smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name Cc1ccccc1N1C(=O)NC(=O)C(=Cc2cc(C(C)(C)C)c(O)c(C(C)(C)C)c2)C1=O ZINC000009260131 132311387 /nfs/dbraw/zinc/31/13/87/132311387.db2.gz ZNSBPIRUHTVMRF-ATVHPVEESA-N 0 2 434.536 4.962 40 10 IJCBLN Cc1[nH]n(-c2cccc(C)c2)c(=O)c1C=Nc1ccc(S(=O)(=O)Nc2ccccc2)cc1 ZINC000408527324 555717591 /nfs/dbraw/zinc/71/75/91/555717591.db2.gz DIDVQBUERLPMBB-KQWNVCNZSA-N 0 2 446.532 4.514 40 10 IJCBLN CCc1cc(Br)cc([N+](=O)[O-])c1N=CC1C(=O)N(c2cccc(C)c2)N=C1C ZINC000408534315 555750912 /nfs/dbraw/zinc/75/09/12/555750912.db2.gz QGJMOTARFNMJTL-BOPFTXTBSA-N 0 2 443.301 4.947 40 10 IJCBLN Cc1cc(C)cc(N2C(=O)NC(=O)C(=Cc3ccc(OCc4cccc(F)c4)cc3)C2=O)c1 ZINC000016269102 556596330 /nfs/dbraw/zinc/59/63/30/556596330.db2.gz JMONDZPBRDIEFX-OEAKJJBVSA-N 0 2 444.462 4.688 40 10 IJCBLN Cc1ccc(N2C(=O)NC(=O)C(=Cc3ccc(OCc4ccc(Cl)cc4)cc3)C2=O)cc1 ZINC000408787139 556856824 /nfs/dbraw/zinc/85/68/24/556856824.db2.gz SFXQXPKZBIATKQ-HYARGMPZSA-N 0 2 446.890 4.894 40 10 IJCBLN CCCOc1ccc2ccccc2c1/C=C1\C(=O)NC(=O)N(c2cccc(C)c2C)C1=O ZINC000408804589 556860171 /nfs/dbraw/zinc/86/01/71/556860171.db2.gz AYNBFKDJZOEKSH-RCCKNPSSSA-N 0 2 428.488 4.912 40 10 IJCBLN Cc1ccc(C)c(N2C(=O)NC(=O)C(=Cc3ccc(OCc4ccccc4)cc3)C2=O)c1 ZINC000408810626 556862356 /nfs/dbraw/zinc/86/23/56/556862356.db2.gz POTCIFIXPRMAED-PXLXIMEGSA-N 0 2 426.472 4.549 40 10 IJCBLN Cc1cc(/C=C2\C(=O)NC(=O)N(c3ccc(C)c(C)c3)C2=O)c(C)n1-c1cc(C)cc(C)c1 ZINC000408850262 556870725 /nfs/dbraw/zinc/87/07/25/556870725.db2.gz JSHUNHPLUFBVSH-ZVHZXABRSA-N 0 2 441.531 4.994 40 10 IJCBLN Cc1cccc(N2C(=O)NC(=O)C(=Cc3ccccc3Cc3ccccc3Cl)C2=O)c1 ZINC000408877110 556876958 /nfs/dbraw/zinc/87/69/58/556876958.db2.gz PWRHNUCQAGYJAH-RCCKNPSSSA-N 0 2 430.891 4.906 40 10 IJCBLN Cc1ccc(N2C(=O)NC(=O)C(=Cc3ccccc3Cc3ccccc3F)C2=O)cc1C ZINC000408877605 556877187 /nfs/dbraw/zinc/87/71/87/556877187.db2.gz WBVANTUYBJSDRW-PXLXIMEGSA-N 0 2 428.463 4.700 40 10 IJCBLN Cc1cccc(N2C(=O)NC(=O)C(=Cc3ccccc3OCc3ccccc3Cl)C2=O)c1 ZINC000408878436 556877365 /nfs/dbraw/zinc/87/73/65/556877365.db2.gz BFQWNWMJJUGHIX-XSFVSMFZSA-N 0 2 446.890 4.894 40 10 IJCBLN Cc1cccc(N2C(=O)NC(=O)/C(=C\c3ccc(OCc4cc(C)cc(C)c4)cc3)C2=O)c1 ZINC000408885311 556877990 /nfs/dbraw/zinc/87/79/90/556877990.db2.gz ZDUGKATYXFGGQK-BUVRLJJBSA-N 0 2 440.499 4.857 40 10 IJCBLN O=C1NC(=O)N(c2ccc(C34CC5CC(CC(C5)C3)C4)cc2)C(=O)/C1=C/c1ccccc1 ZINC000408949736 556897791 /nfs/dbraw/zinc/89/77/91/556897791.db2.gz ISTRMAMHVILWRX-YDZHTSKRSA-N 0 2 426.516 4.821 40 10 IJCBLN CCc1cccc(C)c1-n1c(C)cc(/C=C2\C(=O)NC(=O)N(c3ccccc3)C2=O)c1C ZINC000408959529 556899583 /nfs/dbraw/zinc/89/95/83/556899583.db2.gz ALIBOPPYNKGSHV-PXLXIMEGSA-N 0 2 427.504 4.631 40 10 IJCBLN CCc1ccc(N2C(=O)NC(=O)C(=Cc3cc(C)n(-c4ccc(C)c(C)c4)c3C)C2=O)cc1 ZINC000408988948 556911858 /nfs/dbraw/zinc/91/18/58/556911858.db2.gz SGBRGEHGIBEXQK-IWIPYMOSSA-N 0 2 441.531 4.940 40 10 IJCBLN Cc1cccc(N2C(=O)NC(=O)/C(=C\c3cccn3-c3ccc(C)c(Cl)c3)C2=O)c1C ZINC000409014094 556920256 /nfs/dbraw/zinc/92/02/56/556920256.db2.gz OVOZKDWDOCVVGV-XDHOZWIPSA-N 0 2 433.895 4.722 40 10 IJCBLN CC[C@H](C)Oc1ccc(/C=C2\C(=O)NC(=O)N(c3cccc(Cl)c3Cl)C2=O)cc1 ZINC000409101149 556955781 /nfs/dbraw/zinc/95/57/81/556955781.db2.gz VYLOTVUNCPNFRK-YGRGUWMTSA-N 0 2 433.291 4.837 40 10 IJCBLN O=C1NC(=O)N(c2cccnc2)C(=O)/C1=C\c1ccccc1Sc1ccc(Cl)cc1 ZINC000409245476 557027256 /nfs/dbraw/zinc/02/72/56/557027256.db2.gz UIIJJXYKXFOQME-PDGQHHTCSA-N 0 2 435.892 4.553 40 10 IJCBLN Cc1ccc(N2C(=O)NC(=O)C(=Cc3ccc4c(c3)[C@H](C)CC(C)(C)N4C)C2=O)cc1C ZINC000208191133 557078711 /nfs/dbraw/zinc/07/87/11/557078711.db2.gz HRQXHKVDUFYRKQ-VYVDHXHBSA-N 0 2 431.536 4.692 40 10 IJCBLN CCCc1[nH]n(-c2ccc([N+](=O)[O-])cc2)c(=O)c1C(C)=Nc1ccc(C(=O)OCC)cc1 ZINC000112293401 557239169 /nfs/dbraw/zinc/23/91/69/557239169.db2.gz MOFPCESOXMFQRT-QNGOZBTKSA-N 0 2 436.468 4.660 40 10 IJCBLN CC(C)(C)c1cc(/C=C2\C(=O)NC(=O)N(c3ccc(F)cc3)C2=O)cc(C(C)(C)C)c1O ZINC000015223946 557460584 /nfs/dbraw/zinc/46/05/84/557460584.db2.gz KWWIYHYUHFFYGF-GZTJUZNOSA-N 0 2 438.499 4.793 40 10 IJCBLN CC1=CC(C)(C)N(C(C)C)c2ccc(/C=C3\C(=O)NC(=O)N(c4cccc(F)c4)C3=O)cc21 ZINC000223489211 557478614 /nfs/dbraw/zinc/47/86/14/557478614.db2.gz JMUAUSOPRKNQOS-CIAFOILYSA-N 0 2 447.510 4.902 40 10 IJCBLN CCOc1ccc(Br)cc1C=C1C(=O)NC(=O)N(c2ccc(C)cc2)C1=O ZINC000033409624 557808086 /nfs/dbraw/zinc/80/80/86/557808086.db2.gz QMRGFNVYTKIHKN-LFIBNONCSA-N 0 2 429.270 4.663 40 10 IJCBLN Cc1cc(C=C2C(=O)NC(=O)N(c3ccccc3C)C2=O)c(C)n1-c1ccc(Cl)cc1 ZINC000002397542 132253697 /nfs/dbraw/zinc/25/36/97/132253697.db2.gz WTAXSXDEXXXSRF-DEDYPNTBSA-N 0 2 433.895 4.722 40 10 IJCBLN Cc1cc(N2CCCC2)c(F)cc1C=C1C(=O)NC(=O)N(c2cccc(Cl)c2)C1=O ZINC000034881878 555553143 /nfs/dbraw/zinc/55/31/43/555553143.db2.gz RVGLVNZRGBVUBC-LICLKQGHSA-N 0 2 427.863 4.894 40 10 IJCBLN COc1cc(N2N=C(C)C(C=Nc3c(C)nn(-c4ccccc4)c3C)C2=O)ccc1Cl ZINC000408757914 556587476 /nfs/dbraw/zinc/58/74/76/556587476.db2.gz SDSIALZOWWYHJX-CPNJWEJPSA-N 0 2 435.915 4.870 40 10 IJCBLN Cc1cc(C=C2C(=O)NC(=O)N(c3ccccc3)C2=O)c(C)n1-c1cccc([N+](=O)[O-])c1 ZINC000016268565 556596058 /nfs/dbraw/zinc/59/60/58/556596058.db2.gz VHMTUUKIHONOMA-NDENLUEZSA-N 0 2 430.420 4.509 40 10 IJCBLN Cc1cc(C)cc(N2C(=O)NC(=O)C(=Cc3cc(Cl)cc(Br)c3O)C2=O)c1 ZINC000083308384 556663142 /nfs/dbraw/zinc/66/31/42/556663142.db2.gz HJEGDPLYPFWVOM-VGOFMYFVSA-N 0 2 449.688 4.932 40 10 IJCBLN CCc1ccc(-n2c(C)cc(/C=C3\C(=O)NC(=O)N(c4ccc(C)cc4)C3=O)c2C)cc1 ZINC000408759528 556686681 /nfs/dbraw/zinc/68/66/81/556686681.db2.gz GOQWHAJCZJMDTB-HZHRSRAPSA-N 0 2 427.504 4.631 40 10 IJCBLN CCc1ccc(-n2c(C)cc(/C=C3\C(=O)NC(=O)N(c4cccc(Cl)c4)C3=O)c2C)cc1 ZINC000408765717 556829807 /nfs/dbraw/zinc/82/98/07/556829807.db2.gz XKTFQPYRCPTOKF-LPYMAVHISA-N 0 2 447.922 4.976 40 10 IJCBLN Cc1ccc(COc2ccccc2/C=C2\C(=O)NC(=O)N(c3cc(C)cc(C)c3)C2=O)cc1 ZINC000408775165 556848451 /nfs/dbraw/zinc/84/84/51/556848451.db2.gz FQCQLKXNOWEXKY-HZHRSRAPSA-N 0 2 440.499 4.857 40 10 IJCBLN CCc1ccccc1N1C(=O)NC(=O)C(=Cc2cc(C)n(-c3ccc(C)cc3)c2C)C1=O ZINC000408777933 556853727 /nfs/dbraw/zinc/85/37/27/556853727.db2.gz MNHOPFJBBMFQNJ-PXLXIMEGSA-N 0 2 427.504 4.631 40 10 IJCBLN O=C1NC(=O)N(c2ccc(Cl)cc2)C(=O)/C1=C/c1ccccc1OCc1ccccc1 ZINC000408781681 556856020 /nfs/dbraw/zinc/85/60/20/556856020.db2.gz CXGXSUZCXXHNQH-XSFVSMFZSA-N 0 2 432.863 4.585 40 10 IJCBLN CCOc1ccc(N2C(=O)NC(=O)C(=Cc3c(OC(C)C)ccc4ccccc43)C2=O)cc1 ZINC000408804898 556860372 /nfs/dbraw/zinc/86/03/72/556860372.db2.gz ZXUGJQHGRHLUAD-PXLXIMEGSA-N 0 2 444.487 4.692 40 10 IJCBLN Cc1ccc(C)c(N2C(=O)NC(=O)C(=Cc3c(OC(C)C)ccc4ccccc43)C2=O)c1 ZINC000408805549 556860876 /nfs/dbraw/zinc/86/08/76/556860876.db2.gz GPCNQCCALUVIDG-KGENOOAVSA-N 0 2 428.488 4.910 40 10 IJCBLN Cc1ccccc1N1C(=O)NC(=O)C(=Cc2ccc(OCc3ccccc3)c(Cl)c2)C1=O ZINC000408817628 556864182 /nfs/dbraw/zinc/86/41/82/556864182.db2.gz WBDJGAVCECLJGX-CPNJWEJPSA-N 0 2 446.890 4.894 40 10 IJCBLN Cc1cccc(COc2ccc(Cl)cc2/C=C2\C(=O)NC(=O)N(c3ccccc3)C2=O)c1 ZINC000408817325 556864187 /nfs/dbraw/zinc/86/41/87/556864187.db2.gz SYRWJZNTUAPCMA-KGENOOAVSA-N 0 2 446.890 4.894 40 10 IJCBLN CCc1ccccc1-n1c(C)cc(/C=C2\C(=O)NC(=O)N(c3ccc(C)c(C)c3)C2=O)c1C ZINC000408849241 556870317 /nfs/dbraw/zinc/87/03/17/556870317.db2.gz YPEVVNFYFAZLRF-HZHRSRAPSA-N 0 2 441.531 4.940 40 10 IJCBLN Cc1cc(C=C2C(=O)NC(=O)N(c3ccc(C)c(C)c3)C2=O)c(C)n1-c1cccc(C)c1C ZINC000408855469 556871947 /nfs/dbraw/zinc/87/19/47/556871947.db2.gz DKFFOZAZOPLJME-OEAKJJBVSA-N 0 2 441.531 4.994 40 10 IJCBLN COc1ccc(N2C(=O)NC(=O)C(=Cc3ccccc3Cc3ccccc3Cl)C2=O)cc1 ZINC000408866484 556873587 /nfs/dbraw/zinc/87/35/87/556873587.db2.gz HQHPUUGATCYROV-RCCKNPSSSA-N 0 2 446.890 4.606 40 10 IJCBLN Cc1ccc(C)c(N2C(=O)NC(=O)C(=Cc3ccccc3Cc3cccc(F)c3)C2=O)c1 ZINC000408870548 556874735 /nfs/dbraw/zinc/87/47/35/556874735.db2.gz VYDOWTIXLWICNL-PXLXIMEGSA-N 0 2 428.463 4.700 40 10 IJCBLN COc1ccc(/C=C2\C(=O)NC(=O)N(c3ccccc3)C2=O)c(Cc2cc(C)cc(C)c2)c1 ZINC000408871383 556875073 /nfs/dbraw/zinc/87/50/73/556875073.db2.gz YPBQZBKQYFTAQT-LFVJCYFKSA-N 0 2 440.499 4.569 40 10 IJCBLN COc1ccc(/C=C2\C(=O)NC(=O)N(c3ccccc3)C2=O)c(Cc2ccccc2Cl)c1 ZINC000408872765 556875322 /nfs/dbraw/zinc/87/53/22/556875322.db2.gz IKTVZMZFRTVDNQ-RCCKNPSSSA-N 0 2 446.890 4.606 40 10 IJCBLN CCc1ccccc1N1C(=O)NC(=O)C(=Cc2c(OC(C)C)ccc3ccccc32)C1=O ZINC000408882719 556878551 /nfs/dbraw/zinc/87/85/51/556878551.db2.gz NQWXKDVYNKJYKC-QNGOZBTKSA-N 0 2 428.488 4.856 40 10 IJCBLN Cc1cc(C)cc(COc2ccccc2/C=C2\C(=O)NC(=O)N(c3ccccc3)C2=O)c1 ZINC000408889752 556878812 /nfs/dbraw/zinc/87/88/12/556878812.db2.gz GUMXZLYYAWAZHC-PXLXIMEGSA-N 0 2 426.472 4.549 40 10 IJCBLN Cc1ccc(C)c(N2C(=O)NC(=O)C(=Cc3ccc(OCc4cccc(F)c4)cc3)C2=O)c1 ZINC000408886919 556879383 /nfs/dbraw/zinc/87/93/83/556879383.db2.gz JWTSTBRQAOJZCN-HYARGMPZSA-N 0 2 444.462 4.688 40 10 IJCBLN Cc1cc(N2CCCC2)ccc1/C=C1\C(=O)NC(=O)N(c2ccc(Cl)c(Cl)c2)C1=O ZINC000408962281 556901273 /nfs/dbraw/zinc/90/12/73/556901273.db2.gz XYTVXLHPOMASEG-GZTJUZNOSA-N 0 2 444.318 4.568 40 10 IJCBLN O=C1NC(=O)N(c2ccccc2)C(=O)/C1=C/c1ccc(Sc2nc3ccccc3s2)o1 ZINC000408988576 556911964 /nfs/dbraw/zinc/91/19/64/556911964.db2.gz DUQACMQKIXOZER-NTCAYCPXSA-N 0 2 447.497 4.707 40 10 IJCBLN CCOc1cccc(N2C(=O)NC(=O)C(=Cc3cccn3-c3ccc(C)c(Cl)c3)C2=O)c1 ZINC000409009618 556917400 /nfs/dbraw/zinc/91/74/00/556917400.db2.gz GXXFJDZDBSPQOI-DEDYPNTBSA-N 0 2 449.894 4.504 40 10 IJCBLN COc1c(Cl)cc(/C=C2\C(=O)NC(=O)N(c3cccc(Cl)c3C)C2=O)cc1Cl ZINC000409049482 556932125 /nfs/dbraw/zinc/93/21/25/556932125.db2.gz XCAGYGRNLIKYPM-IZZDOVSWSA-N 0 2 439.682 4.630 40 10 IJCBLN COc1ccc(/C=C2\C(=O)NC(=O)N(c3cccc(Cl)c3Cl)C2=O)c2ccccc12 ZINC000409072518 556946257 /nfs/dbraw/zinc/94/62/57/556946257.db2.gz CKJTWEDELWTDKX-RVDMUPIBSA-N 0 2 441.270 4.822 40 10 IJCBLN CC[C@@H](C)Oc1ccc(/C=C2\C(=O)NC(=O)N(c3cccc(Cl)c3Cl)C2=O)cc1 ZINC000409101148 556955772 /nfs/dbraw/zinc/95/57/72/556955772.db2.gz VYLOTVUNCPNFRK-PKVLTRFUSA-N 0 2 433.291 4.837 40 10 IJCBLN Cc1cccc(-n2cccc2/C=C2\C(=O)NC(=O)N(c3cccc(Cl)c3C)C2=O)c1C ZINC000409237753 557019387 /nfs/dbraw/zinc/01/93/87/557019387.db2.gz LLZQWHDPZHJNEW-QGOAFFKASA-N 0 2 433.895 4.722 40 10 IJCBLN CC[C@@H](C)Oc1c(/C=C2\C(=O)NC(=O)N(c3cccc(Cl)c3C)C2=O)cccc1OC ZINC000409230625 557022284 /nfs/dbraw/zinc/02/22/84/557022284.db2.gz DNLOHTQZXNNRGV-MLDYKZIASA-N 0 2 442.899 4.501 40 10 IJCBLN Cc1ccc(Sc2ccc(/C=C3\C(=O)NC(=O)N(c4cccc(F)c4)C3=O)cc2)cc1 ZINC000409254409 557034482 /nfs/dbraw/zinc/03/44/82/557034482.db2.gz XDDKGLNPVUJQQW-FYJGNVAPSA-N 0 2 432.476 4.952 40 10 IJCBLN CCc1ccccc1N1C(=O)NC(=O)C(=Cc2ccc3c(c2)[C@H](C)CC(C)(C)N3C)C1=O ZINC000208191690 557078752 /nfs/dbraw/zinc/07/87/52/557078752.db2.gz VPWVHCXYQJJAJP-ZGPWBKFBSA-N 0 2 431.536 4.637 40 10 IJCBLN Cc1ccc(N2C(=O)NC(=O)C(=Cc3cc4c(cc3C)N(C)C(C)(C)C[C@@H]4C)C2=O)cc1 ZINC000208229884 557079337 /nfs/dbraw/zinc/07/93/37/557079337.db2.gz MEBGKOXUVBUVJE-RSZPVBOMSA-N 0 2 431.536 4.692 40 10 IJCBLN C[C@H]1CC(C)(C)N(C)c2ccc(/C=C3\C(=O)NC(=O)N(c4cccc(Cl)c4)C3=O)cc21 ZINC000208199637 557079493 /nfs/dbraw/zinc/07/94/93/557079493.db2.gz IFQRYAMRQZVQCK-YRIIZNAFSA-N 0 2 437.927 4.728 40 10 IJCBLN C[C@@H]1CC(C)(C)N(C)c2cc(Cl)c(/C=C3\C(=O)NC(=O)N(c4ccccc4)C3=O)cc21 ZINC000208240422 557080089 /nfs/dbraw/zinc/08/00/89/557080089.db2.gz QTPRZTSUGKSDNE-XWAFYUISSA-N 0 2 437.927 4.728 40 10 IJCBLN CCN1c2ccc(/C=C3\C(=O)NC(=O)N(c4cccc(F)c4)C3=O)cc2C(C)=CC1(C)C ZINC000208515124 557093320 /nfs/dbraw/zinc/09/33/20/557093320.db2.gz PGXZTXUABAHOFP-UDWIEESQSA-N 0 2 433.483 4.514 40 10 IJCBLN COc1ccc(C/N=N\c2cc(C)nc(NS(=O)(=O)c3ccccc3Cl)n2)cc1 ZINC000100565005 557114997 /nfs/dbraw/zinc/11/49/97/557114997.db2.gz IVISIQXYYQBQCR-FLFQWRMESA-N 0 2 431.905 4.532 40 10 IJCBLN CCc1ccc(-n2c(C)cc(/C=C3\C(=O)NC(=O)N(c4ccc(Cl)cc4)C3=O)c2C)cc1 ZINC000101399699 557123843 /nfs/dbraw/zinc/12/38/43/557123843.db2.gz IFHPYKZOWCTJPW-HYARGMPZSA-N 0 2 447.922 4.976 40 10 IJCBLN COC(=O)Cc1[nH]n(-c2ccc(F)cc2)c(=O)c1C(C)=Nc1ccc(Cl)cc1Cl ZINC000112293488 557239221 /nfs/dbraw/zinc/23/92/21/557239221.db2.gz APPKUMWZRHEIKK-ODLFYWEKSA-N 0 2 436.270 4.784 40 10 IJCBLN CN(C)c1ccc(-n2cccc2C=C2C(=O)NC(=O)N(c3cccc(Cl)c3)C2=O)cc1 ZINC000033826427 557809961 /nfs/dbraw/zinc/80/99/61/557809961.db2.gz DCZCAAKBPNRXTP-XSFVSMFZSA-N 0 2 434.883 4.703 40 10 IJCBLN CC1=NN(c2ccc(Br)c(C)c2)C(=O)C1C=Nc1c2nsnc2ccc1C ZINC000408531010 555728661 /nfs/dbraw/zinc/72/86/61/555728661.db2.gz KAQLXAMHPQUPQM-ZROIWOOFSA-N 0 2 442.342 4.789 40 10 IJCBLN Cc1[nH]n(-c2ccc(C)c(C)c2)c(=O)c1C=C1C(=O)NC(=O)N(c2cccc(C)c2C)C1=O ZINC000016350014 556602019 /nfs/dbraw/zinc/60/20/19/556602019.db2.gz UMTJUUKYKQYOCF-UDWIEESQSA-N 0 2 444.491 4.627 40 10 IJCBLN Cc1ccc(N2C(=O)NC(=O)C(=Cc3ccccc3OCc3cccc(C)c3)C2=O)cc1 ZINC000408789550 556856287 /nfs/dbraw/zinc/85/62/87/556856287.db2.gz MGANIKQDEUDYLT-PXLXIMEGSA-N 0 2 426.472 4.549 40 10 IJCBLN CCOc1ccc(Cl)cc1/C=C1\C(=O)NC(=O)N(c2ccc(Cl)c(Cl)c2)C1=O ZINC000408807267 556859325 /nfs/dbraw/zinc/85/93/25/556859325.db2.gz GRLAPFHIPGSHGG-MDWZMJQESA-N 0 2 439.682 4.712 40 10 IJCBLN Cc1cc(/C=C2\C(=O)NC(=O)N(c3ccccc3)C2=O)c(C)n1-c1ccc(F)c(Cl)c1 ZINC000408820847 556866264 /nfs/dbraw/zinc/86/62/64/556866264.db2.gz ZMWMDPZNUBNCHL-WOJGMQOQSA-N 0 2 437.858 4.553 40 10 IJCBLN O=C1NC(=O)N(c2ccc(C34CC5CC(CC(C5)C3)C4)cc2)C(=O)/C1=C/c1ccccc1F ZINC000408857299 556871202 /nfs/dbraw/zinc/87/12/02/556871202.db2.gz UFVOMGQTSSKKRC-WSDLNYQXSA-N 0 2 444.506 4.960 40 10 IJCBLN O=C1NC(=O)N(c2cccc(Cl)c2)C(=O)/C1=C/c1ccc(Cc2cccc(F)c2)cc1 ZINC000408872952 556875578 /nfs/dbraw/zinc/87/55/78/556875578.db2.gz PVBPEAWXJLCGNK-FYJGNVAPSA-N 0 2 434.854 4.736 40 10 IJCBLN Cc1cc(C)cc(COc2ccc(/C=C3\C(=O)NC(=O)N(c4ccccc4C)C3=O)cc2)c1 ZINC000408888393 556878798 /nfs/dbraw/zinc/87/87/98/556878798.db2.gz ZMWBYGSDMGEPRD-HZHRSRAPSA-N 0 2 440.499 4.857 40 10 IJCBLN Cc1cccc(N2C(=O)NC(=O)C(=Cc3ccccc3OCc3cccc(F)c3)C2=O)c1C ZINC000408897570 556883429 /nfs/dbraw/zinc/88/34/29/556883429.db2.gz YHQLKIOFSMGPMV-KGENOOAVSA-N 0 2 444.462 4.688 40 10 IJCBLN Cc1cc(N2CCCC2)ccc1/C=C1\C(=O)NC(=O)N(c2cccc(Cl)c2Cl)C1=O ZINC000408959885 556900012 /nfs/dbraw/zinc/90/00/12/556900012.db2.gz HKWDFIUAAZNCRE-FOWTUZBSSA-N 0 2 444.318 4.568 40 10 IJCBLN CCc1ccc(N2C(=O)NC(=O)C(=Cc3cc(C)n(-c4ccccc4Cl)c3C)C2=O)cc1 ZINC000408981908 556908020 /nfs/dbraw/zinc/90/80/20/556908020.db2.gz DPEMMKIGQLAWDN-ZHZULCJRSA-N 0 2 447.922 4.976 40 10 IJCBLN CCN(CC)c1ccc(/C=C2/C(=O)NC(=O)N(c3cccc(Cl)c3Cl)C2=O)cc1 ZINC000409104707 556953003 /nfs/dbraw/zinc/95/30/03/556953003.db2.gz FDPPIMHTHMRVNK-QINSGFPZSA-N 0 2 432.307 4.506 40 10 IJCBLN O=C1NC(=O)N(c2cccnc2)C(=O)/C1=C/c1ccc(Sc2ccc(Cl)cc2)cc1 ZINC000409220553 557016261 /nfs/dbraw/zinc/01/62/61/557016261.db2.gz BJPVZWCFESRGBA-XDHOZWIPSA-N 0 2 435.892 4.553 40 10 IJCBLN CC(=O)c1ccc(-c2ccc(C=C3C(=O)NC(=O)N(c4cccc(Cl)c4C)C3=O)o2)cc1 ZINC000409246275 557027908 /nfs/dbraw/zinc/02/79/08/557027908.db2.gz ADFQOJCHJYXUOQ-LDADJPATSA-N 0 2 448.862 4.777 40 10 IJCBLN Cc1ccc(N2C(=O)NC(=O)C(=Cc3ccc4c(c3)[C@@H](C)CC(C)(C)N4C)C2=O)cc1C ZINC000208191177 557078692 /nfs/dbraw/zinc/07/86/92/557078692.db2.gz HRQXHKVDUFYRKQ-RSZPVBOMSA-N 0 2 431.536 4.692 40 10 IJCBLN CCc1ccccc1N1C(=O)NC(=O)C(=Cc2ccc3c(c2)C(C)=CC(C)(C)N3CC)C1=O ZINC000208514811 557093162 /nfs/dbraw/zinc/09/31/62/557093162.db2.gz JICCOUVBLIMDLZ-RCCKNPSSSA-N 0 2 443.547 4.937 40 10 IJCBLN Cc1ccccc1N1C(=O)NC(=O)C(=Cc2ccccc2OCc2ccccc2Cl)C1=O ZINC000014133092 557421473 /nfs/dbraw/zinc/42/14/73/557421473.db2.gz VPNWXOHBHNVXNC-XMHGGMMESA-N 0 2 446.890 4.894 40 10 IJCBLN CCc1ccc(N2C(=O)NC(=O)C(=Cc3cc4c(cc3C)N(C)C(C)(C)C[C@H]4C)C2=O)cc1 ZINC000260572465 557492517 /nfs/dbraw/zinc/49/25/17/557492517.db2.gz VVUVKYWBAPAYLT-FEMWLQECSA-N 0 2 445.563 4.946 40 10 IJCBLN COC(=O)c1ccc(NC(C)=C2C(=O)N(c3ccccc3)N=C2c2ccc(OC)cc2)cc1 ZINC000019633793 557502518 /nfs/dbraw/zinc/50/25/18/557502518.db2.gz VFRZHVOAGHZLSP-QJOMJCCJSA-N 0 2 441.487 4.619 40 10 IJCBLN COC(=O)c1ccc(N=C(C)c2c(-c3ccc(OC)cc3)[nH]n(-c3ccccc3)c2=O)cc1 ZINC000019633793 557502522 /nfs/dbraw/zinc/50/25/22/557502522.db2.gz VFRZHVOAGHZLSP-QJOMJCCJSA-N 0 2 441.487 4.619 40 10 IJCBLN COc1ccc(Br)cc1C=C1C(=O)NC(=O)N(c2ccc(C)cc2C)C1=O ZINC000059860610 557827892 /nfs/dbraw/zinc/82/78/92/557827892.db2.gz VTGRZZBQQKHXMQ-XNTDXEJSSA-N 0 2 429.270 4.581 40 10 IJCBLN CCN1c2cc(C)c(/C=C3\C(=O)NC(=O)N(c4cccc(F)c4)C3=O)cc2[C@H](C)CC1(C)C ZINC000208329660 569261366 /nfs/dbraw/zinc/26/13/66/569261366.db2.gz GAPSKFDTFRTVMY-SVZNOHIVSA-N 0 2 449.526 4.913 40 10 IJCBLN Cc1ccc(N2C(=O)NC(=O)C(=Cc3ccc(OCc4ccccc4Cl)cc3)C2=O)cc1 ZINC000408779413 556853969 /nfs/dbraw/zinc/85/39/69/556853969.db2.gz WMQBJOZEOXRMFD-KGENOOAVSA-N 0 2 446.890 4.894 40 10 IJCBLN O=C1NC(=O)N(c2cc(C(F)(F)F)ccc2Cl)C(=O)/C1=C/c1ccc(Cl)cc1 ZINC000408780149 556854311 /nfs/dbraw/zinc/85/43/11/556854311.db2.gz TVQXIQMDHMEIIL-KPKJPENVSA-N 0 2 429.181 4.679 40 10 IJCBLN Cc1cc(/C=C2\C(=O)NC(=O)N(c3cccc(F)c3)C2=O)c(C)n1-c1ccc(Cl)cc1 ZINC000408783679 556855320 /nfs/dbraw/zinc/85/53/20/556855320.db2.gz OJIBRIRLEIPNGB-RGVLZGJSSA-N 0 2 437.858 4.553 40 10 IJCBLN Cc1cccc(COc2ccc(/C=C3\C(=O)NC(=O)N(c4ccccc4Cl)C3=O)cc2)c1 ZINC000408806663 556859037 /nfs/dbraw/zinc/85/90/37/556859037.db2.gz GHCYHBOVDFPYCV-XSFVSMFZSA-N 0 2 446.890 4.894 40 10 IJCBLN Cc1ccccc1N1C(=O)NC(=O)C(=Cc2ccccc2OCc2cccc(Cl)c2)C1=O ZINC000408809421 556861854 /nfs/dbraw/zinc/86/18/54/556861854.db2.gz HAYUQCJNWWOSDO-XSFVSMFZSA-N 0 2 446.890 4.894 40 10 IJCBLN Cc1cc(/C=C2\C(=O)NC(=O)N(c3ccc(C)c(C)c3)C2=O)c(C)n1-c1ccc(C)cc1C ZINC000408855413 556871875 /nfs/dbraw/zinc/87/18/75/556871875.db2.gz DDJQEYSGYKRMID-OEAKJJBVSA-N 0 2 441.531 4.994 40 10 IJCBLN O=C1NC(=O)N(c2ccccc2)C(=O)/C1=C\c1cc(Cl)ccc1Cc1cccc(F)c1 ZINC000408874452 556875839 /nfs/dbraw/zinc/87/58/39/556875839.db2.gz BTYQUEYLDYIXEQ-KGENOOAVSA-N 0 2 434.854 4.736 40 10 IJCBLN CCCOc1ccc2ccccc2c1/C=C1/C(=O)NC(=O)N(c2ccccc2CC)C1=O ZINC000408883305 556878559 /nfs/dbraw/zinc/87/85/59/556878559.db2.gz PBIUACKEJBNHSX-PGMHBOJBSA-N 0 2 428.488 4.857 40 10 IJCBLN Cc1ccc(N2C(=O)NC(=O)C(=Cc3cccc(OCc4cccc(Cl)c4)c3)C2=O)cc1 ZINC000408936003 556895739 /nfs/dbraw/zinc/89/57/39/556895739.db2.gz JMEHBZYXLYKRIT-HMAPJEAMSA-N 0 2 446.890 4.894 40 10 IJCBLN Cc1ccc(Cl)cc1N1C(=O)NC(=O)C(=Cc2cccc(OCc3ccccc3)c2)C1=O ZINC000408936473 556896013 /nfs/dbraw/zinc/89/60/13/556896013.db2.gz KAWWHYNWSPKDJV-BKUYFWCQSA-N 0 2 446.890 4.894 40 10 IJCBLN CCc1ccc(N2C(=O)NC(=O)C(=Cc3ccc4c(c3)[C@@H](C)CC(C)(C)N4C)C2=O)cc1 ZINC000208192184 557078659 /nfs/dbraw/zinc/07/86/59/557078659.db2.gz SZIFZJDEHXHZNW-YIRPMMGJSA-N 0 2 431.536 4.637 40 10 IJCBLN Cc1cc(C)cc(N2C(=O)NC(=O)/C(=C\c3ccc4c(c3)C(C)=CC(C)(C)N4C)C2=O)c1 ZINC000208446179 557087655 /nfs/dbraw/zinc/08/76/55/557087655.db2.gz RZMLJBSNOXXXAM-FYJGNVAPSA-N 0 2 429.520 4.602 40 10 IJCBLN Cc1cc2c(cc1/C=C1\C(=O)NC(=O)N(c3ccc(Cl)cc3)C1=O)C(C)=CC(C)(C)N2C ZINC000208453492 557088012 /nfs/dbraw/zinc/08/80/12/557088012.db2.gz BYOORJOVEZLDRF-UDWIEESQSA-N 0 2 449.938 4.947 40 10 IJCBLN COc1cccc(N=N[C@H]2C(=O)N(c3nc(-c4cccc([N+](=O)[O-])c4)cs3)N=C2C)c1 ZINC000100525282 557114708 /nfs/dbraw/zinc/11/47/08/557114708.db2.gz ZEMWZFFQPVRDLP-KGNHYALCSA-N 0 2 436.453 4.602 40 10 IJCBLN COc1ccc(N=N[C@@H]2C(=O)N(c3nc(-c4cccc([N+](=O)[O-])c4)cs3)N=C2C)cc1 ZINC000100525292 557114738 /nfs/dbraw/zinc/11/47/38/557114738.db2.gz GUVNZQIFQBSEIL-CCWVLBSLSA-N 0 2 436.453 4.602 40 10 IJCBLN O=C1NN(c2cccc(Cl)c2)C(=O)/C1=C/c1ccc(-c2cccc(Br)c2)o1 ZINC000001215349 557120407 /nfs/dbraw/zinc/12/04/07/557120407.db2.gz BFALLFKMZIWRHO-GZTJUZNOSA-N 0 2 443.684 4.824 40 10 IJCBLN COc1ccc(Br)cc1C=C1C(=O)NC(=O)N(c2ccc(C)c(Cl)c2)C1=O ZINC000102695448 557131331 /nfs/dbraw/zinc/13/13/31/557131331.db2.gz ZNLCFIFTQAUNAZ-ZSOIEALJSA-N 0 2 449.688 4.926 40 10 IJCBLN Cc1cccc(COc2ccccc2/C=C2\C(=O)NC(=O)N(c3ccccc3C)C2=O)c1 ZINC000014133101 557421813 /nfs/dbraw/zinc/42/18/13/557421813.db2.gz AWRFNURCTREZLF-RCCKNPSSSA-N 0 2 426.472 4.549 40 10 IJCBLN COc1cccc(N=C(C)c2c(=O)n(-c3ccc(F)cc3)[nH]c2-c2ccccc2)c1OC ZINC000017097471 557478982 /nfs/dbraw/zinc/47/89/82/557478982.db2.gz HYRJGUHEHOBRHK-JWGURIENSA-N 0 2 431.467 4.980 40 10 IJCBLN CCCCOc1ccc(Cl)cc1/C=C1/C(=O)NC(=O)N(c2ccc(C)c(C)c2)C1=O ZINC000108069127 569252154 /nfs/dbraw/zinc/25/21/54/569252154.db2.gz GBBUXPSUQHHFOG-UYRXBGFRSA-N 0 2 426.900 4.802 40 10 IJCBLN Cc1ccccc1OCCn1cccc1C=C1C(=O)NC(=O)N(c2ccc(F)cc2)C1=O ZINC000041108869 525304715 /nfs/dbraw/zinc/30/47/15/525304715.db2.gz UPFODPUXMHHFJO-HKWRFOASSA-N 0 2 433.439 4.521 40 10 IJCBLN O=C1NC(=O)N(c2ccccc2)C(=O)/C1=C\c1ccc(-c2ccc(Cl)cc2Cl)o1 ZINC000408742483 556215712 /nfs/dbraw/zinc/21/57/12/556215712.db2.gz WTQZCQKAKWUWNT-WJDWOHSUSA-N 0 2 427.243 4.920 40 10 IJCBLN CCc1ccc(-n2c(C)cc(/C=C3\C(=O)NC(=O)N(c4cccc(C)c4)C3=O)c2C)cc1 ZINC000408765250 556829660 /nfs/dbraw/zinc/82/96/60/556829660.db2.gz OPCKCMKBRSPSMY-HZHRSRAPSA-N 0 2 427.504 4.631 40 10 IJCBLN Cc1cc(/C=C2\C(=O)NC(=O)N(c3cccc(C)c3C)C2=O)c(C)n1-c1ccc(C)cc1 ZINC000408784541 556855442 /nfs/dbraw/zinc/85/54/42/556855442.db2.gz UKOHKRCPZAMRKY-HYARGMPZSA-N 0 2 427.504 4.686 40 10 IJCBLN Cc1cc(C)cc(N2C(=O)NC(=O)C(=Cc3ccc(OCc4ccccc4F)cc3)C2=O)c1 ZINC000408790880 556856259 /nfs/dbraw/zinc/85/62/59/556856259.db2.gz UEXKZJWNWUADGC-HYARGMPZSA-N 0 2 444.462 4.688 40 10 IJCBLN Cc1ccc(COc2ccc(/C=C3\C(=O)NC(=O)N(c4ccc(C)cc4C)C3=O)cc2)cc1 ZINC000408797774 556857558 /nfs/dbraw/zinc/85/75/58/556857558.db2.gz CTYAOKGWZNVPGL-HZHRSRAPSA-N 0 2 440.499 4.857 40 10 IJCBLN Cc1cccc(COc2ccc(/C=C3\C(=O)NC(=O)N(c4ccc(C)c(C)c4)C3=O)cc2)c1 ZINC000408807174 556859171 /nfs/dbraw/zinc/85/91/71/556859171.db2.gz KMHZOCSEOAKHEK-BUVRLJJBSA-N 0 2 440.499 4.857 40 10 IJCBLN Cc1cccc(N2C(=O)NC(=O)C(=Cc3ccccc3OCc3ccccc3)C2=O)c1C ZINC000408802715 556859645 /nfs/dbraw/zinc/85/96/45/556859645.db2.gz GKNJZKQDXYIKQK-RCCKNPSSSA-N 0 2 426.472 4.549 40 10 IJCBLN Cc1cccc(N2C(=O)NC(=O)C(=Cc3ccc(OCc4ccc(F)cc4)cc3)C2=O)c1C ZINC000408810673 556862426 /nfs/dbraw/zinc/86/24/26/556862426.db2.gz UJUWSFCDIQLCIX-HYARGMPZSA-N 0 2 444.462 4.688 40 10 IJCBLN CCOc1cc(Cl)cc(/C=C2\C(=O)NC(=O)N(c3ccc(Cl)c(Cl)c3)C2=O)c1 ZINC000408879674 556876020 /nfs/dbraw/zinc/87/60/20/556876020.db2.gz DMMWRIIVYWKHPU-VGOFMYFVSA-N 0 2 439.682 4.712 40 10 IJCBLN CCc1cccc(C)c1-n1c(C)cc(/C=C2\C(=O)NC(=O)N(c3cccc(F)c3)C2=O)c1C ZINC000408960574 556900511 /nfs/dbraw/zinc/90/05/11/556900511.db2.gz MWINDJDSGXPTPU-LPYMAVHISA-N 0 2 445.494 4.770 40 10 IJCBLN O=C1NC(=O)N(c2cccc(Cl)c2Cl)C(=O)/C1=C/c1cccn1-c1ccccc1F ZINC000409106516 556958889 /nfs/dbraw/zinc/95/88/89/556958889.db2.gz NUBFZXOROZAXPQ-ACCUITESSA-N 0 2 444.249 4.590 40 10 IJCBLN CC1=CC(C)(C)N(C)c2ccc(/C=C3\C(=O)NC(=O)N(c4cccc(Cl)c4)C3=O)cc21 ZINC000208446342 557087466 /nfs/dbraw/zinc/08/74/66/557087466.db2.gz VEKHKOIUJVUDMS-YBFXNURJSA-N 0 2 435.911 4.638 40 10 IJCBLN Cc1cc2c(cc1/C=C1\C(=O)NC(=O)N(c3cccc(Cl)c3)C1=O)C(C)=CC(C)(C)N2C ZINC000208453666 557087984 /nfs/dbraw/zinc/08/79/84/557087984.db2.gz RPTNCWJXEWWEPQ-RGVLZGJSSA-N 0 2 449.938 4.947 40 10 IJCBLN CC(=O)N(C)c1ccc(N=N[C@H]2C(C)=NN(c3nc(-c4ccc(C)cc4)cs3)C2=O)cc1 ZINC000100525019 557263729 /nfs/dbraw/zinc/26/37/29/557263729.db2.gz REMIZVNCYYNIED-WHEOYJBGSA-N 0 2 446.536 4.976 40 10 IJCBLN CCN1c2cc(C)c(/C=C3\C(=O)NC(=O)N(c4ccccc4)C3=O)cc2[C@@H](C)CC1(C)C ZINC000223578551 557488162 /nfs/dbraw/zinc/48/81/62/557488162.db2.gz KGKLVUISCRMRCU-JPOGYNCRSA-N 0 2 431.536 4.774 40 10 IJCBLN CCOc1cccc(N2C(=O)NC(=O)C(=Cc3cc(F)c(N4CCCC4)cc3C)C2=O)c1 ZINC000033728585 569259783 /nfs/dbraw/zinc/25/97/83/569259783.db2.gz YOSOHYZWIOMJGH-XDHOZWIPSA-N 0 2 437.471 4.640 40 10 IJCBLN Cc1cc(C=C2C(=O)NC(=O)N(c3ccc(Br)cc3C)C2=O)cc(C)c1O ZINC000038181463 569260186 /nfs/dbraw/zinc/26/01/86/569260186.db2.gz BYSYKPXKKGLRSJ-OQLLNIDSSA-N 0 2 429.270 4.587 40 10 IJCBLN Cc1ccc(N2C(=O)NC(=O)C(=CNC(=O)Nc3ccc(Cl)c(Cl)c3)C2=O)cc1C ZINC000016312234 524924449 /nfs/dbraw/zinc/92/44/49/524924449.db2.gz RFMRPOWLZRCLSV-ZROIWOOFSA-N 0 2 447.278 4.739 40 10 IJCBLN CCCCCCOc1ccc(/C=C2/C(=O)NC(=O)N(c3ccccc3)C2=O)cc1OCC ZINC000408539463 555790208 /nfs/dbraw/zinc/79/02/08/555790208.db2.gz HWFOAVRPXLJWMT-SILNSSARSA-N 0 2 436.508 4.711 40 10 IJCBLN Cc1nn(-c2ccc([N+](=O)[O-])cc2)c(C)c1N=CC1C(=O)N(c2ccc(C)cc2C)N=C1C ZINC000408757728 556570853 /nfs/dbraw/zinc/57/08/53/556570853.db2.gz POPIYNTUITZJFT-FYJGNVAPSA-N 0 2 444.495 4.733 40 10 IJCBLN Cc1c(C=C2C(=O)NC(=O)N(c3ccc(C)cc3)C2=O)c2ccccc2n1Cc1ccccc1 ZINC000016292716 556598477 /nfs/dbraw/zinc/59/84/77/556598477.db2.gz QODPTDCMKBSBAR-JLPGSUDCSA-N 0 2 449.510 4.973 40 10 IJCBLN CCOc1ccc(/C=C2\C(=O)NC(=O)N(c3ccc(Cl)cc3Cl)C2=O)cc1Cl ZINC000408779473 556853913 /nfs/dbraw/zinc/85/39/13/556853913.db2.gz XFARJTVIQMBQFI-KPKJPENVSA-N 0 2 439.682 4.712 40 10 IJCBLN Cc1cccc(COc2ccccc2/C=C2\C(=O)NC(=O)N(c3cc(C)cc(C)c3)C2=O)c1 ZINC000408780956 556854532 /nfs/dbraw/zinc/85/45/32/556854532.db2.gz OKYJZLXCMWXIQP-HZHRSRAPSA-N 0 2 440.499 4.857 40 10 IJCBLN Cc1ccc(COc2ccc(/C=C3\C(=O)NC(=O)N(c4ccccc4C)C3=O)cc2)cc1C ZINC000408804830 556860490 /nfs/dbraw/zinc/86/04/90/556860490.db2.gz ZOWJAPAYBGBPKB-HZHRSRAPSA-N 0 2 440.499 4.857 40 10 IJCBLN Cc1ccc(Cl)cc1N1C(=O)NC(=O)C(=Cc2ccccc2OCc2ccccc2)C1=O ZINC000408813324 556861435 /nfs/dbraw/zinc/86/14/35/556861435.db2.gz MXNCQSHXIUAGRD-DEDYPNTBSA-N 0 2 446.890 4.894 40 10 IJCBLN Cc1c(Cl)cccc1N1C(=O)NC(=O)C(=Cc2ccc(OCc3ccccc3)cc2)C1=O ZINC000408814776 556865360 /nfs/dbraw/zinc/86/53/60/556865360.db2.gz WFJXBMGLNDXPEA-XSFVSMFZSA-N 0 2 446.890 4.894 40 10 IJCBLN COc1cc(/C=C2/C(=O)NC(=O)N(c3ccccc3)C2=O)ccc1Cc1ccccc1Cl ZINC000408868930 556874184 /nfs/dbraw/zinc/87/41/84/556874184.db2.gz PZXIMWZHTNCVTL-DEDYPNTBSA-N 0 2 446.890 4.606 40 10 IJCBLN CCc1ccccc1N1C(=O)NC(=O)C(=Cc2ccc(Cc3cccc(F)c3)cc2)C1=O ZINC000408869663 556874373 /nfs/dbraw/zinc/87/43/73/556874373.db2.gz SYODXNAONRFMLU-JWGURIENSA-N 0 2 428.463 4.645 40 10 IJCBLN Cc1cccc(N2C(=O)NC(=O)C(=Cc3ccc(Cc4ccccc4F)cc3)C2=O)c1C ZINC000408870465 556874762 /nfs/dbraw/zinc/87/47/62/556874762.db2.gz FAKANQUOGIXALQ-RCCKNPSSSA-N 0 2 428.463 4.700 40 10 IJCBLN O=C1NC(=O)N(c2ccc(Cl)cc2)C(=O)/C1=C/c1ccc(Cc2cccc(F)c2)cc1 ZINC000408873835 556875758 /nfs/dbraw/zinc/87/57/58/556875758.db2.gz XGTRDVQAAJIEEH-KGENOOAVSA-N 0 2 434.854 4.736 40 10 IJCBLN CCc1ccccc1N1C(=O)NC(=O)C(=Cc2ccccc2OCc2cccc(F)c2)C1=O ZINC000408895219 556880606 /nfs/dbraw/zinc/88/06/06/556880606.db2.gz UHFIXWFWXSJVES-QNGOZBTKSA-N 0 2 444.462 4.634 40 10 IJCBLN O=C1NC(=O)N(c2ccc(Cl)c(Cl)c2)C(=O)/C1=C/c1c(O)ccc2ccccc12 ZINC000408896400 556881265 /nfs/dbraw/zinc/88/12/65/556881265.db2.gz NISYMJFVHXYTJF-XNTDXEJSSA-N 0 2 427.243 4.519 40 10 IJCBLN Cc1cc(C)cc(N2C(=O)NC(=O)C(=Cc3c(OC(C)C)ccc4ccccc43)C2=O)c1 ZINC000408897968 556883398 /nfs/dbraw/zinc/88/33/98/556883398.db2.gz JYRHDOMZVUAZDP-HYARGMPZSA-N 0 2 428.488 4.910 40 10 IJCBLN CC[C@H](C)Oc1ccc2ccccc2c1/C=C1\C(=O)NC(=O)N(c2ccc(F)cc2)C1=O ZINC000408903116 556885592 /nfs/dbraw/zinc/88/55/92/556885592.db2.gz POAMBVWRMWDXAF-HBBMIWKISA-N 0 2 432.451 4.823 40 10 IJCBLN Cc1ccc(N2C(=O)NC(=O)C(=Cc3cccc(OCc4ccccc4)c3)C2=O)cc1Cl ZINC000408934179 556895164 /nfs/dbraw/zinc/89/51/64/556895164.db2.gz CSZIGQJNLBJWPY-BKUYFWCQSA-N 0 2 446.890 4.894 40 10 IJCBLN Cc1ccc(C)c(N2C(=O)NC(=O)C(=Cc3cccc(OCc4ccccc4F)c3)C2=O)c1 ZINC000408934225 556895248 /nfs/dbraw/zinc/89/52/48/556895248.db2.gz DAPSUFSBVJWQAC-STZFKDTASA-N 0 2 444.462 4.688 40 10 IJCBLN Cc1ccc(COc2cccc(/C=C3/C(=O)NC(=O)N(c4cccc(Cl)c4)C3=O)c2)cc1 ZINC000408940975 556896690 /nfs/dbraw/zinc/89/66/90/556896690.db2.gz WBHLWHFMTCAQMV-XKZIYDEJSA-N 0 2 446.890 4.894 40 10 IJCBLN Cc1cccc(N2C(=O)NC(=O)C(=Cc3cccc(OCc4cccc(F)c4)c3)C2=O)c1C ZINC000408940776 556896717 /nfs/dbraw/zinc/89/67/17/556896717.db2.gz VBVZKLGVCUWOQD-HMAPJEAMSA-N 0 2 444.462 4.688 40 10 IJCBLN O=C1NC(=O)N(c2ccc(C34CC5CC(CC(C5)C3)C4)cc2)C(=O)/C1=C/c1ccc(F)cc1 ZINC000408948779 556898666 /nfs/dbraw/zinc/89/86/66/556898666.db2.gz GQXYIJXBAITGRY-FSJBWODESA-N 0 2 444.506 4.960 40 10 IJCBLN Cc1cc(C=C2C(=O)NC(=O)N(c3ccc(C)cc3)C2=O)c(C)n1-c1c(C)cc(C)cc1C ZINC000408961179 556900969 /nfs/dbraw/zinc/90/09/69/556900969.db2.gz BEWHEQOAMMKYIZ-OEAKJJBVSA-N 0 2 441.531 4.994 40 10 IJCBLN CC(=O)c1cccc(-c2ccc(C=C3C(=O)NC(=O)N(c4ccc(C)c(Cl)c4)C3=O)o2)c1 ZINC000408984482 556910788 /nfs/dbraw/zinc/91/07/88/556910788.db2.gz RLVYSHVTJOYMBH-UNOMPAQXSA-N 0 2 448.862 4.777 40 10 IJCBLN C[C@@H]1CC(C)(C)N(C)c2ccc(/C=C3\C(=O)NC(=O)N(c4ccc(Cl)cc4)C3=O)cc21 ZINC000208198429 557079399 /nfs/dbraw/zinc/07/93/99/557079399.db2.gz GWCXLWGUAJMWNK-ONDHQXCVSA-N 0 2 437.927 4.728 40 10 IJCBLN CCc1ccccc1N1C(=O)NC(=O)C(=Cc2ccc3c(c2)C(C)=CC(C)(C)N3C)C1=O ZINC000208447305 557087685 /nfs/dbraw/zinc/08/76/85/557087685.db2.gz OCYGPUOLWQCRQU-XSFVSMFZSA-N 0 2 429.520 4.547 40 10 IJCBLN Cc1cccc(N2C(=O)NC(=O)/C(=C\c3cc4c(cc3C)N(C)C(C)(C)C=C4C)C2=O)c1 ZINC000208453101 557087989 /nfs/dbraw/zinc/08/79/89/557087989.db2.gz AMKQNZGHHJFVFY-FYJGNVAPSA-N 0 2 429.520 4.602 40 10 IJCBLN CCc1ccccc1N1C(=O)NC(=O)C(=Cc2cc3c(cc2C)N(C)C(C)(C)C=C3C)C1=O ZINC000208454484 557088315 /nfs/dbraw/zinc/08/83/15/557088315.db2.gz QHQQWLUJZCOKMT-KGENOOAVSA-N 0 2 443.547 4.856 40 10 IJCBLN Cc1ccc(COc2ccc(/C=C3\C(=O)NC(=O)N(c4ccc(Cl)cc4)C3=O)cc2)cc1 ZINC000101402311 557124142 /nfs/dbraw/zinc/12/41/42/557124142.db2.gz OCRQNPSKNFOTPW-HYARGMPZSA-N 0 2 446.890 4.894 40 10 IJCBLN Cc1ccc(N2C(=O)NC(=O)C(=Cc3cc4c(cc3C)N(C)C(C)(C)C[C@H]4C)C2=O)cc1 ZINC000260567651 557296762 /nfs/dbraw/zinc/29/67/62/557296762.db2.gz MEBGKOXUVBUVJE-VYVDHXHBSA-N 0 2 431.536 4.692 40 10 IJCBLN COC(=O)c1ccccc1N=C(C)c1c(-c2ccc(OC)cc2)[nH]n(-c2ccccc2)c1=O ZINC000019633721 557502496 /nfs/dbraw/zinc/50/24/96/557502496.db2.gz NEZWKXAMKQMIRE-QJOMJCCJSA-N 0 2 441.487 4.619 40 10 IJCBLN CCOc1ccc(Br)cc1C=C1C(=O)NC(=O)N(c2cccc(C)c2)C1=O ZINC000033409718 557808051 /nfs/dbraw/zinc/80/80/51/557808051.db2.gz KPZRVXFNZFNODX-LFIBNONCSA-N 0 2 429.270 4.663 40 10 IJCBLN CCn1nc(C)c(N=CC2C(=O)N(c3ccc(Br)c(C)c3C)N=C2C)c1C ZINC000408534283 555750921 /nfs/dbraw/zinc/75/09/21/555750921.db2.gz QCYFZUKDBLPVBR-YBEGLDIGSA-N 0 2 430.350 4.618 40 10 IJCBLN Cc1cc(/C=C2\C(=O)NC(=O)N(c3ccc(Cl)cc3)C2=O)c(C)n1-c1ccccc1F ZINC000408777838 556853535 /nfs/dbraw/zinc/85/35/35/556853535.db2.gz JXYVJCDHVNYEAA-LDADJPATSA-N 0 2 437.858 4.553 40 10 IJCBLN Cc1cc(C=C2C(=O)NC(=O)N(c3ccc(C)cc3)C2=O)c(C)n1-c1ccc(C)cc1C ZINC000408782008 556854766 /nfs/dbraw/zinc/85/47/66/556854766.db2.gz VBIXKZAFGIPONK-HYARGMPZSA-N 0 2 427.504 4.686 40 10 IJCBLN Cc1cc(C=C2C(=O)NC(=O)N(c3cc(C)cc(C)c3)C2=O)c(C)n1-c1cc(C)ccc1C ZINC000408781668 556856052 /nfs/dbraw/zinc/85/60/52/556856052.db2.gz CPMQXQYFJVWWHT-OEAKJJBVSA-N 0 2 441.531 4.994 40 10 IJCBLN CCCOc1ccc2ccccc2c1/C=C1\C(=O)NC(=O)N(c2ccc(OCC)cc2)C1=O ZINC000408806002 556860973 /nfs/dbraw/zinc/86/09/73/556860973.db2.gz DOZACOLHSHJCEP-CJLVFECKSA-N 0 2 444.487 4.694 40 10 IJCBLN Cc1ccc(N2C(=O)NC(=O)C(=Cc3ccc(OCc4ccccc4)c(Cl)c3)C2=O)cc1 ZINC000408810138 556862208 /nfs/dbraw/zinc/86/22/08/556862208.db2.gz OYIQTAKNYVZOIU-DEDYPNTBSA-N 0 2 446.890 4.894 40 10 IJCBLN CCOc1c(Cl)cc(/C=C2\C(=O)NC(=O)N(c3ccc(C)c(C)c3)C2=O)cc1Cl ZINC000408852048 556869807 /nfs/dbraw/zinc/86/98/07/556869807.db2.gz QQQAKEXAMIBBGY-OVCLIPMQSA-N 0 2 433.291 4.675 40 10 IJCBLN Cc1ccc(N2C(=O)NC(=O)C(=Cc3ccccc3Cc3ccccc3Cl)C2=O)cc1 ZINC000408867880 556873886 /nfs/dbraw/zinc/87/38/86/556873886.db2.gz MIGFZMIKFYWOBV-RCCKNPSSSA-N 0 2 430.891 4.906 40 10 IJCBLN CCc1ccccc1N1C(=O)NC(=O)C(=Cc2ccc(OCc3ccc(C)cc3)cc2)C1=O ZINC000408878482 556877447 /nfs/dbraw/zinc/87/74/47/556877447.db2.gz BEEGOVYUNOCBEX-KQWNVCNZSA-N 0 2 440.499 4.803 40 10 IJCBLN O=C1NC(=O)N(c2ccccc2F)C(=O)/C1=C/c1ccccc1Cc1ccccc1Cl ZINC000408884192 556877727 /nfs/dbraw/zinc/87/77/27/556877727.db2.gz XAXGDEVTJGUTGD-JXAWBTAJSA-N 0 2 434.854 4.736 40 10 IJCBLN O=C1NC(=O)N(c2ccc(Cl)cc2)C(=O)/C1=C\c1ccccc1Cc1ccccc1F ZINC000408883847 556877749 /nfs/dbraw/zinc/87/77/49/556877749.db2.gz RKKZAFTYMQTIAI-XSFVSMFZSA-N 0 2 434.854 4.736 40 10 IJCBLN Cc1cc(C)cc(COc2ccccc2/C=C2/C(=O)NC(=O)N(c3ccccc3F)C2=O)c1 ZINC000408885456 556878003 /nfs/dbraw/zinc/87/80/03/556878003.db2.gz AGGHVRMAGIZYLA-ZHZULCJRSA-N 0 2 444.462 4.688 40 10 IJCBLN O=C1NC(=O)N(c2ccccc2Cl)C(=O)/C1=C/c1ccc(Cc2ccccc2F)cc1 ZINC000408883065 556878539 /nfs/dbraw/zinc/87/85/39/556878539.db2.gz SXORKPOEVZVABN-NBVRZTHBSA-N 0 2 434.854 4.736 40 10 IJCBLN CC[C@H](C)Oc1ccc(/C=C2\C(=O)NC(=O)N(c3ccc(Cl)cc3)C2=O)cc1Cl ZINC000408896654 556881249 /nfs/dbraw/zinc/88/12/49/556881249.db2.gz GXRNETMIGYDMEV-SEJMYLSOSA-N 0 2 433.291 4.837 40 10 IJCBLN Cc1ccccc1/C=C1\C(=O)NC(=O)N(c2ccc(OCc3ccc(Cl)cc3)cc2)C1=O ZINC000408933908 556895323 /nfs/dbraw/zinc/89/53/23/556895323.db2.gz CDHBKRMTQQOYCB-HYARGMPZSA-N 0 2 446.890 4.894 40 10 IJCBLN Cc1ccc(N2C(=O)NC(=O)C(=Cc3cccc(OCc4ccc(Cl)cc4)c3)C2=O)cc1 ZINC000408936552 556895940 /nfs/dbraw/zinc/89/59/40/556895940.db2.gz LAOQMSUTTBHZFW-HMAPJEAMSA-N 0 2 446.890 4.894 40 10 IJCBLN O=C1NC(=O)N(c2ccc(OCc3ccc(Cl)cc3)cc2)C(=O)/C1=C/c1cccs1 ZINC000408937753 556897024 /nfs/dbraw/zinc/89/70/24/556897024.db2.gz ONMWKHQGCUBPOB-XDHOZWIPSA-N 0 2 438.892 4.647 40 10 IJCBLN O=C1NC(=O)N(c2ccc(C34CC5CC(CC(C5)C3)C4)cc2)C(=O)/C1=C/c1cccc(F)c1 ZINC000408951758 556899213 /nfs/dbraw/zinc/89/92/13/556899213.db2.gz MNYCJEBPNXYEDQ-FSJBWODESA-N 0 2 444.506 4.960 40 10 IJCBLN CCc1ccc(N2C(=O)NC(=O)C(=Cc3ccc(OCc4cccc(C)c4)cc3)C2=O)cc1 ZINC000408983620 556908516 /nfs/dbraw/zinc/90/85/16/556908516.db2.gz GVMWJOZJYFDKAX-JLPGSUDCSA-N 0 2 440.499 4.803 40 10 IJCBLN O=C1NC(=O)N(c2ccc(Cl)c(Cl)c2)C(=O)/C1=C/c1cc(Cl)cc(Cl)c1O ZINC000409046662 556930298 /nfs/dbraw/zinc/93/02/98/556930298.db2.gz LDAOLCBHFDFNLK-ONNFQVAWSA-N 0 2 446.073 4.672 40 10 IJCBLN CC[C@@H](C)Oc1ccccc1/C=C1\C(=O)NC(=O)N(c2cccc(Cl)c2Cl)C1=O ZINC000409088864 556951105 /nfs/dbraw/zinc/95/11/05/556951105.db2.gz LYSGCMNXCLCRMZ-SLQMCABGSA-N 0 2 433.291 4.837 40 10 IJCBLN CC[C@H](C)Oc1ccccc1/C=C1\C(=O)NC(=O)N(c2cccc(Cl)c2Cl)C1=O ZINC000409088861 556951115 /nfs/dbraw/zinc/95/11/15/556951115.db2.gz LYSGCMNXCLCRMZ-SEVUAYLXSA-N 0 2 433.291 4.837 40 10 IJCBLN CCOc1ccc(Cl)cc1/C=C1\C(=O)NC(=O)N(c2ccc(Cl)cc2Cl)C1=O ZINC000409099539 556954596 /nfs/dbraw/zinc/95/45/96/556954596.db2.gz UAKVINRDKNEDJW-MDWZMJQESA-N 0 2 439.682 4.712 40 10 IJCBLN Cc1ccccc1-n1cccc1/C=C1\C(=O)NC(=O)N(c2cccc(Cl)c2Cl)C1=O ZINC000409099885 556954939 /nfs/dbraw/zinc/95/49/39/556954939.db2.gz MOMIUPBFDSDZHN-NTCAYCPXSA-N 0 2 440.286 4.759 40 10 IJCBLN O=C1NC(=O)N(c2ccc(OCc3ccccc3)cc2)C(=O)/C1=C/c1ccc(Cl)cc1 ZINC000409212118 557006894 /nfs/dbraw/zinc/00/68/94/557006894.db2.gz PAZSTPSSOSFFSD-KGENOOAVSA-N 0 2 432.863 4.585 40 10 IJCBLN Cc1cc2c(cc1/C=C1\C(=O)NC(=O)N(c3ccccc3F)C1=O)[C@H](C)CC(C)(C)N2C ZINC000208231866 557079871 /nfs/dbraw/zinc/07/98/71/557079871.db2.gz MAFNQIMMLWWGON-GYZOOYGHSA-N 0 2 435.499 4.523 40 10 IJCBLN COC(=O)c1ccccc1N=C(C)c1c(=O)n(-c2ccc(F)cc2)[nH]c1-c1ccccc1 ZINC000103921318 557140913 /nfs/dbraw/zinc/14/09/13/557140913.db2.gz BIRJYKBFKNUKGV-JWGURIENSA-N 0 2 429.451 4.749 40 10 IJCBLN CCc1ccc(-n2c(C)cc(/C=C3\C(=O)NC(=O)N(c4ccccc4C)C3=O)c2C)cc1 ZINC000014132758 557421451 /nfs/dbraw/zinc/42/14/51/557421451.db2.gz SPZZMNIGOCCRGM-PXLXIMEGSA-N 0 2 427.504 4.631 40 10 IJCBLN CCOc1ccc(OCC)c(N2C(=O)NC(=O)C(=Cc3c(C)[nH]c4ccccc43)C2=O)c1 ZINC000059104838 557814268 /nfs/dbraw/zinc/81/42/68/557814268.db2.gz SPVZUAHUZBLYGK-QGOAFFKASA-N 0 2 433.464 4.780 40 10 IJCBLN CCOc1ccc(Br)cc1C=C1C(=O)NC(=O)N(c2ccc(C)cc2C)C1=O ZINC000059860526 557827825 /nfs/dbraw/zinc/82/78/25/557827825.db2.gz LFBYLXAXYVTZIV-LFIBNONCSA-N 0 2 443.297 4.971 40 10 IJCBLN O=C1C=CC(=NNc2ccc(Cl)cc2Cl)C=C1C=Cc1[nH]c(=O)[nH]c(=O)c1[N+](=O)[O-] ZINC000108922076 569260951 /nfs/dbraw/zinc/26/09/51/569260951.db2.gz UGFFAOQOHSYMGV-YQUBBGPRSA-N 0 2 448.222 4.570 40 10 IJCBLN CCOc1ccc(N2C(=O)NC(=O)C(=Cc3ccc(-c4cccc(Cl)c4)o3)C2=O)cc1 ZINC000408741166 556213690 /nfs/dbraw/zinc/21/36/90/556213690.db2.gz OFLVTLOGGWZEKG-CPNJWEJPSA-N 0 2 436.851 4.665 40 10 IJCBLN Cc1ccc(-c2ccc(C=C3C(=O)NC(=O)N(c4ccc5c(c4)OCO5)C3=O)o2)c(C)c1 ZINC000032109644 556530342 /nfs/dbraw/zinc/53/03/42/556530342.db2.gz QKMRSMOWGCHPPX-WQRHYEAKSA-N 0 2 430.416 4.799 40 10 IJCBLN Cc1cc(C=C2C(=O)NC(=O)N(c3ccc(C)cc3)C2=O)c(C)n1-c1c(C)cccc1C ZINC000408771844 556847666 /nfs/dbraw/zinc/84/76/66/556847666.db2.gz JMYKYAFKWKQCPP-HYARGMPZSA-N 0 2 427.504 4.686 40 10 IJCBLN Cc1ccc(Cl)cc1N1C(=O)NC(=O)C(=Cc2cc(Cl)ccc2OC(C)C)C1=O ZINC000408801242 556858459 /nfs/dbraw/zinc/85/84/59/556858459.db2.gz SSQAURHYQZLXBU-CXUHLZMHSA-N 0 2 433.291 4.755 40 10 IJCBLN CC(C)Oc1ccc2ccccc2c1/C=C1\C(=O)NC(=O)N(c2cccc(Cl)c2)C1=O ZINC000408802194 556859439 /nfs/dbraw/zinc/85/94/39/556859439.db2.gz YJYMLPZOUTWWDS-DEDYPNTBSA-N 0 2 434.879 4.947 40 10 IJCBLN Cc1ccc(N2C(=O)NC(=O)C(=Cc3ccccc3OCc3cccc(F)c3)C2=O)cc1C ZINC000408859413 556872121 /nfs/dbraw/zinc/87/21/21/556872121.db2.gz XAMJZOKEIMYKGP-HYARGMPZSA-N 0 2 444.462 4.688 40 10 IJCBLN Cc1cccc(N2C(=O)NC(=O)C(=Cc3ccc(Cc4ccccc4Cl)cc3)C2=O)c1 ZINC000408876140 556876584 /nfs/dbraw/zinc/87/65/84/556876584.db2.gz NKPATRKDJOHWCH-RCCKNPSSSA-N 0 2 430.891 4.906 40 10 IJCBLN Cc1cccc(N2C(=O)NC(=O)C(=Cc3ccc(Cc4cccc(F)c4)cc3)C2=O)c1C ZINC000408881589 556878198 /nfs/dbraw/zinc/87/81/98/556878198.db2.gz NPJGATWIXDKKLZ-PXLXIMEGSA-N 0 2 428.463 4.700 40 10 IJCBLN O=C1NC(=O)N(c2ccccc2F)C(=O)/C1=C\c1ccc(Cc2ccccc2Cl)cc1 ZINC000408882902 556878526 /nfs/dbraw/zinc/87/85/26/556878526.db2.gz RUAYETUXQUIITG-JXAWBTAJSA-N 0 2 434.854 4.736 40 10 IJCBLN Cc1cc(/C=C2\C(=O)NC(=O)N(c3cccc(F)c3)C2=O)c(C)n1-c1ccc(C)c(C)c1 ZINC000408913975 556889333 /nfs/dbraw/zinc/88/93/33/556889333.db2.gz WPMYFZHUSHRTOM-WSDLNYQXSA-N 0 2 431.467 4.516 40 10 IJCBLN O=C1NC(=O)N(c2ccccc2)C(=O)/C1=C\c1cccc(OCc2ccccc2Cl)c1 ZINC000408935527 556895747 /nfs/dbraw/zinc/89/57/47/556895747.db2.gz HOZFCOQYTGWBFU-ZHZULCJRSA-N 0 2 432.863 4.585 40 10 IJCBLN CCOc1cccc(N2C(=O)NC(=O)C(=Cc3ccc(O[C@@H](C)CC)c(Cl)c3)C2=O)c1 ZINC000409014742 556920503 /nfs/dbraw/zinc/92/05/03/556920503.db2.gz IZPKPUYAVSBDPF-BGARDKSCSA-N 0 2 442.899 4.582 40 10 IJCBLN Cc1ccc(-n2cccc2/C=C2\C(=O)NC(=O)N(c3cccc(Cl)c3C)C2=O)cc1C ZINC000409224494 557013364 /nfs/dbraw/zinc/01/33/64/557013364.db2.gz HXZSPDZXEIPBPD-CPNJWEJPSA-N 0 2 433.895 4.722 40 10 IJCBLN Cc1cc2c(cc1/C=C1\C(=O)NC(=O)N(c3ccccc3C)C1=O)[C@@H](C)CC(C)(C)N2C ZINC000208230659 557079741 /nfs/dbraw/zinc/07/97/41/557079741.db2.gz AWIQGKVNJAPGDF-NNIWKIFQSA-N 0 2 431.536 4.692 40 10 IJCBLN Cc1cccc(N2C(=O)NC(=O)/C(=C\c3cc4c(cc3Cl)N(C)C(C)(C)C=C4C)C2=O)c1 ZINC000208475832 557092623 /nfs/dbraw/zinc/09/26/23/557092623.db2.gz PXFMJHWVTWSQKX-YBFXNURJSA-N 0 2 449.938 4.947 40 10 IJCBLN CC(=O)Nc1ccc(N=N[C@@H]2C(C)=NN(c3nc(-c4ccc(C)cc4)cs3)C2=O)cc1 ZINC000100510922 557115741 /nfs/dbraw/zinc/11/57/41/557115741.db2.gz BWVYWJWKOBRNLX-RMBMZXQHSA-N 0 2 432.509 4.952 40 10 IJCBLN Cc1ccccc1N1C(=O)NC(=O)C(=Cc2ccccc2OCc2ccc(Cl)cc2)C1=O ZINC000014133093 557421764 /nfs/dbraw/zinc/42/17/64/557421764.db2.gz RZVCMJPWNKEYGQ-XSFVSMFZSA-N 0 2 446.890 4.894 40 10 IJCBLN CCn1c(=O)oc2cc(S(=O)(=O)Nc3nc(-c4ccc(Cl)cc4)cs3)c(C)cc21 ZINC000223359851 557462329 /nfs/dbraw/zinc/46/23/29/557462329.db2.gz JQGGBGCFBXAQGI-UHFFFAOYSA-N 0 2 449.941 4.501 40 10 IJCBLN CC[C@@H](C)Oc1c(Cl)cc(/C=C2/C(=O)NN(c3ccccc3)C2=O)cc1Br ZINC000108136049 569260788 /nfs/dbraw/zinc/26/07/88/569260788.db2.gz SMMKLHAJWPCRTL-CDCQXCROSA-N 0 2 449.732 4.741 40 10 IJCBLN CCN1c2ccc(/C=C3\C(=O)NC(=O)N(c4cccc(C)c4)C3=O)cc2[C@H](C)CC1(C)C ZINC000208313601 569261262 /nfs/dbraw/zinc/26/12/62/569261262.db2.gz YOLYKVVVUNWYNG-AQRZYSDFSA-N 0 2 431.536 4.774 40 10 IJCBLN O=C1NC(=O)N(c2cccc3ccccc32)C(=O)C1=CNc1ccc(Cl)cc1Cl ZINC000408526183 555715270 /nfs/dbraw/zinc/71/52/70/555715270.db2.gz AFEOONDYCXBQPC-RVDMUPIBSA-N 0 2 426.259 4.725 40 10 IJCBLN CCOc1ccc(N2C(=O)NC(=O)C(=Cc3ccc(-c4ccc(Cl)cc4)o3)C2=O)cc1 ZINC000408740740 556212962 /nfs/dbraw/zinc/21/29/62/556212962.db2.gz MADITLGVNFAHID-CPNJWEJPSA-N 0 2 436.851 4.665 40 10 IJCBLN CCOc1ccc(/C=C2\C(=O)NC(=O)N(c3ccc(Cl)c(Cl)c3)C2=O)cc1Cl ZINC000408769665 556847060 /nfs/dbraw/zinc/84/70/60/556847060.db2.gz YUVCEWIYVMRTLD-KPKJPENVSA-N 0 2 439.682 4.712 40 10 IJCBLN O=C1NC(=O)N(c2ccccc2)C(=O)/C1=C/c1ccc(OCc2cccc(Cl)c2)cc1 ZINC000408797554 556857570 /nfs/dbraw/zinc/85/75/70/556857570.db2.gz GQNCGHQSKNQAOJ-KGENOOAVSA-N 0 2 432.863 4.585 40 10 IJCBLN Cc1ccc(COc2ccc(/C=C3\C(=O)NC(=O)N(c4cccc(Cl)c4)C3=O)cc2)cc1 ZINC000408809138 556861933 /nfs/dbraw/zinc/86/19/33/556861933.db2.gz KDXUEDNQQNHPBB-LPYMAVHISA-N 0 2 446.890 4.894 40 10 IJCBLN CCc1ccc(N2C(=O)NC(=O)C(=Cc3ccccc3Cc3ccccc3F)C2=O)cc1 ZINC000408868945 556874094 /nfs/dbraw/zinc/87/40/94/556874094.db2.gz OKNVEOVHZDVYRV-CJLVFECKSA-N 0 2 428.463 4.645 40 10 IJCBLN O=C1NC(=O)N(c2ccccc2)C(=O)/C1=C\c1cc(Cl)ccc1Cc1ccccc1F ZINC000408870718 556874680 /nfs/dbraw/zinc/87/46/80/556874680.db2.gz WMIHXXJDDMSDBC-XSFVSMFZSA-N 0 2 434.854 4.736 40 10 IJCBLN Cc1ccc(C)c(N2C(=O)NC(=O)C(=Cc3ccc(Cc4cccc(F)c4)cc3)C2=O)c1 ZINC000408875677 556876265 /nfs/dbraw/zinc/87/62/65/556876265.db2.gz LETYFTWYNQROKB-PXLXIMEGSA-N 0 2 428.463 4.700 40 10 IJCBLN CCOc1c(Cl)cc(Cl)cc1/C=C1\C(=O)NC(=O)N(c2ccc(Cl)cc2)C1=O ZINC000409041074 556928007 /nfs/dbraw/zinc/92/80/07/556928007.db2.gz ICNHVGPVQYNKMO-RIYZIHGNSA-N 0 2 439.682 4.712 40 10 IJCBLN CCOc1ccccc1N1C(=O)NC(=O)C(=Cc2ccc(-c3ccc(Cl)cc3)o2)C1=O ZINC000409234872 557025929 /nfs/dbraw/zinc/02/59/29/557025929.db2.gz NNQVWYVNHUBYQG-GHRIWEEISA-N 0 2 436.851 4.665 40 10 IJCBLN CCOc1ccccc1N1C(=O)NC(=O)C(=Cc2cc(C)n(C3CCCCC3)c2C)C1=O ZINC000409246664 557028186 /nfs/dbraw/zinc/02/81/86/557028186.db2.gz AATJPAYRLIHXCJ-HMMYKYKNSA-N 0 2 435.524 4.675 40 10 IJCBLN CCc1ccc(N2C(=O)NC(=O)C(=Cc3ccc4c(c3)[C@H](C)CC(C)(C)N4C)C2=O)cc1 ZINC000208192145 557078685 /nfs/dbraw/zinc/07/86/85/557078685.db2.gz SZIFZJDEHXHZNW-ZFMLPXDISA-N 0 2 431.536 4.637 40 10 IJCBLN Cc1cccc(N2C(=O)NC(=O)/C(=C\c3ccc4c(c3)C(C)=CC(C)(C)N4C)C2=O)c1C ZINC000208444966 557087521 /nfs/dbraw/zinc/08/75/21/557087521.db2.gz QDTSMJMYNDWGKR-DEDYPNTBSA-N 0 2 429.520 4.602 40 10 IJCBLN CCN1c2cc(C)c(/C=C3\C(=O)NC(=O)N(c4ccccc4C)C3=O)cc2C(C)=CC1(C)C ZINC000208520781 557093663 /nfs/dbraw/zinc/09/36/63/557093663.db2.gz HHNBCZMXRYTMPL-KGENOOAVSA-N 0 2 443.547 4.992 40 10 IJCBLN CC(C)N1c2ccc(/C=C3\C(=O)NC(=O)N(c4ccccc4)C3=O)cc2[C@@H](C)CC1(C)C ZINC000223551911 557484959 /nfs/dbraw/zinc/48/49/59/557484959.db2.gz HPJGMICZJYPQOG-JPOGYNCRSA-N 0 2 431.536 4.854 40 10 IJCBLN CCN(CC)c1ccc(C=C2C(=O)NC(=O)N(c3cccc(Br)c3)C2=O)cc1 ZINC000059198319 557818527 /nfs/dbraw/zinc/81/85/27/557818527.db2.gz XJPFAHHRBJEHJH-LDADJPATSA-N 0 2 442.313 4.802 40 10 IJCBLN CCOc1ccc(-c2ccc(/C=C3\C(=O)NN(c4ccc(F)c(Cl)c4)C3=O)o2)cc1 ZINC000226095697 569410037 /nfs/dbraw/zinc/41/00/37/569410037.db2.gz ABKNEJZDHVGMRO-SFQUDFHCSA-N 0 2 426.831 4.599 40 10 IJCBLN CCc1ccc(-n2c(C)cc(/C=C3\C(=O)NC(=O)N(c4cccc(C)c4C)C3=O)c2C)cc1 ZINC000408757148 556236901 /nfs/dbraw/zinc/23/69/01/556236901.db2.gz XLXTZUFJYJQVBI-HZHRSRAPSA-N 0 2 441.531 4.940 40 10 IJCBLN Cc1cc(/C=C2\C(=O)NC(=O)N(c3ccc(Cl)cc3)C2=O)c(C)n1-c1ccccc1C ZINC000408780751 556854526 /nfs/dbraw/zinc/85/45/26/556854526.db2.gz JNITXWAAGFIVSQ-DEDYPNTBSA-N 0 2 433.895 4.722 40 10 IJCBLN CCOc1c(Cl)cc(/C=C2\C(=O)NC(=O)N(c3cc(C)cc(C)c3)C2=O)cc1Cl ZINC000408787920 556856634 /nfs/dbraw/zinc/85/66/34/556856634.db2.gz AXVQOJYYPAFXDR-OVCLIPMQSA-N 0 2 433.291 4.675 40 10 IJCBLN Cc1ccc(C)c(N2C(=O)NC(=O)C(=Cc3ccccc3OCc3ccc(F)cc3)C2=O)c1 ZINC000408796632 556857129 /nfs/dbraw/zinc/85/71/29/556857129.db2.gz BDJWVCLPMBPSTG-KGENOOAVSA-N 0 2 444.462 4.688 40 10 IJCBLN Cc1cccc(COc2ccccc2/C=C2\C(=O)NC(=O)N(c3ccc(C)cc3C)C2=O)c1 ZINC000408800502 556858380 /nfs/dbraw/zinc/85/83/80/556858380.db2.gz NCGATYKACAZLKS-PXLXIMEGSA-N 0 2 440.499 4.857 40 10 IJCBLN Cc1ccc(C)c(N2C(=O)NC(=O)C(=Cc3ccc(OCc4ccc(F)cc4)cc3)C2=O)c1 ZINC000408806886 556859180 /nfs/dbraw/zinc/85/91/80/556859180.db2.gz CBZIIOVYHVXQQO-HYARGMPZSA-N 0 2 444.462 4.688 40 10 IJCBLN Cc1ccc(N2C(=O)NC(=O)C(=Cc3c(OC(C)C)ccc4ccccc43)C2=O)c(C)c1 ZINC000408812612 556862940 /nfs/dbraw/zinc/86/29/40/556862940.db2.gz PCSPQZUNMHMNFL-KGENOOAVSA-N 0 2 428.488 4.910 40 10 IJCBLN Cc1ccc(N2C(=O)NC(=O)C(=Cc3ccccc3Cc3cccc(F)c3)C2=O)c(C)c1 ZINC000408866749 556873547 /nfs/dbraw/zinc/87/35/47/556873547.db2.gz IQKDJDIIDOYEKF-PXLXIMEGSA-N 0 2 428.463 4.700 40 10 IJCBLN Cc1ccc(N2C(=O)NC(=O)C(=Cc3ccc(OCc4cccc(F)c4)cc3)C2=O)c(C)c1 ZINC000408886638 556879432 /nfs/dbraw/zinc/87/94/32/556879432.db2.gz HTEYSXXAMRHJSP-HYARGMPZSA-N 0 2 444.462 4.688 40 10 IJCBLN CCCOc1ccc(N2C(=O)NC(=O)C(=Cc3cc(Cl)ccc3OC(C)C)C2=O)cc1 ZINC000408895218 556880522 /nfs/dbraw/zinc/88/05/22/556880522.db2.gz CZQRPNSWIAZUAU-UYRXBGFRSA-N 0 2 442.899 4.582 40 10 IJCBLN Cc1ccc(N2C(=O)NC(=O)C(=Cc3ccccc3OCc3ccccc3F)C2=O)c(C)c1 ZINC000408897224 556883064 /nfs/dbraw/zinc/88/30/64/556883064.db2.gz QWMYNYSQVJBYHZ-XSFVSMFZSA-N 0 2 444.462 4.688 40 10 IJCBLN Cc1ccc(N2C(=O)NC(=O)C(=Cc3cccc(OCc4ccccc4F)c3)C2=O)c(C)c1 ZINC000408934773 556895537 /nfs/dbraw/zinc/89/55/37/556895537.db2.gz FZIJUKPPAOVMJD-STZFKDTASA-N 0 2 444.462 4.688 40 10 IJCBLN CCc1ccccc1-n1c(C)cc(/C=C2\C(=O)NC(=O)N(c3cccc(C)c3C)C2=O)c1C ZINC000408968419 556903648 /nfs/dbraw/zinc/90/36/48/556903648.db2.gz WLJYGEGZFNGJNL-PXLXIMEGSA-N 0 2 441.531 4.940 40 10 IJCBLN COc1cc(C)c(/C=C2/C(=O)NC(=O)N(c3ccc(C)c(Cl)c3)C2=O)cc1C(C)C ZINC000408981192 556907676 /nfs/dbraw/zinc/90/76/76/556907676.db2.gz AAHLFCTZQVKQTG-ZDLGFXPLSA-N 0 2 426.900 4.755 40 10 IJCBLN CCc1ccccc1N1C(=O)NC(=O)C(=Cc2ccc(O[C@H](C)CC)c(Cl)c2)C1=O ZINC000409009901 556917709 /nfs/dbraw/zinc/91/77/09/556917709.db2.gz CIPVMXSJPLCBLA-RFRKOGIWSA-N 0 2 426.900 4.746 40 10 IJCBLN CCc1ccccc1N1C(=O)NC(=O)C(=Cc2ccc3c(c2)[C@@H](C)CC(C)(C)N3C)C1=O ZINC000208191732 557078717 /nfs/dbraw/zinc/07/87/17/557078717.db2.gz VPWVHCXYQJJAJP-RZKQZQCBSA-N 0 2 431.536 4.637 40 10 IJCBLN CC1=CC(C)(C)N(C)c2ccc(/C=C3\C(=O)NC(=O)N(c4ccc(Cl)cc4)C3=O)cc21 ZINC000208446540 557087673 /nfs/dbraw/zinc/08/76/73/557087673.db2.gz OUNYLVYKVYLKCO-XDHOZWIPSA-N 0 2 435.911 4.638 40 10 IJCBLN CCN1c2ccc(/C=C3\C(=O)NC(=O)N(c4cc(C)cc(C)c4)C3=O)cc2C(C)=CC1(C)C ZINC000208502986 557093209 /nfs/dbraw/zinc/09/32/09/557093209.db2.gz BGXOHMCOKLEGMO-HYARGMPZSA-N 0 2 443.547 4.992 40 10 IJCBLN CCN1c2cc(C)c(/C=C3\C(=O)NC(=O)N(c4cccc(C)c4)C3=O)cc2C(C)=CC1(C)C ZINC000208524643 557093691 /nfs/dbraw/zinc/09/36/91/557093691.db2.gz QXHNHLFHMKYYLB-HYARGMPZSA-N 0 2 443.547 4.992 40 10 IJCBLN Cc1cccc(N2C(=O)NC(=O)C(=Cc3cc4c(cc3C)N(C)C(C)(C)C[C@H]4C)C2=O)c1 ZINC000260567360 557296893 /nfs/dbraw/zinc/29/68/93/557296893.db2.gz KSWWUYFUKGLOTR-VYVDHXHBSA-N 0 2 431.536 4.692 40 10 IJCBLN CC(C)N1c2ccc(/C=C3\C(=O)NC(=O)N(c4ccccc4F)C3=O)cc2[C@H](C)CC1(C)C ZINC000260572682 557492573 /nfs/dbraw/zinc/49/25/73/557492573.db2.gz XVDYGHOIUIUNOZ-CXDFQFJYSA-N 0 2 449.526 4.993 40 10 IJCBLN COc1ccc(N2C(=O)NC(=O)C(=Cc3ccc(OCc4ccc(F)cc4)cc3)C2=O)cc1 ZINC000001202432 132239340 /nfs/dbraw/zinc/23/93/40/132239340.db2.gz MVHAUBXZFQUXLM-HYARGMPZSA-N 0 2 446.434 4.920 40 10 IJCBLN O=C1NC(=O)N(c2ccc(F)cc2)C(=O)/C1=C/c1ccc(-c2ccc(F)c(Cl)c2)o1 ZINC000408600963 555969555 /nfs/dbraw/zinc/96/95/55/555969555.db2.gz HVIQTRXRUIUNQS-XNTDXEJSSA-N 0 2 428.778 4.545 40 10 IJCBLN Cc1cc(/C=C2\C(=O)NC(=O)N(c3ccc(Cl)cc3)C2=O)c(C)n1-c1cccc(C)c1 ZINC000408759072 556681512 /nfs/dbraw/zinc/68/15/12/556681512.db2.gz XICJXEIRHFAQBY-FYJGNVAPSA-N 0 2 433.895 4.722 40 10 IJCBLN Cc1cc(C=C2C(=O)NC(=O)N(c3cc(C)cc(C)c3)C2=O)c(C)n1-c1c(C)cccc1C ZINC000408772458 556848003 /nfs/dbraw/zinc/84/80/03/556848003.db2.gz PKZFNIXQOWNXIQ-OEAKJJBVSA-N 0 2 441.531 4.994 40 10 IJCBLN Cc1cc(C=C2C(=O)NC(=O)N(c3cc(C)cc(C)c3)C2=O)c(C)n1-c1cccc(C)c1C ZINC000408775756 556848774 /nfs/dbraw/zinc/84/87/74/556848774.db2.gz JOOLOZLWTBXTTB-OEAKJJBVSA-N 0 2 441.531 4.994 40 10 IJCBLN Cc1cccc(COc2ccc(/C=C3\C(=O)NC(=O)N(c4cc(C)cc(C)c4)C3=O)cc2)c1 ZINC000408778164 556853805 /nfs/dbraw/zinc/85/38/05/556853805.db2.gz CEURIKKCKMIVHU-BUVRLJJBSA-N 0 2 440.499 4.857 40 10 IJCBLN Cc1ccc(COc2ccc(/C=C3\C(=O)NC(=O)N(c4cc(C)cc(C)c4)C3=O)cc2)cc1 ZINC000408786565 556856504 /nfs/dbraw/zinc/85/65/04/556856504.db2.gz KTIXPQCBKIAYKQ-BUVRLJJBSA-N 0 2 440.499 4.857 40 10 IJCBLN CCCOc1ccc2ccccc2c1/C=C1\C(=O)NC(=O)N(c2ccc(C)cc2C)C1=O ZINC000408799872 556857814 /nfs/dbraw/zinc/85/78/14/556857814.db2.gz IVRTXDRLRFGHCC-RCCKNPSSSA-N 0 2 428.488 4.912 40 10 IJCBLN Cc1ccccc1N1C(=O)NC(=O)C(=Cc2ccc(OCc3cccc(Cl)c3)cc2)C1=O ZINC000408799974 556858026 /nfs/dbraw/zinc/85/80/26/556858026.db2.gz MFUPPTACZCVFJB-KGENOOAVSA-N 0 2 446.890 4.894 40 10 IJCBLN Cc1ccc(COc2ccccc2/C=C2\C(=O)NC(=O)N(c3ccccc3Cl)C2=O)cc1 ZINC000408804625 556860150 /nfs/dbraw/zinc/86/01/50/556860150.db2.gz ZAJDLDRXOBMICS-XMHGGMMESA-N 0 2 446.890 4.894 40 10 IJCBLN Cc1ccc(N2C(=O)NC(=O)C(=Cc3ccc(OC(C)C)c(Cl)c3)C2=O)cc1Cl ZINC000408808491 556861496 /nfs/dbraw/zinc/86/14/96/556861496.db2.gz JCMUZDWIWJQKBW-OVCLIPMQSA-N 0 2 433.291 4.755 40 10 IJCBLN Cc1cccc(COc2ccccc2/C=C2\C(=O)NC(=O)N(c3cccc(C)c3)C2=O)c1 ZINC000408812871 556862922 /nfs/dbraw/zinc/86/29/22/556862922.db2.gz PTMQJPRNBUAOSB-PXLXIMEGSA-N 0 2 426.472 4.549 40 10 IJCBLN Cc1ccc(C)c(N2C(=O)NC(=O)C(=Cc3ccccc3OCc3ccccc3)C2=O)c1 ZINC000408819225 556865097 /nfs/dbraw/zinc/86/50/97/556865097.db2.gz XDSUQPZHOLVHEF-RCCKNPSSSA-N 0 2 426.472 4.549 40 10 IJCBLN O=C1C=CC(=NNc2ccccc2)C=C1C=C1C(=O)NC(=O)N(c2ccc(F)cc2)C1=O ZINC000408856968 556871170 /nfs/dbraw/zinc/87/11/70/556871170.db2.gz MDNRELWBGZEJSA-FILAMKBWSA-N 0 2 430.395 4.613 40 10 IJCBLN Cc1cc(C=C2C(=O)NC(=O)N(c3ccc(C)c(C)c3)C2=O)c(C)n1-c1ccc(C)c(C)c1 ZINC000408854498 556871721 /nfs/dbraw/zinc/87/17/21/556871721.db2.gz GVNAPWDUBYTZIU-ZVHZXABRSA-N 0 2 441.531 4.994 40 10 IJCBLN Cc1ccc(N2C(=O)NC(=O)C(=Cc3ccc(Cc4cccc(F)c4)cc3)C2=O)cc1C ZINC000408875975 556876651 /nfs/dbraw/zinc/87/66/51/556876651.db2.gz IGUBGYFONPURQA-HZHRSRAPSA-N 0 2 428.463 4.700 40 10 IJCBLN COc1ccc(N2C(=O)NC(=O)C(=Cc3ccccc3Cc3cc(C)cc(C)c3)C2=O)cc1 ZINC000408878301 556877227 /nfs/dbraw/zinc/87/72/27/556877227.db2.gz ZWWONAZSNFORDV-LFVJCYFKSA-N 0 2 440.499 4.569 40 10 IJCBLN O=C1NC(=O)N(c2ccc(Cl)cc2)C(=O)/C1=C/c1ccc(Cc2ccccc2F)cc1 ZINC000408881827 556878276 /nfs/dbraw/zinc/87/82/76/556878276.db2.gz MHRNINWBDRBPRI-XSFVSMFZSA-N 0 2 434.854 4.736 40 10 IJCBLN CC[C@@H](C)Oc1ccc(/C=C2\C(=O)NC(=O)N(c3ccc(Cl)cc3)C2=O)cc1Cl ZINC000408896653 556881197 /nfs/dbraw/zinc/88/11/97/556881197.db2.gz GXRNETMIGYDMEV-HMHNVIDESA-N 0 2 433.291 4.837 40 10 IJCBLN Cc1ccc(/C=C2\C(=O)NC(=O)N(c3ccc(OCc4ccccc4Cl)cc3)C2=O)cc1 ZINC000408935980 556895754 /nfs/dbraw/zinc/89/57/54/556895754.db2.gz JGVATSGNYYQBOC-KGENOOAVSA-N 0 2 446.890 4.894 40 10 IJCBLN CCc1ccc(N2C(=O)NC(=O)C(=Cc3cccc(OCc4cccc(F)c4)c3)C2=O)cc1 ZINC000408940298 556896597 /nfs/dbraw/zinc/89/65/97/556896597.db2.gz UTLQYCPCLJDWCY-HAHDFKILSA-N 0 2 444.462 4.634 40 10 IJCBLN O=C1NC(=O)N(c2ccc(OCc3ccc(Cl)cc3)cc2)C(=O)/C1=C/c1ccccc1 ZINC000408940798 556896723 /nfs/dbraw/zinc/89/67/23/556896723.db2.gz VDFQJZNMHCISPT-KGENOOAVSA-N 0 2 432.863 4.585 40 10 IJCBLN O=C1NC(=O)N(c2ccc(C34CC5CC(CC(C5)C3)C4)cc2)C(=O)/C1=C/c1ccsc1 ZINC000408947934 556898395 /nfs/dbraw/zinc/89/83/95/556898395.db2.gz DSPZHKRMXKHMMD-UFFVCSGVSA-N 0 2 432.545 4.882 40 10 IJCBLN CCCOc1c(Cl)cc(/C=C2\C(=O)NC(=O)N(c3ccc(F)cc3)C2=O)cc1Cl ZINC000409043337 556929770 /nfs/dbraw/zinc/92/97/70/556929770.db2.gz FAJGALLRWUQSHD-RIYZIHGNSA-N 0 2 437.254 4.588 40 10 IJCBLN COc1c(Cl)cc(Cl)cc1/C=C1\C(=O)NC(=O)N(c2cc(Cl)ccc2C)C1=O ZINC000409044210 556930069 /nfs/dbraw/zinc/93/00/69/556930069.db2.gz UIKXNUWLMICFIL-AWNIVKPZSA-N 0 2 439.682 4.630 40 10 IJCBLN O=C1NC(=O)N(c2ccc(Cl)c(Cl)c2)C(=O)/C1=C/c1ccc(Cl)cc1Cl ZINC000409217052 557012024 /nfs/dbraw/zinc/01/20/24/557012024.db2.gz NNUREVMEFFDKMY-VZUCSPMQSA-N 0 2 430.074 4.967 40 10 IJCBLN CCN1c2ccc(/C=C3\C(=O)NC(=O)N(c4ccc(C)c(C)c4)C3=O)cc2C(C)=CC1(C)C ZINC000208514569 557093223 /nfs/dbraw/zinc/09/32/23/557093223.db2.gz PUBZYENPBJZXMY-HYARGMPZSA-N 0 2 443.547 4.992 40 10 IJCBLN CCN1c2cc(C)c(/C=C3\C(=O)NC(=O)N(c4cccc(F)c4)C3=O)cc2[C@@H](C)CC1(C)C ZINC000223582749 557488644 /nfs/dbraw/zinc/48/86/44/557488644.db2.gz GAPSKFDTFRTVMY-GKXUUXLPSA-N 0 2 449.526 4.913 40 10 IJCBLN Cc1cc(C=C2C(=O)NC(=O)N(c3ccc4c(c3)OCO4)C2=O)c(C)n1-c1ccccc1C ZINC000059104974 557814617 /nfs/dbraw/zinc/81/46/17/557814617.db2.gz GAFSPODVCZTUMP-YBFXNURJSA-N 0 2 443.459 4.638 40 10 IJCBLN CCCCOc1ccc(/C=C2/C(=O)NC(=O)N(c3ccc(Cl)cc3)C2=O)cc1OCC ZINC000107627933 569250769 /nfs/dbraw/zinc/25/07/69/569250769.db2.gz XPJLTGBBWYJXAQ-AQTBWJFISA-N 0 2 442.899 4.584 40 10 IJCBLN CCN1c2ccc(/C=C3\C(=O)NC(=O)N(c4cccc(F)c4)C3=O)cc2[C@H](C)CC1(C)C ZINC000208305818 569261178 /nfs/dbraw/zinc/26/11/78/569261178.db2.gz GYNXPGDRRCGGLQ-RVZJCZPVSA-N 0 2 435.499 4.604 40 10 IJCBLN Cc1cc(C=C2C(=O)NC(=O)N(c3cc(C)cc(C)c3)C2=O)c(C)n1-c1ccc(C)cc1C ZINC000408771662 556846850 /nfs/dbraw/zinc/84/68/50/556846850.db2.gz IMWVCPZCDHUMCK-OEAKJJBVSA-N 0 2 441.531 4.994 40 10 IJCBLN Cc1ccc(COc2ccc(/C=C3\C(=O)NC(=O)N(c4ccc(C)cc4)C3=O)cc2)cc1 ZINC000408775467 556848651 /nfs/dbraw/zinc/84/86/51/556848651.db2.gz SYYMTANOSQNCIB-HZHRSRAPSA-N 0 2 426.472 4.549 40 10 IJCBLN CCOc1ccc2ccc(OCC)c(/C=C3\C(=O)NC(=O)N(c4ccc(C)cc4)C3=O)c2c1 ZINC000408780319 556854275 /nfs/dbraw/zinc/85/42/75/556854275.db2.gz XILTZDHWXZYDNE-PXLXIMEGSA-N 0 2 444.487 4.612 40 10 IJCBLN CCOc1ccc(/C=C2\C(=O)NC(=O)N(c3cccc(Cl)c3Cl)C2=O)cc1Cl ZINC000408783340 556855382 /nfs/dbraw/zinc/85/53/82/556855382.db2.gz NRPOFZIQOJBMHO-DHZHZOJOSA-N 0 2 439.682 4.712 40 10 IJCBLN Cc1cc(C)cc(N2C(=O)NC(=O)C(=Cc3cn(Cc4ccccc4)c4ccccc34)C2=O)c1 ZINC000408784519 556855605 /nfs/dbraw/zinc/85/56/05/556855605.db2.gz UAWOFKILXCZLEF-BUVRLJJBSA-N 0 2 449.510 4.973 40 10 IJCBLN CCCOc1ccc(Cl)cc1/C=C1\C(=O)NC(=O)N(c2ccc(C)c(Cl)c2)C1=O ZINC000408801069 556858610 /nfs/dbraw/zinc/85/86/10/556858610.db2.gz RPCKPKSHYZRPJG-MHWRWJLKSA-N 0 2 433.291 4.757 40 10 IJCBLN CCCOc1ccc2ccccc2c1/C=C1\C(=O)NC(=O)N(c2cc(C)ccc2C)C1=O ZINC000408806526 556858976 /nfs/dbraw/zinc/85/89/76/556858976.db2.gz FCFYYXFASFCIIW-RCCKNPSSSA-N 0 2 428.488 4.912 40 10 IJCBLN Cc1cccc(N2C(=O)NC(=O)C(=Cc3ccccc3OCc3ccc(Cl)cc3)C2=O)c1 ZINC000408804907 556860412 /nfs/dbraw/zinc/86/04/12/556860412.db2.gz ZZUNAKYDQIECOP-KGENOOAVSA-N 0 2 446.890 4.894 40 10 IJCBLN Cc1ccc(N2C(=O)NC(=O)C(=Cc3ccc(OCc4ccc(F)cc4)cc3)C2=O)cc1C ZINC000408805058 556860432 /nfs/dbraw/zinc/86/04/32/556860432.db2.gz CVHOAWFHBIUIPV-OEAKJJBVSA-N 0 2 444.462 4.688 40 10 IJCBLN Cc1cccc(N2C(=O)NC(=O)C(=Cc3ccc(OCc4ccc(C)c(C)c4)cc3)C2=O)c1 ZINC000408815523 556863146 /nfs/dbraw/zinc/86/31/46/556863146.db2.gz QNLMEBJWZKAZBN-BUVRLJJBSA-N 0 2 440.499 4.857 40 10 IJCBLN Cc1ccc(COc2ccc(/C=C3\C(=O)NC(=O)N(c4cccc(C)c4)C3=O)cc2)cc1 ZINC000408816212 556863548 /nfs/dbraw/zinc/86/35/48/556863548.db2.gz RFECGUJWWFRBKI-HZHRSRAPSA-N 0 2 426.472 4.549 40 10 IJCBLN O=C1NC(=O)N(c2ccccc2Cl)C(=O)/C1=C/c1ccccc1OCc1ccccc1 ZINC000408814289 556865221 /nfs/dbraw/zinc/86/52/21/556865221.db2.gz YYYFDARKUUCSRK-NBVRZTHBSA-N 0 2 432.863 4.585 40 10 IJCBLN Cc1ccc(N2C(=O)NC(=O)C(=Cc3ccc(OCc4cccc(Cl)c4)cc3)C2=O)cc1 ZINC000408814687 556865247 /nfs/dbraw/zinc/86/52/47/556865247.db2.gz ZNUSHVUBVHLLMW-HYARGMPZSA-N 0 2 446.890 4.894 40 10 IJCBLN Cc1ccc(COc2ccc(Cl)cc2/C=C2\C(=O)NC(=O)N(c3ccccc3)C2=O)cc1 ZINC000408814159 556865280 /nfs/dbraw/zinc/86/52/80/556865280.db2.gz NZBRWERMIRCCNH-KGENOOAVSA-N 0 2 446.890 4.894 40 10 IJCBLN Cc1ccc(N2C(=O)NC(=O)C(=Cc3ccccc3OCc3ccccc3F)C2=O)cc1C ZINC000408843148 556869465 /nfs/dbraw/zinc/86/94/65/556869465.db2.gz DRZMHDOAGRYBHW-KGENOOAVSA-N 0 2 444.462 4.688 40 10 IJCBLN Cc1ccc(N2C(=O)NC(=O)C(=Cc3ccc(OCc4cccc(F)c4)cc3)C2=O)cc1C ZINC000408855037 556871868 /nfs/dbraw/zinc/87/18/68/556871868.db2.gz CRIJQFOUKSDUNI-OEAKJJBVSA-N 0 2 444.462 4.688 40 10 IJCBLN Cc1ccc(C)c(N2C(=O)NC(=O)C(=Cc3ccc(Cc4ccccc4F)cc3)C2=O)c1 ZINC000408875669 556876388 /nfs/dbraw/zinc/87/63/88/556876388.db2.gz LAXBSEZCWAVRNE-RCCKNPSSSA-N 0 2 428.463 4.700 40 10 IJCBLN CCc1ccccc1N1C(=O)NC(=O)C(=Cc2ccccc2OCc2ccc(C)cc2)C1=O ZINC000408877496 556877123 /nfs/dbraw/zinc/87/71/23/556877123.db2.gz VLUPCGYFHZTKHI-JWGURIENSA-N 0 2 440.499 4.803 40 10 IJCBLN O=C1NC(=O)N(c2ccc(C34CC5CC(CC(C5)C3)C4)cc2)C(=O)/C1=C/C=C/c1ccco1 ZINC000408946486 556898098 /nfs/dbraw/zinc/89/80/98/556898098.db2.gz AKSHNNAKJRDKHJ-XXVMINMXSA-N 0 2 442.515 4.970 40 10 IJCBLN Cc1cc(C)cc(N2C(=O)NC(=O)C(=Cc3cccc(OCc4ccccc4F)c3)C2=O)c1 ZINC000408960197 556899950 /nfs/dbraw/zinc/89/99/50/556899950.db2.gz DLFXRWPJCJCZDH-HYARGMPZSA-N 0 2 444.462 4.688 40 10 IJCBLN Cc1cc(C)cc(N2C(=O)NC(=O)C(=Cc3cccc(OCc4ccc(F)cc4)c3)C2=O)c1 ZINC000408962714 556901546 /nfs/dbraw/zinc/90/15/46/556901546.db2.gz JODADVWWFSSCJR-OEAKJJBVSA-N 0 2 444.462 4.688 40 10 IJCBLN CCc1ccc(N2C(=O)NC(=O)C(=Cc3ccc(OCc4ccc(C)cc4)cc3)C2=O)cc1 ZINC000408986896 556909838 /nfs/dbraw/zinc/90/98/38/556909838.db2.gz NQAQWLLSBWNWAZ-JLPGSUDCSA-N 0 2 440.499 4.803 40 10 IJCBLN O=C1NC(=O)N(c2ccccc2)C(=O)/C1=C/c1ccc(Sc2cccc3cccnc32)o1 ZINC000408988156 556910604 /nfs/dbraw/zinc/91/06/04/556910604.db2.gz CYKVCDBUOIPVKJ-NBVRZTHBSA-N 0 2 441.468 4.645 40 10 IJCBLN CCc1ccc(N2C(=O)NC(=O)C(=Cc3cc(C)n(-c4cc(C)cc(C)c4)c3C)C2=O)cc1 ZINC000408990324 556911078 /nfs/dbraw/zinc/91/10/78/556911078.db2.gz WYUBKBULFMTFJS-IWIPYMOSSA-N 0 2 441.531 4.940 40 10 IJCBLN CCc1ccc(N2C(=O)NC(=O)C(=Cc3ccccc3OCc3ccccc3F)C2=O)cc1 ZINC000408990491 556911141 /nfs/dbraw/zinc/91/11/41/556911141.db2.gz NHRBDOUTUKVMIQ-QNGOZBTKSA-N 0 2 444.462 4.634 40 10 IJCBLN CCOc1c(Cl)cc(/C=C2\C(=O)NC(=O)N(c3ccccc3Cl)C2=O)cc1Cl ZINC000409041920 556929439 /nfs/dbraw/zinc/92/94/39/556929439.db2.gz KYRSINKZKBMAQT-YRNVUSSQSA-N 0 2 439.682 4.712 40 10 IJCBLN CC(C)COc1c(Cl)cc(/C=C2\C(=O)NC(=O)N(c3ccccc3)C2=O)cc1Cl ZINC000409060416 556937273 /nfs/dbraw/zinc/93/72/73/556937273.db2.gz ZUBRQUSJNLTFSC-OVCLIPMQSA-N 0 2 433.291 4.695 40 10 IJCBLN Cc1ccc(-n2cccc2/C=C2\C(=O)NC(=O)N(c3cccc(Cl)c3C)C2=O)c(C)c1 ZINC000409231008 557022664 /nfs/dbraw/zinc/02/26/64/557022664.db2.gz ASSTXEOVTXRACK-QGOAFFKASA-N 0 2 433.895 4.722 40 10 IJCBLN Cc1cccc(N2C(=O)NC(=O)C(=Cc3cc4c(cc3C)N(C)C(C)(C)C[C@@H]4C)C2=O)c1 ZINC000208230401 557079715 /nfs/dbraw/zinc/07/97/15/557079715.db2.gz KSWWUYFUKGLOTR-RSZPVBOMSA-N 0 2 431.536 4.692 40 10 IJCBLN CCN1c2cc(C)c(/C=C3\C(=O)NC(=O)N(c4ccccc4F)C3=O)cc2C(C)=CC1(C)C ZINC000208517062 557093654 /nfs/dbraw/zinc/09/36/54/557093654.db2.gz QANMHSITBBUHRV-CPNJWEJPSA-N 0 2 447.510 4.822 40 10 IJCBLN CC(C)N1c2ccc(/C=C3\C(=O)NC(=O)N(c4ccccc4)C3=O)cc2[C@H](C)CC1(C)C ZINC000260565256 557285702 /nfs/dbraw/zinc/28/57/02/557285702.db2.gz HPJGMICZJYPQOG-AQRZYSDFSA-N 0 2 431.536 4.854 40 10 IJCBLN CCc1ccccc1-n1c(C)cc(/C=C2\C(=O)NC(=O)N(c3ccccc3C)C2=O)c1C ZINC000014132925 557421612 /nfs/dbraw/zinc/42/16/12/557421612.db2.gz IIDJHPGTAQVAOI-RCCKNPSSSA-N 0 2 427.504 4.631 40 10 IJCBLN COc1ccc(OC)c(N=C(C)c2c(=O)n(-c3ccc(F)cc3)[nH]c2-c2ccccc2)c1 ZINC000017097470 557479017 /nfs/dbraw/zinc/47/90/17/557479017.db2.gz WWKVSXBSHLLKTM-KQWNVCNZSA-N 0 2 431.467 4.980 40 10 IJCBLN CCN1c2ccc(/C=C3\C(=O)NC(=O)N(c4ccccc4C)C3=O)cc2[C@@H](C)CC1(C)C ZINC000223536500 557483094 /nfs/dbraw/zinc/48/30/94/557483094.db2.gz QYUUPNBKHSPEJU-TYSUYXETSA-N 0 2 431.536 4.774 40 10 IJCBLN COC(=O)c1ccc(NC(C)=C2C(=O)N(c3ccc(F)cc3)N=C2c2ccccc2)cc1 ZINC000017096427 557488775 /nfs/dbraw/zinc/48/87/75/557488775.db2.gz MBHWALUFMQJFLH-JWGURIENSA-N 0 2 429.451 4.749 40 10 IJCBLN COC(=O)c1ccc(N=C(C)c2c(=O)n(-c3ccc(F)cc3)[nH]c2-c2ccccc2)cc1 ZINC000017096427 557488778 /nfs/dbraw/zinc/48/87/78/557488778.db2.gz MBHWALUFMQJFLH-JWGURIENSA-N 0 2 429.451 4.749 40 10 IJCBLN Cc1cc(C=C2C(=O)NC(=O)N(c3ccc(C)c(Cl)c3)C2=O)c(C)n1-c1ccccc1 ZINC000002394660 132253532 /nfs/dbraw/zinc/25/35/32/132253532.db2.gz VYSVMRBMNWFKAM-UDWIEESQSA-N 0 2 433.895 4.722 40 10 IJCBLN COc1ccc(N2C(=O)NC(=O)C(=Cc3ccc(-c4ccc(C)cc4[N+](=O)[O-])o3)C2=O)cc1 ZINC000016291377 556597925 /nfs/dbraw/zinc/59/79/25/556597925.db2.gz WZJDEQSQMSKIEA-PDGQHHTCSA-N 0 2 447.403 4.679 40 10 IJCBLN Cc1cccc(COc2ccc(/C=C3\C(=O)NC(=O)N(c4ccc(C)cc4C)C3=O)cc2)c1 ZINC000408801665 556858579 /nfs/dbraw/zinc/85/85/79/556858579.db2.gz WTECTPWFVLAZNC-HZHRSRAPSA-N 0 2 440.499 4.857 40 10 IJCBLN O=C1NC(=O)N(c2ccccc2)C(=O)/C1=C/c1ccccc1OCc1ccc(Cl)cc1 ZINC000408804164 556860123 /nfs/dbraw/zinc/86/01/23/556860123.db2.gz CQQRREJVRZWBRN-XSFVSMFZSA-N 0 2 432.863 4.585 40 10 IJCBLN CCCOc1ccc2ccccc2c1/C=C1\C(=O)NC(=O)N(c2ccccc2Cl)C1=O ZINC000408805323 556860788 /nfs/dbraw/zinc/86/07/88/556860788.db2.gz GGOMGGCJXYTUKF-NBVRZTHBSA-N 0 2 434.879 4.948 40 10 IJCBLN CCCOc1ccc(/C=C2\C(=O)NC(=O)N(c3cc(Cl)ccc3C)C2=O)cc1Cl ZINC000408811996 556862649 /nfs/dbraw/zinc/86/26/49/556862649.db2.gz MJTZEHGYVFAUFG-OQLLNIDSSA-N 0 2 433.291 4.757 40 10 IJCBLN Cc1cccc(COc2ccc(/C=C3\C(=O)NC(=O)N(c4ccccc4)C3=O)cc2Cl)c1 ZINC000408815699 556863221 /nfs/dbraw/zinc/86/32/21/556863221.db2.gz TZUSRAWYJZLAPN-DEDYPNTBSA-N 0 2 446.890 4.894 40 10 IJCBLN Cc1ccc(COc2ccc(/C=C3/C(=O)NC(=O)N(c4ccccc4F)C3=O)cc2)cc1C ZINC000408875200 556874470 /nfs/dbraw/zinc/87/44/70/556874470.db2.gz HDBBAXZEHZHPIB-STZFKDTASA-N 0 2 444.462 4.688 40 10 IJCBLN Cc1cccc(N2C(=O)NC(=O)C(=Cc3ccccc3OCc3ccccc3F)C2=O)c1C ZINC000408895576 556880829 /nfs/dbraw/zinc/88/08/29/556880829.db2.gz LIMYAOYCFYQCQE-XSFVSMFZSA-N 0 2 444.462 4.688 40 10 IJCBLN CCCCOc1ccc(N2C(=O)NC(=O)C(=Cc3c(OC)ccc4ccccc43)C2=O)cc1 ZINC000408896659 556881174 /nfs/dbraw/zinc/88/11/74/556881174.db2.gz GYMQEWKDSSNKQC-JWGURIENSA-N 0 2 444.487 4.694 40 10 IJCBLN Cc1cc(C)cc(COc2ccccc2/C=C2\C(=O)NC(=O)N(c3ccccc3C)C2=O)c1 ZINC000408893265 556881794 /nfs/dbraw/zinc/88/17/94/556881794.db2.gz DKVNPNBHWANGNB-PXLXIMEGSA-N 0 2 440.499 4.857 40 10 IJCBLN CCCCOc1ccc(N2C(=O)NC(=O)C(=Cc3cc(Cl)ccc3OCC)C2=O)cc1 ZINC000408899639 556882009 /nfs/dbraw/zinc/88/20/09/556882009.db2.gz PPQCIAZXJLOXEI-RGEXLXHISA-N 0 2 442.899 4.584 40 10 IJCBLN Cc1cccc(N2C(=O)NC(=O)C(=Cc3ccc(OCc4ccccc4Cl)cc3)C2=O)c1 ZINC000408897653 556883355 /nfs/dbraw/zinc/88/33/55/556883355.db2.gz ZGTKFHWWTTWYRX-KGENOOAVSA-N 0 2 446.890 4.894 40 10 IJCBLN Cc1ccc(COc2cccc(/C=C3/C(=O)NC(=O)N(c4cc(C)ccc4C)C3=O)c2)cc1 ZINC000408934564 556895557 /nfs/dbraw/zinc/89/55/57/556895557.db2.gz FBTWJDLAFNWFHS-HAHDFKILSA-N 0 2 440.499 4.857 40 10 IJCBLN Cc1ccc(COc2cccc(/C=C3/C(=O)NC(=O)N(c4ccccc4Cl)C3=O)c2)cc1 ZINC000408936469 556896006 /nfs/dbraw/zinc/89/60/06/556896006.db2.gz JZYXWFRZUFMBIN-ZHZULCJRSA-N 0 2 446.890 4.894 40 10 IJCBLN CCc1ccc(N2C(=O)NC(=O)C(=Cc3cc(C)n(-c4cccc(C)c4)c3C)C2=O)cc1 ZINC000408985240 556909082 /nfs/dbraw/zinc/90/90/82/556909082.db2.gz KBDGPOSAKJJZNC-HAHDFKILSA-N 0 2 427.504 4.631 40 10 IJCBLN O=C1NC(=O)N(c2cccc(Cl)c2Cl)C(=O)/C1=C/c1cccn1-c1ccc(F)cc1 ZINC000409102304 556956277 /nfs/dbraw/zinc/95/62/77/556956277.db2.gz YPRTZMBJOKHHST-RVDMUPIBSA-N 0 2 444.249 4.590 40 10 IJCBLN Cc1cc(C)cc(N2C(=O)NC(=O)/C(=C\c3cc4c(cc3C)N(C)C(C)(C)C=C4C)C2=O)c1 ZINC000208453146 557087844 /nfs/dbraw/zinc/08/78/44/557087844.db2.gz RXYFVDBIXFWLPY-LPYMAVHISA-N 0 2 443.547 4.910 40 10 IJCBLN CCN1c2ccc(/C=C3\C(=O)NC(=O)N(c4ccc(C)cc4)C3=O)cc2C(C)=CC1(C)C ZINC000208502683 557093147 /nfs/dbraw/zinc/09/31/47/557093147.db2.gz LJKWOWPJJACTRH-KGENOOAVSA-N 0 2 429.520 4.683 40 10 IJCBLN CCN1c2ccc(/C=C3\C(=O)NC(=O)N(c4cccc(C)c4C)C3=O)cc2C(C)=CC1(C)C ZINC000208512855 557093264 /nfs/dbraw/zinc/09/32/64/557093264.db2.gz OYQCFDBHAQHMQN-KGENOOAVSA-N 0 2 443.547 4.992 40 10 IJCBLN CCN1c2ccc(/C=C3\C(=O)NC(=O)N(c4ccccc4F)C3=O)cc2C(C)=CC1(C)C ZINC000208514772 557093292 /nfs/dbraw/zinc/09/32/92/557093292.db2.gz PMKOIBSSNKRQOM-QGOAFFKASA-N 0 2 433.483 4.514 40 10 IJCBLN CCc1ccc(N2C(=O)NC(=O)C(=Cc3cccn3CCOc3ccccc3C)C2=O)cc1 ZINC000033330654 557113931 /nfs/dbraw/zinc/11/39/31/557113931.db2.gz NOXISTCUAACSDW-XLNRJJMWSA-N 0 2 443.503 4.945 40 10 IJCBLN COC(=O)CC1=NN(c2nc3ccccc3s2)C(=O)C1=C(C)Nc1ccccc1Cl ZINC000103919850 557141059 /nfs/dbraw/zinc/14/10/59/557141059.db2.gz LIDKPMILGKURLS-UNOMPAQXSA-N 0 2 440.912 4.602 40 10 IJCBLN COC(=O)Cc1[nH]n(-c2nc3ccccc3s2)c(=O)c1C(C)=Nc1ccccc1Cl ZINC000103919850 557141063 /nfs/dbraw/zinc/14/10/63/557141063.db2.gz LIDKPMILGKURLS-UNOMPAQXSA-N 0 2 440.912 4.602 40 10 IJCBLN CC[C@@H](C)Oc1c(Cl)cc(/C=C2\C(=O)NC(=O)N(c3ccccc3C)C2=O)cc1OC ZINC000014133165 557421877 /nfs/dbraw/zinc/42/18/77/557421877.db2.gz KJIPFLPKHJPURM-DWKHYPNZSA-N 0 2 442.899 4.501 40 10 IJCBLN CCCCOc1ccc(Cl)cc1/C=C1/C(=O)NC(=O)N(c2ccc(Cl)cc2)C1=O ZINC000107564644 569250484 /nfs/dbraw/zinc/25/04/84/569250484.db2.gz AMSVKOGLSWENDY-ATVHPVEESA-N 0 2 433.291 4.839 40 10 IJCBLN Cc1cccc(N2C(=O)NC(=O)C(=Cc3ccc(-c4cc([N+](=O)[O-])ccc4C)o3)C2=O)c1 ZINC000001202080 132239349 /nfs/dbraw/zinc/23/93/49/132239349.db2.gz WMHIAEFTBISXOX-XDHOZWIPSA-N 0 2 431.404 4.978 40 10 IJCBLN COc1ccc(N2C(=O)NC(=O)C(=Cc3ccc(-c4cc([N+](=O)[O-])ccc4C)o3)C2=O)cc1 ZINC000001203008 132239381 /nfs/dbraw/zinc/23/93/81/132239381.db2.gz ZDZJDRCPSRMRIC-XDHOZWIPSA-N 0 2 447.403 4.679 40 10 IJCBLN Cc1cc(/C=C2\C(=O)NC(=O)N(c3ccc(C)c(C)c3)C2=O)c(C)n1-c1cccc(C)c1 ZINC000408757421 556238663 /nfs/dbraw/zinc/23/86/63/556238663.db2.gz ZTNLLLHOCBGJEW-OEAKJJBVSA-N 0 2 427.504 4.686 40 10 IJCBLN Cc1cc(C=C2C(=O)NC(=O)N(c3cc(C)cc(C)c3)C2=O)c(C)n1-c1cccc(C)c1 ZINC000408761645 556687869 /nfs/dbraw/zinc/68/78/69/556687869.db2.gz KJIPTOXWEULHOG-OEAKJJBVSA-N 0 2 427.504 4.686 40 10 IJCBLN CCCOc1ccc2ccccc2c1/C=C1\C(=O)NC(=O)N(c2cccc(Cl)c2)C1=O ZINC000408800155 556857965 /nfs/dbraw/zinc/85/79/65/556857965.db2.gz NGJJMOLWLLKIKB-XSFVSMFZSA-N 0 2 434.879 4.948 40 10 IJCBLN Cc1ccc(COc2ccc(/C=C3\C(=O)NC(=O)N(c4cc(C)ccc4C)C3=O)cc2)cc1 ZINC000408801866 556858885 /nfs/dbraw/zinc/85/88/85/556858885.db2.gz WDMBGCOXSWJKFG-HZHRSRAPSA-N 0 2 440.499 4.857 40 10 IJCBLN Cc1ccc(Cl)cc1N1C(=O)NC(=O)C(=Cc2ccc(OCc3ccccc3)cc2)C1=O ZINC000408804930 556860406 /nfs/dbraw/zinc/86/04/06/556860406.db2.gz HJVCVPFHWQHALK-FYJGNVAPSA-N 0 2 446.890 4.894 40 10 IJCBLN Cc1ccc(N2C(=O)NC(=O)C(=Cc3ccc(OCc4ccccc4F)cc3)C2=O)cc1C ZINC000408859647 556872214 /nfs/dbraw/zinc/87/22/14/556872214.db2.gz VYMMAMZDUMNOEO-HYARGMPZSA-N 0 2 444.462 4.688 40 10 IJCBLN O=C1NC(=O)N(c2ccccc2Cl)C(=O)/C1=C\c1ccccc1Cc1ccccc1F ZINC000408869751 556874456 /nfs/dbraw/zinc/87/44/56/556874456.db2.gz TUMNCJJXBRRPMW-NBVRZTHBSA-N 0 2 434.854 4.736 40 10 IJCBLN Cc1cc(C)cc(COc2ccc(/C=C3/C(=O)NC(=O)N(c4ccccc4F)C3=O)cc2)c1 ZINC000408888854 556878753 /nfs/dbraw/zinc/87/87/53/556878753.db2.gz BWANMXNEJUUKBD-STZFKDTASA-N 0 2 444.462 4.688 40 10 IJCBLN Cc1cc(C)cc(COc2ccc(/C=C3\C(=O)NC(=O)N(c4ccccc4)C3=O)cc2)c1 ZINC000408890171 556879200 /nfs/dbraw/zinc/87/92/00/556879200.db2.gz PBPKJWFIHIJQBM-HZHRSRAPSA-N 0 2 426.472 4.549 40 10 IJCBLN Cc1ccc(N2C(=O)NC(=O)C(=Cc3ccc(OCc4cc(C)cc(C)c4)cc3)C2=O)cc1 ZINC000408887928 556879861 /nfs/dbraw/zinc/87/98/61/556879861.db2.gz UVXCROHIKOOCAN-BUVRLJJBSA-N 0 2 440.499 4.857 40 10 IJCBLN O=C1NC(=O)N(c2ccc(OCc3ccccc3Cl)cc2)C(=O)/C1=C/c1ccccc1 ZINC000408941526 556896961 /nfs/dbraw/zinc/89/69/61/556896961.db2.gz WUZOJIUJAVQPHO-XSFVSMFZSA-N 0 2 432.863 4.585 40 10 IJCBLN CCc1ccc(N2C(=O)NC(=O)C(=Cc3cc(C)n(-c4cc(C)ccc4C)c3C)C2=O)cc1 ZINC000408985131 556908981 /nfs/dbraw/zinc/90/89/81/556908981.db2.gz VPWUIQSUTBMNAV-HAHDFKILSA-N 0 2 441.531 4.940 40 10 IJCBLN CCOc1ccc2ccccc2c1/C=C1/C(=O)NC(=O)N(c2ccc(C)c(Cl)c2)C1=O ZINC000408988463 556911917 /nfs/dbraw/zinc/91/19/17/556911917.db2.gz QYPBRWYVSQTECL-UYRXBGFRSA-N 0 2 434.879 4.867 40 10 IJCBLN CCOc1c(Cl)cc(Cl)cc1/C=C1\C(=O)NC(=O)N(c2cccc(Cl)c2)C1=O ZINC000409040561 556928507 /nfs/dbraw/zinc/92/85/07/556928507.db2.gz GRWSTLIFRGZDHN-VGOFMYFVSA-N 0 2 439.682 4.712 40 10 IJCBLN C[C@@H]1CC(C)(C)N(C)c2ccc(/C=C3\C(=O)NC(=O)N(c4cccc(Cl)c4)C3=O)cc21 ZINC000208199596 557079468 /nfs/dbraw/zinc/07/94/68/557079468.db2.gz IFQRYAMRQZVQCK-HIPSJFSSSA-N 0 2 437.927 4.728 40 10 IJCBLN Cc1cc2c(cc1/C=C1\C(=O)NC(=O)N(c3cccc(F)c3)C1=O)[C@H](C)CC(C)(C)N2C ZINC000208232318 557079806 /nfs/dbraw/zinc/07/98/06/557079806.db2.gz REUXKOONZZLAJJ-PZUDMAOCSA-N 0 2 435.499 4.523 40 10 IJCBLN COC(=O)c1ccccc1N=C(C)c1c(-c2ccccc2)[nH]n(-c2ccc(OC)cc2)c1=O ZINC000103921315 557141000 /nfs/dbraw/zinc/14/10/00/557141000.db2.gz GQEQGDXKICLEMM-QJOMJCCJSA-N 0 2 441.487 4.619 40 10 IJCBLN COC(=O)Cc1[nH]n(-c2ccc(OC)cc2)c(=O)c1C(C)=Nc1cc(Cl)ccc1Cl ZINC000112294308 557239644 /nfs/dbraw/zinc/23/96/44/557239644.db2.gz NYVFFDRWQXAFKR-NDENLUEZSA-N 0 2 448.306 4.654 40 10 IJCBLN Cc1cc(C=C2C(=O)NC(=O)N(c3ccc(F)cc3)C2=O)c(C)n1-c1cccc([N+](=O)[O-])c1 ZINC000059135015 557815076 /nfs/dbraw/zinc/81/50/76/557815076.db2.gz OHRXCQIJPHSGIH-RGVLZGJSSA-N 0 2 448.410 4.648 40 10 IJCBLN CCCCOc1ccc(Cl)cc1/C=C1\C(=O)NC(=O)N(c2ccc(OCC)cc2)C1=O ZINC000408532628 555744161 /nfs/dbraw/zinc/74/41/61/555744161.db2.gz OIEKQHABKYXPHJ-XMHGGMMESA-N 0 2 442.899 4.584 40 10 IJCBLN CCCCCCOc1ccc(Cl)cc1/C=C1/C(=O)NC(=O)N(c2ccc(O)cc2)C1=O ZINC000408537451 555779463 /nfs/dbraw/zinc/77/94/63/555779463.db2.gz FHPBZCUWQATRHJ-RGEXLXHISA-N 0 2 442.899 4.671 40 10 IJCBLN O=C1NC(=O)N(c2ccc(O)cc2)C(=O)/C1=C\c1ccc(-c2cc(Cl)ccc2Cl)o1 ZINC000408605295 555966115 /nfs/dbraw/zinc/96/61/15/555966115.db2.gz YJHHUZVMWDNXMY-YBEGLDIGSA-N 0 2 443.242 4.625 40 10 IJCBLN Cc1cccc(COc2ccc(/C=C3\C(=O)NC(=O)N(c4ccc(Cl)cc4)C3=O)cc2)c1 ZINC000408774892 556848400 /nfs/dbraw/zinc/84/84/00/556848400.db2.gz DISGTGMKIWDREG-HYARGMPZSA-N 0 2 446.890 4.894 40 10 IJCBLN CCOc1cc(/C=C2\C(=O)NC(=O)N(c3ccc(C)cc3)C2=O)cc(Cl)c1OC(C)C ZINC000408800378 556857992 /nfs/dbraw/zinc/85/79/92/556857992.db2.gz OQEMYNPXOPZBLN-LICLKQGHSA-N 0 2 442.899 4.501 40 10 IJCBLN Cc1cccc(COc2ccccc2/C=C2\C(=O)NC(=O)N(c3ccccc3Cl)C2=O)c1 ZINC000408801037 556858497 /nfs/dbraw/zinc/85/84/97/556858497.db2.gz RJGLXEWIJOQGJY-XMHGGMMESA-N 0 2 446.890 4.894 40 10 IJCBLN Cc1ccc(COc2ccccc2/C=C2\C(=O)NC(=O)N(c3cccc(Cl)c3)C2=O)cc1 ZINC000408807744 556861304 /nfs/dbraw/zinc/86/13/04/556861304.db2.gz HMQVKJTYHIXXQJ-FYJGNVAPSA-N 0 2 446.890 4.894 40 10 IJCBLN Cc1ccc(COc2ccccc2/C=C2\C(=O)NC(=O)N(c3cc(C)ccc3C)C2=O)cc1 ZINC000408809079 556861921 /nfs/dbraw/zinc/86/19/21/556861921.db2.gz HINRRVABUYBGJA-PXLXIMEGSA-N 0 2 440.499 4.857 40 10 IJCBLN CCOc1ccc2ccccc2c1/C=C1\C(=O)NC(=O)N(c2cc(Cl)ccc2C)C1=O ZINC000408819040 556864728 /nfs/dbraw/zinc/86/47/28/556864728.db2.gz WJXBEHSETZSYLR-CPNJWEJPSA-N 0 2 434.879 4.867 40 10 IJCBLN Cc1cc(C=C2C(=O)NC(=O)N(c3ccc(C)c(C)c3)C2=O)c(C)n1-c1c(C)cccc1C ZINC000408852764 556870236 /nfs/dbraw/zinc/87/02/36/556870236.db2.gz IBNLEQAHXUELBX-OEAKJJBVSA-N 0 2 441.531 4.994 40 10 IJCBLN Cc1ccc(N2C(=O)NC(=O)C(=Cc3ccc(Cc4ccccc4F)cc3)C2=O)c(C)c1 ZINC000408868617 556874212 /nfs/dbraw/zinc/87/42/12/556874212.db2.gz AJTMLCLVJKECTE-RCCKNPSSSA-N 0 2 428.463 4.700 40 10 IJCBLN CCc1ccccc1N1C(=O)NC(=O)C(=Cc2ccccc2Cc2cccc(F)c2)C1=O ZINC000408876240 556876615 /nfs/dbraw/zinc/87/66/15/556876615.db2.gz KFWKEQBCWAMYNA-JWGURIENSA-N 0 2 428.463 4.645 40 10 IJCBLN O=C1NC(=O)N(c2ccc(Cl)cc2)C(=O)/C1=C\c1ccccc1Cc1cccc(F)c1 ZINC000408876022 556876679 /nfs/dbraw/zinc/87/66/79/556876679.db2.gz MEVUYSIVPFDHNV-KGENOOAVSA-N 0 2 434.854 4.736 40 10 IJCBLN CCCOc1ccc(N2C(=O)NC(=O)C(=Cc3ccc(OCCC)c(Cl)c3)C2=O)cc1 ZINC000408893514 556881721 /nfs/dbraw/zinc/88/17/21/556881721.db2.gz AWAGZGLAPSVXPX-AQTBWJFISA-N 0 2 442.899 4.584 40 10 IJCBLN Cc1ccc(N2C(=O)NC(=O)C(=Cc3cccc(OCc4cccc(F)c4)c3)C2=O)c(C)c1 ZINC000408933782 556895276 /nfs/dbraw/zinc/89/52/76/556895276.db2.gz BGLJNQPAOXCYHE-HMAPJEAMSA-N 0 2 444.462 4.688 40 10 IJCBLN Cc1ccc(N2C(=O)NC(=O)C(=Cc3cccc(OCc4ccccc4Cl)c3)C2=O)cc1 ZINC000408937211 556896948 /nfs/dbraw/zinc/89/69/48/556896948.db2.gz NFXGSHRDSMRIPV-STZFKDTASA-N 0 2 446.890 4.894 40 10 IJCBLN CC(=O)c1ccc(-c2ccc(C=C3C(=O)NC(=O)N(c4ccc(C)c(Cl)c4)C3=O)o2)cc1 ZINC000408982927 556908256 /nfs/dbraw/zinc/90/82/56/556908256.db2.gz IXMHTVZMNGHHAV-UNOMPAQXSA-N 0 2 448.862 4.777 40 10 IJCBLN CCOc1cccc(N2C(=O)NC(=O)C(=Cc3ccc(O[C@H](C)CC)c(Cl)c3)C2=O)c1 ZINC000409014744 556920520 /nfs/dbraw/zinc/92/05/20/556920520.db2.gz IZPKPUYAVSBDPF-XWAFYUISSA-N 0 2 442.899 4.582 40 10 IJCBLN COc1c(Cl)cc(/C=C2\C(=O)NC(=O)N(c3cc(Cl)ccc3C)C2=O)cc1Cl ZINC000409058802 556935866 /nfs/dbraw/zinc/93/58/66/556935866.db2.gz TVXFORABJUNSPS-LFYBBSHMSA-N 0 2 439.682 4.630 40 10 IJCBLN Cc1cc2c(cc1/C=C1\C(=O)NC(=O)N(c3cccc(F)c3)C1=O)[C@@H](C)CC(C)(C)N2C ZINC000208232363 557079883 /nfs/dbraw/zinc/07/98/83/557079883.db2.gz REUXKOONZZLAJJ-BBJIBYMTSA-N 0 2 435.499 4.523 40 10 IJCBLN O=C1NC(=O)N(c2ccncc2)C(=O)/C1=C/c1ccc(Sc2ccc(Cl)cc2)cc1 ZINC000409394799 557098521 /nfs/dbraw/zinc/09/85/21/557098521.db2.gz FZRWBULUMZRVBC-CPNJWEJPSA-N 0 2 435.892 4.553 40 10 IJCBLN CCN1c2ccc(/C=C3\C(=O)NC(=O)N(c4ccc(C)cc4)C3=O)cc2[C@@H](C)CC1(C)C ZINC000223533069 557482770 /nfs/dbraw/zinc/48/27/70/557482770.db2.gz UPICNLQPJQLXAX-JPOGYNCRSA-N 0 2 431.536 4.774 40 10 IJCBLN Cc1cc([N+](=O)[O-])ccc1-c1ccc(C=C2C(=O)NC(=O)N(c3ccc(F)cc3)C2=O)o1 ZINC000059106189 557820219 /nfs/dbraw/zinc/82/02/19/557820219.db2.gz HDFRIAUBDNPZTD-WQRHYEAKSA-N 0 2 435.367 4.809 40 10 IJCBLN Cc1cc(C=C2C(=O)NC(=O)N(c3ccc(F)cc3)C2=O)c(C)n1-c1ccc([N+](=O)[O-])cc1 ZINC000059106186 557820242 /nfs/dbraw/zinc/82/02/42/557820242.db2.gz BCRXFFPELJNSHV-NDENLUEZSA-N 0 2 448.410 4.648 40 10 IJCBLN CC[C@H](C)Oc1c(Cl)cc(/C=C2/C(=O)NN(c3ccccc3)C2=O)cc1Br ZINC000108136056 569260843 /nfs/dbraw/zinc/26/08/43/569260843.db2.gz SMMKLHAJWPCRTL-ZENNRRHLSA-N 0 2 449.732 4.741 40 10 IJCBLN Cc1cccc(C)c1OCCn1cccc1C=C1C(=O)NC(=O)N(c2ccc(F)cc2)C1=O ZINC000035304684 524316703 /nfs/dbraw/zinc/31/67/03/524316703.db2.gz BTGIOCBBJNGEEQ-QNGOZBTKSA-N 0 2 447.466 4.830 40 10 IJCBLN Cc1cc(C=C2C(=O)NC(=O)N(c3ccc(C)cc3)C2=O)c(C)n1-c1ccc(C)c(C)c1 ZINC000408742227 556215694 /nfs/dbraw/zinc/21/56/94/556215694.db2.gz VKJBDHLPJMRMJZ-OEAKJJBVSA-N 0 2 427.504 4.686 40 10 IJCBLN Cc1cc(/C=C2\C(=O)NC(=O)N(c3cccc(Cl)c3)C2=O)c(C)n1-c1cccc(C)c1 ZINC000408764724 556829464 /nfs/dbraw/zinc/82/94/64/556829464.db2.gz JVQJGRCSPSXIQV-CIAFOILYSA-N 0 2 433.895 4.722 40 10 IJCBLN Cc1cccc(COc2ccc(/C=C3\C(=O)NC(=O)N(c4cccc(Cl)c4)C3=O)cc2)c1 ZINC000408800725 556858243 /nfs/dbraw/zinc/85/82/43/556858243.db2.gz OXOJYBSOZHPFEZ-LPYMAVHISA-N 0 2 446.890 4.894 40 10 IJCBLN CCCOc1ccc(/C=C2\C(=O)NC(=O)N(c3cccc(Cl)c3C)C2=O)cc1Cl ZINC000408810909 556862507 /nfs/dbraw/zinc/86/25/07/556862507.db2.gz VADOPLSABPIWSI-GXDHUFHOSA-N 0 2 433.291 4.757 40 10 IJCBLN Cc1ccc(/C=C2\C(=O)NC(=O)N(c3ccc(C45CC6CC(CC(C6)C4)C5)cc3)C2=O)o1 ZINC000408845093 556868738 /nfs/dbraw/zinc/86/87/38/556868738.db2.gz FDMCBPHVWJSWIR-SSDVNMTOSA-N 0 2 430.504 4.722 40 10 IJCBLN Cc1cc(C=C2C(=O)NC(=O)N(c3ccc(C)c(C)c3)C2=O)c(C)n1-c1ccccc1C ZINC000408853636 556871451 /nfs/dbraw/zinc/87/14/51/556871451.db2.gz VRLKVBNRKZEHOQ-HYARGMPZSA-N 0 2 427.504 4.686 40 10 IJCBLN Cc1cc(C)cc(Cc2ccccc2/C=C2/C(=O)NC(=O)N(c3ccccc3F)C2=O)c1 ZINC000408867903 556873923 /nfs/dbraw/zinc/87/39/23/556873923.db2.gz KOGGUKULJXGYMR-QNGOZBTKSA-N 0 2 428.463 4.700 40 10 IJCBLN Cc1cc(/C=C2\C(=O)NC(=O)N(c3cccc(F)c3)C2=O)c(C)n1-c1cc(C)cc(C)c1 ZINC000408914298 556889674 /nfs/dbraw/zinc/88/96/74/556889674.db2.gz PCLBHBYYBVOHHC-WSDLNYQXSA-N 0 2 431.467 4.516 40 10 IJCBLN CCn1cccc1/C=C1\C(=O)NC(=O)N(c2ccc(C34CC5CC(CC(C5)C3)C4)cc2)C1=O ZINC000408948754 556898564 /nfs/dbraw/zinc/89/85/64/556898564.db2.gz GHYSEGZZOCSXMY-YDZHTSKRSA-N 0 2 443.547 4.642 40 10 IJCBLN CCOc1ccccc1N1C(=O)NC(=O)C(=Cc2ccc(O[C@H](C)CC)c(Cl)c2)C1=O ZINC000409223409 557017764 /nfs/dbraw/zinc/01/77/64/557017764.db2.gz ZKNNOOKXZXQMEW-RGHBXIHOSA-N 0 2 442.899 4.582 40 10 IJCBLN CCOc1ccccc1N1C(=O)NC(=O)C(=Cc2ccccc2Sc2ccccc2)C1=O ZINC000409244715 557026757 /nfs/dbraw/zinc/02/67/57/557026757.db2.gz HTTRUBJAUCKRNB-MNDPQUGUSA-N 0 2 444.512 4.903 40 10 IJCBLN CCOc1ccccc1N1C(=O)NC(=O)C(=Cc2ccc(Sc3ccccc3)cc2)C1=O ZINC000409243087 557032879 /nfs/dbraw/zinc/03/28/79/557032879.db2.gz YNPPCOCGFRGPNQ-CAPFRKAQSA-N 0 2 444.512 4.903 40 10 IJCBLN C[C@H]1CC(C)(C)N(C)c2ccc(/C=C3\C(=O)NC(=O)N(c4ccc(Cl)cc4)C3=O)cc21 ZINC000208198472 557079348 /nfs/dbraw/zinc/07/93/48/557079348.db2.gz GWCXLWGUAJMWNK-BXUJETTOSA-N 0 2 437.927 4.728 40 10 IJCBLN COC(=O)Cc1[nH]n(-c2ccc(OC)cc2)c(=O)c1C(C)=Nc1ccc(Cl)cc1Cl ZINC000112294337 557239761 /nfs/dbraw/zinc/23/97/61/557239761.db2.gz DZZTYLBSNTYVRN-NDENLUEZSA-N 0 2 448.306 4.654 40 10 IJCBLN CCOc1cc(/C=C2\C(=O)NC(=O)N(c3ccccc3C)C2=O)cc(Cl)c1OC(C)C ZINC000014133171 557421830 /nfs/dbraw/zinc/42/18/30/557421830.db2.gz KWBBKCBZZPXIGU-MHWRWJLKSA-N 0 2 442.899 4.501 40 10 IJCBLN Cc1c(C=C2C(=O)NC(=O)N(c3cccc(Br)c3)C2=O)c2ccccc2n1C ZINC000016249771 557471480 /nfs/dbraw/zinc/47/14/80/557471480.db2.gz FPNFFLMQBWEWIA-BOPFTXTBSA-N 0 2 438.281 4.756 40 10 IJCBLN CC(C)N1c2ccc(/C=C3\C(=O)NC(=O)N(c4cccc(F)c4)C3=O)cc2[C@@H](C)CC1(C)C ZINC000223559611 557485983 /nfs/dbraw/zinc/48/59/83/557485983.db2.gz HQMGEGRIVXLBAY-GKXUUXLPSA-N 0 2 449.526 4.993 40 10 IJCBLN CCOc1ccc(OCC)c(N2C(=O)NC(=O)C(=Cc3cn(CC)c4ccccc34)C2=O)c1 ZINC000059104863 557814276 /nfs/dbraw/zinc/81/42/76/557814276.db2.gz OLDRCLFOAWIJQA-CPNJWEJPSA-N 0 2 447.491 4.965 40 10 IJCBLN CCN1c2cc(C)c(/C=C3\C(=O)NC(=O)N(c4ccccc4)C3=O)cc2[C@H](C)CC1(C)C ZINC000208316213 569261247 /nfs/dbraw/zinc/26/12/47/569261247.db2.gz KGKLVUISCRMRCU-AQRZYSDFSA-N 0 2 431.536 4.774 40 10 IJCBLN Cc1cc(C=C2C(=O)NC(=O)N(c3cccc(C)c3)C2=O)c(C)n1-c1ccc(C)c(C)c1 ZINC000408740422 556212742 /nfs/dbraw/zinc/21/27/42/556212742.db2.gz KJFWLZWNXVLYAM-OEAKJJBVSA-N 0 2 427.504 4.686 40 10 IJCBLN Cc1[nH]n(-c2ccc(C)c(C)c2)c(=O)c1C=C1C(=O)NC(=O)N(c2cccc(C)c2C)C1=O ZINC000016350011 556602028 /nfs/dbraw/zinc/60/20/28/556602028.db2.gz UMTJUUKYKQYOCF-NDENLUEZSA-N 0 2 444.491 4.627 40 10 IJCBLN CCc1ccccc1N1C(=O)NC(=O)C(=Cc2cc(C)n(-c3ccc(Cl)cc3)c2C)C1=O ZINC000408783405 556855307 /nfs/dbraw/zinc/85/53/07/556855307.db2.gz OSRDVNMIXBQMHI-KGENOOAVSA-N 0 2 447.922 4.976 40 10 IJCBLN CCc1ccccc1-n1c(C)cc(/C=C2\C(=O)NC(=O)N(c3cc(C)cc(C)c3)C2=O)c1C ZINC000408791308 556857254 /nfs/dbraw/zinc/85/72/54/556857254.db2.gz YNZYZSRFPNMKTO-HZHRSRAPSA-N 0 2 441.531 4.940 40 10 IJCBLN Cc1ccc(N2C(=O)NC(=O)C(=Cc3ccccc3OCc3ccc(C)c(C)c3)C2=O)cc1 ZINC000408803625 556860005 /nfs/dbraw/zinc/86/00/05/556860005.db2.gz RIAKABKZJNFJME-HZHRSRAPSA-N 0 2 440.499 4.857 40 10 IJCBLN CCCOc1ccc(/C=C2\C(=O)NC(=O)N(c3ccc(C)c(Cl)c3)C2=O)cc1OCC ZINC000408810846 556862420 /nfs/dbraw/zinc/86/24/20/556862420.db2.gz MZEVHEOBVWKSNU-GZTJUZNOSA-N 0 2 442.899 4.502 40 10 IJCBLN O=C1NC(=O)N(c2ccccc2Cl)C(=O)/C1=C/c1ccc(Cc2cccc(F)c2)cc1 ZINC000408868704 556874161 /nfs/dbraw/zinc/87/41/61/556874161.db2.gz PRWHKYBZPJWUGV-XMHGGMMESA-N 0 2 434.854 4.736 40 10 IJCBLN Cc1ccccc1N1C(=O)NC(=O)C(=Cc2ccccc2Cc2ccccc2Cl)C1=O ZINC000408872692 556875184 /nfs/dbraw/zinc/87/51/84/556875184.db2.gz OGVHZQHVPQHBBC-HMMYKYKNSA-N 0 2 430.891 4.906 40 10 IJCBLN CCc1ccccc1N1C(=O)NC(=O)C(=Cc2ccc(OCc3ccccc3F)cc2)C1=O ZINC000408880901 556876406 /nfs/dbraw/zinc/87/64/06/556876406.db2.gz JIKSIFCRINITJW-QNGOZBTKSA-N 0 2 444.462 4.634 40 10 IJCBLN Cc1ccc(C)c(N2C(=O)NC(=O)C(=Cc3ccccc3OCc3cccc(F)c3)C2=O)c1 ZINC000408895427 556880865 /nfs/dbraw/zinc/88/08/65/556880865.db2.gz MTMJFTWGRINZBE-KGENOOAVSA-N 0 2 444.462 4.688 40 10 IJCBLN CCCOc1ccc(N2C(=O)NC(=O)C(=Cc3ccc(OC(C)C)c(Cl)c3)C2=O)cc1 ZINC000408900154 556882364 /nfs/dbraw/zinc/88/23/64/556882364.db2.gz RTANIRAVDXFAKU-PDGQHHTCSA-N 0 2 442.899 4.582 40 10 IJCBLN CCc1ccc(N2C(=O)NC(=O)C(=Cc3cccc(OCc4ccccc4F)c3)C2=O)cc1 ZINC000408934142 556895305 /nfs/dbraw/zinc/89/53/05/556895305.db2.gz CODHBUMPEMMXTJ-JCMHNJIXSA-N 0 2 444.462 4.634 40 10 IJCBLN CCc1ccc(N2C(=O)NC(=O)C(=Cc3ccc(OCc4ccc(F)cc4)cc3)C2=O)cc1 ZINC000408988065 556910521 /nfs/dbraw/zinc/91/05/21/556910521.db2.gz QHFMCLSXXPNENH-HAHDFKILSA-N 0 2 444.462 4.634 40 10 IJCBLN CCOc1c(Cl)cc(Cl)cc1/C=C1\C(=O)NC(=O)N(c2ccccc2Cl)C1=O ZINC000409048124 556931837 /nfs/dbraw/zinc/93/18/37/556931837.db2.gz QGKCDODDRLVUOV-XYOKQWHBSA-N 0 2 439.682 4.712 40 10 IJCBLN CCOc1ccc(Cl)cc1/C=C1\C(=O)NC(=O)N(c2cccc(Cl)c2Cl)C1=O ZINC000409108121 556959632 /nfs/dbraw/zinc/95/96/32/556959632.db2.gz RVVVTTUPRPWVBT-FMIVXFBMSA-N 0 2 439.682 4.712 40 10 IJCBLN Cc1ccccc1N1C(=O)NC(=O)C(=Cc2ccc(OCc3ccc(Cl)cc3)cc2)C1=O ZINC000014132794 557421560 /nfs/dbraw/zinc/42/15/60/557421560.db2.gz UMYZSYMAUBZGBN-KGENOOAVSA-N 0 2 446.890 4.894 40 10 IJCBLN Cc1ccc([N+](=O)[O-])cc1-c1ccc(C=C2C(=O)NC(=O)N(c3ccc(F)cc3)C2=O)o1 ZINC000096475584 557838146 /nfs/dbraw/zinc/83/81/46/557838146.db2.gz FWYBXGCKGBNNMU-WOJGMQOQSA-N 0 2 435.367 4.809 40 10 IJCBLN Cc1ccc(N2C(=O)NC(=O)C(=Cc3ccc(OC(=O)c4cccs4)cc3)C2=O)cc1 ZINC000001117798 568659912 /nfs/dbraw/zinc/65/99/12/568659912.db2.gz DONUNJOIFXVPPU-QGOAFFKASA-N 0 2 432.457 4.782 40 10 IJCBLN Cc1ccc(C)c(N2C(=O)NC(=O)C(=CNc3c(Cl)cc(Cl)cc3Cl)C2=O)c1 ZINC000408527244 555717272 /nfs/dbraw/zinc/71/72/72/555717272.db2.gz FNZNISYKLULZMF-XYOKQWHBSA-N 0 2 438.698 4.842 40 10 IJCBLN CC1=NN(c2ccc(Br)cc2C)C(=O)C1C=Nc1ccc(C)cc1[N+](=O)[O-] ZINC000408531032 555728989 /nfs/dbraw/zinc/72/89/89/555728989.db2.gz KFKPGQYOCVYBDU-GDNBJRDFSA-N 0 2 429.274 4.693 40 10 IJCBLN O=C1NC(=O)N(c2cccc(Cl)c2Cl)C(=O)/C1=C\c1ccc(-c2ccccc2)o1 ZINC000009263160 556270136 /nfs/dbraw/zinc/27/01/36/556270136.db2.gz ZANZUWUHOCITGO-KAMYIIQDSA-N 0 2 427.243 4.920 40 10 IJCBLN Cc1cc(/C=C2\C(=O)NC(=O)N(c3cccc(F)c3)C2=O)c(C)n1-c1cccc(Cl)c1 ZINC000408759345 556686694 /nfs/dbraw/zinc/68/66/94/556686694.db2.gz CMNIPWPUFSGMBX-KEBDBYFISA-N 0 2 437.858 4.553 40 10 IJCBLN Cc1cc(/C=C2\C(=O)NC(=O)N(c3ccccc3F)C2=O)c(C)n1-c1cccc(Cl)c1 ZINC000408764427 556829480 /nfs/dbraw/zinc/82/94/80/556829480.db2.gz INGYPJKUXJBODF-WOJGMQOQSA-N 0 2 437.858 4.553 40 10 IJCBLN O=C1NC(=O)N(c2ccccc2)C(=O)/C1=C/c1ccccc1OCc1cccc(Cl)c1 ZINC000408801943 556858796 /nfs/dbraw/zinc/85/87/96/556858796.db2.gz WXMAQEUTUFSXID-XSFVSMFZSA-N 0 2 432.863 4.585 40 10 IJCBLN CCCOc1ccc(Cl)cc1/C=C1\C(=O)NC(=O)N(c2cccc(Cl)c2C)C1=O ZINC000408804606 556860156 /nfs/dbraw/zinc/86/01/56/556860156.db2.gz YVKUJGPQFRWMIJ-RVDMUPIBSA-N 0 2 433.291 4.757 40 10 IJCBLN CCOc1cc(/C=C2\C(=O)NC(=O)N(c3cc(Cl)ccc3C)C2=O)ccc1OC(C)C ZINC000408805521 556860840 /nfs/dbraw/zinc/86/08/40/556860840.db2.gz LBJMFLPEZHJBMX-LICLKQGHSA-N 0 2 442.899 4.501 40 10 IJCBLN Cc1cc(C=C2C(=O)NC(=O)N(c3ccc(C)c(C)c3)C2=O)c(C)n1-c1ccccc1F ZINC000408853256 556870108 /nfs/dbraw/zinc/87/01/08/556870108.db2.gz QLGDWFJUFVLUCF-DEDYPNTBSA-N 0 2 431.467 4.516 40 10 IJCBLN Cc1ccc(C)c(N2C(=O)NC(=O)C(=Cc3cccc(OCc4cccc(F)c4)c3)C2=O)c1 ZINC000408937001 556895258 /nfs/dbraw/zinc/89/52/58/556895258.db2.gz LZFNDQQMGRWVEV-HMAPJEAMSA-N 0 2 444.462 4.688 40 10 IJCBLN Cc1ccc(N2C(=O)NC(=O)C(=Cc3cccc(OCc4cccc(F)c4)c3)C2=O)cc1C ZINC000408940059 556896398 /nfs/dbraw/zinc/89/63/98/556896398.db2.gz TYFJCKIXKJWHRC-UCQKPKSFSA-N 0 2 444.462 4.688 40 10 IJCBLN CCc1ccccc1-n1c(C)cc(/C=C2\C(=O)NC(=O)N(c3cccc(Cl)c3)C2=O)c1C ZINC000408965384 556902499 /nfs/dbraw/zinc/90/24/99/556902499.db2.gz GTFDGIFKAAMBPE-FYJGNVAPSA-N 0 2 447.922 4.976 40 10 IJCBLN Cc1ccc(-n2cccc2/C=C2\C(=O)NC(=O)N(c3cccc(Cl)c3)C2=O)cc1Cl ZINC000409018689 556920070 /nfs/dbraw/zinc/92/00/70/556920070.db2.gz XSAMSGKOETZCIA-WOJGMQOQSA-N 0 2 440.286 4.759 40 10 IJCBLN Cc1cccc(-n2cccc2/C=C2\C(=O)NC(=O)N(c3cccc(Cl)c3Cl)C2=O)c1 ZINC000409070778 556945058 /nfs/dbraw/zinc/94/50/58/556945058.db2.gz MBEJDNCRRRQSPH-FOWTUZBSSA-N 0 2 440.286 4.759 40 10 IJCBLN Cc1cccc(N2C(=O)NC(=O)C(=Cc3ccc4c(c3)[C@H](C)CC(C)(C)N4C)C2=O)c1C ZINC000208197585 557078962 /nfs/dbraw/zinc/07/89/62/557078962.db2.gz VTNSJAXXERKAAR-RBYWHNRPSA-N 0 2 431.536 4.692 40 10 IJCBLN CC(=O)N(C)c1ccc(N=N[C@@H]2C(C)=NN(c3nc(-c4ccc(C)cc4)cs3)C2=O)cc1 ZINC000100525017 557263614 /nfs/dbraw/zinc/26/36/14/557263614.db2.gz REMIZVNCYYNIED-JMSHBIQUSA-N 0 2 446.536 4.976 40 10 IJCBLN Cc1cccc(COc2ccc(/C=C3\C(=O)NC(=O)N(c4ccccc4C)C3=O)cc2)c1 ZINC000014132730 557421483 /nfs/dbraw/zinc/42/14/83/557421483.db2.gz CJQQKFWOUAFCKQ-PXLXIMEGSA-N 0 2 426.472 4.549 40 10 IJCBLN CCOc1cc(C=C2C(=O)NC(=O)N(c3ccc(F)cc3)C2=O)cc(Cl)c1OCC ZINC000059135452 557815324 /nfs/dbraw/zinc/81/53/24/557815324.db2.gz BFCTWODMKPLEAG-OQLLNIDSSA-N 0 2 432.835 4.783 40 10 IJCBLN Cc1cc(C=C2C(=O)NC(=O)N(c3ccc4ccccc4c3)C2=O)c(C)n1C[C@H]1CCCO1 ZINC000059109171 557820306 /nfs/dbraw/zinc/82/03/06/557820306.db2.gz UADVIOGNABQCIR-QPHMKDBKSA-N 0 2 443.503 4.944 40 10 IJCBLN CCN1c2ccc(/C=C3\C(=O)NC(=O)N(c4ccccc4C)C3=O)cc2[C@H](C)CC1(C)C ZINC000208308905 569261185 /nfs/dbraw/zinc/26/11/85/569261185.db2.gz QYUUPNBKHSPEJU-HDAKKWKLSA-N 0 2 431.536 4.774 40 10 IJCBLN O=C1NC(=O)N(c2ccccc2)C(=O)/C1=C\c1ccc(-c2ccc(Cl)c(Cl)c2)o1 ZINC000408742659 556216176 /nfs/dbraw/zinc/21/61/76/556216176.db2.gz XQBUTRKQDCNBTH-PTNGSMBKSA-N 0 2 427.243 4.920 40 10 IJCBLN O=C1NN(c2ccc(Cl)c(Cl)c2)C(=O)/C1=C/c1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000016399942 556605264 /nfs/dbraw/zinc/60/52/64/556605264.db2.gz KSISOJDEGNKIIS-XNTDXEJSSA-N 0 2 444.230 4.623 40 10 IJCBLN Cc1cc(C=C2C(=O)NC(=O)N(c3ccc(C)cc3)C2=O)c(C)n1-c1cccc(Cl)c1 ZINC000408760165 556687284 /nfs/dbraw/zinc/68/72/84/556687284.db2.gz SSQATEUFMYJFBG-CIAFOILYSA-N 0 2 433.895 4.722 40 10 IJCBLN Cc1ccc(COc2ccc(/C=C3\C(=O)NC(=O)N(c4cccc(C)c4C)C3=O)cc2)cc1 ZINC000408796555 556857027 /nfs/dbraw/zinc/85/70/27/556857027.db2.gz ALCVALCMGXYSRH-HZHRSRAPSA-N 0 2 440.499 4.857 40 10 IJCBLN Cc1cccc(N2C(=O)NC(=O)C(=Cc3ccccc3OCc3ccc(F)cc3)C2=O)c1C ZINC000408800407 556858119 /nfs/dbraw/zinc/85/81/19/556858119.db2.gz OZQKGZQLTQVICN-KGENOOAVSA-N 0 2 444.462 4.688 40 10 IJCBLN CCOc1cc(/C=C2\C(=O)NC(=O)N(c3cccc(C)c3)C2=O)cc(Cl)c1OC(C)C ZINC000408800730 556858330 /nfs/dbraw/zinc/85/83/30/556858330.db2.gz OZPLNYMYQZEYSN-LICLKQGHSA-N 0 2 442.899 4.501 40 10 IJCBLN COc1ccc2ccccc2c1/C=C1\C(=O)NC(=O)N(c2ccc(Cl)c(Cl)c2)C1=O ZINC000408802323 556859379 /nfs/dbraw/zinc/85/93/79/556859379.db2.gz ZBTPBVDSZWVPPF-LFIBNONCSA-N 0 2 441.270 4.822 40 10 IJCBLN Cc1ccc(COc2ccccc2/C=C2\C(=O)NC(=O)N(c3ccccc3C)C2=O)cc1C ZINC000408802645 556859737 /nfs/dbraw/zinc/85/97/37/556859737.db2.gz ZTLNOQBFLLRNLK-PXLXIMEGSA-N 0 2 440.499 4.857 40 10 IJCBLN CCc1cccc(C)c1-n1c(C)cc(/C=C2\C(=O)NC(=O)N(c3ccccc3F)C2=O)c1C ZINC000408846497 556868906 /nfs/dbraw/zinc/86/89/06/556868906.db2.gz NRHKECWDSPPBJM-XSFVSMFZSA-N 0 2 445.494 4.770 40 10 IJCBLN O=C1NC(=O)N(c2ccc(Cl)cc2Cl)C(=O)/C1=C\c1ccc(N2CCCCC2)cc1 ZINC000408851185 556870995 /nfs/dbraw/zinc/87/09/95/556870995.db2.gz WFRSCYFCOGGCPM-ATVHPVEESA-N 0 2 444.318 4.650 40 10 IJCBLN CCc1ccc(N2C(=O)NC(=O)C(=Cc3ccccc3Cc3cccc(F)c3)C2=O)cc1 ZINC000408868634 556874173 /nfs/dbraw/zinc/87/41/73/556874173.db2.gz NVXOTXXBXUXXKS-XQNSMLJCSA-N 0 2 428.463 4.645 40 10 IJCBLN CCc1ccccc1N1C(=O)NC(=O)C(=Cc2ccccc2OCc2cccc(C)c2)C1=O ZINC000408869277 556874407 /nfs/dbraw/zinc/87/44/07/556874407.db2.gz QJNMBJQBIYAHMM-JWGURIENSA-N 0 2 440.499 4.803 40 10 IJCBLN CCc1ccccc1N1C(=O)NC(=O)C(=Cc2ccc(OCc3ccc(F)cc3)cc2)C1=O ZINC000408885390 556877903 /nfs/dbraw/zinc/87/79/03/556877903.db2.gz ZDYXGADMNUWTKS-JCMHNJIXSA-N 0 2 444.462 4.634 40 10 IJCBLN CC[C@@H](C)Oc1ccc2ccccc2c1/C=C1\C(=O)NC(=O)N(c2ccc(F)cc2)C1=O ZINC000408903118 556885782 /nfs/dbraw/zinc/88/57/82/556885782.db2.gz POAMBVWRMWDXAF-HFITWMCCSA-N 0 2 432.451 4.823 40 10 IJCBLN Cc1ccc(N2C(=O)NC(=O)C(=Cc3cccc(OCc4ccccc4)c3)C2=O)cc1C ZINC000408935176 556895553 /nfs/dbraw/zinc/89/55/53/556895553.db2.gz HDYDPBGXQBJBDE-HAHDFKILSA-N 0 2 426.472 4.549 40 10 IJCBLN O=C1NC(=O)N(c2cccc(Cl)c2Cl)C(=O)/C1=C/c1ccc(N2CCCCC2)cc1 ZINC000408959510 556899592 /nfs/dbraw/zinc/89/95/92/556899592.db2.gz ADMRYUCRCFJNKV-DTQAZKPQSA-N 0 2 444.318 4.650 40 10 IJCBLN CCc1cccc(C)c1-n1c(C)cc(/C=C2\C(=O)NC(=O)N(c3cccc(C)c3)C2=O)c1C ZINC000408959582 556899749 /nfs/dbraw/zinc/89/97/49/556899749.db2.gz BJAAEJHNHFKAJG-HZHRSRAPSA-N 0 2 441.531 4.940 40 10 IJCBLN CCc1ccc(N2C(=O)NC(=O)C(=Cc3cc(C)n(-c4cccc(Cl)c4)c3C)C2=O)cc1 ZINC000408990989 556911336 /nfs/dbraw/zinc/91/13/36/556911336.db2.gz YPKCHFRDQGTFFZ-XKZIYDEJSA-N 0 2 447.922 4.976 40 10 IJCBLN CC(C)COc1c(Cl)cc(Cl)cc1/C=C1\C(=O)NC(=O)N(c2ccccc2)C1=O ZINC000409048192 556931730 /nfs/dbraw/zinc/93/17/30/556931730.db2.gz REAONDWSXMDPGG-CXUHLZMHSA-N 0 2 433.291 4.695 40 10 IJCBLN COc1c(Cl)cc(Cl)cc1/C=C1\C(=O)NC(=O)N(c2ccc(C)c(Cl)c2)C1=O ZINC000409049629 556932141 /nfs/dbraw/zinc/93/21/41/556932141.db2.gz XKWDDVIPKMSRSH-AWNIVKPZSA-N 0 2 439.682 4.630 40 10 IJCBLN CCn1cc(/C=C2\C(=O)NC(=O)N(c3cccc(Cl)c3Cl)C2=O)c2ccccc21 ZINC000409099354 556954624 /nfs/dbraw/zinc/95/46/24/556954624.db2.gz LISXORNYCBVOOV-GXDHUFHOSA-N 0 2 428.275 4.634 40 10 IJCBLN CCOc1ccccc1N1C(=O)NC(=O)C(=Cc2cccn2-c2ccc(C)c(Cl)c2)C1=O ZINC000409239897 557021051 /nfs/dbraw/zinc/02/10/51/557021051.db2.gz NYRITCNSMXDPHI-QGOAFFKASA-N 0 2 449.894 4.504 40 10 IJCBLN Cc1cc(C=C2C(=O)NC(=O)N(c3cccc(Cl)c3C)C2=O)c(C)n1-c1ccccc1 ZINC000409241033 557031378 /nfs/dbraw/zinc/03/13/78/557031378.db2.gz MYTYWXUARAVVMF-UYRXBGFRSA-N 0 2 433.895 4.722 40 10 IJCBLN Cc1cc(C)cc(N2C(=O)NC(=O)C(=Cc3ccc4c(c3)[C@@H](C)CC(C)(C)N4C)C2=O)c1 ZINC000208197810 557079316 /nfs/dbraw/zinc/07/93/16/557079316.db2.gz NGAYIVIEYJPCGX-RSZPVBOMSA-N 0 2 431.536 4.692 40 10 IJCBLN Cc1cc2c(cc1/C=C1\C(=O)NC(=O)N(c3ccccc3F)C1=O)[C@@H](C)CC(C)(C)N2C ZINC000208231905 557079782 /nfs/dbraw/zinc/07/97/82/557079782.db2.gz MAFNQIMMLWWGON-BRFSQIRFSA-N 0 2 435.499 4.523 40 10 IJCBLN CCc1ccccc1N1C(=O)NC(=O)C(=Cc2cc3c(cc2C)N(C)C(C)(C)C[C@H]3C)C1=O ZINC000260567969 557296872 /nfs/dbraw/zinc/29/68/72/557296872.db2.gz MZQVQSKNHAHPDP-AQRZYSDFSA-N 0 2 445.563 4.946 40 10 IJCBLN CC1=CC(C)(C)N(C(C)C)c2ccc(/C=C3\C(=O)NC(=O)N(c4ccccc4F)C3=O)cc21 ZINC000223488950 557478561 /nfs/dbraw/zinc/47/85/61/557478561.db2.gz OISAFXAWOASVFA-CPNJWEJPSA-N 0 2 447.510 4.902 40 10 IJCBLN CCN1c2cc(C)c(/C=C3\C(=O)NC(=O)N(c4ccccc4F)C3=O)cc2[C@@H](C)CC1(C)C ZINC000223582672 557488698 /nfs/dbraw/zinc/48/86/98/557488698.db2.gz CYDGQKLYACGTFJ-HUCUOGIVSA-N 0 2 449.526 4.913 40 10 IJCBLN O=C1NC(=O)N(c2ccc(Cl)cc2)C(=O)/C1=C\c1cc(Cl)cc(Cl)c1Cl ZINC000059426702 557823606 /nfs/dbraw/zinc/82/36/06/557823606.db2.gz XPUZTQNWGBMCSF-SDQBBNPISA-N 0 2 430.074 4.967 40 10 IJCBLN COc1ccc(C=C2C(=O)NC(=O)N(c3ccc(C)cc3C)C2=O)cc1Br ZINC000059861398 557827801 /nfs/dbraw/zinc/82/78/01/557827801.db2.gz IVEDGOATPNOMDH-NTEUORMPSA-N 0 2 429.270 4.581 40 10 IJCBLN CCN(CC)c1ccc(C=C2C(=O)NC(=O)N(c3ccc(C)c(Cl)c3)C2=O)c(O)c1 ZINC000096475892 557838269 /nfs/dbraw/zinc/83/82/69/557838269.db2.gz RTSUGJRFLFDVKI-YVLHZVERSA-N 0 2 427.888 4.707 40 10 IJCBLN O=S(=O)(Nc1cc(Sc2nc[nH]n2)c(O)c2ccccc12)c1ccc2ccccc2c1 ZINC000006142968 562946303 /nfs/dbraw/zinc/94/63/03/562946303.db2.gz UGODIOOKONOGOI-UHFFFAOYSA-N 0 2 448.529 4.769 40 10 IJCBLN CCc1ccc(N2C(=O)NC(=O)C(=Cc3cc(C)n(-c4ccc(Cl)cc4)c3C)C2=O)cc1 ZINC000002258667 536184330 /nfs/dbraw/zinc/18/43/30/536184330.db2.gz GQEWULKGQFNCIO-HYARGMPZSA-N 0 2 447.922 4.976 40 10 IJCBLN CCCCCCOc1ccc(/C=C2\C(=O)NC(=O)N(c3cccc(Cl)c3)C2=O)cc1 ZINC000408540627 555800486 /nfs/dbraw/zinc/80/04/86/555800486.db2.gz URMSYGSWHUZWEQ-XSFVSMFZSA-N 0 2 426.900 4.966 40 10 IJCBLN Cc1cc(C=C2C(=O)NC(=O)N(c3cc(C)cc(C)c3)C2=O)c(C)n1-c1ccccc1F ZINC000408778345 556853863 /nfs/dbraw/zinc/85/38/63/556853863.db2.gz DYBNTNGEUMUMLH-DEDYPNTBSA-N 0 2 431.467 4.516 40 10 IJCBLN CCc1ccccc1-n1c(C)cc(/C=C2\C(=O)NC(=O)N(c3ccc(C)cc3)C2=O)c1C ZINC000408779568 556854089 /nfs/dbraw/zinc/85/40/89/556854089.db2.gz YPTUWAXBLXVOHR-PXLXIMEGSA-N 0 2 427.504 4.631 40 10 IJCBLN Cc1ccccc1N1C(=O)NC(=O)C(=Cc2cc(Cl)ccc2OCc2ccccc2)C1=O ZINC000408794693 556857010 /nfs/dbraw/zinc/85/70/10/556857010.db2.gz AVRWEMRURSFYIE-XSFVSMFZSA-N 0 2 446.890 4.894 40 10 IJCBLN Cc1c(Cl)cccc1N1C(=O)NC(=O)C(=Cc2ccc(OC(C)C)c(Cl)c2)C1=O ZINC000408806478 556858860 /nfs/dbraw/zinc/85/88/60/556858860.db2.gz JIDXKXHZCBCSIX-NTEUORMPSA-N 0 2 433.291 4.755 40 10 IJCBLN CCc1ccc(N2C(=O)NC(=O)C(=Cc3c(OC(C)C)ccc4ccccc43)C2=O)cc1 ZINC000408807905 556861379 /nfs/dbraw/zinc/86/13/79/556861379.db2.gz PDFRLBRUCFZGCX-PXLXIMEGSA-N 0 2 428.488 4.856 40 10 IJCBLN Cc1ccc(N2C(=O)NC(=O)C(=Cc3ccccc3OCc3ccc(F)cc3)C2=O)cc1C ZINC000408813332 556862957 /nfs/dbraw/zinc/86/29/57/556862957.db2.gz UASDQHLTBIAYKO-HYARGMPZSA-N 0 2 444.462 4.688 40 10 IJCBLN Cc1cccc(N2C(=O)NC(=O)C(=Cc3ccccc3OCc3cccc(Cl)c3)C2=O)c1 ZINC000408816266 556863680 /nfs/dbraw/zinc/86/36/80/556863680.db2.gz RJQXJOWWZHIJOA-KGENOOAVSA-N 0 2 446.890 4.894 40 10 IJCBLN Cc1cccc(COc2ccc(/C=C3\C(=O)NC(=O)N(c4cccc(C)c4C)C3=O)cc2)c1 ZINC000408818567 556864519 /nfs/dbraw/zinc/86/45/19/556864519.db2.gz YKAMYSKMZCOGRX-HZHRSRAPSA-N 0 2 440.499 4.857 40 10 IJCBLN O=C1NC(=O)N(c2ccccc2Cl)C(=O)/C1=C/c1ccc(OCc2ccccc2)cc1 ZINC000408813542 556865060 /nfs/dbraw/zinc/86/50/60/556865060.db2.gz OGZKTULTPSLZBN-XMHGGMMESA-N 0 2 432.863 4.585 40 10 IJCBLN Cc1ccc(COc2ccccc2/C=C2\C(=O)NC(=O)N(c3cccc(C)c3C)C2=O)cc1 ZINC000408819472 556865343 /nfs/dbraw/zinc/86/53/43/556865343.db2.gz XGZCSYFAJBOTJX-PXLXIMEGSA-N 0 2 440.499 4.857 40 10 IJCBLN COc1ccc(N2C(=O)NC(=O)C(=Cc3ccc(Cc4ccccc4Cl)cc3)C2=O)cc1 ZINC000408868048 556873954 /nfs/dbraw/zinc/87/39/54/556873954.db2.gz NCACPUIYVDPBJE-RCCKNPSSSA-N 0 2 446.890 4.606 40 10 IJCBLN O=C1NC(=O)N(c2ccccc2)C(=O)/C1=C\c1ccc(Cc2ccccc2F)c(Cl)c1 ZINC000408878198 556877246 /nfs/dbraw/zinc/87/72/46/556877246.db2.gz XZZCDMLDJCEGQD-XDHOZWIPSA-N 0 2 434.854 4.736 40 10 IJCBLN Cc1ccccc1N1C(=O)NC(=O)C(=Cc2ccc(Cc3ccccc3Cl)cc2)C1=O ZINC000408882898 556878576 /nfs/dbraw/zinc/87/85/76/556878576.db2.gz PIWQUBFEIZZINV-HMMYKYKNSA-N 0 2 430.891 4.906 40 10 IJCBLN Cc1ccc(COc2cccc(/C=C3/C(=O)NC(=O)N(c4cccc(C)c4C)C3=O)c2)cc1 ZINC000408935113 556895444 /nfs/dbraw/zinc/89/54/44/556895444.db2.gz GTFVNLMJSGQREZ-HAHDFKILSA-N 0 2 440.499 4.857 40 10 IJCBLN Cc1cccc(N2C(=O)NC(=O)C(=Cc3cccc(OCc4ccccc4F)c3)C2=O)c1C ZINC000408942221 556897634 /nfs/dbraw/zinc/89/76/34/556897634.db2.gz YFMJKBXKUTZEED-STZFKDTASA-N 0 2 444.462 4.688 40 10 IJCBLN Cc1ccc(N2C(=O)NC(=O)C(=Cc3ccc(OCc4ccccc4)cc3)C2=O)cc1Cl ZINC000408982674 556907936 /nfs/dbraw/zinc/90/79/36/556907936.db2.gz DUXLBAZRDRKFOX-BKUYFWCQSA-N 0 2 446.890 4.894 40 10 IJCBLN CCOc1c(Cl)cc(/C=C2/C(=O)NC(=O)N(c3ccc(CC)cc3)C2=O)cc1Cl ZINC000408984038 556908567 /nfs/dbraw/zinc/90/85/67/556908567.db2.gz PKZHEYNHFZKSSE-DHDCSXOGSA-N 0 2 433.291 4.621 40 10 IJCBLN Cc1ccc(NC(=O)c2c3c(sc2NS(=O)(=O)c2ccccc2)CCCC3)cc1 ZINC000409057478 556934810 /nfs/dbraw/zinc/93/48/10/556934810.db2.gz GOWUFRMJSJNGAY-UHFFFAOYSA-N 0 2 426.563 4.988 40 10 IJCBLN COc1cc(C)c(/C=C2\C(=O)NC(=O)N(c3cccc(Cl)c3C)C2=O)cc1C(C)C ZINC000409230473 557022220 /nfs/dbraw/zinc/02/22/20/557022220.db2.gz DSFAREPIMYLBOU-GZTJUZNOSA-N 0 2 426.900 4.755 40 10 IJCBLN Cc1cccc(N2C(=O)NC(=O)C(=Cc3ccc4c(c3)[C@@H](C)CC(C)(C)N4C)C2=O)c1C ZINC000208197622 557079453 /nfs/dbraw/zinc/07/94/53/557079453.db2.gz VTNSJAXXERKAAR-UOEVCUDDSA-N 0 2 431.536 4.692 40 10 IJCBLN Cc1ccc(N2C(=O)NC(=O)/C(=C\c3cc4c(cc3C)N(C)C(C)(C)C=C4C)C2=O)cc1 ZINC000208452807 557087915 /nfs/dbraw/zinc/08/79/15/557087915.db2.gz SUTYZJAMHYBGRB-FYJGNVAPSA-N 0 2 429.520 4.602 40 10 IJCBLN COc1ccc(N2C(=O)NC(=O)C(=Cc3ccc(OCc4ccccc4F)cc3)C2=O)cc1 ZINC000001199268 557120072 /nfs/dbraw/zinc/12/00/72/557120072.db2.gz BBRHFXGOVSVYHD-KGENOOAVSA-N 0 2 446.434 4.920 40 10 IJCBLN CC(C)COc1ccc(C=C2C(=O)NC(=O)N(c3cccc(Br)c3)C2=O)cc1 ZINC000059198346 557818551 /nfs/dbraw/zinc/81/85/51/557818551.db2.gz OMOCQZSSKAWKOU-VCHYOVAHSA-N 0 2 443.297 4.991 40 10 IJCBLN Cc1ccc(N2C(=O)NC(=O)C(=Cc3ccc(OCc4ccccc4)cc3)C2=O)cc1C ZINC000059336703 557822387 /nfs/dbraw/zinc/82/23/87/557822387.db2.gz NFTZJDDRTYHKIE-HZHRSRAPSA-N 0 2 426.472 4.549 40 10 IJCBLN CCN1c2cc(C)c(/C=C3\C(=O)NC(=O)N(c4ccccc4F)C3=O)cc2[C@H](C)CC1(C)C ZINC000208329185 569261377 /nfs/dbraw/zinc/26/13/77/569261377.db2.gz CYDGQKLYACGTFJ-CXDFQFJYSA-N 0 2 449.526 4.913 40 10 IJCBLN Cc1cccc(C2=NN3C(=NC(=O)/C(=C\c4cc(Cl)c(O)c(Cl)c4)C3=N)S2)c1 ZINC000003003952 569435156 /nfs/dbraw/zinc/43/51/56/569435156.db2.gz XZSCFDZXGBABPK-NBUXHNBQSA-N 0 2 431.304 4.675 40 10 IJCBLN O=C1NC(=O)N(c2ccccc2)C(=O)C1=Cc1cccn1-c1nnc(-c2ccccc2)s1 ZINC000041108859 527045937 /nfs/dbraw/zinc/04/59/37/527045937.db2.gz VCJIDCFPAGAYFX-JXAWBTAJSA-N 0 2 441.472 4.503 40 10 IJCBLN CCOc1cc(C=C2C(=O)NC(=O)N(c3ccc(OC)cc3)C2=O)cc(Cl)c1OCC ZINC000002773888 535658625 /nfs/dbraw/zinc/65/86/25/535658625.db2.gz DDZXNNJDBQGYAS-MHWRWJLKSA-N 0 2 444.871 4.653 40 10 IJCBLN Cc1ccc(COc2ccccc2/C=C2\C(=O)NC(=O)N(c3ccc(C)cc3)C2=O)cc1 ZINC000408782908 556855121 /nfs/dbraw/zinc/85/51/21/556855121.db2.gz KJLJYIKKMHSAEV-PXLXIMEGSA-N 0 2 426.472 4.549 40 10 IJCBLN CCCOc1c(Cl)cc(/C=C2\C(=O)NC(=O)N(c3ccc(C)cc3)C2=O)cc1OCC ZINC000408799746 556857775 /nfs/dbraw/zinc/85/77/75/556857775.db2.gz IFBOVQRVGNPFSK-GZTJUZNOSA-N 0 2 442.899 4.502 40 10 IJCBLN Cc1cccc(COc2ccccc2/C=C2\C(=O)NC(=O)N(c3ccc(C)c(C)c3)C2=O)c1 ZINC000408800604 556858313 /nfs/dbraw/zinc/85/83/13/556858313.db2.gz QECQFQQBXJHSLF-HZHRSRAPSA-N 0 2 440.499 4.857 40 10 IJCBLN Cc1ccc(N2C(=O)NC(=O)C(=Cc3ccccc3OCc3ccc(F)cc3)C2=O)c(C)c1 ZINC000408802655 556859767 /nfs/dbraw/zinc/85/97/67/556859767.db2.gz ZXOXGLPVEXQMDF-KGENOOAVSA-N 0 2 444.462 4.688 40 10 IJCBLN CCCOc1c(Cl)cc(/C=C2\C(=O)NC(=O)N(c3ccccc3C)C2=O)cc1OCC ZINC000408804253 556860283 /nfs/dbraw/zinc/86/02/83/556860283.db2.gz DUJVGIIAVALSFB-LFIBNONCSA-N 0 2 442.899 4.502 40 10 IJCBLN Cc1ccc(N2C(=O)NC(=O)C(=Cc3ccccc3OCc3cccc(Cl)c3)C2=O)cc1 ZINC000408816623 556863556 /nfs/dbraw/zinc/86/35/56/556863556.db2.gz UDWNSTKQRGEGEA-KGENOOAVSA-N 0 2 446.890 4.894 40 10 IJCBLN Cc1cccc(N2C(=O)NC(=O)C(=Cc3ccccc3OCc3ccc(C)c(C)c3)C2=O)c1 ZINC000408819516 556864070 /nfs/dbraw/zinc/86/40/70/556864070.db2.gz ZDWKTRRZQHLMSC-HZHRSRAPSA-N 0 2 440.499 4.857 40 10 IJCBLN O=C1NC(=O)N(c2ccccc2)C(=O)/C1=C/c1ccc(Cc2cccc(F)c2)c(Cl)c1 ZINC000408876416 556876598 /nfs/dbraw/zinc/87/65/98/556876598.db2.gz OTGZBWWOXLKHPX-DEDYPNTBSA-N 0 2 434.854 4.736 40 10 IJCBLN CCc1ccc(N2C(=O)NC(=O)C(=Cc3ccc(Cc4ccccc4F)cc3)C2=O)cc1 ZINC000408877342 556876900 /nfs/dbraw/zinc/87/69/00/556876900.db2.gz UZPJARNZNTVGIH-CJLVFECKSA-N 0 2 428.463 4.645 40 10 IJCBLN CC[C@H](C)Oc1ccc2ccccc2c1/C=C1\C(=O)NC(=O)N(c2ccc(C)cc2)C1=O ZINC000408901520 556882739 /nfs/dbraw/zinc/88/27/39/556882739.db2.gz YLKYXKDMPPUBBF-HINJULBWSA-N 0 2 428.488 4.992 40 10 IJCBLN O=C1NC(=O)N(c2ccc(Cl)c(Cl)c2)C(=O)/C1=C/c1ccc(N2CCCCC2)cc1 ZINC000408960901 556899490 /nfs/dbraw/zinc/89/94/90/556899490.db2.gz PORWYVOOINHTIW-SFQUDFHCSA-N 0 2 444.318 4.650 40 10 IJCBLN CCc1ccc(N2C(=O)NC(=O)C(=Cc3ccccc3OCc3cccc(C)c3)C2=O)cc1 ZINC000408990605 556911283 /nfs/dbraw/zinc/91/12/83/556911283.db2.gz OFLWQJYJGSHFCD-KQWNVCNZSA-N 0 2 440.499 4.803 40 10 IJCBLN COc1ccc(N2C(=O)NC(=O)C(=Cc3ccc(Sc4ccc(C)cc4)cc3)C2=O)cc1 ZINC000409244675 557026775 /nfs/dbraw/zinc/02/67/75/557026775.db2.gz HCWXOROZSFVUSC-PXLXIMEGSA-N 0 2 444.512 4.821 40 10 IJCBLN CCN1c2ccc(/C=C3\C(=O)NC(=O)N(c4cccc(C)c4)C3=O)cc2C(C)=CC1(C)C ZINC000208502947 557093173 /nfs/dbraw/zinc/09/31/73/557093173.db2.gz LBCYDIUUPDLFHC-KGENOOAVSA-N 0 2 429.520 4.683 40 10 IJCBLN CCN1c2cc(C)c(/C=C3\C(=O)NC(=O)N(c4ccccc4)C3=O)cc2C(C)=CC1(C)C ZINC000208524306 557093518 /nfs/dbraw/zinc/09/35/18/557093518.db2.gz CPLPDCBASGLZAE-KGENOOAVSA-N 0 2 429.520 4.683 40 10 IJCBLN Cc1c(C=C2C(=O)NC(=O)N(c3ccc(C)cc3)C2=O)c2ccccc2n1Cc1ccccc1 ZINC000207317233 557236676 /nfs/dbraw/zinc/23/66/76/557236676.db2.gz QODPTDCMKBSBAR-LFVJCYFKSA-N 0 2 449.510 4.973 40 10 IJCBLN CN(C)c1ccc([C@@H]2CC(c3c(O)c4ccccc4n(C)c3=O)=Nc3ccccc3N2)cc1 ZINC000104827571 557328815 /nfs/dbraw/zinc/32/88/15/557328815.db2.gz HEVQNYARMKVDIC-QFIPXVFZSA-N 0 2 438.531 4.988 40 10 IJCBLN Cc1cc(C=C2C(=O)NC(=O)N(c3ccccc3C)C2=O)c(C)n1-c1cccc(Cl)c1 ZINC000014132767 557421458 /nfs/dbraw/zinc/42/14/58/557421458.db2.gz FOWWZBAGOXMCTK-UDWIEESQSA-N 0 2 433.895 4.722 40 10 IJCBLN Cc1cc(C=C2C(=O)NC(=O)N(c3ccc(Cl)cc3)C2=O)c(C)n1-c1ccc(O)cc1 ZINC000033535460 557808393 /nfs/dbraw/zinc/80/83/93/557808393.db2.gz ZPSIRJQUNGELAK-UDWIEESQSA-N 0 2 435.867 4.960 40 10 IJCBLN COC(=O)c1ccc(-c2ccc(C=C3C(=O)NC(=O)N(c4ccc(F)cc4)C3=O)o2)c(C)c1 ZINC000059135402 557815319 /nfs/dbraw/zinc/81/53/19/557815319.db2.gz BGOMGHJFEZVHEY-XDHOZWIPSA-N 0 2 448.406 4.687 40 10 IJCBLN Cc1cc(C=C2C(=O)NC(=O)N(c3cccc(C)c3)C2=O)c(C)n1-c1cccc(Cl)c1 ZINC000408753736 556235153 /nfs/dbraw/zinc/23/51/53/556235153.db2.gz HRDOINWSTVGXQK-CIAFOILYSA-N 0 2 433.895 4.722 40 10 IJCBLN CCc1ccc(-n2c(C)cc(/C=C3\C(=O)NC(=O)N(c4ccc(C)c(C)c4)C3=O)c2C)cc1 ZINC000408756164 556239471 /nfs/dbraw/zinc/23/94/71/556239471.db2.gz UKANSHLAZQUHIM-BUVRLJJBSA-N 0 2 441.531 4.940 40 10 IJCBLN O=C1NC(=O)N(c2ccc(Br)cc2)C(=O)C1=Cc1c(O)ccc2ccccc12 ZINC000083327227 556663694 /nfs/dbraw/zinc/66/36/94/556663694.db2.gz JFSDCWZXRZWSEP-GZTJUZNOSA-N 0 2 437.249 4.815 40 10 IJCBLN CCOc1ccc2ccc(OCC)c(/C=C3\C(=O)NC(=O)N(c4cccc(C)c4)C3=O)c2c1 ZINC000408776716 556847625 /nfs/dbraw/zinc/84/76/25/556847625.db2.gz PXOZRMYYYYLNNC-PXLXIMEGSA-N 0 2 444.487 4.612 40 10 IJCBLN Cc1cc(C)cc(N2C(=O)NC(=O)C(=Cc3ccccc3OCc3ccccc3F)C2=O)c1 ZINC000408786500 556856522 /nfs/dbraw/zinc/85/65/22/556856522.db2.gz RJQZFENPMQZZPU-KGENOOAVSA-N 0 2 444.462 4.688 40 10 IJCBLN CCCOc1ccc(/C=C2\C(=O)NC(=O)N(c3cc(Cl)ccc3C)C2=O)cc1OCC ZINC000408798867 556857866 /nfs/dbraw/zinc/85/78/66/556857866.db2.gz GHIPOVGEFYTAFM-GZTJUZNOSA-N 0 2 442.899 4.502 40 10 IJCBLN Cc1ccc(COc2ccccc2/C=C2\C(=O)NC(=O)N(c3cccc(C)c3)C2=O)cc1 ZINC000408803790 556859994 /nfs/dbraw/zinc/85/99/94/556859994.db2.gz AMNGAUHPRKDRMN-PXLXIMEGSA-N 0 2 426.472 4.549 40 10 IJCBLN Cc1cccc(N2C(=O)NC(=O)C(=Cc3ccc(OCc4cccc(Cl)c4)cc3)C2=O)c1 ZINC000408809216 556861756 /nfs/dbraw/zinc/86/17/56/556861756.db2.gz KRQBRUAHLUZZKS-HYARGMPZSA-N 0 2 446.890 4.894 40 10 IJCBLN Cc1cc(C)cc(Cc2ccc(/C=C3/C(=O)NC(=O)N(c4ccccc4F)C3=O)cc2)c1 ZINC000408867625 556873916 /nfs/dbraw/zinc/87/39/16/556873916.db2.gz JEJURPOLEXVBTO-QNGOZBTKSA-N 0 2 428.463 4.700 40 10 IJCBLN Cc1ccc(N2C(=O)NC(=O)C(=Cc3ccc(Cc4cccc(F)c4)cc3)C2=O)c(C)c1 ZINC000408871532 556875069 /nfs/dbraw/zinc/87/50/69/556875069.db2.gz YRTPWGDMYQIVTG-PXLXIMEGSA-N 0 2 428.463 4.700 40 10 IJCBLN Cc1ccc(N2C(=O)NC(=O)C(=Cc3ccc(Cc4ccccc4F)cc3)C2=O)cc1C ZINC000408872785 556875211 /nfs/dbraw/zinc/87/52/11/556875211.db2.gz ITTSFBLQURUTEC-PXLXIMEGSA-N 0 2 428.463 4.700 40 10 IJCBLN O=C1NC(=O)N(c2cccc(Cl)c2)C(=O)/C1=C\c1ccccc1Cc1cccc(F)c1 ZINC000408873572 556875549 /nfs/dbraw/zinc/87/55/49/556875549.db2.gz SDMNQBHUMTWOBW-FYJGNVAPSA-N 0 2 434.854 4.736 40 10 IJCBLN Cc1ccc(COc2ccccc2/C=C2/C(=O)NC(=O)N(c3ccccc3F)C2=O)cc1C ZINC000408877081 556876801 /nfs/dbraw/zinc/87/68/01/556876801.db2.gz PNLJQWWIDQXQJZ-ZHZULCJRSA-N 0 2 444.462 4.688 40 10 IJCBLN CCc1ccccc1N1C(=O)NC(=O)C(=Cc2ccccc2OCc2ccccc2F)C1=O ZINC000408882777 556878595 /nfs/dbraw/zinc/87/85/95/556878595.db2.gz QVCITETZLREVRM-HKWRFOASSA-N 0 2 444.462 4.634 40 10 IJCBLN Cc1cccc(N2C(=O)NC(=O)C(=Cc3ccc(OCc4ccccc4F)cc3)C2=O)c1C ZINC000408889870 556878820 /nfs/dbraw/zinc/87/88/20/556878820.db2.gz KEGCAFSWYNHWPY-KGENOOAVSA-N 0 2 444.462 4.688 40 10 IJCBLN Cc1ccc(C)c(N2C(=O)NC(=O)C(=Cc3ccccc3OCc3ccccc3F)C2=O)c1 ZINC000408889987 556879195 /nfs/dbraw/zinc/87/91/95/556879195.db2.gz METXFEFTBMRNEP-XSFVSMFZSA-N 0 2 444.462 4.688 40 10 IJCBLN CCCOc1ccc(N2C(=O)NC(=O)C(=Cc3cc(Cl)ccc3OCCC)C2=O)cc1 ZINC000408898035 556883294 /nfs/dbraw/zinc/88/32/94/556883294.db2.gz KSFINWHSKZDRHQ-RGEXLXHISA-N 0 2 442.899 4.584 40 10 IJCBLN CCn1c2ccccc2c2cc(/C=C3\C(=O)NC(=O)N(c4ccc(F)cc4)C3=O)ccc21 ZINC000408902593 556885316 /nfs/dbraw/zinc/88/53/16/556885316.db2.gz KSXTUPJIHGFHIA-XSFVSMFZSA-N 0 2 427.435 4.620 40 10 IJCBLN Cc1cc(/C=C2\C(=O)NC(=O)N(c3cccc(F)c3)C2=O)c(C)n1-c1c(C)cccc1C ZINC000408911758 556888472 /nfs/dbraw/zinc/88/84/72/556888472.db2.gz OKUDLJUBIOHZIQ-CIAFOILYSA-N 0 2 431.467 4.516 40 10 IJCBLN O=C1NC(=O)N(c2cccc(Cl)c2)C(=O)/C1=C\c1cccc(OCc2ccccc2)c1 ZINC000408938431 556897089 /nfs/dbraw/zinc/89/70/89/556897089.db2.gz QMLYFQYYCVXWFU-BKUYFWCQSA-N 0 2 432.863 4.585 40 10 IJCBLN Cc1ccc(N2C(=O)NC(=O)C(=Cc3ccccc3OCc3ccccc3)C2=O)cc1Cl ZINC000408988687 556909015 /nfs/dbraw/zinc/90/90/15/556909015.db2.gz IVJXIZFRXRKYDA-MOSHPQCFSA-N 0 2 446.890 4.894 40 10 IJCBLN CCc1ccc(N2C(=O)NC(=O)C(=Cc3cc(C)n(-c4ccccc4CC)c3C)C2=O)cc1 ZINC000408985749 556909304 /nfs/dbraw/zinc/90/93/04/556909304.db2.gz YIDZRQOSDXMYPF-KQWNVCNZSA-N 0 2 441.531 4.885 40 10 IJCBLN Cc1ccccc1N1C(=O)NC(=O)/C(=C\c2cc3c(cc2Cl)N(C)C(C)(C)C=C3C)C1=O ZINC000208476005 557092570 /nfs/dbraw/zinc/09/25/70/557092570.db2.gz UNCZMMZUDYCBEF-WOJGMQOQSA-N 0 2 449.938 4.947 40 10 IJCBLN CCN1c2ccc(/C=C3\C(=O)NC(=O)N(c4ccccc4C)C3=O)cc2C(C)=CC1(C)C ZINC000208514103 557093245 /nfs/dbraw/zinc/09/32/45/557093245.db2.gz SZNROMPPOXPCCT-XSFVSMFZSA-N 0 2 429.520 4.683 40 10 IJCBLN CC(=O)Nc1ccc(N=N[C@H]2C(C)=NN(c3nc(-c4ccc(C)cc4)cs3)C2=O)cc1 ZINC000100510927 557115652 /nfs/dbraw/zinc/11/56/52/557115652.db2.gz BWVYWJWKOBRNLX-QTJUSOIVSA-N 0 2 432.509 4.952 40 10 IJCBLN Cc1ccc(COc2ccc(/C=C3\C(=O)NC(=O)N(c4ccccc4C)C3=O)cc2)cc1 ZINC000014132796 557421586 /nfs/dbraw/zinc/42/15/86/557421586.db2.gz QRZQDHWXZMOTME-PXLXIMEGSA-N 0 2 426.472 4.549 40 10 IJCBLN Cc1ccc(N2C(=O)NC(=O)C(=Cc3ccc(N4CCCCC4)c([N+](=O)[O-])c3)C2=O)cc1C ZINC000008781243 132294458 /nfs/dbraw/zinc/29/44/58/132294458.db2.gz LTOGMJHAAGOSLH-CPNJWEJPSA-N 0 2 448.479 4.709 40 10 IJCBLN Cc1cccc(COc2ccccc2/C=C2\C(=O)NC(=O)N(c3ccc(Cl)cc3)C2=O)c1 ZINC000408778199 556853795 /nfs/dbraw/zinc/85/37/95/556853795.db2.gz QTQNXGBLQNGVKH-KGENOOAVSA-N 0 2 446.890 4.894 40 10 IJCBLN Cc1cc(C)cc(N2C(=O)NC(=O)C(=Cc3ccccc3OCc3ccccc3)C2=O)c1 ZINC000408787037 556856752 /nfs/dbraw/zinc/85/67/52/556856752.db2.gz ZXAICOHFLVVKSE-PXLXIMEGSA-N 0 2 426.472 4.549 40 10 IJCBLN Cc1ccc(COc2ccc(/C=C3\C(=O)NC(=O)N(c4ccc(C)c(C)c4)C3=O)cc2)cc1 ZINC000408804010 556859880 /nfs/dbraw/zinc/85/98/80/556859880.db2.gz BWBVXSBEOPVTJL-BUVRLJJBSA-N 0 2 440.499 4.857 40 10 IJCBLN Cc1ccc(COc2ccccc2/C=C2\C(=O)NC(=O)N(c3ccc(C)cc3C)C2=O)cc1 ZINC000408804055 556859888 /nfs/dbraw/zinc/85/98/88/556859888.db2.gz CJJXHKGVNSDFDR-PXLXIMEGSA-N 0 2 440.499 4.857 40 10 IJCBLN CCCOc1ccc2ccccc2c1/C=C1\C(=O)NC(=O)N(c2ccc(CC)cc2)C1=O ZINC000408804235 556860293 /nfs/dbraw/zinc/86/02/93/556860293.db2.gz DOSLGQYGSWDACC-CJLVFECKSA-N 0 2 428.488 4.857 40 10 IJCBLN Cc1ccc(COc2ccc(/C=C3\C(=O)NC(=O)N(c4ccccc4Cl)C3=O)cc2)cc1 ZINC000408806056 556861045 /nfs/dbraw/zinc/86/10/45/556861045.db2.gz ALPZCEPWNHGOLO-XSFVSMFZSA-N 0 2 446.890 4.894 40 10 IJCBLN Cc1ccc(COc2ccccc2/C=C2\C(=O)NC(=O)N(c3ccc(C)c(C)c3)C2=O)cc1 ZINC000408811884 556862778 /nfs/dbraw/zinc/86/27/78/556862778.db2.gz WLNAFPXKVCTIDE-HZHRSRAPSA-N 0 2 440.499 4.857 40 10 IJCBLN Cc1cccc(N2C(=O)NC(=O)C(=Cc3ccc(OCc4ccccc4)c(Cl)c3)C2=O)c1 ZINC000408819011 556864794 /nfs/dbraw/zinc/86/47/94/556864794.db2.gz WGWRLDPXEAEUGU-DEDYPNTBSA-N 0 2 446.890 4.894 40 10 IJCBLN CCc1ccccc1N1C(=O)NC(=O)C(=Cc2ccccc2Cc2ccccc2F)C1=O ZINC000408869611 556874383 /nfs/dbraw/zinc/87/43/83/556874383.db2.gz QCPKUZUMGYXSTD-PGMHBOJBSA-N 0 2 428.463 4.645 40 10 IJCBLN Cc1ccc(C)c(N2C(=O)NC(=O)C(=Cc3ccc(OCc4ccccc4F)cc3)C2=O)c1 ZINC000408878785 556877482 /nfs/dbraw/zinc/87/74/82/556877482.db2.gz BDTSHVUFWXJNCP-KGENOOAVSA-N 0 2 444.462 4.688 40 10 IJCBLN Cc1cccc(N2C(=O)NC(=O)C(=Cc3ccccc3Cc3cccc(F)c3)C2=O)c1C ZINC000408884717 556877658 /nfs/dbraw/zinc/87/76/58/556877658.db2.gz VAXWFBGNBIVISB-PXLXIMEGSA-N 0 2 428.463 4.700 40 10 IJCBLN Cc1ccc(N2C(=O)NC(=O)C(=Cc3cc(C(C)(C)C)c(O)c(C(C)(C)C)c3)C2=O)cc1 ZINC000408986289 556909716 /nfs/dbraw/zinc/90/97/16/556909716.db2.gz PNZKDCRKIZKWML-LDADJPATSA-N 0 2 434.536 4.962 40 10 IJCBLN COc1c(Cl)cc(/C=C2/C(=O)NC(=O)N(c3ccc(C)c(Cl)c3)C2=O)cc1Cl ZINC000408984398 556910909 /nfs/dbraw/zinc/91/09/09/556910909.db2.gz QLJZEPNPXWRPSU-XGICHPGQSA-N 0 2 439.682 4.630 40 10 IJCBLN CCOc1ccc(/C=C2/C(=O)NC(=O)N(c3ccc(C)c(Cl)c3)C2=O)c2ccccc12 ZINC000408988942 556911922 /nfs/dbraw/zinc/91/19/22/556911922.db2.gz SFJFZPZHJWTAED-UNOMPAQXSA-N 0 2 434.879 4.867 40 10 IJCBLN CCc1ccccc1N1C(=O)NC(=O)C(=Cc2cc3c(cc2C)N(C)C(C)(C)C[C@@H]3C)C1=O ZINC000208231950 557079818 /nfs/dbraw/zinc/07/98/18/557079818.db2.gz MZQVQSKNHAHPDP-JPOGYNCRSA-N 0 2 445.563 4.946 40 10 IJCBLN CCc1ccc(N2C(=O)NC(=O)C(=Cc3cc4c(cc3C)N(C)C(C)(C)C[C@@H]4C)C2=O)cc1 ZINC000208232275 557079847 /nfs/dbraw/zinc/07/98/47/557079847.db2.gz VVUVKYWBAPAYLT-NIZGNDASSA-N 0 2 445.563 4.946 40 10 IJCBLN C[C@H]1CC(C)(C)N(C)c2cc(Cl)c(/C=C3\C(=O)NC(=O)N(c4ccccc4)C3=O)cc21 ZINC000208240464 557080132 /nfs/dbraw/zinc/08/01/32/557080132.db2.gz QTPRZTSUGKSDNE-BGARDKSCSA-N 0 2 437.927 4.728 40 10 IJCBLN COc1cccc(N=N[C@@H]2C(=O)N(c3nc(-c4cccc([N+](=O)[O-])c4)cs3)N=C2C)c1 ZINC000100525285 557114745 /nfs/dbraw/zinc/11/47/45/557114745.db2.gz ZEMWZFFQPVRDLP-CCWVLBSLSA-N 0 2 436.453 4.602 40 10 IJCBLN O=C1NN(c2ccc(Cl)cc2)C(=O)/C1=C/c1ccc(-c2cccc(Br)c2)o1 ZINC000001202921 557120451 /nfs/dbraw/zinc/12/04/51/557120451.db2.gz LHNLKPLVQNWGME-GZTJUZNOSA-N 0 2 443.684 4.824 40 10 IJCBLN CCOC(=O)c1ccc(-c2ccc(C=C3C(=O)NC(=O)N(c4ccccc4)C3=O)o2)cc1 ZINC000016687889 557475148 /nfs/dbraw/zinc/47/51/48/557475148.db2.gz SKZABYNDFCPDGT-XMHGGMMESA-N 0 2 430.416 4.630 40 10 IJCBLN CCN1c2ccc(/C=C3\C(=O)NC(=O)N(c4cccc(C)c4)C3=O)cc2[C@@H](C)CC1(C)C ZINC000223533133 557482944 /nfs/dbraw/zinc/48/29/44/557482944.db2.gz YOLYKVVVUNWYNG-JPOGYNCRSA-N 0 2 431.536 4.774 40 10 IJCBLN Cc1ccc(Sc2ccc(C=C3C(=O)NC(=O)N(c4ccc5c(c4)OCO5)C3=O)o2)cc1 ZINC000059104476 557814076 /nfs/dbraw/zinc/81/40/76/557814076.db2.gz NBCNIKIHTZLBHZ-GZTJUZNOSA-N 0 2 448.456 4.975 40 10 IJCBLN Cc1c(C=C2C(=O)NC(=O)N(c3ccc(Br)cc3)C2=O)c2ccccc2n1C ZINC000059198189 557818524 /nfs/dbraw/zinc/81/85/24/557818524.db2.gz NJNKWVGVRIFSRT-BOPFTXTBSA-N 0 2 438.281 4.756 40 10 IJCBLN Cc1cc(C=C2C(=O)NC(=O)N(c3ccc4ccccc4c3)C2=O)c(C)n1C[C@@H]1CCCO1 ZINC000059109170 557820203 /nfs/dbraw/zinc/82/02/03/557820203.db2.gz UADVIOGNABQCIR-MQXJPVLKSA-N 0 2 443.503 4.944 40 10 IJCBLN CCOc1ccc(N2C(=O)NC(=O)C(=Cc3cc(F)c(N4CCCC4)cc3C)C2=O)cc1 ZINC000033738281 569259810 /nfs/dbraw/zinc/25/98/10/569259810.db2.gz NZZTXSHDINOEAY-CPNJWEJPSA-N 0 2 437.471 4.640 40 10 IJCBLN CCOc1ccc(N2C(=O)NC(=O)C(=Cc3cc(Cl)cc(Cl)c3Cl)C2=O)cc1 ZINC000408740424 556212681 /nfs/dbraw/zinc/21/26/81/556212681.db2.gz KKBLGMSVFKWRTN-ZSOIEALJSA-N 0 2 439.682 4.712 40 10 IJCBLN Cc1cc(/C=C2\C(=O)NC(=O)N(c3cccc(C)c3C)C2=O)c(C)n1-c1cccc(C)c1 ZINC000408763326 556829152 /nfs/dbraw/zinc/82/91/52/556829152.db2.gz PBTSKVOUMLNQPW-HYARGMPZSA-N 0 2 427.504 4.686 40 10 IJCBLN CCCOc1ccc2ccccc2c1/C=C1\C(=O)NC(=O)N(c2ccc(C)c(C)c2)C1=O ZINC000408795558 556857018 /nfs/dbraw/zinc/85/70/18/556857018.db2.gz CJJIPSNMRWCAGX-PXLXIMEGSA-N 0 2 428.488 4.912 40 10 IJCBLN Cc1ccc(COc2ccccc2/C=C2\C(=O)NC(=O)N(c3ccccc3)C2=O)cc1C ZINC000408804428 556860207 /nfs/dbraw/zinc/86/02/07/556860207.db2.gz FWZPNWATYJJLAT-PXLXIMEGSA-N 0 2 426.472 4.549 40 10 IJCBLN Cc1ccc(N2C(=O)NC(=O)C(=Cc3c(OC(C)C)ccc4ccccc43)C2=O)cc1C ZINC000408812679 556863065 /nfs/dbraw/zinc/86/30/65/556863065.db2.gz MGPILGXTKVBRLR-HYARGMPZSA-N 0 2 428.488 4.910 40 10 IJCBLN Cc1ccc(C)c(N2C(=O)NC(=O)C(=Cc3ccccc3Cc3ccccc3F)C2=O)c1 ZINC000408873941 556875872 /nfs/dbraw/zinc/87/58/72/556875872.db2.gz XOYOGLLWIHALMN-RCCKNPSSSA-N 0 2 428.463 4.700 40 10 IJCBLN Cc1ccc(N2C(=O)NC(=O)C(=Cc3ccc(Cc4ccccc4Cl)cc3)C2=O)cc1 ZINC000408878015 556877138 /nfs/dbraw/zinc/87/71/38/556877138.db2.gz YUPNBYWZTHITJR-RCCKNPSSSA-N 0 2 430.891 4.906 40 10 IJCBLN O=C1NC(=O)N(c2ccccc2Cl)C(=O)/C1=C\c1ccccc1Cc1cccc(F)c1 ZINC000408878831 556877504 /nfs/dbraw/zinc/87/75/04/556877504.db2.gz CEIWRQCAQXIFHN-XMHGGMMESA-N 0 2 434.854 4.736 40 10 IJCBLN CC(C)(C)c1cc(/C=C2\C(=O)NC(=O)N(c3cccc(F)c3)C2=O)cc(C(C)(C)C)c1O ZINC000408913546 556889270 /nfs/dbraw/zinc/88/92/70/556889270.db2.gz VKMPXVDAZICROA-LICLKQGHSA-N 0 2 438.499 4.793 40 10 IJCBLN O=C1NC(=O)N(c2ccccc2Cl)C(=O)/C1=C\c1cccc(OCc2ccccc2)c1 ZINC000408934660 556895520 /nfs/dbraw/zinc/89/55/20/556895520.db2.gz FNXAKXOSSAESHD-RGEXLXHISA-N 0 2 432.863 4.585 40 10 IJCBLN Cc1ccc(N2C(=O)NC(=O)C(=Cc3cccc(OCc4ccccc4F)c3)C2=O)cc1C ZINC000408936027 556895682 /nfs/dbraw/zinc/89/56/82/556895682.db2.gz JQGLMVPBVAIELJ-HMAPJEAMSA-N 0 2 444.462 4.688 40 10 IJCBLN CCc1ccc(N2C(=O)NC(=O)C(=Cc3cccc(OCc4ccc(C)cc4)c3)C2=O)cc1 ZINC000408937275 556896875 /nfs/dbraw/zinc/89/68/75/556896875.db2.gz NSDCUGVGIGFKJP-JLPGSUDCSA-N 0 2 440.499 4.803 40 10 IJCBLN O=C1NC(=O)N(c2ccccc2)C(=O)/C1=C\c1cccc(OCc2ccc(Cl)cc2)c1 ZINC000408938225 556897124 /nfs/dbraw/zinc/89/71/24/556897124.db2.gz PLGCJZGDOPJGHA-STZFKDTASA-N 0 2 432.863 4.585 40 10 IJCBLN CCc1ccc(N2C(=O)NC(=O)C(=Cc3cc(C)n(-c4cccc(C)c4C)c3C)C2=O)cc1 ZINC000408981288 556907756 /nfs/dbraw/zinc/90/77/56/556907756.db2.gz ALGIMHSUQSXNEU-HAHDFKILSA-N 0 2 441.531 4.940 40 10 IJCBLN COc1c(Cl)cc(Cl)cc1/C=C1\C(=O)NC(=O)N(c2cccc(Cl)c2C)C1=O ZINC000409060239 556937266 /nfs/dbraw/zinc/93/72/66/556937266.db2.gz YQIUOUPPCRZWPJ-KPKJPENVSA-N 0 2 439.682 4.630 40 10 IJCBLN CCOc1ccc(/C=C2\C(=O)NC(=O)N(c3cccc(Cl)c3C)C2=O)c2ccccc12 ZINC000409250221 557030625 /nfs/dbraw/zinc/03/06/25/557030625.db2.gz MRIOFPOUAUPRER-QGOAFFKASA-N 0 2 434.879 4.867 40 10 IJCBLN Cc1ccc(N2C(=O)NC(=O)/C(=C\c3cc4c(cc3C)N(C)C(C)(C)C=C4C)C2=O)cc1C ZINC000208454198 557087889 /nfs/dbraw/zinc/08/78/89/557087889.db2.gz YWTTZSAIMLNNQE-LPYMAVHISA-N 0 2 443.547 4.910 40 10 IJCBLN CCCCOc1ccc(C=C2C(=O)NC(=O)N(c3ccc(OCC)cc3)C2=O)cc1OC ZINC000038199874 557208058 /nfs/dbraw/zinc/20/80/58/557208058.db2.gz BQZGMCDLZROTTE-XMHGGMMESA-N 0 2 438.480 4.780 40 10 IJCBLN COC(=O)Cc1[nH]n(-c2ccc(F)cc2)c(=O)c1C(C)=Nc1cc(Cl)ccc1Cl ZINC000112293487 557239200 /nfs/dbraw/zinc/23/92/00/557239200.db2.gz KXFBIQNITAUDNA-ODLFYWEKSA-N 0 2 436.270 4.784 40 10 IJCBLN CC1=CC(C)(C)N(C(C)C)c2ccc(/C=C3\C(=O)NC(=O)N(c4ccccc4)C3=O)cc21 ZINC000223483364 557477547 /nfs/dbraw/zinc/47/75/47/557477547.db2.gz DYAUVAYCAKHMOS-KGENOOAVSA-N 0 2 429.520 4.763 40 10 IJCBLN Cc1ccc(-c2ccc(C=C3C(=O)NC(=O)N(c4ccc(F)cc4)C3=O)o2)cc1[N+](=O)[O-] ZINC000059135434 557815276 /nfs/dbraw/zinc/81/52/76/557815276.db2.gz CLGPZBHATSITGM-GZTJUZNOSA-N 0 2 435.367 4.809 40 10 IJCBLN CCN1c2ccc(/C=C3\C(=O)NC(=O)N(c4ccccc4F)C3=O)cc2[C@H](C)CC1(C)C ZINC000208305484 569261160 /nfs/dbraw/zinc/26/11/60/569261160.db2.gz VRYFWYNDBIYMIJ-COYFKBPASA-N 0 2 435.499 4.604 40 10 IJCBLN O=C1NC(=O)N(c2ccc(F)cc2)C(=O)C1=Cc1cn(Cc2ccccc2)c2ccccc12 ZINC000002276830 132251016 /nfs/dbraw/zinc/25/10/16/132251016.db2.gz LMZNFBQQYGTXBX-HYARGMPZSA-N 0 2 439.446 4.700 40 10 IJCBLN O=C1NC(=O)N(c2ccccc2)C(=O)/C1=C\c1ccc(-c2cccc(Cl)c2Cl)o1 ZINC000408742821 556216182 /nfs/dbraw/zinc/21/61/82/556216182.db2.gz YHAWTTQMJLHURR-PTNGSMBKSA-N 0 2 427.243 4.920 40 10 IJCBLN Cc1cc(C=C2C(=O)NC(=O)N(c3cc(C)cc(C)c3)C2=O)c(C)n1-c1ccccc1C ZINC000408772123 556847541 /nfs/dbraw/zinc/84/75/41/556847541.db2.gz DCPBBHNBJHKAGD-HYARGMPZSA-N 0 2 427.504 4.686 40 10 IJCBLN Cc1cccc(COc2ccccc2/C=C2\C(=O)NC(=O)N(c3cccc(C)c3C)C2=O)c1 ZINC000408801610 556858545 /nfs/dbraw/zinc/85/85/45/556858545.db2.gz UXLXZOZAHAGFKP-PXLXIMEGSA-N 0 2 440.499 4.857 40 10 IJCBLN CCCOc1ccc(/C=C2\C(=O)NC(=O)N(c3ccc(C)c(Cl)c3)C2=O)cc1Cl ZINC000408819100 556864855 /nfs/dbraw/zinc/86/48/55/556864855.db2.gz WRFRMMMQDXDZJS-OQLLNIDSSA-N 0 2 433.291 4.757 40 10 IJCBLN Cc1cccc(COc2ccc(/C=C3\C(=O)NC(=O)N(c4cc(C)ccc4C)C3=O)cc2)c1 ZINC000408814160 556865268 /nfs/dbraw/zinc/86/52/68/556865268.db2.gz NZCDWJLMUOEZKP-HZHRSRAPSA-N 0 2 440.499 4.857 40 10 IJCBLN O=C1NC(=O)N(c2ccccc2)C(=O)/C1=C/c1ccc(OCc2ccc(Cl)cc2)cc1 ZINC000408815180 556865595 /nfs/dbraw/zinc/86/55/95/556865595.db2.gz PPUNSYDYUDNUBA-KGENOOAVSA-N 0 2 432.863 4.585 40 10 IJCBLN O=C1NC(=O)N(c2cccc(Cl)c2)C(=O)/C1=C/c1ccc(Cc2ccccc2F)cc1 ZINC000408871911 556875222 /nfs/dbraw/zinc/87/52/22/556875222.db2.gz ZKYGIJCBOKDOLT-DEDYPNTBSA-N 0 2 434.854 4.736 40 10 IJCBLN COc1cc(/C=C2\C(=O)NC(=O)N(c3ccccc3)C2=O)ccc1Cc1cc(C)cc(C)c1 ZINC000408877753 556877156 /nfs/dbraw/zinc/87/71/56/556877156.db2.gz YHSXRLCNWKJRGT-HZHRSRAPSA-N 0 2 440.499 4.569 40 10 IJCBLN Cc1cccc(N2C(=O)NC(=O)/C(=C\c3ccccc3OCc3cc(C)cc(C)c3)C2=O)c1 ZINC000408890725 556879022 /nfs/dbraw/zinc/87/90/22/556879022.db2.gz YFLWEHBURFYXLC-HZHRSRAPSA-N 0 2 440.499 4.857 40 10 IJCBLN Cc1ccc(C)c(N2C(=O)NC(=O)C(=Cc3cccc(OCc4ccccc4)c3)C2=O)c1 ZINC000408934648 556895555 /nfs/dbraw/zinc/89/55/55/556895555.db2.gz FMGNVFULCUFWJW-JCMHNJIXSA-N 0 2 426.472 4.549 40 10 IJCBLN Cc1cc(/C=C2\C(=O)NC(=O)N(c3ccc(F)cc3)C2=O)c(C)n1-c1c(C)cc(C)cc1C ZINC000408966041 556902818 /nfs/dbraw/zinc/90/28/18/556902818.db2.gz MNJSHKBIQXJKDN-LPYMAVHISA-N 0 2 445.494 4.825 40 10 IJCBLN COc1ccc2ccccc2c1/C=C1/C(=O)NC(=O)N(c2cccc(Cl)c2Cl)C1=O ZINC000409098085 556953743 /nfs/dbraw/zinc/95/37/43/556953743.db2.gz KBIAMOMGJWSDED-PTNGSMBKSA-N 0 2 441.270 4.822 40 10 IJCBLN CCOc1ccccc1N1C(=O)NC(=O)C(=Cc2ccc(O[C@@H](C)CC)c(Cl)c2)C1=O ZINC000409223406 557017758 /nfs/dbraw/zinc/01/77/58/557017758.db2.gz ZKNNOOKXZXQMEW-AOHITCTBSA-N 0 2 442.899 4.582 40 10 IJCBLN CCOc1ccccc1N1C(=O)NC(=O)C(=Cc2ccc(Sc3ccc(C)cc3)o2)C1=O ZINC000409232837 557024693 /nfs/dbraw/zinc/02/46/93/557024693.db2.gz SJQRGMFHXHYKOV-NBVRZTHBSA-N 0 2 448.500 4.804 40 10 IJCBLN Cc1ccc(N2C(=O)NC(=O)/C(=C\c3cc4c(cc3Cl)N(C)C(C)(C)C=C4C)C2=O)cc1 ZINC000208475548 557092599 /nfs/dbraw/zinc/09/25/99/557092599.db2.gz XUEAWMFCVMYJPI-YBFXNURJSA-N 0 2 449.938 4.947 40 10 IJCBLN CCN1c2cc(C)c(/C=C3\C(=O)NC(=O)N(c4ccc(C)cc4)C3=O)cc2C(C)=CC1(C)C ZINC000208524597 557093634 /nfs/dbraw/zinc/09/36/34/557093634.db2.gz YSGLXEAGXSQYDL-HYARGMPZSA-N 0 2 443.547 4.992 40 10 IJCBLN CC(C)N1c2ccc(/C=C3\C(=O)NC(=O)N(c4ccccc4F)C3=O)cc2[C@@H](C)CC1(C)C ZINC000223559214 557485919 /nfs/dbraw/zinc/48/59/19/557485919.db2.gz XVDYGHOIUIUNOZ-HUCUOGIVSA-N 0 2 449.526 4.993 40 10 IJCBLN CCOc1ccc(C=C2C(=O)NC(=O)N(c3ccc(Br)cc3C)C2=O)cc1 ZINC000033410855 557808058 /nfs/dbraw/zinc/80/80/58/557808058.db2.gz ARGMOFKUMPSPSZ-WJDWOHSUSA-N 0 2 429.270 4.663 40 10 IJCBLN CCN1c2ccc(/C=C3\C(=O)NC(=O)N(c4ccc(C)cc4)C3=O)cc2[C@H](C)CC1(C)C ZINC000208313308 569261227 /nfs/dbraw/zinc/26/12/27/569261227.db2.gz UPICNLQPJQLXAX-AQRZYSDFSA-N 0 2 431.536 4.774 40 10 IJCBLN CCc1ccc(-n2c(C)cc(/C=C3\C(=O)NC(=O)N(c4cc(C)cc(C)c4)C3=O)c2C)cc1 ZINC000408766676 556830027 /nfs/dbraw/zinc/83/00/27/556830027.db2.gz WMHNKVRYJLWDNM-BUVRLJJBSA-N 0 2 441.531 4.940 40 10 IJCBLN CCc1ccccc1-n1c(C)cc(/C=C2\C(=O)NC(=O)N(c3ccc(Cl)cc3)C2=O)c1C ZINC000408791064 556857194 /nfs/dbraw/zinc/85/71/94/556857194.db2.gz VMGOEJOWNVISNH-KGENOOAVSA-N 0 2 447.922 4.976 40 10 IJCBLN Cc1cccc(COc2ccccc2/C=C2\C(=O)NC(=O)N(c3cc(C)ccc3C)C2=O)c1 ZINC000408799881 556857872 /nfs/dbraw/zinc/85/78/72/556857872.db2.gz IYWOVSIZUFNKQH-PXLXIMEGSA-N 0 2 440.499 4.857 40 10 IJCBLN Cc1c(Cl)cccc1N1C(=O)NC(=O)C(=Cc2cc(Cl)ccc2OC(C)C)C1=O ZINC000408800139 556858129 /nfs/dbraw/zinc/85/81/29/556858129.db2.gz LAIYVDZMRLHZEB-XNTDXEJSSA-N 0 2 433.291 4.755 40 10 IJCBLN Cc1ccc(N2C(=O)NC(=O)C(=Cc3ccc(OCc4ccc(C)c(C)c4)cc3)C2=O)cc1 ZINC000408805187 556860464 /nfs/dbraw/zinc/86/04/64/556860464.db2.gz JIGMPEQMXLDHDZ-BUVRLJJBSA-N 0 2 440.499 4.857 40 10 IJCBLN O=C1NC(=O)N(c2ccc(C34CC5CC(CC(C5)C3)C4)cc2)C(=O)/C1=C/c1cccc(O)c1 ZINC000408855532 556871857 /nfs/dbraw/zinc/87/18/57/556871857.db2.gz GAAHICKGZJGXPT-FSJBWODESA-N 0 2 442.515 4.526 40 10 IJCBLN Cc1ccc(N2C(=O)NC(=O)C(=Cc3ccccc3Cc3cccc(F)c3)C2=O)cc1C ZINC000408877113 556876863 /nfs/dbraw/zinc/87/68/63/556876863.db2.gz SUYNXVVSPIWQDI-HZHRSRAPSA-N 0 2 428.463 4.700 40 10 IJCBLN COc1ccc(N2C(=O)NC(=O)C(=Cc3ccc(Cc4cc(C)cc(C)c4)cc3)C2=O)cc1 ZINC000408878178 556877172 /nfs/dbraw/zinc/87/71/72/556877172.db2.gz XMFISDUXFCJWJU-LFVJCYFKSA-N 0 2 440.499 4.569 40 10 IJCBLN Cc1ccc(N2C(=O)NC(=O)C(=Cc3ccc(OCc4ccccc4F)cc3)C2=O)c(C)c1 ZINC000408878684 556877471 /nfs/dbraw/zinc/87/74/71/556877471.db2.gz BIHKWYXGKDALDV-KGENOOAVSA-N 0 2 444.462 4.688 40 10 IJCBLN Cc1ccc(N2C(=O)NC(=O)C(=Cc3ccccc3OCc3cccc(F)c3)C2=O)c(C)c1 ZINC000408888627 556878732 /nfs/dbraw/zinc/87/87/32/556878732.db2.gz YATDMMSYGKWWRU-KGENOOAVSA-N 0 2 444.462 4.688 40 10 IJCBLN CCc1ccc(N2C(=O)NC(=O)C(=Cc3ccc4c(c3)C(C)=CC(C)(C)N4CC)C2=O)cc1 ZINC000208515076 557093254 /nfs/dbraw/zinc/09/32/54/557093254.db2.gz XKDNYRGRBARMJV-PXLXIMEGSA-N 0 2 443.547 4.937 40 10 IJCBLN O=C1NC(=O)N(c2ccncc2)C(=O)/C1=C/c1ccc(Sc2ccc(Cl)cc2)s1 ZINC000409393691 557097889 /nfs/dbraw/zinc/09/78/89/557097889.db2.gz RZNHPEVIOLVWCW-LFIBNONCSA-N 0 2 441.921 4.614 40 10 IJCBLN CCc1cccc(C)c1-n1c(C)cc(/C=C2\C(=O)NC(=O)N(c3ccccc3C)C2=O)c1C ZINC000014133130 557421823 /nfs/dbraw/zinc/42/18/23/557421823.db2.gz QRHZFLXVFCFCBX-PXLXIMEGSA-N 0 2 441.531 4.940 40 10 IJCBLN Cc1cc(C=C2C(=O)NC(=O)N(c3cc(C)cc(C)c3)C2=O)c(C)n1-c1ccc(F)cc1 ZINC000033930974 557810263 /nfs/dbraw/zinc/81/02/63/557810263.db2.gz IQUZPIFMYKCLME-LPYMAVHISA-N 0 2 431.467 4.721 40 10 IJCBLN CCCCCCOc1ccc(Cl)cc1/C=C1/C(=O)NC(=O)N(c2ccccc2)C1=O ZINC000408540210 555798760 /nfs/dbraw/zinc/79/87/60/555798760.db2.gz OQGYXLBOMZFRRU-CYVLTUHYSA-N 0 2 426.900 4.966 40 10 IJCBLN O=C1NC(=O)N(c2ccc([N+](=O)[O-])cc2)C(=O)C1=Cc1ccc(OCc2ccccc2)cc1 ZINC000016480330 556611344 /nfs/dbraw/zinc/61/13/44/556611344.db2.gz WNXLOHNYKSMDHN-STZFKDTASA-N 0 2 443.415 4.681 40 10 IJCBLN Cc1ccc(C2=C/C(=C\c3ccc([N+](=O)[O-])cc3)C(=O)N2c2cc([N+](=O)[O-])ccc2O)cc1 ZINC000408780922 556854472 /nfs/dbraw/zinc/85/44/72/556854472.db2.gz NJMRTXYJSUOYTA-LDADJPATSA-N 0 2 443.415 4.988 40 10 IJCBLN O=C1NC(=O)N(c2ccccc2)C(=O)/C1=C/c1ccc(OCc2ccccc2)c(Cl)c1 ZINC000408800133 556857945 /nfs/dbraw/zinc/85/79/45/556857945.db2.gz KWJIMBJNKGVYRX-CPNJWEJPSA-N 0 2 432.863 4.585 40 10 IJCBLN Cc1cccc(COc2ccc(/C=C3\C(=O)NC(=O)N(c4cccc(C)c4)C3=O)cc2)c1 ZINC000408800095 556858036 /nfs/dbraw/zinc/85/80/36/556858036.db2.gz KKIYMGBMIOPSNF-HZHRSRAPSA-N 0 2 426.472 4.549 40 10 IJCBLN CCCOc1ccc2ccccc2c1/C=C1\C(=O)NC(=O)N(c2ccc(Cl)cc2)C1=O ZINC000408800827 556858290 /nfs/dbraw/zinc/85/82/90/556858290.db2.gz PQFXCLPNXMVCTE-XSFVSMFZSA-N 0 2 434.879 4.948 40 10 IJCBLN COc1ccc(/C=C2\C(=O)NC(=O)N(c3ccc(C)c(C)c3)C2=O)cc1Cc1ccccc1 ZINC000408854711 556871704 /nfs/dbraw/zinc/87/17/04/556871704.db2.gz AKQCDDMKHBNSKM-XQNSMLJCSA-N 0 2 440.499 4.569 40 10 IJCBLN Cc1ccc(N2C(=O)NC(=O)C(=Cc3ccccc3Cc3ccccc3F)C2=O)c(C)c1 ZINC000408866731 556873660 /nfs/dbraw/zinc/87/36/60/556873660.db2.gz IFOCRGAMDXBMMP-RCCKNPSSSA-N 0 2 428.463 4.700 40 10 IJCBLN CCc1ccccc1N1C(=O)NC(=O)C(=Cc2ccc(OCc3cccc(C)c3)cc2)C1=O ZINC000408869609 556874478 /nfs/dbraw/zinc/87/44/78/556874478.db2.gz STOFKRKYVNAJDR-KQWNVCNZSA-N 0 2 440.499 4.803 40 10 IJCBLN CCc1ccccc1N1C(=O)NC(=O)C(=Cc2ccc(Cc3ccccc3F)cc2)C1=O ZINC000408884665 556877762 /nfs/dbraw/zinc/87/77/62/556877762.db2.gz YTUWUGJLLMSILC-PGMHBOJBSA-N 0 2 428.463 4.645 40 10 IJCBLN Cc1c(Cl)cccc1N1C(=O)NC(=O)C(=Cc2cccc(OCc3ccccc3)c2)C1=O ZINC000408935569 556895599 /nfs/dbraw/zinc/89/55/99/556895599.db2.gz HYGKZHDNQRHYLM-ZHZULCJRSA-N 0 2 446.890 4.894 40 10 IJCBLN Cc1ccc(N2C(=O)NC(=O)C(=Cc3cccc(OCc4ccccc4)c3)C2=O)c(C)c1 ZINC000408938683 556897473 /nfs/dbraw/zinc/89/74/73/556897473.db2.gz RDAIFJGOVQWOQD-JCMHNJIXSA-N 0 2 426.472 4.549 40 10 IJCBLN CCc1ccc(N2C(=O)NC(=O)C(=Cc3cc(C)n(-c4ccc(C)cc4C)c3C)C2=O)cc1 ZINC000408989630 556910880 /nfs/dbraw/zinc/91/08/80/556910880.db2.gz UOXGMDVQEBMNAZ-HAHDFKILSA-N 0 2 441.531 4.940 40 10 IJCBLN CCCOc1c(Cl)cc(Cl)cc1/C=C1\C(=O)NC(=O)N(c2ccc(F)cc2)C1=O ZINC000409058834 556935898 /nfs/dbraw/zinc/93/58/98/556935898.db2.gz UAFMYUMUAPDIBC-OQLLNIDSSA-N 0 2 437.254 4.588 40 10 IJCBLN CCOc1ccccc1N1C(=O)NC(=O)C(=Cc2c(OC(C)C)ccc3ccccc32)C1=O ZINC000409241973 557032263 /nfs/dbraw/zinc/03/22/63/557032263.db2.gz TUUGOUZTZNGTDI-HMMYKYKNSA-N 0 2 444.487 4.692 40 10 IJCBLN CC[C@@H](C)Oc1ccc(/C=C2\C(=O)NC(=O)N(c3cccc(Cl)c3C)C2=O)cc1OC ZINC000409243266 557033181 /nfs/dbraw/zinc/03/31/81/557033181.db2.gz RJOYLUGHLZCRII-KWWJGWKXSA-N 0 2 442.899 4.501 40 10 IJCBLN CC1=CC(C)(C)N(C)c2cc(Cl)c(/C=C3\C(=O)NC(=O)N(c4ccccc4)C3=O)cc21 ZINC000208475504 557092556 /nfs/dbraw/zinc/09/25/56/557092556.db2.gz TWJQQEOGAQEIFY-WOJGMQOQSA-N 0 2 435.911 4.638 40 10 IJCBLN CCN1c2cc(C)c(/C=C3\C(=O)NC(=O)N(c4cccc(F)c4)C3=O)cc2C(C)=CC1(C)C ZINC000208517470 557093682 /nfs/dbraw/zinc/09/36/82/557093682.db2.gz OUUDKUJFLFRCLK-CIAFOILYSA-N 0 2 447.510 4.822 40 10 IJCBLN CCOc1ccc(C=C2C(=O)NC(=O)N(c3ccc(Br)c(C)c3)C2=O)cc1 ZINC000059862142 557827837 /nfs/dbraw/zinc/82/78/37/557827837.db2.gz YNWJXFOPAVYWDY-LFIBNONCSA-N 0 2 429.270 4.663 40 10 IJCBLN CC(C)(C)Oc1c(Cl)cc(/C=C2/C(=O)NN(c3ccccc3)C2=O)cc1Br ZINC000108116592 569260814 /nfs/dbraw/zinc/26/08/14/569260814.db2.gz PATVVGDCAUOVEC-ZROIWOOFSA-N 0 2 449.732 4.741 40 10 IJCBLN Cc1ccc(COc2ccccc2/C=C2/C(=O)NC(=O)N(c3ccc(Cl)cc3)C2=O)cc1 ZINC000009323170 132313684 /nfs/dbraw/zinc/31/36/84/132313684.db2.gz KFWPNBSSUKYBMV-STZFKDTASA-N 0 2 446.890 4.894 40 10 IJCBLN CCc1ccc(N2C(=O)NC(=O)C(=Cc3ccc(-c4ccc(C(=O)OC)cc4)o3)C2=O)cc1 ZINC000033331094 523963398 /nfs/dbraw/zinc/96/33/98/523963398.db2.gz CRGDQYFPEVEGJK-ZHZULCJRSA-N 0 2 444.443 4.802 40 10 IJCBLN CCc1ccccc1N1C(=O)NC(=O)C(=Cc2cc(C)n(-c3cccc(C)c3)c2C)C1=O ZINC000408753762 556234645 /nfs/dbraw/zinc/23/46/45/556234645.db2.gz HVXAUSDSBMXUMZ-PXLXIMEGSA-N 0 2 427.504 4.631 40 10 IJCBLN Cc1cc(C=C2C(=O)NC(=O)N(c3ccc(C)cc3)C2=O)c(C)n1-c1cccc(C)c1C ZINC000408766623 556830023 /nfs/dbraw/zinc/83/00/23/556830023.db2.gz DNPGTOWKPRYELA-HYARGMPZSA-N 0 2 427.504 4.686 40 10 IJCBLN Cc1ccc(N2C(=O)NC(=O)C(=Cc3ccccc3OCc3ccc(Cl)cc3)C2=O)cc1 ZINC000408772761 556847896 /nfs/dbraw/zinc/84/78/96/556847896.db2.gz MYJCEMVGQQWNDE-KGENOOAVSA-N 0 2 446.890 4.894 40 10 IJCBLN Cc1ccc(N2C(=O)NC(=O)C(=Cc3ccccc3OCc3ccccc3)C2=O)cc1C ZINC000408798012 556857592 /nfs/dbraw/zinc/85/75/92/556857592.db2.gz DJYAJHLNKCUEPL-PXLXIMEGSA-N 0 2 426.472 4.549 40 10 IJCBLN Cc1ccc(N2C(=O)NC(=O)C(=Cc3ccc(OCc4ccc(F)cc4)cc3)C2=O)c(C)c1 ZINC000408803417 556859653 /nfs/dbraw/zinc/85/96/53/556859653.db2.gz OQOXBFNHRMEOGY-HYARGMPZSA-N 0 2 444.462 4.688 40 10 IJCBLN CCOc1ccc2ccccc2c1/C=C1\C(=O)NC(=O)N(c2cccc(Cl)c2C)C1=O ZINC000408804775 556860397 /nfs/dbraw/zinc/86/03/97/556860397.db2.gz ZJPOIISIXJLJKS-QGOAFFKASA-N 0 2 434.879 4.867 40 10 IJCBLN CC(C)Oc1ccc2ccccc2c1/C=C1\C(=O)NC(=O)N(c2ccccc2Cl)C1=O ZINC000408818596 556864469 /nfs/dbraw/zinc/86/44/69/556864469.db2.gz XKUJAMDVNNZCBQ-QGOAFFKASA-N 0 2 434.879 4.947 40 10 IJCBLN O=C1NC(=O)N(c2ccc(OCc3ccccc3)cc2)C(=O)/C1=C/c1cccc(Cl)c1 ZINC000408866570 556873582 /nfs/dbraw/zinc/87/35/82/556873582.db2.gz HEWKYJDLQJBZQY-KGENOOAVSA-N 0 2 432.863 4.585 40 10 IJCBLN CCc1ccccc1N1C(=O)NC(=O)C(=Cc2ccccc2OCc2ccc(F)cc2)C1=O ZINC000408869603 556874418 /nfs/dbraw/zinc/87/44/18/556874418.db2.gz QCLXWXFOFVYNKL-QNGOZBTKSA-N 0 2 444.462 4.634 40 10 IJCBLN CCc1cccc(C)c1-n1c(C)cc(/C=C2\C(=O)NC(=O)N(c3ccc(F)cc3)C2=O)c1C ZINC000408901972 556883149 /nfs/dbraw/zinc/88/31/49/556883149.db2.gz DBQKCTJJHSGVNI-HYARGMPZSA-N 0 2 445.494 4.770 40 10 IJCBLN CCc1ccccc1N1C(=O)NC(=O)C(=Cc2ccc(O[C@@H](C)CC)c(Cl)c2)C1=O ZINC000409009899 556917779 /nfs/dbraw/zinc/91/77/79/556917779.db2.gz CIPVMXSJPLCBLA-IQGJIOQQSA-N 0 2 426.900 4.746 40 10 IJCBLN CCOc1c(Cl)cc(/C=C2\C(=O)NC(=O)N(c3cccc(Cl)c3)C2=O)cc1Cl ZINC000409044545 556930101 /nfs/dbraw/zinc/93/01/01/556930101.db2.gz VVQAQLOCKPNLKS-AWNIVKPZSA-N 0 2 439.682 4.712 40 10 IJCBLN CCOc1c(Cl)cc(Cl)cc1/C=C1\C(=O)NC(=O)N(c2ccc(C)c(C)c2)C1=O ZINC000409057022 556934421 /nfs/dbraw/zinc/93/44/21/556934421.db2.gz OKVNAEYYPVVVQR-CXUHLZMHSA-N 0 2 433.291 4.675 40 10 IJCBLN O=C1NC(=O)N(c2cccc(Cl)c2Cl)C(=O)/C1=C/c1ccc(N2CCCCCC2)o1 ZINC000409069103 556942794 /nfs/dbraw/zinc/94/27/94/556942794.db2.gz UXPBZYAGZIZRDM-WYMLVPIESA-N 0 2 448.306 4.633 40 10 IJCBLN Cc1cc(/C=C2\C(=O)NC(=O)N(c3cccc(Cl)c3Cl)C2=O)c(C)n1C(C)(C)C ZINC000409107567 556959315 /nfs/dbraw/zinc/95/93/15/556959315.db2.gz RXXYYWWJHUWDKC-GXDHUFHOSA-N 0 2 434.323 4.833 40 10 IJCBLN CC[C@H](C)Oc1c(/C=C2\C(=O)NC(=O)N(c3cccc(Cl)c3C)C2=O)cccc1OC ZINC000409230624 557022338 /nfs/dbraw/zinc/02/23/38/557022338.db2.gz DNLOHTQZXNNRGV-HKJJFUAXSA-N 0 2 442.899 4.501 40 10 IJCBLN CCOc1ccccc1N1C(=O)NC(=O)/C(=C\c2cc(C(C)C)c(OCC)cc2C)C1=O ZINC000409246475 557027955 /nfs/dbraw/zinc/02/79/55/557027955.db2.gz BTMNZFVSJKSJNX-XMHGGMMESA-N 0 2 436.508 4.582 40 10 IJCBLN Cc1cccc(N2C(=O)NC(=O)/C(=C\c3cc4c(cc3C)N(C)C(C)(C)C=C4C)C2=O)c1C ZINC000208464410 557089730 /nfs/dbraw/zinc/08/97/30/557089730.db2.gz JSZSBGYSMXKDBC-FYJGNVAPSA-N 0 2 443.547 4.910 40 10 IJCBLN CC(C)N1c2ccc(/C=C3\C(=O)NC(=O)N(c4cccc(F)c4)C3=O)cc2[C@H](C)CC1(C)C ZINC000260565265 557285586 /nfs/dbraw/zinc/28/55/86/557285586.db2.gz HQMGEGRIVXLBAY-SVZNOHIVSA-N 0 2 449.526 4.993 40 10 IJCBLN CN(C)c1ccc([C@H]2CC(c3c(O)c4ccccc4n(C)c3=O)=Nc3ccccc3N2)cc1 ZINC000104827573 557328773 /nfs/dbraw/zinc/32/87/73/557328773.db2.gz HEVQNYARMKVDIC-JOCHJYFZSA-N 0 2 438.531 4.988 40 10 IJCBLN COC(=O)c1ccc(NC(C)=C2C(=O)N(c3ccc(OC)cc3)N=C2c2ccccc2)cc1 ZINC000019633710 557502317 /nfs/dbraw/zinc/50/23/17/557502317.db2.gz BCRFXQXBVATUQW-QJOMJCCJSA-N 0 2 441.487 4.619 40 10 IJCBLN COC(=O)c1ccc(N=C(C)c2c(-c3ccccc3)[nH]n(-c3ccc(OC)cc3)c2=O)cc1 ZINC000019633710 557502319 /nfs/dbraw/zinc/50/23/19/557502319.db2.gz BCRFXQXBVATUQW-QJOMJCCJSA-N 0 2 441.487 4.619 40 10 IJCBLN CCOc1ccc(Br)cc1C=C1C(=O)NC(=O)N(c2ccccc2C)C1=O ZINC000059860518 557827919 /nfs/dbraw/zinc/82/79/19/557827919.db2.gz KKCDXGDXDZYJFZ-RVDMUPIBSA-N 0 2 429.270 4.663 40 10 IJCBLN CCc1ccc(N2C(=O)NC(=O)C(=Cc3cc(Br)ccc3OC)C2=O)cc1 ZINC000017086541 523962901 /nfs/dbraw/zinc/96/29/01/523962901.db2.gz FYEUEDAXRHOCNU-WJDWOHSUSA-N 0 2 429.270 4.527 40 10 IJCBLN Cc1ccc(OCCn2cccc2C=C2C(=O)NC(=O)N(c3ccc(F)cc3)C2=O)c(C)c1 ZINC000041108870 525426983 /nfs/dbraw/zinc/42/69/83/525426983.db2.gz YXURTZQUGKHMLK-QNGOZBTKSA-N 0 2 447.466 4.830 40 10 IJCBLN Cc1ccc(N2C(=O)NC(=O)C(=Cc3cc(Cl)cc(Br)c3O)C2=O)cc1 ZINC000083318105 556663707 /nfs/dbraw/zinc/66/37/07/556663707.db2.gz PZOIZTYMWLYMDX-NTUHNPAUSA-N 0 2 435.661 4.623 40 10 IJCBLN Cc1cc(C)cc(N2C(=O)NC(=O)C(=Cc3ccccc3OCc3cccc(F)c3)C2=O)c1 ZINC000408782007 556854696 /nfs/dbraw/zinc/85/46/96/556854696.db2.gz FHVRGPYRWDZIDI-HYARGMPZSA-N 0 2 444.462 4.688 40 10 IJCBLN Cc1cc(C)cc(N2C(=O)NC(=O)C(=Cc3ccccc3OCc3ccc(F)cc3)C2=O)c1 ZINC000408786456 556856395 /nfs/dbraw/zinc/85/63/95/556856395.db2.gz QDYPBIGEXVCDHD-HYARGMPZSA-N 0 2 444.462 4.688 40 10 IJCBLN CCOc1ccc2ccc(OCC)c(/C=C3\C(=O)NC(=O)N(c4ccccc4C)C3=O)c2c1 ZINC000408791178 556857100 /nfs/dbraw/zinc/85/71/00/556857100.db2.gz VTZDNMJXEWVZBI-RCCKNPSSSA-N 0 2 444.487 4.612 40 10 IJCBLN Cc1cccc(N2C(=O)NC(=O)C(=Cc3ccc(OCc4ccc(Cl)cc4)cc3)C2=O)c1 ZINC000408797904 556857582 /nfs/dbraw/zinc/85/75/82/556857582.db2.gz CZOIHLOLTHUTRJ-HYARGMPZSA-N 0 2 446.890 4.894 40 10 IJCBLN CC(C)Oc1ccc2ccccc2c1/C=C1\C(=O)NC(=O)N(c2ccc(Cl)cc2)C1=O ZINC000408802642 556859431 /nfs/dbraw/zinc/85/94/31/556859431.db2.gz ZSCICSCQFMQXKN-DEDYPNTBSA-N 0 2 434.879 4.947 40 10 IJCBLN Cc1cccc(COc2ccccc2/C=C2\C(=O)NC(=O)N(c3cccc(Cl)c3)C2=O)c1 ZINC000408805428 556860829 /nfs/dbraw/zinc/86/08/29/556860829.db2.gz AZMSZRLTXPLCOS-FYJGNVAPSA-N 0 2 446.890 4.894 40 10 IJCBLN Cc1cccc(N2C(=O)NC(=O)C(=Cc3ccccc3Cc3ccccc3F)C2=O)c1C ZINC000408880487 556876357 /nfs/dbraw/zinc/87/63/57/556876357.db2.gz JGZYEOMEXCIJNO-RCCKNPSSSA-N 0 2 428.463 4.700 40 10 IJCBLN Cc1cccc(N2C(=O)NC(=O)C(=Cc3ccc(OCc4cccc(F)c4)cc3)C2=O)c1C ZINC000408890637 556879172 /nfs/dbraw/zinc/87/91/72/556879172.db2.gz WWGXTECKRREUBT-HYARGMPZSA-N 0 2 444.462 4.688 40 10 IJCBLN CCCOc1ccc(N2C(=O)NC(=O)C(=Cc3c(OCC)ccc4ccccc43)C2=O)cc1 ZINC000408899281 556881957 /nfs/dbraw/zinc/88/19/57/556881957.db2.gz NXTFNNBJGGLLNN-JWGURIENSA-N 0 2 444.487 4.694 40 10 IJCBLN CCc1ccccc1N1C(=O)NC(=O)C(=Cc2cccn2-c2ccc(C)c(Cl)c2)C1=O ZINC000409010124 556917688 /nfs/dbraw/zinc/91/76/88/556917688.db2.gz JQBBNQGISHCWOM-CPNJWEJPSA-N 0 2 433.895 4.668 40 10 IJCBLN CC[C@H](C)Oc1ccc(/C=C2\C(=O)NC(=O)N(c3cccc(Cl)c3C)C2=O)cc1OC ZINC000409243267 557033189 /nfs/dbraw/zinc/03/31/89/557033189.db2.gz RJOYLUGHLZCRII-XDUBLRSXSA-N 0 2 442.899 4.501 40 10 IJCBLN Cc1cc2c(cc1/C=C1\C(=O)NC(=O)N(c3ccccc3C)C1=O)C(C)=CC(C)(C)N2C ZINC000208453631 557087907 /nfs/dbraw/zinc/08/79/07/557087907.db2.gz AVECILFRKKNOFD-DEDYPNTBSA-N 0 2 429.520 4.602 40 10 IJCBLN O=C1NC(=O)N(c2ccncc2)C(=O)/C1=C\c1ccccc1Sc1ccc(Cl)cc1 ZINC000409395498 557102733 /nfs/dbraw/zinc/10/27/33/557102733.db2.gz OHZFSWUCPDNOQT-AQTBWJFISA-N 0 2 435.892 4.553 40 10 IJCBLN COc1ccc(-c2[nH]n(-c3ccc(OC)cc3)c(=O)c2C(C)=Nc2cccc(C)n2)cc1 ZINC000103921409 557140954 /nfs/dbraw/zinc/14/09/54/557140954.db2.gz GLJARODJKXGCKB-QJOMJCCJSA-N 0 2 428.492 4.544 40 10 IJCBLN COc1ccc(-c2[nH]n(-c3ccc(OC)cc3)c(=O)c2C(C)=Nc2ncccc2C)cc1 ZINC000103922137 557141389 /nfs/dbraw/zinc/14/13/89/557141389.db2.gz JURGMQMXWFYSBV-XLNRJJMWSA-N 0 2 428.492 4.544 40 10 IJCBLN Cc1ccccc1N1C(=O)NC(=O)C(=Cc2ccc(OCc3ccccc3Cl)cc2)C1=O ZINC000014132792 557421620 /nfs/dbraw/zinc/42/16/20/557421620.db2.gz PZMGOGGWIWLRID-XSFVSMFZSA-N 0 2 446.890 4.894 40 10 IJCBLN COC(=O)c1cccc(-c2ccc(C=C3C(=O)NC(=O)N(c4ccc(F)cc4)C3=O)o2)c1C ZINC000059135396 557815296 /nfs/dbraw/zinc/81/52/96/557815296.db2.gz OXUFTPLTKBFCNM-XDHOZWIPSA-N 0 2 448.406 4.687 40 10 IJCBLN CC1=NN(c2ccccc2)C(=O)/C1=C/c1cc(Br)c(O)c(Br)c1 ZINC000224116245 569182318 /nfs/dbraw/zinc/18/23/18/569182318.db2.gz XRARJIXPGCZMQF-NTUHNPAUSA-N 0 2 436.103 4.723 40 10 IJCBLN Cc1cc(/C=C2/C(=O)NC(=O)N(c3ccc(Cl)cc3)C2=O)c(C)n1C1CCCCC1 ZINC000009323174 132313705 /nfs/dbraw/zinc/31/37/05/132313705.db2.gz ULYZTAUQONSNIY-MOSHPQCFSA-N 0 2 425.916 4.930 40 10 IJCBLN CCc1ccc(N2C(=O)NC(=O)C(=Cc3cc(C)n(-c4ccc(C)cc4)c3C)C2=O)cc1 ZINC000002226659 536184421 /nfs/dbraw/zinc/18/44/21/536184421.db2.gz DFCHLBOJKGJLRH-HZHRSRAPSA-N 0 2 427.504 4.631 40 10 IJCBLN CCOc1c(Cl)cc(/C=C2\C(=O)NC(=O)N(c3ccc(Cl)cc3)C2=O)cc1Cl ZINC000408787892 556856818 /nfs/dbraw/zinc/85/68/18/556856818.db2.gz ANXIOKXTYCAOFV-NTUHNPAUSA-N 0 2 439.682 4.712 40 10 IJCBLN Cc1c(Cl)cccc1N1C(=O)NC(=O)C(=Cc2ccccc2OCc2ccccc2)C1=O ZINC000408801899 556858841 /nfs/dbraw/zinc/85/88/41/556858841.db2.gz WPZUJJLTEWSMMD-XMHGGMMESA-N 0 2 446.890 4.894 40 10 IJCBLN CCCOc1ccc(/C=C2\C(=O)NC(=O)N(c3cccc(Cl)c3C)C2=O)cc1OCC ZINC000408802918 556859774 /nfs/dbraw/zinc/85/97/74/556859774.db2.gz JEPCBULEXJEJPS-FOWTUZBSSA-N 0 2 442.899 4.502 40 10 IJCBLN Cc1cccc(N2C(=O)NC(=O)C(=Cc3c(OC(C)C)ccc4ccccc43)C2=O)c1C ZINC000408804550 556860267 /nfs/dbraw/zinc/86/02/67/556860267.db2.gz YIFWRJALYPUSPH-KGENOOAVSA-N 0 2 428.488 4.910 40 10 IJCBLN Cc1ccc(Cl)cc1N1C(=O)NC(=O)C(=Cc2ccc(OC(C)C)c(Cl)c2)C1=O ZINC000408819530 556864192 /nfs/dbraw/zinc/86/41/92/556864192.db2.gz ZFZLFEBYZKBLCN-OVCLIPMQSA-N 0 2 433.291 4.755 40 10 IJCBLN CCCOc1ccc(Cl)cc1/C=C1\C(=O)NC(=O)N(c2cc(Cl)ccc2C)C1=O ZINC000408813495 556865017 /nfs/dbraw/zinc/86/50/17/556865017.db2.gz OCOUSKMUEGCJMT-MHWRWJLKSA-N 0 2 433.291 4.757 40 10 IJCBLN Cc1cc(/C=C2\C(=O)NC(=O)N(c3ccc(C)c(C)c3)C2=O)c(C)n1-c1cc(C)ccc1C ZINC000408849990 556870691 /nfs/dbraw/zinc/87/06/91/556870691.db2.gz CLIBSXNGFIGTHY-OEAKJJBVSA-N 0 2 441.531 4.994 40 10 IJCBLN O=C1NC(=O)N(c2cccc(Cl)c2)C(=O)/C1=C\c1ccccc1Cc1ccccc1F ZINC000408865192 556873365 /nfs/dbraw/zinc/87/33/65/556873365.db2.gz BSKLFGWBUCNWMK-DEDYPNTBSA-N 0 2 434.854 4.736 40 10 IJCBLN CCc1ccccc1N1C(=O)NC(=O)C(=Cc2ccc(OCc3cccc(F)c3)cc2)C1=O ZINC000408894655 556880324 /nfs/dbraw/zinc/88/03/24/556880324.db2.gz KBWFGJXVGCOJAB-JCMHNJIXSA-N 0 2 444.462 4.634 40 10 IJCBLN CCn1c2ccccc2c2cc(/C=C3\C(=O)NC(=O)N(c4cccc(F)c4)C3=O)ccc21 ZINC000408911639 556888497 /nfs/dbraw/zinc/88/84/97/556888497.db2.gz AORUYVRQJALQBM-DEDYPNTBSA-N 0 2 427.435 4.620 40 10 IJCBLN Cc1cccc(N2C(=O)NC(=O)C(=Cc3cccc(OCc4ccccc4)c3)C2=O)c1C ZINC000408940911 556896644 /nfs/dbraw/zinc/89/66/44/556896644.db2.gz VPAUGOGIACYPDE-JCMHNJIXSA-N 0 2 426.472 4.549 40 10 IJCBLN CCc1ccc(N2C(=O)NC(=O)C(=Cc3ccccc3OCc3cccc(F)c3)C2=O)cc1 ZINC000408990845 556911392 /nfs/dbraw/zinc/91/13/92/556911392.db2.gz OMZRMGUAWMHUKG-JCMHNJIXSA-N 0 2 444.462 4.634 40 10 IJCBLN CCCOc1ccc(N2C(=O)NC(=O)C(=Cc3cccc4ccccc34)C2=O)cc1OCC ZINC000409208746 556997715 /nfs/dbraw/zinc/99/77/15/556997715.db2.gz BWOQWYBLVVHRHV-RCCKNPSSSA-N 0 2 444.487 4.694 40 10 IJCBLN O=C1NC(=O)N(c2ccccc2)C(=O)/C1=C/c1ccc(-c2ccccc2C(F)(F)F)o1 ZINC000409216641 557011637 /nfs/dbraw/zinc/01/16/37/557011637.db2.gz MZEAQEIJKLVOOT-FOWTUZBSSA-N 0 2 426.350 4.632 40 10 IJCBLN Cc1ccc(Sc2ccc(/C=C3\C(=O)NC(=O)N(c4ccccc4F)C3=O)cc2)cc1 ZINC000409223916 557017966 /nfs/dbraw/zinc/01/79/66/557017966.db2.gz GQDGGZLMIVPBNU-XMHGGMMESA-N 0 2 432.476 4.952 40 10 IJCBLN Cc1c(Cl)cccc1N1C(=O)NC(=O)C(=Cc2cccn2-c2ccc(Cl)cc2)C1=O ZINC000409235803 557018041 /nfs/dbraw/zinc/01/80/41/557018041.db2.gz BRXUDRLWRDGDHI-SFQUDFHCSA-N 0 2 440.286 4.759 40 10 IJCBLN O=C1NC(=O)N(c2cccnc2)C(=O)/C1=C/c1ccc(Sc2ccc(Cl)cc2)s1 ZINC000409234983 557025735 /nfs/dbraw/zinc/02/57/35/557025735.db2.gz ACUPKAFIAQYGQJ-MHWRWJLKSA-N 0 2 441.921 4.614 40 10 IJCBLN CCc1ccc(N2C(=O)NC(=O)C(=Cc3ccc4c(c3)C(C)=CC(C)(C)N4C)C2=O)cc1 ZINC000208447552 557087436 /nfs/dbraw/zinc/08/74/36/557087436.db2.gz XMFQGVCCEXUFMH-KGENOOAVSA-N 0 2 429.520 4.547 40 10 IJCBLN CCc1ccc(N2C(=O)NC(=O)C(=Cc3cc4c(cc3C)N(C)C(C)(C)C=C4C)C2=O)cc1 ZINC000208454780 557088361 /nfs/dbraw/zinc/08/83/61/557088361.db2.gz PSGXBTIKOLAOSW-HYARGMPZSA-N 0 2 443.547 4.856 40 10 IJCBLN CCN1c2ccc(/C=C3\C(=O)NC(=O)N(c4ccccc4F)C3=O)cc2[C@@H](C)CC1(C)C ZINC000223536866 557483114 /nfs/dbraw/zinc/48/31/14/557483114.db2.gz VRYFWYNDBIYMIJ-VUODPORTSA-N 0 2 435.499 4.604 40 10 IJCBLN O=C1NC(=O)N(c2ccc(Br)cc2)C(=O)/C1=C\c1ccc(-c2ccccc2)cc1 ZINC000009323156 132313733 /nfs/dbraw/zinc/31/37/33/132313733.db2.gz LXFVMACKSLLPDY-ZHZULCJRSA-N 0 2 447.288 4.783 40 10 IJCBLN Cc1ccc(Sc2ccc(/C=C3\C(=O)NN(c4ccccc4)C3=O)cc2[N+](=O)[O-])cc1 ZINC000032124972 556534075 /nfs/dbraw/zinc/53/40/75/556534075.db2.gz UULQBLOMWPJXBS-CPNJWEJPSA-N 0 2 431.473 4.516 40 10 IJCBLN CCc1ccc(-n2c(C)cc(/C=C3\C(=O)NC(=O)N(c4ccccc4CC)C3=O)c2C)cc1 ZINC000408758447 556679308 /nfs/dbraw/zinc/67/93/08/556679308.db2.gz KBMJBRPJHOKGAZ-XQNSMLJCSA-N 0 2 441.531 4.885 40 10 IJCBLN Cc1cc(C=C2C(=O)NC(=O)N(c3ccc(C)cc3)C2=O)c(C)n1-c1ccccc1Cl ZINC000408778334 556853852 /nfs/dbraw/zinc/85/38/52/556853852.db2.gz DTTSNDJNIPGIGM-CPNJWEJPSA-N 0 2 433.895 4.722 40 10 IJCBLN Cc1cc(C=C2C(=O)NC(=O)N(c3ccc(C)cc3)C2=O)c(C)n1-c1cc(C)ccc1C ZINC000408780490 556854586 /nfs/dbraw/zinc/85/45/86/556854586.db2.gz CKRYWAOJMLPNPM-HYARGMPZSA-N 0 2 427.504 4.686 40 10 IJCBLN CCCOc1c(Cl)cc(/C=C2\C(=O)NC(=O)N(c3cccc(C)c3)C2=O)cc1OCC ZINC000408800932 556858283 /nfs/dbraw/zinc/85/82/83/556858283.db2.gz QFOZTNLLAFPKPB-GZTJUZNOSA-N 0 2 442.899 4.502 40 10 IJCBLN Cc1ccc(COc2ccc(/C=C3\C(=O)NC(=O)N(c4ccccc4)C3=O)cc2)cc1C ZINC000408801007 556858535 /nfs/dbraw/zinc/85/85/35/556858535.db2.gz RBIDSUNJECQOAO-HZHRSRAPSA-N 0 2 426.472 4.549 40 10 IJCBLN Cc1ccc(N2C(=O)NC(=O)C(=Cc3ccccc3OCc3cc(C)cc(C)c3)C2=O)cc1 ZINC000408881358 556878283 /nfs/dbraw/zinc/87/82/83/556878283.db2.gz KUIJPUHQDLNHMD-HZHRSRAPSA-N 0 2 440.499 4.857 40 10 IJCBLN CC[C@@H](C)Oc1ccc2ccccc2c1/C=C1\C(=O)NC(=O)N(c2ccc(C)cc2)C1=O ZINC000408901521 556882920 /nfs/dbraw/zinc/88/29/20/556882920.db2.gz YLKYXKDMPPUBBF-HRKXOBMBSA-N 0 2 428.488 4.992 40 10 IJCBLN O=C1NC(=O)N(c2cccc(F)c2)C(=O)/C1=C/c1ccc(Sc2ccc(Cl)cc2)o1 ZINC000408913628 556889401 /nfs/dbraw/zinc/88/94/01/556889401.db2.gz MNYHVDFZXLWTBC-GZTJUZNOSA-N 0 2 442.855 4.890 40 10 IJCBLN Cc1ccc(COc2cccc(/C=C3/C(=O)NC(=O)N(c4ccc(C)cc4)C3=O)c2)cc1 ZINC000408935135 556895516 /nfs/dbraw/zinc/89/55/16/556895516.db2.gz GXUVAPQNZGZIBY-HAHDFKILSA-N 0 2 426.472 4.549 40 10 IJCBLN Cc1ccc(COc2cccc(/C=C3/C(=O)NC(=O)N(c4ccc(C)cc4C)C3=O)c2)cc1 ZINC000408941645 556896991 /nfs/dbraw/zinc/89/69/91/556896991.db2.gz XMYKUMSUFQGUCW-HAHDFKILSA-N 0 2 440.499 4.857 40 10 IJCBLN Cc1cc(C)cc(N2C(=O)NC(=O)C(=Cc3ccc4c(c3)[C@H](C)CC(C)(C)N4C)C2=O)c1 ZINC000208197762 557079501 /nfs/dbraw/zinc/07/95/01/557079501.db2.gz NGAYIVIEYJPCGX-VYVDHXHBSA-N 0 2 431.536 4.692 40 10 IJCBLN Cc1ccc(N2C(=O)NC(=O)/C(=C\c3ccc4c(c3)C(C)=CC(C)(C)N4C)C2=O)cc1C ZINC000208447032 557087645 /nfs/dbraw/zinc/08/76/45/557087645.db2.gz ALMOULWXUAJMTM-FYJGNVAPSA-N 0 2 429.520 4.602 40 10 IJCBLN CC[C@H](C)Oc1c(Cl)cc(/C=C2\C(=O)NC(=O)N(c3ccccc3C)C2=O)cc1OC ZINC000014133166 557421884 /nfs/dbraw/zinc/42/18/84/557421884.db2.gz KJIPFLPKHJPURM-KNGSKEOJSA-N 0 2 442.899 4.501 40 10 IJCBLN CCN1c2ccc(/C=C3\C(=O)NC(=O)N(c4cccc(F)c4)C3=O)cc2[C@@H](C)CC1(C)C ZINC000223536933 557483068 /nfs/dbraw/zinc/48/30/68/557483068.db2.gz GYNXPGDRRCGGLQ-SLDJAQPHSA-N 0 2 435.499 4.604 40 10 IJCBLN Cc1cc2c(cc1/C=C1\C(=O)NC(=O)N(c3ccccc3C)C1=O)[C@H](C)CC(C)(C)N2C ZINC000223570898 557487431 /nfs/dbraw/zinc/48/74/31/557487431.db2.gz AWIQGKVNJAPGDF-UOBPLZBXSA-N 0 2 431.536 4.692 40 10 IJCBLN COC(=O)c1ccc(C)c(-c2ccc(C=C3C(=O)NC(=O)N(c4ccc(F)cc4)C3=O)o2)c1 ZINC000059135411 557815384 /nfs/dbraw/zinc/81/53/84/557815384.db2.gz MYGVFKVJXMEMHU-XDHOZWIPSA-N 0 2 448.406 4.687 40 10 IJCBLN Cc1cc(C=C2C(=O)NC(=O)N(c3cccc(C)c3)C2=O)c(C)n1-c1cc(C)cc(C)c1 ZINC000009310863 556279227 /nfs/dbraw/zinc/27/92/27/556279227.db2.gz JMDGRIKMFRFJJO-UCQKPKSFSA-N 0 2 427.504 4.686 40 10 IJCBLN Cc1ccc(N2C(=O)NC(=O)C(=Cc3ccccc3OCc3ccccc3Cl)C2=O)cc1 ZINC000408777327 556848760 /nfs/dbraw/zinc/84/87/60/556848760.db2.gz YOQOFFOXYYHFEL-XSFVSMFZSA-N 0 2 446.890 4.894 40 10 IJCBLN Cc1ccc(N2C(=O)NC(=O)C(=Cc3ccc(OCc4cccc(C)c4)cc3)C2=O)cc1 ZINC000408786805 556856407 /nfs/dbraw/zinc/85/64/07/556856407.db2.gz WFEBICJANTWJCZ-HZHRSRAPSA-N 0 2 426.472 4.549 40 10 IJCBLN Cc1ccc(COc2ccc(/C=C3\C(=O)NC(=O)N(c4ccccc4)C3=O)cc2Cl)cc1 ZINC000408797017 556857291 /nfs/dbraw/zinc/85/72/91/556857291.db2.gz FLQGIDBAMTXUFC-DEDYPNTBSA-N 0 2 446.890 4.894 40 10 IJCBLN Cc1ccc(N2C(=O)NC(=O)C(=Cc3cc(Cl)ccc3OC(C)C)C2=O)cc1Cl ZINC000408804184 556860313 /nfs/dbraw/zinc/86/03/13/556860313.db2.gz CXBJZVCJCBVVLY-CXUHLZMHSA-N 0 2 433.291 4.755 40 10 IJCBLN CCOc1cc(/C=C2\C(=O)NC(=O)N(c3ccc(C)c(Cl)c3)C2=O)ccc1OC(C)C ZINC000408807632 556861317 /nfs/dbraw/zinc/86/13/17/556861317.db2.gz DJVYTGOWYZCTKK-LICLKQGHSA-N 0 2 442.899 4.501 40 10 IJCBLN CCOc1cc(/C=C2\C(=O)NC(=O)N(c3cccc(Cl)c3C)C2=O)ccc1OC(C)C ZINC000408813569 556865112 /nfs/dbraw/zinc/86/51/12/556865112.db2.gz OIWJIHKVBINJJD-LFIBNONCSA-N 0 2 442.899 4.501 40 10 IJCBLN CCc1ccc(N2C(=O)NC(=O)C(=Cc3ccc(Cc4cccc(F)c4)cc3)C2=O)cc1 ZINC000408872722 556875327 /nfs/dbraw/zinc/87/53/27/556875327.db2.gz OYHNQIOLWGBRSQ-XQNSMLJCSA-N 0 2 428.463 4.645 40 10 IJCBLN CCCCOc1ccc(N2C(=O)NC(=O)C(=Cc3ccc(OCC)c(Cl)c3)C2=O)cc1 ZINC000408898885 556883662 /nfs/dbraw/zinc/88/36/62/556883662.db2.gz NBSUEGZLHYVBDR-AQTBWJFISA-N 0 2 442.899 4.584 40 10 IJCBLN O=C1NC(=O)N(c2ccccc2)C(=O)/C1=C\c1cccc(OCc2cccc(Cl)c2)c1 ZINC000408939411 556896341 /nfs/dbraw/zinc/89/63/41/556896341.db2.gz SFPMGUFQZVMQKK-STZFKDTASA-N 0 2 432.863 4.585 40 10 IJCBLN CCc1ccc(N2C(=O)NC(=O)C(=Cc3ccc(OCc4cccc(F)c4)cc3)C2=O)cc1 ZINC000408986458 556909617 /nfs/dbraw/zinc/90/96/17/556909617.db2.gz MBXMCVVDZINTKA-HAHDFKILSA-N 0 2 444.462 4.634 40 10 IJCBLN Cc1ccc(-n2cccc2/C=C2\C(=O)NC(=O)N(c3cccc(Cl)c3Cl)C2=O)cc1 ZINC000409093656 556949499 /nfs/dbraw/zinc/94/94/99/556949499.db2.gz BLMQJWRVVDMBHT-FOWTUZBSSA-N 0 2 440.286 4.759 40 10 IJCBLN O=C1NC(=O)N(c2ccc(Cl)c(Cl)c2)C(=O)/C1=C/c1c(Cl)cccc1Cl ZINC000409209757 557004118 /nfs/dbraw/zinc/00/41/18/557004118.db2.gz IJEJXSAOFIFYSF-JXMROGBWSA-N 0 2 430.074 4.967 40 10 IJCBLN CCOc1ccccc1N1C(=O)NC(=O)C(=Cc2ccc(-c3cccc(Cl)c3)o2)C1=O ZINC000409245738 557027567 /nfs/dbraw/zinc/02/75/67/557027567.db2.gz YKBCNWRNKAAVPN-GHRIWEEISA-N 0 2 436.851 4.665 40 10 IJCBLN COc1ccc(N=N[C@H]2C(=O)N(c3nc(-c4cccc([N+](=O)[O-])c4)cs3)N=C2C)cc1 ZINC000100525289 557114812 /nfs/dbraw/zinc/11/48/12/557114812.db2.gz GUVNZQIFQBSEIL-KGNHYALCSA-N 0 2 436.453 4.602 40 10 IJCBLN Cc1ccc(COc2ccccc2/C=C2\C(=O)NC(=O)N(c3ccccc3C)C2=O)cc1 ZINC000014133100 557421728 /nfs/dbraw/zinc/42/17/28/557421728.db2.gz LBBCPZXGXPECNH-RCCKNPSSSA-N 0 2 426.472 4.549 40 10 IJCBLN O=C1NC(=O)N(c2ccc3c(c2)OCO3)C(=O)C1=Cc1ccc(-c2ccc(Cl)cc2)o1 ZINC000059104605 557814280 /nfs/dbraw/zinc/81/42/80/557814280.db2.gz OOTKPFNVCJFHCA-MHWRWJLKSA-N 0 2 436.807 4.835 40 10 IJCBLN CCOc1ccc(N2C(=O)NC(=O)C(=Cc3ccc(-c4cccc([N+](=O)[O-])c4)o3)C2=O)cc1 ZINC000059861784 557827798 /nfs/dbraw/zinc/82/77/98/557827798.db2.gz QPRHCXRCWNZFJH-CPNJWEJPSA-N 0 2 447.403 4.760 40 10 IJCBLN