ZINC000417696989 1090963758 /nfs/dbraw/zinc/96/37/58/1090963758.db2.gz CYLCPNWCZGZMBH-UHFFFAOYSA-N -1 0 351.233 4.254 20 0 FIADRM Cc1cc(N2CCCC2)ccc1NC(=O)Nc1cccc(CCC(=O)[O-])c1 ZINC000417724625 1090970884 /nfs/dbraw/zinc/97/08/84/1090970884.db2.gz ILRHMAYUKWXLNB-UHFFFAOYSA-N -1 0 367.449 4.256 20 0 FIADRM Cc1nc2ccc(Br)cn2c1Nc1ccc(C(=O)[O-])c(C)c1 ZINC001211654955 1091042313 /nfs/dbraw/zinc/04/23/13/1091042313.db2.gz GPXIWIOKFFDVFF-UHFFFAOYSA-N -1 0 360.211 4.155 20 0 FIADRM O=S(=O)(NCC1CCSCC1)c1c(Cl)cc(Cl)cc1Cl ZINC000500120519 1091051840 /nfs/dbraw/zinc/05/18/40/1091051840.db2.gz HQCSYFHIFHVZNV-UHFFFAOYSA-N -1 0 374.742 4.068 20 0 FIADRM Cc1c(O)ccc2c(CNc3ccc(NC(=O)C(C)C)cc3)cc(=O)oc12 ZINC000025426818 1091177958 /nfs/dbraw/zinc/17/79/58/1091177958.db2.gz UHQVZGFQKPTZMJ-UHFFFAOYSA-N -1 0 366.417 4.014 20 0 FIADRM C[C@@H](Cc1ccc(NC(=O)C[C@H]2CCCc3ccccc32)cc1)C(=O)[O-] ZINC000431983088 1091518525 /nfs/dbraw/zinc/51/85/25/1091518525.db2.gz SWYWCMOEMVHVLF-MAUKXSAKSA-N -1 0 351.446 4.399 20 0 FIADRM C[C@H](CCc1cccc(F)c1)C(=O)Nc1ccc(C[C@H](C)C(=O)[O-])cc1 ZINC000431993406 1091526398 /nfs/dbraw/zinc/52/63/98/1091526398.db2.gz IIPAFIJDSCBHMP-CABCVRRESA-N -1 0 357.425 4.296 20 0 FIADRM C[C@@H](Cc1ccc(NC(=O)CSc2ccccc2Cl)cc1)C(=O)[O-] ZINC000431993778 1091526422 /nfs/dbraw/zinc/52/64/22/1091526422.db2.gz IZRMOBSNPAWCFZ-LBPRGKRZSA-N -1 0 363.866 4.334 20 0 FIADRM C[C@H](Cc1ccc(NC(=O)[C@H]2C[C@@H]2c2cccc(Cl)c2)cc1)C(=O)[O-] ZINC000431995964 1091529430 /nfs/dbraw/zinc/52/94/30/1091529430.db2.gz QXWFVGWQFSLFCZ-PJSAGSTRSA-N -1 0 357.837 4.345 20 0 FIADRM C[C@H](Cc1ccc(NC(=O)C2=Cc3cc(Cl)ccc3OC2)cc1)C(=O)[O-] ZINC000431998296 1091531065 /nfs/dbraw/zinc/53/10/65/1091531065.db2.gz FANFQYDKNQJTPU-GFCCVEGCSA-N -1 0 371.820 4.018 20 0 FIADRM CC(C)COc1ccc(C(=O)Nc2ccc(C[C@H](C)C(=O)[O-])cc2)cc1 ZINC000431999009 1091532627 /nfs/dbraw/zinc/53/26/27/1091532627.db2.gz BGSZWBDYFMKUEE-HNNXBMFYSA-N -1 0 355.434 4.237 20 0 FIADRM CC[C@H](O[C@@H]1CCC[C@@H](C)C1)C(=O)Nc1ccc(C[C@H](C)C(=O)[O-])cc1 ZINC000432002857 1091539174 /nfs/dbraw/zinc/53/91/74/1091539174.db2.gz XTWVHFNKTMLKFS-OHQAAIJDSA-N -1 0 361.482 4.262 20 0 FIADRM Cc1ccc(C)c(SCC(=O)Nc2ccc(C[C@H](C)C(=O)[O-])cc2)c1 ZINC000432008685 1091545243 /nfs/dbraw/zinc/54/52/43/1091545243.db2.gz RPCOHMZNVNQSID-HNNXBMFYSA-N -1 0 357.475 4.297 20 0 FIADRM O=C([O-])COc1cccc(C(=O)N2CCc3cc(-c4ccccc4)ccc32)c1 ZINC000432089770 1091643470 /nfs/dbraw/zinc/64/34/70/1091643470.db2.gz AZYZXMWHHCPVKG-UHFFFAOYSA-N -1 0 373.408 4.020 20 0 FIADRM O=C([O-])c1ccc(C(=O)Nc2ccc(F)cc2Nc2ccccc2F)cn1 ZINC000432089705 1091644135 /nfs/dbraw/zinc/64/41/35/1091644135.db2.gz PHVJQNCPQNRCSY-UHFFFAOYSA-N -1 0 369.327 4.054 20 0 FIADRM CCSCc1ccc(C(=O)N[C@@H](CCC(=O)[O-])Cc2ccccc2)cc1 ZINC000432101886 1091661944 /nfs/dbraw/zinc/66/19/44/1091661944.db2.gz FCXTYEDIBXNJAR-IBGZPJMESA-N -1 0 371.502 4.146 20 0 FIADRM C[C@H](NC(=O)c1ccc(C(=O)[O-])o1)c1ccc(-c2ccc(F)cc2)cc1 ZINC000432111244 1091678964 /nfs/dbraw/zinc/67/89/64/1091678964.db2.gz WRBNNILGPGTMKM-LBPRGKRZSA-N -1 0 353.349 4.275 20 0 FIADRM Cc1cc(CCCC(=O)N[C@H](CCC(=O)[O-])Cc2ccccc2)c(C)s1 ZINC000432128473 1091706222 /nfs/dbraw/zinc/70/62/22/1091706222.db2.gz YDPDKDFGHRZQKF-LJQANCHMSA-N 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ZINC000652122440 1091749042 /nfs/dbraw/zinc/74/90/42/1091749042.db2.gz WOKYYQDBZPNLKT-QAQDUYKDSA-N -1 0 353.418 4.095 20 0 FIADRM Cc1cc(Br)cc(C)c1NC(=O)CC1(C(=O)[O-])CCCCC1 ZINC000047495754 1091768954 /nfs/dbraw/zinc/76/89/54/1091768954.db2.gz FWZVFAGYGWBLII-UHFFFAOYSA-N -1 0 368.271 4.430 20 0 FIADRM Cc1cc(Nc2cc(C(=O)NCC(C)C)ccc2Cl)ccc1C(=O)[O-] ZINC001211660570 1091776274 /nfs/dbraw/zinc/77/62/74/1091776274.db2.gz ALXPYEAYDBYQCY-UHFFFAOYSA-N -1 0 360.841 4.476 20 0 FIADRM Cc1ccc(C(F)(F)F)cc1NC(=O)N1CCC(CCC(=O)[O-])CC1 ZINC000327285493 1091939025 /nfs/dbraw/zinc/93/90/25/1091939025.db2.gz WRVULJHEPUONKW-UHFFFAOYSA-N -1 0 358.360 4.123 20 0 FIADRM CC(C)(C)c1ccc(SCC(=O)N2CCC[C@H](CCC(=O)[O-])C2)cc1 ZINC000236600728 1091996829 /nfs/dbraw/zinc/99/68/29/1091996829.db2.gz PSHSTZZBYHCLJQ-OAHLLOKOSA-N -1 0 363.523 4.180 20 0 FIADRM Cc1ccc(C(=O)N=c2[n-]nc([C@H]3CCCc4ccccc43)s2)s1 ZINC000432637013 1092021177 /nfs/dbraw/zinc/02/11/77/1092021177.db2.gz ZCXUJJLSZWWOAO-AWEZNQCLSA-N -1 0 355.488 4.050 20 0 FIADRM Cc1cc(F)c(Nc2ccc(NC(=O)CCC(=O)[O-])cc2)cc1Cl ZINC001213193990 1092045990 /nfs/dbraw/zinc/04/59/90/1092045990.db2.gz BLKVAMRDIKMCLA-UHFFFAOYSA-N -1 0 350.777 4.334 20 0 FIADRM Cc1ncc([N-]S(=O)(=O)c2ccc(CCC(C)C)cc2)c(C2CC2)n1 ZINC000500547550 1092214176 /nfs/dbraw/zinc/21/41/76/1092214176.db2.gz RQWVWVQGPQVVQO-UHFFFAOYSA-N -1 0 359.495 4.052 20 0 FIADRM CC(C)(C(=O)[O-])[C@@H]1CCCN(C(=O)CCSc2ccccc2Cl)C1 ZINC000325463109 1092305389 /nfs/dbraw/zinc/30/53/89/1092305389.db2.gz RNYUALDKYPPEKG-CYBMUJFWSA-N -1 0 369.914 4.172 20 0 FIADRM COc1cc(C)c(S(=O)(=O)Nc2ccc3ncsc3c2)cc1Cl ZINC000432772459 1092313159 /nfs/dbraw/zinc/31/31/59/1092313159.db2.gz USDYEBQMXQXMGF-UHFFFAOYSA-N -1 0 368.867 4.068 20 0 FIADRM CC(=O)Nc1ccc(S(=O)(=O)Nc2cccc(C)c2F)c2ccccc12 ZINC000182419876 1092315215 /nfs/dbraw/zinc/31/52/15/1092315215.db2.gz JUBVCGRKEKLPTA-UHFFFAOYSA-N -1 0 372.421 4.047 20 0 FIADRM CC(C)c1cc(C(=O)Nc2ccc(C(=O)[O-])cc2)c2cnn(C(C)C)c2n1 ZINC000500650440 1092321072 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O=S(=O)(N[C@H](c1ccccc1)C(F)F)c1csc2ccccc21 ZINC000431620698 1087676748 /nfs/dbraw/zinc/67/67/48/1087676748.db2.gz AXXSPMIOHGNCJZ-OAHLLOKOSA-N -1 0 353.415 4.186 20 0 FIADRM O=C([O-])CC[C@@H]1CCCN(C(=O)CCCc2ccc3ccccc3c2)C1 ZINC000191209058 1087703474 /nfs/dbraw/zinc/70/34/74/1087703474.db2.gz NZHVHWDFRPCMNJ-SFHVURJKSA-N -1 0 353.462 4.266 20 0 FIADRM Cc1ccc([N-]S(=O)(=O)c2c(C)c(Cl)cc(C)c2Cl)c(O)c1 ZINC000612037746 1087714450 /nfs/dbraw/zinc/71/44/50/1087714450.db2.gz CLSJHTYSCNELTL-UHFFFAOYSA-N -1 0 360.262 4.425 20 0 FIADRM O=S(=O)([N-]c1ccccc1N1CCCCC1)c1ccc(Cl)cc1F ZINC000612058675 1087727104 /nfs/dbraw/zinc/72/71/04/1087727104.db2.gz LXEFJNNWDOWEMR-UHFFFAOYSA-N -1 0 368.861 4.270 20 0 FIADRM Cc1nc(C=Cc2sc3ccccc3c2Cl)[nH]c(=O)c1CC(=O)[O-] ZINC000504713610 1087797813 /nfs/dbraw/zinc/79/78/13/1087797813.db2.gz XRRFYELSDMGDFB-SREVYHEPSA-N -1 0 360.822 4.156 20 0 FIADRM Cc1nc(C=Cc2ccc(-c3cccc(F)c3)s2)[nH]c(=O)c1CC(=O)[O-] ZINC000504728678 1087826157 /nfs/dbraw/zinc/82/61/57/1087826157.db2.gz GCHHRQAPTSHYBL-VURMDHGXSA-N -1 0 370.405 4.156 20 0 FIADRM Cc1nc(C=Cc2cc(-c3ccccc3)cs2)[nH]c(=O)c1CC(=O)[O-] ZINC000504728214 1087826309 /nfs/dbraw/zinc/82/63/09/1087826309.db2.gz ALWLDQUANSJOFA-BQYQJAHWSA-N -1 0 352.415 4.017 20 0 FIADRM CCC(CC)(CNC(=O)Nc1cc(-c2cccnc2)ccc1C)C(=O)[O-] ZINC000424388199 1087970553 /nfs/dbraw/zinc/97/05/53/1087970553.db2.gz JPJATDRRLAIQDD-UHFFFAOYSA-N -1 0 355.438 4.070 20 0 FIADRM CC(C)Sc1ccc([C@H](C)NC(=O)NCCC(C)(C)C(=O)[O-])cc1 ZINC000424408618 1087979865 /nfs/dbraw/zinc/97/98/65/1087979865.db2.gz LTFWAUXYNVFUSS-ZDUSSCGKSA-N -1 0 352.500 4.048 20 0 FIADRM COCc1cc(Cl)ccc1NC(=O)CC1(C(=O)[O-])CCCCCC1 ZINC000424541978 1088045866 /nfs/dbraw/zinc/04/58/66/1088045866.db2.gz VUNHSECSCSJMDX-UHFFFAOYSA-N -1 0 353.846 4.240 20 0 FIADRM CSc1cc(NS(=O)(=O)Cc2cc(C(C)(C)C)on2)ccc1Cl ZINC000414393184 1088135888 /nfs/dbraw/zinc/13/58/88/1088135888.db2.gz FTSYAZMZKRVCKM-UHFFFAOYSA-N -1 0 374.915 4.289 20 0 FIADRM Cc1oc(C(=O)[O-])cc1C(=O)N(Cc1ccc(C(F)(F)F)cc1)C1CC1 ZINC000659118140 1088143882 /nfs/dbraw/zinc/14/38/82/1088143882.db2.gz AOZYFVDOFUBPBE-UHFFFAOYSA-N -1 0 367.323 4.110 20 0 FIADRM Cc1cc(OCC(=O)[O-])ccc1NC(=O)[C@@H]1CCC[C@@H]1Cc1ccccc1 ZINC000659132063 1088181946 /nfs/dbraw/zinc/18/19/46/1088181946.db2.gz ZBNPNPBAODAQPF-IEBWSBKVSA-N -1 0 367.445 4.056 20 0 FIADRM CC(C)C[C@@H](C(=O)NC1CCC(C(=O)[O-])CC1)c1ccc(Cl)cc1 ZINC000659130073 1088182438 /nfs/dbraw/zinc/18/24/38/1088182438.db2.gz CVCYTYRPQOXMLS-BDVYOWHSSA-N -1 0 351.874 4.229 20 0 FIADRM Cc1ccc(NC(=O)C2CC2)cc1NC(=O)c1cc(F)cc(Cl)c1[O-] ZINC000177067449 1088195330 /nfs/dbraw/zinc/19/53/30/1088195330.db2.gz LXOYMMVRDHGWBW-UHFFFAOYSA-N -1 0 362.788 4.094 20 0 FIADRM O=C(Nc1ccc(-c2cn3c(n2)CCCC3)cc1)c1cc(F)c([O-])c(F)c1 ZINC000177094900 1088208851 /nfs/dbraw/zinc/20/88/51/1088208851.db2.gz SINRAUDWGOKLJI-UHFFFAOYSA-N -1 0 369.371 4.123 20 0 FIADRM O=C(c1c([O-])cc(Cl)cc1Cl)N1CCO[C@@H](c2cccc(F)c2)C1 ZINC000177144320 1088226820 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351.874 4.039 20 0 FIADRM C[C@@H]1CN(C(=O)[C@H](c2ccccc2)c2ccc(Cl)cc2)CC[C@@H]1C(=O)[O-] ZINC000659225810 1088309617 /nfs/dbraw/zinc/30/96/17/1088309617.db2.gz SLNSQDNXUZKFSF-MDASCCDHSA-N -1 0 371.864 4.041 20 0 FIADRM CCc1cc(C(=O)N2CC[C@H](C(=O)[O-])[C@H](C)C2)sc1-c1ccccc1 ZINC000659225776 1088309966 /nfs/dbraw/zinc/30/99/66/1088309966.db2.gz RGOWWFVXOIGCOJ-CJNGLKHVSA-N -1 0 357.475 4.160 20 0 FIADRM CCN(C(=O)c1cc(C(=O)[O-])co1)[C@@H](C)Cc1ccc(C(F)(F)F)cc1 ZINC000659232794 1088335919 /nfs/dbraw/zinc/33/59/19/1088335919.db2.gz PEIVDURDQMZNBK-NSHDSACASA-N -1 0 369.339 4.090 20 0 FIADRM CCSc1cccc([N-]S(=O)(=O)c2cccc3cc(C)cnc32)c1 ZINC000505315819 1088346834 /nfs/dbraw/zinc/34/68/34/1088346834.db2.gz DDXVUUJLQYSEQS-UHFFFAOYSA-N -1 0 358.488 4.456 20 0 FIADRM O=S(=O)([N-]c1ccc(Cl)cc1O)c1cccc(Cl)c1Cl ZINC000513819531 1088414452 /nfs/dbraw/zinc/41/44/52/1088414452.db2.gz YNQJDXKOZKODMH-UHFFFAOYSA-N -1 0 352.626 4.153 20 0 FIADRM Cc1ccc2c(n1)[n-]cc(C(=O)N1CC3(CCCC3)c3ccccc31)c2=O ZINC000434299114 1088485205 /nfs/dbraw/zinc/48/52/05/1088485205.db2.gz JLKIQRPHMOVMOW-UHFFFAOYSA-N -1 0 359.429 4.116 20 0 FIADRM CCCCCc1n[n-]c(=NC(=O)N(Cc2cccs2)C(C)C)s1 ZINC000513950426 1088560097 /nfs/dbraw/zinc/56/00/97/1088560097.db2.gz QRKVSBRUTNSZKO-UHFFFAOYSA-N -1 0 352.529 4.197 20 0 FIADRM O=C([O-])CCC1CCN(C(=O)NCCCCc2ccc(Cl)s2)CC1 ZINC000659402273 1088584969 /nfs/dbraw/zinc/58/49/69/1088584969.db2.gz CUZRIOBDCCPTCH-UHFFFAOYSA-N -1 0 372.918 4.011 20 0 FIADRM C[C@@H](NC(=O)NCCCC(=O)[O-])c1ccc(O[C@@H](C)c2ccccc2)cc1 ZINC000659406923 1088591041 /nfs/dbraw/zinc/59/10/41/1088591041.db2.gz SUMIWISYCKRGMA-CVEARBPZSA-N -1 0 370.449 4.052 20 0 FIADRM O=C(c1cc(F)cc(Cl)c1[O-])N1CCc2[nH]c3ccc(F)cc3c2C1 ZINC000178479813 1088611062 /nfs/dbraw/zinc/61/10/62/1088611062.db2.gz KRLDISYZHKGVDU-UHFFFAOYSA-N -1 0 362.763 4.004 20 0 FIADRM Cc1ccc(-c2[n-][nH]c(=NC(=O)c3cccc(-c4cscn4)c3)c2C)o1 ZINC000434433106 1088621533 /nfs/dbraw/zinc/62/15/33/1088621533.db2.gz OPTPKUNYHONAGC-UHFFFAOYSA-N -1 0 364.430 4.084 20 0 FIADRM Cc1ccc(-c2[n-][nH]c(=NC(=O)[C@@H]3C[C@@H]3c3ccc([C@H]4C[C@H]4C)o3)c2C)o1 ZINC000434504463 1088686144 /nfs/dbraw/zinc/68/61/44/1088686144.db2.gz UMKREPYIMVRDJZ-SDJAHQOYSA-N -1 0 365.433 4.167 20 0 FIADRM O=C(c1ccc(C(F)(F)F)cc1O)N(Cc1ccco1)Cc1ccco1 ZINC000180360107 1088771811 /nfs/dbraw/zinc/77/18/11/1088771811.db2.gz SLQKOALQPAWCKT-UHFFFAOYSA-N -1 0 365.307 4.440 20 0 FIADRM O=C([O-])c1ccc(NCc2ccc(Oc3ccc(Cl)cc3)cc2)nn1 ZINC001167712246 1088839781 /nfs/dbraw/zinc/83/97/81/1088839781.db2.gz IYJIXHMFTIGOJT-UHFFFAOYSA-N -1 0 355.781 4.233 20 0 FIADRM CCN(C(=O)NCCCCCC(=O)[O-])[C@H](C)c1cccc(C(F)(F)F)c1 ZINC000414604439 1088841790 /nfs/dbraw/zinc/84/17/90/1088841790.db2.gz AWNJFGVCZGCVSH-CYBMUJFWSA-N -1 0 374.403 4.443 20 0 FIADRM O=C([O-])[C@@H]1C[N@H+](Cc2nc3ccccc3s2)C[C@H]1c1ccc(Cl)cc1 ZINC000659797420 1088873195 /nfs/dbraw/zinc/87/31/95/1088873195.db2.gz SXNAQXYBZDTEEK-LSDHHAIUSA-N -1 0 372.877 4.250 20 0 FIADRM O=C([O-])c1ccc(C[N@@H+]2CC[C@@]3(C2)CCc2ccccc2O3)cc1Cl ZINC000659795840 1088878781 /nfs/dbraw/zinc/87/87/81/1088878781.db2.gz GQANPDVOTDUAIF-HXUWFJFHSA-N -1 0 357.837 4.008 20 0 FIADRM O=C([O-])[C@H](c1cc(Cl)cc(Cl)c1)N1CCOC(C2CC2)(C2CC2)C1 ZINC000659799891 1088882550 /nfs/dbraw/zinc/88/25/50/1088882550.db2.gz JUOJUOBHNAHLNS-INIZCTEOSA-N -1 0 370.276 4.010 20 0 FIADRM CC(C)Sc1ccc([C@@H](C)NC(=O)NCCCCCC(=O)[O-])cc1 ZINC000414618953 1088905319 /nfs/dbraw/zinc/90/53/19/1088905319.db2.gz SERFEWYPMNZNJQ-CQSZACIVSA-N -1 0 352.500 4.192 20 0 FIADRM C[C@@H](NC(=O)N(C)CCCC(=O)[O-])c1ccc(Oc2ccccc2)c(F)c1 ZINC000414624206 1088909746 /nfs/dbraw/zinc/90/97/46/1088909746.db2.gz YAJVRVUVUSVBTE-CQSZACIVSA-N -1 0 374.412 4.185 20 0 FIADRM Cc1ccsc1[C@H](Cc1ccccc1)NC(=O)NCCCCCC(=O)[O-] ZINC000414635002 1088913089 /nfs/dbraw/zinc/91/30/89/1088913089.db2.gz ZGSCAWJYBLGNTL-KRWDZBQOSA-N -1 0 374.506 4.285 20 0 FIADRM O=C([O-])CCCCCNC(=O)N1CCC(c2cccc3ccccc32)CC1 ZINC000414630879 1088914355 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FIADRM COc1ccc(OC(C)C)c([N-]S(=O)(=O)c2ccc(C(F)F)cc2)c1 ZINC000514628240 1089283230 /nfs/dbraw/zinc/28/32/30/1089283230.db2.gz CXWUGTKQVLKIGM-UHFFFAOYSA-N -1 0 371.405 4.221 20 0 FIADRM CCCCc1n[n-]c(=NC(=O)N2CC[C@H](C)[C@H]2c2cccc(F)c2)s1 ZINC000472755679 1089302908 /nfs/dbraw/zinc/30/29/08/1089302908.db2.gz XJAQIPRBGVNFFI-LRDDRELGSA-N -1 0 362.474 4.057 20 0 FIADRM CC(C)n1ncc2c1nc(/C=C\c1cnn(-c3ccccc3)c1)cc2C(=O)[O-] ZINC000514664940 1089338891 /nfs/dbraw/zinc/33/88/91/1089338891.db2.gz PWXDTQKNVOIXPE-HJWRWDBZSA-N -1 0 373.416 4.067 20 0 FIADRM CCCCCc1n[n-]c(=NC(=O)N(Cc2ccc(F)cc2)C(C)C)s1 ZINC000510019223 1089364241 /nfs/dbraw/zinc/36/42/41/1089364241.db2.gz MDLIHKOMXGGTDB-UHFFFAOYSA-N -1 0 364.490 4.274 20 0 FIADRM Cc1noc(C)c1S(=O)(=O)[N-]c1ccccc1SC1CCCC1 ZINC000032094447 1089423775 /nfs/dbraw/zinc/42/37/75/1089423775.db2.gz FNVDIPFQQMXQKZ-UHFFFAOYSA-N -1 0 352.481 4.127 20 0 FIADRM FC(F)(F)c1cc(CN=c2[n-]ncn2Cc2ccccc2)ccc1Cl ZINC000514769441 1089451966 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ZINC000432001962 1091538119 /nfs/dbraw/zinc/53/81/19/1091538119.db2.gz SPOXCAZTXGXJAW-CYBMUJFWSA-N -1 0 367.401 4.095 20 0 FIADRM CC(C)c1ccc(OCC(=O)Nc2ccc(C[C@@H](C)C(=O)[O-])cc2)cc1 ZINC000432001359 1091538279 /nfs/dbraw/zinc/53/82/79/1091538279.db2.gz QHTRUYNHNNHIFK-OAHLLOKOSA-N -1 0 355.434 4.091 20 0 FIADRM C[C@H](Cc1ccc(NC(=O)[C@H](C)CSc2ccccc2)cc1)C(=O)[O-] ZINC000432003438 1091538992 /nfs/dbraw/zinc/53/89/92/1091538992.db2.gz QJNFWUYLZLBMQM-HUUCEWRRSA-N -1 0 357.475 4.317 20 0 FIADRM Cc1ccc2nc(C)c(C(=O)Nc3ccc(C[C@H](C)C(=O)[O-])cc3)cc2c1 ZINC000432002662 1091539950 /nfs/dbraw/zinc/53/99/50/1091539950.db2.gz XABAFZMBYZAFDE-AWEZNQCLSA-N -1 0 362.429 4.367 20 0 FIADRM Cc1ccc(-c2cc(C(=O)Nc3ccc(C[C@H](C)C(=O)[O-])cc3)on2)cc1 ZINC000432004609 1091541107 /nfs/dbraw/zinc/54/11/07/1091541107.db2.gz BJDZTUAIESAKFI-AWEZNQCLSA-N -1 0 364.401 4.166 20 0 FIADRM Cc1ccccc1C1(CN=c2[n-]nc(-c3ccccc3)s2)CCOCC1 ZINC000511726882 1091567140 /nfs/dbraw/zinc/56/71/40/1091567140.db2.gz LJHIEXLJLALWBW-UHFFFAOYSA-N -1 0 365.502 4.096 20 0 FIADRM C[C@]1(NC(=O)c2cc3c(ccc4ccccc34)[nH]2)CCCC[C@@H]1C(=O)[O-] ZINC000432088730 1091642574 /nfs/dbraw/zinc/64/25/74/1091642574.db2.gz LEJMJXRTRGJNAG-IERDGZPVSA-N -1 0 350.418 4.084 20 0 FIADRM O=C([O-])c1ccc(C(=O)Nc2ccc(F)cc2Nc2ccccc2F)o1 ZINC000432089420 1091642608 /nfs/dbraw/zinc/64/26/08/1091642608.db2.gz OUMDGOIRKBYSDZ-UHFFFAOYSA-N -1 0 358.300 4.252 20 0 FIADRM C[C@@]1(NC(=O)Cc2csc3ccc(Cl)cc23)CCCC[C@H]1C(=O)[O-] ZINC000432097041 1091653295 /nfs/dbraw/zinc/65/32/95/1091653295.db2.gz HNAHZPVPIQLZHW-KBXCAEBGSA-N -1 0 365.882 4.247 20 0 FIADRM C[C@@H](NC(=O)CC1(C(=O)[O-])CCC1)c1ccc(-c2ccc(F)cc2)cc1 ZINC000432106374 1091672571 /nfs/dbraw/zinc/67/25/71/1091672571.db2.gz HWIRJYOYVXAQPK-CQSZACIVSA-N -1 0 355.409 4.315 20 0 FIADRM C[C@@H](c1cccc(Cl)c1)N(C)C(=O)NC[C@](C)(C(=O)[O-])c1ccccc1 ZINC000652105767 1091693414 /nfs/dbraw/zinc/69/34/14/1091693414.db2.gz VSCQXSSDWOYKNB-XOBRGWDASA-N -1 0 374.868 4.085 20 0 FIADRM CCOc1ccc(Oc2cc(CN=c3[n-]nc(C(C)C)s3)ccn2)cc1 ZINC000432121287 1091694925 /nfs/dbraw/zinc/69/49/25/1091694925.db2.gz FPINXWCQMWYQPB-UHFFFAOYSA-N -1 0 370.478 4.282 20 0 FIADRM CC(C)c1n[n-]c(=NCc2ccccc2COCc2ccccc2)s1 ZINC000432126655 1091704417 /nfs/dbraw/zinc/70/44/17/1091704417.db2.gz AJFJRBGXHNKTGQ-UHFFFAOYSA-N -1 0 353.491 4.412 20 0 FIADRM C[C@@H](NC(=O)CCc1ccccc1C(=O)[O-])c1ccc(-c2ccncc2)cc1 ZINC000432127198 1091705104 /nfs/dbraw/zinc/70/51/04/1091705104.db2.gz RHLKDUJRYRKCGR-MRXNPFEDSA-N -1 0 374.440 4.257 20 0 FIADRM Cc1cccc(Oc2ncccc2NC(=O)c2cccc(C(=O)[O-])c2)c1C ZINC000432127032 1091705532 /nfs/dbraw/zinc/70/55/32/1091705532.db2.gz QTOJKMMXJQCPLZ-UHFFFAOYSA-N -1 0 362.385 4.441 20 0 FIADRM C[C@]1(NC(=O)CCCc2csc3ccccc23)CCCC[C@H]1C(=O)[O-] ZINC000432130677 1091712955 /nfs/dbraw/zinc/71/29/55/1091712955.db2.gz QDBAKYNHIKAOMI-JXFKEZNVSA-N -1 0 359.491 4.374 20 0 FIADRM COCc1n[n-]c(=N[C@H](c2cccs2)c2ccc(C(C)C)cc2)s1 ZINC000432142238 1091730005 /nfs/dbraw/zinc/73/00/05/1091730005.db2.gz CXCNYYRISXRGGT-KRWDZBQOSA-N -1 0 359.520 4.493 20 0 FIADRM O=C([O-])c1ccccc1CCC(=O)N1CCCC[C@H]1Cc1ccccc1F ZINC000652121427 1091750315 /nfs/dbraw/zinc/75/03/15/1091750315.db2.gz IYIMRNGBHQTRER-SFHVURJKSA-N -1 0 369.436 4.080 20 0 FIADRM CC(C)(C(=O)[O-])c1ccc(NC(=O)[C@@H]2CCCC[C@@H]2C(F)(F)F)cc1 ZINC000262215297 1091822357 /nfs/dbraw/zinc/82/23/57/1091822357.db2.gz MDFZXRGNCMSGDN-KGLIPLIRSA-N -1 0 357.372 4.356 20 0 FIADRM O=C([O-])CC[C@H]1CCCN(C(=O)c2sc3cc(F)ccc3c2Cl)C1 ZINC000324716303 1092010027 /nfs/dbraw/zinc/01/00/27/1092010027.db2.gz DSKALLSPZVIFDD-SNVBAGLBSA-N -1 0 369.845 4.411 20 0 FIADRM O=c1[n-]c(-c2nc3ccccc3cc2Br)nc2ccc(O)cc12 ZINC000436924869 1092021239 /nfs/dbraw/zinc/02/12/39/1092021239.db2.gz GYFHUYBDODLMHU-UHFFFAOYSA-N -1 0 368.190 4.019 20 0 FIADRM C[C@H]1CN(C(=O)c2sc3cc(Cl)ccc3c2Cl)CC[C@@H]1C(=O)[O-] ZINC000261608589 1092030226 /nfs/dbraw/zinc/03/02/26/1092030226.db2.gz ARXKNQITSGZPGT-WPRPVWTQSA-N -1 0 372.273 4.391 20 0 FIADRM C[C@H](C(F)(F)F)S(=O)(=O)[N-][C@@H](CCc1ccccc1)c1ccccc1 ZINC000544750707 1092162205 /nfs/dbraw/zinc/16/22/05/1092162205.db2.gz VMONVMIPEIHRPL-PBHICJAKSA-N -1 0 371.424 4.231 20 0 FIADRM CC[C@@H](C)c1ccccc1OCC(=O)N[C@H](CC(=O)[O-])c1ccccc1C ZINC000236885909 1092167243 /nfs/dbraw/zinc/16/72/43/1092167243.db2.gz MJRHBXZBUKGQHE-DNVCBOLYSA-N -1 0 369.461 4.220 20 0 FIADRM O=C(N=c1nc(-c2ccccc2)[n-]s1)c1c(Cl)cc(F)cc1Cl ZINC000432714431 1092175153 /nfs/dbraw/zinc/17/51/53/1092175153.db2.gz AHQHJQHVUZZXCG-UHFFFAOYSA-N -1 0 368.220 4.325 20 0 FIADRM CCc1ccc([C@H](C)C(=O)N[C@H](CC(=O)[O-])c2ccc(SC)cc2)cc1 ZINC000236972077 1092186104 /nfs/dbraw/zinc/18/61/04/1092186104.db2.gz ANDUMWMNZKSMEU-IFXJQAMLSA-N -1 0 371.502 4.407 20 0 FIADRM CCCCOc1ccc(F)cc1Nc1cc(S(=O)(=O)CC)ccc1O ZINC001211719005 1092233056 /nfs/dbraw/zinc/23/30/56/1092233056.db2.gz RGYICZFAMYTDIT-UHFFFAOYSA-N -1 0 367.442 4.247 20 0 FIADRM Cc1ccc(-c2ccsc2C(=O)N=c2nc3ccc(Cl)cn3[n-]2)cc1 ZINC000508317218 1092240098 /nfs/dbraw/zinc/24/00/98/1092240098.db2.gz NYTWCTCEPMEBAY-UHFFFAOYSA-N -1 0 368.849 4.094 20 0 FIADRM O=S(=O)(CC1CCC1)[N-][C@@H](c1cccc2ccccc21)C(F)(F)F ZINC000512427386 1092307904 /nfs/dbraw/zinc/30/79/04/1092307904.db2.gz SMBDZTYJXGIMDL-INIZCTEOSA-N -1 0 357.397 4.163 20 0 FIADRM Cc1oc(CNC(=O)Cc2cc3c(ccc4ccccc34)o2)cc1C(=O)[O-] ZINC000190925142 1092311640 /nfs/dbraw/zinc/31/16/40/1092311640.db2.gz LZWMVKJGHWMWGX-UHFFFAOYSA-N -1 0 363.369 4.045 20 0 FIADRM COc1cccc(/C=C\c2ncc(C(=O)[O-])c(C(C)C)n2)c1OC(C)C ZINC000607009196 1092341631 /nfs/dbraw/zinc/34/16/31/1092341631.db2.gz HCNRGPKKPWNVTJ-KTKRTIGZSA-N -1 0 356.422 4.264 20 0 FIADRM Cc1ccc([C@H]2CCCN2C(=O)c2nn(-c3ccc(F)cc3)cc2[O-])s1 ZINC000500673692 1092353717 /nfs/dbraw/zinc/35/37/17/1092353717.db2.gz ZNSBOVSNNIXQPX-OAHLLOKOSA-N -1 0 371.437 4.064 20 0 FIADRM C/C(=C/C(=O)N(CCC(=O)[O-])CC(C)C)c1ccc(C(F)(F)F)cc1 ZINC000236736460 1092416873 /nfs/dbraw/zinc/41/68/73/1092416873.db2.gz DNUMEKGXTLFYEE-RAXLEYEMSA-N -1 0 357.372 4.068 20 0 FIADRM CCCCC[C@@H](C)CC(=O)N1CCc2[nH]c3ccc(C(=O)[O-])cc3c2C1 ZINC000236799518 1092423494 /nfs/dbraw/zinc/42/34/94/1092423494.db2.gz KICPJUDKZVLESA-CQSZACIVSA-N -1 0 356.466 4.357 20 0 FIADRM O=S(=O)(Nc1ccc(-c2nc(C3CCCC3)no2)cc1)c1ccccc1 ZINC000521028934 1092433318 /nfs/dbraw/zinc/43/33/18/1092433318.db2.gz OXNRTRGUYPYPQK-UHFFFAOYSA-N -1 0 369.446 4.195 20 0 FIADRM CC(C)(C)n1cc(NC(=O)c2cc(Cl)cc(Br)c2[O-])cn1 ZINC000438941926 1092448413 /nfs/dbraw/zinc/44/84/13/1092448413.db2.gz NGMQHVXYVFCREN-UHFFFAOYSA-N -1 0 372.650 4.012 20 0 FIADRM Cc1ccccc1[C@@H](CC(=O)[O-])NC(=O)C[C@@H]1CCCc2ccccc21 ZINC000237590060 1092494480 /nfs/dbraw/zinc/49/44/80/1092494480.db2.gz CLVHLOGNCMASHS-FXAWDEMLSA-N -1 0 351.446 4.137 20 0 FIADRM Cc1cc([N-]S(=O)(=O)c2cnccc2C(F)(F)F)cc(C)c1Cl ZINC000442227784 1092501250 /nfs/dbraw/zinc/50/12/50/1092501250.db2.gz GRFGTFBWZZERGG-UHFFFAOYSA-N -1 0 364.776 4.171 20 0 FIADRM Cc1ccccc1[C@H](CC(=O)[O-])NC(=O)c1cccc(Cl)c1Cl ZINC000237663845 1092522159 /nfs/dbraw/zinc/52/21/59/1092522159.db2.gz IXRXXXAVXWWOAI-AWEZNQCLSA-N -1 0 352.217 4.248 20 0 FIADRM Cc1onc(-c2ccccc2Cl)c1C(=O)NCCCCCCC(=O)[O-] ZINC000237689696 1092526027 /nfs/dbraw/zinc/52/60/27/1092526027.db2.gz YWYAVQSCOOONAJ-UHFFFAOYSA-N -1 0 364.829 4.068 20 0 FIADRM O=C(c1ccccc1)c1cccc([N-]S(=O)(=O)c2ccccc2Cl)c1 ZINC000509535200 1092532327 /nfs/dbraw/zinc/53/23/27/1092532327.db2.gz CHPXMDBYYISGDQ-UHFFFAOYSA-N -1 0 371.845 4.372 20 0 FIADRM Cc1ccc(-c2ccc(C(=O)Nc3nc(CC(=O)[O-])cs3)c(F)c2)cc1 ZINC000237717294 1092536115 /nfs/dbraw/zinc/53/61/15/1092536115.db2.gz XPKKOXSZERDIKQ-UHFFFAOYSA-N -1 0 370.405 4.137 20 0 FIADRM Cc1ccc(C(=O)N2CCc3[nH]c4ccc(C(=O)[O-])cc4c3C2)cc1Cl ZINC000237847654 1092561755 /nfs/dbraw/zinc/56/17/55/1092561755.db2.gz LKGHCDTZDDPFKT-UHFFFAOYSA-N -1 0 368.820 4.026 20 0 FIADRM O=C([O-])Cc1ccccc1NC(=O)CCCCc1nc2ccccc2s1 ZINC000238067586 1092562092 /nfs/dbraw/zinc/56/20/92/1092562092.db2.gz CEFHLAUOZKOQMC-UHFFFAOYSA-N -1 0 368.458 4.275 20 0 FIADRM O=C([O-])CCSCc1cccc(NC(=O)c2ccc3ccccc3n2)c1 ZINC000190982097 1092563280 /nfs/dbraw/zinc/56/32/80/1092563280.db2.gz IUQJSGJVBUIWEJ-UHFFFAOYSA-N -1 0 366.442 4.195 20 0 FIADRM O=C([O-])CCCCCCNC(=O)c1csc(-c2cccc(Cl)c2)n1 ZINC000238135451 1092568620 /nfs/dbraw/zinc/56/86/20/1092568620.db2.gz SRBCXSRYZZFRBD-UHFFFAOYSA-N -1 0 366.870 4.228 20 0 FIADRM Cc1ccccc1[C@@H](CC(=O)[O-])NC(=O)c1cc2cc(C)c(C)cc2o1 ZINC000237907158 1092580306 /nfs/dbraw/zinc/58/03/06/1092580306.db2.gz WYEGWKVWAJWYMJ-QGZVFWFLSA-N -1 0 351.402 4.304 20 0 FIADRM O=C(c1cccc(Br)c1[O-])N1CCC(c2ccccc2)CC1 ZINC000521247037 1092589695 /nfs/dbraw/zinc/58/96/95/1092589695.db2.gz ZKXGKXRMKZUWLJ-UHFFFAOYSA-N -1 0 360.251 4.175 20 0 FIADRM O=C(N[C@H]1CCCc2c3cc(Cl)ccc3[nH]c21)c1ccc(F)cc1[O-] ZINC001648958796 1092647373 /nfs/dbraw/zinc/64/73/73/1092647373.db2.gz KRDLHOJUHNLQKQ-INIZCTEOSA-N -1 0 358.800 4.473 20 0 FIADRM Cc1cc(C)c(N=c2[n-]nc(SCC(=O)C3CC3)s2)c(Cl)c1 ZINC000521346528 1092657565 /nfs/dbraw/zinc/65/75/65/1092657565.db2.gz ZFJRRFVDAOGFCH-UHFFFAOYSA-N -1 0 353.900 4.045 20 0 FIADRM O=C([O-])CCc1ccc(NC(=O)c2ccc(Oc3cccnc3)cc2)cc1 ZINC000191023019 1092662742 /nfs/dbraw/zinc/66/27/42/1092662742.db2.gz KUQUOVYNOYWKID-UHFFFAOYSA-N -1 0 362.385 4.143 20 0 FIADRM CC[C@H](C(=O)N[C@H](CC(=O)[O-])c1ccc(Cl)c(F)c1)c1ccccc1 ZINC000447895184 1092670096 /nfs/dbraw/zinc/67/00/96/1092670096.db2.gz XQWBPSKCPPULRZ-WMLDXEAASA-N -1 0 363.816 4.305 20 0 FIADRM CC(C)CN=c1[n-]nc(S[C@H](C)c2ccc(OC(F)F)cc2)s1 ZINC000512537968 1092673624 /nfs/dbraw/zinc/67/36/24/1092673624.db2.gz AXTRQANJOWIYAP-SNVBAGLBSA-N -1 0 359.467 4.483 20 0 FIADRM CC(C)(C)Oc1ccccc1[N-]S(=O)(=O)c1c(F)cc(F)cc1F ZINC000521492903 1092719776 /nfs/dbraw/zinc/71/97/76/1092719776.db2.gz JCOCLPJBIFKZAW-UHFFFAOYSA-N -1 0 359.369 4.082 20 0 FIADRM Cc1cc(Cl)c(NC(=O)CC2(CC(=O)[O-])CCC2)cc1Br ZINC000643343678 1092766941 /nfs/dbraw/zinc/76/69/41/1092766941.db2.gz XJSUBMAMKLVJSB-UHFFFAOYSA-N -1 0 374.662 4.385 20 0 FIADRM O=S(=O)([N-]c1csc2ccccc12)c1cnccc1C(F)(F)F 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ZINC000262972301 1099754000 /nfs/dbraw/zinc/75/40/00/1099754000.db2.gz KAAUSCAPOBLGCO-UHFFFAOYSA-N -1 0 372.490 4.060 20 0 FIADRM O=C([O-])[C@@]12CCC[C@H]1CN(C(=O)Nc1cccc(-c3ccccc3)c1)C2 ZINC000263027002 1099756405 /nfs/dbraw/zinc/75/64/05/1099756405.db2.gz JZGHUXYIZDGIDI-LAUBAEHRSA-N -1 0 350.418 4.072 20 0 FIADRM Cc1cccc(Oc2ccccc2C(=O)N2CCC(CC(=O)[O-])CC2)c1 ZINC000263036281 1099757991 /nfs/dbraw/zinc/75/79/91/1099757991.db2.gz DFGMYZLYTXYLMG-UHFFFAOYSA-N -1 0 353.418 4.114 20 0 FIADRM C[C@]1(C(=O)[O-])CCCN(C(=O)c2ccc(SCc3ccccc3)cc2)C1 ZINC000263039048 1099758461 /nfs/dbraw/zinc/75/84/61/1099758461.db2.gz CUONUTQSKOWEMZ-NRFANRHFSA-N -1 0 369.486 4.306 20 0 FIADRM O=C([O-])c1ccccc1CC1CCN(C(=O)c2cncc3ccccc32)CC1 ZINC000263050465 1099759352 /nfs/dbraw/zinc/75/93/52/1099759352.db2.gz PWUDORZYKGFTOI-UHFFFAOYSA-N -1 0 374.440 4.028 20 0 FIADRM CC(C)[C@@H](CC(=O)N[C@H](C)c1ccc(OCC(=O)[O-])cc1)c1ccccc1 ZINC000263067039 1099760427 /nfs/dbraw/zinc/76/04/27/1099760427.db2.gz OYJQUENVNJWGGC-OXQOHEQNSA-N -1 0 369.461 4.157 20 0 FIADRM CCOc1ccc(OCCCC(=O)Nc2ccc([C@H](C)C(=O)[O-])cc2)cc1 ZINC000263053340 1099760997 /nfs/dbraw/zinc/76/09/97/1099760997.db2.gz FAXMHRBSWHALRX-HNNXBMFYSA-N -1 0 371.433 4.071 20 0 FIADRM Cc1cc(C)cc(C(=O)N2CCC(Cc3ccccc3C(=O)[O-])CC2)c1 ZINC000263065956 1099761189 /nfs/dbraw/zinc/76/11/89/1099761189.db2.gz QYWWBMOJSZEMJL-UHFFFAOYSA-N -1 0 351.446 4.097 20 0 FIADRM Cc1cc(C(=O)N2CCC[C@@H](C(=O)[O-])[C@H]2C)sc1-c1ccc(F)cc1 ZINC000263092308 1099762385 /nfs/dbraw/zinc/76/23/85/1099762385.db2.gz AKCWIJQRHCYPKW-IUODEOHRSA-N -1 0 361.438 4.188 20 0 FIADRM CC(C)(C(=O)NCc1ccc(C(=O)[O-])s1)c1cccc(C(F)(F)F)c1 ZINC000263104733 1099764043 /nfs/dbraw/zinc/76/40/43/1099764043.db2.gz DCGXXYCGHAJSJH-UHFFFAOYSA-N -1 0 371.380 4.059 20 0 FIADRM O=C([O-])CCCCCNC(=O)c1cnn(C2CCCC2)c1-c1ccccc1 ZINC000263170864 1099768183 /nfs/dbraw/zinc/76/81/83/1099768183.db2.gz JHRAURTZIJAMOR-UHFFFAOYSA-N -1 0 369.465 4.040 20 0 FIADRM COc1ccc(SCCC(=O)Nc2ccc([C@@H](C)C(=O)[O-])cc2)cc1 ZINC000263181586 1099768541 /nfs/dbraw/zinc/76/85/41/1099768541.db2.gz HHSFWLKYZYUHEA-CYBMUJFWSA-N -1 0 359.447 4.004 20 0 FIADRM C[C@@H](CC(=O)Nc1ccc(OCCCC(=O)[O-])cc1)c1ccc(F)cc1 ZINC000263193335 1099769309 /nfs/dbraw/zinc/76/93/09/1099769309.db2.gz ZGFBPEBLKPHBPR-AWEZNQCLSA-N -1 0 359.397 4.202 20 0 FIADRM CCOc1ccccc1-c1cccc(C(=O)N2C[C@@H](C(=O)[O-])CC[C@@H]2C)c1 ZINC000263187704 1099769893 /nfs/dbraw/zinc/76/98/93/1099769893.db2.gz KXMVNESHMKHQNO-YJBOKZPZSA-N -1 0 367.445 4.078 20 0 FIADRM CSc1ccc(O[C@H](C)C(=O)Nc2cccc([C@@H](C)C(=O)[O-])c2)cc1 ZINC000263206279 1099770584 /nfs/dbraw/zinc/77/05/84/1099770584.db2.gz KRURAXBDUCJQCT-CHWSQXEVSA-N -1 0 359.447 4.003 20 0 FIADRM Cc1nc(C2CCCC2)sc1C(=O)Nc1ccc(CC(=O)[O-])c(F)c1 ZINC000263232164 1099773773 /nfs/dbraw/zinc/77/37/73/1099773773.db2.gz QRANUJROQUSVHX-UHFFFAOYSA-N -1 0 362.426 4.128 20 0 FIADRM Cc1ccc(C[C@@H](C)C(=O)Nc2cccc(CSCC(=O)[O-])c2)cc1 ZINC000263270504 1099776230 /nfs/dbraw/zinc/77/62/30/1099776230.db2.gz LYVDEWRDWOWXNO-OAHLLOKOSA-N -1 0 357.475 4.130 20 0 FIADRM CCC[C@H](NC(=O)N1CC[C@@](C)(C(=O)[O-])C1)c1cccc(C(F)(F)F)c1 ZINC000263311105 1099780352 /nfs/dbraw/zinc/78/03/52/1099780352.db2.gz YTAIIAVEBYZPOY-WMLDXEAASA-N -1 0 372.387 4.053 20 0 FIADRM Cc1cc(O[C@H](C)C(=O)Nc2cccc([C@@H](C)C(=O)[O-])c2)ccc1Cl ZINC000263343300 1099781664 /nfs/dbraw/zinc/78/16/64/1099781664.db2.gz SNWSYRPBSPZETQ-CHWSQXEVSA-N -1 0 361.825 4.243 20 0 FIADRM C[C@@H](C(=O)[O-])c1cccc(NC(=O)C2(Cc3cccc(F)c3)CCC2)c1 ZINC000263343997 1099781896 /nfs/dbraw/zinc/78/18/96/1099781896.db2.gz STNPTMQSOZSNEC-CQSZACIVSA-N -1 0 355.409 4.365 20 0 FIADRM C[C@H](C(=O)[O-])c1cccc(NC(=O)C2(Cc3ccccc3Cl)CC2)c1 ZINC000263346399 1099781954 /nfs/dbraw/zinc/78/19/54/1099781954.db2.gz UDGQFUJTUJPUBA-ZDUSSCGKSA-N -1 0 357.837 4.490 20 0 FIADRM C[C@@H](C(=O)[O-])c1cccc(NC(=O)C(C)(C)Oc2cccc(Cl)c2)c1 ZINC000263342283 1099781968 /nfs/dbraw/zinc/78/19/68/1099781968.db2.gz SGTZKWMQYDZSSH-GFCCVEGCSA-N 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ZINC000263395946 1099786251 /nfs/dbraw/zinc/78/62/51/1099786251.db2.gz GNXSSBWLJLZSRB-OAHLLOKOSA-N -1 0 352.434 4.012 20 0 FIADRM CC(C)C(=O)c1ccc([C@@H](C)C(=O)Nc2cccc(CCC(=O)[O-])c2)cc1 ZINC000263384306 1099786978 /nfs/dbraw/zinc/78/69/78/1099786978.db2.gz CJIPGTNMUHKFFD-OAHLLOKOSA-N -1 0 367.445 4.285 20 0 FIADRM O=S(=O)([N-]c1cc(Cl)c(Cl)cn1)c1cccc(C(F)(F)F)c1 ZINC000437306357 1099790129 /nfs/dbraw/zinc/79/01/29/1099790129.db2.gz PMADMHLUWKJPSZ-UHFFFAOYSA-N -1 0 371.167 4.208 20 0 FIADRM Cc1cc(SC2CCCCC2)ccc1NC(=O)NCCCC(=O)[O-] ZINC000263458095 1099792795 /nfs/dbraw/zinc/79/27/95/1099792795.db2.gz CPTMDGLUKLNYEO-UHFFFAOYSA-N -1 0 350.484 4.406 20 0 FIADRM Cc1cc(O[C@H](C)c2ccccc2)ccc1NC(=O)N(C)C[C@H](C)C(=O)[O-] ZINC000263475920 1099793636 /nfs/dbraw/zinc/79/36/36/1099793636.db2.gz JFLRYTRVYOELEP-JKSUJKDBSA-N -1 0 370.449 4.319 20 0 FIADRM Cc1ccsc1S(=O)(=O)[N-]c1ccccc1N1CCCCCC1 ZINC000437321333 1099798153 /nfs/dbraw/zinc/79/81/53/1099798153.db2.gz WWCRHTGONGLGFI-UHFFFAOYSA-N -1 0 350.509 4.238 20 0 FIADRM O=C([O-])C1CCC(NC(=O)N2CCCC[C@@H]2c2cccc(Cl)c2)CC1 ZINC000263514643 1099798320 /nfs/dbraw/zinc/79/83/20/1099798320.db2.gz ZXVMNUZEICEMSN-QWFMPGPPSA-N -1 0 364.873 4.220 20 0 FIADRM CCc1c(C)sc(NC(=O)c2csc(C(F)(F)F)n2)c1C(=O)[O-] ZINC000263518302 1099800483 /nfs/dbraw/zinc/80/04/83/1099800483.db2.gz FUVDVDDLHRRBKL-UHFFFAOYSA-N -1 0 364.370 4.045 20 0 FIADRM COc1ccc([C@@H](N=c2nc([C@H](C)OC)[n-]s2)c2ccc(C)cc2)cc1 ZINC000509683624 1099878451 /nfs/dbraw/zinc/87/84/51/1099878451.db2.gz UDPPIYIXELVYPY-KSSFIOAISA-N -1 0 369.490 4.186 20 0 FIADRM Cc1ccc(-c2[n-][nH]c(=NC(=O)[C@H](C)Cc3cccc(Cl)c3)c2C)o1 ZINC000533781574 1099927476 /nfs/dbraw/zinc/92/74/76/1099927476.db2.gz OYZDIYWAEFDGGT-LLVKDONJSA-N -1 0 357.841 4.179 20 0 FIADRM CCCCc1n[n-]c(=NC(=O)N2C[C@@H](C)C[C@H]2c2cccc(F)c2)s1 ZINC000437574067 1099995540 /nfs/dbraw/zinc/99/55/40/1099995540.db2.gz BLLDEBDSFLPPPW-WFASDCNBSA-N -1 0 362.474 4.057 20 0 FIADRM CCc1n[n-]c(=NC(=O)N(Cc2ccccc2Cl)C2CCCC2)s1 ZINC000437591634 1100022052 /nfs/dbraw/zinc/02/20/52/1100022052.db2.gz PKJIITLJDSUMPN-UHFFFAOYSA-N -1 0 364.902 4.153 20 0 FIADRM COCc1ccc(S(=O)(=O)[N-]c2ncc(C3CCCCC3)s2)cc1 ZINC000517111071 1100077660 /nfs/dbraw/zinc/07/76/60/1100077660.db2.gz FYCUCKUTRBANTJ-UHFFFAOYSA-N -1 0 366.508 4.138 20 0 FIADRM CCSc1n[n-]c(=NC(=O)N2CCCC3(C2)CCCCCC3)s1 ZINC000437673043 1100086116 /nfs/dbraw/zinc/08/61/16/1100086116.db2.gz KARPBSRGGRDEQR-UHFFFAOYSA-N -1 0 354.545 4.040 20 0 FIADRM Cc1ccc(SCC(F)(F)F)c([N-]S(=O)(=O)c2ccco2)c1 ZINC000437678911 1100092570 /nfs/dbraw/zinc/09/25/70/1100092570.db2.gz OTILQXKYSUJHCN-UHFFFAOYSA-N -1 0 351.371 4.043 20 0 FIADRM CC[C@@](C)(NCc1cc(=O)[nH]c(-c2ccccc2)n1)c1nc(C)cs1 ZINC000459398311 1100105969 /nfs/dbraw/zinc/10/59/69/1100105969.db2.gz YOUUUEVYCZQPCE-LJQANCHMSA-N -1 0 354.479 4.029 20 0 FIADRM O=C([O-])c1csc(NC(=O)c2ccc(COc3ccc(F)cc3)o2)c1 ZINC000191368318 1100178001 /nfs/dbraw/zinc/17/80/01/1100178001.db2.gz XKHUTDHNXXWIGV-UHFFFAOYSA-N -1 0 361.350 4.010 20 0 FIADRM O=C([O-])c1csc(NC(=O)c2cccc(NC(=O)c3cccs3)c2)c1 ZINC000191361934 1100194670 /nfs/dbraw/zinc/19/46/70/1100194670.db2.gz QPCCOAWADDVUBJ-UHFFFAOYSA-N -1 0 372.427 4.012 20 0 FIADRM Cc1c2cc(Cl)ccc2oc1C(=O)NC[C@](C)(C(=O)[O-])c1ccccc1 ZINC000517228605 1100206303 /nfs/dbraw/zinc/20/63/03/1100206303.db2.gz QWAYATCJOPYCHV-FQEVSTJZSA-N -1 0 371.820 4.167 20 0 FIADRM O=S(=O)([N-]c1ncc(-c2ccccc2F)s1)c1ccccc1Cl ZINC000549995493 1100240213 /nfs/dbraw/zinc/24/02/13/1100240213.db2.gz XXLAQXDDSGCWHM-UHFFFAOYSA-N -1 0 368.842 4.403 20 0 FIADRM CC[C@@H](c1n[n-]c(=NC(=O)c2ccc(Cl)s2)s1)c1ccccc1 ZINC000517361763 1100315823 /nfs/dbraw/zinc/31/58/23/1100315823.db2.gz VFJGXJRISHSZDG-LLVKDONJSA-N -1 0 363.895 4.469 20 0 FIADRM Cc1cc(Cl)c2ccccc2c1NC(=O)N1C[C@H](C(=O)[O-])C[C@H](C)C1 ZINC000422537121 1100327049 /nfs/dbraw/zinc/32/70/49/1100327049.db2.gz GPKSEQCTPBYYFP-WCQYABFASA-N -1 0 360.841 4.376 20 0 FIADRM C[C@@H]1C[C@H](c2cccc(F)c2)N(C(=O)N=c2nc(C(C)(C)C)[n-]s2)C1 ZINC000437950329 1100332548 /nfs/dbraw/zinc/33/25/48/1100332548.db2.gz DPXABOSWKJWOMT-BXUZGUMPSA-N -1 0 362.474 4.012 20 0 FIADRM CC(=O)c1ccc(Oc2ccc(C(=O)NCCCCCC(=O)[O-])cc2)cc1 ZINC000455839984 1100404307 /nfs/dbraw/zinc/40/43/07/1100404307.db2.gz XAOOQJIXNJZMTA-UHFFFAOYSA-N -1 0 369.417 4.056 20 0 FIADRM O=C(Nc1ccc(-c2cnc(C3CC3)o2)cc1)c1cc(=O)c2ccccc2[n-]1 ZINC000506193623 1100540513 /nfs/dbraw/zinc/54/05/13/1100540513.db2.gz XIKSHPGNLQXYOX-UHFFFAOYSA-N -1 0 371.396 4.313 20 0 FIADRM CC(C)(CC(=O)N1CCC[C@]1(C)Cc1ccccc1C(F)(F)F)C(=O)[O-] ZINC000659233007 1100603018 /nfs/dbraw/zinc/60/30/18/1100603018.db2.gz SJPDWZSNQNIEFZ-GOSISDBHSA-N -1 0 371.399 4.130 20 0 FIADRM C[C@@H]1C[C@H](NC(=O)c2s[n-]c(=O)c2Cl)C[C@@H](c2ccccc2)C1 ZINC000517710643 1100609270 /nfs/dbraw/zinc/60/92/70/1100609270.db2.gz GPGCRYMWVUKFSE-DRZSPHRISA-N -1 0 350.871 4.204 20 0 FIADRM O=C(Nc1cccc(Oc2ccccc2)c1)c1ccc(-c2nc(=O)o[n-]2)cc1 ZINC000517704584 1100614161 /nfs/dbraw/zinc/61/41/61/1100614161.db2.gz BBQPKRFMRQYHLR-UHFFFAOYSA-N -1 0 373.368 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