smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name CC(C)n1ccnc1CN(C)Cc1ccccc1[O-] ZINC000264716433 520025592 /nfs/dbraw/zinc/02/55/92/520025592.db2.gz NODJDJJYUCPGPI-UHFFFAOYSA-N -1 3 259.353 2.802 20 10 CFCDHM CC(=O)c1cc(F)cc(CN2CC[C@H](C)C2)c1[O-] ZINC000040719062 518288456 /nfs/dbraw/zinc/28/84/56/518288456.db2.gz DULCNOFSHUFAFQ-VIFPVBQESA-N -1 3 251.301 2.576 20 10 CFCDHM CCN(CCc1cccs1)C(=O)c1cccc(O)c1[O-] ZINC000279504299 521169317 /nfs/dbraw/zinc/16/93/17/521169317.db2.gz IVHXTGMFRPKYJQ-UHFFFAOYSA-N -1 3 291.372 2.864 20 10 CFCDHM CCOC(=O)c1cc(NCc2cc(F)ccc2[O-])cn1C ZINC000290559512 521444360 /nfs/dbraw/zinc/44/43/60/521444360.db2.gz SHCYHYDCSLFWLW-UHFFFAOYSA-N -1 3 292.310 2.659 20 10 CFCDHM CCN1CCN(Cc2cccc(Cl)c2[O-])[C@H](C)C1 ZINC000289832424 521688980 /nfs/dbraw/zinc/68/89/80/521688980.db2.gz UJCIGRCIPXVKSS-LLVKDONJSA-N -1 3 268.788 2.572 20 10 CFCDHM CCCN(Cc1ccccc1[O-])[C@H](C(N)=O)c1ccccc1 ZINC000157066910 521690621 /nfs/dbraw/zinc/69/06/21/521690621.db2.gz TXOHFIARHQRJCP-KRWDZBQOSA-N -1 3 298.386 2.831 20 10 CFCDHM COCc1nc(CN[C@H](C)c2cc(F)ccc2[O-])cs1 ZINC000289614607 523202622 /nfs/dbraw/zinc/20/26/22/523202622.db2.gz DFOCWWNGYCGERC-SECBINFHSA-N -1 3 296.367 2.985 20 10 CFCDHM CO[C@@H]1CN(Cc2c([O-])cccc2Cl)CC[C@@H]1C ZINC000221275807 523739102 /nfs/dbraw/zinc/73/91/02/523739102.db2.gz RLYRESLYSXSGLA-IINYFYTJSA-N -1 3 269.772 2.902 20 10 CFCDHM C[C@H]1CN(Cc2cccc(F)c2[O-])C[C@@H](C2CC2)O1 ZINC000280603016 524627886 /nfs/dbraw/zinc/62/78/86/524627886.db2.gz OEEKQAUJONEOHK-HZMBPMFUSA-N -1 3 265.328 2.531 20 10 CFCDHM Cc1ccc(C(=O)N2CCC[C@@H](C3CC3)C2)c([O-])c1O ZINC000292004031 526095166 /nfs/dbraw/zinc/09/51/66/526095166.db2.gz CMPBBSGAYJCMGN-GFCCVEGCSA-N -1 3 275.348 2.668 20 10 CFCDHM O=C(N[C@@H]1CC12CCCCC2)c1cccc(O)c1[O-] ZINC000193151990 526881318 /nfs/dbraw/zinc/88/13/18/526881318.db2.gz AFJVGLFLCAZFLV-GFCCVEGCSA-N -1 3 261.321 2.550 20 10 CFCDHM Cn1nccc1CNCc1cc(Cl)cc(Cl)c1[O-] ZINC000071138204 527610436 /nfs/dbraw/zinc/61/04/36/527610436.db2.gz QMBFPVHNGXAJMH-UHFFFAOYSA-N -1 3 286.162 2.722 20 10 CFCDHM CC[C@H]1COCCN1Cc1c([O-])ccc2ccncc21 ZINC000738083273 574057402 /nfs/dbraw/zinc/05/74/02/574057402.db2.gz VHEKTSRDUGALLE-ZDUSSCGKSA-N -1 3 272.348 2.551 20 10 CFCDHM O=C(OCc1cccc(Cl)n1)c1cc([O-])cs1 ZINC000745002740 574096661 /nfs/dbraw/zinc/09/66/61/574096661.db2.gz ONWKWDUJNRLDGD-UHFFFAOYSA-N -1 3 269.709 2.859 20 10 CFCDHM C[C@H](C(=O)NC1CCCCC1)N(C)Cc1ccccc1[O-] ZINC000731843571 574130258 /nfs/dbraw/zinc/13/02/58/574130258.db2.gz RAWWQLVYEHOWES-CYBMUJFWSA-N -1 3 290.407 2.661 20 10 CFCDHM O=C(NCCc1ccc(F)cc1)c1cc([O-])cs1 ZINC000731863895 574130829 /nfs/dbraw/zinc/13/08/29/574130829.db2.gz JEDLWHRRYWAXSB-UHFFFAOYSA-N -1 3 265.309 2.565 20 10 CFCDHM COc1cc(NC(=O)c2cc([O-])cs2)cc(OC)c1 ZINC000731864204 574130955 /nfs/dbraw/zinc/13/09/55/574130955.db2.gz OTOIMHXAEUGDSL-UHFFFAOYSA-N -1 3 279.317 2.723 20 10 CFCDHM Cc1ccc(OC[C@H](C)NC(=O)c2cc([O-])cs2)cc1 ZINC000732278398 574148145 /nfs/dbraw/zinc/14/81/45/574148145.db2.gz LAZPPKJWXOSUOV-NSHDSACASA-N -1 3 291.372 2.959 20 10 CFCDHM CN(C)c1ccccc1NC(=O)c1cc([O-])cs1 ZINC000732269032 574148617 /nfs/dbraw/zinc/14/86/17/574148617.db2.gz OQHJFQQZGFAWGS-UHFFFAOYSA-N -1 3 262.334 2.772 20 10 CFCDHM O=C(N[C@@H]1CCOc2c(F)cccc21)c1cc([O-])cs1 ZINC000732275643 574149331 /nfs/dbraw/zinc/14/93/31/574149331.db2.gz FWGDSWNMLCBBSL-LLVKDONJSA-N -1 3 293.319 2.846 20 10 CFCDHM O=C(OC[C@@H]1CC1(Cl)Cl)c1cc([O-])cs1 ZINC000732354981 574153258 /nfs/dbraw/zinc/15/32/58/574153258.db2.gz YNBPRYCCPDXECC-YFKPBYRVSA-N -1 3 267.133 2.804 20 10 CFCDHM CCc1cnc(CN(C)C(=O)c2cc([O-])cs2)s1 ZINC000747522330 574199637 /nfs/dbraw/zinc/19/96/37/574199637.db2.gz ICPFBHWSCVOQCW-UHFFFAOYSA-N -1 3 282.390 2.745 20 10 CFCDHM CO[C@@H](CNCc1cc(Cl)ccc1[O-])C(F)(F)F ZINC000733330188 574222694 /nfs/dbraw/zinc/22/26/94/574222694.db2.gz RNGYFKAIRAZXQI-JTQLQIEISA-N -1 3 283.677 2.713 20 10 CFCDHM C[C@@H](NCc1cccnc1)c1cc(F)cc(F)c1[O-] ZINC000756345480 574227819 /nfs/dbraw/zinc/22/78/19/574227819.db2.gz XQJQVTLIYVQXCM-SECBINFHSA-N -1 3 264.275 2.916 20 10 CFCDHM COc1ncccc1CN[C@H](C)c1cc(F)cc(F)c1[O-] ZINC000756392702 574233022 /nfs/dbraw/zinc/23/30/22/574233022.db2.gz IYYZZQXWDYYTGT-SECBINFHSA-N -1 3 294.301 2.925 20 10 CFCDHM Cc1cc(CN(C)CC(=O)[O-])c(O)c(C(C)(C)C)c1 ZINC000740079745 574234849 /nfs/dbraw/zinc/23/48/49/574234849.db2.gz KJLLONHDZUBDSL-UHFFFAOYSA-N -1 3 265.353 2.515 20 10 CFCDHM C[C@H]1C[C@H](NCc2nccn2C)c2c1c(F)ccc2[O-] ZINC000756539710 574245038 /nfs/dbraw/zinc/24/50/38/574245038.db2.gz SBFDACJGGWYLTG-ONGXEEELSA-N -1 3 275.327 2.603 20 10 CFCDHM O=C(c1cc([O-])cs1)N1CC[C@@H]1Cc1ccccc1 ZINC000748421471 574251336 /nfs/dbraw/zinc/25/13/36/574251336.db2.gz PVGKVOQSILZVLS-GFCCVEGCSA-N -1 3 273.357 2.911 20 10 CFCDHM CCc1cc(CN[C@H](C)c2cc(F)ccc2[O-])on1 ZINC000756608106 574251961 /nfs/dbraw/zinc/25/19/61/574251961.db2.gz QFBKLIKVURMAPX-SECBINFHSA-N -1 3 264.300 2.933 20 10 CFCDHM C[C@@H](NCc1csc(N(C)C)n1)c1ccc(F)cc1[O-] ZINC000756635635 574254260 /nfs/dbraw/zinc/25/42/60/574254260.db2.gz GIOIHJADIIMDQW-SECBINFHSA-N -1 3 295.383 2.905 20 10 CFCDHM Cc1ccc(C(=O)N[C@@H]2CC[C@H](C)[C@H](C)C2)c([O-])c1O ZINC000756637932 574254636 /nfs/dbraw/zinc/25/46/36/574254636.db2.gz MJOSIVBUCINWJX-MVWJERBFSA-N -1 3 277.364 2.961 20 10 CFCDHM Cc1noc(C)c1[C@H](C)NC(=O)c1cc([O-])cs1 ZINC000733806403 574257002 /nfs/dbraw/zinc/25/70/02/574257002.db2.gz BNRXMAWUEPFUPI-LURJTMIESA-N -1 3 266.322 2.550 20 10 CFCDHM C[C@H](NCc1cccc(F)n1)c1ccc(F)cc1[O-] ZINC000756769403 574260940 /nfs/dbraw/zinc/26/09/40/574260940.db2.gz QDNWFZPVKNSHTC-VIFPVBQESA-N -1 3 264.275 2.916 20 10 CFCDHM Cc1cc(CN[C@H](C)c2cc(Cl)ccc2[O-])ncn1 ZINC000756777370 574262252 /nfs/dbraw/zinc/26/22/52/574262252.db2.gz XDAIRUZCSREGKM-SNVBAGLBSA-N -1 3 277.755 2.995 20 10 CFCDHM C[C@@H](NC[C@@](C)(O)C(F)(F)F)c1cc(F)cc(F)c1[O-] ZINC000756782471 574262352 /nfs/dbraw/zinc/26/23/52/574262352.db2.gz BMYGWGTZUJBANC-KSBSHMNSSA-N -1 3 299.239 2.634 20 10 CFCDHM CO[C@@H](CN[C@H](C)c1ccc(F)cc1[O-])C(F)(F)F ZINC000756836459 574266048 /nfs/dbraw/zinc/26/60/48/574266048.db2.gz VRYYFSBFKZXDNU-HQJQHLMTSA-N -1 3 281.249 2.759 20 10 CFCDHM Cc1ccc(CNC(=O)c2ccc(C)c(O)c2[O-])c(C)c1 ZINC000751532663 574378597 /nfs/dbraw/zinc/37/85/97/574378597.db2.gz CUSXVADMSQVYJV-UHFFFAOYSA-N -1 3 285.343 2.953 20 10 CFCDHM O=C(NCCOc1ccccc1Cl)c1cc([O-])cs1 ZINC000752640722 574393349 /nfs/dbraw/zinc/39/33/49/574393349.db2.gz IQLCKUCPIXUDCB-UHFFFAOYSA-N -1 3 297.763 2.916 20 10 CFCDHM CC(C)[C@H]1OCCC[C@@H]1CNC(=O)c1cc([O-])cs1 ZINC000752816367 574395503 /nfs/dbraw/zinc/39/55/03/574395503.db2.gz SIVCBFLQYDMWBY-ZWNOBZJWSA-N -1 3 283.393 2.635 20 10 CFCDHM CS[C@H](CNC(=O)c1ccc(C)c(O)c1[O-])C(C)(C)C ZINC000752893509 574396272 /nfs/dbraw/zinc/39/62/72/574396272.db2.gz WPCWFWVARSXRLN-LLVKDONJSA-N -1 3 297.420 2.914 20 10 CFCDHM O=C([O-])[C@H]1CCC[N@H+](Cc2c([O-])ccc3ccccc32)C1 ZINC000086728316 600712771 /nfs/dbraw/zinc/71/27/71/600712771.db2.gz SIOYMHIIWVEVSJ-ZDUSSCGKSA-N -1 3 285.343 2.842 20 10 CFCDHM O=C([O-])[C@H]1CCC[N@@H+](Cc2c([O-])ccc3ccccc32)C1 ZINC000086728316 600712773 /nfs/dbraw/zinc/71/27/73/600712773.db2.gz SIOYMHIIWVEVSJ-ZDUSSCGKSA-N -1 3 285.343 2.842 20 10 CFCDHM C[N@H+](Cc1ccc(C(=O)[O-])s1)Cc1ccccc1[O-] ZINC000830819317 601953706 /nfs/dbraw/zinc/95/37/06/601953706.db2.gz CPDOXRPRQYFPAC-UHFFFAOYSA-N -1 3 277.345 2.784 20 10 CFCDHM C[N@@H+](Cc1ccc(C(=O)[O-])s1)Cc1ccccc1[O-] ZINC000830819317 601953707 /nfs/dbraw/zinc/95/37/07/601953707.db2.gz CPDOXRPRQYFPAC-UHFFFAOYSA-N -1 3 277.345 2.784 20 10 CFCDHM C[C@H]1CN(Cc2cc(F)cc(F)c2[O-])C[C@H](C)S1 ZINC000893977857 618258874 /nfs/dbraw/zinc/25/88/74/618258874.db2.gz KVOGTZRATAFUEO-IUCAKERBSA-N -1 3 273.348 2.996 20 10 CFCDHM CC[C@@H]1CN(Cc2cc(F)cc(F)c2[O-])CCS1 ZINC000894034176 618276528 /nfs/dbraw/zinc/27/65/28/618276528.db2.gz LXOKOSZVFYGGKU-LLVKDONJSA-N -1 3 273.348 2.998 20 10 CFCDHM [O-]c1c(F)cc(F)cc1Cn1cnc2c1CCCC2 ZINC000895390007 618563245 /nfs/dbraw/zinc/56/32/45/618563245.db2.gz UMYMRUVVFGHCDT-UHFFFAOYSA-N -1 3 264.275 2.794 20 10 CFCDHM Cc1ccc(C(=O)Nc2ccc(F)c(C#N)c2)c([O-])c1O ZINC000182324772 625285473 /nfs/dbraw/zinc/28/54/73/625285473.db2.gz UOTSGGNOYQOEGK-UHFFFAOYSA-N -1 3 286.262 2.669 20 10 CFCDHM CCn1ccc(CNCc2cc(Cl)c(F)cc2[O-])n1 ZINC000840954396 619130149 /nfs/dbraw/zinc/13/01/49/619130149.db2.gz DTYHJFIPHWSDGP-UHFFFAOYSA-N -1 3 283.734 2.691 20 10 CFCDHM C[C@H]1[C@@H](CO)CCCN1Cc1c([O-])ccc(Cl)c1F ZINC000840978071 619207276 /nfs/dbraw/zinc/20/72/76/619207276.db2.gz KZMURXFESCAXBV-VHSXEESVSA-N -1 3 287.762 2.778 20 10 CFCDHM [O-]c1cccc(F)c1CNc1ncnc2c1CCCC2 ZINC000895832683 619619486 /nfs/dbraw/zinc/61/94/86/619619486.db2.gz LWVLCTFVFRWWDT-UHFFFAOYSA-N -1 3 273.311 2.812 20 10 CFCDHM O=C(NCc1c([O-])cccc1F)C1(C(F)F)CCCC1 ZINC000928705336 619995496 /nfs/dbraw/zinc/99/54/96/619995496.db2.gz HDWMISIRGHWVMV-UHFFFAOYSA-N -1 3 287.281 2.973 20 10 CFCDHM CC[C@@H](C)[C@H](C)C(=O)NCc1c([O-])cccc1F ZINC000928708572 619996469 /nfs/dbraw/zinc/99/64/69/619996469.db2.gz PNUYDSUNWKFQKG-ZJUUUORDSA-N -1 3 253.317 2.830 20 10 CFCDHM Cc1ccc(C(=O)N(C)OCc2ccccc2)c([O-])c1O ZINC000182883986 625392470 /nfs/dbraw/zinc/39/24/70/625392470.db2.gz ZEKYKCNZHDZAOX-UHFFFAOYSA-N -1 3 287.315 2.610 20 10 CFCDHM C[C@@H](N[C@@H](C)c1ccc(Cl)cc1[O-])c1ncn(C)n1 ZINC000841753435 620235883 /nfs/dbraw/zinc/23/58/83/620235883.db2.gz SZKHBDINBRNICD-DTWKUNHWSA-N -1 3 280.759 2.586 20 10 CFCDHM CC(C)(C)C(C)(C)NC(=O)c1cccc(O)c1[O-] ZINC000311051630 620435566 /nfs/dbraw/zinc/43/55/66/620435566.db2.gz GXNWGVOABLHVJU-UHFFFAOYSA-N -1 3 251.326 2.652 20 10 CFCDHM CC(C)Cc1coc(NC(=O)c2cccc(O)c2[O-])n1 ZINC000899448155 620570244 /nfs/dbraw/zinc/57/02/44/620570244.db2.gz KBDMXMCDBIIOEQ-UHFFFAOYSA-N -1 3 276.292 2.537 20 10 CFCDHM [O-]c1c(Cl)cccc1CNCc1cn(C2CC2)cn1 ZINC000902704711 621153260 /nfs/dbraw/zinc/15/32/60/621153260.db2.gz IRJIJODYJTUFNC-UHFFFAOYSA-N -1 3 277.755 2.867 20 10 CFCDHM C[C@H](NCc1cc(Cl)ccc1[O-])C(=O)OC(C)(C)C ZINC000158039483 623088695 /nfs/dbraw/zinc/08/86/95/623088695.db2.gz RFPVXWJIXBKDNN-VIFPVBQESA-N -1 3 285.771 2.865 20 10 CFCDHM C[C@H]1CCC[C@H](NC(=O)c2cccc(O)c2[O-])CC1 ZINC000227535397 623111929 /nfs/dbraw/zinc/11/19/29/623111929.db2.gz OJJXXHIYISDEGM-QWRGUYRKSA-N -1 3 263.337 2.796 20 10 CFCDHM CCOC(=O)CN(CC)Cc1cc(Cl)c(C)cc1[O-] ZINC000824606227 623531018 /nfs/dbraw/zinc/53/10/18/623531018.db2.gz PTADTHLWNMSRFA-UHFFFAOYSA-N -1 3 285.771 2.739 20 10 CFCDHM Cc1cc([O-])c(CN2CCO[C@H](C)[C@@H]2C)cc1Cl ZINC000824815107 623571291 /nfs/dbraw/zinc/57/12/91/623571291.db2.gz ZNRIVPWBUMWRIL-WDEREUQCSA-N -1 3 269.772 2.963 20 10 CFCDHM Cc1cc([O-])c(CN2CCC[C@]23CCOC3=O)cc1Cl ZINC000825567904 623717407 /nfs/dbraw/zinc/71/74/07/623717407.db2.gz OWNWSVQWVXFNHC-OAHLLOKOSA-N -1 3 295.766 2.636 20 10 CFCDHM Cc1cc([O-])c(CN2CCOCC(F)(F)C2)cc1Cl ZINC000825943732 623773274 /nfs/dbraw/zinc/77/32/74/623773274.db2.gz JLJNIFRGKCEGSY-UHFFFAOYSA-N -1 3 291.725 2.822 20 10 CFCDHM [O-]c1cc(Br)ccc1CN1CC2(CC2)C1 ZINC000826029526 623784466 /nfs/dbraw/zinc/78/44/66/623784466.db2.gz HHJGIDKKDJSATO-UHFFFAOYSA-N -1 3 268.154 2.751 20 10 CFCDHM Cc1cc([O-])c(CN2CCO[C@@H](CF)C2)cc1Cl ZINC000826121707 623795820 /nfs/dbraw/zinc/79/58/20/623795820.db2.gz SVYPRAJUKCWXSF-NSHDSACASA-N -1 3 273.735 2.524 20 10 CFCDHM Cc1cc([O-])c(CN2CC[C@H](O)C(F)(F)C2)c(Cl)c1 ZINC000826952820 623913787 /nfs/dbraw/zinc/91/37/87/623913787.db2.gz UJWBKODOWCXNSP-LBPRGKRZSA-N -1 3 291.725 2.556 20 10 CFCDHM C[C@H]1CC[C@H](NC(=O)NCc2c([O-])cccc2F)CC1 ZINC000917551519 624358870 /nfs/dbraw/zinc/35/88/70/624358870.db2.gz DFLHNQHSPBJHRJ-XYPYZODXSA-N -1 3 280.343 2.909 20 10 CFCDHM C[C@H]1CCC[C@@H](C2CN(C(=O)c3cccc(O)c3[O-])C2)C1 ZINC000829119597 624377904 /nfs/dbraw/zinc/37/79/04/624377904.db2.gz OQECZDPMAHKWHH-NWDGAFQWSA-N -1 3 289.375 2.996 20 10 CFCDHM C[C@@H]1C[C@@H]2C[C@@H]2C[C@@H]1C(=O)NCc1c([O-])cccc1F ZINC000830181224 624659717 /nfs/dbraw/zinc/65/97/17/624659717.db2.gz YEJYRJAIJXSNJU-KKOKHZNYSA-N -1 3 277.339 2.830 20 10 CFCDHM CCC[C@H]1C[C@H]1NC(=O)NCc1c([O-])cccc1F ZINC000921033619 624799362 /nfs/dbraw/zinc/79/93/62/624799362.db2.gz VFMWXHMIVRXYLZ-JOYOIKCWSA-N -1 3 266.316 2.519 20 10 CFCDHM CC1(CNC(=O)NCc2c([O-])cccc2F)CCC1 ZINC000921352357 624855388 /nfs/dbraw/zinc/85/53/88/624855388.db2.gz LIXZCDAEQAGAQX-UHFFFAOYSA-N -1 3 266.316 2.521 20 10 CFCDHM Cc1ccc(C(=O)N(C)c2ccc(F)cc2)c([O-])c1O ZINC000182145314 625261022 /nfs/dbraw/zinc/26/10/22/625261022.db2.gz WOMPCECGKSMZDO-UHFFFAOYSA-N -1 3 275.279 2.822 20 10 CFCDHM O=C(NC(C1CCC1)C1CCC1)c1cccc(O)c1[O-] ZINC000325341181 625907776 /nfs/dbraw/zinc/90/77/76/625907776.db2.gz DRVICXBZKYQECD-UHFFFAOYSA-N -1 3 275.348 2.796 20 10 CFCDHM O=C(NCCC1(F)CCC1)NCc1c([O-])cccc1F ZINC000922480169 626293545 /nfs/dbraw/zinc/29/35/45/626293545.db2.gz LREMCBKTGPVESY-UHFFFAOYSA-N -1 3 284.306 2.613 20 10 CFCDHM [O-]c1c(F)cc(F)cc1CN[C@@H](c1ncccn1)C1CC1 ZINC000922578080 626314847 /nfs/dbraw/zinc/31/48/47/626314847.db2.gz YGHBFCHAYDNRLF-CYBMUJFWSA-N -1 3 291.301 2.701 20 10 CFCDHM CC(C)[C@]1(C)C[C@@H]1NC(=O)NCc1c([O-])cccc1F ZINC000922849507 626381693 /nfs/dbraw/zinc/38/16/93/626381693.db2.gz KWTFQTXDBVJUNN-ZFWWWQNUSA-N -1 3 280.343 2.765 20 10 CFCDHM C[C@H]1CN(C(=O)c2cccc(O)c2[O-])c2ccccc21 ZINC000186947345 626407035 /nfs/dbraw/zinc/40/70/35/626407035.db2.gz JGCVPFCEJSVDCH-JTQLQIEISA-N -1 3 269.300 2.862 20 10 CFCDHM CCC[C@H](C)c1cc(NC(=O)c2cccc(O)c2[O-])n[nH]1 ZINC000187129453 626460599 /nfs/dbraw/zinc/46/05/99/626460599.db2.gz AEXHKVODZWQHOI-VIFPVBQESA-N -1 3 289.335 2.977 20 10 CFCDHM [O-]c1cc(F)c(Cl)cc1CN1CC2(C1)CCCOC2 ZINC000839137315 626528073 /nfs/dbraw/zinc/52/80/73/626528073.db2.gz DWNMTPGYHYNIGQ-UHFFFAOYSA-N -1 3 285.746 2.797 20 10 CFCDHM CCCN1CC(=O)N[C@H]1c1cc(-c2ccccc2)ccc1[O-] ZINC000840824811 626548733 /nfs/dbraw/zinc/54/87/33/626548733.db2.gz OTYJNLPPCCRBDS-GOSISDBHSA-N -1 3 296.370 2.900 20 10 CFCDHM CC(=O)c1cc(F)cc(CN2CCC[C@H]2C(F)F)c1[O-] ZINC000761120034 626807827 /nfs/dbraw/zinc/80/78/27/626807827.db2.gz RAEBGAMJLGMWMP-LBPRGKRZSA-N -1 3 287.281 2.963 20 10 CFCDHM CC1(O)CCN(Cc2cc(Cl)cc(F)c2[O-])CC1 ZINC000775701356 628056540 /nfs/dbraw/zinc/05/65/40/628056540.db2.gz SGSJRJMEGDCUEA-UHFFFAOYSA-N -1 3 273.735 2.532 20 10 CFCDHM CC(=O)c1cc(F)cc(CN2CCO[C@H](C(C)C)C2)c1[O-] ZINC000778243107 628291953 /nfs/dbraw/zinc/29/19/53/628291953.db2.gz SJRYXYYOTIAEAW-HNNXBMFYSA-N -1 3 295.354 2.591 20 10 CFCDHM COC(=O)[C@H]1CCCCCN1Cc1cc(Cl)ccc1[O-] ZINC000781527412 628557693 /nfs/dbraw/zinc/55/76/93/628557693.db2.gz NGLRGQGBAFGSAS-CYBMUJFWSA-N -1 3 297.782 2.963 20 10 CFCDHM CCc1ccc(C(=O)NCc2ccccc2O)c([O-])c1 ZINC000787131108 628995165 /nfs/dbraw/zinc/99/51/65/628995165.db2.gz HHLPVKKOWOJEBL-UHFFFAOYSA-N -1 3 271.316 2.590 20 10 CFCDHM COC(=O)CN(Cc1cc(Cl)ccc1[O-])CC1(C)CC1 ZINC000787166142 628997209 /nfs/dbraw/zinc/99/72/09/628997209.db2.gz NIPVKMVZCBACKW-UHFFFAOYSA-N -1 3 297.782 2.821 20 10 CFCDHM C[C@@H]1C[C@@H](O)CN1Cc1cc(Cl)cc(Cl)c1[O-] ZINC000788269055 629053236 /nfs/dbraw/zinc/05/32/36/629053236.db2.gz KYEHQXDYOCOJTD-GMSGAONNSA-N -1 3 276.163 2.654 20 10 CFCDHM CCN1CC(=O)N[C@H]1c1cc(-c2ccccc2)ccc1[O-] ZINC000788689546 629092913 /nfs/dbraw/zinc/09/29/13/629092913.db2.gz GXRYMBSQZJKLFS-QGZVFWFLSA-N -1 3 282.343 2.510 20 10 CFCDHM O=C(Nc1cccc(N2CCCC2)c1)c1cccc(O)c1[O-] ZINC000790551294 629247297 /nfs/dbraw/zinc/24/72/97/629247297.db2.gz LKXMPQHGAXBSFN-UHFFFAOYSA-N -1 3 298.342 2.950 20 10 CFCDHM O=C(c1cccc(O)c1[O-])N1CC[C@H]1c1cccc(F)c1 ZINC000790809821 629265694 /nfs/dbraw/zinc/26/56/94/629265694.db2.gz ZTCOPEAGAGMGJM-ZDUSSCGKSA-N -1 3 287.290 2.824 20 10 CFCDHM Cc1cccc(C)c1CNC(=O)c1cccc(O)c1[O-] ZINC000790892019 629270193 /nfs/dbraw/zinc/27/01/93/629270193.db2.gz TVZGBSVAOFHYGZ-UHFFFAOYSA-N -1 3 271.316 2.645 20 10 CFCDHM CC[C@@H](C)n1nc(NC(=O)c2cccc(O)c2[O-])cc1C ZINC000790914741 629271145 /nfs/dbraw/zinc/27/11/45/629271145.db2.gz CYUUADITXWTMMT-SECBINFHSA-N -1 3 289.335 2.826 20 10 CFCDHM CC[C@H](C)n1nc(NC(=O)c2cccc(O)c2[O-])cc1C ZINC000790914745 629271371 /nfs/dbraw/zinc/27/13/71/629271371.db2.gz CYUUADITXWTMMT-VIFPVBQESA-N -1 3 289.335 2.826 20 10 CFCDHM CCCN1CCN(Cc2c([O-])ccc(Cl)c2F)CC1 ZINC000792156455 629403385 /nfs/dbraw/zinc/40/33/85/629403385.db2.gz GPMJNADOADKRQS-UHFFFAOYSA-N -1 3 286.778 2.712 20 10 CFCDHM C[C@]1(CO)CCCN1Cc1c([O-])ccc(Cl)c1F ZINC000792180795 629406887 /nfs/dbraw/zinc/40/68/87/629406887.db2.gz URSISZYXCUSZJC-CYBMUJFWSA-N -1 3 273.735 2.532 20 10 CFCDHM Cc1ccc(C(=O)Nc2cccc3c2CCO3)c([O-])c1O ZINC000794147442 629616807 /nfs/dbraw/zinc/61/68/07/629616807.db2.gz KITVLXXNIKYLNH-UHFFFAOYSA-N -1 3 285.299 2.593 20 10 CFCDHM Cc1cc(NCc2cc(Cl)cc(Cl)c2[O-])nc(N)n1 ZINC000808090209 630949404 /nfs/dbraw/zinc/94/94/04/630949404.db2.gz UBOAVQJEFBOMBM-UHFFFAOYSA-N -1 3 299.161 2.992 20 10 CFCDHM CCN(Cc1cn(C)nn1)Cc1c([O-])cc(C)cc1Cl ZINC000840936479 631268374 /nfs/dbraw/zinc/26/83/74/631268374.db2.gz JTJCZEXBNAMKJY-UHFFFAOYSA-N -1 3 294.786 2.505 20 10 CFCDHM COC[C@H]1CN(Cc2c([O-])cc(C)cc2Cl)C[C@@H](C)O1 ZINC000840940415 631272014 /nfs/dbraw/zinc/27/20/14/631272014.db2.gz YRBHYUGIGFMSGC-VXGBXAGGSA-N -1 3 299.798 2.590 20 10 CFCDHM Cc1cc([O-])c(CN2CC(OCC(F)F)C2)c(Cl)c1 ZINC000840953723 631280411 /nfs/dbraw/zinc/28/04/11/631280411.db2.gz XJORPXQXEGVFPS-UHFFFAOYSA-N -1 3 291.725 2.820 20 10 CFCDHM Cc1cc(Cl)cc(C[N@@H+](C)C[C@H](C)C(=O)[O-])c1[O-] ZINC000840999362 631299217 /nfs/dbraw/zinc/29/92/17/631299217.db2.gz VDSMIYVLRTXWIY-VIFPVBQESA-N -1 3 271.744 2.507 20 10 CFCDHM Cc1cc(Cl)cc(C[N@H+](C)C[C@H](C)C(=O)[O-])c1[O-] ZINC000840999362 631299225 /nfs/dbraw/zinc/29/92/25/631299225.db2.gz VDSMIYVLRTXWIY-VIFPVBQESA-N -1 3 271.744 2.507 20 10 CFCDHM COCc1nc(CNCc2cc(Cl)ccc2[O-])cs1 ZINC000810170840 631338057 /nfs/dbraw/zinc/33/80/57/631338057.db2.gz QMTZVTUQJATURS-UHFFFAOYSA-N -1 3 298.795 2.938 20 10 CFCDHM C[C@@H](N[C@@H](C)c1ncn(C)n1)c1ccc(Cl)cc1[O-] ZINC000841753433 631466219 /nfs/dbraw/zinc/46/62/19/631466219.db2.gz SZKHBDINBRNICD-BDAKNGLRSA-N -1 3 280.759 2.586 20 10 CFCDHM CON(C[C@H]1CCC[C@H](C)C1)C(=O)c1cccc(O)c1[O-] ZINC000812419711 631714508 /nfs/dbraw/zinc/71/45/08/631714508.db2.gz OYLDMCJWHHIMKU-RYUDHWBXSA-N -1 3 293.363 2.928 20 10 CFCDHM CN(Cc1cnccn1)Cc1cc(Cl)c(F)cc1[O-] ZINC000816498201 632471410 /nfs/dbraw/zinc/47/14/10/632471410.db2.gz KXOJONVTKBYLNP-UHFFFAOYSA-N -1 3 281.718 2.607 20 10 CFCDHM [O-]c1ccc(F)c(CNCc2ccccc2O)c1F ZINC000816545636 632481564 /nfs/dbraw/zinc/48/15/64/632481564.db2.gz YXUDEZHEUNIWDW-UHFFFAOYSA-N -1 3 265.259 2.666 20 10 CFCDHM [O-]c1cc(F)c(Cl)cc1CN1CCOCC2(CC2)C1 ZINC000816567069 632486161 /nfs/dbraw/zinc/48/61/61/632486161.db2.gz PMGVHQDYOQARBL-UHFFFAOYSA-N -1 3 285.746 2.797 20 10 CFCDHM COC(=O)[C@@H](C)N(C)Cc1ccc2ccccc2c1[O-] ZINC000816595767 632491321 /nfs/dbraw/zinc/49/13/21/632491321.db2.gz AATGPBGLBBJEOU-LLVKDONJSA-N -1 3 273.332 2.539 20 10 CFCDHM COc1ccncc1CNCc1cc(Cl)cc(F)c1[O-] ZINC000816618617 632495621 /nfs/dbraw/zinc/49/56/21/632495621.db2.gz CMLKMULXRWHXPH-UHFFFAOYSA-N -1 3 296.729 2.878 20 10 CFCDHM COCc1cnc(CNCc2cc(Cl)ccc2[O-])s1 ZINC000846054382 632625087 /nfs/dbraw/zinc/62/50/87/632625087.db2.gz AJYZGNUWGAKNCH-UHFFFAOYSA-N -1 3 298.795 2.938 20 10 CFCDHM CC(C)(C)C[C@@H]1C[C@H]1NC(=O)c1cccc(O)c1[O-] ZINC000846371929 632699541 /nfs/dbraw/zinc/69/95/41/632699541.db2.gz FOCWSUBSMLPCIT-GXSJLCMTSA-N -1 3 263.337 2.652 20 10 CFCDHM CC[C@H](NCC(F)(F)CN)c1cccc(Cl)c1[O-] ZINC000817967888 632766094 /nfs/dbraw/zinc/76/60/94/632766094.db2.gz NECACXBMLSMMKJ-JTQLQIEISA-N -1 3 278.730 2.680 20 10 CFCDHM O=C(Nc1ccc([C@H]2CCOC2)cc1)c1cccc(O)c1[O-] ZINC000818731121 632895114 /nfs/dbraw/zinc/89/51/14/632895114.db2.gz PDMROSXHQHCSLI-LBPRGKRZSA-N -1 3 299.326 2.854 20 10 CFCDHM C[C@@H](NCc1cscn1)c1ccc(F)cc1[O-] ZINC000108941640 633744560 /nfs/dbraw/zinc/74/45/60/633744560.db2.gz OJPBDILCZXWEGK-MRVPVSSYSA-N -1 3 252.314 2.839 20 10 CFCDHM Cc1cc([O-])c(CN[C@@H](C)c2nccn2C)c(Cl)c1 ZINC000850409956 633981584 /nfs/dbraw/zinc/98/15/84/633981584.db2.gz JKFBWXCDXRVCCF-JTQLQIEISA-N -1 3 279.771 2.938 20 10 CFCDHM CC[C@H](N[C@H]1C[C@@H](C)n2ncnc21)c1ccc(F)cc1[O-] ZINC000850498869 634018947 /nfs/dbraw/zinc/01/89/47/634018947.db2.gz FDXJZWFJWRAUQH-ICCXJUOJSA-N -1 3 290.342 2.870 20 10 CFCDHM O=C(NC1CCC2(CC2(F)F)CC1)c1cccc(O)c1[O-] ZINC000855960166 635698987 /nfs/dbraw/zinc/69/89/87/635698987.db2.gz HXBUVUJRKYHQMT-UHFFFAOYSA-N -1 3 297.301 2.796 20 10 CFCDHM Cc1cc(Cl)cc(C[N@@H+]2CC[C@H](C(=O)[O-])[C@@H](C)C2)c1[O-] ZINC000863739008 637766500 /nfs/dbraw/zinc/76/65/00/637766500.db2.gz GSMUEMFZXFSKQA-GWCFXTLKSA-N -1 3 297.782 2.897 20 10 CFCDHM Cc1cc(Cl)cc(C[N@H+]2CC[C@H](C(=O)[O-])[C@@H](C)C2)c1[O-] ZINC000863739008 637766505 /nfs/dbraw/zinc/76/65/05/637766505.db2.gz GSMUEMFZXFSKQA-GWCFXTLKSA-N -1 3 297.782 2.897 20 10 CFCDHM C/C=C/C[C@H]1CCCN(C(=O)c2cccc(O)c2[O-])C1 ZINC000863817376 637788404 /nfs/dbraw/zinc/78/84/04/637788404.db2.gz KPPJJFKGTBMMAZ-JDGPPOGSSA-N -1 3 275.348 2.916 20 10 CFCDHM CCc1cc(O)ccc1NC(=O)c1cccc(O)c1[O-] ZINC000191036476 650475153 /nfs/dbraw/zinc/47/51/53/650475153.db2.gz GKONBJUVHQDGEF-UHFFFAOYSA-N -1 3 273.288 2.618 20 10 CFCDHM Cc1nonc1CN[C@@H](C)c1ccc(Cl)cc1[O-] ZINC000872135509 641664107 /nfs/dbraw/zinc/66/41/07/641664107.db2.gz HYFBDHJBEHDDGK-ZETCQYMHSA-N -1 3 267.716 2.588 20 10 CFCDHM CC1(C)CN(Cc2ccc(F)c(F)c2[O-])CCS1 ZINC000876748226 642992965 /nfs/dbraw/zinc/99/29/65/642992965.db2.gz YXPZXGZQRAGMAZ-UHFFFAOYSA-N -1 3 273.348 2.998 20 10 CFCDHM O=C(Nc1cccc2ncccc21)c1cccc(O)c1[O-] ZINC000126205068 643048547 /nfs/dbraw/zinc/04/85/47/643048547.db2.gz KYTZXBDGJRROCE-UHFFFAOYSA-N -1 3 280.283 2.898 20 10 CFCDHM CCc1ccc(NC(=O)c2cccc(O)c2[O-])cc1 ZINC000126227528 643055414 /nfs/dbraw/zinc/05/54/14/643055414.db2.gz BJMMWLDVJIDUDT-UHFFFAOYSA-N -1 3 257.289 2.913 20 10 CFCDHM CC[C@H]1CCCC[C@@H]1NC(=O)c1cccc(O)c1[O-] ZINC000126298940 643110104 /nfs/dbraw/zinc/11/01/04/643110104.db2.gz NKYPBOQCKCXCTO-JQWIXIFHSA-N -1 3 263.337 2.796 20 10 CFCDHM [O-]c1c(CN[C@H]2CCCc3c[nH]nc32)ccc(F)c1F ZINC000877110533 643156751 /nfs/dbraw/zinc/15/67/51/643156751.db2.gz XTYQGUHCVPDPIX-NSHDSACASA-N -1 3 279.290 2.561 20 10 CFCDHM C[C@@H](CNC(=O)c1cccc(O)c1[O-])C(C)(C)C ZINC000126520553 643263304 /nfs/dbraw/zinc/26/33/04/643263304.db2.gz JIOJJZUYTAOZIE-VIFPVBQESA-N -1 3 251.326 2.510 20 10 CFCDHM CC(C)(C)[C@H]1CCN(C(=O)c2cccc(O)c2[O-])C1 ZINC000126538338 643289929 /nfs/dbraw/zinc/28/99/29/643289929.db2.gz ZMFUFRNGIJMQCE-JTQLQIEISA-N -1 3 263.337 2.606 20 10 CFCDHM C[C@H]1C[C@H](NC(=O)c2cccc(O)c2[O-])C[C@@H](C)C1 ZINC000249290139 650958157 /nfs/dbraw/zinc/95/81/57/650958157.db2.gz KEROQGFGWUWBOA-URLYPYJESA-N -1 3 263.337 2.652 20 10 CFCDHM CCc1cc(CNCc2cc(F)cc(F)c2[O-])on1 ZINC000883016965 645564856 /nfs/dbraw/zinc/56/48/56/645564856.db2.gz SNFSZAPYCIDRAB-UHFFFAOYSA-N -1 3 268.263 2.511 20 10 CFCDHM C[C@H](NCc1cccc(N(C)C)n1)c1c([O-])cccc1F ZINC000886556672 647046346 /nfs/dbraw/zinc/04/63/46/647046346.db2.gz HQQSHYJAUZUQLJ-NSHDSACASA-N -1 3 289.354 2.843 20 10 CFCDHM COc1cccnc1CN[C@@H](C)c1c([O-])cccc1F ZINC000886621781 647072695 /nfs/dbraw/zinc/07/26/95/647072695.db2.gz AXWRACYKVQSLAL-JTQLQIEISA-N -1 3 276.311 2.786 20 10 CFCDHM CC[C@@H]1CCC[C@@H]1C(=O)NCc1c([O-])cccc1F ZINC000928705902 648944733 /nfs/dbraw/zinc/94/47/33/648944733.db2.gz MLWYJPQTXGKOAL-MNOVXSKESA-N -1 3 265.328 2.974 20 10 CFCDHM C[C@@H]1CCC[C@H](OCC(=O)NCc2c([O-])cccc2F)C1 ZINC000928706730 648945673 /nfs/dbraw/zinc/94/56/73/648945673.db2.gz YPPNYIJBPSXOLG-NEPJUHHUSA-N -1 3 295.354 2.743 20 10 CFCDHM CCc1nc(C)c(C(=O)NCc2c([O-])cccc2F)s1 ZINC000928710365 648946682 /nfs/dbraw/zinc/94/66/82/648946682.db2.gz CFLVWYJYGWVBSR-UHFFFAOYSA-N -1 3 294.351 2.789 20 10 CFCDHM O=C(NCc1c([O-])cccc1F)[C@H]1CCCC12CC2 ZINC000928710930 648946856 /nfs/dbraw/zinc/94/68/56/648946856.db2.gz YELXGIUGBXGTGO-LLVKDONJSA-N -1 3 263.312 2.728 20 10 CFCDHM CC(=O)c1cc(F)cc(CN2CC[C@@H]2C(F)F)c1[O-] ZINC000931424659 649424023 /nfs/dbraw/zinc/42/40/23/649424023.db2.gz MRAGDWXDLQAYNV-LLVKDONJSA-N -1 3 273.254 2.573 20 10 CFCDHM C[C@@H]1CN(Cc2cc(F)cc(Cl)c2[O-])CC[C@]1(C)O ZINC001237807544 779719250 /nfs/dbraw/zinc/71/92/50/779719250.db2.gz LONLGTRAKDUIID-OTYXRUKQSA-N -1 3 287.762 2.778 20 10 CFCDHM O=C(NC/C=C\c1ccccc1)c1cccc(O)c1[O-] ZINC000588612057 775281616 /nfs/dbraw/zinc/28/16/16/775281616.db2.gz ZDPRCSAXNINGEM-YVMONPNESA-N -1 3 269.300 2.541 20 10 CFCDHM O=C(NCc1c([O-])cccc1F)NCC12CCC(CC1)C2 ZINC001225389695 775439786 /nfs/dbraw/zinc/43/97/86/775439786.db2.gz VUOMAAKNIISGFZ-UHFFFAOYSA-N -1 3 292.354 2.911 20 10 CFCDHM C[N@H+](Cc1ccccc1)Cc1ccc(C(=O)[O-])cc1[O-] ZINC001231449068 777221890 /nfs/dbraw/zinc/22/18/90/777221890.db2.gz UVCGDBUNPWVCNP-UHFFFAOYSA-N -1 3 271.316 2.722 20 10 CFCDHM C[N@@H+](Cc1ccccc1)Cc1ccc(C(=O)[O-])cc1[O-] ZINC001231449068 777221895 /nfs/dbraw/zinc/22/18/95/777221895.db2.gz UVCGDBUNPWVCNP-UHFFFAOYSA-N -1 3 271.316 2.722 20 10 CFCDHM C[N@H+](CCc1cccs1)Cc1ccc(C(=O)[O-])cc1[O-] ZINC001231452673 777223473 /nfs/dbraw/zinc/22/34/73/777223473.db2.gz REBKWRCKORZWFR-UHFFFAOYSA-N -1 3 291.372 2.826 20 10 CFCDHM C[N@@H+](CCc1cccs1)Cc1ccc(C(=O)[O-])cc1[O-] ZINC001231452673 777223481 /nfs/dbraw/zinc/22/34/81/777223481.db2.gz REBKWRCKORZWFR-UHFFFAOYSA-N -1 3 291.372 2.826 20 10 CFCDHM Cc1cccc2c1CN(Cc1cc(C(=O)[O-])ccc1O)C2 ZINC001231560756 777259417 /nfs/dbraw/zinc/25/94/17/777259417.db2.gz LRAXBYBDOPJMSR-UHFFFAOYSA-N -1 3 283.327 2.915 20 10 CFCDHM O=C([O-])c1ccc([O-])c(C[N@@H+]2CCC[C@@H]3CCC[C@H]32)c1 ZINC001231565010 777261637 /nfs/dbraw/zinc/26/16/37/777261637.db2.gz MYRXNBYJEWJFBN-SMDDNHRTSA-N -1 3 275.348 2.855 20 10 CFCDHM O=C([O-])c1ccc([O-])c(C[N@H+]2CCC[C@@H]3CCC[C@H]32)c1 ZINC001231565010 777261645 /nfs/dbraw/zinc/26/16/45/777261645.db2.gz MYRXNBYJEWJFBN-SMDDNHRTSA-N -1 3 275.348 2.855 20 10 CFCDHM Cc1cc([O-])c(CN2CCC(=O)[C@@H](F)CC2)cc1Cl ZINC001231868901 777357174 /nfs/dbraw/zinc/35/71/74/777357174.db2.gz ZMGXAMSEVZBLNZ-LBPRGKRZSA-N -1 3 285.746 2.857 20 10 CFCDHM Cc1cc([O-])c(CN2CCc3nn(C)cc3C2)cc1Cl ZINC001231870110 777359546 /nfs/dbraw/zinc/35/95/46/777359546.db2.gz JVKOXFQRWZPSRW-UHFFFAOYSA-N -1 3 291.782 2.646 20 10 CFCDHM COc1cc([O-])c(CN2CC(OC(C)C)C2)cc1Cl ZINC001232267701 777499123 /nfs/dbraw/zinc/49/91/23/777499123.db2.gz FHFCJWOUKLPHNW-UHFFFAOYSA-N -1 3 285.771 2.663 20 10 CFCDHM COc1cc([O-])c(CN2CCOC[C@H]2C2CC2)cc1Cl ZINC001232267454 777499457 /nfs/dbraw/zinc/49/94/57/777499457.db2.gz CBMYHXBBCUFZON-ZDUSSCGKSA-N -1 3 297.782 2.665 20 10 CFCDHM COc1cc([O-])c(CN2CC(F)(C3CC3)C2)cc1Cl ZINC001232266350 777499767 /nfs/dbraw/zinc/49/97/67/777499767.db2.gz LQFMSSVEQSAAFB-UHFFFAOYSA-N -1 3 285.746 2.988 20 10 CFCDHM CC[C@@H]1COCCN1Cc1cc(Cl)c(OC)cc1[O-] ZINC001232269097 777501593 /nfs/dbraw/zinc/50/15/93/777501593.db2.gz AGQHLZYBBJIMSM-LLVKDONJSA-N -1 3 285.771 2.665 20 10 CFCDHM [O-]c1cnc(Cl)cc1CN1CCc2cccc(O)c2C1 ZINC001233039139 777774914 /nfs/dbraw/zinc/77/49/14/777774914.db2.gz NOWFZOOPLJLXAH-UHFFFAOYSA-N -1 3 290.750 2.705 20 10 CFCDHM [O-]c1ccc(F)c(F)c1CN1CC[C@H]2CCCO[C@H]2C1 ZINC001233332760 777893909 /nfs/dbraw/zinc/89/39/09/777893909.db2.gz WRIBAVTTXMABEI-YGRLFVJLSA-N -1 3 283.318 2.671 20 10 CFCDHM C[C@@]1(O)CCN(Cc2cc(Cl)c(Cl)cc2[O-])C1 ZINC001236794733 778941426 /nfs/dbraw/zinc/94/14/26/778941426.db2.gz UHURQUKAPSURNT-GFCCVEGCSA-N -1 3 276.163 2.656 20 10 CFCDHM COc1cc([O-])c(CN2C[C@H](C)O[C@@H](C)C2)c(Cl)c1 ZINC001236804791 778947249 /nfs/dbraw/zinc/94/72/49/778947249.db2.gz ZPXRNLCOJXVESH-UWVGGRQHSA-N -1 3 285.771 2.663 20 10 CFCDHM [O-]c1ccc(Cl)c(Cl)c1CN1CC[C@H](CO)C1 ZINC001237080883 779006704 /nfs/dbraw/zinc/00/67/04/779006704.db2.gz GWZIENSICJOBAU-QMMMGPOBSA-N -1 3 276.163 2.513 20 10 CFCDHM CCN1CCN(Cc2c([O-])ccc(Cl)c2Cl)CC1 ZINC001237078518 779006749 /nfs/dbraw/zinc/00/67/49/779006749.db2.gz UBIYNEUFYLUUSM-UHFFFAOYSA-N -1 3 289.206 2.837 20 10 CFCDHM COC(CN(C)Cc1c([O-])ccc(Cl)c1Cl)OC ZINC001237084197 779008503 /nfs/dbraw/zinc/00/85/03/779008503.db2.gz HXSRNIOGEOGYTO-UHFFFAOYSA-N -1 3 294.178 2.750 20 10 CFCDHM [O-]c1ccc(Cl)c(Cl)c1CN1CCN2CC[C@@H]2C1 ZINC001237086719 779009091 /nfs/dbraw/zinc/00/90/91/779009091.db2.gz NWSWCUXVERTFFE-SECBINFHSA-N -1 3 287.190 2.589 20 10 CFCDHM [O-]c1c(Cl)cc(F)cc1CN1CCCC[C@@H](O)C1 ZINC001237807455 779184464 /nfs/dbraw/zinc/18/44/64/779184464.db2.gz JDMPZZKYRVJISZ-LLVKDONJSA-N -1 3 273.735 2.532 20 10 CFCDHM CC1(O)CCN(Cc2cc(F)cc(Cl)c2[O-])CC1 ZINC001237808061 779184567 /nfs/dbraw/zinc/18/45/67/779184567.db2.gz PVROGCZMYZCLAH-UHFFFAOYSA-N -1 3 273.735 2.532 20 10 CFCDHM C[C@@H]1CCN(Cc2cc(F)cc(Cl)c2[O-])C[C@@]1(C)O ZINC001237809070 779185936 /nfs/dbraw/zinc/18/59/36/779185936.db2.gz YYDHGDHRQPVUMR-YMTOWFKASA-N -1 3 287.762 2.778 20 10 CFCDHM CN(Cc1cnn(C)c1)Cc1cc(F)c(Cl)cc1[O-] ZINC001237948019 779213870 /nfs/dbraw/zinc/21/38/70/779213870.db2.gz YGDNWNODQLQCJN-UHFFFAOYSA-N -1 3 283.734 2.550 20 10 CFCDHM CO[C@@H]1CCCN(Cc2cc(F)cc(Cl)c2[O-])C1 ZINC001237798197 779717993 /nfs/dbraw/zinc/71/79/93/779717993.db2.gz AAPBTPIJDFTQSE-LLVKDONJSA-N -1 3 273.735 2.796 20 10 CFCDHM [O-]c1cccc(Br)c1CN1CC[C@H](F)C1 ZINC000707129638 781226895 /nfs/dbraw/zinc/22/68/95/781226895.db2.gz JWCCDCJDZMOEIW-QMMMGPOBSA-N -1 3 274.133 2.699 20 10 CFCDHM O=C(c1cccc(O)c1[O-])N1CC[C@@H](C2CCCC2)C1 ZINC000708850411 781283315 /nfs/dbraw/zinc/28/33/15/781283315.db2.gz OUXYSYGVHWWVIT-GFCCVEGCSA-N -1 3 275.348 2.750 20 10 CFCDHM C[C@H](NC[C@@H](O)C(F)(F)F)c1cc(Cl)ccc1[O-] ZINC000273441276 299302820 /nfs/dbraw/zinc/30/28/20/299302820.db2.gz YMEXFXZYIQJDRD-QUBYGPBYSA-N -1 3 283.677 2.619 20 10 CFCDHM CCCOc1ccc(CN2CCOCC23CCC3)c([O-])c1 ZINC000093510425 375259397 /nfs/dbraw/zinc/25/93/97/375259397.db2.gz FGYXLPPFFVHMCP-UHFFFAOYSA-N -1 3 291.391 2.936 20 10 CFCDHM C[C@H]1O[C@@H](C)[C@@H](C)[C@@H]1C(=O)NCc1cc(Cl)ccc1[O-] ZINC000529513803 383714814 /nfs/dbraw/zinc/71/48/14/383714814.db2.gz UFKRGMXOTBSKLO-PUXPGTEJSA-N -1 3 297.782 2.721 20 10 CFCDHM COC1CCN(Cc2cccc(Cl)c2[O-])CC1 ZINC000124522456 377058612 /nfs/dbraw/zinc/05/86/12/377058612.db2.gz DHNYOOBNVPIWTC-UHFFFAOYSA-N -1 3 255.745 2.656 20 10 CFCDHM O=C(c1cccc(O)c1[O-])N1CC2(CCC2)[C@@H]1C1CC1 ZINC000291033514 296253749 /nfs/dbraw/zinc/25/37/49/296253749.db2.gz FMIVXQWKNLUYAB-AWEZNQCLSA-N -1 3 273.332 2.503 20 10 CFCDHM [O-]c1ccc(Cl)cc1CN1CCO[C@H]2CCC[C@@H]21 ZINC000132758756 377873734 /nfs/dbraw/zinc/87/37/34/377873734.db2.gz YJXFTVWUIBVSTP-JSGCOSHPSA-N -1 3 267.756 2.799 20 10 CFCDHM C[C@@H]1CN(Cc2c([O-])cccc2Cl)CCCO1 ZINC000134153410 377987888 /nfs/dbraw/zinc/98/78/88/377987888.db2.gz LZRNORHSPAUAHI-SNVBAGLBSA-N -1 3 255.745 2.656 20 10 CFCDHM Cc1cc(Cl)cc(CN2CCO[C@@H](C)C2)c1[O-] ZINC000179646879 380566959 /nfs/dbraw/zinc/56/69/59/380566959.db2.gz NPSHUMWIJWNSGL-JTQLQIEISA-N -1 3 255.745 2.575 20 10 CFCDHM CO[C@H]1CCCN(Cc2cccc(Cl)c2[O-])C1 ZINC000179749810 380576844 /nfs/dbraw/zinc/57/68/44/380576844.db2.gz BAWMWIDPAWWETD-NSHDSACASA-N -1 3 255.745 2.656 20 10 CFCDHM C[C@H]1CN(Cc2cc(F)ccc2[O-])CC(C)(C)O1 ZINC000179982825 380605864 /nfs/dbraw/zinc/60/58/64/380605864.db2.gz FQXQVBXIRIDSDH-JTQLQIEISA-N -1 3 253.317 2.531 20 10 CFCDHM Cc1ccc(C(=O)N2C[C@H](C)CC[C@@H]2C)c([O-])c1O ZINC000182534451 381106929 /nfs/dbraw/zinc/10/69/29/381106929.db2.gz JPBCNPMGPSSAIL-KOLCDFICSA-N -1 3 263.337 2.667 20 10 CFCDHM COc1cc(Cl)cc(CN2CCO[C@@H](C)[C@@H]2C)c1[O-] ZINC000184694240 381462513 /nfs/dbraw/zinc/46/25/13/381462513.db2.gz FTNALIUTKIMRFU-UWVGGRQHSA-N -1 3 285.771 2.663 20 10 CFCDHM C[C@@H](NCc1cnn(C)c1)c1cc(Cl)ccc1[O-] ZINC000185113001 381539823 /nfs/dbraw/zinc/53/98/23/381539823.db2.gz FMLYXIZZPBRXAI-SECBINFHSA-N -1 3 265.744 2.630 20 10 CFCDHM O=c1[nH]ccc2c1CN(Cc1cc(Cl)ccc1[O-])CC2 ZINC000372814395 381874010 /nfs/dbraw/zinc/87/40/10/381874010.db2.gz JPZJUSFRGJYOHR-UHFFFAOYSA-N -1 3 290.750 2.705 20 10 CFCDHM [O-]c1c(Cl)cccc1CN1CC([C@@H]2CCOC2)C1 ZINC000373469957 382010680 /nfs/dbraw/zinc/01/06/80/382010680.db2.gz PWXWLOJRTHKJQS-LLVKDONJSA-N -1 3 267.756 2.514 20 10 CFCDHM [O-]c1c(Cl)cccc1CN1CC([C@H]2CCOC2)C1 ZINC000373469958 382011494 /nfs/dbraw/zinc/01/14/94/382011494.db2.gz PWXWLOJRTHKJQS-NSHDSACASA-N -1 3 267.756 2.514 20 10 CFCDHM [O-]c1ccc(Cl)c(F)c1CN1CC[C@@](O)(C2CC2)C1 ZINC000373315221 381977871 /nfs/dbraw/zinc/97/78/71/381977871.db2.gz CKMKBCXWHFURMY-AWEZNQCLSA-N -1 3 285.746 2.532 20 10 CFCDHM CC(=O)c1cc(Cl)cc(CN2CCOC[C@@H](C)C2)c1[O-] ZINC000374367821 382045608 /nfs/dbraw/zinc/04/56/08/382045608.db2.gz SDZJRDWZFTUGCM-JTQLQIEISA-N -1 3 297.782 2.717 20 10 CFCDHM [O-]c1ccccc1CN1CCc2[nH]nc(C(F)(F)F)c2C1 ZINC000374891094 382060073 /nfs/dbraw/zinc/06/00/73/382060073.db2.gz FSKGTZJWXSQCDA-UHFFFAOYSA-N -1 3 297.280 2.692 20 10 CFCDHM CS[C@H]1CCC[C@H](NC(=O)c2cccc(O)c2[O-])C1 ZINC000187106128 382101054 /nfs/dbraw/zinc/10/10/54/382101054.db2.gz XOLRGMVGRUVXNQ-UWVGGRQHSA-N -1 3 281.377 2.502 20 10 CFCDHM CC[C@@H](c1ccncc1)N(C)C(=O)c1cccc(O)c1[O-] ZINC000187113350 382101650 /nfs/dbraw/zinc/10/16/50/382101650.db2.gz XGKINSZXMMCAMI-ZDUSSCGKSA-N -1 3 286.331 2.716 20 10 CFCDHM CC(C)[C@H]1N(C(=O)c2cccc(O)c2[O-])CC12CCC2 ZINC000293657735 382218319 /nfs/dbraw/zinc/21/83/19/382218319.db2.gz MFTBNHQHQVFULW-CQSZACIVSA-N -1 3 275.348 2.749 20 10 CFCDHM C[C@H](NCc1cc(Cl)c(F)cc1[O-])c1cn[nH]c1 ZINC000293673382 382226444 /nfs/dbraw/zinc/22/64/44/382226444.db2.gz QUCUKAKCADUBIL-ZETCQYMHSA-N -1 3 269.707 2.759 20 10 CFCDHM C[C@]1(c2ccccc2)CCN(C(=O)c2cccc(O)c2[O-])C1 ZINC000365928591 382458457 /nfs/dbraw/zinc/45/84/57/382458457.db2.gz FBEXSRYEHBCWKL-SFHVURJKSA-N -1 3 297.354 2.902 20 10 CFCDHM CCCCN(Cc1ccccc1[O-])Cc1nccc(N)n1 ZINC000282444001 385312816 /nfs/dbraw/zinc/31/28/16/385312816.db2.gz LGLLGVBTGSCGDP-UHFFFAOYSA-N -1 3 286.379 2.567 20 10 CFCDHM CCN(Cc1cnn(C)c1)Cc1c([O-])cccc1Cl ZINC000271155094 385352606 /nfs/dbraw/zinc/35/26/06/385352606.db2.gz VNWHOLVWRPFLNY-UHFFFAOYSA-N -1 3 279.771 2.801 20 10 CFCDHM CCCOc1ccc(CN(C)Cc2ccon2)c([O-])c1 ZINC000271178571 385363623 /nfs/dbraw/zinc/36/36/23/385363623.db2.gz GZLQOXLZKDKIIJ-UHFFFAOYSA-N -1 3 276.336 2.801 20 10 CFCDHM CC(C)OC(=O)[C@H](C)N(C)Cc1c([O-])cccc1Cl ZINC000271184560 385367879 /nfs/dbraw/zinc/36/78/79/385367879.db2.gz LOKWVAKWKMDUNL-JTQLQIEISA-N -1 3 285.771 2.818 20 10 CFCDHM CCc1nnc(CN[C@H](C)c2ccccc2[O-])s1 ZINC000273237070 385675511 /nfs/dbraw/zinc/67/55/11/385675511.db2.gz WWLNHQIRXNTAOW-SECBINFHSA-N -1 3 263.366 2.657 20 10 CFCDHM CN(Cc1cn2c(n1)CCCC2)Cc1ccccc1[O-] ZINC000373880078 393475984 /nfs/dbraw/zinc/47/59/84/393475984.db2.gz FZOKSHNFGMMJSA-UHFFFAOYSA-N -1 3 271.364 2.557 20 10 CFCDHM Cc1ccc(C(=O)NC[C@@H]2CCC(F)(F)C2)c([O-])c1O ZINC000281918419 394093602 /nfs/dbraw/zinc/09/36/02/394093602.db2.gz VKMCKUPYNMWRQT-SECBINFHSA-N -1 3 285.290 2.571 20 10 CFCDHM [O-]c1ccc(Cl)c(F)c1CN1CCC[C@H]2COC[C@H]21 ZINC000367071995 394251399 /nfs/dbraw/zinc/25/13/99/394251399.db2.gz LSWPMOVCDBZPEV-JOYOIKCWSA-N -1 3 285.746 2.796 20 10 CFCDHM Cc1ccc(C(=O)N2CC3(CCC3)[C@@H]2C2CC2)c([O-])c1O ZINC000291828458 292049871 /nfs/dbraw/zinc/04/98/71/292049871.db2.gz FPLWTVJSZJFIJO-HNNXBMFYSA-N -1 3 287.359 2.811 20 10 CFCDHM C[C@H]1COc2ccccc2CN1C(=O)c1cccc(O)c1[O-] ZINC000365623697 278464062 /nfs/dbraw/zinc/46/40/62/278464062.db2.gz CQPLZJCNGSRDBH-NSHDSACASA-N -1 3 299.326 2.521 20 10 CFCDHM CC[C@H](NCc1cnnn1CC)c1cc(Cl)ccc1[O-] ZINC000527918643 330295056 /nfs/dbraw/zinc/29/50/56/330295056.db2.gz CGTUVGCFFMYVBV-ZDUSSCGKSA-N -1 3 294.786 2.898 20 10 CFCDHM O=C(/C=C\c1cncs1)N1CCCc2cccc([O-])c21 ZINC000492949487 332419924 /nfs/dbraw/zinc/41/99/24/332419924.db2.gz HVTNIMPTJYYOGF-SREVYHEPSA-N -1 3 286.356 2.841 20 10 CFCDHM O=C(/C=C/c1cncc([O-])c1)N1CCc2c1cccc2F ZINC000184300414 333126713 /nfs/dbraw/zinc/12/67/13/333126713.db2.gz JRCQDFRSPAUVJS-SNAWJCMRSA-N -1 3 284.290 2.529 20 10 CFCDHM CC(=O)c1cc(F)cc(CN2C[C@H](C)[C@H]2C)c1[O-] ZINC000293369261 518287283 /nfs/dbraw/zinc/28/72/83/518287283.db2.gz JBHWCPOFBNGCJC-DTWKUNHWSA-N -1 3 251.301 2.574 20 10 CFCDHM CC(C)OCc1nc([C@@H](C)NCc2ccccc2[O-])no1 ZINC000290772461 519776413 /nfs/dbraw/zinc/77/64/13/519776413.db2.gz CGCWITHXEVAHPM-LLVKDONJSA-N -1 3 291.351 2.551 20 10 CFCDHM CCC[C@@]1(COC)CCCN1C(=O)c1cccc(O)c1[O-] ZINC000278107962 520966853 /nfs/dbraw/zinc/96/68/53/520966853.db2.gz RHGVDHFKMJYDHF-INIZCTEOSA-N -1 3 293.363 2.519 20 10 CFCDHM COc1c([O-])c(CN(C)Cc2ccco2)ccc1[N+](=O)[O-] ZINC000278231868 521872315 /nfs/dbraw/zinc/87/23/15/521872315.db2.gz MVTOHMLDTNSORI-UHFFFAOYSA-N -1 3 292.291 2.534 20 10 CFCDHM CCc1nnc([C@H](C)N[C@H](C)c2ccc(F)cc2[O-])[nH]1 ZINC000273480069 522454818 /nfs/dbraw/zinc/45/48/18/522454818.db2.gz LVPDKEUWFZYHEH-BDAKNGLRSA-N -1 3 278.331 2.624 20 10 CFCDHM Cc1cc(CN[C@@H](C)c2ccc(F)cc2[O-])on1 ZINC000062748365 524766024 /nfs/dbraw/zinc/76/60/24/524766024.db2.gz SZOJETFVVOXNSC-VIFPVBQESA-N -1 3 250.273 2.679 20 10 CFCDHM Cc1cc(CN[C@H](C)c2cc(F)ccc2[O-])on1 ZINC000094618000 524777825 /nfs/dbraw/zinc/77/78/25/524777825.db2.gz PHZAQHASYADERO-SECBINFHSA-N -1 3 250.273 2.679 20 10 CFCDHM C[C@@H]1CN(Cc2c([O-])ccc(Cl)c2F)CCCO1 ZINC000191313495 524980347 /nfs/dbraw/zinc/98/03/47/524980347.db2.gz BNPHNULXUJLXGQ-SECBINFHSA-N -1 3 273.735 2.796 20 10 CFCDHM COc1ncccc1CN[C@H](C)c1cc(F)ccc1[O-] ZINC000094617604 525062264 /nfs/dbraw/zinc/06/22/64/525062264.db2.gz YJRXXFHOTMTNPG-SNVBAGLBSA-N -1 3 276.311 2.786 20 10 CFCDHM C[C@@H](N[C@H](CO)c1ccccc1)c1ccc(F)cc1[O-] ZINC000063000753 525667425 /nfs/dbraw/zinc/66/74/25/525667425.db2.gz IPJYVHOYGRMZMW-IAQYHMDHSA-N -1 3 275.323 2.916 20 10 CFCDHM [O-]c1c(F)cccc1CN1CCC[C@@H](n2cccn2)C1 ZINC000361070225 526328268 /nfs/dbraw/zinc/32/82/68/526328268.db2.gz WEIDGMRTPOQXSL-CYBMUJFWSA-N -1 3 275.327 2.565 20 10 CFCDHM [O-]c1c(F)cccc1CN1CC[C@@H](Oc2cccnc2)C1 ZINC000361053151 526328413 /nfs/dbraw/zinc/32/84/13/526328413.db2.gz QEVCTVLVDMVQIS-CQSZACIVSA-N -1 3 288.322 2.580 20 10 CFCDHM CN(CCOc1ccccc1)C(=O)c1cc([O-])cs1 ZINC000731865298 574131309 /nfs/dbraw/zinc/13/13/09/574131309.db2.gz ARUQDMSOBYIENR-UHFFFAOYSA-N -1 3 277.345 2.605 20 10 CFCDHM CC(C)c1nnc(NC(=O)c2cc([O-])cs2)s1 ZINC000731867971 574132181 /nfs/dbraw/zinc/13/21/81/574132181.db2.gz FSDWGUMBNCCYME-UHFFFAOYSA-N -1 3 269.351 2.681 20 10 CFCDHM C[N@H+](Cc1ccccc1[O-])Cc1ccc(F)cc1C(=O)[O-] ZINC000737494585 574144740 /nfs/dbraw/zinc/14/47/40/574144740.db2.gz WGFXXRQPZKSLIP-UHFFFAOYSA-N -1 3 289.306 2.862 20 10 CFCDHM C[N@@H+](Cc1ccccc1[O-])Cc1ccc(F)cc1C(=O)[O-] ZINC000737494585 574144741 /nfs/dbraw/zinc/14/47/41/574144741.db2.gz WGFXXRQPZKSLIP-UHFFFAOYSA-N -1 3 289.306 2.862 20 10 CFCDHM O=C(NCc1ccc(Cl)o1)c1cc([O-])cs1 ZINC000732265867 574148170 /nfs/dbraw/zinc/14/81/70/574148170.db2.gz JKFKTUOAMNDEGN-UHFFFAOYSA-N -1 3 257.698 2.630 20 10 CFCDHM O=C(NCc1ccccc1-n1cccn1)c1cc([O-])cs1 ZINC000732278098 574149053 /nfs/dbraw/zinc/14/90/53/574149053.db2.gz GAOJFZWEHNLDDO-UHFFFAOYSA-N -1 3 299.355 2.569 20 10 CFCDHM O=C(NC[C@H]1CCc2ccccc21)c1cc([O-])cs1 ZINC000732292840 574150466 /nfs/dbraw/zinc/15/04/66/574150466.db2.gz ANIIDOBXPNOSKA-LLVKDONJSA-N -1 3 273.357 2.914 20 10 CFCDHM CCc1csc(NC(=O)c2cc([O-])cs2)n1 ZINC000732287994 574150752 /nfs/dbraw/zinc/15/07/52/574150752.db2.gz KVAZPTFHPZWKQQ-UHFFFAOYSA-N -1 3 254.336 2.725 20 10 CFCDHM Cc1ccc(OCCOC(=O)c2cc([O-])cs2)cc1 ZINC000732354905 574153160 /nfs/dbraw/zinc/15/31/60/574153160.db2.gz VYJHXUAHSSQDJE-UHFFFAOYSA-N -1 3 278.329 2.998 20 10 CFCDHM CC(C)[C@@H](OC(=O)c1cc([O-])cs1)C(=O)NC(C)(C)C ZINC000732354409 574153200 /nfs/dbraw/zinc/15/32/00/574153200.db2.gz LLQFRIXZJIRDDV-LLVKDONJSA-N -1 3 299.392 2.550 20 10 CFCDHM CCN1C(=O)/C(=C\c2ccc([O-])c(F)c2)SC1=S ZINC000755402250 574160262 /nfs/dbraw/zinc/16/02/62/574160262.db2.gz JEBXTHLTBMHPFB-UXBLZVDNSA-N -1 3 283.349 2.752 20 10 CFCDHM CCOc1ccc(CN[C@@H](COC)c2ccco2)c([O-])c1 ZINC000747099784 574179941 /nfs/dbraw/zinc/17/99/41/574179941.db2.gz MFHUGAVAABMOGX-AWEZNQCLSA-N -1 3 291.347 2.861 20 10 CFCDHM O=C([O-])CCC[N@H+](Cc1ccco1)Cc1ccccc1[O-] ZINC000739672545 574223232 /nfs/dbraw/zinc/22/32/32/574223232.db2.gz POFIYUWNISBFTN-UHFFFAOYSA-N -1 3 289.331 2.852 20 10 CFCDHM O=C([O-])CCC[N@@H+](Cc1ccco1)Cc1ccccc1[O-] ZINC000739672545 574223234 /nfs/dbraw/zinc/22/32/34/574223234.db2.gz POFIYUWNISBFTN-UHFFFAOYSA-N -1 3 289.331 2.852 20 10 CFCDHM CC(=O)c1cc(F)cc(CN(CCO)CC(C)(C)C)c1[O-] ZINC000748049731 574226447 /nfs/dbraw/zinc/22/64/47/574226447.db2.gz PJFPXMWVBIAJSV-UHFFFAOYSA-N -1 3 297.370 2.574 20 10 CFCDHM Cn1ccc(CNCc2c([O-])cccc2Cl)c1 ZINC000748098631 574229410 /nfs/dbraw/zinc/22/94/10/574229410.db2.gz KAFXUROAPYAUNN-UHFFFAOYSA-N -1 3 250.729 2.674 20 10 CFCDHM Cc1cccc(CN[C@@H](C)c2cc([N+](=O)[O-])ccc2[O-])n1 ZINC000756445041 574238240 /nfs/dbraw/zinc/23/82/40/574238240.db2.gz XQZURVATETXTEC-NSHDSACASA-N -1 3 287.319 2.855 20 10 CFCDHM O=C([O-])C[C@H]1CCCC[N@@H+]1Cc1cc2c(cc1[O-])CCC2 ZINC000739639451 574244121 /nfs/dbraw/zinc/24/41/21/574244121.db2.gz MPUZQHFYADCVHG-OAHLLOKOSA-N -1 3 289.375 2.710 20 10 CFCDHM O=C([O-])C[C@H]1CCCC[N@H+]1Cc1cc2c(cc1[O-])CCC2 ZINC000739639451 574244125 /nfs/dbraw/zinc/24/41/25/574244125.db2.gz MPUZQHFYADCVHG-OAHLLOKOSA-N -1 3 289.375 2.710 20 10 CFCDHM C[C@@H](COC(=O)c1cc([O-])cs1)C(F)(F)F ZINC000748276663 574244556 /nfs/dbraw/zinc/24/45/56/574244556.db2.gz GEVLLLWKOFVTLW-YFKPBYRVSA-N -1 3 254.229 2.809 20 10 CFCDHM CCc1cc(CN[C@@H](C)c2cc(F)ccc2[O-])on1 ZINC000756608107 574251667 /nfs/dbraw/zinc/25/16/67/574251667.db2.gz QFBKLIKVURMAPX-VIFPVBQESA-N -1 3 264.300 2.933 20 10 CFCDHM C[C@@H](N[C@H](C)c1cc(F)cc(F)c1[O-])c1cn[nH]c1 ZINC000756776450 574261677 /nfs/dbraw/zinc/26/16/77/574261677.db2.gz PIUSIQZJLSOFHR-HTQZYQBOSA-N -1 3 267.279 2.805 20 10 CFCDHM C[C@@H](NCc1ncccc1F)c1ccc(F)cc1[O-] ZINC000756769862 574261850 /nfs/dbraw/zinc/26/18/50/574261850.db2.gz RHOIQOABECQXIR-SECBINFHSA-N -1 3 264.275 2.916 20 10 CFCDHM C[C@@H](NCc1ncccc1F)c1cc(F)ccc1[O-] ZINC000756771083 574261880 /nfs/dbraw/zinc/26/18/80/574261880.db2.gz ZUMXSGSKHBUNHV-SECBINFHSA-N -1 3 264.275 2.916 20 10 CFCDHM CO[C@H](CN[C@@H](C)c1cc(F)cc(F)c1[O-])C(F)(F)F ZINC000756835114 574266829 /nfs/dbraw/zinc/26/68/29/574266829.db2.gz MSZZLCUGEIAJNE-QUBYGPBYSA-N -1 3 299.239 2.898 20 10 CFCDHM CC(C)C[C@H](NC(=O)c1cc([O-])cs1)C(=O)OC(C)C ZINC000734017926 574270654 /nfs/dbraw/zinc/27/06/54/574270654.db2.gz SXVWRPYLVAMCSO-NSHDSACASA-N -1 3 299.392 2.550 20 10 CFCDHM Cc1cc(N(C)C)ccc1CNC(=O)c1ccccc1[O-] ZINC000734405375 574285573 /nfs/dbraw/zinc/28/55/73/574285573.db2.gz DKJUDLKSPGUYJZ-UHFFFAOYSA-N -1 3 284.359 2.697 20 10 CFCDHM O=C(N[C@@H]1C[C@@H]1Cc1ccccc1)c1cc([O-])cs1 ZINC000743632530 574308446 /nfs/dbraw/zinc/30/84/46/574308446.db2.gz IAYWABOGMAPPTK-WCQYABFASA-N -1 3 273.357 2.815 20 10 CFCDHM C[C@@H]([NH2+]Cc1cc(-c2ccccc2)ccc1[O-])C(=O)[O-] ZINC000739030980 574312100 /nfs/dbraw/zinc/31/21/00/574312100.db2.gz JCSXSPNDEPWLNS-LLVKDONJSA-N -1 3 271.316 2.622 20 10 CFCDHM CO[C@@H](C)CN(Cc1cc(F)cc(C(C)=O)c1[O-])C(C)C ZINC000750825485 574357257 /nfs/dbraw/zinc/35/72/57/574357257.db2.gz DBIKHPAVFHATQH-NSHDSACASA-N -1 3 297.370 2.979 20 10 CFCDHM CCO[C@H]1C[C@@H](NC(=O)c2cc([O-])cs2)C12CCCC2 ZINC000743790883 574372207 /nfs/dbraw/zinc/37/22/07/574372207.db2.gz OLRCGRPGHXEKMG-OLZOCXBDSA-N -1 3 295.404 2.921 20 10 CFCDHM Cc1ccsc1CNC(=O)c1ccc(C)c(O)c1[O-] ZINC000751536572 574378763 /nfs/dbraw/zinc/37/87/63/574378763.db2.gz ZLGIFDOLGIFFPI-UHFFFAOYSA-N -1 3 277.345 2.706 20 10 CFCDHM C[C@@H](C[C@@H](O)c1cccs1)NC(=O)c1cc([O-])cs1 ZINC000752631010 574393205 /nfs/dbraw/zinc/39/32/05/574393205.db2.gz PGIXWHQRAKCCIS-WCBMZHEXSA-N -1 3 297.401 2.757 20 10 CFCDHM O=C(c1cc([O-])cs1)N1CCc2c(F)ccc(F)c2C1 ZINC000752824657 574395605 /nfs/dbraw/zinc/39/56/05/574395605.db2.gz VHLCTGWWYCIFLG-UHFFFAOYSA-N -1 3 295.310 2.930 20 10 CFCDHM C[C@@H]1CN(C(=O)c2cc([O-])cs2)CC(C)(C)C1 ZINC000753487550 574403155 /nfs/dbraw/zinc/40/31/55/574403155.db2.gz AKTGOKJMUXYZFQ-VIFPVBQESA-N -1 3 253.367 2.962 20 10 CFCDHM CCOc1ccc(C[NH2+][C@@](C)(CC)CC(=O)[O-])c([O-])c1 ZINC000830075509 601432878 /nfs/dbraw/zinc/43/28/78/601432878.db2.gz ZBGOIGCUDWHAQD-HNNXBMFYSA-N -1 3 281.352 2.524 20 10 CFCDHM COc1ccc(O)c([C@H](C)NCc2ccoc2C(=O)[O-])c1 ZINC000833733887 605128190 /nfs/dbraw/zinc/12/81/90/605128190.db2.gz UWNUPXATWGASKD-VIFPVBQESA-N -1 3 291.303 2.543 20 10 CFCDHM CC(C)(C(=O)[O-])[C@@H]1CCC[N@H+](Cc2ccccc2[O-])C1 ZINC000135046794 605547578 /nfs/dbraw/zinc/54/75/78/605547578.db2.gz XGVUNUDPPZPEMS-CYBMUJFWSA-N -1 3 277.364 2.715 20 10 CFCDHM CC(C)(C(=O)[O-])[C@@H]1CCC[N@@H+](Cc2ccccc2[O-])C1 ZINC000135046794 605547582 /nfs/dbraw/zinc/54/75/82/605547582.db2.gz XGVUNUDPPZPEMS-CYBMUJFWSA-N -1 3 277.364 2.715 20 10 CFCDHM COc1ccccc1NC(=O)c1ccc(C)c(O)c1[O-] ZINC000177667469 618014854 /nfs/dbraw/zinc/01/48/54/618014854.db2.gz NCBSWEKZBAPAAE-UHFFFAOYSA-N -1 3 273.288 2.667 20 10 CFCDHM CN(Cc1cc(Br)ccc1[O-])CC(F)F ZINC000092508788 618180921 /nfs/dbraw/zinc/18/09/21/618180921.db2.gz MBNIILRXFNLCSX-UHFFFAOYSA-N -1 3 280.112 2.852 20 10 CFCDHM COc1ccc(NC(=O)c2ccc(C)c(O)c2[O-])cc1 ZINC000177659299 618466003 /nfs/dbraw/zinc/46/60/03/618466003.db2.gz ANEZCXHKECCBRZ-UHFFFAOYSA-N -1 3 273.288 2.667 20 10 CFCDHM O=C([O-])CC[C@H]1CCCC[N@@H+]1Cc1cc(F)ccc1[O-] ZINC000236416943 618622059 /nfs/dbraw/zinc/62/20/59/618622059.db2.gz LOAMTLHKEUHQQV-CYBMUJFWSA-N -1 3 281.327 2.751 20 10 CFCDHM O=C([O-])CC[C@H]1CCCC[N@H+]1Cc1cc(F)ccc1[O-] ZINC000236416943 618622060 /nfs/dbraw/zinc/62/20/60/618622060.db2.gz LOAMTLHKEUHQQV-CYBMUJFWSA-N -1 3 281.327 2.751 20 10 CFCDHM C[C@@H](NCc1cc(Cl)ccc1[O-])C(=O)OC(C)(C)C ZINC000123269514 618864767 /nfs/dbraw/zinc/86/47/67/618864767.db2.gz RFPVXWJIXBKDNN-SECBINFHSA-N -1 3 285.771 2.865 20 10 CFCDHM O=C(NCCOC1CCCCCC1)c1cccc(O)c1[O-] ZINC000185685901 618929453 /nfs/dbraw/zinc/92/94/53/618929453.db2.gz WVUFMCQMGIOVRF-UHFFFAOYSA-N -1 3 293.363 2.567 20 10 CFCDHM CCc1onc(C)c1CNCc1c([O-])cccc1F ZINC000896638151 619780278 /nfs/dbraw/zinc/78/02/78/619780278.db2.gz IJUQCAQMLHIMGL-UHFFFAOYSA-N -1 3 264.300 2.680 20 10 CFCDHM CCOc1cccc(CNCc2c([O-])cccc2F)n1 ZINC000896639307 619781027 /nfs/dbraw/zinc/78/10/27/619781027.db2.gz DCOINXJKADBVDP-UHFFFAOYSA-N -1 3 276.311 2.615 20 10 CFCDHM CCC[C@@H](NCc1ccc2ccccc2c1[O-])C(=O)OC ZINC000897833861 620291278 /nfs/dbraw/zinc/29/12/78/620291278.db2.gz ASKWUBXBQAJQRQ-OAHLLOKOSA-N -1 3 287.359 2.977 20 10 CFCDHM C[C@@H](NCc1cc(F)cc(F)c1[O-])c1cncs1 ZINC000897929849 620305494 /nfs/dbraw/zinc/30/54/94/620305494.db2.gz BZHPRMQDHDNPEO-SSDOTTSWSA-N -1 3 270.304 2.978 20 10 CFCDHM CC(C)[C@@H](N[C@H](C)c1c([O-])cccc1F)c1nncn1C ZINC000903063727 621238365 /nfs/dbraw/zinc/23/83/65/621238365.db2.gz HKXOIKKULQGKEI-QMTHXVAHSA-N -1 3 292.358 2.708 20 10 CFCDHM CC(C)[C@@H](N[C@@H](C)c1ccc(F)cc1[O-])c1nncn1C ZINC000903066766 621239147 /nfs/dbraw/zinc/23/91/47/621239147.db2.gz XDTPZRUATWKFSX-IINYFYTJSA-N -1 3 292.358 2.708 20 10 CFCDHM CCC(C)(C)NC(=S)NCc1c([O-])cccc1F ZINC000905662109 621812078 /nfs/dbraw/zinc/81/20/78/621812078.db2.gz SBXBNSIDHTZBTK-UHFFFAOYSA-N -1 3 270.373 2.684 20 10 CFCDHM C[C@@H](O)CN(Cc1ccc2ccccc2c1[O-])CC(F)F ZINC000825103798 623631308 /nfs/dbraw/zinc/63/13/08/623631308.db2.gz IIPZFPFTGOFQPQ-LLVKDONJSA-N -1 3 295.329 2.993 20 10 CFCDHM CC[C@@H](C)[C@@H](C)NC(=O)NCc1c([O-])cccc1F ZINC000914366234 623774084 /nfs/dbraw/zinc/77/40/84/623774084.db2.gz MCJNIHWNKJKZPG-NXEZZACHSA-N -1 3 268.332 2.765 20 10 CFCDHM Cc1cc([O-])c(CN2CC(O)(C(C)C)C2)cc1Cl ZINC000826113772 623795951 /nfs/dbraw/zinc/79/59/51/623795951.db2.gz PRPIRXYBSAJNLA-UHFFFAOYSA-N -1 3 269.772 2.557 20 10 CFCDHM COCCN(CCF)Cc1cc(Cl)c(F)cc1[O-] ZINC000827049018 623930413 /nfs/dbraw/zinc/93/04/13/623930413.db2.gz ULJISCNCNMEUMU-UHFFFAOYSA-N -1 3 279.714 2.603 20 10 CFCDHM C[C@H]1CN(Cc2c([O-])ccc(Cl)c2F)C[C@H](C)C1O ZINC000827151407 623954146 /nfs/dbraw/zinc/95/41/46/623954146.db2.gz AGXLMAONTFMDEX-IUCAKERBSA-N -1 3 287.762 2.633 20 10 CFCDHM CN(Cc1c([O-])ccc(Cl)c1F)CC1=CCCOC1 ZINC000827189780 623961861 /nfs/dbraw/zinc/96/18/61/623961861.db2.gz NYYGVYVQSIXLHJ-UHFFFAOYSA-N -1 3 285.746 2.963 20 10 CFCDHM CCC[C@H]1C[C@@H]1NC(=O)NCc1c([O-])cccc1F ZINC000921033617 624799652 /nfs/dbraw/zinc/79/96/52/624799652.db2.gz VFMWXHMIVRXYLZ-CABZTGNLSA-N -1 3 266.316 2.519 20 10 CFCDHM Cc1ccc(C(=O)Nc2cc(F)cc(F)c2)c([O-])c1O ZINC000181823696 625221272 /nfs/dbraw/zinc/22/12/72/625221272.db2.gz IRWJWISSYSHABL-UHFFFAOYSA-N -1 3 279.242 2.937 20 10 CFCDHM O=C(NC1(c2cccc(F)c2)CC1)c1cccc(O)c1[O-] ZINC000185711889 625765241 /nfs/dbraw/zinc/76/52/41/625765241.db2.gz OLPJSVJJMNOLSI-UHFFFAOYSA-N -1 3 287.290 2.656 20 10 CFCDHM Cc1cc(NC(=O)c2cccc(O)c2[O-])cnc1Cl ZINC000185782279 625776714 /nfs/dbraw/zinc/77/67/14/625776714.db2.gz CUKHMZMMAOFZFY-UHFFFAOYSA-N -1 3 278.695 2.707 20 10 CFCDHM CCS[C@@H]1CCC[C@H](NC(=O)c2cccc(O)c2[O-])C1 ZINC000185798056 625779242 /nfs/dbraw/zinc/77/92/42/625779242.db2.gz WLPHHOVLWGRJEG-WDEREUQCSA-N -1 3 295.404 2.892 20 10 CFCDHM O=C(NCc1c([O-])cccc1F)N[C@H]1CCC(F)(F)C1 ZINC000921510606 625839215 /nfs/dbraw/zinc/83/92/15/625839215.db2.gz YZTKNEGYNODCQM-QMMMGPOBSA-N -1 3 288.269 2.518 20 10 CFCDHM CC[C@@H](N[C@@H]1CCn2ccnc21)c1ccc(F)cc1[O-] ZINC000834831932 625891343 /nfs/dbraw/zinc/89/13/43/625891343.db2.gz LTTHTTJJTDVCKI-CHWSQXEVSA-N -1 3 275.327 2.914 20 10 CFCDHM CCc1nc(CN[C@H](C)c2ccc(F)cc2[O-])co1 ZINC000834900977 625915153 /nfs/dbraw/zinc/91/51/53/625915153.db2.gz YCQWQWMOPDCQCD-SECBINFHSA-N -1 3 264.300 2.933 20 10 CFCDHM Cc1cc(CNCc2c([O-])cccc2Cl)no1 ZINC000083552183 625977613 /nfs/dbraw/zinc/97/76/13/625977613.db2.gz NPGLMNDTPAGEGI-UHFFFAOYSA-N -1 3 252.701 2.632 20 10 CFCDHM O=C(NCc1c([O-])cccc1F)N[C@@H]1CCCC1(F)F ZINC000922489813 626297648 /nfs/dbraw/zinc/29/76/48/626297648.db2.gz LHWBHJQBYIJWKH-LLVKDONJSA-N -1 3 288.269 2.518 20 10 CFCDHM O=[N+]([O-])c1ccc([O-])c(CN[C@@H](c2ccccn2)C2CC2)c1 ZINC000922586408 626318243 /nfs/dbraw/zinc/31/82/43/626318243.db2.gz LYDSWMGCPVWZEN-MRXNPFEDSA-N -1 3 299.330 2.936 20 10 CFCDHM O=[N+]([O-])c1ccc([O-])c(CN[C@H]2CCCc3cccnc32)c1 ZINC000922880196 626386281 /nfs/dbraw/zinc/38/62/81/626386281.db2.gz HTACTDVYOYWDBJ-AWEZNQCLSA-N -1 3 299.330 2.863 20 10 CFCDHM O=[N+]([O-])c1ccc([O-])c(CN[C@@H]2CCCc3cccnc32)c1 ZINC000922881005 626386659 /nfs/dbraw/zinc/38/66/59/626386659.db2.gz HTACTDVYOYWDBJ-CQSZACIVSA-N -1 3 299.330 2.863 20 10 CFCDHM O=C(NCCC1=CCCCC1)c1cccc(O)c1[O-] ZINC000186740223 626398050 /nfs/dbraw/zinc/39/80/50/626398050.db2.gz IAFBZVIOZDJWQN-UHFFFAOYSA-N -1 3 261.321 2.718 20 10 CFCDHM C[C@@H]1CCC[C@@H](C)N(C(=O)c2cccc(O)c2[O-])C1 ZINC000187128497 626459707 /nfs/dbraw/zinc/45/97/07/626459707.db2.gz NERXSJSLHIPYPS-GHMZBOCLSA-N -1 3 263.337 2.749 20 10 CFCDHM CCS[C@H]1CC[C@@H](N(C)C(=O)c2cccc(O)c2[O-])C1 ZINC000187191144 626479180 /nfs/dbraw/zinc/47/91/80/626479180.db2.gz YBHKSRZYKGOLMR-MNOVXSKESA-N -1 3 295.404 2.844 20 10 CFCDHM CCCN1CC(=O)N[C@@H]1c1cc(-c2ccccc2)ccc1[O-] ZINC000840824812 626548772 /nfs/dbraw/zinc/54/87/72/626548772.db2.gz OTYJNLPPCCRBDS-SFHVURJKSA-N -1 3 296.370 2.900 20 10 CFCDHM CCN1CCN(Cc2cc(Cl)cc(F)c2[O-])[C@@H](C)C1 ZINC000809697316 626553912 /nfs/dbraw/zinc/55/39/12/626553912.db2.gz DTVQRGCWHVOAJY-JTQLQIEISA-N -1 3 286.778 2.711 20 10 CFCDHM Cc1ccc2c(c1)N(C(=O)c1ccc(C)c(O)c1[O-])CC2 ZINC000770495905 627525958 /nfs/dbraw/zinc/52/59/58/627525958.db2.gz ZVADZXBFJSOANQ-UHFFFAOYSA-N -1 3 283.327 2.918 20 10 CFCDHM CC[C@@H](NCC(F)(F)CO)c1cc(Cl)ccc1[O-] ZINC000775555003 628036947 /nfs/dbraw/zinc/03/69/47/628036947.db2.gz GTWFAUIDTKVIBO-SNVBAGLBSA-N -1 3 279.714 2.714 20 10 CFCDHM COC(=O)[C@@H]1C[C@H](C)CCN1Cc1cc(Cl)ccc1[O-] ZINC000776003106 628093154 /nfs/dbraw/zinc/09/31/54/628093154.db2.gz WRTGBWKATGPFDZ-MFKMUULPSA-N -1 3 297.782 2.819 20 10 CFCDHM COc1cccc(CNCc2cccc(Cl)c2[O-])n1 ZINC000776173649 628111184 /nfs/dbraw/zinc/11/11/84/628111184.db2.gz CGAQCOWEVHBIRJ-UHFFFAOYSA-N -1 3 278.739 2.739 20 10 CFCDHM C[C@@H](C(=O)NC(C)(C)C)N(C)Cc1cccc(Cl)c1[O-] ZINC000777219177 628208871 /nfs/dbraw/zinc/20/88/71/628208871.db2.gz HTOOJOREVHBLSL-JTQLQIEISA-N -1 3 298.814 2.781 20 10 CFCDHM CC(=O)c1cc(F)cc(CN2CC[C@@H](C)[C@@H](F)C2)c1[O-] ZINC000778239812 628291470 /nfs/dbraw/zinc/29/14/70/628291470.db2.gz VBVBPDKIMDNWGM-OTYXRUKQSA-N -1 3 283.318 2.914 20 10 CFCDHM Cc1ccc(C(=O)N2CCc3cccc(F)c32)c([O-])c1O ZINC000780983414 628510786 /nfs/dbraw/zinc/51/07/86/628510786.db2.gz GXOKVTQZQZTUMI-UHFFFAOYSA-N -1 3 287.290 2.748 20 10 CFCDHM CCc1ccc(CN(C)C(=O)c2cccc(O)c2[O-])cc1 ZINC000790473655 629241553 /nfs/dbraw/zinc/24/15/53/629241553.db2.gz YSYYNXSRHXQLMH-UHFFFAOYSA-N -1 3 285.343 2.932 20 10 CFCDHM Cc1ccc(CN(C(=O)c2cccc(O)c2[O-])C2CC2)o1 ZINC000790540139 629246846 /nfs/dbraw/zinc/24/68/46/629246846.db2.gz DUKQYZZMFAFAAU-UHFFFAOYSA-N -1 3 287.315 2.804 20 10 CFCDHM CCC(CC)[C@@H](CCNC(=O)c1cccc(O)c1[O-])OC ZINC000790899429 629270730 /nfs/dbraw/zinc/27/07/30/629270730.db2.gz JTWWCZWSFBWSTJ-CQSZACIVSA-N -1 3 295.379 2.669 20 10 CFCDHM Cc1cc(C)c2c(c1)CN(C(=O)c1cccc(O)c1[O-])CC2 ZINC000790944527 629272894 /nfs/dbraw/zinc/27/28/94/629272894.db2.gz AZEOZSUSLOJXMV-UHFFFAOYSA-N -1 3 297.354 2.913 20 10 CFCDHM COC1CCN(Cc2c([O-])ccc(Cl)c2F)CC1 ZINC000792157722 629403293 /nfs/dbraw/zinc/40/32/93/629403293.db2.gz ZVBMZNVKQJJBJU-UHFFFAOYSA-N -1 3 273.735 2.796 20 10 CFCDHM [O-]c1c(F)cc(Cl)cc1CN1CC([C@H]2CCOC2)C1 ZINC000793254888 629514838 /nfs/dbraw/zinc/51/48/38/629514838.db2.gz MADQEYYZHIIYGS-VIFPVBQESA-N -1 3 285.746 2.653 20 10 CFCDHM CCOC(=O)CN(Cc1c([O-])cc(C)cc1Cl)C1CC1 ZINC000840910784 631260243 /nfs/dbraw/zinc/26/02/43/631260243.db2.gz MDKPIYFKXRWXDA-UHFFFAOYSA-N -1 3 297.782 2.882 20 10 CFCDHM [O-]c1cccc(Cl)c1CN1CCO[C@]2(CCSC2)C1 ZINC000843417320 631949221 /nfs/dbraw/zinc/94/92/21/631949221.db2.gz AWMAUEXRWBCFQX-CQSZACIVSA-N -1 3 299.823 2.754 20 10 CFCDHM Cc1c(NC(=O)c2cccc(O)c2[O-])n[nH]c1C(C)C ZINC000844148199 632127430 /nfs/dbraw/zinc/12/74/30/632127430.db2.gz MCWAOVVNZHAPFR-UHFFFAOYSA-N -1 3 275.308 2.505 20 10 CFCDHM CC[C@H]1CC[C@H](NC(=O)c2cccc(O)c2[O-])CC1 ZINC000817216300 632573331 /nfs/dbraw/zinc/57/33/31/632573331.db2.gz UUWXAOMSKSLGMI-XYPYZODXSA-N -1 3 263.337 2.796 20 10 CFCDHM C[C@H]1C[C@@H](CO)CN(Cc2c([O-])ccc(Cl)c2F)C1 ZINC000817413253 632624199 /nfs/dbraw/zinc/62/41/99/632624199.db2.gz UWLZOERPYKOJTJ-VHSXEESVSA-N -1 3 287.762 2.635 20 10 CFCDHM CCn1nc(C)c(CN[C@@H](C)c2cc(Cl)ccc2[O-])n1 ZINC000818345102 632834044 /nfs/dbraw/zinc/83/40/44/632834044.db2.gz JJFCKIUVRIUBSI-VIFPVBQESA-N -1 3 294.786 2.816 20 10 CFCDHM [O-]c1ccc(Cl)cc1CN1CC2(CC2(F)F)C1 ZINC000848922418 633405071 /nfs/dbraw/zinc/40/50/71/633405071.db2.gz QYMNSUVOUALTKC-UHFFFAOYSA-N -1 3 259.683 2.887 20 10 CFCDHM CCCCCN1CC(=O)N[C@H]1c1cc(Cl)c(C)cc1[O-] ZINC000849183388 633580332 /nfs/dbraw/zinc/58/03/32/633580332.db2.gz RZZWZXLDAWKGRQ-OAHLLOKOSA-N -1 3 296.798 2.975 20 10 CFCDHM C[C@@H](NCc1c([O-])ccc(Cl)c1F)c1nccn1C ZINC000850410011 633981559 /nfs/dbraw/zinc/98/15/59/633981559.db2.gz LOSQBQXKAXEXPF-MRVPVSSYSA-N -1 3 283.734 2.769 20 10 CFCDHM C[C@H](N[C@@H](C)c1ccc(F)cc1[O-])c1nccn1C ZINC000850571983 634056957 /nfs/dbraw/zinc/05/69/57/634056957.db2.gz FXAZUCYWWPVFRQ-UWVGGRQHSA-N -1 3 263.316 2.677 20 10 CFCDHM CN(C[C@@H]1CCc2ccccc21)C(=O)c1cccc(O)c1[O-] ZINC000856303889 635780219 /nfs/dbraw/zinc/78/02/19/635780219.db2.gz ABLCLQVJLFVGPA-ZDUSSCGKSA-N -1 3 297.354 2.900 20 10 CFCDHM Cc1cc([O-])c(CN2CC3(C2)CCCO3)c(Cl)c1 ZINC000862484326 637399439 /nfs/dbraw/zinc/39/94/39/637399439.db2.gz KCWBRMVJRNUKMB-UHFFFAOYSA-N -1 3 267.756 2.719 20 10 CFCDHM [O-]c1c(F)c(F)ccc1CN1CCC[C@H](n2ccnc2)C1 ZINC000876680713 642970790 /nfs/dbraw/zinc/97/07/90/642970790.db2.gz SQLLGWZGNDBBBE-LBPRGKRZSA-N -1 3 293.317 2.704 20 10 CFCDHM Cc1ccc(NC(=O)c2cccc(O)c2[O-])cc1C ZINC000126220723 643054803 /nfs/dbraw/zinc/05/48/03/643054803.db2.gz ZVZXZZBQONJVMQ-UHFFFAOYSA-N -1 3 257.289 2.967 20 10 CFCDHM CC[C@H]1CCCC[C@H]1NC(=O)c1cccc(O)c1[O-] ZINC000126299331 643110407 /nfs/dbraw/zinc/11/04/07/643110407.db2.gz NKYPBOQCKCXCTO-CMPLNLGQSA-N -1 3 263.337 2.796 20 10 CFCDHM C[C@H]1c2ccsc2CCN1C(=O)c1cccc(O)c1[O-] ZINC000126344398 643153773 /nfs/dbraw/zinc/15/37/73/643153773.db2.gz BDAZDBCPQBSZJA-VIFPVBQESA-N -1 3 289.356 2.919 20 10 CFCDHM O=C(N[C@@H]1CCCc2sccc21)c1cccc(O)c1[O-] ZINC000126389820 643190354 /nfs/dbraw/zinc/19/03/54/643190354.db2.gz PHMXCJAZPYKDFO-LLVKDONJSA-N -1 3 289.356 2.967 20 10 CFCDHM C[C@@H]1CC[C@@H](NC(=O)c2cccc(O)c2[O-])C[C@@H]1C ZINC000126449297 643227139 /nfs/dbraw/zinc/22/71/39/643227139.db2.gz BIJIRUMWPTWQMQ-OUAUKWLOSA-N -1 3 263.337 2.652 20 10 CFCDHM CC1(C)CCCC[C@H]1NC(=O)c1cccc(O)c1[O-] ZINC000126479182 643240402 /nfs/dbraw/zinc/24/04/02/643240402.db2.gz MKRUVMOCIKHFPI-GFCCVEGCSA-N -1 3 263.337 2.796 20 10 CFCDHM O=C(c1cccc(O)c1[O-])N1CC[C@@H]2CCCC[C@@H]21 ZINC000126511126 643260674 /nfs/dbraw/zinc/26/06/74/643260674.db2.gz ICYUQLZZYRRYBC-JQWIXIFHSA-N -1 3 261.321 2.503 20 10 CFCDHM CC(=O)NC[C@H]1CCCCN1Cc1cccc(Cl)c1[O-] ZINC000877673782 643448014 /nfs/dbraw/zinc/44/80/14/643448014.db2.gz IKXWARFYKGTNDI-CYBMUJFWSA-N -1 3 296.798 2.536 20 10 CFCDHM COCC1(C2CC2)CN(Cc2cccc(Cl)c2[O-])C1 ZINC000877686000 643454401 /nfs/dbraw/zinc/45/44/01/643454401.db2.gz JRLWPBBMWPKFAH-UHFFFAOYSA-N -1 3 281.783 2.904 20 10 CFCDHM CC1(C)C[C@H](NC(=O)c2cccc(O)c2[O-])CCS1 ZINC000888801182 644559094 /nfs/dbraw/zinc/55/90/94/644559094.db2.gz XJQXVHOYEHZUSC-SECBINFHSA-N -1 3 281.377 2.502 20 10 CFCDHM O=C(NCC[C@@H]1CCCC1(F)F)c1cccc(O)c1[O-] ZINC000881582173 645056742 /nfs/dbraw/zinc/05/67/42/645056742.db2.gz CSXJKFNSXSCMBQ-VIFPVBQESA-N -1 3 285.290 2.653 20 10 CFCDHM CC(C)c1nnc([C@@H](C)NCc2cc(F)cc(F)c2[O-])[nH]1 ZINC000883078394 645595070 /nfs/dbraw/zinc/59/50/70/645595070.db2.gz PUAZIGYCKVYYDG-MRVPVSSYSA-N -1 3 296.321 2.763 20 10 CFCDHM CC(C)c1nc([C@@H](C)NCc2cc(F)cc(F)c2[O-])n[nH]1 ZINC000883078394 645595077 /nfs/dbraw/zinc/59/50/77/645595077.db2.gz PUAZIGYCKVYYDG-MRVPVSSYSA-N -1 3 296.321 2.763 20 10 CFCDHM C[C@@H]1CO[C@@H](C)CN1Cc1cc(Cl)ccc1[O-] ZINC000132181338 645888978 /nfs/dbraw/zinc/88/89/78/645888978.db2.gz NPORTKZGDXPOPY-ZJUUUORDSA-N -1 3 255.745 2.655 20 10 CFCDHM C[C@H](NCc1nccs1)c1c([O-])cccc1F ZINC000886508973 647022866 /nfs/dbraw/zinc/02/28/66/647022866.db2.gz VREAWFMFYVJREJ-QMMMGPOBSA-N -1 3 252.314 2.839 20 10 CFCDHM C[C@@H](N[C@H]1CCn2ccnc21)c1c([O-])cccc1F ZINC000886615413 647069314 /nfs/dbraw/zinc/06/93/14/647069314.db2.gz FUIDKPFOKCPHHL-KOLCDFICSA-N -1 3 261.300 2.523 20 10 CFCDHM C[C@]12CN(C(=O)c3cccc(O)c3[O-])C[C@H]1[C@H]1CC[C@@H]2C1 ZINC000887883520 647430832 /nfs/dbraw/zinc/43/08/32/647430832.db2.gz QGMJKASRUAIEMA-IANATYFASA-N -1 3 287.359 2.606 20 10 CFCDHM O=C(NCc1c([O-])cccc1F)c1occ2c1CCC2 ZINC000928704901 648943913 /nfs/dbraw/zinc/94/39/13/648943913.db2.gz AUGRVKJZQVAMJF-UHFFFAOYSA-N -1 3 275.279 2.543 20 10 CFCDHM C[C@H]1CCC[C@@]1(C)C(=O)NCc1c([O-])cccc1F ZINC000928706008 648944535 /nfs/dbraw/zinc/94/45/35/648944535.db2.gz NKQJOOXLGMGUSK-ZUZCIYMTSA-N -1 3 265.328 2.974 20 10 CFCDHM Cc1c(C(=O)NCc2c([O-])cccc2F)cnn1C(C)C ZINC000928705871 648944629 /nfs/dbraw/zinc/94/46/29/648944629.db2.gz OONRJCRIRYTSBK-UHFFFAOYSA-N -1 3 291.326 2.547 20 10 CFCDHM O=C(CCCC(F)(F)F)NCc1c([O-])cccc1F ZINC000928705241 648944991 /nfs/dbraw/zinc/94/49/91/648944991.db2.gz ICZPDEOQMVXUPJ-UHFFFAOYSA-N -1 3 279.233 2.880 20 10 CFCDHM C[C@@H]1CCCC[C@@H]1C(=O)NCc1c([O-])cccc1F ZINC000928706627 648945527 /nfs/dbraw/zinc/94/55/27/648945527.db2.gz SNUIQAMVXZAUKZ-MNOVXSKESA-N -1 3 265.328 2.974 20 10 CFCDHM CCC[C@H]1C[C@@H](C(=O)NCc2c([O-])cccc2F)CCO1 ZINC000928709196 648946106 /nfs/dbraw/zinc/94/61/06/648946106.db2.gz YEUNSJMLYVCJTE-RYUDHWBXSA-N -1 3 295.354 2.743 20 10 CFCDHM CC(=O)c1cc(Cl)cc(CN2CCC[C@]2(C)CO)c1[O-] ZINC000723022344 770447280 /nfs/dbraw/zinc/44/72/80/770447280.db2.gz IOFGMOOQYHIYBW-OAHLLOKOSA-N -1 3 297.782 2.595 20 10 CFCDHM O=C(NCc1c([O-])cccc1F)NC1CCC=CCC1 ZINC000924057218 770820589 /nfs/dbraw/zinc/82/05/89/770820589.db2.gz AUGJMIJFNTYSRV-UHFFFAOYSA-N -1 3 278.327 2.829 20 10 CFCDHM CN1c2ccccc2C(=O)N[C@@H]1c1cc(Cl)ccc1[O-] ZINC000024034698 775731781 /nfs/dbraw/zinc/73/17/81/775731781.db2.gz MLQGPQNHMLPVQT-AWEZNQCLSA-N -1 3 288.734 2.924 20 10 CFCDHM O=C1c2cccc(OC3CC3)c2C(=O)c2cccc([O-])c21 ZINC001229191798 776749386 /nfs/dbraw/zinc/74/93/86/776749386.db2.gz DFRHIOBOQGBLSZ-UHFFFAOYSA-N -1 3 280.279 2.709 20 10 CFCDHM CC(C)C1CC[NH+](Cc2cc(C(=O)[O-])ccc2[O-])CC1 ZINC001231565221 777261680 /nfs/dbraw/zinc/26/16/80/777261680.db2.gz BOEWDSDNUHRKPJ-UHFFFAOYSA-N -1 3 277.364 2.958 20 10 CFCDHM O=C([O-])c1ccc([O-])c(C[N@@H+]2CCC[C@H]3CCC[C@@H]32)c1 ZINC001231565009 777262069 /nfs/dbraw/zinc/26/20/69/777262069.db2.gz MYRXNBYJEWJFBN-RISCZKNCSA-N -1 3 275.348 2.855 20 10 CFCDHM O=C([O-])c1ccc([O-])c(C[N@H+]2CCC[C@H]3CCC[C@@H]32)c1 ZINC001231565009 777262076 /nfs/dbraw/zinc/26/20/76/777262076.db2.gz MYRXNBYJEWJFBN-RISCZKNCSA-N -1 3 275.348 2.855 20 10 CFCDHM CO[C@@H]1CN(Cc2cc(Cl)c(C)cc2[O-])C[C@@H]1F ZINC001231867950 777357949 /nfs/dbraw/zinc/35/79/49/777357949.db2.gz OGZPBHDCKDWEGK-WCQYABFASA-N -1 3 273.735 2.523 20 10 CFCDHM C[C@H]1CCN(Cc2cc(Cl)c([O-])cc2O)CCC1=O ZINC001232259404 777496792 /nfs/dbraw/zinc/49/67/92/777496792.db2.gz JCDWHOSWJOUXLG-VIFPVBQESA-N -1 3 283.755 2.552 20 10 CFCDHM COc1cc([O-])c(CN2C[C@@H]3C[C@@H]3[C@H](F)C2)cc1Cl ZINC001232268090 777501020 /nfs/dbraw/zinc/50/10/20/777501020.db2.gz LXQGVDUOUFKKGP-PTOFAABTSA-N -1 3 285.746 2.844 20 10 CFCDHM COC[C@H]1CCCCN1Cc1c([O-])ccc(F)c1F ZINC001233332374 777890997 /nfs/dbraw/zinc/89/09/97/777890997.db2.gz JDMZRZSRYFJRQA-SNVBAGLBSA-N -1 3 271.307 2.671 20 10 CFCDHM C[C@@]1(CF)CCN(Cc2c([O-])ccc(F)c2F)C1 ZINC001233332335 777891072 /nfs/dbraw/zinc/89/10/72/777891072.db2.gz HMTSMMYMBLTBRD-ZDUSSCGKSA-N -1 3 259.271 2.852 20 10 CFCDHM CC1(F)CN(Cc2ccc(C(F)(F)F)cc2[O-])C1 ZINC001233452305 777959655 /nfs/dbraw/zinc/95/96/55/777959655.db2.gz QWZIKPFORTWCIH-UHFFFAOYSA-N -1 3 263.234 2.955 20 10 CFCDHM [O-]c1cc(C(F)(F)F)ccc1CN1CCn2nccc2C1 ZINC001233455376 777960230 /nfs/dbraw/zinc/96/02/30/777960230.db2.gz ICJUNZDZTFZIOJ-UHFFFAOYSA-N -1 3 297.280 2.623 20 10 CFCDHM [O-]c1ccc(Br)cc1CN1C[C@@H](F)[C@H](F)C1 ZINC000714556303 778288405 /nfs/dbraw/zinc/28/84/05/778288405.db2.gz SAVHIVMSLUMKCN-NXEZZACHSA-N -1 3 292.123 2.647 20 10 CFCDHM [O-]c1cc(Cl)c(Cl)cc1CN1CC[C@@H](CO)C1 ZINC001236796467 778941456 /nfs/dbraw/zinc/94/14/56/778941456.db2.gz PJLHJEUUZVXKNN-MRVPVSSYSA-N -1 3 276.163 2.513 20 10 CFCDHM [O-]c1cc(Cl)c(Cl)cc1CN1CCC(CO)CC1 ZINC001236789386 778937512 /nfs/dbraw/zinc/93/75/12/778937512.db2.gz FRVKNMVJYRDTQB-UHFFFAOYSA-N -1 3 290.190 2.903 20 10 CFCDHM C[C@@H]1C[C@H](O)CN1Cc1cc(Cl)c(Cl)cc1[O-] ZINC001236792057 778938568 /nfs/dbraw/zinc/93/85/68/778938568.db2.gz AXNMWKRQDMXNKV-APPZFPTMSA-N -1 3 276.163 2.654 20 10 CFCDHM C[C@]1(O)CCN(Cc2cc(Cl)c(Cl)cc2[O-])C1 ZINC001236794737 778941684 /nfs/dbraw/zinc/94/16/84/778941684.db2.gz UHURQUKAPSURNT-LBPRGKRZSA-N -1 3 276.163 2.656 20 10 CFCDHM [O-]c1cc(Cl)c(Cl)cc1CN1CCC2(COC2)C1 ZINC001236794841 778941796 /nfs/dbraw/zinc/94/17/96/778941796.db2.gz VNCNNKQXSNLLQG-UHFFFAOYSA-N -1 3 288.174 2.921 20 10 CFCDHM CC[C@H]1COCCN1Cc1c([O-])cc(OC)cc1Cl ZINC001236803379 778944606 /nfs/dbraw/zinc/94/46/06/778944606.db2.gz NCCVEPZSXNAKBG-JTQLQIEISA-N -1 3 285.771 2.665 20 10 CFCDHM COC[C@@H]1CCN1Cc1cc(Cl)c(Cl)cc1[O-] ZINC001236805223 778947235 /nfs/dbraw/zinc/94/72/35/778947235.db2.gz XROGGFUDBFYYQK-VIFPVBQESA-N -1 3 276.163 2.920 20 10 CFCDHM COc1cc([O-])c(CN2CCOC[C@@H]2C2CC2)c(Cl)c1 ZINC001236808313 778948200 /nfs/dbraw/zinc/94/82/00/778948200.db2.gz NFZFSMJAIIEMHA-CQSZACIVSA-N -1 3 297.782 2.665 20 10 CFCDHM COc1cc([O-])c(CN2CC(C)C2)c(Br)c1 ZINC001237062004 779001877 /nfs/dbraw/zinc/00/18/77/779001877.db2.gz IQVUSLODHBXTJN-UHFFFAOYSA-N -1 3 286.169 2.615 20 10 CFCDHM [O-]c1ccc(F)c(Cl)c1CN1CC[C@H]2OCC[C@H]21 ZINC001237123605 779020141 /nfs/dbraw/zinc/02/01/41/779020141.db2.gz JRGNHMRLNJCYEL-ZYHUDNBSSA-N -1 3 271.719 2.548 20 10 CFCDHM Cn1cnc(NCc2cc(Cl)c3cccnc3c2[O-])c1 ZINC001168521345 779431466 /nfs/dbraw/zinc/43/14/66/779431466.db2.gz AGCKHOCRVMEKIV-UHFFFAOYSA-N -1 3 288.738 2.939 20 10 CFCDHM Cc1cc(CN(C)Cc2cc(F)c(Cl)cc2[O-])n(C)n1 ZINC001237937976 779724768 /nfs/dbraw/zinc/72/47/68/779724768.db2.gz WDDNEVQXXVMHGP-UHFFFAOYSA-N -1 3 297.761 2.859 20 10 CFCDHM CO[C@H]1CN(Cc2ccc(F)c(F)c2[O-])CC[C@H]1C ZINC000703532169 781026475 /nfs/dbraw/zinc/02/64/75/781026475.db2.gz SWOFZNVIUDDPSP-SKDRFNHKSA-N -1 3 271.307 2.527 20 10 CFCDHM CCN(C(=O)c1cccc(O)c1[O-])[C@@H](C)C(C)C ZINC000706447301 781174198 /nfs/dbraw/zinc/17/41/98/781174198.db2.gz AQPHTZRTNWLEEA-JTQLQIEISA-N -1 3 251.326 2.604 20 10 CFCDHM O=C(c1cccc(O)c1[O-])N1C2CCCC1CCC2 ZINC000707237339 781235520 /nfs/dbraw/zinc/23/55/20/781235520.db2.gz ORDZVBXMBOHUJU-UHFFFAOYSA-N -1 3 261.321 2.645 20 10 CFCDHM C[C@@H](NCc1cc(F)cc(F)c1[O-])c1ccns1 ZINC000708432816 781274811 /nfs/dbraw/zinc/27/48/11/781274811.db2.gz DAWZDYYPKVFYDY-SSDOTTSWSA-N -1 3 270.304 2.978 20 10 CFCDHM Cc1nc(CNCc2cc(F)cc(F)c2[O-])cs1 ZINC000708468714 781276145 /nfs/dbraw/zinc/27/61/45/781276145.db2.gz XJWOYYKCKNQMMZ-UHFFFAOYSA-N -1 3 270.304 2.725 20 10 CFCDHM C[C@H]1COCCN(Cc2cccc(Cl)c2[O-])C1 ZINC000378445510 300340018 /nfs/dbraw/zinc/34/00/18/300340018.db2.gz UPLGAVXJCLCJJW-SNVBAGLBSA-N -1 3 255.745 2.514 20 10 CFCDHM C[C@@H](N[C@H](C)c1ccc(F)c(F)c1[O-])c1cnn(C)c1 ZINC000276883678 296158617 /nfs/dbraw/zinc/15/86/17/296158617.db2.gz GLAHPHFDXODQHI-RKDXNWHRSA-N -1 3 281.306 2.816 20 10 CFCDHM Cc1ccc(C[C@H](C)NC(=O)c2cccc(O)c2[O-])s1 ZINC000126440209 377228012 /nfs/dbraw/zinc/22/80/12/377228012.db2.gz JBFIWYKWYIYFGT-VIFPVBQESA-N -1 3 291.372 2.829 20 10 CFCDHM CCC[C@@H]1CCCCN1C(=O)c1cccc(O)c1[O-] ZINC000126517330 377232899 /nfs/dbraw/zinc/23/28/99/377232899.db2.gz ZDQMANCNVHSVCX-LLVKDONJSA-N -1 3 263.337 2.893 20 10 CFCDHM CCC[C@H]1CN(Cc2cc(F)cc(C(C)=O)c2[O-])CCO1 ZINC000132176528 377810184 /nfs/dbraw/zinc/81/01/84/377810184.db2.gz SBHHOXVVZJWIRC-AWEZNQCLSA-N -1 3 295.354 2.735 20 10 CFCDHM CCCOc1ccc(CN(C)Cc2nccn2C)c([O-])c1 ZINC000134114100 377983377 /nfs/dbraw/zinc/98/33/77/377983377.db2.gz DXGCUOXJBUZZHW-UHFFFAOYSA-N -1 3 289.379 2.547 20 10 CFCDHM COC[C@H]1CCCN(Cc2cc(F)cc(C(C)=O)c2[O-])C1 ZINC000177285093 380325088 /nfs/dbraw/zinc/32/50/88/380325088.db2.gz KTOMIOZLBDBYSD-LBPRGKRZSA-N -1 3 295.354 2.592 20 10 CFCDHM Cc1ccc(C(=O)N(C)[C@H](C)c2ccco2)c([O-])c1O ZINC000179419713 380541383 /nfs/dbraw/zinc/54/13/83/380541383.db2.gz VZMHXCMACVBBNM-SNVBAGLBSA-N -1 3 275.304 2.832 20 10 CFCDHM C[C@@H]1CN(Cc2cc(F)ccc2[O-])CC(C)(C)O1 ZINC000179982812 380605361 /nfs/dbraw/zinc/60/53/61/380605361.db2.gz FQXQVBXIRIDSDH-SNVBAGLBSA-N -1 3 253.317 2.531 20 10 CFCDHM CN(Cc1nnc(C2CC2)n1C1CC1)Cc1ccccc1[O-] ZINC000181461643 380797489 /nfs/dbraw/zinc/79/74/89/380797489.db2.gz HJLRSSBWHVNVJT-UHFFFAOYSA-N -1 3 298.390 2.828 20 10 CFCDHM C[C@H](O)c1ncc(CN(C)Cc2ccccc2[O-])s1 ZINC000289091305 381024910 /nfs/dbraw/zinc/02/49/10/381024910.db2.gz LIVNOSHADWBZPP-JTQLQIEISA-N -1 3 278.377 2.534 20 10 CFCDHM Cc1noc([C@@H](NCc2ccccc2[O-])c2ccccc2)n1 ZINC000369118729 381197094 /nfs/dbraw/zinc/19/70/94/381197094.db2.gz UDTYMOAZPVAWBR-INIZCTEOSA-N -1 3 295.342 2.963 20 10 CFCDHM COC(=O)C1CCN(Cc2cc(Cl)cc(C)c2[O-])CC1 ZINC000183486880 381277077 /nfs/dbraw/zinc/27/70/77/381277077.db2.gz LYNBUCVYXLJANE-UHFFFAOYSA-N -1 3 297.782 2.739 20 10 CFCDHM CN(C)c1ccc(CNCc2cc([O-])cc(F)c2)cc1 ZINC000184134614 381374501 /nfs/dbraw/zinc/37/45/01/381374501.db2.gz OARFOFKKNHJFPH-UHFFFAOYSA-N -1 3 274.339 2.887 20 10 CFCDHM CCn1ccnc1CN[C@@H](C)c1ccc(F)cc1[O-] ZINC000296605515 381468421 /nfs/dbraw/zinc/46/84/21/381468421.db2.gz VYEMDGASPGUFGK-JTQLQIEISA-N -1 3 263.316 2.599 20 10 CFCDHM Cn1cnc2c1CCN(Cc1c([O-])ccc3ccccc31)C2 ZINC000371713290 381687024 /nfs/dbraw/zinc/68/70/24/381687024.db2.gz LXBBTBDPXYZOCW-UHFFFAOYSA-N -1 3 293.370 2.837 20 10 CFCDHM Cc1ccc(C(=O)N2C[C@H]3CCCCC[C@@H]32)c([O-])c1O ZINC000374771687 382056060 /nfs/dbraw/zinc/05/60/60/382056060.db2.gz PBUMPNAVFGDQAJ-YPMHNXCESA-N -1 3 275.348 2.811 20 10 CFCDHM O=C(N[C@@H]1CCCOc2ccccc21)c1cccc(O)c1[O-] ZINC000187056967 382087735 /nfs/dbraw/zinc/08/77/35/382087735.db2.gz HRBPGJBWLCWRJF-CYBMUJFWSA-N -1 3 299.326 2.742 20 10 CFCDHM CCc1nnc([C@@H](C)NCc2cc(Cl)c(F)cc2[O-])[nH]1 ZINC000293729786 382254001 /nfs/dbraw/zinc/25/40/01/382254001.db2.gz WGSLLTOREOLMEV-SSDOTTSWSA-N -1 3 298.749 2.716 20 10 CFCDHM CCc1nc([C@@H](C)NCc2cc(Cl)c(F)cc2[O-])n[nH]1 ZINC000293729786 382254008 /nfs/dbraw/zinc/25/40/08/382254008.db2.gz WGSLLTOREOLMEV-SSDOTTSWSA-N -1 3 298.749 2.716 20 10 CFCDHM [O-]c1cc(F)c(Cl)cc1CN1CCC[C@@H](O)CC1 ZINC000293914106 382334811 /nfs/dbraw/zinc/33/48/11/382334811.db2.gz GEIVPDDDIHQZOM-SNVBAGLBSA-N -1 3 273.735 2.532 20 10 CFCDHM O=C(c1cccc(O)c1[O-])N1CC[C@@H]1c1ccccc1F ZINC000365753766 382437294 /nfs/dbraw/zinc/43/72/94/382437294.db2.gz OCUHRASSTVEJLD-CYBMUJFWSA-N -1 3 287.290 2.824 20 10 CFCDHM [O-]c1c(Cl)cccc1C[N@@H+]1CCC[C@H](c2nnc[n-]2)C1 ZINC000378446066 382463042 /nfs/dbraw/zinc/46/30/42/382463042.db2.gz XUULDRGZLPFFAO-NSHDSACASA-N -1 3 292.770 2.543 20 10 CFCDHM [O-]c1c(Cl)cccc1C[N@H+]1CCC[C@H](c2nnc[n-]2)C1 ZINC000378446066 382463047 /nfs/dbraw/zinc/46/30/47/382463047.db2.gz XUULDRGZLPFFAO-NSHDSACASA-N -1 3 292.770 2.543 20 10 CFCDHM CCN(C)C(=O)[C@H](C)N[C@H](C)c1cc(Cl)ccc1[O-] ZINC000189400354 382603972 /nfs/dbraw/zinc/60/39/72/382603972.db2.gz MWUDXASPOUOTTF-ZJUUUORDSA-N -1 3 284.787 2.563 20 10 CFCDHM CC(C)C1CCN(C(=O)c2cccc(O)c2[O-])CC1 ZINC000190142250 382654836 /nfs/dbraw/zinc/65/48/36/382654836.db2.gz GROLUESRZMOISH-UHFFFAOYSA-N -1 3 263.337 2.606 20 10 CFCDHM CCC[C@@H](C)N(C)C(=O)c1ccc(C)c(O)c1[O-] ZINC000267570987 384416756 /nfs/dbraw/zinc/41/67/56/384416756.db2.gz IPLROYXURVGVRM-SNVBAGLBSA-N -1 3 251.326 2.667 20 10 CFCDHM Cn1nccc1[C@@H]1CCCCN1Cc1cc(F)ccc1[O-] ZINC000281140811 385185460 /nfs/dbraw/zinc/18/54/60/385185460.db2.gz DSLMTKVDAGKJEC-HNNXBMFYSA-N -1 3 289.354 2.992 20 10 CFCDHM CN(Cc1ccon1)Cc1cc(Br)ccc1[O-] ZINC000271181810 385366074 /nfs/dbraw/zinc/36/60/74/385366074.db2.gz HZFFDJAGWKAZEI-UHFFFAOYSA-N -1 3 297.152 2.775 20 10 CFCDHM CC[C@@H]1CN(Cc2cc(Cl)cc(Cl)c2[O-])C[C@@H]1O ZINC000271244927 385377666 /nfs/dbraw/zinc/37/76/66/385377666.db2.gz BXUDJHCLTUUTIS-PELKAZGASA-N -1 3 290.190 2.902 20 10 CFCDHM CC[C@H](NCc1cnn(C)c1)c1ccc(F)cc1[O-] ZINC000286102869 385560631 /nfs/dbraw/zinc/56/06/31/385560631.db2.gz NHVQWYJLXIHBBQ-ZDUSSCGKSA-N -1 3 263.316 2.506 20 10 CFCDHM C[C@H]1CCN(C(=O)c2cccc(O)c2[O-])C[C@@H](C)C1 ZINC000193146571 393643247 /nfs/dbraw/zinc/64/32/47/393643247.db2.gz ZPAUAKHDBGQIRF-QWRGUYRKSA-N -1 3 263.337 2.606 20 10 CFCDHM CCCCc1nc(CN(C)Cc2ccccc2[O-])no1 ZINC000109773243 393879831 /nfs/dbraw/zinc/87/98/31/393879831.db2.gz HJMNKCPJSDEGEV-UHFFFAOYSA-N -1 3 275.352 2.750 20 10 CFCDHM CN(C(=O)/C=C\c1cncc([O-])c1)c1ccc(F)c(F)c1 ZINC000492518214 394069766 /nfs/dbraw/zinc/06/97/66/394069766.db2.gz GIMHSJAEEIJBQN-DJWKRKHSSA-N -1 3 290.269 2.742 20 10 CFCDHM Cn1cnc(-c2cccc(NCc3cc(F)ccc3[O-])c2)n1 ZINC000153536244 394285518 /nfs/dbraw/zinc/28/55/18/394285518.db2.gz BTPCOIODGNGHNG-UHFFFAOYSA-N -1 3 298.321 2.939 20 10 CFCDHM C[C@H](NCc1ccccc1[O-])c1nnc2n1CCCCC2 ZINC000037140676 260069325 /nfs/dbraw/zinc/06/93/25/260069325.db2.gz HCWGVICJGDQPTB-LBPRGKRZSA-N -1 3 286.379 2.561 20 10 CFCDHM CCN(Cc1cc(F)cc(C(C)=O)c1[O-])C1CC1 ZINC000037322916 260159986 /nfs/dbraw/zinc/15/99/86/260159986.db2.gz IKJHFKIFPXBANQ-UHFFFAOYSA-N -1 3 251.301 2.718 20 10 CFCDHM Cc1ccc(C(=O)N2C[C@@H]3CCCCC[C@H]32)c([O-])c1O ZINC000374771686 267812905 /nfs/dbraw/zinc/81/29/05/267812905.db2.gz PBUMPNAVFGDQAJ-WCQYABFASA-N -1 3 275.348 2.811 20 10 CFCDHM CC[C@H](NCc1nncn1CC)c1cccc(Cl)c1[O-] ZINC000287547427 288051291 /nfs/dbraw/zinc/05/12/91/288051291.db2.gz FKHCUHCDRKFWOH-LBPRGKRZSA-N -1 3 294.786 2.898 20 10 CFCDHM CC[C@H]1CCCCN1C(=O)c1ccc(C)c(O)c1[O-] ZINC000177667451 288194761 /nfs/dbraw/zinc/19/47/61/288194761.db2.gz JLKFHOYHBCAXSK-NSHDSACASA-N -1 3 263.337 2.811 20 10 CFCDHM C[C@H]1c2cccn2CCN1Cc1cccc(F)c1[O-] ZINC000272311707 280133947 /nfs/dbraw/zinc/13/39/47/280133947.db2.gz RRTHPTXLTWCNBZ-NSHDSACASA-N -1 3 260.312 2.910 20 10 CFCDHM O=C(c1cccc(O)c1[O-])N1CCC[C@@H]2CCCC[C@@H]21 ZINC000126269525 304549306 /nfs/dbraw/zinc/54/93/06/304549306.db2.gz QGDHUQFGVXWHQZ-AAEUAGOBSA-N -1 3 275.348 2.893 20 10 CFCDHM CC[C@@H](NCc1cnnn1CC)c1cccc(Cl)c1[O-] ZINC000527918470 330295391 /nfs/dbraw/zinc/29/53/91/330295391.db2.gz YOYVYXOCNPEOQT-CYBMUJFWSA-N -1 3 294.786 2.898 20 10 CFCDHM CC[C@@H](NCc1cnn(CC)n1)c1ccc(C)cc1[O-] ZINC000527921959 330295897 /nfs/dbraw/zinc/29/58/97/330295897.db2.gz ASGNHEGGBRKRJL-CQSZACIVSA-N -1 3 274.368 2.553 20 10 CFCDHM CCN(C(=O)/C=C\c1cncc([O-])c1)c1ccccc1OC ZINC000492403866 332395873 /nfs/dbraw/zinc/39/58/73/332395873.db2.gz ZYLHVFOSJSKRLJ-HJWRWDBZSA-N -1 3 298.342 2.862 20 10 CFCDHM CC(=O)c1cc(F)cc(CN(C)C2CCC2)c1[O-] ZINC000079464946 518283799 /nfs/dbraw/zinc/28/37/99/518283799.db2.gz JIVVTQQFSGQILM-UHFFFAOYSA-N -1 3 251.301 2.718 20 10 CFCDHM CCOCc1nc([C@@H](C)N[C@H](C)c2ccccc2[O-])no1 ZINC000290020789 520218341 /nfs/dbraw/zinc/21/83/41/520218341.db2.gz CGRXUADNORXDCD-GHMZBOCLSA-N -1 3 291.351 2.724 20 10 CFCDHM CCCC[C@@H](C)N(C)C(=O)c1cccc(O)c1[O-] ZINC000291280289 521002586 /nfs/dbraw/zinc/00/25/86/521002586.db2.gz ONMZTBWJGASNFL-SNVBAGLBSA-N -1 3 251.326 2.749 20 10 CFCDHM CN(CC1(c2ccccc2)CC1)C(=O)c1cccc(O)c1[O-] ZINC000275417383 522609829 /nfs/dbraw/zinc/60/98/29/522609829.db2.gz HTYVMMNXNULSJS-UHFFFAOYSA-N -1 3 297.354 2.902 20 10 CFCDHM CCn1cc(NCc2cc(Br)ccc2[O-])cn1 ZINC000121863195 523437046 /nfs/dbraw/zinc/43/70/46/523437046.db2.gz PWTTVVARADJVSV-UHFFFAOYSA-N -1 3 296.168 2.983 20 10 CFCDHM COC(=O)[C@H](c1ccsc1)N(C)Cc1ccccc1[O-] ZINC000280125886 523942367 /nfs/dbraw/zinc/94/23/67/523942367.db2.gz VNYYVOOOQNJRMT-AWEZNQCLSA-N -1 3 291.372 2.800 20 10 CFCDHM C[C@@H](NC[C@@](C)(O)C(F)(F)F)c1ccc(F)c(F)c1[O-] ZINC000276925929 525487666 /nfs/dbraw/zinc/48/76/66/525487666.db2.gz NHYNQYFSFZTMAU-KSBSHMNSSA-N -1 3 299.239 2.634 20 10 CFCDHM Cc1ccc([C@H](O)CNCc2c([O-])cccc2Cl)o1 ZINC000265987502 525976936 /nfs/dbraw/zinc/97/69/36/525976936.db2.gz NHKFGPDAVUGIJO-CYBMUJFWSA-N -1 3 281.739 2.770 20 10 CFCDHM [O-]c1ccc(F)cc1CN1CCCC[C@@H]1c1cc[nH]n1 ZINC000289612276 526349396 /nfs/dbraw/zinc/34/93/96/526349396.db2.gz VWQGDGXMYBIDAB-CQSZACIVSA-N -1 3 275.327 2.982 20 10 CFCDHM [O-]c1cccc(Cl)c1CN1CC[C@@H](n2cccn2)C1 ZINC000291211259 526363884 /nfs/dbraw/zinc/36/38/84/526363884.db2.gz IPAQBOSYLHDZQV-LLVKDONJSA-N -1 3 277.755 2.689 20 10 CFCDHM O=C(NC1CCC2(CC2)CC1)c1cccc(O)c1[O-] ZINC000277690096 527503256 /nfs/dbraw/zinc/50/32/56/527503256.db2.gz VBVYSWGLTOBBIS-UHFFFAOYSA-N -1 3 261.321 2.550 20 10 CFCDHM C[C@@H](C[N@H+](Cc1cc2c(cc1[O-])CCC2)C1CC1)C(=O)[O-] ZINC000736581634 574061364 /nfs/dbraw/zinc/06/13/64/574061364.db2.gz BOAXIOUCPMABHK-NSHDSACASA-N -1 3 289.375 2.566 20 10 CFCDHM C[C@@H](C[N@@H+](Cc1cc2c(cc1[O-])CCC2)C1CC1)C(=O)[O-] ZINC000736581634 574061365 /nfs/dbraw/zinc/06/13/65/574061365.db2.gz BOAXIOUCPMABHK-NSHDSACASA-N -1 3 289.375 2.566 20 10 CFCDHM COc1ccc2c(c1)CN(C(=O)c1cc([O-])cs1)CC2 ZINC000731870049 574131256 /nfs/dbraw/zinc/13/12/56/574131256.db2.gz IVIXRRYJKXXHAA-UHFFFAOYSA-N -1 3 289.356 2.661 20 10 CFCDHM O=C(N[C@H]1C[C@@H]1c1ccccc1)c1cc([O-])cs1 ZINC000732277754 574149645 /nfs/dbraw/zinc/14/96/45/574149645.db2.gz OKDZJWCFMPVWDQ-NEPJUHHUSA-N -1 3 259.330 2.740 20 10 CFCDHM Cc1ccc(OCCCNC(=O)c2cc([O-])cs2)cc1 ZINC000732283954 574149989 /nfs/dbraw/zinc/14/99/89/574149989.db2.gz YHJWEYZJORQEPN-UHFFFAOYSA-N -1 3 291.372 2.961 20 10 CFCDHM O=C(NCc1cccc2cccnc21)c1cc([O-])cs1 ZINC000732279144 574150225 /nfs/dbraw/zinc/15/02/25/574150225.db2.gz YXSUVYPPMHSNBM-UHFFFAOYSA-N -1 3 284.340 2.932 20 10 CFCDHM Cc1ccccc1OCCCNC(=O)c1cc([O-])cs1 ZINC000732287391 574150638 /nfs/dbraw/zinc/15/06/38/574150638.db2.gz BJXMBYBSEZXAHE-UHFFFAOYSA-N -1 3 291.372 2.961 20 10 CFCDHM CCCO[C@@H]1CCCN(C(=O)c2cc([O-])cs2)CC1 ZINC000732290668 574150810 /nfs/dbraw/zinc/15/08/10/574150810.db2.gz WGPJKWJRNQWCTO-GFCCVEGCSA-N -1 3 283.393 2.875 20 10 CFCDHM O=C(OCCOc1cccc(F)c1)c1cc([O-])cs1 ZINC000732353043 574152791 /nfs/dbraw/zinc/15/27/91/574152791.db2.gz KRBRTSZKLYTEFO-UHFFFAOYSA-N -1 3 282.292 2.829 20 10 CFCDHM O=C(OCCOc1ccccc1F)c1cc([O-])cs1 ZINC000732354537 574153331 /nfs/dbraw/zinc/15/33/31/574153331.db2.gz URWBFWXDIIAKOF-UHFFFAOYSA-N -1 3 282.292 2.829 20 10 CFCDHM COC(=O)[C@H](OC(=O)c1cc([O-])cs1)c1ccccc1 ZINC000732354875 574153400 /nfs/dbraw/zinc/15/34/00/574153400.db2.gz VFMKYBSHYMDLQX-GFCCVEGCSA-N -1 3 292.312 2.525 20 10 CFCDHM O=C(NCCc1ccc(F)cc1F)c1cc([O-])cs1 ZINC000732678103 574165160 /nfs/dbraw/zinc/16/51/60/574165160.db2.gz QMPUPKARPHJRRB-UHFFFAOYSA-N -1 3 283.299 2.704 20 10 CFCDHM Cc1cnn(CCCCCOC(=O)c2cc([O-])cs2)c1 ZINC000733496391 574242353 /nfs/dbraw/zinc/24/23/53/574242353.db2.gz HWIARJHUECBOGX-UHFFFAOYSA-N -1 3 294.376 2.986 20 10 CFCDHM C[C@@H](NCc1ccc(F)cn1)c1cc(F)ccc1[O-] ZINC000756657215 574255823 /nfs/dbraw/zinc/25/58/23/574255823.db2.gz BOGPWLPBVQDUJQ-SECBINFHSA-N -1 3 264.275 2.916 20 10 CFCDHM Cc1cc(CN[C@H]2C[C@@H](C)c3c2c([O-])ccc3F)ncn1 ZINC000756775430 574261885 /nfs/dbraw/zinc/26/18/85/574261885.db2.gz HKSATHZMGAAFAA-RNCFNFMXSA-N -1 3 287.338 2.968 20 10 CFCDHM CO[C@@H](CN[C@H](C)c1cc(F)cc(F)c1[O-])C(F)(F)F ZINC000756835112 574266753 /nfs/dbraw/zinc/26/67/53/574266753.db2.gz MSZZLCUGEIAJNE-LDWIPMOCSA-N -1 3 299.239 2.898 20 10 CFCDHM CCc1ccccc1CNC(=O)c1cc([O-])cs1 ZINC000740928414 574274596 /nfs/dbraw/zinc/27/45/96/574274596.db2.gz LFRQDIHMEAWOCH-UHFFFAOYSA-N -1 3 261.346 2.946 20 10 CFCDHM Cc1cc(N(C)C)ccc1CNC(=O)c1cc([O-])cs1 ZINC000734558124 574292815 /nfs/dbraw/zinc/29/28/15/574292815.db2.gz PBOFALXKZWOMQK-UHFFFAOYSA-N -1 3 290.388 2.758 20 10 CFCDHM Nc1ccnc(CN(Cc2ccccc2[O-])C2CCCC2)n1 ZINC000749513133 574298313 /nfs/dbraw/zinc/29/83/13/574298313.db2.gz AAPVGXVPIWOKMB-UHFFFAOYSA-N -1 3 298.390 2.709 20 10 CFCDHM CCO[C@H]1C[C@@H](NC(=O)c2cc([O-])cs2)C12CCC2 ZINC000743630450 574369821 /nfs/dbraw/zinc/36/98/21/574369821.db2.gz TWHXBYNUGJZGQM-NEPJUHHUSA-N -1 3 281.377 2.531 20 10 CFCDHM C[C@@H](CNC(=O)c1cc([O-])cs1)Oc1ccccc1F ZINC000743720889 574371358 /nfs/dbraw/zinc/37/13/58/574371358.db2.gz DTBHHDYYWRMMOZ-VIFPVBQESA-N -1 3 295.335 2.790 20 10 CFCDHM Cn1cnc2cc(NC(=O)c3cc([O-])cs3)ccc21 ZINC000743813849 574372859 /nfs/dbraw/zinc/37/28/59/574372859.db2.gz WHJIFBXFCBBFJG-UHFFFAOYSA-N -1 3 273.317 2.593 20 10 CFCDHM Cc1ccc(C(=O)N[C@@H](C)CCC(C)C)c([O-])c1O ZINC000751533608 574378646 /nfs/dbraw/zinc/37/86/46/574378646.db2.gz QOFNPFIOQYHMEO-NSHDSACASA-N -1 3 265.353 2.961 20 10 CFCDHM Cc1ccc(C(=O)N[C@H]2CCc3c2cccc3O)c([O-])c1O ZINC000751538514 574378758 /nfs/dbraw/zinc/37/87/58/574378758.db2.gz QSCCPUUYSZOEPA-ZDUSSCGKSA-N -1 3 299.326 2.529 20 10 CFCDHM CCN(CCC(F)(F)F)C(=O)c1ccc(C)c(O)c1[O-] ZINC000751538716 574378816 /nfs/dbraw/zinc/37/88/16/574378816.db2.gz UPRJGYXIVBSZOM-UHFFFAOYSA-N -1 3 291.269 2.821 20 10 CFCDHM CS[C@@H](CNC(=O)c1ccc(C)c(O)c1[O-])C(C)(C)C ZINC000752893511 574396185 /nfs/dbraw/zinc/39/61/85/574396185.db2.gz WPCWFWVARSXRLN-NSHDSACASA-N -1 3 297.420 2.914 20 10 CFCDHM C[C@H]([NH2+][C@@H](Cc1ccccc1)C(=O)[O-])c1ccccc1[O-] ZINC000204866947 597732798 /nfs/dbraw/zinc/73/27/98/597732798.db2.gz YEPSLJIJZZOSLE-WFASDCNBSA-N -1 3 285.343 2.739 20 10 CFCDHM Cc1cc(Cl)cc(C[NH2+]CCCCC(=O)[O-])c1[O-] ZINC000820976920 598193410 /nfs/dbraw/zinc/19/34/10/598193410.db2.gz WBQAEZWAOPPCDS-UHFFFAOYSA-N -1 3 271.744 2.699 20 10 CFCDHM CCC(CC)(CC(=O)[O-])[NH2+]Cc1ccccc1[O-] ZINC000828804209 601261280 /nfs/dbraw/zinc/26/12/80/601261280.db2.gz JDEQCUCSEIYYMJ-UHFFFAOYSA-N -1 3 251.326 2.515 20 10 CFCDHM C[C@H]1C[N@H+](Cc2c([O-])ccc3ccccc32)C[C@@H]1C(=O)[O-] ZINC000086774461 601816993 /nfs/dbraw/zinc/81/69/93/601816993.db2.gz UJISWMXXHFLTFH-FZMZJTMJSA-N -1 3 285.343 2.698 20 10 CFCDHM C[C@H]1C[N@@H+](Cc2c([O-])ccc3ccccc32)C[C@@H]1C(=O)[O-] ZINC000086774461 601816994 /nfs/dbraw/zinc/81/69/94/601816994.db2.gz UJISWMXXHFLTFH-FZMZJTMJSA-N -1 3 285.343 2.698 20 10 CFCDHM COc1ccc(C)cc1NC(=O)c1ccc(C)c(O)c1[O-] ZINC000179384962 618268991 /nfs/dbraw/zinc/26/89/91/618268991.db2.gz UHZXTZWYPNVYKI-UHFFFAOYSA-N -1 3 287.315 2.976 20 10 CFCDHM CC(C)(C)C(F)(F)CNC(=O)c1cccc(O)c1[O-] ZINC000856278866 618444222 /nfs/dbraw/zinc/44/42/22/618444222.db2.gz WARPTDURVASNCC-UHFFFAOYSA-N -1 3 273.279 2.509 20 10 CFCDHM Cc1ccc(C(=O)Nc2ccc3n[nH]cc3c2)c([O-])c1O ZINC000177667707 618470429 /nfs/dbraw/zinc/47/04/29/618470429.db2.gz DORYXSFAPZZWOT-UHFFFAOYSA-N -1 3 283.287 2.535 20 10 CFCDHM Cc1nc(NC(=O)c2ccc(C)c(O)c2[O-])sc1C ZINC000177685536 618472291 /nfs/dbraw/zinc/47/22/91/618472291.db2.gz LQLVPPRMWMOPIR-UHFFFAOYSA-N -1 3 278.333 2.732 20 10 CFCDHM [O-]c1c(F)cc(F)cc1CN1CCOCC2(CCC2)C1 ZINC000894464858 619392050 /nfs/dbraw/zinc/39/20/50/619392050.db2.gz UFPWNEADEGXVMY-UHFFFAOYSA-N -1 3 283.318 2.673 20 10 CFCDHM CN(Cc1cc(F)cc(F)c1[O-])[C@H](CO)c1ccccc1 ZINC000894884265 619497725 /nfs/dbraw/zinc/49/77/25/619497725.db2.gz VYUNCBBWKXCPTI-OAHLLOKOSA-N -1 3 293.313 2.836 20 10 CFCDHM COC(C)(C)c1nsc(NCc2c([O-])cccc2F)n1 ZINC000895833410 619619745 /nfs/dbraw/zinc/61/97/45/619619745.db2.gz WQUODXJXXRWFTG-UHFFFAOYSA-N -1 3 297.355 2.876 20 10 CFCDHM C[C@@H]1CCN(Cc2cc(Cl)c(F)cc2[O-])CCO1 ZINC000896578410 619765878 /nfs/dbraw/zinc/76/58/78/619765878.db2.gz URORBFINXAGGOF-SECBINFHSA-N -1 3 273.735 2.796 20 10 CFCDHM CCOCCC1(C(=O)NCc2c([O-])cccc2F)CCC1 ZINC000928706250 619995965 /nfs/dbraw/zinc/99/59/65/619995965.db2.gz TURWNEYHVSYJLO-UHFFFAOYSA-N -1 3 295.354 2.744 20 10 CFCDHM C[C@@H]1CC[C@@H](C(=O)NCc2c([O-])cccc2F)C1 ZINC000928709211 619996327 /nfs/dbraw/zinc/99/63/27/619996327.db2.gz YUHDYDPWTYNRKG-NXEZZACHSA-N -1 3 251.301 2.584 20 10 CFCDHM CS[C@@H](C)CCC(=O)NCc1c([O-])cccc1F ZINC000928708522 619996340 /nfs/dbraw/zinc/99/63/40/619996340.db2.gz NLGUVCYFBFOFPK-VIFPVBQESA-N -1 3 271.357 2.679 20 10 CFCDHM Cc1ccc(C(=O)Nc2ccc3c(c2)N(C)CC3)c([O-])c1O ZINC000182991724 625409948 /nfs/dbraw/zinc/40/99/48/625409948.db2.gz BCKYNYNIWPFMKM-UHFFFAOYSA-N -1 3 298.342 2.651 20 10 CFCDHM Cn1nnc(NCc2c([O-])cccc2Cl)c1C(F)F ZINC000902711148 621154007 /nfs/dbraw/zinc/15/40/07/621154007.db2.gz JGROXFVRLCCMNV-UHFFFAOYSA-N -1 3 288.685 2.724 20 10 CFCDHM CC(C)[C@H](N[C@H](C)c1ccc(F)cc1[O-])c1nncn1C ZINC000903066768 621239392 /nfs/dbraw/zinc/23/93/92/621239392.db2.gz XDTPZRUATWKFSX-YGRLFVJLSA-N -1 3 292.358 2.708 20 10 CFCDHM [O-]c1cccc(Cl)c1CN1CCO[C@H](C(F)F)C1 ZINC000802652951 622201048 /nfs/dbraw/zinc/20/10/48/622201048.db2.gz HWVVHRICDDKKNL-NSHDSACASA-N -1 3 277.698 2.512 20 10 CFCDHM C[C@@H]1C[C@H](C)[C@H](C)N(C(=O)c2cccc(O)c2[O-])C1 ZINC000166844022 623034476 /nfs/dbraw/zinc/03/44/76/623034476.db2.gz QKIVEIKKPMXAQF-VWYCJHECSA-N -1 3 263.337 2.604 20 10 CFCDHM C[C@@H]1C[C@@H](C)[C@@H](C)N(C(=O)c2cccc(O)c2[O-])C1 ZINC000229426468 623203937 /nfs/dbraw/zinc/20/39/37/623203937.db2.gz QKIVEIKKPMXAQF-GMTAPVOTSA-N -1 3 263.337 2.604 20 10 CFCDHM Cc1cnc(CNCc2cccc(Br)c2[O-])o1 ZINC000231788079 623369765 /nfs/dbraw/zinc/36/97/65/623369765.db2.gz POBUSCJNMYSFQR-UHFFFAOYSA-N -1 3 297.152 2.741 20 10 CFCDHM [O-]c1cc(F)c(Cl)cc1CN[C@H]1CCn2ccnc21 ZINC000824533993 623520213 /nfs/dbraw/zinc/52/02/13/623520213.db2.gz WEJAMHFGIGUBHT-NSHDSACASA-N -1 3 281.718 2.616 20 10 CFCDHM CC(C)c1nnc(CNCc2cc(Cl)cc(F)c2[O-])[nH]1 ZINC000824602765 623531651 /nfs/dbraw/zinc/53/16/51/623531651.db2.gz FHIDBCJEJZHFIX-UHFFFAOYSA-N -1 3 298.749 2.716 20 10 CFCDHM CCc1ncc(CNCc2c([O-])cccc2Cl)o1 ZINC000825078777 623623515 /nfs/dbraw/zinc/62/35/15/623623515.db2.gz DCUGDVLDPCHXPP-UHFFFAOYSA-N -1 3 266.728 2.886 20 10 CFCDHM CN(Cc1cnc[nH]1)Cc1c([O-])ccc(Cl)c1F ZINC000826769366 623870044 /nfs/dbraw/zinc/87/00/44/623870044.db2.gz KLEWAMJJCHHCQL-UHFFFAOYSA-N -1 3 269.707 2.540 20 10 CFCDHM Cc1ccc(C(=O)Nc2ccc3c(c2)CCO3)c([O-])c1O ZINC000181854402 625224105 /nfs/dbraw/zinc/22/41/05/625224105.db2.gz IXWDGGGZBYKHEF-UHFFFAOYSA-N -1 3 285.299 2.593 20 10 CFCDHM O=C(NC1(c2ccccc2F)CC1)c1cccc(O)c1[O-] ZINC000185691726 625761356 /nfs/dbraw/zinc/76/13/56/625761356.db2.gz ZUYHNEPYANRJEI-UHFFFAOYSA-N -1 3 287.290 2.656 20 10 CFCDHM O=C(Nc1ccc2c(c1)C(=O)CCC2)c1cccc(O)c1[O-] ZINC000185805968 625781119 /nfs/dbraw/zinc/78/11/19/625781119.db2.gz JIHPVVNUQCSQTQ-UHFFFAOYSA-N -1 3 297.310 2.869 20 10 CFCDHM C[C@@H](NCc1nnc(C2CC2)[nH]1)c1cc(F)cc(F)c1[O-] ZINC000834869518 625905605 /nfs/dbraw/zinc/90/56/05/625905605.db2.gz BMRAVMXGUXWSQY-SSDOTTSWSA-N -1 3 294.305 2.517 20 10 CFCDHM CCC(C)(C)CNC(=O)NCc1c([O-])cccc1F ZINC000922189481 626236299 /nfs/dbraw/zinc/23/62/99/626236299.db2.gz VRCYUDYHSAQNHN-UHFFFAOYSA-N -1 3 268.332 2.767 20 10 CFCDHM O=C(NCc1c([O-])cccc1F)NCC1=CCCCC1 ZINC000922656977 626333801 /nfs/dbraw/zinc/33/38/01/626333801.db2.gz SYTDSHFFSQLGSI-UHFFFAOYSA-N -1 3 278.327 2.831 20 10 CFCDHM O=C(Nc1cccc(OC(F)F)c1)c1cccc(O)c1[O-] ZINC000186948079 626406886 /nfs/dbraw/zinc/40/68/86/626406886.db2.gz SVSHOKIUPVULFL-UHFFFAOYSA-N -1 3 295.241 2.952 20 10 CFCDHM O=C(NCc1c([O-])cccc1F)NC[C@@H]1CC[C@@H]2C[C@@H]2C1 ZINC000923387015 626470246 /nfs/dbraw/zinc/47/02/46/626470246.db2.gz ILDHFEIRLICIIM-UTUOFQBUSA-N -1 3 292.354 2.767 20 10 CFCDHM [O-]c1c(Cl)cccc1CN1CC2(CC(F)C2)C1 ZINC000839140617 626528612 /nfs/dbraw/zinc/52/86/12/626528612.db2.gz RTVYXNKDILPFRF-UHFFFAOYSA-N -1 3 255.720 2.980 20 10 CFCDHM Cc1ncc(CNCc2c([O-])ccc(Cl)c2F)o1 ZINC000839169878 626529351 /nfs/dbraw/zinc/52/93/51/626529351.db2.gz KPRSKNOHHRQZPD-UHFFFAOYSA-N -1 3 270.691 2.771 20 10 CFCDHM [O-]c1cc(F)c(Cl)cc1CN1C[C@@H]2C[C@H]1CS2 ZINC000839193763 626531036 /nfs/dbraw/zinc/53/10/36/626531036.db2.gz XSPZPYXSFGEHRY-IUCAKERBSA-N -1 3 273.760 2.874 20 10 CFCDHM Cc1cc2cc(CNC(=O)c3cccc(O)c3[O-])ccc2[nH]1 ZINC000804887660 626539178 /nfs/dbraw/zinc/53/91/78/626539178.db2.gz LEVWBVGOZWDAPH-UHFFFAOYSA-N -1 3 296.326 2.818 20 10 CFCDHM C/C=C/C[C@@H](NCc1cc(F)ccc1[O-])C(=O)OCC ZINC000763361504 626982377 /nfs/dbraw/zinc/98/23/77/626982377.db2.gz LLIRBEDWNGIHCK-MASHWEEQSA-N -1 3 281.327 2.519 20 10 CFCDHM O=C(c1cccc(O)c1[O-])N1CCSC2(CCC2)CC1 ZINC000839803019 627936551 /nfs/dbraw/zinc/93/65/51/627936551.db2.gz IUPALQILGODANP-UHFFFAOYSA-N -1 3 293.388 2.600 20 10 CFCDHM O=C(N[C@H]1C[C@@H]1C1CCCCC1)c1cccc(O)c1[O-] ZINC000776663085 628167075 /nfs/dbraw/zinc/16/70/75/628167075.db2.gz FKRCCBDHRDZXML-OLZOCXBDSA-N -1 3 275.348 2.796 20 10 CFCDHM Cc1cn2cc(NC(=O)c3ccc(C)c(O)c3[O-])ccc2n1 ZINC000780921597 628505199 /nfs/dbraw/zinc/50/51/99/628505199.db2.gz MYAGIBQAWIFGHJ-UHFFFAOYSA-N -1 3 297.314 2.615 20 10 CFCDHM Cc1nnc(NCc2cc(C)cc(Br)c2[O-])o1 ZINC000781560134 628559674 /nfs/dbraw/zinc/55/96/74/628559674.db2.gz QWWCXSBUOSEQKK-UHFFFAOYSA-N -1 3 298.140 2.767 20 10 CFCDHM [O-]c1c(F)cc(Cl)cc1CN1CCOCC2(CC2)C1 ZINC000783598847 628725206 /nfs/dbraw/zinc/72/52/06/628725206.db2.gz ASEPOGOQCZNGPT-UHFFFAOYSA-N -1 3 285.746 2.797 20 10 CFCDHM [O-]c1c(F)cccc1CN1CCc2ncsc2C1 ZINC000783744865 628741227 /nfs/dbraw/zinc/74/12/27/628741227.db2.gz KBGZSZKXZBGFBU-UHFFFAOYSA-N -1 3 264.325 2.546 20 10 CFCDHM C[C@@H]1Cc2ccccc2[C@H]1NC(=O)c1cccc(O)c1[O-] ZINC000790704244 629257983 /nfs/dbraw/zinc/25/79/83/629257983.db2.gz OJKQQRRIOZLHBU-BMIGLBTASA-N -1 3 283.327 2.761 20 10 CFCDHM Cc1ccccc1CC1CN(C(=O)c2cccc(O)c2[O-])C1 ZINC000790873149 629269561 /nfs/dbraw/zinc/26/95/61/629269561.db2.gz IBOMFABRZPHPNV-UHFFFAOYSA-N -1 3 297.354 2.721 20 10 CFCDHM Cc1ccc2c(c1)CCN2C(=O)c1cccc(O)c1[O-] ZINC000790918764 629271742 /nfs/dbraw/zinc/27/17/42/629271742.db2.gz WRLQWYCSAPEHLL-UHFFFAOYSA-N -1 3 269.300 2.609 20 10 CFCDHM C[C@@H](NCc1c([O-])ccc(Cl)c1F)c1cnn(C)c1 ZINC000790970751 629275421 /nfs/dbraw/zinc/27/54/21/629275421.db2.gz FEBQYFCWZROGCN-MRVPVSSYSA-N -1 3 283.734 2.769 20 10 CFCDHM C[C@H]1COCCCN1Cc1c([O-])ccc(Cl)c1F ZINC000792166093 629404349 /nfs/dbraw/zinc/40/43/49/629404349.db2.gz OYZWEPUYRRGRHT-VIFPVBQESA-N -1 3 273.735 2.796 20 10 CFCDHM COCC1=CCN(Cc2c([O-])ccc(Cl)c2F)CC1 ZINC000792174803 629406149 /nfs/dbraw/zinc/40/61/49/629406149.db2.gz KUJBLKLYDQZOHC-UHFFFAOYSA-N -1 3 285.746 2.963 20 10 CFCDHM C[C@@H]1CN(Cc2c([O-])ccc(Cl)c2F)[C@H](C)CN1C ZINC000792173851 629406200 /nfs/dbraw/zinc/40/62/00/629406200.db2.gz DPMCGKGFLXKNHX-NXEZZACHSA-N -1 3 286.778 2.709 20 10 CFCDHM O=C(Nc1nccn1-c1ccccc1)c1cccc(O)c1[O-] ZINC000792479227 629427826 /nfs/dbraw/zinc/42/78/26/629427826.db2.gz USEADMSKKRBPSI-UHFFFAOYSA-N -1 3 295.298 2.536 20 10 CFCDHM Cc1cc(CN[C@@H](C)c2cc(F)cc(F)c2[O-])n(C)n1 ZINC000793562519 629571969 /nfs/dbraw/zinc/57/19/69/629571969.db2.gz VLVUECDYJCUVKE-VIFPVBQESA-N -1 3 281.306 2.563 20 10 CFCDHM CC[C@@H](NCc1nccn1C)c1ccc(F)cc1[O-] ZINC000796751611 629959913 /nfs/dbraw/zinc/95/99/13/629959913.db2.gz AJJNVFHEZBCOBN-GFCCVEGCSA-N -1 3 263.316 2.506 20 10 CFCDHM Cc1cc2c(cc1C)N(C(=O)c1cccc(O)c1[O-])CC2 ZINC000804320204 630671548 /nfs/dbraw/zinc/67/15/48/630671548.db2.gz MNWNXTWTSQGNEN-UHFFFAOYSA-N -1 3 283.327 2.918 20 10 CFCDHM CCn1ccc(CN[C@H](C)c2cc(F)cc(F)c2[O-])n1 ZINC000840840079 631237808 /nfs/dbraw/zinc/23/78/08/631237808.db2.gz FGFJLNWUOAQGJY-SECBINFHSA-N -1 3 281.306 2.738 20 10 CFCDHM Cc1cc([O-])c(CN(C)CC(=O)NC(C)(C)C)c(Cl)c1 ZINC000840910016 631260324 /nfs/dbraw/zinc/26/03/24/631260324.db2.gz OJYMRUOQRLTNLM-UHFFFAOYSA-N -1 3 298.814 2.701 20 10 CFCDHM Cc1cc([O-])c(CN2CC(OC(F)F)C2)c(Cl)c1 ZINC000840953305 631281626 /nfs/dbraw/zinc/28/16/26/631281626.db2.gz OWFRVHVLBQMIQK-UHFFFAOYSA-N -1 3 277.698 2.777 20 10 CFCDHM [O-]c1ccc(Cl)cc1CN1CC(O)(c2ccccc2)C1 ZINC000811508924 631573316 /nfs/dbraw/zinc/57/33/16/631573316.db2.gz LDWIGWDFWWPKEE-UHFFFAOYSA-N -1 3 289.762 2.749 20 10 CFCDHM [O-]c1cccc(Cl)c1CN1CCO[C@@]2(CCSC2)C1 ZINC000843417319 631948635 /nfs/dbraw/zinc/94/86/35/631948635.db2.gz AWMAUEXRWBCFQX-AWEZNQCLSA-N -1 3 299.823 2.754 20 10 CFCDHM C[C@H](NCc1cc[nH]n1)c1cccc(C(F)(F)F)c1[O-] ZINC000815577697 632291347 /nfs/dbraw/zinc/29/13/47/632291347.db2.gz WONCOCUATNFRQT-QMMMGPOBSA-N -1 3 285.269 2.985 20 10 CFCDHM Cc1cc(Cl)cc(C[N@@H+](CC(=O)[O-])CC2CC2)c1[O-] ZINC000844936941 632342075 /nfs/dbraw/zinc/34/20/75/632342075.db2.gz QTIFPINRJGZRNR-UHFFFAOYSA-N -1 3 283.755 2.651 20 10 CFCDHM Cc1cc(Cl)cc(C[N@H+](CC(=O)[O-])CC2CC2)c1[O-] ZINC000844936941 632342080 /nfs/dbraw/zinc/34/20/80/632342080.db2.gz QTIFPINRJGZRNR-UHFFFAOYSA-N -1 3 283.755 2.651 20 10 CFCDHM C[C@@H]1CN(C)[C@@H](C)CN1Cc1cc(Cl)c(F)cc1[O-] ZINC000816571420 632487836 /nfs/dbraw/zinc/48/78/36/632487836.db2.gz CYFWUUIFKBQGMM-VHSXEESVSA-N -1 3 286.778 2.709 20 10 CFCDHM CC(C)(C)n1cc(CNCc2cc(Cl)ccc2[O-])nn1 ZINC000846054687 632625104 /nfs/dbraw/zinc/62/51/04/632625104.db2.gz DOZMKYUVYVWCLL-UHFFFAOYSA-N -1 3 294.786 2.682 20 10 CFCDHM C[C@H](NCC(F)(F)CN)c1cccc(C(F)(F)F)c1[O-] ZINC000817967545 632766337 /nfs/dbraw/zinc/76/63/37/632766337.db2.gz KDJKIAUQRKQQGA-ZETCQYMHSA-N -1 3 298.255 2.656 20 10 CFCDHM Cc1cc(Cl)cc(C[N@H+](CC(=O)[O-])C2CCC2)c1[O-] ZINC000848639768 633305940 /nfs/dbraw/zinc/30/59/40/633305940.db2.gz LGHCXEPPNSUYGK-UHFFFAOYSA-N -1 3 283.755 2.793 20 10 CFCDHM Cc1cc(Cl)cc(C[N@@H+](CC(=O)[O-])C2CCC2)c1[O-] ZINC000848639768 633305945 /nfs/dbraw/zinc/30/59/45/633305945.db2.gz LGHCXEPPNSUYGK-UHFFFAOYSA-N -1 3 283.755 2.793 20 10 CFCDHM C[C@@H](O)CN(Cc1c([O-])ccc(Cl)c1F)C1CC1 ZINC000848928430 633410843 /nfs/dbraw/zinc/41/08/43/633410843.db2.gz DANUQZCKVAYMDH-MRVPVSSYSA-N -1 3 273.735 2.530 20 10 CFCDHM CC[C@H](N[C@@H]1C[C@@H](C)n2ncnc21)c1ccc(F)cc1[O-] ZINC000850498870 634018862 /nfs/dbraw/zinc/01/88/62/634018862.db2.gz FDXJZWFJWRAUQH-JIMOISOXSA-N -1 3 290.342 2.870 20 10 CFCDHM CCn1cc(CN[C@H](C)c2cc(Cl)ccc2[O-])nn1 ZINC000850522138 634030426 /nfs/dbraw/zinc/03/04/26/634030426.db2.gz DSQUJYYMSYDAPL-SECBINFHSA-N -1 3 280.759 2.508 20 10 CFCDHM Cc1cc([O-])c(CN2CCc3n[nH]cc3C2)c(Cl)c1 ZINC000857876337 636044546 /nfs/dbraw/zinc/04/45/46/636044546.db2.gz DBUHBGSLLDGMEJ-UHFFFAOYSA-N -1 3 277.755 2.635 20 10 CFCDHM CCC1(CC)CN(Cc2cc(F)ccc2[O-])CC[S@@]1=O ZINC000187554860 650258329 /nfs/dbraw/zinc/25/83/29/650258329.db2.gz NXVSSCPEBNZHPM-FQEVSTJZSA-N -1 3 299.411 2.654 20 10 CFCDHM Cc1cc([O-])c(CN2CCO[C@@H](CCF)C2)cc1Cl ZINC000862530155 637409000 /nfs/dbraw/zinc/40/90/00/637409000.db2.gz JOGHXKBXSREAHS-LBPRGKRZSA-N -1 3 287.762 2.914 20 10 CFCDHM C/C=C\C[C@@H]1CCCN(C(=O)c2cccc(O)c2[O-])C1 ZINC000863817378 637788572 /nfs/dbraw/zinc/78/85/72/637788572.db2.gz KPPJJFKGTBMMAZ-ZZKXABKFSA-N -1 3 275.348 2.916 20 10 CFCDHM O=C(NC[C@@H]1CCc2ccccc21)c1cccc(O)c1[O-] ZINC000193062594 650620222 /nfs/dbraw/zinc/62/02/22/650620222.db2.gz CSJRTVSTFNRGHI-LBPRGKRZSA-N -1 3 283.327 2.558 20 10 CFCDHM CC1(CNC(=O)c2cccc(O)c2[O-])Cc2ccccc2C1 ZINC000193151751 650628242 /nfs/dbraw/zinc/62/82/42/650628242.db2.gz QMFNGMWVBRUNBE-UHFFFAOYSA-N -1 3 297.354 2.633 20 10 CFCDHM CC[C@H](NCc1nonc1C)c1cc(Cl)ccc1[O-] ZINC000872135860 641663613 /nfs/dbraw/zinc/66/36/13/641663613.db2.gz IODOYWUYWDFRLV-NSHDSACASA-N -1 3 281.743 2.978 20 10 CFCDHM O=C1[N-]C(=O)C(=Cc2cc(F)cc(Cl)c2)S1 ZINC000874927343 642553132 /nfs/dbraw/zinc/55/31/32/642553132.db2.gz BEYFHQBFAYSHMD-BAQGIRSFSA-N -1 3 257.673 2.803 20 10 CFCDHM CN(Cc1ccc(F)cc1)C(=O)c1cccc(O)c1[O-] ZINC000126280633 643089815 /nfs/dbraw/zinc/08/98/15/643089815.db2.gz BWYFJNNXJMSYNR-UHFFFAOYSA-N -1 3 275.279 2.509 20 10 CFCDHM O=C(Nc1nc(C2CC2)cs1)c1cccc(O)c1[O-] ZINC000126307211 643111977 /nfs/dbraw/zinc/11/19/77/643111977.db2.gz PRBXBXSZIGKTTI-UHFFFAOYSA-N -1 3 276.317 2.684 20 10 CFCDHM Cc1ccc([C@H](C)NC(=O)c2cccc(O)c2[O-])cc1 ZINC000126320025 643117532 /nfs/dbraw/zinc/11/75/32/643117532.db2.gz RKGXBHQSAKWNPY-NSHDSACASA-N -1 3 271.316 2.897 20 10 CFCDHM C[C@@H](NC(=O)c1cccc(O)c1[O-])C1CCCCC1 ZINC000126383415 643187651 /nfs/dbraw/zinc/18/76/51/643187651.db2.gz QEVMWENRBYQDDD-SNVBAGLBSA-N -1 3 263.337 2.796 20 10 CFCDHM C[C@@H](NC(=O)c1cccc(O)c1[O-])c1ccsc1 ZINC000126390546 643190513 /nfs/dbraw/zinc/19/05/13/643190513.db2.gz ILHJGHHMJKKBJE-MRVPVSSYSA-N -1 3 263.318 2.650 20 10 CFCDHM COCC1(C2CC2)CN(Cc2ccc(F)c(F)c2[O-])C1 ZINC000877686508 643455429 /nfs/dbraw/zinc/45/54/29/643455429.db2.gz OVRFPMBQRJCBKU-UHFFFAOYSA-N -1 3 283.318 2.529 20 10 CFCDHM NC(=O)c1ccc(NCc2c([O-])cccc2Cl)cc1 ZINC000127232118 643951837 /nfs/dbraw/zinc/95/18/37/643951837.db2.gz JCKAYUOGZWFMMX-UHFFFAOYSA-N -1 3 276.723 2.757 20 10 CFCDHM C[C@@H]1C[C@H](NCc2cc(F)cc(F)c2[O-])c2nccn21 ZINC000883135899 645620945 /nfs/dbraw/zinc/62/09/45/645620945.db2.gz PLJSQQOMDXILIR-PELKAZGASA-N -1 3 279.290 2.663 20 10 CFCDHM Cc1[nH]nc(NCc2c([O-])cccc2Cl)c1C ZINC000886196427 646915539 /nfs/dbraw/zinc/91/55/39/646915539.db2.gz RYUDITCBKGJBBW-UHFFFAOYSA-N -1 3 251.717 2.998 20 10 CFCDHM COc1ncccc1CN[C@H](C)c1c([O-])cccc1F ZINC000886501425 647021373 /nfs/dbraw/zinc/02/13/73/647021373.db2.gz KATWWCHFNLZZGJ-SNVBAGLBSA-N -1 3 276.311 2.786 20 10 CFCDHM CC(C)c1nnc(CN[C@@H](C)c2c([O-])cccc2F)[nH]1 ZINC000886617270 647069797 /nfs/dbraw/zinc/06/97/97/647069797.db2.gz JCXBAWIEHQJMCS-VIFPVBQESA-N -1 3 278.331 2.624 20 10 CFCDHM C[C@@H](N[C@@H](C)c1c([O-])cccc1F)c1ccn(C)n1 ZINC000886625079 647074426 /nfs/dbraw/zinc/07/44/26/647074426.db2.gz IETOLCHOIOEBRS-ZJUUUORDSA-N -1 3 263.316 2.677 20 10 CFCDHM O=C(c1cccc(O)c1[O-])N1CC[C@@H]1C1CCCC1 ZINC000889404797 647562343 /nfs/dbraw/zinc/56/23/43/647562343.db2.gz BOVZYIFJSKCOEJ-GFCCVEGCSA-N -1 3 261.321 2.503 20 10 CFCDHM Cc1ccc(C(=O)Nc2ccnn2C2CCC2)c([O-])c1O ZINC000890356779 647785016 /nfs/dbraw/zinc/78/50/16/647785016.db2.gz OPQOAFIPAUSJRF-UHFFFAOYSA-N -1 3 287.319 2.580 20 10 CFCDHM O=C(NCc1c([O-])cccc1F)[C@H]1C[C@H]1C1CCCC1 ZINC000928705351 648944889 /nfs/dbraw/zinc/94/48/89/648944889.db2.gz HINNLNRJQIKYCV-RYUDHWBXSA-N -1 3 277.339 2.974 20 10 CFCDHM Cc1noc(C(C)C)c1C(=O)NCc1c([O-])cccc1F ZINC000928707699 648945249 /nfs/dbraw/zinc/94/52/49/648945249.db2.gz AVXPLMVQHCPCDZ-UHFFFAOYSA-N -1 3 292.310 2.881 20 10 CFCDHM CCC[C@@H]1C[C@@H](C(=O)NCc2c([O-])cccc2F)CCO1 ZINC000928709195 648946233 /nfs/dbraw/zinc/94/62/33/648946233.db2.gz YEUNSJMLYVCJTE-NWDGAFQWSA-N -1 3 295.354 2.743 20 10 CFCDHM CCS[C@H](C(=O)NCc1c([O-])cccc1F)C(C)C ZINC000928711826 648946465 /nfs/dbraw/zinc/94/64/65/648946465.db2.gz LLOFYQNJEWHDFO-ZDUSSCGKSA-N -1 3 285.384 2.925 20 10 CFCDHM CC(C)(C)SCC(=O)NCc1c([O-])cccc1F ZINC000928710469 648946667 /nfs/dbraw/zinc/94/66/67/648946667.db2.gz SSEQQPJYQWNEBG-UHFFFAOYSA-N -1 3 271.357 2.679 20 10 CFCDHM O=C([O-])c1ccc(C[N@@H+]2CCC[C@H]3CCC[C@@H]32)c([O-])c1 ZINC001231455914 777223770 /nfs/dbraw/zinc/22/37/70/777223770.db2.gz XLYDYYLCLPKJGF-RISCZKNCSA-N -1 3 275.348 2.855 20 10 CFCDHM O=C([O-])c1ccc(C[N@H+]2CCC[C@H]3CCC[C@@H]32)c([O-])c1 ZINC001231455914 777223779 /nfs/dbraw/zinc/22/37/79/777223779.db2.gz XLYDYYLCLPKJGF-RISCZKNCSA-N -1 3 275.348 2.855 20 10 CFCDHM C[C@@H]1CCC[N@H+](Cc2cc(C(=O)[O-])ccc2[O-])C[C@H]1C ZINC001231560451 777259621 /nfs/dbraw/zinc/25/96/21/777259621.db2.gz INDBXYCCWKFWTI-VXGBXAGGSA-N -1 3 277.364 2.958 20 10 CFCDHM C[C@@H]1CCC[N@@H+](Cc2cc(C(=O)[O-])ccc2[O-])C[C@H]1C ZINC001231560451 777259623 /nfs/dbraw/zinc/25/96/23/777259623.db2.gz INDBXYCCWKFWTI-VXGBXAGGSA-N -1 3 277.364 2.958 20 10 CFCDHM Cc1cc([O-])c(CN2CCCC(=O)C2)cc1Cl ZINC001231870450 777359748 /nfs/dbraw/zinc/35/97/48/777359748.db2.gz BSHRHDRUOCUBPR-UHFFFAOYSA-N -1 3 253.729 2.519 20 10 CFCDHM O=C1CCN(Cc2ccc3ccccc3c2[O-])C[C@H]1F ZINC001231880300 777362916 /nfs/dbraw/zinc/36/29/16/777362916.db2.gz BIAZRGWBPVSNPK-CQSZACIVSA-N -1 3 273.307 2.658 20 10 CFCDHM CN(Cc1ccc(F)c(F)c1[O-])C1CC(F)(F)C1 ZINC001233073857 777788313 /nfs/dbraw/zinc/78/83/13/777788313.db2.gz FWNNRUUYWBYCCR-UHFFFAOYSA-N -1 3 263.234 2.900 20 10 CFCDHM CCCCN1CCN(Cc2ccc(F)c(F)c2[O-])CC1 ZINC001233077363 777788983 /nfs/dbraw/zinc/78/89/83/777788983.db2.gz LERVPZWKSDQWDX-UHFFFAOYSA-N -1 3 284.350 2.588 20 10 CFCDHM CN(CCc1ccccn1)Cc1c([O-])ccc(F)c1F ZINC001233332057 777890799 /nfs/dbraw/zinc/89/07/99/777890799.db2.gz WZFFLVLWXICZPM-UHFFFAOYSA-N -1 3 278.302 2.740 20 10 CFCDHM CN(Cc1c([O-])ccc(F)c1F)C[C@@H]1CCCCO1 ZINC001233334360 777892639 /nfs/dbraw/zinc/89/26/39/777892639.db2.gz CSSPQHMFWNBBRM-JTQLQIEISA-N -1 3 271.307 2.671 20 10 CFCDHM CC(=O)[C@@H]1CCN(Cc2cccc(C(F)(F)F)c2[O-])C1 ZINC001233419130 777942608 /nfs/dbraw/zinc/94/26/08/777942608.db2.gz KNSSYSFSYDSESH-SNVBAGLBSA-N -1 3 287.281 2.822 20 10 CFCDHM C[C@H]1COCCN(Cc2cccc(C(F)(F)F)c2[O-])C1 ZINC001233415942 777942676 /nfs/dbraw/zinc/94/26/76/777942676.db2.gz PFSALFNGVWTLBN-SNVBAGLBSA-N -1 3 289.297 2.879 20 10 CFCDHM COC[C@@H]1CCN1Cc1cccc(C(F)(F)F)c1[O-] ZINC001233419815 777945294 /nfs/dbraw/zinc/94/52/94/777945294.db2.gz NMKUTVZGCSAIJX-JTQLQIEISA-N -1 3 275.270 2.632 20 10 CFCDHM C[C@@H]1CN(Cc2ccc(C(F)(F)F)cc2[O-])CCC1=O ZINC001233452222 777957798 /nfs/dbraw/zinc/95/77/98/777957798.db2.gz OJESNSCLJQSTBC-SECBINFHSA-N -1 3 287.281 2.822 20 10 CFCDHM [O-]c1cc(F)c(F)cc1CN1CC2(C1)C[C@H](F)CS2 ZINC001142527266 778401800 /nfs/dbraw/zinc/40/18/00/778401800.db2.gz QTPLRBODIGXPEK-VIFPVBQESA-N -1 3 289.322 2.700 20 10 CFCDHM [O-]c1cc(Cl)c(Cl)cc1CN1CC[C@H](F)[C@H](O)C1 ZINC001236792172 778939117 /nfs/dbraw/zinc/93/91/17/778939117.db2.gz CPEJWOSZIKVOCZ-CMPLNLGQSA-N -1 3 294.153 2.604 20 10 CFCDHM [O-]c1cc(Cl)c(Cl)cc1CN1CC[C@H](CO)C1 ZINC001236796470 778941713 /nfs/dbraw/zinc/94/17/13/778941713.db2.gz PJLHJEUUZVXKNN-QMMMGPOBSA-N -1 3 276.163 2.513 20 10 CFCDHM COc1cc([O-])c(CN2C[C@H](F)C[C@H]2C)c(Cl)c1 ZINC001236798068 778942009 /nfs/dbraw/zinc/94/20/09/778942009.db2.gz KWWUHDCSABNMRN-RKDXNWHRSA-N -1 3 273.735 2.987 20 10 CFCDHM COc1cc([O-])c(CN2CCCC[C@@H]2C(C)=O)c(Cl)c1 ZINC001236807917 778947074 /nfs/dbraw/zinc/94/70/74/778947074.db2.gz LALARRSMJJWOJX-CQSZACIVSA-N -1 3 297.782 2.998 20 10 CFCDHM COc1cc([O-])c(CN2CCO[C@H](C(C)C)C2)c(Cl)c1 ZINC001236808601 778949559 /nfs/dbraw/zinc/94/95/59/778949559.db2.gz PDEUWAPDHPHDND-HNNXBMFYSA-N -1 3 299.798 2.911 20 10 CFCDHM [O-]c1cc2ccccc2cc1CN(CCO)CC(F)(F)F ZINC001236836597 778960324 /nfs/dbraw/zinc/96/03/24/778960324.db2.gz LGOLYSWBYMQWPH-UHFFFAOYSA-N -1 3 299.292 2.902 20 10 CFCDHM [O-]c1ccc(Cl)c(Cl)c1CN1CC[C@@H](F)[C@@H](O)C1 ZINC001237078848 779003726 /nfs/dbraw/zinc/00/37/26/779003726.db2.gz YNZNHPVSZZCFFJ-KOLCDFICSA-N -1 3 294.153 2.604 20 10 CFCDHM C[C@@H]1CCN(Cc2c([O-])ccc(Cl)c2Cl)C[C@@H]1O ZINC001237078694 779007799 /nfs/dbraw/zinc/00/77/99/779007799.db2.gz WJZKXPWEZVZZHA-PELKAZGASA-N -1 3 290.190 2.902 20 10 CFCDHM C[C@H]1CN(Cc2cc(F)ccc2[O-])C[C@](C)(C(F)F)O1 ZINC000698929141 779102581 /nfs/dbraw/zinc/10/25/81/779102581.db2.gz PAFYMRWDOPWBNC-LKFCYVNXSA-N -1 3 289.297 2.776 20 10 CFCDHM C[C@H]1CN(Cc2cc(Cl)cc(F)c2[O-])CC[C@@]1(C)O ZINC001237617652 779144372 /nfs/dbraw/zinc/14/43/72/779144372.db2.gz UDUYFNFCMJPVQD-LKFCYVNXSA-N -1 3 287.762 2.778 20 10 CFCDHM [O-]c1c(F)cc(Cl)cc1CN1CCC[C@@]12CCOC2 ZINC001237622123 779145445 /nfs/dbraw/zinc/14/54/45/779145445.db2.gz NCYVSIQFQYQWCU-AWEZNQCLSA-N -1 3 285.746 2.940 20 10 CFCDHM CCO[C@@H]1CCN(Cc2cc(Cl)cc(F)c2[O-])C1 ZINC001237623671 779146968 /nfs/dbraw/zinc/14/69/68/779146968.db2.gz SMXHUMQGEGBVCL-LLVKDONJSA-N -1 3 273.735 2.796 20 10 CFCDHM Cc1cc([O-])c(CN2CCCO2)cc1Br ZINC001237677875 779158829 /nfs/dbraw/zinc/15/88/29/779158829.db2.gz QWZKQMSDDHHINM-UHFFFAOYSA-N -1 3 272.142 2.600 20 10 CFCDHM [O-]c1c(Cl)cc(F)cc1CN1CCC[C@@]12CCOC2 ZINC001237805996 779182713 /nfs/dbraw/zinc/18/27/13/779182713.db2.gz QDNORORLHQTNBU-AWEZNQCLSA-N -1 3 285.746 2.940 20 10 CFCDHM C[C@@H]1CN(Cc2cc(F)c(Cl)cc2[O-])CCCO1 ZINC001237935814 779211309 /nfs/dbraw/zinc/21/13/09/779211309.db2.gz ZJRNHSOIIRVNNK-SECBINFHSA-N -1 3 273.735 2.796 20 10 CFCDHM CO[C@H]1CCCN(Cc2cc(F)c(Cl)cc2[O-])C1 ZINC001237946342 779215179 /nfs/dbraw/zinc/21/51/79/779215179.db2.gz JAJZWDUQAJQWSZ-JTQLQIEISA-N -1 3 273.735 2.796 20 10 CFCDHM CCO[C@H]1CCN(Cc2cc(Cl)cc(C(C)=O)c2[O-])C1 ZINC000701709052 780824762 /nfs/dbraw/zinc/82/47/62/780824762.db2.gz OCUCJAWBFVSMRM-ZDUSSCGKSA-N -1 3 297.782 2.859 20 10 CFCDHM CC[C@H]1CN(Cc2ccc(F)c(F)c2[O-])CCCO1 ZINC000703539395 781026526 /nfs/dbraw/zinc/02/65/26/781026526.db2.gz AWUFEOMNRIQLHK-NSHDSACASA-N -1 3 271.307 2.671 20 10 CFCDHM CN(Cc1ccc2c(c1)OCO2)Cc1c([O-])cccc1F ZINC001137838462 781151497 /nfs/dbraw/zinc/15/14/97/781151497.db2.gz APOPSYRCGAEKMR-UHFFFAOYSA-N -1 3 289.306 2.892 20 10 CFCDHM CCC(C)(C)[C@@H](C)NC(=O)c1cccc(O)c1[O-] ZINC000709972553 781324404 /nfs/dbraw/zinc/32/44/04/781324404.db2.gz STOIEMYCVYSDIC-SECBINFHSA-N -1 3 251.326 2.652 20 10 CFCDHM [O-]c1c(Cl)cc(Cl)cc1CN1CC[C@@H](CO)C1 ZINC000092763977 347645533 /nfs/dbraw/zinc/64/55/33/347645533.db2.gz QLQVWPVVYUNNHF-MRVPVSSYSA-N -1 3 276.163 2.513 20 10 CFCDHM C[C@@H](N[C@H](C)c1ccc(F)c(F)c1[O-])c1cn[nH]c1 ZINC000276908149 296158717 /nfs/dbraw/zinc/15/87/17/296158717.db2.gz KGJCCSXYFNNTPC-HTQZYQBOSA-N -1 3 267.279 2.805 20 10 CFCDHM [O-]c1ccc(Cl)cc1CN1CCOC[C@H]1C1CC1 ZINC000093645479 375285512 /nfs/dbraw/zinc/28/55/12/375285512.db2.gz MVGACAJKCYGKNP-ZDUSSCGKSA-N -1 3 267.756 2.656 20 10 CFCDHM CC[C@H]1CCCN(C(=O)c2cccc(O)c2[O-])CC1 ZINC000126434556 377228361 /nfs/dbraw/zinc/22/83/61/377228361.db2.gz UCYIOCOLCUHWCP-NSHDSACASA-N -1 3 263.337 2.750 20 10 CFCDHM CC[C@@H](C)CN(CC)C(=O)c1cccc(O)c1[O-] ZINC000126476163 377231168 /nfs/dbraw/zinc/23/11/68/377231168.db2.gz PMGSAMWTJXCZOB-SNVBAGLBSA-N -1 3 251.326 2.606 20 10 CFCDHM [O-]c1cccc(Cl)c1CN1CC[C@@](O)(C(F)(F)F)C1 ZINC000130168443 377519191 /nfs/dbraw/zinc/51/91/91/377519191.db2.gz MHKQDQSWEMKJTM-NSHDSACASA-N -1 3 295.688 2.545 20 10 CFCDHM C[C@H](O)C1CCN(Cc2c([O-])cccc2Cl)CC1 ZINC000130415660 377554548 /nfs/dbraw/zinc/55/45/48/377554548.db2.gz NFMJMBNYBSYJGJ-JTQLQIEISA-N -1 3 269.772 2.638 20 10 CFCDHM [O-]c1c(Cl)cccc1CN1CC[C@@](O)(C(F)(F)F)C1 ZINC000180406235 380652651 /nfs/dbraw/zinc/65/26/51/380652651.db2.gz YIWMQSMVVNQANC-NSHDSACASA-N -1 3 295.688 2.545 20 10 CFCDHM CC[C@@H](NCc1cc(C)nn1C)c1ccc(F)cc1[O-] ZINC000287591180 380877057 /nfs/dbraw/zinc/87/70/57/380877057.db2.gz ROIQYINPCMFVSY-CQSZACIVSA-N -1 3 277.343 2.814 20 10 CFCDHM CC[C@@H](N[C@H](C)c1nncn1C)c1cccc(Cl)c1[O-] ZINC000287789026 380940089 /nfs/dbraw/zinc/94/00/89/380940089.db2.gz SRHFQZKOFHDSEQ-BXKDBHETSA-N -1 3 294.786 2.976 20 10 CFCDHM Cc1ccc(C(=O)N2CCC[C@@H](C)[C@@H]2C)c([O-])c1O ZINC000182499747 381100709 /nfs/dbraw/zinc/10/07/09/381100709.db2.gz MZOZSMHCPARLRG-KOLCDFICSA-N -1 3 263.337 2.667 20 10 CFCDHM CC[C@H](CSC)N(C)C(=O)c1ccc(C)c(O)c1[O-] ZINC000182983943 381193541 /nfs/dbraw/zinc/19/35/41/381193541.db2.gz AFJDKZGADFIZAL-SNVBAGLBSA-N -1 3 283.393 2.620 20 10 CFCDHM C[C@H](NCc1cnn(C)c1)c1cc(Cl)ccc1[O-] ZINC000185112979 381538856 /nfs/dbraw/zinc/53/88/56/381538856.db2.gz FMLYXIZZPBRXAI-VIFPVBQESA-N -1 3 265.744 2.630 20 10 CFCDHM C[C@@H](N[C@@H]1c2ccccc2C[C@@H]1O)c1ccc(F)cc1[O-] ZINC000185122249 381541453 /nfs/dbraw/zinc/54/14/53/381541453.db2.gz MLUSSKOYHZEIFV-GPNNCHTKSA-N -1 3 287.334 2.840 20 10 CFCDHM O=C(c1cccc(O)c1[O-])N1CC[C@@H](Cc2ccccc2)C1 ZINC000185726219 381715657 /nfs/dbraw/zinc/71/56/57/381715657.db2.gz OZSRCXKFGWUIKY-AWEZNQCLSA-N -1 3 297.354 2.803 20 10 CFCDHM Cc1nc(CNCc2ccccc2[O-])c2n1CCCC2 ZINC000373143592 381937986 /nfs/dbraw/zinc/93/79/86/381937986.db2.gz XLEIAWFAMQYQHU-UHFFFAOYSA-N -1 3 271.364 2.523 20 10 CFCDHM [O-]c1ccc(Cl)c(F)c1CN1CC[C@](O)(C2CC2)C1 ZINC000373315223 381978595 /nfs/dbraw/zinc/97/85/95/381978595.db2.gz CKMKBCXWHFURMY-CQSZACIVSA-N -1 3 285.746 2.532 20 10 CFCDHM CN(CCF)Cc1cc(Br)ccc1[O-] ZINC000293695318 382236409 /nfs/dbraw/zinc/23/64/09/382236409.db2.gz RAQXKLXBQUOYAQ-UHFFFAOYSA-N -1 3 262.122 2.556 20 10 CFCDHM [O-]c1c(Cl)cccc1CN[C@@H](CCO)c1ccco1 ZINC000187528774 382203224 /nfs/dbraw/zinc/20/32/24/382203224.db2.gz GWBBKQQQGZDFFW-LBPRGKRZSA-N -1 3 281.739 2.852 20 10 CFCDHM [O-]c1ccc(Cl)cc1CN1CCO[C@H](C2CC2)C1 ZINC000364514650 382322762 /nfs/dbraw/zinc/32/27/62/382322762.db2.gz YTPCZMAIPYFYJP-AWEZNQCLSA-N -1 3 267.756 2.656 20 10 CFCDHM [O-]c1ccc(F)cc1CN1C[C@]2(CCCO2)[C@@H]1C1CC1 ZINC000293834266 382297880 /nfs/dbraw/zinc/29/78/80/382297880.db2.gz ATOYIUZVQQTRAT-JKSUJKDBSA-N -1 3 277.339 2.675 20 10 CFCDHM O=S(=O)(CCCCF)Nc1ccc([O-])c(Cl)c1 ZINC000294081494 382408382 /nfs/dbraw/zinc/40/83/82/382408382.db2.gz AFVQECONIRJFRY-UHFFFAOYSA-N -1 3 281.736 2.537 20 10 CFCDHM COC(=O)[C@@H]1CN(Cc2cccc(Cl)c2[O-])CC1(C)C ZINC000378443372 382460655 /nfs/dbraw/zinc/46/06/55/382460655.db2.gz MVVFPURIKKIZEP-NSHDSACASA-N -1 3 297.782 2.677 20 10 CFCDHM Cn1ccnc1[C@@H]1N(Cc2ccccc2[O-])CC1(C)C ZINC000294907267 382543582 /nfs/dbraw/zinc/54/35/82/382543582.db2.gz XTVYEDTVKIOGQC-AWEZNQCLSA-N -1 3 271.364 2.709 20 10 CFCDHM CN(Cc1cc(Cl)c(F)cc1[O-])C[C@H]1CCCO1 ZINC000295000619 382560111 /nfs/dbraw/zinc/56/01/11/382560111.db2.gz UUTGSEKHBRHTSF-SNVBAGLBSA-N -1 3 273.735 2.796 20 10 CFCDHM CO[C@H]1CCCN(Cc2cc(Cl)c(F)cc2[O-])C1 ZINC000295295843 382609762 /nfs/dbraw/zinc/60/97/62/382609762.db2.gz JMDZQGPVYXSUEU-JTQLQIEISA-N -1 3 273.735 2.796 20 10 CFCDHM CO[C@@H]1CCN(Cc2cc(F)cc(C(C)=O)c2[O-])[C@H](C)C1 ZINC000281667373 385200528 /nfs/dbraw/zinc/20/05/28/385200528.db2.gz LGLHGDPSIDKNOM-QMTHXVAHSA-N -1 3 295.354 2.733 20 10 CFCDHM CCCCN(Cc1nc(C)no1)Cc1ccccc1[O-] ZINC000282566066 385343181 /nfs/dbraw/zinc/34/31/81/385343181.db2.gz ZAMUXGKZBIOTJG-UHFFFAOYSA-N -1 3 275.352 2.886 20 10 CFCDHM [O-]c1c(Cl)cccc1CN[C@@H]1CCCc2c[nH]nc21 ZINC000271781970 385392242 /nfs/dbraw/zinc/39/22/42/385392242.db2.gz DWYWGVGRDCBPAU-GFCCVEGCSA-N -1 3 277.755 2.936 20 10 CFCDHM COC(=O)c1ccc([O-])c([C@@H](C)NCc2ccco2)c1 ZINC000273406723 385681227 /nfs/dbraw/zinc/68/12/27/385681227.db2.gz ONQRUJVISHQADF-SNVBAGLBSA-N -1 3 275.304 2.623 20 10 CFCDHM CCn1cc(CN[C@H](C)c2ccc(F)cc2[O-])cn1 ZINC000273499730 385685763 /nfs/dbraw/zinc/68/57/63/385685763.db2.gz PVGSLRGHZQWMCU-SNVBAGLBSA-N -1 3 263.316 2.599 20 10 CFCDHM CCNC(=O)[C@@H](C)N[C@H](CC)c1cccc(Cl)c1[O-] ZINC000286867614 385727962 /nfs/dbraw/zinc/72/79/62/385727962.db2.gz HANSEDNNMJCJIE-BXKDBHETSA-N -1 3 284.787 2.611 20 10 CFCDHM CN(C(=O)/C=C/c1cncc([O-])c1)c1ccc(F)cc1 ZINC000181904172 393503814 /nfs/dbraw/zinc/50/38/14/393503814.db2.gz BTODOGSZBSFXQA-FARCUNLSSA-N -1 3 272.279 2.603 20 10 CFCDHM C[C@@H]1CCCC[C@H]1NC(=O)CN(C)Cc1ccccc1[O-] ZINC000109770310 393879827 /nfs/dbraw/zinc/87/98/27/393879827.db2.gz JWVNDAHBBGERQC-UKRRQHHQSA-N -1 3 290.407 2.519 20 10 CFCDHM CC[C@@H](NC1CN(C(=O)OC)C1)c1cccc(Cl)c1[O-] ZINC000287783608 394210059 /nfs/dbraw/zinc/21/00/59/394210059.db2.gz SHQDYUMVWQPMFN-GFCCVEGCSA-N -1 3 298.770 2.537 20 10 CFCDHM Cn1ccc(/C=C\C(=O)N2CCCc3cccc([O-])c32)c1 ZINC000493392863 394230146 /nfs/dbraw/zinc/23/01/46/394230146.db2.gz SPYRJSYFICNVKF-FPLPWBNLSA-N -1 3 282.343 2.723 20 10 CFCDHM CC(C)c1nc(CN[C@@H](C)c2ccc(F)c(F)c2[O-])n[nH]1 ZINC000296464393 394309408 /nfs/dbraw/zinc/30/94/08/394309408.db2.gz NLISVWYDUDVKSJ-QMMMGPOBSA-N -1 3 296.321 2.763 20 10 CFCDHM Cc1ccc(C(=O)N2CC[C@H](CC(C)C)C2)c([O-])c1O ZINC000179530855 292063782 /nfs/dbraw/zinc/06/37/82/292063782.db2.gz FZUMCVHRJGVAKF-GFCCVEGCSA-N -1 3 277.364 2.914 20 10 CFCDHM Cc1cc(S(=O)(=O)[N-]c2ccc(O)cc2)ccc1F ZINC000005234377 170077940 /nfs/dbraw/zinc/07/79/40/170077940.db2.gz WVWICQONQMZYBX-UHFFFAOYSA-N -1 3 281.308 2.641 20 10 CFCDHM CC(=O)c1cc(F)cc(CN2CCCCC2)c1[O-] ZINC000037322704 173123413 /nfs/dbraw/zinc/12/34/13/173123413.db2.gz CMKYUMLWNAOPAY-UHFFFAOYSA-N -1 3 251.301 2.720 20 10 CFCDHM [O-]c1ccc(F)cc1CN1C[C@H](CO)Cc2ccccc21 ZINC000367795650 267118097 /nfs/dbraw/zinc/11/80/97/267118097.db2.gz HPAVQDYHCABAPP-GFCCVEGCSA-N -1 3 287.334 2.703 20 10 CFCDHM Cc1ccc(C(=O)N2CC[C@H](c3ccco3)C2)c([O-])c1O ZINC000367879376 267124239 /nfs/dbraw/zinc/12/42/39/267124239.db2.gz PIRIIYRNOCRGEL-NSHDSACASA-N -1 3 287.315 2.629 20 10 CFCDHM Cc1ccc(C(=O)N2CC3(CCC3)C[C@@H]2C)c([O-])c1O ZINC000370632343 267332456 /nfs/dbraw/zinc/33/24/56/267332456.db2.gz ZPPPUMOOIZTHND-NSHDSACASA-N -1 3 275.348 2.811 20 10 CFCDHM C[C@@H]1CCN(C(=O)C=Cc2c[nH]cn2)c2c([O-])cccc21 ZINC000283228937 274297536 /nfs/dbraw/zinc/29/75/36/274297536.db2.gz STLWQUCOWFMYRS-MVIFTORASA-N -1 3 283.331 2.669 20 10 CFCDHM C[C@@H]1CN(C(=O)c2cccc(O)c2[O-])[C@@H]1c1ccccc1 ZINC000187148246 288045701 /nfs/dbraw/zinc/04/57/01/288045701.db2.gz YUOHVNFKBPRYSY-ABAIWWIYSA-N -1 3 283.327 2.931 20 10 CFCDHM Cc1ccc(C(=O)N2CCC23CCCCC3)c([O-])c1O ZINC000364615651 301497104 /nfs/dbraw/zinc/49/71/04/301497104.db2.gz FWYSETIDQZSJCY-UHFFFAOYSA-N -1 3 275.348 2.955 20 10 CFCDHM CCn1nncc1CN[C@H](C)c1ccc(Cl)cc1[O-] ZINC000527911595 330290820 /nfs/dbraw/zinc/29/08/20/330290820.db2.gz BBVQSHLVFGKVNZ-SECBINFHSA-N -1 3 280.759 2.508 20 10 CFCDHM CCN(C(=O)/C=C/c1cncc([O-])c1)c1ccccc1OC ZINC000492403864 332395819 /nfs/dbraw/zinc/39/58/19/332395819.db2.gz ZYLHVFOSJSKRLJ-CMDGGOBGSA-N -1 3 298.342 2.862 20 10 CFCDHM CCN(C(=O)/C=C\c1cncc([O-])c1)c1cccc(OC)c1 ZINC000492433811 332397246 /nfs/dbraw/zinc/39/72/46/332397246.db2.gz CJWVAFHIYPOXSP-FPLPWBNLSA-N -1 3 298.342 2.862 20 10 CFCDHM O=C(NCC[C@H]1CC=CCC1)c1cccc(O)c1[O-] ZINC000529868306 333512390 /nfs/dbraw/zinc/51/23/90/333512390.db2.gz QCCRRVZBVPUCDG-NSHDSACASA-N -1 3 261.321 2.574 20 10 CFCDHM CC(=O)c1cc(Cl)cc(CN2CCCC[C@@H]2CO)c1[O-] ZINC000050152221 518279894 /nfs/dbraw/zinc/27/98/94/518279894.db2.gz SAEHNOHGQBCPNJ-CYBMUJFWSA-N -1 3 297.782 2.595 20 10 CFCDHM COc1cc(Cl)cc(CNCc2snnc2C)c1[O-] ZINC000292852205 522541971 /nfs/dbraw/zinc/54/19/71/522541971.db2.gz UGGFEFFHCCLGIC-UHFFFAOYSA-N -1 3 299.783 2.504 20 10 CFCDHM CN(C)C(=O)[C@@H](c1ccccc1)N(C)Cc1ccccc1[O-] ZINC000171937026 524010309 /nfs/dbraw/zinc/01/03/09/524010309.db2.gz SLVDYXFDTWRPED-QGZVFWFLSA-N -1 3 298.386 2.654 20 10 CFCDHM COCCOc1ccc(NCc2cc(F)ccc2[O-])cn1 ZINC000226617328 524050253 /nfs/dbraw/zinc/05/02/53/524050253.db2.gz PKENRWOWQVWSEX-UHFFFAOYSA-N -1 3 292.310 2.564 20 10 CFCDHM CSCCCCCCNC(=O)c1cccc(O)c1[O-] ZINC000193160187 525414503 /nfs/dbraw/zinc/41/45/03/525414503.db2.gz BCVUVMAJCRZSNR-UHFFFAOYSA-N -1 3 283.393 2.751 20 10 CFCDHM C[C@@H](N[C@H](C)c1cc(Cl)ccc1[O-])c1ncn(C)n1 ZINC000275810447 525657159 /nfs/dbraw/zinc/65/71/59/525657159.db2.gz ZLOJHAMKOCXWOS-RKDXNWHRSA-N -1 3 280.759 2.586 20 10 CFCDHM [O-]c1cc2c(cc1CN[C@H](C1CC1)C(F)(F)F)OCO2 ZINC000288394170 526336905 /nfs/dbraw/zinc/33/69/05/526336905.db2.gz HIXKEBVQTDECME-GFCCVEGCSA-N -1 3 289.253 2.551 20 10 CFCDHM [O-]c1ccc(F)cc1CNCc1noc2c1CCCC2 ZINC000290071053 526350913 /nfs/dbraw/zinc/35/09/13/526350913.db2.gz FWCXDDUVJVJMFX-UHFFFAOYSA-N -1 3 276.311 2.688 20 10 CFCDHM Cc1nnsc1CN[C@H](C)c1cc(F)ccc1[O-] ZINC000293351925 526448542 /nfs/dbraw/zinc/44/85/42/526448542.db2.gz GZJHUGMEAYJBDR-SSDOTTSWSA-N -1 3 267.329 2.542 20 10 CFCDHM O=C(c1cccc(O)c1[O-])N1CC[C@@H](CC(F)(F)F)C1 ZINC000277610627 526771622 /nfs/dbraw/zinc/77/16/22/526771622.db2.gz PVXTVCXFFPVFOE-QMMMGPOBSA-N -1 3 289.253 2.512 20 10 CFCDHM O=C(c1cc([O-])cs1)N1CCC(c2ccccn2)CC1 ZINC000754490496 574097926 /nfs/dbraw/zinc/09/79/26/574097926.db2.gz KQXHUQWKOZSRJI-UHFFFAOYSA-N -1 3 288.372 2.869 20 10 CFCDHM CN(C)c1ccc(CN(C)C(=O)c2cc([O-])cs2)cc1 ZINC000731864574 574130743 /nfs/dbraw/zinc/13/07/43/574130743.db2.gz XKLMQVQFNJDASP-UHFFFAOYSA-N -1 3 290.388 2.792 20 10 CFCDHM COCc1ccc(CNC(=O)c2cc([O-])cs2)cc1 ZINC000731869628 574131329 /nfs/dbraw/zinc/13/13/29/574131329.db2.gz UMAOWWCVZHHULQ-UHFFFAOYSA-N -1 3 277.345 2.530 20 10 CFCDHM C[C@H](CNC(=O)c1cc([O-])cs1)N(C)c1ccccc1 ZINC000731869377 574132573 /nfs/dbraw/zinc/13/25/73/574132573.db2.gz GGVHMMZDYRGITP-LLVKDONJSA-N -1 3 290.388 2.708 20 10 CFCDHM Cn1c2ccccc2sc1=NC(=O)c1cc([O-])cs1 ZINC000731868423 574132789 /nfs/dbraw/zinc/13/27/89/574132789.db2.gz YMSSQSCNAGXXJO-UHFFFAOYSA-N -1 3 290.369 2.748 20 10 CFCDHM O=C(c1cc([O-])cs1)N1CCC[C@@H]1c1cccnc1 ZINC000732267106 574148277 /nfs/dbraw/zinc/14/82/77/574148277.db2.gz CARPDXJNCGUFOZ-GFCCVEGCSA-N -1 3 274.345 2.826 20 10 CFCDHM CN(C)Cc1cccc(NC(=O)c2cc([O-])cs2)c1 ZINC000732271711 574148791 /nfs/dbraw/zinc/14/87/91/574148791.db2.gz PJGRFNKQDAHAGD-UHFFFAOYSA-N -1 3 276.361 2.768 20 10 CFCDHM COc1cc(CNC(=O)c2cc([O-])cs2)ccc1C ZINC000732276897 574149547 /nfs/dbraw/zinc/14/95/47/574149547.db2.gz VTNRMMMXILVMAW-UHFFFAOYSA-N -1 3 277.345 2.701 20 10 CFCDHM CCN(Cc1ccoc1)C(=O)c1cc([O-])cs1 ZINC000732282594 574149968 /nfs/dbraw/zinc/14/99/68/574149968.db2.gz QYFZTYQMDFGYIN-UHFFFAOYSA-N -1 3 251.307 2.709 20 10 CFCDHM CN(CCN(C)c1ccccc1)C(=O)c1cc([O-])cs1 ZINC000732289455 574150470 /nfs/dbraw/zinc/15/04/70/574150470.db2.gz GZCIIRYTWNUOJQ-UHFFFAOYSA-N -1 3 290.388 2.662 20 10 CFCDHM CN(CCc1ccccc1F)C(=O)c1cc([O-])cs1 ZINC000732291047 574150633 /nfs/dbraw/zinc/15/06/33/574150633.db2.gz NUZJZVNXJSZIPU-UHFFFAOYSA-N -1 3 279.336 2.908 20 10 CFCDHM COc1ccccc1C(=O)COC(=O)c1cc([O-])cs1 ZINC000732352800 574152857 /nfs/dbraw/zinc/15/28/57/574152857.db2.gz HIONESKXOGUQJJ-UHFFFAOYSA-N -1 3 292.312 2.502 20 10 CFCDHM O=C(N[C@@H]1[C@@H]2CCO[C@@H]2C12CCCC2)c1cc([O-])cs1 ZINC000755297406 574153023 /nfs/dbraw/zinc/15/30/23/574153023.db2.gz SJEVQKPOGJBFIP-UHTWSYAYSA-N -1 3 293.388 2.531 20 10 CFCDHM COC(=O)[C@@H](OC(=O)c1cc([O-])cs1)c1ccccc1 ZINC000732354876 574153148 /nfs/dbraw/zinc/15/31/48/574153148.db2.gz VFMKYBSHYMDLQX-LBPRGKRZSA-N -1 3 292.312 2.525 20 10 CFCDHM COc1ccc(C(=O)COC(=O)c2cc([O-])cs2)cc1 ZINC000732354668 574153266 /nfs/dbraw/zinc/15/32/66/574153266.db2.gz PYJQDKPGHLDUGZ-UHFFFAOYSA-N -1 3 292.312 2.502 20 10 CFCDHM Cc1cc(CN(C)Cc2ccccc2O)oc1C(=O)[O-] ZINC000738382965 574166546 /nfs/dbraw/zinc/16/65/46/574166546.db2.gz RCPDADNOZDEFKG-UHFFFAOYSA-N -1 3 275.304 2.624 20 10 CFCDHM O=C(NCCc1cccc(F)c1F)c1cc([O-])cs1 ZINC000732833904 574175094 /nfs/dbraw/zinc/17/50/94/574175094.db2.gz IJHPFGQEZGFKFQ-UHFFFAOYSA-N -1 3 283.299 2.704 20 10 CFCDHM CCc1ncsc1NC(=O)c1cc([O-])cs1 ZINC000747617583 574203210 /nfs/dbraw/zinc/20/32/10/574203210.db2.gz QZKFIZLZGGCUOD-UHFFFAOYSA-N -1 3 254.336 2.725 20 10 CFCDHM O=C([O-])c1cccc(CNCc2ccc3c(c2)CCO3)c1 ZINC000756303504 574223514 /nfs/dbraw/zinc/22/35/14/574223514.db2.gz WIHVWXVOTMMGEI-UHFFFAOYSA-N -1 3 283.327 2.610 20 10 CFCDHM COc1ccc(CN[C@H](CNC(=O)[O-])CC(C)C)cc1C ZINC000739903918 574228310 /nfs/dbraw/zinc/22/83/10/574228310.db2.gz RYNZCCWJTBQROZ-AWEZNQCLSA-N -1 3 294.395 2.776 20 10 CFCDHM Cc1noc([C@@H](C)NCc2cc(Cl)ccc2[O-])n1 ZINC000729683872 574228793 /nfs/dbraw/zinc/22/87/93/574228793.db2.gz DWHUUFYQWIVVQS-SSDOTTSWSA-N -1 3 267.716 2.588 20 10 CFCDHM COc1ncccc1CN[C@@H](C)c1cc(F)cc(F)c1[O-] ZINC000756392707 574233169 /nfs/dbraw/zinc/23/31/69/574233169.db2.gz IYYZZQXWDYYTGT-VIFPVBQESA-N -1 3 294.301 2.925 20 10 CFCDHM C[C@@H](NCc1cscn1)c1cc(F)cc(F)c1[O-] ZINC000756507815 574242108 /nfs/dbraw/zinc/24/21/08/574242108.db2.gz FWOOWACNLCEOMO-SSDOTTSWSA-N -1 3 270.304 2.978 20 10 CFCDHM C[C@@H](N[C@H]1C[C@@H](C)c2c1c([O-])ccc2F)c1nncn1C ZINC000756534389 574244217 /nfs/dbraw/zinc/24/42/17/574244217.db2.gz KRYHJNSUNNBMJT-KKZNHRDASA-N -1 3 290.342 2.559 20 10 CFCDHM Cc1ncsc1CN[C@H](C)c1cc([N+](=O)[O-])ccc1[O-] ZINC000756547663 574245931 /nfs/dbraw/zinc/24/59/31/574245931.db2.gz FSKZHDBFZVDLQA-MRVPVSSYSA-N -1 3 293.348 2.916 20 10 CFCDHM C[C@@H](NCc1cc[nH]n1)c1cc(Br)ccc1[O-] ZINC000756557248 574247096 /nfs/dbraw/zinc/24/70/96/574247096.db2.gz RRFAFFAVXGHGIF-MRVPVSSYSA-N -1 3 296.168 2.729 20 10 CFCDHM CCc1cc(CN[C@H](C)c2cc(F)cc(F)c2[O-])n[nH]1 ZINC000756575522 574249286 /nfs/dbraw/zinc/24/92/86/574249286.db2.gz VHOJZXOMCZCPGM-MRVPVSSYSA-N -1 3 281.306 2.807 20 10 CFCDHM CCc1cc(CN[C@H](C)c2cc(F)cc(F)c2[O-])[nH]n1 ZINC000756575522 574249288 /nfs/dbraw/zinc/24/92/88/574249288.db2.gz VHOJZXOMCZCPGM-MRVPVSSYSA-N -1 3 281.306 2.807 20 10 CFCDHM C[C@H](NCc1csc(N(C)C)n1)c1ccc(F)cc1[O-] ZINC000756635637 574253782 /nfs/dbraw/zinc/25/37/82/574253782.db2.gz GIOIHJADIIMDQW-VIFPVBQESA-N -1 3 295.383 2.905 20 10 CFCDHM Cc1ccc(C(=O)N[C@@H]2CC[C@@H](C)[C@H](C)C2)c([O-])c1O ZINC000756637933 574254500 /nfs/dbraw/zinc/25/45/00/574254500.db2.gz MJOSIVBUCINWJX-YUSALJHKSA-N -1 3 277.364 2.961 20 10 CFCDHM C[C@H](NCC(=O)NC1CCCC1)c1cc(Cl)ccc1[O-] ZINC000756705561 574258300 /nfs/dbraw/zinc/25/83/00/574258300.db2.gz LDCNTFLYCKHJPF-JTQLQIEISA-N -1 3 296.798 2.755 20 10 CFCDHM C[C@@H](N[C@@H](C)c1cc(F)cc(F)c1[O-])c1cn[nH]c1 ZINC000756776456 574261658 /nfs/dbraw/zinc/26/16/58/574261658.db2.gz PIUSIQZJLSOFHR-SFYZADRCSA-N -1 3 267.279 2.805 20 10 CFCDHM C[C@@H](NCc1cocn1)c1cc(Cl)ccc1[O-] ZINC000756831002 574266144 /nfs/dbraw/zinc/26/61/44/574266144.db2.gz KURQTQZDAPHSFL-MRVPVSSYSA-N -1 3 252.701 2.884 20 10 CFCDHM COC(=O)c1ccc(CNCc2cc(Cl)ccc2[O-])o1 ZINC000734159816 574277507 /nfs/dbraw/zinc/27/75/07/574277507.db2.gz JCXCGXKAJUXFCF-UHFFFAOYSA-N -1 3 295.722 2.715 20 10 CFCDHM C[S@](=O)Cc1cccc(NC(=O)c2cc([O-])cs2)c1 ZINC000734555411 574292915 /nfs/dbraw/zinc/29/29/15/574292915.db2.gz RVODPHMXEYYQDF-IBGZPJMESA-N -1 3 295.385 2.585 20 10 CFCDHM O=C(NCC1Cc2ccccc2C1)c1cc([O-])cs1 ZINC000735327301 574320912 /nfs/dbraw/zinc/32/09/12/574320912.db2.gz YOLTUEGCLFBKOE-UHFFFAOYSA-N -1 3 273.357 2.599 20 10 CFCDHM O=c1[n-]c(Sc2nccs2)nc2ccccc12 ZINC000750531910 574346178 /nfs/dbraw/zinc/34/61/78/574346178.db2.gz SPLMMTHYXLTJSU-UHFFFAOYSA-N -1 3 261.331 2.943 20 10 CFCDHM O=C(Nc1ccc2c(c1)NC(=O)CC2)c1cc([O-])cs1 ZINC000743634151 574370108 /nfs/dbraw/zinc/37/01/08/574370108.db2.gz NCCRZJNLUPRNSO-UHFFFAOYSA-N -1 3 288.328 2.591 20 10 CFCDHM Cc1ccc(O[C@@H](C)CNC(=O)c2cc([O-])cs2)cc1 ZINC000743720164 574371289 /nfs/dbraw/zinc/37/12/89/574371289.db2.gz STRASPZJQJAVTQ-NSHDSACASA-N -1 3 291.372 2.959 20 10 CFCDHM CC[C@@H](NC(=O)c1cc([O-])cs1)c1c(C)nn(C)c1C ZINC000743748471 574371691 /nfs/dbraw/zinc/37/16/91/574371691.db2.gz NLZKVMJETDSEET-LLVKDONJSA-N -1 3 293.392 2.685 20 10 CFCDHM Cc1ccc(C(=O)Nc2cc(C(C)C)[nH]n2)c([O-])c1O ZINC000751535453 574378710 /nfs/dbraw/zinc/37/87/10/574378710.db2.gz PZXAZRLVUMFFAE-UHFFFAOYSA-N -1 3 275.308 2.505 20 10 CFCDHM C[C@H](C[C@H](O)c1cccs1)NC(=O)c1cc([O-])cs1 ZINC000752631009 574393248 /nfs/dbraw/zinc/39/32/48/574393248.db2.gz PGIXWHQRAKCCIS-SCZZXKLOSA-N -1 3 297.401 2.757 20 10 CFCDHM O=C([O-])C[N@H+](Cc1c([O-])ccc2ccccc21)C1CC1 ZINC000086751587 601376469 /nfs/dbraw/zinc/37/64/69/601376469.db2.gz BGVKSDPRTVOTSY-UHFFFAOYSA-N -1 3 271.316 2.594 20 10 CFCDHM O=C([O-])C[N@@H+](Cc1c([O-])ccc2ccccc21)C1CC1 ZINC000086751587 601376471 /nfs/dbraw/zinc/37/64/71/601376471.db2.gz BGVKSDPRTVOTSY-UHFFFAOYSA-N -1 3 271.316 2.594 20 10 CFCDHM CC(C)C[C@@H](CNC(=O)[O-])[NH2+][C@H](C)c1ccccc1[O-] ZINC000833793349 606039253 /nfs/dbraw/zinc/03/92/53/606039253.db2.gz DSOITXRZGZLSDT-NEPJUHHUSA-N -1 3 280.368 2.725 20 10 CFCDHM C[C@@H]1CCCC[C@@]1(C)NC(=O)c1cccc(O)c1[O-] ZINC000308721306 617827760 /nfs/dbraw/zinc/82/77/60/617827760.db2.gz CUBYCYNETYRRKE-MEBBXXQBSA-N -1 3 263.337 2.796 20 10 CFCDHM Cc1ccc(C(=O)Nc2ccc(N(C)C)cc2)c([O-])c1O ZINC000179410642 618272351 /nfs/dbraw/zinc/27/23/51/618272351.db2.gz AESJRDLNRJAMBA-UHFFFAOYSA-N -1 3 286.331 2.725 20 10 CFCDHM C[C@@H]1[C@H](C)SCCN1Cc1cc(F)cc(F)c1[O-] ZINC000894035221 618277293 /nfs/dbraw/zinc/27/72/93/618277293.db2.gz WRNNQNLJYRYPHF-BDAKNGLRSA-N -1 3 273.348 2.996 20 10 CFCDHM Cc1ccc(C(=O)Nc2ccc(F)cc2)c([O-])c1O ZINC000177665126 618469525 /nfs/dbraw/zinc/46/95/25/618469525.db2.gz ODCQMUBYTIPQEL-UHFFFAOYSA-N -1 3 261.252 2.798 20 10 CFCDHM CC(=O)c1cc(F)cc(CN2CCC(F)(F)C2)c1[O-] ZINC000313333363 618981936 /nfs/dbraw/zinc/98/19/36/618981936.db2.gz NMPZCEMTLAIWKI-UHFFFAOYSA-N -1 3 273.254 2.575 20 10 CFCDHM Cc1ccc(CN(CCO)Cc2cc(F)cc(F)c2[O-])o1 ZINC000894638473 619434238 /nfs/dbraw/zinc/43/42/38/619434238.db2.gz WMMBVHRMUMAWGF-UHFFFAOYSA-N -1 3 297.301 2.566 20 10 CFCDHM [O-]c1c(F)cc(F)cc1CN1CC(CC(F)F)C1 ZINC000895055371 619536716 /nfs/dbraw/zinc/53/67/16/619536716.db2.gz OIVAFNIOQUWLMU-UHFFFAOYSA-N -1 3 263.234 2.757 20 10 CFCDHM CCc1cc(C)nc(NCc2c([O-])cccc2F)n1 ZINC000895833184 619619332 /nfs/dbraw/zinc/61/93/32/619619332.db2.gz VQHSUZGACWXWTA-UHFFFAOYSA-N -1 3 261.300 2.804 20 10 CFCDHM CC(C)Oc1cncc(NCc2c([O-])cccc2F)n1 ZINC000895832684 619619464 /nfs/dbraw/zinc/61/94/64/619619464.db2.gz LXGAROCWEDIPRU-UHFFFAOYSA-N -1 3 277.299 2.721 20 10 CFCDHM C[C@H]1CCN(Cc2cc(Cl)c(F)cc2[O-])CCO1 ZINC000896578412 619766370 /nfs/dbraw/zinc/76/63/70/619766370.db2.gz URORBFINXAGGOF-VIFPVBQESA-N -1 3 273.735 2.796 20 10 CFCDHM Cc1nc(CNCc2c([O-])cccc2F)cs1 ZINC000896640310 619781721 /nfs/dbraw/zinc/78/17/21/619781721.db2.gz JSZMCWYAYVWDFS-UHFFFAOYSA-N -1 3 252.314 2.586 20 10 CFCDHM COc1ccc(CNCc2c([O-])cccc2F)c(OC)c1 ZINC000896640952 619781788 /nfs/dbraw/zinc/78/17/88/619781788.db2.gz NEJLCGVZZQJDAI-UHFFFAOYSA-N -1 3 291.322 2.838 20 10 CFCDHM [O-]c1ccc(Cl)cc1CN1CCn2cccc2C1 ZINC000896762195 619809570 /nfs/dbraw/zinc/80/95/70/619809570.db2.gz ZPLZLWJRWSKYKU-UHFFFAOYSA-N -1 3 262.740 2.863 20 10 CFCDHM C[C@@H](C(=O)NCc1c([O-])cccc1F)C(C)(C)C ZINC000928705470 619995308 /nfs/dbraw/zinc/99/53/08/619995308.db2.gz KKLJXEGECSJWRZ-VIFPVBQESA-N -1 3 253.317 2.830 20 10 CFCDHM CCCC(O)(CCC)CC(=O)NCc1c([O-])cccc1F ZINC000928705625 619995341 /nfs/dbraw/zinc/99/53/41/619995341.db2.gz MJMLJQHKWUSLEG-UHFFFAOYSA-N -1 3 297.370 2.869 20 10 CFCDHM CC(C)c1ocnc1C(=O)NCc1c([O-])cccc1F ZINC000928706132 619995457 /nfs/dbraw/zinc/99/54/57/619995457.db2.gz RMVRZKWWQSFTLR-UHFFFAOYSA-N -1 3 278.283 2.573 20 10 CFCDHM C[C@H]1CC[C@@H](CC(=O)NCc2c([O-])cccc2F)C1 ZINC000928706789 619995972 /nfs/dbraw/zinc/99/59/72/619995972.db2.gz ZZXDUUFTIDRGGH-WDEREUQCSA-N -1 3 265.328 2.974 20 10 CFCDHM C[C@@H]1CC[C@H](CC(=O)NCc2c([O-])cccc2F)C1 ZINC000928706786 619996029 /nfs/dbraw/zinc/99/60/29/619996029.db2.gz ZZXDUUFTIDRGGH-MNOVXSKESA-N -1 3 265.328 2.974 20 10 CFCDHM CO[C@H]1CCC[C@H](CC(=O)NCc2c([O-])cccc2F)C1 ZINC000928707756 619996480 /nfs/dbraw/zinc/99/64/80/619996480.db2.gz HTGWZOJMQIWSQV-RYUDHWBXSA-N -1 3 295.354 2.743 20 10 CFCDHM CC(C)[C@@]1(C)C[C@H]1C(=O)NCc1c([O-])cccc1F ZINC000928708776 619996591 /nfs/dbraw/zinc/99/65/91/619996591.db2.gz TYSGKVZBVFXUPK-XHDPSFHLSA-N -1 3 265.328 2.830 20 10 CFCDHM Cc1noc(C2(NCc3cc(Cl)c(C)cc3[O-])CC2)n1 ZINC000897896392 620300198 /nfs/dbraw/zinc/30/01/98/620300198.db2.gz VSKMKQFCSLALKV-UHFFFAOYSA-N -1 3 293.754 2.824 20 10 CFCDHM C[C@H](NCc1ccc(F)c(F)c1[O-])c1cncs1 ZINC000897930303 620305355 /nfs/dbraw/zinc/30/53/55/620305355.db2.gz MVYWAYZPXGVGRE-ZETCQYMHSA-N -1 3 270.304 2.978 20 10 CFCDHM [O-]c1c(Cl)cccc1CNCc1cc2n(n1)CCCC2 ZINC000898216531 620346702 /nfs/dbraw/zinc/34/67/02/620346702.db2.gz YEAPYUZPXJLDAF-UHFFFAOYSA-N -1 3 291.782 2.868 20 10 CFCDHM COc1ncc(CNCc2cccc(Cl)c2[O-])s1 ZINC000898218537 620347098 /nfs/dbraw/zinc/34/70/98/620347098.db2.gz JOGRJUVBGZSCBN-UHFFFAOYSA-N -1 3 284.768 2.801 20 10 CFCDHM Cc1cc(O)ccc1[N-]S(=O)(=O)c1ccc(F)cc1 ZINC000045929070 623036232 /nfs/dbraw/zinc/03/62/32/623036232.db2.gz KELKTYYOFWFDTN-UHFFFAOYSA-N -1 3 281.308 2.641 20 10 CFCDHM CCCCOCCCNC(=O)NCc1c([O-])cccc1F ZINC000913855474 623621811 /nfs/dbraw/zinc/62/18/11/623621811.db2.gz KNXWZQVJSMKKLS-UHFFFAOYSA-N -1 3 298.358 2.537 20 10 CFCDHM Cc1ccc([C@H](C)NC(=O)NCc2c([O-])cccc2F)o1 ZINC000913911073 623643951 /nfs/dbraw/zinc/64/39/51/623643951.db2.gz QFRAZGBGQAABDU-JTQLQIEISA-N -1 3 292.310 2.993 20 10 CFCDHM [O-]c1c(CN2CC[C@@H](O)C(F)(F)C2)ccc2ccccc12 ZINC000826953001 623913597 /nfs/dbraw/zinc/91/35/97/623913597.db2.gz ZFBLPCCWHLJPJU-CQSZACIVSA-N -1 3 293.313 2.747 20 10 CFCDHM Cc1nnc(CN(C)Cc2c([O-])cccc2Cl)s1 ZINC000827806196 624098469 /nfs/dbraw/zinc/09/84/69/624098469.db2.gz QESXRKHJQCGMHK-UHFFFAOYSA-N -1 3 283.784 2.838 20 10 CFCDHM O=C(C[C@H]1CC=CCC1)NCc1c([O-])cccc1F ZINC000830179637 624659499 /nfs/dbraw/zinc/65/94/99/624659499.db2.gz BHZUXMZCKGHQHO-NSHDSACASA-N -1 3 263.312 2.894 20 10 CFCDHM C[C@@]1(CNC(=O)NCc2c([O-])cccc2F)CCCS1 ZINC000921439675 624889560 /nfs/dbraw/zinc/88/95/60/624889560.db2.gz HNRROEJGZHIEQS-AWEZNQCLSA-N -1 3 298.383 2.616 20 10 CFCDHM CC(C)C[C@@H]1CCN(C(=O)c2cccc(O)c2[O-])C1 ZINC000185774572 625775663 /nfs/dbraw/zinc/77/56/63/625775663.db2.gz KJBHWJXBYZLPKX-NSHDSACASA-N -1 3 263.337 2.606 20 10 CFCDHM CC(C)C[C@H](C)NC(=O)NCc1c([O-])cccc1F ZINC000921599234 625992173 /nfs/dbraw/zinc/99/21/73/625992173.db2.gz CEGRYVALQPBVHK-JTQLQIEISA-N -1 3 268.332 2.765 20 10 CFCDHM CC(C)[C@]1(C)C[C@H]1NC(=O)NCc1c([O-])cccc1F ZINC000922849505 626381397 /nfs/dbraw/zinc/38/13/97/626381397.db2.gz KWTFQTXDBVJUNN-HIFRSBDPSA-N -1 3 280.343 2.765 20 10 CFCDHM Cc1nc2cc(NC(=O)c3cccc(O)c3[O-])ccc2o1 ZINC000186826010 626400623 /nfs/dbraw/zinc/40/06/23/626400623.db2.gz NOQULVHRROOTCM-UHFFFAOYSA-N -1 3 284.271 2.800 20 10 CFCDHM O=C(N[C@H](c1ccccc1)C1CC1)c1cccc(O)c1[O-] ZINC000186877571 626401685 /nfs/dbraw/zinc/40/16/85/626401685.db2.gz NVGUQKDUEVGLRP-OAHLLOKOSA-N -1 3 283.327 2.979 20 10 CFCDHM O=C(NCc1c([O-])cccc1F)NC1CC2(CCC2)C1 ZINC000923087830 626450671 /nfs/dbraw/zinc/45/06/71/626450671.db2.gz GOBYYKTXJTYTBQ-UHFFFAOYSA-N -1 3 278.327 2.663 20 10 CFCDHM O=C(NCc1c([O-])cccc1F)NC[C@H]1CCCC12CC2 ZINC000923494669 626476877 /nfs/dbraw/zinc/47/68/77/626476877.db2.gz ZNSUTCLKDWKEEZ-LLVKDONJSA-N -1 3 292.354 2.911 20 10 CFCDHM [O-]c1c(Cl)cccc1CN1C[C@@H]2C[C@H]1CS2 ZINC000839191611 626530796 /nfs/dbraw/zinc/53/07/96/626530796.db2.gz ILQSTRBLWFNPJM-UWVGGRQHSA-N -1 3 255.770 2.735 20 10 CFCDHM C[C@@H](NCc1cc(Cl)c(F)cc1[O-])c1ccn(C)n1 ZINC000839192695 626530934 /nfs/dbraw/zinc/53/09/34/626530934.db2.gz WAFVMTZVTAPJRZ-MRVPVSSYSA-N -1 3 283.734 2.769 20 10 CFCDHM CC(=O)c1cc(F)cc(CN2CC3(C2)CC(F)(F)C3)c1[O-] ZINC000761115305 626807570 /nfs/dbraw/zinc/80/75/70/626807570.db2.gz QUMQBJHJUATPOY-UHFFFAOYSA-N -1 3 299.292 2.965 20 10 CFCDHM Cc1ccc(F)c(CN(C)C(=O)c2cccc(O)c2[O-])c1 ZINC000768334260 627333437 /nfs/dbraw/zinc/33/34/37/627333437.db2.gz YHTRGVHTYQBSLZ-UHFFFAOYSA-N -1 3 289.306 2.818 20 10 CFCDHM COc1c([O-])c(CNc2cncc(C)c2)ccc1[N+](=O)[O-] ZINC000775034428 627986149 /nfs/dbraw/zinc/98/61/49/627986149.db2.gz SHLQKYPCKCDUJS-UHFFFAOYSA-N -1 3 289.291 2.625 20 10 CFCDHM [O-]c1c(Cl)cccc1CN1CCCC[C@H]1C1OCCO1 ZINC000775674449 628053127 /nfs/dbraw/zinc/05/31/27/628053127.db2.gz BSCVDNRMZLXFQL-ZDUSSCGKSA-N -1 3 297.782 2.773 20 10 CFCDHM Cc1ccc(C(=O)Nc2nc3c(s2)CCC3)c([O-])c1O ZINC000780859397 628500681 /nfs/dbraw/zinc/50/06/81/628500681.db2.gz DJNPYFMUHCLBFF-UHFFFAOYSA-N -1 3 290.344 2.604 20 10 CFCDHM CCc1ncsc1NC(=O)c1ccc(C)c(O)c1[O-] ZINC000780985840 628511344 /nfs/dbraw/zinc/51/13/44/628511344.db2.gz IGRMPGIGPNOCOX-UHFFFAOYSA-N -1 3 278.333 2.677 20 10 CFCDHM Cc1noc(NCc2cc(C)cc(Br)c2[O-])n1 ZINC000781559338 628559778 /nfs/dbraw/zinc/55/97/78/628559778.db2.gz AWGOYCQCTHDHAL-UHFFFAOYSA-N -1 3 298.140 2.767 20 10 CFCDHM CC[C@H](NCc1cc(F)ccc1[O-])C(F)(F)F ZINC000787438495 629012715 /nfs/dbraw/zinc/01/27/15/629012715.db2.gz AIZKLVJKTAOACN-JTQLQIEISA-N -1 3 251.223 2.962 20 10 CFCDHM Cc1nc(NCc2cc(C)cc(Br)c2[O-])n[nH]1 ZINC000788451684 629068832 /nfs/dbraw/zinc/06/88/32/629068832.db2.gz NIYAZNFSJHPVRX-UHFFFAOYSA-N -1 3 297.156 2.502 20 10 CFCDHM O=C(NCC(F)(F)c1ccccc1)c1cccc(O)c1[O-] ZINC000789859908 629192564 /nfs/dbraw/zinc/19/25/64/629192564.db2.gz APWHXOISMASDSJ-UHFFFAOYSA-N -1 3 293.269 2.620 20 10 CFCDHM C[C@@H]1C[C@@H]1c1ccc(CNC(=O)c2cccc(O)c2[O-])o1 ZINC000790554486 629247487 /nfs/dbraw/zinc/24/74/87/629247487.db2.gz OCGAYKCULJYIRJ-SKDRFNHKSA-N -1 3 287.315 2.744 20 10 CFCDHM CCc1ccc(CCNC(=O)c2cccc(O)c2[O-])cc1 ZINC000790747613 629259260 /nfs/dbraw/zinc/25/92/60/629259260.db2.gz XJXPKVAEMJCNIF-UHFFFAOYSA-N -1 3 285.343 2.633 20 10 CFCDHM Cc1cc(NC(=O)c2cccc(O)c2[O-])cc2n[nH]cc21 ZINC000790911329 629271127 /nfs/dbraw/zinc/27/11/27/629271127.db2.gz GQPUMTOOINPXIO-UHFFFAOYSA-N -1 3 283.287 2.535 20 10 CFCDHM CC[C@H](C)n1ncc(NC(=O)c2cccc(O)c2[O-])c1C ZINC000791569040 629334632 /nfs/dbraw/zinc/33/46/32/629334632.db2.gz PVAKGISWFOABET-VIFPVBQESA-N -1 3 289.335 2.826 20 10 CFCDHM C[C@H](O)[C@@H]1CCCN(Cc2c([O-])ccc(Cl)c2F)C1 ZINC000792174331 629406184 /nfs/dbraw/zinc/40/61/84/629406184.db2.gz RYXQFFKBTMOITD-VHSXEESVSA-N -1 3 287.762 2.778 20 10 CFCDHM CC1(C)CN(Cc2c([O-])ccc(Cl)c2F)CC[C@H]1O ZINC000792178363 629406639 /nfs/dbraw/zinc/40/66/39/629406639.db2.gz DBIFUFARJYVWTL-GFCCVEGCSA-N -1 3 287.762 2.778 20 10 CFCDHM CC[C@H](Nc1cn(C)nc1OC)c1ccc(F)cc1[O-] ZINC000796960254 629996099 /nfs/dbraw/zinc/99/60/99/629996099.db2.gz DMEYIWNLROYBIP-NSHDSACASA-N -1 3 279.315 2.837 20 10 CFCDHM [O-]c1c(Cl)cccc1CN1CC[C@H](OC(F)F)C1 ZINC000802658439 630536561 /nfs/dbraw/zinc/53/65/61/630536561.db2.gz AQJHTCFPOBCBDT-VIFPVBQESA-N -1 3 277.698 2.859 20 10 CFCDHM COc1cccc(C2(NC(=O)c3cccc(O)c3[O-])CC2)c1 ZINC000804323723 630672202 /nfs/dbraw/zinc/67/22/02/630672202.db2.gz VCLYRPULVLLERL-UHFFFAOYSA-N -1 3 299.326 2.526 20 10 CFCDHM CO[C@H]1C[C@@H](N(C)Cc2c([O-])ccc(Cl)c2F)C1 ZINC000809692841 631265538 /nfs/dbraw/zinc/26/55/38/631265538.db2.gz ICHDOWBWGNCERG-DTORHVGOSA-N -1 3 273.735 2.794 20 10 CFCDHM [O-]c1ccc(Cl)cc1CN1CCOC[C@H]1CC(F)F ZINC000809713138 631269106 /nfs/dbraw/zinc/26/91/06/631269106.db2.gz ZXELIBFGCVQHEH-LLVKDONJSA-N -1 3 291.725 2.902 20 10 CFCDHM C[C@@H](NCc1cocn1)c1ccc(Cl)cc1[O-] ZINC000841750238 631464041 /nfs/dbraw/zinc/46/40/41/631464041.db2.gz NNVOGFRMPRKTEN-MRVPVSSYSA-N -1 3 252.701 2.884 20 10 CFCDHM C[C@H](NCc1ccon1)c1ccc(Cl)cc1[O-] ZINC000841755166 631467161 /nfs/dbraw/zinc/46/71/61/631467161.db2.gz OMYBQBZRYFVGSV-QMMMGPOBSA-N -1 3 252.701 2.884 20 10 CFCDHM Cc1nnsc1CN[C@H](C)c1cc(F)cc(F)c1[O-] ZINC000813883504 631971947 /nfs/dbraw/zinc/97/19/47/631971947.db2.gz OILCHPDTJIKOMV-ZCFIWIBFSA-N -1 3 285.319 2.681 20 10 CFCDHM O=C(c1cccc(O)c1[O-])N1CCCC[C@H]1C1CCC1 ZINC000844124529 632123113 /nfs/dbraw/zinc/12/31/13/632123113.db2.gz USYYMUAKDIKAGF-ZDUSSCGKSA-N -1 3 275.348 2.893 20 10 CFCDHM CCN1CCN(Cc2cc(Cl)c(F)cc2[O-])C[C@@H]1C ZINC000816506452 632474145 /nfs/dbraw/zinc/47/41/45/632474145.db2.gz CYDXKPJVVSXJEW-JTQLQIEISA-N -1 3 286.778 2.711 20 10 CFCDHM CC1(C)CN(Cc2cc(Cl)c(F)cc2[O-])CC[C@H]1O ZINC000816586193 632490089 /nfs/dbraw/zinc/49/00/89/632490089.db2.gz CFVICAXQSCAMJH-CYBMUJFWSA-N -1 3 287.762 2.778 20 10 CFCDHM [O-]c1c(CN2C[C@@H](O)CC(F)(F)C2)ccc2ccccc12 ZINC000816589415 632490738 /nfs/dbraw/zinc/49/07/38/632490738.db2.gz XMEHHBJJKHKCQI-ZDUSSCGKSA-N -1 3 293.313 2.747 20 10 CFCDHM CC[C@@H]1CN(C)CCN1Cc1cc(Cl)cc(F)c1[O-] ZINC000816660352 632506106 /nfs/dbraw/zinc/50/61/06/632506106.db2.gz AJGBPIVPZJYVQR-GFCCVEGCSA-N -1 3 286.778 2.711 20 10 CFCDHM CCn1nc(C)c(CN[C@H](C)c2ccc(Cl)cc2[O-])n1 ZINC000818346850 632834474 /nfs/dbraw/zinc/83/44/74/632834474.db2.gz VHPCEHCHWLCADV-SECBINFHSA-N -1 3 294.786 2.816 20 10 CFCDHM C[C@@H]1CCN(Cc2c([O-])ccc(Cl)c2F)C[C@H]1CO ZINC000857060506 635921332 /nfs/dbraw/zinc/92/13/32/635921332.db2.gz AMMZXLYXGIMRNT-ZJUUUORDSA-N -1 3 287.762 2.635 20 10 CFCDHM C[C@@H]1CCN(Cc2cc(Cl)cc(F)c2[O-])C[C@H]1CO ZINC000857061557 635921768 /nfs/dbraw/zinc/92/17/68/635921768.db2.gz RYJJRPYCEYLHMU-KOLCDFICSA-N -1 3 287.762 2.635 20 10 CFCDHM CC[C@H](NCc1ncccn1)c1ccc(F)cc1[O-] ZINC000850552831 634051786 /nfs/dbraw/zinc/05/17/86/634051786.db2.gz QFSRIKQJGAHBIS-LBPRGKRZSA-N -1 3 261.300 2.562 20 10 CFCDHM N[C@@H]1CN(Cc2cc(Cl)cc(Cl)c2[O-])CC[C@H]1F ZINC000853248431 634951498 /nfs/dbraw/zinc/95/14/98/634951498.db2.gz TZSNUSUUKWUNER-GHMZBOCLSA-N -1 3 293.169 2.570 20 10 CFCDHM Cc1ccc(C(=O)Nc2cc([C@H]3C[C@@H]3C)[nH]n2)c([O-])c1O ZINC000855002077 635437205 /nfs/dbraw/zinc/43/72/05/635437205.db2.gz NSZBZGSWICRUBI-WPRPVWTQSA-N -1 3 287.319 2.505 20 10 CFCDHM COc1c(F)cc(NC(=O)c2cccc(O)c2[O-])cc1F ZINC000188241875 650320639 /nfs/dbraw/zinc/32/06/39/650320639.db2.gz KJXNNAXJKMVIOP-UHFFFAOYSA-N -1 3 295.241 2.637 20 10 CFCDHM CC(C)CCn1ccc(NC(=O)c2cccc(O)c2[O-])n1 ZINC000193137547 650626678 /nfs/dbraw/zinc/62/66/78/650626678.db2.gz WKLPDLGOLHUEAU-UHFFFAOYSA-N -1 3 289.335 2.593 20 10 CFCDHM CCN(CC)c1ccc(C=C2SC(=O)[N-]C2=O)cc1F ZINC000874927975 642554289 /nfs/dbraw/zinc/55/42/89/642554289.db2.gz NBYHCXXUTFCGIE-WQLSENKSSA-N -1 3 294.351 2.996 20 10 CFCDHM C[C@H]1SCCN(Cc2ccc(F)c(F)c2[O-])[C@@H]1C ZINC000876751076 642993944 /nfs/dbraw/zinc/99/39/44/642993944.db2.gz UGAVRKVZALBVCX-RKDXNWHRSA-N -1 3 273.348 2.996 20 10 CFCDHM CC(C)CO[C@@H]1CCN(Cc2ccc(F)c(F)c2[O-])C1 ZINC000876808337 643018030 /nfs/dbraw/zinc/01/80/30/643018030.db2.gz HTIVRNNPZLSBPS-GFCCVEGCSA-N -1 3 285.334 2.917 20 10 CFCDHM O=C(Nc1nc2c(s1)CCCC2)c1cccc(O)c1[O-] ZINC000126319215 643117873 /nfs/dbraw/zinc/11/78/73/643117873.db2.gz HMOHAOYLFBLICJ-UHFFFAOYSA-N -1 3 290.344 2.685 20 10 CFCDHM CCOc1cccc(NC(=O)c2cccc(O)c2[O-])c1 ZINC000126321167 643143538 /nfs/dbraw/zinc/14/35/38/643143538.db2.gz AJWYLZQXTOKOTJ-UHFFFAOYSA-N -1 3 273.288 2.749 20 10 CFCDHM O=C(Nc1cc(F)c(F)cc1F)c1cccc(O)c1[O-] ZINC000126388201 643189172 /nfs/dbraw/zinc/18/91/72/643189172.db2.gz ZJIQNGSUDJSZGP-UHFFFAOYSA-N -1 3 283.205 2.767 20 10 CFCDHM CC(C)CC[C@@H](C)NC(=O)c1cccc(O)c1[O-] ZINC000126424862 643211163 /nfs/dbraw/zinc/21/11/63/643211163.db2.gz ZKTKFHHIJFXXKF-SNVBAGLBSA-N -1 3 251.326 2.652 20 10 CFCDHM C[C@H]1CC(NC(=O)c2cccc(O)c2[O-])C[C@H](C)C1 ZINC000126448567 643227552 /nfs/dbraw/zinc/22/75/52/643227552.db2.gz KEROQGFGWUWBOA-NXEZZACHSA-N -1 3 263.337 2.652 20 10 CFCDHM CC[C@H](C)C[C@H](C)NC(=O)c1cccc(O)c1[O-] ZINC000126457522 643231672 /nfs/dbraw/zinc/23/16/72/643231672.db2.gz LRWSELMQAHPTBV-UWVGGRQHSA-N -1 3 251.326 2.652 20 10 CFCDHM Cc1nccnc1[C@@H](C)NCc1ccc(F)c(F)c1[O-] ZINC000877829354 643594691 /nfs/dbraw/zinc/59/46/91/643594691.db2.gz ZXXORCFQHGBZTL-SECBINFHSA-N -1 3 279.290 2.620 20 10 CFCDHM CCn1cc([C@H](C)NCc2cc(F)cc(F)c2[O-])cn1 ZINC000883137457 645620980 /nfs/dbraw/zinc/62/09/80/645620980.db2.gz FTWTYFPYNLPAFV-VIFPVBQESA-N -1 3 281.306 2.738 20 10 CFCDHM C[C@H](NCc1cscn1)c1c([O-])cccc1F ZINC000886518782 647025616 /nfs/dbraw/zinc/02/56/16/647025616.db2.gz GGFGVXZOFHZDOU-QMMMGPOBSA-N -1 3 252.314 2.839 20 10 CFCDHM C[C@@H](N[C@@H]1CCn2ccnc21)c1c([O-])cccc1F ZINC000886615414 647069150 /nfs/dbraw/zinc/06/91/50/647069150.db2.gz FUIDKPFOKCPHHL-MWLCHTKSSA-N -1 3 261.300 2.523 20 10 CFCDHM COc1cccnc1CN[C@H](C)c1c([O-])cccc1F ZINC000886621782 647072504 /nfs/dbraw/zinc/07/25/04/647072504.db2.gz AXWRACYKVQSLAL-SNVBAGLBSA-N -1 3 276.311 2.786 20 10 CFCDHM O=C(NCc1c([O-])cccc1F)NC[C@]12C[C@H]1CCCC2 ZINC000924378402 647969429 /nfs/dbraw/zinc/96/94/29/647969429.db2.gz RPJCYPQNSCZCAG-BZNIZROVSA-N -1 3 292.354 2.911 20 10 CFCDHM C[C@@H]1CCC[C@@H](C(=O)NCc2c([O-])cccc2F)C1 ZINC000928705198 648944061 /nfs/dbraw/zinc/94/40/61/648944061.db2.gz HFCLIAAQGYQBTH-GHMZBOCLSA-N -1 3 265.328 2.974 20 10 CFCDHM C[C@H](CC(F)(F)F)C(=O)NCc1c([O-])cccc1F ZINC000928705542 648944583 /nfs/dbraw/zinc/94/45/83/648944583.db2.gz JMYBOWUUEYFNER-SSDOTTSWSA-N -1 3 279.233 2.736 20 10 CFCDHM C[C@@H]1CC[C@@H](CC(=O)NCc2c([O-])cccc2F)C1 ZINC000928706784 648945379 /nfs/dbraw/zinc/94/53/79/648945379.db2.gz ZZXDUUFTIDRGGH-GHMZBOCLSA-N -1 3 265.328 2.974 20 10 CFCDHM CC[C@@H](C)CC[C@H](O)CC(=O)NCc1c([O-])cccc1F ZINC000928708262 648945682 /nfs/dbraw/zinc/94/56/82/648945682.db2.gz JLKNUGROWLBNJY-NEPJUHHUSA-N -1 3 297.370 2.725 20 10 CFCDHM CC(C)[C@@]1(C)C[C@@H]1C(=O)NCc1c([O-])cccc1F ZINC000928708774 648946068 /nfs/dbraw/zinc/94/60/68/648946068.db2.gz TYSGKVZBVFXUPK-IAQYHMDHSA-N -1 3 265.328 2.830 20 10 CFCDHM CC(C)C(C)(C)C(=O)NCc1c([O-])cccc1F ZINC000928708700 648946198 /nfs/dbraw/zinc/94/61/98/648946198.db2.gz QWKSJHMIFXNHHO-UHFFFAOYSA-N -1 3 253.317 2.830 20 10 CFCDHM COc1cc([O-])c(CN2CC=CC2)cc1Br ZINC001233134979 777804386 /nfs/dbraw/zinc/80/43/86/777804386.db2.gz IQCCOGJKLYJRIC-UHFFFAOYSA-N -1 3 284.153 2.535 20 10 CFCDHM O=C(c1cccc(O)c1[O-])N1CCC[C@H](C2CCC2)C1 ZINC000692936490 769831025 /nfs/dbraw/zinc/83/10/25/769831025.db2.gz YBPLMGOZVLFVRV-LBPRGKRZSA-N -1 3 275.348 2.750 20 10 CFCDHM CN(Cc1c([O-])cc(F)cc1F)C[C@H]1CCCCO1 ZINC001140583538 770965018 /nfs/dbraw/zinc/96/50/18/770965018.db2.gz KKKUDWKGQLDVKI-LLVKDONJSA-N -1 3 271.307 2.671 20 10 CFCDHM [O-]c1cc(F)cc(F)c1CN1CCc2cccc(O)c2C1 ZINC001140584595 770970605 /nfs/dbraw/zinc/97/06/05/770970605.db2.gz YBVTXQKHBTUCGX-UHFFFAOYSA-N -1 3 291.297 2.934 20 10 CFCDHM C[N@H+](CCc1ccccc1)Cc1ccc(C(=O)[O-])cc1[O-] ZINC001231448673 777220326 /nfs/dbraw/zinc/22/03/26/777220326.db2.gz NIUROIWZIFPWRK-UHFFFAOYSA-N -1 3 285.343 2.765 20 10 CFCDHM C[N@@H+](CCc1ccccc1)Cc1ccc(C(=O)[O-])cc1[O-] ZINC001231448673 777220336 /nfs/dbraw/zinc/22/03/36/777220336.db2.gz NIUROIWZIFPWRK-UHFFFAOYSA-N -1 3 285.343 2.765 20 10 CFCDHM C[N@H+](Cc1ccc(F)cc1)Cc1ccc(C(=O)[O-])cc1[O-] ZINC001231445807 777221542 /nfs/dbraw/zinc/22/15/42/777221542.db2.gz BEZHLDIMQZSWPI-UHFFFAOYSA-N -1 3 289.306 2.862 20 10 CFCDHM C[N@@H+](Cc1ccc(F)cc1)Cc1ccc(C(=O)[O-])cc1[O-] ZINC001231445807 777221546 /nfs/dbraw/zinc/22/15/46/777221546.db2.gz BEZHLDIMQZSWPI-UHFFFAOYSA-N -1 3 289.306 2.862 20 10 CFCDHM O=C([O-])c1ccc(C[NH+]2CC3(C2)CCCCC3)c([O-])c1 ZINC001231454902 777223570 /nfs/dbraw/zinc/22/35/70/777223570.db2.gz KDJNHKDYTNMSPP-UHFFFAOYSA-N -1 3 275.348 2.857 20 10 CFCDHM C[C@@]1(F)CCC[N@H+](Cc2cc(C(=O)[O-])ccc2[O-])CC1 ZINC001231561228 777259144 /nfs/dbraw/zinc/25/91/44/777259144.db2.gz PUUPLKDJHVSERE-OAHLLOKOSA-N -1 3 281.327 2.805 20 10 CFCDHM C[C@@]1(F)CCC[N@@H+](Cc2cc(C(=O)[O-])ccc2[O-])CC1 ZINC001231561228 777259151 /nfs/dbraw/zinc/25/91/51/777259151.db2.gz PUUPLKDJHVSERE-OAHLLOKOSA-N -1 3 281.327 2.805 20 10 CFCDHM CCCCC[N@H+](C)Cc1cc(C(=O)[O-])ccc1[O-] ZINC001231559362 777260011 /nfs/dbraw/zinc/26/00/11/777260011.db2.gz BNAHDYOGAAAACB-UHFFFAOYSA-N -1 3 251.326 2.712 20 10 CFCDHM CCCCC[N@@H+](C)Cc1cc(C(=O)[O-])ccc1[O-] ZINC001231559362 777260019 /nfs/dbraw/zinc/26/00/19/777260019.db2.gz BNAHDYOGAAAACB-UHFFFAOYSA-N -1 3 251.326 2.712 20 10 CFCDHM O=C([O-])c1ccc([O-])c(C[N@@H+]2CC[C@@H]3CCC[C@@H]3C2)c1 ZINC001231561679 777260197 /nfs/dbraw/zinc/26/01/97/777260197.db2.gz YHIOKRPVXDRWIN-WCQYABFASA-N -1 3 275.348 2.712 20 10 CFCDHM O=C([O-])c1ccc([O-])c(C[N@H+]2CC[C@@H]3CCC[C@@H]3C2)c1 ZINC001231561679 777260201 /nfs/dbraw/zinc/26/02/01/777260201.db2.gz YHIOKRPVXDRWIN-WCQYABFASA-N -1 3 275.348 2.712 20 10 CFCDHM C[C@@H]1C[C@H](C)C[N@@H+](Cc2cc(C(=O)[O-])ccc2[O-])C1 ZINC001231564868 777261367 /nfs/dbraw/zinc/26/13/67/777261367.db2.gz JDCLDNFEIWHYHO-PHIMTYICSA-N -1 3 263.337 2.568 20 10 CFCDHM C[C@@H]1C[C@H](C)C[N@H+](Cc2cc(C(=O)[O-])ccc2[O-])C1 ZINC001231564868 777261371 /nfs/dbraw/zinc/26/13/71/777261371.db2.gz JDCLDNFEIWHYHO-PHIMTYICSA-N -1 3 263.337 2.568 20 10 CFCDHM CC(C)[C@H]1CCC[N@@H+]1Cc1cc(C(=O)[O-])ccc1[O-] ZINC001231566265 777262031 /nfs/dbraw/zinc/26/20/31/777262031.db2.gz VTQZUZSAOUXKJR-CYBMUJFWSA-N -1 3 263.337 2.711 20 10 CFCDHM CC(C)[C@H]1CCC[N@H+]1Cc1cc(C(=O)[O-])ccc1[O-] ZINC001231566265 777262036 /nfs/dbraw/zinc/26/20/36/777262036.db2.gz VTQZUZSAOUXKJR-CYBMUJFWSA-N -1 3 263.337 2.711 20 10 CFCDHM C[C@H]1CCCCC[N@@H+]1Cc1cc(C(=O)[O-])ccc1[O-] ZINC001231564095 777262198 /nfs/dbraw/zinc/26/21/98/777262198.db2.gz OCOTVJPWTULYGT-NSHDSACASA-N -1 3 263.337 2.855 20 10 CFCDHM C[C@H]1CCCCC[N@H+]1Cc1cc(C(=O)[O-])ccc1[O-] ZINC001231564095 777262200 /nfs/dbraw/zinc/26/22/00/777262200.db2.gz OCOTVJPWTULYGT-NSHDSACASA-N -1 3 263.337 2.855 20 10 CFCDHM [O-]c1c(CN2CCO[C@@H]3C[C@@H]32)ccc2ccccc21 ZINC001231881757 777364583 /nfs/dbraw/zinc/36/45/83/777364583.db2.gz BMQLYIUJXAMESC-LSDHHAIUSA-N -1 3 255.317 2.519 20 10 CFCDHM [O-]c1c(CN2CCn3nccc3C2)ccc2ccccc21 ZINC001231884196 777367199 /nfs/dbraw/zinc/36/71/99/777367199.db2.gz YSLQUFBSZXFWAR-UHFFFAOYSA-N -1 3 279.343 2.758 20 10 CFCDHM [O-]c1cc(O)c(CN2CC3(C2)CC(F)(F)C3)cc1Cl ZINC001232260449 777496801 /nfs/dbraw/zinc/49/68/01/777496801.db2.gz QNFCXNLSOREZDK-UHFFFAOYSA-N -1 3 289.709 2.982 20 10 CFCDHM COc1cc([O-])c(CN2CC[C@H](F)C2)cc1Cl ZINC001232265957 777499496 /nfs/dbraw/zinc/49/94/96/777499496.db2.gz HOAZDRYLROWBPY-VIFPVBQESA-N -1 3 259.708 2.598 20 10 CFCDHM [O-]c1ccc(F)c(F)c1CN1CC[C@H]2CCCO[C@@H]2C1 ZINC001233332759 777894643 /nfs/dbraw/zinc/89/46/43/777894643.db2.gz WRIBAVTTXMABEI-QMTHXVAHSA-N -1 3 283.318 2.671 20 10 CFCDHM [O-]c1c(CN2C[C@@H]3CCO[C@@H]3C2)cccc1C(F)(F)F ZINC001233418737 777942785 /nfs/dbraw/zinc/94/27/85/777942785.db2.gz TXCZHXOIHRFODZ-JOYOIKCWSA-N -1 3 287.281 2.632 20 10 CFCDHM CCOC1CN(Cc2ccc(C(F)(F)F)cc2[O-])C1 ZINC001233452033 777958227 /nfs/dbraw/zinc/95/82/27/777958227.db2.gz IHDSJDJIALVWFY-UHFFFAOYSA-N -1 3 275.270 2.632 20 10 CFCDHM [O-]c1c(CN2CC(F)(CO)C2)cccc1-c1ccccc1 ZINC001234998131 778349488 /nfs/dbraw/zinc/34/94/88/778349488.db2.gz FXQBQQIRSLMOEQ-UHFFFAOYSA-N -1 3 287.334 2.575 20 10 CFCDHM CC(=O)CN(C)Cc1cc(Cl)c(Cl)cc1[O-] ZINC001236793587 778939582 /nfs/dbraw/zinc/93/95/82/778939582.db2.gz LRIZPCIVQFXKQI-UHFFFAOYSA-N -1 3 262.136 2.720 20 10 CFCDHM COc1cc([O-])c(CN2C[C@@H]3C[C@@H]3[C@@H](F)C2)c(Cl)c1 ZINC001236796066 778941383 /nfs/dbraw/zinc/94/13/83/778941383.db2.gz QRUQEMUQDALJNL-FWDPORAESA-N -1 3 285.746 2.844 20 10 CFCDHM COc1cc([O-])c(CN2CCOCC23CCC3)c(Cl)c1 ZINC001236801264 778943317 /nfs/dbraw/zinc/94/33/17/778943317.db2.gz DIMDHIIHCJYTIS-UHFFFAOYSA-N -1 3 297.782 2.809 20 10 CFCDHM CC[C@@H]1COCCN1Cc1c([O-])cc(OC)cc1Cl ZINC001236803381 778945140 /nfs/dbraw/zinc/94/51/40/778945140.db2.gz NCCVEPZSXNAKBG-SNVBAGLBSA-N -1 3 285.771 2.665 20 10 CFCDHM COc1ccc(CN2CCC[C@]3(CCO3)C2)c([O-])c1Cl ZINC001236812434 778950816 /nfs/dbraw/zinc/95/08/16/778950816.db2.gz VPMITQIQIQQOGD-HNNXBMFYSA-N -1 3 297.782 2.809 20 10 CFCDHM COc1cc([O-])c(CN(C)CCF)c(Br)c1 ZINC001237069131 779004112 /nfs/dbraw/zinc/00/41/12/779004112.db2.gz ZAVRZJZRBIFRKN-UHFFFAOYSA-N -1 3 292.148 2.565 20 10 CFCDHM CSCCN(C)Cc1c([O-])ccc(F)c1Cl ZINC001237128515 779021661 /nfs/dbraw/zinc/02/16/61/779021661.db2.gz QTPMPQCZKXPHEC-UHFFFAOYSA-N -1 3 263.765 2.980 20 10 CFCDHM [O-]c1c(F)cc(Cl)cc1CN1CC[C@@H]2CCO[C@H]2C1 ZINC001237616365 779143950 /nfs/dbraw/zinc/14/39/50/779143950.db2.gz BSMVJCVKCKCECA-RNCFNFMXSA-N -1 3 285.746 2.796 20 10 CFCDHM [O-]c1c(F)cc(Cl)cc1CN1CCCC[C@@H]1CO ZINC001237618840 779145728 /nfs/dbraw/zinc/14/57/28/779145728.db2.gz JNDJPPOASDIRSM-LLVKDONJSA-N -1 3 273.735 2.532 20 10 CFCDHM CO[C@@H](C)C1CN(Cc2cc(Cl)cc(F)c2[O-])C1 ZINC001237623572 779147113 /nfs/dbraw/zinc/14/71/13/779147113.db2.gz POZCTQSVVAOGSC-QMMMGPOBSA-N -1 3 273.735 2.651 20 10 CFCDHM [O-]c1c(Cl)cc(F)cc1CN1CCC2(CCO2)CC1 ZINC001237798282 779180430 /nfs/dbraw/zinc/18/04/30/779180430.db2.gz CXRWICUKFYNIKJ-UHFFFAOYSA-N -1 3 285.746 2.940 20 10 CFCDHM [O-]c1c(Cl)cc(F)cc1CN1CCCC2(COC2)C1 ZINC001237801676 779181349 /nfs/dbraw/zinc/18/13/49/779181349.db2.gz UBWGODJBSRCDLO-UHFFFAOYSA-N -1 3 285.746 2.797 20 10 CFCDHM [O-]c1c(Cl)cc(F)cc1CN1CCC[C@]12CCOC2 ZINC001237806001 779183081 /nfs/dbraw/zinc/18/30/81/779183081.db2.gz QDNORORLHQTNBU-CQSZACIVSA-N -1 3 285.746 2.940 20 10 CFCDHM COC[C@H]1CCCN1Cc1cc(F)cc(Cl)c1[O-] ZINC001237804768 779183341 /nfs/dbraw/zinc/18/33/41/779183341.db2.gz GEQKEQLPIKRYST-LLVKDONJSA-N -1 3 273.735 2.796 20 10 CFCDHM C[C@@H]1CC[C@@H](O)CN1Cc1cc(F)c(Cl)cc1[O-] ZINC001237933457 779209730 /nfs/dbraw/zinc/20/97/30/779209730.db2.gz CCMBRSUVYCYIFE-PSASIEDQSA-N -1 3 273.735 2.530 20 10 CFCDHM C[C@]1(O)CCCN(Cc2cc(F)c(Cl)cc2[O-])C1 ZINC001237938032 779212064 /nfs/dbraw/zinc/21/20/64/779212064.db2.gz WVUVMYYCBMNGTL-ZDUSSCGKSA-N -1 3 273.735 2.532 20 10 CFCDHM [O-]c1cc(Cl)c(Cl)cc1CN1CCC[C@H](CO)C1 ZINC001236794767 779639190 /nfs/dbraw/zinc/63/91/90/779639190.db2.gz UNRBJYQVXLGTMN-VIFPVBQESA-N -1 3 290.190 2.903 20 10 CFCDHM [O-]c1cccc(Br)c1CNCC(F)(F)F ZINC000706830320 781204868 /nfs/dbraw/zinc/20/48/68/781204868.db2.gz PURTZOLOVDLEJD-UHFFFAOYSA-N -1 3 284.075 2.807 20 10 CFCDHM CCc1cnc(CNCc2cc(F)cc(F)c2[O-])s1 ZINC000708548446 781292769 /nfs/dbraw/zinc/29/27/69/781292769.db2.gz FSNYETHFWURQEJ-UHFFFAOYSA-N -1 3 284.331 2.979 20 10 CFCDHM C[C@@H](NCCF)c1ccc(Br)cc1[O-] ZINC000280925877 296124484 /nfs/dbraw/zinc/12/44/84/296124484.db2.gz DXTVEPICHXXBTG-SSDOTTSWSA-N -1 3 262.122 2.775 20 10 CFCDHM CC(=O)c1cc(Cl)cc(CN(C)C[C@H]2CCCO2)c1[O-] ZINC000048948788 373236146 /nfs/dbraw/zinc/23/61/46/373236146.db2.gz VOBZRFIKRIGDLT-CYBMUJFWSA-N -1 3 297.782 2.859 20 10 CFCDHM CCCOc1ccc(CN(C)Cc2cnccn2)c([O-])c1 ZINC000092591485 375128363 /nfs/dbraw/zinc/12/83/63/375128363.db2.gz CCVMXQIDXRUZPL-UHFFFAOYSA-N -1 3 287.363 2.603 20 10 CFCDHM C[C@H]1O[C@@H](C)[C@H](C)[C@H]1C(=O)NCc1cc(Cl)ccc1[O-] ZINC000529513802 383714988 /nfs/dbraw/zinc/71/49/88/383714988.db2.gz UFKRGMXOTBSKLO-LFNDISMMSA-N -1 3 297.782 2.721 20 10 CFCDHM O=C(c1cccc(O)c1[O-])N1CC(C2CCCCC2)C1 ZINC000294314045 296253996 /nfs/dbraw/zinc/25/39/96/296253996.db2.gz OWCWSOOTSQGGPA-UHFFFAOYSA-N -1 3 275.348 2.750 20 10 CFCDHM CCC[C@@H]1CN(Cc2cc(F)cc(C(C)=O)c2[O-])CCO1 ZINC000132176309 377811145 /nfs/dbraw/zinc/81/11/45/377811145.db2.gz SBHHOXVVZJWIRC-CQSZACIVSA-N -1 3 295.354 2.735 20 10 CFCDHM CCCOc1ccc(CN2CCO[C@H](CC)C2)c([O-])c1 ZINC000132020305 377792044 /nfs/dbraw/zinc/79/20/44/377792044.db2.gz IBDIFGHBSKEXBY-CQSZACIVSA-N -1 3 279.380 2.792 20 10 CFCDHM CC[C@H]1CN(Cc2c([O-])cccc2Cl)CCO1 ZINC000132011605 377792205 /nfs/dbraw/zinc/79/22/05/377792205.db2.gz ABIAKNKENFOWIQ-JTQLQIEISA-N -1 3 255.745 2.656 20 10 CFCDHM CN(Cc1c([O-])cccc1Cl)C[C@@H]1CCCO1 ZINC000132959398 377890816 /nfs/dbraw/zinc/89/08/16/377890816.db2.gz ZFYOGIBWOQXIMA-JTQLQIEISA-N -1 3 255.745 2.656 20 10 CFCDHM Cc1ccc(C(=O)NC[C@@H]2CC[C@H]3C[C@H]3C2)c([O-])c1O ZINC000529577130 383734142 /nfs/dbraw/zinc/73/41/42/383734142.db2.gz JIEOEGCMTZCYKA-GRYCIOLGSA-N -1 3 275.348 2.572 20 10 CFCDHM CO[C@@H]1CCCN(Cc2cc(Cl)cc(C(C)=O)c2[O-])C1 ZINC000177112987 380305792 /nfs/dbraw/zinc/30/57/92/380305792.db2.gz WOSLJXXLNDFUNL-CYBMUJFWSA-N -1 3 297.782 2.859 20 10 CFCDHM Cc1ccc(C(=O)N(C)[C@@H](C)c2cccnc2)c([O-])c1O ZINC000179460548 380547024 /nfs/dbraw/zinc/54/70/24/380547024.db2.gz UQPWROMJPUZWNP-NSHDSACASA-N -1 3 286.331 2.634 20 10 CFCDHM Cc1ncsc1CN(C)Cc1cc(F)ccc1[O-] ZINC000180069108 380615822 /nfs/dbraw/zinc/61/58/22/380615822.db2.gz UBTNTAQIVZYXQC-UHFFFAOYSA-N -1 3 266.341 2.928 20 10 CFCDHM [O-]c1c(Cl)cccc1CN1CCS[C@@H]2COCC[C@@H]21 ZINC000180683885 380690362 /nfs/dbraw/zinc/69/03/62/380690362.db2.gz DXKBGRQLWXVTTA-QWHCGFSZSA-N -1 3 299.823 2.752 20 10 CFCDHM COC[C@@H](NCc1cc(F)ccc1[O-])c1ccc(C)o1 ZINC000180826304 380702366 /nfs/dbraw/zinc/70/23/66/380702366.db2.gz WHPMGLIHKLRMDX-CYBMUJFWSA-N -1 3 279.311 2.910 20 10 CFCDHM C[C@H](NCc1cnnn1C)c1ccc2ccccc2c1[O-] ZINC000287404429 380824498 /nfs/dbraw/zinc/82/44/98/380824498.db2.gz RDTIMXLZIYUFFY-NSHDSACASA-N -1 3 282.347 2.525 20 10 CFCDHM Cc1ccc(C(=O)N(C)CCc2cccs2)c([O-])c1O ZINC000182524274 381106866 /nfs/dbraw/zinc/10/68/66/381106866.db2.gz VPAHQKZDYRXZBH-UHFFFAOYSA-N -1 3 291.372 2.782 20 10 CFCDHM CC[C@@H](CSC)N(C)C(=O)c1ccc(C)c(O)c1[O-] ZINC000182983922 381193332 /nfs/dbraw/zinc/19/33/32/381193332.db2.gz AFJDKZGADFIZAL-JTQLQIEISA-N -1 3 283.393 2.620 20 10 CFCDHM COc1c([O-])c(CN2CCC[C@@](C)(F)C2)ccc1[N+](=O)[O-] ZINC000296119847 381263103 /nfs/dbraw/zinc/26/31/03/381263103.db2.gz SYBCMIQDBZKZRV-CQSZACIVSA-N -1 3 298.314 2.633 20 10 CFCDHM COc1cc(Cl)cc(CN(C(C)C)C2COC2)c1[O-] ZINC000296181855 381288805 /nfs/dbraw/zinc/28/88/05/381288805.db2.gz XUFYCTWCWBSFKU-UHFFFAOYSA-N -1 3 285.771 2.663 20 10 CFCDHM CC(C)(C)n1ncnc1CN[C@@H]1CCc2cccc([O-])c21 ZINC000296527776 381435687 /nfs/dbraw/zinc/43/56/87/381435687.db2.gz RLWYSNJZLLVSSG-GFCCVEGCSA-N -1 3 286.379 2.516 20 10 CFCDHM COc1cc(Cl)cc(CN2CCO[C@@H](C)[C@H]2C)c1[O-] ZINC000184694221 381462562 /nfs/dbraw/zinc/46/25/62/381462562.db2.gz FTNALIUTKIMRFU-ZJUUUORDSA-N -1 3 285.771 2.663 20 10 CFCDHM Cc1nn(C)cc1[C@H](C)N[C@@H](C)c1ccc(F)cc1[O-] ZINC000185349476 381607804 /nfs/dbraw/zinc/60/78/04/381607804.db2.gz LFJBXCFSVBBZIE-UWVGGRQHSA-N -1 3 277.343 2.985 20 10 CFCDHM CC(=O)c1cc(F)cc(CN(C)[C@@H](CO)CC(C)C)c1[O-] ZINC000185370480 381615961 /nfs/dbraw/zinc/61/59/61/381615961.db2.gz XEKYBHSXCIPFSD-CQSZACIVSA-N -1 3 297.370 2.573 20 10 CFCDHM O=C1OCCC12CCN(Cc1cc(Cl)ccc1[O-])CC2 ZINC000359865975 381648651 /nfs/dbraw/zinc/64/86/51/381648651.db2.gz FHVYEUIRVHGWNJ-UHFFFAOYSA-N -1 3 295.766 2.575 20 10 CFCDHM O=C(c1cccc(O)c1[O-])N1CC[C@H](Cc2ccccc2)C1 ZINC000185726246 381716393 /nfs/dbraw/zinc/71/63/93/381716393.db2.gz OZSRCXKFGWUIKY-CQSZACIVSA-N -1 3 297.354 2.803 20 10 CFCDHM [O-]c1ccc(F)cc1CN1CCOC[C@H]1c1ccco1 ZINC000373120894 381932630 /nfs/dbraw/zinc/93/26/30/381932630.db2.gz HXZDFKCVFUOQNE-ZDUSSCGKSA-N -1 3 277.295 2.698 20 10 CFCDHM CCCOc1ccc(CN2CCO[C@@H](C3CC3)C2)c([O-])c1 ZINC000375332058 382081302 /nfs/dbraw/zinc/08/13/02/382081302.db2.gz NKKVWIILFHUAOJ-QGZVFWFLSA-N -1 3 291.391 2.792 20 10 CFCDHM COCC1=CCN(Cc2cc(Cl)cc(OC)c2[O-])CC1 ZINC000187621797 382228149 /nfs/dbraw/zinc/22/81/49/382228149.db2.gz AOQAFIPGZWJSQV-UHFFFAOYSA-N -1 3 297.782 2.833 20 10 CFCDHM Cc1c(CN[C@@H](C)c2ccc(F)c(F)c2[O-])cnn1C ZINC000187807723 382273759 /nfs/dbraw/zinc/27/37/59/382273759.db2.gz LHDIARYKNKFIEX-QMMMGPOBSA-N -1 3 281.306 2.563 20 10 CFCDHM CC1(C)CN(C(=O)c2cccc(O)c2[O-])[C@@H]1c1ccncc1 ZINC000293849099 382304841 /nfs/dbraw/zinc/30/48/41/382304841.db2.gz JAQFEQNLOFVAHH-OAHLLOKOSA-N -1 3 298.342 2.716 20 10 CFCDHM O=C1OCCC12CCN(Cc1cccc(Cl)c1[O-])CC2 ZINC000378442182 382461359 /nfs/dbraw/zinc/46/13/59/382461359.db2.gz JAJSANWYXKYUKN-UHFFFAOYSA-N -1 3 295.766 2.575 20 10 CFCDHM CN(Cc1cnn(C)c1)Cc1cc(Cl)c(F)cc1[O-] ZINC000294808782 382529488 /nfs/dbraw/zinc/52/94/88/382529488.db2.gz DVWFSRWBKWIHJR-UHFFFAOYSA-N -1 3 283.734 2.550 20 10 CFCDHM CCN(CCOC)Cc1cc(Cl)c(F)cc1[O-] ZINC000294889057 382540093 /nfs/dbraw/zinc/54/00/93/382540093.db2.gz LMTRASFPBTVARS-UHFFFAOYSA-N -1 3 261.724 2.653 20 10 CFCDHM C[C@@H]1CCN(Cc2cc(Cl)cc(Cl)c2[O-])[C@@H]1CO ZINC000191175550 382694272 /nfs/dbraw/zinc/69/42/72/382694272.db2.gz LJTTVZNBENZDHY-PRHODGIISA-N -1 3 290.190 2.902 20 10 CFCDHM O=C(NC[C@@H]1CCCC(F)(F)C1)c1cccc(O)c1[O-] ZINC000282295978 385275549 /nfs/dbraw/zinc/27/55/49/385275549.db2.gz RZQRVERIGRSXRP-SECBINFHSA-N -1 3 285.290 2.653 20 10 CFCDHM CCCCN(Cc1nnc(C)o1)Cc1ccccc1[O-] ZINC000282386165 385298379 /nfs/dbraw/zinc/29/83/79/385298379.db2.gz GKQJGKQGVHIIKI-UHFFFAOYSA-N -1 3 275.352 2.886 20 10 CFCDHM CC(C)(C)n1ncnc1CNCc1c([O-])cccc1Cl ZINC000282775492 385386578 /nfs/dbraw/zinc/38/65/78/385386578.db2.gz VFXXCUUPVIVQFM-UHFFFAOYSA-N -1 3 294.786 2.682 20 10 CFCDHM [O-]c1ccc(F)cc1CN1CCOCC12CCCC2 ZINC000272374903 385521870 /nfs/dbraw/zinc/52/18/70/385521870.db2.gz HCKFHTMDZDQDIT-UHFFFAOYSA-N -1 3 265.328 2.676 20 10 CFCDHM C[C@@H](N[C@@H](C)c1cc(Cl)ccc1[O-])c1nncn1C ZINC000273606780 385691373 /nfs/dbraw/zinc/69/13/73/385691373.db2.gz UJWYQKDAAULBEA-DTWKUNHWSA-N -1 3 280.759 2.586 20 10 CFCDHM C[C@@H](NCc1nccn1C)c1cc(Cl)ccc1[O-] ZINC000273613418 385691463 /nfs/dbraw/zinc/69/14/63/385691463.db2.gz WTPVYBBCVFAFMG-SECBINFHSA-N -1 3 265.744 2.630 20 10 CFCDHM CCNC(=O)[C@@H](C)N[C@@H](CC)c1cccc(Cl)c1[O-] ZINC000286867622 385728151 /nfs/dbraw/zinc/72/81/51/385728151.db2.gz HANSEDNNMJCJIE-SKDRFNHKSA-N -1 3 284.787 2.611 20 10 CFCDHM CN(Cc1nc(C(C)(C)C)no1)Cc1ccccc1[O-] ZINC000109769678 393879667 /nfs/dbraw/zinc/87/96/67/393879667.db2.gz RGWWCMMIUQFQAZ-UHFFFAOYSA-N -1 3 275.352 2.705 20 10 CFCDHM C[C@H](c1nc(C2CC2)no1)N(C)Cc1ccccc1[O-] ZINC000109771173 393879732 /nfs/dbraw/zinc/87/97/32/393879732.db2.gz WVPXDNSYPHVCKT-SNVBAGLBSA-N -1 3 273.336 2.846 20 10 CFCDHM CC[C@@H](NCC(=O)N(C)CC)c1cccc(Cl)c1[O-] ZINC000287604885 286902068 /nfs/dbraw/zinc/90/20/68/286902068.db2.gz ITOVKGQJJCASCA-GFCCVEGCSA-N -1 3 284.787 2.565 20 10 CFCDHM C[C@H](NCc1nnc(C2CC2)[nH]1)c1cc(Cl)ccc1[O-] ZINC000296228221 263187719 /nfs/dbraw/zinc/18/77/19/263187719.db2.gz BXOWRZSASRXFBH-QMMMGPOBSA-N -1 3 292.770 2.892 20 10 CFCDHM [O-]c1ccc(F)cc1CN1CCc2ccccc2[C@@H]1CO ZINC000180163917 275050329 /nfs/dbraw/zinc/05/03/29/275050329.db2.gz KUSSYTFMSGOAOP-INIZCTEOSA-N -1 3 287.334 2.623 20 10 CFCDHM CCCN(CC(=O)N(C)C)Cc1cc(Cl)cc(C)c1[O-] ZINC000179827839 276248655 /nfs/dbraw/zinc/24/86/55/276248655.db2.gz ULXTVUJWZVMPNC-UHFFFAOYSA-N -1 3 298.814 2.654 20 10 CFCDHM C[C@@H]1COc2ccccc2CN1C(=O)c1cccc(O)c1[O-] ZINC000365623696 288398492 /nfs/dbraw/zinc/39/84/92/288398492.db2.gz CQPLZJCNGSRDBH-LLVKDONJSA-N -1 3 299.326 2.521 20 10 CFCDHM C[C@H]1C[C@@H]2CCCC[C@@H]2N1C(=O)c1cccc(O)c1[O-] ZINC000187100248 300453091 /nfs/dbraw/zinc/45/30/91/300453091.db2.gz BFSVGSOHRQQEHW-GVXVVHGQSA-N -1 3 275.348 2.891 20 10 CFCDHM Cc1cc(Cl)cc(CN2CCOC[C@H]2C)c1[O-] ZINC000271696098 301286592 /nfs/dbraw/zinc/28/65/92/301286592.db2.gz AZNWKNKUHVZTMD-SNVBAGLBSA-N -1 3 255.745 2.575 20 10 CFCDHM CCN(C(=O)/C=C/c1cncc([O-])c1)c1ccc(OC)cc1 ZINC000492397893 332395673 /nfs/dbraw/zinc/39/56/73/332395673.db2.gz KRKZTOMLIIPFSC-RUDMXATFSA-N -1 3 298.342 2.862 20 10 CFCDHM CC(=O)c1cc(Cl)cc(CN[C@@H](C)c2cn[nH]c2)c1[O-] ZINC000275244258 518278319 /nfs/dbraw/zinc/27/83/19/518278319.db2.gz XPAKKMSHLMMJPF-QMMMGPOBSA-N -1 3 293.754 2.822 20 10 CFCDHM CC(C)(C)C1=CCN(C(=O)c2cccc(O)c2[O-])CC1 ZINC000162492714 518599852 /nfs/dbraw/zinc/59/98/52/518599852.db2.gz YSMLFGSFJGSKOA-UHFFFAOYSA-N -1 3 275.348 2.916 20 10 CFCDHM CC(C)(C)[C@H]1CN(Cc2cc(F)ccc2[O-])CCO1 ZINC000279831460 518981240 /nfs/dbraw/zinc/98/12/40/518981240.db2.gz BCILYWHJJZCJHE-CQSZACIVSA-N -1 3 267.344 2.778 20 10 CFCDHM CCN(C(=O)c1cccc(O)c1[O-])[C@@H]1CCOC(C)(C)C1 ZINC000292517435 520101275 /nfs/dbraw/zinc/10/12/75/520101275.db2.gz BLYXMXCARSNOTI-LLVKDONJSA-N -1 3 293.363 2.518 20 10 CFCDHM CC1(C)CN(Cc2ccccc2[O-])C[C@@H](C(F)(F)F)O1 ZINC000292740978 520484111 /nfs/dbraw/zinc/48/41/11/520484111.db2.gz HLMJIQDOCCDRGH-LBPRGKRZSA-N -1 3 289.297 2.934 20 10 CFCDHM CCC[C@H]1SCCN1C(=O)c1ccc(C)c(O)c1[O-] ZINC000179501600 521257609 /nfs/dbraw/zinc/25/76/09/521257609.db2.gz YCOXXCAYBKOGLG-LLVKDONJSA-N -1 3 281.377 2.721 20 10 CFCDHM CN(C)c1ccc(CN[C@@H](C(=O)[O-])c2ccccc2)cc1 ZINC000050507909 522212490 /nfs/dbraw/zinc/21/24/90/522212490.db2.gz MRPQGJUFPVUIHF-MRXNPFEDSA-N -1 3 284.359 2.668 20 10 CFCDHM COc1cc(Cl)cc(CN2CCO[C@H]3CCC[C@@H]32)c1[O-] ZINC000230929783 522536557 /nfs/dbraw/zinc/53/65/57/522536557.db2.gz AFQCENVBOJPSGX-STQMWFEESA-N -1 3 297.782 2.808 20 10 CFCDHM CC[C@H](N[C@@H](C)c1ncn(C)n1)c1ccc(C)cc1[O-] ZINC000280158759 522703752 /nfs/dbraw/zinc/70/37/52/522703752.db2.gz QOBVCJWNTDGOQZ-AAEUAGOBSA-N -1 3 274.368 2.631 20 10 CFCDHM CN(Cc1cccc(F)c1[O-])C[C@H]1CCCCO1 ZINC000160205642 523313201 /nfs/dbraw/zinc/31/32/01/523313201.db2.gz IOXYAUCQDVUKFI-GFCCVEGCSA-N -1 3 253.317 2.532 20 10 CFCDHM COc1ccccc1N(CCO)Cc1cc(F)ccc1[O-] ZINC000290273770 524531339 /nfs/dbraw/zinc/53/13/39/524531339.db2.gz YFIWJJIVDTZTAW-UHFFFAOYSA-N -1 3 291.322 2.539 20 10 CFCDHM C[C@@H]1C[C@H](c2cccnc2)N(C(=O)c2cccc(O)c2[O-])C1 ZINC000193162348 525468896 /nfs/dbraw/zinc/46/88/96/525468896.db2.gz MVRIXIFCHUFARA-BXUZGUMPSA-N -1 3 298.342 2.716 20 10 CFCDHM C[C@@H](N[C@@H](C)c1ccc(F)c(F)c1[O-])c1cnn(C)c1 ZINC000276883675 525607556 /nfs/dbraw/zinc/60/75/56/525607556.db2.gz GLAHPHFDXODQHI-BDAKNGLRSA-N -1 3 281.306 2.816 20 10 CFCDHM Cc1ccc([C@H](NCc2ccc3c(c2)CCO3)C(=O)[O-])cc1 ZINC000276950938 525969041 /nfs/dbraw/zinc/96/90/41/525969041.db2.gz DUTNGBFHBCJZQA-KRWDZBQOSA-N -1 3 297.354 2.845 20 10 CFCDHM O=C([O-])Cc1ccccc1CNCc1ccc2c(c1)CCO2 ZINC000276927540 527639312 /nfs/dbraw/zinc/63/93/12/527639312.db2.gz AWTFOCQXIKQDMO-UHFFFAOYSA-N -1 3 297.354 2.538 20 10 CFCDHM COC(=O)CN(Cc1cc(Cl)ccc1[O-])C[C@H]1C[C@@H]1C ZINC000754120262 574090358 /nfs/dbraw/zinc/09/03/58/574090358.db2.gz BLCMBTZJMAFZRD-WDEREUQCSA-N -1 3 297.782 2.677 20 10 CFCDHM COC(=O)CN(Cc1cc(Cl)ccc1[O-])C[C@@H]1C[C@@H]1C ZINC000754120261 574090569 /nfs/dbraw/zinc/09/05/69/574090569.db2.gz BLCMBTZJMAFZRD-QWRGUYRKSA-N -1 3 297.782 2.677 20 10 CFCDHM C[C@@H](C(=O)NC1CCCCC1)N(C)Cc1ccccc1[O-] ZINC000731843572 574130413 /nfs/dbraw/zinc/13/04/13/574130413.db2.gz RAWWQLVYEHOWES-ZDUSSCGKSA-N -1 3 290.407 2.661 20 10 CFCDHM O=C(NCCOc1ccc(Cl)cc1)c1cc([O-])cs1 ZINC000731863767 574130635 /nfs/dbraw/zinc/13/06/35/574130635.db2.gz CMMWSIQGSJREMU-UHFFFAOYSA-N -1 3 297.763 2.916 20 10 CFCDHM Cc1ccc(CN(C)C(=O)c2cc([O-])cs2)o1 ZINC000731863777 574130734 /nfs/dbraw/zinc/13/07/34/574130734.db2.gz DHWZIYHXWOQMHM-UHFFFAOYSA-N -1 3 251.307 2.627 20 10 CFCDHM O=C(OCc1ccc(F)cc1)c1cc([O-])cs1 ZINC000731912273 574133545 /nfs/dbraw/zinc/13/35/45/574133545.db2.gz SWEKDFLIIKGMCB-UHFFFAOYSA-N -1 3 252.266 2.950 20 10 CFCDHM Cc1cccc(OCCOC(=O)c2cc([O-])cs2)c1 ZINC000731912255 574133851 /nfs/dbraw/zinc/13/38/51/574133851.db2.gz SFXFDTMXFBSEIV-UHFFFAOYSA-N -1 3 278.329 2.998 20 10 CFCDHM CC[C@@H]1CN(Cc2c([O-])ccc3ccncc32)C[C@H](C)O1 ZINC000732183983 574145100 /nfs/dbraw/zinc/14/51/00/574145100.db2.gz CFWDVLYKUDCJNU-GXTWGEPZSA-N -1 3 286.375 2.940 20 10 CFCDHM Clc1cc(-c2nnn[n-]2)cnc1Sc1nccs1 ZINC000737558565 574147206 /nfs/dbraw/zinc/14/72/06/574147206.db2.gz NOBNPAUQWXFWIP-UHFFFAOYSA-N -1 3 296.768 2.523 20 10 CFCDHM Clc1cc(-c2nn[n-]n2)cnc1Sc1nccs1 ZINC000737558565 574147207 /nfs/dbraw/zinc/14/72/07/574147207.db2.gz NOBNPAUQWXFWIP-UHFFFAOYSA-N -1 3 296.768 2.523 20 10 CFCDHM O=C(c1cc([O-])cs1)N1CCC[C@@H]1c1ccncc1 ZINC000732265675 574147864 /nfs/dbraw/zinc/14/78/64/574147864.db2.gz FPQYVEWTEMADEG-GFCCVEGCSA-N -1 3 274.345 2.826 20 10 CFCDHM COc1ccc(C)cc1CNC(=O)c1cc([O-])cs1 ZINC000732267984 574148102 /nfs/dbraw/zinc/14/81/02/574148102.db2.gz ASOXZTLPVCLKMU-UHFFFAOYSA-N -1 3 277.345 2.701 20 10 CFCDHM O=C(Nc1ccc(-n2cccn2)cc1)c1cc([O-])cs1 ZINC000732271695 574148478 /nfs/dbraw/zinc/14/84/78/574148478.db2.gz PBIBCVDYWDMYHX-UHFFFAOYSA-N -1 3 285.328 2.892 20 10 CFCDHM CC(C)COC1CCN(C(=O)c2cc([O-])cs2)CC1 ZINC000732275474 574149470 /nfs/dbraw/zinc/14/94/70/574149470.db2.gz XTPPVHGONHYEBE-UHFFFAOYSA-N -1 3 283.393 2.731 20 10 CFCDHM Cc1csc([C@H](C)NC(=O)c2cc([O-])cs2)n1 ZINC000732284089 574149843 /nfs/dbraw/zinc/14/98/43/574149843.db2.gz JPRUUGQXGDCPHD-ZETCQYMHSA-N -1 3 268.363 2.710 20 10 CFCDHM O=C(NCCOc1ccc(F)c(F)c1)c1cc([O-])cs1 ZINC000732289868 574150581 /nfs/dbraw/zinc/15/05/81/574150581.db2.gz YIJFDRSLPNTGDG-UHFFFAOYSA-N -1 3 299.298 2.541 20 10 CFCDHM O=C(N[C@@H]1[C@H]2CCO[C@H]2C12CCCC2)c1cc([O-])cs1 ZINC000755297404 574153056 /nfs/dbraw/zinc/15/30/56/574153056.db2.gz SJEVQKPOGJBFIP-RAIGVLPGSA-N -1 3 293.388 2.531 20 10 CFCDHM COc1ccc(CNCc2cn3cc(C)ccc3n2)c([O-])c1 ZINC000729681163 574227955 /nfs/dbraw/zinc/22/79/55/574227955.db2.gz VZTGEPLOBXMGPU-UHFFFAOYSA-N -1 3 297.358 2.647 20 10 CFCDHM O=C(Nc1ccc(Cl)nc1)c1cc([O-])cs1 ZINC000733805569 574256802 /nfs/dbraw/zinc/25/68/02/574256802.db2.gz WFZLUTOEUSODLK-UHFFFAOYSA-N -1 3 254.698 2.754 20 10 CFCDHM C[C@@H](NCc1cccc(F)n1)c1cc(F)ccc1[O-] ZINC000756768803 574261259 /nfs/dbraw/zinc/26/12/59/574261259.db2.gz MWMVYHXRRDJZND-SECBINFHSA-N -1 3 264.275 2.916 20 10 CFCDHM CO[C@@H](CN[C@@H](C)c1ccc(F)cc1[O-])C(F)(F)F ZINC000756836457 574266444 /nfs/dbraw/zinc/26/64/44/574266444.db2.gz VRYYFSBFKZXDNU-CPCISQLKSA-N -1 3 281.249 2.759 20 10 CFCDHM O=C(c1cc([O-])cs1)N1CCOC2(CCCCC2)C1 ZINC000743712191 574371147 /nfs/dbraw/zinc/37/11/47/574371147.db2.gz MQCHXOYOTOTZOL-UHFFFAOYSA-N -1 3 281.377 2.629 20 10 CFCDHM O=C(NCC(C1CC1)C1CC1)c1cc([O-])cs1 ZINC000743749218 574371619 /nfs/dbraw/zinc/37/16/19/574371619.db2.gz YDNDLKOJBVHTCS-UHFFFAOYSA-N -1 3 251.351 2.620 20 10 CFCDHM CC(C)Cn1cc(NC(=O)c2cc([O-])cs2)cn1 ZINC000743754633 574371642 /nfs/dbraw/zinc/37/16/42/574371642.db2.gz WANAUUZQCBFBIY-UHFFFAOYSA-N -1 3 265.338 2.559 20 10 CFCDHM Cc1ccc(C(=O)N(C)Cc2ccccc2C)c([O-])c1O ZINC000751530286 574378512 /nfs/dbraw/zinc/37/85/12/574378512.db2.gz KMDJUGBLLQUSCE-UHFFFAOYSA-N -1 3 285.343 2.987 20 10 CFCDHM Cc1ccc(O)c(NC(=O)c2ccc(C)c(O)c2[O-])c1 ZINC000751535524 574378755 /nfs/dbraw/zinc/37/87/55/574378755.db2.gz QNCFTWYKAKMLHO-UHFFFAOYSA-N -1 3 273.288 2.673 20 10 CFCDHM CCOc1ccc(C[NH2+][C@](C)(CC)CC(=O)[O-])c([O-])c1 ZINC000830075510 601432927 /nfs/dbraw/zinc/43/29/27/601432927.db2.gz ZBGOIGCUDWHAQD-OAHLLOKOSA-N -1 3 281.352 2.524 20 10 CFCDHM O=C([O-])N1CC([NH2+]Cc2cc(-c3ccccc3)ccc2[O-])C1 ZINC000833278606 604420923 /nfs/dbraw/zinc/42/09/23/604420923.db2.gz YIHMCIHFQGERIJ-UHFFFAOYSA-N -1 3 298.342 2.511 20 10 CFCDHM C[N@H+](CC(=O)[O-])Cc1cc(-c2ccccc2)ccc1[O-] ZINC000820568703 604539924 /nfs/dbraw/zinc/53/99/24/604539924.db2.gz AOJNECIQLWEWEV-UHFFFAOYSA-N -1 3 271.316 2.576 20 10 CFCDHM C[N@@H+](CC(=O)[O-])Cc1cc(-c2ccccc2)ccc1[O-] ZINC000820568703 604539929 /nfs/dbraw/zinc/53/99/29/604539929.db2.gz AOJNECIQLWEWEV-UHFFFAOYSA-N -1 3 271.316 2.576 20 10 CFCDHM O=C([O-])[C@@H]1C[C@@H]2CCCC[C@H]2[N@@H+]1Cc1ccccc1[O-] ZINC000250094411 604679469 /nfs/dbraw/zinc/67/94/69/604679469.db2.gz YUFGOMVHOBPLHC-YUTCNCBUSA-N -1 3 275.348 2.610 20 10 CFCDHM O=C([O-])[C@@H]1C[C@@H]2CCCC[C@H]2[N@H+]1Cc1ccccc1[O-] ZINC000250094411 604679473 /nfs/dbraw/zinc/67/94/73/604679473.db2.gz YUFGOMVHOBPLHC-YUTCNCBUSA-N -1 3 275.348 2.610 20 10 CFCDHM Fc1ccc(CSc2nccs2)cc1-c1nnn[n-]1 ZINC000822773935 607008480 /nfs/dbraw/zinc/00/84/80/607008480.db2.gz BQTYEWJUAWTIEY-UHFFFAOYSA-N -1 3 293.352 2.755 20 10 CFCDHM Fc1ccc(CSc2nccs2)cc1-c1nn[n-]n1 ZINC000822773935 607008481 /nfs/dbraw/zinc/00/84/81/607008481.db2.gz BQTYEWJUAWTIEY-UHFFFAOYSA-N -1 3 293.352 2.755 20 10 CFCDHM Cc1c(NCc2cccc(F)c2[O-])cccc1-c1nn[nH]n1 ZINC000826242385 609486216 /nfs/dbraw/zinc/48/62/16/609486216.db2.gz MQIKGKNLKIPJNO-UHFFFAOYSA-N -1 3 299.309 2.632 20 10 CFCDHM Cc1c(NCc2cc(F)ccc2O)cccc1-c1nn[n-]n1 ZINC000826242315 609486338 /nfs/dbraw/zinc/48/63/38/609486338.db2.gz KAQSWBWWSCVGRP-UHFFFAOYSA-N -1 3 299.309 2.632 20 10 CFCDHM C[C@@H]1C[C@@H]1[C@@H]1C[C@@H]1CNC(=O)NCc1c([O-])cccc1F ZINC000924044697 617919027 /nfs/dbraw/zinc/91/90/27/617919027.db2.gz XDONNLDETAKXLG-WISYIIOYSA-N -1 3 292.354 2.623 20 10 CFCDHM [O-]c1c(F)cc(F)cc1CN1CCC[C@H](n2ccnc2)C1 ZINC000893994445 618261568 /nfs/dbraw/zinc/26/15/68/618261568.db2.gz MDSGPADLOKYSBX-ZDUSSCGKSA-N -1 3 293.317 2.704 20 10 CFCDHM COc1c(C)ccc(NC(=O)c2cccc(O)c2[O-])c1C ZINC000192981952 618446825 /nfs/dbraw/zinc/44/68/25/618446825.db2.gz OXCINKHSNIXUHW-UHFFFAOYSA-N -1 3 287.315 2.976 20 10 CFCDHM CN(Cc1cc(Cl)ccc1[O-])[C@H]1CC(C)(C)OC1=O ZINC000814181201 618459170 /nfs/dbraw/zinc/45/91/70/618459170.db2.gz XKUICLXXPOYVRL-NSHDSACASA-N -1 3 283.755 2.572 20 10 CFCDHM CC(C)(O)C1CCN(Cc2cc(F)cc(F)c2[O-])CC1 ZINC000895460701 618597459 /nfs/dbraw/zinc/59/74/59/618597459.db2.gz SEHMCUDNWYUABN-UHFFFAOYSA-N -1 3 285.334 2.653 20 10 CFCDHM Cc1nc(NCCCSc2nccs2)cc(=O)[n-]1 ZINC000892515331 618604664 /nfs/dbraw/zinc/60/46/64/618604664.db2.gz MXCYXFWJYWPGGY-UHFFFAOYSA-N -1 3 282.394 2.541 20 10 CFCDHM CC(C)c1nnc(NCc2c([O-])cccc2F)o1 ZINC000895832369 619619274 /nfs/dbraw/zinc/61/92/74/619619274.db2.gz FTZSTPHCYBXTSQ-UHFFFAOYSA-N -1 3 251.261 2.650 20 10 CFCDHM C[C@@H]1CCC[C@@H](OCC(=O)NCc2c([O-])cccc2F)C1 ZINC000928706733 619995994 /nfs/dbraw/zinc/99/59/94/619995994.db2.gz YPPNYIJBPSXOLG-VXGBXAGGSA-N -1 3 295.354 2.743 20 10 CFCDHM CC1CCC(OCC(=O)NCc2c([O-])cccc2F)CC1 ZINC000928709206 619996170 /nfs/dbraw/zinc/99/61/70/619996170.db2.gz YMSRXHMKLCDYCY-UHFFFAOYSA-N -1 3 295.354 2.743 20 10 CFCDHM CS[C@H](C)CCC(=O)NCc1c([O-])cccc1F ZINC000928708521 619996257 /nfs/dbraw/zinc/99/62/57/619996257.db2.gz NLGUVCYFBFOFPK-SECBINFHSA-N -1 3 271.357 2.679 20 10 CFCDHM CCn1ccc(C(=O)NCc2c([O-])cccc2F)c1C ZINC000928708275 619996317 /nfs/dbraw/zinc/99/63/17/619996317.db2.gz FDKCZEMSHCYNAX-UHFFFAOYSA-N -1 3 276.311 2.591 20 10 CFCDHM C[C@@H](CC(=O)NCc1c([O-])cccc1F)C1CC1 ZINC000928712231 619996784 /nfs/dbraw/zinc/99/67/84/619996784.db2.gz PBAWDJVTEASEIZ-VIFPVBQESA-N -1 3 251.301 2.584 20 10 CFCDHM CCC[C@H](C)CC(=O)NCc1c([O-])cccc1F ZINC000928712632 619997185 /nfs/dbraw/zinc/99/71/85/619997185.db2.gz UXRYGRYJCCDWHN-JTQLQIEISA-N -1 3 253.317 2.974 20 10 CFCDHM C[C@H](NCc1cc(F)cc(F)c1[O-])c1cncs1 ZINC000897929850 620305447 /nfs/dbraw/zinc/30/54/47/620305447.db2.gz BZHPRMQDHDNPEO-ZETCQYMHSA-N -1 3 270.304 2.978 20 10 CFCDHM O=C(NCc1c([O-])cccc1F)N[C@@H]1C[C@H]2CCC[C@H]21 ZINC000898254151 620357712 /nfs/dbraw/zinc/35/77/12/620357712.db2.gz ASWAJAXADRANAI-GIPNMCIBSA-N -1 3 278.327 2.519 20 10 CFCDHM C[C@@H](NCc1cnn(CCF)c1)c1cc(F)cc(F)c1[O-] ZINC000903274246 621310175 /nfs/dbraw/zinc/31/01/75/621310175.db2.gz KIJJMNCQCPROIQ-SECBINFHSA-N -1 3 299.296 2.687 20 10 CFCDHM C[C@H]1CCC[C@@H](NC(=O)c2cccc(O)c2[O-])CC1 ZINC000227535388 623112160 /nfs/dbraw/zinc/11/21/60/623112160.db2.gz OJJXXHIYISDEGM-WDEREUQCSA-N -1 3 263.337 2.796 20 10 CFCDHM Cc1cc([O-])c(CN2C[C@H](C)O[C@@H](C)C2)cc1Cl ZINC000824474850 623511568 /nfs/dbraw/zinc/51/15/68/623511568.db2.gz UQXLCCDFBCOUTI-QWRGUYRKSA-N -1 3 269.772 2.963 20 10 CFCDHM COC(=O)[C@H]1CCCCN1Cc1cc(Cl)c(C)cc1[O-] ZINC000824541647 623520148 /nfs/dbraw/zinc/52/01/48/623520148.db2.gz FZCWFEBBEMTXIS-CYBMUJFWSA-N -1 3 297.782 2.882 20 10 CFCDHM CN(Cc1ccon1)Cc1ccc(Br)cc1[O-] ZINC000824851175 623578524 /nfs/dbraw/zinc/57/85/24/623578524.db2.gz UDMQXPFMZMETPZ-UHFFFAOYSA-N -1 3 297.152 2.775 20 10 CFCDHM Cc1noc([C@@H](C)NCc2cc(Cl)c(C)cc2[O-])n1 ZINC000825681262 623738757 /nfs/dbraw/zinc/73/87/57/623738757.db2.gz OMMNDXYWZRTLHQ-MRVPVSSYSA-N -1 3 281.743 2.896 20 10 CFCDHM COCCC1CN(Cc2c([O-])ccc(Cl)c2F)C1 ZINC000826899291 623905502 /nfs/dbraw/zinc/90/55/02/623905502.db2.gz JFMYVEFLZDLLNP-UHFFFAOYSA-N -1 3 273.735 2.653 20 10 CFCDHM Cc1nc(CN(C)Cc2ccc3ccccc3c2[O-])no1 ZINC000827891189 624121674 /nfs/dbraw/zinc/12/16/74/624121674.db2.gz CPGORYOOHJSPOP-UHFFFAOYSA-N -1 3 283.331 2.869 20 10 CFCDHM CCCC[C@H](COC)NC(=O)NCc1c([O-])cccc1F ZINC000919456674 624574245 /nfs/dbraw/zinc/57/42/45/624574245.db2.gz YYBOROPPEWZRCZ-LLVKDONJSA-N -1 3 298.358 2.536 20 10 CFCDHM O=C(NCc1c([O-])cccc1F)[C@@H]1CC[C@@H]2C[C@@H]2CC1 ZINC000830180014 624659381 /nfs/dbraw/zinc/65/93/81/624659381.db2.gz GAYBZFKOYPUDBJ-CNDDSTCGSA-N -1 3 277.339 2.974 20 10 CFCDHM Cc1ccc(C(=O)Nc2cccc([N+](=O)[O-])c2)c([O-])c1O ZINC000181763806 625213366 /nfs/dbraw/zinc/21/33/66/625213366.db2.gz FXMJDBPEWDDNHH-UHFFFAOYSA-N -1 3 288.259 2.567 20 10 CFCDHM CCC[C@@H](NC(=O)c1cccc(O)c1[O-])C1CCC1 ZINC000325205420 625890189 /nfs/dbraw/zinc/89/01/89/625890189.db2.gz IWVNRBWEWHOJAQ-GFCCVEGCSA-N -1 3 263.337 2.796 20 10 CFCDHM CC[C@@H](N[C@H]1CCn2ccnc21)c1ccc(F)cc1[O-] ZINC000834831934 625890295 /nfs/dbraw/zinc/89/02/95/625890295.db2.gz LTTHTTJJTDVCKI-OLZOCXBDSA-N -1 3 275.327 2.914 20 10 CFCDHM O=C(NCc1c([O-])cccc1F)N[C@@H]1CCCC12CC2 ZINC000923508676 626477955 /nfs/dbraw/zinc/47/79/55/626477955.db2.gz LYEICNTYCGTAOG-CYBMUJFWSA-N -1 3 278.327 2.663 20 10 CFCDHM [O-]c1cccc(Cl)c1CN1CC(OCC(F)F)C1 ZINC000839138834 626528344 /nfs/dbraw/zinc/52/83/44/626528344.db2.gz UNEOMPZOTMYOLX-UHFFFAOYSA-N -1 3 277.698 2.512 20 10 CFCDHM [O-]c1c(F)cc(Cl)cc1CN[C@@H](CCO)c1ccco1 ZINC000769557541 627455837 /nfs/dbraw/zinc/45/58/37/627455837.db2.gz SFXVOQXOIATXLY-LBPRGKRZSA-N -1 3 299.729 2.991 20 10 CFCDHM COc1c([O-])c(CNc2ccc(C)cn2)ccc1[N+](=O)[O-] ZINC000774978516 627983141 /nfs/dbraw/zinc/98/31/41/627983141.db2.gz VENJPPASWLYFKP-UHFFFAOYSA-N -1 3 289.291 2.625 20 10 CFCDHM CC(C)N1CCN(Cc2cc(Cl)cc(F)c2[O-])CC1 ZINC000775647933 628049634 /nfs/dbraw/zinc/04/96/34/628049634.db2.gz IDUUKENCIAEBDU-UHFFFAOYSA-N -1 3 286.778 2.711 20 10 CFCDHM CCC1(O)CCN(Cc2cc(Cl)cc(F)c2[O-])CC1 ZINC000775716792 628058326 /nfs/dbraw/zinc/05/83/26/628058326.db2.gz GLZYISVUBXCSND-UHFFFAOYSA-N -1 3 287.762 2.922 20 10 CFCDHM O=C(N[C@@H]1C[C@@H]1C1CCCCC1)c1cccc(O)c1[O-] ZINC000776663084 628167146 /nfs/dbraw/zinc/16/71/46/628167146.db2.gz FKRCCBDHRDZXML-CHWSQXEVSA-N -1 3 275.348 2.796 20 10 CFCDHM CC(=O)c1cc(F)cc(CN2CC[C@H](C)[C@@H](F)C2)c1[O-] ZINC000778239813 628291117 /nfs/dbraw/zinc/29/11/17/628291117.db2.gz VBVBPDKIMDNWGM-XPTSAGLGSA-N -1 3 283.318 2.914 20 10 CFCDHM Cc1ccc(C(=O)Nc2scnc2C2CC2)c([O-])c1O ZINC000780996362 628511624 /nfs/dbraw/zinc/51/16/24/628511624.db2.gz CFKZNHWGEKPSNX-UHFFFAOYSA-N -1 3 290.344 2.992 20 10 CFCDHM COC(=O)[C@@H](NCc1cc(F)ccc1[O-])c1cccs1 ZINC000789573385 629167528 /nfs/dbraw/zinc/16/75/28/629167528.db2.gz WPDMJKZLZGUYON-ZDUSSCGKSA-N -1 3 295.335 2.597 20 10 CFCDHM CCC[C@H](NC(=O)c1cccc(O)c1[O-])c1ccccn1 ZINC000790647866 629254772 /nfs/dbraw/zinc/25/47/72/629254772.db2.gz CICKCRVJCQEESO-ZDUSSCGKSA-N -1 3 286.331 2.764 20 10 CFCDHM O=C(NC1(c2ccccc2)CC1)c1cccc(O)c1[O-] ZINC000790673492 629256844 /nfs/dbraw/zinc/25/68/44/629256844.db2.gz WBTCCRGQTHXVID-UHFFFAOYSA-N -1 3 269.300 2.517 20 10 CFCDHM O=C(N[C@@H]1CSc2ccccc21)c1cccc(O)c1[O-] ZINC000790739530 629259246 /nfs/dbraw/zinc/25/92/46/629259246.db2.gz DBTOVQJPMBSLFN-LLVKDONJSA-N -1 3 287.340 2.675 20 10 CFCDHM CC(C)[C@H](NC(=O)c1cccc(O)c1[O-])c1ccccn1 ZINC000790754627 629260018 /nfs/dbraw/zinc/26/00/18/629260018.db2.gz QTAXJBHFDCELAH-AWEZNQCLSA-N -1 3 286.331 2.620 20 10 CFCDHM CC[C@@H](C)n1ncc(NC(=O)c2cccc(O)c2[O-])c1C ZINC000791569037 629334636 /nfs/dbraw/zinc/33/46/36/629334636.db2.gz PVAKGISWFOABET-SECBINFHSA-N -1 3 289.335 2.826 20 10 CFCDHM C[C@H]1CN(Cc2c([O-])ccc(Cl)c2F)[C@@H](C)CN1C ZINC000792173853 629405362 /nfs/dbraw/zinc/40/53/62/629405362.db2.gz DPMCGKGFLXKNHX-UWVGGRQHSA-N -1 3 286.778 2.709 20 10 CFCDHM CC1(C)CN(Cc2c([O-])ccc(Cl)c2F)CC[C@@H]1O ZINC000792178364 629405484 /nfs/dbraw/zinc/40/54/84/629405484.db2.gz DBIFUFARJYVWTL-LBPRGKRZSA-N -1 3 287.762 2.778 20 10 CFCDHM O=C(c1cccc(O)c1[O-])N1CCCc2ccccc2CC1 ZINC000836922681 630917933 /nfs/dbraw/zinc/91/79/33/630917933.db2.gz PPGBBHMCUOYXPH-UHFFFAOYSA-N -1 3 297.354 2.729 20 10 CFCDHM O=C1NCc2c1cccc2NCc1c([O-])cccc1Cl ZINC000808419534 630989508 /nfs/dbraw/zinc/98/95/08/630989508.db2.gz JEIBEIWVBGWTQZ-UHFFFAOYSA-N -1 3 288.734 2.901 20 10 CFCDHM CCCN(CC(=O)OC)Cc1c([O-])cc(C)cc1Cl ZINC000840907345 631258672 /nfs/dbraw/zinc/25/86/72/631258672.db2.gz CXJPRYFTAGKVCU-UHFFFAOYSA-N -1 3 285.771 2.739 20 10 CFCDHM C[C@@H]1CO[C@H](C(F)(F)F)CN1Cc1cc(F)ccc1[O-] ZINC000809696122 631266591 /nfs/dbraw/zinc/26/65/91/631266591.db2.gz CLWSJIFBPLUODX-PELKAZGASA-N -1 3 293.260 2.683 20 10 CFCDHM CCOCCOC1CN(Cc2c([O-])cc(C)cc2Cl)C1 ZINC000840936321 631269261 /nfs/dbraw/zinc/26/92/61/631269261.db2.gz JIZOZKREQUOAKD-UHFFFAOYSA-N -1 3 299.798 2.591 20 10 CFCDHM COC[C@@H]1CN(Cc2c([O-])cc(C)cc2Cl)C[C@@H](C)O1 ZINC000840940411 631271662 /nfs/dbraw/zinc/27/16/62/631271662.db2.gz YRBHYUGIGFMSGC-NEPJUHHUSA-N -1 3 299.798 2.590 20 10 CFCDHM Cc1cc([O-])c(CN2CCO[C@H](C3CC3)C2)c(Cl)c1 ZINC000840939598 631272344 /nfs/dbraw/zinc/27/23/44/631272344.db2.gz ZSFUJHZRSOQAKH-HNNXBMFYSA-N -1 3 281.783 2.965 20 10 CFCDHM Cc1cc([O-])c(CN(CC(F)F)C[C@H](C)O)c(Cl)c1 ZINC000840950361 631279216 /nfs/dbraw/zinc/27/92/16/631279216.db2.gz JGMMLTQAYFRNJA-VIFPVBQESA-N -1 3 293.741 2.802 20 10 CFCDHM [O-]c1c(Cl)cc(Cl)cc1CNCc1cncnc1 ZINC000809775858 631287109 /nfs/dbraw/zinc/28/71/09/631287109.db2.gz MDGXKTSJGFTXPC-UHFFFAOYSA-N -1 3 284.146 2.779 20 10 CFCDHM COc1ccc(CNCc2ccccc2CC(=O)[O-])cc1C ZINC000841795378 631472916 /nfs/dbraw/zinc/47/29/16/631472916.db2.gz QIJQFJFETPQKOY-UHFFFAOYSA-N -1 3 299.370 2.921 20 10 CFCDHM CC(C)(C)OC(=O)N1CCCN1Cc1cc(F)ccc1[O-] ZINC000811503106 631572773 /nfs/dbraw/zinc/57/27/73/631572773.db2.gz VLRSITSCNASPQU-UHFFFAOYSA-N -1 3 296.342 2.889 20 10 CFCDHM O=C(Nc1cc2c(cn1)CCCC2)c1cccc(O)c1[O-] ZINC000812735612 631765170 /nfs/dbraw/zinc/76/51/70/631765170.db2.gz DMLOFGUEYMOKHM-UHFFFAOYSA-N -1 3 284.315 2.624 20 10 CFCDHM Cc1cc([O-])c(CNCc2ccno2)c(Cl)c1 ZINC000843402393 631945506 /nfs/dbraw/zinc/94/55/06/631945506.db2.gz GUAKEEYNVNRTPS-UHFFFAOYSA-N -1 3 252.701 2.632 20 10 CFCDHM COC(=O)CN(Cc1ccc2ccccc2c1[O-])C1CC1 ZINC000816520410 632477965 /nfs/dbraw/zinc/47/79/65/632477965.db2.gz OHQQPFWMNSFRDP-UHFFFAOYSA-N -1 3 285.343 2.683 20 10 CFCDHM CC1(C)CN(Cc2cc(Cl)c(F)cc2[O-])CC[C@@H]1O ZINC000816586194 632490036 /nfs/dbraw/zinc/49/00/36/632490036.db2.gz CFVICAXQSCAMJH-ZDUSSCGKSA-N -1 3 287.762 2.778 20 10 CFCDHM C[C@@H]1CN(Cc2cccc(Br)c2[O-])[C@H]1C ZINC000816649323 632503841 /nfs/dbraw/zinc/50/38/41/632503841.db2.gz XLFWGMQWTBPXKJ-BDAKNGLRSA-N -1 3 270.170 2.995 20 10 CFCDHM Cc1ccc2[nH]c(NC(=O)c3ccc(C)c(O)c3[O-])nc2c1 ZINC000817018058 632546112 /nfs/dbraw/zinc/54/61/12/632546112.db2.gz MQPDTOMKAFZUNS-UHFFFAOYSA-N -1 3 297.314 2.843 20 10 CFCDHM C[C@@]1(CCNC(=O)c2cccc(O)c2[O-])C[C@@]1(F)Cl ZINC000846413023 632706688 /nfs/dbraw/zinc/70/66/88/632706688.db2.gz SFUIBNSXRSLAHD-OLZOCXBDSA-N -1 3 287.718 2.532 20 10 CFCDHM C[C@]1(CCNC(=O)c2cccc(O)c2[O-])C[C@]1(F)Cl ZINC000846413024 632706880 /nfs/dbraw/zinc/70/68/80/632706880.db2.gz SFUIBNSXRSLAHD-QWHCGFSZSA-N -1 3 287.718 2.532 20 10 CFCDHM Cc1cc(NC(=O)c2ccc(C)c(O)c2[O-])cn2ccnc12 ZINC000818058042 632793294 /nfs/dbraw/zinc/79/32/94/632793294.db2.gz ZLIQWMRPJYRGAC-UHFFFAOYSA-N -1 3 297.314 2.615 20 10 CFCDHM CCOc1ccc(C[NH2+]CC(CC)(CC)C(=O)[O-])c([O-])c1 ZINC000818631259 632884405 /nfs/dbraw/zinc/88/44/05/632884405.db2.gz DMSQITDSVUQYNQ-UHFFFAOYSA-N -1 3 295.379 2.772 20 10 CFCDHM Cc1noc([C@@H](C)N(C)Cc2cc(Cl)ccc2[O-])n1 ZINC000848925543 633408714 /nfs/dbraw/zinc/40/87/14/633408714.db2.gz HAFFBVAEFWBKRG-MRVPVSSYSA-N -1 3 281.743 2.930 20 10 CFCDHM Cc1cc([O-])c([C@@H]2NC3(CCCC3)C(=O)N2C)cc1Cl ZINC000849182012 633580310 /nfs/dbraw/zinc/58/03/10/633580310.db2.gz BQFCVVWLZSKQAR-CYBMUJFWSA-N -1 3 294.782 2.727 20 10 CFCDHM O=C(c1cccc(O)c1[O-])N1CC2CC1(c1ccccc1)C2 ZINC000856441548 635810866 /nfs/dbraw/zinc/81/08/66/635810866.db2.gz CFAGWYIYMMJFHW-UHFFFAOYSA-N -1 3 295.338 2.859 20 10 CFCDHM [O-]c1cccc(Br)c1CN1CC(C(F)F)C1 ZINC000862389823 637351718 /nfs/dbraw/zinc/35/17/18/637351718.db2.gz PBYLZJREVIMQQV-UHFFFAOYSA-N -1 3 292.123 2.852 20 10 CFCDHM Cc1cc(Cl)cc(C[N@@H+]2CC[C@@H](C(=O)[O-])[C@@H](C)C2)c1[O-] ZINC000863739009 637765710 /nfs/dbraw/zinc/76/57/10/637765710.db2.gz GSMUEMFZXFSKQA-GXFFZTMASA-N -1 3 297.782 2.897 20 10 CFCDHM Cc1cc(Cl)cc(C[N@H+]2CC[C@@H](C(=O)[O-])[C@@H](C)C2)c1[O-] ZINC000863739009 637765717 /nfs/dbraw/zinc/76/57/17/637765717.db2.gz GSMUEMFZXFSKQA-GXFFZTMASA-N -1 3 297.782 2.897 20 10 CFCDHM CC(C)OC1CCC(NC(=O)c2cccc(O)c2[O-])CC1 ZINC000193146239 650627738 /nfs/dbraw/zinc/62/77/38/650627738.db2.gz CQWZIRSMKLDKEZ-UHFFFAOYSA-N -1 3 293.363 2.564 20 10 CFCDHM C[C@@H]1SCCN(Cc2ccc(F)c(F)c2[O-])[C@H]1C ZINC000876751075 642994198 /nfs/dbraw/zinc/99/41/98/642994198.db2.gz UGAVRKVZALBVCX-IUCAKERBSA-N -1 3 273.348 2.996 20 10 CFCDHM CN(Cc1cccn1C)Cc1ccc(F)c(F)c1[O-] ZINC000876757672 642996641 /nfs/dbraw/zinc/99/66/41/642996641.db2.gz CLTRJEODOFVXIH-UHFFFAOYSA-N -1 3 266.291 2.641 20 10 CFCDHM CCCCC[C@@H](C)NC(=O)c1cccc(O)c1[O-] ZINC000126297583 643109392 /nfs/dbraw/zinc/10/93/92/643109392.db2.gz DOJWKYAYNSGWFY-SNVBAGLBSA-N -1 3 251.326 2.796 20 10 CFCDHM CC(C)c1csc(NC(=O)c2cccc(O)c2[O-])n1 ZINC000126307491 643112292 /nfs/dbraw/zinc/11/22/92/643112292.db2.gz RGGVUEIGMCCDBF-UHFFFAOYSA-N -1 3 278.333 2.930 20 10 CFCDHM CC(C)CN(C(=O)c1cccc(O)c1[O-])C(C)C ZINC000126335859 643151630 /nfs/dbraw/zinc/15/16/30/643151630.db2.gz ZDQXHHFXAVWVIP-UHFFFAOYSA-N -1 3 251.326 2.604 20 10 CFCDHM C[C@@H]1CCCC[C@@H]1CNC(=O)c1cccc(O)c1[O-] ZINC000126346107 643153415 /nfs/dbraw/zinc/15/34/15/643153415.db2.gz VKBPLVAFCNIYFO-GHMZBOCLSA-N -1 3 263.337 2.654 20 10 CFCDHM C[C@@H](CCc1ccccc1)NC(=O)c1cccc(O)c1[O-] ZINC000126351041 643155722 /nfs/dbraw/zinc/15/57/22/643155722.db2.gz YMDMBZYTKKUUJE-LBPRGKRZSA-N -1 3 285.343 2.849 20 10 CFCDHM C[C@@H](CNC(=O)c1cccc(O)c1[O-])c1ccccc1 ZINC000126539990 643290310 /nfs/dbraw/zinc/29/03/10/643290310.db2.gz ZPXLNFVQRGAZGK-NSHDSACASA-N -1 3 271.316 2.631 20 10 CFCDHM CC[C@H]1CCCCCN1C(=O)c1cccc(O)c1[O-] ZINC000126540656 643290732 /nfs/dbraw/zinc/29/07/32/643290732.db2.gz LBZPSNHNMAOCMS-NSHDSACASA-N -1 3 263.337 2.893 20 10 CFCDHM COCC1(C2CCC2)CN(Cc2ccc(F)c(F)c2[O-])C1 ZINC000877624434 643410015 /nfs/dbraw/zinc/41/00/15/643410015.db2.gz BEUVBOYCMLLRTH-UHFFFAOYSA-N -1 3 297.345 2.919 20 10 CFCDHM CC1(C)C[C@@H](O)CN(Cc2c([O-])ccc(Cl)c2F)C1 ZINC000877751320 643527794 /nfs/dbraw/zinc/52/77/94/643527794.db2.gz BJVBLJZNMXCIDF-SECBINFHSA-N -1 3 287.762 2.778 20 10 CFCDHM CC(=O)c1cc(F)cc(CN2OC3CCC2CC3)c1[O-] ZINC000879799164 644429534 /nfs/dbraw/zinc/42/95/34/644429534.db2.gz AGKUPVKIJMNUHJ-UHFFFAOYSA-N -1 3 279.311 2.792 20 10 CFCDHM Cc1cc([N-]S(=O)(=O)c2ccc(F)c(C)c2)ccc1O ZINC000136492830 646841243 /nfs/dbraw/zinc/84/12/43/646841243.db2.gz JEAJLDUEOTZISC-UHFFFAOYSA-N -1 3 295.335 2.949 20 10 CFCDHM C[C@@H](N[C@@H](CO)c1ccccc1)c1c([O-])cccc1F ZINC000886540939 647037888 /nfs/dbraw/zinc/03/78/88/647037888.db2.gz NEIKTOPTLJCQJA-RISCZKNCSA-N -1 3 275.323 2.916 20 10 CFCDHM C[C@H](N[C@H]1CCn2ccnc21)c1c([O-])cccc1F ZINC000886615415 647068947 /nfs/dbraw/zinc/06/89/47/647068947.db2.gz FUIDKPFOKCPHHL-ONGXEEELSA-N -1 3 261.300 2.523 20 10 CFCDHM C[C@H](N[C@@H](C)c1c([O-])cccc1F)c1ccnn1C ZINC000886648079 647087304 /nfs/dbraw/zinc/08/73/04/647087304.db2.gz LDEAZTBRSLVWMN-UWVGGRQHSA-N -1 3 263.316 2.677 20 10 CFCDHM CCn1ccc(NCc2c([O-])cccc2Cl)n1 ZINC000302370848 647406311 /nfs/dbraw/zinc/40/63/11/647406311.db2.gz ZRKZXURSJOZENY-UHFFFAOYSA-N -1 3 251.717 2.874 20 10 CFCDHM C[C@H]1C[C@@H](NC(=O)NCc2c([O-])cccc2F)CCS1 ZINC000927228548 648741438 /nfs/dbraw/zinc/74/14/38/648741438.db2.gz PUWSVSDTUPILMP-UWVGGRQHSA-N -1 3 298.383 2.615 20 10 CFCDHM C[C@H]1CCC[C@@H](C(=O)NCc2c([O-])cccc2F)C1 ZINC000928705201 648943952 /nfs/dbraw/zinc/94/39/52/648943952.db2.gz HFCLIAAQGYQBTH-WDEREUQCSA-N -1 3 265.328 2.974 20 10 CFCDHM CC(C)(C(=O)NCc1c([O-])cccc1F)C1CCC1 ZINC000928705323 648944750 /nfs/dbraw/zinc/94/47/50/648944750.db2.gz GMHHRHGMBYIDLG-UHFFFAOYSA-N -1 3 265.328 2.974 20 10 CFCDHM CO[C@@H]1CCC[C@H](CC(=O)NCc2c([O-])cccc2F)C1 ZINC000928707755 648945309 /nfs/dbraw/zinc/94/53/09/648945309.db2.gz HTGWZOJMQIWSQV-NWDGAFQWSA-N -1 3 295.354 2.743 20 10 CFCDHM O=C(NCc1c([O-])cccc1F)[C@@]12C[C@@H]1CCCC2 ZINC000928710977 648946471 /nfs/dbraw/zinc/94/64/71/648946471.db2.gz YVBQXILAXMQWDS-BONVTDFDSA-N -1 3 263.312 2.728 20 10 CFCDHM C[C@H](CC(=O)NCc1c([O-])cccc1F)c1ccco1 ZINC000928712689 648946701 /nfs/dbraw/zinc/94/67/01/648946701.db2.gz UIDUSVAMFDMIOM-SNVBAGLBSA-N -1 3 277.295 2.934 20 10 CFCDHM CC(=O)c1cc(F)cc(CN2CC[C@H]2C(F)F)c1[O-] ZINC000931424661 649424085 /nfs/dbraw/zinc/42/40/85/649424085.db2.gz MRAGDWXDLQAYNV-NSHDSACASA-N -1 3 273.254 2.573 20 10 CFCDHM Cc1ccc(O)c(CNC(=O)c2cc([O-])ccc2Cl)c1 ZINC001167293898 770227337 /nfs/dbraw/zinc/22/73/37/770227337.db2.gz SZUPHMPJXYPCNR-UHFFFAOYSA-N -1 3 291.734 2.990 20 10 CFCDHM Cc1[nH]c(CN(C)Cc2ccccc2O)c(C)c1C(=O)[O-] ZINC001140497877 770765419 /nfs/dbraw/zinc/76/54/19/770765419.db2.gz VHCCVDXTMPZVHD-UHFFFAOYSA-N -1 3 288.347 2.667 20 10 CFCDHM CO[C@H]1CCN(Cc2c([O-])cc(F)cc2F)[C@H](C)C1 ZINC001140584647 770970663 /nfs/dbraw/zinc/97/06/63/770970663.db2.gz ACIHOIZFMAYEFY-KOLCDFICSA-N -1 3 271.307 2.670 20 10 CFCDHM CN(Cc1ccsc1)Cc1ccc(C(=O)[O-])cc1O ZINC001231452048 777222752 /nfs/dbraw/zinc/22/27/52/777222752.db2.gz BQEISWDMCZPWHB-UHFFFAOYSA-N -1 3 277.345 2.784 20 10 CFCDHM O=C([O-])c1ccc(C[N@@H+]2CCC[C@@H]3CCC[C@H]32)c([O-])c1 ZINC001231455915 777224009 /nfs/dbraw/zinc/22/40/09/777224009.db2.gz XLYDYYLCLPKJGF-SMDDNHRTSA-N -1 3 275.348 2.855 20 10 CFCDHM O=C([O-])c1ccc(C[N@H+]2CCC[C@@H]3CCC[C@H]32)c([O-])c1 ZINC001231455915 777224014 /nfs/dbraw/zinc/22/40/14/777224014.db2.gz XLYDYYLCLPKJGF-SMDDNHRTSA-N -1 3 275.348 2.855 20 10 CFCDHM O=C([O-])c1ccc([O-])c(C[N@H+]2C[C@H]3[C@H](CCC3(F)F)C2)c1 ZINC001231560746 777259692 /nfs/dbraw/zinc/25/96/92/777259692.db2.gz LKTWTAVLJKFQTD-PWSUYJOCSA-N -1 3 297.301 2.568 20 10 CFCDHM O=C([O-])c1ccc([O-])c(C[N@@H+]2C[C@H]3[C@H](CCC3(F)F)C2)c1 ZINC001231560746 777259701 /nfs/dbraw/zinc/25/97/01/777259701.db2.gz LKTWTAVLJKFQTD-PWSUYJOCSA-N -1 3 297.301 2.568 20 10 CFCDHM COC(=O)C1(C)CCN(Cc2cccc(Cl)c2[O-])CC1 ZINC001231912156 777381474 /nfs/dbraw/zinc/38/14/74/777381474.db2.gz WPMGGEUKPAAWQR-UHFFFAOYSA-N -1 3 297.782 2.821 20 10 CFCDHM COc1cc([O-])c(CN2CCC[C@@H]2CF)cc1Cl ZINC001232271234 777501036 /nfs/dbraw/zinc/50/10/36/777501036.db2.gz SFPBFZVUTYQPFV-SNVBAGLBSA-N -1 3 273.735 2.988 20 10 CFCDHM [O-]c1c(CN2CC[C@H]3CCCO[C@@H]3C2)ccc(F)c1F ZINC001233076037 777789312 /nfs/dbraw/zinc/78/93/12/777789312.db2.gz KEAYKKMNIOBXNU-ZWNOBZJWSA-N -1 3 283.318 2.671 20 10 CFCDHM [O-]c1ccc(F)c(F)c1CN1CC[C@@]2(C1)CCCCO2 ZINC001233332541 777890178 /nfs/dbraw/zinc/89/01/78/777890178.db2.gz OOBGSEDNSWMOJG-OAHLLOKOSA-N -1 3 283.318 2.815 20 10 CFCDHM CCO[C@H]1CCCN(Cc2c([O-])ccc(F)c2F)C1 ZINC001233334884 777893384 /nfs/dbraw/zinc/89/33/84/777893384.db2.gz YIESXILKMKJLMB-JTQLQIEISA-N -1 3 271.307 2.671 20 10 CFCDHM CCCCCN1CCN(Cc2c([O-])ccc(F)c2F)CC1 ZINC001233334314 777894409 /nfs/dbraw/zinc/89/44/09/777894409.db2.gz BLTYCBOLDORRLS-UHFFFAOYSA-N -1 3 298.377 2.978 20 10 CFCDHM [O-]c1ccc(F)c(F)c1CN1CCC(n2ccnc2)CC1 ZINC001233335425 777894783 /nfs/dbraw/zinc/89/47/83/777894783.db2.gz UTKPNNWAARNIRD-UHFFFAOYSA-N -1 3 293.317 2.704 20 10 CFCDHM [O-]c1c(CN(C2CC2)C2COC2)cccc1C(F)(F)F ZINC001233418336 777943819 /nfs/dbraw/zinc/94/38/19/777943819.db2.gz BYCQFNDIKBZHGR-UHFFFAOYSA-N -1 3 287.281 2.774 20 10 CFCDHM C[C@H]1CC(=O)CCN1Cc1ccc(C(F)(F)F)cc1[O-] ZINC001233451874 777958291 /nfs/dbraw/zinc/95/82/91/777958291.db2.gz CGADJHGWXKGBND-VIFPVBQESA-N -1 3 287.281 2.964 20 10 CFCDHM CN(Cc1cnccn1)Cc1ccc(C(F)(F)F)cc1[O-] ZINC001233454299 777959157 /nfs/dbraw/zinc/95/91/57/777959157.db2.gz OZYPSGZHPMTGJT-UHFFFAOYSA-N -1 3 297.280 2.833 20 10 CFCDHM [O-]c1cc(C(F)(F)F)ccc1CN1CCn2cncc2C1 ZINC001233454813 777960096 /nfs/dbraw/zinc/96/00/96/777960096.db2.gz KVTZMXUXIMYGCV-UHFFFAOYSA-N -1 3 297.280 2.623 20 10 CFCDHM CCO[C@H]1CCCN(Cc2cc(F)c(F)cc2[O-])C1 ZINC001142520109 778399262 /nfs/dbraw/zinc/39/92/62/778399262.db2.gz BKLYCKMBEUCRCZ-NSHDSACASA-N -1 3 271.307 2.671 20 10 CFCDHM O=C(N[C@@H]1CCCC2(CC2)C1)c1cccc(O)c1[O-] ZINC000696165055 778856813 /nfs/dbraw/zinc/85/68/13/778856813.db2.gz VYXMCQKWYGQKMM-SNVBAGLBSA-N -1 3 261.321 2.550 20 10 CFCDHM COc1cc([O-])c(CN2CCn3cccc3C2)c(Cl)c1 ZINC001236798814 778943471 /nfs/dbraw/zinc/94/34/71/778943471.db2.gz IMVFNNSLSOOIJX-UHFFFAOYSA-N -1 3 292.766 2.872 20 10 CFCDHM COC[C@H]1CCN1Cc1cc(Cl)c(Cl)cc1[O-] ZINC001236805222 778946245 /nfs/dbraw/zinc/94/62/45/778946245.db2.gz XROGGFUDBFYYQK-SECBINFHSA-N -1 3 276.163 2.920 20 10 CFCDHM COc1cc([O-])c(CN2CC(C(F)F)C2)c(Cl)c1 ZINC001236806201 778946618 /nfs/dbraw/zinc/94/66/18/778946618.db2.gz QCPZAEMKAAYBRB-UHFFFAOYSA-N -1 3 277.698 2.751 20 10 CFCDHM COc1cc([O-])c(CN2CC=CC2)c(Br)c1 ZINC001237062909 779002641 /nfs/dbraw/zinc/00/26/41/779002641.db2.gz OZXYYPQNYGSZAW-UHFFFAOYSA-N -1 3 284.153 2.535 20 10 CFCDHM C[C@@H]1CN(Cc2c([O-])ccc(Cl)c2Cl)CC[C@H]1O ZINC001237078361 779006378 /nfs/dbraw/zinc/00/63/78/779006378.db2.gz QAMABOSWIZPMKX-LDYMZIIASA-N -1 3 290.190 2.902 20 10 CFCDHM CN(Cc1c([O-])ccc(Cl)c1Cl)[C@@H]1CCOC1 ZINC001237083057 779006614 /nfs/dbraw/zinc/00/66/14/779006614.db2.gz XOBJHVFRQFXOEE-MRVPVSSYSA-N -1 3 276.163 2.920 20 10 CFCDHM C[C@H]1CN(Cc2c([O-])ccc(Cl)c2Cl)CC[C@H]1O ZINC001237078358 779007036 /nfs/dbraw/zinc/00/70/36/779007036.db2.gz QAMABOSWIZPMKX-GZMMTYOYSA-N -1 3 290.190 2.902 20 10 CFCDHM CN(Cc1c([O-])ccc(F)c1Cl)[C@@H]1CCCOC1 ZINC001237125289 779018565 /nfs/dbraw/zinc/01/85/65/779018565.db2.gz CEUJYJUCSIKMLX-SECBINFHSA-N -1 3 273.735 2.796 20 10 CFCDHM [O-]c1ccc(F)c(Cl)c1CN1CC[C@@H]2CCO[C@H]2C1 ZINC001237124392 779018809 /nfs/dbraw/zinc/01/88/09/779018809.db2.gz PAIRWTYZGTYOGI-RNCFNFMXSA-N -1 3 285.746 2.796 20 10 CFCDHM [O-]c1ccc(F)c(Cl)c1CN1CCCC[C@@H]1CO ZINC001237122279 779019216 /nfs/dbraw/zinc/01/92/16/779019216.db2.gz SSGGUMHPHKIBOK-SECBINFHSA-N -1 3 273.735 2.532 20 10 CFCDHM [O-]c1ccc(F)c(Cl)c1CN1CCSCC1 ZINC001237125035 779020100 /nfs/dbraw/zinc/02/01/00/779020100.db2.gz VHPNDTGKGFAQPG-UHFFFAOYSA-N -1 3 261.749 2.734 20 10 CFCDHM C[C@H]1C[C@H](O)CCN1Cc1cc(Cl)cc(F)c1[O-] ZINC001237622600 779147244 /nfs/dbraw/zinc/14/72/44/779147244.db2.gz VGASCDIKHLAZTF-GZMMTYOYSA-N -1 3 273.735 2.530 20 10 CFCDHM CCN1CCN(Cc2cc(F)cc(Cl)c2[O-])[C@H](C)C1 ZINC001237801254 779181311 /nfs/dbraw/zinc/18/13/11/779181311.db2.gz GBRXRYYELVSYIO-SNVBAGLBSA-N -1 3 286.778 2.711 20 10 CFCDHM CC(C)N1CCN(Cc2cc(F)cc(Cl)c2[O-])CC1 ZINC001237807511 779184400 /nfs/dbraw/zinc/18/44/00/779184400.db2.gz KWYOFBSGRLTDKV-UHFFFAOYSA-N -1 3 286.778 2.711 20 10 CFCDHM CC(=O)[C@H]1CCCN(Cc2cc(F)c(Cl)cc2[O-])C1 ZINC001237950602 779214177 /nfs/dbraw/zinc/21/41/77/779214177.db2.gz XJQUSRZRYGBQHB-JTQLQIEISA-N -1 3 285.746 2.986 20 10 CFCDHM CC(=O)[C@@H]1CCCN(Cc2cc(F)c(Cl)cc2[O-])C1 ZINC001237950603 779214299 /nfs/dbraw/zinc/21/42/99/779214299.db2.gz XJQUSRZRYGBQHB-SNVBAGLBSA-N -1 3 285.746 2.986 20 10 CFCDHM C[C@@H](NCc1c([O-])cccc1Br)C(F)F ZINC000706868870 781206850 /nfs/dbraw/zinc/20/68/50/781206850.db2.gz TVLYXHBGWQNJJI-ZCFIWIBFSA-N -1 3 280.112 2.898 20 10 CFCDHM CO[C@@H]1CC[C@@H](C)N(Cc2cc(F)cc(F)c2[O-])C1 ZINC000708414216 781273877 /nfs/dbraw/zinc/27/38/77/781273877.db2.gz PKUOOBTWVOFSDV-BXKDBHETSA-N -1 3 271.307 2.670 20 10 CFCDHM CC(C)(C)C1CCN(C(=O)c2cccc(O)c2[O-])CC1 ZINC000126372732 377223857 /nfs/dbraw/zinc/22/38/57/377223857.db2.gz IHQUXIFOJVIGRD-UHFFFAOYSA-N -1 3 277.364 2.996 20 10 CFCDHM CCOCCN(C)Cc1cc(Cl)cc(C(C)=O)c1[O-] ZINC000127392226 377279019 /nfs/dbraw/zinc/27/90/19/377279019.db2.gz KTHGCWSLMDJFED-UHFFFAOYSA-N -1 3 285.771 2.717 20 10 CFCDHM CC(C)N(Cc1cc2c(cc1[O-])OCO2)CC(F)F ZINC000130876431 377624742 /nfs/dbraw/zinc/62/47/42/377624742.db2.gz HEMUWOAKRRTZAZ-UHFFFAOYSA-N -1 3 273.279 2.596 20 10 CFCDHM CCN(Cc1cc(Br)ccc1[O-])C(C)=O ZINC000175844107 380142884 /nfs/dbraw/zinc/14/28/84/380142884.db2.gz LVQQOHGJMDWBMM-UHFFFAOYSA-N -1 3 272.142 2.523 20 10 CFCDHM CC[C@@H]1CN(Cc2cc(F)cc(C(C)=O)c2[O-])C[C@H](C)O1 ZINC000175665723 380108543 /nfs/dbraw/zinc/10/85/43/380108543.db2.gz IPDQSUYFRPUTBB-IINYFYTJSA-N -1 3 295.354 2.733 20 10 CFCDHM CC[C@H]1CN(Cc2cc(F)cc(C(C)=O)c2[O-])C[C@H](C)O1 ZINC000175665743 380109405 /nfs/dbraw/zinc/10/94/05/380109405.db2.gz IPDQSUYFRPUTBB-HZMBPMFUSA-N -1 3 295.354 2.733 20 10 CFCDHM CS[C@H]1CCC[C@H](NC(=O)c2ccc(C)c(O)c2[O-])C1 ZINC000177686753 380367403 /nfs/dbraw/zinc/36/74/03/380367403.db2.gz RZQQHLMFAGOXJQ-QWRGUYRKSA-N -1 3 295.404 2.810 20 10 CFCDHM [O-]c1ccc(F)cc1CN1CCc2nc(C3CC3)ncc2C1 ZINC000529666556 383745435 /nfs/dbraw/zinc/74/54/35/383745435.db2.gz VWBCYXNFJAOYLB-UHFFFAOYSA-N -1 3 299.349 2.757 20 10 CFCDHM CCN(CC(C)C)C(=O)c1ccc(C)c(O)c1[O-] ZINC000179424792 380541599 /nfs/dbraw/zinc/54/15/99/380541599.db2.gz TYMWEGVZAHQYKY-UHFFFAOYSA-N -1 3 251.326 2.524 20 10 CFCDHM Cc1ccc(C(=O)N([C@@H](C)C2CC2)C2CC2)c([O-])c1O ZINC000179457080 380545357 /nfs/dbraw/zinc/54/53/57/380545357.db2.gz MSQWGGWGURPFAD-JTQLQIEISA-N -1 3 275.348 2.809 20 10 CFCDHM Cc1ccc(C(=O)N2CCC[C@@H]3CCC[C@H]32)c([O-])c1O ZINC000179519984 380552276 /nfs/dbraw/zinc/55/22/76/380552276.db2.gz KEQPEFZCJFPVFD-WCQYABFASA-N -1 3 275.348 2.811 20 10 CFCDHM Cc1ccc(C(=O)N2CCC[C@@H]3CCC[C@@H]32)c([O-])c1O ZINC000179519963 380552717 /nfs/dbraw/zinc/55/27/17/380552717.db2.gz KEQPEFZCJFPVFD-AAEUAGOBSA-N -1 3 275.348 2.811 20 10 CFCDHM [O-]c1ccccc1CN1CCCC[C@@H]1c1ncc[nH]1 ZINC000179566303 380558870 /nfs/dbraw/zinc/55/88/70/380558870.db2.gz OKFKVXJISDCFAX-CYBMUJFWSA-N -1 3 257.337 2.843 20 10 CFCDHM [O-]c1ccc(F)cc1CN1CCO[C@H](c2ccco2)C1 ZINC000180243283 380638463 /nfs/dbraw/zinc/63/84/63/380638463.db2.gz VYBXPPAJZLWABW-HNNXBMFYSA-N -1 3 277.295 2.698 20 10 CFCDHM Cc1ccc(C(=O)N2CCC(C(C)C)CC2)c([O-])c1O ZINC000182513522 381105120 /nfs/dbraw/zinc/10/51/20/381105120.db2.gz JVUDSJHDVNLMLO-UHFFFAOYSA-N -1 3 277.364 2.914 20 10 CFCDHM Cc1ccc(C(=O)N2C[C@@H](C)CC[C@H]2C)c([O-])c1O ZINC000182534500 381106609 /nfs/dbraw/zinc/10/66/09/381106609.db2.gz JPBCNPMGPSSAIL-GXSJLCMTSA-N -1 3 263.337 2.667 20 10 CFCDHM Cc1cnc([C@@H](C)NC(=O)c2ccc(C)c(O)c2[O-])s1 ZINC000182566157 381114071 /nfs/dbraw/zinc/11/40/71/381114071.db2.gz JVLMEJMOPMTTRW-SECBINFHSA-N -1 3 292.360 2.662 20 10 CFCDHM Cc1ccc(C(=O)N2CC[C@@H](C)[C@@H](C)C2)c([O-])c1O ZINC000182964970 381191228 /nfs/dbraw/zinc/19/12/28/381191228.db2.gz VJUOADXRHMLUPQ-KOLCDFICSA-N -1 3 263.337 2.524 20 10 CFCDHM COc1cc(Cl)cc(CN2CCO[C@H](C)[C@@H]2C)c1[O-] ZINC000184694282 381462807 /nfs/dbraw/zinc/46/28/07/381462807.db2.gz FTNALIUTKIMRFU-VHSXEESVSA-N -1 3 285.771 2.663 20 10 CFCDHM C[C@H](NCc1ccnn1C)c1cc(Cl)ccc1[O-] ZINC000184996157 381507128 /nfs/dbraw/zinc/50/71/28/381507128.db2.gz UABKFTWDQDGANX-VIFPVBQESA-N -1 3 265.744 2.630 20 10 CFCDHM C[C@@H](N[C@@H](C)c1cc(Cl)ccc1[O-])C(=O)NC(C)(C)C ZINC000185217842 381566380 /nfs/dbraw/zinc/56/63/80/381566380.db2.gz GJQYZEZTJJDIGY-VHSXEESVSA-N -1 3 298.814 2.999 20 10 CFCDHM COCC1=CCN(Cc2cc(F)cc(C(C)=O)c2[O-])CC1 ZINC000185893833 381771912 /nfs/dbraw/zinc/77/19/12/381771912.db2.gz YJYMTUMFMAFDPZ-UHFFFAOYSA-N -1 3 293.338 2.512 20 10 CFCDHM C[C@H](NCc1cccc(N(C)C)n1)c1ccc(F)cc1[O-] ZINC000186179223 381843568 /nfs/dbraw/zinc/84/35/68/381843568.db2.gz HCJAJDLUIQNGHC-NSHDSACASA-N -1 3 289.354 2.843 20 10 CFCDHM C[C@@H](N[C@H](CCO)c1ccco1)c1cc(F)ccc1[O-] ZINC000186534899 381939823 /nfs/dbraw/zinc/93/98/23/381939823.db2.gz QXIRLINVESHVGI-ZWNOBZJWSA-N -1 3 279.311 2.899 20 10 CFCDHM CO[C@@H]1CCCN(Cc2cc(F)cc(C(C)=O)c2[O-])CC1 ZINC000374690724 382052760 /nfs/dbraw/zinc/05/27/60/382052760.db2.gz BNHZOIQFOYPTCH-CQSZACIVSA-N -1 3 295.354 2.735 20 10 CFCDHM [O-]c1ccccc1CN1CCOC[C@@H]1c1ccccc1 ZINC000374898740 382058837 /nfs/dbraw/zinc/05/88/37/382058837.db2.gz RJMYWQCSAUQAHZ-MRXNPFEDSA-N -1 3 269.344 2.966 20 10 CFCDHM [O-]c1ccccc1CN1CCOC[C@H]1c1ccccc1 ZINC000374898733 382059430 /nfs/dbraw/zinc/05/94/30/382059430.db2.gz RJMYWQCSAUQAHZ-INIZCTEOSA-N -1 3 269.344 2.966 20 10 CFCDHM [O-]c1ccc(F)cc1CN1CCOC2(CCCC2)C1 ZINC000376822945 382178792 /nfs/dbraw/zinc/17/87/92/382178792.db2.gz MLBIWTSLSJLXFN-UHFFFAOYSA-N -1 3 265.328 2.676 20 10 CFCDHM O=C(c1cccc(O)c1[O-])N1CC2(CC2)c2ccccc21 ZINC000376558195 382146079 /nfs/dbraw/zinc/14/60/79/382146079.db2.gz WTDDFEJKKWCKCH-UHFFFAOYSA-N -1 3 281.311 2.790 20 10 CFCDHM CCc1nc([C@@H](C)NC(=O)c2cccc(O)c2[O-])cs1 ZINC000187513559 382200110 /nfs/dbraw/zinc/20/01/10/382200110.db2.gz FSRRFNPINQVPQW-MRVPVSSYSA-N -1 3 292.360 2.608 20 10 CFCDHM CC1(CO)CCN(Cc2cc(Cl)c(F)cc2[O-])CC1 ZINC000293657204 382219028 /nfs/dbraw/zinc/21/90/28/382219028.db2.gz PFZVDMSUOLSHKG-UHFFFAOYSA-N -1 3 287.762 2.779 20 10 CFCDHM [O-]c1ccc(F)cc1CN1CCOc2cc(O)ccc2C1 ZINC000377710193 382327509 /nfs/dbraw/zinc/32/75/09/382327509.db2.gz WBQNQDIXMJVEBR-UHFFFAOYSA-N -1 3 289.306 2.632 20 10 CFCDHM CCCN(Cc1nn(CC)nc1C)Cc1ccccc1[O-] ZINC000294733006 382526934 /nfs/dbraw/zinc/52/69/34/382526934.db2.gz GWXQVYKSKLIVSL-UHFFFAOYSA-N -1 3 288.395 2.724 20 10 CFCDHM CC(C)c1nnc(CNCc2cccc(Cl)c2[O-])[nH]1 ZINC000294762654 382527153 /nfs/dbraw/zinc/52/71/53/382527153.db2.gz JFJGTBWUMHLPJT-UHFFFAOYSA-N -1 3 280.759 2.577 20 10 CFCDHM CC(C)c1nc(CNCc2cccc(Cl)c2[O-])n[nH]1 ZINC000294762654 382527158 /nfs/dbraw/zinc/52/71/58/382527158.db2.gz JFJGTBWUMHLPJT-UHFFFAOYSA-N -1 3 280.759 2.577 20 10 CFCDHM [O-]c1c(Cl)cccc1CN1CCC[C@@]12CCOC2 ZINC000367048724 382556120 /nfs/dbraw/zinc/55/61/20/382556120.db2.gz XZRBCPKSQJNJQO-AWEZNQCLSA-N -1 3 267.756 2.801 20 10 CFCDHM [O-]c1c(Cl)cccc1CN1CCC[C@]12CCOC2 ZINC000367048725 382556820 /nfs/dbraw/zinc/55/68/20/382556820.db2.gz XZRBCPKSQJNJQO-CQSZACIVSA-N -1 3 267.756 2.801 20 10 CFCDHM CC1(O)CCN(Cc2cc(Cl)c(F)cc2[O-])CC1 ZINC000295321508 382616623 /nfs/dbraw/zinc/61/66/23/382616623.db2.gz LKMJGQLMQRLEBF-UHFFFAOYSA-N -1 3 273.735 2.532 20 10 CFCDHM CCN(Cc1cccc(Cl)c1[O-])C[C@@H](O)C(F)(F)F ZINC000189876510 382643630 /nfs/dbraw/zinc/64/36/30/382643630.db2.gz ZAHLPFZUYJFHCR-SNVBAGLBSA-N -1 3 297.704 2.791 20 10 CFCDHM CCCCN(Cc1nonc1C)Cc1ccccc1[O-] ZINC000282330360 385285526 /nfs/dbraw/zinc/28/55/26/385285526.db2.gz AWHBVTZISGPBRX-UHFFFAOYSA-N -1 3 275.352 2.886 20 10 CFCDHM C[C@@H](O)[C@H]1CCN(Cc2cc(Cl)cc(Cl)c2[O-])C1 ZINC000272492134 385551579 /nfs/dbraw/zinc/55/15/79/385551579.db2.gz DXRVIPGVYURWLV-BDAKNGLRSA-N -1 3 290.190 2.902 20 10 CFCDHM CCNC(=O)[C@H](C)N[C@H](CC)c1cccc(Cl)c1[O-] ZINC000286867620 385727741 /nfs/dbraw/zinc/72/77/41/385727741.db2.gz HANSEDNNMJCJIE-JOYOIKCWSA-N -1 3 284.787 2.611 20 10 CFCDHM Cc1nnc([C@@H](C)N(C)Cc2ccccc2[O-])s1 ZINC000274547255 385821196 /nfs/dbraw/zinc/82/11/96/385821196.db2.gz WDTCZGKLOWRNSU-SECBINFHSA-N -1 3 263.366 2.745 20 10 CFCDHM C[C@H]1CCCC[C@H]1NC(=O)CN(C)Cc1ccccc1[O-] ZINC000109770312 393879340 /nfs/dbraw/zinc/87/93/40/393879340.db2.gz JWVNDAHBBGERQC-DZGCQCFKSA-N -1 3 290.407 2.519 20 10 CFCDHM C[C@@H]1CCN(C(=O)/C=C\c2cnccn2)c2c([O-])cccc21 ZINC000492568008 394071530 /nfs/dbraw/zinc/07/15/30/394071530.db2.gz RHESTTNDMRHUJK-FOQNGQEVSA-N -1 3 295.342 2.736 20 10 CFCDHM CCCCN(Cc1cc[nH]n1)Cc1ccccc1[O-] ZINC000283150385 394130216 /nfs/dbraw/zinc/13/02/16/394130216.db2.gz XODSWZSXFWSWAM-UHFFFAOYSA-N -1 3 259.353 2.918 20 10 CFCDHM Cc1cccc(S(=O)(=O)[N-]c2ccc(O)cc2)c1 ZINC000006416173 170199570 /nfs/dbraw/zinc/19/95/70/170199570.db2.gz JZDRNFQYSFXLMK-UHFFFAOYSA-N -1 3 263.318 2.501 20 10 CFCDHM C[C@@H]1CCOCCN1Cc1c([O-])ccc(Cl)c1F ZINC000367701182 267111069 /nfs/dbraw/zinc/11/10/69/267111069.db2.gz FPNDYRFAIBUMCK-SECBINFHSA-N -1 3 273.735 2.796 20 10 CFCDHM COc1cc(Cl)cc(CN2CCOCC[C@@H]2C)c1[O-] ZINC000367708011 267112236 /nfs/dbraw/zinc/11/22/36/267112236.db2.gz QDWQKWZWXVWDPV-JTQLQIEISA-N -1 3 285.771 2.665 20 10 CFCDHM C[C@H]1CCOCCN1Cc1c([O-])cccc1Cl ZINC000368131918 267146788 /nfs/dbraw/zinc/14/67/88/267146788.db2.gz OPLAGTGODJBEJW-JTQLQIEISA-N -1 3 255.745 2.656 20 10 CFCDHM [O-]c1c(Cl)cccc1CNCc1cnc2n1CCCC2 ZINC000368487892 267177899 /nfs/dbraw/zinc/17/78/99/267177899.db2.gz MBADGLZGEZPIMU-UHFFFAOYSA-N -1 3 291.782 2.868 20 10 CFCDHM Cn1cc2c(n1)CCC[C@H]2NCc1cccc(Cl)c1[O-] ZINC000283129068 294325717 /nfs/dbraw/zinc/32/57/17/294325717.db2.gz VYUIMDBBEOQBNY-CYBMUJFWSA-N -1 3 291.782 2.946 20 10 CFCDHM C[C@@H]1C[C@H]2CCCC[C@@H]2N1C(=O)c1cccc(O)c1[O-] ZINC000187100266 297481666 /nfs/dbraw/zinc/48/16/66/297481666.db2.gz BFSVGSOHRQQEHW-WZRBSPASSA-N -1 3 275.348 2.891 20 10 CFCDHM O=C(c1cccc(O)c1[O-])N1CCS[C@@H]2CCCC[C@@H]21 ZINC000193130429 304549260 /nfs/dbraw/zinc/54/92/60/304549260.db2.gz FYVBZUPMVKFQGP-WCQYABFASA-N -1 3 293.388 2.598 20 10 CFCDHM O=C(c1cccc(O)c1[O-])N1C[C@H]2CCCCC[C@H]21 ZINC000370492280 304549302 /nfs/dbraw/zinc/54/93/02/304549302.db2.gz PUGHLASQWUYGIS-ZYHUDNBSSA-N -1 3 261.321 2.503 20 10 CFCDHM CCn1nncc1CN[C@@H](C)c1ccc(Cl)cc1[O-] ZINC000527911603 330290860 /nfs/dbraw/zinc/29/08/60/330290860.db2.gz BBVQSHLVFGKVNZ-VIFPVBQESA-N -1 3 280.759 2.508 20 10 CFCDHM CCn1ncc(CN[C@H](C)c2ccc(Cl)cc2[O-])n1 ZINC000527923935 330296187 /nfs/dbraw/zinc/29/61/87/330296187.db2.gz CXDYASLDYPSEIQ-SECBINFHSA-N -1 3 280.759 2.508 20 10 CFCDHM CCOc1ccccc1N(C)C(=O)/C=C\c1cncc([O-])c1 ZINC000492397895 332395620 /nfs/dbraw/zinc/39/56/20/332395620.db2.gz KRNQMYCOXHOMSW-HJWRWDBZSA-N -1 3 298.342 2.862 20 10 CFCDHM C[C@H]1[C@@H](C2CC2)[C@H]1C(=O)NCc1cc(Cl)ccc1[O-] ZINC000529510423 333491879 /nfs/dbraw/zinc/49/18/79/333491879.db2.gz BGYQWXQQNJFCTG-YZMDESFKSA-N -1 3 279.767 2.954 20 10 CFCDHM CC(=O)c1cc(F)cc(CN(C)Cc2cccnc2)c1[O-] ZINC000050134335 518284591 /nfs/dbraw/zinc/28/45/91/518284591.db2.gz MSHWOOXWGDUYDI-UHFFFAOYSA-N -1 3 288.322 2.761 20 10 CFCDHM CC(=O)c1cc(F)cc(CN(C)Cc2ccco2)c1[O-] ZINC000050133933 518284615 /nfs/dbraw/zinc/28/46/15/518284615.db2.gz HMIABLWUHUOJQZ-UHFFFAOYSA-N -1 3 277.295 2.959 20 10 CFCDHM CCCCN(CC(F)(F)F)C(=O)c1cccc(O)c1[O-] ZINC000274974955 520444700 /nfs/dbraw/zinc/44/47/00/520444700.db2.gz KURUYENDBOBTEJ-UHFFFAOYSA-N -1 3 291.269 2.902 20 10 CFCDHM CC1(C)CN(Cc2c([O-])cccc2Cl)CC[C@@H]1O ZINC000275969359 520471742 /nfs/dbraw/zinc/47/17/42/520471742.db2.gz LLFLECMMEHAZTQ-ZDUSSCGKSA-N -1 3 269.772 2.638 20 10 CFCDHM CC[C@H](C)[C@H](NC(=O)c1cccc(O)c1[O-])C(F)(F)F ZINC000277865904 521971054 /nfs/dbraw/zinc/97/10/54/521971054.db2.gz DHUZPYGAAYSPFB-CPCISQLKSA-N -1 3 291.269 2.805 20 10 CFCDHM COc1cc(CCO)ccc1NCc1cc(F)ccc1[O-] ZINC000289692954 522338205 /nfs/dbraw/zinc/33/82/05/522338205.db2.gz NFRMFSLHBNQIMS-UHFFFAOYSA-N -1 3 291.322 2.687 20 10 CFCDHM CCc1nnc(CN[C@@H](C)c2ccc(F)cc2[O-])s1 ZINC000290312842 522742634 /nfs/dbraw/zinc/74/26/34/522742634.db2.gz ZYDKSHYIPHJULP-QMMMGPOBSA-N -1 3 281.356 2.796 20 10 CFCDHM C[C@H]1C[C@@H](c2cccnc2)N(C(=O)c2cccc(O)c2[O-])C1 ZINC000193162388 524833947 /nfs/dbraw/zinc/83/39/47/524833947.db2.gz MVRIXIFCHUFARA-FZMZJTMJSA-N -1 3 298.342 2.716 20 10 CFCDHM Cc1cc(Cl)cc(CN2CC(F)(F)C[C@@H]2CO)c1[O-] ZINC000364843376 524861303 /nfs/dbraw/zinc/86/13/03/524861303.db2.gz LFUOJFOFSQHUFT-LLVKDONJSA-N -1 3 291.725 2.556 20 10 CFCDHM C[C@@H]1CN2CCCC[C@@H]2CN1Cc1cccc(F)c1[O-] ZINC000166378166 525080287 /nfs/dbraw/zinc/08/02/87/525080287.db2.gz SRYYGSGQIAFOEU-TZMCWYRMSA-N -1 3 278.371 2.590 20 10 CFCDHM C[C@@H](NCc1cccc(Cl)c1[O-])c1cn[nH]c1 ZINC000224935874 525532578 /nfs/dbraw/zinc/53/25/78/525532578.db2.gz XCNUKFJBRKWPAF-MRVPVSSYSA-N -1 3 251.717 2.620 20 10 CFCDHM [O-]c1c(F)cccc1CN1CCO[C@H]2CCCC[C@H]21 ZINC000228003996 526328846 /nfs/dbraw/zinc/32/88/46/526328846.db2.gz JTAKNAGFTQEZMZ-KGLIPLIRSA-N -1 3 265.328 2.675 20 10 CFCDHM [O-]c1c(F)cccc1CN1CCC[C@H](n2cccn2)C1 ZINC000361070226 526329528 /nfs/dbraw/zinc/32/95/28/526329528.db2.gz WEIDGMRTPOQXSL-ZDUSSCGKSA-N -1 3 275.327 2.565 20 10 CFCDHM [O-]c1ccc(Cl)c(F)c1CN1CC[C@H](n2cccn2)C1 ZINC000365839747 526344833 /nfs/dbraw/zinc/34/48/33/526344833.db2.gz VOQWQGGAUMHXOI-JTQLQIEISA-N -1 3 295.745 2.828 20 10 CFCDHM Cn1cc(CNCc2cc(Cl)cc(Cl)c2[O-])cn1 ZINC000041158854 527217991 /nfs/dbraw/zinc/21/79/91/527217991.db2.gz VNLBUOHOXHIACR-UHFFFAOYSA-N -1 3 286.162 2.722 20 10 CFCDHM CCc1ccc(CCNC(=O)c2cc([O-])cs2)cc1 ZINC000736682462 574065547 /nfs/dbraw/zinc/06/55/47/574065547.db2.gz IKBSJOWQUCJOKO-UHFFFAOYSA-N -1 3 275.373 2.989 20 10 CFCDHM COCc1cccc(CNC(=O)c2cc([O-])cs2)c1 ZINC000731872036 574131247 /nfs/dbraw/zinc/13/12/47/574131247.db2.gz UNTQUYPRUWAEAE-UHFFFAOYSA-N -1 3 277.345 2.530 20 10 CFCDHM CN(CCOc1ccc(F)cc1)C(=O)c1cc([O-])cs1 ZINC000731866697 574132300 /nfs/dbraw/zinc/13/23/00/574132300.db2.gz YLEPWLSYGVDGJA-UHFFFAOYSA-N -1 3 295.335 2.744 20 10 CFCDHM O=C(Nc1ccc2n[nH]cc2c1)c1cc([O-])cs1 ZINC000731867393 574132311 /nfs/dbraw/zinc/13/23/11/574132311.db2.gz IRIMMDUJFBVLET-UHFFFAOYSA-N -1 3 259.290 2.582 20 10 CFCDHM C[C@@H](NC(=O)c1cc([O-])cs1)c1ccc2c(c1)OCO2 ZINC000731869309 574132685 /nfs/dbraw/zinc/13/26/85/574132685.db2.gz PMPYOIPBOXNKHU-MRVPVSSYSA-N -1 3 291.328 2.673 20 10 CFCDHM O=C(c1cc([O-])cs1)N1CCO[C@@H](c2ccccc2)C1 ZINC000732266389 574148044 /nfs/dbraw/zinc/14/80/44/574148044.db2.gz APEVWJLPZFNRQD-CYBMUJFWSA-N -1 3 289.356 2.667 20 10 CFCDHM Cn1cccc1[C@H]1CCCN1C(=O)c1cc([O-])cs1 ZINC000732267364 574148255 /nfs/dbraw/zinc/14/82/55/574148255.db2.gz ZGGXXHIZVCEMFE-GFCCVEGCSA-N -1 3 276.361 2.770 20 10 CFCDHM O=C(NC[C@H]1Cc2ccccc21)c1cc([O-])cs1 ZINC000732273749 574148463 /nfs/dbraw/zinc/14/84/63/574148463.db2.gz BIERDXQJWIPMPK-SNVBAGLBSA-N -1 3 259.330 2.523 20 10 CFCDHM O=C(Nc1ccc2c[nH]nc2c1)c1cc([O-])cs1 ZINC000732269425 574148588 /nfs/dbraw/zinc/14/85/88/574148588.db2.gz XRZMIPIVCYCQAA-UHFFFAOYSA-N -1 3 259.290 2.582 20 10 CFCDHM O=C(NCc1ccc2ccccc2n1)c1cc([O-])cs1 ZINC000732270712 574148624 /nfs/dbraw/zinc/14/86/24/574148624.db2.gz GBHIHHLLNCOHAF-UHFFFAOYSA-N -1 3 284.340 2.932 20 10 CFCDHM C[C@H](Cc1ccsc1)NC(=O)c1cc([O-])cs1 ZINC000732276912 574149147 /nfs/dbraw/zinc/14/91/47/574149147.db2.gz WOARRYKGHCDDFU-MRVPVSSYSA-N -1 3 267.375 2.876 20 10 CFCDHM Cc1cccc(OC[C@H](C)NC(=O)c2cc([O-])cs2)c1 ZINC000732276052 574149521 /nfs/dbraw/zinc/14/95/21/574149521.db2.gz DYRWLKKJRSBDEV-NSHDSACASA-N -1 3 291.372 2.959 20 10 CFCDHM COc1ccc(CCNC(=O)c2cc([O-])cs2)cc1F ZINC000732286329 574149852 /nfs/dbraw/zinc/14/98/52/574149852.db2.gz QWGWQUXSZQSYIC-UHFFFAOYSA-N -1 3 295.335 2.574 20 10 CFCDHM O=C(N[C@@H]1CCOc2ccc(F)cc21)c1cc([O-])cs1 ZINC000732291339 574150576 /nfs/dbraw/zinc/15/05/76/574150576.db2.gz VUQWOXZLIAVJPY-LLVKDONJSA-N -1 3 293.319 2.846 20 10 CFCDHM CCCOc1ccc(CNC(=O)c2cc([O-])cs2)cn1 ZINC000732289977 574150851 /nfs/dbraw/zinc/15/08/51/574150851.db2.gz NXGBUFKJDMRMMI-UHFFFAOYSA-N -1 3 292.360 2.568 20 10 CFCDHM CC(C)C[C@H](C)N(C)C(=O)COC(=O)c1cc([O-])cs1 ZINC000732353166 574152775 /nfs/dbraw/zinc/15/27/75/574152775.db2.gz MZSAOMRUKJSJCV-JTQLQIEISA-N -1 3 299.392 2.504 20 10 CFCDHM Cc1cccc2nc(COC(=O)c3cc([O-])cs3)cn21 ZINC000732353970 574153242 /nfs/dbraw/zinc/15/32/42/574153242.db2.gz XJYPRQMVBRKYMR-UHFFFAOYSA-N -1 3 288.328 2.767 20 10 CFCDHM COc1ccc(CCOC(=O)c2cc([O-])cs2)cc1 ZINC000732354343 574153253 /nfs/dbraw/zinc/15/32/53/574153253.db2.gz JWROHCKDWNIVCQ-UHFFFAOYSA-N -1 3 278.329 2.862 20 10 CFCDHM CO[C@@H](CNC(=O)c1cc([O-])cs1)c1ccccc1 ZINC000732574857 574161167 /nfs/dbraw/zinc/16/11/67/574161167.db2.gz DDUUAKNIRKEAED-LBPRGKRZSA-N -1 3 277.345 2.571 20 10 CFCDHM [O-]c1cccc(Cl)c1CNCc1cccc(F)n1 ZINC000747936712 574221119 /nfs/dbraw/zinc/22/11/19/574221119.db2.gz YYLJDGJHCNOGOE-UHFFFAOYSA-N -1 3 266.703 2.870 20 10 CFCDHM Cc1cc(CN[C@H](C)c2cc(F)cc(F)c2[O-])on1 ZINC000756542641 574244751 /nfs/dbraw/zinc/24/47/51/574244751.db2.gz CGXPDAOIGJUESP-MRVPVSSYSA-N -1 3 268.263 2.818 20 10 CFCDHM C[C@H](NCc1cccc(F)n1)c1cc([N+](=O)[O-])ccc1[O-] ZINC000756768020 574261357 /nfs/dbraw/zinc/26/13/57/574261357.db2.gz IBVOMOOMXPJVQH-VIFPVBQESA-N -1 3 291.282 2.685 20 10 CFCDHM CCc1ccc([O-])c(C(=O)N(C)Cc2ccccc2O)c1 ZINC000748840501 574271209 /nfs/dbraw/zinc/27/12/09/574271209.db2.gz LULIDRGZNNGNRM-UHFFFAOYSA-N -1 3 285.343 2.932 20 10 CFCDHM O=C(Nc1cc(F)ccc1[O-])C1=CC(=O)CS1 ZINC000748854781 574272098 /nfs/dbraw/zinc/27/20/98/574272098.db2.gz ZHOSISNLKQSDRK-UHFFFAOYSA-N -1 3 253.254 2.551 20 10 CFCDHM COC(=O)c1ccc(CNCc2c([O-])cccc2Cl)o1 ZINC000734159373 574277723 /nfs/dbraw/zinc/27/77/23/574277723.db2.gz DFXGGJUEZZCEDL-UHFFFAOYSA-N -1 3 295.722 2.715 20 10 CFCDHM Cc1cc(N(C)C)ccc1C[N-]C(=O)C(F)(F)C(F)F ZINC000749391646 574292772 /nfs/dbraw/zinc/29/27/72/574292772.db2.gz NDTWNMAVFPDOCL-UHFFFAOYSA-N -1 3 292.276 2.578 20 10 CFCDHM Cc1ccc([C@@H]2COCCN2C(=O)c2cc([O-])cs2)o1 ZINC000735124943 574313870 /nfs/dbraw/zinc/31/38/70/574313870.db2.gz GVWFYXGOBXNBIF-NSHDSACASA-N -1 3 293.344 2.569 20 10 CFCDHM O=C(NCCOC1CCCCCC1)c1cc([O-])cs1 ZINC000735702901 574333599 /nfs/dbraw/zinc/33/35/99/574333599.db2.gz SEQDLOZLBMLCQY-UHFFFAOYSA-N -1 3 283.393 2.923 20 10 CFCDHM CCCC(O)(CCC)CNC(=O)c1cc([O-])cs1 ZINC000743716376 574371445 /nfs/dbraw/zinc/37/14/45/574371445.db2.gz YBWBDWZMARVQHK-UHFFFAOYSA-N -1 3 271.382 2.515 20 10 CFCDHM CC(C)[C@@H]1OCCC[C@H]1CNC(=O)c1cc([O-])cs1 ZINC000752816361 574395469 /nfs/dbraw/zinc/39/54/69/574395469.db2.gz SIVCBFLQYDMWBY-GWCFXTLKSA-N -1 3 283.393 2.635 20 10 CFCDHM CN(C[C@H]1CC=CCC1)C(=O)c1cc([O-])cs1 ZINC000753504081 574403464 /nfs/dbraw/zinc/40/34/64/574403464.db2.gz QXMVZIKVTJRPNA-JTQLQIEISA-N -1 3 251.351 2.882 20 10 CFCDHM O=C([O-])CC1([NH2+]Cc2ccccc2[O-])CCCCC1 ZINC000833205598 601562323 /nfs/dbraw/zinc/56/23/23/601562323.db2.gz IIGPMZQCZJZWJX-UHFFFAOYSA-N -1 3 263.337 2.659 20 10 CFCDHM O=C([O-])c1ccc(C[NH2+]Cc2cc(Cl)ccc2[O-])o1 ZINC000740133064 600525348 /nfs/dbraw/zinc/52/53/48/600525348.db2.gz TURQOXKEKOVIAW-UHFFFAOYSA-N -1 3 281.695 2.627 20 10 CFCDHM COc1ccc(O)c([C@@H](C)NCc2ccc(C(=O)[O-])o2)c1 ZINC000833734035 605124755 /nfs/dbraw/zinc/12/47/55/605124755.db2.gz ZUYIHWJJGNIMDX-SECBINFHSA-N -1 3 291.303 2.543 20 10 CFCDHM C[N@H+](Cc1cc(F)ccc1[O-])[C@@H](C(=O)[O-])c1ccccc1 ZINC000833694100 605482895 /nfs/dbraw/zinc/48/28/95/605482895.db2.gz KDRCNDLWKPKGHF-OAHLLOKOSA-N -1 3 289.306 2.789 20 10 CFCDHM C[N@@H+](Cc1cc(F)ccc1[O-])[C@@H](C(=O)[O-])c1ccccc1 ZINC000833694100 605482898 /nfs/dbraw/zinc/48/28/98/605482898.db2.gz KDRCNDLWKPKGHF-OAHLLOKOSA-N -1 3 289.306 2.789 20 10 CFCDHM CCOC(=O)CC(C)(C)CC(=O)C(=O)c1cc([O-])cs1 ZINC000935945599 649963892 /nfs/dbraw/zinc/96/38/92/649963892.db2.gz DBYUFFQCJGBUFL-UHFFFAOYSA-N -1 3 298.360 2.575 20 10 CFCDHM C[C@H]1CCCC[C@@]1(C)NC(=O)c1cccc(O)c1[O-] ZINC000308721308 617827591 /nfs/dbraw/zinc/82/75/91/617827591.db2.gz CUBYCYNETYRRKE-ZUZCIYMTSA-N -1 3 263.337 2.796 20 10 CFCDHM Cc1ccc(C(=O)N2CCCc3ccccc32)c([O-])c1O ZINC000179379120 620757872 /nfs/dbraw/zinc/75/78/72/620757872.db2.gz GJBNRWQKRBMUPU-UHFFFAOYSA-N -1 3 283.327 2.999 20 10 CFCDHM C[C@@H]1C[C@@H]1[C@H]1C[C@@H]1CNC(=O)NCc1c([O-])cccc1F ZINC000924044698 617918948 /nfs/dbraw/zinc/91/89/48/617918948.db2.gz XDONNLDETAKXLG-WYUUTHIRSA-N -1 3 292.354 2.623 20 10 CFCDHM C[C@H]1SCCN(Cc2cc(F)cc(F)c2[O-])[C@@H]1C ZINC000894035224 618277707 /nfs/dbraw/zinc/27/77/07/618277707.db2.gz WRNNQNLJYRYPHF-RKDXNWHRSA-N -1 3 273.348 2.996 20 10 CFCDHM O=[N+]([O-])c1cc(Cl)cc(CN2CCCCC2)c1[O-] ZINC000092107051 618433032 /nfs/dbraw/zinc/43/30/32/618433032.db2.gz MLKHNDVFOGGNMM-UHFFFAOYSA-N -1 3 270.716 2.940 20 10 CFCDHM C=Cc1ccc(S(=O)(=O)[N-]c2ccc(O)cc2)cc1 ZINC000199460058 618976002 /nfs/dbraw/zinc/97/60/02/618976002.db2.gz LYZDFEFVBHGZEB-UHFFFAOYSA-N -1 3 275.329 2.836 20 10 CFCDHM CC[C@@H](N[C@H]1CNOC1)c1cc(Cl)cc(Cl)c1[O-] ZINC000925864926 619189683 /nfs/dbraw/zinc/18/96/83/619189683.db2.gz CSCCRCQJQHVBFZ-GZMMTYOYSA-N -1 3 291.178 2.643 20 10 CFCDHM [O-]c1c(F)cc(F)cc1CN1CCC[C@@H](OC(F)F)C1 ZINC000894434359 619384084 /nfs/dbraw/zinc/38/40/84/619384084.db2.gz RFYUZWWRLZSXJM-SNVBAGLBSA-N -1 3 293.260 2.874 20 10 CFCDHM CN(Cc1ncc[nH]1)Cc1c([O-])cccc1Br ZINC000894586358 619424787 /nfs/dbraw/zinc/42/47/87/619424787.db2.gz CQIKBCGSEFGBII-UHFFFAOYSA-N -1 3 296.168 2.510 20 10 CFCDHM Cc1ccc(NC(=O)c2ccc(C)c(O)c2[O-])c(C)n1 ZINC000182591154 625354902 /nfs/dbraw/zinc/35/49/02/625354902.db2.gz RXINSOYHFNIBEC-UHFFFAOYSA-N -1 3 272.304 2.670 20 10 CFCDHM C[C@@H]1CN(Cc2cc(Cl)cc(Cl)c2[O-])C[C@H]1O ZINC000897684507 620271411 /nfs/dbraw/zinc/27/14/11/620271411.db2.gz QKKXVWHWZOEOAC-RDDDGLTNSA-N -1 3 276.163 2.512 20 10 CFCDHM O=C(NCc1c([O-])cccc1F)N[C@@H]1C[C@@H]2CCC[C@H]12 ZINC000898254153 620357956 /nfs/dbraw/zinc/35/79/56/620357956.db2.gz ASWAJAXADRANAI-OUJBWJOFSA-N -1 3 278.327 2.519 20 10 CFCDHM C[C@H](NCc1csc(N)n1)c1cc(F)cc(F)c1[O-] ZINC000902500851 621105925 /nfs/dbraw/zinc/10/59/25/621105925.db2.gz XYXBFRLJKZTGJU-LURJTMIESA-N -1 3 285.319 2.560 20 10 CFCDHM C[C@H](NCc1cnn(CCF)c1)c1cc(F)cc(F)c1[O-] ZINC000903274247 621309887 /nfs/dbraw/zinc/30/98/87/621309887.db2.gz KIJJMNCQCPROIQ-VIFPVBQESA-N -1 3 299.296 2.687 20 10 CFCDHM CC[C@@H](NCc1cn(C)cn1)c1ccc(F)cc1[O-] ZINC000903352939 621344299 /nfs/dbraw/zinc/34/42/99/621344299.db2.gz XDIYVIHFKZGYAD-CYBMUJFWSA-N -1 3 263.316 2.506 20 10 CFCDHM CCc1csc([C@H](C)NC(=O)c2cccc(O)c2[O-])n1 ZINC000910733393 622471540 /nfs/dbraw/zinc/47/15/40/622471540.db2.gz CJQXCCDNUNTTKO-QMMMGPOBSA-N -1 3 292.360 2.608 20 10 CFCDHM CCC(CC)(CNC(=O)c1cccc(O)c1[O-])SC ZINC000229412914 623202645 /nfs/dbraw/zinc/20/26/45/623202645.db2.gz ABOAYWFHVLKRHW-UHFFFAOYSA-N -1 3 283.393 2.749 20 10 CFCDHM CC(C)c1nnc(CNCc2c([O-])cccc2Cl)[nH]1 ZINC000824603360 623531391 /nfs/dbraw/zinc/53/13/91/623531391.db2.gz QGJTYFRZVYTRJM-UHFFFAOYSA-N -1 3 280.759 2.577 20 10 CFCDHM Cc1cc([O-])c(CNCc2ccon2)cc1Cl ZINC000825325488 623672487 /nfs/dbraw/zinc/67/24/87/623672487.db2.gz GQWPZFSQSGRWHX-UHFFFAOYSA-N -1 3 252.701 2.632 20 10 CFCDHM C[C@@H]1OCCN(Cc2cc(Cl)ccc2[O-])[C@H]1C ZINC000093418110 623713730 /nfs/dbraw/zinc/71/37/30/623713730.db2.gz NWHOMKMZDSJMOJ-UWVGGRQHSA-N -1 3 255.745 2.655 20 10 CFCDHM C[C@H]1CCC[C@@H](NC(=O)NCc2c([O-])cccc2F)C1 ZINC000914201046 623733433 /nfs/dbraw/zinc/73/34/33/623733433.db2.gz VNIDJDDAROZLID-WDEREUQCSA-N -1 3 280.343 2.909 20 10 CFCDHM CCN(C(=O)c1cccc(O)c1[O-])c1nc(C)cs1 ZINC000185744090 625771549 /nfs/dbraw/zinc/77/15/49/625771549.db2.gz ORMVADMJRGTUPJ-UHFFFAOYSA-N -1 3 278.333 2.529 20 10 CFCDHM CCS[C@H]1CCC[C@H](NC(=O)c2cccc(O)c2[O-])C1 ZINC000185798073 625779470 /nfs/dbraw/zinc/77/94/70/625779470.db2.gz WLPHHOVLWGRJEG-QWRGUYRKSA-N -1 3 295.404 2.892 20 10 CFCDHM O=C(NCCSc1ccccc1)c1cccc(O)c1[O-] ZINC000186791812 626399364 /nfs/dbraw/zinc/39/93/64/626399364.db2.gz OWEFUURZCCXZKH-UHFFFAOYSA-N -1 3 289.356 2.620 20 10 CFCDHM O=C(NCc1c([O-])cccc1F)N[C@@H]1CCCC[C@H]1F ZINC000922897534 626422473 /nfs/dbraw/zinc/42/24/73/626422473.db2.gz UMRHHZNUZGMYRT-VXGBXAGGSA-N -1 3 284.306 2.611 20 10 CFCDHM C[C@@H]1CCC[C@H](C)N(C(=O)c2cccc(O)c2[O-])C1 ZINC000187128462 626459890 /nfs/dbraw/zinc/45/98/90/626459890.db2.gz NERXSJSLHIPYPS-MNOVXSKESA-N -1 3 263.337 2.749 20 10 CFCDHM C[C@]1(CNC(=O)NCc2c([O-])cccc2F)C[C@H]2C[C@H]2C1 ZINC000923458313 626473807 /nfs/dbraw/zinc/47/38/07/626473807.db2.gz OAIMIJYQFAFEJV-CDMJZVDBSA-N -1 3 292.354 2.767 20 10 CFCDHM [O-]c1ccc(Cl)c(F)c1CN1CC2(C1)CCOCC2 ZINC000839141224 626528576 /nfs/dbraw/zinc/52/85/76/626528576.db2.gz MOKCEVHIDZULLC-UHFFFAOYSA-N -1 3 285.746 2.797 20 10 CFCDHM Cc1ncc([C@H](C)NCc2cc([N+](=O)[O-])ccc2[O-])s1 ZINC000761433442 626834394 /nfs/dbraw/zinc/83/43/94/626834394.db2.gz AHQDGXAIMKGNJC-QMMMGPOBSA-N -1 3 293.348 2.916 20 10 CFCDHM Cc1ccc(C(=O)Nc2ccc3c(c2)ncn3C)c([O-])c1O ZINC000780956831 628508602 /nfs/dbraw/zinc/50/86/02/628508602.db2.gz NAJNVZAZUZEXOQ-UHFFFAOYSA-N -1 3 297.314 2.545 20 10 CFCDHM Cc1cc(Br)c([O-])c(CNCc2cocn2)c1 ZINC000781628897 628568224 /nfs/dbraw/zinc/56/82/24/628568224.db2.gz CNXGRFDRJSYHAX-UHFFFAOYSA-N -1 3 297.152 2.741 20 10 CFCDHM CC[C@H](N[C@@H](C)c1ncn(C)n1)c1cc(Cl)ccc1[O-] ZINC000783297204 628698212 /nfs/dbraw/zinc/69/82/12/628698212.db2.gz GCDXENDRXLLPIV-CABZTGNLSA-N -1 3 294.786 2.976 20 10 CFCDHM O=C(Nc1ccccc1-c1cn[nH]c1)c1cccc(O)c1[O-] ZINC000784475966 628819719 /nfs/dbraw/zinc/81/97/19/628819719.db2.gz ACZQWQFOSYQYAH-UHFFFAOYSA-N -1 3 295.298 2.740 20 10 CFCDHM Cc1cc(CNCc2c([O-])ccc(Cl)c2F)n(C)n1 ZINC000790601680 629251520 /nfs/dbraw/zinc/25/15/20/629251520.db2.gz MSCZGMWIYGWVKT-UHFFFAOYSA-N -1 3 283.734 2.516 20 10 CFCDHM Cc1noc(C(C)(C)NCc2cc(Cl)ccc2[O-])n1 ZINC000790623437 629252867 /nfs/dbraw/zinc/25/28/67/629252867.db2.gz UHAAHTAFSQSBKW-UHFFFAOYSA-N -1 3 281.743 2.762 20 10 CFCDHM Cc1ccc2c(c1)CCN(C(=O)c1cccc(O)c1[O-])C2 ZINC000790987329 629277894 /nfs/dbraw/zinc/27/78/94/629277894.db2.gz BGBYJVWQGXKWJD-UHFFFAOYSA-N -1 3 283.327 2.605 20 10 CFCDHM CC(=O)c1cc(F)cc(CN2[C@@H](C)C[C@@H]2C)c1[O-] ZINC000791564870 629333088 /nfs/dbraw/zinc/33/30/88/629333088.db2.gz ASIWCCAIKALJGH-IUCAKERBSA-N -1 3 251.301 2.717 20 10 CFCDHM C[C@@H]1COCCCN1Cc1c([O-])ccc(Cl)c1F ZINC000792166091 629404217 /nfs/dbraw/zinc/40/42/17/629404217.db2.gz OYZWEPUYRRGRHT-SECBINFHSA-N -1 3 273.735 2.796 20 10 CFCDHM C[C@H]1[C@H](C(F)(F)F)CCN1C(=O)c1cccc(O)c1[O-] ZINC000792537522 629432310 /nfs/dbraw/zinc/43/23/10/629432310.db2.gz IQIDBRILHRLOND-IONNQARKSA-N -1 3 289.253 2.511 20 10 CFCDHM CC[C@H](NCc1ncnn1CC)c1cc(Cl)ccc1[O-] ZINC000794842007 629692992 /nfs/dbraw/zinc/69/29/92/629692992.db2.gz ORYNVMDKANUFER-LBPRGKRZSA-N -1 3 294.786 2.898 20 10 CFCDHM Cc1cc(=O)[n-]c(C=Cc2ccc(N(C)C)c(F)c2)n1 ZINC000806574222 630814854 /nfs/dbraw/zinc/81/48/54/630814854.db2.gz ICZSLAALMTWXDS-ALCCZGGFSA-N -1 3 273.311 2.866 20 10 CFCDHM C[C@@H](N[C@@H](C)c1cc(F)cc(F)c1[O-])c1ccn(C)n1 ZINC000840815351 631230187 /nfs/dbraw/zinc/23/01/87/631230187.db2.gz DTNDWBPOARIGGA-DTWKUNHWSA-N -1 3 281.306 2.816 20 10 CFCDHM CC(=O)c1cc(F)cc(CN2Cc3ccncc3C2)c1[O-] ZINC000809565119 631235951 /nfs/dbraw/zinc/23/59/51/631235951.db2.gz UMZKBHTWOATPCL-UHFFFAOYSA-N -1 3 286.306 2.645 20 10 CFCDHM CCN(CC)C(=O)CN(C)Cc1c([O-])cc(C)cc1Cl ZINC000840908753 631259734 /nfs/dbraw/zinc/25/97/34/631259734.db2.gz WNPGXDPHKNMXPL-UHFFFAOYSA-N -1 3 298.814 2.654 20 10 CFCDHM [O-]c1ccc(F)cc1CNCc1nccc(C(F)F)n1 ZINC000809783296 631288843 /nfs/dbraw/zinc/28/88/43/631288843.db2.gz XRPQSVFLXDWEBM-UHFFFAOYSA-N -1 3 283.253 2.549 20 10 CFCDHM O=C([O-])CC[C@@H](Cc1ccccc1)[NH2+]Cc1ccccc1[O-] ZINC000840998446 631298553 /nfs/dbraw/zinc/29/85/53/631298553.db2.gz HUVDMRMSGSWETE-INIZCTEOSA-N -1 3 299.370 2.958 20 10 CFCDHM CC1(C)[C@@H](O)CCN1Cc1c([O-])ccc(Cl)c1F ZINC000812779603 631771954 /nfs/dbraw/zinc/77/19/54/631771954.db2.gz SYSTUUAYPIDGLG-NSHDSACASA-N -1 3 273.735 2.530 20 10 CFCDHM CC[C@H](C)C[C@H](NCc1cc(F)ccc1[O-])C(=O)OC ZINC000843415339 631948120 /nfs/dbraw/zinc/94/81/20/631948120.db2.gz KFNKUXVIBKFHFO-GWCFXTLKSA-N -1 3 283.343 2.599 20 10 CFCDHM Cc1nnsc1CN[C@@H](C)c1cc(F)cc(F)c1[O-] ZINC000813883503 631972041 /nfs/dbraw/zinc/97/20/41/631972041.db2.gz OILCHPDTJIKOMV-LURJTMIESA-N -1 3 285.319 2.681 20 10 CFCDHM CC(C)[C@@H]1N(C(=O)c2cccc(O)c2[O-])CC12CC=CC2 ZINC000844094796 632117499 /nfs/dbraw/zinc/11/74/99/632117499.db2.gz CFXLBXQGHYZCJQ-HNNXBMFYSA-N -1 3 287.359 2.915 20 10 CFCDHM O=C(c1cccc(O)c1[O-])N1CCCC[C@@H]1C1CCC1 ZINC000844124528 632123472 /nfs/dbraw/zinc/12/34/72/632123472.db2.gz USYYMUAKDIKAGF-CYBMUJFWSA-N -1 3 275.348 2.893 20 10 CFCDHM CC[C@@H](C(=O)[O-])[N@H+](C)Cc1cc(Cl)cc(C)c1[O-] ZINC000844938669 632342707 /nfs/dbraw/zinc/34/27/07/632342707.db2.gz VWFJGICSXSHAHP-NSHDSACASA-N -1 3 271.744 2.649 20 10 CFCDHM CC[C@@H](C(=O)[O-])[N@@H+](C)Cc1cc(Cl)cc(C)c1[O-] ZINC000844938669 632342714 /nfs/dbraw/zinc/34/27/14/632342714.db2.gz VWFJGICSXSHAHP-NSHDSACASA-N -1 3 271.744 2.649 20 10 CFCDHM C[C@H]1COCCCN1Cc1cc(Cl)c(F)cc1[O-] ZINC000816514265 632475250 /nfs/dbraw/zinc/47/52/50/632475250.db2.gz RKTRNFICLHRGHX-VIFPVBQESA-N -1 3 273.735 2.796 20 10 CFCDHM CC[C@@H]1CN(C)CCN1Cc1c([O-])ccc(Cl)c1F ZINC000816660435 632506332 /nfs/dbraw/zinc/50/63/32/632506332.db2.gz DUHKKDYRFNQOAU-SNVBAGLBSA-N -1 3 286.778 2.711 20 10 CFCDHM C[C@H](N[C@@H]1C[C@@H](C)n2ncnc21)c1ccc(Cl)cc1[O-] ZINC000850499079 634019035 /nfs/dbraw/zinc/01/90/35/634019035.db2.gz JEUMNFSVCHGFTF-VDDIYKPWSA-N -1 3 292.770 2.994 20 10 CFCDHM C[C@H](N[C@H]1C[C@@H](C)n2ncnc21)c1cc(Cl)ccc1[O-] ZINC000850499231 634020114 /nfs/dbraw/zinc/02/01/14/634020114.db2.gz LKQNFTMLBOWCNT-PTRXPTGYSA-N -1 3 292.770 2.994 20 10 CFCDHM CCn1nccc1CNCc1c([O-])ccc(Cl)c1F ZINC000853094187 634902572 /nfs/dbraw/zinc/90/25/72/634902572.db2.gz RZRWVKGADOKIGT-UHFFFAOYSA-N -1 3 283.734 2.691 20 10 CFCDHM O=C(Nc1cccc(-n2ccnc2)c1)c1cccc(O)c1[O-] ZINC000188207594 650319467 /nfs/dbraw/zinc/31/94/67/650319467.db2.gz BZDMVKDDXVYGLJ-UHFFFAOYSA-N -1 3 295.298 2.536 20 10 CFCDHM [O-]c1c(CNc2ccc3nn[nH]c3c2)ccc(F)c1F ZINC000864025160 637836837 /nfs/dbraw/zinc/83/68/37/637836837.db2.gz OYOGNYYTFGQIHK-UHFFFAOYSA-N -1 3 276.246 2.554 20 10 CFCDHM Cc1ccc([C@H](C)CNC(=O)c2cccc(O)c2[O-])cc1 ZINC000193081644 650621214 /nfs/dbraw/zinc/62/12/14/650621214.db2.gz UMODWPJTDNLBEX-GFCCVEGCSA-N -1 3 285.343 2.940 20 10 CFCDHM COc1cc(C)c(NC(=O)c2cccc(O)c2[O-])cc1F ZINC000193167913 650629793 /nfs/dbraw/zinc/62/97/93/650629793.db2.gz GMMVVEVQVJZGRY-UHFFFAOYSA-N -1 3 291.278 2.806 20 10 CFCDHM Cc1nonc1CN[C@H](C)c1cc(Cl)ccc1[O-] ZINC000872134957 641663745 /nfs/dbraw/zinc/66/37/45/641663745.db2.gz AOJJCXNQHBPKOB-SSDOTTSWSA-N -1 3 267.716 2.588 20 10 CFCDHM O=C(N[C@@H]1C[C@H]1c1ccc(F)cc1)c1cccc(O)c1[O-] ZINC000194983480 650735449 /nfs/dbraw/zinc/73/54/49/650735449.db2.gz ADPPRJXFQQSZMF-QWHCGFSZSA-N -1 3 287.290 2.523 20 10 CFCDHM [O-]c1c(F)c(F)ccc1CN1CCC(n2ccnc2)CC1 ZINC000876651098 642959143 /nfs/dbraw/zinc/95/91/43/642959143.db2.gz PCWRYMQKHBMRIR-UHFFFAOYSA-N -1 3 293.317 2.704 20 10 CFCDHM [O-]c1c(F)c(F)ccc1CN1CCC[C@@H](n2ccnc2)C1 ZINC000876680712 642970482 /nfs/dbraw/zinc/97/04/82/642970482.db2.gz SQLLGWZGNDBBBE-GFCCVEGCSA-N -1 3 293.317 2.704 20 10 CFCDHM CCN(C(=O)c1cccc(O)c1[O-])c1ccccc1 ZINC000126220442 643054382 /nfs/dbraw/zinc/05/43/82/643054382.db2.gz CSNIJYYKOSTPSJ-UHFFFAOYSA-N -1 3 257.289 2.765 20 10 CFCDHM [O-]c1cccc(Cl)c1CNCc1ncccc1F ZINC000126288852 643107548 /nfs/dbraw/zinc/10/75/48/643107548.db2.gz WYPUWNYYVBHAQR-UHFFFAOYSA-N -1 3 266.703 2.870 20 10 CFCDHM C[C@H](Cc1ccsc1)NC(=O)c1cccc(O)c1[O-] ZINC000126303687 643111440 /nfs/dbraw/zinc/11/14/40/643111440.db2.gz CRRHKZPXXLEBPX-SECBINFHSA-N -1 3 277.345 2.520 20 10 CFCDHM C[C@H]1CCCC[C@@H]1CNC(=O)c1cccc(O)c1[O-] ZINC000126346306 643153766 /nfs/dbraw/zinc/15/37/66/643153766.db2.gz VKBPLVAFCNIYFO-WDEREUQCSA-N -1 3 263.337 2.654 20 10 CFCDHM CC(C)CC[C@H](C)NC(=O)c1cccc(O)c1[O-] ZINC000126425113 643211335 /nfs/dbraw/zinc/21/13/35/643211335.db2.gz ZKTKFHHIJFXXKF-JTQLQIEISA-N -1 3 251.326 2.652 20 10 CFCDHM Cc1cnn([C@H]2CCN(Cc3ccc(F)c(F)c3[O-])C2)c1 ZINC000877541570 643343649 /nfs/dbraw/zinc/34/36/49/643343649.db2.gz GRIHTHOVSGCAGA-LBPRGKRZSA-N -1 3 293.317 2.622 20 10 CFCDHM CCc1noc(C)c1CNCc1ccc(F)c(F)c1[O-] ZINC000877551261 643350768 /nfs/dbraw/zinc/35/07/68/643350768.db2.gz WOEIJTZXMJROEC-UHFFFAOYSA-N -1 3 282.290 2.819 20 10 CFCDHM CN(Cc1ccc(F)c(F)c1[O-])[C@@H](CO)c1ccccc1 ZINC000877563080 643363089 /nfs/dbraw/zinc/36/30/89/643363089.db2.gz GVGJGLSCKAWEAL-AWEZNQCLSA-N -1 3 293.313 2.836 20 10 CFCDHM O=C1N(c2ccccc2)[C@H](c2cc(F)ccc2[O-])NC12CC2 ZINC000877859232 643609572 /nfs/dbraw/zinc/60/95/72/643609572.db2.gz OIVLTHZKAWDZNS-OAHLLOKOSA-N -1 3 298.317 2.699 20 10 CFCDHM C[C@@H](NCc1nccs1)c1c([O-])cccc1F ZINC000886508972 647023500 /nfs/dbraw/zinc/02/35/00/647023500.db2.gz VREAWFMFYVJREJ-MRVPVSSYSA-N -1 3 252.314 2.839 20 10 CFCDHM CC(C)(C)OC[C@H]1CCCN1C(=O)c1cccc(O)c1[O-] ZINC000928235069 648882231 /nfs/dbraw/zinc/88/22/31/648882231.db2.gz REBBDHONPQETKW-LLVKDONJSA-N -1 3 293.363 2.518 20 10 CFCDHM O=C(NCc1c([O-])cccc1F)c1[nH]ccc1C1CC1 ZINC000928705010 648944218 /nfs/dbraw/zinc/94/42/18/648944218.db2.gz BYWSUWDVYNONJK-UHFFFAOYSA-N -1 3 274.295 2.667 20 10 CFCDHM CCC(C)(C)CC(=O)NCc1c([O-])cccc1F ZINC000928706519 648944589 /nfs/dbraw/zinc/94/45/89/648944589.db2.gz VPRCATGCKRFGLE-UHFFFAOYSA-N -1 3 253.317 2.974 20 10 CFCDHM O=C(NCc1c([O-])cccc1F)[C@H]1C[C@@H]1C1CCCC1 ZINC000928705347 648944725 /nfs/dbraw/zinc/94/47/25/648944725.db2.gz HINNLNRJQIKYCV-NEPJUHHUSA-N -1 3 277.339 2.974 20 10 CFCDHM C[C@H]1CCCC[C@@H]1OCC(=O)NCc1c([O-])cccc1F ZINC000928706534 648944876 /nfs/dbraw/zinc/94/48/76/648944876.db2.gz VYVFJCPOKVOKHT-NHYWBVRUSA-N -1 3 295.354 2.743 20 10 CFCDHM O=C(NCc1c([O-])cccc1F)[C@@H]1CCc2ccccc2C1 ZINC000928706042 648944911 /nfs/dbraw/zinc/94/49/11/648944911.db2.gz NZXMRIZPOFBHQL-CQSZACIVSA-N -1 3 299.345 2.953 20 10 CFCDHM CC(C)(C(=O)NCc1c([O-])cccc1F)C1CC1 ZINC000928706883 648945419 /nfs/dbraw/zinc/94/54/19/648945419.db2.gz YIZVBVVERUDPDZ-UHFFFAOYSA-N -1 3 251.301 2.584 20 10 CFCDHM O=C(NCc1c([O-])cccc1F)[C@H]1CCCC(F)(F)C1 ZINC000928707807 648945667 /nfs/dbraw/zinc/94/56/67/648945667.db2.gz IXIATCMUFZSHQZ-VIFPVBQESA-N -1 3 287.281 2.973 20 10 CFCDHM CCCCSCC(=O)NCc1c([O-])cccc1F ZINC000928711177 648946573 /nfs/dbraw/zinc/94/65/73/648946573.db2.gz GHZVLNYKMQRRDY-UHFFFAOYSA-N -1 3 271.357 2.681 20 10 CFCDHM CC(C)(C(=O)NCc1c([O-])cccc1F)[C@@H]1CCCCO1 ZINC000928710676 648946599 /nfs/dbraw/zinc/94/65/99/648946599.db2.gz VQPZVTSELZIZCS-AWEZNQCLSA-N -1 3 295.354 2.743 20 10 CFCDHM CC(C)n1ccc(NC(=O)NCc2c([O-])cccc2F)n1 ZINC000931243707 649396108 /nfs/dbraw/zinc/39/61/08/649396108.db2.gz OJGHVHJCKXZJSC-UHFFFAOYSA-N -1 3 292.314 2.630 20 10 CFCDHM CC(C)Oc1cccc2c1C(=O)c1c([O-])cccc1C2=O ZINC001226379766 775797956 /nfs/dbraw/zinc/79/79/56/775797956.db2.gz ICDNPVAVHYZKOG-UHFFFAOYSA-N -1 3 282.295 2.955 20 10 CFCDHM CC[N@H+](Cc1ccncc1)Cc1ccc(C(=O)[O-])cc1[O-] ZINC001231445903 777220750 /nfs/dbraw/zinc/22/07/50/777220750.db2.gz CKOYQCJPJODVBD-UHFFFAOYSA-N -1 3 286.331 2.508 20 10 CFCDHM CC[N@@H+](Cc1ccncc1)Cc1ccc(C(=O)[O-])cc1[O-] ZINC001231445903 777220759 /nfs/dbraw/zinc/22/07/59/777220759.db2.gz CKOYQCJPJODVBD-UHFFFAOYSA-N -1 3 286.331 2.508 20 10 CFCDHM O=C([O-])c1ccc(C[N@@H+]2CCC[C@H]2c2ccncc2)c([O-])c1 ZINC001231452838 777224094 /nfs/dbraw/zinc/22/40/94/777224094.db2.gz UZGYUWDVIBCDHS-HNNXBMFYSA-N -1 3 298.342 2.823 20 10 CFCDHM O=C([O-])c1ccc(C[N@H+]2CCC[C@H]2c2ccncc2)c([O-])c1 ZINC001231452838 777224100 /nfs/dbraw/zinc/22/41/00/777224100.db2.gz UZGYUWDVIBCDHS-HNNXBMFYSA-N -1 3 298.342 2.823 20 10 CFCDHM O=C([O-])c1ccc([O-])c(C[N@H+]2C[C@@H]3CC(F)(F)C[C@@H]3C2)c1 ZINC001231560268 777258742 /nfs/dbraw/zinc/25/87/42/777258742.db2.gz DVQBFMOTCNBZGN-TXEJJXNPSA-N -1 3 297.301 2.568 20 10 CFCDHM O=C([O-])c1ccc([O-])c(C[N@@H+]2C[C@@H]3CC(F)(F)C[C@@H]3C2)c1 ZINC001231560268 777258746 /nfs/dbraw/zinc/25/87/46/777258746.db2.gz DVQBFMOTCNBZGN-TXEJJXNPSA-N -1 3 297.301 2.568 20 10 CFCDHM O=C([O-])c1ccc([O-])c(C[N@@H+]2CCC23CCCCC3)c1 ZINC001231560795 777259852 /nfs/dbraw/zinc/25/98/52/777259852.db2.gz NEUIPGUGPNTRKW-UHFFFAOYSA-N -1 3 275.348 2.999 20 10 CFCDHM O=C([O-])c1ccc([O-])c(C[N@H+]2CCC23CCCCC3)c1 ZINC001231560795 777259858 /nfs/dbraw/zinc/25/98/58/777259858.db2.gz NEUIPGUGPNTRKW-UHFFFAOYSA-N -1 3 275.348 2.999 20 10 CFCDHM Cc1cc([O-])c(CN2CCOC3(CC3)C2)cc1Cl ZINC001231871214 777359688 /nfs/dbraw/zinc/35/96/88/777359688.db2.gz FZCRFCNDLFEZOQ-UHFFFAOYSA-N -1 3 267.756 2.719 20 10 CFCDHM COc1cc([O-])c(CN2C[C@@H](F)[C@H](F)C2)cc1Cl ZINC001232265775 777499582 /nfs/dbraw/zinc/49/95/82/777499582.db2.gz FNKJKMQCYHCWGI-NXEZZACHSA-N -1 3 277.698 2.546 20 10 CFCDHM [O-]c1c(CN2CC[C@@H]3CCCO[C@@H]3C2)ccc(F)c1F ZINC001233076035 777789246 /nfs/dbraw/zinc/78/92/46/777789246.db2.gz KEAYKKMNIOBXNU-GXFFZTMASA-N -1 3 283.318 2.671 20 10 CFCDHM CCCCN1CCN(Cc2c([O-])ccc(F)c2F)CC1 ZINC001233334637 777893085 /nfs/dbraw/zinc/89/30/85/777893085.db2.gz OHIWJDABHPKKTQ-UHFFFAOYSA-N -1 3 284.350 2.588 20 10 CFCDHM [O-]c1c(CN2CCCOCC2)cccc1C(F)(F)F ZINC001233416097 777943387 /nfs/dbraw/zinc/94/33/87/777943387.db2.gz WHJVSAHDESFDFS-UHFFFAOYSA-N -1 3 275.270 2.633 20 10 CFCDHM CN(Cc1ccncn1)Cc1cccc(C(F)(F)F)c1[O-] ZINC001233419789 777945094 /nfs/dbraw/zinc/94/50/94/777945094.db2.gz MMNRIFRJMYXGMW-UHFFFAOYSA-N -1 3 297.280 2.833 20 10 CFCDHM C[C@H]1CN(Cc2ccc(C(F)(F)F)cc2[O-])CCC1=O ZINC001233452223 777956811 /nfs/dbraw/zinc/95/68/11/777956811.db2.gz OJESNSCLJQSTBC-VIFPVBQESA-N -1 3 287.281 2.822 20 10 CFCDHM O=C1O[C@H]2C[C@@H]1N(Cc1cccc(-c3ccccc3)c1[O-])C2 ZINC001234998786 778348414 /nfs/dbraw/zinc/34/84/14/778348414.db2.gz OFKBLDFKIHXBSU-HOCLYGCPSA-N -1 3 295.338 2.559 20 10 CFCDHM CO[C@H]1CCN(Cc2cc(Cl)c(Cl)cc2[O-])C1 ZINC001236792042 778939936 /nfs/dbraw/zinc/93/99/36/778939936.db2.gz ARBFOHRRSPIAQO-VIFPVBQESA-N -1 3 276.163 2.920 20 10 CFCDHM COc1cc([O-])c(CN2C[C@@H](F)C[C@H]2C)c(Cl)c1 ZINC001236798065 778940906 /nfs/dbraw/zinc/94/09/06/778940906.db2.gz KWWUHDCSABNMRN-BDAKNGLRSA-N -1 3 273.735 2.987 20 10 CFCDHM COc1ccc(CN2[C@@H]3CC[C@H]2CC(=O)C3)c([O-])c1Cl ZINC001236801039 778942492 /nfs/dbraw/zinc/94/24/92/778942492.db2.gz CUUGJVSDOYYROS-PHIMTYICSA-N -1 3 295.766 2.750 20 10 CFCDHM [O-]c1cc(Cl)c(Cl)cc1CN1CCN2CC[C@@H]2C1 ZINC001236805146 778946398 /nfs/dbraw/zinc/94/63/98/778946398.db2.gz VQDAGKIFEJUVGZ-SNVBAGLBSA-N -1 3 287.190 2.589 20 10 CFCDHM COc1cc([O-])c(CN2C[C@@H](C)OC[C@@H]2C)c(Cl)c1 ZINC001236806263 778946477 /nfs/dbraw/zinc/94/64/77/778946477.db2.gz SDKLMLADYYYYOG-VHSXEESVSA-N -1 3 285.771 2.663 20 10 CFCDHM O=C1CCN(Cc2cc3ccccc3cc2[O-])CC1(F)F ZINC001236831809 778958353 /nfs/dbraw/zinc/95/83/53/778958353.db2.gz HYIVGMODHQTFOW-UHFFFAOYSA-N -1 3 291.297 2.956 20 10 CFCDHM C[C@@]1(O)CCN(Cc2c([O-])ccc(Cl)c2Cl)C1 ZINC001237078766 779001539 /nfs/dbraw/zinc/00/15/39/779001539.db2.gz WXJILUASFQOUBJ-GFCCVEGCSA-N -1 3 276.163 2.656 20 10 CFCDHM [O-]c1ccc(Cl)c(Cl)c1CN1CCC[C@@H]1CO ZINC001237078876 779007494 /nfs/dbraw/zinc/00/74/94/779007494.db2.gz ZEKVLPHVXGDHGR-MRVPVSSYSA-N -1 3 276.163 2.656 20 10 CFCDHM C[C@H]1CN(Cc2c([O-])ccc(Cl)c2Cl)CC[C@@H]1O ZINC001237078360 779007730 /nfs/dbraw/zinc/00/77/30/779007730.db2.gz QAMABOSWIZPMKX-KWQFWETISA-N -1 3 290.190 2.902 20 10 CFCDHM [O-]c1ccc(F)c(Cl)c1CN1CCC[C@@]12CCOC2 ZINC001237131946 779022997 /nfs/dbraw/zinc/02/29/97/779022997.db2.gz YSBIGAAXGMBDQU-AWEZNQCLSA-N -1 3 285.746 2.940 20 10 CFCDHM [O-]c1c(F)cc(Cl)cc1CN1CCCC[C@@H](O)C1 ZINC001237617528 779144147 /nfs/dbraw/zinc/14/41/47/779144147.db2.gz SEGJPTXBCJFNMJ-LLVKDONJSA-N -1 3 273.735 2.532 20 10 CFCDHM C[C@@H]1C[C@H](O)CCN1Cc1cc(F)cc(Cl)c1[O-] ZINC001237799632 779181333 /nfs/dbraw/zinc/18/13/33/779181333.db2.gz SHSUEWOEUWLCEA-LDYMZIIASA-N -1 3 273.735 2.530 20 10 CFCDHM [O-]c1c(Cl)cc(F)cc1CN1C[C@H]2[C@H](CF)[C@H]2C1 ZINC001237804920 779183164 /nfs/dbraw/zinc/18/31/64/779183164.db2.gz HYBJUNMDDHPKRW-RTCCRHLQSA-N -1 3 273.710 2.832 20 10 CFCDHM C[C@@H]1CC[C@@H](O)CN1Cc1cc(F)cc(Cl)c1[O-] ZINC001237808669 779184313 /nfs/dbraw/zinc/18/43/13/779184313.db2.gz VSWKOCLJBUSXDN-LDYMZIIASA-N -1 3 273.735 2.530 20 10 CFCDHM C[C@H]1COCCN(Cc2cc(F)c(Cl)cc2[O-])C1 ZINC001237933626 779209419 /nfs/dbraw/zinc/20/94/19/779209419.db2.gz FDGBISLGHXSQOK-SECBINFHSA-N -1 3 273.735 2.653 20 10 CFCDHM C[C@H]1C[C@H](O)CCN1Cc1cc(F)c(Cl)cc1[O-] ZINC001237950716 779216488 /nfs/dbraw/zinc/21/64/88/779216488.db2.gz ZKRAJXFHPOODTK-WCBMZHEXSA-N -1 3 273.735 2.530 20 10 CFCDHM [O-]c1cc(Cl)c(Cl)cc1CN1CCC[C@@H](CO)C1 ZINC001236794761 779638799 /nfs/dbraw/zinc/63/87/99/779638799.db2.gz UNRBJYQVXLGTMN-SECBINFHSA-N -1 3 290.190 2.903 20 10 CFCDHM [O-]c1ccc(Cl)cc1CN1CCO[C@H](CCF)C1 ZINC000700593399 780703591 /nfs/dbraw/zinc/70/35/91/780703591.db2.gz UMMSSVVQJIQXFG-GFCCVEGCSA-N -1 3 273.735 2.606 20 10 CFCDHM [O-]c1cccc(Br)c1CNCC(F)F ZINC000706821936 781203839 /nfs/dbraw/zinc/20/38/39/781203839.db2.gz UTAHRMKMLPSFPM-UHFFFAOYSA-N -1 3 266.085 2.509 20 10 CFCDHM COc1ccc(S(=O)(=O)[N-]c2ccc(O)cc2)cc1C ZINC000142416690 781506496 /nfs/dbraw/zinc/50/64/96/781506496.db2.gz IPRDLKILKMWSDP-UHFFFAOYSA-N -1 3 293.344 2.510 20 10 CFCDHM COC(=O)CN(Cc1c([O-])ccc2ccccc21)C1CC1 ZINC000080300528 347352972 /nfs/dbraw/zinc/35/29/72/347352972.db2.gz CGXXVIRBUVGEBM-UHFFFAOYSA-N -1 3 285.343 2.683 20 10 CFCDHM [O-]c1ccc(Cl)cc1CN1CCS[C@@H]2COCC[C@@H]21 ZINC000091856017 375066653 /nfs/dbraw/zinc/06/66/53/375066653.db2.gz NNXOEPKSMGFGQO-GXTWGEPZSA-N -1 3 299.823 2.752 20 10 CFCDHM O=C(c1cccc(O)c1[O-])N(Cc1cccs1)C1CC1 ZINC000126292190 377221693 /nfs/dbraw/zinc/22/16/93/377221693.db2.gz GEIRJMDABPSFFA-UHFFFAOYSA-N -1 3 289.356 2.964 20 10 CFCDHM C[C@@H]1CCCC[C@@H]1N(C)C(=O)c1cccc(O)c1[O-] ZINC000126337503 377221944 /nfs/dbraw/zinc/22/19/44/377221944.db2.gz AONZUTPDYLQYAL-PWSUYJOCSA-N -1 3 263.337 2.749 20 10 CFCDHM C[C@@H]1CN(Cc2cccc(Cl)c2[O-])C[C@H](C)N1C ZINC000141904012 378243306 /nfs/dbraw/zinc/24/33/06/378243306.db2.gz ZZVVDJFXPMMALH-PHIMTYICSA-N -1 3 268.788 2.570 20 10 CFCDHM CN(Cc1nccs1)Cc1cc(F)ccc1[O-] ZINC000180184343 380630139 /nfs/dbraw/zinc/63/01/39/380630139.db2.gz BMULKSNRTVXZTB-UHFFFAOYSA-N -1 3 252.314 2.620 20 10 CFCDHM O=C(NC[C@@H]1CCCCC1(F)F)c1cccc(O)c1[O-] ZINC000295417606 380841291 /nfs/dbraw/zinc/84/12/91/380841291.db2.gz MDBOLJCUFRDYSZ-VIFPVBQESA-N -1 3 285.290 2.653 20 10 CFCDHM CCN(CC)C(=O)CN(C)Cc1cc(Cl)cc(C)c1[O-] ZINC000183375677 381265693 /nfs/dbraw/zinc/26/56/93/381265693.db2.gz HJJRIQHMQXBTBE-UHFFFAOYSA-N -1 3 298.814 2.654 20 10 CFCDHM CC(C)Cn1cc(CN(C)Cc2ccccc2[O-])cn1 ZINC000183127145 381220766 /nfs/dbraw/zinc/22/07/66/381220766.db2.gz SVADSZLVPKKKAK-UHFFFAOYSA-N -1 3 273.380 2.877 20 10 CFCDHM CC(C)N1CC[C@@H](N[C@@H](C)c2cc(Cl)ccc2[O-])C1=O ZINC000186047712 381811588 /nfs/dbraw/zinc/81/15/88/381811588.db2.gz WGNCAGWTGPKXHG-GXFFZTMASA-N -1 3 296.798 2.706 20 10 CFCDHM CC(C)N1CC[C@H](N[C@@H](C)c2cc(Cl)ccc2[O-])C1=O ZINC000186047691 381811841 /nfs/dbraw/zinc/81/18/41/381811841.db2.gz WGNCAGWTGPKXHG-GWCFXTLKSA-N -1 3 296.798 2.706 20 10 CFCDHM O=C(c1cccc(O)c1[O-])N1CCC(c2ccccn2)CC1 ZINC000377052216 382207225 /nfs/dbraw/zinc/20/72/25/382207225.db2.gz NGJRTRBGLPIIOZ-UHFFFAOYSA-N -1 3 298.342 2.513 20 10 CFCDHM COc1ccncc1CN[C@@H](C)c1cc(F)ccc1[O-] ZINC000293990256 382367751 /nfs/dbraw/zinc/36/77/51/382367751.db2.gz BZAKMTKCLYDTCA-JTQLQIEISA-N -1 3 276.311 2.786 20 10 CFCDHM CC(C)[C@H](C)N(C(=O)c1cccc(O)c1[O-])C1CC1 ZINC000188281310 382382370 /nfs/dbraw/zinc/38/23/70/382382370.db2.gz CLPHOCZMOOPZAO-JTQLQIEISA-N -1 3 263.337 2.747 20 10 CFCDHM COC[C@@H]1CN(Cc2cc(Cl)cc(C)c2[O-])C[C@H](C)O1 ZINC000188336198 382395092 /nfs/dbraw/zinc/39/50/92/382395092.db2.gz BTSCVWSLJMDDQJ-FZMZJTMJSA-N -1 3 299.798 2.590 20 10 CFCDHM Cn1ccnc1[C@H]1N(Cc2ccccc2[O-])CC1(C)C ZINC000294907271 382543318 /nfs/dbraw/zinc/54/33/18/382543318.db2.gz XTVYEDTVKIOGQC-CQSZACIVSA-N -1 3 271.364 2.709 20 10 CFCDHM CN(Cc1cc(Cl)c(F)cc1[O-])C[C@@H]1CCCO1 ZINC000295000616 382559570 /nfs/dbraw/zinc/55/95/70/382559570.db2.gz UUTGSEKHBRHTSF-JTQLQIEISA-N -1 3 273.735 2.796 20 10 CFCDHM COc1cc(C)nc(CN(C)Cc2ccccc2[O-])c1 ZINC000270293482 385044219 /nfs/dbraw/zinc/04/42/19/385044219.db2.gz NSUFAAVAPKUIDF-UHFFFAOYSA-N -1 3 272.348 2.736 20 10 CFCDHM CC[C@H]1CN(Cc2cc(Cl)cc(Cl)c2[O-])C[C@H]1O ZINC000271244956 385377289 /nfs/dbraw/zinc/37/72/89/385377289.db2.gz BXUDJHCLTUUTIS-QPUJVOFHSA-N -1 3 290.190 2.902 20 10 CFCDHM COCc1nc(CN[C@@H](C)c2ccccc2[O-])cs1 ZINC000271645421 385387428 /nfs/dbraw/zinc/38/74/28/385387428.db2.gz HZEIHDGGIYKFFV-JTQLQIEISA-N -1 3 278.377 2.846 20 10 CFCDHM [O-]c1cccc(Cl)c1CNc1nnc(C2CC2)o1 ZINC000271953639 385409930 /nfs/dbraw/zinc/40/99/30/385409930.db2.gz CKKGXNMFDLKKSB-UHFFFAOYSA-N -1 3 265.700 2.918 20 10 CFCDHM CCN(Cc1ccccn1)Cc1cccc(F)c1[O-] ZINC000272339696 385514502 /nfs/dbraw/zinc/51/45/02/385514502.db2.gz YNHNAJPUGYVGMV-UHFFFAOYSA-N -1 3 260.312 2.948 20 10 CFCDHM Cc1ccc(C(=O)N2CC[C@H](C)C[C@H]2C)c([O-])c1O ZINC000272804594 385618993 /nfs/dbraw/zinc/61/89/93/385618993.db2.gz ZCIXODIZRIMYKX-GXSJLCMTSA-N -1 3 263.337 2.667 20 10 CFCDHM COC(=O)c1ccc([O-])c([C@@H](C)NCc2ccoc2)c1 ZINC000273412739 385681400 /nfs/dbraw/zinc/68/14/00/385681400.db2.gz PZNGZERJEVGNJZ-SNVBAGLBSA-N -1 3 275.304 2.623 20 10 CFCDHM CN(Cc1cn(C)nc1C(F)F)Cc1ccccc1[O-] ZINC000274464353 385805365 /nfs/dbraw/zinc/80/53/65/385805365.db2.gz IEKJGWASQIWRDG-UHFFFAOYSA-N -1 3 281.306 2.695 20 10 CFCDHM CCCCc1noc(CN(C)Cc2ccccc2[O-])n1 ZINC000109770361 393879323 /nfs/dbraw/zinc/87/93/23/393879323.db2.gz GCXJDOCYTDIFLY-UHFFFAOYSA-N -1 3 275.352 2.750 20 10 CFCDHM Cc1ccc(C(=O)NC[C@H]2CCC(F)(F)C2)c([O-])c1O ZINC000281918421 394093657 /nfs/dbraw/zinc/09/36/57/394093657.db2.gz VKMCKUPYNMWRQT-VIFPVBQESA-N -1 3 285.290 2.571 20 10 CFCDHM CC(C)c1nc(CN[C@H](C)c2ccc(F)c(F)c2[O-])n[nH]1 ZINC000296464389 394309081 /nfs/dbraw/zinc/30/90/81/394309081.db2.gz NLISVWYDUDVKSJ-MRVPVSSYSA-N -1 3 296.321 2.763 20 10 CFCDHM Cc1cc(F)ccc1S(=O)(=O)[N-]c1ccc(O)cc1 ZINC000005234378 170077842 /nfs/dbraw/zinc/07/78/42/170077842.db2.gz WUCJZZNNENRFNX-UHFFFAOYSA-N -1 3 281.308 2.641 20 10 CFCDHM CC[C@H](c1ccccc1[O-])N1CC(F)(F)C[C@H]1CO ZINC000368037696 267140413 /nfs/dbraw/zinc/14/04/13/267140413.db2.gz NMKNGVHHGABUTC-CMPLNLGQSA-N -1 3 271.307 2.545 20 10 CFCDHM [O-]c1ccccc1CN1CCCC[C@H]1c1ncc[nH]1 ZINC000179566316 275061729 /nfs/dbraw/zinc/06/17/29/275061729.db2.gz OKFKVXJISDCFAX-ZDUSSCGKSA-N -1 3 257.337 2.843 20 10 CFCDHM CC1(C)OC[C@@H]2C[C@@]21NCc1c([O-])ccc(Cl)c1F ZINC000527765806 330281675 /nfs/dbraw/zinc/28/16/75/330281675.db2.gz JUBBBJSSSFRGAJ-RMLUDKJBSA-N -1 3 285.746 2.842 20 10 CFCDHM CCO[C@@]1(C)C[C@H]1NCc1c([O-])cccc1Cl ZINC000527782973 330283156 /nfs/dbraw/zinc/28/31/56/330283156.db2.gz COIPUFCJBCKURA-OLZOCXBDSA-N -1 3 255.745 2.703 20 10 CFCDHM CC(=O)c1cc(F)cc(CN2CCC=C(C)C2)c1[O-] ZINC000280958706 518282953 /nfs/dbraw/zinc/28/29/53/518282953.db2.gz YNXXMBAPMOSTTJ-UHFFFAOYSA-N -1 3 263.312 2.886 20 10 CFCDHM CC(=O)c1cc(F)cc(CN2C[C@H](C)OC(C)(C)C2)c1[O-] ZINC000045699072 518287315 /nfs/dbraw/zinc/28/73/15/518287315.db2.gz QREROGBBWHUGHO-JTQLQIEISA-N -1 3 295.354 2.733 20 10 CFCDHM CCCCN(Cc1nnc(C)[nH]1)Cc1ccccc1[O-] ZINC000292978867 520549539 /nfs/dbraw/zinc/54/95/39/520549539.db2.gz XHTUENCBQGCGGP-UHFFFAOYSA-N -1 3 274.368 2.621 20 10 CFCDHM CCN(Cc1cc(F)cc(C(C)=O)c1[O-])C[C@H]1CCCO1 ZINC000048965251 521292571 /nfs/dbraw/zinc/29/25/71/521292571.db2.gz IHHDCZZTONSCFM-CQSZACIVSA-N -1 3 295.354 2.735 20 10 CFCDHM CN(C)c1ccc(CNCc2c([O-])cccc2Cl)cn1 ZINC000264935454 522208863 /nfs/dbraw/zinc/20/88/63/522208863.db2.gz CPKFOGWYFHOAMY-UHFFFAOYSA-N -1 3 291.782 2.796 20 10 CFCDHM CCc1nnc(CN[C@@H](C)c2cc(F)ccc2[O-])s1 ZINC000289597709 522741284 /nfs/dbraw/zinc/74/12/84/522741284.db2.gz BKFWCQKAKRQPNX-QMMMGPOBSA-N -1 3 281.356 2.796 20 10 CFCDHM COC(=O)[C@H]1CCN(Cc2c([O-])cccc2Cl)C[C@@H]1C ZINC000276424098 523962191 /nfs/dbraw/zinc/96/21/91/523962191.db2.gz GNUBZPVGICPNOY-QWRGUYRKSA-N -1 3 297.782 2.677 20 10 CFCDHM C[C@@H]1CN(C(=O)c2cccc(O)c2[O-])[C@H]1c1ccccc1 ZINC000187148283 524872647 /nfs/dbraw/zinc/87/26/47/524872647.db2.gz YUOHVNFKBPRYSY-IAQYHMDHSA-N -1 3 283.327 2.931 20 10 CFCDHM C[C@H](N[C@@H](C)c1cc(Cl)ccc1[O-])c1ncnn1C ZINC000276684061 525528173 /nfs/dbraw/zinc/52/81/73/525528173.db2.gz TYTAKOJDBWCPLZ-IUCAKERBSA-N -1 3 280.759 2.586 20 10 CFCDHM C[C@@H](N[C@@H](C)c1cnn(C)c1)c1ccc(F)c(F)c1[O-] ZINC000276883676 525621992 /nfs/dbraw/zinc/62/19/92/525621992.db2.gz GLAHPHFDXODQHI-DTWKUNHWSA-N -1 3 281.306 2.816 20 10 CFCDHM Cc1c([C@@H](C)N[C@H](C)c2ccc(F)cc2[O-])cnn1C ZINC000062747620 525902554 /nfs/dbraw/zinc/90/25/54/525902554.db2.gz IJOYCFFOAMLDJD-NXEZZACHSA-N -1 3 277.343 2.985 20 10 CFCDHM O=C(c1cccc(O)c1[O-])N1CC=C(c2ccccc2F)C1 ZINC000365759114 526769532 /nfs/dbraw/zinc/76/95/32/526769532.db2.gz RFFRKACLPFLMCN-UHFFFAOYSA-N -1 3 299.301 2.776 20 10 CFCDHM CCO[C@@H]1C[C@H](N(C)C(=O)c2cc([O-])cs2)C1(C)C ZINC000754905148 574127614 /nfs/dbraw/zinc/12/76/14/574127614.db2.gz CWQLMUJSFIQFEY-NWDGAFQWSA-N -1 3 283.393 2.729 20 10 CFCDHM CO[C@]1(C)C[C@@H](N(C)C(=O)c2cc([O-])cs2)C1(C)C ZINC000754908418 574128008 /nfs/dbraw/zinc/12/80/08/574128008.db2.gz VKAJTUJFWAHPKK-BXUZGUMPSA-N -1 3 283.393 2.729 20 10 CFCDHM O=C(NCc1ccc(-n2cccn2)cc1)c1cc([O-])cs1 ZINC000731870378 574131311 /nfs/dbraw/zinc/13/13/11/574131311.db2.gz XLFBWXGJWFSGRR-UHFFFAOYSA-N -1 3 299.355 2.569 20 10 CFCDHM Cc1cccc(C)c1OCCNC(=O)c1cc([O-])cs1 ZINC000731871784 574131324 /nfs/dbraw/zinc/13/13/24/574131324.db2.gz OLHHXEFFJVSRDR-UHFFFAOYSA-N -1 3 291.372 2.879 20 10 CFCDHM O=C(Nc1ccn(-c2ccccc2)n1)c1cc([O-])cs1 ZINC000731867092 574132333 /nfs/dbraw/zinc/13/23/33/574132333.db2.gz FESKHZWABGHYCP-UHFFFAOYSA-N -1 3 285.328 2.892 20 10 CFCDHM COc1cccc([C@@H](C)NC(=O)c2cc([O-])cs2)c1 ZINC000732267467 574147920 /nfs/dbraw/zinc/14/79/20/574147920.db2.gz GEETUMWHTNVGJK-SECBINFHSA-N -1 3 277.345 2.953 20 10 CFCDHM C[C@H](c1ccco1)N(C)C(=O)c1cc([O-])cs1 ZINC000732268385 574147990 /nfs/dbraw/zinc/14/79/90/574147990.db2.gz DOOKWOBGHMQFAT-MRVPVSSYSA-N -1 3 251.307 2.880 20 10 CFCDHM O=C(NCCCOc1ccccc1F)c1cc([O-])cs1 ZINC000732259585 574148200 /nfs/dbraw/zinc/14/82/00/574148200.db2.gz RYABZWASEMHAMO-UHFFFAOYSA-N -1 3 295.335 2.792 20 10 CFCDHM CCO[C@H](CCNC(=O)c1cc([O-])cs1)C(C)C ZINC000746409602 574148354 /nfs/dbraw/zinc/14/83/54/574148354.db2.gz HWXONKROTZDFKA-LLVKDONJSA-N -1 3 271.382 2.635 20 10 CFCDHM O=C(NCCOC1CCCCC1)c1cc([O-])cs1 ZINC000732274926 574148582 /nfs/dbraw/zinc/14/85/82/574148582.db2.gz CZTMQFKULUFGPG-UHFFFAOYSA-N -1 3 269.366 2.533 20 10 CFCDHM O=C(Nc1ccc2c(c1)CCC(=O)N2)c1cc([O-])cs1 ZINC000732269202 574148835 /nfs/dbraw/zinc/14/88/35/574148835.db2.gz QWVWOGZSSRNRHK-UHFFFAOYSA-N -1 3 288.328 2.591 20 10 CFCDHM CN(Cc1ccsc1)C(=O)c1cc([O-])cs1 ZINC000732257788 574149605 /nfs/dbraw/zinc/14/96/05/574149605.db2.gz BVGYQHUTNYNPMK-UHFFFAOYSA-N -1 3 253.348 2.787 20 10 CFCDHM CCOc1ccccc1CCNC(=O)c1cc([O-])cs1 ZINC000732284618 574149855 /nfs/dbraw/zinc/14/98/55/574149855.db2.gz VFBXIPJWQYJRSS-UHFFFAOYSA-N -1 3 291.372 2.825 20 10 CFCDHM CCCCn1nccc1NC(=O)c1cc([O-])cs1 ZINC000732281475 574149870 /nfs/dbraw/zinc/14/98/70/574149870.db2.gz KWLAPBSTGHFQHT-UHFFFAOYSA-N -1 3 265.338 2.703 20 10 CFCDHM O=C(NC[C@H]1CCOc2ccccc21)c1cc([O-])cs1 ZINC000732289677 574150444 /nfs/dbraw/zinc/15/04/44/574150444.db2.gz BJHDNUVMNYGVMX-SNVBAGLBSA-N -1 3 289.356 2.750 20 10 CFCDHM COc1ccc(O)c([C@@H](C)NC(=O)c2cc([O-])cs2)c1 ZINC000732287602 574150475 /nfs/dbraw/zinc/15/04/75/574150475.db2.gz YHIJELPCAMFPEG-MRVPVSSYSA-N -1 3 293.344 2.659 20 10 CFCDHM CCCO[C@H]1CCCN(C(=O)c2cc([O-])cs2)CC1 ZINC000732290669 574150803 /nfs/dbraw/zinc/15/08/03/574150803.db2.gz WGPJKWJRNQWCTO-LBPRGKRZSA-N -1 3 283.393 2.875 20 10 CFCDHM Cc1cc([O-])c(C[NH+]2CCC(N(C)C(=O)[O-])CC2)cc1C ZINC000738239791 574161501 /nfs/dbraw/zinc/16/15/01/574161501.db2.gz MDHNVHZRHXNSOR-UHFFFAOYSA-N -1 3 292.379 2.583 20 10 CFCDHM Cc1cc([O-])c(C[NH+]2CCC3(C[C@H]3C(=O)[O-])CC2)cc1C ZINC000738464028 574170474 /nfs/dbraw/zinc/17/04/74/574170474.db2.gz XFHYZBUVQWIOOM-AWEZNQCLSA-N -1 3 289.375 2.696 20 10 CFCDHM O=C(NC/C=C/c1ccccc1)c1cc([O-])cs1 ZINC000733000130 574182482 /nfs/dbraw/zinc/18/24/82/574182482.db2.gz NTRUIDPVTCHJPS-QPJJXVBHSA-N -1 3 259.330 2.897 20 10 CFCDHM Cc1oc(CN(C)Cc2ccccc2O)cc1C(=O)[O-] ZINC000738967118 574191471 /nfs/dbraw/zinc/19/14/71/574191471.db2.gz PBHJHENMERCYSW-UHFFFAOYSA-N -1 3 275.304 2.624 20 10 CFCDHM COc1ccc(O)c([C@@H](C)NC(=O)c2ccccc2[O-])c1 ZINC000729279118 574195919 /nfs/dbraw/zinc/19/59/19/574195919.db2.gz ZMYRSGJCAKQSLA-SNVBAGLBSA-N -1 3 287.315 2.597 20 10 CFCDHM COc1ccc(CNCc2nnc(C(C)C)s2)c([O-])c1 ZINC000756132949 574211701 /nfs/dbraw/zinc/21/17/01/574211701.db2.gz SXQSWQYMUVUEQI-UHFFFAOYSA-N -1 3 293.392 2.666 20 10 CFCDHM COc1ccc(CN[C@@H]2CCCCN(C(=O)[O-])C2)cc1C ZINC000739903149 574228263 /nfs/dbraw/zinc/22/82/63/574228263.db2.gz MAZKKXKZNAZCHD-CQSZACIVSA-N -1 3 292.379 2.626 20 10 CFCDHM Cc1noc(C)c1CN[C@H](C)c1cc([N+](=O)[O-])ccc1[O-] ZINC000756461864 574238944 /nfs/dbraw/zinc/23/89/44/574238944.db2.gz WMESPGHPQRPHGT-MRVPVSSYSA-N -1 3 291.307 2.756 20 10 CFCDHM CCc1cc(CN[C@@H](C)c2cc(F)cc(F)c2[O-])n[nH]1 ZINC000756575525 574249569 /nfs/dbraw/zinc/24/95/69/574249569.db2.gz VHOJZXOMCZCPGM-QMMMGPOBSA-N -1 3 281.306 2.807 20 10 CFCDHM CCc1cc(CN[C@@H](C)c2cc(F)cc(F)c2[O-])[nH]n1 ZINC000756575525 574249571 /nfs/dbraw/zinc/24/95/71/574249571.db2.gz VHOJZXOMCZCPGM-QMMMGPOBSA-N -1 3 281.306 2.807 20 10 CFCDHM O=C(NCCC1Cc2ccccc2C1)c1cc([O-])cs1 ZINC000756807720 574264602 /nfs/dbraw/zinc/26/46/02/574264602.db2.gz BGVWOVDWRGMMHL-UHFFFAOYSA-N -1 3 287.384 2.989 20 10 CFCDHM CCc1ccc([O-])c(C(=O)NCc2ccc(N(C)C)cc2)c1 ZINC000748829878 574270677 /nfs/dbraw/zinc/27/06/77/574270677.db2.gz QVXXICQFAKENDO-UHFFFAOYSA-N -1 3 298.386 2.951 20 10 CFCDHM C[C@@H]([NH2+]Cc1cccc(C(=O)[O-])c1)c1ccccc1[O-] ZINC000820148551 597733902 /nfs/dbraw/zinc/73/39/02/597733902.db2.gz OWAUKYGKPWXHIE-LLVKDONJSA-N -1 3 271.316 2.941 20 10 CFCDHM C[N@H+](Cc1ccc(C(=O)[O-])cc1)Cc1ccccc1[O-] ZINC000086725241 600142256 /nfs/dbraw/zinc/14/22/56/600142256.db2.gz DZFIXYHVLNHJPJ-UHFFFAOYSA-N -1 3 271.316 2.722 20 10 CFCDHM C[N@@H+](Cc1ccc(C(=O)[O-])cc1)Cc1ccccc1[O-] ZINC000086725241 600142258 /nfs/dbraw/zinc/14/22/58/600142258.db2.gz DZFIXYHVLNHJPJ-UHFFFAOYSA-N -1 3 271.316 2.722 20 10 CFCDHM CCC[N@H+](C/C=C(/C)C(=O)[O-])Cc1ccccc1[O-] ZINC000829486308 601161439 /nfs/dbraw/zinc/16/14/39/601161439.db2.gz BMSOLRUKNXVEDP-WQLSENKSSA-N -1 3 263.337 2.635 20 10 CFCDHM CCC[N@@H+](C/C=C(/C)C(=O)[O-])Cc1ccccc1[O-] ZINC000829486308 601161440 /nfs/dbraw/zinc/16/14/40/601161440.db2.gz BMSOLRUKNXVEDP-WQLSENKSSA-N -1 3 263.337 2.635 20 10 CFCDHM C[C@@]1(C(=O)[O-])CC[N@H+](Cc2c([O-])ccc3ccccc32)C1 ZINC000086779215 601892514 /nfs/dbraw/zinc/89/25/14/601892514.db2.gz PBPRVMYGKQISOY-QGZVFWFLSA-N -1 3 285.343 2.842 20 10 CFCDHM C[C@@]1(C(=O)[O-])CC[N@@H+](Cc2c([O-])ccc3ccccc32)C1 ZINC000086779215 601892517 /nfs/dbraw/zinc/89/25/17/601892517.db2.gz PBPRVMYGKQISOY-QGZVFWFLSA-N -1 3 285.343 2.842 20 10 CFCDHM C[C@]1(C(=O)[O-])CC[N@H+](Cc2c([O-])ccc3ccccc32)C1 ZINC000086779212 601892527 /nfs/dbraw/zinc/89/25/27/601892527.db2.gz PBPRVMYGKQISOY-KRWDZBQOSA-N -1 3 285.343 2.842 20 10 CFCDHM C[C@]1(C(=O)[O-])CC[N@@H+](Cc2c([O-])ccc3ccccc32)C1 ZINC000086779212 601892531 /nfs/dbraw/zinc/89/25/31/601892531.db2.gz PBPRVMYGKQISOY-KRWDZBQOSA-N -1 3 285.343 2.842 20 10 CFCDHM CC(C)C[C@@H](CNC(=O)[O-])[NH2+][C@@H](C)c1ccccc1[O-] ZINC000833793354 606039471 /nfs/dbraw/zinc/03/94/71/606039471.db2.gz DSOITXRZGZLSDT-RYUDHWBXSA-N -1 3 280.368 2.725 20 10 CFCDHM C[C@@H]1C[C@@H]1[C@@H]1C[C@H]1CNC(=O)NCc1c([O-])cccc1F ZINC000924044691 617918376 /nfs/dbraw/zinc/91/83/76/617918376.db2.gz XDONNLDETAKXLG-NOOOWODRSA-N -1 3 292.354 2.623 20 10 CFCDHM CCS[C@H]1CC[C@H](N(C)C(=O)c2cccc(O)c2[O-])C1 ZINC000187191111 618274350 /nfs/dbraw/zinc/27/43/50/618274350.db2.gz YBHKSRZYKGOLMR-QWRGUYRKSA-N -1 3 295.404 2.844 20 10 CFCDHM CC1(C)CN(Cc2cc(F)cc(F)c2[O-])CCS1 ZINC000894035441 618277622 /nfs/dbraw/zinc/27/76/22/618277622.db2.gz YCQUGCSIYDOPBQ-UHFFFAOYSA-N -1 3 273.348 2.998 20 10 CFCDHM C[C@H]1CN(Cc2cc(Cl)cc(F)c2[O-])[C@@H](C)CN1C ZINC000775984936 618402032 /nfs/dbraw/zinc/40/20/32/618402032.db2.gz ILORRTKTMIUPLR-UWVGGRQHSA-N -1 3 286.778 2.709 20 10 CFCDHM Cc1cc([O-])c(CN2CCCC3(C2)OCCO3)c(Cl)c1 ZINC000840937659 619077900 /nfs/dbraw/zinc/07/79/00/619077900.db2.gz UEZHGCYHEXJYHQ-UHFFFAOYSA-N -1 3 297.782 2.693 20 10 CFCDHM [O-]c1c(F)cc(F)cc1CN1CCSC[C@@H]1C1CC1 ZINC000894903657 619508366 /nfs/dbraw/zinc/50/83/66/619508366.db2.gz AWDMBVDQUSRAEI-CYBMUJFWSA-N -1 3 285.359 2.998 20 10 CFCDHM Cc1cc([O-])c(CN2CCc3ncncc3C2)cc1Cl ZINC000895724391 619592031 /nfs/dbraw/zinc/59/20/31/619592031.db2.gz OYVCTUVYSUTYNO-UHFFFAOYSA-N -1 3 289.766 2.702 20 10 CFCDHM [O-]c1cccc(F)c1CNCc1cnc(C2CC2)o1 ZINC000896644453 619778305 /nfs/dbraw/zinc/77/83/05/619778305.db2.gz WLIHOQJSLWPUDZ-UHFFFAOYSA-N -1 3 262.284 2.687 20 10 CFCDHM CC(C)Cn1nccc1CNCc1c([O-])cccc1F ZINC000896638828 619781124 /nfs/dbraw/zinc/78/11/24/619781124.db2.gz RBHZCHYQJCAAMQ-UHFFFAOYSA-N -1 3 277.343 2.674 20 10 CFCDHM [O-]c1cccc(F)c1CNCc1cc(C2CC2)no1 ZINC000896641632 619781991 /nfs/dbraw/zinc/78/19/91/619781991.db2.gz OCIRNNUCHQRVKH-UHFFFAOYSA-N -1 3 262.284 2.687 20 10 CFCDHM O=C(/C=C\C1CCCC1)NCc1c([O-])cccc1F ZINC000928706594 619995944 /nfs/dbraw/zinc/99/59/44/619995944.db2.gz RIHSJPYDUMODIF-HJWRWDBZSA-N -1 3 263.312 2.894 20 10 CFCDHM [O-]c1c(Cl)cccc1CNCc1nccn1C1CC1 ZINC000898215577 620346672 /nfs/dbraw/zinc/34/66/72/620346672.db2.gz NZYXLXBKGSHINO-UHFFFAOYSA-N -1 3 277.755 2.867 20 10 CFCDHM CCCCCNC(=O)NCc1c([O-])cccc1F ZINC000905147917 621711111 /nfs/dbraw/zinc/71/11/11/621711111.db2.gz KJHVTNNGSQDGRN-UHFFFAOYSA-N -1 3 254.305 2.521 20 10 CFCDHM CC(C)c1cnc(NC(=O)c2cccc(O)c2[O-])s1 ZINC000185743609 625771821 /nfs/dbraw/zinc/77/18/21/625771821.db2.gz DFOYTCNREVJZCY-UHFFFAOYSA-N -1 3 278.333 2.930 20 10 CFCDHM O=[N+]([O-])c1cc(Cl)cc(CNCc2ccoc2)c1[O-] ZINC000171128402 623206675 /nfs/dbraw/zinc/20/66/75/623206675.db2.gz PHPOXCMXXQGQDP-UHFFFAOYSA-N -1 3 282.683 2.837 20 10 CFCDHM CC[C@H]1CN(Cc2cc(Cl)c(C)cc2[O-])CCO1 ZINC000824547940 623521951 /nfs/dbraw/zinc/52/19/51/623521951.db2.gz FBZRJXRNALPAKU-LBPRGKRZSA-N -1 3 269.772 2.965 20 10 CFCDHM Cc1cc([O-])c(CNCc2cocn2)cc1Cl ZINC000825291529 623664345 /nfs/dbraw/zinc/66/43/45/623664345.db2.gz MYDLTTLZHZIWPH-UHFFFAOYSA-N -1 3 252.701 2.632 20 10 CFCDHM Cc1ccc(C(=O)Nc2ncsc2C2CC2)c([O-])c1O ZINC000914117303 623702684 /nfs/dbraw/zinc/70/26/84/623702684.db2.gz LKBSRFOUTDFOND-UHFFFAOYSA-N -1 3 290.344 2.992 20 10 CFCDHM Cc1cc([O-])c(CN[C@@H]2C[C@H](C)n3ncnc32)cc1Cl ZINC000826887815 623903560 /nfs/dbraw/zinc/90/35/60/623903560.db2.gz AJQUEOVCZJGKQN-JOYOIKCWSA-N -1 3 292.770 2.741 20 10 CFCDHM Cc1cc([O-])c(CN2CC[C@@H](O)C(F)(F)C2)c(Cl)c1 ZINC000826952819 623914211 /nfs/dbraw/zinc/91/42/11/623914211.db2.gz UJWBKODOWCXNSP-GFCCVEGCSA-N -1 3 291.725 2.556 20 10 CFCDHM Cc1nnc(CN(C)Cc2cc(Cl)c(C)cc2[O-])o1 ZINC000827039492 623928503 /nfs/dbraw/zinc/92/85/03/623928503.db2.gz WMDLQZSRXMMGKC-UHFFFAOYSA-N -1 3 281.743 2.677 20 10 CFCDHM C[C@@H]1CN(Cc2c([O-])ccc(Cl)c2F)C[C@@]1(C)CO ZINC000827691845 624065849 /nfs/dbraw/zinc/06/58/49/624065849.db2.gz CIGACNZXRAYBHV-OTYXRUKQSA-N -1 3 287.762 2.635 20 10 CFCDHM O=C(N[C@H]1CCSC2(CCC2)C1)c1cccc(O)c1[O-] ZINC000834735722 625820772 /nfs/dbraw/zinc/82/07/72/625820772.db2.gz WFLKZEUNHMBATN-JTQLQIEISA-N -1 3 293.388 2.646 20 10 CFCDHM CCC[C@H](NC(=O)c1cccc(O)c1[O-])C1CCC1 ZINC000325205422 625889571 /nfs/dbraw/zinc/88/95/71/625889571.db2.gz IWVNRBWEWHOJAQ-LBPRGKRZSA-N -1 3 263.337 2.796 20 10 CFCDHM CCc1nc(CN[C@@H](C)c2ccc(F)cc2[O-])co1 ZINC000834900979 625915534 /nfs/dbraw/zinc/91/55/34/625915534.db2.gz YCQWQWMOPDCQCD-VIFPVBQESA-N -1 3 264.300 2.933 20 10 CFCDHM COc1cccnc1CN[C@@H](C)c1ccc(F)cc1[O-] ZINC000834906342 625918517 /nfs/dbraw/zinc/91/85/17/625918517.db2.gz PCZMRXPSSDMNJV-JTQLQIEISA-N -1 3 276.311 2.786 20 10 CFCDHM O=C(NCc1c([O-])cccc1F)NCC1(C2CC2)CC1 ZINC000921613528 625993743 /nfs/dbraw/zinc/99/37/43/625993743.db2.gz IMAQJYNTRLDNBT-UHFFFAOYSA-N -1 3 278.327 2.521 20 10 CFCDHM O=C(NCCC1=CCCC1)NCc1c([O-])cccc1F ZINC000921625028 626001556 /nfs/dbraw/zinc/00/15/56/626001556.db2.gz OGYDSBVDAVHGSM-UHFFFAOYSA-N -1 3 278.327 2.831 20 10 CFCDHM O=[N+]([O-])c1ccc([O-])c(CN[C@H](c2ccccn2)C2CC2)c1 ZINC000922586407 626318337 /nfs/dbraw/zinc/31/83/37/626318337.db2.gz LYDSWMGCPVWZEN-INIZCTEOSA-N -1 3 299.330 2.936 20 10 CFCDHM [O-]c1cccc(Cl)c1CNc1nncn1C1CC1 ZINC000922658055 626335386 /nfs/dbraw/zinc/33/53/86/626335386.db2.gz IHXNYXZSXGTQQD-UHFFFAOYSA-N -1 3 264.716 2.584 20 10 CFCDHM O=C(NCc1c([O-])cccc1F)N[C@H](C1CC1)C1CCC1 ZINC000922815431 626371787 /nfs/dbraw/zinc/37/17/87/626371787.db2.gz BVGVTHRARGFQIO-HNNXBMFYSA-N -1 3 292.354 2.909 20 10 CFCDHM O=C(NCc1c([O-])cccc1F)N[C@@H]1CC[C@H]2C[C@H]2C1 ZINC000923040048 626445787 /nfs/dbraw/zinc/44/57/87/626445787.db2.gz IEHJWONEKSPUHP-GARJFASQSA-N -1 3 278.327 2.519 20 10 CFCDHM CC(C)(C)OCCCNC(=O)NCc1c([O-])cccc1F ZINC000923269404 626461738 /nfs/dbraw/zinc/46/17/38/626461738.db2.gz WCOWYYGIXGMJPM-UHFFFAOYSA-N -1 3 298.358 2.536 20 10 CFCDHM O=C1C[C@H]2CC[C@@H](C1)N2Cc1cc(Cl)c(F)cc1[O-] ZINC000839129636 626527701 /nfs/dbraw/zinc/52/77/01/626527701.db2.gz NDTPLGJIHOJDOI-AOOOYVTPSA-N -1 3 283.730 2.881 20 10 CFCDHM [O-]c1c(Cl)cccc1CN1CC2(C1)CCOCC2 ZINC000839141647 626528515 /nfs/dbraw/zinc/52/85/15/626528515.db2.gz UZGFYBUJVYDCGE-UHFFFAOYSA-N -1 3 267.756 2.658 20 10 CFCDHM C[C@H](NCc1cccc(Cl)c1[O-])c1ccn(C)n1 ZINC000839190639 626530660 /nfs/dbraw/zinc/53/06/60/626530660.db2.gz JBVIAHQGJDHTBM-VIFPVBQESA-N -1 3 265.744 2.630 20 10 CFCDHM COC(=O)c1ccc(NCc2c([O-])cccc2Cl)cn1 ZINC000758470480 626595235 /nfs/dbraw/zinc/59/52/35/626595235.db2.gz JPIJJFMSCCWTMU-UHFFFAOYSA-N -1 3 292.722 2.839 20 10 CFCDHM CC[C@@]1(C)COCCN1Cc1cc(F)cc(C(C)=O)c1[O-] ZINC000761102441 626805463 /nfs/dbraw/zinc/80/54/63/626805463.db2.gz RKIDQEHRKSUVKM-INIZCTEOSA-N -1 3 295.354 2.735 20 10 CFCDHM [O-]c1c(F)cc(Cl)cc1CN1CCC(CCO)CC1 ZINC000775647859 628047163 /nfs/dbraw/zinc/04/71/63/628047163.db2.gz FKJMABFMGFXICC-UHFFFAOYSA-N -1 3 287.762 2.779 20 10 CFCDHM [O-]c1c(Cl)cccc1CNCc1cn2ccccc2n1 ZINC000775807849 628071230 /nfs/dbraw/zinc/07/12/30/628071230.db2.gz LSFUCWRQCUMAJI-UHFFFAOYSA-N -1 3 287.750 2.983 20 10 CFCDHM C[C@@H]1[C@H](C)N(Cc2cc(Cl)cc(F)c2[O-])CCN1C ZINC000775987033 628092234 /nfs/dbraw/zinc/09/22/34/628092234.db2.gz UATGMJUIZHKCOC-ZJUUUORDSA-N -1 3 286.778 2.709 20 10 CFCDHM COC(=O)[C@H]1C[C@@H](C)CCN1Cc1cc(Cl)ccc1[O-] ZINC000776003103 628093407 /nfs/dbraw/zinc/09/34/07/628093407.db2.gz WRTGBWKATGPFDZ-GXFFZTMASA-N -1 3 297.782 2.819 20 10 CFCDHM CC[C@@]1(O)CCN(Cc2cc(Cl)cc(C(C)=O)c2[O-])C1 ZINC000778405336 628305481 /nfs/dbraw/zinc/30/54/81/628305481.db2.gz OCLKSYYBEVANFQ-OAHLLOKOSA-N -1 3 297.782 2.595 20 10 CFCDHM Cc1cc(NC(=O)c2ccc(C)c(O)c2[O-])cc2n[nH]cc21 ZINC000781000272 628512257 /nfs/dbraw/zinc/51/22/57/628512257.db2.gz HHHXKYPEJPKMSK-UHFFFAOYSA-N -1 3 297.314 2.843 20 10 CFCDHM O=C(NC[C@@H]1CCC[C@H]1C1CC1)c1cccc(O)c1[O-] ZINC000839804906 628544642 /nfs/dbraw/zinc/54/46/42/628544642.db2.gz CVEOQORYMWXHLD-RYUDHWBXSA-N -1 3 275.348 2.654 20 10 CFCDHM O=C(Nc1cccc(-n2cccn2)c1)c1cccc(O)c1[O-] ZINC000790538615 629246774 /nfs/dbraw/zinc/24/67/74/629246774.db2.gz JVPILGXPVBNJJU-UHFFFAOYSA-N -1 3 295.298 2.536 20 10 CFCDHM Cc1ccc2c(c1)N(C(=O)c1cccc(O)c1[O-])CC2 ZINC000790598791 629251259 /nfs/dbraw/zinc/25/12/59/629251259.db2.gz PREQRLBZARDKKN-UHFFFAOYSA-N -1 3 269.300 2.609 20 10 CFCDHM O=C(N[C@@H]1CC[C@H]2CCC[C@@H]2C1)c1cccc(O)c1[O-] ZINC000790792529 629262825 /nfs/dbraw/zinc/26/28/25/629262825.db2.gz FTFDESLLCXEEHY-IJLUTSLNSA-N -1 3 275.348 2.796 20 10 CFCDHM O=C(c1cccc(O)c1[O-])N1CC[C@@H]1Cc1ccccc1 ZINC000790842732 629268800 /nfs/dbraw/zinc/26/88/00/629268800.db2.gz JFUDJFOVQMKCKU-CYBMUJFWSA-N -1 3 283.327 2.555 20 10 CFCDHM C[C@@H]1CN(C)[C@@H](C)CN1Cc1c([O-])ccc(Cl)c1F ZINC000792173856 629406121 /nfs/dbraw/zinc/40/61/21/629406121.db2.gz DPMCGKGFLXKNHX-VHSXEESVSA-N -1 3 286.778 2.709 20 10 CFCDHM C[C@@H](NCc1cccnc1F)c1ccc(F)cc1[O-] ZINC000794836256 629692512 /nfs/dbraw/zinc/69/25/12/629692512.db2.gz OTLDQJPWXZXLFS-SECBINFHSA-N -1 3 264.275 2.916 20 10 CFCDHM CC1(CC(F)(F)F)CN(C(=O)c2cccc(O)c2[O-])C1 ZINC000837186768 630972311 /nfs/dbraw/zinc/97/23/11/630972311.db2.gz UPMIUIPOWPNVAU-UHFFFAOYSA-N -1 3 289.253 2.512 20 10 CFCDHM CC(C)[C@H](NCc1cccc(Cl)c1[O-])c1nncn1C ZINC000809691549 631263675 /nfs/dbraw/zinc/26/36/75/631263675.db2.gz JQDNJUHHVKPVJC-LBPRGKRZSA-N -1 3 294.786 2.661 20 10 CFCDHM Cc1cc([O-])c(CN(C)Cc2ccon2)c(Cl)c1 ZINC000840916611 631263727 /nfs/dbraw/zinc/26/37/27/631263727.db2.gz CEIQWSZUYNNDGE-UHFFFAOYSA-N -1 3 266.728 2.974 20 10 CFCDHM CCN1CCN(Cc2c([O-])ccc(Cl)c2F)[C@H](C)C1 ZINC000809697839 631267147 /nfs/dbraw/zinc/26/71/47/631267147.db2.gz PSTOFDNWGUTLRV-SNVBAGLBSA-N -1 3 286.778 2.711 20 10 CFCDHM Cc1cc([O-])c(CN2C[C@@H](O)CC(F)(F)C2)c(Cl)c1 ZINC000840941828 631273473 /nfs/dbraw/zinc/27/34/73/631273473.db2.gz NEGNGPMLHRNAKX-VIFPVBQESA-N -1 3 291.725 2.556 20 10 CFCDHM Cc1cc([O-])c(CN2CCOCC(F)(F)C2)c(Cl)c1 ZINC000840946170 631274926 /nfs/dbraw/zinc/27/49/26/631274926.db2.gz HKWUYNQPSGRACV-UHFFFAOYSA-N -1 3 291.725 2.822 20 10 CFCDHM Cc1noc(C2CN(Cc3c([O-])cc(C)cc3Cl)C2)n1 ZINC000840953674 631281190 /nfs/dbraw/zinc/28/11/90/631281190.db2.gz VRJXKJUZDPEIIM-UHFFFAOYSA-N -1 3 293.754 2.645 20 10 CFCDHM C[C@@H]1[C@H](C)N(C)CCN1Cc1cc(Cl)c(F)cc1[O-] ZINC000816571721 632488018 /nfs/dbraw/zinc/48/80/18/632488018.db2.gz NTKIVWSRVKEYAA-VHSXEESVSA-N -1 3 286.778 2.709 20 10 CFCDHM C[C@@H]1CN(Cc2cccc(Br)c2[O-])[C@@H]1C ZINC000816649326 632503389 /nfs/dbraw/zinc/50/33/89/632503389.db2.gz XLFWGMQWTBPXKJ-RKDXNWHRSA-N -1 3 270.170 2.995 20 10 CFCDHM O=C(N[C@H](c1ccccc1)C(F)F)c1cccc(O)c1[O-] ZINC000817223139 632574529 /nfs/dbraw/zinc/57/45/29/632574529.db2.gz KIOVUVPGXWKWSQ-GFCCVEGCSA-N -1 3 293.269 2.834 20 10 CFCDHM Cc1ncc(NC(=O)c2ccc(C)c(O)c2[O-])c(C2CC2)n1 ZINC000848031428 633193712 /nfs/dbraw/zinc/19/37/12/633193712.db2.gz DAFQLTBCNBOJKU-UHFFFAOYSA-N -1 3 299.330 2.634 20 10 CFCDHM CCOC[C@@H]1CN(Cc2cc(Cl)c(C)cc2[O-])CCO1 ZINC000862502280 637405581 /nfs/dbraw/zinc/40/55/81/637405581.db2.gz HSTXUJZBNDPFCI-ZDUSSCGKSA-N -1 3 299.798 2.591 20 10 CFCDHM CN(Cc1cccc(F)c1)C(=O)c1cccc(O)c1[O-] ZINC000126237471 643058569 /nfs/dbraw/zinc/05/85/69/643058569.db2.gz KQUSMAXYHPARST-UHFFFAOYSA-N -1 3 275.279 2.509 20 10 CFCDHM CCCCC[C@H](C)NC(=O)c1cccc(O)c1[O-] ZINC000126297811 643109424 /nfs/dbraw/zinc/10/94/24/643109424.db2.gz DOJWKYAYNSGWFY-JTQLQIEISA-N -1 3 251.326 2.796 20 10 CFCDHM CCc1nc(NC(=O)c2cccc(O)c2[O-])sc1C ZINC000126302510 643110486 /nfs/dbraw/zinc/11/04/86/643110486.db2.gz NGSMKDWMJBKAIK-UHFFFAOYSA-N -1 3 278.333 2.677 20 10 CFCDHM C[C@@H]1c2ccsc2CCN1C(=O)c1cccc(O)c1[O-] ZINC000126344151 643153270 /nfs/dbraw/zinc/15/32/70/643153270.db2.gz BDAZDBCPQBSZJA-SECBINFHSA-N -1 3 289.356 2.919 20 10 CFCDHM COc1ccc(NC(=O)c2cccc(O)c2[O-])c(C)c1 ZINC000126391316 643190459 /nfs/dbraw/zinc/19/04/59/643190459.db2.gz XISSQBOOKHUABM-UHFFFAOYSA-N -1 3 273.288 2.667 20 10 CFCDHM C[C@@H]1CC[C@@H](NC(=O)c2cccc(O)c2[O-])[C@H](C)C1 ZINC000126428080 643210904 /nfs/dbraw/zinc/21/09/04/643210904.db2.gz KUSGYZXLNLGRCL-CKYFFXLPSA-N -1 3 263.337 2.652 20 10 CFCDHM CCC(CC)(CC)NC(=O)c1cccc(O)c1[O-] ZINC000126452325 643228450 /nfs/dbraw/zinc/22/84/50/643228450.db2.gz UOVVNILSSONDQH-UHFFFAOYSA-N -1 3 251.326 2.796 20 10 CFCDHM Cc1cnn([C@@H]2CCN(Cc3ccc(F)c(F)c3[O-])C2)c1 ZINC000877541568 643344172 /nfs/dbraw/zinc/34/41/72/643344172.db2.gz GRIHTHOVSGCAGA-GFCCVEGCSA-N -1 3 293.317 2.622 20 10 CFCDHM Cc1nccnc1[C@@H](C)NCc1cccc(Cl)c1[O-] ZINC000877828914 643595017 /nfs/dbraw/zinc/59/50/17/643595017.db2.gz SWFOZWZTXKTBJT-SNVBAGLBSA-N -1 3 277.755 2.995 20 10 CFCDHM CCCc1ncc(CNCc2cc(F)cc(F)c2[O-])o1 ZINC000883136399 645621002 /nfs/dbraw/zinc/62/10/02/645621002.db2.gz BTLVDACBTZWMKC-UHFFFAOYSA-N -1 3 282.290 2.901 20 10 CFCDHM Cn1ncc(C2CC2)c1CNCc1cc(F)cc(F)c1[O-] ZINC000883174970 645641143 /nfs/dbraw/zinc/64/11/43/645641143.db2.gz WFHMVQSWPYOAFS-UHFFFAOYSA-N -1 3 293.317 2.571 20 10 CFCDHM C[C@H](NCc1c(C2CC2)cnn1C)c1c([O-])cccc1F ZINC000886637684 647081445 /nfs/dbraw/zinc/08/14/45/647081445.db2.gz CEQXJPYWKGEAFR-JTQLQIEISA-N -1 3 289.354 2.993 20 10 CFCDHM CC[C@@H]1C[C@H](CC(=O)NCc2c([O-])cccc2F)CCO1 ZINC000928707747 648945612 /nfs/dbraw/zinc/94/56/12/648945612.db2.gz HODAEDYFMYSEEE-VXGBXAGGSA-N -1 3 295.354 2.743 20 10 CFCDHM CCC[C@@H](CC)C(=O)NCc1c([O-])cccc1F ZINC000928709877 648945884 /nfs/dbraw/zinc/94/58/84/648945884.db2.gz MVUXOGYZMDDMOU-SNVBAGLBSA-N -1 3 253.317 2.974 20 10 CFCDHM O=C(NCc1c([O-])cccc1F)c1cccnc1C1CC1 ZINC000928708987 648945895 /nfs/dbraw/zinc/94/58/95/648945895.db2.gz URCOBKIIURUWKE-UHFFFAOYSA-N -1 3 286.306 2.734 20 10 CFCDHM Cc1oc(C(C)C)nc1C(=O)NCc1c([O-])cccc1F ZINC000928708734 648945990 /nfs/dbraw/zinc/94/59/90/648945990.db2.gz RSWJTDIPDBAZRM-UHFFFAOYSA-N -1 3 292.310 2.881 20 10 CFCDHM O=C([O-])c1ccc(C[N@@H+]2CCc3ccsc3C2)c([O-])c1 ZINC001231452126 777224277 /nfs/dbraw/zinc/22/42/77/777224277.db2.gz DZQXCKGPVSBVDZ-UHFFFAOYSA-N -1 3 289.356 2.710 20 10 CFCDHM O=C([O-])c1ccc(C[N@H+]2CCc3ccsc3C2)c([O-])c1 ZINC001231452126 777224286 /nfs/dbraw/zinc/22/42/86/777224286.db2.gz DZQXCKGPVSBVDZ-UHFFFAOYSA-N -1 3 289.356 2.710 20 10 CFCDHM CCN(Cc1ccccn1)Cc1cc(C(=O)[O-])ccc1O ZINC001231564904 777260558 /nfs/dbraw/zinc/26/05/58/777260558.db2.gz JSLXNWGRWNLEDI-UHFFFAOYSA-N -1 3 286.331 2.508 20 10 CFCDHM O=C([O-])c1ccc(O)c(CN2CCc3sccc3C2)c1 ZINC001231563862 777261147 /nfs/dbraw/zinc/26/11/47/777261147.db2.gz RZTODSPXOWVQCG-UHFFFAOYSA-N -1 3 289.356 2.710 20 10 CFCDHM CC[C@H]1CCCC[N@@H+]1Cc1cc(C(=O)[O-])ccc1[O-] ZINC001231563509 777261290 /nfs/dbraw/zinc/26/12/90/777261290.db2.gz BXHJTCQIOOHWFZ-ZDUSSCGKSA-N -1 3 263.337 2.855 20 10 CFCDHM CC[C@H]1CCCC[N@H+]1Cc1cc(C(=O)[O-])ccc1[O-] ZINC001231563509 777261294 /nfs/dbraw/zinc/26/12/94/777261294.db2.gz BXHJTCQIOOHWFZ-ZDUSSCGKSA-N -1 3 263.337 2.855 20 10 CFCDHM Cc1cc([O-])c(CN2CCCC(=O)[C@@H](F)C2)cc1Cl ZINC001231867239 777357010 /nfs/dbraw/zinc/35/70/10/777357010.db2.gz IXGROHZPKBQPQW-LBPRGKRZSA-N -1 3 285.746 2.857 20 10 CFCDHM [O-]c1c(CN2CCO[C@H]3C[C@H]32)ccc2ccccc21 ZINC001231881747 777365218 /nfs/dbraw/zinc/36/52/18/777365218.db2.gz BMQLYIUJXAMESC-CABCVRRESA-N -1 3 255.317 2.519 20 10 CFCDHM C[C@@H]1CCN(Cc2cc(Cl)c([O-])cc2O)C[C@H]1F ZINC001232261203 777496749 /nfs/dbraw/zinc/49/67/49/777496749.db2.gz WSTXULGHUPAANA-LDYMZIIASA-N -1 3 273.735 2.931 20 10 CFCDHM COc1cc([O-])c(CN2CCC(=O)[C@@H](C)CC2)cc1Cl ZINC001232267001 777499362 /nfs/dbraw/zinc/49/93/62/777499362.db2.gz USHPSHWORUGHPR-JTQLQIEISA-N -1 3 297.782 2.855 20 10 CFCDHM COc1cc([O-])c(CN2CCOCC2(C)C)cc1Cl ZINC001232269931 777501371 /nfs/dbraw/zinc/50/13/71/777501371.db2.gz OFHPVUHLJUSHHN-UHFFFAOYSA-N -1 3 285.771 2.665 20 10 CFCDHM C[C@H]1C[C@@H](CF)N(Cc2c([O-])ccc(F)c2F)C1 ZINC001233332607 777888365 /nfs/dbraw/zinc/88/83/65/777888365.db2.gz QUEACBTZUXVZIE-IUCAKERBSA-N -1 3 259.271 2.850 20 10 CFCDHM [O-]c1ccc(F)c(F)c1CN1CC[C@]2(C1)CCCCO2 ZINC001233332540 777891461 /nfs/dbraw/zinc/89/14/61/777891461.db2.gz OOBGSEDNSWMOJG-HNNXBMFYSA-N -1 3 283.318 2.815 20 10 CFCDHM C[C@@H]1CC(=O)CCN1Cc1ccc(C(F)(F)F)cc1[O-] ZINC001233451873 777958141 /nfs/dbraw/zinc/95/81/41/777958141.db2.gz CGADJHGWXKGBND-SECBINFHSA-N -1 3 287.281 2.964 20 10 CFCDHM COc1ccc2ccc([O-])c(CN3CC(F)C3)c2c1 ZINC001234518347 778241956 /nfs/dbraw/zinc/24/19/56/778241956.db2.gz HYYHWIINOUNQGP-UHFFFAOYSA-N -1 3 261.296 2.708 20 10 CFCDHM [O-]c1cc(Cl)c(Cl)cc1CN1CC[C@@H](F)[C@@H](O)C1 ZINC001236792180 778938411 /nfs/dbraw/zinc/93/84/11/778938411.db2.gz CPEJWOSZIKVOCZ-PWSUYJOCSA-N -1 3 294.153 2.604 20 10 CFCDHM COc1cc([O-])c(CN2CCCC(=O)CC2)c(Cl)c1 ZINC001236795409 778941167 /nfs/dbraw/zinc/94/11/67/778941167.db2.gz KUZWEDUSMOZHFF-UHFFFAOYSA-N -1 3 283.755 2.609 20 10 CFCDHM COc1cc([O-])c(CN2CC(C)(C)C2)c(Cl)c1 ZINC001236798396 778942550 /nfs/dbraw/zinc/94/25/50/778942550.db2.gz NWKQLMUZFSWJOA-UHFFFAOYSA-N -1 3 255.745 2.896 20 10 CFCDHM COc1cc([O-])c(CN2C[C@@H](C)O[C@@H](C)C2)c(Cl)c1 ZINC001236805679 778947278 /nfs/dbraw/zinc/94/72/78/778947278.db2.gz ZPXRNLCOJXVESH-AOOOYVTPSA-N -1 3 285.771 2.663 20 10 CFCDHM COc1cc([O-])c(CN2CCO[C@@H](C(C)C)C2)c(Cl)c1 ZINC001236808602 778949041 /nfs/dbraw/zinc/94/90/41/778949041.db2.gz PDEUWAPDHPHDND-OAHLLOKOSA-N -1 3 299.798 2.911 20 10 CFCDHM CCN1CCN(Cc2ccc(OC)c(Cl)c2[O-])C[C@H]1C ZINC001236817130 778952729 /nfs/dbraw/zinc/95/27/29/778952729.db2.gz DEYHJRHMKBXURF-LLVKDONJSA-N -1 3 298.814 2.580 20 10 CFCDHM [O-]c1ccc(Cl)c(Cl)c1CN1CC2(C1)CCOC2 ZINC001237077619 779006088 /nfs/dbraw/zinc/00/60/88/779006088.db2.gz IVHKRDIGWYFZIM-UHFFFAOYSA-N -1 3 288.174 2.921 20 10 CFCDHM COC(=O)CCN(C)Cc1c([O-])ccc(Cl)c1Cl ZINC001237084816 779009462 /nfs/dbraw/zinc/00/94/62/779009462.db2.gz NUHCENLSEKDMSC-UHFFFAOYSA-N -1 3 292.162 2.694 20 10 CFCDHM CO[C@H]1CCCN(Cc2c([O-])ccc(F)c2Cl)C1 ZINC001237119105 779016520 /nfs/dbraw/zinc/01/65/20/779016520.db2.gz ARURGIRKOBHQKP-VIFPVBQESA-N -1 3 273.735 2.796 20 10 CFCDHM CC(=O)[C@H]1CCN(Cc2cc(Cl)cc(F)c2[O-])C1 ZINC001237623762 779147541 /nfs/dbraw/zinc/14/75/41/779147541.db2.gz UXLZUZZFNDGFMA-VIFPVBQESA-N -1 3 271.719 2.596 20 10 CFCDHM C[C@@H]1CCCN(Cc2cc(F)cc(Cl)c2[O-])[C@H]1CO ZINC001237808966 779184044 /nfs/dbraw/zinc/18/40/44/779184044.db2.gz XGJKGBCCBFSBQI-RNCFNFMXSA-N -1 3 287.762 2.778 20 10 CFCDHM COC[C@@H]1CCCCN1Cc1cc(F)cc(F)c1[O-] ZINC000708414790 781273058 /nfs/dbraw/zinc/27/30/58/781273058.db2.gz SPCYTRKUJWBVTI-LBPRGKRZSA-N -1 3 271.307 2.671 20 10 CFCDHM C[C@@H]1CCN(Cc2cc(F)cc(F)c2[O-])C[C@H](C)O1 ZINC000708434046 781274618 /nfs/dbraw/zinc/27/46/18/781274618.db2.gz NPSDOXWVGOKWKC-ZJUUUORDSA-N -1 3 271.307 2.670 20 10 CFCDHM Cc1csc(CNCc2cc(F)cc(F)c2[O-])n1 ZINC000708467092 781276328 /nfs/dbraw/zinc/27/63/28/781276328.db2.gz LYLFKGHMAUUUJQ-UHFFFAOYSA-N -1 3 270.304 2.725 20 10 CFCDHM CCC(C)(C)[C@H](C)NC(=O)c1cccc(O)c1[O-] ZINC000709972558 781324297 /nfs/dbraw/zinc/32/42/97/781324297.db2.gz STOIEMYCVYSDIC-VIFPVBQESA-N -1 3 251.326 2.652 20 10 CFCDHM O=S(=O)(CCC1CC1)Nc1ccc([O-])c(Cl)c1 ZINC000095990430 185057295 /nfs/dbraw/zinc/05/72/95/185057295.db2.gz QLZZJPWCNANDGE-UHFFFAOYSA-N -1 3 275.757 2.587 20 10 CFCDHM O=C(NCc1ccc(N2CCCC2)cc1)c1cccc([O-])c1 ZINC000181961427 539884755 /nfs/dbraw/zinc/88/47/55/539884755.db2.gz DFKPBWRUHTZTRG-UHFFFAOYSA-N -1 3 296.370 2.922 20 10 CFCDHM CCCOc1ccc(CN(CC(=O)OC)C(C)C)c([O-])c1 ZINC000093287287 375203922 /nfs/dbraw/zinc/20/39/22/375203922.db2.gz FDVXWESNZPJWSX-UHFFFAOYSA-N -1 3 295.379 2.564 20 10 CFCDHM C[C@H]1CCCC[C@H]1N(C)C(=O)c1cccc(O)c1[O-] ZINC000126338092 377221555 /nfs/dbraw/zinc/22/15/55/377221555.db2.gz AONZUTPDYLQYAL-CMPLNLGQSA-N -1 3 263.337 2.749 20 10 CFCDHM CN(Cc1c([O-])cccc1Cl)[C@@H]1CCSC1 ZINC000130577013 377578330 /nfs/dbraw/zinc/57/83/30/377578330.db2.gz CHONQDAQDXGTLJ-SECBINFHSA-N -1 3 257.786 2.983 20 10 CFCDHM CC[C@@H](C)CN(C)C(=O)c1ccc(C)c(O)c1[O-] ZINC000179490938 380548613 /nfs/dbraw/zinc/54/86/13/380548613.db2.gz BWRLMJNFLCKJLG-SECBINFHSA-N -1 3 251.326 2.524 20 10 CFCDHM [O-]c1ccccc1CN1CCO[C@@H](c2cccc(O)c2)C1 ZINC000179576258 380560456 /nfs/dbraw/zinc/56/04/56/380560456.db2.gz FNRZSAZUWFUTQB-QGZVFWFLSA-N -1 3 285.343 2.671 20 10 CFCDHM CN(CCOCC1CC1)Cc1cccc(Cl)c1[O-] ZINC000180581766 380678032 /nfs/dbraw/zinc/67/80/32/380678032.db2.gz SYOQAELYAPPILU-UHFFFAOYSA-N -1 3 269.772 2.904 20 10 CFCDHM CN(C(=O)c1cccc(O)c1[O-])C1CCC(F)(F)CC1 ZINC000288085206 381006926 /nfs/dbraw/zinc/00/69/26/381006926.db2.gz FZFXOINCFKGZFV-UHFFFAOYSA-N -1 3 285.290 2.748 20 10 CFCDHM CC(C)(C)n1ncnc1CN[C@H]1CCc2cccc([O-])c21 ZINC000296527779 381436233 /nfs/dbraw/zinc/43/62/33/381436233.db2.gz RLWYSNJZLLVSSG-LBPRGKRZSA-N -1 3 286.379 2.516 20 10 CFCDHM Cc1ccc(C(=O)N2C[C@H]3CCCCC[C@H]32)c([O-])c1O ZINC000374771685 382056042 /nfs/dbraw/zinc/05/60/42/382056042.db2.gz PBUMPNAVFGDQAJ-DGCLKSJQSA-N -1 3 275.348 2.811 20 10 CFCDHM [O-]c1c(Cl)cccc1CN1CCC[C@H]2OCC[C@H]21 ZINC000373490890 382017361 /nfs/dbraw/zinc/01/73/61/382017361.db2.gz RZDOWWABIOMIAG-CHWSQXEVSA-N -1 3 267.756 2.799 20 10 CFCDHM [O-]c1ccc(Cl)cc1CN1CCC[C@H]2COC[C@H]21 ZINC000375705358 382098059 /nfs/dbraw/zinc/09/80/59/382098059.db2.gz QAAZNHPHCSBCAY-GXFFZTMASA-N -1 3 267.756 2.656 20 10 CFCDHM Cc1c(CNCc2cc(Cl)c(F)cc2[O-])cnn1C ZINC000293634621 382204223 /nfs/dbraw/zinc/20/42/23/382204223.db2.gz NJLVTYCWSMUTTP-UHFFFAOYSA-N -1 3 283.734 2.516 20 10 CFCDHM O=C(C1CCN(Cc2ccccc2[O-])CC1)C(F)(F)F ZINC000187656300 382237421 /nfs/dbraw/zinc/23/74/21/382237421.db2.gz QWVAQEPCUHGATJ-UHFFFAOYSA-N -1 3 287.281 2.736 20 10 CFCDHM C[C@H]1C[C@@H](O)CCN1Cc1cc(Cl)c(F)cc1[O-] ZINC000293814285 382290463 /nfs/dbraw/zinc/29/04/63/382290463.db2.gz FKMPVWABRMSLHP-WPRPVWTQSA-N -1 3 273.735 2.530 20 10 CFCDHM COc1ccncc1CN[C@H](C)c1cc(F)ccc1[O-] ZINC000293990261 382368018 /nfs/dbraw/zinc/36/80/18/382368018.db2.gz BZAKMTKCLYDTCA-SNVBAGLBSA-N -1 3 276.311 2.786 20 10 CFCDHM CCCCN(Cc1ccccc1[O-])[C@H](C)C(=O)OC ZINC000282417446 385304700 /nfs/dbraw/zinc/30/47/00/385304700.db2.gz JAJZSZDQVCZWNJ-GFCCVEGCSA-N -1 3 265.353 2.556 20 10 CFCDHM Cc1ccc(C(=O)N(C)[C@@H](C)C(C)C)c([O-])c1O ZINC000272652352 385582598 /nfs/dbraw/zinc/58/25/98/385582598.db2.gz KQIOUIFHVIHTRW-JTQLQIEISA-N -1 3 251.326 2.523 20 10 CFCDHM [O-]c1ccc(Cl)c(F)c1CN1CCC2(CCO2)CC1 ZINC000367070102 394251423 /nfs/dbraw/zinc/25/14/23/394251423.db2.gz ADERKTIZHSMDBV-UHFFFAOYSA-N -1 3 285.746 2.940 20 10 CFCDHM Cc1ccc(C(=O)N2CCC[C@H]3CCC[C@@H]32)c([O-])c1O ZINC000179519959 292054519 /nfs/dbraw/zinc/05/45/19/292054519.db2.gz KEQPEFZCJFPVFD-YPMHNXCESA-N -1 3 275.348 2.811 20 10 CFCDHM CC[C@@H](N[C@@H](C)c1nncn1C)c1cccc(Cl)c1[O-] ZINC000287789034 286922577 /nfs/dbraw/zinc/92/25/77/286922577.db2.gz SRHFQZKOFHDSEQ-JOYOIKCWSA-N -1 3 294.786 2.976 20 10 CFCDHM O=C(NCCc1c[nH]c2ccccc12)c1cccc(O)c1[O-] ZINC000072106670 176316573 /nfs/dbraw/zinc/31/65/73/176316573.db2.gz LVETVUNDZCUBFV-UHFFFAOYSA-N -1 3 296.326 2.552 20 10 CFCDHM CC(=O)c1cc(Cl)cc(CN2CCCC2)c1[O-] ZINC000037322540 260159611 /nfs/dbraw/zinc/15/96/11/260159611.db2.gz JBVNFWLFWGRCID-UHFFFAOYSA-N -1 3 253.729 2.844 20 10 CFCDHM Cc1cnn([C@@H]2CCN(Cc3cc(Cl)ccc3[O-])C2)c1 ZINC000365614165 262374728 /nfs/dbraw/zinc/37/47/28/262374728.db2.gz FOVUPMYDZWNARH-CQSZACIVSA-N -1 3 291.782 2.998 20 10 CFCDHM C[C@@H](NCc1nnc(C2CC2)[nH]1)c1cc(Cl)ccc1[O-] ZINC000296228214 263187677 /nfs/dbraw/zinc/18/76/77/263187677.db2.gz BXOWRZSASRXFBH-MRVPVSSYSA-N -1 3 292.770 2.892 20 10 CFCDHM CO[C@H]1CCN(Cc2cc(F)cc(C(C)=O)c2[O-])[C@@H](C)C1 ZINC000281667361 274080363 /nfs/dbraw/zinc/08/03/63/274080363.db2.gz LGLHGDPSIDKNOM-HZMBPMFUSA-N -1 3 295.354 2.733 20 10 CFCDHM CN(C(=O)/C=C\c1cncc([O-])c1)c1ccc(F)cc1 ZINC000492432973 332397237 /nfs/dbraw/zinc/39/72/37/332397237.db2.gz BTODOGSZBSFXQA-UQCOIBPSSA-N -1 3 272.279 2.603 20 10 CFCDHM CC(=O)c1cc(Cl)cc(CN(C)c2ccn(C)n2)c1[O-] ZINC000285046045 518277789 /nfs/dbraw/zinc/27/77/89/518277789.db2.gz NVSAVCMEHHBDPN-UHFFFAOYSA-N -1 3 293.754 2.618 20 10 CFCDHM CC(C)C[C@H]1CCCN(C(=O)c2cccc(O)c2[O-])C1 ZINC000193133351 519409895 /nfs/dbraw/zinc/40/98/95/519409895.db2.gz WQMLBGDYDRWODM-GFCCVEGCSA-N -1 3 277.364 2.996 20 10 CFCDHM CC(C)n1nccc1CN(C)Cc1ccccc1[O-] ZINC000279733125 520097676 /nfs/dbraw/zinc/09/76/76/520097676.db2.gz WHCARKNNIBVVKP-UHFFFAOYSA-N -1 3 259.353 2.802 20 10 CFCDHM CCN(Cc1cc(F)cc(C(C)=O)c1[O-])C[C@@H](C)OC ZINC000291158028 521293967 /nfs/dbraw/zinc/29/39/67/521293967.db2.gz FNVHIEXNWVDNMU-SNVBAGLBSA-N -1 3 283.343 2.591 20 10 CFCDHM CN(C)c1cccnc1CNCc1c([O-])cccc1Cl ZINC000289874133 522298606 /nfs/dbraw/zinc/29/86/06/522298606.db2.gz RKMCTHOEJCSNLF-UHFFFAOYSA-N -1 3 291.782 2.796 20 10 CFCDHM COCc1nc(CN[C@@H](C)c2cc(F)ccc2[O-])cs1 ZINC000289614612 523205064 /nfs/dbraw/zinc/20/50/64/523205064.db2.gz DFOCWWNGYCGERC-VIFPVBQESA-N -1 3 296.367 2.985 20 10 CFCDHM CC[C@@H]1CCCN(C(=O)c2cccc(O)c2[O-])CC1 ZINC000126434330 523243750 /nfs/dbraw/zinc/24/37/50/523243750.db2.gz UCYIOCOLCUHWCP-LLVKDONJSA-N -1 3 263.337 2.750 20 10 CFCDHM CCn1cc(CN[C@@H](C)c2ccc(F)c(F)c2[O-])cn1 ZINC000276911113 523383745 /nfs/dbraw/zinc/38/37/45/523383745.db2.gz KTJSFLGDRJWDBE-VIFPVBQESA-N -1 3 281.306 2.738 20 10 CFCDHM COC(=O)[C@@H]1CCN(Cc2c([O-])cccc2Cl)C[C@@H]1C ZINC000276424101 523715973 /nfs/dbraw/zinc/71/59/73/523715973.db2.gz GNUBZPVGICPNOY-WDEREUQCSA-N -1 3 297.782 2.677 20 10 CFCDHM CN(C)C(=O)[C@H](c1ccccc1)N(C)Cc1ccccc1[O-] ZINC000171937030 524014808 /nfs/dbraw/zinc/01/48/08/524014808.db2.gz SLVDYXFDTWRPED-KRWDZBQOSA-N -1 3 298.386 2.654 20 10 CFCDHM C[C@@H](CNC(=O)c1cccc(O)c1[O-])Cc1cccs1 ZINC000193093741 524722860 /nfs/dbraw/zinc/72/28/60/524722860.db2.gz ISTQIANTXUYNBU-SNVBAGLBSA-N -1 3 291.372 2.768 20 10 CFCDHM C[C@@H](NCCF)c1cc(Br)ccc1[O-] ZINC000280929884 525446271 /nfs/dbraw/zinc/44/62/71/525446271.db2.gz FILUCBPNJDYVRN-SSDOTTSWSA-N -1 3 262.122 2.775 20 10 CFCDHM C[C@@H](NCc1ccnn1C)c1cc(Cl)ccc1[O-] ZINC000184996178 525546532 /nfs/dbraw/zinc/54/65/32/525546532.db2.gz UABKFTWDQDGANX-SECBINFHSA-N -1 3 265.744 2.630 20 10 CFCDHM [O-]c1ccc(F)cc1CN1CC[C@H](n2cc(Cl)cn2)C1 ZINC000290814542 526349962 /nfs/dbraw/zinc/34/99/62/526349962.db2.gz GJKWQKDRXHEHHT-ZDUSSCGKSA-N -1 3 295.745 2.828 20 10 CFCDHM O=C(c1cccc(O)c1[O-])N1C[C@H]2CCCCCC[C@@H]21 ZINC000365759059 526771523 /nfs/dbraw/zinc/77/15/23/526771523.db2.gz QUTDMDPWOJXDKU-YPMHNXCESA-N -1 3 275.348 2.893 20 10 CFCDHM [O-]c1ccc(F)cc1CNc1ccc(OCCCO)cc1 ZINC000289752935 527542309 /nfs/dbraw/zinc/54/23/09/527542309.db2.gz QSMMUFWITDRLIR-UHFFFAOYSA-N -1 3 291.322 2.905 20 10 CFCDHM O=C(Nc1cccc(-c2nnco2)c1)c1cc([O-])cs1 ZINC000736672244 574064923 /nfs/dbraw/zinc/06/49/23/574064923.db2.gz FWOZXPXGUBJASV-UHFFFAOYSA-N -1 3 287.300 2.756 20 10 CFCDHM CN(CCCNC(=O)c1cc([O-])cs1)c1ccccc1 ZINC000731861405 574130905 /nfs/dbraw/zinc/13/09/05/574130905.db2.gz AFQVWAZRIIKERA-UHFFFAOYSA-N -1 3 290.388 2.710 20 10 CFCDHM O=C(Nc1cccc(Cn2cccn2)c1)c1cc([O-])cs1 ZINC000731868613 574132701 /nfs/dbraw/zinc/13/27/01/574132701.db2.gz LSZLGOIHAYQGRO-UHFFFAOYSA-N -1 3 299.355 2.951 20 10 CFCDHM O=C(NCc1cccc(F)c1)c1cc([O-])cs1 ZINC000731868501 574132817 /nfs/dbraw/zinc/13/28/17/574132817.db2.gz GYLZTSVOXCWREX-UHFFFAOYSA-N -1 3 251.282 2.523 20 10 CFCDHM O=C(Nc1ccc2oc(=O)[nH]c2c1)c1cc([O-])cs1 ZINC000731868286 574132831 /nfs/dbraw/zinc/13/28/31/574132831.db2.gz AJHIAXZMGXYRBE-UHFFFAOYSA-N -1 3 276.273 2.553 20 10 CFCDHM O=C(OCc1cccc([N+](=O)[O-])c1)c1cc([O-])cs1 ZINC000731912267 574133596 /nfs/dbraw/zinc/13/35/96/574133596.db2.gz STMGYJVXSLDHRB-UHFFFAOYSA-N -1 3 279.273 2.719 20 10 CFCDHM Cc1ccc(C(=O)COC(=O)c2cc([O-])cs2)cc1 ZINC000731912951 574133615 /nfs/dbraw/zinc/13/36/15/574133615.db2.gz ZWNJWCVGQLYVDJ-UHFFFAOYSA-N -1 3 276.313 2.802 20 10 CFCDHM CN(Cc1c([O-])ccc2ccncc21)CC(F)F ZINC000728900893 574135460 /nfs/dbraw/zinc/13/54/60/574135460.db2.gz WLUNZLLBWIMLGV-UHFFFAOYSA-N -1 3 252.264 2.637 20 10 CFCDHM C[C@@H](Cc1cccs1)NC(=O)c1cc([O-])cs1 ZINC000732268417 574147952 /nfs/dbraw/zinc/14/79/52/574147952.db2.gz GJYWKTCVXPGZCU-QMMMGPOBSA-N -1 3 267.375 2.876 20 10 CFCDHM C[C@@H](c1ccco1)N(C)C(=O)c1cc([O-])cs1 ZINC000732268386 574148121 /nfs/dbraw/zinc/14/81/21/574148121.db2.gz DOOKWOBGHMQFAT-QMMMGPOBSA-N -1 3 251.307 2.880 20 10 CFCDHM O=C(Nc1nnc(-c2ccco2)s1)c1cc([O-])cs1 ZINC000732267337 574148151 /nfs/dbraw/zinc/14/81/51/574148151.db2.gz YBJKHOLYIQXGHY-UHFFFAOYSA-N -1 3 293.329 2.818 20 10 CFCDHM CN(Cc1ccccc1[N+](=O)[O-])C(=O)c1cc([O-])cs1 ZINC000732269062 574148469 /nfs/dbraw/zinc/14/84/69/574148469.db2.gz POBYGEUHPTULLR-UHFFFAOYSA-N -1 3 292.316 2.634 20 10 CFCDHM O=C(N[C@H]1CCOc2c(F)cccc21)c1cc([O-])cs1 ZINC000732275644 574149289 /nfs/dbraw/zinc/14/92/89/574149289.db2.gz FWGDSWNMLCBBSL-NSHDSACASA-N -1 3 293.319 2.846 20 10 CFCDHM CCOc1ccccc1CNC(=O)c1cc([O-])cs1 ZINC000732276824 574149394 /nfs/dbraw/zinc/14/93/94/574149394.db2.gz SIYOVJIEWXJQOA-UHFFFAOYSA-N -1 3 277.345 2.782 20 10 CFCDHM COc1cccc(CN(C)C(=O)c2cc([O-])cs2)c1 ZINC000732258199 574149419 /nfs/dbraw/zinc/14/94/19/574149419.db2.gz IPVGSHXYYXPCFV-UHFFFAOYSA-N -1 3 277.345 2.735 20 10 CFCDHM Cc1ccc2c(c1C)OC[C@@H]2NC(=O)c1cc([O-])cs1 ZINC000732286388 574150032 /nfs/dbraw/zinc/15/00/32/574150032.db2.gz SKFBUQVCMFKLMI-LBPRGKRZSA-N -1 3 289.356 2.934 20 10 CFCDHM CC(C)Cc1cc(NC(=O)c2cc([O-])cs2)n[nH]1 ZINC000732285425 574150183 /nfs/dbraw/zinc/15/01/83/574150183.db2.gz FQDFIOHMFFCTFY-UHFFFAOYSA-N -1 3 265.338 2.628 20 10 CFCDHM CC(C)C[C@@H](C)N(C)C(=O)COC(=O)c1cc([O-])cs1 ZINC000732353167 574152565 /nfs/dbraw/zinc/15/25/65/574152565.db2.gz MZSAOMRUKJSJCV-SNVBAGLBSA-N -1 3 299.392 2.504 20 10 CFCDHM C[C@@H](OC(=O)c1cc([O-])cs1)c1nc(C2CC2)no1 ZINC000732353882 574153040 /nfs/dbraw/zinc/15/30/40/574153040.db2.gz CFZXNRKWPSDOEA-ZCFIWIBFSA-N -1 3 280.305 2.632 20 10 CFCDHM O=C(OCc1c(F)cccc1[N+](=O)[O-])c1cc([O-])cs1 ZINC000732353960 574153412 /nfs/dbraw/zinc/15/34/12/574153412.db2.gz MGPAKTXMDVXCSZ-UHFFFAOYSA-N -1 3 297.263 2.858 20 10 CFCDHM CN(Cc1cc[nH]n1)Cc1c([O-])ccc2ccccc21 ZINC000732671357 574165210 /nfs/dbraw/zinc/16/52/10/574165210.db2.gz UZKSNWZZJLEBEO-UHFFFAOYSA-N -1 3 267.332 2.901 20 10 CFCDHM Cc1ccc([C@H](C)N[C@@H](C(N)=O)c2ccccc2)c([O-])c1 ZINC000756381045 574231337 /nfs/dbraw/zinc/23/13/37/574231337.db2.gz IWTWFQBGTCIXAD-BLLLJJGKSA-N -1 3 284.359 2.578 20 10 CFCDHM Cc1ccc([C@@H](C)N[C@H](C(N)=O)c2ccccc2)c([O-])c1 ZINC000756381048 574231419 /nfs/dbraw/zinc/23/14/19/574231419.db2.gz IWTWFQBGTCIXAD-WBMJQRKESA-N -1 3 284.359 2.578 20 10 CFCDHM CCN(CC)C(=O)CN[C@H](C)c1cc(Cl)ccc1[O-] ZINC000756459691 574238723 /nfs/dbraw/zinc/23/87/23/574238723.db2.gz WSHGCTVQBBLOJN-SNVBAGLBSA-N -1 3 284.787 2.565 20 10 CFCDHM CC(C)c1cnc(COC(=O)c2cc([O-])cs2)o1 ZINC000733496428 574242211 /nfs/dbraw/zinc/24/22/11/574242211.db2.gz JEIFWKJXPOKWIO-UHFFFAOYSA-N -1 3 267.306 2.922 20 10 CFCDHM C[C@@H](NCc1cccc(O)c1)c1cc([N+](=O)[O-])ccc1[O-] ZINC000756516087 574243255 /nfs/dbraw/zinc/24/32/55/574243255.db2.gz PDGUEZGMTMXCSX-SNVBAGLBSA-N -1 3 288.303 2.857 20 10 CFCDHM C[C@H](N[C@H]1C[C@@H](C)c2c1c([O-])ccc2F)c1nncn1C ZINC000756534395 574244265 /nfs/dbraw/zinc/24/42/65/574244265.db2.gz KRYHJNSUNNBMJT-YWVKMMECSA-N -1 3 290.342 2.559 20 10 CFCDHM C[C@@H](NCc1ccc(F)cn1)c1cc([N+](=O)[O-])ccc1[O-] ZINC000756661114 574256599 /nfs/dbraw/zinc/25/65/99/574256599.db2.gz XUXUHAQQCUAQMP-SECBINFHSA-N -1 3 291.282 2.685 20 10 CFCDHM CCc1cc(CNCc2c([O-])cccc2Cl)n[nH]1 ZINC000733900836 574260568 /nfs/dbraw/zinc/26/05/68/574260568.db2.gz LUKJGSZTVJNSCB-UHFFFAOYSA-N -1 3 265.744 2.621 20 10 CFCDHM CCc1cc(CNCc2c([O-])cccc2Cl)[nH]n1 ZINC000733900836 574260572 /nfs/dbraw/zinc/26/05/72/574260572.db2.gz LUKJGSZTVJNSCB-UHFFFAOYSA-N -1 3 265.744 2.621 20 10 CFCDHM C[C@H](NCc1cocn1)c1cc(Cl)ccc1[O-] ZINC000756831003 574265520 /nfs/dbraw/zinc/26/55/20/574265520.db2.gz KURQTQZDAPHSFL-QMMMGPOBSA-N -1 3 252.701 2.884 20 10 CFCDHM CO[C@H](CN[C@H](C)c1ccc(F)cc1[O-])C(F)(F)F ZINC000756836462 574266579 /nfs/dbraw/zinc/26/65/79/574266579.db2.gz VRYYFSBFKZXDNU-RDDDGLTNSA-N -1 3 281.249 2.759 20 10 CFCDHM Fc1ccc(CSc2nccs2)c(-c2nnn[n-]2)c1 ZINC000737648882 574295992 /nfs/dbraw/zinc/29/59/92/574295992.db2.gz KOWASJXZEJMQBF-UHFFFAOYSA-N -1 3 293.352 2.755 20 10 CFCDHM Fc1ccc(CSc2nccs2)c(-c2nn[n-]n2)c1 ZINC000737648882 574295993 /nfs/dbraw/zinc/29/59/93/574295993.db2.gz KOWASJXZEJMQBF-UHFFFAOYSA-N -1 3 293.352 2.755 20 10 CFCDHM O=c1[nH]c(NCc2ccccc2[O-])nc2ccccc21 ZINC000750537297 574346947 /nfs/dbraw/zinc/34/69/47/574346947.db2.gz JRDKINOEQVRQRV-UHFFFAOYSA-N -1 3 267.288 2.653 20 10 CFCDHM CCN(CCc1ccccn1)C(=O)c1cc([O-])cs1 ZINC000743541557 574368238 /nfs/dbraw/zinc/36/82/38/574368238.db2.gz USMQTVPYOHIKIU-UHFFFAOYSA-N -1 3 276.361 2.554 20 10 CFCDHM O=C(N[C@H]1C[C@@H]1Cc1ccccc1)c1cc([O-])cs1 ZINC000743632528 574369747 /nfs/dbraw/zinc/36/97/47/574369747.db2.gz IAYWABOGMAPPTK-AAEUAGOBSA-N -1 3 273.357 2.815 20 10 CFCDHM CCO[C@@H]1C[C@@H](NC(=O)c2cc([O-])cs2)C12CCC2 ZINC000743630455 574369757 /nfs/dbraw/zinc/36/97/57/574369757.db2.gz TWHXBYNUGJZGQM-VXGBXAGGSA-N -1 3 281.377 2.531 20 10 CFCDHM Cc1ccccc1O[C@@H](C)CNC(=O)c1cc([O-])cs1 ZINC000743718829 574371260 /nfs/dbraw/zinc/37/12/60/574371260.db2.gz SMKCBBFLRWVADY-NSHDSACASA-N -1 3 291.372 2.959 20 10 CFCDHM CSCC[C@H](C)N(C)C(=O)c1cc([O-])cs1 ZINC000751396830 574376427 /nfs/dbraw/zinc/37/64/27/574376427.db2.gz XAYFKFNCAIPYHW-QMMMGPOBSA-N -1 3 259.396 2.667 20 10 CFCDHM C[C@@H](C[C@H](O)c1cccs1)NC(=O)c1cc([O-])cs1 ZINC000752631012 574393202 /nfs/dbraw/zinc/39/32/02/574393202.db2.gz PGIXWHQRAKCCIS-WPRPVWTQSA-N -1 3 297.401 2.757 20 10 CFCDHM O=C(N[C@H]1COc2cc(F)cc(F)c21)c1cc([O-])cs1 ZINC000753523329 574403804 /nfs/dbraw/zinc/40/38/04/574403804.db2.gz KLLLQGDAGJNNEK-VIFPVBQESA-N -1 3 297.282 2.595 20 10 CFCDHM O=C([O-])N1CCc2cccc(C[NH2+]Cc3ccccc3[O-])c21 ZINC000832086987 603858194 /nfs/dbraw/zinc/85/81/94/603858194.db2.gz LOWMESRWXDJGIQ-UHFFFAOYSA-N -1 3 298.342 2.723 20 10 CFCDHM O=C([O-])[C@@H]1C[C@@H]2CCCC[C@@H]2[N@@H+]1Cc1ccccc1[O-] ZINC000227229727 604679800 /nfs/dbraw/zinc/67/98/00/604679800.db2.gz YUFGOMVHOBPLHC-UBHSHLNASA-N -1 3 275.348 2.610 20 10 CFCDHM O=C([O-])[C@@H]1C[C@@H]2CCCC[C@@H]2[N@H+]1Cc1ccccc1[O-] ZINC000227229727 604679802 /nfs/dbraw/zinc/67/98/02/604679802.db2.gz YUFGOMVHOBPLHC-UBHSHLNASA-N -1 3 275.348 2.610 20 10 CFCDHM Cc1ccc(C(=O)Nc2nc3ccccc3[nH]2)c([O-])c1O ZINC000177658156 618465825 /nfs/dbraw/zinc/46/58/25/618465825.db2.gz ZKCIAKKYTUXTFV-UHFFFAOYSA-N -1 3 283.287 2.535 20 10 CFCDHM Cc1ccc(C(=O)Nc2ccc3c(c2)CCCO3)c([O-])c1O ZINC000182288757 625282663 /nfs/dbraw/zinc/28/26/63/625282663.db2.gz IWOAFFFKVTYXRQ-UHFFFAOYSA-N -1 3 299.326 2.984 20 10 CFCDHM Cc1cc([O-])c(CN(C)CCNC(=O)C(C)C)c(Cl)c1 ZINC000840919945 618940117 /nfs/dbraw/zinc/94/01/17/618940117.db2.gz DVAQKGREPJEQTL-UHFFFAOYSA-N -1 3 298.814 2.558 20 10 CFCDHM Cc1cc([O-])c(CN2CC(O)(C(C)C)C2)c(Cl)c1 ZINC000840952548 619124918 /nfs/dbraw/zinc/12/49/18/619124918.db2.gz DUGSXFSMEBAQLW-UHFFFAOYSA-N -1 3 269.772 2.557 20 10 CFCDHM CCCC1(C(=O)NCc2c([O-])cccc2F)CC1 ZINC000928705354 619995600 /nfs/dbraw/zinc/99/56/00/619995600.db2.gz KELWUSUWBMPNFD-UHFFFAOYSA-N -1 3 251.301 2.728 20 10 CFCDHM CCc1oc(C(=O)NCc2c([O-])cccc2F)cc1C ZINC000928705834 619995671 /nfs/dbraw/zinc/99/56/71/619995671.db2.gz NYTRMFGSIJIUEH-UHFFFAOYSA-N -1 3 277.295 2.925 20 10 CFCDHM C[C@@H]1CCC[C@@H]1CC(=O)NCc1c([O-])cccc1F ZINC000928707702 619996197 /nfs/dbraw/zinc/99/61/97/619996197.db2.gz GYDIOPYFOIRGEW-GHMZBOCLSA-N -1 3 265.328 2.974 20 10 CFCDHM CCC/C(C)=C\C(=O)NCc1c([O-])cccc1F ZINC000928711532 619996925 /nfs/dbraw/zinc/99/69/25/619996925.db2.gz IHHGXIWZTXLSQB-NTMALXAHSA-N -1 3 251.301 2.894 20 10 CFCDHM C[C@@H](N[C@@H](C)c1ccc(Cl)cc1[O-])c1ncnn1C ZINC000841751884 620217169 /nfs/dbraw/zinc/21/71/69/620217169.db2.gz LETPFLHWYOIXHD-DTWKUNHWSA-N -1 3 280.759 2.586 20 10 CFCDHM C[C@@H](N[C@@H](C)c1ncnn1C)c1ccc(Cl)cc1[O-] ZINC000841751882 620217376 /nfs/dbraw/zinc/21/73/76/620217376.db2.gz LETPFLHWYOIXHD-BDAKNGLRSA-N -1 3 280.759 2.586 20 10 CFCDHM C[C@@H]1CN(Cc2cc(Cl)cc(Cl)c2[O-])C[C@@H]1O ZINC000897684506 620271201 /nfs/dbraw/zinc/27/12/01/620271201.db2.gz QKKXVWHWZOEOAC-HQJQHLMTSA-N -1 3 276.163 2.512 20 10 CFCDHM O=C(NCc1c([O-])cccc1F)NCC1CCCC1 ZINC000902944482 621207277 /nfs/dbraw/zinc/20/72/77/621207277.db2.gz HOSGFMSMNOKCQV-UHFFFAOYSA-N -1 3 266.316 2.521 20 10 CFCDHM C[C@@H]1CCC[C@@H](NC(=O)c2cccc(O)c2[O-])CC1 ZINC000227535386 623112008 /nfs/dbraw/zinc/11/20/08/623112008.db2.gz OJJXXHIYISDEGM-GHMZBOCLSA-N -1 3 263.337 2.796 20 10 CFCDHM COC(=O)[C@@H]1CCCCN1Cc1cc(Cl)c(C)cc1[O-] ZINC000824541648 623519707 /nfs/dbraw/zinc/51/97/07/623519707.db2.gz FZCWFEBBEMTXIS-ZDUSSCGKSA-N -1 3 297.782 2.882 20 10 CFCDHM [O-]c1cc(F)c(Cl)cc1CN[C@@H]1CCn2ccnc21 ZINC000824533992 623519757 /nfs/dbraw/zinc/51/97/57/623519757.db2.gz WEJAMHFGIGUBHT-LLVKDONJSA-N -1 3 281.718 2.616 20 10 CFCDHM COC(=O)C(C)(C)N(C)Cc1cc(Cl)c(C)cc1[O-] ZINC000824687809 623545818 /nfs/dbraw/zinc/54/58/18/623545818.db2.gz BFNNOTSETNLQSU-UHFFFAOYSA-N -1 3 285.771 2.737 20 10 CFCDHM C[C@@H]1C[C@H](O)CN(Cc2cc(Cl)cc(Cl)c2[O-])C1 ZINC000825311075 623668903 /nfs/dbraw/zinc/66/89/03/623668903.db2.gz GDLPCTFNXGWAQB-KCJUWKMLSA-N -1 3 290.190 2.902 20 10 CFCDHM Cc1cc([O-])c(CN2CC(OC(F)F)C2)cc1Cl ZINC000826114353 623795444 /nfs/dbraw/zinc/79/54/44/623795444.db2.gz XRQGNLWONFIIRD-UHFFFAOYSA-N -1 3 277.698 2.777 20 10 CFCDHM Cc1cc([O-])c(CN[C@H]2C[C@H](C)n3ncnc32)cc1Cl ZINC000826887813 623903292 /nfs/dbraw/zinc/90/32/92/623903292.db2.gz AJQUEOVCZJGKQN-CABZTGNLSA-N -1 3 292.770 2.741 20 10 CFCDHM COCCN(CCF)Cc1cc(Cl)c(C)cc1[O-] ZINC000827048266 623930289 /nfs/dbraw/zinc/93/02/89/623930289.db2.gz NJGHRBUUHWUPHL-UHFFFAOYSA-N -1 3 275.751 2.772 20 10 CFCDHM C[C@H]1CN(Cc2cc(Cl)cc(F)c2[O-])C[C@H](C)C1O ZINC000827151781 623954945 /nfs/dbraw/zinc/95/49/45/623954945.db2.gz JPLIXEWGNUYQDK-IUCAKERBSA-N -1 3 287.762 2.633 20 10 CFCDHM CCC[C@@H](CC)NC(=O)NCc1c([O-])cccc1F ZINC000915193949 623993754 /nfs/dbraw/zinc/99/37/54/623993754.db2.gz BYVWMSXIIGXNBU-SNVBAGLBSA-N -1 3 268.332 2.909 20 10 CFCDHM [O-]c1c(Cl)cc(Cl)cc1CN1CCC2(COC2)C1 ZINC000827643387 624050604 /nfs/dbraw/zinc/05/06/04/624050604.db2.gz JSCRSIHYLVTBEV-UHFFFAOYSA-N -1 3 288.174 2.921 20 10 CFCDHM [O-]c1c(Cl)cccc1CN1CCCc2n[nH]cc2C1 ZINC000828014234 624154594 /nfs/dbraw/zinc/15/45/94/624154594.db2.gz XZXMRAFHCPUFPN-UHFFFAOYSA-N -1 3 277.755 2.717 20 10 CFCDHM CC[C@@H]1CCC[C@H]1NC(=O)NCc1c([O-])cccc1F ZINC000921424042 624877957 /nfs/dbraw/zinc/87/79/57/624877957.db2.gz BLTSTPOWILATIH-ZWNOBZJWSA-N -1 3 280.343 2.909 20 10 CFCDHM CCCC1(CNC(=O)NCc2c([O-])cccc2F)CC1 ZINC000921453963 624894784 /nfs/dbraw/zinc/89/47/84/624894784.db2.gz ZDDVTSLUMGUXDP-UHFFFAOYSA-N -1 3 280.343 2.911 20 10 CFCDHM C[C@H](c1cccc(O)c1)N(C)C(=O)c1cccc(O)c1[O-] ZINC000185847251 625791042 /nfs/dbraw/zinc/79/10/42/625791042.db2.gz NDBKWJDGTCGKNV-SNVBAGLBSA-N -1 3 287.315 2.637 20 10 CFCDHM C[C@H](N[C@H]1CCn2ccnc21)c1cc(F)cc(F)c1[O-] ZINC000834830676 625891316 /nfs/dbraw/zinc/89/13/16/625891316.db2.gz GFDUVOHLUAQGAX-UFBFGSQYSA-N -1 3 279.290 2.663 20 10 CFCDHM C[C@H]1CC[C@H](NC(=O)NCc2c([O-])cccc2F)C1 ZINC000922111995 626210105 /nfs/dbraw/zinc/21/01/05/626210105.db2.gz BTHRYKCNKGGYMX-UWVGGRQHSA-N -1 3 266.316 2.519 20 10 CFCDHM O=C(NCc1c([O-])cccc1F)N[C@@H]1CCC[C@@H]2C[C@@H]21 ZINC000922858414 626382327 /nfs/dbraw/zinc/38/23/27/626382327.db2.gz WYRZJRRHCGBNOJ-GBIKHYSHSA-N -1 3 278.327 2.519 20 10 CFCDHM O=C(Nc1cnn(-c2ccccc2)c1)c1cccc(O)c1[O-] ZINC000187025611 626417546 /nfs/dbraw/zinc/41/75/46/626417546.db2.gz SLOADXBBCPJRDM-UHFFFAOYSA-N -1 3 295.298 2.536 20 10 CFCDHM COC(=O)c1ccc(CNCc2cccc(Cl)c2[O-])o1 ZINC000809742492 626694807 /nfs/dbraw/zinc/69/48/07/626694807.db2.gz AAWRXZFTLBGYEN-UHFFFAOYSA-N -1 3 295.722 2.715 20 10 CFCDHM C/C=C\C[C@@H](NCc1cc(F)ccc1[O-])C(=O)OCC ZINC000763361501 626982520 /nfs/dbraw/zinc/98/25/20/626982520.db2.gz LLIRBEDWNGIHCK-HSBHDXMMSA-N -1 3 281.327 2.519 20 10 CFCDHM O=C1[N-]C(=S)S/C1=C\c1cc(Cl)cc(F)c1O ZINC000768269473 627329647 /nfs/dbraw/zinc/32/96/47/627329647.db2.gz PJCRCVOWELDQNA-UQCOIBPSSA-N -1 3 289.740 2.674 20 10 CFCDHM COc1cc(C)c(NC(=O)c2cccc(O)c2[O-])cc1C ZINC000769698374 627467314 /nfs/dbraw/zinc/46/73/14/627467314.db2.gz ZMSUFPSUTGZWGV-UHFFFAOYSA-N -1 3 287.315 2.976 20 10 CFCDHM COC1CCN(Cc2cc(Cl)cc(F)c2[O-])CC1 ZINC000775644661 628049324 /nfs/dbraw/zinc/04/93/24/628049324.db2.gz MZDZWFDCPHGJLS-UHFFFAOYSA-N -1 3 273.735 2.796 20 10 CFCDHM O=C(NC[C@H]1CCC[C@@H]1C1CC1)c1cccc(O)c1[O-] ZINC000839804910 628545348 /nfs/dbraw/zinc/54/53/48/628545348.db2.gz CVEOQORYMWXHLD-VXGBXAGGSA-N -1 3 275.348 2.654 20 10 CFCDHM Cc1ccc(C(=O)Nc2cnc3c(c2)CCCC3)c([O-])c1O ZINC000782840567 628660148 /nfs/dbraw/zinc/66/01/48/628660148.db2.gz RCPLAFJKZBLAEO-UHFFFAOYSA-N -1 3 298.342 2.932 20 10 CFCDHM C[C@H](CNC(=O)c1cccc(O)c1[O-])c1ccc(F)cc1 ZINC000790576530 629249468 /nfs/dbraw/zinc/24/94/68/629249468.db2.gz KCKXVNUKAZJRJY-SNVBAGLBSA-N -1 3 289.306 2.770 20 10 CFCDHM Cc1cccc2c1CCN(C(=O)c1cccc(O)c1[O-])C2 ZINC000790652274 629255512 /nfs/dbraw/zinc/25/55/12/629255512.db2.gz PBESYLSITIEBJJ-UHFFFAOYSA-N -1 3 283.327 2.605 20 10 CFCDHM C[C@H]1Cc2ccccc2[C@@H]1NC(=O)c1cccc(O)c1[O-] ZINC000790704247 629258103 /nfs/dbraw/zinc/25/81/03/629258103.db2.gz OJKQQRRIOZLHBU-ZUZCIYMTSA-N -1 3 283.327 2.761 20 10 CFCDHM O=C(c1cccc(O)c1[O-])N1CC[C@@H]1c1cccc(F)c1 ZINC000790809817 629265753 /nfs/dbraw/zinc/26/57/53/629265753.db2.gz ZTCOPEAGAGMGJM-CYBMUJFWSA-N -1 3 287.290 2.824 20 10 CFCDHM Cc1ccc(-c2cc(NC(=O)c3cccc(O)c3[O-])[nH]n2)o1 ZINC000790965386 629275138 /nfs/dbraw/zinc/27/51/38/629275138.db2.gz NJIAHQLKPUYDGH-UHFFFAOYSA-N -1 3 299.286 2.642 20 10 CFCDHM O=C(c1cccc(O)c1[O-])N(CC1CC1)C1CCC1 ZINC000794390667 629642634 /nfs/dbraw/zinc/64/26/34/629642634.db2.gz BITDJFPEDQKGQW-UHFFFAOYSA-N -1 3 261.321 2.503 20 10 CFCDHM CC[C@@H](NCc1ccn(C)n1)c1ccc(F)cc1[O-] ZINC000796853721 629979778 /nfs/dbraw/zinc/97/97/78/629979778.db2.gz PZEHMEYHRVYRAX-CYBMUJFWSA-N -1 3 263.316 2.506 20 10 CFCDHM CC(C)[C@H]1CN(C(=O)c2cccc(O)c2[O-])[C@H]1C(C)C ZINC000836888068 630908852 /nfs/dbraw/zinc/90/88/52/630908852.db2.gz ITBLFLROTXLEPY-OCCSQVGLSA-N -1 3 277.364 2.850 20 10 CFCDHM Cc1cc(O)ccc1[N-]S(=O)(=O)c1ccc(F)cc1C ZINC000041091158 649988500 /nfs/dbraw/zinc/98/85/00/649988500.db2.gz MESHCLLEEOZXPQ-UHFFFAOYSA-N -1 3 295.335 2.949 20 10 CFCDHM C[C@@H](N[C@H](C)c1cc(F)cc(F)c1[O-])c1ccn(C)n1 ZINC000840815353 631229593 /nfs/dbraw/zinc/22/95/93/631229593.db2.gz DTNDWBPOARIGGA-RKDXNWHRSA-N -1 3 281.306 2.816 20 10 CFCDHM CC(C)[C@@H](NCc1cccc(Cl)c1[O-])c1nncn1C ZINC000809691548 631264161 /nfs/dbraw/zinc/26/41/61/631264161.db2.gz JQDNJUHHVKPVJC-GFCCVEGCSA-N -1 3 294.786 2.661 20 10 CFCDHM Cc1cc([O-])c(CN2CCc3c[nH]nc3C2)c(Cl)c1 ZINC000840916558 631264676 /nfs/dbraw/zinc/26/46/76/631264676.db2.gz BASZMIWMHBKZSO-UHFFFAOYSA-N -1 3 277.755 2.635 20 10 CFCDHM CO[C@@H](C)CN(C)Cc1c([O-])ccc(Cl)c1F ZINC000809717154 631269948 /nfs/dbraw/zinc/26/99/48/631269948.db2.gz COHOMOVZYPZISD-QMMMGPOBSA-N -1 3 261.724 2.651 20 10 CFCDHM CCn1ccc(CNCc2c([O-])cc(C)cc2Cl)n1 ZINC000840954853 631280916 /nfs/dbraw/zinc/28/09/16/631280916.db2.gz LBMPYLKOAQAEHT-UHFFFAOYSA-N -1 3 279.771 2.860 20 10 CFCDHM [O-]c1c(F)cc(Cl)cc1CN1CC[C@H](n2cccn2)C1 ZINC000812780617 631773023 /nfs/dbraw/zinc/77/30/23/631773023.db2.gz KPESPKLYUVJNAN-LBPRGKRZSA-N -1 3 295.745 2.828 20 10 CFCDHM COC(=O)[C@H](CC(C)(C)C)NCc1cc(F)ccc1[O-] ZINC000843424040 631953639 /nfs/dbraw/zinc/95/36/39/631953639.db2.gz UBOYKJSDHGVYPW-LBPRGKRZSA-N -1 3 283.343 2.599 20 10 CFCDHM [O-]c1c(CN2CCn3ccnc3C2)ccc2ccccc21 ZINC000816500823 632472293 /nfs/dbraw/zinc/47/22/93/632472293.db2.gz JQWWMUIYAHKJTF-UHFFFAOYSA-N -1 3 279.343 2.758 20 10 CFCDHM [O-]c1cccnc1C[NH2+]Cc1cc(Cl)c(F)cc1[O-] ZINC000816594928 632491941 /nfs/dbraw/zinc/49/19/41/632491941.db2.gz STJURLTYHMRBON-UHFFFAOYSA-N -1 3 282.702 2.575 20 10 CFCDHM Cc1ccc2[nH]c(NC(=O)c3cccc(O)c3[O-])nc2c1 ZINC000817017128 632546321 /nfs/dbraw/zinc/54/63/21/632546321.db2.gz AACUHTAMIPACBQ-UHFFFAOYSA-N -1 3 283.287 2.535 20 10 CFCDHM Cc1ccc2nc(NC(=O)c3cccc(O)c3[O-])[nH]c2c1 ZINC000817017128 632546324 /nfs/dbraw/zinc/54/63/24/632546324.db2.gz AACUHTAMIPACBQ-UHFFFAOYSA-N -1 3 283.287 2.535 20 10 CFCDHM C[C@@H]1C[C@H](CO)CN(Cc2c([O-])ccc(Cl)c2F)C1 ZINC000817413254 632624061 /nfs/dbraw/zinc/62/40/61/632624061.db2.gz UWLZOERPYKOJTJ-ZJUUUORDSA-N -1 3 287.762 2.635 20 10 CFCDHM Cc1cc(Cl)cc(C[N@@H+]2C[C@H](C)C[C@@H](C(=O)[O-])C2)c1[O-] ZINC000817881151 632717471 /nfs/dbraw/zinc/71/74/71/632717471.db2.gz GSWBCWHDKDOHHR-BXKDBHETSA-N -1 3 297.782 2.897 20 10 CFCDHM Cc1cc(Cl)cc(C[N@H+]2C[C@H](C)C[C@@H](C(=O)[O-])C2)c1[O-] ZINC000817881151 632717474 /nfs/dbraw/zinc/71/74/74/632717474.db2.gz GSWBCWHDKDOHHR-BXKDBHETSA-N -1 3 297.782 2.897 20 10 CFCDHM C[C@H]1CCN(Cc2cc(Cl)cc(F)c2[O-])C[C@@H]1CO ZINC000857061555 635922209 /nfs/dbraw/zinc/92/22/09/635922209.db2.gz RYJJRPYCEYLHMU-GXSJLCMTSA-N -1 3 287.762 2.635 20 10 CFCDHM CC[C@H](NCc1cn(CC)nn1)c1cccc(Cl)c1[O-] ZINC000850522078 634030177 /nfs/dbraw/zinc/03/01/77/634030177.db2.gz AUUHYGSBNQZRJR-ZDUSSCGKSA-N -1 3 294.786 2.898 20 10 CFCDHM COC[C@@]1(C)CN(Cc2cc(Cl)c(C)cc2[O-])CCO1 ZINC000862552297 637424131 /nfs/dbraw/zinc/42/41/31/637424131.db2.gz VODJSXASCWZSTD-OAHLLOKOSA-N -1 3 299.798 2.591 20 10 CFCDHM O=C(c1cccc(O)c1[O-])N1CCC[C@@H](c2cccnc2)C1 ZINC000869050273 639014039 /nfs/dbraw/zinc/01/40/39/639014039.db2.gz BVNXYNVEWXOCGE-CYBMUJFWSA-N -1 3 298.342 2.513 20 10 CFCDHM CC1(C)CN(C(=O)c2cccc(O)c2[O-])[C@@H]1c1ccco1 ZINC000869787600 639398890 /nfs/dbraw/zinc/39/88/90/639398890.db2.gz IZTBYMRZUYNWRW-CQSZACIVSA-N -1 3 287.315 2.914 20 10 CFCDHM C[C@@H]1[C@H](C)SCCN1Cc1ccc(F)c(F)c1[O-] ZINC000876751073 642994687 /nfs/dbraw/zinc/99/46/87/642994687.db2.gz UGAVRKVZALBVCX-BDAKNGLRSA-N -1 3 273.348 2.996 20 10 CFCDHM O=C(NCc1ccccc1Cl)c1cccc(O)c1[O-] ZINC000126206209 643049131 /nfs/dbraw/zinc/04/91/31/643049131.db2.gz RNRVZRAEDLIBQW-UHFFFAOYSA-N -1 3 277.707 2.681 20 10 CFCDHM Cc1cccc(CN(C)C(=O)c2cccc(O)c2[O-])c1 ZINC000126279932 643089110 /nfs/dbraw/zinc/08/91/10/643089110.db2.gz ALEJCUBAICCOCN-UHFFFAOYSA-N -1 3 271.316 2.678 20 10 CFCDHM Cc1ccc(N(C)C(=O)c2cccc(O)c2[O-])cc1 ZINC000126371039 643182907 /nfs/dbraw/zinc/18/29/07/643182907.db2.gz MYXXFFBGHMUGTO-UHFFFAOYSA-N -1 3 257.289 2.683 20 10 CFCDHM CC[C@H]1CCC[C@H](NC(=O)c2cccc(O)c2[O-])C1 ZINC000126449920 643227718 /nfs/dbraw/zinc/22/77/18/643227718.db2.gz IRVSCBMWORHWJV-QWRGUYRKSA-N -1 3 263.337 2.796 20 10 CFCDHM O=C(c1cccc(O)c1[O-])N1CCC[C@H]2CCC[C@@H]21 ZINC000126453647 643229625 /nfs/dbraw/zinc/22/96/25/643229625.db2.gz FHWKVVJYHLPHLW-PWSUYJOCSA-N -1 3 261.321 2.503 20 10 CFCDHM CC1(C)CCC[C@H](NC(=O)c2cccc(O)c2[O-])C1 ZINC000126498181 643255337 /nfs/dbraw/zinc/25/53/37/643255337.db2.gz RYMQCKVDRLPDKJ-JTQLQIEISA-N -1 3 263.337 2.796 20 10 CFCDHM [O-]c1c(CN2CCSC[C@H]2C2CC2)ccc(F)c1F ZINC000877568401 643367684 /nfs/dbraw/zinc/36/76/84/643367684.db2.gz NCFWTCUTGCJGBG-LBPRGKRZSA-N -1 3 285.359 2.998 20 10 CFCDHM CC(C)n1ccc(CNCc2cc(F)cc(F)c2[O-])n1 ZINC000883015922 645563641 /nfs/dbraw/zinc/56/36/41/645563641.db2.gz IKUSPGJYWMOTCC-UHFFFAOYSA-N -1 3 281.306 2.738 20 10 CFCDHM COC[C@H](NCc1cc(F)cc(F)c1[O-])c1ccco1 ZINC000883026899 645568284 /nfs/dbraw/zinc/56/82/84/645568284.db2.gz INCATNPYOZKQGJ-LBPRGKRZSA-N -1 3 283.274 2.741 20 10 CFCDHM Cc1[nH]nc(C(C)C)c1C(=O)NCc1c([O-])cccc1F ZINC000928704558 648944027 /nfs/dbraw/zinc/94/40/27/648944027.db2.gz BVZLZXGHQNKHAX-UHFFFAOYSA-N -1 3 291.326 2.616 20 10 CFCDHM CC(=O)[C@H](C)CCCCC(=O)NCc1c([O-])cccc1F ZINC000928706140 648944550 /nfs/dbraw/zinc/94/45/50/648944550.db2.gz RSSXLPGRUKPGQM-LLVKDONJSA-N -1 3 295.354 2.933 20 10 CFCDHM C[C@@H]1CCCC[C@@H]1OCC(=O)NCc1c([O-])cccc1F ZINC000928706532 648944642 /nfs/dbraw/zinc/94/46/42/648944642.db2.gz VYVFJCPOKVOKHT-ABAIWWIYSA-N -1 3 295.354 2.743 20 10 CFCDHM C[C@@H]1CCCC[C@H]1OCC(=O)NCc1c([O-])cccc1F ZINC000928706533 648944791 /nfs/dbraw/zinc/94/47/91/648944791.db2.gz VYVFJCPOKVOKHT-IAQYHMDHSA-N -1 3 295.354 2.743 20 10 CFCDHM O=C(CCCc1cccnc1)NCc1c([O-])cccc1F ZINC000928706177 648944940 /nfs/dbraw/zinc/94/49/40/648944940.db2.gz OSUPFNZRDVFVDE-UHFFFAOYSA-N -1 3 288.322 2.565 20 10 CFCDHM CC(C)c1ccc(C(=O)NCc2c([O-])cccc2F)cn1 ZINC000928706121 648944958 /nfs/dbraw/zinc/94/49/58/648944958.db2.gz RBJQKDQCVWZJQM-UHFFFAOYSA-N -1 3 288.322 2.980 20 10 CFCDHM Cc1csc(CCC(=O)NCc2c([O-])cccc2F)n1 ZINC000928707468 648945556 /nfs/dbraw/zinc/94/55/56/648945556.db2.gz FCURONPOGUKUGS-UHFFFAOYSA-N -1 3 294.351 2.545 20 10 CFCDHM O=C(NCc1c([O-])cccc1F)C12CCC(CC1)C2 ZINC000928709235 648945835 /nfs/dbraw/zinc/94/58/35/648945835.db2.gz ZRNPBUABFBWKBW-UHFFFAOYSA-N -1 3 263.312 2.728 20 10 CFCDHM Cc1csc([C@H](C)C(=O)NCc2c([O-])cccc2F)n1 ZINC000928708429 648945910 /nfs/dbraw/zinc/94/59/10/648945910.db2.gz LVHIXVROZIAIRW-SECBINFHSA-N -1 3 294.351 2.716 20 10 CFCDHM O=C(NCc1c([O-])cccc1F)[C@H]1[C@@H]2c3ccccc3C[C@H]12 ZINC000928712824 648946735 /nfs/dbraw/zinc/94/67/35/648946735.db2.gz VNURNSOPUCJGQA-JCURWCKSSA-N -1 3 297.329 2.733 20 10 CFCDHM O=C(NCc1c([O-])cccc1F)[C@@H]1C[C@H]1c1ccco1 ZINC000928710528 648946815 /nfs/dbraw/zinc/94/68/15/648946815.db2.gz UOFOXVFLGMNDTK-NXEZZACHSA-N -1 3 275.279 2.544 20 10 CFCDHM CC[C@H]1CN(Cc2cccc(F)c2[O-])C[C@H](CC)O1 ZINC000398783300 770607595 /nfs/dbraw/zinc/60/75/95/770607595.db2.gz MVWQXBVJKRBYSL-STQMWFEESA-N -1 3 267.344 2.921 20 10 CFCDHM O=C1c2cccc([O-])c2C(=O)c2c(OC3CC3)cccc21 ZINC001226380044 775797447 /nfs/dbraw/zinc/79/74/47/775797447.db2.gz MMHWZWHVSMDUNF-UHFFFAOYSA-N -1 3 280.279 2.709 20 10 CFCDHM CC1(C)C[N@H+](Cc2ccc(C(=O)[O-])cc2[O-])CCC1(F)F ZINC001231447434 777220686 /nfs/dbraw/zinc/22/06/86/777220686.db2.gz TYMURNGYHPYVRV-UHFFFAOYSA-N -1 3 299.317 2.958 20 10 CFCDHM CC1(C)C[N@@H+](Cc2ccc(C(=O)[O-])cc2[O-])CCC1(F)F ZINC001231447434 777220695 /nfs/dbraw/zinc/22/06/95/777220695.db2.gz TYMURNGYHPYVRV-UHFFFAOYSA-N -1 3 299.317 2.958 20 10 CFCDHM C[C@]1(F)CCCC[N@H+](Cc2ccc(C(=O)[O-])cc2[O-])C1 ZINC001231445665 777221074 /nfs/dbraw/zinc/22/10/74/777221074.db2.gz AGGVUOUILLRGDA-HNNXBMFYSA-N -1 3 281.327 2.805 20 10 CFCDHM C[C@]1(F)CCCC[N@@H+](Cc2ccc(C(=O)[O-])cc2[O-])C1 ZINC001231445665 777221081 /nfs/dbraw/zinc/22/10/81/777221081.db2.gz AGGVUOUILLRGDA-HNNXBMFYSA-N -1 3 281.327 2.805 20 10 CFCDHM CC(C)C1CC[NH+](Cc2ccc(C(=O)[O-])cc2[O-])CC1 ZINC001231452180 777221618 /nfs/dbraw/zinc/22/16/18/777221618.db2.gz CWQZGNSAIRUMQW-UHFFFAOYSA-N -1 3 277.364 2.958 20 10 CFCDHM O=C([O-])c1ccc(C[N@@H+]2CCC[C@@H]3CCC[C@@H]32)c([O-])c1 ZINC001231455913 777224033 /nfs/dbraw/zinc/22/40/33/777224033.db2.gz XLYDYYLCLPKJGF-FZMZJTMJSA-N -1 3 275.348 2.855 20 10 CFCDHM O=C([O-])c1ccc(C[N@H+]2CCC[C@@H]3CCC[C@@H]32)c([O-])c1 ZINC001231455913 777224037 /nfs/dbraw/zinc/22/40/37/777224037.db2.gz XLYDYYLCLPKJGF-FZMZJTMJSA-N -1 3 275.348 2.855 20 10 CFCDHM C[C@H]1CCC[N@H+](Cc2cc(C(=O)[O-])ccc2[O-])[C@H]1C ZINC001231563326 777260658 /nfs/dbraw/zinc/26/06/58/777260658.db2.gz HRHRKYDUYUAVKC-QWRGUYRKSA-N -1 3 263.337 2.711 20 10 CFCDHM C[C@H]1CCC[N@@H+](Cc2cc(C(=O)[O-])ccc2[O-])[C@H]1C ZINC001231563326 777260668 /nfs/dbraw/zinc/26/06/68/777260668.db2.gz HRHRKYDUYUAVKC-QWRGUYRKSA-N -1 3 263.337 2.711 20 10 CFCDHM [O-]c1cc(O)c(CN2C[C@@H]3C[C@@H]3[C@H](F)C2)cc1Cl ZINC001232257896 777495235 /nfs/dbraw/zinc/49/52/35/777495235.db2.gz LJQNARAJCJPYSB-OVYXKVPISA-N -1 3 271.719 2.541 20 10 CFCDHM COc1cc([O-])c(CN2C[C@@H](F)C[C@H]2C)cc1Cl ZINC001232266914 777499645 /nfs/dbraw/zinc/49/96/45/777499645.db2.gz SQUNLSDNIZLBQG-SCZZXKLOSA-N -1 3 273.735 2.987 20 10 CFCDHM CN(Cc1ccncc1)Cc1ccc(F)c(F)c1[O-] ZINC001233073633 777787582 /nfs/dbraw/zinc/78/75/82/777787582.db2.gz AXBOMCKZXZUPAC-UHFFFAOYSA-N -1 3 264.275 2.697 20 10 CFCDHM [O-]c1ccc(F)c(F)c1CN1CCC[C@H](CF)C1 ZINC001233334706 777893748 /nfs/dbraw/zinc/89/37/48/777893748.db2.gz QNCIRPFDKWZSAO-SECBINFHSA-N -1 3 259.271 2.852 20 10 CFCDHM O=C(NCc1c([O-])cccc1F)C1CCCCC1 ZINC000928711049 777964738 /nfs/dbraw/zinc/96/47/38/777964738.db2.gz ZIXABXIHQVJIDS-UHFFFAOYSA-N -1 3 251.301 2.728 20 10 CFCDHM [O-]c1ccc(Br)cc1CN1C[C@@H](F)[C@@H](F)C1 ZINC000714556302 778287856 /nfs/dbraw/zinc/28/78/56/778287856.db2.gz SAVHIVMSLUMKCN-AOOOYVTPSA-N -1 3 292.123 2.647 20 10 CFCDHM [O-]c1cc(Cl)c(Cl)cc1CN1CC[C@@H](F)[C@H](O)C1 ZINC001236792184 778939571 /nfs/dbraw/zinc/93/95/71/778939571.db2.gz CPEJWOSZIKVOCZ-ZYHUDNBSSA-N -1 3 294.153 2.604 20 10 CFCDHM CO[C@@H]1CCN(Cc2cc(Cl)c(Cl)cc2[O-])C1 ZINC001236792040 778939678 /nfs/dbraw/zinc/93/96/78/778939678.db2.gz ARBFOHRRSPIAQO-SECBINFHSA-N -1 3 276.163 2.920 20 10 CFCDHM COc1ccc(CN2CC([C@@H](C)OC)C2)c([O-])c1Cl ZINC001236809743 778949274 /nfs/dbraw/zinc/94/92/74/778949274.db2.gz NZPRQGNIXPFBEU-SECBINFHSA-N -1 3 285.771 2.521 20 10 CFCDHM C[C@@H]1CC[C@@H](O)CN1Cc1c([O-])ccc(F)c1Cl ZINC001237120073 779017361 /nfs/dbraw/zinc/01/73/61/779017361.db2.gz ILSLWYOEWWNAKK-RKDXNWHRSA-N -1 3 273.735 2.530 20 10 CFCDHM [O-]c1ccc(F)c(Cl)c1CN1CC2(C1)CCCOC2 ZINC001237123119 779019537 /nfs/dbraw/zinc/01/95/37/779019537.db2.gz HLSOJBPFGJWENV-UHFFFAOYSA-N -1 3 285.746 2.797 20 10 CFCDHM O=C1C[C@H]2CC[C@@H](C1)N2Cc1c([O-])ccc(F)c1Cl ZINC001237122967 779019404 /nfs/dbraw/zinc/01/94/04/779019404.db2.gz FZJGQDGDGJLKSK-DTORHVGOSA-N -1 3 283.730 2.881 20 10 CFCDHM [O-]c1ccc(F)c(Cl)c1CN1CC2(CSC2)C1 ZINC001237125345 779019516 /nfs/dbraw/zinc/01/95/16/779019516.db2.gz CRNRFPFLPWCUED-UHFFFAOYSA-N -1 3 273.760 2.734 20 10 CFCDHM CCN(CCn1cccn1)Cc1c([O-])ccc(F)c1Cl ZINC001237126443 779021011 /nfs/dbraw/zinc/02/10/11/779021011.db2.gz LEEVKKZFCJJJKQ-UHFFFAOYSA-N -1 3 297.761 2.903 20 10 CFCDHM Cc1cc([O-])c(CN2CC(F)(F)C2)cc1Br ZINC001237675877 779158460 /nfs/dbraw/zinc/15/84/60/779158460.db2.gz CVAQMXCHGNCGTB-UHFFFAOYSA-N -1 3 292.123 2.914 20 10 CFCDHM CO[C@H](C)C1CN(Cc2cc(F)cc(Cl)c2[O-])C1 ZINC001237803662 779183233 /nfs/dbraw/zinc/18/32/33/779183233.db2.gz UCOZUHPQGZNWDM-MRVPVSSYSA-N -1 3 273.735 2.651 20 10 CFCDHM C[C@@H]1CCN(Cc2cc(Cl)cc(F)c2[O-])C[C@]1(C)O ZINC001237617157 779700483 /nfs/dbraw/zinc/70/04/83/779700483.db2.gz LXQJBKCWEPLFSS-OTYXRUKQSA-N -1 3 287.762 2.778 20 10 CFCDHM COc1ccncc1CNCc1cccc(Cl)c1[O-] ZINC000701538678 780815268 /nfs/dbraw/zinc/81/52/68/780815268.db2.gz LHDLYYQQVJEGIA-UHFFFAOYSA-N -1 3 278.739 2.739 20 10 CFCDHM [O-]c1cccc(Br)c1CN1CC[C@@H](F)C1 ZINC000707129636 781226544 /nfs/dbraw/zinc/22/65/44/781226544.db2.gz JWCCDCJDZMOEIW-MRVPVSSYSA-N -1 3 274.133 2.699 20 10 CFCDHM C[C@@H](NC[C@@H](O)C(F)(F)F)c1cc(Cl)ccc1[O-] ZINC000273441275 296127925 /nfs/dbraw/zinc/12/79/25/296127925.db2.gz YMEXFXZYIQJDRD-LHLIQPBNSA-N -1 3 283.677 2.619 20 10 CFCDHM [O-]c1ccccc1CN(Cc1ccccn1)C[C@H]1CCCO1 ZINC000119486839 376422721 /nfs/dbraw/zinc/42/27/21/376422721.db2.gz FVPPOVRHSWWGAJ-QGZVFWFLSA-N -1 3 298.386 2.968 20 10 CFCDHM O=C(c1cccc(O)c1[O-])N1CCS[C@H]2CCCC[C@@H]21 ZINC000193130418 296253768 /nfs/dbraw/zinc/25/37/68/296253768.db2.gz FYVBZUPMVKFQGP-AAEUAGOBSA-N -1 3 293.388 2.598 20 10 CFCDHM O=C(c1cccc(O)c1[O-])N1CCC[C@H](C(F)(F)F)C1 ZINC000126458498 377229301 /nfs/dbraw/zinc/22/93/01/377229301.db2.gz DONPDOWPLQHJRB-QMMMGPOBSA-N -1 3 289.253 2.512 20 10 CFCDHM [O-]c1cccc(Cl)c1CN1CCO[C@@H]2CCC[C@@H]21 ZINC000132768528 377875034 /nfs/dbraw/zinc/87/50/34/377875034.db2.gz UQGSFIYKHRQAEX-GXTWGEPZSA-N -1 3 267.756 2.799 20 10 CFCDHM Cc1ccc(C(=O)Nc2nc(C3CC3)cs2)c([O-])c1O ZINC000177670634 380366011 /nfs/dbraw/zinc/36/60/11/380366011.db2.gz WIKQSTLWCKBNFL-UHFFFAOYSA-N -1 3 290.344 2.992 20 10 CFCDHM Cc1ccc(C(=O)N2CCS[C@@H](C(C)C)C2)c([O-])c1O ZINC000179525735 380551829 /nfs/dbraw/zinc/55/18/29/380551829.db2.gz NHEZMUDCCYXDFS-GFCCVEGCSA-N -1 3 295.404 2.620 20 10 CFCDHM CC(=O)c1cc(F)cc(CN[C@@H](C)c2cccnc2)c1[O-] ZINC000181647312 380851825 /nfs/dbraw/zinc/85/18/25/380851825.db2.gz QHUUGFUOCUJILY-JTQLQIEISA-N -1 3 288.322 2.980 20 10 CFCDHM Cc1ccc(C(=O)N(CC(C)C)C(C)C)c([O-])c1O ZINC000182275539 381046697 /nfs/dbraw/zinc/04/66/97/381046697.db2.gz VCYDBBVEHSDGPJ-UHFFFAOYSA-N -1 3 265.353 2.913 20 10 CFCDHM Cc1ccc(C(=O)N2CC3(CCC3)[C@H]2C2CC2)c([O-])c1O ZINC000291828462 381773413 /nfs/dbraw/zinc/77/34/13/381773413.db2.gz FPLWTVJSZJFIJO-OAHLLOKOSA-N -1 3 287.359 2.811 20 10 CFCDHM Cc1nc(C2CCN(Cc3cccc(F)c3[O-])CC2)no1 ZINC000373122017 381933865 /nfs/dbraw/zinc/93/38/65/381933865.db2.gz DOPJGBHFGILTHV-UHFFFAOYSA-N -1 3 291.326 2.602 20 10 CFCDHM Cc1nc([C@@H]2CCCCN2Cc2cc(F)ccc2[O-])no1 ZINC000376169173 382123191 /nfs/dbraw/zinc/12/31/91/382123191.db2.gz ZTOZHILBNDPEOS-ZDUSSCGKSA-N -1 3 291.326 2.950 20 10 CFCDHM O=C(c1cccc(O)c1[O-])N1CCC[C@@H]1Cc1ccccc1 ZINC000187213773 382130159 /nfs/dbraw/zinc/13/01/59/382130159.db2.gz BYNYTHFJYGEJOS-CQSZACIVSA-N -1 3 297.354 2.945 20 10 CFCDHM CC1(C)CN(C(=O)c2cccc(O)c2[O-])[C@@H]1c1cccnc1 ZINC000293667808 382223911 /nfs/dbraw/zinc/22/39/11/382223911.db2.gz GEUYODYTDWMSDD-OAHLLOKOSA-N -1 3 298.342 2.716 20 10 CFCDHM CC(C)c1nnc(CNCc2cc(Cl)c(F)cc2[O-])[nH]1 ZINC000294891451 382541147 /nfs/dbraw/zinc/54/11/47/382541147.db2.gz WLRJVUSHYHRHFD-UHFFFAOYSA-N -1 3 298.749 2.716 20 10 CFCDHM CC(C)c1nc(CNCc2cc(Cl)c(F)cc2[O-])n[nH]1 ZINC000294891451 382541153 /nfs/dbraw/zinc/54/11/53/382541153.db2.gz WLRJVUSHYHRHFD-UHFFFAOYSA-N -1 3 298.749 2.716 20 10 CFCDHM C[C@@H](O)C[C@H]1CCCN1Cc1cc(Cl)c(F)cc1[O-] ZINC000295274047 382605164 /nfs/dbraw/zinc/60/51/64/382605164.db2.gz HWOJMMUSYAMPOM-MWLCHTKSSA-N -1 3 287.762 2.920 20 10 CFCDHM C[C@H](O)C[C@H]1CCCN1Cc1cc(Cl)c(F)cc1[O-] ZINC000295274037 382605609 /nfs/dbraw/zinc/60/56/09/382605609.db2.gz HWOJMMUSYAMPOM-GXSJLCMTSA-N -1 3 287.762 2.920 20 10 CFCDHM Cc1ccc(C(=O)N2CCC(F)(F)C[C@H]2C)c([O-])c1O ZINC000530011706 383763591 /nfs/dbraw/zinc/76/35/91/383763591.db2.gz NBWIKXMLNJTQEG-SECBINFHSA-N -1 3 285.290 2.666 20 10 CFCDHM CCCCN(CC)C(=O)c1ccc(C)c(O)c1[O-] ZINC000267548445 384413227 /nfs/dbraw/zinc/41/32/27/384413227.db2.gz CFMYIBYVNLROFL-UHFFFAOYSA-N -1 3 251.326 2.668 20 10 CFCDHM CN(C)c1cccc(CNCc2c([O-])cccc2Cl)n1 ZINC000269982232 384928971 /nfs/dbraw/zinc/92/89/71/384928971.db2.gz NGWCSVZTWDXCGU-UHFFFAOYSA-N -1 3 291.782 2.796 20 10 CFCDHM [O-]c1c(Cl)cc(Cl)cc1CN1CCC(CO)CC1 ZINC000271046567 385318590 /nfs/dbraw/zinc/31/85/90/385318590.db2.gz RIQPLRGCEVMLHJ-UHFFFAOYSA-N -1 3 290.190 2.903 20 10 CFCDHM CCCCN(Cc1ccn(C)n1)Cc1ccccc1[O-] ZINC000282390675 385299906 /nfs/dbraw/zinc/29/99/06/385299906.db2.gz GVGZWKDTOFNLAV-UHFFFAOYSA-N -1 3 273.380 2.928 20 10 CFCDHM CN(Cc1ccc2c(c1)OCO2)Cc1cccc(F)c1[O-] ZINC000272331475 385512728 /nfs/dbraw/zinc/51/27/28/385512728.db2.gz WQCBUXZPTBXRAO-UHFFFAOYSA-N -1 3 289.306 2.892 20 10 CFCDHM Cc1ccc(C(=O)N2CCC[C@H]2C(C)C)c([O-])c1O ZINC000272869401 385637755 /nfs/dbraw/zinc/63/77/55/385637755.db2.gz VZKRLCFCDJUDPQ-LBPRGKRZSA-N -1 3 263.337 2.667 20 10 CFCDHM CCNC(=O)[C@H](C)N[C@@H](CC)c1cccc(Cl)c1[O-] ZINC000286867617 385728215 /nfs/dbraw/zinc/72/82/15/385728215.db2.gz HANSEDNNMJCJIE-CABZTGNLSA-N -1 3 284.787 2.611 20 10 CFCDHM COc1cc(Cl)cc(CN2CCOC[C@H]2C2CC2)c1[O-] ZINC000184698532 393530000 /nfs/dbraw/zinc/53/00/00/393530000.db2.gz DEANAYCSBRNHLB-ZDUSSCGKSA-N -1 3 297.782 2.665 20 10 CFCDHM CCc1noc([C@@H](C)N(C)Cc2ccccc2[O-])n1 ZINC000109772663 393879400 /nfs/dbraw/zinc/87/94/00/393879400.db2.gz AJQWSUMHEVQSEV-SNVBAGLBSA-N -1 3 261.325 2.531 20 10 CFCDHM O=C(/C=C/c1cncs1)N1CCCc2cccc([O-])c21 ZINC000492949490 394105484 /nfs/dbraw/zinc/10/54/84/394105484.db2.gz HVTNIMPTJYYOGF-VOTSOKGWSA-N -1 3 286.356 2.841 20 10 CFCDHM C[C@H]1CCN(C(=O)/C=C/c2cnccn2)c2c([O-])cccc21 ZINC000492568009 394071509 /nfs/dbraw/zinc/07/15/09/394071509.db2.gz RHESTTNDMRHUJK-FYJFLYSWSA-N -1 3 295.342 2.736 20 10 CFCDHM Cc1ccc(C(=O)N2CCC[C@H](C)CC2)c([O-])c1O ZINC000177677156 292054081 /nfs/dbraw/zinc/05/40/81/292054081.db2.gz QHSXDZZBVMDAEU-JTQLQIEISA-N -1 3 263.337 2.668 20 10 CFCDHM CC[C@H](NCC(=O)NCC1CC1)c1cccc(Cl)c1[O-] ZINC000287290174 288036342 /nfs/dbraw/zinc/03/63/42/288036342.db2.gz BWVWBFLHVMLOSZ-ZDUSSCGKSA-N -1 3 296.798 2.613 20 10 CFCDHM CC[C@H](NCc1cnnn1CC)c1cccc(Cl)c1[O-] ZINC000527918471 330295343 /nfs/dbraw/zinc/29/53/43/330295343.db2.gz YOYVYXOCNPEOQT-ZDUSSCGKSA-N -1 3 294.786 2.898 20 10 CFCDHM CC(C)N(Cc1ccco1)C(=O)c1cccc(O)c1[O-] ZINC000280030405 519660751 /nfs/dbraw/zinc/66/07/51/519660751.db2.gz YAGJFAVHOIHHQY-UHFFFAOYSA-N -1 3 275.304 2.742 20 10 CFCDHM CC(C)n1ccc(CN(C)Cc2ccccc2[O-])n1 ZINC000172015064 519997807 /nfs/dbraw/zinc/99/78/07/519997807.db2.gz LZCQHAWEGXLLOC-UHFFFAOYSA-N -1 3 259.353 2.802 20 10 CFCDHM CC1(C)CN(Cc2cc(Cl)cc(Cl)c2[O-])C[C@@H]1O ZINC000280473545 520475809 /nfs/dbraw/zinc/47/58/09/520475809.db2.gz NJCHCDCTKQMKLX-NSHDSACASA-N -1 3 290.190 2.902 20 10 CFCDHM CC1(C)CN(Cc2ccccc2[O-])C[C@H](C(F)(F)F)O1 ZINC000292740976 520483990 /nfs/dbraw/zinc/48/39/90/520483990.db2.gz HLMJIQDOCCDRGH-GFCCVEGCSA-N -1 3 289.297 2.934 20 10 CFCDHM CCC(=O)N[C@H]1CCCN(Cc2cc(Cl)ccc2[O-])C1 ZINC000158044083 521191808 /nfs/dbraw/zinc/19/18/08/521191808.db2.gz HOULQKMUPCHCQD-ZDUSSCGKSA-N -1 3 296.798 2.536 20 10 CFCDHM CCOC(=O)[C@H](CC)N(Cc1ccccc1[O-])C1CC1 ZINC000191658644 521234839 /nfs/dbraw/zinc/23/48/39/521234839.db2.gz DLFPNRMFAAPCFU-AWEZNQCLSA-N -1 3 277.364 2.698 20 10 CFCDHM CCCN(Cc1ncnn1CCC)Cc1ccccc1[O-] ZINC000279360931 521694505 /nfs/dbraw/zinc/69/45/05/521694505.db2.gz GEAJLGIEPONTCG-UHFFFAOYSA-N -1 3 288.395 2.806 20 10 CFCDHM CC[C@@]1(C)CN(Cc2cc(F)ccc2[O-])CCO1 ZINC000191151150 523717509 /nfs/dbraw/zinc/71/75/09/523717509.db2.gz HCBFLSFHXRPYLY-AWEZNQCLSA-N -1 3 253.317 2.532 20 10 CFCDHM CO[C@@]1(C)CCCN(Cc2cc(F)cc(C(C)=O)c2[O-])C1 ZINC000230275408 523806240 /nfs/dbraw/zinc/80/62/40/523806240.db2.gz ZUYHRBXOZLCSHF-INIZCTEOSA-N -1 3 295.354 2.735 20 10 CFCDHM C[C@H]1CN(Cc2c([O-])ccc(Cl)c2F)CCCO1 ZINC000191313509 524609596 /nfs/dbraw/zinc/60/95/96/524609596.db2.gz BNPHNULXUJLXGQ-VIFPVBQESA-N -1 3 273.735 2.796 20 10 CFCDHM C[C@@H]1CN(Cc2cc(F)ccc2[O-])C[C@@H](C2CC2)O1 ZINC000280105655 524985903 /nfs/dbraw/zinc/98/59/03/524985903.db2.gz AZOLCVUHYHSWTH-BMIGLBTASA-N -1 3 265.328 2.531 20 10 CFCDHM C[C@@H](N[C@@H](C)c1cnn(C)c1)c1ccc(F)cc1[O-] ZINC000273611016 525621402 /nfs/dbraw/zinc/62/14/02/525621402.db2.gz VVGYAQHCEYXGHN-VHSXEESVSA-N -1 3 263.316 2.677 20 10 CFCDHM C[C@@H](N[C@@H](C)c1ncnn1C)c1cc(Cl)ccc1[O-] ZINC000276684046 525625233 /nfs/dbraw/zinc/62/52/33/525625233.db2.gz TYTAKOJDBWCPLZ-BDAKNGLRSA-N -1 3 280.759 2.586 20 10 CFCDHM C[C@H]1COC(C)(C)CN1Cc1cc(F)ccc1[O-] ZINC000754156891 574078812 /nfs/dbraw/zinc/07/88/12/574078812.db2.gz XDRJXOOXWUVJTG-JTQLQIEISA-N -1 3 253.317 2.531 20 10 CFCDHM O=C(OCC[C@H]1CCCCO1)c1cc([O-])cs1 ZINC000754814946 574122468 /nfs/dbraw/zinc/12/24/68/574122468.db2.gz HWFOTMIDTMDJEF-SNVBAGLBSA-N -1 3 256.323 2.570 20 10 CFCDHM COC(=O)Nc1ccc(NC(=O)c2cc([O-])cs2)cc1 ZINC000731871704 574131295 /nfs/dbraw/zinc/13/12/95/574131295.db2.gz JYQTUSGZIIMFIM-UHFFFAOYSA-N -1 3 292.316 2.884 20 10 CFCDHM CCOc1cccc(CNC(=O)c2cc([O-])cs2)c1 ZINC000731872244 574131307 /nfs/dbraw/zinc/13/13/07/574131307.db2.gz YWZJJMPEVCCQQU-UHFFFAOYSA-N -1 3 277.345 2.782 20 10 CFCDHM O=C(NCCCNc1ccccc1)c1cc([O-])cs1 ZINC000731873331 574131869 /nfs/dbraw/zinc/13/18/69/574131869.db2.gz NBWHQXGYZPBKJQ-UHFFFAOYSA-N -1 3 276.361 2.686 20 10 CFCDHM COc1ccc([C@@H](C)NC(=O)c2cc([O-])cs2)cc1 ZINC000732267560 574148165 /nfs/dbraw/zinc/14/81/65/574148165.db2.gz KMWAGAQFUKRJLT-SECBINFHSA-N -1 3 277.345 2.953 20 10 CFCDHM O=C(NCCc1ccc2ccccc2n1)c1cc([O-])cs1 ZINC000732273584 574148604 /nfs/dbraw/zinc/14/86/04/574148604.db2.gz YXGVEMRJWMNJKZ-UHFFFAOYSA-N -1 3 298.367 2.974 20 10 CFCDHM CN(C)Cc1ccccc1NC(=O)c1cc([O-])cs1 ZINC000732271521 574148703 /nfs/dbraw/zinc/14/87/03/574148703.db2.gz IMDLZBYJYCKPLH-UHFFFAOYSA-N -1 3 276.361 2.768 20 10 CFCDHM C[C@H](COc1ccccc1)NC(=O)c1cc([O-])cs1 ZINC000732273498 574148840 /nfs/dbraw/zinc/14/88/40/574148840.db2.gz BEVLDWIKNXDHGC-SNVBAGLBSA-N -1 3 277.345 2.651 20 10 CFCDHM Cc1cc([C@@H]2CCCN2C(=O)c2cc([O-])cs2)on1 ZINC000732269630 574148890 /nfs/dbraw/zinc/14/88/90/574148890.db2.gz GRUOLPDBTATXKZ-JTQLQIEISA-N -1 3 278.333 2.727 20 10 CFCDHM O=C(c1cc([O-])cs1)N1CCC[C@H]1C1CCC1 ZINC000732285992 574149868 /nfs/dbraw/zinc/14/98/68/574149868.db2.gz RALSEIYANKOVME-NSHDSACASA-N -1 3 251.351 2.858 20 10 CFCDHM COC[C@H](NC(=O)c1cc([O-])cs1)c1ccccc1 ZINC000732284194 574149873 /nfs/dbraw/zinc/14/98/73/574149873.db2.gz NQUNIHWBBQWZJZ-LBPRGKRZSA-N -1 3 277.345 2.571 20 10 CFCDHM CC(C)Cc1cc(NC(=O)c2cc([O-])cs2)n(C)n1 ZINC000732280656 574149952 /nfs/dbraw/zinc/14/99/52/574149952.db2.gz NSPLIDCMJIEMIE-UHFFFAOYSA-N -1 3 279.365 2.638 20 10 CFCDHM O=C(c1cc([O-])cs1)N1CCCC[C@@H]1c1ncc[nH]1 ZINC000732280141 574150149 /nfs/dbraw/zinc/15/01/49/574150149.db2.gz ZOJXLKLPOXIABJ-SNVBAGLBSA-N -1 3 277.349 2.544 20 10 CFCDHM COc1ccc(COC(=O)c2cc([O-])cs2)cc1F ZINC000732353626 574152953 /nfs/dbraw/zinc/15/29/53/574152953.db2.gz ISRPVZXGIYNHOH-UHFFFAOYSA-N -1 3 282.292 2.958 20 10 CFCDHM COc1cccc(C(=O)COC(=O)c2cc([O-])cs2)c1 ZINC000732354639 574153323 /nfs/dbraw/zinc/15/33/23/574153323.db2.gz PCJWXGQEOUMBAJ-UHFFFAOYSA-N -1 3 292.312 2.502 20 10 CFCDHM Cc1cccc(NC(=O)COC(=O)c2cc([O-])cs2)c1 ZINC000732354617 574153339 /nfs/dbraw/zinc/15/33/39/574153339.db2.gz XHTCIUFNURQTTJ-UHFFFAOYSA-N -1 3 291.328 2.558 20 10 CFCDHM Cc1ccccc1NC(=O)COC(=O)c1cc([O-])cs1 ZINC000732354747 574153421 /nfs/dbraw/zinc/15/34/21/574153421.db2.gz YEDLVGLCGPLXAF-UHFFFAOYSA-N -1 3 291.328 2.558 20 10 CFCDHM Cc1oc(C(=O)[O-])cc1CN(C)Cc1ccccc1O ZINC000738958678 574191042 /nfs/dbraw/zinc/19/10/42/574191042.db2.gz XMMPNWZJJBPIHS-UHFFFAOYSA-N -1 3 275.304 2.624 20 10 CFCDHM CN(Cc1ccon1)Cc1c([O-])ccc2ccncc21 ZINC000739879272 574227039 /nfs/dbraw/zinc/22/70/39/574227039.db2.gz JNAPSYKUHUUWNV-UHFFFAOYSA-N -1 3 269.304 2.560 20 10 CFCDHM Cc1ncc(CN[C@H](C)c2cc([N+](=O)[O-])ccc2[O-])s1 ZINC000756533600 574244238 /nfs/dbraw/zinc/24/42/38/574244238.db2.gz JQSANWWWLJAXCH-MRVPVSSYSA-N -1 3 293.348 2.916 20 10 CFCDHM CCc1cc(CN[C@H](C)c2ccc(F)cc2[O-])on1 ZINC000756612800 574252041 /nfs/dbraw/zinc/25/20/41/574252041.db2.gz YFKNKOHDUKKRKK-SECBINFHSA-N -1 3 264.300 2.933 20 10 CFCDHM C[C@H](NCc1ccc(F)cn1)c1cc(F)ccc1[O-] ZINC000756657216 574255827 /nfs/dbraw/zinc/25/58/27/574255827.db2.gz BOGPWLPBVQDUJQ-VIFPVBQESA-N -1 3 264.275 2.916 20 10 CFCDHM Cc1cc(CN[C@H]2C[C@H](C)c3c2c([O-])ccc3F)ncn1 ZINC000756775434 574261834 /nfs/dbraw/zinc/26/18/34/574261834.db2.gz HKSATHZMGAAFAA-ZANVPECISA-N -1 3 287.338 2.968 20 10 CFCDHM CO[C@H](CN[C@H](C)c1cc(F)cc(F)c1[O-])C(F)(F)F ZINC000756835113 574266793 /nfs/dbraw/zinc/26/67/93/574266793.db2.gz MSZZLCUGEIAJNE-LHLIQPBNSA-N -1 3 299.239 2.898 20 10 CFCDHM C[C@H](Nc1cnn(CCO)c1)c1ccc2ccccc2c1[O-] ZINC000756855028 574268812 /nfs/dbraw/zinc/26/88/12/574268812.db2.gz JXYWGAWGKPFCDB-LBPRGKRZSA-N -1 3 297.358 2.907 20 10 CFCDHM Cc1nc(COC(=O)c2cc([O-])cs2)cs1 ZINC000740959650 574276005 /nfs/dbraw/zinc/27/60/05/574276005.db2.gz HHKAAFIAGCHDAA-UHFFFAOYSA-N -1 3 255.320 2.576 20 10 CFCDHM Cc1ccc(CCNC(=O)c2cc([O-])cs2)cc1 ZINC000734865453 574305446 /nfs/dbraw/zinc/30/54/46/574305446.db2.gz SOVITPVDPMBNNS-UHFFFAOYSA-N -1 3 261.346 2.735 20 10 CFCDHM O=C(N[C@H]1C[C@H]1Cc1ccccc1)c1cc([O-])cs1 ZINC000743632531 574308290 /nfs/dbraw/zinc/30/82/90/574308290.db2.gz IAYWABOGMAPPTK-YPMHNXCESA-N -1 3 273.357 2.815 20 10 CFCDHM Cc1ccccc1O[C@H](C)CNC(=O)c1cc([O-])cs1 ZINC000743718828 574371306 /nfs/dbraw/zinc/37/13/06/574371306.db2.gz SMKCBBFLRWVADY-LLVKDONJSA-N -1 3 291.372 2.959 20 10 CFCDHM C[C@@H](CNC(=O)c1cc([O-])cs1)Oc1cccc(F)c1 ZINC000743716738 574371348 /nfs/dbraw/zinc/37/13/48/574371348.db2.gz LLZIIIJWXSICIT-VIFPVBQESA-N -1 3 295.335 2.790 20 10 CFCDHM O=C(NCC1(C2CC2)CCC1)c1cc([O-])cs1 ZINC000752627060 574393256 /nfs/dbraw/zinc/39/32/56/574393256.db2.gz KFVIVDJPHAYYND-UHFFFAOYSA-N -1 3 251.351 2.764 20 10 CFCDHM CCOC(=O)[C@@H](CC1CC1)NCc1cc(Cl)ccc1[O-] ZINC000753567698 574404762 /nfs/dbraw/zinc/40/47/62/574404762.db2.gz HOCYSTQVODBWOR-CYBMUJFWSA-N -1 3 297.782 2.867 20 10 CFCDHM C[C@@H]([NH2+]C1CCC(C(=O)[O-])CC1)c1ccccc1[O-] ZINC000086735343 597733180 /nfs/dbraw/zinc/73/31/80/597733180.db2.gz DCEUDCDGEZMMIY-VOMCLLRMSA-N -1 3 263.337 2.686 20 10 CFCDHM O=C([O-])[C@@H]1C[C@H]2CCCC[C@H]2[N@@H+]1Cc1ccccc1[O-] ZINC000250094410 604679415 /nfs/dbraw/zinc/67/94/15/604679415.db2.gz YUFGOMVHOBPLHC-BNOWGMLFSA-N -1 3 275.348 2.610 20 10 CFCDHM O=C([O-])[C@@H]1C[C@H]2CCCC[C@H]2[N@H+]1Cc1ccccc1[O-] ZINC000250094410 604679420 /nfs/dbraw/zinc/67/94/20/604679420.db2.gz YUFGOMVHOBPLHC-BNOWGMLFSA-N -1 3 275.348 2.610 20 10 CFCDHM CC(C)(C)C[C@H]1CCN(C(=O)c2cccc(O)c2[O-])C1 ZINC000307774376 618096849 /nfs/dbraw/zinc/09/68/49/618096849.db2.gz MHWPSHPBOAGBNP-LLVKDONJSA-N -1 3 277.364 2.996 20 10 CFCDHM O=C(NCC[C@@H]1C[C@H]1C1CC1)NCc1c([O-])cccc1F ZINC000924360145 617625432 /nfs/dbraw/zinc/62/54/32/617625432.db2.gz UFABZADRLVHLTI-NEPJUHHUSA-N -1 3 292.354 2.767 20 10 CFCDHM CCn1ccc(CN[C@@H](C)c2ccc(F)cc2[O-])n1 ZINC000840841704 617772174 /nfs/dbraw/zinc/77/21/74/617772174.db2.gz ZAWMTXFOQAKTCI-JTQLQIEISA-N -1 3 263.316 2.599 20 10 CFCDHM C[C@@H]1CCCC[C@]1(C)NC(=O)c1cccc(O)c1[O-] ZINC000308721302 617827582 /nfs/dbraw/zinc/82/75/82/617827582.db2.gz CUBYCYNETYRRKE-BMIGLBTASA-N -1 3 263.337 2.796 20 10 CFCDHM Cc1ccc(C(=O)N(C)c2ccccc2)c([O-])c1O ZINC000179380700 618268346 /nfs/dbraw/zinc/26/83/46/618268346.db2.gz YSOBMGXMQYEKGI-UHFFFAOYSA-N -1 3 257.289 2.683 20 10 CFCDHM Cc1ccc(C(=O)Nc2ccccc2F)c([O-])c1O ZINC000179382276 618269131 /nfs/dbraw/zinc/26/91/31/618269131.db2.gz WTFUKQKGHUMYDL-UHFFFAOYSA-N -1 3 261.252 2.798 20 10 CFCDHM O=C(Nc1ccc(-n2cccn2)cc1)c1cccc(O)c1[O-] ZINC000186909938 618269368 /nfs/dbraw/zinc/26/93/68/618269368.db2.gz AZXHJCDFYUHJPO-UHFFFAOYSA-N -1 3 295.298 2.536 20 10 CFCDHM Cc1ccc(C(=O)Nc2ccccc2N(C)C)c([O-])c1O ZINC000177670776 618469468 /nfs/dbraw/zinc/46/94/68/618469468.db2.gz BPWVHERPKDGSQZ-UHFFFAOYSA-N -1 3 286.331 2.725 20 10 CFCDHM CCc1nc(NC(=O)c2ccc(C)c(O)c2[O-])sc1C ZINC000177672854 618471846 /nfs/dbraw/zinc/47/18/46/618471846.db2.gz CFFOLTMAYPPSTM-UHFFFAOYSA-N -1 3 292.360 2.986 20 10 CFCDHM CCc1onc(C)c1NC(=O)NCc1c([O-])cccc1F ZINC000930572551 618870331 /nfs/dbraw/zinc/87/03/31/618870331.db2.gz HABFGBYZBJUWGQ-UHFFFAOYSA-N -1 3 293.298 2.712 20 10 CFCDHM Cc1cc(C)nc(NC(=O)c2ccc(C)c(O)c2[O-])c1 ZINC000182857181 618901221 /nfs/dbraw/zinc/90/12/21/618901221.db2.gz DZBPRWOBARGOAT-UHFFFAOYSA-N -1 3 272.304 2.670 20 10 CFCDHM CC[C@@H]1CC[C@@H](C)N(C(=O)c2cccc(O)c2[O-])C1 ZINC000311332957 618935150 /nfs/dbraw/zinc/93/51/50/618935150.db2.gz DRAUTPXOXKJDFA-GHMZBOCLSA-N -1 3 263.337 2.749 20 10 CFCDHM Cc1cc([O-])c(CN2CCn3cncc3C2)c(Cl)c1 ZINC000840946106 619107884 /nfs/dbraw/zinc/10/78/84/619107884.db2.gz GFHISYFHVPOVLS-UHFFFAOYSA-N -1 3 277.755 2.566 20 10 CFCDHM COc1ccc(F)c(NC(=O)c2ccc(C)c(O)c2[O-])c1 ZINC000182589595 625354879 /nfs/dbraw/zinc/35/48/79/625354879.db2.gz KCPNZVRQQRWIQA-UHFFFAOYSA-N -1 3 291.278 2.806 20 10 CFCDHM CC(C)OC1CN(Cc2cc(Cl)ccc2[O-])C1 ZINC000895952861 619643092 /nfs/dbraw/zinc/64/30/92/619643092.db2.gz RAYNWLQEVWFRQL-UHFFFAOYSA-N -1 3 255.745 2.655 20 10 CFCDHM CC(C)(C)n1cc(CNCc2c([O-])cccc2F)cn1 ZINC000896639286 619780837 /nfs/dbraw/zinc/78/08/37/619780837.db2.gz CNFGEEWPUKGAJM-UHFFFAOYSA-N -1 3 277.343 2.773 20 10 CFCDHM CCc1nn(C)c(Cl)c1CNCc1c([O-])cccc1F ZINC000896640631 619781303 /nfs/dbraw/zinc/78/13/03/619781303.db2.gz KFAOKOBXAAMWOY-UHFFFAOYSA-N -1 3 297.761 2.770 20 10 CFCDHM Cc1nc(C(C)C)oc1C(=O)NCc1c([O-])cccc1F ZINC000928705232 619995172 /nfs/dbraw/zinc/99/51/72/619995172.db2.gz FBBDPTSFKUPLQJ-UHFFFAOYSA-N -1 3 292.310 2.881 20 10 CFCDHM C[C@H]1CC[C@H](C(=O)NCc2c([O-])cccc2F)C1 ZINC000928709212 619996233 /nfs/dbraw/zinc/99/62/33/619996233.db2.gz YUHDYDPWTYNRKG-UWVGGRQHSA-N -1 3 251.301 2.584 20 10 CFCDHM O=C(NCc1c([O-])cccc1F)c1csc(C2CC2)n1 ZINC000928712557 619997107 /nfs/dbraw/zinc/99/71/07/619997107.db2.gz SRDHZIQOXYLCLV-UHFFFAOYSA-N -1 3 292.335 2.795 20 10 CFCDHM C[C@@H](N[C@H](C)c1ccc(Cl)cc1[O-])c1ncnn1C ZINC000841751891 620217754 /nfs/dbraw/zinc/21/77/54/620217754.db2.gz LETPFLHWYOIXHD-RKDXNWHRSA-N -1 3 280.759 2.586 20 10 CFCDHM CC(C)[C@H](N[C@@H](C)c1c([O-])cccc1F)c1nncn1C ZINC000903063725 621238182 /nfs/dbraw/zinc/23/81/82/621238182.db2.gz HKXOIKKULQGKEI-HZMBPMFUSA-N -1 3 292.358 2.708 20 10 CFCDHM CS[C@@H]1CCCC[C@H]1NC(=O)c1cccc(O)c1[O-] ZINC000229398636 623202031 /nfs/dbraw/zinc/20/20/31/623202031.db2.gz PEJFKIGRWDRZNR-ZYHUDNBSSA-N -1 3 281.377 2.502 20 10 CFCDHM CCc1nc(CNCc2cc(Cl)ccc2[O-])co1 ZINC000825051032 623617096 /nfs/dbraw/zinc/61/70/96/623617096.db2.gz UQFXHTXHLSQZJY-UHFFFAOYSA-N -1 3 266.728 2.886 20 10 CFCDHM CC(C)(C)CCNC(=O)NCc1c([O-])cccc1F ZINC000914208987 623736603 /nfs/dbraw/zinc/73/66/03/623736603.db2.gz HPJPMMVOQCSTSW-UHFFFAOYSA-N -1 3 268.332 2.767 20 10 CFCDHM COCC[C@H]1COCCN1Cc1cc(Cl)c(C)cc1[O-] ZINC000825956182 623775803 /nfs/dbraw/zinc/77/58/03/623775803.db2.gz YMXTXSQXQNOQSB-ZDUSSCGKSA-N -1 3 299.798 2.591 20 10 CFCDHM C[C@@H]1CCC[C@@H](C2CN(C(=O)c3cccc(O)c3[O-])C2)C1 ZINC000829119599 624377756 /nfs/dbraw/zinc/37/77/56/624377756.db2.gz OQECZDPMAHKWHH-VXGBXAGGSA-N -1 3 289.375 2.996 20 10 CFCDHM C[C@@H](NC(=O)NCc1c([O-])cccc1F)C1CCCC1 ZINC000918681724 624461548 /nfs/dbraw/zinc/46/15/48/624461548.db2.gz LSKHYKKDYHDLFF-SNVBAGLBSA-N -1 3 280.343 2.909 20 10 CFCDHM C[C@]1(CNC(=O)NCc2c([O-])cccc2F)CCCS1 ZINC000921439676 624889273 /nfs/dbraw/zinc/88/92/73/624889273.db2.gz HNRROEJGZHIEQS-CQSZACIVSA-N -1 3 298.383 2.616 20 10 CFCDHM CC(C)(NC(=O)c1cccc(O)c1[O-])c1cccc(F)c1 ZINC000185694305 625761392 /nfs/dbraw/zinc/76/13/92/625761392.db2.gz GYSAAWLXIXHMMB-UHFFFAOYSA-N -1 3 289.306 2.902 20 10 CFCDHM CCS[C@@H]1CCCC[C@H]1NC(=O)c1cccc(O)c1[O-] ZINC000185807909 625780773 /nfs/dbraw/zinc/78/07/73/625780773.db2.gz LPLGFLCPIKRFFX-DGCLKSJQSA-N -1 3 295.404 2.892 20 10 CFCDHM C[C@@H](N[C@H]1CCn2ccnc21)c1cc(F)cc(F)c1[O-] ZINC000834830668 625891078 /nfs/dbraw/zinc/89/10/78/625891078.db2.gz GFDUVOHLUAQGAX-PELKAZGASA-N -1 3 279.290 2.663 20 10 CFCDHM CCC(C)(C)OCCNC(=O)NCc1c([O-])cccc1F ZINC000922823111 626374723 /nfs/dbraw/zinc/37/47/23/626374723.db2.gz VHKBROVOPDRNFR-UHFFFAOYSA-N -1 3 298.358 2.536 20 10 CFCDHM O=C(NCCc1cccc(Cl)c1)c1cccc(O)c1[O-] ZINC000186779950 626398926 /nfs/dbraw/zinc/39/89/26/626398926.db2.gz IYQWPWDUVZVDMU-UHFFFAOYSA-N -1 3 291.734 2.724 20 10 CFCDHM Cn1nc(CNCc2c([O-])cccc2Cl)cc1C1CC1 ZINC000922956894 626432969 /nfs/dbraw/zinc/43/29/69/626432969.db2.gz DIUBGNQBXBSIKM-UHFFFAOYSA-N -1 3 291.782 2.946 20 10 CFCDHM CCN1CCN(Cc2cc(Cl)cc(F)c2[O-])[C@H](C)C1 ZINC000809697320 626553943 /nfs/dbraw/zinc/55/39/43/626553943.db2.gz DTVQRGCWHVOAJY-SNVBAGLBSA-N -1 3 286.778 2.711 20 10 CFCDHM CC(C)OC[C@@H]1CN(Cc2c([O-])cccc2Cl)CCO1 ZINC000770687835 627541974 /nfs/dbraw/zinc/54/19/74/627541974.db2.gz FSMRVOAPMVZPJX-LBPRGKRZSA-N -1 3 299.798 2.671 20 10 CFCDHM C[C@]1(O)CCCN(Cc2cc(Cl)cc(F)c2[O-])C1 ZINC000775712381 628057835 /nfs/dbraw/zinc/05/78/35/628057835.db2.gz GRMDYHPNOGEKLH-ZDUSSCGKSA-N -1 3 273.735 2.532 20 10 CFCDHM [O-]c1c(Br)cccc1CN1CC=CCC1 ZINC000779159202 628356990 /nfs/dbraw/zinc/35/69/90/628356990.db2.gz BUFATFMYIIKYKD-UHFFFAOYSA-N -1 3 268.154 2.917 20 10 CFCDHM Cc1ccc(C(=O)Nc2ccc3c[nH]nc3c2)c([O-])c1O ZINC000780858796 628500543 /nfs/dbraw/zinc/50/05/43/628500543.db2.gz BBDONNKXHXIAIU-UHFFFAOYSA-N -1 3 283.287 2.535 20 10 CFCDHM Cc1nc(C)c(NC(=O)c2ccc(C)c(O)c2[O-])s1 ZINC000780959130 628508699 /nfs/dbraw/zinc/50/86/99/628508699.db2.gz HGRVBKMIOSFGJS-UHFFFAOYSA-N -1 3 278.333 2.732 20 10 CFCDHM Cc1ccc2c(c1)CCN2C(=O)c1ccc(C)c(O)c1[O-] ZINC000781011830 628512959 /nfs/dbraw/zinc/51/29/59/628512959.db2.gz AUICBLKIMCWYQF-UHFFFAOYSA-N -1 3 283.327 2.918 20 10 CFCDHM CC(C)(CC(F)(F)F)NC(=O)c1cccc(O)c1[O-] ZINC000781807394 628582984 /nfs/dbraw/zinc/58/29/84/628582984.db2.gz QETXGJVVLHBKDZ-UHFFFAOYSA-N -1 3 277.242 2.559 20 10 CFCDHM CC(C)[C@@H](CC(F)(F)F)NC(=O)c1cccc(O)c1[O-] ZINC000783869963 628752421 /nfs/dbraw/zinc/75/24/21/628752421.db2.gz SFCYHWXIJRQVEW-SECBINFHSA-N -1 3 291.269 2.805 20 10 CFCDHM C[C@H]1C[C@@H](O)CN1Cc1cc(Cl)cc(Cl)c1[O-] ZINC000788269056 629053070 /nfs/dbraw/zinc/05/30/70/629053070.db2.gz KYEHQXDYOCOJTD-OIBJUYFYSA-N -1 3 276.163 2.654 20 10 CFCDHM Cn1ccc2cccc(NC(=O)c3cccc(O)c3[O-])c21 ZINC000788553113 629081432 /nfs/dbraw/zinc/08/14/32/629081432.db2.gz CRWFIJSAXSHWAI-UHFFFAOYSA-N -1 3 282.299 2.842 20 10 CFCDHM COc1ccc(C2(NC(=O)c3cccc(O)c3[O-])CC2)cc1 ZINC000790686266 629257054 /nfs/dbraw/zinc/25/70/54/629257054.db2.gz OLAIIOPWMQIRRC-UHFFFAOYSA-N -1 3 299.326 2.526 20 10 CFCDHM CCCCn1ncc(NC(=O)c2cccc(O)c2[O-])c1C ZINC000790899814 629270571 /nfs/dbraw/zinc/27/05/71/629270571.db2.gz ONMFMRYMYFXURF-UHFFFAOYSA-N -1 3 289.335 2.655 20 10 CFCDHM CCN1CCN(Cc2c([O-])ccc(Cl)c2F)C[C@H]1C ZINC000792167223 629403976 /nfs/dbraw/zinc/40/39/76/629403976.db2.gz FBRDUKPZRDDPTQ-SNVBAGLBSA-N -1 3 286.778 2.711 20 10 CFCDHM CC[C@@H](NCc1ncnn1CC)c1cc(Cl)ccc1[O-] ZINC000794842005 629693463 /nfs/dbraw/zinc/69/34/63/629693463.db2.gz ORYNVMDKANUFER-GFCCVEGCSA-N -1 3 294.786 2.898 20 10 CFCDHM CCN(C(=O)c1cccc(O)c1[O-])C1CC(C)(C)C1 ZINC000839890082 630344579 /nfs/dbraw/zinc/34/45/79/630344579.db2.gz AXQMZISSZXBQNY-UHFFFAOYSA-N -1 3 263.337 2.749 20 10 CFCDHM Cc1cc([O-])c(CNCc2nnc(C(C)C)[nH]2)c(Cl)c1 ZINC000840950906 631279701 /nfs/dbraw/zinc/27/97/01/631279701.db2.gz QLKAPGOEBWSKFM-UHFFFAOYSA-N -1 3 294.786 2.885 20 10 CFCDHM Cc1c(CN(C)Cc2cc(Cl)c(F)cc2[O-])cnn1C ZINC000816594819 632491897 /nfs/dbraw/zinc/49/18/97/632491897.db2.gz PVXOOIHRCGYJPF-UHFFFAOYSA-N -1 3 297.761 2.859 20 10 CFCDHM CC[C@H]1CN(C)CCN1Cc1cc(Cl)c(F)cc1[O-] ZINC000816660945 632507231 /nfs/dbraw/zinc/50/72/31/632507231.db2.gz VSXSIZPKJIYCNL-NSHDSACASA-N -1 3 286.778 2.711 20 10 CFCDHM CC(C)n1cc(CNCc2cc(Cl)ccc2[O-])nn1 ZINC000846056718 632625518 /nfs/dbraw/zinc/62/55/18/632625518.db2.gz YFFDTAIDDPRWNW-UHFFFAOYSA-N -1 3 280.759 2.508 20 10 CFCDHM C[C@]1(CCNC(=O)c2cccc(O)c2[O-])C[C@@]1(F)Cl ZINC000846413025 632707158 /nfs/dbraw/zinc/70/71/58/632707158.db2.gz SFUIBNSXRSLAHD-STQMWFEESA-N -1 3 287.718 2.532 20 10 CFCDHM O=C(Nc1cccc(C2CC2)n1)c1cccc(O)c1[O-] ZINC000817769416 632709257 /nfs/dbraw/zinc/70/92/57/632709257.db2.gz UYSFJCXPFHGNRC-UHFFFAOYSA-N -1 3 270.288 2.623 20 10 CFCDHM CCn1nc(C)c(CNCc2c([O-])cc(C)cc2Cl)n1 ZINC000818220392 632815569 /nfs/dbraw/zinc/81/55/69/632815569.db2.gz GMBVDIZAWOHVSN-UHFFFAOYSA-N -1 3 294.786 2.564 20 10 CFCDHM Cc1ccc(C(=O)Nc2cc([C@@H]3C[C@H]3C)[nH]n2)c([O-])c1O ZINC000855002074 635437564 /nfs/dbraw/zinc/43/75/64/635437564.db2.gz NSZBZGSWICRUBI-PSASIEDQSA-N -1 3 287.319 2.505 20 10 CFCDHM C[C@@H](NC(=O)c1cccc(O)c1[O-])C1CCC(F)CC1 ZINC000856079897 635720141 /nfs/dbraw/zinc/72/01/41/635720141.db2.gz CGZVTUKHQPESQL-KPPDAEKUSA-N -1 3 281.327 2.744 20 10 CFCDHM COC[C@]1(C)CN(Cc2cc(Cl)c(C)cc2[O-])CCO1 ZINC000862552296 637423987 /nfs/dbraw/zinc/42/39/87/637423987.db2.gz VODJSXASCWZSTD-HNNXBMFYSA-N -1 3 299.798 2.591 20 10 CFCDHM Cc1ccc(CCNC(=O)c2cccc(O)c2[O-])c(C)c1 ZINC000192991103 650613980 /nfs/dbraw/zinc/61/39/80/650613980.db2.gz NKABJIZUTBVSHT-UHFFFAOYSA-N -1 3 285.343 2.687 20 10 CFCDHM O=C(NC/C=C/c1ccccc1)c1cccc(O)c1[O-] ZINC000193066771 650620415 /nfs/dbraw/zinc/62/04/15/650620415.db2.gz ZDPRCSAXNINGEM-VMPITWQZSA-N -1 3 269.300 2.541 20 10 CFCDHM O=C([O-])CC[C@@H]1CCCC[N@@H+]1Cc1ccccc1[O-] ZINC000086755136 650797540 /nfs/dbraw/zinc/79/75/40/650797540.db2.gz NIHZDFONWDNAJI-ZDUSSCGKSA-N -1 3 263.337 2.612 20 10 CFCDHM O=C([O-])CC[C@@H]1CCCC[N@H+]1Cc1ccccc1[O-] ZINC000086755136 650797544 /nfs/dbraw/zinc/79/75/44/650797544.db2.gz NIHZDFONWDNAJI-ZDUSSCGKSA-N -1 3 263.337 2.612 20 10 CFCDHM CC(C)CO[C@H]1CCN(Cc2ccc(F)c(F)c2[O-])C1 ZINC000876808338 643018390 /nfs/dbraw/zinc/01/83/90/643018390.db2.gz HTIVRNNPZLSBPS-LBPRGKRZSA-N -1 3 285.334 2.917 20 10 CFCDHM C[C@H](NC(=O)c1cccc(O)c1[O-])c1ccccc1 ZINC000126188585 643027931 /nfs/dbraw/zinc/02/79/31/643027931.db2.gz TYICXSSFGYDASF-JTQLQIEISA-N -1 3 257.289 2.589 20 10 CFCDHM O=C(NC1CCCCCCC1)c1cccc(O)c1[O-] ZINC000126207462 643048861 /nfs/dbraw/zinc/04/88/61/643048861.db2.gz KHFXWVJPYNEJIS-UHFFFAOYSA-N -1 3 263.337 2.941 20 10 CFCDHM C[C@H]1Cc2ccccc2N1C(=O)c1cccc(O)c1[O-] ZINC000126213433 643052273 /nfs/dbraw/zinc/05/22/73/643052273.db2.gz QAPPOUQOXCBUHV-JTQLQIEISA-N -1 3 269.300 2.689 20 10 CFCDHM O=C(Nc1ccc(F)c(F)c1)c1cccc(O)c1[O-] ZINC000126219088 643054467 /nfs/dbraw/zinc/05/44/67/643054467.db2.gz HIDDZWTXJDDLCZ-UHFFFAOYSA-N -1 3 265.215 2.628 20 10 CFCDHM Cc1cccc(NC(=O)c2cccc(O)c2[O-])c1C ZINC000126233752 643056379 /nfs/dbraw/zinc/05/63/79/643056379.db2.gz ANLKVXXPXHZYEU-UHFFFAOYSA-N -1 3 257.289 2.967 20 10 CFCDHM CC1(C)CCC(NC(=O)c2cccc(O)c2[O-])CC1 ZINC000126436481 643212191 /nfs/dbraw/zinc/21/21/91/643212191.db2.gz QWSXFHKOSZAGGE-UHFFFAOYSA-N -1 3 263.337 2.796 20 10 CFCDHM COc1ccc([C@@H](C)NC(=O)c2cccc(O)c2[O-])cc1 ZINC000126466624 643234086 /nfs/dbraw/zinc/23/40/86/643234086.db2.gz ZSZJQOXMCCFTCJ-SNVBAGLBSA-N -1 3 287.315 2.597 20 10 CFCDHM CC1(C)C[C@@H](O)CN(Cc2cc(Cl)c(F)cc2[O-])C1 ZINC000877751291 643527626 /nfs/dbraw/zinc/52/76/26/643527626.db2.gz AWMSPGYCJMORMT-SNVBAGLBSA-N -1 3 287.762 2.778 20 10 CFCDHM Cc1cc(CNCc2cccc(Cl)c2[O-])on1 ZINC000127877272 644342792 /nfs/dbraw/zinc/34/27/92/644342792.db2.gz TUVAWFLUCOEUPN-UHFFFAOYSA-N -1 3 252.701 2.632 20 10 CFCDHM CC1(C)COCCN1Cc1cc(Cl)ccc1[O-] ZINC000133540366 646139267 /nfs/dbraw/zinc/13/92/67/646139267.db2.gz ILYGGVKVTDKULO-UHFFFAOYSA-N -1 3 255.745 2.656 20 10 CFCDHM CCn1ccc(CN[C@@H](C)c2c([O-])cccc2F)n1 ZINC000886625541 647075337 /nfs/dbraw/zinc/07/53/37/647075337.db2.gz UJTHGAXTLJMVBF-JTQLQIEISA-N -1 3 263.316 2.599 20 10 CFCDHM C[C@H](N[C@H]1CCN(C(C)(C)C)C1=O)c1c([O-])cccc1F ZINC000886629944 647077007 /nfs/dbraw/zinc/07/70/07/647077007.db2.gz QWOMDTWDHHXYES-JQWIXIFHSA-N -1 3 294.370 2.581 20 10 CFCDHM C[C@@H](N[C@H](C)c1c([O-])cccc1F)c1ccnn1C ZINC000886648078 647087001 /nfs/dbraw/zinc/08/70/01/647087001.db2.gz LDEAZTBRSLVWMN-NXEZZACHSA-N -1 3 263.316 2.677 20 10 CFCDHM O=C([O-])[C@@H]1C[C@H]2CCCC[C@H]2[N@@H+]1Cc1cc(F)ccc1[O-] ZINC000300436228 647332795 /nfs/dbraw/zinc/33/27/95/647332795.db2.gz GUUBIUJUQUZCSB-HONMWMINSA-N -1 3 293.338 2.749 20 10 CFCDHM O=C([O-])[C@@H]1C[C@H]2CCCC[C@H]2[N@H+]1Cc1cc(F)ccc1[O-] ZINC000300436228 647332800 /nfs/dbraw/zinc/33/28/00/647332800.db2.gz GUUBIUJUQUZCSB-HONMWMINSA-N -1 3 293.338 2.749 20 10 CFCDHM C[C@@H]1C[C@H](NC(=O)NCc2c([O-])cccc2F)CCS1 ZINC000927228545 648741419 /nfs/dbraw/zinc/74/14/19/648741419.db2.gz PUWSVSDTUPILMP-NXEZZACHSA-N -1 3 298.383 2.615 20 10 CFCDHM CSCCCCC(=O)NCc1c([O-])cccc1F ZINC000928706507 648944563 /nfs/dbraw/zinc/94/45/63/648944563.db2.gz VCZLAFPVIQDHND-UHFFFAOYSA-N -1 3 271.357 2.681 20 10 CFCDHM CC(C)(CC(=O)NCc1c([O-])cccc1F)C1CC1 ZINC000928705357 648944634 /nfs/dbraw/zinc/94/46/34/648944634.db2.gz HLLGFNQCVYRYTH-UHFFFAOYSA-N -1 3 265.328 2.974 20 10 CFCDHM CC[C@@H](OC1CCCC1)C(=O)NCc1c([O-])cccc1F ZINC000928706189 648944841 /nfs/dbraw/zinc/94/48/41/648944841.db2.gz SOWUBCRWQYDFDL-OAHLLOKOSA-N -1 3 295.354 2.885 20 10 CFCDHM O=C(NCc1c([O-])cccc1F)[C@@H]1CCC[C@H]2C[C@H]21 ZINC000928705363 648944903 /nfs/dbraw/zinc/94/49/03/648944903.db2.gz HQXHTGKLJZAFCX-HBNTYKKESA-N -1 3 263.312 2.584 20 10 CFCDHM CC(C)c1cc(C(=O)NCc2c([O-])cccc2F)no1 ZINC000928705795 648944999 /nfs/dbraw/zinc/94/49/99/648944999.db2.gz MXGVYJKWKQIDLB-UHFFFAOYSA-N -1 3 278.283 2.573 20 10 CFCDHM O=C(NCc1c([O-])cccc1F)[C@H]1CCC(F)(F)C1 ZINC000928708352 648945301 /nfs/dbraw/zinc/94/53/01/648945301.db2.gz JZJWKFFSFIIHCT-QMMMGPOBSA-N -1 3 273.254 2.583 20 10 CFCDHM O=C(C[C@@H]1C=CCCC1)NCc1c([O-])cccc1F ZINC000928708693 648946135 /nfs/dbraw/zinc/94/61/35/648946135.db2.gz QMVDPYPQLPJUGJ-LLVKDONJSA-N -1 3 263.312 2.894 20 10 CFCDHM O=C(NCc1c([O-])cccc1F)c1c[nH]cc1C1CC1 ZINC000928711080 648946538 /nfs/dbraw/zinc/94/65/38/648946538.db2.gz ZWMWQIJBVYFSHX-UHFFFAOYSA-N -1 3 274.295 2.667 20 10 CFCDHM C[C@H](CC(=O)NCc1c([O-])cccc1F)n1cccc1 ZINC000928712247 648946896 /nfs/dbraw/zinc/94/68/96/648946896.db2.gz PGECANWGLZLWNR-LLVKDONJSA-N -1 3 276.311 2.600 20 10 CFCDHM CCOC(=O)[C@@]12C[C@@H]1CCN2Cc1ccc(Cl)cc1[O-] ZINC001140462825 770667937 /nfs/dbraw/zinc/66/79/37/770667937.db2.gz LQCKXKIHTVBQJT-XHDPSFHLSA-N -1 3 295.766 2.573 20 10 CFCDHM CC(=O)c1cc(F)cc(CN2CCC[C@@H](F)C2)c1[O-] ZINC000689862418 775194146 /nfs/dbraw/zinc/19/41/46/775194146.db2.gz GOCACFRYPAXPRR-LLVKDONJSA-N -1 3 269.291 2.668 20 10 CFCDHM CN1c2ccccc2C(=O)N[C@H]1c1cc(Cl)ccc1[O-] ZINC000024034700 775732719 /nfs/dbraw/zinc/73/27/19/775732719.db2.gz MLQGPQNHMLPVQT-CQSZACIVSA-N -1 3 288.734 2.924 20 10 CFCDHM C[C@]1(F)CCC[N@H+](Cc2cc(C(=O)[O-])ccc2[O-])CC1 ZINC001231561227 777260043 /nfs/dbraw/zinc/26/00/43/777260043.db2.gz PUUPLKDJHVSERE-HNNXBMFYSA-N -1 3 281.327 2.805 20 10 CFCDHM C[C@]1(F)CCC[N@@H+](Cc2cc(C(=O)[O-])ccc2[O-])CC1 ZINC001231561227 777260046 /nfs/dbraw/zinc/26/00/46/777260046.db2.gz PUUPLKDJHVSERE-HNNXBMFYSA-N -1 3 281.327 2.805 20 10 CFCDHM C[C@@H]1CCC[N@H+](Cc2cc(C(=O)[O-])ccc2[O-])CC1 ZINC001231561330 777260143 /nfs/dbraw/zinc/26/01/43/777260143.db2.gz SBDCFVPXAXUIAX-LLVKDONJSA-N -1 3 263.337 2.712 20 10 CFCDHM C[C@@H]1CCC[N@@H+](Cc2cc(C(=O)[O-])ccc2[O-])CC1 ZINC001231561330 777260149 /nfs/dbraw/zinc/26/01/49/777260149.db2.gz SBDCFVPXAXUIAX-LLVKDONJSA-N -1 3 263.337 2.712 20 10 CFCDHM O=C([O-])c1ccc([O-])c(C[NH+]2CCC3(CC(F)C3)CC2)c1 ZINC001231560319 777260215 /nfs/dbraw/zinc/26/02/15/777260215.db2.gz GLEKXRMSBATHPR-UHFFFAOYSA-N -1 3 293.338 2.805 20 10 CFCDHM Cc1ncc2n1CCN(Cc1cc(Cl)c(C)cc1[O-])C2 ZINC001231868208 777357853 /nfs/dbraw/zinc/35/78/53/777357853.db2.gz RLVPGMBIKMWSLI-UHFFFAOYSA-N -1 3 291.782 2.875 20 10 CFCDHM [O-]c1c(CN2Cc3cncnc3C2)ccc2ccccc21 ZINC001231879225 777363358 /nfs/dbraw/zinc/36/33/58/777363358.db2.gz ASVAQAKHAKEPJU-UHFFFAOYSA-N -1 3 277.327 2.851 20 10 CFCDHM COc1cc([O-])c(CN2CCCC(=O)[C@H](C)C2)cc1Cl ZINC001232265940 777498941 /nfs/dbraw/zinc/49/89/41/777498941.db2.gz HLIODDPPTWXTNC-SNVBAGLBSA-N -1 3 297.782 2.855 20 10 CFCDHM COc1cc([O-])c(CN2CCSCC2)cc1Cl ZINC001232267491 777499374 /nfs/dbraw/zinc/49/93/74/777499374.db2.gz HHQTZKWPODYFKH-UHFFFAOYSA-N -1 3 273.785 2.603 20 10 CFCDHM COc1cc([O-])c(CN2CC(C(F)F)C2)cc1Cl ZINC001232270861 777500821 /nfs/dbraw/zinc/50/08/21/777500821.db2.gz LAOMMQBYXXRLCR-UHFFFAOYSA-N -1 3 277.698 2.751 20 10 CFCDHM [O-]c1c(CN2CC[C@H]3CCCO[C@H]3C2)ccc(F)c1F ZINC001233076036 777789015 /nfs/dbraw/zinc/78/90/15/777789015.db2.gz KEAYKKMNIOBXNU-MFKMUULPSA-N -1 3 283.318 2.671 20 10 CFCDHM [O-]c1cc(C(F)(F)F)ccc1CN1CCCCO1 ZINC001233452436 777960763 /nfs/dbraw/zinc/96/07/63/777960763.db2.gz WJZHROABINMTAC-UHFFFAOYSA-N -1 3 261.243 2.938 20 10 CFCDHM [O-]c1cccc(Br)c1CN1C[C@@H](F)[C@@H](F)C1 ZINC000714559263 778293208 /nfs/dbraw/zinc/29/32/08/778293208.db2.gz SZXZDBUBJCCGKP-AOOOYVTPSA-N -1 3 292.123 2.647 20 10 CFCDHM CCC(=O)NCc1cc(Cl)c2cccnc2c1[O-] ZINC001142719935 778917956 /nfs/dbraw/zinc/91/79/56/778917956.db2.gz ZSICTZGUBIDKLD-UHFFFAOYSA-N -1 3 264.712 2.620 20 10 CFCDHM COc1ccc(CN2CC3(C2)CCOCC3)c([O-])c1Cl ZINC001236814385 778950631 /nfs/dbraw/zinc/95/06/31/778950631.db2.gz WUNAOEMUNXVZSG-UHFFFAOYSA-N -1 3 297.782 2.667 20 10 CFCDHM [O-]c1ccc(Cl)c(Cl)c1CN1CCC[C@@H](CO)C1 ZINC001237078102 779006547 /nfs/dbraw/zinc/00/65/47/779006547.db2.gz NSUGBNGRSJUFIK-SECBINFHSA-N -1 3 290.190 2.903 20 10 CFCDHM CO[C@@H]1CCN(Cc2c([O-])ccc(Cl)c2Cl)C1 ZINC001237077725 779007965 /nfs/dbraw/zinc/00/79/65/779007965.db2.gz JYWJFCZURLQGDQ-MRVPVSSYSA-N -1 3 276.163 2.920 20 10 CFCDHM CC1(O)CCN(Cc2c([O-])ccc(F)c2Cl)CC1 ZINC001237121188 779016882 /nfs/dbraw/zinc/01/68/82/779016882.db2.gz KTDXTGLZIKPWRI-UHFFFAOYSA-N -1 3 273.735 2.532 20 10 CFCDHM C[C@H]1C[C@@H](O)CCN1Cc1c([O-])ccc(F)c1Cl ZINC001237125590 779019639 /nfs/dbraw/zinc/01/96/39/779019639.db2.gz DXJUDROHYOLZRP-IUCAKERBSA-N -1 3 273.735 2.530 20 10 CFCDHM CC(=O)C1CCN(Cc2c([O-])ccc(F)c2Cl)CC1 ZINC001237127097 779021130 /nfs/dbraw/zinc/02/11/30/779021130.db2.gz UTNBGQGPXNUOQT-UHFFFAOYSA-N -1 3 285.746 2.986 20 10 CFCDHM C[C@H]1C[C@@H](O)CCN1Cc1cc(F)cc(Cl)c1[O-] ZINC001237799629 779181283 /nfs/dbraw/zinc/18/12/83/779181283.db2.gz SHSUEWOEUWLCEA-KWQFWETISA-N -1 3 273.735 2.530 20 10 CFCDHM C[C@@H]1COCCN(Cc2cc(F)c(Cl)cc2[O-])C1 ZINC001237933627 779209596 /nfs/dbraw/zinc/20/95/96/779209596.db2.gz FDGBISLGHXSQOK-VIFPVBQESA-N -1 3 273.735 2.653 20 10 CFCDHM CC1(O)CCN(Cc2cc(F)c(Cl)cc2[O-])CC1 ZINC001237934178 779724916 /nfs/dbraw/zinc/72/49/16/779724916.db2.gz IKNWZWUMLLUSLW-UHFFFAOYSA-N -1 3 273.735 2.532 20 10 CFCDHM COC[C@H]1CCCCN1Cc1ccc(F)c(F)c1[O-] ZINC000703480450 781015872 /nfs/dbraw/zinc/01/58/72/781015872.db2.gz BFWPBDVRDVTJKC-LLVKDONJSA-N -1 3 271.307 2.671 20 10 CFCDHM C[C@H](NCc1c([O-])cccc1Br)C(F)F ZINC000706868866 781206859 /nfs/dbraw/zinc/20/68/59/781206859.db2.gz TVLYXHBGWQNJJI-LURJTMIESA-N -1 3 280.112 2.898 20 10 CFCDHM [O-]c1c(Br)cc(Cl)cc1CNCCF ZINC000708139438 781266118 /nfs/dbraw/zinc/26/61/18/781266118.db2.gz RGYDMCCEDIGWOC-UHFFFAOYSA-N -1 3 282.540 2.867 20 10 CFCDHM CC(C)O[C@@H]1CCN(Cc2cc(F)cc(F)c2[O-])C1 ZINC000708382028 781271915 /nfs/dbraw/zinc/27/19/15/781271915.db2.gz DCPFDGHGDJJLLQ-GFCCVEGCSA-N -1 3 271.307 2.670 20 10 CFCDHM CCO[C@@H]1CCCN(Cc2cc(F)cc(F)c2[O-])C1 ZINC000708412512 781272845 /nfs/dbraw/zinc/27/28/45/781272845.db2.gz ICXLUSVDPBJMCM-GFCCVEGCSA-N -1 3 271.307 2.671 20 10 CFCDHM CC(C)[C@@H]1CN(Cc2cc(Cl)ccc2[O-])CCO1 ZINC000709028895 781287687 /nfs/dbraw/zinc/28/76/87/781287687.db2.gz ISNIJDIJMWPQRH-AWEZNQCLSA-N -1 3 269.772 2.902 20 10 CFCDHM CN(C)c1ncc(CN(C)Cc2ccccc2[O-])s1 ZINC000091974450 347605308 /nfs/dbraw/zinc/60/53/08/347605308.db2.gz HGTYPQBTUTYUKY-UHFFFAOYSA-N -1 3 277.393 2.547 20 10 CFCDHM CCCOc1ccc(CN2CCOC3(CCC3)C2)c([O-])c1 ZINC000093640454 375281951 /nfs/dbraw/zinc/28/19/51/375281951.db2.gz QXGODERMPNODRF-UHFFFAOYSA-N -1 3 291.391 2.936 20 10 CFCDHM CN(CC(=O)N(C)C1CCCCC1)Cc1ccccc1[O-] ZINC000111235493 375833996 /nfs/dbraw/zinc/83/39/96/375833996.db2.gz DJZGPRSILLIVJO-UHFFFAOYSA-N -1 3 290.407 2.615 20 10 CFCDHM Cc1ccc(C(=O)N(C)[C@H](C)c2ccncc2)c([O-])c1O ZINC000179460417 380546218 /nfs/dbraw/zinc/54/62/18/380546218.db2.gz MHUGHVIUFVOWRN-LLVKDONJSA-N -1 3 286.331 2.634 20 10 CFCDHM CC[C@H](C)CN(C)C(=O)c1ccc(C)c(O)c1[O-] ZINC000179490951 380548949 /nfs/dbraw/zinc/54/89/49/380548949.db2.gz BWRLMJNFLCKJLG-VIFPVBQESA-N -1 3 251.326 2.524 20 10 CFCDHM Cc1nc(C2(NCc3cc(F)ccc3[O-])CCCC2)no1 ZINC000180598782 380681618 /nfs/dbraw/zinc/68/16/18/380681618.db2.gz CGQHJPCOCLKEEE-UHFFFAOYSA-N -1 3 291.326 2.782 20 10 CFCDHM C[C@@H](O)c1ncc(CN(C)Cc2ccccc2[O-])s1 ZINC000289091308 381025501 /nfs/dbraw/zinc/02/55/01/381025501.db2.gz LIVNOSHADWBZPP-SNVBAGLBSA-N -1 3 278.377 2.534 20 10 CFCDHM Cc1ccc(C(=O)NC(C)(C)c2nccs2)c([O-])c1O ZINC000182459083 381091937 /nfs/dbraw/zinc/09/19/37/381091937.db2.gz LBKDTKQFFKKSPI-UHFFFAOYSA-N -1 3 292.360 2.528 20 10 CFCDHM CC[C@H]1CN(Cc2cc(Cl)cc(OC)c2[O-])CCO1 ZINC000184677270 381457970 /nfs/dbraw/zinc/45/79/70/381457970.db2.gz CQQKLRVMCFMMQH-LBPRGKRZSA-N -1 3 285.771 2.665 20 10 CFCDHM C[C@@H](N[C@H](C)c1cc(Cl)ccc1[O-])C(=O)NC(C)(C)C ZINC000185217855 381566535 /nfs/dbraw/zinc/56/65/35/381566535.db2.gz GJQYZEZTJJDIGY-NXEZZACHSA-N -1 3 298.814 2.999 20 10 CFCDHM CC(C)[C@@H]1N(C(=O)c2cccc(O)c2[O-])CC12CCC2 ZINC000293657733 382218709 /nfs/dbraw/zinc/21/87/09/382218709.db2.gz MFTBNHQHQVFULW-AWEZNQCLSA-N -1 3 275.348 2.749 20 10 CFCDHM O=C(c1cccc(O)c1[O-])N1CCC[C@H]1c1nccs1 ZINC000365754753 382437319 /nfs/dbraw/zinc/43/73/19/382437319.db2.gz UHXATZBUJOYAFR-JTQLQIEISA-N -1 3 290.344 2.532 20 10 CFCDHM CCOC(=O)C1(C)CCN(Cc2cccc(F)c2[O-])CC1 ZINC000378544501 382482505 /nfs/dbraw/zinc/48/25/05/382482505.db2.gz SQIVUOOJEYYGFB-UHFFFAOYSA-N -1 3 295.354 2.697 20 10 CFCDHM CCn1cc([C@@H](C)NCc2cccc(F)c2[O-])cn1 ZINC000294834070 382533986 /nfs/dbraw/zinc/53/39/86/382533986.db2.gz LUPRVVYTRXNSPW-SNVBAGLBSA-N -1 3 263.316 2.599 20 10 CFCDHM O=C(c1cccc(O)c1[O-])N1CCS[C@H]2CCCC[C@H]21 ZINC000193130443 382716278 /nfs/dbraw/zinc/71/62/78/382716278.db2.gz FYVBZUPMVKFQGP-YPMHNXCESA-N -1 3 293.388 2.598 20 10 CFCDHM CNC(=O)CN(Cc1ccccc1[O-])[C@@H](C)c1ccccc1 ZINC000268339639 384608128 /nfs/dbraw/zinc/60/81/28/384608128.db2.gz VDTISHNUDSEOJG-AWEZNQCLSA-N -1 3 298.386 2.701 20 10 CFCDHM CCCCN(CC(=O)OCC)Cc1ccccc1[O-] ZINC000282500313 385326828 /nfs/dbraw/zinc/32/68/28/385326828.db2.gz QUGWBFBAYOTNLF-UHFFFAOYSA-N -1 3 265.353 2.557 20 10 CFCDHM CC(=O)c1cc(Cl)cc(CN(C)[C@@H]2CCC[C@H]2O)c1[O-] ZINC000286351293 385596336 /nfs/dbraw/zinc/59/63/36/385596336.db2.gz FPAHSFRTJPTYFC-ZIAGYGMSSA-N -1 3 297.782 2.593 20 10 CFCDHM C[C@@H](N[C@@H]1CCCc2c[nH]nc21)c1ccc(F)cc1[O-] ZINC000273496052 385686045 /nfs/dbraw/zinc/68/60/45/385686045.db2.gz PBLFQZZTJISEJK-NOZJJQNGSA-N -1 3 275.327 2.983 20 10 CFCDHM C[C@@H](N[C@@H](C)c1nncn1C)c1cc(Cl)ccc1[O-] ZINC000273606778 385690733 /nfs/dbraw/zinc/69/07/33/385690733.db2.gz UJWYQKDAAULBEA-BDAKNGLRSA-N -1 3 280.759 2.586 20 10 CFCDHM C[C@H](C(=O)N1CCCCCC1)N(C)Cc1ccccc1[O-] ZINC000109771309 393879516 /nfs/dbraw/zinc/87/95/16/393879516.db2.gz ARTCDLAODRWNFS-CQSZACIVSA-N -1 3 290.407 2.615 20 10 CFCDHM CC(C)c1nc(CN(C)Cc2ccccc2[O-])no1 ZINC000109773830 393879679 /nfs/dbraw/zinc/87/96/79/393879679.db2.gz ZPEMIAKRXFBKNB-UHFFFAOYSA-N -1 3 261.325 2.531 20 10 CFCDHM CN(Cc1noc(C(C)(C)C)n1)Cc1ccccc1[O-] ZINC000109769057 393879803 /nfs/dbraw/zinc/87/98/03/393879803.db2.gz HRCURYZXIGJOIC-UHFFFAOYSA-N -1 3 275.352 2.705 20 10 CFCDHM CCCOc1ccc(CN(C)Cc2cnn(C)c2)c([O-])c1 ZINC000119714318 393923714 /nfs/dbraw/zinc/92/37/14/393923714.db2.gz QYHVEVLSRPMZFE-UHFFFAOYSA-N -1 3 289.379 2.547 20 10 CFCDHM Cc1ccc([C@@H](C)NCc2ncnn2C(C)(C)C)c([O-])c1 ZINC000281922109 394095064 /nfs/dbraw/zinc/09/50/64/394095064.db2.gz AOIBUUCNEITMJU-GFCCVEGCSA-N -1 3 288.395 2.898 20 10 CFCDHM [O-]c1c(F)cccc1CN1CC[C@@H](Oc2ccncc2)C1 ZINC000369394126 267240740 /nfs/dbraw/zinc/24/07/40/267240740.db2.gz ZGLLVJITUCPGCY-CQSZACIVSA-N -1 3 288.322 2.580 20 10 CFCDHM O=C(Nc1cccc2c1OCCC2)c1cccc(O)c1[O-] ZINC000370032634 267284997 /nfs/dbraw/zinc/28/49/97/267284997.db2.gz LTLNZZCNROPANB-UHFFFAOYSA-N -1 3 285.299 2.675 20 10 CFCDHM [O-]c1ccc(Cl)cc1CN1CCC[C@H]1c1ncon1 ZINC000371380955 267397404 /nfs/dbraw/zinc/39/74/04/267397404.db2.gz BZTMTNGFJKARRM-NSHDSACASA-N -1 3 279.727 2.766 20 10 CFCDHM CC[C@H](N[C@H](C)c1nncn1C)c1cccc(Cl)c1[O-] ZINC000287789039 288084277 /nfs/dbraw/zinc/08/42/77/288084277.db2.gz SRHFQZKOFHDSEQ-SKDRFNHKSA-N -1 3 294.786 2.976 20 10 CFCDHM Cc1noc([C@@H]2CCCCN2Cc2cc(F)ccc2[O-])n1 ZINC000289753910 279255420 /nfs/dbraw/zinc/25/54/20/279255420.db2.gz JIKWETFSYBTWPR-ZDUSSCGKSA-N -1 3 291.326 2.950 20 10 CFCDHM CC1(C)OC[C@H]2C[C@]21NCc1c([O-])ccc(Cl)c1F ZINC000527765804 330281684 /nfs/dbraw/zinc/28/16/84/330281684.db2.gz JUBBBJSSSFRGAJ-CLAHSXSESA-N -1 3 285.746 2.842 20 10 CFCDHM C[C@H]1CN(C(=O)/C=C\c2cncc([O-])c2)c2ccccc2O1 ZINC000492435235 332397335 /nfs/dbraw/zinc/39/73/35/332397335.db2.gz FHRSDZQXRBWJMJ-DGMVEKRQSA-N -1 3 296.326 2.615 20 10 CFCDHM C[C@H]1O[C@@H](C)[C@H](C)[C@@H]1C(=O)NCc1cc(Cl)ccc1[O-] ZINC000529513805 333492200 /nfs/dbraw/zinc/49/22/00/333492200.db2.gz UFKRGMXOTBSKLO-RZGXBDKHSA-N -1 3 297.782 2.721 20 10 CFCDHM Cc1csc(COC(=O)c2cc([O-])cs2)n1 ZINC000756410380 574110700 /nfs/dbraw/zinc/11/07/00/574110700.db2.gz KTKMKVCFPDWQIJ-UHFFFAOYSA-N -1 3 255.320 2.576 20 10 CFCDHM CCS[C@H]1CCC[C@H]1NC(=O)c1cccc(O)c1[O-] ZINC000187165974 521732078 /nfs/dbraw/zinc/73/20/78/521732078.db2.gz ZRNJXPBYMDBBSR-PWSUYJOCSA-N -1 3 281.377 2.502 20 10 CFCDHM CC(=O)c1cc(Cl)cc(CN[C@H](C)c2cn[nH]c2)c1[O-] ZINC000275244254 518279062 /nfs/dbraw/zinc/27/90/62/518279062.db2.gz XPAKKMSHLMMJPF-MRVPVSSYSA-N -1 3 293.754 2.822 20 10 CFCDHM CCOCc1nc([C@H](C)N[C@H](C)c2ccccc2[O-])no1 ZINC000290020794 520218427 /nfs/dbraw/zinc/21/84/27/520218427.db2.gz CGRXUADNORXDCD-MNOVXSKESA-N -1 3 291.351 2.724 20 10 CFCDHM CCS[C@H]1CCC[C@@H]1NC(=O)c1cccc(O)c1[O-] ZINC000187165936 521731525 /nfs/dbraw/zinc/73/15/25/521731525.db2.gz ZRNJXPBYMDBBSR-JQWIXIFHSA-N -1 3 281.377 2.502 20 10 CFCDHM CC[C@H]1CO[C@H](C)CN1Cc1cc(F)cc(C(C)=O)c1[O-] ZINC000048915889 523351050 /nfs/dbraw/zinc/35/10/50/523351050.db2.gz BIZSORJUNPTMOU-YGRLFVJLSA-N -1 3 295.354 2.733 20 10 CFCDHM CC[C@]1(C)CN(Cc2cc(F)ccc2[O-])CCO1 ZINC000191151134 523576392 /nfs/dbraw/zinc/57/63/92/523576392.db2.gz HCBFLSFHXRPYLY-CQSZACIVSA-N -1 3 253.317 2.532 20 10 CFCDHM C[C@@H]1CCC[C@@H](C)N1C(=O)CN(C)Cc1ccccc1[O-] ZINC000264595693 524273804 /nfs/dbraw/zinc/27/38/04/524273804.db2.gz IEMLMSNLVNCLID-ZIAGYGMSSA-N -1 3 290.407 2.614 20 10 CFCDHM C[C@H]1CN2CCCC[C@@H]2CN1Cc1cccc(F)c1[O-] ZINC000166378276 524686301 /nfs/dbraw/zinc/68/63/01/524686301.db2.gz SRYYGSGQIAFOEU-GXTWGEPZSA-N -1 3 278.371 2.590 20 10 CFCDHM C[C@@H](N[C@@H](CCO)c1ccco1)c1ccc(F)cc1[O-] ZINC000186562882 525627198 /nfs/dbraw/zinc/62/71/98/525627198.db2.gz GQBHWWOCHVBZQS-MFKMUULPSA-N -1 3 279.311 2.899 20 10 CFCDHM Cc1ccc(C(=O)N2CC(C)(C)[C@H]2C2CC2)c([O-])c1O ZINC000291967760 526080600 /nfs/dbraw/zinc/08/06/00/526080600.db2.gz SLZRKKFIAKSFFB-CQSZACIVSA-N -1 3 275.348 2.667 20 10 CFCDHM Cc1ccc(C(=O)N[C@@H](C)CCc2ccco2)c([O-])c1O ZINC000272655421 526192569 /nfs/dbraw/zinc/19/25/69/526192569.db2.gz LMGVQJSRXLFCOK-NSHDSACASA-N -1 3 289.331 2.750 20 10 CFCDHM [O-]c1c(Cl)cccc1CN1CC[C@@H](n2cccn2)C1 ZINC000291309306 526325765 /nfs/dbraw/zinc/32/57/65/526325765.db2.gz RMUXGUSOIVJHBL-GFCCVEGCSA-N -1 3 277.755 2.689 20 10 CFCDHM [O-]c1c(F)cccc1CN1CC[C@H](Oc2cccnc2)C1 ZINC000361053150 526329925 /nfs/dbraw/zinc/32/99/25/526329925.db2.gz QEVCTVLVDMVQIS-AWEZNQCLSA-N -1 3 288.322 2.580 20 10 CFCDHM [O-]c1ccc(Cl)cc1CN1CCO[C@H]2CCC[C@H]21 ZINC000228143524 526347426 /nfs/dbraw/zinc/34/74/26/526347426.db2.gz YJXFTVWUIBVSTP-OCCSQVGLSA-N -1 3 267.756 2.799 20 10 CFCDHM [O-]c1cccc(Cl)c1CN1CCCSCC1 ZINC000272845547 526364031 /nfs/dbraw/zinc/36/40/31/526364031.db2.gz SAFNATORUHDFDO-UHFFFAOYSA-N -1 3 257.786 2.985 20 10 CFCDHM O=c1[nH]ccc2c1CN(Cc1cccc(Cl)c1[O-])CC2 ZINC000276977168 526379871 /nfs/dbraw/zinc/37/98/71/526379871.db2.gz DTDAKYDTMXTYCB-UHFFFAOYSA-N -1 3 290.750 2.705 20 10 CFCDHM Cn1ncc2c1CCC[C@H]2NCc1cccc(Cl)c1[O-] ZINC000158104482 527580268 /nfs/dbraw/zinc/58/02/68/527580268.db2.gz VVZOWSZZGQBVRX-CYBMUJFWSA-N -1 3 291.782 2.946 20 10 CFCDHM Cc1nn(C)c(C)c1CNCc1c([O-])cccc1Cl ZINC000083552343 527635755 /nfs/dbraw/zinc/63/57/55/527635755.db2.gz WJNFITBUNPYHDV-UHFFFAOYSA-N -1 3 279.771 2.686 20 10 CFCDHM CC[N@H+](CC(=O)[O-])Cc1cc(C(C)C)c(C)cc1[O-] ZINC000737074190 574108470 /nfs/dbraw/zinc/10/84/70/574108470.db2.gz CGYMOLWUKFFOFH-UHFFFAOYSA-N -1 3 265.353 2.731 20 10 CFCDHM CC[N@@H+](CC(=O)[O-])Cc1cc(C(C)C)c(C)cc1[O-] ZINC000737074190 574108472 /nfs/dbraw/zinc/10/84/72/574108472.db2.gz CGYMOLWUKFFOFH-UHFFFAOYSA-N -1 3 265.353 2.731 20 10 CFCDHM C[C@@H](NCc1ccc(F)cn1)c1ccc(F)cc1[O-] ZINC000756659193 574127757 /nfs/dbraw/zinc/12/77/57/574127757.db2.gz PJLLDWQHGXMXDQ-SECBINFHSA-N -1 3 264.275 2.916 20 10 CFCDHM CN(Cc1cn(-c2ccccc2)nn1)Cc1ccccc1[O-] ZINC000731843558 574130204 /nfs/dbraw/zinc/13/02/04/574130204.db2.gz QREJGDUOSUOUEM-UHFFFAOYSA-N -1 3 294.358 2.605 20 10 CFCDHM O=C(NCCc1ccccc1F)c1cc([O-])cs1 ZINC000731863977 574130836 /nfs/dbraw/zinc/13/08/36/574130836.db2.gz HVIPSLPGFFCGHX-UHFFFAOYSA-N -1 3 265.309 2.565 20 10 CFCDHM COc1ccc(NC(=O)c2cc([O-])cs2)cc1OC ZINC000731865769 574131313 /nfs/dbraw/zinc/13/13/13/574131313.db2.gz HHMYKCCOUMYGDP-UHFFFAOYSA-N -1 3 279.317 2.723 20 10 CFCDHM Cc1ccc(OCCN(C)C(=O)c2cc([O-])cs2)cc1 ZINC000731865205 574131462 /nfs/dbraw/zinc/13/14/62/574131462.db2.gz IRRCRIPEQYWDBM-UHFFFAOYSA-N -1 3 291.372 2.913 20 10 CFCDHM O=C(Nc1ccc2c(c1)OCCCO2)c1cc([O-])cs1 ZINC000731866797 574132447 /nfs/dbraw/zinc/13/24/47/574132447.db2.gz ZABAUUPBFNWCCQ-UHFFFAOYSA-N -1 3 291.328 2.867 20 10 CFCDHM O=C(COC(=O)c1cc([O-])cs1)c1ccc(F)cc1 ZINC000731910244 574133162 /nfs/dbraw/zinc/13/31/62/574133162.db2.gz QDCSHRPWORNZOP-UHFFFAOYSA-N -1 3 280.276 2.633 20 10 CFCDHM O=C(N[C@@H]1C[C@@H]1c1cccc(F)c1)c1cc([O-])cs1 ZINC000732278418 574147910 /nfs/dbraw/zinc/14/79/10/574147910.db2.gz MDZAACWCRLSVOE-VXGBXAGGSA-N -1 3 277.320 2.879 20 10 CFCDHM CN(Cc1ccc(Cl)nc1)C(=O)c1cc([O-])cs1 ZINC000732266979 574148251 /nfs/dbraw/zinc/14/82/51/574148251.db2.gz SHDJBQWOQJYVPV-UHFFFAOYSA-N -1 3 282.752 2.774 20 10 CFCDHM COc1cc(F)ccc1NC(=O)c1cc([O-])cs1 ZINC000732269846 574148438 /nfs/dbraw/zinc/14/84/38/574148438.db2.gz VTAQBBZBDZKRHN-UHFFFAOYSA-N -1 3 267.281 2.854 20 10 CFCDHM CCN(CC)c1ccc(NC(=O)c2cc([O-])cs2)cn1 ZINC000732272057 574148725 /nfs/dbraw/zinc/14/87/25/574148725.db2.gz FTDRMEZGWFGSMY-UHFFFAOYSA-N -1 3 291.376 2.947 20 10 CFCDHM C[C@@H](NC(=O)c1cc([O-])cs1)c1cccc([N+](=O)[O-])c1 ZINC000732273874 574148750 /nfs/dbraw/zinc/14/87/50/574148750.db2.gz FEUICBUNRHFBPX-MRVPVSSYSA-N -1 3 292.316 2.853 20 10 CFCDHM CN(CCc1ccc(F)cc1)C(=O)c1cc([O-])cs1 ZINC000732276275 574149260 /nfs/dbraw/zinc/14/92/60/574149260.db2.gz PKCJPBRWKBENBG-UHFFFAOYSA-N -1 3 279.336 2.908 20 10 CFCDHM CCc1nc(CN(C)C(=O)c2cc([O-])cs2)cs1 ZINC000732277169 574149299 /nfs/dbraw/zinc/14/92/99/574149299.db2.gz BYLPONUQRPCSRE-UHFFFAOYSA-N -1 3 282.390 2.745 20 10 CFCDHM O=C(N[C@@H]1C[C@H]1c1ccccc1)c1cc([O-])cs1 ZINC000732277755 574149579 /nfs/dbraw/zinc/14/95/79/574149579.db2.gz OKDZJWCFMPVWDQ-NWDGAFQWSA-N -1 3 259.330 2.740 20 10 CFCDHM CN1CCN(C(=O)c2cc([O-])cs2)Cc2ccccc21 ZINC000732285160 574150168 /nfs/dbraw/zinc/15/01/68/574150168.db2.gz ULCOLWMNAADBQK-UHFFFAOYSA-N -1 3 288.372 2.546 20 10 CFCDHM O=C(N[C@@H]1[C@H]2CCO[C@@H]2C12CCCC2)c1cc([O-])cs1 ZINC000755297405 574152957 /nfs/dbraw/zinc/15/29/57/574152957.db2.gz SJEVQKPOGJBFIP-RTXFEEFZSA-N -1 3 293.388 2.531 20 10 CFCDHM CC(C)[C@H](OC(=O)c1cc([O-])cs1)C(=O)NC(C)(C)C ZINC000732354410 574153207 /nfs/dbraw/zinc/15/32/07/574153207.db2.gz LLQFRIXZJIRDDV-NSHDSACASA-N -1 3 299.392 2.550 20 10 CFCDHM Cc1nn(C)c(Cl)c1COC(=O)c1cc([O-])cs1 ZINC000732354963 574153274 /nfs/dbraw/zinc/15/32/74/574153274.db2.gz XTZMVVXTHXBOHW-UHFFFAOYSA-N -1 3 286.740 2.506 20 10 CFCDHM O=C(c1cc([O-])cs1)N1CCS[C@@H]2CCCC[C@@H]21 ZINC000752823989 574181853 /nfs/dbraw/zinc/18/18/53/574181853.db2.gz GILPJXAUKAJDQU-WDEREUQCSA-N -1 3 283.418 2.954 20 10 CFCDHM CN(C)c1ccc(CN[C@@H](C(=O)[O-])c2ccsc2)cc1 ZINC000756363090 574229707 /nfs/dbraw/zinc/22/97/07/574229707.db2.gz RMBPMKVMFUZPBO-CQSZACIVSA-N -1 3 290.388 2.730 20 10 CFCDHM CCN(CC)C(=O)CN[C@@H](C)c1cc(Cl)ccc1[O-] ZINC000756459688 574238936 /nfs/dbraw/zinc/23/89/36/574238936.db2.gz WSHGCTVQBBLOJN-JTQLQIEISA-N -1 3 284.787 2.565 20 10 CFCDHM Cc1n[nH]cc1CN[C@@H](C)c1cc(F)cc(F)c1[O-] ZINC000756740187 574260070 /nfs/dbraw/zinc/26/00/70/574260070.db2.gz QGRRJGWFFDQOII-QMMMGPOBSA-N -1 3 267.279 2.553 20 10 CFCDHM Cc1cc(CN[C@@H]2C[C@@H](C)c3c2c([O-])ccc3F)ncn1 ZINC000756775427 574261642 /nfs/dbraw/zinc/26/16/42/574261642.db2.gz HKSATHZMGAAFAA-NOZJJQNGSA-N -1 3 287.338 2.968 20 10 CFCDHM C[C@H](N[C@@H](C)c1cc(F)cc(F)c1[O-])c1cn[nH]c1 ZINC000756776460 574261720 /nfs/dbraw/zinc/26/17/20/574261720.db2.gz PIUSIQZJLSOFHR-YUMQZZPRSA-N -1 3 267.279 2.805 20 10 CFCDHM CCc1nnc([C@H](C)N[C@H](C)c2cc(F)cc(F)c2[O-])[nH]1 ZINC000756780217 574262163 /nfs/dbraw/zinc/26/21/63/574262163.db2.gz XIAAHXXXGRLAGZ-SFYZADRCSA-N -1 3 296.321 2.763 20 10 CFCDHM CCc1nc([C@H](C)N[C@H](C)c2cc(F)cc(F)c2[O-])n[nH]1 ZINC000756780217 574262165 /nfs/dbraw/zinc/26/21/65/574262165.db2.gz XIAAHXXXGRLAGZ-SFYZADRCSA-N -1 3 296.321 2.763 20 10 CFCDHM C[C@@H](NCc1cocn1)c1ccc(Br)cc1[O-] ZINC000756831108 574265959 /nfs/dbraw/zinc/26/59/59/574265959.db2.gz LBGGLQIHBVUXDD-MRVPVSSYSA-N -1 3 297.152 2.994 20 10 CFCDHM COc1cc(CCNC(=O)c2cc([O-])cs2)ccc1C ZINC000741299519 574286063 /nfs/dbraw/zinc/28/60/63/574286063.db2.gz UIJVYTUXMZBRAI-UHFFFAOYSA-N -1 3 291.372 2.743 20 10 CFCDHM [O-]c1ccc2ccncc2c1CN1CCC[C@@H]1c1ncon1 ZINC000750021000 574321374 /nfs/dbraw/zinc/32/13/74/574321374.db2.gz ZHGSROXSHNIYRJ-CQSZACIVSA-N -1 3 296.330 2.661 20 10 CFCDHM C[C@H](NC(=O)c1cc([O-])cs1)c1nc(C(C)(C)C)no1 ZINC000743800286 574372283 /nfs/dbraw/zinc/37/22/83/574372283.db2.gz ULDVAIGLSPPWNF-ZETCQYMHSA-N -1 3 295.364 2.625 20 10 CFCDHM CCSCC[C@@H](C)NC(=O)c1cc([O-])cs1 ZINC000743807679 574372684 /nfs/dbraw/zinc/37/26/84/574372684.db2.gz RACGHUDLBXWRFO-MRVPVSSYSA-N -1 3 259.396 2.715 20 10 CFCDHM CC(C)Oc1cc(CNC(=O)c2cc([O-])cs2)ccn1 ZINC000752629615 574393235 /nfs/dbraw/zinc/39/32/35/574393235.db2.gz FSVOEEWJFLNIGX-UHFFFAOYSA-N -1 3 292.360 2.566 20 10 CFCDHM CO[C@H](C)c1nc(CNC(=O)c2cc([O-])cs2)cs1 ZINC000752824186 574395611 /nfs/dbraw/zinc/39/56/11/574395611.db2.gz JRZVFZFOQPTLRF-SSDOTTSWSA-N -1 3 298.389 2.548 20 10 CFCDHM Cc1ccc(C(=O)N2CC[C@H](C(C)(C)C)C2)c([O-])c1O ZINC000753229947 574400449 /nfs/dbraw/zinc/40/04/49/574400449.db2.gz SJSDWZSRTMWXCX-NSHDSACASA-N -1 3 277.364 2.914 20 10 CFCDHM CN(C[C@@H]1CC=CCC1)C(=O)c1cc([O-])cs1 ZINC000753504086 574403377 /nfs/dbraw/zinc/40/33/77/574403377.db2.gz QXMVZIKVTJRPNA-SNVBAGLBSA-N -1 3 251.351 2.882 20 10 CFCDHM O=C([O-])c1ccc(C[NH2+]Cc2cc(F)ccc2[O-])cc1 ZINC000821545746 598212882 /nfs/dbraw/zinc/21/28/82/598212882.db2.gz NJKCQXZKCKHLPR-UHFFFAOYSA-N -1 3 275.279 2.519 20 10 CFCDHM C[N@H+](Cc1ccc(C(=O)[O-])c(F)c1)Cc1ccccc1[O-] ZINC000830811109 601633881 /nfs/dbraw/zinc/63/38/81/601633881.db2.gz MVNYWOIYNBFYDO-UHFFFAOYSA-N -1 3 289.306 2.862 20 10 CFCDHM C[N@@H+](Cc1ccc(C(=O)[O-])c(F)c1)Cc1ccccc1[O-] ZINC000830811109 601633882 /nfs/dbraw/zinc/63/38/82/601633882.db2.gz MVNYWOIYNBFYDO-UHFFFAOYSA-N -1 3 289.306 2.862 20 10 CFCDHM C[C@@H]1C[N@H+](Cc2c([O-])ccc3ccccc32)C[C@H]1C(=O)[O-] ZINC000235391102 601817078 /nfs/dbraw/zinc/81/70/78/601817078.db2.gz UJISWMXXHFLTFH-BXUZGUMPSA-N -1 3 285.343 2.698 20 10 CFCDHM C[C@@H]1C[N@@H+](Cc2c([O-])ccc3ccccc32)C[C@H]1C(=O)[O-] ZINC000235391102 601817079 /nfs/dbraw/zinc/81/70/79/601817079.db2.gz UJISWMXXHFLTFH-BXUZGUMPSA-N -1 3 285.343 2.698 20 10 CFCDHM COc1ccc(O)c([C@H](C)NCc2cc(C(=O)[O-])co2)c1 ZINC000833733601 605127159 /nfs/dbraw/zinc/12/71/59/605127159.db2.gz LAYRXQCOUJXSRC-VIFPVBQESA-N -1 3 291.303 2.543 20 10 CFCDHM C[C@@H]1CN(Cc2cc(F)cc(F)c2[O-])C[C@@H](C)S1 ZINC000893977858 618258462 /nfs/dbraw/zinc/25/84/62/618258462.db2.gz KVOGTZRATAFUEO-RKDXNWHRSA-N -1 3 273.348 2.996 20 10 CFCDHM CCn1cc(CN(C)Cc2cc(F)cc(F)c2[O-])cn1 ZINC000894029334 618281665 /nfs/dbraw/zinc/28/16/65/618281665.db2.gz YQNZJFJRGKASAH-UHFFFAOYSA-N -1 3 281.306 2.519 20 10 CFCDHM Cc1ccc(C(=O)N2CCc3ccc(F)cc32)c([O-])c1O ZINC000177677381 618470367 /nfs/dbraw/zinc/47/03/67/618470367.db2.gz PBNYUMQUTSPPNX-UHFFFAOYSA-N -1 3 287.290 2.748 20 10 CFCDHM CN(Cc1ncc[nH]1)Cc1ccc(Br)cc1[O-] ZINC000894586485 619424784 /nfs/dbraw/zinc/42/47/84/619424784.db2.gz FNXPOPQMUZCIFQ-UHFFFAOYSA-N -1 3 296.168 2.510 20 10 CFCDHM [O-]c1cccc(F)c1CNc1cc(NCC2CC2)ncn1 ZINC000895832167 619619283 /nfs/dbraw/zinc/61/92/83/619619283.db2.gz CVVRISHOYHECHL-UHFFFAOYSA-N -1 3 288.326 2.755 20 10 CFCDHM Cn1ncc(C2CCC2)c1CNCc1c([O-])cccc1F ZINC000896639048 619781087 /nfs/dbraw/zinc/78/10/87/619781087.db2.gz TWMOBLNBFSNUAM-UHFFFAOYSA-N -1 3 289.354 2.822 20 10 CFCDHM C[C@@H](CC(=O)NCc1c([O-])cccc1F)C(F)(F)F ZINC000928707663 619996483 /nfs/dbraw/zinc/99/64/83/619996483.db2.gz ABQFBJYUYUEMNY-ZETCQYMHSA-N -1 3 279.233 2.736 20 10 CFCDHM CC(=O)c1cc(F)cc(CN2CC[C@@H]2C(F)(F)F)c1[O-] ZINC000821269090 622882093 /nfs/dbraw/zinc/88/20/93/622882093.db2.gz CVQMAVQEFXEYSB-LLVKDONJSA-N -1 3 291.244 2.871 20 10 CFCDHM C[C@H]1CCC[C@H](CNC(=O)c2cccc(O)c2[O-])C1 ZINC000228736247 623160227 /nfs/dbraw/zinc/16/02/27/623160227.db2.gz XBGVYASTMOOMCS-QWRGUYRKSA-N -1 3 263.337 2.654 20 10 CFCDHM CC[C@@H]1COCCN1Cc1cc(Cl)c(C)cc1[O-] ZINC000824597950 623529791 /nfs/dbraw/zinc/52/97/91/623529791.db2.gz XOHNKPZAFMCFJU-GFCCVEGCSA-N -1 3 269.772 2.965 20 10 CFCDHM Cc1cc([O-])c(CN2CCCC3(C2)OCCO3)cc1Cl ZINC000825451237 623696503 /nfs/dbraw/zinc/69/65/03/623696503.db2.gz RRJCIEQHCUUCKW-UHFFFAOYSA-N -1 3 297.782 2.693 20 10 CFCDHM Cc1cc([O-])c(CN2CCO[C@H](C(F)F)C2)cc1Cl ZINC000825778880 623753728 /nfs/dbraw/zinc/75/37/28/623753728.db2.gz CDIZNQURCKLARE-LBPRGKRZSA-N -1 3 291.725 2.820 20 10 CFCDHM CC[C@@H](NC(=O)NCc1c([O-])cccc1F)C(C)C ZINC000914369527 623775994 /nfs/dbraw/zinc/77/59/94/623775994.db2.gz APZRATVCYRKAPI-GFCCVEGCSA-N -1 3 268.332 2.765 20 10 CFCDHM Cc1cc([O-])c(CN[C@@H]2C[C@@H](C)n3ncnc32)cc1Cl ZINC000826887810 623903044 /nfs/dbraw/zinc/90/30/44/623903044.db2.gz AJQUEOVCZJGKQN-BXKDBHETSA-N -1 3 292.770 2.741 20 10 CFCDHM CS[C@@H]1CC[C@@H](NC(=O)NCc2c([O-])cccc2F)C1 ZINC000920686903 624750974 /nfs/dbraw/zinc/75/09/74/624750974.db2.gz ODEZYXZVKJAJIX-NXEZZACHSA-N -1 3 298.383 2.615 20 10 CFCDHM CC[C@H](N[C@H]1CCn2ccnc21)c1ccc(F)cc1[O-] ZINC000834831939 625890903 /nfs/dbraw/zinc/89/09/03/625890903.db2.gz LTTHTTJJTDVCKI-STQMWFEESA-N -1 3 275.327 2.914 20 10 CFCDHM COc1cccnc1CN[C@@H](C)c1cc(F)cc(F)c1[O-] ZINC000834906952 625919452 /nfs/dbraw/zinc/91/94/52/625919452.db2.gz UXPQZQJMQQMLDD-VIFPVBQESA-N -1 3 294.301 2.925 20 10 CFCDHM O=C(NCc1c([O-])cccc1F)N[C@@H]1CC[C@@H]2C[C@@H]2C1 ZINC000923040050 626445816 /nfs/dbraw/zinc/44/58/16/626445816.db2.gz IEHJWONEKSPUHP-GMTAPVOTSA-N -1 3 278.327 2.519 20 10 CFCDHM [O-]c1ccc(Br)cc1CN1CC(C(F)F)C1 ZINC000839140941 626528460 /nfs/dbraw/zinc/52/84/60/626528460.db2.gz KPDSSRCNSMVVFR-UHFFFAOYSA-N -1 3 292.123 2.852 20 10 CFCDHM [O-]c1ccc(Cl)c(F)c1CN1C[C@@H]2C[C@H]1CS2 ZINC000839191588 626530834 /nfs/dbraw/zinc/53/08/34/626530834.db2.gz ICTHCFOPJPSXMI-YUMQZZPRSA-N -1 3 273.760 2.874 20 10 CFCDHM CC(C)(O)c1cccc(NC(=O)c2cccc(O)c2[O-])c1 ZINC000768266114 627329568 /nfs/dbraw/zinc/32/95/68/627329568.db2.gz FNUYMBZNCHKNBX-UHFFFAOYSA-N -1 3 287.315 2.578 20 10 CFCDHM C[C@@H]1CN(Cc2cc(Cl)cc(F)c2[O-])CCCO1 ZINC000775679361 628054123 /nfs/dbraw/zinc/05/41/23/628054123.db2.gz YKHDPFQWGIJRRR-SECBINFHSA-N -1 3 273.735 2.796 20 10 CFCDHM CCN1CCN(Cc2cc(Cl)cc(F)c2[O-])C[C@H]1C ZINC000775686533 628055355 /nfs/dbraw/zinc/05/53/55/628055355.db2.gz JBOSFTDGSPRBTO-SNVBAGLBSA-N -1 3 286.778 2.711 20 10 CFCDHM O=C(NC[C@H]1CCCc2ccccc21)c1cccc(O)c1[O-] ZINC000776327385 628131620 /nfs/dbraw/zinc/13/16/20/628131620.db2.gz KHFJUOYPPMOKBY-CYBMUJFWSA-N -1 3 297.354 2.948 20 10 CFCDHM O=C(N[C@@H]1C[C@H]1C1CCCCC1)c1cccc(O)c1[O-] ZINC000776663086 628166906 /nfs/dbraw/zinc/16/69/06/628166906.db2.gz FKRCCBDHRDZXML-QWHCGFSZSA-N -1 3 275.348 2.796 20 10 CFCDHM O=C(N[C@H]1C[C@H]1C1CCCCC1)c1cccc(O)c1[O-] ZINC000776663087 628167103 /nfs/dbraw/zinc/16/71/03/628167103.db2.gz FKRCCBDHRDZXML-STQMWFEESA-N -1 3 275.348 2.796 20 10 CFCDHM CSc1ccc(NC(=O)c2ccc(C)c(O)c2[O-])cn1 ZINC000780923460 628505166 /nfs/dbraw/zinc/50/51/66/628505166.db2.gz SSRCLZPQHXCLRU-UHFFFAOYSA-N -1 3 290.344 2.775 20 10 CFCDHM COC(=O)[C@@H]1CCCCCN1Cc1cc(Cl)ccc1[O-] ZINC000781527413 628557446 /nfs/dbraw/zinc/55/74/46/628557446.db2.gz NGLRGQGBAFGSAS-ZDUSSCGKSA-N -1 3 297.782 2.963 20 10 CFCDHM CC(C)COC(=O)[C@H](C)NCc1c([O-])cccc1Cl ZINC000789581014 629168433 /nfs/dbraw/zinc/16/84/33/629168433.db2.gz UOTXXQKGHPROOR-JTQLQIEISA-N -1 3 285.771 2.723 20 10 CFCDHM O=C(c1cccc(O)c1[O-])N1CCc2cc(F)c(F)cc21 ZINC000790543049 629246944 /nfs/dbraw/zinc/24/69/44/629246944.db2.gz OXLASSOOZFKDHN-UHFFFAOYSA-N -1 3 291.253 2.579 20 10 CFCDHM Cc1cccc2c1CC[C@H]2NC(=O)c1cccc(O)c1[O-] ZINC000790658642 629255728 /nfs/dbraw/zinc/25/57/28/629255728.db2.gz XGFOURXXZMOTHV-CQSZACIVSA-N -1 3 283.327 2.824 20 10 CFCDHM Cc1ccc2c(c1)[C@H](NC(=O)c1cccc(O)c1[O-])CC2 ZINC000790664958 629256330 /nfs/dbraw/zinc/25/63/30/629256330.db2.gz XMGHVHOCLUWADO-CQSZACIVSA-N -1 3 283.327 2.824 20 10 CFCDHM O=C(N[C@@H]1CC[C@@H]2CCC[C@H]2C1)c1cccc(O)c1[O-] ZINC000790792535 629263103 /nfs/dbraw/zinc/26/31/03/629263103.db2.gz FTFDESLLCXEEHY-SDDRHHMPSA-N -1 3 275.348 2.796 20 10 CFCDHM Cc1c(CN(C)Cc2cccc(Cl)c2[O-])cnn1C ZINC000790938244 629272878 /nfs/dbraw/zinc/27/28/78/629272878.db2.gz QWGVUOGGRKVWTI-UHFFFAOYSA-N -1 3 279.771 2.720 20 10 CFCDHM CCN(CCOC)Cc1c([O-])ccc(Cl)c1F ZINC000792162982 629404149 /nfs/dbraw/zinc/40/41/49/629404149.db2.gz UJLXZDKKPPEWNI-UHFFFAOYSA-N -1 3 261.724 2.653 20 10 CFCDHM [O-]c1ccc(Cl)c(F)c1CN1CC[C@H](OC(F)F)C1 ZINC000802658928 630536357 /nfs/dbraw/zinc/53/63/57/630536357.db2.gz UKGOLBUWVXBYSG-ZETCQYMHSA-N -1 3 295.688 2.998 20 10 CFCDHM COc1nnc(NCc2c([O-])cccc2Cl)s1 ZINC000806668956 630828992 /nfs/dbraw/zinc/82/89/92/630828992.db2.gz GQSFKIBPUICUCL-UHFFFAOYSA-N -1 3 271.729 2.518 20 10 CFCDHM C[C@@H](N[C@@H](C)c1ccn(C)n1)c1cc(F)cc(F)c1[O-] ZINC000840815350 631229827 /nfs/dbraw/zinc/22/98/27/631229827.db2.gz DTNDWBPOARIGGA-BDAKNGLRSA-N -1 3 281.306 2.816 20 10 CFCDHM Cc1cc([O-])c(CN2CCO[C@@H](C3CC3)C2)c(Cl)c1 ZINC000840939601 631272849 /nfs/dbraw/zinc/27/28/49/631272849.db2.gz ZSFUJHZRSOQAKH-OAHLLOKOSA-N -1 3 281.783 2.965 20 10 CFCDHM O=C([O-])[C@@H]1CC[N@H+](Cc2cc(-c3ccccc3)ccc2[O-])C1 ZINC000840995479 631296639 /nfs/dbraw/zinc/29/66/39/631296639.db2.gz PLPDQHXQKJFWAT-OAHLLOKOSA-N -1 3 297.354 2.966 20 10 CFCDHM O=C([O-])[C@@H]1CC[N@@H+](Cc2cc(-c3ccccc3)ccc2[O-])C1 ZINC000840995479 631296643 /nfs/dbraw/zinc/29/66/43/631296643.db2.gz PLPDQHXQKJFWAT-OAHLLOKOSA-N -1 3 297.354 2.966 20 10 CFCDHM [O-]c1c(F)cc(Cl)cc1CN1CC[C@@H](n2cccn2)C1 ZINC000812780616 631773640 /nfs/dbraw/zinc/77/36/40/631773640.db2.gz KPESPKLYUVJNAN-GFCCVEGCSA-N -1 3 295.745 2.828 20 10 CFCDHM Cc1nnsc1CNCc1c([O-])ccc(Cl)c1F ZINC000813790075 631960312 /nfs/dbraw/zinc/96/03/12/631960312.db2.gz GILSTHQFBBWRQL-UHFFFAOYSA-N -1 3 287.747 2.634 20 10 CFCDHM O=C(c1cccc(O)c1[O-])N1CCC[C@@H](c2ccncc2)C1 ZINC000844143905 632126139 /nfs/dbraw/zinc/12/61/39/632126139.db2.gz YOISHGJKCBYPJI-CYBMUJFWSA-N -1 3 298.342 2.513 20 10 CFCDHM CN1CCN(Cc2cc(Cl)c(F)cc2[O-])C(C)(C)C1 ZINC000816513626 632475377 /nfs/dbraw/zinc/47/53/77/632475377.db2.gz WYQIOQIGCBDURM-UHFFFAOYSA-N -1 3 286.778 2.711 20 10 CFCDHM COc1ccc(O)c(CNCc2c(F)ccc([O-])c2F)c1 ZINC000816550335 632482194 /nfs/dbraw/zinc/48/21/94/632482194.db2.gz OMMGKDUTEFMNNE-UHFFFAOYSA-N -1 3 295.285 2.674 20 10 CFCDHM C[C@@H]1CC[C@@H](O)CN1Cc1cc(Cl)c(F)cc1[O-] ZINC000817413900 632625114 /nfs/dbraw/zinc/62/51/14/632625114.db2.gz DIFCIKVHAKIRIR-PSASIEDQSA-N -1 3 273.735 2.530 20 10 CFCDHM CCc1cc(NCc2c([O-])cccc2Cl)nn1C ZINC000817709461 632688948 /nfs/dbraw/zinc/68/89/48/632688948.db2.gz ZNLRNRLKVVWIJV-UHFFFAOYSA-N -1 3 265.744 2.954 20 10 CFCDHM CC[C@H](NCC(F)(F)CN)c1cc(Cl)ccc1[O-] ZINC000817968699 632767241 /nfs/dbraw/zinc/76/72/41/632767241.db2.gz WDRPEZDSNWPGTL-JTQLQIEISA-N -1 3 278.730 2.680 20 10 CFCDHM C[C@H](N[C@H]1C[C@@H](C)n2ncnc21)c1ccc(Cl)cc1[O-] ZINC000850499078 634018300 /nfs/dbraw/zinc/01/83/00/634018300.db2.gz JEUMNFSVCHGFTF-PTRXPTGYSA-N -1 3 292.770 2.994 20 10 CFCDHM O=C(c1cccc(O)c1[O-])N1CCC[C@@H](c2ccccn2)C1 ZINC000854643431 635355204 /nfs/dbraw/zinc/35/52/04/635355204.db2.gz XQIAGCLZOCSJGE-GFCCVEGCSA-N -1 3 298.342 2.513 20 10 CFCDHM Cc1ccc(C(=O)Nc2cc([C@@H]3C[C@@H]3C)[nH]n2)c([O-])c1O ZINC000855002076 635437951 /nfs/dbraw/zinc/43/79/51/635437951.db2.gz NSZBZGSWICRUBI-WCBMZHEXSA-N -1 3 287.319 2.505 20 10 CFCDHM CN(Cc1cn[nH]c1)Cc1c([O-])cccc1Br ZINC000862245513 637297770 /nfs/dbraw/zinc/29/77/70/637297770.db2.gz QYLQURHYEPJROB-UHFFFAOYSA-N -1 3 296.168 2.510 20 10 CFCDHM [O-]c1cccc(Br)c1CN(C1CC1)C1COC1 ZINC000862381930 637348047 /nfs/dbraw/zinc/34/80/47/637348047.db2.gz KHQWCJYVHPPRDW-UHFFFAOYSA-N -1 3 298.180 2.518 20 10 CFCDHM Cc1cc([O-])c(CN2CCO[C@@H](CCF)C2)c(Cl)c1 ZINC000862529112 637407863 /nfs/dbraw/zinc/40/78/63/637407863.db2.gz BBHHZFNXZUNWHQ-NSHDSACASA-N -1 3 287.762 2.914 20 10 CFCDHM [O-]c1cccc(Cl)c1CNc1ncc2c(n1)CCOC2 ZINC000865294662 638261902 /nfs/dbraw/zinc/26/19/02/638261902.db2.gz RKDZSXAKSPFEAK-UHFFFAOYSA-N -1 3 291.738 2.520 20 10 CFCDHM CC[C@H](Cc1ccccc1)NC(=O)c1cccc(O)c1[O-] ZINC000193015092 650616232 /nfs/dbraw/zinc/61/62/32/650616232.db2.gz AVOAPSQJJUSNEJ-CYBMUJFWSA-N -1 3 285.343 2.849 20 10 CFCDHM C[C@@H](NC(=O)c1cccc(O)c1[O-])c1cccc(F)c1F ZINC000193150950 650628122 /nfs/dbraw/zinc/62/81/22/650628122.db2.gz CNFSFXQMSDIJEV-MRVPVSSYSA-N -1 3 293.269 2.867 20 10 CFCDHM CCCNC(=O)CN(CCC)Cc1c([O-])cccc1Cl ZINC000124786342 642322430 /nfs/dbraw/zinc/32/24/30/642322430.db2.gz LGROPWXYSUGQHU-UHFFFAOYSA-N -1 3 298.814 2.784 20 10 CFCDHM Cc1cc(C)cc(NC(=O)c2cccc(O)c2[O-])c1 ZINC000126226135 643055729 /nfs/dbraw/zinc/05/57/29/643055729.db2.gz RZJMNWAQXOGCKS-UHFFFAOYSA-N -1 3 257.289 2.967 20 10 CFCDHM Cc1ccc(C)c(NC(=O)c2cccc(O)c2[O-])c1 ZINC000126234192 643057678 /nfs/dbraw/zinc/05/76/78/643057678.db2.gz NQWKZNHZVYFCDJ-UHFFFAOYSA-N -1 3 257.289 2.967 20 10 CFCDHM Cc1ccc([C@H](C)NC(=O)c2cccc(O)c2[O-])s1 ZINC000126304169 643111046 /nfs/dbraw/zinc/11/10/46/643111046.db2.gz SRYRLQQYANGZKG-VIFPVBQESA-N -1 3 277.345 2.959 20 10 CFCDHM [O-]c1c(CN2CCCSCC2)ccc(F)c1F ZINC000877170656 643188218 /nfs/dbraw/zinc/18/82/18/643188218.db2.gz RLUFVVBXIKVIOH-UHFFFAOYSA-N -1 3 259.321 2.609 20 10 CFCDHM C[C@@H]1CC(NC(=O)c2cccc(O)c2[O-])C[C@@H](C)C1 ZINC000126448301 643227785 /nfs/dbraw/zinc/22/77/85/643227785.db2.gz KEROQGFGWUWBOA-UWVGGRQHSA-N -1 3 263.337 2.652 20 10 CFCDHM CC(C)OC(=O)[C@H](C)N(C)Cc1cc(Cl)ccc1[O-] ZINC000093773075 650946307 /nfs/dbraw/zinc/94/63/07/650946307.db2.gz BJXJKTBVCDRYDW-JTQLQIEISA-N -1 3 285.771 2.818 20 10 CFCDHM COC[C@@H](NCc1cc(F)cc(F)c1[O-])c1ccco1 ZINC000883026898 645568687 /nfs/dbraw/zinc/56/86/87/645568687.db2.gz INCATNPYOZKQGJ-GFCCVEGCSA-N -1 3 283.274 2.741 20 10 CFCDHM CCc1cc(CN[C@H](C)c2c([O-])cccc2F)on1 ZINC000886529936 647030789 /nfs/dbraw/zinc/03/07/89/647030789.db2.gz AJAXSZUMXDZBCS-SECBINFHSA-N -1 3 264.300 2.933 20 10 CFCDHM C[C@@H](N[C@H](CO)c1ccccc1)c1c([O-])cccc1F ZINC000886528503 647031220 /nfs/dbraw/zinc/03/12/20/647031220.db2.gz NEIKTOPTLJCQJA-BXUZGUMPSA-N -1 3 275.323 2.916 20 10 CFCDHM Cc1nnsc1CN[C@H](C)c1c([O-])cccc1F ZINC000886613730 647067987 /nfs/dbraw/zinc/06/79/87/647067987.db2.gz CXFWHJLZRONGCQ-MRVPVSSYSA-N -1 3 267.329 2.542 20 10 CFCDHM O=C([O-])[C@@H]1C[C@@H]2CCCC[C@H]2[N@@H+]1Cc1cc(F)ccc1[O-] ZINC000300436227 647332678 /nfs/dbraw/zinc/33/26/78/647332678.db2.gz GUUBIUJUQUZCSB-GDLCADMTSA-N -1 3 293.338 2.749 20 10 CFCDHM O=C([O-])[C@@H]1C[C@@H]2CCCC[C@H]2[N@H+]1Cc1cc(F)ccc1[O-] ZINC000300436227 647332684 /nfs/dbraw/zinc/33/26/84/647332684.db2.gz GUUBIUJUQUZCSB-GDLCADMTSA-N -1 3 293.338 2.749 20 10 CFCDHM CC(C)(C)C(=O)CCCC(=O)NCc1c([O-])cccc1F ZINC000928705080 648944311 /nfs/dbraw/zinc/94/43/11/648944311.db2.gz DFWSMKTVCSARNS-UHFFFAOYSA-N -1 3 295.354 2.933 20 10 CFCDHM C[C@@H]1CCC[C@]1(C)C(=O)NCc1c([O-])cccc1F ZINC000928706002 648944523 /nfs/dbraw/zinc/94/45/23/648944523.db2.gz NKQJOOXLGMGUSK-BMIGLBTASA-N -1 3 265.328 2.974 20 10 CFCDHM C[C@@H]1CC/C(=C/C(=O)NCc2c([O-])cccc2F)C1 ZINC000928705500 648944569 /nfs/dbraw/zinc/94/45/69/648944569.db2.gz KPVDPLXTZWQIKK-UBYNWHESSA-N -1 3 263.312 2.894 20 10 CFCDHM O=C(NCc1c([O-])cccc1F)[C@H]1CCCCCC(=O)C1 ZINC000928706362 648944594 /nfs/dbraw/zinc/94/45/94/648944594.db2.gz RCDAUBWVCYVNCO-NSHDSACASA-N -1 3 293.338 2.687 20 10 CFCDHM CCO[C@H](CC(=O)NCc1c([O-])cccc1F)C(C)C ZINC000928706265 648944599 /nfs/dbraw/zinc/94/45/99/648944599.db2.gz TZICJHUQEIBJGZ-CQSZACIVSA-N -1 3 283.343 2.599 20 10 CFCDHM CC(C)CCCC(=O)NCc1c([O-])cccc1F ZINC000928705632 648944700 /nfs/dbraw/zinc/94/47/00/648944700.db2.gz KKQFJWVXVCHIQJ-UHFFFAOYSA-N -1 3 253.317 2.974 20 10 CFCDHM C[C@H]1CC[C@H](C(=O)NCc2c([O-])cccc2F)CC1 ZINC000928706649 648945539 /nfs/dbraw/zinc/94/55/39/648945539.db2.gz TYNHIFJBAUYNCJ-XYPYZODXSA-N -1 3 265.328 2.974 20 10 CFCDHM C[C@H]1CCCC[C@H]1C(=O)NCc1c([O-])cccc1F ZINC000928706629 648945585 /nfs/dbraw/zinc/94/55/85/648945585.db2.gz SNUIQAMVXZAUKZ-WDEREUQCSA-N -1 3 265.328 2.974 20 10 CFCDHM O=C(NCc1c([O-])cccc1F)c1ccoc1C1CC1 ZINC000928707608 648945590 /nfs/dbraw/zinc/94/55/90/648945590.db2.gz FZFYRTGMVCEGRJ-UHFFFAOYSA-N -1 3 275.279 2.932 20 10 CFCDHM O=C(CC1CCCC1)NCc1c([O-])cccc1F ZINC000928709931 648945946 /nfs/dbraw/zinc/94/59/46/648945946.db2.gz OARVQYFVBBCRGG-UHFFFAOYSA-N -1 3 251.301 2.728 20 10 CFCDHM CCC[C@H](CC)C(=O)NCc1c([O-])cccc1F ZINC000928709876 648946053 /nfs/dbraw/zinc/94/60/53/648946053.db2.gz MVUXOGYZMDDMOU-JTQLQIEISA-N -1 3 253.317 2.974 20 10 CFCDHM O=C([O-])c1ccc(C[N@@H+]2CCCC(F)(F)CC2)c([O-])c1 ZINC001231447791 777221723 /nfs/dbraw/zinc/22/17/23/777221723.db2.gz WPYGIMQAORMSFS-UHFFFAOYSA-N -1 3 285.290 2.712 20 10 CFCDHM O=C([O-])c1ccc(C[N@H+]2CCCC(F)(F)CC2)c([O-])c1 ZINC001231447791 777221730 /nfs/dbraw/zinc/22/17/30/777221730.db2.gz WPYGIMQAORMSFS-UHFFFAOYSA-N -1 3 285.290 2.712 20 10 CFCDHM C[C@@]1(F)CCCC[N@H+](Cc2ccc(C(=O)[O-])cc2[O-])C1 ZINC001231445676 777222152 /nfs/dbraw/zinc/22/21/52/777222152.db2.gz AGGVUOUILLRGDA-OAHLLOKOSA-N -1 3 281.327 2.805 20 10 CFCDHM C[C@@]1(F)CCCC[N@@H+](Cc2ccc(C(=O)[O-])cc2[O-])C1 ZINC001231445676 777222159 /nfs/dbraw/zinc/22/21/59/777222159.db2.gz AGGVUOUILLRGDA-OAHLLOKOSA-N -1 3 281.327 2.805 20 10 CFCDHM C[C@@H]1CCC[N@H+](Cc2cc(C(=O)[O-])ccc2[O-])[C@@H]1C ZINC001231563323 777261126 /nfs/dbraw/zinc/26/11/26/777261126.db2.gz HRHRKYDUYUAVKC-GHMZBOCLSA-N -1 3 263.337 2.711 20 10 CFCDHM C[C@@H]1CCC[N@@H+](Cc2cc(C(=O)[O-])ccc2[O-])[C@@H]1C ZINC001231563323 777261131 /nfs/dbraw/zinc/26/11/31/777261131.db2.gz HRHRKYDUYUAVKC-GHMZBOCLSA-N -1 3 263.337 2.711 20 10 CFCDHM CC(=O)[C@@H]1CCCN1Cc1cc(Cl)c(C)cc1[O-] ZINC001231871670 777361760 /nfs/dbraw/zinc/36/17/60/777361760.db2.gz PIFPGMXEWNLNBY-ZDUSSCGKSA-N -1 3 267.756 2.907 20 10 CFCDHM [O-]c1cc(O)c(CN2CCn3cccc3C2)cc1Cl ZINC001232261852 777496572 /nfs/dbraw/zinc/49/65/72/777496572.db2.gz QXYAUWQYVRJWQA-UHFFFAOYSA-N -1 3 278.739 2.569 20 10 CFCDHM [O-]c1cc(O)c(CN2CCc3cccnc3C2)cc1Cl ZINC001232262248 777496814 /nfs/dbraw/zinc/49/68/14/777496814.db2.gz DALOXBJUPDOVHM-UHFFFAOYSA-N -1 3 290.750 2.705 20 10 CFCDHM COc1cc([O-])c(CN2CCO[C@@H](C(C)C)C2)cc1Cl ZINC001232268658 777500799 /nfs/dbraw/zinc/50/07/99/777500799.db2.gz PYVQYRGYRTVUSZ-OAHLLOKOSA-N -1 3 299.798 2.911 20 10 CFCDHM [O-]c1ccc(F)c(CN2CCc3cccc(O)c3C2)c1F ZINC001233396699 777934022 /nfs/dbraw/zinc/93/40/22/777934022.db2.gz QPIQDOHANANPTC-UHFFFAOYSA-N -1 3 291.297 2.934 20 10 CFCDHM [O-]c1cc(C(F)(F)F)ccc1CN1CC(F)(F)C1 ZINC001233451558 777957097 /nfs/dbraw/zinc/95/70/97/777957097.db2.gz PIELUTDIEAPGHH-UHFFFAOYSA-N -1 3 267.197 2.862 20 10 CFCDHM [O-]c1cc(C(F)(F)F)ccc1CN(C1CC1)C1COC1 ZINC001233454623 777960701 /nfs/dbraw/zinc/96/07/01/777960701.db2.gz CJQJUEDIBBQPAY-UHFFFAOYSA-N -1 3 287.281 2.774 20 10 CFCDHM COc1ccc2ccc([O-])c(CN3CCCC(=O)C3)c2c1 ZINC001234552850 778251066 /nfs/dbraw/zinc/25/10/66/778251066.db2.gz LDYUHYBMUZIHDR-UHFFFAOYSA-N -1 3 285.343 2.719 20 10 CFCDHM [O-]c1cc(Cl)c(Cl)cc1CN1CCC[C@H]1CO ZINC001236789119 778937314 /nfs/dbraw/zinc/93/73/14/778937314.db2.gz CNUDJSACDDZCJC-VIFPVBQESA-N -1 3 276.163 2.656 20 10 CFCDHM COc1cc([O-])c(CN2CCC[C@H](F)C2)c(Cl)c1 ZINC001236799755 778942793 /nfs/dbraw/zinc/94/27/93/778942793.db2.gz PYDIQVNNOXHXBL-VIFPVBQESA-N -1 3 273.735 2.988 20 10 CFCDHM CCCOC1CN(Cc2c([O-])cc(OC)cc2Cl)C1 ZINC001236799270 778942941 /nfs/dbraw/zinc/94/29/41/778942941.db2.gz LMSMDXIKHRLXFI-UHFFFAOYSA-N -1 3 285.771 2.665 20 10 CFCDHM CN(Cc1c([O-])ccc(Cl)c1Cl)[C@H]1CCOC1 ZINC001237083058 779006962 /nfs/dbraw/zinc/00/69/62/779006962.db2.gz XOBJHVFRQFXOEE-QMMMGPOBSA-N -1 3 276.163 2.920 20 10 CFCDHM C[C@@]1(CO)CCN(Cc2c([O-])ccc(Cl)c2Cl)C1 ZINC001237078197 779007305 /nfs/dbraw/zinc/00/73/05/779007305.db2.gz PFSOJRDNEOHQJF-CYBMUJFWSA-N -1 3 290.190 2.903 20 10 CFCDHM [O-]c1ccc(F)c(Cl)c1CN1CCC[C@]2(CCO2)C1 ZINC001237125844 779019763 /nfs/dbraw/zinc/01/97/63/779019763.db2.gz GNRODHSFCCEJDZ-AWEZNQCLSA-N -1 3 285.746 2.940 20 10 CFCDHM [O-]c1cc(F)cc(F)c1CN1CCNC2=CCCC[C@@H]21 ZINC001237226061 779055924 /nfs/dbraw/zinc/05/59/24/779055924.db2.gz ULLKUHFDJQHSRS-AWEZNQCLSA-N -1 3 280.318 2.512 20 10 CFCDHM [O-]c1c(F)cc(Cl)cc1CN1CCC[C@]12CCOC2 ZINC001237622124 779145432 /nfs/dbraw/zinc/14/54/32/779145432.db2.gz NCYVSIQFQYQWCU-CQSZACIVSA-N -1 3 285.746 2.940 20 10 CFCDHM C[C@@H]1C[C@@H](O)CCN1Cc1cc(F)cc(Cl)c1[O-] ZINC001237799628 779182093 /nfs/dbraw/zinc/18/20/93/779182093.db2.gz SHSUEWOEUWLCEA-KCJUWKMLSA-N -1 3 273.735 2.530 20 10 CFCDHM O=C1CCC[C@H]2CN(Cc3cc(F)cc(Cl)c3[O-])C[C@H]12 ZINC001237800327 779182439 /nfs/dbraw/zinc/18/24/39/779182439.db2.gz JMQRQTGLBCPSST-CABZTGNLSA-N -1 3 297.757 2.986 20 10 CFCDHM [O-]c1c(Cl)cc(F)cc1CN1CCC[C@@H](O)CC1 ZINC001237807490 779184556 /nfs/dbraw/zinc/18/45/56/779184556.db2.gz KHFFLOXZXKGBGP-LLVKDONJSA-N -1 3 273.735 2.532 20 10 CFCDHM C[C@@H]1CCN(Cc2cc(F)cc(Cl)c2[O-])C[C@]1(C)O ZINC001237809065 779185776 /nfs/dbraw/zinc/18/57/76/779185776.db2.gz YYDHGDHRQPVUMR-OTYXRUKQSA-N -1 3 287.762 2.778 20 10 CFCDHM [O-]c1cc(Cl)c(F)cc1CN1CCCC2(COC2)C1 ZINC001237933395 779209064 /nfs/dbraw/zinc/20/90/64/779209064.db2.gz BBGGYZOKUPUPPV-UHFFFAOYSA-N -1 3 285.746 2.797 20 10 CFCDHM COc1ccc(CN2CC([C@H](C)OC)C2)c([O-])c1Cl ZINC001236809745 779641806 /nfs/dbraw/zinc/64/18/06/779641806.db2.gz NZPRQGNIXPFBEU-VIFPVBQESA-N -1 3 285.771 2.521 20 10 CFCDHM C[C@@]1(O)CCCN(Cc2cc(F)cc(Cl)c2[O-])C1 ZINC001237798216 779717916 /nfs/dbraw/zinc/71/79/16/779717916.db2.gz AUUSVJCHISJRBK-CYBMUJFWSA-N -1 3 273.735 2.532 20 10 CFCDHM CCc1nc(CNCc2cc(F)cc(F)c2[O-])cs1 ZINC000708548218 781293015 /nfs/dbraw/zinc/29/30/15/781293015.db2.gz CQLOLQLSAOOKHS-UHFFFAOYSA-N -1 3 284.331 2.979 20 10 CFCDHM COc1ccc(CN2Cc3cccc([O-])c3C2)cc1 ZINC000146915280 347946521 /nfs/dbraw/zinc/94/65/21/347946521.db2.gz KZBZYYYAPWQMTR-UHFFFAOYSA-N -1 3 255.317 2.917 20 10 CFCDHM [O-]c1cc(F)c(Cl)cc1CN[C@H](CCO)c1ccco1 ZINC000294532088 199075751 /nfs/dbraw/zinc/07/57/51/199075751.db2.gz DEWWFOUZSRPPOW-GFCCVEGCSA-N -1 3 299.729 2.991 20 10 CFCDHM CC(=O)c1cc(Cl)cc(CN(C)C[C@@H]2CCCO2)c1[O-] ZINC000048948786 373235243 /nfs/dbraw/zinc/23/52/43/373235243.db2.gz VOBZRFIKRIGDLT-ZDUSSCGKSA-N -1 3 297.782 2.859 20 10 CFCDHM CCCOc1ccc(CN2CCOC[C@H]2C2CC2)c([O-])c1 ZINC000093645697 375283487 /nfs/dbraw/zinc/28/34/87/375283487.db2.gz YODAYBANQSEGKE-INIZCTEOSA-N -1 3 291.391 2.792 20 10 CFCDHM O=C(c1cccc(O)c1[O-])N1CC2(CCC2)[C@H]1C1CC1 ZINC000291033517 296253846 /nfs/dbraw/zinc/25/38/46/296253846.db2.gz FMIVXQWKNLUYAB-CQSZACIVSA-N -1 3 273.332 2.503 20 10 CFCDHM C[C@H]1CCC[C@@H](N(C)C(=O)c2cccc(O)c2[O-])C1 ZINC000126291231 377222313 /nfs/dbraw/zinc/22/23/13/377222313.db2.gz GSJSIEAUALFBBL-WDEREUQCSA-N -1 3 263.337 2.749 20 10 CFCDHM O=C(c1cccc(O)c1[O-])N1CCC[C@@H]1C1CCCC1 ZINC000126362242 377223546 /nfs/dbraw/zinc/22/35/46/377223546.db2.gz GYZQNBAAALHFPX-CYBMUJFWSA-N -1 3 275.348 2.893 20 10 CFCDHM COCCOC1CCN(Cc2cccc(Cl)c2[O-])CC1 ZINC000180201338 380631655 /nfs/dbraw/zinc/63/16/55/380631655.db2.gz JBYFSNACIMOLPA-UHFFFAOYSA-N -1 3 299.798 2.673 20 10 CFCDHM [O-]c1ccc(F)cc1CN1CCCC[C@H]1c1ncc[nH]1 ZINC000180020387 380611203 /nfs/dbraw/zinc/61/12/03/380611203.db2.gz AWIKFWLJRKZIBU-ZDUSSCGKSA-N -1 3 275.327 2.982 20 10 CFCDHM [O-]c1ccccc1CNCc1noc2c1CCCC2 ZINC000288326930 381009875 /nfs/dbraw/zinc/00/98/75/381009875.db2.gz AKHIHNWLRISHAK-UHFFFAOYSA-N -1 3 258.321 2.549 20 10 CFCDHM CC[C@@H](NC(=O)c1ccc(C)c(O)c1[O-])c1ccncc1 ZINC000182497309 381101837 /nfs/dbraw/zinc/10/18/37/381101837.db2.gz RIJCEPIBIGEXPJ-CYBMUJFWSA-N -1 3 286.331 2.682 20 10 CFCDHM Cc1ccc(C(=O)N(C)[C@H](C)C2(C)CC2)c([O-])c1O ZINC000182579909 381115503 /nfs/dbraw/zinc/11/55/03/381115503.db2.gz ZJTJSMYDBOFCRM-SNVBAGLBSA-N -1 3 263.337 2.667 20 10 CFCDHM CCn1ccnc1CN[C@@H](C)c1ccc(C)cc1[O-] ZINC000296302209 381339390 /nfs/dbraw/zinc/33/93/90/381339390.db2.gz FYHHOLDNGVFPCF-LBPRGKRZSA-N -1 3 259.353 2.768 20 10 CFCDHM CCS[C@H]1CCCCN(C(=O)c2cccc(O)c2[O-])C1 ZINC000187088177 382095135 /nfs/dbraw/zinc/09/51/35/382095135.db2.gz FJTSXGYVRXVYMR-NSHDSACASA-N -1 3 295.404 2.846 20 10 CFCDHM CC1(C)CN(C(=O)c2cccc(O)c2[O-])[C@H]1c1ccncc1 ZINC000293849092 382304373 /nfs/dbraw/zinc/30/43/73/382304373.db2.gz JAQFEQNLOFVAHH-HNNXBMFYSA-N -1 3 298.342 2.716 20 10 CFCDHM [O-]c1ccc(F)cc1CN[C@@H](c1nc[nH]n1)c1ccccc1 ZINC000364320864 382305781 /nfs/dbraw/zinc/30/57/81/382305781.db2.gz AAPXLYLFTODVFH-OAHLLOKOSA-N -1 3 298.321 2.529 20 10 CFCDHM Cc1ccc(C(=O)Nc2cccc(C3CC3)n2)c([O-])c1O ZINC000293903048 382329449 /nfs/dbraw/zinc/32/94/49/382329449.db2.gz LPNAXYQWHPLDPO-UHFFFAOYSA-N -1 3 284.315 2.931 20 10 CFCDHM C[C@H]1C[C@@H](CO)CCN1Cc1cc(Cl)c(F)cc1[O-] ZINC000294001426 382373388 /nfs/dbraw/zinc/37/33/88/382373388.db2.gz SUJSWZZXJYVVKQ-UWVGGRQHSA-N -1 3 287.762 2.778 20 10 CFCDHM CSC[C@@H]1CCCN(C(=O)c2ccc(C)c(O)c2[O-])C1 ZINC000294581417 382517130 /nfs/dbraw/zinc/51/71/30/382517130.db2.gz HROMWHYPMYUPGZ-LLVKDONJSA-N -1 3 295.404 2.621 20 10 CFCDHM CCN(C)C(=O)[C@@H](C)N[C@H](C)c1cc(Cl)ccc1[O-] ZINC000189400334 382603887 /nfs/dbraw/zinc/60/38/87/382603887.db2.gz MWUDXASPOUOTTF-NXEZZACHSA-N -1 3 284.787 2.563 20 10 CFCDHM O=C(N[C@@H]1[C@@H]2CCc3ccccc3[C@@H]21)c1cccc(O)c1[O-] ZINC000189523670 382620120 /nfs/dbraw/zinc/62/01/20/382620120.db2.gz IQTVUHJBBWEHST-UHOFOFEASA-N -1 3 295.338 2.556 20 10 CFCDHM Cc1cc(Cl)cc(CN2CCC[C@@]23CCOC3=O)c1[O-] ZINC000190035430 382651084 /nfs/dbraw/zinc/65/10/84/382651084.db2.gz OEECASAYWAHRLS-HNNXBMFYSA-N -1 3 295.766 2.636 20 10 CFCDHM C[C@@H](NCc1ncnn1C(C)(C)C)c1ccc(F)cc1[O-] ZINC000282775413 385386948 /nfs/dbraw/zinc/38/69/48/385386948.db2.gz PFXLBILUGKRVPW-SNVBAGLBSA-N -1 3 292.358 2.729 20 10 CFCDHM CN1CCN(Cc2cccc(Cl)c2[O-])C(C)(C)C1 ZINC000271839915 385393585 /nfs/dbraw/zinc/39/35/85/385393585.db2.gz QBNKAXOECIXKKW-UHFFFAOYSA-N -1 3 268.788 2.572 20 10 CFCDHM CCC1(O)CCN(Cc2cccc(Cl)c2[O-])CC1 ZINC000271869878 385395270 /nfs/dbraw/zinc/39/52/70/385395270.db2.gz RWCQEAHVYCVSLF-UHFFFAOYSA-N -1 3 269.772 2.783 20 10 CFCDHM [O-]c1cccc(Cl)c1CNc1nc(C2CC2)no1 ZINC000272028635 385430175 /nfs/dbraw/zinc/43/01/75/385430175.db2.gz DIPHMEYZBRJDQH-UHFFFAOYSA-N -1 3 265.700 2.918 20 10 CFCDHM COCCCOCCN(C)Cc1c([O-])cccc1Cl ZINC000272397505 385527941 /nfs/dbraw/zinc/52/79/41/385527941.db2.gz WDTZYOVCXVRSNC-UHFFFAOYSA-N -1 3 287.787 2.531 20 10 CFCDHM Cc1ccc(C(=O)N(C)[C@H](C)C(C)C)c([O-])c1O ZINC000272652354 385582899 /nfs/dbraw/zinc/58/28/99/385582899.db2.gz KQIOUIFHVIHTRW-SNVBAGLBSA-N -1 3 251.326 2.523 20 10 CFCDHM CCc1nnc([C@@H](C)N[C@@H](C)c2ccc(F)cc2[O-])[nH]1 ZINC000273480073 385684559 /nfs/dbraw/zinc/68/45/59/385684559.db2.gz LVPDKEUWFZYHEH-DTWKUNHWSA-N -1 3 278.331 2.624 20 10 CFCDHM Cc1ccc(C(=O)N2CC[C@H](C)C(C)(C)C2)c([O-])c1O ZINC000274287240 385756897 /nfs/dbraw/zinc/75/68/97/385756897.db2.gz ZZANWUNYUOPJTM-NSHDSACASA-N -1 3 277.364 2.914 20 10 CFCDHM C[C@@H](C(=O)NCc1ccccc1)N(C)Cc1ccccc1[O-] ZINC000109773309 393879285 /nfs/dbraw/zinc/87/92/85/393879285.db2.gz LTMWJUZPTMEENV-AWEZNQCLSA-N -1 3 298.386 2.529 20 10 CFCDHM C[C@@H]1CN(Cc2cccc(F)c2[O-])C[C@H](C2CC2)O1 ZINC000280603024 394073229 /nfs/dbraw/zinc/07/32/29/394073229.db2.gz OEEKQAUJONEOHK-QMTHXVAHSA-N -1 3 265.328 2.531 20 10 CFCDHM [O-]c1ccc(Cl)c(F)c1CN1CCC[C@]12CCOC2 ZINC000367047809 394250422 /nfs/dbraw/zinc/25/04/22/394250422.db2.gz NDOIDCZQOQIMRT-CQSZACIVSA-N -1 3 285.746 2.940 20 10 CFCDHM COC1CCN(Cc2cc(Cl)cc(C(C)=O)c2[O-])CC1 ZINC000037323381 260088992 /nfs/dbraw/zinc/08/89/92/260088992.db2.gz PUDMNWUYHOGFSO-UHFFFAOYSA-N -1 3 297.782 2.859 20 10 CFCDHM O=C(NCc1ccc2cccnc2c1[O-])[C@@H]1CC=CCC1 ZINC000521396316 260072231 /nfs/dbraw/zinc/07/22/31/260072231.db2.gz LVVYZHYDAULNBR-CYBMUJFWSA-N -1 3 282.343 2.913 20 10 CFCDHM Cc1ccc(C(=O)N2CCC3(CCC3)CC2)c([O-])c1O ZINC000376437101 267976878 /nfs/dbraw/zinc/97/68/78/267976878.db2.gz SUUJWKVOFZXQRR-UHFFFAOYSA-N -1 3 275.348 2.813 20 10 CFCDHM C[C@H](N[C@@H](CCO)c1ccco1)c1cc(F)ccc1[O-] ZINC000186534848 278268881 /nfs/dbraw/zinc/26/88/81/278268881.db2.gz QXIRLINVESHVGI-GWCFXTLKSA-N -1 3 279.311 2.899 20 10 CFCDHM O=C(/C=C\c1cncc(F)c1)N1CCCc2cccc([O-])c21 ZINC000255898835 327026510 /nfs/dbraw/zinc/02/65/10/327026510.db2.gz PLASMZNYPFABNQ-SREVYHEPSA-N -1 3 298.317 2.919 20 10 CFCDHM C[C@@H]1CCN(C(=O)C=Cc2c[nH]cn2)c2c([O-])cccc21 ZINC000492814160 332414488 /nfs/dbraw/zinc/41/44/88/332414488.db2.gz STLWQUCOWFMYRS-ISALQUGTSA-N -1 3 283.331 2.669 20 10 CFCDHM CC(=O)c1cc(Cl)cc(CN2CCCC[C@H]2CO)c1[O-] ZINC000050152223 518279751 /nfs/dbraw/zinc/27/97/51/518279751.db2.gz SAEHNOHGQBCPNJ-ZDUSSCGKSA-N -1 3 297.782 2.595 20 10 CFCDHM CC1(C)CN(Cc2c([O-])cccc2Cl)CC[C@H]1O ZINC000275969358 520471568 /nfs/dbraw/zinc/47/15/68/520471568.db2.gz LLFLECMMEHAZTQ-CYBMUJFWSA-N -1 3 269.772 2.638 20 10 CFCDHM CCN(Cc1cnn(C)c1)Cc1cc(Cl)c(F)cc1[O-] ZINC000295064963 521440756 /nfs/dbraw/zinc/44/07/56/521440756.db2.gz AJIXPTVVRWJEBZ-UHFFFAOYSA-N -1 3 297.761 2.940 20 10 CFCDHM CCC1(CC)CN(C(=O)c2cccc(O)c2[O-])CCS1 ZINC000280560042 521689919 /nfs/dbraw/zinc/68/99/19/521689919.db2.gz UTYRCPKDQRPMFL-UHFFFAOYSA-N -1 3 295.404 2.846 20 10 CFCDHM CCS[C@@H]1CCC[C@@H]1NC(=O)c1cccc(O)c1[O-] ZINC000187165921 521725599 /nfs/dbraw/zinc/72/55/99/521725599.db2.gz ZRNJXPBYMDBBSR-CMPLNLGQSA-N -1 3 281.377 2.502 20 10 CFCDHM CO[C@]1(C)CCCN(Cc2cc(F)cc(C(C)=O)c2[O-])C1 ZINC000230275411 521750639 /nfs/dbraw/zinc/75/06/39/521750639.db2.gz ZUYHRBXOZLCSHF-MRXNPFEDSA-N -1 3 295.354 2.735 20 10 CFCDHM CCc1cnc(CNCc2cc(F)ccc2[O-])s1 ZINC000226612953 522036466 /nfs/dbraw/zinc/03/64/66/522036466.db2.gz QADCOKQCTPFKSK-UHFFFAOYSA-N -1 3 266.341 2.840 20 10 CFCDHM COC(=O)c1ccc([O-])c([C@H](C)NCc2occc2C)c1 ZINC000293306495 522135539 /nfs/dbraw/zinc/13/55/39/522135539.db2.gz DWSTZAKCKZBGNJ-NSHDSACASA-N -1 3 289.331 2.931 20 10 CFCDHM CC[C@H](NC(=O)c1ccc(C)c(O)c1[O-])c1ccncc1 ZINC000182497288 522530965 /nfs/dbraw/zinc/53/09/65/522530965.db2.gz RIJCEPIBIGEXPJ-ZDUSSCGKSA-N -1 3 286.331 2.682 20 10 CFCDHM COC1(C)CCN(Cc2cc(F)cc(C(C)=O)c2[O-])CC1 ZINC000271695540 522570713 /nfs/dbraw/zinc/57/07/13/522570713.db2.gz GCIHJSGFSMSBBU-UHFFFAOYSA-N -1 3 295.354 2.735 20 10 CFCDHM CCc1nnc(CNCc2c([O-])cccc2Cl)s1 ZINC000289678961 522740406 /nfs/dbraw/zinc/74/04/06/522740406.db2.gz CGPSNZVJCQDZAR-UHFFFAOYSA-N -1 3 283.784 2.749 20 10 CFCDHM COC[C@H]1CCN(Cc2cc(Cl)cc(C(C)=O)c2[O-])C1 ZINC000081071736 522844675 /nfs/dbraw/zinc/84/46/75/522844675.db2.gz CDYFKPKXFFKDAA-NSHDSACASA-N -1 3 297.782 2.717 20 10 CFCDHM COCCN(Cc1ccccn1)Cc1cc(F)ccc1[O-] ZINC000289864873 523757802 /nfs/dbraw/zinc/75/78/02/523757802.db2.gz QXXWEICKTYDLJQ-UHFFFAOYSA-N -1 3 290.338 2.575 20 10 CFCDHM Cc1cc(CN[C@H](C)c2ccc(F)c(F)c2[O-])n(C)n1 ZINC000284057208 524777338 /nfs/dbraw/zinc/77/73/38/524777338.db2.gz AFTNOAWSBFRPOY-SECBINFHSA-N -1 3 281.306 2.563 20 10 CFCDHM C[C@H](NCCF)c1cc(Br)ccc1[O-] ZINC000280929889 525347013 /nfs/dbraw/zinc/34/70/13/525347013.db2.gz FILUCBPNJDYVRN-ZETCQYMHSA-N -1 3 262.122 2.775 20 10 CFCDHM C[C@@H](NCc1nccs1)c1ccc(F)cc1[O-] ZINC000062748087 525563934 /nfs/dbraw/zinc/56/39/34/525563934.db2.gz HKEUEROQRIYSMH-MRVPVSSYSA-N -1 3 252.314 2.839 20 10 CFCDHM C[C@@H](N[C@@H](C)c1cc(Cl)ccc1[O-])c1ncn(C)n1 ZINC000275810442 525604834 /nfs/dbraw/zinc/60/48/34/525604834.db2.gz ZLOJHAMKOCXWOS-DTWKUNHWSA-N -1 3 280.759 2.586 20 10 CFCDHM Cc1c([C@H](C)N[C@H](C)c2ccc(F)cc2[O-])cnn1C ZINC000062747621 525924561 /nfs/dbraw/zinc/92/45/61/525924561.db2.gz IJOYCFFOAMLDJD-ZJUUUORDSA-N -1 3 277.343 2.985 20 10 CFCDHM O=C(c1cccc(O)c1[O-])N1CCC[C@H]1C1CCC1 ZINC000193016578 526771832 /nfs/dbraw/zinc/77/18/32/526771832.db2.gz DPGAISUXKINJSP-LBPRGKRZSA-N -1 3 261.321 2.503 20 10 CFCDHM Cc1nc(CNCc2cc(F)ccc2[O-])c2n1CCCC2 ZINC000361906782 526889341 /nfs/dbraw/zinc/88/93/41/526889341.db2.gz IKCBDGURQSJMDT-UHFFFAOYSA-N -1 3 289.354 2.662 20 10 CFCDHM O=C(NCCc1c(F)cccc1F)c1cc([O-])cs1 ZINC000731870626 574131305 /nfs/dbraw/zinc/13/13/05/574131305.db2.gz LESUFHCJCXZEIJ-UHFFFAOYSA-N -1 3 283.299 2.704 20 10 CFCDHM CN(C)[C@H](CNC(=O)c1cc([O-])cs1)c1cccs1 ZINC000731865332 574131391 /nfs/dbraw/zinc/13/13/91/574131391.db2.gz BIFIFRHAJWFPNE-SNVBAGLBSA-N -1 3 296.417 2.548 20 10 CFCDHM CCOCc1ccc(CNC(=O)c2cc([O-])cs2)cc1 ZINC000731868700 574132643 /nfs/dbraw/zinc/13/26/43/574132643.db2.gz PYPQYMMVJFCTPI-UHFFFAOYSA-N -1 3 291.372 2.920 20 10 CFCDHM Cn1cccc1[C@@H]1CCCN1C(=O)c1cc([O-])cs1 ZINC000732267365 574147828 /nfs/dbraw/zinc/14/78/28/574147828.db2.gz ZGGXXHIZVCEMFE-LBPRGKRZSA-N -1 3 276.361 2.770 20 10 CFCDHM CCc1ccc(O)c(NC(=O)c2cc([O-])cs2)c1 ZINC000746410926 574148136 /nfs/dbraw/zinc/14/81/36/574148136.db2.gz ARIGPTKFYKPSMR-UHFFFAOYSA-N -1 3 263.318 2.974 20 10 CFCDHM O=C(N[C@H]1CCOc2ccc(F)cc21)c1cc([O-])cs1 ZINC000732291340 574150533 /nfs/dbraw/zinc/15/05/33/574150533.db2.gz VUQWOXZLIAVJPY-NSHDSACASA-N -1 3 293.319 2.846 20 10 CFCDHM O=C(c1cc([O-])cs1)N1CC[C@H](c2ccco2)C1 ZINC000732291685 574150692 /nfs/dbraw/zinc/15/06/92/574150692.db2.gz KVEVPCSCAZIDAG-VIFPVBQESA-N -1 3 263.318 2.676 20 10 CFCDHM COc1ccccc1COC(=O)c1cc([O-])cs1 ZINC000732353903 574153066 /nfs/dbraw/zinc/15/30/66/574153066.db2.gz CXJUGSAKNRMQGA-UHFFFAOYSA-N -1 3 264.302 2.819 20 10 CFCDHM COc1ccc(OCCOC(=O)c2cc([O-])cs2)cc1 ZINC000732352594 574153035 /nfs/dbraw/zinc/15/30/35/574153035.db2.gz AASKGXNJIZNWFL-UHFFFAOYSA-N -1 3 294.328 2.698 20 10 CFCDHM CC[C@H](NC(=O)c1cc([O-])cs1)c1nccs1 ZINC000738545869 574172911 /nfs/dbraw/zinc/17/29/11/574172911.db2.gz SHXCMBZGGUYDSQ-QMMMGPOBSA-N -1 3 268.363 2.791 20 10 CFCDHM CC(C)n1cc([C@@H](C)NC(=O)c2cc([O-])cs2)cn1 ZINC000732835180 574174808 /nfs/dbraw/zinc/17/48/08/574174808.db2.gz HTYZEAXCEWTXDH-SECBINFHSA-N -1 3 279.365 2.722 20 10 CFCDHM CCOc1ccc(CN(C)Cc2ccccc2[O-])nc1 ZINC000755944344 574199876 /nfs/dbraw/zinc/19/98/76/574199876.db2.gz XHXYFLQLKUODJJ-UHFFFAOYSA-N -1 3 272.348 2.818 20 10 CFCDHM C[C@@H](NCc1cccnc1)c1cc([N+](=O)[O-])ccc1[O-] ZINC000756345118 574226958 /nfs/dbraw/zinc/22/69/58/574226958.db2.gz VUHGZEXPFKFZFE-SNVBAGLBSA-N -1 3 273.292 2.546 20 10 CFCDHM Cn1ccc(CNCc2cc(Cl)cc([N+](=O)[O-])c2[O-])c1 ZINC000748098854 574229115 /nfs/dbraw/zinc/22/91/15/574229115.db2.gz PSGXTKNLYQYZON-UHFFFAOYSA-N -1 3 295.726 2.582 20 10 CFCDHM CCc1cc(CN[C@H](C)c2ccc(F)cc2[O-])[nH]n1 ZINC000756571519 574248651 /nfs/dbraw/zinc/24/86/51/574248651.db2.gz FVNCTRKJUMIQQZ-SECBINFHSA-N -1 3 263.316 2.668 20 10 CFCDHM C[C@H]1C[C@H](NCc2ccon2)c2c1c(F)ccc2[O-] ZINC000756635506 574254069 /nfs/dbraw/zinc/25/40/69/574254069.db2.gz GBXJQIGDSLDTEM-KWQFWETISA-N -1 3 262.284 2.857 20 10 CFCDHM Cc1cc(CN[C@@H](C)c2cc(Cl)ccc2[O-])ncn1 ZINC000756777367 574262296 /nfs/dbraw/zinc/26/22/96/574262296.db2.gz XDAIRUZCSREGKM-JTQLQIEISA-N -1 3 277.755 2.995 20 10 CFCDHM C[C@H]1C[C@H](NCc2cocn2)c2c1c(F)ccc2[O-] ZINC000756829782 574266248 /nfs/dbraw/zinc/26/62/48/574266248.db2.gz BUWXNLAKTVCURM-KWQFWETISA-N -1 3 262.284 2.857 20 10 CFCDHM O=C(NC[C@@H](O)c1ccccc1Cl)c1cc([O-])cs1 ZINC000740929044 574274544 /nfs/dbraw/zinc/27/45/44/574274544.db2.gz OIMGCFQOOQSMHO-LLVKDONJSA-N -1 3 297.763 2.571 20 10 CFCDHM O=C(c1cc([O-])cs1)N1CCc2ccccc2CC1 ZINC000734864886 574305701 /nfs/dbraw/zinc/30/57/01/574305701.db2.gz LTFCYNNHOQSUJK-UHFFFAOYSA-N -1 3 273.357 2.695 20 10 CFCDHM COCCN(Cc1c([O-])ccc2ccncc21)CC(F)F ZINC000725785589 574308033 /nfs/dbraw/zinc/30/80/33/574308033.db2.gz UHHWCMIYTLBNII-UHFFFAOYSA-N -1 3 296.317 2.654 20 10 CFCDHM O=C(NC[C@@H]1CCc2ccccc2C1)c1cc([O-])cs1 ZINC000735326103 574320894 /nfs/dbraw/zinc/32/08/94/574320894.db2.gz DCSWNZXIAZCOOW-LLVKDONJSA-N -1 3 287.384 2.989 20 10 CFCDHM CC[C@@H](NC(=O)c1cc([O-])cs1)c1ccncc1 ZINC000743502820 574367475 /nfs/dbraw/zinc/36/74/75/574367475.db2.gz JQSDDBKZYRJJJN-LLVKDONJSA-N -1 3 262.334 2.730 20 10 CFCDHM CC[C@H](NC(=O)c1cc([O-])cs1)c1c(C)nn(C)c1C ZINC000743748472 574371630 /nfs/dbraw/zinc/37/16/30/574371630.db2.gz NLZKVMJETDSEET-NSHDSACASA-N -1 3 293.392 2.685 20 10 CFCDHM Cc1ccc(C(=O)N2C[C@@H](C)CC(C)(C)C2)c([O-])c1O ZINC000753029224 574397646 /nfs/dbraw/zinc/39/76/46/574397646.db2.gz KNRGXIRUPNYWIB-JTQLQIEISA-N -1 3 277.364 2.914 20 10 CFCDHM C[C@@H]1C[N@H+](Cc2c([O-])ccc3ccccc32)C[C@@H]1C(=O)[O-] ZINC000086774460 601817121 /nfs/dbraw/zinc/81/71/21/601817121.db2.gz UJISWMXXHFLTFH-RISCZKNCSA-N -1 3 285.343 2.698 20 10 CFCDHM C[C@@H]1C[N@@H+](Cc2c([O-])ccc3ccccc32)C[C@@H]1C(=O)[O-] ZINC000086774460 601817122 /nfs/dbraw/zinc/81/71/22/601817122.db2.gz UJISWMXXHFLTFH-RISCZKNCSA-N -1 3 285.343 2.698 20 10 CFCDHM CC(C)(C(=O)[O-])[C@H]1CCC[N@H+](Cc2cc(F)ccc2[O-])C1 ZINC000232538516 605548006 /nfs/dbraw/zinc/54/80/06/605548006.db2.gz HUEYTLJJJDSGMS-LBPRGKRZSA-N -1 3 295.354 2.854 20 10 CFCDHM CC(C)(C(=O)[O-])[C@H]1CCC[N@@H+](Cc2cc(F)ccc2[O-])C1 ZINC000232538516 605548008 /nfs/dbraw/zinc/54/80/08/605548008.db2.gz HUEYTLJJJDSGMS-LBPRGKRZSA-N -1 3 295.354 2.854 20 10 CFCDHM Cc1ccc(C(=O)N2c3ccccc3C[C@H]2C)c([O-])c1O ZINC000179406068 618269813 /nfs/dbraw/zinc/26/98/13/618269813.db2.gz FPCKCVPCAPBHQM-LLVKDONJSA-N -1 3 283.327 2.998 20 10 CFCDHM CN1CCCc2cc(NC(=O)c3cccc(O)c3[O-])ccc21 ZINC000187084181 618272159 /nfs/dbraw/zinc/27/21/59/618272159.db2.gz UOSTYBUGOYQUMH-UHFFFAOYSA-N -1 3 298.342 2.733 20 10 CFCDHM COc1cc(NC(=O)c2ccc(C)c(O)c2[O-])ccc1F ZINC000187551016 618280978 /nfs/dbraw/zinc/28/09/78/618280978.db2.gz ULMMIIUZHGVBED-UHFFFAOYSA-N -1 3 291.278 2.806 20 10 CFCDHM CC(C)CSCCCNC(=O)c1cccc(O)c1[O-] ZINC000193148097 618453056 /nfs/dbraw/zinc/45/30/56/618453056.db2.gz RLOLHUBBXYXCNM-UHFFFAOYSA-N -1 3 283.393 2.607 20 10 CFCDHM Cc1cc(S(=O)(=O)[N-]c2ccc(O)cc2)cc(C)c1F ZINC000182418383 618895649 /nfs/dbraw/zinc/89/56/49/618895649.db2.gz ANLOUEGGKVSSPT-UHFFFAOYSA-N -1 3 295.335 2.949 20 10 CFCDHM CCc1nocc1CN(C)Cc1cc(F)cc(F)c1[O-] ZINC000894863570 619488963 /nfs/dbraw/zinc/48/89/63/619488963.db2.gz ISXIKDRHEZZCLH-UHFFFAOYSA-N -1 3 282.290 2.853 20 10 CFCDHM CCOCc1nc(C)cc(NCc2c([O-])cccc2F)n1 ZINC000895832935 619619269 /nfs/dbraw/zinc/61/92/69/619619269.db2.gz QXAAZQZYKIXHSJ-UHFFFAOYSA-N -1 3 291.326 2.778 20 10 CFCDHM [O-]c1cccc(F)c1CN[C@@H]1CCc2cccnc21 ZINC000896640208 619781385 /nfs/dbraw/zinc/78/13/85/619781385.db2.gz GVILGEXMTLPUHH-CYBMUJFWSA-N -1 3 258.296 2.703 20 10 CFCDHM Cc1nn(C(C)C)cc1CNCc1c([O-])cccc1F ZINC000896639533 619781400 /nfs/dbraw/zinc/78/14/00/619781400.db2.gz VRGGSDPOIBVZHN-UHFFFAOYSA-N -1 3 277.343 2.907 20 10 CFCDHM [O-]c1cccc(F)c1CN[C@H]1CCc2cccnc21 ZINC000896640209 619781758 /nfs/dbraw/zinc/78/17/58/619781758.db2.gz GVILGEXMTLPUHH-ZDUSSCGKSA-N -1 3 258.296 2.703 20 10 CFCDHM CC(C)C[C@H](C)C(=O)NCc1c([O-])cccc1F ZINC000928707179 619996064 /nfs/dbraw/zinc/99/60/64/619996064.db2.gz BTTDYWZXJYLXHZ-JTQLQIEISA-N -1 3 253.317 2.830 20 10 CFCDHM CC1(C)CO[C@@H](CCC(=O)NCc2c([O-])cccc2F)C1 ZINC000928711901 619997145 /nfs/dbraw/zinc/99/71/45/619997145.db2.gz VJVRLJYNEJLSPV-NSHDSACASA-N -1 3 295.354 2.743 20 10 CFCDHM CC(C)CCO[C@@H](C)C(=O)NCc1c([O-])cccc1F ZINC000928712806 619997161 /nfs/dbraw/zinc/99/71/61/619997161.db2.gz ZGHUFPFEQZDEFZ-NSHDSACASA-N -1 3 283.343 2.599 20 10 CFCDHM C[C@@H](NCc1ccc(F)c(F)c1[O-])c1cncs1 ZINC000897930302 620305103 /nfs/dbraw/zinc/30/51/03/620305103.db2.gz MVYWAYZPXGVGRE-SSDOTTSWSA-N -1 3 270.304 2.978 20 10 CFCDHM CCO[N-]C(=O)Cc1cc(C)n(-c2ccccc2)c1C ZINC000820523504 622694580 /nfs/dbraw/zinc/69/45/80/622694580.db2.gz LXGIQXILDUDLDC-UHFFFAOYSA-N -1 3 272.348 2.704 20 10 CFCDHM CC[C@@H]1CN(Cc2cc(Cl)c(C)cc2[O-])CCO1 ZINC000824547939 623522255 /nfs/dbraw/zinc/52/22/55/623522255.db2.gz FBZRJXRNALPAKU-GFCCVEGCSA-N -1 3 269.772 2.965 20 10 CFCDHM Cc1noc([C@H](C)NCc2cc(Cl)c(C)cc2[O-])n1 ZINC000825681263 623739034 /nfs/dbraw/zinc/73/90/34/623739034.db2.gz OMMNDXYWZRTLHQ-QMMMGPOBSA-N -1 3 281.743 2.896 20 10 CFCDHM CCOC1CN(Cc2cc(Cl)c(C)cc2[O-])C1 ZINC000826113084 623794563 /nfs/dbraw/zinc/79/45/63/623794563.db2.gz HNOIABKQKAJODG-UHFFFAOYSA-N -1 3 255.745 2.575 20 10 CFCDHM Cc1cc([O-])c(CN2CC[C@@H](O)C(F)(F)C2)cc1Cl ZINC000826952798 623913937 /nfs/dbraw/zinc/91/39/37/623913937.db2.gz SZIZKVOWTAEHAI-GFCCVEGCSA-N -1 3 291.725 2.556 20 10 CFCDHM O=C(NCc1ccc(N2CCCC2)cc1)c1ccccc1[O-] ZINC000915083764 623979968 /nfs/dbraw/zinc/97/99/68/623979968.db2.gz NOFVRYVLQDGGEI-UHFFFAOYSA-N -1 3 296.370 2.922 20 10 CFCDHM C[C@H]1CCC[C@@H]1NC(=O)NCc1c([O-])cccc1F ZINC000917025354 624300506 /nfs/dbraw/zinc/30/05/06/624300506.db2.gz UOIDKXILSLSKLR-CABZTGNLSA-N -1 3 266.316 2.519 20 10 CFCDHM CCS[C@@H]1CCC[C@@H](NC(=O)c2cccc(O)c2[O-])C1 ZINC000185798091 625779149 /nfs/dbraw/zinc/77/91/49/625779149.db2.gz WLPHHOVLWGRJEG-GHMZBOCLSA-N -1 3 295.404 2.892 20 10 CFCDHM CCn1c2ccccc2nc1NC(=O)c1cccc(O)c1[O-] ZINC000186836202 626400707 /nfs/dbraw/zinc/40/07/07/626400707.db2.gz UTZHAIAVCZNXRA-UHFFFAOYSA-N -1 3 297.314 2.720 20 10 CFCDHM O=C(N[C@@H]1C[C@H]1c1cccc(F)c1)c1cccc(O)c1[O-] ZINC000187078693 626449244 /nfs/dbraw/zinc/44/92/44/626449244.db2.gz SOYTZQZBYMDMAD-QWHCGFSZSA-N -1 3 287.290 2.523 20 10 CFCDHM CC(C)n1cc(NC(=O)NCc2c([O-])cccc2F)cn1 ZINC000923124149 626452164 /nfs/dbraw/zinc/45/21/64/626452164.db2.gz TYRKPKDHNKHTSN-UHFFFAOYSA-N -1 3 292.314 2.630 20 10 CFCDHM CC[C@@H](NC(=O)NCc1c([O-])cccc1F)C1CC1 ZINC000923300458 626463913 /nfs/dbraw/zinc/46/39/13/626463913.db2.gz SMDNGLFNVBUYDG-GFCCVEGCSA-N -1 3 266.316 2.519 20 10 CFCDHM C[C@@H](N[C@H](C)c1ccc(F)cc1[O-])c1ccn(C)n1 ZINC000840817541 626523153 /nfs/dbraw/zinc/52/31/53/626523153.db2.gz VOXYXEMVTNGBQD-NXEZZACHSA-N -1 3 263.316 2.677 20 10 CFCDHM [O-]c1ccc2ccncc2c1CN1CCC(F)(F)C1 ZINC000776293067 628127517 /nfs/dbraw/zinc/12/75/17/628127517.db2.gz PPCRRBUCXXMNAQ-UHFFFAOYSA-N -1 3 264.275 2.781 20 10 CFCDHM CC[C@H](N[C@H](C)c1ncn(C)n1)c1cc(Cl)ccc1[O-] ZINC000783297206 628698391 /nfs/dbraw/zinc/69/83/91/628698391.db2.gz GCDXENDRXLLPIV-SKDRFNHKSA-N -1 3 294.786 2.976 20 10 CFCDHM [O-]c1c(Cl)cccc1CN1CCOCC2(CC2)C1 ZINC000783596613 628725007 /nfs/dbraw/zinc/72/50/07/628725007.db2.gz YZWSMRYYKIZAKI-UHFFFAOYSA-N -1 3 267.756 2.658 20 10 CFCDHM C[C@@H](CN(C)C(=O)c1cccc(O)c1[O-])c1ccccc1 ZINC000790629366 629253771 /nfs/dbraw/zinc/25/37/71/629253771.db2.gz HXMSWMPONACXKJ-LBPRGKRZSA-N -1 3 285.343 2.974 20 10 CFCDHM Cc1cccc2c1CC[C@@H]2NC(=O)c1cccc(O)c1[O-] ZINC000790658639 629256022 /nfs/dbraw/zinc/25/60/22/629256022.db2.gz XGFOURXXZMOTHV-AWEZNQCLSA-N -1 3 283.327 2.824 20 10 CFCDHM C[C@@H]1Cc2ccccc2[C@@H]1NC(=O)c1cccc(O)c1[O-] ZINC000790704246 629258292 /nfs/dbraw/zinc/25/82/92/629258292.db2.gz OJKQQRRIOZLHBU-MEBBXXQBSA-N -1 3 283.327 2.761 20 10 CFCDHM [O-]c1ccc(Cl)c(F)c1CN1CCC[C@@H](CCO)C1 ZINC000792168043 629404898 /nfs/dbraw/zinc/40/48/98/629404898.db2.gz ZELJMXNYHPAOLM-JTQLQIEISA-N -1 3 287.762 2.779 20 10 CFCDHM CC[C@@H](NCc1cocn1)c1ccc(F)cc1[O-] ZINC000796880620 629984657 /nfs/dbraw/zinc/98/46/57/629984657.db2.gz RCVMXMAXWOHJOM-GFCCVEGCSA-N -1 3 250.273 2.760 20 10 CFCDHM Cc1ccc(C(=O)N2CCc3cc(F)ccc32)c([O-])c1O ZINC000801547249 630457004 /nfs/dbraw/zinc/45/70/04/630457004.db2.gz LKGUMSHLRNAPTA-UHFFFAOYSA-N -1 3 287.290 2.748 20 10 CFCDHM CCO[C@@H]1CCCN(Cc2cc(F)cc(C(C)=O)c2[O-])C1 ZINC000042423873 649999178 /nfs/dbraw/zinc/99/91/78/649999178.db2.gz UXVUKYCTDQFJOH-CQSZACIVSA-N -1 3 295.354 2.735 20 10 CFCDHM CC[C@H](NCc1ccn(CC)n1)c1ccc(F)cc1[O-] ZINC000840840291 631237057 /nfs/dbraw/zinc/23/70/57/631237057.db2.gz COYWGFNDALZOTK-AWEZNQCLSA-N -1 3 277.343 2.989 20 10 CFCDHM Cc1cc([O-])c(CN2CCO[C@H](C)C2)c(Cl)c1 ZINC000840910892 631260343 /nfs/dbraw/zinc/26/03/43/631260343.db2.gz WWYWUXOKHWNONN-SNVBAGLBSA-N -1 3 255.745 2.575 20 10 CFCDHM Cn1ncc2c1CCCN(Cc1cccc(Cl)c1[O-])C2 ZINC000840954762 631280215 /nfs/dbraw/zinc/28/02/15/631280215.db2.gz NIGORGLBBQJURI-UHFFFAOYSA-N -1 3 291.782 2.728 20 10 CFCDHM O=c1cc(CSc2nccs2)nc(C2CC2)[n-]1 ZINC000840194000 631348821 /nfs/dbraw/zinc/34/88/21/631348821.db2.gz RTQXFGVIXQBHKJ-UHFFFAOYSA-N -1 3 265.363 2.808 20 10 CFCDHM COC1CCN(Cc2cc(Cl)c(F)cc2[O-])CC1 ZINC000816483189 632468341 /nfs/dbraw/zinc/46/83/41/632468341.db2.gz IVZMMQZXTJFJJP-UHFFFAOYSA-N -1 3 273.735 2.796 20 10 CFCDHM C[C@@H]1CC[C@H](O)CN1Cc1cc(Cl)c(F)cc1[O-] ZINC000817413901 632625833 /nfs/dbraw/zinc/62/58/33/632625833.db2.gz DIFCIKVHAKIRIR-SCZZXKLOSA-N -1 3 273.735 2.530 20 10 CFCDHM C[C@H]1CCN(Cc2c([O-])ccc(Cl)c2F)C[C@@H]1CO ZINC000857060505 635921184 /nfs/dbraw/zinc/92/11/84/635921184.db2.gz AMMZXLYXGIMRNT-VHSXEESVSA-N -1 3 287.762 2.635 20 10 CFCDHM Cc1noc(CN(C)Cc2ccc3ccccc3c2[O-])n1 ZINC000848928184 633410736 /nfs/dbraw/zinc/41/07/36/633410736.db2.gz WVQXMBIQQGRQGS-UHFFFAOYSA-N -1 3 283.331 2.869 20 10 CFCDHM C[C@H](O)CN(Cc1c([O-])ccc(Cl)c1F)C1CC1 ZINC000848928431 633411245 /nfs/dbraw/zinc/41/12/45/633411245.db2.gz DANUQZCKVAYMDH-QMMMGPOBSA-N -1 3 273.735 2.530 20 10 CFCDHM C[C@H](N[C@H]1C[C@H](C)n2ncnc21)c1cc(F)cc(F)c1[O-] ZINC000850499099 634019187 /nfs/dbraw/zinc/01/91/87/634019187.db2.gz JJASTVQGMJDWRW-UBJUHAIHSA-N -1 3 294.305 2.619 20 10 CFCDHM CCn1cc(CN[C@@H](C)c2ccc(Cl)cc2[O-])nn1 ZINC000850522690 634030103 /nfs/dbraw/zinc/03/01/03/634030103.db2.gz WQUFEGBLUCQABD-VIFPVBQESA-N -1 3 280.759 2.508 20 10 CFCDHM CCn1nccc1CN[C@@H](C)c1cc(F)cc(F)c1[O-] ZINC000853239106 634948305 /nfs/dbraw/zinc/94/83/05/634948305.db2.gz ACGKXLFIBGKJJC-VIFPVBQESA-N -1 3 281.306 2.738 20 10 CFCDHM O=C(c1cccc(O)c1[O-])N(CCC1CC1)CC1CC1 ZINC000856284384 635775756 /nfs/dbraw/zinc/77/57/56/635775756.db2.gz LNQVCKSVFSTHPH-UHFFFAOYSA-N -1 3 275.348 2.750 20 10 CFCDHM CC1CCC(C)(NC(=O)c2cccc(O)c2[O-])CC1 ZINC000188341618 650324097 /nfs/dbraw/zinc/32/40/97/650324097.db2.gz GUUIKLXIEVEIBZ-UHFFFAOYSA-N -1 3 263.337 2.796 20 10 CFCDHM C[C@H]1SCCN(Cc2ccc(F)c(F)c2[O-])[C@H]1C ZINC000876751074 642994653 /nfs/dbraw/zinc/99/46/53/642994653.db2.gz UGAVRKVZALBVCX-DTWKUNHWSA-N -1 3 273.348 2.996 20 10 CFCDHM O=C(Nc1ccc(F)cc1F)c1cccc(O)c1[O-] ZINC000126225855 643055718 /nfs/dbraw/zinc/05/57/18/643055718.db2.gz WLKVUVNEFWLXPL-UHFFFAOYSA-N -1 3 265.215 2.628 20 10 CFCDHM Cc1ccc([C@@H](C)NC(=O)c2cccc(O)c2[O-])s1 ZINC000126303939 643111309 /nfs/dbraw/zinc/11/13/09/643111309.db2.gz SRYRLQQYANGZKG-SECBINFHSA-N -1 3 277.345 2.959 20 10 CFCDHM C[C@H](N(C)C(=O)c1cccc(O)c1[O-])C(C)(C)C ZINC000126342938 643153319 /nfs/dbraw/zinc/15/33/19/643153319.db2.gz SZHQFEBKQDUUGV-VIFPVBQESA-N -1 3 251.326 2.604 20 10 CFCDHM O=C(c1cccc(O)c1[O-])N1CCC[C@H]2CCC[C@H]21 ZINC000126454191 643230928 /nfs/dbraw/zinc/23/09/28/643230928.db2.gz FHWKVVJYHLPHLW-ZYHUDNBSSA-N -1 3 261.321 2.503 20 10 CFCDHM CC[C@@H](C)C[C@H](C)NC(=O)c1cccc(O)c1[O-] ZINC000126457374 643232145 /nfs/dbraw/zinc/23/21/45/643232145.db2.gz LRWSELMQAHPTBV-ZJUUUORDSA-N -1 3 251.326 2.652 20 10 CFCDHM Cc1cc([O-])c(CN2Cc3cnn(C)c3C2)cc1Cl ZINC000877632995 643416812 /nfs/dbraw/zinc/41/68/12/643416812.db2.gz VGUJBTAIRRQWCE-UHFFFAOYSA-N -1 3 277.755 2.603 20 10 CFCDHM Cc1noc(C2CC2)c1NC(=O)c1ccc(C)c(O)c1[O-] ZINC000135597035 646554617 /nfs/dbraw/zinc/55/46/17/646554617.db2.gz ISIBDVKMBLCYDA-UHFFFAOYSA-N -1 3 288.303 2.832 20 10 CFCDHM C[C@H](N[C@H](CO)c1ccccc1)c1c([O-])cccc1F ZINC000886528504 647031121 /nfs/dbraw/zinc/03/11/21/647031121.db2.gz NEIKTOPTLJCQJA-SMDDNHRTSA-N -1 3 275.323 2.916 20 10 CFCDHM CC(C)C[C@H](C)OCCC(=O)NCc1c([O-])cccc1F ZINC000928706098 648944659 /nfs/dbraw/zinc/94/46/59/648944659.db2.gz QCLCDVGXTJJCSX-LBPRGKRZSA-N -1 3 297.370 2.989 20 10 CFCDHM O=C(NCc1c([O-])cccc1F)[C@@H]1C[C@H]1C1CCC1 ZINC000928706214 648944859 /nfs/dbraw/zinc/94/48/59/648944859.db2.gz OWKSMHKUNPXEKP-WDEREUQCSA-N -1 3 263.312 2.584 20 10 CFCDHM CCC(=CC(=O)NCc1c([O-])cccc1F)CC ZINC000928706543 648944871 /nfs/dbraw/zinc/94/48/71/648944871.db2.gz WQRVMWPDVCFIMG-UHFFFAOYSA-N -1 3 251.301 2.894 20 10 CFCDHM CC(C)c1cc(C(=O)NCc2c([O-])cccc2F)on1 ZINC000928706588 648944951 /nfs/dbraw/zinc/94/49/51/648944951.db2.gz XXSOEESGIDQDIN-UHFFFAOYSA-N -1 3 278.283 2.573 20 10 CFCDHM Cc1nn(C(C)C)cc1C(=O)NCc1c([O-])cccc1F ZINC000928706665 648945473 /nfs/dbraw/zinc/94/54/73/648945473.db2.gz UOVWLXPGDNXWLF-UHFFFAOYSA-N -1 3 291.326 2.547 20 10 CFCDHM O=C(CCCc1nccs1)NCc1c([O-])cccc1F ZINC000928707117 648945654 /nfs/dbraw/zinc/94/56/54/648945654.db2.gz AHZDRMYUGZSHAE-UHFFFAOYSA-N -1 3 294.351 2.627 20 10 CFCDHM O=C(CCCc1ccccn1)NCc1c([O-])cccc1F ZINC000928711131 648946492 /nfs/dbraw/zinc/94/64/92/648946492.db2.gz DWDLOKZSQKUGOH-UHFFFAOYSA-N -1 3 288.322 2.565 20 10 CFCDHM CC(=O)c1cc(F)cc(CN2CCn3cccc3C2)c1[O-] ZINC000932533473 649616077 /nfs/dbraw/zinc/61/60/77/649616077.db2.gz ZWPTYGXMCVSZJN-UHFFFAOYSA-N -1 3 288.322 2.551 20 10 CFCDHM C[C@H]1C[N@@H+](Cc2cc(C(=O)[O-])ccc2[O-])CCC[C@@H]1C ZINC001231560450 777259968 /nfs/dbraw/zinc/25/99/68/777259968.db2.gz INDBXYCCWKFWTI-RYUDHWBXSA-N -1 3 277.364 2.958 20 10 CFCDHM C[C@H]1C[N@H+](Cc2cc(C(=O)[O-])ccc2[O-])CCC[C@@H]1C ZINC001231560450 777259977 /nfs/dbraw/zinc/25/99/77/777259977.db2.gz INDBXYCCWKFWTI-RYUDHWBXSA-N -1 3 277.364 2.958 20 10 CFCDHM C[C@H]1CC[N@H+](Cc2cc(C(=O)[O-])ccc2[O-])[C@@H](C)C1 ZINC001231564082 777261101 /nfs/dbraw/zinc/26/11/01/777261101.db2.gz HYOIERIYCPMRQM-QWRGUYRKSA-N -1 3 263.337 2.711 20 10 CFCDHM C[C@H]1CC[N@@H+](Cc2cc(C(=O)[O-])ccc2[O-])[C@@H](C)C1 ZINC001231564082 777261107 /nfs/dbraw/zinc/26/11/07/777261107.db2.gz HYOIERIYCPMRQM-QWRGUYRKSA-N -1 3 263.337 2.711 20 10 CFCDHM C[C@@H]1CCC[N@H+](Cc2cc(C(=O)[O-])ccc2[O-])[C@H]1C ZINC001231563324 777261659 /nfs/dbraw/zinc/26/16/59/777261659.db2.gz HRHRKYDUYUAVKC-MNOVXSKESA-N -1 3 263.337 2.711 20 10 CFCDHM C[C@@H]1CCC[N@@H+](Cc2cc(C(=O)[O-])ccc2[O-])[C@H]1C ZINC001231563324 777261665 /nfs/dbraw/zinc/26/16/65/777261665.db2.gz HRHRKYDUYUAVKC-MNOVXSKESA-N -1 3 263.337 2.711 20 10 CFCDHM COc1cc([O-])c(CN(C)CC(F)F)cc1Cl ZINC001232271197 777501380 /nfs/dbraw/zinc/50/13/80/777501380.db2.gz QNWVYELPYVFJLV-UHFFFAOYSA-N -1 3 265.687 2.751 20 10 CFCDHM [O-]c1ccc(F)c(F)c1CN1C[C@@H]2C[C@H]1C[C@@H]2F ZINC001233335637 777896717 /nfs/dbraw/zinc/89/67/17/777896717.db2.gz FDAOUPGAFPGZTJ-LAEOZQHASA-N -1 3 257.255 2.603 20 10 CFCDHM CN(Cc1cccc(C(F)(F)F)c1[O-])C1(C)COC1 ZINC001233418727 777944358 /nfs/dbraw/zinc/94/43/58/777944358.db2.gz SMJZCAFNWPASSR-UHFFFAOYSA-N -1 3 275.270 2.632 20 10 CFCDHM O=C1CCN(Cc2ccc(C(F)(F)F)cc2[O-])C[C@@H]1F ZINC001233454796 777959679 /nfs/dbraw/zinc/95/96/79/777959679.db2.gz KKWULVMCMYTDQX-JTQLQIEISA-N -1 3 291.244 2.524 20 10 CFCDHM C[C@@H]1CN(Cc2cc(Cl)c(Cl)cc2[O-])CC[C@@H]1O ZINC001236793746 778939195 /nfs/dbraw/zinc/93/91/95/778939195.db2.gz ORBCUIZVDVBHNZ-PELKAZGASA-N -1 3 290.190 2.902 20 10 CFCDHM C[C@]1(CO)CCN(Cc2cc(Cl)c(Cl)cc2[O-])C1 ZINC001236792664 778939413 /nfs/dbraw/zinc/93/94/13/778939413.db2.gz GLFCWZLQNNJEKU-ZDUSSCGKSA-N -1 3 290.190 2.903 20 10 CFCDHM COc1cc([O-])c(CN2CC[C@H]2C)c(Br)c1 ZINC001237066321 779003576 /nfs/dbraw/zinc/00/35/76/779003576.db2.gz VMRIOMSKOOSBDW-MRVPVSSYSA-N -1 3 286.169 2.758 20 10 CFCDHM [O-]c1ccc(Cl)c(Cl)c1CN1CCC[C@H]1CO ZINC001237078877 779007358 /nfs/dbraw/zinc/00/73/58/779007358.db2.gz ZEKVLPHVXGDHGR-QMMMGPOBSA-N -1 3 276.163 2.656 20 10 CFCDHM COC1CCN(Cc2c([O-])ccc(F)c2Cl)CC1 ZINC001237119717 779017908 /nfs/dbraw/zinc/01/79/08/779017908.db2.gz FBVVQEOWPNZHBQ-UHFFFAOYSA-N -1 3 273.735 2.796 20 10 CFCDHM [O-]c1ccc(F)c(Cl)c1CN1CCCC2(COC2)C1 ZINC001237125251 779019947 /nfs/dbraw/zinc/01/99/47/779019947.db2.gz XBJFOWRGXUQBOK-UHFFFAOYSA-N -1 3 285.746 2.797 20 10 CFCDHM C[C@]1(O)CCCN(Cc2c([O-])ccc(F)c2Cl)C1 ZINC001237126078 779021253 /nfs/dbraw/zinc/02/12/53/779021253.db2.gz IAFZHADZSRGFTK-ZDUSSCGKSA-N -1 3 273.735 2.532 20 10 CFCDHM C[C@@H]1C[C@@H](O)CCN1Cc1cc(Cl)cc(F)c1[O-] ZINC001237622601 779147265 /nfs/dbraw/zinc/14/72/65/779147265.db2.gz VGASCDIKHLAZTF-KCJUWKMLSA-N -1 3 273.735 2.530 20 10 CFCDHM CN1C[C@@H]2C[C@H]1CN2Cc1cc(Cl)c(Cl)cc1[O-] ZINC001236799264 779640056 /nfs/dbraw/zinc/64/00/56/779640056.db2.gz NAORXUQATRUWNU-UWVGGRQHSA-N -1 3 287.190 2.587 20 10 CFCDHM Cc1ncc(CN(C)Cc2cc(F)c(Cl)cc2[O-])cn1 ZINC001237949873 779727130 /nfs/dbraw/zinc/72/71/30/779727130.db2.gz NUDGPQSCPFWUIQ-UHFFFAOYSA-N -1 3 295.745 2.915 20 10 CFCDHM CO[C@H]1CN(Cc2cc(F)cc(F)c2[O-])CC[C@@H]1C ZINC000708413669 781273212 /nfs/dbraw/zinc/27/32/12/781273212.db2.gz MPSIQCXZRNABBI-ZANVPECISA-N -1 3 271.307 2.527 20 10 CFCDHM CCc1nn(C)c(Cl)c1CN(C)Cc1ccccc1[O-] ZINC000091956493 375073762 /nfs/dbraw/zinc/07/37/62/375073762.db2.gz BSCWTIHEEUQIKU-UHFFFAOYSA-N -1 3 293.798 2.974 20 10 CFCDHM [O-]c1ccc(F)cc1CN1CC(Cc2ccco2)C1 ZINC000529649256 383741608 /nfs/dbraw/zinc/74/16/08/383741608.db2.gz OZEBEYNDSLLAHV-UHFFFAOYSA-N -1 3 261.296 2.799 20 10 CFCDHM CC(=O)c1cc(F)cc(CN(C)Cc2cc(C)on2)c1[O-] ZINC000175580118 380092255 /nfs/dbraw/zinc/09/22/55/380092255.db2.gz CEEYHJRMNDLPHN-UHFFFAOYSA-N -1 3 292.310 2.662 20 10 CFCDHM CC(C)n1cc(CN(C)Cc2ccccc2[O-])cn1 ZINC000179804044 380581339 /nfs/dbraw/zinc/58/13/39/380581339.db2.gz LAJIWIIIPCLZBA-UHFFFAOYSA-N -1 3 259.353 2.802 20 10 CFCDHM CC(=O)c1cc(F)cc(CN[C@H](C)c2cccnc2)c1[O-] ZINC000181647326 380852183 /nfs/dbraw/zinc/85/21/83/380852183.db2.gz QHUUGFUOCUJILY-SNVBAGLBSA-N -1 3 288.322 2.980 20 10 CFCDHM CN1CCCc2cc(CNC(=O)c3cccc([O-])c3)ccc21 ZINC000182254816 381041709 /nfs/dbraw/zinc/04/17/09/381041709.db2.gz JWBCNMKNRSQVEE-UHFFFAOYSA-N -1 3 296.370 2.705 20 10 CFCDHM CCc1onc(C)c1NC(=O)c1ccc(C)c(O)c1[O-] ZINC000182943519 381189000 /nfs/dbraw/zinc/18/90/00/381189000.db2.gz BDYOKSZYFZWRKT-UHFFFAOYSA-N -1 3 276.292 2.517 20 10 CFCDHM CC[C@H](NCc1nnc(C2CC2)[nH]1)c1ccc(F)cc1[O-] ZINC000296620092 381475451 /nfs/dbraw/zinc/47/54/51/381475451.db2.gz WURJSTWQUABYLB-LBPRGKRZSA-N -1 3 290.342 2.768 20 10 CFCDHM CC[C@H](NCc1nccn1CC)c1ccc(F)cc1[O-] ZINC000296597941 381465213 /nfs/dbraw/zinc/46/52/13/381465213.db2.gz VJRBDOKBSZYYSM-ZDUSSCGKSA-N -1 3 277.343 2.989 20 10 CFCDHM Cc1ccc(C(=O)Nc2ccc3c(n2)CCC3)c([O-])c1O ZINC000297176529 381553018 /nfs/dbraw/zinc/55/30/18/381553018.db2.gz NQMJSLZQTDMJDJ-UHFFFAOYSA-N -1 3 284.315 2.542 20 10 CFCDHM Cc1nn(C)cc1[C@@H](C)N[C@H](C)c1ccc(F)cc1[O-] ZINC000185349495 381608155 /nfs/dbraw/zinc/60/81/55/381608155.db2.gz LFJBXCFSVBBZIE-NXEZZACHSA-N -1 3 277.343 2.985 20 10 CFCDHM Cc1ccc(C(=O)N2CCC=C(c3ccco3)C2)c([O-])c1O ZINC000376038811 382116702 /nfs/dbraw/zinc/11/67/02/382116702.db2.gz YUIZESSCWBVHNH-UHFFFAOYSA-N -1 3 299.326 2.929 20 10 CFCDHM CN(Cc1cccc(F)c1[O-])[C@H]1CCCc2c1cnn2C ZINC000376536027 382140769 /nfs/dbraw/zinc/14/07/69/382140769.db2.gz SKLTUMQUKGLERH-AWEZNQCLSA-N -1 3 289.354 2.774 20 10 CFCDHM COC(=O)[C@H]1CN(Cc2cccc(Cl)c2[O-])CC1(C)C ZINC000378443371 382461718 /nfs/dbraw/zinc/46/17/18/382461718.db2.gz MVVFPURIKKIZEP-LLVKDONJSA-N -1 3 297.782 2.677 20 10 CFCDHM [O-]c1ccc(F)cc1CN[C@H]1COc2cccc(F)c21 ZINC000378632270 382496070 /nfs/dbraw/zinc/49/60/70/382496070.db2.gz LGTRLBZAHKJCQW-LBPRGKRZSA-N -1 3 277.270 2.894 20 10 CFCDHM Cc1csc([C@@H]2COCCN2Cc2ccccc2[O-])n1 ZINC000190404026 382666354 /nfs/dbraw/zinc/66/63/54/382666354.db2.gz MCAJAVMHQALKSC-ZDUSSCGKSA-N -1 3 290.388 2.731 20 10 CFCDHM C[C@@H]1CN2CCCC[C@H]2CN1Cc1cccc(F)c1[O-] ZINC000252780313 383434330 /nfs/dbraw/zinc/43/43/30/383434330.db2.gz SRYYGSGQIAFOEU-OCCSQVGLSA-N -1 3 278.371 2.590 20 10 CFCDHM CC[C@H](N[C@H](C)c1ncnn1C)c1ccc(C)cc1[O-] ZINC000280119702 384889689 /nfs/dbraw/zinc/88/96/89/384889689.db2.gz OFAPJBKVHRGXFP-YPMHNXCESA-N -1 3 274.368 2.631 20 10 CFCDHM Cc1ccc(C(=O)Nc2cnn(CC(C)C)c2)c([O-])c1O ZINC000272750765 385603887 /nfs/dbraw/zinc/60/38/87/385603887.db2.gz OFTNDOOVEPRCLK-UHFFFAOYSA-N -1 3 289.335 2.511 20 10 CFCDHM Cc1cc(Cl)cc(CN(C)Cc2nccn2C)c1[O-] ZINC000272809394 385621380 /nfs/dbraw/zinc/62/13/80/385621380.db2.gz NFVHLILWZHGMGR-UHFFFAOYSA-N -1 3 279.771 2.720 20 10 CFCDHM COC(=O)c1ccc([O-])c([C@H](C)NCc2ccco2)c1 ZINC000273406716 385680566 /nfs/dbraw/zinc/68/05/66/385680566.db2.gz ONQRUJVISHQADF-JTQLQIEISA-N -1 3 275.304 2.623 20 10 CFCDHM Cn1cnc(-c2cccc(NCc3cccc(F)c3[O-])c2)n1 ZINC000372284416 394309356 /nfs/dbraw/zinc/30/93/56/394309356.db2.gz ZOSSVYMEUUFSRJ-UHFFFAOYSA-N -1 3 298.321 2.939 20 10 CFCDHM CCCN(Cc1ccccc1[O-])[C@@H](C(N)=O)c1ccccc1 ZINC000157067068 394341371 /nfs/dbraw/zinc/34/13/71/394341371.db2.gz TXOHFIARHQRJCP-QGZVFWFLSA-N -1 3 298.386 2.831 20 10 CFCDHM O=C(NCc1ccc2cccnc2c1[O-])[C@H]1CC=CCC1 ZINC000521396317 260073402 /nfs/dbraw/zinc/07/34/02/260073402.db2.gz LVVYZHYDAULNBR-ZDUSSCGKSA-N -1 3 282.343 2.913 20 10 CFCDHM Cc1ccc(C(=O)N2CCCC23CCC3)c([O-])c1O ZINC000368438177 267172402 /nfs/dbraw/zinc/17/24/02/267172402.db2.gz JOQQQYPRJOPGSG-UHFFFAOYSA-N -1 3 261.321 2.565 20 10 CFCDHM C[C@@]1(O)CCCN(Cc2c([O-])ccc(Cl)c2F)CC1 ZINC000369557024 267250957 /nfs/dbraw/zinc/25/09/57/267250957.db2.gz RIBREJBKCVGONC-CQSZACIVSA-N -1 3 287.762 2.922 20 10 CFCDHM C[C@H](N[C@H]1c2ccccc2C[C@@H]1O)c1ccc(F)cc1[O-] ZINC000185674372 290062751 /nfs/dbraw/zinc/06/27/51/290062751.db2.gz MLUSSKOYHZEIFV-POJUEXTFSA-N -1 3 287.334 2.840 20 10 CFCDHM Cc1ccc(C(=O)N2C[C@H](C)C[C@H](C)C2)c([O-])c1O ZINC000177660514 301521205 /nfs/dbraw/zinc/52/12/05/301521205.db2.gz SKENYBFRFDTWMU-AOOOYVTPSA-N -1 3 263.337 2.524 20 10 CFCDHM CC[C@@H](NCc1cnn(CC)n1)c1cc(Cl)ccc1[O-] ZINC000527925571 330296545 /nfs/dbraw/zinc/29/65/45/330296545.db2.gz VHFFCOMHMZOAOD-CYBMUJFWSA-N -1 3 294.786 2.898 20 10 CFCDHM CCN(C(=O)/C=C/c1cncc([O-])c1)c1cccc(OC)c1 ZINC000492433808 332397253 /nfs/dbraw/zinc/39/72/53/332397253.db2.gz CJWVAFHIYPOXSP-BQYQJAHWSA-N -1 3 298.342 2.862 20 10 CFCDHM C[C@@H]1CCN(C(=O)/C=C/c2cnccn2)c2c([O-])cccc21 ZINC000492568006 332403577 /nfs/dbraw/zinc/40/35/77/332403577.db2.gz RHESTTNDMRHUJK-BTDICHCPSA-N -1 3 295.342 2.736 20 10 CFCDHM Cc1ccc(C(=O)N[C@@H]2C[C@H]2c2ccsc2)c([O-])c1O ZINC000530001265 333516993 /nfs/dbraw/zinc/51/69/93/333516993.db2.gz QFHDFHXHDITUMP-NWDGAFQWSA-N -1 3 289.356 2.754 20 10 CFCDHM CCN1CCN(Cc2cccc(Cl)c2[O-])[C@@H](C)C1 ZINC000289832427 521688537 /nfs/dbraw/zinc/68/85/37/521688537.db2.gz UJCIGRCIPXVKSS-NSHDSACASA-N -1 3 268.788 2.572 20 10 CFCDHM CC(=O)c1cc(F)cc(CN2CCS[C@H](C)C2)c1[O-] ZINC000079413953 518288147 /nfs/dbraw/zinc/28/81/47/518288147.db2.gz NQXRUTPAWROQCK-SECBINFHSA-N -1 3 283.368 2.671 20 10 CFCDHM CC(C)c1noc(CN(C)Cc2ccccc2[O-])n1 ZINC000171927089 519903046 /nfs/dbraw/zinc/90/30/46/519903046.db2.gz OQYZUOOMJGTXII-UHFFFAOYSA-N -1 3 261.325 2.531 20 10 CFCDHM CCOC(=O)[C@@H](CC)N(Cc1ccccc1[O-])C1CC1 ZINC000191658660 521048708 /nfs/dbraw/zinc/04/87/08/521048708.db2.gz DLFPNRMFAAPCFU-CQSZACIVSA-N -1 3 277.364 2.698 20 10 CFCDHM CCc1nnc(CN[C@H](C)c2cc(F)ccc2[O-])s1 ZINC000289597708 522743274 /nfs/dbraw/zinc/74/32/74/522743274.db2.gz BKFWCQKAKRQPNX-MRVPVSSYSA-N -1 3 281.356 2.796 20 10 CFCDHM CC[C@H](N[C@H](C)c1nncn1C)c1ccc(C)cc1[O-] ZINC000280239036 522745766 /nfs/dbraw/zinc/74/57/66/522745766.db2.gz VTQIKAMZLQOQRW-YPMHNXCESA-N -1 3 274.368 2.631 20 10 CFCDHM COCC(C)(C)N(C)Cc1cc(F)cc(C(C)=O)c1[O-] ZINC000292429334 522814271 /nfs/dbraw/zinc/81/42/71/522814271.db2.gz VXXAFJGPCQPBHF-UHFFFAOYSA-N -1 3 283.343 2.591 20 10 CFCDHM CC[C@@H](N[C@@H](C)c1ncn(C)n1)c1ccc(C)cc1[O-] ZINC000280158770 522915799 /nfs/dbraw/zinc/91/57/99/522915799.db2.gz QOBVCJWNTDGOQZ-WCQYABFASA-N -1 3 274.368 2.631 20 10 CFCDHM CC[C@@H]1CCCCN1C(=O)CN(C)Cc1ccccc1[O-] ZINC000264577424 523148429 /nfs/dbraw/zinc/14/84/29/523148429.db2.gz BDIVYSNQARQMOI-OAHLLOKOSA-N -1 3 290.407 2.615 20 10 CFCDHM CCn1cc(CNCc2c([O-])cccc2Cl)cn1 ZINC000265471067 523380550 /nfs/dbraw/zinc/38/05/50/523380550.db2.gz IRBOPDHZBRKJEP-UHFFFAOYSA-N -1 3 265.744 2.552 20 10 CFCDHM COCCN(Cc1cccnc1)Cc1cc(F)ccc1[O-] ZINC000289398920 523760558 /nfs/dbraw/zinc/76/05/58/523760558.db2.gz GCTXUIGVNBDGKJ-UHFFFAOYSA-N -1 3 290.338 2.575 20 10 CFCDHM C[C@H]1CCC[C@H](C)N1C(=O)CN(C)Cc1ccccc1[O-] ZINC000264595687 524183390 /nfs/dbraw/zinc/18/33/90/524183390.db2.gz IEMLMSNLVNCLID-KBPBESRZSA-N -1 3 290.407 2.614 20 10 CFCDHM Cc1cc(CNCc2cc(Cl)c(F)cc2[O-])on1 ZINC000293495458 524759746 /nfs/dbraw/zinc/75/97/46/524759746.db2.gz AZFDPKVZBZQUCK-UHFFFAOYSA-N -1 3 270.691 2.771 20 10 CFCDHM C[C@@H]1CN(C(=O)c2cccc(O)c2[O-])[C@H]2CCCC[C@H]12 ZINC000193158824 524874454 /nfs/dbraw/zinc/87/44/54/524874454.db2.gz IAZJHZVAALKZGK-WZRBSPASSA-N -1 3 275.348 2.749 20 10 CFCDHM C[C@@H]1C[C@H](C)CCN(C(=O)c2cccc(O)c2[O-])C1 ZINC000193146530 525371920 /nfs/dbraw/zinc/37/19/20/525371920.db2.gz ZPAUAKHDBGQIRF-GHMZBOCLSA-N -1 3 263.337 2.606 20 10 CFCDHM Cc1ccc([C@@H](NCc2ccc3c(c2)CCO3)C(=O)[O-])cc1 ZINC000276950943 525774750 /nfs/dbraw/zinc/77/47/50/525774750.db2.gz DUTNGBFHBCJZQA-QGZVFWFLSA-N -1 3 297.354 2.845 20 10 CFCDHM [O-]c1ccc(Cl)cc1CN1CCOC[C@@H]1C1CC1 ZINC000093645478 526347486 /nfs/dbraw/zinc/34/74/86/526347486.db2.gz MVGACAJKCYGKNP-CYBMUJFWSA-N -1 3 267.756 2.656 20 10 CFCDHM Cc1nnc([C@@H](C)N[C@H](C)c2ccccc2[O-])s1 ZINC000274275162 526397028 /nfs/dbraw/zinc/39/70/28/526397028.db2.gz XKENSQJMEMLXIT-RKDXNWHRSA-N -1 3 263.366 2.964 20 10 CFCDHM Cc1nnsc1CNCc1cc(Cl)cc(C)c1[O-] ZINC000292733116 526446877 /nfs/dbraw/zinc/44/68/77/526446877.db2.gz GNZHUGFHIRJXIQ-UHFFFAOYSA-N -1 3 283.784 2.804 20 10 CFCDHM O=C(c1cccc(O)c1[O-])N1CCC[C@@H]1C1CCC1 ZINC000193016562 526772254 /nfs/dbraw/zinc/77/22/54/526772254.db2.gz DPGAISUXKINJSP-GFCCVEGCSA-N -1 3 261.321 2.503 20 10 CFCDHM Cc1cc(F)ccc1CN(C)C(=O)c1cccc(O)c1[O-] ZINC000754698416 574114690 /nfs/dbraw/zinc/11/46/90/574114690.db2.gz HYVSQMMYABRYEY-UHFFFAOYSA-N -1 3 289.306 2.818 20 10 CFCDHM O=C(c1cc([O-])cs1)N(Cc1ccncc1)C1CC1 ZINC000731870816 574131260 /nfs/dbraw/zinc/13/12/60/574131260.db2.gz YEPPNBGUOKSKIU-UHFFFAOYSA-N -1 3 274.345 2.654 20 10 CFCDHM CC(C)N(C(=O)[C@@H](C)OC(=O)c1cc([O-])cs1)C(C)C ZINC000731910212 574133341 /nfs/dbraw/zinc/13/33/41/574133341.db2.gz OUQIIOQYXKVRBD-SNVBAGLBSA-N -1 3 299.392 2.644 20 10 CFCDHM C[C@H](CCc1ccco1)NC(=O)c1cc([O-])cs1 ZINC000732258537 574147588 /nfs/dbraw/zinc/14/75/88/574147588.db2.gz SYGLJOGZBIHSRE-SECBINFHSA-N -1 3 265.334 2.798 20 10 CFCDHM O=C(Nc1nc2c(s1)CCC2)c1cc([O-])cs1 ZINC000732267210 574148115 /nfs/dbraw/zinc/14/81/15/574148115.db2.gz UICBKEOOHBBVJC-UHFFFAOYSA-N -1 3 266.347 2.651 20 10 CFCDHM O=C(Nc1nnc(C(F)(F)F)s1)c1cc([O-])cs1 ZINC000732267570 574148312 /nfs/dbraw/zinc/14/83/12/574148312.db2.gz LBGGCRIYTGHKMP-UHFFFAOYSA-N -1 3 295.267 2.576 20 10 CFCDHM O=C(NCc1ccn(-c2ccccc2)n1)c1cc([O-])cs1 ZINC000732274390 574148866 /nfs/dbraw/zinc/14/88/66/574148866.db2.gz HUXVAYNQWJUORR-UHFFFAOYSA-N -1 3 299.355 2.569 20 10 CFCDHM CN(C(=O)c1cc([O-])cs1)C(C1CC1)C1CC1 ZINC000732279294 574149829 /nfs/dbraw/zinc/14/98/29/574149829.db2.gz HTWMTSXHGGTXJM-UHFFFAOYSA-N -1 3 251.351 2.714 20 10 CFCDHM O=C(N[C@@H]1CCc2c1cccc2O)c1cc([O-])cs1 ZINC000732285543 574149845 /nfs/dbraw/zinc/14/98/45/574149845.db2.gz JGHXVVDOAHXNJB-LLVKDONJSA-N -1 3 275.329 2.577 20 10 CFCDHM C[C@H]1C[C@@H]1c1cc(NC(=O)c2cc([O-])cs2)n[nH]1 ZINC000732280529 574150247 /nfs/dbraw/zinc/15/02/47/574150247.db2.gz KDVPLZAPJYANOP-XPUUQOCRSA-N -1 3 263.322 2.553 20 10 CFCDHM Cc1cc2c[nH]nc2cc1NC(=O)c1cc([O-])cs1 ZINC000732287971 574150586 /nfs/dbraw/zinc/15/05/86/574150586.db2.gz KGGZQIPEXCDPCW-UHFFFAOYSA-N -1 3 273.317 2.891 20 10 CFCDHM O=C(NCc1cc(F)ccc1F)c1cc([O-])cs1 ZINC000732287503 574150759 /nfs/dbraw/zinc/15/07/59/574150759.db2.gz CVSOAIJQPNGQED-UHFFFAOYSA-N -1 3 269.272 2.662 20 10 CFCDHM O=C(OCc1ccc2c(c1)OCCO2)c1cc([O-])cs1 ZINC000732352759 574152840 /nfs/dbraw/zinc/15/28/40/574152840.db2.gz FWRXXMVYZOIOHU-UHFFFAOYSA-N -1 3 292.312 2.582 20 10 CFCDHM Cn1c(COC(=O)c2cc([O-])cs2)nc2ccccc21 ZINC000732353446 574152878 /nfs/dbraw/zinc/15/28/78/574152878.db2.gz PHFHGOIUHITATE-UHFFFAOYSA-N -1 3 288.328 2.697 20 10 CFCDHM Cc1ncc(COC(=O)c2cc([O-])cs2)s1 ZINC000732353455 574153010 /nfs/dbraw/zinc/15/30/10/574153010.db2.gz POFGUYVYVHINSQ-UHFFFAOYSA-N -1 3 255.320 2.576 20 10 CFCDHM C[C@@H](NC(=O)c1cc([O-])cs1)[C@H]1COc2ccccc21 ZINC000755308395 574153528 /nfs/dbraw/zinc/15/35/28/574153528.db2.gz YRCJFNJKQXSPJU-BXKDBHETSA-N -1 3 289.356 2.748 20 10 CFCDHM COc1ccc2ccc([O-])c(CN(C)Cc3cc[nH]n3)c2c1 ZINC000732671714 574165219 /nfs/dbraw/zinc/16/52/19/574165219.db2.gz ZEHLLMUKSYAWCG-UHFFFAOYSA-N -1 3 297.358 2.909 20 10 CFCDHM O=C(OCc1ccc([N+](=O)[O-])cc1F)c1cc([O-])cs1 ZINC000746984810 574174141 /nfs/dbraw/zinc/17/41/41/574174141.db2.gz YNFMNTFMLHBIQO-UHFFFAOYSA-N -1 3 297.263 2.858 20 10 CFCDHM Cc1nc(COC(=O)c2cc([O-])cs2)sc1C ZINC000756411599 574235055 /nfs/dbraw/zinc/23/50/55/574235055.db2.gz SBIRAGJHKPQVLG-UHFFFAOYSA-N -1 3 269.347 2.884 20 10 CFCDHM C[C@H](NCc1ccccc1CO)c1ccc(F)cc1[O-] ZINC000756456133 574238793 /nfs/dbraw/zinc/23/87/93/574238793.db2.gz GIYYBOYZKXLYMY-NSHDSACASA-N -1 3 275.323 2.874 20 10 CFCDHM COC(=O)c1ccc([O-])c([C@H](C)NCc2ccoc2C)c1 ZINC000756483394 574240551 /nfs/dbraw/zinc/24/05/51/574240551.db2.gz QCUDZXGPPHECPD-JTQLQIEISA-N -1 3 289.331 2.931 20 10 CFCDHM O=C(OCCCCCn1cccn1)c1cc([O-])cs1 ZINC000733497395 574242249 /nfs/dbraw/zinc/24/22/49/574242249.db2.gz VFAUFZJIDQYSSC-UHFFFAOYSA-N -1 3 280.349 2.678 20 10 CFCDHM Cc1ccc(C(=O)N[C@@H]2CC[C@H](C)[C@@H](C)C2)c([O-])c1O ZINC000756637934 574254757 /nfs/dbraw/zinc/25/47/57/574254757.db2.gz MJOSIVBUCINWJX-ZMLRMANQSA-N -1 3 277.364 2.961 20 10 CFCDHM Cc1n[nH]cc1CN[C@H](C)c1cc(F)cc(F)c1[O-] ZINC000756740185 574260059 /nfs/dbraw/zinc/26/00/59/574260059.db2.gz QGRRJGWFFDQOII-MRVPVSSYSA-N -1 3 267.279 2.553 20 10 CFCDHM C[C@H](NCc1ncccc1F)c1cc(F)ccc1[O-] ZINC000756771084 574261623 /nfs/dbraw/zinc/26/16/23/574261623.db2.gz ZUMXSGSKHBUNHV-VIFPVBQESA-N -1 3 264.275 2.916 20 10 CFCDHM C[C@@H](NCc1cocn1)c1cc(Br)ccc1[O-] ZINC000756830447 574265893 /nfs/dbraw/zinc/26/58/93/574265893.db2.gz HKGWVBFHEGWGTR-MRVPVSSYSA-N -1 3 297.152 2.994 20 10 CFCDHM C[C@H]1C[C@@H](NCc2cocn2)c2c1c(F)ccc2[O-] ZINC000756829779 574266241 /nfs/dbraw/zinc/26/62/41/574266241.db2.gz BUWXNLAKTVCURM-GZMMTYOYSA-N -1 3 262.284 2.857 20 10 CFCDHM O=C(Nc1ccc(-c2nnco2)cc1)c1cc([O-])cs1 ZINC000740923958 574274180 /nfs/dbraw/zinc/27/41/80/574274180.db2.gz QYOJRABGCOBBGY-UHFFFAOYSA-N -1 3 287.300 2.756 20 10 CFCDHM O=C(NCCCSc1nccs1)c1ccccc1[O-] ZINC000734359035 574284960 /nfs/dbraw/zinc/28/49/60/574284960.db2.gz SKQSSJZUVJWCBO-UHFFFAOYSA-N -1 3 294.401 2.761 20 10 CFCDHM Cc1cnc([C@@H](C)NC(=O)c2cc([O-])cs2)s1 ZINC000750250228 574331750 /nfs/dbraw/zinc/33/17/50/574331750.db2.gz QBOZVUPLEBXYAI-SSDOTTSWSA-N -1 3 268.363 2.710 20 10 CFCDHM CCc1ccc([C@@H](COC)NC(=O)c2cc([O-])cs2)o1 ZINC000743597411 574369125 /nfs/dbraw/zinc/36/91/25/574369125.db2.gz CRWBCSDLGWRDFL-LLVKDONJSA-N -1 3 295.360 2.727 20 10 CFCDHM Cc1ccc(C(=O)N(C)C[C@H]2CC=CCC2)c([O-])c1O ZINC000753105831 574398609 /nfs/dbraw/zinc/39/86/09/574398609.db2.gz MBSFEGODTWCKBC-LBPRGKRZSA-N -1 3 275.348 2.835 20 10 CFCDHM CC(C)(C)[C@@H]1CCN(C(=O)c2cc([O-])cs2)C1 ZINC000753512296 574403578 /nfs/dbraw/zinc/40/35/78/574403578.db2.gz MGTNQGQEMNGATA-SECBINFHSA-N -1 3 253.367 2.962 20 10 CFCDHM C[C@H](CN(C)C(=O)c1cc([O-])cs1)c1nccs1 ZINC000753521821 574403841 /nfs/dbraw/zinc/40/38/41/574403841.db2.gz AYKDEJNLEPGJSU-MRVPVSSYSA-N -1 3 282.390 2.786 20 10 CFCDHM CCC[N@H+](C/C=C(\C)C(=O)[O-])Cc1ccccc1[O-] ZINC000829486309 601161496 /nfs/dbraw/zinc/16/14/96/601161496.db2.gz BMSOLRUKNXVEDP-XYOKQWHBSA-N -1 3 263.337 2.635 20 10 CFCDHM CCC[N@@H+](C/C=C(\C)C(=O)[O-])Cc1ccccc1[O-] ZINC000829486309 601161498 /nfs/dbraw/zinc/16/14/98/601161498.db2.gz BMSOLRUKNXVEDP-XYOKQWHBSA-N -1 3 263.337 2.635 20 10 CFCDHM CC(C)(C(=O)[O-])[C@@H]1CCC[N@H+](Cc2cc(F)ccc2[O-])C1 ZINC000232529999 605547950 /nfs/dbraw/zinc/54/79/50/605547950.db2.gz HUEYTLJJJDSGMS-GFCCVEGCSA-N -1 3 295.354 2.854 20 10 CFCDHM CC(C)(C(=O)[O-])[C@@H]1CCC[N@@H+](Cc2cc(F)ccc2[O-])C1 ZINC000232529999 605547952 /nfs/dbraw/zinc/54/79/52/605547952.db2.gz HUEYTLJJJDSGMS-GFCCVEGCSA-N -1 3 295.354 2.854 20 10 CFCDHM CCOC(=O)CC(C)(C)CC(=O)C(=O)c1cccc([O-])c1 ZINC000935946963 649964835 /nfs/dbraw/zinc/96/48/35/649964835.db2.gz QHYMPZUYEXXMSD-UHFFFAOYSA-N -1 3 292.331 2.514 20 10 CFCDHM CC(C)(C)N1CC[C@@H]1C(=O)NCc1cccc(Cl)c1[O-] ZINC000890761486 617841338 /nfs/dbraw/zinc/84/13/38/617841338.db2.gz TXRQJLLURWXXMV-GFCCVEGCSA-N -1 3 296.798 2.535 20 10 CFCDHM C[C@H]1CSCCN1Cc1cc(F)cc(F)c1[O-] ZINC000894028167 618281169 /nfs/dbraw/zinc/28/11/69/618281169.db2.gz WLJUAIIUWYFLEI-QMMMGPOBSA-N -1 3 259.321 2.608 20 10 CFCDHM [O-]c1c(F)cc(F)cc1CN1CC(Cc2ccco2)C1 ZINC000895393436 618565360 /nfs/dbraw/zinc/56/53/60/618565360.db2.gz JQCRQWPMUDSLSK-UHFFFAOYSA-N -1 3 279.286 2.938 20 10 CFCDHM O=[N+]([O-])c1cc(Cl)cc(CN2CC[C@@H](CF)C2)c1[O-] ZINC000895572383 619556874 /nfs/dbraw/zinc/55/68/74/619556874.db2.gz CQSWNYYNXBMOFC-QMMMGPOBSA-N -1 3 288.706 2.745 20 10 CFCDHM CCn1c(C)nc([N+](=O)[O-])c1NCc1c([O-])cccc1F ZINC000895832174 619619258 /nfs/dbraw/zinc/61/92/58/619619258.db2.gz DBLPFMKAOJQEFN-UHFFFAOYSA-N -1 3 294.286 2.576 20 10 CFCDHM C[C@H]1CCN(Cc2c([O-])ccc(Cl)c2F)CCO1 ZINC000896584273 619767625 /nfs/dbraw/zinc/76/76/25/619767625.db2.gz NEHRMMYSWUXCSD-VIFPVBQESA-N -1 3 273.735 2.796 20 10 CFCDHM CCOc1cncc(CNCc2c([O-])cccc2F)c1 ZINC000896642332 619777478 /nfs/dbraw/zinc/77/74/78/619777478.db2.gz PXVCPCZIPNPJJW-UHFFFAOYSA-N -1 3 276.311 2.615 20 10 CFCDHM [O-]c1cccc(F)c1CNCc1cnn(C2CCC2)c1 ZINC000896638597 619780963 /nfs/dbraw/zinc/78/09/63/619780963.db2.gz JWEYZMLZKGWTSW-UHFFFAOYSA-N -1 3 275.327 2.743 20 10 CFCDHM CCc1ncc(CNCc2c([O-])cccc2F)s1 ZINC000896639211 619780985 /nfs/dbraw/zinc/78/09/85/619780985.db2.gz BBZHTVIQMQOUTO-UHFFFAOYSA-N -1 3 266.341 2.840 20 10 CFCDHM CCc1[nH]nc(Cl)c1CNCc1c([O-])cccc1F ZINC000896642081 619781975 /nfs/dbraw/zinc/78/19/75/619781975.db2.gz PSGZACWMPRYINZ-UHFFFAOYSA-N -1 3 283.734 2.760 20 10 CFCDHM CCCc1[nH]ccc1C(=O)NCc1c([O-])cccc1F ZINC000928705605 619995146 /nfs/dbraw/zinc/99/51/46/619995146.db2.gz KFKKNOGKOJKMGR-UHFFFAOYSA-N -1 3 276.311 2.742 20 10 CFCDHM C[C@H](C(=O)NCc1c([O-])cccc1F)C(C)(C)C ZINC000928705462 619995189 /nfs/dbraw/zinc/99/51/89/619995189.db2.gz KKLJXEGECSJWRZ-SECBINFHSA-N -1 3 253.317 2.830 20 10 CFCDHM CCc1onc(C)c1CNCc1ccc(F)c(F)c1[O-] ZINC000897336254 619999423 /nfs/dbraw/zinc/99/94/23/619999423.db2.gz ALAFPSQBCNIPGV-UHFFFAOYSA-N -1 3 282.290 2.819 20 10 CFCDHM CC[C@@H](NCc1csc(N)n1)c1ccc(F)cc1[O-] ZINC000902499062 621105529 /nfs/dbraw/zinc/10/55/29/621105529.db2.gz KLEOEHAQQDJANW-LLVKDONJSA-N -1 3 281.356 2.811 20 10 CFCDHM C[C@H](NCc1cnn(CCF)c1)c1c([O-])cccc1F ZINC000903273584 621309224 /nfs/dbraw/zinc/30/92/24/621309224.db2.gz BJZRMMVAEKVIOB-JTQLQIEISA-N -1 3 281.306 2.548 20 10 CFCDHM Cc1cc([O-])c(CN2C[C@@H](C)O[C@H](C)C2)cc1Cl ZINC000824474846 623511022 /nfs/dbraw/zinc/51/10/22/623511022.db2.gz UQXLCCDFBCOUTI-GHMZBOCLSA-N -1 3 269.772 2.963 20 10 CFCDHM C[C@@H]1[C@H](C)OCCN1Cc1cc(Cl)ccc1[O-] ZINC000093418109 623713791 /nfs/dbraw/zinc/71/37/91/623713791.db2.gz NWHOMKMZDSJMOJ-ZJUUUORDSA-N -1 3 255.745 2.655 20 10 CFCDHM C[C@H]1CCC[C@H](NC(=O)NCc2c([O-])cccc2F)C1 ZINC000914201045 623733586 /nfs/dbraw/zinc/73/35/86/623733586.db2.gz VNIDJDDAROZLID-QWRGUYRKSA-N -1 3 280.343 2.909 20 10 CFCDHM C[C@@H]1CN(Cc2c([O-])ccc(Cl)c2F)C[C@@H](C)C1O ZINC000827151409 623953993 /nfs/dbraw/zinc/95/39/93/623953993.db2.gz AGXLMAONTFMDEX-RKDXNWHRSA-N -1 3 287.762 2.633 20 10 CFCDHM CCS[C@H]1CCCC[C@H]1NC(=O)c1cccc(O)c1[O-] ZINC000185807927 625779887 /nfs/dbraw/zinc/77/98/87/625779887.db2.gz LPLGFLCPIKRFFX-YPMHNXCESA-N -1 3 295.404 2.892 20 10 CFCDHM CC(C)[C@@]1(C)C[C@@H]1NC(=O)NCc1c([O-])cccc1F ZINC000922849504 626381599 /nfs/dbraw/zinc/38/15/99/626381599.db2.gz KWTFQTXDBVJUNN-DZGCQCFKSA-N -1 3 280.343 2.765 20 10 CFCDHM Cc1nc2ccc(NC(=O)c3cccc(O)c3[O-])cc2o1 ZINC000186876285 626401760 /nfs/dbraw/zinc/40/17/60/626401760.db2.gz FBRBGYYPZCHYEI-UHFFFAOYSA-N -1 3 284.271 2.800 20 10 CFCDHM O=C(N[C@H]1CCc2cc(F)ccc21)c1cccc(O)c1[O-] ZINC000187010821 626411447 /nfs/dbraw/zinc/41/14/47/626411447.db2.gz WUPSVMKKXANWMW-ZDUSSCGKSA-N -1 3 287.290 2.654 20 10 CFCDHM Cc1ncc(CNCc2cc(Cl)c(F)cc2[O-])o1 ZINC000839169328 626529232 /nfs/dbraw/zinc/52/92/32/626529232.db2.gz HIRXMONOCXDKRX-UHFFFAOYSA-N -1 3 270.691 2.771 20 10 CFCDHM Cc1cccc2c1CN(C(=O)c1cccc(O)c1[O-])CC2 ZINC000760665651 626761869 /nfs/dbraw/zinc/76/18/69/626761869.db2.gz HXQMCIDMEGYWQP-UHFFFAOYSA-N -1 3 283.327 2.605 20 10 CFCDHM [O-]c1c(F)cc(Cl)cc1CN[C@H](CCO)c1ccco1 ZINC000769557540 627455668 /nfs/dbraw/zinc/45/56/68/627455668.db2.gz SFXVOQXOIATXLY-GFCCVEGCSA-N -1 3 299.729 2.991 20 10 CFCDHM COC(=O)[C@H]1C[C@H](C)CCN1Cc1cc(Cl)ccc1[O-] ZINC000776003433 628093198 /nfs/dbraw/zinc/09/31/98/628093198.db2.gz WRTGBWKATGPFDZ-ZWNOBZJWSA-N -1 3 297.782 2.819 20 10 CFCDHM C[C@H]1CN(Cc2cc(F)ccc2[O-])C[C@@H](C(F)(F)F)O1 ZINC000779023627 628347056 /nfs/dbraw/zinc/34/70/56/628347056.db2.gz UZLXKKHHALORAQ-UFBFGSQYSA-N -1 3 293.260 2.683 20 10 CFCDHM CC[C@@H](NCc1cc(F)ccc1[O-])C(=O)OC(C)(C)C ZINC000779127411 628354404 /nfs/dbraw/zinc/35/44/04/628354404.db2.gz ZEULYATZUYXNSH-GFCCVEGCSA-N -1 3 283.343 2.741 20 10 CFCDHM Cc1cc(Br)c([O-])c(CNc2ncccn2)c1 ZINC000783625833 628728243 /nfs/dbraw/zinc/72/82/43/628728243.db2.gz GEPZAMLRACMUKO-UHFFFAOYSA-N -1 3 294.152 2.865 20 10 CFCDHM [O-]c1c(Cl)cc(Cl)cc1CN1C[C@@H]2C[C@]2(CO)C1 ZINC000783742739 628740571 /nfs/dbraw/zinc/74/05/71/628740571.db2.gz OUVMGBGMFSHWKQ-TVQRCGJNSA-N -1 3 288.174 2.513 20 10 CFCDHM O=C(Nc1cc(-c2ccccc2)[nH]n1)c1cccc(O)c1[O-] ZINC000790539282 629246602 /nfs/dbraw/zinc/24/66/02/629246602.db2.gz OVDGLKZRLGNDDC-UHFFFAOYSA-N -1 3 295.298 2.740 20 10 CFCDHM O=C(c1cccc(O)c1[O-])N1CCC(c2cccnc2)CC1 ZINC000790911108 629271339 /nfs/dbraw/zinc/27/13/39/629271339.db2.gz LCTUGBUXLPKBGF-UHFFFAOYSA-N -1 3 298.342 2.513 20 10 CFCDHM CCn1cc(CNCc2c([O-])ccc(Cl)c2F)cn1 ZINC000790968179 629275359 /nfs/dbraw/zinc/27/53/59/629275359.db2.gz RSULKFSHVJEQCA-UHFFFAOYSA-N -1 3 283.734 2.691 20 10 CFCDHM Cc1cc2n[nH]cc2cc1NC(=O)c1cccc(O)c1[O-] ZINC000791056501 629284738 /nfs/dbraw/zinc/28/47/38/629284738.db2.gz YGOCLIOFFJPNPD-UHFFFAOYSA-N -1 3 283.287 2.535 20 10 CFCDHM CN(CCc1cnccn1)Cc1c([O-])ccc(Cl)c1F ZINC000792173905 629405450 /nfs/dbraw/zinc/40/54/50/629405450.db2.gz LNTBAVLPHSDBJL-UHFFFAOYSA-N -1 3 295.745 2.649 20 10 CFCDHM CC[C@]1(O)CCN(Cc2c([O-])ccc(Cl)c2F)C1 ZINC000792179766 629406736 /nfs/dbraw/zinc/40/67/36/629406736.db2.gz MQFCNESJDVKRNT-ZDUSSCGKSA-N -1 3 273.735 2.532 20 10 CFCDHM CCN(Cc1occc1C)C(=O)c1cccc(O)c1[O-] ZINC000839885013 630329216 /nfs/dbraw/zinc/32/92/16/630329216.db2.gz UKEGQJRQPYPAIP-UHFFFAOYSA-N -1 3 275.304 2.662 20 10 CFCDHM O=C(NCCc1ccc2[nH]ccc2c1)c1cccc(O)c1[O-] ZINC000799791599 630344368 /nfs/dbraw/zinc/34/43/68/630344368.db2.gz JMWYGFNLUPHFTH-UHFFFAOYSA-N -1 3 296.326 2.552 20 10 CFCDHM Cc1cc(N(C)C)ccc1C[C@@H](C)[N-]C(=O)C(F)(F)F ZINC000839918151 630400978 /nfs/dbraw/zinc/40/09/78/630400978.db2.gz JZSMGUBHBWRQDD-SNVBAGLBSA-N -1 3 288.313 2.671 20 10 CFCDHM CCN1CCN(Cc2c([O-])ccc(Cl)c2F)[C@@H](C)C1 ZINC000809697838 631266377 /nfs/dbraw/zinc/26/63/77/631266377.db2.gz PSTOFDNWGUTLRV-JTQLQIEISA-N -1 3 286.778 2.711 20 10 CFCDHM C[C@@H]1CO[C@@H](C(F)(F)F)CN1Cc1cc(F)ccc1[O-] ZINC000809696124 631267100 /nfs/dbraw/zinc/26/71/00/631267100.db2.gz CLWSJIFBPLUODX-PRHODGIISA-N -1 3 293.260 2.683 20 10 CFCDHM COC[C@H]1CN(Cc2c([O-])cc(C)cc2Cl)C[C@H](C)O1 ZINC000840940412 631272091 /nfs/dbraw/zinc/27/20/91/631272091.db2.gz YRBHYUGIGFMSGC-NWDGAFQWSA-N -1 3 299.798 2.590 20 10 CFCDHM O=C([O-])CC[C@H](Cc1ccccc1)[NH2+]Cc1ccccc1[O-] ZINC000840998447 631297768 /nfs/dbraw/zinc/29/77/68/631297768.db2.gz HUVDMRMSGSWETE-MRXNPFEDSA-N -1 3 299.370 2.958 20 10 CFCDHM Cc1cc(Cl)cc(C[NH2+][C@@H](CC(C)C)C(=O)[O-])c1[O-] ZINC000840997163 631298416 /nfs/dbraw/zinc/29/84/16/631298416.db2.gz JXWCELROYBMQFU-LBPRGKRZSA-N -1 3 285.771 2.943 20 10 CFCDHM C[C@H](NCc1cocn1)c1ccc(Cl)cc1[O-] ZINC000841750240 631464621 /nfs/dbraw/zinc/46/46/21/631464621.db2.gz NNVOGFRMPRKTEN-QMMMGPOBSA-N -1 3 252.701 2.884 20 10 CFCDHM [O-]c1ccc(F)cc1CN1CCc2cc(Cl)nnc2C1 ZINC000843419149 631950343 /nfs/dbraw/zinc/95/03/43/631950343.db2.gz VEDNKTFQYGKZSH-UHFFFAOYSA-N -1 3 293.729 2.533 20 10 CFCDHM O=C1CN(Cc2ccc3ccccc3c2[O-])CN1CC1CC1 ZINC000816594485 632492142 /nfs/dbraw/zinc/49/21/42/632492142.db2.gz FMGYCNQOWYUJJF-UHFFFAOYSA-N -1 3 296.370 2.557 20 10 CFCDHM C[C@@H]1CC[C@@H](O)CN1Cc1cc(Cl)cc(F)c1[O-] ZINC000817414557 632625517 /nfs/dbraw/zinc/62/55/17/632625517.db2.gz LLEMKXQIXHHPJU-LDYMZIIASA-N -1 3 273.735 2.530 20 10 CFCDHM O=C(c1cccc(O)c1[O-])N1CCc2c1c(F)ccc2F ZINC000817821328 632714122 /nfs/dbraw/zinc/71/41/22/632714122.db2.gz RWZREXFUTSAQEG-UHFFFAOYSA-N -1 3 291.253 2.579 20 10 CFCDHM Cc1cc(Cl)cc(C[N@H+]2C[C@H](C(=O)[O-])C[C@H](C)C2)c1[O-] ZINC000817881160 632717657 /nfs/dbraw/zinc/71/76/57/632717657.db2.gz GSWBCWHDKDOHHR-JOYOIKCWSA-N -1 3 297.782 2.897 20 10 CFCDHM Cc1cc(Cl)cc(C[N@@H+]2C[C@H](C(=O)[O-])C[C@H](C)C2)c1[O-] ZINC000817881160 632717659 /nfs/dbraw/zinc/71/76/59/632717659.db2.gz GSWBCWHDKDOHHR-JOYOIKCWSA-N -1 3 297.782 2.897 20 10 CFCDHM Cn1c(NCc2c([O-])cccc2Cl)nnc1C1CC1 ZINC000849347067 633624911 /nfs/dbraw/zinc/62/49/11/633624911.db2.gz PKXQXKCORBNFGA-UHFFFAOYSA-N -1 3 278.743 2.664 20 10 CFCDHM C[C@H](NCc1c([O-])ccc(Cl)c1F)c1nccn1C ZINC000850410012 633981814 /nfs/dbraw/zinc/98/18/14/633981814.db2.gz LOSQBQXKAXEXPF-QMMMGPOBSA-N -1 3 283.734 2.769 20 10 CFCDHM COc1ccnc(CN[C@H](C)c2ccc(F)cc2[O-])c1F ZINC000850536062 634041314 /nfs/dbraw/zinc/04/13/14/634041314.db2.gz BDEGZFKCAMVBQK-SECBINFHSA-N -1 3 294.301 2.925 20 10 CFCDHM CCC1(CC)CN(Cc2cc(F)ccc2[O-])CC[S@]1=O ZINC000187554884 650258316 /nfs/dbraw/zinc/25/83/16/650258316.db2.gz NXVSSCPEBNZHPM-HXUWFJFHSA-N -1 3 299.411 2.654 20 10 CFCDHM CN(Cc1cc[nH]n1)Cc1c([O-])cccc1Br ZINC000862242520 637296870 /nfs/dbraw/zinc/29/68/70/637296870.db2.gz IKALUBOJKTZXII-UHFFFAOYSA-N -1 3 296.168 2.510 20 10 CFCDHM CC(C)(NC(=O)c1cccc(O)c1[O-])c1ccc(F)cc1 ZINC000188409715 650328609 /nfs/dbraw/zinc/32/86/09/650328609.db2.gz JGEBJUIVLBBZJS-UHFFFAOYSA-N -1 3 289.306 2.902 20 10 CFCDHM [O-]c1cccc(Cl)c1CNc1ccn(CCF)n1 ZINC000865837282 638602497 /nfs/dbraw/zinc/60/24/97/638602497.db2.gz JYMKQYCERRWWGK-UHFFFAOYSA-N -1 3 269.707 2.824 20 10 CFCDHM O=C(NCc1c([O-])cccc1F)N[C@@H]1CCCC[C@@H]1F ZINC000923620481 639693652 /nfs/dbraw/zinc/69/36/52/639693652.db2.gz UMRHHZNUZGMYRT-NWDGAFQWSA-N -1 3 284.306 2.611 20 10 CFCDHM O=C(Nc1ccc2c(c1)CCCO2)c1cccc(O)c1[O-] ZINC000193001166 650614933 /nfs/dbraw/zinc/61/49/33/650614933.db2.gz OVEOVDWZCNDQPP-UHFFFAOYSA-N -1 3 285.299 2.675 20 10 CFCDHM COc1cccc2c1CC[C@@H]2NC(=O)c1cccc(O)c1[O-] ZINC000193133759 650625612 /nfs/dbraw/zinc/62/56/12/650625612.db2.gz WDYSKUUIRYBWIT-ZDUSSCGKSA-N -1 3 299.326 2.524 20 10 CFCDHM COc1cccc(C[N@@H+]2CCCC[C@@H]2CCC(=O)[O-])c1[O-] ZINC000086755088 650797392 /nfs/dbraw/zinc/79/73/92/650797392.db2.gz CYSWTJHTVRZTRW-CYBMUJFWSA-N -1 3 293.363 2.620 20 10 CFCDHM COc1cccc(C[N@H+]2CCCC[C@@H]2CCC(=O)[O-])c1[O-] ZINC000086755088 650797394 /nfs/dbraw/zinc/79/73/94/650797394.db2.gz CYSWTJHTVRZTRW-CYBMUJFWSA-N -1 3 293.363 2.620 20 10 CFCDHM [O-]c1c(CN[C@@H]2CCCc3c[nH]nc32)ccc(F)c1F ZINC000877110532 643156404 /nfs/dbraw/zinc/15/64/04/643156404.db2.gz XTYQGUHCVPDPIX-LLVKDONJSA-N -1 3 279.290 2.561 20 10 CFCDHM O=C(c1cccc(O)c1[O-])N1CCCc2ccccc2C1 ZINC000126401470 643205479 /nfs/dbraw/zinc/20/54/79/643205479.db2.gz MYELNUPUVBOSNS-UHFFFAOYSA-N -1 3 283.327 2.686 20 10 CFCDHM C[C@H](CNC(=O)c1cccc(O)c1[O-])C(C)(C)C ZINC000126520753 643277457 /nfs/dbraw/zinc/27/74/57/643277457.db2.gz JIOJJZUYTAOZIE-SECBINFHSA-N -1 3 251.326 2.510 20 10 CFCDHM CN(Cc1ccc(F)c(F)c1[O-])[C@H](CO)c1ccccc1 ZINC000877563081 643362498 /nfs/dbraw/zinc/36/24/98/643362498.db2.gz GVGJGLSCKAWEAL-CQSZACIVSA-N -1 3 293.313 2.836 20 10 CFCDHM O=c1[nH]c2ccc(NCc3c([O-])cccc3Cl)cc2[nH]1 ZINC000127238930 643953561 /nfs/dbraw/zinc/95/35/61/643953561.db2.gz DJUXBPQZXYRORQ-UHFFFAOYSA-N -1 3 289.722 2.827 20 10 CFCDHM C[C@@H]1CCC[C@H](NC(=O)c2cccc(O)c2[O-])[C@H]1C ZINC000249372840 650958812 /nfs/dbraw/zinc/95/88/12/650958812.db2.gz XGRQYSNGAIQJGE-SCVCMEIPSA-N -1 3 263.337 2.652 20 10 CFCDHM Cc1noc(C)c1CN[C@@H](C)c1c([O-])cccc1F ZINC000886512235 647024105 /nfs/dbraw/zinc/02/41/05/647024105.db2.gz AAIAPISTHFXIJQ-VIFPVBQESA-N -1 3 264.300 2.987 20 10 CFCDHM CCc1nnc([C@H](C)N[C@H](C)c2c([O-])cccc2F)[nH]1 ZINC000886558671 647046214 /nfs/dbraw/zinc/04/62/14/647046214.db2.gz PIIQBCAHVDRQNB-BDAKNGLRSA-N -1 3 278.331 2.624 20 10 CFCDHM C[C@H](N[C@H](CO)c1ccsc1)c1c([O-])cccc1F ZINC000886591722 647057266 /nfs/dbraw/zinc/05/72/66/647057266.db2.gz AEKKSRPHNZQWMQ-JOYOIKCWSA-N -1 3 281.352 2.977 20 10 CFCDHM COc1ccncc1CN[C@@H](C)c1c([O-])cccc1F ZINC000886613778 647067780 /nfs/dbraw/zinc/06/77/80/647067780.db2.gz FAHSPGVKSRCGFR-JTQLQIEISA-N -1 3 276.311 2.786 20 10 CFCDHM C[C@@H](N[C@@H]1CCN(C(C)(C)C)C1=O)c1c([O-])cccc1F ZINC000886629946 647077461 /nfs/dbraw/zinc/07/74/61/647077461.db2.gz QWOMDTWDHHXYES-ZYHUDNBSSA-N -1 3 294.370 2.581 20 10 CFCDHM CC(F)(F)CCC(=O)NCc1c([O-])cccc1F ZINC000928712356 648942238 /nfs/dbraw/zinc/94/22/38/648942238.db2.gz SAYPIHQCOASWFG-UHFFFAOYSA-N -1 3 261.243 2.583 20 10 CFCDHM CC(C)CCSCC(=O)NCc1c([O-])cccc1F ZINC000928712354 648942590 /nfs/dbraw/zinc/94/25/90/648942590.db2.gz SAJWHRJABNKICW-UHFFFAOYSA-N -1 3 285.384 2.927 20 10 CFCDHM O=C(NCc1c([O-])cccc1F)[C@H]1CC12CCSCC2 ZINC000928706299 648944775 /nfs/dbraw/zinc/94/47/75/648944775.db2.gz QMVCUZIODZLZLF-LLVKDONJSA-N -1 3 295.379 2.681 20 10 CFCDHM CCCc1nc(C)c(C(=O)NCc2c([O-])cccc2F)o1 ZINC000928706021 648945013 /nfs/dbraw/zinc/94/50/13/648945013.db2.gz NSACLXJQCBDBBV-UHFFFAOYSA-N -1 3 292.310 2.710 20 10 CFCDHM CCC[C@H]1C[C@H](C(=O)NCc2c([O-])cccc2F)CCO1 ZINC000928709194 648945928 /nfs/dbraw/zinc/94/59/28/648945928.db2.gz YEUNSJMLYVCJTE-NEPJUHHUSA-N -1 3 295.354 2.743 20 10 CFCDHM CC(C)c1[nH]ccc1C(=O)NCc1c([O-])cccc1F ZINC000928709217 648945962 /nfs/dbraw/zinc/94/59/62/648945962.db2.gz YVMSVXYPJAIRIS-UHFFFAOYSA-N -1 3 276.311 2.913 20 10 CFCDHM O=C(C[C@H]1C=CCCC1)NCc1c([O-])cccc1F ZINC000928708694 648946205 /nfs/dbraw/zinc/94/62/05/648946205.db2.gz QMVDPYPQLPJUGJ-NSHDSACASA-N -1 3 263.312 2.894 20 10 CFCDHM O=C(c1cccc(O)c1[O-])N1CCC[C@@H](C2CCC2)C1 ZINC000692936489 769831567 /nfs/dbraw/zinc/83/15/67/769831567.db2.gz YBPLMGOZVLFVRV-GFCCVEGCSA-N -1 3 275.348 2.750 20 10 CFCDHM [O-]c1cccc(Cl)c1CN1CCc2ncccc2C1 ZINC001140341541 770528630 /nfs/dbraw/zinc/52/86/30/770528630.db2.gz VBQPBTIHSBZEJZ-UHFFFAOYSA-N -1 3 274.751 2.999 20 10 CFCDHM [O-]c1cccc(Br)c1CNCc1nccs1 ZINC000706869098 770537058 /nfs/dbraw/zinc/53/70/58/770537058.db2.gz ZVSCTDFTIPRNPA-UHFFFAOYSA-N -1 3 299.193 2.901 20 10 CFCDHM CO[C@H]1CC[C@H](C)N(Cc2ccc(F)c(F)c2[O-])C1 ZINC000687215080 776575330 /nfs/dbraw/zinc/57/53/30/776575330.db2.gz RADOTWZUFPFMNA-ONGXEEELSA-N -1 3 271.307 2.670 20 10 CFCDHM O=C([O-])c1ccc([O-])c(C[NH+]2CCC3(CCC3)CC2)c1 ZINC001231560267 777258769 /nfs/dbraw/zinc/25/87/69/777258769.db2.gz DUKYZJQVEQJWPB-UHFFFAOYSA-N -1 3 275.348 2.857 20 10 CFCDHM C[C@H]1CCC[N@H+](Cc2cc(C(=O)[O-])ccc2[O-])CC1 ZINC001231561331 777259720 /nfs/dbraw/zinc/25/97/20/777259720.db2.gz SBDCFVPXAXUIAX-NSHDSACASA-N -1 3 263.337 2.712 20 10 CFCDHM C[C@H]1CCC[N@@H+](Cc2cc(C(=O)[O-])ccc2[O-])CC1 ZINC001231561331 777259729 /nfs/dbraw/zinc/25/97/29/777259729.db2.gz SBDCFVPXAXUIAX-NSHDSACASA-N -1 3 263.337 2.712 20 10 CFCDHM C[C@@H]1CCCC[N@H+](Cc2cc(C(=O)[O-])ccc2[O-])C1 ZINC001231560750 777260104 /nfs/dbraw/zinc/26/01/04/777260104.db2.gz LMRLCTFNEDOSNQ-LLVKDONJSA-N -1 3 263.337 2.712 20 10 CFCDHM C[C@@H]1CCCC[N@@H+](Cc2cc(C(=O)[O-])ccc2[O-])C1 ZINC001231560750 777260112 /nfs/dbraw/zinc/26/01/12/777260112.db2.gz LMRLCTFNEDOSNQ-LLVKDONJSA-N -1 3 263.337 2.712 20 10 CFCDHM CCN(Cc1cccnc1)Cc1cc(C(=O)[O-])ccc1O ZINC001231565290 777261803 /nfs/dbraw/zinc/26/18/03/777261803.db2.gz RNWIDOIBCVHLOE-UHFFFAOYSA-N -1 3 286.331 2.508 20 10 CFCDHM [O-]c1cc(O)c(CN2CCC[C@H](F)C2)cc1Cl ZINC001232261381 777496694 /nfs/dbraw/zinc/49/66/94/777496694.db2.gz FTJICKMTHREABQ-VIFPVBQESA-N -1 3 259.708 2.685 20 10 CFCDHM CC1(F)CCN(Cc2c([O-])ccc(F)c2F)CC1 ZINC001233331798 777890612 /nfs/dbraw/zinc/89/06/12/777890612.db2.gz LKYSSSSXDMSFSB-UHFFFAOYSA-N -1 3 259.271 2.994 20 10 CFCDHM CCCO[C@@H]1CCN(Cc2c([O-])ccc(F)c2F)C1 ZINC001233334537 777891970 /nfs/dbraw/zinc/89/19/70/777891970.db2.gz LARYLRUFQLUJQG-SNVBAGLBSA-N -1 3 271.307 2.671 20 10 CFCDHM [O-]c1ccc(F)c(F)c1CN1CC[C@@]2(CC2(F)F)C1 ZINC001233335015 777894207 /nfs/dbraw/zinc/89/42/07/777894207.db2.gz DMFRCTGTYNPWLQ-GFCCVEGCSA-N -1 3 275.245 2.902 20 10 CFCDHM [O-]c1ccc(F)c(F)c1CN(CCO)Cc1cccs1 ZINC001233334644 777894559 /nfs/dbraw/zinc/89/45/59/777894559.db2.gz OMQBOVIGMFQWBB-UHFFFAOYSA-N -1 3 299.342 2.726 20 10 CFCDHM [O-]c1ccc(F)c(F)c1CN1CCC(n2cccn2)CC1 ZINC001233335606 777896274 /nfs/dbraw/zinc/89/62/74/777896274.db2.gz CWHPTABDNDKBTK-UHFFFAOYSA-N -1 3 293.317 2.704 20 10 CFCDHM CN(Cc1cnccn1)Cc1cccc(C(F)(F)F)c1[O-] ZINC001233418489 777943596 /nfs/dbraw/zinc/94/35/96/777943596.db2.gz JEVPGSSEUQUSDJ-UHFFFAOYSA-N -1 3 297.280 2.833 20 10 CFCDHM CCOC1CCN(Cc2cc(F)c(F)cc2[O-])CC1 ZINC001142520687 778399107 /nfs/dbraw/zinc/39/91/07/778399107.db2.gz NUSDNIQJIWFXGO-UHFFFAOYSA-N -1 3 271.307 2.671 20 10 CFCDHM CC[C@@]12C[C@@H](CO1)N(Cc1c([O-])cc(OC)cc1Cl)C2 ZINC001236808339 778948340 /nfs/dbraw/zinc/94/83/40/778948340.db2.gz NUILYGDBCSOWAL-BONVTDFDSA-N -1 3 297.782 2.808 20 10 CFCDHM [O-]c1c(F)cc(Cl)cc1CN1CCC[C@]2(CCO2)C1 ZINC001237622312 779145792 /nfs/dbraw/zinc/14/57/92/779145792.db2.gz QAUAEBRBJJECTB-AWEZNQCLSA-N -1 3 285.746 2.940 20 10 CFCDHM CN1CCN(Cc2cc(Cl)cc(F)c2[O-])CC1(C)C ZINC001237622008 779145986 /nfs/dbraw/zinc/14/59/86/779145986.db2.gz LGNVLJZFKGSQJC-UHFFFAOYSA-N -1 3 286.778 2.711 20 10 CFCDHM C[C@H]1CCCN(Cc2cc(Cl)cc(F)c2[O-])[C@H]1CO ZINC001237618400 779146369 /nfs/dbraw/zinc/14/63/69/779146369.db2.gz ZSLDZUHZBBYQLE-ZANVPECISA-N -1 3 287.762 2.778 20 10 CFCDHM CCC1(O)CCN(Cc2cc(F)cc(Cl)c2[O-])CC1 ZINC001237798234 779179858 /nfs/dbraw/zinc/17/98/58/779179858.db2.gz BRWVVKDYROJESZ-UHFFFAOYSA-N -1 3 287.762 2.922 20 10 CFCDHM C[C@H]1C[C@H](O)CCN1Cc1cc(F)cc(Cl)c1[O-] ZINC001237799625 779181885 /nfs/dbraw/zinc/18/18/85/779181885.db2.gz SHSUEWOEUWLCEA-GZMMTYOYSA-N -1 3 273.735 2.530 20 10 CFCDHM [O-]c1cc(Cl)c(F)cc1CN1CC[C@]2(CCCO2)C1 ZINC001237935278 779211727 /nfs/dbraw/zinc/21/17/27/779211727.db2.gz UODYIUHZGBCZFU-CQSZACIVSA-N -1 3 285.746 2.940 20 10 CFCDHM CN(Cc1ccncn1)Cc1cc(F)c(Cl)cc1[O-] ZINC001237943609 779213528 /nfs/dbraw/zinc/21/35/28/779213528.db2.gz NSOWZSHBXQARSS-UHFFFAOYSA-N -1 3 281.718 2.607 20 10 CFCDHM [O-]c1cc(Cl)c(F)cc1CN1CCC[C@@]12CCOC2 ZINC001237949417 779214738 /nfs/dbraw/zinc/21/47/38/779214738.db2.gz LLAJJJVGENSHBG-AWEZNQCLSA-N -1 3 285.746 2.940 20 10 CFCDHM [O-]c1cc(Br)ccc1CN1CCC(F)(F)C1 ZINC000691680169 779505999 /nfs/dbraw/zinc/50/59/99/779505999.db2.gz TUFRWTSHBKOSSK-UHFFFAOYSA-N -1 3 292.123 2.996 20 10 CFCDHM Cc1noc(C)c1CNCc1ccc(F)c(F)c1[O-] ZINC000703230375 780999691 /nfs/dbraw/zinc/99/96/91/780999691.db2.gz RHZJVQDEQMTPOS-UHFFFAOYSA-N -1 3 268.263 2.565 20 10 CFCDHM CCc1nc(C)c(CNCc2ccc(F)c(F)c2[O-])o1 ZINC000703340001 781008531 /nfs/dbraw/zinc/00/85/31/781008531.db2.gz HHJTVNJMLXKHMX-UHFFFAOYSA-N -1 3 282.290 2.819 20 10 CFCDHM CO[C@@H]1CN(Cc2ccc(F)c(F)c2[O-])CC[C@H]1C ZINC000703532158 781026436 /nfs/dbraw/zinc/02/64/36/781026436.db2.gz SWOFZNVIUDDPSP-BXKDBHETSA-N -1 3 271.307 2.527 20 10 CFCDHM C[C@]12CCCC[C@H]1CN2C(=O)c1cccc(O)c1[O-] ZINC000707195764 781230712 /nfs/dbraw/zinc/23/07/12/781230712.db2.gz DNAVTQZRMVXZGX-BONVTDFDSA-N -1 3 261.321 2.503 20 10 CFCDHM [O-]c1c(Cl)cc(Cl)cc1CN1CCC[C@H]1CO ZINC000092455823 347625545 /nfs/dbraw/zinc/62/55/45/347625545.db2.gz DSNAVUOCTMDEEH-JTQLQIEISA-N -1 3 276.163 2.656 20 10 CFCDHM C[C@H](NC[C@H](O)C(F)(F)F)c1cc(Cl)ccc1[O-] ZINC000273441278 299314731 /nfs/dbraw/zinc/31/47/31/299314731.db2.gz YMEXFXZYIQJDRD-WKEGUHRASA-N -1 3 283.677 2.619 20 10 CFCDHM C[C@@H](NCc1nncn1C)c1ccc2ccccc2c1[O-] ZINC000038007516 372761196 /nfs/dbraw/zinc/76/11/96/372761196.db2.gz FGKYZFGSPLWYRP-LLVKDONJSA-N -1 3 282.347 2.525 20 10 CFCDHM CC(=O)c1cc(F)cc(CN2CCC[C@H]2C)c1[O-] ZINC000037911612 372736542 /nfs/dbraw/zinc/73/65/42/372736542.db2.gz PPUJDTVUSPPUEH-SECBINFHSA-N -1 3 251.301 2.718 20 10 CFCDHM CN(Cc1ccccc1[O-])[C@H]1CCN(c2ccccc2)C1=O ZINC000109769115 375823401 /nfs/dbraw/zinc/82/34/01/375823401.db2.gz ALYHVXVBVBWZMR-INIZCTEOSA-N -1 3 296.370 2.630 20 10 CFCDHM CC(C)(C)[S@@](=O)CCNCc1c([O-])cccc1Cl ZINC000116920963 376215942 /nfs/dbraw/zinc/21/59/42/376215942.db2.gz ZVEIPIKDGFCLSP-GOSISDBHSA-N -1 3 289.828 2.682 20 10 CFCDHM C[C@H]1CCCC[C@@H]1N(C)C(=O)c1cccc(O)c1[O-] ZINC000126337701 377221139 /nfs/dbraw/zinc/22/11/39/377221139.db2.gz AONZUTPDYLQYAL-JQWIXIFHSA-N -1 3 263.337 2.749 20 10 CFCDHM CCOC(=O)CN(Cc1c([O-])cccc1Cl)C1CC1 ZINC000130356014 377542889 /nfs/dbraw/zinc/54/28/89/377542889.db2.gz JMVPIDJQUBAFEE-UHFFFAOYSA-N -1 3 283.755 2.573 20 10 CFCDHM COCCN(C)Cc1cc(Cl)cc(Cl)c1[O-] ZINC000132703181 377869382 /nfs/dbraw/zinc/86/93/82/377869382.db2.gz OQKJPDGHCVFRJB-UHFFFAOYSA-N -1 3 264.152 2.777 20 10 CFCDHM CC(=O)c1cc(F)cc(CN(C)[C@H](CO)C(C)(C)C)c1[O-] ZINC000134389431 378008886 /nfs/dbraw/zinc/00/88/86/378008886.db2.gz ISRHHPRMTLBIBB-CQSZACIVSA-N -1 3 297.370 2.573 20 10 CFCDHM CCOC[C@H]1CN(Cc2cc(Cl)cc(C)c2[O-])CCO1 ZINC000529665597 383743757 /nfs/dbraw/zinc/74/37/57/383743757.db2.gz HHSRDPAGIRBNCN-CQSZACIVSA-N -1 3 299.798 2.591 20 10 CFCDHM Cc1ccc(C(=O)Nc2nnc(C(C)C)s2)c([O-])c1O ZINC000177668637 380364329 /nfs/dbraw/zinc/36/43/29/380364329.db2.gz VMEWBNDFZREGEM-UHFFFAOYSA-N -1 3 293.348 2.633 20 10 CFCDHM Cc1ccc([C@@H]2COCCN2Cc2ccccc2[O-])o1 ZINC000179576401 380561064 /nfs/dbraw/zinc/56/10/64/380561064.db2.gz UUUPXJPGDADOPC-AWEZNQCLSA-N -1 3 273.332 2.867 20 10 CFCDHM Cc1cc(Cl)cc(CN(C)Cc2cnn(C)c2)c1[O-] ZINC000179601882 380563104 /nfs/dbraw/zinc/56/31/04/380563104.db2.gz KILFTSQDJISBIL-UHFFFAOYSA-N -1 3 279.771 2.720 20 10 CFCDHM CN(Cc1nccn1C(F)F)Cc1cc(F)ccc1[O-] ZINC000179934813 380600198 /nfs/dbraw/zinc/60/01/98/380600198.db2.gz SNLCVBWBSDHTCW-UHFFFAOYSA-N -1 3 285.269 2.755 20 10 CFCDHM COC[C@H](NCc1cc(F)ccc1[O-])c1ccc(C)o1 ZINC000180826323 380702511 /nfs/dbraw/zinc/70/25/11/380702511.db2.gz WHPMGLIHKLRMDX-ZDUSSCGKSA-N -1 3 279.311 2.910 20 10 CFCDHM CN(CCn1cccn1)Cc1cc(Cl)c(F)cc1[O-] ZINC000295414007 380838080 /nfs/dbraw/zinc/83/80/80/380838080.db2.gz RVJVNRDCFQPWNU-UHFFFAOYSA-N -1 3 283.734 2.513 20 10 CFCDHM Cc1ccc(C(=O)N2CCC[C@H](C)[C@@H]2C)c([O-])c1O ZINC000182499725 381101860 /nfs/dbraw/zinc/10/18/60/381101860.db2.gz MZOZSMHCPARLRG-ONGXEEELSA-N -1 3 263.337 2.667 20 10 CFCDHM Cc1ccc(C(=O)N2[C@@H](C)CCC[C@@H]2C)c([O-])c1O ZINC000182378491 381078368 /nfs/dbraw/zinc/07/83/68/381078368.db2.gz SPGWRLFMJWPPJM-QWRGUYRKSA-N -1 3 263.337 2.809 20 10 CFCDHM [O-]c1c(F)cccc1CN1CCOc2cc(O)ccc2C1 ZINC000289873351 381198222 /nfs/dbraw/zinc/19/82/22/381198222.db2.gz VVPNBVUULHTYCB-UHFFFAOYSA-N -1 3 289.306 2.632 20 10 CFCDHM CCCOc1ccc(CN(C(C)C)C2COC2)c([O-])c1 ZINC000296202539 381299451 /nfs/dbraw/zinc/29/94/51/381299451.db2.gz ZHHUQNKLNKRQBP-UHFFFAOYSA-N -1 3 279.380 2.790 20 10 CFCDHM CC(C)OC[C@@H]1CN(Cc2cc(Cl)ccc2[O-])CCO1 ZINC000372116029 381754543 /nfs/dbraw/zinc/75/45/43/381754543.db2.gz INAJYOFSLKZZDG-AWEZNQCLSA-N -1 3 299.798 2.671 20 10 CFCDHM Cc1nc([C@@H]2CCCN(Cc3cccc(F)c3[O-])C2)no1 ZINC000373122999 381933426 /nfs/dbraw/zinc/93/34/26/381933426.db2.gz HLHXQRWFGQRSJP-GFCCVEGCSA-N -1 3 291.326 2.602 20 10 CFCDHM O=C(NCCCOC1CCCCC1)c1cccc(O)c1[O-] ZINC000186810165 382020832 /nfs/dbraw/zinc/02/08/32/382020832.db2.gz SWKAILRSLODIBF-UHFFFAOYSA-N -1 3 293.363 2.567 20 10 CFCDHM COc1cc(Cl)cc(CN2CCO[C@@H](C3CC3)C2)c1[O-] ZINC000375331664 382082409 /nfs/dbraw/zinc/08/24/09/382082409.db2.gz IWJAQGYTUNHNOQ-CQSZACIVSA-N -1 3 297.782 2.665 20 10 CFCDHM CCS[C@@H]1CCCCN(C(=O)c2cccc(O)c2[O-])C1 ZINC000187088153 382095259 /nfs/dbraw/zinc/09/52/59/382095259.db2.gz FJTSXGYVRXVYMR-LLVKDONJSA-N -1 3 295.404 2.846 20 10 CFCDHM C[C@@H]1C[C@@H]2CCCC[C@@H]2N1C(=O)c1cccc(O)c1[O-] ZINC000187100230 382098569 /nfs/dbraw/zinc/09/85/69/382098569.db2.gz BFSVGSOHRQQEHW-MDZLAQPJSA-N -1 3 275.348 2.891 20 10 CFCDHM [O-]c1ccc(Cl)c(F)c1CN1CCC12CCOCC2 ZINC000376463129 382137871 /nfs/dbraw/zinc/13/78/71/382137871.db2.gz LBARCOMJTQLARN-UHFFFAOYSA-N -1 3 285.746 2.940 20 10 CFCDHM Cc1ccc(C(=O)N2CC[C@@]3(C)[C@@H](C2)C3(F)F)c([O-])c1O ZINC000293637698 382206626 /nfs/dbraw/zinc/20/66/26/382206626.db2.gz KMQNTSNNJVELRD-YGRLFVJLSA-N -1 3 297.301 2.524 20 10 CFCDHM Cc1nn(C)c(C)c1CN[C@@H](C)c1ccc(F)c(F)c1[O-] ZINC000187685690 382246175 /nfs/dbraw/zinc/24/61/75/382246175.db2.gz BXAKBHQOVXRLAA-QMMMGPOBSA-N -1 3 295.333 2.872 20 10 CFCDHM Cc1c(CN[C@H](C)c2ccc(F)c(F)c2[O-])cnn1C ZINC000187807741 382274643 /nfs/dbraw/zinc/27/46/43/382274643.db2.gz LHDIARYKNKFIEX-MRVPVSSYSA-N -1 3 281.306 2.563 20 10 CFCDHM [O-]c1ccc(F)cc1CN1C[C@@]2(CCCO2)[C@H]1C1CC1 ZINC000293834255 382297627 /nfs/dbraw/zinc/29/76/27/382297627.db2.gz ATOYIUZVQQTRAT-CVEARBPZSA-N -1 3 277.339 2.675 20 10 CFCDHM COc1cc(Cl)cc(CN2CCC[C@H]2CF)c1[O-] ZINC000293957357 382352806 /nfs/dbraw/zinc/35/28/06/382352806.db2.gz JDXFHOSMEQMAFM-NSHDSACASA-N -1 3 273.735 2.988 20 10 CFCDHM O=C(c1cccc(O)c1[O-])N1CCC2(CCC2)CC1 ZINC000308729417 382485464 /nfs/dbraw/zinc/48/54/64/382485464.db2.gz PWNVASJXUUQLMS-UHFFFAOYSA-N -1 3 261.321 2.504 20 10 CFCDHM CCC1(CC)CN(C(=O)c2ccc(C)c(O)c2[O-])C1 ZINC000294406604 382512725 /nfs/dbraw/zinc/51/27/25/382512725.db2.gz NNRZKPMZVBPPNB-UHFFFAOYSA-N -1 3 263.337 2.668 20 10 CFCDHM CN(CCOCC1CC1)Cc1c([O-])cccc1Cl ZINC000271203866 385375248 /nfs/dbraw/zinc/37/52/48/385375248.db2.gz YNCVCYPVBROBAB-UHFFFAOYSA-N -1 3 269.772 2.904 20 10 CFCDHM CCCCN(Cc1ccccc1[O-])[C@@H](C)c1nncn1C ZINC000287006648 385760711 /nfs/dbraw/zinc/76/07/11/385760711.db2.gz RGGORIHIEGMHPI-ZDUSSCGKSA-N -1 3 288.395 2.884 20 10 CFCDHM Cc1ccc(C(=O)N2CC3(C2)CCCCC3)c([O-])c1O ZINC000274892012 385892468 /nfs/dbraw/zinc/89/24/68/385892468.db2.gz DDYHWDMHAWVKOM-UHFFFAOYSA-N -1 3 275.348 2.813 20 10 CFCDHM CC(C)N(C(=O)[C@@H](C)N(C)Cc1ccccc1[O-])C(C)C ZINC000109769870 393879823 /nfs/dbraw/zinc/87/98/23/393879823.db2.gz IMTZCGFYJUDWNK-CQSZACIVSA-N -1 3 292.423 2.858 20 10 CFCDHM O=C(/C=C\c1cncc([O-])c1)N1CCc2c1cccc2F ZINC000492630929 394073380 /nfs/dbraw/zinc/07/33/80/394073380.db2.gz JRCQDFRSPAUVJS-PLNGDYQASA-N -1 3 284.290 2.529 20 10 CFCDHM C[C@H]1CC[C@]2(CCN(C(=O)c3cccc(O)c3[O-])C2)C1 ZINC000365554552 300078371 /nfs/dbraw/zinc/07/83/71/300078371.db2.gz DQQNZKWAQSZGMH-ZBEGNZNMSA-N -1 3 275.348 2.750 20 10 CFCDHM O=C(NC12CC3CC(CC(C3)C1)C2)c1cccc(O)c1[O-] ZINC000040404242 174253878 /nfs/dbraw/zinc/25/38/78/174253878.db2.gz OBCKLEWCWOGKSJ-UHFFFAOYSA-N -1 3 287.359 2.796 20 10 CFCDHM COc1cc(Cl)cc(CN2CCCO[C@@H](C)C2)c1[O-] ZINC000184687899 262292451 /nfs/dbraw/zinc/29/24/51/262292451.db2.gz AHHHNTUTVWWWMQ-JTQLQIEISA-N -1 3 285.771 2.665 20 10 CFCDHM CC[C@@H](c1ccccc1[O-])N1CCOCC(F)(F)C1 ZINC000367684861 267108901 /nfs/dbraw/zinc/10/89/01/267108901.db2.gz ITZVVIYEZWIVQZ-LBPRGKRZSA-N -1 3 271.307 2.811 20 10 CFCDHM C[C@H]1CCOCCN1Cc1c([O-])ccc(Cl)c1F ZINC000367701183 267111394 /nfs/dbraw/zinc/11/13/94/267111394.db2.gz FPNDYRFAIBUMCK-VIFPVBQESA-N -1 3 273.735 2.796 20 10 CFCDHM CC[C@@H](c1ccccc1[O-])N1CC(F)(F)C[C@H]1CO ZINC000368037697 267139663 /nfs/dbraw/zinc/13/96/63/267139663.db2.gz NMKNGVHHGABUTC-JQWIXIFHSA-N -1 3 271.307 2.545 20 10 CFCDHM [O-]c1ccc(Cl)cc1CN1CC([C@H]2CCOC2)C1 ZINC000369868722 267273146 /nfs/dbraw/zinc/27/31/46/267273146.db2.gz UHMUGMZFNXDWOA-JTQLQIEISA-N -1 3 267.756 2.514 20 10 CFCDHM CC(C)c1nnc2n1CCN(Cc1ccccc1[O-])[C@H]2C ZINC000188449936 278108736 /nfs/dbraw/zinc/10/87/36/278108736.db2.gz UUOWPTFGNSOLLF-LBPRGKRZSA-N -1 3 286.379 2.684 20 10 CFCDHM CC[C@H](NCc1cnn(CC)n1)c1cc(Cl)ccc1[O-] ZINC000527925574 330296470 /nfs/dbraw/zinc/29/64/70/330296470.db2.gz VHFFCOMHMZOAOD-ZDUSSCGKSA-N -1 3 294.786 2.898 20 10 CFCDHM CC1(NC(=O)c2cccc(O)c2[O-])CCC(F)(F)CC1 ZINC000529806755 333509611 /nfs/dbraw/zinc/50/96/11/333509611.db2.gz WRIDLUJOOVFOTP-UHFFFAOYSA-N -1 3 285.290 2.796 20 10 CFCDHM CC(C)[C@H]1CCCN(C(=O)c2cccc(O)c2[O-])CC1 ZINC000126435538 519824840 /nfs/dbraw/zinc/82/48/40/519824840.db2.gz YQSQPJAVNJZOIG-LBPRGKRZSA-N -1 3 277.364 2.996 20 10 CFCDHM CC(C)n1cnnc1CN(C)Cc1c([O-])cccc1Cl ZINC000292877735 520058539 /nfs/dbraw/zinc/05/85/39/520058539.db2.gz XGOHQUXRLXGTCX-UHFFFAOYSA-N -1 3 294.786 2.850 20 10 CFCDHM CCN(CC(C)(C)C)C(=O)c1cccc(O)c1[O-] ZINC000291177767 520393890 /nfs/dbraw/zinc/39/38/90/520393890.db2.gz KMGFYEYYUVZOMD-UHFFFAOYSA-N -1 3 251.326 2.606 20 10 CFCDHM CCCC[C@@H](C(=O)OC)N(C)Cc1ccccc1[O-] ZINC000072629617 520983364 /nfs/dbraw/zinc/98/33/64/520983364.db2.gz GDBSPRLQWOQFBJ-ZDUSSCGKSA-N -1 3 265.353 2.556 20 10 CFCDHM CCC(CC)N(CC)C(=O)c1cccc(O)c1[O-] ZINC000292064282 521549237 /nfs/dbraw/zinc/54/92/37/521549237.db2.gz GZJFPNLXIYKWMI-UHFFFAOYSA-N -1 3 251.326 2.749 20 10 CFCDHM COc1cc(Cl)cc(CN2CCO[C@H]3CCC[C@H]32)c1[O-] ZINC000228630993 522538018 /nfs/dbraw/zinc/53/80/18/522538018.db2.gz AFQCENVBOJPSGX-OLZOCXBDSA-N -1 3 297.782 2.808 20 10 CFCDHM COCc1nc(CN[C@H](C)c2ccc(F)cc2[O-])cs1 ZINC000289570215 523206306 /nfs/dbraw/zinc/20/63/06/523206306.db2.gz AXCJHEOLHIREQN-SECBINFHSA-N -1 3 296.367 2.985 20 10 CFCDHM COCc1nc(CN[C@H](C)c2ccccc2[O-])cs1 ZINC000271645423 523207365 /nfs/dbraw/zinc/20/73/65/523207365.db2.gz HZEIHDGGIYKFFV-SNVBAGLBSA-N -1 3 278.377 2.846 20 10 CFCDHM CO[C@H]1CCN(Cc2cc(F)cc(C(C)=O)c2[O-])[C@H](C)C1 ZINC000281667377 523996875 /nfs/dbraw/zinc/99/68/75/523996875.db2.gz LGLHGDPSIDKNOM-YGRLFVJLSA-N -1 3 295.354 2.733 20 10 CFCDHM Cc1cc(CN[C@@H](C)c2cc(F)ccc2[O-])on1 ZINC000094617999 524764278 /nfs/dbraw/zinc/76/42/78/524764278.db2.gz PHZAQHASYADERO-VIFPVBQESA-N -1 3 250.273 2.679 20 10 CFCDHM Cc1cc(Cl)cc(CN2CCn3cnnc3[C@H]2C)c1[O-] ZINC000276854349 524864172 /nfs/dbraw/zinc/86/41/72/524864172.db2.gz VLUHNUILXZKGME-SNVBAGLBSA-N -1 3 292.770 2.522 20 10 CFCDHM C[C@H](N[C@H](CO)c1ccccc1)c1ccc(F)cc1[O-] ZINC000063000752 525595440 /nfs/dbraw/zinc/59/54/40/525595440.db2.gz IPJYVHOYGRMZMW-XHDPSFHLSA-N -1 3 275.323 2.916 20 10 CFCDHM Cc1ccc(C(=O)NCCSC(C)(C)C)c([O-])c1O ZINC000272835877 526169042 /nfs/dbraw/zinc/16/90/42/526169042.db2.gz QNNCOXGEKZCLSN-UHFFFAOYSA-N -1 3 283.393 2.668 20 10 CFCDHM Cc1cnn([C@@H]2CCN(Cc3c([O-])cccc3Cl)C2)c1 ZINC000290841477 526267195 /nfs/dbraw/zinc/26/71/95/526267195.db2.gz IIBUJNAIICZCOG-GFCCVEGCSA-N -1 3 291.782 2.998 20 10 CFCDHM [O-]c1cc(F)c(Cl)cc1CN1CC[C@@H](n2cccn2)C1 ZINC000293872528 526333368 /nfs/dbraw/zinc/33/33/68/526333368.db2.gz JECUQVQSXDCMFG-LLVKDONJSA-N -1 3 295.745 2.828 20 10 CFCDHM [O-]c1ccc(Cl)c(F)c1CN1CC[C@@H](n2cccn2)C1 ZINC000365839750 526344252 /nfs/dbraw/zinc/34/42/52/526344252.db2.gz VOQWQGGAUMHXOI-SNVBAGLBSA-N -1 3 295.745 2.828 20 10 CFCDHM O=C(Nc1c[nH]nc1-c1ccccc1)c1cccc(O)c1[O-] ZINC000193142135 527096348 /nfs/dbraw/zinc/09/63/48/527096348.db2.gz YVPXWHILEKLWAU-UHFFFAOYSA-N -1 3 295.298 2.740 20 10 CFCDHM CCN(CCc1nccs1)C(=O)c1cc([O-])cs1 ZINC000754495886 574098400 /nfs/dbraw/zinc/09/84/00/574098400.db2.gz DBYDOHFYBFLDHV-UHFFFAOYSA-N -1 3 282.390 2.615 20 10 CFCDHM CO[C@]1(C)C[C@H](N(C)C(=O)c2cc([O-])cs2)C1(C)C ZINC000754908422 574127222 /nfs/dbraw/zinc/12/72/22/574127222.db2.gz VKAJTUJFWAHPKK-SMDDNHRTSA-N -1 3 283.393 2.729 20 10 CFCDHM O=C(NCc1ccc(OC(F)F)cc1)c1cc([O-])cs1 ZINC000731864660 574130886 /nfs/dbraw/zinc/13/08/86/574130886.db2.gz BTXLUPVFBRLOKZ-UHFFFAOYSA-N -1 3 299.298 2.985 20 10 CFCDHM COc1ccc(CN(C)C(=O)c2cc([O-])cs2)cc1 ZINC000731863958 574130930 /nfs/dbraw/zinc/13/09/30/574130930.db2.gz GWIFVBNBFLKZNX-UHFFFAOYSA-N -1 3 277.345 2.735 20 10 CFCDHM COCCOc1ccc(NC(=O)c2cc([O-])cs2)cc1 ZINC000731869920 574131232 /nfs/dbraw/zinc/13/12/32/574131232.db2.gz YTMUGKZTJJOZHY-UHFFFAOYSA-N -1 3 293.344 2.731 20 10 CFCDHM O=C(NCc1ccccc1F)c1cc([O-])cs1 ZINC000731865320 574131505 /nfs/dbraw/zinc/13/15/05/574131505.db2.gz BDGCJTUQHOVSPV-UHFFFAOYSA-N -1 3 251.282 2.523 20 10 CFCDHM O=C(Nc1ccc(N2CCCC2)cn1)c1cc([O-])cs1 ZINC000731868308 574132918 /nfs/dbraw/zinc/13/29/18/574132918.db2.gz BQPLOGPEQSXVEI-UHFFFAOYSA-N -1 3 289.360 2.701 20 10 CFCDHM O=C(OCc1ccc([N+](=O)[O-])cc1)c1cc([O-])cs1 ZINC000731909589 574133258 /nfs/dbraw/zinc/13/32/58/574133258.db2.gz FHIGDNFPUCKGCI-UHFFFAOYSA-N -1 3 279.273 2.719 20 10 CFCDHM CC[C@@H]1CN(Cc2c([O-])ccc3ccncc32)C[C@@H](C)O1 ZINC000732183986 574145187 /nfs/dbraw/zinc/14/51/87/574145187.db2.gz CFWDVLYKUDCJNU-TZMCWYRMSA-N -1 3 286.375 2.940 20 10 CFCDHM C[C@@H](c1ccccn1)N(C)C(=O)c1cc([O-])cs1 ZINC000732278097 574149635 /nfs/dbraw/zinc/14/96/35/574149635.db2.gz FYVMGKOJHOOZPZ-VIFPVBQESA-N -1 3 262.334 2.682 20 10 CFCDHM Cc1csc([C@@H](C)NC(=O)c2cc([O-])cs2)n1 ZINC000732284088 574150036 /nfs/dbraw/zinc/15/00/36/574150036.db2.gz JPRUUGQXGDCPHD-SSDOTTSWSA-N -1 3 268.363 2.710 20 10 CFCDHM O=C(N[C@H]1CCc2c1cccc2O)c1cc([O-])cs1 ZINC000732285545 574150231 /nfs/dbraw/zinc/15/02/31/574150231.db2.gz JGHXVVDOAHXNJB-NSHDSACASA-N -1 3 275.329 2.577 20 10 CFCDHM O=C(OCCc1ccc([N+](=O)[O-])cc1)c1cc([O-])cs1 ZINC000732352687 574152584 /nfs/dbraw/zinc/15/25/84/574152584.db2.gz BXZBVGABNHAKNX-UHFFFAOYSA-N -1 3 293.300 2.761 20 10 CFCDHM COC(=O)c1ccc([C@H](C)OC(=O)c2cc([O-])cs2)o1 ZINC000732352659 574152631 /nfs/dbraw/zinc/15/26/31/574152631.db2.gz AWUIFQQTDFOJCQ-ZETCQYMHSA-N -1 3 296.300 2.751 20 10 CFCDHM COC(=O)c1cccc(COC(=O)c2cc([O-])cs2)c1 ZINC000732352794 574152759 /nfs/dbraw/zinc/15/27/59/574152759.db2.gz HCTVGQOYQPPMNK-UHFFFAOYSA-N -1 3 292.312 2.597 20 10 CFCDHM O=C(OCc1csc([N+](=O)[O-])c1)c1cc([O-])cs1 ZINC000732353186 574152890 /nfs/dbraw/zinc/15/28/90/574152890.db2.gz NJROPCROXBREGK-UHFFFAOYSA-N -1 3 285.302 2.780 20 10 CFCDHM O=C(OCCCOCC(F)(F)F)c1cc([O-])cs1 ZINC000732354931 574153364 /nfs/dbraw/zinc/15/33/64/574153364.db2.gz WZEVOWPUHWQGMQ-UHFFFAOYSA-N -1 3 284.255 2.580 20 10 CFCDHM CCc1noc(C)c1NC(=O)c1cc([O-])cs1 ZINC000755322503 574153745 /nfs/dbraw/zinc/15/37/45/574153745.db2.gz RWJBOGZIKZDNOT-UHFFFAOYSA-N -1 3 252.295 2.565 20 10 CFCDHM Cc1cc([O-])c(C[N@@H+](CCC(=O)[O-])C(C)C)cc1C ZINC000738463891 574170170 /nfs/dbraw/zinc/17/01/70/574170170.db2.gz SFNGGUIHXAKJPB-UHFFFAOYSA-N -1 3 265.353 2.694 20 10 CFCDHM Cc1cc([O-])c(C[N@H+](CCC(=O)[O-])C(C)C)cc1C ZINC000738463891 574170172 /nfs/dbraw/zinc/17/01/72/574170172.db2.gz SFNGGUIHXAKJPB-UHFFFAOYSA-N -1 3 265.353 2.694 20 10 CFCDHM CCS[C@H]1CCC[C@@H]1NC(=O)c1cc([O-])cs1 ZINC000755831639 574191059 /nfs/dbraw/zinc/19/10/59/574191059.db2.gz HTBOHMWLQSZEOS-UWVGGRQHSA-N -1 3 271.407 2.858 20 10 CFCDHM Cc1nc(C(C)(C)NCc2cc(Cl)ccc2[O-])no1 ZINC000729854918 574234298 /nfs/dbraw/zinc/23/42/98/574234298.db2.gz IFYGYXSMRFWAPZ-UHFFFAOYSA-N -1 3 281.743 2.762 20 10 CFCDHM C[C@@H](NCc1ccoc1)c1cc([N+](=O)[O-])ccc1[O-] ZINC000756447961 574238049 /nfs/dbraw/zinc/23/80/49/574238049.db2.gz ZIMBZFUGJMUZLL-SECBINFHSA-N -1 3 262.265 2.744 20 10 CFCDHM O=C(OCCc1cccs1)c1cc([O-])cs1 ZINC000733497095 574242234 /nfs/dbraw/zinc/24/22/34/574242234.db2.gz RESVTMQRQRMKKS-UHFFFAOYSA-N -1 3 254.332 2.915 20 10 CFCDHM C[C@@H]1C[C@@H](NCc2nccn2C)c2c1c(F)ccc2[O-] ZINC000756539709 574244844 /nfs/dbraw/zinc/24/48/44/574244844.db2.gz SBFDACJGGWYLTG-MWLCHTKSSA-N -1 3 275.327 2.603 20 10 CFCDHM C[C@@H]1C[C@H](NCc2nccn2C)c2c1c(F)ccc2[O-] ZINC000756539708 574245169 /nfs/dbraw/zinc/24/51/69/574245169.db2.gz SBFDACJGGWYLTG-KOLCDFICSA-N -1 3 275.327 2.603 20 10 CFCDHM O=C(NCc1nc2c(s1)CCCC2)c1cc([O-])cs1 ZINC000748307802 574246809 /nfs/dbraw/zinc/24/68/09/574246809.db2.gz OZRRDLWKHKVXDO-UHFFFAOYSA-N -1 3 294.401 2.719 20 10 CFCDHM Cc1cc(CN[C@@H](C)c2cc(F)cc(F)c2[O-])n[nH]1 ZINC000756584587 574250482 /nfs/dbraw/zinc/25/04/82/574250482.db2.gz GRMRHXQRPIUKQO-QMMMGPOBSA-N -1 3 267.279 2.553 20 10 CFCDHM Cc1cc(CN[C@@H](C)c2cc(F)cc(F)c2[O-])[nH]n1 ZINC000756584587 574250483 /nfs/dbraw/zinc/25/04/83/574250483.db2.gz GRMRHXQRPIUKQO-QMMMGPOBSA-N -1 3 267.279 2.553 20 10 CFCDHM O=C(c1cc([O-])cs1)N1CC[C@H]1Cc1ccccc1 ZINC000748421478 574251452 /nfs/dbraw/zinc/25/14/52/574251452.db2.gz PVGKVOQSILZVLS-LBPRGKRZSA-N -1 3 273.357 2.911 20 10 CFCDHM C[C@H](CNC(=O)c1cc([O-])cs1)Oc1ccccc1 ZINC000733806499 574256932 /nfs/dbraw/zinc/25/69/32/574256932.db2.gz FCVMLCFBOVPUQN-SNVBAGLBSA-N -1 3 277.345 2.651 20 10 CFCDHM C[C@@H](N[C@@H](C)c1cn[nH]c1)c1cc(F)cc(F)c1[O-] ZINC000756776454 574261912 /nfs/dbraw/zinc/26/19/12/574261912.db2.gz PIUSIQZJLSOFHR-JGVFFNPUSA-N -1 3 267.279 2.805 20 10 CFCDHM C[C@@H]1C[C@@H](NCc2ccn(C)n2)c2c1c(F)ccc2[O-] ZINC000756776969 574262281 /nfs/dbraw/zinc/26/22/81/574262281.db2.gz FEHFNOAGWWYREI-BXKDBHETSA-N -1 3 275.327 2.603 20 10 CFCDHM Cc1cncc(CN[C@H](C)c2cc([N+](=O)[O-])ccc2[O-])c1 ZINC000756784560 574262995 /nfs/dbraw/zinc/26/29/95/574262995.db2.gz NXUHPEGHVJVMBQ-LLVKDONJSA-N -1 3 287.319 2.855 20 10 CFCDHM C[C@@H]1C[C@H](NCc2cocn2)c2c1c(F)ccc2[O-] ZINC000756829781 574266222 /nfs/dbraw/zinc/26/62/22/574266222.db2.gz BUWXNLAKTVCURM-KCJUWKMLSA-N -1 3 262.284 2.857 20 10 CFCDHM CO[C@H](CN[C@@H](C)c1ccc(F)cc1[O-])C(F)(F)F ZINC000756836464 574266851 /nfs/dbraw/zinc/26/68/51/574266851.db2.gz VRYYFSBFKZXDNU-WRWORJQWSA-N -1 3 281.249 2.759 20 10 CFCDHM CCc1cc(CNCc2c([O-])cccc2Cl)on1 ZINC000741258531 574284685 /nfs/dbraw/zinc/28/46/85/574284685.db2.gz NLZBRGNOYOXRKG-UHFFFAOYSA-N -1 3 266.728 2.886 20 10 CFCDHM CC(C)[C@H](NC(=O)c1cc([O-])cs1)c1ccccn1 ZINC000743475735 574365925 /nfs/dbraw/zinc/36/59/25/574365925.db2.gz VKEUORULSPNLRJ-ZDUSSCGKSA-N -1 3 276.361 2.976 20 10 CFCDHM CC(C)[C@H]1CN(C(=O)c2cc([O-])cs2)CCS1 ZINC000743788825 574372126 /nfs/dbraw/zinc/37/21/26/574372126.db2.gz SBBUWGYANZYNIE-LLVKDONJSA-N -1 3 271.407 2.667 20 10 CFCDHM O=C(NCCCC(F)(F)F)c1cc([O-])cs1 ZINC000743814494 574372986 /nfs/dbraw/zinc/37/29/86/574372986.db2.gz MITBAORZOWUHIB-UHFFFAOYSA-N -1 3 253.245 2.526 20 10 CFCDHM Cc1ccc(C(=O)NCc2cccc(Cl)c2)c([O-])c1O ZINC000751531071 574378539 /nfs/dbraw/zinc/37/85/39/574378539.db2.gz YVKRPKSHTPBVTQ-UHFFFAOYSA-N -1 3 291.734 2.990 20 10 CFCDHM CO[C@@H]1Cc2ccc(NC(=O)c3cc([O-])cs3)cc2C1 ZINC000753498445 574403347 /nfs/dbraw/zinc/40/33/47/574403347.db2.gz OVFCPUANUHNPEQ-CYBMUJFWSA-N -1 3 289.356 2.820 20 10 CFCDHM C[C@H]([NH2+]Cc1ccc(C(=O)[O-])cc1)c1ccccc1[O-] ZINC000820141613 598173825 /nfs/dbraw/zinc/17/38/25/598173825.db2.gz FNVZYNATULKGEN-NSHDSACASA-N -1 3 271.316 2.941 20 10 CFCDHM Cc1ccc(C(=O)NCc2ccc(N(C)C)cc2)c([O-])c1 ZINC000023956796 617713038 /nfs/dbraw/zinc/71/30/38/617713038.db2.gz CKURHMDZBZPYGC-UHFFFAOYSA-N -1 3 284.359 2.697 20 10 CFCDHM COc1cc(F)ccc1NC(=O)c1ccc(C)c(O)c1[O-] ZINC000179418964 618272279 /nfs/dbraw/zinc/27/22/79/618272279.db2.gz SPTUNPCWBAMIJD-UHFFFAOYSA-N -1 3 291.278 2.806 20 10 CFCDHM CC(C)CO[C@H]1CCN(Cc2cc(F)cc(F)c2[O-])C1 ZINC000894095989 618321875 /nfs/dbraw/zinc/32/18/75/618321875.db2.gz SUNCCGCTTLJDGZ-ZDUSSCGKSA-N -1 3 285.334 2.917 20 10 CFCDHM Cc1ccc(NC(=O)c2ccc(C)c(O)c2[O-])cc1O ZINC000182618579 625359177 /nfs/dbraw/zinc/35/91/77/625359177.db2.gz IIDNAWXNBHXPEY-UHFFFAOYSA-N -1 3 273.288 2.673 20 10 CFCDHM [O-]c1ccc(Cl)c(F)c1CN1CC[C@@H](CF)C1 ZINC000895573197 619557402 /nfs/dbraw/zinc/55/74/02/619557402.db2.gz OHXKLSPRVQQOKZ-QMMMGPOBSA-N -1 3 261.699 2.976 20 10 CFCDHM CCc1nc(CNCc2c([O-])cccc2F)cs1 ZINC000896642017 619782224 /nfs/dbraw/zinc/78/22/24/619782224.db2.gz WAFPLCWUNPVQQM-UHFFFAOYSA-N -1 3 266.341 2.840 20 10 CFCDHM O=C(CCC1CCC1)NCc1c([O-])cccc1F ZINC000928704806 619995322 /nfs/dbraw/zinc/99/53/22/619995322.db2.gz DFUTXERUZAZTJZ-UHFFFAOYSA-N -1 3 251.301 2.728 20 10 CFCDHM C[C@H]1CN(Cc2cc(Cl)cc(Cl)c2[O-])C[C@@H]1O ZINC000897684505 620270999 /nfs/dbraw/zinc/27/09/99/620270999.db2.gz QKKXVWHWZOEOAC-CPCISQLKSA-N -1 3 276.163 2.512 20 10 CFCDHM O=C(NCc1c([O-])cccc1F)N1CCCCCC1 ZINC000902943656 621206648 /nfs/dbraw/zinc/20/66/48/621206648.db2.gz AEAKZAXHECCWOD-UHFFFAOYSA-N -1 3 266.316 2.617 20 10 CFCDHM [O-]c1ccc(Br)cc1CNC(CF)CF ZINC000824554606 623523057 /nfs/dbraw/zinc/52/30/57/623523057.db2.gz IIMJZYSCKDFKRZ-UHFFFAOYSA-N -1 3 280.112 2.552 20 10 CFCDHM Cc1cc([O-])c(CN2CCc3c[nH]nc3C2)cc1Cl ZINC000824848799 623577004 /nfs/dbraw/zinc/57/70/04/623577004.db2.gz BAPREWRAOOHIPT-UHFFFAOYSA-N -1 3 277.755 2.635 20 10 CFCDHM CCC(CC)NC(=O)NCc1c([O-])cccc1F ZINC000913845281 623615636 /nfs/dbraw/zinc/61/56/36/623615636.db2.gz PXKJHHSGMVKXNC-UHFFFAOYSA-N -1 3 254.305 2.519 20 10 CFCDHM C[C@H]1OCCN(Cc2cc(Cl)ccc2[O-])[C@@H]1C ZINC000093418111 623714084 /nfs/dbraw/zinc/71/40/84/623714084.db2.gz NWHOMKMZDSJMOJ-NXEZZACHSA-N -1 3 255.745 2.655 20 10 CFCDHM CC[C@H](C)[C@H](C)NC(=O)NCc1c([O-])cccc1F ZINC000914366235 623773906 /nfs/dbraw/zinc/77/39/06/623773906.db2.gz MCJNIHWNKJKZPG-UWVGGRQHSA-N -1 3 268.332 2.765 20 10 CFCDHM Cc1cc([O-])c(CN2CCn3cncc3C2)cc1Cl ZINC000825948643 623774781 /nfs/dbraw/zinc/77/47/81/623774781.db2.gz HIYVRQLJSHMIAX-UHFFFAOYSA-N -1 3 277.755 2.566 20 10 CFCDHM CC[C@H](NC(=O)NCc1c([O-])cccc1F)C(C)C ZINC000914369528 623775428 /nfs/dbraw/zinc/77/54/28/623775428.db2.gz APZRATVCYRKAPI-LBPRGKRZSA-N -1 3 268.332 2.765 20 10 CFCDHM [O-]c1cc(Br)ccc1CN(C1CC1)C1COC1 ZINC000826030287 623784406 /nfs/dbraw/zinc/78/44/06/623784406.db2.gz VJBFZOXHDLDSNV-UHFFFAOYSA-N -1 3 298.180 2.518 20 10 CFCDHM Cc1cc([O-])c(CN(C)Cc2c[nH]cn2)c(Cl)c1 ZINC000826768545 623869840 /nfs/dbraw/zinc/86/98/40/623869840.db2.gz CHUROHAYUPITQD-UHFFFAOYSA-N -1 3 265.744 2.709 20 10 CFCDHM [O-]c1c(CN2CC[C@H](O)C(F)(F)C2)ccc2ccccc12 ZINC000826953000 623913987 /nfs/dbraw/zinc/91/39/87/623913987.db2.gz ZFBLPCCWHLJPJU-AWEZNQCLSA-N -1 3 293.313 2.747 20 10 CFCDHM Cc1nnc(CN(C)Cc2ccc3ccccc3c2[O-])o1 ZINC000827039136 623928491 /nfs/dbraw/zinc/92/84/91/623928491.db2.gz IAQMWWGDCVLRAG-UHFFFAOYSA-N -1 3 283.331 2.869 20 10 CFCDHM CC1=C(C(=O)NCc2c([O-])cccc2F)CCN1C(C)C ZINC000830181423 624661382 /nfs/dbraw/zinc/66/13/82/624661382.db2.gz ZTXAVDULFKRMCP-UHFFFAOYSA-N -1 3 292.354 2.536 20 10 CFCDHM CC[C@H]1CCC[C@@H]1NC(=O)NCc1c([O-])cccc1F ZINC000921424039 624877664 /nfs/dbraw/zinc/87/76/64/624877664.db2.gz BLTSTPOWILATIH-GWCFXTLKSA-N -1 3 280.343 2.909 20 10 CFCDHM CN(Cc1cscn1)Cc1cc(F)ccc1[O-] ZINC000179994722 624990162 /nfs/dbraw/zinc/99/01/62/624990162.db2.gz NBXPGLAWMGECNL-UHFFFAOYSA-N -1 3 252.314 2.620 20 10 CFCDHM CCS[C@H]1CCC[C@@H](NC(=O)c2cccc(O)c2[O-])C1 ZINC000185798108 625779006 /nfs/dbraw/zinc/77/90/06/625779006.db2.gz WLPHHOVLWGRJEG-MNOVXSKESA-N -1 3 295.404 2.892 20 10 CFCDHM C[C@H](NCc1nnc(C2CC2)[nH]1)c1cc(F)cc(F)c1[O-] ZINC000834869520 625905581 /nfs/dbraw/zinc/90/55/81/625905581.db2.gz BMRAVMXGUXWSQY-ZETCQYMHSA-N -1 3 294.305 2.517 20 10 CFCDHM C[C@@H]1CN(C(=O)c2cccc(O)c2[O-])c2ccccc21 ZINC000186947326 626407103 /nfs/dbraw/zinc/40/71/03/626407103.db2.gz JGCVPFCEJSVDCH-SNVBAGLBSA-N -1 3 269.300 2.862 20 10 CFCDHM Cn1nc(CNCc2cc(F)cc(F)c2[O-])cc1C1CC1 ZINC000922956236 626433077 /nfs/dbraw/zinc/43/30/77/626433077.db2.gz RAURNEAUTFIRFK-UHFFFAOYSA-N -1 3 293.317 2.571 20 10 CFCDHM C[C@@H](NC(=O)c1ccccc1[O-])c1ccc(N(C)C)cc1 ZINC000773020104 627769806 /nfs/dbraw/zinc/76/98/06/627769806.db2.gz NUNNLWWCBOAABI-GFCCVEGCSA-N -1 3 284.359 2.949 20 10 CFCDHM COc1c([O-])c(CNc2ccccc2)ccc1[N+](=O)[O-] ZINC000774935503 627979866 /nfs/dbraw/zinc/97/98/66/627979866.db2.gz OJCVNLHREYLWMZ-UHFFFAOYSA-N -1 3 274.276 2.921 20 10 CFCDHM C[C@@H]1CN(Cc2cc(Cl)cc(F)c2[O-])[C@H](C)CN1C ZINC000775984935 628091247 /nfs/dbraw/zinc/09/12/47/628091247.db2.gz ILORRTKTMIUPLR-NXEZZACHSA-N -1 3 286.778 2.709 20 10 CFCDHM CC(C)[C@@H](NCc1cc(F)ccc1[O-])C(=O)OC(C)(C)C ZINC000779106559 628352930 /nfs/dbraw/zinc/35/29/30/628352930.db2.gz PBPKXFDAVUAORG-CQSZACIVSA-N -1 3 297.370 2.987 20 10 CFCDHM Cc1ccc(C(=O)N2C[C@H](C)Oc3ccccc32)c([O-])c1O ZINC000780941302 628506504 /nfs/dbraw/zinc/50/65/04/628506504.db2.gz SHKITMFQUAOVSD-NSHDSACASA-N -1 3 299.326 2.834 20 10 CFCDHM O=C(Nc1ccc2ccccc2n1)c1cccc(O)c1[O-] ZINC000790477426 629241799 /nfs/dbraw/zinc/24/17/99/629241799.db2.gz FFBFKBWKAOVFAK-UHFFFAOYSA-N -1 3 280.283 2.898 20 10 CFCDHM O=C(c1cccc(O)c1[O-])N1CCC[C@H]1c1ccc(O)cc1 ZINC000790572351 629248848 /nfs/dbraw/zinc/24/88/48/629248848.db2.gz XEICJYCFESJTIH-AWEZNQCLSA-N -1 3 299.326 2.781 20 10 CFCDHM O=C(c1cccc(O)c1[O-])N1CCC[C@@H]1c1ccc(O)cc1 ZINC000790572352 629248925 /nfs/dbraw/zinc/24/89/25/629248925.db2.gz XEICJYCFESJTIH-CQSZACIVSA-N -1 3 299.326 2.781 20 10 CFCDHM O=C(NC[C@H]1CCc2ccccc2C1)c1cccc(O)c1[O-] ZINC000790742269 629259449 /nfs/dbraw/zinc/25/94/49/629259449.db2.gz ULYZZZYGKCNMSW-LBPRGKRZSA-N -1 3 297.354 2.633 20 10 CFCDHM C[C@@]1(c2ccccc2)C[C@H]1NC(=O)c1cccc(O)c1[O-] ZINC000790785317 629262476 /nfs/dbraw/zinc/26/24/76/629262476.db2.gz LMBVCKVFXUPTPG-PBHICJAKSA-N -1 3 283.327 2.558 20 10 CFCDHM C[C@@H](C1CC1)n1cc(NC(=O)c2cccc(O)c2[O-])cn1 ZINC000790944509 629272965 /nfs/dbraw/zinc/27/29/65/629272965.db2.gz AICBQQBBKKMVGA-VIFPVBQESA-N -1 3 287.319 2.518 20 10 CFCDHM C[C@H](NCc1c([O-])ccc(Cl)c1F)c1cnn(C)c1 ZINC000790970754 629275567 /nfs/dbraw/zinc/27/55/67/629275567.db2.gz FEBQYFCWZROGCN-QMMMGPOBSA-N -1 3 283.734 2.769 20 10 CFCDHM CC(=O)c1cc(F)cc(CN2[C@H](C)C[C@@H]2C)c1[O-] ZINC000791564869 629333142 /nfs/dbraw/zinc/33/31/42/629333142.db2.gz ASIWCCAIKALJGH-DTORHVGOSA-N -1 3 251.301 2.717 20 10 CFCDHM CC[C@@]1(O)CCN(Cc2c([O-])ccc(Cl)c2F)C1 ZINC000792179764 629406838 /nfs/dbraw/zinc/40/68/38/629406838.db2.gz MQFCNESJDVKRNT-CYBMUJFWSA-N -1 3 273.735 2.532 20 10 CFCDHM C[C@@H](NC(=O)c1cccc(O)c1[O-])c1ccc(Cl)cn1 ZINC000792451112 629426297 /nfs/dbraw/zinc/42/62/97/629426297.db2.gz TZDUYDRPQVYMTQ-MRVPVSSYSA-N -1 3 292.722 2.637 20 10 CFCDHM CCn1ncnc1CN[C@@H](C)c1cc(Cl)ccc1[O-] ZINC000794842030 629693389 /nfs/dbraw/zinc/69/33/89/629693389.db2.gz OZCVIUHOSDCGGV-VIFPVBQESA-N -1 3 280.759 2.508 20 10 CFCDHM CC[C@@H](Nc1cn(C)nc1OC)c1ccc(F)cc1[O-] ZINC000796960252 629996347 /nfs/dbraw/zinc/99/63/47/629996347.db2.gz DMEYIWNLROYBIP-LLVKDONJSA-N -1 3 279.315 2.837 20 10 CFCDHM [O-]c1ccc(Cl)cc1CN1CCO[C@@H](C(F)F)C1 ZINC000802653675 630536001 /nfs/dbraw/zinc/53/60/01/630536001.db2.gz QBPLPAOJSQRUBK-LLVKDONJSA-N -1 3 277.698 2.512 20 10 CFCDHM Cc1cc([O-])c(CN2CCO[C@@H](C)C2)c(Cl)c1 ZINC000840910891 631260820 /nfs/dbraw/zinc/26/08/20/631260820.db2.gz WWYWUXOKHWNONN-JTQLQIEISA-N -1 3 255.745 2.575 20 10 CFCDHM Cc1cc([O-])c(CN2CCOC(C)(C)C2)c(Cl)c1 ZINC000840910856 631261176 /nfs/dbraw/zinc/26/11/76/631261176.db2.gz NJNQQMVWDFNJCJ-UHFFFAOYSA-N -1 3 269.772 2.965 20 10 CFCDHM Cc1cc([O-])c(CN(C)Cc2cn[nH]c2)c(Cl)c1 ZINC000840915585 631263296 /nfs/dbraw/zinc/26/32/96/631263296.db2.gz RGTUSYMWDOIGSW-UHFFFAOYSA-N -1 3 265.744 2.709 20 10 CFCDHM C[C@H]1CO[C@@H](C(F)(F)F)CN1Cc1cc(F)ccc1[O-] ZINC000809696126 631266189 /nfs/dbraw/zinc/26/61/89/631266189.db2.gz CLWSJIFBPLUODX-QPUJVOFHSA-N -1 3 293.260 2.683 20 10 CFCDHM [O-]c1ccc(Cl)cc1CN1CCOC[C@@H]1CC(F)F ZINC000809713140 631269541 /nfs/dbraw/zinc/26/95/41/631269541.db2.gz ZXELIBFGCVQHEH-NSHDSACASA-N -1 3 291.725 2.902 20 10 CFCDHM Cc1cc([O-])c(CN2C[C@H](O)CC(F)(F)C2)c(Cl)c1 ZINC000840941827 631274368 /nfs/dbraw/zinc/27/43/68/631274368.db2.gz NEGNGPMLHRNAKX-SECBINFHSA-N -1 3 291.725 2.556 20 10 CFCDHM Cc1cc(Cl)cc(C[NH2+][C@H](CC(C)C)C(=O)[O-])c1[O-] ZINC000840995866 631296607 /nfs/dbraw/zinc/29/66/07/631296607.db2.gz JXWCELROYBMQFU-GFCCVEGCSA-N -1 3 285.771 2.943 20 10 CFCDHM O=C(Nc1cc(C2CC2)ccn1)c1cccc(O)c1[O-] ZINC000812359341 631695318 /nfs/dbraw/zinc/69/53/18/631695318.db2.gz FXVIKAJRPSCMRW-UHFFFAOYSA-N -1 3 270.288 2.623 20 10 CFCDHM CCN(Cc1c([O-])ccc(Cl)c1F)[C@H]1CCOC1 ZINC000812780511 631773259 /nfs/dbraw/zinc/77/32/59/631773259.db2.gz GVZFWAKBVJXEIY-VIFPVBQESA-N -1 3 273.735 2.796 20 10 CFCDHM Cc1ccc(C(=O)Nc2ccnn2C(C)(C)C)c([O-])c1O ZINC000856281221 635773441 /nfs/dbraw/zinc/77/34/41/635773441.db2.gz VMJBLXPOIFWXBM-UHFFFAOYSA-N -1 3 289.335 2.610 20 10 CFCDHM COc1ccncc1CNCc1cc(Cl)c(F)cc1[O-] ZINC000816619078 632495445 /nfs/dbraw/zinc/49/54/45/632495445.db2.gz SBWCXHBSYNRZQW-UHFFFAOYSA-N -1 3 296.729 2.878 20 10 CFCDHM [O-]c1c(F)cc(Cl)cc1CN1CCC[C@@H](O)CC1 ZINC000816667673 632509988 /nfs/dbraw/zinc/50/99/88/632509988.db2.gz UBHOVZFEASJCRC-LLVKDONJSA-N -1 3 273.735 2.532 20 10 CFCDHM C[C@@H]1CN(C(=O)c2cccc(O)c2[O-])Cc2ccccc2O1 ZINC000817047943 632549415 /nfs/dbraw/zinc/54/94/15/632549415.db2.gz KGHYWPVXPNCVGH-LLVKDONJSA-N -1 3 299.326 2.521 20 10 CFCDHM CC[C@H](NCc1nn(CC)nc1C)c1ccc(F)cc1[O-] ZINC000818346848 632834981 /nfs/dbraw/zinc/83/49/81/632834981.db2.gz VGRZMTFEGLHTNZ-ZDUSSCGKSA-N -1 3 292.358 2.692 20 10 CFCDHM CC(C)(CNC(=O)c1cccc(O)c1[O-])CC(F)(F)F ZINC000856520313 635831720 /nfs/dbraw/zinc/83/17/20/635831720.db2.gz XBDJUXOVPSTJLG-UHFFFAOYSA-N -1 3 291.269 2.806 20 10 CFCDHM Cc1noc(CN(C)Cc2c([O-])cc(C)cc2Cl)n1 ZINC000848927046 633409912 /nfs/dbraw/zinc/40/99/12/633409912.db2.gz APJOLAVLZOTOGN-UHFFFAOYSA-N -1 3 281.743 2.677 20 10 CFCDHM CC[C@H](N[C@@H]1C[C@H](C)n2ncnc21)c1ccc(F)cc1[O-] ZINC000850498871 634018496 /nfs/dbraw/zinc/01/84/96/634018496.db2.gz FDXJZWFJWRAUQH-TVYUQYBPSA-N -1 3 290.342 2.870 20 10 CFCDHM Cc1cc([O-])c(CN2CCc3n[nH]cc3C2)cc1Cl ZINC000857876774 636045417 /nfs/dbraw/zinc/04/54/17/636045417.db2.gz LKMDULXYKGOIHN-UHFFFAOYSA-N -1 3 277.755 2.635 20 10 CFCDHM [O-]c1cccc(Cl)c1CNc1cnn(CCF)c1 ZINC000858246545 636163681 /nfs/dbraw/zinc/16/36/81/636163681.db2.gz TUXBULFZIJCHMW-UHFFFAOYSA-N -1 3 269.707 2.824 20 10 CFCDHM [O-]c1ccc(Br)cc1CN1CC2(C1)CCCO2 ZINC000862484222 637399574 /nfs/dbraw/zinc/39/95/74/637399574.db2.gz GUUGCODYUFNWNU-UHFFFAOYSA-N -1 3 298.180 2.520 20 10 CFCDHM CCc1cc(O)ccc1[N-]S(=O)(=O)c1ccccc1 ZINC000189432341 650380497 /nfs/dbraw/zinc/38/04/97/650380497.db2.gz FTDYXCOCXNQNCC-UHFFFAOYSA-N -1 3 277.345 2.755 20 10 CFCDHM CCc1cc(O)ccc1NC(=O)c1ccc(C)c(O)c1[O-] ZINC000191083029 650477458 /nfs/dbraw/zinc/47/74/58/650477458.db2.gz AHRFLLFTIBTGBD-UHFFFAOYSA-N -1 3 287.315 2.927 20 10 CFCDHM C[C@H](NC(=O)c1cccc(O)c1[O-])c1cccc(F)c1F ZINC000193150935 650628387 /nfs/dbraw/zinc/62/83/87/650628387.db2.gz CNFSFXQMSDIJEV-QMMMGPOBSA-N -1 3 293.269 2.867 20 10 CFCDHM O=C(NCC[C@H]1CCCS1)NCc1c([O-])cccc1F ZINC000923633223 641464342 /nfs/dbraw/zinc/46/43/42/641464342.db2.gz FQDWDOPCXDWFTR-SNVBAGLBSA-N -1 3 298.383 2.616 20 10 CFCDHM Cc1nonc1CN[C@H](C)c1ccc(Cl)cc1[O-] ZINC000872135508 641663472 /nfs/dbraw/zinc/66/34/72/641663472.db2.gz HYFBDHJBEHDDGK-SSDOTTSWSA-N -1 3 267.716 2.588 20 10 CFCDHM COc1ncccc1CNCc1cccc(Cl)c1[O-] ZINC000124697728 642302085 /nfs/dbraw/zinc/30/20/85/642302085.db2.gz XYSZTFIOIGPIEL-UHFFFAOYSA-N -1 3 278.739 2.739 20 10 CFCDHM COc1cccc(C[N@@H+]2CCCC[C@H]2CCC(=O)[O-])c1[O-] ZINC000086755090 650797550 /nfs/dbraw/zinc/79/75/50/650797550.db2.gz CYSWTJHTVRZTRW-ZDUSSCGKSA-N -1 3 293.363 2.620 20 10 CFCDHM COc1cccc(C[N@H+]2CCCC[C@H]2CCC(=O)[O-])c1[O-] ZINC000086755090 650797554 /nfs/dbraw/zinc/79/75/54/650797554.db2.gz CYSWTJHTVRZTRW-ZDUSSCGKSA-N -1 3 293.363 2.620 20 10 CFCDHM CC(=O)c1cccc(NC(=O)c2cccc(O)c2[O-])c1 ZINC000126169690 643021618 /nfs/dbraw/zinc/02/16/18/643021618.db2.gz ATFWDWNIASOHHF-UHFFFAOYSA-N -1 3 271.272 2.553 20 10 CFCDHM O=C(c1cccc(O)c1[O-])N1CCCc2ccccc21 ZINC000126218127 643053438 /nfs/dbraw/zinc/05/34/38/643053438.db2.gz UDFXSCGEVCINFW-UHFFFAOYSA-N -1 3 269.300 2.691 20 10 CFCDHM CN(Cc1ccccc1F)C(=O)c1cccc(O)c1[O-] ZINC000126280424 643089757 /nfs/dbraw/zinc/08/97/57/643089757.db2.gz YZDJAOVMOMYZFS-UHFFFAOYSA-N -1 3 275.279 2.509 20 10 CFCDHM C[C@H](NC(=O)c1cccc(O)c1[O-])c1ccsc1 ZINC000126390329 643190662 /nfs/dbraw/zinc/19/06/62/643190662.db2.gz ILHJGHHMJKKBJE-QMMMGPOBSA-N -1 3 263.318 2.650 20 10 CFCDHM CC[C@@H]1CCC[C@@H](NC(=O)c2cccc(O)c2[O-])C1 ZINC000126450105 643227309 /nfs/dbraw/zinc/22/73/09/643227309.db2.gz IRVSCBMWORHWJV-GHMZBOCLSA-N -1 3 263.337 2.796 20 10 CFCDHM CC1(C)CCCC[C@@H]1NC(=O)c1cccc(O)c1[O-] ZINC000126478911 643239962 /nfs/dbraw/zinc/23/99/62/643239962.db2.gz MKRUVMOCIKHFPI-LBPRGKRZSA-N -1 3 263.337 2.796 20 10 CFCDHM [O-]c1c(CN2CCOCC3(CCC3)C2)ccc(F)c1F ZINC000877349607 643246709 /nfs/dbraw/zinc/24/67/09/643246709.db2.gz MVVWDIJMSWGJLD-UHFFFAOYSA-N -1 3 283.318 2.673 20 10 CFCDHM [O-]c1c(CN2CC(C3CCOCC3)C2)ccc(F)c1F ZINC000877500290 643311845 /nfs/dbraw/zinc/31/18/45/643311845.db2.gz RIWJUWODRMWYLP-UHFFFAOYSA-N -1 3 283.318 2.529 20 10 CFCDHM CC1(C)C[C@@H](O)CN(Cc2cc(Cl)cc(F)c2[O-])C1 ZINC000877751328 643526926 /nfs/dbraw/zinc/52/69/26/643526926.db2.gz BNNNBISUTZJBQI-LLVKDONJSA-N -1 3 287.762 2.778 20 10 CFCDHM CC1(C)C[C@@H](NC(=O)c2cccc(O)c2[O-])CCS1 ZINC000888801183 644558881 /nfs/dbraw/zinc/55/88/81/644558881.db2.gz XJQXVHOYEHZUSC-VIFPVBQESA-N -1 3 281.377 2.502 20 10 CFCDHM C[C@H]1OCCN(Cc2cc(Cl)ccc2[O-])[C@H]1C ZINC000093418112 650939547 /nfs/dbraw/zinc/93/95/47/650939547.db2.gz NWHOMKMZDSJMOJ-VHSXEESVSA-N -1 3 255.745 2.655 20 10 CFCDHM CCn1ccnc1[C@@H](C)NCc1cc(F)cc(F)c1[O-] ZINC000883135991 645621158 /nfs/dbraw/zinc/62/11/58/645621158.db2.gz RMDQHWQCHNFUCM-SECBINFHSA-N -1 3 281.306 2.738 20 10 CFCDHM Cc1nccnc1[C@@H](C)NCc1cc(F)cc(F)c1[O-] ZINC000883203994 645660935 /nfs/dbraw/zinc/66/09/35/645660935.db2.gz QCFQXGQIANZWJX-SECBINFHSA-N -1 3 279.290 2.620 20 10 CFCDHM C[C@@H]1CN(Cc2cc(Cl)ccc2[O-])[C@H](C)CO1 ZINC000132181137 645889450 /nfs/dbraw/zinc/88/94/50/645889450.db2.gz NPORTKZGDXPOPY-NXEZZACHSA-N -1 3 255.745 2.655 20 10 CFCDHM C[C@@H](NCc1ncccc1N(C)C)c1c([O-])cccc1F ZINC000886612060 647067239 /nfs/dbraw/zinc/06/72/39/647067239.db2.gz ATPKWMJAMYSTBK-LLVKDONJSA-N -1 3 289.354 2.843 20 10 CFCDHM COc1ccnc(CN[C@H](C)c2c([O-])cccc2F)c1F ZINC000886637766 647081890 /nfs/dbraw/zinc/08/18/90/647081890.db2.gz DZKUSLFEWXJRBM-SECBINFHSA-N -1 3 294.301 2.925 20 10 CFCDHM CC(C)n1cccc1C(=O)NCc1c([O-])cccc1F ZINC000928705604 648944604 /nfs/dbraw/zinc/94/46/04/648944604.db2.gz LWLVIGQQHGMBOO-UHFFFAOYSA-N -1 3 276.311 2.844 20 10 CFCDHM C[C@@H]1CCCC[C@H]1C(=O)NCc1c([O-])cccc1F ZINC000928706626 648945216 /nfs/dbraw/zinc/94/52/16/648945216.db2.gz SNUIQAMVXZAUKZ-GHMZBOCLSA-N -1 3 265.328 2.974 20 10 CFCDHM Cc1cc(C(=O)NCc2c([O-])cccc2F)nn1C(C)C ZINC000928706984 648945425 /nfs/dbraw/zinc/94/54/25/648945425.db2.gz ZHLMGLFSQARFFT-UHFFFAOYSA-N -1 3 291.326 2.547 20 10 CFCDHM CC1(C)CC[C@@H](C(=O)NCc2c([O-])cccc2F)C1 ZINC000928708426 648946032 /nfs/dbraw/zinc/94/60/32/648946032.db2.gz LTRRHPSNHCLUGB-SNVBAGLBSA-N -1 3 265.328 2.974 20 10 CFCDHM O=C(NCc1c([O-])cccc1F)[C@@H]1CCCC12CC2 ZINC000928710932 648946481 /nfs/dbraw/zinc/94/64/81/648946481.db2.gz YELXGIUGBXGTGO-NSHDSACASA-N -1 3 263.312 2.728 20 10 CFCDHM CN(Cc1c([O-])cc(F)cc1F)C[C@@H]1CCCCO1 ZINC001140583539 770964904 /nfs/dbraw/zinc/96/49/04/770964904.db2.gz KKKUDWKGQLDVKI-NSHDSACASA-N -1 3 271.307 2.671 20 10 CFCDHM [O-]c1ccc(F)cc1CN1CC(Oc2ccc(F)cc2)C1 ZINC001140059136 770116272 /nfs/dbraw/zinc/11/62/72/770116272.db2.gz UTIABGJQKFERJR-UHFFFAOYSA-N -1 3 291.297 2.934 20 10 CFCDHM Cc1ncc(CNCc2c([O-])cccc2Cl)o1 ZINC000397875660 770359254 /nfs/dbraw/zinc/35/92/54/770359254.db2.gz JWLRPAOOPLVMNV-UHFFFAOYSA-N -1 3 252.701 2.632 20 10 CFCDHM [O-]c1cc(F)cc(F)c1CN1CCC(n2ccnc2)CC1 ZINC001140584049 770969625 /nfs/dbraw/zinc/96/96/25/770969625.db2.gz DUPRLOPLXGCXEQ-UHFFFAOYSA-N -1 3 293.317 2.704 20 10 CFCDHM CC1C[C@H]2CC[C@@H](C1)N2C(=O)c1cccc(O)c1[O-] ZINC000692915375 776676125 /nfs/dbraw/zinc/67/61/25/776676125.db2.gz LTGSPTXGLGMLBT-FGWVZKOKSA-N -1 3 261.321 2.501 20 10 CFCDHM O=C([O-])c1ccc(C[N@@H+]2CCC[C@H]2c2ccccn2)c([O-])c1 ZINC001231452657 777223164 /nfs/dbraw/zinc/22/31/64/777223164.db2.gz QRHVIKFKDMQNTN-HNNXBMFYSA-N -1 3 298.342 2.823 20 10 CFCDHM O=C([O-])c1ccc(C[N@H+]2CCC[C@H]2c2ccccn2)c([O-])c1 ZINC001231452657 777223174 /nfs/dbraw/zinc/22/31/74/777223174.db2.gz QRHVIKFKDMQNTN-HNNXBMFYSA-N -1 3 298.342 2.823 20 10 CFCDHM O=C([O-])c1ccc(C[NH+]2CCc3ccccc3CC2)c([O-])c1 ZINC001231452158 777223948 /nfs/dbraw/zinc/22/39/48/777223948.db2.gz FRRFHVJXHBXELD-UHFFFAOYSA-N -1 3 297.354 2.691 20 10 CFCDHM O=C([O-])c1ccc(CN(Cc2ccco2)C2CC2)c(O)c1 ZINC001231454995 777224064 /nfs/dbraw/zinc/22/40/64/777224064.db2.gz URPDARSDWSXXGJ-UHFFFAOYSA-N -1 3 287.315 2.848 20 10 CFCDHM C[C@H]1CCC[N@H+](Cc2cc(C(=O)[O-])ccc2[O-])C[C@H]1C ZINC001231560449 777259519 /nfs/dbraw/zinc/25/95/19/777259519.db2.gz INDBXYCCWKFWTI-NWDGAFQWSA-N -1 3 277.364 2.958 20 10 CFCDHM C[C@H]1CCC[N@@H+](Cc2cc(C(=O)[O-])ccc2[O-])C[C@H]1C ZINC001231560449 777259524 /nfs/dbraw/zinc/25/95/24/777259524.db2.gz INDBXYCCWKFWTI-NWDGAFQWSA-N -1 3 277.364 2.958 20 10 CFCDHM C[C@@H]1CC[N@H+](Cc2cc(C(=O)[O-])ccc2[O-])[C@@H](C)C1 ZINC001231564079 777261608 /nfs/dbraw/zinc/26/16/08/777261608.db2.gz HYOIERIYCPMRQM-MNOVXSKESA-N -1 3 263.337 2.711 20 10 CFCDHM C[C@@H]1CC[N@@H+](Cc2cc(C(=O)[O-])ccc2[O-])[C@@H](C)C1 ZINC001231564079 777261616 /nfs/dbraw/zinc/26/16/16/777261616.db2.gz HYOIERIYCPMRQM-MNOVXSKESA-N -1 3 263.337 2.711 20 10 CFCDHM Cc1cc([O-])c(CN2CCc3c(cnn3C)C2)cc1Cl ZINC001231870115 777358709 /nfs/dbraw/zinc/35/87/09/777358709.db2.gz JXTWUDRQQKFYSN-UHFFFAOYSA-N -1 3 291.782 2.646 20 10 CFCDHM [O-]c1c(CN2CC(F)(F)C[C@H]2CO)ccc2ccccc12 ZINC001231878456 777362806 /nfs/dbraw/zinc/36/28/06/777362806.db2.gz KOYVUCIJOVFIGL-ZDUSSCGKSA-N -1 3 293.313 2.747 20 10 CFCDHM [O-]c1c(CN2CCC23COC3)ccc2ccccc21 ZINC001231882239 777364599 /nfs/dbraw/zinc/36/45/99/777364599.db2.gz NVOQJDJLPNTPGS-UHFFFAOYSA-N -1 3 255.317 2.520 20 10 CFCDHM CCC(=O)N[C@@H]1CCCN(Cc2cccc(Cl)c2[O-])C1 ZINC001231913237 777383447 /nfs/dbraw/zinc/38/34/47/777383447.db2.gz JFELCFHERYCQCQ-GFCCVEGCSA-N -1 3 296.798 2.536 20 10 CFCDHM C[C@@H]1C[C@@H](F)CN1Cc1cc(Cl)c([O-])cc1O ZINC001232258627 777496886 /nfs/dbraw/zinc/49/68/86/777496886.db2.gz BGCBSDITRMUXRP-VXNVDRBHSA-N -1 3 259.708 2.684 20 10 CFCDHM COc1cc([O-])c(CN2C[C@H](F)C[C@H]2C)cc1Cl ZINC001232266913 777498891 /nfs/dbraw/zinc/49/88/91/777498891.db2.gz SQUNLSDNIZLBQG-PSASIEDQSA-N -1 3 273.735 2.987 20 10 CFCDHM C[C@]1(CF)CCN(Cc2c([O-])ccc(F)c2F)C1 ZINC001233332334 777888714 /nfs/dbraw/zinc/88/87/14/777888714.db2.gz HMTSMMYMBLTBRD-CYBMUJFWSA-N -1 3 259.271 2.852 20 10 CFCDHM CN(Cc1c([O-])ccc(F)c1F)C1CC(F)(F)C1 ZINC001233331831 777888942 /nfs/dbraw/zinc/88/89/42/777888942.db2.gz MPUJJUSAITYHKP-UHFFFAOYSA-N -1 3 263.234 2.900 20 10 CFCDHM CSC1CCN(Cc2c([O-])ccc(F)c2F)CC1 ZINC001233334605 777894939 /nfs/dbraw/zinc/89/49/39/777894939.db2.gz NHYACICPLNATFH-UHFFFAOYSA-N -1 3 273.348 2.998 20 10 CFCDHM O=C1CCN(Cc2ccc(C(F)(F)F)cc2[O-])C[C@H]1F ZINC001233454797 777960013 /nfs/dbraw/zinc/96/00/13/777960013.db2.gz KKWULVMCMYTDQX-SNVBAGLBSA-N -1 3 291.244 2.524 20 10 CFCDHM COc1cc([O-])c(CN2CC[C@H](F)C2)c(Cl)c1 ZINC001236800368 778942698 /nfs/dbraw/zinc/94/26/98/778942698.db2.gz XTVAIAJJADZLGV-QMMMGPOBSA-N -1 3 259.708 2.598 20 10 CFCDHM COc1cc([O-])c(CN2CCOC(C)(C)C2)c(Cl)c1 ZINC001236798904 778943613 /nfs/dbraw/zinc/94/36/13/778943613.db2.gz QBOVIICVPWQGED-UHFFFAOYSA-N -1 3 285.771 2.665 20 10 CFCDHM COc1ccc(CN2CCN(C(C)C)CC2)c([O-])c1Cl ZINC001236806684 778946580 /nfs/dbraw/zinc/94/65/80/778946580.db2.gz ZKBMELLFIGGOJZ-UHFFFAOYSA-N -1 3 298.814 2.580 20 10 CFCDHM COc1cc([O-])c(CN2CC3(CSC3)C2)c(Cl)c1 ZINC001236806038 778946874 /nfs/dbraw/zinc/94/68/74/778946874.db2.gz LTBSPCXHJHQJIU-UHFFFAOYSA-N -1 3 285.796 2.603 20 10 CFCDHM CCO[C@@H]1CCN(Cc2c([O-])ccc(F)c2Cl)C1 ZINC001237131923 779022773 /nfs/dbraw/zinc/02/27/73/779022773.db2.gz YHIWTBQVIRCXKW-SECBINFHSA-N -1 3 273.735 2.796 20 10 CFCDHM C[C@H]1C[C@@H](O)CCN1Cc1cc(Cl)cc(F)c1[O-] ZINC001237622602 779146906 /nfs/dbraw/zinc/14/69/06/779146906.db2.gz VGASCDIKHLAZTF-KWQFWETISA-N -1 3 273.735 2.530 20 10 CFCDHM CCCN1CCN(Cc2cc(F)cc(Cl)c2[O-])CC1 ZINC001237800136 779181525 /nfs/dbraw/zinc/18/15/25/779181525.db2.gz XTCQTCGSMISPND-UHFFFAOYSA-N -1 3 286.778 2.712 20 10 CFCDHM [O-]c1c(Cl)cc(F)cc1CN1CCC[C@H](O)CC1 ZINC001237807491 779184862 /nfs/dbraw/zinc/18/48/62/779184862.db2.gz KHFFLOXZXKGBGP-NSHDSACASA-N -1 3 273.735 2.532 20 10 CFCDHM C[C@H]1CC[C@H](CO)CN1Cc1cc(F)cc(Cl)c1[O-] ZINC001237809200 779186114 /nfs/dbraw/zinc/18/61/14/779186114.db2.gz ZZKOMHMKXUBYKG-UWVGGRQHSA-N -1 3 287.762 2.778 20 10 CFCDHM CN(Cc1ccno1)Cc1cc(F)c(Cl)cc1[O-] ZINC001237941494 779213406 /nfs/dbraw/zinc/21/34/06/779213406.db2.gz XIMTYZOOFHNRBK-UHFFFAOYSA-N -1 3 270.691 2.805 20 10 CFCDHM [O-]c1cc(Cl)c(F)cc1CN1CCC[C@@]2(CCO2)C1 ZINC001237950561 779214327 /nfs/dbraw/zinc/21/43/27/779214327.db2.gz WQIZKIPXXUQSEI-CQSZACIVSA-N -1 3 285.746 2.940 20 10 CFCDHM Cc1cc(CNCc2c([O-])cccc2Br)no1 ZINC000706829873 781204819 /nfs/dbraw/zinc/20/48/19/781204819.db2.gz DNQVIRDKORVCOB-UHFFFAOYSA-N -1 3 297.152 2.741 20 10 CFCDHM Cc1noc(C)c1CN[C@@H](C)c1ccc(F)cc1[O-] ZINC000092328754 375102030 /nfs/dbraw/zinc/10/20/30/375102030.db2.gz VVTDBNFXKNXPOX-QMMMGPOBSA-N -1 3 264.300 2.987 20 10 CFCDHM CCCOc1ccc(CN2CCO[C@H](C)[C@@H]2C)c([O-])c1 ZINC000093418440 375233122 /nfs/dbraw/zinc/23/31/22/375233122.db2.gz DSHMNPNOLCWBDD-QWHCGFSZSA-N -1 3 279.380 2.790 20 10 CFCDHM COCCOC1CCN(Cc2c([O-])cccc2Cl)CC1 ZINC000124833245 377093959 /nfs/dbraw/zinc/09/39/59/377093959.db2.gz VTAYCCDCWBBBDC-UHFFFAOYSA-N -1 3 299.798 2.673 20 10 CFCDHM C[C@@H]1CCCC[C@H]1N(C)C(=O)c1cccc(O)c1[O-] ZINC000126337890 377221272 /nfs/dbraw/zinc/22/12/72/377221272.db2.gz AONZUTPDYLQYAL-ZYHUDNBSSA-N -1 3 263.337 2.749 20 10 CFCDHM CN(Cc1cc(Cl)cc(Cl)c1[O-])[C@H]1CCOC1 ZINC000156096921 378635421 /nfs/dbraw/zinc/63/54/21/378635421.db2.gz FWHQHELZPBGOLT-JTQLQIEISA-N -1 3 276.163 2.920 20 10 CFCDHM Cc1ccc([C@@H]2CN(Cc3ccccc3[O-])CCO2)o1 ZINC000179584288 380560687 /nfs/dbraw/zinc/56/06/87/380560687.db2.gz AELZJUOHVIAMNA-INIZCTEOSA-N -1 3 273.332 2.867 20 10 CFCDHM [O-]c1ccc(F)cc1CN1CCN(c2cccs2)CC1 ZINC000180206658 380633556 /nfs/dbraw/zinc/63/35/56/380633556.db2.gz NLWIDHXGKBZDMA-UHFFFAOYSA-N -1 3 292.379 2.915 20 10 CFCDHM C[C@@H](C(=O)OC(C)(C)C)N(C)Cc1cc(F)ccc1[O-] ZINC000180209194 380633644 /nfs/dbraw/zinc/63/36/44/380633644.db2.gz ARNGJTSBNFCVAG-JTQLQIEISA-N -1 3 283.343 2.693 20 10 CFCDHM [O-]c1c(Cl)cccc1CN1CC[C@](O)(C(F)(F)F)C1 ZINC000180406218 380652688 /nfs/dbraw/zinc/65/26/88/380652688.db2.gz YIWMQSMVVNQANC-LLVKDONJSA-N -1 3 295.688 2.545 20 10 CFCDHM CC(=O)c1cc(F)cc(CN[C@@H](C)c2ccccn2)c1[O-] ZINC000181795295 380896517 /nfs/dbraw/zinc/89/65/17/380896517.db2.gz TYZQRLAAVQKADL-JTQLQIEISA-N -1 3 288.322 2.980 20 10 CFCDHM C[C@@]1(O)CCCN(Cc2cc(Cl)c(F)cc2[O-])C1 ZINC000295501605 380899186 /nfs/dbraw/zinc/89/91/86/380899186.db2.gz YJZKFAKYVFKKEU-CYBMUJFWSA-N -1 3 273.735 2.532 20 10 CFCDHM Cc1cc(Cl)cc(CN2CCCC3(C2)OCCO3)c1[O-] ZINC000182081861 380987975 /nfs/dbraw/zinc/98/79/75/380987975.db2.gz ILRXFANMAUVAAR-UHFFFAOYSA-N -1 3 297.782 2.693 20 10 CFCDHM Cc1noc([C@H](NCc2ccccc2[O-])c2ccccc2)n1 ZINC000369118731 381197947 /nfs/dbraw/zinc/19/79/47/381197947.db2.gz UDTYMOAZPVAWBR-MRXNPFEDSA-N -1 3 295.342 2.963 20 10 CFCDHM CCn1ccnc1CN[C@@H](C)c1cc(F)ccc1[O-] ZINC000296488575 381419063 /nfs/dbraw/zinc/41/90/63/381419063.db2.gz OOROTQCVNWLIIE-JTQLQIEISA-N -1 3 263.316 2.599 20 10 CFCDHM COc1cc(Cl)cc(CN2CCSC[C@@H]2C)c1[O-] ZINC000184693914 381463775 /nfs/dbraw/zinc/46/37/75/381463775.db2.gz XCGZXFSBPHLCOD-VIFPVBQESA-N -1 3 287.812 2.992 20 10 CFCDHM CCc1nnc(CN[C@H]2CCc3cccc([O-])c32)s1 ZINC000297461108 381560913 /nfs/dbraw/zinc/56/09/13/381560913.db2.gz XTZKDXZFYUJPIM-JTQLQIEISA-N -1 3 275.377 2.583 20 10 CFCDHM CO[C@H]1CCCN(Cc2cc(F)cc(C(C)=O)c2[O-])CC1 ZINC000374690722 382053091 /nfs/dbraw/zinc/05/30/91/382053091.db2.gz BNHZOIQFOYPTCH-AWEZNQCLSA-N -1 3 295.354 2.735 20 10 CFCDHM COc1ccc2c(c1)OCCN(Cc1ccccc1[O-])C2 ZINC000376693172 382165445 /nfs/dbraw/zinc/16/54/45/382165445.db2.gz FAAGDDMYSHVCNH-UHFFFAOYSA-N -1 3 285.343 2.795 20 10 CFCDHM [O-]c1cccc(Cl)c1CN1CCC2(CC1)OCCCO2 ZINC000293648678 382213398 /nfs/dbraw/zinc/21/33/98/382213398.db2.gz MWOWDTBGNBZMTE-UHFFFAOYSA-N -1 3 297.782 2.775 20 10 CFCDHM C[C@H](C1CC1)N(C(=O)c1cccc(O)c1[O-])C1CC1 ZINC000188300325 382387865 /nfs/dbraw/zinc/38/78/65/382387865.db2.gz BFAQOAUUHFZLIY-SECBINFHSA-N -1 3 261.321 2.501 20 10 CFCDHM CCCO[C@H]1CCCN(C(=O)c2cccc(O)c2[O-])CC1 ZINC000188447550 382415173 /nfs/dbraw/zinc/41/51/73/382415173.db2.gz IEEBVUCFUQDOII-LBPRGKRZSA-N -1 3 293.363 2.519 20 10 CFCDHM CCn1cc([C@H](C)NCc2cccc(F)c2[O-])cn1 ZINC000294834069 382534156 /nfs/dbraw/zinc/53/41/56/382534156.db2.gz LUPRVVYTRXNSPW-JTQLQIEISA-N -1 3 263.316 2.599 20 10 CFCDHM C[C@@H](O)C[C@@H]1CCCN1Cc1cc(Cl)c(F)cc1[O-] ZINC000295274042 382604897 /nfs/dbraw/zinc/60/48/97/382604897.db2.gz HWOJMMUSYAMPOM-KOLCDFICSA-N -1 3 287.762 2.920 20 10 CFCDHM COC[C@@H](C)N(C)Cc1cc(Cl)c(F)cc1[O-] ZINC000295316871 382615245 /nfs/dbraw/zinc/61/52/45/382615245.db2.gz LAJQOPPPXGOLTQ-MRVPVSSYSA-N -1 3 261.724 2.651 20 10 CFCDHM O=C(N[C@@H]1[C@H]2CCc3ccccc3[C@@H]12)c1cccc(O)c1[O-] ZINC000189523653 382619936 /nfs/dbraw/zinc/61/99/36/382619936.db2.gz IQTVUHJBBWEHST-APHBMKBZSA-N -1 3 295.338 2.556 20 10 CFCDHM CCN(Cc1cccc(Cl)c1[O-])C[C@H](O)C(F)(F)F ZINC000189876491 382643589 /nfs/dbraw/zinc/64/35/89/382643589.db2.gz ZAHLPFZUYJFHCR-JTQLQIEISA-N -1 3 297.704 2.791 20 10 CFCDHM Cn1cnnc1[C@H]1CCCN1Cc1c([O-])cccc1Cl ZINC000271167963 385358919 /nfs/dbraw/zinc/35/89/19/385358919.db2.gz CSFFPLFSERVJOP-GFCCVEGCSA-N -1 3 292.770 2.511 20 10 CFCDHM Cn1cnnc1[C@@H]1CCCN1Cc1c([O-])cccc1Cl ZINC000271167964 385359498 /nfs/dbraw/zinc/35/94/98/385359498.db2.gz CSFFPLFSERVJOP-LBPRGKRZSA-N -1 3 292.770 2.511 20 10 CFCDHM CCCN(CC1CC1)C(=O)c1ccc(C)c(O)c1[O-] ZINC000271235777 385377892 /nfs/dbraw/zinc/37/78/92/385377892.db2.gz CIYHZARFFMWBFJ-UHFFFAOYSA-N -1 3 263.337 2.668 20 10 CFCDHM COc1cc(Cl)cc(CN(C)Cc2ccon2)c1[O-] ZINC000273722821 385694269 /nfs/dbraw/zinc/69/42/69/385694269.db2.gz INIABCPUWGFFTI-UHFFFAOYSA-N -1 3 282.727 2.674 20 10 CFCDHM COCCN(Cc1ccco1)Cc1cc(F)ccc1[O-] ZINC000179939215 393472338 /nfs/dbraw/zinc/47/23/38/393472338.db2.gz RGRHGITZBRQZAE-UHFFFAOYSA-N -1 3 279.311 2.773 20 10 CFCDHM C[C@H]1CCCC[C@@H]1NC(=O)CN(C)Cc1ccccc1[O-] ZINC000109770307 393879767 /nfs/dbraw/zinc/87/97/67/393879767.db2.gz JWVNDAHBBGERQC-ZFWWWQNUSA-N -1 3 290.407 2.519 20 10 CFCDHM CC[C@]1(C)CCCN(C(=O)c2cccc(O)c2[O-])C1 ZINC000193106886 288439889 /nfs/dbraw/zinc/43/98/89/288439889.db2.gz WDSLCPREBLFGPN-OAHLLOKOSA-N -1 3 263.337 2.750 20 10 CFCDHM CC[C@@H]1CC[C@H](C)N1C(=O)c1ccc(C)c(O)c1[O-] ZINC000272963760 287118759 /nfs/dbraw/zinc/11/87/59/287118759.db2.gz JWTHXWKGGCADOE-WDEREUQCSA-N -1 3 263.337 2.809 20 10 CFCDHM [O-]c1ccc(Cl)cc1CN1CC([C@@H]2CCOC2)C1 ZINC000369868723 267273155 /nfs/dbraw/zinc/27/31/55/267273155.db2.gz UHMUGMZFNXDWOA-SNVBAGLBSA-N -1 3 267.756 2.514 20 10 CFCDHM CC[C@@H](N[C@@H]1CCCn2c(C)nnc21)c1ccccc1[O-] ZINC000369972374 267280574 /nfs/dbraw/zinc/28/05/74/267280574.db2.gz FMVJGPFLYCPZGF-ZIAGYGMSSA-N -1 3 286.379 2.868 20 10 CFCDHM O=C(c1cccc(O)c1[O-])N1C[C@@H]2CCCCC[C@@H]21 ZINC000370492278 267322775 /nfs/dbraw/zinc/32/27/75/267322775.db2.gz PUGHLASQWUYGIS-JQWIXIFHSA-N -1 3 261.321 2.503 20 10 CFCDHM CC(=O)c1cc(Cl)cc(CN2CCC(C)(O)CC2)c1[O-] ZINC000161200801 278244002 /nfs/dbraw/zinc/24/40/02/278244002.db2.gz GHFOXVLUUSCQIR-UHFFFAOYSA-N -1 3 297.782 2.595 20 10 CFCDHM C[C@H](N[C@@H]1CCCc2c[nH]nc21)c1ccc(F)cc1[O-] ZINC000273496058 290014063 /nfs/dbraw/zinc/01/40/63/290014063.db2.gz PBLFQZZTJISEJK-TVQRCGJNSA-N -1 3 275.327 2.983 20 10 CFCDHM CCn1ncc(CN[C@H](C)c2cc(Cl)cc(C)c2[O-])n1 ZINC000527924554 330296417 /nfs/dbraw/zinc/29/64/17/330296417.db2.gz QIPHKHWPJJTHES-SNVBAGLBSA-N -1 3 294.786 2.816 20 10 CFCDHM C[C@@H]1[C@@H](C(=O)NCc2ccc3cccnc3c2[O-])[C@@H]1C1CC1 ZINC000529501710 333491192 /nfs/dbraw/zinc/49/11/92/333491192.db2.gz NMRFEYOCHMAVMJ-NZVBXONLSA-N -1 3 296.370 2.849 20 10 CFCDHM CCC[C@@H](C)C(=O)NCCNCc1c([O-])cccc1Cl ZINC000292684882 520607666 /nfs/dbraw/zinc/60/76/66/520607666.db2.gz NBPQOBAOFAYOQY-LLVKDONJSA-N -1 3 298.814 2.688 20 10 CFCDHM CCC(=O)N(CC)Cc1cc(Br)ccc1[O-] ZINC000075416908 521087524 /nfs/dbraw/zinc/08/75/24/521087524.db2.gz SSWBEALUDYAXNA-UHFFFAOYSA-N -1 3 286.169 2.913 20 10 CFCDHM CC[C@@H](C)N(CCO)Cc1cc(Cl)cc(C(C)=O)c1[O-] ZINC000287503536 522090447 /nfs/dbraw/zinc/09/04/47/522090447.db2.gz UDJQWKXTWZICGE-SNVBAGLBSA-N -1 3 299.798 2.841 20 10 CFCDHM CO[C@@H]1CCCN(Cc2c([O-])cccc2Cl)C1 ZINC000218993967 523599498 /nfs/dbraw/zinc/59/94/98/523599498.db2.gz KJVFSPALRFMUNW-SNVBAGLBSA-N -1 3 255.745 2.656 20 10 CFCDHM CC[C@@]1(C)CCCN(C(=O)c2cccc(O)c2[O-])C1 ZINC000193106901 523706798 /nfs/dbraw/zinc/70/67/98/523706798.db2.gz WDSLCPREBLFGPN-HNNXBMFYSA-N -1 3 263.337 2.750 20 10 CFCDHM C[C@H]1CN(Cc2cc(F)ccc2[O-])C[C@H](C2CC2)O1 ZINC000280105689 524611616 /nfs/dbraw/zinc/61/16/16/524611616.db2.gz AZOLCVUHYHSWTH-ZUZCIYMTSA-N -1 3 265.328 2.531 20 10 CFCDHM C[C@H](NC[C@@](C)(O)C(F)(F)F)c1ccc(F)c(F)c1[O-] ZINC000276925932 525401847 /nfs/dbraw/zinc/40/18/47/525401847.db2.gz NHYNQYFSFZTMAU-UPONEAKYSA-N -1 3 299.239 2.634 20 10 CFCDHM C[C@@H](N[C@@H](C)c1cn[nH]c1)c1ccc(F)c(F)c1[O-] ZINC000276908158 525620088 /nfs/dbraw/zinc/62/00/88/525620088.db2.gz KGJCCSXYFNNTPC-JGVFFNPUSA-N -1 3 267.279 2.805 20 10 CFCDHM [O-]c1ccc(Br)cc1CNCC(F)F ZINC000236615510 526341058 /nfs/dbraw/zinc/34/10/58/526341058.db2.gz PIWVMPQRLXIJBO-UHFFFAOYSA-N -1 3 266.085 2.509 20 10 CFCDHM [O-]c1ccc(F)cc1CN1CC[C@@H](n2cc(Cl)cn2)C1 ZINC000290814538 526348467 /nfs/dbraw/zinc/34/84/67/526348467.db2.gz GJKWQKDRXHEHHT-CYBMUJFWSA-N -1 3 295.745 2.828 20 10 CFCDHM [O-]c1ccc(F)cc1CN1CCCC[C@H]1c1cc[nH]n1 ZINC000289612273 526349570 /nfs/dbraw/zinc/34/95/70/526349570.db2.gz VWQGDGXMYBIDAB-AWEZNQCLSA-N -1 3 275.327 2.982 20 10 CFCDHM CCC[C@@](C)([NH2+]Cc1cc(C)c(C)cc1[O-])C(=O)[O-] ZINC000736962912 574087840 /nfs/dbraw/zinc/08/78/40/574087840.db2.gz QHDOGKZIAKTTQW-OAHLLOKOSA-N -1 3 265.353 2.742 20 10 CFCDHM CC[N@H+](CCC(=O)[O-])Cc1cc(C(C)(C)C)cc(O)c1[O-] ZINC000737096072 574111004 /nfs/dbraw/zinc/11/10/04/574111004.db2.gz KCKBDZALIXRXFW-UHFFFAOYSA-N -1 3 295.379 2.692 20 10 CFCDHM CC[N@@H+](CCC(=O)[O-])Cc1cc(C(C)(C)C)cc(O)c1[O-] ZINC000737096072 574111008 /nfs/dbraw/zinc/11/10/08/574111008.db2.gz KCKBDZALIXRXFW-UHFFFAOYSA-N -1 3 295.379 2.692 20 10 CFCDHM CCOc1ccc(C[NH2+]C2CCC(C(=O)[O-])CC2)c([O-])c1 ZINC000737204804 574118558 /nfs/dbraw/zinc/11/85/58/574118558.db2.gz XRLUAGJWGSPQOJ-UHFFFAOYSA-N -1 3 293.363 2.524 20 10 CFCDHM O=C(OCC[C@@H]1CCCCO1)c1cc([O-])cs1 ZINC000754814944 574122505 /nfs/dbraw/zinc/12/25/05/574122505.db2.gz HWFOTMIDTMDJEF-JTQLQIEISA-N -1 3 256.323 2.570 20 10 CFCDHM CCO[C@H]1C[C@H](N(C)C(=O)c2cc([O-])cs2)C1(C)C ZINC000754905149 574127531 /nfs/dbraw/zinc/12/75/31/574127531.db2.gz CWQLMUJSFIQFEY-RYUDHWBXSA-N -1 3 283.393 2.729 20 10 CFCDHM CC(C)(C)CCN1CCN(C(=O)c2cc([O-])cs2)CC1 ZINC000731869998 574131317 /nfs/dbraw/zinc/13/13/17/574131317.db2.gz GRBOVGAANOCBLR-UHFFFAOYSA-N -1 3 296.436 2.648 20 10 CFCDHM C[C@@H]1CCCC[C@@H]1OCCNC(=O)c1cc([O-])cs1 ZINC000731870225 574131430 /nfs/dbraw/zinc/13/14/30/574131430.db2.gz VNIFANXQKKWLDC-PWSUYJOCSA-N -1 3 283.393 2.779 20 10 CFCDHM C[C@@H](NC(=O)c1cc([O-])cs1)c1nc2ccccc2[nH]1 ZINC000731868330 574132649 /nfs/dbraw/zinc/13/26/49/574132649.db2.gz CMSVKWHZBHWELV-MRVPVSSYSA-N -1 3 287.344 2.821 20 10 CFCDHM COCc1cccc(NC(=O)c2cc([O-])cs2)c1 ZINC000731868377 574132770 /nfs/dbraw/zinc/13/27/70/574132770.db2.gz FPCNPZVSTVZGOQ-UHFFFAOYSA-N -1 3 263.318 2.852 20 10 CFCDHM CC[C@H]1CN(Cc2c([O-])ccc3ccncc32)C[C@@H](C)O1 ZINC000732183985 574145463 /nfs/dbraw/zinc/14/54/63/574145463.db2.gz CFWDVLYKUDCJNU-OCCSQVGLSA-N -1 3 286.375 2.940 20 10 CFCDHM Cc1ccc(OC[C@@H](C)NC(=O)c2cc([O-])cs2)cc1 ZINC000732278397 574147850 /nfs/dbraw/zinc/14/78/50/574147850.db2.gz LAZPPKJWXOSUOV-LLVKDONJSA-N -1 3 291.372 2.959 20 10 CFCDHM O=C(N[C@@H]1C[C@H]1c1cccc(F)c1)c1cc([O-])cs1 ZINC000732278416 574147961 /nfs/dbraw/zinc/14/79/61/574147961.db2.gz MDZAACWCRLSVOE-NWDGAFQWSA-N -1 3 277.320 2.879 20 10 CFCDHM CC(=O)c1cccc(NC(=O)c2cc([O-])cs2)c1 ZINC000732266850 574148051 /nfs/dbraw/zinc/14/80/51/574148051.db2.gz OBIZPHKLDGYXRO-UHFFFAOYSA-N -1 3 261.302 2.909 20 10 CFCDHM CCc1nc([C@@H](C)NC(=O)c2cc([O-])cs2)cs1 ZINC000732302219 574149529 /nfs/dbraw/zinc/14/95/29/574149529.db2.gz DORMCZDPFKUQHC-SSDOTTSWSA-N -1 3 282.390 2.964 20 10 CFCDHM COCc1cc(CNC(=O)c2cc([O-])cs2)ccc1F ZINC000732290151 574150625 /nfs/dbraw/zinc/15/06/25/574150625.db2.gz QQQHAGXJZQVIAN-UHFFFAOYSA-N -1 3 295.335 2.669 20 10 CFCDHM COc1ccc(C2(NC(=O)c3cc([O-])cs3)CC2)cc1 ZINC000732291048 574150787 /nfs/dbraw/zinc/15/07/87/574150787.db2.gz NYCUZGHMKUCMDZ-UHFFFAOYSA-N -1 3 289.356 2.881 20 10 CFCDHM COc1cccc(C[C@H](C)NC(=O)c2cc([O-])cs2)c1 ZINC000733002983 574182686 /nfs/dbraw/zinc/18/26/86/574182686.db2.gz QIUPQWRQLBSVHD-JTQLQIEISA-N -1 3 291.372 2.823 20 10 CFCDHM [O-]c1cccc(Cl)c1CNCc1ccc(CO)c(F)c1 ZINC000733325513 574221652 /nfs/dbraw/zinc/22/16/52/574221652.db2.gz PZFCTIFWFNETAN-UHFFFAOYSA-N -1 3 295.741 2.967 20 10 CFCDHM CCOc1ccc(CNC(C)(C)c2noc(C)n2)c([O-])c1 ZINC000729854947 574234303 /nfs/dbraw/zinc/23/43/03/574234303.db2.gz KUKNQSUUMQRLOH-UHFFFAOYSA-N -1 3 291.351 2.507 20 10 CFCDHM C[C@@H](NCc1nccs1)c1cc(F)cc(F)c1[O-] ZINC000756444788 574238224 /nfs/dbraw/zinc/23/82/24/574238224.db2.gz WTWWBLRERMDBQK-SSDOTTSWSA-N -1 3 270.304 2.978 20 10 CFCDHM O=C([O-])c1ccc(CNCc2c(O)cccc2Cl)o1 ZINC000740133097 574238923 /nfs/dbraw/zinc/23/89/23/574238923.db2.gz VFSKEBCCJSBIFP-UHFFFAOYSA-N -1 3 281.695 2.627 20 10 CFCDHM Cc1nn(C)c(C)c1CN[C@@H](C)c1cc(F)cc(F)c1[O-] ZINC000756513262 574242768 /nfs/dbraw/zinc/24/27/68/574242768.db2.gz GNVAOBJCGGWBNN-QMMMGPOBSA-N -1 3 295.333 2.872 20 10 CFCDHM C[C@@H]1C[C@H](NCc2cc[nH]n2)c2c1c(F)ccc2[O-] ZINC000756554919 574246917 /nfs/dbraw/zinc/24/69/17/574246917.db2.gz KBBIYLYKCDKLOV-KCJUWKMLSA-N -1 3 261.300 2.593 20 10 CFCDHM C[C@@H](CNC(=O)c1cc([O-])cs1)Oc1ccccc1 ZINC000733806498 574256673 /nfs/dbraw/zinc/25/66/73/574256673.db2.gz FCVMLCFBOVPUQN-JTQLQIEISA-N -1 3 277.345 2.651 20 10 CFCDHM C[C@H]1C[C@@H](NCc2ccn(C)n2)c2c1c(F)ccc2[O-] ZINC000756776971 574262316 /nfs/dbraw/zinc/26/23/16/574262316.db2.gz FEHFNOAGWWYREI-JOYOIKCWSA-N -1 3 275.327 2.603 20 10 CFCDHM C[C@H]1C[C@H](NCc2ccn(C)n2)c2c1c(F)ccc2[O-] ZINC000756776970 574262344 /nfs/dbraw/zinc/26/23/44/574262344.db2.gz FEHFNOAGWWYREI-CABZTGNLSA-N -1 3 275.327 2.603 20 10 CFCDHM CS[C@@H]1CCC[C@H](NC(=O)c2cc([O-])cs2)C1 ZINC000735330311 574321084 /nfs/dbraw/zinc/32/10/84/574321084.db2.gz HVRTUVXSEMEZAV-WCBMZHEXSA-N -1 3 271.407 2.858 20 10 CFCDHM O=C(NCCCc1ccc(O)cc1)c1cc([O-])cs1 ZINC000735702949 574333763 /nfs/dbraw/zinc/33/37/63/574333763.db2.gz UAISBIXWWYYEGH-UHFFFAOYSA-N -1 3 277.345 2.522 20 10 CFCDHM Cc1cc(C(=O)COC(=O)c2cc([O-])cs2)ccc1F ZINC000750347126 574334573 /nfs/dbraw/zinc/33/45/73/574334573.db2.gz JKQSNZWEWMSVOL-UHFFFAOYSA-N -1 3 294.303 2.941 20 10 CFCDHM CCO[C@@H]1C[C@H](NC(=O)c2cc([O-])cs2)C12CCC2 ZINC000743630452 574369795 /nfs/dbraw/zinc/36/97/95/574369795.db2.gz TWHXBYNUGJZGQM-NWDGAFQWSA-N -1 3 281.377 2.531 20 10 CFCDHM CC(C)C1CCN(C(=O)c2cc([O-])cs2)CC1 ZINC000743712586 574371053 /nfs/dbraw/zinc/37/10/53/574371053.db2.gz VATVVDSXGQNDIF-UHFFFAOYSA-N -1 3 253.367 2.962 20 10 CFCDHM Cc1ccc(O[C@H](C)CNC(=O)c2cc([O-])cs2)cc1 ZINC000743720163 574371237 /nfs/dbraw/zinc/37/12/37/574371237.db2.gz STRASPZJQJAVTQ-LLVKDONJSA-N -1 3 291.372 2.959 20 10 CFCDHM C[C@H](CNC(=O)c1cc([O-])cs1)Oc1ccccc1F ZINC000743720888 574371301 /nfs/dbraw/zinc/37/13/01/574371301.db2.gz DTBHHDYYWRMMOZ-SECBINFHSA-N -1 3 295.335 2.790 20 10 CFCDHM CN(CCc1cccs1)C(=O)c1cc([O-])cs1 ZINC000743753949 574371608 /nfs/dbraw/zinc/37/16/08/574371608.db2.gz VNTPVJMYLCNVJA-UHFFFAOYSA-N -1 3 267.375 2.830 20 10 CFCDHM CCO[C@@H]1C[C@H](NC(=O)c2cc([O-])cs2)C12CCCC2 ZINC000743790884 574372146 /nfs/dbraw/zinc/37/21/46/574372146.db2.gz OLRCGRPGHXEKMG-QWHCGFSZSA-N -1 3 295.404 2.921 20 10 CFCDHM Cc1noc(C)c1[C@H](C)CNC(=O)c1cc([O-])cs1 ZINC000752632720 574393322 /nfs/dbraw/zinc/39/33/22/574393322.db2.gz XZWBZHMYPJYDIV-SSDOTTSWSA-N -1 3 280.349 2.592 20 10 CFCDHM O=C(c1cc([O-])cs1)N1CCS[C@@H]2CCCC[C@H]21 ZINC000752823986 574395607 /nfs/dbraw/zinc/39/56/07/574395607.db2.gz GILPJXAUKAJDQU-GHMZBOCLSA-N -1 3 283.418 2.954 20 10 CFCDHM CCn1ccc(CN[C@H](C)c2ccc(F)cc2[O-])n1 ZINC000840841705 617772417 /nfs/dbraw/zinc/77/24/17/617772417.db2.gz ZAWMTXFOQAKTCI-SNVBAGLBSA-N -1 3 263.316 2.599 20 10 CFCDHM C[C@@H](O)c1cc(NC(=O)c2cccc(O)c2[O-])ccc1F ZINC000804803377 617889800 /nfs/dbraw/zinc/88/98/00/617889800.db2.gz LXEIQCNNSBRPGV-MRVPVSSYSA-N -1 3 291.278 2.543 20 10 CFCDHM CCOC(=O)CN(Cc1cc(Cl)ccc1[O-])C(C)C ZINC000179424689 618275440 /nfs/dbraw/zinc/27/54/40/618275440.db2.gz MBVZPQAVBUXOQG-UHFFFAOYSA-N -1 3 285.771 2.819 20 10 CFCDHM CCc1cccc(S(=O)(=O)[N-]c2ccc(O)cc2)c1 ZINC000182419994 625299584 /nfs/dbraw/zinc/29/95/84/625299584.db2.gz RAWGUSMFGCASOU-UHFFFAOYSA-N -1 3 277.345 2.755 20 10 CFCDHM [O-]c1c(Cl)cccc1CNCc1nccs1 ZINC000162828808 619064682 /nfs/dbraw/zinc/06/46/82/619064682.db2.gz MCPTVIKEMKUDMO-UHFFFAOYSA-N -1 3 254.742 2.792 20 10 CFCDHM Cc1nnc([C@@H](C)NCc2c([O-])cc(C)cc2Cl)[nH]1 ZINC000894779431 619464201 /nfs/dbraw/zinc/46/42/01/619464201.db2.gz YDRFZXOLQKLIDA-MRVPVSSYSA-N -1 3 280.759 2.631 20 10 CFCDHM [O-]c1cccc(F)c1CNCc1nc2c(s1)CCC2 ZINC000896638798 619781145 /nfs/dbraw/zinc/78/11/45/619781145.db2.gz XFVCLJZIOMCPJG-UHFFFAOYSA-N -1 3 278.352 2.766 20 10 CFCDHM C[C@H]1CCC[C@H]1CC(=O)NCc1c([O-])cccc1F ZINC000928707710 619996441 /nfs/dbraw/zinc/99/64/41/619996441.db2.gz GYDIOPYFOIRGEW-QWRGUYRKSA-N -1 3 265.328 2.974 20 10 CFCDHM CCn1cnc2c1CCN(Cc1c([O-])cccc1Cl)C2 ZINC000897336259 619999432 /nfs/dbraw/zinc/99/94/32/619999432.db2.gz APJOTXSQQQXORG-UHFFFAOYSA-N -1 3 291.782 2.820 20 10 CFCDHM Cn1ncc(Cl)c1CNCc1cccc(Cl)c1[O-] ZINC000898218281 620347172 /nfs/dbraw/zinc/34/71/72/620347172.db2.gz CQASJGDCBOOVGX-UHFFFAOYSA-N -1 3 286.162 2.722 20 10 CFCDHM C[C@@H](NCc1cn(C)cn1)c1cccc(C(F)(F)F)c1[O-] ZINC000903351367 621342995 /nfs/dbraw/zinc/34/29/95/621342995.db2.gz KELXCVOPBPITHV-SECBINFHSA-N -1 3 299.296 2.995 20 10 CFCDHM O=C(NCC[C@H]1CCc2ccccc21)c1cccc(O)c1[O-] ZINC000833398321 625565410 /nfs/dbraw/zinc/56/54/10/625565410.db2.gz DTBKCPUSVBWNEF-CYBMUJFWSA-N -1 3 297.354 2.948 20 10 CFCDHM C[C@@H]1C[C@H](C)[C@@H](C)N(C(=O)c2cccc(O)c2[O-])C1 ZINC000229426486 623203931 /nfs/dbraw/zinc/20/39/31/623203931.db2.gz QKIVEIKKPMXAQF-OUAUKWLOSA-N -1 3 263.337 2.604 20 10 CFCDHM Cc1cc([O-])c(CN2C[C@@H](C)O[C@@H](C)C2)cc1Cl ZINC000824474848 623511283 /nfs/dbraw/zinc/51/12/83/623511283.db2.gz UQXLCCDFBCOUTI-PHIMTYICSA-N -1 3 269.772 2.963 20 10 CFCDHM Cc1cc([O-])c(CN(C)Cc2cnccn2)cc1Cl ZINC000824632921 623535490 /nfs/dbraw/zinc/53/54/90/623535490.db2.gz UJKRNIRQHDOKTL-UHFFFAOYSA-N -1 3 277.755 2.776 20 10 CFCDHM C[C@H]1CCCC[C@@H]1NC(=O)NCc1c([O-])cccc1F ZINC000913856854 623622721 /nfs/dbraw/zinc/62/27/21/623622721.db2.gz QQTBGPHBIQGXNU-GWCFXTLKSA-N -1 3 280.343 2.909 20 10 CFCDHM C[C@H](Cc1ccco1)NC(=O)NCc1c([O-])cccc1F ZINC000914106303 623697667 /nfs/dbraw/zinc/69/76/67/623697667.db2.gz CPJBCHZNSPXIGR-SNVBAGLBSA-N -1 3 292.310 2.555 20 10 CFCDHM CN(Cc1cnc[nH]1)Cc1cc(Cl)cc(F)c1[O-] ZINC000826769639 623869235 /nfs/dbraw/zinc/86/92/35/623869235.db2.gz PQBVQCVZUKCIJS-UHFFFAOYSA-N -1 3 269.707 2.540 20 10 CFCDHM C[C@@H]1CN(Cc2c([O-])ccc(Cl)c2F)C[C@H](C)[C@H]1O ZINC000827151408 623953737 /nfs/dbraw/zinc/95/37/37/623953737.db2.gz AGXLMAONTFMDEX-QRJZZWFUSA-N -1 3 287.762 2.633 20 10 CFCDHM C[C@H](NCc1cccc(Cl)c1[O-])c1nccn1C ZINC000827722139 624075625 /nfs/dbraw/zinc/07/56/25/624075625.db2.gz ALLFXOJXUSHFPD-VIFPVBQESA-N -1 3 265.744 2.630 20 10 CFCDHM C[C@H]1CCC[C@H](C2CN(C(=O)c3cccc(O)c3[O-])C2)C1 ZINC000829119598 624377248 /nfs/dbraw/zinc/37/72/48/624377248.db2.gz OQECZDPMAHKWHH-RYUDHWBXSA-N -1 3 289.375 2.996 20 10 CFCDHM O=C(NCCCC1CC1)NCc1c([O-])cccc1F ZINC000919444462 624574468 /nfs/dbraw/zinc/57/44/68/624574468.db2.gz BNSGPLOIHAJVAN-UHFFFAOYSA-N -1 3 266.316 2.521 20 10 CFCDHM O=C(C[C@@H]1CC=CCC1)NCc1c([O-])cccc1F ZINC000830179636 624658526 /nfs/dbraw/zinc/65/85/26/624658526.db2.gz BHZUXMZCKGHQHO-LLVKDONJSA-N -1 3 263.312 2.894 20 10 CFCDHM O=C(NCc1c([O-])cccc1F)NCC(C1CC1)C1CC1 ZINC000920803304 624772752 /nfs/dbraw/zinc/77/27/52/624772752.db2.gz NVXZKVCOGFHRLK-UHFFFAOYSA-N -1 3 292.354 2.767 20 10 CFCDHM CC1(C)CCC[C@@H]1NC(=O)NCc1c([O-])cccc1F ZINC000921351744 624852731 /nfs/dbraw/zinc/85/27/31/624852731.db2.gz SWVSCNPTGVBKKQ-ZDUSSCGKSA-N -1 3 280.343 2.909 20 10 CFCDHM Cc1cccc2c1CCN2C(=O)c1ccc(C)c(O)c1[O-] ZINC000182253127 625276887 /nfs/dbraw/zinc/27/68/87/625276887.db2.gz FYVMKCCOXCFAKK-UHFFFAOYSA-N -1 3 283.327 2.918 20 10 CFCDHM Cc1cccc2c1N(C(=O)c1cccc(O)c1[O-])CC2 ZINC000185796410 625779323 /nfs/dbraw/zinc/77/93/23/625779323.db2.gz COEFWFALGHOUCW-UHFFFAOYSA-N -1 3 269.300 2.609 20 10 CFCDHM C[C@@H](N[C@@H]1CCn2ccnc21)c1cc(F)cc(F)c1[O-] ZINC000834830672 625891331 /nfs/dbraw/zinc/89/13/31/625891331.db2.gz GFDUVOHLUAQGAX-PRHODGIISA-N -1 3 279.290 2.663 20 10 CFCDHM O=C(NCc1c([O-])cccc1F)N[C@@H]1CCC[C@H]2C[C@H]21 ZINC000923047672 626446280 /nfs/dbraw/zinc/44/62/80/626446280.db2.gz WYRZJRRHCGBNOJ-OPQQBVKSSA-N -1 3 278.327 2.519 20 10 CFCDHM O=C(N[C@@H](Cc1ccccc1)C1CC1)c1cccc(O)c1[O-] ZINC000187111530 626454246 /nfs/dbraw/zinc/45/42/46/626454246.db2.gz ZKFNQBPQNUQZRD-HNNXBMFYSA-N -1 3 297.354 2.849 20 10 CFCDHM O=C(NCc1c([O-])cccc1F)NC[C@@H]1CCC[C@H]2C[C@H]21 ZINC000923277622 626462552 /nfs/dbraw/zinc/46/25/52/626462552.db2.gz NKCSGVYKACVQSK-SDDRHHMPSA-N -1 3 292.354 2.767 20 10 CFCDHM CC(C)[C@H](NC(=O)NCc1c([O-])cccc1F)C1CC1 ZINC000923327127 626466780 /nfs/dbraw/zinc/46/67/80/626466780.db2.gz NSHJIWPPYIGQFT-AWEZNQCLSA-N -1 3 280.343 2.765 20 10 CFCDHM O=C(NCc1c([O-])cccc1F)NC[C@@H]1CC[C@H]2C[C@H]2C1 ZINC000923387013 626470296 /nfs/dbraw/zinc/47/02/96/626470296.db2.gz ILDHFEIRLICIIM-GRYCIOLGSA-N -1 3 292.354 2.767 20 10 CFCDHM C[C@@H](NCc1cccc(Cl)c1[O-])c1ccn(C)n1 ZINC000839190638 626530500 /nfs/dbraw/zinc/53/05/00/626530500.db2.gz JBVIAHQGJDHTBM-SECBINFHSA-N -1 3 265.744 2.630 20 10 CFCDHM Cc1cc(C)c(NC(=O)c2ccc(C)c(O)c2[O-])cc1O ZINC000762702659 626930781 /nfs/dbraw/zinc/93/07/81/626930781.db2.gz GTOGGTWKQPBZEM-UHFFFAOYSA-N -1 3 287.315 2.981 20 10 CFCDHM CC(C)OC[C@H]1CN(Cc2c([O-])cccc2Cl)CCO1 ZINC000770687834 627541533 /nfs/dbraw/zinc/54/15/33/627541533.db2.gz FSMRVOAPMVZPJX-GFCCVEGCSA-N -1 3 299.798 2.671 20 10 CFCDHM C[C@@H]1COCCN(Cc2cc(Cl)cc(F)c2[O-])C1 ZINC000775705762 628056549 /nfs/dbraw/zinc/05/65/49/628056549.db2.gz LBWLEUOWGVVTCR-VIFPVBQESA-N -1 3 273.735 2.653 20 10 CFCDHM Cc1cc(N(C)C)ccc1NC(=O)c1cccc(O)c1[O-] ZINC000776336362 628132949 /nfs/dbraw/zinc/13/29/49/628132949.db2.gz KYWAGXIHYPEPDC-UHFFFAOYSA-N -1 3 286.331 2.725 20 10 CFCDHM CC(=O)c1cc(F)cc(CN2CC[C@@H](C)[C@H](F)C2)c1[O-] ZINC000778239814 628291214 /nfs/dbraw/zinc/29/12/14/628291214.db2.gz VBVBPDKIMDNWGM-YMTOWFKASA-N -1 3 283.318 2.914 20 10 CFCDHM CCc1csc(NC(=O)c2ccc(C)c(O)c2[O-])n1 ZINC000780933091 628506001 /nfs/dbraw/zinc/50/60/01/628506001.db2.gz YXQRBDLEFGAEMO-UHFFFAOYSA-N -1 3 278.333 2.677 20 10 CFCDHM COc1cccc([C@@H](C)NC(=O)c2cccc(O)c2[O-])c1 ZINC000790528942 629245646 /nfs/dbraw/zinc/24/56/46/629245646.db2.gz VMGGTWOULYGYCB-SNVBAGLBSA-N -1 3 287.315 2.597 20 10 CFCDHM Cc1ccc2c(c1)CC[C@H]2NC(=O)c1cccc(O)c1[O-] ZINC000790571238 629248837 /nfs/dbraw/zinc/24/88/37/629248837.db2.gz DJDYAVRBVMJJIE-CQSZACIVSA-N -1 3 283.327 2.824 20 10 CFCDHM C[C@]1(c2ccccc2)C[C@@H]1NC(=O)c1cccc(O)c1[O-] ZINC000790785319 629262575 /nfs/dbraw/zinc/26/25/75/629262575.db2.gz LMBVCKVFXUPTPG-WMLDXEAASA-N -1 3 283.327 2.558 20 10 CFCDHM Cc1cc(CN[C@H](C)c2cc(F)cc(F)c2[O-])n(C)n1 ZINC000793562518 629572394 /nfs/dbraw/zinc/57/23/94/629572394.db2.gz VLVUECDYJCUVKE-SECBINFHSA-N -1 3 281.306 2.563 20 10 CFCDHM CC[C@H](NCc1ccn(C)n1)c1ccc(F)cc1[O-] ZINC000796853724 629979950 /nfs/dbraw/zinc/97/99/50/629979950.db2.gz PZEHMEYHRVYRAX-ZDUSSCGKSA-N -1 3 263.316 2.506 20 10 CFCDHM O=C(NCC1(C2CCC2)CCC1)c1cccc(O)c1[O-] ZINC000837217721 630979449 /nfs/dbraw/zinc/97/94/49/630979449.db2.gz PUCGBJMYPJUORI-UHFFFAOYSA-N -1 3 275.348 2.798 20 10 CFCDHM CCO[C@H]1CCCN(Cc2cc(F)cc(C(C)=O)c2[O-])C1 ZINC000042423874 649999207 /nfs/dbraw/zinc/99/92/07/649999207.db2.gz UXVUKYCTDQFJOH-AWEZNQCLSA-N -1 3 295.354 2.735 20 10 CFCDHM Cc1cc([O-])c(CN2C[C@@H](C)O[C@@H](C)C2)c(Cl)c1 ZINC000840908205 631258303 /nfs/dbraw/zinc/25/83/03/631258303.db2.gz PWVYSSWZWSCTMC-PHIMTYICSA-N -1 3 269.772 2.963 20 10 CFCDHM Cc1cc([O-])c(CN(C)Cc2nccn2C)c(Cl)c1 ZINC000840936149 631268589 /nfs/dbraw/zinc/26/85/89/631268589.db2.gz FKYXZZGEKFTPAD-UHFFFAOYSA-N -1 3 279.771 2.720 20 10 CFCDHM COC[C@@H]1CN(Cc2c([O-])cc(C)cc2Cl)C[C@H](C)O1 ZINC000840940414 631272662 /nfs/dbraw/zinc/27/26/62/631272662.db2.gz YRBHYUGIGFMSGC-RYUDHWBXSA-N -1 3 299.798 2.590 20 10 CFCDHM Cc1cc([O-])c(CN(C)C[C@@H](O)C(F)(F)F)c(Cl)c1 ZINC000840948855 631276837 /nfs/dbraw/zinc/27/68/37/631276837.db2.gz LRQFLFWRBNKFBA-LLVKDONJSA-N -1 3 297.704 2.709 20 10 CFCDHM COC1(c2ccccc2)CN(Cc2cc(F)ccc2[O-])C1 ZINC000813330590 631902987 /nfs/dbraw/zinc/90/29/87/631902987.db2.gz AFHHGPBSQHIEAE-UHFFFAOYSA-N -1 3 287.334 2.889 20 10 CFCDHM [O-]c1ccc(Cl)cc1CN1CCO[C@@]2(CCSC2)C1 ZINC000843418086 631948499 /nfs/dbraw/zinc/94/84/99/631948499.db2.gz PYHJCSCMGJVEGB-AWEZNQCLSA-N -1 3 299.823 2.754 20 10 CFCDHM C[C@@H](NCc1nccn1C)c1cccc(C(F)(F)F)c1[O-] ZINC000815574997 632289880 /nfs/dbraw/zinc/28/98/80/632289880.db2.gz HWHRXQQPDXHTDH-SECBINFHSA-N -1 3 299.296 2.995 20 10 CFCDHM COc1ccncc1CN[C@@H](C)c1cc(F)cc(F)c1[O-] ZINC000815630118 632301835 /nfs/dbraw/zinc/30/18/35/632301835.db2.gz XFBRRZSRRVDFFX-VIFPVBQESA-N -1 3 294.301 2.925 20 10 CFCDHM CCN1CCN(Cc2cc(Cl)c(F)cc2[O-])C[C@H]1C ZINC000816506453 632473645 /nfs/dbraw/zinc/47/36/45/632473645.db2.gz CYDXKPJVVSXJEW-SNVBAGLBSA-N -1 3 286.778 2.711 20 10 CFCDHM COc1ccc(CNCc2c(F)ccc([O-])c2F)c(O)c1 ZINC000816597307 632491713 /nfs/dbraw/zinc/49/17/13/632491713.db2.gz MQZGAJDLMJOJOY-UHFFFAOYSA-N -1 3 295.285 2.674 20 10 CFCDHM [O-]c1c(CN(CCO)CC(F)F)ccc2ccccc12 ZINC000816595744 632492022 /nfs/dbraw/zinc/49/20/22/632492022.db2.gz ZCOCPFOLYHONTD-UHFFFAOYSA-N -1 3 281.302 2.605 20 10 CFCDHM CCN1CCN(Cc2cc(Cl)c(F)cc2[O-])[C@@H](C)C1 ZINC000816607897 632492765 /nfs/dbraw/zinc/49/27/65/632492765.db2.gz IVHOEVQJYDYEHI-JTQLQIEISA-N -1 3 286.778 2.711 20 10 CFCDHM CCC(CC)(C[NH2+]Cc1cc(F)ccc1[O-])C(=O)[O-] ZINC000818629979 632883124 /nfs/dbraw/zinc/88/31/24/632883124.db2.gz NIKNUHXSLSXFEH-UHFFFAOYSA-N -1 3 269.316 2.512 20 10 CFCDHM CCc1ccc(C(=O)N(C)Cc2ccccc2O)c([O-])c1 ZINC000188357873 650325556 /nfs/dbraw/zinc/32/55/56/650325556.db2.gz IWKVHNGINIZSHG-UHFFFAOYSA-N -1 3 285.343 2.932 20 10 CFCDHM C/C=C/C[C@@H]1CCCN(C(=O)c2cccc(O)c2[O-])C1 ZINC000863817377 637788158 /nfs/dbraw/zinc/78/81/58/637788158.db2.gz KPPJJFKGTBMMAZ-QAVQXKDTSA-N -1 3 275.348 2.916 20 10 CFCDHM CCCN1CCN(Cc2cccc(Cl)c2[O-])CC1 ZINC000124501638 642167532 /nfs/dbraw/zinc/16/75/32/642167532.db2.gz MEQYPVMKSAOKKU-UHFFFAOYSA-N -1 3 268.788 2.573 20 10 CFCDHM CCN(CC)c1ccc(C=C2SC(=O)[N-]C2=O)cc1F ZINC000874927976 642554092 /nfs/dbraw/zinc/55/40/92/642554092.db2.gz NBYHCXXUTFCGIE-XYOKQWHBSA-N -1 3 294.351 2.996 20 10 CFCDHM Cc1ccc(NC(=O)c2cccc(O)c2[O-])cc1F ZINC000126227760 643055518 /nfs/dbraw/zinc/05/55/18/643055518.db2.gz OJDAARLIVSEAOC-UHFFFAOYSA-N -1 3 261.252 2.798 20 10 CFCDHM O=C(NCc1ccc(Cl)cc1)c1cccc(O)c1[O-] ZINC000126236164 643058810 /nfs/dbraw/zinc/05/88/10/643058810.db2.gz IRRAGBIWRVCOAY-UHFFFAOYSA-N -1 3 277.707 2.681 20 10 CFCDHM Cc1ccc(F)c(NC(=O)c2cccc(O)c2[O-])c1 ZINC000126240065 643060315 /nfs/dbraw/zinc/06/03/15/643060315.db2.gz WJZVMGNWHREGPZ-UHFFFAOYSA-N -1 3 261.252 2.798 20 10 CFCDHM NC(=O)c1ccc(F)c(NCc2c([O-])cccc2Cl)c1 ZINC000127271870 643981002 /nfs/dbraw/zinc/98/10/02/643981002.db2.gz ZZSZQZRRXZJBFN-UHFFFAOYSA-N -1 3 294.713 2.896 20 10 CFCDHM [O-]c1c(F)cc(F)cc1CNCc1nccn1C(F)F ZINC000882934036 645516158 /nfs/dbraw/zinc/51/61/58/645516158.db2.gz WGOHXBWKYVOJRX-UHFFFAOYSA-N -1 3 289.232 2.552 20 10 CFCDHM CC(C)c1nnc([C@H](C)NCc2cc(F)cc(F)c2[O-])[nH]1 ZINC000883078395 645594685 /nfs/dbraw/zinc/59/46/85/645594685.db2.gz PUAZIGYCKVYYDG-QMMMGPOBSA-N -1 3 296.321 2.763 20 10 CFCDHM CC(C)c1nc([C@H](C)NCc2cc(F)cc(F)c2[O-])n[nH]1 ZINC000883078395 645594690 /nfs/dbraw/zinc/59/46/90/645594690.db2.gz PUAZIGYCKVYYDG-QMMMGPOBSA-N -1 3 296.321 2.763 20 10 CFCDHM COc1ccncc1CN[C@H](C)c1c([O-])cccc1F ZINC000886613779 647068313 /nfs/dbraw/zinc/06/83/13/647068313.db2.gz FAHSPGVKSRCGFR-SNVBAGLBSA-N -1 3 276.311 2.786 20 10 CFCDHM C[C@@H](N[C@H](C)c1c([O-])cccc1F)c1ccn(C)n1 ZINC000886625076 647074225 /nfs/dbraw/zinc/07/42/25/647074225.db2.gz IETOLCHOIOEBRS-NXEZZACHSA-N -1 3 263.316 2.677 20 10 CFCDHM Cc1ccc(C(=O)Nc2cccnc2C2CC2)c([O-])c1O ZINC000889882412 647688444 /nfs/dbraw/zinc/68/84/44/647688444.db2.gz JCDRXOMWFGNSBT-UHFFFAOYSA-N -1 3 284.315 2.931 20 10 CFCDHM C[C@@H](CC(F)(F)F)C(=O)NCc1c([O-])cccc1F ZINC000928705543 648944818 /nfs/dbraw/zinc/94/48/18/648944818.db2.gz JMYBOWUUEYFNER-ZETCQYMHSA-N -1 3 279.233 2.736 20 10 CFCDHM C[C@@H](C(=O)NCc1c([O-])cccc1F)C1CCC1 ZINC000928705692 648944996 /nfs/dbraw/zinc/94/49/96/648944996.db2.gz LCQCFZPNDUGQPQ-SECBINFHSA-N -1 3 251.301 2.584 20 10 CFCDHM CC(C)(C)OCCCC(=O)NCc1c([O-])cccc1F ZINC000928707158 648945677 /nfs/dbraw/zinc/94/56/77/648945677.db2.gz BIUJWBQKQNKZOT-UHFFFAOYSA-N -1 3 283.343 2.743 20 10 CFCDHM CC/C(C)=C(/C)C(=O)NCc1c([O-])cccc1F ZINC000928709003 648945845 /nfs/dbraw/zinc/94/58/45/648945845.db2.gz VFWCZROSIJIGEB-KTKRTIGZSA-N -1 3 251.301 2.894 20 10 CFCDHM CC(C)(C)[C@@H]1C[C@H]1C(=O)NCc1c([O-])cccc1F ZINC000928709607 648946213 /nfs/dbraw/zinc/94/62/13/648946213.db2.gz JZKMQJSMTOSCTO-MWLCHTKSSA-N -1 3 265.328 2.830 20 10 CFCDHM CC1(C)CC[C@H]1C(=O)NCc1c([O-])cccc1F ZINC000928712826 648946507 /nfs/dbraw/zinc/94/65/07/648946507.db2.gz VPMVEXMOOZLFFL-JTQLQIEISA-N -1 3 251.301 2.584 20 10 CFCDHM C[C@H](CC(=O)NCc1c([O-])cccc1F)c1ccncc1 ZINC000928712982 648946759 /nfs/dbraw/zinc/94/67/59/648946759.db2.gz ZEWYWWICJBIJGF-LLVKDONJSA-N -1 3 288.322 2.736 20 10 CFCDHM COc1cc([O-])c(CN2CC[C@@H]2C)cc1Br ZINC001233135224 777805537 /nfs/dbraw/zinc/80/55/37/777805537.db2.gz OXMIDJPIYUSTBG-QMMMGPOBSA-N -1 3 286.169 2.758 20 10 CFCDHM Cc1cccc2c1CC[N@H+](Cc1ccc(C(=O)[O-])cc1[O-])C2 ZINC001231445633 777222028 /nfs/dbraw/zinc/22/20/28/777222028.db2.gz AALFMSDEOOFVLP-UHFFFAOYSA-N -1 3 297.354 2.957 20 10 CFCDHM Cc1cccc2c1CC[N@@H+](Cc1ccc(C(=O)[O-])cc1[O-])C2 ZINC001231445633 777222034 /nfs/dbraw/zinc/22/20/34/777222034.db2.gz AALFMSDEOOFVLP-UHFFFAOYSA-N -1 3 297.354 2.957 20 10 CFCDHM O=C([O-])c1ccc(C[NH+]2CCC(C(F)F)CC2)c([O-])c1 ZINC001231455970 777224450 /nfs/dbraw/zinc/22/44/50/777224450.db2.gz YVHXQVSNVOOHTG-UHFFFAOYSA-N -1 3 285.290 2.568 20 10 CFCDHM O=C([O-])c1ccc(O)c(CN(Cc2ccco2)C2CC2)c1 ZINC001231566097 777260497 /nfs/dbraw/zinc/26/04/97/777260497.db2.gz QDFKPGLRFNRPBS-UHFFFAOYSA-N -1 3 287.315 2.848 20 10 CFCDHM CC1(C)CC[NH+](Cc2cc(C(=O)[O-])ccc2[O-])CC1 ZINC001231564201 777260960 /nfs/dbraw/zinc/26/09/60/777260960.db2.gz OZVQFEPCUXMQMS-UHFFFAOYSA-N -1 3 263.337 2.712 20 10 CFCDHM C[C@@H]1CCC[C@@H](C)[NH+]1Cc1cc(C(=O)[O-])ccc1[O-] ZINC001231562078 777261386 /nfs/dbraw/zinc/26/13/86/777261386.db2.gz ZMMVLFYMEVUKKV-GHMZBOCLSA-N -1 3 263.337 2.853 20 10 CFCDHM Cc1cc([O-])c(CN2C[C@@H](F)[C@H](F)C2)cc1Cl ZINC001231866996 777357309 /nfs/dbraw/zinc/35/73/09/777357309.db2.gz GFMNNLHENNWIGR-GHMZBOCLSA-N -1 3 261.699 2.846 20 10 CFCDHM CCCOC1CN(Cc2cc(Cl)c(C)cc2[O-])C1 ZINC001231870607 777358955 /nfs/dbraw/zinc/35/89/55/777358955.db2.gz LSRVFMGILRUWJU-UHFFFAOYSA-N -1 3 269.772 2.965 20 10 CFCDHM O=C1CCN(Cc2ccc3ccccc3c2[O-])CC1(F)F ZINC001231880270 777363233 /nfs/dbraw/zinc/36/32/33/777363233.db2.gz AXMWZTGWHIUBAG-UHFFFAOYSA-N -1 3 291.297 2.956 20 10 CFCDHM [O-]c1c(CN2CC3(CCO3)C2)ccc2ccccc21 ZINC001231881121 777364703 /nfs/dbraw/zinc/36/47/03/777364703.db2.gz RKUATFIPFVJZLB-UHFFFAOYSA-N -1 3 255.317 2.520 20 10 CFCDHM O=c1[nH]ccc2c1CCN(Cc1cccc(Cl)c1[O-])C2 ZINC001231914878 777383107 /nfs/dbraw/zinc/38/31/07/777383107.db2.gz UGAIJQOVCYNXFK-UHFFFAOYSA-N -1 3 290.750 2.705 20 10 CFCDHM COc1cc([O-])c(CN2Cc3ccncc3C2)cc1Cl ZINC001232270134 777501835 /nfs/dbraw/zinc/50/18/35/777501835.db2.gz UVHWFCFDDULDOZ-UHFFFAOYSA-N -1 3 290.750 2.965 20 10 CFCDHM CCCCCN1CCN(Cc2ccc(F)c(F)c2[O-])CC1 ZINC001233077601 777789608 /nfs/dbraw/zinc/78/96/08/777789608.db2.gz TYZMBIVUBJOWJE-UHFFFAOYSA-N -1 3 298.377 2.978 20 10 CFCDHM C[C@@H]1COCCN(Cc2cccc(C(F)(F)F)c2[O-])C1 ZINC001233415941 777943266 /nfs/dbraw/zinc/94/32/66/777943266.db2.gz PFSALFNGVWTLBN-JTQLQIEISA-N -1 3 289.297 2.879 20 10 CFCDHM COC[C@H]1CCN1Cc1cccc(C(F)(F)F)c1[O-] ZINC001233419816 777945032 /nfs/dbraw/zinc/94/50/32/777945032.db2.gz NMKUTVZGCSAIJX-SNVBAGLBSA-N -1 3 275.270 2.632 20 10 CFCDHM [O-]c1c(CN2CC3(CSC3)C2)cccc1C(F)(F)F ZINC001233419377 777945457 /nfs/dbraw/zinc/94/54/57/777945457.db2.gz WCZIDVXOUQOMNM-UHFFFAOYSA-N -1 3 289.322 2.960 20 10 CFCDHM C[C@H]1CN(Cc2ccc(C(F)(F)F)cc2[O-])CCO1 ZINC001233452096 777957030 /nfs/dbraw/zinc/95/70/30/777957030.db2.gz KPOZKTKZHZCKJN-VIFPVBQESA-N -1 3 275.270 2.632 20 10 CFCDHM COC1(C)CN(Cc2ccc(C(F)(F)F)cc2[O-])C1 ZINC001233451828 777958251 /nfs/dbraw/zinc/95/82/51/777958251.db2.gz AOCKJCWPONQXCJ-UHFFFAOYSA-N -1 3 275.270 2.632 20 10 CFCDHM [O-]c1cc(C(F)(F)F)ccc1CN1C[C@H]2CC[C@@H]1CO2 ZINC001233455614 777960483 /nfs/dbraw/zinc/96/04/83/777960483.db2.gz RVELTWMFLYMWBS-VXGBXAGGSA-N -1 3 287.281 2.774 20 10 CFCDHM CCCC(=O)c1cc(O)c([O-])cc1O[C@@H]1CCCN(C)C1 ZINC001233496916 777968524 /nfs/dbraw/zinc/96/85/24/777968524.db2.gz KSYWBYSZXKSTHM-LLVKDONJSA-N -1 3 293.363 2.554 20 10 CFCDHM COc1cc([O-])c(CN2CCC(=O)[C@@H](C)CC2)c(Cl)c1 ZINC001236798424 778942773 /nfs/dbraw/zinc/94/27/73/778942773.db2.gz OEEGZQSRGGXTFZ-JTQLQIEISA-N -1 3 297.782 2.855 20 10 CFCDHM COc1cc([O-])c(CN2C[C@@H](C)OC[C@H]2C)c(Cl)c1 ZINC001236808951 778948584 /nfs/dbraw/zinc/94/85/84/778948584.db2.gz SDKLMLADYYYYOG-NXEZZACHSA-N -1 3 285.771 2.663 20 10 CFCDHM [O-]c1ccc(Cl)c(Cl)c1CN1CCC2(COC2)C1 ZINC001237078582 779006172 /nfs/dbraw/zinc/00/61/72/779006172.db2.gz UZCLADYWRHQZPA-UHFFFAOYSA-N -1 3 288.174 2.921 20 10 CFCDHM C[C@@H]1CN(Cc2c([O-])ccc(Cl)c2Cl)CC[C@@H]1O ZINC001237078359 779007398 /nfs/dbraw/zinc/00/73/98/779007398.db2.gz QAMABOSWIZPMKX-KCJUWKMLSA-N -1 3 290.190 2.902 20 10 CFCDHM C[C@@H]1CN(Cc2c([O-])ccc(Cl)c2Cl)CCN1C ZINC001237084215 779008481 /nfs/dbraw/zinc/00/84/81/779008481.db2.gz HYVPUHDBNLGAQI-SECBINFHSA-N -1 3 289.206 2.835 20 10 CFCDHM CO[C@@H]1CCCN(Cc2c([O-])ccc(F)c2Cl)C1 ZINC001237119102 779016605 /nfs/dbraw/zinc/01/66/05/779016605.db2.gz ARURGIRKOBHQKP-SECBINFHSA-N -1 3 273.735 2.796 20 10 CFCDHM [O-]c1cc(Br)ccc1CN1CC[C@@H](F)C1 ZINC000691679584 779504930 /nfs/dbraw/zinc/50/49/30/779504930.db2.gz KEDWYESBESQEJW-SNVBAGLBSA-N -1 3 274.133 2.699 20 10 CFCDHM COc1cc([O-])c(CN2CCOC[C@@H]2C(C)C)c(Cl)c1 ZINC001236801268 779641100 /nfs/dbraw/zinc/64/11/00/779641100.db2.gz DIYQTTIIBSJJPR-CQSZACIVSA-N -1 3 299.798 2.911 20 10 CFCDHM [O-]c1cccc(Cl)c1CN1CCO[C@@H](CCF)C1 ZINC000700591444 780702447 /nfs/dbraw/zinc/70/24/47/780702447.db2.gz NFLIQWGERODWKH-JTQLQIEISA-N -1 3 273.735 2.606 20 10 CFCDHM CCO[C@@H]1CCCN(Cc2ccc(F)c(F)c2[O-])C1 ZINC000703541168 781027833 /nfs/dbraw/zinc/02/78/33/781027833.db2.gz LJLCMOKBJMKRBP-LLVKDONJSA-N -1 3 271.307 2.671 20 10 CFCDHM CN(Cc1c([O-])cccc1Br)CC(F)F ZINC000707128734 781226858 /nfs/dbraw/zinc/22/68/58/781226858.db2.gz AOOSJQDGJCGBQT-UHFFFAOYSA-N -1 3 280.112 2.852 20 10 CFCDHM CCc1nc(C)c(CNCc2cc(F)cc(F)c2[O-])o1 ZINC000708482890 781265435 /nfs/dbraw/zinc/26/54/35/781265435.db2.gz YRQQSYNOFWQWFB-UHFFFAOYSA-N -1 3 282.290 2.819 20 10 CFCDHM CO[C@@H]1CN(Cc2cc(F)cc(F)c2[O-])CC[C@@H]1C ZINC000708413667 781273262 /nfs/dbraw/zinc/27/32/62/781273262.db2.gz MPSIQCXZRNABBI-TVQRCGJNSA-N -1 3 271.307 2.527 20 10 CFCDHM CO[C@@H]1CC[C@H](C)N(Cc2cc(F)cc(F)c2[O-])C1 ZINC000708414220 781274117 /nfs/dbraw/zinc/27/41/17/781274117.db2.gz PKUOOBTWVOFSDV-JOYOIKCWSA-N -1 3 271.307 2.670 20 10 CFCDHM CN(Cc1cccc(F)c1[O-])[C@@H](CO)c1ccccc1 ZINC000295102617 199346270 /nfs/dbraw/zinc/34/62/70/199346270.db2.gz SZSXUHVVHDJFKQ-HNNXBMFYSA-N -1 3 275.323 2.697 20 10 CFCDHM [O-]c1ccc(F)cc1CN1C[C@@H](CO)c2ccccc21 ZINC000293791465 198774466 /nfs/dbraw/zinc/77/44/66/198774466.db2.gz COBYUEBVDSHEES-LBPRGKRZSA-N -1 3 273.307 2.627 20 10 CFCDHM Cc1nn(C)c(Cl)c1CN(C)Cc1ccccc1[O-] ZINC000114721344 376081407 /nfs/dbraw/zinc/08/14/07/376081407.db2.gz MBUIRHNEJJOUIP-UHFFFAOYSA-N -1 3 279.771 2.720 20 10 CFCDHM C[C@H]1O[C@@H](C)[C@@H](C)[C@H]1C(=O)NCc1cc(Cl)ccc1[O-] ZINC000529513804 383715128 /nfs/dbraw/zinc/71/51/28/383715128.db2.gz UFKRGMXOTBSKLO-QOBXEIRBSA-N -1 3 297.782 2.721 20 10 CFCDHM CCCOc1ccc(CN2CCO[C@H]3CCC[C@@H]32)c([O-])c1 ZINC000132776498 377876108 /nfs/dbraw/zinc/87/61/08/377876108.db2.gz SVRSWQRFROYZRO-RDJZCZTQSA-N -1 3 291.391 2.934 20 10 CFCDHM CC(=O)c1cc(Cl)cc(CN(C)c2cnn(C)c2)c1[O-] ZINC000177289225 380325569 /nfs/dbraw/zinc/32/55/69/380325569.db2.gz DGZGFFXUVUWPCY-UHFFFAOYSA-N -1 3 293.754 2.618 20 10 CFCDHM CCC[C@@H]1SCCN1C(=O)c1ccc(C)c(O)c1[O-] ZINC000179501608 380550848 /nfs/dbraw/zinc/55/08/48/380550848.db2.gz YCOXXCAYBKOGLG-NSHDSACASA-N -1 3 281.377 2.721 20 10 CFCDHM CCSCC[C@@H](C)NC(=O)c1ccc(C)c(O)c1[O-] ZINC000179527238 380552059 /nfs/dbraw/zinc/55/20/59/380552059.db2.gz ANHQESRIYCCJKT-SNVBAGLBSA-N -1 3 283.393 2.668 20 10 CFCDHM CCOC(=O)[C@H]1CCCN(Cc2cccc(Cl)c2[O-])C1 ZINC000179844032 380586277 /nfs/dbraw/zinc/58/62/77/380586277.db2.gz PQOLHFBTNSWFLV-LBPRGKRZSA-N -1 3 297.782 2.821 20 10 CFCDHM CCC[C@@H]1CN(Cc2cc(F)ccc2[O-])CCO1 ZINC000180173300 380628133 /nfs/dbraw/zinc/62/81/33/380628133.db2.gz SCJNHPWJHOIBHL-CYBMUJFWSA-N -1 3 253.317 2.532 20 10 CFCDHM CCC[C@H]1CN(Cc2cc(F)ccc2[O-])CCO1 ZINC000180173319 380628425 /nfs/dbraw/zinc/62/84/25/380628425.db2.gz SCJNHPWJHOIBHL-ZDUSSCGKSA-N -1 3 253.317 2.532 20 10 CFCDHM Cc1occc1CN(C)C(=O)c1ccc(C)c(O)c1[O-] ZINC000182202901 381019312 /nfs/dbraw/zinc/01/93/12/381019312.db2.gz ORUIEQCTYKCRHZ-UHFFFAOYSA-N -1 3 275.304 2.580 20 10 CFCDHM Cc1ccc(C(=O)NCCCC(C)(F)F)c([O-])c1O ZINC000295864677 381124682 /nfs/dbraw/zinc/12/46/82/381124682.db2.gz XEXHCHICHMPKIQ-UHFFFAOYSA-N -1 3 273.279 2.571 20 10 CFCDHM CCCOc1ccc(CN(C2CC2)C2COC2)c([O-])c1 ZINC000296019571 381214795 /nfs/dbraw/zinc/21/47/95/381214795.db2.gz MIRSXTOBNREUBY-UHFFFAOYSA-N -1 3 277.364 2.544 20 10 CFCDHM O=C(NCc1c(O)ccc2c1CCCC2)c1cccc([O-])c1 ZINC000182838469 381169067 /nfs/dbraw/zinc/16/90/67/381169067.db2.gz SANNJTDVFRWBBR-UHFFFAOYSA-N -1 3 297.354 2.907 20 10 CFCDHM COCCC1(C)CN(Cc2c([O-])cccc2Cl)C1 ZINC000297428623 381560962 /nfs/dbraw/zinc/56/09/62/381560962.db2.gz OEHRAPDARQHPEW-UHFFFAOYSA-N -1 3 269.772 2.904 20 10 CFCDHM C[C@@H](N[C@H]1c2ccccc2C[C@@H]1O)c1ccc(F)cc1[O-] ZINC000185674388 381701830 /nfs/dbraw/zinc/70/18/30/381701830.db2.gz MLUSSKOYHZEIFV-YKJXYISPSA-N -1 3 287.334 2.840 20 10 CFCDHM C[C@@H](N[C@H](CCO)c1ccco1)c1ccc(F)cc1[O-] ZINC000186562920 381947833 /nfs/dbraw/zinc/94/78/33/381947833.db2.gz GQBHWWOCHVBZQS-ZWNOBZJWSA-N -1 3 279.311 2.899 20 10 CFCDHM COc1cc(Cl)cc(CN2CCC[C@H]3OCC[C@H]32)c1[O-] ZINC000373487113 382016294 /nfs/dbraw/zinc/01/62/94/382016294.db2.gz BEJMCFRJPYLNDF-CHWSQXEVSA-N -1 3 297.782 2.808 20 10 CFCDHM Cc1nc([C@H]2CCCCN2Cc2ccccc2[O-])no1 ZINC000376168518 382123394 /nfs/dbraw/zinc/12/33/94/382123394.db2.gz XAHKGJNTYDKABQ-CYBMUJFWSA-N -1 3 273.336 2.811 20 10 CFCDHM COc1cc(Cl)cc(CN2CCO[C@H](C3CC3)C2)c1[O-] ZINC000375331662 382080956 /nfs/dbraw/zinc/08/09/56/382080956.db2.gz IWJAQGYTUNHNOQ-AWEZNQCLSA-N -1 3 297.782 2.665 20 10 CFCDHM CC[C@@H](c1ccccc1[O-])N1CCC[C@@H]1c1nncn1C ZINC000377694997 382324022 /nfs/dbraw/zinc/32/40/22/382324022.db2.gz LKIDOLYSFLEZTL-UONOGXRCSA-N -1 3 286.379 2.809 20 10 CFCDHM Cc1ccc(C(=O)N2CCCC23CCCC3)c([O-])c1O ZINC000365543005 382410128 /nfs/dbraw/zinc/41/01/28/382410128.db2.gz ZORVKNXNIFHCPV-UHFFFAOYSA-N -1 3 275.348 2.955 20 10 CFCDHM Cc1nocc1CNCc1cccc(Br)c1[O-] ZINC000294764495 382526962 /nfs/dbraw/zinc/52/69/62/382526962.db2.gz SIWFRICEUZABNW-UHFFFAOYSA-N -1 3 297.152 2.741 20 10 CFCDHM O=C(N[C@@H](c1ccccn1)C1CCC1)c1cccc(O)c1[O-] ZINC000529828675 383759051 /nfs/dbraw/zinc/75/90/51/383759051.db2.gz CTFYKIVKDACYKC-OAHLLOKOSA-N -1 3 298.342 2.764 20 10 CFCDHM CO[C@@H](C)c1nc(CNCc2ccccc2[O-])cs1 ZINC000267650219 384433222 /nfs/dbraw/zinc/43/32/22/384433222.db2.gz UHODADKXZRLJRF-JTQLQIEISA-N -1 3 278.377 2.846 20 10 CFCDHM CC[C@@H](NCc1ncnn1C(C)(C)C)c1ccccc1[O-] ZINC000282455117 385315341 /nfs/dbraw/zinc/31/53/41/385315341.db2.gz FRNRDJKQNYSDJS-CYBMUJFWSA-N -1 3 288.395 2.980 20 10 CFCDHM C[C@@H](O)C1CCN(Cc2cccc(Cl)c2[O-])CC1 ZINC000271719756 385388679 /nfs/dbraw/zinc/38/86/79/385388679.db2.gz JIXIZEWEHISFKZ-SNVBAGLBSA-N -1 3 269.772 2.638 20 10 CFCDHM CC[C@@H]1CN(Cc2cc(Cl)cc(Cl)c2[O-])C[C@H]1O ZINC000271244943 385377941 /nfs/dbraw/zinc/37/79/41/385377941.db2.gz BXUDJHCLTUUTIS-PRHODGIISA-N -1 3 290.190 2.902 20 10 CFCDHM CC[C@H](c1ccccc1[O-])N1CCn2cc(C)nc2C1 ZINC000372601468 393452246 /nfs/dbraw/zinc/45/22/46/393452246.db2.gz SOAAGZYARBIUGD-CQSZACIVSA-N -1 3 271.364 2.864 20 10 CFCDHM C[C@@H](NC(=O)CN(C)Cc1ccccc1[O-])c1ccccc1 ZINC000109772334 393879703 /nfs/dbraw/zinc/87/97/03/393879703.db2.gz KFPAINJBHVRUHS-CQSZACIVSA-N -1 3 298.386 2.701 20 10 CFCDHM Cn1ccc(/C=C/C(=O)N2CCCc3cccc([O-])c32)c1 ZINC000493392862 394230230 /nfs/dbraw/zinc/23/02/30/394230230.db2.gz SPYRJSYFICNVKF-BQYQJAHWSA-N -1 3 282.343 2.723 20 10 CFCDHM CC[C@@H](NCC(=O)NC(C)C)c1cccc(Cl)c1[O-] ZINC000287573833 286902179 /nfs/dbraw/zinc/90/21/79/286902179.db2.gz GZHQUYXUSAWHRW-GFCCVEGCSA-N -1 3 284.787 2.611 20 10 CFCDHM C[C@@H](NCc1cnc2n1CCCC2)c1ccc(F)cc1[O-] ZINC000367436462 262013890 /nfs/dbraw/zinc/01/38/90/262013890.db2.gz FZSCQBLQLQTAQX-LLVKDONJSA-N -1 3 289.354 2.915 20 10 CFCDHM Cc1c([C@@H]2CCCN2Cc2cccc(F)c2[O-])cnn1C ZINC000368463298 267175017 /nfs/dbraw/zinc/17/50/17/267175017.db2.gz XZROENVSOBKGCG-HNNXBMFYSA-N -1 3 289.354 2.910 20 10 CFCDHM [O-]c1ccc(Cl)cc1CN1CCOCC(F)(F)C1 ZINC000368586293 267188845 /nfs/dbraw/zinc/18/88/45/267188845.db2.gz XIILRZMLZMNRDK-UHFFFAOYSA-N -1 3 277.698 2.513 20 10 CFCDHM CC[C@@H](N[C@H]1CCCn2c(C)nnc21)c1ccccc1[O-] ZINC000369972372 267280333 /nfs/dbraw/zinc/28/03/33/267280333.db2.gz FMVJGPFLYCPZGF-KGLIPLIRSA-N -1 3 286.379 2.868 20 10 CFCDHM CC[C@H](N[C@H]1CCCn2c(C)nnc21)c1ccccc1[O-] ZINC000369972371 267280428 /nfs/dbraw/zinc/28/04/28/267280428.db2.gz FMVJGPFLYCPZGF-KBPBESRZSA-N -1 3 286.379 2.868 20 10 CFCDHM CC(C)[C@@H]1N(C(=O)c2cccc(O)c2[O-])CC1(C)C ZINC000293988004 280061670 /nfs/dbraw/zinc/06/16/70/280061670.db2.gz RGQGWRCLMIJMKK-ZDUSSCGKSA-N -1 3 263.337 2.604 20 10 CFCDHM CCN(C(=O)/C=C\c1cncc([O-])c1)c1ccc(OC)cc1 ZINC000492397894 332395640 /nfs/dbraw/zinc/39/56/40/332395640.db2.gz KRKZTOMLIIPFSC-WTKPLQERSA-N -1 3 298.342 2.862 20 10 CFCDHM CC1(C)CN(Cc2cc(Cl)cc(Cl)c2[O-])C[C@H]1O ZINC000280473532 520474460 /nfs/dbraw/zinc/47/44/60/520474460.db2.gz NJCHCDCTKQMKLX-LLVKDONJSA-N -1 3 290.190 2.902 20 10 CFCDHM Cc1ccc(CNC(=O)c2cc([O-])cs2)s1 ZINC000731871324 574131444 /nfs/dbraw/zinc/13/14/44/574131444.db2.gz BSPDBEXZIMIBTQ-UHFFFAOYSA-N -1 3 253.348 2.754 20 10 CFCDHM CN(Cc1cccs1)C(=O)c1cc([O-])cs1 ZINC000731867979 574132384 /nfs/dbraw/zinc/13/23/84/574132384.db2.gz GEZBRIMWTCWNGS-UHFFFAOYSA-N -1 3 253.348 2.787 20 10 CFCDHM O=C(OC[C@H]1CC1(Cl)Cl)c1cc([O-])cs1 ZINC000732354980 574153109 /nfs/dbraw/zinc/15/31/09/574153109.db2.gz YNBPRYCCPDXECC-RXMQYKEDSA-N -1 3 267.133 2.804 20 10 CFCDHM CC(=O)c1cc(F)cc(CN(C)C[C@@H]2CCCCO2)c1[O-] ZINC000048949095 518283073 /nfs/dbraw/zinc/28/30/73/518283073.db2.gz JWMVNVPASAJJRH-AWEZNQCLSA-N -1 3 295.354 2.735 20 10 CFCDHM CC(C)OCc1nc([C@H](C)NCc2ccccc2[O-])no1 ZINC000290772465 519776710 /nfs/dbraw/zinc/77/67/10/519776710.db2.gz CGCWITHXEVAHPM-NSHDSACASA-N -1 3 291.351 2.551 20 10 CFCDHM CCCN(Cc1nccn1C)Cc1ccccc1[O-] ZINC000068973688 521695105 /nfs/dbraw/zinc/69/51/05/521695105.db2.gz KGBFBPHRGVOHSM-UHFFFAOYSA-N -1 3 259.353 2.538 20 10 CFCDHM COCC[C@H]1COCCN1Cc1cc(Cl)cc(C)c1[O-] ZINC000291175721 521994094 /nfs/dbraw/zinc/99/40/94/521994094.db2.gz FDNPWSXHODFKSJ-AWEZNQCLSA-N -1 3 299.798 2.591 20 10 CFCDHM COCC1CCN(Cc2cc(F)cc(C(C)=O)c2[O-])CC1 ZINC000070081432 522936160 /nfs/dbraw/zinc/93/61/60/522936160.db2.gz DVDMALVZJNDRLA-UHFFFAOYSA-N -1 3 295.354 2.592 20 10 CFCDHM C[C@H]1CN(C(=O)c2cccc(O)c2[O-])[C@@H]2CCCC[C@H]12 ZINC000193158868 524539461 /nfs/dbraw/zinc/53/94/61/524539461.db2.gz IAZJHZVAALKZGK-DMDPSCGWSA-N -1 3 275.348 2.749 20 10 CFCDHM Cc1cnc(C(C)(C)NC(=O)c2cccc(O)c2[O-])s1 ZINC000298203806 525978955 /nfs/dbraw/zinc/97/89/55/525978955.db2.gz GBUDXLGWCNSWBU-UHFFFAOYSA-N -1 3 292.360 2.528 20 10 CFCDHM Cc1nnc([C@H](C)N[C@@H](C)c2ccccc2[O-])s1 ZINC000274275161 526405422 /nfs/dbraw/zinc/40/54/22/526405422.db2.gz XKENSQJMEMLXIT-IUCAKERBSA-N -1 3 263.366 2.964 20 10 CFCDHM CCC[C@](C)([NH2+]Cc1cc(C)c(C)cc1[O-])C(=O)[O-] ZINC000736962907 574087853 /nfs/dbraw/zinc/08/78/53/574087853.db2.gz QHDOGKZIAKTTQW-HNNXBMFYSA-N -1 3 265.353 2.742 20 10 CFCDHM CO[C@@]1(C)C[C@@H](N(C)C(=O)c2cc([O-])cs2)C1(C)C ZINC000754908420 574127236 /nfs/dbraw/zinc/12/72/36/574127236.db2.gz VKAJTUJFWAHPKK-RISCZKNCSA-N -1 3 283.393 2.729 20 10 CFCDHM C[C@H](Cc1cccs1)NC(=O)c1cc([O-])cs1 ZINC000732268416 574148011 /nfs/dbraw/zinc/14/80/11/574148011.db2.gz GJYWKTCVXPGZCU-MRVPVSSYSA-N -1 3 267.375 2.876 20 10 CFCDHM O=C(c1cc([O-])cs1)N1CCC[C@H]1c1ccncc1 ZINC000732265677 574148062 /nfs/dbraw/zinc/14/80/62/574148062.db2.gz FPQYVEWTEMADEG-LBPRGKRZSA-N -1 3 274.345 2.826 20 10 CFCDHM CN(C)[C@@H](CNC(=O)c1cc([O-])cs1)c1ccsc1 ZINC000732270112 574148815 /nfs/dbraw/zinc/14/88/15/574148815.db2.gz ZXFUSBDUYIRWCK-NSHDSACASA-N -1 3 296.417 2.548 20 10 CFCDHM COc1c(F)cc(NC(=O)c2cc([O-])cs2)cc1F ZINC000732275220 574149335 /nfs/dbraw/zinc/14/93/35/574149335.db2.gz GTOGMRHARINPTC-UHFFFAOYSA-N -1 3 285.271 2.993 20 10 CFCDHM C[C@@H](NC(=O)c1cc([O-])cs1)c1cccc(O)c1 ZINC000732281755 574149960 /nfs/dbraw/zinc/14/99/60/574149960.db2.gz CGHNXAOGVHWFSK-MRVPVSSYSA-N -1 3 263.318 2.650 20 10 CFCDHM O=C(Nc1cnn(-c2ccccc2)c1)c1cc([O-])cs1 ZINC000732280347 574150264 /nfs/dbraw/zinc/15/02/64/574150264.db2.gz XNUMGFWSYCPPBR-UHFFFAOYSA-N -1 3 285.328 2.892 20 10 CFCDHM CCN(C)c1ccccc1CNC(=O)c1cc([O-])cs1 ZINC000732289544 574150842 /nfs/dbraw/zinc/15/08/42/574150842.db2.gz SWAJTLGTOSGHCA-UHFFFAOYSA-N -1 3 290.388 2.840 20 10 CFCDHM CC(C)c1noc([C@@H](C)OC(=O)c2cc([O-])cs2)n1 ZINC000732353829 574152685 /nfs/dbraw/zinc/15/26/85/574152685.db2.gz ATHQSICEYGDIMX-SSDOTTSWSA-N -1 3 282.321 2.878 20 10 CFCDHM CC(C)c1noc([C@H](C)OC(=O)c2cc([O-])cs2)n1 ZINC000732353830 574152846 /nfs/dbraw/zinc/15/28/46/574152846.db2.gz ATHQSICEYGDIMX-ZETCQYMHSA-N -1 3 282.321 2.878 20 10 CFCDHM COC(=O)c1ccc([C@@H](C)OC(=O)c2cc([O-])cs2)o1 ZINC000732352657 574152982 /nfs/dbraw/zinc/15/29/82/574152982.db2.gz AWUIFQQTDFOJCQ-SSDOTTSWSA-N -1 3 296.300 2.751 20 10 CFCDHM Cc1ccc([C@@H](C)N[C@@H](C(N)=O)c2ccccc2)c([O-])c1 ZINC000756381047 574231384 /nfs/dbraw/zinc/23/13/84/574231384.db2.gz IWTWFQBGTCIXAD-MLGOLLRUSA-N -1 3 284.359 2.578 20 10 CFCDHM Cc1cc(O)c(CN2CC[C@@H](NC(=O)[O-])C2)cc1C(C)C ZINC000740089849 574235562 /nfs/dbraw/zinc/23/55/62/574235562.db2.gz ZDERZWZQZIRGOT-CYBMUJFWSA-N -1 3 292.379 2.666 20 10 CFCDHM Cc1noc(C)c1CN[C@@H](C)c1cc([N+](=O)[O-])ccc1[O-] ZINC000756461866 574239047 /nfs/dbraw/zinc/23/90/47/574239047.db2.gz WMESPGHPQRPHGT-QMMMGPOBSA-N -1 3 291.307 2.756 20 10 CFCDHM C[C@@H]1C[C@@H](NCc2cc[nH]n2)c2c1c(F)ccc2[O-] ZINC000756554923 574246886 /nfs/dbraw/zinc/24/68/86/574246886.db2.gz KBBIYLYKCDKLOV-LDYMZIIASA-N -1 3 261.300 2.593 20 10 CFCDHM C[C@@H](NC[C@](C)(O)C(F)(F)F)c1cc(F)cc(F)c1[O-] ZINC000756782463 574262404 /nfs/dbraw/zinc/26/24/04/574262404.db2.gz BMYGWGTZUJBANC-KBUNVGBDSA-N -1 3 299.239 2.634 20 10 CFCDHM C[C@@H]1C[C@H](NCc2ccn(C)n2)c2c1c(F)ccc2[O-] ZINC000756776972 574262420 /nfs/dbraw/zinc/26/24/20/574262420.db2.gz FEHFNOAGWWYREI-SKDRFNHKSA-N -1 3 275.327 2.603 20 10 CFCDHM COCC1(N[C@@H](C)c2cc(F)cc(F)c2[O-])CC1 ZINC000756851325 574268863 /nfs/dbraw/zinc/26/88/63/574268863.db2.gz SSFGAAOHUPIFIC-QMMMGPOBSA-N -1 3 257.280 2.500 20 10 CFCDHM CC(C)[C@@H](NC(=O)c1cc([O-])cs1)c1ccccn1 ZINC000743475733 574366123 /nfs/dbraw/zinc/36/61/23/574366123.db2.gz VKEUORULSPNLRJ-CYBMUJFWSA-N -1 3 276.361 2.976 20 10 CFCDHM C[C@@H](CCc1cccn1C)NC(=O)c1cc([O-])cs1 ZINC000743712610 574371125 /nfs/dbraw/zinc/37/11/25/574371125.db2.gz WEXLGABPKVGZEY-JTQLQIEISA-N -1 3 278.377 2.543 20 10 CFCDHM O=C(c1cc([O-])cs1)N1CCC(C(F)(F)F)CC1 ZINC000743756255 574371680 /nfs/dbraw/zinc/37/16/80/574371680.db2.gz FKXOKHHAZKTXBZ-UHFFFAOYSA-N -1 3 279.283 2.868 20 10 CFCDHM CCO[C@H]1C[C@H](NC(=O)c2cc([O-])cs2)C12CCCC2 ZINC000743790885 574372197 /nfs/dbraw/zinc/37/21/97/574372197.db2.gz OLRCGRPGHXEKMG-STQMWFEESA-N -1 3 295.404 2.921 20 10 CFCDHM Cn1c(NC(=O)c2cc([O-])cs2)nc2cc(F)ccc21 ZINC000743792957 574372464 /nfs/dbraw/zinc/37/24/64/574372464.db2.gz PDHGKDHWVSDRQO-UHFFFAOYSA-N -1 3 291.307 2.732 20 10 CFCDHM CCN(Cc1ccccn1)C(=O)c1cc([O-])cs1 ZINC000752819691 574395602 /nfs/dbraw/zinc/39/56/02/574395602.db2.gz PJERUDGSTWCTPU-UHFFFAOYSA-N -1 3 262.334 2.511 20 10 CFCDHM CO[C@@H](C)c1nc(CNC(=O)c2cc([O-])cs2)cs1 ZINC000752824187 574395643 /nfs/dbraw/zinc/39/56/43/574395643.db2.gz JRZVFZFOQPTLRF-ZETCQYMHSA-N -1 3 298.389 2.548 20 10 CFCDHM O=C(NCCCNc1cccc(F)c1)c1cc([O-])cs1 ZINC000753522075 574403818 /nfs/dbraw/zinc/40/38/18/574403818.db2.gz MXVKAVTVBITLEZ-UHFFFAOYSA-N -1 3 294.351 2.825 20 10 CFCDHM CC[N@H+](CCC(=O)[O-])Cc1c([O-])ccc2ccccc21 ZINC000086754385 600423978 /nfs/dbraw/zinc/42/39/78/600423978.db2.gz WJMQBPABONSROY-UHFFFAOYSA-N -1 3 273.332 2.842 20 10 CFCDHM CC[N@@H+](CCC(=O)[O-])Cc1c([O-])ccc2ccccc21 ZINC000086754385 600423982 /nfs/dbraw/zinc/42/39/82/600423982.db2.gz WJMQBPABONSROY-UHFFFAOYSA-N -1 3 273.332 2.842 20 10 CFCDHM CC(C)(C)N1CC[C@H]1C(=O)NCc1cccc(Cl)c1[O-] ZINC000890761487 617840914 /nfs/dbraw/zinc/84/09/14/617840914.db2.gz TXRQJLLURWXXMV-LBPRGKRZSA-N -1 3 296.798 2.535 20 10 CFCDHM O=C(NCC[C@@H]1CC[C@@H]2C[C@@H]21)NCc1c([O-])cccc1F ZINC000924407805 617970153 /nfs/dbraw/zinc/97/01/53/617970153.db2.gz KSWUSVJOMDRWCO-QJPTWQEYSA-N -1 3 292.354 2.767 20 10 CFCDHM C[C@@H]1CN(C)[C@@H](C)CN1Cc1cc(Cl)cc(F)c1[O-] ZINC000775984937 618401326 /nfs/dbraw/zinc/40/13/26/618401326.db2.gz ILORRTKTMIUPLR-VHSXEESVSA-N -1 3 286.778 2.709 20 10 CFCDHM CC(C)c1csc(CNC(=O)c2cccc(O)c2[O-])n1 ZINC000193137210 618451288 /nfs/dbraw/zinc/45/12/88/618451288.db2.gz WVKYTNHYVFAYRX-UHFFFAOYSA-N -1 3 292.360 2.608 20 10 CFCDHM CC1(F)CCN(Cc2cc(F)cc(F)c2[O-])CC1 ZINC000895447031 618591713 /nfs/dbraw/zinc/59/17/13/618591713.db2.gz HQBPYQRSALYUQY-UHFFFAOYSA-N -1 3 259.271 2.994 20 10 CFCDHM C[C@@H](NCc1ncn(C)n1)c1ccc2ccccc2c1[O-] ZINC000186214374 619071634 /nfs/dbraw/zinc/07/16/34/619071634.db2.gz JEPBVKXNBACIDD-LLVKDONJSA-N -1 3 282.347 2.525 20 10 CFCDHM [O-]c1cccc(F)c1CNCc1ccc2c(n1)CCC2 ZINC000896636289 619780058 /nfs/dbraw/zinc/78/00/58/619780058.db2.gz AETWJOFRZZXZGU-UHFFFAOYSA-N -1 3 272.323 2.705 20 10 CFCDHM C[C@H]1CCC[C@H](OCC(=O)NCc2c([O-])cccc2F)C1 ZINC000928706732 619995800 /nfs/dbraw/zinc/99/58/00/619995800.db2.gz YPPNYIJBPSXOLG-RYUDHWBXSA-N -1 3 295.354 2.743 20 10 CFCDHM C[C@H]1CCC[C@@H](OCC(=O)NCc2c([O-])cccc2F)C1 ZINC000928706731 619995881 /nfs/dbraw/zinc/99/58/81/619995881.db2.gz YPPNYIJBPSXOLG-NWDGAFQWSA-N -1 3 295.354 2.743 20 10 CFCDHM O=C(C[C@H]1CCC(F)(F)C1)NCc1c([O-])cccc1F ZINC000928707128 619996088 /nfs/dbraw/zinc/99/60/88/619996088.db2.gz APHJGHGWAHBWEI-SECBINFHSA-N -1 3 287.281 2.973 20 10 CFCDHM C[C@H](N[C@@H](C)c1ccc(Cl)cc1[O-])c1ncn(C)n1 ZINC000841753436 620235919 /nfs/dbraw/zinc/23/59/19/620235919.db2.gz SZKHBDINBRNICD-IUCAKERBSA-N -1 3 280.759 2.586 20 10 CFCDHM Cn1ncc(CNCc2cccc(Cl)c2[O-])c1Cl ZINC000898219578 620347093 /nfs/dbraw/zinc/34/70/93/620347093.db2.gz ZWEGXICIJVJQHO-UHFFFAOYSA-N -1 3 286.162 2.722 20 10 CFCDHM CC(C)[C@H](N[C@H](C)c1c([O-])cccc1F)c1nncn1C ZINC000903063728 621238295 /nfs/dbraw/zinc/23/82/95/621238295.db2.gz HKXOIKKULQGKEI-YGRLFVJLSA-N -1 3 292.358 2.708 20 10 CFCDHM O=C(NCC[C@@H]1CCc2ccccc21)c1cccc(O)c1[O-] ZINC000833398322 625565196 /nfs/dbraw/zinc/56/51/96/625565196.db2.gz DTBKCPUSVBWNEF-ZDUSSCGKSA-N -1 3 297.354 2.948 20 10 CFCDHM Cc1cc(CNCc2cccc(Br)c2[O-])no1 ZINC000044693382 622940284 /nfs/dbraw/zinc/94/02/84/622940284.db2.gz NXNOFZSPLLEDCN-UHFFFAOYSA-N -1 3 297.152 2.741 20 10 CFCDHM [O-]c1cc(Br)ccc1CN1CCSCC1 ZINC000824549238 623522146 /nfs/dbraw/zinc/52/21/46/623522146.db2.gz ZUDFYLQDOCNYIG-UHFFFAOYSA-N -1 3 288.210 2.704 20 10 CFCDHM Cc1cc([O-])c(CN2CCOC[C@H]2C2CC2)cc1Cl ZINC000824861989 623580162 /nfs/dbraw/zinc/58/01/62/623580162.db2.gz FRCPCALDPDFRLK-AWEZNQCLSA-N -1 3 281.783 2.965 20 10 CFCDHM [O-]c1cc(Br)ccc1CN1CC(C(F)F)C1 ZINC000826113093 623793002 /nfs/dbraw/zinc/79/30/02/623793002.db2.gz IEGUGNCUWCEBDV-UHFFFAOYSA-N -1 3 292.123 2.852 20 10 CFCDHM C[C@@H]1C[C@H](NCc2cc(Cl)c(F)cc2[O-])c2ncnn21 ZINC000826889589 623902995 /nfs/dbraw/zinc/90/29/95/623902995.db2.gz WHIJYGITQKRSSI-HQJQHLMTSA-N -1 3 296.733 2.572 20 10 CFCDHM C[C@@H]1CCC[C@H]1NC(=O)NCc1c([O-])cccc1F ZINC000917025353 624300552 /nfs/dbraw/zinc/30/05/52/624300552.db2.gz UOIDKXILSLSKLR-BXKDBHETSA-N -1 3 266.316 2.519 20 10 CFCDHM CC(C)[C@H]1C[C@H](C(=O)NCc2c([O-])cccc2F)CCO1 ZINC000830179919 624659521 /nfs/dbraw/zinc/65/95/21/624659521.db2.gz DROQFKJVZIRITG-IAQYHMDHSA-N -1 3 295.354 2.599 20 10 CFCDHM CS[C@@H]1CC[C@H](NC(=O)NCc2c([O-])cccc2F)C1 ZINC000920686905 624750722 /nfs/dbraw/zinc/75/07/22/624750722.db2.gz ODEZYXZVKJAJIX-VHSXEESVSA-N -1 3 298.383 2.615 20 10 CFCDHM CCC1(CNC(=O)NCc2c([O-])cccc2F)CC1 ZINC000921350564 624853449 /nfs/dbraw/zinc/85/34/49/624853449.db2.gz BLRRZNYWSWRBQE-UHFFFAOYSA-N -1 3 266.316 2.521 20 10 CFCDHM C[C@@H](c1cccc(O)c1)N(C)C(=O)c1cccc(O)c1[O-] ZINC000185847230 625790713 /nfs/dbraw/zinc/79/07/13/625790713.db2.gz NDBKWJDGTCGKNV-JTQLQIEISA-N -1 3 287.315 2.637 20 10 CFCDHM CCC(CC)(CNC(=O)NCc1c([O-])cccc1F)OC ZINC000922594450 626321076 /nfs/dbraw/zinc/32/10/76/626321076.db2.gz IIBIJIJQPRALIN-UHFFFAOYSA-N -1 3 298.358 2.536 20 10 CFCDHM O=C(NCc1c([O-])cccc1F)NC[C@@H]1C[C@H]1C1CCC1 ZINC000922954415 626432439 /nfs/dbraw/zinc/43/24/39/626432439.db2.gz SZVSDUHLTPSDMZ-RYUDHWBXSA-N -1 3 292.354 2.767 20 10 CFCDHM O=C(N[C@H]1C[C@@H]1c1cccc(F)c1)c1cccc(O)c1[O-] ZINC000187078670 626449239 /nfs/dbraw/zinc/44/92/39/626449239.db2.gz SOYTZQZBYMDMAD-OLZOCXBDSA-N -1 3 287.290 2.523 20 10 CFCDHM CC(C)(C)Cc1cc(NC(=O)c2cccc(O)c2[O-])n[nH]1 ZINC000187130581 626460775 /nfs/dbraw/zinc/46/07/75/626460775.db2.gz DHLGWADIBDSBBU-UHFFFAOYSA-N -1 3 289.335 2.662 20 10 CFCDHM O=C(NCc1c([O-])cccc1F)NC[C@@H]1CCCC12CC2 ZINC000923494671 626476957 /nfs/dbraw/zinc/47/69/57/626476957.db2.gz ZNSUTCLKDWKEEZ-NSHDSACASA-N -1 3 292.354 2.911 20 10 CFCDHM COCC1(C)CN(Cc2cc(Cl)c(F)cc2[O-])C1 ZINC000839142937 626528720 /nfs/dbraw/zinc/52/87/20/626528720.db2.gz HYHOGCBMDDCQTC-UHFFFAOYSA-N -1 3 273.735 2.653 20 10 CFCDHM C[C@@H](NCc1c([O-])ccc(Cl)c1F)c1ccn(C)n1 ZINC000839190523 626530646 /nfs/dbraw/zinc/53/06/46/626530646.db2.gz HGRUFYYHJFIQFM-MRVPVSSYSA-N -1 3 283.734 2.769 20 10 CFCDHM COc1c([O-])c(CNc2ncccc2C)ccc1[N+](=O)[O-] ZINC000774973543 627982315 /nfs/dbraw/zinc/98/23/15/627982315.db2.gz AVRVFGHBDFIYQK-UHFFFAOYSA-N -1 3 289.291 2.625 20 10 CFCDHM COc1c([O-])c(CNc2cccnc2C)ccc1[N+](=O)[O-] ZINC000775031086 627986271 /nfs/dbraw/zinc/98/62/71/627986271.db2.gz AWRHCZPTJAESJQ-UHFFFAOYSA-N -1 3 289.291 2.625 20 10 CFCDHM COc1c([O-])c(CNc2ccc(C)nc2)ccc1[N+](=O)[O-] ZINC000775036926 627986527 /nfs/dbraw/zinc/98/65/27/627986527.db2.gz HLRZTBUYSQHJBN-UHFFFAOYSA-N -1 3 289.291 2.625 20 10 CFCDHM C[C@H]([N-]C(=O)C(F)(F)C(F)F)c1ccc(N(C)C)cc1 ZINC000775409302 628022372 /nfs/dbraw/zinc/02/23/72/628022372.db2.gz DOLBAJUQPCMGGQ-QMMMGPOBSA-N -1 3 292.276 2.830 20 10 CFCDHM CC(=O)c1cc(F)cc(CN2CC[C@H](C)[C@H](F)C2)c1[O-] ZINC000778239811 628291607 /nfs/dbraw/zinc/29/16/07/628291607.db2.gz VBVBPDKIMDNWGM-LKFCYVNXSA-N -1 3 283.318 2.914 20 10 CFCDHM CC(=O)c1cc(F)cc(CN2C[C@H](C)O[C@H](C)[C@@H]2C)c1[O-] ZINC000782633421 628650722 /nfs/dbraw/zinc/65/07/22/628650722.db2.gz HIVGSEKMKJUTNY-JBLDHEPKSA-N -1 3 295.354 2.732 20 10 CFCDHM Cc1cc(Br)c([O-])c(CNc2cnccn2)c1 ZINC000788449800 629068804 /nfs/dbraw/zinc/06/88/04/629068804.db2.gz SEBGJKMYUKFAKT-UHFFFAOYSA-N -1 3 294.152 2.865 20 10 CFCDHM COC(=O)[C@H](NCc1cc(F)ccc1[O-])c1cccs1 ZINC000789573384 629167212 /nfs/dbraw/zinc/16/72/12/629167212.db2.gz WPDMJKZLZGUYON-CYBMUJFWSA-N -1 3 295.335 2.597 20 10 CFCDHM CCC[C@@H](NC(=O)c1cccc(O)c1[O-])c1ccccn1 ZINC000790647863 629254911 /nfs/dbraw/zinc/25/49/11/629254911.db2.gz CICKCRVJCQEESO-CYBMUJFWSA-N -1 3 286.331 2.764 20 10 CFCDHM Cc1ccc(CC[C@H](C)NC(=O)c2cccc(O)c2[O-])o1 ZINC000790793900 629262884 /nfs/dbraw/zinc/26/28/84/629262884.db2.gz UCILPIRZBREWMO-JTQLQIEISA-N -1 3 289.331 2.750 20 10 CFCDHM C[C@H](C1CC1)n1cc(NC(=O)c2cccc(O)c2[O-])cn1 ZINC000790944508 629272858 /nfs/dbraw/zinc/27/28/58/629272858.db2.gz AICBQQBBKKMVGA-SECBINFHSA-N -1 3 287.319 2.518 20 10 CFCDHM Cc1cc(CNCc2c([O-])ccc(Cl)c2F)n[nH]1 ZINC000790966788 629274700 /nfs/dbraw/zinc/27/47/00/629274700.db2.gz INZDWHYIZFIZOE-UHFFFAOYSA-N -1 3 269.707 2.506 20 10 CFCDHM Cc1cc(CNCc2c([O-])ccc(Cl)c2F)[nH]n1 ZINC000790966788 629274705 /nfs/dbraw/zinc/27/47/05/629274705.db2.gz INZDWHYIZFIZOE-UHFFFAOYSA-N -1 3 269.707 2.506 20 10 CFCDHM CN1CCN(Cc2c([O-])ccc(Cl)c2F)C(C)(C)C1 ZINC000792165982 629403962 /nfs/dbraw/zinc/40/39/62/629403962.db2.gz NEOFASFBCNERSH-UHFFFAOYSA-N -1 3 286.778 2.711 20 10 CFCDHM C[C@@H]1[C@H](C)N(Cc2c([O-])ccc(Cl)c2F)CCN1C ZINC000792173776 629406066 /nfs/dbraw/zinc/40/60/66/629406066.db2.gz CDLHPZMERNMUFA-ZJUUUORDSA-N -1 3 286.778 2.709 20 10 CFCDHM [O-]c1cccnc1C[NH2+]Cc1cc(Cl)cc(F)c1[O-] ZINC000793258669 629515705 /nfs/dbraw/zinc/51/57/05/629515705.db2.gz LZZXJGRWCZZRRV-UHFFFAOYSA-N -1 3 282.702 2.575 20 10 CFCDHM Cc1ccc(C(=O)Nc2cc3c(cn2)CCCC3)c([O-])c1O ZINC000794744242 629682959 /nfs/dbraw/zinc/68/29/59/629682959.db2.gz HVJAAIWCBPFSNU-UHFFFAOYSA-N -1 3 298.342 2.932 20 10 CFCDHM CC(C)(C)CN1C(=O)C(C)(C)N[C@H]1c1cc(F)ccc1[O-] ZINC000840828935 630538527 /nfs/dbraw/zinc/53/85/27/630538527.db2.gz XXTFRQRCNLOERV-CYBMUJFWSA-N -1 3 294.370 2.786 20 10 CFCDHM CN(Cc1c([O-])ccc(Cl)c1F)[C@H]1CCCOC1 ZINC000809693116 631264958 /nfs/dbraw/zinc/26/49/58/631264958.db2.gz OFYKCMOPLMFMQL-VIFPVBQESA-N -1 3 273.735 2.796 20 10 CFCDHM Cc1ncc(CNCc2c([O-])cc(C)cc2Cl)o1 ZINC000840952688 631280270 /nfs/dbraw/zinc/28/02/70/631280270.db2.gz GBMVTPPXBUJLGH-UHFFFAOYSA-N -1 3 266.728 2.940 20 10 CFCDHM COc1nn(C)cc1N[C@H](C)c1ccc(Cl)cc1[O-] ZINC000841750716 631465389 /nfs/dbraw/zinc/46/53/89/631465389.db2.gz AMALHWSZRQGGOR-MRVPVSSYSA-N -1 3 281.743 2.961 20 10 CFCDHM CC[C@@H](C)C[C@@H](NCc1cc(F)ccc1[O-])C(=O)OC ZINC000843415342 631947623 /nfs/dbraw/zinc/94/76/23/631947623.db2.gz KFNKUXVIBKFHFO-ZWNOBZJWSA-N -1 3 283.343 2.599 20 10 CFCDHM CCCN(CC(=O)OC)Cc1ccc2ccccc2c1[O-] ZINC000816478110 632467518 /nfs/dbraw/zinc/46/75/18/632467518.db2.gz USLAUEJFKQIUMJ-UHFFFAOYSA-N -1 3 287.359 2.930 20 10 CFCDHM C[C@H]1COCCN(Cc2cc(Cl)c(F)cc2[O-])C1 ZINC000816514138 632475670 /nfs/dbraw/zinc/47/56/70/632475670.db2.gz NHIJWVGUGKEBGA-SECBINFHSA-N -1 3 273.735 2.653 20 10 CFCDHM C[C@@H]1[C@@H](C)CN1Cc1cccc(Br)c1[O-] ZINC000816649324 632503771 /nfs/dbraw/zinc/50/37/71/632503771.db2.gz XLFWGMQWTBPXKJ-DTWKUNHWSA-N -1 3 270.170 2.995 20 10 CFCDHM Cc1cc(NC(=O)c2ccc(C)c(O)c2[O-])nn1C(C)C ZINC000817701441 632687386 /nfs/dbraw/zinc/68/73/86/632687386.db2.gz FYRCOHBFMOVXMC-UHFFFAOYSA-N -1 3 289.335 2.744 20 10 CFCDHM CCn1nc(C)c(CN[C@@H](C)c2ccc(Cl)cc2[O-])n1 ZINC000818346851 632835052 /nfs/dbraw/zinc/83/50/52/632835052.db2.gz VHPCEHCHWLCADV-VIFPVBQESA-N -1 3 294.786 2.816 20 10 CFCDHM CC(=O)c1cc(F)cc(CN2CCC(C(C)=O)CC2)c1[O-] ZINC000846951277 632856811 /nfs/dbraw/zinc/85/68/11/632856811.db2.gz PVKMVSPMQOSLNN-UHFFFAOYSA-N -1 3 293.338 2.535 20 10 CFCDHM Cc1cc(Cl)cc(C[NH2+]CCC(C)(C)C(=O)[O-])c1[O-] ZINC000818629172 632883424 /nfs/dbraw/zinc/88/34/24/632883424.db2.gz UOAODVPTJMLMAR-UHFFFAOYSA-N -1 3 285.771 2.945 20 10 CFCDHM C[C@@H]1CCN(Cc2c([O-])ccc(Cl)c2F)C[C@@H]1CO ZINC000857060502 635921204 /nfs/dbraw/zinc/92/12/04/635921204.db2.gz AMMZXLYXGIMRNT-NXEZZACHSA-N -1 3 287.762 2.635 20 10 CFCDHM CCCCCN1CC(=O)N[C@@H]1c1cc(Cl)c(C)cc1[O-] ZINC000849183386 633580054 /nfs/dbraw/zinc/58/00/54/633580054.db2.gz RZZWZXLDAWKGRQ-HNNXBMFYSA-N -1 3 296.798 2.975 20 10 CFCDHM Cc1cc([O-])c([C@@H]2NC(=O)[C@H]3C[C@H](C)CCN32)cc1Cl ZINC000849183458 633580238 /nfs/dbraw/zinc/58/02/38/633580238.db2.gz TVBGQPRACAOPQY-IHPUGEDLSA-N -1 3 294.782 2.583 20 10 CFCDHM C[C@H](N[C@@H]1C[C@@H](C)n2ncnc21)c1cc(Cl)ccc1[O-] ZINC000850499232 634020458 /nfs/dbraw/zinc/02/04/58/634020458.db2.gz LKQNFTMLBOWCNT-VDDIYKPWSA-N -1 3 292.770 2.994 20 10 CFCDHM CCCCN(CC(=O)OC)Cc1cc(Cl)ccc1[O-] ZINC000109779683 634235922 /nfs/dbraw/zinc/23/59/22/634235922.db2.gz CNFZOYYTKJVZMT-UHFFFAOYSA-N -1 3 285.771 2.821 20 10 CFCDHM CN(Cc1c[nH]cn1)Cc1c([O-])cccc1Br ZINC000862408512 637362593 /nfs/dbraw/zinc/36/25/93/637362593.db2.gz JBDXBBCYYUTPAK-UHFFFAOYSA-N -1 3 296.168 2.510 20 10 CFCDHM Cc1cccc([C@@H](C)CNC(=O)c2cccc(O)c2[O-])c1 ZINC000193087073 650622276 /nfs/dbraw/zinc/62/22/76/650622276.db2.gz JCMWJGOUOHZBOE-LBPRGKRZSA-N -1 3 285.343 2.940 20 10 CFCDHM O=C1NCc2ccc(NCc3c([O-])cccc3Cl)cc21 ZINC000124531315 642212265 /nfs/dbraw/zinc/21/22/65/642212265.db2.gz WEMLIYSAUDDWDH-UHFFFAOYSA-N -1 3 288.734 2.901 20 10 CFCDHM O=C1[N-]C(=O)C(=Cc2cc(F)cc(Cl)c2)S1 ZINC000874927345 642552888 /nfs/dbraw/zinc/55/28/88/642552888.db2.gz BEYFHQBFAYSHMD-FPYGCLRLSA-N -1 3 257.673 2.803 20 10 CFCDHM CCOc1ccccc1NC(=O)c1cccc(O)c1[O-] ZINC000126201140 643046282 /nfs/dbraw/zinc/04/62/82/643046282.db2.gz HVJXKGTZLUSMMQ-UHFFFAOYSA-N -1 3 273.288 2.749 20 10 CFCDHM O=C(Nc1cccc2cccnc21)c1cccc(O)c1[O-] ZINC000126200908 643046585 /nfs/dbraw/zinc/04/65/85/643046585.db2.gz JXSHCESYZATFMS-UHFFFAOYSA-N -1 3 280.283 2.898 20 10 CFCDHM C[C@@H]1CCC[C@H](NC(=O)c2cccc(O)c2[O-])[C@@H]1C ZINC000126231441 643056830 /nfs/dbraw/zinc/05/68/30/643056830.db2.gz XGRQYSNGAIQJGE-FOGDFJRCSA-N -1 3 263.337 2.652 20 10 CFCDHM CCN(C(=O)c1cccc(O)c1[O-])c1ccc(F)cc1 ZINC000126371987 643184139 /nfs/dbraw/zinc/18/41/39/643184139.db2.gz LWNDYLYTSCQDHU-UHFFFAOYSA-N -1 3 275.279 2.904 20 10 CFCDHM O=C(Nc1cnc2ccccc2c1)c1cccc(O)c1[O-] ZINC000126387947 643189380 /nfs/dbraw/zinc/18/93/80/643189380.db2.gz BKMILADQBLMENV-UHFFFAOYSA-N -1 3 280.283 2.898 20 10 CFCDHM O=C(NCc1cccc(Cl)c1)c1cccc(O)c1[O-] ZINC000126384886 643189652 /nfs/dbraw/zinc/18/96/52/643189652.db2.gz XMBMWNXFYCKSDJ-UHFFFAOYSA-N -1 3 277.707 2.681 20 10 CFCDHM C[C@H](Cc1cccs1)NC(=O)c1cccc(O)c1[O-] ZINC000126408716 643207895 /nfs/dbraw/zinc/20/78/95/643207895.db2.gz BCJZTNOFYBMFOU-SECBINFHSA-N -1 3 277.345 2.520 20 10 CFCDHM CN(CC(=O)OC(C)(C)C)Cc1c([O-])cccc1Cl ZINC000126937227 643768108 /nfs/dbraw/zinc/76/81/08/643768108.db2.gz ZRNATUWEQFUWCW-UHFFFAOYSA-N -1 3 285.771 2.819 20 10 CFCDHM CCOC(=O)CN(Cc1cc(Cl)ccc1[O-])C1CC1 ZINC000091773069 650908222 /nfs/dbraw/zinc/90/82/22/650908222.db2.gz HULWSCGLHCOREW-UHFFFAOYSA-N -1 3 283.755 2.573 20 10 CFCDHM CC(C)OC(=O)[C@@H](C)N(C)Cc1cc(Cl)ccc1[O-] ZINC000093773074 650945959 /nfs/dbraw/zinc/94/59/59/650945959.db2.gz BJXJKTBVCDRYDW-SNVBAGLBSA-N -1 3 285.771 2.818 20 10 CFCDHM COCCc1ccnc(NCc2cc(F)cc(F)c2[O-])c1 ZINC000883117741 645611183 /nfs/dbraw/zinc/61/11/83/645611183.db2.gz HEYYNNXVEFFHMY-UHFFFAOYSA-N -1 3 294.301 2.866 20 10 CFCDHM CCN(CC)c1ccc(C=Cc2nccc(=O)[n-]2)cc1 ZINC000131750425 645804136 /nfs/dbraw/zinc/80/41/36/645804136.db2.gz KBRNGANBGNMGET-JXMROGBWSA-N -1 3 269.348 2.787 20 10 CFCDHM CCn1cc(CN[C@H](C)c2c([O-])cccc2F)cn1 ZINC000886546904 647041688 /nfs/dbraw/zinc/04/16/88/647041688.db2.gz AFGAZZWRAKBQGK-SNVBAGLBSA-N -1 3 263.316 2.599 20 10 CFCDHM CCc1nnc([C@@H](C)N[C@@H](C)c2c([O-])cccc2F)[nH]1 ZINC000886558672 647046051 /nfs/dbraw/zinc/04/60/51/647046051.db2.gz PIIQBCAHVDRQNB-DTWKUNHWSA-N -1 3 278.331 2.624 20 10 CFCDHM C[C@H](N[C@@H](CO)c1ccsc1)c1c([O-])cccc1F ZINC000886591721 647057005 /nfs/dbraw/zinc/05/70/05/647057005.db2.gz AEKKSRPHNZQWMQ-CABZTGNLSA-N -1 3 281.352 2.977 20 10 CFCDHM CCn1ccnc1CN[C@@H](C)c1c([O-])cccc1F ZINC000886617219 647069854 /nfs/dbraw/zinc/06/98/54/647069854.db2.gz GZGWMPFYCGQBIE-JTQLQIEISA-N -1 3 263.316 2.599 20 10 CFCDHM O=C(NCc1c([O-])cccc1F)NC[C@@]12C[C@@H]1CCCC2 ZINC000924378406 647969352 /nfs/dbraw/zinc/96/93/52/647969352.db2.gz RPJCYPQNSCZCAG-MEDUHNTESA-N -1 3 292.354 2.911 20 10 CFCDHM O=C(c1cccc(O)c1[O-])N1C[C@@H]2C[C@]2(c2ccccc2)C1 ZINC000927315608 648754575 /nfs/dbraw/zinc/75/45/75/648754575.db2.gz XOLGNFFKUVJRJG-SCLBCKFNSA-N -1 3 295.338 2.512 20 10 CFCDHM O=C(NCc1c([O-])cccc1F)NC[C@]12C[C@H]1CCC2 ZINC000927710863 648821368 /nfs/dbraw/zinc/82/13/68/648821368.db2.gz VKJXDGKUDXNDEK-BMIGLBTASA-N -1 3 278.327 2.521 20 10 CFCDHM CC(C)(C)CCC(=O)NCc1c([O-])cccc1F ZINC000928706573 648944664 /nfs/dbraw/zinc/94/46/64/648944664.db2.gz XNFIAUZNNSXLKS-UHFFFAOYSA-N -1 3 253.317 2.974 20 10 CFCDHM C[C@H](C(=O)NCc1c([O-])cccc1F)C1CCC1 ZINC000928705693 648944681 /nfs/dbraw/zinc/94/46/81/648944681.db2.gz LCQCFZPNDUGQPQ-VIFPVBQESA-N -1 3 251.301 2.584 20 10 CFCDHM C[C@]1(C(=O)NCc2c([O-])cccc2F)C[C@H]2C[C@H]2C1 ZINC000928706802 648945244 /nfs/dbraw/zinc/94/52/44/648945244.db2.gz VIBJKJNPHBBINT-RTUWITSCSA-N -1 3 263.312 2.584 20 10 CFCDHM CC[C@H](C)[C@H](C)C(=O)NCc1c([O-])cccc1F ZINC000928708570 648946091 /nfs/dbraw/zinc/94/60/91/648946091.db2.gz PNUYDSUNWKFQKG-UWVGGRQHSA-N -1 3 253.317 2.830 20 10 CFCDHM O=C(C[C@H]1CCC2(CCC2)O1)NCc1c([O-])cccc1F ZINC000928711873 648946542 /nfs/dbraw/zinc/94/65/42/648946542.db2.gz VIVLBUHKRUWATC-LLVKDONJSA-N -1 3 293.338 2.639 20 10 CFCDHM O=C(Nc1cnn(C2CCCC2)c1)c1cccc(O)c1[O-] ZINC000928793592 648955844 /nfs/dbraw/zinc/95/58/44/648955844.db2.gz RBQLDMAXXKXBNQ-UHFFFAOYSA-N -1 3 287.319 2.662 20 10 CFCDHM CC[C@@H]1CN(Cc2cccc(F)c2[O-])C[C@H](CC)O1 ZINC000398783290 770607465 /nfs/dbraw/zinc/60/74/65/770607465.db2.gz MVWQXBVJKRBYSL-BETUJISGSA-N -1 3 267.344 2.921 20 10 CFCDHM CC(C)Oc1cccc2c1C(=O)c1cccc([O-])c1C2=O ZINC001229186420 776746284 /nfs/dbraw/zinc/74/62/84/776746284.db2.gz JZYUEYBHLZXLEG-UHFFFAOYSA-N -1 3 282.295 2.955 20 10 CFCDHM O=C([O-])c1ccc(C[N@H+]2C[C@H]3[C@H](CCC3(F)F)C2)c([O-])c1 ZINC001231449919 777220865 /nfs/dbraw/zinc/22/08/65/777220865.db2.gz NSMGEGVQCWTPHR-PWSUYJOCSA-N -1 3 297.301 2.568 20 10 CFCDHM O=C([O-])c1ccc(C[N@@H+]2C[C@H]3[C@H](CCC3(F)F)C2)c([O-])c1 ZINC001231449919 777220871 /nfs/dbraw/zinc/22/08/71/777220871.db2.gz NSMGEGVQCWTPHR-PWSUYJOCSA-N -1 3 297.301 2.568 20 10 CFCDHM O=C([O-])c1ccc(C[N@@H+]2CCC[C@@H]2c2cccnc2)c([O-])c1 ZINC001231446468 777222244 /nfs/dbraw/zinc/22/22/44/777222244.db2.gz JHKNTZXXLGAWBS-OAHLLOKOSA-N -1 3 298.342 2.823 20 10 CFCDHM O=C([O-])c1ccc(C[N@H+]2CCC[C@@H]2c2cccnc2)c([O-])c1 ZINC001231446468 777222249 /nfs/dbraw/zinc/22/22/49/777222249.db2.gz JHKNTZXXLGAWBS-OAHLLOKOSA-N -1 3 298.342 2.823 20 10 CFCDHM CCN(Cc1cccnc1)Cc1ccc(C(=O)[O-])cc1O ZINC001231452189 777223807 /nfs/dbraw/zinc/22/38/07/777223807.db2.gz FZMPNVSVLZBQRR-UHFFFAOYSA-N -1 3 286.331 2.508 20 10 CFCDHM C[C@@H]1[C@@H](C)CCC[N@@H+]1Cc1cc(C(=O)[O-])ccc1[O-] ZINC001231563327 777260938 /nfs/dbraw/zinc/26/09/38/777260938.db2.gz HRHRKYDUYUAVKC-WDEREUQCSA-N -1 3 263.337 2.711 20 10 CFCDHM C[C@@H]1[C@@H](C)CCC[N@H+]1Cc1cc(C(=O)[O-])ccc1[O-] ZINC001231563327 777260946 /nfs/dbraw/zinc/26/09/46/777260946.db2.gz HRHRKYDUYUAVKC-WDEREUQCSA-N -1 3 263.337 2.711 20 10 CFCDHM C[C@H]1CC[N@H+](Cc2cc(C(=O)[O-])ccc2[O-])CCC1(F)F ZINC001231561691 777261196 /nfs/dbraw/zinc/26/11/96/777261196.db2.gz YPQKLARWARWUMU-JTQLQIEISA-N -1 3 299.317 2.958 20 10 CFCDHM C[C@H]1CC[N@@H+](Cc2cc(C(=O)[O-])ccc2[O-])CCC1(F)F ZINC001231561691 777261200 /nfs/dbraw/zinc/26/12/00/777261200.db2.gz YPQKLARWARWUMU-JTQLQIEISA-N -1 3 299.317 2.958 20 10 CFCDHM CN(Cc1ccsc1)Cc1cc(C(=O)[O-])ccc1O ZINC001231565411 777261313 /nfs/dbraw/zinc/26/13/13/777261313.db2.gz VEGJNPGOGQSNLJ-UHFFFAOYSA-N -1 3 277.345 2.784 20 10 CFCDHM Cc1cc([O-])c(CN2C[C@H]3CC[C@@H]2CO3)cc1Cl ZINC001231871720 777360972 /nfs/dbraw/zinc/36/09/72/777360972.db2.gz PWSMUYAYUSRGFY-VXGBXAGGSA-N -1 3 267.756 2.717 20 10 CFCDHM O=C1CCCN(Cc2ccc3ccccc3c2[O-])C1 ZINC001231880379 777362301 /nfs/dbraw/zinc/36/23/01/777362301.db2.gz DPYUITMWEABURX-UHFFFAOYSA-N -1 3 255.317 2.710 20 10 CFCDHM [O-]c1c(Cl)cccc1CN1C[C@@H]2OCC(F)(F)[C@@H]2C1 ZINC001231910958 777381823 /nfs/dbraw/zinc/38/18/23/777381823.db2.gz WXMPGZUMAUKKJN-KOLCDFICSA-N -1 3 289.709 2.512 20 10 CFCDHM [O-]c1cc(O)c(CN2CC3(C2)CCCCO3)cc1Cl ZINC001232258098 777495112 /nfs/dbraw/zinc/49/51/12/777495112.db2.gz QCIZZHNBRIDDIL-UHFFFAOYSA-N -1 3 283.755 2.506 20 10 CFCDHM COc1cc([O-])c(CN(C)Cc2ccno2)cc1Cl ZINC001232267643 777499973 /nfs/dbraw/zinc/49/99/73/777499973.db2.gz DIQQGBBGIGMBBG-UHFFFAOYSA-N -1 3 282.727 2.674 20 10 CFCDHM COc1cc([O-])c(CN2CCCC[C@@H]2C(C)=O)cc1Cl ZINC001232269372 777500883 /nfs/dbraw/zinc/50/08/83/777500883.db2.gz XQQGRPXWLIHIKD-CYBMUJFWSA-N -1 3 297.782 2.998 20 10 CFCDHM COc1cc([O-])c(CN2CCOC[C@H]2C(C)C)cc1Cl ZINC001232270240 777500928 /nfs/dbraw/zinc/50/09/28/777500928.db2.gz YZZDXMMEDFXRDK-ZDUSSCGKSA-N -1 3 299.798 2.911 20 10 CFCDHM [O-]c1cc(C(F)(F)F)ccc1CN1Cc2cncnc2C1 ZINC001233451908 777958029 /nfs/dbraw/zinc/95/80/29/777958029.db2.gz CZMQYQITMOTRPQ-UHFFFAOYSA-N -1 3 295.264 2.717 20 10 CFCDHM O=C1CCN(Cc2cccc(-c3ccccc3)c2[O-])C1 ZINC001234997444 778347900 /nfs/dbraw/zinc/34/79/00/778347900.db2.gz YWUAZFDVKYYARW-UHFFFAOYSA-N -1 3 267.328 2.834 20 10 CFCDHM [O-]c1cc(O)c(CN2CCCCC23COC3)cc1Cl ZINC001232269350 778916026 /nfs/dbraw/zinc/91/60/26/778916026.db2.gz ZXGDPDFKXWAXLG-UHFFFAOYSA-N -1 3 283.755 2.506 20 10 CFCDHM COc1cc([O-])c(CN2CCSCC2)c(Cl)c1 ZINC001236795093 778941147 /nfs/dbraw/zinc/94/11/47/778941147.db2.gz IQEVYNKLNCPQGC-UHFFFAOYSA-N -1 3 273.785 2.603 20 10 CFCDHM COC(CN(C)Cc1cc(Cl)c(Cl)cc1[O-])OC ZINC001236800027 778943639 /nfs/dbraw/zinc/94/36/39/778943639.db2.gz SBYWRYNJEAZSPI-UHFFFAOYSA-N -1 3 294.178 2.750 20 10 CFCDHM COc1ccc(CN2CCC[C@@H](C(C)=O)C2)c([O-])c1Cl ZINC001236807567 778946130 /nfs/dbraw/zinc/94/61/30/778946130.db2.gz QLPUKMNMMJGNPV-LLVKDONJSA-N -1 3 297.782 2.855 20 10 CFCDHM COc1cc([O-])c(CN2C[C@@H](C)O[C@H](C)C2)c(Cl)c1 ZINC001236805689 778946553 /nfs/dbraw/zinc/94/65/53/778946553.db2.gz ZPXRNLCOJXVESH-NXEZZACHSA-N -1 3 285.771 2.663 20 10 CFCDHM COc1cc([O-])c(CN2CCC[C@@H]2CF)c(Cl)c1 ZINC001236806351 778946801 /nfs/dbraw/zinc/94/68/01/778946801.db2.gz VHZDCKGJFKFUER-SECBINFHSA-N -1 3 273.735 2.988 20 10 CFCDHM CO[C@@H](C)C1CN(Cc2c([O-])ccc(F)c2Cl)C1 ZINC001237128989 779014117 /nfs/dbraw/zinc/01/41/17/779014117.db2.gz SQBXYIIHVDISQF-QMMMGPOBSA-N -1 3 273.735 2.651 20 10 CFCDHM C[C@@H]1CC[C@H](O)CN1Cc1c([O-])ccc(F)c1Cl ZINC001237120072 779017699 /nfs/dbraw/zinc/01/76/99/779017699.db2.gz ILSLWYOEWWNAKK-BDAKNGLRSA-N -1 3 273.735 2.530 20 10 CFCDHM C[C@@H]1C[C@@H](O)CCN1Cc1c([O-])ccc(F)c1Cl ZINC001237125587 779019743 /nfs/dbraw/zinc/01/97/43/779019743.db2.gz DXJUDROHYOLZRP-BDAKNGLRSA-N -1 3 273.735 2.530 20 10 CFCDHM [O-]c1c(F)cc(Cl)cc1CN1CC(N2CCCCC2)C1 ZINC001237621934 779145369 /nfs/dbraw/zinc/14/53/69/779145369.db2.gz JPJASHVAIXJDKP-UHFFFAOYSA-N -1 3 298.789 2.855 20 10 CFCDHM [O-]c1c(Cl)cc(F)cc1CN1CCN(CC2CC2)CC1 ZINC001237815191 779187367 /nfs/dbraw/zinc/18/73/67/779187367.db2.gz WWKGKXGTAWJOMG-UHFFFAOYSA-N -1 3 298.789 2.712 20 10 CFCDHM [O-]c1cc(Cl)c(F)cc1CN1CC[C@@]2(CCCO2)C1 ZINC001237935276 779211532 /nfs/dbraw/zinc/21/15/32/779211532.db2.gz UODYIUHZGBCZFU-AWEZNQCLSA-N -1 3 285.746 2.940 20 10 CFCDHM CCC1(O)CCN(Cc2cc(F)c(Cl)cc2[O-])CC1 ZINC001237948735 779213855 /nfs/dbraw/zinc/21/38/55/779213855.db2.gz HOUKWNZPHKURRV-UHFFFAOYSA-N -1 3 287.762 2.922 20 10 CFCDHM [O-]c1cc(Cl)c(F)cc1CN1CCC[C@]12CCOC2 ZINC001237949418 779214079 /nfs/dbraw/zinc/21/40/79/779214079.db2.gz LLAJJJVGENSHBG-CQSZACIVSA-N -1 3 285.746 2.940 20 10 CFCDHM C[C@]1(O)CCCN(Cc2cc(F)cc(Cl)c2[O-])C1 ZINC001237798217 779718167 /nfs/dbraw/zinc/71/81/67/779718167.db2.gz AUUSVJCHISJRBK-ZDUSSCGKSA-N -1 3 273.735 2.532 20 10 CFCDHM [O-]c1cccc(F)c1CN1CCc2cc(O)ccc2C1 ZINC001137833176 780931189 /nfs/dbraw/zinc/93/11/89/780931189.db2.gz WDZNKRZNMUKAQS-UHFFFAOYSA-N -1 3 273.307 2.795 20 10 CFCDHM CO[C@H]1CN(Cc2ccc(F)c(F)c2[O-])CC[C@@H]1C ZINC000703532162 781026169 /nfs/dbraw/zinc/02/61/69/781026169.db2.gz SWOFZNVIUDDPSP-CABZTGNLSA-N -1 3 271.307 2.527 20 10 CFCDHM [O-]c1c(F)cc(F)cc1CN1CCC(F)(F)CC1 ZINC000708420989 781273007 /nfs/dbraw/zinc/27/30/07/781273007.db2.gz ABFQWVQTGNDGIJ-UHFFFAOYSA-N -1 3 263.234 2.902 20 10 CFCDHM CC(=O)c1cc(F)cc(CN2CCC[C@@H]2C)c1[O-] ZINC000037911613 372735340 /nfs/dbraw/zinc/73/53/40/372735340.db2.gz PPUJDTVUSPPUEH-VIFPVBQESA-N -1 3 251.301 2.718 20 10 CFCDHM CC(C)N1CCN(Cc2cccc(Cl)c2[O-])CC1 ZINC000124527510 377061401 /nfs/dbraw/zinc/06/14/01/377061401.db2.gz ZFEYAPDWCIVIQH-UHFFFAOYSA-N -1 3 268.788 2.572 20 10 CFCDHM [O-]c1cccc(Cl)c1CN1CCO[C@H]2CCC[C@@H]21 ZINC000132768318 377875109 /nfs/dbraw/zinc/87/51/09/377875109.db2.gz UQGSFIYKHRQAEX-JSGCOSHPSA-N -1 3 267.756 2.799 20 10 CFCDHM C[C@H]1CN(Cc2cc(Cl)ccc2[O-])CCCO1 ZINC000134145065 377986560 /nfs/dbraw/zinc/98/65/60/377986560.db2.gz YTZGNONFNXGMCO-JTQLQIEISA-N -1 3 255.745 2.656 20 10 CFCDHM CC[C@@]1(C)CN(Cc2cc(F)cc(C(C)=O)c2[O-])CCO1 ZINC000135736767 378161443 /nfs/dbraw/zinc/16/14/43/378161443.db2.gz LBHPJTNBRPVUPN-INIZCTEOSA-N -1 3 295.354 2.735 20 10 CFCDHM Cc1ccc(C(=O)N(C)[C@@H](C)c2ccncc2)c([O-])c1O ZINC000179460404 380546470 /nfs/dbraw/zinc/54/64/70/380546470.db2.gz MHUGHVIUFVOWRN-NSHDSACASA-N -1 3 286.331 2.634 20 10 CFCDHM [O-]c1ccccc1CN1CCO[C@@H](c2ccco2)C1 ZINC000179583869 380561419 /nfs/dbraw/zinc/56/14/19/380561419.db2.gz OTIPIWQSAFCXGN-OAHLLOKOSA-N -1 3 259.305 2.559 20 10 CFCDHM C[C@]1(O)CCN(Cc2cc(Cl)cc(Cl)c2[O-])C1 ZINC000180192196 380630335 /nfs/dbraw/zinc/63/03/35/380630335.db2.gz RNMSRQANMIGNFX-LBPRGKRZSA-N -1 3 276.163 2.656 20 10 CFCDHM O=C(NC[C@H]1CCCCC1(F)F)c1cccc(O)c1[O-] ZINC000295417602 380841191 /nfs/dbraw/zinc/84/11/91/380841191.db2.gz MDBOLJCUFRDYSZ-SECBINFHSA-N -1 3 285.290 2.653 20 10 CFCDHM Cc1ccc(C(=O)Nc2nccn2CC(C)C)c([O-])c1O ZINC000182294470 381052298 /nfs/dbraw/zinc/05/22/98/381052298.db2.gz OAMLCQZBBXMRHJ-UHFFFAOYSA-N -1 3 289.335 2.511 20 10 CFCDHM CC[C@@H](c1ccccc1[O-])N1CCn2c(nnc2C2CC2)C1 ZINC000368815998 381140132 /nfs/dbraw/zinc/14/01/32/381140132.db2.gz IGWSSMZPSXLUJQ-AWEZNQCLSA-N -1 3 298.390 2.828 20 10 CFCDHM CCOC(=O)[C@@H]1CCCCCN1Cc1ccccc1[O-] ZINC000371465879 381635060 /nfs/dbraw/zinc/63/50/60/381635060.db2.gz IWTMRIKMGQOBCR-AWEZNQCLSA-N -1 3 277.364 2.700 20 10 CFCDHM C[C@@H]1CC2(CCC2)CN1C(=O)c1cccc(O)c1[O-] ZINC000372891174 381884100 /nfs/dbraw/zinc/88/41/00/381884100.db2.gz LRDSYQHCPGOECZ-SNVBAGLBSA-N -1 3 261.321 2.503 20 10 CFCDHM CN1CCc2cc(CNCc3cc([O-])cc(F)c3)ccc21 ZINC000373519319 382016724 /nfs/dbraw/zinc/01/67/24/382016724.db2.gz AUTKPCRXULAOOB-UHFFFAOYSA-N -1 3 286.350 2.813 20 10 CFCDHM [O-]c1ccc(F)cc1CN1CCC[C@@H]1c1ncc[nH]1 ZINC000375353868 382081407 /nfs/dbraw/zinc/08/14/07/382081407.db2.gz QYNNVCMMIVLMJL-GFCCVEGCSA-N -1 3 261.300 2.592 20 10 CFCDHM [O-]c1ccc(Cl)c(F)c1CN1CCCC[C@@H](CO)C1 ZINC000377234823 382237345 /nfs/dbraw/zinc/23/73/45/382237345.db2.gz AYBDPJLBFWBIRF-SNVBAGLBSA-N -1 3 287.762 2.779 20 10 CFCDHM [O-]c1cc(F)c(Cl)cc1CN1CCC[C@H](O)CC1 ZINC000293914088 382334780 /nfs/dbraw/zinc/33/47/80/382334780.db2.gz GEIVPDDDIHQZOM-JTQLQIEISA-N -1 3 273.735 2.532 20 10 CFCDHM [O-]c1ccc(Cl)c(F)c1CN1CC([C@H]2CCOC2)C1 ZINC000365558262 382412176 /nfs/dbraw/zinc/41/21/76/382412176.db2.gz CIQPJJAVJUPEOK-VIFPVBQESA-N -1 3 285.746 2.653 20 10 CFCDHM CO[C@H](C)c1nc(CNCc2ccccc2[O-])cs1 ZINC000267650220 384433055 /nfs/dbraw/zinc/43/30/55/384433055.db2.gz UHODADKXZRLJRF-SNVBAGLBSA-N -1 3 278.377 2.846 20 10 CFCDHM C[C@H](NCc1cc(Cl)cc([N+](=O)[O-])c1[O-])c1cn[nH]c1 ZINC000270165793 385000295 /nfs/dbraw/zinc/00/02/95/385000295.db2.gz GPILJTGVQFETGG-ZETCQYMHSA-N -1 3 296.714 2.528 20 10 CFCDHM [O-]c1c(Cl)cccc1CN1CCN(C2CCC2)CC1 ZINC000271802357 385392348 /nfs/dbraw/zinc/39/23/48/385392348.db2.gz LASRUKZEORPUQT-UHFFFAOYSA-N -1 3 280.799 2.716 20 10 CFCDHM CCn1cc(CNCc2cccc(Cl)c2[O-])cn1 ZINC000271794056 385392980 /nfs/dbraw/zinc/39/29/80/385392980.db2.gz HMCZNYSIPWKFLM-UHFFFAOYSA-N -1 3 265.744 2.552 20 10 CFCDHM CC(C)(C)OC(=O)[C@H]1CCN(Cc2cccc(F)c2[O-])C1 ZINC000272331313 385512510 /nfs/dbraw/zinc/51/25/10/385512510.db2.gz WNBPFGUNIPOXDJ-LBPRGKRZSA-N -1 3 295.354 2.695 20 10 CFCDHM Cc1ccc(C(=O)N2CCc3ccsc3C2)c([O-])c1O ZINC000273068686 385669840 /nfs/dbraw/zinc/66/98/40/385669840.db2.gz ZQLANCARZZLHJK-UHFFFAOYSA-N -1 3 289.356 2.666 20 10 CFCDHM CCCCN(Cc1ccccc1[O-])[C@H](C)c1nncn1C ZINC000287006646 385760775 /nfs/dbraw/zinc/76/07/75/385760775.db2.gz RGGORIHIEGMHPI-CYBMUJFWSA-N -1 3 288.395 2.884 20 10 CFCDHM [O-]c1ccc(F)cc1CN1CCc2ccccc2[C@H]1CO ZINC000180163900 285281750 /nfs/dbraw/zinc/28/17/50/285281750.db2.gz KUSSYTFMSGOAOP-MRXNPFEDSA-N -1 3 287.334 2.623 20 10 CFCDHM CN(Cc1cn2c(n1)CCCC2)Cc1cccc(F)c1[O-] ZINC000373887462 393475462 /nfs/dbraw/zinc/47/54/62/393475462.db2.gz ZDMRVQNNXYZAIT-UHFFFAOYSA-N -1 3 289.354 2.696 20 10 CFCDHM O=C(/C=C\c1cncc([O-])c1)N1CCc2ccc(F)cc21 ZINC000492943909 394104045 /nfs/dbraw/zinc/10/40/45/394104045.db2.gz XUNHTTJDPWAUAF-RJRFIUFISA-N -1 3 284.290 2.529 20 10 CFCDHM CC[C@@H](c1ccccc1[O-])N1CC(F)(F)C[C@@H]1CO ZINC000368037698 267139676 /nfs/dbraw/zinc/13/96/76/267139676.db2.gz NMKNGVHHGABUTC-PWSUYJOCSA-N -1 3 271.307 2.545 20 10 CFCDHM CC[C@@H](c1ccccc1[O-])N1CCc2c(ncn2C)C1 ZINC000368880355 267210627 /nfs/dbraw/zinc/21/06/27/267210627.db2.gz QYTPEEUJZKDDRX-AWEZNQCLSA-N -1 3 271.364 2.635 20 10 CFCDHM CC(=O)c1cc(Cl)cc(CN2CCOCC[C@@H]2C)c1[O-] ZINC000362235271 278244024 /nfs/dbraw/zinc/24/40/24/278244024.db2.gz KCAPQKVHGHMZFX-JTQLQIEISA-N -1 3 297.782 2.859 20 10 CFCDHM O=C(NCC[C@@H]1CC=CCC1)c1cccc(O)c1[O-] ZINC000529868303 333512324 /nfs/dbraw/zinc/51/23/24/333512324.db2.gz QCCRRVZBVPUCDG-LLVKDONJSA-N -1 3 261.321 2.574 20 10 CFCDHM CCC[C@@H](C(=O)OCC)N(C)Cc1ccccc1[O-] ZINC000077284295 520601376 /nfs/dbraw/zinc/60/13/76/520601376.db2.gz IBLNDRPSFOSOBL-ZDUSSCGKSA-N -1 3 265.353 2.556 20 10 CFCDHM CC(=O)c1cc(F)cc(CN(CC(F)F)C2CC2)c1[O-] ZINC000079432514 518284939 /nfs/dbraw/zinc/28/49/39/518284939.db2.gz QWXPIIXSQDKNRM-UHFFFAOYSA-N -1 3 287.281 2.963 20 10 CFCDHM CC(C)C[C@@H]1CCCN(C(=O)c2cccc(O)c2[O-])C1 ZINC000193133338 519264550 /nfs/dbraw/zinc/26/45/50/519264550.db2.gz WQMLBGDYDRWODM-LBPRGKRZSA-N -1 3 277.364 2.996 20 10 CFCDHM CCN(C(=O)c1cccc(O)c1[O-])[C@H]1CCOC(C)(C)C1 ZINC000292517439 520101250 /nfs/dbraw/zinc/10/12/50/520101250.db2.gz BLYXMXCARSNOTI-NSHDSACASA-N -1 3 293.363 2.518 20 10 CFCDHM CCOC[C@@H]1CCN(Cc2cc(F)cc(C(C)=O)c2[O-])C1 ZINC000079497940 520132791 /nfs/dbraw/zinc/13/27/91/520132791.db2.gz PXWMZURLCZJLOP-GFCCVEGCSA-N -1 3 295.354 2.592 20 10 CFCDHM CCN(Cc1ccncc1)Cc1cccc(F)c1[O-] ZINC000289804329 521422257 /nfs/dbraw/zinc/42/22/57/521422257.db2.gz MYXZPYQOZSPLKX-UHFFFAOYSA-N -1 3 260.312 2.948 20 10 CFCDHM CC[C@H]1CO[C@@H](C)CN1Cc1cc(F)cc(C(C)=O)c1[O-] ZINC000048915893 523342369 /nfs/dbraw/zinc/34/23/69/523342369.db2.gz BIZSORJUNPTMOU-HZMBPMFUSA-N -1 3 295.354 2.733 20 10 CFCDHM CO[C@@H](C)CN(C)Cc1cc(Cl)cc(C(C)=O)c1[O-] ZINC000285508075 523407635 /nfs/dbraw/zinc/40/76/35/523407635.db2.gz DEGVZUWFZKWRLI-VIFPVBQESA-N -1 3 285.771 2.715 20 10 CFCDHM C[C@H](CNC(=O)c1cccc(O)c1[O-])Cc1cccs1 ZINC000193093731 524466508 /nfs/dbraw/zinc/46/65/08/524466508.db2.gz ISTQIANTXUYNBU-JTQLQIEISA-N -1 3 291.372 2.768 20 10 CFCDHM C[C@H](NCc1ncccc1N(C)C)c1cc(F)ccc1[O-] ZINC000289941180 525489439 /nfs/dbraw/zinc/48/94/39/525489439.db2.gz VZAFOAKGNHATSJ-NSHDSACASA-N -1 3 289.354 2.843 20 10 CFCDHM C[C@@H](NC[C@](C)(O)C(F)(F)F)c1ccc(F)c(F)c1[O-] ZINC000276925924 525506299 /nfs/dbraw/zinc/50/62/99/525506299.db2.gz NHYNQYFSFZTMAU-KBUNVGBDSA-N -1 3 299.239 2.634 20 10 CFCDHM Cc1ccc(C(=O)NC[C@H]2CCCC(F)(F)C2)c([O-])c1O ZINC000282339553 526181045 /nfs/dbraw/zinc/18/10/45/526181045.db2.gz WFIUSTQUDOHUFD-JTQLQIEISA-N -1 3 299.317 2.962 20 10 CFCDHM Cc1nnc([C@@H](C)N[C@@H](C)c2ccccc2[O-])s1 ZINC000274275159 526397129 /nfs/dbraw/zinc/39/71/29/526397129.db2.gz XKENSQJMEMLXIT-DTWKUNHWSA-N -1 3 263.366 2.964 20 10 CFCDHM Cc1nnsc1CN[C@@H](C)c1cc(F)ccc1[O-] ZINC000293351927 526447826 /nfs/dbraw/zinc/44/78/26/526447826.db2.gz GZJHUGMEAYJBDR-ZETCQYMHSA-N -1 3 267.329 2.542 20 10 CFCDHM Cc1noc(C)c1CNCc1c([O-])cccc1Cl ZINC000083552202 526515005 /nfs/dbraw/zinc/51/50/05/526515005.db2.gz DFZPXQHAFFJCMZ-UHFFFAOYSA-N -1 3 266.728 2.940 20 10 CFCDHM O=C(c1cccc(O)c1[O-])N1CCC2(CCCC2)C1 ZINC000193107112 526771365 /nfs/dbraw/zinc/77/13/65/526771365.db2.gz IZFYIIGRELZTDV-UHFFFAOYSA-N -1 3 261.321 2.504 20 10 CFCDHM O=[N+]([O-])c1cc(Cl)cc(CNC2CC(F)(F)C2)c1[O-] ZINC000277599013 527332256 /nfs/dbraw/zinc/33/22/56/527332256.db2.gz ILLOGSXURNNNFN-UHFFFAOYSA-N -1 3 292.669 2.841 20 10 CFCDHM [O-]c1ccc(-c2ccccc2)cc1CNCC(F)(F)CO ZINC000274224054 527521669 /nfs/dbraw/zinc/52/16/69/527521669.db2.gz CJQDAPKDCWIHRL-UHFFFAOYSA-N -1 3 293.313 2.776 20 10 CFCDHM CC[C@@H]1COCCN1Cc1c([O-])ccc2ccncc21 ZINC000738083271 574057387 /nfs/dbraw/zinc/05/73/87/574057387.db2.gz VHEKTSRDUGALLE-CYBMUJFWSA-N -1 3 272.348 2.551 20 10 CFCDHM CCO[C@@H]1C[C@@H](N(C)C(=O)c2cc([O-])cs2)C1(C)C ZINC000754905150 574127623 /nfs/dbraw/zinc/12/76/23/574127623.db2.gz CWQLMUJSFIQFEY-VXGBXAGGSA-N -1 3 283.393 2.729 20 10 CFCDHM C[C@@H](CNC(=O)c1cc([O-])cs1)c1ccccc1 ZINC000731861395 574130704 /nfs/dbraw/zinc/13/07/04/574130704.db2.gz ABEHBYLGYPPFHC-JTQLQIEISA-N -1 3 261.346 2.987 20 10 CFCDHM O=C(NCCc1cc(F)cc(F)c1)c1cc([O-])cs1 ZINC000731872350 574131832 /nfs/dbraw/zinc/13/18/32/574131832.db2.gz GJXKQQFQEWNHFE-UHFFFAOYSA-N -1 3 283.299 2.704 20 10 CFCDHM COc1ccccc1CN(C)C(=O)c1cc([O-])cs1 ZINC000732258352 574147436 /nfs/dbraw/zinc/14/74/36/574147436.db2.gz KUCFMXXHRNHQGA-UHFFFAOYSA-N -1 3 277.345 2.735 20 10 CFCDHM CC(=O)Nc1cccc(NC(=O)c2cc([O-])cs2)c1 ZINC000732264144 574147915 /nfs/dbraw/zinc/14/79/15/574147915.db2.gz AXUCTZJGEKGYKU-UHFFFAOYSA-N -1 3 276.317 2.664 20 10 CFCDHM O=C(c1cc([O-])cs1)N1CCO[C@H](c2ccccc2)C1 ZINC000732266391 574148018 /nfs/dbraw/zinc/14/80/18/574148018.db2.gz APEVWJLPZFNRQD-ZDUSSCGKSA-N -1 3 289.356 2.667 20 10 CFCDHM O=C(Nc1ccnn1Cc1ccccc1)c1cc([O-])cs1 ZINC000732262624 574148026 /nfs/dbraw/zinc/14/80/26/574148026.db2.gz VRJCDCGVNAQXCJ-UHFFFAOYSA-N -1 3 299.355 2.951 20 10 CFCDHM CN(CCCOc1ccccc1)C(=O)c1cc([O-])cs1 ZINC000732271889 574148419 /nfs/dbraw/zinc/14/84/19/574148419.db2.gz YHVAUUQZNQXAQJ-UHFFFAOYSA-N -1 3 291.372 2.995 20 10 CFCDHM O=C(Nc1ccn(Cc2ccccc2)n1)c1cc([O-])cs1 ZINC000732274072 574148526 /nfs/dbraw/zinc/14/85/26/574148526.db2.gz ILLZCPMTXSKYDC-UHFFFAOYSA-N -1 3 299.355 2.951 20 10 CFCDHM C[C@H](c1ccncc1)N(C)C(=O)c1cc([O-])cs1 ZINC000732273277 574148609 /nfs/dbraw/zinc/14/86/09/574148609.db2.gz OWSJHWUSZZZDAY-SECBINFHSA-N -1 3 262.334 2.682 20 10 CFCDHM CCOc1ccc(CNC(=O)c2cc([O-])cs2)cc1 ZINC000732269817 574148853 /nfs/dbraw/zinc/14/88/53/574148853.db2.gz VAIDBLGHVHBIIV-UHFFFAOYSA-N -1 3 277.345 2.782 20 10 CFCDHM O=C(NCc1ccccc1-n1ccnc1)c1cc([O-])cs1 ZINC000732275962 574149391 /nfs/dbraw/zinc/14/93/91/574149391.db2.gz LLLAQJAVXSJXHR-UHFFFAOYSA-N -1 3 299.355 2.569 20 10 CFCDHM Cc1cn2cc(NC(=O)c3cc([O-])cs3)ccc2n1 ZINC000732282254 574149882 /nfs/dbraw/zinc/14/98/82/574149882.db2.gz CDGGJXOAEWMVRJ-UHFFFAOYSA-N -1 3 273.317 2.662 20 10 CFCDHM CN(C)c1ccc(CNC(=O)c2cc([O-])cs2)cc1F ZINC000732279764 574150026 /nfs/dbraw/zinc/15/00/26/574150026.db2.gz YMROFYCUUYJMDC-UHFFFAOYSA-N -1 3 294.351 2.589 20 10 CFCDHM Cc1cc([O-])c(C[N@H+](CC(=O)[O-])C2CC2)cc1C(C)C ZINC000738239859 574161548 /nfs/dbraw/zinc/16/15/48/574161548.db2.gz MZLREODNEHFPOH-UHFFFAOYSA-N -1 3 277.364 2.873 20 10 CFCDHM Cc1cc([O-])c(C[N@@H+](CC(=O)[O-])C2CC2)cc1C(C)C ZINC000738239859 574161551 /nfs/dbraw/zinc/16/15/51/574161551.db2.gz MZLREODNEHFPOH-UHFFFAOYSA-N -1 3 277.364 2.873 20 10 CFCDHM C[C@H](COC(=O)c1cc([O-])cs1)C(F)(F)F ZINC000748276662 574244627 /nfs/dbraw/zinc/24/46/27/574244627.db2.gz GEVLLLWKOFVTLW-RXMQYKEDSA-N -1 3 254.229 2.809 20 10 CFCDHM C[C@H]1C[C@@H](NCc2nccn2C)c2c1c(F)ccc2[O-] ZINC000756539707 574244719 /nfs/dbraw/zinc/24/47/19/574244719.db2.gz SBFDACJGGWYLTG-GXSJLCMTSA-N -1 3 275.327 2.603 20 10 CFCDHM Cc1ccc(C(=O)NCc2ccccc2O)c([O-])c1C ZINC000748345594 574247944 /nfs/dbraw/zinc/24/79/44/574247944.db2.gz OEMJVDUUHLQESD-UHFFFAOYSA-N -1 3 271.316 2.645 20 10 CFCDHM C[C@@H](N[C@@H](C)c1cnn(C)c1)c1cc(F)cc(F)c1[O-] ZINC000756603371 574251924 /nfs/dbraw/zinc/25/19/24/574251924.db2.gz BIMAQZHNPHUQGG-DTWKUNHWSA-N -1 3 281.306 2.816 20 10 CFCDHM C[C@H](NCc1ncccc1F)c1ccc(F)cc1[O-] ZINC000756769863 574261523 /nfs/dbraw/zinc/26/15/23/574261523.db2.gz RHOIQOABECQXIR-VIFPVBQESA-N -1 3 264.275 2.916 20 10 CFCDHM C[C@H](NCc1cocn1)c1cc(Br)ccc1[O-] ZINC000756830448 574266310 /nfs/dbraw/zinc/26/63/10/574266310.db2.gz HKGWVBFHEGWGTR-QMMMGPOBSA-N -1 3 297.152 2.994 20 10 CFCDHM CCc1ccc([O-])c(C(=O)NCc2ccccc2O)c1 ZINC000748842268 574271091 /nfs/dbraw/zinc/27/10/91/574271091.db2.gz XPPZEUIKKWCMRW-UHFFFAOYSA-N -1 3 271.316 2.590 20 10 CFCDHM Cc1cnc([C@H](C)NC(=O)c2cc([O-])cs2)s1 ZINC000750250229 574331716 /nfs/dbraw/zinc/33/17/16/574331716.db2.gz QBOZVUPLEBXYAI-ZETCQYMHSA-N -1 3 268.363 2.710 20 10 CFCDHM CO[C@H](C)CN(Cc1cc(F)cc(C(C)=O)c1[O-])C(C)C ZINC000750825478 574357407 /nfs/dbraw/zinc/35/74/07/574357407.db2.gz DBIKHPAVFHATQH-LLVKDONJSA-N -1 3 297.370 2.979 20 10 CFCDHM C[C@@]1(c2ccccc2)C[C@H]1NC(=O)c1cc([O-])cs1 ZINC000743641975 574370051 /nfs/dbraw/zinc/37/00/51/574370051.db2.gz LICSAFGVSLICFC-HIFRSBDPSA-N -1 3 273.357 2.914 20 10 CFCDHM CSCC[C@@H](C)N(C)C(=O)c1cc([O-])cs1 ZINC000751396829 574376489 /nfs/dbraw/zinc/37/64/89/574376489.db2.gz XAYFKFNCAIPYHW-MRVPVSSYSA-N -1 3 259.396 2.667 20 10 CFCDHM Cc1ccc(C(=O)NCc2ccc(Cl)cc2)c([O-])c1O ZINC000751529834 574378529 /nfs/dbraw/zinc/37/85/29/574378529.db2.gz GXQCLIRVBBCMJK-UHFFFAOYSA-N -1 3 291.734 2.990 20 10 CFCDHM O=C([O-])CC[NH2+]Cc1cc(-c2ccccc2)ccc1[O-] ZINC000819498804 597133393 /nfs/dbraw/zinc/13/33/93/597133393.db2.gz CBJIKQCORHKJMD-UHFFFAOYSA-N -1 3 271.316 2.624 20 10 CFCDHM C[C@@H]1CSCCN1Cc1cc(F)cc(F)c1[O-] ZINC000894028166 618280640 /nfs/dbraw/zinc/28/06/40/618280640.db2.gz WLJUAIIUWYFLEI-MRVPVSSYSA-N -1 3 259.321 2.608 20 10 CFCDHM O=C([O-])[C@@]1(F)CC[N@H+](Cc2c([O-])ccc3ccccc32)C1 ZINC000833176011 601371710 /nfs/dbraw/zinc/37/17/10/601371710.db2.gz VTCNGJUBCWMYJD-MRXNPFEDSA-N -1 3 289.306 2.544 20 10 CFCDHM O=C([O-])[C@@]1(F)CC[N@@H+](Cc2c([O-])ccc3ccccc32)C1 ZINC000833176011 601371712 /nfs/dbraw/zinc/37/17/12/601371712.db2.gz VTCNGJUBCWMYJD-MRXNPFEDSA-N -1 3 289.306 2.544 20 10 CFCDHM CC[C@]1(C(=O)[O-])CCC[N@H+](Cc2cc(F)ccc2[O-])C1 ZINC000234103067 617994110 /nfs/dbraw/zinc/99/41/10/617994110.db2.gz VAQYCTHOOVYLKH-HNNXBMFYSA-N -1 3 281.327 2.608 20 10 CFCDHM CC[C@]1(C(=O)[O-])CCC[N@@H+](Cc2cc(F)ccc2[O-])C1 ZINC000234103067 617994112 /nfs/dbraw/zinc/99/41/12/617994112.db2.gz VAQYCTHOOVYLKH-HNNXBMFYSA-N -1 3 281.327 2.608 20 10 CFCDHM Cc1cccc(S(=O)(=O)[N-]c2ccc(O)cc2C)c1 ZINC000078005190 618417920 /nfs/dbraw/zinc/41/79/20/618417920.db2.gz GKPUKRPJGGWRRS-UHFFFAOYSA-N -1 3 277.345 2.810 20 10 CFCDHM COc1cccc(C)c1NC(=O)c1ccc(C)c(O)c1[O-] ZINC000192941269 618444458 /nfs/dbraw/zinc/44/44/58/618444458.db2.gz MZXULWUNJAZSAK-UHFFFAOYSA-N -1 3 287.315 2.976 20 10 CFCDHM COCc1cccc(NC(=O)c2ccc(C)c(O)c2[O-])c1 ZINC000177670488 618469500 /nfs/dbraw/zinc/46/95/00/618469500.db2.gz VNYNQPHXLBTXGB-UHFFFAOYSA-N -1 3 287.315 2.805 20 10 CFCDHM Cc1nc(C)c(CNCc2cccc(Cl)c2[O-])o1 ZINC000311704176 618720603 /nfs/dbraw/zinc/72/06/03/618720603.db2.gz STEPOBLQBZHVQD-UHFFFAOYSA-N -1 3 266.728 2.940 20 10 CFCDHM [O-]c1ccc(Br)cc1CN1CCC(F)(F)C1 ZINC000313353464 618981794 /nfs/dbraw/zinc/98/17/94/618981794.db2.gz VYWMLKAQKNKHFT-UHFFFAOYSA-N -1 3 292.123 2.996 20 10 CFCDHM Cc1cc([O-])c(CN[C@@H]2CCn3ccnc32)c(Cl)c1 ZINC000840949120 619117983 /nfs/dbraw/zinc/11/79/83/619117983.db2.gz NXXGFQNXEPMCHZ-GFCCVEGCSA-N -1 3 277.755 2.785 20 10 CFCDHM Cc1cnc(CNCc2cc(Cl)ccc2[O-])o1 ZINC000235954579 619194014 /nfs/dbraw/zinc/19/40/14/619194014.db2.gz UXXCFNLASDJQEN-UHFFFAOYSA-N -1 3 252.701 2.632 20 10 CFCDHM C[C@@H]1[C@H](CO)CCCN1Cc1c([O-])ccc(Cl)c1F ZINC000840978075 619207297 /nfs/dbraw/zinc/20/72/97/619207297.db2.gz KZMURXFESCAXBV-ZJUUUORDSA-N -1 3 287.762 2.778 20 10 CFCDHM [O-]c1c(F)cc(F)cc1CN1CCCSCC1 ZINC000894421330 619380375 /nfs/dbraw/zinc/38/03/75/619380375.db2.gz CYXQSMANBMPFBN-UHFFFAOYSA-N -1 3 259.321 2.609 20 10 CFCDHM Cc1cc([O-])c(CN2CCc3ncncc3C2)c(Cl)c1 ZINC000895723157 619591466 /nfs/dbraw/zinc/59/14/66/619591466.db2.gz CIPZVHSPUNPFNP-UHFFFAOYSA-N -1 3 289.766 2.702 20 10 CFCDHM Cc1cc(CNCc2c([O-])cccc2F)sn1 ZINC000896636197 619779523 /nfs/dbraw/zinc/77/95/23/619779523.db2.gz AFWKJMPUOLAENB-UHFFFAOYSA-N -1 3 252.314 2.586 20 10 CFCDHM Cc1cnc(CNCc2c([O-])cccc2F)s1 ZINC000896636296 619779898 /nfs/dbraw/zinc/77/98/98/619779898.db2.gz AJEFSFSNGANLTM-UHFFFAOYSA-N -1 3 252.314 2.586 20 10 CFCDHM [O-]c1cccc(F)c1CNCc1ccnn1C1CCC1 ZINC000896636810 619780020 /nfs/dbraw/zinc/78/00/20/619780020.db2.gz BVNHWXVORXSRFB-UHFFFAOYSA-N -1 3 275.327 2.743 20 10 CFCDHM Cn1cc(CNCc2c([O-])cccc2F)c(C(C)(C)C)n1 ZINC000896638896 619780943 /nfs/dbraw/zinc/78/09/43/619780943.db2.gz YRCSCZKUBKEIFA-UHFFFAOYSA-N -1 3 291.370 2.852 20 10 CFCDHM CC(C)c1c[nH]c(CNCc2c([O-])cccc2F)n1 ZINC000896641633 619782196 /nfs/dbraw/zinc/78/21/96/619782196.db2.gz OCJLAOHIQMNPFR-UHFFFAOYSA-N -1 3 263.316 2.668 20 10 CFCDHM CCO[C@H]1CCN(Cc2c([O-])ccc(Cl)c2F)C1 ZINC000897067141 619924519 /nfs/dbraw/zinc/92/45/19/619924519.db2.gz FAIMEDAPKWCNMG-VIFPVBQESA-N -1 3 273.735 2.796 20 10 CFCDHM O=C(CCCC1CC1)NCc1c([O-])cccc1F ZINC000928705570 619995312 /nfs/dbraw/zinc/99/53/12/619995312.db2.gz JXVHLYPFIXGDNQ-UHFFFAOYSA-N -1 3 251.301 2.728 20 10 CFCDHM O=C(NCc1c([O-])cccc1F)[C@H]1[C@@H]2CCCC[C@@H]21 ZINC000928705841 619995477 /nfs/dbraw/zinc/99/54/77/619995477.db2.gz OCOUGRWYPIVMBJ-MSRIBSCDSA-N -1 3 263.312 2.584 20 10 CFCDHM CO[C@@H]1CCC[C@@H](CC(=O)NCc2c([O-])cccc2F)C1 ZINC000928707757 619996270 /nfs/dbraw/zinc/99/62/70/619996270.db2.gz HTGWZOJMQIWSQV-VXGBXAGGSA-N -1 3 295.354 2.743 20 10 CFCDHM C[C@H]1CCC[C@@H]1CC(=O)NCc1c([O-])cccc1F ZINC000928707712 619996288 /nfs/dbraw/zinc/99/62/88/619996288.db2.gz GYDIOPYFOIRGEW-WDEREUQCSA-N -1 3 265.328 2.974 20 10 CFCDHM O=C(c1cccc(O)c1[O-])N1CCCCCCCC1 ZINC000322086310 620231437 /nfs/dbraw/zinc/23/14/37/620231437.db2.gz PSTMAIPMPKGYJA-UHFFFAOYSA-N -1 3 263.337 2.894 20 10 CFCDHM Cc1ncoc1CNCc1cccc(Cl)c1[O-] ZINC000898216269 620346566 /nfs/dbraw/zinc/34/65/66/620346566.db2.gz WRLVLLONRKNTRI-UHFFFAOYSA-N -1 3 252.701 2.632 20 10 CFCDHM C[C@@H](NCc1cc(C2CC2)n(C)n1)c1c([O-])cccc1F ZINC000927107457 620453915 /nfs/dbraw/zinc/45/39/15/620453915.db2.gz IIRZXAURJXILEM-SNVBAGLBSA-N -1 3 289.354 2.993 20 10 CFCDHM Cc1ccc(C(=O)Nc2ccc(F)cc2F)c([O-])c1O ZINC000179384068 620847531 /nfs/dbraw/zinc/84/75/31/620847531.db2.gz KWWBRZIOOZJQCD-UHFFFAOYSA-N -1 3 279.242 2.937 20 10 CFCDHM CCc1csc([C@@H](C)NC(=O)c2cccc(O)c2[O-])n1 ZINC000910733391 622471518 /nfs/dbraw/zinc/47/15/18/622471518.db2.gz CJQXCCDNUNTTKO-MRVPVSSYSA-N -1 3 292.360 2.608 20 10 CFCDHM Cc1cc(=O)[n-]c(C=Cc2ccc(N(C)C)cc2)n1 ZINC000167370204 623051680 /nfs/dbraw/zinc/05/16/80/623051680.db2.gz KOKXFRAJKSVBRQ-RMKNXTFCSA-N -1 3 255.321 2.727 20 10 CFCDHM [O-]c1ccc(Br)cc1CN1CC2(CC2)C1 ZINC000824533214 623518813 /nfs/dbraw/zinc/51/88/13/623518813.db2.gz CAERBXLEXJCQBP-UHFFFAOYSA-N -1 3 268.154 2.751 20 10 CFCDHM Cc1cc([O-])c(CN2CCO[C@@H](C)C2)cc1Cl ZINC000824542208 623520990 /nfs/dbraw/zinc/52/09/90/623520990.db2.gz QMJJFYXLTJOEQS-JTQLQIEISA-N -1 3 255.745 2.575 20 10 CFCDHM Cc1cc([O-])c(CN2CCOCC2(C)C)cc1Cl ZINC000824605102 623531055 /nfs/dbraw/zinc/53/10/55/623531055.db2.gz FLDWVKNTJSTISR-UHFFFAOYSA-N -1 3 269.772 2.965 20 10 CFCDHM Cc1cc([O-])c(CN2CCn3ccnc3C2)cc1Cl ZINC000824682925 623544854 /nfs/dbraw/zinc/54/48/54/623544854.db2.gz PCZCQCDCISQJPR-UHFFFAOYSA-N -1 3 277.755 2.566 20 10 CFCDHM Cc1cc([O-])c(CN2C[C@H]3CC[C@@H](C2)O3)cc1Cl ZINC000824819798 623572570 /nfs/dbraw/zinc/57/25/70/623572570.db2.gz SUCMDILPOKXCHQ-TXEJJXNPSA-N -1 3 267.756 2.717 20 10 CFCDHM CC[C@H](C)[C@@H](C)NC(=O)NCc1c([O-])cccc1F ZINC000914366236 623773768 /nfs/dbraw/zinc/77/37/68/623773768.db2.gz MCJNIHWNKJKZPG-VHSXEESVSA-N -1 3 268.332 2.765 20 10 CFCDHM Cc1cc([O-])c(CN(C)[C@@H]2CC(C)(C)OC2=O)cc1Cl ZINC000825991610 623778845 /nfs/dbraw/zinc/77/88/45/623778845.db2.gz KHLDPNIPDMEIJV-GFCCVEGCSA-N -1 3 297.782 2.880 20 10 CFCDHM Cc1noc(C2CN(Cc3cc(Cl)c(C)cc3[O-])C2)n1 ZINC000826114463 623795230 /nfs/dbraw/zinc/79/52/30/623795230.db2.gz ZXXBYYMNDYOWDB-UHFFFAOYSA-N -1 3 293.754 2.645 20 10 CFCDHM C[C@@H]1C[C@@H](NCc2cc(Cl)c(F)cc2[O-])c2ncnn21 ZINC000826889590 623902972 /nfs/dbraw/zinc/90/29/72/623902972.db2.gz WHIJYGITQKRSSI-RDDDGLTNSA-N -1 3 296.733 2.572 20 10 CFCDHM C[C@@H]1CN(Cc2cc(Cl)cc(F)c2[O-])C[C@@H](C)C1O ZINC000827151782 623955134 /nfs/dbraw/zinc/95/51/34/623955134.db2.gz JPLIXEWGNUYQDK-RKDXNWHRSA-N -1 3 287.762 2.633 20 10 CFCDHM [O-]c1c(Cl)cc(Cl)cc1CN1CC[C@@]2(O)C[C@H]2C1 ZINC000827290901 623982506 /nfs/dbraw/zinc/98/25/06/623982506.db2.gz HXOGIWHDEMQJBK-TVQRCGJNSA-N -1 3 288.174 2.656 20 10 CFCDHM O=C(C[C@@H]1CCCC1(F)F)NCc1c([O-])cccc1F ZINC000830179572 624659799 /nfs/dbraw/zinc/65/97/99/624659799.db2.gz ASZQBEPAKSHTIP-VIFPVBQESA-N -1 3 287.281 2.973 20 10 CFCDHM CC[C@@H]1CCC[C@@H]1NC(=O)NCc1c([O-])cccc1F ZINC000921424041 624877775 /nfs/dbraw/zinc/87/77/75/624877775.db2.gz BLTSTPOWILATIH-MFKMUULPSA-N -1 3 280.343 2.909 20 10 CFCDHM O=C(N[C@@H]1CCSC2(CCC2)C1)c1cccc(O)c1[O-] ZINC000834735723 625818993 /nfs/dbraw/zinc/81/89/93/625818993.db2.gz WFLKZEUNHMBATN-SNVBAGLBSA-N -1 3 293.388 2.646 20 10 CFCDHM CC[C@H](N[C@@H]1CCn2ccnc21)c1ccc(F)cc1[O-] ZINC000834831937 625889432 /nfs/dbraw/zinc/88/94/32/625889432.db2.gz LTTHTTJJTDVCKI-QWHCGFSZSA-N -1 3 275.327 2.914 20 10 CFCDHM CCn1ccnc1CN[C@@H](C)c1cc(F)cc(F)c1[O-] ZINC000834880256 625907715 /nfs/dbraw/zinc/90/77/15/625907715.db2.gz QIQUHBGVYRLSNG-VIFPVBQESA-N -1 3 281.306 2.738 20 10 CFCDHM COc1cccnc1CN[C@H](C)c1ccc(F)cc1[O-] ZINC000834906343 625918262 /nfs/dbraw/zinc/91/82/62/625918262.db2.gz PCZMRXPSSDMNJV-SNVBAGLBSA-N -1 3 276.311 2.786 20 10 CFCDHM O=C(NCc1c([O-])cccc1F)NC[C@H]1CCCCS1 ZINC000921905015 626176033 /nfs/dbraw/zinc/17/60/33/626176033.db2.gz JYGBTRHBLKHFEW-SNVBAGLBSA-N -1 3 298.383 2.616 20 10 CFCDHM O=C(NCc1c([O-])cccc1F)N[C@H]1CCCC1(F)F ZINC000922489814 626297690 /nfs/dbraw/zinc/29/76/90/626297690.db2.gz LHWBHJQBYIJWKH-NSHDSACASA-N -1 3 288.269 2.518 20 10 CFCDHM O=C(NCCc1ccc(Cl)s1)c1cccc(O)c1[O-] ZINC000186954838 626407820 /nfs/dbraw/zinc/40/78/20/626407820.db2.gz PDSWQKDEGWFVFF-UHFFFAOYSA-N -1 3 297.763 2.785 20 10 CFCDHM C[C@@H](NC(=O)NCc1c([O-])cccc1F)C(C)(C)C ZINC000923085142 626449767 /nfs/dbraw/zinc/44/97/67/626449767.db2.gz QYOCGXGRPRGGGX-SECBINFHSA-N -1 3 268.332 2.765 20 10 CFCDHM CC1(C)CC(NC(=O)NCc2c([O-])cccc2F)C1 ZINC000923348525 626467894 /nfs/dbraw/zinc/46/78/94/626467894.db2.gz HREAMVHBXNGMDE-UHFFFAOYSA-N -1 3 266.316 2.519 20 10 CFCDHM CCS[C@@H]1CC[C@@H](N(C)C(=O)c2cccc(O)c2[O-])C1 ZINC000187191129 626479209 /nfs/dbraw/zinc/47/92/09/626479209.db2.gz YBHKSRZYKGOLMR-GHMZBOCLSA-N -1 3 295.404 2.844 20 10 CFCDHM C[C@@H](N[C@@H](C)c1ccn(C)n1)c1ccc(F)cc1[O-] ZINC000840817844 626522624 /nfs/dbraw/zinc/52/26/24/626522624.db2.gz VOXYXEMVTNGBQD-ZJUUUORDSA-N -1 3 263.316 2.677 20 10 CFCDHM O=C1C[C@H]2CC[C@@H](C1)N2Cc1cccc(Cl)c1[O-] ZINC000839132317 626527970 /nfs/dbraw/zinc/52/79/70/626527970.db2.gz YQVNQZWVUSQTKB-PHIMTYICSA-N -1 3 265.740 2.742 20 10 CFCDHM C/C=C/C[C@H](NCc1cc(F)ccc1[O-])C(=O)OCC ZINC000763361502 626982659 /nfs/dbraw/zinc/98/26/59/626982659.db2.gz LLIRBEDWNGIHCK-LQPUYASZSA-N -1 3 281.327 2.519 20 10 CFCDHM COc1cccc(NC(=O)c2ccc(C)c(O)c2[O-])c1F ZINC000771524674 627611302 /nfs/dbraw/zinc/61/13/02/627611302.db2.gz ULHAMYSWCDHSLR-UHFFFAOYSA-N -1 3 291.278 2.806 20 10 CFCDHM O=C(Nc1ccn(-c2ccccc2)n1)c1cccc(O)c1[O-] ZINC000776325719 628131629 /nfs/dbraw/zinc/13/16/29/628131629.db2.gz PVJIKDXNIQWILO-UHFFFAOYSA-N -1 3 295.298 2.536 20 10 CFCDHM COc1ccccc1N(C)C(=O)c1ccc(C)c(O)c1[O-] ZINC000780902265 628503639 /nfs/dbraw/zinc/50/36/39/628503639.db2.gz BNZFFZXVWQQUAA-UHFFFAOYSA-N -1 3 287.315 2.691 20 10 CFCDHM Cc1cc(Br)c([O-])c(CNc2cnn(C)c2)c1 ZINC000781917472 628591020 /nfs/dbraw/zinc/59/10/20/628591020.db2.gz HTBNLNCVTLVCME-UHFFFAOYSA-N -1 3 296.168 2.809 20 10 CFCDHM CC(C)[C@@H](NC(=O)c1cccc(O)c1[O-])c1ccccn1 ZINC000790754629 629259969 /nfs/dbraw/zinc/25/99/69/629259969.db2.gz QTAXJBHFDCELAH-CQSZACIVSA-N -1 3 286.331 2.620 20 10 CFCDHM C[C@@H]1CN(C(=O)c2cccc(O)c2[O-])CC(C)(C)C1 ZINC000790926884 629271680 /nfs/dbraw/zinc/27/16/80/629271680.db2.gz AHDQFJRFXJRZEB-JTQLQIEISA-N -1 3 263.337 2.606 20 10 CFCDHM CCc1cnccc1[C@H](C)NC(=O)c1cccc(O)c1[O-] ZINC000790919011 629271816 /nfs/dbraw/zinc/27/18/16/629271816.db2.gz ZBUIKZXSLBHBOD-JTQLQIEISA-N -1 3 286.331 2.546 20 10 CFCDHM CC1(C)CN(C(=O)c2cccc(O)c2[O-])CC(C)(C)C1 ZINC000790939434 629273157 /nfs/dbraw/zinc/27/31/57/629273157.db2.gz QNZWTCNVKMZQLP-UHFFFAOYSA-N -1 3 277.364 2.996 20 10 CFCDHM CCN1CCN(Cc2c([O-])ccc(Cl)c2F)C[C@@H]1C ZINC000792167219 629404509 /nfs/dbraw/zinc/40/45/09/629404509.db2.gz FBRDUKPZRDDPTQ-JTQLQIEISA-N -1 3 286.778 2.711 20 10 CFCDHM C[C@H](NC(=O)c1cccc(O)c1[O-])c1ccc(Cl)cn1 ZINC000792448694 629426493 /nfs/dbraw/zinc/42/64/93/629426493.db2.gz TZDUYDRPQVYMTQ-QMMMGPOBSA-N -1 3 292.722 2.637 20 10 CFCDHM COc1cc([N-]S(=O)(=O)c2ccccc2C)ccc1O ZINC000797820341 630107815 /nfs/dbraw/zinc/10/78/15/630107815.db2.gz SIZGYWGPPXIKHT-UHFFFAOYSA-N -1 3 293.344 2.510 20 10 CFCDHM CC(C)[C@@H]1CN(C(=O)c2cccc(O)c2[O-])[C@@H]1C(C)C ZINC000836888066 630908722 /nfs/dbraw/zinc/90/87/22/630908722.db2.gz ITBLFLROTXLEPY-GXTWGEPZSA-N -1 3 277.364 2.850 20 10 CFCDHM Cc1cc(CNCc2c([O-])cc(C)cc2Cl)on1 ZINC000840890600 631252984 /nfs/dbraw/zinc/25/29/84/631252984.db2.gz PGGLVMSQZNBQDQ-UHFFFAOYSA-N -1 3 266.728 2.940 20 10 CFCDHM Cc1cc([O-])c(CN2CCO[C@@H](CF)C2)c(Cl)c1 ZINC000840955421 631282507 /nfs/dbraw/zinc/28/25/07/631282507.db2.gz UUAYDFGSKSUNOD-JTQLQIEISA-N -1 3 273.735 2.524 20 10 CFCDHM CC1(C)[C@H](O)CCN1Cc1c([O-])ccc(Cl)c1F ZINC000812779602 631771644 /nfs/dbraw/zinc/77/16/44/631771644.db2.gz SYSTUUAYPIDGLG-LLVKDONJSA-N -1 3 273.735 2.530 20 10 CFCDHM CC(C)[C@H]1N(C(=O)c2cccc(O)c2[O-])CC12CC=CC2 ZINC000844094799 632117388 /nfs/dbraw/zinc/11/73/88/632117388.db2.gz CFXLBXQGHYZCJQ-OAHLLOKOSA-N -1 3 287.359 2.915 20 10 CFCDHM CCC1(O)CCN(Cc2cc(Cl)c(F)cc2[O-])CC1 ZINC000816514571 632475776 /nfs/dbraw/zinc/47/57/76/632475776.db2.gz BEQLULPNIGTVJE-UHFFFAOYSA-N -1 3 287.762 2.922 20 10 CFCDHM C[C@@H]1CN(Cc2c([O-])ccc(Cl)c2F)C[C@H](C)N1C ZINC000816653383 632505241 /nfs/dbraw/zinc/50/52/41/632505241.db2.gz PWDIQWBZENBBSR-AOOOYVTPSA-N -1 3 286.778 2.709 20 10 CFCDHM CC[C@H]1CN(C)CCN1Cc1c([O-])ccc(Cl)c1F ZINC000816660434 632505878 /nfs/dbraw/zinc/50/58/78/632505878.db2.gz DUHKKDYRFNQOAU-JTQLQIEISA-N -1 3 286.778 2.711 20 10 CFCDHM [O-]c1ccc(Cl)c(F)c1CN1CCC[C@@H](O)CC1 ZINC000816667677 632509961 /nfs/dbraw/zinc/50/99/61/632509961.db2.gz UFCPMDBESJJSSL-SECBINFHSA-N -1 3 273.735 2.532 20 10 CFCDHM C[C@H]1C[C@H](CO)CN(Cc2c([O-])ccc(Cl)c2F)C1 ZINC000817413252 632624500 /nfs/dbraw/zinc/62/45/00/632624500.db2.gz UWLZOERPYKOJTJ-UWVGGRQHSA-N -1 3 287.762 2.635 20 10 CFCDHM O=C(Nc1ccc([C@@H]2CCOC2)cc1)c1cccc(O)c1[O-] ZINC000818731120 632895545 /nfs/dbraw/zinc/89/55/45/632895545.db2.gz PDMROSXHQHCSLI-GFCCVEGCSA-N -1 3 299.326 2.854 20 10 CFCDHM O=C(c1cccc(O)c1[O-])N1CCSC12CCCCC2 ZINC000848051312 633195994 /nfs/dbraw/zinc/19/59/94/633195994.db2.gz DSDJUQDPKWTKBY-UHFFFAOYSA-N -1 3 293.388 2.947 20 10 CFCDHM Cc1noc([C@H](C)N(C)Cc2cc(Cl)ccc2[O-])n1 ZINC000848925544 633408597 /nfs/dbraw/zinc/40/85/97/633408597.db2.gz HAFFBVAEFWBKRG-QMMMGPOBSA-N -1 3 281.743 2.930 20 10 CFCDHM Cc1cc([O-])c([C@@H]2NC(=O)[C@H]3C[C@@H](C)CCN32)cc1Cl ZINC000849183462 633580394 /nfs/dbraw/zinc/58/03/94/633580394.db2.gz TVBGQPRACAOPQY-REAQECSSSA-N -1 3 294.782 2.583 20 10 CFCDHM COc1ccnc(CN[C@@H](C)c2ccc(F)cc2[O-])c1F ZINC000850536063 634041081 /nfs/dbraw/zinc/04/10/81/634041081.db2.gz BDEGZFKCAMVBQK-VIFPVBQESA-N -1 3 294.301 2.925 20 10 CFCDHM CCn1nccc1CN[C@H](C)c1cc(F)cc(F)c1[O-] ZINC000853239105 634948578 /nfs/dbraw/zinc/94/85/78/634948578.db2.gz ACGKXLFIBGKJJC-SECBINFHSA-N -1 3 281.306 2.738 20 10 CFCDHM O=C(c1cccc(O)c1[O-])N1CCC[C@H](c2ccccn2)C1 ZINC000854643432 635354985 /nfs/dbraw/zinc/35/49/85/635354985.db2.gz XQIAGCLZOCSJGE-LBPRGKRZSA-N -1 3 298.342 2.513 20 10 CFCDHM [O-]c1cccc(Br)c1CN1CCOCC12CC2 ZINC000862358075 637331474 /nfs/dbraw/zinc/33/14/74/637331474.db2.gz SMVVUMSPMKKROB-UHFFFAOYSA-N -1 3 298.180 2.520 20 10 CFCDHM CCOC[C@H]1CN(Cc2cc(Cl)c(C)cc2[O-])CCO1 ZINC000862502279 637405603 /nfs/dbraw/zinc/40/56/03/637405603.db2.gz HSTXUJZBNDPFCI-CYBMUJFWSA-N -1 3 299.798 2.591 20 10 CFCDHM O=C(NC[C@H]1CCc2ccccc21)c1cccc(O)c1[O-] ZINC000193062584 650620042 /nfs/dbraw/zinc/62/00/42/650620042.db2.gz CSJRTVSTFNRGHI-GFCCVEGCSA-N -1 3 283.327 2.558 20 10 CFCDHM Cc1c(NC(=O)c2cccc(O)c2[O-])cccc1N(C)C ZINC000193153164 650628442 /nfs/dbraw/zinc/62/84/42/650628442.db2.gz VCODFHPITPQBDK-UHFFFAOYSA-N -1 3 286.331 2.725 20 10 CFCDHM Cc1ccc(F)cc1NC(=O)c1cccc(O)c1[O-] ZINC000126226387 643055866 /nfs/dbraw/zinc/05/58/66/643055866.db2.gz OHDATRTWLGAWDL-UHFFFAOYSA-N -1 3 261.252 2.798 20 10 CFCDHM C[C@@H]1CCCC[C@H]1CNC(=O)c1cccc(O)c1[O-] ZINC000126346547 643153371 /nfs/dbraw/zinc/15/33/71/643153371.db2.gz VKBPLVAFCNIYFO-MNOVXSKESA-N -1 3 263.337 2.654 20 10 CFCDHM CC[C@H](C)C[C@@H](C)NC(=O)c1cccc(O)c1[O-] ZINC000126457225 643232045 /nfs/dbraw/zinc/23/20/45/643232045.db2.gz LRWSELMQAHPTBV-VHSXEESVSA-N -1 3 251.326 2.652 20 10 CFCDHM Cc1nocc1CNCc1cc(Cl)cc(F)c1[O-] ZINC000877563444 643362818 /nfs/dbraw/zinc/36/28/18/643362818.db2.gz NBPGUJJVNGJZCF-UHFFFAOYSA-N -1 3 270.691 2.771 20 10 CFCDHM Cn1ncc(C2CC2)c1CNCc1ccc(F)c(F)c1[O-] ZINC000877630787 643415333 /nfs/dbraw/zinc/41/53/33/643415333.db2.gz MQSDNNYZMXLPTL-UHFFFAOYSA-N -1 3 293.317 2.571 20 10 CFCDHM O=C(NCC[C@H]1CCCC1(F)F)c1cccc(O)c1[O-] ZINC000881582172 645056440 /nfs/dbraw/zinc/05/64/40/645056440.db2.gz CSXJKFNSXSCMBQ-SECBINFHSA-N -1 3 285.290 2.653 20 10 CFCDHM CCn1nccc1CN[C@@H](C)c1c([O-])cccc1F ZINC000886639845 647082740 /nfs/dbraw/zinc/08/27/40/647082740.db2.gz MSBNVEPXCVNBEU-JTQLQIEISA-N -1 3 263.316 2.599 20 10 CFCDHM C[C@@H](NCc1cc(C2CC2)nn1C)c1c([O-])cccc1F ZINC000927101058 648712229 /nfs/dbraw/zinc/71/22/29/648712229.db2.gz POBDSOPHMLCQFM-SNVBAGLBSA-N -1 3 289.354 2.993 20 10 CFCDHM O=C(NCc1c([O-])cccc1F)[C@@H]1C[C@H]1C1CCCC1 ZINC000928705349 648944577 /nfs/dbraw/zinc/94/45/77/648944577.db2.gz HINNLNRJQIKYCV-NWDGAFQWSA-N -1 3 277.339 2.974 20 10 CFCDHM O=C(Cc1ccc2c(c1)CCC2)NCc1c([O-])cccc1F ZINC000928710221 648946027 /nfs/dbraw/zinc/94/60/27/648946027.db2.gz QICDOTQSAMAIMN-UHFFFAOYSA-N -1 3 299.345 2.879 20 10 CFCDHM Cc1noc(C)c1[C@@H](C)C(=O)NCc1c([O-])cccc1F ZINC000928712350 648946696 /nfs/dbraw/zinc/94/66/96/648946696.db2.gz RYCTZBYSNLPKLA-MRVPVSSYSA-N -1 3 292.310 2.556 20 10 CFCDHM Cc1noc(C(C)C)c1NC(=O)c1cccc(O)c1[O-] ZINC000928787353 648954529 /nfs/dbraw/zinc/95/45/29/648954529.db2.gz KUOQDPKLARVYFJ-UHFFFAOYSA-N -1 3 276.292 2.770 20 10 CFCDHM CSC1CCN(Cc2c([O-])cc(F)cc2F)CC1 ZINC001140583421 770963119 /nfs/dbraw/zinc/96/31/19/770963119.db2.gz FXXIPIZZTDVZPS-UHFFFAOYSA-N -1 3 273.348 2.998 20 10 CFCDHM C[C@H]1CC[N@H+](Cc2ccc(C(=O)[O-])cc2[O-])CCC1(F)F ZINC001231447015 777221477 /nfs/dbraw/zinc/22/14/77/777221477.db2.gz NJPWYNILQDKCGO-JTQLQIEISA-N -1 3 299.317 2.958 20 10 CFCDHM C[C@H]1CC[N@@H+](Cc2ccc(C(=O)[O-])cc2[O-])CCC1(F)F ZINC001231447015 777221484 /nfs/dbraw/zinc/22/14/84/777221484.db2.gz NJPWYNILQDKCGO-JTQLQIEISA-N -1 3 299.317 2.958 20 10 CFCDHM O=C([O-])c1ccc([O-])c(C[N@@H+]2CCC[C@H]3CCC[C@H]32)c1 ZINC001231565007 777262094 /nfs/dbraw/zinc/26/20/94/777262094.db2.gz MYRXNBYJEWJFBN-BXUZGUMPSA-N -1 3 275.348 2.855 20 10 CFCDHM O=C([O-])c1ccc([O-])c(C[N@H+]2CCC[C@H]3CCC[C@H]32)c1 ZINC001231565007 777262100 /nfs/dbraw/zinc/26/21/00/777262100.db2.gz MYRXNBYJEWJFBN-BXUZGUMPSA-N -1 3 275.348 2.855 20 10 CFCDHM Cc1cc([O-])c(CN2C[C@@H](F)[C@@H](F)C2)cc1Cl ZINC001231867000 777357925 /nfs/dbraw/zinc/35/79/25/777357925.db2.gz GFMNNLHENNWIGR-PHIMTYICSA-N -1 3 261.699 2.846 20 10 CFCDHM Cc1cc([O-])c(CN2Cc3cncnc3C2)cc1Cl ZINC001231868998 777358623 /nfs/dbraw/zinc/35/86/23/777358623.db2.gz LJHUWORFWJOQCY-UHFFFAOYSA-N -1 3 275.739 2.660 20 10 CFCDHM Cc1cc([O-])c(CN2CCC[C@H](F)C(=O)C2)cc1Cl ZINC001231868973 777358718 /nfs/dbraw/zinc/35/87/18/777358718.db2.gz JPHWZYYMJQDKAK-LBPRGKRZSA-N -1 3 285.746 2.857 20 10 CFCDHM CCOC(=O)[C@@H]1CCCN1Cc1cc(Cl)c(C)cc1[O-] ZINC001231870783 777359627 /nfs/dbraw/zinc/35/96/27/777359627.db2.gz SVUKHAAQXIQXAN-ZDUSSCGKSA-N -1 3 297.782 2.882 20 10 CFCDHM Cc1cc([O-])c(CN2CCc3ncn(C)c3C2)cc1Cl ZINC001231871423 777359729 /nfs/dbraw/zinc/35/97/29/777359729.db2.gz KNODSXGXSWTBJA-UHFFFAOYSA-N -1 3 291.782 2.646 20 10 CFCDHM O=C1CCN(Cc2ccc3ccccc3c2[O-])CC1 ZINC001231879203 777362611 /nfs/dbraw/zinc/36/26/11/777362611.db2.gz ABOBLRZGNVSQSN-UHFFFAOYSA-N -1 3 255.317 2.710 20 10 CFCDHM O=C1CCN(Cc2ccc3ccccc3c2[O-])C[C@@H]1F ZINC001231880296 777362983 /nfs/dbraw/zinc/36/29/83/777362983.db2.gz BIAZRGWBPVSNPK-AWEZNQCLSA-N -1 3 273.307 2.658 20 10 CFCDHM [O-]c1c(CN2CC(O)(C(F)(F)F)C2)ccc2ccccc12 ZINC001231879588 777363489 /nfs/dbraw/zinc/36/34/89/777363489.db2.gz JEXCOSCESWEGTA-UHFFFAOYSA-N -1 3 297.276 2.654 20 10 CFCDHM CCN1C[C@@H](C)N(Cc2ccc3ccccc3c2[O-])CC1=O ZINC001231883582 777364549 /nfs/dbraw/zinc/36/45/49/777364549.db2.gz QTSRTXCMQPDRCU-CYBMUJFWSA-N -1 3 298.386 2.598 20 10 CFCDHM [O-]c1c(CN(CCO)CC(F)(F)F)ccc2ccccc12 ZINC001231882390 777365359 /nfs/dbraw/zinc/36/53/59/777365359.db2.gz JSDIDPZXSHNJKI-UHFFFAOYSA-N -1 3 299.292 2.902 20 10 CFCDHM [O-]c1ccc(F)c(F)c1CN1CC[C@]2(CC2(F)F)C1 ZINC001233335016 777893229 /nfs/dbraw/zinc/89/32/29/777893229.db2.gz DMFRCTGTYNPWLQ-LBPRGKRZSA-N -1 3 275.245 2.902 20 10 CFCDHM CN(Cc1cncnc1)Cc1cccc(C(F)(F)F)c1[O-] ZINC001233419687 777946289 /nfs/dbraw/zinc/94/62/89/777946289.db2.gz ISCDDIYOKUNLPU-UHFFFAOYSA-N -1 3 297.280 2.833 20 10 CFCDHM [O-]c1cc(F)c(F)cc1CN1CC2(C1)C[C@@H](F)CS2 ZINC001142527265 778401926 /nfs/dbraw/zinc/40/19/26/778401926.db2.gz QTPLRBODIGXPEK-SECBINFHSA-N -1 3 289.322 2.700 20 10 CFCDHM [O-]c1c(Br)cc(F)cc1CN1C[C@@H]2C[C@@H]2C1 ZINC001235294630 778446839 /nfs/dbraw/zinc/44/68/39/778446839.db2.gz PKKKJSYRZQGLKT-OCAPTIKFSA-N -1 3 286.144 2.746 20 10 CFCDHM CCN(Cc1cc(Cl)c(Cl)cc1[O-])C1CN(C)C1 ZINC001236802117 778945433 /nfs/dbraw/zinc/94/54/33/778945433.db2.gz FPJBEECCVCINOU-UHFFFAOYSA-N -1 3 289.206 2.835 20 10 CFCDHM [O-]c1ccc(Cl)c(Cl)c1CN1CC[C@H](F)[C@@H](O)C1 ZINC001237078850 779002870 /nfs/dbraw/zinc/00/28/70/779002870.db2.gz YNZNHPVSZZCFFJ-ONGXEEELSA-N -1 3 294.153 2.604 20 10 CFCDHM COC[C@H]1CCN1Cc1c([O-])ccc(Cl)c1Cl ZINC001237085890 779009523 /nfs/dbraw/zinc/00/95/23/779009523.db2.gz KMFWNWNJXDTEJE-MRVPVSSYSA-N -1 3 276.163 2.920 20 10 CFCDHM [O-]c1ccc(Cl)cc1CN1CCO[C@@H](C(F)(F)F)C1 ZINC000698953924 779110704 /nfs/dbraw/zinc/11/07/04/779110704.db2.gz RIPMSROUGNKXNJ-LLVKDONJSA-N -1 3 295.688 2.809 20 10 CFCDHM COC[C@@H]1CCCN1Cc1cc(Cl)cc(F)c1[O-] ZINC001237616853 779144207 /nfs/dbraw/zinc/14/42/07/779144207.db2.gz ILCCWFRZUFAVGU-NSHDSACASA-N -1 3 273.735 2.796 20 10 CFCDHM Cc1cc([O-])c(CN2CCCC(=O)C2)cc1Br ZINC001237677771 779159953 /nfs/dbraw/zinc/15/99/53/779159953.db2.gz DIXKUFIBXBAGRZ-UHFFFAOYSA-N -1 3 298.180 2.628 20 10 CFCDHM [O-]c1c(Cl)cc(F)cc1CN1CCC[C@]2(CCO2)C1 ZINC001237800106 779181746 /nfs/dbraw/zinc/18/17/46/779181746.db2.gz XEPZBWGYVDFLDX-AWEZNQCLSA-N -1 3 285.746 2.940 20 10 CFCDHM [O-]c1cc(Cl)c(F)cc1CN1CC2(C1)CCOCC2 ZINC001237936027 779211982 /nfs/dbraw/zinc/21/19/82/779211982.db2.gz IHILSKCSSHQOPL-UHFFFAOYSA-N -1 3 285.746 2.797 20 10 CFCDHM CCO[C@H]1CCCN(Cc2ccc(F)c(F)c2[O-])C1 ZINC000703541169 781027106 /nfs/dbraw/zinc/02/71/06/781027106.db2.gz LJLCMOKBJMKRBP-NSHDSACASA-N -1 3 271.307 2.671 20 10 CFCDHM CO[C@@H]1CN(Cc2cc(F)cc(F)c2[O-])CC[C@H]1C ZINC000708413663 781273085 /nfs/dbraw/zinc/27/30/85/781273085.db2.gz MPSIQCXZRNABBI-NOZJJQNGSA-N -1 3 271.307 2.527 20 10 CFCDHM COC[C@H]1CCCCN1Cc1cc(F)cc(F)c1[O-] ZINC000708414788 781273505 /nfs/dbraw/zinc/27/35/05/781273505.db2.gz SPCYTRKUJWBVTI-GFCCVEGCSA-N -1 3 271.307 2.671 20 10 CFCDHM CO[C@H]1CC[C@@H](C)N(Cc2cc(F)cc(F)c2[O-])C1 ZINC000708414223 781274055 /nfs/dbraw/zinc/27/40/55/781274055.db2.gz PKUOOBTWVOFSDV-SKDRFNHKSA-N -1 3 271.307 2.670 20 10 CFCDHM [O-]c1ccccc1CN(Cc1ccno1)C[C@H]1CCCO1 ZINC000070976515 346918818 /nfs/dbraw/zinc/91/88/18/346918818.db2.gz IWKDNMQRULOGIS-CQSZACIVSA-N -1 3 288.347 2.561 20 10 CFCDHM CCCN(Cc1ccccc1[O-])[C@@H](CC)C(=O)OC ZINC000174375225 283297106 /nfs/dbraw/zinc/29/71/06/283297106.db2.gz SYYOTUFCSFSAKD-ZDUSSCGKSA-N -1 3 265.353 2.556 20 10 CFCDHM [O-]c1ccccc1CN(C[C@@H]1CCCO1)CC(F)(F)F ZINC000111232976 375833246 /nfs/dbraw/zinc/83/32/46/375833246.db2.gz VURGRPPGLOKDAU-LBPRGKRZSA-N -1 3 289.297 2.936 20 10 CFCDHM CC(=O)c1cc(Cl)cc(CN2CCC[C@](C)(O)C2)c1[O-] ZINC000125040571 377113050 /nfs/dbraw/zinc/11/30/50/377113050.db2.gz DKNMCNXOOVSJDK-HNNXBMFYSA-N -1 3 297.782 2.595 20 10 CFCDHM CC(C)CN(CC(C)C)C(=O)c1cccc(O)c1[O-] ZINC000126278660 377220115 /nfs/dbraw/zinc/22/01/15/377220115.db2.gz QKGPLUQAOZZSDS-UHFFFAOYSA-N -1 3 265.353 2.852 20 10 CFCDHM CC1CCC(N(C)C(=O)c2cccc(O)c2[O-])CC1 ZINC000126287688 377221186 /nfs/dbraw/zinc/22/11/86/377221186.db2.gz CCMNCFVRIMHJEL-UHFFFAOYSA-N -1 3 263.337 2.749 20 10 CFCDHM CCC(CC)CN(CC)C(=O)c1cccc(O)c1[O-] ZINC000126288182 377222163 /nfs/dbraw/zinc/22/21/63/377222163.db2.gz HBRIQKOHDBGFDB-UHFFFAOYSA-N -1 3 265.353 2.996 20 10 CFCDHM Cc1ccc(C[C@@H](C)NC(=O)c2cccc(O)c2[O-])s1 ZINC000126439990 377228647 /nfs/dbraw/zinc/22/86/47/377228647.db2.gz JBFIWYKWYIYFGT-SECBINFHSA-N -1 3 291.372 2.829 20 10 CFCDHM C[C@@H]1CN(Cc2c([O-])cccc2Cl)C[C@H](C)O1 ZINC000126961321 377256970 /nfs/dbraw/zinc/25/69/70/377256970.db2.gz JJYRVOIYLLAEJA-AOOOYVTPSA-N -1 3 255.745 2.655 20 10 CFCDHM CC[C@@H]1CN(Cc2c([O-])cccc2Cl)CCO1 ZINC000132011415 377792481 /nfs/dbraw/zinc/79/24/81/377792481.db2.gz ABIAKNKENFOWIQ-SNVBAGLBSA-N -1 3 255.745 2.656 20 10 CFCDHM CC[C@]1(C)CN(Cc2cc(F)cc(C(C)=O)c2[O-])CCO1 ZINC000135736737 378161206 /nfs/dbraw/zinc/16/12/06/378161206.db2.gz LBHPJTNBRPVUPN-MRXNPFEDSA-N -1 3 295.354 2.735 20 10 CFCDHM CO[C@H]1CCCN(Cc2cc(Cl)cc(C(C)=O)c2[O-])C1 ZINC000177112970 380305345 /nfs/dbraw/zinc/30/53/45/380305345.db2.gz WOSLJXXLNDFUNL-ZDUSSCGKSA-N -1 3 297.782 2.859 20 10 CFCDHM Cc1ccc(C(=O)N(C)[C@@H](C)c2ccccn2)c([O-])c1O ZINC000177676949 380365595 /nfs/dbraw/zinc/36/55/95/380365595.db2.gz RWVOOYBFSJEOAS-NSHDSACASA-N -1 3 286.331 2.634 20 10 CFCDHM [O-]c1ccccc1CN1CCO[C@H](c2ccco2)C1 ZINC000179583853 380560916 /nfs/dbraw/zinc/56/09/16/380560916.db2.gz OTIPIWQSAFCXGN-HNNXBMFYSA-N -1 3 259.305 2.559 20 10 CFCDHM Cc1ccc([C@H]2CN(Cc3ccccc3[O-])CCO2)o1 ZINC000179584297 380561536 /nfs/dbraw/zinc/56/15/36/380561536.db2.gz AELZJUOHVIAMNA-MRXNPFEDSA-N -1 3 273.332 2.867 20 10 CFCDHM C[C@@H](O)C1CCN(Cc2cc(Cl)c(F)cc2[O-])CC1 ZINC000295515189 380909081 /nfs/dbraw/zinc/90/90/81/380909081.db2.gz ZMQHOVXRGXETKA-SECBINFHSA-N -1 3 287.762 2.778 20 10 CFCDHM CC[C@H](N[C@@H](C)c1nncn1C)c1cccc(Cl)c1[O-] ZINC000287789030 380940496 /nfs/dbraw/zinc/94/04/96/380940496.db2.gz SRHFQZKOFHDSEQ-CABZTGNLSA-N -1 3 294.786 2.976 20 10 CFCDHM Cc1cnc([C@H](C)NC(=O)c2ccc(C)c(O)c2[O-])s1 ZINC000182566142 381113424 /nfs/dbraw/zinc/11/34/24/381113424.db2.gz JVLMEJMOPMTTRW-VIFPVBQESA-N -1 3 292.360 2.662 20 10 CFCDHM Cc1ccc(C(=O)NC[C@H]2CCCCC2(F)F)c([O-])c1O ZINC000296154330 381277870 /nfs/dbraw/zinc/27/78/70/381277870.db2.gz SIGYMLYWBGOQNZ-SNVBAGLBSA-N -1 3 299.317 2.962 20 10 CFCDHM COCc1nc(CN[C@@H]2CCc3cccc([O-])c32)cs1 ZINC000297217580 381552736 /nfs/dbraw/zinc/55/27/36/381552736.db2.gz HBHXNFQZSZOFHH-GFCCVEGCSA-N -1 3 290.388 2.772 20 10 CFCDHM [O-]c1c(F)cccc1CN1CC[C@H](O)c2ccccc2C1 ZINC000371875985 381715979 /nfs/dbraw/zinc/71/59/79/381715979.db2.gz IJRRZIFMIBCVCT-INIZCTEOSA-N -1 3 287.334 2.971 20 10 CFCDHM [O-]c1ccccc1CN1CCOc2cccc(F)c2C1 ZINC000375009488 382063802 /nfs/dbraw/zinc/06/38/02/382063802.db2.gz WUVPJCYDODETLZ-UHFFFAOYSA-N -1 3 273.307 2.926 20 10 CFCDHM Cc1cc(Cl)cc(CN2C[C@H]3CC[C@@H](C2)O3)c1[O-] ZINC000375011262 382065926 /nfs/dbraw/zinc/06/59/26/382065926.db2.gz FCRVDTSYCRVWSL-BETUJISGSA-N -1 3 267.756 2.717 20 10 CFCDHM C[C@H]1CN(C(=O)c2cccc(O)c2[O-])[C@@H]1c1ccccc1 ZINC000187148264 382110251 /nfs/dbraw/zinc/11/02/51/382110251.db2.gz YUOHVNFKBPRYSY-NHYWBVRUSA-N -1 3 283.327 2.931 20 10 CFCDHM CS[C@@H]1CCC[C@H](NC(=O)c2cccc(O)c2[O-])C1 ZINC000187106109 382099902 /nfs/dbraw/zinc/09/99/02/382099902.db2.gz XOLRGMVGRUVXNQ-VHSXEESVSA-N -1 3 281.377 2.502 20 10 CFCDHM COC[C@@H]1CN(Cc2cc(Cl)cc(C)c2[O-])C[C@@H](C)O1 ZINC000188336221 382394763 /nfs/dbraw/zinc/39/47/63/382394763.db2.gz BTSCVWSLJMDDQJ-RISCZKNCSA-N -1 3 299.798 2.590 20 10 CFCDHM COC[C@@]1(C)CCN(Cc2cc(F)cc(C(C)=O)c2[O-])C1 ZINC000294130010 382427637 /nfs/dbraw/zinc/42/76/37/382427637.db2.gz FJWCZDKVSUQNEV-INIZCTEOSA-N -1 3 295.354 2.592 20 10 CFCDHM [O-]c1ccccc1CN1CC(O)(c2ccc(Cl)cc2)C1 ZINC000365659170 382430644 /nfs/dbraw/zinc/43/06/44/382430644.db2.gz ARNMVHAHBQESPA-UHFFFAOYSA-N -1 3 289.762 2.749 20 10 CFCDHM C[C@@H]1CC[C@@]2(CCN(C(=O)c3cccc(O)c3[O-])C2)C1 ZINC000365554547 382412101 /nfs/dbraw/zinc/41/21/01/382412101.db2.gz DQQNZKWAQSZGMH-BDJLRTHQSA-N -1 3 275.348 2.750 20 10 CFCDHM O=C(c1cccc(O)c1[O-])N1CC=C(c2ccc(F)cc2)C1 ZINC000365553362 382412621 /nfs/dbraw/zinc/41/26/21/382412621.db2.gz HHUPGFMBXWPIJG-UHFFFAOYSA-N -1 3 299.301 2.776 20 10 CFCDHM [O-]c1c(Cl)cccc1C[N@@H+]1CCC[C@@H](c2nnc[n-]2)C1 ZINC000378446065 382462360 /nfs/dbraw/zinc/46/23/60/382462360.db2.gz XUULDRGZLPFFAO-LLVKDONJSA-N -1 3 292.770 2.543 20 10 CFCDHM [O-]c1c(Cl)cccc1C[N@H+]1CCC[C@@H](c2nnc[n-]2)C1 ZINC000378446065 382462366 /nfs/dbraw/zinc/46/23/66/382462366.db2.gz XUULDRGZLPFFAO-LLVKDONJSA-N -1 3 292.770 2.543 20 10 CFCDHM [O-]c1ccc(F)cc1CNc1cnc2c(c1)COCC2 ZINC000378491250 382473236 /nfs/dbraw/zinc/47/32/36/382473236.db2.gz GHXSXZCBAVGNMK-UHFFFAOYSA-N -1 3 274.295 2.611 20 10 CFCDHM CNC(=O)CN(Cc1ccccc1[O-])[C@H](C)c1ccccc1 ZINC000268339643 384608170 /nfs/dbraw/zinc/60/81/70/384608170.db2.gz VDTISHNUDSEOJG-CQSZACIVSA-N -1 3 298.386 2.701 20 10 CFCDHM [O-]c1cccc(Cl)c1CN1CCN(C2CCC2)CC1 ZINC000271190439 385369482 /nfs/dbraw/zinc/36/94/82/385369482.db2.gz PKLZEKLPMDERMT-UHFFFAOYSA-N -1 3 280.799 2.716 20 10 CFCDHM CCC1(O)CCN(Cc2c([O-])cccc2Cl)CC1 ZINC000271196808 385371792 /nfs/dbraw/zinc/37/17/92/385371792.db2.gz OEKBUGXGVZBHNA-UHFFFAOYSA-N -1 3 269.772 2.783 20 10 CFCDHM CCOCCO[C@H]1CCN(Cc2c([O-])cccc2Cl)C1 ZINC000271390963 385381764 /nfs/dbraw/zinc/38/17/64/385381764.db2.gz TYUXMWVVZAKDSW-LBPRGKRZSA-N -1 3 299.798 2.673 20 10 CFCDHM C[C@@H](N[C@H](C)c1cc(Cl)ccc1[O-])c1nncn1C ZINC000273606784 385691277 /nfs/dbraw/zinc/69/12/77/385691277.db2.gz UJWYQKDAAULBEA-RKDXNWHRSA-N -1 3 280.759 2.586 20 10 CFCDHM CC1(CO)CCN(Cc2cccc(Cl)c2[O-])CC1 ZINC000184073301 393523862 /nfs/dbraw/zinc/52/38/62/393523862.db2.gz UDRQOAHYWQEJGL-UHFFFAOYSA-N -1 3 269.772 2.640 20 10 CFCDHM CC[C@@H]1CC[C@@H](C)N1C(=O)c1ccc(C)c(O)c1[O-] ZINC000272963751 287100274 /nfs/dbraw/zinc/10/02/74/287100274.db2.gz JWTHXWKGGCADOE-GHMZBOCLSA-N -1 3 263.337 2.809 20 10 CFCDHM C[C@@H](NCc1ccccc1[O-])c1nnc2n1CCCCC2 ZINC000037140677 260069283 /nfs/dbraw/zinc/06/92/83/260069283.db2.gz HCWGVICJGDQPTB-GFCCVEGCSA-N -1 3 286.379 2.561 20 10 CFCDHM [O-]c1ccc(Cl)cc1CN1CCC[C@@H]1c1ncon1 ZINC000371380954 267397073 /nfs/dbraw/zinc/39/70/73/267397073.db2.gz BZTMTNGFJKARRM-LLVKDONJSA-N -1 3 279.727 2.766 20 10 CFCDHM CC[C@H](NCC(=O)N(C)CC)c1cccc(Cl)c1[O-] ZINC000287604896 288035669 /nfs/dbraw/zinc/03/56/69/288035669.db2.gz ITOVKGQJJCASCA-LBPRGKRZSA-N -1 3 284.787 2.565 20 10 CFCDHM CC[C@H]1CC[C@H](C)N1C(=O)c1ccc(C)c(O)c1[O-] ZINC000272963757 288244559 /nfs/dbraw/zinc/24/45/59/288244559.db2.gz JWTHXWKGGCADOE-QWRGUYRKSA-N -1 3 263.337 2.809 20 10 CFCDHM O=C(c1cccc(O)c1[O-])N1CCC[C@H]2CCCC[C@@H]21 ZINC000126269303 304549456 /nfs/dbraw/zinc/54/94/56/304549456.db2.gz QGDHUQFGVXWHQZ-YPMHNXCESA-N -1 3 275.348 2.893 20 10 CFCDHM Cc1ccc(C(=O)N2CCCC(C)(C)C2)c([O-])c1O ZINC000182435409 301497584 /nfs/dbraw/zinc/49/75/84/301497584.db2.gz WQEFDJSBWRLGND-UHFFFAOYSA-N -1 3 263.337 2.668 20 10 CFCDHM Cc1ccc(C(=O)N2C[C@@H](C)CC[C@@H]2C)c([O-])c1O ZINC000182534465 301518509 /nfs/dbraw/zinc/51/85/09/301518509.db2.gz JPBCNPMGPSSAIL-ONGXEEELSA-N -1 3 263.337 2.667 20 10 CFCDHM CCc1nc(C)c(CNCc2cccc(F)c2[O-])o1 ZINC000292720440 328467469 /nfs/dbraw/zinc/46/74/69/328467469.db2.gz FHGPRGUIIFNOGI-UHFFFAOYSA-N -1 3 264.300 2.680 20 10 CFCDHM CN(C(=O)/C=C\c1cncc([O-])c1)c1ccc2cc[nH]c2c1 ZINC000492015076 332379386 /nfs/dbraw/zinc/37/93/86/332379386.db2.gz CPBTVKBELKESLI-DJWKRKHSSA-N -1 3 293.326 2.945 20 10 CFCDHM CCO[C@@]1(C)C[C@H]1NCc1cc(Cl)cc(F)c1[O-] ZINC000529652734 333504061 /nfs/dbraw/zinc/50/40/61/333504061.db2.gz OAJOKCPNFMNCPM-YPMHNXCESA-N -1 3 273.735 2.842 20 10 CFCDHM CCOCCOCCN(C)Cc1cccc(Cl)c1[O-] ZINC000191571268 519993633 /nfs/dbraw/zinc/99/36/33/519993633.db2.gz CDTLXTOWWIGRTR-UHFFFAOYSA-N -1 3 287.787 2.531 20 10 CFCDHM CC(=O)c1cc(F)cc(CN2C[C@@H](C)OC(C)(C)C2)c1[O-] ZINC000045699069 518286747 /nfs/dbraw/zinc/28/67/47/518286747.db2.gz QREROGBBWHUGHO-SNVBAGLBSA-N -1 3 295.354 2.733 20 10 CFCDHM CC(=O)c1cc(F)cc(CN2C[C@@H](C)[C@@H]2C)c1[O-] ZINC000293369256 518286951 /nfs/dbraw/zinc/28/69/51/518286951.db2.gz JBHWCPOFBNGCJC-BDAKNGLRSA-N -1 3 251.301 2.574 20 10 CFCDHM CC[C@@H](C(=O)OC(C)(C)C)N(C)Cc1ccccc1[O-] ZINC000192102751 521886270 /nfs/dbraw/zinc/88/62/70/521886270.db2.gz HYFABRQRMKLLDE-ZDUSSCGKSA-N -1 3 279.380 2.944 20 10 CFCDHM COC(=O)c1ccc([O-])c([C@@H](C)NCc2occc2C)c1 ZINC000293306491 522135240 /nfs/dbraw/zinc/13/52/40/522135240.db2.gz DWSTZAKCKZBGNJ-LLVKDONJSA-N -1 3 289.331 2.931 20 10 CFCDHM COc1cc(CCO)ccc1NCc1cccc(F)c1[O-] ZINC000289913808 522339229 /nfs/dbraw/zinc/33/92/29/522339229.db2.gz YCHRIDJKDFXJCM-UHFFFAOYSA-N -1 3 291.322 2.687 20 10 CFCDHM CCc1nnc(CN[C@@H](C)c2ccccc2[O-])s1 ZINC000273237073 522743495 /nfs/dbraw/zinc/74/34/95/522743495.db2.gz WWLNHQIRXNTAOW-VIFPVBQESA-N -1 3 263.366 2.657 20 10 CFCDHM CC[C@H](N[C@H](C)c1ncn(C)n1)c1ccc(C)cc1[O-] ZINC000280158773 522745131 /nfs/dbraw/zinc/74/51/31/522745131.db2.gz QOBVCJWNTDGOQZ-YPMHNXCESA-N -1 3 274.368 2.631 20 10 CFCDHM CC[C@@H]1CO[C@H](C)CN1Cc1cc(F)cc(C(C)=O)c1[O-] ZINC000048915888 523518444 /nfs/dbraw/zinc/51/84/44/523518444.db2.gz BIZSORJUNPTMOU-QMTHXVAHSA-N -1 3 295.354 2.733 20 10 CFCDHM CO[C@@H]1CCN(Cc2cc(F)cc(C(C)=O)c2[O-])[C@@H](C)C1 ZINC000281667367 523684646 /nfs/dbraw/zinc/68/46/46/523684646.db2.gz LGLHGDPSIDKNOM-IINYFYTJSA-N -1 3 295.354 2.733 20 10 CFCDHM C[C@H]1C[C@H](c2cccnc2)N(C(=O)c2cccc(O)c2[O-])C1 ZINC000193162360 524943896 /nfs/dbraw/zinc/94/38/96/524943896.db2.gz MVRIXIFCHUFARA-SMDDNHRTSA-N -1 3 298.342 2.716 20 10 CFCDHM C[C@@H]1CN(Cc2cc(F)ccc2[O-])C[C@H](C2CC2)O1 ZINC000280105678 524987834 /nfs/dbraw/zinc/98/78/34/524987834.db2.gz AZOLCVUHYHSWTH-MEBBXXQBSA-N -1 3 265.328 2.531 20 10 CFCDHM C[C@@H]1CN(Cc2cccc(F)c2[O-])C[C@@H](C2CC2)O1 ZINC000280603030 525003880 /nfs/dbraw/zinc/00/38/80/525003880.db2.gz OEEKQAUJONEOHK-YGRLFVJLSA-N -1 3 265.328 2.531 20 10 CFCDHM C[C@H](NC[C@](C)(O)C(F)(F)F)c1ccc(F)c(F)c1[O-] ZINC000276925926 525423359 /nfs/dbraw/zinc/42/33/59/525423359.db2.gz NHYNQYFSFZTMAU-KGFZYKRKSA-N -1 3 299.239 2.634 20 10 CFCDHM [O-]c1c(Cl)cccc1CN1CCCSCC1 ZINC000272859160 526327175 /nfs/dbraw/zinc/32/71/75/526327175.db2.gz UMFWGAYKUQFXNS-UHFFFAOYSA-N -1 3 257.786 2.985 20 10 CFCDHM [O-]c1c(F)cccc1CN1CCN(C2CCCC2)CC1 ZINC000166373786 526329475 /nfs/dbraw/zinc/32/94/75/526329475.db2.gz VEKGTCJQIMZHHK-UHFFFAOYSA-N -1 3 278.371 2.592 20 10 CFCDHM [O-]c1c(F)cccc1CN1CCO[C@@H]2CCCC[C@@H]21 ZINC000160222402 526329852 /nfs/dbraw/zinc/32/98/52/526329852.db2.gz JTAKNAGFTQEZMZ-UONOGXRCSA-N -1 3 265.328 2.675 20 10 CFCDHM O=C(c1cccc(O)c1[O-])N1CC[C@H](CC(F)(F)F)C1 ZINC000277610622 526770920 /nfs/dbraw/zinc/77/09/20/526770920.db2.gz PVXTVCXFFPVFOE-MRVPVSSYSA-N -1 3 289.253 2.512 20 10 CFCDHM COc1cccc([O-])c1CNCc1cn2cccc(C)c2n1 ZINC000736642389 574063905 /nfs/dbraw/zinc/06/39/05/574063905.db2.gz WTBKFWPHJGAIEF-UHFFFAOYSA-N -1 3 297.358 2.647 20 10 CFCDHM O=C(c1cc([O-])cs1)N1CCc2ccccc2C1 ZINC000731861788 574130825 /nfs/dbraw/zinc/13/08/25/574130825.db2.gz NZPUQVQRAREUDL-UHFFFAOYSA-N -1 3 259.330 2.652 20 10 CFCDHM CC(=O)Nc1ccc(NC(=O)c2cc([O-])cs2)cc1 ZINC000731861484 574130903 /nfs/dbraw/zinc/13/09/03/574130903.db2.gz CQAKEFNSCINLMH-UHFFFAOYSA-N -1 3 276.317 2.664 20 10 CFCDHM CC(=O)N(C)c1ccc(NC(=O)c2cc([O-])cs2)cc1 ZINC000731871403 574131488 /nfs/dbraw/zinc/13/14/88/574131488.db2.gz JSNZOYIGULLTAM-UHFFFAOYSA-N -1 3 290.344 2.689 20 10 CFCDHM CC(C)Oc1ncccc1CNC(=O)c1cc([O-])cs1 ZINC000731872262 574131854 /nfs/dbraw/zinc/13/18/54/574131854.db2.gz ZMARIYVMILZVER-UHFFFAOYSA-N -1 3 292.360 2.566 20 10 CFCDHM Cc1ccc(NC(=O)COC(=O)c2cc([O-])cs2)cc1 ZINC000731909598 574133330 /nfs/dbraw/zinc/13/33/30/574133330.db2.gz FJEGKISOOOABAL-UHFFFAOYSA-N -1 3 291.328 2.558 20 10 CFCDHM O=C(NCc1ccc(F)cc1F)c1cc([O-])cs1 ZINC000732268300 574148174 /nfs/dbraw/zinc/14/81/74/574148174.db2.gz GWWGMKSTKWWSFG-UHFFFAOYSA-N -1 3 269.272 2.662 20 10 CFCDHM CC(=O)Nc1ccc(NC(=O)c2cc([O-])cs2)cc1C ZINC000732267949 574148221 /nfs/dbraw/zinc/14/82/21/574148221.db2.gz CUDQHQIKNQYCJF-UHFFFAOYSA-N -1 3 290.344 2.973 20 10 CFCDHM O=C(Nc1nccn1Cc1ccccc1)c1cc([O-])cs1 ZINC000732273964 574148732 /nfs/dbraw/zinc/14/87/32/574148732.db2.gz MHTLSTGNKVCGMN-UHFFFAOYSA-N -1 3 299.355 2.951 20 10 CFCDHM O=C(Nc1ccccc1-n1ccnc1)c1cc([O-])cs1 ZINC000732270411 574148861 /nfs/dbraw/zinc/14/88/61/574148861.db2.gz BHVOIRBARDMEHC-UHFFFAOYSA-N -1 3 285.328 2.892 20 10 CFCDHM Cc1cc([C@H]2CCCN2C(=O)c2cc([O-])cs2)no1 ZINC000732268949 574148892 /nfs/dbraw/zinc/14/88/92/574148892.db2.gz UHGAIZMPYLTLRH-LLVKDONJSA-N -1 3 278.333 2.727 20 10 CFCDHM O=C(c1cc([O-])cs1)N1CC[C@@H](c2ccco2)C1 ZINC000732291684 574150645 /nfs/dbraw/zinc/15/06/45/574150645.db2.gz KVEVPCSCAZIDAG-SECBINFHSA-N -1 3 263.318 2.676 20 10 CFCDHM O=C(COC(=O)c1cc([O-])cs1)c1cccc(F)c1 ZINC000732352673 574152560 /nfs/dbraw/zinc/15/25/60/574152560.db2.gz BFKSBMFKWUQUJM-UHFFFAOYSA-N -1 3 280.276 2.633 20 10 CFCDHM O=C(COC(=O)c1cc([O-])cs1)C1CCCCC1 ZINC000732352793 574152730 /nfs/dbraw/zinc/15/27/30/574152730.db2.gz HCRPFUQAHTUKPV-UHFFFAOYSA-N -1 3 268.334 2.760 20 10 CFCDHM C[C@H](NC(=O)c1cc([O-])cs1)[C@H]1COc2ccccc21 ZINC000755308399 574153582 /nfs/dbraw/zinc/15/35/82/574153582.db2.gz YRCJFNJKQXSPJU-JOYOIKCWSA-N -1 3 289.356 2.748 20 10 CFCDHM CCN1C(=O)/C(=C/c2ccc([O-])c(F)c2)SC1=S ZINC000755402248 574160116 /nfs/dbraw/zinc/16/01/16/574160116.db2.gz JEBXTHLTBMHPFB-POHAHGRESA-N -1 3 283.349 2.752 20 10 CFCDHM O=C(NCCc1cc(F)ccc1F)c1cc([O-])cs1 ZINC000746893171 574170332 /nfs/dbraw/zinc/17/03/32/574170332.db2.gz AOISRECVMDUUNP-UHFFFAOYSA-N -1 3 283.299 2.704 20 10 CFCDHM [O-]c1ccc(Cl)cc1CNCc1cccc(F)n1 ZINC000747934502 574221078 /nfs/dbraw/zinc/22/10/78/574221078.db2.gz FLISKFYCMADXTD-UHFFFAOYSA-N -1 3 266.703 2.870 20 10 CFCDHM C[C@@H](NCc1ccco1)c1cc([N+](=O)[O-])ccc1[O-] ZINC000756343428 574227318 /nfs/dbraw/zinc/22/73/18/574227318.db2.gz NTMWIFBVGDEOFC-SECBINFHSA-N -1 3 262.265 2.744 20 10 CFCDHM COc1ccc(CN[C@@H](CNC(=O)[O-])CC(C)C)cc1C ZINC000739903921 574228056 /nfs/dbraw/zinc/22/80/56/574228056.db2.gz RYNZCCWJTBQROZ-CQSZACIVSA-N -1 3 294.395 2.776 20 10 CFCDHM COC(=O)c1ccc([O-])c([C@@H](C)NCc2ccoc2C)c1 ZINC000756483397 574240650 /nfs/dbraw/zinc/24/06/50/574240650.db2.gz QCUDZXGPPHECPD-SNVBAGLBSA-N -1 3 289.331 2.931 20 10 CFCDHM C[C@H](NCc1cscn1)c1cc(F)cc(F)c1[O-] ZINC000756507816 574242194 /nfs/dbraw/zinc/24/21/94/574242194.db2.gz FWOOWACNLCEOMO-ZETCQYMHSA-N -1 3 270.304 2.978 20 10 CFCDHM C[C@H](NCc1cccc(O)c1)c1cc([N+](=O)[O-])ccc1[O-] ZINC000756516086 574243357 /nfs/dbraw/zinc/24/33/57/574243357.db2.gz PDGUEZGMTMXCSX-JTQLQIEISA-N -1 3 288.303 2.857 20 10 CFCDHM C[C@@H](NCc1cc[nH]n1)c1cc(Cl)ccc1[O-] ZINC000756558042 574247648 /nfs/dbraw/zinc/24/76/48/574247648.db2.gz ZAPQUZVVPMGREN-MRVPVSSYSA-N -1 3 251.717 2.620 20 10 CFCDHM C[C@H](NCc1ccon1)c1cc(Br)ccc1[O-] ZINC000756636534 574253956 /nfs/dbraw/zinc/25/39/56/574253956.db2.gz KETOGVFHLOKCEJ-QMMMGPOBSA-N -1 3 297.152 2.994 20 10 CFCDHM C[C@H](NC[C@@](C)(O)C(F)(F)F)c1cc(F)cc(F)c1[O-] ZINC000756782475 574262373 /nfs/dbraw/zinc/26/23/73/574262373.db2.gz BMYGWGTZUJBANC-UPONEAKYSA-N -1 3 299.239 2.634 20 10 CFCDHM CC(C)CSCCNC(=O)c1cc([O-])cs1 ZINC000756810830 574264713 /nfs/dbraw/zinc/26/47/13/574264713.db2.gz QJFKBYMICQWXIA-UHFFFAOYSA-N -1 3 259.396 2.573 20 10 CFCDHM CCc1ccc([C@H](COC)NC(=O)c2cc([O-])cs2)o1 ZINC000743597412 574369171 /nfs/dbraw/zinc/36/91/71/574369171.db2.gz CRWBCSDLGWRDFL-NSHDSACASA-N -1 3 295.360 2.727 20 10 CFCDHM O=C(Nc1ncn(C2CCCCC2)n1)c1cc([O-])cs1 ZINC000753503293 574403371 /nfs/dbraw/zinc/40/33/71/574403371.db2.gz NCGAUGCSUQKIOA-UHFFFAOYSA-N -1 3 292.364 2.803 20 10 CFCDHM C[C@@H](CN(C)C(=O)c1cc([O-])cs1)c1nccs1 ZINC000753521843 574403864 /nfs/dbraw/zinc/40/38/64/574403864.db2.gz AYKDEJNLEPGJSU-QMMMGPOBSA-N -1 3 282.390 2.786 20 10 CFCDHM C[N@H+](Cc1cc(F)ccc1[O-])[C@H](C(=O)[O-])c1ccccc1 ZINC000833694099 605482636 /nfs/dbraw/zinc/48/26/36/605482636.db2.gz KDRCNDLWKPKGHF-HNNXBMFYSA-N -1 3 289.306 2.789 20 10 CFCDHM C[N@@H+](Cc1cc(F)ccc1[O-])[C@H](C(=O)[O-])c1ccccc1 ZINC000833694099 605482640 /nfs/dbraw/zinc/48/26/40/605482640.db2.gz KDRCNDLWKPKGHF-HNNXBMFYSA-N -1 3 289.306 2.789 20 10 CFCDHM COCCN(Cc1ccco1)Cc1cc(F)cc(F)c1[O-] ZINC000893953521 618251532 /nfs/dbraw/zinc/25/15/32/618251532.db2.gz HQPHZUGXRALNTG-UHFFFAOYSA-N -1 3 297.301 2.912 20 10 CFCDHM [O-]c1c(F)cc(F)cc1CN1CC(CC2CC2)C1 ZINC000895376760 618555645 /nfs/dbraw/zinc/55/56/45/618555645.db2.gz JOLMILIOKSRTNG-UHFFFAOYSA-N -1 3 253.292 2.902 20 10 CFCDHM [O-]c1cc(Br)ccc1CN1CC[C@@H]1C(F)F ZINC000895430841 618578786 /nfs/dbraw/zinc/57/87/86/618578786.db2.gz IOZREVVPQRRFNB-SECBINFHSA-N -1 3 292.123 2.994 20 10 CFCDHM [O-]c1cccc(Br)c1CN1CC[C@@H]1C(F)F ZINC000895431848 618579139 /nfs/dbraw/zinc/57/91/39/618579139.db2.gz QTXSXOMDTHBWLZ-SECBINFHSA-N -1 3 292.123 2.994 20 10 CFCDHM C[C@@H]1[C@@H](CO)CCCN1Cc1c([O-])ccc(Cl)c1F ZINC000840978050 619207234 /nfs/dbraw/zinc/20/72/34/619207234.db2.gz KZMURXFESCAXBV-NXEZZACHSA-N -1 3 287.762 2.778 20 10 CFCDHM [O-]c1c(F)cc(F)cc1CN1CCC[C@H](OC(F)F)C1 ZINC000894434356 619384382 /nfs/dbraw/zinc/38/43/82/619384382.db2.gz RFYUZWWRLZSXJM-JTQLQIEISA-N -1 3 293.260 2.874 20 10 CFCDHM Cc1cc([O-])c(CN[C@@H](CCO)C(F)(F)F)cc1Cl ZINC000894849952 619483137 /nfs/dbraw/zinc/48/31/37/619483137.db2.gz GIUNAUDPEWYKJN-NSHDSACASA-N -1 3 297.704 2.757 20 10 CFCDHM CCc1nc(C)cc(NCc2c([O-])cccc2F)n1 ZINC000895832674 619619515 /nfs/dbraw/zinc/61/95/15/619619515.db2.gz LOXZAUMDERQEIN-UHFFFAOYSA-N -1 3 261.300 2.804 20 10 CFCDHM [O-]c1cccc(F)c1CNc1cc(NC2CC2)ncn1 ZINC000895832820 619619524 /nfs/dbraw/zinc/61/95/24/619619524.db2.gz NFFDNSDQHJJXKK-UHFFFAOYSA-N -1 3 274.299 2.508 20 10 CFCDHM CCc1nsc(NCc2c([O-])cccc2F)n1 ZINC000895833503 619619671 /nfs/dbraw/zinc/61/96/71/619619671.db2.gz YJTPCYOPUCTMGT-UHFFFAOYSA-N -1 3 253.302 2.557 20 10 CFCDHM [O-]c1c(F)cc(F)cc1CN1CCC(O)(C2CCC2)CC1 ZINC000897033945 619916879 /nfs/dbraw/zinc/91/68/79/619916879.db2.gz FTCMQBTUBUNYQJ-UHFFFAOYSA-N -1 3 297.345 2.797 20 10 CFCDHM C[C@H]1CC[C@H](CC(=O)NCc2c([O-])cccc2F)C1 ZINC000928706788 619996066 /nfs/dbraw/zinc/99/60/66/619996066.db2.gz ZZXDUUFTIDRGGH-QWRGUYRKSA-N -1 3 265.328 2.974 20 10 CFCDHM O=C(NCc1c([O-])cccc1F)c1coc(C2CCC2)n1 ZINC000928707581 619996241 /nfs/dbraw/zinc/99/62/41/619996241.db2.gz FTOQCWSWBQDWDD-UHFFFAOYSA-N -1 3 290.294 2.717 20 10 CFCDHM O=C(NCc1c([O-])cccc1F)c1ccnc(C2CC2)c1 ZINC000928708573 619996305 /nfs/dbraw/zinc/99/63/05/619996305.db2.gz PPAUBPQFYOSSKD-UHFFFAOYSA-N -1 3 286.306 2.734 20 10 CFCDHM O=C(C[C@@H]1CCC2(CCC2)O1)NCc1c([O-])cccc1F ZINC000928711876 619997183 /nfs/dbraw/zinc/99/71/83/619997183.db2.gz VIVLBUHKRUWATC-NSHDSACASA-N -1 3 293.338 2.639 20 10 CFCDHM Nc1ccc2c(c1)CN(Cc1cccc(F)c1[O-])CCO2 ZINC000903945734 621483449 /nfs/dbraw/zinc/48/34/49/621483449.db2.gz XRCSKJDXSQFJRR-UHFFFAOYSA-N -1 3 288.322 2.508 20 10 CFCDHM [O-]c1cccc(Cl)c1CN1CCO[C@@H](C(F)F)C1 ZINC000802652950 622200913 /nfs/dbraw/zinc/20/09/13/622200913.db2.gz HWVVHRICDDKKNL-LLVKDONJSA-N -1 3 277.698 2.512 20 10 CFCDHM CCc1ncc(CNCc2cccc(Cl)c2[O-])o1 ZINC000825079004 623622922 /nfs/dbraw/zinc/62/29/22/623622922.db2.gz JLETYYSBTVWRRN-UHFFFAOYSA-N -1 3 266.728 2.886 20 10 CFCDHM CC[C@@H](C)[C@H](C)NC(=O)NCc1c([O-])cccc1F ZINC000914366237 623774003 /nfs/dbraw/zinc/77/40/03/623774003.db2.gz MCJNIHWNKJKZPG-ZJUUUORDSA-N -1 3 268.332 2.765 20 10 CFCDHM Cc1cc([O-])c(CN(CC(F)F)C[C@@H](C)O)cc1Cl ZINC000826089242 623792633 /nfs/dbraw/zinc/79/26/33/623792633.db2.gz BNTWGABOMCRZJZ-SECBINFHSA-N -1 3 293.741 2.802 20 10 CFCDHM [O-]c1ccc(Cl)cc1CNCc1cn(C2CCC2)nn1 ZINC000826139965 623797872 /nfs/dbraw/zinc/79/78/72/623797872.db2.gz TYNJJRGRFPYJFR-UHFFFAOYSA-N -1 3 292.770 2.652 20 10 CFCDHM Cc1cc([O-])c(CN2CCc3nccnc3C2)c(Cl)c1 ZINC000827686923 624064306 /nfs/dbraw/zinc/06/43/06/624064306.db2.gz HICRWOYUYUDUOQ-UHFFFAOYSA-N -1 3 289.766 2.702 20 10 CFCDHM C[C@H](NCc1cc(Cl)c(F)cc1[O-])c1nccn1C ZINC000827722188 624075742 /nfs/dbraw/zinc/07/57/42/624075742.db2.gz BXLTYYIDRMCCNI-QMMMGPOBSA-N -1 3 283.734 2.769 20 10 CFCDHM [O-]c1ccc(Cl)cc1CNCc1cscn1 ZINC000082367489 625722103 /nfs/dbraw/zinc/72/21/03/625722103.db2.gz OHBRHLZMTVIUEC-UHFFFAOYSA-N -1 3 254.742 2.792 20 10 CFCDHM CC[C@H](C)CCNC(=O)NCc1c([O-])cccc1F ZINC000923235700 626458837 /nfs/dbraw/zinc/45/88/37/626458837.db2.gz VTMSLZSCPHCNGF-JTQLQIEISA-N -1 3 268.332 2.767 20 10 CFCDHM [O-]c1c(CN2CC(OC(F)F)C2)ccc2ccccc21 ZINC000839144887 626526124 /nfs/dbraw/zinc/52/61/24/626526124.db2.gz PNMIITQUJNRXKQ-UHFFFAOYSA-N -1 3 279.286 2.969 20 10 CFCDHM Cc1c(NCc2c([O-])cccc2Cl)cnn1C ZINC000774822220 627967720 /nfs/dbraw/zinc/96/77/20/627967720.db2.gz BZYKFPMCRDUVNM-UHFFFAOYSA-N -1 3 251.717 2.700 20 10 CFCDHM C[C@H]1COCCN(Cc2cc(Cl)cc(F)c2[O-])C1 ZINC000775705761 628056690 /nfs/dbraw/zinc/05/66/90/628056690.db2.gz LBWLEUOWGVVTCR-SECBINFHSA-N -1 3 273.735 2.653 20 10 CFCDHM COC(=O)[C@@H]1C[C@@H](C)CCN1Cc1cc(Cl)ccc1[O-] ZINC000776003099 628093472 /nfs/dbraw/zinc/09/34/72/628093472.db2.gz WRTGBWKATGPFDZ-GWCFXTLKSA-N -1 3 297.782 2.819 20 10 CFCDHM O=C(Nc1ccc(-n2ccnc2)cc1)c1cccc(O)c1[O-] ZINC000776327611 628132476 /nfs/dbraw/zinc/13/24/76/628132476.db2.gz LKJQSZMUILPIJJ-UHFFFAOYSA-N -1 3 295.298 2.536 20 10 CFCDHM C[C@H]1CN(Cc2cc(F)ccc2[O-])C[C@H](C(F)(F)F)O1 ZINC000779023625 628345788 /nfs/dbraw/zinc/34/57/88/628345788.db2.gz UZLXKKHHALORAQ-QPUJVOFHSA-N -1 3 293.260 2.683 20 10 CFCDHM CSc1ccc(NC(=O)c2ccc(C)c(O)c2[O-])nc1 ZINC000780945299 628507090 /nfs/dbraw/zinc/50/70/90/628507090.db2.gz VHLKUQMGOZHWOH-UHFFFAOYSA-N -1 3 290.344 2.775 20 10 CFCDHM Cc1ccc(CC[C@@H](C)NC(=O)c2cccc(O)c2[O-])o1 ZINC000790793902 629263031 /nfs/dbraw/zinc/26/30/31/629263031.db2.gz UCILPIRZBREWMO-SNVBAGLBSA-N -1 3 289.331 2.750 20 10 CFCDHM C[C@@H]1[C@@H](C)N(Cc2c([O-])ccc(Cl)c2F)CCN1C ZINC000792173772 629406106 /nfs/dbraw/zinc/40/61/06/629406106.db2.gz CDLHPZMERNMUFA-NXEZZACHSA-N -1 3 286.778 2.709 20 10 CFCDHM Cc1cc(Br)c([O-])c(CN2CC(C)C2)c1 ZINC000802651412 630534894 /nfs/dbraw/zinc/53/48/94/630534894.db2.gz ORBHSZFZWNVEPJ-UHFFFAOYSA-N -1 3 270.170 2.915 20 10 CFCDHM [O-]c1ccc(Cl)cc1CN1CCO[C@H](C(F)F)C1 ZINC000802653676 630536170 /nfs/dbraw/zinc/53/61/70/630536170.db2.gz QBPLPAOJSQRUBK-NSHDSACASA-N -1 3 277.698 2.512 20 10 CFCDHM Cc1noc([C@H]2CCCN2Cc2cc(F)ccc2[O-])n1 ZINC000809720905 631272012 /nfs/dbraw/zinc/27/20/12/631272012.db2.gz JOLMTVNUGPNUKL-GFCCVEGCSA-N -1 3 277.299 2.560 20 10 CFCDHM Cc1cc([O-])c(CNCc2noc(C3CC3)n2)c(Cl)c1 ZINC000840941181 631272290 /nfs/dbraw/zinc/27/22/90/631272290.db2.gz PWQDSKMNVWBUTG-UHFFFAOYSA-N -1 3 293.754 2.904 20 10 CFCDHM COc1ccc(CN[C@@H](C(=O)[O-])c2ccsc2)cc1C ZINC000841798207 631472802 /nfs/dbraw/zinc/47/28/02/631472802.db2.gz DYMIPOORUGDJHK-CQSZACIVSA-N -1 3 291.372 2.981 20 10 CFCDHM C[C@@H]1CN(Cc2cc(Cl)c(F)cc2[O-])CCCO1 ZINC000816502962 632472400 /nfs/dbraw/zinc/47/24/00/632472400.db2.gz XGRWBLKWAFJSJX-SECBINFHSA-N -1 3 273.735 2.796 20 10 CFCDHM [O-]c1cc(F)c(Cl)cc1CN1CCC2(CCO2)CC1 ZINC000816600195 632492912 /nfs/dbraw/zinc/49/29/12/632492912.db2.gz ONFCJXNCYOSVTE-UHFFFAOYSA-N -1 3 285.746 2.940 20 10 CFCDHM CCOc1ccc(C[NH2+]C[C@H](CC(C)C)C(=O)[O-])c([O-])c1 ZINC000818630652 632884685 /nfs/dbraw/zinc/88/46/85/632884685.db2.gz VVAMWMSHOVYUSV-ZDUSSCGKSA-N -1 3 295.379 2.627 20 10 CFCDHM CCCCN1CC(=O)N[C@H]1c1cc(Cl)c(C)cc1[O-] ZINC000849183296 633580276 /nfs/dbraw/zinc/58/02/76/633580276.db2.gz RBZCNZMUJIWJCW-CQSZACIVSA-N -1 3 282.771 2.585 20 10 CFCDHM CC[C@@H](NCc1cn(CC)nn1)c1cccc(Cl)c1[O-] ZINC000850522077 634030378 /nfs/dbraw/zinc/03/03/78/634030378.db2.gz AUUHYGSBNQZRJR-CYBMUJFWSA-N -1 3 294.786 2.898 20 10 CFCDHM Cc1cc(Cl)cc(C[NH2+]C[C@@H](C(=O)[O-])C2CCC2)c1[O-] ZINC000854245896 635271399 /nfs/dbraw/zinc/27/13/99/635271399.db2.gz GEOVNOGXSDRZOA-CYBMUJFWSA-N -1 3 297.782 2.945 20 10 CFCDHM O=C(c1cccc(O)c1[O-])N1CCC(c2ccco2)CC1 ZINC000855292266 635503280 /nfs/dbraw/zinc/50/32/80/635503280.db2.gz XQOWIYOIRRKEAD-UHFFFAOYSA-N -1 3 287.315 2.711 20 10 CFCDHM Cc1cc([N-]S(=O)(=O)c2ccc(C)c(F)c2)ccc1O ZINC000158860001 650239422 /nfs/dbraw/zinc/23/94/22/650239422.db2.gz AWOGMBKIODBTSE-UHFFFAOYSA-N -1 3 295.335 2.949 20 10 CFCDHM Cc1cccc2c1CCN2C(=O)c1cccc(O)c1[O-] ZINC000188315084 650322876 /nfs/dbraw/zinc/32/28/76/650322876.db2.gz ASPCYRCTOKUGEB-UHFFFAOYSA-N -1 3 269.300 2.609 20 10 CFCDHM COC[C@]1(C)CN(Cc2c([O-])cc(C)cc2Cl)CCO1 ZINC000862552085 637423835 /nfs/dbraw/zinc/42/38/35/637423835.db2.gz SPNMRGQWJBNZKB-HNNXBMFYSA-N -1 3 299.798 2.591 20 10 CFCDHM C[C@@H](NCc1c([O-])ccc(Cl)c1F)c1ccnn1C ZINC000865839460 638605333 /nfs/dbraw/zinc/60/53/33/638605333.db2.gz XFFOZGYPTQQDCQ-MRVPVSSYSA-N -1 3 283.734 2.769 20 10 CFCDHM C[C@H]1c2ccccc2CCN1C(=O)c1cccc(O)c1[O-] ZINC000193127170 650625584 /nfs/dbraw/zinc/62/55/84/650625584.db2.gz MQOPOMPIHPGXAU-NSHDSACASA-N -1 3 283.327 2.857 20 10 CFCDHM COc1ccc(S(=O)(=O)[N-]c2ccc(O)cc2)c(C)c1 ZINC000194107624 650718000 /nfs/dbraw/zinc/71/80/00/650718000.db2.gz DCBFELDFQNJKSB-UHFFFAOYSA-N -1 3 293.344 2.510 20 10 CFCDHM O=C(NCc1ccc2ncccc2c1)c1cccc(O)c1[O-] ZINC000194910259 650733595 /nfs/dbraw/zinc/73/35/95/650733595.db2.gz DNNXDCVRXBGNPI-UHFFFAOYSA-N -1 3 294.310 2.576 20 10 CFCDHM C[C@@H]1CN(Cc2ccc(F)c(F)c2[O-])C[C@@H](C)S1 ZINC000876642941 642955602 /nfs/dbraw/zinc/95/56/02/642955602.db2.gz PPTOXYRKJYEDSG-RKDXNWHRSA-N -1 3 273.348 2.996 20 10 CFCDHM CCN(Cc1cccs1)C(=O)c1cccc(O)c1[O-] ZINC000126287924 643107512 /nfs/dbraw/zinc/10/75/12/643107512.db2.gz KJHRCTRGXZKYRS-UHFFFAOYSA-N -1 3 277.345 2.822 20 10 CFCDHM O=C(N[C@H]1CCCc2sccc21)c1cccc(O)c1[O-] ZINC000126390068 643190604 /nfs/dbraw/zinc/19/06/04/643190604.db2.gz PHMXCJAZPYKDFO-NSHDSACASA-N -1 3 289.356 2.967 20 10 CFCDHM CC[C@H]1CCC[C@@H](NC(=O)c2cccc(O)c2[O-])C1 ZINC000126450211 643227247 /nfs/dbraw/zinc/22/72/47/643227247.db2.gz IRVSCBMWORHWJV-WDEREUQCSA-N -1 3 263.337 2.796 20 10 CFCDHM C[C@H](CNC(=O)c1cccc(O)c1[O-])c1ccccc1 ZINC000126540213 643290806 /nfs/dbraw/zinc/29/08/06/643290806.db2.gz ZPXLNFVQRGAZGK-LLVKDONJSA-N -1 3 271.316 2.631 20 10 CFCDHM CCCN(CC(=O)OCC)Cc1cc(Cl)ccc1[O-] ZINC000092380422 650919214 /nfs/dbraw/zinc/91/92/14/650919214.db2.gz HRRKIRSBRVNPGK-UHFFFAOYSA-N -1 3 285.771 2.821 20 10 CFCDHM C[C@@H]1C[C@@H](NCc2cc(F)cc(F)c2[O-])c2nccn21 ZINC000883135900 645621088 /nfs/dbraw/zinc/62/10/88/645621088.db2.gz PLJSQQOMDXILIR-PRHODGIISA-N -1 3 279.290 2.663 20 10 CFCDHM CCn1cc([C@@H](C)NCc2cc(F)cc(F)c2[O-])cn1 ZINC000883137456 645621528 /nfs/dbraw/zinc/62/15/28/645621528.db2.gz FTWTYFPYNLPAFV-SECBINFHSA-N -1 3 281.306 2.738 20 10 CFCDHM C[C@H](NCc1cccnc1N(C)C)c1c([O-])cccc1F ZINC000886502952 647022530 /nfs/dbraw/zinc/02/25/30/647022530.db2.gz VPFQISONLSOOFO-NSHDSACASA-N -1 3 289.354 2.843 20 10 CFCDHM C[C@@H](NCc1cscn1)c1c([O-])cccc1F ZINC000886518781 647025867 /nfs/dbraw/zinc/02/58/67/647025867.db2.gz GGFGVXZOFHZDOU-MRVPVSSYSA-N -1 3 252.314 2.839 20 10 CFCDHM C[C@@H](N[C@@H](CO)c1ccsc1)c1c([O-])cccc1F ZINC000886591723 647057785 /nfs/dbraw/zinc/05/77/85/647057785.db2.gz AEKKSRPHNZQWMQ-SKDRFNHKSA-N -1 3 281.352 2.977 20 10 CFCDHM C[C@H]1CCC[C@H](C(=O)NCc2c([O-])cccc2F)C1 ZINC000928705200 648944159 /nfs/dbraw/zinc/94/41/59/648944159.db2.gz HFCLIAAQGYQBTH-QWRGUYRKSA-N -1 3 265.328 2.974 20 10 CFCDHM O=C(NCc1c([O-])cccc1F)[C@@H]1CCCCCC(=O)C1 ZINC000928706360 648944985 /nfs/dbraw/zinc/94/49/85/648944985.db2.gz RCDAUBWVCYVNCO-LLVKDONJSA-N -1 3 293.338 2.687 20 10 CFCDHM O=C(NCc1c([O-])cccc1F)[C@@H]1[C@@H]2Cc3ccccc3[C@@H]21 ZINC000928712825 648946606 /nfs/dbraw/zinc/94/66/06/648946606.db2.gz VNURNSOPUCJGQA-OAUYIBNBSA-N -1 3 297.329 2.733 20 10 CFCDHM COc1cc([O-])c(CN2CC(C)C2)cc1Br ZINC001233134670 777804810 /nfs/dbraw/zinc/80/48/10/777804810.db2.gz AZKKQNPFIZWGAB-UHFFFAOYSA-N -1 3 286.169 2.615 20 10 CFCDHM CCCCCCNC(=O)NCc1c([O-])cccc1F ZINC001211051085 770422952 /nfs/dbraw/zinc/42/29/52/770422952.db2.gz WITQTLBLTNHKBU-UHFFFAOYSA-N -1 3 268.332 2.911 20 10 CFCDHM CC(=O)c1cc(Cl)cc(CN2CCC[C@@]2(C)CO)c1[O-] ZINC000723022343 770447261 /nfs/dbraw/zinc/44/72/61/770447261.db2.gz IOFGMOOQYHIYBW-HNNXBMFYSA-N -1 3 297.782 2.595 20 10 CFCDHM O=C([O-])c1ccc(C[NH+]2CC(c3ccccc3)C2)c([O-])c1 ZINC001231455907 777222815 /nfs/dbraw/zinc/22/28/15/777222815.db2.gz XIZBOANUUAGNRY-UHFFFAOYSA-N -1 3 283.327 2.690 20 10 CFCDHM O=C([O-])c1ccc(C[N@@H+]2CCC23CCCC3)c([O-])c1 ZINC001231450612 777223024 /nfs/dbraw/zinc/22/30/24/777223024.db2.gz TYRVJEFRINISJH-UHFFFAOYSA-N -1 3 261.321 2.609 20 10 CFCDHM O=C([O-])c1ccc(C[N@H+]2CCC23CCCC3)c([O-])c1 ZINC001231450612 777223030 /nfs/dbraw/zinc/22/30/30/777223030.db2.gz TYRVJEFRINISJH-UHFFFAOYSA-N -1 3 261.321 2.609 20 10 CFCDHM Cc1ccc2c(c1)CC[N@@H+](Cc1ccc(C(=O)[O-])cc1[O-])C2 ZINC001231454508 777224116 /nfs/dbraw/zinc/22/41/16/777224116.db2.gz ZDBPLJNFPIBOOR-UHFFFAOYSA-N -1 3 297.354 2.957 20 10 CFCDHM Cc1ccc2c(c1)CC[N@H+](Cc1ccc(C(=O)[O-])cc1[O-])C2 ZINC001231454508 777224119 /nfs/dbraw/zinc/22/41/19/777224119.db2.gz ZDBPLJNFPIBOOR-UHFFFAOYSA-N -1 3 297.354 2.957 20 10 CFCDHM O=C([O-])c1ccc(C[N@@H+]2CCC[C@@H]2c2ccccn2)c([O-])c1 ZINC001231452658 777224663 /nfs/dbraw/zinc/22/46/63/777224663.db2.gz QRHVIKFKDMQNTN-OAHLLOKOSA-N -1 3 298.342 2.823 20 10 CFCDHM O=C([O-])c1ccc(C[N@H+]2CCC[C@@H]2c2ccccn2)c([O-])c1 ZINC001231452658 777224670 /nfs/dbraw/zinc/22/46/70/777224670.db2.gz QRHVIKFKDMQNTN-OAHLLOKOSA-N -1 3 298.342 2.823 20 10 CFCDHM O=C([O-])c1ccc([O-])c(C[N@H+]2C[C@@H]3CCCC[C@@H]3C2)c1 ZINC001231561308 777258675 /nfs/dbraw/zinc/25/86/75/777258675.db2.gz RXDQYCXOYHODOY-BETUJISGSA-N -1 3 275.348 2.712 20 10 CFCDHM O=C([O-])c1ccc([O-])c(C[N@@H+]2C[C@@H]3CCCC[C@@H]3C2)c1 ZINC001231561308 777258677 /nfs/dbraw/zinc/25/86/77/777258677.db2.gz RXDQYCXOYHODOY-BETUJISGSA-N -1 3 275.348 2.712 20 10 CFCDHM CC(C)[C@@H]1CCC[N@@H+]1Cc1cc(C(=O)[O-])ccc1[O-] ZINC001231566266 777261531 /nfs/dbraw/zinc/26/15/31/777261531.db2.gz VTQZUZSAOUXKJR-ZDUSSCGKSA-N -1 3 263.337 2.711 20 10 CFCDHM CC(C)[C@@H]1CCC[N@H+]1Cc1cc(C(=O)[O-])ccc1[O-] ZINC001231566266 777261538 /nfs/dbraw/zinc/26/15/38/777261538.db2.gz VTQZUZSAOUXKJR-ZDUSSCGKSA-N -1 3 263.337 2.711 20 10 CFCDHM Cc1cc([O-])c(CN2CCC[C@@H](F)C(=O)C2)cc1Cl ZINC001231868972 777359442 /nfs/dbraw/zinc/35/94/42/777359442.db2.gz JPHWZYYMJQDKAK-GFCCVEGCSA-N -1 3 285.746 2.857 20 10 CFCDHM CN(Cc1ccc2ccccc2c1[O-])Cc1ncccn1 ZINC001231879534 777362591 /nfs/dbraw/zinc/36/25/91/777362591.db2.gz HINFWGGKWJPROV-UHFFFAOYSA-N -1 3 279.343 2.967 20 10 CFCDHM CC(=O)C1CCN(Cc2cccc(Cl)c2[O-])CC1 ZINC001231912695 777379929 /nfs/dbraw/zinc/37/99/29/777379929.db2.gz SMTOTDILQGJANM-UHFFFAOYSA-N -1 3 267.756 2.847 20 10 CFCDHM COc1cc([O-])c(CN2CCCCC23COC3)cc1Cl ZINC001232269757 777500979 /nfs/dbraw/zinc/50/09/79/777500979.db2.gz JVBJFEHWDIOENN-UHFFFAOYSA-N -1 3 297.782 2.809 20 10 CFCDHM CN(Cc1c([O-])cc(Br)cc1F)C1CC1 ZINC001233026628 777769463 /nfs/dbraw/zinc/76/94/63/777769463.db2.gz ANQNFKSLVNQJAV-UHFFFAOYSA-N -1 3 274.133 2.888 20 10 CFCDHM CC(C)O[C@H]1CCN(Cc2c([O-])ccc(F)c2F)C1 ZINC001233335779 777897934 /nfs/dbraw/zinc/89/79/34/777897934.db2.gz LCVJHHDGOFPFON-JTQLQIEISA-N -1 3 271.307 2.670 20 10 CFCDHM [O-]c1c(CN2CC[C@]23CCOC3)cccc1C(F)(F)F ZINC001233418953 777942881 /nfs/dbraw/zinc/94/28/81/777942881.db2.gz CZHLSTRDCGBPSF-CYBMUJFWSA-N -1 3 287.281 2.776 20 10 CFCDHM C[C@@H]1COCCN1Cc1ccc(C(F)(F)F)cc1[O-] ZINC001233451973 777957720 /nfs/dbraw/zinc/95/77/20/777957720.db2.gz GRZZFPOAMOJGQX-SECBINFHSA-N -1 3 275.270 2.632 20 10 CFCDHM O=C1CCN(Cc2ccc(C(F)(F)F)cc2[O-])CC1 ZINC001233452093 777958239 /nfs/dbraw/zinc/95/82/39/777958239.db2.gz KOBREVNXWVMBSI-UHFFFAOYSA-N -1 3 273.254 2.576 20 10 CFCDHM O=C(NCc1c([O-])cccc1F)C1C[C@H]2CC[C@@H](C1)S2 ZINC000928709805 777964383 /nfs/dbraw/zinc/96/43/83/777964383.db2.gz FZITXAKHPUMYJD-FGWVZKOKSA-N -1 3 295.379 2.822 20 10 CFCDHM COc1ccc2ccc([O-])c(CN3CCCO3)c2c1 ZINC001234519186 778241976 /nfs/dbraw/zinc/24/19/76/778241976.db2.gz RVZREAXAGHQERF-UHFFFAOYSA-N -1 3 259.305 2.691 20 10 CFCDHM [O-]c1cccc(Br)c1CN1C[C@@H](F)[C@H](F)C1 ZINC000714559264 778293191 /nfs/dbraw/zinc/29/31/91/778293191.db2.gz SZXZDBUBJCCGKP-NXEZZACHSA-N -1 3 292.123 2.647 20 10 CFCDHM O=C(N[C@H]1CCCC2(CC2)C1)c1cccc(O)c1[O-] ZINC000696165052 778856800 /nfs/dbraw/zinc/85/68/00/778856800.db2.gz VYXMCQKWYGQKMM-JTQLQIEISA-N -1 3 261.321 2.550 20 10 CFCDHM CCN1CCN(Cc2cc(Cl)c(Cl)cc2[O-])CC1 ZINC001236792540 778939628 /nfs/dbraw/zinc/93/96/28/778939628.db2.gz DWZUBMWGAIOMMA-UHFFFAOYSA-N -1 3 289.206 2.837 20 10 CFCDHM C[C@@H]1CCN(Cc2cc(Cl)c(Cl)cc2[O-])C[C@@H]1O ZINC001236792722 778939700 /nfs/dbraw/zinc/93/97/00/778939700.db2.gz HFDQZXBOIGROJT-OQPBUACISA-N -1 3 290.190 2.902 20 10 CFCDHM [O-]c1cc(Cl)c(Cl)cc1CN1CCC(O)CC1 ZINC001236794845 778940953 /nfs/dbraw/zinc/94/09/53/778940953.db2.gz VVGHTMVUVDYNJV-UHFFFAOYSA-N -1 3 276.163 2.656 20 10 CFCDHM C[C@@H]1CN(Cc2cc(Cl)c(Cl)cc2[O-])CCN1C ZINC001236798191 778941537 /nfs/dbraw/zinc/94/15/37/778941537.db2.gz HUZRDUYEPDRHRX-SECBINFHSA-N -1 3 289.206 2.835 20 10 CFCDHM COc1cc([O-])c(CN2CCC(=O)[C@H](C)CC2)c(Cl)c1 ZINC001236798427 778942505 /nfs/dbraw/zinc/94/25/05/778942505.db2.gz OEEGZQSRGGXTFZ-SNVBAGLBSA-N -1 3 297.782 2.855 20 10 CFCDHM COc1cc([O-])c(CN2CCC[C@@H](F)C2)c(Cl)c1 ZINC001236799754 778943112 /nfs/dbraw/zinc/94/31/12/778943112.db2.gz PYDIQVNNOXHXBL-SECBINFHSA-N -1 3 273.735 2.988 20 10 CFCDHM COc1ccc(CN2CCCO[C@H](C)C2)c([O-])c1Cl ZINC001236801240 778944631 /nfs/dbraw/zinc/94/46/31/778944631.db2.gz IFUKVPYXPSWOAS-SNVBAGLBSA-N -1 3 285.771 2.665 20 10 CFCDHM COc1ccc(CN2CCCO[C@@H](C)C2)c([O-])c1Cl ZINC001236801239 778944909 /nfs/dbraw/zinc/94/49/09/778944909.db2.gz IFUKVPYXPSWOAS-JTQLQIEISA-N -1 3 285.771 2.665 20 10 CFCDHM C[C@@H]1CO[C@@H]2CN(Cc3c([O-])ccc(F)c3Cl)C[C@H]12 ZINC001237127807 779021068 /nfs/dbraw/zinc/02/10/68/779021068.db2.gz FRTSYLSVAUCJMZ-JRKPZEMJSA-N -1 3 285.746 2.651 20 10 CFCDHM C[C@@H]1CCCN(Cc2cc(Cl)cc(F)c2[O-])[C@H]1CO ZINC001237618396 779145470 /nfs/dbraw/zinc/14/54/70/779145470.db2.gz ZSLDZUHZBBYQLE-RNCFNFMXSA-N -1 3 287.762 2.778 20 10 CFCDHM CC(=O)[C@@H]1CCN(Cc2cc(Cl)cc(F)c2[O-])C1 ZINC001237623759 779147388 /nfs/dbraw/zinc/14/73/88/779147388.db2.gz UXLZUZZFNDGFMA-SECBINFHSA-N -1 3 271.719 2.596 20 10 CFCDHM CO[C@@H](C)C1CN(Cc2cc(F)cc(Cl)c2[O-])C1 ZINC001237803667 779183515 /nfs/dbraw/zinc/18/35/15/779183515.db2.gz UCOZUHPQGZNWDM-QMMMGPOBSA-N -1 3 273.735 2.651 20 10 CFCDHM [O-]c1c(Cl)cc(F)cc1CN1CCN2CCCC[C@H]2C1 ZINC001237812950 779185805 /nfs/dbraw/zinc/18/58/05/779185805.db2.gz JCPDWXFVQONIGJ-ZDUSSCGKSA-N -1 3 298.789 2.855 20 10 CFCDHM Cc1ccc(CNCc2ccc(F)c(F)c2[O-])nc1C ZINC000703382590 781013100 /nfs/dbraw/zinc/01/31/00/781013100.db2.gz OBWVGLLHTWGXNS-UHFFFAOYSA-N -1 3 278.302 2.972 20 10 CFCDHM COC[C@@H]1CCCCN1Cc1ccc(F)c(F)c1[O-] ZINC000703480452 781016257 /nfs/dbraw/zinc/01/62/57/781016257.db2.gz BFWPBDVRDVTJKC-NSHDSACASA-N -1 3 271.307 2.671 20 10 CFCDHM COCCC1(C)CN(Cc2cc(Cl)cc(OC)c2[O-])C1 ZINC000297459574 200198233 /nfs/dbraw/zinc/19/82/33/200198233.db2.gz RLBYDEZHEQBIRB-UHFFFAOYSA-N -1 3 299.798 2.913 20 10 CFCDHM [O-]c1ccc(Cl)cc1CN1CCS[C@H]2COCC[C@@H]21 ZINC000091856016 375066033 /nfs/dbraw/zinc/06/60/33/375066033.db2.gz NNXOEPKSMGFGQO-JSGCOSHPSA-N -1 3 299.823 2.752 20 10 CFCDHM O=[N+]([O-])c1cc(Cl)cc(CN2CCCC2)c1[O-] ZINC000101590275 375644478 /nfs/dbraw/zinc/64/44/78/375644478.db2.gz NRCLWDHNXRUOGA-UHFFFAOYSA-N -1 3 256.689 2.550 20 10 CFCDHM C[C@H]1CN(Cc2cccc(Cl)c2[O-])CCCO1 ZINC000124588697 377067401 /nfs/dbraw/zinc/06/74/01/377067401.db2.gz FQJYMXJKAKCKKS-JTQLQIEISA-N -1 3 255.745 2.656 20 10 CFCDHM C[C@@H]1CCC[C@@H](N(C)C(=O)c2cccc(O)c2[O-])C1 ZINC000126291052 377221660 /nfs/dbraw/zinc/22/16/60/377221660.db2.gz GSJSIEAUALFBBL-GHMZBOCLSA-N -1 3 263.337 2.749 20 10 CFCDHM O=C(c1cccc(O)c1[O-])N1CC[C@@H](c2ccccc2)C1 ZINC000126376545 377223815 /nfs/dbraw/zinc/22/38/15/377223815.db2.gz KEJJLOLHEQTWGR-CYBMUJFWSA-N -1 3 283.327 2.728 20 10 CFCDHM CC(C)[C@@H]1CCCN(C(=O)c2cccc(O)c2[O-])CC1 ZINC000126435288 377228386 /nfs/dbraw/zinc/22/83/86/377228386.db2.gz YQSQPJAVNJZOIG-GFCCVEGCSA-N -1 3 277.364 2.996 20 10 CFCDHM CC1(C)CCCN(C(=O)c2cccc(O)c2[O-])CC1 ZINC000126453402 377228487 /nfs/dbraw/zinc/22/84/87/377228487.db2.gz HAOILXUAKOKUPK-UHFFFAOYSA-N -1 3 263.337 2.750 20 10 CFCDHM CCCOc1ccc(CN2C[C@@H](C)O[C@@H](C)C2)c([O-])c1 ZINC000126956999 377256714 /nfs/dbraw/zinc/25/67/14/377256714.db2.gz RKRKJYNUSCYGGW-BETUJISGSA-N -1 3 279.380 2.790 20 10 CFCDHM CN(Cc1c([O-])cccc1Cl)C[C@H]1CCCO1 ZINC000132959622 377890795 /nfs/dbraw/zinc/89/07/95/377890795.db2.gz ZFYOGIBWOQXIMA-SNVBAGLBSA-N -1 3 255.745 2.656 20 10 CFCDHM C[C@H]1CN(Cc2c([O-])cccc2Cl)CCCO1 ZINC000134153573 377987566 /nfs/dbraw/zinc/98/75/66/377987566.db2.gz LZRNORHSPAUAHI-JTQLQIEISA-N -1 3 255.745 2.656 20 10 CFCDHM Cc1ccc(C(=O)N[C@H]2CCCc3occc32)c([O-])c1O ZINC000179415837 380541986 /nfs/dbraw/zinc/54/19/86/380541986.db2.gz GAOIKLBGUIVNSB-LBPRGKRZSA-N -1 3 287.315 2.807 20 10 CFCDHM CC(C)N(CC(=O)OC(C)(C)C)Cc1ccccc1[O-] ZINC000179580825 380560982 /nfs/dbraw/zinc/56/09/82/380560982.db2.gz AGJZJGZUKGXKSV-UHFFFAOYSA-N -1 3 279.380 2.944 20 10 CFCDHM C[C@H]1c2cccn2CCN1Cc1cc(F)ccc1[O-] ZINC000179881873 380591740 /nfs/dbraw/zinc/59/17/40/380591740.db2.gz HBEPVXYQLQPSDV-NSHDSACASA-N -1 3 260.312 2.910 20 10 CFCDHM COC[C@H]1CCN(Cc2cc(Cl)c(F)cc2[O-])C1 ZINC000295464617 380871737 /nfs/dbraw/zinc/87/17/37/380871737.db2.gz WDQPHAQDYCWWGS-VIFPVBQESA-N -1 3 273.735 2.653 20 10 CFCDHM CC(C)N(Cc1cccc(Cl)c1[O-])C1COC1 ZINC000295985487 381199009 /nfs/dbraw/zinc/19/90/09/381199009.db2.gz JXKHLKCGWWPMCS-UHFFFAOYSA-N -1 3 255.745 2.655 20 10 CFCDHM Cc1ccc(C(=O)NC[C@@H]2CCCCC2(F)F)c([O-])c1O ZINC000296154326 381278602 /nfs/dbraw/zinc/27/86/02/381278602.db2.gz SIGYMLYWBGOQNZ-JTQLQIEISA-N -1 3 299.317 2.962 20 10 CFCDHM C[C@@H](N[C@@H](C)C(=O)NC(C)(C)C)c1cc(Cl)ccc1[O-] ZINC000185217822 381566639 /nfs/dbraw/zinc/56/66/39/381566639.db2.gz GJQYZEZTJJDIGY-ZJUUUORDSA-N -1 3 298.814 2.999 20 10 CFCDHM [O-]c1ccc2ccccc2c1CN1CC(n2cccn2)C1 ZINC000359972943 381704508 /nfs/dbraw/zinc/70/45/08/381704508.db2.gz HNYUHILGWHRPMD-UHFFFAOYSA-N -1 3 279.343 2.799 20 10 CFCDHM CCSCC[C@H](C)N(C)C(=O)c1cccc(O)c1[O-] ZINC000185773439 381729065 /nfs/dbraw/zinc/72/90/65/381729065.db2.gz XNZUDFYYOZQUQT-JTQLQIEISA-N -1 3 283.393 2.702 20 10 CFCDHM Cc1nc([C@@H]2CCCCN2Cc2ccccc2[O-])no1 ZINC000376168522 382123328 /nfs/dbraw/zinc/12/33/28/382123328.db2.gz XAHKGJNTYDKABQ-ZDUSSCGKSA-N -1 3 273.336 2.811 20 10 CFCDHM O=C(c1cccc(O)c1[O-])N1CCC[C@H]1Cc1ccccc1 ZINC000187213760 382129488 /nfs/dbraw/zinc/12/94/88/382129488.db2.gz BYNYTHFJYGEJOS-AWEZNQCLSA-N -1 3 297.354 2.945 20 10 CFCDHM CC1(C)CN(C(=O)c2cccc(O)c2[O-])[C@H]1c1cccnc1 ZINC000293667807 382224384 /nfs/dbraw/zinc/22/43/84/382224384.db2.gz GEUYODYTDWMSDD-HNNXBMFYSA-N -1 3 298.342 2.716 20 10 CFCDHM [O-]c1ccc(F)cc1CN1C[C@@]2(CCCO2)[C@@H]1C1CC1 ZINC000293834258 382298373 /nfs/dbraw/zinc/29/83/73/382298373.db2.gz ATOYIUZVQQTRAT-HOTGVXAUSA-N -1 3 277.339 2.675 20 10 CFCDHM CC[C@H](NC(=O)c1cccc(O)c1[O-])c1nc(C)cs1 ZINC000188425165 382411096 /nfs/dbraw/zinc/41/10/96/382411096.db2.gz PCESGLPOKUAHOR-JTQLQIEISA-N -1 3 292.360 2.744 20 10 CFCDHM C[C@@]1(c2ccccc2)CCN(C(=O)c2cccc(O)c2[O-])C1 ZINC000365928589 382458702 /nfs/dbraw/zinc/45/87/02/382458702.db2.gz FBEXSRYEHBCWKL-GOSISDBHSA-N -1 3 297.354 2.902 20 10 CFCDHM COc1ccncc1CN[C@H](C)c1ccc(F)c(F)c1[O-] ZINC000294492985 382516077 /nfs/dbraw/zinc/51/60/77/382516077.db2.gz XVWLQKWUTRKRAD-SECBINFHSA-N -1 3 294.301 2.925 20 10 CFCDHM Cc1cc(Cl)cc(CN2CCC[C@]23CCOC3=O)c1[O-] ZINC000190035451 382651071 /nfs/dbraw/zinc/65/10/71/382651071.db2.gz OEECASAYWAHRLS-OAHLLOKOSA-N -1 3 295.766 2.636 20 10 CFCDHM C[C@H]1CN2CCCC[C@H]2CN1Cc1cccc(F)c1[O-] ZINC000252780310 383434972 /nfs/dbraw/zinc/43/49/72/383434972.db2.gz SRYYGSGQIAFOEU-JSGCOSHPSA-N -1 3 278.371 2.590 20 10 CFCDHM [O-]c1ccccc1CN1CCC=C(Br)C1 ZINC000282362224 385293097 /nfs/dbraw/zinc/29/30/97/385293097.db2.gz PUZQFPSQSVRDCA-UHFFFAOYSA-N -1 3 268.154 2.877 20 10 CFCDHM CCCNC(=O)CN(CCC)Cc1cccc(Cl)c1[O-] ZINC000271693926 385389145 /nfs/dbraw/zinc/38/91/45/385389145.db2.gz AENJNGRPSBSDMR-UHFFFAOYSA-N -1 3 298.814 2.784 20 10 CFCDHM [O-]c1cccc(Cl)c1CN1CCS[C@H]2COCC[C@H]21 ZINC000271295804 385378829 /nfs/dbraw/zinc/37/88/29/385378829.db2.gz SEGGYCPYRRUKDK-OCCSQVGLSA-N -1 3 299.823 2.752 20 10 CFCDHM [O-]c1cccc(Cl)c1CN1CCS[C@H]2COCC[C@@H]21 ZINC000271295802 385378964 /nfs/dbraw/zinc/37/89/64/385378964.db2.gz SEGGYCPYRRUKDK-JSGCOSHPSA-N -1 3 299.823 2.752 20 10 CFCDHM [O-]c1cccc(Cl)c1CNc1nnc([C@@H]2CCCO2)o1 ZINC000272199371 385471484 /nfs/dbraw/zinc/47/14/84/385471484.db2.gz HFUAEEHQLMVTTJ-NSHDSACASA-N -1 3 295.726 2.892 20 10 CFCDHM CO[C@H](C)c1nc(CNCc2cc(F)ccc2[O-])cs1 ZINC000272480861 385549448 /nfs/dbraw/zinc/54/94/48/385549448.db2.gz SQHZWJBWQZLEDU-SECBINFHSA-N -1 3 296.367 2.985 20 10 CFCDHM CC[C@@H](NCc1cnn(C)c1)c1ccc(F)cc1[O-] ZINC000286102866 385560404 /nfs/dbraw/zinc/56/04/04/385560404.db2.gz NHVQWYJLXIHBBQ-CYBMUJFWSA-N -1 3 263.316 2.506 20 10 CFCDHM Cc1ncc(CN(C)Cc2cc(F)ccc2[O-])s1 ZINC000179947135 393473431 /nfs/dbraw/zinc/47/34/31/393473431.db2.gz BASGRTLVPGRBRZ-UHFFFAOYSA-N -1 3 266.341 2.928 20 10 CFCDHM O=C(/C=C/c1cncc([O-])c1)N1CCc2ccc(F)cc21 ZINC000181941137 393504081 /nfs/dbraw/zinc/50/40/81/393504081.db2.gz XUNHTTJDPWAUAF-DAFODLJHSA-N -1 3 284.290 2.529 20 10 CFCDHM CCOCCN(CC)Cc1cc(F)cc(C(C)=O)c1[O-] ZINC000107062163 393869171 /nfs/dbraw/zinc/86/91/71/393869171.db2.gz WXNZQMXEIUWOTN-UHFFFAOYSA-N -1 3 283.343 2.592 20 10 CFCDHM [O-]c1ccc(Cl)c(F)c1CN1CCC[C@@]12CCOC2 ZINC000367047808 394250308 /nfs/dbraw/zinc/25/03/08/394250308.db2.gz NDOIDCZQOQIMRT-AWEZNQCLSA-N -1 3 285.746 2.940 20 10 CFCDHM Cc1ccc(C(=O)N2CC[C@H](C)[C@H](C)C2)c([O-])c1O ZINC000182964916 292063635 /nfs/dbraw/zinc/06/36/35/292063635.db2.gz VJUOADXRHMLUPQ-GXSJLCMTSA-N -1 3 263.337 2.524 20 10 CFCDHM C[C@@H]1CCN(C(=O)c2cccc(O)c2[O-])CC1(C)C ZINC000280587878 296541814 /nfs/dbraw/zinc/54/18/14/296541814.db2.gz XHECEQRJVFQEEQ-SNVBAGLBSA-N -1 3 263.337 2.606 20 10 CFCDHM C[C@@H](NC[C@H](O)C(F)(F)F)c1cc(Cl)ccc1[O-] ZINC000273441273 287036391 /nfs/dbraw/zinc/03/63/91/287036391.db2.gz YMEXFXZYIQJDRD-LDWIPMOCSA-N -1 3 283.677 2.619 20 10 CFCDHM C[C@@H]1CCOCCN1Cc1c([O-])cccc1Cl ZINC000368131920 267146581 /nfs/dbraw/zinc/14/65/81/267146581.db2.gz OPLAGTGODJBEJW-SNVBAGLBSA-N -1 3 255.745 2.656 20 10 CFCDHM [O-]c1c(F)cccc1CN1CCN(c2ccccc2)CC1 ZINC000166372242 275060527 /nfs/dbraw/zinc/06/05/27/275060527.db2.gz QZOAVXUQYXXNPF-UHFFFAOYSA-N -1 3 286.350 2.854 20 10 CFCDHM CCCOc1ccc(CN2C[C@H]3CC[C@@H](C2)O3)c([O-])c1 ZINC000211720503 333107478 /nfs/dbraw/zinc/10/74/78/333107478.db2.gz ADRXSDYBQMXRPQ-GASCZTMLSA-N -1 3 277.364 2.544 20 10 CFCDHM CCCN(CC(C)C)C(=O)c1ccc(C)c(O)c1[O-] ZINC000272884171 521582493 /nfs/dbraw/zinc/58/24/93/521582493.db2.gz YHCKUOWLPGWLAC-UHFFFAOYSA-N -1 3 265.353 2.914 20 10 CFCDHM CC1(C)CN(Cc2cccc(Cl)c2[O-])CC[C@@H]1O ZINC000275822603 520482038 /nfs/dbraw/zinc/48/20/38/520482038.db2.gz FFSSFUJSXDFACK-LBPRGKRZSA-N -1 3 269.772 2.638 20 10 CFCDHM CCN(Cc1cc(F)cc(C(C)=O)c1[O-])C[C@@H]1CCCO1 ZINC000048965248 521293369 /nfs/dbraw/zinc/29/33/69/521293369.db2.gz IHHDCZZTONSCFM-AWEZNQCLSA-N -1 3 295.354 2.735 20 10 CFCDHM COc1cc(CN[C@@H](C)c2ccc(F)c(F)c2[O-])ccn1 ZINC000191197112 522473982 /nfs/dbraw/zinc/47/39/82/522473982.db2.gz JLBAPSFDBVKZLH-VIFPVBQESA-N -1 3 294.301 2.925 20 10 CFCDHM COCc1nc(CN[C@@H](C)c2ccc(F)cc2[O-])cs1 ZINC000289570218 523204124 /nfs/dbraw/zinc/20/41/24/523204124.db2.gz AXCJHEOLHIREQN-VIFPVBQESA-N -1 3 296.367 2.985 20 10 CFCDHM Cc1cc(Cl)cc(CN2CCn3cnnc3[C@@H]2C)c1[O-] ZINC000276854345 524864863 /nfs/dbraw/zinc/86/48/63/524864863.db2.gz VLUHNUILXZKGME-JTQLQIEISA-N -1 3 292.770 2.522 20 10 CFCDHM C[C@H](NCc1cccc(Cl)c1[O-])c1cn[nH]c1 ZINC000224935913 525455657 /nfs/dbraw/zinc/45/56/57/525455657.db2.gz XCNUKFJBRKWPAF-QMMMGPOBSA-N -1 3 251.717 2.620 20 10 CFCDHM C[C@@]1(NCc2cc(-c3ccccc3)ccc2[O-])CCOC1=O ZINC000289922148 525873429 /nfs/dbraw/zinc/87/34/29/525873429.db2.gz VMNMIRDJKMLXLN-GOSISDBHSA-N -1 3 297.354 2.854 20 10 CFCDHM [O-]c1c(Cl)cccc1CN1CC[C@H](n2cccn2)C1 ZINC000291309308 526326069 /nfs/dbraw/zinc/32/60/69/526326069.db2.gz RMUXGUSOIVJHBL-LBPRGKRZSA-N -1 3 277.755 2.689 20 10 CFCDHM [O-]c1ccc(Br)cc1CN(C1CC1)C1COC1 ZINC000295992192 526342336 /nfs/dbraw/zinc/34/23/36/526342336.db2.gz KHKBYCNNIUTCRL-UHFFFAOYSA-N -1 3 298.180 2.518 20 10 CFCDHM [O-]c1ccccc1CN1CCCC[C@@H]1c1cc[nH]n1 ZINC000289081099 526371641 /nfs/dbraw/zinc/37/16/41/526371641.db2.gz AWXLQQWBQIQBFC-CQSZACIVSA-N -1 3 257.337 2.843 20 10 CFCDHM CC(C)[N@H+](CCC(=O)[O-])Cc1cc2c(cc1[O-])CCC2 ZINC000736469073 574056935 /nfs/dbraw/zinc/05/69/35/574056935.db2.gz XUYHYJKPOJNPQN-UHFFFAOYSA-N -1 3 277.364 2.566 20 10 CFCDHM CC(C)[N@@H+](CCC(=O)[O-])Cc1cc2c(cc1[O-])CCC2 ZINC000736469073 574056936 /nfs/dbraw/zinc/05/69/36/574056936.db2.gz XUYHYJKPOJNPQN-UHFFFAOYSA-N -1 3 277.364 2.566 20 10 CFCDHM COc1c(C)cnc(COC(=O)c2cc([O-])cs2)c1C ZINC000736824849 574079103 /nfs/dbraw/zinc/07/91/03/574079103.db2.gz JUEQBGWHLBGFKD-UHFFFAOYSA-N -1 3 293.344 2.831 20 10 CFCDHM O=C(c1cc([O-])cs1)N1CCOC[C@H]1c1ccccc1 ZINC000754904944 574127506 /nfs/dbraw/zinc/12/75/06/574127506.db2.gz BYGOYMDWTLRKQP-ZDUSSCGKSA-N -1 3 289.356 2.667 20 10 CFCDHM Cc1cccc(CCNC(=O)c2cc([O-])cs2)c1 ZINC000731872764 574131769 /nfs/dbraw/zinc/13/17/69/574131769.db2.gz QEZWGGQFWLVPCH-UHFFFAOYSA-N -1 3 261.346 2.735 20 10 CFCDHM C[C@H](NC(=O)c1cc([O-])cs1)c1nc2ccccc2[nH]1 ZINC000731868331 574132726 /nfs/dbraw/zinc/13/27/26/574132726.db2.gz CMSVKWHZBHWELV-QMMMGPOBSA-N -1 3 287.344 2.821 20 10 CFCDHM Cc1ccccc1OCCOC(=O)c1cc([O-])cs1 ZINC000731910210 574133230 /nfs/dbraw/zinc/13/32/30/574133230.db2.gz OSTNMPDWCRVPKL-UHFFFAOYSA-N -1 3 278.329 2.998 20 10 CFCDHM C[C@@H](CCc1ccco1)NC(=O)c1cc([O-])cs1 ZINC000732258538 574147319 /nfs/dbraw/zinc/14/73/19/574147319.db2.gz SYGLJOGZBIHSRE-VIFPVBQESA-N -1 3 265.334 2.798 20 10 CFCDHM O=C(N[C@H]1C[C@@H]1c1cccc(F)c1)c1cc([O-])cs1 ZINC000732278415 574148281 /nfs/dbraw/zinc/14/82/81/574148281.db2.gz MDZAACWCRLSVOE-NEPJUHHUSA-N -1 3 277.320 2.879 20 10 CFCDHM COCCOc1cccc(NC(=O)c2cc([O-])cs2)c1 ZINC000732275123 574148520 /nfs/dbraw/zinc/14/85/20/574148520.db2.gz YOQWOEZGLVGHBJ-UHFFFAOYSA-N -1 3 293.344 2.731 20 10 CFCDHM O=C(c1cc([O-])cs1)N1CCc2cc(F)c(F)cc21 ZINC000732270949 574148786 /nfs/dbraw/zinc/14/87/86/574148786.db2.gz YWUBPQWYJJAAAY-UHFFFAOYSA-N -1 3 281.283 2.935 20 10 CFCDHM CC(C)Oc1ccc(NC(=O)c2cc([O-])cs2)cn1 ZINC000732275907 574149112 /nfs/dbraw/zinc/14/91/12/574149112.db2.gz RIVWYNRXCHUZKC-UHFFFAOYSA-N -1 3 278.333 2.888 20 10 CFCDHM Cc1cccc(OC[C@@H](C)NC(=O)c2cc([O-])cs2)c1 ZINC000732276051 574149243 /nfs/dbraw/zinc/14/92/43/574149243.db2.gz DYRWLKKJRSBDEV-LLVKDONJSA-N -1 3 291.372 2.959 20 10 CFCDHM CCOc1ccc(CNC(=O)c2cc([O-])cs2)cc1F ZINC000732288902 574150543 /nfs/dbraw/zinc/15/05/43/574150543.db2.gz JWXRETMZVBNQNT-UHFFFAOYSA-N -1 3 295.335 2.922 20 10 CFCDHM O=C(OCc1ccnc(Cl)c1)c1cc([O-])cs1 ZINC000732354642 574153376 /nfs/dbraw/zinc/15/33/76/574153376.db2.gz PESYCKBQTWCJPM-UHFFFAOYSA-N -1 3 269.709 2.859 20 10 CFCDHM CN(C)c1nc(CNCc2c([O-])cccc2Cl)cs1 ZINC000747100691 574179704 /nfs/dbraw/zinc/17/97/04/574179704.db2.gz NNCQLCWWICRJDE-UHFFFAOYSA-N -1 3 297.811 2.858 20 10 CFCDHM Cc1noc([C@@H](C)NCc2c([O-])cccc2Cl)n1 ZINC000733328646 574221674 /nfs/dbraw/zinc/22/16/74/574221674.db2.gz YJMJEYBMSAKSKP-SSDOTTSWSA-N -1 3 267.716 2.588 20 10 CFCDHM CCOc1ccc(CN[C@@H](C)C(=O)OC(C)(C)C)c([O-])c1 ZINC000733332322 574222763 /nfs/dbraw/zinc/22/27/63/574222763.db2.gz ZDCGGQTYZIFOGE-NSHDSACASA-N -1 3 295.379 2.611 20 10 CFCDHM CO[C@H](CNCc1cc(Cl)ccc1[O-])C(F)(F)F ZINC000733330189 574222777 /nfs/dbraw/zinc/22/27/77/574222777.db2.gz RNGYFKAIRAZXQI-SNVBAGLBSA-N -1 3 283.677 2.713 20 10 CFCDHM O=C([O-])c1ccc(CNCc2ccc3c(c2)CCO3)cc1 ZINC000740133133 574238898 /nfs/dbraw/zinc/23/88/98/574238898.db2.gz XNNBJRVNVDEHDU-UHFFFAOYSA-N -1 3 283.327 2.610 20 10 CFCDHM CC(C)CCOCCOC(=O)c1cc([O-])cs1 ZINC000733496401 574242203 /nfs/dbraw/zinc/24/22/03/574242203.db2.gz IEPAVAYUZWGZLH-UHFFFAOYSA-N -1 3 258.339 2.673 20 10 CFCDHM Cc1nn(C)c(C)c1CN[C@H](C)c1cc(F)cc(F)c1[O-] ZINC000756513257 574242707 /nfs/dbraw/zinc/24/27/07/574242707.db2.gz GNVAOBJCGGWBNN-MRVPVSSYSA-N -1 3 295.333 2.872 20 10 CFCDHM CCCN(Cc1ccccc1[O-])Cc1nccc(C)n1 ZINC000756544363 574245680 /nfs/dbraw/zinc/24/56/80/574245680.db2.gz OXFXVKGNMWQNOV-UHFFFAOYSA-N -1 3 271.364 2.903 20 10 CFCDHM C[C@H]1C[C@H](NCc2cc[nH]n2)c2c1c(F)ccc2[O-] ZINC000756554921 574246844 /nfs/dbraw/zinc/24/68/44/574246844.db2.gz KBBIYLYKCDKLOV-KWQFWETISA-N -1 3 261.300 2.593 20 10 CFCDHM C[C@@H](NCc1ccon1)c1ccc(Br)cc1[O-] ZINC000756637575 574254255 /nfs/dbraw/zinc/25/42/55/574254255.db2.gz NVQAXDSGUKDBOY-MRVPVSSYSA-N -1 3 297.152 2.994 20 10 CFCDHM C[C@@H](NCc1cccc(F)n1)c1cc([N+](=O)[O-])ccc1[O-] ZINC000756768018 574261043 /nfs/dbraw/zinc/26/10/43/574261043.db2.gz IBVOMOOMXPJVQH-SECBINFHSA-N -1 3 291.282 2.685 20 10 CFCDHM C[C@@H](NCc1cccc(F)n1)c1ccc(F)cc1[O-] ZINC000756769402 574261276 /nfs/dbraw/zinc/26/12/76/574261276.db2.gz QDNWFZPVKNSHTC-SECBINFHSA-N -1 3 264.275 2.916 20 10 CFCDHM Cc1cncc(CN[C@@H](C)c2cc([N+](=O)[O-])ccc2[O-])c1 ZINC000756784561 574262719 /nfs/dbraw/zinc/26/27/19/574262719.db2.gz NXUHPEGHVJVMBQ-NSHDSACASA-N -1 3 287.319 2.855 20 10 CFCDHM CCSCC[C@H](C)NC(=O)c1cc([O-])cs1 ZINC000743807680 574372643 /nfs/dbraw/zinc/37/26/43/574372643.db2.gz RACGHUDLBXWRFO-QMMMGPOBSA-N -1 3 259.396 2.715 20 10 CFCDHM Cc1cc(Br)cc(CN2CC(F)C2)c1[O-] ZINC000753577382 574405164 /nfs/dbraw/zinc/40/51/64/574405164.db2.gz USTPIIZLAQIZLU-UHFFFAOYSA-N -1 3 274.133 2.617 20 10 CFCDHM O=C([O-])[C@@H]1CCC[N@H+](Cc2c([O-])ccc3ccccc32)C1 ZINC000086728318 600419988 /nfs/dbraw/zinc/41/99/88/600419988.db2.gz SIOYMHIIWVEVSJ-CYBMUJFWSA-N -1 3 285.343 2.842 20 10 CFCDHM O=C([O-])[C@@H]1CCC[N@@H+](Cc2c([O-])ccc3ccccc32)C1 ZINC000086728318 600419989 /nfs/dbraw/zinc/41/99/89/600419989.db2.gz SIOYMHIIWVEVSJ-CYBMUJFWSA-N -1 3 285.343 2.842 20 10 CFCDHM Cc1cc(O)c(CNCc2ccc(C(=O)[O-])o2)cc1C ZINC000832900326 600809877 /nfs/dbraw/zinc/80/98/77/600809877.db2.gz XOYSBTWKVMJGPR-UHFFFAOYSA-N -1 3 275.304 2.590 20 10 CFCDHM CC[C@H]1CN(Cc2cc(F)cc(F)c2[O-])CCS1 ZINC000894034178 618276330 /nfs/dbraw/zinc/27/63/30/618276330.db2.gz LXOKOSZVFYGGKU-NSHDSACASA-N -1 3 273.348 2.998 20 10 CFCDHM CN(Cc1cccn1C)Cc1cc(F)cc(F)c1[O-] ZINC000894043505 618286661 /nfs/dbraw/zinc/28/66/61/618286661.db2.gz QLDZMUINFRMMJL-UHFFFAOYSA-N -1 3 266.291 2.641 20 10 CFCDHM Cc1cccc([C@H](C)CNC(=O)c2cccc(O)c2[O-])c1 ZINC000193087083 618450514 /nfs/dbraw/zinc/45/05/14/618450514.db2.gz JCMWJGOUOHZBOE-GFCCVEGCSA-N -1 3 285.343 2.940 20 10 CFCDHM COc1cccc(NC(=O)c2ccc(C)c(O)c2[O-])c1 ZINC000177658949 618466289 /nfs/dbraw/zinc/46/62/89/618466289.db2.gz ADYKURVVIURJAQ-UHFFFAOYSA-N -1 3 273.288 2.667 20 10 CFCDHM [O-]c1c(F)cc(Br)cc1CN1C[C@@H]2C[C@@H]2C1 ZINC000895390349 618563272 /nfs/dbraw/zinc/56/32/72/618563272.db2.gz KNXKCIVNXKOECD-OCAPTIKFSA-N -1 3 286.144 2.746 20 10 CFCDHM COCCN(Cc1cc(Cl)ccc1[O-])CC(F)F ZINC000092966049 618970209 /nfs/dbraw/zinc/97/02/09/618970209.db2.gz CTNSSZXVRXCYIT-UHFFFAOYSA-N -1 3 279.714 2.759 20 10 CFCDHM CN(Cc1cc(F)cc(F)c1[O-])[C@@H](CO)c1ccccc1 ZINC000894884264 619497878 /nfs/dbraw/zinc/49/78/78/619497878.db2.gz VYUNCBBWKXCPTI-HNNXBMFYSA-N -1 3 293.313 2.836 20 10 CFCDHM [O-]c1cccc(Cl)c1CNCc1nc(C(F)F)no1 ZINC000895726577 619592477 /nfs/dbraw/zinc/59/24/77/619592477.db2.gz FAIYWGUJEWKHOQ-UHFFFAOYSA-N -1 3 289.669 2.656 20 10 CFCDHM CCCc1nsc(NCc2c([O-])cccc2F)n1 ZINC000895832828 619619198 /nfs/dbraw/zinc/61/91/98/619619198.db2.gz NKDCZBWHYNHVTQ-UHFFFAOYSA-N -1 3 267.329 2.947 20 10 CFCDHM [O-]c1cccc(F)c1CNc1nccc(N2CCCC2)n1 ZINC000895832364 619619294 /nfs/dbraw/zinc/61/92/94/619619294.db2.gz FSGZOTIKYQJHDK-UHFFFAOYSA-N -1 3 288.326 2.534 20 10 CFCDHM COc1c(C)cnc(CNCc2c([O-])cccc2F)c1C ZINC000896643190 619777899 /nfs/dbraw/zinc/77/78/99/619777899.db2.gz STMITJPMHNNXJO-UHFFFAOYSA-N -1 3 290.338 2.842 20 10 CFCDHM CCOc1ccc(CNCc2c([O-])cccc2F)o1 ZINC000896640719 619781501 /nfs/dbraw/zinc/78/15/01/619781501.db2.gz RJOZCNBCJXVWPN-UHFFFAOYSA-N -1 3 265.284 2.813 20 10 CFCDHM COC(=O)c1oc(CNCc2c([O-])cccc2F)cc1C ZINC000896640745 619781547 /nfs/dbraw/zinc/78/15/47/619781547.db2.gz JGPQCKLRUPXDGU-UHFFFAOYSA-N -1 3 293.294 2.509 20 10 CFCDHM NC(=O)Cc1ccc(NCc2c([O-])cccc2Cl)cc1 ZINC000148129384 619914463 /nfs/dbraw/zinc/91/44/63/619914463.db2.gz AIDIZCUMEVQLBH-UHFFFAOYSA-N -1 3 290.750 2.686 20 10 CFCDHM CCO[C@H]1CCN(Cc2cc(Cl)c(F)cc2[O-])C1 ZINC000897068844 619925053 /nfs/dbraw/zinc/92/50/53/619925053.db2.gz ZAHUVAGJNBOEHY-JTQLQIEISA-N -1 3 273.735 2.796 20 10 CFCDHM CCc1noc(C)c1NC(=O)c1ccc(C)c(O)c1[O-] ZINC000182903551 625395233 /nfs/dbraw/zinc/39/52/33/625395233.db2.gz XFCWMSZDDDNBRS-UHFFFAOYSA-N -1 3 276.292 2.517 20 10 CFCDHM CCC[N@H+](CC(=O)[O-])Cc1cc(Cl)cc(C)c1[O-] ZINC000840997794 620116449 /nfs/dbraw/zinc/11/64/49/620116449.db2.gz FDYNAHHULHXVNE-UHFFFAOYSA-N -1 3 271.744 2.651 20 10 CFCDHM CCC[N@@H+](CC(=O)[O-])Cc1cc(Cl)cc(C)c1[O-] ZINC000840997794 620116450 /nfs/dbraw/zinc/11/64/50/620116450.db2.gz FDYNAHHULHXVNE-UHFFFAOYSA-N -1 3 271.744 2.651 20 10 CFCDHM [O-]c1cccc(F)c1CNC(=S)NC(C1CC1)C1CC1 ZINC000905661532 621811304 /nfs/dbraw/zinc/81/13/04/621811304.db2.gz NZDOQIGQPJDYGV-UHFFFAOYSA-N -1 3 294.395 2.684 20 10 CFCDHM O=C(N[C@@H]1CCC[C@H](C2CC2)C1)c1cccc(O)c1[O-] ZINC000819798119 622558938 /nfs/dbraw/zinc/55/89/38/622558938.db2.gz SQTMKMNANMLANB-NWDGAFQWSA-N -1 3 275.348 2.796 20 10 CFCDHM CC(C)C(CNC(=O)c1cccc(O)c1[O-])C(C)C ZINC000229572808 623212706 /nfs/dbraw/zinc/21/27/06/623212706.db2.gz CKJVKKYCBBYKLU-UHFFFAOYSA-N -1 3 265.353 2.756 20 10 CFCDHM [O-]c1ccc(Cl)cc1CNCc1noc(C2CC2)n1 ZINC000824320132 623490365 /nfs/dbraw/zinc/49/03/65/623490365.db2.gz DRIAQCKDHVQFOC-UHFFFAOYSA-N -1 3 279.727 2.596 20 10 CFCDHM Cc1cc([O-])c(CN(C)CC(=O)NC(C)(C)C)cc1Cl ZINC000824535741 623519654 /nfs/dbraw/zinc/51/96/54/623519654.db2.gz WLXIVEMVORGERL-UHFFFAOYSA-N -1 3 298.814 2.701 20 10 CFCDHM Cc1cc([O-])c(CN2CCO[C@H](C)C2)cc1Cl ZINC000824542209 623520575 /nfs/dbraw/zinc/52/05/75/623520575.db2.gz QMJJFYXLTJOEQS-SNVBAGLBSA-N -1 3 255.745 2.575 20 10 CFCDHM Cc1cc([O-])c(CN2CCO[C@@H](C)[C@@H]2C)cc1Cl ZINC000824815106 623571651 /nfs/dbraw/zinc/57/16/51/623571651.db2.gz ZNRIVPWBUMWRIL-QWRGUYRKSA-N -1 3 269.772 2.963 20 10 CFCDHM CCc1nc(CNCc2c([O-])cccc2Cl)co1 ZINC000825051079 623617331 /nfs/dbraw/zinc/61/73/31/623617331.db2.gz VNFKLGAJWFZKTK-UHFFFAOYSA-N -1 3 266.728 2.886 20 10 CFCDHM Cc1cc([O-])c(CNCc2noc(C3CC3)n2)cc1Cl ZINC000825748579 623750419 /nfs/dbraw/zinc/75/04/19/623750419.db2.gz GGRYUDBTFQNSNB-UHFFFAOYSA-N -1 3 293.754 2.904 20 10 CFCDHM Cc1cc([O-])c(CN(C)[C@H]2CC(C)(C)OC2=O)cc1Cl ZINC000825991611 623779310 /nfs/dbraw/zinc/77/93/10/623779310.db2.gz KHLDPNIPDMEIJV-LBPRGKRZSA-N -1 3 297.782 2.880 20 10 CFCDHM CC(C)CCOC(=O)NCc1c([O-])cccc1F ZINC000921451982 624894484 /nfs/dbraw/zinc/89/44/84/624894484.db2.gz ZWDKTLYPFMXCCZ-UHFFFAOYSA-N -1 3 255.289 2.804 20 10 CFCDHM O=C(NCc1c([O-])cccc1F)OC1CCCC1 ZINC000921452101 624894565 /nfs/dbraw/zinc/89/45/65/624894565.db2.gz DELJWHIHQCBOOM-UHFFFAOYSA-N -1 3 253.273 2.700 20 10 CFCDHM C[C@H](N[C@@H]1CCn2ccnc21)c1cc(F)cc(F)c1[O-] ZINC000834830675 625891826 /nfs/dbraw/zinc/89/18/26/625891826.db2.gz GFDUVOHLUAQGAX-QPUJVOFHSA-N -1 3 279.290 2.663 20 10 CFCDHM CCc1ncc(CN[C@H](C)c2ccc(F)cc2[O-])o1 ZINC000834899157 625914112 /nfs/dbraw/zinc/91/41/12/625914112.db2.gz IRPYEKJFJKJPAD-SECBINFHSA-N -1 3 264.300 2.933 20 10 CFCDHM CC1(C)CC[C@H]1NC(=O)NCc1c([O-])cccc1F ZINC000922480642 626293335 /nfs/dbraw/zinc/29/33/35/626293335.db2.gz YGVNGTOLLHJBEN-GFCCVEGCSA-N -1 3 266.316 2.519 20 10 CFCDHM CCc1ccc(CNC(=O)c2cccc(O)c2[O-])s1 ZINC000186937786 626405590 /nfs/dbraw/zinc/40/55/90/626405590.db2.gz IVCYMSIEHGHATD-UHFFFAOYSA-N -1 3 277.345 2.652 20 10 CFCDHM C[C@@H](Cc1ccccc1F)NC(=O)c1cccc(O)c1[O-] ZINC000186999689 626410500 /nfs/dbraw/zinc/41/05/00/626410500.db2.gz AHEUWHFUBRRMEJ-JTQLQIEISA-N -1 3 289.306 2.598 20 10 CFCDHM CC[C@@H](C)CCNC(=O)NCc1c([O-])cccc1F ZINC000923235702 626459061 /nfs/dbraw/zinc/45/90/61/626459061.db2.gz VTMSLZSCPHCNGF-SNVBAGLBSA-N -1 3 268.332 2.767 20 10 CFCDHM [O-]c1c(Cl)cccc1CN1CC2(C1)CCCOC2 ZINC000839138787 626528413 /nfs/dbraw/zinc/52/84/13/626528413.db2.gz UALWVRCWQXUZNE-UHFFFAOYSA-N -1 3 267.756 2.658 20 10 CFCDHM [O-]c1c(F)cc(Cl)cc1CN1C[C@@H]2C[C@H]1CS2 ZINC000839191143 626530749 /nfs/dbraw/zinc/53/07/49/626530749.db2.gz FGAUKRPURCBLIE-UWVGGRQHSA-N -1 3 273.760 2.874 20 10 CFCDHM Cc1ccc(CNCc2cc([N+](=O)[O-])ccc2[O-])nc1C ZINC000839164233 626531517 /nfs/dbraw/zinc/53/15/17/626531517.db2.gz NTCMUWSNTMUHLK-UHFFFAOYSA-N -1 3 287.319 2.602 20 10 CFCDHM CC(=O)c1cc(Cl)cc(CN2C[C@@H]3C[C@H]2CS3)c1[O-] ZINC000839201039 626532027 /nfs/dbraw/zinc/53/20/27/626532027.db2.gz CQTLKSSMYXQOLV-RYUDHWBXSA-N -1 3 297.807 2.938 20 10 CFCDHM Cc1ncc([C@@H](C)NCc2cc([N+](=O)[O-])ccc2[O-])s1 ZINC000761433441 626834448 /nfs/dbraw/zinc/83/44/48/626834448.db2.gz AHQDGXAIMKGNJC-MRVPVSSYSA-N -1 3 293.348 2.916 20 10 CFCDHM COc1c([O-])c(CN(C)Cc2ccoc2)ccc1[N+](=O)[O-] ZINC000774852301 627971685 /nfs/dbraw/zinc/97/16/85/627971685.db2.gz INUDLBQHIPAHTO-UHFFFAOYSA-N -1 3 292.291 2.534 20 10 CFCDHM [O-]c1c(F)cc(Cl)cc1CN1CCC[C@H](CCO)C1 ZINC000775680820 628054993 /nfs/dbraw/zinc/05/49/93/628054993.db2.gz JPBXDLZGYKHIIV-SNVBAGLBSA-N -1 3 287.762 2.779 20 10 CFCDHM [O-]c1c(Cl)cc(Cl)cc1CN1C[C@H]2C[C@@]2(CO)C1 ZINC000783742738 628740182 /nfs/dbraw/zinc/74/01/82/628740182.db2.gz OUVMGBGMFSHWKQ-RNCFNFMXSA-N -1 3 288.174 2.513 20 10 CFCDHM [O-]c1cccc(Cl)c1CN1C[C@H](O)Cc2ccccc21 ZINC000789761444 629186244 /nfs/dbraw/zinc/18/62/44/629186244.db2.gz FUQUTRXPOFFBCA-GFCCVEGCSA-N -1 3 289.762 2.969 20 10 CFCDHM O=C(NCc1ccc2ccccc2n1)c1cccc(O)c1[O-] ZINC000790536948 629246218 /nfs/dbraw/zinc/24/62/18/629246218.db2.gz BFSKSZWQVUUYBE-UHFFFAOYSA-N -1 3 294.310 2.576 20 10 CFCDHM O=C(NC1(c2ccc(F)cc2)CC1)c1cccc(O)c1[O-] ZINC000790839654 629268616 /nfs/dbraw/zinc/26/86/16/629268616.db2.gz HJNMNTOVJVWAPC-UHFFFAOYSA-N -1 3 287.290 2.656 20 10 CFCDHM O=C(c1cccc(O)c1[O-])N(CC(F)F)CC1CCC1 ZINC000790911992 629271280 /nfs/dbraw/zinc/27/12/80/629271280.db2.gz XSVDYCWWIPWWEH-UHFFFAOYSA-N -1 3 285.290 2.605 20 10 CFCDHM Cc1cc(CNC(=O)c2cccc(O)c2[O-])ccc1Cl ZINC000790933202 629272496 /nfs/dbraw/zinc/27/24/96/629272496.db2.gz XWNKCAWEIWGBLH-UHFFFAOYSA-N -1 3 291.734 2.990 20 10 CFCDHM Cc1ccc(CN(CCO)Cc2c([O-])cccc2Cl)o1 ZINC000793365843 629531767 /nfs/dbraw/zinc/53/17/67/629531767.db2.gz PQUIPQZKRLTWJL-UHFFFAOYSA-N -1 3 295.766 2.942 20 10 CFCDHM CC[C@H](NCc1ccon1)c1ccc(F)cc1[O-] ZINC000796791467 629968580 /nfs/dbraw/zinc/96/85/80/629968580.db2.gz XMBLWWWMBDUFMR-LBPRGKRZSA-N -1 3 250.273 2.760 20 10 CFCDHM CCn1cnnc1CN[C@@H](C)c1ccc(Cl)cc1[O-] ZINC000841743590 631463117 /nfs/dbraw/zinc/46/31/17/631463117.db2.gz BEDKMRSEMVXWBK-VIFPVBQESA-N -1 3 280.759 2.508 20 10 CFCDHM C[C@@H](NCc1ccon1)c1ccc(Cl)cc1[O-] ZINC000841755165 631466853 /nfs/dbraw/zinc/46/68/53/631466853.db2.gz OMYBQBZRYFVGSV-MRVPVSSYSA-N -1 3 252.701 2.884 20 10 CFCDHM CCCN(CCC)c1ccc(CNC[C@@H](F)C(=O)[O-])cc1 ZINC000841816916 631475246 /nfs/dbraw/zinc/47/52/46/631475246.db2.gz XNTSEBDNLLUWLX-OAHLLOKOSA-N -1 3 296.386 2.825 20 10 CFCDHM Cc1cc(CNCc2ccc3c(c2)CCO3)ccc1C(=O)[O-] ZINC000841822643 631475330 /nfs/dbraw/zinc/47/53/30/631475330.db2.gz OIUSHQDGOSZKOP-UHFFFAOYSA-N -1 3 297.354 2.918 20 10 CFCDHM COc1ccncc1CN[C@H](C)c1cc(F)cc(F)c1[O-] ZINC000815630117 632301962 /nfs/dbraw/zinc/30/19/62/632301962.db2.gz XFBRRZSRRVDFFX-SECBINFHSA-N -1 3 294.301 2.925 20 10 CFCDHM Cc1cc(Cl)cc(C[N@@H+]2[C@H](C)CC[C@@H]2C(=O)[O-])c1[O-] ZINC000844936126 632341962 /nfs/dbraw/zinc/34/19/62/632341962.db2.gz UJUOPDLVHUQZQQ-BXKDBHETSA-N -1 3 283.755 2.792 20 10 CFCDHM Cc1cc(Cl)cc(C[N@H+]2[C@H](C)CC[C@@H]2C(=O)[O-])c1[O-] ZINC000844936126 632341966 /nfs/dbraw/zinc/34/19/66/632341966.db2.gz UJUOPDLVHUQZQQ-BXKDBHETSA-N -1 3 283.755 2.792 20 10 CFCDHM C[C@@H]1COCCN(Cc2cc(Cl)c(F)cc2[O-])C1 ZINC000816514139 632474853 /nfs/dbraw/zinc/47/48/53/632474853.db2.gz NHIJWVGUGKEBGA-VIFPVBQESA-N -1 3 273.735 2.653 20 10 CFCDHM Cc1cc(CNCc2cc(Cl)c(F)cc2[O-])ncn1 ZINC000816559869 632484049 /nfs/dbraw/zinc/48/40/49/632484049.db2.gz XWZOFYVPZHMDGN-UHFFFAOYSA-N -1 3 281.718 2.573 20 10 CFCDHM [O-]c1c(CN2C[C@H](O)CC(F)(F)C2)ccc2ccccc12 ZINC000816589414 632490477 /nfs/dbraw/zinc/49/04/77/632490477.db2.gz XMEHHBJJKHKCQI-CYBMUJFWSA-N -1 3 293.313 2.747 20 10 CFCDHM CC[C@@H](NCC(F)(F)CN)c1cc(Cl)ccc1[O-] ZINC000817968700 632767153 /nfs/dbraw/zinc/76/71/53/632767153.db2.gz WDRPEZDSNWPGTL-SNVBAGLBSA-N -1 3 278.730 2.680 20 10 CFCDHM C[C@H](N[C@H]1C[C@H](C)n2ncnc21)c1cc(Cl)ccc1[O-] ZINC000850499229 634019732 /nfs/dbraw/zinc/01/97/32/634019732.db2.gz LKQNFTMLBOWCNT-AUTRQRHGSA-N -1 3 292.770 2.994 20 10 CFCDHM COC(=O)CN(Cc1cc(Cl)ccc1[O-])CC(C)C ZINC000109779560 634235808 /nfs/dbraw/zinc/23/58/08/634235808.db2.gz HFFDVZHNMUUFHU-UHFFFAOYSA-N -1 3 285.771 2.677 20 10 CFCDHM C[C@@H](NCc1cc([N+](=O)[O-])ccc1[O-])c1ccns1 ZINC000858317613 636188511 /nfs/dbraw/zinc/18/85/11/636188511.db2.gz WGAQCOGSNAVVSE-MRVPVSSYSA-N -1 3 279.321 2.608 20 10 CFCDHM CC[C@H](NC(=O)c1cccc(O)c1[O-])c1c(C)noc1C ZINC000189536512 650387452 /nfs/dbraw/zinc/38/74/52/650387452.db2.gz JGIPOCYJESOGHQ-NSHDSACASA-N -1 3 290.319 2.584 20 10 CFCDHM C[C@H](NCc1c([O-])ccc(Cl)c1F)c1ccnn1C ZINC000865839461 638604842 /nfs/dbraw/zinc/60/48/42/638604842.db2.gz XFFOZGYPTQQDCQ-QMMMGPOBSA-N -1 3 283.734 2.769 20 10 CFCDHM C[C@@H](NCc1c([O-])cccc1Cl)C(=O)OC(C)(C)C ZINC000123261311 639768928 /nfs/dbraw/zinc/76/89/28/639768928.db2.gz LEQZPKGFDCURIG-SECBINFHSA-N -1 3 285.771 2.865 20 10 CFCDHM Cc1nonc1CN[C@@H](C)c1cc(Cl)ccc1[O-] ZINC000872134958 641663523 /nfs/dbraw/zinc/66/35/23/641663523.db2.gz AOJJCXNQHBPKOB-ZETCQYMHSA-N -1 3 267.716 2.588 20 10 CFCDHM [O-]c1c(F)c(F)ccc1CN(CCO)Cc1ccccc1 ZINC000876526410 642904722 /nfs/dbraw/zinc/90/47/22/642904722.db2.gz SVXSRSHRTQFQRL-UHFFFAOYSA-N -1 3 293.313 2.665 20 10 CFCDHM CCOc1ccc(NC(=O)c2cccc(O)c2[O-])cc1 ZINC000126199814 643032828 /nfs/dbraw/zinc/03/28/28/643032828.db2.gz KYCNQTVUWKCRMK-UHFFFAOYSA-N -1 3 273.288 2.749 20 10 CFCDHM CN(C(=O)c1cccc(O)c1[O-])C1CCCCCC1 ZINC000126267494 643085811 /nfs/dbraw/zinc/08/58/11/643085811.db2.gz REGPETDZCJOQOA-UHFFFAOYSA-N -1 3 263.337 2.893 20 10 CFCDHM Cc1ccc([C@@H](C)NC(=O)c2cccc(O)c2[O-])cc1 ZINC000126319764 643117712 /nfs/dbraw/zinc/11/77/12/643117712.db2.gz RKGXBHQSAKWNPY-LLVKDONJSA-N -1 3 271.316 2.897 20 10 CFCDHM C[C@@H](Cc1cccs1)NC(=O)c1cccc(O)c1[O-] ZINC000126408482 643206982 /nfs/dbraw/zinc/20/69/82/643206982.db2.gz BCJZTNOFYBMFOU-VIFPVBQESA-N -1 3 277.345 2.520 20 10 CFCDHM Cc1nocc1CNCc1cc(Cl)c(F)cc1[O-] ZINC000877564077 643364469 /nfs/dbraw/zinc/36/44/69/643364469.db2.gz XNQXNLSSSRAMKM-UHFFFAOYSA-N -1 3 270.691 2.771 20 10 CFCDHM CC1(C)C[C@H](O)CN(Cc2cc(Cl)c(F)cc2[O-])C1 ZINC000877751290 643526612 /nfs/dbraw/zinc/52/66/12/643526612.db2.gz AWMSPGYCJMORMT-JTQLQIEISA-N -1 3 287.762 2.778 20 10 CFCDHM Cc1cc(NCc2c([O-])cccc2Cl)nn1C ZINC000129643765 645308694 /nfs/dbraw/zinc/30/86/94/645308694.db2.gz YTKARDUYGZIBNS-UHFFFAOYSA-N -1 3 251.717 2.700 20 10 CFCDHM [O-]c1c(F)cc(F)cc1CNCc1noc2c1CCCC2 ZINC000883120793 645612355 /nfs/dbraw/zinc/61/23/55/645612355.db2.gz NLUSXYBVYFVXKI-UHFFFAOYSA-N -1 3 294.301 2.827 20 10 CFCDHM CCN(CC)c1ccc(C=Cc2nccc(=O)[n-]2)cc1F ZINC000131826015 645831459 /nfs/dbraw/zinc/83/14/59/645831459.db2.gz OIAVWSOXHAUFGP-SOFGYWHQSA-N -1 3 287.338 2.926 20 10 CFCDHM CCc1nnc([C@@H](C)N[C@H](C)c2c([O-])cccc2F)[nH]1 ZINC000886558674 647046440 /nfs/dbraw/zinc/04/64/40/647046440.db2.gz PIIQBCAHVDRQNB-RKDXNWHRSA-N -1 3 278.331 2.624 20 10 CFCDHM CCn1ccc(CN[C@H](C)c2c([O-])cccc2F)n1 ZINC000886625542 647075535 /nfs/dbraw/zinc/07/55/35/647075535.db2.gz UJTHGAXTLJMVBF-SNVBAGLBSA-N -1 3 263.316 2.599 20 10 CFCDHM C[C@@H](NCc1c(C2CC2)cnn1C)c1c([O-])cccc1F ZINC000886637685 647081877 /nfs/dbraw/zinc/08/18/77/647081877.db2.gz CEQXJPYWKGEAFR-SNVBAGLBSA-N -1 3 289.354 2.993 20 10 CFCDHM C[C@H](C(=O)NCc1c([O-])cccc1F)C1CCCC1 ZINC000928705559 648944307 /nfs/dbraw/zinc/94/43/07/648944307.db2.gz LJKHSPKIDNEMQO-JTQLQIEISA-N -1 3 265.328 2.974 20 10 CFCDHM CCCc1ncc(C(=O)NCc2c([O-])cccc2F)s1 ZINC000928705322 648944945 /nfs/dbraw/zinc/94/49/45/648944945.db2.gz JKENTWVEQRMDTF-UHFFFAOYSA-N -1 3 294.351 2.870 20 10 CFCDHM CC(C)(C)/C=C\C(=O)NCc1c([O-])cccc1F ZINC000928706580 648945394 /nfs/dbraw/zinc/94/53/94/648945394.db2.gz XPZXCBFYSARRTE-FPLPWBNLSA-N -1 3 251.301 2.750 20 10 CFCDHM C[C@]1(C(=O)NCc2c([O-])cccc2F)CC=CCC1 ZINC000928706666 648945596 /nfs/dbraw/zinc/94/55/96/648945596.db2.gz UPELJOWDLXJJCV-HNNXBMFYSA-N -1 3 263.312 2.894 20 10 CFCDHM Cc1cc(C)c(C(=O)NCc2c([O-])cccc2F)c(C)n1 ZINC000928709665 648945996 /nfs/dbraw/zinc/94/59/96/648945996.db2.gz KRAXULZPCCLXNI-UHFFFAOYSA-N -1 3 288.322 2.782 20 10 CFCDHM C[C@H]1CN(Cc2cc(F)cc(Cl)c2[O-])CC[C@]1(C)O ZINC001237807546 779718804 /nfs/dbraw/zinc/71/88/04/779718804.db2.gz LONLGTRAKDUIID-XPTSAGLGSA-N -1 3 287.762 2.778 20 10 CFCDHM O=C(c1ccccc1)c1ccc([O-])c(O)c1OC1CC1 ZINC001227941849 776336699 /nfs/dbraw/zinc/33/66/99/776336699.db2.gz YHHKSYVFXMGXAE-UHFFFAOYSA-N -1 3 270.284 2.870 20 10 CFCDHM CCC1CC[NH+](Cc2cc(C(=O)[O-])ccc2[O-])CC1 ZINC001231560276 777259252 /nfs/dbraw/zinc/25/92/52/777259252.db2.gz FAJQKIWLTVWGPV-UHFFFAOYSA-N -1 3 263.337 2.712 20 10 CFCDHM [O-]c1ccc2ccccc2c1CN(CCO)CC(F)(F)F ZINC001231590556 777271384 /nfs/dbraw/zinc/27/13/84/777271384.db2.gz HFYURFRDJSCWOX-UHFFFAOYSA-N -1 3 299.292 2.902 20 10 CFCDHM C[C@@H]1CN(Cc2cc(Cl)c([O-])cc2O)C[C@@H]1F ZINC001232261032 777496447 /nfs/dbraw/zinc/49/64/47/777496447.db2.gz VOFAOYXRZPIHPJ-XCBNKYQSSA-N -1 3 259.708 2.541 20 10 CFCDHM COc1cc([O-])c(CN2CC3(C2)CCCCO3)cc1Cl ZINC001232266061 777499526 /nfs/dbraw/zinc/49/95/26/777499526.db2.gz HXSJNCNNQCKITF-UHFFFAOYSA-N -1 3 297.782 2.809 20 10 CFCDHM COc1cc([O-])c(CN2CCC(=O)C(C)(C)C2)cc1Cl ZINC001232269748 777501396 /nfs/dbraw/zinc/50/13/96/777501396.db2.gz JODTZIXBNPAAQJ-UHFFFAOYSA-N -1 3 297.782 2.855 20 10 CFCDHM [O-]c1cccc2c1C[N@H+](Cc1ccc(F)c(F)c1[O-])CC2 ZINC001233078891 777788614 /nfs/dbraw/zinc/78/86/14/777788614.db2.gz NFCGPOKPMNDESL-UHFFFAOYSA-N -1 3 291.297 2.934 20 10 CFCDHM [O-]c1cccc2c1C[N@@H+](Cc1ccc(F)c(F)c1[O-])CC2 ZINC001233078891 777788624 /nfs/dbraw/zinc/78/86/24/777788624.db2.gz NFCGPOKPMNDESL-UHFFFAOYSA-N -1 3 291.297 2.934 20 10 CFCDHM [O-]c1ccc(F)c(F)c1CN1CC[C@@H]2CCCO[C@@H]2C1 ZINC001233332758 777892578 /nfs/dbraw/zinc/89/25/78/777892578.db2.gz WRIBAVTTXMABEI-IINYFYTJSA-N -1 3 283.318 2.671 20 10 CFCDHM CCOC1CCN(Cc2c([O-])ccc(F)c2F)CC1 ZINC001233334892 777893957 /nfs/dbraw/zinc/89/39/57/777893957.db2.gz YMICONXFNXNSOO-UHFFFAOYSA-N -1 3 271.307 2.671 20 10 CFCDHM Cc1cc(Br)c([O-])c(CN2CCC2)c1 ZINC001236673684 778908292 /nfs/dbraw/zinc/90/82/92/778908292.db2.gz NQJZLZJBAWSLSI-UHFFFAOYSA-N -1 3 256.143 2.669 20 10 CFCDHM C[C@@H]1CN(Cc2cc(Cl)c(Cl)cc2[O-])CC[C@H]1O ZINC001236793748 778939805 /nfs/dbraw/zinc/93/98/05/778939805.db2.gz ORBCUIZVDVBHNZ-PRHODGIISA-N -1 3 290.190 2.902 20 10 CFCDHM COc1cc([O-])c(CN2CCCCC23COC3)c(Cl)c1 ZINC001236800776 778943526 /nfs/dbraw/zinc/94/35/26/778943526.db2.gz XELPJSHMMSYRAK-UHFFFAOYSA-N -1 3 297.782 2.809 20 10 CFCDHM CCCN1CCN(Cc2ccc(OC)c(Cl)c2[O-])CC1 ZINC001236812283 778949883 /nfs/dbraw/zinc/94/98/83/778949883.db2.gz UVHKZARYORCXEA-UHFFFAOYSA-N -1 3 298.814 2.582 20 10 CFCDHM [O-]c1ccc(Cl)c(Cl)c1CN1CC[C@@H](F)[C@H](O)C1 ZINC001237078849 779004004 /nfs/dbraw/zinc/00/40/04/779004004.db2.gz YNZNHPVSZZCFFJ-MWLCHTKSSA-N -1 3 294.153 2.604 20 10 CFCDHM CCOC(=O)CCN(C)Cc1c([O-])ccc(F)c1Cl ZINC001237126061 779018617 /nfs/dbraw/zinc/01/86/17/779018617.db2.gz HNQAQIWEIWUDFJ-UHFFFAOYSA-N -1 3 289.734 2.570 20 10 CFCDHM [O-]c1c(Cl)cc(F)cc1CN1CCC[C@@]2(CCO2)C1 ZINC001237800110 779181372 /nfs/dbraw/zinc/18/13/72/779181372.db2.gz XEPZBWGYVDFLDX-CQSZACIVSA-N -1 3 285.746 2.940 20 10 CFCDHM C[C@@H]1C[C@H](O)CCN1Cc1cc(F)c(Cl)cc1[O-] ZINC001237950712 779216390 /nfs/dbraw/zinc/21/63/90/779216390.db2.gz ZKRAJXFHPOODTK-PSASIEDQSA-N -1 3 273.735 2.530 20 10 CFCDHM CC[C@H]1CN(Cc2cc(F)cc(F)c2[O-])CCCO1 ZINC000708413885 781272930 /nfs/dbraw/zinc/27/29/30/781272930.db2.gz ORJHSVZVOMDABX-LBPRGKRZSA-N -1 3 271.307 2.671 20 10 CFCDHM [O-]c1c(F)cc(F)cc1CN1CCO[C@@H](C(F)F)CC1 ZINC000708412118 781273619 /nfs/dbraw/zinc/27/36/19/781273619.db2.gz GDZKTPAHBHRFMV-LLVKDONJSA-N -1 3 293.260 2.526 20 10 CFCDHM Cc1cnc(CNCc2cc(F)cc(F)c2[O-])s1 ZINC000708467082 781275857 /nfs/dbraw/zinc/27/58/57/781275857.db2.gz LYCSMQKTUIXUBJ-UHFFFAOYSA-N -1 3 270.304 2.725 20 10 CFCDHM CC(C)[C@H]1CN(Cc2c([O-])cccc2Cl)CCO1 ZINC000709018447 781286742 /nfs/dbraw/zinc/28/67/42/781286742.db2.gz ASBHWJHTKZITSN-CQSZACIVSA-N -1 3 269.772 2.902 20 10 CFCDHM Cc1cnn(C2CN(Cc3cc(Cl)ccc3[O-])C2)c1 ZINC000361255381 348506874 /nfs/dbraw/zinc/50/68/74/348506874.db2.gz NXGBMXOWEHIBIZ-UHFFFAOYSA-N -1 3 277.755 2.607 20 10 CFCDHM COCC1=CCN(Cc2cc(Cl)c(F)cc2[O-])CC1 ZINC000294834780 199204629 /nfs/dbraw/zinc/20/46/29/199204629.db2.gz YSSZFZVMEVNVAI-UHFFFAOYSA-N -1 3 285.746 2.963 20 10 CFCDHM C[C@H](N[C@@H](CCO)c1ccco1)c1ccc(F)cc1[O-] ZINC000186562863 299349346 /nfs/dbraw/zinc/34/93/46/299349346.db2.gz GQBHWWOCHVBZQS-GWCFXTLKSA-N -1 3 279.311 2.899 20 10 CFCDHM [O-]c1cccc(Cl)c1CN[C@@H]1c2ccccc2C[C@@H]1O ZINC000113327193 376010346 /nfs/dbraw/zinc/01/03/46/376010346.db2.gz VSFRXSDGCLJYGB-JKSUJKDBSA-N -1 3 289.762 2.794 20 10 CFCDHM C[C@H]1CCC[C@H](N(C)C(=O)c2cccc(O)c2[O-])C1 ZINC000126290860 377221159 /nfs/dbraw/zinc/22/11/59/377221159.db2.gz GSJSIEAUALFBBL-QWRGUYRKSA-N -1 3 263.337 2.749 20 10 CFCDHM CC(C)(CNC(=O)c1cccc(O)c1[O-])c1cccs1 ZINC000126489173 377230218 /nfs/dbraw/zinc/23/02/18/377230218.db2.gz PRHACPDUAZIFDH-UHFFFAOYSA-N -1 3 291.372 2.867 20 10 CFCDHM CCCOc1ccc(CN2C[C@@H](C)O[C@H](C)C2)c([O-])c1 ZINC000126957219 377257226 /nfs/dbraw/zinc/25/72/26/377257226.db2.gz RKRKJYNUSCYGGW-CHWSQXEVSA-N -1 3 279.380 2.790 20 10 CFCDHM [O-]c1cccc(Cl)c1CN1CCC(C2OCCO2)CC1 ZINC000130094786 377510523 /nfs/dbraw/zinc/51/05/23/377510523.db2.gz KHJBJDBFRJDYKZ-UHFFFAOYSA-N -1 3 297.782 2.631 20 10 CFCDHM Cc1ccc(C(=O)N(C)[C@H](C)c2cccnc2)c([O-])c1O ZINC000179460558 380546577 /nfs/dbraw/zinc/54/65/77/380546577.db2.gz UQPWROMJPUZWNP-LLVKDONJSA-N -1 3 286.331 2.634 20 10 CFCDHM C[C@@H]1c2cccn2CCN1Cc1cc(F)ccc1[O-] ZINC000179881860 380592074 /nfs/dbraw/zinc/59/20/74/380592074.db2.gz HBEPVXYQLQPSDV-LLVKDONJSA-N -1 3 260.312 2.910 20 10 CFCDHM [O-]c1ccc(F)cc1CN1CCCC[C@@H]1c1ncc[nH]1 ZINC000180020370 380611819 /nfs/dbraw/zinc/61/18/19/380611819.db2.gz AWIKFWLJRKZIBU-CYBMUJFWSA-N -1 3 275.327 2.982 20 10 CFCDHM COC(=O)CN(CCc1ccccc1)Cc1ccccc1[O-] ZINC000180910357 380711784 /nfs/dbraw/zinc/71/17/84/380711784.db2.gz ZTZMMSVSTRDYQE-UHFFFAOYSA-N -1 3 299.370 2.610 20 10 CFCDHM C[C@H](O)C1CCN(Cc2cc(Cl)c(F)cc2[O-])CC1 ZINC000295515198 380909050 /nfs/dbraw/zinc/90/90/50/380909050.db2.gz ZMQHOVXRGXETKA-VIFPVBQESA-N -1 3 287.762 2.778 20 10 CFCDHM Cc1noc([N-]Cc2c(C)c3ccccc3n2C)n1 ZINC000287890445 380965762 /nfs/dbraw/zinc/96/57/62/380965762.db2.gz ZYMATWZGWLTXNF-UHFFFAOYSA-N -1 3 256.309 2.790 20 10 CFCDHM O=C(Nc1cccc(-c2cc[nH]n2)c1)c1cccc(O)c1[O-] ZINC000184774545 381475249 /nfs/dbraw/zinc/47/52/49/381475249.db2.gz UBYYFUPVXLKWRV-UHFFFAOYSA-N -1 3 295.298 2.740 20 10 CFCDHM CC[C@@H]1CN(Cc2cc(Cl)cc(OC)c2[O-])CCO1 ZINC000184677249 381458295 /nfs/dbraw/zinc/45/82/95/381458295.db2.gz CQQKLRVMCFMMQH-GFCCVEGCSA-N -1 3 285.771 2.665 20 10 CFCDHM COc1cc(Cl)cc(CN2C[C@@H](C)OC[C@H]2C)c1[O-] ZINC000184680848 381458986 /nfs/dbraw/zinc/45/89/86/381458986.db2.gz AZVVPABJUNCLMA-NXEZZACHSA-N -1 3 285.771 2.663 20 10 CFCDHM COc1cc(Cl)cc(CN2CCOC3(CCC3)C2)c1[O-] ZINC000184698250 381462741 /nfs/dbraw/zinc/46/27/41/381462741.db2.gz MBEHHMCCIRNWQN-UHFFFAOYSA-N -1 3 297.782 2.809 20 10 CFCDHM CC(=O)c1cc(F)cc(CN(C)[C@H](CO)CC(C)C)c1[O-] ZINC000185370460 381614958 /nfs/dbraw/zinc/61/49/58/381614958.db2.gz XEKYBHSXCIPFSD-AWEZNQCLSA-N -1 3 297.370 2.573 20 10 CFCDHM CC[C@@](C)(NC(=O)c1cccc(O)c1[O-])c1nccs1 ZINC000185708326 381711566 /nfs/dbraw/zinc/71/15/66/381711566.db2.gz LHFVWONGAWVONK-CQSZACIVSA-N -1 3 292.360 2.610 20 10 CFCDHM CC(C)N1CC[C@@H](N[C@H](C)c2cc(Cl)ccc2[O-])C1=O ZINC000186047744 381811338 /nfs/dbraw/zinc/81/13/38/381811338.db2.gz WGNCAGWTGPKXHG-ZWNOBZJWSA-N -1 3 296.798 2.706 20 10 CFCDHM [O-]c1ccc(Cl)cc1CN1CCC[C@H]2OCC[C@H]21 ZINC000373484215 382014441 /nfs/dbraw/zinc/01/44/41/382014441.db2.gz KXHVAEBCEUOBCH-TZMCWYRMSA-N -1 3 267.756 2.799 20 10 CFCDHM CSCCCCCNC(=O)c1ccc(C)c(O)c1[O-] ZINC000186948722 382054515 /nfs/dbraw/zinc/05/45/15/382054515.db2.gz FRFJWZGLVIJHIS-UHFFFAOYSA-N -1 3 283.393 2.669 20 10 CFCDHM CC[C@H](c1ccncc1)N(C)C(=O)c1cccc(O)c1[O-] ZINC000187113369 382102767 /nfs/dbraw/zinc/10/27/67/382102767.db2.gz XGKINSZXMMCAMI-CYBMUJFWSA-N -1 3 286.331 2.716 20 10 CFCDHM [O-]c1ccc(F)cc1CN1CCC[C@H]1c1ncc[nH]1 ZINC000375353870 382081030 /nfs/dbraw/zinc/08/10/30/382081030.db2.gz QYNNVCMMIVLMJL-LBPRGKRZSA-N -1 3 261.300 2.592 20 10 CFCDHM [O-]c1c(Cl)cccc1CN1CCC2(CC1)OCCCO2 ZINC000293543077 382165602 /nfs/dbraw/zinc/16/56/02/382165602.db2.gz CZNYQLMTKAGTHA-UHFFFAOYSA-N -1 3 297.782 2.775 20 10 CFCDHM Cc1ccc(C(=O)N2CC[C@]3(C)[C@H](C2)C3(F)F)c([O-])c1O ZINC000293637688 382206834 /nfs/dbraw/zinc/20/68/34/382206834.db2.gz KMQNTSNNJVELRD-IINYFYTJSA-N -1 3 297.301 2.524 20 10 CFCDHM Cc1ccccc1C1=CCN(C(=O)c2cccc(O)c2[O-])C1 ZINC000365757229 382438416 /nfs/dbraw/zinc/43/84/16/382438416.db2.gz HWNZVBUTJISTND-UHFFFAOYSA-N -1 3 295.338 2.946 20 10 CFCDHM C[C@@H]1CC[C@]2(CCN(C(=O)c3cccc(O)c3[O-])C2)C1 ZINC000365554548 382411880 /nfs/dbraw/zinc/41/18/80/382411880.db2.gz DQQNZKWAQSZGMH-BZNIZROVSA-N -1 3 275.348 2.750 20 10 CFCDHM COc1ccncc1CN[C@@H](C)c1ccc(F)c(F)c1[O-] ZINC000294492989 382515984 /nfs/dbraw/zinc/51/59/84/382515984.db2.gz XVWLQKWUTRKRAD-VIFPVBQESA-N -1 3 294.301 2.925 20 10 CFCDHM COc1ncccc1CN[C@@H](C)c1ccc(F)c(F)c1[O-] ZINC000191198749 382695328 /nfs/dbraw/zinc/69/53/28/382695328.db2.gz VQXPDYRTTJXCNC-VIFPVBQESA-N -1 3 294.301 2.925 20 10 CFCDHM C[C@@H](NCc1cc(Cl)cc([N+](=O)[O-])c1[O-])c1cn[nH]c1 ZINC000270165791 385000462 /nfs/dbraw/zinc/00/04/62/385000462.db2.gz GPILJTGVQFETGG-SSDOTTSWSA-N -1 3 296.714 2.528 20 10 CFCDHM CC[C@H](NCc1ncnn1C(C)(C)C)c1ccccc1[O-] ZINC000282455121 385316065 /nfs/dbraw/zinc/31/60/65/385316065.db2.gz FRNRDJKQNYSDJS-ZDUSSCGKSA-N -1 3 288.395 2.980 20 10 CFCDHM CCOCc1nnc(NCc2c([O-])cccc2Cl)o1 ZINC000272027000 385430097 /nfs/dbraw/zinc/43/00/97/385430097.db2.gz DCDMEKLYWSCUGC-UHFFFAOYSA-N -1 3 283.715 2.577 20 10 CFCDHM [O-]c1cccc(Cl)c1CNc1nnc([C@H]2CCCO2)o1 ZINC000272199367 385471737 /nfs/dbraw/zinc/47/17/37/385471737.db2.gz HFUAEEHQLMVTTJ-LLVKDONJSA-N -1 3 295.726 2.892 20 10 CFCDHM C[C@H](O)[C@@H]1CCN(Cc2cc(Cl)cc(Cl)c2[O-])C1 ZINC000272492135 385551420 /nfs/dbraw/zinc/55/14/20/385551420.db2.gz DXRVIPGVYURWLV-DTWKUNHWSA-N -1 3 290.190 2.902 20 10 CFCDHM Cc1ccc(CN[C@@H](C)c2cc([N+](=O)[O-])ccc2[O-])cn1 ZINC000273420127 385683024 /nfs/dbraw/zinc/68/30/24/385683024.db2.gz RXRSYXDBEQEOOS-NSHDSACASA-N -1 3 287.319 2.855 20 10 CFCDHM CCc1nnc([C@H](C)N[C@@H](C)c2ccc(F)cc2[O-])[nH]1 ZINC000273480076 385685332 /nfs/dbraw/zinc/68/53/32/385685332.db2.gz LVPDKEUWFZYHEH-IUCAKERBSA-N -1 3 278.331 2.624 20 10 CFCDHM C[C@H](N[C@H]1CCCc2c[nH]nc21)c1ccc(F)cc1[O-] ZINC000273496061 385686013 /nfs/dbraw/zinc/68/60/13/385686013.db2.gz PBLFQZZTJISEJK-ZANVPECISA-N -1 3 275.327 2.983 20 10 CFCDHM CCCCCNC(=O)[C@@H](C)N(C)Cc1ccccc1[O-] ZINC000109770332 393879559 /nfs/dbraw/zinc/87/95/59/393879559.db2.gz RLARRLUMAUSPRQ-CYBMUJFWSA-N -1 3 278.396 2.519 20 10 CFCDHM C[C@H]1CCN(C(=O)c2cccc(O)c2[O-])CC1(C)C ZINC000280587874 394073450 /nfs/dbraw/zinc/07/34/50/394073450.db2.gz XHECEQRJVFQEEQ-JTQLQIEISA-N -1 3 263.337 2.606 20 10 CFCDHM Cc1ccc(C(=O)N2CCCC[C@@H](C)C2)c([O-])c1O ZINC000186441377 292051450 /nfs/dbraw/zinc/05/14/50/292051450.db2.gz NDXXLELGBAJZJI-SNVBAGLBSA-N -1 3 263.337 2.668 20 10 CFCDHM Cc1cnn([C@H]2CCN(Cc3cc(Cl)ccc3[O-])C2)c1 ZINC000365614164 262374848 /nfs/dbraw/zinc/37/48/48/262374848.db2.gz FOVUPMYDZWNARH-AWEZNQCLSA-N -1 3 291.782 2.998 20 10 CFCDHM COc1cc(Cl)cc(CN2CCOCC[C@H]2C)c1[O-] ZINC000367708012 267112196 /nfs/dbraw/zinc/11/21/96/267112196.db2.gz QDWQKWZWXVWDPV-SNVBAGLBSA-N -1 3 285.771 2.665 20 10 CFCDHM CC[C@@H](N[C@H](C)c1nncn1C)c1ccc(C)cc1[O-] ZINC000280239031 276534479 /nfs/dbraw/zinc/53/44/79/276534479.db2.gz VTQIKAMZLQOQRW-DGCLKSJQSA-N -1 3 274.368 2.631 20 10 CFCDHM CC[C@H](NCC(=O)NC(C)C)c1cccc(Cl)c1[O-] ZINC000287573835 288035690 /nfs/dbraw/zinc/03/56/90/288035690.db2.gz GZHQUYXUSAWHRW-LBPRGKRZSA-N -1 3 284.787 2.611 20 10 CFCDHM Cc1ccc(C(=O)N2CC[C@H](C)C[C@@H]2C)c([O-])c1O ZINC000272804605 301515775 /nfs/dbraw/zinc/51/57/75/301515775.db2.gz ZCIXODIZRIMYKX-ONGXEEELSA-N -1 3 263.337 2.667 20 10 CFCDHM CCO[C@@]1(C)C[C@H]1NCc1c([O-])ccc(Cl)c1F ZINC000527782879 330283191 /nfs/dbraw/zinc/28/31/91/330283191.db2.gz LMXFGYHCTYVGTI-YPMHNXCESA-N -1 3 273.735 2.842 20 10 CFCDHM CCC(NC(=O)c1cccc(O)c1[O-])(C1CC1)C1CC1 ZINC000529800829 333509284 /nfs/dbraw/zinc/50/92/84/333509284.db2.gz UGULAMNSJKUMBK-UHFFFAOYSA-N -1 3 275.348 2.796 20 10 CFCDHM CCN(CCOC)Cc1cc(Cl)cc(C(C)=O)c1[O-] ZINC000049013391 521134676 /nfs/dbraw/zinc/13/46/76/521134676.db2.gz OXKONJNNIVPCQZ-UHFFFAOYSA-N -1 3 285.771 2.717 20 10 CFCDHM CC(=O)c1cc(F)cc(CN2C[C@H](C)[C@@H]2C)c1[O-] ZINC000293369267 518286124 /nfs/dbraw/zinc/28/61/24/518286124.db2.gz JBHWCPOFBNGCJC-IUCAKERBSA-N -1 3 251.301 2.574 20 10 CFCDHM CCCC[C@H](C(=O)OC)N(C)Cc1ccccc1[O-] ZINC000072629618 521125630 /nfs/dbraw/zinc/12/56/30/521125630.db2.gz GDBSPRLQWOQFBJ-CYBMUJFWSA-N -1 3 265.353 2.556 20 10 CFCDHM CCCN(Cc1ncnn1C(C)C)Cc1ccccc1[O-] ZINC000280062354 521695217 /nfs/dbraw/zinc/69/52/17/521695217.db2.gz PRLWRNOIKAAZNW-UHFFFAOYSA-N -1 3 288.395 2.977 20 10 CFCDHM CCCN(Cc1nnc(CC)o1)Cc1ccccc1[O-] ZINC000104682353 521696176 /nfs/dbraw/zinc/69/61/76/521696176.db2.gz DEEOVFRPTNLVND-UHFFFAOYSA-N -1 3 275.352 2.750 20 10 CFCDHM CC[C@@H](NCc1cnn(CC)c1)c1ccc(F)cc1[O-] ZINC000286292735 522893431 /nfs/dbraw/zinc/89/34/31/522893431.db2.gz WSKVNIWBOARRCF-CQSZACIVSA-N -1 3 277.343 2.989 20 10 CFCDHM CC[C@@H](NCc1nncn1CC)c1ccc(C)cc1[O-] ZINC000280060235 522897305 /nfs/dbraw/zinc/89/73/05/522897305.db2.gz KFLODCGWCOVIJL-CYBMUJFWSA-N -1 3 274.368 2.553 20 10 CFCDHM C[C@@H](N[C@@H](C)c1ccc(F)c(F)c1[O-])c1cn[nH]c1 ZINC000276908167 525607152 /nfs/dbraw/zinc/60/71/52/525607152.db2.gz KGJCCSXYFNNTPC-SFYZADRCSA-N -1 3 267.279 2.805 20 10 CFCDHM C[C@@H](N[C@@H](C)c1ncn(C)n1)c1cc(Cl)ccc1[O-] ZINC000275810439 525624615 /nfs/dbraw/zinc/62/46/15/525624615.db2.gz ZLOJHAMKOCXWOS-BDAKNGLRSA-N -1 3 280.759 2.586 20 10 CFCDHM [O-]c1ccc(Cl)cc1CN1CCO[C@@H]2CCC[C@H]21 ZINC000228143511 526346667 /nfs/dbraw/zinc/34/66/67/526346667.db2.gz YJXFTVWUIBVSTP-TZMCWYRMSA-N -1 3 267.756 2.799 20 10 CFCDHM [O-]c1ccc(Cl)cc1CN1CC[C@H](n2cccn2)C1 ZINC000365846142 526346755 /nfs/dbraw/zinc/34/67/55/526346755.db2.gz GSVRDWNWSPXRQE-ZDUSSCGKSA-N -1 3 277.755 2.689 20 10 CFCDHM Cc1nnsc1CN[C@H](C)c1ccc(F)c(F)c1[O-] ZINC000293363663 526448239 /nfs/dbraw/zinc/44/82/39/526448239.db2.gz HMJPZFICIBKLLH-ZCFIWIBFSA-N -1 3 285.319 2.681 20 10 CFCDHM Cc1nnsc1CN[C@@H](C)c1ccc(F)c(F)c1[O-] ZINC000293363653 526449076 /nfs/dbraw/zinc/44/90/76/526449076.db2.gz HMJPZFICIBKLLH-LURJTMIESA-N -1 3 285.319 2.681 20 10 CFCDHM O=C(c1cccc(O)c1[O-])N1CC2(C1)CCCCC2 ZINC000279808900 526769682 /nfs/dbraw/zinc/76/96/82/526769682.db2.gz KXDXKHPEIKJCNL-UHFFFAOYSA-N -1 3 261.321 2.504 20 10 CFCDHM O=C(NCc1nc2ccccc2s1)c1cc([O-])cs1 ZINC000731862011 574130939 /nfs/dbraw/zinc/13/09/39/574130939.db2.gz WPXVEJXPLJVSPS-UHFFFAOYSA-N -1 3 290.369 2.993 20 10 CFCDHM CN(C)[C@@H](CNC(=O)c1cc([O-])cs1)c1cccs1 ZINC000731865330 574131303 /nfs/dbraw/zinc/13/13/03/574131303.db2.gz BIFIFRHAJWFPNE-JTQLQIEISA-N -1 3 296.417 2.548 20 10 CFCDHM CCc1nc(COC(=O)c2cc([O-])cs2)cs1 ZINC000731910939 574133466 /nfs/dbraw/zinc/13/34/66/574133466.db2.gz WXGAOXTXNPONAQ-UHFFFAOYSA-N -1 3 269.347 2.830 20 10 CFCDHM O=C(OCc1nc2ccccc2o1)c1cc([O-])cs1 ZINC000731910812 574133552 /nfs/dbraw/zinc/13/35/52/574133552.db2.gz CYFCLCXCCRDPCE-UHFFFAOYSA-N -1 3 275.285 2.952 20 10 CFCDHM O=C(OCc1ccccc1F)c1cc([O-])cs1 ZINC000731911213 574133759 /nfs/dbraw/zinc/13/37/59/574133759.db2.gz GJIIOISHYAAHTJ-UHFFFAOYSA-N -1 3 252.266 2.950 20 10 CFCDHM COc1cccc([C@H](C)NC(=O)c2cc([O-])cs2)c1 ZINC000732267468 574148073 /nfs/dbraw/zinc/14/80/73/574148073.db2.gz GEETUMWHTNVGJK-VIFPVBQESA-N -1 3 277.345 2.953 20 10 CFCDHM CN(Cc1cccc(F)c1)C(=O)c1cc([O-])cs1 ZINC000732258959 574148156 /nfs/dbraw/zinc/14/81/56/574148156.db2.gz WPLNTEGUEDHKAR-UHFFFAOYSA-N -1 3 265.309 2.865 20 10 CFCDHM COc1ccc([C@H](C)NC(=O)c2cc([O-])cs2)cc1 ZINC000732267561 574148195 /nfs/dbraw/zinc/14/81/95/574148195.db2.gz KMWAGAQFUKRJLT-VIFPVBQESA-N -1 3 277.345 2.953 20 10 CFCDHM Cc1cc([C@H]2CCCN2C(=O)c2cc([O-])cs2)on1 ZINC000732269632 574148753 /nfs/dbraw/zinc/14/87/53/574148753.db2.gz GRUOLPDBTATXKZ-SNVBAGLBSA-N -1 3 278.333 2.727 20 10 CFCDHM O=C(NCc1nc(-c2ccccc2)c[nH]1)c1cc([O-])cs1 ZINC000732278575 574149473 /nfs/dbraw/zinc/14/94/73/574149473.db2.gz QCSOUUWZDWYXRZ-UHFFFAOYSA-N -1 3 299.355 2.774 20 10 CFCDHM O=C(N[C@H]1C[C@H]1c1ccccc1)c1cc([O-])cs1 ZINC000732277756 574149489 /nfs/dbraw/zinc/14/94/89/574149489.db2.gz OKDZJWCFMPVWDQ-RYUDHWBXSA-N -1 3 259.330 2.740 20 10 CFCDHM O=C(NCc1cc2ccccc2[nH]1)c1cc([O-])cs1 ZINC000732279526 574149859 /nfs/dbraw/zinc/14/98/59/574149859.db2.gz SVVRKSWGBKUGLF-UHFFFAOYSA-N -1 3 272.329 2.865 20 10 CFCDHM CCCCc1noc(COC(=O)c2cc([O-])cs2)n1 ZINC000732354366 574153382 /nfs/dbraw/zinc/15/33/82/574153382.db2.gz KHWQXLUKDDTTBK-UHFFFAOYSA-N -1 3 282.321 2.536 20 10 CFCDHM O=C(Nc1cccc(-n2ccnc2)c1)c1cc([O-])cs1 ZINC000746685511 574162897 /nfs/dbraw/zinc/16/28/97/574162897.db2.gz DEUYPWFWDJRUMU-UHFFFAOYSA-N -1 3 285.328 2.892 20 10 CFCDHM Cc1cc([O-])c(C[N@@H+]2CCCC[C@H]2CC(=O)[O-])cc1C ZINC000738464015 574170520 /nfs/dbraw/zinc/17/05/20/574170520.db2.gz VOJUHMDHWQTRSO-AWEZNQCLSA-N -1 3 277.364 2.838 20 10 CFCDHM Cc1cc([O-])c(C[N@H+]2CCCC[C@H]2CC(=O)[O-])cc1C ZINC000738464015 574170521 /nfs/dbraw/zinc/17/05/21/574170521.db2.gz VOJUHMDHWQTRSO-AWEZNQCLSA-N -1 3 277.364 2.838 20 10 CFCDHM CC(C)n1cc([C@H](C)NC(=O)c2cc([O-])cs2)cn1 ZINC000732835181 574174881 /nfs/dbraw/zinc/17/48/81/574174881.db2.gz HTYZEAXCEWTXDH-VIFPVBQESA-N -1 3 279.365 2.722 20 10 CFCDHM CC(C)c1nnc(CNCc2ccccc2[O-])s1 ZINC000756141763 574212618 /nfs/dbraw/zinc/21/26/18/574212618.db2.gz YPVBCZLTPCDAFR-UHFFFAOYSA-N -1 3 263.366 2.657 20 10 CFCDHM COc1ccc(CN[C@H]2CCCCN(C(=O)[O-])C2)cc1C ZINC000739903144 574228248 /nfs/dbraw/zinc/22/82/48/574228248.db2.gz MAZKKXKZNAZCHD-AWEZNQCLSA-N -1 3 292.379 2.626 20 10 CFCDHM CCn1cc(CN(C)Cc2c([O-])ccc3ccncc32)cn1 ZINC000733789952 574255788 /nfs/dbraw/zinc/25/57/88/574255788.db2.gz AMUZDWGBFUGESH-UHFFFAOYSA-N -1 3 296.374 2.789 20 10 CFCDHM CO[C@@H](CN[C@@H](C)c1cc(F)cc(F)c1[O-])C(F)(F)F ZINC000756835116 574266538 /nfs/dbraw/zinc/26/65/38/574266538.db2.gz MSZZLCUGEIAJNE-WKEGUHRASA-N -1 3 299.239 2.898 20 10 CFCDHM Cc1nc2cc(NC(=O)c3cc([O-])cs3)ccc2n1C ZINC000743806672 574372680 /nfs/dbraw/zinc/37/26/80/574372680.db2.gz PMLYOHGDXNCQEX-UHFFFAOYSA-N -1 3 287.344 2.901 20 10 CFCDHM O=C(c1cc([O-])cs1)N1CCS[C@H]2CCCC[C@@H]21 ZINC000752823988 574395627 /nfs/dbraw/zinc/39/56/27/574395627.db2.gz GILPJXAUKAJDQU-QWRGUYRKSA-N -1 3 283.418 2.954 20 10 CFCDHM C[C@@H]1CN(Cc2cc(F)cc(F)c2[O-])CCS1 ZINC000894002851 618269785 /nfs/dbraw/zinc/26/97/85/618269785.db2.gz TULKWURPWPNYCB-MRVPVSSYSA-N -1 3 259.321 2.608 20 10 CFCDHM O=C([O-])[C@]1(F)CC[N@H+](Cc2c([O-])ccc3ccccc32)C1 ZINC000833176008 601371774 /nfs/dbraw/zinc/37/17/74/601371774.db2.gz VTCNGJUBCWMYJD-INIZCTEOSA-N -1 3 289.306 2.544 20 10 CFCDHM O=C([O-])[C@]1(F)CC[N@@H+](Cc2c([O-])ccc3ccccc32)C1 ZINC000833176008 601371777 /nfs/dbraw/zinc/37/17/77/601371777.db2.gz VTCNGJUBCWMYJD-INIZCTEOSA-N -1 3 289.306 2.544 20 10 CFCDHM O=C([O-])[C@@H]1C[C@H]2CCCC[C@@H]2[N@@H+]1Cc1ccccc1[O-] ZINC000227229744 604679753 /nfs/dbraw/zinc/67/97/53/604679753.db2.gz YUFGOMVHOBPLHC-XBFCOCLRSA-N -1 3 275.348 2.610 20 10 CFCDHM O=C([O-])[C@@H]1C[C@H]2CCCC[C@@H]2[N@H+]1Cc1ccccc1[O-] ZINC000227229744 604679757 /nfs/dbraw/zinc/67/97/57/604679757.db2.gz YUFGOMVHOBPLHC-XBFCOCLRSA-N -1 3 275.348 2.610 20 10 CFCDHM O=C([O-])C[C@H]1CCC[N@@H+]1Cc1c([O-])ccc2ccccc21 ZINC000086791053 604981413 /nfs/dbraw/zinc/98/14/13/604981413.db2.gz IQDNYAVHDXUYPZ-CYBMUJFWSA-N -1 3 285.343 2.985 20 10 CFCDHM O=C([O-])C[C@H]1CCC[N@H+]1Cc1c([O-])ccc2ccccc21 ZINC000086791053 604981417 /nfs/dbraw/zinc/98/14/17/604981417.db2.gz IQDNYAVHDXUYPZ-CYBMUJFWSA-N -1 3 285.343 2.985 20 10 CFCDHM Fc1ccc(-c2nnn[n-]2)c(CSc2nccs2)c1 ZINC000822758579 607040435 /nfs/dbraw/zinc/04/04/35/607040435.db2.gz SICNKNUPSIICEW-UHFFFAOYSA-N -1 3 293.352 2.755 20 10 CFCDHM Fc1ccc(-c2nn[n-]n2)c(CSc2nccs2)c1 ZINC000822758579 607040436 /nfs/dbraw/zinc/04/04/36/607040436.db2.gz SICNKNUPSIICEW-UHFFFAOYSA-N -1 3 293.352 2.755 20 10 CFCDHM Cc1cc(CNCc2cc(Cl)ccc2[O-])no1 ZINC000044692337 618035471 /nfs/dbraw/zinc/03/54/71/618035471.db2.gz DTAFCFZPMBDADY-UHFFFAOYSA-N -1 3 252.701 2.632 20 10 CFCDHM CCS[C@@H]1CC[C@H](N(C)C(=O)c2cccc(O)c2[O-])C1 ZINC000187191093 618273878 /nfs/dbraw/zinc/27/38/78/618273878.db2.gz YBHKSRZYKGOLMR-WDEREUQCSA-N -1 3 295.404 2.844 20 10 CFCDHM C[C@H]1SCCN(Cc2cc(F)cc(F)c2[O-])[C@H]1C ZINC000894035222 618277455 /nfs/dbraw/zinc/27/74/55/618277455.db2.gz WRNNQNLJYRYPHF-DTWKUNHWSA-N -1 3 273.348 2.996 20 10 CFCDHM C[C@@H]1SCCN(Cc2cc(F)cc(F)c2[O-])[C@H]1C ZINC000894035223 618277668 /nfs/dbraw/zinc/27/76/68/618277668.db2.gz WRNNQNLJYRYPHF-IUCAKERBSA-N -1 3 273.348 2.996 20 10 CFCDHM Cc1ccc(C(=O)Nc2cccc(F)c2)c([O-])c1O ZINC000177667490 618470398 /nfs/dbraw/zinc/47/03/98/618470398.db2.gz VZXJTIPOGHDBRZ-UHFFFAOYSA-N -1 3 261.252 2.798 20 10 CFCDHM Cc1ccc(C(=O)N2CCc3ccccc32)c([O-])c1O ZINC000177667555 618470528 /nfs/dbraw/zinc/47/05/28/618470528.db2.gz BPWKEYKMGPHPJI-UHFFFAOYSA-N -1 3 269.300 2.609 20 10 CFCDHM Cc1nnc(CNCc2c([O-])cc(C)cc2Cl)s1 ZINC000840936503 619077526 /nfs/dbraw/zinc/07/75/26/619077526.db2.gz KHTMRWNZYKJSJU-UHFFFAOYSA-N -1 3 283.784 2.804 20 10 CFCDHM COC1(C)CN(Cc2c([O-])cc(C)cc2Cl)C1 ZINC000840945134 619104015 /nfs/dbraw/zinc/10/40/15/619104015.db2.gz ASHHVUJLDHAREL-UHFFFAOYSA-N -1 3 255.745 2.575 20 10 CFCDHM Cc1nnc([C@H](C)NCc2c([O-])cc(C)cc2Cl)[nH]1 ZINC000894779433 619463969 /nfs/dbraw/zinc/46/39/69/619463969.db2.gz YDRFZXOLQKLIDA-QMMMGPOBSA-N -1 3 280.759 2.631 20 10 CFCDHM [O-]c1ccc(Cl)c(F)c1CN1CC[C@H](CF)C1 ZINC000895573196 619557077 /nfs/dbraw/zinc/55/70/77/619557077.db2.gz OHXKLSPRVQQOKZ-MRVPVSSYSA-N -1 3 261.699 2.976 20 10 CFCDHM CCn1nc(C)c([N+](=O)[O-])c1NCc1c([O-])cccc1F ZINC000895832152 619619032 /nfs/dbraw/zinc/61/90/32/619619032.db2.gz CBYVZJCCSUUAAJ-UHFFFAOYSA-N -1 3 294.286 2.576 20 10 CFCDHM [O-]c1cccc(F)c1CNc1ccc(N2CCCC2)nn1 ZINC000895832612 619619221 /nfs/dbraw/zinc/61/92/21/619619221.db2.gz IVVWZRJVFRVEMZ-UHFFFAOYSA-N -1 3 288.326 2.534 20 10 CFCDHM CCc1cc(NCc2c([O-])cccc2F)nc(C)n1 ZINC000895832904 619619229 /nfs/dbraw/zinc/61/92/29/619619229.db2.gz QBCYDFZFUYOSAP-UHFFFAOYSA-N -1 3 261.300 2.804 20 10 CFCDHM C[C@@H]1CCN(Cc2c([O-])ccc(Cl)c2F)CCO1 ZINC000896584272 619767228 /nfs/dbraw/zinc/76/72/28/619767228.db2.gz NEHRMMYSWUXCSD-SECBINFHSA-N -1 3 273.735 2.796 20 10 CFCDHM [O-]c1cccc(F)c1CNCc1cc(C(F)(F)F)n[nH]1 ZINC000896638992 619780807 /nfs/dbraw/zinc/78/08/07/619780807.db2.gz SJHGIZFPMNBCFO-UHFFFAOYSA-N -1 3 289.232 2.563 20 10 CFCDHM Cc1ncc([C@H](C)NCc2c([O-])cccc2F)c(C)n1 ZINC000896640329 619781495 /nfs/dbraw/zinc/78/14/95/619781495.db2.gz HDNWJKPVKUXUMF-VIFPVBQESA-N -1 3 275.327 2.789 20 10 CFCDHM CCO[C@H]1CCN(Cc2cc(Cl)cc(F)c2[O-])C1 ZINC000897069217 619924789 /nfs/dbraw/zinc/92/47/89/619924789.db2.gz SMXHUMQGEGBVCL-NSHDSACASA-N -1 3 273.735 2.796 20 10 CFCDHM O=C(NCc1c([O-])cccc1F)C(F)=C1CCCC1 ZINC000928706212 619995838 /nfs/dbraw/zinc/99/58/38/619995838.db2.gz SWPGMUIRRKDGOK-UHFFFAOYSA-N -1 3 267.275 2.945 20 10 CFCDHM O=C(C[C@@H]1CCC(F)(F)C1)NCc1c([O-])cccc1F ZINC000928707129 619995866 /nfs/dbraw/zinc/99/58/66/619995866.db2.gz APHJGHGWAHBWEI-VIFPVBQESA-N -1 3 287.281 2.973 20 10 CFCDHM C[C@@H]1CCC[C@H]1CC(=O)NCc1c([O-])cccc1F ZINC000928707705 619996216 /nfs/dbraw/zinc/99/62/16/619996216.db2.gz GYDIOPYFOIRGEW-MNOVXSKESA-N -1 3 265.328 2.974 20 10 CFCDHM Cc1ccc(C(=O)Nc2cc(F)ccc2O)c([O-])c1O ZINC000182912965 625394768 /nfs/dbraw/zinc/39/47/68/625394768.db2.gz ZUZFVGKKQMYZFK-UHFFFAOYSA-N -1 3 277.251 2.503 20 10 CFCDHM Cc1ccc(C(=O)Nc2ccc3c(c2)COC3)c([O-])c1O ZINC000182971579 625407670 /nfs/dbraw/zinc/40/76/70/625407670.db2.gz RWYHQUBBAYRSIG-UHFFFAOYSA-N -1 3 285.299 2.689 20 10 CFCDHM C[C@@H]1CCC[C@H](CNC(=O)c2cccc(O)c2[O-])C1 ZINC000228736234 623160021 /nfs/dbraw/zinc/16/00/21/623160021.db2.gz XBGVYASTMOOMCS-MNOVXSKESA-N -1 3 263.337 2.654 20 10 CFCDHM [O-]c1ccc(Cl)c(F)c1CNC1(CF)CCOCC1 ZINC000824690652 623545625 /nfs/dbraw/zinc/54/56/25/623545625.db2.gz KISNGQRFONUJTC-UHFFFAOYSA-N -1 3 291.725 2.793 20 10 CFCDHM O=C(NCc1c([O-])cccc1F)NC[C@@H]1CC=CCC1 ZINC000914414605 623787232 /nfs/dbraw/zinc/78/72/32/623787232.db2.gz WRAAVWUFSVJYBA-LLVKDONJSA-N -1 3 278.327 2.687 20 10 CFCDHM COC(=O)[C@@H](CC1CC1)NCc1cc(Cl)c(C)cc1[O-] ZINC000826120284 623795480 /nfs/dbraw/zinc/79/54/80/623795480.db2.gz BDKAHPFZFVESNM-CYBMUJFWSA-N -1 3 297.782 2.785 20 10 CFCDHM COC(C)(C)C[C@@H](C)NC(=O)NCc1c([O-])cccc1F ZINC000920527027 624739299 /nfs/dbraw/zinc/73/92/99/624739299.db2.gz KMKGSOKPSPAXGW-SNVBAGLBSA-N -1 3 298.358 2.534 20 10 CFCDHM O=C(NCc1c([O-])cccc1F)N[C@@H](C1CC1)C1CCC1 ZINC000922815432 626371890 /nfs/dbraw/zinc/37/18/90/626371890.db2.gz BVGVTHRARGFQIO-OAHLLOKOSA-N -1 3 292.354 2.909 20 10 CFCDHM CCC[C@@H](C)c1cc(NC(=O)c2cccc(O)c2[O-])n[nH]1 ZINC000187129433 626460622 /nfs/dbraw/zinc/46/06/22/626460622.db2.gz AEXHKVODZWQHOI-SECBINFHSA-N -1 3 289.335 2.977 20 10 CFCDHM CCc1ccc(O)c(NC(=O)c2cccc(O)c2[O-])c1 ZINC000187158438 626471335 /nfs/dbraw/zinc/47/13/35/626471335.db2.gz LFDJRLXUTMNMIR-UHFFFAOYSA-N -1 3 273.288 2.618 20 10 CFCDHM CCc1ccccc1S(=O)(=O)[N-]c1ccc(O)cc1 ZINC000187166621 626473712 /nfs/dbraw/zinc/47/37/12/626473712.db2.gz ZFILWLPUOLGZTQ-UHFFFAOYSA-N -1 3 277.345 2.755 20 10 CFCDHM [O-]c1cccc(Cl)c1CN1CCC[C@@H]1c1ncon1 ZINC000769233060 627414008 /nfs/dbraw/zinc/41/40/08/627414008.db2.gz QZODZTOXKXBMQN-LLVKDONJSA-N -1 3 279.727 2.766 20 10 CFCDHM CCCN1CCN(Cc2cc(Cl)cc(F)c2[O-])CC1 ZINC000775636482 628048727 /nfs/dbraw/zinc/04/87/27/628048727.db2.gz DDCGSASWMXUZKK-UHFFFAOYSA-N -1 3 286.778 2.712 20 10 CFCDHM C[C@@H]1[C@H](C)N(C)CCN1Cc1cc(Cl)cc(F)c1[O-] ZINC000775987032 628092520 /nfs/dbraw/zinc/09/25/20/628092520.db2.gz UATGMJUIZHKCOC-VHSXEESVSA-N -1 3 286.778 2.709 20 10 CFCDHM [O-]c1cccc(Cl)c1CNc1nc2ccccn2n1 ZINC000776266378 628124485 /nfs/dbraw/zinc/12/44/85/628124485.db2.gz UXNDJAAATWTCNA-UHFFFAOYSA-N -1 3 274.711 2.700 20 10 CFCDHM C[C@H](C(=O)NC(C)(C)C)N(C)Cc1cccc(Cl)c1[O-] ZINC000777219180 628208826 /nfs/dbraw/zinc/20/88/26/628208826.db2.gz HTOOJOREVHBLSL-SNVBAGLBSA-N -1 3 298.814 2.781 20 10 CFCDHM CC(C)[C@H](CC(F)(F)F)NC(=O)c1cccc(O)c1[O-] ZINC000783869965 628752246 /nfs/dbraw/zinc/75/22/46/628752246.db2.gz SFCYHWXIJRQVEW-VIFPVBQESA-N -1 3 291.269 2.805 20 10 CFCDHM CN(Cc1ccc(F)cc1F)C(=O)c1cccc(O)c1[O-] ZINC000790519210 629244939 /nfs/dbraw/zinc/24/49/39/629244939.db2.gz ZWAHAVZILHIHSR-UHFFFAOYSA-N -1 3 293.269 2.648 20 10 CFCDHM O=C(c1cccc(O)c1[O-])N1CC[C@@H]1c1ccccc1 ZINC000790538588 629246758 /nfs/dbraw/zinc/24/67/58/629246758.db2.gz JEMXSJHOHZJMLC-CYBMUJFWSA-N -1 3 269.300 2.685 20 10 CFCDHM C[C@H]1C[C@@H]1c1ccc(CNC(=O)c2cccc(O)c2[O-])o1 ZINC000790554483 629247125 /nfs/dbraw/zinc/24/71/25/629247125.db2.gz OCGAYKCULJYIRJ-CABZTGNLSA-N -1 3 287.315 2.744 20 10 CFCDHM O=C(Nc1ccc2scnc2c1)c1cccc(O)c1[O-] ZINC000790622081 629253088 /nfs/dbraw/zinc/25/30/88/629253088.db2.gz GEZFWIWPMSHACV-UHFFFAOYSA-N -1 3 286.312 2.960 20 10 CFCDHM O=C(N[C@H]1CCc2ccc(F)cc21)c1cccc(O)c1[O-] ZINC000790664632 629256520 /nfs/dbraw/zinc/25/65/20/629256520.db2.gz SBQBIIMGVGJKHL-ZDUSSCGKSA-N -1 3 287.290 2.654 20 10 CFCDHM COc1c(F)cc(F)cc1NC(=O)c1cccc(O)c1[O-] ZINC000790893473 629270062 /nfs/dbraw/zinc/27/00/62/629270062.db2.gz WUJXOLZVEXQPIW-UHFFFAOYSA-N -1 3 295.241 2.637 20 10 CFCDHM CS[C@H](CNC(=O)c1cccc(O)c1[O-])C(C)(C)C ZINC000790926876 629271771 /nfs/dbraw/zinc/27/17/71/629271771.db2.gz QXTRPJISAKXSMA-LLVKDONJSA-N -1 3 283.393 2.605 20 10 CFCDHM Cc1ccc(C(=O)Nc2cnc(C(C)C)nc2)c([O-])c1O ZINC000794415956 629644753 /nfs/dbraw/zinc/64/47/53/629644753.db2.gz QIQJWQGLCPEYES-UHFFFAOYSA-N -1 3 287.319 2.572 20 10 CFCDHM CC[C@H](NCc1nnc(C)s1)c1ccc(F)cc1[O-] ZINC000796930208 629990381 /nfs/dbraw/zinc/99/03/81/629990381.db2.gz CZQMMGSJHSZGPP-NSHDSACASA-N -1 3 281.356 2.932 20 10 CFCDHM C[C@H](N[C@@H](C)c1cc(F)cc(F)c1[O-])c1ccn(C)n1 ZINC000840815352 631230020 /nfs/dbraw/zinc/23/00/20/631230020.db2.gz DTNDWBPOARIGGA-IUCAKERBSA-N -1 3 281.306 2.816 20 10 CFCDHM CC[C@@H](NCc1ccn(CC)n1)c1ccc(F)cc1[O-] ZINC000840840292 631237312 /nfs/dbraw/zinc/23/73/12/631237312.db2.gz COYWGFNDALZOTK-CQSZACIVSA-N -1 3 277.343 2.989 20 10 CFCDHM Cc1cc([O-])c(CN2CCO[C@H](CF)C2)c(Cl)c1 ZINC000840955422 631282114 /nfs/dbraw/zinc/28/21/14/631282114.db2.gz UUAYDFGSKSUNOD-SNVBAGLBSA-N -1 3 273.735 2.524 20 10 CFCDHM [O-]c1cccc(Cl)c1CN1CC(O)(c2ccccc2)C1 ZINC000811509296 631574276 /nfs/dbraw/zinc/57/42/76/631574276.db2.gz UWOZEAWIRMBLOC-UHFFFAOYSA-N -1 3 289.762 2.749 20 10 CFCDHM Cc1nn(C)c2cc(NC(=O)c3cccc(O)c3[O-])ccc12 ZINC000812618489 631744646 /nfs/dbraw/zinc/74/46/46/631744646.db2.gz MIAIGCCOFULDGP-UHFFFAOYSA-N -1 3 297.314 2.545 20 10 CFCDHM CC1(C)[C@H](O)CCN1Cc1cc(Cl)cc(F)c1[O-] ZINC000812778651 631772374 /nfs/dbraw/zinc/77/23/74/631772374.db2.gz KHEARQZGLIBJIA-LLVKDONJSA-N -1 3 273.735 2.530 20 10 CFCDHM COc1ccc(N(C)Cc2cc(=O)[n-]c(C3CC3)n2)cc1 ZINC000844354866 632177998 /nfs/dbraw/zinc/17/79/98/632177998.db2.gz JCHGKINRXPKOBZ-UHFFFAOYSA-N -1 3 285.347 2.705 20 10 CFCDHM C[C@@H](NCc1cc[nH]n1)c1cccc(C(F)(F)F)c1[O-] ZINC000815577696 632291029 /nfs/dbraw/zinc/29/10/29/632291029.db2.gz WONCOCUATNFRQT-MRVPVSSYSA-N -1 3 285.269 2.985 20 10 CFCDHM CC(C)N1CCN(Cc2cc(Cl)c(F)cc2[O-])CC1 ZINC000816484045 632468170 /nfs/dbraw/zinc/46/81/70/632468170.db2.gz NVFZRJONDOFHRY-UHFFFAOYSA-N -1 3 286.778 2.711 20 10 CFCDHM CCN(Cc1cn(C)nn1)Cc1ccc2ccccc2c1[O-] ZINC000816566619 632486731 /nfs/dbraw/zinc/48/67/31/632486731.db2.gz AOWBUTCGVJQMKE-UHFFFAOYSA-N -1 3 296.374 2.696 20 10 CFCDHM [O-]c1cc(F)c(Cl)cc1CN1CC([C@H]2CCOC2)C1 ZINC000816594644 632492166 /nfs/dbraw/zinc/49/21/66/632492166.db2.gz KRKOZHXHOSHFSD-VIFPVBQESA-N -1 3 285.746 2.653 20 10 CFCDHM Cc1cccc(CN(C)C(=O)c2cccc(O)c2[O-])c1C ZINC000816788455 632522797 /nfs/dbraw/zinc/52/27/97/632522797.db2.gz HXPGDWBEUZHJTO-UHFFFAOYSA-N -1 3 285.343 2.987 20 10 CFCDHM CC(C)(NC(=O)c1cccc(O)c1[O-])c1ccccc1F ZINC000817039427 632548641 /nfs/dbraw/zinc/54/86/41/632548641.db2.gz VHMVXYZFGVSHRK-UHFFFAOYSA-N -1 3 289.306 2.902 20 10 CFCDHM C[C@@H]1CC[C@H](O)CN1Cc1cc(Cl)cc(F)c1[O-] ZINC000817414553 632625176 /nfs/dbraw/zinc/62/51/76/632625176.db2.gz LLEMKXQIXHHPJU-KCJUWKMLSA-N -1 3 273.735 2.530 20 10 CFCDHM CN(Cc1c(F)cccc1F)C(=O)c1cccc(O)c1[O-] ZINC000818545980 632863568 /nfs/dbraw/zinc/86/35/68/632863568.db2.gz RRHWNQJUOHRVAQ-UHFFFAOYSA-N -1 3 293.269 2.648 20 10 CFCDHM Cc1cc([O-])c([C@@H]2NC(=O)[C@@H]3C[C@@H](C)CCN23)cc1Cl ZINC000849183460 633580220 /nfs/dbraw/zinc/58/02/20/633580220.db2.gz TVBGQPRACAOPQY-ORUWWINDSA-N -1 3 294.782 2.583 20 10 CFCDHM CCN1C(=O)C(C)(C)N[C@@H]1c1cc(Cl)c(C)cc1[O-] ZINC000849183158 633580384 /nfs/dbraw/zinc/58/03/84/633580384.db2.gz QEJVMXYVHXORFC-LBPRGKRZSA-N -1 3 282.771 2.583 20 10 CFCDHM C[C@H](N[C@H]1C[C@@H](C)n2ncnc21)c1cc(F)cc(F)c1[O-] ZINC000850499097 634019056 /nfs/dbraw/zinc/01/90/56/634019056.db2.gz JJASTVQGMJDWRW-LWINAJNOSA-N -1 3 294.305 2.619 20 10 CFCDHM C[C@@H](N[C@@H](C)c1ccc(F)cc1[O-])c1nccn1C ZINC000850571985 634057446 /nfs/dbraw/zinc/05/74/46/634057446.db2.gz FXAZUCYWWPVFRQ-VHSXEESVSA-N -1 3 263.316 2.677 20 10 CFCDHM O=C(NCc1cc2ccccc2o1)c1cccc(O)c1[O-] ZINC000188197237 650317889 /nfs/dbraw/zinc/31/78/89/650317889.db2.gz QCZRKMVMXOWRAP-UHFFFAOYSA-N -1 3 283.283 2.774 20 10 CFCDHM Cc1ccccc1C[C@H](C)NC(=O)c1cccc(O)c1[O-] ZINC000192987459 650613869 /nfs/dbraw/zinc/61/38/69/650613869.db2.gz VSKKMNGSTCUKEB-LBPRGKRZSA-N -1 3 285.343 2.767 20 10 CFCDHM COc1cc(F)c(NC(=O)c2cccc(O)c2[O-])cc1F ZINC000193133104 650625625 /nfs/dbraw/zinc/62/56/25/650625625.db2.gz ZAGJHBDSLQMPCZ-UHFFFAOYSA-N -1 3 295.241 2.637 20 10 CFCDHM COc1ccc(C)cc1NC(=O)c1cccc(O)c1[O-] ZINC000126210976 643051203 /nfs/dbraw/zinc/05/12/03/643051203.db2.gz KUPXXYNBTLOVAL-UHFFFAOYSA-N -1 3 273.288 2.667 20 10 CFCDHM Cc1cccc(C)c1NC(=O)c1cccc(O)c1[O-] ZINC000126230439 643056994 /nfs/dbraw/zinc/05/69/94/643056994.db2.gz WOZNBCPTRXVHET-UHFFFAOYSA-N -1 3 257.289 2.967 20 10 CFCDHM CCN(Cc1ccccc1)C(=O)c1cccc(O)c1[O-] ZINC000126241774 643075600 /nfs/dbraw/zinc/07/56/00/643075600.db2.gz IWKNZNZZMZIXHQ-UHFFFAOYSA-N -1 3 271.316 2.760 20 10 CFCDHM CC1(NCc2cc(Cl)cc(Cl)c2[O-])COC1 ZINC000877691739 643457474 /nfs/dbraw/zinc/45/74/74/643457474.db2.gz UVVKAUBOSUDIOD-UHFFFAOYSA-N -1 3 262.136 2.578 20 10 CFCDHM C[C@H]1C[C@@H](NCc2cc(F)cc(F)c2[O-])c2nccn21 ZINC000883135901 645621398 /nfs/dbraw/zinc/62/13/98/645621398.db2.gz PLJSQQOMDXILIR-QPUJVOFHSA-N -1 3 279.290 2.663 20 10 CFCDHM Cc1nccnc1[C@H](C)NCc1cc(F)cc(F)c1[O-] ZINC000883203995 645662396 /nfs/dbraw/zinc/66/23/96/645662396.db2.gz QCFQXGQIANZWJX-VIFPVBQESA-N -1 3 279.290 2.620 20 10 CFCDHM Cc1ccc(C(=O)Nc2cnn(C3CCC3)c2)c([O-])c1O ZINC000889058016 646069018 /nfs/dbraw/zinc/06/90/18/646069018.db2.gz GXKIUJRMGLIUNY-UHFFFAOYSA-N -1 3 287.319 2.580 20 10 CFCDHM Cc1cc(CN[C@H](C)c2c([O-])cccc2F)on1 ZINC000886522674 647027872 /nfs/dbraw/zinc/02/78/72/647027872.db2.gz OSEWLTAXTCRJRQ-SECBINFHSA-N -1 3 250.273 2.679 20 10 CFCDHM C[C@H](NCc1csc(N(C)C)n1)c1c([O-])cccc1F ZINC000886534801 647034204 /nfs/dbraw/zinc/03/42/04/647034204.db2.gz OSFMTCYBSFDWSB-VIFPVBQESA-N -1 3 295.383 2.905 20 10 CFCDHM C[C@H](N[C@@H](CO)c1ccccc1)c1c([O-])cccc1F ZINC000886540938 647037632 /nfs/dbraw/zinc/03/76/32/647037632.db2.gz NEIKTOPTLJCQJA-FZMZJTMJSA-N -1 3 275.323 2.916 20 10 CFCDHM C[C@H](NCc1ncccc1N(C)C)c1c([O-])cccc1F ZINC000886612061 647066616 /nfs/dbraw/zinc/06/66/16/647066616.db2.gz ATPKWMJAMYSTBK-NSHDSACASA-N -1 3 289.354 2.843 20 10 CFCDHM CC(C)c1nnc(CN[C@H](C)c2c([O-])cccc2F)[nH]1 ZINC000886617269 647069832 /nfs/dbraw/zinc/06/98/32/647069832.db2.gz JCXBAWIEHQJMCS-SECBINFHSA-N -1 3 278.331 2.624 20 10 CFCDHM O=C(NCc1c([O-])cccc1F)C(F)=C1CCC1 ZINC000928705279 648944966 /nfs/dbraw/zinc/94/49/66/648944966.db2.gz FTNLZIUVOQWYSZ-UHFFFAOYSA-N -1 3 253.248 2.555 20 10 CFCDHM O=C(NCc1c([O-])cccc1F)C1(C2CC2)CCC1 ZINC000928709553 648945970 /nfs/dbraw/zinc/94/59/70/648945970.db2.gz JNOHFOZCGFWARG-UHFFFAOYSA-N -1 3 263.312 2.728 20 10 CFCDHM CC1(C(=O)NCc2c([O-])cccc2F)CC(F)(F)C1 ZINC000928709840 648946172 /nfs/dbraw/zinc/94/61/72/648946172.db2.gz MIZFGLBKTOHXGB-UHFFFAOYSA-N -1 3 273.254 2.583 20 10 CFCDHM CC(C)(C(=O)NCc1c([O-])cccc1F)[C@H]1CCCCO1 ZINC000928710679 648946708 /nfs/dbraw/zinc/94/67/08/648946708.db2.gz VQPZVTSELZIZCS-CQSZACIVSA-N -1 3 295.354 2.743 20 10 CFCDHM O=C(NCc1c([O-])cccc1F)C1(C(F)F)CCC1 ZINC000928710656 648946801 /nfs/dbraw/zinc/94/68/01/648946801.db2.gz VLOZVUKLIFBYJB-UHFFFAOYSA-N -1 3 273.254 2.583 20 10 CFCDHM [O-]c1c(Cl)cc(F)cc1CN1CCN(C2CCC2)CC1 ZINC001237807860 779719050 /nfs/dbraw/zinc/71/90/50/779719050.db2.gz NJDDVTGATPGWRD-UHFFFAOYSA-N -1 3 298.789 2.855 20 10 CFCDHM CC1(c2ccccc2)CN(C(=O)c2cccc(O)c2[O-])C1 ZINC001167576809 770925359 /nfs/dbraw/zinc/92/53/59/770925359.db2.gz LPDCZULYKOCVLP-UHFFFAOYSA-N -1 3 283.327 2.512 20 10 CFCDHM CO[C@@H]1CCN(Cc2c([O-])cc(F)cc2F)[C@H](C)C1 ZINC001140584648 770970308 /nfs/dbraw/zinc/97/03/08/770970308.db2.gz ACIHOIZFMAYEFY-MWLCHTKSSA-N -1 3 271.307 2.670 20 10 CFCDHM CC(C)[C@H]1CCCN(C(=O)c2cccc(O)c2[O-])C1 ZINC000694434565 775484175 /nfs/dbraw/zinc/48/41/75/775484175.db2.gz OQXLHNJEWWZNFR-NSHDSACASA-N -1 3 263.337 2.606 20 10 CFCDHM O=C([O-])c1ccc(C[N@@H+]2CCC[C@H]2c2cccnc2)c([O-])c1 ZINC001231446462 777220399 /nfs/dbraw/zinc/22/03/99/777220399.db2.gz JHKNTZXXLGAWBS-HNNXBMFYSA-N -1 3 298.342 2.823 20 10 CFCDHM O=C([O-])c1ccc(C[N@H+]2CCC[C@H]2c2cccnc2)c([O-])c1 ZINC001231446462 777220409 /nfs/dbraw/zinc/22/04/09/777220409.db2.gz JHKNTZXXLGAWBS-HNNXBMFYSA-N -1 3 298.342 2.823 20 10 CFCDHM C[C@H]1C[N@H+](Cc2ccc(C(=O)[O-])cc2[O-])CCC1(F)F ZINC001231447307 777221023 /nfs/dbraw/zinc/22/10/23/777221023.db2.gz RNUUSXNFDFNDQM-VIFPVBQESA-N -1 3 285.290 2.568 20 10 CFCDHM C[C@H]1C[N@@H+](Cc2ccc(C(=O)[O-])cc2[O-])CCC1(F)F ZINC001231447307 777221029 /nfs/dbraw/zinc/22/10/29/777221029.db2.gz RNUUSXNFDFNDQM-VIFPVBQESA-N -1 3 285.290 2.568 20 10 CFCDHM O=C([O-])c1ccc([O-])c(C[N@@H+]2CCC3(CCCC3)C2)c1 ZINC001231565523 777261326 /nfs/dbraw/zinc/26/13/26/777261326.db2.gz ZPXKRGBRIYUDLR-UHFFFAOYSA-N -1 3 275.348 2.857 20 10 CFCDHM O=C([O-])c1ccc([O-])c(C[N@H+]2CCC3(CCCC3)C2)c1 ZINC001231565523 777261328 /nfs/dbraw/zinc/26/13/28/777261328.db2.gz ZPXKRGBRIYUDLR-UHFFFAOYSA-N -1 3 275.348 2.857 20 10 CFCDHM Cc1cc([O-])c(CN2CCC(=O)C[C@H]2C)cc1Cl ZINC001231867465 777357019 /nfs/dbraw/zinc/35/70/19/777357019.db2.gz KUUZHXQTYKFMGV-SNVBAGLBSA-N -1 3 267.756 2.907 20 10 CFCDHM CCN(Cc1cc(Cl)c(C)cc1[O-])[C@@H](C)C(=O)OC ZINC001231871269 777359089 /nfs/dbraw/zinc/35/90/89/777359089.db2.gz IIYPDHJXJJBHFP-JTQLQIEISA-N -1 3 285.771 2.737 20 10 CFCDHM Cc1cc([O-])c(CN2C[C@H](F)C[C@@H](CO)C2)cc1Cl ZINC001231869435 777359894 /nfs/dbraw/zinc/35/98/94/777359894.db2.gz QOIXJGPBTPJYGW-ZYHUDNBSSA-N -1 3 287.762 2.506 20 10 CFCDHM [O-]c1c(Cl)cccc1CN1CC(N2CCCCC2)C1 ZINC001231912480 777379889 /nfs/dbraw/zinc/37/98/89/777379889.db2.gz IPMBVQJKOBPOGY-UHFFFAOYSA-N -1 3 280.799 2.716 20 10 CFCDHM [O-]c1ccc(F)c(F)c1CN(CCO)Cc1ccccc1 ZINC001233331547 777890381 /nfs/dbraw/zinc/89/03/81/777890381.db2.gz AQBULIIOCCZLNJ-UHFFFAOYSA-N -1 3 293.313 2.665 20 10 CFCDHM [O-]c1ccc(F)c(F)c1CN1CC(c2cccnc2)C1 ZINC001233335026 777893427 /nfs/dbraw/zinc/89/34/27/777893427.db2.gz DVZZMDPXOWOYGP-UHFFFAOYSA-N -1 3 276.286 2.665 20 10 CFCDHM CC(=O)[C@H]1CCN(Cc2cccc(C(F)(F)F)c2[O-])C1 ZINC001233419129 777944254 /nfs/dbraw/zinc/94/42/54/777944254.db2.gz KNSSYSFSYDSESH-JTQLQIEISA-N -1 3 287.281 2.822 20 10 CFCDHM [O-]c1cc(C(F)(F)F)ccc1CN1C[C@@H](F)[C@@H](F)C1 ZINC001233452050 777956940 /nfs/dbraw/zinc/95/69/40/777956940.db2.gz IRZJMZZQXLFGFI-AOOOYVTPSA-N -1 3 281.224 2.903 20 10 CFCDHM [O-]c1c(Br)cc(F)cc1CN1CCCC1 ZINC001235296489 778447815 /nfs/dbraw/zinc/44/78/15/778447815.db2.gz ILQHANMHPPDADQ-UHFFFAOYSA-N -1 3 274.133 2.890 20 10 CFCDHM C[C@@H]1CCN(Cc2c([O-])ccc(Cl)c2Cl)C[C@H]1O ZINC001237078695 779007833 /nfs/dbraw/zinc/00/78/33/779007833.db2.gz WJZKXPWEZVZZHA-PRHODGIISA-N -1 3 290.190 2.902 20 10 CFCDHM [O-]c1ccc(Cl)c(Cl)c1CN1CCN2CC[C@H]2C1 ZINC001237086720 779009017 /nfs/dbraw/zinc/00/90/17/779009017.db2.gz NWSWCUXVERTFFE-VIFPVBQESA-N -1 3 287.190 2.589 20 10 CFCDHM C[C@H]1COCCN(Cc2c([O-])ccc(F)c2Cl)C1 ZINC001237122770 779011670 /nfs/dbraw/zinc/01/16/70/779011670.db2.gz YMWRVUXFRUNVPF-SECBINFHSA-N -1 3 273.735 2.653 20 10 CFCDHM CCC1(O)CCN(Cc2c([O-])ccc(F)c2Cl)CC1 ZINC001237126439 779021619 /nfs/dbraw/zinc/02/16/19/779021619.db2.gz LCEVLYXIJAUTLP-UHFFFAOYSA-N -1 3 287.762 2.922 20 10 CFCDHM C[C@@H]1CN(Cc2cc(F)ccc2[O-])C[C@@](C)(C(F)F)O1 ZINC000698929143 779102564 /nfs/dbraw/zinc/10/25/64/779102564.db2.gz PAFYMRWDOPWBNC-OTYXRUKQSA-N -1 3 289.297 2.776 20 10 CFCDHM [O-]c1ccc(Cl)cc1CN1CCO[C@H](C(F)(F)F)C1 ZINC000698953925 779110557 /nfs/dbraw/zinc/11/05/57/779110557.db2.gz RIPMSROUGNKXNJ-NSHDSACASA-N -1 3 295.688 2.809 20 10 CFCDHM [O-]c1c(F)cc(Cl)cc1CN1CCCC[C@H](O)C1 ZINC001237617529 779144830 /nfs/dbraw/zinc/14/48/30/779144830.db2.gz SEGJPTXBCJFNMJ-NSHDSACASA-N -1 3 273.735 2.532 20 10 CFCDHM [O-]c1c(Cl)cc(F)cc1CN1CCC[C@H](CCO)C1 ZINC001237800383 779181639 /nfs/dbraw/zinc/18/16/39/779181639.db2.gz YGPFYGHWMJELPE-SNVBAGLBSA-N -1 3 287.762 2.779 20 10 CFCDHM COC[C@@H]1CCCN1Cc1cc(F)cc(Cl)c1[O-] ZINC001237804769 779183323 /nfs/dbraw/zinc/18/33/23/779183323.db2.gz GEQKEQLPIKRYST-NSHDSACASA-N -1 3 273.735 2.796 20 10 CFCDHM C[C@@H]1CC[C@H](O)CN1Cc1cc(F)cc(Cl)c1[O-] ZINC001237808667 779184730 /nfs/dbraw/zinc/18/47/30/779184730.db2.gz VSWKOCLJBUSXDN-KCJUWKMLSA-N -1 3 273.735 2.530 20 10 CFCDHM [O-]c1cc(Cl)c(F)cc1CN1CCSCC1 ZINC001237934193 779210322 /nfs/dbraw/zinc/21/03/22/779210322.db2.gz ISTJMPNAQWPCLM-UHFFFAOYSA-N -1 3 261.749 2.734 20 10 CFCDHM [O-]c1cc(Cl)c(F)cc1CN1CC2(CSC2)C1 ZINC001237941315 779210639 /nfs/dbraw/zinc/21/06/39/779210639.db2.gz VACPMJUCINEYNO-UHFFFAOYSA-N -1 3 273.760 2.734 20 10 CFCDHM [O-]c1cc(Cl)c(F)cc1CN1CC2(C1)CCCOC2 ZINC001237935533 779211062 /nfs/dbraw/zinc/21/10/62/779211062.db2.gz VSVIQJBMQFPHNL-UHFFFAOYSA-N -1 3 285.746 2.797 20 10 CFCDHM C[C@H]1CN(Cc2cc(F)c(Cl)cc2[O-])CCCO1 ZINC001237935816 779211569 /nfs/dbraw/zinc/21/15/69/779211569.db2.gz ZJRNHSOIIRVNNK-VIFPVBQESA-N -1 3 273.735 2.796 20 10 CFCDHM [O-]c1cc(Cl)c(Cl)cc1CN1CCC[C@H](O)C1 ZINC001236794159 779638917 /nfs/dbraw/zinc/63/89/17/779638917.db2.gz QGBILEZTPCQUBJ-VIFPVBQESA-N -1 3 276.163 2.656 20 10 CFCDHM [O-]c1cccc(F)c1CN1CCC[C@@H]1c1cnccn1 ZINC001137837460 781139711 /nfs/dbraw/zinc/13/97/11/781139711.db2.gz HWAKWHTWMXQDDO-CQSZACIVSA-N -1 3 273.311 2.658 20 10 CFCDHM [O-]c1c(F)cc(F)cc1CN1CCO[C@H](C(F)F)CC1 ZINC000708412122 781274076 /nfs/dbraw/zinc/27/40/76/781274076.db2.gz GDZKTPAHBHRFMV-NSHDSACASA-N -1 3 293.260 2.526 20 10 CFCDHM C[C@H](NCc1cc(F)cc(F)c1[O-])c1ccns1 ZINC000708432818 781275382 /nfs/dbraw/zinc/27/53/82/781275382.db2.gz DAWZDYYPKVFYDY-ZETCQYMHSA-N -1 3 270.304 2.978 20 10 CFCDHM [O-]c1c(Cl)cc(Cl)cc1CN1CCC[C@@H]1CO ZINC000092470899 347627994 /nfs/dbraw/zinc/62/79/94/347627994.db2.gz DSNAVUOCTMDEEH-SNVBAGLBSA-N -1 3 276.163 2.656 20 10 CFCDHM Cc1nn(C)c(C)c1CN[C@@H](C)c1ccc(F)cc1[O-] ZINC000092324700 375101269 /nfs/dbraw/zinc/10/12/69/375101269.db2.gz VMIOVAWDJIHJTL-VIFPVBQESA-N -1 3 277.343 2.732 20 10 CFCDHM CC(C)C[C@@H](C)N(C)C(=O)CN(C)Cc1ccccc1[O-] ZINC000111235007 375833574 /nfs/dbraw/zinc/83/35/74/375833574.db2.gz INNNWVPTWNBJJS-CQSZACIVSA-N -1 3 292.423 2.717 20 10 CFCDHM CN(CC1CCCCC1)C(=O)c1cccc(O)c1[O-] ZINC000126290440 377221537 /nfs/dbraw/zinc/22/15/37/377221537.db2.gz LEUKTQZYDXDDIV-UHFFFAOYSA-N -1 3 263.337 2.750 20 10 CFCDHM CN(Cc1cc(Cl)cc(Cl)c1[O-])[C@@H]1CCOC1 ZINC000156096818 378635196 /nfs/dbraw/zinc/63/51/96/378635196.db2.gz FWHQHELZPBGOLT-SNVBAGLBSA-N -1 3 276.163 2.920 20 10 CFCDHM CCN(Cc1cc(Br)ccc1[O-])C(=O)C1CC1 ZINC000175848122 380142861 /nfs/dbraw/zinc/14/28/61/380142861.db2.gz SRSQPQDIQISIIY-UHFFFAOYSA-N -1 3 298.180 2.913 20 10 CFCDHM COC[C@@H]1CCCN(Cc2cc(F)cc(C(C)=O)c2[O-])C1 ZINC000177285113 380326165 /nfs/dbraw/zinc/32/61/65/380326165.db2.gz KTOMIOZLBDBYSD-GFCCVEGCSA-N -1 3 295.354 2.592 20 10 CFCDHM Cc1ccc(CN(C)C(=O)c2ccc(C)c(O)c2[O-])o1 ZINC000177659118 380363814 /nfs/dbraw/zinc/36/38/14/380363814.db2.gz IRSUZYIVGDFPSG-UHFFFAOYSA-N -1 3 275.304 2.580 20 10 CFCDHM Cc1ccc(C(=O)N(C)C(C2CC2)C2CC2)c([O-])c1O ZINC000179464277 380546806 /nfs/dbraw/zinc/54/68/06/380546806.db2.gz FRWNPTIUVIKXEJ-UHFFFAOYSA-N -1 3 275.348 2.667 20 10 CFCDHM COCCCOCCN(C)Cc1cccc(Cl)c1[O-] ZINC000181524517 380818009 /nfs/dbraw/zinc/81/80/09/380818009.db2.gz WXKJPGZNHYDQRU-UHFFFAOYSA-N -1 3 287.787 2.531 20 10 CFCDHM CC[C@H](NCc1cc(C)nn1C)c1ccc(F)cc1[O-] ZINC000287591175 380878350 /nfs/dbraw/zinc/87/83/50/380878350.db2.gz ROIQYINPCMFVSY-AWEZNQCLSA-N -1 3 277.343 2.814 20 10 CFCDHM Cc1ccc(C(=O)N2CC[C@H](C)C[C@H](C)C2)c([O-])c1O ZINC000182891143 381179160 /nfs/dbraw/zinc/17/91/60/381179160.db2.gz SFZWAKBQTYJGRE-QWRGUYRKSA-N -1 3 277.364 2.914 20 10 CFCDHM Cc1ccc(C(=O)N2CC[C@@H](C)[C@H](C)C2)c([O-])c1O ZINC000182964934 381190598 /nfs/dbraw/zinc/19/05/98/381190598.db2.gz VJUOADXRHMLUPQ-MWLCHTKSSA-N -1 3 263.337 2.524 20 10 CFCDHM O=C(c1cccc(O)c1[O-])N1C[C@@H]2CCCCCC[C@H]21 ZINC000365759058 382438598 /nfs/dbraw/zinc/43/85/98/382438598.db2.gz QUTDMDPWOJXDKU-WCQYABFASA-N -1 3 275.348 2.893 20 10 CFCDHM C[C@@H](C1CC1)n1nccc1NC(=O)c1cccc(O)c1[O-] ZINC000188375895 382402715 /nfs/dbraw/zinc/40/27/15/382402715.db2.gz DQBHMUBCPYDLCI-VIFPVBQESA-N -1 3 287.319 2.518 20 10 CFCDHM COc1ccncc1CN[C@@H](C)c1ccc(F)cc1[O-] ZINC000294488426 382514433 /nfs/dbraw/zinc/51/44/33/382514433.db2.gz XSNQJVCLNVMKQW-JTQLQIEISA-N -1 3 276.311 2.786 20 10 CFCDHM CCC[C@H](C)N(C)C(=O)c1ccc(C)c(O)c1[O-] ZINC000267570985 384416282 /nfs/dbraw/zinc/41/62/82/384416282.db2.gz IPLROYXURVGVRM-JTQLQIEISA-N -1 3 251.326 2.667 20 10 CFCDHM C[C@H](NCc1ncnn1C(C)(C)C)c1ccc(F)cc1[O-] ZINC000282775408 385386973 /nfs/dbraw/zinc/38/69/73/385386973.db2.gz PFXLBILUGKRVPW-JTQLQIEISA-N -1 3 292.358 2.729 20 10 CFCDHM CCCc1nnc(NCc2c([O-])cccc2Cl)o1 ZINC000271971172 385414935 /nfs/dbraw/zinc/41/49/35/385414935.db2.gz JNUCQPOMGTYKLB-UHFFFAOYSA-N -1 3 267.716 2.993 20 10 CFCDHM CC(C)(C)OC(=O)[C@@H]1CCN(Cc2cccc(F)c2[O-])C1 ZINC000272331311 385511730 /nfs/dbraw/zinc/51/17/30/385511730.db2.gz WNBPFGUNIPOXDJ-GFCCVEGCSA-N -1 3 295.354 2.695 20 10 CFCDHM C[C@H](O)[C@H]1CCN(Cc2cc(Cl)cc(Cl)c2[O-])C1 ZINC000272492136 385551286 /nfs/dbraw/zinc/55/12/86/385551286.db2.gz DXRVIPGVYURWLV-IUCAKERBSA-N -1 3 290.190 2.902 20 10 CFCDHM Cc1ccc(C(=O)N(C)C2Cc3ccccc3C2)c([O-])c1O ZINC000272890038 385642724 /nfs/dbraw/zinc/64/27/24/385642724.db2.gz ZCTTXEOZXCTGKT-UHFFFAOYSA-N -1 3 297.354 2.646 20 10 CFCDHM CCn1cnnc1CN[C@@H](C)c1cc(Cl)ccc1[O-] ZINC000273371020 385678957 /nfs/dbraw/zinc/67/89/57/385678957.db2.gz GFEHAHQRRQMENO-VIFPVBQESA-N -1 3 280.759 2.508 20 10 CFCDHM CCCCc1nnc(NC(=O)c2cccc(O)c2[O-])s1 ZINC000186857211 393549714 /nfs/dbraw/zinc/54/97/14/393549714.db2.gz CTZAVELEXFPCAS-UHFFFAOYSA-N -1 3 293.348 2.544 20 10 CFCDHM C[C@H]1CCN(C(=O)C=Cc2c[nH]cn2)c2c([O-])cccc21 ZINC000283228940 394130314 /nfs/dbraw/zinc/13/03/14/394130314.db2.gz STLWQUCOWFMYRS-QRGHLMKCSA-N -1 3 283.331 2.669 20 10 CFCDHM Cc1ccc(C(=O)N2CC(C)(C)[C@@H]2C2CC2)c([O-])c1O ZINC000291967757 292049591 /nfs/dbraw/zinc/04/95/91/292049591.db2.gz SLZRKKFIAKSFFB-AWEZNQCLSA-N -1 3 275.348 2.667 20 10 CFCDHM COc1cc(Cl)cc(CN2CCOC[C@H](C)C2)c1[O-] ZINC000360334049 286223205 /nfs/dbraw/zinc/22/32/05/286223205.db2.gz JUSBWZAXWXWKHS-SNVBAGLBSA-N -1 3 285.771 2.523 20 10 CFCDHM O=C(Nc1ccc2[nH]ccc2c1)c1cccc(O)c1[O-] ZINC000072106125 176316514 /nfs/dbraw/zinc/31/65/14/176316514.db2.gz XPGCANYDXSFIBT-UHFFFAOYSA-N -1 3 268.272 2.831 20 10 CFCDHM CC(=O)c1cc(Cl)cc(CN(C)C2CC2)c1[O-] ZINC000037322961 260159789 /nfs/dbraw/zinc/15/97/89/260159789.db2.gz YNZUPYHOCNDLBO-UHFFFAOYSA-N -1 3 253.729 2.842 20 10 CFCDHM CC[C@@H]1CCCCN1C(=O)c1ccc(C)c(O)c1[O-] ZINC000177667440 280245993 /nfs/dbraw/zinc/24/59/93/280245993.db2.gz JLKFHOYHBCAXSK-LLVKDONJSA-N -1 3 263.337 2.811 20 10 CFCDHM C[C@@H]1CSCCN1Cc1cccc(Cl)c1[O-] ZINC000180246614 297182385 /nfs/dbraw/zinc/18/23/85/297182385.db2.gz HXAXGXVVXTZPEK-SECBINFHSA-N -1 3 257.786 2.983 20 10 CFCDHM CC(C)c1ncc2c(n1)CCN(Cc1ccccc1[O-])C2 ZINC000527620232 330265929 /nfs/dbraw/zinc/26/59/29/330265929.db2.gz ZJFGGTPSTWKLIK-UHFFFAOYSA-N -1 3 283.375 2.864 20 10 CFCDHM CCn1ncc(CN[C@@H](C)c2cc(Cl)cc(C)c2[O-])n1 ZINC000527924553 330296296 /nfs/dbraw/zinc/29/62/96/330296296.db2.gz QIPHKHWPJJTHES-JTQLQIEISA-N -1 3 294.786 2.816 20 10 CFCDHM Cc1ccc(C(=O)NC[C@@H]2CC[C@@H]3C[C@@H]3C2)c([O-])c1O ZINC000529577134 333499112 /nfs/dbraw/zinc/49/91/12/333499112.db2.gz JIEOEGCMTZCYKA-UTUOFQBUSA-N -1 3 275.348 2.572 20 10 CFCDHM CC(=O)c1cc(F)cc(CN(C)[C@@H]2CCSC2)c1[O-] ZINC000050133422 518283100 /nfs/dbraw/zinc/28/31/00/518283100.db2.gz ZFKDIFOQMXQOOU-GFCCVEGCSA-N -1 3 283.368 2.671 20 10 CFCDHM CC(C)(C)[C@H]1CCCN(C(=O)c2cccc(O)c2[O-])C1 ZINC000280547370 518974118 /nfs/dbraw/zinc/97/41/18/518974118.db2.gz NLRSCFWBGOBQHB-NSHDSACASA-N -1 3 277.364 2.996 20 10 CFCDHM COC(=O)c1cc(CN(C)Cc2ccccc2[O-])oc1C ZINC000264704108 521835621 /nfs/dbraw/zinc/83/56/21/521835621.db2.gz KKJZSEVNRDOMSB-UHFFFAOYSA-N -1 3 289.331 2.712 20 10 CFCDHM C[C@@H]1CN(Cc2cc(Cl)cc(Cl)c2[O-])C[C@H]1CO ZINC000191732139 524985685 /nfs/dbraw/zinc/98/56/85/524985685.db2.gz JKPWTIVCJWKEEK-SCZZXKLOSA-N -1 3 290.190 2.759 20 10 CFCDHM COc1ncccc1CN[C@@H](C)c1ccc(F)cc1[O-] ZINC000062747642 525059076 /nfs/dbraw/zinc/05/90/76/525059076.db2.gz VQJCEBRYMIIFEL-JTQLQIEISA-N -1 3 276.311 2.786 20 10 CFCDHM C[C@@H](N[C@@H](C)c1ccc(F)cc1[O-])c1cnn(C)c1 ZINC000273611018 525609878 /nfs/dbraw/zinc/60/98/78/525609878.db2.gz VVGYAQHCEYXGHN-ZJUUUORDSA-N -1 3 263.316 2.677 20 10 CFCDHM Cn1ncc2c1CCC[C@@H]2NCc1cccc(Cl)c1[O-] ZINC000158104612 527578383 /nfs/dbraw/zinc/57/83/83/527578383.db2.gz VVZOWSZZGQBVRX-ZDUSSCGKSA-N -1 3 291.782 2.946 20 10 CFCDHM O=C(OCCc1ccc2c(c1)CCO2)c1cc([O-])cs1 ZINC000745003069 574096607 /nfs/dbraw/zinc/09/66/07/574096607.db2.gz VWVDEUNVWTWTCP-UHFFFAOYSA-N -1 3 290.340 2.788 20 10 CFCDHM Cc1ccccc1CCNC(=O)c1cc([O-])cs1 ZINC000731864405 574130916 /nfs/dbraw/zinc/13/09/16/574130916.db2.gz UPZIBOFCJOPYNA-UHFFFAOYSA-N -1 3 261.346 2.735 20 10 CFCDHM C[C@H]1CCCC[C@H]1OCCNC(=O)c1cc([O-])cs1 ZINC000731870223 574131134 /nfs/dbraw/zinc/13/11/34/574131134.db2.gz VNIFANXQKKWLDC-CMPLNLGQSA-N -1 3 283.393 2.779 20 10 CFCDHM C[C@@H](COc1cccc(F)c1)NC(=O)c1cc([O-])cs1 ZINC000731870551 574131189 /nfs/dbraw/zinc/13/11/89/574131189.db2.gz PSAIPZDRUIICDM-VIFPVBQESA-N -1 3 295.335 2.790 20 10 CFCDHM C[C@@H](CNC(=O)c1cc([O-])cs1)N(C)c1ccccc1 ZINC000731869379 574132630 /nfs/dbraw/zinc/13/26/30/574132630.db2.gz GGVHMMZDYRGITP-NSHDSACASA-N -1 3 290.388 2.708 20 10 CFCDHM CN(CC(=O)Nc1ccccc1F)Cc1ccccc1[O-] ZINC000732203185 574145814 /nfs/dbraw/zinc/14/58/14/574145814.db2.gz OHRLWORXCANEFM-UHFFFAOYSA-N -1 3 288.322 2.602 20 10 CFCDHM O=C(c1cc([O-])cs1)N1CCC[C@H]1c1cccnc1 ZINC000732267109 574148034 /nfs/dbraw/zinc/14/80/34/574148034.db2.gz CARPDXJNCGUFOZ-LBPRGKRZSA-N -1 3 274.345 2.826 20 10 CFCDHM COc1ccc(CCCNC(=O)c2cc([O-])cs2)cc1 ZINC000732275173 574149370 /nfs/dbraw/zinc/14/93/70/574149370.db2.gz FZRLAGKAQRRZHH-UHFFFAOYSA-N -1 3 291.372 2.825 20 10 CFCDHM C[C@@H](Cc1ccsc1)NC(=O)c1cc([O-])cs1 ZINC000732276913 574149478 /nfs/dbraw/zinc/14/94/78/574149478.db2.gz WOARRYKGHCDDFU-QMMMGPOBSA-N -1 3 267.375 2.876 20 10 CFCDHM O=C(NCc1ccccc1O)c1ccc2c(c1[O-])CCCC2 ZINC000755514804 574166882 /nfs/dbraw/zinc/16/68/82/574166882.db2.gz IUKWYNVGVXRGMP-UHFFFAOYSA-N -1 3 297.354 2.907 20 10 CFCDHM Cc1cc([O-])c(C[NH+]2CCC3(C[C@@H]3C(=O)[O-])CC2)cc1C ZINC000738464029 574170263 /nfs/dbraw/zinc/17/02/63/574170263.db2.gz XFHYZBUVQWIOOM-CQSZACIVSA-N -1 3 289.375 2.696 20 10 CFCDHM CCOc1ccc(CN[C@H](C)C(=O)OC(C)(C)C)c([O-])c1 ZINC000733332321 574223095 /nfs/dbraw/zinc/22/30/95/574223095.db2.gz ZDCGGQTYZIFOGE-LLVKDONJSA-N -1 3 295.379 2.611 20 10 CFCDHM Cc1cccc(CN[C@H](C)c2cc([N+](=O)[O-])ccc2[O-])n1 ZINC000756445040 574238267 /nfs/dbraw/zinc/23/82/67/574238267.db2.gz XQZURVATETXTEC-LLVKDONJSA-N -1 3 287.319 2.855 20 10 CFCDHM O=C(OCc1cccc2c1OCCO2)c1cc([O-])cs1 ZINC000733497356 574242320 /nfs/dbraw/zinc/24/23/20/574242320.db2.gz UKWVQIGLCVTXMF-UHFFFAOYSA-N -1 3 292.312 2.582 20 10 CFCDHM CN1CCN(C(=O)c2cc([O-])cs2)C2(CCCCC2)C1 ZINC000748380065 574249978 /nfs/dbraw/zinc/24/99/78/574249978.db2.gz SPNBYEADFCNWGD-UHFFFAOYSA-N -1 3 294.420 2.544 20 10 CFCDHM C[C@@H]1C[C@H](NCc2ccon2)c2c1c(F)ccc2[O-] ZINC000756635502 574253975 /nfs/dbraw/zinc/25/39/75/574253975.db2.gz GBXJQIGDSLDTEM-KCJUWKMLSA-N -1 3 262.284 2.857 20 10 CFCDHM CCOC(=O)CCCCCOC(=O)c1cc([O-])cs1 ZINC000735535655 574328816 /nfs/dbraw/zinc/32/88/16/574328816.db2.gz JYFRUCVHIDJDMM-UHFFFAOYSA-N -1 3 286.349 2.734 20 10 CFCDHM C[C@]1(c2ccccc2)C[C@@H]1NC(=O)c1cc([O-])cs1 ZINC000743641974 574370042 /nfs/dbraw/zinc/37/00/42/574370042.db2.gz LICSAFGVSLICFC-DZGCQCFKSA-N -1 3 273.357 2.914 20 10 CFCDHM O=C(c1cc([O-])cs1)N1CCC[C@H]2CCC[C@@H]21 ZINC000743707412 574371098 /nfs/dbraw/zinc/37/10/98/574371098.db2.gz GMBAUAFBGSJBBT-KOLCDFICSA-N -1 3 251.351 2.858 20 10 CFCDHM Cc1ccc(C(=O)NCc2cc3ccccc3[nH]2)c([O-])c1O ZINC000751533563 574378617 /nfs/dbraw/zinc/37/86/17/574378617.db2.gz AFXDTXURUZMQAW-UHFFFAOYSA-N -1 3 296.326 2.818 20 10 CFCDHM C[C@H](C[C@@H](O)c1cccs1)NC(=O)c1cc([O-])cs1 ZINC000752631008 574393207 /nfs/dbraw/zinc/39/32/07/574393207.db2.gz PGIXWHQRAKCCIS-PSASIEDQSA-N -1 3 297.401 2.757 20 10 CFCDHM Cc1ccc(C(=O)N2CC[C@@H](C(C)(C)C)C2)c([O-])c1O ZINC000753229931 574400463 /nfs/dbraw/zinc/40/04/63/574400463.db2.gz SJSDWZSRTMWXCX-LLVKDONJSA-N -1 3 277.364 2.914 20 10 CFCDHM Fc1cccc(Sc2nccs2)c1-c1nnn[n-]1 ZINC000737662708 598241242 /nfs/dbraw/zinc/24/12/42/598241242.db2.gz CZDLAKFHPPTFRD-UHFFFAOYSA-N -1 3 279.325 2.614 20 10 CFCDHM O=C([O-])NC1C[C@H]2CCC[C@@H](C1)[N@H+]2Cc1ccccc1[O-] ZINC000834162016 605586072 /nfs/dbraw/zinc/58/60/72/605586072.db2.gz MRLSQDPTDPCMDO-AGUYFDCRSA-N -1 3 290.363 2.545 20 10 CFCDHM O=C([O-])NC1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1[O-] ZINC000834162016 605586076 /nfs/dbraw/zinc/58/60/76/605586076.db2.gz MRLSQDPTDPCMDO-AGUYFDCRSA-N -1 3 290.363 2.545 20 10 CFCDHM C[C@H]1CCCC[C@]1(C)NC(=O)c1cccc(O)c1[O-] ZINC000308721304 617827124 /nfs/dbraw/zinc/82/71/24/617827124.db2.gz CUBYCYNETYRRKE-BONVTDFDSA-N -1 3 263.337 2.796 20 10 CFCDHM [O-]c1c(F)cc(F)cc1CN1CCC[C@@H](n2ccnc2)C1 ZINC000893994444 618261886 /nfs/dbraw/zinc/26/18/86/618261886.db2.gz MDSGPADLOKYSBX-CYBMUJFWSA-N -1 3 293.317 2.704 20 10 CFCDHM COc1ccc(NC(=O)c2ccc(C)c(O)c2[O-])cc1F ZINC000179434628 618274634 /nfs/dbraw/zinc/27/46/34/618274634.db2.gz ZCYCWYVURZZWPC-UHFFFAOYSA-N -1 3 291.278 2.806 20 10 CFCDHM Cc1cc([O-])c(CNCc2cc(C)ncn2)c(Cl)c1 ZINC000840907193 618414564 /nfs/dbraw/zinc/41/45/64/618414564.db2.gz NBMNJCTXUYZRDO-UHFFFAOYSA-N -1 3 277.755 2.742 20 10 CFCDHM [O-]c1ccc(Br)cc1CN1CC[C@H]1C(F)F ZINC000895437974 618585612 /nfs/dbraw/zinc/58/56/12/618585612.db2.gz XBCZAADFELVDBA-VIFPVBQESA-N -1 3 292.123 2.994 20 10 CFCDHM O=C([O-])CC[C@@H]1CCCC[N@@H+]1Cc1cc(F)ccc1[O-] ZINC000236423458 618621880 /nfs/dbraw/zinc/62/18/80/618621880.db2.gz LOAMTLHKEUHQQV-ZDUSSCGKSA-N -1 3 281.327 2.751 20 10 CFCDHM O=C([O-])CC[C@@H]1CCCC[N@H+]1Cc1cc(F)ccc1[O-] ZINC000236423458 618621885 /nfs/dbraw/zinc/62/18/85/618621885.db2.gz LOAMTLHKEUHQQV-ZDUSSCGKSA-N -1 3 281.327 2.751 20 10 CFCDHM Cc1cnc(CNCc2cc(Br)ccc2[O-])o1 ZINC000235954133 619193959 /nfs/dbraw/zinc/19/39/59/619193959.db2.gz NHQJKWOQWHQWTC-UHFFFAOYSA-N -1 3 297.152 2.741 20 10 CFCDHM COCCC1(C)CN(Cc2cc(F)cc(F)c2[O-])C1 ZINC000894980443 619521329 /nfs/dbraw/zinc/52/13/29/619521329.db2.gz PMHBBRXKOVQISJ-UHFFFAOYSA-N -1 3 271.307 2.529 20 10 CFCDHM [O-]c1ccc(Cl)cc1CNCc1nc(C(F)F)no1 ZINC000895727409 619592455 /nfs/dbraw/zinc/59/24/55/619592455.db2.gz RFSPYGSMUBPWTH-UHFFFAOYSA-N -1 3 289.669 2.656 20 10 CFCDHM CC(C)OC1CN(Cc2c([O-])cccc2Cl)C1 ZINC000895953415 619643686 /nfs/dbraw/zinc/64/36/86/619643686.db2.gz XQJYKHSLBKKPOQ-UHFFFAOYSA-N -1 3 255.745 2.655 20 10 CFCDHM COc1ccc(OC)c(CNCc2c([O-])cccc2F)c1 ZINC000896639124 619780865 /nfs/dbraw/zinc/78/08/65/619780865.db2.gz AQSUWPNTAUVNGW-UHFFFAOYSA-N -1 3 291.322 2.838 20 10 CFCDHM COc1cccc(CNCc2c([O-])cccc2F)c1OC ZINC000896641848 619782262 /nfs/dbraw/zinc/78/22/62/619782262.db2.gz UFLBHNASANOGIH-UHFFFAOYSA-N -1 3 291.322 2.838 20 10 CFCDHM C[C@H](CC(=O)NCc1c([O-])cccc1F)C(F)(F)F ZINC000928707662 619996293 /nfs/dbraw/zinc/99/62/93/619996293.db2.gz ABQFBJYUYUEMNY-SSDOTTSWSA-N -1 3 279.233 2.736 20 10 CFCDHM CC(C)(C)c1coc(NC(=O)c2cccc(O)c2[O-])n1 ZINC000898302135 620368142 /nfs/dbraw/zinc/36/81/42/620368142.db2.gz OYGDNLDBXDSBNJ-UHFFFAOYSA-N -1 3 276.292 2.636 20 10 CFCDHM CC(=O)c1cc(F)cc(CN2CC[C@H]2C(F)(F)F)c1[O-] ZINC000821269092 622881608 /nfs/dbraw/zinc/88/16/08/622881608.db2.gz CVQMAVQEFXEYSB-NSHDSACASA-N -1 3 291.244 2.871 20 10 CFCDHM [O-]c1c(CNC(CF)CF)ccc2ccccc21 ZINC000824554828 623523144 /nfs/dbraw/zinc/52/31/44/623523144.db2.gz NCHPGRVXHSRTGU-UHFFFAOYSA-N -1 3 251.276 2.943 20 10 CFCDHM Cc1cc([O-])c(CN2C[C@@H](C)OC[C@H]2C)cc1Cl ZINC000824576074 623526575 /nfs/dbraw/zinc/52/65/75/623526575.db2.gz ZNJVFCLHWGTHRC-GHMZBOCLSA-N -1 3 269.772 2.963 20 10 CFCDHM CCC[C@@H](C)NC(=O)NCc1c([O-])cccc1F ZINC000913850797 623620084 /nfs/dbraw/zinc/62/00/84/623620084.db2.gz RPYHOFVRBGHRNO-SECBINFHSA-N -1 3 254.305 2.519 20 10 CFCDHM CCC[C@H](C)NC(=O)NCc1c([O-])cccc1F ZINC000913850798 623620193 /nfs/dbraw/zinc/62/01/93/623620193.db2.gz RPYHOFVRBGHRNO-VIFPVBQESA-N -1 3 254.305 2.519 20 10 CFCDHM O=C(NCc1c([O-])cccc1F)NC(C1CC1)C1CC1 ZINC000913986589 623667260 /nfs/dbraw/zinc/66/72/60/623667260.db2.gz ZRXVPRCLZDCSDP-UHFFFAOYSA-N -1 3 278.327 2.519 20 10 CFCDHM Cc1cc([O-])c(CN(C2CC2)C2COC2)cc1Cl ZINC000826029883 623785104 /nfs/dbraw/zinc/78/51/04/623785104.db2.gz LTQMMRZCTDMSCX-UHFFFAOYSA-N -1 3 267.756 2.717 20 10 CFCDHM Cc1cc([O-])c(CN[C@H]2C[C@@H](C)n3ncnc32)cc1Cl ZINC000826887817 623902863 /nfs/dbraw/zinc/90/28/63/623902863.db2.gz AJQUEOVCZJGKQN-SKDRFNHKSA-N -1 3 292.770 2.741 20 10 CFCDHM C[C@@H]1CN(Cc2cc(Cl)cc(F)c2[O-])C[C@H](C)[C@H]1O ZINC000827151783 623954859 /nfs/dbraw/zinc/95/48/59/623954859.db2.gz JPLIXEWGNUYQDK-WOFXILAISA-N -1 3 287.762 2.633 20 10 CFCDHM Cc1nc(CN(C)Cc2c([O-])cc(C)cc2Cl)no1 ZINC000827898955 624124648 /nfs/dbraw/zinc/12/46/48/624124648.db2.gz XHAMLBHBJQXEGB-UHFFFAOYSA-N -1 3 281.743 2.677 20 10 CFCDHM [O-]c1cc(F)c(Cl)cc1CN1CCCc2n[nH]cc2C1 ZINC000828011094 624152974 /nfs/dbraw/zinc/15/29/74/624152974.db2.gz YVHMIXZKIFAMMB-UHFFFAOYSA-N -1 3 295.745 2.856 20 10 CFCDHM C[C@H]1CCC[C@H]1NC(=O)NCc1c([O-])cccc1F ZINC000917025355 624300740 /nfs/dbraw/zinc/30/07/40/624300740.db2.gz UOIDKXILSLSKLR-JOYOIKCWSA-N -1 3 266.316 2.519 20 10 CFCDHM C[C@@H]1C[C@@H]2C[C@@H]2C[C@H]1C(=O)NCc1c([O-])cccc1F ZINC000830181222 624659117 /nfs/dbraw/zinc/65/91/17/624659117.db2.gz YEJYRJAIJXSNJU-DDHJBXDOSA-N -1 3 277.339 2.830 20 10 CFCDHM CSC1(CNC(=O)NCc2c([O-])cccc2F)CCC1 ZINC000922242924 626249243 /nfs/dbraw/zinc/24/92/43/626249243.db2.gz ZFELERRBBYGPNZ-UHFFFAOYSA-N -1 3 298.383 2.616 20 10 CFCDHM [O-]c1c(F)cc(F)cc1CN[C@H](c1ncccn1)C1CC1 ZINC000922578081 626315225 /nfs/dbraw/zinc/31/52/25/626315225.db2.gz YGHBFCHAYDNRLF-ZDUSSCGKSA-N -1 3 291.301 2.701 20 10 CFCDHM CC(C)[C@@H]1C[C@H]1CNC(=O)NCc1c([O-])cccc1F ZINC000922734913 626356235 /nfs/dbraw/zinc/35/62/35/626356235.db2.gz UKEGHWQHMCWRCN-QWRGUYRKSA-N -1 3 280.343 2.623 20 10 CFCDHM O=C(N[C@@H](c1ccccc1)C1CC1)c1cccc(O)c1[O-] ZINC000186877550 626401690 /nfs/dbraw/zinc/40/16/90/626401690.db2.gz NVGUQKDUEVGLRP-HNNXBMFYSA-N -1 3 283.327 2.979 20 10 CFCDHM O=C(NCC1(c2ccccc2)CC1)c1cccc(O)c1[O-] ZINC000187205129 626480368 /nfs/dbraw/zinc/48/03/68/626480368.db2.gz GIMRRSFTLNNBSS-UHFFFAOYSA-N -1 3 283.327 2.559 20 10 CFCDHM C[C@H](N[C@@H](C)c1ccc(F)cc1[O-])c1ccn(C)n1 ZINC000840817842 626522446 /nfs/dbraw/zinc/52/24/46/626522446.db2.gz VOXYXEMVTNGBQD-UWVGGRQHSA-N -1 3 263.316 2.677 20 10 CFCDHM CC(=O)c1cc(F)cc(CN2CCOC(C)(C)[C@H]2C)c1[O-] ZINC000763418321 626987560 /nfs/dbraw/zinc/98/75/60/626987560.db2.gz DYMZDEKOHACYGM-LLVKDONJSA-N -1 3 295.354 2.733 20 10 CFCDHM CC(=O)c1cc(F)cc(CN(C)CCOC(C)(C)C)c1[O-] ZINC000767903608 627292985 /nfs/dbraw/zinc/29/29/85/627292985.db2.gz GVLGAXPFDQZGHD-UHFFFAOYSA-N -1 3 297.370 2.981 20 10 CFCDHM [O-]c1cccc(Cl)c1CN1CCC[C@H]1c1ncon1 ZINC000769233062 627414358 /nfs/dbraw/zinc/41/43/58/627414358.db2.gz QZODZTOXKXBMQN-NSHDSACASA-N -1 3 279.727 2.766 20 10 CFCDHM [O-]c1c(Cl)cccc1CN1CCCC[C@@H]1C1OCCO1 ZINC000775674448 628052877 /nfs/dbraw/zinc/05/28/77/628052877.db2.gz BSCVDNRMZLXFQL-CYBMUJFWSA-N -1 3 297.782 2.773 20 10 CFCDHM [O-]c1c(Cl)cccc1CN1CCC(O)(C(F)F)CC1 ZINC000779208848 628360590 /nfs/dbraw/zinc/36/05/90/628360590.db2.gz NZKPPJBTDQTJBZ-UHFFFAOYSA-N -1 3 291.725 2.638 20 10 CFCDHM Cn1ccc2ccc(NC(=O)c3cccc(O)c3[O-])cc21 ZINC000785748186 628910432 /nfs/dbraw/zinc/91/04/32/628910432.db2.gz QEMCBLMIHYZAGE-UHFFFAOYSA-N -1 3 282.299 2.842 20 10 CFCDHM CCN1CC(=O)N[C@@H]1c1cc(-c2ccccc2)ccc1[O-] ZINC000788689542 629092681 /nfs/dbraw/zinc/09/26/81/629092681.db2.gz GXRYMBSQZJKLFS-KRWDZBQOSA-N -1 3 282.343 2.510 20 10 CFCDHM Cc1nc2cc(NC(=O)c3cccc(O)c3[O-])ccc2[nH]1 ZINC000790496638 629243131 /nfs/dbraw/zinc/24/31/31/629243131.db2.gz XGEDUPGCCGOQDH-UHFFFAOYSA-N -1 3 283.287 2.535 20 10 CFCDHM Cc1cc(C)c(CNC(=O)c2cccc(O)c2[O-])c(C)c1 ZINC000790523691 629244841 /nfs/dbraw/zinc/24/48/41/629244841.db2.gz VDDWSCLHCVTMRO-UHFFFAOYSA-N -1 3 285.343 2.953 20 10 CFCDHM Cc1cc2c[nH]nc2cc1NC(=O)c1cccc(O)c1[O-] ZINC000790653230 629255300 /nfs/dbraw/zinc/25/53/00/629255300.db2.gz WYCGZCUSXQRTGS-UHFFFAOYSA-N -1 3 283.287 2.535 20 10 CFCDHM Cc1nc2cc(NC(=O)c3cccc(O)c3[O-])ccc2n1C ZINC000790810774 629265612 /nfs/dbraw/zinc/26/56/12/629265612.db2.gz RDPUJJFVDOBWLB-UHFFFAOYSA-N -1 3 297.314 2.545 20 10 CFCDHM CCc1cnccc1[C@@H](C)NC(=O)c1cccc(O)c1[O-] ZINC000790919013 629271522 /nfs/dbraw/zinc/27/15/22/629271522.db2.gz ZBUIKZXSLBHBOD-SNVBAGLBSA-N -1 3 286.331 2.546 20 10 CFCDHM CC[C@H](CC(F)(F)F)NC(=O)c1cccc(O)c1[O-] ZINC000790932262 629272347 /nfs/dbraw/zinc/27/23/47/629272347.db2.gz XHTMAPBMDNJRMM-SSDOTTSWSA-N -1 3 277.242 2.559 20 10 CFCDHM COc1ccc2c(c1NC(=O)c1cccc(O)c1[O-])CCC2 ZINC000791118710 629288317 /nfs/dbraw/zinc/28/83/17/629288317.db2.gz BJKWACUTXBTKSU-UHFFFAOYSA-N -1 3 299.326 2.847 20 10 CFCDHM [O-]c1ccc(Cl)c(F)c1CN(CCCO)C1CC1 ZINC000792164635 629403987 /nfs/dbraw/zinc/40/39/87/629403987.db2.gz AZMQLDTWMUKOJU-UHFFFAOYSA-N -1 3 273.735 2.532 20 10 CFCDHM C[C@@H](O)[C@@H]1CCCN(Cc2c([O-])ccc(Cl)c2F)C1 ZINC000792174329 629405632 /nfs/dbraw/zinc/40/56/32/629405632.db2.gz RYXQFFKBTMOITD-NXEZZACHSA-N -1 3 287.762 2.778 20 10 CFCDHM Cc1ccc(CN(CCO)Cc2cccc(Cl)c2[O-])o1 ZINC000793367301 629531838 /nfs/dbraw/zinc/53/18/38/629531838.db2.gz YKPSYVFBJPGJBG-UHFFFAOYSA-N -1 3 295.766 2.942 20 10 CFCDHM [O-]c1ccc2oc3c(c2c1CN1CCO[C@@H]2C[C@@H]21)CCCC3 ZINC000793624517 629580619 /nfs/dbraw/zinc/58/06/19/629580619.db2.gz XSGRMZDVPMLFTQ-SUMWQHHRSA-N -1 3 299.370 2.990 20 10 CFCDHM CC(C)(C)n1ncnc1CNCc1cc(Cl)ccc1[O-] ZINC000800293725 630367618 /nfs/dbraw/zinc/36/76/18/630367618.db2.gz ITXQVWAZOSUXQV-UHFFFAOYSA-N -1 3 294.786 2.682 20 10 CFCDHM Cc1cc([O-])c(CNCc2ccon2)c(Cl)c1 ZINC000840903319 631256979 /nfs/dbraw/zinc/25/69/79/631256979.db2.gz ZYIABVZLUINPQT-UHFFFAOYSA-N -1 3 252.701 2.632 20 10 CFCDHM CCn1ccc(CNCc2c([O-])cccc2Cl)n1 ZINC000840955925 631283127 /nfs/dbraw/zinc/28/31/27/631283127.db2.gz AVDPUHDRYQTNBK-UHFFFAOYSA-N -1 3 265.744 2.552 20 10 CFCDHM O=C([O-])[C@H]1CC[N@H+](Cc2cc(-c3ccccc3)ccc2[O-])C1 ZINC000840995478 631296258 /nfs/dbraw/zinc/29/62/58/631296258.db2.gz PLPDQHXQKJFWAT-HNNXBMFYSA-N -1 3 297.354 2.966 20 10 CFCDHM O=C([O-])[C@H]1CC[N@@H+](Cc2cc(-c3ccccc3)ccc2[O-])C1 ZINC000840995478 631296270 /nfs/dbraw/zinc/29/62/70/631296270.db2.gz PLPDQHXQKJFWAT-HNNXBMFYSA-N -1 3 297.354 2.966 20 10 CFCDHM Cc1cc(Cl)cc(C[N@@H+]2CCC[C@H](C(=O)[O-])C2)c1[O-] ZINC000840997678 631298212 /nfs/dbraw/zinc/29/82/12/631298212.db2.gz ZIZFGSSDNRRFTI-JTQLQIEISA-N -1 3 283.755 2.651 20 10 CFCDHM Cc1cc(Cl)cc(C[N@H+]2CCC[C@H](C(=O)[O-])C2)c1[O-] ZINC000840997678 631298213 /nfs/dbraw/zinc/29/82/13/631298213.db2.gz ZIZFGSSDNRRFTI-JTQLQIEISA-N -1 3 283.755 2.651 20 10 CFCDHM COc1ccc(CN[C@H](C(=O)[O-])c2ccsc2)cc1C ZINC000841798205 631472660 /nfs/dbraw/zinc/47/26/60/631472660.db2.gz DYMIPOORUGDJHK-AWEZNQCLSA-N -1 3 291.372 2.981 20 10 CFCDHM [O-]c1c(Br)cccc1CN1CC(C2CC2)C1 ZINC000812775382 631770938 /nfs/dbraw/zinc/77/09/38/631770938.db2.gz LPOWYRJIUKDJCF-UHFFFAOYSA-N -1 3 282.181 2.997 20 10 CFCDHM [O-]c1ccc(Cl)cc1CN1CCO[C@]2(CCSC2)C1 ZINC000843418088 631948681 /nfs/dbraw/zinc/94/86/81/631948681.db2.gz PYHJCSCMGJVEGB-CQSZACIVSA-N -1 3 299.823 2.754 20 10 CFCDHM CCOC(=O)[C@H](C)NCc1ccc2ccccc2c1[O-] ZINC000816589887 632490773 /nfs/dbraw/zinc/49/07/73/632490773.db2.gz LJHCCQQSFWZOTE-NSHDSACASA-N -1 3 273.332 2.587 20 10 CFCDHM COc1cccc(CNCc2c(F)ccc([O-])c2F)c1O ZINC000816610593 632494557 /nfs/dbraw/zinc/49/45/57/632494557.db2.gz QNJCJABNVBGAAB-UHFFFAOYSA-N -1 3 295.285 2.674 20 10 CFCDHM O=C(N[C@@H](c1ccccc1)C(F)F)c1cccc(O)c1[O-] ZINC000817223140 632574683 /nfs/dbraw/zinc/57/46/83/632574683.db2.gz KIOVUVPGXWKWSQ-LBPRGKRZSA-N -1 3 293.269 2.834 20 10 CFCDHM Cc1cc(Cl)cc(C[NH2+]C[C@H](C(=O)[O-])C(C)C)c1[O-] ZINC000848641178 633307016 /nfs/dbraw/zinc/30/70/16/633307016.db2.gz ZOQIHGHGETZWKW-LBPRGKRZSA-N -1 3 285.771 2.800 20 10 CFCDHM CC[C@H](N[C@H]1C[C@H](C)n2ncnc21)c1ccc(F)cc1[O-] ZINC000850498872 634018750 /nfs/dbraw/zinc/01/87/50/634018750.db2.gz FDXJZWFJWRAUQH-XDTLVQLUSA-N -1 3 290.342 2.870 20 10 CFCDHM C[C@H](N[C@@H]1C[C@H](C)n2ncnc21)c1cc(Cl)ccc1[O-] ZINC000850499230 634019805 /nfs/dbraw/zinc/01/98/05/634019805.db2.gz LKQNFTMLBOWCNT-HOTUBEGUSA-N -1 3 292.770 2.994 20 10 CFCDHM C[C@@H](N[C@@H](C)c1nccn1C)c1ccc(F)cc1[O-] ZINC000850571986 634057169 /nfs/dbraw/zinc/05/71/69/634057169.db2.gz FXAZUCYWWPVFRQ-ZJUUUORDSA-N -1 3 263.316 2.677 20 10 CFCDHM Cc1ccc(C(=O)Nc2cc([C@H]3C[C@H]3C)[nH]n2)c([O-])c1O ZINC000855002075 635438072 /nfs/dbraw/zinc/43/80/72/635438072.db2.gz NSZBZGSWICRUBI-SCZZXKLOSA-N -1 3 287.319 2.505 20 10 CFCDHM [O-]c1cccc(Br)c1CN1CC2(C1)CCCO2 ZINC000862484583 637399228 /nfs/dbraw/zinc/39/92/28/637399228.db2.gz VNNMXNRVTUHPIP-UHFFFAOYSA-N -1 3 298.180 2.520 20 10 CFCDHM CC(C)N(Cc1ccccn1)C(=O)c1cccc(O)c1[O-] ZINC000863943107 637818807 /nfs/dbraw/zinc/81/88/07/637818807.db2.gz OANAZKYDIXCXKV-UHFFFAOYSA-N -1 3 286.331 2.544 20 10 CFCDHM CC[C@@H](Cc1ccccc1)NC(=O)c1cccc(O)c1[O-] ZINC000193015082 650616133 /nfs/dbraw/zinc/61/61/33/650616133.db2.gz AVOAPSQJJUSNEJ-ZDUSSCGKSA-N -1 3 285.343 2.849 20 10 CFCDHM O=C(Nc1cc(C(F)(F)F)ccn1)c1cccc(O)c1[O-] ZINC000193156707 650629227 /nfs/dbraw/zinc/62/92/27/650629227.db2.gz OOGBLJKOILDMAD-UHFFFAOYSA-N -1 3 298.220 2.764 20 10 CFCDHM [O-]c1c(Br)cccc1CN1CCSCC1 ZINC000126207687 643050130 /nfs/dbraw/zinc/05/01/30/643050130.db2.gz NEACHTJAKYPZLW-UHFFFAOYSA-N -1 3 288.210 2.704 20 10 CFCDHM C[C@@H]1Cc2ccccc2N1C(=O)c1cccc(O)c1[O-] ZINC000126213207 643052251 /nfs/dbraw/zinc/05/22/51/643052251.db2.gz QAPPOUQOXCBUHV-SNVBAGLBSA-N -1 3 269.300 2.689 20 10 CFCDHM C[C@H](c1cccs1)N(C)C(=O)c1cccc(O)c1[O-] ZINC000126324954 643145662 /nfs/dbraw/zinc/14/56/62/643145662.db2.gz SZPXFQNWEMPKFP-SECBINFHSA-N -1 3 277.345 2.993 20 10 CFCDHM CC(C)c1nc([C@H](C)NCc2ccc(F)c(F)c2[O-])n[nH]1 ZINC000877125867 643164810 /nfs/dbraw/zinc/16/48/10/643164810.db2.gz CBUPCWKQPBJMNR-QMMMGPOBSA-N -1 3 296.321 2.763 20 10 CFCDHM O=C(NCc1ccc(Cl)s1)c1cccc(O)c1[O-] ZINC000126433828 643212208 /nfs/dbraw/zinc/21/22/08/643212208.db2.gz RZVOHGGIRBYMDJ-UHFFFAOYSA-N -1 3 283.736 2.743 20 10 CFCDHM C[C@H](N[C@@H](C)c1c([O-])cccc1F)c1ccn(C)n1 ZINC000886625077 647074535 /nfs/dbraw/zinc/07/45/35/647074535.db2.gz IETOLCHOIOEBRS-UWVGGRQHSA-N -1 3 263.316 2.677 20 10 CFCDHM O=C(NCc1c([O-])cccc1F)N[C@@H]1C[C@@H]2CCCC[C@H]12 ZINC000924014450 647912767 /nfs/dbraw/zinc/91/27/67/647912767.db2.gz NXLADPFAOYMPRJ-COPLHBTASA-N -1 3 292.354 2.909 20 10 CFCDHM CC[C@H](N[C@@H]1CNOC1)c1cc(Cl)cc(Cl)c1[O-] ZINC000925858675 648346706 /nfs/dbraw/zinc/34/67/06/648346706.db2.gz CSCCRCQJQHVBFZ-KCJUWKMLSA-N -1 3 291.178 2.643 20 10 CFCDHM O=C(NCc1c([O-])cccc1F)[C@H]1CCc2ccccc2C1 ZINC000928706041 648944769 /nfs/dbraw/zinc/94/47/69/648944769.db2.gz NZXMRIZPOFBHQL-AWEZNQCLSA-N -1 3 299.345 2.953 20 10 CFCDHM CCCC(C)(C)C(=O)NCc1c([O-])cccc1F ZINC000928706058 648944810 /nfs/dbraw/zinc/94/48/10/648944810.db2.gz OGISFBIREDGAIJ-UHFFFAOYSA-N -1 3 253.317 2.974 20 10 CFCDHM CC[C@H]1CCC[C@H]1C(=O)NCc1c([O-])cccc1F ZINC000928705909 648944917 /nfs/dbraw/zinc/94/49/17/648944917.db2.gz MLWYJPQTXGKOAL-WDEREUQCSA-N -1 3 265.328 2.974 20 10 CFCDHM CC[C@H](C)CC[C@H](O)CC(=O)NCc1c([O-])cccc1F ZINC000928708267 648945287 /nfs/dbraw/zinc/94/52/87/648945287.db2.gz JLKNUGROWLBNJY-RYUDHWBXSA-N -1 3 297.370 2.725 20 10 CFCDHM O=C(NCc1c([O-])cccc1F)[C@@H]1CCCC(F)(F)C1 ZINC000928707806 648945315 /nfs/dbraw/zinc/94/53/15/648945315.db2.gz IXIATCMUFZSHQZ-SECBINFHSA-N -1 3 287.281 2.973 20 10 CFCDHM C[C@H]1CCCC[C@@H]1C(=O)NCc1c([O-])cccc1F ZINC000928706628 648945366 /nfs/dbraw/zinc/94/53/66/648945366.db2.gz SNUIQAMVXZAUKZ-QWRGUYRKSA-N -1 3 265.328 2.974 20 10 CFCDHM CO[C@H](C(=O)NCc1c([O-])cccc1F)C1CCCCC1 ZINC000928710040 648945877 /nfs/dbraw/zinc/94/58/77/648945877.db2.gz GLLPSGAOTJAIJJ-HNNXBMFYSA-N -1 3 295.354 2.743 20 10 CFCDHM CCOCCCCCC(=O)NCc1c([O-])cccc1F ZINC000928710261 648945920 /nfs/dbraw/zinc/94/59/20/648945920.db2.gz RVLJYOVWEHKJMU-UHFFFAOYSA-N -1 3 283.343 2.744 20 10 CFCDHM CC(C)(C(=O)NCc1c([O-])cccc1F)c1ccccn1 ZINC000928708690 648946048 /nfs/dbraw/zinc/94/60/48/648946048.db2.gz QGFGOCZITLXNQS-UHFFFAOYSA-N -1 3 288.322 2.520 20 10 CFCDHM CCC(C)(CC)C(=O)NCc1c([O-])cccc1F ZINC000928709192 648946114 /nfs/dbraw/zinc/94/61/14/648946114.db2.gz YARFLWPBQATFJM-UHFFFAOYSA-N -1 3 253.317 2.974 20 10 CFCDHM CCc1noc(C)c1NC(=O)NCc1c([O-])cccc1F ZINC000930547343 649271210 /nfs/dbraw/zinc/27/12/10/649271210.db2.gz QIYROTSGCBHOHN-UHFFFAOYSA-N -1 3 293.298 2.712 20 10 CFCDHM C[C@@H]1CN(Cc2cc(F)cc(Cl)c2[O-])CC[C@@]1(C)O ZINC001237807548 779719731 /nfs/dbraw/zinc/71/97/31/779719731.db2.gz LONLGTRAKDUIID-YMTOWFKASA-N -1 3 287.762 2.778 20 10 CFCDHM COCC1CCN(Cc2c([O-])cc(F)cc2F)CC1 ZINC001140580276 770951639 /nfs/dbraw/zinc/95/16/39/770951639.db2.gz VQNZEAPZEHYYEI-UHFFFAOYSA-N -1 3 271.307 2.529 20 10 CFCDHM [O-]c1ccc(Br)cc1CN1CC[C@H](F)C1 ZINC000689865674 775880392 /nfs/dbraw/zinc/88/03/92/775880392.db2.gz YNTNHCRRYZRSOA-JTQLQIEISA-N -1 3 274.133 2.699 20 10 CFCDHM O=C([O-])c1ccc(C[N@H+]2C[C@@H]3CC(F)(F)C[C@@H]3C2)c([O-])c1 ZINC001231449964 777221349 /nfs/dbraw/zinc/22/13/49/777221349.db2.gz OXHUIEIGODVBSR-TXEJJXNPSA-N -1 3 297.301 2.568 20 10 CFCDHM O=C([O-])c1ccc(C[N@@H+]2C[C@@H]3CC(F)(F)C[C@@H]3C2)c([O-])c1 ZINC001231449964 777221357 /nfs/dbraw/zinc/22/13/57/777221357.db2.gz OXHUIEIGODVBSR-TXEJJXNPSA-N -1 3 297.301 2.568 20 10 CFCDHM CCC1CC[NH+](Cc2ccc(C(=O)[O-])cc2[O-])CC1 ZINC001231445893 777222171 /nfs/dbraw/zinc/22/21/71/777222171.db2.gz CIYMAJKNGXYNMB-UHFFFAOYSA-N -1 3 263.337 2.712 20 10 CFCDHM Cc1cc([O-])c(CN2CC[C@@](C)(O)[C@@H](F)C2)cc1Cl ZINC001231866904 777357835 /nfs/dbraw/zinc/35/78/35/777357835.db2.gz FDNNCJOIELZCPZ-UONOGXRCSA-N -1 3 287.762 2.649 20 10 CFCDHM Cc1cc([O-])c(CN2CCC(=O)C(F)(F)C2)cc1Cl ZINC001231871061 777359218 /nfs/dbraw/zinc/35/92/18/777359218.db2.gz XQZVZMNNGBKLLH-UHFFFAOYSA-N -1 3 289.709 2.764 20 10 CFCDHM [O-]c1cc(O)c(CN2CCc3cnccc3C2)cc1Cl ZINC001232261205 777496269 /nfs/dbraw/zinc/49/62/69/777496269.db2.gz WSZIVGNVRQVWPA-UHFFFAOYSA-N -1 3 290.750 2.705 20 10 CFCDHM COc1cc([O-])c(CN2CCCC(=O)CC2)cc1Cl ZINC001232267805 777499871 /nfs/dbraw/zinc/49/98/71/777499871.db2.gz JHMVCEUDYDAZGI-UHFFFAOYSA-N -1 3 283.755 2.609 20 10 CFCDHM COc1cc([O-])c(CN2CCC[C@H]2C(C)=O)cc1Cl ZINC001232270553 777501077 /nfs/dbraw/zinc/50/10/77/777501077.db2.gz FBOGXSYHNURVMN-LBPRGKRZSA-N -1 3 283.755 2.608 20 10 CFCDHM [O-]c1c(CN2CC[C@@H]3CCCO[C@H]3C2)ccc(F)c1F ZINC001233076034 777790272 /nfs/dbraw/zinc/79/02/72/777790272.db2.gz KEAYKKMNIOBXNU-GWCFXTLKSA-N -1 3 283.318 2.671 20 10 CFCDHM [O-]c1c(CN2CCSCC2)cccc1C(F)(F)F ZINC001233416316 777943288 /nfs/dbraw/zinc/94/32/88/777943288.db2.gz DAOBLLYGCRONNN-UHFFFAOYSA-N -1 3 277.311 2.960 20 10 CFCDHM C[C@H]1COCCN1Cc1ccc(C(F)(F)F)cc1[O-] ZINC001233451974 777957235 /nfs/dbraw/zinc/95/72/35/777957235.db2.gz GRZZFPOAMOJGQX-VIFPVBQESA-N -1 3 275.270 2.632 20 10 CFCDHM [O-]c1cc(C(F)(F)F)ccc1CN1CC2(C1)CCCO2 ZINC001233452322 777959039 /nfs/dbraw/zinc/95/90/39/777959039.db2.gz RHKHBCKLLWXHTQ-UHFFFAOYSA-N -1 3 287.281 2.776 20 10 CFCDHM [O-]c1cc(Cl)c(Cl)cc1CN1CC[C@H](F)[C@@H](O)C1 ZINC001236792174 778938770 /nfs/dbraw/zinc/93/87/70/778938770.db2.gz CPEJWOSZIKVOCZ-JQWIXIFHSA-N -1 3 294.153 2.604 20 10 CFCDHM COc1cc([O-])c(CN2CC[C@@H](F)C2)c(Cl)c1 ZINC001236800362 778943419 /nfs/dbraw/zinc/94/34/19/778943419.db2.gz XTVAIAJJADZLGV-MRVPVSSYSA-N -1 3 259.708 2.598 20 10 CFCDHM COc1cc([O-])c(CN2CCCC(=O)[C@@H](C)C2)c(Cl)c1 ZINC001236799085 778943490 /nfs/dbraw/zinc/94/34/90/778943490.db2.gz RCTXLAUQIKLDCM-JTQLQIEISA-N -1 3 297.782 2.855 20 10 CFCDHM COc1ccc(CN2CCC[C@@]3(CCO3)C2)c([O-])c1Cl ZINC001236812435 778950867 /nfs/dbraw/zinc/95/08/67/778950867.db2.gz VPMITQIQIQQOGD-OAHLLOKOSA-N -1 3 297.782 2.809 20 10 CFCDHM [O-]c1ccc(Cl)c(Cl)c1CN1CCC[C@@H](O)C1 ZINC001237077230 779006887 /nfs/dbraw/zinc/00/68/87/779006887.db2.gz DIRKIKPYMMGBLO-MRVPVSSYSA-N -1 3 276.163 2.656 20 10 CFCDHM [O-]c1ccc(Cl)c(Cl)c1CN1CCC(CO)CC1 ZINC001237079247 779006976 /nfs/dbraw/zinc/00/69/76/779006976.db2.gz IQFLRPVYBGUFLO-UHFFFAOYSA-N -1 3 290.190 2.903 20 10 CFCDHM C[C@@H]1C[C@H](O)CCN1Cc1c([O-])ccc(F)c1Cl ZINC001237125796 779018995 /nfs/dbraw/zinc/01/89/95/779018995.db2.gz DXJUDROHYOLZRP-RKDXNWHRSA-N -1 3 273.735 2.530 20 10 CFCDHM [O-]c1ccc(F)c(Cl)c1CN1CC2(C1)CCOCC2 ZINC001237124487 779019486 /nfs/dbraw/zinc/01/94/86/779019486.db2.gz MILXLOKBJJFIAI-UHFFFAOYSA-N -1 3 285.746 2.797 20 10 CFCDHM [O-]c1c(F)cc(Cl)cc1CN1CCCC[C@H]1CO ZINC001237618842 779145575 /nfs/dbraw/zinc/14/55/75/779145575.db2.gz JNDJPPOASDIRSM-NSHDSACASA-N -1 3 273.735 2.532 20 10 CFCDHM O=C1CCC[C@@H]2CN(Cc3cc(F)cc(Cl)c3[O-])C[C@@H]12 ZINC001237800323 779181702 /nfs/dbraw/zinc/18/17/02/779181702.db2.gz JMQRQTGLBCPSST-BXKDBHETSA-N -1 3 297.757 2.986 20 10 CFCDHM CN1CCN(Cc2cc(F)cc(Cl)c2[O-])CC1(C)C ZINC001237805983 779182649 /nfs/dbraw/zinc/18/26/49/779182649.db2.gz QBLYGMHXWZMPHJ-UHFFFAOYSA-N -1 3 286.778 2.711 20 10 CFCDHM CN(Cc1cncnc1)Cc1cc(F)c(Cl)cc1[O-] ZINC001237940565 779211463 /nfs/dbraw/zinc/21/14/63/779211463.db2.gz BBUSONCKNPSPFO-UHFFFAOYSA-N -1 3 281.718 2.607 20 10 CFCDHM CO[C@@H](C)C1CN(Cc2cc(F)c(Cl)cc2[O-])C1 ZINC001237941603 779724788 /nfs/dbraw/zinc/72/47/88/779724788.db2.gz ZBIJDKTXLMMKSV-QMMMGPOBSA-N -1 3 273.735 2.651 20 10 CFCDHM CC(C)O[C@@H]1CCN(Cc2ccc(F)c(F)c2[O-])C1 ZINC000703500557 781017293 /nfs/dbraw/zinc/01/72/93/781017293.db2.gz DMFUCXCKQZBHMX-LLVKDONJSA-N -1 3 271.307 2.670 20 10 CFCDHM CO[C@@H]1CN(Cc2ccc(F)c(F)c2[O-])CC[C@@H]1C ZINC000703532165 781026268 /nfs/dbraw/zinc/02/62/68/781026268.db2.gz SWOFZNVIUDDPSP-JOYOIKCWSA-N -1 3 271.307 2.527 20 10 CFCDHM CCOC1CCN(Cc2ccc(F)c(F)c2[O-])CC1 ZINC000703540848 781027464 /nfs/dbraw/zinc/02/74/64/781027464.db2.gz KCTIADLYJHYQKW-UHFFFAOYSA-N -1 3 271.307 2.671 20 10 CFCDHM CC[C@@H]1CN(Cc2cc(F)cc(F)c2[O-])CCCO1 ZINC000708413881 781272964 /nfs/dbraw/zinc/27/29/64/781272964.db2.gz ORJHSVZVOMDABX-GFCCVEGCSA-N -1 3 271.307 2.671 20 10 CFCDHM CCO[C@H]1CCCN(Cc2cc(F)cc(F)c2[O-])C1 ZINC000708412517 781273186 /nfs/dbraw/zinc/27/31/86/781273186.db2.gz ICXLUSVDPBJMCM-LBPRGKRZSA-N -1 3 271.307 2.671 20 10 CFCDHM C[C@]1(C(F)(F)F)CCN(C(=O)c2cccc(O)c2[O-])C1 ZINC000709338887 781309973 /nfs/dbraw/zinc/30/99/73/781309973.db2.gz DKOBUPBMKBEPTO-LBPRGKRZSA-N -1 3 289.253 2.512 20 10 CFCDHM CCCCC[C@@H](C)NC(=O)CN(C)Cc1ccccc1[O-] ZINC000111236099 375836422 /nfs/dbraw/zinc/83/64/22/375836422.db2.gz HZESLKLGUAQZIO-CQSZACIVSA-N -1 3 292.423 2.909 20 10 CFCDHM CCCOc1ccc(CN2C[C@H](C)O[C@@H](C)C2)c([O-])c1 ZINC000126957432 377255717 /nfs/dbraw/zinc/25/57/17/377255717.db2.gz RKRKJYNUSCYGGW-STQMWFEESA-N -1 3 279.380 2.790 20 10 CFCDHM COCCn1cc(NCc2c([O-])cccc2Cl)cn1 ZINC000133757354 377955667 /nfs/dbraw/zinc/95/56/67/377955667.db2.gz LSKQNDXNZLAHIG-UHFFFAOYSA-N -1 3 281.743 2.501 20 10 CFCDHM CC(=O)c1cc(F)cc(CN(C)[C@@H](CO)C(C)(C)C)c1[O-] ZINC000134389403 378009106 /nfs/dbraw/zinc/00/91/06/378009106.db2.gz ISRHHPRMTLBIBB-AWEZNQCLSA-N -1 3 297.370 2.573 20 10 CFCDHM COCCCn1ccc(NCc2c([O-])cccc2Cl)n1 ZINC000151625743 378341746 /nfs/dbraw/zinc/34/17/46/378341746.db2.gz VSKKVHSGBHMSCV-UHFFFAOYSA-N -1 3 295.770 2.891 20 10 CFCDHM Cc1ccc(C(=O)N2CCc3sccc3C2)c([O-])c1O ZINC000177666495 380363839 /nfs/dbraw/zinc/36/38/39/380363839.db2.gz GBDIFEIQNDJDLH-UHFFFAOYSA-N -1 3 289.356 2.666 20 10 CFCDHM COC[C@@H](NCc1ccccc1[O-])c1ccc(C)o1 ZINC000177566161 380355130 /nfs/dbraw/zinc/35/51/30/380355130.db2.gz BTRMCBCAKWYVKX-CYBMUJFWSA-N -1 3 261.321 2.771 20 10 CFCDHM CCOC(=O)[C@@H]1CCCN(Cc2cccc(Cl)c2[O-])C1 ZINC000179843942 380585571 /nfs/dbraw/zinc/58/55/71/380585571.db2.gz PQOLHFBTNSWFLV-GFCCVEGCSA-N -1 3 297.782 2.821 20 10 CFCDHM [O-]c1ccc(F)cc1CN1CCO[C@@H](c2ccco2)C1 ZINC000180243300 380638616 /nfs/dbraw/zinc/63/86/16/380638616.db2.gz VYBXPPAJZLWABW-OAHLLOKOSA-N -1 3 277.295 2.698 20 10 CFCDHM COc1ccc(CN(C)Cc2cc(F)ccc2[O-])cc1O ZINC000179974035 380605721 /nfs/dbraw/zinc/60/57/21/380605721.db2.gz DVTMPSUWYFXNIV-UHFFFAOYSA-N -1 3 291.322 2.878 20 10 CFCDHM CCCCCN(CC(N)=O)Cc1cccc(Cl)c1[O-] ZINC000180803783 380701009 /nfs/dbraw/zinc/70/10/09/380701009.db2.gz HHFKCWWCRCHEJT-UHFFFAOYSA-N -1 3 284.787 2.523 20 10 CFCDHM Cc1ccc(C(=O)N(Cc2ccccn2)C2CC2)c([O-])c1O ZINC000181783447 380893579 /nfs/dbraw/zinc/89/35/79/380893579.db2.gz QKWAHXIHWNZXNP-UHFFFAOYSA-N -1 3 298.342 2.606 20 10 CFCDHM CC(=O)c1cc(F)cc(CN[C@H](C)c2ccccn2)c1[O-] ZINC000181795317 380896470 /nfs/dbraw/zinc/89/64/70/380896470.db2.gz TYZQRLAAVQKADL-SNVBAGLBSA-N -1 3 288.322 2.980 20 10 CFCDHM Cc1ccc(C(=O)N2CCC[C@@H]2C2CCC2)c([O-])c1O ZINC000182324632 381063219 /nfs/dbraw/zinc/06/32/19/381063219.db2.gz CBYOVBGTYMSPSM-CYBMUJFWSA-N -1 3 275.348 2.811 20 10 CFCDHM COc1cc(Cl)cc(CN2CCSC[C@H]2C)c1[O-] ZINC000184693897 381462833 /nfs/dbraw/zinc/46/28/33/381462833.db2.gz XCGZXFSBPHLCOD-SECBINFHSA-N -1 3 287.812 2.992 20 10 CFCDHM CC[C@@H](NCc1nccn1CC)c1ccc(F)cc1[O-] ZINC000296597938 381465124 /nfs/dbraw/zinc/46/51/24/381465124.db2.gz VJRBDOKBSZYYSM-CYBMUJFWSA-N -1 3 277.343 2.989 20 10 CFCDHM CN(Cc1cc(-c2cccnc2)n[nH]1)Cc1ccccc1[O-] ZINC000371403797 381616617 /nfs/dbraw/zinc/61/66/17/381616617.db2.gz CEPFBWGIJQQSQI-UHFFFAOYSA-N -1 3 294.358 2.809 20 10 CFCDHM [O-]c1c(F)cccc1CN1CCC(OCC2CC2)CC1 ZINC000359997830 381719848 /nfs/dbraw/zinc/71/98/48/381719848.db2.gz VGZLLOKUIBKPQW-UHFFFAOYSA-N -1 3 279.355 2.922 20 10 CFCDHM CC(C)(C)OCc1cc(CNCc2ccccc2[O-])no1 ZINC000186413082 381903637 /nfs/dbraw/zinc/90/36/37/381903637.db2.gz IQSZNMFGFZZUSB-UHFFFAOYSA-N -1 3 290.363 2.985 20 10 CFCDHM CN(Cc1cn2c(n1)CCCC2)Cc1cc(F)ccc1[O-] ZINC000375406478 382083552 /nfs/dbraw/zinc/08/35/52/382083552.db2.gz SYLJSKBXDCSOEF-UHFFFAOYSA-N -1 3 289.354 2.696 20 10 CFCDHM CCc1nc([C@H](C)NC(=O)c2cccc(O)c2[O-])cs1 ZINC000187513578 382199329 /nfs/dbraw/zinc/19/93/29/382199329.db2.gz FSRRFNPINQVPQW-QMMMGPOBSA-N -1 3 292.360 2.608 20 10 CFCDHM CCc1nnc([C@H](C)NCc2cc(Cl)c(F)cc2[O-])[nH]1 ZINC000293729788 382254139 /nfs/dbraw/zinc/25/41/39/382254139.db2.gz WGSLLTOREOLMEV-ZETCQYMHSA-N -1 3 298.749 2.716 20 10 CFCDHM CCc1nc([C@H](C)NCc2cc(Cl)c(F)cc2[O-])n[nH]1 ZINC000293729788 382254145 /nfs/dbraw/zinc/25/41/45/382254145.db2.gz WGSLLTOREOLMEV-ZETCQYMHSA-N -1 3 298.749 2.716 20 10 CFCDHM CC[C@H](c1ccccc1[O-])N1CCC[C@@H]1c1nncn1C ZINC000377694999 382323440 /nfs/dbraw/zinc/32/34/40/382323440.db2.gz LKIDOLYSFLEZTL-ZIAGYGMSSA-N -1 3 286.379 2.809 20 10 CFCDHM CC(C)c1nnc2n1CCN(Cc1ccccc1[O-])[C@@H]2C ZINC000188449907 382416904 /nfs/dbraw/zinc/41/69/04/382416904.db2.gz UUOWPTFGNSOLLF-GFCCVEGCSA-N -1 3 286.379 2.684 20 10 CFCDHM CCCN(Cc1cnns1)Cc1ccccc1[O-] ZINC000294851581 382534201 /nfs/dbraw/zinc/53/42/01/382534201.db2.gz CFWJMAIXEIPHPS-UHFFFAOYSA-N -1 3 263.366 2.656 20 10 CFCDHM C[C@H](O)C[C@@H]1CCCN1Cc1cc(Cl)c(F)cc1[O-] ZINC000295274051 382605523 /nfs/dbraw/zinc/60/55/23/382605523.db2.gz HWOJMMUSYAMPOM-ONGXEEELSA-N -1 3 287.762 2.920 20 10 CFCDHM CC[C@H]1CN(Cc2cc(F)cc(C(C)=O)c2[O-])CCCO1 ZINC000281204089 385186987 /nfs/dbraw/zinc/18/69/87/385186987.db2.gz AREHTRXNSBTUBM-AWEZNQCLSA-N -1 3 295.354 2.735 20 10 CFCDHM CCCCN(Cc1ccccc1[O-])[C@@H](C)C(=O)OC ZINC000282417450 385305367 /nfs/dbraw/zinc/30/53/67/385305367.db2.gz JAJZSZDQVCZWNJ-LBPRGKRZSA-N -1 3 265.353 2.556 20 10 CFCDHM C[C@H](O)C1CCN(Cc2cccc(Cl)c2[O-])CC1 ZINC000271719754 385389188 /nfs/dbraw/zinc/38/91/88/385389188.db2.gz JIXIZEWEHISFKZ-JTQLQIEISA-N -1 3 269.772 2.638 20 10 CFCDHM CCCN(Cc1ccn(C)n1)Cc1ccccc1[O-] ZINC000271207909 385375970 /nfs/dbraw/zinc/37/59/70/385375970.db2.gz SWKSHGWCAFWDJR-UHFFFAOYSA-N -1 3 259.353 2.538 20 10 CFCDHM Cc1cc(CN[C@@H](C)c2ccc(F)c(F)c2[O-])n(C)n1 ZINC000284057213 385529212 /nfs/dbraw/zinc/52/92/12/385529212.db2.gz AFTNOAWSBFRPOY-VIFPVBQESA-N -1 3 281.306 2.563 20 10 CFCDHM CC(C)c1nnc(CN(C)Cc2ccccc2[O-])o1 ZINC000109770444 393879603 /nfs/dbraw/zinc/87/96/03/393879603.db2.gz MGGMJMBHNCPXGX-UHFFFAOYSA-N -1 3 261.325 2.531 20 10 CFCDHM CN(CC(=O)NCC1CCCCC1)Cc1ccccc1[O-] ZINC000109768975 393879723 /nfs/dbraw/zinc/87/97/23/393879723.db2.gz HGDZRUCNIDXLQQ-UHFFFAOYSA-N -1 3 290.407 2.521 20 10 CFCDHM CCCCCNC(=O)[C@H](C)N(C)Cc1ccccc1[O-] ZINC000109770335 393879790 /nfs/dbraw/zinc/87/97/90/393879790.db2.gz RLARRLUMAUSPRQ-ZDUSSCGKSA-N -1 3 278.396 2.519 20 10 CFCDHM CCCN(Cc1noc(CC)n1)Cc1ccccc1[O-] ZINC000109836024 393880273 /nfs/dbraw/zinc/88/02/73/393880273.db2.gz ILDSNBGOFGPRQY-UHFFFAOYSA-N -1 3 275.352 2.750 20 10 CFCDHM Cc1ccc(CN[C@H](C)c2cc([N+](=O)[O-])ccc2[O-])cn1 ZINC000273420125 292106497 /nfs/dbraw/zinc/10/64/97/292106497.db2.gz RXRSYXDBEQEOOS-LLVKDONJSA-N -1 3 287.319 2.855 20 10 CFCDHM CC(C)NC(=O)CN(C)Cc1c([O-])ccc2ccccc21 ZINC000008184024 170322971 /nfs/dbraw/zinc/32/29/71/170322971.db2.gz WGXTYJNLOXWAGX-UHFFFAOYSA-N -1 3 286.375 2.502 20 10 CFCDHM O=C(c1cccc(O)c1[O-])N1C[C@H]2CCCCC[C@@H]21 ZINC000370492279 267322440 /nfs/dbraw/zinc/32/24/40/267322440.db2.gz PUGHLASQWUYGIS-PWSUYJOCSA-N -1 3 261.321 2.503 20 10 CFCDHM CC(C)(C)OC1CCN(C(=O)c2cccc(O)c2[O-])CC1 ZINC000279332097 278461457 /nfs/dbraw/zinc/46/14/57/278461457.db2.gz QITFJKOZHQPEOO-UHFFFAOYSA-N -1 3 293.363 2.518 20 10 CFCDHM Cc1ccc(C(=O)N2CCC(F)(F)[C@@H](C)C2)c([O-])c1O ZINC000292574768 301497173 /nfs/dbraw/zinc/49/71/73/301497173.db2.gz GCBNOOOOKRBWJW-VIFPVBQESA-N -1 3 285.290 2.524 20 10 CFCDHM CC(=O)c1cc(F)cc(CN(C)[C@H]2CCSC2)c1[O-] ZINC000050133423 518285002 /nfs/dbraw/zinc/28/50/02/518285002.db2.gz ZFKDIFOQMXQOOU-LBPRGKRZSA-N -1 3 283.368 2.671 20 10 CFCDHM CC1(C)CN(Cc2cccc(F)c2[O-])CC(C)(C)O1 ZINC000226455405 520481858 /nfs/dbraw/zinc/48/18/58/520481858.db2.gz HMSDSYSOERDOAV-UHFFFAOYSA-N -1 3 267.344 2.921 20 10 CFCDHM CC(=O)c1cc(Cl)cc(CN2CC[C@H](O)C[C@@H]2C)c1[O-] ZINC000292456017 518277431 /nfs/dbraw/zinc/27/74/31/518277431.db2.gz PXMYWFTZVQANRU-ZANVPECISA-N -1 3 297.782 2.593 20 10 CFCDHM CC(=O)c1cc(Cl)cc(CN2CCCO[C@@H](C)C2)c1[O-] ZINC000061919679 518277909 /nfs/dbraw/zinc/27/79/09/518277909.db2.gz UHNQBRRPOAJHMW-JTQLQIEISA-N -1 3 297.782 2.859 20 10 CFCDHM CC(=O)c1cc(Cl)cc(CN2CCC[C@H](O)CC2)c1[O-] ZINC000292981442 518279827 /nfs/dbraw/zinc/27/98/27/518279827.db2.gz BISOMVIRRUGHCR-ZDUSSCGKSA-N -1 3 297.782 2.595 20 10 CFCDHM CC(C)[C@H]1N(C(=O)c2cccc(O)c2[O-])CC1(C)C ZINC000293987998 519828244 /nfs/dbraw/zinc/82/82/44/519828244.db2.gz RGQGWRCLMIJMKK-CYBMUJFWSA-N -1 3 263.337 2.604 20 10 CFCDHM CCCC[C@H](C)N(C)C(=O)c1cccc(O)c1[O-] ZINC000291280287 521143211 /nfs/dbraw/zinc/14/32/11/521143211.db2.gz ONMZTBWJGASNFL-JTQLQIEISA-N -1 3 251.326 2.749 20 10 CFCDHM CCN(Cc1cc(F)ccc1[O-])CC(F)(F)F ZINC000226562502 521293307 /nfs/dbraw/zinc/29/33/07/521293307.db2.gz VWDGUPDKVDRTSX-UHFFFAOYSA-N -1 3 251.223 2.916 20 10 CFCDHM COc1c([O-])c(CNCc2occc2C)ccc1[N+](=O)[O-] ZINC000292706030 521878333 /nfs/dbraw/zinc/87/83/33/521878333.db2.gz CWPLSRCBOTZOAH-UHFFFAOYSA-N -1 3 292.291 2.500 20 10 CFCDHM CC[C@@H](C)[C@@H](NC(=O)c1cccc(O)c1[O-])C(F)(F)F ZINC000277865909 522311569 /nfs/dbraw/zinc/31/15/69/522311569.db2.gz DHUZPYGAAYSPFB-RDDDGLTNSA-N -1 3 291.269 2.805 20 10 CFCDHM COc1cc(Cl)cc(CN2CCO[C@@H]3CCC[C@H]32)c1[O-] ZINC000228630983 522535713 /nfs/dbraw/zinc/53/57/13/522535713.db2.gz AFQCENVBOJPSGX-CHWSQXEVSA-N -1 3 297.782 2.808 20 10 CFCDHM CC[C@H](NCc1nncn1CC)c1ccc(C)cc1[O-] ZINC000280060238 522674977 /nfs/dbraw/zinc/67/49/77/522674977.db2.gz KFLODCGWCOVIJL-ZDUSSCGKSA-N -1 3 274.368 2.553 20 10 CFCDHM COc1ncccc1CN[C@@H](C)c1cc(F)ccc1[O-] ZINC000094617603 525061587 /nfs/dbraw/zinc/06/15/87/525061587.db2.gz YJRXXFHOTMTNPG-JTQLQIEISA-N -1 3 276.311 2.786 20 10 CFCDHM C[C@H](NCc1ncccc1N(C)C)c1ccc(F)cc1[O-] ZINC000289840004 525489113 /nfs/dbraw/zinc/48/91/13/525489113.db2.gz PVCUEASEZRHIEW-NSHDSACASA-N -1 3 289.354 2.843 20 10 CFCDHM Cc1csc(CNCc2cc(F)ccc2[O-])n1 ZINC000226584063 526357577 /nfs/dbraw/zinc/35/75/77/526357577.db2.gz XHNFJAUWUVEAHL-UHFFFAOYSA-N -1 3 252.314 2.586 20 10 CFCDHM [O-]c1cccc(Cl)c1CN1CCCc2n[nH]cc21 ZINC000291499072 526362280 /nfs/dbraw/zinc/36/22/80/526362280.db2.gz HFQJSJHKUQCKMW-UHFFFAOYSA-N -1 3 263.728 2.722 20 10 CFCDHM [O-]c1cccc(Cl)c1CN1CCO[C@@H]2CCC[C@H]21 ZINC000228144110 526363830 /nfs/dbraw/zinc/36/38/30/526363830.db2.gz UQGSFIYKHRQAEX-TZMCWYRMSA-N -1 3 267.756 2.799 20 10 CFCDHM [O-]c1ccccc1CN(Cc1cocn1)C[C@H]1CCCO1 ZINC000191920468 526372641 /nfs/dbraw/zinc/37/26/41/526372641.db2.gz GYIYMZIHJHCOEZ-OAHLLOKOSA-N -1 3 288.347 2.561 20 10 CFCDHM CC(=O)c1cc(F)cc(CN2CC(C)(C)OC[C@@H]2C)c1[O-] ZINC000753834873 574050763 /nfs/dbraw/zinc/05/07/63/574050763.db2.gz WEAXBQOJQXZJRV-JTQLQIEISA-N -1 3 295.354 2.733 20 10 CFCDHM Cc1nc(C)c(COC(=O)c2cc([O-])cs2)s1 ZINC000745002170 574096091 /nfs/dbraw/zinc/09/60/91/574096091.db2.gz HVUOULVRZDLYOF-UHFFFAOYSA-N -1 3 269.347 2.884 20 10 CFCDHM C[C@H](NCc1ccoc1)c1cc([N+](=O)[O-])ccc1[O-] ZINC000756447963 574117367 /nfs/dbraw/zinc/11/73/67/574117367.db2.gz ZIMBZFUGJMUZLL-VIFPVBQESA-N -1 3 262.265 2.744 20 10 CFCDHM Cc1cccc(OCCNC(=O)c2cc([O-])cs2)c1 ZINC000731864148 574130802 /nfs/dbraw/zinc/13/08/02/574130802.db2.gz LTWWHTMQQRFJCY-UHFFFAOYSA-N -1 3 277.345 2.571 20 10 CFCDHM Cc1ccsc1CNC(=O)c1cc([O-])cs1 ZINC000731870972 574131321 /nfs/dbraw/zinc/13/13/21/574131321.db2.gz ASTUEIRVNCRBAJ-UHFFFAOYSA-N -1 3 253.348 2.754 20 10 CFCDHM C[N@H+](Cc1cccc(C(=O)[O-])c1)Cc1ccccc1[O-] ZINC000737486320 574144142 /nfs/dbraw/zinc/14/41/42/574144142.db2.gz HQTMVRZJAUSWFH-UHFFFAOYSA-N -1 3 271.316 2.722 20 10 CFCDHM C[N@@H+](Cc1cccc(C(=O)[O-])c1)Cc1ccccc1[O-] ZINC000737486320 574144145 /nfs/dbraw/zinc/14/41/45/574144145.db2.gz HQTMVRZJAUSWFH-UHFFFAOYSA-N -1 3 271.316 2.722 20 10 CFCDHM O=C(N[C@H]1CCCc2occc21)c1cc([O-])cs1 ZINC000732267479 574147815 /nfs/dbraw/zinc/14/78/15/574147815.db2.gz HAXANZOVRAKFPM-JTQLQIEISA-N -1 3 263.318 2.854 20 10 CFCDHM O=C(NC[C@@H](O)c1ccc(Cl)cc1)c1cc([O-])cs1 ZINC000732268953 574148498 /nfs/dbraw/zinc/14/84/98/574148498.db2.gz UIMAQKBKIWSUQI-LLVKDONJSA-N -1 3 297.763 2.571 20 10 CFCDHM COc1ccc(CNC(=O)c2cc([O-])cs2)cc1F ZINC000732268719 574148847 /nfs/dbraw/zinc/14/88/47/574148847.db2.gz MVPGXSVAAKKVPU-UHFFFAOYSA-N -1 3 281.308 2.531 20 10 CFCDHM Cc1ccc2c(c1)N(C(=O)c1cc([O-])cs1)CC2 ZINC000732281061 574149837 /nfs/dbraw/zinc/14/98/37/574149837.db2.gz YPARBMIVLZRACB-UHFFFAOYSA-N -1 3 259.330 2.965 20 10 CFCDHM Cc1csc(CCCCNC(=O)c2cc([O-])cs2)n1 ZINC000732284511 574150056 /nfs/dbraw/zinc/15/00/56/574150056.db2.gz ULTGDTRQPVNVKL-UHFFFAOYSA-N -1 3 296.417 2.971 20 10 CFCDHM CCCN(C[C@H]1CCCCO1)C(=O)c1cc([O-])cs1 ZINC000732288575 574150593 /nfs/dbraw/zinc/15/05/93/574150593.db2.gz DJQBYZFPCBGRFQ-GFCCVEGCSA-N -1 3 283.393 2.875 20 10 CFCDHM CCCCC[C@H](C)NC(=O)COC(=O)c1cc([O-])cs1 ZINC000732353950 574153163 /nfs/dbraw/zinc/15/31/63/574153163.db2.gz XCPPGINLARIGPV-JTQLQIEISA-N -1 3 299.392 2.696 20 10 CFCDHM CO[C@H](CNC(=O)c1cc([O-])cs1)c1ccccc1 ZINC000732574856 574161526 /nfs/dbraw/zinc/16/15/26/574161526.db2.gz DDUUAKNIRKEAED-GFCCVEGCSA-N -1 3 277.345 2.571 20 10 CFCDHM CC(C)(C)c1cnc(CNC(=O)c2cc([O-])cs2)o1 ZINC000746693765 574163580 /nfs/dbraw/zinc/16/35/80/574163580.db2.gz KZQACDXRPNJRFA-UHFFFAOYSA-N -1 3 280.349 2.669 20 10 CFCDHM Cc1ccc([C@H](C)N[C@H](C(N)=O)c2ccccc2)c([O-])c1 ZINC000756381046 574231453 /nfs/dbraw/zinc/23/14/53/574231453.db2.gz IWTWFQBGTCIXAD-LRDDRELGSA-N -1 3 284.359 2.578 20 10 CFCDHM CCOc1ccc(COC(=O)c2cc([O-])cs2)nc1 ZINC000756411087 574235088 /nfs/dbraw/zinc/23/50/88/574235088.db2.gz PJXFIAUVNKJQRK-UHFFFAOYSA-N -1 3 279.317 2.604 20 10 CFCDHM C[C@@H](NCc1ccon1)c1cc(Br)ccc1[O-] ZINC000756636531 574254143 /nfs/dbraw/zinc/25/41/43/574254143.db2.gz KETOGVFHLOKCEJ-MRVPVSSYSA-N -1 3 297.152 2.994 20 10 CFCDHM C[C@H](NC[C@](C)(O)C(F)(F)F)c1cc(F)cc(F)c1[O-] ZINC000756782466 574262378 /nfs/dbraw/zinc/26/23/78/574262378.db2.gz BMYGWGTZUJBANC-KGFZYKRKSA-N -1 3 299.239 2.634 20 10 CFCDHM CCc1nnc([C@@H](C)N[C@H](C)c2cc(F)cc(F)c2[O-])[nH]1 ZINC000756780215 574262394 /nfs/dbraw/zinc/26/23/94/574262394.db2.gz XIAAHXXXGRLAGZ-HTQZYQBOSA-N -1 3 296.321 2.763 20 10 CFCDHM CCc1nc([C@@H](C)N[C@H](C)c2cc(F)cc(F)c2[O-])n[nH]1 ZINC000756780215 574262395 /nfs/dbraw/zinc/26/23/95/574262395.db2.gz XIAAHXXXGRLAGZ-HTQZYQBOSA-N -1 3 296.321 2.763 20 10 CFCDHM Cc1ccc(S(=O)(=O)[N-]c2ccc(O)cc2C)cc1F ZINC000740705913 574263556 /nfs/dbraw/zinc/26/35/56/574263556.db2.gz PQUDWVNVPMYVMJ-UHFFFAOYSA-N -1 3 295.335 2.949 20 10 CFCDHM COCC1(N[C@H](C)c2cc(F)cc(F)c2[O-])CC1 ZINC000756851324 574268934 /nfs/dbraw/zinc/26/89/34/574268934.db2.gz SSFGAAOHUPIFIC-MRVPVSSYSA-N -1 3 257.280 2.500 20 10 CFCDHM CS[C@@H]1CCC[C@@H](NC(=O)c2cc([O-])cs2)C1 ZINC000735330303 574320864 /nfs/dbraw/zinc/32/08/64/574320864.db2.gz HVRTUVXSEMEZAV-PSASIEDQSA-N -1 3 271.407 2.858 20 10 CFCDHM C[C@@H](CNC(=O)c1cc([O-])cs1)Oc1ccc(F)cc1 ZINC000743720854 574371265 /nfs/dbraw/zinc/37/12/65/574371265.db2.gz CNCNAMOPFHWTDG-VIFPVBQESA-N -1 3 295.335 2.790 20 10 CFCDHM Cc1ccc(C(=O)N[C@H](C)CCC(C)C)c([O-])c1O ZINC000751533607 574378625 /nfs/dbraw/zinc/37/86/25/574378625.db2.gz QOFNPFIOQYHMEO-LLVKDONJSA-N -1 3 265.353 2.961 20 10 CFCDHM CCc1ccc(CNC(=O)c2ccc(C)c(O)c2[O-])s1 ZINC000751533724 574378696 /nfs/dbraw/zinc/37/86/96/574378696.db2.gz QHKMKNRQLVUFFE-UHFFFAOYSA-N -1 3 291.372 2.960 20 10 CFCDHM O=C(OCc1nc(C2CCCC2)no1)c1cc([O-])cs1 ZINC000751715305 574381383 /nfs/dbraw/zinc/38/13/83/574381383.db2.gz OKGYZIUHYFCOBP-UHFFFAOYSA-N -1 3 294.332 2.851 20 10 CFCDHM O=C([O-])C[C@@H]1CCC[N@@H+]1Cc1c([O-])ccc2ccccc21 ZINC000086791056 604981295 /nfs/dbraw/zinc/98/12/95/604981295.db2.gz IQDNYAVHDXUYPZ-ZDUSSCGKSA-N -1 3 285.343 2.985 20 10 CFCDHM O=C([O-])C[C@@H]1CCC[N@H+]1Cc1c([O-])ccc2ccccc21 ZINC000086791056 604981296 /nfs/dbraw/zinc/98/12/96/604981296.db2.gz IQDNYAVHDXUYPZ-ZDUSSCGKSA-N -1 3 285.343 2.985 20 10 CFCDHM CC(C)(C)C[C@@H]1CCN(C(=O)c2cccc(O)c2[O-])C1 ZINC000307774378 618096727 /nfs/dbraw/zinc/09/67/27/618096727.db2.gz MHWPSHPBOAGBNP-NSHDSACASA-N -1 3 277.364 2.996 20 10 CFCDHM C[C@@H]1CN(Cc2cc(F)cc(F)c2[O-])C[C@H](C)S1 ZINC000893977856 618258657 /nfs/dbraw/zinc/25/86/57/618258657.db2.gz KVOGTZRATAFUEO-DTORHVGOSA-N -1 3 273.348 2.996 20 10 CFCDHM C[C@@H]1CN(Cc2cc(Cl)cc(F)c2[O-])[C@@H](C)CN1C ZINC000775984938 618402071 /nfs/dbraw/zinc/40/20/71/618402071.db2.gz ILORRTKTMIUPLR-ZJUUUORDSA-N -1 3 286.778 2.709 20 10 CFCDHM CCn1ccc(CNCc2cccc(Cl)c2[O-])n1 ZINC000840955350 619136302 /nfs/dbraw/zinc/13/63/02/619136302.db2.gz QKTDUXHLRYRWFV-UHFFFAOYSA-N -1 3 265.744 2.552 20 10 CFCDHM CCc1cnc(NC(=O)c2ccc(C)c(O)c2[O-])s1 ZINC000182522721 625321716 /nfs/dbraw/zinc/32/17/16/625321716.db2.gz UHRGBNPUEGNITL-UHFFFAOYSA-N -1 3 278.333 2.677 20 10 CFCDHM COc1ccc(CN(C)Cc2cc(F)cc(F)c2[O-])cn1 ZINC000894452555 619389639 /nfs/dbraw/zinc/38/96/39/619389639.db2.gz AJWPDLOZHUMJLK-UHFFFAOYSA-N -1 3 294.301 2.706 20 10 CFCDHM Cc1cc([O-])c(CN(C)Cc2ncc[nH]2)c(Cl)c1 ZINC000894586901 619424841 /nfs/dbraw/zinc/42/48/41/619424841.db2.gz LJKMPFZKROAQAH-UHFFFAOYSA-N -1 3 265.744 2.709 20 10 CFCDHM CC(C)(C)c1nnc(NCc2c([O-])cccc2F)o1 ZINC000895833182 619619504 /nfs/dbraw/zinc/61/95/04/619619504.db2.gz VORLJISWSVMSNC-UHFFFAOYSA-N -1 3 265.288 2.824 20 10 CFCDHM CC(C)n1cncc1CNCc1c([O-])cccc1F ZINC000896637519 619780432 /nfs/dbraw/zinc/78/04/32/619780432.db2.gz JWELVECEZGUSQY-UHFFFAOYSA-N -1 3 263.316 2.599 20 10 CFCDHM Cc1ncc([C@@H](C)NCc2c([O-])cccc2F)c(C)n1 ZINC000896640328 619781704 /nfs/dbraw/zinc/78/17/04/619781704.db2.gz HDNWJKPVKUXUMF-SECBINFHSA-N -1 3 275.327 2.789 20 10 CFCDHM Cc1nc(CNCc2c([O-])cccc2F)sc1C ZINC000896641776 619782160 /nfs/dbraw/zinc/78/21/60/619782160.db2.gz VQFQKVOKZKDLAD-UHFFFAOYSA-N -1 3 266.341 2.894 20 10 CFCDHM CCC/C(C)=C/C(=O)NCc1c([O-])cccc1F ZINC000928711526 619996911 /nfs/dbraw/zinc/99/69/11/619996911.db2.gz IHHGXIWZTXLSQB-CSKARUKUSA-N -1 3 251.301 2.894 20 10 CFCDHM Cc1n[nH]c2cc(NC(=O)c3ccc(C)c(O)c3[O-])ccc12 ZINC000182973861 625407103 /nfs/dbraw/zinc/40/71/03/625407103.db2.gz AXQFNMUMIRXQIS-UHFFFAOYSA-N -1 3 297.314 2.843 20 10 CFCDHM CCc1cc(NCc2cc(F)cc(F)c2[O-])nc(C)n1 ZINC000902228950 621002698 /nfs/dbraw/zinc/00/26/98/621002698.db2.gz MHQQRKGBULYKHA-UHFFFAOYSA-N -1 3 279.290 2.943 20 10 CFCDHM CC[C@H](NCc1cn(C)cn1)c1ccc(F)cc1[O-] ZINC000903352940 621344330 /nfs/dbraw/zinc/34/43/30/621344330.db2.gz XDIYVIHFKZGYAD-ZDUSSCGKSA-N -1 3 263.316 2.506 20 10 CFCDHM [O-]c1c(Br)cccc1CN(C1CC1)C1COC1 ZINC000824471513 623510062 /nfs/dbraw/zinc/51/00/62/623510062.db2.gz DLMZKIZIKBPCNP-UHFFFAOYSA-N -1 3 298.180 2.518 20 10 CFCDHM CC(C)OC(=O)[C@@H](NCc1cc(F)ccc1[O-])C(C)C ZINC000824844512 623575269 /nfs/dbraw/zinc/57/52/69/623575269.db2.gz AIELYUCEHPPZAS-AWEZNQCLSA-N -1 3 283.343 2.597 20 10 CFCDHM Cc1cc([O-])c(CN2CCOC[C@@H]2C2CC2)cc1Cl ZINC000824861990 623580124 /nfs/dbraw/zinc/58/01/24/623580124.db2.gz FRCPCALDPDFRLK-CQSZACIVSA-N -1 3 281.783 2.965 20 10 CFCDHM CC(C)OC(=O)[C@H](C)NCc1ccc2ccccc2c1[O-] ZINC000825117418 623634146 /nfs/dbraw/zinc/63/41/46/623634146.db2.gz CSJHNGPVOKVIRX-LBPRGKRZSA-N -1 3 287.359 2.975 20 10 CFCDHM Cc1cn2c(n1)CN(Cc1cc(Cl)c(C)cc1[O-])CC2 ZINC000825483882 623702129 /nfs/dbraw/zinc/70/21/29/623702129.db2.gz FSAWKZYETQRRBH-UHFFFAOYSA-N -1 3 291.782 2.875 20 10 CFCDHM Cc1cc([O-])c(CN2CC(OCC(F)F)C2)cc1Cl ZINC000826113040 623794755 /nfs/dbraw/zinc/79/47/55/623794755.db2.gz GAFBAIMNZLDDDR-UHFFFAOYSA-N -1 3 291.725 2.820 20 10 CFCDHM CN(Cc1c[nH]cn1)Cc1cccc(Br)c1[O-] ZINC000826769193 623869245 /nfs/dbraw/zinc/86/92/45/623869245.db2.gz IUTRNPXNYAOADG-UHFFFAOYSA-N -1 3 296.168 2.510 20 10 CFCDHM [O-]c1cccc(Cl)c1CNc1nc2n(n1)CCCC2 ZINC000834482384 625692164 /nfs/dbraw/zinc/69/21/64/625692164.db2.gz IPLYVJPSIFNJBK-UHFFFAOYSA-N -1 3 278.743 2.586 20 10 CFCDHM CCS[C@H]1CCCC[C@@H]1NC(=O)c1cccc(O)c1[O-] ZINC000185807890 625780825 /nfs/dbraw/zinc/78/08/25/625780825.db2.gz LPLGFLCPIKRFFX-AAEUAGOBSA-N -1 3 295.404 2.892 20 10 CFCDHM CC(C)c1nnc(CN[C@@H](C)c2cc(F)cc(F)c2[O-])[nH]1 ZINC000834873295 625905985 /nfs/dbraw/zinc/90/59/85/625905985.db2.gz XOTDBTRJYCPQRF-QMMMGPOBSA-N -1 3 296.321 2.763 20 10 CFCDHM O=C(NCc1c([O-])cccc1F)NCC1(C2CC2)CCC1 ZINC000921600077 625992303 /nfs/dbraw/zinc/99/23/03/625992303.db2.gz JLFMXCIYZLSTFX-UHFFFAOYSA-N -1 3 292.354 2.911 20 10 CFCDHM CC1(CCNC(=O)NCc2c([O-])cccc2F)CC1 ZINC000922257642 626253659 /nfs/dbraw/zinc/25/36/59/626253659.db2.gz SHXVOBIHXLYVBB-UHFFFAOYSA-N -1 3 266.316 2.521 20 10 CFCDHM CCOCc1cccc(NC(=O)c2cccc(O)c2[O-])c1 ZINC000187063566 626442198 /nfs/dbraw/zinc/44/21/98/626442198.db2.gz DULHVTFOGJOAMX-UHFFFAOYSA-N -1 3 287.315 2.887 20 10 CFCDHM CCSC1(CNC(=O)NCc2c([O-])cccc2F)CC1 ZINC000923318874 626465659 /nfs/dbraw/zinc/46/56/59/626465659.db2.gz PUAYSUALAIPLGM-UHFFFAOYSA-N -1 3 298.383 2.616 20 10 CFCDHM CC(C)(C)c1nnc(CNCc2c([O-])cccc2Cl)[nH]1 ZINC000839170384 626529331 /nfs/dbraw/zinc/52/93/31/626529331.db2.gz LDASFTBHJZZIAH-UHFFFAOYSA-N -1 3 294.786 2.751 20 10 CFCDHM COC(=O)[C@@H](NCc1cc(Cl)ccc1[O-])C(C)(C)C ZINC000768525431 627350521 /nfs/dbraw/zinc/35/05/21/627350521.db2.gz WMGNSILRJAWYHP-GFCCVEGCSA-N -1 3 285.771 2.723 20 10 CFCDHM CN(Cc1cn[nH]c1)Cc1cccc(Br)c1[O-] ZINC000769426148 627437994 /nfs/dbraw/zinc/43/79/94/627437994.db2.gz SSBACLIGHSIMRE-UHFFFAOYSA-N -1 3 296.168 2.510 20 10 CFCDHM [O-]c1c(F)cc(Cl)cc1CN1CCN(CC2CC2)CC1 ZINC000775655342 628050309 /nfs/dbraw/zinc/05/03/09/628050309.db2.gz XYVJNKZBYSBDCC-UHFFFAOYSA-N -1 3 298.789 2.712 20 10 CFCDHM CO[C@H]1CCCN(Cc2cc(Cl)cc(F)c2[O-])C1 ZINC000775656008 628050641 /nfs/dbraw/zinc/05/06/41/628050641.db2.gz ABEXMKXSALOWNV-NSHDSACASA-N -1 3 273.735 2.796 20 10 CFCDHM C[C@@H]1[C@@H](C)N(Cc2cc(Cl)cc(F)c2[O-])CCN1C ZINC000775987025 628092450 /nfs/dbraw/zinc/09/24/50/628092450.db2.gz UATGMJUIZHKCOC-NXEZZACHSA-N -1 3 286.778 2.709 20 10 CFCDHM C[C@@H]1CN(Cc2cc(F)ccc2[O-])C[C@H](C(F)(F)F)O1 ZINC000779023624 628345390 /nfs/dbraw/zinc/34/53/90/628345390.db2.gz UZLXKKHHALORAQ-PRHODGIISA-N -1 3 293.260 2.683 20 10 CFCDHM Cc1ccc(C(=O)N2C[C@@H](C)Oc3ccccc32)c([O-])c1O ZINC000780941300 628506364 /nfs/dbraw/zinc/50/63/64/628506364.db2.gz SHKITMFQUAOVSD-LLVKDONJSA-N -1 3 299.326 2.834 20 10 CFCDHM CCN1CCc2ccc(NC(=O)c3cccc(O)c3[O-])cc21 ZINC000790639735 629254010 /nfs/dbraw/zinc/25/40/10/629254010.db2.gz FZQGKRTYMQBKOR-UHFFFAOYSA-N -1 3 298.342 2.733 20 10 CFCDHM Cc1ccc2c(c1C)OC[C@@H]2NC(=O)c1cccc(O)c1[O-] ZINC000790646860 629254969 /nfs/dbraw/zinc/25/49/69/629254969.db2.gz NJDHIEHDMSUZDN-ZDUSSCGKSA-N -1 3 299.326 2.578 20 10 CFCDHM CC1(c2ccccc2)CC(NC(=O)c2cccc(O)c2[O-])C1 ZINC000790663225 629256049 /nfs/dbraw/zinc/25/60/49/629256049.db2.gz RAKJAACVGZGRON-UHFFFAOYSA-N -1 3 297.354 2.948 20 10 CFCDHM Cc1ccc2c(c1)[C@@H](NC(=O)c1cccc(O)c1[O-])CC2 ZINC000790664957 629256602 /nfs/dbraw/zinc/25/66/02/629256602.db2.gz XMGHVHOCLUWADO-AWEZNQCLSA-N -1 3 283.327 2.824 20 10 CFCDHM CC(C)CC1CCN(C(=O)c2cccc(O)c2[O-])CC1 ZINC000790885986 629270012 /nfs/dbraw/zinc/27/00/12/629270012.db2.gz DDBFKLGDHGEWNV-UHFFFAOYSA-N -1 3 277.364 2.996 20 10 CFCDHM Cn1cc(C(C)(C)NCc2c([O-])ccc(Cl)c2F)cn1 ZINC000790972026 629276148 /nfs/dbraw/zinc/27/61/48/629276148.db2.gz DOCJURGYZGSWJD-UHFFFAOYSA-N -1 3 297.761 2.943 20 10 CFCDHM C[C@@H](O)[C@H]1CCCN(Cc2c([O-])ccc(Cl)c2F)C1 ZINC000792174332 629406041 /nfs/dbraw/zinc/40/60/41/629406041.db2.gz RYXQFFKBTMOITD-ZJUUUORDSA-N -1 3 287.762 2.778 20 10 CFCDHM CN(C(=O)c1cccc(O)c1[O-])[C@@H]1CCC(C)(C)C1 ZINC000794277089 629629808 /nfs/dbraw/zinc/62/98/08/629629808.db2.gz SOSVVEFBNZQRLP-SNVBAGLBSA-N -1 3 263.337 2.749 20 10 CFCDHM [O-]c1cccc(Cl)c1CNc1ccc(CCO)nc1 ZINC000806670522 630828891 /nfs/dbraw/zinc/82/88/91/630828891.db2.gz MJHMOSYRUHULMT-UHFFFAOYSA-N -1 3 278.739 2.588 20 10 CFCDHM COc1nn(C)cc1N[C@@H](C)c1ccc(Cl)cc1[O-] ZINC000841750718 631465344 /nfs/dbraw/zinc/46/53/44/631465344.db2.gz AMALHWSZRQGGOR-QMMMGPOBSA-N -1 3 281.743 2.961 20 10 CFCDHM Cc1cc(Cl)cc(C[NH2+][C@@H]2CC[C@H](C(=O)[O-])C2)c1[O-] ZINC000843040665 631809522 /nfs/dbraw/zinc/80/95/22/631809522.db2.gz XDLOLDZYYVDFSK-JOYOIKCWSA-N -1 3 283.755 2.697 20 10 CFCDHM Cc1cc(Cl)cc(C[N@H+]2CC[C@@H](C)[C@@H](C(=O)[O-])C2)c1[O-] ZINC000843039086 631809795 /nfs/dbraw/zinc/80/97/95/631809795.db2.gz ANISFBVENDLRRW-RNCFNFMXSA-N -1 3 297.782 2.897 20 10 CFCDHM Cc1cc(Cl)cc(C[N@@H+]2CC[C@@H](C)[C@@H](C(=O)[O-])C2)c1[O-] ZINC000843039086 631809801 /nfs/dbraw/zinc/80/98/01/631809801.db2.gz ANISFBVENDLRRW-RNCFNFMXSA-N -1 3 297.782 2.897 20 10 CFCDHM CC[C@@H](C)C[C@H](NCc1cc(F)ccc1[O-])C(=O)OC ZINC000843415341 631947274 /nfs/dbraw/zinc/94/72/74/631947274.db2.gz KFNKUXVIBKFHFO-MFKMUULPSA-N -1 3 283.343 2.599 20 10 CFCDHM CN(Cc1cc[nH]n1)Cc1ccc2ccccc2c1[O-] ZINC000816508259 632473553 /nfs/dbraw/zinc/47/35/53/632473553.db2.gz HHQSKZMFAAONAM-UHFFFAOYSA-N -1 3 267.332 2.901 20 10 CFCDHM C[C@@H]1CN(Cc2cc(Cl)cc(F)c2[O-])C[C@H](C)N1C ZINC000816653042 632505201 /nfs/dbraw/zinc/50/52/01/632505201.db2.gz CUVMHSBKWGQIDX-AOOOYVTPSA-N -1 3 286.778 2.709 20 10 CFCDHM [O-]c1cc(F)c(Cl)cc1CN1C[C@H]2[C@@H](C1)C2(F)F ZINC000846113539 632636163 /nfs/dbraw/zinc/63/61/63/632636163.db2.gz MKKZQSVUZDFDGD-OCAPTIKFSA-N -1 3 277.673 2.882 20 10 CFCDHM C[C@H](NCC(F)(F)CN)c1cc(Cl)c(Cl)cc1[O-] ZINC000817967440 632766660 /nfs/dbraw/zinc/76/66/60/632766660.db2.gz IRQQSITWFWPFTO-LURJTMIESA-N -1 3 299.148 2.944 20 10 CFCDHM C[C@H]1CCN(Cc2c([O-])ccc(Cl)c2F)C[C@H]1CO ZINC000857060503 635920860 /nfs/dbraw/zinc/92/08/60/635920860.db2.gz AMMZXLYXGIMRNT-UWVGGRQHSA-N -1 3 287.762 2.635 20 10 CFCDHM Cc1cc([O-])c([C@H]2NC3(CCCC3)C(=O)N2C)cc1Cl ZINC000849182013 633580549 /nfs/dbraw/zinc/58/05/49/633580549.db2.gz BQFCVVWLZSKQAR-ZDUSSCGKSA-N -1 3 294.782 2.727 20 10 CFCDHM Cc1ccc(C(=O)NCc2cc(Cl)ccc2O)c([O-])c1 ZINC000857548384 635983664 /nfs/dbraw/zinc/98/36/64/635983664.db2.gz LAXWKKUPEQYAJA-UHFFFAOYSA-N -1 3 291.734 2.990 20 10 CFCDHM COCc1ccc(NC(=O)c2ccc(C)c(O)c2[O-])cc1 ZINC000193023714 650616979 /nfs/dbraw/zinc/61/69/79/650616979.db2.gz OVQKDVBTVJJCFC-UHFFFAOYSA-N -1 3 287.315 2.805 20 10 CFCDHM CC(C)(C)CCCNC(=O)c1cccc(O)c1[O-] ZINC000193084930 650622223 /nfs/dbraw/zinc/62/22/23/650622223.db2.gz AXJWJVWOVUFYHD-UHFFFAOYSA-N -1 3 251.326 2.654 20 10 CFCDHM O=C(NCC1(Cc2ccccc2)CC1)c1cccc(O)c1[O-] ZINC000193142921 650627348 /nfs/dbraw/zinc/62/73/48/650627348.db2.gz ZIRIEAAOIQSXOW-UHFFFAOYSA-N -1 3 297.354 2.851 20 10 CFCDHM O=C(NCc1ccc(C(F)F)cc1)c1cccc(O)c1[O-] ZINC000193164680 650629889 /nfs/dbraw/zinc/62/98/89/650629889.db2.gz AAVCAKLJLYLXQS-UHFFFAOYSA-N -1 3 293.269 2.965 20 10 CFCDHM C[C@H]1CCCC[C@H]1CNC(=O)c1cccc(O)c1[O-] ZINC000126346770 643154419 /nfs/dbraw/zinc/15/44/19/643154419.db2.gz VKBPLVAFCNIYFO-QWRGUYRKSA-N -1 3 263.337 2.654 20 10 CFCDHM Cc1cccc(N(C)C(=O)c2cccc(O)c2[O-])c1 ZINC000126370717 643183043 /nfs/dbraw/zinc/18/30/43/643183043.db2.gz RLYPVHSNMPWEHQ-UHFFFAOYSA-N -1 3 257.289 2.683 20 10 CFCDHM Cc1cc(C)cc(N(C)C(=O)c2cccc(O)c2[O-])c1 ZINC000126369740 643183068 /nfs/dbraw/zinc/18/30/68/643183068.db2.gz XQZNJPTYTUJFBD-UHFFFAOYSA-N -1 3 271.316 2.991 20 10 CFCDHM CC(=O)NC[C@@H]1CCCCN1Cc1cccc(Cl)c1[O-] ZINC000877673784 643447321 /nfs/dbraw/zinc/44/73/21/643447321.db2.gz IKXWARFYKGTNDI-ZDUSSCGKSA-N -1 3 296.798 2.536 20 10 CFCDHM CCOC(=O)[C@@H](C)C1CN(Cc2cccc(Cl)c2[O-])C1 ZINC000877831375 643597505 /nfs/dbraw/zinc/59/75/05/643597505.db2.gz XJIKWFHURMOZNO-JTQLQIEISA-N -1 3 297.782 2.677 20 10 CFCDHM CC(=O)c1cc(F)cc(CN(C)OCC(F)(F)F)c1[O-] ZINC000879513275 644298435 /nfs/dbraw/zinc/29/84/35/644298435.db2.gz HVFGWPLXGCEFRV-UHFFFAOYSA-N -1 3 295.232 2.660 20 10 CFCDHM CC(=O)c1cc(Cl)cc(CN2[C@H](C)CC[C@@H]2CO)c1[O-] ZINC000880438887 644707420 /nfs/dbraw/zinc/70/74/20/644707420.db2.gz DBECOTUIIFYTQX-NOZJJQNGSA-N -1 3 297.782 2.593 20 10 CFCDHM C[C@@H]1CCC[C@@H](NC(=O)c2cccc(O)c2[O-])[C@H]1C ZINC000249372838 650958727 /nfs/dbraw/zinc/95/87/27/650958727.db2.gz XGRQYSNGAIQJGE-JFGNBEQYSA-N -1 3 263.337 2.652 20 10 CFCDHM CCc1cc(CN[C@@H](C)c2c([O-])cccc2F)on1 ZINC000886529937 647031280 /nfs/dbraw/zinc/03/12/80/647031280.db2.gz AJAXSZUMXDZBCS-VIFPVBQESA-N -1 3 264.300 2.933 20 10 CFCDHM C[C@H](N[C@@H](CCO)c1ccco1)c1c([O-])cccc1F ZINC000886592332 647058695 /nfs/dbraw/zinc/05/86/95/647058695.db2.gz QMARKZROAFPOAB-JQWIXIFHSA-N -1 3 279.311 2.899 20 10 CFCDHM C[C@H](N[C@H](CCO)c1ccco1)c1c([O-])cccc1F ZINC000886592331 647058857 /nfs/dbraw/zinc/05/88/57/647058857.db2.gz QMARKZROAFPOAB-CMPLNLGQSA-N -1 3 279.311 2.899 20 10 CFCDHM C[C@@H](N[C@H]1CCN(C(C)(C)C)C1=O)c1c([O-])cccc1F ZINC000886629945 647077335 /nfs/dbraw/zinc/07/73/35/647077335.db2.gz QWOMDTWDHHXYES-PWSUYJOCSA-N -1 3 294.370 2.581 20 10 CFCDHM C[C@@H](N[C@@H](C)c1ccnn1C)c1c([O-])cccc1F ZINC000886648080 647087091 /nfs/dbraw/zinc/08/70/91/647087091.db2.gz LDEAZTBRSLVWMN-VHSXEESVSA-N -1 3 263.316 2.677 20 10 CFCDHM C[C@@H]1C[C@@H](NC(=O)NCc2c([O-])cccc2F)CCS1 ZINC000927228553 648741762 /nfs/dbraw/zinc/74/17/62/648741762.db2.gz PUWSVSDTUPILMP-ZJUUUORDSA-N -1 3 298.383 2.615 20 10 CFCDHM O=C(c1cccc(O)c1[O-])N1C[C@H]2C[C@@]2(c2ccccc2)C1 ZINC000927315606 648754631 /nfs/dbraw/zinc/75/46/31/648754631.db2.gz XOLGNFFKUVJRJG-ACJLOTCBSA-N -1 3 295.338 2.512 20 10 CFCDHM CC[C@H]1C[C@H](CC(=O)NCc2c([O-])cccc2F)CCO1 ZINC000928707744 648945497 /nfs/dbraw/zinc/94/54/97/648945497.db2.gz HODAEDYFMYSEEE-NEPJUHHUSA-N -1 3 295.354 2.743 20 10 CFCDHM CC1(C)CC[C@H](C(=O)NCc2c([O-])cccc2F)C1 ZINC000928708425 648946129 /nfs/dbraw/zinc/94/61/29/648946129.db2.gz LTRRHPSNHCLUGB-JTQLQIEISA-N -1 3 265.328 2.974 20 10 CFCDHM C[C@@H](CC(=O)NCc1c([O-])cccc1F)c1ccncc1 ZINC000928712984 648946526 /nfs/dbraw/zinc/94/65/26/648946526.db2.gz ZEWYWWICJBIJGF-NSHDSACASA-N -1 3 288.322 2.736 20 10 CFCDHM CO[C@H]1CCCN(Cc2cc(F)cc(Cl)c2[O-])C1 ZINC001237800520 779719218 /nfs/dbraw/zinc/71/92/18/779719218.db2.gz AAPBTPIJDFTQSE-NSHDSACASA-N -1 3 273.735 2.796 20 10 CFCDHM O=C(NCc1cc(Cl)c2cccnc2c1[O-])[C@H]1C[C@@H]1F ZINC001143445368 770929978 /nfs/dbraw/zinc/92/99/78/770929978.db2.gz HLRAIUPTASHKRA-ONGXEEELSA-N -1 3 294.713 2.568 20 10 CFCDHM CCCCC[N@H+](C)Cc1ccc(C(=O)[O-])cc1[O-] ZINC001231447392 777220796 /nfs/dbraw/zinc/22/07/96/777220796.db2.gz SGIRTZYUYHOMEN-UHFFFAOYSA-N -1 3 251.326 2.712 20 10 CFCDHM CCCCC[N@@H+](C)Cc1ccc(C(=O)[O-])cc1[O-] ZINC001231447392 777220803 /nfs/dbraw/zinc/22/08/03/777220803.db2.gz SGIRTZYUYHOMEN-UHFFFAOYSA-N -1 3 251.326 2.712 20 10 CFCDHM Cc1cccc2c1CN(Cc1ccc(C(=O)[O-])cc1O)C2 ZINC001231445657 777221985 /nfs/dbraw/zinc/22/19/85/777221985.db2.gz AGCMMBZSCDREAU-UHFFFAOYSA-N -1 3 283.327 2.915 20 10 CFCDHM O=C([O-])c1ccc(C[N@@H+]2CCC[C@@H](C(F)F)C2)c([O-])c1 ZINC001231452674 777223139 /nfs/dbraw/zinc/22/31/39/777223139.db2.gz RFCFGCZCFKPMMO-LLVKDONJSA-N -1 3 285.290 2.568 20 10 CFCDHM O=C([O-])c1ccc(C[N@H+]2CCC[C@@H](C(F)F)C2)c([O-])c1 ZINC001231452674 777223145 /nfs/dbraw/zinc/22/31/45/777223145.db2.gz RFCFGCZCFKPMMO-LLVKDONJSA-N -1 3 285.290 2.568 20 10 CFCDHM C[C@@H]1CC[N@H+](Cc2cc(C(=O)[O-])ccc2[O-])CCC1(F)F ZINC001231561692 777260624 /nfs/dbraw/zinc/26/06/24/777260624.db2.gz YPQKLARWARWUMU-SNVBAGLBSA-N -1 3 299.317 2.958 20 10 CFCDHM C[C@@H]1CC[N@@H+](Cc2cc(C(=O)[O-])ccc2[O-])CCC1(F)F ZINC001231561692 777260631 /nfs/dbraw/zinc/26/06/31/777260631.db2.gz YPQKLARWARWUMU-SNVBAGLBSA-N -1 3 299.317 2.958 20 10 CFCDHM C[C@@H]1CC[N@H+](Cc2cc(C(=O)[O-])ccc2[O-])[C@H](C)C1 ZINC001231564072 777260873 /nfs/dbraw/zinc/26/08/73/777260873.db2.gz HYOIERIYCPMRQM-GHMZBOCLSA-N -1 3 263.337 2.711 20 10 CFCDHM C[C@@H]1CC[N@@H+](Cc2cc(C(=O)[O-])ccc2[O-])[C@H](C)C1 ZINC001231564072 777260878 /nfs/dbraw/zinc/26/08/78/777260878.db2.gz HYOIERIYCPMRQM-GHMZBOCLSA-N -1 3 263.337 2.711 20 10 CFCDHM O=C([O-])c1ccc([O-])c(C[N@@H+]2CCCCC23CC3)c1 ZINC001231565548 777261706 /nfs/dbraw/zinc/26/17/06/777261706.db2.gz FKKDFXQZDYPGDX-UHFFFAOYSA-N -1 3 261.321 2.609 20 10 CFCDHM O=C([O-])c1ccc([O-])c(C[N@H+]2CCCCC23CC3)c1 ZINC001231565548 777261716 /nfs/dbraw/zinc/26/17/16/777261716.db2.gz FKKDFXQZDYPGDX-UHFFFAOYSA-N -1 3 261.321 2.609 20 10 CFCDHM C[C@@H]1C[C@@H](C)C[NH+](Cc2cc(C(=O)[O-])ccc2[O-])C1 ZINC001231564867 777261852 /nfs/dbraw/zinc/26/18/52/777261852.db2.gz JDCLDNFEIWHYHO-GHMZBOCLSA-N -1 3 263.337 2.568 20 10 CFCDHM Cc1cc([O-])c(CN2CCC(=O)C[C@@H]2C)cc1Cl ZINC001231867453 777357654 /nfs/dbraw/zinc/35/76/54/777357654.db2.gz KUUZHXQTYKFMGV-JTQLQIEISA-N -1 3 267.756 2.907 20 10 CFCDHM [O-]c1c(CN2CC[C@H]3OCC[C@H]32)cccc1C(F)(F)F ZINC001233416623 777942641 /nfs/dbraw/zinc/94/26/41/777942641.db2.gz PBSTZIDFGWNSSO-VXGBXAGGSA-N -1 3 287.281 2.774 20 10 CFCDHM CO[C@H](C)C1CN(Cc2cccc(C(F)(F)F)c2[O-])C1 ZINC001233418936 777942834 /nfs/dbraw/zinc/94/28/34/777942834.db2.gz CFOWUHPPKDQVKY-SECBINFHSA-N -1 3 289.297 2.878 20 10 CFCDHM [O-]c1cc(C(F)(F)F)ccc1CN1C[C@@H](F)[C@H](F)C1 ZINC001233452051 777956962 /nfs/dbraw/zinc/95/69/62/777956962.db2.gz IRZJMZZQXLFGFI-NXEZZACHSA-N -1 3 281.224 2.903 20 10 CFCDHM C[C@@H]1C[C@@H](O)CN1Cc1cc(Cl)c(Cl)cc1[O-] ZINC001236792059 778939151 /nfs/dbraw/zinc/93/91/51/778939151.db2.gz AXNMWKRQDMXNKV-VXNVDRBHSA-N -1 3 276.163 2.654 20 10 CFCDHM [O-]c1cc(Cl)c(Cl)cc1CN1CC2(C1)CCOC2 ZINC001236793673 778939329 /nfs/dbraw/zinc/93/93/29/778939329.db2.gz NGSPZUALDITSQV-UHFFFAOYSA-N -1 3 288.174 2.921 20 10 CFCDHM COc1cc([O-])c(CN2C[C@@H](C)[C@@H](F)C2)c(Cl)c1 ZINC001236800478 778943153 /nfs/dbraw/zinc/94/31/53/778943153.db2.gz ZNVGUSMQJOJCPP-PELKAZGASA-N -1 3 273.735 2.844 20 10 CFCDHM COc1cc([O-])c(CN2CCC(=O)C(C)(C)C2)c(Cl)c1 ZINC001236804505 778944884 /nfs/dbraw/zinc/94/48/84/778944884.db2.gz VRLHQANRQJDFBS-UHFFFAOYSA-N -1 3 297.782 2.855 20 10 CFCDHM COc1cc([O-])c(CN2CCCC[C@H]2C(C)=O)c(Cl)c1 ZINC001236807916 778947155 /nfs/dbraw/zinc/94/71/55/778947155.db2.gz LALARRSMJJWOJX-AWEZNQCLSA-N -1 3 297.782 2.998 20 10 CFCDHM [O-]c1ccc(Cl)c(Cl)c1CN1CC(C2COC2)C1 ZINC001237077087 779004519 /nfs/dbraw/zinc/00/45/19/779004519.db2.gz CKIRZXNTMSHGKU-UHFFFAOYSA-N -1 3 288.174 2.777 20 10 CFCDHM CC(=O)[C@@H]1CCCN(Cc2c([O-])ccc(F)c2Cl)C1 ZINC001237127238 779021737 /nfs/dbraw/zinc/02/17/37/779021737.db2.gz XLJAOYLQDJWXOE-SNVBAGLBSA-N -1 3 285.746 2.986 20 10 CFCDHM C[C@@H]1CN(Cc2cc(Cl)cc(F)c2[O-])CC[C@@]1(C)O ZINC001237617911 779144721 /nfs/dbraw/zinc/14/47/21/779144721.db2.gz UDUYFNFCMJPVQD-YMTOWFKASA-N -1 3 287.762 2.778 20 10 CFCDHM C[C@@H]1CCCN(Cc2cc(Cl)cc(F)c2[O-])[C@@H]1CO ZINC001237618395 779145619 /nfs/dbraw/zinc/14/56/19/779145619.db2.gz ZSLDZUHZBBYQLE-NOZJJQNGSA-N -1 3 287.762 2.778 20 10 CFCDHM [O-]c1c(Cl)cc(F)cc1CN1CC[C@]2(CCCO2)C1 ZINC001237800695 779182053 /nfs/dbraw/zinc/18/20/53/779182053.db2.gz AOXKLWZZPQBIGK-CQSZACIVSA-N -1 3 285.746 2.940 20 10 CFCDHM COC1CCN(Cc2cc(F)c(Cl)cc2[O-])CC1 ZINC001237947501 779214566 /nfs/dbraw/zinc/21/45/66/779214566.db2.gz QBTXIIDXWWYALL-UHFFFAOYSA-N -1 3 273.735 2.796 20 10 CFCDHM Cc1cc(C(=O)[O-])ccc1C[N@@H+]1CCc2cccc([O-])c2C1 ZINC001238146487 779261817 /nfs/dbraw/zinc/26/18/17/779261817.db2.gz XBDDVEDPVAPAQP-UHFFFAOYSA-N -1 3 297.354 2.957 20 10 CFCDHM Cc1cc(C(=O)[O-])ccc1C[N@H+]1CCc2cccc([O-])c2C1 ZINC001238146487 779261819 /nfs/dbraw/zinc/26/18/19/779261819.db2.gz XBDDVEDPVAPAQP-UHFFFAOYSA-N -1 3 297.354 2.957 20 10 CFCDHM [O-]c1c(CNc2cncnc2)cc(Cl)c2cccnc12 ZINC001168521703 779432279 /nfs/dbraw/zinc/43/22/79/779432279.db2.gz HKXDPYHIRPQHHA-UHFFFAOYSA-N -1 3 286.722 2.996 20 10 CFCDHM [O-]c1cccc(Cl)c1CN1CCO[C@H](CCF)C1 ZINC000700591446 780702878 /nfs/dbraw/zinc/70/28/78/780702878.db2.gz NFLIQWGERODWKH-SNVBAGLBSA-N -1 3 273.735 2.606 20 10 CFCDHM [O-]c1ccc(Cl)cc1CN1CCO[C@@H](CCF)C1 ZINC000700593404 780704220 /nfs/dbraw/zinc/70/42/20/780704220.db2.gz UMMSSVVQJIQXFG-LBPRGKRZSA-N -1 3 273.735 2.606 20 10 CFCDHM O=C(c1cccc(O)c1[O-])N1CCCC2(CC2)CC1 ZINC000702584521 780935559 /nfs/dbraw/zinc/93/55/59/780935559.db2.gz QIKAEUNZVPBBPC-UHFFFAOYSA-N -1 3 261.321 2.504 20 10 CFCDHM O=C(c1cccc(O)c1[O-])N1CC[C@H](C2CCCC2)C1 ZINC000708850412 781283156 /nfs/dbraw/zinc/28/31/56/781283156.db2.gz OUXYSYGVHWWVIT-LBPRGKRZSA-N -1 3 275.348 2.750 20 10 CFCDHM CN(C)c1ccc(CNCc2ccccc2CC(=O)[O-])cc1 ZINC000277084837 282290340 /nfs/dbraw/zinc/29/03/40/282290340.db2.gz WXDYJRRPFGXXDA-UHFFFAOYSA-N -1 3 298.386 2.670 20 10 CFCDHM Cc1cc(CNCc2cc(Br)ccc2[O-])on1 ZINC000105455474 375790296 /nfs/dbraw/zinc/79/02/96/375790296.db2.gz NZFMCYYJIDCRAE-UHFFFAOYSA-N -1 3 297.152 2.741 20 10 CFCDHM CC(C)C[C@H](C)N(C)C(=O)CN(C)Cc1ccccc1[O-] ZINC000111235009 375833871 /nfs/dbraw/zinc/83/38/71/375833871.db2.gz INNNWVPTWNBJJS-AWEZNQCLSA-N -1 3 292.423 2.717 20 10 CFCDHM CCN(C(=O)c1cccc(O)c1[O-])C1CCCCC1 ZINC000126221424 377217492 /nfs/dbraw/zinc/21/74/92/377217492.db2.gz AQISJERONXHULT-UHFFFAOYSA-N -1 3 263.337 2.893 20 10 CFCDHM CCCOc1ccc(CN2CCOCC2(C)C)c([O-])c1 ZINC000133553935 377940390 /nfs/dbraw/zinc/94/03/90/377940390.db2.gz MOJLPZXVNWZXIP-UHFFFAOYSA-N -1 3 279.380 2.792 20 10 CFCDHM CS[C@@H]1CCC[C@@H](NC(=O)c2ccc(C)c(O)c2[O-])C1 ZINC000177686765 380367386 /nfs/dbraw/zinc/36/73/86/380367386.db2.gz RZQQHLMFAGOXJQ-GHMZBOCLSA-N -1 3 295.404 2.810 20 10 CFCDHM CCN(C(=O)c1ccc(C)c(O)c1[O-])c1nc(C)cs1 ZINC000179521212 380553106 /nfs/dbraw/zinc/55/31/06/380553106.db2.gz WRPLECWDBGHCNZ-UHFFFAOYSA-N -1 3 292.360 2.838 20 10 CFCDHM C[C@@H]1CN(Cc2cccc(Cl)c2[O-])CCS1 ZINC000180041552 380613495 /nfs/dbraw/zinc/61/34/95/380613495.db2.gz KNQLQIUJSSAXSO-SECBINFHSA-N -1 3 257.786 2.983 20 10 CFCDHM CCC[N@H+](CCCCC(=O)[O-])Cc1ccccc1[O-] ZINC000181551751 380825333 /nfs/dbraw/zinc/82/53/33/380825333.db2.gz GQNJDUCJBRZGBV-UHFFFAOYSA-N -1 3 265.353 2.859 20 10 CFCDHM CCC[N@@H+](CCCCC(=O)[O-])Cc1ccccc1[O-] ZINC000181551751 380825339 /nfs/dbraw/zinc/82/53/39/380825339.db2.gz GQNJDUCJBRZGBV-UHFFFAOYSA-N -1 3 265.353 2.859 20 10 CFCDHM CO[C@H]1C[C@@H](N(C)Cc2c([O-])cccc2Cl)C1 ZINC000289091211 381025778 /nfs/dbraw/zinc/02/57/78/381025778.db2.gz BNNKVPIGMWKUOZ-AOOOYVTPSA-N -1 3 255.745 2.655 20 10 CFCDHM CC[C@@H](NCc1nnc(C2CC2)[nH]1)c1ccc(F)cc1[O-] ZINC000296620088 381476016 /nfs/dbraw/zinc/47/60/16/381476016.db2.gz WURJSTWQUABYLB-GFCCVEGCSA-N -1 3 290.342 2.768 20 10 CFCDHM CCn1ccnc1CN[C@H](C)c1ccc(F)cc1[O-] ZINC000296605517 381468463 /nfs/dbraw/zinc/46/84/63/381468463.db2.gz VYEMDGASPGUFGK-SNVBAGLBSA-N -1 3 263.316 2.599 20 10 CFCDHM CCc1nnc(CN[C@@H]2CCc3cccc([O-])c32)s1 ZINC000297461111 381560818 /nfs/dbraw/zinc/56/08/18/381560818.db2.gz XTZKDXZFYUJPIM-SNVBAGLBSA-N -1 3 275.377 2.583 20 10 CFCDHM CC(=O)c1cc(Cl)cc(CN2CCOC[C@H](C)C2)c1[O-] ZINC000374367822 382045356 /nfs/dbraw/zinc/04/53/56/382045356.db2.gz SDZJRDWZFTUGCM-SNVBAGLBSA-N -1 3 297.782 2.717 20 10 CFCDHM Cc1cnn(C2CN(Cc3cc(Cl)cc(C)c3[O-])C2)c1 ZINC000375840045 382105408 /nfs/dbraw/zinc/10/54/08/382105408.db2.gz KNZIBIOWYUAWOL-UHFFFAOYSA-N -1 3 291.782 2.916 20 10 CFCDHM CCCOc1ccc(CN2CCO[C@H](C3CC3)C2)c([O-])c1 ZINC000375332057 382082435 /nfs/dbraw/zinc/08/24/35/382082435.db2.gz NKKVWIILFHUAOJ-KRWDZBQOSA-N -1 3 291.391 2.792 20 10 CFCDHM [O-]c1ccc(Cl)c(F)c1CN1CCCC[C@H](CO)C1 ZINC000377234822 382237525 /nfs/dbraw/zinc/23/75/25/382237525.db2.gz AYBDPJLBFWBIRF-JTQLQIEISA-N -1 3 287.762 2.779 20 10 CFCDHM Cc1nnsc1CNCc1cc(Cl)c(F)cc1[O-] ZINC000293991327 382369828 /nfs/dbraw/zinc/36/98/28/382369828.db2.gz SAPMYRBAIPMUEE-UHFFFAOYSA-N -1 3 287.747 2.634 20 10 CFCDHM COC[C@]1(C)CCN(Cc2cc(F)cc(C(C)=O)c2[O-])C1 ZINC000294130016 382428052 /nfs/dbraw/zinc/42/80/52/382428052.db2.gz FJWCZDKVSUQNEV-MRXNPFEDSA-N -1 3 295.354 2.592 20 10 CFCDHM [O-]c1ccc(F)cc1CNc1ccc(OC2COC2)cc1 ZINC000188850651 382491410 /nfs/dbraw/zinc/49/14/10/382491410.db2.gz HNVRALUVWDNISO-UHFFFAOYSA-N -1 3 289.306 2.921 20 10 CFCDHM CS[C@H]1CCN(Cc2cc(F)cc(C(C)=O)c2[O-])C1 ZINC000294434342 382513833 /nfs/dbraw/zinc/51/38/33/382513833.db2.gz PVVKMKULQBARMM-LBPRGKRZSA-N -1 3 283.368 2.671 20 10 CFCDHM CO[C@@H]1CCCN(Cc2cc(Cl)c(F)cc2[O-])C1 ZINC000295295847 382610615 /nfs/dbraw/zinc/61/06/15/382610615.db2.gz JMDZQGPVYXSUEU-SNVBAGLBSA-N -1 3 273.735 2.796 20 10 CFCDHM O=C(N[C@H](c1ccccn1)C1CCC1)c1cccc(O)c1[O-] ZINC000529828674 383758986 /nfs/dbraw/zinc/75/89/86/383758986.db2.gz CTFYKIVKDACYKC-HNNXBMFYSA-N -1 3 298.342 2.764 20 10 CFCDHM CCCN(CC(F)F)C(=O)c1ccc(C)c(O)c1[O-] ZINC000267561165 384414057 /nfs/dbraw/zinc/41/40/57/384414057.db2.gz GMSIHKMMFLIUAM-UHFFFAOYSA-N -1 3 273.279 2.524 20 10 CFCDHM [O-]c1cccc(Cl)c1CN1CCS[C@@H]2COCC[C@H]21 ZINC000271295806 385379364 /nfs/dbraw/zinc/37/93/64/385379364.db2.gz SEGGYCPYRRUKDK-TZMCWYRMSA-N -1 3 299.823 2.752 20 10 CFCDHM Cc1noc(C2CCN(Cc3cccc(F)c3[O-])CC2)n1 ZINC000272252263 385487706 /nfs/dbraw/zinc/48/77/06/385487706.db2.gz IPEPERWQDVLCRS-UHFFFAOYSA-N -1 3 291.326 2.602 20 10 CFCDHM C[C@H](NCc1nccn1C)c1cc(Cl)ccc1[O-] ZINC000273613419 385691502 /nfs/dbraw/zinc/69/15/02/385691502.db2.gz WTPVYBBCVFAFMG-VIFPVBQESA-N -1 3 265.744 2.630 20 10 CFCDHM CC[C@@H](c1ccccc1[O-])N1CCn2cc(C)nc2C1 ZINC000372601467 393452584 /nfs/dbraw/zinc/45/25/84/393452584.db2.gz SOAAGZYARBIUGD-AWEZNQCLSA-N -1 3 271.364 2.864 20 10 CFCDHM CCOc1ccccc1N(C)C(=O)/C=C/c1cncc([O-])c1 ZINC000182159012 393507870 /nfs/dbraw/zinc/50/78/70/393507870.db2.gz KRNQMYCOXHOMSW-CMDGGOBGSA-N -1 3 298.342 2.862 20 10 CFCDHM CCC(C)(C)NC(=O)[C@@H](C)N(C)Cc1ccccc1[O-] ZINC000109772292 393879645 /nfs/dbraw/zinc/87/96/45/393879645.db2.gz CEEXGGWSAQEPPU-GFCCVEGCSA-N -1 3 278.396 2.517 20 10 CFCDHM Cc1ccc([C@H](C)NCc2ncnn2C(C)(C)C)c([O-])c1 ZINC000281922111 394094944 /nfs/dbraw/zinc/09/49/44/394094944.db2.gz AOIBUUCNEITMJU-LBPRGKRZSA-N -1 3 288.395 2.898 20 10 CFCDHM CCC[C@H]1CCCCN1C(=O)c1cccc(O)c1[O-] ZINC000126517545 394029577 /nfs/dbraw/zinc/02/95/77/394029577.db2.gz ZDQMANCNVHSVCX-NSHDSACASA-N -1 3 263.337 2.893 20 10 CFCDHM CC[C@@H](NCc1nncn1CC)c1cccc(Cl)c1[O-] ZINC000287547424 394207204 /nfs/dbraw/zinc/20/72/04/394207204.db2.gz FKHCUHCDRKFWOH-GFCCVEGCSA-N -1 3 294.786 2.898 20 10 CFCDHM O=C(/C=C\c1cncc([O-])c1)N1CCc2cccc(F)c21 ZINC000493261863 394193820 /nfs/dbraw/zinc/19/38/20/394193820.db2.gz DCTQVAKAMDERDL-PLNGDYQASA-N -1 3 284.290 2.529 20 10 CFCDHM Cc1ccc(C(=O)N2CCCC3(CCC3)C2)c([O-])c1O ZINC000366246332 292051026 /nfs/dbraw/zinc/05/10/26/292051026.db2.gz FQAHRPHGEWCWDZ-UHFFFAOYSA-N -1 3 275.348 2.813 20 10 CFCDHM Cc1ccc(C(=O)N2CCC[C@@H](C)[C@H]2C)c([O-])c1O ZINC000182499779 292052781 /nfs/dbraw/zinc/05/27/81/292052781.db2.gz MZOZSMHCPARLRG-MWLCHTKSSA-N -1 3 263.337 2.667 20 10 CFCDHM COc1c([O-])c(CN2CCC[C@](C)(F)C2)ccc1[N+](=O)[O-] ZINC000296119844 286187141 /nfs/dbraw/zinc/18/71/41/286187141.db2.gz SYBCMIQDBZKZRV-AWEZNQCLSA-N -1 3 298.314 2.633 20 10 CFCDHM O=C(N[C@H]1C[C@H](c2ccccc2)C1)c1cccc(O)c1[O-] ZINC000366699733 263151248 /nfs/dbraw/zinc/15/12/48/263151248.db2.gz JLOATGCCGITGJM-JOCQHMNTSA-N -1 3 283.327 2.774 20 10 CFCDHM [O-]c1ccc(Cl)c(F)c1CN1CC[C@H]2OCC[C@H]2C1 ZINC000369669434 267258375 /nfs/dbraw/zinc/25/83/75/267258375.db2.gz ABGKYQFZTBGBFZ-TVQRCGJNSA-N -1 3 285.746 2.796 20 10 CFCDHM CC[C@@H](NCc1cnnn1CC)c1cc(Cl)ccc1[O-] ZINC000527913917 330294966 /nfs/dbraw/zinc/29/49/66/330294966.db2.gz CGTUVGCFFMYVBV-CYBMUJFWSA-N -1 3 294.786 2.898 20 10 CFCDHM CCn1nncc1CN[C@@H](C)c1cc(Cl)ccc1[O-] ZINC000527920102 330295606 /nfs/dbraw/zinc/29/56/06/330295606.db2.gz MFDWKCDPVRBVQL-VIFPVBQESA-N -1 3 280.759 2.508 20 10 CFCDHM CCn1ncc(CN[C@H](C)c2cc(Cl)ccc2[O-])n1 ZINC000527922209 330295910 /nfs/dbraw/zinc/29/59/10/330295910.db2.gz CUECXALKQSFDLP-SECBINFHSA-N -1 3 280.759 2.508 20 10 CFCDHM CCC[C@H](C)C(=O)NCCNCc1c([O-])cccc1Cl ZINC000292684889 520998702 /nfs/dbraw/zinc/99/87/02/520998702.db2.gz NBPQOBAOFAYOQY-NSHDSACASA-N -1 3 298.814 2.688 20 10 CFCDHM CC(=O)c1cc(F)cc(CN(C)Cc2nccs2)c1[O-] ZINC000079474123 518283760 /nfs/dbraw/zinc/28/37/60/518283760.db2.gz JEEXXHJOHJXJBJ-UHFFFAOYSA-N -1 3 294.351 2.822 20 10 CFCDHM CC(C)(C)[C@@H]1CCCN(C(=O)c2cccc(O)c2[O-])C1 ZINC000280547368 518937253 /nfs/dbraw/zinc/93/72/53/518937253.db2.gz NLRSCFWBGOBQHB-LLVKDONJSA-N -1 3 277.364 2.996 20 10 CFCDHM CCC[C@H](C(=O)OCC)N(C)Cc1ccccc1[O-] ZINC000077284297 520991372 /nfs/dbraw/zinc/99/13/72/520991372.db2.gz IBLNDRPSFOSOBL-CYBMUJFWSA-N -1 3 265.353 2.556 20 10 CFCDHM CCC[C@]1(COC)CCCN1C(=O)c1cccc(O)c1[O-] ZINC000278107964 521322099 /nfs/dbraw/zinc/32/20/99/521322099.db2.gz RHGVDHFKMJYDHF-MRXNPFEDSA-N -1 3 293.363 2.519 20 10 CFCDHM CN(CC(=O)NC1CCCCCC1)Cc1ccccc1[O-] ZINC000264628502 522471333 /nfs/dbraw/zinc/47/13/33/522471333.db2.gz UHPYPDYQEGVHPB-UHFFFAOYSA-N -1 3 290.407 2.663 20 10 CFCDHM COC[C@H]1CCN1Cc1cc(Cl)cc(C)c1[O-] ZINC000293738915 522851947 /nfs/dbraw/zinc/85/19/47/522851947.db2.gz VNZMACFPVMNDNE-GFCCVEGCSA-N -1 3 255.745 2.575 20 10 CFCDHM CN(Cc1ccccc1[O-])c1nc2ccccc2c(=O)[nH]1 ZINC000302679637 523387917 /nfs/dbraw/zinc/38/79/17/523387917.db2.gz WBQMHNBDPQDLIE-UHFFFAOYSA-N -1 3 281.315 2.677 20 10 CFCDHM COC(=O)[C@H]1CCN(Cc2c([O-])cccc2Cl)C[C@H]1C ZINC000276424095 523962406 /nfs/dbraw/zinc/96/24/06/523962406.db2.gz GNUBZPVGICPNOY-MNOVXSKESA-N -1 3 297.782 2.677 20 10 CFCDHM C[C@@H](NCc1ncccc1N(C)C)c1ccc(F)cc1[O-] ZINC000289839999 525560894 /nfs/dbraw/zinc/56/08/94/525560894.db2.gz PVCUEASEZRHIEW-LLVKDONJSA-N -1 3 289.354 2.843 20 10 CFCDHM Cc1ccc(C(=O)N2CCC[C@H]2c2cccnc2)c([O-])c1O ZINC000365009704 526108946 /nfs/dbraw/zinc/10/89/46/526108946.db2.gz HZATUAOPENKRCP-AWEZNQCLSA-N -1 3 298.342 2.779 20 10 CFCDHM Cc1cnn([C@H]2CCN(Cc3cccc(Cl)c3[O-])C2)c1 ZINC000290929622 526268928 /nfs/dbraw/zinc/26/89/28/526268928.db2.gz OUMDJTZENBDYCK-ZDUSSCGKSA-N -1 3 291.782 2.998 20 10 CFCDHM [O-]c1c(F)cccc1CN1CCO[C@@H]2CCCC[C@H]21 ZINC000228003985 526329590 /nfs/dbraw/zinc/32/95/90/526329590.db2.gz JTAKNAGFTQEZMZ-ZIAGYGMSSA-N -1 3 265.328 2.675 20 10 CFCDHM [O-]c1c(F)cccc1CN[C@@H]1COc2ccccc21 ZINC000158772992 526331326 /nfs/dbraw/zinc/33/13/26/526331326.db2.gz PVNPPIFUPLJOFC-CYBMUJFWSA-N -1 3 259.280 2.755 20 10 CFCDHM [O-]c1cccc(Cl)c1CN1CCO[C@H]2CCC[C@H]21 ZINC000228144129 526363303 /nfs/dbraw/zinc/36/33/03/526363303.db2.gz UQGSFIYKHRQAEX-OCCSQVGLSA-N -1 3 267.756 2.799 20 10 CFCDHM Cc1nc(CNCc2cccc(F)c2[O-])c2n1CCCC2 ZINC000361908974 526888813 /nfs/dbraw/zinc/88/88/13/526888813.db2.gz RJOYMLBEBRZBTI-UHFFFAOYSA-N -1 3 289.354 2.662 20 10 CFCDHM C[C@H](C[N@H+](Cc1cc2c(cc1[O-])CCC2)C1CC1)C(=O)[O-] ZINC000736581633 574060901 /nfs/dbraw/zinc/06/09/01/574060901.db2.gz BOAXIOUCPMABHK-LLVKDONJSA-N -1 3 289.375 2.566 20 10 CFCDHM C[C@H](C[N@@H+](Cc1cc2c(cc1[O-])CCC2)C1CC1)C(=O)[O-] ZINC000736581633 574060903 /nfs/dbraw/zinc/06/09/03/574060903.db2.gz BOAXIOUCPMABHK-LLVKDONJSA-N -1 3 289.375 2.566 20 10 CFCDHM Cc1cccc(OCCN(C)C(=O)c2cc([O-])cs2)c1 ZINC000731871011 574131360 /nfs/dbraw/zinc/13/13/60/574131360.db2.gz ULECHZWSCXTWNJ-UHFFFAOYSA-N -1 3 291.372 2.913 20 10 CFCDHM CC(=O)Nc1ccc(C)c(NC(=O)c2cc([O-])cs2)c1 ZINC000731869351 574132873 /nfs/dbraw/zinc/13/28/73/574132873.db2.gz FTBXPLWSXPWJKQ-UHFFFAOYSA-N -1 3 290.344 2.973 20 10 CFCDHM CC(C)N(C(=O)[C@H](C)OC(=O)c1cc([O-])cs1)C(C)C ZINC000731910211 574133220 /nfs/dbraw/zinc/13/32/20/574133220.db2.gz OUQIIOQYXKVRBD-JTQLQIEISA-N -1 3 299.392 2.644 20 10 CFCDHM O=C(NCCCOc1ccccc1)c1cc([O-])cs1 ZINC000732259433 574147780 /nfs/dbraw/zinc/14/77/80/574147780.db2.gz RJAFJJADAPEWEN-UHFFFAOYSA-N -1 3 277.345 2.653 20 10 CFCDHM CCN(CCC(F)(F)F)C(=O)c1cc([O-])cs1 ZINC000732279930 574150259 /nfs/dbraw/zinc/15/02/59/574150259.db2.gz UXUIDIUEOJUJEV-UHFFFAOYSA-N -1 3 267.272 2.868 20 10 CFCDHM O=C(NC[C@@H]1CCc2ccccc21)c1cc([O-])cs1 ZINC000732292841 574150538 /nfs/dbraw/zinc/15/05/38/574150538.db2.gz ANIIDOBXPNOSKA-NSHDSACASA-N -1 3 273.357 2.914 20 10 CFCDHM O=C(NCCOc1ccc(F)cc1F)c1cc([O-])cs1 ZINC000732289111 574150604 /nfs/dbraw/zinc/15/06/04/574150604.db2.gz LAHDCEWZJYYBGG-UHFFFAOYSA-N -1 3 299.298 2.541 20 10 CFCDHM O=C(OCc1cc(F)ccc1[N+](=O)[O-])c1cc([O-])cs1 ZINC000732354031 574153141 /nfs/dbraw/zinc/15/31/41/574153141.db2.gz YQGYQIJVDKVLKN-UHFFFAOYSA-N -1 3 297.263 2.858 20 10 CFCDHM COc1ccc(OC)c(COC(=O)c2cc([O-])cs2)c1 ZINC000732354363 574153190 /nfs/dbraw/zinc/15/31/90/574153190.db2.gz KEWFRUXEJNGLOL-UHFFFAOYSA-N -1 3 294.328 2.828 20 10 CFCDHM COc1ccccc1OCCOC(=O)c1cc([O-])cs1 ZINC000732354977 574153432 /nfs/dbraw/zinc/15/34/32/574153432.db2.gz YLUMWFKAKCUTDO-UHFFFAOYSA-N -1 3 294.328 2.698 20 10 CFCDHM COc1cccc(C[C@@H](C)NC(=O)c2cc([O-])cs2)c1 ZINC000733002984 574182405 /nfs/dbraw/zinc/18/24/05/574182405.db2.gz QIUPQWRQLBSVHD-SNVBAGLBSA-N -1 3 291.372 2.823 20 10 CFCDHM CCS[C@@H]1CCC[C@H]1NC(=O)c1cc([O-])cs1 ZINC000755831637 574191133 /nfs/dbraw/zinc/19/11/33/574191133.db2.gz HTBOHMWLQSZEOS-NXEZZACHSA-N -1 3 271.407 2.858 20 10 CFCDHM O=C(OCC1CCC2(CC1)OCCO2)c1cc([O-])cs1 ZINC000753394287 574201457 /nfs/dbraw/zinc/20/14/57/574201457.db2.gz DCTBHDHWKULKKA-UHFFFAOYSA-N -1 3 298.360 2.544 20 10 CFCDHM CO[C@@H](CNCc1c([O-])cccc1Cl)C(F)(F)F ZINC000733328886 574221815 /nfs/dbraw/zinc/22/18/15/574221815.db2.gz GJOWNOUATOFJDP-JTQLQIEISA-N -1 3 283.677 2.713 20 10 CFCDHM Cc1cc(CN[C@@H](C)c2cc(F)cc(F)c2[O-])on1 ZINC000756542642 574244768 /nfs/dbraw/zinc/24/47/68/574244768.db2.gz CGXPDAOIGJUESP-QMMMGPOBSA-N -1 3 268.263 2.818 20 10 CFCDHM O=C(Nc1ncc(Cl)s1)c1cc([O-])cs1 ZINC000748343402 574247887 /nfs/dbraw/zinc/24/78/87/574247887.db2.gz WJKQBVCZUKJEJP-UHFFFAOYSA-N -1 3 260.727 2.816 20 10 CFCDHM CCc1cc(CN[C@@H](C)c2ccc(F)cc2[O-])on1 ZINC000756612806 574251792 /nfs/dbraw/zinc/25/17/92/574251792.db2.gz YFKNKOHDUKKRKK-VIFPVBQESA-N -1 3 264.300 2.933 20 10 CFCDHM C[C@@H](N[C@@H](C)c1cc(F)cc(F)c1[O-])c1cnn(C)c1 ZINC000756603367 574251868 /nfs/dbraw/zinc/25/18/68/574251868.db2.gz BIMAQZHNPHUQGG-BDAKNGLRSA-N -1 3 281.306 2.816 20 10 CFCDHM Cc1c(CN[C@@H](C)c2cc(F)cc(F)c2[O-])cnn1C ZINC000756776572 574261785 /nfs/dbraw/zinc/26/17/85/574261785.db2.gz QCNQTYVWBQLEQK-QMMMGPOBSA-N -1 3 281.306 2.563 20 10 CFCDHM Cc1cc(CN[C@@H](C)c2cc(F)cc(F)c2[O-])ncn1 ZINC000756777124 574262347 /nfs/dbraw/zinc/26/23/47/574262347.db2.gz VEFKZOZYULQEHV-VIFPVBQESA-N -1 3 279.290 2.620 20 10 CFCDHM CSc1ccc(NC(=O)c2cc([O-])cs2)nc1 ZINC000734880273 574306061 /nfs/dbraw/zinc/30/60/61/574306061.db2.gz KZAPUGUSDMGIFG-UHFFFAOYSA-N -1 3 266.347 2.823 20 10 CFCDHM CC(C)n1ccc(COC(=O)c2cc([O-])cs2)n1 ZINC000735145255 574315189 /nfs/dbraw/zinc/31/51/89/574315189.db2.gz YXTMQJZDGMKEGB-UHFFFAOYSA-N -1 3 266.322 2.588 20 10 CFCDHM Cn1cc(C(C)(C)NCc2cc(Cl)ccc2[O-])cn1 ZINC000742373429 574325726 /nfs/dbraw/zinc/32/57/26/574325726.db2.gz CWIWOOFHUHKEQG-UHFFFAOYSA-N -1 3 279.771 2.804 20 10 CFCDHM C[C@@]1(c2ccccc2)C[C@@H]1NC(=O)c1cc([O-])cs1 ZINC000743641977 574370006 /nfs/dbraw/zinc/37/00/06/574370006.db2.gz LICSAFGVSLICFC-ZFWWWQNUSA-N -1 3 273.357 2.914 20 10 CFCDHM C[C@@H](NC(=O)c1cc([O-])cs1)c1nc(C(C)(C)C)no1 ZINC000743800285 574372372 /nfs/dbraw/zinc/37/23/72/574372372.db2.gz ULDVAIGLSPPWNF-SSDOTTSWSA-N -1 3 295.364 2.625 20 10 CFCDHM COc1ncc(COC(=O)c2cc([O-])cs2)cc1Cl ZINC000751714792 574381212 /nfs/dbraw/zinc/38/12/12/574381212.db2.gz LHMQIPRSEVIGHC-UHFFFAOYSA-N -1 3 299.735 2.868 20 10 CFCDHM Cc1noc(C)c1[C@@H](C)CNC(=O)c1cc([O-])cs1 ZINC000752632721 574393417 /nfs/dbraw/zinc/39/34/17/574393417.db2.gz XZWBZHMYPJYDIV-ZETCQYMHSA-N -1 3 280.349 2.592 20 10 CFCDHM CO[C@H]1Cc2ccc(NC(=O)c3cc([O-])cs3)cc2C1 ZINC000753498446 574403350 /nfs/dbraw/zinc/40/33/50/574403350.db2.gz OVFCPUANUHNPEQ-ZDUSSCGKSA-N -1 3 289.356 2.820 20 10 CFCDHM Cc1cc(O)c(CN2CC[C@](F)(C(=O)[O-])C2)cc1C(C)C ZINC000832899679 601371563 /nfs/dbraw/zinc/37/15/63/601371563.db2.gz QJBFPXBVSLAKKP-MRXNPFEDSA-N -1 3 295.354 2.823 20 10 CFCDHM CC(C)(C(=O)[O-])[C@H]1CCC[N@H+](Cc2ccccc2[O-])C1 ZINC000135046814 605548063 /nfs/dbraw/zinc/54/80/63/605548063.db2.gz XGVUNUDPPZPEMS-ZDUSSCGKSA-N -1 3 277.364 2.715 20 10 CFCDHM CC(C)(C(=O)[O-])[C@H]1CCC[N@@H+](Cc2ccccc2[O-])C1 ZINC000135046814 605548068 /nfs/dbraw/zinc/54/80/68/605548068.db2.gz XGVUNUDPPZPEMS-ZDUSSCGKSA-N -1 3 277.364 2.715 20 10 CFCDHM CC(C)C[C@H](CNC(=O)[O-])[NH2+][C@H](C)c1ccccc1[O-] ZINC000833793357 606039624 /nfs/dbraw/zinc/03/96/24/606039624.db2.gz DSOITXRZGZLSDT-VXGBXAGGSA-N -1 3 280.368 2.725 20 10 CFCDHM Fc1c(CSc2nccs2)cccc1-c1nnn[n-]1 ZINC000826371810 608673238 /nfs/dbraw/zinc/67/32/38/608673238.db2.gz UZLOIFHWIKUAHS-UHFFFAOYSA-N -1 3 293.352 2.755 20 10 CFCDHM Fc1c(CSc2nccs2)cccc1-c1nn[n-]n1 ZINC000826371810 608673239 /nfs/dbraw/zinc/67/32/39/608673239.db2.gz UZLOIFHWIKUAHS-UHFFFAOYSA-N -1 3 293.352 2.755 20 10 CFCDHM O=C(NCCc1cc2ccccc2[nH]1)c1cccc(O)c1[O-] ZINC000187199651 618274877 /nfs/dbraw/zinc/27/48/77/618274877.db2.gz ZIFVECVZRBRVQW-UHFFFAOYSA-N -1 3 296.326 2.552 20 10 CFCDHM O=C(Nc1ccc(-c2ncc[nH]2)cc1)c1cccc(O)c1[O-] ZINC000188330515 619083485 /nfs/dbraw/zinc/08/34/85/619083485.db2.gz CWRAURPQJIBMQK-UHFFFAOYSA-N -1 3 295.298 2.740 20 10 CFCDHM CC[C@H](N[C@H]1CNOC1)c1cc(Cl)cc(Cl)c1[O-] ZINC000925864927 619189562 /nfs/dbraw/zinc/18/95/62/619189562.db2.gz CSCCRCQJQHVBFZ-KWQFWETISA-N -1 3 291.178 2.643 20 10 CFCDHM [O-]c1c(F)cc(F)cc1CN1CCSC[C@H]1C1CC1 ZINC000894903658 619508426 /nfs/dbraw/zinc/50/84/26/619508426.db2.gz AWDMBVDQUSRAEI-ZDUSSCGKSA-N -1 3 285.359 2.998 20 10 CFCDHM [O-]c1cccc(F)c1CNc1ncnc2c1ncn2C1CC1 ZINC000895833095 619619393 /nfs/dbraw/zinc/61/93/93/619619393.db2.gz SWJSQCJOQLLJTR-UHFFFAOYSA-N -1 3 299.309 2.618 20 10 CFCDHM CC(C)(C)c1ncc(CNCc2c([O-])cccc2F)cn1 ZINC000896636910 619780103 /nfs/dbraw/zinc/78/01/03/619780103.db2.gz GMVNTRHUBDSTAV-UHFFFAOYSA-N -1 3 289.354 2.909 20 10 CFCDHM CCOC(=O)c1ccc(CNCc2c([O-])cccc2F)o1 ZINC000896637627 619780584 /nfs/dbraw/zinc/78/05/84/619780584.db2.gz PJCIMDVKAAZQHU-UHFFFAOYSA-N -1 3 293.294 2.591 20 10 CFCDHM CC(C)(CNC(=O)NCc1c([O-])cccc1F)C1CC1 ZINC000896971069 619907833 /nfs/dbraw/zinc/90/78/33/619907833.db2.gz ZQTXSAJPNJYHRY-UHFFFAOYSA-N -1 3 280.343 2.767 20 10 CFCDHM Cn1nc(C2CC2)cc1CNCc1ccc(F)c(F)c1[O-] ZINC000897224007 619953668 /nfs/dbraw/zinc/95/36/68/619953668.db2.gz DQNREYOFTFFUMI-UHFFFAOYSA-N -1 3 293.317 2.571 20 10 CFCDHM O=C(NCc1c([O-])cccc1F)C1(C(F)(F)F)CCC1 ZINC000928706827 619995939 /nfs/dbraw/zinc/99/59/39/619995939.db2.gz VUSRQUPVECNWGF-UHFFFAOYSA-N -1 3 291.244 2.880 20 10 CFCDHM C[C@@H]1CC[C@H](C(=O)NCc2c([O-])cccc2F)C1 ZINC000928709214 619996421 /nfs/dbraw/zinc/99/64/21/619996421.db2.gz YUHDYDPWTYNRKG-ZJUUUORDSA-N -1 3 251.301 2.584 20 10 CFCDHM CC(C)[C@]1(C)C[C@H]1C(=O)NCc1c([O-])cccc1F ZINC000928708775 619996607 /nfs/dbraw/zinc/99/66/07/619996607.db2.gz TYSGKVZBVFXUPK-NHYWBVRUSA-N -1 3 265.328 2.830 20 10 CFCDHM COc1ccc(F)cc1NC(=O)c1ccc(C)c(O)c1[O-] ZINC000182969925 625403993 /nfs/dbraw/zinc/40/39/93/625403993.db2.gz LICIOTRBPKXXAR-UHFFFAOYSA-N -1 3 291.278 2.806 20 10 CFCDHM O=C(NCc1c([O-])cccc1F)N[C@@H]1C[C@@H]2CCC[C@@H]12 ZINC000898254152 620357767 /nfs/dbraw/zinc/35/77/67/620357767.db2.gz ASWAJAXADRANAI-OPQQBVKSSA-N -1 3 278.327 2.519 20 10 CFCDHM C[C@@H]1CC=CC[C@H]1NC(=O)NCc1c([O-])cccc1F ZINC000898878881 620498322 /nfs/dbraw/zinc/49/83/22/620498322.db2.gz XQTUTMJUBZARNZ-ZWNOBZJWSA-N -1 3 278.327 2.685 20 10 CFCDHM CC(C)[C@H](N[C@@H](C)c1ccc(F)cc1[O-])c1nncn1C ZINC000903066765 621239272 /nfs/dbraw/zinc/23/92/72/621239272.db2.gz XDTPZRUATWKFSX-HZMBPMFUSA-N -1 3 292.358 2.708 20 10 CFCDHM C[C@@H](N(C)C(=O)c1cccc(O)c1[O-])C(C)(C)C ZINC000126343156 623067577 /nfs/dbraw/zinc/06/75/77/623067577.db2.gz SZHQFEBKQDUUGV-SECBINFHSA-N -1 3 251.326 2.604 20 10 CFCDHM O=C(NCCCC1CCCC1)c1cccc(O)c1[O-] ZINC000230101558 623252639 /nfs/dbraw/zinc/25/26/39/623252639.db2.gz PEZGHZVVKLSTAB-UHFFFAOYSA-N -1 3 263.337 2.798 20 10 CFCDHM CCN(CC)C(=O)CN(C)Cc1cc(Cl)c(C)cc1[O-] ZINC000824473497 623511695 /nfs/dbraw/zinc/51/16/95/623511695.db2.gz BFESLRZXQRQLIS-UHFFFAOYSA-N -1 3 298.814 2.654 20 10 CFCDHM Cc1cc([O-])c(CN(C)Cc2cc[nH]n2)cc1Cl ZINC000824778300 623563904 /nfs/dbraw/zinc/56/39/04/623563904.db2.gz RURRFYHXDXMJTR-UHFFFAOYSA-N -1 3 265.744 2.709 20 10 CFCDHM C[C@H]1CCCC[C@H]1NC(=O)NCc1c([O-])cccc1F ZINC000913856855 623623099 /nfs/dbraw/zinc/62/30/99/623623099.db2.gz QQTBGPHBIQGXNU-GXFFZTMASA-N -1 3 280.343 2.909 20 10 CFCDHM CCCc1ncc(CNCc2cccc(F)c2[O-])o1 ZINC000825085929 623625687 /nfs/dbraw/zinc/62/56/87/623625687.db2.gz OGEPOYFFQUDIRC-UHFFFAOYSA-N -1 3 264.300 2.762 20 10 CFCDHM C[C@@H](Cc1ccco1)NC(=O)NCc1c([O-])cccc1F ZINC000914106302 623698428 /nfs/dbraw/zinc/69/84/28/623698428.db2.gz CPJBCHZNSPXIGR-JTQLQIEISA-N -1 3 292.310 2.555 20 10 CFCDHM COC(=O)[C@@]1(C)CCCN1Cc1cc(Cl)c(C)cc1[O-] ZINC000825563406 623716059 /nfs/dbraw/zinc/71/60/59/623716059.db2.gz WSOIZCZZBDMWLE-OAHLLOKOSA-N -1 3 297.782 2.882 20 10 CFCDHM Cc1cc([O-])c(CN2CCC[C@@]23CCOC3=O)cc1Cl ZINC000825567901 623717498 /nfs/dbraw/zinc/71/74/98/623717498.db2.gz OWNWSVQWVXFNHC-HNNXBMFYSA-N -1 3 295.766 2.636 20 10 CFCDHM COC[C@@H]1CN(Cc2cc(Cl)c(C)cc2[O-])C[C@@H](C)O1 ZINC000825634208 623727413 /nfs/dbraw/zinc/72/74/13/623727413.db2.gz JPIQMMOVNXQEPB-YPMHNXCESA-N -1 3 299.798 2.590 20 10 CFCDHM COC1(C)CN(Cc2cc(Cl)c(C)cc2[O-])C1 ZINC000825935685 623771234 /nfs/dbraw/zinc/77/12/34/623771234.db2.gz ZLJSMHNWBARAIZ-UHFFFAOYSA-N -1 3 255.745 2.575 20 10 CFCDHM Cc1cc([O-])c(CN2CCO[C@H](CF)C2)cc1Cl ZINC000826121704 623795650 /nfs/dbraw/zinc/79/56/50/623795650.db2.gz SVYPRAJUKCWXSF-LLVKDONJSA-N -1 3 273.735 2.524 20 10 CFCDHM [O-]c1c(Br)cccc1CNCc1cscn1 ZINC000082367490 625722286 /nfs/dbraw/zinc/72/22/86/625722286.db2.gz FSQRKNGBDUPDOC-UHFFFAOYSA-N -1 3 299.193 2.901 20 10 CFCDHM Cc1csc(C(C)(C)NC(=O)c2cccc(O)c2[O-])n1 ZINC000185675746 625760339 /nfs/dbraw/zinc/76/03/39/625760339.db2.gz NRPNDCGLCIONML-UHFFFAOYSA-N -1 3 292.360 2.528 20 10 CFCDHM CC(C)C[C@H]1CCN(C(=O)c2cccc(O)c2[O-])C1 ZINC000185774591 625775810 /nfs/dbraw/zinc/77/58/10/625775810.db2.gz KJBHWJXBYZLPKX-LLVKDONJSA-N -1 3 263.337 2.606 20 10 CFCDHM C[C@H](NC(=O)NCc1c([O-])cccc1F)C1CCC1 ZINC000921655208 626049906 /nfs/dbraw/zinc/04/99/06/626049906.db2.gz PWHUKERPUYPBAA-VIFPVBQESA-N -1 3 266.316 2.519 20 10 CFCDHM O=C(NCc1c([O-])cccc1F)NOC1CCCCC1 ZINC000922085807 626205650 /nfs/dbraw/zinc/20/56/50/626205650.db2.gz VYBRXRDGHOCORL-UHFFFAOYSA-N -1 3 282.315 2.595 20 10 CFCDHM CC(C)=CCCNC(=O)NCc1c([O-])cccc1F ZINC000922163632 626226660 /nfs/dbraw/zinc/22/66/60/626226660.db2.gz QVMNEJQGDXCRRQ-UHFFFAOYSA-N -1 3 266.316 2.687 20 10 CFCDHM O=C(N[C@H](Cc1ccccc1)C1CC1)c1cccc(O)c1[O-] ZINC000187111554 626454262 /nfs/dbraw/zinc/45/42/62/626454262.db2.gz ZKFNQBPQNUQZRD-OAHLLOKOSA-N -1 3 297.354 2.849 20 10 CFCDHM CN(Cc1ccon1)Cc1cc(Cl)ccc1[O-] ZINC000769467003 627444451 /nfs/dbraw/zinc/44/44/51/627444451.db2.gz QGGKWSFRNJAQGA-UHFFFAOYSA-N -1 3 252.701 2.666 20 10 CFCDHM [O-]c1c(F)cc(Cl)cc1CN1CCC[C@@H](CCO)C1 ZINC000775680817 628054752 /nfs/dbraw/zinc/05/47/52/628054752.db2.gz JPBXDLZGYKHIIV-JTQLQIEISA-N -1 3 287.762 2.779 20 10 CFCDHM CC(=O)c1cc(F)cc(CN2C[C@H](C)O[C@@H](C)[C@H]2C)c1[O-] ZINC000782633423 628651158 /nfs/dbraw/zinc/65/11/58/628651158.db2.gz HIVGSEKMKJUTNY-UMNHJUIQSA-N -1 3 295.354 2.732 20 10 CFCDHM CSc1ccc(CNC(=O)c2cccc(O)c2[O-])cc1 ZINC000784584696 628828964 /nfs/dbraw/zinc/82/89/64/628828964.db2.gz YTKKLBNNDNYPKC-UHFFFAOYSA-N -1 3 289.356 2.750 20 10 CFCDHM C[C@H]1C[C@H](O)CN1Cc1cc(Cl)cc(Cl)c1[O-] ZINC000788269058 629053347 /nfs/dbraw/zinc/05/33/47/629053347.db2.gz KYEHQXDYOCOJTD-XVKPBYJWSA-N -1 3 276.163 2.654 20 10 CFCDHM C[C@@H](NC(=O)c1cccc(O)c1[O-])c1c(F)cccc1F ZINC000790523337 629245085 /nfs/dbraw/zinc/24/50/85/629245085.db2.gz RJJYPSXPNAMYKL-MRVPVSSYSA-N -1 3 293.269 2.867 20 10 CFCDHM Cn1ccc2c1cccc2NC(=O)c1cccc(O)c1[O-] ZINC000790628599 629253679 /nfs/dbraw/zinc/25/36/79/629253679.db2.gz BPHXDWGTNWFAAD-UHFFFAOYSA-N -1 3 282.299 2.842 20 10 CFCDHM O=C(NC[C@@H]1CCc2ccccc2C1)c1cccc(O)c1[O-] ZINC000790742266 629259143 /nfs/dbraw/zinc/25/91/43/629259143.db2.gz ULYZZZYGKCNMSW-GFCCVEGCSA-N -1 3 297.354 2.633 20 10 CFCDHM C[C@]1(c2ccccc2)C[C@H]1NC(=O)c1cccc(O)c1[O-] ZINC000790785318 629262420 /nfs/dbraw/zinc/26/24/20/629262420.db2.gz LMBVCKVFXUPTPG-RHSMWYFYSA-N -1 3 283.327 2.558 20 10 CFCDHM O=C(Nc1scnc1C1CC1)c1cccc(O)c1[O-] ZINC000790909548 629271076 /nfs/dbraw/zinc/27/10/76/629271076.db2.gz VLJBSQRRILDXFS-UHFFFAOYSA-N -1 3 276.317 2.684 20 10 CFCDHM C[C@@H]1CN(Cc2c([O-])ccc(Cl)c2F)[C@@H](C)CN1C ZINC000792173858 629406087 /nfs/dbraw/zinc/40/60/87/629406087.db2.gz DPMCGKGFLXKNHX-ZJUUUORDSA-N -1 3 286.778 2.709 20 10 CFCDHM CN(C(=O)c1cccc(O)c1[O-])c1ccc2cc[nH]c2c1 ZINC000792578685 629435849 /nfs/dbraw/zinc/43/58/49/629435849.db2.gz MXJWECSUMIFDJC-UHFFFAOYSA-N -1 3 282.299 2.856 20 10 CFCDHM Cc1ccc(C(=O)Nc2cn(C)nc2C(C)C)c([O-])c1O ZINC000797763246 630100804 /nfs/dbraw/zinc/10/08/04/630100804.db2.gz JIWYXQLOIAENBE-UHFFFAOYSA-N -1 3 289.335 2.515 20 10 CFCDHM CC(C)(C)CN1C(=O)C(C)(C)N[C@@H]1c1cc(F)ccc1[O-] ZINC000840828936 630538395 /nfs/dbraw/zinc/53/83/95/630538395.db2.gz XXTFRQRCNLOERV-ZDUSSCGKSA-N -1 3 294.370 2.786 20 10 CFCDHM Cc1cc([O-])c(CN2CCO[C@@H](C(F)F)C2)c(Cl)c1 ZINC000840943053 631274310 /nfs/dbraw/zinc/27/43/10/631274310.db2.gz QGDXQXLCJFOBHU-GFCCVEGCSA-N -1 3 291.725 2.820 20 10 CFCDHM CON(C[C@@H]1CCC[C@H](C)C1)C(=O)c1cccc(O)c1[O-] ZINC000812419710 631714290 /nfs/dbraw/zinc/71/42/90/631714290.db2.gz OYLDMCJWHHIMKU-NWDGAFQWSA-N -1 3 293.363 2.928 20 10 CFCDHM Cc1cc(CNCc2cc(Cl)c(F)cc2[O-])no1 ZINC000816540564 632480598 /nfs/dbraw/zinc/48/05/98/632480598.db2.gz PFQBQHIODQJBIM-UHFFFAOYSA-N -1 3 270.691 2.771 20 10 CFCDHM [O-]c1cc(F)c(Cl)cc1CNCc1nccs1 ZINC000816537053 632480977 /nfs/dbraw/zinc/48/09/77/632480977.db2.gz RDHBDBQVSQSGJC-UHFFFAOYSA-N -1 3 272.732 2.931 20 10 CFCDHM CC(C)N1CCN(Cc2ccc3ccccc3c2[O-])CC1=O ZINC000816566506 632486425 /nfs/dbraw/zinc/48/64/25/632486425.db2.gz XKGZXOXCCMJKPA-UHFFFAOYSA-N -1 3 298.386 2.598 20 10 CFCDHM [O-]c1ccc(Cl)c(F)c1CN1CCC[C@H](O)CC1 ZINC000816667678 632510497 /nfs/dbraw/zinc/51/04/97/632510497.db2.gz UFCPMDBESJJSSL-VIFPVBQESA-N -1 3 273.735 2.532 20 10 CFCDHM Cc1ccc(C(=O)Nc2cc3c(cn2)CCC3)c([O-])c1O ZINC000818994371 632924816 /nfs/dbraw/zinc/92/48/16/632924816.db2.gz ZQYMYOUAJXWVGL-UHFFFAOYSA-N -1 3 284.315 2.542 20 10 CFCDHM C[C@H]1CCN(Cc2cc(Cl)cc(F)c2[O-])C[C@H]1CO ZINC000857061560 635922300 /nfs/dbraw/zinc/92/23/00/635922300.db2.gz RYJJRPYCEYLHMU-ONGXEEELSA-N -1 3 287.762 2.635 20 10 CFCDHM Cc1cc(Cl)cc(C[NH2+]C[C@@H](C(=O)[O-])C(C)C)c1[O-] ZINC000848641177 633306393 /nfs/dbraw/zinc/30/63/93/633306393.db2.gz ZOQIHGHGETZWKW-GFCCVEGCSA-N -1 3 285.771 2.800 20 10 CFCDHM C[C@H](NC(=O)c1cccc(O)c1[O-])C1CCC(F)CC1 ZINC000856079899 635720419 /nfs/dbraw/zinc/72/04/19/635720419.db2.gz CGZVTUKHQPESQL-WHXUTIOJSA-N -1 3 281.327 2.744 20 10 CFCDHM C[C@@H](Nc1cnn(CCF)c1)c1ccc(F)cc1[O-] ZINC000858491951 636271919 /nfs/dbraw/zinc/27/19/19/636271919.db2.gz QTJRNLSCYULENE-SECBINFHSA-N -1 3 267.279 2.870 20 10 CFCDHM C[C@H](c1ccco1)N(C)C(=O)c1cccc(O)c1[O-] ZINC000188157703 650317152 /nfs/dbraw/zinc/31/71/52/650317152.db2.gz NQIIYZCXDFIEFL-SECBINFHSA-N -1 3 261.277 2.524 20 10 CFCDHM C[C@@H](c1ccco1)N(C)C(=O)c1cccc(O)c1[O-] ZINC000188157678 650317368 /nfs/dbraw/zinc/31/73/68/650317368.db2.gz NQIIYZCXDFIEFL-VIFPVBQESA-N -1 3 261.277 2.524 20 10 CFCDHM Cc1cc(NC(=O)c2cccc(O)c2[O-])ccc1N(C)C ZINC000188170428 650318024 /nfs/dbraw/zinc/31/80/24/650318024.db2.gz CMLPXOHAUJGITD-UHFFFAOYSA-N -1 3 286.331 2.725 20 10 CFCDHM CCc1cc(O)ccc1[N-]S(=O)(=O)c1ccc(F)cc1 ZINC000189426752 650380829 /nfs/dbraw/zinc/38/08/29/650380829.db2.gz OVBATEYVURWQFR-UHFFFAOYSA-N -1 3 295.335 2.895 20 10 CFCDHM CC[C@@H](NC(=O)c1cccc(O)c1[O-])c1c(C)noc1C ZINC000189536534 650387527 /nfs/dbraw/zinc/38/75/27/650387527.db2.gz JGIPOCYJESOGHQ-LLVKDONJSA-N -1 3 290.319 2.584 20 10 CFCDHM Cc1ccc([C@@H](C)CNC(=O)c2cccc(O)c2[O-])cc1 ZINC000193081632 650621165 /nfs/dbraw/zinc/62/11/65/650621165.db2.gz UMODWPJTDNLBEX-LBPRGKRZSA-N -1 3 285.343 2.940 20 10 CFCDHM O=C([O-])CC[C@H]1CCCC[N@@H+]1Cc1ccccc1[O-] ZINC000086755135 650797420 /nfs/dbraw/zinc/79/74/20/650797420.db2.gz NIHZDFONWDNAJI-CYBMUJFWSA-N -1 3 263.337 2.612 20 10 CFCDHM O=C([O-])CC[C@H]1CCCC[N@H+]1Cc1ccccc1[O-] ZINC000086755135 650797422 /nfs/dbraw/zinc/79/74/22/650797422.db2.gz NIHZDFONWDNAJI-CYBMUJFWSA-N -1 3 263.337 2.612 20 10 CFCDHM C[C@H]1CN(Cc2ccc(F)c(F)c2[O-])C[C@H](C)S1 ZINC000876642940 642955450 /nfs/dbraw/zinc/95/54/50/642955450.db2.gz PPTOXYRKJYEDSG-IUCAKERBSA-N -1 3 273.348 2.996 20 10 CFCDHM Cc1ccc2c(c1)CCCN2C(=O)c1cccc(O)c1[O-] ZINC000126215373 643052099 /nfs/dbraw/zinc/05/20/99/643052099.db2.gz HCDNCNXCSYQSNZ-UHFFFAOYSA-N -1 3 283.327 2.999 20 10 CFCDHM O=C(Nc1nc2ccccc2s1)c1cccc(O)c1[O-] ZINC000126215128 643052375 /nfs/dbraw/zinc/05/23/75/643052375.db2.gz CJZNQTCGQCCRLJ-UHFFFAOYSA-N -1 3 286.312 2.960 20 10 CFCDHM Cc1ccc(NC(=O)c2cccc(O)c2[O-])c(F)c1 ZINC000126238902 643059639 /nfs/dbraw/zinc/05/96/39/643059639.db2.gz HLOODGFBDDOPQR-UHFFFAOYSA-N -1 3 261.252 2.798 20 10 CFCDHM CC1(C)CN(Cc2cccc(Br)c2[O-])C1 ZINC000877718090 643482685 /nfs/dbraw/zinc/48/26/85/643482685.db2.gz WXNZLTCUWXUVKH-UHFFFAOYSA-N -1 3 270.170 2.997 20 10 CFCDHM CCOC(=O)[C@H](C)C1CN(Cc2cccc(Cl)c2[O-])C1 ZINC000877831376 643597290 /nfs/dbraw/zinc/59/72/90/643597290.db2.gz XJIKWFHURMOZNO-SNVBAGLBSA-N -1 3 297.782 2.677 20 10 CFCDHM COC(=O)[C@H]1CCCCN1Cc1cc(Cl)ccc1[O-] ZINC000093441010 650939917 /nfs/dbraw/zinc/93/99/17/650939917.db2.gz JKSAZXRSDOKBKU-GFCCVEGCSA-N -1 3 283.755 2.573 20 10 CFCDHM C[C@@H]1CC[C@@H](NC(=O)c2cccc(O)c2[O-])C[C@H]1C ZINC000249271744 650956924 /nfs/dbraw/zinc/95/69/24/650956924.db2.gz BIJIRUMWPTWQMQ-GMTAPVOTSA-N -1 3 263.337 2.652 20 10 CFCDHM C[C@@H](N[C@H](CO)c1ccsc1)c1c([O-])cccc1F ZINC000886591720 647057621 /nfs/dbraw/zinc/05/76/21/647057621.db2.gz AEKKSRPHNZQWMQ-BXKDBHETSA-N -1 3 281.352 2.977 20 10 CFCDHM C[C@H]1CCCC[C@H]1OCC(=O)NCc1c([O-])cccc1F ZINC000928706535 648944530 /nfs/dbraw/zinc/94/45/30/648944530.db2.gz VYVFJCPOKVOKHT-XHDPSFHLSA-N -1 3 295.354 2.743 20 10 CFCDHM O=C(NCc1c([O-])cccc1F)c1scnc1C1CC1 ZINC000928705992 648944625 /nfs/dbraw/zinc/94/46/25/648944625.db2.gz PXIZKVBXDVYHHJ-UHFFFAOYSA-N -1 3 292.335 2.795 20 10 CFCDHM CSCC1(CC(=O)NCc2c([O-])cccc2F)CC1 ZINC000928706638 648945277 /nfs/dbraw/zinc/94/52/77/648945277.db2.gz SULQSEYUURMXOI-UHFFFAOYSA-N -1 3 283.368 2.681 20 10 CFCDHM CCn1c(C)cc(C(=O)NCc2c([O-])cccc2F)c1C ZINC000928707817 648945482 /nfs/dbraw/zinc/94/54/82/648945482.db2.gz CGZUAXGIHXAJJI-UHFFFAOYSA-N -1 3 290.338 2.900 20 10 CFCDHM CC1(C)CCC[C@H]1C(=O)NCc1c([O-])cccc1F ZINC000928707678 648945624 /nfs/dbraw/zinc/94/56/24/648945624.db2.gz GICYVCVWGSDRHZ-NSHDSACASA-N -1 3 265.328 2.974 20 10 CFCDHM CO[C@H]1CCC[C@@H](CC(=O)NCc2c([O-])cccc2F)C1 ZINC000928707754 648945646 /nfs/dbraw/zinc/94/56/46/648945646.db2.gz HTGWZOJMQIWSQV-NEPJUHHUSA-N -1 3 295.354 2.743 20 10 CFCDHM COCCN(C)Cc1c([O-])ccc(Cl)c1Cl ZINC001237077233 779006047 /nfs/dbraw/zinc/00/60/47/779006047.db2.gz DKVJOLNIMHWZMY-UHFFFAOYSA-N -1 3 264.152 2.777 20 10 CFCDHM O=C([O-])c1ccc(C[N@@H+]2CCc3cccc([O-])c3C2)s1 ZINC001231466470 777227784 /nfs/dbraw/zinc/22/77/84/777227784.db2.gz GJILNIWMRSEUPY-UHFFFAOYSA-N -1 3 289.356 2.710 20 10 CFCDHM O=C([O-])c1ccc(C[N@H+]2CCc3cccc([O-])c3C2)s1 ZINC001231466470 777227790 /nfs/dbraw/zinc/22/77/90/777227790.db2.gz GJILNIWMRSEUPY-UHFFFAOYSA-N -1 3 289.356 2.710 20 10 CFCDHM O=C([O-])c1ccc(CN2CCc3cccc(O)c3C2)s1 ZINC001231466470 777227797 /nfs/dbraw/zinc/22/77/97/777227797.db2.gz GJILNIWMRSEUPY-UHFFFAOYSA-N -1 3 289.356 2.710 20 10 CFCDHM C[N@@H+](Cc1cc(C(=O)[O-])ccc1[O-])CC1CCCC1 ZINC001231566353 777261580 /nfs/dbraw/zinc/26/15/80/777261580.db2.gz ZHAGAXSDGSWPRW-UHFFFAOYSA-N -1 3 263.337 2.712 20 10 CFCDHM C[N@H+](Cc1cc(C(=O)[O-])ccc1[O-])CC1CCCC1 ZINC001231566353 777261588 /nfs/dbraw/zinc/26/15/88/777261588.db2.gz ZHAGAXSDGSWPRW-UHFFFAOYSA-N -1 3 263.337 2.712 20 10 CFCDHM Cc1cc([O-])c(CN2CCC(=O)[C@H](C)C2)cc1Cl ZINC001231866275 777356088 /nfs/dbraw/zinc/35/60/88/777356088.db2.gz BTAFUBQKVZRGLF-SNVBAGLBSA-N -1 3 267.756 2.765 20 10 CFCDHM Cc1cc([O-])c(CN2CCCC23COC3)cc1Cl ZINC001231870658 777359581 /nfs/dbraw/zinc/35/95/81/777359581.db2.gz MQMRVAAJUWUMIN-UHFFFAOYSA-N -1 3 267.756 2.719 20 10 CFCDHM C[C@@H]1CN(Cc2cc(Cl)c([O-])cc2O)CCCC1=O ZINC001232260888 777496465 /nfs/dbraw/zinc/49/64/65/777496465.db2.gz SIDUBRLHMYSLQO-SECBINFHSA-N -1 3 283.755 2.552 20 10 CFCDHM COc1cc([O-])c(CN2C[C@@H](C)OC[C@H]2C)cc1Cl ZINC001232268389 777501209 /nfs/dbraw/zinc/50/12/09/777501209.db2.gz MXJOEHRSCPHQNH-NXEZZACHSA-N -1 3 285.771 2.663 20 10 CFCDHM COc1cc([O-])c(CN2C[C@@H](C)OC[C@@H]2C)cc1Cl ZINC001232270941 777501280 /nfs/dbraw/zinc/50/12/80/777501280.db2.gz MXJOEHRSCPHQNH-VHSXEESVSA-N -1 3 285.771 2.663 20 10 CFCDHM CCO[C@@H]1CCCN(Cc2c([O-])ccc(F)c2F)C1 ZINC001233334885 777892747 /nfs/dbraw/zinc/89/27/47/777892747.db2.gz YIESXILKMKJLMB-SNVBAGLBSA-N -1 3 271.307 2.671 20 10 CFCDHM CCCC(=O)c1cc(O)c([O-])cc1O[C@H]1CCCN(C)C1 ZINC001233496918 777969135 /nfs/dbraw/zinc/96/91/35/777969135.db2.gz KSYWBYSZXKSTHM-NSHDSACASA-N -1 3 293.363 2.554 20 10 CFCDHM COc1cc([O-])c(CN2CCOCC2(C)C)c(Cl)c1 ZINC001236800222 778942533 /nfs/dbraw/zinc/94/25/33/778942533.db2.gz UKCHKPPTXKBFLZ-UHFFFAOYSA-N -1 3 285.771 2.665 20 10 CFCDHM CCN(Cc1cc(Cl)c(Cl)cc1[O-])C1COC1 ZINC001236798683 778942630 /nfs/dbraw/zinc/94/26/30/778942630.db2.gz KFDLYUYVRODMCO-UHFFFAOYSA-N -1 3 276.163 2.920 20 10 CFCDHM COc1ccc(CN2CC(C)(C)C2)c([O-])c1Cl ZINC001236803436 778944996 /nfs/dbraw/zinc/94/49/96/778944996.db2.gz UGVVLQQEBDZESW-UHFFFAOYSA-N -1 3 255.745 2.896 20 10 CFCDHM [O-]c1ccc(Cl)c(Cl)c1CN1C[C@@H]2CCO[C@@H]2C1 ZINC001237085287 779008422 /nfs/dbraw/zinc/00/84/22/779008422.db2.gz XLDLYDSNYOBCFQ-QPUJVOFHSA-N -1 3 288.174 2.920 20 10 CFCDHM [O-]c1ccc(F)c(Cl)c1CN1CCC[C@]12CCOC2 ZINC001237131947 779023062 /nfs/dbraw/zinc/02/30/62/779023062.db2.gz YSBIGAAXGMBDQU-CQSZACIVSA-N -1 3 285.746 2.940 20 10 CFCDHM Cc1cc([O-])c(CN2CCCCO2)cc1Br ZINC001237678128 779160011 /nfs/dbraw/zinc/16/00/11/779160011.db2.gz UPKYGVBBSXHBRL-UHFFFAOYSA-N -1 3 286.169 2.991 20 10 CFCDHM [O-]c1cc(Cl)c(F)cc1CN1CC[C@H]2OCC[C@H]21 ZINC001237935574 779211425 /nfs/dbraw/zinc/21/14/25/779211425.db2.gz WBUMFWNXCCFHFO-DGCLKSJQSA-N -1 3 271.719 2.548 20 10 CFCDHM C[C@@H](NCC(F)(F)CO)c1ccc2ccccc2c1[O-] ZINC000184703859 296117356 /nfs/dbraw/zinc/11/73/56/296117356.db2.gz YQIALYKBQMTLBX-SNVBAGLBSA-N -1 3 281.302 2.824 20 10 CFCDHM O=C(c1cccc(O)c1[O-])N1CCC[C@@H]2CCCC[C@H]21 ZINC000126269941 377219016 /nfs/dbraw/zinc/21/90/16/377219016.db2.gz QGDHUQFGVXWHQZ-WCQYABFASA-N -1 3 275.348 2.893 20 10 CFCDHM O=C(c1cccc(O)c1[O-])N1CCC[C@@H](C(F)(F)F)C1 ZINC000126458637 377227649 /nfs/dbraw/zinc/22/76/49/377227649.db2.gz DONPDOWPLQHJRB-MRVPVSSYSA-N -1 3 289.253 2.512 20 10 CFCDHM CC[C@H](C)CN(CC)C(=O)c1cccc(O)c1[O-] ZINC000126476412 377230765 /nfs/dbraw/zinc/23/07/65/377230765.db2.gz PMGSAMWTJXCZOB-JTQLQIEISA-N -1 3 251.326 2.606 20 10 CFCDHM CCCOc1ccc(CN2CCO[C@@H](CC)C2)c([O-])c1 ZINC000132020539 377791871 /nfs/dbraw/zinc/79/18/71/377791871.db2.gz IBDIFGHBSKEXBY-AWEZNQCLSA-N -1 3 279.380 2.792 20 10 CFCDHM CCCOc1ccc(CN2CCO[C@@H]3CCC[C@@H]32)c([O-])c1 ZINC000132776677 377876060 /nfs/dbraw/zinc/87/60/60/377876060.db2.gz SVRSWQRFROYZRO-DOTOQJQBSA-N -1 3 291.391 2.934 20 10 CFCDHM O=C(/C=C/c1cccnc1)N1CCCc2cccc([O-])c21 ZINC000155676334 378630713 /nfs/dbraw/zinc/63/07/13/378630713.db2.gz SFBPTPATHVSVCL-CMDGGOBGSA-N -1 3 280.327 2.780 20 10 CFCDHM Cc1ccc(C(=O)N[C@@H]2CCCc3occc32)c([O-])c1O ZINC000179415824 380541614 /nfs/dbraw/zinc/54/16/14/380541614.db2.gz GAOIKLBGUIVNSB-GFCCVEGCSA-N -1 3 287.315 2.807 20 10 CFCDHM COc1cccc([C@@H]2CN(Cc3ccccc3[O-])CCO2)c1 ZINC000179570160 380558720 /nfs/dbraw/zinc/55/87/20/380558720.db2.gz DPPWWMKEYPPSNH-SFHVURJKSA-N -1 3 299.370 2.974 20 10 CFCDHM CO[C@@H]1CCCN(Cc2cccc(Cl)c2[O-])C1 ZINC000179749798 380576428 /nfs/dbraw/zinc/57/64/28/380576428.db2.gz BAWMWIDPAWWETD-LLVKDONJSA-N -1 3 255.745 2.656 20 10 CFCDHM [O-]c1c(Cl)cccc1CN1CCN(CC2CC2)CC1 ZINC000179754082 380576772 /nfs/dbraw/zinc/57/67/72/380576772.db2.gz ASKVLHKXHJFWDN-UHFFFAOYSA-N -1 3 280.799 2.573 20 10 CFCDHM [O-]c1c(Cl)cccc1CN1CCC(C2OCCO2)CC1 ZINC000180011462 380609645 /nfs/dbraw/zinc/60/96/45/380609645.db2.gz MKBNWZYPCZLUIC-UHFFFAOYSA-N -1 3 297.782 2.631 20 10 CFCDHM Cc1ccc(C(=O)N2CCCCCCC2)c([O-])c1O ZINC000181827654 380908030 /nfs/dbraw/zinc/90/80/30/380908030.db2.gz JYKDTCGMHHZNIG-UHFFFAOYSA-N -1 3 263.337 2.813 20 10 CFCDHM Cc1ccc(C(=O)N2CCC3(CCCC3)C2)c([O-])c1O ZINC000182526150 381107109 /nfs/dbraw/zinc/10/71/09/381107109.db2.gz CABLEBOHDHKOQN-UHFFFAOYSA-N -1 3 275.348 2.813 20 10 CFCDHM CC(=O)c1cc(Cl)cc(CN2CCC[C@@H](O)[C@H]2C)c1[O-] ZINC000296374073 381368315 /nfs/dbraw/zinc/36/83/15/381368315.db2.gz STACGRWTQBGMGH-YMTOWFKASA-N -1 3 297.782 2.593 20 10 CFCDHM COc1cc(Cl)cc(CN2CCO[C@H](C)[C@H]2C)c1[O-] ZINC000184694260 381463340 /nfs/dbraw/zinc/46/33/40/381463340.db2.gz FTNALIUTKIMRFU-NXEZZACHSA-N -1 3 285.771 2.663 20 10 CFCDHM COc1cc(Cl)cc(CN2CCOCC23CCC3)c1[O-] ZINC000184695955 381463415 /nfs/dbraw/zinc/46/34/15/381463415.db2.gz VUYOJDUHPOKPFO-UHFFFAOYSA-N -1 3 297.782 2.809 20 10 CFCDHM [O-]c1ccccc1CN1CCOC[C@@H]1c1ccco1 ZINC000373126406 381932926 /nfs/dbraw/zinc/93/29/26/381932926.db2.gz UVPDULSFVKRZNL-CYBMUJFWSA-N -1 3 259.305 2.559 20 10 CFCDHM CN(Cc1cccc(F)c1[O-])[C@@H]1CCCc2c1cnn2C ZINC000376536028 382141027 /nfs/dbraw/zinc/14/10/27/382141027.db2.gz SKLTUMQUKGLERH-CQSZACIVSA-N -1 3 289.354 2.774 20 10 CFCDHM [O-]c1ccc(F)cc1CN[C@@H]1COc2cccc(F)c21 ZINC000378632269 382495625 /nfs/dbraw/zinc/49/56/25/382495625.db2.gz LGTRLBZAHKJCQW-GFCCVEGCSA-N -1 3 277.270 2.894 20 10 CFCDHM [O-]c1ccccc1CN(Cc1cocn1)C[C@@H]1CCCO1 ZINC000191920455 382703268 /nfs/dbraw/zinc/70/32/68/382703268.db2.gz GYIYMZIHJHCOEZ-HNNXBMFYSA-N -1 3 288.347 2.561 20 10 CFCDHM CC(=O)c1cc(F)cc(CN(C)CCCOC(C)C)c1[O-] ZINC000267460333 384395803 /nfs/dbraw/zinc/39/58/03/384395803.db2.gz RLJVCCYVTNHOCD-UHFFFAOYSA-N -1 3 297.370 2.981 20 10 CFCDHM Cc1cc(Cl)cc(CN(C)Cc2ccon2)c1[O-] ZINC000271743014 385389927 /nfs/dbraw/zinc/38/99/27/385389927.db2.gz AGZPTXHXTSHZPQ-UHFFFAOYSA-N -1 3 266.728 2.974 20 10 CFCDHM CCCN(Cc1nnc(C)s1)Cc1ccccc1[O-] ZINC000271467214 385382556 /nfs/dbraw/zinc/38/25/56/385382556.db2.gz VHQOOEPIBUGHOQ-UHFFFAOYSA-N -1 3 277.393 2.964 20 10 CFCDHM Cc1cc(CN[C@@H](C)c2cc(Cl)ccc2[O-])n(C)n1 ZINC000284242431 385547543 /nfs/dbraw/zinc/54/75/43/385547543.db2.gz IEJZOSMPLYASMA-JTQLQIEISA-N -1 3 279.771 2.938 20 10 CFCDHM CO[C@@H](C)c1nc(CNCc2cc(F)ccc2[O-])cs1 ZINC000272480863 385549270 /nfs/dbraw/zinc/54/92/70/385549270.db2.gz SQHZWJBWQZLEDU-VIFPVBQESA-N -1 3 296.367 2.985 20 10 CFCDHM CCOCCOC1CN(Cc2cc(Cl)cc(C)c2[O-])C1 ZINC000272398344 385527906 /nfs/dbraw/zinc/52/79/06/385527906.db2.gz IOVNOLMWJBAKSN-UHFFFAOYSA-N -1 3 299.798 2.591 20 10 CFCDHM Cc1ccc(C(=O)N2CC[C@@H](C)C[C@H]2C)c([O-])c1O ZINC000272804602 385619761 /nfs/dbraw/zinc/61/97/61/385619761.db2.gz ZCIXODIZRIMYKX-MWLCHTKSSA-N -1 3 263.337 2.667 20 10 CFCDHM CO[C@H]1CCCN(Cc2c([O-])cccc2Cl)C1 ZINC000218994046 393760194 /nfs/dbraw/zinc/76/01/94/393760194.db2.gz KJVFSPALRFMUNW-JTQLQIEISA-N -1 3 255.745 2.656 20 10 CFCDHM C[C@H](C(=O)NCc1ccccc1)N(C)Cc1ccccc1[O-] ZINC000109773313 393879808 /nfs/dbraw/zinc/87/98/08/393879808.db2.gz LTMWJUZPTMEENV-CQSZACIVSA-N -1 3 298.386 2.529 20 10 CFCDHM C[C@@H](c1nc(C2CC2)no1)N(C)Cc1ccccc1[O-] ZINC000109771170 393879835 /nfs/dbraw/zinc/87/98/35/393879835.db2.gz WVPXDNSYPHVCKT-JTQLQIEISA-N -1 3 273.336 2.846 20 10 CFCDHM O=C(/C=C/c1cncc([O-])c1)N1CCc2cc(F)ccc21 ZINC000492767039 394076199 /nfs/dbraw/zinc/07/61/99/394076199.db2.gz NAIMHSCFLHXZHM-DAFODLJHSA-N -1 3 284.290 2.529 20 10 CFCDHM CC[C@H](c1ccccc1[O-])N1CCc2c(ncn2C)C1 ZINC000368880356 267210432 /nfs/dbraw/zinc/21/04/32/267210432.db2.gz QYTPEEUJZKDDRX-CQSZACIVSA-N -1 3 271.364 2.635 20 10 CFCDHM C[C@]1(O)CCCN(Cc2c([O-])ccc(Cl)c2F)CC1 ZINC000369557023 267250103 /nfs/dbraw/zinc/25/01/03/267250103.db2.gz RIBREJBKCVGONC-AWEZNQCLSA-N -1 3 287.762 2.922 20 10 CFCDHM CC[C@H](N[C@@H](C)c1ncnn1C)c1ccc(C)cc1[O-] ZINC000280119696 276638495 /nfs/dbraw/zinc/63/84/95/276638495.db2.gz OFAPJBKVHRGXFP-AAEUAGOBSA-N -1 3 274.368 2.631 20 10 CFCDHM CC(=O)c1cc(F)cc(CN2CCSC[C@@H]2C)c1[O-] ZINC000070220489 277105990 /nfs/dbraw/zinc/10/59/90/277105990.db2.gz MXPYYDKBHYEUIA-VIFPVBQESA-N -1 3 283.368 2.671 20 10 CFCDHM CCn1nncc1CN[C@H](C)c1cc(Cl)ccc1[O-] ZINC000527920101 330295714 /nfs/dbraw/zinc/29/57/14/330295714.db2.gz MFDWKCDPVRBVQL-SECBINFHSA-N -1 3 280.759 2.508 20 10 CFCDHM CCn1ncc(CN[C@@H](C)c2cc(Cl)ccc2[O-])n1 ZINC000527922210 330295935 /nfs/dbraw/zinc/29/59/35/330295935.db2.gz CUECXALKQSFDLP-VIFPVBQESA-N -1 3 280.759 2.508 20 10 CFCDHM CC(C)N(CC1CCC1)C(=O)c1cccc(O)c1[O-] ZINC000278132593 519641201 /nfs/dbraw/zinc/64/12/01/519641201.db2.gz MQBRYCAYUDIJAT-UHFFFAOYSA-N -1 3 263.337 2.749 20 10 CFCDHM CCOC(=O)C1CCN(Cc2c([O-])cccc2Cl)CC1 ZINC000158094922 520577695 /nfs/dbraw/zinc/57/76/95/520577695.db2.gz RMIOFKWTAFYEDQ-UHFFFAOYSA-N -1 3 297.782 2.821 20 10 CFCDHM COCC[C@@H]1COCCN1Cc1cc(Cl)cc(C)c1[O-] ZINC000291175724 521890053 /nfs/dbraw/zinc/89/00/53/521890053.db2.gz FDNPWSXHODFKSJ-CQSZACIVSA-N -1 3 299.798 2.591 20 10 CFCDHM COc1cc(Cl)cc(CN2CCO[C@@H]3CCC[C@@H]32)c1[O-] ZINC000230929781 522535228 /nfs/dbraw/zinc/53/52/28/522535228.db2.gz AFQCENVBOJPSGX-QWHCGFSZSA-N -1 3 297.782 2.808 20 10 CFCDHM COCc1nc(CNCc2c([O-])cccc2Cl)cs1 ZINC000289983137 523198812 /nfs/dbraw/zinc/19/88/12/523198812.db2.gz ZWATZANSQOXALR-UHFFFAOYSA-N -1 3 298.795 2.938 20 10 CFCDHM CC[C@H](C(=O)OC(C)(C)C)N(C)Cc1ccccc1[O-] ZINC000192102757 523811368 /nfs/dbraw/zinc/81/13/68/523811368.db2.gz HYFABRQRMKLLDE-CYBMUJFWSA-N -1 3 279.380 2.944 20 10 CFCDHM C[C@H]1CN(Cc2cccc(F)c2[O-])C[C@H](C2CC2)O1 ZINC000280603020 524626311 /nfs/dbraw/zinc/62/63/11/524626311.db2.gz OEEKQAUJONEOHK-IINYFYTJSA-N -1 3 265.328 2.531 20 10 CFCDHM Cc1ccc([C@@H](O)CNCc2c([O-])cccc2Cl)o1 ZINC000265987504 525781126 /nfs/dbraw/zinc/78/11/26/525781126.db2.gz NHKFGPDAVUGIJO-ZDUSSCGKSA-N -1 3 281.739 2.770 20 10 CFCDHM Cc1ccc(C(=O)N(CC(C)C)C2CC2)c([O-])c1O ZINC000179416661 526069649 /nfs/dbraw/zinc/06/96/49/526069649.db2.gz ASWPGRJPQSYXRX-UHFFFAOYSA-N -1 3 263.337 2.667 20 10 CFCDHM [O-]c1c(F)cccc1CN1CCO[C@H]2CCCC[C@@H]21 ZINC000160222271 526328738 /nfs/dbraw/zinc/32/87/38/526328738.db2.gz JTAKNAGFTQEZMZ-KBPBESRZSA-N -1 3 265.328 2.675 20 10 CFCDHM [O-]c1ccc(Br)cc1CNCc1ccccn1 ZINC000067697056 526341240 /nfs/dbraw/zinc/34/12/40/526341240.db2.gz WXAWTJLPHMHVFW-UHFFFAOYSA-N -1 3 293.164 2.840 20 10 CFCDHM [O-]c1ccc(Cl)cc1CN1CCS[C@H]2COCC[C@H]21 ZINC000246445954 526346558 /nfs/dbraw/zinc/34/65/58/526346558.db2.gz NNXOEPKSMGFGQO-OCCSQVGLSA-N -1 3 299.823 2.752 20 10 CFCDHM COC(=O)c1ccc(COC(=O)c2cc([O-])cs2)cc1 ZINC000731909653 574133351 /nfs/dbraw/zinc/13/33/51/574133351.db2.gz HUSXJBQMDQJZCA-UHFFFAOYSA-N -1 3 292.312 2.597 20 10 CFCDHM C[N@H+](Cc1ccccc1[O-])[C@H](C(=O)[O-])c1ccc(F)cc1 ZINC000737494726 574144713 /nfs/dbraw/zinc/14/47/13/574144713.db2.gz ZTWDPTGLSADRIU-HNNXBMFYSA-N -1 3 289.306 2.789 20 10 CFCDHM C[N@@H+](Cc1ccccc1[O-])[C@H](C(=O)[O-])c1ccc(F)cc1 ZINC000737494726 574144715 /nfs/dbraw/zinc/14/47/15/574144715.db2.gz ZTWDPTGLSADRIU-HNNXBMFYSA-N -1 3 289.306 2.789 20 10 CFCDHM Cc1cccn2cc(CN(C)Cc3ccccc3[O-])nc12 ZINC000732203354 574146038 /nfs/dbraw/zinc/14/60/38/574146038.db2.gz RAKOZUUMDDSQKY-UHFFFAOYSA-N -1 3 281.359 2.980 20 10 CFCDHM COc1ccccc1[C@H](C)NC(=O)c1cc([O-])cs1 ZINC000732265282 574148270 /nfs/dbraw/zinc/14/82/70/574148270.db2.gz SNJRLMDNAAFLIS-VIFPVBQESA-N -1 3 277.345 2.953 20 10 CFCDHM C[C@@H](c1ccncc1)N(C)C(=O)c1cc([O-])cs1 ZINC000732273278 574148894 /nfs/dbraw/zinc/14/88/94/574148894.db2.gz OWSJHWUSZZZDAY-VIFPVBQESA-N -1 3 262.334 2.682 20 10 CFCDHM CCc1nc([C@H](C)NC(=O)c2cc([O-])cs2)cs1 ZINC000732302220 574149481 /nfs/dbraw/zinc/14/94/81/574149481.db2.gz DORMCZDPFKUQHC-ZETCQYMHSA-N -1 3 282.390 2.964 20 10 CFCDHM CCCN(CCc1ccccn1)C(=O)c1cc([O-])cs1 ZINC000732277071 574149555 /nfs/dbraw/zinc/14/95/55/574149555.db2.gz DJRVGXOGCKCZAH-UHFFFAOYSA-N -1 3 290.388 2.944 20 10 CFCDHM Cc1ccc2c(c1C)OC[C@H]2NC(=O)c1cc([O-])cs1 ZINC000732286380 574149866 /nfs/dbraw/zinc/14/98/66/574149866.db2.gz SKFBUQVCMFKLMI-GFCCVEGCSA-N -1 3 289.356 2.934 20 10 CFCDHM O=C(c1cc([O-])cs1)N1CCC[C@@H]1C1CCC1 ZINC000732285990 574149925 /nfs/dbraw/zinc/14/99/25/574149925.db2.gz RALSEIYANKOVME-LLVKDONJSA-N -1 3 251.351 2.858 20 10 CFCDHM C[C@@H]1C[C@@H]1c1cc(NC(=O)c2cc([O-])cs2)n[nH]1 ZINC000732280527 574149997 /nfs/dbraw/zinc/14/99/97/574149997.db2.gz KDVPLZAPJYANOP-SVRRBLITSA-N -1 3 263.322 2.553 20 10 CFCDHM COC(=O)[C@H](CC1CCCCC1)NCc1ccccc1[O-] ZINC000756147184 574214001 /nfs/dbraw/zinc/21/40/01/574214001.db2.gz NYYOMWKJXATEHH-HNNXBMFYSA-N -1 3 291.391 2.994 20 10 CFCDHM COC(=O)[C@@H](CC1CCCCC1)NCc1ccccc1[O-] ZINC000756147186 574214104 /nfs/dbraw/zinc/21/41/04/574214104.db2.gz NYYOMWKJXATEHH-OAHLLOKOSA-N -1 3 291.391 2.994 20 10 CFCDHM CN(C)c1ccc(CN[C@H](C(=O)[O-])c2ccsc2)cc1 ZINC000756363088 574229804 /nfs/dbraw/zinc/22/98/04/574229804.db2.gz RMBPMKVMFUZPBO-AWEZNQCLSA-N -1 3 290.388 2.730 20 10 CFCDHM COc1ccc(CN[C@H](C)c2cc(F)cc(F)c2[O-])cn1 ZINC000756381072 574231367 /nfs/dbraw/zinc/23/13/67/574231367.db2.gz JUDZMXNMNBAPDI-SECBINFHSA-N -1 3 294.301 2.925 20 10 CFCDHM Cc1cc([O-])c(C[N@H+](C)CCCNC(=O)[O-])cc1C(C)C ZINC000740087547 574235274 /nfs/dbraw/zinc/23/52/74/574235274.db2.gz DCBGDGHBANAKBL-UHFFFAOYSA-N -1 3 294.395 2.914 20 10 CFCDHM Cc1cc([O-])c(C[N@@H+](C)CCCNC(=O)[O-])cc1C(C)C ZINC000740087547 574235278 /nfs/dbraw/zinc/23/52/78/574235278.db2.gz DCBGDGHBANAKBL-UHFFFAOYSA-N -1 3 294.395 2.914 20 10 CFCDHM Cc1cc(O)c(CN2CC[C@H](NC(=O)[O-])C2)cc1C(C)C ZINC000740089850 574235319 /nfs/dbraw/zinc/23/53/19/574235319.db2.gz ZDERZWZQZIRGOT-ZDUSSCGKSA-N -1 3 292.379 2.666 20 10 CFCDHM C[C@H](NCc1cc[nH]n1)c1cc(Br)ccc1[O-] ZINC000756557251 574247147 /nfs/dbraw/zinc/24/71/47/574247147.db2.gz RRFAFFAVXGHGIF-QMMMGPOBSA-N -1 3 296.168 2.729 20 10 CFCDHM C[C@H](NCc1ccon1)c1cc(Cl)ccc1[O-] ZINC000756637079 574254133 /nfs/dbraw/zinc/25/41/33/574254133.db2.gz LWOGUARDCDMGKQ-QMMMGPOBSA-N -1 3 252.701 2.884 20 10 CFCDHM C[C@@H](NCC(=O)NC1CCCC1)c1cc(Cl)ccc1[O-] ZINC000756705563 574258275 /nfs/dbraw/zinc/25/82/75/574258275.db2.gz LDCNTFLYCKHJPF-SNVBAGLBSA-N -1 3 296.798 2.755 20 10 CFCDHM C[S@@](=O)Cc1cccc(NC(=O)c2cc([O-])cs2)c1 ZINC000734555412 574292872 /nfs/dbraw/zinc/29/28/72/574292872.db2.gz RVODPHMXEYYQDF-LJQANCHMSA-N -1 3 295.385 2.585 20 10 CFCDHM Cc1ccc([C@H]2COCCN2C(=O)c2cc([O-])cs2)o1 ZINC000735124941 574313786 /nfs/dbraw/zinc/31/37/86/574313786.db2.gz GVWFYXGOBXNBIF-LLVKDONJSA-N -1 3 293.344 2.569 20 10 CFCDHM O=C(NC[C@H]1CCc2ccccc2C1)c1cc([O-])cs1 ZINC000735326104 574320923 /nfs/dbraw/zinc/32/09/23/574320923.db2.gz DCSWNZXIAZCOOW-NSHDSACASA-N -1 3 287.384 2.989 20 10 CFCDHM Cc1cccc(O[C@H](C)CNC(=O)c2cc([O-])cs2)c1 ZINC000743712205 574371109 /nfs/dbraw/zinc/37/11/09/574371109.db2.gz NMTPLJXKENEZIV-LLVKDONJSA-N -1 3 291.372 2.959 20 10 CFCDHM O=C(c1cc([O-])cs1)N1CCC[C@@H]2CCC[C@H]21 ZINC000743707410 574371154 /nfs/dbraw/zinc/37/11/54/574371154.db2.gz GMBAUAFBGSJBBT-GXSJLCMTSA-N -1 3 251.351 2.858 20 10 CFCDHM CCc1cnc(NC(=O)c2cc([O-])cs2)s1 ZINC000743741276 574371657 /nfs/dbraw/zinc/37/16/57/574371657.db2.gz UJPHMIMLDYNVDX-UHFFFAOYSA-N -1 3 254.336 2.725 20 10 CFCDHM Cc1ccc(C(=O)NCC2CCCCC2)c([O-])c1O ZINC000751530792 574378478 /nfs/dbraw/zinc/37/84/78/574378478.db2.gz UDMKORXJMXAESV-UHFFFAOYSA-N -1 3 263.337 2.716 20 10 CFCDHM COc1cc(C)cc(CNC(=O)c2cc([O-])cs2)c1 ZINC000752628172 574393226 /nfs/dbraw/zinc/39/32/26/574393226.db2.gz YMZOGOVTVSAHSS-UHFFFAOYSA-N -1 3 277.345 2.701 20 10 CFCDHM COc1ccc(CNCc2ccc(C(=O)[O-])cc2)cc1C ZINC000818591780 597136563 /nfs/dbraw/zinc/13/65/63/597136563.db2.gz VNIPYRYUUFMMFQ-UHFFFAOYSA-N -1 3 285.343 2.992 20 10 CFCDHM C[C@@H]([NH2+]CCCCCC(=O)[O-])c1ccccc1[O-] ZINC000820142094 597733896 /nfs/dbraw/zinc/73/38/96/597733896.db2.gz NXJSIKVLAGMASE-LLVKDONJSA-N -1 3 251.326 2.688 20 10 CFCDHM CC[C@@H]([NH2+]CCCCC(=O)[O-])c1ccccc1[O-] ZINC000820285355 597808780 /nfs/dbraw/zinc/80/87/80/597808780.db2.gz ZPNOTYLMEFXHBN-GFCCVEGCSA-N -1 3 251.326 2.688 20 10 CFCDHM COc1ccc(O)c([C@H](C)NCc2ccc(C(=O)[O-])o2)c1 ZINC000833734036 605124779 /nfs/dbraw/zinc/12/47/79/605124779.db2.gz ZUYIHWJJGNIMDX-VIFPVBQESA-N -1 3 291.303 2.543 20 10 CFCDHM CN(C)c1ccc(CNc2cccc(-c3nnn[n-]3)c2)cc1 ZINC000393366466 608870815 /nfs/dbraw/zinc/87/08/15/608870815.db2.gz CQYUXTBVUTVJKK-UHFFFAOYSA-N -1 3 294.362 2.545 20 10 CFCDHM CN(C)c1ccc(CNc2cccc(-c3nn[n-]n3)c2)cc1 ZINC000393366466 608870816 /nfs/dbraw/zinc/87/08/16/608870816.db2.gz CQYUXTBVUTVJKK-UHFFFAOYSA-N -1 3 294.362 2.545 20 10 CFCDHM C[C@H](NC(=O)c1cccc(O)c1[O-])c1ccc(F)cc1F ZINC000186757539 618264396 /nfs/dbraw/zinc/26/43/96/618264396.db2.gz MGTHNFOBLIUTDN-QMMMGPOBSA-N -1 3 293.269 2.867 20 10 CFCDHM COCC1(C2CCC2)CN(Cc2cc(F)cc(F)c2[O-])C1 ZINC000895251766 618498080 /nfs/dbraw/zinc/49/80/80/618498080.db2.gz NFSIQIHVSUWDMV-UHFFFAOYSA-N -1 3 297.345 2.919 20 10 CFCDHM COCC1(C2CC2)CN(Cc2cc(F)cc(F)c2[O-])C1 ZINC000895439520 618587631 /nfs/dbraw/zinc/58/76/31/618587631.db2.gz CRFFYHFHFXTMSH-UHFFFAOYSA-N -1 3 283.318 2.529 20 10 CFCDHM O=C(NCc1ccccc1O)c1cc([O-])ccc1Cl ZINC000236555663 618633343 /nfs/dbraw/zinc/63/33/43/618633343.db2.gz GCFLMXFIHDGYBR-UHFFFAOYSA-N -1 3 277.707 2.681 20 10 CFCDHM CC(C)(CNC(=O)c1cccc(O)c1[O-])C1=CCCC1 ZINC000312251881 618914975 /nfs/dbraw/zinc/91/49/75/618914975.db2.gz DECXRKFWALBEET-UHFFFAOYSA-N -1 3 275.348 2.964 20 10 CFCDHM C[C@H]1[C@H](CO)CCCN1Cc1c([O-])ccc(Cl)c1F ZINC000840978057 619207224 /nfs/dbraw/zinc/20/72/24/619207224.db2.gz KZMURXFESCAXBV-UWVGGRQHSA-N -1 3 287.762 2.778 20 10 CFCDHM [O-]c1cccc(F)c1CNCc1cnn(CC2CCC2)c1 ZINC000896638668 619781172 /nfs/dbraw/zinc/78/11/72/619781172.db2.gz KIYDAQKUQKEOSZ-UHFFFAOYSA-N -1 3 289.354 2.818 20 10 CFCDHM Cc1cc(NC(=O)c2ccc(C)c(O)c2[O-])ccc1O ZINC000182881010 625388881 /nfs/dbraw/zinc/38/88/81/625388881.db2.gz YNZFLDIRTLLGJA-UHFFFAOYSA-N -1 3 273.288 2.673 20 10 CFCDHM CC(C)(C(=O)NCc1c([O-])cccc1F)c1cccnc1 ZINC000928704508 619994939 /nfs/dbraw/zinc/99/49/39/619994939.db2.gz AHWZVIHJPFOTMX-UHFFFAOYSA-N -1 3 288.322 2.520 20 10 CFCDHM C[C@H](N[C@@H](C)c1ccc(Cl)cc1[O-])c1ncnn1C ZINC000841751886 620217592 /nfs/dbraw/zinc/21/75/92/620217592.db2.gz LETPFLHWYOIXHD-IUCAKERBSA-N -1 3 280.759 2.586 20 10 CFCDHM Cc1nc(CNCc2cccc(Cl)c2[O-])[nH]c1C ZINC000898214376 620346359 /nfs/dbraw/zinc/34/63/59/620346359.db2.gz BGPKWXKKHBGDEG-UHFFFAOYSA-N -1 3 265.744 2.675 20 10 CFCDHM Cc1ccc(C(=O)N2c3ccccc3C[C@@H]2C)c([O-])c1O ZINC000179406062 620987875 /nfs/dbraw/zinc/98/78/75/620987875.db2.gz FPCKCVPCAPBHQM-NSHDSACASA-N -1 3 283.327 2.998 20 10 CFCDHM CC(C)[C@@H](N[C@H](C)c1ccc(F)cc1[O-])c1nncn1C ZINC000903066767 621239527 /nfs/dbraw/zinc/23/95/27/621239527.db2.gz XDTPZRUATWKFSX-QMTHXVAHSA-N -1 3 292.358 2.708 20 10 CFCDHM [O-]c1cccc(F)c1CNC(=S)NC1CCCCC1 ZINC000905662121 621811939 /nfs/dbraw/zinc/81/19/39/621811939.db2.gz SFSVDZHMJOXQOU-UHFFFAOYSA-N -1 3 282.384 2.828 20 10 CFCDHM Cc1cc(CNCc2cc(Br)ccc2[O-])no1 ZINC000226036793 623053809 /nfs/dbraw/zinc/05/38/09/623053809.db2.gz PWSKCTSMBPKBCC-UHFFFAOYSA-N -1 3 297.152 2.741 20 10 CFCDHM C[C@H](CCCC(F)(F)F)NC(=O)c1cccc(O)c1[O-] ZINC000757649448 623492685 /nfs/dbraw/zinc/49/26/85/623492685.db2.gz VXMOXDRPXNRYAH-MRVPVSSYSA-N -1 3 291.269 2.949 20 10 CFCDHM COC[C@H]1CN(Cc2cc(Cl)c(C)cc2[O-])C[C@H](C)O1 ZINC000825634205 623727239 /nfs/dbraw/zinc/72/72/39/623727239.db2.gz JPIQMMOVNXQEPB-WCQYABFASA-N -1 3 299.798 2.590 20 10 CFCDHM Cc1cc([O-])c(CN[C@@H](C)C(=O)OC(C)C)cc1Cl ZINC000826097138 623793408 /nfs/dbraw/zinc/79/34/08/623793408.db2.gz PTCILNFQMBXYIY-JTQLQIEISA-N -1 3 285.771 2.784 20 10 CFCDHM Cc1noc(CN(C)Cc2cc(Cl)c(C)cc2[O-])n1 ZINC000826539537 623808193 /nfs/dbraw/zinc/80/81/93/623808193.db2.gz VKRVTVQUHWMENJ-UHFFFAOYSA-N -1 3 281.743 2.677 20 10 CFCDHM C[C@H]1C[C@@H](NCc2cc(Cl)c(F)cc2[O-])c2ncnn21 ZINC000826889591 623903405 /nfs/dbraw/zinc/90/34/05/623903405.db2.gz WHIJYGITQKRSSI-WRWORJQWSA-N -1 3 296.733 2.572 20 10 CFCDHM CCC[C@H](CC)NC(=O)NCc1c([O-])cccc1F ZINC000915193948 623993469 /nfs/dbraw/zinc/99/34/69/623993469.db2.gz BYVWMSXIIGXNBU-JTQLQIEISA-N -1 3 268.332 2.909 20 10 CFCDHM Cc1cccc(N(C)C(=O)c2ccc(C)c(O)c2[O-])c1 ZINC000179474405 624963724 /nfs/dbraw/zinc/96/37/24/624963724.db2.gz BSJKKUCFOXWMDC-UHFFFAOYSA-N -1 3 271.316 2.991 20 10 CFCDHM C[C@@H](CCC1CC1)NC(=O)NCc1c([O-])cccc1F ZINC000922019856 626196992 /nfs/dbraw/zinc/19/69/92/626196992.db2.gz PDSZQUXKIZJAER-JTQLQIEISA-N -1 3 280.343 2.909 20 10 CFCDHM C[C@H](Cc1ccccc1F)NC(=O)c1cccc(O)c1[O-] ZINC000186999710 626410580 /nfs/dbraw/zinc/41/05/80/626410580.db2.gz AHEUWHFUBRRMEJ-SNVBAGLBSA-N -1 3 289.306 2.598 20 10 CFCDHM Cn1nc(C2CC2)cc1CNCc1cc(F)cc(F)c1[O-] ZINC000922948201 626431017 /nfs/dbraw/zinc/43/10/17/626431017.db2.gz SYVHHEACJZXCMJ-UHFFFAOYSA-N -1 3 293.317 2.571 20 10 CFCDHM [O-]c1ccc(Cl)c(F)c1CN1CC2(C1)CCCOC2 ZINC000839138115 626528404 /nfs/dbraw/zinc/52/84/04/626528404.db2.gz LUXZOOSLQYXGKK-UHFFFAOYSA-N -1 3 285.746 2.797 20 10 CFCDHM CC[C@H](NCC(F)(F)CO)c1cc(Cl)ccc1[O-] ZINC000775554997 628036734 /nfs/dbraw/zinc/03/67/34/628036734.db2.gz GTWFAUIDTKVIBO-JTQLQIEISA-N -1 3 279.714 2.714 20 10 CFCDHM CN1CCN(Cc2cc(Cl)cc(F)c2[O-])C(C)(C)C1 ZINC000775699727 628056885 /nfs/dbraw/zinc/05/68/85/628056885.db2.gz COYKETVUUIBGLA-UHFFFAOYSA-N -1 3 286.778 2.711 20 10 CFCDHM O=C(NCC1(c2ccccc2)CCC1)c1cccc(O)c1[O-] ZINC000776327736 628131741 /nfs/dbraw/zinc/13/17/41/628131741.db2.gz RSVZDDHMOMDYDZ-UHFFFAOYSA-N -1 3 297.354 2.950 20 10 CFCDHM CC(C)(C)OC(=O)[C@H]1CCCN1Cc1cc(F)ccc1[O-] ZINC000779023154 628345759 /nfs/dbraw/zinc/34/57/59/628345759.db2.gz OYKWKONNLKNULE-CYBMUJFWSA-N -1 3 295.354 2.837 20 10 CFCDHM CC[C@@]1(O)CCN(Cc2cc(Cl)cc(F)c2[O-])C1 ZINC000779219076 628360900 /nfs/dbraw/zinc/36/09/00/628360900.db2.gz LMJWGNIEXWPMCE-CYBMUJFWSA-N -1 3 273.735 2.532 20 10 CFCDHM Cc1ccc(C(=O)N2CCN(C)c3ccccc32)c([O-])c1O ZINC000780937694 628505946 /nfs/dbraw/zinc/50/59/46/628505946.db2.gz FZOZGRVKWTZGJP-UHFFFAOYSA-N -1 3 298.342 2.503 20 10 CFCDHM CC(=O)c1cc(F)cc(CN2Cc3cccnc3C2)c1[O-] ZINC000787669974 629025011 /nfs/dbraw/zinc/02/50/11/629025011.db2.gz MLKSHZLMCZNPQU-UHFFFAOYSA-N -1 3 286.306 2.645 20 10 CFCDHM C[C@@H]1C[C@H]1c1ccc(CNC(=O)c2cccc(O)c2[O-])o1 ZINC000790554482 629247361 /nfs/dbraw/zinc/24/73/61/629247361.db2.gz OCGAYKCULJYIRJ-BXKDBHETSA-N -1 3 287.315 2.744 20 10 CFCDHM O=C(N[C@H]1CSc2ccccc21)c1cccc(O)c1[O-] ZINC000790739531 629259404 /nfs/dbraw/zinc/25/94/04/629259404.db2.gz DBTOVQJPMBSLFN-NSHDSACASA-N -1 3 287.340 2.675 20 10 CFCDHM Cc1c(NC(=O)c2cccc(O)c2[O-])cnn1CC(C)C ZINC000790911311 629271139 /nfs/dbraw/zinc/27/11/39/629271139.db2.gz GDGFPLRUTTXYHJ-UHFFFAOYSA-N -1 3 289.335 2.511 20 10 CFCDHM CS[C@@H](CNC(=O)c1cccc(O)c1[O-])C(C)(C)C ZINC000790926878 629271847 /nfs/dbraw/zinc/27/18/47/629271847.db2.gz QXTRPJISAKXSMA-NSHDSACASA-N -1 3 283.393 2.605 20 10 CFCDHM CCC1CN(Cc2cccc(Br)c2[O-])C1 ZINC000835075530 629372881 /nfs/dbraw/zinc/37/28/81/629372881.db2.gz VSJPMZQPFIOVBT-UHFFFAOYSA-N -1 3 270.170 2.997 20 10 CFCDHM [O-]c1ccc(Cl)c(F)c1CN1CCC(CCO)CC1 ZINC000792162097 629404283 /nfs/dbraw/zinc/40/42/83/629404283.db2.gz CXCSCLKQJPMGSD-UHFFFAOYSA-N -1 3 287.762 2.779 20 10 CFCDHM Cc1cc(N(C)C)ccc1C[C@H](C)[N-]C(=O)C(F)(F)F ZINC000839918150 630400802 /nfs/dbraw/zinc/40/08/02/630400802.db2.gz JZSMGUBHBWRQDD-JTQLQIEISA-N -1 3 288.313 2.671 20 10 CFCDHM Cc1cc([O-])c(CN(C)Cc2cnn(C)c2)c(Cl)c1 ZINC000840909589 631261773 /nfs/dbraw/zinc/26/17/73/631261773.db2.gz JKHNDYMPXGYTGB-UHFFFAOYSA-N -1 3 279.771 2.720 20 10 CFCDHM Cc1cc([O-])c(CN2CCO[C@H](C(F)F)C2)c(Cl)c1 ZINC000840943055 631273765 /nfs/dbraw/zinc/27/37/65/631273765.db2.gz QGDXQXLCJFOBHU-LBPRGKRZSA-N -1 3 291.725 2.820 20 10 CFCDHM Cc1noc([C@@H](C)NCc2c([O-])cc(C)cc2Cl)n1 ZINC000840941760 631274256 /nfs/dbraw/zinc/27/42/56/631274256.db2.gz KQILAXJRMZEVBL-MRVPVSSYSA-N -1 3 281.743 2.896 20 10 CFCDHM C=Cc1ccc(CCNC(=O)c2cccc(O)c2[O-])cc1 ZINC000812595696 631738969 /nfs/dbraw/zinc/73/89/69/631738969.db2.gz MJVGICZNDFDKOI-UHFFFAOYSA-N -1 3 283.327 2.713 20 10 CFCDHM [O-]c1ccc(F)c(CNCc2ccc3c(c2)CCO3)c1F ZINC000816545361 632481478 /nfs/dbraw/zinc/48/14/78/632481478.db2.gz NOPNJHIEBDSURN-UHFFFAOYSA-N -1 3 291.297 2.895 20 10 CFCDHM [O-]c1cc(F)c(Cl)cc1CN1CC([C@@H]2CCOC2)C1 ZINC000816594643 632491970 /nfs/dbraw/zinc/49/19/70/632491970.db2.gz KRKOZHXHOSHFSD-SECBINFHSA-N -1 3 285.746 2.653 20 10 CFCDHM C[C@H]1CN(Cc2cccc(Br)c2[O-])[C@H]1C ZINC000816649325 632503032 /nfs/dbraw/zinc/50/30/32/632503032.db2.gz XLFWGMQWTBPXKJ-IUCAKERBSA-N -1 3 270.170 2.995 20 10 CFCDHM CCOc1ccc(C[NH2+]C[C@@H](CC(C)C)C(=O)[O-])c([O-])c1 ZINC000818630651 632884444 /nfs/dbraw/zinc/88/44/44/632884444.db2.gz VVAMWMSHOVYUSV-CYBMUJFWSA-N -1 3 295.379 2.627 20 10 CFCDHM C[C@H](NCc1cscn1)c1ccc(F)cc1[O-] ZINC000108941637 633744586 /nfs/dbraw/zinc/74/45/86/633744586.db2.gz OJPBDILCZXWEGK-QMMMGPOBSA-N -1 3 252.314 2.839 20 10 CFCDHM [O-]c1cccc(Br)c1CNC(CF)CF ZINC000858171492 636147500 /nfs/dbraw/zinc/14/75/00/636147500.db2.gz WULHZNVWALLLDK-UHFFFAOYSA-N -1 3 280.112 2.552 20 10 CFCDHM O=C(Nc1ccccc1-n1cccn1)c1cccc(O)c1[O-] ZINC000188176571 650318361 /nfs/dbraw/zinc/31/83/61/650318361.db2.gz PTLIJYGSMQDNFM-UHFFFAOYSA-N -1 3 295.298 2.536 20 10 CFCDHM [O-]c1cccc(Br)c1CN1CCSCC1 ZINC000862216449 637288104 /nfs/dbraw/zinc/28/81/04/637288104.db2.gz XBRGKCNXDYQRBB-UHFFFAOYSA-N -1 3 288.210 2.704 20 10 CFCDHM Cc1ccccc1C1(CNC(=O)c2cccc(O)c2[O-])CC1 ZINC000188365557 650325323 /nfs/dbraw/zinc/32/53/23/650325323.db2.gz SGCWVCVTDOTCAV-UHFFFAOYSA-N -1 3 297.354 2.868 20 10 CFCDHM O=C(NCCCc1cccc(F)c1)c1cccc(O)c1[O-] ZINC000193062019 650620299 /nfs/dbraw/zinc/62/02/99/650620299.db2.gz PZWVMFCPRCZKNJ-UHFFFAOYSA-N -1 3 289.306 2.600 20 10 CFCDHM Cc1cc(Cl)ncc1NC(=O)c1cccc(O)c1[O-] ZINC000193138194 650626619 /nfs/dbraw/zinc/62/66/19/650626619.db2.gz PITYNJHNVJTBJU-UHFFFAOYSA-N -1 3 278.695 2.707 20 10 CFCDHM CC[C@@H](NCc1nonc1C)c1cc(Cl)ccc1[O-] ZINC000872135857 641663807 /nfs/dbraw/zinc/66/38/07/641663807.db2.gz IODOYWUYWDFRLV-LLVKDONJSA-N -1 3 281.743 2.978 20 10 CFCDHM O=C(NCc1ccc(F)c(Cl)c1)c1cccc(O)c1[O-] ZINC000126385126 643188978 /nfs/dbraw/zinc/18/89/78/643188978.db2.gz FNHJSQNMODUSLH-UHFFFAOYSA-N -1 3 295.697 2.820 20 10 CFCDHM Cc1cc(NC(=O)c2cccc(O)c2[O-])ccc1F ZINC000126388878 643188994 /nfs/dbraw/zinc/18/89/94/643188994.db2.gz JUCQTUIAOMSHMF-UHFFFAOYSA-N -1 3 261.252 2.798 20 10 CFCDHM CC1CCC(CNC(=O)c2cccc(O)c2[O-])CC1 ZINC000126406404 643206082 /nfs/dbraw/zinc/20/60/82/643206082.db2.gz ZGQFOEVQWYGIJL-UHFFFAOYSA-N -1 3 263.337 2.654 20 10 CFCDHM O=C(c1cccc(O)c1[O-])N1CCC[C@@H]2CCC[C@@H]21 ZINC000126453943 643230609 /nfs/dbraw/zinc/23/06/09/643230609.db2.gz FHWKVVJYHLPHLW-JQWIXIFHSA-N -1 3 261.321 2.503 20 10 CFCDHM COc1ccc([C@H](C)NC(=O)c2cccc(O)c2[O-])cc1 ZINC000126466341 643234235 /nfs/dbraw/zinc/23/42/35/643234235.db2.gz ZSZJQOXMCCFTCJ-JTQLQIEISA-N -1 3 287.315 2.597 20 10 CFCDHM CC(C)(C)[C@@H]1CCN(C(=O)c2cccc(O)c2[O-])C1 ZINC000126538114 643289685 /nfs/dbraw/zinc/28/96/85/643289685.db2.gz ZMFUFRNGIJMQCE-SNVBAGLBSA-N -1 3 263.337 2.606 20 10 CFCDHM [O-]c1c(CN2CC(CC3CC3)C2)ccc(F)c1F ZINC000877647322 643429745 /nfs/dbraw/zinc/42/97/45/643429745.db2.gz WZCUAHQKEPIWHI-UHFFFAOYSA-N -1 3 253.292 2.902 20 10 CFCDHM CN(CC(=O)OC(C)(C)C)Cc1cc(Cl)ccc1[O-] ZINC000126928652 643763796 /nfs/dbraw/zinc/76/37/96/643763796.db2.gz NELZDEWRHYMUFU-UHFFFAOYSA-N -1 3 285.771 2.819 20 10 CFCDHM [O-]c1c(F)cc(F)cc1CN[C@@H]1CCCc2c[nH]nc21 ZINC000883048569 645582557 /nfs/dbraw/zinc/58/25/57/645582557.db2.gz RCNHERCBRXAEHP-GFCCVEGCSA-N -1 3 279.290 2.561 20 10 CFCDHM CCn1cc(CN[C@@H](C)c2c([O-])cccc2F)cn1 ZINC000886546903 647041762 /nfs/dbraw/zinc/04/17/62/647041762.db2.gz AFGAZZWRAKBQGK-JTQLQIEISA-N -1 3 263.316 2.599 20 10 CFCDHM COc1ccnc(CN[C@@H](C)c2c([O-])cccc2F)c1F ZINC000886637767 647081438 /nfs/dbraw/zinc/08/14/38/647081438.db2.gz DZKUSLFEWXJRBM-VIFPVBQESA-N -1 3 294.301 2.925 20 10 CFCDHM C[C@@H](Nc1cnn(CCF)c1)c1c([O-])cccc1F ZINC000886642063 647084173 /nfs/dbraw/zinc/08/41/73/647084173.db2.gz ZIMVXSMXZZRIRI-SECBINFHSA-N -1 3 267.279 2.870 20 10 CFCDHM C[C@@H](NCc1cc(C2CC2)n(C)n1)c1ccc(F)cc1[O-] ZINC000927107447 648714043 /nfs/dbraw/zinc/71/40/43/648714043.db2.gz FLCUOYKNGQWYDA-SNVBAGLBSA-N -1 3 289.354 2.993 20 10 CFCDHM COC1CCC(CC(=O)NCc2c([O-])cccc2F)CC1 ZINC000928705172 648943906 /nfs/dbraw/zinc/94/39/06/648943906.db2.gz GRUGIAISCOQWIL-UHFFFAOYSA-N -1 3 295.354 2.743 20 10 CFCDHM CC[C@H]1CCC[C@@H]1C(=O)NCc1c([O-])cccc1F ZINC000928705906 648944543 /nfs/dbraw/zinc/94/45/43/648944543.db2.gz MLWYJPQTXGKOAL-QWRGUYRKSA-N -1 3 265.328 2.974 20 10 CFCDHM COCCC1(C(=O)NCc2c([O-])cccc2F)CCCC1 ZINC000928705801 648944555 /nfs/dbraw/zinc/94/45/55/648944555.db2.gz MZSQBJHDPBOWHQ-UHFFFAOYSA-N -1 3 295.354 2.744 20 10 CFCDHM CC(C)(C)/C=C/C(=O)NCc1c([O-])cccc1F ZINC000928706579 648944669 /nfs/dbraw/zinc/94/46/69/648944669.db2.gz XPZXCBFYSARRTE-BQYQJAHWSA-N -1 3 251.301 2.750 20 10 CFCDHM CC(C)C[C@@H](C)OCCC(=O)NCc1c([O-])cccc1F ZINC000928706097 648944785 /nfs/dbraw/zinc/94/47/85/648944785.db2.gz QCLCDVGXTJJCSX-GFCCVEGCSA-N -1 3 297.370 2.989 20 10 CFCDHM CCCC[C@H](C)C(=O)NCc1c([O-])cccc1F ZINC000928707155 648945561 /nfs/dbraw/zinc/94/55/61/648945561.db2.gz BHRVDKPAMAZAPQ-JTQLQIEISA-N -1 3 253.317 2.974 20 10 CFCDHM CC[C@@H](C)CC[C@@H](O)CC(=O)NCc1c([O-])cccc1F ZINC000928708271 648945629 /nfs/dbraw/zinc/94/56/29/648945629.db2.gz JLKNUGROWLBNJY-VXGBXAGGSA-N -1 3 297.370 2.725 20 10 CFCDHM O=C(NCc1c([O-])cccc1F)[C@]12C[C@H]1CCCC2 ZINC000928710979 648946586 /nfs/dbraw/zinc/94/65/86/648946586.db2.gz YVBQXILAXMQWDS-MEBBXXQBSA-N -1 3 263.312 2.728 20 10 CFCDHM CCS[C@@H](C(=O)NCc1c([O-])cccc1F)C(C)C ZINC000928711823 648946791 /nfs/dbraw/zinc/94/67/91/648946791.db2.gz LLOFYQNJEWHDFO-CYBMUJFWSA-N -1 3 285.384 2.925 20 10 CFCDHM [O-]c1cccc(Cl)c1CNCc1cn2ccccc2n1 ZINC000113314556 651191206 /nfs/dbraw/zinc/19/12/06/651191206.db2.gz LHKJWWFVEOIPEZ-UHFFFAOYSA-N -1 3 287.750 2.983 20 10 CFCDHM CC(F)(F)CNCc1c([O-])cccc1Br ZINC000706825189 781204553 /nfs/dbraw/zinc/20/45/53/781204553.db2.gz QFXKOQZLSBOYBE-UHFFFAOYSA-N -1 3 280.112 2.900 20 10 CFCDHM O=C(c1cccc(O)c1[O-])N1CCC(C2CCC2)CC1 ZINC000692985896 770018077 /nfs/dbraw/zinc/01/80/77/770018077.db2.gz LDGBJECPQQPLBV-UHFFFAOYSA-N -1 3 275.348 2.750 20 10 CFCDHM C[C@H]1CN(Cc2c([O-])cccc2Cl)CCCC1=O ZINC001140337841 770526017 /nfs/dbraw/zinc/52/60/17/770526017.db2.gz IZKOGNVBCZTHAR-JTQLQIEISA-N -1 3 267.756 2.847 20 10 CFCDHM [O-]c1cc(F)cc(F)c1CN1CC[C@@H]2CCCO[C@@H]2C1 ZINC001140582793 770958962 /nfs/dbraw/zinc/95/89/62/770958962.db2.gz MZIWWOAGPINMRZ-ZUZCIYMTSA-N -1 3 283.318 2.671 20 10 CFCDHM C[N@H+](Cc1cccc(F)c1)Cc1ccc(C(=O)[O-])cc1[O-] ZINC001231446225 777220998 /nfs/dbraw/zinc/22/09/98/777220998.db2.gz FTIBYQCZRIXYDC-UHFFFAOYSA-N -1 3 289.306 2.862 20 10 CFCDHM C[N@@H+](Cc1cccc(F)c1)Cc1ccc(C(=O)[O-])cc1[O-] ZINC001231446225 777221003 /nfs/dbraw/zinc/22/10/03/777221003.db2.gz FTIBYQCZRIXYDC-UHFFFAOYSA-N -1 3 289.306 2.862 20 10 CFCDHM CCN(Cc1ccccn1)Cc1ccc(C(=O)[O-])cc1O ZINC001231455471 777223936 /nfs/dbraw/zinc/22/39/36/777223936.db2.gz PDIRFDJMSKQJGP-UHFFFAOYSA-N -1 3 286.331 2.508 20 10 CFCDHM O=C([O-])c1ccc([O-])c(C[NH+]2C[C@H]3CCCC[C@@H]3C2)c1 ZINC001231561309 777259831 /nfs/dbraw/zinc/25/98/31/777259831.db2.gz RXDQYCXOYHODOY-CHWSQXEVSA-N -1 3 275.348 2.712 20 10 CFCDHM O=C([O-])c1ccc([O-])c(C[N@@H+]2CC[C@H]3CCC[C@H]3C2)c1 ZINC001231561680 777260537 /nfs/dbraw/zinc/26/05/37/777260537.db2.gz YHIOKRPVXDRWIN-YPMHNXCESA-N -1 3 275.348 2.712 20 10 CFCDHM O=C([O-])c1ccc([O-])c(C[N@H+]2CC[C@H]3CCC[C@H]3C2)c1 ZINC001231561680 777260542 /nfs/dbraw/zinc/26/05/42/777260542.db2.gz YHIOKRPVXDRWIN-YPMHNXCESA-N -1 3 275.348 2.712 20 10 CFCDHM O=C([O-])c1ccc([O-])c(C[NH+]2CCc3ccccc3CC2)c1 ZINC001231564424 777261274 /nfs/dbraw/zinc/26/12/74/777261274.db2.gz QDQIZGYQKADDHZ-UHFFFAOYSA-N -1 3 297.354 2.691 20 10 CFCDHM C[N@H+](CCc1cccs1)Cc1cc(C(=O)[O-])ccc1[O-] ZINC001231565527 777261499 /nfs/dbraw/zinc/26/14/99/777261499.db2.gz ZWIMLOONEJIWLU-UHFFFAOYSA-N -1 3 291.372 2.826 20 10 CFCDHM C[N@@H+](CCc1cccs1)Cc1cc(C(=O)[O-])ccc1[O-] ZINC001231565527 777261506 /nfs/dbraw/zinc/26/15/06/777261506.db2.gz ZWIMLOONEJIWLU-UHFFFAOYSA-N -1 3 291.372 2.826 20 10 CFCDHM Cc1cc([O-])c(CN2CCCC(=O)CC2)cc1Cl ZINC001231867958 777357622 /nfs/dbraw/zinc/35/76/22/777357622.db2.gz OLXCRBRQNXZJFN-UHFFFAOYSA-N -1 3 267.756 2.909 20 10 CFCDHM CO[C@H]1CN(Cc2cc(Cl)c(C)cc2[O-])C[C@@H]1F ZINC001231869268 777358781 /nfs/dbraw/zinc/35/87/81/777358781.db2.gz OGZPBHDCKDWEGK-AAEUAGOBSA-N -1 3 273.735 2.523 20 10 CFCDHM [O-]c1c(Cl)cccc1CN1CC2(CSC2)C1 ZINC001231914887 777382499 /nfs/dbraw/zinc/38/24/99/777382499.db2.gz UYZJDNXUCWFJDT-UHFFFAOYSA-N -1 3 255.770 2.594 20 10 CFCDHM COc1cc([O-])c(CN2C[C@@H](C)O[C@H](C)C2)cc1Cl ZINC001232266746 777500266 /nfs/dbraw/zinc/50/02/66/777500266.db2.gz XTXZFVXEUCXALH-NXEZZACHSA-N -1 3 285.771 2.663 20 10 CFCDHM COc1cc([O-])c(CN2CCOCC23CCC3)cc1Cl ZINC001232269749 777500810 /nfs/dbraw/zinc/50/08/10/777500810.db2.gz JPIGATKJZBRBLQ-UHFFFAOYSA-N -1 3 297.782 2.809 20 10 CFCDHM COc1cc([O-])c(CN2CCO[C@H](C(C)C)C2)cc1Cl ZINC001232268573 777500868 /nfs/dbraw/zinc/50/08/68/777500868.db2.gz PYVQYRGYRTVUSZ-HNNXBMFYSA-N -1 3 299.798 2.911 20 10 CFCDHM COC[C@@H]1CCCCN1Cc1c([O-])ccc(F)c1F ZINC001233332373 777889582 /nfs/dbraw/zinc/88/95/82/777889582.db2.gz JDMZRZSRYFJRQA-JTQLQIEISA-N -1 3 271.307 2.671 20 10 CFCDHM [O-]c1ccc(F)c(F)c1CN1C[C@@H]2C[C@H]1C[C@H]2F ZINC001233334398 777894017 /nfs/dbraw/zinc/89/40/17/777894017.db2.gz FDAOUPGAFPGZTJ-DKCNOQQISA-N -1 3 257.255 2.603 20 10 CFCDHM [O-]c1ccc(F)c(F)c1CN1CCC[C@@H](CF)C1 ZINC001233334707 777895063 /nfs/dbraw/zinc/89/50/63/777895063.db2.gz QNCIRPFDKWZSAO-VIFPVBQESA-N -1 3 259.271 2.852 20 10 CFCDHM [O-]c1cc(F)c(F)cc1CN(CCO)Cc1cccs1 ZINC001142520686 778399217 /nfs/dbraw/zinc/39/92/17/778399217.db2.gz NTJAADONNQUIGI-UHFFFAOYSA-N -1 3 299.342 2.726 20 10 CFCDHM CN(Cc1cc(Cl)c(Cl)cc1[O-])C1(C)COC1 ZINC001236798053 778941225 /nfs/dbraw/zinc/94/12/25/778941225.db2.gz FWFYETNYCUPZIC-UHFFFAOYSA-N -1 3 276.163 2.920 20 10 CFCDHM C[C@@H]1CCN(Cc2cc(Cl)c(Cl)cc2[O-])C[C@H]1O ZINC001236792721 778939616 /nfs/dbraw/zinc/93/96/16/778939616.db2.gz HFDQZXBOIGROJT-AMIZOPFISA-N -1 3 290.190 2.902 20 10 CFCDHM COCC1CN(Cc2c([O-])ccc(Cl)c2Cl)C1 ZINC001237077850 779007336 /nfs/dbraw/zinc/00/73/36/779007336.db2.gz LAJUFPQEIXWDDC-UHFFFAOYSA-N -1 3 276.163 2.777 20 10 CFCDHM C[C@@H]1CN(Cc2cc(F)ccc2[O-])C[C@](C)(C(F)F)O1 ZINC000698929145 779103900 /nfs/dbraw/zinc/10/39/00/779103900.db2.gz PAFYMRWDOPWBNC-YMTOWFKASA-N -1 3 289.297 2.776 20 10 CFCDHM COC[C@H]1CCCN1Cc1cc(Cl)cc(F)c1[O-] ZINC001237618746 779145670 /nfs/dbraw/zinc/14/56/70/779145670.db2.gz ILCCWFRZUFAVGU-LLVKDONJSA-N -1 3 273.735 2.796 20 10 CFCDHM O=C1CCC[C@H]2CN(Cc3cc(F)cc(Cl)c3[O-])C[C@@H]12 ZINC001237800332 779181455 /nfs/dbraw/zinc/18/14/55/779181455.db2.gz JMQRQTGLBCPSST-JOYOIKCWSA-N -1 3 297.757 2.986 20 10 CFCDHM [O-]c1c(Cl)cc(F)cc1CN1CCC[C@@H](CCO)C1 ZINC001237800377 779181958 /nfs/dbraw/zinc/18/19/58/779181958.db2.gz YGPFYGHWMJELPE-JTQLQIEISA-N -1 3 287.762 2.779 20 10 CFCDHM [O-]c1c(Cl)cc(F)cc1CN1CCCC[C@H](O)C1 ZINC001237807456 779184375 /nfs/dbraw/zinc/18/43/75/779184375.db2.gz JDMPZZKYRVJISZ-NSHDSACASA-N -1 3 273.735 2.532 20 10 CFCDHM C[C@@H]1CCCN(Cc2cc(F)cc(Cl)c2[O-])[C@@H]1CO ZINC001237808965 779184813 /nfs/dbraw/zinc/18/48/13/779184813.db2.gz XGJKGBCCBFSBQI-NOZJJQNGSA-N -1 3 287.762 2.778 20 10 CFCDHM CC(=O)C1CCN(Cc2cc(F)c(Cl)cc2[O-])CC1 ZINC001237937721 779211178 /nfs/dbraw/zinc/21/11/78/779211178.db2.gz UGVYYRPOHAJLAZ-UHFFFAOYSA-N -1 3 285.746 2.986 20 10 CFCDHM CC(=O)[C@@H]1CCN(Cc2cc(F)c(Cl)cc2[O-])C1 ZINC001237941605 779213426 /nfs/dbraw/zinc/21/34/26/779213426.db2.gz ZDZRDTYJBLRYLH-SECBINFHSA-N -1 3 271.719 2.596 20 10 CFCDHM [O-]c1cc(Cl)c(F)cc1CN1CCC[C@]2(CCO2)C1 ZINC001237950557 779214636 /nfs/dbraw/zinc/21/46/36/779214636.db2.gz WQIZKIPXXUQSEI-AWEZNQCLSA-N -1 3 285.746 2.940 20 10 CFCDHM [O-]c1cccc(F)c1CN(CCO)Cc1cccs1 ZINC001137837314 781137621 /nfs/dbraw/zinc/13/76/21/781137621.db2.gz AXACUISPAZOADG-UHFFFAOYSA-N -1 3 281.352 2.587 20 10 CFCDHM CC(C)[C@H]1CN(Cc2cc(Cl)ccc2[O-])CCO1 ZINC000709028899 781288232 /nfs/dbraw/zinc/28/82/32/781288232.db2.gz ISNIJDIJMWPQRH-CQSZACIVSA-N -1 3 269.772 2.902 20 10 CFCDHM C[C@@]1(C(F)(F)F)CCN(C(=O)c2cccc(O)c2[O-])C1 ZINC000709338885 781309911 /nfs/dbraw/zinc/30/99/11/781309911.db2.gz DKOBUPBMKBEPTO-GFCCVEGCSA-N -1 3 289.253 2.512 20 10 CFCDHM C[C@H]1CN(C(=O)c2cccc(O)c2[O-])[C@H]2CCCC[C@H]12 ZINC000193158840 290780691 /nfs/dbraw/zinc/78/06/91/290780691.db2.gz IAZJHZVAALKZGK-LOWVWBTDSA-N -1 3 275.348 2.749 20 10 CFCDHM CCCOc1ccc(CN2CCOC[C@@H]2C2CC2)c([O-])c1 ZINC000093645696 375284617 /nfs/dbraw/zinc/28/46/17/375284617.db2.gz YODAYBANQSEGKE-MRXNPFEDSA-N -1 3 291.391 2.792 20 10 CFCDHM CN(Cc1ccccc1[O-])[C@@H]1CCN(c2ccccc2)C1=O ZINC000109769113 375823378 /nfs/dbraw/zinc/82/33/78/375823378.db2.gz ALYHVXVBVBWZMR-MRXNPFEDSA-N -1 3 296.370 2.630 20 10 CFCDHM CCCCC[C@H](C)NC(=O)CN(C)Cc1ccccc1[O-] ZINC000111236101 375835112 /nfs/dbraw/zinc/83/51/12/375835112.db2.gz HZESLKLGUAQZIO-AWEZNQCLSA-N -1 3 292.423 2.909 20 10 CFCDHM C[C@@H]1[C@@H](C(=O)NCc2cc(Cl)ccc2[O-])[C@H]1C1CC1 ZINC000529510417 383714287 /nfs/dbraw/zinc/71/42/87/383714287.db2.gz BGYQWXQQNJFCTG-MCCGJVOXSA-N -1 3 279.767 2.954 20 10 CFCDHM C[C@@H]1[C@H](C(=O)NCc2cc(Cl)ccc2[O-])[C@H]1C1CC1 ZINC000529510420 383714348 /nfs/dbraw/zinc/71/43/48/383714348.db2.gz BGYQWXQQNJFCTG-PCTYZZJISA-N -1 3 279.767 2.954 20 10 CFCDHM O=C(c1cccc(O)c1[O-])N1CC[C@H](c2ccccc2)C1 ZINC000126376777 377223607 /nfs/dbraw/zinc/22/36/07/377223607.db2.gz KEJJLOLHEQTWGR-ZDUSSCGKSA-N -1 3 283.327 2.728 20 10 CFCDHM CCC(C)(C)OC1CN(Cc2cc(F)ccc2[O-])C1 ZINC000529642425 383740548 /nfs/dbraw/zinc/74/05/48/383740548.db2.gz ROPLALLEXXJLGL-UHFFFAOYSA-N -1 3 267.344 2.921 20 10 CFCDHM Cc1cc(Cl)cc(CN2CCSCC2)c1[O-] ZINC000179666166 380568750 /nfs/dbraw/zinc/56/87/50/380568750.db2.gz CAPAETZEEVNSGK-UHFFFAOYSA-N -1 3 257.786 2.903 20 10 CFCDHM COCCN(Cc1cc(F)ccc1[O-])CC(F)(F)F ZINC000180009695 380608929 /nfs/dbraw/zinc/60/89/29/380608929.db2.gz BPJJSAISOQHIOF-UHFFFAOYSA-N -1 3 281.249 2.542 20 10 CFCDHM [O-]c1c(Cl)cccc1CN1CCS[C@H]2COCC[C@@H]21 ZINC000180683869 380689126 /nfs/dbraw/zinc/68/91/26/380689126.db2.gz DXKBGRQLWXVTTA-STQMWFEESA-N -1 3 299.823 2.752 20 10 CFCDHM COC[C@@H](NCc1cc(F)ccc1[O-])c1ccco1 ZINC000180826440 380702571 /nfs/dbraw/zinc/70/25/71/380702571.db2.gz CDNCQQGHYOFNPZ-GFCCVEGCSA-N -1 3 265.284 2.602 20 10 CFCDHM CC[C@H](c1ccccc1[O-])N1CCn2c(nnc2C2CC2)C1 ZINC000368815999 381140500 /nfs/dbraw/zinc/14/05/00/381140500.db2.gz IGWSSMZPSXLUJQ-CQSZACIVSA-N -1 3 298.390 2.828 20 10 CFCDHM CS[C@H]1CCCCN(C(=O)c2ccc(C)c(O)c2[O-])C1 ZINC000182851983 381170948 /nfs/dbraw/zinc/17/09/48/381170948.db2.gz MLAAHMPJDNOZEI-NSHDSACASA-N -1 3 295.404 2.764 20 10 CFCDHM Cc1ccc(C(=O)N2CC[C@H](C)[C@@H](C)C2)c([O-])c1O ZINC000182964950 381191542 /nfs/dbraw/zinc/19/15/42/381191542.db2.gz VJUOADXRHMLUPQ-ONGXEEELSA-N -1 3 263.337 2.524 20 10 CFCDHM COc1cc(Cl)cc(CN2CCS[C@H](C)C2)c1[O-] ZINC000184688425 381461542 /nfs/dbraw/zinc/46/15/42/381461542.db2.gz NDXXYHRBEICFPB-SECBINFHSA-N -1 3 287.812 2.992 20 10 CFCDHM CCCN(Cc1cc(COC)on1)Cc1ccccc1[O-] ZINC000297929055 381575233 /nfs/dbraw/zinc/57/52/33/381575233.db2.gz UKZZXYQPHAMCGS-UHFFFAOYSA-N -1 3 290.363 2.939 20 10 CFCDHM C[C@@H]1COCCN(Cc2cc(Cl)ccc2[O-])C1 ZINC000359878463 381655230 /nfs/dbraw/zinc/65/52/30/381655230.db2.gz RGCNWBHQUQUMPY-JTQLQIEISA-N -1 3 255.745 2.514 20 10 CFCDHM Cc1ccc(C(=O)N2CC(Cc3ccccc3)C2)c([O-])c1O ZINC000371673209 381674173 /nfs/dbraw/zinc/67/41/73/381674173.db2.gz XUBRMNSGJUHMAI-UHFFFAOYSA-N -1 3 297.354 2.721 20 10 CFCDHM [O-]c1ccc(F)cc1CNc1cccc2c1OCC[C@H]2O ZINC000185578857 381670144 /nfs/dbraw/zinc/67/01/44/381670144.db2.gz YODPIKQFWVJKJN-OAHLLOKOSA-N -1 3 289.306 2.959 20 10 CFCDHM Cc1nc([C@H]2CCCN(Cc3cccc(F)c3[O-])C2)no1 ZINC000373123000 381933284 /nfs/dbraw/zinc/93/32/84/381933284.db2.gz HLHXQRWFGQRSJP-LBPRGKRZSA-N -1 3 291.326 2.602 20 10 CFCDHM C[C@H](N[C@H](CCO)c1ccco1)c1ccc(F)cc1[O-] ZINC000186562902 381948017 /nfs/dbraw/zinc/94/80/17/381948017.db2.gz GQBHWWOCHVBZQS-GXFFZTMASA-N -1 3 279.311 2.899 20 10 CFCDHM COCC1=CCN(Cc2cccc(Cl)c2[O-])CC1 ZINC000187613936 382226857 /nfs/dbraw/zinc/22/68/57/382226857.db2.gz NFMDWMMBGJUGRE-UHFFFAOYSA-N -1 3 267.756 2.824 20 10 CFCDHM CCc1nocc1CN(C)Cc1cc(F)ccc1[O-] ZINC000293763310 382269249 /nfs/dbraw/zinc/26/92/49/382269249.db2.gz XZEYWSJQNUFJRP-UHFFFAOYSA-N -1 3 264.300 2.714 20 10 CFCDHM CC[C@@H](NC(=O)c1cccc(O)c1[O-])c1nc(C)cs1 ZINC000188425191 382411318 /nfs/dbraw/zinc/41/13/18/382411318.db2.gz PCESGLPOKUAHOR-SNVBAGLBSA-N -1 3 292.360 2.744 20 10 CFCDHM [O-]c1cc(F)c(Cl)cc1CN1CCSCC1 ZINC000294334000 382510485 /nfs/dbraw/zinc/51/04/85/382510485.db2.gz ADNDSGLZTFTVHL-UHFFFAOYSA-N -1 3 261.749 2.734 20 10 CFCDHM CCCN(CCC)C(=O)c1ccc(C)c(O)c1[O-] ZINC000267566122 384416356 /nfs/dbraw/zinc/41/63/56/384416356.db2.gz HMICEKHASZNGAU-UHFFFAOYSA-N -1 3 251.326 2.668 20 10 CFCDHM CN(C)C(=O)CN(C)Cc1cc(-c2ccccc2)ccc1[O-] ZINC000271051361 385320718 /nfs/dbraw/zinc/32/07/18/385320718.db2.gz VUZABJHXDFLLGA-UHFFFAOYSA-N -1 3 298.386 2.579 20 10 CFCDHM CCn1cnnc1CN[C@H](C)c1cc(Cl)ccc1[O-] ZINC000273371017 385678412 /nfs/dbraw/zinc/67/84/12/385678412.db2.gz GFEHAHQRRQMENO-SECBINFHSA-N -1 3 280.759 2.508 20 10 CFCDHM CC[C@H]1CC[C@@H](C)N1C(=O)c1ccc(C)c(O)c1[O-] ZINC000272963754 385669023 /nfs/dbraw/zinc/66/90/23/385669023.db2.gz JWTHXWKGGCADOE-MNOVXSKESA-N -1 3 263.337 2.809 20 10 CFCDHM CCCCCCNC(=O)CN(C)Cc1ccccc1[O-] ZINC000109773496 393879782 /nfs/dbraw/zinc/87/97/82/393879782.db2.gz ZUJUEQICSODQHD-UHFFFAOYSA-N -1 3 278.396 2.521 20 10 CFCDHM O=S(=O)([N-]c1ccc(O)cc1)c1ccc2c(c1)CCC2 ZINC000034936942 171896571 /nfs/dbraw/zinc/89/65/71/171896571.db2.gz WLLBTDDZQNPRRD-UHFFFAOYSA-N -1 3 289.356 2.682 20 10 CFCDHM CC[C@@H](c1ccccc1[O-])N1CCn2cncc2C1 ZINC000368215808 267152749 /nfs/dbraw/zinc/15/27/49/267152749.db2.gz OKIQKHXNODRTTM-AWEZNQCLSA-N -1 3 257.337 2.556 20 10 CFCDHM O=C(c1cccc(O)c1[O-])N1C[C@@H]2CCCCC[C@H]21 ZINC000370492277 267322810 /nfs/dbraw/zinc/32/28/10/267322810.db2.gz PUGHLASQWUYGIS-CMPLNLGQSA-N -1 3 261.321 2.503 20 10 CFCDHM CC[C@H](NC1CN(C(=O)OC)C1)c1cccc(Cl)c1[O-] ZINC000287783611 288035852 /nfs/dbraw/zinc/03/58/52/288035852.db2.gz SHQDYUMVWQPMFN-LBPRGKRZSA-N -1 3 298.770 2.537 20 10 CFCDHM C[C@@H](N[C@H]1CCCc2c[nH]nc21)c1ccc(F)cc1[O-] ZINC000273496055 278383837 /nfs/dbraw/zinc/38/38/37/278383837.db2.gz PBLFQZZTJISEJK-RNCFNFMXSA-N -1 3 275.327 2.983 20 10 CFCDHM CC[C@H](c1ccccc1[O-])N1CCC[C@H]1c1nncn1C ZINC000377694995 281024759 /nfs/dbraw/zinc/02/47/59/281024759.db2.gz LKIDOLYSFLEZTL-KGLIPLIRSA-N -1 3 286.379 2.809 20 10 CFCDHM Cc1ccc(C(=O)N2CC[C@@H](C)C(C)(C)C2)c([O-])c1O ZINC000274287238 301514107 /nfs/dbraw/zinc/51/41/07/301514107.db2.gz ZZANWUNYUOPJTM-LLVKDONJSA-N -1 3 277.364 2.914 20 10 CFCDHM CO[C@H](CNCc1c([O-])cccc1Cl)C(F)(F)F ZINC000733328887 574221734 /nfs/dbraw/zinc/22/17/34/574221734.db2.gz GJOWNOUATOFJDP-SNVBAGLBSA-N -1 3 283.677 2.713 20 10 CFCDHM CCCN(CC(C)C)C(=O)c1cccc(O)c1[O-] ZINC000279554290 521583265 /nfs/dbraw/zinc/58/32/65/521583265.db2.gz MYARHSYBVSKCBO-UHFFFAOYSA-N -1 3 251.326 2.606 20 10 CFCDHM CC(=O)c1cc(F)cc(CN(C(C)C)[C@@H]2CCOC2)c1[O-] ZINC000291710427 518282857 /nfs/dbraw/zinc/28/28/57/518282857.db2.gz INRUHTOMCCUDRO-CQSZACIVSA-N -1 3 295.354 2.733 20 10 CFCDHM CCOCc1nc([C@@H](C)N[C@@H](C)c2ccccc2[O-])no1 ZINC000290020800 520219878 /nfs/dbraw/zinc/21/98/78/520219878.db2.gz CGRXUADNORXDCD-WDEREUQCSA-N -1 3 291.351 2.724 20 10 CFCDHM CCCOc1ccc(CN2CCO[C@H]3CCC[C@H]32)c([O-])c1 ZINC000228144629 520350760 /nfs/dbraw/zinc/35/07/60/520350760.db2.gz SVRSWQRFROYZRO-WBVHZDCISA-N -1 3 291.391 2.934 20 10 CFCDHM CCN(Cc1c([O-])cccc1Cl)C[C@H](C)OC ZINC000291012860 521281256 /nfs/dbraw/zinc/28/12/56/521281256.db2.gz BEWOCPVWDXFMIL-JTQLQIEISA-N -1 3 257.761 2.902 20 10 CFCDHM CCCN(Cc1ccccc1[O-])[C@@H](C)C(=O)OCC ZINC000076074180 521690879 /nfs/dbraw/zinc/69/08/79/521690879.db2.gz ZTKAQIKJPBGTBF-LBPRGKRZSA-N -1 3 265.353 2.556 20 10 CFCDHM CC[C@H](C)N(CCO)Cc1cc(Cl)cc(C(C)=O)c1[O-] ZINC000287503534 523937628 /nfs/dbraw/zinc/93/76/28/523937628.db2.gz UDJQWKXTWZICGE-JTQLQIEISA-N -1 3 299.798 2.841 20 10 CFCDHM CO[C@H]1CN(Cc2c([O-])cccc2Cl)CC[C@@H]1C ZINC000221275866 524007624 /nfs/dbraw/zinc/00/76/24/524007624.db2.gz RLYRESLYSXSGLA-HZMBPMFUSA-N -1 3 269.772 2.902 20 10 CFCDHM Cc1cc(CNCc2c([O-])cccc2Cl)on1 ZINC000083552451 524759541 /nfs/dbraw/zinc/75/95/41/524759541.db2.gz ITRCAYRMUFHZSK-UHFFFAOYSA-N -1 3 252.701 2.632 20 10 CFCDHM C[C@H](NCc1c([O-])cccc1Cl)C(=O)OC(C)(C)C ZINC000158040536 525427787 /nfs/dbraw/zinc/42/77/87/525427787.db2.gz LEQZPKGFDCURIG-VIFPVBQESA-N -1 3 285.771 2.865 20 10 CFCDHM C[C@H](N[C@@H](C)c1ccc(F)c(F)c1[O-])c1cnn(C)c1 ZINC000276883677 525530784 /nfs/dbraw/zinc/53/07/84/525530784.db2.gz GLAHPHFDXODQHI-IUCAKERBSA-N -1 3 281.306 2.816 20 10 CFCDHM C[C@@H](N[C@H](C)c1ccc(F)cc1[O-])c1cnn(C)c1 ZINC000273611010 525660580 /nfs/dbraw/zinc/66/05/80/525660580.db2.gz VVGYAQHCEYXGHN-NXEZZACHSA-N -1 3 263.316 2.677 20 10 CFCDHM Cc1ccc([C@@H](NCc2ccc(N(C)C)cc2)C(=O)[O-])cc1 ZINC000277087022 525775945 /nfs/dbraw/zinc/77/59/45/525775945.db2.gz XEFKTTJCUJWDFX-QGZVFWFLSA-N -1 3 298.386 2.977 20 10 CFCDHM Cc1c([C@@H](C)N[C@@H](C)c2ccc(F)cc2[O-])cnn1C ZINC000062747618 525901351 /nfs/dbraw/zinc/90/13/51/525901351.db2.gz IJOYCFFOAMLDJD-VHSXEESVSA-N -1 3 277.343 2.985 20 10 CFCDHM Cc1ccc([C@H](NCc2ccc(N(C)C)cc2)C(=O)[O-])cc1 ZINC000277087018 525968994 /nfs/dbraw/zinc/96/89/94/525968994.db2.gz XEFKTTJCUJWDFX-KRWDZBQOSA-N -1 3 298.386 2.977 20 10 CFCDHM CCO[C@H]1C[C@@H](N(C)C(=O)c2cc([O-])cs2)C1(C)C ZINC000754905147 574127569 /nfs/dbraw/zinc/12/75/69/574127569.db2.gz CWQLMUJSFIQFEY-NEPJUHHUSA-N -1 3 283.393 2.729 20 10 CFCDHM O=C(Nc1nc2ccccc2[nH]1)c1cc([O-])cs1 ZINC000731861845 574130900 /nfs/dbraw/zinc/13/09/00/574130900.db2.gz QLGROBFTAPMVSY-UHFFFAOYSA-N -1 3 259.290 2.582 20 10 CFCDHM Cc1ccccc1OCCNC(=O)c1cc([O-])cs1 ZINC000731870281 574131401 /nfs/dbraw/zinc/13/14/01/574131401.db2.gz KQVGVNNFSLGZPP-UHFFFAOYSA-N -1 3 277.345 2.571 20 10 CFCDHM O=C(NCCCOc1ccc(F)cc1)c1cc([O-])cs1 ZINC000731873051 574131900 /nfs/dbraw/zinc/13/19/00/574131900.db2.gz VSILSUHWIZIVCB-UHFFFAOYSA-N -1 3 295.335 2.792 20 10 CFCDHM O=C(NCc1cnn(-c2ccccc2)c1)c1cc([O-])cs1 ZINC000731866405 574132435 /nfs/dbraw/zinc/13/24/35/574132435.db2.gz HRLKPPQNWYFENA-UHFFFAOYSA-N -1 3 299.355 2.569 20 10 CFCDHM O=C(NCCc1cccc(F)c1)c1cc([O-])cs1 ZINC000731866595 574132469 /nfs/dbraw/zinc/13/24/69/574132469.db2.gz XCSDDCRAIMFDRX-UHFFFAOYSA-N -1 3 265.309 2.565 20 10 CFCDHM O=C(c1cc([O-])cs1)N1CCC[C@@H](C(F)(F)F)C1 ZINC000731898389 574133602 /nfs/dbraw/zinc/13/36/02/574133602.db2.gz KBFGUJZBOPMHLN-SSDOTTSWSA-N -1 3 279.283 2.868 20 10 CFCDHM O=C(OCc1ccc(Cl)nc1)c1cc([O-])cs1 ZINC000731910660 574133643 /nfs/dbraw/zinc/13/36/43/574133643.db2.gz VIVMNINOENRDOS-UHFFFAOYSA-N -1 3 269.709 2.859 20 10 CFCDHM Cc1nc(NC(=O)c2cc([O-])cs2)sc1C ZINC000732262522 574147799 /nfs/dbraw/zinc/14/77/99/574147799.db2.gz BOTIZITWYBWJPW-UHFFFAOYSA-N -1 3 254.336 2.779 20 10 CFCDHM O=C(N[C@H]1C[C@H]1c1cccc(F)c1)c1cc([O-])cs1 ZINC000732278417 574147877 /nfs/dbraw/zinc/14/78/77/574147877.db2.gz MDZAACWCRLSVOE-RYUDHWBXSA-N -1 3 277.320 2.879 20 10 CFCDHM Cc1ccc(CNC(=O)c2cc([O-])cs2)cc1F ZINC000732259190 574148291 /nfs/dbraw/zinc/14/82/91/574148291.db2.gz NXYVIQOJGYSBTF-UHFFFAOYSA-N -1 3 265.309 2.831 20 10 CFCDHM Cc1cc([C@@H]2CCCN2C(=O)c2cc([O-])cs2)no1 ZINC000732268950 574148529 /nfs/dbraw/zinc/14/85/29/574148529.db2.gz UHGAIZMPYLTLRH-NSHDSACASA-N -1 3 278.333 2.727 20 10 CFCDHM CC(=O)Nc1cc(NC(=O)c2cc([O-])cs2)ccc1C ZINC000732271963 574148870 /nfs/dbraw/zinc/14/88/70/574148870.db2.gz BILKGXNWPTWTMS-UHFFFAOYSA-N -1 3 290.344 2.973 20 10 CFCDHM CCCCc1cc(NC(=O)c2cc([O-])cs2)n[nH]1 ZINC000732278980 574149841 /nfs/dbraw/zinc/14/98/41/574149841.db2.gz HSHSDYWXLKOWCY-UHFFFAOYSA-N -1 3 265.338 2.772 20 10 CFCDHM COc1ccc2c(c1)CCN2C(=O)c1cc([O-])cs1 ZINC000732278786 574149877 /nfs/dbraw/zinc/14/98/77/574149877.db2.gz BQMFAWMMKIGLDE-UHFFFAOYSA-N -1 3 275.329 2.665 20 10 CFCDHM Cc1cccc2c1CCN2C(=O)c1cc([O-])cs1 ZINC000732279198 574149889 /nfs/dbraw/zinc/14/98/89/574149889.db2.gz KKAPZDAKBSRHBA-UHFFFAOYSA-N -1 3 259.330 2.965 20 10 CFCDHM O=C(NC/C=C\c1ccccc1)c1cc([O-])cs1 ZINC000733000128 574182707 /nfs/dbraw/zinc/18/27/07/574182707.db2.gz NTRUIDPVTCHJPS-DAXSKMNVSA-N -1 3 259.330 2.897 20 10 CFCDHM Cc1cc(F)ccc1CCNC(=O)c1cc([O-])cs1 ZINC000755860951 574193127 /nfs/dbraw/zinc/19/31/27/574193127.db2.gz ZRJUSKPCXZAPJM-UHFFFAOYSA-N -1 3 279.336 2.874 20 10 CFCDHM COc1cc(CN[C@H](C)c2cc(F)cc(F)c2[O-])ccn1 ZINC000756398075 574233693 /nfs/dbraw/zinc/23/36/93/574233693.db2.gz BKNAFZPQMOISFP-SECBINFHSA-N -1 3 294.301 2.925 20 10 CFCDHM C[C@H]1C[C@@H](NCc2cc[nH]n2)c2c1c(F)ccc2[O-] ZINC000756554915 574246860 /nfs/dbraw/zinc/24/68/60/574246860.db2.gz KBBIYLYKCDKLOV-GZMMTYOYSA-N -1 3 261.300 2.593 20 10 CFCDHM CCc1nnc([C@@H](C)N[C@@H](C)c2cc(F)cc(F)c2[O-])[nH]1 ZINC000756780216 574262437 /nfs/dbraw/zinc/26/24/37/574262437.db2.gz XIAAHXXXGRLAGZ-JGVFFNPUSA-N -1 3 296.321 2.763 20 10 CFCDHM CCc1nc([C@@H](C)N[C@@H](C)c2cc(F)cc(F)c2[O-])n[nH]1 ZINC000756780216 574262439 /nfs/dbraw/zinc/26/24/39/574262439.db2.gz XIAAHXXXGRLAGZ-JGVFFNPUSA-N -1 3 296.321 2.763 20 10 CFCDHM O=C(N[C@@H]1C[C@H]1Cc1ccccc1)c1cc([O-])cs1 ZINC000743632529 574308367 /nfs/dbraw/zinc/30/83/67/574308367.db2.gz IAYWABOGMAPPTK-DGCLKSJQSA-N -1 3 273.357 2.815 20 10 CFCDHM C[C@H]([NH2+]Cc1cc(-c2ccccc2)ccc1[O-])C(=O)[O-] ZINC000739030984 574312137 /nfs/dbraw/zinc/31/21/37/574312137.db2.gz JCSXSPNDEPWLNS-NSHDSACASA-N -1 3 271.316 2.622 20 10 CFCDHM O=C(NCc1c(O)ccc2c1CCCC2)c1ccccc1[O-] ZINC000743719842 574371244 /nfs/dbraw/zinc/37/12/44/574371244.db2.gz WULARCUXVDQPOP-UHFFFAOYSA-N -1 3 297.354 2.907 20 10 CFCDHM CC(C)[C@@H]1OCCC[C@@H]1CNC(=O)c1cc([O-])cs1 ZINC000752816365 574395463 /nfs/dbraw/zinc/39/54/63/574395463.db2.gz SIVCBFLQYDMWBY-MFKMUULPSA-N -1 3 283.393 2.635 20 10 CFCDHM CCOC(=O)[C@H](CC1CC1)NCc1cc(Cl)ccc1[O-] ZINC000753567699 574404733 /nfs/dbraw/zinc/40/47/33/574404733.db2.gz HOCYSTQVODBWOR-ZDUSSCGKSA-N -1 3 297.782 2.867 20 10 CFCDHM CC[C@H]([NH2+]CCCCC(=O)[O-])c1ccccc1[O-] ZINC000820285362 597808897 /nfs/dbraw/zinc/80/88/97/597808897.db2.gz ZPNOTYLMEFXHBN-LBPRGKRZSA-N -1 3 251.326 2.688 20 10 CFCDHM O=C([O-])c1cccc(C[NH2+]Cc2cc(F)ccc2[O-])c1 ZINC000821552291 598213060 /nfs/dbraw/zinc/21/30/60/598213060.db2.gz GJRBURZZLYDQER-UHFFFAOYSA-N -1 3 275.279 2.519 20 10 CFCDHM CCOc1ccc(C[NH2+]C(CC)(CC)CC(=O)[O-])c([O-])c1 ZINC000830075337 601261844 /nfs/dbraw/zinc/26/18/44/601261844.db2.gz OOMJUMXXXJASCC-UHFFFAOYSA-N -1 3 295.379 2.914 20 10 CFCDHM CCc1oc(C(=O)[O-])cc1CN(C)Cc1ccccc1O ZINC000830362532 601418042 /nfs/dbraw/zinc/41/80/42/601418042.db2.gz BODQUSZBEKWLIR-UHFFFAOYSA-N -1 3 289.331 2.878 20 10 CFCDHM Cc1cccc(CNc2cccc(-c3nnn[n-]3)c2C)c1O ZINC000826298412 609486492 /nfs/dbraw/zinc/48/64/92/609486492.db2.gz RGWOLHMRJFYWRX-UHFFFAOYSA-N -1 3 295.346 2.801 20 10 CFCDHM Cc1cccc(CNc2cccc(-c3nn[n-]n3)c2C)c1O ZINC000826298412 609486494 /nfs/dbraw/zinc/48/64/94/609486494.db2.gz RGWOLHMRJFYWRX-UHFFFAOYSA-N -1 3 295.346 2.801 20 10 CFCDHM Cc1noc(C)c1CN(C)Cc1cc(F)cc(F)c1[O-] ZINC000893961572 618248137 /nfs/dbraw/zinc/24/81/37/618248137.db2.gz CJZSQALHHHUITF-UHFFFAOYSA-N -1 3 282.290 2.907 20 10 CFCDHM CC(C)CO[C@@H]1CCN(Cc2cc(F)cc(F)c2[O-])C1 ZINC000894095986 618322096 /nfs/dbraw/zinc/32/20/96/618322096.db2.gz SUNCCGCTTLJDGZ-CYBMUJFWSA-N -1 3 285.334 2.917 20 10 CFCDHM [O-]c1ccc(Br)cc1CNCc1cscn1 ZINC000163761413 618680920 /nfs/dbraw/zinc/68/09/20/618680920.db2.gz ZODJTVZJXIWECK-UHFFFAOYSA-N -1 3 299.193 2.901 20 10 CFCDHM [O-]c1cccc(F)c1CNc1cc(N2CCCC2)ncn1 ZINC000895832883 619619211 /nfs/dbraw/zinc/61/92/11/619619211.db2.gz PLRLHQHYGFJILE-UHFFFAOYSA-N -1 3 288.326 2.534 20 10 CFCDHM COCc1ccc(CNCc2c([O-])cccc2F)o1 ZINC000896642019 619782188 /nfs/dbraw/zinc/78/21/88/619782188.db2.gz WARIOONHRZTXQT-UHFFFAOYSA-N -1 3 265.284 2.561 20 10 CFCDHM [O-]c1cccc(Cl)c1CN1CCn2cccc2C1 ZINC000896761160 619808267 /nfs/dbraw/zinc/80/82/67/619808267.db2.gz PXZOBHKZMGDBKM-UHFFFAOYSA-N -1 3 262.740 2.863 20 10 CFCDHM O=C(NCc1c([O-])cccc1F)[C@@H]1CC[C@@H]2C[C@@H]2C1 ZINC000928705376 619995694 /nfs/dbraw/zinc/99/56/94/619995694.db2.gz IBSIWTVSXUVVEY-GMTAPVOTSA-N -1 3 263.312 2.584 20 10 CFCDHM Cc1ccc(C(=O)N2CCCc3cccc(O)c32)c([O-])c1O ZINC000182960497 625403770 /nfs/dbraw/zinc/40/37/70/625403770.db2.gz JXTZWCDADLOOKU-UHFFFAOYSA-N -1 3 299.326 2.705 20 10 CFCDHM CC[C@H](NCc1csc(N)n1)c1ccc(F)cc1[O-] ZINC000902499063 621105195 /nfs/dbraw/zinc/10/51/95/621105195.db2.gz KLEOEHAQQDJANW-NSHDSACASA-N -1 3 281.356 2.811 20 10 CFCDHM NC(=O)c1cccc(NCc2c([O-])cccc2Cl)c1 ZINC000149160278 621992242 /nfs/dbraw/zinc/99/22/42/621992242.db2.gz BSCKWCUKYNBOST-UHFFFAOYSA-N -1 3 276.723 2.757 20 10 CFCDHM [O-]c1c(F)cccc1CN1CCOc2ccccc2C1 ZINC000166374672 623010220 /nfs/dbraw/zinc/01/02/20/623010220.db2.gz POFAEGQBBMYAKN-UHFFFAOYSA-N -1 3 273.307 2.926 20 10 CFCDHM CCC1(CNC(=O)c2cccc(O)c2[O-])CCCC1 ZINC000229413347 623203077 /nfs/dbraw/zinc/20/30/77/623203077.db2.gz IOCILVWQKYPARC-UHFFFAOYSA-N -1 3 263.337 2.798 20 10 CFCDHM CCCN(CC(=O)OC)Cc1cc(Cl)c(C)cc1[O-] ZINC000824474690 623511741 /nfs/dbraw/zinc/51/17/41/623511741.db2.gz RDVCVYSRKWEYDQ-UHFFFAOYSA-N -1 3 285.771 2.739 20 10 CFCDHM CCOC(=O)CN(Cc1cc(Cl)c(C)cc1[O-])C1CC1 ZINC000824586429 623528679 /nfs/dbraw/zinc/52/86/79/623528679.db2.gz AKNGFBQRGBWRGY-UHFFFAOYSA-N -1 3 297.782 2.882 20 10 CFCDHM Cc1cc([O-])c(CN2CCOC[C@H]2C)cc1Cl ZINC000824594062 623529664 /nfs/dbraw/zinc/52/96/64/623529664.db2.gz XHWRDHAWHZSPEA-SNVBAGLBSA-N -1 3 255.745 2.575 20 10 CFCDHM CN(Cc1cc[nH]n1)Cc1ccc(Br)cc1[O-] ZINC000824777765 623563244 /nfs/dbraw/zinc/56/32/44/623563244.db2.gz OWYIGTUYUVQPFR-UHFFFAOYSA-N -1 3 296.168 2.510 20 10 CFCDHM Cc1cc(CNCc2cc(Cl)c(C)cc2[O-])no1 ZINC000825143344 623638943 /nfs/dbraw/zinc/63/89/43/623638943.db2.gz GMAQXLKJSWSVRZ-UHFFFAOYSA-N -1 3 266.728 2.940 20 10 CFCDHM Cc1cc([O-])c(CN2C[C@H](O)CC(F)(F)C2)cc1Cl ZINC000825658257 623731782 /nfs/dbraw/zinc/73/17/82/623731782.db2.gz NPIQGFBBAVYJDB-SNVBAGLBSA-N -1 3 291.725 2.556 20 10 CFCDHM Cc1cc([O-])c(CN2CCn3cnnc3[C@@H]2C)cc1Cl ZINC000825685609 623740151 /nfs/dbraw/zinc/74/01/51/623740151.db2.gz GMWUEZYDWJFBBR-JTQLQIEISA-N -1 3 292.770 2.522 20 10 CFCDHM [O-]c1cc(Br)ccc1CNC(CF)CF ZINC000826029855 623785068 /nfs/dbraw/zinc/78/50/68/623785068.db2.gz KWJDKLGIWRMLJR-UHFFFAOYSA-N -1 3 280.112 2.552 20 10 CFCDHM COCCC1CN(Cc2cc(Cl)cc(F)c2[O-])C1 ZINC000826899779 623905216 /nfs/dbraw/zinc/90/52/16/623905216.db2.gz VFZXXEKNJLTJEY-UHFFFAOYSA-N -1 3 273.735 2.653 20 10 CFCDHM C[C@@H]1CCC[C@H](C2CN(C(=O)c3cccc(O)c3[O-])C2)C1 ZINC000829119596 624377600 /nfs/dbraw/zinc/37/76/00/624377600.db2.gz OQECZDPMAHKWHH-NEPJUHHUSA-N -1 3 289.375 2.996 20 10 CFCDHM C[C@H](NC(=O)NCc1c([O-])cccc1F)C1CCCC1 ZINC000918681722 624462382 /nfs/dbraw/zinc/46/23/82/624462382.db2.gz LSKHYKKDYHDLFF-JTQLQIEISA-N -1 3 280.343 2.909 20 10 CFCDHM CCC(CC)CNC(=O)NCc1c([O-])cccc1F ZINC000919598217 624590658 /nfs/dbraw/zinc/59/06/58/624590658.db2.gz UEIIOXCJJKUFIQ-UHFFFAOYSA-N -1 3 268.332 2.767 20 10 CFCDHM O=C(C[C@H]1CCCC1(F)F)NCc1c([O-])cccc1F ZINC000830179570 624658662 /nfs/dbraw/zinc/65/86/62/624658662.db2.gz ASZQBEPAKSHTIP-SECBINFHSA-N -1 3 287.281 2.973 20 10 CFCDHM CC(C)[C@@H]1C[C@@H](C(=O)NCc2c([O-])cccc2F)CCO1 ZINC000830179920 624658688 /nfs/dbraw/zinc/65/86/88/624658688.db2.gz DROQFKJVZIRITG-NHYWBVRUSA-N -1 3 295.354 2.599 20 10 CFCDHM CC(C)[C@H]1C[C@@H](C(=O)NCc2c([O-])cccc2F)CCO1 ZINC000830179921 624659542 /nfs/dbraw/zinc/65/95/42/624659542.db2.gz DROQFKJVZIRITG-XHDPSFHLSA-N -1 3 295.354 2.599 20 10 CFCDHM CCn1ccnc1CN[C@H](C)c1cc(F)cc(F)c1[O-] ZINC000834880255 625907829 /nfs/dbraw/zinc/90/78/29/625907829.db2.gz QIQUHBGVYRLSNG-SECBINFHSA-N -1 3 281.306 2.738 20 10 CFCDHM COc1cccnc1CN[C@H](C)c1cc(F)cc(F)c1[O-] ZINC000834906951 625919263 /nfs/dbraw/zinc/91/92/63/625919263.db2.gz UXPQZQJMQQMLDD-SECBINFHSA-N -1 3 294.301 2.925 20 10 CFCDHM [O-]c1cccc(Cl)c1CNCc1nccs1 ZINC000083552057 625977519 /nfs/dbraw/zinc/97/75/19/625977519.db2.gz KGROHWJSXOMZCS-UHFFFAOYSA-N -1 3 254.742 2.792 20 10 CFCDHM CC(C)C[C@@H](C)NC(=O)NCc1c([O-])cccc1F ZINC000921599235 625992325 /nfs/dbraw/zinc/99/23/25/625992325.db2.gz CEGRYVALQPBVHK-SNVBAGLBSA-N -1 3 268.332 2.765 20 10 CFCDHM C[C@H]1CC[C@@H](NC(=O)NCc2c([O-])cccc2F)C1 ZINC000922111997 626210198 /nfs/dbraw/zinc/21/01/98/626210198.db2.gz BTHRYKCNKGGYMX-VHSXEESVSA-N -1 3 266.316 2.519 20 10 CFCDHM CCc1onc(C)c1CNCc1cc(F)cc(F)c1[O-] ZINC000922981806 626439220 /nfs/dbraw/zinc/43/92/20/626439220.db2.gz LBYAKZJOJHBFKP-UHFFFAOYSA-N -1 3 282.290 2.819 20 10 CFCDHM O=C(NCc1c([O-])cccc1F)NCC1CCC(F)CC1 ZINC000923044503 626446543 /nfs/dbraw/zinc/44/65/43/626446543.db2.gz MQWQKDXWPSNSKN-UHFFFAOYSA-N -1 3 298.333 2.859 20 10 CFCDHM CCC[C@@H](CNC(=O)NCc1c([O-])cccc1F)OCC ZINC000923395835 626470585 /nfs/dbraw/zinc/47/05/85/626470585.db2.gz PQXRTNQEYMODGR-NSHDSACASA-N -1 3 298.358 2.536 20 10 CFCDHM CC(C)CC1(CNC(=O)c2cccc(O)c2[O-])CC1 ZINC000187182260 626478207 /nfs/dbraw/zinc/47/82/07/626478207.db2.gz XGSJSGGWPPGJHX-UHFFFAOYSA-N -1 3 263.337 2.654 20 10 CFCDHM CCOC1(C)CN(Cc2cc(Cl)ccc2[O-])C1 ZINC000839142300 626528672 /nfs/dbraw/zinc/52/86/72/626528672.db2.gz HFCAZZAHBLXJCJ-UHFFFAOYSA-N -1 3 255.745 2.656 20 10 CFCDHM [O-]c1ccc(Cl)c(F)c1CN1CCC[C@@H]2COC[C@@H]21 ZINC000839187672 626530180 /nfs/dbraw/zinc/53/01/80/626530180.db2.gz LSWPMOVCDBZPEV-SKDRFNHKSA-N -1 3 285.746 2.796 20 10 CFCDHM COc1c([O-])c(CNc2cccc(C)n2)ccc1[N+](=O)[O-] ZINC000774979381 627982920 /nfs/dbraw/zinc/98/29/20/627982920.db2.gz YKHUSXFUEUFNJB-UHFFFAOYSA-N -1 3 289.291 2.625 20 10 CFCDHM CCN(Cc1cnn(C)c1)Cc1cc(Cl)cc(F)c1[O-] ZINC000775662679 628051532 /nfs/dbraw/zinc/05/15/32/628051532.db2.gz ZBZYXEBTAIOZFM-UHFFFAOYSA-N -1 3 297.761 2.940 20 10 CFCDHM CCc1nc(C)c(NC(=O)c2ccc(C)c(O)c2[O-])s1 ZINC000779309804 628372136 /nfs/dbraw/zinc/37/21/36/628372136.db2.gz NGDPVCFWFJWQBM-UHFFFAOYSA-N -1 3 292.360 2.986 20 10 CFCDHM Cc1ccc(C(=O)Nc2c(C)cccc2O)c([O-])c1O ZINC000781012903 628512749 /nfs/dbraw/zinc/51/27/49/628512749.db2.gz AZIIAVVLKAJZCM-UHFFFAOYSA-N -1 3 273.288 2.673 20 10 CFCDHM O=C(Nc1ccc([O-])cc1F)C1=CC(=O)CS1 ZINC000782853624 628660640 /nfs/dbraw/zinc/66/06/40/628660640.db2.gz GSCSOQOMIFPNMT-UHFFFAOYSA-N -1 3 253.254 2.551 20 10 CFCDHM C[C@@H]1C[C@H](O)CN1Cc1cc(Cl)cc(Cl)c1[O-] ZINC000788269057 629052992 /nfs/dbraw/zinc/05/29/92/629052992.db2.gz KYEHQXDYOCOJTD-XCBNKYQSSA-N -1 3 276.163 2.654 20 10 CFCDHM [O-]c1cccc(Cl)c1CN1C[C@@H](O)Cc2ccccc21 ZINC000789761446 629185927 /nfs/dbraw/zinc/18/59/27/629185927.db2.gz FUQUTRXPOFFBCA-LBPRGKRZSA-N -1 3 289.762 2.969 20 10 CFCDHM O=C(N[C@@H]1CC[C@H]2CCC[C@H]2C1)c1cccc(O)c1[O-] ZINC000790792527 629262857 /nfs/dbraw/zinc/26/28/57/629262857.db2.gz FTFDESLLCXEEHY-GRYCIOLGSA-N -1 3 275.348 2.796 20 10 CFCDHM O=C(N[C@@H]1CC[C@@H]2CCC[C@@H]2C1)c1cccc(O)c1[O-] ZINC000790792531 629262991 /nfs/dbraw/zinc/26/29/91/629262991.db2.gz FTFDESLLCXEEHY-QJPTWQEYSA-N -1 3 275.348 2.796 20 10 CFCDHM O=C(c1cccc(O)c1[O-])N1CC[C@H]1Cc1ccccc1 ZINC000790842737 629269108 /nfs/dbraw/zinc/26/91/08/629269108.db2.gz JFUDJFOVQMKCKU-ZDUSSCGKSA-N -1 3 283.327 2.555 20 10 CFCDHM Cc1ccc(C(=O)Nc2cc3c[nH]nc3cc2C)c([O-])c1O ZINC000791056544 629284250 /nfs/dbraw/zinc/28/42/50/629284250.db2.gz FZUDAJYNTOYUGU-UHFFFAOYSA-N -1 3 297.314 2.843 20 10 CFCDHM [O-]c1cccnc1C[NH2+]Cc1c([O-])ccc(Cl)c1F ZINC000793256241 629515695 /nfs/dbraw/zinc/51/56/95/629515695.db2.gz LLLRRBUMSHREMO-UHFFFAOYSA-N -1 3 282.702 2.575 20 10 CFCDHM C[C@@H](NCc1cccnc1F)c1cc([N+](=O)[O-])ccc1[O-] ZINC000794835602 629692544 /nfs/dbraw/zinc/69/25/44/629692544.db2.gz MGWRPVJRNJLXLT-SECBINFHSA-N -1 3 291.282 2.685 20 10 CFCDHM O=C(NC12CCC(CC1)CC2)c1cccc(O)c1[O-] ZINC000836880513 630906692 /nfs/dbraw/zinc/90/66/92/630906692.db2.gz DAZVMPQFASGWEC-UHFFFAOYSA-N -1 3 261.321 2.550 20 10 CFCDHM Cc1cc(CNCc2c([O-])cc(C)cc2Cl)no1 ZINC000840883529 631251067 /nfs/dbraw/zinc/25/10/67/631251067.db2.gz DZCYMLHGWUAOJD-UHFFFAOYSA-N -1 3 266.728 2.940 20 10 CFCDHM CC[C@H]1CN(Cc2c([O-])cc(C)cc2Cl)CCO1 ZINC000840910962 631256428 /nfs/dbraw/zinc/25/64/28/631256428.db2.gz YNPXAFGFIRPYEE-NSHDSACASA-N -1 3 269.772 2.965 20 10 CFCDHM COCCCOC1CN(Cc2c([O-])cc(C)cc2Cl)C1 ZINC000840952468 631278888 /nfs/dbraw/zinc/27/88/88/631278888.db2.gz AKXSXEDXXWFILF-UHFFFAOYSA-N -1 3 299.798 2.591 20 10 CFCDHM Cc1cc(Cl)cc(C[N@@H+](CC(=O)[O-])C(C)C)c1[O-] ZINC000840998153 631298119 /nfs/dbraw/zinc/29/81/19/631298119.db2.gz NYYQRNRGQOAISL-UHFFFAOYSA-N -1 3 271.744 2.649 20 10 CFCDHM Cc1cc(Cl)cc(C[N@H+](CC(=O)[O-])C(C)C)c1[O-] ZINC000840998153 631298126 /nfs/dbraw/zinc/29/81/26/631298126.db2.gz NYYQRNRGQOAISL-UHFFFAOYSA-N -1 3 271.744 2.649 20 10 CFCDHM NC(=O)c1ccc(NCc2c([O-])cccc2Cl)cc1F ZINC000812346280 631694198 /nfs/dbraw/zinc/69/41/98/631694198.db2.gz MBGMYBJKBDUCLC-UHFFFAOYSA-N -1 3 294.713 2.896 20 10 CFCDHM CC[C@H](NCc1cc(F)ccc1[O-])C(=O)OC(C)(C)C ZINC000843431769 631957225 /nfs/dbraw/zinc/95/72/25/631957225.db2.gz ZEULYATZUYXNSH-LBPRGKRZSA-N -1 3 283.343 2.741 20 10 CFCDHM COc1ccncc1CNCc1c([O-])ccc(Cl)c1F ZINC000814298436 632050084 /nfs/dbraw/zinc/05/00/84/632050084.db2.gz SSWCTVLAZWPBHM-UHFFFAOYSA-N -1 3 296.729 2.878 20 10 CFCDHM CCOC(=O)CN(C)Cc1ccc2ccccc2c1[O-] ZINC000816484736 632468870 /nfs/dbraw/zinc/46/88/70/632468870.db2.gz MVMZVPGNPINTIC-UHFFFAOYSA-N -1 3 273.332 2.540 20 10 CFCDHM C[C@H]1CN(Cc2cc(Cl)c(F)cc2[O-])CCCO1 ZINC000816502963 632472791 /nfs/dbraw/zinc/47/27/91/632472791.db2.gz XGRWBLKWAFJSJX-VIFPVBQESA-N -1 3 273.735 2.796 20 10 CFCDHM C[C@@H]1COCCCN1Cc1cc(Cl)c(F)cc1[O-] ZINC000816514264 632475912 /nfs/dbraw/zinc/47/59/12/632475912.db2.gz RKTRNFICLHRGHX-SECBINFHSA-N -1 3 273.735 2.796 20 10 CFCDHM Cc1nnc(CNCc2cc(Cl)c(F)cc2[O-])s1 ZINC000816566052 632486634 /nfs/dbraw/zinc/48/66/34/632486634.db2.gz KEQFBAHGUGKHJT-UHFFFAOYSA-N -1 3 287.747 2.634 20 10 CFCDHM C[C@@H](NCC(F)(F)CN)c1cc(Cl)c(Cl)cc1[O-] ZINC000817967441 632766078 /nfs/dbraw/zinc/76/60/78/632766078.db2.gz IRQQSITWFWPFTO-ZCFIWIBFSA-N -1 3 299.148 2.944 20 10 CFCDHM C[C@H](N[C@@H]1C[C@@H](C)n2ncnc21)c1cc(F)cc(F)c1[O-] ZINC000850499098 634018779 /nfs/dbraw/zinc/01/87/79/634018779.db2.gz JJASTVQGMJDWRW-RGNHYFCHSA-N -1 3 294.305 2.619 20 10 CFCDHM CC[C@@H](NCc1ncccn1)c1ccc(F)cc1[O-] ZINC000850552829 634051090 /nfs/dbraw/zinc/05/10/90/634051090.db2.gz QFSRIKQJGAHBIS-GFCCVEGCSA-N -1 3 261.300 2.562 20 10 CFCDHM Cc1cc([O-])c(CN2CC3(C2)CCCO3)cc1Cl ZINC000862484347 637399115 /nfs/dbraw/zinc/39/91/15/637399115.db2.gz LDEZOIMWGMNQAC-UHFFFAOYSA-N -1 3 267.756 2.719 20 10 CFCDHM Cc1cc(Cl)cc(C[N@@H+]2CC[C@@H](C(=O)[O-])[C@H](C)C2)c1[O-] ZINC000863739011 637766439 /nfs/dbraw/zinc/76/64/39/637766439.db2.gz GSMUEMFZXFSKQA-ZWNOBZJWSA-N -1 3 297.782 2.897 20 10 CFCDHM Cc1cc(Cl)cc(C[N@H+]2CC[C@@H](C(=O)[O-])[C@H](C)C2)c1[O-] ZINC000863739011 637766441 /nfs/dbraw/zinc/76/64/41/637766441.db2.gz GSMUEMFZXFSKQA-ZWNOBZJWSA-N -1 3 297.782 2.897 20 10 CFCDHM O=C(Nc1ccc2ncsc2c1)c1cccc(O)c1[O-] ZINC000192985735 650614018 /nfs/dbraw/zinc/61/40/18/650614018.db2.gz QHVOZNFQKAMJTO-UHFFFAOYSA-N -1 3 286.312 2.960 20 10 CFCDHM O=C(Nc1cccc(OCCF)c1)c1cccc(O)c1[O-] ZINC000193133817 650625604 /nfs/dbraw/zinc/62/56/04/650625604.db2.gz NTFBBWHNKPBQRX-UHFFFAOYSA-N -1 3 291.278 2.698 20 10 CFCDHM CC[C@H]1CN(Cc2ccc(F)c(F)c2[O-])CCS1 ZINC000876747393 642991958 /nfs/dbraw/zinc/99/19/58/642991958.db2.gz BYNZAGJWVVBCSY-JTQLQIEISA-N -1 3 273.348 2.998 20 10 CFCDHM Cc1ccc(NC(=O)c2cccc(O)c2[O-])c(C)c1 ZINC000126187862 643028122 /nfs/dbraw/zinc/02/81/22/643028122.db2.gz VWANSNICRSLJFY-UHFFFAOYSA-N -1 3 257.289 2.967 20 10 CFCDHM Cc1cc(F)ccc1NC(=O)c1cccc(O)c1[O-] ZINC000126229940 643057098 /nfs/dbraw/zinc/05/70/98/643057098.db2.gz DWPLJFZKBDVRPA-UHFFFAOYSA-N -1 3 261.252 2.798 20 10 CFCDHM CC[C@@H]1CCCC[C@@H]1NC(=O)c1cccc(O)c1[O-] ZINC000126298687 643108952 /nfs/dbraw/zinc/10/89/52/643108952.db2.gz NKYPBOQCKCXCTO-PWSUYJOCSA-N -1 3 263.337 2.796 20 10 CFCDHM CC[C@@H]1CCCC[C@H]1NC(=O)c1cccc(O)c1[O-] ZINC000126299148 643110412 /nfs/dbraw/zinc/11/04/12/643110412.db2.gz NKYPBOQCKCXCTO-ZYHUDNBSSA-N -1 3 263.337 2.796 20 10 CFCDHM CC[C@@H](C)C[C@@H](C)NC(=O)c1cccc(O)c1[O-] ZINC000126457008 643231775 /nfs/dbraw/zinc/23/17/75/643231775.db2.gz LRWSELMQAHPTBV-NXEZZACHSA-N -1 3 251.326 2.652 20 10 CFCDHM Cc1cc(F)ccc1CCNC(=O)c1cccc(O)c1[O-] ZINC000126486040 643251327 /nfs/dbraw/zinc/25/13/27/643251327.db2.gz YOPQLQLGJHYHOM-UHFFFAOYSA-N -1 3 289.306 2.518 20 10 CFCDHM CC1(C)C[C@H](O)CN(Cc2c([O-])ccc(Cl)c2F)C1 ZINC000877751321 643527357 /nfs/dbraw/zinc/52/73/57/643527357.db2.gz BJVBLJZNMXCIDF-VIFPVBQESA-N -1 3 287.762 2.778 20 10 CFCDHM C[C@H](NCc1cc(Cl)cc(F)c1[O-])c1ccnn1C ZINC000877762165 643541486 /nfs/dbraw/zinc/54/14/86/643541486.db2.gz AQZYVIOICOQCQJ-QMMMGPOBSA-N -1 3 283.734 2.769 20 10 CFCDHM CC[C@@H]1CN(Cc2cc(Cl)ccc2[O-])CCO1 ZINC000132002577 645863112 /nfs/dbraw/zinc/86/31/12/645863112.db2.gz UTWSQZTXNRFUNV-GFCCVEGCSA-N -1 3 255.745 2.656 20 10 CFCDHM CC[C@H]1CN(Cc2cc(Cl)ccc2[O-])CCO1 ZINC000132002781 645863371 /nfs/dbraw/zinc/86/33/71/645863371.db2.gz UTWSQZTXNRFUNV-LBPRGKRZSA-N -1 3 255.745 2.656 20 10 CFCDHM C[C@H]1C[C@H](NC(=O)NCc2c([O-])cccc2F)CCS1 ZINC000927228550 648741697 /nfs/dbraw/zinc/74/16/97/648741697.db2.gz PUWSVSDTUPILMP-VHSXEESVSA-N -1 3 298.383 2.615 20 10 CFCDHM C[C@H]1CC/C(=C\C(=O)NCc2c([O-])cccc2F)C1 ZINC000928705499 648944619 /nfs/dbraw/zinc/94/46/19/648944619.db2.gz KPVDPLXTZWQIKK-NGPGYTDTSA-N -1 3 263.312 2.894 20 10 CFCDHM CCC1(C(=O)NCc2c([O-])cccc2F)CCC1 ZINC000928705285 648944741 /nfs/dbraw/zinc/94/47/41/648944741.db2.gz ISQGTOMWVGSLLY-UHFFFAOYSA-N -1 3 251.301 2.728 20 10 CFCDHM O=C(NCc1c([O-])cccc1F)C1(F)CCCCC1 ZINC000928706013 648945007 /nfs/dbraw/zinc/94/50/07/648945007.db2.gz NPJFMEACSZEIFK-UHFFFAOYSA-N -1 3 269.291 2.820 20 10 CFCDHM CCC(CC)CC(=O)NCc1c([O-])cccc1F ZINC000928706273 648945018 /nfs/dbraw/zinc/94/50/18/648945018.db2.gz UFAZRONPHMLUEK-UHFFFAOYSA-N -1 3 253.317 2.974 20 10 CFCDHM C[C@H](Cc1ccco1)C(=O)NCc1c([O-])cccc1F ZINC000928708278 648945524 /nfs/dbraw/zinc/94/55/24/648945524.db2.gz BSZJJALUQBXLCE-SNVBAGLBSA-N -1 3 277.295 2.619 20 10 CFCDHM CCC1=C(C(=O)NCc2c([O-])cccc2F)CCCO1 ZINC000928709234 648946095 /nfs/dbraw/zinc/94/60/95/648946095.db2.gz ZMKPEGTWFRIGKJ-UHFFFAOYSA-N -1 3 279.311 2.622 20 10 CFCDHM C[C@@H](CC(=O)NCc1c([O-])cccc1F)c1ccco1 ZINC000928712687 648946775 /nfs/dbraw/zinc/94/67/75/648946775.db2.gz UIDUSVAMFDMIOM-JTQLQIEISA-N -1 3 277.295 2.934 20 10 CFCDHM [O-]c1ccc(F)cc1CN1CCc2nc(Cl)ncc2C1 ZINC001140054910 770105092 /nfs/dbraw/zinc/10/50/92/770105092.db2.gz ADTMVYIMXVJWSE-UHFFFAOYSA-N -1 3 293.729 2.533 20 10 CFCDHM CC(=O)c1cc(F)cc(CN2CCC(F)CC2)c1[O-] ZINC000689883753 775974551 /nfs/dbraw/zinc/97/45/51/775974551.db2.gz HCYGJPNIWPQNCK-UHFFFAOYSA-N -1 3 269.291 2.668 20 10 CFCDHM C[C@@H]1CC[N@H+](Cc2ccc(C(=O)[O-])cc2[O-])CCC1(F)F ZINC001231447018 777222124 /nfs/dbraw/zinc/22/21/24/777222124.db2.gz NJPWYNILQDKCGO-SNVBAGLBSA-N -1 3 299.317 2.958 20 10 CFCDHM C[C@@H]1CC[N@@H+](Cc2ccc(C(=O)[O-])cc2[O-])CCC1(F)F ZINC001231447018 777222129 /nfs/dbraw/zinc/22/21/29/777222129.db2.gz NJPWYNILQDKCGO-SNVBAGLBSA-N -1 3 299.317 2.958 20 10 CFCDHM O=C([O-])c1ccc(C[NH+]2C3CCCC2CCC3)c([O-])c1 ZINC001231455186 777222935 /nfs/dbraw/zinc/22/29/35/777222935.db2.gz XUGJJAWVPNKNPW-UHFFFAOYSA-N -1 3 275.348 2.997 20 10 CFCDHM O=C([O-])c1ccc(C[N@@H+]2CCC[C@H](C(F)F)C2)c([O-])c1 ZINC001231452675 777223264 /nfs/dbraw/zinc/22/32/64/777223264.db2.gz RFCFGCZCFKPMMO-NSHDSACASA-N -1 3 285.290 2.568 20 10 CFCDHM O=C([O-])c1ccc(C[N@H+]2CCC[C@H](C(F)F)C2)c([O-])c1 ZINC001231452675 777223272 /nfs/dbraw/zinc/22/32/72/777223272.db2.gz RFCFGCZCFKPMMO-NSHDSACASA-N -1 3 285.290 2.568 20 10 CFCDHM CC[C@H]1CCC[N@H+](Cc2cc(C(=O)[O-])ccc2[O-])C1 ZINC001231565231 777260804 /nfs/dbraw/zinc/26/08/04/777260804.db2.gz BQKIRPUXAXFBFN-NSHDSACASA-N -1 3 263.337 2.712 20 10 CFCDHM CC[C@H]1CCC[N@@H+](Cc2cc(C(=O)[O-])ccc2[O-])C1 ZINC001231565231 777260810 /nfs/dbraw/zinc/26/08/10/777260810.db2.gz BQKIRPUXAXFBFN-NSHDSACASA-N -1 3 263.337 2.712 20 10 CFCDHM O=C([O-])c1ccc([O-])c(C[N@@H+]2CCCC3(CCC3)C2)c1 ZINC001231567231 777261931 /nfs/dbraw/zinc/26/19/31/777261931.db2.gz XSFNLDKNSJDRGL-UHFFFAOYSA-N -1 3 275.348 2.857 20 10 CFCDHM O=C([O-])c1ccc([O-])c(C[N@H+]2CCCC3(CCC3)C2)c1 ZINC001231567231 777261935 /nfs/dbraw/zinc/26/19/35/777261935.db2.gz XSFNLDKNSJDRGL-UHFFFAOYSA-N -1 3 275.348 2.857 20 10 CFCDHM CC[C@@H]1CCC[N@H+](Cc2cc(C(=O)[O-])ccc2[O-])C1 ZINC001231565228 777261994 /nfs/dbraw/zinc/26/19/94/777261994.db2.gz BQKIRPUXAXFBFN-LLVKDONJSA-N -1 3 263.337 2.712 20 10 CFCDHM CC[C@@H]1CCC[N@@H+](Cc2cc(C(=O)[O-])ccc2[O-])C1 ZINC001231565228 777262001 /nfs/dbraw/zinc/26/20/01/777262001.db2.gz BQKIRPUXAXFBFN-LLVKDONJSA-N -1 3 263.337 2.712 20 10 CFCDHM Cc1cc([O-])c(CN2C[C@@H](F)C[C@H](CO)C2)cc1Cl ZINC001231869433 777358658 /nfs/dbraw/zinc/35/86/58/777358658.db2.gz QOIXJGPBTPJYGW-JQWIXIFHSA-N -1 3 287.762 2.506 20 10 CFCDHM [O-]c1ccc(F)c(F)c1CN1CCC(F)(F)CC1 ZINC001233331733 777889725 /nfs/dbraw/zinc/88/97/25/777889725.db2.gz IXQHEQZQCVGLPU-UHFFFAOYSA-N -1 3 263.234 2.902 20 10 CFCDHM [O-]c1cc(Cl)c(Cl)cc1CN1CCC[C@@H](O)C1 ZINC001236794156 778938550 /nfs/dbraw/zinc/93/85/50/778938550.db2.gz QGBILEZTPCQUBJ-SECBINFHSA-N -1 3 276.163 2.656 20 10 CFCDHM C[C@@]1(CO)CCN(Cc2cc(Cl)c(Cl)cc2[O-])C1 ZINC001236792663 778938962 /nfs/dbraw/zinc/93/89/62/778938962.db2.gz GLFCWZLQNNJEKU-CYBMUJFWSA-N -1 3 290.190 2.903 20 10 CFCDHM COc1cc([O-])c(CN2CCCC(=O)[C@H](C)C2)c(Cl)c1 ZINC001236799088 778942609 /nfs/dbraw/zinc/94/26/09/778942609.db2.gz RCTXLAUQIKLDCM-SNVBAGLBSA-N -1 3 297.782 2.855 20 10 CFCDHM COc1ccc(CN2CCOC[C@@H](C)C2)c([O-])c1Cl ZINC001236803346 778944713 /nfs/dbraw/zinc/94/47/13/778944713.db2.gz SGIQFVYIPBREHH-JTQLQIEISA-N -1 3 285.771 2.523 20 10 CFCDHM COc1ccc(CN2CCOC[C@H](C)C2)c([O-])c1Cl ZINC001236803348 778945604 /nfs/dbraw/zinc/94/56/04/778945604.db2.gz SGIQFVYIPBREHH-SNVBAGLBSA-N -1 3 285.771 2.523 20 10 CFCDHM CO[C@H]1CCN(Cc2c([O-])ccc(Cl)c2Cl)C1 ZINC001237077726 779007758 /nfs/dbraw/zinc/00/77/58/779007758.db2.gz JYWJFCZURLQGDQ-QMMMGPOBSA-N -1 3 276.163 2.920 20 10 CFCDHM CN1C[C@@H]2C[C@H]1CN2Cc1c([O-])ccc(Cl)c1Cl ZINC001237084672 779009411 /nfs/dbraw/zinc/00/94/11/779009411.db2.gz NJKOZIGXURFXCX-IUCAKERBSA-N -1 3 287.190 2.587 20 10 CFCDHM [O-]c1ccc(F)c(Cl)c1CN1CC[C@]2(CCCO2)C1 ZINC001237125069 779020493 /nfs/dbraw/zinc/02/04/93/779020493.db2.gz WPTZOCVKAMPCNJ-CQSZACIVSA-N -1 3 285.746 2.940 20 10 CFCDHM [O-]c1cccc(Cl)c1CN1CCO[C@H](C(F)(F)F)C1 ZINC000698953950 779110630 /nfs/dbraw/zinc/11/06/30/779110630.db2.gz SYVNGCMVTDFMHN-NSHDSACASA-N -1 3 295.688 2.809 20 10 CFCDHM C[C@@H]1CO[C@@H]2CN(Cc3cc(Cl)cc(F)c3[O-])C[C@H]12 ZINC001237622467 779146263 /nfs/dbraw/zinc/14/62/63/779146263.db2.gz SDQSCIGSFOICLZ-XTWCZFFVSA-N -1 3 285.746 2.651 20 10 CFCDHM CO[C@H](C)C1CN(Cc2cc(Cl)cc(F)c2[O-])C1 ZINC001237623571 779147101 /nfs/dbraw/zinc/14/71/01/779147101.db2.gz POZCTQSVVAOGSC-MRVPVSSYSA-N -1 3 273.735 2.651 20 10 CFCDHM C[C@@H]1C[C@H](O)CCN1Cc1cc(Cl)cc(F)c1[O-] ZINC001237622603 779147560 /nfs/dbraw/zinc/14/75/60/779147560.db2.gz VGASCDIKHLAZTF-LDYMZIIASA-N -1 3 273.735 2.530 20 10 CFCDHM C[C@@H]1CN(Cc2cc(F)cc(Cl)c2[O-])C[C@H](C)N1C ZINC001237800351 779182339 /nfs/dbraw/zinc/18/23/39/779182339.db2.gz YBZHWAJGJBFYDB-AOOOYVTPSA-N -1 3 286.778 2.709 20 10 CFCDHM [O-]c1c(Cl)cc(F)cc1CN1CCCC[C@@H]1CO ZINC001237809713 779185661 /nfs/dbraw/zinc/18/56/61/779185661.db2.gz KTBKCXDVCUECPH-LLVKDONJSA-N -1 3 273.735 2.532 20 10 CFCDHM CC(=O)[C@H]1CCN(Cc2cc(F)c(Cl)cc2[O-])C1 ZINC001237941606 779213316 /nfs/dbraw/zinc/21/33/16/779213316.db2.gz ZDZRDTYJBLRYLH-VIFPVBQESA-N -1 3 271.719 2.596 20 10 CFCDHM [O-]c1cc(Cl)c(F)cc1CN1CCCC[C@H]1CO ZINC001237946401 779215158 /nfs/dbraw/zinc/21/51/58/779215158.db2.gz LDKLRXDVCJCZHT-JTQLQIEISA-N -1 3 273.735 2.532 20 10 CFCDHM COc1ccc(CN2CCC(F)CC2)c([O-])c1Cl ZINC001236801256 779640598 /nfs/dbraw/zinc/64/05/98/779640598.db2.gz IOMHQNMBYAHDKC-UHFFFAOYSA-N -1 3 273.735 2.988 20 10 CFCDHM CO[C@H](C)C1CN(Cc2cc(F)c(Cl)cc2[O-])C1 ZINC001237941602 779724975 /nfs/dbraw/zinc/72/49/75/779724975.db2.gz ZBIJDKTXLMMKSV-MRVPVSSYSA-N -1 3 273.735 2.651 20 10 CFCDHM [O-]c1c(F)cc(F)cc1Nc1c(F)cncc1F ZINC001212477384 780391485 /nfs/dbraw/zinc/39/14/85/780391485.db2.gz BZPVVSAYJJJGHB-UHFFFAOYSA-N -1 3 258.174 2.509 20 10 CFCDHM Cc1ncc(CNCc2c([O-])cccc2Br)o1 ZINC000706804266 781203852 /nfs/dbraw/zinc/20/38/52/781203852.db2.gz HIKILRVRRAOCGF-UHFFFAOYSA-N -1 3 297.152 2.741 20 10 CFCDHM CC(C)[C@@H]1CN(Cc2c([O-])cccc2Cl)CCO1 ZINC000709018445 781286490 /nfs/dbraw/zinc/28/64/90/781286490.db2.gz ASBHWJHTKZITSN-AWEZNQCLSA-N -1 3 269.772 2.902 20 10 CFCDHM C[C@@H](NCc1cc(F)cc(F)c1[O-])c1cscn1 ZINC000708498045 781290700 /nfs/dbraw/zinc/29/07/00/781290700.db2.gz WSAYLFRMNIZTLT-SSDOTTSWSA-N -1 3 270.304 2.978 20 10 CFCDHM C[C@H]1C[C@H]2CCCC[C@@H]2N1C(=O)c1cccc(O)c1[O-] ZINC000187100283 291160276 /nfs/dbraw/zinc/16/02/76/291160276.db2.gz BFSVGSOHRQQEHW-LOWVWBTDSA-N -1 3 275.348 2.891 20 10 CFCDHM CN(Cc1ccc([S@](C)=O)cc1)Cc1ccccc1[O-] ZINC000091974646 375074086 /nfs/dbraw/zinc/07/40/86/375074086.db2.gz LIJWULHBDIEXET-HXUWFJFHSA-N -1 3 289.400 2.762 20 10 CFCDHM Cn1cnnc1[C@@H]1CCCN1Cc1cc(Cl)ccc1[O-] ZINC000093809920 375313244 /nfs/dbraw/zinc/31/32/44/375313244.db2.gz MJLAUOSNQXWMEQ-LBPRGKRZSA-N -1 3 292.770 2.511 20 10 CFCDHM C[C@@H]1[C@@H](C(=O)NCc2cc(Cl)ccc2[O-])[C@@H]1C1CC1 ZINC000529510422 383714268 /nfs/dbraw/zinc/71/42/68/383714268.db2.gz BGYQWXQQNJFCTG-ULCPSODYSA-N -1 3 279.767 2.954 20 10 CFCDHM O=C(c1cccc(O)c1[O-])N1CCS[C@@H]2CCCC[C@H]21 ZINC000193130455 296253952 /nfs/dbraw/zinc/25/39/52/296253952.db2.gz FYVBZUPMVKFQGP-DGCLKSJQSA-N -1 3 293.388 2.598 20 10 CFCDHM C[C@@H]1CN(Cc2cc(Cl)ccc2[O-])CCCO1 ZINC000134144860 377987081 /nfs/dbraw/zinc/98/70/81/377987081.db2.gz YTZGNONFNXGMCO-SNVBAGLBSA-N -1 3 255.745 2.656 20 10 CFCDHM Cc1ccc(C(=O)N(C)[C@H](C)c2ccccn2)c([O-])c1O ZINC000177676962 380365346 /nfs/dbraw/zinc/36/53/46/380365346.db2.gz RWVOOYBFSJEOAS-LLVKDONJSA-N -1 3 286.331 2.634 20 10 CFCDHM CCOC[C@H]1CN(Cc2c([O-])cc(C)cc2Cl)CCO1 ZINC000529667410 383745275 /nfs/dbraw/zinc/74/52/75/383745275.db2.gz VFWYSIDUIBFLGQ-GFCCVEGCSA-N -1 3 299.798 2.591 20 10 CFCDHM Cc1ccc([C@H]2COCCN2Cc2ccccc2[O-])o1 ZINC000179576416 380561517 /nfs/dbraw/zinc/56/15/17/380561517.db2.gz UUUPXJPGDADOPC-CQSZACIVSA-N -1 3 273.332 2.867 20 10 CFCDHM C[C@H](CF)NCc1cc(Br)ccc1[O-] ZINC000288465064 381013099 /nfs/dbraw/zinc/01/30/99/381013099.db2.gz OJYKWZQNMZGYPJ-SSDOTTSWSA-N -1 3 262.122 2.602 20 10 CFCDHM [O-]c1ccccc1CN1CCCC[C@H]1c1cc[nH]n1 ZINC000289081095 381023209 /nfs/dbraw/zinc/02/32/09/381023209.db2.gz AWXLQQWBQIQBFC-AWEZNQCLSA-N -1 3 257.337 2.843 20 10 CFCDHM Cc1ccc(C(=O)N2CCC[C@H]2C2CCC2)c([O-])c1O ZINC000182324651 381064356 /nfs/dbraw/zinc/06/43/56/381064356.db2.gz CBYOVBGTYMSPSM-ZDUSSCGKSA-N -1 3 275.348 2.811 20 10 CFCDHM C[C@H](N[C@@H]1c2ccccc2C[C@@H]1O)c1ccc(F)cc1[O-] ZINC000185122230 381541807 /nfs/dbraw/zinc/54/18/07/381541807.db2.gz MLUSSKOYHZEIFV-PZDALLCQSA-N -1 3 287.334 2.840 20 10 CFCDHM O=C(c1cccc(O)c1[O-])N1CCC2(C1)CCCCC2 ZINC000187135610 382109401 /nfs/dbraw/zinc/10/94/01/382109401.db2.gz WVVXGEKCGFNCFU-UHFFFAOYSA-N -1 3 275.348 2.894 20 10 CFCDHM CS[C@@H]1CCC[C@@H](NC(=O)c2cccc(O)c2[O-])C1 ZINC000187106149 382100540 /nfs/dbraw/zinc/10/05/40/382100540.db2.gz XOLRGMVGRUVXNQ-NXEZZACHSA-N -1 3 281.377 2.502 20 10 CFCDHM [O-]c1ccc(Cl)cc1CNCc1cnc2n1CCCC2 ZINC000376714861 382166790 /nfs/dbraw/zinc/16/67/90/382166790.db2.gz HJAZOWDBHXKYHX-UHFFFAOYSA-N -1 3 291.782 2.868 20 10 CFCDHM Cc1nn(C)c(C)c1CNCc1cc(Cl)c(F)cc1[O-] ZINC000293799911 382284791 /nfs/dbraw/zinc/28/47/91/382284791.db2.gz BXXJYHQTSJHMBB-UHFFFAOYSA-N -1 3 297.761 2.825 20 10 CFCDHM C[C@@H](C1CC1)N(C(=O)c1cccc(O)c1[O-])C1CC1 ZINC000188300303 382387550 /nfs/dbraw/zinc/38/75/50/382387550.db2.gz BFAQOAUUHFZLIY-VIFPVBQESA-N -1 3 261.321 2.501 20 10 CFCDHM [O-]c1ccc(Cl)cc1CN[C@H]1CCCc2c[nH]nc21 ZINC000378164144 382410460 /nfs/dbraw/zinc/41/04/60/382410460.db2.gz KXPKIVSKGPVLMS-LBPRGKRZSA-N -1 3 277.755 2.936 20 10 CFCDHM CCCO[C@@H]1CCCN(C(=O)c2cccc(O)c2[O-])CC1 ZINC000188447530 382415052 /nfs/dbraw/zinc/41/50/52/382415052.db2.gz IEEBVUCFUQDOII-GFCCVEGCSA-N -1 3 293.363 2.519 20 10 CFCDHM CS[C@@H]1CCN(Cc2cc(F)cc(C(C)=O)c2[O-])C1 ZINC000294434340 382512808 /nfs/dbraw/zinc/51/28/08/382512808.db2.gz PVVKMKULQBARMM-GFCCVEGCSA-N -1 3 283.368 2.671 20 10 CFCDHM COc1ccncc1CN[C@H](C)c1ccc(F)cc1[O-] ZINC000294488429 382513540 /nfs/dbraw/zinc/51/35/40/382513540.db2.gz XSNQJVCLNVMKQW-SNVBAGLBSA-N -1 3 276.311 2.786 20 10 CFCDHM [O-]c1c(Cl)cc(Cl)cc1CN1CCC[C@@H](CO)C1 ZINC000269332926 384749203 /nfs/dbraw/zinc/74/92/03/384749203.db2.gz CQQCYTSTZLYQFU-SECBINFHSA-N -1 3 290.190 2.903 20 10 CFCDHM [O-]c1c(Cl)cc(Cl)cc1CN1CCC[C@H](CO)C1 ZINC000269332928 384749251 /nfs/dbraw/zinc/74/92/51/384749251.db2.gz CQQCYTSTZLYQFU-VIFPVBQESA-N -1 3 290.190 2.903 20 10 CFCDHM O=C(NC[C@H]1CCCC(F)(F)C1)c1cccc(O)c1[O-] ZINC000282295984 385275514 /nfs/dbraw/zinc/27/55/14/385275514.db2.gz RZQRVERIGRSXRP-VIFPVBQESA-N -1 3 285.290 2.653 20 10 CFCDHM CCCCN(Cc1noc(C)n1)Cc1ccccc1[O-] ZINC000282519653 385333119 /nfs/dbraw/zinc/33/31/19/385333119.db2.gz SZSWNCPDIVXXHN-UHFFFAOYSA-N -1 3 275.352 2.886 20 10 CFCDHM CC(=O)c1cc(F)cc(CN2CCC=C(F)C2)c1[O-] ZINC000272493182 385551206 /nfs/dbraw/zinc/55/12/06/385551206.db2.gz NDKBGCJPSYVVQV-UHFFFAOYSA-N -1 3 267.275 2.793 20 10 CFCDHM C[C@@H](O)[C@@H]1CCN(Cc2cc(Cl)cc(Cl)c2[O-])C1 ZINC000272492137 385551945 /nfs/dbraw/zinc/55/19/45/385551945.db2.gz DXRVIPGVYURWLV-RKDXNWHRSA-N -1 3 290.190 2.902 20 10 CFCDHM CCC(C)(C)N(C)C(=O)c1ccc(C)c(O)c1[O-] ZINC000272724095 385597210 /nfs/dbraw/zinc/59/72/10/385597210.db2.gz IBRRACBXNJWCLA-UHFFFAOYSA-N -1 3 251.326 2.667 20 10 CFCDHM Cc1ccc(C(=O)N(C)CC(C)(C)C)c([O-])c1O ZINC000272875186 385638831 /nfs/dbraw/zinc/63/88/31/385638831.db2.gz WUYVSQULZLNWRH-UHFFFAOYSA-N -1 3 251.326 2.524 20 10 CFCDHM COC(=O)c1ccc([O-])c([C@H](C)NCc2ccoc2)c1 ZINC000273412738 385681557 /nfs/dbraw/zinc/68/15/57/385681557.db2.gz PZNGZERJEVGNJZ-JTQLQIEISA-N -1 3 275.304 2.623 20 10 CFCDHM COCCN(Cc1ccco1)Cc1ccccc1[O-] ZINC000109761273 393879535 /nfs/dbraw/zinc/87/95/35/393879535.db2.gz RDWFEISVODTPME-UHFFFAOYSA-N -1 3 261.321 2.634 20 10 CFCDHM CC[C@@H](NCC(=O)NCC1CC1)c1cccc(Cl)c1[O-] ZINC000287290170 286902731 /nfs/dbraw/zinc/90/27/31/286902731.db2.gz BWVWBFLHVMLOSZ-CYBMUJFWSA-N -1 3 296.798 2.613 20 10 CFCDHM O=C(NC1CC(c2ccccc2)C1)c1cccc(O)c1[O-] ZINC000370579352 267329684 /nfs/dbraw/zinc/32/96/84/267329684.db2.gz JLOATGCCGITGJM-UHFFFAOYSA-N -1 3 283.327 2.774 20 10 CFCDHM CC(=O)c1cc(F)cc(CN2CCCSCC2)c1[O-] ZINC000050157646 277106015 /nfs/dbraw/zinc/10/60/15/277106015.db2.gz BRXKXRDYMZYVBH-UHFFFAOYSA-N -1 3 283.368 2.673 20 10 CFCDHM CC(=O)c1cc(F)cc(CN2CCSC[C@H](C)C2)c1[O-] ZINC000190429631 278244288 /nfs/dbraw/zinc/24/42/88/278244288.db2.gz BQJLHJYZLCLQSH-SNVBAGLBSA-N -1 3 297.395 2.919 20 10 CFCDHM CC[C@@H](N[C@@H](C)c1ncnn1C)c1cccc(Cl)c1[O-] ZINC000287310124 280192595 /nfs/dbraw/zinc/19/25/95/280192595.db2.gz CWXNONIJBHLRPK-JOYOIKCWSA-N -1 3 294.786 2.976 20 10 CFCDHM Cc1cc(Cl)cc(CN2CCOC[C@@H]2C)c1[O-] ZINC000271696097 301286505 /nfs/dbraw/zinc/28/65/05/301286505.db2.gz AZNWKNKUHVZTMD-JTQLQIEISA-N -1 3 255.745 2.575 20 10 CFCDHM O=C(/C=C\c1cccnc1)N1CCCc2cccc([O-])c21 ZINC000255306730 326962979 /nfs/dbraw/zinc/96/29/79/326962979.db2.gz SFBPTPATHVSVCL-HJWRWDBZSA-N -1 3 280.327 2.780 20 10 CFCDHM CC(C)(C)[C@@H]1CN(Cc2cc(F)ccc2[O-])CCO1 ZINC000279831449 518947294 /nfs/dbraw/zinc/94/72/94/518947294.db2.gz BCILYWHJJZCJHE-AWEZNQCLSA-N -1 3 267.344 2.778 20 10 CFCDHM CC(C)C1(C)CCN(C(=O)c2cccc(O)c2[O-])CC1 ZINC000280450477 519550150 /nfs/dbraw/zinc/55/01/50/519550150.db2.gz LFLBXENXCGLVSW-UHFFFAOYSA-N -1 3 277.364 2.996 20 10 CFCDHM CC[C@@H](C)[C@H](NC(=O)c1cccc(O)c1[O-])C(F)(F)F ZINC000277865907 522382649 /nfs/dbraw/zinc/38/26/49/522382649.db2.gz DHUZPYGAAYSPFB-HQJQHLMTSA-N -1 3 291.269 2.805 20 10 CFCDHM COC[C@@H]1CCN(Cc2cc(Cl)cc(C(C)=O)c2[O-])C1 ZINC000081071739 522474202 /nfs/dbraw/zinc/47/42/02/522474202.db2.gz CDYFKPKXFFKDAA-LLVKDONJSA-N -1 3 297.782 2.717 20 10 CFCDHM CC[C@@H](N[C@H](C)c1ncnn1C)c1cccc(Cl)c1[O-] ZINC000287310118 522940153 /nfs/dbraw/zinc/94/01/53/522940153.db2.gz CWXNONIJBHLRPK-BXKDBHETSA-N -1 3 294.786 2.976 20 10 CFCDHM CC[C@@H](N[C@H](C)c1ncn(C)n1)c1ccc(C)cc1[O-] ZINC000280158765 522941586 /nfs/dbraw/zinc/94/15/86/522941586.db2.gz QOBVCJWNTDGOQZ-DGCLKSJQSA-N -1 3 274.368 2.631 20 10 CFCDHM CN(C(=O)c1cccc(O)c1[O-])[C@@H]1CCCc2cccnc21 ZINC000364897006 523944664 /nfs/dbraw/zinc/94/46/64/523944664.db2.gz RFKLYUVLXZFICM-CYBMUJFWSA-N -1 3 298.342 2.642 20 10 CFCDHM CN(C(=O)c1cccc(O)c1[O-])[C@H]1CCCc2cccnc21 ZINC000364897009 523945208 /nfs/dbraw/zinc/94/52/08/523945208.db2.gz RFKLYUVLXZFICM-ZDUSSCGKSA-N -1 3 298.342 2.642 20 10 CFCDHM C[C@@H](N[C@H](C)c1cc(Cl)ccc1[O-])c1ncnn1C ZINC000276684067 525658271 /nfs/dbraw/zinc/65/82/71/525658271.db2.gz TYTAKOJDBWCPLZ-RKDXNWHRSA-N -1 3 280.759 2.586 20 10 CFCDHM [O-]c1cc(F)c(Cl)cc1CN1CC[C@H](n2cccn2)C1 ZINC000293872532 526332680 /nfs/dbraw/zinc/33/26/80/526332680.db2.gz JECUQVQSXDCMFG-NSHDSACASA-N -1 3 295.745 2.828 20 10 CFCDHM [O-]c1ccc(F)cc1CN[C@@H](C1CC1)C(F)(F)F ZINC000290236859 526351909 /nfs/dbraw/zinc/35/19/09/526351909.db2.gz UFHHHXZORAUXJZ-NSHDSACASA-N -1 3 263.234 2.962 20 10 CFCDHM O=C(c1cccc(O)c1[O-])N1CCC(c2ccncc2)CC1 ZINC000277088407 526771667 /nfs/dbraw/zinc/77/16/67/526771667.db2.gz BERQEFLQPKBGJJ-UHFFFAOYSA-N -1 3 298.342 2.513 20 10 CFCDHM Cn1cc(NCc2cc(F)ccc2[O-])c(C2CC2)n1 ZINC000291179723 527274649 /nfs/dbraw/zinc/27/46/49/527274649.db2.gz FNANKCFZEZIRIA-UHFFFAOYSA-N -1 3 261.300 2.754 20 10 CFCDHM O=C(NCCc1c[nH]c2ccccc12)c1cc([O-])cs1 ZINC000731862080 574130624 /nfs/dbraw/zinc/13/06/24/574130624.db2.gz ZBYWBZHBCPDPIR-UHFFFAOYSA-N -1 3 286.356 2.908 20 10 CFCDHM O=C(Nc1cccc(-n2cccn2)c1)c1cc([O-])cs1 ZINC000731869903 574131137 /nfs/dbraw/zinc/13/11/37/574131137.db2.gz QLJAJTQOEBEZAV-UHFFFAOYSA-N -1 3 285.328 2.892 20 10 CFCDHM CN(CCOc1ccccc1F)C(=O)c1cc([O-])cs1 ZINC000731865167 574131356 /nfs/dbraw/zinc/13/13/56/574131356.db2.gz HDMQBIJLHOAYDU-UHFFFAOYSA-N -1 3 295.335 2.744 20 10 CFCDHM CN(Cc1ccc(F)cc1)C(=O)c1cc([O-])cs1 ZINC000731869376 574132592 /nfs/dbraw/zinc/13/25/92/574132592.db2.gz GEVOVLRUSHJVMI-UHFFFAOYSA-N -1 3 265.309 2.865 20 10 CFCDHM O=C(Nc1ccc(-n2ccnc2)cc1)c1cc([O-])cs1 ZINC000731868406 574132838 /nfs/dbraw/zinc/13/28/38/574132838.db2.gz XXFCICOIROJURX-UHFFFAOYSA-N -1 3 285.328 2.892 20 10 CFCDHM O=C(c1cc([O-])cs1)N1CCC[C@H](C(F)(F)F)C1 ZINC000731898390 574133565 /nfs/dbraw/zinc/13/35/65/574133565.db2.gz KBFGUJZBOPMHLN-ZETCQYMHSA-N -1 3 279.283 2.868 20 10 CFCDHM O=C(NCc1ccc(F)c(F)c1)c1cc([O-])cs1 ZINC000732267101 574147839 /nfs/dbraw/zinc/14/78/39/574147839.db2.gz BZKWLZOOKZARNE-UHFFFAOYSA-N -1 3 269.272 2.662 20 10 CFCDHM CCOC(=O)CCCCCCNC(=O)c1cc([O-])cs1 ZINC000732273223 574148642 /nfs/dbraw/zinc/14/86/42/574148642.db2.gz MZNWMRWOKDIMOE-UHFFFAOYSA-N -1 3 299.392 2.697 20 10 CFCDHM O=C(c1cc([O-])cs1)N1CCC[C@@H]1c1ccccn1 ZINC000732276281 574149504 /nfs/dbraw/zinc/14/95/04/574149504.db2.gz POZVXFOOZXZLME-GFCCVEGCSA-N -1 3 274.345 2.826 20 10 CFCDHM COC(=O)Nc1cccc(NC(=O)c2cc([O-])cs2)c1 ZINC000732275200 574149650 /nfs/dbraw/zinc/14/96/50/574149650.db2.gz ZFWPRXUXVQPXER-UHFFFAOYSA-N -1 3 292.316 2.884 20 10 CFCDHM C[C@H]1C[C@H]1c1cc(NC(=O)c2cc([O-])cs2)n[nH]1 ZINC000732280526 574150102 /nfs/dbraw/zinc/15/01/02/574150102.db2.gz KDVPLZAPJYANOP-POYBYMJQSA-N -1 3 263.322 2.553 20 10 CFCDHM COc1ccccc1CCN(C)C(=O)c1cc([O-])cs1 ZINC000732287220 574150664 /nfs/dbraw/zinc/15/06/64/574150664.db2.gz QTXFREGACIEAMR-UHFFFAOYSA-N -1 3 291.372 2.777 20 10 CFCDHM COc1ccc(O)c([C@H](C)NC(=O)c2cc([O-])cs2)c1 ZINC000732287604 574150726 /nfs/dbraw/zinc/15/07/26/574150726.db2.gz YHIJELPCAMFPEG-QMMMGPOBSA-N -1 3 293.344 2.659 20 10 CFCDHM C[C@H](NC(=O)c1cc([O-])cs1)[C@@H]1COc2ccccc21 ZINC000755308397 574153164 /nfs/dbraw/zinc/15/31/64/574153164.db2.gz YRCJFNJKQXSPJU-CABZTGNLSA-N -1 3 289.356 2.748 20 10 CFCDHM CCCCC[C@@H](C)NC(=O)COC(=O)c1cc([O-])cs1 ZINC000732353952 574153127 /nfs/dbraw/zinc/15/31/27/574153127.db2.gz XCPPGINLARIGPV-SNVBAGLBSA-N -1 3 299.392 2.696 20 10 CFCDHM Cc1ccc2nc(COC(=O)c3cc([O-])cs3)cn2c1 ZINC000732355467 574153350 /nfs/dbraw/zinc/15/33/50/574153350.db2.gz NMHKJQYBTHGPJG-UHFFFAOYSA-N -1 3 288.328 2.767 20 10 CFCDHM CCCCc1nc(COC(=O)c2cc([O-])cs2)no1 ZINC000732354121 574153356 /nfs/dbraw/zinc/15/33/56/574153356.db2.gz DRGRYYXHNUTUMI-UHFFFAOYSA-N -1 3 282.321 2.536 20 10 CFCDHM CC[C@@H](NC(=O)c1cc([O-])cs1)c1nccs1 ZINC000738545868 574172919 /nfs/dbraw/zinc/17/29/19/574172919.db2.gz SHXCMBZGGUYDSQ-MRVPVSSYSA-N -1 3 268.363 2.791 20 10 CFCDHM Cc1noc([C@H](C)NCc2cc(Cl)ccc2[O-])n1 ZINC000729683873 574228629 /nfs/dbraw/zinc/22/86/29/574228629.db2.gz DWHUUFYQWIVVQS-ZETCQYMHSA-N -1 3 267.716 2.588 20 10 CFCDHM Cc1cc([O-])c(C[N@@H+](C)C2CCN(C(=O)[O-])CC2)cc1C ZINC000740087430 574235467 /nfs/dbraw/zinc/23/54/67/574235467.db2.gz BILXRAVUVMSEOW-UHFFFAOYSA-N -1 3 292.379 2.583 20 10 CFCDHM Cc1cc([O-])c(C[N@H+](C)C2CCN(C(=O)[O-])CC2)cc1C ZINC000740087430 574235471 /nfs/dbraw/zinc/23/54/71/574235471.db2.gz BILXRAVUVMSEOW-UHFFFAOYSA-N -1 3 292.379 2.583 20 10 CFCDHM C[C@@H](N[C@@H]1C[C@@H](C)c2c1c([O-])ccc2F)c1nncn1C ZINC000756534386 574244068 /nfs/dbraw/zinc/24/40/68/574244068.db2.gz KRYHJNSUNNBMJT-FXPVBKGRSA-N -1 3 290.342 2.559 20 10 CFCDHM C[C@H](NCc1cc[nH]n1)c1ccc(Br)cc1[O-] ZINC000756553417 574247309 /nfs/dbraw/zinc/24/73/09/574247309.db2.gz KWUXPTLRPGRUBE-QMMMGPOBSA-N -1 3 296.168 2.729 20 10 CFCDHM C[C@H](NCc1cc[nH]n1)c1cc(Cl)ccc1[O-] ZINC000756558046 574247532 /nfs/dbraw/zinc/24/75/32/574247532.db2.gz ZAPQUZVVPMGREN-QMMMGPOBSA-N -1 3 251.717 2.620 20 10 CFCDHM O=C(NCc1ccccc1O)c1cc2c(cc1[O-])CCCC2 ZINC000748345518 574247884 /nfs/dbraw/zinc/24/78/84/574247884.db2.gz CVPWSHDAIDOREX-UHFFFAOYSA-N -1 3 297.354 2.907 20 10 CFCDHM C[C@@H](N[C@H](C)c1cc(F)cc(F)c1[O-])c1cnn(C)c1 ZINC000756603378 574252051 /nfs/dbraw/zinc/25/20/51/574252051.db2.gz BIMAQZHNPHUQGG-RKDXNWHRSA-N -1 3 281.306 2.816 20 10 CFCDHM C[C@@H](NCc1csc(N(C)C)n1)c1cc(F)ccc1[O-] ZINC000756634888 574253939 /nfs/dbraw/zinc/25/39/39/574253939.db2.gz CVXAEFASVMMRDU-SECBINFHSA-N -1 3 295.383 2.905 20 10 CFCDHM C[C@H](NCc1csc(N(C)C)n1)c1cc(F)ccc1[O-] ZINC000756634889 574254021 /nfs/dbraw/zinc/25/40/21/574254021.db2.gz CVXAEFASVMMRDU-VIFPVBQESA-N -1 3 295.383 2.905 20 10 CFCDHM C[C@@H](NCc1ccn(C)n1)c1cc(Cl)ccc1[O-] ZINC000756778264 574262447 /nfs/dbraw/zinc/26/24/47/574262447.db2.gz NNQYKZZUSIXZBW-SECBINFHSA-N -1 3 265.744 2.630 20 10 CFCDHM C[C@@H](Nc1cnn(CCO)c1)c1ccc2ccccc2c1[O-] ZINC000756855027 574268844 /nfs/dbraw/zinc/26/88/44/574268844.db2.gz JXYWGAWGKPFCDB-GFCCVEGCSA-N -1 3 297.358 2.907 20 10 CFCDHM CS[C@H]1CCC[C@H](NC(=O)c2cc([O-])cs2)C1 ZINC000735330312 574320917 /nfs/dbraw/zinc/32/09/17/574320917.db2.gz HVRTUVXSEMEZAV-WPRPVWTQSA-N -1 3 271.407 2.858 20 10 CFCDHM CCn1nc(NC(=O)c2cc([O-])cs2)cc1C1CC1 ZINC000750249460 574331858 /nfs/dbraw/zinc/33/18/58/574331858.db2.gz CNKZTVXWNTWIMO-UHFFFAOYSA-N -1 3 277.349 2.800 20 10 CFCDHM C[C@]1(c2ccccc2)C[C@H]1NC(=O)c1cc([O-])cs1 ZINC000743641976 574370123 /nfs/dbraw/zinc/37/01/23/574370123.db2.gz LICSAFGVSLICFC-UKRRQHHQSA-N -1 3 273.357 2.914 20 10 CFCDHM CCCCCCNC(=O)c1ccc(C)c(O)c1[O-] ZINC000751532455 574378652 /nfs/dbraw/zinc/37/86/52/574378652.db2.gz CGBSLDMITNMOQV-UHFFFAOYSA-N -1 3 251.326 2.716 20 10 CFCDHM CC(C)OC1CCC(NC(=O)c2cc([O-])cs2)CC1 ZINC000752632487 574393383 /nfs/dbraw/zinc/39/33/83/574393383.db2.gz SDQCTDKSILNSDC-UHFFFAOYSA-N -1 3 283.393 2.920 20 10 CFCDHM CC(C)[C@H]1OCCC[C@H]1CNC(=O)c1cc([O-])cs1 ZINC000752816363 574395479 /nfs/dbraw/zinc/39/54/79/574395479.db2.gz SIVCBFLQYDMWBY-GXFFZTMASA-N -1 3 283.393 2.635 20 10 CFCDHM Cc1ccc(C(=O)N2C[C@H](C)CC(C)(C)C2)c([O-])c1O ZINC000753029233 574397648 /nfs/dbraw/zinc/39/76/48/574397648.db2.gz KNRGXIRUPNYWIB-SNVBAGLBSA-N -1 3 277.364 2.914 20 10 CFCDHM O=C(N[C@@H]1COc2cc(F)cc(F)c21)c1cc([O-])cs1 ZINC000753523325 574403831 /nfs/dbraw/zinc/40/38/31/574403831.db2.gz KLLLQGDAGJNNEK-SECBINFHSA-N -1 3 297.282 2.595 20 10 CFCDHM C[C@@H]([NH2+][C@@H](Cc1ccccc1)C(=O)[O-])c1ccccc1[O-] ZINC000204866962 597733288 /nfs/dbraw/zinc/73/32/88/597733288.db2.gz YEPSLJIJZZOSLE-DOMZBBRYSA-N -1 3 285.343 2.739 20 10 CFCDHM C[C@H]([NH2+]Cc1cccc(C(=O)[O-])c1)c1ccccc1[O-] ZINC000820148552 597733796 /nfs/dbraw/zinc/73/37/96/597733796.db2.gz OWAUKYGKPWXHIE-NSHDSACASA-N -1 3 271.316 2.941 20 10 CFCDHM CC(C)C[C@H](CNC(=O)[O-])[NH2+][C@@H](C)c1ccccc1[O-] ZINC000833793352 606039523 /nfs/dbraw/zinc/03/95/23/606039523.db2.gz DSOITXRZGZLSDT-NWDGAFQWSA-N -1 3 280.368 2.725 20 10 CFCDHM Cc1nc(NCc2ccc(N3CCCC3)cc2)cc(=O)[n-]1 ZINC000891797118 617757748 /nfs/dbraw/zinc/75/77/48/617757748.db2.gz RQRSCCPIDDSQBX-UHFFFAOYSA-N -1 3 284.363 2.703 20 10 CFCDHM CCN1CCCC[C@@H]1C(=O)NCc1cccc(Cl)c1[O-] ZINC000890758225 617835951 /nfs/dbraw/zinc/83/59/51/617835951.db2.gz SOGBEWCSNMGXJK-CYBMUJFWSA-N -1 3 296.798 2.536 20 10 CFCDHM C[C@@H]1CC[C@H](NC(=O)c2cccc(O)c2[O-])[C@H](C)C1 ZINC000126427563 617940882 /nfs/dbraw/zinc/94/08/82/617940882.db2.gz KUSGYZXLNLGRCL-FOGDFJRCSA-N -1 3 263.337 2.652 20 10 CFCDHM Cc1cccc2c1N(C(=O)c1ccc(C)c(O)c1[O-])CC2 ZINC000179535923 618325685 /nfs/dbraw/zinc/32/56/85/618325685.db2.gz HOXHRRQXIUVMBN-UHFFFAOYSA-N -1 3 283.327 2.918 20 10 CFCDHM CN(Cc1cc(Cl)ccc1[O-])[C@@H]1CC(C)(C)OC1=O ZINC000814181197 618459671 /nfs/dbraw/zinc/45/96/71/618459671.db2.gz XKUICLXXPOYVRL-LLVKDONJSA-N -1 3 283.755 2.572 20 10 CFCDHM CSc1ccc(S(=O)(=O)[N-]c2ccc(O)cc2)cc1 ZINC000182418991 625298884 /nfs/dbraw/zinc/29/88/84/625298884.db2.gz MQQMAKVDRKLBLU-UHFFFAOYSA-N -1 3 295.385 2.915 20 10 CFCDHM CON(Cc1ccccc1)C(=O)c1ccc(C)c(O)c1[O-] ZINC000183095958 618903048 /nfs/dbraw/zinc/90/30/48/618903048.db2.gz WDRIBARRVAYTEC-UHFFFAOYSA-N -1 3 287.315 2.610 20 10 CFCDHM O=C(NCc1cccc2cccnc21)c1cccc(O)c1[O-] ZINC000184773822 619068600 /nfs/dbraw/zinc/06/86/00/619068600.db2.gz VYEDQQRCSHOWKI-UHFFFAOYSA-N -1 3 294.310 2.576 20 10 CFCDHM Cc1cc([O-])c(CN[C@H]2CCn3ccnc32)c(Cl)c1 ZINC000840949121 619117739 /nfs/dbraw/zinc/11/77/39/619117739.db2.gz NXXGFQNXEPMCHZ-LBPRGKRZSA-N -1 3 277.755 2.785 20 10 CFCDHM Cc1cc([O-])c(CNCc2nnc(C3CC3)[nH]2)c(Cl)c1 ZINC000840951414 619122766 /nfs/dbraw/zinc/12/27/66/619122766.db2.gz WHKPIAPTJZDAPK-UHFFFAOYSA-N -1 3 292.770 2.639 20 10 CFCDHM O=C(Nc1ccc(N2CCCC2)cc1)c1cccc(O)c1[O-] ZINC000317922247 619127658 /nfs/dbraw/zinc/12/76/58/619127658.db2.gz WTYZIHBMYKHRLZ-UHFFFAOYSA-N -1 3 298.342 2.950 20 10 CFCDHM CCON(CC)Cc1cc(F)cc(C(C)=O)c1[O-] ZINC000879796183 619368410 /nfs/dbraw/zinc/36/84/10/619368410.db2.gz OGSASBJGCSLLIC-UHFFFAOYSA-N -1 3 255.289 2.507 20 10 CFCDHM CN(Cc1ncc[nH]1)Cc1cc(Br)ccc1[O-] ZINC000894584560 619424501 /nfs/dbraw/zinc/42/45/01/619424501.db2.gz WCENQPYJEXBYGX-UHFFFAOYSA-N -1 3 296.168 2.510 20 10 CFCDHM Cc1cc([O-])c(CN(C)Cc2ncc[nH]2)cc1Cl ZINC000894586493 619424818 /nfs/dbraw/zinc/42/48/18/619424818.db2.gz FXDYIDQQTJDAIG-UHFFFAOYSA-N -1 3 265.744 2.709 20 10 CFCDHM [O-]c1c(F)cc(F)cc1CN1CC2(CC(F)C2)C1 ZINC000894977023 619520561 /nfs/dbraw/zinc/52/05/61/619520561.db2.gz QYMDMFHZEOQNHV-UHFFFAOYSA-N -1 3 257.255 2.604 20 10 CFCDHM Cc1nn(C)c(CNCc2c([O-])cccc2F)c1Cl ZINC000896641182 619781320 /nfs/dbraw/zinc/78/13/20/619781320.db2.gz LQDCEYKMDIWQRO-UHFFFAOYSA-N -1 3 283.734 2.516 20 10 CFCDHM Cc1csc(CNCc2c([O-])cccc2F)n1 ZINC000896641835 619782277 /nfs/dbraw/zinc/78/22/77/619782277.db2.gz SYCCQQXJAABJLK-UHFFFAOYSA-N -1 3 252.314 2.586 20 10 CFCDHM C[C@@H](C(=O)NCc1c([O-])cccc1F)C1CCCC1 ZINC000928705562 619995131 /nfs/dbraw/zinc/99/51/31/619995131.db2.gz LJKHSPKIDNEMQO-SNVBAGLBSA-N -1 3 265.328 2.974 20 10 CFCDHM O=C(NCc1c([O-])cccc1F)[C@H]1CCCCC1(F)F ZINC000928706829 619995790 /nfs/dbraw/zinc/99/57/90/619995790.db2.gz VUWQODXLPGPANF-SNVBAGLBSA-N -1 3 287.281 2.973 20 10 CFCDHM Cc1nc(CCC(=O)NCc2c([O-])cccc2F)cs1 ZINC000928706735 619995793 /nfs/dbraw/zinc/99/57/93/619995793.db2.gz YQANZSHXIIRHTR-UHFFFAOYSA-N -1 3 294.351 2.545 20 10 CFCDHM O=C(NCc1c([O-])cccc1F)[C@@H]1CCCCC1(F)F ZINC000928706828 619996006 /nfs/dbraw/zinc/99/60/06/619996006.db2.gz VUWQODXLPGPANF-JTQLQIEISA-N -1 3 287.281 2.973 20 10 CFCDHM CCC[C@@H]1C[C@H](C(=O)NCc2c([O-])cccc2F)CCO1 ZINC000928709197 619996428 /nfs/dbraw/zinc/99/64/28/619996428.db2.gz YEUNSJMLYVCJTE-VXGBXAGGSA-N -1 3 295.354 2.743 20 10 CFCDHM C[C@H](CC(=O)NCc1c([O-])cccc1F)C1CC1 ZINC000928712229 619996841 /nfs/dbraw/zinc/99/68/41/619996841.db2.gz PBAWDJVTEASEIZ-SECBINFHSA-N -1 3 251.301 2.584 20 10 CFCDHM C[C@@H](N[C@H](C)c1ccc(Cl)cc1[O-])c1ncn(C)n1 ZINC000841753437 620236073 /nfs/dbraw/zinc/23/60/73/620236073.db2.gz SZKHBDINBRNICD-RKDXNWHRSA-N -1 3 280.759 2.586 20 10 CFCDHM C[C@@H](NCc1csc(N)n1)c1cc(F)cc(F)c1[O-] ZINC000902500852 621105769 /nfs/dbraw/zinc/10/57/69/621105769.db2.gz XYXBFRLJKZTGJU-ZCFIWIBFSA-N -1 3 285.319 2.560 20 10 CFCDHM C[C@@H](NCc1cnn(CCF)c1)c1c([O-])cccc1F ZINC000903273587 621309341 /nfs/dbraw/zinc/30/93/41/621309341.db2.gz BJZRMMVAEKVIOB-SNVBAGLBSA-N -1 3 281.306 2.548 20 10 CFCDHM O=C(c1cccc(O)c1[O-])N1CC=CC12CCCCC2 ZINC000912474745 622724533 /nfs/dbraw/zinc/72/45/33/622724533.db2.gz REIOJSHJYYXFPL-UHFFFAOYSA-N -1 3 273.332 2.813 20 10 CFCDHM C[C@@H]1CC[C@@H](NC(=O)c2cccc(O)c2[O-])[C@@H](C)C1 ZINC000228513154 623147196 /nfs/dbraw/zinc/14/71/96/623147196.db2.gz KUSGYZXLNLGRCL-JFGNBEQYSA-N -1 3 263.337 2.652 20 10 CFCDHM CC(C)N(Cc1cc(Cl)c(F)cc1[O-])C1COC1 ZINC000824471444 623510357 /nfs/dbraw/zinc/51/03/57/623510357.db2.gz BTYZWSVBIHINNM-UHFFFAOYSA-N -1 3 273.735 2.794 20 10 CFCDHM Cc1cc([O-])c(CN2CCc3c(ncn3C)C2)cc1Cl ZINC000824478661 623512362 /nfs/dbraw/zinc/51/23/62/623512362.db2.gz NHWLHJBSGXDZCY-UHFFFAOYSA-N -1 3 291.782 2.646 20 10 CFCDHM COC(=O)CN(Cc1cc(Cl)c(C)cc1[O-])C(C)C ZINC000824581883 623528915 /nfs/dbraw/zinc/52/89/15/623528915.db2.gz WLPJVZSWTFCHDF-UHFFFAOYSA-N -1 3 285.771 2.737 20 10 CFCDHM Cc1ccc([C@@H](C)NC(=O)NCc2c([O-])cccc2F)o1 ZINC000913911074 623643906 /nfs/dbraw/zinc/64/39/06/623643906.db2.gz QFRAZGBGQAABDU-SNVBAGLBSA-N -1 3 292.310 2.993 20 10 CFCDHM Cc1cc([O-])c(CN2CCO[C@@H](C3CC3)C2)cc1Cl ZINC000825548505 623713785 /nfs/dbraw/zinc/71/37/85/623713785.db2.gz HIHBLVNKCWGDHB-OAHLLOKOSA-N -1 3 281.783 2.965 20 10 CFCDHM Cc1cc([O-])c(CN(CC(F)F)C[C@H](C)O)cc1Cl ZINC000826089244 623792980 /nfs/dbraw/zinc/79/29/80/623792980.db2.gz BNTWGABOMCRZJZ-VIFPVBQESA-N -1 3 293.741 2.802 20 10 CFCDHM O=[N+]([O-])c1cc(Cl)cc(CN2CC[C@H]3C[C@H]3C2)c1[O-] ZINC000827507701 624020598 /nfs/dbraw/zinc/02/05/98/624020598.db2.gz ZAZVBGCACWZWRY-IUCAKERBSA-N -1 3 282.727 2.796 20 10 CFCDHM C[C@H]1CN(Cc2c([O-])ccc(Cl)c2F)C[C@@]1(C)CO ZINC000827691846 624065541 /nfs/dbraw/zinc/06/55/41/624065541.db2.gz CIGACNZXRAYBHV-XPTSAGLGSA-N -1 3 287.762 2.635 20 10 CFCDHM CC1(CCC(=O)NCc2c([O-])cccc2F)CC1 ZINC000830180841 624659005 /nfs/dbraw/zinc/65/90/05/624659005.db2.gz SUZJLXDMUHIUOK-UHFFFAOYSA-N -1 3 251.301 2.728 20 10 CFCDHM COc1cc(C)ccc1NC(=O)c1ccc(C)c(O)c1[O-] ZINC000182149483 625260903 /nfs/dbraw/zinc/26/09/03/625260903.db2.gz HZGWOPDDCRTXOA-UHFFFAOYSA-N -1 3 287.315 2.976 20 10 CFCDHM CCOC(=O)[C@@H](NCc1cc(F)ccc1[O-])C(C)(C)C ZINC000768524720 625895593 /nfs/dbraw/zinc/89/55/93/625895593.db2.gz POAIISZMGSBEIL-CYBMUJFWSA-N -1 3 283.343 2.599 20 10 CFCDHM CCCN(C[C@@H]1CCCCO1)C(=O)c1cccc(O)c1[O-] ZINC000187078222 626449032 /nfs/dbraw/zinc/44/90/32/626449032.db2.gz DRDDMMJNIVZCIM-LBPRGKRZSA-N -1 3 293.363 2.519 20 10 CFCDHM CCCN(C[C@H]1CCCCO1)C(=O)c1cccc(O)c1[O-] ZINC000187078243 626449128 /nfs/dbraw/zinc/44/91/28/626449128.db2.gz DRDDMMJNIVZCIM-GFCCVEGCSA-N -1 3 293.363 2.519 20 10 CFCDHM C[C@@H](N[C@@H](C)c1ccc(F)cc1[O-])c1ccn(C)n1 ZINC000840817843 626522615 /nfs/dbraw/zinc/52/26/15/626522615.db2.gz VOXYXEMVTNGBQD-VHSXEESVSA-N -1 3 263.316 2.677 20 10 CFCDHM CC(C)(C)c1nnc(CNCc2cccc(Cl)c2[O-])[nH]1 ZINC000839169821 626529454 /nfs/dbraw/zinc/52/94/54/626529454.db2.gz JKQUKJIIJWFWSA-UHFFFAOYSA-N -1 3 294.786 2.751 20 10 CFCDHM Cc1cc(Br)c([O-])c(CNCc2ccno2)c1 ZINC000761500234 626841171 /nfs/dbraw/zinc/84/11/71/626841171.db2.gz UFFODDCWAJEXBA-UHFFFAOYSA-N -1 3 297.152 2.741 20 10 CFCDHM C[C@H](NC(=O)c1ccccc1[O-])c1ccc(N(C)C)cc1 ZINC000773020106 627769649 /nfs/dbraw/zinc/76/96/49/627769649.db2.gz NUNNLWWCBOAABI-LBPRGKRZSA-N -1 3 284.359 2.949 20 10 CFCDHM COc1c([O-])c(CNc2cc(C)ccn2)ccc1[N+](=O)[O-] ZINC000774979575 627983285 /nfs/dbraw/zinc/98/32/85/627983285.db2.gz ZSOVXFIGRIRZPE-UHFFFAOYSA-N -1 3 289.291 2.625 20 10 CFCDHM C[C@@H]([N-]C(=O)C(F)(F)C(F)F)c1ccc(N(C)C)cc1 ZINC000775409301 628022199 /nfs/dbraw/zinc/02/21/99/628022199.db2.gz DOLBAJUQPCMGGQ-MRVPVSSYSA-N -1 3 292.276 2.830 20 10 CFCDHM CCN1CCN(Cc2cc(Cl)cc(F)c2[O-])C[C@@H]1C ZINC000775686532 628055964 /nfs/dbraw/zinc/05/59/64/628055964.db2.gz JBOSFTDGSPRBTO-JTQLQIEISA-N -1 3 286.778 2.711 20 10 CFCDHM O=C(NC[C@@H]1CCCc2ccccc21)c1cccc(O)c1[O-] ZINC000776327387 628131890 /nfs/dbraw/zinc/13/18/90/628131890.db2.gz KHFJUOYPPMOKBY-ZDUSSCGKSA-N -1 3 297.354 2.948 20 10 CFCDHM Cc1cc(C)c(CCNC(=O)c2cccc(O)c2[O-])c(C)c1 ZINC000776676774 628167057 /nfs/dbraw/zinc/16/70/57/628167057.db2.gz PSCLVNVWVWVMKW-UHFFFAOYSA-N -1 3 299.370 2.996 20 10 CFCDHM C[C@@H]1CN(Cc2cc(F)ccc2[O-])C[C@@H](C(F)(F)F)O1 ZINC000779023623 628345507 /nfs/dbraw/zinc/34/55/07/628345507.db2.gz UZLXKKHHALORAQ-PELKAZGASA-N -1 3 293.260 2.683 20 10 CFCDHM CC(=O)c1cc(F)cc(CN2C[C@H](C)O[C@H](C)[C@H]2C)c1[O-] ZINC000782633420 628651081 /nfs/dbraw/zinc/65/10/81/628651081.db2.gz HIVGSEKMKJUTNY-HOSYDEDBSA-N -1 3 295.354 2.732 20 10 CFCDHM COc1cccc([C@H](C)NC(=O)c2cccc(O)c2[O-])c1 ZINC000790528941 629245545 /nfs/dbraw/zinc/24/55/45/629245545.db2.gz VMGGTWOULYGYCB-JTQLQIEISA-N -1 3 287.315 2.597 20 10 CFCDHM O=C(c1cccc(O)c1[O-])N1CC[C@H]1c1ccccc1 ZINC000790538590 629246606 /nfs/dbraw/zinc/24/66/06/629246606.db2.gz JEMXSJHOHZJMLC-ZDUSSCGKSA-N -1 3 269.300 2.685 20 10 CFCDHM O=C(NCc1coc2ccccc12)c1cccc(O)c1[O-] ZINC000790716410 629258881 /nfs/dbraw/zinc/25/88/81/629258881.db2.gz CQHWGHIMMAWLQC-UHFFFAOYSA-N -1 3 283.283 2.774 20 10 CFCDHM [O-]c1ccc(Cl)c(F)c1CN1CCN(C2CCC2)CC1 ZINC000792165531 629404106 /nfs/dbraw/zinc/40/41/06/629404106.db2.gz HYVMVQDMHYMYFH-UHFFFAOYSA-N -1 3 298.789 2.855 20 10 CFCDHM C[C@H]1[C@H](C)N(Cc2c([O-])ccc(Cl)c2F)CCN1C ZINC000792173773 629405860 /nfs/dbraw/zinc/40/58/60/629405860.db2.gz CDLHPZMERNMUFA-UWVGGRQHSA-N -1 3 286.778 2.709 20 10 CFCDHM C[C@@H]1[C@H](C(F)(F)F)CCN1C(=O)c1cccc(O)c1[O-] ZINC000792537526 629432242 /nfs/dbraw/zinc/43/22/42/629432242.db2.gz IQIDBRILHRLOND-VXNVDRBHSA-N -1 3 289.253 2.511 20 10 CFCDHM CN(C(=O)c1cccc(O)c1[O-])[C@H]1CCC(C)(C)C1 ZINC000794277087 629629854 /nfs/dbraw/zinc/62/98/54/629629854.db2.gz SOSVVEFBNZQRLP-JTQLQIEISA-N -1 3 263.337 2.749 20 10 CFCDHM CO[C@H](C)CN(C)Cc1c([O-])ccc(Cl)c1F ZINC000809717153 631270120 /nfs/dbraw/zinc/27/01/20/631270120.db2.gz COHOMOVZYPZISD-MRVPVSSYSA-N -1 3 261.724 2.651 20 10 CFCDHM Cc1cc(Cl)cc(C[N@@H+](C)C[C@@H](C)C(=O)[O-])c1[O-] ZINC000840999360 631299183 /nfs/dbraw/zinc/29/91/83/631299183.db2.gz VDSMIYVLRTXWIY-SECBINFHSA-N -1 3 271.744 2.507 20 10 CFCDHM Cc1cc(Cl)cc(C[N@H+](C)C[C@@H](C)C(=O)[O-])c1[O-] ZINC000840999360 631299187 /nfs/dbraw/zinc/29/91/87/631299187.db2.gz VDSMIYVLRTXWIY-SECBINFHSA-N -1 3 271.744 2.507 20 10 CFCDHM CCn1ncnc1CN[C@@H](C)c1ccc(Cl)cc1[O-] ZINC000841753512 631466400 /nfs/dbraw/zinc/46/64/00/631466400.db2.gz UXXRHLINFIJJBH-VIFPVBQESA-N -1 3 280.759 2.508 20 10 CFCDHM CC1(C)[C@@H](O)CCN1Cc1cc(Cl)cc(F)c1[O-] ZINC000812778652 631772163 /nfs/dbraw/zinc/77/21/63/631772163.db2.gz KHEARQZGLIBJIA-NSHDSACASA-N -1 3 273.735 2.530 20 10 CFCDHM Cc1cc(Cl)cc(C[N@H+]2CC[C@H](C)[C@@H](C(=O)[O-])C2)c1[O-] ZINC000843039088 631809431 /nfs/dbraw/zinc/80/94/31/631809431.db2.gz ANISFBVENDLRRW-ZANVPECISA-N -1 3 297.782 2.897 20 10 CFCDHM Cc1cc(Cl)cc(C[N@@H+]2CC[C@H](C)[C@@H](C(=O)[O-])C2)c1[O-] ZINC000843039088 631809437 /nfs/dbraw/zinc/80/94/37/631809437.db2.gz ANISFBVENDLRRW-ZANVPECISA-N -1 3 297.782 2.897 20 10 CFCDHM Cc1cc(Cl)cc(C[N@H+]2CC[C@H](C)[C@H](C(=O)[O-])C2)c1[O-] ZINC000843039087 631810055 /nfs/dbraw/zinc/81/00/55/631810055.db2.gz ANISFBVENDLRRW-TVQRCGJNSA-N -1 3 297.782 2.897 20 10 CFCDHM Cc1cc(Cl)cc(C[N@@H+]2CC[C@H](C)[C@H](C(=O)[O-])C2)c1[O-] ZINC000843039087 631810057 /nfs/dbraw/zinc/81/00/57/631810057.db2.gz ANISFBVENDLRRW-TVQRCGJNSA-N -1 3 297.782 2.897 20 10 CFCDHM C[C@@H]1[C@@H](C)N(Cc2cc(Cl)c(F)cc2[O-])CCN1C ZINC000816571719 632488058 /nfs/dbraw/zinc/48/80/58/632488058.db2.gz NTKIVWSRVKEYAA-NXEZZACHSA-N -1 3 286.778 2.709 20 10 CFCDHM C[C@@H]1CN(Cc2cc(Cl)c(F)cc2[O-])[C@@H](C)CN1C ZINC000816571421 632488249 /nfs/dbraw/zinc/48/82/49/632488249.db2.gz CYFWUUIFKBQGMM-ZJUUUORDSA-N -1 3 286.778 2.709 20 10 CFCDHM C[C@@H]1[C@H](C)N(Cc2cc(Cl)c(F)cc2[O-])CCN1C ZINC000816571722 632488266 /nfs/dbraw/zinc/48/82/66/632488266.db2.gz NTKIVWSRVKEYAA-ZJUUUORDSA-N -1 3 286.778 2.709 20 10 CFCDHM CC[C@H]1CN(C)CCN1Cc1cc(Cl)cc(F)c1[O-] ZINC000816660353 632506566 /nfs/dbraw/zinc/50/65/66/632506566.db2.gz AJGBPIVPZJYVQR-LBPRGKRZSA-N -1 3 286.778 2.711 20 10 CFCDHM C[C@@H]1C[C@@H](CO)CN(Cc2c([O-])ccc(Cl)c2F)C1 ZINC000817413251 632624705 /nfs/dbraw/zinc/62/47/05/632624705.db2.gz UWLZOERPYKOJTJ-NXEZZACHSA-N -1 3 287.762 2.635 20 10 CFCDHM Cc1cc(Cl)cc(C[N@@H+]2C[C@@H](C)C[C@H](C(=O)[O-])C2)c1[O-] ZINC000817881158 632717613 /nfs/dbraw/zinc/71/76/13/632717613.db2.gz GSWBCWHDKDOHHR-CABZTGNLSA-N -1 3 297.782 2.897 20 10 CFCDHM Cc1cc(Cl)cc(C[N@H+]2C[C@@H](C)C[C@H](C(=O)[O-])C2)c1[O-] ZINC000817881158 632717614 /nfs/dbraw/zinc/71/76/14/632717614.db2.gz GSWBCWHDKDOHHR-CABZTGNLSA-N -1 3 297.782 2.897 20 10 CFCDHM C[C@H](NCC(F)(F)CN)c1ccc2ccccc2c1[O-] ZINC000817965768 632764001 /nfs/dbraw/zinc/76/40/01/632764001.db2.gz CHYAGVYKWWADNJ-JTQLQIEISA-N -1 3 280.318 2.790 20 10 CFCDHM CCN1C(=O)C(C)(C)N[C@H]1c1cc(Cl)c(C)cc1[O-] ZINC000849183150 633580353 /nfs/dbraw/zinc/58/03/53/633580353.db2.gz QEJVMXYVHXORFC-GFCCVEGCSA-N -1 3 282.771 2.583 20 10 CFCDHM Cc1cc([O-])c(CN[C@H](C)c2nccn2C)c(Cl)c1 ZINC000850409957 633982160 /nfs/dbraw/zinc/98/21/60/633982160.db2.gz JKFBWXCDXRVCCF-SNVBAGLBSA-N -1 3 279.771 2.938 20 10 CFCDHM C[C@H](N[C@@H]1C[C@H](C)n2ncnc21)c1ccc(Cl)cc1[O-] ZINC000850499077 634019197 /nfs/dbraw/zinc/01/91/97/634019197.db2.gz JEUMNFSVCHGFTF-HOTUBEGUSA-N -1 3 292.770 2.994 20 10 CFCDHM COC[C@@]1(C)CN(Cc2c([O-])cc(C)cc2Cl)CCO1 ZINC000862552087 637424183 /nfs/dbraw/zinc/42/41/83/637424183.db2.gz SPNMRGQWJBNZKB-OAHLLOKOSA-N -1 3 299.798 2.591 20 10 CFCDHM COc1cccc2c1CC[C@H]2NC(=O)c1cccc(O)c1[O-] ZINC000193133773 650625549 /nfs/dbraw/zinc/62/55/49/650625549.db2.gz WDYSKUUIRYBWIT-CYBMUJFWSA-N -1 3 299.326 2.524 20 10 CFCDHM C[C@@H]1c2ccccc2CCN1C(=O)c1cccc(O)c1[O-] ZINC000193127148 650625588 /nfs/dbraw/zinc/62/55/88/650625588.db2.gz MQOPOMPIHPGXAU-LLVKDONJSA-N -1 3 283.327 2.857 20 10 CFCDHM Nc1ccc2c(c1)OCCN(Cc1cccc(F)c1[O-])C2 ZINC000873219744 642073082 /nfs/dbraw/zinc/07/30/82/642073082.db2.gz NMYWNRDCFCVVHW-UHFFFAOYSA-N -1 3 288.322 2.508 20 10 CFCDHM C[C@H](NC(=O)c1cccc(O)c1[O-])C1CCCCC1 ZINC000126383219 643187661 /nfs/dbraw/zinc/18/76/61/643187661.db2.gz QEVMWENRBYQDDD-JTQLQIEISA-N -1 3 263.337 2.796 20 10 CFCDHM CC[C@@H]1CCC[C@H](NC(=O)c2cccc(O)c2[O-])C1 ZINC000126449703 643227693 /nfs/dbraw/zinc/22/76/93/643227693.db2.gz IRVSCBMWORHWJV-MNOVXSKESA-N -1 3 263.337 2.796 20 10 CFCDHM COc1cc(CNCc2c([O-])cc(C)cc2Cl)on1 ZINC000877635578 643420462 /nfs/dbraw/zinc/42/04/62/643420462.db2.gz XCZOLWRUHUNWKE-UHFFFAOYSA-N -1 3 282.727 2.640 20 10 CFCDHM Cc1nccnc1[C@H](C)NCc1ccc(F)c(F)c1[O-] ZINC000877829355 643595099 /nfs/dbraw/zinc/59/50/99/643595099.db2.gz ZXXORCFQHGBZTL-VIFPVBQESA-N -1 3 279.290 2.620 20 10 CFCDHM C[C@@H]1CC[C@H](NC(=O)c2cccc(O)c2[O-])C[C@H]1C ZINC000249271745 650957344 /nfs/dbraw/zinc/95/73/44/650957344.db2.gz BIJIRUMWPTWQMQ-MXWKQRLJSA-N -1 3 263.337 2.652 20 10 CFCDHM CCn1nccc1CN[C@H](C)c1c([O-])cccc1F ZINC000886639846 647082606 /nfs/dbraw/zinc/08/26/06/647082606.db2.gz MSBNVEPXCVNBEU-SNVBAGLBSA-N -1 3 263.316 2.599 20 10 CFCDHM O=C(NCc1c([O-])cccc1F)C(C1CC1)C1CC1 ZINC000928704501 648944130 /nfs/dbraw/zinc/94/41/30/648944130.db2.gz AFVFNYHMAFIERB-UHFFFAOYSA-N -1 3 263.312 2.584 20 10 CFCDHM CCO[C@@H](CC(=O)NCc1c([O-])cccc1F)C(C)C ZINC000928706263 648944863 /nfs/dbraw/zinc/94/48/63/648944863.db2.gz TZICJHUQEIBJGZ-AWEZNQCLSA-N -1 3 283.343 2.599 20 10 CFCDHM C[C@H]1CCC[C@]1(C)C(=O)NCc1c([O-])cccc1F ZINC000928706003 648944884 /nfs/dbraw/zinc/94/48/84/648944884.db2.gz NKQJOOXLGMGUSK-BONVTDFDSA-N -1 3 265.328 2.974 20 10 CFCDHM Cc1ncsc1CCC(=O)NCc1c([O-])cccc1F ZINC000928706846 648945465 /nfs/dbraw/zinc/94/54/65/648945465.db2.gz WVCNBHNPBGYLJP-UHFFFAOYSA-N -1 3 294.351 2.545 20 10 CFCDHM CC[C@H](C)[C@@H](C)C(=O)NCc1c([O-])cccc1F ZINC000928708571 648945864 /nfs/dbraw/zinc/94/58/64/648945864.db2.gz PNUYDSUNWKFQKG-VHSXEESVSA-N -1 3 253.317 2.830 20 10 CFCDHM CCO[C@@H](C(=O)NCc1c([O-])cccc1F)C1CCCC1 ZINC000928709494 648946037 /nfs/dbraw/zinc/94/60/37/648946037.db2.gz ISNJQIAYSAZAJT-OAHLLOKOSA-N -1 3 295.354 2.743 20 10 CFCDHM CC(C)[C@]1(C)C[C@@H]1C(=O)NCc1c([O-])cccc1F ZINC000928708773 648946044 /nfs/dbraw/zinc/94/60/44/648946044.db2.gz TYSGKVZBVFXUPK-ABAIWWIYSA-N -1 3 265.328 2.830 20 10 CFCDHM CC(C)(C(=O)NCc1c([O-])cccc1F)c1nccs1 ZINC000928712906 648946688 /nfs/dbraw/zinc/94/66/88/648946688.db2.gz XJQIQYSWXVKBAU-UHFFFAOYSA-N -1 3 294.351 2.582 20 10 CFCDHM COC1CCN(Cc2cc(F)cc(Cl)c2[O-])CC1 ZINC001237809024 779719150 /nfs/dbraw/zinc/71/91/50/779719150.db2.gz YOYVYMBBOZOWLE-UHFFFAOYSA-N -1 3 273.735 2.796 20 10 CFCDHM Cc1cc(C)c(-c2noc(-c3cccc(O)c3[O-])n2)cn1 ZINC000397426737 770201546 /nfs/dbraw/zinc/20/15/46/770201546.db2.gz YFRKPCKYNJYKBF-UHFFFAOYSA-N -1 3 283.287 2.827 20 10 CFCDHM [O-]c1c(CN2CCNCC(F)(F)C2)ccc2ccccc21 ZINC001211347045 770487394 /nfs/dbraw/zinc/48/73/94/770487394.db2.gz LIPJZBPQRGMTGN-UHFFFAOYSA-N -1 3 292.329 2.586 20 10 CFCDHM CC[C@@H]1CN(Cc2cccc(F)c2[O-])C[C@@H](CC)O1 ZINC000398783294 770607170 /nfs/dbraw/zinc/60/71/70/770607170.db2.gz MVWQXBVJKRBYSL-CHWSQXEVSA-N -1 3 267.344 2.921 20 10 CFCDHM C[C@@H](CN(C)C(=O)c1cccc(O)c1[O-])C(C)(C)C ZINC000399608441 776650112 /nfs/dbraw/zinc/65/01/12/776650112.db2.gz PVQPIJNVXGOLLA-JTQLQIEISA-N -1 3 265.353 2.852 20 10 CFCDHM Cc1ccc2c(c1)C[N@@H+](Cc1ccc(C(=O)[O-])cc1[O-])CC2 ZINC001231447846 777221112 /nfs/dbraw/zinc/22/11/12/777221112.db2.gz WZELPVURRIKSBM-UHFFFAOYSA-N -1 3 297.354 2.957 20 10 CFCDHM Cc1ccc2c(c1)C[N@H+](Cc1ccc(C(=O)[O-])cc1[O-])CC2 ZINC001231447846 777221120 /nfs/dbraw/zinc/22/11/20/777221120.db2.gz WZELPVURRIKSBM-UHFFFAOYSA-N -1 3 297.354 2.957 20 10 CFCDHM C[C@H]1CCCC[N@H+](Cc2cc(C(=O)[O-])ccc2[O-])C1 ZINC001231560751 777259941 /nfs/dbraw/zinc/25/99/41/777259941.db2.gz LMRLCTFNEDOSNQ-NSHDSACASA-N -1 3 263.337 2.712 20 10 CFCDHM C[C@H]1CCCC[N@@H+](Cc2cc(C(=O)[O-])ccc2[O-])C1 ZINC001231560751 777259948 /nfs/dbraw/zinc/25/99/48/777259948.db2.gz LMRLCTFNEDOSNQ-NSHDSACASA-N -1 3 263.337 2.712 20 10 CFCDHM Cc1cc([O-])c(CN(CCO)CC(F)(F)F)cc1Cl ZINC001231870124 777359527 /nfs/dbraw/zinc/35/95/27/777359527.db2.gz KKAYBDQSTIFDNM-UHFFFAOYSA-N -1 3 297.704 2.711 20 10 CFCDHM Cc1cc([O-])c(CN(C)Cc2ccno2)cc1Cl ZINC001231869938 777359702 /nfs/dbraw/zinc/35/97/02/777359702.db2.gz BCKICZMLBCUIGB-UHFFFAOYSA-N -1 3 266.728 2.974 20 10 CFCDHM COc1cc([O-])c(CN2C[C@H](C)O[C@@H](C)C2)cc1Cl ZINC001232266747 777498841 /nfs/dbraw/zinc/49/88/41/777498841.db2.gz XTXZFVXEUCXALH-UWVGGRQHSA-N -1 3 285.771 2.663 20 10 CFCDHM COc1cc([O-])c(CN(C)Cc2ccon2)cc1Cl ZINC001232269789 777501057 /nfs/dbraw/zinc/50/10/57/777501057.db2.gz KZVYZTCQYDBDNS-UHFFFAOYSA-N -1 3 282.727 2.674 20 10 CFCDHM COc1cc([O-])c(CN2CCCC[C@H]2C(C)=O)cc1Cl ZINC001232269373 777501977 /nfs/dbraw/zinc/50/19/77/777501977.db2.gz XQQGRPXWLIHIKD-ZDUSSCGKSA-N -1 3 297.782 2.998 20 10 CFCDHM [O-]c1ccc(F)c(F)c1CN1C[C@H]2[C@H](CC2(F)F)C1 ZINC001233332214 777889335 /nfs/dbraw/zinc/88/93/35/777889335.db2.gz CMSBBESBSPMNPU-APPZFPTMSA-N -1 3 275.245 2.757 20 10 CFCDHM [O-]c1c(CN2CC3(C2)CCOC3)cccc1C(F)(F)F ZINC001233415546 777943407 /nfs/dbraw/zinc/94/34/07/777943407.db2.gz AIXFFSCMECMDTD-UHFFFAOYSA-N -1 3 287.281 2.633 20 10 CFCDHM CN(Cc1ccc(C(F)(F)F)cc1[O-])Cc1ncccn1 ZINC001233452236 777956787 /nfs/dbraw/zinc/95/67/87/777956787.db2.gz OMTRJHWSSXBBKZ-UHFFFAOYSA-N -1 3 297.280 2.833 20 10 CFCDHM Cn1ncc2c1CN(Cc1ccc(C(F)(F)F)cc1[O-])C2 ZINC001233453979 777959914 /nfs/dbraw/zinc/95/99/14/777959914.db2.gz BCFCOQNVSSFSST-UHFFFAOYSA-N -1 3 297.280 2.660 20 10 CFCDHM [O-]c1ccc(Nc2cccc(O)c2O)c(F)c1F ZINC001212009510 778325984 /nfs/dbraw/zinc/32/59/84/778325984.db2.gz RFMYHICVNYALIJ-UHFFFAOYSA-N -1 3 253.204 2.825 20 10 CFCDHM COc1ccc(CN2CCC[C@@H](OC)C2)c([O-])c1Cl ZINC001236802002 778945120 /nfs/dbraw/zinc/94/51/20/778945120.db2.gz MKJIPMKPRRMXTA-LLVKDONJSA-N -1 3 285.771 2.665 20 10 CFCDHM COc1ccc(CN2CC[C@@H]3CCO[C@H]3C2)c([O-])c1Cl ZINC001236802205 778945219 /nfs/dbraw/zinc/94/52/19/778945219.db2.gz OZIMMHNUERXLQP-MFKMUULPSA-N -1 3 297.782 2.665 20 10 CFCDHM CCN1CCN(Cc2ccc(OC)c(Cl)c2[O-])[C@H](C)C1 ZINC001236818570 778952711 /nfs/dbraw/zinc/95/27/11/778952711.db2.gz ONZFHLNCMBERJK-LLVKDONJSA-N -1 3 298.814 2.580 20 10 CFCDHM C[C@@H]1CN(Cc2cc(Cl)cc(F)c2[O-])CC[C@]1(C)O ZINC001237617655 779144460 /nfs/dbraw/zinc/14/44/60/779144460.db2.gz UDUYFNFCMJPVQD-OTYXRUKQSA-N -1 3 287.762 2.778 20 10 CFCDHM C[C@H]1CC[C@@H](CO)CN1Cc1cc(F)cc(Cl)c1[O-] ZINC001237809201 779186195 /nfs/dbraw/zinc/18/61/95/779186195.db2.gz ZZKOMHMKXUBYKG-VHSXEESVSA-N -1 3 287.762 2.778 20 10 CFCDHM C[C@@H]1CC[C@H](O)CN1Cc1cc(F)c(Cl)cc1[O-] ZINC001237933459 779209559 /nfs/dbraw/zinc/20/95/59/779209559.db2.gz CCMBRSUVYCYIFE-SCZZXKLOSA-N -1 3 273.735 2.530 20 10 CFCDHM C[C@@]1(O)CCCN(Cc2cc(F)c(Cl)cc2[O-])C1 ZINC001237938030 779210757 /nfs/dbraw/zinc/21/07/57/779210757.db2.gz WVUVMYYCBMNGTL-CYBMUJFWSA-N -1 3 273.735 2.532 20 10 CFCDHM Cc1cc(CNCc2c([O-])cccc2Br)on1 ZINC000706829932 781204639 /nfs/dbraw/zinc/20/46/39/781204639.db2.gz HBEDEBGZJCGRSG-UHFFFAOYSA-N -1 3 297.152 2.741 20 10 CFCDHM CC(=O)c1cc(Cl)cc(CN2CC[C@H]3C[C@H]32)c1[O-] ZINC000707052215 781221967 /nfs/dbraw/zinc/22/19/67/781221967.db2.gz GRKRXLZJUHSMKZ-TVQRCGJNSA-N -1 3 265.740 2.842 20 10 CFCDHM [O-]c1ccccc1CN(C[C@H]1CCCO1)CC(F)(F)F ZINC000111232978 375832906 /nfs/dbraw/zinc/83/29/06/375832906.db2.gz VURGRPPGLOKDAU-GFCCVEGCSA-N -1 3 289.297 2.936 20 10 CFCDHM Cc1noc(C)c1CNCc1cccc(Cl)c1[O-] ZINC000124735777 377082117 /nfs/dbraw/zinc/08/21/17/377082117.db2.gz QJDBOBGFWGQBCX-UHFFFAOYSA-N -1 3 266.728 2.940 20 10 CFCDHM O=C(c1cccc(O)c1[O-])N1CCC[C@H]2CCCC[C@H]21 ZINC000126269730 377218480 /nfs/dbraw/zinc/21/84/80/377218480.db2.gz QGDHUQFGVXWHQZ-DGCLKSJQSA-N -1 3 275.348 2.893 20 10 CFCDHM O=C(c1cccc(O)c1[O-])N1CCC[C@H]1C1CCCC1 ZINC000126362542 377223614 /nfs/dbraw/zinc/22/36/14/377223614.db2.gz GYZQNBAAALHFPX-ZDUSSCGKSA-N -1 3 275.348 2.893 20 10 CFCDHM CCC1(CC)CCN(C(=O)c2cccc(O)c2[O-])C1 ZINC000126481909 377230801 /nfs/dbraw/zinc/23/08/01/377230801.db2.gz FOFBMDJBSBJWOF-UHFFFAOYSA-N -1 3 263.337 2.750 20 10 CFCDHM C[C@@H](O)C1CCN(Cc2c([O-])cccc2Cl)CC1 ZINC000130415844 377553963 /nfs/dbraw/zinc/55/39/63/377553963.db2.gz NFMJMBNYBSYJGJ-SNVBAGLBSA-N -1 3 269.772 2.638 20 10 CFCDHM COc1cc(Cl)cc(CN2C[C@@H](C)O[C@@H](C)C2)c1[O-] ZINC000132024981 377791965 /nfs/dbraw/zinc/79/19/65/377791965.db2.gz SJXKUUWZJCATTR-AOOOYVTPSA-N -1 3 285.771 2.663 20 10 CFCDHM CCOC[C@@H]1CN(Cc2cc(Cl)cc(C)c2[O-])CCO1 ZINC000529665596 383743858 /nfs/dbraw/zinc/74/38/58/383743858.db2.gz HHSRDPAGIRBNCN-AWEZNQCLSA-N -1 3 299.798 2.591 20 10 CFCDHM C[C@H](NCc1nnc2n1CCCCC2)c1ccccc1[O-] ZINC000179877613 380592397 /nfs/dbraw/zinc/59/23/97/380592397.db2.gz YVXIZMHKMZZIRN-LBPRGKRZSA-N -1 3 286.379 2.561 20 10 CFCDHM CC[C@@H]1CN(Cc2cc(F)ccc2[O-])C[C@H](C)O1 ZINC000179987060 380607120 /nfs/dbraw/zinc/60/71/20/380607120.db2.gz JRLDTDGNQLBGBA-GXFFZTMASA-N -1 3 253.317 2.531 20 10 CFCDHM COC[C@@H]1CCN(Cc2cc(Cl)c(F)cc2[O-])C1 ZINC000295464611 380871576 /nfs/dbraw/zinc/87/15/76/380871576.db2.gz WDQPHAQDYCWWGS-SECBINFHSA-N -1 3 273.735 2.653 20 10 CFCDHM Cc1ccc(C(=O)N(C)[C@@H](C)C2(C)CC2)c([O-])c1O ZINC000182579892 381113746 /nfs/dbraw/zinc/11/37/46/381113746.db2.gz ZJTJSMYDBOFCRM-JTQLQIEISA-N -1 3 263.337 2.667 20 10 CFCDHM Cc1ccc(C(=O)N2[C@H](C)CCC[C@H]2C)c([O-])c1O ZINC000182378506 381078014 /nfs/dbraw/zinc/07/80/14/381078014.db2.gz SPGWRLFMJWPPJM-GHMZBOCLSA-N -1 3 263.337 2.809 20 10 CFCDHM Cc1ccc(C(=O)N2CC[C@H](C)C[C@@H](C)C2)c([O-])c1O ZINC000182891185 381179279 /nfs/dbraw/zinc/17/92/79/381179279.db2.gz SFZWAKBQTYJGRE-WDEREUQCSA-N -1 3 277.364 2.914 20 10 CFCDHM CCn1ccnc1CN[C@H](C)c1cc(F)ccc1[O-] ZINC000296488582 381418580 /nfs/dbraw/zinc/41/85/80/381418580.db2.gz OOROTQCVNWLIIE-SNVBAGLBSA-N -1 3 263.316 2.599 20 10 CFCDHM CC(C)c1nnc(CN[C@@H](C)c2ccc(F)cc2[O-])[nH]1 ZINC000296603916 381469034 /nfs/dbraw/zinc/46/90/34/381469034.db2.gz VUMPRNOYHJYPSD-VIFPVBQESA-N -1 3 278.331 2.624 20 10 CFCDHM Cn1cc(NCc2cc(F)ccc2[O-])c(-c2ccccn2)n1 ZINC000371793732 381703089 /nfs/dbraw/zinc/70/30/89/381703089.db2.gz AGKDCDQDFVPDPT-UHFFFAOYSA-N -1 3 298.321 2.939 20 10 CFCDHM O=C(c1cccc(O)c1[O-])N1CCC12CCCCC2 ZINC000373064204 381920576 /nfs/dbraw/zinc/92/05/76/381920576.db2.gz UUDMTGOHXPZKFN-UHFFFAOYSA-N -1 3 261.321 2.647 20 10 CFCDHM [O-]c1c(F)cccc1CN[C@H]1COc2cccc(F)c21 ZINC000375779385 382102462 /nfs/dbraw/zinc/10/24/62/382102462.db2.gz LRPZBHYNEKFRQI-LBPRGKRZSA-N -1 3 277.270 2.894 20 10 CFCDHM Cc1csc2c1CN(C(=O)c1cccc(O)c1[O-])CC2 ZINC000375670161 382096561 /nfs/dbraw/zinc/09/65/61/382096561.db2.gz ZXJMYYFVSFMSKU-UHFFFAOYSA-N -1 3 289.356 2.666 20 10 CFCDHM [O-]c1cccc(Cl)c1CNc1cc2n(n1)CCCC2 ZINC000375742704 382100003 /nfs/dbraw/zinc/10/00/03/382100003.db2.gz IOJPDSWASHVKGQ-UHFFFAOYSA-N -1 3 277.755 2.612 20 10 CFCDHM Cc1ccc(C(=O)N2CC(C)(C)[C@@H]2C(C)C)c([O-])c1O ZINC000294150683 382436119 /nfs/dbraw/zinc/43/61/19/382436119.db2.gz UVFBAQWLQCGAKP-AWEZNQCLSA-N -1 3 277.364 2.913 20 10 CFCDHM Cc1csc([C@H]2COCCN2Cc2ccccc2[O-])n1 ZINC000190404044 382666322 /nfs/dbraw/zinc/66/63/22/382666322.db2.gz MCAJAVMHQALKSC-CYBMUJFWSA-N -1 3 290.388 2.731 20 10 CFCDHM [O-]c1ccc(Br)cc1CN1C[C@H]2CC[C@@H](C1)O2 ZINC000211719897 382775337 /nfs/dbraw/zinc/77/53/37/382775337.db2.gz YMYKLAYIWMXHGW-TXEJJXNPSA-N -1 3 298.180 2.518 20 10 CFCDHM C[C@H](N[C@@H]1c2ccccc2C[C@H]1O)c1ccc(F)cc1[O-] ZINC000248499026 383251274 /nfs/dbraw/zinc/25/12/74/383251274.db2.gz MLUSSKOYHZEIFV-LZVXQISVSA-N -1 3 287.334 2.840 20 10 CFCDHM [O-]c1cccc(Cl)c1CN1CCS[C@@H]2COCC[C@@H]21 ZINC000271295801 385379479 /nfs/dbraw/zinc/37/94/79/385379479.db2.gz SEGGYCPYRRUKDK-GXTWGEPZSA-N -1 3 299.823 2.752 20 10 CFCDHM CC[C@H](NCc1nccn1CC)c1ccccc1[O-] ZINC000271649753 385388281 /nfs/dbraw/zinc/38/82/81/385388281.db2.gz AYZISPRZTYEMKT-ZDUSSCGKSA-N -1 3 259.353 2.850 20 10 CFCDHM CC(C)(C)N1C[C@@H](NCc2c([O-])cccc2Cl)CC1=O ZINC000271778764 385391415 /nfs/dbraw/zinc/39/14/15/385391415.db2.gz DFFIWPNDSHBJAM-JTQLQIEISA-N -1 3 296.798 2.535 20 10 CFCDHM Cc1cc(CN(C)Cc2c([O-])cccc2Cl)no1 ZINC000122936592 393974164 /nfs/dbraw/zinc/97/41/64/393974164.db2.gz HDZNVTMTGSJOMA-UHFFFAOYSA-N -1 3 266.728 2.974 20 10 CFCDHM CC[C@@H](N[C@H](C)c1ncnn1C)c1ccc(C)cc1[O-] ZINC000280119698 394070449 /nfs/dbraw/zinc/07/04/49/394070449.db2.gz OFAPJBKVHRGXFP-DGCLKSJQSA-N -1 3 274.368 2.631 20 10 CFCDHM CC[C@H](c1ccccc1[O-])N1CCOCC(F)(F)C1 ZINC000367684860 267108501 /nfs/dbraw/zinc/10/85/01/267108501.db2.gz ITZVVIYEZWIVQZ-GFCCVEGCSA-N -1 3 271.307 2.811 20 10 CFCDHM [O-]c1ccc2ccccc2c1CN1CCn2cncc2C1 ZINC000367940750 267129755 /nfs/dbraw/zinc/12/97/55/267129755.db2.gz DQTNRYAPVLDULI-UHFFFAOYSA-N -1 3 279.343 2.758 20 10 CFCDHM C[C@H]1CCOCCN1Cc1cc(Cl)ccc1[O-] ZINC000368595709 267189823 /nfs/dbraw/zinc/18/98/23/267189823.db2.gz YDVFWEUYWAEAKX-JTQLQIEISA-N -1 3 255.745 2.656 20 10 CFCDHM C[C@H](N[C@H]1c2ccccc2C[C@H]1O)c1ccc(F)cc1[O-] ZINC000248499024 279555339 /nfs/dbraw/zinc/55/53/39/279555339.db2.gz MLUSSKOYHZEIFV-HKJPBSJPSA-N -1 3 287.334 2.840 20 10 CFCDHM C[C@@H]1CN(C(=O)/C=C/c2cncc([O-])c2)c2ccccc2O1 ZINC000492435236 332397422 /nfs/dbraw/zinc/39/74/22/332397422.db2.gz FHRSDZQXRBWJMJ-NNNHXZLVSA-N -1 3 296.326 2.615 20 10 CFCDHM C[C@H]1[C@@H](C2CC2)[C@H]1C(=O)NCc1ccc2cccnc2c1[O-] ZINC000529501709 333491248 /nfs/dbraw/zinc/49/12/48/333491248.db2.gz NMRFEYOCHMAVMJ-LKTVYLICSA-N -1 3 296.370 2.849 20 10 CFCDHM CCOCCN(CC)Cc1c([O-])cccc1Cl ZINC000156022552 519909870 /nfs/dbraw/zinc/90/98/70/519909870.db2.gz HHHTWIRKFVRTEN-UHFFFAOYSA-N -1 3 257.761 2.904 20 10 CFCDHM CC(=O)c1cc(F)cc(CN(C)Cc2ccccn2)c1[O-] ZINC000050134230 518285258 /nfs/dbraw/zinc/28/52/58/518285258.db2.gz KEGYAXRUYLVDNG-UHFFFAOYSA-N -1 3 288.322 2.761 20 10 CFCDHM CC(=O)c1cc(F)cc(CN2C[C@@H](C)[C@H]2C)c1[O-] ZINC000293369272 518287700 /nfs/dbraw/zinc/28/77/00/518287700.db2.gz JBHWCPOFBNGCJC-RKDXNWHRSA-N -1 3 251.301 2.574 20 10 CFCDHM CC(C)(C)c1nnc(CNCc2ccccc2[O-])s1 ZINC000268220362 519121336 /nfs/dbraw/zinc/12/13/36/519121336.db2.gz QWRZFHQFYTVYEY-UHFFFAOYSA-N -1 3 277.393 2.831 20 10 CFCDHM CCOCCOCCN(C)Cc1c([O-])cccc1Cl ZINC000276118233 519992915 /nfs/dbraw/zinc/99/29/15/519992915.db2.gz AYVFDOKWNXWHCT-UHFFFAOYSA-N -1 3 287.787 2.531 20 10 CFCDHM CCOC[C@H]1CCN(Cc2cc(F)cc(C(C)=O)c2[O-])C1 ZINC000079497941 520180879 /nfs/dbraw/zinc/18/08/79/520180879.db2.gz PXWMZURLCZJLOP-LBPRGKRZSA-N -1 3 295.354 2.592 20 10 CFCDHM CCCOc1ccc(CN2CCO[C@@H]3CCC[C@H]32)c([O-])c1 ZINC000228144609 520351179 /nfs/dbraw/zinc/35/11/79/520351179.db2.gz SVRSWQRFROYZRO-NVXWUHKLSA-N -1 3 291.391 2.934 20 10 CFCDHM CCN(CC(C)(C)C)C(=O)c1ccc(C)c(O)c1[O-] ZINC000292209647 520394309 /nfs/dbraw/zinc/39/43/09/520394309.db2.gz YHXGFXBFIQERDT-UHFFFAOYSA-N -1 3 265.353 2.914 20 10 CFCDHM CCCN(Cc1ccccc1[O-])[C@H](CC)C(=O)OC ZINC000174375241 521691031 /nfs/dbraw/zinc/69/10/31/521691031.db2.gz SYYOTUFCSFSAKD-CYBMUJFWSA-N -1 3 265.353 2.556 20 10 CFCDHM CC[C@H](N[C@@H](C)c1ncnn1C)c1cccc(Cl)c1[O-] ZINC000287310121 522700836 /nfs/dbraw/zinc/70/08/36/522700836.db2.gz CWXNONIJBHLRPK-CABZTGNLSA-N -1 3 294.786 2.976 20 10 CFCDHM CN(CCCn1ccnc1)Cc1c([O-])cccc1Cl ZINC000290661549 522804266 /nfs/dbraw/zinc/80/42/66/522804266.db2.gz ZRTGZFGRUWYTMJ-UHFFFAOYSA-N -1 3 279.771 2.764 20 10 CFCDHM CCn1cc(CNCc2cc(Cl)c(F)cc2[O-])cn1 ZINC000293513361 523383104 /nfs/dbraw/zinc/38/31/04/523383104.db2.gz CKAOSKZHTDCLGS-UHFFFAOYSA-N -1 3 283.734 2.691 20 10 CFCDHM CCn1cc(CN[C@H](C)c2ccc(F)c(F)c2[O-])cn1 ZINC000276911109 523388286 /nfs/dbraw/zinc/38/82/86/523388286.db2.gz KTJSFLGDRJWDBE-SECBINFHSA-N -1 3 281.306 2.738 20 10 CFCDHM CO[C@H]1CN(Cc2c([O-])cccc2Cl)CC[C@H]1C ZINC000276048013 524008387 /nfs/dbraw/zinc/00/83/87/524008387.db2.gz RLYRESLYSXSGLA-YGRLFVJLSA-N -1 3 269.772 2.902 20 10 CFCDHM C[C@H](N[C@@H](C)c1ccc(F)cc1[O-])c1cnn(C)c1 ZINC000273611013 525530915 /nfs/dbraw/zinc/53/09/15/525530915.db2.gz VVGYAQHCEYXGHN-UWVGGRQHSA-N -1 3 263.316 2.677 20 10 CFCDHM Cc1cn2c(n1)CN(Cc1cc(Cl)cc(C)c1[O-])CC2 ZINC000378640890 525931252 /nfs/dbraw/zinc/93/12/52/525931252.db2.gz XVIAISDJCSNLMJ-UHFFFAOYSA-N -1 3 291.782 2.875 20 10 CFCDHM Cc1ccc(C(=O)N2CCC[C@@H]2c2ccncc2)c([O-])c1O ZINC000181836158 526102790 /nfs/dbraw/zinc/10/27/90/526102790.db2.gz LXMZGRSSPWKEGM-CQSZACIVSA-N -1 3 298.342 2.779 20 10 CFCDHM Cc1cnn([C@H]2CCN(Cc3c([O-])cccc3Cl)C2)c1 ZINC000290841480 526268311 /nfs/dbraw/zinc/26/83/11/526268311.db2.gz IIBUJNAIICZCOG-LBPRGKRZSA-N -1 3 291.782 2.998 20 10 CFCDHM [O-]c1ccccc1CN[C@H]1COc2cccc(F)c21 ZINC000363675927 526374360 /nfs/dbraw/zinc/37/43/60/526374360.db2.gz VCEGXMRJGCVXNU-LBPRGKRZSA-N -1 3 259.280 2.755 20 10 CFCDHM Cn1cncc1CNCc1cc(Cl)cc(Cl)c1[O-] ZINC000290484528 527508680 /nfs/dbraw/zinc/50/86/80/527508680.db2.gz OEBNDPMVVYWVOK-UHFFFAOYSA-N -1 3 286.162 2.722 20 10 CFCDHM O=C(c1cc([O-])cs1)N1CCOC[C@@H]1c1ccccc1 ZINC000754904942 574127595 /nfs/dbraw/zinc/12/75/95/574127595.db2.gz BYGOYMDWTLRKQP-CYBMUJFWSA-N -1 3 289.356 2.667 20 10 CFCDHM Cc1cccc(OCCCNC(=O)c2cc([O-])cs2)c1 ZINC000731865120 574131515 /nfs/dbraw/zinc/13/15/15/574131515.db2.gz FQPACHJTCZFALX-UHFFFAOYSA-N -1 3 291.372 2.961 20 10 CFCDHM O=C(NCC1(c2ccccc2)CC1)c1cc([O-])cs1 ZINC000731866516 574132034 /nfs/dbraw/zinc/13/20/34/574132034.db2.gz JXFRNRRJAVQAAR-UHFFFAOYSA-N -1 3 273.357 2.915 20 10 CFCDHM O=C(c1cc([O-])cs1)N(Cc1cccnc1)C1CC1 ZINC000731867039 574132130 /nfs/dbraw/zinc/13/21/30/574132130.db2.gz BHRSSLKMTFIBIY-UHFFFAOYSA-N -1 3 274.345 2.654 20 10 CFCDHM Cc1ccc(C(=O)COC(=O)c2cc([O-])cs2)s1 ZINC000731911005 574133853 /nfs/dbraw/zinc/13/38/53/574133853.db2.gz YLTYHABSBNWARK-UHFFFAOYSA-N -1 3 282.342 2.863 20 10 CFCDHM O=C(N[C@@H]1CCCc2occc21)c1cc([O-])cs1 ZINC000732267480 574148301 /nfs/dbraw/zinc/14/83/01/574148301.db2.gz HAXANZOVRAKFPM-SNVBAGLBSA-N -1 3 263.318 2.854 20 10 CFCDHM CN(Cc1nc2ccccc2[nH]1)C(=O)c1cc([O-])cs1 ZINC000732267100 574148305 /nfs/dbraw/zinc/14/83/05/574148305.db2.gz UYMJSDJHOOYYSS-UHFFFAOYSA-N -1 3 287.344 2.602 20 10 CFCDHM C[C@H](c1cccnc1)N(C)C(=O)c1cc([O-])cs1 ZINC000732273401 574148770 /nfs/dbraw/zinc/14/87/70/574148770.db2.gz UVUUULJUQYQMGC-SECBINFHSA-N -1 3 262.334 2.682 20 10 CFCDHM C[C@H](c1ccccn1)N(C)C(=O)c1cc([O-])cs1 ZINC000732278096 574149439 /nfs/dbraw/zinc/14/94/39/574149439.db2.gz FYVMGKOJHOOZPZ-SECBINFHSA-N -1 3 262.334 2.682 20 10 CFCDHM CC(C)(C)c1nsc(NC(=O)c2cc([O-])cs2)n1 ZINC000732285243 574149930 /nfs/dbraw/zinc/14/99/30/574149930.db2.gz YSAVYGNSWPLUHX-UHFFFAOYSA-N -1 3 283.378 2.855 20 10 CFCDHM O=C(c1cc([O-])cs1)N1CCCC[C@H]1c1ncc[nH]1 ZINC000732280140 574150049 /nfs/dbraw/zinc/15/00/49/574150049.db2.gz ZOJXLKLPOXIABJ-JTQLQIEISA-N -1 3 277.349 2.544 20 10 CFCDHM O=C(NC[C@@H]1CCOc2ccccc21)c1cc([O-])cs1 ZINC000732289675 574150528 /nfs/dbraw/zinc/15/05/28/574150528.db2.gz BJHDNUVMNYGVMX-JTQLQIEISA-N -1 3 289.356 2.750 20 10 CFCDHM O=C(NCCCc1cccc(F)c1)c1cc([O-])cs1 ZINC000732291138 574150569 /nfs/dbraw/zinc/15/05/69/574150569.db2.gz RCMYTVQGLTZNEK-UHFFFAOYSA-N -1 3 279.336 2.955 20 10 CFCDHM C[C@H](OC(=O)c1cc([O-])cs1)c1nc(C2CC2)no1 ZINC000732353881 574152924 /nfs/dbraw/zinc/15/29/24/574152924.db2.gz CFZXNRKWPSDOEA-LURJTMIESA-N -1 3 280.305 2.632 20 10 CFCDHM O=C(COC(=O)c1cc([O-])cs1)c1ccccc1F ZINC000732354337 574153134 /nfs/dbraw/zinc/15/31/34/574153134.db2.gz JTUZKEMFFHOKJT-UHFFFAOYSA-N -1 3 280.276 2.633 20 10 CFCDHM CN1CCOc2ccc(NC(=O)c3cc([O-])cs3)cc21 ZINC000746710409 574163979 /nfs/dbraw/zinc/16/39/79/574163979.db2.gz PLYSRWGKYKWMNE-UHFFFAOYSA-N -1 3 290.344 2.535 20 10 CFCDHM Cc1nc(C(C)(C)NCc2c([O-])ccc3ccncc32)no1 ZINC000729848800 574234174 /nfs/dbraw/zinc/23/41/74/574234174.db2.gz OWCJMEMHUNJKJH-UHFFFAOYSA-N -1 3 298.346 2.657 20 10 CFCDHM Cc1noc2ncc(NC(=O)c3cc([O-])cs3)cc12 ZINC000748321315 574247298 /nfs/dbraw/zinc/24/72/98/574247298.db2.gz RUQNXANTYIDTRB-UHFFFAOYSA-N -1 3 275.289 2.551 20 10 CFCDHM C[C@H]1C[C@@H](NCc2ccon2)c2c1c(F)ccc2[O-] ZINC000756635499 574253986 /nfs/dbraw/zinc/25/39/86/574253986.db2.gz GBXJQIGDSLDTEM-GZMMTYOYSA-N -1 3 262.284 2.857 20 10 CFCDHM C[C@H](NCc1ccon1)c1ccc(Br)cc1[O-] ZINC000756637576 574254110 /nfs/dbraw/zinc/25/41/10/574254110.db2.gz NVQAXDSGUKDBOY-QMMMGPOBSA-N -1 3 297.152 2.994 20 10 CFCDHM CCn1cc(CN[C@@H](C)c2cc(F)cc(F)c2[O-])cn1 ZINC000756734098 574260009 /nfs/dbraw/zinc/26/00/09/574260009.db2.gz VHJXZXLLYKPOCI-VIFPVBQESA-N -1 3 281.306 2.738 20 10 CFCDHM C[C@H](NCc1cocn1)c1ccc(Br)cc1[O-] ZINC000756831115 574266027 /nfs/dbraw/zinc/26/60/27/574266027.db2.gz LBGGLQIHBVUXDD-QMMMGPOBSA-N -1 3 297.152 2.994 20 10 CFCDHM Cc1nonc1CN(Cc1ccco1)Cc1ccccc1[O-] ZINC000734148841 574274834 /nfs/dbraw/zinc/27/48/34/574274834.db2.gz NHJOHXXZXJSUDL-UHFFFAOYSA-N -1 3 299.330 2.879 20 10 CFCDHM O=C(c1cc([O-])cs1)N1CCC[C@H]2CCC[C@H]21 ZINC000743707415 574371161 /nfs/dbraw/zinc/37/11/61/574371161.db2.gz GMBAUAFBGSJBBT-MWLCHTKSSA-N -1 3 251.351 2.858 20 10 CFCDHM O=C(NCCc1nc2ccccc2o1)c1cc([O-])cs1 ZINC000743820375 574372872 /nfs/dbraw/zinc/37/28/72/574372872.db2.gz CPXZSEWSRHHCGJ-UHFFFAOYSA-N -1 3 288.328 2.567 20 10 CFCDHM Cc1ccc(C(=O)NCc2ccccc2Cl)c([O-])c1O ZINC000751530341 574378517 /nfs/dbraw/zinc/37/85/17/574378517.db2.gz LHNKVSRSWDHMMT-UHFFFAOYSA-N -1 3 291.734 2.990 20 10 CFCDHM Cc1ccc(C(=O)N[C@@H]2CCc3c2cccc3O)c([O-])c1O ZINC000751538513 574378809 /nfs/dbraw/zinc/37/88/09/574378809.db2.gz QSCCPUUYSZOEPA-CYBMUJFWSA-N -1 3 299.326 2.529 20 10 CFCDHM O=C(c1cc([O-])cs1)N1CCS[C@H]2CCCC[C@H]21 ZINC000752823987 574395688 /nfs/dbraw/zinc/39/56/88/574395688.db2.gz GILPJXAUKAJDQU-MNOVXSKESA-N -1 3 283.418 2.954 20 10 CFCDHM C[C@H]([NH2+]C1CCC(C(=O)[O-])CC1)c1ccccc1[O-] ZINC000086735341 597733082 /nfs/dbraw/zinc/73/30/82/597733082.db2.gz DCEUDCDGEZMMIY-UNXYVOJBSA-N -1 3 263.337 2.686 20 10 CFCDHM C[C@H]([NH2+]CCCCCC(=O)[O-])c1ccccc1[O-] ZINC000820142096 597733890 /nfs/dbraw/zinc/73/38/90/597733890.db2.gz NXJSIKVLAGMASE-NSHDSACASA-N -1 3 251.326 2.688 20 10 CFCDHM Cc1cc(Cl)cc(C[NH+]2CCC(C(=O)[O-])CC2)c1[O-] ZINC000820976675 598181460 /nfs/dbraw/zinc/18/14/60/598181460.db2.gz RNRGPMHVKKKEQT-UHFFFAOYSA-N -1 3 283.755 2.651 20 10 CFCDHM [O-]c1cccc(F)c1CNc1ccnc(C2CC2)n1 ZINC000895833430 619619853 /nfs/dbraw/zinc/61/98/53/619619853.db2.gz XBNQUIMKBLTXAO-UHFFFAOYSA-N -1 3 259.284 2.811 20 10 CFCDHM COC(=O)c1cc(CNCc2c([O-])cccc2F)oc1C ZINC000896641465 619782245 /nfs/dbraw/zinc/78/22/45/619782245.db2.gz RTKLHMQZIKWVBL-UHFFFAOYSA-N -1 3 293.294 2.509 20 10 CFCDHM CC(C)=C(C)CC(=O)NCc1c([O-])cccc1F ZINC000928704882 619995357 /nfs/dbraw/zinc/99/53/57/619995357.db2.gz AHSLRKFTLGYXRN-UHFFFAOYSA-N -1 3 251.301 2.894 20 10 CFCDHM CC(C)C[C@@H](C)C(=O)NCc1c([O-])cccc1F ZINC000928707180 619996003 /nfs/dbraw/zinc/99/60/03/619996003.db2.gz BTTDYWZXJYLXHZ-SNVBAGLBSA-N -1 3 253.317 2.830 20 10 CFCDHM CCn1cnc2c1CCN(Cc1cc(Cl)ccc1[O-])C2 ZINC000897336695 619999913 /nfs/dbraw/zinc/99/99/13/619999913.db2.gz LRIIBACXSDWDSQ-UHFFFAOYSA-N -1 3 291.782 2.820 20 10 CFCDHM C[C@@H]1[C@H](O)CCN1Cc1cc(Cl)cc(Cl)c1[O-] ZINC000825103736 623630011 /nfs/dbraw/zinc/63/00/11/623630011.db2.gz HHIWTIOBTFQEDL-RDDDGLTNSA-N -1 3 276.163 2.654 20 10 CFCDHM COC(=O)[C@H](CC1CC1)NCc1cc(Cl)c(C)cc1[O-] ZINC000826120285 623795883 /nfs/dbraw/zinc/79/58/83/623795883.db2.gz BDKAHPFZFVESNM-ZDUSSCGKSA-N -1 3 297.782 2.785 20 10 CFCDHM C[C@H]1CN(Cc2c([O-])ccc(Cl)c2F)C[C@]1(C)CO ZINC000827691831 624065562 /nfs/dbraw/zinc/06/55/62/624065562.db2.gz CIGACNZXRAYBHV-LKFCYVNXSA-N -1 3 287.762 2.635 20 10 CFCDHM Cc1nc(CN(C)Cc2cc(Cl)c(C)cc2[O-])no1 ZINC000827898872 624122899 /nfs/dbraw/zinc/12/28/99/624122899.db2.gz VFCIMDDYUBUNEL-UHFFFAOYSA-N -1 3 281.743 2.677 20 10 CFCDHM CCn1nccc1CNCc1cc(Cl)cc(F)c1[O-] ZINC000827955208 624138259 /nfs/dbraw/zinc/13/82/59/624138259.db2.gz BFEHDFQUAPMAJF-UHFFFAOYSA-N -1 3 283.734 2.691 20 10 CFCDHM C[C@@H]1CCC[C@@H]1NC(=O)NCc1c([O-])cccc1F ZINC000917025356 624300649 /nfs/dbraw/zinc/30/06/49/624300649.db2.gz UOIDKXILSLSKLR-SKDRFNHKSA-N -1 3 266.316 2.519 20 10 CFCDHM CC(C)[C@@H]1C[C@H](C(=O)NCc2c([O-])cccc2F)CCO1 ZINC000830179918 624658564 /nfs/dbraw/zinc/65/85/64/624658564.db2.gz DROQFKJVZIRITG-ABAIWWIYSA-N -1 3 295.354 2.599 20 10 CFCDHM CS[C@H]1CC[C@@H](NC(=O)NCc2c([O-])cccc2F)C1 ZINC000920686906 624750839 /nfs/dbraw/zinc/75/08/39/624750839.db2.gz ODEZYXZVKJAJIX-ZJUUUORDSA-N -1 3 298.383 2.615 20 10 CFCDHM CS[C@H]1CC[C@H](NC(=O)NCc2c([O-])cccc2F)C1 ZINC000920686904 624750863 /nfs/dbraw/zinc/75/08/63/624750863.db2.gz ODEZYXZVKJAJIX-UWVGGRQHSA-N -1 3 298.383 2.615 20 10 CFCDHM O=C(NCCC1CCC1)NCc1c([O-])cccc1F ZINC000921401450 624869261 /nfs/dbraw/zinc/86/92/61/624869261.db2.gz XZLXAAOUNOOBML-UHFFFAOYSA-N -1 3 266.316 2.521 20 10 CFCDHM O=C(NCc1c([O-])cccc1F)N[C@@H]1CCC(F)(F)C1 ZINC000921510602 625839801 /nfs/dbraw/zinc/83/98/01/625839801.db2.gz YZTKNEGYNODCQM-MRVPVSSYSA-N -1 3 288.269 2.518 20 10 CFCDHM C[C@@H](NC(=O)NCc1c([O-])cccc1F)C1CCC1 ZINC000921655206 626049826 /nfs/dbraw/zinc/04/98/26/626049826.db2.gz PWHUKERPUYPBAA-SECBINFHSA-N -1 3 266.316 2.519 20 10 CFCDHM CC(C)OCCCCNC(=O)NCc1c([O-])cccc1F ZINC000921900856 626175086 /nfs/dbraw/zinc/17/50/86/626175086.db2.gz LFYWQIRNECZLFD-UHFFFAOYSA-N -1 3 298.358 2.536 20 10 CFCDHM O=C(NCc1c([O-])cccc1F)NC[C@@H]1CCCCS1 ZINC000921905014 626175907 /nfs/dbraw/zinc/17/59/07/626175907.db2.gz JYGBTRHBLKHFEW-JTQLQIEISA-N -1 3 298.383 2.616 20 10 CFCDHM CC(C)[C@@]1(C)C[C@H]1NC(=O)NCc1c([O-])cccc1F ZINC000922849506 626381452 /nfs/dbraw/zinc/38/14/52/626381452.db2.gz KWTFQTXDBVJUNN-UKRRQHHQSA-N -1 3 280.343 2.765 20 10 CFCDHM O=C(c1cccc(O)c1[O-])N(Cc1ccccc1)C1CC1 ZINC000186863835 626401479 /nfs/dbraw/zinc/40/14/79/626401479.db2.gz NKYLLEUSHJDGDL-UHFFFAOYSA-N -1 3 283.327 2.903 20 10 CFCDHM C[C@@H](CNC(=O)NCc1c([O-])cccc1F)CC(F)F ZINC000923022843 626443158 /nfs/dbraw/zinc/44/31/58/626443158.db2.gz FAEYCGMOOXNLKE-MRVPVSSYSA-N -1 3 290.285 2.622 20 10 CFCDHM CCC[C@H](CNC(=O)NCc1c([O-])cccc1F)OCC ZINC000923395833 626470519 /nfs/dbraw/zinc/47/05/19/626470519.db2.gz PQXRTNQEYMODGR-LLVKDONJSA-N -1 3 298.358 2.536 20 10 CFCDHM O=C(NC1CCC(C(F)F)CC1)c1cccc(O)c1[O-] ZINC000838103284 626486070 /nfs/dbraw/zinc/48/60/70/626486070.db2.gz LEACDIALFQYNAN-UHFFFAOYSA-N -1 3 285.290 2.652 20 10 CFCDHM CCC1(c2ccccc2)CN(C(=O)c2cccc(O)c2[O-])C1 ZINC000838188441 626489317 /nfs/dbraw/zinc/48/93/17/626489317.db2.gz HUNBWESJXNBOLP-UHFFFAOYSA-N -1 3 297.354 2.902 20 10 CFCDHM [O-]c1c(F)cc(Cl)cc1CN1CC2(C1)CCCOC2 ZINC000839139051 626528274 /nfs/dbraw/zinc/52/82/74/626528274.db2.gz XDIWPBKJLDQNOQ-UHFFFAOYSA-N -1 3 285.746 2.797 20 10 CFCDHM CCn1cc(CN(C)Cc2c([O-])cccc2Cl)cn1 ZINC000769428507 627437877 /nfs/dbraw/zinc/43/78/77/627437877.db2.gz SQDQWWOUFMLFIL-UHFFFAOYSA-N -1 3 279.771 2.894 20 10 CFCDHM CC[C@]1(O)CCN(Cc2cc(Cl)cc(C(C)=O)c2[O-])C1 ZINC000778405335 628305584 /nfs/dbraw/zinc/30/55/84/628305584.db2.gz OCLKSYYBEVANFQ-HNNXBMFYSA-N -1 3 297.782 2.595 20 10 CFCDHM COC(=O)[C@H](NCc1cc(Cl)ccc1[O-])C(C)(C)C ZINC000780894075 628502743 /nfs/dbraw/zinc/50/27/43/628502743.db2.gz WMGNSILRJAWYHP-LBPRGKRZSA-N -1 3 285.771 2.723 20 10 CFCDHM Cc1noc2ncc(NC(=O)c3ccc(C)c(O)c3[O-])cc12 ZINC000780921231 628504875 /nfs/dbraw/zinc/50/48/75/628504875.db2.gz KJWNLTBMNQPHNJ-UHFFFAOYSA-N -1 3 299.286 2.503 20 10 CFCDHM COC(=O)c1cncc(NCc2c([O-])cccc2Cl)c1 ZINC000783830760 628748673 /nfs/dbraw/zinc/74/86/73/628748673.db2.gz DFEKFKWFYIECCE-UHFFFAOYSA-N -1 3 292.722 2.839 20 10 CFCDHM O=C(c1cccc(O)c1[O-])N1CCCC2(CCCC2)C1 ZINC000783853405 628749680 /nfs/dbraw/zinc/74/96/80/628749680.db2.gz YRJKFBINKHNLCN-UHFFFAOYSA-N -1 3 275.348 2.894 20 10 CFCDHM O=C(NCc1cccc2cc[nH]c21)c1cccc(O)c1[O-] ZINC000787366915 629009417 /nfs/dbraw/zinc/00/94/17/629009417.db2.gz LXUKZDPUUAFBHX-UHFFFAOYSA-N -1 3 282.299 2.509 20 10 CFCDHM CN(C)c1ccnc(NCc2c([O-])ccc(Cl)c2F)n1 ZINC000790240863 629222551 /nfs/dbraw/zinc/22/25/51/629222551.db2.gz LANAWVGZMULOQD-UHFFFAOYSA-N -1 3 296.733 2.653 20 10 CFCDHM CC(C)Oc1ccc(NC(=O)c2cccc(O)c2[O-])cn1 ZINC000790555740 629247715 /nfs/dbraw/zinc/24/77/15/629247715.db2.gz BFKAIFFAUHIODZ-UHFFFAOYSA-N -1 3 288.303 2.532 20 10 CFCDHM CC(C)c1cccnc1NC(=O)c1cccc(O)c1[O-] ZINC000790903398 629270560 /nfs/dbraw/zinc/27/05/60/629270560.db2.gz CMTKNQKKBIROSR-UHFFFAOYSA-N -1 3 272.304 2.869 20 10 CFCDHM CC[C@@H](CC(F)(F)F)NC(=O)c1cccc(O)c1[O-] ZINC000790932264 629271983 /nfs/dbraw/zinc/27/19/83/629271983.db2.gz XHTMAPBMDNJRMM-ZETCQYMHSA-N -1 3 277.242 2.559 20 10 CFCDHM CO[N-]C(=O)Cc1cc(C)n(-c2ccc(Cl)cc2)c1C ZINC000790938247 629272750 /nfs/dbraw/zinc/27/27/50/629272750.db2.gz SITKSIHJXFJQSC-UHFFFAOYSA-N -1 3 292.766 2.968 20 10 CFCDHM CCc1cc(CNCc2c([O-])ccc(Cl)c2F)n[nH]1 ZINC000790965618 629274500 /nfs/dbraw/zinc/27/45/00/629274500.db2.gz UNLCVJDRMJZVMR-UHFFFAOYSA-N -1 3 283.734 2.760 20 10 CFCDHM CCc1cc(CNCc2c([O-])ccc(Cl)c2F)[nH]n1 ZINC000790965618 629274501 /nfs/dbraw/zinc/27/45/01/629274501.db2.gz UNLCVJDRMJZVMR-UHFFFAOYSA-N -1 3 283.734 2.760 20 10 CFCDHM Cc1cc(CNCc2c([O-])ccc(Cl)c2F)ncn1 ZINC000790981193 629276936 /nfs/dbraw/zinc/27/69/36/629276936.db2.gz TUHCUGQJRRQPTG-UHFFFAOYSA-N -1 3 281.718 2.573 20 10 CFCDHM C[C@@H]1[C@H](C)N(C)CCN1Cc1c([O-])ccc(Cl)c1F ZINC000792173774 629405651 /nfs/dbraw/zinc/40/56/51/629405651.db2.gz CDLHPZMERNMUFA-VHSXEESVSA-N -1 3 286.778 2.709 20 10 CFCDHM C[C@H]1[C@@H](C(F)(F)F)CCN1C(=O)c1cccc(O)c1[O-] ZINC000792537518 629432002 /nfs/dbraw/zinc/43/20/02/629432002.db2.gz IQIDBRILHRLOND-CBAPKCEASA-N -1 3 289.253 2.511 20 10 CFCDHM [O-]c1c(F)cc(Cl)cc1CN1CC([C@@H]2CCOC2)C1 ZINC000793254885 629514878 /nfs/dbraw/zinc/51/48/78/629514878.db2.gz MADQEYYZHIIYGS-SECBINFHSA-N -1 3 285.746 2.653 20 10 CFCDHM Cc1cc(CNCc2cc(Cl)cc(F)c2[O-])n(C)n1 ZINC000793604861 629578182 /nfs/dbraw/zinc/57/81/82/629578182.db2.gz CIVGWIUYWLQKPO-UHFFFAOYSA-N -1 3 283.734 2.516 20 10 CFCDHM CC(=O)c1cc(Cl)cc(CN2CCC[C@@H]2[C@H](C)O)c1[O-] ZINC000852560181 634779628 /nfs/dbraw/zinc/77/96/28/634779628.db2.gz PUVNEDKUISFGGG-IINYFYTJSA-N -1 3 297.782 2.593 20 10 CFCDHM O=C(NCCc1cccc2[nH]ccc21)c1cccc(O)c1[O-] ZINC000800643123 630399459 /nfs/dbraw/zinc/39/94/59/630399459.db2.gz VQAVSYHKVBWEEA-UHFFFAOYSA-N -1 3 296.326 2.552 20 10 CFCDHM CC1CN(Cc2cccc(Br)c2[O-])C1 ZINC000802651643 630535149 /nfs/dbraw/zinc/53/51/49/630535149.db2.gz VAKKKSSEMWRQFO-UHFFFAOYSA-N -1 3 256.143 2.606 20 10 CFCDHM O=C(c1cccc(O)c1[O-])N1CCc2cc(Cl)ccc21 ZINC000804346945 630674357 /nfs/dbraw/zinc/67/43/57/630674357.db2.gz YXGMXBWRSJPBKP-UHFFFAOYSA-N -1 3 289.718 2.954 20 10 CFCDHM O=C(Nc1nc(-c2ccccc2)c[nH]1)c1cccc(O)c1[O-] ZINC000807193792 630866642 /nfs/dbraw/zinc/86/66/42/630866642.db2.gz IABIPGYFMXDAAA-UHFFFAOYSA-N -1 3 295.298 2.740 20 10 CFCDHM Cc1cc([O-])c(CN(C)C[C@H](O)C(F)(F)F)c(Cl)c1 ZINC000840948856 631276369 /nfs/dbraw/zinc/27/63/69/631276369.db2.gz LRQFLFWRBNKFBA-NSHDSACASA-N -1 3 297.704 2.709 20 10 CFCDHM CCOC1CN(Cc2c([O-])cc(C)cc2Cl)C1 ZINC000840953735 631281648 /nfs/dbraw/zinc/28/16/48/631281648.db2.gz XXCMNSAGSIZLGL-UHFFFAOYSA-N -1 3 255.745 2.575 20 10 CFCDHM CCN(Cc1c([O-])ccc(Cl)c1F)[C@@H]1CCOC1 ZINC000812780510 631772855 /nfs/dbraw/zinc/77/28/55/631772855.db2.gz GVZFWAKBVJXEIY-SECBINFHSA-N -1 3 273.735 2.796 20 10 CFCDHM COC(=O)[C@@H](CC(C)(C)C)NCc1cc(F)ccc1[O-] ZINC000843424039 631953624 /nfs/dbraw/zinc/95/36/24/631953624.db2.gz UBOYKJSDHGVYPW-GFCCVEGCSA-N -1 3 283.343 2.599 20 10 CFCDHM CCN(CC(=O)OC)Cc1ccc2ccccc2c1[O-] ZINC000816503013 632472537 /nfs/dbraw/zinc/47/25/37/632472537.db2.gz ZYLSYJSVQJLAND-UHFFFAOYSA-N -1 3 273.332 2.540 20 10 CFCDHM [O-]c1cc(F)c(Cl)cc1CN1CCN(C2CCC2)CC1 ZINC000816511419 632474835 /nfs/dbraw/zinc/47/48/35/632474835.db2.gz XEMJDGHVVRGZRK-UHFFFAOYSA-N -1 3 298.789 2.855 20 10 CFCDHM COc1ncccc1CNCc1cc(Cl)c(F)cc1[O-] ZINC000816534228 632479412 /nfs/dbraw/zinc/47/94/12/632479412.db2.gz BGVWPNNHBJEUNH-UHFFFAOYSA-N -1 3 296.729 2.878 20 10 CFCDHM C[C@@H]1CN(Cc2cc(Cl)c(F)cc2[O-])[C@H](C)CN1C ZINC000816571418 632487869 /nfs/dbraw/zinc/48/78/69/632487869.db2.gz CYFWUUIFKBQGMM-NXEZZACHSA-N -1 3 286.778 2.709 20 10 CFCDHM C[C@@H]1CN(Cc2cc(Cl)c(F)cc2[O-])C[C@H](C)N1C ZINC000816653048 632505189 /nfs/dbraw/zinc/50/51/89/632505189.db2.gz DCXYYTISNQKONY-AOOOYVTPSA-N -1 3 286.778 2.709 20 10 CFCDHM CC[C@@H]1CN(C)CCN1Cc1cc(Cl)c(F)cc1[O-] ZINC000816660944 632507823 /nfs/dbraw/zinc/50/78/23/632507823.db2.gz VSXSIZPKJIYCNL-LLVKDONJSA-N -1 3 286.778 2.711 20 10 CFCDHM [O-]c1c(Cl)cccc1CN1C[C@H]2[C@@H](C1)C2(F)F ZINC000846111915 632635344 /nfs/dbraw/zinc/63/53/44/632635344.db2.gz OJWPFUKCTKBVPP-DTORHVGOSA-N -1 3 259.683 2.743 20 10 CFCDHM C[C@@H]1CCN(Cc2cc(Cl)cc(F)c2[O-])C[C@@H]1CO ZINC000857061558 635922263 /nfs/dbraw/zinc/92/22/63/635922263.db2.gz RYJJRPYCEYLHMU-MWLCHTKSSA-N -1 3 287.762 2.635 20 10 CFCDHM Cc1cc([O-])c([C@@H]2NC(=O)[C@@H]3C[C@H](C)CCN23)cc1Cl ZINC000849183457 633580368 /nfs/dbraw/zinc/58/03/68/633580368.db2.gz TVBGQPRACAOPQY-CWONEXCFSA-N -1 3 294.782 2.583 20 10 CFCDHM O=C(Nc1cncc2c1CCCC2)c1cccc(O)c1[O-] ZINC000855201353 635483221 /nfs/dbraw/zinc/48/32/21/635483221.db2.gz NPBHHFGBBKCLLI-UHFFFAOYSA-N -1 3 284.315 2.624 20 10 CFCDHM Cc1ccc(CC2CN(C(=O)c3cccc(O)c3[O-])C2)cc1 ZINC000855865223 635676710 /nfs/dbraw/zinc/67/67/10/635676710.db2.gz ZWXLFSXFLQGJFT-UHFFFAOYSA-N -1 3 297.354 2.721 20 10 CFCDHM O=C(NCc1cc(Cl)ccc1O)c1ccccc1[O-] ZINC000857547737 635983271 /nfs/dbraw/zinc/98/32/71/635983271.db2.gz RNFAVEKNPLWAFK-UHFFFAOYSA-N -1 3 277.707 2.681 20 10 CFCDHM C[C@@H](c1ccccc1)N(C)C(=O)c1cccc(O)c1[O-] ZINC000188089301 650314598 /nfs/dbraw/zinc/31/45/98/650314598.db2.gz MFNGPOCTICCVSR-NSHDSACASA-N -1 3 271.316 2.931 20 10 CFCDHM [O-]c1cc(Br)ccc1CN1CC2(C1)CCCO2 ZINC000862484534 637399507 /nfs/dbraw/zinc/39/95/07/637399507.db2.gz TWNWEFATVNDIPK-UHFFFAOYSA-N -1 3 298.180 2.520 20 10 CFCDHM Cc1ccc(C(=O)Nc2ccc(O)cc2F)c([O-])c1O ZINC000119428306 637640584 /nfs/dbraw/zinc/64/05/84/637640584.db2.gz FPXFYPBMQJJFEV-UHFFFAOYSA-N -1 3 277.251 2.503 20 10 CFCDHM Cc1ccc(C(=O)Nc2nc(C(C)C)ns2)c([O-])c1O ZINC000874696304 642457822 /nfs/dbraw/zinc/45/78/22/642457822.db2.gz WAXRQDHOSUVXHQ-UHFFFAOYSA-N -1 3 293.348 2.633 20 10 CFCDHM CC[C@@H]1CN(Cc2ccc(F)c(F)c2[O-])CCS1 ZINC000876747394 642991897 /nfs/dbraw/zinc/99/18/97/642991897.db2.gz BYNZAGJWVVBCSY-SNVBAGLBSA-N -1 3 273.348 2.998 20 10 CFCDHM O=C(NCCC1CCCCC1)c1cccc(O)c1[O-] ZINC000126274857 643088719 /nfs/dbraw/zinc/08/87/19/643088719.db2.gz GWNPLRZLGWUATB-UHFFFAOYSA-N -1 3 263.337 2.798 20 10 CFCDHM CCc1ccccc1CNC(=O)c1cccc(O)c1[O-] ZINC000126447574 643226490 /nfs/dbraw/zinc/22/64/90/643226490.db2.gz DPAVVUJVDRYPKW-UHFFFAOYSA-N -1 3 271.316 2.590 20 10 CFCDHM CC(C)n1ncnc1CNCc1cc(Cl)ccc1[O-] ZINC000877612100 643399635 /nfs/dbraw/zinc/39/96/35/643399635.db2.gz CPAYKGTXPAHZKA-UHFFFAOYSA-N -1 3 280.759 2.508 20 10 CFCDHM C[C@@H](NCc1cc(Cl)cc(F)c1[O-])c1ccnn1C ZINC000877762157 643541507 /nfs/dbraw/zinc/54/15/07/643541507.db2.gz AQZYVIOICOQCQJ-MRVPVSSYSA-N -1 3 283.734 2.769 20 10 CFCDHM CCn1ccnc1[C@H](C)NCc1cc(F)cc(F)c1[O-] ZINC000883135992 645621381 /nfs/dbraw/zinc/62/13/81/645621381.db2.gz RMDQHWQCHNFUCM-VIFPVBQESA-N -1 3 281.306 2.738 20 10 CFCDHM CC1(C)CN(Cc2c([O-])cccc2Cl)CCO1 ZINC000132307300 645905630 /nfs/dbraw/zinc/90/56/30/645905630.db2.gz NCEREFNIFICSJG-UHFFFAOYSA-N -1 3 255.745 2.656 20 10 CFCDHM CCn1ccnc1CN[C@H](C)c1c([O-])cccc1F ZINC000886617220 647070200 /nfs/dbraw/zinc/07/02/00/647070200.db2.gz GZGWMPFYCGQBIE-SNVBAGLBSA-N -1 3 263.316 2.599 20 10 CFCDHM CC/C(C)=C(\C)C(=O)NCc1c([O-])cccc1F ZINC000928709004 648942499 /nfs/dbraw/zinc/94/24/99/648942499.db2.gz VFWCZROSIJIGEB-MDZDMXLPSA-N -1 3 251.301 2.894 20 10 CFCDHM O=C(C[C@@H]1CC[C@H]2C[C@H]21)NCc1c([O-])cccc1F ZINC000928705592 648944849 /nfs/dbraw/zinc/94/48/49/648944849.db2.gz KDPMTWDSCUPYRZ-GARJFASQSA-N -1 3 263.312 2.584 20 10 CFCDHM C[C@@H]1CCC[C@@]1(C)C(=O)NCc1c([O-])cccc1F ZINC000928706007 648944926 /nfs/dbraw/zinc/94/49/26/648944926.db2.gz NKQJOOXLGMGUSK-MEBBXXQBSA-N -1 3 265.328 2.974 20 10 CFCDHM CC(=O)CC(C)(C)CC(=O)NCc1c([O-])cccc1F ZINC000928707469 648945403 /nfs/dbraw/zinc/94/54/03/648945403.db2.gz FDARTYROIXIVFU-UHFFFAOYSA-N -1 3 281.327 2.543 20 10 CFCDHM CCO[C@H](C(=O)NCc1c([O-])cccc1F)C1CCCC1 ZINC000928709488 648945941 /nfs/dbraw/zinc/94/59/41/648945941.db2.gz ISNJQIAYSAZAJT-HNNXBMFYSA-N -1 3 295.354 2.743 20 10 CFCDHM CC(C)[C@H]1COCCN1Cc1ccc(Cl)cc1[O-] ZINC001140464547 770679914 /nfs/dbraw/zinc/67/99/14/770679914.db2.gz UJJXPKUMLFGTDN-CYBMUJFWSA-N -1 3 269.772 2.902 20 10 CFCDHM O=C([O-])c1ccc(C[N@H+]2C[C@H]3CC[C@@H](C2)C3(F)F)c([O-])c1 ZINC001231449146 777220550 /nfs/dbraw/zinc/22/05/50/777220550.db2.gz FNZQMWBBEBMZFT-TXEJJXNPSA-N -1 3 297.301 2.568 20 10 CFCDHM O=C([O-])c1ccc(C[N@@H+]2C[C@H]3CC[C@@H](C2)C3(F)F)c([O-])c1 ZINC001231449146 777220556 /nfs/dbraw/zinc/22/05/56/777220556.db2.gz FNZQMWBBEBMZFT-TXEJJXNPSA-N -1 3 297.301 2.568 20 10 CFCDHM O=C([O-])c1ccc(C[N@@H+]2CCC23CCCCC3)c([O-])c1 ZINC001231450581 777224174 /nfs/dbraw/zinc/22/41/74/777224174.db2.gz SXIXIWVGPKJMQS-UHFFFAOYSA-N -1 3 275.348 2.999 20 10 CFCDHM O=C([O-])c1ccc(C[N@H+]2CCC23CCCCC3)c([O-])c1 ZINC001231450581 777224182 /nfs/dbraw/zinc/22/41/82/777224182.db2.gz SXIXIWVGPKJMQS-UHFFFAOYSA-N -1 3 275.348 2.999 20 10 CFCDHM O=C([O-])c1ccc([O-])c(C[N@@H+]2CCC23CCCC3)c1 ZINC001231560594 777259279 /nfs/dbraw/zinc/25/92/79/777259279.db2.gz KQHWEAAFPOXHLW-UHFFFAOYSA-N -1 3 261.321 2.609 20 10 CFCDHM O=C([O-])c1ccc([O-])c(C[N@H+]2CCC23CCCC3)c1 ZINC001231560594 777259285 /nfs/dbraw/zinc/25/92/85/777259285.db2.gz KQHWEAAFPOXHLW-UHFFFAOYSA-N -1 3 261.321 2.609 20 10 CFCDHM O=C([O-])c1ccc([O-])c(C[NH+]2C3CCCC2CCC3)c1 ZINC001231565955 777261380 /nfs/dbraw/zinc/26/13/80/777261380.db2.gz FNBHCAJXOOYMQH-UHFFFAOYSA-N -1 3 275.348 2.997 20 10 CFCDHM O=C1CCN(Cc2c([O-])ccc3ccccc32)CC1(F)F ZINC001231590161 777269176 /nfs/dbraw/zinc/26/91/76/777269176.db2.gz NUOCSAZQVZMBHI-UHFFFAOYSA-N -1 3 291.297 2.956 20 10 CFCDHM Cc1cc([O-])c(CN2CCCC(=O)[C@H](F)C2)cc1Cl ZINC001231867229 777357479 /nfs/dbraw/zinc/35/74/79/777357479.db2.gz IXGROHZPKBQPQW-GFCCVEGCSA-N -1 3 285.746 2.857 20 10 CFCDHM C[C@H]1CN(Cc2cc(Cl)c([O-])cc2O)CCCC1=O ZINC001232260889 777496285 /nfs/dbraw/zinc/49/62/85/777496285.db2.gz SIDUBRLHMYSLQO-VIFPVBQESA-N -1 3 283.755 2.552 20 10 CFCDHM [O-]c1cc(O)c(CN2CCC[C@@H](F)C2)cc1Cl ZINC001232261380 777496434 /nfs/dbraw/zinc/49/64/34/777496434.db2.gz FTJICKMTHREABQ-SECBINFHSA-N -1 3 259.708 2.685 20 10 CFCDHM [O-]c1cc(O)c(CN2CCc3ncccc3C2)cc1Cl ZINC001232267030 777499805 /nfs/dbraw/zinc/49/98/05/777499805.db2.gz HSBCXHIUFAWNAH-UHFFFAOYSA-N -1 3 290.750 2.705 20 10 CFCDHM COc1cc([O-])c(CN2CC3(CSC3)C2)cc1Cl ZINC001232270521 777501787 /nfs/dbraw/zinc/50/17/87/777501787.db2.gz CTLDANNOXSNOAC-UHFFFAOYSA-N -1 3 285.796 2.603 20 10 CFCDHM CC(C)O[C@@H]1CCN(Cc2c([O-])ccc(F)c2F)C1 ZINC001233335780 777897890 /nfs/dbraw/zinc/89/78/90/777897890.db2.gz LCVJHHDGOFPFON-SNVBAGLBSA-N -1 3 271.307 2.670 20 10 CFCDHM CN(CCF)Cc1cccc(C(F)(F)F)c1[O-] ZINC001233419891 777945952 /nfs/dbraw/zinc/94/59/52/777945952.db2.gz QNMIAVOPVWDDII-UHFFFAOYSA-N -1 3 251.223 2.812 20 10 CFCDHM CO[C@@H](C)C1CN(Cc2cccc(C(F)(F)F)c2[O-])C1 ZINC001233418937 777944116 /nfs/dbraw/zinc/94/41/16/777944116.db2.gz CFOWUHPPKDQVKY-VIFPVBQESA-N -1 3 289.297 2.878 20 10 CFCDHM O=C1CCCN(Cc2ccc(C(F)(F)F)cc2[O-])C1 ZINC001233454209 777959838 /nfs/dbraw/zinc/95/98/38/777959838.db2.gz LDWLWHBODDNOLO-UHFFFAOYSA-N -1 3 273.254 2.576 20 10 CFCDHM O=C(NCc1cc(Cl)c2cccnc2c1[O-])C1CC1 ZINC001142680447 778673645 /nfs/dbraw/zinc/67/36/45/778673645.db2.gz DIFRGEYSOTVOGJ-UHFFFAOYSA-N -1 3 276.723 2.620 20 10 CFCDHM C[C@H]1CN(Cc2cc(Cl)c(Cl)cc2[O-])CC[C@@H]1O ZINC001236794056 778938402 /nfs/dbraw/zinc/93/84/02/778938402.db2.gz ORBCUIZVDVBHNZ-UFBFGSQYSA-N -1 3 290.190 2.902 20 10 CFCDHM [O-]c1cc(Cl)c(Cl)cc1CN1CC(C2COC2)C1 ZINC001236792132 778939560 /nfs/dbraw/zinc/93/95/60/778939560.db2.gz CDJPZSKQLBHZOH-UHFFFAOYSA-N -1 3 288.174 2.777 20 10 CFCDHM COc1cc([O-])c(CN2C[C@@H]3C[C@@H]3[C@H](F)C2)c(Cl)c1 ZINC001236796067 778940344 /nfs/dbraw/zinc/94/03/44/778940344.db2.gz QRUQEMUQDALJNL-GMOODISLSA-N -1 3 285.746 2.844 20 10 CFCDHM COc1cc([O-])c(CN2CCOC[C@H]2C(C)C)c(Cl)c1 ZINC001236801267 778943790 /nfs/dbraw/zinc/94/37/90/778943790.db2.gz DIYQTTIIBSJJPR-AWEZNQCLSA-N -1 3 299.798 2.911 20 10 CFCDHM COc1cc([O-])c(CN2CC[C@@H]2C)c(Br)c1 ZINC001237066429 779003067 /nfs/dbraw/zinc/00/30/67/779003067.db2.gz VMRIOMSKOOSBDW-QMMMGPOBSA-N -1 3 286.169 2.758 20 10 CFCDHM [O-]c1ccc(Cl)c(Cl)c1CN1CCCOCC1 ZINC001237077127 779005169 /nfs/dbraw/zinc/00/51/69/779005169.db2.gz DBGKCILUYRZGCU-UHFFFAOYSA-N -1 3 276.163 2.921 20 10 CFCDHM [O-]c1ccc(Cl)c(Cl)c1CN1CCC(O)CC1 ZINC001237078379 779007248 /nfs/dbraw/zinc/00/72/48/779007248.db2.gz QMXYURCYFIHUKO-UHFFFAOYSA-N -1 3 276.163 2.656 20 10 CFCDHM [O-]c1ccc(Cl)c(Cl)c1CN1CCC[C@H](CO)C1 ZINC001237078103 779007619 /nfs/dbraw/zinc/00/76/19/779007619.db2.gz NSUGBNGRSJUFIK-VIFPVBQESA-N -1 3 290.190 2.903 20 10 CFCDHM Cc1cc([O-])c(CN2CCC(=O)CC2)cc1Br ZINC001237677904 779159443 /nfs/dbraw/zinc/15/94/43/779159443.db2.gz RUBMHQHWKUHMBO-UHFFFAOYSA-N -1 3 298.180 2.628 20 10 CFCDHM [O-]c1c(Cl)cc(F)cc1CN1CC[C@@]2(CCCO2)C1 ZINC001237800693 779182423 /nfs/dbraw/zinc/18/24/23/779182423.db2.gz AOXKLWZZPQBIGK-AWEZNQCLSA-N -1 3 285.746 2.940 20 10 CFCDHM CCN1CCN(Cc2cc(F)cc(Cl)c2[O-])C[C@H]1C ZINC001237799462 779182433 /nfs/dbraw/zinc/18/24/33/779182433.db2.gz BNFHLLFNBTXJAM-SNVBAGLBSA-N -1 3 286.778 2.711 20 10 CFCDHM CCO[C@@H]1CCN(Cc2cc(F)cc(Cl)c2[O-])C1 ZINC001237805803 779183651 /nfs/dbraw/zinc/18/36/51/779183651.db2.gz OIKWFIUECMRYSQ-LLVKDONJSA-N -1 3 273.735 2.796 20 10 CFCDHM C[C@@H]1CC[C@H](CO)CN1Cc1cc(F)cc(Cl)c1[O-] ZINC001237809203 779185346 /nfs/dbraw/zinc/18/53/46/779185346.db2.gz ZZKOMHMKXUBYKG-ZJUUUORDSA-N -1 3 287.762 2.778 20 10 CFCDHM [O-]c1cc(Cl)c(F)cc1CN1CCCC[C@@H]1CO ZINC001237946403 779215009 /nfs/dbraw/zinc/21/50/09/779215009.db2.gz LDKLRXDVCJCZHT-SNVBAGLBSA-N -1 3 273.735 2.532 20 10 CFCDHM C[C@H]1C[C@@H](O)CCN1Cc1cc(F)c(Cl)cc1[O-] ZINC001237950718 779216723 /nfs/dbraw/zinc/21/67/23/779216723.db2.gz ZKRAJXFHPOODTK-WPRPVWTQSA-N -1 3 273.735 2.530 20 10 CFCDHM COc1ccc(CN2CC3(C2)CCCOC3)c([O-])c1Cl ZINC001236800872 779639931 /nfs/dbraw/zinc/63/99/31/779639931.db2.gz ADEQXVGSFNAYEW-UHFFFAOYSA-N -1 3 297.782 2.667 20 10 CFCDHM O=C1C[C@H]2CC[C@@H](C1)N2Cc1cc(F)c(Cl)cc1[O-] ZINC001237935829 779725076 /nfs/dbraw/zinc/72/50/76/779725076.db2.gz ZNGMYQCYIYSRHY-AOOOYVTPSA-N -1 3 283.730 2.881 20 10 CFCDHM CC(C)[C@@H]1CN(Cc2ccc(F)c(F)c2[O-])CCCO1 ZINC000703609454 781038920 /nfs/dbraw/zinc/03/89/20/781038920.db2.gz JQQSFEMUPLAVKC-ZDUSSCGKSA-N -1 3 285.334 2.917 20 10 CFCDHM CC(C)[C@H]1CN(Cc2ccc(F)c(F)c2[O-])CCCO1 ZINC000703609452 781039292 /nfs/dbraw/zinc/03/92/92/781039292.db2.gz JQQSFEMUPLAVKC-CYBMUJFWSA-N -1 3 285.334 2.917 20 10 CFCDHM C[C@H](NCCF)c1ccc(Br)cc1[O-] ZINC000280925879 299295664 /nfs/dbraw/zinc/29/56/64/299295664.db2.gz DXTVEPICHXXBTG-ZETCQYMHSA-N -1 3 262.122 2.775 20 10 CFCDHM CC(C)(C)[S@](=O)CCNCc1c([O-])cccc1Cl ZINC000116920965 376216203 /nfs/dbraw/zinc/21/62/03/376216203.db2.gz ZVEIPIKDGFCLSP-SFHVURJKSA-N -1 3 289.828 2.682 20 10 CFCDHM [O-]c1ccccc1CN(Cc1ccccn1)C[C@@H]1CCCO1 ZINC000119486698 376422501 /nfs/dbraw/zinc/42/25/01/376422501.db2.gz FVPPOVRHSWWGAJ-KRWDZBQOSA-N -1 3 298.386 2.968 20 10 CFCDHM C[C@@H]1CCC[C@H](N(C)C(=O)c2cccc(O)c2[O-])C1 ZINC000126290694 377221128 /nfs/dbraw/zinc/22/11/28/377221128.db2.gz GSJSIEAUALFBBL-MNOVXSKESA-N -1 3 263.337 2.749 20 10 CFCDHM CS[C@@H]1CCC[C@H](NC(=O)c2ccc(C)c(O)c2[O-])C1 ZINC000177686776 380367352 /nfs/dbraw/zinc/36/73/52/380367352.db2.gz RZQQHLMFAGOXJQ-WDEREUQCSA-N -1 3 295.404 2.810 20 10 CFCDHM CS[C@H]1CCC[C@@H](NC(=O)c2ccc(C)c(O)c2[O-])C1 ZINC000177686745 380367963 /nfs/dbraw/zinc/36/79/63/380367963.db2.gz RZQQHLMFAGOXJQ-MNOVXSKESA-N -1 3 295.404 2.810 20 10 CFCDHM Cc1ccc(C(=O)N([C@H](C)C2CC2)C2CC2)c([O-])c1O ZINC000179457088 380545499 /nfs/dbraw/zinc/54/54/99/380545499.db2.gz MSQWGGWGURPFAD-SNVBAGLBSA-N -1 3 275.348 2.809 20 10 CFCDHM Cc1ccc(C(=O)N2CCC[C@H]3CCC[C@H]32)c([O-])c1O ZINC000179519974 380553031 /nfs/dbraw/zinc/55/30/31/380553031.db2.gz KEQPEFZCJFPVFD-DGCLKSJQSA-N -1 3 275.348 2.811 20 10 CFCDHM COC(=O)C1(N(C)Cc2ccccc2[O-])CCCCC1 ZINC000179574276 380558253 /nfs/dbraw/zinc/55/82/53/380558253.db2.gz UYVWLBOWVYHRFY-UHFFFAOYSA-N -1 3 277.364 2.700 20 10 CFCDHM COc1cccc([C@H]2CN(Cc3ccccc3[O-])CCO2)c1 ZINC000179570176 380559171 /nfs/dbraw/zinc/55/91/71/380559171.db2.gz DPPWWMKEYPPSNH-GOSISDBHSA-N -1 3 299.370 2.974 20 10 CFCDHM Cc1cc(Cl)cc(CN2CCO[C@H](C)C2)c1[O-] ZINC000179646869 380566847 /nfs/dbraw/zinc/56/68/47/380566847.db2.gz NPSHUMWIJWNSGL-SNVBAGLBSA-N -1 3 255.745 2.575 20 10 CFCDHM Cc1cc(Cl)cc(CN(C)Cc2cnccn2)c1[O-] ZINC000179886594 380591334 /nfs/dbraw/zinc/59/13/34/380591334.db2.gz DIYHXWDENURYCU-UHFFFAOYSA-N -1 3 277.755 2.776 20 10 CFCDHM Cc1ccc(C(=O)N2CCC[C@H](C)[C@H]2C)c([O-])c1O ZINC000182499761 381100954 /nfs/dbraw/zinc/10/09/54/381100954.db2.gz MZOZSMHCPARLRG-GXSJLCMTSA-N -1 3 263.337 2.667 20 10 CFCDHM C[C@H](N[C@@H](C)c1cc(Cl)ccc1[O-])C(=O)NC(C)(C)C ZINC000185217806 381566786 /nfs/dbraw/zinc/56/67/86/381566786.db2.gz GJQYZEZTJJDIGY-UWVGGRQHSA-N -1 3 298.814 2.999 20 10 CFCDHM Cc1nn(C)cc1[C@@H](C)N[C@@H](C)c1ccc(F)cc1[O-] ZINC000185349455 381607485 /nfs/dbraw/zinc/60/74/85/381607485.db2.gz LFJBXCFSVBBZIE-VHSXEESVSA-N -1 3 277.343 2.985 20 10 CFCDHM CC[C@](C)(NC(=O)c1cccc(O)c1[O-])c1nccs1 ZINC000185708309 381711818 /nfs/dbraw/zinc/71/18/18/381711818.db2.gz LHFVWONGAWVONK-AWEZNQCLSA-N -1 3 292.360 2.610 20 10 CFCDHM CC(C)OC[C@H]1CN(Cc2cc(Cl)ccc2[O-])CCO1 ZINC000372116030 381753833 /nfs/dbraw/zinc/75/38/33/381753833.db2.gz INAJYOFSLKZZDG-CQSZACIVSA-N -1 3 299.798 2.671 20 10 CFCDHM [O-]c1c(F)cccc1CN[C@@H]1COc2cccc(F)c21 ZINC000375779384 382101991 /nfs/dbraw/zinc/10/19/91/382101991.db2.gz LRPZBHYNEKFRQI-GFCCVEGCSA-N -1 3 277.270 2.894 20 10 CFCDHM CN(CCc1cnccn1)Cc1cc(Cl)c(F)cc1[O-] ZINC000293545258 382167367 /nfs/dbraw/zinc/16/73/67/382167367.db2.gz GLDFZWBMGTVNGQ-UHFFFAOYSA-N -1 3 295.745 2.649 20 10 CFCDHM CC[C@@H](c1ccccc1[O-])N1CCC[C@H]1c1nncn1C ZINC000377694993 382323165 /nfs/dbraw/zinc/32/31/65/382323165.db2.gz LKIDOLYSFLEZTL-KBPBESRZSA-N -1 3 286.379 2.809 20 10 CFCDHM [O-]c1ccc(Cl)c(F)c1CN1CC([C@@H]2CCOC2)C1 ZINC000365558261 382411772 /nfs/dbraw/zinc/41/17/72/382411772.db2.gz CIQPJJAVJUPEOK-SECBINFHSA-N -1 3 285.746 2.653 20 10 CFCDHM C[C@H]1CCN(C(=O)c2cccc(O)c2[O-])C[C@H](C)C1 ZINC000193146542 382716396 /nfs/dbraw/zinc/71/63/96/382716396.db2.gz ZPAUAKHDBGQIRF-WDEREUQCSA-N -1 3 263.337 2.606 20 10 CFCDHM [O-]c1c(Cl)cccc1CN1CCS[C@@H]2COCC[C@H]21 ZINC000245642671 383018711 /nfs/dbraw/zinc/01/87/11/383018711.db2.gz DXKBGRQLWXVTTA-CHWSQXEVSA-N -1 3 299.823 2.752 20 10 CFCDHM Cn1nccc1[C@H]1CCCCN1Cc1cc(F)ccc1[O-] ZINC000281140815 385184169 /nfs/dbraw/zinc/18/41/69/385184169.db2.gz DSLMTKVDAGKJEC-OAHLLOKOSA-N -1 3 289.354 2.992 20 10 CFCDHM CSCCCN(C)Cc1cc(F)cc(C(C)=O)c1[O-] ZINC000281572749 385197723 /nfs/dbraw/zinc/19/77/23/385197723.db2.gz ZEPPNGOAMVORFP-UHFFFAOYSA-N -1 3 285.384 2.919 20 10 CFCDHM CCCCN(Cc1nnc(C)n1C)Cc1ccccc1[O-] ZINC000282552191 385339824 /nfs/dbraw/zinc/33/98/24/385339824.db2.gz XGNIUBGPRXFVJG-UHFFFAOYSA-N -1 3 288.395 2.631 20 10 CFCDHM CC(C)OC(=O)[C@@H](C)N(C)Cc1c([O-])cccc1Cl ZINC000271184563 385367217 /nfs/dbraw/zinc/36/72/17/385367217.db2.gz LOKWVAKWKMDUNL-SNVBAGLBSA-N -1 3 285.771 2.818 20 10 CFCDHM CCCCN(C(=O)c1ccc(C)c(O)c1[O-])C1CC1 ZINC000271247392 385377949 /nfs/dbraw/zinc/37/79/49/385377949.db2.gz GMUUUQUNJFCDNE-UHFFFAOYSA-N -1 3 263.337 2.811 20 10 CFCDHM CC(C)(C)N1C[C@H](NCc2c([O-])cccc2Cl)CC1=O ZINC000271778766 385391044 /nfs/dbraw/zinc/39/10/44/385391044.db2.gz DFFIWPNDSHBJAM-SNVBAGLBSA-N -1 3 296.798 2.535 20 10 CFCDHM [O-]c1c(F)cccc1CN1CC[C@H](Oc2ccccn2)C1 ZINC000272260935 385491440 /nfs/dbraw/zinc/49/14/40/385491440.db2.gz KCMASJSBYZTLJK-ZDUSSCGKSA-N -1 3 288.322 2.580 20 10 CFCDHM CCn1cc(CN[C@@H](C)c2ccc(F)cc2[O-])cn1 ZINC000273499729 385686605 /nfs/dbraw/zinc/68/66/05/385686605.db2.gz PVGSLRGHZQWMCU-JTQLQIEISA-N -1 3 263.316 2.599 20 10 CFCDHM CCCCOC(=O)[C@H](C)N(C)Cc1ccccc1[O-] ZINC000119528598 397600843 /nfs/dbraw/zinc/60/08/43/397600843.db2.gz GFVKFFSHIPMWBU-LBPRGKRZSA-N -1 3 265.353 2.556 20 10 CFCDHM COc1ccc(CNCc2cc(Cl)ccc2[O-])cn1 ZINC000020186292 171050104 /nfs/dbraw/zinc/05/01/04/171050104.db2.gz IMIGJXLFBRNRKU-UHFFFAOYSA-N -1 3 278.739 2.739 20 10 CFCDHM [O-]c1ccc(F)cc1CN1C[C@@H](CO)Cc2ccccc21 ZINC000367795652 267117857 /nfs/dbraw/zinc/11/78/57/267117857.db2.gz HPAVQDYHCABAPP-LBPRGKRZSA-N -1 3 287.334 2.703 20 10 CFCDHM CC(=O)c1cc(F)cc(CN2CCSC[C@H]2C)c1[O-] ZINC000070220488 277105947 /nfs/dbraw/zinc/10/59/47/277105947.db2.gz MXPYYDKBHYEUIA-SECBINFHSA-N -1 3 283.368 2.671 20 10 CFCDHM Cc1ccc(C(=O)N2CC(C)(C)[C@H]2C(C)C)c([O-])c1O ZINC000294150691 301496268 /nfs/dbraw/zinc/49/62/68/301496268.db2.gz UVFBAQWLQCGAKP-CQSZACIVSA-N -1 3 277.364 2.913 20 10 CFCDHM O=C(c1cccc(O)c1[O-])N1CCCC12CCCC2 ZINC000365537676 327409374 /nfs/dbraw/zinc/40/93/74/327409374.db2.gz MHRFQQFLXKUMSQ-UHFFFAOYSA-N -1 3 261.321 2.647 20 10 CFCDHM O=C(NCc1cc(Cl)ccc1[O-])NCC1CC=CC1 ZINC000528150134 330309737 /nfs/dbraw/zinc/30/97/37/330309737.db2.gz WEPHRAFCNLHHJH-UHFFFAOYSA-N -1 3 280.755 2.811 20 10 CFCDHM O=C(/C=C\c1cncc([O-])c1)N1CCc2cc(F)ccc21 ZINC000492767340 332412691 /nfs/dbraw/zinc/41/26/91/332412691.db2.gz NAIMHSCFLHXZHM-RJRFIUFISA-N -1 3 284.290 2.529 20 10 CFCDHM C[C@@H]1[C@@H](C(=O)NCc2ccc3cccnc3c2[O-])[C@H]1C1CC1 ZINC000529501708 333491275 /nfs/dbraw/zinc/49/12/75/333491275.db2.gz NMRFEYOCHMAVMJ-COLVAYQJSA-N -1 3 296.370 2.849 20 10 CFCDHM CC(=O)c1cc(F)cc(CN(C)Cc2cscn2)c1[O-] ZINC000050142242 518282830 /nfs/dbraw/zinc/28/28/30/518282830.db2.gz YZDIHGOGZLNMHO-UHFFFAOYSA-N -1 3 294.351 2.822 20 10 CFCDHM CC(=O)c1cc(F)cc(CN(C)CC(F)(F)F)c1[O-] ZINC000037665109 518284481 /nfs/dbraw/zinc/28/44/81/518284481.db2.gz XWZGTWGHWQGQGN-UHFFFAOYSA-N -1 3 279.233 2.728 20 10 CFCDHM CC(=O)c1cc(F)cc(CN2CC[C@@H](C)C2)c1[O-] ZINC000040719060 518288222 /nfs/dbraw/zinc/28/82/22/518288222.db2.gz DULCNOFSHUFAFQ-SECBINFHSA-N -1 3 251.301 2.576 20 10 CFCDHM CCC1CCN(C(=O)c2ccc(C)c(O)c2[O-])CC1 ZINC000272531004 519858673 /nfs/dbraw/zinc/85/86/73/519858673.db2.gz ANJYJCPTHJGVRY-UHFFFAOYSA-N -1 3 263.337 2.668 20 10 CFCDHM CCCCN(CCO)Cc1c([O-])cccc1Cl ZINC000159098323 520522117 /nfs/dbraw/zinc/52/21/17/520522117.db2.gz WKTLCVJDFGVNFT-UHFFFAOYSA-N -1 3 257.761 2.640 20 10 CFCDHM COc1cc(CN[C@H](C)c2ccc(F)cc2[O-])ccn1 ZINC000062748554 522485063 /nfs/dbraw/zinc/48/50/63/522485063.db2.gz GWXMYXFHFUSYRM-SNVBAGLBSA-N -1 3 276.311 2.786 20 10 CFCDHM COc1cc(Cl)cc(CNCc2nccs2)c1[O-] ZINC000228671657 522539990 /nfs/dbraw/zinc/53/99/90/522539990.db2.gz QYZSVMIAQKBJPZ-UHFFFAOYSA-N -1 3 284.768 2.801 20 10 CFCDHM CN(Cc1ccon1)Cc1c([O-])cccc1Cl ZINC000271195567 523480937 /nfs/dbraw/zinc/48/09/37/523480937.db2.gz NLWRNIPXAUYGCI-UHFFFAOYSA-N -1 3 252.701 2.666 20 10 CFCDHM CC[C@@H]1CO[C@@H](C)CN1Cc1cc(F)cc(C(C)=O)c1[O-] ZINC000048915891 523507026 /nfs/dbraw/zinc/50/70/26/523507026.db2.gz BIZSORJUNPTMOU-IINYFYTJSA-N -1 3 295.354 2.733 20 10 CFCDHM CN(Cc1nccn1C(F)F)Cc1ccccc1[O-] ZINC000171936999 523588119 /nfs/dbraw/zinc/58/81/19/523588119.db2.gz XTBCFCNCRDCPSM-UHFFFAOYSA-N -1 3 267.279 2.616 20 10 CFCDHM C[C@H]1CCN(Cc2cc(Cl)cc(Cl)c2[O-])[C@@H]1CO ZINC000191175567 524290940 /nfs/dbraw/zinc/29/09/40/524290940.db2.gz LJTTVZNBENZDHY-QPUJVOFHSA-N -1 3 290.190 2.902 20 10 CFCDHM Cc1cc(Cl)cc(CN2CCn3cncc3C2)c1[O-] ZINC000291496738 524864756 /nfs/dbraw/zinc/86/47/56/524864756.db2.gz HAGLGPRKMQHNRV-UHFFFAOYSA-N -1 3 277.755 2.566 20 10 CFCDHM Cc1ccc(C(=O)N2CCC[C@H](C3CC3)C2)c([O-])c1O ZINC000292004035 526103028 /nfs/dbraw/zinc/10/30/28/526103028.db2.gz CMPBBSGAYJCMGN-LBPRGKRZSA-N -1 3 275.348 2.668 20 10 CFCDHM Cc1ccc(C(=O)N2CCCc3occc3C2)c([O-])c1O ZINC000293097847 526108974 /nfs/dbraw/zinc/10/89/74/526108974.db2.gz SRMXINDDPIXIJW-UHFFFAOYSA-N -1 3 287.315 2.588 20 10 CFCDHM [O-]c1ccccc1CNCc1noc(-c2ccccc2F)n1 ZINC000363684454 526374245 /nfs/dbraw/zinc/37/42/45/526374245.db2.gz GLMGGXVLUDTSBA-UHFFFAOYSA-N -1 3 299.305 2.871 20 10 CFCDHM Cc1noc([C@H]2CCCCN2Cc2cc(F)ccc2[O-])n1 ZINC000289753908 526668289 /nfs/dbraw/zinc/66/82/89/526668289.db2.gz JIKWETFSYBTWPR-CYBMUJFWSA-N -1 3 291.326 2.950 20 10 CFCDHM C[C@H](NCc1ccco1)c1cc([N+](=O)[O-])ccc1[O-] ZINC000756343430 574094947 /nfs/dbraw/zinc/09/49/47/574094947.db2.gz NTMWIFBVGDEOFC-VIFPVBQESA-N -1 3 262.265 2.744 20 10 CFCDHM CN(Cc1ccccc1F)C(=O)c1cc([O-])cs1 ZINC000731871166 574131348 /nfs/dbraw/zinc/13/13/48/574131348.db2.gz YMPBAJXFIDSXHV-UHFFFAOYSA-N -1 3 265.309 2.865 20 10 CFCDHM C[C@H](COc1cccc(F)c1)NC(=O)c1cc([O-])cs1 ZINC000731870550 574131426 /nfs/dbraw/zinc/13/14/26/574131426.db2.gz PSAIPZDRUIICDM-SECBINFHSA-N -1 3 295.335 2.790 20 10 CFCDHM C[C@H]1CCCC[C@@H]1OCCNC(=O)c1cc([O-])cs1 ZINC000731870224 574131447 /nfs/dbraw/zinc/13/14/47/574131447.db2.gz VNIFANXQKKWLDC-JQWIXIFHSA-N -1 3 283.393 2.779 20 10 CFCDHM CC(C)(C)c1ncc(NC(=O)c2cc([O-])cs2)cn1 ZINC000731871859 574131450 /nfs/dbraw/zinc/13/14/50/574131450.db2.gz STQPUTKRUXUDOT-UHFFFAOYSA-N -1 3 277.349 2.794 20 10 CFCDHM Cc1cc(C)cc(OCCNC(=O)c2cc([O-])cs2)c1 ZINC000731870327 574131477 /nfs/dbraw/zinc/13/14/77/574131477.db2.gz MSOFQOJYSDMSCF-UHFFFAOYSA-N -1 3 291.372 2.879 20 10 CFCDHM CCCc1nnc(NC(=O)c2cc([O-])cs2)s1 ZINC000731867734 574132045 /nfs/dbraw/zinc/13/20/45/574132045.db2.gz RQXSHPBBHXPQCH-UHFFFAOYSA-N -1 3 269.351 2.510 20 10 CFCDHM CC(C)Cc1nnc(NC(=O)c2cc([O-])cs2)s1 ZINC000731867592 574132220 /nfs/dbraw/zinc/13/22/20/574132220.db2.gz NJXYSBSCJQBIPY-UHFFFAOYSA-N -1 3 283.378 2.756 20 10 CFCDHM C[C@H](OC(=O)c1cc([O-])cs1)C(=O)Nc1ccccc1 ZINC000731911248 574133608 /nfs/dbraw/zinc/13/36/08/574133608.db2.gz HTWVCLDJEPQDFJ-VIFPVBQESA-N -1 3 291.328 2.638 20 10 CFCDHM C[C@@H](OC(=O)c1cc([O-])cs1)C(=O)Nc1ccccc1 ZINC000731911247 574133679 /nfs/dbraw/zinc/13/36/79/574133679.db2.gz HTWVCLDJEPQDFJ-SECBINFHSA-N -1 3 291.328 2.638 20 10 CFCDHM C[C@H](OC(=O)c1cc([O-])cs1)C(=O)c1ccccc1 ZINC000731912187 574133768 /nfs/dbraw/zinc/13/37/68/574133768.db2.gz PZIDZRRPBMUQJP-VIFPVBQESA-N -1 3 276.313 2.882 20 10 CFCDHM CC(=O)c1ccc(NC(=O)c2cc([O-])cs2)cc1 ZINC000732265881 574147785 /nfs/dbraw/zinc/14/77/85/574147785.db2.gz KIWUXVKFQFSJJN-UHFFFAOYSA-N -1 3 261.302 2.909 20 10 CFCDHM C[C@H](NC(=O)c1cc([O-])cs1)c1cccc([N+](=O)[O-])c1 ZINC000732273876 574148826 /nfs/dbraw/zinc/14/88/26/574148826.db2.gz FEUICBUNRHFBPX-QMMMGPOBSA-N -1 3 292.316 2.853 20 10 CFCDHM C[C@H](Cc1ccccc1F)NC(=O)c1cc([O-])cs1 ZINC000732276848 574149081 /nfs/dbraw/zinc/14/90/81/574149081.db2.gz TZPNCDPJVMJBFB-SECBINFHSA-N -1 3 279.336 2.954 20 10 CFCDHM CCCOc1ncccc1CNC(=O)c1cc([O-])cs1 ZINC000732277928 574149324 /nfs/dbraw/zinc/14/93/24/574149324.db2.gz VYNKOMJGCGPGMW-UHFFFAOYSA-N -1 3 292.360 2.568 20 10 CFCDHM O=C(c1cc([O-])cs1)N1CCC[C@H]1c1ccccn1 ZINC000732276282 574149408 /nfs/dbraw/zinc/14/94/08/574149408.db2.gz POZVXFOOZXZLME-LBPRGKRZSA-N -1 3 274.345 2.826 20 10 CFCDHM C[C@@H](Cc1ccccc1F)NC(=O)c1cc([O-])cs1 ZINC000732276849 574149658 /nfs/dbraw/zinc/14/96/58/574149658.db2.gz TZPNCDPJVMJBFB-VIFPVBQESA-N -1 3 279.336 2.954 20 10 CFCDHM C[C@@H]1C[C@H]1c1cc(NC(=O)c2cc([O-])cs2)n[nH]1 ZINC000732280522 574150221 /nfs/dbraw/zinc/15/02/21/574150221.db2.gz KDVPLZAPJYANOP-HTRCEHHLSA-N -1 3 263.322 2.553 20 10 CFCDHM O=C(COC(=O)c1cc([O-])cs1)c1ccc(F)cc1F ZINC000732352935 574152617 /nfs/dbraw/zinc/15/26/17/574152617.db2.gz AIFJKVSPWVPJDJ-UHFFFAOYSA-N -1 3 298.266 2.772 20 10 CFCDHM O=C(COC(=O)c1cc([O-])cs1)c1ccc(F)c(F)c1 ZINC000732352782 574152750 /nfs/dbraw/zinc/15/27/50/574152750.db2.gz GTGWHJRPAYWOGA-UHFFFAOYSA-N -1 3 298.266 2.772 20 10 CFCDHM COCc1cccc(COC(=O)c2cc([O-])cs2)c1 ZINC000747053052 574177169 /nfs/dbraw/zinc/17/71/69/574177169.db2.gz CLEGJBMTXPQKSO-UHFFFAOYSA-N -1 3 278.329 2.957 20 10 CFCDHM CCS[C@@H]1CCC[C@@H]1NC(=O)c1cc([O-])cs1 ZINC000755831641 574191379 /nfs/dbraw/zinc/19/13/79/574191379.db2.gz HTBOHMWLQSZEOS-VHSXEESVSA-N -1 3 271.407 2.858 20 10 CFCDHM COc1ccc(O)c([C@H](C)NC(=O)c2ccccc2[O-])c1 ZINC000729279117 574195880 /nfs/dbraw/zinc/19/58/80/574195880.db2.gz ZMYRSGJCAKQSLA-JTQLQIEISA-N -1 3 287.315 2.597 20 10 CFCDHM COc1cccc([O-])c1CNCc1cn2cc(C)ccc2n1 ZINC000729681190 574227895 /nfs/dbraw/zinc/22/78/95/574227895.db2.gz WXODQBLXRUMMKY-UHFFFAOYSA-N -1 3 297.358 2.647 20 10 CFCDHM C[C@@H](NCc1cc[nH]n1)c1ccc(Br)cc1[O-] ZINC000756553415 574246869 /nfs/dbraw/zinc/24/68/69/574246869.db2.gz KWUXPTLRPGRUBE-MRVPVSSYSA-N -1 3 296.168 2.729 20 10 CFCDHM C[C@H](N[C@@H](C)c1cc(F)cc(F)c1[O-])c1cnn(C)c1 ZINC000756603374 574251711 /nfs/dbraw/zinc/25/17/11/574251711.db2.gz BIMAQZHNPHUQGG-IUCAKERBSA-N -1 3 281.306 2.816 20 10 CFCDHM Cc1c(CN[C@H](C)c2cc(F)cc(F)c2[O-])cnn1C ZINC000756776567 574261839 /nfs/dbraw/zinc/26/18/39/574261839.db2.gz QCNQTYVWBQLEQK-MRVPVSSYSA-N -1 3 281.306 2.563 20 10 CFCDHM [O-]c1ccc2ccncc2c1CN1CCC[C@H]1c1ncon1 ZINC000750020997 574321222 /nfs/dbraw/zinc/32/12/22/574321222.db2.gz ZHGSROXSHNIYRJ-AWEZNQCLSA-N -1 3 296.330 2.661 20 10 CFCDHM COc1cc(OC)c(NC(=O)c2cc([O-])cs2)cc1F ZINC000755859572 574356283 /nfs/dbraw/zinc/35/62/83/574356283.db2.gz GEYLWXUUPULVID-UHFFFAOYSA-N -1 3 297.307 2.862 20 10 CFCDHM Cc1ccc(CNC(=O)c2ccc(C)c(O)c2[O-])s1 ZINC000751532962 574378605 /nfs/dbraw/zinc/37/86/05/574378605.db2.gz IMPRCLGXNMXOPP-UHFFFAOYSA-N -1 3 277.345 2.706 20 10 CFCDHM Cc1ccc(C(=O)N(C)C[C@@H]2CC=CCC2)c([O-])c1O ZINC000753105830 574398635 /nfs/dbraw/zinc/39/86/35/574398635.db2.gz MBSFEGODTWCKBC-GFCCVEGCSA-N -1 3 275.348 2.835 20 10 CFCDHM C[C@H]1CN(C(=O)c2cc([O-])cs2)CC(C)(C)C1 ZINC000753487548 574403100 /nfs/dbraw/zinc/40/31/00/574403100.db2.gz AKTGOKJMUXYZFQ-SECBINFHSA-N -1 3 253.367 2.962 20 10 CFCDHM Cc1cc(O)c(CNc2cccc(-c3nnn[n-]3)c2)cc1C ZINC000826271770 608871719 /nfs/dbraw/zinc/87/17/19/608871719.db2.gz GRHILHFTAQNTEW-UHFFFAOYSA-N -1 3 295.346 2.801 20 10 CFCDHM Cc1cc(O)c(CNc2cccc(-c3nn[n-]n3)c2)cc1C ZINC000826271770 608871722 /nfs/dbraw/zinc/87/17/22/608871722.db2.gz GRHILHFTAQNTEW-UHFFFAOYSA-N -1 3 295.346 2.801 20 10 CFCDHM CC1(C)CN(Cc2cc(Cl)cc(F)c2[O-])CC[C@H]1O ZINC000783730144 618721698 /nfs/dbraw/zinc/72/16/98/618721698.db2.gz QSBMJLQIDCXNSC-GFCCVEGCSA-N -1 3 287.762 2.778 20 10 CFCDHM Cc1cc(CN(C)Cc2cc(Cl)ccc2[O-])no1 ZINC000092254291 618804084 /nfs/dbraw/zinc/80/40/84/618804084.db2.gz RKSSEYQXYNESFD-UHFFFAOYSA-N -1 3 266.728 2.974 20 10 CFCDHM Cc1ccc(C(=O)N2CCc3c2cccc3F)c([O-])c1O ZINC000184306094 618913744 /nfs/dbraw/zinc/91/37/44/618913744.db2.gz BHFPBXSZDKTVMQ-UHFFFAOYSA-N -1 3 287.290 2.748 20 10 CFCDHM CC[C@@H]1CC[C@H](C)N(C(=O)c2cccc(O)c2[O-])C1 ZINC000311332960 618935352 /nfs/dbraw/zinc/93/53/52/618935352.db2.gz DRAUTPXOXKJDFA-WDEREUQCSA-N -1 3 263.337 2.749 20 10 CFCDHM [O-]c1c(F)cc(F)cc1CN(CCO)Cc1ccccc1 ZINC000893871158 619232683 /nfs/dbraw/zinc/23/26/83/619232683.db2.gz GYERSOWZYHPOQX-UHFFFAOYSA-N -1 3 293.313 2.665 20 10 CFCDHM Cc1ncoc1CNCc1cccc(Br)c1[O-] ZINC000894571452 619421457 /nfs/dbraw/zinc/42/14/57/619421457.db2.gz RHBOPXCWLPOLLP-UHFFFAOYSA-N -1 3 297.152 2.741 20 10 CFCDHM Cc1cc([O-])c(CN[C@H](CCO)C(F)(F)F)cc1Cl ZINC000894849950 619483066 /nfs/dbraw/zinc/48/30/66/619483066.db2.gz GIUNAUDPEWYKJN-LLVKDONJSA-N -1 3 297.704 2.757 20 10 CFCDHM [O-]c1cccc(F)c1CNc1ncc2c(n1)CCCC2 ZINC000895833199 619619225 /nfs/dbraw/zinc/61/92/25/619619225.db2.gz WAPZSKBZWKFOPG-UHFFFAOYSA-N -1 3 273.311 2.812 20 10 CFCDHM [O-]c1cccc(F)c1CNc1nnc(C2CC2)s1 ZINC000895832937 619619388 /nfs/dbraw/zinc/61/93/88/619619388.db2.gz QYFBCUNWRICILH-UHFFFAOYSA-N -1 3 265.313 2.872 20 10 CFCDHM [O-]c1ccc(F)cc1CN1CCn2nc(C3CC3)cc2C1 ZINC000896939522 619900884 /nfs/dbraw/zinc/90/08/84/619900884.db2.gz IQHLVJUODYKCKW-UHFFFAOYSA-N -1 3 287.338 2.621 20 10 CFCDHM O=C(NCc1c([O-])cccc1F)[C@@H]1CCC[C@@H]2C[C@@H]21 ZINC000928705364 619995530 /nfs/dbraw/zinc/99/55/30/619995530.db2.gz HQXHTGKLJZAFCX-MXWKQRLJSA-N -1 3 263.312 2.584 20 10 CFCDHM O=C(/C=C/C1CCCC1)NCc1c([O-])cccc1F ZINC000928706593 619995850 /nfs/dbraw/zinc/99/58/50/619995850.db2.gz RIHSJPYDUMODIF-CMDGGOBGSA-N -1 3 263.312 2.894 20 10 CFCDHM O=C(NCc1c([O-])cccc1F)[C@@H]1CC12CCSCC2 ZINC000928706301 619995891 /nfs/dbraw/zinc/99/58/91/619995891.db2.gz QMVCUZIODZLZLF-NSHDSACASA-N -1 3 295.379 2.681 20 10 CFCDHM O=C(NCc1c([O-])cccc1F)[C@@H]1C[C@@H]2C=C[C@H]1CC2 ZINC000928706595 619996078 /nfs/dbraw/zinc/99/60/78/619996078.db2.gz RJJKXHVBZSGGDC-GRYCIOLGSA-N -1 3 275.323 2.750 20 10 CFCDHM CC(C)CCO[C@H](C)C(=O)NCc1c([O-])cccc1F ZINC000928712803 619997137 /nfs/dbraw/zinc/99/71/37/619997137.db2.gz ZGHUFPFEQZDEFZ-LLVKDONJSA-N -1 3 283.343 2.599 20 10 CFCDHM Cc1cc([N-]S(=O)(=O)c2ccccc2C)ccc1O ZINC000148624193 620247724 /nfs/dbraw/zinc/24/77/24/620247724.db2.gz DSXHTDUPPNQKLE-UHFFFAOYSA-N -1 3 277.345 2.810 20 10 CFCDHM Cc1cccc(S(=O)(=O)[N-]c2ccc(O)c(C)c2)c1 ZINC000148640323 620251996 /nfs/dbraw/zinc/25/19/96/620251996.db2.gz KCOQABJYAAAPNF-UHFFFAOYSA-N -1 3 277.345 2.810 20 10 CFCDHM O=C(NCc1c([O-])cccc1F)N[C@@H]1C[C@H]2CCC[C@@H]21 ZINC000898254150 620357868 /nfs/dbraw/zinc/35/78/68/620357868.db2.gz ASWAJAXADRANAI-GBIKHYSHSA-N -1 3 278.327 2.519 20 10 CFCDHM O=C(NCc1c([O-])cccc1F)NC1CCCCC1 ZINC000905149502 621711330 /nfs/dbraw/zinc/71/13/30/621711330.db2.gz UPNBXQFUUOFZBD-UHFFFAOYSA-N -1 3 266.316 2.663 20 10 CFCDHM Cc1cc([O-])c(CN2C[C@@H](C)OC[C@@H]2C)cc1Cl ZINC000824576077 623526422 /nfs/dbraw/zinc/52/64/22/623526422.db2.gz ZNJVFCLHWGTHRC-WDEREUQCSA-N -1 3 269.772 2.963 20 10 CFCDHM CC(C)c1nnc(CNCc2c([O-])ccc(Cl)c2F)[nH]1 ZINC000824602919 623531286 /nfs/dbraw/zinc/53/12/86/623531286.db2.gz HAUGZXGDYFDPMN-UHFFFAOYSA-N -1 3 298.749 2.716 20 10 CFCDHM CC(C)c1nc(CNCc2c([O-])ccc(Cl)c2F)n[nH]1 ZINC000824602919 623531290 /nfs/dbraw/zinc/53/12/90/623531290.db2.gz HAUGZXGDYFDPMN-UHFFFAOYSA-N -1 3 298.749 2.716 20 10 CFCDHM C[C@@H]1CCCC[C@@H]1NC(=O)NCc1c([O-])cccc1F ZINC000913856856 623623176 /nfs/dbraw/zinc/62/31/76/623623176.db2.gz QQTBGPHBIQGXNU-MFKMUULPSA-N -1 3 280.343 2.909 20 10 CFCDHM Cc1cc([O-])c(CN2CC(F)(F)C[C@@H]2CO)cc1Cl ZINC000825622310 623724879 /nfs/dbraw/zinc/72/48/79/623724879.db2.gz SVXFPYWTSCHMGT-SNVBAGLBSA-N -1 3 291.725 2.556 20 10 CFCDHM C[C@@H]1CCC[C@@H](NC(=O)NCc2c([O-])cccc2F)C1 ZINC000914201043 623733753 /nfs/dbraw/zinc/73/37/53/623733753.db2.gz VNIDJDDAROZLID-GHMZBOCLSA-N -1 3 280.343 2.909 20 10 CFCDHM Cc1cc([O-])c(CN2CCn3cnnc3[C@H]2C)cc1Cl ZINC000825685610 623740099 /nfs/dbraw/zinc/74/00/99/623740099.db2.gz GMWUEZYDWJFBBR-SNVBAGLBSA-N -1 3 292.770 2.522 20 10 CFCDHM O=C(NCc1c([O-])cccc1F)NC[C@H]1CC=CCC1 ZINC000914414607 623787523 /nfs/dbraw/zinc/78/75/23/623787523.db2.gz WRAAVWUFSVJYBA-NSHDSACASA-N -1 3 278.327 2.687 20 10 CFCDHM C[C@H]1C[C@H](NCc2cc(Cl)c(F)cc2[O-])c2ncnn21 ZINC000826889588 623903339 /nfs/dbraw/zinc/90/33/39/623903339.db2.gz WHIJYGITQKRSSI-CPCISQLKSA-N -1 3 296.733 2.572 20 10 CFCDHM O=[N+]([O-])c1cc(Cl)cc(CN2CC[C@@H]3C[C@@H]3C2)c1[O-] ZINC000827507702 624020253 /nfs/dbraw/zinc/02/02/53/624020253.db2.gz ZAZVBGCACWZWRY-RKDXNWHRSA-N -1 3 282.727 2.796 20 10 CFCDHM C[C@@H](NCc1cccc(Cl)c1[O-])c1nccn1C ZINC000827722138 624076018 /nfs/dbraw/zinc/07/60/18/624076018.db2.gz ALLFXOJXUSHFPD-SECBINFHSA-N -1 3 265.744 2.630 20 10 CFCDHM Cc1cncc([C@@H]2CCCN2C(=O)c2cccc(O)c2[O-])c1 ZINC000830465244 624751812 /nfs/dbraw/zinc/75/18/12/624751812.db2.gz QHOPQSKFTGOWIC-AWEZNQCLSA-N -1 3 298.342 2.779 20 10 CFCDHM Cc1cncc([C@H]2CCCN2C(=O)c2cccc(O)c2[O-])c1 ZINC000830465245 624752110 /nfs/dbraw/zinc/75/21/10/624752110.db2.gz QHOPQSKFTGOWIC-CQSZACIVSA-N -1 3 298.342 2.779 20 10 CFCDHM CC[C@H]1CCC[C@H]1NC(=O)NCc1c([O-])cccc1F ZINC000921424040 624877432 /nfs/dbraw/zinc/87/74/32/624877432.db2.gz BLTSTPOWILATIH-GXFFZTMASA-N -1 3 280.343 2.909 20 10 CFCDHM O=C(Nc1cccc2[nH]ccc21)c1cccc(O)c1[O-] ZINC000187061839 626441767 /nfs/dbraw/zinc/44/17/67/626441767.db2.gz QIWPFYNCCDGCHO-UHFFFAOYSA-N -1 3 268.272 2.831 20 10 CFCDHM O=C(N[C@H]1C[C@H]1c1cccc(F)c1)c1cccc(O)c1[O-] ZINC000187078653 626449319 /nfs/dbraw/zinc/44/93/19/626449319.db2.gz SOYTZQZBYMDMAD-STQMWFEESA-N -1 3 287.290 2.523 20 10 CFCDHM O=C(NCCc1cc2ccccc2o1)c1cccc(O)c1[O-] ZINC000187116699 626457465 /nfs/dbraw/zinc/45/74/65/626457465.db2.gz SRILARRLEKLUOQ-UHFFFAOYSA-N -1 3 297.310 2.817 20 10 CFCDHM O=C(NCCCc1ccco1)NCc1c([O-])cccc1F ZINC000923339743 626467551 /nfs/dbraw/zinc/46/75/51/626467551.db2.gz ZVYAJPDFISGGFW-UHFFFAOYSA-N -1 3 292.310 2.556 20 10 CFCDHM C[C@H](NCc1c([O-])ccc(Cl)c1F)c1ccn(C)n1 ZINC000839190524 626530623 /nfs/dbraw/zinc/53/06/23/626530623.db2.gz HGRUFYYHJFIQFM-QMMMGPOBSA-N -1 3 283.734 2.769 20 10 CFCDHM C[C@H](NCc1cc(Cl)c(F)cc1[O-])c1ccn(C)n1 ZINC000839192698 626530981 /nfs/dbraw/zinc/53/09/81/626530981.db2.gz WAFVMTZVTAPJRZ-QMMMGPOBSA-N -1 3 283.734 2.769 20 10 CFCDHM Cc1ccc(C)c(CN(C)C(=O)c2cccc(O)c2[O-])c1 ZINC000760548519 626755180 /nfs/dbraw/zinc/75/51/80/626755180.db2.gz OTVNTFYWUDWODX-UHFFFAOYSA-N -1 3 285.343 2.987 20 10 CFCDHM CC[C@]1(C)COCCN1Cc1cc(F)cc(C(C)=O)c1[O-] ZINC000761102444 626804959 /nfs/dbraw/zinc/80/49/59/626804959.db2.gz RKIDQEHRKSUVKM-MRXNPFEDSA-N -1 3 295.354 2.735 20 10 CFCDHM CC1(CO)CCN(Cc2cc(Cl)cc(F)c2[O-])CC1 ZINC000762790833 626937567 /nfs/dbraw/zinc/93/75/67/626937567.db2.gz JICZZENRLNWBAD-UHFFFAOYSA-N -1 3 287.762 2.779 20 10 CFCDHM CCn1cc(CN(C)Cc2cccc(Cl)c2[O-])cn1 ZINC000775700384 628056595 /nfs/dbraw/zinc/05/65/95/628056595.db2.gz OBHLNBWZQAQURA-UHFFFAOYSA-N -1 3 279.771 2.894 20 10 CFCDHM Cc1cc(CNCc2cc(Cl)cc(F)c2[O-])ncn1 ZINC000776252343 628121729 /nfs/dbraw/zinc/12/17/29/628121729.db2.gz CEXPLHGBBOCRLR-UHFFFAOYSA-N -1 3 281.718 2.573 20 10 CFCDHM Cc1ccc(NC(=O)c2ccc(C)c(O)c2[O-])c2n[nH]cc21 ZINC000780916937 628504854 /nfs/dbraw/zinc/50/48/54/628504854.db2.gz BZHPKZBIHZCACT-UHFFFAOYSA-N -1 3 297.314 2.843 20 10 CFCDHM CC[C@@H](N[C@@H](C)c1ncn(C)n1)c1cc(Cl)ccc1[O-] ZINC000783297205 628698303 /nfs/dbraw/zinc/69/83/03/628698303.db2.gz GCDXENDRXLLPIV-JOYOIKCWSA-N -1 3 294.786 2.976 20 10 CFCDHM CN(CCc1ccccc1F)C(=O)c1cccc(O)c1[O-] ZINC000790676940 629256941 /nfs/dbraw/zinc/25/69/41/629256941.db2.gz HBUSPYSKELUSPH-UHFFFAOYSA-N -1 3 289.306 2.552 20 10 CFCDHM C[C@@]1(c2ccccc2)C[C@@H]1NC(=O)c1cccc(O)c1[O-] ZINC000790785320 629262411 /nfs/dbraw/zinc/26/24/11/629262411.db2.gz LMBVCKVFXUPTPG-YOEHRIQHSA-N -1 3 283.327 2.558 20 10 CFCDHM Cc1cccc(CC2CN(C(=O)c3cccc(O)c3[O-])C2)c1 ZINC000790873837 629269576 /nfs/dbraw/zinc/26/95/76/629269576.db2.gz OMJGIHUKMRVGMY-UHFFFAOYSA-N -1 3 297.354 2.721 20 10 CFCDHM C[C@H]1CN(C(=O)c2cccc(O)c2[O-])CC(C)(C)C1 ZINC000790926886 629271718 /nfs/dbraw/zinc/27/17/18/629271718.db2.gz AHDQFJRFXJRZEB-SNVBAGLBSA-N -1 3 263.337 2.606 20 10 CFCDHM Cc1c(CN(C)Cc2c([O-])cccc2Cl)cnn1C ZINC000790936385 629272325 /nfs/dbraw/zinc/27/23/25/629272325.db2.gz GKTRENLBCHBCMO-UHFFFAOYSA-N -1 3 279.771 2.720 20 10 CFCDHM CCC1(O)CCN(Cc2c([O-])ccc(Cl)c2F)CC1 ZINC000792166194 629404333 /nfs/dbraw/zinc/40/43/33/629404333.db2.gz PVXYXNJMTNMXGF-UHFFFAOYSA-N -1 3 287.762 2.922 20 10 CFCDHM C[C@@H]1[C@@H](C(F)(F)F)CCN1C(=O)c1cccc(O)c1[O-] ZINC000792537513 629432231 /nfs/dbraw/zinc/43/22/31/629432231.db2.gz IQIDBRILHRLOND-APPZFPTMSA-N -1 3 289.253 2.511 20 10 CFCDHM [O-]c1c(Cl)cccc1CNCc1cccnc1F ZINC000793285540 629520863 /nfs/dbraw/zinc/52/08/63/629520863.db2.gz PSPFIIFYECTJOO-UHFFFAOYSA-N -1 3 266.703 2.870 20 10 CFCDHM CC[C@H](NCc1nccn1C)c1ccc(F)cc1[O-] ZINC000796751613 629960182 /nfs/dbraw/zinc/96/01/82/629960182.db2.gz AJJNVFHEZBCOBN-LBPRGKRZSA-N -1 3 263.316 2.506 20 10 CFCDHM CC[C@@H](NCc1ccon1)c1ccc(F)cc1[O-] ZINC000796791464 629968712 /nfs/dbraw/zinc/96/87/12/629968712.db2.gz XMBLWWWMBDUFMR-GFCCVEGCSA-N -1 3 250.273 2.760 20 10 CFCDHM [O-]c1ccc(Br)cc1CN1CCOCC12CC2 ZINC000802658889 630536474 /nfs/dbraw/zinc/53/64/74/630536474.db2.gz UAVZPYPJDUVDRT-UHFFFAOYSA-N -1 3 298.180 2.520 20 10 CFCDHM CC(=O)c1cc(NC(=O)c2cccc(O)c2[O-])ccc1F ZINC000804273533 630666342 /nfs/dbraw/zinc/66/63/42/630666342.db2.gz ZCGWJZMUCBLTGG-UHFFFAOYSA-N -1 3 289.262 2.692 20 10 CFCDHM CCn1ccc(CN[C@@H](C)c2cc(F)cc(F)c2[O-])n1 ZINC000840840082 631237190 /nfs/dbraw/zinc/23/71/90/631237190.db2.gz FGFJLNWUOAQGJY-VIFPVBQESA-N -1 3 281.306 2.738 20 10 CFCDHM Cc1cc([O-])c(CN(C)Cc2cnccn2)c(Cl)c1 ZINC000840912125 631261374 /nfs/dbraw/zinc/26/13/74/631261374.db2.gz HQSURAARMZQUSA-UHFFFAOYSA-N -1 3 277.755 2.776 20 10 CFCDHM Cc1cc([O-])c(CN2C[C@H]3CC[C@@H](C2)O3)c(Cl)c1 ZINC000840914904 631263187 /nfs/dbraw/zinc/26/31/87/631263187.db2.gz IGJWNKIACCMPMU-PHIMTYICSA-N -1 3 267.756 2.717 20 10 CFCDHM CN(Cc1c([O-])ccc(Cl)c1F)[C@@H]1CCCOC1 ZINC000809693115 631265139 /nfs/dbraw/zinc/26/51/39/631265139.db2.gz OFYKCMOPLMFMQL-SECBINFHSA-N -1 3 273.735 2.796 20 10 CFCDHM Cc1cn2c(n1)CN(Cc1c([O-])cc(C)cc1Cl)CC2 ZINC000840936128 631269298 /nfs/dbraw/zinc/26/92/98/631269298.db2.gz DRADJTSNIANPRB-UHFFFAOYSA-N -1 3 291.782 2.875 20 10 CFCDHM CC[C@H](C(=O)[O-])[N@H+](C)Cc1cc(Cl)cc(C)c1[O-] ZINC000844938667 632342564 /nfs/dbraw/zinc/34/25/64/632342564.db2.gz VWFJGICSXSHAHP-LLVKDONJSA-N -1 3 271.744 2.649 20 10 CFCDHM CC[C@H](C(=O)[O-])[N@@H+](C)Cc1cc(Cl)cc(C)c1[O-] ZINC000844938667 632342571 /nfs/dbraw/zinc/34/25/71/632342571.db2.gz VWFJGICSXSHAHP-LLVKDONJSA-N -1 3 271.744 2.649 20 10 CFCDHM C[C@H]1CN(Cc2cc(Cl)c(F)cc2[O-])[C@@H](C)CN1C ZINC000816571419 632488300 /nfs/dbraw/zinc/48/83/00/632488300.db2.gz CYFWUUIFKBQGMM-UWVGGRQHSA-N -1 3 286.778 2.709 20 10 CFCDHM [O-]c1cc(F)c(Cl)cc1CN1CCC12CCOCC2 ZINC000816592461 632491793 /nfs/dbraw/zinc/49/17/93/632491793.db2.gz KSSNNJATUGVVBO-UHFFFAOYSA-N -1 3 285.746 2.940 20 10 CFCDHM Cc1nonc1CNCc1ccc2ccccc2c1[O-] ZINC000816610926 632493848 /nfs/dbraw/zinc/49/38/48/632493848.db2.gz CPTAZVBRGYUGJP-UHFFFAOYSA-N -1 3 269.304 2.527 20 10 CFCDHM [O-]c1c(F)cc(Cl)cc1CN1CCC(C2(O)CC2)CC1 ZINC000846007398 632611995 /nfs/dbraw/zinc/61/19/95/632611995.db2.gz HAPZPVNFRDRYLL-UHFFFAOYSA-N -1 3 299.773 2.922 20 10 CFCDHM C[C@@H]1CC[C@@H](O)CN1Cc1c([O-])ccc(Cl)c1F ZINC000817414468 632625452 /nfs/dbraw/zinc/62/54/52/632625452.db2.gz LJEIQWZJPHUVFA-RKDXNWHRSA-N -1 3 273.735 2.530 20 10 CFCDHM CC[C@@H](NCC(F)(F)CN)c1cccc(Cl)c1[O-] ZINC000817967889 632766646 /nfs/dbraw/zinc/76/66/46/632766646.db2.gz NECACXBMLSMMKJ-SNVBAGLBSA-N -1 3 278.730 2.680 20 10 CFCDHM CC[C@@H](NCc1nn(CC)nc1C)c1ccc(F)cc1[O-] ZINC000818346846 632835195 /nfs/dbraw/zinc/83/51/95/632835195.db2.gz VGRZMTFEGLHTNZ-CYBMUJFWSA-N -1 3 292.358 2.692 20 10 CFCDHM C[C@H](N[C@@H]1C[C@H](C)n2ncnc21)c1cc(F)cc(F)c1[O-] ZINC000850499100 634019253 /nfs/dbraw/zinc/01/92/53/634019253.db2.gz JJASTVQGMJDWRW-YVZVNANGSA-N -1 3 294.305 2.619 20 10 CFCDHM CC(C)C[C@H](C[NH2+]Cc1cc(F)ccc1[O-])CC(=O)[O-] ZINC000854243948 635270729 /nfs/dbraw/zinc/27/07/29/635270729.db2.gz IXUPAUUVPGTHTR-NSHDSACASA-N -1 3 283.343 2.758 20 10 CFCDHM CN(C[C@H]1CCc2ccccc21)C(=O)c1cccc(O)c1[O-] ZINC000856303888 635780675 /nfs/dbraw/zinc/78/06/75/635780675.db2.gz ABLCLQVJLFVGPA-CYBMUJFWSA-N -1 3 297.354 2.900 20 10 CFCDHM C[C@H](c1ccccc1)N(C)C(=O)c1cccc(O)c1[O-] ZINC000188089325 650315201 /nfs/dbraw/zinc/31/52/01/650315201.db2.gz MFNGPOCTICCVSR-LLVKDONJSA-N -1 3 271.316 2.931 20 10 CFCDHM CN(Cc1ccon1)Cc1c([O-])cccc1Br ZINC000862247033 637299083 /nfs/dbraw/zinc/29/90/83/637299083.db2.gz FRTLZVXVILXBHJ-UHFFFAOYSA-N -1 3 297.152 2.775 20 10 CFCDHM Cc1nocc1CNCc1c([O-])ccc(Cl)c1F ZINC000865678345 638507421 /nfs/dbraw/zinc/50/74/21/638507421.db2.gz GBJADOMZSRKFST-UHFFFAOYSA-N -1 3 270.691 2.771 20 10 CFCDHM O=C(c1cccc(O)c1[O-])N1CCC[C@H](c2cccnc2)C1 ZINC000869050274 639014057 /nfs/dbraw/zinc/01/40/57/639014057.db2.gz BVNXYNVEWXOCGE-ZDUSSCGKSA-N -1 3 298.342 2.513 20 10 CFCDHM Cc1ccccc1C[C@@H](C)NC(=O)c1cccc(O)c1[O-] ZINC000192987446 650614020 /nfs/dbraw/zinc/61/40/20/650614020.db2.gz VSKKMNGSTCUKEB-GFCCVEGCSA-N -1 3 285.343 2.767 20 10 CFCDHM CCCc1csc(NC(=O)c2cccc(O)c2[O-])n1 ZINC000193151294 650628326 /nfs/dbraw/zinc/62/83/26/650628326.db2.gz PFGIBGBHSDOEQI-UHFFFAOYSA-N -1 3 278.333 2.759 20 10 CFCDHM Cc1ccc(NC(=O)c2cccc(O)c2[O-])cc1[N+](=O)[O-] ZINC000126214378 643051848 /nfs/dbraw/zinc/05/18/48/643051848.db2.gz QRMIQIIDRNCADN-UHFFFAOYSA-N -1 3 288.259 2.567 20 10 CFCDHM CCc1ccccc1NC(=O)c1cccc(O)c1[O-] ZINC000126227997 643055606 /nfs/dbraw/zinc/05/56/06/643055606.db2.gz AVZAUMVRZCJUFW-UHFFFAOYSA-N -1 3 257.289 2.913 20 10 CFCDHM Cc1ccc(CN(C)C(=O)c2cccc(O)c2[O-])cc1 ZINC000126236989 643058727 /nfs/dbraw/zinc/05/87/27/643058727.db2.gz NTGUPGCSLSAGTK-UHFFFAOYSA-N -1 3 271.316 2.678 20 10 CFCDHM C[C@@H](c1cccs1)N(C)C(=O)c1cccc(O)c1[O-] ZINC000126324765 643145370 /nfs/dbraw/zinc/14/53/70/643145370.db2.gz SZPXFQNWEMPKFP-VIFPVBQESA-N -1 3 277.345 2.993 20 10 CFCDHM Cc1c(F)cccc1NC(=O)c1cccc(O)c1[O-] ZINC000126347980 643154539 /nfs/dbraw/zinc/15/45/39/643154539.db2.gz SFFAXBKMQJIRMW-UHFFFAOYSA-N -1 3 261.252 2.798 20 10 CFCDHM CC[C@@H]1CCCCCN1C(=O)c1cccc(O)c1[O-] ZINC000126540442 643290428 /nfs/dbraw/zinc/29/04/28/643290428.db2.gz LBZPSNHNMAOCMS-LLVKDONJSA-N -1 3 263.337 2.893 20 10 CFCDHM CC(C)(C)OC1CN(Cc2cc(F)ccc2[O-])C1 ZINC000877769601 643547700 /nfs/dbraw/zinc/54/77/00/643547700.db2.gz FQPHJCYCNSLYGW-UHFFFAOYSA-N -1 3 253.317 2.531 20 10 CFCDHM CCc1noc(C)c1CNCc1cc(F)cc(F)c1[O-] ZINC000883130325 645617521 /nfs/dbraw/zinc/61/75/21/645617521.db2.gz AEDOIOPJPMPJQM-UHFFFAOYSA-N -1 3 282.290 2.819 20 10 CFCDHM Cc1noc(C)c1CN[C@H](C)c1c([O-])cccc1F ZINC000886512234 647024298 /nfs/dbraw/zinc/02/42/98/647024298.db2.gz AAIAPISTHFXIJQ-SECBINFHSA-N -1 3 264.300 2.987 20 10 CFCDHM Cc1cc(CN[C@@H](C)c2c([O-])cccc2F)on1 ZINC000886522675 647028304 /nfs/dbraw/zinc/02/83/04/647028304.db2.gz OSEWLTAXTCRJRQ-VIFPVBQESA-N -1 3 250.273 2.679 20 10 CFCDHM C[C@@H](N[C@H](CCO)c1ccco1)c1c([O-])cccc1F ZINC000886592334 647058052 /nfs/dbraw/zinc/05/80/52/647058052.db2.gz QMARKZROAFPOAB-ZYHUDNBSSA-N -1 3 279.311 2.899 20 10 CFCDHM O=C(NCc1c([O-])cccc1F)[C@@H]1C[C@@H]1C1CCCC1 ZINC000928705353 648944648 /nfs/dbraw/zinc/94/46/48/648944648.db2.gz HINNLNRJQIKYCV-VXGBXAGGSA-N -1 3 277.339 2.974 20 10 CFCDHM CC[C@H](CC(F)F)C(=O)NCc1c([O-])cccc1F ZINC000928705506 648944835 /nfs/dbraw/zinc/94/48/35/648944835.db2.gz IZTHNPKMSIEXLH-MRVPVSSYSA-N -1 3 275.270 2.829 20 10 CFCDHM CC[C@H](OC1CCCC1)C(=O)NCc1c([O-])cccc1F ZINC000928706186 648944689 /nfs/dbraw/zinc/94/46/89/648944689.db2.gz SOWUBCRWQYDFDL-HNNXBMFYSA-N -1 3 295.354 2.885 20 10 CFCDHM CC(=O)C(C)(C)CCC(=O)NCc1c([O-])cccc1F ZINC000928706518 648944802 /nfs/dbraw/zinc/94/48/02/648944802.db2.gz VONMPXMUCMHLDR-UHFFFAOYSA-N -1 3 281.327 2.543 20 10 CFCDHM CC[C@@H]1C[C@@H](CC(=O)NCc2c([O-])cccc2F)CCO1 ZINC000928707745 648945205 /nfs/dbraw/zinc/94/52/05/648945205.db2.gz HODAEDYFMYSEEE-NWDGAFQWSA-N -1 3 295.354 2.743 20 10 CFCDHM Cc1csc([C@@H](C)C(=O)NCc2c([O-])cccc2F)n1 ZINC000928708430 648945934 /nfs/dbraw/zinc/94/59/34/648945934.db2.gz LVHIXVROZIAIRW-VIFPVBQESA-N -1 3 294.351 2.716 20 10 CFCDHM CCCCCCOCC(=O)NCc1c([O-])cccc1F ZINC000928710369 648946489 /nfs/dbraw/zinc/94/64/89/648946489.db2.gz CFSIILLVXBUTQO-UHFFFAOYSA-N -1 3 283.343 2.744 20 10 CFCDHM O=C(NCc1c([O-])cccc1F)C1CC2(CC2(F)F)C1 ZINC000928712946 648946578 /nfs/dbraw/zinc/94/65/78/648946578.db2.gz YIZHUMQLIRSXOP-UHFFFAOYSA-N -1 3 285.265 2.583 20 10 CFCDHM Cc1noc(C)c1[C@H](C)C(=O)NCc1c([O-])cccc1F ZINC000928712353 648946849 /nfs/dbraw/zinc/94/68/49/648946849.db2.gz RYCTZBYSNLPKLA-QMMMGPOBSA-N -1 3 292.310 2.556 20 10 CFCDHM [O-]c1cc(Cl)ccc1CN1CCOC2(CCC2)C1 ZINC001204607879 775116287 /nfs/dbraw/zinc/11/62/87/775116287.db2.gz AEAQHNPOLRSHLX-UHFFFAOYSA-N -1 3 267.756 2.801 20 10 CFCDHM O=C([O-])c1ccc(C[N@@H+]2CCC[C@H]3CCC[C@H]32)c([O-])c1 ZINC001231455912 777222642 /nfs/dbraw/zinc/22/26/42/777222642.db2.gz XLYDYYLCLPKJGF-BXUZGUMPSA-N -1 3 275.348 2.855 20 10 CFCDHM O=C([O-])c1ccc(C[N@H+]2CCC[C@H]3CCC[C@H]32)c([O-])c1 ZINC001231455912 777222655 /nfs/dbraw/zinc/22/26/55/777222655.db2.gz XLYDYYLCLPKJGF-BXUZGUMPSA-N -1 3 275.348 2.855 20 10 CFCDHM C[N@H+](Cc1cccs1)Cc1ccc(C(=O)[O-])cc1[O-] ZINC001231452435 777223656 /nfs/dbraw/zinc/22/36/56/777223656.db2.gz PCJSXZOMUHPKDQ-UHFFFAOYSA-N -1 3 277.345 2.784 20 10 CFCDHM C[N@@H+](Cc1cccs1)Cc1ccc(C(=O)[O-])cc1[O-] ZINC001231452435 777223663 /nfs/dbraw/zinc/22/36/63/777223663.db2.gz PCJSXZOMUHPKDQ-UHFFFAOYSA-N -1 3 277.345 2.784 20 10 CFCDHM O=C([O-])c1ccc(C[N@@H+]2CCCCC23CC3)c([O-])c1 ZINC001231452151 777223833 /nfs/dbraw/zinc/22/38/33/777223833.db2.gz BNUGJZOGZWUDAT-UHFFFAOYSA-N -1 3 261.321 2.609 20 10 CFCDHM O=C([O-])c1ccc(C[N@H+]2CCCCC23CC3)c([O-])c1 ZINC001231452151 777223844 /nfs/dbraw/zinc/22/38/44/777223844.db2.gz BNUGJZOGZWUDAT-UHFFFAOYSA-N -1 3 261.321 2.609 20 10 CFCDHM O=C([O-])c1ccc([O-])c(C[NH+]2C[C@@H]3CCCC[C@H]3C2)c1 ZINC001231561310 777260251 /nfs/dbraw/zinc/26/02/51/777260251.db2.gz RXDQYCXOYHODOY-STQMWFEESA-N -1 3 275.348 2.712 20 10 CFCDHM C[N@@H+](Cc1cc(C(=O)[O-])ccc1[O-])C[C@H]1CC1(C)C ZINC001231566131 777261773 /nfs/dbraw/zinc/26/17/73/777261773.db2.gz RNHCRHRDLGCNHZ-GFCCVEGCSA-N -1 3 263.337 2.568 20 10 CFCDHM C[N@H+](Cc1cc(C(=O)[O-])ccc1[O-])C[C@H]1CC1(C)C ZINC001231566131 777261776 /nfs/dbraw/zinc/26/17/76/777261776.db2.gz RNHCRHRDLGCNHZ-GFCCVEGCSA-N -1 3 263.337 2.568 20 10 CFCDHM COc1cc([O-])c(CN2CCOC[C@@H]2C2CC2)cc1Cl ZINC001232267451 777499167 /nfs/dbraw/zinc/49/91/67/777499167.db2.gz CBMYHXBBCUFZON-CYBMUJFWSA-N -1 3 297.782 2.665 20 10 CFCDHM COc1cc([O-])c(CN2CCCC(=O)[C@@H](C)C2)cc1Cl ZINC001232265936 777499411 /nfs/dbraw/zinc/49/94/11/777499411.db2.gz HLIODDPPTWXTNC-JTQLQIEISA-N -1 3 297.782 2.855 20 10 CFCDHM COc1cc([O-])c(CN2CCC(=O)[C@H](C)CC2)cc1Cl ZINC001232267003 777499521 /nfs/dbraw/zinc/49/95/21/777499521.db2.gz USHPSHWORUGHPR-SNVBAGLBSA-N -1 3 297.782 2.855 20 10 CFCDHM CCCO[C@H]1CCN(Cc2c([O-])ccc(F)c2F)C1 ZINC001233334536 777892969 /nfs/dbraw/zinc/89/29/69/777892969.db2.gz LARYLRUFQLUJQG-JTQLQIEISA-N -1 3 271.307 2.671 20 10 CFCDHM CCOCC1CCN(Cc2c([O-])ccc(F)c2F)CC1 ZINC001233335084 777894506 /nfs/dbraw/zinc/89/45/06/777894506.db2.gz GXNTXCPLTHVMGB-UHFFFAOYSA-N -1 3 285.334 2.919 20 10 CFCDHM CC(C)(CNC(=O)c1cccc(O)c1[O-])C(C)(F)F ZINC000697313933 778181074 /nfs/dbraw/zinc/18/10/74/778181074.db2.gz RPGWBUNHCGDMRK-UHFFFAOYSA-N -1 3 273.279 2.509 20 10 CFCDHM CC(=O)OC1CN(Cc2cccc(-c3ccccc3)c2[O-])C1 ZINC001234996052 778349104 /nfs/dbraw/zinc/34/91/04/778349104.db2.gz TYVAXZMNXMOTFT-UHFFFAOYSA-N -1 3 297.354 2.807 20 10 CFCDHM [O-]c1cc(F)c(F)cc1CN1CCC(n2cccn2)CC1 ZINC001142527180 778401900 /nfs/dbraw/zinc/40/19/00/778401900.db2.gz NKXUGUNKOGZVRM-UHFFFAOYSA-N -1 3 293.317 2.704 20 10 CFCDHM [O-]c1ccc(F)cc1CN1CCO[C@@H](CC(F)(F)F)C1 ZINC000698222648 778767094 /nfs/dbraw/zinc/76/70/94/778767094.db2.gz WNIWDDDHSAQRLK-NSHDSACASA-N -1 3 293.260 2.685 20 10 CFCDHM C[C@H]1CN(Cc2cc(Cl)c(Cl)cc2[O-])C[C@H]1O ZINC001236793120 778939178 /nfs/dbraw/zinc/93/91/78/778939178.db2.gz IBMZWOCYXHUMJD-JVXZTZIISA-N -1 3 276.163 2.512 20 10 CFCDHM C[C@H]1CN(Cc2cc(Cl)c(Cl)cc2[O-])C[C@@H]1O ZINC001236793122 778939496 /nfs/dbraw/zinc/93/94/96/778939496.db2.gz IBMZWOCYXHUMJD-MADCSZMMSA-N -1 3 276.163 2.512 20 10 CFCDHM C[C@]1(O)CCN(Cc2c([O-])ccc(Cl)c2Cl)C1 ZINC001237078767 779003346 /nfs/dbraw/zinc/00/33/46/779003346.db2.gz WXJILUASFQOUBJ-LBPRGKRZSA-N -1 3 276.163 2.656 20 10 CFCDHM C[C@]1(CO)CCN(Cc2c([O-])ccc(Cl)c2Cl)C1 ZINC001237078199 779006812 /nfs/dbraw/zinc/00/68/12/779006812.db2.gz PFSOJRDNEOHQJF-ZDUSSCGKSA-N -1 3 290.190 2.903 20 10 CFCDHM CCN(CCOC)Cc1c([O-])ccc(F)c1Cl ZINC001237122868 779020313 /nfs/dbraw/zinc/02/03/13/779020313.db2.gz ZWFZRIFJARQSQL-UHFFFAOYSA-N -1 3 261.724 2.653 20 10 CFCDHM CCN1CCN(Cc2cccc(C(F)(F)F)c2[O-])CC1 ZINC001233415960 779041156 /nfs/dbraw/zinc/04/11/56/779041156.db2.gz PZMGBJYBVIAUHQ-UHFFFAOYSA-N -1 3 288.313 2.549 20 10 CFCDHM [O-]c1cccc(Cl)c1CN1CCO[C@@H](C(F)(F)F)C1 ZINC000698953949 779110674 /nfs/dbraw/zinc/11/06/74/779110674.db2.gz SYVNGCMVTDFMHN-LLVKDONJSA-N -1 3 295.688 2.809 20 10 CFCDHM O=C1CCC[C@@H]2CN(Cc3cc(F)cc(Cl)c3[O-])C[C@H]12 ZINC001237800336 779181361 /nfs/dbraw/zinc/18/13/61/779181361.db2.gz JMQRQTGLBCPSST-SKDRFNHKSA-N -1 3 297.757 2.986 20 10 CFCDHM C[C@H]1CCCN(Cc2cc(F)cc(Cl)c2[O-])[C@H]1CO ZINC001237808968 779185676 /nfs/dbraw/zinc/18/56/76/779185676.db2.gz XGJKGBCCBFSBQI-ZANVPECISA-N -1 3 287.762 2.778 20 10 CFCDHM [O-]c1c(Cl)cc(F)cc1CN1CCCC[C@H]1CO ZINC001237809714 779186157 /nfs/dbraw/zinc/18/61/57/779186157.db2.gz KTBKCXDVCUECPH-NSHDSACASA-N -1 3 273.735 2.532 20 10 CFCDHM [O-]c1cc(Br)ccc1CNCC(F)F ZINC000691394340 779395526 /nfs/dbraw/zinc/39/55/26/779395526.db2.gz CWZYOPSYJUSHLL-UHFFFAOYSA-N -1 3 266.085 2.509 20 10 CFCDHM [O-]c1cccc(Br)c1CN1CCC(F)(F)C1 ZINC000707134371 781226922 /nfs/dbraw/zinc/22/69/22/781226922.db2.gz JNMKJSXCNJENBY-UHFFFAOYSA-N -1 3 292.123 2.996 20 10 CFCDHM CO[C@H]1CC[C@H](C)N(Cc2cc(F)cc(F)c2[O-])C1 ZINC000708414218 781273529 /nfs/dbraw/zinc/27/35/29/781273529.db2.gz PKUOOBTWVOFSDV-CABZTGNLSA-N -1 3 271.307 2.670 20 10 CFCDHM CCOC(=O)c1ccc(CN(C)Cc2ccccc2[O-])o1 ZINC000091974645 375073086 /nfs/dbraw/zinc/07/30/86/375073086.db2.gz VSKQHFHJUNSKGO-UHFFFAOYSA-N -1 3 289.331 2.794 20 10 CFCDHM Cc1noc(C)c1CN[C@H](C)c1ccc(F)cc1[O-] ZINC000092328756 375101854 /nfs/dbraw/zinc/10/18/54/375101854.db2.gz VVTDBNFXKNXPOX-MRVPVSSYSA-N -1 3 264.300 2.987 20 10 CFCDHM Cc1ccc(C(=O)N2CCS[C@H](C(C)C)C2)c([O-])c1O ZINC000179525727 380552177 /nfs/dbraw/zinc/55/21/77/380552177.db2.gz NHEZMUDCCYXDFS-LBPRGKRZSA-N -1 3 295.404 2.620 20 10 CFCDHM CCOCCO[C@H]1CCN(Cc2cccc(Cl)c2[O-])C1 ZINC000180769770 380697984 /nfs/dbraw/zinc/69/79/84/380697984.db2.gz KNHGWXHAMDPEAA-ZDUSSCGKSA-N -1 3 299.798 2.673 20 10 CFCDHM CSCC1CCC(NC(=O)c2cccc(O)c2[O-])CC1 ZINC000295370412 380815318 /nfs/dbraw/zinc/81/53/18/380815318.db2.gz DLFUYNCCJSYFFF-UHFFFAOYSA-N -1 3 295.404 2.749 20 10 CFCDHM Cc1ccc(C(=O)N2CCCc3ccccc3C2)c([O-])c1O ZINC000182396525 381081841 /nfs/dbraw/zinc/08/18/41/381081841.db2.gz ILBAWUIWCYESFB-UHFFFAOYSA-N -1 3 297.354 2.995 20 10 CFCDHM Cc1ccc(C(=O)N2C[C@H](C)CC[C@H]2C)c([O-])c1O ZINC000182534485 381107304 /nfs/dbraw/zinc/10/73/04/381107304.db2.gz JPBCNPMGPSSAIL-MWLCHTKSSA-N -1 3 263.337 2.667 20 10 CFCDHM CCc1nnc(NCc2c([O-])cccc2Cl)o1 ZINC000296149519 381276905 /nfs/dbraw/zinc/27/69/05/381276905.db2.gz WQSLQKHPBSECEE-UHFFFAOYSA-N -1 3 253.689 2.603 20 10 CFCDHM C[C@H]1COCCN(Cc2cc(Cl)ccc2[O-])C1 ZINC000359878466 381655034 /nfs/dbraw/zinc/65/50/34/381655034.db2.gz RGCNWBHQUQUMPY-SNVBAGLBSA-N -1 3 255.745 2.514 20 10 CFCDHM [O-]c1c(F)cccc1CN1CC[C@@H](O)c2ccccc2C1 ZINC000371875986 381715401 /nfs/dbraw/zinc/71/54/01/381715401.db2.gz IJRRZIFMIBCVCT-MRXNPFEDSA-N -1 3 287.334 2.971 20 10 CFCDHM Cc1ccc(C(=O)N2CC=C(c3ccccc3)C2)c([O-])c1O ZINC000371674092 381674974 /nfs/dbraw/zinc/67/49/74/381674974.db2.gz DFEILOBOPIUNFN-UHFFFAOYSA-N -1 3 295.338 2.946 20 10 CFCDHM C[C@H](N[C@H](CCO)c1ccco1)c1cc(F)ccc1[O-] ZINC000186534885 381939410 /nfs/dbraw/zinc/93/94/10/381939410.db2.gz QXIRLINVESHVGI-GXFFZTMASA-N -1 3 279.311 2.899 20 10 CFCDHM Cc1ccc(C(=O)N2C[C@@H]3CCCCC[C@@H]32)c([O-])c1O ZINC000374771684 382056212 /nfs/dbraw/zinc/05/62/12/382056212.db2.gz PBUMPNAVFGDQAJ-AAEUAGOBSA-N -1 3 275.348 2.811 20 10 CFCDHM C[C@@H]1CCN(C(=O)c2cccc(O)c2[O-])CC12CCC2 ZINC000375693378 382096518 /nfs/dbraw/zinc/09/65/18/382096518.db2.gz RSSPJPHDNVERIC-LLVKDONJSA-N -1 3 275.348 2.750 20 10 CFCDHM CC(C)[C@@H](C)N(C(=O)c1cccc(O)c1[O-])C1CC1 ZINC000188281284 382382301 /nfs/dbraw/zinc/38/23/01/382382301.db2.gz CLPHOCZMOOPZAO-SNVBAGLBSA-N -1 3 263.337 2.747 20 10 CFCDHM Cc1ccoc1CN(C)C(=O)c1ccc(C)c(O)c1[O-] ZINC000294149291 382435061 /nfs/dbraw/zinc/43/50/61/382435061.db2.gz PZAFTVITOVFDQB-UHFFFAOYSA-N -1 3 275.304 2.580 20 10 CFCDHM O=C(c1cccc(O)c1[O-])N1C[C@@H]2CCCCCC[C@@H]21 ZINC000365759056 382437953 /nfs/dbraw/zinc/43/79/53/382437953.db2.gz QUTDMDPWOJXDKU-AAEUAGOBSA-N -1 3 275.348 2.893 20 10 CFCDHM [O-]c1ccc(Cl)cc1CN[C@@H]1CCCc2c[nH]nc21 ZINC000378164143 382410829 /nfs/dbraw/zinc/41/08/29/382410829.db2.gz KXPKIVSKGPVLMS-GFCCVEGCSA-N -1 3 277.755 2.936 20 10 CFCDHM CCCN(Cc1ccccc1[O-])Cc1nccnc1OC ZINC000294763810 382526891 /nfs/dbraw/zinc/52/68/91/382526891.db2.gz IXGACQVDIXCHHM-UHFFFAOYSA-N -1 3 287.363 2.603 20 10 CFCDHM CC(=O)c1cc(F)cc(CN2CCSC[C@@H](C)C2)c1[O-] ZINC000190429649 382667816 /nfs/dbraw/zinc/66/78/16/382667816.db2.gz BQJLHJYZLCLQSH-JTQLQIEISA-N -1 3 297.395 2.919 20 10 CFCDHM C[C@@H](N[C@@H](C)C(=O)N1CCCC1)c1cc(Cl)ccc1[O-] ZINC000281526669 385198163 /nfs/dbraw/zinc/19/81/63/385198163.db2.gz IBKSYLPDFHCBMF-MNOVXSKESA-N -1 3 296.798 2.707 20 10 CFCDHM C[C@H](NCc1ncnn1C(C)(C)C)c1ccccc1[O-] ZINC000282680034 385368850 /nfs/dbraw/zinc/36/88/50/385368850.db2.gz JPSHPAGDTVMTQD-NSHDSACASA-N -1 3 274.368 2.590 20 10 CFCDHM C[C@@H](NCc1ncnn1C(C)(C)C)c1ccccc1[O-] ZINC000282680029 385369191 /nfs/dbraw/zinc/36/91/91/385369191.db2.gz JPSHPAGDTVMTQD-LLVKDONJSA-N -1 3 274.368 2.590 20 10 CFCDHM [O-]c1ccccc1CN1CCO[C@H](c2ccccc2)C1 ZINC000271305347 385379213 /nfs/dbraw/zinc/37/92/13/385379213.db2.gz UCSCRMMYIFBJSF-KRWDZBQOSA-N -1 3 269.344 2.966 20 10 CFCDHM COc1c(O)cccc1CN(C)Cc1ccccc1[O-] ZINC000272256690 385490047 /nfs/dbraw/zinc/49/00/47/385490047.db2.gz JLGXENHJQKYBPT-UHFFFAOYSA-N -1 3 273.332 2.738 20 10 CFCDHM Cc1ccc(C(=O)N(CC(F)F)C(C)C)c([O-])c1O ZINC000272753120 385604502 /nfs/dbraw/zinc/60/45/02/385604502.db2.gz OPQXRNRFQCUVLP-UHFFFAOYSA-N -1 3 273.279 2.522 20 10 CFCDHM CC[C@H](NCc1cnn(CC)c1)c1ccc(F)cc1[O-] ZINC000286292729 385584135 /nfs/dbraw/zinc/58/41/35/385584135.db2.gz WSKVNIWBOARRCF-AWEZNQCLSA-N -1 3 277.343 2.989 20 10 CFCDHM CCOC1CC(N(C)Cc2cc(F)cc(C(C)=O)c2[O-])C1 ZINC000286690326 385687150 /nfs/dbraw/zinc/68/71/50/385687150.db2.gz CZSSXGXFRVVHRV-UHFFFAOYSA-N -1 3 295.354 2.733 20 10 CFCDHM C[C@H](NC(=O)CN(C)Cc1ccccc1[O-])c1ccccc1 ZINC000109772330 393879657 /nfs/dbraw/zinc/87/96/57/393879657.db2.gz KFPAINJBHVRUHS-AWEZNQCLSA-N -1 3 298.386 2.701 20 10 CFCDHM CCc1noc(C)c1CN(C)Cc1ccccc1[O-] ZINC000119064408 393913244 /nfs/dbraw/zinc/91/32/44/393913244.db2.gz MOKGDYUUKDXEDU-UHFFFAOYSA-N -1 3 260.337 2.883 20 10 CFCDHM C[C@H](N[C@@H](C)c1cc(Cl)ccc1[O-])C(=O)N1CCCC1 ZINC000281529023 394078002 /nfs/dbraw/zinc/07/80/02/394078002.db2.gz IBKSYLPDFHCBMF-QWRGUYRKSA-N -1 3 296.798 2.707 20 10 CFCDHM Cc1ccc(C(=O)N2CCC(F)(F)[C@H](C)C2)c([O-])c1O ZINC000292574763 292050425 /nfs/dbraw/zinc/05/04/25/292050425.db2.gz GCBNOOOOKRBWJW-SECBINFHSA-N -1 3 285.290 2.524 20 10 CFCDHM Cc1ccc(C(=O)N2[C@H](C)CCC[C@@H]2C)c([O-])c1O ZINC000182378471 292070688 /nfs/dbraw/zinc/07/06/88/292070688.db2.gz SPGWRLFMJWPPJM-PHIMTYICSA-N -1 3 263.337 2.809 20 10 CFCDHM C[C@@H]1COCCN(Cc2cccc(Cl)c2[O-])C1 ZINC000378445509 297119555 /nfs/dbraw/zinc/11/95/55/297119555.db2.gz UPLGAVXJCLCJJW-JTQLQIEISA-N -1 3 255.745 2.514 20 10 CFCDHM CC[C@@H](N[C@@H](C)c1ncnn1C)c1ccc(C)cc1[O-] ZINC000280119700 276438475 /nfs/dbraw/zinc/43/84/75/276438475.db2.gz OFAPJBKVHRGXFP-WCQYABFASA-N -1 3 274.368 2.631 20 10 CFCDHM CC(=O)c1cc(Cl)cc(CN2CCCO[C@H](C)C2)c1[O-] ZINC000061919678 278244012 /nfs/dbraw/zinc/24/40/12/278244012.db2.gz UHNQBRRPOAJHMW-SNVBAGLBSA-N -1 3 297.782 2.859 20 10 CFCDHM Cc1ccc(C(=O)N2CCC[C@@H](C)CC2)c([O-])c1O ZINC000177677167 301502190 /nfs/dbraw/zinc/50/21/90/301502190.db2.gz QHSXDZZBVMDAEU-SNVBAGLBSA-N -1 3 263.337 2.668 20 10 CFCDHM CCn1ncc(CN[C@@H](C)c2ccc(Cl)cc2[O-])n1 ZINC000527923936 330296194 /nfs/dbraw/zinc/29/61/94/330296194.db2.gz CXDYASLDYPSEIQ-VIFPVBQESA-N -1 3 280.759 2.508 20 10 CFCDHM C[C@H]1CN(C(=O)/C=C/c2cncc([O-])c2)c2ccccc2O1 ZINC000492435237 332397412 /nfs/dbraw/zinc/39/74/12/332397412.db2.gz FHRSDZQXRBWJMJ-SYTKJHMZSA-N -1 3 296.326 2.615 20 10 CFCDHM CCCN(Cc1ccccc1[O-])[C@H](C)C(=O)OCC ZINC000076074182 521691081 /nfs/dbraw/zinc/69/10/81/521691081.db2.gz ZTKAQIKJPBGTBF-GFCCVEGCSA-N -1 3 265.353 2.556 20 10 CFCDHM CC(=O)c1cc(Cl)cc(CN2CCC[C@@H](O)CC2)c1[O-] ZINC000292981438 518279442 /nfs/dbraw/zinc/27/94/42/518279442.db2.gz BISOMVIRRUGHCR-CYBMUJFWSA-N -1 3 297.782 2.595 20 10 CFCDHM CC(=O)c1cc(Cl)cc(CN(C)C2(CO)CCC2)c1[O-] ZINC000292131967 518280020 /nfs/dbraw/zinc/28/00/20/518280020.db2.gz LKBNGXAELNZQRA-UHFFFAOYSA-N -1 3 297.782 2.595 20 10 CFCDHM CC(=O)c1cc(F)cc(CN(C(C)C)[C@H]2CCOC2)c1[O-] ZINC000291710425 518285073 /nfs/dbraw/zinc/28/50/73/518285073.db2.gz INRUHTOMCCUDRO-AWEZNQCLSA-N -1 3 295.354 2.733 20 10 CFCDHM CCN(CC(=O)OC)Cc1c([O-])ccc2ccccc21 ZINC000264120648 520385033 /nfs/dbraw/zinc/38/50/33/520385033.db2.gz XCHFBGSYNCFBMD-UHFFFAOYSA-N -1 3 273.332 2.540 20 10 CFCDHM CCC[C@@H]1CCCN(C(=O)c2cccc(O)c2[O-])C1 ZINC000193132715 520824508 /nfs/dbraw/zinc/82/45/08/520824508.db2.gz OXCYOFKOBXMEMG-LLVKDONJSA-N -1 3 263.337 2.750 20 10 CFCDHM CCN(Cc1c([O-])cccc1Cl)C[C@@H](C)OC ZINC000291012863 521281864 /nfs/dbraw/zinc/28/18/64/521281864.db2.gz BEWOCPVWDXFMIL-SNVBAGLBSA-N -1 3 257.761 2.902 20 10 CFCDHM COCCc1ccnc(NCc2cc(F)ccc2[O-])c1 ZINC000289792182 522027509 /nfs/dbraw/zinc/02/75/09/522027509.db2.gz SCMAKOXXTRLYFP-UHFFFAOYSA-N -1 3 276.311 2.727 20 10 CFCDHM COc1cc(CN[C@H](C)c2ccc(F)c(F)c2[O-])ccn1 ZINC000191197128 522485002 /nfs/dbraw/zinc/48/50/02/522485002.db2.gz JLBAPSFDBVKZLH-SECBINFHSA-N -1 3 294.301 2.925 20 10 CFCDHM COc1cc(Cl)cc(CN2CCOC[C@@H](C)C2)c1[O-] ZINC000360334044 522536062 /nfs/dbraw/zinc/53/60/62/522536062.db2.gz JUSBWZAXWXWKHS-JTQLQIEISA-N -1 3 285.771 2.523 20 10 CFCDHM CN(Cc1cccc(F)c1[O-])C[C@@H]1CCCCO1 ZINC000160205506 523314802 /nfs/dbraw/zinc/31/48/02/523314802.db2.gz IOXYAUCQDVUKFI-LBPRGKRZSA-N -1 3 253.317 2.532 20 10 CFCDHM Cc1cc(Cl)cc(CN2CC3(C2)CCOC3)c1[O-] ZINC000293862194 524861751 /nfs/dbraw/zinc/86/17/51/524861751.db2.gz CCJOUTUQSNJYRQ-UHFFFAOYSA-N -1 3 267.756 2.576 20 10 CFCDHM Cc1cc(Cl)cc(CN2CCC[C@](F)(CO)C2)c1[O-] ZINC000289678607 524866611 /nfs/dbraw/zinc/86/66/11/524866611.db2.gz DXMHLZVAFQKASP-CQSZACIVSA-N -1 3 287.762 2.650 20 10 CFCDHM COc1ncccc1CN[C@H](C)c1ccc(F)cc1[O-] ZINC000062747643 525062124 /nfs/dbraw/zinc/06/21/24/525062124.db2.gz VQJCEBRYMIIFEL-SNVBAGLBSA-N -1 3 276.311 2.786 20 10 CFCDHM COc1ncccc1CN[C@H](C)c1ccc(F)c(F)c1[O-] ZINC000191198768 525064296 /nfs/dbraw/zinc/06/42/96/525064296.db2.gz VQXPDYRTTJXCNC-SECBINFHSA-N -1 3 294.301 2.925 20 10 CFCDHM [O-]c1ccc(Cl)c(F)c1CN1CC[C@@]2(CCOC2)C1 ZINC000191426261 526345379 /nfs/dbraw/zinc/34/53/79/526345379.db2.gz RABGOXCILLCLPV-CQSZACIVSA-N -1 3 285.746 2.797 20 10 CFCDHM [O-]c1ccc(F)cc1CN[C@H](C1CC1)C(F)(F)F ZINC000290236857 526350635 /nfs/dbraw/zinc/35/06/35/526350635.db2.gz UFHHHXZORAUXJZ-LLVKDONJSA-N -1 3 263.234 2.962 20 10 CFCDHM [O-]c1ccccc1CN[C@@H]1COc2cccc(F)c21 ZINC000363675915 526374627 /nfs/dbraw/zinc/37/46/27/526374627.db2.gz VCEGXMRJGCVXNU-GFCCVEGCSA-N -1 3 259.280 2.755 20 10 CFCDHM O=C(c1cccc(O)c1[O-])N1Cc2ccccc2C2(CC2)C1 ZINC000365671374 526772084 /nfs/dbraw/zinc/77/20/84/526772084.db2.gz DLUVHOSYMPAWHI-UHFFFAOYSA-N -1 3 295.338 2.785 20 10 CFCDHM O=C(Nc1cccc(-c2cn[nH]c2)c1)c1cccc(O)c1[O-] ZINC000365670245 527310541 /nfs/dbraw/zinc/31/05/41/527310541.db2.gz HSXDPPGZNUZWAA-UHFFFAOYSA-N -1 3 295.298 2.740 20 10 CFCDHM COC(=O)CN(Cc1cc(Cl)ccc1[O-])C[C@H]1C[C@H]1C ZINC000754120257 574090585 /nfs/dbraw/zinc/09/05/85/574090585.db2.gz BLCMBTZJMAFZRD-GHMZBOCLSA-N -1 3 297.782 2.677 20 10 CFCDHM O=[N+]([O-])c1ccc([O-])c(CNCc2cccc(F)c2F)c1 ZINC000730817233 574098088 /nfs/dbraw/zinc/09/80/88/574098088.db2.gz PQOGVIYUIDCRIN-UHFFFAOYSA-N -1 3 294.257 2.868 20 10 CFCDHM C[C@H](NCc1ccc(F)cn1)c1ccc(F)cc1[O-] ZINC000756659196 574127716 /nfs/dbraw/zinc/12/77/16/574127716.db2.gz PJLLDWQHGXMXDQ-VIFPVBQESA-N -1 3 264.275 2.916 20 10 CFCDHM O=C(NCc1ccc(F)cc1)c1cc([O-])cs1 ZINC000731863882 574130807 /nfs/dbraw/zinc/13/08/07/574130807.db2.gz IVQLTJUUNJDQLA-UHFFFAOYSA-N -1 3 251.282 2.523 20 10 CFCDHM CC(C)(C)c1nnc(NC(=O)c2cc([O-])cs2)s1 ZINC000731870009 574131124 /nfs/dbraw/zinc/13/11/24/574131124.db2.gz HMFNYBQTWTUFQX-UHFFFAOYSA-N -1 3 283.378 2.855 20 10 CFCDHM O=C(NCc1ccccc1OC(F)F)c1cc([O-])cs1 ZINC000731866036 574131179 /nfs/dbraw/zinc/13/11/79/574131179.db2.gz DUWCEEVQADZTFL-UHFFFAOYSA-N -1 3 299.298 2.985 20 10 CFCDHM O=C(NCCCOC1CCCCC1)c1cc([O-])cs1 ZINC000731865923 574131417 /nfs/dbraw/zinc/13/14/17/574131417.db2.gz WXSCWHMQRSIYEG-UHFFFAOYSA-N -1 3 283.393 2.923 20 10 CFCDHM O=C(Nc1cnn(Cc2ccccc2)c1)c1cc([O-])cs1 ZINC000731870679 574131498 /nfs/dbraw/zinc/13/14/98/574131498.db2.gz MNXXLVFCKCWKRO-UHFFFAOYSA-N -1 3 299.355 2.951 20 10 CFCDHM CCCCc1nnc(NC(=O)c2cc([O-])cs2)s1 ZINC000731867333 574132306 /nfs/dbraw/zinc/13/23/06/574132306.db2.gz GIWAYYRTACJFNY-UHFFFAOYSA-N -1 3 283.378 2.900 20 10 CFCDHM O=C(OCc1cccc(F)c1)c1cc([O-])cs1 ZINC000731911217 574133739 /nfs/dbraw/zinc/13/37/39/574133739.db2.gz GLGRNHWPJXRBOL-UHFFFAOYSA-N -1 3 252.266 2.950 20 10 CFCDHM CC[C@H]1CN(Cc2c([O-])ccc3ccncc32)C[C@H](C)O1 ZINC000732183984 574145047 /nfs/dbraw/zinc/14/50/47/574145047.db2.gz CFWDVLYKUDCJNU-JSGCOSHPSA-N -1 3 286.375 2.940 20 10 CFCDHM Cc1ccc(OCCNC(=O)c2cc([O-])cs2)c(C)c1 ZINC000732258532 574147409 /nfs/dbraw/zinc/14/74/09/574147409.db2.gz SVQIRHLZFCLTCX-UHFFFAOYSA-N -1 3 291.372 2.879 20 10 CFCDHM CC(=O)Nc1cccc(NC(=O)c2cc([O-])cs2)c1C ZINC000732268186 574148226 /nfs/dbraw/zinc/14/82/26/574148226.db2.gz FSJLSZSQSDTSNI-UHFFFAOYSA-N -1 3 290.344 2.973 20 10 CFCDHM C[C@@H](c1cccnc1)N(C)C(=O)c1cc([O-])cs1 ZINC000732273402 574148882 /nfs/dbraw/zinc/14/88/82/574148882.db2.gz UVUUULJUQYQMGC-VIFPVBQESA-N -1 3 262.334 2.682 20 10 CFCDHM O=C(NCc1ccc(-n2ccnc2)cc1)c1cc([O-])cs1 ZINC000732278631 574149201 /nfs/dbraw/zinc/14/92/01/574149201.db2.gz CZLMKPRZGAESCT-UHFFFAOYSA-N -1 3 299.355 2.569 20 10 CFCDHM CN(C(=O)c1cc([O-])cs1)C1Cc2ccccc2C1 ZINC000732275701 574149457 /nfs/dbraw/zinc/14/94/57/574149457.db2.gz IFSGQBFSRPYLAU-UHFFFAOYSA-N -1 3 273.357 2.693 20 10 CFCDHM CC(C)(C)SCCNC(=O)c1cc([O-])cs1 ZINC000732284689 574150212 /nfs/dbraw/zinc/15/02/12/574150212.db2.gz YFGYNACOBRDGNG-UHFFFAOYSA-N -1 3 259.396 2.715 20 10 CFCDHM O=C(NC1(c2ccccc2)CC1)c1cc([O-])cs1 ZINC000732290994 574150782 /nfs/dbraw/zinc/15/07/82/574150782.db2.gz LMBDWWGMBITQOL-UHFFFAOYSA-N -1 3 259.330 2.873 20 10 CFCDHM CC(=O)Nc1cccc(COC(=O)c2cc([O-])cs2)c1 ZINC000732353809 574152721 /nfs/dbraw/zinc/15/27/21/574152721.db2.gz WKWYKGXVUWZSAV-UHFFFAOYSA-N -1 3 291.328 2.769 20 10 CFCDHM Cc1cnc(CCN(C)C(=O)c2cc([O-])cs2)s1 ZINC000755299505 574152881 /nfs/dbraw/zinc/15/28/81/574152881.db2.gz WSQZFYGDZNSWKQ-UHFFFAOYSA-N -1 3 282.390 2.533 20 10 CFCDHM Cc1ccccc1C(=O)COC(=O)c1cc([O-])cs1 ZINC000732354006 574153221 /nfs/dbraw/zinc/15/32/21/574153221.db2.gz YGGBKFVHVYVGQU-UHFFFAOYSA-N -1 3 276.313 2.802 20 10 CFCDHM Cc1cc([O-])c(C[N@@H+](C[C@@H](C)C(=O)[O-])C2CC2)cc1C ZINC000738463428 574170464 /nfs/dbraw/zinc/17/04/64/574170464.db2.gz BWKFGQQKMKWCTI-GFCCVEGCSA-N -1 3 277.364 2.694 20 10 CFCDHM Cc1cc([O-])c(C[N@H+](C[C@@H](C)C(=O)[O-])C2CC2)cc1C ZINC000738463428 574170466 /nfs/dbraw/zinc/17/04/66/574170466.db2.gz BWKFGQQKMKWCTI-GFCCVEGCSA-N -1 3 277.364 2.694 20 10 CFCDHM O=C([O-])CC[N@H+](Cc1ccccc1[O-])C1CCCC1 ZINC000738587813 574174702 /nfs/dbraw/zinc/17/47/02/574174702.db2.gz RQYUDRANVJUVKJ-UHFFFAOYSA-N -1 3 263.337 2.612 20 10 CFCDHM O=C([O-])CC[N@@H+](Cc1ccccc1[O-])C1CCCC1 ZINC000738587813 574174707 /nfs/dbraw/zinc/17/47/07/574174707.db2.gz RQYUDRANVJUVKJ-UHFFFAOYSA-N -1 3 263.337 2.612 20 10 CFCDHM Cc1ncsc1CN[C@@H](C)c1cc([N+](=O)[O-])ccc1[O-] ZINC000756547664 574245508 /nfs/dbraw/zinc/24/55/08/574245508.db2.gz FSKZHDBFZVDLQA-QMMMGPOBSA-N -1 3 293.348 2.916 20 10 CFCDHM C[C@H](NCc1cccc(F)n1)c1cc(F)ccc1[O-] ZINC000756768804 574261013 /nfs/dbraw/zinc/26/10/13/574261013.db2.gz MWMVYHXRRDJZND-VIFPVBQESA-N -1 3 264.275 2.916 20 10 CFCDHM CC(C)CSCCCNC(=O)c1cc([O-])cs1 ZINC000756810768 574264583 /nfs/dbraw/zinc/26/45/83/574264583.db2.gz PNYXYBUSLSVBGY-UHFFFAOYSA-N -1 3 273.423 2.963 20 10 CFCDHM O=C(c1cc([O-])cs1)N(CC1CC1)CC1CC1 ZINC000734555553 574292895 /nfs/dbraw/zinc/29/28/95/574292895.db2.gz XNWCRWGIZIPFSJ-UHFFFAOYSA-N -1 3 251.351 2.716 20 10 CFCDHM CC[C@H](NC(=O)c1cc([O-])cs1)c1ccncc1 ZINC000743502822 574367359 /nfs/dbraw/zinc/36/73/59/574367359.db2.gz JQSDDBKZYRJJJN-NSHDSACASA-N -1 3 262.334 2.730 20 10 CFCDHM C[C@H](CCc1cccn1C)NC(=O)c1cc([O-])cs1 ZINC000743712611 574371113 /nfs/dbraw/zinc/37/11/13/574371113.db2.gz WEXLGABPKVGZEY-SNVBAGLBSA-N -1 3 278.377 2.543 20 10 CFCDHM C[C@H](CNC(=O)c1cc([O-])cs1)Oc1cccc(F)c1 ZINC000743716737 574371296 /nfs/dbraw/zinc/37/12/96/574371296.db2.gz LLZIIIJWXSICIT-SECBINFHSA-N -1 3 295.335 2.790 20 10 CFCDHM CC(C)[C@@H]1CN(C(=O)c2cc([O-])cs2)CCS1 ZINC000743788826 574372190 /nfs/dbraw/zinc/37/21/90/574372190.db2.gz SBBUWGYANZYNIE-NSHDSACASA-N -1 3 271.407 2.667 20 10 CFCDHM CS[C@H](CNC(=O)c1cc([O-])cs1)C(C)(C)C ZINC000753473849 574402949 /nfs/dbraw/zinc/40/29/49/574402949.db2.gz MGNZLSOOFTTXOL-SNVBAGLBSA-N -1 3 273.423 2.961 20 10 CFCDHM C[C@H]1C[N@H+](Cc2c([O-])ccc3ccccc32)C[C@H]1C(=O)[O-] ZINC000251875389 601816850 /nfs/dbraw/zinc/81/68/50/601816850.db2.gz UJISWMXXHFLTFH-SMDDNHRTSA-N -1 3 285.343 2.698 20 10 CFCDHM C[C@H]1C[N@@H+](Cc2c([O-])ccc3ccccc32)C[C@H]1C(=O)[O-] ZINC000251875389 601816852 /nfs/dbraw/zinc/81/68/52/601816852.db2.gz UJISWMXXHFLTFH-SMDDNHRTSA-N -1 3 285.343 2.698 20 10 CFCDHM COc1ccc(O)c([C@@H](C)NCc2cc(C(=O)[O-])co2)c1 ZINC000833733599 605127108 /nfs/dbraw/zinc/12/71/08/605127108.db2.gz LAYRXQCOUJXSRC-SECBINFHSA-N -1 3 291.303 2.543 20 10 CFCDHM COc1ccc(O)c([C@@H](C)NCc2occc2C(=O)[O-])c1 ZINC000833733743 605127717 /nfs/dbraw/zinc/12/77/17/605127717.db2.gz OKCFCZRURWXQEV-SECBINFHSA-N -1 3 291.303 2.543 20 10 CFCDHM O=C(NCC[C@@H]1CC[C@H]2C[C@H]21)NCc1c([O-])cccc1F ZINC000924407809 617970405 /nfs/dbraw/zinc/97/04/05/617970405.db2.gz KSWUSVJOMDRWCO-SRVKXCTJSA-N -1 3 292.354 2.767 20 10 CFCDHM Cc1cccc(NC(=O)c2ccc(C)c(O)c2[O-])c1 ZINC000177658903 618004239 /nfs/dbraw/zinc/00/42/39/618004239.db2.gz CHLRAQAWVSBXKL-UHFFFAOYSA-N -1 3 257.289 2.967 20 10 CFCDHM Cc1ccc(C(=O)Nc2ccc(Cl)nc2)c([O-])c1O ZINC000179410403 618272335 /nfs/dbraw/zinc/27/23/35/618272335.db2.gz KVYFAXSLHNJJPK-UHFFFAOYSA-N -1 3 278.695 2.707 20 10 CFCDHM O=C(Nc1cc(C2CCCC2)[nH]n1)c1cccc(O)c1[O-] ZINC000193077812 618448795 /nfs/dbraw/zinc/44/87/95/618448795.db2.gz HQLITIYUOSUNSI-UHFFFAOYSA-N -1 3 287.319 2.731 20 10 CFCDHM CC1(C)CN(Cc2cc(Cl)cc(F)c2[O-])CC[C@@H]1O ZINC000783730150 618721673 /nfs/dbraw/zinc/72/16/73/618721673.db2.gz QSBMJLQIDCXNSC-LBPRGKRZSA-N -1 3 287.762 2.778 20 10 CFCDHM [O-]c1c(F)cc(F)cc1CN1CC(C2CCOCC2)C1 ZINC000894669603 619439423 /nfs/dbraw/zinc/43/94/23/619439423.db2.gz ZSAVUKDLDBGZSN-UHFFFAOYSA-N -1 3 283.318 2.529 20 10 CFCDHM CC(C)Oc1cc(NCc2c([O-])cccc2F)ncn1 ZINC000895832625 619619455 /nfs/dbraw/zinc/61/94/55/619619455.db2.gz JIJCDJTYBOWIIL-UHFFFAOYSA-N -1 3 277.299 2.721 20 10 CFCDHM CCC[C@@H](C)CC(=O)NCc1c([O-])cccc1F ZINC000928712635 619997220 /nfs/dbraw/zinc/99/72/20/619997220.db2.gz UXRYGRYJCCDWHN-SNVBAGLBSA-N -1 3 253.317 2.974 20 10 CFCDHM Cc1cc([O-])c(CNc2cc(C)cn(C)c2=O)c(Cl)c1 ZINC000902260083 621008400 /nfs/dbraw/zinc/00/84/00/621008400.db2.gz PKMJZHUPJTYXLS-UHFFFAOYSA-N -1 3 292.766 2.973 20 10 CFCDHM [O-]c1c(Br)cccc1CN1CC2(CC2)C1 ZINC000824534034 623519898 /nfs/dbraw/zinc/51/98/98/623519898.db2.gz XXYZYXXXQKKKOE-UHFFFAOYSA-N -1 3 268.154 2.751 20 10 CFCDHM Cc1cc([O-])c(CN2C[C@H](C)OC[C@H]2C)cc1Cl ZINC000824576075 623525906 /nfs/dbraw/zinc/52/59/06/623525906.db2.gz ZNJVFCLHWGTHRC-MNOVXSKESA-N -1 3 269.772 2.963 20 10 CFCDHM Cc1cc([O-])c(CN2CCOC[C@@H]2C)cc1Cl ZINC000824594061 623530006 /nfs/dbraw/zinc/53/00/06/623530006.db2.gz XHWRDHAWHZSPEA-JTQLQIEISA-N -1 3 255.745 2.575 20 10 CFCDHM Cc1cc([O-])c(CN2CCO[C@H](C)[C@H]2C)cc1Cl ZINC000824815103 623570540 /nfs/dbraw/zinc/57/05/40/623570540.db2.gz ZNRIVPWBUMWRIL-GHMZBOCLSA-N -1 3 269.772 2.963 20 10 CFCDHM Cc1cc([O-])c(CN(C)Cc2nccn2C)cc1Cl ZINC000825450961 623696343 /nfs/dbraw/zinc/69/63/43/623696343.db2.gz OTDYYHQMKSGDCY-UHFFFAOYSA-N -1 3 279.771 2.720 20 10 CFCDHM CCOC(=O)[C@H]1CCCN1Cc1cc(Cl)c(C)cc1[O-] ZINC000825526610 623708810 /nfs/dbraw/zinc/70/88/10/623708810.db2.gz SVUKHAAQXIQXAN-CYBMUJFWSA-N -1 3 297.782 2.882 20 10 CFCDHM COCCCOC1CN(Cc2cc(Cl)c(C)cc2[O-])C1 ZINC000826113107 623794310 /nfs/dbraw/zinc/79/43/10/623794310.db2.gz IKVBMZBIBHDEIV-UHFFFAOYSA-N -1 3 299.798 2.591 20 10 CFCDHM CN(Cc1c[nH]cn1)Cc1cc(Cl)c(F)cc1[O-] ZINC000826769204 623869582 /nfs/dbraw/zinc/86/95/82/623869582.db2.gz IZPCQLFWUOWUFK-UHFFFAOYSA-N -1 3 269.707 2.540 20 10 CFCDHM CN(Cc1cnc[nH]1)Cc1cc(Cl)c(F)cc1[O-] ZINC000826769204 623869588 /nfs/dbraw/zinc/86/95/88/623869588.db2.gz IZPCQLFWUOWUFK-UHFFFAOYSA-N -1 3 269.707 2.540 20 10 CFCDHM Cc1nnc(CN(C)Cc2c([O-])cc(C)cc2Cl)o1 ZINC000827039473 623928381 /nfs/dbraw/zinc/92/83/81/623928381.db2.gz VTRKMNOFFRRSAS-UHFFFAOYSA-N -1 3 281.743 2.677 20 10 CFCDHM [O-]c1ccc(F)cc1CN1CCOc2ccc(O)cc2C1 ZINC000827655716 624054323 /nfs/dbraw/zinc/05/43/23/624054323.db2.gz BMCLPBYYUZNBQD-UHFFFAOYSA-N -1 3 289.306 2.632 20 10 CFCDHM C[C@@H]1CN(Cc2c([O-])ccc(Cl)c2F)C[C@]1(C)CO ZINC000827691847 624065977 /nfs/dbraw/zinc/06/59/77/624065977.db2.gz CIGACNZXRAYBHV-YMTOWFKASA-N -1 3 287.762 2.635 20 10 CFCDHM C[C@@H](NCc1cc(Cl)c(F)cc1[O-])c1nccn1C ZINC000827722187 624075886 /nfs/dbraw/zinc/07/58/86/624075886.db2.gz BXLTYYIDRMCCNI-MRVPVSSYSA-N -1 3 283.734 2.769 20 10 CFCDHM COC(C)(C)C[C@H](C)NC(=O)NCc1c([O-])cccc1F ZINC000920527025 624739466 /nfs/dbraw/zinc/73/94/66/624739466.db2.gz KMKGSOKPSPAXGW-JTQLQIEISA-N -1 3 298.358 2.534 20 10 CFCDHM CCC[C@@H]1C[C@@H]1NC(=O)NCc1c([O-])cccc1F ZINC000921033620 624799187 /nfs/dbraw/zinc/79/91/87/624799187.db2.gz VFMWXHMIVRXYLZ-SKDRFNHKSA-N -1 3 266.316 2.519 20 10 CFCDHM C[C@H](CCC1CC1)NC(=O)NCc1c([O-])cccc1F ZINC000922019857 626197145 /nfs/dbraw/zinc/19/71/45/626197145.db2.gz PDSZQUXKIZJAER-SNVBAGLBSA-N -1 3 280.343 2.909 20 10 CFCDHM C[C@@H]1CC[C@H](NC(=O)NCc2c([O-])cccc2F)C1 ZINC000922111999 626210210 /nfs/dbraw/zinc/21/02/10/626210210.db2.gz BTHRYKCNKGGYMX-ZJUUUORDSA-N -1 3 266.316 2.519 20 10 CFCDHM CN(Cc1ccc(F)c(F)c1)C(=O)c1cccc(O)c1[O-] ZINC000186878384 626401770 /nfs/dbraw/zinc/40/17/70/626401770.db2.gz ASYUBQYFLMLGSB-UHFFFAOYSA-N -1 3 293.269 2.648 20 10 CFCDHM Cc1ccc(CNC(=O)c2cccc(O)c2[O-])c(C)c1 ZINC000186890234 626401977 /nfs/dbraw/zinc/40/19/77/626401977.db2.gz DJHNPTRTKHNCAM-UHFFFAOYSA-N -1 3 271.316 2.645 20 10 CFCDHM C[C@H]1CCC[C@@H](CNC(=O)c2cccc(O)c2[O-])C1 ZINC000228736224 626402867 /nfs/dbraw/zinc/40/28/67/626402867.db2.gz XBGVYASTMOOMCS-WDEREUQCSA-N -1 3 263.337 2.654 20 10 CFCDHM CC(C)(CNC(=O)c1cccc(O)c1[O-])c1ccccc1 ZINC000186903866 626403443 /nfs/dbraw/zinc/40/34/43/626403443.db2.gz ZMKCBUDYZDYIJN-UHFFFAOYSA-N -1 3 285.343 2.805 20 10 CFCDHM [O-]c1ccc(Cl)cc1CN1CC(OCC(F)F)C1 ZINC000839138597 626528382 /nfs/dbraw/zinc/52/83/82/626528382.db2.gz RWOIFDXPFKPEBQ-UHFFFAOYSA-N -1 3 277.698 2.512 20 10 CFCDHM C/C=C\C[C@H](NCc1cc(F)ccc1[O-])C(=O)OCC ZINC000763361499 626982277 /nfs/dbraw/zinc/98/22/77/626982277.db2.gz LLIRBEDWNGIHCK-DXTPNHAXSA-N -1 3 281.327 2.519 20 10 CFCDHM CC(=O)c1cc(F)cc(CN2CCOC(C)(C)[C@@H]2C)c1[O-] ZINC000763418322 626987452 /nfs/dbraw/zinc/98/74/52/626987452.db2.gz DYMZDEKOHACYGM-NSHDSACASA-N -1 3 295.354 2.733 20 10 CFCDHM CN(C)c1ccc(C=Cc2nccc(=O)[n-]2)cc1F ZINC000764440932 627060526 /nfs/dbraw/zinc/06/05/26/627060526.db2.gz DCHPMOSFNRYDOK-XQRVVYSFSA-N -1 3 259.284 2.558 20 10 CFCDHM CCOC(=O)CN(Cc1cc(Cl)ccc1[O-])C1CCC1 ZINC000768530786 627351194 /nfs/dbraw/zinc/35/11/94/627351194.db2.gz NMUUCRIUBDXNSN-UHFFFAOYSA-N -1 3 297.782 2.963 20 10 CFCDHM [O-]c1c(F)cc(Cl)cc1CN1CCN(C2CCC2)CC1 ZINC000775702456 628056808 /nfs/dbraw/zinc/05/68/08/628056808.db2.gz WLAWOOZUTNEKBY-UHFFFAOYSA-N -1 3 298.789 2.855 20 10 CFCDHM [O-]c1c(Cl)cccc1CNCc1cccc(F)n1 ZINC000776252828 628122654 /nfs/dbraw/zinc/12/26/54/628122654.db2.gz ZIJARLCNIMRVNP-UHFFFAOYSA-N -1 3 266.703 2.870 20 10 CFCDHM CC(=O)c1cc(F)cc(CN2CCO[C@@H](C(C)C)C2)c1[O-] ZINC000778243110 628291883 /nfs/dbraw/zinc/29/18/83/628291883.db2.gz SJRYXYYOTIAEAW-OAHLLOKOSA-N -1 3 295.354 2.591 20 10 CFCDHM O=C(NC[C@@H]1CCC[C@@H]1C1CC1)c1cccc(O)c1[O-] ZINC000839804902 628542379 /nfs/dbraw/zinc/54/23/79/628542379.db2.gz CVEOQORYMWXHLD-NWDGAFQWSA-N -1 3 275.348 2.654 20 10 CFCDHM CC(=O)c1cc(Cl)cc(CN(C)Cc2c[nH]cn2)c1[O-] ZINC000852287556 634711145 /nfs/dbraw/zinc/71/11/45/634711145.db2.gz ZSPLGPRQJLRBDV-UHFFFAOYSA-N -1 3 293.754 2.603 20 10 CFCDHM Cc1ccc2c(c1C)OC[C@H]2NC(=O)c1cccc(O)c1[O-] ZINC000790646854 629254717 /nfs/dbraw/zinc/25/47/17/629254717.db2.gz NJDHIEHDMSUZDN-CYBMUJFWSA-N -1 3 299.326 2.578 20 10 CFCDHM O=C(c1cccc(O)c1[O-])N(CCc1ccccc1)C1CC1 ZINC000790895401 629270453 /nfs/dbraw/zinc/27/04/53/629270453.db2.gz SHXLYNJFDNGQSP-UHFFFAOYSA-N -1 3 297.354 2.945 20 10 CFCDHM CC(C)CCc1cc(NC(=O)c2cccc(O)c2[O-])n[nH]1 ZINC000790961610 629273997 /nfs/dbraw/zinc/27/39/97/629273997.db2.gz PDFJHHIOVJQTJI-UHFFFAOYSA-N -1 3 289.335 2.662 20 10 CFCDHM [O-]c1ccc2oc3c(c2c1CN1CCO[C@H]2C[C@H]21)CCCC3 ZINC000793624515 629580872 /nfs/dbraw/zinc/58/08/72/629580872.db2.gz XSGRMZDVPMLFTQ-DYVFJYSZSA-N -1 3 299.370 2.990 20 10 CFCDHM COc1cc(NC(=O)c2cccc(O)c2[O-])c(C)cc1C ZINC000794364161 629640665 /nfs/dbraw/zinc/64/06/65/629640665.db2.gz CSKNVHXOHAJUDG-UHFFFAOYSA-N -1 3 287.315 2.976 20 10 CFCDHM C[C@H](NCc1cccnc1F)c1ccc(F)cc1[O-] ZINC000794836257 629692277 /nfs/dbraw/zinc/69/22/77/629692277.db2.gz OTLDQJPWXZXLFS-VIFPVBQESA-N -1 3 264.275 2.916 20 10 CFCDHM CC(=O)c1cc(Cl)cc(CN2CCC[C@@H]2[C@@H](C)O)c1[O-] ZINC000852560183 634780028 /nfs/dbraw/zinc/78/00/28/634780028.db2.gz PUVNEDKUISFGGG-QMTHXVAHSA-N -1 3 297.782 2.593 20 10 CFCDHM CC(C)[C@@H]1[C@@H](C(C)C)CN1C(=O)c1cccc(O)c1[O-] ZINC000836888069 630909510 /nfs/dbraw/zinc/90/95/10/630909510.db2.gz ITBLFLROTXLEPY-TZMCWYRMSA-N -1 3 277.364 2.850 20 10 CFCDHM Cc1cc([O-])c(CN[C@@H](C)C(=O)OC(C)C)c(Cl)c1 ZINC000840950849 631279821 /nfs/dbraw/zinc/27/98/21/631279821.db2.gz PBVTYYDCKDRKIR-JTQLQIEISA-N -1 3 285.771 2.784 20 10 CFCDHM CCn1cnnc1CN[C@H](C)c1ccc(Cl)cc1[O-] ZINC000841743588 631463598 /nfs/dbraw/zinc/46/35/98/631463598.db2.gz BEDKMRSEMVXWBK-SECBINFHSA-N -1 3 280.759 2.508 20 10 CFCDHM CON(C[C@H]1CCC[C@@H](C)C1)C(=O)c1cccc(O)c1[O-] ZINC000812419709 631714247 /nfs/dbraw/zinc/71/42/47/631714247.db2.gz OYLDMCJWHHIMKU-NEPJUHHUSA-N -1 3 293.363 2.928 20 10 CFCDHM C[C@H](NCc1ccn(C)n1)c1cccc(C(F)(F)F)c1[O-] ZINC000815599424 632295690 /nfs/dbraw/zinc/29/56/90/632295690.db2.gz SQXIWYGTXVVKBQ-VIFPVBQESA-N -1 3 299.296 2.995 20 10 CFCDHM CCOC(=O)CN(CC)Cc1ccc2ccccc2c1[O-] ZINC000816495039 632470301 /nfs/dbraw/zinc/47/03/01/632470301.db2.gz HZFMZFDBSFEDHJ-UHFFFAOYSA-N -1 3 287.359 2.930 20 10 CFCDHM CN(Cc1cn[nH]c1)Cc1cc(Cl)c(F)cc1[O-] ZINC000816512466 632475833 /nfs/dbraw/zinc/47/58/33/632475833.db2.gz JVAVEIFVLFXJDJ-UHFFFAOYSA-N -1 3 269.707 2.540 20 10 CFCDHM C[C@H]1CN(C(=O)c2cccc(O)c2[O-])Cc2ccccc2O1 ZINC000817047944 632549385 /nfs/dbraw/zinc/54/93/85/632549385.db2.gz KGHYWPVXPNCVGH-NSHDSACASA-N -1 3 299.326 2.521 20 10 CFCDHM [O-]c1ccc(Cl)c(F)c1CN1CCC(C2(O)CC2)CC1 ZINC000846008461 632611693 /nfs/dbraw/zinc/61/16/93/632611693.db2.gz OFBRYWUKFDRWFY-UHFFFAOYSA-N -1 3 299.773 2.922 20 10 CFCDHM CC[C@@H]1CCC[C@H](C)N1C(=O)c1cccc(O)c1[O-] ZINC000856272716 635771230 /nfs/dbraw/zinc/77/12/30/635771230.db2.gz GXLHHNVKIJXHKZ-WDEREUQCSA-N -1 3 263.337 2.891 20 10 CFCDHM Cc1cc([O-])c(CN2Cc3cnn(C)c3C2)c(Cl)c1 ZINC000864049028 637842906 /nfs/dbraw/zinc/84/29/06/637842906.db2.gz BRIBRRYHOQITSC-UHFFFAOYSA-N -1 3 277.755 2.603 20 10 CFCDHM O=C(NCC[C@@H]1CCCS1)NCc1c([O-])cccc1F ZINC000923633219 641464626 /nfs/dbraw/zinc/46/46/26/641464626.db2.gz FQDWDOPCXDWFTR-JTQLQIEISA-N -1 3 298.383 2.616 20 10 CFCDHM O=C(Nc1ccc(OC(F)F)cc1)c1cccc(O)c1[O-] ZINC000126243954 643076745 /nfs/dbraw/zinc/07/67/45/643076745.db2.gz LUFXJJIIYFGKFH-UHFFFAOYSA-N -1 3 295.241 2.952 20 10 CFCDHM O=C(NCCc1ccc(Cl)cc1)c1cccc(O)c1[O-] ZINC000126278931 643089280 /nfs/dbraw/zinc/08/92/80/643089280.db2.gz YFXAKORZQOFZBZ-UHFFFAOYSA-N -1 3 291.734 2.724 20 10 CFCDHM CC(C)c1nc([C@@H](C)NCc2ccc(F)c(F)c2[O-])n[nH]1 ZINC000877125866 643165244 /nfs/dbraw/zinc/16/52/44/643165244.db2.gz CBUPCWKQPBJMNR-MRVPVSSYSA-N -1 3 296.321 2.763 20 10 CFCDHM CC[C@]1(O)CCCN(Cc2cc(Cl)cc(F)c2[O-])C1 ZINC000877691723 643457907 /nfs/dbraw/zinc/45/79/07/643457907.db2.gz UNGFTVATXVHKEM-AWEZNQCLSA-N -1 3 287.762 2.922 20 10 CFCDHM CC1(C)C[C@H](O)CN(Cc2cc(Cl)cc(F)c2[O-])C1 ZINC000877751329 643527448 /nfs/dbraw/zinc/52/74/48/643527448.db2.gz BNNNBISUTZJBQI-NSHDSACASA-N -1 3 287.762 2.778 20 10 CFCDHM CC(C)(CNC(=O)c1cccc(O)c1[O-])CC(F)F ZINC000881539248 645031884 /nfs/dbraw/zinc/03/18/84/645031884.db2.gz NWLIZLQPPMYTNJ-UHFFFAOYSA-N -1 3 273.279 2.509 20 10 CFCDHM C[C@H]1C[C@H](NCc2cc(F)cc(F)c2[O-])c2nccn21 ZINC000883135902 645621135 /nfs/dbraw/zinc/62/11/35/645621135.db2.gz PLJSQQOMDXILIR-UFBFGSQYSA-N -1 3 279.290 2.663 20 10 CFCDHM O=c1ccnc(C=Cc2ccc(N3CCCCC3)cc2)[n-]1 ZINC000131725954 645799753 /nfs/dbraw/zinc/79/97/53/645799753.db2.gz YVKPDDUBAIJOLP-RMKNXTFCSA-N -1 3 281.359 2.931 20 10 CFCDHM CC1(C)CN(Cc2cc(Cl)ccc2[O-])CCO1 ZINC000132300694 645904490 /nfs/dbraw/zinc/90/44/90/645904490.db2.gz JDTGPINCZWDUCA-UHFFFAOYSA-N -1 3 255.745 2.656 20 10 CFCDHM C[C@@H](NCc1csc(N(C)C)n1)c1c([O-])cccc1F ZINC000886534800 647033982 /nfs/dbraw/zinc/03/39/82/647033982.db2.gz OSFMTCYBSFDWSB-SECBINFHSA-N -1 3 295.383 2.905 20 10 CFCDHM C[C@H](N[C@@H]1CCN(C(C)(C)C)C1=O)c1c([O-])cccc1F ZINC000886629943 647076894 /nfs/dbraw/zinc/07/68/94/647076894.db2.gz QWOMDTWDHHXYES-CMPLNLGQSA-N -1 3 294.370 2.581 20 10 CFCDHM C[C@H](Nc1cnn(CCF)c1)c1c([O-])cccc1F ZINC000886642064 647084152 /nfs/dbraw/zinc/08/41/52/647084152.db2.gz ZIMVXSMXZZRIRI-VIFPVBQESA-N -1 3 267.279 2.870 20 10 CFCDHM CC[C@@H](N[C@@H]1CNOC1)c1cc(Cl)cc(Cl)c1[O-] ZINC000925858678 648346645 /nfs/dbraw/zinc/34/66/45/648346645.db2.gz CSCCRCQJQHVBFZ-LDYMZIIASA-N -1 3 291.178 2.643 20 10 CFCDHM C[C@H](NCc1cc(C2CC2)nn1C)c1c([O-])cccc1F ZINC000927101057 648712019 /nfs/dbraw/zinc/71/20/19/648712019.db2.gz POBDSOPHMLCQFM-JTQLQIEISA-N -1 3 289.354 2.993 20 10 CFCDHM CC1(C(=O)NCc2c([O-])cccc2F)CCCC1 ZINC000928711156 648942297 /nfs/dbraw/zinc/94/22/97/648942297.db2.gz FTNBSTYNSCEZLD-UHFFFAOYSA-N -1 3 251.301 2.728 20 10 CFCDHM O=C(CC1CCSCC1)NCc1c([O-])cccc1F ZINC000928704540 648944322 /nfs/dbraw/zinc/94/43/22/648944322.db2.gz BGJXTVQJHPTXCA-UHFFFAOYSA-N -1 3 283.368 2.681 20 10 CFCDHM C[C@H]1CC/C(=C/C(=O)NCc2c([O-])cccc2F)C1 ZINC000928705495 648944853 /nfs/dbraw/zinc/94/48/53/648944853.db2.gz KPVDPLXTZWQIKK-DFYQSJSGSA-N -1 3 263.312 2.894 20 10 CFCDHM CC[C@@H]1CCC[C@H]1C(=O)NCc1c([O-])cccc1F ZINC000928705899 648944893 /nfs/dbraw/zinc/94/48/93/648944893.db2.gz MLWYJPQTXGKOAL-GHMZBOCLSA-N -1 3 265.328 2.974 20 10 CFCDHM CC[C@H]1C[C@@H](CC(=O)NCc2c([O-])cccc2F)CCO1 ZINC000928707746 648945351 /nfs/dbraw/zinc/94/53/51/648945351.db2.gz HODAEDYFMYSEEE-RYUDHWBXSA-N -1 3 295.354 2.743 20 10 CFCDHM O=C(NCc1c([O-])cccc1F)C1CC2(CCC2)C1 ZINC000928706643 648945535 /nfs/dbraw/zinc/94/55/35/648945535.db2.gz SYOABHHXDDRXIF-UHFFFAOYSA-N -1 3 263.312 2.728 20 10 CFCDHM CC[C@H](C)CC[C@@H](O)CC(=O)NCc1c([O-])cccc1F ZINC000928708265 648945545 /nfs/dbraw/zinc/94/55/45/648945545.db2.gz JLKNUGROWLBNJY-NWDGAFQWSA-N -1 3 297.370 2.725 20 10 CFCDHM O=C(NCc1c([O-])cccc1F)[C@@H]1CCC(F)(F)C1 ZINC000928708349 648945601 /nfs/dbraw/zinc/94/56/01/648945601.db2.gz JZJWKFFSFIIHCT-MRVPVSSYSA-N -1 3 273.254 2.583 20 10 CFCDHM CC[C@@H](C)CCC(=O)NCc1c([O-])cccc1F ZINC000928707031 648945640 /nfs/dbraw/zinc/94/56/40/648945640.db2.gz ZXCHWHRVBWTFHY-SNVBAGLBSA-N -1 3 253.317 2.974 20 10 CFCDHM C/C(=C(\F)C(=O)NCc1c([O-])cccc1F)C1CC1 ZINC000928710196 648945853 /nfs/dbraw/zinc/94/58/53/648945853.db2.gz PQFQFXDYSSSNPV-MDWZMJQESA-N -1 3 267.275 2.801 20 10 CFCDHM CSCC(C)(C)C(=O)NCc1c([O-])cccc1F ZINC000928708707 648946142 /nfs/dbraw/zinc/94/61/42/648946142.db2.gz RIHDVUVPDUTARG-UHFFFAOYSA-N -1 3 271.357 2.537 20 10 CFCDHM CC1(C)CC(C(=O)NCc2c([O-])cccc2F)C1 ZINC000928708489 648946225 /nfs/dbraw/zinc/94/62/25/648946225.db2.gz MODYNROVPOJJRV-UHFFFAOYSA-N -1 3 251.301 2.584 20 10 CFCDHM C[C@@H]1CCC[C@H](C)[N@H+]1Cc1cc(C(=O)[O-])ccc1[O-] ZINC001231562079 778862118 /nfs/dbraw/zinc/86/21/18/778862118.db2.gz ZMMVLFYMEVUKKV-PHIMTYICSA-N -1 3 263.337 2.853 20 10 CFCDHM C[C@@H]1CCC[C@H](C)[N@@H+]1Cc1cc(C(=O)[O-])ccc1[O-] ZINC001231562079 778862126 /nfs/dbraw/zinc/86/21/26/778862126.db2.gz ZMMVLFYMEVUKKV-PHIMTYICSA-N -1 3 263.337 2.853 20 10 CFCDHM CO[C@H]1CCN(Cc2c([O-])cc(F)cc2F)[C@@H](C)C1 ZINC001140584649 770970749 /nfs/dbraw/zinc/97/07/49/770970749.db2.gz ACIHOIZFMAYEFY-ONGXEEELSA-N -1 3 271.307 2.670 20 10 CFCDHM CC1(F)CCN(Cc2c(F)ccc(F)c2[O-])CC1 ZINC001139685522 776616871 /nfs/dbraw/zinc/61/68/71/776616871.db2.gz MQPPFIYZHFMFFR-UHFFFAOYSA-N -1 3 259.271 2.994 20 10 CFCDHM O=C([O-])c1ccc(C[N@@H+]2CCC[C@@H]2c2ccncc2)c([O-])c1 ZINC001231452839 777223502 /nfs/dbraw/zinc/22/35/02/777223502.db2.gz UZGYUWDVIBCDHS-OAHLLOKOSA-N -1 3 298.342 2.823 20 10 CFCDHM O=C([O-])c1ccc(C[N@H+]2CCC[C@@H]2c2ccncc2)c([O-])c1 ZINC001231452839 777223511 /nfs/dbraw/zinc/22/35/11/777223511.db2.gz UZGYUWDVIBCDHS-OAHLLOKOSA-N -1 3 298.342 2.823 20 10 CFCDHM C[C@@H]1CCC[N@H+](Cc2cc(C(=O)[O-])ccc2[O-])C[C@@H]1C ZINC001231560403 777259660 /nfs/dbraw/zinc/25/96/60/777259660.db2.gz INDBXYCCWKFWTI-NEPJUHHUSA-N -1 3 277.364 2.958 20 10 CFCDHM C[C@@H]1CCC[N@@H+](Cc2cc(C(=O)[O-])ccc2[O-])C[C@@H]1C ZINC001231560403 777259668 /nfs/dbraw/zinc/25/96/68/777259668.db2.gz INDBXYCCWKFWTI-NEPJUHHUSA-N -1 3 277.364 2.958 20 10 CFCDHM CC[C@@H]1CCCC[N@@H+]1Cc1cc(C(=O)[O-])ccc1[O-] ZINC001231563508 777261437 /nfs/dbraw/zinc/26/14/37/777261437.db2.gz BXHJTCQIOOHWFZ-CYBMUJFWSA-N -1 3 263.337 2.855 20 10 CFCDHM CC[C@@H]1CCCC[N@H+]1Cc1cc(C(=O)[O-])ccc1[O-] ZINC001231563508 777261443 /nfs/dbraw/zinc/26/14/43/777261443.db2.gz BXHJTCQIOOHWFZ-CYBMUJFWSA-N -1 3 263.337 2.855 20 10 CFCDHM C[N@@H+](Cc1cc(C(=O)[O-])ccc1[O-])C[C@@H]1CC1(C)C ZINC001231566132 777261742 /nfs/dbraw/zinc/26/17/42/777261742.db2.gz RNHCRHRDLGCNHZ-LBPRGKRZSA-N -1 3 263.337 2.568 20 10 CFCDHM C[N@H+](Cc1cc(C(=O)[O-])ccc1[O-])C[C@@H]1CC1(C)C ZINC001231566132 777261751 /nfs/dbraw/zinc/26/17/51/777261751.db2.gz RNHCRHRDLGCNHZ-LBPRGKRZSA-N -1 3 263.337 2.568 20 10 CFCDHM C[C@H]1CCC[C@H](C)[NH+]1Cc1cc(C(=O)[O-])ccc1[O-] ZINC001231562080 777262054 /nfs/dbraw/zinc/26/20/54/777262054.db2.gz ZMMVLFYMEVUKKV-QWRGUYRKSA-N -1 3 263.337 2.853 20 10 CFCDHM Cc1cc([O-])c(CN2CC(OC(C)C)C2)cc1Cl ZINC001231870204 777359274 /nfs/dbraw/zinc/35/92/74/777359274.db2.gz NQIAOPGJYMRWNB-UHFFFAOYSA-N -1 3 269.772 2.963 20 10 CFCDHM Cc1cc([O-])c(CN2C[C@H](CO)C[C@H](F)C2)cc1Cl ZINC001231869434 777359327 /nfs/dbraw/zinc/35/93/27/777359327.db2.gz QOIXJGPBTPJYGW-PWSUYJOCSA-N -1 3 287.762 2.506 20 10 CFCDHM Cc1cc([O-])c(CN(C)Cc2ncccn2)cc1Cl ZINC001231869826 777359358 /nfs/dbraw/zinc/35/93/58/777359358.db2.gz ZYNNWCPTIZHPMR-UHFFFAOYSA-N -1 3 277.755 2.776 20 10 CFCDHM COc1cc([O-])c(CN2C[C@@H]3C[C@@H]3[C@@H](F)C2)cc1Cl ZINC001232268089 777501005 /nfs/dbraw/zinc/50/10/05/777501005.db2.gz LXQGVDUOUFKKGP-PEXQALLHSA-N -1 3 285.746 2.844 20 10 CFCDHM CCCCOC1CN(Cc2cc(Cl)c([O-])cc2O)C1 ZINC001232268209 777501550 /nfs/dbraw/zinc/50/15/50/777501550.db2.gz NDFBVMMSGOXOGT-UHFFFAOYSA-N -1 3 285.771 2.752 20 10 CFCDHM [O-]c1cc(O)c(CN2CCc3ccncc3C2)cc1Cl ZINC001232268186 777501758 /nfs/dbraw/zinc/50/17/58/777501758.db2.gz MRVNIVSJXBDPSZ-UHFFFAOYSA-N -1 3 290.750 2.705 20 10 CFCDHM COCCN(Cc1c([O-])ccc(F)c1F)C(C)C ZINC001233334794 777893153 /nfs/dbraw/zinc/89/31/53/777893153.db2.gz UCTXAULNQPHJBF-UHFFFAOYSA-N -1 3 259.296 2.527 20 10 CFCDHM [O-]c1ccc(F)cc1CN1CCO[C@H](CC(F)(F)F)C1 ZINC000698222646 778766770 /nfs/dbraw/zinc/76/67/70/778766770.db2.gz WNIWDDDHSAQRLK-LLVKDONJSA-N -1 3 293.260 2.685 20 10 CFCDHM Cc1cc(Br)c([O-])c(CN2CC=CC2)c1 ZINC001236664960 778906760 /nfs/dbraw/zinc/90/67/60/778906760.db2.gz ZAFHKIUIWXHVOD-UHFFFAOYSA-N -1 3 268.154 2.835 20 10 CFCDHM COc1ccc(CN2CCC[C@H](OC)C2)c([O-])c1Cl ZINC001236802003 778945807 /nfs/dbraw/zinc/94/58/07/778945807.db2.gz MKJIPMKPRRMXTA-NSHDSACASA-N -1 3 285.771 2.665 20 10 CFCDHM COc1ccc(CN2CCC(C(C)=O)CC2)c([O-])c1Cl ZINC001236812505 778950640 /nfs/dbraw/zinc/95/06/40/778950640.db2.gz YDVMJSFUELHUSR-UHFFFAOYSA-N -1 3 297.782 2.855 20 10 CFCDHM [O-]c1ccc(F)c(Cl)c1CN1CCC[C@@]2(CCO2)C1 ZINC001237125846 779018748 /nfs/dbraw/zinc/01/87/48/779018748.db2.gz GNRODHSFCCEJDZ-CQSZACIVSA-N -1 3 285.746 2.940 20 10 CFCDHM C[C@@]1(O)CCCN(Cc2c([O-])ccc(F)c2Cl)C1 ZINC001237126077 779021793 /nfs/dbraw/zinc/02/17/93/779021793.db2.gz IAFZHADZSRGFTK-CYBMUJFWSA-N -1 3 273.735 2.532 20 10 CFCDHM O=c1[n-]c(Cl)c(CN2CCc3cccc(O)c3C2)s1 ZINC001237168228 779035860 /nfs/dbraw/zinc/03/58/60/779035860.db2.gz GXOQEMLEZFYGLT-UHFFFAOYSA-N -1 3 296.779 2.766 20 10 CFCDHM C[C@@H]1CO[C@@H]2CN(Cc3cc(F)c(Cl)cc3[O-])C[C@H]12 ZINC001237948823 779213911 /nfs/dbraw/zinc/21/39/11/779213911.db2.gz IGDMILUQNNAHFJ-PJCOJXEDSA-N -1 3 285.746 2.651 20 10 CFCDHM CO[C@@H]1CCCN(Cc2cc(F)c(Cl)cc2[O-])C1 ZINC001237946343 779214415 /nfs/dbraw/zinc/21/44/15/779214415.db2.gz JAJZWDUQAJQWSZ-SNVBAGLBSA-N -1 3 273.735 2.796 20 10 CFCDHM Cn1ccc(NCc2cc(Cl)c3cccnc3c2[O-])n1 ZINC001168522368 779433700 /nfs/dbraw/zinc/43/37/00/779433700.db2.gz PWPCNOLMVTUMDZ-UHFFFAOYSA-N -1 3 288.738 2.939 20 10 CFCDHM [O-]c1c(Cl)cc(F)cc1CN1CC(N2CCCCC2)C1 ZINC001237798549 779718244 /nfs/dbraw/zinc/71/82/44/779718244.db2.gz JAIYFCITJSVTRW-UHFFFAOYSA-N -1 3 298.789 2.855 20 10 CFCDHM CCN(C(=O)c1cccc(O)c1[O-])[C@H](C)C(C)C ZINC000706447303 781175360 /nfs/dbraw/zinc/17/53/60/781175360.db2.gz AQPHTZRTNWLEEA-SNVBAGLBSA-N -1 3 251.326 2.604 20 10 CFCDHM CC(=O)c1cc(Cl)cc(CN2CC[C@@H]3C[C@@H]32)c1[O-] ZINC000707052214 781221503 /nfs/dbraw/zinc/22/15/03/781221503.db2.gz GRKRXLZJUHSMKZ-RNCFNFMXSA-N -1 3 265.740 2.842 20 10 CFCDHM [O-]c1cc(F)c(Cl)cc1CN[C@@H](CCO)c1ccco1 ZINC000294532090 199075978 /nfs/dbraw/zinc/07/59/78/199075978.db2.gz DEWWFOUZSRPPOW-LBPRGKRZSA-N -1 3 299.729 2.991 20 10 CFCDHM C[C@@]1(O)CCCN(Cc2cc(Cl)c(F)cc2[O-])CC1 ZINC000294792457 199184768 /nfs/dbraw/zinc/18/47/68/199184768.db2.gz VIIBSPABRIELNE-CQSZACIVSA-N -1 3 287.762 2.922 20 10 CFCDHM Cn1cnnc1[C@H]1CCCN1Cc1cc(Cl)ccc1[O-] ZINC000093809921 375313306 /nfs/dbraw/zinc/31/33/06/375313306.db2.gz MJLAUOSNQXWMEQ-GFCCVEGCSA-N -1 3 292.770 2.511 20 10 CFCDHM C[C@@H]1CN(Cc2cccc(Cl)c2[O-])CCCO1 ZINC000124588461 377068717 /nfs/dbraw/zinc/06/87/17/377068717.db2.gz FQJYMXJKAKCKKS-SNVBAGLBSA-N -1 3 255.745 2.656 20 10 CFCDHM [O-]c1cccc(Cl)c1CN1CCOC2(CCC2)C1 ZINC000130516813 377570863 /nfs/dbraw/zinc/57/08/63/377570863.db2.gz SMTKHTXISDDJRG-UHFFFAOYSA-N -1 3 267.756 2.801 20 10 CFCDHM COC1CCN(Cc2c([O-])cccc2Cl)CC1 ZINC000132144306 377806108 /nfs/dbraw/zinc/80/61/08/377806108.db2.gz KCLYTEZMHJYRGH-UHFFFAOYSA-N -1 3 255.745 2.656 20 10 CFCDHM C[C@@H](C(=O)OC(C)(C)C)N(C)Cc1ccccc1[O-] ZINC000154987570 378606760 /nfs/dbraw/zinc/60/67/60/378606760.db2.gz CRIKOTDLDAOJAY-NSHDSACASA-N -1 3 265.353 2.554 20 10 CFCDHM Cc1ccc(C(=O)N2C[C@H](C)C[C@@H](C)C2)c([O-])c1O ZINC000177660537 380364410 /nfs/dbraw/zinc/36/44/10/380364410.db2.gz SKENYBFRFDTWMU-NXEZZACHSA-N -1 3 263.337 2.524 20 10 CFCDHM Cc1ccc(C(=O)N(Cc2ccncc2)C2CC2)c([O-])c1O ZINC000177675502 380365842 /nfs/dbraw/zinc/36/58/42/380365842.db2.gz BPCVUANWHLHIOW-UHFFFAOYSA-N -1 3 298.342 2.606 20 10 CFCDHM [O-]c1ccccc1CN1CCc2nc(C3CC3)ncc2C1 ZINC000529666236 383745395 /nfs/dbraw/zinc/74/53/95/383745395.db2.gz SKIZNVIHJJOIKS-UHFFFAOYSA-N -1 3 281.359 2.618 20 10 CFCDHM CCSCC[C@H](C)NC(=O)c1ccc(C)c(O)c1[O-] ZINC000179527245 380552665 /nfs/dbraw/zinc/55/26/65/380552665.db2.gz ANHQESRIYCCJKT-JTQLQIEISA-N -1 3 283.393 2.668 20 10 CFCDHM C[C@@H](NCc1cnnn1C)c1ccc2ccccc2c1[O-] ZINC000287404424 380824158 /nfs/dbraw/zinc/82/41/58/380824158.db2.gz RDTIMXLZIYUFFY-LLVKDONJSA-N -1 3 282.347 2.525 20 10 CFCDHM CS[C@@H]1CCCCN(C(=O)c2ccc(C)c(O)c2[O-])C1 ZINC000182852005 381170557 /nfs/dbraw/zinc/17/05/57/381170557.db2.gz MLAAHMPJDNOZEI-LLVKDONJSA-N -1 3 295.404 2.764 20 10 CFCDHM CCn1ccnc1CN[C@H](C)c1ccc(C)cc1[O-] ZINC000296302205 381339149 /nfs/dbraw/zinc/33/91/49/381339149.db2.gz FYHHOLDNGVFPCF-GFCCVEGCSA-N -1 3 259.353 2.768 20 10 CFCDHM CC(=O)c1cc(F)cc(CN2CCCOC(C)(C)C2)c1[O-] ZINC000370171295 381399170 /nfs/dbraw/zinc/39/91/70/381399170.db2.gz YCPVIEQBUUBFDX-UHFFFAOYSA-N -1 3 295.354 2.735 20 10 CFCDHM Cc1cc(Br)cc(CNCC(F)F)c1[O-] ZINC000298041329 381577349 /nfs/dbraw/zinc/57/73/49/381577349.db2.gz HHHXSBOXIBPGPB-UHFFFAOYSA-N -1 3 280.112 2.818 20 10 CFCDHM Cc1nn(C)cc1[C@H](C)N[C@H](C)c1ccc(F)cc1[O-] ZINC000185349518 381607665 /nfs/dbraw/zinc/60/76/65/381607665.db2.gz LFJBXCFSVBBZIE-ZJUUUORDSA-N -1 3 277.343 2.985 20 10 CFCDHM [O-]c1ccc(F)cc1CNc1cccc2c1OCC[C@@H]2O ZINC000185578843 381670874 /nfs/dbraw/zinc/67/08/74/381670874.db2.gz YODPIKQFWVJKJN-HNNXBMFYSA-N -1 3 289.306 2.959 20 10 CFCDHM C[C@@H](NCc1cccc(N(C)C)n1)c1ccc(F)cc1[O-] ZINC000186179237 381844095 /nfs/dbraw/zinc/84/40/95/381844095.db2.gz HCJAJDLUIQNGHC-LLVKDONJSA-N -1 3 289.354 2.843 20 10 CFCDHM C[C@H]1CC2(CCC2)CN1C(=O)c1cccc(O)c1[O-] ZINC000372891171 381884586 /nfs/dbraw/zinc/88/45/86/381884586.db2.gz LRDSYQHCPGOECZ-JTQLQIEISA-N -1 3 261.321 2.503 20 10 CFCDHM [O-]c1ccc(F)cc1CN1CCOC[C@@H]1c1ccco1 ZINC000373120891 381932577 /nfs/dbraw/zinc/93/25/77/381932577.db2.gz HXZDFKCVFUOQNE-CYBMUJFWSA-N -1 3 277.295 2.698 20 10 CFCDHM [O-]c1ccccc1CN1CCOC[C@H]1c1ccco1 ZINC000373126407 381932867 /nfs/dbraw/zinc/93/28/67/381932867.db2.gz UVPDULSFVKRZNL-ZDUSSCGKSA-N -1 3 259.305 2.559 20 10 CFCDHM C[C@H]1CCN(C(=O)c2cccc(O)c2[O-])CC12CCC2 ZINC000375693380 382096867 /nfs/dbraw/zinc/09/68/67/382096867.db2.gz RSSPJPHDNVERIC-NSHDSACASA-N -1 3 275.348 2.750 20 10 CFCDHM CC1(Cc2ccccc2)CN(C(=O)c2cccc(O)c2[O-])C1 ZINC000376455394 382137933 /nfs/dbraw/zinc/13/79/33/382137933.db2.gz QLNACNUCCJMIIS-UHFFFAOYSA-N -1 3 297.354 2.803 20 10 CFCDHM Cc1cc(CNCc2cc(Cl)c(F)cc2[O-])n(C)n1 ZINC000294718683 382525160 /nfs/dbraw/zinc/52/51/60/382525160.db2.gz PHPFLMQQHUDNSE-UHFFFAOYSA-N -1 3 283.734 2.516 20 10 CFCDHM [O-]c1ccccc1CNC1(c2noc(C(F)F)n2)CCC1 ZINC000366494770 382519691 /nfs/dbraw/zinc/51/96/91/382519691.db2.gz DSVVVLQNVJWQCS-UHFFFAOYSA-N -1 3 295.289 2.882 20 10 CFCDHM CCN(C)C(=O)[C@@H](C)N[C@@H](C)c1cc(Cl)ccc1[O-] ZINC000189400290 382603622 /nfs/dbraw/zinc/60/36/22/382603622.db2.gz MWUDXASPOUOTTF-VHSXEESVSA-N -1 3 284.787 2.563 20 10 CFCDHM CC(=O)c1cc(F)cc(CN2CCC(CF)CC2)c1[O-] ZINC000295190470 382579757 /nfs/dbraw/zinc/57/97/57/382579757.db2.gz SZAYTWJHQQJFQZ-UHFFFAOYSA-N -1 3 283.318 2.915 20 10 CFCDHM CC[C@@H]1CN(Cc2cc(F)cc(C(C)=O)c2[O-])CCCO1 ZINC000281204092 385186844 /nfs/dbraw/zinc/18/68/44/385186844.db2.gz AREHTRXNSBTUBM-CQSZACIVSA-N -1 3 295.354 2.735 20 10 CFCDHM CCCCN(Cc1ncc[nH]1)Cc1ccccc1[O-] ZINC000282346021 385288535 /nfs/dbraw/zinc/28/85/35/385288535.db2.gz CFMCWQUTZFFYCA-UHFFFAOYSA-N -1 3 259.353 2.918 20 10 CFCDHM [O-]c1ccccc1CN1CCO[C@@H](c2ccccc2)C1 ZINC000271305351 385378864 /nfs/dbraw/zinc/37/88/64/385378864.db2.gz UCSCRMMYIFBJSF-QGZVFWFLSA-N -1 3 269.344 2.966 20 10 CFCDHM CC(C)(C)OC(=O)[C@H]1CCCN1Cc1ccccc1[O-] ZINC000271339735 385380718 /nfs/dbraw/zinc/38/07/18/385380718.db2.gz JMRCILXICOCTJW-CYBMUJFWSA-N -1 3 277.364 2.698 20 10 CFCDHM CCn1cc(N[C@H](C)c2cc(C(=O)OC)ccc2[O-])cn1 ZINC000273496269 385686539 /nfs/dbraw/zinc/68/65/39/385686539.db2.gz PHAYXTJMTPJZFO-SNVBAGLBSA-N -1 3 289.335 2.568 20 10 CFCDHM CC(C)N(C(=O)[C@H](C)N(C)Cc1ccccc1[O-])C(C)C ZINC000109769874 393879498 /nfs/dbraw/zinc/87/94/98/393879498.db2.gz IMTZCGFYJUDWNK-AWEZNQCLSA-N -1 3 292.423 2.858 20 10 CFCDHM Cc1cccc2c1OCC[C@@H]2NC(=O)c1cccc(O)c1[O-] ZINC000364309571 292603681 /nfs/dbraw/zinc/60/36/81/292603681.db2.gz QCJMKJLCAKWNBR-ZDUSSCGKSA-N -1 3 299.326 2.660 20 10 CFCDHM CC(=O)c1cc(Cl)cc(CN2CCOCC[C@H]2C)c1[O-] ZINC000362235276 278243927 /nfs/dbraw/zinc/24/39/27/278243927.db2.gz KCAPQKVHGHMZFX-SNVBAGLBSA-N -1 3 297.782 2.859 20 10 CFCDHM Cc1ccc(C(=O)N2C[C@@H](C)C[C@H](C)C2)c([O-])c1O ZINC000177660526 301518502 /nfs/dbraw/zinc/51/85/02/301518502.db2.gz SKENYBFRFDTWMU-UWVGGRQHSA-N -1 3 263.337 2.524 20 10 CFCDHM C[C@@H]1[C@H](C(=O)NCc2ccc3cccnc3c2[O-])[C@H]1C1CC1 ZINC000529501711 333491236 /nfs/dbraw/zinc/49/12/36/333491236.db2.gz NMRFEYOCHMAVMJ-VQISRLSMSA-N -1 3 296.370 2.849 20 10 CFCDHM CC(=O)c1cc(F)cc(CN(C)CCOCC2CC2)c1[O-] ZINC000088558724 518283219 /nfs/dbraw/zinc/28/32/19/518283219.db2.gz ZJBHRDCYMVPXGQ-UHFFFAOYSA-N -1 3 295.354 2.592 20 10 CFCDHM CC(=O)c1cc(F)cc(CN(C)C[C@H]2CCCCO2)c1[O-] ZINC000048949097 518283697 /nfs/dbraw/zinc/28/36/97/518283697.db2.gz JWMVNVPASAJJRH-CQSZACIVSA-N -1 3 295.354 2.735 20 10 CFCDHM CCCCCN(CCCOC)C(=O)c1cccc(O)c1[O-] ZINC000193158042 520163007 /nfs/dbraw/zinc/16/30/07/520163007.db2.gz GUOJOCOUARWTGR-UHFFFAOYSA-N -1 3 295.379 2.767 20 10 CFCDHM COc1cc(CN[C@@H](C)c2ccc(F)cc2[O-])ccn1 ZINC000062748553 522475469 /nfs/dbraw/zinc/47/54/69/522475469.db2.gz GWXMYXFHFUSYRM-JTQLQIEISA-N -1 3 276.311 2.786 20 10 CFCDHM COC[C@@H]1CCN1Cc1cc(Cl)cc(C)c1[O-] ZINC000293738919 522484571 /nfs/dbraw/zinc/48/45/71/522484571.db2.gz VNZMACFPVMNDNE-LBPRGKRZSA-N -1 3 255.745 2.575 20 10 CFCDHM CC[C@@H](N[C@@H](C)c1nncn1C)c1ccc(C)cc1[O-] ZINC000280239033 522917791 /nfs/dbraw/zinc/91/77/91/522917791.db2.gz VTQIKAMZLQOQRW-WCQYABFASA-N -1 3 274.368 2.631 20 10 CFCDHM COCC1=CCN(Cc2c([O-])cccc2Cl)CC1 ZINC000274883976 522921880 /nfs/dbraw/zinc/92/18/80/522921880.db2.gz BXBGLCAYQSALQC-UHFFFAOYSA-N -1 3 267.756 2.824 20 10 CFCDHM C[C@H]1CN(Cc2cc(F)ccc2[O-])C[C@@H](C2CC2)O1 ZINC000280105665 524612294 /nfs/dbraw/zinc/61/22/94/524612294.db2.gz AZOLCVUHYHSWTH-BONVTDFDSA-N -1 3 265.328 2.531 20 10 CFCDHM C[C@@H]1CN(C(=O)c2cccc(O)c2[O-])[C@@H]2CCCC[C@@H]21 ZINC000193158854 524872676 /nfs/dbraw/zinc/87/26/76/524872676.db2.gz IAZJHZVAALKZGK-NQBHXWOUSA-N -1 3 275.348 2.749 20 10 CFCDHM C[C@@H]1C[C@@H](c2cccnc2)N(C(=O)c2cccc(O)c2[O-])C1 ZINC000193162373 525293463 /nfs/dbraw/zinc/29/34/63/525293463.db2.gz MVRIXIFCHUFARA-RISCZKNCSA-N -1 3 298.342 2.716 20 10 CFCDHM C[C@@H](N[C@@H](C)c1cc(Cl)ccc1[O-])c1ncnn1C ZINC000276684053 525603961 /nfs/dbraw/zinc/60/39/61/525603961.db2.gz TYTAKOJDBWCPLZ-DTWKUNHWSA-N -1 3 280.759 2.586 20 10 CFCDHM Cc1ccc(C(=O)N2CCC[C@@H]2c2cccnc2)c([O-])c1O ZINC000365009705 526100256 /nfs/dbraw/zinc/10/02/56/526100256.db2.gz HZATUAOPENKRCP-CQSZACIVSA-N -1 3 298.342 2.779 20 10 CFCDHM Cc1ccc(C(=O)N2CCc3cccc(C)c3C2)c([O-])c1O ZINC000277187002 526133126 /nfs/dbraw/zinc/13/31/26/526133126.db2.gz BHIJGGFUWUKUSV-UHFFFAOYSA-N -1 3 297.354 2.913 20 10 CFCDHM Cc1cnn([C@@H]2CCN(Cc3cccc(Cl)c3[O-])C2)c1 ZINC000290929619 526267176 /nfs/dbraw/zinc/26/71/76/526267176.db2.gz OUMDJTZENBDYCK-CYBMUJFWSA-N -1 3 291.782 2.998 20 10 CFCDHM [O-]c1c(Cl)cccc1CN1CCS[C@H]2COCC[C@H]21 ZINC000245642678 526326828 /nfs/dbraw/zinc/32/68/28/526326828.db2.gz DXKBGRQLWXVTTA-OLZOCXBDSA-N -1 3 299.823 2.752 20 10 CFCDHM [O-]c1ccc(Cl)c(F)c1CN1CCCN(C2CC2)CC1 ZINC000191288785 526344733 /nfs/dbraw/zinc/34/47/33/526344733.db2.gz SIBCALIWDXLSID-UHFFFAOYSA-N -1 3 298.789 2.855 20 10 CFCDHM [O-]c1ccc(Cl)cc1CN1CCS[C@@H]2COCC[C@H]21 ZINC000246445973 526346784 /nfs/dbraw/zinc/34/67/84/526346784.db2.gz NNXOEPKSMGFGQO-TZMCWYRMSA-N -1 3 299.823 2.752 20 10 CFCDHM O=c1[nH]ccc2c1CN(Cc1c([O-])cccc1Cl)CC2 ZINC000276979323 526362356 /nfs/dbraw/zinc/36/23/56/526362356.db2.gz FFECEBLITAYKDJ-UHFFFAOYSA-N -1 3 290.750 2.705 20 10 CFCDHM O=C(N[C@H]1CC12CCCCC2)c1cccc(O)c1[O-] ZINC000193152001 527017394 /nfs/dbraw/zinc/01/73/94/527017394.db2.gz AFJVGLFLCAZFLV-LBPRGKRZSA-N -1 3 261.321 2.550 20 10 CFCDHM COC(=O)CN(Cc1cc(Cl)ccc1[O-])C[C@@H]1C[C@H]1C ZINC000754120259 574090783 /nfs/dbraw/zinc/09/07/83/574090783.db2.gz BLCMBTZJMAFZRD-MNOVXSKESA-N -1 3 297.782 2.677 20 10 CFCDHM CCOc1ccc([O-])c(C[NH2+]C2CCC(C(=O)[O-])CC2)c1 ZINC000737203639 574118283 /nfs/dbraw/zinc/11/82/83/574118283.db2.gz PPPQMJCZVOZLRF-UHFFFAOYSA-N -1 3 293.363 2.524 20 10 CFCDHM C[C@@H]1CCCC[C@H]1OCCNC(=O)c1cc([O-])cs1 ZINC000731870226 574131280 /nfs/dbraw/zinc/13/12/80/574131280.db2.gz VNIFANXQKKWLDC-ZYHUDNBSSA-N -1 3 283.393 2.779 20 10 CFCDHM Cc1ccccc1OCCN(C)C(=O)c1cc([O-])cs1 ZINC000731864746 574131399 /nfs/dbraw/zinc/13/13/99/574131399.db2.gz BYHRBHJJBFBTOZ-UHFFFAOYSA-N -1 3 291.372 2.913 20 10 CFCDHM C[C@@H](OC(=O)c1cc([O-])cs1)C(=O)c1ccccc1 ZINC000731912184 574133856 /nfs/dbraw/zinc/13/38/56/574133856.db2.gz PZIDZRRPBMUQJP-SECBINFHSA-N -1 3 276.313 2.882 20 10 CFCDHM COC(=O)CN(CC=C(C)C)Cc1cc(Cl)ccc1[O-] ZINC000732203086 574146314 /nfs/dbraw/zinc/14/63/14/574146314.db2.gz OISVEVWKUAHLMD-UHFFFAOYSA-N -1 3 297.782 2.987 20 10 CFCDHM CC(=O)Nc1cc(NC(=O)c2cc([O-])cs2)ccc1F ZINC000732266911 574147970 /nfs/dbraw/zinc/14/79/70/574147970.db2.gz PPJWPHLPHXSVPD-UHFFFAOYSA-N -1 3 294.307 2.804 20 10 CFCDHM Cc1cc(CNC(=O)c2cc([O-])cs2)ccc1F ZINC000732263826 574148076 /nfs/dbraw/zinc/14/80/76/574148076.db2.gz VUFBTKJHGRIEEZ-UHFFFAOYSA-N -1 3 265.309 2.831 20 10 CFCDHM CN(C)[C@H](CNC(=O)c1cc([O-])cs1)c1ccsc1 ZINC000732270109 574148694 /nfs/dbraw/zinc/14/86/94/574148694.db2.gz ZXFUSBDUYIRWCK-LLVKDONJSA-N -1 3 296.417 2.548 20 10 CFCDHM CC(C)(C)n1cc(NC(=O)c2cc([O-])cs2)cn1 ZINC000732278727 574149585 /nfs/dbraw/zinc/14/95/85/574149585.db2.gz UKTAFUUIIFOEIH-UHFFFAOYSA-N -1 3 265.338 2.658 20 10 CFCDHM COCCN(Cc1ccccc1)C(=O)c1cc([O-])cs1 ZINC000732258136 574149619 /nfs/dbraw/zinc/14/96/19/574149619.db2.gz FYULLGLTVBQUCD-UHFFFAOYSA-N -1 3 291.372 2.743 20 10 CFCDHM C[C@H](NC(=O)c1cc([O-])cs1)c1cccc(O)c1 ZINC000732281756 574150241 /nfs/dbraw/zinc/15/02/41/574150241.db2.gz CGHNXAOGVHWFSK-QMMMGPOBSA-N -1 3 263.318 2.650 20 10 CFCDHM CCCN(C[C@@H]1CCCCO1)C(=O)c1cc([O-])cs1 ZINC000732288576 574150448 /nfs/dbraw/zinc/15/04/48/574150448.db2.gz DJQBYZFPCBGRFQ-LBPRGKRZSA-N -1 3 283.393 2.875 20 10 CFCDHM O=C(OCc1cccnc1Cl)c1cc([O-])cs1 ZINC000732353208 574152893 /nfs/dbraw/zinc/15/28/93/574152893.db2.gz NZACPESOGLIJEC-UHFFFAOYSA-N -1 3 269.709 2.859 20 10 CFCDHM O=C(OCc1noc2c1CCCC2)c1cc([O-])cs1 ZINC000732354959 574153215 /nfs/dbraw/zinc/15/32/15/574153215.db2.gz XQPBMMPXWPNHKP-UHFFFAOYSA-N -1 3 279.317 2.678 20 10 CFCDHM Cc1cc(CN[C@H](C)c2cc(F)cc(F)c2[O-])n[nH]1 ZINC000756584584 574250589 /nfs/dbraw/zinc/25/05/89/574250589.db2.gz GRMRHXQRPIUKQO-MRVPVSSYSA-N -1 3 267.279 2.553 20 10 CFCDHM Cc1cc(CN[C@H](C)c2cc(F)cc(F)c2[O-])[nH]n1 ZINC000756584584 574250593 /nfs/dbraw/zinc/25/05/93/574250593.db2.gz GRMRHXQRPIUKQO-MRVPVSSYSA-N -1 3 267.279 2.553 20 10 CFCDHM C[C@@H]1C[C@@H](NCc2ccon2)c2c1c(F)ccc2[O-] ZINC000756635509 574253858 /nfs/dbraw/zinc/25/38/58/574253858.db2.gz GBXJQIGDSLDTEM-LDYMZIIASA-N -1 3 262.284 2.857 20 10 CFCDHM Cc1noc(C)c1[C@@H](C)NC(=O)c1cc([O-])cs1 ZINC000733806405 574257008 /nfs/dbraw/zinc/25/70/08/574257008.db2.gz BNRXMAWUEPFUPI-ZCFIWIBFSA-N -1 3 266.322 2.550 20 10 CFCDHM C[C@H](NCc1ccn(C)n1)c1cc(Cl)ccc1[O-] ZINC000756778266 574262452 /nfs/dbraw/zinc/26/24/52/574262452.db2.gz NNQYKZZUSIXZBW-VIFPVBQESA-N -1 3 265.744 2.630 20 10 CFCDHM CCO[C@H]1C[C@H](NC(=O)c2cc([O-])cs2)C12CCC2 ZINC000743630454 574369753 /nfs/dbraw/zinc/36/97/53/574369753.db2.gz TWHXBYNUGJZGQM-RYUDHWBXSA-N -1 3 281.377 2.531 20 10 CFCDHM Cc1cccc(O[C@@H](C)CNC(=O)c2cc([O-])cs2)c1 ZINC000743712206 574371064 /nfs/dbraw/zinc/37/10/64/574371064.db2.gz NMTPLJXKENEZIV-NSHDSACASA-N -1 3 291.372 2.959 20 10 CFCDHM CCO[C@@H]1C[C@@H](NC(=O)c2cc([O-])cs2)C12CCCC2 ZINC000743790882 574372097 /nfs/dbraw/zinc/37/20/97/574372097.db2.gz OLRCGRPGHXEKMG-CHWSQXEVSA-N -1 3 295.404 2.921 20 10 CFCDHM C[N@H+](Cc1cc(F)ccc1[O-])C1(C(=O)[O-])CCCCC1 ZINC000394227457 605480249 /nfs/dbraw/zinc/48/02/49/605480249.db2.gz MMFDSDOJMGOXBH-UHFFFAOYSA-N -1 3 281.327 2.751 20 10 CFCDHM C[N@@H+](Cc1cc(F)ccc1[O-])C1(C(=O)[O-])CCCCC1 ZINC000394227457 605480254 /nfs/dbraw/zinc/48/02/54/605480254.db2.gz MMFDSDOJMGOXBH-UHFFFAOYSA-N -1 3 281.327 2.751 20 10 CFCDHM [O-]c1ccc(Cl)c(F)c1CNCc1ccccc1CO ZINC000790956110 618084135 /nfs/dbraw/zinc/08/41/35/618084135.db2.gz MRKCZFQYFCEAOE-UHFFFAOYSA-N -1 3 295.741 2.967 20 10 CFCDHM CCN1CCCC[C@H]1C(=O)NCc1cccc(Cl)c1[O-] ZINC000890758228 617836004 /nfs/dbraw/zinc/83/60/04/617836004.db2.gz SOGBEWCSNMGXJK-ZDUSSCGKSA-N -1 3 296.798 2.536 20 10 CFCDHM CC(=O)c1cc(F)cc(CN(C)Cc2ccoc2)c1[O-] ZINC000050151067 618079157 /nfs/dbraw/zinc/07/91/57/618079157.db2.gz IWMPXCRDDBOIPF-UHFFFAOYSA-N -1 3 277.295 2.959 20 10 CFCDHM Cc1ccc(C(=O)Nc2ccc(F)c(F)c2)c([O-])c1O ZINC000179384392 618268865 /nfs/dbraw/zinc/26/88/65/618268865.db2.gz GDPJISYQDZAHRW-UHFFFAOYSA-N -1 3 279.242 2.937 20 10 CFCDHM O=C(NCCC1CC=CC1)NCc1c([O-])cccc1F ZINC000926729119 618609294 /nfs/dbraw/zinc/60/92/94/618609294.db2.gz KEWIOHUEKBPCMD-UHFFFAOYSA-N -1 3 278.327 2.687 20 10 CFCDHM COc1ccc(NC(=O)c2ccc(C)c(O)c2[O-])c(C)c1 ZINC000182306282 625282615 /nfs/dbraw/zinc/28/26/15/625282615.db2.gz MLSAFPXRCPVNIO-UHFFFAOYSA-N -1 3 287.315 2.976 20 10 CFCDHM CC(C)(C)C(C)(C)CNC(=O)c1cccc(O)c1[O-] ZINC000311827830 618724445 /nfs/dbraw/zinc/72/44/45/618724445.db2.gz FTONZRXKRZWMSZ-UHFFFAOYSA-N -1 3 265.353 2.900 20 10 CFCDHM O=[N+]([O-])c1cc(Cl)cc(CN2CC[C@H](CF)C2)c1[O-] ZINC000895572381 619556667 /nfs/dbraw/zinc/55/66/67/619556667.db2.gz CQSWNYYNXBMOFC-MRVPVSSYSA-N -1 3 288.706 2.745 20 10 CFCDHM CC(C)c1noc(NCc2c([O-])cccc2F)n1 ZINC000895832595 619619310 /nfs/dbraw/zinc/61/93/10/619619310.db2.gz HXUVBQGJKPTJDT-UHFFFAOYSA-N -1 3 251.261 2.650 20 10 CFCDHM [O-]c1cccc(F)c1CNCc1cccc2c1OCCO2 ZINC000896640223 619781461 /nfs/dbraw/zinc/78/14/61/619781461.db2.gz GWPGQKLWXJNHCL-UHFFFAOYSA-N -1 3 289.306 2.592 20 10 CFCDHM [O-]c1cccc(F)c1CNCc1cccc2c1OCC2 ZINC000896641227 619782123 /nfs/dbraw/zinc/78/21/23/619782123.db2.gz TZJRQXJMZBMWLR-UHFFFAOYSA-N -1 3 273.307 2.756 20 10 CFCDHM Cc1ccc([C@H](C)C(=O)NCc2c([O-])cccc2F)o1 ZINC000928706206 619995899 /nfs/dbraw/zinc/99/58/99/619995899.db2.gz STDKIPKGWAWIIO-JTQLQIEISA-N -1 3 277.295 2.853 20 10 CFCDHM CC(C)(C(=O)NCc1c([O-])cccc1F)C1CCOCC1 ZINC000928709181 619996539 /nfs/dbraw/zinc/99/65/39/619996539.db2.gz XUIRECLLLOMZHW-UHFFFAOYSA-N -1 3 295.354 2.600 20 10 CFCDHM C[C@H]1CN(Cc2cc(Cl)cc(Cl)c2[O-])C[C@H]1O ZINC000897684508 620271070 /nfs/dbraw/zinc/27/10/70/620271070.db2.gz QKKXVWHWZOEOAC-WRWORJQWSA-N -1 3 276.163 2.512 20 10 CFCDHM CCc1nocc1CNCc1cccc(Cl)c1[O-] ZINC000898219095 620347264 /nfs/dbraw/zinc/34/72/64/620347264.db2.gz UVRMRWHPKBCGJY-UHFFFAOYSA-N -1 3 266.728 2.886 20 10 CFCDHM C[C@H](NCc1cc(C2CC2)n(C)n1)c1c([O-])cccc1F ZINC000927107450 620453899 /nfs/dbraw/zinc/45/38/99/620453899.db2.gz IIRZXAURJXILEM-JTQLQIEISA-N -1 3 289.354 2.993 20 10 CFCDHM CC(C)[C@@H](N[C@@H](C)c1c([O-])cccc1F)c1nncn1C ZINC000903063726 621238077 /nfs/dbraw/zinc/23/80/77/621238077.db2.gz HKXOIKKULQGKEI-IINYFYTJSA-N -1 3 292.358 2.708 20 10 CFCDHM CC1(CNC(=O)c2cccc(O)c2[O-])CCCCC1 ZINC000229413262 623202962 /nfs/dbraw/zinc/20/29/62/623202962.db2.gz JKHMMESJAMJIRI-UHFFFAOYSA-N -1 3 263.337 2.798 20 10 CFCDHM CCN(CC)c1ccc(CNC(=O)c2cncc([O-])c2)cc1 ZINC000171864488 623247221 /nfs/dbraw/zinc/24/72/21/623247221.db2.gz VKWWTHSDLNKHNW-UHFFFAOYSA-N -1 3 299.374 2.563 20 10 CFCDHM Cc1cc([O-])c(CN(C)Cc2ccon2)cc1Cl ZINC000824848918 623577199 /nfs/dbraw/zinc/57/71/99/623577199.db2.gz CBPWTEOFHZGNBH-UHFFFAOYSA-N -1 3 266.728 2.974 20 10 CFCDHM C[C@@H]1CCCC[C@H]1NC(=O)NCc1c([O-])cccc1F ZINC000913856857 623622939 /nfs/dbraw/zinc/62/29/39/623622939.db2.gz QQTBGPHBIQGXNU-ZWNOBZJWSA-N -1 3 280.343 2.909 20 10 CFCDHM CCN(Cc1cn(C)nn1)Cc1cc(Cl)c(C)cc1[O-] ZINC000825479767 623700197 /nfs/dbraw/zinc/70/01/97/623700197.db2.gz RXZBPCQAENGIBY-UHFFFAOYSA-N -1 3 294.786 2.505 20 10 CFCDHM C[C@@H]1CCC[C@H](NC(=O)NCc2c([O-])cccc2F)C1 ZINC000914201044 623733742 /nfs/dbraw/zinc/73/37/42/623733742.db2.gz VNIDJDDAROZLID-MNOVXSKESA-N -1 3 280.343 2.909 20 10 CFCDHM Cc1cc([O-])c(CN2CCO[C@@H](C(F)F)C2)cc1Cl ZINC000825778879 623753865 /nfs/dbraw/zinc/75/38/65/623753865.db2.gz CDIZNQURCKLARE-GFCCVEGCSA-N -1 3 291.725 2.820 20 10 CFCDHM COCC[C@@H]1COCCN1Cc1cc(Cl)c(C)cc1[O-] ZINC000825956181 623775938 /nfs/dbraw/zinc/77/59/38/623775938.db2.gz YMXTXSQXQNOQSB-CYBMUJFWSA-N -1 3 299.798 2.591 20 10 CFCDHM COCCN(CCF)Cc1c([O-])cc(C)cc1Cl ZINC000827049261 623930366 /nfs/dbraw/zinc/93/03/66/623930366.db2.gz VPBRKUSUAJZLJE-UHFFFAOYSA-N -1 3 275.751 2.772 20 10 CFCDHM CC1(C)CCC[C@H]1NC(=O)NCc1c([O-])cccc1F ZINC000921351743 624852617 /nfs/dbraw/zinc/85/26/17/624852617.db2.gz SWVSCNPTGVBKKQ-CYBMUJFWSA-N -1 3 280.343 2.909 20 10 CFCDHM COCc1ccccc1NC(=O)c1ccc(C)c(O)c1[O-] ZINC000179431734 624962205 /nfs/dbraw/zinc/96/22/05/624962205.db2.gz DMKVYIJSLDLCDJ-UHFFFAOYSA-N -1 3 287.315 2.805 20 10 CFCDHM C[C@@H](NC(=O)c1cccc(O)c1[O-])c1ccc(F)cc1F ZINC000186757555 626398567 /nfs/dbraw/zinc/39/85/67/626398567.db2.gz MGTHNFOBLIUTDN-MRVPVSSYSA-N -1 3 293.269 2.867 20 10 CFCDHM C[C@H](CNC(=O)NCc1c([O-])cccc1F)CC(F)F ZINC000923022844 626443155 /nfs/dbraw/zinc/44/31/55/626443155.db2.gz FAEYCGMOOXNLKE-QMMMGPOBSA-N -1 3 290.285 2.622 20 10 CFCDHM O=C(N[C@@H]1C[C@@H]1c1cccc(F)c1)c1cccc(O)c1[O-] ZINC000187078710 626449264 /nfs/dbraw/zinc/44/92/64/626449264.db2.gz SOYTZQZBYMDMAD-CHWSQXEVSA-N -1 3 287.290 2.523 20 10 CFCDHM CC(C)[C@@H](NC(=O)NCc1c([O-])cccc1F)C1CC1 ZINC000923327130 626466638 /nfs/dbraw/zinc/46/66/38/626466638.db2.gz NSHJIWPPYIGQFT-CQSZACIVSA-N -1 3 280.343 2.765 20 10 CFCDHM O=C1C[C@H]2CC[C@@H](C1)N2Cc1c([O-])ccc(Cl)c1F ZINC000839129300 626527574 /nfs/dbraw/zinc/52/75/74/626527574.db2.gz IYVPOOBTSQMSLH-DTORHVGOSA-N -1 3 283.730 2.881 20 10 CFCDHM [O-]c1cc(F)c(Cl)cc1CN1CC2(C1)CCOCC2 ZINC000839141756 626528571 /nfs/dbraw/zinc/52/85/71/626528571.db2.gz YZZNRMWCNCSWJB-UHFFFAOYSA-N -1 3 285.746 2.797 20 10 CFCDHM Cc1ncc(CNCc2cc(Cl)cc(F)c2[O-])o1 ZINC000839171163 626529357 /nfs/dbraw/zinc/52/93/57/626529357.db2.gz ZUEJQVYZMHBWOU-UHFFFAOYSA-N -1 3 270.691 2.771 20 10 CFCDHM [O-]c1cc(F)c(Cl)cc1CN1CCC[C@@H]2COC[C@@H]21 ZINC000839190732 626530538 /nfs/dbraw/zinc/53/05/38/626530538.db2.gz KCUWRAOLXZLEJL-RNCFNFMXSA-N -1 3 285.746 2.796 20 10 CFCDHM O=C(NCCC1Cc2ccccc2C1)c1cccc(O)c1[O-] ZINC000760563664 626756023 /nfs/dbraw/zinc/75/60/23/626756023.db2.gz VRMSIOAPCGUIJC-UHFFFAOYSA-N -1 3 297.354 2.633 20 10 CFCDHM Cc1cc(C)cc(CN(C)C(=O)c2cccc(O)c2[O-])c1 ZINC000765637653 627152497 /nfs/dbraw/zinc/15/24/97/627152497.db2.gz SYDAHKBNYQLELA-UHFFFAOYSA-N -1 3 285.343 2.987 20 10 CFCDHM C[C@H](O)C1CCN(Cc2cc(Cl)cc(F)c2[O-])CC1 ZINC000775675087 628053231 /nfs/dbraw/zinc/05/32/31/628053231.db2.gz SBGURACEPCYCOI-VIFPVBQESA-N -1 3 287.762 2.778 20 10 CFCDHM CC[C@]1(O)CCN(Cc2cc(Cl)cc(F)c2[O-])C1 ZINC000779219077 628361158 /nfs/dbraw/zinc/36/11/58/628361158.db2.gz LMJWGNIEXWPMCE-ZDUSSCGKSA-N -1 3 273.735 2.532 20 10 CFCDHM Cc1[nH]nc(C(F)F)c1NC(=O)c1ccc(C)c(O)c1[O-] ZINC000781357932 628542771 /nfs/dbraw/zinc/54/27/71/628542771.db2.gz VZAZAKSETJEOLB-UHFFFAOYSA-N -1 3 297.261 2.628 20 10 CFCDHM C[C@@H](CNC(=O)c1cccc(O)c1[O-])c1ccc(F)cc1 ZINC000790576528 629249696 /nfs/dbraw/zinc/24/96/96/629249696.db2.gz KCKXVNUKAZJRJY-JTQLQIEISA-N -1 3 289.306 2.770 20 10 CFCDHM O=C(c1cccc(O)c1[O-])N1CCCc2sccc2C1 ZINC000790666025 629256372 /nfs/dbraw/zinc/25/63/72/629256372.db2.gz PMKNDGPSXPESTA-UHFFFAOYSA-N -1 3 289.356 2.748 20 10 CFCDHM O=C(N[C@@H]1CCc2ccc(F)cc21)c1cccc(O)c1[O-] ZINC000790664631 629256589 /nfs/dbraw/zinc/25/65/89/629256589.db2.gz SBQBIIMGVGJKHL-CYBMUJFWSA-N -1 3 287.290 2.654 20 10 CFCDHM [O-]c1ccc(Cl)c(F)c1CN1CCC[C@H](CCO)C1 ZINC000792168044 629404795 /nfs/dbraw/zinc/40/47/95/629404795.db2.gz ZELJMXNYHPAOLM-SNVBAGLBSA-N -1 3 287.762 2.779 20 10 CFCDHM C[C@H](NCc1cccnc1F)c1cc([N+](=O)[O-])ccc1[O-] ZINC000794835605 629692537 /nfs/dbraw/zinc/69/25/37/629692537.db2.gz MGWRPVJRNJLXLT-VIFPVBQESA-N -1 3 291.282 2.685 20 10 CFCDHM CCn1ncnc1CN[C@H](C)c1cc(Cl)ccc1[O-] ZINC000794842028 629693163 /nfs/dbraw/zinc/69/31/63/629693163.db2.gz OZCVIUHOSDCGGV-SECBINFHSA-N -1 3 280.759 2.508 20 10 CFCDHM CC(=O)c1cc(F)cc(CN2CC[C@@H](C)O[C@@H](C)C2)c1[O-] ZINC000852588254 634787324 /nfs/dbraw/zinc/78/73/24/634787324.db2.gz AJLZVOSLGISSHZ-MNOVXSKESA-N -1 3 295.354 2.733 20 10 CFCDHM CC(C)[C@@H]1CN(C(=O)c2cccc(O)c2[O-])[C@H]1C(C)C ZINC000836888067 630908523 /nfs/dbraw/zinc/90/85/23/630908523.db2.gz ITBLFLROTXLEPY-JSGCOSHPSA-N -1 3 277.364 2.850 20 10 CFCDHM Cc1cc([O-])c(CN(C)Cc2cc[nH]n2)c(Cl)c1 ZINC000840918818 631263715 /nfs/dbraw/zinc/26/37/15/631263715.db2.gz ZLHAPMQSPWIVON-UHFFFAOYSA-N -1 3 265.744 2.709 20 10 CFCDHM CON(C[C@@H]1CCC[C@@H](C)C1)C(=O)c1cccc(O)c1[O-] ZINC000812419712 631714406 /nfs/dbraw/zinc/71/44/06/631714406.db2.gz OYLDMCJWHHIMKU-VXGBXAGGSA-N -1 3 293.363 2.928 20 10 CFCDHM C[C@H]1[C@H](C)N(Cc2cc(Cl)c(F)cc2[O-])CCN1C ZINC000816571720 632487641 /nfs/dbraw/zinc/48/76/41/632487641.db2.gz NTKIVWSRVKEYAA-UWVGGRQHSA-N -1 3 286.778 2.709 20 10 CFCDHM CCn1nc(C)c(CN[C@H](C)c2cc(Cl)ccc2[O-])n1 ZINC000818345100 632833460 /nfs/dbraw/zinc/83/34/60/632833460.db2.gz JJFCKIUVRIUBSI-SECBINFHSA-N -1 3 294.786 2.816 20 10 CFCDHM CCOc1ccc(C[N@H+](CC(=O)[O-])CC(C)(C)C)c([O-])c1 ZINC000854244033 635270492 /nfs/dbraw/zinc/27/04/92/635270492.db2.gz MOBFDPREELNZEF-UHFFFAOYSA-N -1 3 295.379 2.724 20 10 CFCDHM CCOc1ccc(C[N@@H+](CC(=O)[O-])CC(C)(C)C)c([O-])c1 ZINC000854244033 635270496 /nfs/dbraw/zinc/27/04/96/635270496.db2.gz MOBFDPREELNZEF-UHFFFAOYSA-N -1 3 295.379 2.724 20 10 CFCDHM Cc1cc(Cl)cc(C[NH2+]C[C@H](C(=O)[O-])C2CCC2)c1[O-] ZINC000854245898 635271742 /nfs/dbraw/zinc/27/17/42/635271742.db2.gz GEOVNOGXSDRZOA-ZDUSSCGKSA-N -1 3 297.782 2.945 20 10 CFCDHM O=C(NC1(Cc2ccccc2)CCC1)c1cccc(O)c1[O-] ZINC000857300561 635962547 /nfs/dbraw/zinc/96/25/47/635962547.db2.gz DTLKJIQTUBVSIP-UHFFFAOYSA-N -1 3 297.354 2.993 20 10 CFCDHM C[C@H](Nc1cnn(CCF)c1)c1ccc(F)cc1[O-] ZINC000858491952 636271595 /nfs/dbraw/zinc/27/15/95/636271595.db2.gz QTJRNLSCYULENE-VIFPVBQESA-N -1 3 267.279 2.870 20 10 CFCDHM COCCc1ccccc1NC(=O)c1cccc(O)c1[O-] ZINC000191704480 650518783 /nfs/dbraw/zinc/51/87/83/650518783.db2.gz JCGBJHMYUKJUQT-UHFFFAOYSA-N -1 3 287.315 2.539 20 10 CFCDHM COc1cccc(C)c1NC(=O)c1cccc(O)c1[O-] ZINC000192948183 650611393 /nfs/dbraw/zinc/61/13/93/650611393.db2.gz XOPDECMLJHIUMM-UHFFFAOYSA-N -1 3 273.288 2.667 20 10 CFCDHM CC[C@@]1(O)CCCN(Cc2cc(Cl)cc(F)c2[O-])C1 ZINC000877691724 643457938 /nfs/dbraw/zinc/45/79/38/643457938.db2.gz UNGFTVATXVHKEM-CQSZACIVSA-N -1 3 287.762 2.922 20 10 CFCDHM COC(=O)CN(Cc1cc(Cl)ccc1[O-])C1CCCC1 ZINC000093277171 650936697 /nfs/dbraw/zinc/93/66/97/650936697.db2.gz CAVPHLQLIMCOEH-UHFFFAOYSA-N -1 3 297.782 2.963 20 10 CFCDHM CCc1ncc(CNCc2cc(F)cc(F)c2[O-])o1 ZINC000883136622 645621436 /nfs/dbraw/zinc/62/14/36/645621436.db2.gz IWZLUUGOWTWQES-UHFFFAOYSA-N -1 3 268.263 2.511 20 10 CFCDHM C[C@@H](NCc1cccc(N(C)C)n1)c1c([O-])cccc1F ZINC000886556671 647046492 /nfs/dbraw/zinc/04/64/92/647046492.db2.gz HQQSHYJAUZUQLJ-LLVKDONJSA-N -1 3 289.354 2.843 20 10 CFCDHM C[C@H](N[C@@H]1CCn2ccnc21)c1c([O-])cccc1F ZINC000886615412 647068874 /nfs/dbraw/zinc/06/88/74/647068874.db2.gz FUIDKPFOKCPHHL-GXSJLCMTSA-N -1 3 261.300 2.523 20 10 CFCDHM C[C@@H](N[C@@H](C)c1ccn(C)n1)c1c([O-])cccc1F ZINC000886625078 647074132 /nfs/dbraw/zinc/07/41/32/647074132.db2.gz IETOLCHOIOEBRS-VHSXEESVSA-N -1 3 263.316 2.677 20 10 CFCDHM CC(C)(C)OC[C@@H]1CCCN1C(=O)c1cccc(O)c1[O-] ZINC000928240986 648885955 /nfs/dbraw/zinc/88/59/55/648885955.db2.gz REBBDHONPQETKW-NSHDSACASA-N -1 3 293.363 2.518 20 10 CFCDHM C[C@H]1CC=C(C(=O)NCc2c([O-])cccc2F)CC1 ZINC000928704980 648944227 /nfs/dbraw/zinc/94/42/27/648944227.db2.gz BSMDJWYFWZLPGM-JTQLQIEISA-N -1 3 263.312 2.894 20 10 CFCDHM C[C@@H]1CCC[C@H](C(=O)NCc2c([O-])cccc2F)C1 ZINC000928705199 648944298 /nfs/dbraw/zinc/94/42/98/648944298.db2.gz HFCLIAAQGYQBTH-MNOVXSKESA-N -1 3 265.328 2.974 20 10 CFCDHM O=C(C[C@@H]1CC[C@@H]2C[C@@H]21)NCc1c([O-])cccc1F ZINC000928705595 648944829 /nfs/dbraw/zinc/94/48/29/648944829.db2.gz KDPMTWDSCUPYRZ-VWYCJHECSA-N -1 3 263.312 2.584 20 10 CFCDHM CC[C@@H](CC(F)F)C(=O)NCc1c([O-])cccc1F ZINC000928705508 648945004 /nfs/dbraw/zinc/94/50/04/648945004.db2.gz IZTHNPKMSIEXLH-QMMMGPOBSA-N -1 3 275.270 2.829 20 10 CFCDHM CC(C)c1nocc1C(=O)NCc1c([O-])cccc1F ZINC000928707677 648945256 /nfs/dbraw/zinc/94/52/56/648945256.db2.gz ALEBYCHMDXBPEB-UHFFFAOYSA-N -1 3 278.283 2.573 20 10 CFCDHM C[C@@H](Cc1ccco1)C(=O)NCc1c([O-])cccc1F ZINC000928708274 648945267 /nfs/dbraw/zinc/94/52/67/648945267.db2.gz BSZJJALUQBXLCE-JTQLQIEISA-N -1 3 277.295 2.619 20 10 CFCDHM Cc1noc(C2CC2)c1C(=O)NCc1c([O-])cccc1F ZINC000928707167 648945567 /nfs/dbraw/zinc/94/55/67/648945567.db2.gz BLVFTSPHQHVWSJ-UHFFFAOYSA-N -1 3 290.294 2.635 20 10 CFCDHM C[C@@H](CC(=O)NCc1c([O-])cccc1F)n1cccc1 ZINC000928712248 648946499 /nfs/dbraw/zinc/94/64/99/648946499.db2.gz PGECANWGLZLWNR-NSHDSACASA-N -1 3 276.311 2.600 20 10 CFCDHM CC(=O)c1cc(F)cc(CN2CCC[C@H](F)C2)c1[O-] ZINC000689862422 775194957 /nfs/dbraw/zinc/19/49/57/775194957.db2.gz GOCACFRYPAXPRR-NSHDSACASA-N -1 3 269.291 2.668 20 10 CFCDHM CC(C)[C@@H]1CCCN(C(=O)c2cccc(O)c2[O-])C1 ZINC000694434562 775484301 /nfs/dbraw/zinc/48/43/01/775484301.db2.gz OQXLHNJEWWZNFR-LLVKDONJSA-N -1 3 263.337 2.606 20 10 CFCDHM C[C@@H]1C[N@H+](Cc2ccc(C(=O)[O-])cc2[O-])CCC1(F)F ZINC001231447306 777221176 /nfs/dbraw/zinc/22/11/76/777221176.db2.gz RNUUSXNFDFNDQM-SECBINFHSA-N -1 3 285.290 2.568 20 10 CFCDHM C[C@@H]1C[N@@H+](Cc2ccc(C(=O)[O-])cc2[O-])CCC1(F)F ZINC001231447306 777221183 /nfs/dbraw/zinc/22/11/83/777221183.db2.gz RNUUSXNFDFNDQM-SECBINFHSA-N -1 3 285.290 2.568 20 10 CFCDHM O=C([O-])c1ccc([O-])c(C[NH+]2CC3CCC(CC3)C2)c1 ZINC001231566326 777262182 /nfs/dbraw/zinc/26/21/82/777262182.db2.gz XTFSCYXKTYCKIC-UHFFFAOYSA-N -1 3 275.348 2.712 20 10 CFCDHM Cc1cc([O-])c(CN2CCC(=O)[C@@H](C)C2)cc1Cl ZINC001231866269 777356103 /nfs/dbraw/zinc/35/61/03/777356103.db2.gz BTAFUBQKVZRGLF-JTQLQIEISA-N -1 3 267.756 2.765 20 10 CFCDHM Cc1cc([O-])c(CN2CCC(=O)[C@H](F)CC2)cc1Cl ZINC001231868900 777356769 /nfs/dbraw/zinc/35/67/69/777356769.db2.gz ZMGXAMSEVZBLNZ-GFCCVEGCSA-N -1 3 285.746 2.857 20 10 CFCDHM Cc1cc([O-])c(CN2CCc3cnn(C)c3C2)cc1Cl ZINC001231870269 777358879 /nfs/dbraw/zinc/35/88/79/777358879.db2.gz QXBAXGQQHAYKCG-UHFFFAOYSA-N -1 3 291.782 2.646 20 10 CFCDHM Cc1cc([O-])c(CN2CCn3nccc3C2)cc1Cl ZINC001231871938 777361672 /nfs/dbraw/zinc/36/16/72/777361672.db2.gz RRWPURYVNWBFRV-UHFFFAOYSA-N -1 3 277.755 2.566 20 10 CFCDHM Cc1ncc(CN(C)Cc2cccc(Cl)c2[O-])cn1 ZINC001231914881 777383792 /nfs/dbraw/zinc/38/37/92/777383792.db2.gz UICKYLBBBUGRQG-UHFFFAOYSA-N -1 3 277.755 2.776 20 10 CFCDHM C[C@@H]1C[C@H](F)CN1Cc1cc(Cl)c([O-])cc1O ZINC001232258626 777496367 /nfs/dbraw/zinc/49/63/67/777496367.db2.gz BGCBSDITRMUXRP-APPZFPTMSA-N -1 3 259.708 2.684 20 10 CFCDHM COc1cc([O-])c(CN2C[C@@H](C)O[C@@H](C)C2)cc1Cl ZINC001232266745 777499542 /nfs/dbraw/zinc/49/95/42/777499542.db2.gz XTXZFVXEUCXALH-AOOOYVTPSA-N -1 3 285.771 2.663 20 10 CFCDHM [O-]c1c(F)c(F)ccc1CN(CCO)Cc1cccs1 ZINC001233077127 777788895 /nfs/dbraw/zinc/78/88/95/777788895.db2.gz FJFOANNMKKPOCO-UHFFFAOYSA-N -1 3 299.342 2.726 20 10 CFCDHM CC1(C)CN(Cc2c([O-])ccc(F)c2F)CCCO1 ZINC001233334803 777895171 /nfs/dbraw/zinc/89/51/71/777895171.db2.gz UKKUFXSTJMVQOA-UHFFFAOYSA-N -1 3 271.307 2.671 20 10 CFCDHM CCN(Cc1cccc(C(F)(F)F)c1[O-])C1COC1 ZINC001233418498 777943224 /nfs/dbraw/zinc/94/32/24/777943224.db2.gz JOSCCXKPNQYDDX-UHFFFAOYSA-N -1 3 275.270 2.632 20 10 CFCDHM COC(=O)CN(C)Cc1cccc(-c2ccccc2)c1[O-] ZINC001234999357 778348145 /nfs/dbraw/zinc/34/81/45/778348145.db2.gz TWFSSRGPQUKFKY-UHFFFAOYSA-N -1 3 285.343 2.664 20 10 CFCDHM CCO[C@@H]1CCCN(Cc2cc(F)c(F)cc2[O-])C1 ZINC001142520107 778399170 /nfs/dbraw/zinc/39/91/70/778399170.db2.gz BKLYCKMBEUCRCZ-LLVKDONJSA-N -1 3 271.307 2.671 20 10 CFCDHM COc1cc([O-])c(CN2CC(OC(C)C)C2)c(Cl)c1 ZINC001236806884 778947013 /nfs/dbraw/zinc/94/70/13/778947013.db2.gz CCAHDPJXFPXJNG-UHFFFAOYSA-N -1 3 285.771 2.663 20 10 CFCDHM [O-]c1ccc(Cl)c(Cl)c1CN1CCC[C@H](O)C1 ZINC001237077231 779006830 /nfs/dbraw/zinc/00/68/30/779006830.db2.gz DIRKIKPYMMGBLO-QMMMGPOBSA-N -1 3 276.163 2.656 20 10 CFCDHM C[C@@H]1COCCN(Cc2c([O-])ccc(F)c2Cl)C1 ZINC001237122771 779012202 /nfs/dbraw/zinc/01/22/02/779012202.db2.gz YMWRVUXFRUNVPF-VIFPVBQESA-N -1 3 273.735 2.653 20 10 CFCDHM Cc1nc(CCN(C)Cc2c([O-])ccc(F)c2Cl)no1 ZINC001237121263 779017640 /nfs/dbraw/zinc/01/76/40/779017640.db2.gz AJUWEMMOWFAELN-UHFFFAOYSA-N -1 3 299.733 2.551 20 10 CFCDHM [O-]c1ccc(F)c(Cl)c1CN1CCCC[C@H]1CO ZINC001237122283 779019274 /nfs/dbraw/zinc/01/92/74/779019274.db2.gz SSGGUMHPHKIBOK-VIFPVBQESA-N -1 3 273.735 2.532 20 10 CFCDHM CN(Cc1cnn(C)c1)Cc1cccc(C(F)(F)F)c1[O-] ZINC001233415878 779041536 /nfs/dbraw/zinc/04/15/36/779041536.db2.gz LYSNDWGLSCIDIF-UHFFFAOYSA-N -1 3 299.296 2.777 20 10 CFCDHM C[C@H]1CN(Cc2cc(Cl)cc(F)c2[O-])CC[C@]1(C)O ZINC001237617656 779144080 /nfs/dbraw/zinc/14/40/80/779144080.db2.gz UDUYFNFCMJPVQD-XPTSAGLGSA-N -1 3 287.762 2.778 20 10 CFCDHM C[C@H]1CCCN(Cc2cc(F)cc(Cl)c2[O-])[C@@H]1CO ZINC001237808967 779184495 /nfs/dbraw/zinc/18/44/95/779184495.db2.gz XGJKGBCCBFSBQI-TVQRCGJNSA-N -1 3 287.762 2.778 20 10 CFCDHM CCO[C@@H]1CCN(Cc2cc(F)c(Cl)cc2[O-])C1 ZINC001237940425 779211956 /nfs/dbraw/zinc/21/19/56/779211956.db2.gz KGPWKNMYFGFSJW-SNVBAGLBSA-N -1 3 273.735 2.796 20 10 CFCDHM C[C@@H]1CCN(Cc2cc(Cl)cc(F)c2[O-])C[C@@]1(C)O ZINC001237617161 779700697 /nfs/dbraw/zinc/70/06/97/779700697.db2.gz LXQJBKCWEPLFSS-YMTOWFKASA-N -1 3 287.762 2.778 20 10 CFCDHM CC[C@@H]1CN(Cc2ccc(F)c(F)c2[O-])CCCO1 ZINC000703539394 781026348 /nfs/dbraw/zinc/02/63/48/781026348.db2.gz AWUFEOMNRIQLHK-LLVKDONJSA-N -1 3 271.307 2.671 20 10 CFCDHM CC(=O)c1cc(F)cc(CN2CC[C@@H](C(F)F)C2)c1[O-] ZINC000707174486 781230124 /nfs/dbraw/zinc/23/01/24/781230124.db2.gz ZMWHNCPDCJKWAX-SECBINFHSA-N -1 3 287.281 2.821 20 10 CFCDHM C[C@H](NCc1cc(F)cc(F)c1[O-])c1cscn1 ZINC000708498047 781290949 /nfs/dbraw/zinc/29/09/49/781290949.db2.gz WSAYLFRMNIZTLT-ZETCQYMHSA-N -1 3 270.304 2.978 20 10 CFCDHM C[C@H]1CSCCN1Cc1cccc(Cl)c1[O-] ZINC000180246628 300388996 /nfs/dbraw/zinc/38/89/96/300388996.db2.gz HXAXGXVVXTZPEK-VIFPVBQESA-N -1 3 257.786 2.983 20 10 CFCDHM C[C@H](N[C@@H](C)c1ccc(F)c(F)c1[O-])c1cn[nH]c1 ZINC000276908174 299345431 /nfs/dbraw/zinc/34/54/31/299345431.db2.gz KGJCCSXYFNNTPC-YUMQZZPRSA-N -1 3 267.279 2.805 20 10 CFCDHM C[C@H](NCc1nncn1C)c1ccc2ccccc2c1[O-] ZINC000038007515 372761394 /nfs/dbraw/zinc/76/13/94/372761394.db2.gz FGKYZFGSPLWYRP-NSHDSACASA-N -1 3 282.347 2.525 20 10 CFCDHM CN(Cc1cnn(C(C)(C)C)c1)Cc1ccccc1[O-] ZINC000091974711 375072813 /nfs/dbraw/zinc/07/28/13/375072813.db2.gz ASXJYTQHQGTOPA-UHFFFAOYSA-N -1 3 273.380 2.976 20 10 CFCDHM Cc1nn(C)c(C)c1CN[C@H](C)c1ccc(F)cc1[O-] ZINC000092324702 375102289 /nfs/dbraw/zinc/10/22/89/375102289.db2.gz VMIOVAWDJIHJTL-SECBINFHSA-N -1 3 277.343 2.732 20 10 CFCDHM [O-]c1ccc(Cl)cc1CN1CCOC2(CCC2)C1 ZINC000093640194 375280504 /nfs/dbraw/zinc/28/05/04/375280504.db2.gz DHRRLGBUFOZRQQ-UHFFFAOYSA-N -1 3 267.756 2.801 20 10 CFCDHM [O-]c1ccc(Cl)cc1CN1CCOCC12CCC2 ZINC000093510083 375260331 /nfs/dbraw/zinc/26/03/31/375260331.db2.gz POGFDWKXWMOWTI-UHFFFAOYSA-N -1 3 267.756 2.801 20 10 CFCDHM O=C(NCc1cc(Cl)ccc1[O-])c1cnn(C2CC2)c1 ZINC000529513491 383715260 /nfs/dbraw/zinc/71/52/60/383715260.db2.gz RXFJDYKGFBPSRV-UHFFFAOYSA-N -1 3 291.738 2.507 20 10 CFCDHM COCCn1ccc(NCc2c([O-])cccc2Cl)n1 ZINC000123997755 377005173 /nfs/dbraw/zinc/00/51/73/377005173.db2.gz AKPNREXUPQSMKV-UHFFFAOYSA-N -1 3 281.743 2.501 20 10 CFCDHM [O-]c1ccc(Br)cc1CN1CCSCC1 ZINC000126156935 377213640 /nfs/dbraw/zinc/21/36/40/377213640.db2.gz QSACUNWBOUBJIB-UHFFFAOYSA-N -1 3 288.210 2.704 20 10 CFCDHM O=C(c1cccc(O)c1[O-])N1CCC2(CCCC2)CC1 ZINC000126402256 377226566 /nfs/dbraw/zinc/22/65/66/377226566.db2.gz LOYQXPHUNGCHNB-UHFFFAOYSA-N -1 3 275.348 2.894 20 10 CFCDHM [O-]c1cccc(Cl)c1CN1CC[C@](O)(C(F)(F)F)C1 ZINC000130168244 377519493 /nfs/dbraw/zinc/51/94/93/377519493.db2.gz MHKQDQSWEMKJTM-LLVKDONJSA-N -1 3 295.688 2.545 20 10 CFCDHM CN(Cc1c([O-])cccc1Cl)[C@H]1CCSC1 ZINC000130577237 377580090 /nfs/dbraw/zinc/58/00/90/377580090.db2.gz CHONQDAQDXGTLJ-VIFPVBQESA-N -1 3 257.786 2.983 20 10 CFCDHM Cc1ccc(C(=O)N(C)CC2CCCC2)c([O-])c1O ZINC000177677246 380365369 /nfs/dbraw/zinc/36/53/69/380365369.db2.gz SDMCMMDUMLGASP-UHFFFAOYSA-N -1 3 263.337 2.668 20 10 CFCDHM Cc1ccc(C(=O)N2CCC[C@H]2c2ccncc2)c([O-])c1O ZINC000181836181 380910260 /nfs/dbraw/zinc/91/02/60/380910260.db2.gz LXMZGRSSPWKEGM-AWEZNQCLSA-N -1 3 298.342 2.779 20 10 CFCDHM [O-]c1cc2c(cc1CN[C@@H](C1CC1)C(F)(F)F)OCO2 ZINC000288394173 381011320 /nfs/dbraw/zinc/01/13/20/381011320.db2.gz HIXKEBVQTDECME-LBPRGKRZSA-N -1 3 289.253 2.551 20 10 CFCDHM CCOC(=O)[C@H]1CCCCCN1Cc1ccccc1[O-] ZINC000371465880 381633859 /nfs/dbraw/zinc/63/38/59/381633859.db2.gz IWTMRIKMGQOBCR-CQSZACIVSA-N -1 3 277.364 2.700 20 10 CFCDHM CC(C)N1CC[C@H](N[C@H](C)c2cc(Cl)ccc2[O-])C1=O ZINC000186047730 381811308 /nfs/dbraw/zinc/81/13/08/381811308.db2.gz WGNCAGWTGPKXHG-MFKMUULPSA-N -1 3 296.798 2.706 20 10 CFCDHM Cc1cc(Cl)cc(CN2CCc3c(ncn3C)C2)c1[O-] ZINC000375016945 382064659 /nfs/dbraw/zinc/06/46/59/382064659.db2.gz ZXLZJLWLTGBTKJ-UHFFFAOYSA-N -1 3 291.782 2.646 20 10 CFCDHM [O-]c1c(Cl)cccc1CN1CCC[C@H]2COC[C@H]21 ZINC000375703538 382098534 /nfs/dbraw/zinc/09/85/34/382098534.db2.gz HRKJTGYZAPGZMM-WCQYABFASA-N -1 3 267.756 2.656 20 10 CFCDHM O=C(c1cccc(O)c1[O-])N1Cc2cccc(Cl)c2C1 ZINC000377110267 382217427 /nfs/dbraw/zinc/21/74/27/382217427.db2.gz HGWPSHHUFVSHNY-UHFFFAOYSA-N -1 3 289.718 2.907 20 10 CFCDHM C[C@H]1CC[C@@]2(CCN(C(=O)c3cccc(O)c3[O-])C2)C1 ZINC000365554550 382412499 /nfs/dbraw/zinc/41/24/99/382412499.db2.gz DQQNZKWAQSZGMH-MEDUHNTESA-N -1 3 275.348 2.750 20 10 CFCDHM COC[C@H](C)N(C)Cc1cc(Cl)c(F)cc1[O-] ZINC000295316874 382615899 /nfs/dbraw/zinc/61/58/99/382615899.db2.gz LAJQOPPPXGOLTQ-QMMMGPOBSA-N -1 3 261.724 2.651 20 10 CFCDHM [O-]c1c(Cl)cccc1CN[C@H]1CCCc2c[nH]nc21 ZINC000271781972 385392539 /nfs/dbraw/zinc/39/25/39/385392539.db2.gz DWYWGVGRDCBPAU-LBPRGKRZSA-N -1 3 277.755 2.936 20 10 CFCDHM Cn1cc2c(n1)CCC[C@@H]2NCc1cccc(Cl)c1[O-] ZINC000283129071 385439549 /nfs/dbraw/zinc/43/95/49/385439549.db2.gz VYUIMDBBEOQBNY-ZDUSSCGKSA-N -1 3 291.782 2.946 20 10 CFCDHM Cc1ccc(C(=O)N2C[C@@H](C)CC2(C)C)c([O-])c1O ZINC000272709594 385593199 /nfs/dbraw/zinc/59/31/99/385593199.db2.gz DKTOTNHRRIUZDZ-VIFPVBQESA-N -1 3 263.337 2.667 20 10 CFCDHM Cc1ccc(C(=O)N2CC[C@@H](C)C[C@@H]2C)c([O-])c1O ZINC000272804598 385619371 /nfs/dbraw/zinc/61/93/71/385619371.db2.gz ZCIXODIZRIMYKX-KOLCDFICSA-N -1 3 263.337 2.667 20 10 CFCDHM CCc1nnc([C@@H](C)N[C@H](C)c2ccc(F)cc2[O-])[nH]1 ZINC000273480079 385685129 /nfs/dbraw/zinc/68/51/29/385685129.db2.gz LVPDKEUWFZYHEH-RKDXNWHRSA-N -1 3 278.331 2.624 20 10 CFCDHM CCn1cc(N[C@@H](C)c2cc(C(=O)OC)ccc2[O-])cn1 ZINC000273496266 385685983 /nfs/dbraw/zinc/68/59/83/385685983.db2.gz PHAYXTJMTPJZFO-JTQLQIEISA-N -1 3 289.335 2.568 20 10 CFCDHM CC(C)Cc1noc(CN(C)Cc2ccccc2[O-])n1 ZINC000109769290 393879715 /nfs/dbraw/zinc/87/97/15/393879715.db2.gz LTKFYUOOZRSWRZ-UHFFFAOYSA-N -1 3 275.352 2.606 20 10 CFCDHM CCc1noc([C@H](C)N(C)Cc2ccccc2[O-])n1 ZINC000109772666 393879747 /nfs/dbraw/zinc/87/97/47/393879747.db2.gz AJQWSUMHEVQSEV-JTQLQIEISA-N -1 3 261.325 2.531 20 10 CFCDHM C[C@@H]1CCCC[C@@H]1NC(=O)CN(C)Cc1ccccc1[O-] ZINC000109770304 393879799 /nfs/dbraw/zinc/87/97/99/393879799.db2.gz JWVNDAHBBGERQC-HIFRSBDPSA-N -1 3 290.407 2.519 20 10 CFCDHM C[C@H]1COCCN(Cc2c([O-])ccc(Cl)c2F)C1 ZINC000365233384 394229981 /nfs/dbraw/zinc/22/99/81/394229981.db2.gz IGUSLOXYFJZYMQ-SECBINFHSA-N -1 3 273.735 2.653 20 10 CFCDHM COc1cc(Cl)cc(CN2CCC[C@H]3COC[C@H]32)c1[O-] ZINC000367072088 394251544 /nfs/dbraw/zinc/25/15/44/394251544.db2.gz MNTSDOPHTNGQAD-GXFFZTMASA-N -1 3 297.782 2.665 20 10 CFCDHM CCCCOC(=O)[C@@H](C)N(C)Cc1ccccc1[O-] ZINC000119528444 397600693 /nfs/dbraw/zinc/60/06/93/397600693.db2.gz GFVKFFSHIPMWBU-GFCCVEGCSA-N -1 3 265.353 2.556 20 10 CFCDHM Cc1ccc(C(=O)N2CC[C@@H](c3ccco3)C2)c([O-])c1O ZINC000367879375 267123885 /nfs/dbraw/zinc/12/38/85/267123885.db2.gz PIRIIYRNOCRGEL-LLVKDONJSA-N -1 3 287.315 2.629 20 10 CFCDHM Cc1ccc(C(=O)N2C[C@H](C)CC2(C)C)c([O-])c1O ZINC000272709592 301521160 /nfs/dbraw/zinc/52/11/60/301521160.db2.gz DKTOTNHRRIUZDZ-SECBINFHSA-N -1 3 263.337 2.667 20 10 CFCDHM CCOCCN(C)Cc1cc(Cl)c(F)cc1[O-] ZINC000293612991 519904568 /nfs/dbraw/zinc/90/45/68/519904568.db2.gz LYMZHKUNYSHHBB-UHFFFAOYSA-N -1 3 261.724 2.653 20 10 CFCDHM CCOCc1nc([C@H](C)N[C@@H](C)c2ccccc2[O-])no1 ZINC000290020796 520219490 /nfs/dbraw/zinc/21/94/90/520219490.db2.gz CGRXUADNORXDCD-QWRGUYRKSA-N -1 3 291.351 2.724 20 10 CFCDHM CCC(=O)N[C@@H]1CCCN(Cc2cc(Cl)ccc2[O-])C1 ZINC000158043933 521184108 /nfs/dbraw/zinc/18/41/08/521184108.db2.gz HOULQKMUPCHCQD-CYBMUJFWSA-N -1 3 296.798 2.536 20 10 CFCDHM CC[C@H](C)[C@@H](NC(=O)c1cccc(O)c1[O-])C(F)(F)F ZINC000277865912 521853894 /nfs/dbraw/zinc/85/38/94/521853894.db2.gz DHUZPYGAAYSPFB-WRWORJQWSA-N -1 3 291.269 2.805 20 10 CFCDHM COCC(C)(C)CCCNC(=O)c1ccc(C)c(O)c1[O-] ZINC000292316459 522806796 /nfs/dbraw/zinc/80/67/96/522806796.db2.gz OOYZHYASVMWCMS-UHFFFAOYSA-N -1 3 295.379 2.589 20 10 CFCDHM COC(=O)[C@@H]1CCN(Cc2c([O-])cccc2Cl)C[C@H]1C ZINC000276424091 523715019 /nfs/dbraw/zinc/71/50/19/523715019.db2.gz GNUBZPVGICPNOY-GHMZBOCLSA-N -1 3 297.782 2.677 20 10 CFCDHM CO[C@H](C)CN(C)Cc1cc(Cl)cc(C(C)=O)c1[O-] ZINC000285508070 523877859 /nfs/dbraw/zinc/87/78/59/523877859.db2.gz DEGVZUWFZKWRLI-SECBINFHSA-N -1 3 285.771 2.715 20 10 CFCDHM C[C@@H]1CCC[C@H](C)N1C(=O)CN(C)Cc1ccccc1[O-] ZINC000264595690 524354319 /nfs/dbraw/zinc/35/43/19/524354319.db2.gz IEMLMSNLVNCLID-OKILXGFUSA-N -1 3 290.407 2.614 20 10 CFCDHM Cc1cc(Cl)cc(CN2CC(F)(F)C[C@H]2CO)c1[O-] ZINC000364843382 524862721 /nfs/dbraw/zinc/86/27/21/524862721.db2.gz LFUOJFOFSQHUFT-NSHDSACASA-N -1 3 291.725 2.556 20 10 CFCDHM C[C@]1(NCc2cc(-c3ccccc3)ccc2[O-])CCOC1=O ZINC000289922151 525298942 /nfs/dbraw/zinc/29/89/42/525298942.db2.gz VMNMIRDJKMLXLN-SFHVURJKSA-N -1 3 297.354 2.854 20 10 CFCDHM C[C@@H](NCc1ncccc1N(C)C)c1cc(F)ccc1[O-] ZINC000289941177 525560941 /nfs/dbraw/zinc/56/09/41/525560941.db2.gz VZAFOAKGNHATSJ-LLVKDONJSA-N -1 3 289.354 2.843 20 10 CFCDHM Cc1c([C@H](C)N[C@@H](C)c2ccc(F)cc2[O-])cnn1C ZINC000062747619 525922447 /nfs/dbraw/zinc/92/24/47/525922447.db2.gz IJOYCFFOAMLDJD-UWVGGRQHSA-N -1 3 277.343 2.985 20 10 CFCDHM [O-]c1c(F)cccc1CN[C@H]1COc2ccccc21 ZINC000158773097 526330986 /nfs/dbraw/zinc/33/09/86/526330986.db2.gz PVNPPIFUPLJOFC-ZDUSSCGKSA-N -1 3 259.280 2.755 20 10 CFCDHM [O-]c1ccc(Cl)c(F)c1CN1CC[C@]2(CCOC2)C1 ZINC000191426246 526345361 /nfs/dbraw/zinc/34/53/61/526345361.db2.gz RABGOXCILLCLPV-AWEZNQCLSA-N -1 3 285.746 2.797 20 10 CFCDHM CN(Cc1ccccc1[O-])CC(F)(F)C(F)F ZINC000736620802 574062824 /nfs/dbraw/zinc/06/28/24/574062824.db2.gz WXIGFXXZZXKVMS-UHFFFAOYSA-N -1 3 251.223 2.724 20 10 CFCDHM COC(=O)CN(CCC1CC1)Cc1cc(Cl)ccc1[O-] ZINC000744402295 574072289 /nfs/dbraw/zinc/07/22/89/574072289.db2.gz MBQSAGZLUHQUNI-UHFFFAOYSA-N -1 3 297.782 2.821 20 10 CFCDHM CSc1cc(O)ccc1NC(=O)c1cccc(O)c1[O-] ZINC000754747706 574117941 /nfs/dbraw/zinc/11/79/41/574117941.db2.gz SYUNCRYEEDPCMC-UHFFFAOYSA-N -1 3 291.328 2.778 20 10 CFCDHM CO[C@@]1(C)C[C@H](N(C)C(=O)c2cc([O-])cs2)C1(C)C ZINC000754908419 574127210 /nfs/dbraw/zinc/12/72/10/574127210.db2.gz VKAJTUJFWAHPKK-FZMZJTMJSA-N -1 3 283.393 2.729 20 10 CFCDHM CN(Cc1ccccc1[O-])Cc1nc2ccccc2c(=O)[nH]1 ZINC000731843443 574130378 /nfs/dbraw/zinc/13/03/78/574130378.db2.gz HQUJTOSOICCWLO-UHFFFAOYSA-N -1 3 295.342 2.673 20 10 CFCDHM COC(=O)c1cc(CN(C)Cc2ccccc2[O-])c(C)o1 ZINC000731842776 574130404 /nfs/dbraw/zinc/13/04/04/574130404.db2.gz BIDOSHKIDZEAOA-UHFFFAOYSA-N -1 3 289.331 2.712 20 10 CFCDHM C[C@H](CNC(=O)c1cc([O-])cs1)c1ccccc1 ZINC000731861396 574130749 /nfs/dbraw/zinc/13/07/49/574130749.db2.gz ABEHBYLGYPPFHC-SNVBAGLBSA-N -1 3 261.346 2.987 20 10 CFCDHM O=C(NCCOc1cccc(Cl)c1)c1cc([O-])cs1 ZINC000731869536 574131493 /nfs/dbraw/zinc/13/14/93/574131493.db2.gz KUGBGGKNXYFGSX-UHFFFAOYSA-N -1 3 297.763 2.916 20 10 CFCDHM Cc1ccc(OCCNC(=O)c2cc([O-])cs2)cc1 ZINC000731868103 574132340 /nfs/dbraw/zinc/13/23/40/574132340.db2.gz MHGMIEBQKBGJHA-UHFFFAOYSA-N -1 3 277.345 2.571 20 10 CFCDHM CCOCc1ccccc1CNC(=O)c1cc([O-])cs1 ZINC000731868370 574132803 /nfs/dbraw/zinc/13/28/03/574132803.db2.gz FLYGHEZJZJHOTM-UHFFFAOYSA-N -1 3 291.372 2.920 20 10 CFCDHM C[N@H+](Cc1ccccc1[O-])[C@@H](C(=O)[O-])c1ccc(F)cc1 ZINC000737494729 574145097 /nfs/dbraw/zinc/14/50/97/574145097.db2.gz ZTWDPTGLSADRIU-OAHLLOKOSA-N -1 3 289.306 2.789 20 10 CFCDHM C[N@@H+](Cc1ccccc1[O-])[C@@H](C(=O)[O-])c1ccc(F)cc1 ZINC000737494729 574145098 /nfs/dbraw/zinc/14/50/98/574145098.db2.gz ZTWDPTGLSADRIU-OAHLLOKOSA-N -1 3 289.306 2.789 20 10 CFCDHM CN(C)c1ccc(NC(=O)c2cc([O-])cs2)cc1 ZINC000732265317 574147933 /nfs/dbraw/zinc/14/79/33/574147933.db2.gz UYNDLMDMXQYTGZ-UHFFFAOYSA-N -1 3 262.334 2.772 20 10 CFCDHM COc1ccc(CN(C)C(=O)c2cc([O-])cs2)cc1F ZINC000732257780 574149184 /nfs/dbraw/zinc/14/91/84/574149184.db2.gz BJXQJVUMVDTJPU-UHFFFAOYSA-N -1 3 295.335 2.874 20 10 CFCDHM O=C(Nc1n[nH]c2ccc(F)cc21)c1cc([O-])cs1 ZINC000732285574 574150017 /nfs/dbraw/zinc/15/00/17/574150017.db2.gz BZPHFNUDWIHXNA-UHFFFAOYSA-N -1 3 277.280 2.721 20 10 CFCDHM Cc1nc(CNC(=O)c2cc([O-])cs2)nc2ccccc12 ZINC000732283134 574150070 /nfs/dbraw/zinc/15/00/70/574150070.db2.gz YJBNWNUPHLEBCV-UHFFFAOYSA-N -1 3 299.355 2.635 20 10 CFCDHM Cc1cccc2c1CCN(C(=O)c1cc([O-])cs1)C2 ZINC000732286189 574150076 /nfs/dbraw/zinc/15/00/76/574150076.db2.gz BFWUQQNVGMTSHY-UHFFFAOYSA-N -1 3 273.357 2.961 20 10 CFCDHM O=C(NCCCOC1CCCC1)c1cc([O-])cs1 ZINC000732280217 574150154 /nfs/dbraw/zinc/15/01/54/574150154.db2.gz CYVGCUSDRKGLOU-UHFFFAOYSA-N -1 3 269.366 2.533 20 10 CFCDHM Cc1ccc(NC(=O)c2cc([O-])cs2)c2n[nH]cc21 ZINC000732278899 574150237 /nfs/dbraw/zinc/15/02/37/574150237.db2.gz FFAVMHTYHZQUCS-UHFFFAOYSA-N -1 3 273.317 2.891 20 10 CFCDHM CC(C)CCc1noc(COC(=O)c2cc([O-])cs2)n1 ZINC000732354063 574153308 /nfs/dbraw/zinc/15/33/08/574153308.db2.gz ZBFQKGVXEXQRBR-UHFFFAOYSA-N -1 3 296.348 2.782 20 10 CFCDHM Cc1cc([O-])c(C[N@@H+](C[C@H](C)C(=O)[O-])C2CC2)cc1C ZINC000738463429 574170433 /nfs/dbraw/zinc/17/04/33/574170433.db2.gz BWKFGQQKMKWCTI-LBPRGKRZSA-N -1 3 277.364 2.694 20 10 CFCDHM Cc1cc([O-])c(C[N@H+](C[C@H](C)C(=O)[O-])C2CC2)cc1C ZINC000738463429 574170437 /nfs/dbraw/zinc/17/04/37/574170437.db2.gz BWKFGQQKMKWCTI-LBPRGKRZSA-N -1 3 277.364 2.694 20 10 CFCDHM CCS[C@H]1CCC[C@H]1NC(=O)c1cc([O-])cs1 ZINC000755831643 574191233 /nfs/dbraw/zinc/19/12/33/574191233.db2.gz HTBOHMWLQSZEOS-ZJUUUORDSA-N -1 3 271.407 2.858 20 10 CFCDHM COc1cc(CN[C@@H](C)c2cc(F)cc(F)c2[O-])ccn1 ZINC000756398079 574233610 /nfs/dbraw/zinc/23/36/10/574233610.db2.gz BKNAFZPQMOISFP-VIFPVBQESA-N -1 3 294.301 2.925 20 10 CFCDHM Cc1ncc(CN[C@@H](C)c2cc([N+](=O)[O-])ccc2[O-])s1 ZINC000756533602 574244290 /nfs/dbraw/zinc/24/42/90/574244290.db2.gz JQSANWWWLJAXCH-QMMMGPOBSA-N -1 3 293.348 2.916 20 10 CFCDHM C[C@H](N[C@@H]1C[C@@H](C)c2c1c([O-])ccc2F)c1nncn1C ZINC000756534392 574244413 /nfs/dbraw/zinc/24/44/13/574244413.db2.gz KRYHJNSUNNBMJT-WCABBAIRSA-N -1 3 290.342 2.559 20 10 CFCDHM O=C([N-]Cc1ccccc1O)C(F)(F)c1ccc(F)cc1 ZINC000748345982 574247895 /nfs/dbraw/zinc/24/78/95/574247895.db2.gz IJEMSAYFUXMPAF-UHFFFAOYSA-N -1 3 295.260 2.940 20 10 CFCDHM CCc1cc(CN[C@@H](C)c2ccc(F)cc2[O-])[nH]n1 ZINC000756571523 574248689 /nfs/dbraw/zinc/24/86/89/574248689.db2.gz FVNCTRKJUMIQQZ-VIFPVBQESA-N -1 3 263.316 2.668 20 10 CFCDHM C[C@H](NCc1ccc(F)cn1)c1cc([N+](=O)[O-])ccc1[O-] ZINC000756661116 574256594 /nfs/dbraw/zinc/25/65/94/574256594.db2.gz XUXUHAQQCUAQMP-VIFPVBQESA-N -1 3 291.282 2.685 20 10 CFCDHM CCn1cc(CN[C@H](C)c2cc(F)cc(F)c2[O-])cn1 ZINC000756734097 574259950 /nfs/dbraw/zinc/25/99/50/574259950.db2.gz VHJXZXLLYKPOCI-SECBINFHSA-N -1 3 281.306 2.738 20 10 CFCDHM CCc1nnc([C@H](C)N[C@@H](C)c2cc(F)cc(F)c2[O-])[nH]1 ZINC000756780218 574262246 /nfs/dbraw/zinc/26/22/46/574262246.db2.gz XIAAHXXXGRLAGZ-YUMQZZPRSA-N -1 3 296.321 2.763 20 10 CFCDHM CCc1nc([C@H](C)N[C@@H](C)c2cc(F)cc(F)c2[O-])n[nH]1 ZINC000756780218 574262247 /nfs/dbraw/zinc/26/22/47/574262247.db2.gz XIAAHXXXGRLAGZ-YUMQZZPRSA-N -1 3 296.321 2.763 20 10 CFCDHM Cc1cc(CN[C@H](C)c2cc(F)cc(F)c2[O-])ncn1 ZINC000756777123 574262360 /nfs/dbraw/zinc/26/23/60/574262360.db2.gz VEFKZOZYULQEHV-SECBINFHSA-N -1 3 279.290 2.620 20 10 CFCDHM CC(=O)N(C)c1ccccc1NC(=O)c1cc([O-])cs1 ZINC000735703321 574333485 /nfs/dbraw/zinc/33/34/85/574333485.db2.gz IAUARHBLIIYTIK-UHFFFAOYSA-N -1 3 290.344 2.689 20 10 CFCDHM O=C(c1cc([O-])cs1)N1CCC[C@@H]2CCC[C@@H]21 ZINC000743707416 574371149 /nfs/dbraw/zinc/37/11/49/574371149.db2.gz GMBAUAFBGSJBBT-ONGXEEELSA-N -1 3 251.351 2.858 20 10 CFCDHM C[C@H](CNC(=O)c1cc([O-])cs1)Oc1ccc(F)cc1 ZINC000743720853 574371311 /nfs/dbraw/zinc/37/13/11/574371311.db2.gz CNCNAMOPFHWTDG-SECBINFHSA-N -1 3 295.335 2.790 20 10 CFCDHM O=C(c1cc([O-])cs1)N1CCC2(CCCC2)C1 ZINC000743767067 574372001 /nfs/dbraw/zinc/37/20/01/574372001.db2.gz DIFDVGRUQAKQAQ-UHFFFAOYSA-N -1 3 251.351 2.860 20 10 CFCDHM Cn1cncc1CN(Cc1ccco1)Cc1ccccc1[O-] ZINC000751480684 574377645 /nfs/dbraw/zinc/37/76/45/574377645.db2.gz YTASACJZUZKIGK-UHFFFAOYSA-N -1 3 297.358 2.921 20 10 CFCDHM COc1cccc(OCCOC(=O)c2cc([O-])cs2)c1 ZINC000751716463 574381403 /nfs/dbraw/zinc/38/14/03/574381403.db2.gz XLFPILYORYYNQO-UHFFFAOYSA-N -1 3 294.328 2.698 20 10 CFCDHM CC(C)(C)[C@H]1CCN(C(=O)c2cc([O-])cs2)C1 ZINC000753512298 574403633 /nfs/dbraw/zinc/40/36/33/574403633.db2.gz MGTNQGQEMNGATA-VIFPVBQESA-N -1 3 253.367 2.962 20 10 CFCDHM O=C(NCCCNc1ccccc1F)c1cc([O-])cs1 ZINC000753520921 574403839 /nfs/dbraw/zinc/40/38/39/574403839.db2.gz GDPBXWNDGYPSIW-UHFFFAOYSA-N -1 3 294.351 2.825 20 10 CFCDHM COc1ccc(CNCc2cccc(C(=O)[O-])c2)cc1C ZINC000820837240 598194012 /nfs/dbraw/zinc/19/40/12/598194012.db2.gz UJWABSHKDVAFRB-UHFFFAOYSA-N -1 3 285.343 2.992 20 10 CFCDHM COc1ccc(O)c([C@@H](C)NCc2ccoc2C(=O)[O-])c1 ZINC000833733886 605127731 /nfs/dbraw/zinc/12/77/31/605127731.db2.gz UWNUPXATWGASKD-SECBINFHSA-N -1 3 291.303 2.543 20 10 CFCDHM CN(Cc1ccc(NC(=O)[O-])nc1)Cc1ccccc1O ZINC000833874674 605531423 /nfs/dbraw/zinc/53/14/23/605531423.db2.gz VNOUGXVDYBHEGR-UHFFFAOYSA-N -1 3 287.319 2.509 20 10 CFCDHM C[C@@H]1C[C@@H]1[C@H]1C[C@H]1CNC(=O)NCc1c([O-])cccc1F ZINC000924044693 617918532 /nfs/dbraw/zinc/91/85/32/617918532.db2.gz XDONNLDETAKXLG-RHYQMDGZSA-N -1 3 292.354 2.623 20 10 CFCDHM [O-]c1c(Br)cccc1CNCc1nccs1 ZINC000042412611 620760366 /nfs/dbraw/zinc/76/03/66/620760366.db2.gz ICIIPOILOQZQSB-UHFFFAOYSA-N -1 3 299.193 2.901 20 10 CFCDHM Cc1ccc(NC(=O)c2ccc(C)c(O)c2[O-])cc1 ZINC000177659277 618004487 /nfs/dbraw/zinc/00/44/87/618004487.db2.gz VHEPABWMNLLVAG-UHFFFAOYSA-N -1 3 257.289 2.967 20 10 CFCDHM Cc1ccc(N(C)C(=O)c2ccc(C)c(O)c2[O-])cc1 ZINC000179469906 618276635 /nfs/dbraw/zinc/27/66/35/618276635.db2.gz BSGSWFRDMKSRRT-UHFFFAOYSA-N -1 3 271.316 2.991 20 10 CFCDHM Cc1cc(O)ccc1[N-]S(=O)(=O)c1ccc(F)c(F)c1 ZINC000078005172 618418369 /nfs/dbraw/zinc/41/83/69/618418369.db2.gz VFFSJCUBQYMEOE-UHFFFAOYSA-N -1 3 299.298 2.780 20 10 CFCDHM CCOC(=O)CN(CC)Cc1c([O-])cc(C)cc1Cl ZINC000840911698 618439736 /nfs/dbraw/zinc/43/97/36/618439736.db2.gz NDIPBMTXZWUDKF-UHFFFAOYSA-N -1 3 285.771 2.739 20 10 CFCDHM O=C(NC1(c2ccccc2)CCC1)c1cccc(O)c1[O-] ZINC000192993452 618446629 /nfs/dbraw/zinc/44/66/29/618446629.db2.gz LBDUTWHXYJAORQ-UHFFFAOYSA-N -1 3 283.327 2.907 20 10 CFCDHM Cc1ccc(C(=O)Nc2ccc(O)cc2C)c([O-])c1O ZINC000182859914 618901120 /nfs/dbraw/zinc/90/11/20/618901120.db2.gz PIMLKNMLDRONOH-UHFFFAOYSA-N -1 3 273.288 2.673 20 10 CFCDHM C[C@H](NCc1ncn(C)n1)c1ccc2ccccc2c1[O-] ZINC000186214352 619071596 /nfs/dbraw/zinc/07/15/96/619071596.db2.gz JEPBVKXNBACIDD-NSHDSACASA-N -1 3 282.347 2.525 20 10 CFCDHM COC(=O)c1cc(CNCc2c([O-])cccc2F)c(C)o1 ZINC000896637995 619780419 /nfs/dbraw/zinc/78/04/19/619780419.db2.gz MXICNVBWTNPWBV-UHFFFAOYSA-N -1 3 293.294 2.509 20 10 CFCDHM Cc1nn(C)c(Cl)c1CNCc1c([O-])cccc1F ZINC000896639276 619780918 /nfs/dbraw/zinc/78/09/18/619780918.db2.gz CFGCENXKPUFUPP-UHFFFAOYSA-N -1 3 283.734 2.516 20 10 CFCDHM CC(C)n1cc(CNCc2c([O-])cccc2F)cn1 ZINC000896639127 619780969 /nfs/dbraw/zinc/78/09/69/619780969.db2.gz AQUAUCJUEWCRSN-UHFFFAOYSA-N -1 3 263.316 2.599 20 10 CFCDHM CCOc1ccc(C[NH2+]Cc2c([O-])cccc2F)c([O-])c1 ZINC000896641112 619781418 /nfs/dbraw/zinc/78/14/18/619781418.db2.gz PQVDXEYZVHBSOG-UHFFFAOYSA-N -1 3 291.322 2.925 20 10 CFCDHM [O-]c1cccc(F)c1CNCc1ccnn1CC1CCC1 ZINC000896641959 619781970 /nfs/dbraw/zinc/78/19/70/619781970.db2.gz PACJVURHKKPVNW-UHFFFAOYSA-N -1 3 289.354 2.818 20 10 CFCDHM CC(=O)CCC(C)(C)C(=O)NCc1c([O-])cccc1F ZINC000928705879 619995460 /nfs/dbraw/zinc/99/54/60/619995460.db2.gz OQDBTINBUAMPDZ-UHFFFAOYSA-N -1 3 281.327 2.543 20 10 CFCDHM CC(C)(C)c1cc(C(=O)NCc2c([O-])cccc2F)no1 ZINC000928705352 619995485 /nfs/dbraw/zinc/99/54/85/619995485.db2.gz KACWJUMOYRFZLI-UHFFFAOYSA-N -1 3 292.310 2.747 20 10 CFCDHM O=C(CCCC1CCOCC1)NCc1c([O-])cccc1F ZINC000928708779 619996572 /nfs/dbraw/zinc/99/65/72/619996572.db2.gz UADNAKPDMOCAPW-UHFFFAOYSA-N -1 3 295.354 2.744 20 10 CFCDHM COCC1(C(=O)NCc2c([O-])cccc2F)CCCCC1 ZINC000928712828 619997140 /nfs/dbraw/zinc/99/71/40/619997140.db2.gz VQTIPQXYTVHINA-UHFFFAOYSA-N -1 3 295.354 2.744 20 10 CFCDHM C[C@@H]1CCC[C@H](NC(=O)c2cccc(O)c2[O-])CC1 ZINC000227535394 623111708 /nfs/dbraw/zinc/11/17/08/623111708.db2.gz OJJXXHIYISDEGM-MNOVXSKESA-N -1 3 263.337 2.796 20 10 CFCDHM C[C@@H](CCCC(F)(F)F)NC(=O)c1cccc(O)c1[O-] ZINC000757649454 623492566 /nfs/dbraw/zinc/49/25/66/623492566.db2.gz VXMOXDRPXNRYAH-QMMMGPOBSA-N -1 3 291.269 2.949 20 10 CFCDHM Cc1cc([O-])c(CN2CCOC(C)(C)C2)cc1Cl ZINC000824592057 623529756 /nfs/dbraw/zinc/52/97/56/623529756.db2.gz DGCQTYAFUJKOBK-UHFFFAOYSA-N -1 3 269.772 2.965 20 10 CFCDHM C[C@H](O)CN(Cc1ccc2ccccc2c1[O-])CC(F)F ZINC000825103799 623630844 /nfs/dbraw/zinc/63/08/44/623630844.db2.gz IIPZFPFTGOFQPQ-NSHDSACASA-N -1 3 295.329 2.993 20 10 CFCDHM CC(C)CCCNC(=O)NCc1c([O-])cccc1F ZINC000914065198 623685399 /nfs/dbraw/zinc/68/53/99/623685399.db2.gz NJITZIVIGWLBKW-UHFFFAOYSA-N -1 3 268.332 2.767 20 10 CFCDHM Cc1nnc(CNCc2cc(Cl)c(C)cc2[O-])s1 ZINC000825475842 623700072 /nfs/dbraw/zinc/70/00/72/623700072.db2.gz WQMSZYZHYJNEDH-UHFFFAOYSA-N -1 3 283.784 2.804 20 10 CFCDHM [O-]c1cc(Br)ccc1CN1CCOCC12CC2 ZINC000825803896 623755891 /nfs/dbraw/zinc/75/58/91/623755891.db2.gz LRXNYKMGTSHHQF-UHFFFAOYSA-N -1 3 298.180 2.520 20 10 CFCDHM COCCC1CN(Cc2cc(Cl)c(F)cc2[O-])C1 ZINC000826894207 623904338 /nfs/dbraw/zinc/90/43/38/623904338.db2.gz KRBYCAHPHSFWMH-UHFFFAOYSA-N -1 3 273.735 2.653 20 10 CFCDHM CCCC[C@@H](COC)NC(=O)NCc1c([O-])cccc1F ZINC000919456675 624574828 /nfs/dbraw/zinc/57/48/28/624574828.db2.gz YYBOROPPEWZRCZ-NSHDSACASA-N -1 3 298.358 2.536 20 10 CFCDHM O=C(NCc1c([O-])cccc1F)[C@@H]1C[C@@H]2CCCC[C@H]12 ZINC000830180966 624659745 /nfs/dbraw/zinc/65/97/45/624659745.db2.gz VGCCONFDCUHLOE-SDDRHHMPSA-N -1 3 277.339 2.974 20 10 CFCDHM CCC[C@@H]1C[C@H]1NC(=O)NCc1c([O-])cccc1F ZINC000921033616 624799239 /nfs/dbraw/zinc/79/92/39/624799239.db2.gz VFMWXHMIVRXYLZ-BXKDBHETSA-N -1 3 266.316 2.519 20 10 CFCDHM COCC1(C)CN(Cc2cccc(Cl)c2[O-])C1 ZINC000839142851 626528680 /nfs/dbraw/zinc/52/86/80/626528680.db2.gz DVHAOXIMZHUILF-UHFFFAOYSA-N -1 3 255.745 2.514 20 10 CFCDHM Cc1ccc(C(=O)Nc2ccc3nccnc3c2)c([O-])c1O ZINC000179437595 624962281 /nfs/dbraw/zinc/96/22/81/624962281.db2.gz IEIBPPQWWVJEII-UHFFFAOYSA-N -1 3 295.298 2.602 20 10 CFCDHM COc1ccc2c(c1)CCN2C(=O)c1ccc(C)c(O)c1[O-] ZINC000182253620 625275621 /nfs/dbraw/zinc/27/56/21/625275621.db2.gz DUMQWYGGDKPZTB-UHFFFAOYSA-N -1 3 299.326 2.618 20 10 CFCDHM CCc1ncc(CN[C@@H](C)c2ccc(F)cc2[O-])o1 ZINC000834899159 625914336 /nfs/dbraw/zinc/91/43/36/625914336.db2.gz IRPYEKJFJKJPAD-VIFPVBQESA-N -1 3 264.300 2.933 20 10 CFCDHM O=C(NCc1c([O-])cccc1F)N[C@H]1CCC[C@@H]2C[C@@H]21 ZINC000922858415 626382454 /nfs/dbraw/zinc/38/24/54/626382454.db2.gz WYRZJRRHCGBNOJ-NRUUGDAUSA-N -1 3 278.327 2.519 20 10 CFCDHM O=C(Nc1ccccc1N1CCCC1)c1cccc(O)c1[O-] ZINC000186856380 626400968 /nfs/dbraw/zinc/40/09/68/626400968.db2.gz NBRHVMZYKTYTNZ-UHFFFAOYSA-N -1 3 298.342 2.950 20 10 CFCDHM CN(CCc1ccc(F)cc1)C(=O)c1cccc(O)c1[O-] ZINC000187006947 626411148 /nfs/dbraw/zinc/41/11/48/626411148.db2.gz OANBHGDUXZQWMT-UHFFFAOYSA-N -1 3 289.306 2.552 20 10 CFCDHM [O-]c1c(F)cc(F)cc1CNCc1cccc2c1OCC2 ZINC000922941330 626428321 /nfs/dbraw/zinc/42/83/21/626428321.db2.gz KIJGYCLSQXJSEL-UHFFFAOYSA-N -1 3 291.297 2.895 20 10 CFCDHM O=C(NCc1c([O-])cccc1F)NC[C@@H]1CCC[C@@H]2C[C@@H]21 ZINC000923277626 626462531 /nfs/dbraw/zinc/46/25/31/626462531.db2.gz NKCSGVYKACVQSK-WOPDTQHZSA-N -1 3 292.354 2.767 20 10 CFCDHM O=C1[N-]C(=S)S/C1=C/c1cc(Cl)cc(F)c1O ZINC000768269444 627330001 /nfs/dbraw/zinc/33/00/01/627330001.db2.gz PJCRCVOWELDQNA-FARCUNLSSA-N -1 3 289.740 2.674 20 10 CFCDHM C[C@@]1(O)CCCN(Cc2cc(Cl)cc(F)c2[O-])C1 ZINC000775712372 628058046 /nfs/dbraw/zinc/05/80/46/628058046.db2.gz GRMDYHPNOGEKLH-CYBMUJFWSA-N -1 3 273.735 2.532 20 10 CFCDHM CSc1ccncc1NC(=O)c1ccc(C)c(O)c1[O-] ZINC000780961341 628508261 /nfs/dbraw/zinc/50/82/61/628508261.db2.gz QYZLBFDJEDTTLV-UHFFFAOYSA-N -1 3 290.344 2.775 20 10 CFCDHM CC[C@@H](N[C@H](C)c1ncn(C)n1)c1cc(Cl)ccc1[O-] ZINC000783296636 628698428 /nfs/dbraw/zinc/69/84/28/628698428.db2.gz GCDXENDRXLLPIV-BXKDBHETSA-N -1 3 294.786 2.976 20 10 CFCDHM COc1cc(C)cc(NC(=O)c2cccc(O)c2[O-])c1C ZINC000787662728 629024644 /nfs/dbraw/zinc/02/46/44/629024644.db2.gz WBABCVGDJJJCRW-UHFFFAOYSA-N -1 3 287.315 2.976 20 10 CFCDHM Cc1cc(Br)c([O-])c(CNc2cccnn2)c1 ZINC000788448739 629068286 /nfs/dbraw/zinc/06/82/86/629068286.db2.gz NPQXFTBEXMQDBK-UHFFFAOYSA-N -1 3 294.152 2.865 20 10 CFCDHM Cc1ccc(NC(=O)c2cccc(O)c2[O-])c2n[nH]cc21 ZINC000790597731 629251275 /nfs/dbraw/zinc/25/12/75/629251275.db2.gz GLWYTQGRVGFBID-UHFFFAOYSA-N -1 3 283.287 2.535 20 10 CFCDHM C[C@H](CN(C)C(=O)c1cccc(O)c1[O-])c1ccccc1 ZINC000790629365 629253646 /nfs/dbraw/zinc/25/36/46/629253646.db2.gz HXMSWMPONACXKJ-GFCCVEGCSA-N -1 3 285.343 2.974 20 10 CFCDHM Cc1cc(C)cc(CCNC(=O)c2cccc(O)c2[O-])c1 ZINC000790774461 629261505 /nfs/dbraw/zinc/26/15/05/629261505.db2.gz WQPJTJQCKYQQKS-UHFFFAOYSA-N -1 3 285.343 2.687 20 10 CFCDHM O=C(Nc1cccc2cc[nH]c21)c1cccc(O)c1[O-] ZINC000790940410 629273089 /nfs/dbraw/zinc/27/30/89/629273089.db2.gz JUEXZPCFMUEZGU-UHFFFAOYSA-N -1 3 268.272 2.831 20 10 CFCDHM C[C@@H](NCc1c([O-])ccc(Cl)c1F)c1cn[nH]c1 ZINC000790980232 629276809 /nfs/dbraw/zinc/27/68/09/629276809.db2.gz LMITWLGYHDPPCO-SSDOTTSWSA-N -1 3 269.707 2.759 20 10 CFCDHM CCc1nnc([C@H](C)NCc2c([O-])ccc(Cl)c2F)[nH]1 ZINC000790981757 629277023 /nfs/dbraw/zinc/27/70/23/629277023.db2.gz WKEQUCPMGIELSF-ZETCQYMHSA-N -1 3 298.749 2.716 20 10 CFCDHM CCc1nc([C@H](C)NCc2c([O-])ccc(Cl)c2F)n[nH]1 ZINC000790981757 629277025 /nfs/dbraw/zinc/27/70/25/629277025.db2.gz WKEQUCPMGIELSF-ZETCQYMHSA-N -1 3 298.749 2.716 20 10 CFCDHM [O-]c1ccc(Cl)c(F)c1CN1CCOCC2(CC2)C1 ZINC000792174391 629405694 /nfs/dbraw/zinc/40/56/94/629405694.db2.gz UVAYLHKHIRLIPT-UHFFFAOYSA-N -1 3 285.746 2.797 20 10 CFCDHM C[C@@]1(CO)CCCN1Cc1c([O-])ccc(Cl)c1F ZINC000792180798 629406851 /nfs/dbraw/zinc/40/68/51/629406851.db2.gz URSISZYXCUSZJC-ZDUSSCGKSA-N -1 3 273.735 2.532 20 10 CFCDHM CC[C@H](NCc1cocn1)c1ccc(F)cc1[O-] ZINC000796880621 629984442 /nfs/dbraw/zinc/98/44/42/629984442.db2.gz RCVMXMAXWOHJOM-LBPRGKRZSA-N -1 3 250.273 2.760 20 10 CFCDHM CC[C@@H]1CN(Cc2c([O-])cc(C)cc2Cl)CCO1 ZINC000840910961 631256702 /nfs/dbraw/zinc/25/67/02/631256702.db2.gz YNPXAFGFIRPYEE-LLVKDONJSA-N -1 3 269.772 2.965 20 10 CFCDHM Cc1noc([C@H](C)NCc2c([O-])cc(C)cc2Cl)n1 ZINC000840941761 631273753 /nfs/dbraw/zinc/27/37/53/631273753.db2.gz KQILAXJRMZEVBL-QMMMGPOBSA-N -1 3 281.743 2.896 20 10 CFCDHM Cc1nnsc1CNCc1cc(Cl)cc(F)c1[O-] ZINC000814175350 632023832 /nfs/dbraw/zinc/02/38/32/632023832.db2.gz SNISKBARWDWMKW-UHFFFAOYSA-N -1 3 287.747 2.634 20 10 CFCDHM CCCN1CCN(Cc2cc(Cl)c(F)cc2[O-])CC1 ZINC000816480084 632467193 /nfs/dbraw/zinc/46/71/93/632467193.db2.gz CKTUBIJASJFPIQ-UHFFFAOYSA-N -1 3 286.778 2.712 20 10 CFCDHM COC(=O)[C@H](C)N(C)Cc1ccc2ccccc2c1[O-] ZINC000816597640 632491862 /nfs/dbraw/zinc/49/18/62/632491862.db2.gz AATGPBGLBBJEOU-NSHDSACASA-N -1 3 273.332 2.539 20 10 CFCDHM Cc1cc(Br)c([O-])c(CN(C)CCF)c1 ZINC000816640413 632500169 /nfs/dbraw/zinc/50/01/69/632500169.db2.gz HRPLBCWVNLFHRO-UHFFFAOYSA-N -1 3 276.149 2.864 20 10 CFCDHM Cc1cc(Cl)cc(C[N@@H+]2C[C@H](C)C[C@H](C(=O)[O-])C2)c1[O-] ZINC000817881162 632716927 /nfs/dbraw/zinc/71/69/27/632716927.db2.gz GSWBCWHDKDOHHR-SKDRFNHKSA-N -1 3 297.782 2.897 20 10 CFCDHM Cc1cc(Cl)cc(C[N@H+]2C[C@H](C)C[C@H](C(=O)[O-])C2)c1[O-] ZINC000817881162 632716930 /nfs/dbraw/zinc/71/69/30/632716930.db2.gz GSWBCWHDKDOHHR-SKDRFNHKSA-N -1 3 297.782 2.897 20 10 CFCDHM C[C@@H](NCC(F)(F)CN)c1cccc(C(F)(F)F)c1[O-] ZINC000817967544 632766878 /nfs/dbraw/zinc/76/68/78/632766878.db2.gz KDJKIAUQRKQQGA-SSDOTTSWSA-N -1 3 298.255 2.656 20 10 CFCDHM CC(C)(C)C1CC(NC(=O)c2cccc(O)c2[O-])C1 ZINC000818137459 632804220 /nfs/dbraw/zinc/80/42/20/632804220.db2.gz UGRHGGAVEFZJPS-UHFFFAOYSA-N -1 3 263.337 2.652 20 10 CFCDHM C[C@H](N[C@H]1C[C@H](C)n2ncnc21)c1ccc(Cl)cc1[O-] ZINC000850499076 634018796 /nfs/dbraw/zinc/01/87/96/634018796.db2.gz JEUMNFSVCHGFTF-AUTRQRHGSA-N -1 3 292.770 2.994 20 10 CFCDHM CCn1cc(CN[C@H](C)c2ccc(Cl)cc2[O-])nn1 ZINC000850522689 634030025 /nfs/dbraw/zinc/03/00/25/634030025.db2.gz WQUFEGBLUCQABD-SECBINFHSA-N -1 3 280.759 2.508 20 10 CFCDHM Cc1cc(Cl)cc(C[NH2+]CC2(C(=O)[O-])CCC2)c1[O-] ZINC000854244660 635270129 /nfs/dbraw/zinc/27/01/29/635270129.db2.gz NXOJXVBLMFTNIH-UHFFFAOYSA-N -1 3 283.755 2.699 20 10 CFCDHM C[C@H](NCc1cc([N+](=O)[O-])ccc1[O-])c1ccns1 ZINC000858317614 636188608 /nfs/dbraw/zinc/18/86/08/636188608.db2.gz WGAQCOGSNAVVSE-QMMMGPOBSA-N -1 3 279.321 2.608 20 10 CFCDHM CCN(CCc1ccccc1)C(=O)c1cccc(O)c1[O-] ZINC000188209534 650319342 /nfs/dbraw/zinc/31/93/42/650319342.db2.gz NUSFCSTXWIILBD-UHFFFAOYSA-N -1 3 285.343 2.803 20 10 CFCDHM Cc1cc([O-])c(CN2CCO[C@H](CCF)C2)cc1Cl ZINC000862530154 637409360 /nfs/dbraw/zinc/40/93/60/637409360.db2.gz JOGHXKBXSREAHS-GFCCVEGCSA-N -1 3 287.762 2.914 20 10 CFCDHM Cc1cc(Cl)cc(C[N@@H+]2CC[C@H](C(=O)[O-])[C@H](C)C2)c1[O-] ZINC000863739010 637765894 /nfs/dbraw/zinc/76/58/94/637765894.db2.gz GSMUEMFZXFSKQA-MFKMUULPSA-N -1 3 297.782 2.897 20 10 CFCDHM Cc1cc(Cl)cc(C[N@H+]2CC[C@H](C(=O)[O-])[C@H](C)C2)c1[O-] ZINC000863739010 637765901 /nfs/dbraw/zinc/76/59/01/637765901.db2.gz GSMUEMFZXFSKQA-MFKMUULPSA-N -1 3 297.782 2.897 20 10 CFCDHM C[C@@H]1CN(Cc2ccc(F)c(F)c2[O-])C[C@H](C)S1 ZINC000876642939 642955141 /nfs/dbraw/zinc/95/51/41/642955141.db2.gz PPTOXYRKJYEDSG-DTORHVGOSA-N -1 3 273.348 2.996 20 10 CFCDHM C[C@@H](NC(=O)c1cccc(O)c1[O-])c1ccccc1 ZINC000126188816 643028438 /nfs/dbraw/zinc/02/84/38/643028438.db2.gz TYICXSSFGYDASF-SNVBAGLBSA-N -1 3 257.289 2.589 20 10 CFCDHM O=C(Nc1ccc2ncccc2c1)c1cccc(O)c1[O-] ZINC000126386129 643189692 /nfs/dbraw/zinc/18/96/92/643189692.db2.gz CJCSWBHVMXFSQV-UHFFFAOYSA-N -1 3 280.283 2.898 20 10 CFCDHM CC1(C)C(CNC(=O)c2cccc(O)c2[O-])C1(C)C ZINC000126474757 643239375 /nfs/dbraw/zinc/23/93/75/643239375.db2.gz NBPPMIRTACNBAJ-UHFFFAOYSA-N -1 3 263.337 2.510 20 10 CFCDHM CC1(C)CCC[C@@H](NC(=O)c2cccc(O)c2[O-])C1 ZINC000126498434 643255423 /nfs/dbraw/zinc/25/54/23/643255423.db2.gz RYMQCKVDRLPDKJ-SNVBAGLBSA-N -1 3 263.337 2.796 20 10 CFCDHM [O-]c1c(CN2CCSC[C@@H]2C2CC2)ccc(F)c1F ZINC000877568400 643367968 /nfs/dbraw/zinc/36/79/68/643367968.db2.gz NCFWTCUTGCJGBG-GFCCVEGCSA-N -1 3 285.359 2.998 20 10 CFCDHM Cc1nccnc1[C@H](C)NCc1cccc(Cl)c1[O-] ZINC000877828913 643594771 /nfs/dbraw/zinc/59/47/71/643594771.db2.gz SWFOZWZTXKTBJT-JTQLQIEISA-N -1 3 277.755 2.995 20 10 CFCDHM CC(C)OC(=O)[C@@H]1CCCN1Cc1cc(Cl)ccc1[O-] ZINC000093535973 650942494 /nfs/dbraw/zinc/94/24/94/650942494.db2.gz KEZNQASJFMYDTF-ZDUSSCGKSA-N -1 3 297.782 2.962 20 10 CFCDHM [O-]c1c(F)cc(F)cc1CN[C@H]1CCCc2c[nH]nc21 ZINC000883048570 645582466 /nfs/dbraw/zinc/58/24/66/645582466.db2.gz RCNHERCBRXAEHP-LBPRGKRZSA-N -1 3 279.290 2.561 20 10 CFCDHM COc1ncccc1CN[C@@H](C)c1c([O-])cccc1F ZINC000886501424 647021058 /nfs/dbraw/zinc/02/10/58/647021058.db2.gz KATWWCHFNLZZGJ-JTQLQIEISA-N -1 3 276.311 2.786 20 10 CFCDHM C[C@@H](NCc1cccnc1N(C)C)c1c([O-])cccc1F ZINC000886502951 647022321 /nfs/dbraw/zinc/02/23/21/647022321.db2.gz VPFQISONLSOOFO-LLVKDONJSA-N -1 3 289.354 2.843 20 10 CFCDHM CCc1nnc([C@H](C)N[C@@H](C)c2c([O-])cccc2F)[nH]1 ZINC000886558673 647046266 /nfs/dbraw/zinc/04/62/66/647046266.db2.gz PIIQBCAHVDRQNB-IUCAKERBSA-N -1 3 278.331 2.624 20 10 CFCDHM C[C@@H](N[C@@H](CCO)c1ccco1)c1c([O-])cccc1F ZINC000886592333 647058334 /nfs/dbraw/zinc/05/83/34/647058334.db2.gz QMARKZROAFPOAB-PWSUYJOCSA-N -1 3 279.311 2.899 20 10 CFCDHM C[C@H](NCc1cc(C2CC2)n(C)n1)c1ccc(F)cc1[O-] ZINC000927107446 648714214 /nfs/dbraw/zinc/71/42/14/648714214.db2.gz FLCUOYKNGQWYDA-JTQLQIEISA-N -1 3 289.354 2.993 20 10 CFCDHM C[C@@H]1CC=C(C(=O)NCc2c([O-])cccc2F)CC1 ZINC000928704982 648944004 /nfs/dbraw/zinc/94/40/04/648944004.db2.gz BSMDJWYFWZLPGM-SNVBAGLBSA-N -1 3 263.312 2.894 20 10 CFCDHM O=C(NCc1c([O-])cccc1F)c1cc2c([nH]1)CCCC2 ZINC000928706621 648945262 /nfs/dbraw/zinc/94/52/62/648945262.db2.gz SMTUCTVFHWPOPG-UHFFFAOYSA-N -1 3 288.322 2.668 20 10 CFCDHM CC[C@H](C)CCC(=O)NCc1c([O-])cccc1F ZINC000928707030 648945361 /nfs/dbraw/zinc/94/53/61/648945361.db2.gz ZXCHWHRVBWTFHY-JTQLQIEISA-N -1 3 253.317 2.974 20 10 CFCDHM CCCC[C@@H](C)C(=O)NCc1c([O-])cccc1F ZINC000928707156 648945430 /nfs/dbraw/zinc/94/54/30/648945430.db2.gz BHRVDKPAMAZAPQ-SNVBAGLBSA-N -1 3 253.317 2.974 20 10 CFCDHM O=C(NCc1c([O-])cccc1F)C1CCC=CCC1 ZINC000928708333 648945619 /nfs/dbraw/zinc/94/56/19/648945619.db2.gz FXIJWVWXNCUSIC-UHFFFAOYSA-N -1 3 263.312 2.894 20 10 CFCDHM C/C(=C(/F)C(=O)NCc1c([O-])cccc1F)C1CC1 ZINC000928710194 648946160 /nfs/dbraw/zinc/94/61/60/648946160.db2.gz PQFQFXDYSSSNPV-JYRVWZFOSA-N -1 3 267.275 2.801 20 10 CFCDHM Cc1oc(C)c(C(=O)NCc2c([O-])cccc2F)c1C ZINC000928710914 648946514 /nfs/dbraw/zinc/94/65/14/648946514.db2.gz XQGBJVURTDTPME-UHFFFAOYSA-N -1 3 277.295 2.980 20 10 CFCDHM CC1(C)CC[C@@H]1C(=O)NCc1c([O-])cccc1F ZINC000928712827 648946637 /nfs/dbraw/zinc/94/66/37/648946637.db2.gz VPMVEXMOOZLFFL-SNVBAGLBSA-N -1 3 251.301 2.584 20 10 CFCDHM Cc1nnc(NCc2c([O-])cccc2Cl)n1C1CC1 ZINC000284306538 651298916 /nfs/dbraw/zinc/29/89/16/651298916.db2.gz SCPXKAHLLTUJHU-UHFFFAOYSA-N -1 3 278.743 2.893 20 10 CFCDHM Cc1ccoc1CNCc1cc(F)cc(F)c1[O-] ZINC000708535562 775258382 /nfs/dbraw/zinc/25/83/82/775258382.db2.gz MQYDBERQYCODHT-UHFFFAOYSA-N -1 3 253.248 2.862 20 10 CFCDHM O=C([O-])c1ccc([O-])c(C[N@@H+]2CC[C@@H]3CCC[C@H]3C2)c1 ZINC001231561677 777259225 /nfs/dbraw/zinc/25/92/25/777259225.db2.gz YHIOKRPVXDRWIN-AAEUAGOBSA-N -1 3 275.348 2.712 20 10 CFCDHM O=C([O-])c1ccc([O-])c(C[N@H+]2CC[C@@H]3CCC[C@H]3C2)c1 ZINC001231561677 777259231 /nfs/dbraw/zinc/25/92/31/777259231.db2.gz YHIOKRPVXDRWIN-AAEUAGOBSA-N -1 3 275.348 2.712 20 10 CFCDHM O=C([O-])c1ccc(O)c(CN2CCc3ccsc3C2)c1 ZINC001231563448 777261181 /nfs/dbraw/zinc/26/11/81/777261181.db2.gz ACSHPNYGLXOYFG-UHFFFAOYSA-N -1 3 289.356 2.710 20 10 CFCDHM Cc1cc([O-])c(CN2C[C@H](F)C[C@H](CO)C2)cc1Cl ZINC001231869432 777358793 /nfs/dbraw/zinc/35/87/93/777358793.db2.gz QOIXJGPBTPJYGW-CMPLNLGQSA-N -1 3 287.762 2.506 20 10 CFCDHM CCN(Cc1ccc2ccccc2c1[O-])[C@@H](C)C(=O)OC ZINC001231883472 777365558 /nfs/dbraw/zinc/36/55/58/777365558.db2.gz LLNYOLABRDOPKF-LBPRGKRZSA-N -1 3 287.359 2.929 20 10 CFCDHM COc1cc([O-])c(CN2CCOC[C@@H]2C(C)C)cc1Cl ZINC001232270239 777501147 /nfs/dbraw/zinc/50/11/47/777501147.db2.gz YZZDXMMEDFXRDK-CYBMUJFWSA-N -1 3 299.798 2.911 20 10 CFCDHM CC[C@H]1COCCN1Cc1cc(Cl)c(OC)cc1[O-] ZINC001232269100 777501606 /nfs/dbraw/zinc/50/16/06/777501606.db2.gz AGQHLZYBBJIMSM-NSHDSACASA-N -1 3 285.771 2.665 20 10 CFCDHM [O-]c1ccc(F)c(F)c1CN1CCC(CF)CC1 ZINC001233334548 777893047 /nfs/dbraw/zinc/89/30/47/777893047.db2.gz LJJJEKKZJQFYRD-UHFFFAOYSA-N -1 3 259.271 2.852 20 10 CFCDHM CO[C@@H]1CN(Cc2ccc(C(F)(F)F)cc2[O-])C[C@@H]1F ZINC001233452298 777960622 /nfs/dbraw/zinc/96/06/22/777960622.db2.gz QVOVYBUPXHHMBV-CMPLNLGQSA-N -1 3 293.260 2.580 20 10 CFCDHM O=C(C=C(C1CC1)C1CC1)NCc1c([O-])cccc1F ZINC000928710322 777964624 /nfs/dbraw/zinc/96/46/24/777964624.db2.gz BFTAZSBMCDTVGW-UHFFFAOYSA-N -1 3 275.323 2.894 20 10 CFCDHM COC(=O)[C@@H]1CCN1Cc1cccc(-c2ccccc2)c1[O-] ZINC001234997724 778349440 /nfs/dbraw/zinc/34/94/40/778349440.db2.gz DRONRWMWMPEZTH-INIZCTEOSA-N -1 3 297.354 2.807 20 10 CFCDHM CC(F)(F)CNCc1cc(Br)ccc1[O-] ZINC000378749697 778408410 /nfs/dbraw/zinc/40/84/10/778408410.db2.gz NUOFHKCSKUNHIJ-UHFFFAOYSA-N -1 3 280.112 2.900 20 10 CFCDHM [O-]c1cc(Cl)c(Cl)cc1CN1CCCOCC1 ZINC001236793658 778939233 /nfs/dbraw/zinc/93/92/33/778939233.db2.gz NBUFDUMOEPIAEB-UHFFFAOYSA-N -1 3 276.163 2.921 20 10 CFCDHM C[C@H]1CN(Cc2cc(Cl)c(Cl)cc2[O-])CC[C@H]1O ZINC001236794054 778939289 /nfs/dbraw/zinc/93/92/89/778939289.db2.gz ORBCUIZVDVBHNZ-QPUJVOFHSA-N -1 3 290.190 2.902 20 10 CFCDHM [O-]c1cc(Cl)c(Cl)cc1CN1CCC[C@@H]1CO ZINC001236792160 778939435 /nfs/dbraw/zinc/93/94/35/778939435.db2.gz CNUDJSACDDZCJC-SECBINFHSA-N -1 3 276.163 2.656 20 10 CFCDHM COCC1CN(Cc2cc(Cl)c(Cl)cc2[O-])C1 ZINC001236793688 778939735 /nfs/dbraw/zinc/93/97/35/778939735.db2.gz NSXRYGFYDFYCST-UHFFFAOYSA-N -1 3 276.163 2.777 20 10 CFCDHM [O-]c1cc(Cl)c(Cl)cc1CN1C[C@@H]2CCO[C@@H]2C1 ZINC001236795253 778940682 /nfs/dbraw/zinc/94/06/82/778940682.db2.gz BEBGVJZRTYKCAI-ISVAXAHUSA-N -1 3 288.174 2.920 20 10 CFCDHM COc1cc([O-])c(CN2CC3(C2)CCCCO3)c(Cl)c1 ZINC001236799647 778942860 /nfs/dbraw/zinc/94/28/60/778942860.db2.gz UMFONTHYHIGZQM-UHFFFAOYSA-N -1 3 297.782 2.809 20 10 CFCDHM COc1cc([O-])c(CN2CCC[C@H]2C(C)=O)c(Cl)c1 ZINC001236806166 778945999 /nfs/dbraw/zinc/94/59/99/778945999.db2.gz OVTJIJGMLPBCBM-ZDUSSCGKSA-N -1 3 283.755 2.608 20 10 CFCDHM COc1cc([O-])c(CN2CCOC[C@H]2C2CC2)c(Cl)c1 ZINC001236808311 778949438 /nfs/dbraw/zinc/94/94/38/778949438.db2.gz NFZFSMJAIIEMHA-AWEZNQCLSA-N -1 3 297.782 2.665 20 10 CFCDHM C[C@H]1C[C@H](O)CCN1Cc1c([O-])ccc(F)c1Cl ZINC001237125589 779019999 /nfs/dbraw/zinc/01/99/99/779019999.db2.gz DXJUDROHYOLZRP-DTWKUNHWSA-N -1 3 273.735 2.530 20 10 CFCDHM [O-]c1ccc(F)c(Cl)c1CN1CC[C@@]2(CCCO2)C1 ZINC001237125068 779020064 /nfs/dbraw/zinc/02/00/64/779020064.db2.gz WPTZOCVKAMPCNJ-AWEZNQCLSA-N -1 3 285.746 2.940 20 10 CFCDHM CC(=O)[C@H]1CCCN(Cc2c([O-])ccc(F)c2Cl)C1 ZINC001237127237 779020828 /nfs/dbraw/zinc/02/08/28/779020828.db2.gz XLJAOYLQDJWXOE-JTQLQIEISA-N -1 3 285.746 2.986 20 10 CFCDHM [O-]c1c(F)cc(Cl)cc1CN1CCC[C@@]2(CCO2)C1 ZINC001237622313 779145966 /nfs/dbraw/zinc/14/59/66/779145966.db2.gz QAUAEBRBJJECTB-CQSZACIVSA-N -1 3 285.746 2.940 20 10 CFCDHM [O-]c1c(Cl)cc(F)cc1CN1CCN2CCCC[C@@H]2C1 ZINC001237812947 779185552 /nfs/dbraw/zinc/18/55/52/779185552.db2.gz JCPDWXFVQONIGJ-CYBMUJFWSA-N -1 3 298.789 2.855 20 10 CFCDHM CN(Cc1cnccn1)Cc1cc(F)c(Cl)cc1[O-] ZINC001237935572 779210968 /nfs/dbraw/zinc/21/09/68/779210968.db2.gz FDEYJEOFVWSIPW-UHFFFAOYSA-N -1 3 281.718 2.607 20 10 CFCDHM C[C@@H]1C[C@@H](O)CCN1Cc1cc(F)c(Cl)cc1[O-] ZINC001237950714 779216185 /nfs/dbraw/zinc/21/61/85/779216185.db2.gz ZKRAJXFHPOODTK-SCZZXKLOSA-N -1 3 273.735 2.530 20 10 CFCDHM C[C@@H]1CCN(Cc2ccc(F)c(F)c2[O-])C[C@H](C)O1 ZINC000703566046 781037634 /nfs/dbraw/zinc/03/76/34/781037634.db2.gz USYQTOCCQQCEMV-ZJUUUORDSA-N -1 3 271.307 2.670 20 10 CFCDHM CCOC1CCN(Cc2cc(F)cc(F)c2[O-])CC1 ZINC000708414306 781273902 /nfs/dbraw/zinc/27/39/02/781273902.db2.gz QENIORNDHVLMOF-UHFFFAOYSA-N -1 3 271.307 2.671 20 10 CFCDHM CC[C@@H](NC(=O)c1cccc(O)c1[O-])C1CCCC1 ZINC000382870407 781364495 /nfs/dbraw/zinc/36/44/95/781364495.db2.gz QJNOHCRGIOUPSW-GFCCVEGCSA-N -1 3 263.337 2.796 20 10 CFCDHM CC[C@H](NC(=O)c1cccc(O)c1[O-])C1CCCC1 ZINC000382870408 781364573 /nfs/dbraw/zinc/36/45/73/781364573.db2.gz QJNOHCRGIOUPSW-LBPRGKRZSA-N -1 3 263.337 2.796 20 10 CFCDHM [O-]c1ccccc1CN(Cc1ccno1)C[C@@H]1CCCO1 ZINC000070976514 346918877 /nfs/dbraw/zinc/91/88/77/346918877.db2.gz IWKDNMQRULOGIS-AWEZNQCLSA-N -1 3 288.347 2.561 20 10 CFCDHM CN(Cc1cccc(F)c1[O-])[C@H](CO)c1ccccc1 ZINC000295102618 199346031 /nfs/dbraw/zinc/34/60/31/199346031.db2.gz SZSXUHVVHDJFKQ-OAHLLOKOSA-N -1 3 275.323 2.697 20 10 CFCDHM C[C@]1(O)CCCN(Cc2cc(Cl)c(F)cc2[O-])CC1 ZINC000294792455 199184384 /nfs/dbraw/zinc/18/43/84/199184384.db2.gz VIIBSPABRIELNE-AWEZNQCLSA-N -1 3 287.762 2.922 20 10 CFCDHM C[C@H](NCC(F)(F)CO)c1ccc2ccccc2c1[O-] ZINC000184703839 299278615 /nfs/dbraw/zinc/27/86/15/299278615.db2.gz YQIALYKBQMTLBX-JTQLQIEISA-N -1 3 281.302 2.824 20 10 CFCDHM CCC1(C)CN(Cc2ccc([N+](=O)[O-])c(OC)c2[O-])C1 ZINC000297472152 200202954 /nfs/dbraw/zinc/20/29/54/200202954.db2.gz SNUYSWHFZXRCRQ-UHFFFAOYSA-N -1 3 280.324 2.541 20 10 CFCDHM Cc1c([C@@H](C)NCc2cccc(Cl)c2[O-])cnn1C ZINC000124705774 377079542 /nfs/dbraw/zinc/07/95/42/377079542.db2.gz IJGWKRHKPRVFME-SECBINFHSA-N -1 3 279.771 2.938 20 10 CFCDHM O=C(c1cccc(O)c1[O-])N1CCCC2(CCC2)C1 ZINC000366243835 296253973 /nfs/dbraw/zinc/25/39/73/296253973.db2.gz COKPIEPJGLQPJY-UHFFFAOYSA-N -1 3 261.321 2.504 20 10 CFCDHM O=C(c1cccc(O)c1[O-])N1CCC(C(F)(F)F)CC1 ZINC000126458819 377227875 /nfs/dbraw/zinc/22/78/75/377227875.db2.gz SCOYYYPLOXUHNB-UHFFFAOYSA-N -1 3 289.253 2.512 20 10 CFCDHM CCn1cc(NCc2c([O-])cccc2Cl)cn1 ZINC000127252884 377271384 /nfs/dbraw/zinc/27/13/84/377271384.db2.gz KCKAYJYKPXVRHA-UHFFFAOYSA-N -1 3 251.717 2.874 20 10 CFCDHM [O-]c1ccc(Cl)cc1CN1CCO[C@@H]2CCC[C@@H]21 ZINC000132758947 377873922 /nfs/dbraw/zinc/87/39/22/377873922.db2.gz YJXFTVWUIBVSTP-GXTWGEPZSA-N -1 3 267.756 2.799 20 10 CFCDHM COCCCN(CCOC)Cc1c([O-])cccc1Cl ZINC000133095128 377903774 /nfs/dbraw/zinc/90/37/74/377903774.db2.gz PEPLJYVTAQHERU-UHFFFAOYSA-N -1 3 287.787 2.531 20 10 CFCDHM C[C@H](C(=O)OC(C)(C)C)N(C)Cc1ccccc1[O-] ZINC000154987681 378606585 /nfs/dbraw/zinc/60/65/85/378606585.db2.gz CRIKOTDLDAOJAY-LLVKDONJSA-N -1 3 265.353 2.554 20 10 CFCDHM COC[C@H](NCc1ccccc1[O-])c1ccc(C)o1 ZINC000177566173 380354883 /nfs/dbraw/zinc/35/48/83/380354883.db2.gz BTRMCBCAKWYVKX-ZDUSSCGKSA-N -1 3 261.321 2.771 20 10 CFCDHM Cc1ccc(C(=O)N(C)[C@@H](C)c2ccco2)c([O-])c1O ZINC000179419699 380541527 /nfs/dbraw/zinc/54/15/27/380541527.db2.gz VZMHXCMACVBBNM-JTQLQIEISA-N -1 3 275.304 2.832 20 10 CFCDHM [O-]c1ccccc1CN1CCO[C@H](c2cccc(O)c2)C1 ZINC000179576241 380560481 /nfs/dbraw/zinc/56/04/81/380560481.db2.gz FNRZSAZUWFUTQB-KRWDZBQOSA-N -1 3 285.343 2.671 20 10 CFCDHM COC[C@H](NCc1cc(F)ccc1[O-])c1ccco1 ZINC000180826421 380703094 /nfs/dbraw/zinc/70/30/94/380703094.db2.gz CDNCQQGHYOFNPZ-LBPRGKRZSA-N -1 3 265.284 2.602 20 10 CFCDHM C[C@@H](CF)NCc1cc(Br)ccc1[O-] ZINC000288465066 381013281 /nfs/dbraw/zinc/01/32/81/381013281.db2.gz OJYKWZQNMZGYPJ-ZETCQYMHSA-N -1 3 262.122 2.602 20 10 CFCDHM CCCCn1nccc1NC(=O)c1ccc(C)c(O)c1[O-] ZINC000182275466 381045787 /nfs/dbraw/zinc/04/57/87/381045787.db2.gz NTAPTVUOLHRMBT-UHFFFAOYSA-N -1 3 289.335 2.655 20 10 CFCDHM Cc1ccc(C(=O)N2CC[C@@H](C)C[C@@H](C)C2)c([O-])c1O ZINC000182891204 381179821 /nfs/dbraw/zinc/17/98/21/381179821.db2.gz SFZWAKBQTYJGRE-GHMZBOCLSA-N -1 3 277.364 2.914 20 10 CFCDHM [O-]c1cc(OCc2ccccc2)ccc1CN1CCOCC1 ZINC000182928849 381182970 /nfs/dbraw/zinc/18/29/70/381182970.db2.gz UMCDOVDSOMCDNL-UHFFFAOYSA-N -1 3 299.370 2.803 20 10 CFCDHM O=C(Nc1ccc(-c2cc[nH]n2)cc1)c1cccc(O)c1[O-] ZINC000184774571 381475820 /nfs/dbraw/zinc/47/58/20/381475820.db2.gz GKUQLOSEUUJBNU-UHFFFAOYSA-N -1 3 295.298 2.740 20 10 CFCDHM COc1cc(Cl)cc(CN2CCCO[C@H](C)C2)c1[O-] ZINC000184687875 381460401 /nfs/dbraw/zinc/46/04/01/381460401.db2.gz AHHHNTUTVWWWMQ-SNVBAGLBSA-N -1 3 285.771 2.665 20 10 CFCDHM CC(C)c1nnc(CN[C@H](C)c2ccc(F)cc2[O-])[nH]1 ZINC000296603912 381469304 /nfs/dbraw/zinc/46/93/04/381469304.db2.gz VUMPRNOYHJYPSD-SECBINFHSA-N -1 3 278.331 2.624 20 10 CFCDHM COCc1nc(CN[C@H]2CCc3cccc([O-])c32)cs1 ZINC000297217584 381553912 /nfs/dbraw/zinc/55/39/12/381553912.db2.gz HBHXNFQZSZOFHH-LBPRGKRZSA-N -1 3 290.388 2.772 20 10 CFCDHM Cc1cn2c(n1)CN(Cc1cc(Cl)ccc1[O-])CC2 ZINC000371675323 381674669 /nfs/dbraw/zinc/67/46/69/381674669.db2.gz KMSFZMUGWBKDGB-UHFFFAOYSA-N -1 3 277.755 2.566 20 10 CFCDHM Cc1ccc(C(=O)N2CCCC[C@H](C)C2)c([O-])c1O ZINC000186441360 381910835 /nfs/dbraw/zinc/91/08/35/381910835.db2.gz NDXXLELGBAJZJI-JTQLQIEISA-N -1 3 263.337 2.668 20 10 CFCDHM [O-]c1ccc(Cl)c(F)c1CN1CCC[C@H]2OCC[C@H]21 ZINC000373491821 382017164 /nfs/dbraw/zinc/01/71/64/382017164.db2.gz YSFYZIDFVNEUQM-DGCLKSJQSA-N -1 3 285.746 2.938 20 10 CFCDHM O=C(N[C@H]1CCCOc2ccccc21)c1cccc(O)c1[O-] ZINC000187056982 382087613 /nfs/dbraw/zinc/08/76/13/382087613.db2.gz HRBPGJBWLCWRJF-ZDUSSCGKSA-N -1 3 299.326 2.742 20 10 CFCDHM Cc1nn(C)c(C)c1CN[C@H](C)c1ccc(F)c(F)c1[O-] ZINC000187685708 382246116 /nfs/dbraw/zinc/24/61/16/382246116.db2.gz BXAKBHQOVXRLAA-MRVPVSSYSA-N -1 3 295.333 2.872 20 10 CFCDHM O=C(c1cccc(O)c1[O-])N1CC[C@H]1c1ccccc1F ZINC000365753767 382436717 /nfs/dbraw/zinc/43/67/17/382436717.db2.gz OCUHRASSTVEJLD-ZDUSSCGKSA-N -1 3 287.290 2.824 20 10 CFCDHM CC(C)c1nnc(CN(C)Cc2ccccc2[O-])s1 ZINC000294862135 382533877 /nfs/dbraw/zinc/53/38/77/382533877.db2.gz DGOGDVLISPMMFN-UHFFFAOYSA-N -1 3 277.393 2.999 20 10 CFCDHM CC(=O)c1cc(F)cc(CN2CC=C(C)CC2)c1[O-] ZINC000270376604 385077846 /nfs/dbraw/zinc/07/78/46/385077846.db2.gz VHZDRIKAIMUDOZ-UHFFFAOYSA-N -1 3 263.312 2.886 20 10 CFCDHM Cc1ccc(C(=O)NC[C@@H]2CCCC(F)(F)C2)c([O-])c1O ZINC000282339555 385287724 /nfs/dbraw/zinc/28/77/24/385287724.db2.gz WFIUSTQUDOHUFD-SNVBAGLBSA-N -1 3 299.317 2.962 20 10 CFCDHM CC[C@@H](NCc1nccn1CC)c1ccccc1[O-] ZINC000271649750 385388228 /nfs/dbraw/zinc/38/82/28/385388228.db2.gz AYZISPRZTYEMKT-CYBMUJFWSA-N -1 3 259.353 2.850 20 10 CFCDHM Cc1cc(CN[C@H](C)c2cc(Cl)ccc2[O-])n(C)n1 ZINC000284242434 385546838 /nfs/dbraw/zinc/54/68/38/385546838.db2.gz IEJZOSMPLYASMA-SNVBAGLBSA-N -1 3 279.771 2.938 20 10 CFCDHM Cc1ccc(C(=O)N[C@H](C)CCc2ccco2)c([O-])c1O ZINC000272655419 385583882 /nfs/dbraw/zinc/58/38/82/385583882.db2.gz LMGVQJSRXLFCOK-LLVKDONJSA-N -1 3 289.331 2.750 20 10 CFCDHM Cc1ccc(C(=O)N2CCC[C@@H]2C(C)C)c([O-])c1O ZINC000272869397 385637855 /nfs/dbraw/zinc/63/78/55/385637855.db2.gz VZKRLCFCDJUDPQ-GFCCVEGCSA-N -1 3 263.337 2.667 20 10 CFCDHM Cc1nnc([C@H](C)N(C)Cc2ccccc2[O-])s1 ZINC000274547257 385821015 /nfs/dbraw/zinc/82/10/15/385821015.db2.gz WDTCZGKLOWRNSU-VIFPVBQESA-N -1 3 263.366 2.745 20 10 CFCDHM Cc1ccc(C(=O)N2CC[C@@H](CC(C)C)C2)c([O-])c1O ZINC000179530868 292061900 /nfs/dbraw/zinc/06/19/00/292061900.db2.gz FZUMCVHRJGVAKF-LBPRGKRZSA-N -1 3 277.364 2.914 20 10 CFCDHM CC[C@H](c1ccccc1[O-])N1CC(F)(F)C[C@@H]1CO ZINC000368037699 267140117 /nfs/dbraw/zinc/14/01/17/267140117.db2.gz NMKNGVHHGABUTC-ZYHUDNBSSA-N -1 3 271.307 2.545 20 10 CFCDHM C[C@@H]1CCOCCN1Cc1cc(Cl)ccc1[O-] ZINC000368595710 267190381 /nfs/dbraw/zinc/19/03/81/267190381.db2.gz YDVFWEUYWAEAKX-SNVBAGLBSA-N -1 3 255.745 2.656 20 10 CFCDHM [O-]c1ccccc1CN1CCOc2c(F)cccc2C1 ZINC000369406589 267240310 /nfs/dbraw/zinc/24/03/10/267240310.db2.gz BIGLRWFZROJZLW-UHFFFAOYSA-N -1 3 273.307 2.926 20 10 CFCDHM Cc1ccc(C(=O)N2CC3(CCC3)C[C@H]2C)c([O-])c1O ZINC000370632342 267332446 /nfs/dbraw/zinc/33/24/46/267332446.db2.gz ZPPPUMOOIZTHND-LLVKDONJSA-N -1 3 275.348 2.811 20 10 CFCDHM C[C@@H]1c2cccn2CCN1Cc1cccc(F)c1[O-] ZINC000272311706 289092510 /nfs/dbraw/zinc/09/25/10/289092510.db2.gz RRTHPTXLTWCNBZ-LLVKDONJSA-N -1 3 260.312 2.910 20 10 CFCDHM Cc1ccc(C(=O)N2CC[C@@H](C)C[C@H](C)C2)c([O-])c1O ZINC000182891164 301514680 /nfs/dbraw/zinc/51/46/80/301514680.db2.gz SFZWAKBQTYJGRE-MNOVXSKESA-N -1 3 277.364 2.914 20 10 CFCDHM CN(C(=O)/C=C/c1cncc([O-])c1)c1ccc2cc[nH]c2c1 ZINC000492015077 332379325 /nfs/dbraw/zinc/37/93/25/332379325.db2.gz CPBTVKBELKESLI-GORDUTHDSA-N -1 3 293.326 2.945 20 10 CFCDHM CC1(C)CN(Cc2cccc(Cl)c2[O-])CC[C@H]1O ZINC000275822598 520483221 /nfs/dbraw/zinc/48/32/21/520483221.db2.gz FFSSFUJSXDFACK-GFCCVEGCSA-N -1 3 269.772 2.638 20 10 CFCDHM CN(Cc1ccccc1[O-])Cc1cc(CO)ccc1F ZINC000528420476 517936118 /nfs/dbraw/zinc/93/61/18/517936118.db2.gz VDEWDPSQLPXGBX-UHFFFAOYSA-N -1 3 275.323 2.656 20 10 CFCDHM CC(=O)c1cc(Cl)cc(CN(CCO)C2CCC2)c1[O-] ZINC000221204930 518279104 /nfs/dbraw/zinc/27/91/04/518279104.db2.gz ZCCTUXJNEBPBMJ-UHFFFAOYSA-N -1 3 297.782 2.595 20 10 CFCDHM CC(C)CCN(C(=O)c1cccc(O)c1[O-])C1CC1 ZINC000126338357 519650163 /nfs/dbraw/zinc/65/01/63/519650163.db2.gz YCVUTXXVJLDRSV-UHFFFAOYSA-N -1 3 263.337 2.749 20 10 CFCDHM CCC[C@H]1CCCN(C(=O)c2cccc(O)c2[O-])C1 ZINC000193132733 521208477 /nfs/dbraw/zinc/20/84/77/521208477.db2.gz OXCYOFKOBXMEMG-NSHDSACASA-N -1 3 263.337 2.750 20 10 CFCDHM CCN(Cc1cc(F)cc(C(C)=O)c1[O-])C[C@H](C)OC ZINC000291158024 521293460 /nfs/dbraw/zinc/29/34/60/521293460.db2.gz FNVHIEXNWVDNMU-JTQLQIEISA-N -1 3 283.343 2.591 20 10 CFCDHM COc1cc(Cl)cc(CNCc2c(C)noc2C)c1[O-] ZINC000228672225 522541636 /nfs/dbraw/zinc/54/16/36/522541636.db2.gz JDYAJVUECNUKDH-UHFFFAOYSA-N -1 3 296.754 2.949 20 10 CFCDHM CC[C@H](N[C@@H](C)c1nncn1C)c1ccc(C)cc1[O-] ZINC000280239028 522701830 /nfs/dbraw/zinc/70/18/30/522701830.db2.gz VTQIKAMZLQOQRW-AAEUAGOBSA-N -1 3 274.368 2.631 20 10 CFCDHM CCc1nnc(CN[C@H](C)c2ccc(F)cc2[O-])s1 ZINC000290312839 522748173 /nfs/dbraw/zinc/74/81/73/522748173.db2.gz ZYDKSHYIPHJULP-MRVPVSSYSA-N -1 3 281.356 2.796 20 10 CFCDHM CN(Cc1nccn1CC(F)(F)F)Cc1ccccc1[O-] ZINC000171937094 523596539 /nfs/dbraw/zinc/59/65/39/523596539.db2.gz BOPGSNAJTNRXQH-UHFFFAOYSA-N -1 3 299.296 2.783 20 10 CFCDHM C[C@@H]1CCN(C(=O)c2cccc(O)c2[O-])C[C@@H](C)C1 ZINC000193146558 524489386 /nfs/dbraw/zinc/48/93/86/524489386.db2.gz ZPAUAKHDBGQIRF-MNOVXSKESA-N -1 3 263.337 2.606 20 10 CFCDHM Cc1cc(CN[C@H](C)c2ccc(F)cc2[O-])on1 ZINC000062748366 524778088 /nfs/dbraw/zinc/77/80/88/524778088.db2.gz SZOJETFVVOXNSC-SECBINFHSA-N -1 3 250.273 2.679 20 10 CFCDHM C[C@H](N[C@@H](C)c1cc(Cl)ccc1[O-])c1ncn(C)n1 ZINC000275810445 525528411 /nfs/dbraw/zinc/52/84/11/525528411.db2.gz ZLOJHAMKOCXWOS-IUCAKERBSA-N -1 3 280.759 2.586 20 10 CFCDHM [O-]c1ccc(Cl)cc1CN1CC[C@@H](n2cccn2)C1 ZINC000365846138 526347128 /nfs/dbraw/zinc/34/71/28/526347128.db2.gz GSVRDWNWSPXRQE-CYBMUJFWSA-N -1 3 277.755 2.689 20 10 CFCDHM [O-]c1cccc(Cl)c1CN1CC[C@H](n2cccn2)C1 ZINC000291211261 526362247 /nfs/dbraw/zinc/36/22/47/526362247.db2.gz IPAQBOSYLHDZQV-NSHDSACASA-N -1 3 277.755 2.689 20 10 CFCDHM O=C(c1cccc(O)c1[O-])N(CC1CC1)CC1CCC1 ZINC000280217554 526769864 /nfs/dbraw/zinc/76/98/64/526769864.db2.gz YCJQSDXAGCVKPQ-UHFFFAOYSA-N -1 3 275.348 2.750 20 10 CFCDHM Cc1nc(C2(NCc3ccccc3[O-])CCCC2)no1 ZINC000237709861 526770233 /nfs/dbraw/zinc/77/02/33/526770233.db2.gz JZGWJZUNWFDHLP-UHFFFAOYSA-N -1 3 273.336 2.643 20 10 CFCDHM C[C@H](NCc1cc([N+](=O)[O-])ccc1[O-])c1cccnc1 ZINC000731040986 574107332 /nfs/dbraw/zinc/10/73/32/574107332.db2.gz ITJLYOSRJCBIJH-JTQLQIEISA-N -1 3 273.292 2.546 20 10 CFCDHM COc1ccc(C)cc1CCNC(=O)c1cc([O-])cs1 ZINC000731864768 574131200 /nfs/dbraw/zinc/13/12/00/574131200.db2.gz DBOILANBDYDDFX-UHFFFAOYSA-N -1 3 291.372 2.743 20 10 CFCDHM CC(C)Oc1ccc(CNC(=O)c2cc([O-])cs2)cn1 ZINC000731872260 574131954 /nfs/dbraw/zinc/13/19/54/574131954.db2.gz ZIWPMOIDUMLPBA-UHFFFAOYSA-N -1 3 292.360 2.566 20 10 CFCDHM O=C(c1cc([O-])cs1)N1CCc2sccc2C1 ZINC000731866922 574132067 /nfs/dbraw/zinc/13/20/67/574132067.db2.gz KZCGOPPBZRMWAZ-UHFFFAOYSA-N -1 3 265.359 2.714 20 10 CFCDHM O=C(Nc1ccc(N2CCCC2)nc1)c1cc([O-])cs1 ZINC000731867530 574132431 /nfs/dbraw/zinc/13/24/31/574132431.db2.gz WMBPXVBLFFVOCK-UHFFFAOYSA-N -1 3 289.360 2.701 20 10 CFCDHM COCc1ccccc1CNC(=O)c1cc([O-])cs1 ZINC000731868809 574132829 /nfs/dbraw/zinc/13/28/29/574132829.db2.gz XHRWSECGAZPDML-UHFFFAOYSA-N -1 3 277.345 2.530 20 10 CFCDHM O=C(OCc1ccccc1[N+](=O)[O-])c1cc([O-])cs1 ZINC000731912666 574133869 /nfs/dbraw/zinc/13/38/69/574133869.db2.gz XMEXZADIVPLPOZ-UHFFFAOYSA-N -1 3 279.273 2.719 20 10 CFCDHM O=C(NCCc1cccc2cccnc21)c1cc([O-])cs1 ZINC000732263649 574148259 /nfs/dbraw/zinc/14/82/59/574148259.db2.gz IOHIXMHRWUXSBD-UHFFFAOYSA-N -1 3 298.367 2.974 20 10 CFCDHM O=C(Nc1n[nH]c2ccccc21)c1cc([O-])cs1 ZINC000732268880 574148672 /nfs/dbraw/zinc/14/86/72/574148672.db2.gz QPDBCBKEKNTOGA-UHFFFAOYSA-N -1 3 259.290 2.582 20 10 CFCDHM CC(C)c1cc(NC(=O)c2cc([O-])cs2)n[nH]1 ZINC000732278153 574149073 /nfs/dbraw/zinc/14/90/73/574149073.db2.gz UMEYBXPEDLNEIO-UHFFFAOYSA-N -1 3 251.311 2.553 20 10 CFCDHM O=C(N[C@@H]1C[C@@H]1c1ccccc1)c1cc([O-])cs1 ZINC000732277757 574149238 /nfs/dbraw/zinc/14/92/38/574149238.db2.gz OKDZJWCFMPVWDQ-VXGBXAGGSA-N -1 3 259.330 2.740 20 10 CFCDHM Cc1cc([O-])c(C[N@@H+]2CCCC[C@@H]2CC(=O)[O-])cc1C ZINC000738464016 574170155 /nfs/dbraw/zinc/17/01/55/574170155.db2.gz VOJUHMDHWQTRSO-CQSZACIVSA-N -1 3 277.364 2.838 20 10 CFCDHM Cc1cc([O-])c(C[N@H+]2CCCC[C@@H]2CC(=O)[O-])cc1C ZINC000738464016 574170157 /nfs/dbraw/zinc/17/01/57/574170157.db2.gz VOJUHMDHWQTRSO-CQSZACIVSA-N -1 3 277.364 2.838 20 10 CFCDHM COc1ccc(F)c(NC(=O)c2cc([O-])cs2)c1 ZINC000755871309 574193133 /nfs/dbraw/zinc/19/31/33/574193133.db2.gz KNEXLZGBXFAYPV-UHFFFAOYSA-N -1 3 267.281 2.854 20 10 CFCDHM Cc1noc([C@H](C)NCc2c([O-])cccc2Cl)n1 ZINC000733328649 574221784 /nfs/dbraw/zinc/22/17/84/574221784.db2.gz YJMJEYBMSAKSKP-ZETCQYMHSA-N -1 3 267.716 2.588 20 10 CFCDHM C[C@H](NCc1cccnc1)c1cc(F)cc(F)c1[O-] ZINC000756345481 574227601 /nfs/dbraw/zinc/22/76/01/574227601.db2.gz XQJQVTLIYVQXCM-VIFPVBQESA-N -1 3 264.275 2.916 20 10 CFCDHM C[C@H](NCc1nccs1)c1cc(F)cc(F)c1[O-] ZINC000756444804 574237799 /nfs/dbraw/zinc/23/77/99/574237799.db2.gz WTWWBLRERMDBQK-ZETCQYMHSA-N -1 3 270.304 2.978 20 10 CFCDHM Cc1ccc(C(=O)N[C@@H]2CC[C@@H](C)[C@@H](C)C2)c([O-])c1O ZINC000756637931 574254692 /nfs/dbraw/zinc/25/46/92/574254692.db2.gz MJOSIVBUCINWJX-ADEWGFFLSA-N -1 3 277.364 2.961 20 10 CFCDHM Cc1cc(CN[C@@H]2C[C@H](C)c3c2c([O-])ccc3F)ncn1 ZINC000756775432 574261873 /nfs/dbraw/zinc/26/18/73/574261873.db2.gz HKSATHZMGAAFAA-TVQRCGJNSA-N -1 3 287.338 2.968 20 10 CFCDHM O=C(NC[C@H](O)c1ccccc1Cl)c1cc([O-])cs1 ZINC000740929045 574274608 /nfs/dbraw/zinc/27/46/08/574274608.db2.gz OIMGCFQOOQSMHO-NSHDSACASA-N -1 3 297.763 2.571 20 10 CFCDHM CS[C@H]1CCC[C@@H](NC(=O)c2cc([O-])cs2)C1 ZINC000735330310 574321094 /nfs/dbraw/zinc/32/10/94/574321094.db2.gz HVRTUVXSEMEZAV-SCZZXKLOSA-N -1 3 271.407 2.858 20 10 CFCDHM Cc1cc(O)c(CN2CC[C@@](F)(C(=O)[O-])C2)cc1C(C)C ZINC000832899678 601371343 /nfs/dbraw/zinc/37/13/43/601371343.db2.gz QJBFPXBVSLAKKP-INIZCTEOSA-N -1 3 295.354 2.823 20 10 CFCDHM C[N@H+](Cc1ccsc1C(=O)[O-])Cc1ccccc1[O-] ZINC000830860741 601825575 /nfs/dbraw/zinc/82/55/75/601825575.db2.gz WCDIJKMVOULAQP-UHFFFAOYSA-N -1 3 277.345 2.784 20 10 CFCDHM C[N@@H+](Cc1ccsc1C(=O)[O-])Cc1ccccc1[O-] ZINC000830860741 601825576 /nfs/dbraw/zinc/82/55/76/601825576.db2.gz WCDIJKMVOULAQP-UHFFFAOYSA-N -1 3 277.345 2.784 20 10 CFCDHM COc1ccc(O)c([C@H](C)NCc2occc2C(=O)[O-])c1 ZINC000833733744 605127956 /nfs/dbraw/zinc/12/79/56/605127956.db2.gz OKCFCZRURWXQEV-VIFPVBQESA-N -1 3 291.303 2.543 20 10 CFCDHM Cc1cc(O)c(CNc2ccc(-c3nn[n-]n3)cc2)cc1C ZINC000826272184 608868793 /nfs/dbraw/zinc/86/87/93/608868793.db2.gz XQSBMVGSIVTEKX-UHFFFAOYSA-N -1 3 295.346 2.801 20 10 CFCDHM [O-]c1ccc(Cl)c(F)c1CN1C[C@H]2[C@@H](C1)C2(F)F ZINC000846109482 618091736 /nfs/dbraw/zinc/09/17/36/618091736.db2.gz CXXJJIHQBJBKBF-OCAPTIKFSA-N -1 3 277.673 2.882 20 10 CFCDHM C[C@H](O)c1cc(NC(=O)c2cccc(O)c2[O-])ccc1F ZINC000804803379 617889628 /nfs/dbraw/zinc/88/96/28/617889628.db2.gz LXEIQCNNSBRPGV-QMMMGPOBSA-N -1 3 291.278 2.543 20 10 CFCDHM CC(=O)c1cccc(NC(=O)c2ccc(C)c(O)c2[O-])c1 ZINC000179384124 618268916 /nfs/dbraw/zinc/26/89/16/618268916.db2.gz RQWLNEJTSMTOSW-UHFFFAOYSA-N -1 3 285.299 2.861 20 10 CFCDHM O=C(N[C@@H]1CCc2cc(F)ccc21)c1cccc(O)c1[O-] ZINC000187010801 618271808 /nfs/dbraw/zinc/27/18/08/618271808.db2.gz WUPSVMKKXANWMW-CYBMUJFWSA-N -1 3 287.290 2.654 20 10 CFCDHM C[C@@H]1CCC[C@H](C)CN1C(=O)c1cccc(O)c1[O-] ZINC000187128516 618273283 /nfs/dbraw/zinc/27/32/83/618273283.db2.gz NERXSJSLHIPYPS-WDEREUQCSA-N -1 3 263.337 2.749 20 10 CFCDHM Cc1cccc(C)c1CCNC(=O)c1cccc(O)c1[O-] ZINC000193137961 618451563 /nfs/dbraw/zinc/45/15/63/618451563.db2.gz PAPUNAVTIIYLPA-UHFFFAOYSA-N -1 3 285.343 2.687 20 10 CFCDHM [O-]c1cc(Br)ccc1CN1CC[C@H]1C(F)F ZINC000895430842 618578671 /nfs/dbraw/zinc/57/86/71/618578671.db2.gz IOZREVVPQRRFNB-VIFPVBQESA-N -1 3 292.123 2.994 20 10 CFCDHM [O-]c1ccc(Br)cc1CN1CC[C@@H]1C(F)F ZINC000895437973 618585568 /nfs/dbraw/zinc/58/55/68/618585568.db2.gz XBCZAADFELVDBA-SECBINFHSA-N -1 3 292.123 2.994 20 10 CFCDHM Cc1ccc2c(c1)OCCN2C(=O)c1ccc(C)c(O)c1[O-] ZINC000182504981 625319323 /nfs/dbraw/zinc/31/93/23/625319323.db2.gz XBQDJZMAVAHIJD-UHFFFAOYSA-N -1 3 299.326 2.754 20 10 CFCDHM [O-]c1cccc(F)c1CNc1cc(C2CC2)ncn1 ZINC000895832083 619619054 /nfs/dbraw/zinc/61/90/54/619619054.db2.gz ABTPTPKMDLWGLG-UHFFFAOYSA-N -1 3 259.284 2.811 20 10 CFCDHM CC(C)n1nccc1CNCc1c([O-])cccc1F ZINC000896637660 619780346 /nfs/dbraw/zinc/78/03/46/619780346.db2.gz LDIZVXUMYKUIIU-UHFFFAOYSA-N -1 3 263.316 2.599 20 10 CFCDHM COc1cccc(OC)c1CNCc1c([O-])cccc1F ZINC000896639574 619781648 /nfs/dbraw/zinc/78/16/48/619781648.db2.gz WQEDSCDCQCTAHM-UHFFFAOYSA-N -1 3 291.322 2.838 20 10 CFCDHM O=C(NCc1c([O-])cccc1F)[C@@H]1CC[C@H]2C[C@H]2C1 ZINC000928705375 619995607 /nfs/dbraw/zinc/99/56/07/619995607.db2.gz IBSIWTVSXUVVEY-AXFHLTTASA-N -1 3 263.312 2.584 20 10 CFCDHM Cc1ccc([C@@H](C)C(=O)NCc2c([O-])cccc2F)o1 ZINC000928706209 619996009 /nfs/dbraw/zinc/99/60/09/619996009.db2.gz STDKIPKGWAWIIO-SNVBAGLBSA-N -1 3 277.295 2.853 20 10 CFCDHM Cc1nc(C2CC2)oc1C(=O)NCc1c([O-])cccc1F ZINC000928709007 619996581 /nfs/dbraw/zinc/99/65/81/619996581.db2.gz VKEUGLAIOWVJOK-UHFFFAOYSA-N -1 3 290.294 2.635 20 10 CFCDHM CC(C)OC(=O)C(C)(C)NCc1cc(Cl)ccc1[O-] ZINC000898508672 620472745 /nfs/dbraw/zinc/47/27/45/620472745.db2.gz JATHVRMLWMTLRC-UHFFFAOYSA-N -1 3 285.771 2.865 20 10 CFCDHM CCn1cnc(CNCc2cccc(Cl)c2[O-])c1 ZINC000902705175 621153112 /nfs/dbraw/zinc/15/31/12/621153112.db2.gz UMYKXRRQIQEVMW-UHFFFAOYSA-N -1 3 265.744 2.552 20 10 CFCDHM CC(C)n1nccc1NC(=O)NCc1c([O-])cccc1F ZINC000902945121 621207178 /nfs/dbraw/zinc/20/71/78/621207178.db2.gz PYZTUHRZVUKCHO-UHFFFAOYSA-N -1 3 292.314 2.630 20 10 CFCDHM C[C@@H]1C[C@@H](C)[C@H](C)N(C(=O)c2cccc(O)c2[O-])C1 ZINC000166844243 623034084 /nfs/dbraw/zinc/03/40/84/623034084.db2.gz QKIVEIKKPMXAQF-MXWKQRLJSA-N -1 3 263.337 2.604 20 10 CFCDHM C[C@@H]1CC[C@H](NC(=O)c2cccc(O)c2[O-])[C@@H](C)C1 ZINC000228513165 623147254 /nfs/dbraw/zinc/14/72/54/623147254.db2.gz KUSGYZXLNLGRCL-SCVCMEIPSA-N -1 3 263.337 2.652 20 10 CFCDHM C[C@@H]1CCC[C@@H](CNC(=O)c2cccc(O)c2[O-])C1 ZINC000228736214 623159822 /nfs/dbraw/zinc/15/98/22/623159822.db2.gz XBGVYASTMOOMCS-GHMZBOCLSA-N -1 3 263.337 2.654 20 10 CFCDHM COC(=O)CN(Cc1cc(Cl)ccc1[O-])CC1CCC1 ZINC000173362961 623345830 /nfs/dbraw/zinc/34/58/30/623345830.db2.gz CZYZHMJELUIVPJ-UHFFFAOYSA-N -1 3 297.782 2.821 20 10 CFCDHM Cc1cc([O-])c(CN2C[C@H](C)OC[C@@H]2C)cc1Cl ZINC000824576076 623525732 /nfs/dbraw/zinc/52/57/32/623525732.db2.gz ZNJVFCLHWGTHRC-QWRGUYRKSA-N -1 3 269.772 2.963 20 10 CFCDHM CC[C@H]1COCCN1Cc1cc(Cl)c(C)cc1[O-] ZINC000824597951 623530331 /nfs/dbraw/zinc/53/03/31/623530331.db2.gz XOHNKPZAFMCFJU-LBPRGKRZSA-N -1 3 269.772 2.965 20 10 CFCDHM Cc1cc([O-])c(CN2CCO[C@@H](C)[C@H]2C)cc1Cl ZINC000824815105 623571391 /nfs/dbraw/zinc/57/13/91/623571391.db2.gz ZNRIVPWBUMWRIL-MNOVXSKESA-N -1 3 269.772 2.963 20 10 CFCDHM CCOCCOC1CN(Cc2cc(Cl)c(C)cc2[O-])C1 ZINC000825440102 623694587 /nfs/dbraw/zinc/69/45/87/623694587.db2.gz BHHZJSUURFGXAF-UHFFFAOYSA-N -1 3 299.798 2.591 20 10 CFCDHM COC[C@H]1CN(Cc2cc(Cl)c(C)cc2[O-])C[C@@H](C)O1 ZINC000825634202 623727440 /nfs/dbraw/zinc/72/74/40/623727440.db2.gz JPIQMMOVNXQEPB-DGCLKSJQSA-N -1 3 299.798 2.590 20 10 CFCDHM COC[C@@H]1CN(Cc2cc(Cl)c(C)cc2[O-])C[C@H](C)O1 ZINC000825634194 623727741 /nfs/dbraw/zinc/72/77/41/623727741.db2.gz JPIQMMOVNXQEPB-AAEUAGOBSA-N -1 3 299.798 2.590 20 10 CFCDHM Cc1cc([O-])c(CN2C[C@@H](O)CC(F)(F)C2)cc1Cl ZINC000825658254 623731967 /nfs/dbraw/zinc/73/19/67/623731967.db2.gz NPIQGFBBAVYJDB-JTQLQIEISA-N -1 3 291.725 2.556 20 10 CFCDHM Cc1cc([O-])c(CN2CC[C@H](O)C(F)(F)C2)cc1Cl ZINC000826952799 623913681 /nfs/dbraw/zinc/91/36/81/623913681.db2.gz SZIZKVOWTAEHAI-LBPRGKRZSA-N -1 3 291.725 2.556 20 10 CFCDHM Cc1cc([O-])c(CN2CCc3nccnc3C2)cc1Cl ZINC000827687709 624064475 /nfs/dbraw/zinc/06/44/75/624064475.db2.gz UFYRVZFPUNRNQU-UHFFFAOYSA-N -1 3 289.766 2.702 20 10 CFCDHM Cc1nnc(CN(C)Cc2cc(Cl)ccc2[O-])s1 ZINC000827799121 624095765 /nfs/dbraw/zinc/09/57/65/624095765.db2.gz KWEQGKBQEYXQMG-UHFFFAOYSA-N -1 3 283.784 2.838 20 10 CFCDHM COC1(C(=O)NCc2c([O-])cccc2F)CCCCCC1 ZINC000830180607 624659776 /nfs/dbraw/zinc/65/97/76/624659776.db2.gz PMHRRCBPOWFXHY-UHFFFAOYSA-N -1 3 295.354 2.887 20 10 CFCDHM CC(C)C1(CNC(=O)NCc2c([O-])cccc2F)CC1 ZINC000921377244 624863375 /nfs/dbraw/zinc/86/33/75/624863375.db2.gz ONTHGTKWWCALRC-UHFFFAOYSA-N -1 3 280.343 2.767 20 10 CFCDHM CCS[C@@H]1CCCC[C@@H]1NC(=O)c1cccc(O)c1[O-] ZINC000185807868 625780128 /nfs/dbraw/zinc/78/01/28/625780128.db2.gz LPLGFLCPIKRFFX-WCQYABFASA-N -1 3 295.404 2.892 20 10 CFCDHM CC1(C)CC[C@@H]1NC(=O)NCc1c([O-])cccc1F ZINC000922480643 626293574 /nfs/dbraw/zinc/29/35/74/626293574.db2.gz YGVNGTOLLHJBEN-LBPRGKRZSA-N -1 3 266.316 2.519 20 10 CFCDHM CCCc1cnc(NC(=O)c2cccc(O)c2[O-])s1 ZINC000187219527 626480890 /nfs/dbraw/zinc/48/08/90/626480890.db2.gz MCPAJHKGXDHRIX-UHFFFAOYSA-N -1 3 278.333 2.759 20 10 CFCDHM CN(Cc1cc[nH]n1)Cc1cc(Br)ccc1[O-] ZINC000769384391 627432680 /nfs/dbraw/zinc/43/26/80/627432680.db2.gz OEBNRXPUHAVEQN-UHFFFAOYSA-N -1 3 296.168 2.510 20 10 CFCDHM CO[C@@H]1CCCN(Cc2cc(Cl)cc(F)c2[O-])C1 ZINC000775656007 628050171 /nfs/dbraw/zinc/05/01/71/628050171.db2.gz ABEXMKXSALOWNV-LLVKDONJSA-N -1 3 273.735 2.796 20 10 CFCDHM C[C@H]1[C@H](C)N(Cc2cc(Cl)cc(F)c2[O-])CCN1C ZINC000775987028 628092289 /nfs/dbraw/zinc/09/22/89/628092289.db2.gz UATGMJUIZHKCOC-UWVGGRQHSA-N -1 3 286.778 2.709 20 10 CFCDHM Cc1ccc(C(=O)Nc2ccc3[nH]cnc3c2)c([O-])c1O ZINC000780916210 628504663 /nfs/dbraw/zinc/50/46/63/628504663.db2.gz UCXLKXMIPDMJOL-UHFFFAOYSA-N -1 3 283.287 2.535 20 10 CFCDHM O=C(NC[C@H]1CCC[C@H]1C1CC1)c1cccc(O)c1[O-] ZINC000839804896 628542370 /nfs/dbraw/zinc/54/23/70/628542370.db2.gz CVEOQORYMWXHLD-NEPJUHHUSA-N -1 3 275.348 2.654 20 10 CFCDHM C[C@H](NC(=O)c1cccc(O)c1[O-])c1c(F)cccc1F ZINC000790523340 629245079 /nfs/dbraw/zinc/24/50/79/629245079.db2.gz RJJYPSXPNAMYKL-QMMMGPOBSA-N -1 3 293.269 2.867 20 10 CFCDHM Cc1ccc2c(c1)CC[C@@H]2NC(=O)c1cccc(O)c1[O-] ZINC000790571229 629249173 /nfs/dbraw/zinc/24/91/73/629249173.db2.gz DJDYAVRBVMJJIE-AWEZNQCLSA-N -1 3 283.327 2.824 20 10 CFCDHM O=C(NCc1cc2ccccc2[nH]1)c1cccc(O)c1[O-] ZINC000790599153 629251464 /nfs/dbraw/zinc/25/14/64/629251464.db2.gz TVADCUNTTXCSKU-UHFFFAOYSA-N -1 3 282.299 2.509 20 10 CFCDHM C[C@H]1Cc2ccccc2[C@H]1NC(=O)c1cccc(O)c1[O-] ZINC000790704245 629258157 /nfs/dbraw/zinc/25/81/57/629258157.db2.gz OJKQQRRIOZLHBU-BONVTDFDSA-N -1 3 283.327 2.761 20 10 CFCDHM CCC(CC)[C@H](CCNC(=O)c1cccc(O)c1[O-])OC ZINC000790899428 629270547 /nfs/dbraw/zinc/27/05/47/629270547.db2.gz JTWWCZWSFBWSTJ-AWEZNQCLSA-N -1 3 295.379 2.669 20 10 CFCDHM O=C(NCCCc1cccs1)c1cccc(O)c1[O-] ZINC000790910528 629271205 /nfs/dbraw/zinc/27/12/05/629271205.db2.gz BOUGHNWCUCRPGN-UHFFFAOYSA-N -1 3 277.345 2.522 20 10 CFCDHM CCc1nc(C)c(NC(=O)c2cccc(O)c2[O-])s1 ZINC000790943507 629273018 /nfs/dbraw/zinc/27/30/18/629273018.db2.gz LHONRSWBNHAQHQ-UHFFFAOYSA-N -1 3 278.333 2.677 20 10 CFCDHM CCc1nnc([C@@H](C)NCc2c([O-])ccc(Cl)c2F)[nH]1 ZINC000790981755 629277046 /nfs/dbraw/zinc/27/70/46/629277046.db2.gz WKEQUCPMGIELSF-SSDOTTSWSA-N -1 3 298.749 2.716 20 10 CFCDHM CCc1nc([C@@H](C)NCc2c([O-])ccc(Cl)c2F)n[nH]1 ZINC000790981755 629277050 /nfs/dbraw/zinc/27/70/50/629277050.db2.gz WKEQUCPMGIELSF-SSDOTTSWSA-N -1 3 298.749 2.716 20 10 CFCDHM C[C@H](NCc1c([O-])ccc(Cl)c1F)c1cn[nH]c1 ZINC000790980233 629277094 /nfs/dbraw/zinc/27/70/94/629277094.db2.gz LMITWLGYHDPPCO-ZETCQYMHSA-N -1 3 269.707 2.759 20 10 CFCDHM O=C(NCc1ccc(C2CC2)cc1)c1cccc(O)c1[O-] ZINC000791184516 629291613 /nfs/dbraw/zinc/29/16/13/629291613.db2.gz YMJLBYAGZWXDFK-UHFFFAOYSA-N -1 3 283.327 2.905 20 10 CFCDHM CC(=O)c1cc(F)cc(CN2[C@H](C)C[C@H]2C)c1[O-] ZINC000791564871 629333568 /nfs/dbraw/zinc/33/35/68/629333568.db2.gz ASIWCCAIKALJGH-RKDXNWHRSA-N -1 3 251.301 2.717 20 10 CFCDHM C[C@H](O)[C@H]1CCCN(Cc2c([O-])ccc(Cl)c2F)C1 ZINC000792174330 629405752 /nfs/dbraw/zinc/40/57/52/629405752.db2.gz RYXQFFKBTMOITD-UWVGGRQHSA-N -1 3 287.762 2.778 20 10 CFCDHM Cc1cc(=O)[n-]c(C=Cc2ccc3c(c2)CCN3C)n1 ZINC000806574765 630814681 /nfs/dbraw/zinc/81/46/81/630814681.db2.gz VWPAIHDNUSPVAM-GQCTYLIASA-N -1 3 267.332 2.653 20 10 CFCDHM O=C(NC1(Cc2ccccc2)CC1)c1cccc(O)c1[O-] ZINC000807268379 630872516 /nfs/dbraw/zinc/87/25/16/630872516.db2.gz NSGHQNJLROTWQC-UHFFFAOYSA-N -1 3 283.327 2.603 20 10 CFCDHM C[C@H]1CO[C@H](C(F)(F)F)CN1Cc1cc(F)ccc1[O-] ZINC000809696129 631267140 /nfs/dbraw/zinc/26/71/40/631267140.db2.gz CLWSJIFBPLUODX-UFBFGSQYSA-N -1 3 293.260 2.683 20 10 CFCDHM Cc1noc([C@@H]2CCCN2Cc2cc(F)ccc2[O-])n1 ZINC000809720906 631271755 /nfs/dbraw/zinc/27/17/55/631271755.db2.gz JOLMTVNUGPNUKL-LBPRGKRZSA-N -1 3 277.299 2.560 20 10 CFCDHM Cc1cc([O-])c(CN(CC(F)F)C[C@@H](C)O)c(Cl)c1 ZINC000840950360 631278560 /nfs/dbraw/zinc/27/85/60/631278560.db2.gz JGMMLTQAYFRNJA-SECBINFHSA-N -1 3 293.741 2.802 20 10 CFCDHM CN(Cc1nccn1C)Cc1ccc2ccccc2c1[O-] ZINC000816564804 632484969 /nfs/dbraw/zinc/48/49/69/632484969.db2.gz QPJCSYDVYIMFHO-UHFFFAOYSA-N -1 3 281.359 2.911 20 10 CFCDHM CCOC(=O)[C@@H](C)NCc1ccc2ccccc2c1[O-] ZINC000816589886 632490347 /nfs/dbraw/zinc/49/03/47/632490347.db2.gz LJHCCQQSFWZOTE-LLVKDONJSA-N -1 3 273.332 2.587 20 10 CFCDHM CCN1CCN(Cc2cc(Cl)c(F)cc2[O-])[C@H](C)C1 ZINC000816607898 632492981 /nfs/dbraw/zinc/49/29/81/632492981.db2.gz IVHOEVQJYDYEHI-SNVBAGLBSA-N -1 3 286.778 2.711 20 10 CFCDHM [O-]c1c(CN2CCn3cncc3C2)ccc2ccccc21 ZINC000816616525 632496198 /nfs/dbraw/zinc/49/61/98/632496198.db2.gz YVFAQROOQOPUNN-UHFFFAOYSA-N -1 3 279.343 2.758 20 10 CFCDHM [O-]c1cc(F)c(Cl)cc1CN1CCC(C2(O)CC2)CC1 ZINC000846008904 632611680 /nfs/dbraw/zinc/61/16/80/632611680.db2.gz SXSOMCRYKVEQOB-UHFFFAOYSA-N -1 3 299.773 2.922 20 10 CFCDHM C[C@@H]1CC[C@H](O)CN1Cc1c([O-])ccc(Cl)c1F ZINC000817414465 632625426 /nfs/dbraw/zinc/62/54/26/632625426.db2.gz LJEIQWZJPHUVFA-BDAKNGLRSA-N -1 3 273.735 2.530 20 10 CFCDHM CN(C(=O)c1cccc(O)c1[O-])C1CC(OC(C)(C)C)C1 ZINC000817667357 632684331 /nfs/dbraw/zinc/68/43/31/632684331.db2.gz BQNABHRMJFLRLO-UHFFFAOYSA-N -1 3 293.363 2.516 20 10 CFCDHM CCn1cc(CN[C@@H](C)c2cc(Cl)ccc2[O-])nn1 ZINC000850522139 634029841 /nfs/dbraw/zinc/02/98/41/634029841.db2.gz DSQUJYYMSYDAPL-VIFPVBQESA-N -1 3 280.759 2.508 20 10 CFCDHM C[C@@H](N[C@H](C)c1ccc(F)cc1[O-])c1nccn1C ZINC000850571980 634056674 /nfs/dbraw/zinc/05/66/74/634056674.db2.gz FXAZUCYWWPVFRQ-NXEZZACHSA-N -1 3 263.316 2.677 20 10 CFCDHM CC(C)C[C@H](C[NH2+]Cc1ccccc1[O-])CC(=O)[O-] ZINC000854243980 635270811 /nfs/dbraw/zinc/27/08/11/635270811.db2.gz KBUMBNFHOBFSQI-LBPRGKRZSA-N -1 3 265.353 2.619 20 10 CFCDHM Cc1ccnc(NC(=O)c2cccc(O)c2[O-])c1C1CC1 ZINC000857311218 635963726 /nfs/dbraw/zinc/96/37/26/635963726.db2.gz GFEWDVYRGNLMNE-UHFFFAOYSA-N -1 3 284.315 2.931 20 10 CFCDHM O=C(NC[C@@H]1C[C@H]1c1ccccc1)c1cccc(O)c1[O-] ZINC000188467882 650332485 /nfs/dbraw/zinc/33/24/85/650332485.db2.gz NWBBOVZTZZZVJY-JSGCOSHPSA-N -1 3 283.327 2.631 20 10 CFCDHM CCn1ncc2ccc(NC(=O)c3cccc(O)c3[O-])cc21 ZINC000189279416 650372005 /nfs/dbraw/zinc/37/20/05/650372005.db2.gz NGFDVLVVRPJFAP-UHFFFAOYSA-N -1 3 297.314 2.720 20 10 CFCDHM CC1(C)CN(C(=O)c2cccc(O)c2[O-])[C@H]1c1ccco1 ZINC000869787599 639399114 /nfs/dbraw/zinc/39/91/14/639399114.db2.gz IZTBYMRZUYNWRW-AWEZNQCLSA-N -1 3 287.315 2.914 20 10 CFCDHM CCC(=O)c1cccc(NC(=O)c2cccc(O)c2[O-])c1 ZINC000193141699 650626547 /nfs/dbraw/zinc/62/65/47/650626547.db2.gz LBBQAJCTVYRUEW-UHFFFAOYSA-N -1 3 285.299 2.943 20 10 CFCDHM O=C(Nc1ccc2c(c1)CCC2)c1cccc(O)c1[O-] ZINC000126209440 643050172 /nfs/dbraw/zinc/05/01/72/643050172.db2.gz DADHQFZHRUBZCZ-UHFFFAOYSA-N -1 3 269.300 2.839 20 10 CFCDHM C[C@@H]1CCC[C@@H](NC(=O)c2cccc(O)c2[O-])[C@@H]1C ZINC000126231863 643057017 /nfs/dbraw/zinc/05/70/17/643057017.db2.gz XGRQYSNGAIQJGE-CKYFFXLPSA-N -1 3 263.337 2.652 20 10 CFCDHM CCc1cccc(NC(=O)c2cccc(O)c2[O-])c1 ZINC000126230676 643057121 /nfs/dbraw/zinc/05/71/21/643057121.db2.gz NPPULECTCMLYBX-UHFFFAOYSA-N -1 3 257.289 2.913 20 10 CFCDHM O=C(Nc1cccc2cnccc21)c1cccc(O)c1[O-] ZINC000126271178 643087328 /nfs/dbraw/zinc/08/73/28/643087328.db2.gz ZRFBDXZDXDPNSU-UHFFFAOYSA-N -1 3 280.283 2.898 20 10 CFCDHM C[C@@H](Cc1ccsc1)NC(=O)c1cccc(O)c1[O-] ZINC000126303484 643111460 /nfs/dbraw/zinc/11/14/60/643111460.db2.gz CRRHKZPXXLEBPX-VIFPVBQESA-N -1 3 277.345 2.520 20 10 CFCDHM C[C@@H]1CC[C@H](NC(=O)c2cccc(O)c2[O-])C[C@@H]1C ZINC000126448788 643227415 /nfs/dbraw/zinc/22/74/15/643227415.db2.gz BIJIRUMWPTWQMQ-VWYCJHECSA-N -1 3 263.337 2.652 20 10 CFCDHM Cc1cc(F)cc(NC(=O)c2cccc(O)c2[O-])c1 ZINC000126469511 643236629 /nfs/dbraw/zinc/23/66/29/643236629.db2.gz SSBCMNGGUGIVEI-UHFFFAOYSA-N -1 3 261.252 2.798 20 10 CFCDHM CCOc1ccc(NC(=O)c2cccc(O)c2[O-])cc1F ZINC000126528295 643282864 /nfs/dbraw/zinc/28/28/64/643282864.db2.gz MJAMTFPRSLFNOI-UHFFFAOYSA-N -1 3 291.278 2.888 20 10 CFCDHM O=C1N(c2ccccc2)[C@@H](c2cc(F)ccc2[O-])NC12CC2 ZINC000877859231 643609375 /nfs/dbraw/zinc/60/93/75/643609375.db2.gz OIVLTHZKAWDZNS-HNNXBMFYSA-N -1 3 298.317 2.699 20 10 CFCDHM C[C@@H]1CN(Cc2cc(Cl)ccc2[O-])C[C@H](C)O1 ZINC000126871345 643705959 /nfs/dbraw/zinc/70/59/59/643705959.db2.gz GONMVFISQSHVCE-AOOOYVTPSA-N -1 3 255.745 2.655 20 10 CFCDHM CCCN(CC(=O)OCC)Cc1c([O-])cccc1Cl ZINC000130514123 645515061 /nfs/dbraw/zinc/51/50/61/645515061.db2.gz UIOWZXNJTUDQGP-UHFFFAOYSA-N -1 3 285.771 2.821 20 10 CFCDHM CC[C@@H]1COCCN1Cc1cc(Cl)ccc1[O-] ZINC000132331377 645908675 /nfs/dbraw/zinc/90/86/75/645908675.db2.gz NFIWUFRUOPRAMS-GFCCVEGCSA-N -1 3 255.745 2.656 20 10 CFCDHM CC[C@H]1COCCN1Cc1cc(Cl)ccc1[O-] ZINC000132331591 645908721 /nfs/dbraw/zinc/90/87/21/645908721.db2.gz NFIWUFRUOPRAMS-LBPRGKRZSA-N -1 3 255.745 2.656 20 10 CFCDHM [O-]c1c(F)cc(F)cc1CNCc1cc(C2CC2)no1 ZINC000886269301 646942434 /nfs/dbraw/zinc/94/24/34/646942434.db2.gz RGLDXEBJBUFRMS-UHFFFAOYSA-N -1 3 280.274 2.826 20 10 CFCDHM C[C@@H](N[C@@H](C)c1c([O-])cccc1F)c1ccnn1C ZINC000886648081 647086965 /nfs/dbraw/zinc/08/69/65/647086965.db2.gz LDEAZTBRSLVWMN-ZJUUUORDSA-N -1 3 263.316 2.677 20 10 CFCDHM C[C@@]1(C(=O)NCc2c([O-])cccc2F)CC=CCC1 ZINC000928706667 648945385 /nfs/dbraw/zinc/94/53/85/648945385.db2.gz UPELJOWDLXJJCV-OAHLLOKOSA-N -1 3 263.312 2.894 20 10 CFCDHM CC1(C)CCC[C@@H]1C(=O)NCc1c([O-])cccc1F ZINC000928707676 648945454 /nfs/dbraw/zinc/94/54/54/648945454.db2.gz GICYVCVWGSDRHZ-LLVKDONJSA-N -1 3 265.328 2.974 20 10 CFCDHM COc1cc([O-])c(CN2CC[C@H]2C)cc1Br ZINC001233135223 777807064 /nfs/dbraw/zinc/80/70/64/777807064.db2.gz OXMIDJPIYUSTBG-MRVPVSSYSA-N -1 3 286.169 2.758 20 10 CFCDHM CCC(F)(F)C(C)(C)CNC(=O)c1cccc(O)c1[O-] ZINC000700060717 780659222 /nfs/dbraw/zinc/65/92/22/780659222.db2.gz QZRUFOUCLKULJN-UHFFFAOYSA-N -1 3 287.306 2.899 20 10 CFCDHM C[C@@H]1CN(Cc2c([O-])cccc2Cl)CCCC1=O ZINC001140337842 770526579 /nfs/dbraw/zinc/52/65/79/770526579.db2.gz IZKOGNVBCZTHAR-SNVBAGLBSA-N -1 3 267.756 2.847 20 10 CFCDHM O=S(=O)(Cc1ccccc1F)Nc1ccc([O-])c(F)c1 ZINC000396472689 775932705 /nfs/dbraw/zinc/93/27/05/775932705.db2.gz PRHKZWCCOOAUEW-UHFFFAOYSA-N -1 3 299.298 2.612 20 10 CFCDHM O=C([O-])c1ccc(CN2CCc3sccc3C2)c(O)c1 ZINC001231449219 777222052 /nfs/dbraw/zinc/22/20/52/777222052.db2.gz HAGHKMAMMIHJPB-UHFFFAOYSA-N -1 3 289.356 2.710 20 10 CFCDHM C[C@@H]1C[C@@H](C)CC[N@@H+]1Cc1cc(C(=O)[O-])ccc1[O-] ZINC001231564087 777260744 /nfs/dbraw/zinc/26/07/44/777260744.db2.gz HYOIERIYCPMRQM-WDEREUQCSA-N -1 3 263.337 2.711 20 10 CFCDHM C[C@@H]1C[C@@H](C)CC[N@H+]1Cc1cc(C(=O)[O-])ccc1[O-] ZINC001231564087 777260757 /nfs/dbraw/zinc/26/07/57/777260757.db2.gz HYOIERIYCPMRQM-WDEREUQCSA-N -1 3 263.337 2.711 20 10 CFCDHM C[C@@H]1CCCCC[N@@H+]1Cc1cc(C(=O)[O-])ccc1[O-] ZINC001231564094 777261161 /nfs/dbraw/zinc/26/11/61/777261161.db2.gz OCOTVJPWTULYGT-LLVKDONJSA-N -1 3 263.337 2.855 20 10 CFCDHM C[C@@H]1CCCCC[N@H+]1Cc1cc(C(=O)[O-])ccc1[O-] ZINC001231564094 777261165 /nfs/dbraw/zinc/26/11/65/777261165.db2.gz OCOTVJPWTULYGT-LLVKDONJSA-N -1 3 263.337 2.855 20 10 CFCDHM C[C@H]1C[C@H](C)C[NH+](Cc2cc(C(=O)[O-])ccc2[O-])C1 ZINC001231564869 777261469 /nfs/dbraw/zinc/26/14/69/777261469.db2.gz JDCLDNFEIWHYHO-QWRGUYRKSA-N -1 3 263.337 2.568 20 10 CFCDHM O=C([O-])c1ccc([O-])c(C[NH+]2CCCCCCC2)c1 ZINC001231564136 777262110 /nfs/dbraw/zinc/26/21/10/777262110.db2.gz IFBFGRUQTVVTKJ-UHFFFAOYSA-N -1 3 263.337 2.857 20 10 CFCDHM Cc1cc([O-])c(CN2CCC(=O)CC2)cc1Cl ZINC001231867036 777357777 /nfs/dbraw/zinc/35/77/77/777357777.db2.gz HAOOGHOGVIVHSW-UHFFFAOYSA-N -1 3 253.729 2.519 20 10 CFCDHM COC(=O)[C@H](C(C)C)N(C)Cc1cc(Cl)c(C)cc1[O-] ZINC001231870275 777358817 /nfs/dbraw/zinc/35/88/17/777358817.db2.gz RCFFSSYRLWVNJM-AWEZNQCLSA-N -1 3 299.798 2.983 20 10 CFCDHM [O-]c1c(Cl)cccc1CN1CC(N2CCC(F)CC2)C1 ZINC001231912772 777380866 /nfs/dbraw/zinc/38/08/66/777380866.db2.gz YYIVSDCOWQRUGN-UHFFFAOYSA-N -1 3 298.789 2.664 20 10 CFCDHM [O-]c1cc(O)c(CN2C[C@@H]3C[C@@H]3[C@@H](F)C2)cc1Cl ZINC001232257895 777495149 /nfs/dbraw/zinc/49/51/49/777495149.db2.gz LJQNARAJCJPYSB-ARENWVFISA-N -1 3 271.719 2.541 20 10 CFCDHM COc1cc([O-])c(CN2C[C@@H](F)C[C@H]2CF)cc1Cl ZINC001232267116 777499602 /nfs/dbraw/zinc/49/96/02/777499602.db2.gz WUEIBMRFBGDVAR-UWVGGRQHSA-N -1 3 291.725 2.936 20 10 CFCDHM CC[C@@]12C[C@@H](CO1)N(Cc1cc(Cl)c(OC)cc1[O-])C2 ZINC001232267420 777499672 /nfs/dbraw/zinc/49/96/72/777499672.db2.gz BQEAJTGAUFSNJY-NHYWBVRUSA-N -1 3 297.782 2.808 20 10 CFCDHM [O-]c1c(F)c(F)ccc1CN1CCC(n2cccn2)CC1 ZINC001233078410 777789894 /nfs/dbraw/zinc/78/98/94/777789894.db2.gz VDMHKZLUWABRLV-UHFFFAOYSA-N -1 3 293.317 2.704 20 10 CFCDHM [O-]c1ccc(F)c(F)c1CN1CC[C@@H]2CCCO[C@H]2C1 ZINC001233332757 777895243 /nfs/dbraw/zinc/89/52/43/777895243.db2.gz WRIBAVTTXMABEI-HZMBPMFUSA-N -1 3 283.318 2.671 20 10 CFCDHM [O-]c1c(CN2CC[C@@]23CCOC3)cccc1C(F)(F)F ZINC001233418954 777944568 /nfs/dbraw/zinc/94/45/68/777944568.db2.gz CZHLSTRDCGBPSF-ZDUSSCGKSA-N -1 3 287.281 2.776 20 10 CFCDHM C[C@@H]1CN(Cc2ccc(C(F)(F)F)cc2[O-])CCO1 ZINC001233452095 777957337 /nfs/dbraw/zinc/95/73/37/777957337.db2.gz KPOZKTKZHZCKJN-SECBINFHSA-N -1 3 275.270 2.632 20 10 CFCDHM [O-]c1cc(C(F)(F)F)ccc1CN1CCOCC12CC2 ZINC001233455152 777959280 /nfs/dbraw/zinc/95/92/80/777959280.db2.gz YMSYDJVCEYXSGE-UHFFFAOYSA-N -1 3 287.281 2.776 20 10 CFCDHM COc1cc([O-])c(CN(C)Cc2ccno2)c(Cl)c1 ZINC001236808958 778946453 /nfs/dbraw/zinc/94/64/53/778946453.db2.gz SDYZLLYNHUCFME-UHFFFAOYSA-N -1 3 282.727 2.674 20 10 CFCDHM COc1ccc(CN2CCC[C@H](C(C)=O)C2)c([O-])c1Cl ZINC001236807571 778946911 /nfs/dbraw/zinc/94/69/11/778946911.db2.gz QLPUKMNMMJGNPV-NSHDSACASA-N -1 3 297.782 2.855 20 10 CFCDHM [O-]c1ccc(Cl)c(Cl)c1CN1CC[C@H](F)[C@H](O)C1 ZINC001237078847 779003968 /nfs/dbraw/zinc/00/39/68/779003968.db2.gz YNZNHPVSZZCFFJ-GXSJLCMTSA-N -1 3 294.153 2.604 20 10 CFCDHM [O-]c1ccc(Cl)c(Cl)c1CN1CC[C@@H](CO)C1 ZINC001237080881 779006855 /nfs/dbraw/zinc/00/68/55/779006855.db2.gz GWZIENSICJOBAU-MRVPVSSYSA-N -1 3 276.163 2.513 20 10 CFCDHM CO[C@H](C)C1CN(Cc2c([O-])ccc(F)c2Cl)C1 ZINC001237128626 779021154 /nfs/dbraw/zinc/02/11/54/779021154.db2.gz SQBXYIIHVDISQF-MRVPVSSYSA-N -1 3 273.735 2.651 20 10 CFCDHM C[C@H]1CN(Cc2cc(F)ccc2[O-])C[C@@](C)(C(F)F)O1 ZINC000698929144 779103921 /nfs/dbraw/zinc/10/39/21/779103921.db2.gz PAFYMRWDOPWBNC-XPTSAGLGSA-N -1 3 289.297 2.776 20 10 CFCDHM C[C@H]1CCCN(Cc2cc(Cl)cc(F)c2[O-])[C@@H]1CO ZINC001237618398 779146105 /nfs/dbraw/zinc/14/61/05/779146105.db2.gz ZSLDZUHZBBYQLE-TVQRCGJNSA-N -1 3 287.762 2.778 20 10 CFCDHM Cc1cc([O-])c(CN2CC(F)C2)cc1Br ZINC001237678179 779159874 /nfs/dbraw/zinc/15/98/74/779159874.db2.gz VTHJDZXQANMLHG-UHFFFAOYSA-N -1 3 274.133 2.617 20 10 CFCDHM C[C@@H]1CC[C@@H](CO)CN1Cc1cc(F)cc(Cl)c1[O-] ZINC001237809198 779186007 /nfs/dbraw/zinc/18/60/07/779186007.db2.gz ZZKOMHMKXUBYKG-NXEZZACHSA-N -1 3 287.762 2.778 20 10 CFCDHM CC1(C)CN(Cc2ccc(F)c(F)c2[O-])CCCO1 ZINC000703532598 781026690 /nfs/dbraw/zinc/02/66/90/781026690.db2.gz UJXMXIJZHHOEFJ-UHFFFAOYSA-N -1 3 271.307 2.671 20 10 CFCDHM [O-]c1cccc(F)c1CN1CCC[C@H]1c1cnccn1 ZINC001137837459 781139862 /nfs/dbraw/zinc/13/98/62/781139862.db2.gz HWAKWHTWMXQDDO-AWEZNQCLSA-N -1 3 273.311 2.658 20 10 CFCDHM [O-]c1cccc(Br)c1CN1C[C@H]2CC[C@@H](C1)O2 ZINC000707140372 781223567 /nfs/dbraw/zinc/22/35/67/781223567.db2.gz PZEWGMQEPMZFNM-AOOOYVTPSA-N -1 3 298.180 2.518 20 10 CFCDHM COCC1(N(C)Cc2cc(Cl)cc(C(C)=O)c2[O-])CC1 ZINC000707178077 781229899 /nfs/dbraw/zinc/22/98/99/781229899.db2.gz CNIQIAUHFONZLP-UHFFFAOYSA-N -1 3 297.782 2.859 20 10 CFCDHM CC(=O)c1cc(F)cc(CN2CC[C@H](C(F)F)C2)c1[O-] ZINC000707174489 781230152 /nfs/dbraw/zinc/23/01/52/781230152.db2.gz ZMWHNCPDCJKWAX-VIFPVBQESA-N -1 3 287.281 2.821 20 10 CFCDHM CC1(C)CN(Cc2cc(F)cc(F)c2[O-])[C@@H]2COC[C@@H]21 ZINC000708399967 781273118 /nfs/dbraw/zinc/27/31/18/781273118.db2.gz MRYPJMGJZKHEHP-WCQYABFASA-N -1 3 283.318 2.527 20 10 CFCDHM CO[C@H]1CN(Cc2cc(F)cc(F)c2[O-])CC[C@H]1C ZINC000708413665 781274000 /nfs/dbraw/zinc/27/40/00/781274000.db2.gz MPSIQCXZRNABBI-RNCFNFMXSA-N -1 3 271.307 2.527 20 10 CFCDHM Cc1ccc(CNCc2cc(F)cc(F)c2[O-])nc1C ZINC000708455146 781275216 /nfs/dbraw/zinc/27/52/16/781275216.db2.gz UIFQCGFJMCAPAL-UHFFFAOYSA-N -1 3 278.302 2.972 20 10 CFCDHM Cc1noc(C)c1CNCc1cc(F)cc(F)c1[O-] ZINC000708494603 781291094 /nfs/dbraw/zinc/29/10/94/781291094.db2.gz MTXXMCCYEHGACE-UHFFFAOYSA-N -1 3 268.263 2.565 20 10 CFCDHM [O-]c1c(Cl)cc(Cl)cc1CN1CC[C@H](CO)C1 ZINC000092763976 347645753 /nfs/dbraw/zinc/64/57/53/347645753.db2.gz QLQVWPVVYUNNHF-QMMMGPOBSA-N -1 3 276.163 2.513 20 10 CFCDHM CCC1(CC)CN(Cc2ccc([N+](=O)[O-])c(OC)c2[O-])C1 ZINC000297386088 200171283 /nfs/dbraw/zinc/17/12/83/200171283.db2.gz IZPQIIACQKEAEK-UHFFFAOYSA-N -1 3 294.351 2.931 20 10 CFCDHM [O-]c1cccc(Cl)c1CNCc1nccn1C(F)F ZINC000113329577 376011727 /nfs/dbraw/zinc/01/17/27/376011727.db2.gz RBJQUAHSGYGMSD-UHFFFAOYSA-N -1 3 287.697 2.927 20 10 CFCDHM CC(=O)c1cc(Cl)cc(CN2CCC[C@@](C)(O)C2)c1[O-] ZINC000125040311 377113522 /nfs/dbraw/zinc/11/35/22/377113522.db2.gz DKNMCNXOOVSJDK-OAHLLOKOSA-N -1 3 297.782 2.595 20 10 CFCDHM Cc1c([C@H](C)NCc2cccc(Cl)c2[O-])cnn1C ZINC000124705960 377080585 /nfs/dbraw/zinc/08/05/85/377080585.db2.gz IJGWKRHKPRVFME-VIFPVBQESA-N -1 3 279.771 2.938 20 10 CFCDHM CCC1(C)CCN(C(=O)c2cccc(O)c2[O-])CC1 ZINC000126401719 377225381 /nfs/dbraw/zinc/22/53/81/377225381.db2.gz RDJGGFUZFKUOKH-UHFFFAOYSA-N -1 3 263.337 2.750 20 10 CFCDHM CCOC[C@@H]1CN(Cc2c([O-])cc(C)cc2Cl)CCO1 ZINC000529667411 383745761 /nfs/dbraw/zinc/74/57/61/383745761.db2.gz VFWYSIDUIBFLGQ-LBPRGKRZSA-N -1 3 299.798 2.591 20 10 CFCDHM CCC(CC)N(CCOC)C(=O)c1ccc(C)c(O)c1[O-] ZINC000179437189 380543305 /nfs/dbraw/zinc/54/33/05/380543305.db2.gz WMOKSJDHMSKHKK-UHFFFAOYSA-N -1 3 295.379 2.683 20 10 CFCDHM C[C@@]1(O)CCN(Cc2cc(Cl)cc(Cl)c2[O-])C1 ZINC000180192214 380629893 /nfs/dbraw/zinc/62/98/93/380629893.db2.gz RNMSRQANMIGNFX-GFCCVEGCSA-N -1 3 276.163 2.656 20 10 CFCDHM C[C@@H](NCc1nnc2n1CCCCC2)c1ccccc1[O-] ZINC000179877633 380591994 /nfs/dbraw/zinc/59/19/94/380591994.db2.gz YVXIZMHKMZZIRN-GFCCVEGCSA-N -1 3 286.379 2.561 20 10 CFCDHM CCN(Cc1ccccn1)Cc1cc(F)ccc1[O-] ZINC000180140016 380624527 /nfs/dbraw/zinc/62/45/27/380624527.db2.gz SVPAFNSABCLGLQ-UHFFFAOYSA-N -1 3 260.312 2.948 20 10 CFCDHM COc1cc(Cl)cc(CN2C[C@H](C)OC[C@H]2C)c1[O-] ZINC000184680868 381458033 /nfs/dbraw/zinc/45/80/33/381458033.db2.gz AZVVPABJUNCLMA-ZJUUUORDSA-N -1 3 285.771 2.663 20 10 CFCDHM COc1cc(Cl)cc(CN2CCOCC2(C)C)c1[O-] ZINC000184683278 381461615 /nfs/dbraw/zinc/46/16/15/381461615.db2.gz LZMRDMXFTDBRCJ-UHFFFAOYSA-N -1 3 285.771 2.665 20 10 CFCDHM COc1cc(Cl)cc(CN2CCOC[C@@H]2C2CC2)c1[O-] ZINC000184698514 381463646 /nfs/dbraw/zinc/46/36/46/381463646.db2.gz DEANAYCSBRNHLB-CYBMUJFWSA-N -1 3 297.782 2.665 20 10 CFCDHM O=C(c1cccc(O)c1[O-])N1CCC=C(c2ccco2)C1 ZINC000376026810 382117644 /nfs/dbraw/zinc/11/76/44/382117644.db2.gz UVCAVEHUKOXPIW-UHFFFAOYSA-N -1 3 285.299 2.620 20 10 CFCDHM Cc1nc([C@H]2CCCCN2Cc2cc(F)ccc2[O-])no1 ZINC000376169172 382123218 /nfs/dbraw/zinc/12/32/18/382123218.db2.gz ZTOZHILBNDPEOS-CYBMUJFWSA-N -1 3 291.326 2.950 20 10 CFCDHM Cc1cccc2c1OCC[C@H]2NC(=O)c1cccc(O)c1[O-] ZINC000375470545 382089000 /nfs/dbraw/zinc/08/90/00/382089000.db2.gz QCJMKJLCAKWNBR-CYBMUJFWSA-N -1 3 299.326 2.660 20 10 CFCDHM CS[C@H]1CCC[C@@H](NC(=O)c2cccc(O)c2[O-])C1 ZINC000187106169 382100672 /nfs/dbraw/zinc/10/06/72/382100672.db2.gz XOLRGMVGRUVXNQ-ZJUUUORDSA-N -1 3 281.377 2.502 20 10 CFCDHM [O-]c1ccc(F)cc1CN1C[C@H](CO)c2ccccc21 ZINC000293791457 382281359 /nfs/dbraw/zinc/28/13/59/382281359.db2.gz COBYUEBVDSHEES-GFCCVEGCSA-N -1 3 273.307 2.627 20 10 CFCDHM [O-]c1ccc(F)cc1CN[C@H](c1nc[nH]n1)c1ccccc1 ZINC000364320863 382305947 /nfs/dbraw/zinc/30/59/47/382305947.db2.gz AAPXLYLFTODVFH-HNNXBMFYSA-N -1 3 298.321 2.529 20 10 CFCDHM [O-]c1ccc(Cl)cc1CN1CCO[C@@H](C2CC2)C1 ZINC000364514651 382322579 /nfs/dbraw/zinc/32/25/79/382322579.db2.gz YTPCZMAIPYFYJP-CQSZACIVSA-N -1 3 267.756 2.656 20 10 CFCDHM Cn1ccnc1[C@@H]1N(Cc2cc(F)ccc2[O-])CC1(C)C ZINC000294860031 382534484 /nfs/dbraw/zinc/53/44/84/382534484.db2.gz TUNMJQBRPOTUGR-AWEZNQCLSA-N -1 3 289.354 2.848 20 10 CFCDHM Cc1ccc(C(=O)N2CCC(F)(F)C[C@@H]2C)c([O-])c1O ZINC000530011708 383763496 /nfs/dbraw/zinc/76/34/96/383763496.db2.gz NBWIKXMLNJTQEG-VIFPVBQESA-N -1 3 285.290 2.666 20 10 CFCDHM CN(C(=O)/C=C/c1cncc([O-])c1)c1ccc(F)c(F)c1 ZINC000181919453 393504019 /nfs/dbraw/zinc/50/40/19/393504019.db2.gz GIMHSJAEEIJBQN-GORDUTHDSA-N -1 3 290.269 2.742 20 10 CFCDHM C[C@@H](C(=O)N1CCCCCC1)N(C)Cc1ccccc1[O-] ZINC000109771307 393879740 /nfs/dbraw/zinc/87/97/40/393879740.db2.gz ARTCDLAODRWNFS-AWEZNQCLSA-N -1 3 290.407 2.615 20 10 CFCDHM CC[C@H](NCc1nnc2n1CCCC2)c1ccccc1[O-] ZINC000121099085 393947905 /nfs/dbraw/zinc/94/79/05/393947905.db2.gz HQALXSBCRPCCJP-ZDUSSCGKSA-N -1 3 286.379 2.561 20 10 CFCDHM O=C(/C=C/c1cncc([O-])c1)N1CCc2cccc(F)c21 ZINC000493262381 394193809 /nfs/dbraw/zinc/19/38/09/394193809.db2.gz DCTQVAKAMDERDL-SNAWJCMRSA-N -1 3 284.290 2.529 20 10 CFCDHM C[C@@H]1CCOCCN1Cc1cccc(Cl)c1[O-] ZINC000368130551 267146564 /nfs/dbraw/zinc/14/65/64/267146564.db2.gz CVDFAPZSOVETFH-SNVBAGLBSA-N -1 3 255.745 2.656 20 10 CFCDHM CC[C@H](c1ccccc1[O-])N1CCn2cncc2C1 ZINC000368215809 267152910 /nfs/dbraw/zinc/15/29/10/267152910.db2.gz OKIQKHXNODRTTM-CQSZACIVSA-N -1 3 257.337 2.556 20 10 CFCDHM Cc1c([C@H]2CCCN2Cc2cccc(F)c2[O-])cnn1C ZINC000368463299 267175100 /nfs/dbraw/zinc/17/51/00/267175100.db2.gz XZROENVSOBKGCG-OAHLLOKOSA-N -1 3 289.354 2.910 20 10 CFCDHM CC[C@H](N[C@@H]1CCCn2c(C)nnc21)c1ccccc1[O-] ZINC000369972373 267280325 /nfs/dbraw/zinc/28/03/25/267280325.db2.gz FMVJGPFLYCPZGF-UONOGXRCSA-N -1 3 286.379 2.868 20 10 CFCDHM CC[C@H](N[C@H](C)c1ncnn1C)c1cccc(Cl)c1[O-] ZINC000287310128 288083525 /nfs/dbraw/zinc/08/35/25/288083525.db2.gz CWXNONIJBHLRPK-SKDRFNHKSA-N -1 3 294.786 2.976 20 10 CFCDHM O=C(/C=C/c1cncc(F)c1)N1CCCc2cccc([O-])c21 ZINC000155607751 334725201 /nfs/dbraw/zinc/72/52/01/334725201.db2.gz PLASMZNYPFABNQ-VOTSOKGWSA-N -1 3 298.317 2.919 20 10 CFCDHM CCS[C@@H]1CCC[C@H]1NC(=O)c1cccc(O)c1[O-] ZINC000187165954 521726304 /nfs/dbraw/zinc/72/63/04/521726304.db2.gz ZRNJXPBYMDBBSR-ZYHUDNBSSA-N -1 3 281.377 2.502 20 10 CFCDHM CN(C)c1ccc(CN[C@H](C(=O)[O-])c2ccccc2)cc1 ZINC000050507906 522210848 /nfs/dbraw/zinc/21/08/48/522210848.db2.gz MRPQGJUFPVUIHF-INIZCTEOSA-N -1 3 284.359 2.668 20 10 CFCDHM CCc1nn(C)cc1NCc1c([O-])cccc1Cl ZINC000222945678 522700319 /nfs/dbraw/zinc/70/03/19/522700319.db2.gz RSMIRJNDDMVFEQ-UHFFFAOYSA-N -1 3 265.744 2.954 20 10 CFCDHM CC[C@H]1CCCCN1C(=O)CN(C)Cc1ccccc1[O-] ZINC000264577423 523000576 /nfs/dbraw/zinc/00/05/76/523000576.db2.gz BDIVYSNQARQMOI-HNNXBMFYSA-N -1 3 290.407 2.615 20 10 CFCDHM COC(=O)[C@@H](c1ccsc1)N(C)Cc1ccccc1[O-] ZINC000280125888 523660752 /nfs/dbraw/zinc/66/07/52/523660752.db2.gz VNYYVOOOQNJRMT-CQSZACIVSA-N -1 3 291.372 2.800 20 10 CFCDHM CO[C@@H]1CN(Cc2c([O-])cccc2Cl)CC[C@H]1C ZINC000276048008 523737484 /nfs/dbraw/zinc/73/74/84/523737484.db2.gz RLYRESLYSXSGLA-QMTHXVAHSA-N -1 3 269.772 2.902 20 10 CFCDHM Cc1cc(Cl)cc(CN2CCC[C@@](F)(CO)C2)c1[O-] ZINC000289678605 524865355 /nfs/dbraw/zinc/86/53/55/524865355.db2.gz DXMHLZVAFQKASP-AWEZNQCLSA-N -1 3 287.762 2.650 20 10 CFCDHM C[C@H](NCc1nccs1)c1ccc(F)cc1[O-] ZINC000062748086 525491454 /nfs/dbraw/zinc/49/14/54/525491454.db2.gz HKEUEROQRIYSMH-QMMMGPOBSA-N -1 3 252.314 2.839 20 10 CFCDHM Cc1ccc(C(=O)Nc2cc(C3CC3)ccn2)c([O-])c1O ZINC000291918435 526218119 /nfs/dbraw/zinc/21/81/19/526218119.db2.gz AUBZFCGQJMAGAO-UHFFFAOYSA-N -1 3 284.315 2.931 20 10 CFCDHM Cc1nnc([C@H](C)N[C@H](C)c2ccccc2[O-])s1 ZINC000274275157 526406231 /nfs/dbraw/zinc/40/62/31/526406231.db2.gz XKENSQJMEMLXIT-BDAKNGLRSA-N -1 3 263.366 2.964 20 10 CFCDHM CCOc1ccc(CN2CC(C)(C)OC[C@@H]2C)c([O-])c1 ZINC000754156730 574078877 /nfs/dbraw/zinc/07/88/77/574078877.db2.gz UDHIYIHZRAFNCO-LBPRGKRZSA-N -1 3 279.380 2.790 20 10 CFCDHM O=C(OCC(F)(F)C(F)F)c1cc([O-])cs1 ZINC000745001892 574096256 /nfs/dbraw/zinc/09/62/56/574096256.db2.gz FFKQUOSIBORCTB-UHFFFAOYSA-N -1 3 258.192 2.511 20 10 CFCDHM COc1ccc(NC(=O)c2cc([O-])cs2)c(OC)c1 ZINC000731864510 574130658 /nfs/dbraw/zinc/13/06/58/574130658.db2.gz YSOUKTLOFFUJDL-UHFFFAOYSA-N -1 3 279.317 2.723 20 10 CFCDHM O=C(NCCSc1ccccc1)c1cc([O-])cs1 ZINC000731864441 574130756 /nfs/dbraw/zinc/13/07/56/574130756.db2.gz VFOUPNCRKHPPDO-UHFFFAOYSA-N -1 3 279.386 2.976 20 10 CFCDHM O=C(NCCCc1ccccc1)c1cc([O-])cs1 ZINC000731861952 574130840 /nfs/dbraw/zinc/13/08/40/574130840.db2.gz UOWHLHAKVJILLA-UHFFFAOYSA-N -1 3 261.346 2.816 20 10 CFCDHM O=C(Nc1ccc2oc(=O)ccc2c1)c1cc([O-])cs1 ZINC000731870522 574131482 /nfs/dbraw/zinc/13/14/82/574131482.db2.gz OOKXHIZGEBKXHD-UHFFFAOYSA-N -1 3 287.296 2.812 20 10 CFCDHM C[C@H](NC(=O)c1cc([O-])cs1)c1ccc2c(c1)OCO2 ZINC000731869310 574132914 /nfs/dbraw/zinc/13/29/14/574132914.db2.gz PMPYOIPBOXNKHU-QMMMGPOBSA-N -1 3 291.328 2.673 20 10 CFCDHM COc1cccc(COC(=O)c2cc([O-])cs2)c1 ZINC000731909642 574133188 /nfs/dbraw/zinc/13/31/88/574133188.db2.gz HNIDFSOSFZYBTH-UHFFFAOYSA-N -1 3 264.302 2.819 20 10 CFCDHM Cc1cccn2cc(COC(=O)c3cc([O-])cs3)nc12 ZINC000731909249 574133235 /nfs/dbraw/zinc/13/32/35/574133235.db2.gz DSLMBHIAJBMOEJ-UHFFFAOYSA-N -1 3 288.328 2.767 20 10 CFCDHM O=C(OCCOc1ccccc1)c1cc([O-])cs1 ZINC000731909639 574133238 /nfs/dbraw/zinc/13/32/38/574133238.db2.gz HJNMNKMESORXLL-UHFFFAOYSA-N -1 3 264.302 2.690 20 10 CFCDHM Cc1cc(C(=O)CN(C)Cc2ccccc2[O-])c(C)n1C ZINC000732202878 574146348 /nfs/dbraw/zinc/14/63/48/574146348.db2.gz HMEOEIPZHGEICQ-UHFFFAOYSA-N -1 3 286.375 2.662 20 10 CFCDHM O=C(Nc1ccc2c(c1)CCO2)c1cc([O-])cs1 ZINC000732267828 574148273 /nfs/dbraw/zinc/14/82/73/574148273.db2.gz YJHUMPODOOXFOM-UHFFFAOYSA-N -1 3 261.302 2.641 20 10 CFCDHM C[C@@H](COc1ccccc1)NC(=O)c1cc([O-])cs1 ZINC000732273497 574148362 /nfs/dbraw/zinc/14/83/62/574148362.db2.gz BEVLDWIKNXDHGC-JTQLQIEISA-N -1 3 277.345 2.651 20 10 CFCDHM O=C(NC[C@@H]1Cc2ccccc21)c1cc([O-])cs1 ZINC000732273748 574148426 /nfs/dbraw/zinc/14/84/26/574148426.db2.gz BIERDXQJWIPMPK-JTQLQIEISA-N -1 3 259.330 2.523 20 10 CFCDHM CCO[C@@H](CCNC(=O)c1cc([O-])cs1)C(C)C ZINC000746409603 574148637 /nfs/dbraw/zinc/14/86/37/574148637.db2.gz HWXONKROTZDFKA-NSHDSACASA-N -1 3 271.382 2.635 20 10 CFCDHM Cc1occc1CN(C)C(=O)c1cc([O-])cs1 ZINC000732275707 574149590 /nfs/dbraw/zinc/14/95/90/574149590.db2.gz IUUJBIFEQGWZIQ-UHFFFAOYSA-N -1 3 251.307 2.627 20 10 CFCDHM COC[C@@H](NC(=O)c1cc([O-])cs1)c1ccccc1 ZINC000732284193 574150014 /nfs/dbraw/zinc/15/00/14/574150014.db2.gz NQUNIHWBBQWZJZ-GFCCVEGCSA-N -1 3 277.345 2.571 20 10 CFCDHM O=C(N[C@@H]1[C@@H]2CCO[C@H]2C12CCCC2)c1cc([O-])cs1 ZINC000755297403 574152834 /nfs/dbraw/zinc/15/28/34/574152834.db2.gz SJEVQKPOGJBFIP-CYZMBNFOSA-N -1 3 293.388 2.531 20 10 CFCDHM O=C(OCCOc1ccc(F)cc1)c1cc([O-])cs1 ZINC000732353968 574153184 /nfs/dbraw/zinc/15/31/84/574153184.db2.gz XJEGXHQFSIRVDV-UHFFFAOYSA-N -1 3 282.292 2.829 20 10 CFCDHM C[C@@H](NC(=O)c1cc([O-])cs1)[C@@H]1COc2ccccc21 ZINC000755308400 574153336 /nfs/dbraw/zinc/15/33/36/574153336.db2.gz YRCJFNJKQXSPJU-SKDRFNHKSA-N -1 3 289.356 2.748 20 10 CFCDHM COC1CN(Cc2c3c(ccc2[O-])oc2c3CCCC2)C1 ZINC000738225268 574160660 /nfs/dbraw/zinc/16/06/60/574160660.db2.gz LHVKTSQZOKSGJG-UHFFFAOYSA-N -1 3 287.359 2.848 20 10 CFCDHM O=C([O-])C[C@@H]1CCCC[N@@H+]1Cc1cc2c(cc1[O-])CCC2 ZINC000739639448 574221506 /nfs/dbraw/zinc/22/15/06/574221506.db2.gz MPUZQHFYADCVHG-HNNXBMFYSA-N -1 3 289.375 2.710 20 10 CFCDHM O=C([O-])C[C@@H]1CCCC[N@H+]1Cc1cc2c(cc1[O-])CCC2 ZINC000739639448 574221508 /nfs/dbraw/zinc/22/15/08/574221508.db2.gz MPUZQHFYADCVHG-HNNXBMFYSA-N -1 3 289.375 2.710 20 10 CFCDHM C[C@H](NCc1cccnc1)c1cc([N+](=O)[O-])ccc1[O-] ZINC000756345112 574227222 /nfs/dbraw/zinc/22/72/22/574227222.db2.gz VUHGZEXPFKFZFE-JTQLQIEISA-N -1 3 273.292 2.546 20 10 CFCDHM COc1ccc(CN[C@@H](C)c2cc(F)cc(F)c2[O-])cn1 ZINC000756381074 574231314 /nfs/dbraw/zinc/23/13/14/574231314.db2.gz JUDZMXNMNBAPDI-VIFPVBQESA-N -1 3 294.301 2.925 20 10 CFCDHM C[C@@H](NCc1ccccc1CO)c1ccc(F)cc1[O-] ZINC000756456130 574238994 /nfs/dbraw/zinc/23/89/94/574238994.db2.gz GIYYBOYZKXLYMY-LLVKDONJSA-N -1 3 275.323 2.874 20 10 CFCDHM C[C@@H](NCc1ccon1)c1cc(Cl)ccc1[O-] ZINC000756637078 574254103 /nfs/dbraw/zinc/25/41/03/574254103.db2.gz LWOGUARDCDMGKQ-MRVPVSSYSA-N -1 3 252.701 2.884 20 10 CFCDHM C[C@@H]1C[C@@H](NCc2cocn2)c2c1c(F)ccc2[O-] ZINC000756829783 574266170 /nfs/dbraw/zinc/26/61/70/574266170.db2.gz BUWXNLAKTVCURM-LDYMZIIASA-N -1 3 262.284 2.857 20 10 CFCDHM C[C@H](NCc1cc([N+](=O)[O-])ccc1[O-])c1ccccn1 ZINC000725849777 574330949 /nfs/dbraw/zinc/33/09/49/574330949.db2.gz XNECYDJAGVBYOZ-JTQLQIEISA-N -1 3 273.292 2.546 20 10 CFCDHM Cc1cccc(F)c1CNC(=O)c1cc([O-])cs1 ZINC000743721729 574371292 /nfs/dbraw/zinc/37/12/92/574371292.db2.gz KOGOHUJGFLHCSF-UHFFFAOYSA-N -1 3 265.309 2.831 20 10 CFCDHM O=C(c1cc([O-])cs1)N1CCC(C2CCOCC2)CC1 ZINC000752657907 574393511 /nfs/dbraw/zinc/39/35/11/574393511.db2.gz GNNGPZNWYXANON-UHFFFAOYSA-N -1 3 295.404 2.733 20 10 CFCDHM CS[C@@H](CNC(=O)c1cc([O-])cs1)C(C)(C)C ZINC000753473843 574402864 /nfs/dbraw/zinc/40/28/64/574402864.db2.gz MGNZLSOOFTTXOL-JTQLQIEISA-N -1 3 273.423 2.961 20 10 CFCDHM O=C([O-])C1CC[NH+](Cc2c([O-])ccc3ccccc32)CC1 ZINC000086727279 596913185 /nfs/dbraw/zinc/91/31/85/596913185.db2.gz XLFJDWCKYRYIQY-UHFFFAOYSA-N -1 3 285.343 2.842 20 10 CFCDHM C[C@@H]([NH2+]Cc1ccc(C(=O)[O-])cc1)c1ccccc1[O-] ZINC000820141612 598173874 /nfs/dbraw/zinc/17/38/74/598173874.db2.gz FNVZYNATULKGEN-LLVKDONJSA-N -1 3 271.316 2.941 20 10 CFCDHM CC[C@@]1(C(=O)[O-])CCC[N@H+](Cc2cc(F)ccc2[O-])C1 ZINC000233984564 617664200 /nfs/dbraw/zinc/66/42/00/617664200.db2.gz VAQYCTHOOVYLKH-OAHLLOKOSA-N -1 3 281.327 2.608 20 10 CFCDHM CC[C@@]1(C(=O)[O-])CCC[N@@H+](Cc2cc(F)ccc2[O-])C1 ZINC000233984564 617664204 /nfs/dbraw/zinc/66/42/04/617664204.db2.gz VAQYCTHOOVYLKH-OAHLLOKOSA-N -1 3 281.327 2.608 20 10 CFCDHM CCn1cc(CNCc2cc(Cl)cc(F)c2[O-])cn1 ZINC000776208665 618425031 /nfs/dbraw/zinc/42/50/31/618425031.db2.gz JGZFXXLZLCZRRF-UHFFFAOYSA-N -1 3 283.734 2.691 20 10 CFCDHM Cc1ccc(C(=O)Nc2ccccc2C)c([O-])c1O ZINC000177658929 618466208 /nfs/dbraw/zinc/46/62/08/618466208.db2.gz ATTICTFKPWVNAN-UHFFFAOYSA-N -1 3 257.289 2.967 20 10 CFCDHM Cc1ccc(NC(=O)c2ccc(C)c(O)c2[O-])c(O)c1 ZINC000177664256 618469603 /nfs/dbraw/zinc/46/96/03/618469603.db2.gz YRNHIXGXCAPGNW-UHFFFAOYSA-N -1 3 273.288 2.673 20 10 CFCDHM [O-]c1cccc(Br)c1CN1CC[C@H]1C(F)F ZINC000895431849 618579457 /nfs/dbraw/zinc/57/94/57/618579457.db2.gz QTXSXOMDTHBWLZ-VIFPVBQESA-N -1 3 292.123 2.994 20 10 CFCDHM O=C([O-])CCC1CC[NH+](Cc2cc(F)ccc2[O-])CC1 ZINC000236418229 618622246 /nfs/dbraw/zinc/62/22/46/618622246.db2.gz WMEAPWAOAWPEAQ-UHFFFAOYSA-N -1 3 281.327 2.608 20 10 CFCDHM Cc1ccc(C(=O)Nc2cnn(C(C)(C)C)c2)c([O-])c1O ZINC000182247071 618892318 /nfs/dbraw/zinc/89/23/18/618892318.db2.gz YOJSEDFNVJPEAD-UHFFFAOYSA-N -1 3 289.335 2.610 20 10 CFCDHM CCc1ccc(O)c(NC(=O)c2ccc(C)c(O)c2[O-])c1 ZINC000182939768 618902020 /nfs/dbraw/zinc/90/20/20/618902020.db2.gz BMEMUIRVQDQLMG-UHFFFAOYSA-N -1 3 287.315 2.927 20 10 CFCDHM [O-]c1ccc(F)cc1CN1CC(F)(F)C(F)(F)C1 ZINC000313294704 618980067 /nfs/dbraw/zinc/98/00/67/618980067.db2.gz OIIUDPCIYMMXOV-UHFFFAOYSA-N -1 3 267.197 2.618 20 10 CFCDHM Cc1nc(C)c(C)c(NCc2c([O-])cccc2F)n1 ZINC000895832621 619619403 /nfs/dbraw/zinc/61/94/03/619619403.db2.gz JBPHFIQDSXUKID-UHFFFAOYSA-N -1 3 261.300 2.859 20 10 CFCDHM [O-]c1cccc(F)c1CNc1nc(C2CC2)ns1 ZINC000895833508 619619888 /nfs/dbraw/zinc/61/98/88/619619888.db2.gz YRXSVJVSWQBWSQ-UHFFFAOYSA-N -1 3 265.313 2.872 20 10 CFCDHM Cc1ccc(NC(=O)c2ccc(C)c(O)c2[O-])c(C)c1O ZINC000182620740 625360823 /nfs/dbraw/zinc/36/08/23/625360823.db2.gz QEYBJTOSGWZDSW-UHFFFAOYSA-N -1 3 287.315 2.981 20 10 CFCDHM CCc1cnc(CNCc2c([O-])cccc2F)s1 ZINC000896636232 619779967 /nfs/dbraw/zinc/77/99/67/619779967.db2.gz BAFJBLKJJXMGMF-UHFFFAOYSA-N -1 3 266.341 2.840 20 10 CFCDHM CC(C)n1ccnc1CNCc1c([O-])cccc1F ZINC000896639494 619781794 /nfs/dbraw/zinc/78/17/94/619781794.db2.gz VHTWDWLEFVSOIC-UHFFFAOYSA-N -1 3 263.316 2.599 20 10 CFCDHM Cc1ncc(CNCc2c([O-])cccc2F)s1 ZINC000896641347 619782084 /nfs/dbraw/zinc/78/20/84/619782084.db2.gz QRZSBDQVFNBMFY-UHFFFAOYSA-N -1 3 252.314 2.586 20 10 CFCDHM C[C@H]1CC[C@@H](C(=O)NCc2c([O-])cccc2F)C1 ZINC000928709213 619996408 /nfs/dbraw/zinc/99/64/08/619996408.db2.gz YUHDYDPWTYNRKG-VHSXEESVSA-N -1 3 251.301 2.584 20 10 CFCDHM CC1(C)CO[C@H](CCC(=O)NCc2c([O-])cccc2F)C1 ZINC000928711897 619997142 /nfs/dbraw/zinc/99/71/42/619997142.db2.gz VJVRLJYNEJLSPV-LLVKDONJSA-N -1 3 295.354 2.743 20 10 CFCDHM [O-]c1c(F)cc(F)cc1CN1CC(Cc2ccoc2)C1 ZINC000898160195 620340487 /nfs/dbraw/zinc/34/04/87/620340487.db2.gz VBJKCAKTYPXZDP-UHFFFAOYSA-N -1 3 279.286 2.938 20 10 CFCDHM Cn1cc(CNCc2cccc(Cl)c2[O-])c(Cl)n1 ZINC000898216263 620346561 /nfs/dbraw/zinc/34/65/61/620346561.db2.gz WQCGQHJBHSVYMI-UHFFFAOYSA-N -1 3 286.162 2.722 20 10 CFCDHM C[C@H](NCc1cn(C)cn1)c1cccc(C(F)(F)F)c1[O-] ZINC000903351368 621343115 /nfs/dbraw/zinc/34/31/15/621343115.db2.gz KELXCVOPBPITHV-VIFPVBQESA-N -1 3 299.296 2.995 20 10 CFCDHM O=C(NCc1c([O-])cccc1F)NCC1(CC2CC2)CC1 ZINC000923998394 623533262 /nfs/dbraw/zinc/53/32/62/623533262.db2.gz SYXLGZGWBDUKNO-UHFFFAOYSA-N -1 3 292.354 2.911 20 10 CFCDHM [O-]c1cc(Br)ccc1CN1CC=CCC1 ZINC000825445665 623695858 /nfs/dbraw/zinc/69/58/58/623695858.db2.gz BTDPOQKWPARWAE-UHFFFAOYSA-N -1 3 268.154 2.917 20 10 CFCDHM Cc1cc([O-])c(CN2CCO[C@H](C3CC3)C2)cc1Cl ZINC000825548501 623713660 /nfs/dbraw/zinc/71/36/60/623713660.db2.gz HIHBLVNKCWGDHB-HNNXBMFYSA-N -1 3 281.783 2.965 20 10 CFCDHM Cc1cc([O-])c(CN2CC(F)(F)C[C@H]2CO)cc1Cl ZINC000825622308 623725421 /nfs/dbraw/zinc/72/54/21/623725421.db2.gz SVXFPYWTSCHMGT-JTQLQIEISA-N -1 3 291.725 2.556 20 10 CFCDHM Cc1cc([O-])c(CN2CCOCC23CC3)cc1Cl ZINC000825804160 623755566 /nfs/dbraw/zinc/75/55/66/623755566.db2.gz VXOIFVYTXYQWSD-UHFFFAOYSA-N -1 3 267.756 2.719 20 10 CFCDHM O=C(NCc1c([O-])cccc1F)[C@H]1CC[C@@H]2C[C@@H]2CC1 ZINC000830180015 624659659 /nfs/dbraw/zinc/65/96/59/624659659.db2.gz GAYBZFKOYPUDBJ-ZSBIGDGJSA-N -1 3 277.339 2.974 20 10 CFCDHM O=C(NCc1c([O-])cccc1F)OCCC(F)(F)F ZINC000921451587 624894272 /nfs/dbraw/zinc/89/42/72/624894272.db2.gz SJNXYEFSMIEYID-UHFFFAOYSA-N -1 3 281.205 2.710 20 10 CFCDHM CC(C)c1nnc(CN[C@H](C)c2cc(F)cc(F)c2[O-])[nH]1 ZINC000834873292 625905915 /nfs/dbraw/zinc/90/59/15/625905915.db2.gz XOTDBTRJYCPQRF-MRVPVSSYSA-N -1 3 296.321 2.763 20 10 CFCDHM C[C@@H]1CC[C@@H](NC(=O)NCc2c([O-])cccc2F)C1 ZINC000922111993 626210223 /nfs/dbraw/zinc/21/02/23/626210223.db2.gz BTHRYKCNKGGYMX-NXEZZACHSA-N -1 3 266.316 2.519 20 10 CFCDHM C[C@H]1CCC[C@H](C)N(C(=O)c2cccc(O)c2[O-])C1 ZINC000187128476 626459829 /nfs/dbraw/zinc/45/98/29/626459829.db2.gz NERXSJSLHIPYPS-QWRGUYRKSA-N -1 3 263.337 2.749 20 10 CFCDHM CC[C@H](NC(=O)NCc1c([O-])cccc1F)C1CC1 ZINC000923300459 626463836 /nfs/dbraw/zinc/46/38/36/626463836.db2.gz SMDNGLFNVBUYDG-LBPRGKRZSA-N -1 3 266.316 2.519 20 10 CFCDHM O=C(NCc1c([O-])cccc1F)N[C@H]1CCCC12CC2 ZINC000923508677 626478032 /nfs/dbraw/zinc/47/80/32/626478032.db2.gz LYEICNTYCGTAOG-ZDUSSCGKSA-N -1 3 278.327 2.663 20 10 CFCDHM [O-]c1c(F)cc(Cl)cc1CN1CC2(C1)CCOCC2 ZINC000839141753 626528527 /nfs/dbraw/zinc/52/85/27/626528527.db2.gz YOMPVCGAWPFCMZ-UHFFFAOYSA-N -1 3 285.746 2.797 20 10 CFCDHM COc1c([O-])c(CN(C)c2ccccc2)ccc1[N+](=O)[O-] ZINC000774822441 627967812 /nfs/dbraw/zinc/96/78/12/627967812.db2.gz XCYLOWNBYQSKAI-UHFFFAOYSA-N -1 3 288.303 2.945 20 10 CFCDHM C[C@@H](O)C1CCN(Cc2cc(Cl)cc(F)c2[O-])CC1 ZINC000775675086 628053055 /nfs/dbraw/zinc/05/30/55/628053055.db2.gz SBGURACEPCYCOI-SECBINFHSA-N -1 3 287.762 2.778 20 10 CFCDHM C[C@H]1CN(Cc2cc(Cl)cc(F)c2[O-])CCCO1 ZINC000775679362 628054275 /nfs/dbraw/zinc/05/42/75/628054275.db2.gz YKHDPFQWGIJRRR-VIFPVBQESA-N -1 3 273.735 2.796 20 10 CFCDHM [O-]c1c(Cl)cccc1CNCc1ccc(F)cn1 ZINC000776251369 628122098 /nfs/dbraw/zinc/12/20/98/628122098.db2.gz CZEWTHFENHUCPQ-UHFFFAOYSA-N -1 3 266.703 2.870 20 10 CFCDHM CC(=O)c1cc(F)cc(CN2C[C@H](C)O[C@@H](C)[C@@H]2C)c1[O-] ZINC000782633422 628650946 /nfs/dbraw/zinc/65/09/46/628650946.db2.gz HIVGSEKMKJUTNY-NHCYSSNCSA-N -1 3 295.354 2.732 20 10 CFCDHM O=C(NCCCCc1ccccc1)c1cccc(O)c1[O-] ZINC000790485669 629242847 /nfs/dbraw/zinc/24/28/47/629242847.db2.gz ILDZFMRKDVBUSL-UHFFFAOYSA-N -1 3 285.343 2.851 20 10 CFCDHM O=C(NCc1c(F)cccc1Cl)c1cccc(O)c1[O-] ZINC000790527851 629245363 /nfs/dbraw/zinc/24/53/63/629245363.db2.gz MBVXIFFPFHADTJ-UHFFFAOYSA-N -1 3 295.697 2.820 20 10 CFCDHM C[C@H]1C[C@H]1c1ccc(CNC(=O)c2cccc(O)c2[O-])o1 ZINC000790554485 629247339 /nfs/dbraw/zinc/24/73/39/629247339.db2.gz OCGAYKCULJYIRJ-JOYOIKCWSA-N -1 3 287.315 2.744 20 10 CFCDHM O=C(NCCCc1ccccc1F)c1cccc(O)c1[O-] ZINC000794263744 629628192 /nfs/dbraw/zinc/62/81/92/629628192.db2.gz OPNUHTUVEZNWNV-UHFFFAOYSA-N -1 3 289.306 2.600 20 10 CFCDHM CC[C@@H](NCc1nnc(C)s1)c1ccc(F)cc1[O-] ZINC000796930207 629989888 /nfs/dbraw/zinc/98/98/88/629989888.db2.gz CZQMMGSJHSZGPP-LLVKDONJSA-N -1 3 281.356 2.932 20 10 CFCDHM Cc1cc(=O)[n-]c(C=Cc2ccc3c(c2)CCN3C)n1 ZINC000806574767 630815100 /nfs/dbraw/zinc/81/51/00/630815100.db2.gz VWPAIHDNUSPVAM-XQRVVYSFSA-N -1 3 267.332 2.653 20 10 CFCDHM Cc1cc(=O)[n-]c(C=Cc2ccc(N(C)C)c(F)c2)n1 ZINC000806574223 630815184 /nfs/dbraw/zinc/81/51/84/630815184.db2.gz ICZSLAALMTWXDS-FNORWQNLSA-N -1 3 273.311 2.866 20 10 CFCDHM Cc1cc([O-])c(CNCc2cocn2)c(Cl)c1 ZINC000840895737 631254547 /nfs/dbraw/zinc/25/45/47/631254547.db2.gz UWKOLSQYOLABEJ-UHFFFAOYSA-N -1 3 252.701 2.632 20 10 CFCDHM CCCN(CC(=O)N(C)C)Cc1c([O-])cc(C)cc1Cl ZINC000840911930 631260962 /nfs/dbraw/zinc/26/09/62/631260962.db2.gz UWDKFMRYSGGQOK-UHFFFAOYSA-N -1 3 298.814 2.654 20 10 CFCDHM CCn1ncnc1CN[C@H](C)c1ccc(Cl)cc1[O-] ZINC000841753511 631466705 /nfs/dbraw/zinc/46/67/05/631466705.db2.gz UXXRHLINFIJJBH-SECBINFHSA-N -1 3 280.759 2.508 20 10 CFCDHM COc1cc(F)c(F)cc1NC(=O)c1cccc(O)c1[O-] ZINC000811606056 631585866 /nfs/dbraw/zinc/58/58/66/631585866.db2.gz WWFKNOLPTAPURB-UHFFFAOYSA-N -1 3 295.241 2.637 20 10 CFCDHM CC(=O)c1cc(O)ccc1[N-]S(=O)(=O)CCC(C)(C)C ZINC000811695606 631608232 /nfs/dbraw/zinc/60/82/32/631608232.db2.gz BDHRGJPLFNHSHF-UHFFFAOYSA-N -1 3 299.392 2.773 20 10 CFCDHM CC1(C2CC2)CCN(C(=O)c2cccc(O)c2[O-])CC1 ZINC000812273969 631683811 /nfs/dbraw/zinc/68/38/11/631683811.db2.gz PJTHBXDKJOTROB-UHFFFAOYSA-N -1 3 275.348 2.750 20 10 CFCDHM Cc1cc(Cl)cc(C[N@H+]2CC[C@@H](C)[C@H](C(=O)[O-])C2)c1[O-] ZINC000843039085 631809506 /nfs/dbraw/zinc/80/95/06/631809506.db2.gz ANISFBVENDLRRW-NOZJJQNGSA-N -1 3 297.782 2.897 20 10 CFCDHM Cc1cc(Cl)cc(C[N@@H+]2CC[C@@H](C)[C@H](C(=O)[O-])C2)c1[O-] ZINC000843039085 631809509 /nfs/dbraw/zinc/80/95/09/631809509.db2.gz ANISFBVENDLRRW-NOZJJQNGSA-N -1 3 297.782 2.897 20 10 CFCDHM CC[C@H](C)C[C@@H](NCc1cc(F)ccc1[O-])C(=O)OC ZINC000843415340 631948111 /nfs/dbraw/zinc/94/81/11/631948111.db2.gz KFNKUXVIBKFHFO-GXFFZTMASA-N -1 3 283.343 2.599 20 10 CFCDHM CC(C)n1cnnc1CN(C)Cc1cc(Cl)ccc1[O-] ZINC000814179714 632024518 /nfs/dbraw/zinc/02/45/18/632024518.db2.gz XPBIDCUOYUJXEE-UHFFFAOYSA-N -1 3 294.786 2.850 20 10 CFCDHM O=C(c1cccc(O)c1[O-])N1CCC[C@H](c2ccncc2)C1 ZINC000844143906 632125850 /nfs/dbraw/zinc/12/58/50/632125850.db2.gz YOISHGJKCBYPJI-ZDUSSCGKSA-N -1 3 298.342 2.513 20 10 CFCDHM C[C@H](NCc1nccn1C)c1cccc(C(F)(F)F)c1[O-] ZINC000815574998 632290341 /nfs/dbraw/zinc/29/03/41/632290341.db2.gz HWHRXQQPDXHTDH-VIFPVBQESA-N -1 3 299.296 2.995 20 10 CFCDHM C[C@@H](NCc1ccn(C)n1)c1cccc(C(F)(F)F)c1[O-] ZINC000815599423 632295617 /nfs/dbraw/zinc/29/56/17/632295617.db2.gz SQXIWYGTXVVKBQ-SECBINFHSA-N -1 3 299.296 2.995 20 10 CFCDHM [O-]c1cc(F)c(Cl)cc1CN1CC[C@H](OC(F)F)C1 ZINC000816601047 632493096 /nfs/dbraw/zinc/49/30/96/632493096.db2.gz PQYQHKSGPUCTLJ-QMMMGPOBSA-N -1 3 295.688 2.998 20 10 CFCDHM [O-]c1c(F)cc(Cl)cc1CN1CCC[C@H](O)CC1 ZINC000816667674 632510173 /nfs/dbraw/zinc/51/01/73/632510173.db2.gz UBHOVZFEASJCRC-NSHDSACASA-N -1 3 273.735 2.532 20 10 CFCDHM CC(=O)c1ccc(C(=O)N(C)Cc2ccccc2O)cc1[O-] ZINC000816889453 632531264 /nfs/dbraw/zinc/53/12/64/632531264.db2.gz YPZBFZWOCQBAAO-UHFFFAOYSA-N -1 3 299.326 2.573 20 10 CFCDHM C[C@@]1(CCNC(=O)c2cccc(O)c2[O-])C[C@]1(F)Cl ZINC000846413022 632707236 /nfs/dbraw/zinc/70/72/36/632707236.db2.gz SFUIBNSXRSLAHD-CHWSQXEVSA-N -1 3 287.718 2.532 20 10 CFCDHM C[C@@H](NCC(F)(F)CN)c1ccc2ccccc2c1[O-] ZINC000817965775 632763902 /nfs/dbraw/zinc/76/39/02/632763902.db2.gz CHYAGVYKWWADNJ-SNVBAGLBSA-N -1 3 280.318 2.790 20 10 CFCDHM CCCCN1CC(=O)N[C@@H]1c1cc(Cl)c(C)cc1[O-] ZINC000849183295 633580122 /nfs/dbraw/zinc/58/01/22/633580122.db2.gz RBZCNZMUJIWJCW-AWEZNQCLSA-N -1 3 282.771 2.585 20 10 CFCDHM Cc1cc([O-])c(CN2CCO[C@H](CCF)C2)c(Cl)c1 ZINC000862529111 637407533 /nfs/dbraw/zinc/40/75/33/637407533.db2.gz BBHHZFNXZUNWHQ-LLVKDONJSA-N -1 3 287.762 2.914 20 10 CFCDHM C/C=C\C[C@H]1CCCN(C(=O)c2cccc(O)c2[O-])C1 ZINC000863817375 637788536 /nfs/dbraw/zinc/78/85/36/637788536.db2.gz KPPJJFKGTBMMAZ-DLGQBQFBSA-N -1 3 275.348 2.916 20 10 CFCDHM CC1(F)CCN(Cc2ccc(F)c(F)c2[O-])CC1 ZINC000864050290 637843770 /nfs/dbraw/zinc/84/37/70/637843770.db2.gz BQZJBBPZOFCGRM-UHFFFAOYSA-N -1 3 259.271 2.994 20 10 CFCDHM Cc1ccc(S(=O)(=O)[N-]c2ccc(O)cc2)cc1F ZINC000194107701 650718163 /nfs/dbraw/zinc/71/81/63/650718163.db2.gz VFFSBXMMRLPAKF-UHFFFAOYSA-N -1 3 281.308 2.641 20 10 CFCDHM O=C(Nc1ccccc1OC(F)F)c1cccc(O)c1[O-] ZINC000126244196 643076657 /nfs/dbraw/zinc/07/66/57/643076657.db2.gz KXDDANNLJUEYCM-UHFFFAOYSA-N -1 3 295.241 2.952 20 10 CFCDHM Cc1ccccc1CN(C)C(=O)c1cccc(O)c1[O-] ZINC000126280174 643089618 /nfs/dbraw/zinc/08/96/18/643089618.db2.gz QKGMNMWTSQDBFT-UHFFFAOYSA-N -1 3 271.316 2.678 20 10 CFCDHM C[C@H](CCc1ccccc1)NC(=O)c1cccc(O)c1[O-] ZINC000126351249 643155352 /nfs/dbraw/zinc/15/53/52/643155352.db2.gz YMDMBZYTKKUUJE-GFCCVEGCSA-N -1 3 285.343 2.849 20 10 CFCDHM O=C(c1cccc(O)c1[O-])N1CCC[C@@H]2CCC[C@H]21 ZINC000126454453 643231151 /nfs/dbraw/zinc/23/11/51/643231151.db2.gz FHWKVVJYHLPHLW-CMPLNLGQSA-N -1 3 261.321 2.503 20 10 CFCDHM COc1c([O-])c(CNCc2ccc(C)o2)ccc1[N+](=O)[O-] ZINC000877698803 643461837 /nfs/dbraw/zinc/46/18/37/643461837.db2.gz YZOYKYIBNQCELC-UHFFFAOYSA-N -1 3 292.291 2.500 20 10 CFCDHM O=C(c1cccc(O)c1[O-])N1C[C@H](C2CC2)C[C@@H]1C1CC1 ZINC000885222432 646640780 /nfs/dbraw/zinc/64/07/80/646640780.db2.gz BQWOVFHNGGHFIR-TZMCWYRMSA-N -1 3 287.359 2.749 20 10 CFCDHM Cc1nnsc1CN[C@@H](C)c1c([O-])cccc1F ZINC000886613731 647068159 /nfs/dbraw/zinc/06/81/59/647068159.db2.gz CXFWHJLZRONGCQ-QMMMGPOBSA-N -1 3 267.329 2.542 20 10 CFCDHM O=C(c1cccc(O)c1[O-])N1CC[C@H]1C1CCCC1 ZINC000889404798 647562505 /nfs/dbraw/zinc/56/25/05/647562505.db2.gz BOVZYIFJSKCOEJ-LBPRGKRZSA-N -1 3 261.321 2.503 20 10 CFCDHM CC(C)(C(=O)NCc1c([O-])cccc1F)C(C)(F)F ZINC000928705053 648943955 /nfs/dbraw/zinc/94/39/55/648943955.db2.gz CWCGKXUOAJDIQN-UHFFFAOYSA-N -1 3 275.270 2.829 20 10 CFCDHM O=C(NCc1c([O-])cccc1F)C1CCC(F)(F)CC1 ZINC000928705207 648944176 /nfs/dbraw/zinc/94/41/76/648944176.db2.gz HLRWBYBURKTQGG-UHFFFAOYSA-N -1 3 287.281 2.973 20 10 CFCDHM C[C@@H]1CC/C(=C\C(=O)NCc2c([O-])cccc2F)C1 ZINC000928705497 648944695 /nfs/dbraw/zinc/94/46/95/648944695.db2.gz KPVDPLXTZWQIKK-MXBGMFSPSA-N -1 3 263.312 2.894 20 10 CFCDHM CC(=O)[C@@H](C)CCCCC(=O)NCc1c([O-])cccc1F ZINC000928706141 648944898 /nfs/dbraw/zinc/94/48/98/648944898.db2.gz RSSXLPGRUKPGQM-NSHDSACASA-N -1 3 295.354 2.933 20 10 CFCDHM CC1(/C=C/C(=O)NCc2c([O-])cccc2F)CCOCC1 ZINC000928705585 648944932 /nfs/dbraw/zinc/94/49/32/648944932.db2.gz KCYHODRZQBRBRP-AATRIKPKSA-N -1 3 293.338 2.520 20 10 CFCDHM CC(C)C[C@@H]1C[C@H]1C(=O)NCc1c([O-])cccc1F ZINC000928706815 648945344 /nfs/dbraw/zinc/94/53/44/648945344.db2.gz VNGPVFYGWLYHKM-GHMZBOCLSA-N -1 3 265.328 2.830 20 10 CFCDHM O=C(C=C1CCSCC1)NCc1c([O-])cccc1F ZINC000928708505 648945953 /nfs/dbraw/zinc/94/59/53/648945953.db2.gz NDZXQUYDKGYWEZ-UHFFFAOYSA-N -1 3 281.352 2.601 20 10 CFCDHM CC[C@@H](C)[C@@H](C)C(=O)NCc1c([O-])cccc1F ZINC000928708569 648946110 /nfs/dbraw/zinc/94/61/10/648946110.db2.gz PNUYDSUNWKFQKG-NXEZZACHSA-N -1 3 253.317 2.830 20 10 CFCDHM C[C@H]1CN(Cc2cc(F)cc(Cl)c2[O-])CC[C@@]1(C)O ZINC001237807543 779719587 /nfs/dbraw/zinc/71/95/87/779719587.db2.gz LONLGTRAKDUIID-LKFCYVNXSA-N -1 3 287.762 2.778 20 10 CFCDHM CO[C@@H]1CCN(Cc2c([O-])cc(F)cc2F)[C@@H](C)C1 ZINC001140584646 770970971 /nfs/dbraw/zinc/97/09/71/770970971.db2.gz ACIHOIZFMAYEFY-GXSJLCMTSA-N -1 3 271.307 2.670 20 10 CFCDHM CC(C)(CCNC(=O)c1cccc(O)c1[O-])C1CC1 ZINC000328487468 775748694 /nfs/dbraw/zinc/74/86/94/775748694.db2.gz MNYDNSZZPLGCLQ-UHFFFAOYSA-N -1 3 263.337 2.654 20 10 CFCDHM [O-]c1ccc(Br)cc1CN1CC[C@@H](F)C1 ZINC000689865676 775880853 /nfs/dbraw/zinc/88/08/53/775880853.db2.gz YNTNHCRRYZRSOA-SNVBAGLBSA-N -1 3 274.133 2.699 20 10 CFCDHM O=C([O-])c1ccc([O-])c(C[N@@H+]2CC[C@H]3CCC[C@@H]3C2)c1 ZINC001231561678 777259064 /nfs/dbraw/zinc/25/90/64/777259064.db2.gz YHIOKRPVXDRWIN-DGCLKSJQSA-N -1 3 275.348 2.712 20 10 CFCDHM O=C([O-])c1ccc([O-])c(C[N@H+]2CC[C@H]3CCC[C@@H]3C2)c1 ZINC001231561678 777259071 /nfs/dbraw/zinc/25/90/71/777259071.db2.gz YHIOKRPVXDRWIN-DGCLKSJQSA-N -1 3 275.348 2.712 20 10 CFCDHM O=C([O-])c1ccc([O-])c(C[N@@H+]2CCC[C@@H]3CCC[C@@H]32)c1 ZINC001231565008 777261879 /nfs/dbraw/zinc/26/18/79/777261879.db2.gz MYRXNBYJEWJFBN-FZMZJTMJSA-N -1 3 275.348 2.855 20 10 CFCDHM O=C([O-])c1ccc([O-])c(C[N@H+]2CCC[C@@H]3CCC[C@@H]32)c1 ZINC001231565008 777261888 /nfs/dbraw/zinc/26/18/88/777261888.db2.gz MYRXNBYJEWJFBN-FZMZJTMJSA-N -1 3 275.348 2.855 20 10 CFCDHM Cc1cc([O-])c(CN2CC(N3CC[C@H](F)C3)C2)cc1Cl ZINC001231871120 777359711 /nfs/dbraw/zinc/35/97/11/777359711.db2.gz ZCELFTMAKUPKJG-LBPRGKRZSA-N -1 3 298.789 2.582 20 10 CFCDHM Cn1ncc2c1CN(Cc1ccc3ccccc3c1[O-])C2 ZINC001231882814 777365243 /nfs/dbraw/zinc/36/52/43/777365243.db2.gz WAIMYPYTICWEFA-UHFFFAOYSA-N -1 3 279.343 2.795 20 10 CFCDHM C[C@@H]1CCN(Cc2cc(Cl)c([O-])cc2O)CCC1=O ZINC001232259403 777496236 /nfs/dbraw/zinc/49/62/36/777496236.db2.gz JCDWHOSWJOUXLG-SECBINFHSA-N -1 3 283.755 2.552 20 10 CFCDHM O=C(NC1C2CC3CC(C2)CC1C3)c1cccc(O)c1[O-] ZINC000328289824 777656798 /nfs/dbraw/zinc/65/67/98/777656798.db2.gz UODWUQDXHVORCW-UHFFFAOYSA-N -1 3 287.359 2.652 20 10 CFCDHM COCC1CCN(Cc2c([O-])ccc(F)c2F)CC1 ZINC001233332127 777891184 /nfs/dbraw/zinc/89/11/84/777891184.db2.gz ZQPSTEYUXXKMOK-UHFFFAOYSA-N -1 3 271.307 2.529 20 10 CFCDHM CN(Cc1c([O-])ccc(F)c1F)C[C@H]1CCCCO1 ZINC001233334361 777894694 /nfs/dbraw/zinc/89/46/94/777894694.db2.gz CSSPQHMFWNBBRM-SNVBAGLBSA-N -1 3 271.307 2.671 20 10 CFCDHM [O-]c1cc(C(F)(F)F)ccc1CN1CCn2ccnc2C1 ZINC001233452321 777959430 /nfs/dbraw/zinc/95/94/30/777959430.db2.gz RHHFQHNBMKHUOL-UHFFFAOYSA-N -1 3 297.280 2.623 20 10 CFCDHM [O-]c1cc(Cl)c(Cl)cc1CN1CCN2CC[C@H]2C1 ZINC001236805141 778947416 /nfs/dbraw/zinc/94/74/16/778947416.db2.gz VQDAGKIFEJUVGZ-JTQLQIEISA-N -1 3 287.190 2.589 20 10 CFCDHM CCN(Cc1c([O-])ccc(Cl)c1Cl)C1CN(C)C1 ZINC001237083621 779004996 /nfs/dbraw/zinc/00/49/96/779004996.db2.gz BEEKOXYPYIUCKV-UHFFFAOYSA-N -1 3 289.206 2.835 20 10 CFCDHM COC[C@@H]1CCN1Cc1c([O-])ccc(Cl)c1Cl ZINC001237085891 779008721 /nfs/dbraw/zinc/00/87/21/779008721.db2.gz KMFWNWNJXDTEJE-QMMMGPOBSA-N -1 3 276.163 2.920 20 10 CFCDHM CN(Cc1c([O-])ccc(F)c1Cl)[C@H]1CCCOC1 ZINC001237125291 779018475 /nfs/dbraw/zinc/01/84/75/779018475.db2.gz CEUJYJUCSIKMLX-VIFPVBQESA-N -1 3 273.735 2.796 20 10 CFCDHM [O-]c1cc(F)cc(F)c1CN1CCNC2=CCCC[C@H]21 ZINC001237226063 779056019 /nfs/dbraw/zinc/05/60/19/779056019.db2.gz ULLKUHFDJQHSRS-CQSZACIVSA-N -1 3 280.318 2.512 20 10 CFCDHM C[C@@H]1CO[C@@H]2CN(Cc3cc(F)cc(Cl)c3[O-])C[C@H]12 ZINC001237800731 779182013 /nfs/dbraw/zinc/18/20/13/779182013.db2.gz ARPBGQKLNQKTMP-XTWCZFFVSA-N -1 3 285.746 2.651 20 10 CFCDHM C[C@@H]1CN(C)[C@@H](C)CN1Cc1cc(F)cc(Cl)c1[O-] ZINC001237799880 779182163 /nfs/dbraw/zinc/18/21/63/779182163.db2.gz JLOAVSXTHNLATJ-VHSXEESVSA-N -1 3 286.778 2.709 20 10 CFCDHM [O-]c1cc(Cl)c(F)cc1CN1CC[C@@H]2CCO[C@H]2C1 ZINC001237933363 779210209 /nfs/dbraw/zinc/21/02/09/779210209.db2.gz AGZVJOOIUCMJLG-OTYXRUKQSA-N -1 3 285.746 2.796 20 10 CFCDHM CN(Cc1ccc([S@@](C)=O)cc1)Cc1ccccc1[O-] ZINC000091974647 375074497 /nfs/dbraw/zinc/07/44/97/375074497.db2.gz LIJWULHBDIEXET-FQEVSTJZSA-N -1 3 289.400 2.762 20 10 CFCDHM CCCOc1ccc(CN2CCO[C@@H](C)[C@@H]2C)c([O-])c1 ZINC000093418441 375233456 /nfs/dbraw/zinc/23/34/56/375233456.db2.gz DSHMNPNOLCWBDD-STQMWFEESA-N -1 3 279.380 2.790 20 10 CFCDHM CC1(C)CN(C(=O)c2cccc(O)c2[O-])[C@@H]2CCC[C@@H]21 ZINC000378822780 781966515 /nfs/dbraw/zinc/96/65/15/781966515.db2.gz GBAKCHMTSVVFKK-NWDGAFQWSA-N -1 3 275.348 2.749 20 10 CFCDHM C[C@H]1CN(Cc2c([O-])cccc2Cl)C[C@H](C)O1 ZINC000126961561 377256351 /nfs/dbraw/zinc/25/63/51/377256351.db2.gz JJYRVOIYLLAEJA-UWVGGRQHSA-N -1 3 255.745 2.655 20 10 CFCDHM C[C@@H]1CN(Cc2c([O-])cccc2Cl)C[C@@H](C)O1 ZINC000126961802 377256488 /nfs/dbraw/zinc/25/64/88/377256488.db2.gz JJYRVOIYLLAEJA-NXEZZACHSA-N -1 3 255.745 2.655 20 10 CFCDHM CC[C@H]1CN(Cc2cc(F)ccc2[O-])C[C@H](C)O1 ZINC000179987076 380606710 /nfs/dbraw/zinc/60/67/10/380606710.db2.gz JRLDTDGNQLBGBA-GWCFXTLKSA-N -1 3 253.317 2.531 20 10 CFCDHM C[C@]1(O)CCCN(Cc2cc(Cl)c(F)cc2[O-])C1 ZINC000295501607 380900014 /nfs/dbraw/zinc/90/00/14/380900014.db2.gz YJZKFAKYVFKKEU-ZDUSSCGKSA-N -1 3 273.735 2.532 20 10 CFCDHM CCCN(Cc1cn(C(C)C)nn1)Cc1ccccc1[O-] ZINC000289272235 381029172 /nfs/dbraw/zinc/02/91/72/381029172.db2.gz FGLOOWUOBSELRU-UHFFFAOYSA-N -1 3 288.395 2.977 20 10 CFCDHM COc1cc(Cl)cc(CN(C)Cc2cc(C)on2)c1[O-] ZINC000184680946 381459438 /nfs/dbraw/zinc/45/94/38/381459438.db2.gz MTSGEEHMQFZBIT-UHFFFAOYSA-N -1 3 296.754 2.983 20 10 CFCDHM COCCC1(C)CN(Cc2cccc(Cl)c2[O-])C1 ZINC000297345825 381559162 /nfs/dbraw/zinc/55/91/62/381559162.db2.gz GCLIQZLOUPVQHB-UHFFFAOYSA-N -1 3 269.772 2.904 20 10 CFCDHM CN(C(=O)c1cccc(O)c1[O-])[C@H]1CCc2ccccc2C1 ZINC000185657449 381695487 /nfs/dbraw/zinc/69/54/87/381695487.db2.gz XPEHNOWVJRURBH-AWEZNQCLSA-N -1 3 297.354 2.727 20 10 CFCDHM CN(C(=O)c1cccc(O)c1[O-])[C@@H]1CCc2ccccc2C1 ZINC000185657429 381696331 /nfs/dbraw/zinc/69/63/31/381696331.db2.gz XPEHNOWVJRURBH-CQSZACIVSA-N -1 3 297.354 2.727 20 10 CFCDHM CCSCC[C@@H](C)N(C)C(=O)c1cccc(O)c1[O-] ZINC000185773417 381728691 /nfs/dbraw/zinc/72/86/91/381728691.db2.gz XNZUDFYYOZQUQT-SNVBAGLBSA-N -1 3 283.393 2.702 20 10 CFCDHM C[C@@H](N[C@@H](CCO)c1ccco1)c1cc(F)ccc1[O-] ZINC000186534866 381939286 /nfs/dbraw/zinc/93/92/86/381939286.db2.gz QXIRLINVESHVGI-MFKMUULPSA-N -1 3 279.311 2.899 20 10 CFCDHM CC(=O)c1cc(F)cc(CN2CC[C@@H](C3CC3)C2)c1[O-] ZINC000374300507 382041967 /nfs/dbraw/zinc/04/19/67/382041967.db2.gz FNPDOJMEFYJDAS-GFCCVEGCSA-N -1 3 277.339 2.966 20 10 CFCDHM CC(=O)c1cc(F)cc(CN2CC[C@H](C3CC3)C2)c1[O-] ZINC000374300509 382042219 /nfs/dbraw/zinc/04/22/19/382042219.db2.gz FNPDOJMEFYJDAS-LBPRGKRZSA-N -1 3 277.339 2.966 20 10 CFCDHM C[C@H]1CN(C(=O)c2cccc(O)c2[O-])[C@H]1c1ccccc1 ZINC000187148301 382110491 /nfs/dbraw/zinc/11/04/91/382110491.db2.gz YUOHVNFKBPRYSY-XHDPSFHLSA-N -1 3 283.327 2.931 20 10 CFCDHM [O-]c1c(Cl)cccc1CN[C@H](CCO)c1ccco1 ZINC000187528794 382203653 /nfs/dbraw/zinc/20/36/53/382203653.db2.gz GWBBKQQQGZDFFW-GFCCVEGCSA-N -1 3 281.739 2.852 20 10 CFCDHM C[C@@H](NCc1cc(Cl)c(F)cc1[O-])c1cn[nH]c1 ZINC000293673380 382225919 /nfs/dbraw/zinc/22/59/19/382225919.db2.gz QUCUKAKCADUBIL-SSDOTTSWSA-N -1 3 269.707 2.759 20 10 CFCDHM [O-]c1ccc(F)cc1CN1C[C@]2(CCCO2)[C@H]1C1CC1 ZINC000293834262 382298112 /nfs/dbraw/zinc/29/81/12/382298112.db2.gz ATOYIUZVQQTRAT-HZPDHXFCSA-N -1 3 277.339 2.675 20 10 CFCDHM COc1cc(Cl)cc(CN2CCC[C@@H]2CF)c1[O-] ZINC000293957351 382352928 /nfs/dbraw/zinc/35/29/28/382352928.db2.gz JDXFHOSMEQMAFM-LLVKDONJSA-N -1 3 273.735 2.988 20 10 CFCDHM O=C(c1cccc(O)c1[O-])N1CCC[C@@H]1c1nccs1 ZINC000365754754 382437075 /nfs/dbraw/zinc/43/70/75/382437075.db2.gz UHXATZBUJOYAFR-SNVBAGLBSA-N -1 3 290.344 2.532 20 10 CFCDHM O=C(c1cccc(O)c1[O-])N1C[C@H]2CCCCCC[C@H]21 ZINC000365759057 382438219 /nfs/dbraw/zinc/43/82/19/382438219.db2.gz QUTDMDPWOJXDKU-DGCLKSJQSA-N -1 3 275.348 2.893 20 10 CFCDHM O=C(c1cccc(O)c1[O-])N1CC=C(c2ccccc2)C1 ZINC000365790123 382445634 /nfs/dbraw/zinc/44/56/34/382445634.db2.gz NVUUHILEJKNXGD-UHFFFAOYSA-N -1 3 281.311 2.637 20 10 CFCDHM C[C@H](C1CC1)n1nccc1NC(=O)c1cccc(O)c1[O-] ZINC000188375923 382401910 /nfs/dbraw/zinc/40/19/10/382401910.db2.gz DQBHMUBCPYDLCI-SECBINFHSA-N -1 3 287.319 2.518 20 10 CFCDHM CSC[C@H]1CCCN(C(=O)c2ccc(C)c(O)c2[O-])C1 ZINC000294581419 382517631 /nfs/dbraw/zinc/51/76/31/382517631.db2.gz HROMWHYPMYUPGZ-NSHDSACASA-N -1 3 295.404 2.621 20 10 CFCDHM Cn1ccnc1[C@H]1N(Cc2cc(F)ccc2[O-])CC1(C)C ZINC000294860036 382533789 /nfs/dbraw/zinc/53/37/89/382533789.db2.gz TUNMJQBRPOTUGR-CQSZACIVSA-N -1 3 289.354 2.848 20 10 CFCDHM CCN(C)C(=O)[C@H](C)N[C@@H](C)c1cc(Cl)ccc1[O-] ZINC000189400312 382603759 /nfs/dbraw/zinc/60/37/59/382603759.db2.gz MWUDXASPOUOTTF-UWVGGRQHSA-N -1 3 284.787 2.563 20 10 CFCDHM CC[C@H]1CN(Cc2cc(Cl)cc(Cl)c2[O-])C[C@@H]1O ZINC000271244970 385377452 /nfs/dbraw/zinc/37/74/52/385377452.db2.gz BXUDJHCLTUUTIS-UFBFGSQYSA-N -1 3 290.190 2.902 20 10 CFCDHM [O-]c1c(F)cccc1CN(CCO)Cc1ccccc1 ZINC000272340892 385514812 /nfs/dbraw/zinc/51/48/12/385514812.db2.gz YPYNNQJDSMFKTI-UHFFFAOYSA-N -1 3 275.323 2.526 20 10 CFCDHM C[C@H](N[C@@H](C)c1cc(Cl)ccc1[O-])c1nncn1C ZINC000273606782 385690754 /nfs/dbraw/zinc/69/07/54/385690754.db2.gz UJWYQKDAAULBEA-IUCAKERBSA-N -1 3 280.759 2.586 20 10 CFCDHM Cc1ccc(C(=O)N2CC(C3CCCC3)C2)c([O-])c1O ZINC000373760782 393471338 /nfs/dbraw/zinc/47/13/38/393471338.db2.gz YBCUJAKSEZTRQC-UHFFFAOYSA-N -1 3 275.348 2.668 20 10 CFCDHM CCC(C)(C)NC(=O)[C@H](C)N(C)Cc1ccccc1[O-] ZINC000109772295 393879616 /nfs/dbraw/zinc/87/96/16/393879616.db2.gz CEEXGGWSAQEPPU-LBPRGKRZSA-N -1 3 278.396 2.517 20 10 CFCDHM CC[C@@H](NCc1nnc2n1CCCC2)c1ccccc1[O-] ZINC000121099242 393948425 /nfs/dbraw/zinc/94/84/25/393948425.db2.gz HQALXSBCRPCCJP-CYBMUJFWSA-N -1 3 286.379 2.561 20 10 CFCDHM C[C@H](NCc1cnc2n1CCCC2)c1ccc(F)cc1[O-] ZINC000367436463 262014443 /nfs/dbraw/zinc/01/44/43/262014443.db2.gz FZSCQBLQLQTAQX-NSHDSACASA-N -1 3 289.354 2.915 20 10 CFCDHM C[C@H]1CCOCCN1Cc1cccc(Cl)c1[O-] ZINC000368130550 267146894 /nfs/dbraw/zinc/14/68/94/267146894.db2.gz CVDFAPZSOVETFH-JTQLQIEISA-N -1 3 255.745 2.656 20 10 CFCDHM C[C@@H]1COCCN(Cc2c([O-])ccc(Cl)c2F)C1 ZINC000365233385 288335076 /nfs/dbraw/zinc/33/50/76/288335076.db2.gz IGUSLOXYFJZYMQ-VIFPVBQESA-N -1 3 273.735 2.653 20 10 CFCDHM CC[C@H](NCc1cnn(CC)n1)c1ccc(C)cc1[O-] ZINC000527921958 330295879 /nfs/dbraw/zinc/29/58/79/330295879.db2.gz ASGNHEGGBRKRJL-AWEZNQCLSA-N -1 3 274.368 2.553 20 10 CFCDHM C[C@@H]1CN(C(=O)/C=C\c2cncc([O-])c2)c2ccccc2O1 ZINC000492435238 332397387 /nfs/dbraw/zinc/39/73/87/332397387.db2.gz FHRSDZQXRBWJMJ-ZHRWSRJISA-N -1 3 296.326 2.615 20 10 CFCDHM C[C@H]1CCN(C(=O)C=Cc2c[nH]cn2)c2c([O-])cccc21 ZINC000492814159 332414583 /nfs/dbraw/zinc/41/45/83/332414583.db2.gz STLWQUCOWFMYRS-GZTOBOFZSA-N -1 3 283.331 2.669 20 10 CFCDHM