smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name CC(C)c1ccc(N2CCC[C@@]3(CCN3Cc3cccc(F)c3)C2)nc1 ZINC001164997295 722201302 /nfs/dbraw/zinc/20/13/02/722201302.db2.gz YTBWWUVBNQHXAF-JOCHJYFZSA-N 0 3 353.485 4.589 20 0 FJADHN Fc1cccc(CN2CC[C@@]23CCCN(c2cc4ccsc4cn2)C3)c1 ZINC001164996668 722203607 /nfs/dbraw/zinc/20/36/07/722203607.db2.gz UZNUSRPSGRHLFC-OAQYLSRUSA-N 0 3 367.493 4.680 20 0 FJADHN Cc1ccccc1CN1CCC(NC(=O)c2ccc3ccccc3c2)CC1 ZINC000028821387 204890338 /nfs/dbraw/zinc/89/03/38/204890338.db2.gz JIGJYOFQTSHTPK-UHFFFAOYSA-N 0 3 358.485 4.543 20 0 FJADHN c1ccc(-c2cccc(CN3CCC4(CC3)OCc3ccccc34)c2)nc1 ZINC000040980929 205086040 /nfs/dbraw/zinc/08/60/40/205086040.db2.gz ZKBHALUUDNBLKS-UHFFFAOYSA-N 0 3 356.469 4.770 20 0 FJADHN C[C@@H](c1cccc(C(F)(F)F)c1)N(Cc1ccc(C(N)=O)cc1)C1CC1 ZINC000054396489 205200649 /nfs/dbraw/zinc/20/06/49/205200649.db2.gz AOFMHUDSSPMDNE-ZDUSSCGKSA-N 0 3 362.395 4.530 20 0 FJADHN CN(C)Cc1cccc(NC(=O)[C@H]2C[C@H]2c2ccccc2C(F)(F)F)c1 ZINC000127642303 206119736 /nfs/dbraw/zinc/11/97/36/206119736.db2.gz VVKXROROVWKMBH-IRXDYDNUSA-N 0 3 362.395 4.509 20 0 FJADHN FC(F)(F)c1cccc(CNCc2ccc(Br)s2)c1 ZINC000019906750 206327588 /nfs/dbraw/zinc/32/75/88/206327588.db2.gz VDSKXPRLDVGXIF-UHFFFAOYSA-N 0 3 350.203 4.819 20 0 FJADHN C[C@@H](Nc1cccc(OCCN(C)C)c1)c1ccc(Br)s1 ZINC000038002872 211342047 /nfs/dbraw/zinc/34/20/47/211342047.db2.gz WPCWPLXUCIFZKZ-GFCCVEGCSA-N 0 3 369.328 4.624 20 0 FJADHN O=C(CCN1CCC[C@@H]1c1cccs1)Nc1ccc(Cl)cc1F ZINC000022199330 211339379 /nfs/dbraw/zinc/33/93/79/211339379.db2.gz KWOYMOIBLRRYOI-OAHLLOKOSA-N 0 3 352.862 4.706 20 0 FJADHN CCN1CCN(c2ccc(NC(=O)c3ccc(C(C)C)cc3)c(C)c2)CC1 ZINC000026909355 136153435 /nfs/dbraw/zinc/15/34/35/136153435.db2.gz WVAPLLHCNYJIEN-UHFFFAOYSA-N 0 3 365.521 4.513 20 0 FJADHN O=C(Nc1cccc(CN2CCCCC2)c1)[C@H]1CCCC[C@@H]1C(F)(F)F ZINC000107930152 222406547 /nfs/dbraw/zinc/40/65/47/222406547.db2.gz UVDVLZYKOASABE-ROUUACIJSA-N 0 3 368.443 4.980 20 0 FJADHN Fc1ccc(-c2ccc(CNC[C@H]3CCN(c4ccc(F)cc4)C3)o2)cc1 ZINC000084419521 526313727 /nfs/dbraw/zinc/31/37/27/526313727.db2.gz NLEREQXTQDLIOX-MRXNPFEDSA-N 0 3 368.427 4.841 20 0 FJADHN C[C@H]1CCc2sc(C(=O)N(c3ccccc3)C3CCN(C)CC3)cc2C1 ZINC000601956222 567885459 /nfs/dbraw/zinc/88/54/59/567885459.db2.gz LFUDDQBACIAGIP-INIZCTEOSA-N 0 3 368.546 4.614 20 0 FJADHN C[C@@H]1CCc2sc(C(=O)N(c3ccccc3)C3CCN(C)CC3)cc2C1 ZINC000601956223 567885550 /nfs/dbraw/zinc/88/55/50/567885550.db2.gz LFUDDQBACIAGIP-MRXNPFEDSA-N 0 3 368.546 4.614 20 0 FJADHN CN1CCC(N(C(=O)CCCCCc2cccs2)c2ccccc2)CC1 ZINC000601961699 567887618 /nfs/dbraw/zinc/88/76/18/567887618.db2.gz HGGRLVOQEPYJGS-UHFFFAOYSA-N 0 3 370.562 4.978 20 0 FJADHN CN1CCC(N(C(=O)[C@H]2C[C@H]2c2ccccc2Cl)c2ccccc2)CC1 ZINC000601963939 567888493 /nfs/dbraw/zinc/88/84/93/567888493.db2.gz YKDFLTFIPRQBSO-PMACEKPBSA-N 0 3 368.908 4.571 20 0 FJADHN Cc1ccc(CCCCC(=O)N(c2ccccc2)C2CCN(C)CC2)cc1 ZINC000601965956 567889057 /nfs/dbraw/zinc/88/90/57/567889057.db2.gz GIFKWARKJVNDAU-UHFFFAOYSA-N 0 3 364.533 4.835 20 0 FJADHN CN1CCC(N(C(=O)c2csc3ccccc23)c2ccccc2)CC1 ZINC000601968961 567890133 /nfs/dbraw/zinc/89/01/33/567890133.db2.gz VGLWMVJFKYBMGP-UHFFFAOYSA-N 0 3 350.487 4.642 20 0 FJADHN CCc1ccc([C@H](CNC(=O)Nc2cccc(CSC)c2)N(C)C)cc1 ZINC000609471090 567958880 /nfs/dbraw/zinc/95/88/80/567958880.db2.gz KYNGTIRQQSFGBI-FQEVSTJZSA-N 0 3 371.550 4.536 20 0 FJADHN COC(=O)c1ccc(CN[C@@H](Cc2ccccc2)c2sccc2C)s1 ZINC000521418757 567971423 /nfs/dbraw/zinc/97/14/23/567971423.db2.gz KDSXDSPWHIXHTE-KRWDZBQOSA-N 0 3 371.527 4.978 20 0 FJADHN C[C@@H](Nc1cccc(N2CCN(CC3CC3)CC2)c1)c1ccccc1F ZINC000602578774 567993448 /nfs/dbraw/zinc/99/34/48/567993448.db2.gz JEHCOFDYMBCLED-QGZVFWFLSA-N 0 3 353.485 4.531 20 0 FJADHN C[C@@H](N[C@H]1CCc2nc(-c3ccccc3)ncc2C1)c1cc(F)ccc1F ZINC000602584078 567994111 /nfs/dbraw/zinc/99/41/11/567994111.db2.gz CSTSNBQHHBNVPO-KDOFPFPSSA-N 0 3 365.427 4.630 20 0 FJADHN C[C@@H](N[C@@H]1CCc2nc(-c3ccccc3)ncc2C1)c1ccc(F)cc1F ZINC000602584119 567994216 /nfs/dbraw/zinc/99/42/16/567994216.db2.gz NJWWVKKJEUZGIG-RDTXWAMCSA-N 0 3 365.427 4.630 20 0 FJADHN CC(C)NC(=O)Nc1ccc([C@H](C)N[C@H](C)c2ccc(F)c(F)c2)cc1 ZINC000602570265 567996003 /nfs/dbraw/zinc/99/60/03/567996003.db2.gz SOPKELKTYMTZRJ-UONOGXRCSA-N 0 3 361.436 4.907 20 0 FJADHN Cc1ccccc1[C@@H](NCc1ccc(C(N)=O)cc1)C1CCC(C)CC1 ZINC000602912006 568011431 /nfs/dbraw/zinc/01/14/31/568011431.db2.gz WXKIUMMWPDNCHR-NZBFNNPHSA-N 0 3 350.506 4.751 20 0 FJADHN Cc1ccccc1[C@@H](NCc1cccc(C(N)=O)c1)C1CCC(C)CC1 ZINC000602911973 568011489 /nfs/dbraw/zinc/01/14/89/568011489.db2.gz SJYCIXZERJRCRU-NZBFNNPHSA-N 0 3 350.506 4.751 20 0 FJADHN COc1cc(CN[C@H](c2ccc(C)cc2)C2CCC2)cc(OC)c1OC ZINC000186945678 568020864 /nfs/dbraw/zinc/02/08/64/568020864.db2.gz SZXPAKNRDXWXHJ-NRFANRHFSA-N 0 3 355.478 4.652 20 0 FJADHN Cc1ccc([C@H](NCc2ccccc2CN2CCCC2=O)C2CCC2)cc1 ZINC000186987990 568038106 /nfs/dbraw/zinc/03/81/06/568038106.db2.gz DGVVVZFKEIKJNU-XMMPIXPASA-N 0 3 362.517 4.748 20 0 FJADHN COc1ccc(CN[C@@H](c2ccc(C)cc2)C2CCC2)c(OC)c1OC ZINC000187026345 568049613 /nfs/dbraw/zinc/04/96/13/568049613.db2.gz BOIHQURCZLIZPB-HXUWFJFHSA-N 0 3 355.478 4.652 20 0 FJADHN CC[C@H](Cc1ccccc1)N(C)Cc1nnc(-c2ccccc2Cl)o1 ZINC000128617451 568083983 /nfs/dbraw/zinc/08/39/83/568083983.db2.gz ZOCAWOQULLVPIP-MRXNPFEDSA-N 0 3 355.869 4.843 20 0 FJADHN CCOc1cc(CNC[C@H]2OCCc3ccccc32)ccc1OCC(C)C ZINC000603516253 568111660 /nfs/dbraw/zinc/11/16/60/568111660.db2.gz RYMAKRKEVUWPFY-HSZRJFAPSA-N 0 3 369.505 4.524 20 0 FJADHN CCC[C@H](NCc1ccc(CC(N)=O)cc1)c1ccc(Cl)c(Cl)c1 ZINC000603516567 568111695 /nfs/dbraw/zinc/11/16/95/568111695.db2.gz IKANHSFHKYRXLM-SFHVURJKSA-N 0 3 365.304 4.652 20 0 FJADHN COc1cc(CN(C)CCSc2ccccc2)ccc1OC(F)F ZINC000522775626 568131569 /nfs/dbraw/zinc/13/15/69/568131569.db2.gz MONHNUHRTRUQHN-UHFFFAOYSA-N 0 3 353.434 4.521 20 0 FJADHN Cc1ccc(NC(=O)COc2ccc(C(C)C)c(C)c2)c(CN(C)C)c1 ZINC000603694895 568136692 /nfs/dbraw/zinc/13/66/92/568136692.db2.gz BXSNKAZRTYSTAH-UHFFFAOYSA-N 0 3 354.494 4.506 20 0 FJADHN COc1ccc(CCCCCC(=O)Nc2ccc(C)cc2CN(C)C)cc1 ZINC000603694522 568136753 /nfs/dbraw/zinc/13/67/53/568136753.db2.gz BUZPXCVDMPWGCB-UHFFFAOYSA-N 0 3 368.521 4.807 20 0 FJADHN Cc1ccc(NC(=O)Cc2cc(Cl)ccc2Cl)c(CN(C)C)c1 ZINC000603695194 568136778 /nfs/dbraw/zinc/13/67/78/568136778.db2.gz PKENFPXXWRRDMH-UHFFFAOYSA-N 0 3 351.277 4.545 20 0 FJADHN Cc1cn2c(CNCCCO[C@@H]3CCCc4ccccc43)c(C)nc2s1 ZINC000603723606 568142152 /nfs/dbraw/zinc/14/21/52/568142152.db2.gz LPZGGEFSCYMHGI-HXUWFJFHSA-N 0 3 369.534 4.587 20 0 FJADHN C[C@H](NC(C)(C)CNC(=O)Nc1nc2ccsc2s1)c1ccccc1 ZINC000522780564 568157242 /nfs/dbraw/zinc/15/72/42/568157242.db2.gz OUMYADQTVXTISZ-LBPRGKRZSA-N 0 3 374.535 4.609 20 0 FJADHN CC[C@H](CC1CCCC1)C(=O)NC[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000603863124 568172085 /nfs/dbraw/zinc/17/20/85/568172085.db2.gz RFTABFOIVLBJIE-FCHUYYIVSA-N 0 3 356.554 4.621 20 0 FJADHN COC(=O)c1cc(CN2CCC(c3c(C)[nH]c4ccccc43)CC2)oc1C ZINC000603869730 568173696 /nfs/dbraw/zinc/17/36/96/568173696.db2.gz DWYAIHJYIUVYBW-UHFFFAOYSA-N 0 3 366.461 4.544 20 0 FJADHN C[C@@H](N[C@H](C)c1ccc(S(C)(=O)=O)cc1)c1ccc(C(F)(F)F)cc1 ZINC000122278157 568225059 /nfs/dbraw/zinc/22/50/59/568225059.db2.gz DSWMTJSPAIOACK-CHWSQXEVSA-N 0 3 371.424 4.521 20 0 FJADHN C[C@@H]1CN(C(=O)N[C@@H](CN2CCCCC2)c2ccccc2)c2ccccc21 ZINC000604205070 568228306 /nfs/dbraw/zinc/22/83/06/568228306.db2.gz JJJNAATVYZUEIV-NQIIRXRSSA-N 0 3 363.505 4.547 20 0 FJADHN Cc1ccc([C@H](CN[C@@H]2CCSc3c(F)cccc32)N2CCCC2)o1 ZINC000482018138 568229051 /nfs/dbraw/zinc/22/90/51/568229051.db2.gz QSSIKVOABUDBOI-MSOLQXFVSA-N 0 3 360.498 4.691 20 0 FJADHN Cc1nc(CNCCCCSc2ccccc2Br)cs1 ZINC000604417802 568275733 /nfs/dbraw/zinc/27/57/33/568275733.db2.gz XTOFGOJVGVWZFB-UHFFFAOYSA-N 0 3 371.369 4.876 20 0 FJADHN CCN(CC)[C@H](CNC(=O)C[C@@H](C)c1ccccc1F)c1ccccc1 ZINC000303171396 568255379 /nfs/dbraw/zinc/25/53/79/568255379.db2.gz RGNCKNYSUWKNJJ-DYESRHJHSA-N 0 3 356.485 4.519 20 0 FJADHN C[C@@H](NC(C)(C)CNC(=O)C1(c2ccc(Cl)cc2)CC1)c1ccccc1 ZINC000303175042 568255572 /nfs/dbraw/zinc/25/55/72/568255572.db2.gz CAMGRWDUWIPJEF-MRXNPFEDSA-N 0 3 370.924 4.617 20 0 FJADHN CN(C[C@H]1CCCN(C)C1)C(=O)c1ccc(Oc2cccc(Cl)c2)cc1 ZINC000604346736 568264394 /nfs/dbraw/zinc/26/43/94/568264394.db2.gz MNHNIYQORITMSO-INIZCTEOSA-N 0 3 372.896 4.546 20 0 FJADHN Cc1ccc(-c2ncc(CNC[C@@H](C)N(C)Cc3ccccc3)s2)cc1 ZINC000604416562 568274718 /nfs/dbraw/zinc/27/47/18/568274718.db2.gz HUCHDGKUXANATL-GOSISDBHSA-N 0 3 365.546 4.729 20 0 FJADHN Cc1cccnc1[C@H](NCc1cccc(OCc2ccccn2)c1)C(C)C ZINC000604417159 568275267 /nfs/dbraw/zinc/27/52/67/568275267.db2.gz JIROQNCMPMMMLS-JOCHJYFZSA-N 0 3 361.489 4.851 20 0 FJADHN CSc1ccc2c(c1)[C@H](N[C@@H](C)c1ccc([S@@](C)=O)cc1)CCC2 ZINC000563136264 568275387 /nfs/dbraw/zinc/27/53/87/568275387.db2.gz QVIWYKHDHOIOSR-KVGGTASHSA-N 0 3 359.560 4.874 20 0 FJADHN Cc1cccc([C@H](C)NCc2cc3c(c(Br)c2)OCO3)c1C ZINC000604418093 568276221 /nfs/dbraw/zinc/27/62/21/568276221.db2.gz GSWYOPWZJAVQGU-ZDUSSCGKSA-N 0 3 362.267 4.645 20 0 FJADHN Cc1cccc([C@@H](C)NCc2cc3c(c(Br)c2)OCO3)c1C ZINC000604418092 568276239 /nfs/dbraw/zinc/27/62/39/568276239.db2.gz GSWYOPWZJAVQGU-CYBMUJFWSA-N 0 3 362.267 4.645 20 0 FJADHN CSCc1c2ccccc2oc1C(=O)N(CCN(C)C)C1CCCCC1 ZINC000604478414 568299911 /nfs/dbraw/zinc/29/99/11/568299911.db2.gz GERWFSFBQYIUOW-UHFFFAOYSA-N 0 3 374.550 4.632 20 0 FJADHN C[C@@H]1CCC[C@@H](CCNC(=O)N(C)C2CCN(Cc3ccccc3)CC2)C1 ZINC000604667012 568344365 /nfs/dbraw/zinc/34/43/65/568344365.db2.gz JIRKCUHFNIZKOB-UXHICEINSA-N 0 3 371.569 4.509 20 0 FJADHN CC[C@H](CC(=O)NC1CCN([C@H](C)c2ccccc2)CC1)c1ccccc1 ZINC000604713767 568355201 /nfs/dbraw/zinc/35/52/01/568355201.db2.gz HUYZMIHTGCTXDY-WOJBJXKFSA-N 0 3 364.533 4.912 20 0 FJADHN O[C@H]([C@@H](Cc1ccccc1)NCc1csc2ccccc12)C(F)(F)F ZINC000604764908 568361697 /nfs/dbraw/zinc/36/16/97/568361697.db2.gz CAEPKYLDABHXEE-SJLPKXTDSA-N 0 3 365.420 4.525 20 0 FJADHN COc1ccc(C2(NCc3cc(OC)cc4c3O[C@H](C)C4)CCCC2)cc1 ZINC000604765563 568361864 /nfs/dbraw/zinc/36/18/64/568361864.db2.gz SZGNFKMJHLZGJS-MRXNPFEDSA-N 0 3 367.489 4.586 20 0 FJADHN C[C@@H](c1ccccc1)[C@H](CO)NCc1ccc(-c2ccccc2Cl)o1 ZINC000604767851 568362423 /nfs/dbraw/zinc/36/24/23/568362423.db2.gz DJJUDXRVUAPZLE-YWZLYKJASA-N 0 3 355.865 4.854 20 0 FJADHN C[C@H](c1ccccc1)[C@@H](CO)NCc1ccc(-c2ccccc2Cl)o1 ZINC000604767842 568362439 /nfs/dbraw/zinc/36/24/39/568362439.db2.gz DJJUDXRVUAPZLE-FOIQADDNSA-N 0 3 355.865 4.854 20 0 FJADHN Fc1cccc(N2CCC[C@H](NCc3nc(-c4ccccc4)cs3)C2)c1 ZINC000604772779 568363504 /nfs/dbraw/zinc/36/35/04/568363504.db2.gz XBOLEQNXAILMMN-SFHVURJKSA-N 0 3 367.493 4.708 20 0 FJADHN Cc1sc2ncnc(NC3CCN([C@H](C)c4ccccc4)CC3)c2c1C ZINC000604757461 568365270 /nfs/dbraw/zinc/36/52/70/568365270.db2.gz FNMZFROEJRQDQC-OAHLLOKOSA-N 0 3 366.534 4.946 20 0 FJADHN CCc1cc2c(ncnc2NC2CCN([C@@H](C)c3ccccc3)CC2)s1 ZINC000604757542 568365352 /nfs/dbraw/zinc/36/53/52/568365352.db2.gz IYMNVIOVWQWLDO-HNNXBMFYSA-N 0 3 366.534 4.891 20 0 FJADHN CC(C)[C@H]1CCCN(C(=O)NC2CCN([C@@H](C)c3ccccc3)CC2)CC1 ZINC000604827715 568376725 /nfs/dbraw/zinc/37/67/25/568376725.db2.gz XUXAGZRBKKAHOW-PMACEKPBSA-N 0 3 371.569 4.680 20 0 FJADHN Cc1ccc(CCCC(=O)Nc2ccc(OCCN(C)C)c(Cl)c2)cc1 ZINC000604874345 568382721 /nfs/dbraw/zinc/38/27/21/568382721.db2.gz JNOUOIWHPDHTTJ-UHFFFAOYSA-N 0 3 374.912 4.550 20 0 FJADHN O[C@@H](CN[C@@H](CC(F)F)c1ccccc1)COc1ccc2ccccc2c1 ZINC000643255726 568406695 /nfs/dbraw/zinc/40/66/95/568406695.db2.gz REJXYTZQWXTUDQ-FPOVZHCZSA-N 0 3 371.427 4.566 20 0 FJADHN CCN(CC)[C@H](CNC(=O)c1oc2c(cccc2F)c1C)c1ccsc1 ZINC000031992848 568416026 /nfs/dbraw/zinc/41/60/26/568416026.db2.gz BRWRXXDSUFYGSO-QGZVFWFLSA-N 0 3 374.481 4.755 20 0 FJADHN CC[C@@H](N[C@H](C)C(=O)Nc1ccccc1)c1ccc(Br)cc1 ZINC000007375358 568503522 /nfs/dbraw/zinc/50/35/22/568503522.db2.gz IFZFVNFMCWKCJM-CXAGYDPISA-N 0 3 361.283 4.517 20 0 FJADHN Cc1cc([C@@H]2CCCN2CC/C=C/c2ccc(Br)cc2)on1 ZINC000604997227 568507882 /nfs/dbraw/zinc/50/78/82/568507882.db2.gz BCZLTYJFYSFWDJ-RTZWDOBSSA-N 0 3 361.283 4.986 20 0 FJADHN Brc1ccc(CCNCc2csc(-c3ccccc3)n2)cc1 ZINC000605008595 568515934 /nfs/dbraw/zinc/51/59/34/568515934.db2.gz IGJDHUSJCFPERX-UHFFFAOYSA-N 0 3 373.319 4.905 20 0 FJADHN C[C@@H](NC(=O)Nc1cccc(CN(C)C)c1)c1cccc(Cl)c1Cl ZINC000605167919 568595816 /nfs/dbraw/zinc/59/58/16/568595816.db2.gz JKWYHDHCMLWSQS-GFCCVEGCSA-N 0 3 366.292 4.938 20 0 FJADHN CSc1ccccc1NC(=O)CCN1CCS[C@H](c2ccccc2)C1 ZINC000605153822 568597621 /nfs/dbraw/zinc/59/76/21/568597621.db2.gz CJLZJEDQADSCFM-IBGZPJMESA-N 0 3 372.559 4.527 20 0 FJADHN FC(F)(F)COc1cccc(CN2CCS[C@@H](c3ccccc3)C2)c1 ZINC000605155274 568600021 /nfs/dbraw/zinc/60/00/21/568600021.db2.gz MUYXIJYGCJYVGQ-GOSISDBHSA-N 0 3 367.436 4.918 20 0 FJADHN O=C(CC/C=C\c1ccccc1)NCc1ccccc1CN1CCCCC1 ZINC000606164534 568682772 /nfs/dbraw/zinc/68/27/72/568682772.db2.gz MGHGWISSAAHRIA-ACAGNQJTSA-N 0 3 362.517 4.782 20 0 FJADHN C[C@H](Cc1ccc(C(F)(F)F)cc1)C(=O)Nc1cccc(CN(C)C)c1 ZINC000606173128 568705314 /nfs/dbraw/zinc/70/53/14/568705314.db2.gz OOEVTOIHACXQDS-CQSZACIVSA-N 0 3 364.411 4.584 20 0 FJADHN CCCN(C(=O)[C@@H](C)c1cccs1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000606189027 568710089 /nfs/dbraw/zinc/71/00/89/568710089.db2.gz YEEVPFXUHLXUQP-ICSRJNTNSA-N 0 3 370.562 4.755 20 0 FJADHN c1ccc2c(c1)CCCC21CCN(c2ccc(CN3CCCC3)cn2)CC1 ZINC001164387308 718814043 /nfs/dbraw/zinc/81/40/43/718814043.db2.gz FKALDGANNSFNCS-UHFFFAOYSA-N 0 3 361.533 4.552 20 0 FJADHN CC(C)(c1ccnc(Cl)c1)N1C[C@@H]2CCC[C@]2(COc2ccccn2)C1 ZINC001164794871 721507794 /nfs/dbraw/zinc/50/77/94/721507794.db2.gz FBBTXZZLLRNZGN-LAUBAEHRSA-N 0 3 371.912 4.546 20 0 FJADHN CC[C@@H](NCc1ccc(Br)s1)c1ccc(OC)c(OC)c1 ZINC000038018465 211354638 /nfs/dbraw/zinc/35/46/38/211354638.db2.gz JPBKHDNJKIKRTA-CYBMUJFWSA-N 0 3 370.312 4.769 20 0 FJADHN Cc1nc2ccccc2n1CCN[C@@H](C)c1ccc(Br)s1 ZINC000038002081 211343564 /nfs/dbraw/zinc/34/35/64/211343564.db2.gz UIPZADSPCLXOKE-NSHDSACASA-N 0 3 364.312 4.520 20 0 FJADHN CC(C)[C@H](NCC(=O)Nc1cc(F)ccc1F)c1ccc(Cl)cc1 ZINC000014778513 211102693 /nfs/dbraw/zinc/10/26/93/211102693.db2.gz XWSNBAQVJKJMJF-SFHVURJKSA-N 0 3 352.812 4.544 20 0 FJADHN CN1CCC(N(C(=O)c2cc3sccc3s2)c2ccccc2)CC1 ZINC000601958219 567886293 /nfs/dbraw/zinc/88/62/93/567886293.db2.gz SOGVPHMQZKJWDO-UHFFFAOYSA-N 0 3 356.516 4.704 20 0 FJADHN CN1CCC(N(C(=O)[C@H]2C[C@@H]2c2cccc(Cl)c2)c2ccccc2)CC1 ZINC000601959407 567886549 /nfs/dbraw/zinc/88/65/49/567886549.db2.gz ZXZYSKDRBVRPJR-RTWAWAEBSA-N 0 3 368.908 4.571 20 0 FJADHN CCCCc1ccc(C(=O)N(c2ccccc2)C2CCN(C)CC2)cc1 ZINC000601961393 567887329 /nfs/dbraw/zinc/88/73/29/567887329.db2.gz YYDQEFYVCVEIPV-UHFFFAOYSA-N 0 3 350.506 4.770 20 0 FJADHN CN1CCC(N(C(=O)CSc2ccc(Cl)cc2)c2ccccc2)CC1 ZINC000601963881 567888507 /nfs/dbraw/zinc/88/85/07/567888507.db2.gz XNAVIFBEWLPHGV-UHFFFAOYSA-N 0 3 374.937 4.560 20 0 FJADHN CC[C@H](Cc1ccccc1)C(=O)NC[C@H](c1ccsc1)N(CC)CC ZINC000602093035 567932740 /nfs/dbraw/zinc/93/27/40/567932740.db2.gz GQBZHWHEIHNSFN-UYAOXDASSA-N 0 3 358.551 4.516 20 0 FJADHN C[C@@H](N[C@@H]1CCc2nc(-c3ccccc3)ncc2C1)c1cc(F)ccc1F ZINC000602584080 567994141 /nfs/dbraw/zinc/99/41/41/567994141.db2.gz CSTSNBQHHBNVPO-RDTXWAMCSA-N 0 3 365.427 4.630 20 0 FJADHN COc1cc(CN[C@@H](c2ccc(C)cc2)C2CCC2)cc(OC)c1OC ZINC000186945663 568020813 /nfs/dbraw/zinc/02/08/13/568020813.db2.gz SZXPAKNRDXWXHJ-OAQYLSRUSA-N 0 3 355.478 4.652 20 0 FJADHN CC(F)(F)c1cccc(NC(=O)NC2CCN(Cc3ccccc3)CC2)c1 ZINC000186972582 568031482 /nfs/dbraw/zinc/03/14/82/568031482.db2.gz UWIAGUJFDDIQLN-UHFFFAOYSA-N 0 3 373.447 4.584 20 0 FJADHN Cc1cc2c(cc1C)[C@@H](NCc1cccc(Cn3ccnc3)c1)CCS2 ZINC000186987364 568037729 /nfs/dbraw/zinc/03/77/29/568037729.db2.gz SWAGTHGMRNFWGY-NRFANRHFSA-N 0 3 363.530 4.875 20 0 FJADHN Cc1cc2c(cc1C)[C@H](NCc1ccc(Cn3ccnc3)cc1)CCS2 ZINC000186992057 568040010 /nfs/dbraw/zinc/04/00/10/568040010.db2.gz CMUWAHZMYZNRAY-OAQYLSRUSA-N 0 3 363.530 4.875 20 0 FJADHN Cc1ccc([C@@H](NCc2cccc(CN3CCCC3=O)c2)C2CCC2)cc1 ZINC000186998303 568047284 /nfs/dbraw/zinc/04/72/84/568047284.db2.gz YUNRHSCXRADDQC-DEOSSOPVSA-N 0 3 362.517 4.748 20 0 FJADHN Clc1ccc(-c2noc(-c3ccc(CN4CCSCC4)cc3)n2)cc1 ZINC000603630188 568127848 /nfs/dbraw/zinc/12/78/48/568127848.db2.gz FLCODOCGZRCALH-UHFFFAOYSA-N 0 3 371.893 4.606 20 0 FJADHN CN1CCC[C@@H](CNC(=O)C2CC3(C2)CCCCC3)[C@H]1c1cccs1 ZINC000669149956 568147048 /nfs/dbraw/zinc/14/70/48/568147048.db2.gz MSKYXNGCPZRZBP-LPHOPBHVSA-N 0 3 360.567 4.608 20 0 FJADHN CN1CCC[C@@H](CNC(=O)C2CC3(C2)CCCCC3)[C@@H]1c1cccs1 ZINC000669149957 568147415 /nfs/dbraw/zinc/14/74/15/568147415.db2.gz MSKYXNGCPZRZBP-QFBILLFUSA-N 0 3 360.567 4.608 20 0 FJADHN CC[C@@H]1c2ccccc2CCN1CCC(=O)Nc1cc(Cl)ccc1OC ZINC000603944360 568185817 /nfs/dbraw/zinc/18/58/17/568185817.db2.gz LLYMDFIJXCMWRE-LJQANCHMSA-N 0 3 372.896 4.687 20 0 FJADHN CC(=O)c1c(C)cc(C)c(CN2CCCN(Cc3ccccc3)CC2)c1C ZINC000028157164 568193283 /nfs/dbraw/zinc/19/32/83/568193283.db2.gz LSJPBKUWQDKVJI-UHFFFAOYSA-N 0 3 364.533 4.522 20 0 FJADHN COc1ccc(CNCCCSc2ccccc2)c(OC(F)F)c1 ZINC000604063447 568205076 /nfs/dbraw/zinc/20/50/76/568205076.db2.gz VFWUFCRDTZBTAB-UHFFFAOYSA-N 0 3 353.434 4.569 20 0 FJADHN CC[C@H](NCc1cccc(OC(F)(F)F)c1)c1ccc2c(c1)OCCO2 ZINC000236947434 568205119 /nfs/dbraw/zinc/20/51/19/568205119.db2.gz XAURHEFGOWCDKJ-INIZCTEOSA-N 0 3 367.367 4.597 20 0 FJADHN C[C@@H](NCCc1nc(-c2cccc(Cl)c2)no1)c1ccc(Cl)cc1 ZINC000604067124 568205709 /nfs/dbraw/zinc/20/57/09/568205709.db2.gz UXLWIPGOFRFXHL-GFCCVEGCSA-N 0 3 362.260 4.937 20 0 FJADHN CC(C)Oc1ccccc1NCc1ccc(OCCN2CCCC2)cc1 ZINC000604068374 568205855 /nfs/dbraw/zinc/20/58/55/568205855.db2.gz NBQQKCVDBQTKKC-UHFFFAOYSA-N 0 3 354.494 4.561 20 0 FJADHN O=C(NC[C@@H]1CCCN1Cc1ccccc1)Nc1cccc2ccccc21 ZINC000604072172 568210459 /nfs/dbraw/zinc/21/04/59/568210459.db2.gz MISIPKPCINHIIS-FQEVSTJZSA-N 0 3 359.473 4.626 20 0 FJADHN C[C@@H](c1cccs1)N(C)C(=O)N[C@@H](CN1CCCCC1)c1ccccc1 ZINC000604202167 568227621 /nfs/dbraw/zinc/22/76/21/568227621.db2.gz QUBQCLZECBYLDL-HKUYNNGSSA-N 0 3 371.550 4.678 20 0 FJADHN Cc1ccc(CN(Cc2cccc(C(=O)NCC(C)C)c2)C(C)C)s1 ZINC000303235063 568261804 /nfs/dbraw/zinc/26/18/04/568261804.db2.gz ZLKUGTCZYNDCSU-UHFFFAOYSA-N 0 3 358.551 4.853 20 0 FJADHN O=C(N[C@@H](c1ccc(F)cc1)C1CCC1)c1cccc(CN2CCCC2)c1 ZINC000303285201 568264353 /nfs/dbraw/zinc/26/43/53/568264353.db2.gz VQWAMZSHIGWAHA-JOCHJYFZSA-N 0 3 366.480 4.693 20 0 FJADHN CN(C[C@H]1CCCN(C)C1)C(=O)c1sc2cccc(Cl)c2c1Cl ZINC000604346955 568264657 /nfs/dbraw/zinc/26/46/57/568264657.db2.gz GGRKFVFMDNLYSP-NSHDSACASA-N 0 3 371.333 4.622 20 0 FJADHN Cc1c(F)cccc1-c1ccc(CNC[C@H]2OCCc3ccccc32)o1 ZINC000604416573 568274725 /nfs/dbraw/zinc/27/47/25/568274725.db2.gz JDZAZQVAQNYCKE-JOCHJYFZSA-N 0 3 351.421 4.798 20 0 FJADHN Cc1c(F)cccc1-c1ccc(CNC[C@@H]2OCCc3ccccc32)o1 ZINC000604416574 568274770 /nfs/dbraw/zinc/27/47/70/568274770.db2.gz JDZAZQVAQNYCKE-QFIPXVFZSA-N 0 3 351.421 4.798 20 0 FJADHN CCN(CC)Cc1cccc(NC(=O)CSCc2ccc(F)cc2)c1 ZINC000024925843 568274830 /nfs/dbraw/zinc/27/48/30/568274830.db2.gz UGGKXTUUJQDHQB-UHFFFAOYSA-N 0 3 360.498 4.539 20 0 FJADHN CN(C)[C@H](CNCc1ccc(-c2c(F)cccc2F)o1)c1cccs1 ZINC000604414650 568279514 /nfs/dbraw/zinc/27/95/14/568279514.db2.gz HKAVPEZGTONHLZ-MRXNPFEDSA-N 0 3 362.445 4.679 20 0 FJADHN Cc1ccc(-c2ncc(CNC[C@@H](c3ccc(C)cc3)N(C)C)s2)cc1 ZINC000604415449 568280821 /nfs/dbraw/zinc/28/08/21/568280821.db2.gz LJPIIZZLURWYKB-NRFANRHFSA-N 0 3 365.546 4.819 20 0 FJADHN CC(=O)Nc1ccc(CCNCc2ccc(-c3cccc(F)c3C)o2)cc1 ZINC000604415692 568281128 /nfs/dbraw/zinc/28/11/28/568281128.db2.gz PEMBBHSFMARWDI-UHFFFAOYSA-N 0 3 366.436 4.685 20 0 FJADHN CSCc1c2ccccc2oc1C(=O)N(CCN(C)C)c1ccccc1 ZINC000604500903 568301658 /nfs/dbraw/zinc/30/16/58/568301658.db2.gz MJFVBOVDJHKIMF-UHFFFAOYSA-N 0 3 368.502 4.504 20 0 FJADHN Cc1ccccc1[C@@H](C)CC(=O)NCc1ccccc1CN1CCCCC1 ZINC000604697772 568351416 /nfs/dbraw/zinc/35/14/16/568351416.db2.gz CJMBRQCAUHGWIJ-FQEVSTJZSA-N 0 3 364.533 4.791 20 0 FJADHN CCc1ccc([C@@H](C)C(=O)NC2CCN([C@H](C)c3ccccc3)CC2)cc1 ZINC000604713753 568355183 /nfs/dbraw/zinc/35/51/83/568355183.db2.gz GTYWABDSNDFQPA-RTBURBONSA-N 0 3 364.533 4.694 20 0 FJADHN CCc1ccc(CCC(=O)NC2CCN([C@H](C)c3ccccc3)CC2)cc1 ZINC000604713885 568355252 /nfs/dbraw/zinc/35/52/52/568355252.db2.gz LYVOBNAXQLAQHZ-LJQANCHMSA-N 0 3 364.533 4.523 20 0 FJADHN Cc1nc(C(C)C)sc1C(=O)NC1CCN([C@@H](C)c2ccccc2)CC1 ZINC000604714644 568355450 /nfs/dbraw/zinc/35/54/50/568355450.db2.gz YUYYLVCKFKDQGT-INIZCTEOSA-N 0 3 371.550 4.530 20 0 FJADHN CCCc1ccc(CN[C@@](C)(CO)c2cccc(C(F)(F)F)c2)cc1 ZINC000604767139 568362257 /nfs/dbraw/zinc/36/22/57/568362257.db2.gz NXZJNEPBVZUZIO-IBGZPJMESA-N 0 3 351.412 4.655 20 0 FJADHN Cc1cc(CN[C@@](C)(CO)c2cccc(C(F)(F)F)c2)c2ccccc2n1 ZINC000604767663 568362344 /nfs/dbraw/zinc/36/23/44/568362344.db2.gz UUGUZBQGLOPHEO-FQEVSTJZSA-N 0 3 374.406 4.559 20 0 FJADHN CC(C)NC(=O)[C@@H]1CCC[C@@H](NCc2ccc(-c3ccccc3Cl)o2)C1 ZINC000604772938 568363580 /nfs/dbraw/zinc/36/35/80/568363580.db2.gz XCLFLWRPFJQTIL-HZPDHXFCSA-N 0 3 374.912 4.773 20 0 FJADHN C[C@H](CN[C@H](C(=O)N(C)C)c1ccccc1)c1c(Cl)cccc1Cl ZINC000604773792 568363817 /nfs/dbraw/zinc/36/38/17/568363817.db2.gz YVLRBEIGWPWGJK-ACJLOTCBSA-N 0 3 365.304 4.516 20 0 FJADHN CC(C)CCC[C@@H](C)NC(=O)NC1CCN([C@H](C)c2ccccc2)CC1 ZINC000604784447 568366328 /nfs/dbraw/zinc/36/63/28/568366328.db2.gz CFWSGCTYTRBWGX-RTBURBONSA-N 0 3 359.558 4.726 20 0 FJADHN C[C@@H](c1ccccc1)N1CCC(NC(=O)N2CCC[C@@H]2C2CCCC2)CC1 ZINC000604788354 568367049 /nfs/dbraw/zinc/36/70/49/568367049.db2.gz RTGPFMHYZHELDM-PGRDOPGGSA-N 0 3 369.553 4.576 20 0 FJADHN C[C@H](c1ccccc1)N1CCC(NC(=O)Nc2ccc(Cl)cc2)CC1 ZINC000604774954 568368928 /nfs/dbraw/zinc/36/89/28/568368928.db2.gz NEEZLNWUEDMQRV-OAHLLOKOSA-N 0 3 357.885 4.687 20 0 FJADHN CCC1CCC(N(C)C(=O)NC2CCN([C@@H](C)c3ccccc3)CC2)CC1 ZINC000604826532 568376631 /nfs/dbraw/zinc/37/66/31/568376631.db2.gz OIWCYGVYGSYHGF-PGFLUOATSA-N 0 3 371.569 4.822 20 0 FJADHN C[C@H](N[C@@H](Cc1ccccc1)c1cccs1)C(=O)N(C)c1ccccc1 ZINC000604891856 568381939 /nfs/dbraw/zinc/38/19/39/568381939.db2.gz CBXYTUDFFHFUMJ-PXNSSMCTSA-N 0 3 364.514 4.673 20 0 FJADHN CC(C)c1ccc(C(=O)Nc2ccc(OCCN(C)C)c(Cl)c2)cc1 ZINC000604875229 568382803 /nfs/dbraw/zinc/38/28/03/568382803.db2.gz PFMPQXOADKDFNS-UHFFFAOYSA-N 0 3 360.885 4.656 20 0 FJADHN CC(C)(NC(=O)N[C@@H](CN1CCCCC1)c1ccccc1)c1cccs1 ZINC000604920717 568390397 /nfs/dbraw/zinc/39/03/97/568390397.db2.gz GYOJSKPLIHEHHB-SFHVURJKSA-N 0 3 371.550 4.510 20 0 FJADHN Cc1cc(-c2noc([C@@H](C)NC[C@H]3CCc4ccccc4C3)n2)ccc1F ZINC000605007995 568521089 /nfs/dbraw/zinc/52/10/89/568521089.db2.gz PCXOOFWJMSYCJH-CVEARBPZSA-N 0 3 365.452 4.640 20 0 FJADHN Cc1ccsc1CN(C)Cc1ccc(C(=O)Nc2ccccc2)cc1 ZINC000007614303 568539887 /nfs/dbraw/zinc/53/98/87/568539887.db2.gz KYZDQTNZNZBNSK-UHFFFAOYSA-N 0 3 350.487 4.941 20 0 FJADHN CC(C)(Cc1ccccc1)C(=O)Nc1cccc(CN2CCCCC2)c1 ZINC000605083901 568558401 /nfs/dbraw/zinc/55/84/01/568558401.db2.gz ULPYYPKTWIAZOL-UHFFFAOYSA-N 0 3 350.506 4.880 20 0 FJADHN CO[C@@H]1CCCN(Cc2cnn(C3CCCC3)c2-c2ccccc2)CC1 ZINC000643292196 568596133 /nfs/dbraw/zinc/59/61/33/568596133.db2.gz JMNHYNFCQMGSEL-OAQYLSRUSA-N 0 3 353.510 4.666 20 0 FJADHN CC[C@@H](CC(=O)Nc1cc(CN(C)C)ccc1OC)c1ccc(C)cc1 ZINC000606173089 568705216 /nfs/dbraw/zinc/70/52/16/568705216.db2.gz NRLPKIKDCNDONL-SFHVURJKSA-N 0 3 354.494 4.588 20 0 FJADHN Brc1ccc(CNCc2cccc(Br)c2)cc1 ZINC000042238791 205094179 /nfs/dbraw/zinc/09/41/79/205094179.db2.gz KHGNLAJGZGIREU-UHFFFAOYSA-N 0 3 355.073 4.501 20 0 FJADHN Brc1ccccc1-c1ccc(CNCc2cccnc2)s1 ZINC000044861656 205113669 /nfs/dbraw/zinc/11/36/69/205113669.db2.gz BYOOEUKZLWLENT-UHFFFAOYSA-N 0 3 359.292 4.862 20 0 FJADHN C[C@H](c1cccc(C(F)(F)F)c1)N(Cc1ccc(C(N)=O)cc1)C1CC1 ZINC000054396492 205199806 /nfs/dbraw/zinc/19/98/06/205199806.db2.gz AOFMHUDSSPMDNE-CYBMUJFWSA-N 0 3 362.395 4.530 20 0 FJADHN Cc1ccccc1NC(=O)[C@H](C)N[C@@H](Cc1ccccc1)c1ccccc1 ZINC000104883092 206003731 /nfs/dbraw/zinc/00/37/31/206003731.db2.gz FNMQRXDQRMEAOD-CVDCTZTESA-N 0 3 358.485 4.896 20 0 FJADHN Cc1sc2ncnc(NC3CCN(Cc4ccccc4C)CC3)c2c1C ZINC000108092613 206027583 /nfs/dbraw/zinc/02/75/83/206027583.db2.gz KSXKADLZIHUHOO-UHFFFAOYSA-N 0 3 366.534 4.693 20 0 FJADHN CN(C)Cc1cccc(NC(=O)[C@@H]2C[C@@H]2c2ccccc2C(F)(F)F)c1 ZINC000127641662 206120324 /nfs/dbraw/zinc/12/03/24/206120324.db2.gz VVKXROROVWKMBH-IAGOWNOFSA-N 0 3 362.395 4.509 20 0 FJADHN CC(=O)N1CCCCC[C@H]1C1CCN(Cc2ccc3c(c2)CCCC3)CC1 ZINC000644832545 567838418 /nfs/dbraw/zinc/83/84/18/567838418.db2.gz MAFGNSYUODIRFM-DEOSSOPVSA-N 0 3 368.565 4.569 20 0 FJADHN CN1CCC(N(C(=O)CCc2ccc3ccccc3c2)c2ccccc2)CC1 ZINC000601961516 567887314 /nfs/dbraw/zinc/88/73/14/567887314.db2.gz DHIKIDZKQPCIPU-UHFFFAOYSA-N 0 3 372.512 4.900 20 0 FJADHN CCCc1cc(C(=O)N(c2ccccc2)C2CCN(C)CC2)sc1C ZINC000601961734 567887499 /nfs/dbraw/zinc/88/74/99/567887499.db2.gz HYBMGFNGYGCKTR-UHFFFAOYSA-N 0 3 356.535 4.750 20 0 FJADHN Cc1c2cccc(C)c2oc1C(=O)N(c1ccccc1)C1CCN(C)CC1 ZINC000601968851 567889923 /nfs/dbraw/zinc/88/99/23/567889923.db2.gz SBNMRBOBMODTLC-UHFFFAOYSA-N 0 3 362.473 4.791 20 0 FJADHN C[C@@H]1C[C@@H](N(C)C(=O)c2ccc(Cl)s2)CCN1Cc1ccccc1 ZINC000132166233 567920939 /nfs/dbraw/zinc/92/09/39/567920939.db2.gz SQRALGCTWPGMFB-ZBFHGGJFSA-N 0 3 362.926 4.527 20 0 FJADHN COC(=O)c1ccc(CN[C@H](Cc2ccccc2)c2sccc2C)s1 ZINC000521418758 567971419 /nfs/dbraw/zinc/97/14/19/567971419.db2.gz KDSXDSPWHIXHTE-QGZVFWFLSA-N 0 3 371.527 4.978 20 0 FJADHN Cc1cccn2cc(COc3ccc(CNCc4ccsc4)cc3)nc12 ZINC000063313242 567972888 /nfs/dbraw/zinc/97/28/88/567972888.db2.gz GSYXPPJQTSASPY-UHFFFAOYSA-N 0 3 363.486 4.573 20 0 FJADHN FC(F)Oc1cccc(Cl)c1CNCCc1c[nH]c2ccccc12 ZINC000602902906 568015674 /nfs/dbraw/zinc/01/56/74/568015674.db2.gz VUDDZGZTIBQIQP-UHFFFAOYSA-N 0 3 350.796 4.755 20 0 FJADHN Cc1cc2c(cc1C)[C@H](N[C@@H](C)c1ccc(-n3cncn3)cc1)CCS2 ZINC000186937009 568017659 /nfs/dbraw/zinc/01/76/59/568017659.db2.gz GKAYOEAVJHHQPE-OXJNMPFZSA-N 0 3 364.518 4.772 20 0 FJADHN COCCOc1ccc(CN[C@H]2CCSc3cc(C)c(C)cc32)cc1 ZINC000186998904 568047664 /nfs/dbraw/zinc/04/76/64/568047664.db2.gz KJIIKRSTLSTRRS-FQEVSTJZSA-N 0 3 357.519 4.655 20 0 FJADHN C[C@H](NC1CCN(c2ccccn2)CC1)c1ccc(Cl)cc1Cl ZINC000121369040 568060875 /nfs/dbraw/zinc/06/08/75/568060875.db2.gz GSJBBVONXIAFQY-ZDUSSCGKSA-N 0 3 350.293 4.708 20 0 FJADHN C[C@@H](NC1CCN(c2ccccn2)CC1)c1ccc(Cl)cc1Cl ZINC000121369222 568060898 /nfs/dbraw/zinc/06/08/98/568060898.db2.gz GSJBBVONXIAFQY-CYBMUJFWSA-N 0 3 350.293 4.708 20 0 FJADHN C[C@H](NC(C)(C)CNC(=O)C(C)(C)Cc1ccccc1)c1ccccc1 ZINC000522762516 568075381 /nfs/dbraw/zinc/07/53/81/568075381.db2.gz OUSPGADBQQZZDK-SFHVURJKSA-N 0 3 352.522 4.501 20 0 FJADHN CCc1ccc([C@@H](NC(=O)NCc2cccc(CN(C)C)c2)C(C)C)cc1 ZINC000028399223 568075975 /nfs/dbraw/zinc/07/59/75/568075975.db2.gz JOZDIPYOQXHBMT-QFIPXVFZSA-N 0 3 367.537 4.507 20 0 FJADHN c1c(CN2CCC(C3CC3)CC2)c(-c2cccnc2)nn1-c1ccccc1 ZINC000644836917 568080386 /nfs/dbraw/zinc/08/03/86/568080386.db2.gz LMDSSJFWUUGKAU-UHFFFAOYSA-N 0 3 358.489 4.556 20 0 FJADHN CC[C@H]1CCCCN1CCNC(=O)c1ccccc1SCc1ccco1 ZINC000603473153 568103469 /nfs/dbraw/zinc/10/34/69/568103469.db2.gz DEQPWPVHJOPHCU-KRWDZBQOSA-N 0 3 372.534 4.566 20 0 FJADHN CN(c1ccccc1)c1ccc(CNCCC(=O)Nc2ccccc2)cc1 ZINC000603516770 568111803 /nfs/dbraw/zinc/11/18/03/568111803.db2.gz HYMZUYVFIVKAKX-UHFFFAOYSA-N 0 3 359.473 4.573 20 0 FJADHN COc1ccc(CNCCCc2nc(-c3ccncc3)cs2)c(Cl)c1 ZINC000603517748 568111973 /nfs/dbraw/zinc/11/19/73/568111973.db2.gz QQPQAEVNDMZHJY-UHFFFAOYSA-N 0 3 373.909 4.590 20 0 FJADHN Cc1nc(-c2ccccc2)sc1C(=O)Nc1ccc(C)cc1CN(C)C ZINC000603694833 568136721 /nfs/dbraw/zinc/13/67/21/568136721.db2.gz CEFXKKUSBHDHHH-UHFFFAOYSA-N 0 3 365.502 4.741 20 0 FJADHN CCn1c(CNCCCO[C@H]2CCCc3ccccc32)nc2ccccc21 ZINC000603723647 568142192 /nfs/dbraw/zinc/14/21/92/568142192.db2.gz UCNMHSXWQIYDEK-QFIPXVFZSA-N 0 3 363.505 4.630 20 0 FJADHN C[C@@H](NC(=O)Nc1cccc(CN(C)C)c1)c1ccccc1C(F)(F)F ZINC000056621272 568145398 /nfs/dbraw/zinc/14/53/98/568145398.db2.gz NQCYVOVICYFKQW-CYBMUJFWSA-N 0 3 365.399 4.650 20 0 FJADHN FC(F)(F)c1ccc(-c2nc(CNCCC3CCOCC3)cs2)cc1 ZINC000603949255 568186867 /nfs/dbraw/zinc/18/68/67/568186867.db2.gz JJVCUZDBEKQHCK-UHFFFAOYSA-N 0 3 370.440 4.735 20 0 FJADHN Cc1nc2ccccc2nc1CN1CC=C(c2c[nH]c3ccccc23)CC1 ZINC000604040404 568202923 /nfs/dbraw/zinc/20/29/23/568202923.db2.gz SYXLDTNQUURSAX-UHFFFAOYSA-N 0 3 354.457 4.709 20 0 FJADHN COc1cc(CCNCc2c(Cl)ccc(Cl)c2Cl)ccc1O ZINC000604069317 568205996 /nfs/dbraw/zinc/20/59/96/568205996.db2.gz QSKWNANSGKWZAE-UHFFFAOYSA-N 0 3 360.668 4.693 20 0 FJADHN COc1cc(CCNCc2ccc(-c3ccccc3Cl)o2)ccc1O ZINC000604069295 568206041 /nfs/dbraw/zinc/20/60/41/568206041.db2.gz PPKQWCDLSQPOEF-UHFFFAOYSA-N 0 3 357.837 4.647 20 0 FJADHN c1nc(-c2ccccc2)sc1CNC[C@H]1CCCN1Cc1ccccc1 ZINC000604069717 568206180 /nfs/dbraw/zinc/20/61/80/568206180.db2.gz CPNYFEHGOMONJN-HXUWFJFHSA-N 0 3 363.530 4.564 20 0 FJADHN Cc1cc(F)ccc1-c1ccc(CNC[C@H]2OCCc3ccccc32)o1 ZINC000604416609 568274682 /nfs/dbraw/zinc/27/46/82/568274682.db2.gz OPVKORIWNHODAC-JOCHJYFZSA-N 0 3 351.421 4.798 20 0 FJADHN Cc1cc(F)ccc1-c1ccc(CNC[C@@H]2OCCc3ccccc32)o1 ZINC000604416610 568274827 /nfs/dbraw/zinc/27/48/27/568274827.db2.gz OPVKORIWNHODAC-QFIPXVFZSA-N 0 3 351.421 4.798 20 0 FJADHN CSc1ccc2c(c1)[C@H](N[C@H](C)c1ccc([S@](C)=O)cc1)CCC2 ZINC000563136267 568275296 /nfs/dbraw/zinc/27/52/96/568275296.db2.gz QVIWYKHDHOIOSR-UCWRBECXSA-N 0 3 359.560 4.874 20 0 FJADHN COc1ccc2cc(CNC[C@H](c3c(F)cccc3F)N(C)C)ccc2c1 ZINC000604417306 568275437 /nfs/dbraw/zinc/27/54/37/568275437.db2.gz WOHBBPMLMNQSJX-OAQYLSRUSA-N 0 3 370.443 4.519 20 0 FJADHN CN(C)Cc1cccc(NC(=O)[C@H]2C[C@@H]2c2cccc(C(F)(F)F)c2)c1 ZINC000303438849 568278072 /nfs/dbraw/zinc/27/80/72/568278072.db2.gz HINUEMOARRGRGH-MSOLQXFVSA-N 0 3 362.395 4.509 20 0 FJADHN COc1ccc(CCNCc2ccc(-c3cccc(F)c3C)o2)cc1OC ZINC000604414259 568279139 /nfs/dbraw/zinc/27/91/39/568279139.db2.gz GZEUBGBNTVRTIQ-UHFFFAOYSA-N 0 3 369.436 4.744 20 0 FJADHN C[C@H](c1cccc(Cl)c1)N(C)C(=O)NC[C@H](C)N(C)Cc1ccccc1 ZINC000303460192 568280174 /nfs/dbraw/zinc/28/01/74/568280174.db2.gz LHCDIOCTNHMZOK-DLBZAZTESA-N 0 3 373.928 4.563 20 0 FJADHN CC1(C)CN(CCC(=O)Nc2ccccc2-c2ccccc2)C(C)(C)CO1 ZINC000604389791 568281851 /nfs/dbraw/zinc/28/18/51/568281851.db2.gz UOBUNQANQAFHHQ-UHFFFAOYSA-N 0 3 366.505 4.572 20 0 FJADHN CCOc1ccc(-c2noc(CN3C[C@@H](c4ccccc4)C[C@@H]3C)n2)cc1 ZINC000604392916 568283102 /nfs/dbraw/zinc/28/31/02/568283102.db2.gz KPBVUEVTBNSTDA-LPHOPBHVSA-N 0 3 363.461 4.513 20 0 FJADHN Cc1sc2nc([C@H](C)N3C[C@@H](c4ccccc4)C[C@@H]3C)nc(N)c2c1C ZINC000604393906 568283686 /nfs/dbraw/zinc/28/36/86/568283686.db2.gz QLAQENNSSBCOIA-JDFRZJQESA-N 0 3 366.534 4.829 20 0 FJADHN C[C@@H]1C[C@H](c2ccccc2)CN1Cc1coc(-c2ccc(F)c(F)c2)n1 ZINC000604394103 568284085 /nfs/dbraw/zinc/28/40/85/568284085.db2.gz AYPGDAOOLAETGN-PBHICJAKSA-N 0 3 354.400 4.998 20 0 FJADHN CSCCNCc1cn(-c2ccccc2)nc1-c1ccc(Cl)cc1 ZINC000604477476 568299728 /nfs/dbraw/zinc/29/97/28/568299728.db2.gz VCVIDFRSDLHWHP-UHFFFAOYSA-N 0 3 357.910 4.645 20 0 FJADHN COc1cc(CN(Cc2ccc(F)cc2)CC2CC2)ccc1OC(F)F ZINC000604608431 568326270 /nfs/dbraw/zinc/32/62/70/568326270.db2.gz WZMMUOGEVNWRAR-UHFFFAOYSA-N 0 3 365.395 4.848 20 0 FJADHN CC[C@H](C)c1ccc([C@H](NC(=O)N(C)C[C@H]2CCCN(C)C2)C(C)C)cc1 ZINC000604634359 568333201 /nfs/dbraw/zinc/33/32/01/568333201.db2.gz SCWNASVOBXXCHV-CNNODRBYSA-N 0 3 373.585 4.880 20 0 FJADHN CC(C)c1ccc(C(=O)NC2CCN([C@H](C)c3ccccc3)CC2)cc1 ZINC000604714408 568355434 /nfs/dbraw/zinc/35/54/34/568355434.db2.gz ODPYMKDJTCDCNU-GOSISDBHSA-N 0 3 350.506 4.765 20 0 FJADHN CC(=O)NC1CCN(Cc2ccc(Oc3ccc(Cl)cc3C)cc2)CC1 ZINC000604758726 568360209 /nfs/dbraw/zinc/36/02/09/568360209.db2.gz SCBTXWDDZMWKJF-UHFFFAOYSA-N 0 3 372.896 4.541 20 0 FJADHN O[C@@H]([C@@H](Cc1ccccc1)NCc1csc2ccccc12)C(F)(F)F ZINC000604764904 568361685 /nfs/dbraw/zinc/36/16/85/568361685.db2.gz CAEPKYLDABHXEE-AEFFLSMTSA-N 0 3 365.420 4.525 20 0 FJADHN C[C@@](CO)(NCc1cn(Cc2ccccc2)c2ccccc12)c1ccccc1 ZINC000604765539 568361821 /nfs/dbraw/zinc/36/18/21/568361821.db2.gz VTVLQQWXWQBQAS-VWLOTQADSA-N 0 3 370.496 4.687 20 0 FJADHN C[C@@](CO)(NCc1csc2ccccc12)c1cccc(C(F)(F)F)c1 ZINC000604767405 568362355 /nfs/dbraw/zinc/36/23/55/568362355.db2.gz JTGZKPNKKJZSRV-SFHVURJKSA-N 0 3 365.420 4.917 20 0 FJADHN CC(C)CCC[C@@H](C)NC(=O)NC1CCN([C@@H](C)c2ccccc2)CC1 ZINC000604784441 568366306 /nfs/dbraw/zinc/36/63/06/568366306.db2.gz CFWSGCTYTRBWGX-MOPGFXCFSA-N 0 3 359.558 4.726 20 0 FJADHN CCCc1ccccc1NC(=O)NC1CCN([C@@H](C)c2ccccc2)CC1 ZINC000604795184 568368188 /nfs/dbraw/zinc/36/81/88/568368188.db2.gz HHGWZHZCKKNDIE-SFHVURJKSA-N 0 3 365.521 4.986 20 0 FJADHN Cn1cc([C@H](NCCc2cccc(Cl)c2Cl)c2ccccc2)cn1 ZINC000432693570 568474578 /nfs/dbraw/zinc/47/45/78/568474578.db2.gz PRVDABJTBJVOKK-LJQANCHMSA-N 0 3 360.288 4.649 20 0 FJADHN Brc1ccc(/C=C/CCN2CCC[C@@H](c3ccncn3)C2)cc1 ZINC000604997460 568508118 /nfs/dbraw/zinc/50/81/18/568508118.db2.gz YYEVMSNFSWMRGI-NZURWCHMSA-N 0 3 372.310 4.522 20 0 FJADHN C[C@@H](c1cccc(NC(=O)c2ccccc2)c1)N1CCCOC(C)(C)C1 ZINC000604999676 568512846 /nfs/dbraw/zinc/51/28/46/568512846.db2.gz HVPFZIMVWVZBGS-KRWDZBQOSA-N 0 3 352.478 4.501 20 0 FJADHN CC(C)[C@H]1CCCCN1Cc1nc(-c2ccc(C(F)(F)F)cc2)no1 ZINC000605000333 568513872 /nfs/dbraw/zinc/51/38/72/568513872.db2.gz JEXVHRRJHGYUKR-OAHLLOKOSA-N 0 3 353.388 4.766 20 0 FJADHN CC(=O)N1CCCCC[C@@H]1C1CCN(Cc2cccc(C3CC3)c2)CC1 ZINC000643285447 568527740 /nfs/dbraw/zinc/52/77/40/568527740.db2.gz DYCFMZXEPHUGII-HSZRJFAPSA-N 0 3 354.538 4.567 20 0 FJADHN CN1CCC[C@@H](CNC(=O)CC(C)(C)C)[C@@H]1c1ccc(C(F)(F)F)cc1 ZINC000605103351 568566376 /nfs/dbraw/zinc/56/63/76/568566376.db2.gz RWMCPSBZPPCZBG-YJBOKZPZSA-N 0 3 370.459 4.641 20 0 FJADHN O=C(Nc1cccc(-c2nccs2)c1)c1cccc(CN2CCCC2)c1 ZINC000049978907 568635750 /nfs/dbraw/zinc/63/57/50/568635750.db2.gz SPWHGVWCHVKZCA-UHFFFAOYSA-N 0 3 363.486 4.658 20 0 FJADHN C[C@@H](C(=O)NC[C@H](c1cccs1)N1CCC(C)CC1)c1cccs1 ZINC000606163086 568681527 /nfs/dbraw/zinc/68/15/27/568681527.db2.gz WLZVXBICTRTZEP-HZPDHXFCSA-N 0 3 362.564 4.503 20 0 FJADHN CCCN(C(=O)[C@H](C)c1ccsc1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000606187809 568709085 /nfs/dbraw/zinc/70/90/85/568709085.db2.gz HPUMSUYHBGUFGQ-NQIIRXRSSA-N 0 3 370.562 4.755 20 0 FJADHN CCCN(C(=O)[C@@H](C)c1cccs1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000606189026 568709997 /nfs/dbraw/zinc/70/99/97/568709997.db2.gz YEEVPFXUHLXUQP-AZUAARDMSA-N 0 3 370.562 4.755 20 0 FJADHN Fc1cccc(CN2CC[C@]23CCCN(c2nccc4ccccc42)C3)c1 ZINC001164994921 722193536 /nfs/dbraw/zinc/19/35/36/722193536.db2.gz QSOMAWCAKYZGHC-QHCPKHFHSA-N 0 3 361.464 4.619 20 0 FJADHN Cc1ccccc1NC(=O)[C@@H](C)N[C@H](Cc1ccccc1)c1ccccc1 ZINC000104883093 222362856 /nfs/dbraw/zinc/36/28/56/222362856.db2.gz FNMQRXDQRMEAOD-AUSIDOKSSA-N 0 3 358.485 4.896 20 0 FJADHN C[C@H]1CCc2c(C(=O)N(c3ccccc3)C3CCN(C)CC3)csc2C1 ZINC000601956213 567885541 /nfs/dbraw/zinc/88/55/41/567885541.db2.gz LASOHVXJPXQKKZ-INIZCTEOSA-N 0 3 368.546 4.614 20 0 FJADHN CN1CCC(N(C(=O)c2cc(Cl)sc2Cl)c2ccccc2)CC1 ZINC000601958292 567886241 /nfs/dbraw/zinc/88/62/41/567886241.db2.gz UIYYNAHZLFRCLK-UHFFFAOYSA-N 0 3 369.317 4.796 20 0 FJADHN CN1CCC(N(C(=O)[C@@H]2C[C@@H]2c2cccc(Cl)c2)c2ccccc2)CC1 ZINC000601959406 567886564 /nfs/dbraw/zinc/88/65/64/567886564.db2.gz ZXZYSKDRBVRPJR-NHCUHLMSSA-N 0 3 368.908 4.571 20 0 FJADHN CC[C@H](CC(=O)N(c1ccccc1)C1CCN(C)CC1)c1ccccc1 ZINC000601961282 567887417 /nfs/dbraw/zinc/88/74/17/567887417.db2.gz WZLCMERPVUSIQS-LJQANCHMSA-N 0 3 350.506 4.698 20 0 FJADHN CN1CCC(N(C(=O)c2cc3ccc(F)cc3s2)c2ccccc2)CC1 ZINC000601963853 567888454 /nfs/dbraw/zinc/88/84/54/567888454.db2.gz WUIXAUYYAAUCQO-UHFFFAOYSA-N 0 3 368.477 4.781 20 0 FJADHN Cc1ccc(CCC(=O)N(c2ccccc2)C2CCN(C)CC2)cc1Cl ZINC000601965824 567889028 /nfs/dbraw/zinc/88/90/28/567889028.db2.gz DCGXNEFGNSHVDZ-UHFFFAOYSA-N 0 3 370.924 4.708 20 0 FJADHN Cc1ccc([C@@H](CNC(=O)N2CCCCC[C@H]2c2ccco2)N(C)C)cc1 ZINC000605962016 567942935 /nfs/dbraw/zinc/94/29/35/567942935.db2.gz DNDNMQKHXNIHGF-VQTJNVASSA-N 0 3 369.509 4.518 20 0 FJADHN CCOc1cc2nccc(N3CC[C@H](c4ccco4)C3)c2cc1OCC ZINC000602235849 567958490 /nfs/dbraw/zinc/95/84/90/567958490.db2.gz IZVUITRKAGZSSH-HNNXBMFYSA-N 0 3 352.434 4.619 20 0 FJADHN C[C@H](CCc1ccco1)NCc1nc(-c2ccc(Br)cc2)c[nH]1 ZINC000602274149 567962179 /nfs/dbraw/zinc/96/21/79/567962179.db2.gz MTKWETNFFYDDAQ-CYBMUJFWSA-N 0 3 374.282 4.543 20 0 FJADHN C[C@@H](CCc1ccco1)NCc1nc(-c2ccc(Br)cc2)c[nH]1 ZINC000602274150 567962213 /nfs/dbraw/zinc/96/22/13/567962213.db2.gz MTKWETNFFYDDAQ-ZDUSSCGKSA-N 0 3 374.282 4.543 20 0 FJADHN CCOc1cccc([C@H](C)NCc2ccc(OC(F)F)c(OC)c2)c1 ZINC000063319478 567972971 /nfs/dbraw/zinc/97/29/71/567972971.db2.gz YDRAHIIYEGGQAC-ZDUSSCGKSA-N 0 3 351.393 4.546 20 0 FJADHN C[C@@H](c1ccccc1Cl)N1CCC[C@@H](c2nnc3n2CCCCC3)C1 ZINC000521422191 567989302 /nfs/dbraw/zinc/98/93/02/567989302.db2.gz DXKSCAFZYDGTIO-JKSUJKDBSA-N 0 3 358.917 4.599 20 0 FJADHN COc1ccc(C)cc1NC(=O)[C@H](NCCCC(C)C)c1ccccc1 ZINC000028370754 568006697 /nfs/dbraw/zinc/00/66/97/568006697.db2.gz FGYVNKVKCZCIDU-OAQYLSRUSA-N 0 3 354.494 4.709 20 0 FJADHN Cc1ccccc1[C@H](NCc1ccc(C(N)=O)cc1)C1CCC(C)CC1 ZINC000602912008 568011479 /nfs/dbraw/zinc/01/14/79/568011479.db2.gz WXKIUMMWPDNCHR-ORWMALAUSA-N 0 3 350.506 4.751 20 0 FJADHN Cc1cc2c(cc1C)[C@H](N[C@H](C)c1ccc(-n3cncn3)cc1)CCS2 ZINC000186937043 568017640 /nfs/dbraw/zinc/01/76/40/568017640.db2.gz GKAYOEAVJHHQPE-OXQOHEQNSA-N 0 3 364.518 4.772 20 0 FJADHN CC(C)(CC(=O)NCc1ccccc1CN1CCCCC1)c1ccccc1 ZINC000521428801 568021222 /nfs/dbraw/zinc/02/12/22/568021222.db2.gz VFKXEGJKJYRLCB-UHFFFAOYSA-N 0 3 364.533 4.657 20 0 FJADHN Cc1cc2c(cc1C)[C@H](NCc1ccc(N3CCCC3)nc1)CCS2 ZINC000186986314 568037187 /nfs/dbraw/zinc/03/71/87/568037187.db2.gz LIQWMBTZKSFOLN-LJQANCHMSA-N 0 3 353.535 4.625 20 0 FJADHN Cc1ccc([C@H](CNC(=O)Nc2c(C)cccc2C(C)C)N(C)C)cc1 ZINC000065356991 568049346 /nfs/dbraw/zinc/04/93/46/568049346.db2.gz MYSSFAZWAWMLDG-FQEVSTJZSA-N 0 3 353.510 4.851 20 0 FJADHN C[C@H](NCc1ccc(Br)cc1C(F)(F)F)[C@H]1CC1(F)F ZINC000666445189 568082576 /nfs/dbraw/zinc/08/25/76/568082576.db2.gz QWIWPZJZNLMDSN-WRWORJQWSA-N 0 3 358.148 4.601 20 0 FJADHN CC[C@@H](Cc1ccccc1)N(C)Cc1nnc(-c2ccccc2Cl)o1 ZINC000128617234 568083979 /nfs/dbraw/zinc/08/39/79/568083979.db2.gz ZOCAWOQULLVPIP-INIZCTEOSA-N 0 3 355.869 4.843 20 0 FJADHN CC[C@H](N[C@H]1CCN(c2ccc(C(F)(F)F)cc2)C1=O)c1ccccc1 ZINC000603509833 568110336 /nfs/dbraw/zinc/11/03/36/568110336.db2.gz RJMPZGPEXGFRFN-ROUUACIJSA-N 0 3 362.395 4.552 20 0 FJADHN CC(=O)Nc1ccc(CN[C@H]2CCOc3c(-c4ccccc4)cccc32)cc1 ZINC000603518874 568112666 /nfs/dbraw/zinc/11/26/66/568112666.db2.gz OOAGUCLYKBDWRG-QHCPKHFHSA-N 0 3 372.468 4.925 20 0 FJADHN Cc1ccc(NC(=O)c2csc(-c3ccccc3C)n2)c(CN(C)C)c1 ZINC000603694745 568136723 /nfs/dbraw/zinc/13/67/23/568136723.db2.gz ASRSJKKDWKJRQR-UHFFFAOYSA-N 0 3 365.502 4.741 20 0 FJADHN COc1ccc(C2(NCc3cnc(-c4ccccc4)nc3)CCCC2)cc1 ZINC000603709190 568137666 /nfs/dbraw/zinc/13/76/66/568137666.db2.gz PQXAXGXHDWIJSC-UHFFFAOYSA-N 0 3 359.473 4.711 20 0 FJADHN CN1CCC[C@H](CNC(=O)C2CC3(C2)CCCCC3)[C@H]1c1cccs1 ZINC000669149955 568146463 /nfs/dbraw/zinc/14/64/63/568146463.db2.gz MSKYXNGCPZRZBP-APWZRJJASA-N 0 3 360.567 4.608 20 0 FJADHN Cc1ccc(NC(=O)CCCCCc2ccc(O)cc2)c(CN(C)C)c1 ZINC000603737010 568152826 /nfs/dbraw/zinc/15/28/26/568152826.db2.gz JUPNXQWLPXDNJI-UHFFFAOYSA-N 0 3 354.494 4.504 20 0 FJADHN C[C@@H](NC(C)(C)CNC(=O)Nc1nc2ccsc2s1)c1ccccc1 ZINC000522780563 568157204 /nfs/dbraw/zinc/15/72/04/568157204.db2.gz OUMYADQTVXTISZ-GFCCVEGCSA-N 0 3 374.535 4.609 20 0 FJADHN c1ccc(CN2CCC(c3nc(-c4nccc5ccccc54)no3)CC2)cc1 ZINC000603780735 568166458 /nfs/dbraw/zinc/16/64/58/568166458.db2.gz OUTNOSVEVFSOFX-UHFFFAOYSA-N 0 3 370.456 4.664 20 0 FJADHN CC[C@H]1c2ccccc2CCN1Cc1cccc(C(=O)N2CCCCC2)c1 ZINC000603943688 568185700 /nfs/dbraw/zinc/18/57/00/568185700.db2.gz BZNDQPDVXSURSJ-QHCPKHFHSA-N 0 3 362.517 4.822 20 0 FJADHN COc1ccc(-c2nc(CNCC(C)(C)c3cccs3)cs2)cc1 ZINC000603949607 568186910 /nfs/dbraw/zinc/18/69/10/568186910.db2.gz OJVDUWCLPPESSR-UHFFFAOYSA-N 0 3 358.532 4.948 20 0 FJADHN COc1ccc(CNCCOc2ccccc2C(C)C)c(OC(F)F)c1 ZINC000604066611 568205555 /nfs/dbraw/zinc/20/55/55/568205555.db2.gz VMHMZOVZKONCQG-UHFFFAOYSA-N 0 3 365.420 4.589 20 0 FJADHN C[C@H](NCCc1nc(-c2cccc(Cl)c2)no1)c1ccc(Cl)cc1 ZINC000604067125 568205735 /nfs/dbraw/zinc/20/57/35/568205735.db2.gz UXLWIPGOFRFXHL-LBPRGKRZSA-N 0 3 362.260 4.937 20 0 FJADHN C[C@@H](c1ccccc1)N(C)C(=O)N[C@@H](CN1CCCCC1)c1ccccc1 ZINC000604203712 568227865 /nfs/dbraw/zinc/22/78/65/568227865.db2.gz BPWOKYWDGSVHTA-UGKGYDQZSA-N 0 3 365.521 4.616 20 0 FJADHN C[C@H](c1ccccc1)N(C)C(=O)N[C@H](CN1CCCCC1)c1ccccc1 ZINC000604203709 568227935 /nfs/dbraw/zinc/22/79/35/568227935.db2.gz BPWOKYWDGSVHTA-DENIHFKCSA-N 0 3 365.521 4.616 20 0 FJADHN C[C@H]1CN(C(=O)N[C@@H](CN2CCCCC2)c2ccccc2)c2ccccc21 ZINC000604205072 568228353 /nfs/dbraw/zinc/22/83/53/568228353.db2.gz JJJNAATVYZUEIV-RXVVDRJESA-N 0 3 363.505 4.547 20 0 FJADHN CO[C@H](CNCC1=Cc2cc(Cl)cc(Cl)c2OC1)c1ccccc1 ZINC000303208778 568257593 /nfs/dbraw/zinc/25/75/93/568257593.db2.gz ZSCYPUNYOQPVER-GOSISDBHSA-N 0 3 364.272 4.747 20 0 FJADHN CN(C[C@H]1CCCN(C)C1)C(=O)c1sc2cc(Cl)ccc2c1Cl ZINC000604346941 568264660 /nfs/dbraw/zinc/26/46/60/568264660.db2.gz DYWMCUNKNSFBAS-NSHDSACASA-N 0 3 371.333 4.622 20 0 FJADHN Clc1ccc(-c2ccc(CNCCOC[C@@H]3CCCO3)o2)cc1Cl ZINC000604417279 568275398 /nfs/dbraw/zinc/27/53/98/568275398.db2.gz UPIMCZSSGYKTSL-HNNXBMFYSA-N 0 3 370.276 4.539 20 0 FJADHN COc1ccc2cc(CNC[C@@H](c3c(F)cccc3F)N(C)C)ccc2c1 ZINC000604417305 568275402 /nfs/dbraw/zinc/27/54/02/568275402.db2.gz WOHBBPMLMNQSJX-NRFANRHFSA-N 0 3 370.443 4.519 20 0 FJADHN CC(C)(NCc1ccc(-n2cccn2)cc1)c1ccc(Br)cc1 ZINC000319690262 568279192 /nfs/dbraw/zinc/27/91/92/568279192.db2.gz BOVJBDFHWFFCBL-UHFFFAOYSA-N 0 3 370.294 4.660 20 0 FJADHN Cc1ccc(-c2ncc(CN[C@@H](C)COc3ccc(F)cc3F)s2)cc1 ZINC000604415234 568280389 /nfs/dbraw/zinc/28/03/89/568280389.db2.gz HYFYSLBOQQQAMD-AWEZNQCLSA-N 0 3 374.456 4.954 20 0 FJADHN COc1ccc(CCN(Cc2noc3c2CCCC3)CC(C)(C)C)cc1 ZINC000604389930 568281898 /nfs/dbraw/zinc/28/18/98/568281898.db2.gz LVEXTHYRKDMDOX-UHFFFAOYSA-N 0 3 356.510 4.653 20 0 FJADHN CSCCNCc1cn(-c2ccccc2)nc1-c1cc2ccccc2o1 ZINC000604477454 568299716 /nfs/dbraw/zinc/29/97/16/568299716.db2.gz DEWOJRGWTYRWQB-UHFFFAOYSA-N 0 3 363.486 4.738 20 0 FJADHN CSCCNCc1cn(Cc2ccccc2Cl)nc1-c1ccccc1 ZINC000604478465 568299977 /nfs/dbraw/zinc/29/99/77/568299977.db2.gz DEPFHOKSZZQRON-UHFFFAOYSA-N 0 3 371.937 4.704 20 0 FJADHN Cc1cc(C)c(NC(=O)N2CCN(C3CCC(C)CC3)CC2)c(Cl)c1 ZINC000604610280 568326944 /nfs/dbraw/zinc/32/69/44/568326944.db2.gz RBUGJOXLTPSROI-UHFFFAOYSA-N 0 3 363.933 4.685 20 0 FJADHN C[C@@H](CC(=O)NCc1ccccc1CN1CCCCC1)c1cccc(F)c1 ZINC000604698547 568351567 /nfs/dbraw/zinc/35/15/67/568351567.db2.gz WFPPFZWSXMUYMN-SFHVURJKSA-N 0 3 368.496 4.622 20 0 FJADHN CCSc1ccccc1C(=O)NC1CCN([C@H](C)c2ccccc2)CC1 ZINC000604712613 568355080 /nfs/dbraw/zinc/35/50/80/568355080.db2.gz GEULZZUPCXRKHH-QGZVFWFLSA-N 0 3 368.546 4.754 20 0 FJADHN CCc1ccc([C@@H](C)C(=O)NC2CCN([C@@H](C)c3ccccc3)CC2)cc1 ZINC000604713750 568355156 /nfs/dbraw/zinc/35/51/56/568355156.db2.gz GTYWABDSNDFQPA-MOPGFXCFSA-N 0 3 364.533 4.694 20 0 FJADHN Cc1ccc(CCCC(=O)NC2CCN([C@@H](C)c3ccccc3)CC2)cc1 ZINC000604713930 568355259 /nfs/dbraw/zinc/35/52/59/568355259.db2.gz CBRADQVFLIVPLH-FQEVSTJZSA-N 0 3 364.533 4.660 20 0 FJADHN Cc1nc(C(C)C)sc1C(=O)NC1CCN([C@H](C)c2ccccc2)CC1 ZINC000604714645 568355386 /nfs/dbraw/zinc/35/53/86/568355386.db2.gz YUYYLVCKFKDQGT-MRXNPFEDSA-N 0 3 371.550 4.530 20 0 FJADHN Cc1cc(C)c(CN[C@@](C)(CO)c2cccc(C(F)(F)F)c2)cc1C ZINC000604767066 568362230 /nfs/dbraw/zinc/36/22/30/568362230.db2.gz BZDQBBBYORPJKK-IBGZPJMESA-N 0 3 351.412 4.628 20 0 FJADHN CC(C)NC(=O)[C@H]1CCC[C@@H](NCc2ccc(-c3ccccc3Cl)o2)C1 ZINC000604772939 568363629 /nfs/dbraw/zinc/36/36/29/568363629.db2.gz XCLFLWRPFJQTIL-JKSUJKDBSA-N 0 3 374.912 4.773 20 0 FJADHN C[C@H](c1ccccc1)N1CCC(NC(=O)N2CCC[C@H]2C2CCCC2)CC1 ZINC000604788352 568367041 /nfs/dbraw/zinc/36/70/41/568367041.db2.gz RTGPFMHYZHELDM-GCJKJVERSA-N 0 3 369.553 4.576 20 0 FJADHN CCC(CC)CN(CC)C(=O)NC1CCN([C@H](C)c2ccccc2)CC1 ZINC000604788665 568367105 /nfs/dbraw/zinc/36/71/05/568367105.db2.gz WDVYAVBTCXQGER-GOSISDBHSA-N 0 3 359.558 4.680 20 0 FJADHN CC(C)CN(C(=O)NC1CCN([C@@H](C)c2ccccc2)CC1)C1CCCC1 ZINC000604821960 568370138 /nfs/dbraw/zinc/37/01/38/568370138.db2.gz GIBRYASCSNXSCJ-IBGZPJMESA-N 0 3 371.569 4.822 20 0 FJADHN CC(C)[C@H]1CCCN(C(=O)NC2CCN([C@H](C)c3ccccc3)CC2)CC1 ZINC000604827716 568376716 /nfs/dbraw/zinc/37/67/16/568376716.db2.gz XUXAGZRBKKAHOW-UXHICEINSA-N 0 3 371.569 4.680 20 0 FJADHN Cc1ccc(OC2CCN(CCC(=O)Nc3cccc(Cl)c3)CC2)cc1 ZINC000604885339 568380807 /nfs/dbraw/zinc/38/08/07/568380807.db2.gz GPYBLVULDPUBCN-UHFFFAOYSA-N 0 3 372.896 4.520 20 0 FJADHN C[C@H](N[C@H](Cc1ccccc1)c1cccs1)C(=O)N[C@H]1CCCC[C@@H]1C ZINC000604892084 568381996 /nfs/dbraw/zinc/38/19/96/568381996.db2.gz JGHLUCKTIJNQDE-QGZVKYPTSA-N 0 3 370.562 4.705 20 0 FJADHN CC(C)N(C(=O)[C@H](C)N[C@@H](Cc1ccccc1)c1cccs1)C(C)C ZINC000604892606 568383140 /nfs/dbraw/zinc/38/31/40/568383140.db2.gz YVHFPCZPGKXZCJ-HKUYNNGSSA-N 0 3 358.551 4.655 20 0 FJADHN C[C@H](c1ccccc1)N1CCC(NC(=O)NC(C)(C)c2cccs2)CC1 ZINC000604920713 568390353 /nfs/dbraw/zinc/39/03/53/568390353.db2.gz GVEJLSOTXGCTOC-MRXNPFEDSA-N 0 3 371.550 4.508 20 0 FJADHN CN(C)Cc1ccccc1CNC(=O)CC(c1ccccc1)c1ccccc1 ZINC000006992508 568413028 /nfs/dbraw/zinc/41/30/28/568413028.db2.gz UPLQGWKBFOJWDQ-UHFFFAOYSA-N 0 3 372.512 4.587 20 0 FJADHN Cn1cc([C@@H](NCCc2cccc(Cl)c2Cl)c2ccccc2)cn1 ZINC000432693567 568474670 /nfs/dbraw/zinc/47/46/70/568474670.db2.gz PRVDABJTBJVOKK-IBGZPJMESA-N 0 3 360.288 4.649 20 0 FJADHN CCOc1cc(CNC(C)(C)c2cccc(F)c2)cc(Cl)c1OC ZINC000236910100 568497923 /nfs/dbraw/zinc/49/79/23/568497923.db2.gz KIDANWYPGNTFBW-UHFFFAOYSA-N 0 3 351.849 4.911 20 0 FJADHN Cc1cc(-c2noc([C@H](C)NC[C@@H]3CCc4ccccc4C3)n2)ccc1F ZINC000605007998 568521054 /nfs/dbraw/zinc/52/10/54/568521054.db2.gz PCXOOFWJMSYCJH-JKSUJKDBSA-N 0 3 365.452 4.640 20 0 FJADHN CCCCCC(=O)NC[C@H]1CCCN(C)[C@H]1c1ccc(C(F)(F)F)cc1 ZINC000605102762 568566257 /nfs/dbraw/zinc/56/62/57/568566257.db2.gz LBARDHMTTDSFTJ-APWZRJJASA-N 0 3 370.459 4.785 20 0 FJADHN CC(C)CCC(=O)NC[C@@H]1CCCN(C)[C@H]1c1ccc(C(F)(F)F)cc1 ZINC000605102808 568566295 /nfs/dbraw/zinc/56/62/95/568566295.db2.gz GQJPMMIBNLKDJM-LPHOPBHVSA-N 0 3 370.459 4.641 20 0 FJADHN CC(C)CCC(=O)NC[C@H]1CCCN(C)[C@@H]1c1ccc(C(F)(F)F)cc1 ZINC000605102810 568566330 /nfs/dbraw/zinc/56/63/30/568566330.db2.gz GQJPMMIBNLKDJM-VQIMIIECSA-N 0 3 370.459 4.641 20 0 FJADHN CCN(Cc1ccc(C(=O)Nc2nc3ccsc3s2)cc1)C1CC1 ZINC000605115784 568572399 /nfs/dbraw/zinc/57/23/99/568572399.db2.gz CCSVYSZOPSDDQA-UHFFFAOYSA-N 0 3 357.504 4.594 20 0 FJADHN Cc1ccc(-c2ccc(CNCCc3csc(N4CCCC4)n3)o2)cc1 ZINC000605165042 568593391 /nfs/dbraw/zinc/59/33/91/568593391.db2.gz FOXYVMPCKASKRS-UHFFFAOYSA-N 0 3 367.518 4.644 20 0 FJADHN C[C@@H](Cc1ccc(C(F)(F)F)cc1)C(=O)Nc1cccc(CN(C)C)c1 ZINC000606173113 568705305 /nfs/dbraw/zinc/70/53/05/568705305.db2.gz OOEVTOIHACXQDS-AWEZNQCLSA-N 0 3 364.411 4.584 20 0 FJADHN CN(Cc1ccc(N2CCC3(CCCc4ccccc43)CC2)nc1)C1CC1 ZINC001164386818 718814114 /nfs/dbraw/zinc/81/41/14/718814114.db2.gz AQKBWFYSWMLXPN-UHFFFAOYSA-N 0 3 361.533 4.550 20 0 FJADHN Fc1cccc(CN2CC[C@@]23CCCN(c2nccc4ccccc42)C3)c1 ZINC001164994920 722193861 /nfs/dbraw/zinc/19/38/61/722193861.db2.gz QSOMAWCAKYZGHC-HSZRJFAPSA-N 0 3 361.464 4.619 20 0 FJADHN Fc1cccc(CN2CC[C@@]23CCCN(c2cc4ccccc4cn2)C3)c1 ZINC001164993671 722194940 /nfs/dbraw/zinc/19/49/40/722194940.db2.gz HFGFKSNECLHYRI-HSZRJFAPSA-N 0 3 361.464 4.619 20 0 FJADHN CC(C)c1ccc(N2CCC[C@]3(CCN3Cc3cccc(F)c3)C2)nc1 ZINC001164997296 722201093 /nfs/dbraw/zinc/20/10/93/722201093.db2.gz YTBWWUVBNQHXAF-QFIPXVFZSA-N 0 3 353.485 4.589 20 0 FJADHN Fc1cccc(CN2CC[C@]23CCCN(c2cc4ccsc4cn2)C3)c1 ZINC001164996667 722203363 /nfs/dbraw/zinc/20/33/63/722203363.db2.gz UZNUSRPSGRHLFC-NRFANRHFSA-N 0 3 367.493 4.680 20 0 FJADHN Cc1cc(C)c(NC(=O)NC[C@H](c2ccccc2)N2CCCC2)c(C)c1 ZINC000043150679 567850913 /nfs/dbraw/zinc/85/09/13/567850913.db2.gz UVKDSUDUGDQCEY-HXUWFJFHSA-N 0 3 351.494 4.570 20 0 FJADHN C[C@H](CSc1ccccc1)C(=O)N(c1ccccc1)C1CCN(C)CC1 ZINC000601955412 567885180 /nfs/dbraw/zinc/88/51/80/567885180.db2.gz HZQIFHUBFJGMLZ-GOSISDBHSA-N 0 3 368.546 4.542 20 0 FJADHN CN1CCC(N(C(=O)C[C@H]2CCCc3ccccc32)c2ccccc2)CC1 ZINC000601961106 567887362 /nfs/dbraw/zinc/88/73/62/567887362.db2.gz CUZRIFSCYKMHNP-HXUWFJFHSA-N 0 3 362.517 4.624 20 0 FJADHN CN1CCC(N(C(=O)[C@@H]2C[C@H]2c2ccccc2Cl)c2ccccc2)CC1 ZINC000601963942 567888442 /nfs/dbraw/zinc/88/84/42/567888442.db2.gz YKDFLTFIPRQBSO-VQTJNVASSA-N 0 3 368.908 4.571 20 0 FJADHN CN1CCC(N(C(=O)[C@H]2C[C@@H]2c2ccccc2Cl)c2ccccc2)CC1 ZINC000601963940 567888510 /nfs/dbraw/zinc/88/85/10/567888510.db2.gz YKDFLTFIPRQBSO-UXHICEINSA-N 0 3 368.908 4.571 20 0 FJADHN CN1CCC(N(C(=O)c2cc3c(s2)CCCCC3)c2ccccc2)CC1 ZINC000601967825 567889303 /nfs/dbraw/zinc/88/93/03/567889303.db2.gz LCCOMJKHIYFPHE-UHFFFAOYSA-N 0 3 368.546 4.758 20 0 FJADHN C[C@@H](NCC1CCN(C(=O)C(C)(C)C)CC1)c1cc(Cl)ccc1Cl ZINC000186181866 567890473 /nfs/dbraw/zinc/89/04/73/567890473.db2.gz ZLYRPLRXHHGEMM-CYBMUJFWSA-N 0 3 371.352 4.929 20 0 FJADHN CC(C)n1cc(CN[C@@H](c2ccc(Br)cc2)C2CCC2)cn1 ZINC000602276944 567962490 /nfs/dbraw/zinc/96/24/90/567962490.db2.gz VPDVHVDQFQJTDH-GOSISDBHSA-N 0 3 362.315 4.858 20 0 FJADHN C[C@H](CN[C@H]1CCCOc2cc(Br)ccc21)c1nccs1 ZINC000186753265 567979705 /nfs/dbraw/zinc/97/97/05/567979705.db2.gz QPPUDPHTFGXNIE-RISCZKNCSA-N 0 3 367.312 4.513 20 0 FJADHN CC[C@@H](C)Oc1cccc(NC(=O)c2cccc(CN3CCCC3)c2)c1 ZINC000064027919 567993741 /nfs/dbraw/zinc/99/37/41/567993741.db2.gz METVIFHTMISRMT-QGZVFWFLSA-N 0 3 352.478 4.712 20 0 FJADHN FC(F)Oc1cccc(Cl)c1CNC[C@@H]1CCOc2ccccc21 ZINC000602909559 568010885 /nfs/dbraw/zinc/01/08/85/568010885.db2.gz YSAZLQKSOLFJHJ-LBPRGKRZSA-N 0 3 353.796 4.597 20 0 FJADHN Cc1ccccc1[C@@H](NCc1cnc(N(C)C)nc1)C1CCC(C)CC1 ZINC000602911649 568011337 /nfs/dbraw/zinc/01/13/37/568011337.db2.gz IJAZCQZPXCSQSH-IOYBJCICSA-N 0 3 352.526 4.508 20 0 FJADHN Cc1cc2c(cc1C)[C@@H](N[C@H](C)c1ccc(-n3cncn3)cc1)CCS2 ZINC000186937025 568017632 /nfs/dbraw/zinc/01/76/32/568017632.db2.gz GKAYOEAVJHHQPE-UZLBHIALSA-N 0 3 364.518 4.772 20 0 FJADHN Cc1cc2c(cc1C)[C@@H](NCc1ccnc(N3CCCC3)c1)CCS2 ZINC000186979805 568034269 /nfs/dbraw/zinc/03/42/69/568034269.db2.gz JSPMYCTWNCCJJW-IBGZPJMESA-N 0 3 353.535 4.625 20 0 FJADHN COCCOc1ccc(CN[C@@H]2CCSc3cc(C)c(C)cc32)cc1 ZINC000186998918 568047686 /nfs/dbraw/zinc/04/76/86/568047686.db2.gz KJIIKRSTLSTRRS-HXUWFJFHSA-N 0 3 357.519 4.655 20 0 FJADHN COc1cc(CN[C@H](C)c2cccc(Cl)c2)cc(Br)c1O ZINC000021057882 568073504 /nfs/dbraw/zinc/07/35/04/568073504.db2.gz OEJZWLWNKQDJOX-SNVBAGLBSA-N 0 3 370.674 4.668 20 0 FJADHN COc1cc(CN[C@H](C)c2cccc(OC(F)F)c2)ccc1OC(F)F ZINC000067690204 568080725 /nfs/dbraw/zinc/08/07/25/568080725.db2.gz MVZSPYYEYDDIOS-LLVKDONJSA-N 0 3 373.346 4.749 20 0 FJADHN CCSc1ccccc1C(=O)N(C)C1CCN(Cc2ccccc2)CC1 ZINC000603450967 568099427 /nfs/dbraw/zinc/09/94/27/568099427.db2.gz KIKDQUOGWXKZBM-UHFFFAOYSA-N 0 3 368.546 4.535 20 0 FJADHN Clc1ccc(OCc2nc(CNCC3CCSCC3)cs2)cc1 ZINC000603515127 568111422 /nfs/dbraw/zinc/11/14/22/568111422.db2.gz OSZFSANHLYUFJS-UHFFFAOYSA-N 0 3 368.955 4.608 20 0 FJADHN COc1ccc2[nH]cc(CCNCc3csc(-c4cccs4)n3)c2c1 ZINC000603516164 568111614 /nfs/dbraw/zinc/11/16/14/568111614.db2.gz MNWZWTMSJCVQLD-UHFFFAOYSA-N 0 3 369.515 4.694 20 0 FJADHN COc1ccc(CNC[C@H]2OCCc3ccccc32)cc1OCCC(C)C ZINC000603516459 568111653 /nfs/dbraw/zinc/11/16/53/568111653.db2.gz UJGSSGHTOLYEPR-HSZRJFAPSA-N 0 3 369.505 4.524 20 0 FJADHN Cc1ccc(NC(=O)CSc2ccc(C(C)C)cc2)c(CN(C)C)c1 ZINC000603694835 568136712 /nfs/dbraw/zinc/13/67/12/568136712.db2.gz CLFDUPVZFALTFO-UHFFFAOYSA-N 0 3 356.535 4.911 20 0 FJADHN CCn1c(CNCCCO[C@@H]2CCCc3ccccc32)nc2ccccc21 ZINC000603723646 568142170 /nfs/dbraw/zinc/14/21/70/568142170.db2.gz UCNMHSXWQIYDEK-JOCHJYFZSA-N 0 3 363.505 4.630 20 0 FJADHN C[C@H](c1ccncc1)N(C)CCOc1ccc(OCc2ccccc2)cc1 ZINC000603941832 568185159 /nfs/dbraw/zinc/18/51/59/568185159.db2.gz VNNMBHUKHMJLQU-LJQANCHMSA-N 0 3 362.473 4.732 20 0 FJADHN CC[C@@H]1c2ccccc2CCN1Cc1cccc(C(=O)N2CCCCC2)c1 ZINC000603943687 568185625 /nfs/dbraw/zinc/18/56/25/568185625.db2.gz BZNDQPDVXSURSJ-HSZRJFAPSA-N 0 3 362.517 4.822 20 0 FJADHN CC[C@H]1c2ccccc2CCN1CCC(=O)Nc1cc(Cl)ccc1OC ZINC000603944358 568185801 /nfs/dbraw/zinc/18/58/01/568185801.db2.gz LLYMDFIJXCMWRE-IBGZPJMESA-N 0 3 372.896 4.687 20 0 FJADHN CCSCc1ccc(C(=O)NC[C@@H](c2cccs2)N2CCCC2)cc1 ZINC000603949271 568186856 /nfs/dbraw/zinc/18/68/56/568186856.db2.gz AKVJUWIMBROBKX-SFHVURJKSA-N 0 3 374.575 4.568 20 0 FJADHN FC(F)Oc1c(Cl)cc(Cl)cc1CNCCC1CCOCC1 ZINC000603949276 568186877 /nfs/dbraw/zinc/18/68/77/568186877.db2.gz NFCBGQOHERQDGR-UHFFFAOYSA-N 0 3 354.224 4.501 20 0 FJADHN CC(C)(C)c1ccccc1NC(=O)NC[C@@H]1CCCN1Cc1ccccc1 ZINC000604092314 568211820 /nfs/dbraw/zinc/21/18/20/568211820.db2.gz IOGDHLANTUBBSY-IBGZPJMESA-N 0 3 365.521 4.770 20 0 FJADHN C[C@@H](c1ccccc1)N(C)C(=O)N[C@H](CN1CCCCC1)c1ccccc1 ZINC000604203711 568227867 /nfs/dbraw/zinc/22/78/67/568227867.db2.gz BPWOKYWDGSVHTA-SIKLNZKXSA-N 0 3 365.521 4.616 20 0 FJADHN C[C@H]1CN(C(=O)N[C@H](CN2CCCCC2)c2ccccc2)c2ccccc21 ZINC000604205068 568228341 /nfs/dbraw/zinc/22/83/41/568228341.db2.gz JJJNAATVYZUEIV-GHTZIAJQSA-N 0 3 363.505 4.547 20 0 FJADHN CCN(Cc1ccc(C(=O)N2C[C@@H](c3ccccc3)C[C@@H]2C)cc1)C1CC1 ZINC000604258005 568239080 /nfs/dbraw/zinc/23/90/80/568239080.db2.gz QDSDXVSCVNPCCQ-AVRDEDQJSA-N 0 3 362.517 4.689 20 0 FJADHN COc1ccccc1[C@H]1CCCN1CCC(=O)Nc1ccccc1SC ZINC000303181453 568256110 /nfs/dbraw/zinc/25/61/10/568256110.db2.gz KUCBBLLNWJVWSQ-GOSISDBHSA-N 0 3 370.518 4.583 20 0 FJADHN FC(F)Oc1ccc(CN[C@H]2CCCN(c3ccccc3)C2)cc1Cl ZINC000604416722 568275037 /nfs/dbraw/zinc/27/50/37/568275037.db2.gz BCUUHHASKRECGI-HNNXBMFYSA-N 0 3 366.839 4.700 20 0 FJADHN Clc1ccc(-c2ccc(CNCCOC[C@H]3CCCO3)o2)cc1Cl ZINC000604417280 568275449 /nfs/dbraw/zinc/27/54/49/568275449.db2.gz UPIMCZSSGYKTSL-OAHLLOKOSA-N 0 3 370.276 4.539 20 0 FJADHN Cc1cc(F)ccc1-c1ccc(CNC2CCN(C(=O)C(C)(C)C)CC2)o1 ZINC000604415042 568279995 /nfs/dbraw/zinc/27/99/95/568279995.db2.gz HHQAFHSXXQZJGS-UHFFFAOYSA-N 0 3 372.484 4.521 20 0 FJADHN Cc1ccc(-c2ncc(CNC[C@H](c3ccc(C)cc3)N(C)C)s2)cc1 ZINC000604415450 568280723 /nfs/dbraw/zinc/28/07/23/568280723.db2.gz LJPIIZZLURWYKB-OAQYLSRUSA-N 0 3 365.546 4.819 20 0 FJADHN C[C@H]1C[C@@H](c2ccccc2)CN1Cc1coc(-c2ccc(F)c(F)c2)n1 ZINC000604394105 568283978 /nfs/dbraw/zinc/28/39/78/568283978.db2.gz AYPGDAOOLAETGN-WMLDXEAASA-N 0 3 354.400 4.998 20 0 FJADHN C[C@@H]1C[C@@H](c2ccccc2)CN1Cc1nc(-c2cccc(Cl)c2)no1 ZINC000604394116 568284009 /nfs/dbraw/zinc/28/40/09/568284009.db2.gz BNKMUDOWTAIGKO-RHSMWYFYSA-N 0 3 353.853 4.768 20 0 FJADHN Brc1ccc(-c2nc(CN(CC3CC3)CC3CC3)co2)cc1 ZINC000604395510 568294998 /nfs/dbraw/zinc/29/49/98/568294998.db2.gz PDYNJPURNITQQB-UHFFFAOYSA-N 0 3 361.283 4.726 20 0 FJADHN CSCCNCc1cn(-c2ccccc2)nc1-c1cccc(Cl)c1 ZINC000604477481 568299762 /nfs/dbraw/zinc/29/97/62/568299762.db2.gz XLKJWOGUOJYKIQ-UHFFFAOYSA-N 0 3 357.910 4.645 20 0 FJADHN CC[C@H](C)c1ccc([C@@H](NC(=O)N(C)C[C@H]2CCCN(C)C2)C(C)C)cc1 ZINC000604634360 568333176 /nfs/dbraw/zinc/33/31/76/568333176.db2.gz SCWNASVOBXXCHV-IPJJNNNSSA-N 0 3 373.585 4.880 20 0 FJADHN CC(C)=C[C@@H]1[C@@H](C(=O)NC2CCN([C@H](C)c3ccccc3)CC2)C1(C)C ZINC000604714362 568355374 /nfs/dbraw/zinc/35/53/74/568355374.db2.gz KTJQUZKDTDSYOD-UIFIKXQLSA-N 0 3 354.538 4.567 20 0 FJADHN CC(C)c1ccc(C(=O)NC2CCN([C@@H](C)c3ccccc3)CC2)cc1 ZINC000604714409 568355447 /nfs/dbraw/zinc/35/54/47/568355447.db2.gz ODPYMKDJTCDCNU-SFHVURJKSA-N 0 3 350.506 4.765 20 0 FJADHN COCCOc1cccc(CNC2(c3ccc(Cl)cc3)CCCC2)c1 ZINC000604765964 568361907 /nfs/dbraw/zinc/36/19/07/568361907.db2.gz XOXDJSCPNNVMCM-UHFFFAOYSA-N 0 3 359.897 4.924 20 0 FJADHN Cc1cc(F)ccc1-c1ccc(CN[C@H](CO)[C@@H](C)c2ccccc2)o1 ZINC000604767875 568362457 /nfs/dbraw/zinc/36/24/57/568362457.db2.gz DUGQSBQTTVFMHO-HRAATJIYSA-N 0 3 353.437 4.648 20 0 FJADHN C[C@@H](c1ccccc1)[C@@H](CO)NCc1ccc(-c2ccccc2Cl)o1 ZINC000604767848 568362474 /nfs/dbraw/zinc/36/24/74/568362474.db2.gz DJJUDXRVUAPZLE-MGPUTAFESA-N 0 3 355.865 4.854 20 0 FJADHN C[C@@H](c1ccccc1)[C@@H](CO)NCc1ccc(Cl)c(C(F)(F)F)c1 ZINC000604768530 568362594 /nfs/dbraw/zinc/36/25/94/568362594.db2.gz SBHDDIJTVAAQLC-YVEFUNNKSA-N 0 3 357.803 4.613 20 0 FJADHN CC(C)NC(=O)[C@H]1CCC[C@H](NCc2ccc(-c3ccccc3Cl)o2)C1 ZINC000604772937 568363615 /nfs/dbraw/zinc/36/36/15/568363615.db2.gz XCLFLWRPFJQTIL-HOTGVXAUSA-N 0 3 374.912 4.773 20 0 FJADHN CC[C@@H](Cc1ccc(Cl)cc1)NCc1nccn1Cc1ccccc1 ZINC000604773218 568363646 /nfs/dbraw/zinc/36/36/46/568363646.db2.gz QUFIMRQBLQFXCT-FQEVSTJZSA-N 0 3 353.897 4.696 20 0 FJADHN CN(C)C(=O)[C@@H](NCC1(Sc2ccccc2)CCCC1)c1ccccc1 ZINC000604773758 568363800 /nfs/dbraw/zinc/36/38/00/568363800.db2.gz WQWUOSWOOHMGQV-FQEVSTJZSA-N 0 3 368.546 4.511 20 0 FJADHN C[C@H](CN[C@@H](C(=O)N(C)C)c1ccccc1)c1c(Cl)cccc1Cl ZINC000604773797 568363890 /nfs/dbraw/zinc/36/38/90/568363890.db2.gz YVLRBEIGWPWGJK-FZKQIMNGSA-N 0 3 365.304 4.516 20 0 FJADHN C[C@@H](c1ccccc1)N1CCC(NC(=O)Nc2ccc(Cl)cc2)CC1 ZINC000604774953 568368937 /nfs/dbraw/zinc/36/89/37/568368937.db2.gz NEEZLNWUEDMQRV-HNNXBMFYSA-N 0 3 357.885 4.687 20 0 FJADHN CCCOc1ccc(O[C@H]2CCCC[C@@H]2NCc2cnc(C)s2)cc1 ZINC000604892224 568382008 /nfs/dbraw/zinc/38/20/08/568382008.db2.gz KWWXRLQMBWLEOR-PMACEKPBSA-N 0 3 360.523 4.720 20 0 FJADHN Cc1cccc(NC(=O)[C@@H](C)N[C@H](Cc2ccccc2)c2cccs2)c1 ZINC000604892311 568382116 /nfs/dbraw/zinc/38/21/16/568382116.db2.gz PDXKLRHBBJJNLF-YLJYHZDGSA-N 0 3 364.514 4.957 20 0 FJADHN CCCOc1ccc(O[C@@H]2CCCC[C@H]2NCc2cnc(C)s2)cc1 ZINC000604892227 568382139 /nfs/dbraw/zinc/38/21/39/568382139.db2.gz KWWXRLQMBWLEOR-WOJBJXKFSA-N 0 3 360.523 4.720 20 0 FJADHN CC[C@H](N[C@H](C)C(=O)Nc1ccccc1)c1ccc(Br)cc1 ZINC000007375357 568503511 /nfs/dbraw/zinc/50/35/11/568503511.db2.gz IFZFVNFMCWKCJM-DYVFJYSZSA-N 0 3 361.283 4.517 20 0 FJADHN Cc1ncsc1CN(C)CC/C=C\c1ccc(Br)cc1 ZINC000604998652 568512093 /nfs/dbraw/zinc/51/20/93/568512093.db2.gz NZAMNOXERAHPAF-HYXAFXHYSA-N 0 3 351.313 4.749 20 0 FJADHN CC(C)[C@H]1CCCCN1Cc1nc(-c2cccc(C(F)(F)F)c2)no1 ZINC000605000720 568514369 /nfs/dbraw/zinc/51/43/69/568514369.db2.gz YETJGJCCRIATQI-OAHLLOKOSA-N 0 3 353.388 4.766 20 0 FJADHN CC(C)[C@@H]1CCCCN1Cc1nc(-c2cccc(C(F)(F)F)c2)no1 ZINC000605000719 568514374 /nfs/dbraw/zinc/51/43/74/568514374.db2.gz YETJGJCCRIATQI-HNNXBMFYSA-N 0 3 353.388 4.766 20 0 FJADHN Cc1cc(F)ccc1N1CCC[C@H](NCc2cnc(C(C)(C)C)s2)C1 ZINC000605008985 568516220 /nfs/dbraw/zinc/51/62/20/568516220.db2.gz HOSANDJEVSNNEO-INIZCTEOSA-N 0 3 361.530 4.647 20 0 FJADHN C[C@H](NCC(=O)Nc1ccc(Cl)cc1)C1CCC(C(F)(F)F)CC1 ZINC000433172339 568521112 /nfs/dbraw/zinc/52/11/12/568521112.db2.gz HFMLZXNNUFXQFH-HIFPTAJRSA-N 0 3 362.823 4.625 20 0 FJADHN CO[C@H]1CCCN(Cc2cnn(C3CCCC3)c2-c2ccccc2)CC1 ZINC000643292195 568596288 /nfs/dbraw/zinc/59/62/88/568596288.db2.gz JMNHYNFCQMGSEL-NRFANRHFSA-N 0 3 353.510 4.666 20 0 FJADHN c1nn(C2CCCC2)c(-c2ccccc2)c1CN1CC(C2CCOCC2)C1 ZINC000643293464 568628071 /nfs/dbraw/zinc/62/80/71/568628071.db2.gz GUFVTFRFGGUHNR-UHFFFAOYSA-N 0 3 365.521 4.524 20 0 FJADHN CC(C)(c1ccnc(Cl)c1)N1C[C@H]2CCC[C@@]2(COc2ccccn2)C1 ZINC001164794873 721507520 /nfs/dbraw/zinc/50/75/20/721507520.db2.gz FBBTXZZLLRNZGN-UTKZUKDTSA-N 0 3 371.912 4.546 20 0 FJADHN Cc1sc(CCN[C@H](C)c2cn3ccccc3n2)nc1-c1ccccc1 ZINC000559917283 370702742 /nfs/dbraw/zinc/70/27/42/370702742.db2.gz YKKJHHJCWMVGJJ-OAHLLOKOSA-N 0 3 362.502 4.660 20 0 FJADHN Cc1sc2ncnc(NC[C@@H](c3ccco3)N3CCCCC3)c2c1C ZINC000008063497 204316513 /nfs/dbraw/zinc/31/65/13/204316513.db2.gz QQTOWUWPZNIJEC-HNNXBMFYSA-N 0 3 356.495 4.540 20 0 FJADHN Brc1ccc(CNCc2cccc(Br)c2)s1 ZINC000037985112 205037086 /nfs/dbraw/zinc/03/70/86/205037086.db2.gz GYWUDASFEFSVPE-UHFFFAOYSA-N 0 3 361.102 4.563 20 0 FJADHN CC[C@@H](c1ccc(Cl)cc1)N1CCC(NC(=O)c2ccoc2C)CC1 ZINC000066889870 205366773 /nfs/dbraw/zinc/36/67/73/205366773.db2.gz NZAOHKZIMGMVCQ-IBGZPJMESA-N 0 3 360.885 4.587 20 0 FJADHN CC[C@H](c1ccc(Cl)cc1)N1CCC(NC(=O)c2ccoc2C)CC1 ZINC000066889872 205367626 /nfs/dbraw/zinc/36/76/26/205367626.db2.gz NZAOHKZIMGMVCQ-LJQANCHMSA-N 0 3 360.885 4.587 20 0 FJADHN CCc1cccc(CC)c1NC(=O)NC[C@@H](c1ccc(C)cc1)N(C)C ZINC000109313497 206053293 /nfs/dbraw/zinc/05/32/93/206053293.db2.gz LMZZNTJQUKRTQG-FQEVSTJZSA-N 0 3 353.510 4.544 20 0 FJADHN CC[C@H](c1ccc(Cl)cc1)N1CCC(C(=O)N[C@@H](C)C(C)C)CC1 ZINC000110180498 206071645 /nfs/dbraw/zinc/07/16/45/206071645.db2.gz GAIYTYRIDVPWJC-HNAYVOBHSA-N 0 3 350.934 4.664 20 0 FJADHN CCN(CC)Cc1cccc(NC(=O)c2ccc(Br)s2)c1 ZINC000040217970 211515321 /nfs/dbraw/zinc/51/53/21/211515321.db2.gz DRSZLXWPVBTEOI-UHFFFAOYSA-N 0 3 367.312 4.605 20 0 FJADHN CC(C)(C)c1csc(NC(=O)c2ccc(CN3CCCCC3)cc2)n1 ZINC000025447150 211430712 /nfs/dbraw/zinc/43/07/12/211430712.db2.gz XUYZHLXRLRNZIF-UHFFFAOYSA-N 0 3 357.523 4.679 20 0 FJADHN COCc1cc([C@H](C)NCc2ccc(Br)s2)ccc1OC ZINC000038018370 211353864 /nfs/dbraw/zinc/35/38/64/211353864.db2.gz CHSDTVVRAOZUCB-NSHDSACASA-N 0 3 370.312 4.516 20 0 FJADHN CCOCc1ccccc1CN[C@@H](C)c1ccc(Br)s1 ZINC000038003379 211342707 /nfs/dbraw/zinc/34/27/07/211342707.db2.gz GKFIGXUHTLAMEP-LBPRGKRZSA-N 0 3 354.313 4.898 20 0 FJADHN C[C@@H](N[C@H](C)c1ccc2c(c1)OCCO2)c1ccc(Br)s1 ZINC000038002856 211342211 /nfs/dbraw/zinc/34/22/11/211342211.db2.gz GSCOBBLWKJXZBU-GHMZBOCLSA-N 0 3 368.296 4.694 20 0 FJADHN Cc1c2cccc(F)c2oc1C(=O)N(c1ccccc1)C1CCN(C)CC1 ZINC000601957368 567886024 /nfs/dbraw/zinc/88/60/24/567886024.db2.gz OVSYVDUPGPBWOR-UHFFFAOYSA-N 0 3 366.436 4.621 20 0 FJADHN CN1CCC(N(C(=O)c2cc3cc(Cl)ccc3o2)c2ccccc2)CC1 ZINC000601959273 567886547 /nfs/dbraw/zinc/88/65/47/567886547.db2.gz WXCUFOGYEAVMDG-UHFFFAOYSA-N 0 3 368.864 4.827 20 0 FJADHN CN1CCC(N(C(=O)[C@@H]2C[C@H]2c2cccc(Cl)c2)c2ccccc2)CC1 ZINC000601959405 567886592 /nfs/dbraw/zinc/88/65/92/567886592.db2.gz ZXZYSKDRBVRPJR-LEWJYISDSA-N 0 3 368.908 4.571 20 0 FJADHN CC[C@H](Cc1ccccc1)C(=O)NCc1ccccc1CN1CCCCC1 ZINC000601947442 567892103 /nfs/dbraw/zinc/89/21/03/567892103.db2.gz YEWWQWJMUIWVRN-OAQYLSRUSA-N 0 3 364.533 4.558 20 0 FJADHN CC[C@@H](Cc1ccccc1)C(=O)NC[C@H](c1ccsc1)N(CC)CC ZINC000602093029 567932610 /nfs/dbraw/zinc/93/26/10/567932610.db2.gz GQBZHWHEIHNSFN-AZUAARDMSA-N 0 3 358.551 4.516 20 0 FJADHN CCOc1cc2nccc(N3CC[C@@H](c4ccco4)C3)c2cc1OCC ZINC000602235851 567958467 /nfs/dbraw/zinc/95/84/67/567958467.db2.gz IZVUITRKAGZSSH-OAHLLOKOSA-N 0 3 352.434 4.619 20 0 FJADHN CCOc1ccc([C@H]2CCCN2CCC(=O)Nc2ccccc2Cl)cc1 ZINC000021314996 567965979 /nfs/dbraw/zinc/96/59/79/567965979.db2.gz RKFLCCJGLCDNKN-HXUWFJFHSA-N 0 3 372.896 4.904 20 0 FJADHN CCOc1cccc([C@@H](C)NCc2ccc(F)c(Br)c2)c1 ZINC000063319440 567972946 /nfs/dbraw/zinc/97/29/46/567972946.db2.gz JEOFEZLGEQDOHU-GFCCVEGCSA-N 0 3 352.247 4.838 20 0 FJADHN CC(C)NC(=O)Nc1ccc([C@@H](C)N[C@@H](C)c2ccc(F)c(F)c2)cc1 ZINC000602570263 567995987 /nfs/dbraw/zinc/99/59/87/567995987.db2.gz SOPKELKTYMTZRJ-KGLIPLIRSA-N 0 3 361.436 4.907 20 0 FJADHN COc1cc(CN[C@@H]2CCSc3cc(C)c(C)cc32)cc(OC)c1OC ZINC000186945636 568020875 /nfs/dbraw/zinc/02/08/75/568020875.db2.gz YZFFOYQOFUDXLI-QGZVFWFLSA-N 0 3 373.518 4.656 20 0 FJADHN Cc1nc(COc2ccc(CNC(C)(C)c3ccc(Cl)cc3)cc2)no1 ZINC000067011133 568073018 /nfs/dbraw/zinc/07/30/18/568073018.db2.gz KUHMMLUCXLENHK-UHFFFAOYSA-N 0 3 371.868 4.635 20 0 FJADHN Cc1ccc(-c2ccc(CN[C@@H]3CCCc4[nH]c(=O)ccc43)s2)cc1 ZINC000067504101 568076265 /nfs/dbraw/zinc/07/62/65/568076265.db2.gz NOELPUGZEZZTQR-GOSISDBHSA-N 0 3 350.487 4.579 20 0 FJADHN O=c1ccc2c([nH]1)CCC[C@H]2NCc1ccc(-c2ccc(Cl)cc2)s1 ZINC000067504259 568076307 /nfs/dbraw/zinc/07/63/07/568076307.db2.gz WIJAMJVCRQZFBC-QGZVFWFLSA-N 0 3 370.905 4.924 20 0 FJADHN C[C@@H](NCc1ccc(Br)cc1C(F)(F)F)[C@@H]1CC1(F)F ZINC000666445187 568082572 /nfs/dbraw/zinc/08/25/72/568082572.db2.gz QWIWPZJZNLMDSN-HQJQHLMTSA-N 0 3 358.148 4.601 20 0 FJADHN CCN1CCC(N(C)c2ncnc3scc(-c4ccc(C)cc4)c32)CC1 ZINC000603394147 568095301 /nfs/dbraw/zinc/09/53/01/568095301.db2.gz LCUZHVYKHCKAOR-UHFFFAOYSA-N 0 3 366.534 4.587 20 0 FJADHN C[C@@H]1C[C@]2(CCO1)CN(Cc1cccc(-c3ccccc3)c1)C[C@H](C)O2 ZINC000430780137 568104869 /nfs/dbraw/zinc/10/48/69/568104869.db2.gz JJZATIIJGSSZNC-SELNLUPBSA-N 0 3 351.490 4.512 20 0 FJADHN CC[C@@H](N[C@H]1CCN(c2ccc(C(F)(F)F)cc2)C1=O)c1ccccc1 ZINC000603509831 568110332 /nfs/dbraw/zinc/11/03/32/568110332.db2.gz RJMPZGPEXGFRFN-MSOLQXFVSA-N 0 3 362.395 4.552 20 0 FJADHN CC[C@@H](N[C@@H](C)c1ccc(S(C)(=O)=O)cc1)c1ccc(Cl)cc1 ZINC000121748024 568110420 /nfs/dbraw/zinc/11/04/20/568110420.db2.gz KIWHZSOCEVSBSO-SCLBCKFNSA-N 0 3 351.899 4.545 20 0 FJADHN CCC[C@@H](NCc1ccc(CC(N)=O)cc1)c1ccc(Cl)c(Cl)c1 ZINC000603516566 568111689 /nfs/dbraw/zinc/11/16/89/568111689.db2.gz IKANHSFHKYRXLM-GOSISDBHSA-N 0 3 365.304 4.652 20 0 FJADHN C[C@@H](NCc1ccc(N(C)c2ccccc2)cc1)c1ccc(NC(N)=O)cc1 ZINC000603516721 568111745 /nfs/dbraw/zinc/11/17/45/568111745.db2.gz DRAAQXNURSFQFC-QGZVFWFLSA-N 0 3 374.488 4.796 20 0 FJADHN CCOC(=O)CCCCCN1CCc2sccc2[C@H]1c1cccs1 ZINC000522775896 568132074 /nfs/dbraw/zinc/13/20/74/568132074.db2.gz KVPIPUJZNWFEDC-IBGZPJMESA-N 0 3 363.548 4.881 20 0 FJADHN Cc1ccc(NC(=O)c2ccc(OCc3ccccc3)cc2)c(CN(C)C)c1 ZINC000603694830 568136708 /nfs/dbraw/zinc/13/67/08/568136708.db2.gz AWTBMXQXFILBID-UHFFFAOYSA-N 0 3 374.484 4.888 20 0 FJADHN CC[C@@H](CC1CCCC1)C(=O)NC[C@H]1CCCN(Cc2ccccc2)C1 ZINC000603863128 568172160 /nfs/dbraw/zinc/17/21/60/568172160.db2.gz RFTABFOIVLBJIE-YADHBBJMSA-N 0 3 356.554 4.621 20 0 FJADHN C[C@@H](c1ccncc1)N(C)CCOc1ccc(OCc2ccccc2)cc1 ZINC000603941831 568185155 /nfs/dbraw/zinc/18/51/55/568185155.db2.gz VNNMBHUKHMJLQU-IBGZPJMESA-N 0 3 362.473 4.732 20 0 FJADHN CC[C@@H](c1ccccc1)N(Cc1nc(-c2ccccn2)no1)CC(C)C ZINC000604048360 568201124 /nfs/dbraw/zinc/20/11/24/568201124.db2.gz MIKKIDYAFHXFKS-IBGZPJMESA-N 0 3 350.466 4.741 20 0 FJADHN CCOC(=O)C[C@H](c1ccccc1)C1CCN([C@H](C)c2cccnc2)CC1 ZINC000604124462 568214002 /nfs/dbraw/zinc/21/40/02/568214002.db2.gz FWHKZLFATBQPSF-XMSQKQJNSA-N 0 3 366.505 4.592 20 0 FJADHN CCN(Cc1cccs1)C(=O)N[C@@H](CN1CCCCC1)c1ccccc1 ZINC000604207024 568225610 /nfs/dbraw/zinc/22/56/10/568225610.db2.gz XQLANMRSWWROAV-FQEVSTJZSA-N 0 3 371.550 4.507 20 0 FJADHN CC(C)(C)Oc1ccccc1NC(=O)C1CCN(Cc2ccccc2)CC1 ZINC000604302869 568242646 /nfs/dbraw/zinc/24/26/46/568242646.db2.gz WRVRTNHVQMEZIM-UHFFFAOYSA-N 0 3 366.505 4.715 20 0 FJADHN CC(=O)Nc1cccc(CN(Cc2ccc3c(c2)CCO3)C2CCCC2)c1 ZINC000303218139 568258636 /nfs/dbraw/zinc/25/86/36/568258636.db2.gz UDYANEKIWRXSML-UHFFFAOYSA-N 0 3 364.489 4.525 20 0 FJADHN CN(C[C@@H]1CCCN(C)C1)C(=O)c1ccc(Oc2cccc(Cl)c2)cc1 ZINC000604346737 568264445 /nfs/dbraw/zinc/26/44/45/568264445.db2.gz MNHNIYQORITMSO-MRXNPFEDSA-N 0 3 372.896 4.546 20 0 FJADHN C[C@@H]1CCC[C@@H](N(C)CC(=O)N[C@H](c2cccs2)c2ccc(F)cc2)C1 ZINC000026474471 568266832 /nfs/dbraw/zinc/26/68/32/568266832.db2.gz WQTZXGMUEIKVMN-FPDPHYFHSA-N 0 3 374.525 4.603 20 0 FJADHN Cc1[nH]c2c(cccc2C(=O)NCC(C)(C)N[C@@H](C)c2ccccc2)c1C ZINC000303348287 568267053 /nfs/dbraw/zinc/26/70/53/568267053.db2.gz FIJKCXJKLWUUHE-KRWDZBQOSA-N 0 3 363.505 4.644 20 0 FJADHN Cc1ccc(-c2ncc(CN[C@@H]3CCCN(c4ccccc4)C3)s2)cc1 ZINC000604417174 568275364 /nfs/dbraw/zinc/27/53/64/568275364.db2.gz KIHZLOPYDCLZDU-LJQANCHMSA-N 0 3 363.530 4.877 20 0 FJADHN Cc1c(F)cccc1-c1ccc(CNCCCn2cnc3ccccc32)o1 ZINC000604414613 568279334 /nfs/dbraw/zinc/27/93/34/568279334.db2.gz CMVYYNQMQKRPFT-UHFFFAOYSA-N 0 3 363.436 4.924 20 0 FJADHN CCOc1ccc(-c2noc(CN3C[C@H](c4ccccc4)C[C@@H]3C)n2)cc1 ZINC000604392917 568283099 /nfs/dbraw/zinc/28/30/99/568283099.db2.gz KPBVUEVTBNSTDA-QFBILLFUSA-N 0 3 363.461 4.513 20 0 FJADHN CCOc1ccc(-c2noc(CN3C[C@@H](c4ccccc4)C[C@H]3C)n2)cc1 ZINC000604392915 568283114 /nfs/dbraw/zinc/28/31/14/568283114.db2.gz KPBVUEVTBNSTDA-APWZRJJASA-N 0 3 363.461 4.513 20 0 FJADHN Cc1sc2nc([C@H](C)N3C[C@H](c4ccccc4)C[C@H]3C)nc(N)c2c1C ZINC000604393904 568283757 /nfs/dbraw/zinc/28/37/57/568283757.db2.gz QLAQENNSSBCOIA-HACGYAERSA-N 0 3 366.534 4.829 20 0 FJADHN C[C@H]1C[C@@H](c2ccccc2)CN1Cc1nc(-c2cccc(Cl)c2)no1 ZINC000604394117 568283997 /nfs/dbraw/zinc/28/39/97/568283997.db2.gz BNKMUDOWTAIGKO-WMLDXEAASA-N 0 3 353.853 4.768 20 0 FJADHN COC(=O)c1cccc(CN(C)[C@@H](C)c2ccc(C(F)(F)F)cc2)c1 ZINC000604492989 568303762 /nfs/dbraw/zinc/30/37/62/568303762.db2.gz UVKKFDPQUWDFMA-ZDUSSCGKSA-N 0 3 351.368 4.685 20 0 FJADHN Cc1ccc(CN2CCCC2)cc1NC(=O)c1ccsc1C(F)(F)F ZINC000637026257 568309356 /nfs/dbraw/zinc/30/93/56/568309356.db2.gz CABHLLSZRQTFRC-UHFFFAOYSA-N 0 3 368.424 4.923 20 0 FJADHN CC(C)[C@@H](NC(=O)NCc1ccc(CN(C)C)cc1)c1ccccc1Cl ZINC000604575928 568315752 /nfs/dbraw/zinc/31/57/52/568315752.db2.gz YRJGLBIOXQEDLX-HXUWFJFHSA-N 0 3 373.928 4.598 20 0 FJADHN CCN(CC)Cc1cccc(NC(=O)[C@H]2C[C@@H]2c2c(F)cccc2F)c1 ZINC000604699768 568347567 /nfs/dbraw/zinc/34/75/67/568347567.db2.gz HGHLYFJDXYRKBR-IRXDYDNUSA-N 0 3 358.432 4.549 20 0 FJADHN C[C@H](CC(=O)NC1CCN([C@@H](C)c2ccccc2)CC1)c1ccccc1 ZINC000604714497 568355427 /nfs/dbraw/zinc/35/54/27/568355427.db2.gz WSKHQRLDWCCGCB-MOPGFXCFSA-N 0 3 350.506 4.522 20 0 FJADHN C[C@@H](NC(C)(C)CNC(=O)C[C@H](C)c1cccc(F)c1)c1ccccc1 ZINC000604744929 568356074 /nfs/dbraw/zinc/35/60/74/568356074.db2.gz TUNGBVDRKTUNDC-DLBZAZTESA-N 0 3 356.485 4.565 20 0 FJADHN Cc1ccccc1CN1CCCN(C(=O)C[C@@H](C)c2ccccc2C)CC1 ZINC000604741494 568359677 /nfs/dbraw/zinc/35/96/77/568359677.db2.gz YKAFKSHYWZDQHI-OAQYLSRUSA-N 0 3 364.533 4.532 20 0 FJADHN Cc1cc(Cl)ccc1Oc1ccc(CN2CCC(CC(N)=O)CC2)cc1 ZINC000604758458 568360128 /nfs/dbraw/zinc/36/01/28/568360128.db2.gz SPHSGTLJZZPYPY-UHFFFAOYSA-N 0 3 372.896 4.528 20 0 FJADHN C[C@H](c1ccccc1)[C@H](CO)NCc1ccc(Cl)c(C(F)(F)F)c1 ZINC000604768527 568362554 /nfs/dbraw/zinc/36/25/54/568362554.db2.gz SBHDDIJTVAAQLC-PXAZEXFGSA-N 0 3 357.803 4.613 20 0 FJADHN CC[C@@H](Cc1ccc(Cl)cc1)NCc1ccc(Br)cn1 ZINC000604773088 568363658 /nfs/dbraw/zinc/36/36/58/568363658.db2.gz KNBJTSFHSVDRLO-HNNXBMFYSA-N 0 3 353.691 4.608 20 0 FJADHN Cc1cc(Cl)ccc1NC(=O)NC1CCN([C@H](C)c2ccccc2)CC1 ZINC000604792319 568367736 /nfs/dbraw/zinc/36/77/36/568367736.db2.gz SWSWGMDHZHOOQZ-MRXNPFEDSA-N 0 3 371.912 4.996 20 0 FJADHN CCC[C@H](C(=O)Nc1ccc(OCCN(C)C)c(Cl)c1)c1ccccc1 ZINC000604874113 568382626 /nfs/dbraw/zinc/38/26/26/568382626.db2.gz PENLCVZZMLHFLU-SFHVURJKSA-N 0 3 374.912 4.803 20 0 FJADHN Cc1cc(OCc2ccccc2)ccc1NC(=O)c1ccc(CN(C)C)cc1 ZINC000604944845 568403201 /nfs/dbraw/zinc/40/32/01/568403201.db2.gz FMLQPOWPKSRTGE-UHFFFAOYSA-N 0 3 374.484 4.888 20 0 FJADHN Cc1ncc(CN(C)CC/C=C/c2ccc(Br)cc2)s1 ZINC000604997316 568507874 /nfs/dbraw/zinc/50/78/74/568507874.db2.gz KEFVNRXXYAUPIE-HWKANZROSA-N 0 3 351.313 4.749 20 0 FJADHN CCc1ccc(CN2CCC(c3c(OC)cc(OC)cc3OC)CC2)cc1 ZINC000604997173 568507916 /nfs/dbraw/zinc/50/79/16/568507916.db2.gz VUKNGVTWKNIAQC-UHFFFAOYSA-N 0 3 369.505 4.654 20 0 FJADHN Brc1ccc(/C=C\CCN2CCC[C@H](c3ccncn3)C2)cc1 ZINC000604997459 568508085 /nfs/dbraw/zinc/50/80/85/568508085.db2.gz YYEVMSNFSWMRGI-DVZSUYKVSA-N 0 3 372.310 4.522 20 0 FJADHN C[C@@H](NCC(=O)Nc1ccc(Cl)cc1)C1CCC(C(F)(F)F)CC1 ZINC000433172341 568521115 /nfs/dbraw/zinc/52/11/15/568521115.db2.gz HFMLZXNNUFXQFH-PNESKVBLSA-N 0 3 362.823 4.625 20 0 FJADHN Cc1cc(-c2noc([C@@H](C)NC[C@@H]3CCc4ccccc4C3)n2)ccc1F ZINC000605007997 568521118 /nfs/dbraw/zinc/52/11/18/568521118.db2.gz PCXOOFWJMSYCJH-HZPDHXFCSA-N 0 3 365.452 4.640 20 0 FJADHN CCOC1CCN(Cc2cnn(C3CCCC3)c2-c2ccccc2)CC1 ZINC000643284545 568525716 /nfs/dbraw/zinc/52/57/16/568525716.db2.gz IPCKGSIWXPAOHU-UHFFFAOYSA-N 0 3 353.510 4.666 20 0 FJADHN CCCCOc1ccc(-c2nnc(CN3CCCC[C@@H]3C(C)C)o2)cc1 ZINC000605026145 568531064 /nfs/dbraw/zinc/53/10/64/568531064.db2.gz CUIWQUHQWPRQLT-LJQANCHMSA-N 0 3 357.498 4.926 20 0 FJADHN CCCCCC(=O)NC[C@@H]1CCCN(C)[C@H]1c1ccc(C(F)(F)F)cc1 ZINC000605102763 568566280 /nfs/dbraw/zinc/56/62/80/568566280.db2.gz LBARDHMTTDSFTJ-LPHOPBHVSA-N 0 3 370.459 4.785 20 0 FJADHN CCCCCC(=O)NC[C@@H]1CCCN(C)[C@@H]1c1ccc(C(F)(F)F)cc1 ZINC000605102764 568566321 /nfs/dbraw/zinc/56/63/21/568566321.db2.gz LBARDHMTTDSFTJ-QFBILLFUSA-N 0 3 370.459 4.785 20 0 FJADHN C[C@@](CO)(NCc1cccc2ccccc21)c1cccc(C(F)(F)F)c1 ZINC000605151938 568580639 /nfs/dbraw/zinc/58/06/39/568580639.db2.gz JADSHCGZQRMZAV-FQEVSTJZSA-N 0 3 359.391 4.856 20 0 FJADHN c1csc(-c2noc(CCCN3CCS[C@H](c4ccccc4)C3)n2)c1 ZINC000605155670 568600778 /nfs/dbraw/zinc/60/07/78/568600778.db2.gz XKGYZIVQWMREHH-KRWDZBQOSA-N 0 3 371.531 4.521 20 0 FJADHN O=C(Nc1ccc2oc(C3CC3)nc2c1)c1cccc(CN2CCCC2)c1 ZINC000050029405 568664245 /nfs/dbraw/zinc/66/42/45/568664245.db2.gz XBGWZEHQNVPTFX-UHFFFAOYSA-N 0 3 361.445 4.553 20 0 FJADHN CC(C)(c1ccnc(Cl)c1)N1C[C@@H]2CCC[C@@]2(COc2ccccn2)C1 ZINC001164794876 721507900 /nfs/dbraw/zinc/50/79/00/721507900.db2.gz FBBTXZZLLRNZGN-UWJYYQICSA-N 0 3 371.912 4.546 20 0 FJADHN Fc1cccc(CN2CC[C@]23CCCN(c2cc4ccccc4cn2)C3)c1 ZINC001164993672 722194741 /nfs/dbraw/zinc/19/47/41/722194741.db2.gz HFGFKSNECLHYRI-QHCPKHFHSA-N 0 3 361.464 4.619 20 0 FJADHN Cc1sc(CCN[C@@H](C)c2cn3ccccc3n2)nc1-c1ccccc1 ZINC000559917282 370703105 /nfs/dbraw/zinc/70/31/05/370703105.db2.gz YKKJHHJCWMVGJJ-HNNXBMFYSA-N 0 3 362.502 4.660 20 0 FJADHN CCN(CC)Cc1cccc(NC(=O)c2cc(C(C)C)n(C(C)(C)C)n2)c1 ZINC000107857135 206025230 /nfs/dbraw/zinc/02/52/30/206025230.db2.gz ZBXORRBDMGQHIL-UHFFFAOYSA-N 0 3 370.541 4.856 20 0 FJADHN C[C@@H](NC[C@@H](c1ccco1)N1CCCC1)c1ccc(Br)s1 ZINC000038001887 211345012 /nfs/dbraw/zinc/34/50/12/211345012.db2.gz BUOUJAZYSGUTQM-OLZOCXBDSA-N 0 3 369.328 4.591 20 0 FJADHN Cc1nc2ccccc2n1CCN[C@H](C)c1ccc(Br)s1 ZINC000038002082 211343448 /nfs/dbraw/zinc/34/34/48/211343448.db2.gz UIPZADSPCLXOKE-LLVKDONJSA-N 0 3 364.312 4.520 20 0 FJADHN FC(F)(F)Oc1ccc(CNCc2ccc(Br)s2)cc1 ZINC000037979576 211332863 /nfs/dbraw/zinc/33/28/63/211332863.db2.gz NACNNYFKTDEFAA-UHFFFAOYSA-N 0 3 366.202 4.699 20 0 FJADHN C[C@@H](N[C@@H](C)c1ccc(Br)s1)c1ccc2c(c1)OCO2 ZINC000038002654 211339954 /nfs/dbraw/zinc/33/99/54/211339954.db2.gz VDFZQCIUVYKJBD-ZJUUUORDSA-N 0 3 354.269 4.651 20 0 FJADHN CN1CCC(N(C(=O)C[C@@H]2CCCc3ccccc32)c2ccccc2)CC1 ZINC000601961103 567887288 /nfs/dbraw/zinc/88/72/88/567887288.db2.gz CUZRIFSCYKMHNP-FQEVSTJZSA-N 0 3 362.517 4.624 20 0 FJADHN CCCCc1ccc(CC(=O)N(c2ccccc2)C2CCN(C)CC2)cc1 ZINC000601961942 567887712 /nfs/dbraw/zinc/88/77/12/567887712.db2.gz JNWWKHAFWSJGLY-UHFFFAOYSA-N 0 3 364.533 4.699 20 0 FJADHN COc1cc2ccccc2cc1C(=O)N(c1ccccc1)C1CCN(C)CC1 ZINC000601962584 567887900 /nfs/dbraw/zinc/88/79/00/567887900.db2.gz NXONESSFUCWSQN-UHFFFAOYSA-N 0 3 374.484 4.589 20 0 FJADHN CN1CCC(N(C(=O)[C@@H]2C[C@@H]2c2ccccc2Cl)c2ccccc2)CC1 ZINC000601963943 567888559 /nfs/dbraw/zinc/88/85/59/567888559.db2.gz YKDFLTFIPRQBSO-WOJBJXKFSA-N 0 3 368.908 4.571 20 0 FJADHN CCOc1cccc([C@H](C)NCc2ccc(OCc3ccccn3)cc2)c1 ZINC000063319366 567972951 /nfs/dbraw/zinc/97/29/51/567972951.db2.gz TZNURKNILLZZCI-SFHVURJKSA-N 0 3 362.473 4.910 20 0 FJADHN C[C@H](N[C@H]1CCc2nc(-c3ccccc3)ncc2C1)c1cc(F)ccc1F ZINC000602584079 567994118 /nfs/dbraw/zinc/99/41/18/567994118.db2.gz CSTSNBQHHBNVPO-KSSFIOAISA-N 0 3 365.427 4.630 20 0 FJADHN Cc1oc(-c2ccccc2)nc1CN1CCC[C@H]1Cc1cccc(F)c1 ZINC000521424442 567995013 /nfs/dbraw/zinc/99/50/13/567995013.db2.gz DCFYSXGIHCITPT-FQEVSTJZSA-N 0 3 350.437 4.996 20 0 FJADHN c1ccc(CN2CCC[C@@H](SCc3nnc(-c4ccccc4)o3)C2)cc1 ZINC000521435106 568003907 /nfs/dbraw/zinc/00/39/07/568003907.db2.gz OVRWQNQJNJZQKR-LJQANCHMSA-N 0 3 365.502 4.634 20 0 FJADHN Cc1csc(CCCCNCc2c(Cl)cccc2OC(F)F)n1 ZINC000602910944 568011158 /nfs/dbraw/zinc/01/11/58/568011158.db2.gz PAYKXJYXQLVFEB-UHFFFAOYSA-N 0 3 360.857 4.819 20 0 FJADHN CC1(CNCc2c(Cl)cccc2OCc2ccccc2Cl)COC1 ZINC000602915071 568011958 /nfs/dbraw/zinc/01/19/58/568011958.db2.gz DGXVFGOMHJKDKZ-UHFFFAOYSA-N 0 3 366.288 4.699 20 0 FJADHN Cc1cc2c(cc1C)[C@H](NCc1ccnc(N3CCCC3)c1)CCS2 ZINC000186979824 568034296 /nfs/dbraw/zinc/03/42/96/568034296.db2.gz JSPMYCTWNCCJJW-LJQANCHMSA-N 0 3 353.535 4.625 20 0 FJADHN CC(=O)Nc1ccc(CNC(C)(C)c2cccc(C(F)(F)F)c2)cc1 ZINC000067011477 568073135 /nfs/dbraw/zinc/07/31/35/568073135.db2.gz LHEYQZUFNRFGHG-UHFFFAOYSA-N 0 3 350.384 4.689 20 0 FJADHN CC(=O)Nc1ccc(CN[C@@H]2CCOc3c(-c4ccccc4)cccc32)cc1 ZINC000603518873 568112659 /nfs/dbraw/zinc/11/26/59/568112659.db2.gz OOAGUCLYKBDWRG-HSZRJFAPSA-N 0 3 372.468 4.925 20 0 FJADHN Cc1ccc(NC(=O)CCCOc2ccc(Cl)cc2)c(CN(C)C)c1 ZINC000603694529 568136757 /nfs/dbraw/zinc/13/67/57/568136757.db2.gz CGSMXMURFOBUOF-UHFFFAOYSA-N 0 3 360.885 4.508 20 0 FJADHN Cc1ccc(NC(=O)CCSc2ccc(Cl)cc2)c(CN(C)C)c1 ZINC000603695190 568136788 /nfs/dbraw/zinc/13/67/88/568136788.db2.gz PAWXZOVXDFFWSR-UHFFFAOYSA-N 0 3 362.926 4.831 20 0 FJADHN c1ccc(-c2ncc(CNCCCO[C@H]3CCCc4ccccc43)cn2)cc1 ZINC000603723584 568142240 /nfs/dbraw/zinc/14/22/40/568142240.db2.gz IDDWRHRBZNYQFU-QHCPKHFHSA-N 0 3 373.500 4.718 20 0 FJADHN C[C@H](NC(=O)Nc1cccc(CN(C)C)c1)c1ccccc1C(F)(F)F ZINC000056621271 568144798 /nfs/dbraw/zinc/14/47/98/568144798.db2.gz NQCYVOVICYFKQW-ZDUSSCGKSA-N 0 3 365.399 4.650 20 0 FJADHN CCCCN(CC(=O)N[C@H](c1cccs1)c1ccc(C)cc1)C1CC1 ZINC000026450563 568181145 /nfs/dbraw/zinc/18/11/45/568181145.db2.gz ZZBGSGGRFQPKKP-NRFANRHFSA-N 0 3 356.535 4.527 20 0 FJADHN CCCCN(CC(=O)N[C@@H](c1cccs1)c1ccc(C)cc1)C1CC1 ZINC000026450564 568181199 /nfs/dbraw/zinc/18/11/99/568181199.db2.gz ZZBGSGGRFQPKKP-OAQYLSRUSA-N 0 3 356.535 4.527 20 0 FJADHN C[C@H](N[C@@H]1CCC[C@@H]2C[C@@H]21)c1nnc(-c2ccc(Cl)c(Cl)c2)o1 ZINC000563109358 568197624 /nfs/dbraw/zinc/19/76/24/568197624.db2.gz YIMOTAHNDRQTCQ-NPZRNVLXSA-N 0 3 352.265 4.883 20 0 FJADHN COc1cc(CCNCc2ccc(-c3ccc(Cl)cc3)o2)ccc1O ZINC000604069262 568206023 /nfs/dbraw/zinc/20/60/23/568206023.db2.gz LIHBZQBEHQBWHO-UHFFFAOYSA-N 0 3 357.837 4.647 20 0 FJADHN CC(C)c1ccccc1NC(=O)NC[C@@H]1CCCN1Cc1ccccc1 ZINC000604089171 568210154 /nfs/dbraw/zinc/21/01/54/568210154.db2.gz UKPAWZYXNCYGKX-IBGZPJMESA-N 0 3 351.494 4.596 20 0 FJADHN CC(C)(C)c1ccccc1NC(=O)NC[C@H]1CCCN1Cc1ccccc1 ZINC000604092315 568211807 /nfs/dbraw/zinc/21/18/07/568211807.db2.gz IOGDHLANTUBBSY-LJQANCHMSA-N 0 3 365.521 4.770 20 0 FJADHN CC1CCC(N(C)CC(=O)N[C@H](c2cccs2)c2ccc(F)cc2)CC1 ZINC000302769663 568235380 /nfs/dbraw/zinc/23/53/80/568235380.db2.gz YEOJMDOVZQGBHO-RVAKQSJFSA-N 0 3 374.525 4.603 20 0 FJADHN CCN(CC)[C@@H](CNC(=O)C[C@@H](C)c1ccccc1F)c1ccccc1 ZINC000303171401 568255403 /nfs/dbraw/zinc/25/54/03/568255403.db2.gz RGNCKNYSUWKNJJ-UTKZUKDTSA-N 0 3 356.485 4.519 20 0 FJADHN Cc1[nH]c2c(cccc2C(=O)NCC(C)(C)N[C@H](C)c2ccccc2)c1C ZINC000303348289 568267066 /nfs/dbraw/zinc/26/70/66/568267066.db2.gz FIJKCXJKLWUUHE-QGZVFWFLSA-N 0 3 363.505 4.644 20 0 FJADHN CC(C)(C)n1cc(CNCCSCc2cccc3ccccc32)cn1 ZINC000604417867 568276010 /nfs/dbraw/zinc/27/60/10/568276010.db2.gz FWPWIRBMTUNFQL-UHFFFAOYSA-N 0 3 353.535 4.814 20 0 FJADHN Cc1nc2ccccc2n1CCNCc1ccc(-c2ccc(F)cc2C)o1 ZINC000604414718 568279458 /nfs/dbraw/zinc/27/94/58/568279458.db2.gz OXDPJGIHDVWZCK-UHFFFAOYSA-N 0 3 363.436 4.842 20 0 FJADHN C[C@@H]1C[C@H](c2ccccc2)CN1Cc1nc(-c2ccc(Cl)cc2)no1 ZINC000604393224 568283189 /nfs/dbraw/zinc/28/31/89/568283189.db2.gz WNOUCJWHCDUSJO-PBHICJAKSA-N 0 3 353.853 4.768 20 0 FJADHN O=C(CN(CC1CC1)CC1CC1)Nc1cc(Cl)c(Cl)cc1Cl ZINC000604394929 568284842 /nfs/dbraw/zinc/28/48/42/568284842.db2.gz WWRNOLVUDHYMTB-UHFFFAOYSA-N 0 3 361.700 4.707 20 0 FJADHN Cc1cc(C)c(NC(=O)[C@H](C)N2C[C@H](c3ccccc3)C[C@H]2C)c(C)c1 ZINC000604394471 568284454 /nfs/dbraw/zinc/28/44/54/568284454.db2.gz NTXQEOCGCKDQLJ-SVFBPWRDSA-N 0 3 350.506 4.817 20 0 FJADHN CC(C)Cc1ccc(C(=O)NC2CCN([C@H](C)c3ccccc3)CC2)cc1 ZINC000604713493 568355162 /nfs/dbraw/zinc/35/51/62/568355162.db2.gz FPHFDWFQBVTQDB-LJQANCHMSA-N 0 3 364.533 4.841 20 0 FJADHN Cc1ccc(CCCC(=O)NC2CCN([C@H](C)c3ccccc3)CC2)cc1 ZINC000604713937 568355225 /nfs/dbraw/zinc/35/52/25/568355225.db2.gz CBRADQVFLIVPLH-HXUWFJFHSA-N 0 3 364.533 4.660 20 0 FJADHN Cc1ccccc1CN1CCCN(C(=O)C[C@H](C)c2ccccc2C)CC1 ZINC000604741492 568359645 /nfs/dbraw/zinc/35/96/45/568359645.db2.gz YKAFKSHYWZDQHI-NRFANRHFSA-N 0 3 364.533 4.532 20 0 FJADHN Cc1ccccc1[C@H](C)CC(=O)NC[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000604742281 568359834 /nfs/dbraw/zinc/35/98/34/568359834.db2.gz RMMPFYBUMOJEKH-IRLDBZIGSA-N 0 3 364.533 4.517 20 0 FJADHN OC[C@@H](NCc1cn(Cc2ccccc2)c2ccccc12)c1ccccc1 ZINC000604765086 568361810 /nfs/dbraw/zinc/36/18/10/568361810.db2.gz ACPDRWBGEKXIAE-HSZRJFAPSA-N 0 3 356.469 4.513 20 0 FJADHN CCCc1ccc(CN[C@](C)(CO)c2cccc(C(F)(F)F)c2)cc1 ZINC000604767140 568362268 /nfs/dbraw/zinc/36/22/68/568362268.db2.gz NXZJNEPBVZUZIO-LJQANCHMSA-N 0 3 351.412 4.655 20 0 FJADHN C[C@@](CO)(NCc1ccc2ccccc2c1)c1cccc(C(F)(F)F)c1 ZINC000604767296 568362273 /nfs/dbraw/zinc/36/22/73/568362273.db2.gz IBBJPDKWNJZIBC-FQEVSTJZSA-N 0 3 359.391 4.856 20 0 FJADHN CC[C@H](Cc1ccc(Cl)cc1)NCc1nccn1Cc1ccccc1 ZINC000604773219 568363702 /nfs/dbraw/zinc/36/37/02/568363702.db2.gz QUFIMRQBLQFXCT-HXUWFJFHSA-N 0 3 353.897 4.696 20 0 FJADHN COc1cc(NC(=O)[C@@H](C)[C@H](N)c2ccccc2)c(C2CC2)cc1Cl ZINC000655529962 568366142 /nfs/dbraw/zinc/36/61/42/568366142.db2.gz FKSJWHIYQNNADG-BUXKBTBVSA-N 0 3 358.869 4.501 20 0 FJADHN COc1cc(NC(=O)[C@H](C)[C@H](N)c2ccccc2)c(C2CC2)cc1Cl ZINC000655529961 568366149 /nfs/dbraw/zinc/36/61/49/568366149.db2.gz FKSJWHIYQNNADG-BLVKFPJESA-N 0 3 358.869 4.501 20 0 FJADHN CC(C)CCC[C@H](C)NC(=O)NC1CCN([C@@H](C)c2ccccc2)CC1 ZINC000604784445 568366294 /nfs/dbraw/zinc/36/62/94/568366294.db2.gz CFWSGCTYTRBWGX-OALUTQOASA-N 0 3 359.558 4.726 20 0 FJADHN CC(C)CCC[C@H](C)NC(=O)NC1CCN([C@H](C)c2ccccc2)CC1 ZINC000604784446 568366337 /nfs/dbraw/zinc/36/63/37/568366337.db2.gz CFWSGCTYTRBWGX-RBUKOAKNSA-N 0 3 359.558 4.726 20 0 FJADHN C[C@@H](c1ccccc1)N1CCC(NC(=O)N(C)CCC2CCCCC2)CC1 ZINC000604785075 568366429 /nfs/dbraw/zinc/36/64/29/568366429.db2.gz CSWDJSOZDJSFCL-IBGZPJMESA-N 0 3 371.569 4.824 20 0 FJADHN CCCc1ccccc1NC(=O)NC1CCN([C@H](C)c2ccccc2)CC1 ZINC000604795183 568368223 /nfs/dbraw/zinc/36/82/23/568368223.db2.gz HHGWZHZCKKNDIE-GOSISDBHSA-N 0 3 365.521 4.986 20 0 FJADHN CCCCN(CCCC)C(=O)NC1CCN([C@H](C)c2ccccc2)CC1 ZINC000604823280 568370322 /nfs/dbraw/zinc/37/03/22/568370322.db2.gz XNVOOIIZKYCALN-LJQANCHMSA-N 0 3 359.558 4.824 20 0 FJADHN C[C@H](c1ccccc1)N1CCC(NC(=O)Nc2cccc(C(F)F)c2)CC1 ZINC000604799675 568370486 /nfs/dbraw/zinc/37/04/86/568370486.db2.gz ZRIXMFNGBJGCDJ-OAHLLOKOSA-N 0 3 373.447 4.971 20 0 FJADHN CCC1CCC(N(C)C(=O)NC2CCN([C@H](C)c3ccccc3)CC2)CC1 ZINC000604826531 568376651 /nfs/dbraw/zinc/37/66/51/568376651.db2.gz OIWCYGVYGSYHGF-FLPIEVNYSA-N 0 3 371.569 4.822 20 0 FJADHN CCN(Cc1ccc(CN(C)C)cc1)C(=O)c1cc2c(ccc(C)c2C)[nH]1 ZINC000604864645 568379970 /nfs/dbraw/zinc/37/99/70/568379970.db2.gz WXQVDDCUVAUYDX-UHFFFAOYSA-N 0 3 363.505 4.509 20 0 FJADHN C[C@H](N[C@H](Cc1ccccc1)c1cccs1)C(=O)N[C@H]1CCCC[C@H]1C ZINC000604892079 568382014 /nfs/dbraw/zinc/38/20/14/568382014.db2.gz JGHLUCKTIJNQDE-LCLWPZTBSA-N 0 3 370.562 4.705 20 0 FJADHN CN(C)CCOc1ccc(NC(=O)CC(C)(C)c2ccccc2)cc1Cl ZINC000604873696 568382612 /nfs/dbraw/zinc/38/26/12/568382612.db2.gz YCRAZANCZMVSKH-UHFFFAOYSA-N 0 3 374.912 4.587 20 0 FJADHN CCC[C@@H](C(=O)Nc1ccc(OCCN(C)C)c(Cl)c1)c1ccccc1 ZINC000604874112 568382665 /nfs/dbraw/zinc/38/26/65/568382665.db2.gz PENLCVZZMLHFLU-GOSISDBHSA-N 0 3 374.912 4.803 20 0 FJADHN COc1ccc(-c2cc(CN(CCc3ccc(F)cc3)C3CC3)on2)cc1 ZINC000604903459 568385531 /nfs/dbraw/zinc/38/55/31/568385531.db2.gz RVDFBIMFXLNHKF-UHFFFAOYSA-N 0 3 366.436 4.696 20 0 FJADHN CCOc1cc(CNC(C)(C)c2cccc(F)c2)ccc1OC(F)F ZINC000236910148 568498007 /nfs/dbraw/zinc/49/80/07/568498007.db2.gz ZQJVUGZSNCHCLM-UHFFFAOYSA-N 0 3 353.384 4.851 20 0 FJADHN Cc1ncc(CN(C)CC/C=C\c2ccc(Br)cc2)s1 ZINC000604997317 568507785 /nfs/dbraw/zinc/50/77/85/568507785.db2.gz KEFVNRXXYAUPIE-HYXAFXHYSA-N 0 3 351.313 4.749 20 0 FJADHN CCC(C)(C)C(=O)NC[C@H]1CCCN(C)[C@@H]1c1ccc(C(F)(F)F)cc1 ZINC000605102426 568566182 /nfs/dbraw/zinc/56/61/82/568566182.db2.gz HAXHSOVJFLBYOC-NVXWUHKLSA-N 0 3 370.459 4.641 20 0 FJADHN CC(C)CCC(=O)NC[C@@H]1CCCN(C)[C@@H]1c1ccc(C(F)(F)F)cc1 ZINC000605102809 568566342 /nfs/dbraw/zinc/56/63/42/568566342.db2.gz GQJPMMIBNLKDJM-QFBILLFUSA-N 0 3 370.459 4.641 20 0 FJADHN CCCCCC(=O)NC[C@H]1CCCN(C)[C@@H]1c1ccc(C(F)(F)F)cc1 ZINC000605102765 568566349 /nfs/dbraw/zinc/56/63/49/568566349.db2.gz LBARDHMTTDSFTJ-VQIMIIECSA-N 0 3 370.459 4.785 20 0 FJADHN CSc1ccccc1NC(=O)CCN1CCS[C@@H](c2ccccc2)C1 ZINC000605153823 568597709 /nfs/dbraw/zinc/59/77/09/568597709.db2.gz CJLZJEDQADSCFM-LJQANCHMSA-N 0 3 372.559 4.527 20 0 FJADHN CCc1ccc([C@@H](C)CC(=O)N(c2ccccc2)C2CCN(C)CC2)cc1 ZINC000606177981 568693166 /nfs/dbraw/zinc/69/31/66/568693166.db2.gz ZNPRBOXASSHSJA-IBGZPJMESA-N 0 3 364.533 4.870 20 0 FJADHN CC[C@H](CC(=O)Nc1cc(CN(C)C)ccc1OC)c1ccc(C)cc1 ZINC000606173087 568705354 /nfs/dbraw/zinc/70/53/54/568705354.db2.gz NRLPKIKDCNDONL-GOSISDBHSA-N 0 3 354.494 4.588 20 0 FJADHN C[C@@H](NCc1ccc(OC(F)F)cc1)c1ccc(Br)s1 ZINC000038002027 211344479 /nfs/dbraw/zinc/34/44/79/211344479.db2.gz ZJWSCXXVFJVFGU-SECBINFHSA-N 0 3 362.239 4.963 20 0 FJADHN c1ccc(CCN(Cc2ccncc2)Cc2ccc3ncccc3c2)cc1 ZINC000013990057 211067945 /nfs/dbraw/zinc/06/79/45/211067945.db2.gz QYSSSLWFPZHMEO-UHFFFAOYSA-N 0 3 353.469 4.875 20 0 FJADHN CC(=O)N1CCCCC[C@@H]1C1CCN(Cc2ccc3c(c2)CCCC3)CC1 ZINC000644832546 567838446 /nfs/dbraw/zinc/83/84/46/567838446.db2.gz MAFGNSYUODIRFM-XMMPIXPASA-N 0 3 368.565 4.569 20 0 FJADHN CCN(C[C@H](O)COc1ccccc1)[C@H](C)c1cccc(C(F)(F)F)c1 ZINC000255959767 567866830 /nfs/dbraw/zinc/86/68/30/567866830.db2.gz KSCDOBBUIBATKN-QAPCUYQASA-N 0 3 367.411 4.528 20 0 FJADHN CN1CCC(N(C(=O)[C@H]2C[C@H]2c2cccc(Cl)c2)c2ccccc2)CC1 ZINC000601959408 567886560 /nfs/dbraw/zinc/88/65/60/567886560.db2.gz ZXZYSKDRBVRPJR-SFTDATJTSA-N 0 3 368.908 4.571 20 0 FJADHN CN1CCC(N(C(=O)c2ccc(Cl)c(Cl)c2)c2ccccc2)CC1 ZINC000601959370 567886581 /nfs/dbraw/zinc/88/65/81/567886581.db2.gz YLWMLXSKNOTHRF-UHFFFAOYSA-N 0 3 363.288 4.734 20 0 FJADHN CC(C)[C@H](CC(=O)N(c1ccccc1)C1CCN(C)CC1)c1ccccc1 ZINC000601960680 567887209 /nfs/dbraw/zinc/88/72/09/567887209.db2.gz VWRRJQCHDDSXPY-QHCPKHFHSA-N 0 3 364.533 4.944 20 0 FJADHN CN1CCC(N(C(=O)Cc2csc3ccccc23)c2ccccc2)CC1 ZINC000601963918 567888563 /nfs/dbraw/zinc/88/85/63/567888563.db2.gz XXKJUXINPIUTQD-UHFFFAOYSA-N 0 3 364.514 4.571 20 0 FJADHN COc1ccc(CN(C)Cc2ccc(Cl)c3cccnc23)cc1OC ZINC000051454282 567960963 /nfs/dbraw/zinc/96/09/63/567960963.db2.gz OZLDPNNUVDLBAO-UHFFFAOYSA-N 0 3 356.853 4.537 20 0 FJADHN CCOc1ccc([C@@H]2CCCN2CCC(=O)Nc2ccccc2Cl)cc1 ZINC000021314989 567965959 /nfs/dbraw/zinc/96/59/59/567965959.db2.gz RKFLCCJGLCDNKN-FQEVSTJZSA-N 0 3 372.896 4.904 20 0 FJADHN C[C@H](Nc1cccc(N2CCN(CC3CC3)CC2)c1)c1ccccc1F ZINC000602578754 567993442 /nfs/dbraw/zinc/99/34/42/567993442.db2.gz JEHCOFDYMBCLED-KRWDZBQOSA-N 0 3 353.485 4.531 20 0 FJADHN C[C@@H](Nc1cccc(N2CCN(CC3CC3)CC2)c1)c1ccc(F)c(F)c1 ZINC000602579114 567993513 /nfs/dbraw/zinc/99/35/13/567993513.db2.gz PVOXJCWUAPZFQD-MRXNPFEDSA-N 0 3 371.475 4.670 20 0 FJADHN CC(C)NC(=O)Nc1ccc([C@H](C)N[C@@H](C)c2ccc(F)c(F)c2)cc1 ZINC000602570260 567995982 /nfs/dbraw/zinc/99/59/82/567995982.db2.gz SOPKELKTYMTZRJ-KBPBESRZSA-N 0 3 361.436 4.907 20 0 FJADHN Cc1ccccc1[C@H](NCc1cccc(C(N)=O)c1)C1CCC(C)CC1 ZINC000602911979 568011475 /nfs/dbraw/zinc/01/14/75/568011475.db2.gz SJYCIXZERJRCRU-ORWMALAUSA-N 0 3 350.506 4.751 20 0 FJADHN CCc1ccc([C@H](NC(=O)NCc2cccc(CN(C)C)c2)C(C)C)cc1 ZINC000028399226 568076024 /nfs/dbraw/zinc/07/60/24/568076024.db2.gz JOZDIPYOQXHBMT-JOCHJYFZSA-N 0 3 367.537 4.507 20 0 FJADHN Cc1nc2ccccc2nc1CN(C)C[C@@H]1CCCO[C@@H]1c1ccccc1 ZINC000051582105 568090972 /nfs/dbraw/zinc/09/09/72/568090972.db2.gz SJIDUEHSMRFFDN-WMZHIEFXSA-N 0 3 361.489 4.538 20 0 FJADHN Cc1nc2ccccc2nc1CN(C)C[C@H]1CCCO[C@@H]1c1ccccc1 ZINC000051582106 568090978 /nfs/dbraw/zinc/09/09/78/568090978.db2.gz SJIDUEHSMRFFDN-AUSIDOKSSA-N 0 3 361.489 4.538 20 0 FJADHN CC[C@@H]1CCCCN1CCNC(=O)c1ccccc1SCc1ccco1 ZINC000603473154 568103494 /nfs/dbraw/zinc/10/34/94/568103494.db2.gz DEQPWPVHJOPHCU-QGZVFWFLSA-N 0 3 372.534 4.566 20 0 FJADHN Cc1cc(NC(=O)CNC(C)(C)c2ccc(C(C)C)cc2)n(C(C)(C)C)n1 ZINC000603496489 568106358 /nfs/dbraw/zinc/10/63/58/568106358.db2.gz XLULTTYTKTUTRN-UHFFFAOYSA-N 0 3 370.541 4.533 20 0 FJADHN CCOc1cc(CNC[C@@H]2OCCc3ccccc32)ccc1OCC(C)C ZINC000603516254 568111612 /nfs/dbraw/zinc/11/16/12/568111612.db2.gz RYMAKRKEVUWPFY-QHCPKHFHSA-N 0 3 369.505 4.524 20 0 FJADHN CC(C)(C)c1cccc(OCCNCc2cnc(-c3ccccc3)nc2)c1 ZINC000603723043 568141930 /nfs/dbraw/zinc/14/19/30/568141930.db2.gz RBBGAJSYICVWLO-UHFFFAOYSA-N 0 3 361.489 4.610 20 0 FJADHN CN1CCC[C@H](CNC(=O)C2CC3(C2)CCCCC3)[C@@H]1c1cccs1 ZINC000669149958 568147432 /nfs/dbraw/zinc/14/74/32/568147432.db2.gz MSKYXNGCPZRZBP-VQIMIIECSA-N 0 3 360.567 4.608 20 0 FJADHN CC[C@@H]1c2ccccc2CCN1Cc1cccc(C(=O)NCc2ccco2)c1 ZINC000603944330 568185832 /nfs/dbraw/zinc/18/58/32/568185832.db2.gz LBDQRAUVFHSDPM-HSZRJFAPSA-N 0 3 374.484 4.719 20 0 FJADHN CCSCc1ccc(C(=O)N[C@@H](CN2CCCC2)c2ccccc2)cc1 ZINC000603954894 568189293 /nfs/dbraw/zinc/18/92/93/568189293.db2.gz JYWULICBYSVZMM-NRFANRHFSA-N 0 3 368.546 4.507 20 0 FJADHN CC[C@H](c1ccccc1)N(Cc1nc(-c2ccccn2)no1)CC(C)C ZINC000604048361 568201128 /nfs/dbraw/zinc/20/11/28/568201128.db2.gz MIKKIDYAFHXFKS-LJQANCHMSA-N 0 3 350.466 4.741 20 0 FJADHN CCOC(=O)C[C@@H](c1ccccc1)C1CCN([C@@H](C)c2cccnc2)CC1 ZINC000604124456 568213995 /nfs/dbraw/zinc/21/39/95/568213995.db2.gz FWHKZLFATBQPSF-AVRDEDQJSA-N 0 3 366.505 4.592 20 0 FJADHN C[C@@H]1CN(C(=O)N[C@H](CN2CCCCC2)c2ccccc2)c2ccccc21 ZINC000604205073 568228333 /nfs/dbraw/zinc/22/83/33/568228333.db2.gz JJJNAATVYZUEIV-WIYYLYMNSA-N 0 3 363.505 4.547 20 0 FJADHN CSCc1c2ccccc2oc1C(=O)NCC(C)(C)N1CCC[C@@H](C)C1 ZINC000604300338 568245388 /nfs/dbraw/zinc/24/53/88/568245388.db2.gz BRPMYVQEGYKIMI-OAHLLOKOSA-N 0 3 374.550 4.536 20 0 FJADHN CN(C[C@@H]1CCCN(C)C1)C(=O)c1sc2cc(Cl)ccc2c1Cl ZINC000604346940 568264703 /nfs/dbraw/zinc/26/47/03/568264703.db2.gz DYWMCUNKNSFBAS-LLVKDONJSA-N 0 3 371.333 4.622 20 0 FJADHN C[C@@H]1CCC[C@H](N(C)CC(=O)N[C@H](c2cccs2)c2ccc(F)cc2)C1 ZINC000026474485 568267043 /nfs/dbraw/zinc/26/70/43/568267043.db2.gz WQTZXGMUEIKVMN-YWMUFLPLSA-N 0 3 374.525 4.603 20 0 FJADHN Fc1cccc(F)c1-c1ccc(CNC[C@H]2OCCc3ccccc32)o1 ZINC000604416607 568274779 /nfs/dbraw/zinc/27/47/79/568274779.db2.gz OAXGBEGWNCWIPR-HXUWFJFHSA-N 0 3 355.384 4.628 20 0 FJADHN FC(F)(F)c1ccc(N2CC[C@H](NCc3ccc(Cl)s3)C2)cc1 ZINC000604417433 568275670 /nfs/dbraw/zinc/27/56/70/568275670.db2.gz BLZHIKXEIRWUGU-LBPRGKRZSA-N 0 3 360.832 4.789 20 0 FJADHN CN(C)[C@H](CNCc1ccc(-c2c(F)cccc2F)o1)c1ccsc1 ZINC000604414902 568279735 /nfs/dbraw/zinc/27/97/35/568279735.db2.gz PCAWWVGFRDNLDL-QGZVFWFLSA-N 0 3 362.445 4.679 20 0 FJADHN C[C@H](CNC(=O)N(C)[C@@H](C)c1cccc(Cl)c1)N(C)Cc1ccccc1 ZINC000303460195 568280091 /nfs/dbraw/zinc/28/00/91/568280091.db2.gz LHCDIOCTNHMZOK-SJORKVTESA-N 0 3 373.928 4.563 20 0 FJADHN COc1ccc(CCN(Cc2nc3ccccc3o2)CC(C)C)cc1OC ZINC000604393908 568283691 /nfs/dbraw/zinc/28/36/91/568283691.db2.gz QQNKKRVWCWLUSO-UHFFFAOYSA-N 0 3 368.477 4.546 20 0 FJADHN CC[C@H](N[C@@H](C)c1ccc(S(=O)(=O)N(CC)CC)cc1)c1ccccc1 ZINC000303508287 568285043 /nfs/dbraw/zinc/28/50/43/568285043.db2.gz NLHSPMUNMUWWGB-UWJYYQICSA-N 0 3 374.550 4.519 20 0 FJADHN O=C(CN(CC1CC1)CC1CC1)Nc1ccccc1Oc1ccccc1 ZINC000604395486 568295016 /nfs/dbraw/zinc/29/50/16/568295016.db2.gz DZCXUQZCBSPYSG-UHFFFAOYSA-N 0 3 350.462 4.539 20 0 FJADHN CSCCNCc1c(C)nn(-c2ccccc2)c1Oc1ccc(F)cc1 ZINC000604477447 568299744 /nfs/dbraw/zinc/29/97/44/568299744.db2.gz ACAVWMCZGQDKIQ-UHFFFAOYSA-N 0 3 371.481 4.565 20 0 FJADHN CSCCNCc1cn(Cc2ccccc2)nc1-c1ccc(Cl)cc1 ZINC000604478513 568300009 /nfs/dbraw/zinc/30/00/09/568300009.db2.gz QADHFCWHJHZBBN-UHFFFAOYSA-N 0 3 371.937 4.704 20 0 FJADHN COC(=O)c1cccc(CN(C)[C@H](C)c2ccc(C(F)(F)F)cc2)c1 ZINC000604492988 568303715 /nfs/dbraw/zinc/30/37/15/568303715.db2.gz UVKKFDPQUWDFMA-CYBMUJFWSA-N 0 3 351.368 4.685 20 0 FJADHN CC[C@H](C)c1ccc([C@@H](NC(=O)N(C)C[C@@H]2CCCN(C)C2)C(C)C)cc1 ZINC000604634361 568333164 /nfs/dbraw/zinc/33/31/64/568333164.db2.gz SCWNASVOBXXCHV-JQVVWYNYSA-N 0 3 373.585 4.880 20 0 FJADHN C[C@H]1CCC[C@H](CCNC(=O)N(C)C2CCN(Cc3ccccc3)CC2)C1 ZINC000604667013 568344333 /nfs/dbraw/zinc/34/43/33/568344333.db2.gz JIRKCUHFNIZKOB-VQTJNVASSA-N 0 3 371.569 4.509 20 0 FJADHN C[C@H](CC(=O)NCc1ccccc1CN1CCCCC1)c1cccc(F)c1 ZINC000604698546 568351629 /nfs/dbraw/zinc/35/16/29/568351629.db2.gz WFPPFZWSXMUYMN-GOSISDBHSA-N 0 3 368.496 4.622 20 0 FJADHN CCc1ccc([C@H](C)C(=O)NC2CCN([C@@H](C)c3ccccc3)CC2)cc1 ZINC000604713751 568355195 /nfs/dbraw/zinc/35/51/95/568355195.db2.gz GTYWABDSNDFQPA-OALUTQOASA-N 0 3 364.533 4.694 20 0 FJADHN CC(C)=C[C@@H]1[C@@H](C(=O)NC2CCN([C@@H](C)c3ccccc3)CC2)C1(C)C ZINC000604714363 568355314 /nfs/dbraw/zinc/35/53/14/568355314.db2.gz KTJQUZKDTDSYOD-WMQCIHAUSA-N 0 3 354.538 4.567 20 0 FJADHN C[C@H](CC(=O)NCC(C)(C)N[C@H](C)c1ccccc1)c1cccc(F)c1 ZINC000604744931 568356054 /nfs/dbraw/zinc/35/60/54/568356054.db2.gz TUNGBVDRKTUNDC-IAGOWNOFSA-N 0 3 356.485 4.565 20 0 FJADHN CCN(Cc1ccc(CN(C)C)cc1)C(=O)C[C@H](C)c1ccccc1C ZINC000604743888 568360042 /nfs/dbraw/zinc/36/00/42/568360042.db2.gz PVUXCTDOFSPGOC-IBGZPJMESA-N 0 3 352.522 4.599 20 0 FJADHN O=C(NC1CC1)c1ccc(CNC2(c3ccc(Cl)cc3)CCCC2)cc1 ZINC000604764637 568361701 /nfs/dbraw/zinc/36/17/01/568361701.db2.gz AVSFTGSCMPQPMD-UHFFFAOYSA-N 0 3 368.908 4.791 20 0 FJADHN OC[C@@H](NCc1cn(Cc2ccccc2)c2ccccc12)c1ccc(F)cc1 ZINC000604769995 568362859 /nfs/dbraw/zinc/36/28/59/568362859.db2.gz GUSLBSGWXPWULZ-HSZRJFAPSA-N 0 3 374.459 4.652 20 0 FJADHN CC[C@H](Cc1ccc(Cl)cc1)NCc1ccc(Br)cn1 ZINC000604773089 568363650 /nfs/dbraw/zinc/36/36/50/568363650.db2.gz KNBJTSFHSVDRLO-OAHLLOKOSA-N 0 3 353.691 4.608 20 0 FJADHN C[C@@H](CN[C@H](C(=O)N(C)C)c1ccccc1)c1c(Cl)cccc1Cl ZINC000604773799 568363872 /nfs/dbraw/zinc/36/38/72/568363872.db2.gz YVLRBEIGWPWGJK-UGSOOPFHSA-N 0 3 365.304 4.516 20 0 FJADHN Cc1sc2ncnc(NC3CCN([C@@H](C)c4ccccc4)CC3)c2c1C ZINC000604757456 568365287 /nfs/dbraw/zinc/36/52/87/568365287.db2.gz FNMZFROEJRQDQC-HNNXBMFYSA-N 0 3 366.534 4.946 20 0 FJADHN COc1cc(NC(=O)[C@H](C)[C@@H](N)c2ccccc2)c(C2CC2)cc1Cl ZINC000655529963 568366191 /nfs/dbraw/zinc/36/61/91/568366191.db2.gz FKSJWHIYQNNADG-CWTRNNRKSA-N 0 3 358.869 4.501 20 0 FJADHN Cc1ccccc1[C@@H](C)NC(=O)NC1CCN([C@@H](C)c2ccccc2)CC1 ZINC000604784903 568366360 /nfs/dbraw/zinc/36/63/60/568366360.db2.gz JPFNCEFFKHTRIT-MOPGFXCFSA-N 0 3 365.521 4.581 20 0 FJADHN C[C@@H](c1ccccc1)N1CCC(NC(=O)Nc2ccc3c(c2)CCC3)CC1 ZINC000604792417 568367730 /nfs/dbraw/zinc/36/77/30/568367730.db2.gz DMTNITAMSVLOFJ-KRWDZBQOSA-N 0 3 363.505 4.522 20 0 FJADHN CCCC(C)(C)NC(=O)NCc1ccccc1-c1ccc(CN(C)C)cc1 ZINC000604809286 568372315 /nfs/dbraw/zinc/37/23/15/568372315.db2.gz ANNZHZLRVAPMSV-UHFFFAOYSA-N 0 3 367.537 4.793 20 0 FJADHN C[C@H](N[C@@H](Cc1ccccc1)c1cccs1)C(=O)Nc1ccccc1 ZINC000604891888 568382034 /nfs/dbraw/zinc/38/20/34/568382034.db2.gz FIQMDCKBISEGHW-LPHOPBHVSA-N 0 3 350.487 4.649 20 0 FJADHN CCCOc1ccc(O[C@H]2CCCC[C@H]2NCc2cnc(C)s2)cc1 ZINC000604892225 568382039 /nfs/dbraw/zinc/38/20/39/568382039.db2.gz KWWXRLQMBWLEOR-UXHICEINSA-N 0 3 360.523 4.720 20 0 FJADHN C[C@@H](c1ccccc1)N1CCC(NC(=O)NC(C)(C)c2cccs2)CC1 ZINC000604920712 568390355 /nfs/dbraw/zinc/39/03/55/568390355.db2.gz GVEJLSOTXGCTOC-INIZCTEOSA-N 0 3 371.550 4.508 20 0 FJADHN O[C@@H](CN[C@H](CC(F)F)c1ccccc1)COc1ccc2ccccc2c1 ZINC000643255727 568406727 /nfs/dbraw/zinc/40/67/27/568406727.db2.gz REJXYTZQWXTUDQ-PZJWPPBQSA-N 0 3 371.427 4.566 20 0 FJADHN O[C@H](CN[C@@H](CC(F)F)c1ccccc1)COc1ccc2ccccc2c1 ZINC000643255725 568406751 /nfs/dbraw/zinc/40/67/51/568406751.db2.gz REJXYTZQWXTUDQ-CTNGQTDRSA-N 0 3 371.427 4.566 20 0 FJADHN O=C(CCN1CCC[C@@H]1c1ccsc1)Nc1ccc(Cl)cc1F ZINC000051852948 568486747 /nfs/dbraw/zinc/48/67/47/568486747.db2.gz LRPYRVGWLOHLDF-MRXNPFEDSA-N 0 3 352.862 4.706 20 0 FJADHN C[C@@H](NC1(C(=O)Nc2ccccc2)CC1)C1CCC(C(F)(F)F)CC1 ZINC000433074737 568503049 /nfs/dbraw/zinc/50/30/49/568503049.db2.gz FBZYAAXOAHCUPI-WLYUNCDWSA-N 0 3 354.416 4.505 20 0 FJADHN Brc1ccc(/C=C/CCN2CCC[C@H](c3ccncn3)C2)cc1 ZINC000604997461 568508051 /nfs/dbraw/zinc/50/80/51/568508051.db2.gz YYEVMSNFSWMRGI-XMUUHYKESA-N 0 3 372.310 4.522 20 0 FJADHN CN(C)Cc1ccc(CNC(=O)c2ccc(-c3ccccc3Cl)o2)cc1 ZINC000007437463 568515286 /nfs/dbraw/zinc/51/52/86/568515286.db2.gz MPLKNJDYVVJRFW-UHFFFAOYSA-N 0 3 368.864 4.592 20 0 FJADHN Cc1cc(F)ccc1N1CCC[C@@H](NCc2cnc(C(C)(C)C)s2)C1 ZINC000605008986 568516279 /nfs/dbraw/zinc/51/62/79/568516279.db2.gz HOSANDJEVSNNEO-MRXNPFEDSA-N 0 3 361.530 4.647 20 0 FJADHN Cc1onc(-c2ccccc2)c1-c1nnc(CN2CCCC[C@@H]2C(C)C)o1 ZINC000605026527 568531475 /nfs/dbraw/zinc/53/14/75/568531475.db2.gz ZQPSIBBEMXLARA-QGZVFWFLSA-N 0 3 366.465 4.711 20 0 FJADHN CCc1ccc([C@@H]2CCCN2C(=O)c2ccc(CN(CC)C3CC3)cc2)o1 ZINC000605097080 568563389 /nfs/dbraw/zinc/56/33/89/568563389.db2.gz GQLVDXZFOSUWSO-NRFANRHFSA-N 0 3 366.505 4.804 20 0 FJADHN C[C@H](NC(=O)c1ccc(CN(C)C)cc1)c1cccc(Cl)c1Cl ZINC000605114743 568572179 /nfs/dbraw/zinc/57/21/79/568572179.db2.gz YAZCYQJNUOXJKJ-LBPRGKRZSA-N 0 3 351.277 4.546 20 0 FJADHN Cc1cc(C)c(CN[C@](C)(CO)c2cccc(C(F)(F)F)c2)c(C)c1 ZINC000605151145 568580349 /nfs/dbraw/zinc/58/03/49/568580349.db2.gz FTNHFGCPCYPZIH-LJQANCHMSA-N 0 3 351.412 4.628 20 0 FJADHN c1ccc(SCCN2CCCN(CCSc3ccccc3)CC2)cc1 ZINC000605149714 568587258 /nfs/dbraw/zinc/58/72/58/568587258.db2.gz YURKLNWMYBSUHV-UHFFFAOYSA-N 0 3 372.603 4.579 20 0 FJADHN Cc1cccc([C@@H]2CCCCCN2Cc2cccc(C(=O)N(C)C)c2)c1 ZINC000605157004 568588465 /nfs/dbraw/zinc/58/84/65/568588465.db2.gz DHOWLHBLKLMNIF-QFIPXVFZSA-N 0 3 350.506 4.814 20 0 FJADHN C[C@H](NC(=O)Nc1cccc(CN(C)C)c1)c1cccc(Cl)c1Cl ZINC000605167920 568595847 /nfs/dbraw/zinc/59/58/47/568595847.db2.gz JKWYHDHCMLWSQS-LBPRGKRZSA-N 0 3 366.292 4.938 20 0 FJADHN CCCN(C(=O)[C@@H](C)c1ccsc1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000606187806 568709104 /nfs/dbraw/zinc/70/91/04/568709104.db2.gz HPUMSUYHBGUFGQ-GHTZIAJQSA-N 0 3 370.562 4.755 20 0 FJADHN CCCN(C(=O)[C@@H](C)c1ccsc1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000606187810 568709152 /nfs/dbraw/zinc/70/91/52/568709152.db2.gz HPUMSUYHBGUFGQ-RXVVDRJESA-N 0 3 370.562 4.755 20 0 FJADHN CC(C)(c1ccnc(Cl)c1)N1C[C@H]2CCC[C@]2(COc2ccccn2)C1 ZINC001164794868 721507851 /nfs/dbraw/zinc/50/78/51/721507851.db2.gz FBBTXZZLLRNZGN-DYESRHJHSA-N 0 3 371.912 4.546 20 0 FJADHN CC(C)[C@@H](NCC(=O)Nc1cc(F)ccc1F)c1ccc(Cl)cc1 ZINC000014778510 220133246 /nfs/dbraw/zinc/13/32/46/220133246.db2.gz XWSNBAQVJKJMJF-GOSISDBHSA-N 0 3 352.812 4.544 20 0 FJADHN O=C(N[C@@H]1CCSc2ccccc21)c1ccc(CN2CCCCC2)cc1 ZINC000018134445 207626271 /nfs/dbraw/zinc/62/62/71/207626271.db2.gz GVEDBNAIUSXEQV-HXUWFJFHSA-N 0 3 366.530 4.639 20 0 FJADHN O=C(Nc1cc(Cl)ccc1Cl)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000038835424 208206218 /nfs/dbraw/zinc/20/62/18/208206218.db2.gz MYGRLQKLIOKROG-OAHLLOKOSA-N 0 3 363.288 4.844 20 0 FJADHN CCN(CC)C(=O)C1CCN(Cc2sc3ccccc3c2Cl)CC1 ZINC000058524473 221120693 /nfs/dbraw/zinc/12/06/93/221120693.db2.gz QWWAPMPZTWGMPU-UHFFFAOYSA-N 0 3 364.942 4.635 20 0 FJADHN O=C(Nc1ccccc1N1CCCCC1)c1cccc(CN2CCCC2)c1 ZINC000060550071 136132330 /nfs/dbraw/zinc/13/23/30/136132330.db2.gz UVDJBQHKAZZIJY-UHFFFAOYSA-N 0 3 363.505 4.525 20 0 FJADHN Fc1ccc(-c2ccc(CNC[C@@H]3CCN(c4ccc(F)cc4)C3)o2)cc1 ZINC000084419517 526313138 /nfs/dbraw/zinc/31/31/38/526313138.db2.gz NLEREQXTQDLIOX-INIZCTEOSA-N 0 3 368.427 4.841 20 0 FJADHN Cn1c(CCNCc2cnc(C3CCCCC3)s2)nc2cc(F)ccc21 ZINC000531452309 567829832 /nfs/dbraw/zinc/82/98/32/567829832.db2.gz IQISDEIEEJHXDI-UHFFFAOYSA-N 0 3 372.513 4.549 20 0 FJADHN COc1cccc(CN(Cc2ccc(Br)cn2)CC(C)C)c1 ZINC000601835855 567855589 /nfs/dbraw/zinc/85/55/89/567855589.db2.gz FCQXCNXFWJIFMA-UHFFFAOYSA-N 0 3 363.299 4.511 20 0 FJADHN COc1ccccc1-c1ncc(CN2CCC(C3CCCC3)CC2)cn1 ZINC000644833180 567861526 /nfs/dbraw/zinc/86/15/26/567861526.db2.gz QQOPXFWYUXRVRW-UHFFFAOYSA-N 0 3 351.494 4.554 20 0 FJADHN CCN(C[C@@H](O)COc1ccccc1)[C@H](C)c1cccc(C(F)(F)F)c1 ZINC000255959766 567866880 /nfs/dbraw/zinc/86/68/80/567866880.db2.gz KSCDOBBUIBATKN-CRAIPNDOSA-N 0 3 367.411 4.528 20 0 FJADHN CN1CCC(N(C(=O)c2ccc(C(C)(C)C)cc2)c2ccccc2)CC1 ZINC000601956176 567885528 /nfs/dbraw/zinc/88/55/28/567885528.db2.gz JLMHANYUVUKZCT-UHFFFAOYSA-N 0 3 350.506 4.725 20 0 FJADHN CCc1cccc(C)c1NC(=O)NC[C@H](c1ccsc1)N(CC)CC ZINC000043156244 567886933 /nfs/dbraw/zinc/88/69/33/567886933.db2.gz AAABZZJLIBZLEB-GOSISDBHSA-N 0 3 359.539 4.824 20 0 FJADHN CCCCOc1ccc(C(=O)N(c2ccccc2)C2CCN(C)CC2)cc1 ZINC000601961117 567887380 /nfs/dbraw/zinc/88/73/80/567887380.db2.gz CXJFRZCAWOKGQT-UHFFFAOYSA-N 0 3 366.505 4.607 20 0 FJADHN Cc1ccc(SCC(=O)N(c2ccccc2)C2CCN(C)CC2)c(C)c1 ZINC000601963855 567888539 /nfs/dbraw/zinc/88/85/39/567888539.db2.gz WWACZUQRTPXENA-UHFFFAOYSA-N 0 3 368.546 4.523 20 0 FJADHN CN1CCC(N(C(=O)Cc2ccc3ccccc3c2)c2ccccc2)CC1 ZINC000601968830 567889983 /nfs/dbraw/zinc/88/99/83/567889983.db2.gz RVNRVBGDJVBYCV-UHFFFAOYSA-N 0 3 358.485 4.510 20 0 FJADHN CN1CCC(N(C(=O)CSc2ccccc2Cl)c2ccccc2)CC1 ZINC000601969646 567890237 /nfs/dbraw/zinc/89/02/37/567890237.db2.gz YXBCTYOOSBOLOV-UHFFFAOYSA-N 0 3 374.937 4.560 20 0 FJADHN Cc1ccc([C@H](CNC(=O)N2CCCCC[C@H]2c2ccco2)N(C)C)cc1 ZINC000605962013 567942909 /nfs/dbraw/zinc/94/29/09/567942909.db2.gz DNDNMQKHXNIHGF-PMACEKPBSA-N 0 3 369.509 4.518 20 0 FJADHN Cc1ccc([C@H](CNC(=O)N2CCCCC[C@@H]2c2ccco2)N(C)C)cc1 ZINC000605962014 567942927 /nfs/dbraw/zinc/94/29/27/567942927.db2.gz DNDNMQKHXNIHGF-UXHICEINSA-N 0 3 369.509 4.518 20 0 FJADHN C[C@@H](CN[C@@H]1CCCOc2cc(Br)ccc21)c1nccs1 ZINC000186753214 567979713 /nfs/dbraw/zinc/97/97/13/567979713.db2.gz QPPUDPHTFGXNIE-SMDDNHRTSA-N 0 3 367.312 4.513 20 0 FJADHN C[C@H](Nc1cccc(N2CCN(CC3CC3)CC2)c1)c1ccc(F)c(F)c1 ZINC000602579107 567993515 /nfs/dbraw/zinc/99/35/15/567993515.db2.gz PVOXJCWUAPZFQD-INIZCTEOSA-N 0 3 371.475 4.670 20 0 FJADHN C[C@H](Nc1cccc(N2CCN(CC3CC3)CC2)c1)c1ccc(F)cc1 ZINC000602578797 567993517 /nfs/dbraw/zinc/99/35/17/567993517.db2.gz KERPPOGWPBWWFJ-KRWDZBQOSA-N 0 3 353.485 4.531 20 0 FJADHN Cc1cc(C)n(-c2ccc(CN[C@@H](c3ccc(C)cc3)C3CCC3)cn2)n1 ZINC000187022122 568001895 /nfs/dbraw/zinc/00/18/95/568001895.db2.gz NNQNARYVTBXNCQ-HSZRJFAPSA-N 0 3 360.505 4.824 20 0 FJADHN C[C@@H](C1CC1)N(Cc1coc(-c2ccc(Br)cc2)n1)C1CC1 ZINC000521428132 568024833 /nfs/dbraw/zinc/02/48/33/568024833.db2.gz VYSNCFMYQNGVOS-LBPRGKRZSA-N 0 3 361.283 4.867 20 0 FJADHN CN(C)CCc1ccccc1NC(=O)N[C@H](c1cccc(F)c1)C(C)(C)C ZINC000446576565 568054925 /nfs/dbraw/zinc/05/49/25/568054925.db2.gz PQLWFFMUDKAESJ-HXUWFJFHSA-N 0 3 371.500 4.839 20 0 FJADHN CCOc1c(OC)cc(CNC(C)(C)c2ccc(Cl)cc2)cc1OC ZINC000067011147 568073060 /nfs/dbraw/zinc/07/30/60/568073060.db2.gz LBTSQULHMAVVMK-UHFFFAOYSA-N 0 3 363.885 4.781 20 0 FJADHN O=c1ccc2c([nH]1)CCC[C@H]2NCc1ccc(-c2cccc(Cl)c2)s1 ZINC000067504159 568076247 /nfs/dbraw/zinc/07/62/47/568076247.db2.gz AVCVJIDTBCPFPF-QGZVFWFLSA-N 0 3 370.905 4.924 20 0 FJADHN Cc1ccc(-c2ccc(CN[C@H]3CCCc4[nH]c(=O)ccc43)s2)cc1 ZINC000067504102 568076260 /nfs/dbraw/zinc/07/62/60/568076260.db2.gz NOELPUGZEZZTQR-SFHVURJKSA-N 0 3 350.487 4.579 20 0 FJADHN COc1cc(C)c([C@@H](C)NCc2cccc(Br)c2)cc1OC ZINC000067690387 568080711 /nfs/dbraw/zinc/08/07/11/568080711.db2.gz MUQWFDNUOQFBDV-CYBMUJFWSA-N 0 3 364.283 4.626 20 0 FJADHN COc1cc(C)c([C@H](C)NCc2cccc(Br)c2)cc1OC ZINC000067690388 568080720 /nfs/dbraw/zinc/08/07/20/568080720.db2.gz MUQWFDNUOQFBDV-ZDUSSCGKSA-N 0 3 364.283 4.626 20 0 FJADHN COc1cc(CN[C@@H](C)c2cccc(OC(F)F)c2)ccc1OC(F)F ZINC000067690203 568080728 /nfs/dbraw/zinc/08/07/28/568080728.db2.gz MVZSPYYEYDDIOS-NSHDSACASA-N 0 3 373.346 4.749 20 0 FJADHN C[C@@H](c1nc(-c2cccnc2)no1)N1CCC[C@H](c2cc3ccccc3[nH]2)C1 ZINC000603410036 568097746 /nfs/dbraw/zinc/09/77/46/568097746.db2.gz XRJLLCJYOZBCNH-YJBOKZPZSA-N 0 3 373.460 4.554 20 0 FJADHN C[C@H](c1nc(-c2cccnc2)no1)N1CCC[C@@H](c2cc3ccccc3[nH]2)C1 ZINC000603410033 568097762 /nfs/dbraw/zinc/09/77/62/568097762.db2.gz XRJLLCJYOZBCNH-CRAIPNDOSA-N 0 3 373.460 4.554 20 0 FJADHN C[C@H](c1nc(-c2cccnc2)no1)N1CCC[C@H](c2cc3ccccc3[nH]2)C1 ZINC000603410035 568097793 /nfs/dbraw/zinc/09/77/93/568097793.db2.gz XRJLLCJYOZBCNH-QAPCUYQASA-N 0 3 373.460 4.554 20 0 FJADHN CC[C@@H](N[C@@H]1CCN(c2ccc(C(F)(F)F)cc2)C1=O)c1ccccc1 ZINC000603509832 568110330 /nfs/dbraw/zinc/11/03/30/568110330.db2.gz RJMPZGPEXGFRFN-QZTJIDSGSA-N 0 3 362.395 4.552 20 0 FJADHN COc1ccc2[nH]cc(CCNCc3nc(-c4ccccc4)cs3)c2c1 ZINC000603516709 568111709 /nfs/dbraw/zinc/11/17/09/568111709.db2.gz YKPKOJZQRNUKKJ-UHFFFAOYSA-N 0 3 363.486 4.632 20 0 FJADHN CSCc1c2ccccc2oc1C(=O)Nc1cccc(CN(C)C)c1 ZINC000603589980 568123521 /nfs/dbraw/zinc/12/35/21/568123521.db2.gz YUWNHKBHRIOOSY-UHFFFAOYSA-N 0 3 354.475 4.610 20 0 FJADHN CC[C@@H](NC(=O)N(C)C1CCN(Cc2ccccc2)CC1)C1CCCCC1 ZINC000603601518 568124713 /nfs/dbraw/zinc/12/47/13/568124713.db2.gz WKJXIEVUBKJAJH-JOCHJYFZSA-N 0 3 371.569 4.651 20 0 FJADHN Cc1ccc(NC(=O)c2csc(-c3ccc(F)cc3)n2)c(CN(C)C)c1 ZINC000603694878 568136729 /nfs/dbraw/zinc/13/67/29/568136729.db2.gz UARKIKCJWVAJSI-UHFFFAOYSA-N 0 3 369.465 4.572 20 0 FJADHN COCCOc1ccc(CNC2(c3ccccc3)CCCCC2)cc1OC ZINC000603723029 568141967 /nfs/dbraw/zinc/14/19/67/568141967.db2.gz LIRKCIXJOCITLU-UHFFFAOYSA-N 0 3 369.505 4.670 20 0 FJADHN C[C@@H](NC/C=C\c1ccccc1)c1ccc(NC(=O)c2ccncc2)cc1 ZINC000603724012 568142469 /nfs/dbraw/zinc/14/24/69/568142469.db2.gz UBEHDFKRXKWUPY-GNJLHFKMSA-N 0 3 357.457 4.698 20 0 FJADHN C[C@H](NC/C=C\c1ccccc1)c1ccc(NC(=O)c2ccncc2)cc1 ZINC000603724013 568142514 /nfs/dbraw/zinc/14/25/14/568142514.db2.gz UBEHDFKRXKWUPY-MTIYJEKLSA-N 0 3 357.457 4.698 20 0 FJADHN CN(C)Cc1c2ccccc2oc1C(=O)NCCC(C)(C)c1ccccc1 ZINC000603830741 568146062 /nfs/dbraw/zinc/14/60/62/568146062.db2.gz RLCAVGSKDAIMRJ-UHFFFAOYSA-N 0 3 364.489 4.592 20 0 FJADHN C[C@H](NCCc1nc(-c2cccc(Cl)c2)no1)c1ccccc1Cl ZINC000604065283 568205348 /nfs/dbraw/zinc/20/53/48/568205348.db2.gz CSQRYJSHDHDZKK-LBPRGKRZSA-N 0 3 362.260 4.937 20 0 FJADHN Cc1nn(-c2ccc(F)cc2)c(C)c1CNCC(C)(C)Oc1ccccc1 ZINC000604072624 568210489 /nfs/dbraw/zinc/21/04/89/568210489.db2.gz VINDVOJZINYAAV-UHFFFAOYSA-N 0 3 367.468 4.575 20 0 FJADHN CCOC(=O)C[C@@H](c1ccccc1)C1CCN([C@H](C)c2cccnc2)CC1 ZINC000604124458 568213967 /nfs/dbraw/zinc/21/39/67/568213967.db2.gz FWHKZLFATBQPSF-GCJKJVERSA-N 0 3 366.505 4.592 20 0 FJADHN C[C@@H](c1cccs1)N(C)C(=O)N[C@H](CN1CCCCC1)c1ccccc1 ZINC000604202170 568227581 /nfs/dbraw/zinc/22/75/81/568227581.db2.gz QUBQCLZECBYLDL-PKOBYXMFSA-N 0 3 371.550 4.678 20 0 FJADHN C[C@H](c1cccs1)N(C)C(=O)N[C@H](CN1CCCCC1)c1ccccc1 ZINC000604202168 568227586 /nfs/dbraw/zinc/22/75/86/568227586.db2.gz QUBQCLZECBYLDL-IEBWSBKVSA-N 0 3 371.550 4.678 20 0 FJADHN CCN(Cc1ccc(C(=O)N2C[C@@H](c3ccccc3)C[C@H]2C)cc1)C1CC1 ZINC000604258006 568239083 /nfs/dbraw/zinc/23/90/83/568239083.db2.gz QDSDXVSCVNPCCQ-GCJKJVERSA-N 0 3 362.517 4.689 20 0 FJADHN CCN(CC)[C@H](CNCc1cnc(-c2ccccc2)s1)c1ccco1 ZINC000236901437 568252909 /nfs/dbraw/zinc/25/29/09/568252909.db2.gz VZRMHNZNUFZTQX-GOSISDBHSA-N 0 3 355.507 4.576 20 0 FJADHN CO[C@@H](CNCC1=Cc2cc(Cl)cc(Cl)c2OC1)c1ccccc1 ZINC000303208781 568257609 /nfs/dbraw/zinc/25/76/09/568257609.db2.gz ZSCYPUNYOQPVER-SFHVURJKSA-N 0 3 364.272 4.747 20 0 FJADHN CCOc1cccc(CNCCCc2c[nH]c3ccccc23)c1OC(F)F ZINC000518796591 568273222 /nfs/dbraw/zinc/27/32/22/568273222.db2.gz NQDDEIKKPUHPHA-UHFFFAOYSA-N 0 3 374.431 4.890 20 0 FJADHN Cc1ccc(-c2ncc(CNC[C@H](C)N(C)Cc3ccccc3)s2)cc1 ZINC000604416563 568274806 /nfs/dbraw/zinc/27/48/06/568274806.db2.gz HUCHDGKUXANATL-SFHVURJKSA-N 0 3 365.546 4.729 20 0 FJADHN Cc1nc2ccccc2n1CCNCc1ccc(-c2cccc(F)c2C)o1 ZINC000604414688 568279584 /nfs/dbraw/zinc/27/95/84/568279584.db2.gz MOYPPWFDEOZMKO-UHFFFAOYSA-N 0 3 363.436 4.842 20 0 FJADHN Cc1cc(F)ccc1-c1ccc(CNCCCc2nc3ccccc3[nH]2)o1 ZINC000604415439 568280831 /nfs/dbraw/zinc/28/08/31/568280831.db2.gz KATWINHKWNQZLV-UHFFFAOYSA-N 0 3 363.436 4.993 20 0 FJADHN C[C@H]1C[C@H](c2ccccc2)CN1Cc1nc(-c2ccc(Cl)cc2)no1 ZINC000604393227 568283241 /nfs/dbraw/zinc/28/32/41/568283241.db2.gz WNOUCJWHCDUSJO-YOEHRIQHSA-N 0 3 353.853 4.768 20 0 FJADHN Cc1cc(C)c(NC(=O)[C@H](C)N2C[C@@H](c3ccccc3)C[C@H]2C)c(C)c1 ZINC000604394467 568284383 /nfs/dbraw/zinc/28/43/83/568284383.db2.gz NTXQEOCGCKDQLJ-DYXWJJEUSA-N 0 3 350.506 4.817 20 0 FJADHN Cc1cc(C)c(NC(=O)[C@H](C)N2C[C@H](c3ccccc3)C[C@@H]2C)c(C)c1 ZINC000604394469 568284414 /nfs/dbraw/zinc/28/44/14/568284414.db2.gz NTXQEOCGCKDQLJ-IRFCIJBXSA-N 0 3 350.506 4.817 20 0 FJADHN COC(=O)c1cccc(CN(C)[C@H](C)c2cccc(C(F)(F)F)c2)c1 ZINC000604492286 568303472 /nfs/dbraw/zinc/30/34/72/568303472.db2.gz RHHHLBSGSYBVRW-CYBMUJFWSA-N 0 3 351.368 4.685 20 0 FJADHN CC(C)[C@H](NC(=O)NCc1ccc(CN(C)C)cc1)c1ccccc1Cl ZINC000604575927 568315686 /nfs/dbraw/zinc/31/56/86/568315686.db2.gz YRJGLBIOXQEDLX-FQEVSTJZSA-N 0 3 373.928 4.598 20 0 FJADHN c1ccc(COc2cccc(CNC[C@H]3OCCc4ccccc43)c2)cc1 ZINC000313571020 568324942 /nfs/dbraw/zinc/32/49/42/568324942.db2.gz VWNJVQCDNKCJEA-XMMPIXPASA-N 0 3 359.469 4.669 20 0 FJADHN O=C(CSCc1ccc(F)cc1)Nc1cccc(CN2CCCCC2)c1 ZINC000031621500 568334924 /nfs/dbraw/zinc/33/49/24/568334924.db2.gz KYHKXTHTKGGXBM-UHFFFAOYSA-N 0 3 372.509 4.684 20 0 FJADHN CC[C@@H](CC(=O)NC1CCN([C@H](C)c2ccccc2)CC1)c1ccccc1 ZINC000604713765 568355177 /nfs/dbraw/zinc/35/51/77/568355177.db2.gz HUYZMIHTGCTXDY-UXHICEINSA-N 0 3 364.533 4.912 20 0 FJADHN C[C@H](c1ccccc1)N1CCC(NC(=O)c2csc3ccccc23)CC1 ZINC000604714301 568355348 /nfs/dbraw/zinc/35/53/48/568355348.db2.gz VDKBGUUUIBXUAV-MRXNPFEDSA-N 0 3 364.514 4.857 20 0 FJADHN C[C@@H](CC(=O)NCC(C)(C)N[C@@H](C)c1ccccc1)c1cccc(F)c1 ZINC000604744933 568356045 /nfs/dbraw/zinc/35/60/45/568356045.db2.gz TUNGBVDRKTUNDC-IRXDYDNUSA-N 0 3 356.485 4.565 20 0 FJADHN O[C@H]([C@H](Cc1ccccc1)NCc1csc2ccccc12)C(F)(F)F ZINC000604764907 568361690 /nfs/dbraw/zinc/36/16/90/568361690.db2.gz CAEPKYLDABHXEE-FUHWJXTLSA-N 0 3 365.420 4.525 20 0 FJADHN Cc1cc(F)ccc1-c1ccc(CN[C@@H](CO)[C@H](C)c2ccccc2)o1 ZINC000604767876 568362416 /nfs/dbraw/zinc/36/24/16/568362416.db2.gz DUGQSBQTTVFMHO-IERDGZPVSA-N 0 3 353.437 4.648 20 0 FJADHN Cc1c(F)cccc1-c1ccc(CN[C@@H](CO)[C@H](C)c2ccccc2)o1 ZINC000604768418 568362596 /nfs/dbraw/zinc/36/25/96/568362596.db2.gz QAOKVDGXAPOWBQ-VFNWGFHPSA-N 0 3 353.437 4.648 20 0 FJADHN CCC(CC)CN(CC)C(=O)NC1CCN([C@@H](C)c2ccccc2)CC1 ZINC000604788670 568367095 /nfs/dbraw/zinc/36/70/95/568367095.db2.gz WDVYAVBTCXQGER-SFHVURJKSA-N 0 3 359.558 4.680 20 0 FJADHN Cc1ccc(Cl)cc1NC(=O)NC1CCN([C@H](C)c2ccccc2)CC1 ZINC000604792290 568367694 /nfs/dbraw/zinc/36/76/94/568367694.db2.gz WJLIFUTUSJLRQF-MRXNPFEDSA-N 0 3 371.912 4.996 20 0 FJADHN C[C@H](c1ccccc1)N1CCC(NC(=O)Nc2ccc3c(c2)CCC3)CC1 ZINC000604792418 568367720 /nfs/dbraw/zinc/36/77/20/568367720.db2.gz DMTNITAMSVLOFJ-QGZVFWFLSA-N 0 3 363.505 4.522 20 0 FJADHN C[C@H](c1ccccc1)N1CCC(NC(=O)Nc2cccc(Cl)c2)CC1 ZINC000604775046 568368946 /nfs/dbraw/zinc/36/89/46/568368946.db2.gz TYTGOJIGKHXNRK-OAHLLOKOSA-N 0 3 357.885 4.687 20 0 FJADHN Cc1c2ccccc2oc1C(=O)Nc1ccc(OCCN(C)C)c(Cl)c1 ZINC000604874788 568382760 /nfs/dbraw/zinc/38/27/60/568382760.db2.gz ZAIGYRMQKNYIOU-UHFFFAOYSA-N 0 3 372.852 4.587 20 0 FJADHN CC(C)(NCc1ccc(-n2ccnc2)cc1)c1ccc(Br)cc1 ZINC000319758053 568476466 /nfs/dbraw/zinc/47/64/66/568476466.db2.gz JWDKNPTYRBZLQZ-UHFFFAOYSA-N 0 3 370.294 4.660 20 0 FJADHN Cc1cccc(NC(=O)[C@H](C)NCC(c2ccccc2)c2ccccc2)c1 ZINC000011046191 568482961 /nfs/dbraw/zinc/48/29/61/568482961.db2.gz VLDLRZVQGKEDKA-IBGZPJMESA-N 0 3 358.485 4.744 20 0 FJADHN OCC1(CN[C@@H]2CCSc3c(F)cccc32)CC(c2ccccc2)C1 ZINC000433097149 568504841 /nfs/dbraw/zinc/50/48/41/568504841.db2.gz KZEJAGVJDSIPFD-IPFXWSOASA-N 0 3 357.494 4.509 20 0 FJADHN C[C@H](c1cccc(NC(=O)c2ccccc2)c1)N1CCCOC(C)(C)C1 ZINC000604999677 568512873 /nfs/dbraw/zinc/51/28/73/568512873.db2.gz HVPFZIMVWVZBGS-QGZVFWFLSA-N 0 3 352.478 4.501 20 0 FJADHN CCC(C)(C)C(=O)NC[C@@H]1CCCN(C)[C@H]1c1ccc(C(F)(F)F)cc1 ZINC000605102427 568566087 /nfs/dbraw/zinc/56/60/87/568566087.db2.gz HAXHSOVJFLBYOC-RDJZCZTQSA-N 0 3 370.459 4.641 20 0 FJADHN C[C@@H](NC(=O)c1ccc(CN(C)C)cc1)c1cccc(Cl)c1Cl ZINC000605114742 568572202 /nfs/dbraw/zinc/57/22/02/568572202.db2.gz YAZCYQJNUOXJKJ-GFCCVEGCSA-N 0 3 351.277 4.546 20 0 FJADHN Cc1cc(C)c(CN[C@@](C)(CO)c2cccc(C(F)(F)F)c2)c(C)c1 ZINC000605151144 568580288 /nfs/dbraw/zinc/58/02/88/568580288.db2.gz FTNHFGCPCYPZIH-IBGZPJMESA-N 0 3 351.412 4.628 20 0 FJADHN Cc1cccc([C@H]2CCCCCN2Cc2cccc(C(=O)N(C)C)c2)c1 ZINC000605157003 568588380 /nfs/dbraw/zinc/58/83/80/568588380.db2.gz DHOWLHBLKLMNIF-JOCHJYFZSA-N 0 3 350.506 4.814 20 0 FJADHN CCCN(C(=O)[C@H](C)c1cccs1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000606189028 568709983 /nfs/dbraw/zinc/70/99/83/568709983.db2.gz YEEVPFXUHLXUQP-QUCCMNQESA-N 0 3 370.562 4.755 20 0 FJADHN CC[C@H](c1ccc(Cl)cc1)N1CCC(C(=O)N[C@H](C)C(C)C)CC1 ZINC000110180505 209319343 /nfs/dbraw/zinc/31/93/43/209319343.db2.gz GAIYTYRIDVPWJC-DNVCBOLYSA-N 0 3 350.934 4.664 20 0 FJADHN O=C(Nc1cccc(CN2CCCCC2)c1)[C@H]1CCCC[C@H]1C(F)(F)F ZINC000107930157 209281242 /nfs/dbraw/zinc/28/12/42/209281242.db2.gz UVDVLZYKOASABE-ZWKOTPCHSA-N 0 3 368.443 4.980 20 0 FJADHN O=C(Nc1cccc(CN2CCCCC2)c1)[C@@H]1CCCC[C@@H]1C(F)(F)F ZINC000107930149 209281302 /nfs/dbraw/zinc/28/13/02/209281302.db2.gz UVDVLZYKOASABE-MSOLQXFVSA-N 0 3 368.443 4.980 20 0 FJADHN CN(CCC(=O)Nc1c(Cl)cccc1Cl)Cc1ccc(F)cc1 ZINC000012816594 220034091 /nfs/dbraw/zinc/03/40/91/220034091.db2.gz HDWSGDIIONUWCM-UHFFFAOYSA-N 0 3 355.240 4.593 20 0 FJADHN Cc1sc2ncnc(NC[C@H](c3ccco3)N3CCCCC3)c2c1C ZINC000008063498 207218741 /nfs/dbraw/zinc/21/87/41/207218741.db2.gz QQTOWUWPZNIJEC-OAHLLOKOSA-N 0 3 356.495 4.540 20 0 FJADHN CC(C)Cc1ccc(C(=O)N(c2ccccc2)C2CCN(C)CC2)cc1 ZINC000601961700 567887614 /nfs/dbraw/zinc/88/76/14/567887614.db2.gz HJANNEHYZALFHZ-UHFFFAOYSA-N 0 3 350.506 4.626 20 0 FJADHN COc1ccc(C2(NCc3ccc(Oc4cccnc4)c(C)c3)CC2)cc1 ZINC000602275565 567962364 /nfs/dbraw/zinc/96/23/64/567962364.db2.gz SZPAAZCDBWABAH-UHFFFAOYSA-N 0 3 360.457 4.970 20 0 FJADHN C[C@H](CN[C@@H]1CCCOc2cc(Br)ccc21)c1nccs1 ZINC000186753233 567979694 /nfs/dbraw/zinc/97/96/94/567979694.db2.gz QPPUDPHTFGXNIE-BXUZGUMPSA-N 0 3 367.312 4.513 20 0 FJADHN C[C@H](c1ccccc1Cl)N1CCC[C@H](c2nnc3n2CCCCC3)C1 ZINC000521422189 567989281 /nfs/dbraw/zinc/98/92/81/567989281.db2.gz DXKSCAFZYDGTIO-CVEARBPZSA-N 0 3 358.917 4.599 20 0 FJADHN C[C@H](N[C@H]1CCc2nc(-c3ccccc3)ncc2C1)c1ccc(F)cc1F ZINC000602584118 567994180 /nfs/dbraw/zinc/99/41/80/567994180.db2.gz NJWWVKKJEUZGIG-KSSFIOAISA-N 0 3 365.427 4.630 20 0 FJADHN O=C(NC1CC1)c1cccc(CN[C@@H](Cc2ccccc2)c2ccccc2)c1 ZINC000602567263 567995724 /nfs/dbraw/zinc/99/57/24/567995724.db2.gz MEQOAGSTCLNIPH-DEOSSOPVSA-N 0 3 370.496 4.652 20 0 FJADHN CC[C@H](NCc1ccc(OCCN(C)C)cc1)c1cccc(Cl)c1F ZINC000461108038 568005588 /nfs/dbraw/zinc/00/55/88/568005588.db2.gz LONCLJGKJSSSBQ-IBGZPJMESA-N 0 3 364.892 4.660 20 0 FJADHN FC(F)Oc1cccc(Cl)c1CNCCc1cccc2cccnc21 ZINC000602902992 568015657 /nfs/dbraw/zinc/01/56/57/568015657.db2.gz XFAQZJMYLSAZQN-UHFFFAOYSA-N 0 3 362.807 4.822 20 0 FJADHN Cc1cc2c(cc1C)[C@@H](NCc1ccc(N3CCCC3)nc1)CCS2 ZINC000186986298 568037165 /nfs/dbraw/zinc/03/71/65/568037165.db2.gz LIQWMBTZKSFOLN-IBGZPJMESA-N 0 3 353.535 4.625 20 0 FJADHN C[C@@H](NC(C)(C)CNC(=O)C(C)(C)Cc1ccccc1)c1ccccc1 ZINC000522762515 568075431 /nfs/dbraw/zinc/07/54/31/568075431.db2.gz OUSPGADBQQZZDK-GOSISDBHSA-N 0 3 352.522 4.501 20 0 FJADHN COc1ccc(COCCN[C@H](c2cccnc2)C2CCCCC2)cc1 ZINC000603410495 568097852 /nfs/dbraw/zinc/09/78/52/568097852.db2.gz DQGDIKPSNNFILF-QFIPXVFZSA-N 0 3 354.494 4.518 20 0 FJADHN CCCCc1ccc(C(=O)N(C)C2CCN(Cc3ccccc3)CC2)cc1 ZINC000603451001 568099437 /nfs/dbraw/zinc/09/94/37/568099437.db2.gz MDSPCTKAVFJYHB-UHFFFAOYSA-N 0 3 364.533 4.766 20 0 FJADHN C[C@@H](C[C@@H]1CCCO1)NCc1csc(-c2ccc(C(F)(F)F)cc2)n1 ZINC000603512676 568110968 /nfs/dbraw/zinc/11/09/68/568110968.db2.gz CXAAERYAYOIZDI-LRDDRELGSA-N 0 3 370.440 4.876 20 0 FJADHN c1nc2cc(CN[C@H]3CCOc4c(-c5ccccc5)cccc43)ccc2[nH]1 ZINC000603518669 568112093 /nfs/dbraw/zinc/11/20/93/568112093.db2.gz IMIASXAGJJGQGK-FQEVSTJZSA-N 0 3 355.441 4.843 20 0 FJADHN c1nc2ccc(CN[C@H]3CCOc4c(-c5ccccc5)cccc43)cc2[nH]1 ZINC000603518669 568112094 /nfs/dbraw/zinc/11/20/94/568112094.db2.gz IMIASXAGJJGQGK-FQEVSTJZSA-N 0 3 355.441 4.843 20 0 FJADHN CCOC(=O)CCCCCN1CCc2sccc2[C@@H]1c1cccs1 ZINC000522775897 568132016 /nfs/dbraw/zinc/13/20/16/568132016.db2.gz KVPIPUJZNWFEDC-LJQANCHMSA-N 0 3 363.548 4.881 20 0 FJADHN c1ccc(-c2ncc(CNCCCO[C@@H]3CCCc4ccccc43)cn2)cc1 ZINC000603723583 568142176 /nfs/dbraw/zinc/14/21/76/568142176.db2.gz IDDWRHRBZNYQFU-HSZRJFAPSA-N 0 3 373.500 4.718 20 0 FJADHN Cc1ccc(CNC2(c3cccc(Br)c3)CCOCC2)cc1C ZINC000603824563 568150862 /nfs/dbraw/zinc/15/08/62/568150862.db2.gz DOSZZTOKVCXHNH-UHFFFAOYSA-N 0 3 374.322 4.861 20 0 FJADHN CCN(CC)Cc1cccc(NC(=O)[C@H](C)SCc2ccccc2)c1 ZINC000603755783 568152454 /nfs/dbraw/zinc/15/24/54/568152454.db2.gz YCBGAHFQWKDZBM-KRWDZBQOSA-N 0 3 356.535 4.789 20 0 FJADHN CCSCc1ccc(C(=O)N[C@H](CN2CCCC2)c2ccccc2)cc1 ZINC000603954895 568189302 /nfs/dbraw/zinc/18/93/02/568189302.db2.gz JYWULICBYSVZMM-OAQYLSRUSA-N 0 3 368.546 4.507 20 0 FJADHN CCCOc1ccccc1NCc1ccc(OCCN2CCCC2)cc1 ZINC000604068356 568205860 /nfs/dbraw/zinc/20/58/60/568205860.db2.gz JGERQHJEOQBNBM-UHFFFAOYSA-N 0 3 354.494 4.562 20 0 FJADHN CC(C)c1ccc(CNCCc2nc(-c3cccc(Cl)c3)no2)cc1 ZINC000604069812 568206126 /nfs/dbraw/zinc/20/61/26/568206126.db2.gz LEMOCSFCOXVIJN-UHFFFAOYSA-N 0 3 355.869 4.846 20 0 FJADHN O=C(NC[C@H]1CCCN1Cc1ccccc1)Nc1cccc2ccccc21 ZINC000604072173 568210431 /nfs/dbraw/zinc/21/04/31/568210431.db2.gz MISIPKPCINHIIS-HXUWFJFHSA-N 0 3 359.473 4.626 20 0 FJADHN Cc1cc(C)c(NC(=O)NC[C@H]2CCCN2Cc2ccccc2)c(Cl)c1 ZINC000604092302 568211832 /nfs/dbraw/zinc/21/18/32/568211832.db2.gz IIUPSXRGEPIUFQ-GOSISDBHSA-N 0 3 371.912 4.743 20 0 FJADHN Cc1ccc(-c2nc(CCNCc3ccccc3Br)co2)cc1 ZINC000303103375 568253704 /nfs/dbraw/zinc/25/37/04/568253704.db2.gz DDRRAHZTJFKKRT-UHFFFAOYSA-N 0 3 371.278 4.745 20 0 FJADHN COc1ccccc1[C@@H]1CCCN1CCC(=O)Nc1ccccc1SC ZINC000303181455 568256101 /nfs/dbraw/zinc/25/61/01/568256101.db2.gz KUCBBLLNWJVWSQ-SFHVURJKSA-N 0 3 370.518 4.583 20 0 FJADHN CC(C)(C)c1ccc(CNCc2ccnc(OCC(F)(F)F)c2)cc1 ZINC000303202438 568257308 /nfs/dbraw/zinc/25/73/08/568257308.db2.gz OVMSVULZNKBFMP-UHFFFAOYSA-N 0 3 352.400 4.610 20 0 FJADHN Fc1cccc(F)c1-c1ccc(CNC[C@@H]2OCCc3ccccc32)o1 ZINC000604416606 568274699 /nfs/dbraw/zinc/27/46/99/568274699.db2.gz OAXGBEGWNCWIPR-FQEVSTJZSA-N 0 3 355.384 4.628 20 0 FJADHN Cc1cccnc1[C@@H](NCc1cccc(OCc2ccccn2)c1)C(C)C ZINC000604417160 568275284 /nfs/dbraw/zinc/27/52/84/568275284.db2.gz JIROQNCMPMMMLS-QFIPXVFZSA-N 0 3 361.489 4.851 20 0 FJADHN CSc1ccc2c(c1)[C@H](N[C@H](C)c1ccc([S@@](C)=O)cc1)CCC2 ZINC000563136268 568275314 /nfs/dbraw/zinc/27/53/14/568275314.db2.gz QVIWYKHDHOIOSR-UHXKVLTISA-N 0 3 359.560 4.874 20 0 FJADHN Cc1ccc(-c2ncc(CNCCc3cnn(-c4ccccc4)c3)s2)cc1 ZINC000604414849 568279580 /nfs/dbraw/zinc/27/95/80/568279580.db2.gz FNXZYOLHWIVFOV-UHFFFAOYSA-N 0 3 374.513 4.637 20 0 FJADHN CCOc1ccc(-c2noc(CN3C[C@H](c4ccccc4)C[C@H]3C)n2)cc1 ZINC000604392919 568283119 /nfs/dbraw/zinc/28/31/19/568283119.db2.gz KPBVUEVTBNSTDA-VQIMIIECSA-N 0 3 363.461 4.513 20 0 FJADHN Cc1sc2nc([C@H](C)N3C[C@H](c4ccccc4)C[C@@H]3C)nc(N)c2c1C ZINC000604393907 568283778 /nfs/dbraw/zinc/28/37/78/568283778.db2.gz QLAQENNSSBCOIA-RVSPLBMKSA-N 0 3 366.534 4.829 20 0 FJADHN C[C@@H]1C[C@@H](c2ccccc2)CN1Cc1coc(-c2ccc(F)c(F)c2)n1 ZINC000604394104 568284079 /nfs/dbraw/zinc/28/40/79/568284079.db2.gz AYPGDAOOLAETGN-RHSMWYFYSA-N 0 3 354.400 4.998 20 0 FJADHN CC[C@@H](N[C@@H](C)c1ccc(S(=O)(=O)N(CC)CC)cc1)c1ccccc1 ZINC000303508285 568285021 /nfs/dbraw/zinc/28/50/21/568285021.db2.gz NLHSPMUNMUWWGB-LAUBAEHRSA-N 0 3 374.550 4.519 20 0 FJADHN CC1CCC(N2CCN(C(=O)Nc3cccc(Cl)c3Cl)CC2)CC1 ZINC000604609074 568326598 /nfs/dbraw/zinc/32/65/98/568326598.db2.gz QSUVCILHYBDCFC-UHFFFAOYSA-N 0 3 370.324 4.722 20 0 FJADHN Cc1ccc([C@@H](CNC(=O)Nc2ccccc2OC(C)(C)C)N(C)C)cc1 ZINC000604630501 568332093 /nfs/dbraw/zinc/33/20/93/568332093.db2.gz AVWNHVFXMHCGKQ-LJQANCHMSA-N 0 3 369.509 4.597 20 0 FJADHN CC[C@H](C)c1ccc([C@H](NC(=O)N(C)C[C@@H]2CCCN(C)C2)C(C)C)cc1 ZINC000604634362 568333198 /nfs/dbraw/zinc/33/31/98/568333198.db2.gz SCWNASVOBXXCHV-NNMXDRDESA-N 0 3 373.585 4.880 20 0 FJADHN CC(C)[C@H](NC(=O)N1CCCN(C(C)(C)C)CC1)c1ccccc1Cl ZINC000604657088 568339964 /nfs/dbraw/zinc/33/99/64/568339964.db2.gz BLBCZPZBTXCOLL-SFHVURJKSA-N 0 3 365.949 4.553 20 0 FJADHN CCN(CC)Cc1cccc(NC(=O)[C@@H]2C[C@H]2c2c(F)cccc2F)c1 ZINC000604699767 568347547 /nfs/dbraw/zinc/34/75/47/568347547.db2.gz HGHLYFJDXYRKBR-IAGOWNOFSA-N 0 3 358.432 4.549 20 0 FJADHN Cc1ccccc1[C@H](C)CC(=O)N(c1ccccc1)C1CCN(C)CC1 ZINC000604701284 568347918 /nfs/dbraw/zinc/34/79/18/568347918.db2.gz KXSKHBQCADRNQE-LJQANCHMSA-N 0 3 350.506 4.616 20 0 FJADHN C[C@H](CC(=O)NCC(C)(C)N[C@@H](C)c1ccccc1)c1cccc(F)c1 ZINC000604744935 568356030 /nfs/dbraw/zinc/35/60/30/568356030.db2.gz TUNGBVDRKTUNDC-SJORKVTESA-N 0 3 356.485 4.565 20 0 FJADHN O[C@@H]([C@H](Cc1ccccc1)NCc1csc2ccccc12)C(F)(F)F ZINC000604764909 568361726 /nfs/dbraw/zinc/36/17/26/568361726.db2.gz CAEPKYLDABHXEE-WMZOPIPTSA-N 0 3 365.420 4.525 20 0 FJADHN C[C@](CO)(NCc1ccc2ccccc2c1)c1cccc(C(F)(F)F)c1 ZINC000604767297 568362292 /nfs/dbraw/zinc/36/22/92/568362292.db2.gz IBBJPDKWNJZIBC-HXUWFJFHSA-N 0 3 359.391 4.856 20 0 FJADHN CN(C)C(=O)[C@H](NCC1(Sc2ccccc2)CCCC1)c1ccccc1 ZINC000604773759 568363719 /nfs/dbraw/zinc/36/37/19/568363719.db2.gz WQWUOSWOOHMGQV-HXUWFJFHSA-N 0 3 368.546 4.511 20 0 FJADHN C[C@@H](CN[C@@H](C(=O)N(C)C)c1ccccc1)c1c(Cl)cccc1Cl ZINC000604773798 568363863 /nfs/dbraw/zinc/36/38/63/568363863.db2.gz YVLRBEIGWPWGJK-SCLBCKFNSA-N 0 3 365.304 4.516 20 0 FJADHN C[C@H](c1ccccc1)N1CCC(NC(=O)N2CCC[C@@H]2C2CCCC2)CC1 ZINC000604788356 568367033 /nfs/dbraw/zinc/36/70/33/568367033.db2.gz RTGPFMHYZHELDM-XMSQKQJNSA-N 0 3 369.553 4.576 20 0 FJADHN C[C@@H](c1ccccc1)N1CCC(NC(=O)Nc2cccc(Cl)c2)CC1 ZINC000604775045 568368932 /nfs/dbraw/zinc/36/89/32/568368932.db2.gz TYTGOJIGKHXNRK-HNNXBMFYSA-N 0 3 357.885 4.687 20 0 FJADHN C[C@H](N[C@H](Cc1ccccc1)c1cccs1)C(=O)N[C@@H]1CCCC[C@H]1C ZINC000604892083 568382083 /nfs/dbraw/zinc/38/20/83/568382083.db2.gz JGHLUCKTIJNQDE-PIKOESSRSA-N 0 3 370.562 4.705 20 0 FJADHN CN(C)Cc1ccc(C(=O)Nc2nc(/C=C\c3ccccc3)cs2)cc1 ZINC000604963145 568428667 /nfs/dbraw/zinc/42/86/67/568428667.db2.gz ZRXGCJWGVZHJMO-RAXLEYEMSA-N 0 3 363.486 4.627 20 0 FJADHN Cc1cc([C@H]2CCCN2CC/C=C\c2ccc(Br)cc2)on1 ZINC000604997226 568507814 /nfs/dbraw/zinc/50/78/14/568507814.db2.gz BCZLTYJFYSFWDJ-OMUXJLDVSA-N 0 3 361.283 4.986 20 0 FJADHN CCCOc1ccc(O[C@H]2CCCC[C@@H]2NCc2nc(C)cs2)cc1 ZINC000605008477 568515844 /nfs/dbraw/zinc/51/58/44/568515844.db2.gz XCXCYJOKKZILMJ-OALUTQOASA-N 0 3 360.523 4.720 20 0 FJADHN Cc1csc(CCNCc2cnn(C3CCCC3)c2-c2ccccc2)n1 ZINC000643287222 568543549 /nfs/dbraw/zinc/54/35/49/568543549.db2.gz PYLNCNLBNZNSQE-UHFFFAOYSA-N 0 3 366.534 4.762 20 0 FJADHN CCc1ccc([C@H]2CCCN2C(=O)c2ccc(CN(CC)C3CC3)cc2)o1 ZINC000605097081 568563428 /nfs/dbraw/zinc/56/34/28/568563428.db2.gz GQLVDXZFOSUWSO-OAQYLSRUSA-N 0 3 366.505 4.804 20 0 FJADHN CC(C)CCC(=O)NC[C@H]1CCCN(C)[C@H]1c1ccc(C(F)(F)F)cc1 ZINC000605102807 568566233 /nfs/dbraw/zinc/56/62/33/568566233.db2.gz GQJPMMIBNLKDJM-APWZRJJASA-N 0 3 370.459 4.641 20 0 FJADHN c1csc(-c2noc(CCCN3CCS[C@@H](c4ccccc4)C3)n2)c1 ZINC000605155671 568600987 /nfs/dbraw/zinc/60/09/87/568600987.db2.gz XKGYZIVQWMREHH-QGZVFWFLSA-N 0 3 371.531 4.521 20 0 FJADHN C[C@@H](C(=O)NC[C@@H](c1cccs1)N1CCC(C)CC1)c1cccs1 ZINC000606163079 568681491 /nfs/dbraw/zinc/68/14/91/568681491.db2.gz WLZVXBICTRTZEP-CVEARBPZSA-N 0 3 362.564 4.503 20 0 FJADHN O=C(CC/C=C/c1ccccc1)NCc1ccccc1CN1CCCCC1 ZINC000606164538 568682658 /nfs/dbraw/zinc/68/26/58/568682658.db2.gz MGHGWISSAAHRIA-WLRTZDKTSA-N 0 3 362.517 4.782 20 0 FJADHN CCc1ccc([C@H](C)CC(=O)N(c2ccccc2)C2CCN(C)CC2)cc1 ZINC000606177983 568693184 /nfs/dbraw/zinc/69/31/84/568693184.db2.gz ZNPRBOXASSHSJA-LJQANCHMSA-N 0 3 364.533 4.870 20 0 FJADHN Fc1cccc(CN2CC[C@]23CCCN(c2ccc4ccccc4n2)C3)c1 ZINC001164994243 722191910 /nfs/dbraw/zinc/19/19/10/722191910.db2.gz LZENCGKEHQDJRF-QHCPKHFHSA-N 0 3 361.464 4.619 20 0 FJADHN Cc1ccc(NC(=O)[C@@H]2CCCN(Cc3cccc(F)c3)C2)c(Cl)c1 ZINC000109016966 209295501 /nfs/dbraw/zinc/29/55/01/209295501.db2.gz MIQBJWQDZAIQLY-MRXNPFEDSA-N 0 3 360.860 4.638 20 0 FJADHN c1ccc(CCN(Cc2ccncc2)CC2=Cc3ccccc3OC2)cc1 ZINC000013990123 220100162 /nfs/dbraw/zinc/10/01/62/220100162.db2.gz XOQLCOOAUGBHOY-UHFFFAOYSA-N 0 3 356.469 4.602 20 0 FJADHN CC(C)[C@H](NCc1cccc(C(F)(F)F)c1)c1ccc2c(c1)OCCO2 ZINC000061016029 221133806 /nfs/dbraw/zinc/13/38/06/221133806.db2.gz VETDEARQMCWKQL-IBGZPJMESA-N 0 3 365.395 4.964 20 0 FJADHN CN(C)Cc1ccc(CNC(=O)CC(c2ccccc2)c2ccccc2)cc1 ZINC000008062812 567864508 /nfs/dbraw/zinc/86/45/08/567864508.db2.gz NIOGKNHXHDXWQA-UHFFFAOYSA-N 0 3 372.512 4.587 20 0 FJADHN CC(C)c1ccccc1NC(=O)N(CCN(C)C)Cc1cccc(F)c1 ZINC000062372756 567950040 /nfs/dbraw/zinc/95/00/40/567950040.db2.gz NCVIFYRFYCSVHV-UHFFFAOYSA-N 0 3 357.473 4.545 20 0 FJADHN CC(C)n1cc(CN[C@H](c2ccc(Br)cc2)C2CCC2)cn1 ZINC000602276945 567962473 /nfs/dbraw/zinc/96/24/73/567962473.db2.gz VPDVHVDQFQJTDH-SFHVURJKSA-N 0 3 362.315 4.858 20 0 FJADHN C[C@H](NCC1CCN(C(=O)C(C)(C)C)CC1)c1cc(Cl)ccc1Cl ZINC000186772692 567981921 /nfs/dbraw/zinc/98/19/21/567981921.db2.gz ZLYRPLRXHHGEMM-ZDUSSCGKSA-N 0 3 371.352 4.929 20 0 FJADHN Cc1oc(-c2ccccc2)nc1CN1CCC[C@@H]1Cc1cccc(F)c1 ZINC000521424443 567994973 /nfs/dbraw/zinc/99/49/73/567994973.db2.gz DCFYSXGIHCITPT-HXUWFJFHSA-N 0 3 350.437 4.996 20 0 FJADHN O=C(NC1CC1)c1cccc(CN[C@H](Cc2ccccc2)c2ccccc2)c1 ZINC000602567270 567995732 /nfs/dbraw/zinc/99/57/32/567995732.db2.gz MEQOAGSTCLNIPH-XMMPIXPASA-N 0 3 370.496 4.652 20 0 FJADHN CC(C)NC(=O)Nc1ccc([C@@H](C)N[C@H](C)c2ccc(F)c(F)c2)cc1 ZINC000602570267 567995991 /nfs/dbraw/zinc/99/59/91/567995991.db2.gz SOPKELKTYMTZRJ-ZIAGYGMSSA-N 0 3 361.436 4.907 20 0 FJADHN FC(F)Oc1ccc([C@H](N[C@@H]2C[C@H]3OCCC[C@H]23)c2ccccc2)cc1 ZINC000186937104 568017664 /nfs/dbraw/zinc/01/76/64/568017664.db2.gz KNXPSPQQBVKDGJ-UAFMIMERSA-N 0 3 359.416 4.535 20 0 FJADHN Cc1cc2c(cc1C)[C@@H](NCc1ccc(Cn3ccnc3)cc1)CCS2 ZINC000186992042 568040042 /nfs/dbraw/zinc/04/00/42/568040042.db2.gz CMUWAHZMYZNRAY-NRFANRHFSA-N 0 3 363.530 4.875 20 0 FJADHN OC[C@H]1[C@@H]2CN(Cc3ccc(N(c4ccccc4)c4ccccc4)cc3)C[C@H]12 ZINC000644836586 568071778 /nfs/dbraw/zinc/07/17/78/568071778.db2.gz CVDWGXXKVYGKPF-LNWKWYTESA-N 0 3 370.496 4.827 20 0 FJADHN C[C@@H](c1nc(-c2cccnc2)no1)N1CCC[C@@H](c2cc3ccccc3[nH]2)C1 ZINC000603410034 568097798 /nfs/dbraw/zinc/09/77/98/568097798.db2.gz XRJLLCJYOZBCNH-MAUKXSAKSA-N 0 3 373.460 4.554 20 0 FJADHN c1nc2cc(CN[C@@H]3CCOc4c(-c5ccccc5)cccc43)ccc2[nH]1 ZINC000603518670 568112121 /nfs/dbraw/zinc/11/21/21/568112121.db2.gz IMIASXAGJJGQGK-HXUWFJFHSA-N 0 3 355.441 4.843 20 0 FJADHN c1nc2ccc(CN[C@@H]3CCOc4c(-c5ccccc5)cccc43)cc2[nH]1 ZINC000603518670 568112122 /nfs/dbraw/zinc/11/21/22/568112122.db2.gz IMIASXAGJJGQGK-HXUWFJFHSA-N 0 3 355.441 4.843 20 0 FJADHN c1ccc(-c2cccc(CNCc3ccnc(OC4CCOCC4)c3)c2)cc1 ZINC000603518580 568112156 /nfs/dbraw/zinc/11/21/56/568112156.db2.gz UQOMSNLKUPZEGO-UHFFFAOYSA-N 0 3 374.484 4.596 20 0 FJADHN COc1ccc(-c2cc(CN(C)CCc3ccc(Cl)cc3)on2)cc1 ZINC000603498321 568112372 /nfs/dbraw/zinc/11/23/72/568112372.db2.gz SFGBZZWFHLFDAF-UHFFFAOYSA-N 0 3 356.853 4.678 20 0 FJADHN CCN(CC)Cc1cccc(NC(=O)[C@@H](C)SCc2ccccc2)c1 ZINC000603755784 568152431 /nfs/dbraw/zinc/15/24/31/568152431.db2.gz YCBGAHFQWKDZBM-QGZVFWFLSA-N 0 3 356.535 4.789 20 0 FJADHN COC(=O)c1c(CN(C)CC2CC2)nc2ccccc2c1-c1ccccc1 ZINC000603855554 568167849 /nfs/dbraw/zinc/16/78/49/568167849.db2.gz AVRFUZKIMXAHCA-UHFFFAOYSA-N 0 3 360.457 4.530 20 0 FJADHN C[C@@H](N[C@@H]1CCC[C@@H]2C[C@@H]21)c1nnc(-c2ccc(Cl)c(Cl)c2)o1 ZINC000563109355 568197628 /nfs/dbraw/zinc/19/76/28/568197628.db2.gz YIMOTAHNDRQTCQ-DSKWVYQCSA-N 0 3 352.265 4.883 20 0 FJADHN O=C(N[C@H](c1ccc(F)cc1)C1CCC1)c1cccc(CN2CCCC2)c1 ZINC000303285202 568264337 /nfs/dbraw/zinc/26/43/37/568264337.db2.gz VQWAMZSHIGWAHA-QFIPXVFZSA-N 0 3 366.480 4.693 20 0 FJADHN CN(C[C@@H]1CCCN(C)C1)C(=O)c1sc2cccc(Cl)c2c1Cl ZINC000604346954 568264684 /nfs/dbraw/zinc/26/46/84/568264684.db2.gz GGRKFVFMDNLYSP-LLVKDONJSA-N 0 3 371.333 4.622 20 0 FJADHN Cc1ccc(-c2nc(CCNCc3cccc(Br)c3)co2)cc1 ZINC000303304149 568265720 /nfs/dbraw/zinc/26/57/20/568265720.db2.gz QPHSPMHISWVXRV-UHFFFAOYSA-N 0 3 371.278 4.745 20 0 FJADHN Cc1c(F)cccc1-c1ccc(CNC2CCN(C(=O)C(C)(C)C)CC2)o1 ZINC000604415082 568280027 /nfs/dbraw/zinc/28/00/27/568280027.db2.gz NBTXVOMAEZEQAE-UHFFFAOYSA-N 0 3 372.484 4.521 20 0 FJADHN CSCCNCc1cn(-c2ccccc2)nc1-c1ccc(C)cc1C ZINC000604478461 568299989 /nfs/dbraw/zinc/29/99/89/568299989.db2.gz BRIZYJVONXAERO-UHFFFAOYSA-N 0 3 351.519 4.609 20 0 FJADHN CC(C)Cc1ccc([C@H](NC(=O)N(C)C[C@@H]2CCCN(C)C2)C(C)C)cc1 ZINC000604634216 568333131 /nfs/dbraw/zinc/33/31/31/568333131.db2.gz JEQZTQYSDDLRPU-IFMALSPDSA-N 0 3 373.585 4.565 20 0 FJADHN C[C@H](c1ccccc1)N1CCC(NC(=O)c2ccc(-c3ccccc3)[nH]2)CC1 ZINC000604712518 568355003 /nfs/dbraw/zinc/35/50/03/568355003.db2.gz CXYLIYZJANVJKV-GOSISDBHSA-N 0 3 373.500 4.637 20 0 FJADHN CC[C@H](CC(=O)NC1CCN([C@@H](C)c2ccccc2)CC1)c1ccccc1 ZINC000604713766 568355171 /nfs/dbraw/zinc/35/51/71/568355171.db2.gz HUYZMIHTGCTXDY-VQTJNVASSA-N 0 3 364.533 4.912 20 0 FJADHN C[C@H](CC(=O)NC1CCN([C@H](C)c2ccccc2)CC1)c1ccccc1 ZINC000604714500 568355445 /nfs/dbraw/zinc/35/54/45/568355445.db2.gz WSKHQRLDWCCGCB-RTBURBONSA-N 0 3 350.506 4.522 20 0 FJADHN C[C@@H](c1ccccc1)N1CCC(NC(=O)Nc2cccc(C(F)F)c2)CC1 ZINC000604799665 568370490 /nfs/dbraw/zinc/37/04/90/568370490.db2.gz ZRIXMFNGBJGCDJ-HNNXBMFYSA-N 0 3 373.447 4.971 20 0 FJADHN Cc1cccc(NC(=O)[C@H](C)N[C@@H](Cc2ccccc2)c2cccs2)c1 ZINC000604892309 568382097 /nfs/dbraw/zinc/38/20/97/568382097.db2.gz PDXKLRHBBJJNLF-PXNSSMCTSA-N 0 3 364.514 4.957 20 0 FJADHN Cc1ccccc1NC(=O)[C@H](C)NCC(c1ccccc1)c1ccccc1 ZINC000011046333 568483093 /nfs/dbraw/zinc/48/30/93/568483093.db2.gz NSUSJPWOMWMAFH-IBGZPJMESA-N 0 3 358.485 4.744 20 0 FJADHN Cc1cc([C@@H]2CCCN2CC/C=C\c2ccc(Br)cc2)on1 ZINC000604997225 568507861 /nfs/dbraw/zinc/50/78/61/568507861.db2.gz BCZLTYJFYSFWDJ-NCSHICFUSA-N 0 3 361.283 4.986 20 0 FJADHN Cc1cc([C@H]2CCCN2CC/C=C/c2ccc(Br)cc2)on1 ZINC000604997228 568507898 /nfs/dbraw/zinc/50/78/98/568507898.db2.gz BCZLTYJFYSFWDJ-WAUBUAMCSA-N 0 3 361.283 4.986 20 0 FJADHN CCCOc1ccc(O[C@H]2CCCC[C@H]2NCc2nc(C)cs2)cc1 ZINC000605008476 568515813 /nfs/dbraw/zinc/51/58/13/568515813.db2.gz XCXCYJOKKZILMJ-MOPGFXCFSA-N 0 3 360.523 4.720 20 0 FJADHN CCCOc1ccc(O[C@@H]2CCCC[C@H]2NCc2nc(C)cs2)cc1 ZINC000605008479 568515980 /nfs/dbraw/zinc/51/59/80/568515980.db2.gz XCXCYJOKKZILMJ-RTBURBONSA-N 0 3 360.523 4.720 20 0 FJADHN Cc1onc(-c2ccccc2)c1-c1nnc(CN2CCCC[C@H]2C(C)C)o1 ZINC000605026526 568531460 /nfs/dbraw/zinc/53/14/60/568531460.db2.gz ZQPSIBBEMXLARA-KRWDZBQOSA-N 0 3 366.465 4.711 20 0 FJADHN CCC(C)(C)C(=O)NC[C@@H]1CCCN(C)[C@@H]1c1ccc(C(F)(F)F)cc1 ZINC000605102425 568566106 /nfs/dbraw/zinc/56/61/06/568566106.db2.gz HAXHSOVJFLBYOC-DOTOQJQBSA-N 0 3 370.459 4.641 20 0 FJADHN C[C@H](C(=O)NC[C@H](c1cccs1)N1CCC(C)CC1)c1cccs1 ZINC000606163089 568681455 /nfs/dbraw/zinc/68/14/55/568681455.db2.gz WLZVXBICTRTZEP-JKSUJKDBSA-N 0 3 362.564 4.503 20 0 FJADHN C[C@@H](Cc1ccccc1F)C(=O)Nc1cccc(CN2CCCCC2)c1 ZINC000606174654 568690523 /nfs/dbraw/zinc/69/05/23/568690523.db2.gz YHRKQFLUSCIBSB-KRWDZBQOSA-N 0 3 354.469 4.629 20 0 FJADHN Cc1cc2c(ccnc2N2CCC[C@]3(CCN3Cc3cccc(F)c3)C2)o1 ZINC001164994082 722210282 /nfs/dbraw/zinc/21/02/82/722210282.db2.gz FJNGVTDZVOKBFU-QFIPXVFZSA-N 0 3 365.452 4.520 20 0 FJADHN Brc1ccc(CNCc2ccc(Br)cc2)s1 ZINC000037982967 208197070 /nfs/dbraw/zinc/19/70/70/208197070.db2.gz GFWKHQDJUZINGA-UHFFFAOYSA-N 0 3 361.102 4.563 20 0 FJADHN CCN(CC)[C@H](CNCc1nc(C)cs1)c1ccc(C(F)(F)F)cc1 ZINC000236898939 567854080 /nfs/dbraw/zinc/85/40/80/567854080.db2.gz CPPROGGQJSAAQE-MRXNPFEDSA-N 0 3 371.472 4.643 20 0 FJADHN c1[nH]nc(-c2ccccc2)c1CNCc1cccc(OCc2ccccc2)c1 ZINC000061044347 567860050 /nfs/dbraw/zinc/86/00/50/567860050.db2.gz XVWXWHSNDPNROG-UHFFFAOYSA-N 0 3 369.468 4.946 20 0 FJADHN CN1CCC(N(C(=O)c2cc(Cl)cc(Cl)c2)c2ccccc2)CC1 ZINC000601961600 567887598 /nfs/dbraw/zinc/88/75/98/567887598.db2.gz FKBMMDZKVZDPNH-UHFFFAOYSA-N 0 3 363.288 4.734 20 0 FJADHN CC[C@@H](Cc1ccccc1)C(=O)NCc1ccccc1CN1CCCCC1 ZINC000601947431 567892108 /nfs/dbraw/zinc/89/21/08/567892108.db2.gz YEWWQWJMUIWVRN-NRFANRHFSA-N 0 3 364.533 4.558 20 0 FJADHN CCCCN(C)CCNC(=O)c1sc2cccc(Cl)c2c1Cl ZINC000602176764 567942022 /nfs/dbraw/zinc/94/20/22/567942022.db2.gz IXMCCDQQOSVFAB-UHFFFAOYSA-N 0 3 359.322 4.670 20 0 FJADHN CCc1ccc([C@@H](CNC(=O)Nc2cccc(CSC)c2)N(C)C)cc1 ZINC000609471091 567958945 /nfs/dbraw/zinc/95/89/45/567958945.db2.gz KYNGTIRQQSFGBI-HXUWFJFHSA-N 0 3 371.550 4.536 20 0 FJADHN C[C@@H](N[C@@H](C)c1ccc2c(c1)OCCO2)c1ccc(OC(F)(F)F)cc1 ZINC000602550727 567990693 /nfs/dbraw/zinc/99/06/93/567990693.db2.gz LXIDJZONDRNWID-OLZOCXBDSA-N 0 3 367.367 4.768 20 0 FJADHN CN(CCC(=O)Nc1ccccc1Cl)Cc1cccc(C(F)(F)F)c1 ZINC000521424420 567994979 /nfs/dbraw/zinc/99/49/79/567994979.db2.gz ARANQXHHJDLEMM-UHFFFAOYSA-N 0 3 370.802 4.819 20 0 FJADHN Cc1cc(C)n(-c2ccc(CN[C@H](c3ccc(C)cc3)C3CCC3)cn2)n1 ZINC000187022135 568001955 /nfs/dbraw/zinc/00/19/55/568001955.db2.gz NNQNARYVTBXNCQ-QHCPKHFHSA-N 0 3 360.505 4.824 20 0 FJADHN c1ccc(CN2CCC[C@H](SCc3nnc(-c4ccccc4)o3)C2)cc1 ZINC000521435105 568003924 /nfs/dbraw/zinc/00/39/24/568003924.db2.gz OVRWQNQJNJZQKR-IBGZPJMESA-N 0 3 365.502 4.634 20 0 FJADHN Cc1cc2c(cc1C)[C@@H](N[C@@H](C)c1ccc(-n3cncn3)cc1)CCS2 ZINC000186936989 568017644 /nfs/dbraw/zinc/01/76/44/568017644.db2.gz GKAYOEAVJHHQPE-JXFKEZNVSA-N 0 3 364.518 4.772 20 0 FJADHN CC(C)Cc1ccc(C(=O)N(C)C2CCN(Cc3ccccc3)CC2)cc1 ZINC000603452194 568099584 /nfs/dbraw/zinc/09/95/84/568099584.db2.gz WSRBHPYNKBEQBS-UHFFFAOYSA-N 0 3 364.533 4.622 20 0 FJADHN Clc1cnc2oc(CNc3cccc(CN4CCSCC4)c3)cc2c1 ZINC000648395402 568100742 /nfs/dbraw/zinc/10/07/42/568100742.db2.gz XGQMLRYPBBYALJ-UHFFFAOYSA-N 0 3 373.909 4.642 20 0 FJADHN CC[C@@H]1CCCCN1CCNC(=O)c1sc2cc(F)ccc2c1Cl ZINC000603472838 568103410 /nfs/dbraw/zinc/10/34/10/568103410.db2.gz QYVLCJWEAZAWLV-CYBMUJFWSA-N 0 3 368.905 4.688 20 0 FJADHN CC[C@H]1CCCCN1CCNC(=O)c1sc2cc(F)ccc2c1Cl ZINC000603472839 568103427 /nfs/dbraw/zinc/10/34/27/568103427.db2.gz QYVLCJWEAZAWLV-ZDUSSCGKSA-N 0 3 368.905 4.688 20 0 FJADHN C[C@@H]1CN(Cc2cccc(-c3ccccc3)c2)C[C@]2(CCO[C@H](C)C2)O1 ZINC000430780134 568104675 /nfs/dbraw/zinc/10/46/75/568104675.db2.gz JJZATIIJGSSZNC-DNVFCKCGSA-N 0 3 351.490 4.512 20 0 FJADHN CC[C@H](N[C@H](C)c1ccc(S(C)(=O)=O)cc1)c1ccc(Cl)cc1 ZINC000121748185 568110462 /nfs/dbraw/zinc/11/04/62/568110462.db2.gz KIWHZSOCEVSBSO-ACJLOTCBSA-N 0 3 351.899 4.545 20 0 FJADHN Brc1cccc(CCCNCc2csc(C3CC3)n2)c1 ZINC000603513933 568111282 /nfs/dbraw/zinc/11/12/82/568111282.db2.gz NIDNWLPSPPYQEH-UHFFFAOYSA-N 0 3 351.313 4.505 20 0 FJADHN CCCCCOc1cc(CNC[C@H]2OCCc3ccccc32)ccc1OC ZINC000603515887 568111552 /nfs/dbraw/zinc/11/15/52/568111552.db2.gz LXXITXWINHZNRE-HSZRJFAPSA-N 0 3 369.505 4.668 20 0 FJADHN CCCCOc1ccc(CNC[C@@H]2OCCc3ccccc32)cc1OCC ZINC000603516223 568111636 /nfs/dbraw/zinc/11/16/36/568111636.db2.gz PIBBMKKETXCDNB-QHCPKHFHSA-N 0 3 369.505 4.668 20 0 FJADHN FC(F)(F)c1cc(CNC[C@@H]2OCCc3ccccc32)ccc1Cl ZINC000603516499 568111691 /nfs/dbraw/zinc/11/16/91/568111691.db2.gz WQAVWWZEWQIZBN-KRWDZBQOSA-N 0 3 355.787 4.762 20 0 FJADHN FC(F)(F)c1cc(CNC[C@H]2OCCc3ccccc32)ccc1Cl ZINC000603516500 568111711 /nfs/dbraw/zinc/11/17/11/568111711.db2.gz WQAVWWZEWQIZBN-QGZVFWFLSA-N 0 3 355.787 4.762 20 0 FJADHN C[C@H](NCc1ccc(N(C)c2ccccc2)cc1)c1ccc(NC(N)=O)cc1 ZINC000603516718 568111719 /nfs/dbraw/zinc/11/17/19/568111719.db2.gz DRAAQXNURSFQFC-KRWDZBQOSA-N 0 3 374.488 4.796 20 0 FJADHN CCC(CC)N(Cc1nc(-c2ccc(Br)s2)no1)C1CC1 ZINC000603933002 568183541 /nfs/dbraw/zinc/18/35/41/568183541.db2.gz IRUUSSKESIHACI-UHFFFAOYSA-N 0 3 370.316 4.714 20 0 FJADHN Cn1cc(CNCc2coc3ccccc23)c(-c2cc3ccccc3o2)n1 ZINC000603949632 568186967 /nfs/dbraw/zinc/18/69/67/568186967.db2.gz YNRLVKDQSXYWJK-UHFFFAOYSA-N 0 3 357.413 4.869 20 0 FJADHN C[C@@H](N[C@H]1CCC[C@@H]2C[C@@H]21)c1nnc(-c2ccc(Cl)c(Cl)c2)o1 ZINC000563109356 568197658 /nfs/dbraw/zinc/19/76/58/568197658.db2.gz YIMOTAHNDRQTCQ-FCIGDQIPSA-N 0 3 352.265 4.883 20 0 FJADHN CC(C)(CNCc1ccccc1OCc1ccncc1)Oc1ccccc1 ZINC000604081048 568208888 /nfs/dbraw/zinc/20/88/88/568208888.db2.gz SEMVYEXGDDLQRR-UHFFFAOYSA-N 0 3 362.473 4.608 20 0 FJADHN CC(C)n1cc(C2=CCCN([C@H](C)c3cc4ccccc4o3)CC2)nn1 ZINC000563117990 568223384 /nfs/dbraw/zinc/22/33/84/568223384.db2.gz CIWGTTSHKSUSLI-MRXNPFEDSA-N 0 3 350.466 4.846 20 0 FJADHN C[C@@H](N[C@@H](C)c1ccc(S(C)(=O)=O)cc1)c1ccc(C(F)(F)F)cc1 ZINC000122277694 568225019 /nfs/dbraw/zinc/22/50/19/568225019.db2.gz DSWMTJSPAIOACK-OLZOCXBDSA-N 0 3 371.424 4.521 20 0 FJADHN C[C@H](N[C@@H](C)c1ccc(S(C)(=O)=O)cc1)c1ccc(C(F)(F)F)cc1 ZINC000122277548 568225032 /nfs/dbraw/zinc/22/50/32/568225032.db2.gz DSWMTJSPAIOACK-STQMWFEESA-N 0 3 371.424 4.521 20 0 FJADHN C[C@H](c1ccccc1)N(C)C(=O)N[C@@H](CN1CCCCC1)c1ccccc1 ZINC000604203710 568227937 /nfs/dbraw/zinc/22/79/37/568227937.db2.gz BPWOKYWDGSVHTA-KNQAVFIVSA-N 0 3 365.521 4.616 20 0 FJADHN CC1CCN([C@H](CNC(=O)C(C)(C)c2cccs2)c2ccccc2)CC1 ZINC000604317940 568246429 /nfs/dbraw/zinc/24/64/29/568246429.db2.gz RXCARMNEZNCVIS-LJQANCHMSA-N 0 3 370.562 4.615 20 0 FJADHN Brc1cc(CN[C@H](c2ccccc2)C2CCC2)cc2c1OCO2 ZINC000303303514 568265736 /nfs/dbraw/zinc/26/57/36/568265736.db2.gz ZFPBBBUEPYRPNV-GOSISDBHSA-N 0 3 374.278 4.809 20 0 FJADHN FC(F)(F)c1ccc(N2CC[C@@H](NCc3ccc(Cl)s3)C2)cc1 ZINC000604417432 568275667 /nfs/dbraw/zinc/27/56/67/568275667.db2.gz BLZHIKXEIRWUGU-GFCCVEGCSA-N 0 3 360.832 4.789 20 0 FJADHN Brc1ccccc1SCCCCNCc1nccs1 ZINC000604417829 568275739 /nfs/dbraw/zinc/27/57/39/568275739.db2.gz ZOHJXCDYDSFVBI-UHFFFAOYSA-N 0 3 357.342 4.568 20 0 FJADHN CN(C)Cc1cccc(NC(=O)[C@H]2C[C@H]2c2cccc(C(F)(F)F)c2)c1 ZINC000303438851 568278090 /nfs/dbraw/zinc/27/80/90/568278090.db2.gz HINUEMOARRGRGH-ROUUACIJSA-N 0 3 362.395 4.509 20 0 FJADHN C[C@@H]1C[C@@H](c2ccccc2)CN1Cc1nc(-c2ccc(Cl)cc2)no1 ZINC000604393225 568283206 /nfs/dbraw/zinc/28/32/06/568283206.db2.gz WNOUCJWHCDUSJO-RHSMWYFYSA-N 0 3 353.853 4.768 20 0 FJADHN C[C@H]1C[C@H](c2ccccc2)CN1Cc1coc(-c2ccc(F)c(F)c2)n1 ZINC000604394106 568284076 /nfs/dbraw/zinc/28/40/76/568284076.db2.gz AYPGDAOOLAETGN-YOEHRIQHSA-N 0 3 354.400 4.998 20 0 FJADHN C[C@H]1C[C@H](c2ccccc2)CN1Cc1nc(-c2cccc(Cl)c2)no1 ZINC000604394118 568284082 /nfs/dbraw/zinc/28/40/82/568284082.db2.gz BNKMUDOWTAIGKO-YOEHRIQHSA-N 0 3 353.853 4.768 20 0 FJADHN Cc1cc(C)c(NC(=O)[C@H](C)N2C[C@@H](c3ccccc3)C[C@@H]2C)c(C)c1 ZINC000604394473 568284380 /nfs/dbraw/zinc/28/43/80/568284380.db2.gz NTXQEOCGCKDQLJ-ZJOUEHCJSA-N 0 3 350.506 4.817 20 0 FJADHN CN(CCCNC(=O)Nc1ccccc1OC(C)(C)C)Cc1ccccc1 ZINC000604630244 568332018 /nfs/dbraw/zinc/33/20/18/568332018.db2.gz WNPNONAZJOPFTJ-UHFFFAOYSA-N 0 3 369.509 4.508 20 0 FJADHN CCN(CC)Cc1cccc(NC(=O)[C@@H]2C[C@@H]2c2c(F)cccc2F)c1 ZINC000604699766 568347560 /nfs/dbraw/zinc/34/75/60/568347560.db2.gz HGHLYFJDXYRKBR-DLBZAZTESA-N 0 3 358.432 4.549 20 0 FJADHN C[C@@H](c1ccccc1)N1CCC(NC(=O)c2csc3ccccc23)CC1 ZINC000604714300 568355357 /nfs/dbraw/zinc/35/53/57/568355357.db2.gz VDKBGUUUIBXUAV-INIZCTEOSA-N 0 3 364.514 4.857 20 0 FJADHN Cc1ccccc1[C@@H](C)CC(=O)NC[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000604742286 568359821 /nfs/dbraw/zinc/35/98/21/568359821.db2.gz RMMPFYBUMOJEKH-UNMCSNQZSA-N 0 3 364.533 4.517 20 0 FJADHN COc1cc(CNC2(c3ccc(Cl)cc3)CCCC2)cc2c1OCO2 ZINC000604765409 568361853 /nfs/dbraw/zinc/36/18/53/568361853.db2.gz OVKQICJIBCOIDR-UHFFFAOYSA-N 0 3 359.853 4.636 20 0 FJADHN OC[C@H](NCc1cn(Cc2ccccc2)c2ccccc12)c1ccc(F)cc1 ZINC000604769997 568362924 /nfs/dbraw/zinc/36/29/24/568362924.db2.gz GUSLBSGWXPWULZ-QHCPKHFHSA-N 0 3 374.459 4.652 20 0 FJADHN Fc1cccc(N2CCC[C@@H](NCc3nc(-c4ccccc4)cs3)C2)c1 ZINC000604772778 568363498 /nfs/dbraw/zinc/36/34/98/568363498.db2.gz XBOLEQNXAILMMN-GOSISDBHSA-N 0 3 367.493 4.708 20 0 FJADHN Cc1ccc(NC(=O)NC2CCN([C@@H](C)c3ccccc3)CC2)cc1C ZINC000604791548 568367587 /nfs/dbraw/zinc/36/75/87/568367587.db2.gz WZFJJSZLMOWDNA-SFHVURJKSA-N 0 3 351.494 4.651 20 0 FJADHN Cc1cc(Cl)ccc1NC(=O)NC1CCN([C@@H](C)c2ccccc2)CC1 ZINC000604792253 568367732 /nfs/dbraw/zinc/36/77/32/568367732.db2.gz SWSWGMDHZHOOQZ-INIZCTEOSA-N 0 3 371.912 4.996 20 0 FJADHN C[C@@H](N[C@H](Cc1ccccc1)c1cccs1)C(=O)N(C)c1ccccc1 ZINC000604891858 568381931 /nfs/dbraw/zinc/38/19/31/568381931.db2.gz CBXYTUDFFHFUMJ-YLJYHZDGSA-N 0 3 364.514 4.673 20 0 FJADHN CC(C)N(C(=O)[C@H](C)N[C@H](Cc1ccccc1)c1cccs1)C(C)C ZINC000604892611 568383150 /nfs/dbraw/zinc/38/31/50/568383150.db2.gz YVHFPCZPGKXZCJ-PKOBYXMFSA-N 0 3 358.551 4.655 20 0 FJADHN CC(C)(NCc1ccc(-n2ccc(C(F)(F)F)n2)cc1)c1cccs1 ZINC000604892713 568384450 /nfs/dbraw/zinc/38/44/50/568384450.db2.gz UZZRVTXOBPFVIZ-UHFFFAOYSA-N 0 3 365.424 4.978 20 0 FJADHN CN(C)Cc1ccccc1CNC(=O)Cc1coc2ccc3ccccc3c12 ZINC000006992846 568413303 /nfs/dbraw/zinc/41/33/03/568413303.db2.gz ZHSQHZAYIXYXGV-UHFFFAOYSA-N 0 3 372.468 4.507 20 0 FJADHN Cc1cccc(NC(=O)[C@@H](C)NCC(c2ccccc2)c2ccccc2)c1 ZINC000011046187 568482993 /nfs/dbraw/zinc/48/29/93/568482993.db2.gz VLDLRZVQGKEDKA-LJQANCHMSA-N 0 3 358.485 4.744 20 0 FJADHN Cc1ccccc1NC(=O)[C@@H](C)NCC(c1ccccc1)c1ccccc1 ZINC000011046328 568483016 /nfs/dbraw/zinc/48/30/16/568483016.db2.gz NSUSJPWOMWMAFH-LJQANCHMSA-N 0 3 358.485 4.744 20 0 FJADHN CC[C@H](N[C@@H](C)C(=O)Nc1ccccc1)c1ccc(Br)cc1 ZINC000007375355 568503450 /nfs/dbraw/zinc/50/34/50/568503450.db2.gz IFZFVNFMCWKCJM-GUYCJALGSA-N 0 3 361.283 4.517 20 0 FJADHN CC[C@@H](N[C@@H](C)C(=O)Nc1ccccc1)c1ccc(Br)cc1 ZINC000007375356 568503534 /nfs/dbraw/zinc/50/35/34/568503534.db2.gz IFZFVNFMCWKCJM-SUMWQHHRSA-N 0 3 361.283 4.517 20 0 FJADHN FC(F)(F)c1cc(CNCc2cccc(-n3cccn3)c2)ccc1Cl ZINC000605008452 568515868 /nfs/dbraw/zinc/51/58/68/568515868.db2.gz NJYLWLHKZHWQIA-UHFFFAOYSA-N 0 3 365.786 4.834 20 0 FJADHN Cc1ccc(OCc2nc(CNCC3Cc4ccccc4C3)cs2)cc1 ZINC000605008581 568515931 /nfs/dbraw/zinc/51/59/31/568515931.db2.gz HHHCHQRJJCBBRA-UHFFFAOYSA-N 0 3 364.514 4.535 20 0 FJADHN CC(=O)N1CCCCC[C@H]1C1CCN(Cc2cccc(C3CC3)c2)CC1 ZINC000643285448 568527806 /nfs/dbraw/zinc/52/78/06/568527806.db2.gz DYCFMZXEPHUGII-QHCPKHFHSA-N 0 3 354.538 4.567 20 0 FJADHN CCC(C)(C)C(=O)NC[C@H]1CCCN(C)[C@H]1c1ccc(C(F)(F)F)cc1 ZINC000605102428 568566140 /nfs/dbraw/zinc/56/61/40/568566140.db2.gz HAXHSOVJFLBYOC-WBVHZDCISA-N 0 3 370.459 4.641 20 0 FJADHN CN(C(=O)c1ccc(C2=CCCC2)cc1)C1CCN(Cc2ccccc2)CC1 ZINC000637193278 568567423 /nfs/dbraw/zinc/56/74/23/568567423.db2.gz PSYUWMZWVIMNDU-UHFFFAOYSA-N 0 3 374.528 4.991 20 0 FJADHN FC(F)(F)COc1ccc(CN2CCS[C@@H](c3ccccc3)C2)cc1 ZINC000605154210 568598190 /nfs/dbraw/zinc/59/81/90/568598190.db2.gz LNPQAGANVDEBDF-GOSISDBHSA-N 0 3 367.436 4.918 20 0 FJADHN Cc1cc(C)n(-c2ccc(CN3CCS[C@H](c4ccccc4)C3)cc2)n1 ZINC000605154507 568598939 /nfs/dbraw/zinc/59/89/39/568598939.db2.gz SGJQDTYWTOKUBE-QFIPXVFZSA-N 0 3 363.530 4.779 20 0 FJADHN Cc1cc(C)n(-c2ccc(CN3CCC(C(=O)c4ccccc4)CC3)cc2)n1 ZINC000025946831 568627255 /nfs/dbraw/zinc/62/72/55/568627255.db2.gz HDMAXZNBCXRBLQ-UHFFFAOYSA-N 0 3 373.500 4.584 20 0 FJADHN C[C@H](Cc1ccccc1F)C(=O)Nc1cccc(CN2CCCCC2)c1 ZINC000606174655 568690420 /nfs/dbraw/zinc/69/04/20/568690420.db2.gz YHRKQFLUSCIBSB-QGZVFWFLSA-N 0 3 354.469 4.629 20 0 FJADHN Cc1cc2c(ccnc2N2CCC[C@@]3(CCN3Cc3cccc(F)c3)C2)o1 ZINC001164994081 722210135 /nfs/dbraw/zinc/21/01/35/722210135.db2.gz FJNGVTDZVOKBFU-JOCHJYFZSA-N 0 3 365.452 4.520 20 0 FJADHN COc1ccc(CNCC2=Cc3cc(Cl)cc(Cl)c3OC2)cc1 ZINC000109870909 209315280 /nfs/dbraw/zinc/31/52/80/209315280.db2.gz LWSWNXZELMOSMM-UHFFFAOYSA-N 0 3 350.245 4.568 20 0 FJADHN Cc1nc(C)c(CCN[C@@H](C)c2csc(-c3ccccc3F)n2)s1 ZINC000462801940 370698686 /nfs/dbraw/zinc/69/86/86/370698686.db2.gz FIXYFMFRZWYNJB-NSHDSACASA-N 0 3 361.511 4.916 20 0 FJADHN Cc1nc(C)c(CCN[C@H](C)c2csc(-c3ccccc3F)n2)s1 ZINC000462801939 370698703 /nfs/dbraw/zinc/69/87/03/370698703.db2.gz FIXYFMFRZWYNJB-LLVKDONJSA-N 0 3 361.511 4.916 20 0 FJADHN CSc1ccc(Cl)c(C(=O)N[C@H]2CCN([C@@H](C)c3ccccc3)C2)c1 ZINC000054226143 221051247 /nfs/dbraw/zinc/05/12/47/221051247.db2.gz RZTXZXDCZRVKDR-HOCLYGCPSA-N 0 3 374.937 4.627 20 0 FJADHN C[C@H](N[C@@H](C)c1ccc(I)cc1)c1ccsc1 ZINC000061361501 221133458 /nfs/dbraw/zinc/13/34/58/221133458.db2.gz XOXFJKPWIHNOMO-QWRGUYRKSA-N 0 3 357.260 4.765 20 0 FJADHN CC(C)c1ccccc1NC(=O)c1ccc(N2CCN(C(C)C)CC2)cc1 ZINC000109189348 132244763 /nfs/dbraw/zinc/24/47/63/132244763.db2.gz KXHRYFXJCZVJFU-UHFFFAOYSA-N 0 3 365.521 4.593 20 0 FJADHN CCN(CC)[C@H](CNCc1scnc1C)c1ccc(C(F)(F)F)cc1 ZINC000236899106 567854474 /nfs/dbraw/zinc/85/44/74/567854474.db2.gz XWQSWGNRAHMFKP-MRXNPFEDSA-N 0 3 371.472 4.643 20 0 FJADHN C[C@@H](CSc1ccccc1)C(=O)N(c1ccccc1)C1CCN(C)CC1 ZINC000601955414 567885165 /nfs/dbraw/zinc/88/51/65/567885165.db2.gz HZQIFHUBFJGMLZ-SFHVURJKSA-N 0 3 368.546 4.542 20 0 FJADHN CC[C@@H](CC(=O)N(c1ccccc1)C1CCN(C)CC1)c1ccccc1 ZINC000601961278 567887354 /nfs/dbraw/zinc/88/73/54/567887354.db2.gz WZLCMERPVUSIQS-IBGZPJMESA-N 0 3 350.506 4.698 20 0 FJADHN CN1CCC(N(C(=O)c2cccc(Cl)c2Cl)c2ccccc2)CC1 ZINC000601963332 567888102 /nfs/dbraw/zinc/88/81/02/567888102.db2.gz UJDJLORISQMWEM-UHFFFAOYSA-N 0 3 363.288 4.734 20 0 FJADHN CC[C@H](Cc1ccccc1)C(=O)NC[C@@H](c1ccsc1)N(CC)CC ZINC000602093034 567932688 /nfs/dbraw/zinc/93/26/88/567932688.db2.gz GQBZHWHEIHNSFN-QUCCMNQESA-N 0 3 358.551 4.516 20 0 FJADHN COc1cc(-c2nc(CN(C3CC3)C3CCCCC3)cs2)ccc1O ZINC000602238527 567954657 /nfs/dbraw/zinc/95/46/57/567954657.db2.gz HPKPNDKMJWRDLI-UHFFFAOYSA-N 0 3 358.507 4.821 20 0 FJADHN C[C@@H](CN[C@H]1CCCOc2cc(Br)ccc21)c1nccs1 ZINC000186753248 567979698 /nfs/dbraw/zinc/97/96/98/567979698.db2.gz QPPUDPHTFGXNIE-FZMZJTMJSA-N 0 3 367.312 4.513 20 0 FJADHN C[C@@H](N[C@H](C)c1ccc2c(c1)OCCO2)c1ccc(OC(F)(F)F)cc1 ZINC000602550726 567990687 /nfs/dbraw/zinc/99/06/87/567990687.db2.gz LXIDJZONDRNWID-CHWSQXEVSA-N 0 3 367.367 4.768 20 0 FJADHN C[C@H](N[C@@H]1CCc2nc(-c3ccccc3)ncc2C1)c1ccc(F)cc1F ZINC000602584116 567994183 /nfs/dbraw/zinc/99/41/83/567994183.db2.gz NJWWVKKJEUZGIG-KBXCAEBGSA-N 0 3 365.427 4.630 20 0 FJADHN CCOC1CC(CCNCc2cc(Cl)ccc2OCc2cccnc2)C1 ZINC000188785650 568007742 /nfs/dbraw/zinc/00/77/42/568007742.db2.gz AQQQLLWOYJSUFG-UHFFFAOYSA-N 0 3 374.912 4.609 20 0 FJADHN FC(F)Oc1cccc(Cl)c1CNCCc1ccc2ccccc2n1 ZINC000602911175 568011131 /nfs/dbraw/zinc/01/11/31/568011131.db2.gz SMSRYNBABQBXBI-UHFFFAOYSA-N 0 3 362.807 4.822 20 0 FJADHN Cc1cc2c(cc1C)[C@H](NCc1cccc(Cn3ccnc3)c1)CCS2 ZINC000186987385 568037767 /nfs/dbraw/zinc/03/77/67/568037767.db2.gz SWAGTHGMRNFWGY-OAQYLSRUSA-N 0 3 363.530 4.875 20 0 FJADHN Cc1ccc([C@@H](NCc2ccccc2CN2CCCC2=O)C2CCC2)cc1 ZINC000186988008 568038143 /nfs/dbraw/zinc/03/81/43/568038143.db2.gz DGVVVZFKEIKJNU-DEOSSOPVSA-N 0 3 362.517 4.748 20 0 FJADHN C[C@H](CCC(C)(C)C)NC(=O)N(C)C1CCN(Cc2ccccc2)CC1 ZINC000605984829 568060517 /nfs/dbraw/zinc/06/05/17/568060517.db2.gz ACMSCUCDDDAIDD-GOSISDBHSA-N 0 3 359.558 4.507 20 0 FJADHN C[C@@H](NCc1ccc(Br)cc1C(F)(F)F)[C@H]1CC1(F)F ZINC000666445188 568082593 /nfs/dbraw/zinc/08/25/93/568082593.db2.gz QWIWPZJZNLMDSN-RDDDGLTNSA-N 0 3 358.148 4.601 20 0 FJADHN CN(C(=O)c1cc2sccc2s1)C1CCN(Cc2ccccc2)CC1 ZINC000603451101 568099430 /nfs/dbraw/zinc/09/94/30/568099430.db2.gz SIHBHCXNEIJWPS-UHFFFAOYSA-N 0 3 370.543 4.699 20 0 FJADHN C[C@@H]1C[C@@]2(CCO1)CN(Cc1cccc(-c3ccccc3)c1)C[C@H](C)O2 ZINC000430780135 568104703 /nfs/dbraw/zinc/10/47/03/568104703.db2.gz JJZATIIJGSSZNC-MSYCTHLASA-N 0 3 351.490 4.512 20 0 FJADHN COc1ccc2[nH]cc(CCNCc3csc(-c4ccccc4)n3)c2c1 ZINC000603515849 568111593 /nfs/dbraw/zinc/11/15/93/568111593.db2.gz KJGMZGNUCIMKRI-UHFFFAOYSA-N 0 3 363.486 4.632 20 0 FJADHN COc1ccc2[nH]cc(CCNCc3csc(-c4ccsc4)n3)c2c1 ZINC000603516415 568111648 /nfs/dbraw/zinc/11/16/48/568111648.db2.gz VPIGYBVMBLOGKD-UHFFFAOYSA-N 0 3 369.515 4.694 20 0 FJADHN Cc1ccc(NC(=O)C[C@H](c2ccccc2)C(F)(F)F)c(CN(C)C)c1 ZINC000603694768 568136736 /nfs/dbraw/zinc/13/67/36/568136736.db2.gz IBTQLDLPNJKVBB-QGZVFWFLSA-N 0 3 364.411 4.731 20 0 FJADHN COc1ccc(-c2cc(CN(CCc3cccc(F)c3)C3CC3)on2)cc1 ZINC000603713060 568138049 /nfs/dbraw/zinc/13/80/49/568138049.db2.gz TXEANFNSRLFSSE-UHFFFAOYSA-N 0 3 366.436 4.696 20 0 FJADHN CC[C@H]1c2ccccc2CCN1Cc1cccc(C(=O)NCc2ccco2)c1 ZINC000603944332 568185824 /nfs/dbraw/zinc/18/58/24/568185824.db2.gz LBDQRAUVFHSDPM-QHCPKHFHSA-N 0 3 374.484 4.719 20 0 FJADHN CCN1CCN(c2ccc(NCc3ccc(Cl)c(F)c3)c(C)c2)CC1 ZINC000604063001 568204921 /nfs/dbraw/zinc/20/49/21/568204921.db2.gz HVKGUAHFZDFDSE-UHFFFAOYSA-N 0 3 361.892 4.542 20 0 FJADHN Clc1ccc(C2(CNCc3nccn3Cc3ccccc3)CCC2)cc1 ZINC000604066735 568205614 /nfs/dbraw/zinc/20/56/14/568205614.db2.gz YHZQGNJHGXHVAX-UHFFFAOYSA-N 0 3 365.908 4.796 20 0 FJADHN CCN(Cc1ccc(C(=O)N2C[C@H](c3ccccc3)C[C@H]2C)cc1)C1CC1 ZINC000604258008 568239043 /nfs/dbraw/zinc/23/90/43/568239043.db2.gz QDSDXVSCVNPCCQ-XMSQKQJNSA-N 0 3 362.517 4.689 20 0 FJADHN CCN(CC)[C@@H](CNC(=O)C[C@H](C)c1ccccc1F)c1ccccc1 ZINC000303171404 568255367 /nfs/dbraw/zinc/25/53/67/568255367.db2.gz RGNCKNYSUWKNJJ-UWJYYQICSA-N 0 3 356.485 4.519 20 0 FJADHN Cc1c(F)cccc1-c1ccc(CNCc2cccc(-n3ccnc3)c2)o1 ZINC000604419848 568276585 /nfs/dbraw/zinc/27/65/85/568276585.db2.gz ZGHBCOQGXRHGFT-UHFFFAOYSA-N 0 3 361.420 4.870 20 0 FJADHN CN(C)Cc1cccc(NC(=O)[C@@H]2C[C@H]2c2cccc(C(F)(F)F)c2)c1 ZINC000303438852 568278161 /nfs/dbraw/zinc/27/81/61/568278161.db2.gz HINUEMOARRGRGH-ZWKOTPCHSA-N 0 3 362.395 4.509 20 0 FJADHN Cc1c(F)cccc1-c1ccc(CNC[C@@H](c2ccco2)N2CCCC2)o1 ZINC000604414609 568279378 /nfs/dbraw/zinc/27/93/78/568279378.db2.gz BRHXQIHWKJPSOX-FQEVSTJZSA-N 0 3 368.452 4.914 20 0 FJADHN Fc1cccc(F)c1-c1ccc(CNCCCn2cnc3ccccc32)o1 ZINC000604414668 568279558 /nfs/dbraw/zinc/27/95/58/568279558.db2.gz JTQBVZNOWADPCO-UHFFFAOYSA-N 0 3 367.399 4.754 20 0 FJADHN CN(C)[C@@H](CNCc1ccc(-c2c(F)cccc2F)o1)c1ccsc1 ZINC000604414901 568279681 /nfs/dbraw/zinc/27/96/81/568279681.db2.gz PCAWWVGFRDNLDL-KRWDZBQOSA-N 0 3 362.445 4.679 20 0 FJADHN Cc1cc(F)ccc1-c1ccc(CNC[C@@H](c2ccsc2)N(C)C)o1 ZINC000604414889 568279740 /nfs/dbraw/zinc/27/97/40/568279740.db2.gz LTRQAUTULVVDDC-IBGZPJMESA-N 0 3 358.482 4.848 20 0 FJADHN Fc1cccc(F)c1-c1ccc(CNCCCc2nc3ccccc3[nH]2)o1 ZINC000604415444 568280842 /nfs/dbraw/zinc/28/08/42/568280842.db2.gz KPBKDBGQOOSXQJ-UHFFFAOYSA-N 0 3 367.399 4.824 20 0 FJADHN C[C@H]1C[C@@H](c2ccccc2)CN1Cc1nc(-c2ccc(Cl)cc2)no1 ZINC000604393226 568283227 /nfs/dbraw/zinc/28/32/27/568283227.db2.gz WNOUCJWHCDUSJO-WMLDXEAASA-N 0 3 353.853 4.768 20 0 FJADHN C[C@@H]1C[C@H](c2ccccc2)CN1Cc1nc(-c2cccc(Cl)c2)no1 ZINC000604394115 568284032 /nfs/dbraw/zinc/28/40/32/568284032.db2.gz BNKMUDOWTAIGKO-PBHICJAKSA-N 0 3 353.853 4.768 20 0 FJADHN CC[C@H](N[C@H](C)c1ccc(S(=O)(=O)N(CC)CC)cc1)c1ccccc1 ZINC000303508286 568285083 /nfs/dbraw/zinc/28/50/83/568285083.db2.gz NLHSPMUNMUWWGB-UTKZUKDTSA-N 0 3 374.550 4.519 20 0 FJADHN c1ccc(-c2noc(C3CCN(Cc4ccc5c(c4)CCC5)CC3)n2)cc1 ZINC000604387122 568289009 /nfs/dbraw/zinc/28/90/09/568289009.db2.gz ZJFXJYUYMWHYTJ-UHFFFAOYSA-N 0 3 359.473 4.605 20 0 FJADHN Cc1cc(OC(C)C)ccc1NC(=O)N1CCN(C2CCC(C)CC2)CC1 ZINC000604616660 568325085 /nfs/dbraw/zinc/32/50/85/568325085.db2.gz FEZWROMTZAFNCB-UHFFFAOYSA-N 0 3 373.541 4.510 20 0 FJADHN Cc1ccc([C@H](CNC(=O)Nc2ccccc2OC(C)(C)C)N(C)C)cc1 ZINC000604630500 568332114 /nfs/dbraw/zinc/33/21/14/568332114.db2.gz AVWNHVFXMHCGKQ-IBGZPJMESA-N 0 3 369.509 4.597 20 0 FJADHN CC(C)Cc1ccc([C@H](NC(=O)N(C)C[C@H]2CCCN(C)C2)C(C)C)cc1 ZINC000604634218 568333170 /nfs/dbraw/zinc/33/31/70/568333170.db2.gz JEQZTQYSDDLRPU-RBBKRZOGSA-N 0 3 373.585 4.565 20 0 FJADHN Cc1ccc(CCC(=O)NC2CCN([C@@H](C)c3ccccc3)CC2)c(C)c1 ZINC000604713859 568355261 /nfs/dbraw/zinc/35/52/61/568355261.db2.gz QXYVUZSZTNRAKI-FQEVSTJZSA-N 0 3 364.533 4.578 20 0 FJADHN C[C@H](c1ccccc1)N1CCC(NC(=O)c2ccc(C(F)F)cc2)CC1 ZINC000604714379 568355306 /nfs/dbraw/zinc/35/53/06/568355306.db2.gz LXZDKVWGBFBHMU-OAHLLOKOSA-N 0 3 358.432 4.580 20 0 FJADHN CC(C)=C[C@@H]1[C@H](C(=O)NC2CCN([C@@H](C)c3ccccc3)CC2)C1(C)C ZINC000604714361 568355326 /nfs/dbraw/zinc/35/53/26/568355326.db2.gz KTJQUZKDTDSYOD-IOMROCGXSA-N 0 3 354.538 4.567 20 0 FJADHN CC(C)=C[C@@H]1[C@H](C(=O)NC2CCN([C@H](C)c3ccccc3)CC2)C1(C)C ZINC000604714360 568355380 /nfs/dbraw/zinc/35/53/80/568355380.db2.gz KTJQUZKDTDSYOD-DUXKGJEZSA-N 0 3 354.538 4.567 20 0 FJADHN Cc1ccccc1[C@H](C)CC(=O)NC[C@H]1CCCN(Cc2ccccc2)C1 ZINC000604742278 568359768 /nfs/dbraw/zinc/35/97/68/568359768.db2.gz RMMPFYBUMOJEKH-IFMALSPDSA-N 0 3 364.533 4.517 20 0 FJADHN C[C@](CO)(NCc1cn(Cc2ccccc2)c2ccccc12)c1ccccc1 ZINC000604765538 568361819 /nfs/dbraw/zinc/36/18/19/568361819.db2.gz VTVLQQWXWQBQAS-RUZDIDTESA-N 0 3 370.496 4.687 20 0 FJADHN Cc1cc(CN[C@](C)(CO)c2cccc(C(F)(F)F)c2)c2ccccc2n1 ZINC000604767664 568362373 /nfs/dbraw/zinc/36/23/73/568362373.db2.gz UUGUZBQGLOPHEO-HXUWFJFHSA-N 0 3 374.406 4.559 20 0 FJADHN Cc1c(F)cccc1-c1ccc(CN[C@H](CO)[C@@H](C)c2ccccc2)o1 ZINC000604768419 568362588 /nfs/dbraw/zinc/36/25/88/568362588.db2.gz QAOKVDGXAPOWBQ-YCRPNKLZSA-N 0 3 353.437 4.648 20 0 FJADHN C[C@H](c1ccccc1)N1CCC(NC(=O)N(C)CCC2CCCCC2)CC1 ZINC000604785076 568366463 /nfs/dbraw/zinc/36/64/63/568366463.db2.gz CSWDJSOZDJSFCL-LJQANCHMSA-N 0 3 371.569 4.824 20 0 FJADHN CC(C)CN(C(=O)NC1CCN([C@H](C)c2ccccc2)CC1)C1CCCC1 ZINC000604821961 568370179 /nfs/dbraw/zinc/37/01/79/568370179.db2.gz GIBRYASCSNXSCJ-LJQANCHMSA-N 0 3 371.569 4.822 20 0 FJADHN CC(C)[C@@H]1CCCN(C(=O)NC2CCN([C@@H](C)c3ccccc3)CC2)CC1 ZINC000604827717 568376701 /nfs/dbraw/zinc/37/67/01/568376701.db2.gz XUXAGZRBKKAHOW-VQTJNVASSA-N 0 3 371.569 4.680 20 0 FJADHN C[C@H](N[C@H](Cc1ccccc1)c1cccs1)C(=O)N[C@@H]1CCCC[C@@H]1C ZINC000604892085 568382043 /nfs/dbraw/zinc/38/20/43/568382043.db2.gz JGHLUCKTIJNQDE-RAUXBKROSA-N 0 3 370.562 4.705 20 0 FJADHN CC(C)c1ccsc1C(=O)Nc1ccc(OCCN(C)C)c(Cl)c1 ZINC000604875220 568382752 /nfs/dbraw/zinc/38/27/52/568382752.db2.gz OKNPPOCSRGQOOT-UHFFFAOYSA-N 0 3 366.914 4.718 20 0 FJADHN CC(C)N(C(=O)[C@@H](C)N[C@H](Cc1ccccc1)c1cccs1)C(C)C ZINC000604892609 568383131 /nfs/dbraw/zinc/38/31/31/568383131.db2.gz YVHFPCZPGKXZCJ-IEBWSBKVSA-N 0 3 358.551 4.655 20 0 FJADHN CCN(CC)[C@@H](CNC(=O)c1oc2c(cccc2F)c1C)c1ccsc1 ZINC000031992845 568416058 /nfs/dbraw/zinc/41/60/58/568416058.db2.gz BRWRXXDSUFYGSO-KRWDZBQOSA-N 0 3 374.481 4.755 20 0 FJADHN O=C(CCN1CCC[C@H]1c1ccsc1)Nc1ccc(Cl)cc1F ZINC000051852949 568486798 /nfs/dbraw/zinc/48/67/98/568486798.db2.gz LRPYRVGWLOHLDF-INIZCTEOSA-N 0 3 352.862 4.706 20 0 FJADHN OCC1(CN[C@H]2CCSc3c(F)cccc32)CC(c2ccccc2)C1 ZINC000433097148 568504872 /nfs/dbraw/zinc/50/48/72/568504872.db2.gz KZEJAGVJDSIPFD-BSLVTKGXSA-N 0 3 357.494 4.509 20 0 FJADHN Brc1ccc(/C=C\CCN2CCC[C@@H](c3ccncn3)C2)cc1 ZINC000604997458 568508100 /nfs/dbraw/zinc/50/81/00/568508100.db2.gz YYEVMSNFSWMRGI-DIIYHRTISA-N 0 3 372.310 4.522 20 0 FJADHN Cc1cc(-c2noc([C@H](C)NC[C@H]3CCc4ccccc4C3)n2)ccc1F ZINC000605007996 568521102 /nfs/dbraw/zinc/52/11/02/568521102.db2.gz PCXOOFWJMSYCJH-HOTGVXAUSA-N 0 3 365.452 4.640 20 0 FJADHN FC(F)(F)COc1cccc(CN2CCS[C@H](c3ccccc3)C2)c1 ZINC000605155275 568600074 /nfs/dbraw/zinc/60/00/74/568600074.db2.gz MUYXIJYGCJYVGQ-SFHVURJKSA-N 0 3 367.436 4.918 20 0 FJADHN CCCN(C(=O)[C@H](C)c1cccs1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000606189029 568710109 /nfs/dbraw/zinc/71/01/09/568710109.db2.gz YEEVPFXUHLXUQP-UYAOXDASSA-N 0 3 370.562 4.755 20 0 FJADHN O=C(N[C@H]1CCSc2ccccc21)c1ccc(CN2CCCCC2)cc1 ZINC000018134446 220225068 /nfs/dbraw/zinc/22/50/68/220225068.db2.gz GVEDBNAIUSXEQV-FQEVSTJZSA-N 0 3 366.530 4.639 20 0 FJADHN COc1ccccc1N1CCN(Cc2ccccc2-c2ccccc2C)CC1 ZINC000096910029 132226280 /nfs/dbraw/zinc/22/62/80/132226280.db2.gz GAIFFACGCZRTSQ-UHFFFAOYSA-N 0 3 372.512 4.993 20 0 FJADHN Cc1cc(C)c(NC(=O)NC[C@@H](c2ccccc2)N2CCCC2)c(C)c1 ZINC000043150678 567850909 /nfs/dbraw/zinc/85/09/09/567850909.db2.gz UVKDSUDUGDQCEY-FQEVSTJZSA-N 0 3 351.494 4.570 20 0 FJADHN Cc1nn(Cc2ccccc2)c(C)c1CNCCc1ccc(Cl)s1 ZINC000061115446 567856927 /nfs/dbraw/zinc/85/69/27/567856927.db2.gz NCYIOUKETKHISA-UHFFFAOYSA-N 0 3 359.926 4.595 20 0 FJADHN C[C@@H]1CCc2c(C(=O)N(c3ccccc3)C3CCN(C)CC3)csc2C1 ZINC000601956214 567885456 /nfs/dbraw/zinc/88/54/56/567885456.db2.gz LASOHVXJPXQKKZ-MRXNPFEDSA-N 0 3 368.546 4.614 20 0 FJADHN Cc1ccc(C)c(SCC(=O)N(c2ccccc2)C2CCN(C)CC2)c1 ZINC000601959655 567886779 /nfs/dbraw/zinc/88/67/79/567886779.db2.gz HNRJGDBZNLPTRY-UHFFFAOYSA-N 0 3 368.546 4.523 20 0 FJADHN CN1CCC(N(C(=O)c2cc(Cl)ccc2Cl)c2ccccc2)CC1 ZINC000601960849 567887181 /nfs/dbraw/zinc/88/71/81/567887181.db2.gz ADFQWDZSHBBGGA-UHFFFAOYSA-N 0 3 363.288 4.734 20 0 FJADHN C[C@H](C1CC1)N(Cc1coc(-c2ccc(Br)cc2)n1)C1CC1 ZINC000521428131 568024915 /nfs/dbraw/zinc/02/49/15/568024915.db2.gz VYSNCFMYQNGVOS-GFCCVEGCSA-N 0 3 361.283 4.867 20 0 FJADHN COc1ccc(CN[C@H](c2ccc(C)cc2)C2CCC2)c(OC)c1OC ZINC000187026362 568049556 /nfs/dbraw/zinc/04/95/56/568049556.db2.gz BOIHQURCZLIZPB-FQEVSTJZSA-N 0 3 355.478 4.652 20 0 FJADHN CC(C)c1ccccc1NC(=O)NC1CCN(Cc2ccccc2)CC1 ZINC000043231437 568068232 /nfs/dbraw/zinc/06/82/32/568068232.db2.gz LANLOJOYIFQJHP-UHFFFAOYSA-N 0 3 351.494 4.596 20 0 FJADHN O=c1ccc2c([nH]1)CCC[C@@H]2NCc1ccc(-c2cccc(Cl)c2)s1 ZINC000067504160 568076325 /nfs/dbraw/zinc/07/63/25/568076325.db2.gz AVCVJIDTBCPFPF-KRWDZBQOSA-N 0 3 370.905 4.924 20 0 FJADHN CN(C)CCN(C(=O)c1ccc(Oc2ccc(F)cc2)cc1)C1CCCC1 ZINC000603271077 568081233 /nfs/dbraw/zinc/08/12/33/568081233.db2.gz ZNSVWGZIFAQGFR-UHFFFAOYSA-N 0 3 370.468 4.564 20 0 FJADHN COc1cc(OC)cc(Oc2ccc(CN[C@H](C)c3cccnc3)cc2)c1 ZINC000068478310 568088906 /nfs/dbraw/zinc/08/89/06/568088906.db2.gz WKOJHAOPNHHWNT-MRXNPFEDSA-N 0 3 364.445 4.742 20 0 FJADHN COc1ccc(COCCN[C@@H](c2cccnc2)C2CCCCC2)cc1 ZINC000603410494 568097874 /nfs/dbraw/zinc/09/78/74/568097874.db2.gz DQGDIKPSNNFILF-JOCHJYFZSA-N 0 3 354.494 4.518 20 0 FJADHN C[C@H](C[C@H]1CCCO1)NCc1csc(-c2ccc(C(F)(F)F)cc2)n1 ZINC000603512677 568110908 /nfs/dbraw/zinc/11/09/08/568110908.db2.gz CXAAERYAYOIZDI-MLGOLLRUSA-N 0 3 370.440 4.876 20 0 FJADHN C[C@H](C[C@@H]1CCCO1)NCc1csc(-c2ccc(C(F)(F)F)cc2)n1 ZINC000603512678 568110963 /nfs/dbraw/zinc/11/09/63/568110963.db2.gz CXAAERYAYOIZDI-WBMJQRKESA-N 0 3 370.440 4.876 20 0 FJADHN FC(F)Oc1ccc2ccccc2c1CNC[C@H]1OCCc2ccccc21 ZINC000603516551 568111757 /nfs/dbraw/zinc/11/17/57/568111757.db2.gz XTPRDJWUFMTHJA-OAQYLSRUSA-N 0 3 369.411 4.845 20 0 FJADHN O=C(NCCCNCc1ccc(-c2ccc(Cl)cc2)o1)c1cccs1 ZINC000603518181 568112065 /nfs/dbraw/zinc/11/20/65/568112065.db2.gz BGBKNKWLAARTAB-UHFFFAOYSA-N 0 3 374.893 4.571 20 0 FJADHN CC[C@H](CC1CCCC1)C(=O)NC[C@H]1CCCN(Cc2ccccc2)C1 ZINC000603863125 568172094 /nfs/dbraw/zinc/17/20/94/568172094.db2.gz RFTABFOIVLBJIE-FGZHOGPDSA-N 0 3 356.554 4.621 20 0 FJADHN CC[C@@H](CC1CCCC1)C(=O)NC[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000603863126 568172122 /nfs/dbraw/zinc/17/21/22/568172122.db2.gz RFTABFOIVLBJIE-VXKWHMMOSA-N 0 3 356.554 4.621 20 0 FJADHN CCSCc1ccc(C(=O)NC[C@H](c2cccs2)N2CCCC2)cc1 ZINC000603949269 568186874 /nfs/dbraw/zinc/18/68/74/568186874.db2.gz AKVJUWIMBROBKX-GOSISDBHSA-N 0 3 374.575 4.568 20 0 FJADHN Fc1ccc(C2(CNCc3nccn3Cc3ccccc3)CCCC2)cc1 ZINC000604063433 568205053 /nfs/dbraw/zinc/20/50/53/568205053.db2.gz TVYJWHFTIAEICQ-UHFFFAOYSA-N 0 3 363.480 4.672 20 0 FJADHN CCCOc1cccc(CNCCc2nc(-c3cccc(Cl)c3)no2)c1 ZINC000604069951 568206172 /nfs/dbraw/zinc/20/61/72/568206172.db2.gz RRUOVEBKORWTCJ-UHFFFAOYSA-N 0 3 371.868 4.511 20 0 FJADHN CCOc1c(Cl)cc(CNCC(C)(C)Oc2ccccc2)cc1OC ZINC000604079259 568208507 /nfs/dbraw/zinc/20/85/07/568208507.db2.gz DIFLLWFJMZXACS-UHFFFAOYSA-N 0 3 363.885 4.695 20 0 FJADHN CC(C)c1ccccc1NC(=O)NC[C@H]1CCCN1Cc1ccccc1 ZINC000604089172 568210173 /nfs/dbraw/zinc/21/01/73/568210173.db2.gz UKPAWZYXNCYGKX-LJQANCHMSA-N 0 3 351.494 4.596 20 0 FJADHN CCN(Cc1cccs1)C(=O)N[C@H](CN1CCCCC1)c1ccccc1 ZINC000604207025 568225587 /nfs/dbraw/zinc/22/55/87/568225587.db2.gz XQLANMRSWWROAV-HXUWFJFHSA-N 0 3 371.550 4.507 20 0 FJADHN Cc1ccc([C@H](CN[C@H]2CCSc3c(F)cccc32)N2CCCC2)o1 ZINC000482018144 568229137 /nfs/dbraw/zinc/22/91/37/568229137.db2.gz QSSIKVOABUDBOI-ROUUACIJSA-N 0 3 360.498 4.691 20 0 FJADHN CCN(Cc1ccc(C(=O)N2C[C@H](c3ccccc3)C[C@@H]2C)cc1)C1CC1 ZINC000604258007 568239070 /nfs/dbraw/zinc/23/90/70/568239070.db2.gz QDSDXVSCVNPCCQ-PGRDOPGGSA-N 0 3 362.517 4.689 20 0 FJADHN CC1CCN([C@@H](CNC(=O)C(C)(C)c2cccs2)c2ccccc2)CC1 ZINC000604317939 568246432 /nfs/dbraw/zinc/24/64/32/568246432.db2.gz RXCARMNEZNCVIS-IBGZPJMESA-N 0 3 370.562 4.615 20 0 FJADHN FC(F)Oc1ccc(CN[C@@H]2CCCN(c3ccccc3)C2)cc1Cl ZINC000604416723 568275034 /nfs/dbraw/zinc/27/50/34/568275034.db2.gz BCUUHHASKRECGI-OAHLLOKOSA-N 0 3 366.839 4.700 20 0 FJADHN CN(C)Cc1cccc(NC(=O)[C@@H]2C[C@@H]2c2cccc(C(F)(F)F)c2)c1 ZINC000303438850 568278156 /nfs/dbraw/zinc/27/81/56/568278156.db2.gz HINUEMOARRGRGH-QZTJIDSGSA-N 0 3 362.395 4.509 20 0 FJADHN Cc1c(F)cccc1-c1ccc(CNC[C@H](c2ccco2)N2CCCC2)o1 ZINC000604414610 568279442 /nfs/dbraw/zinc/27/94/42/568279442.db2.gz BRHXQIHWKJPSOX-HXUWFJFHSA-N 0 3 368.452 4.914 20 0 FJADHN Cc1sc2nc([C@H](C)N3C[C@@H](c4ccccc4)C[C@H]3C)nc(N)c2c1C ZINC000604393905 568283705 /nfs/dbraw/zinc/28/37/05/568283705.db2.gz QLAQENNSSBCOIA-IFIJOSMWSA-N 0 3 366.534 4.829 20 0 FJADHN CC1CCC(N2CCN(C(=O)Nc3ccccc3C(C)(C)C)CC2)CC1 ZINC000604609598 568326758 /nfs/dbraw/zinc/32/67/58/568326758.db2.gz TUVWCRIULRGCTA-UHFFFAOYSA-N 0 3 357.542 4.712 20 0 FJADHN CC(C)[C@@H](NC(=O)N1CCCN(C(C)(C)C)CC1)c1ccccc1Cl ZINC000604657087 568339967 /nfs/dbraw/zinc/33/99/67/568339967.db2.gz BLBCZPZBTXCOLL-GOSISDBHSA-N 0 3 365.949 4.553 20 0 FJADHN Cc1ccccc1[C@@H](C)CC(=O)N(c1ccccc1)C1CCN(C)CC1 ZINC000604701283 568347879 /nfs/dbraw/zinc/34/78/79/568347879.db2.gz KXSKHBQCADRNQE-IBGZPJMESA-N 0 3 350.506 4.616 20 0 FJADHN Cc1ccccc1[C@H](C)CC(=O)NCc1ccccc1CN1CCCCC1 ZINC000604697773 568351382 /nfs/dbraw/zinc/35/13/82/568351382.db2.gz CJMBRQCAUHGWIJ-HXUWFJFHSA-N 0 3 364.533 4.791 20 0 FJADHN C[C@@H](c1ccccc1)N1CCC(NC(=O)c2ccc(-c3ccccc3)[nH]2)CC1 ZINC000604712521 568354986 /nfs/dbraw/zinc/35/49/86/568354986.db2.gz CXYLIYZJANVJKV-SFHVURJKSA-N 0 3 373.500 4.637 20 0 FJADHN CCSc1ccccc1C(=O)NC1CCN([C@@H](C)c2ccccc2)CC1 ZINC000604712594 568355074 /nfs/dbraw/zinc/35/50/74/568355074.db2.gz GEULZZUPCXRKHH-KRWDZBQOSA-N 0 3 368.546 4.754 20 0 FJADHN CC(C)Cc1ccc(C(=O)NC2CCN([C@@H](C)c3ccccc3)CC2)cc1 ZINC000604713492 568355218 /nfs/dbraw/zinc/35/52/18/568355218.db2.gz FPHFDWFQBVTQDB-IBGZPJMESA-N 0 3 364.533 4.841 20 0 FJADHN CCc1ccc(CCC(=O)NC2CCN([C@@H](C)c3ccccc3)CC2)cc1 ZINC000604713882 568355290 /nfs/dbraw/zinc/35/52/90/568355290.db2.gz LYVOBNAXQLAQHZ-IBGZPJMESA-N 0 3 364.533 4.523 20 0 FJADHN COc1ccc(C2(NCc3cc4c(cc3OC)C[C@@H](C)O4)CCCC2)cc1 ZINC000604765067 568361772 /nfs/dbraw/zinc/36/17/72/568361772.db2.gz NBPMUXPTZHLSKG-MRXNPFEDSA-N 0 3 367.489 4.586 20 0 FJADHN OC[C@H](NCc1cn(Cc2ccccc2)c2ccccc12)c1ccccc1 ZINC000604765089 568361799 /nfs/dbraw/zinc/36/17/99/568361799.db2.gz ACPDRWBGEKXIAE-QHCPKHFHSA-N 0 3 356.469 4.513 20 0 FJADHN COc1ccc(C2(NCc3cc(OC)cc4c3O[C@@H](C)C4)CCCC2)cc1 ZINC000604765562 568361870 /nfs/dbraw/zinc/36/18/70/568361870.db2.gz SZGNFKMJHLZGJS-INIZCTEOSA-N 0 3 367.489 4.586 20 0 FJADHN Cc1cc(F)ccc1-c1ccc(CN[C@@H](CO)[C@@H](C)c2ccccc2)o1 ZINC000604767878 568362467 /nfs/dbraw/zinc/36/24/67/568362467.db2.gz DUGQSBQTTVFMHO-KKSFZXQISA-N 0 3 353.437 4.648 20 0 FJADHN Cc1c(F)cccc1-c1ccc(CN[C@H](CO)[C@H](C)c2ccccc2)o1 ZINC000604768417 568362566 /nfs/dbraw/zinc/36/25/66/568362566.db2.gz QAOKVDGXAPOWBQ-QVKFZJNVSA-N 0 3 353.437 4.648 20 0 FJADHN C[C@@H](c1ccccc1)N1CCC(NC(=O)N2CCC[C@H]2C2CCCC2)CC1 ZINC000604788347 568367035 /nfs/dbraw/zinc/36/70/35/568367035.db2.gz RTGPFMHYZHELDM-AVRDEDQJSA-N 0 3 369.553 4.576 20 0 FJADHN Cc1ccc(NC(=O)NC2CCN([C@H](C)c3ccccc3)CC2)cc1C ZINC000604791547 568367577 /nfs/dbraw/zinc/36/75/77/568367577.db2.gz WZFJJSZLMOWDNA-GOSISDBHSA-N 0 3 351.494 4.651 20 0 FJADHN CCCCN(CCCC)C(=O)NC1CCN([C@@H](C)c2ccccc2)CC1 ZINC000604823278 568370337 /nfs/dbraw/zinc/37/03/37/568370337.db2.gz XNVOOIIZKYCALN-IBGZPJMESA-N 0 3 359.558 4.824 20 0 FJADHN CCCOc1ccc(O[C@@H]2CCCC[C@@H]2NCc2cnc(C)s2)cc1 ZINC000604892226 568382019 /nfs/dbraw/zinc/38/20/19/568382019.db2.gz KWWXRLQMBWLEOR-VQTJNVASSA-N 0 3 360.523 4.720 20 0 FJADHN C[C@@H](N[C@@H](Cc1ccccc1)c1cccs1)C(=O)Nc1ccccc1 ZINC000604891887 568382021 /nfs/dbraw/zinc/38/20/21/568382021.db2.gz FIQMDCKBISEGHW-APWZRJJASA-N 0 3 350.487 4.649 20 0 FJADHN C[C@H](N[C@H](Cc1ccccc1)c1cccs1)C(=O)Nc1ccccc1 ZINC000604891889 568382036 /nfs/dbraw/zinc/38/20/36/568382036.db2.gz FIQMDCKBISEGHW-QFBILLFUSA-N 0 3 350.487 4.649 20 0 FJADHN Cc1cccc(NC(=O)[C@H](C)N[C@H](Cc2ccccc2)c2cccs2)c1 ZINC000604892308 568382101 /nfs/dbraw/zinc/38/21/01/568382101.db2.gz PDXKLRHBBJJNLF-FXAWDEMLSA-N 0 3 364.514 4.957 20 0 FJADHN CCc1ccc([C@@H](C)C(=O)Nc2ccc(OCCN(C)C)c(Cl)c2)cc1 ZINC000604874117 568382641 /nfs/dbraw/zinc/38/26/41/568382641.db2.gz QHAOKBAURVZBAO-OAHLLOKOSA-N 0 3 374.912 4.585 20 0 FJADHN CC(C)N(C(=O)[C@@H](C)N[C@@H](Cc1ccccc1)c1cccs1)C(C)C ZINC000604892610 568383138 /nfs/dbraw/zinc/38/31/38/568383138.db2.gz YVHFPCZPGKXZCJ-MJGOQNOKSA-N 0 3 358.551 4.655 20 0 FJADHN CN(C)Cc1ccc(C(=O)Nc2nc(/C=C/c3ccccc3)cs2)cc1 ZINC000604963144 568428598 /nfs/dbraw/zinc/42/85/98/568428598.db2.gz ZRXGCJWGVZHJMO-JLHYYAGUSA-N 0 3 363.486 4.627 20 0 FJADHN CN(C)Cc1ccc(CNC(=O)Nc2ccccc2-c2cccs2)cc1 ZINC000261370394 568454838 /nfs/dbraw/zinc/45/48/38/568454838.db2.gz SXYRGWVPJXATDY-UHFFFAOYSA-N 0 3 365.502 4.798 20 0 FJADHN CCCCOc1ccc(-c2nnc(CN3CCCC[C@H]3C(C)C)o2)cc1 ZINC000605026144 568531127 /nfs/dbraw/zinc/53/11/27/568531127.db2.gz CUIWQUHQWPRQLT-IBGZPJMESA-N 0 3 357.498 4.926 20 0 FJADHN FC(F)(F)COc1ccc(CN2CCS[C@H](c3ccccc3)C2)cc1 ZINC000605154211 568598364 /nfs/dbraw/zinc/59/83/64/568598364.db2.gz LNPQAGANVDEBDF-SFHVURJKSA-N 0 3 367.436 4.918 20 0 FJADHN CN(C)Cc1cccc(NC(=O)c2cccc(OC3CCCCC3)c2)c1 ZINC000606172321 568704869 /nfs/dbraw/zinc/70/48/69/568704869.db2.gz CLCXEFAMOYLENN-UHFFFAOYSA-N 0 3 352.478 4.712 20 0 FJADHN Fc1cccc(CN2CC[C@@]23CCCN(c2ccc4ccccc4n2)C3)c1 ZINC001164994240 722191765 /nfs/dbraw/zinc/19/17/65/722191765.db2.gz LZENCGKEHQDJRF-HSZRJFAPSA-N 0 3 361.464 4.619 20 0 FJADHN CC[C@@H](c1ccc(Cl)cc1)N1CCC(C(=O)N[C@@H](C)C(C)C)CC1 ZINC000110180496 209320302 /nfs/dbraw/zinc/32/03/02/209320302.db2.gz GAIYTYRIDVPWJC-KXBFYZLASA-N 0 3 350.934 4.664 20 0 FJADHN Cc1ccc(NC(=O)[C@H]2CCCN(Cc3cccc(F)c3)C2)c(Cl)c1 ZINC000109016967 209295461 /nfs/dbraw/zinc/29/54/61/209295461.db2.gz MIQBJWQDZAIQLY-INIZCTEOSA-N 0 3 360.860 4.638 20 0 FJADHN O=C(CCN1CCc2ccccc2C1)Nc1ccccc1-c1ccccc1 ZINC000022197455 220378543 /nfs/dbraw/zinc/37/85/43/220378543.db2.gz DJGRYHOUSGUCCT-UHFFFAOYSA-N 0 3 356.469 4.741 20 0 FJADHN O=C(CCN1CCC[C@H](C(F)(F)F)C1)Nc1c(Cl)cccc1Cl ZINC000022198605 220378873 /nfs/dbraw/zinc/37/88/73/220378873.db2.gz UQHKKYCSDNFWRY-JTQLQIEISA-N 0 3 369.214 4.596 20 0 FJADHN FC(F)(F)c1nc2ccccc2n1C1CCN(Cc2ccccc2)CC1 ZINC000095076846 209017960 /nfs/dbraw/zinc/01/79/60/209017960.db2.gz ZZLHASAPQXOICP-UHFFFAOYSA-N 0 3 359.395 4.892 20 0 FJADHN COCc1cccc(CN[C@@H](C)c2ccc(F)c(Br)c2)c1 ZINC000038010741 263399647 /nfs/dbraw/zinc/39/96/47/263399647.db2.gz VAGABPNHSDWSHJ-LBPRGKRZSA-N 0 3 352.247 4.585 20 0 FJADHN O=C(c1ccc(CN2CCCC2)cc1)N1CC[C@@H]1c1ccc(Cl)cc1 ZINC000521406790 567869100 /nfs/dbraw/zinc/86/91/00/567869100.db2.gz PNYYNNCQDUPHNN-HXUWFJFHSA-N 0 3 354.881 4.523 20 0 FJADHN Cc1c2cc(F)ccc2oc1C(=O)N(c1ccccc1)C1CCN(C)CC1 ZINC000601954691 567885004 /nfs/dbraw/zinc/88/50/04/567885004.db2.gz DFAHXCZSVZRJDC-UHFFFAOYSA-N 0 3 366.436 4.621 20 0 FJADHN CC(C)Sc1ccc(C(=O)N(c2ccccc2)C2CCN(C)CC2)cc1 ZINC000601961058 567887358 /nfs/dbraw/zinc/88/73/58/567887358.db2.gz CJTGYNPWDTZHNO-UHFFFAOYSA-N 0 3 368.546 4.928 20 0 FJADHN CN1CCC(N(C(=O)Cc2cccc3ccccc32)c2ccccc2)CC1 ZINC000601966919 567889321 /nfs/dbraw/zinc/88/93/21/567889321.db2.gz JZCMFICNLLBYDC-UHFFFAOYSA-N 0 3 358.485 4.510 20 0 FJADHN CC[C@@H](Cc1ccccc1)C(=O)NC[C@@H](c1ccsc1)N(CC)CC ZINC000602093033 567932743 /nfs/dbraw/zinc/93/27/43/567932743.db2.gz GQBZHWHEIHNSFN-ICSRJNTNSA-N 0 3 358.551 4.516 20 0 FJADHN C[C@@H](c1ccccc1Cl)N1CCC[C@H](c2nnc3n2CCCCC3)C1 ZINC000521422190 567989246 /nfs/dbraw/zinc/98/92/46/567989246.db2.gz DXKSCAFZYDGTIO-HOTGVXAUSA-N 0 3 358.917 4.599 20 0 FJADHN COc1ccc(C)cc1NC(=O)[C@@H](NCCCC(C)C)c1ccccc1 ZINC000028370748 568005750 /nfs/dbraw/zinc/00/57/50/568005750.db2.gz FGYVNKVKCZCIDU-NRFANRHFSA-N 0 3 354.494 4.709 20 0 FJADHN FC(F)Oc1cccc(Cl)c1CNC[C@H]1CCOc2ccccc21 ZINC000602909557 568010856 /nfs/dbraw/zinc/01/08/56/568010856.db2.gz YSAZLQKSOLFJHJ-GFCCVEGCSA-N 0 3 353.796 4.597 20 0 FJADHN Cc1ccccc1[C@H](NCc1cnc(N(C)C)nc1)C1CCC(C)CC1 ZINC000602911662 568011281 /nfs/dbraw/zinc/01/12/81/568011281.db2.gz IJAZCQZPXCSQSH-VFIGECHUSA-N 0 3 352.526 4.508 20 0 FJADHN Cc1ccc([C@H](NCc2cccc(CN3CCCC3=O)c2)C2CCC2)cc1 ZINC000186998285 568047263 /nfs/dbraw/zinc/04/72/63/568047263.db2.gz YUNRHSCXRADDQC-XMMPIXPASA-N 0 3 362.517 4.748 20 0 FJADHN CN(C)CCc1ccccc1NC(=O)N[C@@H](c1cccc(F)c1)C(C)(C)C ZINC000446576564 568054612 /nfs/dbraw/zinc/05/46/12/568054612.db2.gz PQLWFFMUDKAESJ-FQEVSTJZSA-N 0 3 371.500 4.839 20 0 FJADHN C[C@@H](CCC(C)(C)C)NC(=O)N(C)C1CCN(Cc2ccccc2)CC1 ZINC000605984832 568060585 /nfs/dbraw/zinc/06/05/85/568060585.db2.gz ACMSCUCDDDAIDD-SFHVURJKSA-N 0 3 359.558 4.507 20 0 FJADHN c1c(CN2CCC(C3CC3)CC2)c(-c2ccncc2)nn1-c1ccccc1 ZINC000644836926 568080445 /nfs/dbraw/zinc/08/04/45/568080445.db2.gz LXTAFICOEKAVNN-UHFFFAOYSA-N 0 3 358.489 4.556 20 0 FJADHN COc1cc(CN[C@H](C)c2cccc(OC(C)C)c2)ccc1OC(F)F ZINC000067691116 568080747 /nfs/dbraw/zinc/08/07/47/568080747.db2.gz ZEYSZKZGANCFLA-CQSZACIVSA-N 0 3 365.420 4.935 20 0 FJADHN COc1cc(CN[C@@H](C)c2cccc(OC(C)C)c2)ccc1OC(F)F ZINC000067691118 568080758 /nfs/dbraw/zinc/08/07/58/568080758.db2.gz ZEYSZKZGANCFLA-AWEZNQCLSA-N 0 3 365.420 4.935 20 0 FJADHN CCOc1cccc([C@@H](C)NCc2ccc(OC(F)F)c(OC)c2)c1 ZINC000068840329 568092796 /nfs/dbraw/zinc/09/27/96/568092796.db2.gz YDRAHIIYEGGQAC-CYBMUJFWSA-N 0 3 351.393 4.546 20 0 FJADHN CC[C@H](N[C@@H](C)c1ccc(S(C)(=O)=O)cc1)c1ccc(Cl)cc1 ZINC000121747866 568110439 /nfs/dbraw/zinc/11/04/39/568110439.db2.gz KIWHZSOCEVSBSO-UGSOOPFHSA-N 0 3 351.899 4.545 20 0 FJADHN C[C@@H](C[C@H]1CCCO1)NCc1csc(-c2ccc(C(F)(F)F)cc2)n1 ZINC000603512675 568110901 /nfs/dbraw/zinc/11/09/01/568110901.db2.gz CXAAERYAYOIZDI-BLLLJJGKSA-N 0 3 370.440 4.876 20 0 FJADHN FC(F)Oc1c(Cl)cc(Cl)cc1CNCC1CCSCC1 ZINC000603515124 568111441 /nfs/dbraw/zinc/11/14/41/568111441.db2.gz OFQXUPHTJXFATA-UHFFFAOYSA-N 0 3 356.265 4.828 20 0 FJADHN CCCCCOc1cc(CNC[C@@H]2OCCc3ccccc32)ccc1OC ZINC000603515888 568111550 /nfs/dbraw/zinc/11/15/50/568111550.db2.gz LXXITXWINHZNRE-QHCPKHFHSA-N 0 3 369.505 4.668 20 0 FJADHN Cc1cc(CNCc2cnc3ccccn23)ccc1Oc1ccc(F)cc1 ZINC000603516586 568111679 /nfs/dbraw/zinc/11/16/79/568111679.db2.gz NNGQNPGEMZJUBZ-UHFFFAOYSA-N 0 3 361.420 4.864 20 0 FJADHN CC[C@H](NC(=O)N(C)C1CCN(Cc2ccccc2)CC1)C1CCCCC1 ZINC000603601519 568124671 /nfs/dbraw/zinc/12/46/71/568124671.db2.gz WKJXIEVUBKJAJH-QFIPXVFZSA-N 0 3 371.569 4.651 20 0 FJADHN Cc1ccc(NC(=O)c2cccc(OC3CCCC3)c2)c(CN(C)C)c1 ZINC000603694599 568136714 /nfs/dbraw/zinc/13/67/14/568136714.db2.gz NKSXACUWWUTZFV-UHFFFAOYSA-N 0 3 352.478 4.630 20 0 FJADHN Cc1ccc(NC(=O)C[C@@H](c2ccccc2)C(F)(F)F)c(CN(C)C)c1 ZINC000603694767 568136745 /nfs/dbraw/zinc/13/67/45/568136745.db2.gz IBTQLDLPNJKVBB-KRWDZBQOSA-N 0 3 364.411 4.731 20 0 FJADHN Cc1ccc(NC(=O)c2ccc(OC3CCCC3)cc2)c(CN(C)C)c1 ZINC000603694963 568136804 /nfs/dbraw/zinc/13/68/04/568136804.db2.gz QTXRGBCTMBXDAD-UHFFFAOYSA-N 0 3 352.478 4.630 20 0 FJADHN Cc1ccc(NC(=O)c2cc(-c3ccccc3Cl)on2)c(CN(C)C)c1 ZINC000603695119 568136833 /nfs/dbraw/zinc/13/68/33/568136833.db2.gz FLRJGEYJGLVNBM-UHFFFAOYSA-N 0 3 369.852 4.617 20 0 FJADHN CCCc1ccc(-c2ccc(NC(=O)NC3CCN(C)CC3)cc2)cc1 ZINC000522780398 568154862 /nfs/dbraw/zinc/15/48/62/568154862.db2.gz HISFHSLQIKEDKO-UHFFFAOYSA-N 0 3 351.494 4.522 20 0 FJADHN c1nc(-c2ccccc2)sc1CNC[C@@H]1CCCN1Cc1ccccc1 ZINC000604069714 568206140 /nfs/dbraw/zinc/20/61/40/568206140.db2.gz CPNYFEHGOMONJN-FQEVSTJZSA-N 0 3 363.530 4.564 20 0 FJADHN Clc1cccc(-c2noc(CCNCc3ccc4ccccc4c3)n2)c1 ZINC000604069815 568206151 /nfs/dbraw/zinc/20/61/51/568206151.db2.gz LXCJFTQAPUJEPL-UHFFFAOYSA-N 0 3 363.848 4.876 20 0 FJADHN Clc1cccc(-c2noc(CCNCc3csc4ccccc34)n2)c1 ZINC000604069971 568206159 /nfs/dbraw/zinc/20/61/59/568206159.db2.gz UDTWEYZHOFSUAH-UHFFFAOYSA-N 0 3 369.877 4.937 20 0 FJADHN CCOC(=O)C[C@H](c1ccccc1)C1CCN([C@@H](C)c2cccnc2)CC1 ZINC000604124460 568213984 /nfs/dbraw/zinc/21/39/84/568213984.db2.gz FWHKZLFATBQPSF-PGRDOPGGSA-N 0 3 366.505 4.592 20 0 FJADHN CC1CCC(N(C)CC(=O)N[C@@H](c2cccs2)c2ccc(F)cc2)CC1 ZINC000302769664 568235390 /nfs/dbraw/zinc/23/53/90/568235390.db2.gz YEOJMDOVZQGBHO-ZYKWQNGHSA-N 0 3 374.525 4.603 20 0 FJADHN CCN(CC)[C@H](CNC(=O)C[C@H](C)c1ccccc1F)c1ccccc1 ZINC000303171399 568255376 /nfs/dbraw/zinc/25/53/76/568255376.db2.gz RGNCKNYSUWKNJJ-LAUBAEHRSA-N 0 3 356.485 4.519 20 0 FJADHN CN(C[C@H]1CCCN(C)C1)C(=O)c1cc2sc3ccccc3c2s1 ZINC000604346131 568264092 /nfs/dbraw/zinc/26/40/92/568264092.db2.gz KJNSXYPFKPYKBQ-ZDUSSCGKSA-N 0 3 358.532 4.530 20 0 FJADHN Cc1ccc(-c2ncc(CN[C@H]3CCCN(c4ccccc4)C3)s2)cc1 ZINC000604417173 568275257 /nfs/dbraw/zinc/27/52/57/568275257.db2.gz KIHZLOPYDCLZDU-IBGZPJMESA-N 0 3 363.530 4.877 20 0 FJADHN COc1ccc(CCNCc2ccc(-c3c(F)cccc3F)o2)cc1OC ZINC000604414469 568279273 /nfs/dbraw/zinc/27/92/73/568279273.db2.gz TWYRCNFZDPBUDW-UHFFFAOYSA-N 0 3 373.399 4.574 20 0 FJADHN CN(C)[C@@H](CNCc1ccc(-c2c(F)cccc2F)o1)c1cccs1 ZINC000604414649 568279574 /nfs/dbraw/zinc/27/95/74/568279574.db2.gz HKAVPEZGTONHLZ-INIZCTEOSA-N 0 3 362.445 4.679 20 0 FJADHN Cc1cc(F)ccc1-c1ccc(CNC[C@H](c2ccsc2)N(C)C)o1 ZINC000604414890 568279701 /nfs/dbraw/zinc/27/97/01/568279701.db2.gz LTRQAUTULVVDDC-LJQANCHMSA-N 0 3 358.482 4.848 20 0 FJADHN C[C@H](CNC(=O)N(C)[C@H](C)c1cccc(Cl)c1)N(C)Cc1ccccc1 ZINC000303460193 568280128 /nfs/dbraw/zinc/28/01/28/568280128.db2.gz LHCDIOCTNHMZOK-IAGOWNOFSA-N 0 3 373.928 4.563 20 0 FJADHN Cc1c(F)cccc1-c1ccc(CNCCCc2nc3ccccc3[nH]2)o1 ZINC000604415382 568280740 /nfs/dbraw/zinc/28/07/40/568280740.db2.gz BVABOOWUPINJKO-UHFFFAOYSA-N 0 3 363.436 4.993 20 0 FJADHN COc1ccccc1OCCCNCc1cnc(-c2ccc(C)cc2)s1 ZINC000604416157 568281263 /nfs/dbraw/zinc/28/12/63/568281263.db2.gz KFAGDFDTHXPSQD-UHFFFAOYSA-N 0 3 368.502 4.686 20 0 FJADHN CC[C@@H](N[C@H](C)c1ccc(S(=O)(=O)N(CC)CC)cc1)c1ccccc1 ZINC000303508284 568285059 /nfs/dbraw/zinc/28/50/59/568285059.db2.gz NLHSPMUNMUWWGB-DYESRHJHSA-N 0 3 374.550 4.519 20 0 FJADHN CCOc1ccccc1CN(CCCn1ccnc1)Cc1cccc(F)c1 ZINC000071810654 568302894 /nfs/dbraw/zinc/30/28/94/568302894.db2.gz AOBVBOANYOTGPK-UHFFFAOYSA-N 0 3 367.468 4.513 20 0 FJADHN COC(=O)c1cccc(CN(C)[C@@H](C)c2cccc(C(F)(F)F)c2)c1 ZINC000604492287 568303520 /nfs/dbraw/zinc/30/35/20/568303520.db2.gz RHHHLBSGSYBVRW-ZDUSSCGKSA-N 0 3 351.368 4.685 20 0 FJADHN CCSc1cccc(NC(=O)N2CCN(C3CCC(C)CC3)CC2)c1 ZINC000604623534 568328815 /nfs/dbraw/zinc/32/88/15/568328815.db2.gz GTNVJJFCFWAGOA-UHFFFAOYSA-N 0 3 361.555 4.527 20 0 FJADHN CC(C)Cc1ccc([C@@H](NC(=O)N(C)C[C@H]2CCCN(C)C2)C(C)C)cc1 ZINC000604634219 568333159 /nfs/dbraw/zinc/33/31/59/568333159.db2.gz JEQZTQYSDDLRPU-UNMCSNQZSA-N 0 3 373.585 4.565 20 0 FJADHN CCN(CC)Cc1cccc(NC(=O)[C@H]2C[C@H]2c2c(F)cccc2F)c1 ZINC000604699769 568347541 /nfs/dbraw/zinc/34/75/41/568347541.db2.gz HGHLYFJDXYRKBR-SJORKVTESA-N 0 3 358.432 4.549 20 0 FJADHN C[C@@H](c1ccccc1)N1CCC(NC(=O)c2ccc(C(F)F)cc2)CC1 ZINC000604714378 568355334 /nfs/dbraw/zinc/35/53/34/568355334.db2.gz LXZDKVWGBFBHMU-HNNXBMFYSA-N 0 3 358.432 4.580 20 0 FJADHN C[C@@H](CC(=O)NC1CCN([C@@H](C)c2ccccc2)CC1)c1ccccc1 ZINC000604714498 568355440 /nfs/dbraw/zinc/35/54/40/568355440.db2.gz WSKHQRLDWCCGCB-OALUTQOASA-N 0 3 350.506 4.522 20 0 FJADHN CCN(Cc1ccc(CN(C)C)cc1)C(=O)C[C@@H](C)c1ccccc1C ZINC000604743890 568360029 /nfs/dbraw/zinc/36/00/29/568360029.db2.gz PVUXCTDOFSPGOC-LJQANCHMSA-N 0 3 352.522 4.599 20 0 FJADHN COc1ccc(C2(NCc3cc4c(cc3OC)C[C@H](C)O4)CCCC2)cc1 ZINC000604765065 568361804 /nfs/dbraw/zinc/36/18/04/568361804.db2.gz NBPMUXPTZHLSKG-INIZCTEOSA-N 0 3 367.489 4.586 20 0 FJADHN Fc1cc(CNC2(c3ccc(Cl)cc3)CCCC2)ccc1-n1cncn1 ZINC000604765456 568361880 /nfs/dbraw/zinc/36/18/80/568361880.db2.gz PSJSYUMGKQMEMP-UHFFFAOYSA-N 0 3 370.859 4.619 20 0 FJADHN Cc1cc(C)c(CN[C@](C)(CO)c2cccc(C(F)(F)F)c2)cc1C ZINC000604767067 568362179 /nfs/dbraw/zinc/36/21/79/568362179.db2.gz BZDQBBBYORPJKK-LJQANCHMSA-N 0 3 351.412 4.628 20 0 FJADHN C[C@](CO)(NCc1csc2ccccc12)c1cccc(C(F)(F)F)c1 ZINC000604767404 568362290 /nfs/dbraw/zinc/36/22/90/568362290.db2.gz JTGZKPNKKJZSRV-GOSISDBHSA-N 0 3 365.420 4.917 20 0 FJADHN Cc1cc(F)ccc1-c1ccc(CN[C@H](CO)[C@H](C)c2ccccc2)o1 ZINC000604767877 568362426 /nfs/dbraw/zinc/36/24/26/568362426.db2.gz DUGQSBQTTVFMHO-IIBYNOLFSA-N 0 3 353.437 4.648 20 0 FJADHN Cc1c(F)cccc1-c1ccc(CN[C@@H](CO)[C@@H](C)c2ccccc2)o1 ZINC000604768416 568362600 /nfs/dbraw/zinc/36/26/00/568362600.db2.gz QAOKVDGXAPOWBQ-BTYIYWSLSA-N 0 3 353.437 4.648 20 0 FJADHN C[C@@H](c1ccccc1)[C@H](CO)NCc1ccc(Cl)c(C(F)(F)F)c1 ZINC000604768528 568362607 /nfs/dbraw/zinc/36/26/07/568362607.db2.gz SBHDDIJTVAAQLC-SJCJKPOMSA-N 0 3 357.803 4.613 20 0 FJADHN C[C@H](c1ccccc1)[C@@H](CO)NCc1ccc(Cl)c(C(F)(F)F)c1 ZINC000604768529 568362615 /nfs/dbraw/zinc/36/26/15/568362615.db2.gz SBHDDIJTVAAQLC-SJKOYZFVSA-N 0 3 357.803 4.613 20 0 FJADHN C[C@@H](N[C@H](Cc1ccccc1)c1cccs1)C(=O)Nc1ccccc1 ZINC000604891890 568382029 /nfs/dbraw/zinc/38/20/29/568382029.db2.gz FIQMDCKBISEGHW-VQIMIIECSA-N 0 3 350.487 4.649 20 0 FJADHN Cc1ccccc1C(C)(C)C(=O)Nc1ccc(OCCN(C)C)c(Cl)c1 ZINC000604873508 568382581 /nfs/dbraw/zinc/38/25/81/568382581.db2.gz IYSGOVBJMHWXBK-UHFFFAOYSA-N 0 3 374.912 4.505 20 0 FJADHN CCc1ccc([C@H](C)C(=O)Nc2ccc(OCCN(C)C)c(Cl)c2)cc1 ZINC000604874116 568382599 /nfs/dbraw/zinc/38/25/99/568382599.db2.gz QHAOKBAURVZBAO-HNNXBMFYSA-N 0 3 374.912 4.585 20 0 FJADHN CC(C)(NC(=O)N[C@H](CN1CCCCC1)c1ccccc1)c1cccs1 ZINC000604920716 568390385 /nfs/dbraw/zinc/39/03/85/568390385.db2.gz GYOJSKPLIHEHHB-GOSISDBHSA-N 0 3 371.550 4.510 20 0 FJADHN O[C@H](CN[C@H](CC(F)F)c1ccccc1)COc1ccc2ccccc2c1 ZINC000643255728 568406734 /nfs/dbraw/zinc/40/67/34/568406734.db2.gz REJXYTZQWXTUDQ-TZIWHRDSSA-N 0 3 371.427 4.566 20 0 FJADHN Cc1ncsc1CN(C)CC/C=C/c1ccc(Br)cc1 ZINC000604998651 568512012 /nfs/dbraw/zinc/51/20/12/568512012.db2.gz NZAMNOXERAHPAF-HWKANZROSA-N 0 3 351.313 4.749 20 0 FJADHN CC1(C)CN(Cc2cn(-c3ccccc3)nc2-c2ccccc2)CCCO1 ZINC000604999463 568512765 /nfs/dbraw/zinc/51/27/65/568512765.db2.gz QXWKEVTXTJXDCE-UHFFFAOYSA-N 0 3 361.489 4.540 20 0 FJADHN CCCOc1ccc(O[C@@H]2CCCC[C@@H]2NCc2nc(C)cs2)cc1 ZINC000605008478 568515805 /nfs/dbraw/zinc/51/58/05/568515805.db2.gz XCXCYJOKKZILMJ-RBUKOAKNSA-N 0 3 360.523 4.720 20 0 FJADHN CC(C)(NC(=O)C1CCN(Cc2ccccc2)CC1)c1cccc(Cl)c1 ZINC000606216795 568725036 /nfs/dbraw/zinc/72/50/36/568725036.db2.gz IJEYESOFWLARGQ-UHFFFAOYSA-N 0 3 370.924 4.604 20 0 FJADHN CC(C)[C@H](NCC(=O)Nc1ccccc1Cl)c1ccc(Cl)cc1 ZINC000010136988 207296325 /nfs/dbraw/zinc/29/63/25/207296325.db2.gz WLPDLLTXZJYDIT-SFHVURJKSA-N 0 3 351.277 4.919 20 0 FJADHN CCN(CC)[C@H](CNC(=O)[C@@H]1CCCC[C@@H]1C(F)(F)F)c1ccccc1 ZINC000107922986 222405339 /nfs/dbraw/zinc/40/53/39/222405339.db2.gz OWJAMBPSYZTTJV-FGTMMUONSA-N 0 3 370.459 4.554 20 0 FJADHN O=C(c1ccc(CN2CCCC2)cc1)N1CC[C@H]1c1ccc(Cl)cc1 ZINC000521406789 567869114 /nfs/dbraw/zinc/86/91/14/567869114.db2.gz PNYYNNCQDUPHNN-FQEVSTJZSA-N 0 3 354.881 4.523 20 0 FJADHN CN1CCC(N(C(=O)c2cc3ccccc3s2)c2ccccc2)CC1 ZINC000601957131 567886004 /nfs/dbraw/zinc/88/60/04/567886004.db2.gz NUVWUVYGHUOESX-UHFFFAOYSA-N 0 3 350.487 4.642 20 0 FJADHN CCc1cccc(C)c1NC(=O)NC[C@@H](c1ccsc1)N(CC)CC ZINC000043156243 567886769 /nfs/dbraw/zinc/88/67/69/567886769.db2.gz AAABZZJLIBZLEB-SFHVURJKSA-N 0 3 359.539 4.824 20 0 FJADHN CC(C)[C@@H](CC(=O)N(c1ccccc1)C1CCN(C)CC1)c1ccccc1 ZINC000601960677 567887168 /nfs/dbraw/zinc/88/71/68/567887168.db2.gz VWRRJQCHDDSXPY-HSZRJFAPSA-N 0 3 364.533 4.944 20 0 FJADHN CN1CCC(N(C(=O)c2ccc(Cl)cc2Cl)c2ccccc2)CC1 ZINC000601962276 567887698 /nfs/dbraw/zinc/88/76/98/567887698.db2.gz LSASHFKGSRWRFB-UHFFFAOYSA-N 0 3 363.288 4.734 20 0 FJADHN CC(C)c1ccc(CCC(=O)N(c2ccccc2)C2CCN(C)CC2)cc1 ZINC000601962680 567887872 /nfs/dbraw/zinc/88/78/72/567887872.db2.gz OZJNIFAQCCFBHS-UHFFFAOYSA-N 0 3 364.533 4.870 20 0 FJADHN CN1CCC(N(C(=O)CCCc2ccc(Cl)cc2)c2ccccc2)CC1 ZINC000601963388 567888130 /nfs/dbraw/zinc/88/81/30/567888130.db2.gz VRECLGBTRSCPTQ-UHFFFAOYSA-N 0 3 370.924 4.790 20 0 FJADHN CSc1ccc(Cl)c(C(=O)N(c2ccccc2)C2CCN(C)CC2)c1 ZINC000601963852 567888528 /nfs/dbraw/zinc/88/85/28/567888528.db2.gz WSCWAMSHHKMAPT-UHFFFAOYSA-N 0 3 374.937 4.803 20 0 FJADHN CC(C)Cc1ccc(CC(=O)N(c2ccccc2)C2CCN(C)CC2)cc1 ZINC000601968776 567889955 /nfs/dbraw/zinc/88/99/55/567889955.db2.gz QUXBRRPTDDWEQY-UHFFFAOYSA-N 0 3 364.533 4.555 20 0 FJADHN Cc1ccc([C@@H](CNC(=O)N2CCCCC[C@@H]2c2ccco2)N(C)C)cc1 ZINC000605962017 567942918 /nfs/dbraw/zinc/94/29/18/567942918.db2.gz DNDNMQKHXNIHGF-WOJBJXKFSA-N 0 3 369.509 4.518 20 0 FJADHN C[C@@H](Nc1cccc(N2CCN(CC3CC3)CC2)c1)c1ccc(F)cc1 ZINC000602578801 567993473 /nfs/dbraw/zinc/99/34/73/567993473.db2.gz KERPPOGWPBWWFJ-QGZVFWFLSA-N 0 3 353.485 4.531 20 0 FJADHN C[C@H](N[C@@H]1CCc2nc(-c3ccccc3)ncc2C1)c1cc(F)ccc1F ZINC000602584077 567994092 /nfs/dbraw/zinc/99/40/92/567994092.db2.gz CSTSNBQHHBNVPO-KBXCAEBGSA-N 0 3 365.427 4.630 20 0 FJADHN C[C@@H](N[C@H]1CCc2nc(-c3ccccc3)ncc2C1)c1ccc(F)cc1F ZINC000602584117 567994158 /nfs/dbraw/zinc/99/41/58/567994158.db2.gz NJWWVKKJEUZGIG-KDOFPFPSSA-N 0 3 365.427 4.630 20 0 FJADHN CC[C@@H](NCc1ccc(OCCN(C)C)cc1)c1cccc(Cl)c1F ZINC000461108039 568005618 /nfs/dbraw/zinc/00/56/18/568005618.db2.gz LONCLJGKJSSSBQ-LJQANCHMSA-N 0 3 364.892 4.660 20 0 FJADHN COc1cc(CN[C@H]2CCSc3cc(C)c(C)cc32)cc(OC)c1OC ZINC000186945617 568020785 /nfs/dbraw/zinc/02/07/85/568020785.db2.gz YZFFOYQOFUDXLI-KRWDZBQOSA-N 0 3 373.518 4.656 20 0 FJADHN C[C@H](NCc1ccc(Br)cc1C(F)(F)F)[C@@H]1CC1(F)F ZINC000666445186 568082550 /nfs/dbraw/zinc/08/25/50/568082550.db2.gz QWIWPZJZNLMDSN-CPCISQLKSA-N 0 3 358.148 4.601 20 0 FJADHN C[C@@H]1CN(Cc2cccc(-c3ccccc3)c2)C[C@@]2(CCO[C@H](C)C2)O1 ZINC000430780136 568104846 /nfs/dbraw/zinc/10/48/46/568104846.db2.gz JJZATIIJGSSZNC-PWHSHALESA-N 0 3 351.490 4.512 20 0 FJADHN CC[C@H](N[C@@H]1CCN(c2ccc(C(F)(F)F)cc2)C1=O)c1ccccc1 ZINC000603509834 568110326 /nfs/dbraw/zinc/11/03/26/568110326.db2.gz RJMPZGPEXGFRFN-ZWKOTPCHSA-N 0 3 362.395 4.552 20 0 FJADHN CC[C@@H](N[C@H](C)c1ccc(S(C)(=O)=O)cc1)c1ccc(Cl)cc1 ZINC000121748334 568110435 /nfs/dbraw/zinc/11/04/35/568110435.db2.gz KIWHZSOCEVSBSO-FZKQIMNGSA-N 0 3 351.899 4.545 20 0 FJADHN CCCCOc1ccc(CNC[C@H]2OCCc3ccccc32)cc1OCC ZINC000603516222 568111663 /nfs/dbraw/zinc/11/16/63/568111663.db2.gz PIBBMKKETXCDNB-HSZRJFAPSA-N 0 3 369.505 4.668 20 0 FJADHN FC(F)Oc1ccc2ccccc2c1CNC[C@@H]1OCCc2ccccc21 ZINC000603516547 568111685 /nfs/dbraw/zinc/11/16/85/568111685.db2.gz XTPRDJWUFMTHJA-NRFANRHFSA-N 0 3 369.411 4.845 20 0 FJADHN COc1ccc(CNC[C@@H]2OCCc3ccccc32)cc1OCCC(C)C ZINC000603516460 568111716 /nfs/dbraw/zinc/11/17/16/568111716.db2.gz UJGSSGHTOLYEPR-QHCPKHFHSA-N 0 3 369.505 4.524 20 0 FJADHN Cc1cn2c(CNCCCO[C@H]3CCCc4ccccc43)c(C)nc2s1 ZINC000603723605 568142244 /nfs/dbraw/zinc/14/22/44/568142244.db2.gz LPZGGEFSCYMHGI-FQEVSTJZSA-N 0 3 369.534 4.587 20 0 FJADHN COC(=O)c1cccc(CN2CCC(c3c(C)[nH]c4ccccc43)CC2)c1 ZINC000603869851 568173763 /nfs/dbraw/zinc/17/37/63/568173763.db2.gz QYJYBGLGRZACCG-UHFFFAOYSA-N 0 3 362.473 4.643 20 0 FJADHN C[C@H](N[C@H]1CCC[C@@H]2C[C@@H]21)c1nnc(-c2ccc(Cl)c(Cl)c2)o1 ZINC000563109357 568197630 /nfs/dbraw/zinc/19/76/30/568197630.db2.gz YIMOTAHNDRQTCQ-HOZXKAFVSA-N 0 3 352.265 4.883 20 0 FJADHN Cc1cc(C)c(NC(=O)NC[C@@H]2CCCN2Cc2ccccc2)c(Cl)c1 ZINC000604092304 568211800 /nfs/dbraw/zinc/21/18/00/568211800.db2.gz IIUPSXRGEPIUFQ-SFHVURJKSA-N 0 3 371.912 4.743 20 0 FJADHN CC(C)n1cc(C2=CCCN([C@@H](C)c3cc4ccccc4o3)CC2)nn1 ZINC000563117988 568223331 /nfs/dbraw/zinc/22/33/31/568223331.db2.gz CIWGTTSHKSUSLI-INIZCTEOSA-N 0 3 350.466 4.846 20 0 FJADHN C[C@@H](N[C@@H](C)c1ccc(C(F)(F)F)cc1)c1ccc(S(C)(=O)=O)cc1 ZINC000122277914 568225043 /nfs/dbraw/zinc/22/50/43/568225043.db2.gz DSWMTJSPAIOACK-QWHCGFSZSA-N 0 3 371.424 4.521 20 0 FJADHN C[C@H](c1cccs1)N(C)C(=O)N[C@@H](CN1CCCCC1)c1ccccc1 ZINC000604202169 568227566 /nfs/dbraw/zinc/22/75/66/568227566.db2.gz QUBQCLZECBYLDL-MJGOQNOKSA-N 0 3 371.550 4.678 20 0 FJADHN CSCc1c2ccccc2oc1C(=O)NCC(C)(C)N1CCC[C@H](C)C1 ZINC000604300337 568245367 /nfs/dbraw/zinc/24/53/67/568245367.db2.gz BRPMYVQEGYKIMI-HNNXBMFYSA-N 0 3 374.550 4.536 20 0 FJADHN C[C@H](NC(C)(C)CNC(=O)C1(c2ccc(Cl)cc2)CC1)c1ccccc1 ZINC000303175039 568255591 /nfs/dbraw/zinc/25/55/91/568255591.db2.gz CAMGRWDUWIPJEF-INIZCTEOSA-N 0 3 370.924 4.617 20 0 FJADHN CN(C[C@@H]1CCCN(C)C1)C(=O)c1cc2sc3ccccc3c2s1 ZINC000604346130 568264131 /nfs/dbraw/zinc/26/41/31/568264131.db2.gz KJNSXYPFKPYKBQ-CYBMUJFWSA-N 0 3 358.532 4.530 20 0 FJADHN CSc1ccc2c(c1)[C@H](N[C@@H](C)c1ccc([S@](C)=O)cc1)CCC2 ZINC000563136261 568275332 /nfs/dbraw/zinc/27/53/32/568275332.db2.gz QVIWYKHDHOIOSR-FDORUFNTSA-N 0 3 359.560 4.874 20 0 FJADHN C[C@@H](CNC(=O)N(C)[C@@H](C)c1cccc(Cl)c1)N(C)Cc1ccccc1 ZINC000303460194 568280061 /nfs/dbraw/zinc/28/00/61/568280061.db2.gz LHCDIOCTNHMZOK-IRXDYDNUSA-N 0 3 373.928 4.563 20 0 FJADHN Cc1ccc(-c2ncc(CN[C@H](C)COc3ccc(F)cc3F)s2)cc1 ZINC000604415235 568280343 /nfs/dbraw/zinc/28/03/43/568280343.db2.gz HYFYSLBOQQQAMD-CQSZACIVSA-N 0 3 374.456 4.954 20 0 FJADHN CSCCNCc1cccc(NC(=O)c2ccc(Cl)cc2Cl)c1 ZINC000604477493 568299754 /nfs/dbraw/zinc/29/97/54/568299754.db2.gz ZFVRGTVSSDDSKX-UHFFFAOYSA-N 0 3 369.317 4.698 20 0 FJADHN CCC(CC)CN(CC)Cc1nnc(-c2c(C)onc2-c2ccccc2)o1 ZINC000051824400 568304128 /nfs/dbraw/zinc/30/41/28/568304128.db2.gz JPUSUZDGHJSSHZ-UHFFFAOYSA-N 0 3 368.481 4.958 20 0 FJADHN CC(C)Cc1ccc([C@@H](NC(=O)N(C)C[C@@H]2CCCN(C)C2)C(C)C)cc1 ZINC000604634217 568333127 /nfs/dbraw/zinc/33/31/27/568333127.db2.gz JEQZTQYSDDLRPU-IRLDBZIGSA-N 0 3 373.585 4.565 20 0 FJADHN C[C@H]1CCC[C@@H](CCNC(=O)N(C)C2CCN(Cc3ccccc3)CC2)C1 ZINC000604667011 568344325 /nfs/dbraw/zinc/34/43/25/568344325.db2.gz JIRKCUHFNIZKOB-PMACEKPBSA-N 0 3 371.569 4.509 20 0 FJADHN C[C@@H]1CCC[C@H](CCNC(=O)N(C)C2CCN(Cc3ccccc3)CC2)C1 ZINC000604667014 568344330 /nfs/dbraw/zinc/34/43/30/568344330.db2.gz JIRKCUHFNIZKOB-WOJBJXKFSA-N 0 3 371.569 4.509 20 0 FJADHN CC[C@@H](CC(=O)NC1CCN([C@@H](C)c2ccccc2)CC1)c1ccccc1 ZINC000604713764 568355187 /nfs/dbraw/zinc/35/51/87/568355187.db2.gz HUYZMIHTGCTXDY-PMACEKPBSA-N 0 3 364.533 4.912 20 0 FJADHN CCc1ccc([C@H](C)C(=O)NC2CCN([C@H](C)c3ccccc3)CC2)cc1 ZINC000604713752 568355216 /nfs/dbraw/zinc/35/52/16/568355216.db2.gz GTYWABDSNDFQPA-RBUKOAKNSA-N 0 3 364.533 4.694 20 0 FJADHN Cc1ccc(CCC(=O)NC2CCN([C@H](C)c3ccccc3)CC2)c(C)c1 ZINC000604713860 568355264 /nfs/dbraw/zinc/35/52/64/568355264.db2.gz QXYVUZSZTNRAKI-HXUWFJFHSA-N 0 3 364.533 4.578 20 0 FJADHN C[C@H](c1ccccc1)N1CCC(NC(=O)C[C@H](C)c2ccccc2)CC1 ZINC000604714499 568355453 /nfs/dbraw/zinc/35/54/53/568355453.db2.gz WSKHQRLDWCCGCB-RBUKOAKNSA-N 0 3 350.506 4.522 20 0 FJADHN Cc1ccccc1[C@@H](C)CC(=O)NC[C@H]1CCCN(Cc2ccccc2)C1 ZINC000604742284 568359841 /nfs/dbraw/zinc/35/98/41/568359841.db2.gz RMMPFYBUMOJEKH-RBBKRZOGSA-N 0 3 364.533 4.517 20 0 FJADHN C[C@H](c1ccccc1)[C@H](CO)NCc1ccc(-c2ccccc2Cl)o1 ZINC000604767850 568362437 /nfs/dbraw/zinc/36/24/37/568362437.db2.gz DJJUDXRVUAPZLE-QRWLVFNGSA-N 0 3 355.865 4.854 20 0 FJADHN CC(C)NC(=O)[C@@H]1CCC[C@H](NCc2ccc(-c3ccccc3Cl)o2)C1 ZINC000604772936 568363578 /nfs/dbraw/zinc/36/35/78/568363578.db2.gz XCLFLWRPFJQTIL-CVEARBPZSA-N 0 3 374.912 4.773 20 0 FJADHN CCc1cc2c(ncnc2NC2CCN([C@H](C)c3ccccc3)CC2)s1 ZINC000604757546 568365338 /nfs/dbraw/zinc/36/53/38/568365338.db2.gz IYMNVIOVWQWLDO-OAHLLOKOSA-N 0 3 366.534 4.891 20 0 FJADHN COc1cc(NC(=O)[C@@H](C)[C@@H](N)c2ccccc2)c(C2CC2)cc1Cl ZINC000655529964 568366185 /nfs/dbraw/zinc/36/61/85/568366185.db2.gz FKSJWHIYQNNADG-HXPMCKFVSA-N 0 3 358.869 4.501 20 0 FJADHN Cc1ccccc1[C@@H](C)NC(=O)NC1CCN([C@H](C)c2ccccc2)CC1 ZINC000604784909 568366405 /nfs/dbraw/zinc/36/64/05/568366405.db2.gz JPFNCEFFKHTRIT-RTBURBONSA-N 0 3 365.521 4.581 20 0 FJADHN Cc1ccc(Cl)cc1NC(=O)NC1CCN([C@@H](C)c2ccccc2)CC1 ZINC000604792289 568367706 /nfs/dbraw/zinc/36/77/06/568367706.db2.gz WJLIFUTUSJLRQF-INIZCTEOSA-N 0 3 371.912 4.996 20 0 FJADHN CC(C)[C@@H]1CCCN(C(=O)NC2CCN([C@H](C)c3ccccc3)CC2)CC1 ZINC000604827718 568376707 /nfs/dbraw/zinc/37/67/07/568376707.db2.gz XUXAGZRBKKAHOW-WOJBJXKFSA-N 0 3 371.569 4.680 20 0 FJADHN C[C@@H](N[C@@H](Cc1ccccc1)c1cccs1)C(=O)N(C)c1ccccc1 ZINC000604891857 568381928 /nfs/dbraw/zinc/38/19/28/568381928.db2.gz CBXYTUDFFHFUMJ-XLIONFOSSA-N 0 3 364.514 4.673 20 0 FJADHN C[C@H](N[C@H](Cc1ccccc1)c1cccs1)C(=O)N(C)c1ccccc1 ZINC000604891855 568381994 /nfs/dbraw/zinc/38/19/94/568381994.db2.gz CBXYTUDFFHFUMJ-FXAWDEMLSA-N 0 3 364.514 4.673 20 0 FJADHN Cc1cccc(NC(=O)[C@@H](C)N[C@@H](Cc2ccccc2)c2cccs2)c1 ZINC000604892310 568382110 /nfs/dbraw/zinc/38/21/10/568382110.db2.gz PDXKLRHBBJJNLF-XLIONFOSSA-N 0 3 364.514 4.957 20 0 FJADHN COc1ccc(-c2nc(CN(C)C3CCC(C)CC3)cs2)c(OC)c1 ZINC000061799197 568468399 /nfs/dbraw/zinc/46/83/99/568468399.db2.gz QMAPFZAZXSARLH-UHFFFAOYSA-N 0 3 360.523 4.838 20 0 FJADHN C[C@H](NC1(C(=O)Nc2ccccc2)CC1)C1CCC(C(F)(F)F)CC1 ZINC000433074735 568503028 /nfs/dbraw/zinc/50/30/28/568503028.db2.gz FBZYAAXOAHCUPI-NFOMZHRRSA-N 0 3 354.416 4.505 20 0 FJADHN CC(C)[C@@H]1CCCCN1Cc1nc(-c2ccc(C(F)(F)F)cc2)no1 ZINC000605000332 568513875 /nfs/dbraw/zinc/51/38/75/568513875.db2.gz JEXVHRRJHGYUKR-HNNXBMFYSA-N 0 3 353.388 4.766 20 0 FJADHN CN1CCC[C@H](CNC(=O)CC(C)(C)C)[C@@H]1c1ccc(C(F)(F)F)cc1 ZINC000605103350 568566440 /nfs/dbraw/zinc/56/64/40/568566440.db2.gz RWMCPSBZPPCZBG-QAPCUYQASA-N 0 3 370.459 4.641 20 0 FJADHN C[C@](CO)(NCc1cccc2ccccc21)c1cccc(C(F)(F)F)c1 ZINC000605151939 568580585 /nfs/dbraw/zinc/58/05/85/568580585.db2.gz JADSHCGZQRMZAV-HXUWFJFHSA-N 0 3 359.391 4.856 20 0 FJADHN c1ccc(SCCN2CCC(c3nc(-c4ccccc4)no3)CC2)cc1 ZINC000605150681 568587724 /nfs/dbraw/zinc/58/77/24/568587724.db2.gz OHXUEAVVXDLOIU-UHFFFAOYSA-N 0 3 365.502 4.708 20 0 FJADHN Cc1cc(C)n(-c2ccc(CN3CCS[C@@H](c4ccccc4)C3)cc2)n1 ZINC000605154506 568598960 /nfs/dbraw/zinc/59/89/60/568598960.db2.gz SGJQDTYWTOKUBE-JOCHJYFZSA-N 0 3 363.530 4.779 20 0 FJADHN C[C@H](C(=O)NC[C@@H](c1cccs1)N1CCC(C)CC1)c1cccs1 ZINC000606163083 568681459 /nfs/dbraw/zinc/68/14/59/568681459.db2.gz WLZVXBICTRTZEP-HOTGVXAUSA-N 0 3 362.564 4.503 20 0 FJADHN O=C(Nc1cccc(CN2CCCCC2)c1)c1coc(-c2ccccc2)n1 ZINC000606174198 568690228 /nfs/dbraw/zinc/69/02/28/568690228.db2.gz RTKIVOHDHMJAMX-UHFFFAOYSA-N 0 3 361.445 4.580 20 0 FJADHN CCCN(C(=O)[C@H](C)c1ccsc1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000606187811 568709390 /nfs/dbraw/zinc/70/93/90/568709390.db2.gz HPUMSUYHBGUFGQ-WIYYLYMNSA-N 0 3 370.562 4.755 20 0 FJADHN