smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name Cc1sc(NC(=O)c2ccc(F)cc2)c(CN2CCCCCC2)c1C ZINC000000630414 567916486 /nfs/dbraw/zinc/91/64/86/567916486.db2.gz NIUUWDFMVWJKAN-UHFFFAOYSA-N 0 3 360.498 5.132 50 0 aggregator FKAAHN CN(C)CCNc1cc(-c2cc(Cl)ccc2Cl)nc2ccccc21 ZINC000000632869 219306435 /nfs/dbraw/zinc/30/64/35/219306435.db2.gz LVIDLUGZHKSPFV-UHFFFAOYSA-N 0 3 360.288 5.182 50 0 FKAAHN CN1CCC(Oc2ccccc2Sc2ccccc2C(F)(F)F)CC1 ZINC000000702111 206130402 /nfs/dbraw/zinc/13/04/02/206130402.db2.gz DPBGOHFPUVYOPM-UHFFFAOYSA-N 0 3 367.436 5.330 50 0 FKAAHN CN(C)Cc1ccccc1N[C@H]1c2ccccc2CSc2ccccc21 ZINC000000702116 570451036 /nfs/dbraw/zinc/45/10/36/570451036.db2.gz MSXPUBMISLGRCR-QHCPKHFHSA-N 0 3 360.526 5.555 50 0 FKAAHN CN(C)Cc1ccccc1N[C@@H]1c2ccccc2CSc2ccccc21 ZINC000000702117 570450818 /nfs/dbraw/zinc/45/08/18/570450818.db2.gz MSXPUBMISLGRCR-HSZRJFAPSA-N 0 3 360.526 5.555 50 0 FKAAHN Clc1ccc2c(c1)[C@H](O[C@H]1CN3CCC1CC3)c1ccccc1CS2 ZINC000000702160 210262629 /nfs/dbraw/zinc/26/26/29/210262629.db2.gz BMQGWQJMFCYXPU-PZJWPPBQSA-N 0 3 371.933 5.146 50 0 FKAAHN Clc1ccc2c(c1)[C@@H](O[C@@H]1CN3CCC1CC3)c1ccccc1CS2 ZINC000000702161 219314047 /nfs/dbraw/zinc/31/40/47/219314047.db2.gz BMQGWQJMFCYXPU-CTNGQTDRSA-N 0 3 371.933 5.146 50 0 FKAAHN Clc1ccc2c(c1)[C@H](O[C@@H]1CN3CCC1CC3)c1ccccc1CS2 ZINC000000702162 219314561 /nfs/dbraw/zinc/31/45/61/219314561.db2.gz BMQGWQJMFCYXPU-TZIWHRDSSA-N 0 3 371.933 5.146 50 0 FKAAHN COc1ccc(C2=C(CN(C)C)[C@H](c3ccccc3)c3ccccc3O2)cc1 ZINC000000708910 570451660 /nfs/dbraw/zinc/45/16/60/570451660.db2.gz DAOGNIPTKRWQJW-XMMPIXPASA-N 0 3 371.480 5.192 50 0 FKAAHN COc1ccc(C2=C(CN(C)C)[C@@H](c3ccccc3)c3ccccc3O2)cc1 ZINC000000708911 219314947 /nfs/dbraw/zinc/31/49/47/219314947.db2.gz DAOGNIPTKRWQJW-DEOSSOPVSA-N 0 3 371.480 5.192 50 0 FKAAHN CN1CCC(Oc2ccccc2Sc2ccc(C(F)(F)F)cc2)CC1 ZINC000000717628 210265153 /nfs/dbraw/zinc/26/51/53/210265153.db2.gz MPXWIWCJZHUHQR-UHFFFAOYSA-N 0 3 367.436 5.330 50 0 FKAAHN N[C@H](c1ccc(Cl)cc1Cl)[C@H](N)c1ccc(Cl)cc1Cl ZINC000000732112 219318149 /nfs/dbraw/zinc/31/81/49/219318149.db2.gz UXVDOQZLEYUGHO-ZIAGYGMSSA-N 0 3 350.076 5.000 50 0 FKAAHN N[C@@H](c1ccc(Cl)cc1Cl)[C@@H](N)c1ccc(Cl)cc1Cl ZINC000000732113 570454099 /nfs/dbraw/zinc/45/40/99/570454099.db2.gz UXVDOQZLEYUGHO-KBPBESRZSA-N 0 3 350.076 5.000 50 0 FKAAHN O=C(Nc1sc2c(c1CN1CCCCCC1)CCCC2)c1ccccc1 ZINC000000753455 570454915 /nfs/dbraw/zinc/45/49/15/570454915.db2.gz RLTHLZGRQJJFHO-UHFFFAOYSA-N 0 3 368.546 5.255 50 0 FKAAHN Fc1ccc(C2=CCN(Cc3ccc(-c4ccc(Cl)cc4)o3)CC2)cc1 ZINC000000756600 570455270 /nfs/dbraw/zinc/45/52/70/570455270.db2.gz GGSUBEWMXXHWET-UHFFFAOYSA-N 0 3 367.851 6.028 50 0 FKAAHN CCOc1ccccc1N1CCN(CCC2=C(C)CCCC2(C)C)CC1 ZINC000000756624 132378461 /nfs/dbraw/zinc/37/84/61/132378461.db2.gz OJSIABPYIQAQOS-UHFFFAOYSA-N 0 3 356.554 5.124 50 0 FKAAHN Clc1cccc(N2CCN(C3CCC(c4ccccc4)CC3)CC2)c1 ZINC000000757088 132378422 /nfs/dbraw/zinc/37/84/22/132378422.db2.gz LOHULHGTJRAGCN-UHFFFAOYSA-N 0 3 354.925 5.188 50 0 FKAAHN Clc1ccccc1N1CCN(C2CCC(c3ccccc3)CC2)CC1 ZINC000000757801 132378384 /nfs/dbraw/zinc/37/83/84/132378384.db2.gz XYVIHHVKDIFZAL-UHFFFAOYSA-N 0 3 354.925 5.188 50 0 FKAAHN CN(CCc1ccccn1)Cc1cc(C(C)(C)C)c(O)c(C(C)(C)C)c1 ZINC000000875276 570632313 /nfs/dbraw/zinc/63/23/13/570632313.db2.gz NGXPBIIGDXTUFZ-UHFFFAOYSA-N 0 3 354.538 5.057 50 0 FKAAHN CC1CCN(Cc2c(NC(=O)c3ccccc3)sc3c2CCCC3)CC1 ZINC000000939381 571135002 /nfs/dbraw/zinc/13/50/02/571135002.db2.gz HPXJIKVBEKNVKV-UHFFFAOYSA-N 0 3 368.546 5.111 50 0 FKAAHN Cc1ccc2nc3c(c(Nc4ccc(Br)cc4)c2c1)CCC3 ZINC000000947017 571138238 /nfs/dbraw/zinc/13/82/38/571138238.db2.gz MEMCODPLXZUUOL-UHFFFAOYSA-N 0 3 353.263 5.538 50 0 FKAAHN O=C(Nc1sc2c(c1CN1CCCCC1)CCCC2)c1ccc(F)cc1 ZINC000000948455 570465603 /nfs/dbraw/zinc/46/56/03/570465603.db2.gz YQHCTLBIEIKPSC-UHFFFAOYSA-N 0 3 372.509 5.004 50 0 FKAAHN CCOc1ccc2nc(C)cc(Nc3ccc(Br)cc3)c2c1 ZINC000000949041 570465587 /nfs/dbraw/zinc/46/55/87/570465587.db2.gz MZVSIBXXRHWCLZ-UHFFFAOYSA-N 0 3 357.251 5.448 50 0 FKAAHN CCn1c2ccccc2c2cc(CN[C@@H]3CCCc4ccccc43)ccc21 ZINC000000975552 570467409 /nfs/dbraw/zinc/46/74/09/570467409.db2.gz PUQGENRBXGZWDZ-HSZRJFAPSA-N 0 3 354.497 5.982 50 0 FKAAHN O=C(CC(C(=O)c1cccnc1)c1cccs1)c1ccc(Cl)cc1 ZINC000001043110 570475680 /nfs/dbraw/zinc/47/56/80/570475680.db2.gz REYXUZPEDDIYDH-INIZCTEOSA-N 0 3 355.846 5.036 50 0 FKAAHN O=C(CC(C(=O)c1cccnc1)c1cccs1)c1ccc(Cl)cc1 ZINC000001043111 570475658 /nfs/dbraw/zinc/47/56/58/570475658.db2.gz REYXUZPEDDIYDH-MRXNPFEDSA-N 0 3 355.846 5.036 50 0 FKAAHN CN(Cc1cccc(Oc2ccccc2)c1)Cc1cccc2ccccc21 ZINC000001225338 570495282 /nfs/dbraw/zinc/49/52/82/570495282.db2.gz LDUMPXXQKCCYJL-UHFFFAOYSA-N 0 3 353.465 6.264 50 0 FKAAHN c1ccc(CN[C@H]2CCCc3c4cc(-c5ccccc5)ccc4[nH]c32)cc1 ZINC000001234005 210338031 /nfs/dbraw/zinc/33/80/31/210338031.db2.gz JGESULKOTYJLJR-DEOSSOPVSA-N 0 3 352.481 6.002 50 0 FKAAHN c1ccc(CN[C@@H]2CCCc3c4cc(-c5ccccc5)ccc4[nH]c32)cc1 ZINC000001234006 571210364 /nfs/dbraw/zinc/21/03/64/571210364.db2.gz JGESULKOTYJLJR-XMMPIXPASA-N 0 3 352.481 6.002 50 0 FKAAHN CCN(CC)C(=O)N1c2ccccc2C[C@H](N(CC)CC)c2ccccc21 ZINC000001245579 210338996 /nfs/dbraw/zinc/33/89/96/210338996.db2.gz DUXONKOEFSZBRM-QFIPXVFZSA-N 0 3 365.521 5.226 50 0 FKAAHN CCN(CC)C(=O)N1c2ccccc2C[C@@H](N(CC)CC)c2ccccc21 ZINC000001245580 219393133 /nfs/dbraw/zinc/39/31/33/219393133.db2.gz DUXONKOEFSZBRM-JOCHJYFZSA-N 0 3 365.521 5.226 50 0 FKAAHN CC(C)CCOc1ccc(C(=O)[C@@H](CN2CCCC2)c2ccccc2)cc1 ZINC000001303199 210340734 /nfs/dbraw/zinc/34/07/34/210340734.db2.gz OZMPUUNMCBBTHH-QHCPKHFHSA-N 0 3 365.517 5.174 50 0 FKAAHN CC(C)CCOc1ccc(C(=O)[C@H](CN2CCCC2)c2ccccc2)cc1 ZINC000001303200 219394078 /nfs/dbraw/zinc/39/40/78/219394078.db2.gz OZMPUUNMCBBTHH-HSZRJFAPSA-N 0 3 365.517 5.174 50 0 FKAAHN COc1ccccc1C1=C(CN(C)C)[C@H](c2ccccc2)c2ccccc2O1 ZINC000001405934 203805415 /nfs/dbraw/zinc/80/54/15/203805415.db2.gz MKFBZZSGRVHBMK-XMMPIXPASA-N 0 3 371.480 5.192 50 0 FKAAHN COc1ccccc1C1=C(CN(C)C)[C@@H](c2ccccc2)c2ccccc2O1 ZINC000001405936 571062303 /nfs/dbraw/zinc/06/23/03/571062303.db2.gz MKFBZZSGRVHBMK-DEOSSOPVSA-N 0 3 371.480 5.192 50 0 FKAAHN CCOC1=C(CN2CCCCC2)[C@@H](c2ccc(F)cc2)Oc2ccccc21 ZINC000001408493 571063485 /nfs/dbraw/zinc/06/34/85/571063485.db2.gz ZFAXCMNHJCCKQR-JOCHJYFZSA-N 0 3 367.464 5.193 50 0 FKAAHN CCOC1=C(CN2CCCCC2)[C@H](c2ccc(F)cc2)Oc2ccccc21 ZINC000001408494 571063507 /nfs/dbraw/zinc/06/35/07/571063507.db2.gz ZFAXCMNHJCCKQR-QFIPXVFZSA-N 0 3 367.464 5.193 50 0 FKAAHN Cc1cc(C)c2c(N)c(C3=NC4(CCCC4)Cc4ccccc43)sc2n1 ZINC000001425190 210351815 /nfs/dbraw/zinc/35/18/15/210351815.db2.gz MHSHTIONTBFVJT-UHFFFAOYSA-N 0 3 361.514 5.202 50 0 FKAAHN CC(C)(C)c1cc([C@@H](c2ccccn2)N2CCCC2)cc(C(C)(C)C)c1O ZINC000001463340 571115158 /nfs/dbraw/zinc/11/51/58/571115158.db2.gz HFNOBFOCOZMYKF-NRFANRHFSA-N 0 3 366.549 5.567 50 0 FKAAHN CC(C)(C)c1cc([C@H](c2ccccn2)N2CCCC2)cc(C(C)(C)C)c1O ZINC000001463341 204010141 /nfs/dbraw/zinc/01/01/41/204010141.db2.gz HFNOBFOCOZMYKF-OAQYLSRUSA-N 0 3 366.549 5.567 50 0 FKAAHN CCCN1CCC(N(C(=O)CC)c2ccc3[nH]c(C(C)(C)C)cc3c2)CC1 ZINC000001501475 570501328 /nfs/dbraw/zinc/50/13/28/570501328.db2.gz WCQADWOVIZVRAH-UHFFFAOYSA-N 0 3 369.553 5.083 50 0 FKAAHN CC(C)(C)c1cc2cc(NC3CCN(Cc4ccccc4)CC3)ccc2[nH]1 ZINC000001501477 210356532 /nfs/dbraw/zinc/35/65/32/210356532.db2.gz TVXUWRGZJXASNX-UHFFFAOYSA-N 0 3 361.533 5.542 50 0 FKAAHN CC/C(=C(\c1ccccc1)c1ccc(OCCN(C)C)cc1)c1ccccc1 ZINC000001530689 210358576 /nfs/dbraw/zinc/35/85/76/210358576.db2.gz NKANXQFJJICGDU-QPLCGJKRSA-N 0 3 371.524 5.996 50 0 biogenic,fda FKAAHN CC/C(=C(/c1ccccc1)c1ccc(OCCN(C)C)cc1)c1ccccc1 ZINC000001530690 204012126 /nfs/dbraw/zinc/01/21/26/204012126.db2.gz NKANXQFJJICGDU-OCEACIFDSA-N 0 3 371.524 5.996 50 0 investigational FKAAHN CSc1ccc2c(c1)N(CC[C@@H]1CCCCN1C)c1ccccc1S2 ZINC000001530695 132382105 /nfs/dbraw/zinc/38/21/05/132382105.db2.gz KLBQZWRITKRQQV-INIZCTEOSA-N 0 3 370.587 5.886 50 0 fda FKAAHN CSc1ccc2c(c1)N(CC[C@H]1CCCCN1C)c1ccccc1S2 ZINC000001530697 132382206 /nfs/dbraw/zinc/38/22/06/132382206.db2.gz KLBQZWRITKRQQV-MRXNPFEDSA-N 0 3 370.587 5.886 50 0 fda FKAAHN CCCCSc1ccc([C@H](SCCN(C)C)c2ccccc2)cc1 ZINC000002040210 210377146 /nfs/dbraw/zinc/37/71/46/210377146.db2.gz IZLPZXSZLLELBJ-OAQYLSRUSA-N 0 3 359.604 5.963 50 0 world FKAAHN CCCCSc1ccc([C@@H](SCCN(C)C)c2ccccc2)cc1 ZINC000002040211 210375916 /nfs/dbraw/zinc/37/59/16/210375916.db2.gz IZLPZXSZLLELBJ-NRFANRHFSA-N 0 3 359.604 5.963 50 0 world FKAAHN Cc1c2nc3ccccc3nc2n(N(C)c2ccccc2)c1-c1ccccc1 ZINC000002077874 570513699 /nfs/dbraw/zinc/51/36/99/570513699.db2.gz DAJPYTBZKHTXJC-UHFFFAOYSA-N 0 3 364.452 5.459 50 0 FKAAHN Cc1ccc([C@@H](CCNCc2ccco2)c2ccc(OC(C)C)cc2)cc1 ZINC000002099536 209392956 /nfs/dbraw/zinc/39/29/56/209392956.db2.gz HUBOVUBOIUBELR-XMMPIXPASA-N 0 3 363.501 5.687 50 0 FKAAHN Cc1ccc([C@H](CCNCc2ccco2)c2ccc(OC(C)C)cc2)cc1 ZINC000002099539 209394520 /nfs/dbraw/zinc/39/45/20/209394520.db2.gz HUBOVUBOIUBELR-DEOSSOPVSA-N 0 3 363.501 5.687 50 0 FKAAHN Cn1c2ccccc2c2cc([C@@H]3NCCc4c5ccccc5[nH]c43)ccc21 ZINC000002157365 206152175 /nfs/dbraw/zinc/15/21/75/206152175.db2.gz GUAKGRVMBBQTAZ-QHCPKHFHSA-N 0 3 351.453 5.048 50 0 FKAAHN Cn1c2ccccc2c2cc([C@H]3NCCc4c5ccccc5[nH]c43)ccc21 ZINC000002157368 209393983 /nfs/dbraw/zinc/39/39/83/209393983.db2.gz GUAKGRVMBBQTAZ-HSZRJFAPSA-N 0 3 351.453 5.048 50 0 FKAAHN Clc1ccc([C@H](CCNCc2ccccn2)Cc2ccccc2)cc1 ZINC000002216378 210385478 /nfs/dbraw/zinc/38/54/78/210385478.db2.gz NHZCBGAYEWCYOL-HXUWFJFHSA-N 0 3 350.893 5.241 50 0 FKAAHN Clc1ccc([C@@H](CCNCc2ccccn2)Cc2ccccc2)cc1 ZINC000002216380 210384531 /nfs/dbraw/zinc/38/45/31/210384531.db2.gz NHZCBGAYEWCYOL-FQEVSTJZSA-N 0 3 350.893 5.241 50 0 FKAAHN CC(C)Oc1ccc([C@@H](CCNCc2ccco2)Cc2ccccc2)cc1 ZINC000002249858 570517569 /nfs/dbraw/zinc/51/75/69/570517569.db2.gz OMSFJRRITYQMGV-QFIPXVFZSA-N 0 3 363.501 5.573 50 0 FKAAHN CC(C)Oc1ccc([C@H](CCNCc2ccco2)Cc2ccccc2)cc1 ZINC000002249859 204030008 /nfs/dbraw/zinc/03/00/08/204030008.db2.gz OMSFJRRITYQMGV-JOCHJYFZSA-N 0 3 363.501 5.573 50 0 FKAAHN CCn1c2ccccc2c2cc(CN[C@H]3CCCc4ccccc43)ccc21 ZINC000002466149 570521924 /nfs/dbraw/zinc/52/19/24/570521924.db2.gz PUQGENRBXGZWDZ-QHCPKHFHSA-N 0 3 354.497 5.982 50 0 FKAAHN CN1[C@@H](c2ccccc2)CC(O)(Cc2ccccc2)C[C@@H]1c1ccccc1 ZINC000002472762 571070067 /nfs/dbraw/zinc/07/00/67/571070067.db2.gz AOWOYGJULXOSNG-DNQXCXABSA-N 0 3 357.497 5.168 50 0 FKAAHN CN1[C@H](c2ccccc2)CC(O)(Cc2ccccc2)C[C@H]1c1ccccc1 ZINC000002472766 571070286 /nfs/dbraw/zinc/07/02/86/571070286.db2.gz AOWOYGJULXOSNG-ZEQRLZLVSA-N 0 3 357.497 5.168 50 0 FKAAHN O=C(Nc1ccc(CN2CCCCC2)cc1)c1ccc(-c2ccccc2)cc1 ZINC000002841922 570536234 /nfs/dbraw/zinc/53/62/34/570536234.db2.gz ZQECWBLJDCNVJT-UHFFFAOYSA-N 0 3 370.496 5.592 50 0 FKAAHN COc1cc(CN[C@@H](C)c2ccccc2)ccc1OCc1ccc(F)cc1 ZINC000002846240 570536456 /nfs/dbraw/zinc/53/64/56/570536456.db2.gz FWSSYVLPSPYEJD-KRWDZBQOSA-N 0 3 365.448 5.264 50 0 FKAAHN COc1cc(CN[C@H](C)c2ccccc2)ccc1OCc1ccc(F)cc1 ZINC000002846241 570536478 /nfs/dbraw/zinc/53/64/78/570536478.db2.gz FWSSYVLPSPYEJD-QGZVFWFLSA-N 0 3 365.448 5.264 50 0 FKAAHN Oc1c(C2CCCCC2)cc(CN2CCCCC2)cc1C1CCCCC1 ZINC000002848836 570537019 /nfs/dbraw/zinc/53/70/19/570537019.db2.gz FWLHFVJLMPECPV-UHFFFAOYSA-N 0 3 355.566 6.474 50 0 FKAAHN CCCCOc1ccc(C(=O)Nc2ccc(CN3CCCCC3)cc2)cc1 ZINC000002869553 570768687 /nfs/dbraw/zinc/76/86/87/570768687.db2.gz LCRLIRJUMWZDGS-UHFFFAOYSA-N 0 3 366.505 5.104 50 0 FKAAHN CCCCOc1cccc(C(=O)Nc2ccc(CN3CCCCC3)cc2)c1 ZINC000002875623 570541670 /nfs/dbraw/zinc/54/16/70/570541670.db2.gz CAASBQZSRWMGOZ-UHFFFAOYSA-N 0 3 366.505 5.104 50 0 FKAAHN Clc1ccc(N2CCN(C3CCC(c4ccccc4)CC3)CC2)cc1 ZINC000002894004 132384341 /nfs/dbraw/zinc/38/43/41/132384341.db2.gz CMMFFTWWOBTFMT-UHFFFAOYSA-N 0 3 354.925 5.188 50 0 FKAAHN CC(C)(C)C1CCC(N2CCN(c3cccc(C(F)(F)F)c3)CC2)CC1 ZINC000002894150 132384300 /nfs/dbraw/zinc/38/43/00/132384300.db2.gz VATAZCFYHCMRGJ-UHFFFAOYSA-N 0 3 368.487 5.432 50 0 FKAAHN CC[C@H]1CCCCN1Cc1cc2oc(C)c(-c3ccccc3)c2cc1OC ZINC000002928700 570544559 /nfs/dbraw/zinc/54/45/59/570544559.db2.gz AIVPFDKPVKMYBI-FQEVSTJZSA-N 0 3 363.501 6.181 50 0 FKAAHN CC[C@@H]1CCCCN1Cc1cc2oc(C)c(-c3ccccc3)c2cc1OC ZINC000002928703 570544387 /nfs/dbraw/zinc/54/43/87/570544387.db2.gz AIVPFDKPVKMYBI-HXUWFJFHSA-N 0 3 363.501 6.181 50 0 FKAAHN CC(C)CCN(C(=O)Nc1ccc(Cl)cc1)C1CCN(C(C)C)CC1 ZINC000002933432 571341885 /nfs/dbraw/zinc/34/18/85/571341885.db2.gz OHEHCOPHTUYLMI-UHFFFAOYSA-N 0 3 365.949 5.093 50 0 FKAAHN C[C@H](N[C@H]1CCCc2c3cc(-c4ccccc4)ccc3[nH]c21)c1ccccc1 ZINC000002973806 571343153 /nfs/dbraw/zinc/34/31/53/571343153.db2.gz DNPTZGNAYOZYBV-BVZFJXPGSA-N 0 3 366.508 6.563 50 0 FKAAHN C[C@@H](N[C@H]1CCCc2c3cc(-c4ccccc4)ccc3[nH]c21)c1ccccc1 ZINC000002973807 571343156 /nfs/dbraw/zinc/34/31/56/571343156.db2.gz DNPTZGNAYOZYBV-CJAUYULYSA-N 0 3 366.508 6.563 50 0 FKAAHN C[C@H](N[C@@H]1CCCc2c3cc(-c4ccccc4)ccc3[nH]c21)c1ccccc1 ZINC000002973808 571343174 /nfs/dbraw/zinc/34/31/74/571343174.db2.gz DNPTZGNAYOZYBV-AVRWGWEMSA-N 0 3 366.508 6.563 50 0 FKAAHN C[C@@H](N[C@@H]1CCCc2c3cc(-c4ccccc4)ccc3[nH]c21)c1ccccc1 ZINC000002973809 204072122 /nfs/dbraw/zinc/07/21/22/204072122.db2.gz DNPTZGNAYOZYBV-IQGLISFBSA-N 0 3 366.508 6.563 50 0 FKAAHN Clc1cccc(Cl)c1CSC1=NCCCN1C1CCCCC1 ZINC000003126524 570552274 /nfs/dbraw/zinc/55/22/74/570552274.db2.gz UDTFXJZLIIABCN-UHFFFAOYSA-N 0 3 357.350 5.621 50 0 FKAAHN Cc1c(C)c(C)c(CSC2=NCCCN2C2CCCCC2)c(C)c1C ZINC000003138697 570552504 /nfs/dbraw/zinc/55/25/04/570552504.db2.gz CIXHPUYWHKANQF-UHFFFAOYSA-N 0 3 358.595 5.856 50 0 FKAAHN CCCCN(CCCC)Cc1c(C)c(C)sc1NC(=O)c1ccccc1 ZINC000003142507 570553210 /nfs/dbraw/zinc/55/32/10/570553210.db2.gz ZXDVNQSFRFNBQN-UHFFFAOYSA-N 0 3 372.578 6.019 50 0 FKAAHN CCn1c2ccccc2c2cc(NC(=O)CN(C)C3CCCCC3)ccc21 ZINC000003283522 206160860 /nfs/dbraw/zinc/16/08/60/206160860.db2.gz YCHVNUBEDBEUOD-UHFFFAOYSA-N 0 3 363.505 5.017 50 0 FKAAHN CN(C)[C@@H](CNc1ncnc2sc(-c3ccccc3)cc21)c1ccccc1 ZINC000003292757 571346804 /nfs/dbraw/zinc/34/68/04/571346804.db2.gz MPJJZHSHJRKEOI-IBGZPJMESA-N 0 3 374.513 5.073 50 0 FKAAHN CN(C)[C@H](CNc1ncnc2sc(-c3ccccc3)cc21)c1ccccc1 ZINC000003292759 571346781 /nfs/dbraw/zinc/34/67/81/571346781.db2.gz MPJJZHSHJRKEOI-LJQANCHMSA-N 0 3 374.513 5.073 50 0 FKAAHN C[C@H](N[C@H]1CCCc2ccccc21)C(=O)Nc1ccccc1-c1ccccc1 ZINC000003326042 571180121 /nfs/dbraw/zinc/18/01/21/571180121.db2.gz KMRFHNRVHDYGJO-MBSDFSHPSA-N 0 3 370.496 5.348 50 0 FKAAHN C[C@@H](N[C@H]1CCCc2ccccc21)C(=O)Nc1ccccc1-c1ccccc1 ZINC000003326043 571180190 /nfs/dbraw/zinc/18/01/90/571180190.db2.gz KMRFHNRVHDYGJO-JPYJTQIMSA-N 0 3 370.496 5.348 50 0 FKAAHN C[C@H](N[C@@H]1CCCc2ccccc21)C(=O)Nc1ccccc1-c1ccccc1 ZINC000003326045 571180255 /nfs/dbraw/zinc/18/02/55/571180255.db2.gz KMRFHNRVHDYGJO-FDDCHVKYSA-N 0 3 370.496 5.348 50 0 FKAAHN C[C@@H](N[C@@H]1CCCc2ccccc21)C(=O)Nc1ccccc1-c1ccccc1 ZINC000003326046 571180229 /nfs/dbraw/zinc/18/02/29/571180229.db2.gz KMRFHNRVHDYGJO-WZONZLPQSA-N 0 3 370.496 5.348 50 0 FKAAHN CN(C)[C@@H](CNc1nc(-c2cccs2)nc2ccccc21)c1ccccc1 ZINC000003401463 571182598 /nfs/dbraw/zinc/18/25/98/571182598.db2.gz HAKTWRSIDQACHF-IBGZPJMESA-N 0 3 374.513 5.073 50 0 FKAAHN CN(C)[C@H](CNc1nc(-c2cccs2)nc2ccccc21)c1ccccc1 ZINC000003401466 571349141 /nfs/dbraw/zinc/34/91/41/571349141.db2.gz HAKTWRSIDQACHF-LJQANCHMSA-N 0 3 374.513 5.073 50 0 FKAAHN CC(C)c1ccc(NC(=O)[C@H](c2ccccc2)N2C[C@H](C)C[C@H](C)C2)cc1 ZINC000003614320 204108416 /nfs/dbraw/zinc/10/84/16/204108416.db2.gz GYZUJEAEHADFSP-YYDVJCTNSA-N 0 3 364.533 5.468 50 0 FKAAHN COc1cc(CNCc2ccccc2)cc(Cl)c1OCc1cccs1 ZINC000003672761 571352242 /nfs/dbraw/zinc/35/22/42/571352242.db2.gz XGJGFRLQVMWWQL-UHFFFAOYSA-N 0 3 373.905 5.279 50 0 FKAAHN Brc1ccc2[nH]c3c(c2c1)CCC[C@@H]3NCc1ccccc1 ZINC000003684418 571187356 /nfs/dbraw/zinc/18/73/56/571187356.db2.gz CCOWPQPKDFHXHZ-SFHVURJKSA-N 0 3 355.279 5.098 50 0 FKAAHN Brc1ccc2[nH]c3c(c2c1)CCC[C@H]3NCc1ccccc1 ZINC000003684419 204110338 /nfs/dbraw/zinc/11/03/38/204110338.db2.gz CCOWPQPKDFHXHZ-GOSISDBHSA-N 0 3 355.279 5.098 50 0 FKAAHN O=C([N-]c1ccccc1)c1cc(-c2ccccc2)cc(-c2ccccc2)[s+]1 ZINC000003846800 570568960 /nfs/dbraw/zinc/56/89/60/570568960.db2.gz ZJTXUKQJSOMMOM-UHFFFAOYSA-O 0 3 368.481 6.616 50 0 FKAAHN CCOc1cc2c(cc1OCc1ccccc1)CCN(C)[C@@H]2CC(C)C ZINC000003847342 570568834 /nfs/dbraw/zinc/56/88/34/570568834.db2.gz KQYDZTUSKUWWMV-OAQYLSRUSA-N 0 3 353.506 5.239 50 0 FKAAHN CCOc1cc2c(cc1OCc1ccccc1)CCN(C)[C@H]2CC(C)C ZINC000003847343 570568990 /nfs/dbraw/zinc/56/89/90/570568990.db2.gz KQYDZTUSKUWWMV-NRFANRHFSA-N 0 3 353.506 5.239 50 0 FKAAHN C[C@@H]1[C@H](c2ccccc2)N[C@H](c2ccccc2)C[C@]1(O)c1ccc(F)cc1 ZINC000004031305 571068089 /nfs/dbraw/zinc/06/80/89/571068089.db2.gz KVYUHOPVUTYJPS-TXCSNJEZSA-N 0 3 361.460 5.125 50 0 FKAAHN O[C@]12CCCC[C@H]1[C@@H](c1cccc(Oc3ccc(Cl)cc3)c1)NCC2 ZINC000004031333 571071927 /nfs/dbraw/zinc/07/19/27/571071927.db2.gz VTIHRPRDWGOLPD-HBMCJLEFSA-N 0 3 357.881 5.088 50 0 FKAAHN O[C@]12CCCC[C@H]1[C@H](c1cccc(Oc3ccc(Cl)cc3)c1)NCC2 ZINC000004031334 571071899 /nfs/dbraw/zinc/07/18/99/571071899.db2.gz VTIHRPRDWGOLPD-ACRUOGEOSA-N 0 3 357.881 5.088 50 0 FKAAHN O[C@]12CCCC[C@@H]1[C@@H](c1cccc(Oc3ccc(Cl)cc3)c1)NCC2 ZINC000004031335 571071862 /nfs/dbraw/zinc/07/18/62/571071862.db2.gz VTIHRPRDWGOLPD-NJYVYQBISA-N 0 3 357.881 5.088 50 0 FKAAHN O[C@]12CCCC[C@@H]1[C@H](c1cccc(Oc3ccc(Cl)cc3)c1)NCC2 ZINC000004031336 571071989 /nfs/dbraw/zinc/07/19/89/571071989.db2.gz VTIHRPRDWGOLPD-HKBOAZHASA-N 0 3 357.881 5.088 50 0 FKAAHN FC(F)(F)c1cccc(OCCN2CCC3=C(CCc4ccccc43)C2)c1 ZINC000004090713 571355165 /nfs/dbraw/zinc/35/51/65/571355165.db2.gz MAJTZRJHULSWDK-UHFFFAOYSA-N 0 3 373.418 5.190 50 0 FKAAHN COc1ccc(-c2nc3c4ccccc4ccn3c2CN2CCCCC2)cc1 ZINC000004115730 204121685 /nfs/dbraw/zinc/12/16/85/204121685.db2.gz FOEXGSDATTUMME-UHFFFAOYSA-N 0 3 371.484 5.149 50 0 FKAAHN Cc1cc(Nc2ccc(Br)cc2)c2c(N)cc(C)c(C)c2n1 ZINC000004115922 206169460 /nfs/dbraw/zinc/16/94/60/206169460.db2.gz JWRNRZGHYNBPNS-UHFFFAOYSA-N 0 3 356.267 5.248 50 0 FKAAHN CCCCOC(=O)c1ccc(Nc2cc(C)nc3ccc(OC)cc32)cc1 ZINC000004117183 206168971 /nfs/dbraw/zinc/16/89/71/206168971.db2.gz YHXCXRGIXGMGEO-UHFFFAOYSA-N 0 3 364.445 5.252 50 0 FKAAHN Clc1ccc2c(c1)[C@@H](O[C@H]1CN3CCC1CC3)c1ccccc1CS2 ZINC000004146718 570578546 /nfs/dbraw/zinc/57/85/46/570578546.db2.gz BMQGWQJMFCYXPU-FPOVZHCZSA-N 0 3 371.933 5.146 50 0 FKAAHN CCC[C@@H]1[C@H](c2ccccc2)N[C@H](c2ccccc2)[C@H](C)[C@]1(O)CCC ZINC000004171224 207004484 /nfs/dbraw/zinc/00/44/84/207004484.db2.gz UCLGIKKXOIONJU-PIAWWSJMSA-N 0 3 351.534 5.656 50 0 FKAAHN CC(C)[C@@H]1C[C@@](CCNCc2ccccc2F)(c2ccccc2)CCO1 ZINC000004181369 204126584 /nfs/dbraw/zinc/12/65/84/204126584.db2.gz MSNDYHDGMIZQPJ-GOTSBHOMSA-N 0 3 355.497 5.078 50 0 FKAAHN CC(C)[C@H]1C[C@@](CCNCc2ccccc2F)(c2ccccc2)CCO1 ZINC000004181371 204126541 /nfs/dbraw/zinc/12/65/41/204126541.db2.gz MSNDYHDGMIZQPJ-PKTZIBPZSA-N 0 3 355.497 5.078 50 0 FKAAHN CC(C)[C@@H]1C[C@](CCNCc2ccccc2F)(c2ccccc2)CCO1 ZINC000004181374 570580522 /nfs/dbraw/zinc/58/05/22/570580522.db2.gz MSNDYHDGMIZQPJ-XZOQPEGZSA-N 0 3 355.497 5.078 50 0 FKAAHN CC(C)[C@H]1C[C@](CCNCc2ccccc2F)(c2ccccc2)CCO1 ZINC000004181375 204125705 /nfs/dbraw/zinc/12/57/05/204125705.db2.gz MSNDYHDGMIZQPJ-DHIUTWEWSA-N 0 3 355.497 5.078 50 0 FKAAHN O=C(CNC1CCCCC1)N1c2ccccc2Sc2ccc(Cl)cc21 ZINC000004256160 571357245 /nfs/dbraw/zinc/35/72/45/571357245.db2.gz KCFILLADMODZDQ-UHFFFAOYSA-N 0 3 372.921 5.392 50 0 FKAAHN CCCC[C@]1(O)[C@H](C)[C@H](c2ccccc2)N[C@H](c2ccccc2)[C@@H]1CCC ZINC000004289951 570583499 /nfs/dbraw/zinc/58/34/99/570583499.db2.gz POFXFTVXJUYYRI-AQENTZESSA-N 0 3 365.561 6.046 50 0 FKAAHN CCCC[C@@]1(O)[C@H](C)[C@H](c2ccccc2)N[C@H](c2ccccc2)[C@@H]1CCC ZINC000004289952 570583422 /nfs/dbraw/zinc/58/34/22/570583422.db2.gz POFXFTVXJUYYRI-BHEUDDMMSA-N 0 3 365.561 6.046 50 0 FKAAHN CCCC[C@]1(O)[C@@H](C)[C@H](c2ccccc2)N[C@H](c2ccccc2)[C@@H]1CCC ZINC000004289953 207011414 /nfs/dbraw/zinc/01/14/14/207011414.db2.gz POFXFTVXJUYYRI-SXGYVVAPSA-N 0 3 365.561 6.046 50 0 FKAAHN CCCC[C@@]1(O)[C@@H](C)[C@H](c2ccccc2)N[C@H](c2ccccc2)[C@@H]1CCC ZINC000004289954 207011320 /nfs/dbraw/zinc/01/13/20/207011320.db2.gz POFXFTVXJUYYRI-GFKHSOBKSA-N 0 3 365.561 6.046 50 0 FKAAHN CC1(C)[C@H]2CC[C@](C)(C2)[C@@H]1NCC(=O)N(c1ccccc1)C1CCCCC1 ZINC000004321667 570584757 /nfs/dbraw/zinc/58/47/57/570584757.db2.gz UESVZIGYWSMKFB-KUWBRRTOSA-N 0 3 368.565 5.157 50 0 FKAAHN CCCCCC[C@]1(O)C[C@H](c2ccccc2)N[C@H](c2ccccc2)[C@@H]1CC ZINC000004322915 204132989 /nfs/dbraw/zinc/13/29/89/204132989.db2.gz MPYSXPHSCSBUPX-LIONHTAISA-N 0 3 365.561 6.190 50 0 FKAAHN CCCCCC[C@@]1(O)C[C@H](c2ccccc2)N[C@H](c2ccccc2)[C@@H]1CC ZINC000004322916 204132347 /nfs/dbraw/zinc/13/23/47/204132347.db2.gz MPYSXPHSCSBUPX-ZYQDXHPFSA-N 0 3 365.561 6.190 50 0 FKAAHN CCCCCC[C@]1(O)C[C@@H](c2ccccc2)N[C@H](c2ccccc2)[C@@H]1CC ZINC000004322917 207014217 /nfs/dbraw/zinc/01/42/17/207014217.db2.gz MPYSXPHSCSBUPX-JBXUNAHCSA-N 0 3 365.561 6.190 50 0 FKAAHN CCCCCC[C@@]1(O)C[C@@H](c2ccccc2)N[C@H](c2ccccc2)[C@@H]1CC ZINC000004322918 570585183 /nfs/dbraw/zinc/58/51/83/570585183.db2.gz MPYSXPHSCSBUPX-CXSMSNRLSA-N 0 3 365.561 6.190 50 0 FKAAHN COc1ccccc1C1CCN(Cc2ccc3c(c2)CCC(C)(C)O3)CC1 ZINC000004325154 570585171 /nfs/dbraw/zinc/58/51/71/570585171.db2.gz JNFNPCBQSKYGER-UHFFFAOYSA-N 0 3 365.517 5.178 50 0 FKAAHN COc1cc2c(cc1OC)[C@H](C)N(Cc1sc3ccccc3c1C)CC2 ZINC000004333142 570585259 /nfs/dbraw/zinc/58/52/59/570585259.db2.gz UTGGCACUEFXACL-HNNXBMFYSA-N 0 3 367.514 5.346 50 0 FKAAHN COc1cc2c(cc1OC)[C@@H](C)N(Cc1sc3ccccc3c1C)CC2 ZINC000004333144 207014444 /nfs/dbraw/zinc/01/44/44/207014444.db2.gz UTGGCACUEFXACL-OAHLLOKOSA-N 0 3 367.514 5.346 50 0 FKAAHN Cc1c2ccccc2sc1CN1CCC(C(=O)c2ccc(F)cc2)CC1 ZINC000004333152 204134716 /nfs/dbraw/zinc/13/47/16/204134716.db2.gz GQEPOVJLDVWXFK-UHFFFAOYSA-N 0 3 367.489 5.444 50 0 FKAAHN Cc1sc(NC(=O)c2ccccc2F)c(CN2CCCC[C@@H]2C)c1C ZINC000004539797 204145779 /nfs/dbraw/zinc/14/57/79/204145779.db2.gz NGHZYYOSKFCOBC-ZDUSSCGKSA-N 0 3 360.498 5.131 50 0 FKAAHN Cc1sc(NC(=O)c2ccccc2F)c(CN2CCCC[C@H]2C)c1C ZINC000004539799 207026285 /nfs/dbraw/zinc/02/62/85/207026285.db2.gz NGHZYYOSKFCOBC-CYBMUJFWSA-N 0 3 360.498 5.131 50 0 FKAAHN O=C(CSc1ccc(Cl)cc1)Nc1ccc(CN2CCCCC2)cc1 ZINC000004554767 570774094 /nfs/dbraw/zinc/77/40/94/570774094.db2.gz IBRFACOOKALCEO-UHFFFAOYSA-N 0 3 374.937 5.057 50 0 FKAAHN CC(C)c1ccc(/C=C/C(=O)Nc2ccc(CN3CCCCC3)cc2)cc1 ZINC000004554769 570833595 /nfs/dbraw/zinc/83/35/95/570833595.db2.gz DGDCFEHGLXXBTJ-XNTDXEJSSA-N 0 3 362.517 5.448 50 0 FKAAHN C[C@@H]1[C@H](c2ccccc2)N[C@H](c2ccccc2)C[C@]1(O)Cc1ccccc1 ZINC000004555389 204147398 /nfs/dbraw/zinc/14/73/98/204147398.db2.gz NDHOPVCXDQDCPC-HEGQMBHGSA-N 0 3 357.497 5.072 50 0 FKAAHN CC(C)c1ccc(NC(=O)[C@H](c2ccccc2)N2C[C@H](C)C[C@@H](C)C2)cc1 ZINC000004564906 570836523 /nfs/dbraw/zinc/83/65/23/570836523.db2.gz GYZUJEAEHADFSP-PWHSHALESA-N 0 3 364.533 5.468 50 0 FKAAHN c1ccc2c(c1)ccc1c2-c2c(ccc3ccccc32)OCCNCCO1 ZINC000004566136 207029570 /nfs/dbraw/zinc/02/95/70/207029570.db2.gz SHEFQLIYUKYQGW-UHFFFAOYSA-N 0 3 355.437 5.021 50 0 FKAAHN CC[C@@H]1[C@H](c2ccccc2)N[C@H](c2ccccc2)C[C@]1(O)Cc1ccccc1 ZINC000004612817 207032965 /nfs/dbraw/zinc/03/29/65/207032965.db2.gz KIXGFZRPUASEFM-KEVKATSASA-N 0 3 371.524 5.462 50 0 FKAAHN CC[C@H]1[C@H](c2ccccc2)N[C@H](c2ccccc2)C[C@]1(O)Cc1ccccc1 ZINC000004612818 210546221 /nfs/dbraw/zinc/54/62/21/210546221.db2.gz KIXGFZRPUASEFM-ASDGIDEWSA-N 0 3 371.524 5.462 50 0 FKAAHN CC[C@@H]1[C@@H](c2ccccc2)N[C@H](c2ccccc2)C[C@]1(O)Cc1ccccc1 ZINC000004612820 263335285 /nfs/dbraw/zinc/33/52/85/263335285.db2.gz KIXGFZRPUASEFM-XDZVQPMWSA-N 0 3 371.524 5.462 50 0 FKAAHN CC[C@H]1[C@@H](c2ccccc2)N[C@H](c2ccccc2)C[C@]1(O)Cc1ccccc1 ZINC000004612821 263335287 /nfs/dbraw/zinc/33/52/87/263335287.db2.gz KIXGFZRPUASEFM-QEGGNFSNSA-N 0 3 371.524 5.462 50 0 FKAAHN C[C@@H](CN1CCCCC1)OC(=O)c1cc(C(C)(C)C)cc(C(C)(C)C)c1 ZINC000004664827 570599203 /nfs/dbraw/zinc/59/92/03/570599203.db2.gz BFOXFBPASZZZAD-KRWDZBQOSA-N 0 3 359.554 5.313 50 0 FKAAHN C[C@H](CN1CCCCC1)OC(=O)c1cc(C(C)(C)C)cc(C(C)(C)C)c1 ZINC000004664828 570599306 /nfs/dbraw/zinc/59/93/06/570599306.db2.gz BFOXFBPASZZZAD-QGZVFWFLSA-N 0 3 359.554 5.313 50 0 FKAAHN c1ccc(COc2cccc(CN3CCC(Cc4ccccc4)CC3)c2)cc1 ZINC000004680675 207038007 /nfs/dbraw/zinc/03/80/07/207038007.db2.gz ZLGHCYBECWIMIE-UHFFFAOYSA-N 0 3 371.524 5.720 50 0 FKAAHN C(=C/c1ccccc1)\CN(C/C=C/c1ccccc1)CCc1ccccc1 ZINC000004699201 571163535 /nfs/dbraw/zinc/16/35/35/571163535.db2.gz DUOSCNPXDRFGLW-XOBNHNQQSA-N 0 3 353.509 5.958 50 0 FKAAHN CCCCOCCCN(C/C=C/c1ccccc1)C/C=C/c1ccccc1 ZINC000004699223 571163840 /nfs/dbraw/zinc/16/38/40/571163840.db2.gz IDQUKJSMJVRASN-ODPUSEOTSA-N 0 3 363.545 5.922 50 0 FKAAHN Cc1ccc(CN([C@@H]2CCCc3ccccc32)[C@@H]2CCCc3ccccc32)o1 ZINC000004699254 204156261 /nfs/dbraw/zinc/15/62/61/204156261.db2.gz VPUJLPIELIOCGW-CLJLJLNGSA-N 0 3 371.524 6.545 50 0 FKAAHN Cc1ccc(CN([C@@H]2CCCc3ccccc32)[C@H]2CCCc3ccccc32)o1 ZINC000004699255 219598671 /nfs/dbraw/zinc/59/86/71/219598671.db2.gz VPUJLPIELIOCGW-WMPKNSHKSA-N 0 3 371.524 6.545 50 0 FKAAHN Cc1ccc(CN([C@H]2CCCc3ccccc32)[C@H]2CCCc3ccccc32)o1 ZINC000004699257 571163815 /nfs/dbraw/zinc/16/38/15/571163815.db2.gz VPUJLPIELIOCGW-UIOOFZCWSA-N 0 3 371.524 6.545 50 0 FKAAHN Cc1ccc(-c2noc(CNC3CCCCCCCCCCC3)n2)cc1 ZINC000004723554 571168702 /nfs/dbraw/zinc/16/87/02/571168702.db2.gz MOLGLDFFOROMSC-UHFFFAOYSA-N 0 3 355.526 5.808 50 0 FKAAHN COc1cc2ccccc2cc1C(=O)Nc1ccc(CN2CCCCC2)cc1 ZINC000004724001 204159426 /nfs/dbraw/zinc/15/94/26/204159426.db2.gz YEDUZQUXRTYECW-UHFFFAOYSA-N 0 3 374.484 5.087 50 0 FKAAHN O=C(Nc1sc2c(c1CN1CCCCCC1)CCC2)c1ccc(F)cc1 ZINC000004748609 204162064 /nfs/dbraw/zinc/16/20/64/204162064.db2.gz CZJUEGOSCVQZLS-UHFFFAOYSA-N 0 3 372.509 5.004 50 0 FKAAHN Cc1sc(NC(=O)c2ccc(F)cc2)c(CN2CCCC[C@@H]2C)c1C ZINC000004748619 571231191 /nfs/dbraw/zinc/23/11/91/571231191.db2.gz PHZVZDISHXLFIK-ZDUSSCGKSA-N 0 3 360.498 5.131 50 0 FKAAHN Cc1sc(NC(=O)c2ccc(F)cc2)c(CN2CCCC[C@H]2C)c1C ZINC000004748621 207045120 /nfs/dbraw/zinc/04/51/20/207045120.db2.gz PHZVZDISHXLFIK-CYBMUJFWSA-N 0 3 360.498 5.131 50 0 FKAAHN CCc1ccc(CN2CCC(Nc3ccc(Br)cc3)CC2)cc1 ZINC000004749423 219604266 /nfs/dbraw/zinc/60/42/66/219604266.db2.gz IXQLPKOHIPKSRH-UHFFFAOYSA-N 0 3 373.338 5.088 50 0 FKAAHN Cc1cccc(CN(CCC(C)C)Cc2cccn2Cc2cccc(C)c2)c1 ZINC000004753056 571231452 /nfs/dbraw/zinc/23/14/52/571231452.db2.gz QWJDZRSEGPLKCG-UHFFFAOYSA-N 0 3 374.572 6.202 50 0 FKAAHN Cc1cccc(Cn2cccc2CN(Cc2ccc(F)cc2)CC(C)C)c1 ZINC000004761653 571232342 /nfs/dbraw/zinc/23/23/42/571232342.db2.gz RUUFJQRTTPMGQM-UHFFFAOYSA-N 0 3 364.508 5.642 50 0 FKAAHN Cc1ccccc1CN(Cc1cccn1Cc1ccccc1F)CC(C)C ZINC000004781123 571235364 /nfs/dbraw/zinc/23/53/64/571235364.db2.gz COMCAEUGUFWXDP-UHFFFAOYSA-N 0 3 364.508 5.642 50 0 FKAAHN CCC(=O)c1ccccc1OCCCN1CCC(Cc2ccccc2)CC1 ZINC000004832475 570609039 /nfs/dbraw/zinc/60/90/39/570609039.db2.gz MCLUGZKPXGFEFR-UHFFFAOYSA-N 0 3 365.517 5.003 50 0 FKAAHN CC[C@]1(C)C[C@@](CCNCc2ccccc2F)(c2ccccc2)CCO1 ZINC000004897670 206183071 /nfs/dbraw/zinc/18/30/71/206183071.db2.gz QDDFACYMTXCMLZ-PKTZIBPZSA-N 0 3 355.497 5.223 50 0 FKAAHN CC[C@@]1(C)C[C@@](CCNCc2ccccc2F)(c2ccccc2)CCO1 ZINC000004897672 570556021 /nfs/dbraw/zinc/55/60/21/570556021.db2.gz QDDFACYMTXCMLZ-GOTSBHOMSA-N 0 3 355.497 5.223 50 0 FKAAHN CC[C@]1(C)C[C@](CCNCc2ccccc2F)(c2ccccc2)CCO1 ZINC000004897674 570877491 /nfs/dbraw/zinc/87/74/91/570877491.db2.gz QDDFACYMTXCMLZ-DHIUTWEWSA-N 0 3 355.497 5.223 50 0 FKAAHN CC[C@@]1(C)C[C@](CCNCc2ccccc2F)(c2ccccc2)CCO1 ZINC000004897676 206182869 /nfs/dbraw/zinc/18/28/69/206182869.db2.gz QDDFACYMTXCMLZ-XZOQPEGZSA-N 0 3 355.497 5.223 50 0 FKAAHN Cc1cccc(Cn2cccc2CN(CCC(C)C)Cc2ccccc2)c1 ZINC000004920439 204177309 /nfs/dbraw/zinc/17/73/09/204177309.db2.gz CJHCKPCSWZVYSD-UHFFFAOYSA-N 0 3 360.545 5.893 50 0 FKAAHN c1ccc(Oc2ccc(Nc3c4ccccc4nc4c3CCCC4)cc2)cc1 ZINC000004922271 204177111 /nfs/dbraw/zinc/17/71/11/204177111.db2.gz PECUWGIORXYLMB-UHFFFAOYSA-N 0 3 366.464 6.650 50 0 FKAAHN COc1cc(OC)c(Nc2c3ccccc3nc3c2CCCC3)cc1Cl ZINC000004922296 570561273 /nfs/dbraw/zinc/56/12/73/570561273.db2.gz HXEPAAQYGRLXNN-UHFFFAOYSA-N 0 3 368.864 5.528 50 0 FKAAHN COc1cc(Cl)c(C)cc1Nc1c2ccccc2nc2c1CCCC2 ZINC000004922358 570561115 /nfs/dbraw/zinc/56/11/15/570561115.db2.gz XMZNYPKJXRALEG-UHFFFAOYSA-N 0 3 352.865 5.828 50 0 FKAAHN Cc1ccc(Nc2c3c(nc4ccccc42)CCC3)c(Br)c1 ZINC000004923550 204177477 /nfs/dbraw/zinc/17/74/77/204177477.db2.gz GEXLGYIMEGEDST-UHFFFAOYSA-N 0 3 353.263 5.538 50 0 FKAAHN COc1cc(OC)c(Nc2c3c(nc4ccccc42)CCC3)cc1Cl ZINC000004923583 210581228 /nfs/dbraw/zinc/58/12/28/210581228.db2.gz NEYARGDVHHYALM-UHFFFAOYSA-N 0 3 354.837 5.138 50 0 FKAAHN Cc1ccc(C)c(N2CCN(Cc3ccc4c(c3)Cc3ccccc3-4)CC2)c1 ZINC000004980249 570615814 /nfs/dbraw/zinc/61/58/14/570615814.db2.gz XQPLNMFRMMGWOY-UHFFFAOYSA-N 0 3 368.524 5.197 50 0 FKAAHN C[C@@H](CCN1CCN(c2cccc(C(F)(F)F)c2)CC1)c1ccccc1 ZINC000004981057 570615622 /nfs/dbraw/zinc/61/56/22/570615622.db2.gz BIHXXJVQMPEIFJ-KRWDZBQOSA-N 0 3 362.439 5.021 50 0 FKAAHN C[C@H](CCN1CCN(c2cccc(C(F)(F)F)c2)CC1)c1ccccc1 ZINC000004981058 570615585 /nfs/dbraw/zinc/61/55/85/570615585.db2.gz BIHXXJVQMPEIFJ-QGZVFWFLSA-N 0 3 362.439 5.021 50 0 FKAAHN CCn1c2ccccc2c2cc(CNCc3cc(OC)cc(OC)c3)ccc21 ZINC000004982103 571072931 /nfs/dbraw/zinc/07/29/31/571072931.db2.gz FKZDJYMHNCLRGU-UHFFFAOYSA-N 0 3 374.484 5.121 50 0 FKAAHN CCn1c2ccccc2c2cc(CN3CCCC[C@@H]3c3cccnc3)ccc21 ZINC000004982698 570616214 /nfs/dbraw/zinc/61/62/14/570616214.db2.gz ZIXKZAMEUTXGFP-HSZRJFAPSA-N 0 3 369.512 5.937 50 0 FKAAHN CCn1c2ccccc2c2cc(CN3CCCC[C@H]3c3cccnc3)ccc21 ZINC000004982699 207068572 /nfs/dbraw/zinc/06/85/72/207068572.db2.gz ZIXKZAMEUTXGFP-QHCPKHFHSA-N 0 3 369.512 5.937 50 0 FKAAHN C1=CC2(CCN(Cc3cccc(Oc4ccccc4)c3)CC2)c2ccccc21 ZINC000004983957 207069096 /nfs/dbraw/zinc/06/90/96/207069096.db2.gz SOGHUBCYQWVMQT-UHFFFAOYSA-N 0 3 367.492 6.040 50 0 FKAAHN Fc1ccc(C2=CCN(Cc3ccc(OCc4ccccc4)cc3)CC2)cc1 ZINC000004986838 204183330 /nfs/dbraw/zinc/18/33/30/204183330.db2.gz NCWRPGBOMNCZDI-UHFFFAOYSA-N 0 3 373.471 5.694 50 0 FKAAHN c1ccc(COc2ccc(CN3CCC(Cc4ccccc4)CC3)cc2)cc1 ZINC000004987737 570616714 /nfs/dbraw/zinc/61/67/14/570616714.db2.gz LXMSALWOSZBQJQ-UHFFFAOYSA-N 0 3 371.524 5.720 50 0 FKAAHN CCN(Cc1ccccc1)Cc1ccc(OCc2ccccc2)c(OC)c1 ZINC000004988799 570616652 /nfs/dbraw/zinc/61/66/52/570616652.db2.gz CKYDWULQIWQBCW-UHFFFAOYSA-N 0 3 361.485 5.296 50 0 FKAAHN O=C(Nc1ccc(CN2CCCCC2)cc1)c1cccc(Cl)c1Cl ZINC000004993567 204183008 /nfs/dbraw/zinc/18/30/08/204183008.db2.gz NPEHNVZQFWCCLE-UHFFFAOYSA-N 0 3 363.288 5.232 50 0 FKAAHN Cc1ccc([C@@](O)(c2ccccc2)c2ccccc2[C@@H](C)N(C)C)c(C)c1 ZINC000005008622 207070447 /nfs/dbraw/zinc/07/04/47/207070447.db2.gz CBZLKJDOSMRWOF-NLFFAJNJSA-N 0 3 359.513 5.210 50 0 FKAAHN Cc1ccc([C@](O)(c2ccccc2)c2ccccc2[C@@H](C)N(C)C)c(C)c1 ZINC000005008623 207070752 /nfs/dbraw/zinc/07/07/52/207070752.db2.gz CBZLKJDOSMRWOF-CJFMBICVSA-N 0 3 359.513 5.210 50 0 FKAAHN Clc1cccc(-c2nn(-c3ccccc3)cc2CNCc2ccccc2)c1 ZINC000005013987 204185294 /nfs/dbraw/zinc/18/52/94/204185294.db2.gz KKBQIMGHKUMATP-UHFFFAOYSA-N 0 3 373.887 5.483 50 0 FKAAHN COc1cc(CNCc2cccs2)ccc1OCc1ccc(Cl)cc1 ZINC000005019712 570618325 /nfs/dbraw/zinc/61/83/25/570618325.db2.gz GVUDVRZUCUYKRA-UHFFFAOYSA-N 0 3 373.905 5.279 50 0 FKAAHN CCOc1cc(CNCc2cccs2)ccc1OCc1ccccc1 ZINC000005019728 570618364 /nfs/dbraw/zinc/61/83/64/570618364.db2.gz YUUQLTPJDQMEND-UHFFFAOYSA-N 0 3 353.487 5.016 50 0 FKAAHN COc1cc(CNCc2cccs2)cc(Cl)c1OCc1ccccc1 ZINC000005019730 207072219 /nfs/dbraw/zinc/07/22/19/207072219.db2.gz DYWJDPDNJIOLKB-UHFFFAOYSA-N 0 3 373.905 5.279 50 0 FKAAHN COc1cc(CNCc2cccs2)ccc1OCc1cccc(Cl)c1 ZINC000005019841 207072953 /nfs/dbraw/zinc/07/29/53/207072953.db2.gz YXZPUNVUPNERPS-UHFFFAOYSA-N 0 3 373.905 5.279 50 0 FKAAHN Cc1ccc(C(C)(C)C[C@H](C)N2CCN(c3cc(C)ccc3C)CC2)o1 ZINC000005032017 570618807 /nfs/dbraw/zinc/61/88/07/570618807.db2.gz BPLNQIPINUWSMA-IBGZPJMESA-N 0 3 354.538 5.083 50 0 FKAAHN Cc1ccc(C(C)(C)C[C@@H](C)N2CCN(c3cc(C)ccc3C)CC2)o1 ZINC000005032021 570618759 /nfs/dbraw/zinc/61/87/59/570618759.db2.gz BPLNQIPINUWSMA-LJQANCHMSA-N 0 3 354.538 5.083 50 0 FKAAHN Cc1ccc2c(c1)c1c3n2CCCN(Cc2ccc(C)cc2C)[C@H]3CCC1 ZINC000005032530 570618763 /nfs/dbraw/zinc/61/87/63/570618763.db2.gz SXVAMKQKXMIZMG-DEOSSOPVSA-N 0 3 358.529 5.850 50 0 FKAAHN Cc1ccc2c(c1)c1c3n2CCCN(Cc2ccc(C)cc2C)[C@@H]3CCC1 ZINC000005032534 570618839 /nfs/dbraw/zinc/61/88/39/570618839.db2.gz SXVAMKQKXMIZMG-XMMPIXPASA-N 0 3 358.529 5.850 50 0 FKAAHN CN(C)CCCn1c(-c2ccc(Cl)cc2)cs/c1=N\c1ccccc1 ZINC000005123994 204193432 /nfs/dbraw/zinc/19/34/32/204193432.db2.gz KUGBMOYLIHPSFR-XDOYNYLZSA-N 0 3 371.937 5.054 50 0 FKAAHN O[C@]12CCCC[C@@H]1[C@H](c1ccc(F)cc1)N(C/C=C/c1ccccc1)CC2 ZINC000005192308 570631458 /nfs/dbraw/zinc/63/14/58/570631458.db2.gz WJIDANGHKXCJLA-HJZWWJMASA-N 0 3 365.492 5.207 50 0 FKAAHN COc1cc2c(cc1OC)CN(Cc1c(C)cc(C(C)(C)C)cc1C)CC2 ZINC000005321763 570648691 /nfs/dbraw/zinc/64/86/91/570648691.db2.gz ZPSQMRZEXBTBFY-UHFFFAOYSA-N 0 3 367.533 5.176 50 0 FKAAHN CC(C)Oc1ccc([C@@H](CCNCc2ccco2)c2ccc(F)cc2)cc1 ZINC000005477661 219682509 /nfs/dbraw/zinc/68/25/09/219682509.db2.gz LCVKZCNJUUSFRD-QHCPKHFHSA-N 0 3 367.464 5.518 50 0 FKAAHN CC(C)Oc1ccc([C@H](CCNCc2ccco2)c2ccc(F)cc2)cc1 ZINC000005477662 206195644 /nfs/dbraw/zinc/19/56/44/206195644.db2.gz LCVKZCNJUUSFRD-HSZRJFAPSA-N 0 3 367.464 5.518 50 0 FKAAHN COc1ccc([C@@H](CCNCc2ccccc2F)c2ccc(F)cc2)cc1 ZINC000005477770 219682775 /nfs/dbraw/zinc/68/27/75/219682775.db2.gz KQVIYHJSXGPHKZ-QFIPXVFZSA-N 0 3 367.439 5.285 50 0 FKAAHN COc1ccc([C@H](CCNCc2ccccc2F)c2ccc(F)cc2)cc1 ZINC000005477771 570661577 /nfs/dbraw/zinc/66/15/77/570661577.db2.gz KQVIYHJSXGPHKZ-JOCHJYFZSA-N 0 3 367.439 5.285 50 0 FKAAHN CC1(C)C[C@@](CCNCc2ccco2)(Cc2ccccc2Cl)CCO1 ZINC000005478527 570628231 /nfs/dbraw/zinc/62/82/31/570628231.db2.gz ZBENECJIVXXBGM-OAQYLSRUSA-N 0 3 361.913 5.231 50 0 FKAAHN CC1(C)C[C@](CCNCc2ccco2)(Cc2ccccc2Cl)CCO1 ZINC000005478528 570628289 /nfs/dbraw/zinc/62/82/89/570628289.db2.gz ZBENECJIVXXBGM-NRFANRHFSA-N 0 3 361.913 5.231 50 0 FKAAHN CC(C)(C)c1cc([C@@H](c2ccncc2)N2CCCC2)cc(C(C)(C)C)c1O ZINC000005481514 207101712 /nfs/dbraw/zinc/10/17/12/207101712.db2.gz XPKQZVBYMQCQSB-OAQYLSRUSA-N 0 3 366.549 5.567 50 0 FKAAHN CC(C)(C)c1cc([C@H](c2ccncc2)N2CCCC2)cc(C(C)(C)C)c1O ZINC000005481516 570662483 /nfs/dbraw/zinc/66/24/83/570662483.db2.gz XPKQZVBYMQCQSB-NRFANRHFSA-N 0 3 366.549 5.567 50 0 FKAAHN CN(C)CCNP1(=O)C=C(c2ccccc2)SC(c2ccccc2)=C1 ZINC000005523621 570666725 /nfs/dbraw/zinc/66/67/25/570666725.db2.gz CGVWBBIXLVWOKZ-UHFFFAOYSA-N 0 3 370.458 5.160 50 0 FKAAHN Cc1ccc2nc(C)cc(Nc3ccc(I)cc3)c2c1 ZINC000005593300 570679393 /nfs/dbraw/zinc/67/93/93/570679393.db2.gz KDLSKZHSYJGDRO-UHFFFAOYSA-N 0 3 374.225 5.200 50 0 FKAAHN CCCOC(=O)c1ccc(Nc2cc(C)nc3ccc(OCC)cc32)cc1 ZINC000005808124 570969327 /nfs/dbraw/zinc/96/93/27/570969327.db2.gz LFEPKSSSBCUGCX-UHFFFAOYSA-N 0 3 364.445 5.252 50 0 FKAAHN Cc1cc(C)c2nc(C)cc(Nc3ccc(OCc4ccccc4)cc3)c2c1 ZINC000005811819 570636693 /nfs/dbraw/zinc/63/66/93/570636693.db2.gz BJTAFVSHOQKRBZ-UHFFFAOYSA-N 0 3 368.480 6.483 50 0 FKAAHN CC(C)c1ccc(/C=C2\CNC/C(=C\c3ccc(C(C)C)cc3)C2O)cc1 ZINC000005911550 204229759 /nfs/dbraw/zinc/22/97/59/204229759.db2.gz YJOSLGTXJBUDNI-RNIAWFEPSA-N 0 3 361.529 5.365 50 0 FKAAHN Cc1ccc(C)c(NC(=O)[C@H](NC2CCCCCCC2)c2ccccc2)c1 ZINC000006086201 571118930 /nfs/dbraw/zinc/11/89/30/571118930.db2.gz IACXPJCORYNWDA-HSZRJFAPSA-N 0 3 364.533 5.686 50 0 FKAAHN Cc1ccc(C)c(NC(=O)[C@@H](NC2CCCCCCC2)c2ccccc2)c1 ZINC000006086203 571118957 /nfs/dbraw/zinc/11/89/57/571118957.db2.gz IACXPJCORYNWDA-QHCPKHFHSA-N 0 3 364.533 5.686 50 0 FKAAHN CCCCc1ccc(NC(=O)CNCCC23CC4CC(CC(C4)C2)C3)cc1 ZINC000006429827 204248199 /nfs/dbraw/zinc/24/81/99/204248199.db2.gz HSEMFIFCDWYBRQ-UHFFFAOYSA-N 0 3 368.565 5.164 50 0 FKAAHN Cc1ccc(C(C)C)c(OCCCN2CCCC[C@@H]2c2cccnc2)c1 ZINC000006624390 571237464 /nfs/dbraw/zinc/23/74/64/571237464.db2.gz YLWNQOPFOUQOMO-JOCHJYFZSA-N 0 3 352.522 5.510 50 0 FKAAHN Cc1ccc(C(C)C)c(OCCCN2CCCC[C@H]2c2cccnc2)c1 ZINC000006624391 571237390 /nfs/dbraw/zinc/23/73/90/571237390.db2.gz YLWNQOPFOUQOMO-QFIPXVFZSA-N 0 3 352.522 5.510 50 0 FKAAHN Cc1ccc(C(C)C)cc1OCCCN1CCCC[C@@H]1c1cccnc1 ZINC000006624403 206203868 /nfs/dbraw/zinc/20/38/68/206203868.db2.gz ZRRHSIONALPLMM-JOCHJYFZSA-N 0 3 352.522 5.510 50 0 FKAAHN Cc1ccc(C(C)C)cc1OCCCN1CCCC[C@H]1c1cccnc1 ZINC000006624404 571237617 /nfs/dbraw/zinc/23/76/17/571237617.db2.gz ZRRHSIONALPLMM-QFIPXVFZSA-N 0 3 352.522 5.510 50 0 FKAAHN CCC(=O)c1ccccc1OCCCCN1CCCC[C@@H]1c1cccnc1 ZINC000006624460 571237642 /nfs/dbraw/zinc/23/76/42/571237642.db2.gz HTCFVNAHTFRWGD-OAQYLSRUSA-N 0 3 366.505 5.061 50 0 FKAAHN CCC(=O)c1ccccc1OCCCCN1CCCC[C@H]1c1cccnc1 ZINC000006624461 571160311 /nfs/dbraw/zinc/16/03/11/571160311.db2.gz HTCFVNAHTFRWGD-NRFANRHFSA-N 0 3 366.505 5.061 50 0 FKAAHN CC(C)N[C@H](C(=O)Nc1cc(C(F)(F)F)ccc1Cl)c1ccccc1 ZINC000006638866 571237966 /nfs/dbraw/zinc/23/79/66/571237966.db2.gz MZJHAWOTDKNKOP-INIZCTEOSA-N 0 3 370.802 5.037 50 0 FKAAHN CC(C)N[C@@H](C(=O)Nc1cc(C(F)(F)F)ccc1Cl)c1ccccc1 ZINC000006638871 204257211 /nfs/dbraw/zinc/25/72/11/204257211.db2.gz MZJHAWOTDKNKOP-MRXNPFEDSA-N 0 3 370.802 5.037 50 0 FKAAHN CN(CC(=O)Nc1ccccc1Sc1ccccc1)C1CCCCC1 ZINC000006638999 571238110 /nfs/dbraw/zinc/23/81/10/571238110.db2.gz JFHMZHGXQYAMNI-UHFFFAOYSA-N 0 3 354.519 5.041 50 0 FKAAHN CCCCCN(CCCCC)CC(=O)Nc1cc(C)nc2ccccc21 ZINC000006663982 571239978 /nfs/dbraw/zinc/23/99/78/571239978.db2.gz MHAQQKBQNDYPLT-UHFFFAOYSA-N 0 3 355.526 5.164 50 0 FKAAHN Fc1ccc([C@H](CCNCc2ccccn2)c2ccc(Cl)cc2)cc1 ZINC000006669927 204259135 /nfs/dbraw/zinc/25/91/35/204259135.db2.gz VJAJIMJRYVDRPO-OAQYLSRUSA-N 0 3 354.856 5.186 50 0 FKAAHN Fc1ccc([C@@H](CCNCc2ccccn2)c2ccc(Cl)cc2)cc1 ZINC000006669928 207152660 /nfs/dbraw/zinc/15/26/60/207152660.db2.gz VJAJIMJRYVDRPO-NRFANRHFSA-N 0 3 354.856 5.186 50 0 FKAAHN Fc1ccc([C@H](CCN2Cc3ccccc3C2)c2ccc(Cl)cc2)cc1 ZINC000006670326 204259775 /nfs/dbraw/zinc/25/97/75/204259775.db2.gz KUEDFDMOVZBOME-HSZRJFAPSA-N 0 3 365.879 6.017 50 0 FKAAHN Fc1ccc([C@@H](CCN2Cc3ccccc3C2)c2ccc(Cl)cc2)cc1 ZINC000006670327 571240163 /nfs/dbraw/zinc/24/01/63/571240163.db2.gz KUEDFDMOVZBOME-QHCPKHFHSA-N 0 3 365.879 6.017 50 0 FKAAHN Clc1ccc(COc2ccc(CNCc3ccncc3)cc2)c(Cl)c1 ZINC000006704084 204261653 /nfs/dbraw/zinc/26/16/53/204261653.db2.gz DSLGBNKSGUYDCM-UHFFFAOYSA-N 0 3 373.283 5.257 50 0 FKAAHN FC(F)(F)c1cccc(OCCCN2CCCC[C@@H]2c2cccnc2)c1 ZINC000006719069 571243190 /nfs/dbraw/zinc/24/31/90/571243190.db2.gz LBTGEWHWZCSNRC-LJQANCHMSA-N 0 3 364.411 5.097 50 0 FKAAHN FC(F)(F)c1cccc(OCCCN2CCCC[C@H]2c2cccnc2)c1 ZINC000006719070 207155472 /nfs/dbraw/zinc/15/54/72/207155472.db2.gz LBTGEWHWZCSNRC-IBGZPJMESA-N 0 3 364.411 5.097 50 0 FKAAHN Clc1ccc(OCCCN2CCCC[C@H]2c2cccnc2)c(Cl)c1 ZINC000006719118 571243333 /nfs/dbraw/zinc/24/33/33/571243333.db2.gz VPBSXDDNAFBEME-SFHVURJKSA-N 0 3 365.304 5.385 50 0 FKAAHN Clc1ccc(OCCCN2CCCC[C@@H]2c2cccnc2)c(Cl)c1 ZINC000006719119 571243442 /nfs/dbraw/zinc/24/34/42/571243442.db2.gz VPBSXDDNAFBEME-GOSISDBHSA-N 0 3 365.304 5.385 50 0 FKAAHN Clc1ccc(SCCCCN2CCCC[C@H]2c2cccnc2)cc1 ZINC000006719270 571243373 /nfs/dbraw/zinc/24/33/73/571243373.db2.gz KBWHXJPKBSCKRZ-FQEVSTJZSA-N 0 3 360.954 5.835 50 0 FKAAHN Clc1ccc(SCCCCN2CCCC[C@@H]2c2cccnc2)cc1 ZINC000006719271 571243478 /nfs/dbraw/zinc/24/34/78/571243478.db2.gz KBWHXJPKBSCKRZ-HXUWFJFHSA-N 0 3 360.954 5.835 50 0 FKAAHN Clc1cccc(Cl)c1OCCCN1CCCC[C@H]1c1cccnc1 ZINC000006719323 571243320 /nfs/dbraw/zinc/24/33/20/571243320.db2.gz HEVDIZXZUJELDS-SFHVURJKSA-N 0 3 365.304 5.385 50 0 FKAAHN Cc1ccc(CNCc2cn(-c3ccccc3)nc2-c2cccs2)cc1 ZINC000006751050 207159494 /nfs/dbraw/zinc/15/94/94/207159494.db2.gz DZUCFWDIAODFFG-UHFFFAOYSA-N 0 3 359.498 5.199 50 0 FKAAHN Clc1ccc(-c2nn(-c3ccccc3)cc2CNCc2ccccc2)cc1 ZINC000006788142 263346930 /nfs/dbraw/zinc/34/69/30/263346930.db2.gz VZFWWCUXNVJUQW-UHFFFAOYSA-N 0 3 373.887 5.483 50 0 FKAAHN CC(C)Cc1ccc([C@@H](C)NCC(=O)Nc2ccccc2C(C)C)cc1 ZINC000006881514 204279315 /nfs/dbraw/zinc/27/93/15/204279315.db2.gz RAUYZMUVOIBRPG-GOSISDBHSA-N 0 3 352.522 5.298 50 0 FKAAHN CC(C)Cc1ccc([C@H](C)NCC(=O)Nc2ccccc2C(C)C)cc1 ZINC000006881515 204279017 /nfs/dbraw/zinc/27/90/17/204279017.db2.gz RAUYZMUVOIBRPG-SFHVURJKSA-N 0 3 352.522 5.298 50 0 FKAAHN CC(C)(C)NCc1cc(Br)ccc1OCc1ccc(F)cc1 ZINC000006882525 570787386 /nfs/dbraw/zinc/78/73/86/570787386.db2.gz QURFHFDMFGUBCI-UHFFFAOYSA-N 0 3 366.274 5.055 50 0 FKAAHN CC(C)(C)NCc1cc(Cl)ccc1OCc1ccc(Cl)cc1Cl ZINC000006882529 206243033 /nfs/dbraw/zinc/24/30/33/206243033.db2.gz ITESJONAXZLOCY-UHFFFAOYSA-N 0 3 372.723 6.114 50 0 FKAAHN CC(C)(C)NCc1cc(Br)ccc1OCc1ccccc1F ZINC000006882534 206242892 /nfs/dbraw/zinc/24/28/92/206242892.db2.gz LPXJMSVMLXFCFD-UHFFFAOYSA-N 0 3 366.274 5.055 50 0 FKAAHN COc1cccc(CNC(C)(C)C)c1OCc1ccc(Cl)cc1Cl ZINC000006882591 219779686 /nfs/dbraw/zinc/77/96/86/219779686.db2.gz QWZSJRURLQPPDW-UHFFFAOYSA-N 0 3 368.304 5.469 50 0 FKAAHN CC(C)CNCc1cc(Cl)ccc1OCc1ccc(Cl)cc1Cl ZINC000006883560 570787562 /nfs/dbraw/zinc/78/75/62/570787562.db2.gz HRPLNKRGSKJALP-UHFFFAOYSA-N 0 3 372.723 5.971 50 0 FKAAHN COc1ccc(C2=C[C@H](c3ccccc3)n3c(nc4ccccc43)N2)cc1 ZINC000006887000 263348424 /nfs/dbraw/zinc/34/84/24/263348424.db2.gz KXOFJDWDKOSCKH-JOCHJYFZSA-N 0 3 353.425 5.079 50 0 FKAAHN COc1ccc(C2=C[C@@H](c3ccccc3)n3c(nc4ccccc43)N2)cc1 ZINC000006887001 204279638 /nfs/dbraw/zinc/27/96/38/204279638.db2.gz KXOFJDWDKOSCKH-QFIPXVFZSA-N 0 3 353.425 5.079 50 0 FKAAHN CN1CC2=C(N=C1SCc1ccccc1)c1ccccc1CC21CCCC1 ZINC000006996308 219786172 /nfs/dbraw/zinc/78/61/72/219786172.db2.gz XOBPCHZHQZBLPX-UHFFFAOYSA-N 0 3 374.553 5.749 50 0 FKAAHN CCC[C@H](NCc1c(C)nn(-c2ccc(F)cc2)c1C)c1ccccc1 ZINC000007003020 571256951 /nfs/dbraw/zinc/25/69/51/571256951.db2.gz MKNACGOTWMNWRG-QFIPXVFZSA-N 0 3 351.469 5.259 50 0 FKAAHN CCC[C@@H](NCc1c(C)nn(-c2ccc(F)cc2)c1C)c1ccccc1 ZINC000007003021 571256965 /nfs/dbraw/zinc/25/69/65/571256965.db2.gz MKNACGOTWMNWRG-JOCHJYFZSA-N 0 3 351.469 5.259 50 0 FKAAHN O=C(Nc1ccccc1)c1ccc(CN2CC=C(c3ccccc3)CC2)cc1 ZINC000007017034 571257294 /nfs/dbraw/zinc/25/72/94/571257294.db2.gz SACHGKCQKLFKAE-UHFFFAOYSA-N 0 3 368.480 5.228 50 0 FKAAHN CCCCCCNCc1cc(Cl)ccc1OCc1ccc(Cl)cc1 ZINC000007260992 570662056 /nfs/dbraw/zinc/66/20/56/570662056.db2.gz GCLKBXIPBPRJEA-UHFFFAOYSA-N 0 3 366.332 6.242 50 0 FKAAHN CCCCCCNCc1cc(Cl)ccc1OCc1ccccc1Cl ZINC000007260999 570661914 /nfs/dbraw/zinc/66/19/14/570661914.db2.gz XLJSDMRCVMQYAZ-UHFFFAOYSA-N 0 3 366.332 6.242 50 0 FKAAHN CCCCCCNCc1cccc(OC)c1OCc1ccc(Cl)cc1 ZINC000007261076 207192352 /nfs/dbraw/zinc/19/23/52/207192352.db2.gz IDSQVCRVYSSCGM-UHFFFAOYSA-N 0 3 361.913 5.598 50 0 FKAAHN CCCCCCNCc1cccc(OC)c1OCc1ccccc1Cl ZINC000007261081 204293315 /nfs/dbraw/zinc/29/33/15/204293315.db2.gz AEGGZWIQOLFPDQ-UHFFFAOYSA-N 0 3 361.913 5.598 50 0 FKAAHN CCCCCNCc1cc(Cl)ccc1OCc1ccc(Cl)cc1 ZINC000007261263 570662021 /nfs/dbraw/zinc/66/20/21/570662021.db2.gz KOVVADGAEFLFKJ-UHFFFAOYSA-N 0 3 352.305 5.852 50 0 FKAAHN CCCCCNCc1cc(Br)ccc1OCc1ccccc1 ZINC000007261267 570790013 /nfs/dbraw/zinc/79/00/13/570790013.db2.gz XNMTVEAGPAXKGT-UHFFFAOYSA-N 0 3 362.311 5.308 50 0 FKAAHN CCCCCNCc1cc(Cl)ccc1OCc1ccccc1Cl ZINC000007261270 207192795 /nfs/dbraw/zinc/19/27/95/207192795.db2.gz VNMYZEWLSNVMAK-UHFFFAOYSA-N 0 3 352.305 5.852 50 0 FKAAHN CCCCNCc1cc(Br)ccc1OCc1ccc(F)cc1 ZINC000007261658 570661940 /nfs/dbraw/zinc/66/19/40/570661940.db2.gz LDQTUSFXZGDGRQ-UHFFFAOYSA-N 0 3 366.274 5.057 50 0 FKAAHN CCCCNCc1cc(Cl)ccc1OCc1ccc(Cl)cc1Cl ZINC000007261661 570661965 /nfs/dbraw/zinc/66/19/65/570661965.db2.gz RGMZYUUKGATUNS-UHFFFAOYSA-N 0 3 372.723 6.116 50 0 FKAAHN CCCCNCc1cc(Br)ccc1OCc1ccccc1F ZINC000007261665 570662064 /nfs/dbraw/zinc/66/20/64/570662064.db2.gz DMWVXABQECIICS-UHFFFAOYSA-N 0 3 366.274 5.057 50 0 FKAAHN CCCCNCc1cccc(OC)c1OCc1ccc(Cl)cc1Cl ZINC000007261733 204292395 /nfs/dbraw/zinc/29/23/95/204292395.db2.gz GODFWITVOIWCSP-UHFFFAOYSA-N 0 3 368.304 5.471 50 0 FKAAHN CCCNCc1cc(Br)ccc1OCc1ccc(Cl)cc1 ZINC000007262339 571191529 /nfs/dbraw/zinc/19/15/29/571191529.db2.gz UYGMZZPRWQGMLY-UHFFFAOYSA-N 0 3 368.702 5.181 50 0 FKAAHN CCCNCc1cc(Cl)ccc1OCc1ccc(Cl)cc1Cl ZINC000007262344 570790026 /nfs/dbraw/zinc/79/00/26/570790026.db2.gz KAUNVRRRROKUOA-UHFFFAOYSA-N 0 3 358.696 5.725 50 0 FKAAHN CCCNCc1cc(Br)ccc1OCc1ccccc1Cl ZINC000007262346 570790060 /nfs/dbraw/zinc/79/00/60/570790060.db2.gz MZQQVHUVJREKLS-UHFFFAOYSA-N 0 3 368.702 5.181 50 0 FKAAHN CCCNCc1cccc(OC)c1OCc1ccc(Cl)cc1Cl ZINC000007262407 570790041 /nfs/dbraw/zinc/79/00/41/570790041.db2.gz KYMLOYYMLCNKIS-UHFFFAOYSA-N 0 3 354.277 5.081 50 0 FKAAHN Cc1ccc(CNCc2ccc(OCc3ccc(Cl)cc3)cc2)cc1 ZINC000007525168 204298814 /nfs/dbraw/zinc/29/88/14/204298814.db2.gz OVPTUSJMAPFDOW-UHFFFAOYSA-N 0 3 351.877 5.517 50 0 FKAAHN Cc1ccc(CNCc2ccc(OCc3ccccc3Cl)cc2)cc1 ZINC000007525171 570665915 /nfs/dbraw/zinc/66/59/15/570665915.db2.gz PQUQQYFMHOVNJC-UHFFFAOYSA-N 0 3 351.877 5.517 50 0 FKAAHN Cc1ccc(CNCc2c(OCc3ccccc3)ccc3ccccc32)cc1 ZINC000007525202 570665772 /nfs/dbraw/zinc/66/57/72/570665772.db2.gz NMDXAIZYHZPTOR-UHFFFAOYSA-N 0 3 367.492 6.017 50 0 FKAAHN COc1cc(CNCc2ccc(C)cc2)ccc1OCc1ccc(F)cc1 ZINC000007537840 570665882 /nfs/dbraw/zinc/66/58/82/570665882.db2.gz HUUXDZVJJZDBMZ-UHFFFAOYSA-N 0 3 365.448 5.012 50 0 FKAAHN COc1cc(CNCc2ccc(C)cc2)ccc1OCc1ccccc1F ZINC000007537843 219808454 /nfs/dbraw/zinc/80/84/54/219808454.db2.gz AXGHLJMIHJGHAT-UHFFFAOYSA-N 0 3 365.448 5.012 50 0 FKAAHN CCOc1cc(CNCc2ccc(C)cc2)ccc1OCc1ccccc1 ZINC000007537863 570665932 /nfs/dbraw/zinc/66/59/32/570665932.db2.gz GWGFUZUVTFWIDC-UHFFFAOYSA-N 0 3 361.485 5.263 50 0 FKAAHN Cc1ccc(CNCc2cccc(OCc3ccc(Cl)cc3)c2)cc1 ZINC000007537898 570665917 /nfs/dbraw/zinc/66/59/17/570665917.db2.gz JFJLBMXVOXIARA-UHFFFAOYSA-N 0 3 351.877 5.517 50 0 FKAAHN Cc1ccc(CNCc2cccc(OCc3ccccc3Cl)c2)cc1 ZINC000007537902 570665790 /nfs/dbraw/zinc/66/57/90/570665790.db2.gz PBETWFALJWVRLK-UHFFFAOYSA-N 0 3 351.877 5.517 50 0 FKAAHN COc1cc(CNCc2ccc(C)cc2)ccc1OCc1cccc(C)c1 ZINC000007538106 210743770 /nfs/dbraw/zinc/74/37/70/210743770.db2.gz PYOQORAHBHCFFH-UHFFFAOYSA-N 0 3 361.485 5.181 50 0 FKAAHN COc1cc(CNCc2ccc(C)cc2)ccc1OCc1ccc(C)cc1 ZINC000007538111 570665941 /nfs/dbraw/zinc/66/59/41/570665941.db2.gz DITJCKRQUFATRI-UHFFFAOYSA-N 0 3 361.485 5.181 50 0 FKAAHN COc1cc(CNCc2ccc(C)cc2)ccc1OCc1ccccc1C ZINC000007538115 207197660 /nfs/dbraw/zinc/19/76/60/207197660.db2.gz KMLLLGBCICIJOT-UHFFFAOYSA-N 0 3 361.485 5.181 50 0 FKAAHN COc1ccc(CNCc2ccc(OCc3ccc(Cl)cc3)cc2)cc1 ZINC000007538287 570665776 /nfs/dbraw/zinc/66/57/76/570665776.db2.gz RGRILDJVWROLHY-UHFFFAOYSA-N 0 3 367.876 5.217 50 0 FKAAHN COc1ccc(CNCc2ccc(OCc3ccccc3Cl)cc2)cc1 ZINC000007538290 204300505 /nfs/dbraw/zinc/30/05/05/204300505.db2.gz SLSIKTZFVFDCAF-UHFFFAOYSA-N 0 3 367.876 5.217 50 0 FKAAHN COc1ccc(CNCc2cccc(OCc3ccc(Cl)cc3)c2)cc1 ZINC000007538391 204300439 /nfs/dbraw/zinc/30/04/39/204300439.db2.gz RFTPJSWUJAKYNF-UHFFFAOYSA-N 0 3 367.876 5.217 50 0 FKAAHN COc1ccc(CNCc2cccc(OCc3ccccc3Cl)c2)cc1 ZINC000007538396 204300459 /nfs/dbraw/zinc/30/04/59/204300459.db2.gz AKOSEIGFBCGGCW-UHFFFAOYSA-N 0 3 367.876 5.217 50 0 FKAAHN COc1ccc(CCNCc2ccc(-c3cccc(Cl)c3C)o2)cc1 ZINC000007539107 204300294 /nfs/dbraw/zinc/30/02/94/204300294.db2.gz HYRWEPBECBKFEL-UHFFFAOYSA-N 0 3 355.865 5.249 50 0 FKAAHN CCOc1ccccc1NC(=O)[C@H](NC1CCCCCC1)c1ccccc1 ZINC000007848695 204309459 /nfs/dbraw/zinc/30/94/59/204309459.db2.gz QHGVJXUTGSXXCI-JOCHJYFZSA-N 0 3 366.505 5.078 50 0 FKAAHN CCOc1ccccc1NC(=O)[C@@H](NC1CCCCCC1)c1ccccc1 ZINC000007848699 204309338 /nfs/dbraw/zinc/30/93/38/204309338.db2.gz QHGVJXUTGSXXCI-QFIPXVFZSA-N 0 3 366.505 5.078 50 0 FKAAHN Cc1ccc([C@H](NCc2ccc(-n3ccnc3)cc2)c2ccccc2)cc1 ZINC000007984403 207214747 /nfs/dbraw/zinc/21/47/47/207214747.db2.gz CNKKUALOXYRRLC-XMMPIXPASA-N 0 3 353.469 5.060 50 0 FKAAHN Cc1ccc([C@@H](NCc2ccc(-n3ccnc3)cc2)c2ccccc2)cc1 ZINC000007984405 204312927 /nfs/dbraw/zinc/31/29/27/204312927.db2.gz CNKKUALOXYRRLC-DEOSSOPVSA-N 0 3 353.469 5.060 50 0 FKAAHN CCOCCCNCc1cc(Cl)ccc1OCc1ccc(Cl)cc1 ZINC000008253159 570678904 /nfs/dbraw/zinc/67/89/04/570678904.db2.gz GLZRRXKLZYOZKP-UHFFFAOYSA-N 0 3 368.304 5.089 50 0 FKAAHN CCOCCCNCc1cc(Cl)ccc1OCc1ccccc1Cl ZINC000008253164 570679050 /nfs/dbraw/zinc/67/90/50/570679050.db2.gz JLBBKZFVSRUFKM-UHFFFAOYSA-N 0 3 368.304 5.089 50 0 FKAAHN CCOCCCNCc1ccccc1OCc1ccc(Cl)cc1Cl ZINC000008253213 204323334 /nfs/dbraw/zinc/32/33/34/204323334.db2.gz LWWNNZICEJFDPZ-UHFFFAOYSA-N 0 3 368.304 5.089 50 0 FKAAHN CCOc1cc(CNC2CC2)cc(Cl)c1OCc1ccc(Cl)cc1 ZINC000008253941 570679031 /nfs/dbraw/zinc/67/90/31/570679031.db2.gz TVSKTFFYFKHWPZ-UHFFFAOYSA-N 0 3 366.288 5.223 50 0 FKAAHN CCOc1cc(CNC)cc(Cl)c1OCc1ccc(Cl)cc1Cl ZINC000008254019 207226221 /nfs/dbraw/zinc/22/62/21/207226221.db2.gz PXEHUGLDHQMIRN-UHFFFAOYSA-N 0 3 374.695 5.344 50 0 FKAAHN CCOc1cc(CNC2CC2)cc(Cl)c1OCc1ccccc1Cl ZINC000008254103 207226354 /nfs/dbraw/zinc/22/63/54/207226354.db2.gz WIZGENRMGMYMFJ-UHFFFAOYSA-N 0 3 366.288 5.223 50 0 FKAAHN CCOc1cc(CNC2CC2)ccc1OCc1ccc(Cl)cc1Cl ZINC000008254567 219855377 /nfs/dbraw/zinc/85/53/77/219855377.db2.gz YLZDASXLRHDYHX-UHFFFAOYSA-N 0 3 366.288 5.223 50 0 FKAAHN CCOc1cc(CNCc2ccc(F)cc2)ccc1OCc1ccccc1 ZINC000008254654 570678889 /nfs/dbraw/zinc/67/88/89/570678889.db2.gz RFVBQYFGJRBPRD-UHFFFAOYSA-N 0 3 365.448 5.093 50 0 FKAAHN CCOc1cc(CN[C@@H](C)c2ccccc2)ccc1OCc1ccccc1 ZINC000008254660 570679058 /nfs/dbraw/zinc/67/90/58/570679058.db2.gz YWWRYRQZGSTYKX-IBGZPJMESA-N 0 3 361.485 5.515 50 0 FKAAHN CCOc1cc(CN[C@H](C)c2ccccc2)ccc1OCc1ccccc1 ZINC000008254662 204324112 /nfs/dbraw/zinc/32/41/12/204324112.db2.gz YWWRYRQZGSTYKX-LJQANCHMSA-N 0 3 361.485 5.515 50 0 FKAAHN CC[C@@H](C)NCc1cc(Br)ccc1OCc1ccc(F)cc1 ZINC000008325929 570680331 /nfs/dbraw/zinc/68/03/31/570680331.db2.gz WZJGWWXCVWIENB-CYBMUJFWSA-N 0 3 366.274 5.055 50 0 FKAAHN CC[C@@H](C)NCc1cc(Cl)ccc1OCc1ccc(Cl)cc1Cl ZINC000008325934 210782055 /nfs/dbraw/zinc/78/20/55/210782055.db2.gz FQOAJXPMPUGMLZ-GFCCVEGCSA-N 0 3 372.723 6.114 50 0 FKAAHN CC[C@@H](C)NCc1cc(Br)ccc1OCc1ccccc1F ZINC000008325944 204327102 /nfs/dbraw/zinc/32/71/02/204327102.db2.gz DFNCIVNDOXDMSA-CYBMUJFWSA-N 0 3 366.274 5.055 50 0 FKAAHN CC[C@@H](C)NCc1cccc(OC)c1OCc1ccc(Cl)cc1Cl ZINC000008326029 204327976 /nfs/dbraw/zinc/32/79/76/204327976.db2.gz WSKIFIXAPSZSSH-CYBMUJFWSA-N 0 3 368.304 5.469 50 0 FKAAHN CC[C@H](C)NCc1cc(Br)ccc1OCc1ccc(F)cc1 ZINC000008326690 207230362 /nfs/dbraw/zinc/23/03/62/207230362.db2.gz WZJGWWXCVWIENB-ZDUSSCGKSA-N 0 3 366.274 5.055 50 0 FKAAHN CC[C@H](C)NCc1cc(Cl)ccc1OCc1ccc(Cl)cc1Cl ZINC000008326693 570680394 /nfs/dbraw/zinc/68/03/94/570680394.db2.gz FQOAJXPMPUGMLZ-LBPRGKRZSA-N 0 3 372.723 6.114 50 0 FKAAHN CC[C@H](C)NCc1cc(Br)ccc1OCc1ccccc1F ZINC000008326699 207230086 /nfs/dbraw/zinc/23/00/86/207230086.db2.gz DFNCIVNDOXDMSA-ZDUSSCGKSA-N 0 3 366.274 5.055 50 0 FKAAHN CC[C@H](C)NCc1cccc(OC)c1OCc1ccc(Cl)cc1Cl ZINC000008326780 204327395 /nfs/dbraw/zinc/32/73/95/204327395.db2.gz WSKIFIXAPSZSSH-ZDUSSCGKSA-N 0 3 368.304 5.469 50 0 FKAAHN OC1CCC(NCc2ccc(-c3ccc(Cl)c(C(F)(F)F)c3)o2)CC1 ZINC000008329007 204327058 /nfs/dbraw/zinc/32/70/58/204327058.db2.gz BAYGGIGFRGEGJV-UHFFFAOYSA-N 0 3 373.802 5.012 50 0 FKAAHN Clc1ccc(COc2cccc(CNCc3ccncc3)c2)c(Cl)c1 ZINC000008418418 204331508 /nfs/dbraw/zinc/33/15/08/204331508.db2.gz IVZOEDYHHQIUFJ-UHFFFAOYSA-N 0 3 373.283 5.257 50 0 FKAAHN Clc1ccc(COc2ccc(CNCc3cccnc3)cc2)c(Cl)c1 ZINC000008419377 207234306 /nfs/dbraw/zinc/23/43/06/207234306.db2.gz XVVABQJZUFLNEN-UHFFFAOYSA-N 0 3 373.283 5.257 50 0 FKAAHN COc1cc(CNCc2ccccc2)cc(Cl)c1OCc1ccccc1 ZINC000008470373 570795945 /nfs/dbraw/zinc/79/59/45/570795945.db2.gz FZHCRWDUJCEFHA-UHFFFAOYSA-N 0 3 367.876 5.217 50 0 FKAAHN COc1cc(CNCc2ccccc2)ccc1OCc1ccc(Cl)cc1 ZINC000008471528 570682637 /nfs/dbraw/zinc/68/26/37/570682637.db2.gz OHEVGJMKWYYKDD-UHFFFAOYSA-N 0 3 367.876 5.217 50 0 FKAAHN COc1cc(CNCc2ccccc2)ccc1OCc1cccc(Cl)c1 ZINC000008471943 570682429 /nfs/dbraw/zinc/68/24/29/570682429.db2.gz SLOZXSNZHJYMFS-UHFFFAOYSA-N 0 3 367.876 5.217 50 0 FKAAHN COc1cc(CNCc2ccccc2)ccc1OCc1ccccc1Cl ZINC000008472180 210788706 /nfs/dbraw/zinc/78/87/06/210788706.db2.gz RZYKYCBZRKUDPS-UHFFFAOYSA-N 0 3 367.876 5.217 50 0 FKAAHN COc1cc(CNCc2cccs2)ccc1OCc1ccccc1Cl ZINC000008472193 570682529 /nfs/dbraw/zinc/68/25/29/570682529.db2.gz BBDMTJOOXHOQLR-UHFFFAOYSA-N 0 3 373.905 5.279 50 0 FKAAHN C[C@H](NCc1c(OCc2ccccc2)ccc2ccccc21)c1ccccc1 ZINC000008534225 570682838 /nfs/dbraw/zinc/68/28/38/570682838.db2.gz AJQZKUYFBDKVRC-FQEVSTJZSA-N 0 3 367.492 6.270 50 0 FKAAHN COc1cc(CN[C@@H](C)c2ccccc2)ccc1OCCc1ccccc1 ZINC000008534246 210790880 /nfs/dbraw/zinc/79/08/80/210790880.db2.gz YULUCXXRIQZOSP-IBGZPJMESA-N 0 3 361.485 5.168 50 0 FKAAHN COc1cc(CN[C@@H](C)c2ccccc2)ccc1OCc1ccccc1F ZINC000008534256 570682983 /nfs/dbraw/zinc/68/29/83/570682983.db2.gz RFAABTKLCOPYLY-KRWDZBQOSA-N 0 3 365.448 5.264 50 0 FKAAHN C[C@H](NCc1ccc(OCc2ccc(Cl)cc2)cc1)c1ccccc1 ZINC000008534260 204333141 /nfs/dbraw/zinc/33/31/41/204333141.db2.gz JIEPFEBUACUBSL-KRWDZBQOSA-N 0 3 351.877 5.770 50 0 FKAAHN C[C@H](NCc1ccc(OCc2ccccc2Cl)cc1)c1ccccc1 ZINC000008534262 207236224 /nfs/dbraw/zinc/23/62/24/207236224.db2.gz KFJOINXICPZUDH-KRWDZBQOSA-N 0 3 351.877 5.770 50 0 FKAAHN C[C@H](NCc1cccc(OCc2ccc(Cl)cc2)c1)c1ccccc1 ZINC000008534268 204333708 /nfs/dbraw/zinc/33/37/08/204333708.db2.gz WQFZPKNIEKBXCQ-KRWDZBQOSA-N 0 3 351.877 5.770 50 0 FKAAHN C[C@H](NCc1cccc(OCc2ccccc2Cl)c1)c1ccccc1 ZINC000008534272 570682995 /nfs/dbraw/zinc/68/29/95/570682995.db2.gz JHIXHSSNCVGSFB-KRWDZBQOSA-N 0 3 351.877 5.770 50 0 FKAAHN C[C@H](NCc1ccccc1OCc1ccc(Cl)cc1)c1ccccc1 ZINC000008534280 570683048 /nfs/dbraw/zinc/68/30/48/570683048.db2.gz DPKVWQHIINHQNP-KRWDZBQOSA-N 0 3 351.877 5.770 50 0 FKAAHN C[C@H](NCc1ccccc1OCc1ccccc1Cl)c1ccccc1 ZINC000008534283 570682969 /nfs/dbraw/zinc/68/29/69/570682969.db2.gz ZYKWVQKQBCQISX-KRWDZBQOSA-N 0 3 351.877 5.770 50 0 FKAAHN C[C@@H](NCc1c(OCc2ccccc2)ccc2ccccc21)c1ccccc1 ZINC000008535297 570682936 /nfs/dbraw/zinc/68/29/36/570682936.db2.gz AJQZKUYFBDKVRC-HXUWFJFHSA-N 0 3 367.492 6.270 50 0 FKAAHN COc1cc(CN[C@H](C)c2ccccc2)ccc1OCCc1ccccc1 ZINC000008535318 204333044 /nfs/dbraw/zinc/33/30/44/204333044.db2.gz YULUCXXRIQZOSP-LJQANCHMSA-N 0 3 361.485 5.168 50 0 FKAAHN COc1cc(CN[C@H](C)c2ccccc2)ccc1OCc1ccccc1F ZINC000008535328 570683085 /nfs/dbraw/zinc/68/30/85/570683085.db2.gz RFAABTKLCOPYLY-QGZVFWFLSA-N 0 3 365.448 5.264 50 0 FKAAHN C[C@@H](NCc1ccc(OCc2ccc(Cl)cc2)cc1)c1ccccc1 ZINC000008535332 207236461 /nfs/dbraw/zinc/23/64/61/207236461.db2.gz JIEPFEBUACUBSL-QGZVFWFLSA-N 0 3 351.877 5.770 50 0 FKAAHN C[C@@H](NCc1ccc(OCc2ccccc2Cl)cc1)c1ccccc1 ZINC000008535334 219863908 /nfs/dbraw/zinc/86/39/08/219863908.db2.gz KFJOINXICPZUDH-QGZVFWFLSA-N 0 3 351.877 5.770 50 0 FKAAHN C[C@@H](NCc1cccc(OCc2ccc(Cl)cc2)c1)c1ccccc1 ZINC000008535338 570682813 /nfs/dbraw/zinc/68/28/13/570682813.db2.gz WQFZPKNIEKBXCQ-QGZVFWFLSA-N 0 3 351.877 5.770 50 0 FKAAHN C[C@@H](NCc1cccc(OCc2ccccc2Cl)c1)c1ccccc1 ZINC000008535342 570682900 /nfs/dbraw/zinc/68/29/00/570682900.db2.gz JHIXHSSNCVGSFB-QGZVFWFLSA-N 0 3 351.877 5.770 50 0 FKAAHN C[C@@H](NCc1ccccc1OCc1ccc(Cl)cc1)c1ccccc1 ZINC000008535350 204333964 /nfs/dbraw/zinc/33/39/64/204333964.db2.gz DPKVWQHIINHQNP-QGZVFWFLSA-N 0 3 351.877 5.770 50 0 FKAAHN C[C@@H](NCc1ccccc1OCc1ccccc1Cl)c1ccccc1 ZINC000008535353 204333451 /nfs/dbraw/zinc/33/34/51/204333451.db2.gz ZYKWVQKQBCQISX-QGZVFWFLSA-N 0 3 351.877 5.770 50 0 FKAAHN COc1cc(CNCc2ccc(F)cc2)ccc1OCc1ccc(C)cc1 ZINC000008550150 210792032 /nfs/dbraw/zinc/79/20/32/210792032.db2.gz VYFCYRCBZXTROZ-UHFFFAOYSA-N 0 3 365.448 5.012 50 0 FKAAHN COc1cc(CN[C@@H](C)c2ccccc2)ccc1OCc1ccc(C)cc1 ZINC000008550154 207236803 /nfs/dbraw/zinc/23/68/03/207236803.db2.gz ZTIIRMWTRJFMTE-IBGZPJMESA-N 0 3 361.485 5.433 50 0 FKAAHN COc1cc(CN[C@H](C)c2ccccc2)ccc1OCc1ccc(C)cc1 ZINC000008550156 204333013 /nfs/dbraw/zinc/33/30/13/204333013.db2.gz ZTIIRMWTRJFMTE-LJQANCHMSA-N 0 3 361.485 5.433 50 0 FKAAHN CCCCN(C)Cc1c(C)[nH]c2ccc(Oc3ccccc3)cc2c1=O ZINC000008571800 206217135 /nfs/dbraw/zinc/21/71/35/206217135.db2.gz VQSTYWPYMBORRK-UHFFFAOYSA-N 0 3 350.462 5.273 50 0 FKAAHN CCCCN(C)Cc1c(C)[nH]c2ccc(OCc3ccccc3)cc2c1=O ZINC000008571868 571050573 /nfs/dbraw/zinc/05/05/73/571050573.db2.gz HNQFKXFEESLNQP-UHFFFAOYSA-N 0 3 364.489 5.060 50 0 FKAAHN Cc1[nH]c2ccc(Oc3ccccc3)cc2c(=O)c1CN1CCCCCC1 ZINC000008572546 571050883 /nfs/dbraw/zinc/05/08/83/571050883.db2.gz LIGJAMPYBXZZPD-UHFFFAOYSA-N 0 3 362.473 5.417 50 0 FKAAHN Cc1[nH]c2ccc(Oc3ccccc3)cc2c(=O)c1CN1CCC[C@H](C)C1 ZINC000008572552 571050904 /nfs/dbraw/zinc/05/09/04/571050904.db2.gz GRLPCGKDEINVJF-INIZCTEOSA-N 0 3 362.473 5.273 50 0 FKAAHN Cc1[nH]c2ccc(Oc3ccccc3)cc2c(=O)c1CN1CCC[C@@H](C)C1 ZINC000008572553 206216918 /nfs/dbraw/zinc/21/69/18/206216918.db2.gz GRLPCGKDEINVJF-MRXNPFEDSA-N 0 3 362.473 5.273 50 0 FKAAHN Cc1[nH]c2ccc(Oc3ccccc3)cc2c(=O)c1CN1CCC(C)CC1 ZINC000008572555 206217924 /nfs/dbraw/zinc/21/79/24/206217924.db2.gz IPOYHBRDMWNAHO-UHFFFAOYSA-N 0 3 362.473 5.273 50 0 FKAAHN CCCOc1ccc2[nH]c(C)c(CN(CC)Cc3ccccc3)c(=O)c2c1 ZINC000008572566 206218220 /nfs/dbraw/zinc/21/82/20/206218220.db2.gz HGWZLDKVIGDOJH-UHFFFAOYSA-N 0 3 364.489 5.060 50 0 FKAAHN CCCCN(CC)Cc1c(C)[nH]c2ccc(Oc3ccccc3)cc2c1=O ZINC000008572571 571051087 /nfs/dbraw/zinc/05/10/87/571051087.db2.gz LGFNDCMFERFCHX-UHFFFAOYSA-N 0 3 364.489 5.663 50 0 FKAAHN CCCCc1ccc2[nH]c(C)c(CN(CC)Cc3ccccc3)c(=O)c2c1 ZINC000008572607 571050953 /nfs/dbraw/zinc/05/09/53/571050953.db2.gz CCQVWCRHBCTGSP-UHFFFAOYSA-N 0 3 362.517 5.614 50 0 FKAAHN CCc1c(C)sc2c1CCN(Cc1ccc(F)cc1)[C@@H]2c1ccccc1 ZINC000008609022 207239548 /nfs/dbraw/zinc/23/95/48/207239548.db2.gz OPFMMFUDXHCSMQ-JOCHJYFZSA-N 0 3 365.517 5.906 50 0 FKAAHN CCc1c(C)sc2c1CCN(Cc1ccc(F)cc1)[C@H]2c1ccccc1 ZINC000008609023 204336622 /nfs/dbraw/zinc/33/66/22/204336622.db2.gz OPFMMFUDXHCSMQ-QFIPXVFZSA-N 0 3 365.517 5.906 50 0 FKAAHN CCN(Cc1ccccc1)Cc1c(C)[nH]c2c(C)c(Cl)ccc2c1=O ZINC000008717150 571057007 /nfs/dbraw/zinc/05/70/07/571057007.db2.gz HKWHDRRUKBDSGQ-UHFFFAOYSA-N 0 3 354.881 5.233 50 0 FKAAHN CCN(Cc1ccccc1)Cc1c(C)[nH]c2c(C)cc(Cl)cc2c1=O ZINC000008717231 571057166 /nfs/dbraw/zinc/05/71/66/571057166.db2.gz RSUWYPWAUZHSAD-UHFFFAOYSA-N 0 3 354.881 5.233 50 0 FKAAHN CCCCN(C)Cc1c(=O)c2cc(Cl)ccc2[nH]c1-c1ccccc1 ZINC000008717278 571057100 /nfs/dbraw/zinc/05/71/00/571057100.db2.gz ZAXHIYBXEQQNOX-UHFFFAOYSA-N 0 3 354.881 5.493 50 0 FKAAHN CC1CCN(Cc2c(=O)c3cc(Cl)ccc3[nH]c2-c2ccccc2)CC1 ZINC000008717280 571056989 /nfs/dbraw/zinc/05/69/89/571056989.db2.gz YISKUJGSKXCRKU-UHFFFAOYSA-N 0 3 366.892 5.493 50 0 FKAAHN C[C@H]1CCCN(Cc2c(=O)c3cc(Cl)ccc3[nH]c2-c2ccccc2)C1 ZINC000008717281 206217818 /nfs/dbraw/zinc/21/78/18/206217818.db2.gz QXXZQCPYBXRKBK-HNNXBMFYSA-N 0 3 366.892 5.493 50 0 FKAAHN C[C@@H]1CCCN(Cc2c(=O)c3cc(Cl)ccc3[nH]c2-c2ccccc2)C1 ZINC000008717282 571057058 /nfs/dbraw/zinc/05/70/58/571057058.db2.gz QXXZQCPYBXRKBK-OAHLLOKOSA-N 0 3 366.892 5.493 50 0 FKAAHN CCCC[NH+](CCCC)Cc1c(C)[n-]c2c(OC)ccc(Cl)c2c1=O ZINC000008717388 571057396 /nfs/dbraw/zinc/05/73/96/571057396.db2.gz WPYASOHWYPGYAR-UHFFFAOYSA-N 0 3 364.917 5.313 50 0 FKAAHN CC[C@@H]1CCCCN1Cc1c(C)[nH]c2ccc(OCC(C)C)cc2c1=O ZINC000008717498 571057510 /nfs/dbraw/zinc/05/75/10/571057510.db2.gz XKLMCFBOUQZMRQ-QGZVFWFLSA-N 0 3 356.510 5.048 50 0 FKAAHN CC[C@H]1CCCCN1Cc1c(C)[nH]c2ccc(OCC(C)C)cc2c1=O ZINC000008717499 571057584 /nfs/dbraw/zinc/05/75/84/571057584.db2.gz XKLMCFBOUQZMRQ-KRWDZBQOSA-N 0 3 356.510 5.048 50 0 FKAAHN Fc1ccccc1OCCCN1CCC(c2nc3ccccc3s2)CC1 ZINC000008991346 219873187 /nfs/dbraw/zinc/87/31/87/219873187.db2.gz GUFMZMYJASLQCV-UHFFFAOYSA-N 0 3 370.493 5.084 50 0 FKAAHN CC(C)Oc1ccc([C@H](N[C@@H]2CCOC(C)(C)C2)c2ccccc2)cc1 ZINC000009054202 571094287 /nfs/dbraw/zinc/09/42/87/571094287.db2.gz PCQWAAMGLVFKII-IFMALSPDSA-N 0 3 353.506 5.110 50 0 FKAAHN CC(C)Oc1ccc([C@@H](N[C@@H]2CCOC(C)(C)C2)c2ccccc2)cc1 ZINC000009054204 571094298 /nfs/dbraw/zinc/09/42/98/571094298.db2.gz PCQWAAMGLVFKII-IRLDBZIGSA-N 0 3 353.506 5.110 50 0 FKAAHN CC(C)Oc1ccc([C@H](N[C@H]2CCOC(C)(C)C2)c2ccccc2)cc1 ZINC000009054207 571094202 /nfs/dbraw/zinc/09/42/02/571094202.db2.gz PCQWAAMGLVFKII-RBBKRZOGSA-N 0 3 353.506 5.110 50 0 FKAAHN CC(C)Oc1ccc([C@@H](N[C@H]2CCOC(C)(C)C2)c2ccccc2)cc1 ZINC000009054209 571094232 /nfs/dbraw/zinc/09/42/32/571094232.db2.gz PCQWAAMGLVFKII-UNMCSNQZSA-N 0 3 353.506 5.110 50 0 FKAAHN O=c1[nH]c2ccc(Cl)cc2c(-c2ccccc2)c1CN1CCCCC1 ZINC000009234517 204359557 /nfs/dbraw/zinc/35/95/57/204359557.db2.gz PHGKTXOIVHVYHO-UHFFFAOYSA-N 0 3 352.865 5.247 50 0 FKAAHN c1ccc(SCCN2CCC(c3nc4ccccc4s3)CC2)cc1 ZINC000009486540 571111139 /nfs/dbraw/zinc/11/11/39/571111139.db2.gz CGMMNFYWUIYTTR-UHFFFAOYSA-N 0 3 354.544 5.268 50 0 FKAAHN CCCCN1C(=O)c2ccccc2[C@H]1NC1CCCCCCCCCCC1 ZINC000009553770 204374946 /nfs/dbraw/zinc/37/49/46/204374946.db2.gz QXYBYBITFIHHJH-QHCPKHFHSA-N 0 3 370.581 6.204 50 0 FKAAHN CCCCN1C(=O)c2ccccc2[C@@H]1NC1CCCCCCCCCCC1 ZINC000009553771 204375192 /nfs/dbraw/zinc/37/51/92/204375192.db2.gz QXYBYBITFIHHJH-HSZRJFAPSA-N 0 3 370.581 6.204 50 0 FKAAHN CCc1ccc(-c2nc3ccccn3c2CNCc2ccc(C)cc2)cc1 ZINC000009740827 207285949 /nfs/dbraw/zinc/28/59/49/207285949.db2.gz PCOCYUNXTPLQKK-UHFFFAOYSA-N 0 3 355.485 5.162 50 0 FKAAHN CCc1ccc(-c2nc3ccccn3c2CNCc2cccc(C)c2)cc1 ZINC000009740831 571118616 /nfs/dbraw/zinc/11/86/16/571118616.db2.gz QCYBLEYOQVQKKB-UHFFFAOYSA-N 0 3 355.485 5.162 50 0 FKAAHN CCc1cccc(CC)c1NC(=O)c1ccc(CN2CCCCC2)cc1 ZINC000010313857 570699790 /nfs/dbraw/zinc/69/97/90/570699790.db2.gz WEEVRENOQHDJSS-UHFFFAOYSA-N 0 3 350.506 5.050 50 0 FKAAHN Cc1c(CNCc2ccccc2)c2ccccc2n1Cc1ccccc1Cl ZINC000010315468 570699960 /nfs/dbraw/zinc/69/99/60/570699960.db2.gz RQFZYKUPQKCUTO-UHFFFAOYSA-N 0 3 374.915 5.941 50 0 FKAAHN O=C(Nc1ccc(Cl)cc1Cl)c1ccc(CN2CCCCC2)cc1 ZINC000010335287 204012233 /nfs/dbraw/zinc/01/22/33/204012233.db2.gz LURRWNBCWUXDHZ-UHFFFAOYSA-N 0 3 363.288 5.232 50 0 FKAAHN Cc1ccc([C@H](N[C@@H](C)C(=O)Nc2cc(Cl)ccc2C)C2CC2)cc1 ZINC000010351489 571125567 /nfs/dbraw/zinc/12/55/67/571125567.db2.gz DRELNXFERBLPRW-YWZLYKJASA-N 0 3 356.897 5.025 50 0 FKAAHN Cc1ccc([C@@H](N[C@@H](C)C(=O)Nc2cc(Cl)ccc2C)C2CC2)cc1 ZINC000010351492 219900305 /nfs/dbraw/zinc/90/03/05/219900305.db2.gz DRELNXFERBLPRW-MGPUTAFESA-N 0 3 356.897 5.025 50 0 FKAAHN Cc1ccc([C@H](N[C@H](C)C(=O)Nc2cc(Cl)ccc2C)C2CC2)cc1 ZINC000010351493 571125597 /nfs/dbraw/zinc/12/55/97/571125597.db2.gz DRELNXFERBLPRW-QRWLVFNGSA-N 0 3 356.897 5.025 50 0 FKAAHN Cc1ccc([C@@H](N[C@H](C)C(=O)Nc2cc(Cl)ccc2C)C2CC2)cc1 ZINC000010351494 207299884 /nfs/dbraw/zinc/29/98/84/207299884.db2.gz DRELNXFERBLPRW-FOIQADDNSA-N 0 3 356.897 5.025 50 0 FKAAHN COc1cccc(CNC(C)C)c1OCc1ccc(Cl)cc1Cl ZINC000010435840 570804048 /nfs/dbraw/zinc/80/40/48/570804048.db2.gz WGLRSABCWIPGHR-UHFFFAOYSA-N 0 3 354.277 5.079 50 0 FKAAHN CC(C)NCc1cc(Br)ccc1OCc1ccc(Cl)cc1 ZINC000010435927 571105815 /nfs/dbraw/zinc/10/58/15/571105815.db2.gz ALNXMAICVWDQRG-UHFFFAOYSA-N 0 3 368.702 5.180 50 0 FKAAHN CC(C)NCc1cc(Br)ccc1OCc1ccccc1Cl ZINC000010435935 206279469 /nfs/dbraw/zinc/27/94/69/206279469.db2.gz CTFBASNGDVFJBC-UHFFFAOYSA-N 0 3 368.702 5.180 50 0 FKAAHN CC(C)NCc1cc(Cl)ccc1OCc1ccc(Cl)cc1Cl ZINC000010436026 219903456 /nfs/dbraw/zinc/90/34/56/219903456.db2.gz PGCKEWQCFJBGHS-UHFFFAOYSA-N 0 3 358.696 5.724 50 0 FKAAHN COc1cc(Cl)cc(CNC2CCCCC2)c1OCc1ccccc1 ZINC000010436513 570700813 /nfs/dbraw/zinc/70/08/13/570700813.db2.gz RCOCUUREIYYNHD-UHFFFAOYSA-N 0 3 359.897 5.350 50 0 FKAAHN C[C@H](NCc1ccc(OCc2ccccc2)c(Cl)c1)c1ccccc1 ZINC000010473912 570701277 /nfs/dbraw/zinc/70/12/77/570701277.db2.gz FZSKIGQHTBMLSH-KRWDZBQOSA-N 0 3 351.877 5.770 50 0 FKAAHN C[C@@H](NCc1ccc(OCc2ccccc2)c(Cl)c1)c1ccccc1 ZINC000010473917 570701304 /nfs/dbraw/zinc/70/13/04/570701304.db2.gz FZSKIGQHTBMLSH-QGZVFWFLSA-N 0 3 351.877 5.770 50 0 FKAAHN CCCCCCNCc1cc(Cl)cc(OC)c1OCc1ccccc1 ZINC000010474840 570701323 /nfs/dbraw/zinc/70/13/23/570701323.db2.gz JDHMYBXDYFIJSB-UHFFFAOYSA-N 0 3 361.913 5.598 50 0 FKAAHN Fc1ccc(CNCc2ccc(OCc3ccccc3)c(Cl)c2)cc1 ZINC000010475216 207301422 /nfs/dbraw/zinc/30/14/22/207301422.db2.gz DNNKWHPEEPIPOO-UHFFFAOYSA-N 0 3 355.840 5.348 50 0 FKAAHN Cc1ccc(CNCc2ccc(OCc3ccccc3)c(Cl)c2)cc1 ZINC000010475386 207302511 /nfs/dbraw/zinc/30/25/11/207302511.db2.gz WTNBQFKWANCBRH-UHFFFAOYSA-N 0 3 351.877 5.517 50 0 FKAAHN COc1ccc(CNCc2ccc(OCc3ccccc3)c(Cl)c2)cc1 ZINC000010475399 570701261 /nfs/dbraw/zinc/70/12/61/570701261.db2.gz ZPYVHOUHHRNGKP-UHFFFAOYSA-N 0 3 367.876 5.217 50 0 FKAAHN CCCN(CCC)CC(=O)C12C[C@@H]3C[C@H](C1)CC(c1ccc(C)cc1)(C3)C2 ZINC000011617102 570485136 /nfs/dbraw/zinc/48/51/36/570485136.db2.gz SCLSMFVVQCGLGK-JUJAOGAQSA-N 0 3 367.577 5.524 50 0 FKAAHN Fc1cccc(-c2c[nH]nc2C2CCN(Cc3ccccc3Cl)CC2)c1 ZINC000011789271 570707121 /nfs/dbraw/zinc/70/71/21/570707121.db2.gz XTYMQPAUJPQKOP-UHFFFAOYSA-N 0 3 369.871 5.249 50 0 FKAAHN Cn1cc(CNCc2ccccc2)c(-c2ccc(Oc3ccccc3)cc2)n1 ZINC000011843452 570709809 /nfs/dbraw/zinc/70/98/09/570709809.db2.gz CENNNSPNLGCSJI-UHFFFAOYSA-N 0 3 369.468 5.169 50 0 FKAAHN O=C(CC[C@@H]1CCCN(Cc2ccc(C3CCCCC3)s2)C1)NC1CC1 ZINC000011878920 207326861 /nfs/dbraw/zinc/32/68/61/207326861.db2.gz AHXBDWHZYZBKGX-KRWDZBQOSA-N 0 3 374.594 5.067 50 0 FKAAHN O=C(CC[C@H]1CCCN(Cc2ccc(C3CCCCC3)s2)C1)NC1CC1 ZINC000011878921 570710940 /nfs/dbraw/zinc/71/09/40/570710940.db2.gz AHXBDWHZYZBKGX-QGZVFWFLSA-N 0 3 374.594 5.067 50 0 FKAAHN Cc1ccc(-c2c[nH]nc2[C@@H]2CCCN(Cc3cc4ccccc4[nH]3)C2)cc1 ZINC000011911821 570600326 /nfs/dbraw/zinc/60/03/26/570600326.db2.gz CWBQOLAOYLAVSY-HXUWFJFHSA-N 0 3 370.500 5.246 50 0 FKAAHN Cc1ccc(-c2c[nH]nc2[C@H]2CCCN(Cc3cc4ccccc4[nH]3)C2)cc1 ZINC000011911822 570600204 /nfs/dbraw/zinc/60/02/04/570600204.db2.gz CWBQOLAOYLAVSY-FQEVSTJZSA-N 0 3 370.500 5.246 50 0 FKAAHN Cc1c2cccc(C)c2[nH]c1CN[C@H](C)c1cnn(-c2ccccc2)c1C ZINC000011955230 570713054 /nfs/dbraw/zinc/71/30/54/570713054.db2.gz XKILQMPVQRVTNH-QGZVFWFLSA-N 0 3 358.489 5.130 50 0 FKAAHN Cc1c2cccc(C)c2[nH]c1CN[C@@H](C)c1cnn(-c2ccccc2)c1C ZINC000011955236 570713098 /nfs/dbraw/zinc/71/30/98/570713098.db2.gz XKILQMPVQRVTNH-KRWDZBQOSA-N 0 3 358.489 5.130 50 0 FKAAHN CSc1cccc(CN2CCC(CCC(=O)Nc3ccccc3)CC2)c1 ZINC000012076192 207335609 /nfs/dbraw/zinc/33/56/09/207335609.db2.gz LQWBEJZYPJIAAS-UHFFFAOYSA-N 0 3 368.546 5.039 50 0 FKAAHN Cc1oc(-c2ccoc2)nc1CN1CCCC[C@@H]1CCc1ccccc1 ZINC000012076744 570717116 /nfs/dbraw/zinc/71/71/16/570717116.db2.gz IDHIMKOPSANQIT-HXUWFJFHSA-N 0 3 350.462 5.230 50 0 FKAAHN Cc1oc(-c2ccoc2)nc1CN1CCCC[C@H]1CCc1ccccc1 ZINC000012076745 570717103 /nfs/dbraw/zinc/71/71/03/570717103.db2.gz IDHIMKOPSANQIT-FQEVSTJZSA-N 0 3 350.462 5.230 50 0 FKAAHN Cc1ccc(CN2CCC[C@H](c3n[nH]cc3-c3ccc(Cl)cc3)C2)o1 ZINC000012244018 207351695 /nfs/dbraw/zinc/35/16/95/207351695.db2.gz NNZUWYVTMUFIFP-INIZCTEOSA-N 0 3 355.869 5.011 50 0 FKAAHN Fc1cccc(-c2c[nH]nc2C2CCN(Cc3ccc(Cl)cc3)CC2)c1 ZINC000012246066 570730859 /nfs/dbraw/zinc/73/08/59/570730859.db2.gz LQVFCISQTIKWQN-UHFFFAOYSA-N 0 3 369.871 5.249 50 0 FKAAHN O=C1C(C23CC4CC(CC(C4)C2)C3)CCC1C12CC3CC(CC(C3)C1)C2 ZINC000012363026 207366540 /nfs/dbraw/zinc/36/65/40/207366540.db2.gz WUYQWHVQVHYWPK-KULXHPKPSA-N 0 3 352.562 6.015 50 0 FKAAHN COc1ccc2cc(-c3n[nH]cc3CN[C@@H](C)c3cccs3)ccc2c1 ZINC000012434017 207375410 /nfs/dbraw/zinc/37/54/10/207375410.db2.gz GGFIQYLGYLXJKM-AWEZNQCLSA-N 0 3 363.486 5.151 50 0 FKAAHN COc1ccc2cc(-c3n[nH]cc3CN[C@H](C)c3cccs3)ccc2c1 ZINC000012434018 570744835 /nfs/dbraw/zinc/74/48/35/570744835.db2.gz GGFIQYLGYLXJKM-CQSZACIVSA-N 0 3 363.486 5.151 50 0 FKAAHN Cc1ccc(-c2n[nH]cc2CNCc2scnc2-c2ccccc2)cc1C ZINC000012444421 570746154 /nfs/dbraw/zinc/74/61/54/570746154.db2.gz ZXYOLWHYXQYRGE-UHFFFAOYSA-N 0 3 374.513 5.107 50 0 FKAAHN Cc1ccc(-c2ccccc2CN[C@@H](C)c2cnn(-c3ccccc3)c2C)o1 ZINC000012459157 207381635 /nfs/dbraw/zinc/38/16/35/207381635.db2.gz OYDBGGNDSNPHAG-SFHVURJKSA-N 0 3 371.484 5.600 50 0 FKAAHN C[C@@]1(c2ccncc2)NC[C@@H](c2ccccc2Cl)c2c3ccccc3[nH]c21 ZINC000012549178 571178965 /nfs/dbraw/zinc/17/89/65/571178965.db2.gz BCABKZMHHNPTOY-MBSDFSHPSA-N 0 3 373.887 5.215 50 0 FKAAHN C[C@]1(c2ccncc2)NC[C@@H](c2ccccc2Cl)c2c3ccccc3[nH]c21 ZINC000012549180 571178877 /nfs/dbraw/zinc/17/88/77/571178877.db2.gz BCABKZMHHNPTOY-FDDCHVKYSA-N 0 3 373.887 5.215 50 0 FKAAHN C[C@@]1(c2ccncc2)NC[C@H](c2ccccc2Cl)c2c3ccccc3[nH]c21 ZINC000012549182 571178960 /nfs/dbraw/zinc/17/89/60/571178960.db2.gz BCABKZMHHNPTOY-JPYJTQIMSA-N 0 3 373.887 5.215 50 0 FKAAHN C[C@]1(c2ccncc2)NC[C@H](c2ccccc2Cl)c2c3ccccc3[nH]c21 ZINC000012549184 207392063 /nfs/dbraw/zinc/39/20/63/207392063.db2.gz BCABKZMHHNPTOY-WZONZLPQSA-N 0 3 373.887 5.215 50 0 FKAAHN Cc1c([C@@H](C)NCc2cccc(-c3ccco3)c2)cnn1-c1ccccc1 ZINC000012571754 570750961 /nfs/dbraw/zinc/75/09/61/570750961.db2.gz CLJCRPBTFTUPCP-QGZVFWFLSA-N 0 3 357.457 5.292 50 0 FKAAHN Cc1c([C@H](C)NCc2cccc(-c3ccco3)c2)cnn1-c1ccccc1 ZINC000012571764 220008335 /nfs/dbraw/zinc/00/83/35/220008335.db2.gz CLJCRPBTFTUPCP-KRWDZBQOSA-N 0 3 357.457 5.292 50 0 FKAAHN C[C@H](N[C@@H](c1ccccc1)C1CC1)C(=O)Nc1c(Cl)cccc1Cl ZINC000012676588 220016544 /nfs/dbraw/zinc/01/65/44/220016544.db2.gz KTYUYCLBYJNXIG-SJCJKPOMSA-N 0 3 363.288 5.061 50 0 FKAAHN C[C@@H](N[C@@H](c1ccccc1)C1CC1)C(=O)Nc1c(Cl)cccc1Cl ZINC000012676598 571043910 /nfs/dbraw/zinc/04/39/10/571043910.db2.gz KTYUYCLBYJNXIG-PXAZEXFGSA-N 0 3 363.288 5.061 50 0 FKAAHN C[C@H](N[C@H](c1ccccc1)C1CC1)C(=O)Nc1c(Cl)cccc1Cl ZINC000012676607 206296048 /nfs/dbraw/zinc/29/60/48/206296048.db2.gz KTYUYCLBYJNXIG-YVEFUNNKSA-N 0 3 363.288 5.061 50 0 FKAAHN C[C@@H](N[C@H](c1ccccc1)C1CC1)C(=O)Nc1c(Cl)cccc1Cl ZINC000012676617 220016860 /nfs/dbraw/zinc/01/68/60/220016860.db2.gz KTYUYCLBYJNXIG-SJKOYZFVSA-N 0 3 363.288 5.061 50 0 FKAAHN Cc1cccc(-c2ccc(NC(=O)C3CCN(Cc4ccco4)CC3)cc2)c1 ZINC000012702380 207407625 /nfs/dbraw/zinc/40/76/25/207407625.db2.gz GYIDEUFGJAYGST-UHFFFAOYSA-N 0 3 374.484 5.106 50 0 FKAAHN CC(C)c1cccc(C(C)C)c1NC(=O)c1ccc(CN2CCCC2)cc1 ZINC000012742775 571063854 /nfs/dbraw/zinc/06/38/54/571063854.db2.gz MRKCIUYHZASKEQ-UHFFFAOYSA-N 0 3 364.533 5.782 50 0 FKAAHN Cc1nn(Cc2c(Cl)cccc2Cl)c(C)c1CNCc1ccccc1 ZINC000012743675 571064344 /nfs/dbraw/zinc/06/43/44/571064344.db2.gz HWWCQHNUKZVDTH-UHFFFAOYSA-N 0 3 374.315 5.145 50 0 FKAAHN C[C@@H](N[C@H](c1ccccc1)C1CC1)C(=O)Nc1cccc(Cl)c1Cl ZINC000012812869 571113945 /nfs/dbraw/zinc/11/39/45/571113945.db2.gz SIBDVVOPEBNARG-KZULUSFZSA-N 0 3 363.288 5.061 50 0 FKAAHN C[C@H](N[C@H](c1ccccc1)C1CC1)C(=O)Nc1cccc(Cl)c1Cl ZINC000012812873 571113869 /nfs/dbraw/zinc/11/38/69/571113869.db2.gz SIBDVVOPEBNARG-KPZWWZAWSA-N 0 3 363.288 5.061 50 0 FKAAHN C[C@@H](N[C@@H](c1ccccc1)C1CC1)C(=O)Nc1cccc(Cl)c1Cl ZINC000012812879 220032808 /nfs/dbraw/zinc/03/28/08/220032808.db2.gz SIBDVVOPEBNARG-XIKOKIGWSA-N 0 3 363.288 5.061 50 0 FKAAHN C[C@H](N[C@@H](c1ccccc1)C1CC1)C(=O)Nc1cccc(Cl)c1Cl ZINC000012812884 571113940 /nfs/dbraw/zinc/11/39/40/571113940.db2.gz SIBDVVOPEBNARG-SGTLLEGYSA-N 0 3 363.288 5.061 50 0 FKAAHN CSc1ccc(CN2CCC(CCC(=O)Nc3ccccc3)CC2)cc1 ZINC000012836566 570765275 /nfs/dbraw/zinc/76/52/75/570765275.db2.gz WXTCKBZKPIESDL-UHFFFAOYSA-N 0 3 368.546 5.039 50 0 FKAAHN C[C@@H](N[C@@H](C)c1ccc2ccccc2c1)C(=O)Nc1ccc(Cl)cc1F ZINC000012879028 571137150 /nfs/dbraw/zinc/13/71/50/571137150.db2.gz HVYXWUXWGZGEKC-UONOGXRCSA-N 0 3 370.855 5.310 50 0 FKAAHN C[C@H](N[C@@H](C)c1ccc2ccccc2c1)C(=O)Nc1ccc(Cl)cc1F ZINC000012879035 211002184 /nfs/dbraw/zinc/00/21/84/211002184.db2.gz HVYXWUXWGZGEKC-KBPBESRZSA-N 0 3 370.855 5.310 50 0 FKAAHN C[C@@H](N[C@H](C)c1ccc2ccccc2c1)C(=O)Nc1ccc(Cl)cc1F ZINC000012879043 571137164 /nfs/dbraw/zinc/13/71/64/571137164.db2.gz HVYXWUXWGZGEKC-ZIAGYGMSSA-N 0 3 370.855 5.310 50 0 FKAAHN C[C@@H](N[C@@H](C)C(=O)Nc1ccc(Cl)cc1F)c1ccc2ccccc2c1 ZINC000012879047 211001522 /nfs/dbraw/zinc/00/15/22/211001522.db2.gz HVYXWUXWGZGEKC-KGLIPLIRSA-N 0 3 370.855 5.310 50 0 FKAAHN Cc1ccc(Oc2ccccc2NC(=O)c2ccc(CN(C)C)cc2)cc1 ZINC000012914575 211006346 /nfs/dbraw/zinc/00/63/46/211006346.db2.gz NNUUUWSDOULQKD-UHFFFAOYSA-N 0 3 360.457 5.101 50 0 FKAAHN CC[C@@H](NCC(=O)Nc1ccccc1-c1ccccc1)c1ccc(OC)cc1 ZINC000012930621 220044600 /nfs/dbraw/zinc/04/46/00/220044600.db2.gz IKGGVCWWJOAQFL-JOCHJYFZSA-N 0 3 374.484 5.042 50 0 FKAAHN CC[C@H](NCC(=O)Nc1ccccc1-c1ccccc1)c1ccc(OC)cc1 ZINC000012930624 220043992 /nfs/dbraw/zinc/04/39/92/220043992.db2.gz IKGGVCWWJOAQFL-QFIPXVFZSA-N 0 3 374.484 5.042 50 0 FKAAHN c1cnn(Cc2ccccc2CNCc2cccc(Oc3ccccc3)c2)c1 ZINC000012980759 220048790 /nfs/dbraw/zinc/04/87/90/220048790.db2.gz QPSAPBNERFUETL-UHFFFAOYSA-N 0 3 369.468 5.014 50 0 FKAAHN CCc1cccc(C)c1NC(=O)CN[C@@H](Cc1ccccc1)c1ccccc1 ZINC000013004698 571187885 /nfs/dbraw/zinc/18/78/85/571187885.db2.gz UTPNJQHYHFFWLI-QHCPKHFHSA-N 0 3 372.512 5.070 50 0 FKAAHN CCc1cccc(C)c1NC(=O)CN[C@H](Cc1ccccc1)c1ccccc1 ZINC000013004699 571187898 /nfs/dbraw/zinc/18/78/98/571187898.db2.gz UTPNJQHYHFFWLI-HSZRJFAPSA-N 0 3 372.512 5.070 50 0 FKAAHN CC1(C)[C@H](NCC(=O)N(c2ccccc2)C2CCCCC2)[C@]2(C)CC[C@H]1C2 ZINC000013464302 571308147 /nfs/dbraw/zinc/30/81/47/571308147.db2.gz UESVZIGYWSMKFB-JKFKMHIGSA-N 0 3 368.565 5.157 50 0 FKAAHN C[C@@H]1[C@H](c2ccccc2)N[C@@H](c2ccccc2)C[C@@]1(O)Cc1ccccc1 ZINC000013510966 220070655 /nfs/dbraw/zinc/07/06/55/220070655.db2.gz NDHOPVCXDQDCPC-KXMWUTRISA-N 0 3 357.497 5.072 50 0 FKAAHN CC[C@@H]1[C@H](c2ccccc2)N[C@@H](c2ccccc2)C[C@@]1(O)Cc1ccccc1 ZINC000013513955 220071161 /nfs/dbraw/zinc/07/11/61/220071161.db2.gz KIXGFZRPUASEFM-XPGKHFPBSA-N 0 3 371.524 5.462 50 0 FKAAHN C[C@@H]1[C@H](c2ccccc2)N[C@@H](c2ccccc2)[C@@H](C)C1(O)Cc1ccccc1 ZINC000013552883 220073374 /nfs/dbraw/zinc/07/33/74/220073374.db2.gz YRMXCILLNZAXNX-GQUJEBGOSA-N 0 3 371.524 5.318 50 0 FKAAHN C[C@@H]1[C@H](c2ccccc2)N[C@@H](c2ccccc2)[C@@H](C)C1(O)c1ccccc1 ZINC000013552966 220073546 /nfs/dbraw/zinc/07/35/46/220073546.db2.gz WPGSJVUKSMYCJB-DJEYIWCMSA-N 0 3 357.497 5.232 50 0 FKAAHN CCCCCC[C@]1(O)C[C@H](c2ccccc2)N[C@@H](c2ccccc2)[C@@H]1CC ZINC000013562802 220074622 /nfs/dbraw/zinc/07/46/22/220074622.db2.gz MPYSXPHSCSBUPX-NDBXHCKUSA-N 0 3 365.561 6.190 50 0 FKAAHN CCOc1cccc(CNC2CCCC2)c1OCc1ccc(Cl)cc1 ZINC000013717439 570786378 /nfs/dbraw/zinc/78/63/78/570786378.db2.gz SLJZMMQVLZBBET-UHFFFAOYSA-N 0 3 359.897 5.350 50 0 FKAAHN CCOc1cccc(CNC2CCCC2)c1OCc1ccccc1Cl ZINC000013717442 211052608 /nfs/dbraw/zinc/05/26/08/211052608.db2.gz GNMYQAAUBWUHPF-UHFFFAOYSA-N 0 3 359.897 5.350 50 0 FKAAHN CCNCc1cccc(OCC)c1OCc1ccc(Cl)cc1Cl ZINC000013717521 220089326 /nfs/dbraw/zinc/08/93/26/220089326.db2.gz SBEVVPTXLFYVSA-UHFFFAOYSA-N 0 3 354.277 5.081 50 0 FKAAHN CCCNCc1cccc(OCC)c1OCc1ccc(Cl)cc1Cl ZINC000013717526 220089915 /nfs/dbraw/zinc/08/99/15/220089915.db2.gz BVIIMHYIDXGQMR-UHFFFAOYSA-N 0 3 368.304 5.471 50 0 FKAAHN CCCCCNCc1cccc(OCC)c1OCc1ccc(Cl)cc1 ZINC000013717528 220090007 /nfs/dbraw/zinc/09/00/07/220090007.db2.gz BOQTUWSQRUYYPK-UHFFFAOYSA-N 0 3 361.913 5.598 50 0 FKAAHN CCCCCNCc1cccc(OCC)c1OCc1ccccc1Cl ZINC000013717530 220088960 /nfs/dbraw/zinc/08/89/60/220088960.db2.gz DUYOBIATWMAYMC-UHFFFAOYSA-N 0 3 361.913 5.598 50 0 FKAAHN COc1ccccc1CCNCc1ccc(-c2cccc(Cl)c2C)o1 ZINC000013719176 211052443 /nfs/dbraw/zinc/05/24/43/211052443.db2.gz VBFAXFSZXCBTBP-UHFFFAOYSA-N 0 3 355.865 5.249 50 0 FKAAHN COc1ccccc1CCNCc1ccc(-c2ccc(F)c(Cl)c2)o1 ZINC000013719188 570786475 /nfs/dbraw/zinc/78/64/75/570786475.db2.gz GVKZFXWNAYYUEP-UHFFFAOYSA-N 0 3 359.828 5.080 50 0 FKAAHN COc1ccccc1CCNCc1ccc(-c2ccc(C)c(Cl)c2)o1 ZINC000013719316 211052483 /nfs/dbraw/zinc/05/24/83/211052483.db2.gz NJUSJCBVLQSJOS-UHFFFAOYSA-N 0 3 355.865 5.249 50 0 FKAAHN CCCCOCCCNCc1ccccc1OCc1ccc(Cl)cc1 ZINC000013719483 211052055 /nfs/dbraw/zinc/05/20/55/211052055.db2.gz DWROGUSPIYFMCL-UHFFFAOYSA-N 0 3 361.913 5.215 50 0 FKAAHN CCCCOCCCNCc1ccccc1OCc1ccccc1Cl ZINC000013719487 570786433 /nfs/dbraw/zinc/78/64/33/570786433.db2.gz VRGMSCBXTBDESG-UHFFFAOYSA-N 0 3 361.913 5.215 50 0 FKAAHN CCCCOCCCNCc1cc(Cl)ccc1OCc1ccccc1 ZINC000013719776 211051266 /nfs/dbraw/zinc/05/12/66/211051266.db2.gz PSEAYOPGRJQFHF-UHFFFAOYSA-N 0 3 361.913 5.215 50 0 FKAAHN CCCCOCCCNCc1ccc(-c2cc(Cl)ccc2Cl)o1 ZINC000013719997 570786496 /nfs/dbraw/zinc/78/64/96/570786496.db2.gz DMPCZTOYSKKAKP-UHFFFAOYSA-N 0 3 356.293 5.550 50 0 FKAAHN CCCCOCCCNCc1ccc(-c2cc(Cl)cc(Cl)c2)o1 ZINC000013720005 220089704 /nfs/dbraw/zinc/08/97/04/220089704.db2.gz QDSJWTIPRUTLBM-UHFFFAOYSA-N 0 3 356.293 5.550 50 0 FKAAHN CCCCOCCCNCc1ccc(-c2ccc(Br)cc2)o1 ZINC000013720011 211052666 /nfs/dbraw/zinc/05/26/66/211052666.db2.gz QBBCAGXQBXJSGI-UHFFFAOYSA-N 0 3 366.299 5.006 50 0 FKAAHN CCCCOCCCNCc1ccc(-c2ccc(Cl)cc2Cl)o1 ZINC000013720020 570786411 /nfs/dbraw/zinc/78/64/11/570786411.db2.gz VRRXLXANXPUQLN-UHFFFAOYSA-N 0 3 356.293 5.550 50 0 FKAAHN CCCCOCCCNCc1ccc(-c2cccc(C(F)(F)F)c2)o1 ZINC000013720130 570786419 /nfs/dbraw/zinc/78/64/19/570786419.db2.gz SXDKDJYREOVKLT-UHFFFAOYSA-N 0 3 355.400 5.262 50 0 FKAAHN Clc1ccc(CCNCc2ccccc2OCc2ccccc2)cc1 ZINC000013720892 570838630 /nfs/dbraw/zinc/83/86/30/570838630.db2.gz DHVTYGWNOJOFAK-UHFFFAOYSA-N 0 3 351.877 5.251 50 0 FKAAHN Fc1ccc(COc2ccccc2CNCCc2ccc(Cl)cc2)cc1 ZINC000013720983 570786797 /nfs/dbraw/zinc/78/67/97/570786797.db2.gz GNEGIKLYXNNQMB-UHFFFAOYSA-N 0 3 369.867 5.390 50 0 FKAAHN Fc1ccccc1COc1ccccc1CNCCc1ccc(Cl)cc1 ZINC000013720988 220089929 /nfs/dbraw/zinc/08/99/29/220089929.db2.gz PBSPWTYXTJMYDJ-UHFFFAOYSA-N 0 3 369.867 5.390 50 0 FKAAHN CCOc1c(Cl)cc(Cl)cc1CNCCc1ccc(Cl)cc1 ZINC000013721268 570786756 /nfs/dbraw/zinc/78/67/56/570786756.db2.gz ACJRDTVRPOTLOU-UHFFFAOYSA-N 0 3 358.696 5.378 50 0 FKAAHN Cc1c(Cl)cccc1-c1ccc(CNCCc2ccc(Cl)cc2)o1 ZINC000013721338 570786869 /nfs/dbraw/zinc/78/68/69/570786869.db2.gz JMARMIBNWDBFMT-UHFFFAOYSA-N 0 3 360.284 5.894 50 0 FKAAHN Fc1ccc(-c2ccc(CNCCc3ccc(Cl)cc3)o2)cc1Cl ZINC000013721347 220089637 /nfs/dbraw/zinc/08/96/37/220089637.db2.gz ZPQKQPCFJZCACQ-UHFFFAOYSA-N 0 3 364.247 5.725 50 0 FKAAHN Cc1ccc(COc2ccccc2CNCCc2ccc(Cl)cc2)cc1 ZINC000013721373 211051308 /nfs/dbraw/zinc/05/13/08/211051308.db2.gz QCXBMCCSDYOEFP-UHFFFAOYSA-N 0 3 365.904 5.560 50 0 FKAAHN Cc1ccc(-c2ccc(CNCCc3ccc(Cl)cc3)o2)cc1Cl ZINC000013721439 207480000 /nfs/dbraw/zinc/48/00/00/207480000.db2.gz VZMRTNDZBKXSHO-UHFFFAOYSA-N 0 3 360.284 5.894 50 0 FKAAHN Cc1ccc(COc2ccc(Cl)cc2CNCCCOC(C)C)cc1 ZINC000013722046 570786784 /nfs/dbraw/zinc/78/67/84/570786784.db2.gz MNBVTDORMFVMFQ-UHFFFAOYSA-N 0 3 361.913 5.132 50 0 FKAAHN COCCCNCc1cc(Cl)cc(Cl)c1OCc1ccc(C)cc1 ZINC000013722582 570786802 /nfs/dbraw/zinc/78/68/02/570786802.db2.gz UYDNQPMUZRDLTG-UHFFFAOYSA-N 0 3 368.304 5.007 50 0 FKAAHN CCOc1ccc(Cl)cc1CNCCc1ccc(Cl)cc1Cl ZINC000013723010 570786791 /nfs/dbraw/zinc/78/67/91/570786791.db2.gz ZXFLDHLCTVLMLS-UHFFFAOYSA-N 0 3 358.696 5.378 50 0 FKAAHN Fc1ccccc1-c1ccc(CNCCc2ccc(Cl)cc2Cl)o1 ZINC000013723140 220089773 /nfs/dbraw/zinc/08/97/73/220089773.db2.gz MWPWQGUZZDDBBH-UHFFFAOYSA-N 0 3 364.247 5.725 50 0 FKAAHN Fc1ccc(-c2ccc(CNCCc3ccc(Cl)cc3Cl)o2)cc1 ZINC000013723143 570838598 /nfs/dbraw/zinc/83/85/98/570838598.db2.gz MVMVMUDDFOOQCS-UHFFFAOYSA-N 0 3 364.247 5.725 50 0 FKAAHN Clc1ccc(COc2ccccc2CNCCC2=CCCCC2)cc1 ZINC000013723435 570787131 /nfs/dbraw/zinc/78/71/31/570787131.db2.gz ZMEKHAVXPKTJBU-UHFFFAOYSA-N 0 3 355.909 5.899 50 0 FKAAHN Clc1ccccc1COc1ccccc1CNCCC1=CCCCC1 ZINC000013723438 211052473 /nfs/dbraw/zinc/05/24/73/211052473.db2.gz AWGIESAQHRKJRS-UHFFFAOYSA-N 0 3 355.909 5.899 50 0 FKAAHN COc1cccc(CNCCC2=CCCCC2)c1OCc1ccccc1 ZINC000013723490 211051419 /nfs/dbraw/zinc/05/14/19/211051419.db2.gz BUIRMPOEJBPJGI-UHFFFAOYSA-N 0 3 351.490 5.254 50 0 FKAAHN COc1cccc(CNCCC2=CCCCC2)c1OCc1ccccc1F ZINC000013723543 211052343 /nfs/dbraw/zinc/05/23/43/211052343.db2.gz XATNCOHDSQNDIT-UHFFFAOYSA-N 0 3 369.480 5.393 50 0 FKAAHN COc1cccc(CNCCC2=CCCCC2)c1OCc1ccc(F)cc1 ZINC000013723547 211052642 /nfs/dbraw/zinc/05/26/42/211052642.db2.gz URGKZIVVHLWOMI-UHFFFAOYSA-N 0 3 369.480 5.393 50 0 FKAAHN Clc1ccc(OCc2ccccc2)c(CNCCC2=CCCCC2)c1 ZINC000013723679 570787191 /nfs/dbraw/zinc/78/71/91/570787191.db2.gz ARPLFKLAZGPVOS-UHFFFAOYSA-N 0 3 355.909 5.899 50 0 FKAAHN Fc1ccc(COc2ccc(Cl)cc2CNCCC2=CCCCC2)cc1 ZINC000013723692 211053170 /nfs/dbraw/zinc/05/31/70/211053170.db2.gz FETFHKYTVUWUEI-UHFFFAOYSA-N 0 3 373.899 6.038 50 0 FKAAHN Fc1ccccc1COc1ccc(Cl)cc1CNCCC1=CCCCC1 ZINC000013723695 570787260 /nfs/dbraw/zinc/78/72/60/570787260.db2.gz INXOIOHCEAUZEO-UHFFFAOYSA-N 0 3 373.899 6.038 50 0 FKAAHN Clc1ccc(Cl)c(-c2ccc(CNCCC3=CCCCC3)o2)c1 ZINC000013723853 211053092 /nfs/dbraw/zinc/05/30/92/211053092.db2.gz JAJZTFZSWICJRU-UHFFFAOYSA-N 0 3 350.289 6.234 50 0 FKAAHN Clc1cc(Cl)cc(-c2ccc(CNCCC3=CCCCC3)o2)c1 ZINC000013723859 570787159 /nfs/dbraw/zinc/78/71/59/570787159.db2.gz QPZNOKLFFINMCB-UHFFFAOYSA-N 0 3 350.289 6.234 50 0 FKAAHN Brc1ccc(-c2ccc(CNCCC3=CCCCC3)o2)cc1 ZINC000013723865 570787213 /nfs/dbraw/zinc/78/72/13/570787213.db2.gz ZRQJWLOOEXYVHR-UHFFFAOYSA-N 0 3 360.295 5.689 50 0 FKAAHN Clc1ccc(-c2ccc(CNCCC3=CCCCC3)o2)c(Cl)c1 ZINC000013723875 570787200 /nfs/dbraw/zinc/78/72/00/570787200.db2.gz DQRZOCQYYJAFQQ-UHFFFAOYSA-N 0 3 350.289 6.234 50 0 FKAAHN CCOc1cccc(CNCCC2=CCCCC2)c1OCc1ccccc1 ZINC000013723881 220089623 /nfs/dbraw/zinc/08/96/23/220089623.db2.gz SWDFNWZEVBZBAN-UHFFFAOYSA-N 0 3 365.517 5.644 50 0 FKAAHN COc1cccc(CNCCC2=CCCCC2)c1OCc1ccc(C)cc1 ZINC000013723921 220089013 /nfs/dbraw/zinc/08/90/13/220089013.db2.gz DESQQRSHLVGOAY-UHFFFAOYSA-N 0 3 365.517 5.563 50 0 FKAAHN Cc1ccc(COc2ccc(Cl)cc2CNCCC2=CCCCC2)cc1 ZINC000013723951 570787165 /nfs/dbraw/zinc/78/71/65/570787165.db2.gz MINBBOBMWUQSIV-UHFFFAOYSA-N 0 3 369.936 6.208 50 0 FKAAHN Cc1cc(-c2ccc(CNCCC3=CCCCC3)o2)ccc1Br ZINC000013723957 220089464 /nfs/dbraw/zinc/08/94/64/220089464.db2.gz XVHZOMFVYIQBRB-UHFFFAOYSA-N 0 3 374.322 5.998 50 0 FKAAHN Cc1cc(Br)ccc1-c1ccc(CNCCC2=CCCCC2)o1 ZINC000013723960 207480218 /nfs/dbraw/zinc/48/02/18/207480218.db2.gz GKQYUCPFPBTBAB-UHFFFAOYSA-N 0 3 374.322 5.998 50 0 FKAAHN CC(C)CCNCc1cc(Br)ccc1OCc1ccccc1 ZINC000013724186 570787232 /nfs/dbraw/zinc/78/72/32/570787232.db2.gz YBGPFLUHHVUWBN-UHFFFAOYSA-N 0 3 362.311 5.164 50 0 FKAAHN CC(C)CCNCc1cc(Cl)ccc1OCc1ccc(Cl)cc1 ZINC000013724283 570787177 /nfs/dbraw/zinc/78/71/77/570787177.db2.gz YOJWJEVEEZIVGO-UHFFFAOYSA-N 0 3 352.305 5.708 50 0 FKAAHN CC(C)CCNCc1cc(Cl)ccc1OCc1ccccc1Cl ZINC000013724286 570787180 /nfs/dbraw/zinc/78/71/80/570787180.db2.gz KSTYBHITYHZKLH-UHFFFAOYSA-N 0 3 352.305 5.708 50 0 FKAAHN Cc1ccc(COc2c(Cl)cc(Cl)cc2CNCCC(C)C)cc1 ZINC000013724449 570787241 /nfs/dbraw/zinc/78/72/41/570787241.db2.gz LMFKNDYBDQKXJW-UHFFFAOYSA-N 0 3 366.332 6.017 50 0 FKAAHN CC(C)CCNCc1ccc(-c2ccc(Br)cc2Cl)o1 ZINC000013724476 570787138 /nfs/dbraw/zinc/78/71/38/570787138.db2.gz UWGIFUCEGWLYNW-UHFFFAOYSA-N 0 3 356.691 5.498 50 0 FKAAHN COc1cccc(CNCCC(C)C)c1OCc1ccc(F)cc1Cl ZINC000013724486 220089644 /nfs/dbraw/zinc/08/96/44/220089644.db2.gz JZCYBXAQDJHTQP-UHFFFAOYSA-N 0 3 365.876 5.202 50 0 FKAAHN CCOc1cccc(CNCCC(C)C)c1OCc1ccccc1Cl ZINC000013724552 570787182 /nfs/dbraw/zinc/78/71/82/570787182.db2.gz YKMCONLXGUIILR-UHFFFAOYSA-N 0 3 361.913 5.453 50 0 FKAAHN CCOc1cccc(CNCCC(C)C)c1OCc1ccc(Cl)cc1 ZINC000013724560 211053702 /nfs/dbraw/zinc/05/37/02/211053702.db2.gz QBWLSWNXJARXNY-UHFFFAOYSA-N 0 3 361.913 5.453 50 0 FKAAHN CCC(C)(C)NCc1cc(Cl)ccc1OCc1ccc(Cl)cc1 ZINC000013724818 220091220 /nfs/dbraw/zinc/09/12/20/220091220.db2.gz AOJVZRPUXWAHGR-UHFFFAOYSA-N 0 3 352.305 5.851 50 0 FKAAHN CCC(C)(C)NCc1cc(Cl)ccc1OCc1ccccc1Cl ZINC000013724822 570787175 /nfs/dbraw/zinc/78/71/75/570787175.db2.gz SEKXVDOAWGZZGT-UHFFFAOYSA-N 0 3 352.305 5.851 50 0 FKAAHN CCC(C)(C)NCc1cc(Cl)cc(Cl)c1OCc1ccc(C)cc1 ZINC000013725044 570787701 /nfs/dbraw/zinc/78/77/01/570787701.db2.gz MCOSXZJUWDEOOU-UHFFFAOYSA-N 0 3 366.332 6.159 50 0 FKAAHN CCOc1c(Cl)cc(Cl)cc1CN[C@@H](C)CCc1ccccc1 ZINC000013726206 211054431 /nfs/dbraw/zinc/05/44/31/211054431.db2.gz LHLYDPHBCNKWAM-AWEZNQCLSA-N 0 3 352.305 5.503 50 0 FKAAHN CCOc1c(Cl)cc(Cl)cc1CN[C@H](C)CCc1ccccc1 ZINC000013726210 570787682 /nfs/dbraw/zinc/78/76/82/570787682.db2.gz LHLYDPHBCNKWAM-CQSZACIVSA-N 0 3 352.305 5.503 50 0 FKAAHN CCCCCCNCc1cccc(OCC)c1OCc1ccccc1F ZINC000013729948 570788264 /nfs/dbraw/zinc/78/82/64/570788264.db2.gz XXFKLNBQRGOVAH-UHFFFAOYSA-N 0 3 359.485 5.473 50 0 FKAAHN CCOc1cccc(CNC2CC2)c1OCc1ccc(Cl)cc1Cl ZINC000013730115 206305985 /nfs/dbraw/zinc/30/59/85/206305985.db2.gz CYGXXQWHNYSSMM-UHFFFAOYSA-N 0 3 366.288 5.223 50 0 FKAAHN CCOc1cccc(CNC(C)C)c1OCc1ccc(Cl)cc1Cl ZINC000013730149 220090825 /nfs/dbraw/zinc/09/08/25/220090825.db2.gz SCXMUCKTCAENFV-UHFFFAOYSA-N 0 3 368.304 5.469 50 0 FKAAHN O[C@]12CCCC[C@@H]1[C@@H](c1ccc(F)cc1)N(C/C=C/c1ccccc1)CC2 ZINC000013769940 571097521 /nfs/dbraw/zinc/09/75/21/571097521.db2.gz WJIDANGHKXCJLA-TUZBMEMXSA-N 0 3 365.492 5.207 50 0 FKAAHN O[C@]12CCCC[C@H]1[C@@H](c1ccc(F)cc1)N(C/C=C/c1ccccc1)CC2 ZINC000013769944 220093733 /nfs/dbraw/zinc/09/37/33/220093733.db2.gz WJIDANGHKXCJLA-JXOCAGRKSA-N 0 3 365.492 5.207 50 0 FKAAHN CCCCN1C(=O)C2=C(CCCC2)[C@@H]1NC1CCCCCCCCCCC1 ZINC000013896007 570795317 /nfs/dbraw/zinc/79/53/17/570795317.db2.gz OMJTVXLIJOZBKW-HSZRJFAPSA-N 0 3 374.613 6.088 50 0 FKAAHN CCCCN1C(=O)C2=C(CCCC2)[C@H]1NC1CCCCCCCCCCC1 ZINC000013896011 570795293 /nfs/dbraw/zinc/79/52/93/570795293.db2.gz OMJTVXLIJOZBKW-QHCPKHFHSA-N 0 3 374.613 6.088 50 0 FKAAHN O=C(CN[C@@H]1CCCc2ccccc21)Nc1ccccc1Oc1ccccc1 ZINC000014123946 220108951 /nfs/dbraw/zinc/10/89/51/220108951.db2.gz OROZGAJYFXQCSG-OAQYLSRUSA-N 0 3 372.468 5.085 50 0 FKAAHN O=C(CN[C@H]1CCCc2ccccc21)Nc1ccccc1Oc1ccccc1 ZINC000014123949 211075182 /nfs/dbraw/zinc/07/51/82/211075182.db2.gz OROZGAJYFXQCSG-NRFANRHFSA-N 0 3 372.468 5.085 50 0 FKAAHN Cc1oc(-c2ccc(F)cc2)nc1CN1CCC2(C=Cc3ccccc32)CC1 ZINC000014961181 204592603 /nfs/dbraw/zinc/59/26/03/204592603.db2.gz FLXJNTJGTZGNDQ-UHFFFAOYSA-N 0 3 374.459 5.350 50 0 FKAAHN Cc1ccc(CN[C@H](C)c2cnn(-c3cccc4ccccc43)c2C)s1 ZINC000014974450 570827433 /nfs/dbraw/zinc/82/74/33/570827433.db2.gz RVYHSEAQLOZMCE-MRXNPFEDSA-N 0 3 361.514 5.555 50 0 FKAAHN Cc1ccc(CN[C@@H](C)c2cnn(-c3cccc4ccccc43)c2C)s1 ZINC000014974453 220138354 /nfs/dbraw/zinc/13/83/54/220138354.db2.gz RVYHSEAQLOZMCE-INIZCTEOSA-N 0 3 361.514 5.555 50 0 FKAAHN Cc1cccc(-c2c[nH]nc2[C@@H]2CCCN(Cc3ccc(F)c(F)c3)C2)c1 ZINC000014988554 220140160 /nfs/dbraw/zinc/14/01/60/220140160.db2.gz AZARSCZBJRFUPZ-GOSISDBHSA-N 0 3 367.443 5.043 50 0 FKAAHN Cc1cccc(-c2c[nH]nc2[C@H]2CCCN(Cc3ccc(F)c(F)c3)C2)c1 ZINC000014988557 570828104 /nfs/dbraw/zinc/82/81/04/570828104.db2.gz AZARSCZBJRFUPZ-SFHVURJKSA-N 0 3 367.443 5.043 50 0 FKAAHN Cc1cccc2cc(CNCc3ccc(F)cc3)c(-c3cccs3)nc12 ZINC000014995852 570828313 /nfs/dbraw/zinc/82/83/13/570828313.db2.gz HEVLFPIVIPZPEZ-UHFFFAOYSA-N 0 3 362.473 5.701 50 0 FKAAHN CC(C)=CCC[C@@H](C)CN1CCOc2c(O)cc(-c3cccnc3)cc2C1 ZINC000014996934 220140066 /nfs/dbraw/zinc/14/00/66/220140066.db2.gz NBEVJNPUGAFVMG-GOSISDBHSA-N 0 3 366.505 5.031 50 0 FKAAHN Cc1oc(-c2ccc(C(F)(F)F)cc2)nc1CN(C)C(C1CC1)C1CC1 ZINC000015067271 570831077 /nfs/dbraw/zinc/83/10/77/570831077.db2.gz WPZUIUXWXREDEY-UHFFFAOYSA-N 0 3 364.411 5.289 50 0 FKAAHN CN(C)Cc1ccc(CNc2ncnc3scc(-c4ccccc4)c32)cc1 ZINC000015513611 521907827 /nfs/dbraw/zinc/90/78/27/521907827.db2.gz FBTQMOIRDPGPEI-UHFFFAOYSA-N 0 3 374.513 5.032 50 0 FKAAHN Fc1ccc(-c2nn(-c3ccccc3)cc2CNCc2ccsc2)cc1 ZINC000015581272 211133031 /nfs/dbraw/zinc/13/30/31/211133031.db2.gz CSXVAFNOYHXRHV-UHFFFAOYSA-N 0 3 363.461 5.030 50 0 FKAAHN C[C@@H]1[C@H](c2ccc(Cl)cc2)N[C@@H](c2ccc(Cl)cc2)[C@@H](C)C1(C)O ZINC000015722836 211136963 /nfs/dbraw/zinc/13/69/63/211136963.db2.gz CBNTXTSZXBMDJP-YTFOQLDISA-N 0 3 364.316 5.402 50 0 FKAAHN CCOc1cc(CN2CCC[C@@H]2c2ccc(OC)cc2)ccc1OC(C)C ZINC000015836915 220167481 /nfs/dbraw/zinc/16/74/81/220167481.db2.gz AWJBXLZNLZEOSV-OAQYLSRUSA-N 0 3 369.505 5.218 50 0 FKAAHN CCOc1cc(CN2CCC[C@H]2c2ccc(OC)cc2)ccc1OC(C)C ZINC000015836917 571134793 /nfs/dbraw/zinc/13/47/93/571134793.db2.gz AWJBXLZNLZEOSV-NRFANRHFSA-N 0 3 369.505 5.218 50 0 FKAAHN CCCOc1ccc(CN2CCC[C@@H]2c2ccc(OC)cc2)cc1OCC ZINC000015836920 220167717 /nfs/dbraw/zinc/16/77/17/220167717.db2.gz VCVMZTITLRRQHO-OAQYLSRUSA-N 0 3 369.505 5.220 50 0 FKAAHN CCCOc1ccc(CN2CCC[C@H]2c2ccc(OC)cc2)cc1OCC ZINC000015836922 571134736 /nfs/dbraw/zinc/13/47/36/571134736.db2.gz VCVMZTITLRRQHO-NRFANRHFSA-N 0 3 369.505 5.220 50 0 FKAAHN COc1ccc([C@@H]2CCCN2Cc2ccc(OCC(C)C)c(OC)c2)cc1 ZINC000015836969 571134741 /nfs/dbraw/zinc/13/47/41/571134741.db2.gz VSJCUNWWGNQEOW-NRFANRHFSA-N 0 3 369.505 5.076 50 0 FKAAHN COc1ccc([C@H]2CCCN2Cc2ccc(OCC(C)C)c(OC)c2)cc1 ZINC000015836973 220167249 /nfs/dbraw/zinc/16/72/49/220167249.db2.gz VSJCUNWWGNQEOW-OAQYLSRUSA-N 0 3 369.505 5.076 50 0 FKAAHN CCCN(Cc1ccc(Cl)cc1)Cc1cc(=O)c2c(C)cc(C)cc2[nH]1 ZINC000015862289 571138556 /nfs/dbraw/zinc/13/85/56/571138556.db2.gz SDJCWUDSGPKXLB-UHFFFAOYSA-N 0 3 368.908 5.211 50 0 FKAAHN CCCN(Cc1ccc(Cl)cc1)Cc1cc(=O)c2c(C)ccc(C)c2[nH]1 ZINC000015862290 220169830 /nfs/dbraw/zinc/16/98/30/220169830.db2.gz MLRHYUUQIQVRNU-UHFFFAOYSA-N 0 3 368.908 5.211 50 0 FKAAHN CCCN(Cc1ccc(Cl)cc1)Cc1cc(=O)c2cccc(F)c2[nH]1 ZINC000015862291 211147399 /nfs/dbraw/zinc/14/73/99/211147399.db2.gz XZEALPJYXSHODW-UHFFFAOYSA-N 0 3 358.844 5.145 50 0 FKAAHN Cc1ccc2[nH]c(CN(Cc3ccc(Cl)cc3)CC(C)C)cc(=O)c2c1 ZINC000015862293 571138469 /nfs/dbraw/zinc/13/84/69/571138469.db2.gz WNFRVLSSJRKXIC-UHFFFAOYSA-N 0 3 368.908 5.148 50 0 FKAAHN Cc1ccc(CN(Cc2cc(=O)c3cc(C)cc(C)c3[nH]2)CC(C)C)cc1 ZINC000015862310 211147253 /nfs/dbraw/zinc/14/72/53/211147253.db2.gz ZPAANFQBRREVRU-UHFFFAOYSA-N 0 3 362.517 5.112 50 0 FKAAHN Cc1ccc(CN(Cc2cc(=O)c3c(C)ccc(C)c3[nH]2)CC(C)C)cc1 ZINC000015862312 571138397 /nfs/dbraw/zinc/13/83/97/571138397.db2.gz BKCOIMORAPCPNZ-UHFFFAOYSA-N 0 3 362.517 5.112 50 0 FKAAHN CCc1c(C)sc2c1CCN(Cc1ccc(C)cc1)[C@@H]2c1ccccc1 ZINC000015864865 211147230 /nfs/dbraw/zinc/14/72/30/211147230.db2.gz AMHLNEOJOIXMSV-HSZRJFAPSA-N 0 3 361.554 6.075 50 0 FKAAHN CCc1c(C)sc2c1CCN(Cc1ccc(C)cc1)[C@H]2c1ccccc1 ZINC000015864866 220169863 /nfs/dbraw/zinc/16/98/63/220169863.db2.gz AMHLNEOJOIXMSV-QHCPKHFHSA-N 0 3 361.554 6.075 50 0 FKAAHN C=Cc1ccc(CN2CCc3c(CC)c(C)sc3[C@H]2c2ccccc2)cc1 ZINC000015864875 211148078 /nfs/dbraw/zinc/14/80/78/211148078.db2.gz YNWXCISGUIHPKJ-XMMPIXPASA-N 0 3 373.565 6.410 50 0 FKAAHN C=Cc1ccc(CN2CCc3c(CC)c(C)sc3[C@@H]2c2ccccc2)cc1 ZINC000015864876 571139577 /nfs/dbraw/zinc/13/95/77/571139577.db2.gz YNWXCISGUIHPKJ-DEOSSOPVSA-N 0 3 373.565 6.410 50 0 FKAAHN Cc1ccc(C)c([C@@H](C)NCC(=O)N(Cc2ccco2)C2=CCCCC2)c1 ZINC000016047191 220176235 /nfs/dbraw/zinc/17/62/35/220176235.db2.gz SWADNKLAHFBLDN-LJQANCHMSA-N 0 3 366.505 5.034 50 0 FKAAHN Cc1ccc(C)c([C@H](C)NCC(=O)N(Cc2ccco2)C2=CCCCC2)c1 ZINC000016047192 571152485 /nfs/dbraw/zinc/15/24/85/571152485.db2.gz SWADNKLAHFBLDN-IBGZPJMESA-N 0 3 366.505 5.034 50 0 FKAAHN COc1cc(CN[C@@H](C)c2ccccc2)ccc1OCc1cccc(C)c1 ZINC000016349253 211159062 /nfs/dbraw/zinc/15/90/62/211159062.db2.gz GPXJCRMAGMBTHC-IBGZPJMESA-N 0 3 361.485 5.433 50 0 FKAAHN COc1cc(CN[C@H](C)c2ccccc2)ccc1OCc1cccc(C)c1 ZINC000016349257 220183806 /nfs/dbraw/zinc/18/38/06/220183806.db2.gz GPXJCRMAGMBTHC-LJQANCHMSA-N 0 3 361.485 5.433 50 0 FKAAHN COc1cc(CNCc2ccc(F)cc2)ccc1OCc1cccc(C)c1 ZINC000016349357 220184312 /nfs/dbraw/zinc/18/43/12/220184312.db2.gz QNRRQODDGJBBOU-UHFFFAOYSA-N 0 3 365.448 5.012 50 0 FKAAHN COc1cc(CN[C@@H](C)c2ccccc2)ccc1OCc1ccccc1C ZINC000016362733 211158197 /nfs/dbraw/zinc/15/81/97/211158197.db2.gz OAHQINOFZUCMMA-IBGZPJMESA-N 0 3 361.485 5.433 50 0 FKAAHN COc1cc(CN[C@H](C)c2ccccc2)ccc1OCc1ccccc1C ZINC000016362735 570855398 /nfs/dbraw/zinc/85/53/98/570855398.db2.gz OAHQINOFZUCMMA-LJQANCHMSA-N 0 3 361.485 5.433 50 0 FKAAHN COc1cc(CNCc2ccc(F)cc2)ccc1OCc1ccccc1C ZINC000016362794 211158703 /nfs/dbraw/zinc/15/87/03/211158703.db2.gz WANNBAHUIGVVRW-UHFFFAOYSA-N 0 3 365.448 5.012 50 0 FKAAHN Clc1ccc(COc2ccc(Cl)cc2CNC2CC2)c(Cl)c1 ZINC000016384975 220184459 /nfs/dbraw/zinc/18/44/59/220184459.db2.gz MCPKJYYRQQIEJB-UHFFFAOYSA-N 0 3 356.680 5.478 50 0 FKAAHN Fc1ccc(CNCc2cccc(OCc3ccc(Cl)cc3)c2)cc1 ZINC000016399557 220184048 /nfs/dbraw/zinc/18/40/48/220184048.db2.gz CHMYGOKWFLDVHL-UHFFFAOYSA-N 0 3 355.840 5.348 50 0 FKAAHN Fc1ccc(CNCc2ccc(OCc3ccc(Cl)cc3)cc2)cc1 ZINC000016401621 570855678 /nfs/dbraw/zinc/85/56/78/570855678.db2.gz HZRWIOOHLJKMHN-UHFFFAOYSA-N 0 3 355.840 5.348 50 0 FKAAHN Fc1ccccc1CCNCc1ccccc1OCc1ccc(Cl)cc1 ZINC000016449559 211161381 /nfs/dbraw/zinc/16/13/81/211161381.db2.gz ACFFBLBHZQFPIB-UHFFFAOYSA-N 0 3 369.867 5.390 50 0 FKAAHN Fc1ccccc1CCNCc1ccccc1OCc1ccccc1Cl ZINC000016449564 220185093 /nfs/dbraw/zinc/18/50/93/220185093.db2.gz ZDAOSRVWWSFZJA-UHFFFAOYSA-N 0 3 369.867 5.390 50 0 FKAAHN Fc1ccc(CCNCc2ccccc2OCc2ccc(Cl)cc2)cc1 ZINC000016449690 220185191 /nfs/dbraw/zinc/18/51/91/220185191.db2.gz CIFUNCVUSLZHCD-UHFFFAOYSA-N 0 3 369.867 5.390 50 0 FKAAHN Fc1ccc(CCNCc2ccccc2OCc2ccccc2Cl)cc1 ZINC000016449695 570856311 /nfs/dbraw/zinc/85/63/11/570856311.db2.gz ZFJKYFALGRMOKL-UHFFFAOYSA-N 0 3 369.867 5.390 50 0 FKAAHN Fc1ccc(CNCc2ccc(OCc3ccccc3Cl)cc2)cc1 ZINC000016449887 570856762 /nfs/dbraw/zinc/85/67/62/570856762.db2.gz KDLPJMMZJDGQKF-UHFFFAOYSA-N 0 3 355.840 5.348 50 0 FKAAHN Fc1ccc(CNCc2cccc(OCc3ccccc3Cl)c2)cc1 ZINC000016450074 211161299 /nfs/dbraw/zinc/16/12/99/211161299.db2.gz KGAVGKSDGWBRFP-UHFFFAOYSA-N 0 3 355.840 5.348 50 0 FKAAHN Fc1ccc(COc2ccc(Cl)cc2CNCCc2ccccc2)cc1 ZINC000016479326 570857212 /nfs/dbraw/zinc/85/72/12/570857212.db2.gz MAAFGYXSUPCNPJ-UHFFFAOYSA-N 0 3 369.867 5.390 50 0 FKAAHN Clc1ccc(OCc2ccccc2)c(CNCCc2ccccc2)c1 ZINC000016479337 570857110 /nfs/dbraw/zinc/85/71/10/570857110.db2.gz IGIVFTZPGAOPNX-UHFFFAOYSA-N 0 3 351.877 5.251 50 0 FKAAHN Fc1ccccc1COc1ccc(Cl)cc1CNCCc1ccccc1 ZINC000016479349 570857199 /nfs/dbraw/zinc/85/71/99/570857199.db2.gz OMSSIDFBBNAFKV-UHFFFAOYSA-N 0 3 369.867 5.390 50 0 FKAAHN Clc1ccc(COc2ccccc2CNCCc2ccccc2)cc1 ZINC000016479393 570856977 /nfs/dbraw/zinc/85/69/77/570856977.db2.gz CQPWGLACNBMCRE-UHFFFAOYSA-N 0 3 351.877 5.251 50 0 FKAAHN Clc1ccccc1COc1ccccc1CNCCc1ccccc1 ZINC000016479405 211162012 /nfs/dbraw/zinc/16/20/12/211162012.db2.gz IEHAAPZXCVTCPE-UHFFFAOYSA-N 0 3 351.877 5.251 50 0 FKAAHN Fc1ccc(COc2ccc3ccccc3c2CNCc2ccccc2)cc1 ZINC000016480085 570857056 /nfs/dbraw/zinc/85/70/56/570857056.db2.gz KEAWWWJZUKNFFE-UHFFFAOYSA-N 0 3 371.455 5.848 50 0 FKAAHN c1ccc(CNCc2c(OCc3ccccc3)ccc3ccccc32)cc1 ZINC000016480090 211160432 /nfs/dbraw/zinc/16/04/32/211160432.db2.gz WXZQUBYDSAQIMZ-UHFFFAOYSA-N 0 3 353.465 5.709 50 0 FKAAHN Fc1ccccc1COc1ccc2ccccc2c1CNCc1ccccc1 ZINC000016480096 211161587 /nfs/dbraw/zinc/16/15/87/211161587.db2.gz CWUHRQXXBXOLMW-UHFFFAOYSA-N 0 3 371.455 5.848 50 0 FKAAHN Clc1ccc(COc2ccc(CNCc3ccccc3)cc2)c(Cl)c1 ZINC000016480120 220185826 /nfs/dbraw/zinc/18/58/26/220185826.db2.gz HAQJONIFNYLPTK-UHFFFAOYSA-N 0 3 372.295 5.862 50 0 FKAAHN Clc1ccc(COc2cccc(CNCc3ccccc3)c2)c(Cl)c1 ZINC000016480134 570857066 /nfs/dbraw/zinc/85/70/66/570857066.db2.gz FTKSYBZMBRKKJD-UHFFFAOYSA-N 0 3 372.295 5.862 50 0 FKAAHN Fc1ccc(CCNCc2cc(Cl)ccc2OCc2ccccc2)cc1 ZINC000016480547 570857204 /nfs/dbraw/zinc/85/72/04/570857204.db2.gz ULUMSUVFNWJJOD-UHFFFAOYSA-N 0 3 369.867 5.390 50 0 FKAAHN Fc1ccccc1CCNCc1cc(Cl)ccc1OCc1ccccc1 ZINC000016480553 570857032 /nfs/dbraw/zinc/85/70/32/570857032.db2.gz DLXJCELLJYWVEN-UHFFFAOYSA-N 0 3 369.867 5.390 50 0 FKAAHN Fc1ccc(CNCc2c(OCc3ccccc3)ccc3ccccc32)cc1 ZINC000016480645 220185350 /nfs/dbraw/zinc/18/53/50/220185350.db2.gz OJSLXICOMWZSAS-UHFFFAOYSA-N 0 3 371.455 5.848 50 0 FKAAHN c1csc(CNCc2c(OCc3ccccc3)ccc3ccccc32)c1 ZINC000016480654 220185619 /nfs/dbraw/zinc/18/56/19/220185619.db2.gz KGGDQYPCKGSQTC-UHFFFAOYSA-N 0 3 359.494 5.770 50 0 FKAAHN Clc1ccc(COc2ccc3ccccc3c2CNC2CC2)c(Cl)c1 ZINC000016525841 211163413 /nfs/dbraw/zinc/16/34/13/211163413.db2.gz CEKSCIWQWQPLPN-UHFFFAOYSA-N 0 3 372.295 5.978 50 0 FKAAHN O=C(Nc1ccccc1-c1ccccc1)C1CCN(Cc2ccccc2)CC1 ZINC000016607398 220188813 /nfs/dbraw/zinc/18/88/13/220188813.db2.gz NCOMMNLDBOCGQJ-UHFFFAOYSA-N 0 3 370.496 5.204 50 0 FKAAHN C[C@@H]1[C@H](c2ccccc2)N[C@@H](c2ccccc2)C[C@@]1(O)c1ccc(F)cc1 ZINC000016949092 570470504 /nfs/dbraw/zinc/47/05/04/570470504.db2.gz KVYUHOPVUTYJPS-BMZZKGLRSA-N 0 3 361.460 5.125 50 0 FKAAHN C[C@@H](NCc1cccc(NC(=O)c2ccccc2Cl)c1)c1ccccc1 ZINC000017309591 570748884 /nfs/dbraw/zinc/74/88/84/570748884.db2.gz VXECLIOZHQIARP-MRXNPFEDSA-N 0 3 364.876 5.443 50 0 FKAAHN C[C@H](NCc1cccc(NC(=O)c2ccccc2Cl)c1)c1ccccc1 ZINC000017309592 570749005 /nfs/dbraw/zinc/74/90/05/570749005.db2.gz VXECLIOZHQIARP-INIZCTEOSA-N 0 3 364.876 5.443 50 0 FKAAHN C[C@@H](NCc1cn(Cc2ccccc2)nc1-c1cccs1)c1ccccc1 ZINC000017309595 211184667 /nfs/dbraw/zinc/18/46/67/211184667.db2.gz AKFDYGKIIDNHIF-GOSISDBHSA-N 0 3 373.525 5.511 50 0 FKAAHN C[C@H](NCc1cn(Cc2ccccc2)nc1-c1cccs1)c1ccccc1 ZINC000017309596 220214297 /nfs/dbraw/zinc/21/42/97/220214297.db2.gz AKFDYGKIIDNHIF-SFHVURJKSA-N 0 3 373.525 5.511 50 0 FKAAHN Cc1ccc(CNCc2cccc(NC(=O)c3ccccc3Cl)c2)cc1 ZINC000017311309 220214047 /nfs/dbraw/zinc/21/40/47/220214047.db2.gz GILZQETYELUPHR-UHFFFAOYSA-N 0 3 364.876 5.191 50 0 FKAAHN Cc1ccc(CNCc2cn(Cc3ccccc3)nc2-c2cccs2)cc1 ZINC000017311314 570749193 /nfs/dbraw/zinc/74/91/93/570749193.db2.gz RNJTWGNLOSEBNV-UHFFFAOYSA-N 0 3 373.525 5.258 50 0 FKAAHN Cc1ccc(C(=O)Nc2cccc(CN[C@H](C)c3ccccc3C)c2)cc1 ZINC000017312513 570749207 /nfs/dbraw/zinc/74/92/07/570749207.db2.gz DMORKIDDDZXERR-LJQANCHMSA-N 0 3 358.485 5.407 50 0 FKAAHN Cc1ccc(C(=O)Nc2cccc(CN[C@@H](C)c3ccccc3C)c2)cc1 ZINC000017312515 207619813 /nfs/dbraw/zinc/61/98/13/207619813.db2.gz DMORKIDDDZXERR-IBGZPJMESA-N 0 3 358.485 5.407 50 0 FKAAHN Cc1ccccc1CNCc1cccc(NC(=O)c2ccccc2Cl)c1 ZINC000017314694 220213582 /nfs/dbraw/zinc/21/35/82/220213582.db2.gz VWJXYJWKRXICPO-UHFFFAOYSA-N 0 3 364.876 5.191 50 0 FKAAHN C(=C/c1ccccc1)\CN1CCN(C2c3ccccc3-c3ccccc32)CC1 ZINC000019313160 570885614 /nfs/dbraw/zinc/88/56/14/570885614.db2.gz RDNHEFWZOKNXKM-DHZHZOJOSA-N 0 3 366.508 5.087 50 0 FKAAHN CCc1ccc(CN2CCN(C(c3ccccc3)c3ccccc3)CC2)cc1 ZINC000019359760 570887364 /nfs/dbraw/zinc/88/73/64/570887364.db2.gz IBHIGHXMWAXHKA-UHFFFAOYSA-N 0 3 370.540 5.156 50 0 FKAAHN FC(F)(F)c1cccc(N2CCN(Cc3cccc4ccccc43)CC2)c1 ZINC000019536234 570892174 /nfs/dbraw/zinc/89/21/74/570892174.db2.gz OXVPKNGYDKFBFQ-UHFFFAOYSA-N 0 3 370.418 5.181 50 0 FKAAHN C(=C/c1ccccc1)\CN1CCN(C(c2ccccc2)c2ccccc2)CC1 ZINC000019632891 570896174 /nfs/dbraw/zinc/89/61/74/570896174.db2.gz DERZBLKQOCDDDZ-JLHYYAGUSA-N 0 3 368.524 5.107 50 0 aggregator,world FKAAHN Cc1ccc(CN[C@@H]2CCCc3c2cnn3-c2ccc(C)c(C)c2)s1 ZINC000019634704 570896388 /nfs/dbraw/zinc/89/63/88/570896388.db2.gz JSGUKLDPENYQBE-HXUWFJFHSA-N 0 3 351.519 5.026 50 0 FKAAHN Cc1ccc(CN[C@H]2CCCc3c2cnn3-c2ccc(C)c(C)c2)s1 ZINC000019634708 570896194 /nfs/dbraw/zinc/89/61/94/570896194.db2.gz JSGUKLDPENYQBE-FQEVSTJZSA-N 0 3 351.519 5.026 50 0 FKAAHN CCOc1cc(CN[C@@H](Cc2ccccc2)c2ccccc2)ccc1OC ZINC000019721042 570901365 /nfs/dbraw/zinc/90/13/65/570901365.db2.gz NTZVVYNGGFOLFS-QFIPXVFZSA-N 0 3 361.485 5.168 50 0 FKAAHN CCOc1cc(CN[C@H](Cc2ccccc2)c2ccccc2)ccc1OC ZINC000019721043 570901241 /nfs/dbraw/zinc/90/12/41/570901241.db2.gz NTZVVYNGGFOLFS-JOCHJYFZSA-N 0 3 361.485 5.168 50 0 FKAAHN c1[nH]nc(-c2ccccc2)c1CN(CCc1ccccc1)Cc1ccccc1 ZINC000019722693 570901266 /nfs/dbraw/zinc/90/12/66/570901266.db2.gz CALWOJIHEDRGBR-UHFFFAOYSA-N 0 3 367.496 5.322 50 0 FKAAHN Clc1ccc(OCCCCNCc2ccccc2Cl)c(Cl)c1 ZINC000019737602 570901379 /nfs/dbraw/zinc/90/13/79/570901379.db2.gz YQBOIHAEFINMOK-UHFFFAOYSA-N 0 3 358.696 5.596 50 0 FKAAHN Cc1ccc(NC(=O)c2ccc(CN3CCc4ccccc4C3)cc2)c(C)c1 ZINC000019760646 570902255 /nfs/dbraw/zinc/90/22/55/570902255.db2.gz DJQSQUYKHMHLPD-UHFFFAOYSA-N 0 3 370.496 5.114 50 0 FKAAHN CCc1ccccc1NC(=O)c1ccc(CN2CCc3ccccc3C2)cc1 ZINC000019760812 570902173 /nfs/dbraw/zinc/90/21/73/570902173.db2.gz ZHMWAIZTZKVAAF-UHFFFAOYSA-N 0 3 370.496 5.060 50 0 FKAAHN Cc1ccc(NC(=O)c2ccc(CN3CCc4ccccc4C3)cc2)cc1C ZINC000019770414 570902234 /nfs/dbraw/zinc/90/22/34/570902234.db2.gz ZRVIGLCGGWQTGL-UHFFFAOYSA-N 0 3 370.496 5.114 50 0 FKAAHN CCOc1cc(CNC)cc(Cl)c1OCc1ccc(Cl)c(Cl)c1 ZINC000019777609 263376585 /nfs/dbraw/zinc/37/65/85/263376585.db2.gz MEALOMJJFSFYCY-UHFFFAOYSA-N 0 3 374.695 5.344 50 0 FKAAHN CCOc1cc(CNC)cc(Cl)c1OCc1c(Cl)cccc1Cl ZINC000019777610 263376735 /nfs/dbraw/zinc/37/67/35/263376735.db2.gz YCJAUMQLLSEESW-UHFFFAOYSA-N 0 3 374.695 5.344 50 0 FKAAHN CCC(=O)O[C@@]1(c2ccc(C3CC3)cc2)CCCN(Cc2ccccc2)C1 ZINC000019802223 571327294 /nfs/dbraw/zinc/32/72/94/571327294.db2.gz IEUXNSOWPMMTRK-DEOSSOPVSA-N 0 3 363.501 5.009 50 0 FKAAHN CCC(=O)O[C@]1(c2ccc(C3CC3)cc2)CCCN(Cc2ccccc2)C1 ZINC000019802226 571327360 /nfs/dbraw/zinc/32/73/60/571327360.db2.gz IEUXNSOWPMMTRK-XMMPIXPASA-N 0 3 363.501 5.009 50 0 FKAAHN CC(C)N1CCN([C@@H]2Cc3ccccc3Sc3ccc(Cl)cc32)CC1 ZINC000019802388 220297945 /nfs/dbraw/zinc/29/79/45/220297945.db2.gz KZUYNEYIJRBPII-LJQANCHMSA-N 0 3 372.965 5.114 50 0 FKAAHN CC(C)N1CCN([C@H]2Cc3ccccc3Sc3ccc(Cl)cc32)CC1 ZINC000019802390 220299283 /nfs/dbraw/zinc/29/92/83/220299283.db2.gz KZUYNEYIJRBPII-IBGZPJMESA-N 0 3 372.965 5.114 50 0 FKAAHN Cc1ccc(C)c(NC(=O)c2ccc(CN3CCc4ccccc4C3)cc2)c1 ZINC000019832604 220302160 /nfs/dbraw/zinc/30/21/60/220302160.db2.gz XKPWBFRCWHRMFO-UHFFFAOYSA-N 0 3 370.496 5.114 50 0 FKAAHN Cc1cc(C)cc(NC(=O)c2ccc(CN3CCc4ccccc4C3)cc2)c1 ZINC000019832606 220302293 /nfs/dbraw/zinc/30/22/93/220302293.db2.gz FJWFJVFCDOKDIY-UHFFFAOYSA-N 0 3 370.496 5.114 50 0 FKAAHN COc1ccc(CN[C@@H](Cc2ccccc2)c2ccccc2)c(OC)c1C ZINC000019841314 524084711 /nfs/dbraw/zinc/08/47/11/524084711.db2.gz NTDZDEGTHKCBEQ-QFIPXVFZSA-N 0 3 361.485 5.086 50 0 FKAAHN COc1ccc(CN[C@H](Cc2ccccc2)c2ccccc2)c(OC)c1C ZINC000019841316 524090624 /nfs/dbraw/zinc/09/06/24/524090624.db2.gz NTDZDEGTHKCBEQ-JOCHJYFZSA-N 0 3 361.485 5.086 50 0 FKAAHN Clc1ccccc1CN1CCN(C2CCC(c3ccccc3)CC2)CC1 ZINC000019842166 570904472 /nfs/dbraw/zinc/90/44/72/570904472.db2.gz SULWWKZJHDDCLO-UHFFFAOYSA-N 0 3 368.952 5.184 50 0 FKAAHN Clc1cccc(CN2CCN(C3CCC(c4ccccc4)CC3)CC2)c1 ZINC000019842170 570904251 /nfs/dbraw/zinc/90/42/51/570904251.db2.gz MYHMUCGHSKHLRT-UHFFFAOYSA-N 0 3 368.952 5.184 50 0 FKAAHN CCc1ccc(CN2CCN(C3CCC(c4ccccc4)CC3)CC2)cc1 ZINC000019842392 570904235 /nfs/dbraw/zinc/90/42/35/570904235.db2.gz QATIZVULOCDWKW-UHFFFAOYSA-N 0 3 362.561 5.093 50 0 FKAAHN Cc1oc(-c2ccsc2)nc1CN1CCC2(C=Cc3ccccc32)CC1 ZINC000019853585 571327467 /nfs/dbraw/zinc/32/74/67/571327467.db2.gz QRSUQEQCPCGVMD-UHFFFAOYSA-N 0 3 362.498 5.272 50 0 FKAAHN O[C@@H](CNCc1ccc(-c2cc(Cl)ccc2Cl)o1)c1ccccc1 ZINC000019872482 527652857 /nfs/dbraw/zinc/65/28/57/527652857.db2.gz ASLRYPGIFKSHGM-SFHVURJKSA-N 0 3 362.256 5.077 50 0 FKAAHN O[C@H](CNCc1ccc(-c2cc(Cl)ccc2Cl)o1)c1ccccc1 ZINC000019872484 526277802 /nfs/dbraw/zinc/27/78/02/526277802.db2.gz ASLRYPGIFKSHGM-GOSISDBHSA-N 0 3 362.256 5.077 50 0 FKAAHN O[C@@H](CNCc1ccc(-c2ccc(Cl)cc2Cl)o1)c1ccccc1 ZINC000019872531 527652773 /nfs/dbraw/zinc/65/27/73/527652773.db2.gz ZNGSTGKJRPQKLQ-SFHVURJKSA-N 0 3 362.256 5.077 50 0 FKAAHN O[C@H](CNCc1ccc(-c2ccc(Cl)cc2Cl)o1)c1ccccc1 ZINC000019872533 526278235 /nfs/dbraw/zinc/27/82/35/526278235.db2.gz ZNGSTGKJRPQKLQ-GOSISDBHSA-N 0 3 362.256 5.077 50 0 FKAAHN Cc1cccc(C)c1NC(=O)c1ccc(CN2CCc3ccccc3C2)cc1 ZINC000020028441 211263147 /nfs/dbraw/zinc/26/31/47/211263147.db2.gz JAIFWJBLUVTGTN-UHFFFAOYSA-N 0 3 370.496 5.114 50 0 FKAAHN CC(C)c1ccc(NC(=O)[C@@H](c2ccccc2)N2C[C@H](C)C[C@@H](C)C2)cc1 ZINC000020108159 571327952 /nfs/dbraw/zinc/32/79/52/571327952.db2.gz GYZUJEAEHADFSP-DNVFCKCGSA-N 0 3 364.533 5.468 50 0 FKAAHN CC(C)c1ccc(NC(=O)[C@@H](c2ccccc2)N2C[C@H](C)C[C@H](C)C2)cc1 ZINC000020108161 220312369 /nfs/dbraw/zinc/31/23/69/220312369.db2.gz GYZUJEAEHADFSP-SELNLUPBSA-N 0 3 364.533 5.468 50 0 FKAAHN Cc1cccc(NC(=O)c2ccc(CN3CCc4ccccc4C3)cc2)c1C ZINC000020149102 211270020 /nfs/dbraw/zinc/27/00/20/211270020.db2.gz PXJLCUCNAHNABV-UHFFFAOYSA-N 0 3 370.496 5.114 50 0 FKAAHN COc1ccc(-c2nc(CN3C[C@H]4C[C@@H]3CCC4)c(C)o2)c2ccccc12 ZINC000020149376 211271064 /nfs/dbraw/zinc/27/10/64/211271064.db2.gz QOOWIAJNWXGWRQ-SJORKVTESA-N 0 3 362.473 5.186 50 0 FKAAHN CC1=C(C)[C@@H](NC2CCCCCCCCCCC2)N(CCC(C)C)C1=O ZINC000020157647 263378469 /nfs/dbraw/zinc/37/84/69/263378469.db2.gz HEFFFXUAQCILGO-QFIPXVFZSA-N 0 3 362.602 5.800 50 0 FKAAHN OC(CNCc1ccc(Cl)cc1Cl)(c1ccccc1)c1ccccc1 ZINC000020219105 527503649 /nfs/dbraw/zinc/50/36/49/527503649.db2.gz RUBBJTFKKHUEPV-UHFFFAOYSA-N 0 3 372.295 5.019 50 0 FKAAHN O[C@@](CNCc1cccc(Cl)c1)(c1ccccc1)c1ccc(Cl)cc1 ZINC000020219106 527680327 /nfs/dbraw/zinc/68/03/27/527680327.db2.gz KTCSCPRRKZKCIY-NRFANRHFSA-N 0 3 372.295 5.019 50 0 FKAAHN O[C@](CNCc1cccc(Cl)c1)(c1ccccc1)c1ccc(Cl)cc1 ZINC000020219107 526318634 /nfs/dbraw/zinc/31/86/34/526318634.db2.gz KTCSCPRRKZKCIY-OAQYLSRUSA-N 0 3 372.295 5.019 50 0 FKAAHN O[C@@](CNCc1ccc(Cl)cc1)(c1ccccc1)c1ccc(Cl)cc1 ZINC000020219108 220318569 /nfs/dbraw/zinc/31/85/69/220318569.db2.gz JFKJXGRVBYQCDG-NRFANRHFSA-N 0 3 372.295 5.019 50 0 FKAAHN O[C@](CNCc1ccc(Cl)cc1)(c1ccccc1)c1ccc(Cl)cc1 ZINC000020219109 571328567 /nfs/dbraw/zinc/32/85/67/571328567.db2.gz JFKJXGRVBYQCDG-OAQYLSRUSA-N 0 3 372.295 5.019 50 0 FKAAHN c1coc(CN2CCC[C@@H](c3n[nH]cc3-c3cccc4ccccc43)C2)c1 ZINC000020256239 211273694 /nfs/dbraw/zinc/27/36/94/211273694.db2.gz FPJFHDPYOPGNKR-GOSISDBHSA-N 0 3 357.457 5.203 50 0 FKAAHN c1coc(CN2CCC[C@H](c3n[nH]cc3-c3cccc4ccccc43)C2)c1 ZINC000020256241 220320997 /nfs/dbraw/zinc/32/09/97/220320997.db2.gz FPJFHDPYOPGNKR-SFHVURJKSA-N 0 3 357.457 5.203 50 0 FKAAHN CCc1ccc([C@@H](NCc2cc(Br)cs2)C(C)C)cc1 ZINC000020306508 570880815 /nfs/dbraw/zinc/88/08/15/570880815.db2.gz JXOUQNKFYDXTMX-KRWDZBQOSA-N 0 3 352.341 5.560 50 0 FKAAHN CCc1ccc([C@H](NCc2cc(Br)cs2)C(C)C)cc1 ZINC000020306510 524051977 /nfs/dbraw/zinc/05/19/77/524051977.db2.gz JXOUQNKFYDXTMX-QGZVFWFLSA-N 0 3 352.341 5.560 50 0 FKAAHN OC(CNCc1ccc(Cl)c(Cl)c1)(c1ccccc1)c1ccccc1 ZINC000020365321 527503315 /nfs/dbraw/zinc/50/33/15/527503315.db2.gz QSRJFDLGXIEFAD-UHFFFAOYSA-N 0 3 372.295 5.019 50 0 FKAAHN OC(CNCc1ccccc1)(c1ccc(Cl)cc1)c1ccc(Cl)cc1 ZINC000020365325 220323760 /nfs/dbraw/zinc/32/37/60/220323760.db2.gz ZYKQHJJHAYFFNG-UHFFFAOYSA-N 0 3 372.295 5.019 50 0 FKAAHN CCCCN(Cc1cccs1)Cc1cc(=O)oc2ccc(OCC)cc12 ZINC000020446842 520549494 /nfs/dbraw/zinc/54/94/94/520549494.db2.gz XMUSQFMCWOZELC-UHFFFAOYSA-N 0 3 371.502 5.056 50 0 FKAAHN CC(C)(C)N[C@@H]1C=C(c2ccccc2)Sc2nc(-c3ccccc3)cn21 ZINC000020467973 570917516 /nfs/dbraw/zinc/91/75/16/570917516.db2.gz FKJSRUCOJAJJAH-FQEVSTJZSA-N 0 3 361.514 5.584 50 0 FKAAHN CC(C)(C)N[C@H]1C=C(c2ccccc2)Sc2nc(-c3ccccc3)cn21 ZINC000020467975 220327154 /nfs/dbraw/zinc/32/71/54/220327154.db2.gz FKJSRUCOJAJJAH-HXUWFJFHSA-N 0 3 361.514 5.584 50 0 FKAAHN CCOc1cc2c(cc1OCC)[C@H](c1ccc(-c3ccccc3)cc1)NCC2 ZINC000020506930 211283657 /nfs/dbraw/zinc/28/36/57/211283657.db2.gz ZECGBUYROKQBIO-VWLOTQADSA-N 0 3 373.496 5.386 50 0 FKAAHN CCOc1cc2c(cc1OCC)[C@@H](c1ccc(-c3ccccc3)cc1)NCC2 ZINC000020506932 570918635 /nfs/dbraw/zinc/91/86/35/570918635.db2.gz ZECGBUYROKQBIO-RUZDIDTESA-N 0 3 373.496 5.386 50 0 FKAAHN Cc1scc(CN2CCN(C3CCCCC3)CC2)c1-c1ccc(C)cc1 ZINC000020514439 571330345 /nfs/dbraw/zinc/33/03/45/571330345.db2.gz HLYQOXIDEDAYJX-UHFFFAOYSA-N 0 3 368.590 5.482 50 0 FKAAHN c1cc(CN2CCC(c3n[nH]cc3-c3ccc4ccccc4c3)CC2)co1 ZINC000020535538 220332723 /nfs/dbraw/zinc/33/27/23/220332723.db2.gz GSQSICZZFFJMHB-UHFFFAOYSA-N 0 3 357.457 5.203 50 0 FKAAHN Cc1ccc(COc2ccc3ccccc3c2CNCc2ccccc2)cc1 ZINC000020874143 524630725 /nfs/dbraw/zinc/63/07/25/524630725.db2.gz DIOSUWUHJBNLAR-UHFFFAOYSA-N 0 3 367.492 6.017 50 0 FKAAHN Cc1ccc(COc2ccc3ccccc3c2CNCc2cccs2)cc1 ZINC000020874181 524631161 /nfs/dbraw/zinc/63/11/61/524631161.db2.gz NALVJFSWJUVOKN-UHFFFAOYSA-N 0 3 373.521 6.079 50 0 FKAAHN CCOc1cc(CNCc2ccccc2)ccc1OCc1ccc(C)cc1 ZINC000020874275 520723660 /nfs/dbraw/zinc/72/36/60/520723660.db2.gz JIXZYEJHVCPQRG-UHFFFAOYSA-N 0 3 361.485 5.263 50 0 FKAAHN CCOc1cc(CNCc2cccs2)ccc1OCc1ccc(C)cc1 ZINC000020874318 520725891 /nfs/dbraw/zinc/72/58/91/520725891.db2.gz FKLSKLFERRJCNO-UHFFFAOYSA-N 0 3 367.514 5.324 50 0 FKAAHN Cc1ccc(COc2ccc(Br)cc2CNC(C)(C)C)cc1 ZINC000020874535 220343795 /nfs/dbraw/zinc/34/37/95/220343795.db2.gz XCBIVZRDRNKKAT-UHFFFAOYSA-N 0 3 362.311 5.225 50 0 FKAAHN CCCCNCc1cc(Br)ccc1OCc1ccc(C)cc1 ZINC000020874558 520691668 /nfs/dbraw/zinc/69/16/68/520691668.db2.gz WEAQSYLZFSXCQM-UHFFFAOYSA-N 0 3 362.311 5.226 50 0 FKAAHN Cc1ccc(COc2ccc(Br)cc2CNC2CCCC2)cc1 ZINC000020874560 524628945 /nfs/dbraw/zinc/62/89/45/524628945.db2.gz RQUXPSFXEZXJIL-UHFFFAOYSA-N 0 3 374.322 5.369 50 0 FKAAHN CC[C@@H](C)NCc1cc(Br)ccc1OCc1ccc(C)cc1 ZINC000020874590 522230476 /nfs/dbraw/zinc/23/04/76/522230476.db2.gz UUWJVUYYBIIWHC-OAHLLOKOSA-N 0 3 362.311 5.225 50 0 FKAAHN CC[C@H](C)NCc1cc(Br)ccc1OCc1ccc(C)cc1 ZINC000020874592 524005024 /nfs/dbraw/zinc/00/50/24/524005024.db2.gz UUWJVUYYBIIWHC-HNNXBMFYSA-N 0 3 362.311 5.225 50 0 FKAAHN Cc1ccc(COc2ccc(Cl)cc2CNCCc2ccccc2)cc1 ZINC000020875102 524629159 /nfs/dbraw/zinc/62/91/59/524629159.db2.gz PIVMBIJMHZEVAA-UHFFFAOYSA-N 0 3 365.904 5.560 50 0 FKAAHN CCCCCNCc1ccc(-c2ccc(Br)cc2Cl)o1 ZINC000020875644 520227537 /nfs/dbraw/zinc/22/75/37/520227537.db2.gz BOXLRARJPJOSQU-UHFFFAOYSA-N 0 3 356.691 5.642 50 0 FKAAHN CCCCCCNCc1ccc(-c2ccc(Br)cc2Cl)o1 ZINC000020875646 570925933 /nfs/dbraw/zinc/92/59/33/570925933.db2.gz FFFQHIHJDJGOFB-UHFFFAOYSA-N 0 3 370.718 6.032 50 0 FKAAHN Cc1cc(-c2ccc(CNCCc3ccccc3)o2)ccc1Br ZINC000020875758 526039577 /nfs/dbraw/zinc/03/95/77/526039577.db2.gz WJNNUBLVGMSGRR-UHFFFAOYSA-N 0 3 370.290 5.350 50 0 FKAAHN CCCCCCNCc1ccc(-c2ccc(Br)c(C)c2)o1 ZINC000020875786 520093829 /nfs/dbraw/zinc/09/38/29/520093829.db2.gz NLPHDYZWFBMWOB-UHFFFAOYSA-N 0 3 350.300 5.687 50 0 FKAAHN Cc1cc(Br)ccc1-c1ccc(CNCCc2ccccc2)o1 ZINC000020875896 526161040 /nfs/dbraw/zinc/16/10/40/526161040.db2.gz QORKFBCETSUUSN-UHFFFAOYSA-N 0 3 370.290 5.350 50 0 FKAAHN CCCCCCNCc1ccc(-c2ccc(Br)cc2C)o1 ZINC000020875917 520094820 /nfs/dbraw/zinc/09/48/20/520094820.db2.gz CYXJEGPLTMUHKM-UHFFFAOYSA-N 0 3 350.300 5.687 50 0 FKAAHN CCCCCNCc1cccc(OC)c1OCc1ccc(F)cc1Cl ZINC000020876213 220344966 /nfs/dbraw/zinc/34/49/66/220344966.db2.gz ZVNSFGJEFFETLK-UHFFFAOYSA-N 0 3 365.876 5.347 50 0 FKAAHN COc1ccc(CCNCc2ccc(-c3ccc(C)c(Cl)c3)o2)cc1 ZINC000020876620 523975148 /nfs/dbraw/zinc/97/51/48/523975148.db2.gz QPRWQSINNZEGET-UHFFFAOYSA-N 0 3 355.865 5.249 50 0 FKAAHN CCCOc1c(Cl)cc(CNCCc2ccccc2F)cc1Cl ZINC000020926417 520297848 /nfs/dbraw/zinc/29/78/48/520297848.db2.gz NYRSCSSHOYGVAY-UHFFFAOYSA-N 0 3 356.268 5.254 50 0 FKAAHN CCCOc1c(Cl)cc(CNCc2ccc(OC)cc2)cc1Cl ZINC000020926503 520297861 /nfs/dbraw/zinc/29/78/61/520297861.db2.gz MUKVDLXVDFJVKA-UHFFFAOYSA-N 0 3 354.277 5.081 50 0 FKAAHN CCCOc1ccc(Cl)cc1CNCCc1ccc(Cl)cc1Cl ZINC000020929071 520379307 /nfs/dbraw/zinc/37/93/07/520379307.db2.gz IEKVTAVGBJZHOD-UHFFFAOYSA-N 0 3 372.723 5.768 50 0 FKAAHN CCCOc1c(Cl)cc(Cl)cc1CNCCc1ccccc1F ZINC000020930210 520297111 /nfs/dbraw/zinc/29/71/11/520297111.db2.gz KIYFTMFAHPRDGM-UHFFFAOYSA-N 0 3 356.268 5.254 50 0 FKAAHN CCCOc1c(Cl)cc(Cl)cc1CNCCc1ccc(F)cc1 ZINC000020930216 520297991 /nfs/dbraw/zinc/29/79/91/520297991.db2.gz LHXMYCWBMBFOGC-UHFFFAOYSA-N 0 3 356.268 5.254 50 0 FKAAHN CCCOc1c(Cl)cc(Cl)cc1CNCCc1ccc(OC)cc1 ZINC000020930223 520296838 /nfs/dbraw/zinc/29/68/38/520296838.db2.gz NLMGJPRIOZAXFH-UHFFFAOYSA-N 0 3 368.304 5.123 50 0 FKAAHN CCCOc1c(Cl)cc(Cl)cc1CNCCc1ccccc1OC ZINC000020930372 520297250 /nfs/dbraw/zinc/29/72/50/520297250.db2.gz NHPNGQXIGDJMHN-UHFFFAOYSA-N 0 3 368.304 5.123 50 0 FKAAHN CCCOc1c(Cl)cc(Cl)cc1CNCCc1ccc(Cl)cc1 ZINC000020930389 520297459 /nfs/dbraw/zinc/29/74/59/520297459.db2.gz VXCIRHJZKUDYRB-UHFFFAOYSA-N 0 3 372.723 5.768 50 0 FKAAHN CCCOc1c(Cl)cc(Cl)cc1CN[C@@H](C)CCc1ccccc1 ZINC000020930424 520296432 /nfs/dbraw/zinc/29/64/32/520296432.db2.gz JWBOPENWQMGVLV-HNNXBMFYSA-N 0 3 366.332 5.893 50 0 FKAAHN CCCOc1c(Cl)cc(Cl)cc1CN[C@H](C)CCc1ccccc1 ZINC000020930430 520296367 /nfs/dbraw/zinc/29/63/67/520296367.db2.gz JWBOPENWQMGVLV-OAHLLOKOSA-N 0 3 366.332 5.893 50 0 FKAAHN CC(C)c1cccc(C(C)C)c1OCCCCCCN1CCN(C)CC1 ZINC000022037105 220375844 /nfs/dbraw/zinc/37/58/44/220375844.db2.gz BMUOHQOTDYEGDY-UHFFFAOYSA-N 0 3 360.586 5.120 50 0 FKAAHN Brc1ccc(OCc2ccccc2)c(CNC2CCCC2)c1 ZINC000022074243 570939344 /nfs/dbraw/zinc/93/93/44/570939344.db2.gz ABRBDHIDJOUABL-UHFFFAOYSA-N 0 3 360.295 5.060 50 0 FKAAHN Clc1ccc(COc2ccc(Cl)cc2CNC2CCCC2)cc1 ZINC000022074271 220377614 /nfs/dbraw/zinc/37/76/14/220377614.db2.gz KJBJDTYPCVFLNV-UHFFFAOYSA-N 0 3 350.289 5.605 50 0 FKAAHN Clc1ccc(OCc2ccccc2Cl)c(CNC2CCCC2)c1 ZINC000022074273 211338691 /nfs/dbraw/zinc/33/86/91/211338691.db2.gz FTYUAGXGLKFIDW-UHFFFAOYSA-N 0 3 350.289 5.605 50 0 FKAAHN CCOc1c(Cl)cc(Cl)cc1CNCCc1c[nH]c2ccccc12 ZINC000022074818 220376987 /nfs/dbraw/zinc/37/69/87/220376987.db2.gz BLFYPVABDSNGOG-UHFFFAOYSA-N 0 3 363.288 5.206 50 0 FKAAHN Fc1ccccc1CCNCc1ccc(-c2cc(Cl)ccc2Cl)o1 ZINC000022076509 570939318 /nfs/dbraw/zinc/93/93/18/570939318.db2.gz HFYGHQBZDDIXTC-UHFFFAOYSA-N 0 3 364.247 5.725 50 0 FKAAHN Fc1ccc(CCNCc2ccc(-c3cc(Cl)ccc3Cl)o2)cc1 ZINC000022076511 570939239 /nfs/dbraw/zinc/93/92/39/570939239.db2.gz KNPFYYKPGNTDLO-UHFFFAOYSA-N 0 3 364.247 5.725 50 0 FKAAHN Fc1ccccc1CCNCc1ccc(-c2cc(Cl)cc(Cl)c2)o1 ZINC000022076556 204770131 /nfs/dbraw/zinc/77/01/31/204770131.db2.gz QYUFGIAATVAQRZ-UHFFFAOYSA-N 0 3 364.247 5.725 50 0 FKAAHN Fc1ccc(CCNCc2ccc(-c3cc(Cl)cc(Cl)c3)o2)cc1 ZINC000022076558 207794915 /nfs/dbraw/zinc/79/49/15/207794915.db2.gz LHEATYLIFFTVHC-UHFFFAOYSA-N 0 3 364.247 5.725 50 0 FKAAHN O[C@@H](CNCc1ccc(-c2cc(Cl)cc(Cl)c2)o1)c1ccccc1 ZINC000022076569 570939169 /nfs/dbraw/zinc/93/91/69/570939169.db2.gz NUXHNZQHOOGUTO-SFHVURJKSA-N 0 3 362.256 5.077 50 0 FKAAHN O[C@H](CNCc1ccc(-c2cc(Cl)cc(Cl)c2)o1)c1ccccc1 ZINC000022076571 570939259 /nfs/dbraw/zinc/93/92/59/570939259.db2.gz NUXHNZQHOOGUTO-GOSISDBHSA-N 0 3 362.256 5.077 50 0 FKAAHN Brc1ccc(-c2ccc(CNCCc3ccccc3)o2)cc1 ZINC000022076605 570939323 /nfs/dbraw/zinc/93/93/23/570939323.db2.gz PQJIUTHGIWJYRG-UHFFFAOYSA-N 0 3 356.263 5.041 50 0 FKAAHN Fc1ccccc1CCNCc1ccc(-c2ccc(Br)cc2)o1 ZINC000022076610 207795088 /nfs/dbraw/zinc/79/50/88/207795088.db2.gz QKCCDIHMYVOUGT-UHFFFAOYSA-N 0 3 374.253 5.181 50 0 FKAAHN Fc1ccc(CCNCc2ccc(-c3ccc(Br)cc3)o2)cc1 ZINC000022076611 570939217 /nfs/dbraw/zinc/93/92/17/570939217.db2.gz RKZCBLYSVQEYOJ-UHFFFAOYSA-N 0 3 374.253 5.181 50 0 FKAAHN Fc1ccccc1CCNCc1ccc(-c2ccc(Cl)cc2Cl)o1 ZINC000022076828 211336540 /nfs/dbraw/zinc/33/65/40/211336540.db2.gz SHAXNHHQOBLLPJ-UHFFFAOYSA-N 0 3 364.247 5.725 50 0 FKAAHN Fc1ccc(CCNCc2ccc(-c3ccc(Cl)cc3Cl)o2)cc1 ZINC000022076834 570939119 /nfs/dbraw/zinc/93/91/19/570939119.db2.gz CNLWAFUXFBKGOD-UHFFFAOYSA-N 0 3 364.247 5.725 50 0 FKAAHN COc1ccc(-c2ccc(CNCCc3ccccc3F)o2)cc1Cl ZINC000022107316 211337275 /nfs/dbraw/zinc/33/72/75/211337275.db2.gz HDKWPUPIEPBJLS-UHFFFAOYSA-N 0 3 359.828 5.080 50 0 FKAAHN COc1ccc(-c2ccc(CNCCc3ccc(F)cc3)o2)cc1Cl ZINC000022107326 570939549 /nfs/dbraw/zinc/93/95/49/570939549.db2.gz WCNSVYIRXYLFNZ-UHFFFAOYSA-N 0 3 359.828 5.080 50 0 FKAAHN COc1ccc(CCNCc2ccc(-c3ccc(F)c(Cl)c3)o2)cc1 ZINC000022107485 570939749 /nfs/dbraw/zinc/93/97/49/570939749.db2.gz YPETVBMNHNFLSJ-UHFFFAOYSA-N 0 3 359.828 5.080 50 0 FKAAHN O=C(CCN1CCC[C@@H]1c1cccs1)Nc1cc(Cl)ccc1Cl ZINC000022199312 206369464 /nfs/dbraw/zinc/36/94/64/206369464.db2.gz BYYSHIMOMKDGCU-OAHLLOKOSA-N 0 3 369.317 5.221 50 0 FKAAHN O=C(CCN1CCC[C@H]1c1cccs1)Nc1cc(Cl)ccc1Cl ZINC000022199316 220378977 /nfs/dbraw/zinc/37/89/77/220378977.db2.gz BYYSHIMOMKDGCU-HNNXBMFYSA-N 0 3 369.317 5.221 50 0 FKAAHN C[C@H](c1cccs1)N(C)CCC(=O)Nc1c(Cl)cccc1Cl ZINC000022200069 211340231 /nfs/dbraw/zinc/34/02/31/211340231.db2.gz CINVRVUNMMBWNM-LLVKDONJSA-N 0 3 357.306 5.077 50 0 FKAAHN C[C@@H](c1cccs1)N(C)CCC(=O)Nc1c(Cl)cccc1Cl ZINC000022200074 204771339 /nfs/dbraw/zinc/77/13/39/204771339.db2.gz CINVRVUNMMBWNM-NSHDSACASA-N 0 3 357.306 5.077 50 0 FKAAHN C(=C/c1ccccc1)\CN1CCN(C2CCC(c3ccccc3)CC2)CC1 ZINC000022455893 220387455 /nfs/dbraw/zinc/38/74/55/220387455.db2.gz WYFXCIYLVBYPGA-JXMROGBWSA-N 0 3 360.545 5.044 50 0 FKAAHN c1csc(CN2CCC(CCc3ccc(-c4ccccc4)cc3)CC2)c1 ZINC000022646475 220394255 /nfs/dbraw/zinc/39/42/55/220394255.db2.gz IBKSHTVMBMBQNS-UHFFFAOYSA-N 0 3 361.554 6.260 50 0 FKAAHN c1ccc2c(c1)cccc2CN1CCN(Cc2cccc3ccccc32)CC1 ZINC000022874608 206396273 /nfs/dbraw/zinc/39/62/73/206396273.db2.gz HLIYCXYFCFMPJG-UHFFFAOYSA-N 0 3 366.508 5.311 50 0 FKAAHN Clc1ccccc1-c1ccc(CNC[C@H](c2ccco2)N2CCCC2)o1 ZINC000022933782 570953289 /nfs/dbraw/zinc/95/32/89/570953289.db2.gz UTFUHHIUCFMCIT-LJQANCHMSA-N 0 3 370.880 5.120 50 0 FKAAHN Clc1ccccc1-c1ccc(CNC[C@@H](c2ccco2)N2CCCC2)o1 ZINC000022933785 211371227 /nfs/dbraw/zinc/37/12/27/211371227.db2.gz UTFUHHIUCFMCIT-IBGZPJMESA-N 0 3 370.880 5.120 50 0 FKAAHN Cc1oc(-c2cccc(F)c2)nc1CN1CCC[C@@H](c2ccccc2)C1 ZINC000023129168 570956904 /nfs/dbraw/zinc/95/69/04/570956904.db2.gz PWAZOVBOIJHBPA-LJQANCHMSA-N 0 3 350.437 5.169 50 0 FKAAHN Cc1oc(-c2cccc(F)c2)nc1CN1CCC[C@H](c2ccccc2)C1 ZINC000023129169 570957071 /nfs/dbraw/zinc/95/70/71/570957071.db2.gz PWAZOVBOIJHBPA-IBGZPJMESA-N 0 3 350.437 5.169 50 0 FKAAHN Clc1ccc(-c2c[nH]nc2[C@@H]2CCCN(Cc3ccsc3)C2)cc1 ZINC000023129658 570957009 /nfs/dbraw/zinc/95/70/09/570957009.db2.gz MXIJYJZMJVHZGQ-MRXNPFEDSA-N 0 3 357.910 5.171 50 0 FKAAHN Clc1ccc(-c2c[nH]nc2[C@H]2CCCN(Cc3ccsc3)C2)cc1 ZINC000023129659 211378723 /nfs/dbraw/zinc/37/87/23/211378723.db2.gz MXIJYJZMJVHZGQ-INIZCTEOSA-N 0 3 357.910 5.171 50 0 FKAAHN Fc1ccc(C2=CCN(Cc3cccc(OCc4ccccc4)c3)CC2)cc1 ZINC000023280248 571071181 /nfs/dbraw/zinc/07/11/81/571071181.db2.gz RZKQRGXINCXEQB-UHFFFAOYSA-N 0 3 373.471 5.694 50 0 FKAAHN COc1cccc([C@@H]2CCCN2Cc2c[nH]nc2-c2cc3ccccc3o2)c1 ZINC000023338774 570961506 /nfs/dbraw/zinc/96/15/06/570961506.db2.gz UOCWGSSXKZQOMY-FQEVSTJZSA-N 0 3 373.456 5.169 50 0 FKAAHN COc1cccc([C@H]2CCCN2Cc2c[nH]nc2-c2cc3ccccc3o2)c1 ZINC000023338776 570961429 /nfs/dbraw/zinc/96/14/29/570961429.db2.gz UOCWGSSXKZQOMY-HXUWFJFHSA-N 0 3 373.456 5.169 50 0 FKAAHN CCn1c2ccccc2c2cc(CNCc3ccc(OC)c(OC)c3)ccc21 ZINC000023634123 571176572 /nfs/dbraw/zinc/17/65/72/571176572.db2.gz AOSSYWPSCXQZOY-UHFFFAOYSA-N 0 3 374.484 5.121 50 0 FKAAHN Clc1ccccc1[C@@H](CNCc1ccccn1)c1c[nH]c2ccccc21 ZINC000023908264 570968842 /nfs/dbraw/zinc/96/88/42/570968842.db2.gz PCRZYVNLCKMRKL-LJQANCHMSA-N 0 3 361.876 5.138 50 0 FKAAHN Clc1ccccc1[C@H](CNCc1ccccn1)c1c[nH]c2ccccc21 ZINC000023908266 570968977 /nfs/dbraw/zinc/96/89/77/570968977.db2.gz PCRZYVNLCKMRKL-IBGZPJMESA-N 0 3 361.876 5.138 50 0 FKAAHN Cc1nc(COc2ccc(CN[C@@H]3CCCc4ccccc43)cc2)cs1 ZINC000024081581 570971348 /nfs/dbraw/zinc/97/13/48/570971348.db2.gz WOPGYJBWBVQHQI-JOCHJYFZSA-N 0 3 364.514 5.198 50 0 FKAAHN Cc1nc(COc2ccc(CN[C@H]3CCCc4ccccc43)cc2)cs1 ZINC000024081584 220440666 /nfs/dbraw/zinc/44/06/66/220440666.db2.gz WOPGYJBWBVQHQI-QFIPXVFZSA-N 0 3 364.514 5.198 50 0 FKAAHN Clc1ccc(-c2ccc(CN[C@@H]3CCOc4ccccc43)s2)cc1 ZINC000024082000 570971111 /nfs/dbraw/zinc/97/11/11/570971111.db2.gz OZJNGBHABYJSJB-GOSISDBHSA-N 0 3 355.890 5.682 50 0 FKAAHN Clc1ccc(-c2ccc(CN[C@H]3CCOc4ccccc43)s2)cc1 ZINC000024082003 570971356 /nfs/dbraw/zinc/97/13/56/570971356.db2.gz OZJNGBHABYJSJB-SFHVURJKSA-N 0 3 355.890 5.682 50 0 FKAAHN Cc1cc(C)c(NC(=O)CN(Cc2ccccc2)[C@@H](C)C2CC2)c(Cl)c1 ZINC000024673667 570979580 /nfs/dbraw/zinc/97/95/80/570979580.db2.gz YAXRKQRFEBTTGX-KRWDZBQOSA-N 0 3 370.924 5.196 50 0 FKAAHN Cc1cc(C)c(NC(=O)CN(Cc2ccccc2)[C@H](C)C2CC2)c(Cl)c1 ZINC000024673672 570979363 /nfs/dbraw/zinc/97/93/63/570979363.db2.gz YAXRKQRFEBTTGX-QGZVFWFLSA-N 0 3 370.924 5.196 50 0 FKAAHN C[C@@H](NCc1c(-c2ccccc2)nc2ccccn21)c1ccc(Cl)cc1 ZINC000025046214 571121635 /nfs/dbraw/zinc/12/16/35/571121635.db2.gz YLJQNLYDIFTVFZ-MRXNPFEDSA-N 0 3 361.876 5.506 50 0 FKAAHN C[C@H](NCc1c(-c2ccccc2)nc2ccccn21)c1ccc(Cl)cc1 ZINC000025046222 571121629 /nfs/dbraw/zinc/12/16/29/571121629.db2.gz YLJQNLYDIFTVFZ-INIZCTEOSA-N 0 3 361.876 5.506 50 0 FKAAHN COc1cc(CN[C@@H](C)c2cccc3ccccc32)ccc1OC(F)F ZINC000025364067 571144999 /nfs/dbraw/zinc/14/49/99/571144999.db2.gz FDIVPUHNLSVQNV-AWEZNQCLSA-N 0 3 357.400 5.301 50 0 FKAAHN COc1cc(CN[C@H](C)c2cccc3ccccc32)ccc1OC(F)F ZINC000025364071 571144888 /nfs/dbraw/zinc/14/48/88/571144888.db2.gz FDIVPUHNLSVQNV-CQSZACIVSA-N 0 3 357.400 5.301 50 0 FKAAHN N[C@H](c1ccc(Cl)cc1Cl)[C@@H](N)c1ccc(Cl)cc1Cl ZINC000025759379 570999547 /nfs/dbraw/zinc/99/95/47/570999547.db2.gz UXVDOQZLEYUGHO-OKILXGFUSA-N 0 3 350.076 5.000 50 0 FKAAHN Cc1ccc([C@@H](CNC(=O)c2cccc3ccccc32)N2CCCCC2)cc1 ZINC000027583973 204865733 /nfs/dbraw/zinc/86/57/33/204865733.db2.gz IKFNLIZJLAVCND-XMMPIXPASA-N 0 3 372.512 5.105 50 0 FKAAHN Cc1ccc([C@H](CNC(=O)c2cccc3ccccc32)N2CCCCC2)cc1 ZINC000027583977 571015105 /nfs/dbraw/zinc/01/51/05/571015105.db2.gz IKFNLIZJLAVCND-DEOSSOPVSA-N 0 3 372.512 5.105 50 0 FKAAHN CCN(CC)[C@@H](CNC(=O)c1cccc(C)c1)c1ccc(C(C)(C)C)cc1 ZINC000028290545 571030018 /nfs/dbraw/zinc/03/00/18/571030018.db2.gz XUHRCQWYNGMHFR-QFIPXVFZSA-N 0 3 366.549 5.105 50 0 FKAAHN CCN(CC)[C@H](CNC(=O)c1cccc(C)c1)c1ccc(C(C)(C)C)cc1 ZINC000028290548 571029995 /nfs/dbraw/zinc/02/99/95/571029995.db2.gz XUHRCQWYNGMHFR-JOCHJYFZSA-N 0 3 366.549 5.105 50 0 FKAAHN Cc1ccccc1C(=O)NC[C@H](c1ccc(C(C)C)cc1)N1CCCCC1 ZINC000028291859 571030403 /nfs/dbraw/zinc/03/04/03/571030403.db2.gz FWIOCRCESMQGQZ-HSZRJFAPSA-N 0 3 364.533 5.075 50 0 FKAAHN Cc1ccccc1C(=O)NC[C@@H](c1ccc(C(C)C)cc1)N1CCCCC1 ZINC000028291861 571030410 /nfs/dbraw/zinc/03/04/10/571030410.db2.gz FWIOCRCESMQGQZ-QHCPKHFHSA-N 0 3 364.533 5.075 50 0 FKAAHN Cc1ccc(COc2c(Cl)cc(Cl)cc2CNC(C)(C)C)cc1 ZINC000028427449 571026639 /nfs/dbraw/zinc/02/66/39/571026639.db2.gz BSEPNOGMZYIZOQ-UHFFFAOYSA-N 0 3 352.305 5.769 50 0 FKAAHN CCCCNCc1cc(Cl)cc(Cl)c1OCc1ccc(C)cc1 ZINC000028427516 571032124 /nfs/dbraw/zinc/03/21/24/571032124.db2.gz LZPLPCHRSOUARM-UHFFFAOYSA-N 0 3 352.305 5.771 50 0 FKAAHN Cc1ccc(COc2c(Cl)cc(Cl)cc2CNC2CCCC2)cc1 ZINC000028427521 571032050 /nfs/dbraw/zinc/03/20/50/571032050.db2.gz QJNHEKDRMFSPTF-UHFFFAOYSA-N 0 3 364.316 5.913 50 0 FKAAHN CCCCCNCc1cc(Cl)cc(Cl)c1OCc1ccc(C)cc1 ZINC000028427603 220573628 /nfs/dbraw/zinc/57/36/28/220573628.db2.gz HCJSHWOSMRTPPI-UHFFFAOYSA-N 0 3 366.332 6.161 50 0 FKAAHN Cc1ccc(COc2c(Cl)cc(Cl)cc2CNCC(C)C)cc1 ZINC000028427613 571026649 /nfs/dbraw/zinc/02/66/49/571026649.db2.gz SLQKPKJSIUWBTG-UHFFFAOYSA-N 0 3 352.305 5.626 50 0 FKAAHN CC[C@@H](C)NCc1cc(Cl)cc(Cl)c1OCc1ccc(C)cc1 ZINC000028427619 571146239 /nfs/dbraw/zinc/14/62/39/571146239.db2.gz ZWPHIZSVAVKZLG-CQSZACIVSA-N 0 3 352.305 5.769 50 0 FKAAHN CC[C@H](C)NCc1cc(Cl)cc(Cl)c1OCc1ccc(C)cc1 ZINC000028427626 571146244 /nfs/dbraw/zinc/14/62/44/571146244.db2.gz ZWPHIZSVAVKZLG-AWEZNQCLSA-N 0 3 352.305 5.769 50 0 FKAAHN Clc1cc(CNCc2ccccc2)cc(Cl)c1OCc1ccccc1 ZINC000028427787 571026598 /nfs/dbraw/zinc/02/65/98/571026598.db2.gz UIJXUASRHNZGOV-UHFFFAOYSA-N 0 3 372.295 5.862 50 0 FKAAHN Clc1ccccc1Cn1cc(CNCc2ccccc2)c2ccccc21 ZINC000028427793 207962354 /nfs/dbraw/zinc/96/23/54/207962354.db2.gz OQEHMINIOBHPDM-UHFFFAOYSA-N 0 3 360.888 5.633 50 0 FKAAHN C[C@@H](NCc1cn(Cc2ccccc2Cl)c2ccccc12)c1ccccc1 ZINC000028427939 571032062 /nfs/dbraw/zinc/03/20/62/571032062.db2.gz RPQSCAQQIFGLOF-GOSISDBHSA-N 0 3 374.915 6.194 50 0 FKAAHN C[C@H](NCc1cn(Cc2ccccc2Cl)c2ccccc12)c1ccccc1 ZINC000028427947 571032024 /nfs/dbraw/zinc/03/20/24/571032024.db2.gz RPQSCAQQIFGLOF-SFHVURJKSA-N 0 3 374.915 6.194 50 0 FKAAHN Clc1ccccc1Cn1cc(CNCc2cccnc2)c2ccccc21 ZINC000028427981 571032129 /nfs/dbraw/zinc/03/21/29/571032129.db2.gz BBAGJCZQJWJPDT-UHFFFAOYSA-N 0 3 361.876 5.028 50 0 FKAAHN Clc1ccccc1Cn1cc(CNCc2cccs2)c2ccccc21 ZINC000028428050 571032621 /nfs/dbraw/zinc/03/26/21/571032621.db2.gz WTSSNIXLLQXDAT-UHFFFAOYSA-N 0 3 366.917 5.694 50 0 FKAAHN Cc1ccc(CNCc2cn(Cc3ccccc3Cl)c3ccccc23)cc1 ZINC000028428356 571032519 /nfs/dbraw/zinc/03/25/19/571032519.db2.gz QGVYDGFCHSLCGG-UHFFFAOYSA-N 0 3 374.915 5.941 50 0 FKAAHN Fc1ccc(/C=C/c2sc([N-]c3ccccc3)n[n+]2-c2ccccc2)cc1 ZINC000028712431 204886704 /nfs/dbraw/zinc/88/67/04/204886704.db2.gz BCNLNLNULNZXNP-DTQAZKPQSA-N 0 3 374.464 5.473 50 0 FKAAHN CC(=O)Nc1cccc([C@@H](C)NCc2ccc(-c3ccccc3F)s2)c1 ZINC000028925003 571035614 /nfs/dbraw/zinc/03/56/14/571035614.db2.gz QCHAECOOVCIIMT-CQSZACIVSA-N 0 3 368.477 5.363 50 0 FKAAHN CC(=O)Nc1cccc([C@H](C)NCc2ccc(-c3ccccc3F)s2)c1 ZINC000028925004 571035507 /nfs/dbraw/zinc/03/55/07/571035507.db2.gz QCHAECOOVCIIMT-AWEZNQCLSA-N 0 3 368.477 5.363 50 0 FKAAHN CC(=O)Nc1cccc([C@@H](C)NCc2ccc(-c3ccc(F)cc3)s2)c1 ZINC000028925017 571035564 /nfs/dbraw/zinc/03/55/64/571035564.db2.gz REXMAPMKBJMTNR-CQSZACIVSA-N 0 3 368.477 5.363 50 0 FKAAHN CC(=O)Nc1cccc([C@H](C)NCc2ccc(-c3ccc(F)cc3)s2)c1 ZINC000028925018 571035644 /nfs/dbraw/zinc/03/56/44/571035644.db2.gz REXMAPMKBJMTNR-AWEZNQCLSA-N 0 3 368.477 5.363 50 0 FKAAHN COc1ccc2cc(CN[C@@H](C)c3ccc(NC(=O)C4CC4)cc3)ccc2c1 ZINC000028925374 571341364 /nfs/dbraw/zinc/34/13/64/571341364.db2.gz OZYBAGVRBSWVKC-INIZCTEOSA-N 0 3 374.484 5.048 50 0 FKAAHN COc1ccc2cc(CN[C@H](C)c3ccc(NC(=O)C4CC4)cc3)ccc2c1 ZINC000028925375 571341377 /nfs/dbraw/zinc/34/13/77/571341377.db2.gz OZYBAGVRBSWVKC-MRXNPFEDSA-N 0 3 374.484 5.048 50 0 FKAAHN C[C@@H](NCc1ccc(OCc2ccncc2)cc1)c1cc2ccccc2o1 ZINC000030545622 208002008 /nfs/dbraw/zinc/00/20/08/208002008.db2.gz UTAYXPJYLROSGN-QGZVFWFLSA-N 0 3 358.441 5.258 50 0 FKAAHN C[C@H](NCc1ccc(OCc2ccncc2)cc1)c1cc2ccccc2o1 ZINC000030545623 571048168 /nfs/dbraw/zinc/04/81/68/571048168.db2.gz UTAYXPJYLROSGN-KRWDZBQOSA-N 0 3 358.441 5.258 50 0 FKAAHN COc1ccc([C@@H](C)NCc2ccc(-c3ccccc3F)s2)cc1F ZINC000030628262 571048316 /nfs/dbraw/zinc/04/83/16/571048316.db2.gz HYRMNTFSXCWSBC-CYBMUJFWSA-N 0 3 359.441 5.553 50 0 FKAAHN COc1ccc([C@H](C)NCc2ccc(-c3ccccc3F)s2)cc1F ZINC000030628266 204910071 /nfs/dbraw/zinc/91/00/71/204910071.db2.gz HYRMNTFSXCWSBC-ZDUSSCGKSA-N 0 3 359.441 5.553 50 0 FKAAHN CCN(CC)Cc1cccc(NC(=O)c2ccc(-c3ccc(F)cc3)o2)c1 ZINC000031538585 571352735 /nfs/dbraw/zinc/35/27/35/571352735.db2.gz UJUYJZCVJDTUSS-UHFFFAOYSA-N 0 3 366.436 5.180 50 0 FKAAHN c1ccc(N2CCN([C@@H]3Cc4ccccc4Sc4ccccc43)CC2)cc1 ZINC000031559723 571352795 /nfs/dbraw/zinc/35/27/95/571352795.db2.gz YJYIZAFFTXOBSP-JOCHJYFZSA-N 0 3 372.537 5.257 50 0 FKAAHN c1ccc(N2CCN([C@H]3Cc4ccccc4Sc4ccccc43)CC2)cc1 ZINC000031559725 571352835 /nfs/dbraw/zinc/35/28/35/571352835.db2.gz YJYIZAFFTXOBSP-QFIPXVFZSA-N 0 3 372.537 5.257 50 0 FKAAHN Cc1cc2oc(=O)cc(CN(C)[C@H](C)c3cc4ccccc4o3)c2cc1C ZINC000032754477 570794484 /nfs/dbraw/zinc/79/44/84/570794484.db2.gz GYMDJKKZVBQKDU-MRXNPFEDSA-N 0 3 361.441 5.349 50 0 FKAAHN Cc1cc2oc(=O)cc(CN(C)[C@@H](C)c3cc4ccccc4o3)c2cc1C ZINC000032754478 570794373 /nfs/dbraw/zinc/79/43/73/570794373.db2.gz GYMDJKKZVBQKDU-INIZCTEOSA-N 0 3 361.441 5.349 50 0 FKAAHN CCN(Cc1ccc(Cl)cc1)Cc1cc(=O)oc2c(C)cc(C)cc12 ZINC000033018754 571061161 /nfs/dbraw/zinc/06/11/61/571061161.db2.gz FPLDSIPHFQATLW-UHFFFAOYSA-N 0 3 355.865 5.085 50 0 FKAAHN C[C@@H](N[C@@H](C)c1ccc2ccccc2c1)C(=O)Nc1ccc(F)cc1Cl ZINC000033040090 208069273 /nfs/dbraw/zinc/06/92/73/208069273.db2.gz GSYXGONAGCCDRU-UONOGXRCSA-N 0 3 370.855 5.310 50 0 FKAAHN C[C@H](N[C@@H](C)c1ccc2ccccc2c1)C(=O)Nc1ccc(F)cc1Cl ZINC000033040091 571114885 /nfs/dbraw/zinc/11/48/85/571114885.db2.gz GSYXGONAGCCDRU-KBPBESRZSA-N 0 3 370.855 5.310 50 0 FKAAHN C[C@@H](N[C@H](C)c1ccc2ccccc2c1)C(=O)Nc1ccc(F)cc1Cl ZINC000033040092 571114881 /nfs/dbraw/zinc/11/48/81/571114881.db2.gz GSYXGONAGCCDRU-ZIAGYGMSSA-N 0 3 370.855 5.310 50 0 FKAAHN C[C@@H](N[C@@H](C)C(=O)Nc1ccc(F)cc1Cl)c1ccc2ccccc2c1 ZINC000033040093 571114892 /nfs/dbraw/zinc/11/48/92/571114892.db2.gz GSYXGONAGCCDRU-KGLIPLIRSA-N 0 3 370.855 5.310 50 0 FKAAHN Fc1ccc(-c2n[nH]cc2CN2CCCCC[C@@H]2c2cccs2)cc1 ZINC000033087074 571062068 /nfs/dbraw/zinc/06/20/68/571062068.db2.gz PFCQQTYYXOOKFI-GOSISDBHSA-N 0 3 355.482 5.395 50 0 FKAAHN Fc1ccc(-c2n[nH]cc2CN2CCCCC[C@H]2c2cccs2)cc1 ZINC000033087075 571062063 /nfs/dbraw/zinc/06/20/63/571062063.db2.gz PFCQQTYYXOOKFI-SFHVURJKSA-N 0 3 355.482 5.395 50 0 FKAAHN COc1ccc(-c2n[nH]cc2CN2CCCCC[C@@H]2c2cccs2)cc1 ZINC000033087076 571062047 /nfs/dbraw/zinc/06/20/47/571062047.db2.gz RWKALEUFIYHCAG-LJQANCHMSA-N 0 3 367.518 5.264 50 0 FKAAHN COc1ccc(-c2n[nH]cc2CN2CCCCC[C@H]2c2cccs2)cc1 ZINC000033087077 208071882 /nfs/dbraw/zinc/07/18/82/208071882.db2.gz RWKALEUFIYHCAG-IBGZPJMESA-N 0 3 367.518 5.264 50 0 FKAAHN Cc1ccc(-c2n[nH]cc2CN2CCCCC[C@@H]2c2cccs2)cc1 ZINC000033087090 571061980 /nfs/dbraw/zinc/06/19/80/571061980.db2.gz FIIKCJRQASLZLQ-LJQANCHMSA-N 0 3 351.519 5.564 50 0 FKAAHN Cc1ccc(-c2n[nH]cc2CN2CCCCC[C@H]2c2cccs2)cc1 ZINC000033087091 571061991 /nfs/dbraw/zinc/06/19/91/571061991.db2.gz FIIKCJRQASLZLQ-IBGZPJMESA-N 0 3 351.519 5.564 50 0 FKAAHN Brc1ccccc1CN1CCCCC[C@@H]1c1cccs1 ZINC000033087094 571062076 /nfs/dbraw/zinc/06/20/76/571062076.db2.gz ADAORSPBVYFTEU-MRXNPFEDSA-N 0 3 350.325 5.628 50 0 FKAAHN Brc1ccccc1CN1CCCCC[C@H]1c1cccs1 ZINC000033087095 571061876 /nfs/dbraw/zinc/06/18/76/571061876.db2.gz ADAORSPBVYFTEU-INIZCTEOSA-N 0 3 350.325 5.628 50 0 FKAAHN COc1ccc(CN2CCCCC[C@@H]2c2ccc(C)cc2)c(OC)c1OC ZINC000033087122 208070229 /nfs/dbraw/zinc/07/02/29/208070229.db2.gz NVSZFSLMPGRGIW-HXUWFJFHSA-N 0 3 369.505 5.138 50 0 FKAAHN COc1ccc(CN2CCCCC[C@H]2c2ccc(C)cc2)c(OC)c1OC ZINC000033087123 208071283 /nfs/dbraw/zinc/07/12/83/208071283.db2.gz NVSZFSLMPGRGIW-FQEVSTJZSA-N 0 3 369.505 5.138 50 0 FKAAHN COc1ccc(CN2CCCCC[C@@H]2c2cccc(C)c2)c(OC)c1OC ZINC000033087124 571062042 /nfs/dbraw/zinc/06/20/42/571062042.db2.gz TUTHGVOXZDFYQR-HXUWFJFHSA-N 0 3 369.505 5.138 50 0 FKAAHN COc1ccc(CN2CCCCC[C@H]2c2cccc(C)c2)c(OC)c1OC ZINC000033087125 571061864 /nfs/dbraw/zinc/06/18/64/571061864.db2.gz TUTHGVOXZDFYQR-FQEVSTJZSA-N 0 3 369.505 5.138 50 0 FKAAHN Cc1ccsc1[C@@H]1CCCCCN1Cc1ccc(Br)cc1 ZINC000033087166 571062125 /nfs/dbraw/zinc/06/21/25/571062125.db2.gz PZOBYTBISMUHJS-KRWDZBQOSA-N 0 3 364.352 5.936 50 0 FKAAHN Cc1ccsc1[C@H]1CCCCCN1Cc1ccc(Br)cc1 ZINC000033087167 208070058 /nfs/dbraw/zinc/07/00/58/208070058.db2.gz PZOBYTBISMUHJS-QGZVFWFLSA-N 0 3 364.352 5.936 50 0 FKAAHN COc1cc(OC)c(OC)cc1CN1CCCCC[C@@H]1c1ccc(C)cc1 ZINC000033087168 571062107 /nfs/dbraw/zinc/06/21/07/571062107.db2.gz YLNUBUBGHDIWFN-HXUWFJFHSA-N 0 3 369.505 5.138 50 0 FKAAHN COc1cc(OC)c(OC)cc1CN1CCCCC[C@H]1c1ccc(C)cc1 ZINC000033087169 571061900 /nfs/dbraw/zinc/06/19/00/571061900.db2.gz YLNUBUBGHDIWFN-FQEVSTJZSA-N 0 3 369.505 5.138 50 0 FKAAHN COc1cc(OC)c(OC)cc1CN1CCCCC[C@@H]1c1cccc(C)c1 ZINC000033087170 208070605 /nfs/dbraw/zinc/07/06/05/208070605.db2.gz YFYGMRHJNGYQLY-HXUWFJFHSA-N 0 3 369.505 5.138 50 0 FKAAHN COc1cc(OC)c(OC)cc1CN1CCCCC[C@H]1c1cccc(C)c1 ZINC000033087171 208071528 /nfs/dbraw/zinc/07/15/28/208071528.db2.gz YFYGMRHJNGYQLY-FQEVSTJZSA-N 0 3 369.505 5.138 50 0 FKAAHN Cc1ccsc1[C@@H]1CCCCCN1Cc1cccc(Br)c1 ZINC000033087182 208070955 /nfs/dbraw/zinc/07/09/55/208070955.db2.gz JHKFFNLLZIDRDU-KRWDZBQOSA-N 0 3 364.352 5.936 50 0 FKAAHN Cc1ccsc1[C@H]1CCCCCN1Cc1cccc(Br)c1 ZINC000033087183 208071105 /nfs/dbraw/zinc/07/11/05/208071105.db2.gz JHKFFNLLZIDRDU-QGZVFWFLSA-N 0 3 364.352 5.936 50 0 FKAAHN COc1cc(CN2CCCCC[C@@H]2c2cccs2)ccc1OC(C)C ZINC000033087202 571061969 /nfs/dbraw/zinc/06/19/69/571061969.db2.gz CZDFXMQEQNUIHN-GOSISDBHSA-N 0 3 359.535 5.661 50 0 FKAAHN COc1cc(CN2CCCCC[C@H]2c2cccs2)ccc1OC(C)C ZINC000033087203 571061847 /nfs/dbraw/zinc/06/18/47/571061847.db2.gz CZDFXMQEQNUIHN-SFHVURJKSA-N 0 3 359.535 5.661 50 0 FKAAHN COc1cc(CN2CCCCC[C@@H]2c2sccc2C)ccc1OC(C)C ZINC000033087204 571062021 /nfs/dbraw/zinc/06/20/21/571062021.db2.gz OBOKAZMKCLOBFW-LJQANCHMSA-N 0 3 373.562 5.970 50 0 FKAAHN COc1cc(CN2CCCCC[C@H]2c2sccc2C)ccc1OC(C)C ZINC000033087205 571062499 /nfs/dbraw/zinc/06/24/99/571062499.db2.gz OBOKAZMKCLOBFW-IBGZPJMESA-N 0 3 373.562 5.970 50 0 FKAAHN COc1cc(CN2CCCCC[C@@H]2c2cccs2)ccc1OCC(C)C ZINC000033087220 571062424 /nfs/dbraw/zinc/06/24/24/571062424.db2.gz KSNWOLNFOKSTMW-LJQANCHMSA-N 0 3 373.562 5.909 50 0 FKAAHN COc1cc(CN2CCCCC[C@H]2c2cccs2)ccc1OCC(C)C ZINC000033087221 571062386 /nfs/dbraw/zinc/06/23/86/571062386.db2.gz KSNWOLNFOKSTMW-IBGZPJMESA-N 0 3 373.562 5.909 50 0 FKAAHN CNCc1ccc(Br)cc1Oc1ccc(Cl)c(Cl)c1 ZINC000034030604 571085645 /nfs/dbraw/zinc/08/56/45/571085645.db2.gz WJQHBBMQIFJYHD-UHFFFAOYSA-N 0 3 361.066 5.268 50 0 FKAAHN Brc1ccc2[nH]cc(C3=CCN(Cc4ccccc4)CC3)c2c1 ZINC000034287700 571068452 /nfs/dbraw/zinc/06/84/52/571068452.db2.gz JUYNGLUHLPFYPP-UHFFFAOYSA-N 0 3 367.290 5.220 50 0 FKAAHN Cc1ccc(N(C(=O)CC(C)C)C2CCN(Cc3cccs3)CC2)cc1 ZINC000034682923 570532256 /nfs/dbraw/zinc/53/22/56/570532256.db2.gz PYBKCOAWOKZHHC-UHFFFAOYSA-N 0 3 370.562 5.100 50 0 FKAAHN CCC(=O)N(c1ccc(C)cc1)C1CCN(Cc2ccc(C)c(C)c2)CC1 ZINC000034683311 208104799 /nfs/dbraw/zinc/10/47/99/208104799.db2.gz LVDDLSLDNIWJDG-UHFFFAOYSA-N 0 3 364.533 5.019 50 0 FKAAHN CCCOc1ccc(Br)cc1CNCCC1=CCCCC1 ZINC000034992591 570479775 /nfs/dbraw/zinc/47/97/75/570479775.db2.gz KTEQZUNXPQEYKY-UHFFFAOYSA-N 0 3 352.316 5.218 50 0 FKAAHN Cc1ccc(CN(CCC(C)C)Cc2cccn2Cc2ccccc2)cc1 ZINC000035840970 571206556 /nfs/dbraw/zinc/20/65/56/571206556.db2.gz NTKXMTXGUCNSDE-UHFFFAOYSA-N 0 3 360.545 5.893 50 0 FKAAHN Cc1ccccc1CN(CCC(C)C)Cc1cccn1Cc1ccccc1 ZINC000035840972 571206521 /nfs/dbraw/zinc/20/65/21/571206521.db2.gz VPMYEMQJLLUNLQ-UHFFFAOYSA-N 0 3 360.545 5.893 50 0 FKAAHN CC(C)CN(Cc1cccn1Cc1ccccc1F)Cc1ccccc1 ZINC000035841033 208137928 /nfs/dbraw/zinc/13/79/28/208137928.db2.gz HOPWCKZQXVDJRI-UHFFFAOYSA-N 0 3 350.481 5.334 50 0 FKAAHN Cc1ccc(Cn2cccc2CN(Cc2ccccc2C)CC(C)C)cc1 ZINC000035841070 208136877 /nfs/dbraw/zinc/13/68/77/208136877.db2.gz AAXIMTVRHXDECX-UHFFFAOYSA-N 0 3 360.545 5.811 50 0 FKAAHN Cc1ccc(Cn2cccc2CN(CCC(C)C)Cc2ccccc2C)cc1 ZINC000035841078 571206374 /nfs/dbraw/zinc/20/63/74/571206374.db2.gz QHCOXURUISTEEP-UHFFFAOYSA-N 0 3 374.572 6.202 50 0 FKAAHN Cc1ccccc1Cn1cccc1CN(CCC(C)C)Cc1ccccc1 ZINC000035841106 571206394 /nfs/dbraw/zinc/20/63/94/571206394.db2.gz XKFCOPXPFNBMCD-UHFFFAOYSA-N 0 3 360.545 5.893 50 0 FKAAHN CCCC(O)(CCC)c1ccc(CN(Cc2cccs2)[C@@H](C)CC)o1 ZINC000036157162 571243886 /nfs/dbraw/zinc/24/38/86/571243886.db2.gz NZXPVAIJXIVGNI-KRWDZBQOSA-N 0 3 363.567 5.930 50 0 FKAAHN CCCC(O)(CCC)c1ccc(CN(Cc2cccs2)[C@H](C)CC)o1 ZINC000036157166 205007769 /nfs/dbraw/zinc/00/77/69/205007769.db2.gz NZXPVAIJXIVGNI-QGZVFWFLSA-N 0 3 363.567 5.930 50 0 FKAAHN CCCN(Cc1ccc(C(O)(CCC)CCC)o1)Cc1ccc(OC)cc1 ZINC000036167687 205006523 /nfs/dbraw/zinc/00/65/23/205006523.db2.gz IHTBUMLOAUINHZ-UHFFFAOYSA-N 0 3 373.537 5.488 50 0 FKAAHN CCCC(O)(CCC)c1ccc(CN(Cc2ccc(C)cc2)C(C)C)o1 ZINC000036202788 208148635 /nfs/dbraw/zinc/14/86/35/208148635.db2.gz CMEZDUGDUQQSBE-UHFFFAOYSA-N 0 3 357.538 5.786 50 0 FKAAHN CCCC(O)(CCC)c1ccc(CN(Cc2ccccc2C)C(C)C)o1 ZINC000036203259 211655202 /nfs/dbraw/zinc/65/52/02/211655202.db2.gz FEPISRLQCHMBFM-UHFFFAOYSA-N 0 3 357.538 5.786 50 0 FKAAHN CCOc1ccc(CN2CCCn3cccc3[C@@H]2c2ccc(C)cc2)cc1 ZINC000036347250 571248912 /nfs/dbraw/zinc/24/89/12/571248912.db2.gz KMTKZNSYGLPVTA-DEOSSOPVSA-N 0 3 360.501 5.191 50 0 FKAAHN CCOc1ccc(CN2CCCn3cccc3[C@H]2c2ccc(C)cc2)cc1 ZINC000036347251 571248812 /nfs/dbraw/zinc/24/88/12/571248812.db2.gz KMTKZNSYGLPVTA-XMMPIXPASA-N 0 3 360.501 5.191 50 0 FKAAHN FC(F)(F)c1ccc([C@H]2c3cccn3CCCN2Cc2ccccc2)cc1 ZINC000036347356 208156128 /nfs/dbraw/zinc/15/61/28/208156128.db2.gz DGZUCQDVXAIVBO-NRFANRHFSA-N 0 3 370.418 5.502 50 0 FKAAHN FC(F)(F)c1ccc([C@@H]2c3cccn3CCCN2Cc2ccccc2)cc1 ZINC000036347357 205010515 /nfs/dbraw/zinc/01/05/15/205010515.db2.gz DGZUCQDVXAIVBO-OAQYLSRUSA-N 0 3 370.418 5.502 50 0 FKAAHN COc1ccc([C@H]2c3cccn3CCCN2Cc2cc(C)ccc2C)cc1 ZINC000036347576 205010182 /nfs/dbraw/zinc/01/01/82/205010182.db2.gz UIUYVBNKQXQOAY-DEOSSOPVSA-N 0 3 360.501 5.109 50 0 FKAAHN COc1ccc([C@@H]2c3cccn3CCCN2Cc2cc(C)ccc2C)cc1 ZINC000036347577 208155725 /nfs/dbraw/zinc/15/57/25/208155725.db2.gz UIUYVBNKQXQOAY-XMMPIXPASA-N 0 3 360.501 5.109 50 0 FKAAHN CCc1ccccc1CN1CCCn2cccc2[C@@H]1c1ccc(OC)cc1 ZINC000036347586 205009932 /nfs/dbraw/zinc/00/99/32/205009932.db2.gz FIIYTBZNBFDICP-DEOSSOPVSA-N 0 3 360.501 5.054 50 0 FKAAHN CCc1ccccc1CN1CCCn2cccc2[C@H]1c1ccc(OC)cc1 ZINC000036347587 208154031 /nfs/dbraw/zinc/15/40/31/208154031.db2.gz FIIYTBZNBFDICP-XMMPIXPASA-N 0 3 360.501 5.054 50 0 FKAAHN CCOc1ccc([C@@H]2c3cccn3CCCN2Cc2ccc(C)cc2)cc1 ZINC000036347734 571248891 /nfs/dbraw/zinc/24/88/91/571248891.db2.gz YLFLVCJJDJHLEI-XMMPIXPASA-N 0 3 360.501 5.191 50 0 FKAAHN CCOc1ccc([C@H]2c3cccn3CCCN2Cc2ccc(C)cc2)cc1 ZINC000036347735 205009703 /nfs/dbraw/zinc/00/97/03/205009703.db2.gz YLFLVCJJDJHLEI-DEOSSOPVSA-N 0 3 360.501 5.191 50 0 FKAAHN CCOc1ccc([C@@H]2c3cccn3CCCN2Cc2ccccc2C)cc1 ZINC000036347755 571248961 /nfs/dbraw/zinc/24/89/61/571248961.db2.gz YILPHCYMHZFQFF-XMMPIXPASA-N 0 3 360.501 5.191 50 0 FKAAHN CCOc1ccc([C@H]2c3cccn3CCCN2Cc2ccccc2C)cc1 ZINC000036347756 571249001 /nfs/dbraw/zinc/24/90/01/571249001.db2.gz YILPHCYMHZFQFF-DEOSSOPVSA-N 0 3 360.501 5.191 50 0 FKAAHN COc1ccc(CN2CCCn3cccc3[C@H]2c2ccc(C(C)C)cc2)cc1 ZINC000036348013 208153937 /nfs/dbraw/zinc/15/39/37/208153937.db2.gz UFISMVQIGMCTEO-RUZDIDTESA-N 0 3 374.528 5.615 50 0 FKAAHN COc1ccc(CN2CCCn3cccc3[C@@H]2c2ccc(C(C)C)cc2)cc1 ZINC000036348014 571249090 /nfs/dbraw/zinc/24/90/90/571249090.db2.gz UFISMVQIGMCTEO-VWLOTQADSA-N 0 3 374.528 5.615 50 0 FKAAHN CCc1ccc([C@@H]2c3cccn3CCCN2Cc2ccc(OC)cc2)cc1 ZINC000036348051 571249070 /nfs/dbraw/zinc/24/90/70/571249070.db2.gz SEJUPMIFTQGOQC-XMMPIXPASA-N 0 3 360.501 5.054 50 0 FKAAHN CCc1ccc([C@H]2c3cccn3CCCN2Cc2ccc(OC)cc2)cc1 ZINC000036348052 571249007 /nfs/dbraw/zinc/24/90/07/571249007.db2.gz SEJUPMIFTQGOQC-DEOSSOPVSA-N 0 3 360.501 5.054 50 0 FKAAHN CCc1ccc([C@@H]2c3cccn3CCCN2Cc2ccccc2CC)cc1 ZINC000036348091 571249017 /nfs/dbraw/zinc/24/90/17/571249017.db2.gz ZNLNZLDQAQPNOZ-RUZDIDTESA-N 0 3 358.529 5.608 50 0 FKAAHN CCc1ccc([C@H]2c3cccn3CCCN2Cc2ccccc2CC)cc1 ZINC000036348092 571249121 /nfs/dbraw/zinc/24/91/21/571249121.db2.gz ZNLNZLDQAQPNOZ-VWLOTQADSA-N 0 3 358.529 5.608 50 0 FKAAHN CCc1ccc(CN2CCCn3cccc3[C@@H]2c2cc(C)ccc2C)cc1 ZINC000036348135 205009746 /nfs/dbraw/zinc/00/97/46/205009746.db2.gz WLRMZFSUNFUTQP-VWLOTQADSA-N 0 3 358.529 5.663 50 0 FKAAHN CCc1ccc(CN2CCCn3cccc3[C@H]2c2cc(C)ccc2C)cc1 ZINC000036348136 205011409 /nfs/dbraw/zinc/01/14/09/205011409.db2.gz WLRMZFSUNFUTQP-RUZDIDTESA-N 0 3 358.529 5.663 50 0 FKAAHN COc1cccc(CN2CCCn3cccc3[C@H]2c2cc(C)ccc2C)c1 ZINC000036348137 571249043 /nfs/dbraw/zinc/24/90/43/571249043.db2.gz QLIMIXPYZUSZKX-XMMPIXPASA-N 0 3 360.501 5.109 50 0 FKAAHN COc1cccc(CN2CCCn3cccc3[C@@H]2c2cc(C)ccc2C)c1 ZINC000036348138 205009951 /nfs/dbraw/zinc/00/99/51/205009951.db2.gz QLIMIXPYZUSZKX-DEOSSOPVSA-N 0 3 360.501 5.109 50 0 FKAAHN CCOc1ccccc1CN1CCCn2cccc2[C@@H]1c1cc(C)ccc1C ZINC000036348145 571248940 /nfs/dbraw/zinc/24/89/40/571248940.db2.gz ALMNICHOCVHPCB-VWLOTQADSA-N 0 3 374.528 5.499 50 0 FKAAHN CCOc1ccccc1CN1CCCn2cccc2[C@H]1c1cc(C)ccc1C ZINC000036348146 205011383 /nfs/dbraw/zinc/01/13/83/205011383.db2.gz ALMNICHOCVHPCB-RUZDIDTESA-N 0 3 374.528 5.499 50 0 FKAAHN CCc1ccccc1CN1CCCn2cccc2[C@@H]1c1cccc(OC)c1 ZINC000036348351 571248869 /nfs/dbraw/zinc/24/88/69/571248869.db2.gz BGKDMZHETBGXSP-DEOSSOPVSA-N 0 3 360.501 5.054 50 0 FKAAHN CCc1ccccc1CN1CCCn2cccc2[C@H]1c1cccc(OC)c1 ZINC000036348352 571248909 /nfs/dbraw/zinc/24/89/09/571248909.db2.gz BGKDMZHETBGXSP-XMMPIXPASA-N 0 3 360.501 5.054 50 0 FKAAHN CCOc1ccc(CN2CCCn3cccc3[C@@H]2c2cccc(C)c2)cc1 ZINC000036348379 571248782 /nfs/dbraw/zinc/24/87/82/571248782.db2.gz UBHKBTJVXIDWMW-DEOSSOPVSA-N 0 3 360.501 5.191 50 0 FKAAHN CCOc1ccc(CN2CCCn3cccc3[C@H]2c2cccc(C)c2)cc1 ZINC000036348380 205010939 /nfs/dbraw/zinc/01/09/39/205010939.db2.gz UBHKBTJVXIDWMW-XMMPIXPASA-N 0 3 360.501 5.191 50 0 FKAAHN CCc1ccccc1[C@@H]1c2cccn2CCCN1Cc1cccc(OC)c1 ZINC000036348578 571249124 /nfs/dbraw/zinc/24/91/24/571249124.db2.gz QABBWNUTZNWSNG-XMMPIXPASA-N 0 3 360.501 5.054 50 0 FKAAHN CCc1ccccc1[C@H]1c2cccn2CCCN1Cc1cccc(OC)c1 ZINC000036348579 571249064 /nfs/dbraw/zinc/24/90/64/571249064.db2.gz QABBWNUTZNWSNG-DEOSSOPVSA-N 0 3 360.501 5.054 50 0 FKAAHN CNCc1ccc(Br)cc1Oc1cc(Cl)cc(Cl)c1 ZINC000036814582 204392839 /nfs/dbraw/zinc/39/28/39/204392839.db2.gz WHXXSQUZERNKOB-UHFFFAOYSA-N 0 3 361.066 5.268 50 0 FKAAHN CC(C)CN1CCCn2cccc2[C@@H]1c1cccc(Oc2ccccc2)c1 ZINC000037522379 205026622 /nfs/dbraw/zinc/02/66/22/205026622.db2.gz PFQQRVIUBXZMGS-DEOSSOPVSA-N 0 3 360.501 5.732 50 0 FKAAHN CC(C)CN1CCCn2cccc2[C@H]1c1cccc(Oc2ccccc2)c1 ZINC000037522380 571287111 /nfs/dbraw/zinc/28/71/11/571287111.db2.gz PFQQRVIUBXZMGS-XMMPIXPASA-N 0 3 360.501 5.732 50 0 FKAAHN CC(C)CCN1CCCn2cccc2[C@@H]1c1cccc(Oc2ccccc2)c1 ZINC000037522628 208181065 /nfs/dbraw/zinc/18/10/65/208181065.db2.gz PVYLJFWHOJXIIU-VWLOTQADSA-N 0 3 374.528 6.122 50 0 FKAAHN CC(C)CCN1CCCn2cccc2[C@H]1c1cccc(Oc2ccccc2)c1 ZINC000037522629 571287144 /nfs/dbraw/zinc/28/71/44/571287144.db2.gz PVYLJFWHOJXIIU-RUZDIDTESA-N 0 3 374.528 6.122 50 0 FKAAHN COc1cccc([C@H]2c3cccn3CCCN2Cc2ccc(C)c(C)c2)c1 ZINC000037522672 208180751 /nfs/dbraw/zinc/18/07/51/208180751.db2.gz JJSCZSWHBVYEMM-DEOSSOPVSA-N 0 3 360.501 5.109 50 0 FKAAHN COc1cccc([C@@H]2c3cccn3CCCN2Cc2ccc(C)c(C)c2)c1 ZINC000037522673 571287154 /nfs/dbraw/zinc/28/71/54/571287154.db2.gz JJSCZSWHBVYEMM-XMMPIXPASA-N 0 3 360.501 5.109 50 0 FKAAHN COc1cccc([C@H]2c3cccn3CCCN2Cc2cc(C)cc(C)c2)c1 ZINC000037522676 571287168 /nfs/dbraw/zinc/28/71/68/571287168.db2.gz CXCIMWDJNDSNGI-DEOSSOPVSA-N 0 3 360.501 5.109 50 0 FKAAHN COc1cccc([C@@H]2c3cccn3CCCN2Cc2cc(C)cc(C)c2)c1 ZINC000037522677 571287134 /nfs/dbraw/zinc/28/71/34/571287134.db2.gz CXCIMWDJNDSNGI-XMMPIXPASA-N 0 3 360.501 5.109 50 0 FKAAHN COc1ccc([C@H]2c3cccn3CCCN2Cc2cc(C)cc(C)c2)cc1 ZINC000037523109 571287347 /nfs/dbraw/zinc/28/73/47/571287347.db2.gz QHRVINKDFUZWCA-DEOSSOPVSA-N 0 3 360.501 5.109 50 0 FKAAHN COc1ccc([C@@H]2c3cccn3CCCN2Cc2cc(C)cc(C)c2)cc1 ZINC000037523110 571287224 /nfs/dbraw/zinc/28/72/24/571287224.db2.gz QHRVINKDFUZWCA-XMMPIXPASA-N 0 3 360.501 5.109 50 0 FKAAHN COc1ccc(CN2CCCn3cccc3[C@H]2c2ccc(C)c(C)c2)cc1 ZINC000037523541 208179474 /nfs/dbraw/zinc/17/94/74/208179474.db2.gz SJKYMBXATBPPQR-XMMPIXPASA-N 0 3 360.501 5.109 50 0 FKAAHN COc1ccc(CN2CCCn3cccc3[C@@H]2c2ccc(C)c(C)c2)cc1 ZINC000037523542 205027832 /nfs/dbraw/zinc/02/78/32/205027832.db2.gz SJKYMBXATBPPQR-DEOSSOPVSA-N 0 3 360.501 5.109 50 0 FKAAHN CCc1ccccc1CN1CCCn2cccc2[C@@H]1c1ccc(C)c(C)c1 ZINC000037523553 571287336 /nfs/dbraw/zinc/28/73/36/571287336.db2.gz BUBDNHDSMIXMFY-VWLOTQADSA-N 0 3 358.529 5.663 50 0 FKAAHN CCc1ccccc1CN1CCCn2cccc2[C@H]1c1ccc(C)c(C)c1 ZINC000037523554 208179537 /nfs/dbraw/zinc/17/95/37/208179537.db2.gz BUBDNHDSMIXMFY-RUZDIDTESA-N 0 3 358.529 5.663 50 0 FKAAHN Cc1ccc(N(C(=O)CC(C)C)C2CCN(Cc3ccccc3)CC2)cc1 ZINC000037559813 208182215 /nfs/dbraw/zinc/18/22/15/208182215.db2.gz NMOSUSJCCZMKSR-UHFFFAOYSA-N 0 3 364.533 5.039 50 0 FKAAHN CCCC(=O)N(c1ccc(C)cc1)C1CCN(Cc2ccc(C)cc2)CC1 ZINC000037560447 205027484 /nfs/dbraw/zinc/02/74/84/205027484.db2.gz FAUJGTKXUYSPPU-UHFFFAOYSA-N 0 3 364.533 5.101 50 0 FKAAHN CCCC(=O)N(c1ccc(C)cc1)C1CCN(Cc2cccc(C)c2)CC1 ZINC000037560842 208183161 /nfs/dbraw/zinc/18/31/61/208183161.db2.gz CGKFVODENSCBGK-UHFFFAOYSA-N 0 3 364.533 5.101 50 0 FKAAHN Cc1ccc(-c2nc3c4ccccc4ccn3c2CN2CCCCC2)cc1 ZINC000037868535 571322779 /nfs/dbraw/zinc/32/27/79/571322779.db2.gz QZVYGFRODQIGNJ-UHFFFAOYSA-N 0 3 355.485 5.449 50 0 FKAAHN CCn1c2ccccc2c2cc([C@H]3NCCc4c5ccccc5[nH]c43)ccc21 ZINC000038330957 208202363 /nfs/dbraw/zinc/20/23/63/208202363.db2.gz ASSWMQPRKRHWSP-XMMPIXPASA-N 0 3 365.480 5.531 50 0 FKAAHN CCn1c2ccccc2c2cc([C@@H]3NCCc4c5ccccc5[nH]c43)ccc21 ZINC000038330958 208200581 /nfs/dbraw/zinc/20/05/81/208200581.db2.gz ASSWMQPRKRHWSP-DEOSSOPVSA-N 0 3 365.480 5.531 50 0 FKAAHN CCN(CC)CCSc1nc(-c2ccccc2)c(-c2ccccc2)o1 ZINC000039369628 571000375 /nfs/dbraw/zinc/00/03/75/571000375.db2.gz NGXOVHNYDLBKOL-UHFFFAOYSA-N 0 3 352.503 5.443 50 0 FKAAHN C[C@@H](c1nc2ccccc2n1CCCc1ccccc1)N1CCCCCC1 ZINC000039917297 205048220 /nfs/dbraw/zinc/04/82/20/205048220.db2.gz JAKZSFLGYABANO-FQEVSTJZSA-N 0 3 361.533 5.606 50 0 FKAAHN C[C@H](c1nc2ccccc2n1CCCc1ccccc1)N1CCCCCC1 ZINC000039917298 208214346 /nfs/dbraw/zinc/21/43/46/208214346.db2.gz JAKZSFLGYABANO-HXUWFJFHSA-N 0 3 361.533 5.606 50 0 FKAAHN CC(C)c1cccc(C(C)C)c1NC(=O)NCc1ccc(CN(C)C)cc1 ZINC000040096315 571075822 /nfs/dbraw/zinc/07/58/22/571075822.db2.gz JHVMQIFUOGSMGJ-UHFFFAOYSA-N 0 3 367.537 5.317 50 0 FKAAHN CCCC(=O)Nc1ccc(CNCc2cc(-c3cccs3)cs2)cc1 ZINC000040120009 205056951 /nfs/dbraw/zinc/05/69/51/205056951.db2.gz QRXAVCQVIHIDBJ-UHFFFAOYSA-N 0 3 370.543 5.505 50 0 FKAAHN CC(C)(C)[C@H](NCC(=O)Nc1cc(Cl)ccc1Cl)c1cccs1 ZINC000040155744 208237828 /nfs/dbraw/zinc/23/78/28/208237828.db2.gz DCXVWZPCPFZXKQ-MRXNPFEDSA-N 0 3 371.333 5.370 50 0 FKAAHN CC(C)(C)[C@@H](NCC(=O)Nc1cc(Cl)ccc1Cl)c1cccs1 ZINC000040155745 208237784 /nfs/dbraw/zinc/23/77/84/208237784.db2.gz DCXVWZPCPFZXKQ-INIZCTEOSA-N 0 3 371.333 5.370 50 0 FKAAHN CC(C)(C)N(Cc1ccc2ccccc2n1)Cc1ccc2ccccc2n1 ZINC000040158668 571088546 /nfs/dbraw/zinc/08/85/46/571088546.db2.gz YKHPHKRSNUBIJD-UHFFFAOYSA-N 0 3 355.485 5.584 50 0 FKAAHN Fc1ccccc1CCNCc1ccc(-c2cccc(C(F)(F)F)c2)o1 ZINC000040721300 208264014 /nfs/dbraw/zinc/26/40/14/208264014.db2.gz YPFNGBOIJOTDAS-UHFFFAOYSA-N 0 3 363.354 5.437 50 0 FKAAHN Fc1ccc(CCNCc2ccc(-c3cccc(C(F)(F)F)c3)o2)cc1 ZINC000040721304 571092819 /nfs/dbraw/zinc/09/28/19/571092819.db2.gz CHHCXYNBAVGXFX-UHFFFAOYSA-N 0 3 363.354 5.437 50 0 FKAAHN Clc1ccccc1Cn1cc(CNCc2ccncc2)c2ccccc21 ZINC000040722050 208262678 /nfs/dbraw/zinc/26/26/78/208262678.db2.gz CVAKAQREHNSAED-UHFFFAOYSA-N 0 3 361.876 5.028 50 0 FKAAHN CCCOc1c(CNCCc2ccc(Cl)cc2)cc(Cl)cc1OC ZINC000040722220 208264262 /nfs/dbraw/zinc/26/42/62/208264262.db2.gz FDLSLGUWUFQMJX-UHFFFAOYSA-N 0 3 368.304 5.123 50 0 FKAAHN CCCOc1c(CN[C@@H](C)CCc2ccccc2)cc(Cl)cc1OC ZINC000040722227 208263706 /nfs/dbraw/zinc/26/37/06/208263706.db2.gz UHNRDENGIIFJGL-INIZCTEOSA-N 0 3 361.913 5.248 50 0 FKAAHN CCCOc1c(CN[C@H](C)CCc2ccccc2)cc(Cl)cc1OC ZINC000040722228 208264152 /nfs/dbraw/zinc/26/41/52/208264152.db2.gz UHNRDENGIIFJGL-MRXNPFEDSA-N 0 3 361.913 5.248 50 0 FKAAHN COc1cccc(CNCCC2=CCCCC2)c1OCc1cccc(C)c1 ZINC000040722285 205079063 /nfs/dbraw/zinc/07/90/63/205079063.db2.gz YPSUKGTVWNMACC-UHFFFAOYSA-N 0 3 365.517 5.563 50 0 FKAAHN COc1cccc(CNCCC2=CCCCC2)c1OCc1ccccc1C ZINC000040722345 205078218 /nfs/dbraw/zinc/07/82/18/205078218.db2.gz QMJKUMHXXAOMCP-UHFFFAOYSA-N 0 3 365.517 5.563 50 0 FKAAHN COc1cccc(CNC(C)(C)C)c1OCc1c(Cl)cccc1Cl ZINC000040722354 571236401 /nfs/dbraw/zinc/23/64/01/571236401.db2.gz SSZGHRYFUWFXAZ-UHFFFAOYSA-N 0 3 368.304 5.469 50 0 FKAAHN CCCCNCc1cccc(OC)c1OCc1c(Cl)cccc1Cl ZINC000040722362 571093156 /nfs/dbraw/zinc/09/31/56/571093156.db2.gz SYAPBLSFXFOTSS-UHFFFAOYSA-N 0 3 368.304 5.471 50 0 FKAAHN CCCNCc1cccc(OC)c1OCc1c(Cl)cccc1Cl ZINC000040722375 571236367 /nfs/dbraw/zinc/23/63/67/571236367.db2.gz SEUBOVHVNHZDAT-UHFFFAOYSA-N 0 3 354.277 5.081 50 0 FKAAHN CC[C@@H](C)NCc1cccc(OC)c1OCc1c(Cl)cccc1Cl ZINC000040722379 208264040 /nfs/dbraw/zinc/26/40/40/208264040.db2.gz ZMGNWWVZYVYWJJ-CYBMUJFWSA-N 0 3 368.304 5.469 50 0 FKAAHN CC[C@H](C)NCc1cccc(OC)c1OCc1c(Cl)cccc1Cl ZINC000040722380 205079036 /nfs/dbraw/zinc/07/90/36/205079036.db2.gz ZMGNWWVZYVYWJJ-ZDUSSCGKSA-N 0 3 368.304 5.469 50 0 FKAAHN COc1cccc(CNC(C)C)c1OCc1c(Cl)cccc1Cl ZINC000040722400 571236397 /nfs/dbraw/zinc/23/63/97/571236397.db2.gz KJPQLXKREXYHHN-UHFFFAOYSA-N 0 3 354.277 5.079 50 0 FKAAHN CCCCCNCc1cccc(OC)c1OCc1c(F)cccc1Cl ZINC000040722441 571093133 /nfs/dbraw/zinc/09/31/33/571093133.db2.gz OOKGZTHJOGFRJO-UHFFFAOYSA-N 0 3 365.876 5.347 50 0 FKAAHN COc1cccc(CNCCC(C)C)c1OCc1c(F)cccc1Cl ZINC000040722478 571093248 /nfs/dbraw/zinc/09/32/48/571093248.db2.gz UDOLOESTEJDPCP-UHFFFAOYSA-N 0 3 365.876 5.202 50 0 FKAAHN COc1cccc(CNC(C)(C)C)c1OCc1ccc(Cl)c(Cl)c1 ZINC000040722486 571236411 /nfs/dbraw/zinc/23/64/11/571236411.db2.gz PZZJVYMZAVASSW-UHFFFAOYSA-N 0 3 368.304 5.469 50 0 FKAAHN CCCCNCc1cccc(OC)c1OCc1ccc(Cl)c(Cl)c1 ZINC000040722494 208263719 /nfs/dbraw/zinc/26/37/19/208263719.db2.gz OLJZGOCXPPCJIS-UHFFFAOYSA-N 0 3 368.304 5.471 50 0 FKAAHN CCCNCc1cccc(OC)c1OCc1ccc(Cl)c(Cl)c1 ZINC000040722507 571236409 /nfs/dbraw/zinc/23/64/09/571236409.db2.gz ZWXHBOUFXJINLI-UHFFFAOYSA-N 0 3 354.277 5.081 50 0 FKAAHN CC[C@@H](C)NCc1cccc(OC)c1OCc1ccc(Cl)c(Cl)c1 ZINC000040722511 571093091 /nfs/dbraw/zinc/09/30/91/571093091.db2.gz CMXUKFJLWSGFEJ-CYBMUJFWSA-N 0 3 368.304 5.469 50 0 FKAAHN CC[C@H](C)NCc1cccc(OC)c1OCc1ccc(Cl)c(Cl)c1 ZINC000040722512 205079340 /nfs/dbraw/zinc/07/93/40/205079340.db2.gz CMXUKFJLWSGFEJ-ZDUSSCGKSA-N 0 3 368.304 5.469 50 0 FKAAHN COc1cccc(CNC(C)C)c1OCc1ccc(Cl)c(Cl)c1 ZINC000040722532 571236324 /nfs/dbraw/zinc/23/63/24/571236324.db2.gz HUNHAJYMGLEFFN-UHFFFAOYSA-N 0 3 354.277 5.079 50 0 FKAAHN CCCCCCNCc1cccc(OC)c1OCc1cccc(Cl)c1 ZINC000040722573 205078425 /nfs/dbraw/zinc/07/84/25/205078425.db2.gz UOBRDWSWHPKFNJ-UHFFFAOYSA-N 0 3 361.913 5.598 50 0 FKAAHN Clc1cccc(Cl)c1COc1ccc(CNCc2ccccc2)cc1 ZINC000040722729 208266327 /nfs/dbraw/zinc/26/63/27/208266327.db2.gz BMYOSBSXTIRJNG-UHFFFAOYSA-N 0 3 372.295 5.862 50 0 FKAAHN Clc1cccc(Cl)c1COc1ccc(CNCc2cccnc2)cc1 ZINC000040722742 571093182 /nfs/dbraw/zinc/09/31/82/571093182.db2.gz UITFYDMFRRVXTJ-UHFFFAOYSA-N 0 3 373.283 5.257 50 0 FKAAHN Clc1cccc(Cl)c1COc1ccc(CNCc2ccncc2)cc1 ZINC000040722779 571093202 /nfs/dbraw/zinc/09/32/02/571093202.db2.gz ZIPJTLBXFMPHQC-UHFFFAOYSA-N 0 3 373.283 5.257 50 0 FKAAHN Fc1ccc(COc2ccc(CNCc3ccccc3)cc2)c(Cl)c1 ZINC000040722793 208265246 /nfs/dbraw/zinc/26/52/46/208265246.db2.gz YSHGHTDHGZJZKY-UHFFFAOYSA-N 0 3 355.840 5.348 50 0 FKAAHN C[C@H](NCc1ccc(OCc2ccc(F)cc2Cl)cc1)c1ccccc1 ZINC000040722801 208266290 /nfs/dbraw/zinc/26/62/90/208266290.db2.gz FGAMAYVWKIKLKX-INIZCTEOSA-N 0 3 369.867 5.909 50 0 FKAAHN C[C@@H](NCc1ccc(OCc2ccc(F)cc2Cl)cc1)c1ccccc1 ZINC000040722802 571093190 /nfs/dbraw/zinc/09/31/90/571093190.db2.gz FGAMAYVWKIKLKX-MRXNPFEDSA-N 0 3 369.867 5.909 50 0 FKAAHN Fc1ccc(COc2ccc(CNCc3cccs3)cc2)c(Cl)c1 ZINC000040722812 571093066 /nfs/dbraw/zinc/09/30/66/571093066.db2.gz QIFZZRVCQKGGLS-UHFFFAOYSA-N 0 3 361.869 5.409 50 0 FKAAHN Fc1ccc(CNCc2ccc(OCc3ccc(F)cc3Cl)cc2)cc1 ZINC000040722827 571093213 /nfs/dbraw/zinc/09/32/13/571093213.db2.gz KHKZDBKXULTYJP-UHFFFAOYSA-N 0 3 373.830 5.487 50 0 FKAAHN Cc1ccc(CNCc2ccc(OCc3ccc(F)cc3Cl)cc2)cc1 ZINC000040722837 571093081 /nfs/dbraw/zinc/09/30/81/571093081.db2.gz JALHFPFUPHYEDA-UHFFFAOYSA-N 0 3 369.867 5.656 50 0 FKAAHN Fc1cccc(Cl)c1COc1ccc(CNCc2ccccc2)cc1 ZINC000040722857 571093531 /nfs/dbraw/zinc/09/35/31/571093531.db2.gz FEXXUHUOSSDNSX-UHFFFAOYSA-N 0 3 355.840 5.348 50 0 FKAAHN C[C@H](NCc1ccc(OCc2c(F)cccc2Cl)cc1)c1ccccc1 ZINC000040722864 205078094 /nfs/dbraw/zinc/07/80/94/205078094.db2.gz ULUMXJJBKLXYLT-INIZCTEOSA-N 0 3 369.867 5.909 50 0 FKAAHN C[C@@H](NCc1ccc(OCc2c(F)cccc2Cl)cc1)c1ccccc1 ZINC000040722865 205079184 /nfs/dbraw/zinc/07/91/84/205079184.db2.gz ULUMXJJBKLXYLT-MRXNPFEDSA-N 0 3 369.867 5.909 50 0 FKAAHN Fc1cccc(Cl)c1COc1ccc(CNCc2cccs2)cc1 ZINC000040722875 205078527 /nfs/dbraw/zinc/07/85/27/205078527.db2.gz CVTRKRIYWDERSB-UHFFFAOYSA-N 0 3 361.869 5.409 50 0 FKAAHN Fc1ccc(CNCc2ccc(OCc3c(F)cccc3Cl)cc2)cc1 ZINC000040722889 571093601 /nfs/dbraw/zinc/09/36/01/571093601.db2.gz MDVURLGKWDLBIX-UHFFFAOYSA-N 0 3 373.830 5.487 50 0 FKAAHN Cc1ccc(CNCc2ccc(OCc3c(F)cccc3Cl)cc2)cc1 ZINC000040722899 208265856 /nfs/dbraw/zinc/26/58/56/208265856.db2.gz IYOLKLLYRGWEID-UHFFFAOYSA-N 0 3 369.867 5.656 50 0 FKAAHN Clc1ccc(COc2ccc(CNCc3ccccc3)cc2)cc1Cl ZINC000040722919 571093517 /nfs/dbraw/zinc/09/35/17/571093517.db2.gz SFWWQBFOAWZOLN-UHFFFAOYSA-N 0 3 372.295 5.862 50 0 FKAAHN Clc1ccc(COc2ccc(CNCc3cccnc3)cc2)cc1Cl ZINC000040722932 571093597 /nfs/dbraw/zinc/09/35/97/571093597.db2.gz ZURKCSFKVBUSJC-UHFFFAOYSA-N 0 3 373.283 5.257 50 0 FKAAHN Clc1ccc(COc2ccc(CNCc3ccncc3)cc2)cc1Cl ZINC000040728013 205078174 /nfs/dbraw/zinc/07/81/74/205078174.db2.gz MCDSMHOZHGTUPZ-UHFFFAOYSA-N 0 3 373.283 5.257 50 0 FKAAHN C[C@H](NCc1ccc(OCc2cccc(Cl)c2)cc1)c1ccccc1 ZINC000040728102 205078122 /nfs/dbraw/zinc/07/81/22/205078122.db2.gz YHGARCSKNOWQHW-KRWDZBQOSA-N 0 3 351.877 5.770 50 0 FKAAHN C[C@@H](NCc1ccc(OCc2cccc(Cl)c2)cc1)c1ccccc1 ZINC000040728105 205078775 /nfs/dbraw/zinc/07/87/75/205078775.db2.gz YHGARCSKNOWQHW-QGZVFWFLSA-N 0 3 351.877 5.770 50 0 FKAAHN Fc1ccc(CNCc2ccc(OCc3cccc(Cl)c3)cc2)cc1 ZINC000040728165 220917928 /nfs/dbraw/zinc/91/79/28/220917928.db2.gz ILJUYECQKMNPDD-UHFFFAOYSA-N 0 3 355.840 5.348 50 0 FKAAHN Cc1ccc(CNCc2ccc(OCc3cccc(Cl)c3)cc2)cc1 ZINC000040728191 571093592 /nfs/dbraw/zinc/09/35/92/571093592.db2.gz FYIDWVFYWVIDOY-UHFFFAOYSA-N 0 3 351.877 5.517 50 0 FKAAHN COc1ccc(CNCc2ccc(OCc3cccc(Cl)c3)cc2)cc1 ZINC000040728194 208266448 /nfs/dbraw/zinc/26/64/48/208266448.db2.gz RCGKAJSZISQSBN-UHFFFAOYSA-N 0 3 367.876 5.217 50 0 FKAAHN COc1cc(Cl)cc(CNCCc2ccc(Cl)cc2)c1OC(C)C ZINC000040728407 208266068 /nfs/dbraw/zinc/26/60/68/208266068.db2.gz XALWAZNZBGPHSF-UHFFFAOYSA-N 0 3 368.304 5.122 50 0 FKAAHN COc1cc(Cl)cc(CN[C@@H](C)CCc2ccccc2)c1OC(C)C ZINC000040728428 205078641 /nfs/dbraw/zinc/07/86/41/205078641.db2.gz UJSAJAWCPNCQEX-INIZCTEOSA-N 0 3 361.913 5.247 50 0 FKAAHN COc1cc(Cl)cc(CN[C@H](C)CCc2ccccc2)c1OC(C)C ZINC000040728431 571093574 /nfs/dbraw/zinc/09/35/74/571093574.db2.gz UJSAJAWCPNCQEX-MRXNPFEDSA-N 0 3 361.913 5.247 50 0 FKAAHN CC(C)Oc1c(Cl)cc(Cl)cc1CNCCc1ccccc1F ZINC000040729830 571093991 /nfs/dbraw/zinc/09/39/91/571093991.db2.gz GVHSILGUWQYSCH-UHFFFAOYSA-N 0 3 356.268 5.252 50 0 FKAAHN CC(C)Oc1c(Cl)cc(Cl)cc1CNCCc1ccc(F)cc1 ZINC000040729833 571093927 /nfs/dbraw/zinc/09/39/27/571093927.db2.gz UCMNXFFUZCBUQD-UHFFFAOYSA-N 0 3 356.268 5.252 50 0 FKAAHN COc1ccc(CCNCc2cc(Cl)cc(Cl)c2OC(C)C)cc1 ZINC000040729836 205079108 /nfs/dbraw/zinc/07/91/08/205079108.db2.gz WLJLWIBRKFCISG-UHFFFAOYSA-N 0 3 368.304 5.122 50 0 FKAAHN COc1ccccc1CCNCc1cc(Cl)cc(Cl)c1OC(C)C ZINC000040729884 205078657 /nfs/dbraw/zinc/07/86/57/205078657.db2.gz KLQBZHBVZYUAON-UHFFFAOYSA-N 0 3 368.304 5.122 50 0 FKAAHN CC(C)Oc1c(Cl)cc(Cl)cc1CNCCc1ccc(Cl)cc1 ZINC000040729892 571094054 /nfs/dbraw/zinc/09/40/54/571094054.db2.gz GUKXRMDGPLBLOK-UHFFFAOYSA-N 0 3 372.723 5.766 50 0 FKAAHN CC(C)Oc1c(Cl)cc(Cl)cc1CN[C@@H](C)CCc1ccccc1 ZINC000040729912 205078599 /nfs/dbraw/zinc/07/85/99/205078599.db2.gz MIGWGMVYDGWOLG-HNNXBMFYSA-N 0 3 366.332 5.892 50 0 FKAAHN CC(C)Oc1c(Cl)cc(Cl)cc1CN[C@H](C)CCc1ccccc1 ZINC000040729915 571094001 /nfs/dbraw/zinc/09/40/01/571094001.db2.gz MIGWGMVYDGWOLG-OAHLLOKOSA-N 0 3 366.332 5.892 50 0 FKAAHN CC(C)Oc1ccc(Br)cc1CNCCC1=CCCCC1 ZINC000040730255 571094088 /nfs/dbraw/zinc/09/40/88/571094088.db2.gz RTVFXLMIVSMWFN-UHFFFAOYSA-N 0 3 352.316 5.216 50 0 FKAAHN CC(C)Oc1ccc(Cl)cc1CNCCc1ccc(Cl)cc1Cl ZINC000040730431 205078633 /nfs/dbraw/zinc/07/86/33/205078633.db2.gz SQYWLJFSJKJGBL-UHFFFAOYSA-N 0 3 372.723 5.766 50 0 FKAAHN CC(C)Oc1c(Cl)cc(CNCCc2ccccc2F)cc1Cl ZINC000040730723 571093910 /nfs/dbraw/zinc/09/39/10/571093910.db2.gz UIBYAOWLNXWJQH-UHFFFAOYSA-N 0 3 356.268 5.252 50 0 FKAAHN COc1ccc(CNCc2cc(Cl)c(OC(C)C)c(Cl)c2)cc1 ZINC000040730757 571093892 /nfs/dbraw/zinc/09/38/92/571093892.db2.gz PWEIEWYAEMPSRX-UHFFFAOYSA-N 0 3 354.277 5.079 50 0 FKAAHN Cc1cccc(COc2ccccc2CNCCc2ccc(Cl)cc2)c1 ZINC000040731504 571093908 /nfs/dbraw/zinc/09/39/08/571093908.db2.gz XKGGZGNSGVMTTM-UHFFFAOYSA-N 0 3 365.904 5.560 50 0 FKAAHN Cc1ccccc1COc1ccccc1CNCCc1ccc(Cl)cc1 ZINC000040731690 571094333 /nfs/dbraw/zinc/09/43/33/571094333.db2.gz HLQVNJCUQAZBIK-UHFFFAOYSA-N 0 3 365.904 5.560 50 0 FKAAHN CCOCCCNCc1ccccc1OCc1c(Cl)cccc1Cl ZINC000040731783 205078572 /nfs/dbraw/zinc/07/85/72/205078572.db2.gz FSAYDTQVVXHERM-UHFFFAOYSA-N 0 3 368.304 5.089 50 0 FKAAHN C[C@H](NCc1ccccc1OCc1ccc(F)cc1Cl)c1ccccc1 ZINC000040731953 571094510 /nfs/dbraw/zinc/09/45/10/571094510.db2.gz NACSSKCQIOBWOX-INIZCTEOSA-N 0 3 369.867 5.909 50 0 FKAAHN C[C@@H](NCc1ccccc1OCc1ccc(F)cc1Cl)c1ccccc1 ZINC000040731956 571094497 /nfs/dbraw/zinc/09/44/97/571094497.db2.gz NACSSKCQIOBWOX-MRXNPFEDSA-N 0 3 369.867 5.909 50 0 FKAAHN Fc1ccc(COc2ccccc2CNCCc2ccccc2)c(Cl)c1 ZINC000040731968 208266652 /nfs/dbraw/zinc/26/66/52/208266652.db2.gz RUEQMTFBNHZLGM-UHFFFAOYSA-N 0 3 369.867 5.390 50 0 FKAAHN Fc1ccc(COc2ccccc2CNCCC2=CCCCC2)c(Cl)c1 ZINC000040732111 571094379 /nfs/dbraw/zinc/09/43/79/571094379.db2.gz BWBFTYPCHRDKCY-UHFFFAOYSA-N 0 3 373.899 6.038 50 0 FKAAHN C[C@H](NCc1ccccc1OCc1c(F)cccc1Cl)c1ccccc1 ZINC000040732156 205078377 /nfs/dbraw/zinc/07/83/77/205078377.db2.gz YTDMSIOXDAFSSG-INIZCTEOSA-N 0 3 369.867 5.909 50 0 FKAAHN C[C@@H](NCc1ccccc1OCc1c(F)cccc1Cl)c1ccccc1 ZINC000040732158 571094421 /nfs/dbraw/zinc/09/44/21/571094421.db2.gz YTDMSIOXDAFSSG-MRXNPFEDSA-N 0 3 369.867 5.909 50 0 FKAAHN Fc1cccc(Cl)c1COc1ccccc1CNCCc1ccccc1 ZINC000040732169 205079102 /nfs/dbraw/zinc/07/91/02/205079102.db2.gz SWIMYQJIIYSGHR-UHFFFAOYSA-N 0 3 369.867 5.390 50 0 FKAAHN Fc1cccc(Cl)c1COc1ccccc1CNCCC1=CCCCC1 ZINC000040732308 571094516 /nfs/dbraw/zinc/09/45/16/571094516.db2.gz VEJOXEBHZDKEQU-UHFFFAOYSA-N 0 3 373.899 6.038 50 0 FKAAHN CCOCCCNCc1ccccc1OCc1ccc(Cl)c(Cl)c1 ZINC000040732388 571094523 /nfs/dbraw/zinc/09/45/23/571094523.db2.gz NNPVVGHKLYAUMQ-UHFFFAOYSA-N 0 3 368.304 5.089 50 0 FKAAHN C[C@H](NCc1ccccc1OCc1cccc(Cl)c1)c1ccccc1 ZINC000040732559 571094371 /nfs/dbraw/zinc/09/43/71/571094371.db2.gz FEZGAEDLEYWUTF-KRWDZBQOSA-N 0 3 351.877 5.770 50 0 FKAAHN C[C@@H](NCc1ccccc1OCc1cccc(Cl)c1)c1ccccc1 ZINC000040732562 571094454 /nfs/dbraw/zinc/09/44/54/571094454.db2.gz FEZGAEDLEYWUTF-QGZVFWFLSA-N 0 3 351.877 5.770 50 0 FKAAHN Clc1cccc(COc2ccccc2CNCCc2ccccc2)c1 ZINC000040732571 571094406 /nfs/dbraw/zinc/09/44/06/571094406.db2.gz GQWYSONLFZJJNF-UHFFFAOYSA-N 0 3 351.877 5.251 50 0 FKAAHN Fc1ccccc1CCNCc1ccccc1OCc1cccc(Cl)c1 ZINC000040732619 205078355 /nfs/dbraw/zinc/07/83/55/205078355.db2.gz KEIUHEJSTGPRJP-UHFFFAOYSA-N 0 3 369.867 5.390 50 0 FKAAHN Fc1ccc(CCNCc2ccccc2OCc2cccc(Cl)c2)cc1 ZINC000040732622 205078680 /nfs/dbraw/zinc/07/86/80/205078680.db2.gz SHINCSJWUFDQGJ-UHFFFAOYSA-N 0 3 369.867 5.390 50 0 FKAAHN CCCCOCCCNCc1ccccc1OCc1cccc(Cl)c1 ZINC000040732688 571094476 /nfs/dbraw/zinc/09/44/76/571094476.db2.gz JURGWQKJGCMZDO-UHFFFAOYSA-N 0 3 361.913 5.215 50 0 FKAAHN Clc1cccc(COc2ccccc2CNCCC2=CCCCC2)c1 ZINC000040732706 571094438 /nfs/dbraw/zinc/09/44/38/571094438.db2.gz UHCWMRGXKUVXJZ-UHFFFAOYSA-N 0 3 355.909 5.899 50 0 FKAAHN Cc1cccc(COc2ccc3ccccc3c2CNCc2ccccc2)c1 ZINC000040734768 208265169 /nfs/dbraw/zinc/26/51/69/208265169.db2.gz BSPMDEHKOUUJHA-UHFFFAOYSA-N 0 3 367.492 6.017 50 0 FKAAHN Cc1cccc(COc2ccc3ccccc3c2CNCc2cccs2)c1 ZINC000040734821 208264860 /nfs/dbraw/zinc/26/48/60/208264860.db2.gz YOUZMBALAFOFFF-UHFFFAOYSA-N 0 3 373.521 6.079 50 0 FKAAHN Cc1ccccc1COc1ccc2ccccc2c1CNCc1ccccc1 ZINC000040734982 571094870 /nfs/dbraw/zinc/09/48/70/571094870.db2.gz JSWHNFQOBZFFOP-UHFFFAOYSA-N 0 3 367.492 6.017 50 0 FKAAHN Cc1ccccc1COc1ccc2ccccc2c1CNCc1cccs1 ZINC000040735037 208265952 /nfs/dbraw/zinc/26/59/52/208265952.db2.gz UHZQZFPDAKPTCD-UHFFFAOYSA-N 0 3 373.521 6.079 50 0 FKAAHN Clc1cccc(Cl)c1COc1ccc2ccccc2c1CNC1CC1 ZINC000040735310 571236979 /nfs/dbraw/zinc/23/69/79/571236979.db2.gz XCQNHXAYWCJTJA-UHFFFAOYSA-N 0 3 372.295 5.978 50 0 FKAAHN Fc1ccc(COc2ccc3ccccc3c2CNC2CC2)c(Cl)c1 ZINC000040735521 571236944 /nfs/dbraw/zinc/23/69/44/571236944.db2.gz LNAIANHSYJJPGY-UHFFFAOYSA-N 0 3 355.840 5.463 50 0 FKAAHN Fc1cccc(Cl)c1COc1ccc2ccccc2c1CNC1CC1 ZINC000040735726 571236995 /nfs/dbraw/zinc/23/69/95/571236995.db2.gz HNLSNODIGDCYDK-UHFFFAOYSA-N 0 3 355.840 5.463 50 0 FKAAHN Clc1ccc(COc2ccc3ccccc3c2CNC2CC2)cc1Cl ZINC000040735931 571237107 /nfs/dbraw/zinc/23/71/07/571237107.db2.gz JVJOZYOQXCAQEN-UHFFFAOYSA-N 0 3 372.295 5.978 50 0 FKAAHN CCOc1cc(CNCc2ccccc2)ccc1OCc1cccc(C)c1 ZINC000040736437 208266847 /nfs/dbraw/zinc/26/68/47/208266847.db2.gz FDTULTNJFRDGQH-UHFFFAOYSA-N 0 3 361.485 5.263 50 0 FKAAHN CCOc1cc(CNCc2cccs2)ccc1OCc1cccc(C)c1 ZINC000040736493 571094896 /nfs/dbraw/zinc/09/48/96/571094896.db2.gz GCQSCPISQCDFIL-UHFFFAOYSA-N 0 3 367.514 5.324 50 0 FKAAHN CCOc1cc(CNCc2ccccc2)ccc1OCc1ccccc1C ZINC000040736644 205079473 /nfs/dbraw/zinc/07/94/73/205079473.db2.gz IPWWFSZGEIADBQ-UHFFFAOYSA-N 0 3 361.485 5.263 50 0 FKAAHN CCOc1cc(CNCc2cccs2)ccc1OCc1ccccc1C ZINC000040736698 571094965 /nfs/dbraw/zinc/09/49/65/571094965.db2.gz NPCMTRCRZKFDPB-UHFFFAOYSA-N 0 3 367.514 5.324 50 0 FKAAHN CCOc1cc(CNC2CC2)ccc1OCc1c(Cl)cccc1Cl ZINC000040736965 571237353 /nfs/dbraw/zinc/23/73/53/571237353.db2.gz BOCQQJFNODUEMN-UHFFFAOYSA-N 0 3 366.288 5.223 50 0 FKAAHN CCOc1cc(CNC2CC2)ccc1OCc1ccc(Cl)c(Cl)c1 ZINC000040737608 571237504 /nfs/dbraw/zinc/23/75/04/571237504.db2.gz LWCOPXOJSQZGSE-UHFFFAOYSA-N 0 3 366.288 5.223 50 0 FKAAHN Clc1cccc(Cl)c1COc1cccc(CNCc2ccccc2)c1 ZINC000040738383 571095273 /nfs/dbraw/zinc/09/52/73/571095273.db2.gz PLLGRILFCPQARM-UHFFFAOYSA-N 0 3 372.295 5.862 50 0 FKAAHN Clc1cccc(Cl)c1COc1cccc(CNCc2ccncc2)c1 ZINC000040738489 205078370 /nfs/dbraw/zinc/07/83/70/205078370.db2.gz KBXHQASJSAHSRD-UHFFFAOYSA-N 0 3 373.283 5.257 50 0 FKAAHN Fc1ccc(COc2cccc(CNCc3ccccc3)c2)c(Cl)c1 ZINC000040738519 211757923 /nfs/dbraw/zinc/75/79/23/211757923.db2.gz IHXJGGIQBHLKHU-UHFFFAOYSA-N 0 3 355.840 5.348 50 0 FKAAHN C[C@H](NCc1cccc(OCc2ccc(F)cc2Cl)c1)c1ccccc1 ZINC000040738535 571095175 /nfs/dbraw/zinc/09/51/75/571095175.db2.gz JNTZXPVQLGHXEB-INIZCTEOSA-N 0 3 369.867 5.909 50 0 FKAAHN C[C@@H](NCc1cccc(OCc2ccc(F)cc2Cl)c1)c1ccccc1 ZINC000040738537 571095344 /nfs/dbraw/zinc/09/53/44/571095344.db2.gz JNTZXPVQLGHXEB-MRXNPFEDSA-N 0 3 369.867 5.909 50 0 FKAAHN Fc1ccc(COc2cccc(CNCc3cccs3)c2)c(Cl)c1 ZINC000040738558 208265749 /nfs/dbraw/zinc/26/57/49/208265749.db2.gz AHQNCZJIZRYWPP-UHFFFAOYSA-N 0 3 361.869 5.409 50 0 FKAAHN Fc1ccc(CNCc2cccc(OCc3ccc(F)cc3Cl)c2)cc1 ZINC000040738589 571095214 /nfs/dbraw/zinc/09/52/14/571095214.db2.gz JPPSOOOTHJWXBC-UHFFFAOYSA-N 0 3 373.830 5.487 50 0 FKAAHN Cc1ccc(CNCc2cccc(OCc3ccc(F)cc3Cl)c2)cc1 ZINC000040738611 208265035 /nfs/dbraw/zinc/26/50/35/208265035.db2.gz VLQIULKECRVFLO-UHFFFAOYSA-N 0 3 369.867 5.656 50 0 FKAAHN Fc1cccc(Cl)c1COc1cccc(CNCc2ccccc2)c1 ZINC000040738657 205078944 /nfs/dbraw/zinc/07/89/44/205078944.db2.gz JHJCFOHNKLLKSI-UHFFFAOYSA-N 0 3 355.840 5.348 50 0 FKAAHN C[C@H](NCc1cccc(OCc2c(F)cccc2Cl)c1)c1ccccc1 ZINC000040738671 208265835 /nfs/dbraw/zinc/26/58/35/208265835.db2.gz RDLPIRFWSNQVNY-INIZCTEOSA-N 0 3 369.867 5.909 50 0 FKAAHN C[C@@H](NCc1cccc(OCc2c(F)cccc2Cl)c1)c1ccccc1 ZINC000040738673 571095203 /nfs/dbraw/zinc/09/52/03/571095203.db2.gz RDLPIRFWSNQVNY-MRXNPFEDSA-N 0 3 369.867 5.909 50 0 FKAAHN Fc1cccc(Cl)c1COc1cccc(CNCc2cccs2)c1 ZINC000040738693 571095290 /nfs/dbraw/zinc/09/52/90/571095290.db2.gz IOKMZGPFRWLIET-UHFFFAOYSA-N 0 3 361.869 5.409 50 0 FKAAHN Fc1ccc(CNCc2cccc(OCc3c(F)cccc3Cl)c2)cc1 ZINC000040738722 205078517 /nfs/dbraw/zinc/07/85/17/205078517.db2.gz YAIXHYVAJSKZKV-UHFFFAOYSA-N 0 3 373.830 5.487 50 0 FKAAHN Cc1ccc(CNCc2cccc(OCc3c(F)cccc3Cl)c2)cc1 ZINC000040738742 205078276 /nfs/dbraw/zinc/07/82/76/205078276.db2.gz ALAGJIDVDXMXOE-UHFFFAOYSA-N 0 3 369.867 5.656 50 0 FKAAHN Clc1ccc(COc2cccc(CNCc3ccccc3)c2)cc1Cl ZINC000040738789 205078935 /nfs/dbraw/zinc/07/89/35/205078935.db2.gz JVSCZVVNLFOQCS-UHFFFAOYSA-N 0 3 372.295 5.862 50 0 FKAAHN Clc1ccc(COc2cccc(CNCc3ccncc3)c2)cc1Cl ZINC000040738897 571095208 /nfs/dbraw/zinc/09/52/08/571095208.db2.gz AULSYHOTTZUCCR-UHFFFAOYSA-N 0 3 373.283 5.257 50 0 FKAAHN C[C@H](NCc1cccc(OCc2cccc(Cl)c2)c1)c1ccccc1 ZINC000040738941 571095350 /nfs/dbraw/zinc/09/53/50/571095350.db2.gz CPHSJHNFYZNOCX-KRWDZBQOSA-N 0 3 351.877 5.770 50 0 FKAAHN C[C@@H](NCc1cccc(OCc2cccc(Cl)c2)c1)c1ccccc1 ZINC000040738943 205080077 /nfs/dbraw/zinc/08/00/77/205080077.db2.gz CPHSJHNFYZNOCX-QGZVFWFLSA-N 0 3 351.877 5.770 50 0 FKAAHN Fc1ccc(CNCc2cccc(OCc3cccc(Cl)c3)c2)cc1 ZINC000040738984 205080558 /nfs/dbraw/zinc/08/05/58/205080558.db2.gz OZMISPBACFNVBH-UHFFFAOYSA-N 0 3 355.840 5.348 50 0 FKAAHN Cc1ccc(CNCc2cccc(OCc3cccc(Cl)c3)c2)cc1 ZINC000040739002 571095629 /nfs/dbraw/zinc/09/56/29/571095629.db2.gz QBRPFVGYOBINLO-UHFFFAOYSA-N 0 3 351.877 5.517 50 0 FKAAHN COc1ccc(CNCc2cccc(OCc3cccc(Cl)c3)c2)cc1 ZINC000040739004 571095719 /nfs/dbraw/zinc/09/57/19/571095719.db2.gz IAXNHMHIIAJBAO-UHFFFAOYSA-N 0 3 367.876 5.217 50 0 FKAAHN Cc1cccc(COc2ccc(Br)cc2CNC(C)(C)C)c1 ZINC000040739194 571237824 /nfs/dbraw/zinc/23/78/24/571237824.db2.gz ZKMWUMGHANNSAE-UHFFFAOYSA-N 0 3 362.311 5.225 50 0 FKAAHN CCCCNCc1cc(Br)ccc1OCc1cccc(C)c1 ZINC000040739210 205080846 /nfs/dbraw/zinc/08/08/46/205080846.db2.gz XCSQMBSLYKUEPR-UHFFFAOYSA-N 0 3 362.311 5.226 50 0 FKAAHN Cc1cccc(COc2ccc(Br)cc2CNC2CCCC2)c1 ZINC000040739212 571095763 /nfs/dbraw/zinc/09/57/63/571095763.db2.gz QCJVPWRXYRNWTA-UHFFFAOYSA-N 0 3 374.322 5.369 50 0 FKAAHN CC[C@@H](C)NCc1cc(Br)ccc1OCc1cccc(C)c1 ZINC000040739240 205079707 /nfs/dbraw/zinc/07/97/07/205079707.db2.gz DXZXTZIIKICOKN-OAHLLOKOSA-N 0 3 362.311 5.225 50 0 FKAAHN CC[C@H](C)NCc1cc(Br)ccc1OCc1cccc(C)c1 ZINC000040739242 571095623 /nfs/dbraw/zinc/09/56/23/571095623.db2.gz DXZXTZIIKICOKN-HNNXBMFYSA-N 0 3 362.311 5.225 50 0 FKAAHN Cc1ccccc1COc1ccc(Br)cc1CNC(C)(C)C ZINC000040739327 571237738 /nfs/dbraw/zinc/23/77/38/571237738.db2.gz HNOWQVZYTBFFCC-UHFFFAOYSA-N 0 3 362.311 5.225 50 0 FKAAHN CCCCNCc1cc(Br)ccc1OCc1ccccc1C ZINC000040739343 571095463 /nfs/dbraw/zinc/09/54/63/571095463.db2.gz HUJZSEMVOXBJTF-UHFFFAOYSA-N 0 3 362.311 5.226 50 0 FKAAHN Cc1ccccc1COc1ccc(Br)cc1CNC1CCCC1 ZINC000040739345 208266178 /nfs/dbraw/zinc/26/61/78/208266178.db2.gz SMJRCRZZFMNUKQ-UHFFFAOYSA-N 0 3 374.322 5.369 50 0 FKAAHN CC[C@@H](C)NCc1cc(Br)ccc1OCc1ccccc1C ZINC000040739372 571095661 /nfs/dbraw/zinc/09/56/61/571095661.db2.gz DTKQRHWSQBUTKL-OAHLLOKOSA-N 0 3 362.311 5.225 50 0 FKAAHN CC[C@H](C)NCc1cc(Br)ccc1OCc1ccccc1C ZINC000040739374 571095637 /nfs/dbraw/zinc/09/56/37/571095637.db2.gz DTKQRHWSQBUTKL-HNNXBMFYSA-N 0 3 362.311 5.225 50 0 FKAAHN CCCNCc1cc(Br)ccc1OCc1cccc(Cl)c1 ZINC000040739872 571237704 /nfs/dbraw/zinc/23/77/04/571237704.db2.gz JNVMWZIXBPCGDJ-UHFFFAOYSA-N 0 3 368.702 5.181 50 0 FKAAHN CC(C)NCc1cc(Br)ccc1OCc1cccc(Cl)c1 ZINC000040739913 571237681 /nfs/dbraw/zinc/23/76/81/571237681.db2.gz YNVZGINUSSBICU-UHFFFAOYSA-N 0 3 368.702 5.180 50 0 FKAAHN CCOc1cc(CNC2CC2)cc(Cl)c1OCc1cccc(Cl)c1 ZINC000040742254 571095588 /nfs/dbraw/zinc/09/55/88/571095588.db2.gz RASGCZQDULQKBS-UHFFFAOYSA-N 0 3 366.288 5.223 50 0 FKAAHN Cc1cccc(COc2ccc(Cl)cc2CNCCc2ccccc2)c1 ZINC000040742903 571095595 /nfs/dbraw/zinc/09/55/95/571095595.db2.gz JRIOUBQANRXMOO-UHFFFAOYSA-N 0 3 365.904 5.560 50 0 FKAAHN Cc1cccc(COc2ccc(Cl)cc2CNCCCOC(C)C)c1 ZINC000040742946 208266378 /nfs/dbraw/zinc/26/63/78/208266378.db2.gz YCKLAEAWYYBWPJ-UHFFFAOYSA-N 0 3 361.913 5.132 50 0 FKAAHN Cc1cccc(COc2ccc(Cl)cc2CNCCC2=CCCCC2)c1 ZINC000040742949 205079894 /nfs/dbraw/zinc/07/98/94/205079894.db2.gz HMIBYWSIURBXPS-UHFFFAOYSA-N 0 3 369.936 6.208 50 0 FKAAHN Cc1ccccc1COc1ccc(Cl)cc1CNCCc1ccccc1 ZINC000040742968 205080115 /nfs/dbraw/zinc/08/01/15/205080115.db2.gz LAXKBHLUIGCEEN-UHFFFAOYSA-N 0 3 365.904 5.560 50 0 FKAAHN Cc1ccccc1COc1ccc(Cl)cc1CNCCCOC(C)C ZINC000040743032 208267201 /nfs/dbraw/zinc/26/72/01/208267201.db2.gz AUSIMPTZAQRADB-UHFFFAOYSA-N 0 3 361.913 5.132 50 0 FKAAHN Cc1ccccc1COc1ccc(Cl)cc1CNCCC1=CCCCC1 ZINC000040743038 571095758 /nfs/dbraw/zinc/09/57/58/571095758.db2.gz FQTJVWWEMWSHRZ-UHFFFAOYSA-N 0 3 369.936 6.208 50 0 FKAAHN CC(C)(C)NCc1cc(Cl)ccc1OCc1c(Cl)cccc1Cl ZINC000040743055 571238763 /nfs/dbraw/zinc/23/87/63/571238763.db2.gz CJHRDCZYWHQYRX-UHFFFAOYSA-N 0 3 372.723 6.114 50 0 FKAAHN CCCCNCc1cc(Cl)ccc1OCc1c(Cl)cccc1Cl ZINC000040743071 571095713 /nfs/dbraw/zinc/09/57/13/571095713.db2.gz VOSVYGDCJIEFHE-UHFFFAOYSA-N 0 3 372.723 6.116 50 0 FKAAHN CCCNCc1cc(Cl)ccc1OCc1c(Cl)cccc1Cl ZINC000040743096 571238856 /nfs/dbraw/zinc/23/88/56/571238856.db2.gz SBWZWCAYHFFVJG-UHFFFAOYSA-N 0 3 358.696 5.725 50 0 FKAAHN CC(C)CNCc1cc(Cl)ccc1OCc1c(Cl)cccc1Cl ZINC000040743102 571238850 /nfs/dbraw/zinc/23/88/50/571238850.db2.gz QXDUWOOVSXCVFO-UHFFFAOYSA-N 0 3 372.723 5.971 50 0 FKAAHN CC[C@@H](C)NCc1cc(Cl)ccc1OCc1c(Cl)cccc1Cl ZINC000040743104 205080283 /nfs/dbraw/zinc/08/02/83/205080283.db2.gz YHQSAVKSYCDJRE-GFCCVEGCSA-N 0 3 372.723 6.114 50 0 FKAAHN CC[C@H](C)NCc1cc(Cl)ccc1OCc1c(Cl)cccc1Cl ZINC000040743106 208267880 /nfs/dbraw/zinc/26/78/80/208267880.db2.gz YHQSAVKSYCDJRE-LBPRGKRZSA-N 0 3 372.723 6.114 50 0 FKAAHN Clc1ccc(OCc2c(Cl)cccc2Cl)c(CNC2CC2)c1 ZINC000040743126 571238730 /nfs/dbraw/zinc/23/87/30/571238730.db2.gz HTXXBOKTRFWUBK-UHFFFAOYSA-N 0 3 356.680 5.478 50 0 FKAAHN CC(C)NCc1cc(Cl)ccc1OCc1c(Cl)cccc1Cl ZINC000040743144 571238843 /nfs/dbraw/zinc/23/88/43/571238843.db2.gz JKNUYTQVSWWEKV-UHFFFAOYSA-N 0 3 358.696 5.724 50 0 FKAAHN CC(C)(C)NCc1cc(Cl)ccc1OCc1ccc(F)cc1Cl ZINC000040743180 571238608 /nfs/dbraw/zinc/23/86/08/571238608.db2.gz ITCLDLSVBHLQRN-UHFFFAOYSA-N 0 3 356.268 5.600 50 0 FKAAHN CCCCNCc1cc(Cl)ccc1OCc1ccc(F)cc1Cl ZINC000040743194 571095472 /nfs/dbraw/zinc/09/54/72/571095472.db2.gz TZMSIMJYMOQEKR-UHFFFAOYSA-N 0 3 356.268 5.601 50 0 FKAAHN Fc1ccc(COc2ccc(Cl)cc2CNC2CCCC2)c(Cl)c1 ZINC000040743195 571095641 /nfs/dbraw/zinc/09/56/41/571095641.db2.gz AWERPLNPARQZJL-UHFFFAOYSA-N 0 3 368.279 5.744 50 0 FKAAHN CCCCCNCc1cc(Cl)ccc1OCc1ccc(F)cc1Cl ZINC000040743217 571095554 /nfs/dbraw/zinc/09/55/54/571095554.db2.gz MONLAKWBXTYSEY-UHFFFAOYSA-N 0 3 370.295 5.991 50 0 FKAAHN CC(C)CNCc1cc(Cl)ccc1OCc1ccc(F)cc1Cl ZINC000040743220 571238639 /nfs/dbraw/zinc/23/86/39/571238639.db2.gz KTAUIBXDAQIXON-UHFFFAOYSA-N 0 3 356.268 5.457 50 0 FKAAHN CC[C@@H](C)NCc1cc(Cl)ccc1OCc1ccc(F)cc1Cl ZINC000040743222 571095769 /nfs/dbraw/zinc/09/57/69/571095769.db2.gz YRQVCPYAOAOHSH-GFCCVEGCSA-N 0 3 356.268 5.600 50 0 FKAAHN CC[C@H](C)NCc1cc(Cl)ccc1OCc1ccc(F)cc1Cl ZINC000040743224 208269069 /nfs/dbraw/zinc/26/90/69/208269069.db2.gz YRQVCPYAOAOHSH-LBPRGKRZSA-N 0 3 356.268 5.600 50 0 FKAAHN CC(C)CCNCc1cc(Cl)ccc1OCc1ccc(F)cc1Cl ZINC000040743286 205080834 /nfs/dbraw/zinc/08/08/34/205080834.db2.gz MYFDDKZBBCMXBJ-UHFFFAOYSA-N 0 3 370.295 5.847 50 0 FKAAHN CCC(C)(C)NCc1cc(Cl)ccc1OCc1ccc(F)cc1Cl ZINC000040743287 571096154 /nfs/dbraw/zinc/09/61/54/571096154.db2.gz ZMDGOFXDMQZKGI-UHFFFAOYSA-N 0 3 370.295 5.990 50 0 FKAAHN CC(C)(C)NCc1cc(Cl)ccc1OCc1c(F)cccc1Cl ZINC000040743300 571238631 /nfs/dbraw/zinc/23/86/31/571238631.db2.gz XUNKEKMSEYMVKD-UHFFFAOYSA-N 0 3 356.268 5.600 50 0 FKAAHN CCCCNCc1cc(Cl)ccc1OCc1c(F)cccc1Cl ZINC000040743312 208267443 /nfs/dbraw/zinc/26/74/43/208267443.db2.gz UDJASVDNUXSRDC-UHFFFAOYSA-N 0 3 356.268 5.601 50 0 FKAAHN Fc1cccc(Cl)c1COc1ccc(Cl)cc1CNC1CCCC1 ZINC000040743314 571096072 /nfs/dbraw/zinc/09/60/72/571096072.db2.gz FEKPNQUMOMWNNY-UHFFFAOYSA-N 0 3 368.279 5.744 50 0 FKAAHN CCCCCNCc1cc(Cl)ccc1OCc1c(F)cccc1Cl ZINC000040743336 205079722 /nfs/dbraw/zinc/07/97/22/205079722.db2.gz DVUSFHVROJRZGU-UHFFFAOYSA-N 0 3 370.295 5.991 50 0 FKAAHN CC(C)CNCc1cc(Cl)ccc1OCc1c(F)cccc1Cl ZINC000040743340 571238662 /nfs/dbraw/zinc/23/86/62/571238662.db2.gz CHNYRZBLQLCIJW-UHFFFAOYSA-N 0 3 356.268 5.457 50 0 FKAAHN CC[C@@H](C)NCc1cc(Cl)ccc1OCc1c(F)cccc1Cl ZINC000040743341 205079863 /nfs/dbraw/zinc/07/98/63/205079863.db2.gz KTLIXNOHWOVONW-GFCCVEGCSA-N 0 3 356.268 5.600 50 0 FKAAHN CC[C@H](C)NCc1cc(Cl)ccc1OCc1c(F)cccc1Cl ZINC000040743342 205080876 /nfs/dbraw/zinc/08/08/76/205080876.db2.gz KTLIXNOHWOVONW-LBPRGKRZSA-N 0 3 356.268 5.600 50 0 FKAAHN CC(C)CCNCc1cc(Cl)ccc1OCc1c(F)cccc1Cl ZINC000040743405 205080334 /nfs/dbraw/zinc/08/03/34/205080334.db2.gz CAJWOQLAFRWKCQ-UHFFFAOYSA-N 0 3 370.295 5.847 50 0 FKAAHN CCC(C)(C)NCc1cc(Cl)ccc1OCc1c(F)cccc1Cl ZINC000040743407 571095892 /nfs/dbraw/zinc/09/58/92/571095892.db2.gz OVVWSNUMSJQYJF-UHFFFAOYSA-N 0 3 370.295 5.990 50 0 FKAAHN CC(C)(C)NCc1cc(Cl)ccc1OCc1ccc(Cl)c(Cl)c1 ZINC000040743420 571238538 /nfs/dbraw/zinc/23/85/38/571238538.db2.gz LNMRRKHVLYYNOA-UHFFFAOYSA-N 0 3 372.723 6.114 50 0 FKAAHN CCCCNCc1cc(Cl)ccc1OCc1ccc(Cl)c(Cl)c1 ZINC000040743433 571096150 /nfs/dbraw/zinc/09/61/50/571096150.db2.gz KPWWCXKRDSUAHS-UHFFFAOYSA-N 0 3 372.723 6.116 50 0 FKAAHN CCCNCc1cc(Cl)ccc1OCc1ccc(Cl)c(Cl)c1 ZINC000040743448 571150372 /nfs/dbraw/zinc/15/03/72/571150372.db2.gz UHPRVOKFDRMQBP-UHFFFAOYSA-N 0 3 358.696 5.725 50 0 FKAAHN CC(C)CNCc1cc(Cl)ccc1OCc1ccc(Cl)c(Cl)c1 ZINC000040743451 571238863 /nfs/dbraw/zinc/23/88/63/571238863.db2.gz BTVBOQUOEPDQAE-UHFFFAOYSA-N 0 3 372.723 5.971 50 0 FKAAHN CC[C@@H](C)NCc1cc(Cl)ccc1OCc1ccc(Cl)c(Cl)c1 ZINC000040743452 205079873 /nfs/dbraw/zinc/07/98/73/205079873.db2.gz LEIBPINOMSKZCH-GFCCVEGCSA-N 0 3 372.723 6.114 50 0 FKAAHN CC[C@H](C)NCc1cc(Cl)ccc1OCc1ccc(Cl)c(Cl)c1 ZINC000040743453 205080043 /nfs/dbraw/zinc/08/00/43/205080043.db2.gz LEIBPINOMSKZCH-LBPRGKRZSA-N 0 3 372.723 6.114 50 0 FKAAHN Clc1ccc(OCc2ccc(Cl)c(Cl)c2)c(CNC2CC2)c1 ZINC000040743465 571238826 /nfs/dbraw/zinc/23/88/26/571238826.db2.gz OORSRZUVDCJWTL-UHFFFAOYSA-N 0 3 356.680 5.478 50 0 FKAAHN CC(C)NCc1cc(Cl)ccc1OCc1ccc(Cl)c(Cl)c1 ZINC000040743476 208974348 /nfs/dbraw/zinc/97/43/48/208974348.db2.gz MAATYHFLAXHZKL-UHFFFAOYSA-N 0 3 358.696 5.724 50 0 FKAAHN Clc1cccc(COc2ccc(Cl)cc2CNC2CCCC2)c1 ZINC000040743506 208267970 /nfs/dbraw/zinc/26/79/70/208267970.db2.gz HJZOHZXOMUVVFD-UHFFFAOYSA-N 0 3 350.289 5.605 50 0 FKAAHN CCOCCCNCc1cc(Cl)ccc1OCc1cccc(Cl)c1 ZINC000040743516 208268990 /nfs/dbraw/zinc/26/89/90/208268990.db2.gz SIEZAWZCKKQNGT-UHFFFAOYSA-N 0 3 368.304 5.089 50 0 FKAAHN CCCCCNCc1cc(Cl)ccc1OCc1cccc(Cl)c1 ZINC000040743518 571096070 /nfs/dbraw/zinc/09/60/70/571096070.db2.gz HWPFYUFHEZNGNL-UHFFFAOYSA-N 0 3 352.305 5.852 50 0 FKAAHN CCCCCCNCc1cc(Cl)ccc1OCc1cccc(Cl)c1 ZINC000040743519 205079685 /nfs/dbraw/zinc/07/96/85/205079685.db2.gz GXMRSJVBMXOSKD-UHFFFAOYSA-N 0 3 366.332 6.242 50 0 FKAAHN CC(C)CCNCc1cc(Cl)ccc1OCc1cccc(Cl)c1 ZINC000040743559 571095987 /nfs/dbraw/zinc/09/59/87/571095987.db2.gz GFCAGZRHSNMVNA-UHFFFAOYSA-N 0 3 352.305 5.708 50 0 FKAAHN CCC(C)(C)NCc1cc(Cl)ccc1OCc1cccc(Cl)c1 ZINC000040743560 208267242 /nfs/dbraw/zinc/26/72/42/208267242.db2.gz MTKQSCZRUIMFHF-UHFFFAOYSA-N 0 3 352.305 5.851 50 0 FKAAHN Cc1cc(NCCSc2cc(C)nc3ccccc32)c2ccccc2n1 ZINC000041105092 571107586 /nfs/dbraw/zinc/10/75/86/571107586.db2.gz XYSLJWMLHUWOBC-UHFFFAOYSA-N 0 3 359.498 5.604 50 0 FKAAHN Cc1c2cc(Cl)ccc2oc1C(=O)Nc1ccccc1CN1CCCC1 ZINC000041971040 208289850 /nfs/dbraw/zinc/28/98/50/208289850.db2.gz PWXSUJJBCYBWRG-UHFFFAOYSA-N 0 3 368.864 5.243 50 0 FKAAHN Fc1cccc(-c2c[nH]nc2[C@H]2CCCN(Cc3cc4ccccc4[nH]3)C2)c1 ZINC000042926008 571099209 /nfs/dbraw/zinc/09/92/09/571099209.db2.gz RZXKACSUNIEBSH-SFHVURJKSA-N 0 3 374.463 5.077 50 0 FKAAHN Fc1cccc(-c2c[nH]nc2[C@@H]2CCCN(Cc3cc4ccccc4[nH]3)C2)c1 ZINC000042926011 571099222 /nfs/dbraw/zinc/09/92/22/571099222.db2.gz RZXKACSUNIEBSH-GOSISDBHSA-N 0 3 374.463 5.077 50 0 FKAAHN Cc1ccc(CN2CCC[C@@H](c3n[nH]cc3-c3ccc(Cl)cc3)C2)o1 ZINC000042926032 571099263 /nfs/dbraw/zinc/09/92/63/571099263.db2.gz NNZUWYVTMUFIFP-MRXNPFEDSA-N 0 3 355.869 5.011 50 0 FKAAHN COc1ccc([C@@H]2CCCN2Cc2ccc(OCc3ccccn3)cc2)cc1 ZINC000048313266 205158742 /nfs/dbraw/zinc/15/87/42/205158742.db2.gz NCWAUFQDAHEXCW-DEOSSOPVSA-N 0 3 374.484 5.006 50 0 FKAAHN COc1ccc([C@H]2CCCN2Cc2ccc(OCc3ccccn3)cc2)cc1 ZINC000048313269 221007238 /nfs/dbraw/zinc/00/72/38/221007238.db2.gz NCWAUFQDAHEXCW-XMMPIXPASA-N 0 3 374.484 5.006 50 0 FKAAHN CC[C@@H](c1ccc(Cl)cc1)N1CCC(C(=O)Nc2ccccc2)CC1 ZINC000048365515 570952134 /nfs/dbraw/zinc/95/21/34/570952134.db2.gz HVNRLNPKOGEHCJ-FQEVSTJZSA-N 0 3 356.897 5.142 50 0 FKAAHN CC[C@H](c1ccc(Cl)cc1)N1CCC(C(=O)Nc2ccccc2)CC1 ZINC000048365517 570952020 /nfs/dbraw/zinc/95/20/20/570952020.db2.gz HVNRLNPKOGEHCJ-HXUWFJFHSA-N 0 3 356.897 5.142 50 0 FKAAHN C[C@@H](c1ccccc1)N1CCN(C(c2ccccc2)c2ccccc2)CC1 ZINC000048523114 571308712 /nfs/dbraw/zinc/30/87/12/571308712.db2.gz QGWUTVQQOHVLMZ-NRFANRHFSA-N 0 3 356.513 5.155 50 0 FKAAHN C[C@H](c1ccccc1)N1CCN(C(c2ccccc2)c2ccccc2)CC1 ZINC000048523116 571308729 /nfs/dbraw/zinc/30/87/29/571308729.db2.gz QGWUTVQQOHVLMZ-OAQYLSRUSA-N 0 3 356.513 5.155 50 0 FKAAHN CC(C)Oc1ccc([C@@H](CCNCc2ccco2)C2CCCCC2)cc1 ZINC000050690240 519781699 /nfs/dbraw/zinc/78/16/99/519781699.db2.gz DIECDKRJLGHYQI-QHCPKHFHSA-N 0 3 355.522 5.911 50 0 FKAAHN CC(C)Oc1ccc([C@H](CCNCc2ccco2)C2CCCCC2)cc1 ZINC000050690244 519781931 /nfs/dbraw/zinc/78/19/31/519781931.db2.gz DIECDKRJLGHYQI-HSZRJFAPSA-N 0 3 355.522 5.911 50 0 FKAAHN CN(Cc1c(-c2ccc(Cl)cc2)nc2ccccn21)Cc1ccccc1 ZINC000052518700 571146225 /nfs/dbraw/zinc/14/62/25/571146225.db2.gz KRXKKZZBPXEEOS-UHFFFAOYSA-N 0 3 361.876 5.287 50 0 FKAAHN Cc1ccc(-c2n[nH]cc2CNCc2ccccc2C(F)(F)F)cc1C ZINC000055182895 571117411 /nfs/dbraw/zinc/11/74/11/571117411.db2.gz UFVZGRCTYUQNRR-UHFFFAOYSA-N 0 3 359.395 5.002 50 0 FKAAHN Cc1ccc(C)c(N2CCN(Cc3ccc(-c4ccccc4)cc3)CC2)c1 ZINC000055292383 136126337 /nfs/dbraw/zinc/12/63/37/136126337.db2.gz KFNAGRQLJNKEHU-UHFFFAOYSA-N 0 3 356.513 5.293 50 0 FKAAHN Cc1cccc(N2CCN(Cc3ccc(-c4ccccc4)cc3)CC2)c1C ZINC000055543097 136126833 /nfs/dbraw/zinc/12/68/33/136126833.db2.gz NOTFDGCORKMBJX-UHFFFAOYSA-N 0 3 356.513 5.293 50 0 FKAAHN Clc1cccc(N2CCN(Cc3ccc(-c4ccccc4)cc3)CC2)c1 ZINC000055543351 136127058 /nfs/dbraw/zinc/12/70/58/136127058.db2.gz BJSSPDCHHGOOCH-UHFFFAOYSA-N 0 3 362.904 5.329 50 0 FKAAHN FC(F)(F)c1cccc(N2CCN(Cc3ccc4ccccc4c3)CC2)c1 ZINC000055543769 136126909 /nfs/dbraw/zinc/12/69/09/136126909.db2.gz QQQLCXVTAFVNLH-UHFFFAOYSA-N 0 3 370.418 5.181 50 0 FKAAHN Clc1ccc(N2CCN(Cc3ccc(-c4ccccc4)cc3)CC2)cc1 ZINC000055544047 136127015 /nfs/dbraw/zinc/12/70/15/136127015.db2.gz MJGNPVDNOOVJSN-UHFFFAOYSA-N 0 3 362.904 5.329 50 0 FKAAHN CCn1c2ccccc2c2cc(CN3CCN(c4ccccc4)CC3)ccc21 ZINC000055544048 136127052 /nfs/dbraw/zinc/12/70/52/136127052.db2.gz AOHNWMLKNQDQLD-UHFFFAOYSA-N 0 3 369.512 5.137 50 0 FKAAHN Cc1ccccc1C(=O)O[C@@H](C)CN(Cc1ccccc1)Cc1ccccc1 ZINC000057222614 221084820 /nfs/dbraw/zinc/08/48/20/221084820.db2.gz YIFAYJNANLGLDI-NRFANRHFSA-N 0 3 373.496 5.243 50 0 FKAAHN Cc1ccccc1C(=O)O[C@H](C)CN(Cc1ccccc1)Cc1ccccc1 ZINC000057222617 205237249 /nfs/dbraw/zinc/23/72/49/205237249.db2.gz YIFAYJNANLGLDI-OAQYLSRUSA-N 0 3 373.496 5.243 50 0 FKAAHN CCN(Cc1cccs1)Cc1ccc(C(=O)Nc2ccccc2)cc1 ZINC000057281310 571342504 /nfs/dbraw/zinc/34/25/04/571342504.db2.gz CORGQUPUSWZLDY-UHFFFAOYSA-N 0 3 350.487 5.023 50 0 FKAAHN CC1=C(C)[C@H](NC2CCCCCCCCCCC2)N(CCC(C)C)C1=O ZINC000057284639 205236453 /nfs/dbraw/zinc/23/64/53/205236453.db2.gz HEFFFXUAQCILGO-JOCHJYFZSA-N 0 3 362.602 5.800 50 0 FKAAHN C[C@H](NCc1ccc(-c2ccccc2)s1)c1ccc(-n2ccnc2)cc1 ZINC000057801148 205244181 /nfs/dbraw/zinc/24/41/81/205244181.db2.gz NPCFOCFPUPOJHX-KRWDZBQOSA-N 0 3 359.498 5.452 50 0 FKAAHN C[C@@H](NCc1ccc(-c2ccccc2)s1)c1ccc(-n2ccnc2)cc1 ZINC000057801151 205243736 /nfs/dbraw/zinc/24/37/36/205243736.db2.gz NPCFOCFPUPOJHX-QGZVFWFLSA-N 0 3 359.498 5.452 50 0 FKAAHN Cc1ccc(C)c(NC(=O)[C@@H](c2ccccc2)N(C)C2CCCCC2)c1 ZINC000057945279 571122965 /nfs/dbraw/zinc/12/29/65/571122965.db2.gz JDFPGVIZUFLQPE-JOCHJYFZSA-N 0 3 350.506 5.248 50 0 FKAAHN Cc1ccc(C)c(NC(=O)[C@H](c2ccccc2)N(C)C2CCCCC2)c1 ZINC000057945284 205245281 /nfs/dbraw/zinc/24/52/81/205245281.db2.gz JDFPGVIZUFLQPE-QFIPXVFZSA-N 0 3 350.506 5.248 50 0 FKAAHN Cc1cc2oc(=O)cc(CN[C@@H](c3ccc(F)cc3)C(C)C)c2cc1C ZINC000058054134 571124722 /nfs/dbraw/zinc/12/47/22/571124722.db2.gz WCQRQGDAJGIPBU-JOCHJYFZSA-N 0 3 353.437 5.036 50 0 FKAAHN Cc1cc2oc(=O)cc(CN[C@H](c3ccc(F)cc3)C(C)C)c2cc1C ZINC000058054139 571124766 /nfs/dbraw/zinc/12/47/66/571124766.db2.gz WCQRQGDAJGIPBU-QFIPXVFZSA-N 0 3 353.437 5.036 50 0 FKAAHN COc1ccccc1NC(=O)[C@H](C)N[C@@H](C)c1ccc(-c2ccccc2)cc1 ZINC000058160003 571126298 /nfs/dbraw/zinc/12/62/98/571126298.db2.gz OTMOFBMASGGYGG-ROUUACIJSA-N 0 3 374.484 5.040 50 0 FKAAHN COc1ccccc1NC(=O)[C@H](C)N[C@H](C)c1ccc(-c2ccccc2)cc1 ZINC000058160004 205252502 /nfs/dbraw/zinc/25/25/02/205252502.db2.gz OTMOFBMASGGYGG-MSOLQXFVSA-N 0 3 374.484 5.040 50 0 FKAAHN COc1ccccc1NC(=O)[C@@H](C)N[C@@H](C)c1ccc(-c2ccccc2)cc1 ZINC000058160005 205252876 /nfs/dbraw/zinc/25/28/76/205252876.db2.gz OTMOFBMASGGYGG-ZWKOTPCHSA-N 0 3 374.484 5.040 50 0 FKAAHN COc1ccccc1NC(=O)[C@@H](C)N[C@H](C)c1ccc(-c2ccccc2)cc1 ZINC000058160006 205252896 /nfs/dbraw/zinc/25/28/96/205252896.db2.gz OTMOFBMASGGYGG-QZTJIDSGSA-N 0 3 374.484 5.040 50 0 FKAAHN C[C@H](N[C@@H](C)c1ccccc1)C(=O)Nc1cc(Cl)c(Cl)cc1Cl ZINC000058160692 571126393 /nfs/dbraw/zinc/12/63/93/571126393.db2.gz MPAUIXLAVDZIEW-QWRGUYRKSA-N 0 3 371.695 5.325 50 0 FKAAHN C[C@@H](N[C@@H](C)C(=O)Nc1cc(Cl)c(Cl)cc1Cl)c1ccccc1 ZINC000058160693 571126385 /nfs/dbraw/zinc/12/63/85/571126385.db2.gz MPAUIXLAVDZIEW-MNOVXSKESA-N 0 3 371.695 5.325 50 0 FKAAHN C[C@@H](N[C@@H](C)c1ccccc1)C(=O)Nc1cc(Cl)c(Cl)cc1Cl ZINC000058160694 571126422 /nfs/dbraw/zinc/12/64/22/571126422.db2.gz MPAUIXLAVDZIEW-WDEREUQCSA-N 0 3 371.695 5.325 50 0 FKAAHN C[C@@H](N[C@H](C)c1ccccc1)C(=O)Nc1cc(Cl)c(Cl)cc1Cl ZINC000058160695 571126356 /nfs/dbraw/zinc/12/63/56/571126356.db2.gz MPAUIXLAVDZIEW-GHMZBOCLSA-N 0 3 371.695 5.325 50 0 FKAAHN FC(F)Sc1ccc(CN2CCC[C@@H](c3nc4ccccc4o3)C2)cc1 ZINC000058407024 205273877 /nfs/dbraw/zinc/27/38/77/205273877.db2.gz MPDLDLADFWLAJJ-OAHLLOKOSA-N 0 3 374.456 5.522 50 0 FKAAHN FC(F)Sc1ccc(CN2CCC[C@H](c3nc4ccccc4o3)C2)cc1 ZINC000058407025 221117503 /nfs/dbraw/zinc/11/75/03/221117503.db2.gz MPDLDLADFWLAJJ-HNNXBMFYSA-N 0 3 374.456 5.522 50 0 FKAAHN Cc1cc([C@@H]2CC=C(C)[C@H](c3ccccc3)N2C)cnc1-c1ccccc1 ZINC000058476297 571351804 /nfs/dbraw/zinc/35/18/04/571351804.db2.gz HKZZNEPBJXSGFS-UKILVPOCSA-N 0 3 354.497 6.121 50 0 FKAAHN Cc1cc([C@H]2CC=C(C)[C@H](c3ccccc3)N2C)cnc1-c1ccccc1 ZINC000058476299 221120148 /nfs/dbraw/zinc/12/01/48/221120148.db2.gz HKZZNEPBJXSGFS-ILBGXUMGSA-N 0 3 354.497 6.121 50 0 FKAAHN Cc1cc([C@@H]2CC=C(C)[C@@H](c3ccccc3)N2C)cnc1-c1ccccc1 ZINC000058476302 212012241 /nfs/dbraw/zinc/01/22/41/212012241.db2.gz HKZZNEPBJXSGFS-ZCYQVOJMSA-N 0 3 354.497 6.121 50 0 FKAAHN Cc1cc([C@H]2CC=C(C)[C@@H](c3ccccc3)N2C)cnc1-c1ccccc1 ZINC000058476305 221121018 /nfs/dbraw/zinc/12/10/18/221121018.db2.gz HKZZNEPBJXSGFS-NOZRDPDXSA-N 0 3 354.497 6.121 50 0 FKAAHN FC(F)Oc1ccc2c(c1)CCC[C@H]2NCc1ccccc1C(F)(F)F ZINC000058477738 205276152 /nfs/dbraw/zinc/27/61/52/205276152.db2.gz ATPHJWYWGIRLQM-QGZVFWFLSA-N 0 3 371.349 5.474 50 0 FKAAHN O=C(c1ccccc1)C1CCN(C2c3ccccc3-c3ccccc32)CC1 ZINC000059391991 212017418 /nfs/dbraw/zinc/01/74/18/212017418.db2.gz DWFRCMPUMKISPC-UHFFFAOYSA-N 0 3 353.465 5.351 50 0 FKAAHN C(/C=C/N1CCCC1)=C\c1cc(-c2ccccc2)c(-c2ccccc2)cn1 ZINC000059602426 205281315 /nfs/dbraw/zinc/28/13/15/205281315.db2.gz VTWMOWFPHCWJLH-BGPOSVGRSA-N 0 3 352.481 6.038 50 0 FKAAHN Fc1cc(CNCc2csc3ccccc23)ccc1Oc1cccnc1 ZINC000063549219 205293421 /nfs/dbraw/zinc/29/34/21/205293421.db2.gz HYGJYWWXWLRQPT-UHFFFAOYSA-N 0 3 364.445 5.518 50 0 FKAAHN CC(C)[C@@H](C)N(Cc1nnc(-c2ccc(Cl)cc2Cl)o1)C1CC1 ZINC000064141151 212036554 /nfs/dbraw/zinc/03/65/54/212036554.db2.gz LGHBADKFWALNKN-LLVKDONJSA-N 0 3 354.281 5.052 50 0 FKAAHN Cc1ccc(-c2cc([C@@H]3CCN(Cc4ccoc4)C3)ccn2)c2cccnc12 ZINC000065375918 205341584 /nfs/dbraw/zinc/34/15/84/205341584.db2.gz VQYANHKXJLBDTH-HXUWFJFHSA-N 0 3 369.468 5.188 50 0 FKAAHN Cc1ccc(-c2cc([C@H]3CCN(Cc4ccoc4)C3)ccn2)c2cccnc12 ZINC000065375919 571142609 /nfs/dbraw/zinc/14/26/09/571142609.db2.gz VQYANHKXJLBDTH-FQEVSTJZSA-N 0 3 369.468 5.188 50 0 FKAAHN c1coc(CN2CC[C@@H](c3ccnc(-c4cc5ccccc5s4)c3)C2)c1 ZINC000065525788 571144585 /nfs/dbraw/zinc/14/45/85/571144585.db2.gz JJJNZPZKNFLOAL-GOSISDBHSA-N 0 3 360.482 5.546 50 0 FKAAHN c1coc(CN2CC[C@H](c3ccnc(-c4cc5ccccc5s4)c3)C2)c1 ZINC000065525789 571144502 /nfs/dbraw/zinc/14/45/02/571144502.db2.gz JJJNZPZKNFLOAL-SFHVURJKSA-N 0 3 360.482 5.546 50 0 FKAAHN COc1cc(Oc2cccc(C(F)(F)F)c2)ccc1CN1CCCC1 ZINC000067459577 571146726 /nfs/dbraw/zinc/14/67/26/571146726.db2.gz KILQUFGJMVDMCQ-UHFFFAOYSA-N 0 3 351.368 5.102 50 0 FKAAHN COc1ccc(Oc2cccc(C(F)(F)F)c2)cc1CN1CCCC1 ZINC000067603609 205376362 /nfs/dbraw/zinc/37/63/62/205376362.db2.gz GKENQURGTXMNLV-UHFFFAOYSA-N 0 3 351.368 5.102 50 0 FKAAHN COc1ccc(CN2CCCC2)cc1Oc1cccc(C(F)(F)F)c1 ZINC000067679111 571148139 /nfs/dbraw/zinc/14/81/39/571148139.db2.gz KLBMRXWFLWVYRR-UHFFFAOYSA-N 0 3 351.368 5.102 50 0 FKAAHN COc1ccccc1Oc1ncccc1CNc1ccnc2ccccc21 ZINC000067739465 205387774 /nfs/dbraw/zinc/38/77/74/205387774.db2.gz KVZAHYZFCAAAFJ-UHFFFAOYSA-N 0 3 357.413 5.043 50 0 FKAAHN Cc1ccccc1[C@@H]1CCCN1Cc1cnc2c(-c3ccccc3)cnn2c1 ZINC000067757504 571149234 /nfs/dbraw/zinc/14/92/34/571149234.db2.gz LKNWPKPFHKYCOE-QHCPKHFHSA-N 0 3 368.484 5.042 50 0 FKAAHN Cc1ccccc1[C@H]1CCCN1Cc1cnc2c(-c3ccccc3)cnn2c1 ZINC000067757509 205389234 /nfs/dbraw/zinc/38/92/34/205389234.db2.gz LKNWPKPFHKYCOE-HSZRJFAPSA-N 0 3 368.484 5.042 50 0 FKAAHN COc1cc(CN2CCCC2)ccc1Oc1ccc(C(F)(F)F)cc1 ZINC000067789101 205393441 /nfs/dbraw/zinc/39/34/41/205393441.db2.gz XIPHKXZKKKJKBV-UHFFFAOYSA-N 0 3 351.368 5.102 50 0 FKAAHN Cc1cc(C(F)(F)F)cc(Oc2ccccc2CN2CCCCC2)n1 ZINC000067867762 221297073 /nfs/dbraw/zinc/29/70/73/221297073.db2.gz PKCWKURAILSYEZ-UHFFFAOYSA-N 0 3 350.384 5.187 50 0 FKAAHN COc1ccc(CN2CCCC2)cc1Oc1ccc(C(F)(F)F)cc1 ZINC000067896245 571151577 /nfs/dbraw/zinc/15/15/77/571151577.db2.gz VPFHEFHWTBRSAC-UHFFFAOYSA-N 0 3 351.368 5.102 50 0 FKAAHN CC(C)C[C@@H](C)NCc1cccnc1Oc1cccc(C(F)(F)F)c1 ZINC000067966374 208741515 /nfs/dbraw/zinc/74/15/15/208741515.db2.gz IKVKYYDGUDIFOT-CQSZACIVSA-N 0 3 352.400 5.417 50 0 FKAAHN CC(C)C[C@H](C)NCc1cccnc1Oc1cccc(C(F)(F)F)c1 ZINC000067966375 221309476 /nfs/dbraw/zinc/30/94/76/221309476.db2.gz IKVKYYDGUDIFOT-AWEZNQCLSA-N 0 3 352.400 5.417 50 0 FKAAHN CC(C)(C)[C@H](NCc1cc(Cl)c2c(c1)OCCCO2)c1cccs1 ZINC000069485560 221325592 /nfs/dbraw/zinc/32/55/92/221325592.db2.gz WDJNJYPEAFUZHW-GOSISDBHSA-N 0 3 365.926 5.440 50 0 FKAAHN CC(C)(C)[C@@H](NCc1cc(Cl)c2c(c1)OCCCO2)c1cccs1 ZINC000069485562 221325209 /nfs/dbraw/zinc/32/52/09/221325209.db2.gz WDJNJYPEAFUZHW-SFHVURJKSA-N 0 3 365.926 5.440 50 0 FKAAHN COc1cc(CN2CCCC2)ccc1Oc1cccc(C(F)(F)F)c1 ZINC000071278611 571160689 /nfs/dbraw/zinc/16/06/89/571160689.db2.gz BWWVAZJVHTWXME-UHFFFAOYSA-N 0 3 351.368 5.102 50 0 FKAAHN CN(C)CC1=C(c2cccs2)Oc2ccccc2[C@@H]1c1ccc(F)cc1 ZINC000071405258 571122062 /nfs/dbraw/zinc/12/20/62/571122062.db2.gz KCFLGYCAABMXLC-NRFANRHFSA-N 0 3 365.473 5.384 50 0 FKAAHN CN(C)CC1=C(c2cccs2)Oc2ccccc2[C@H]1c1ccc(F)cc1 ZINC000071405259 571121964 /nfs/dbraw/zinc/12/19/64/571121964.db2.gz KCFLGYCAABMXLC-OAQYLSRUSA-N 0 3 365.473 5.384 50 0 FKAAHN Cc1ccc([C@@H]2c3ccccc3OC(c3cccs3)=C2CN(C)C)cc1 ZINC000071405260 571122076 /nfs/dbraw/zinc/12/20/76/571122076.db2.gz HUVWGTPFVDNZKZ-JOCHJYFZSA-N 0 3 361.510 5.554 50 0 FKAAHN Cc1ccc([C@H]2c3ccccc3OC(c3cccs3)=C2CN(C)C)cc1 ZINC000071405261 571122054 /nfs/dbraw/zinc/12/20/54/571122054.db2.gz HUVWGTPFVDNZKZ-QFIPXVFZSA-N 0 3 361.510 5.554 50 0 FKAAHN CN(C)[C@@H](CNCc1sc2ccccc2c1Cl)c1ccsc1 ZINC000071844485 571127183 /nfs/dbraw/zinc/12/71/83/571127183.db2.gz VTLDDZAYCJLKDU-AWEZNQCLSA-N 0 3 350.940 5.009 50 0 FKAAHN CN(C)[C@H](CNCc1sc2ccccc2c1Cl)c1ccsc1 ZINC000071844486 571127046 /nfs/dbraw/zinc/12/70/46/571127046.db2.gz VTLDDZAYCJLKDU-CQSZACIVSA-N 0 3 350.940 5.009 50 0 FKAAHN Cc1oc(C2CCN([C@@H](C)c3ccc(F)cc3)CC2)nc1-c1ccccc1 ZINC000072304924 571060404 /nfs/dbraw/zinc/06/04/04/571060404.db2.gz DESFETUWJFVYKZ-INIZCTEOSA-N 0 3 364.464 5.730 50 0 FKAAHN Cc1oc(C2CCN([C@H](C)c3ccc(F)cc3)CC2)nc1-c1ccccc1 ZINC000072304925 571060115 /nfs/dbraw/zinc/06/01/15/571060115.db2.gz DESFETUWJFVYKZ-MRXNPFEDSA-N 0 3 364.464 5.730 50 0 FKAAHN CCS[C@@H]1CC[C@H](N(C)Cc2cccc(C(=O)Nc3ccccc3)c2)C1 ZINC000072305265 571061652 /nfs/dbraw/zinc/06/16/52/571061652.db2.gz DHMWXFMXBOQOSR-LEWJYISDSA-N 0 3 368.546 5.045 50 0 FKAAHN CCS[C@H]1CC[C@H](N(C)Cc2cccc(C(=O)Nc3ccccc3)c2)C1 ZINC000072305266 571061627 /nfs/dbraw/zinc/06/16/27/571061627.db2.gz DHMWXFMXBOQOSR-SFTDATJTSA-N 0 3 368.546 5.045 50 0 FKAAHN CCS[C@@H]1CC[C@@H](N(C)Cc2cccc(C(=O)Nc3ccccc3)c2)C1 ZINC000072305267 571061439 /nfs/dbraw/zinc/06/14/39/571061439.db2.gz DHMWXFMXBOQOSR-NHCUHLMSSA-N 0 3 368.546 5.045 50 0 FKAAHN CCS[C@H]1CC[C@@H](N(C)Cc2cccc(C(=O)Nc3ccccc3)c2)C1 ZINC000072305268 571061565 /nfs/dbraw/zinc/06/15/65/571061565.db2.gz DHMWXFMXBOQOSR-RTWAWAEBSA-N 0 3 368.546 5.045 50 0 FKAAHN CN1CCC[C@H](Oc2ccc(/C=C/c3ccc(C(F)(F)F)cc3)cc2)C1 ZINC000075253439 571158490 /nfs/dbraw/zinc/15/84/90/571158490.db2.gz LWJFYUCNSCJYQW-SGSXCFNPSA-N 0 3 361.407 5.349 50 0 FKAAHN CN1CCC[C@@H](Oc2ccc(/C=C/c3ccc(C(F)(F)F)cc3)cc2)C1 ZINC000075253442 571158653 /nfs/dbraw/zinc/15/86/53/571158653.db2.gz LWJFYUCNSCJYQW-DPZZJQGRSA-N 0 3 361.407 5.349 50 0 FKAAHN Cc1oc(-c2ccccc2)nc1CCNCc1cccc(C(F)(F)F)c1 ZINC000078758033 570634201 /nfs/dbraw/zinc/63/42/01/570634201.db2.gz MXEUJHYHROAQSR-UHFFFAOYSA-N 0 3 360.379 5.001 50 0 FKAAHN COc1ccc(C2(NCc3cccc(OC)c3OC)CCCCCC2)cc1 ZINC000078823079 571326311 /nfs/dbraw/zinc/32/63/11/571326311.db2.gz ZHSYJQMWAXCEAR-UHFFFAOYSA-N 0 3 369.505 5.052 50 0 FKAAHN C[C@H](c1ccccc1)N1CC=C(c2ccc(OCc3ccccc3)cc2)CC1 ZINC000079917105 571218235 /nfs/dbraw/zinc/21/82/35/571218235.db2.gz ZXINDPIOCYKBQG-OAQYLSRUSA-N 0 3 369.508 6.116 50 0 FKAAHN NC[C@H](OCc1c(Cl)cccc1Cl)c1ccc(Cl)cc1Cl ZINC000083324629 571232044 /nfs/dbraw/zinc/23/20/44/571232044.db2.gz YEFWMFSHHWNWBA-HNNXBMFYSA-N 0 3 365.087 5.517 50 0 FKAAHN NC[C@@H](OCc1c(Cl)cccc1Cl)c1ccc(Cl)cc1Cl ZINC000083324630 571231959 /nfs/dbraw/zinc/23/19/59/571231959.db2.gz YEFWMFSHHWNWBA-OAHLLOKOSA-N 0 3 365.087 5.517 50 0 FKAAHN COc1ccc([C@@H]2CN[C@H](c3ccccc3)c3[nH]c4ccccc4c32)cc1 ZINC000083943987 571122281 /nfs/dbraw/zinc/12/22/81/571122281.db2.gz SSRVTXWLYQYDND-NZQKXSOJSA-N 0 3 354.453 5.001 50 0 FKAAHN COc1ccc([C@H]2CN[C@H](c3ccccc3)c3[nH]c4ccccc4c32)cc1 ZINC000083943991 571122330 /nfs/dbraw/zinc/12/23/30/571122330.db2.gz SSRVTXWLYQYDND-NFBKMPQASA-N 0 3 354.453 5.001 50 0 FKAAHN COc1ccc([C@@H]2CN[C@@H](c3ccccc3)c3[nH]c4ccccc4c32)cc1 ZINC000083943995 571122219 /nfs/dbraw/zinc/12/22/19/571122219.db2.gz SSRVTXWLYQYDND-REWPJTCUSA-N 0 3 354.453 5.001 50 0 FKAAHN COc1ccc([C@H]2CN[C@@H](c3ccccc3)c3[nH]c4ccccc4c32)cc1 ZINC000083943999 571122305 /nfs/dbraw/zinc/12/23/05/571122305.db2.gz SSRVTXWLYQYDND-OFNKIYASSA-N 0 3 354.453 5.001 50 0 FKAAHN Cc1ccc(CN[C@@H](c2ccc(Br)cc2)C2CCC2)s1 ZINC000084205532 571079082 /nfs/dbraw/zinc/07/90/82/571079082.db2.gz HLDLZDMXCFCDOG-QGZVFWFLSA-N 0 3 350.325 5.450 50 0 FKAAHN Cc1ccc(CN[C@H](c2ccc(Br)cc2)C2CCC2)s1 ZINC000084205535 571079039 /nfs/dbraw/zinc/07/90/39/571079039.db2.gz HLDLZDMXCFCDOG-KRWDZBQOSA-N 0 3 350.325 5.450 50 0 FKAAHN CC(C)[C@H](C)N(Cc1nnc(-c2ccc(Cl)cc2Cl)o1)C1CC1 ZINC000084409913 571084938 /nfs/dbraw/zinc/08/49/38/571084938.db2.gz LGHBADKFWALNKN-NSHDSACASA-N 0 3 354.281 5.052 50 0 FKAAHN FC(F)Oc1ccc2c(c1)CCC[C@@H]2NCc1ccccc1C(F)(F)F ZINC000084504950 571087384 /nfs/dbraw/zinc/08/73/84/571087384.db2.gz ATPHJWYWGIRLQM-KRWDZBQOSA-N 0 3 371.349 5.474 50 0 FKAAHN Fc1cccc2c1SCC[C@H]2NCc1cc(-c2ccccc2)cs1 ZINC000084560167 571089570 /nfs/dbraw/zinc/08/95/70/571089570.db2.gz JGIBGSUWWOQKEH-LJQANCHMSA-N 0 3 355.503 5.881 50 0 FKAAHN Fc1cccc2c1SCC[C@@H]2NCc1cc(-c2ccccc2)cs1 ZINC000084560169 571089580 /nfs/dbraw/zinc/08/95/80/571089580.db2.gz JGIBGSUWWOQKEH-IBGZPJMESA-N 0 3 355.503 5.881 50 0 FKAAHN Clc1cc(CNCc2csc3ccccc23)cc2c1OCCCO2 ZINC000084593155 571091303 /nfs/dbraw/zinc/09/13/03/571091303.db2.gz RHSYTRSRXZUQES-UHFFFAOYSA-N 0 3 359.878 5.006 50 0 FKAAHN CN(C)[C@@H](CNc1cc(C(F)(F)F)nc2ccccc21)c1cccs1 ZINC000089313902 571200848 /nfs/dbraw/zinc/20/08/48/571200848.db2.gz LYIPRNAYWFVZGD-HNNXBMFYSA-N 0 3 365.424 5.030 50 0 FKAAHN CN(C)[C@H](CNc1cc(C(F)(F)F)nc2ccccc21)c1cccs1 ZINC000089313903 571200921 /nfs/dbraw/zinc/20/09/21/571200921.db2.gz LYIPRNAYWFVZGD-OAHLLOKOSA-N 0 3 365.424 5.030 50 0 FKAAHN Cc1cc(N[C@H](c2nccn2C)c2ccc(Cl)cc2)c2ccccc2n1 ZINC000089583065 571212722 /nfs/dbraw/zinc/21/27/22/571212722.db2.gz IXPSBMFSOYHPQY-FQEVSTJZSA-N 0 3 362.864 5.132 50 0 FKAAHN Cc1cc(N[C@@H](c2nccn2C)c2ccc(Cl)cc2)c2ccccc2n1 ZINC000089583069 571212605 /nfs/dbraw/zinc/21/26/05/571212605.db2.gz IXPSBMFSOYHPQY-HXUWFJFHSA-N 0 3 362.864 5.132 50 0 FKAAHN Cc1cc(NC2CCN(Cc3ccc(Cl)cc3)CC2)c2ccccc2n1 ZINC000089583088 571212698 /nfs/dbraw/zinc/21/26/98/571212698.db2.gz QYEVTMLGKYPYOM-UHFFFAOYSA-N 0 3 365.908 5.273 50 0 FKAAHN COc1ccc2c(c1)CCC[C@H]2N[C@@H](C)c1cc(Cl)c(N)c(Cl)c1 ZINC000089904534 571274017 /nfs/dbraw/zinc/27/40/17/571274017.db2.gz GABUWDRYKMYKBX-BBATYDOGSA-N 0 3 365.304 5.312 50 0 FKAAHN COc1ccc2c(c1)CCC[C@H]2N[C@H](C)c1cc(Cl)c(N)c(Cl)c1 ZINC000089904535 571273956 /nfs/dbraw/zinc/27/39/56/571273956.db2.gz GABUWDRYKMYKBX-ADLMAVQZSA-N 0 3 365.304 5.312 50 0 FKAAHN COc1ccc2c(c1)CCC[C@@H]2N[C@@H](C)c1cc(Cl)c(N)c(Cl)c1 ZINC000089904536 571273931 /nfs/dbraw/zinc/27/39/31/571273931.db2.gz GABUWDRYKMYKBX-VOJFVSQTSA-N 0 3 365.304 5.312 50 0 FKAAHN COc1ccc2c(c1)CCC[C@@H]2N[C@H](C)c1cc(Cl)c(N)c(Cl)c1 ZINC000089904537 571274027 /nfs/dbraw/zinc/27/40/27/571274027.db2.gz GABUWDRYKMYKBX-ZMZPIMSZSA-N 0 3 365.304 5.312 50 0 FKAAHN Fc1ccc2c(c1)[C@H](N[C@H](C[C@@H]1CCOC1)c1ccccc1)CCS2 ZINC000090805899 571076461 /nfs/dbraw/zinc/07/64/61/571076461.db2.gz XXTCEMCTMCPVFN-CWFSZBLJSA-N 0 3 357.494 5.120 50 0 FKAAHN Fc1ccc2c(c1)[C@H](N[C@@H](C[C@@H]1CCOC1)c1ccccc1)CCS2 ZINC000090805901 571189019 /nfs/dbraw/zinc/18/90/19/571189019.db2.gz XXTCEMCTMCPVFN-BEVDRBHNSA-N 0 3 357.494 5.120 50 0 FKAAHN Fc1ccc2c(c1)[C@H](N[C@H](C[C@H]1CCOC1)c1ccccc1)CCS2 ZINC000090805903 571188841 /nfs/dbraw/zinc/18/88/41/571188841.db2.gz XXTCEMCTMCPVFN-CDHQVMDDSA-N 0 3 357.494 5.120 50 0 FKAAHN Fc1ccc2c(c1)[C@H](N[C@@H](C[C@H]1CCOC1)c1ccccc1)CCS2 ZINC000090805906 571188781 /nfs/dbraw/zinc/18/87/81/571188781.db2.gz XXTCEMCTMCPVFN-YSGRDPCXSA-N 0 3 357.494 5.120 50 0 FKAAHN CC(C)n1ccnc1C1CCN(Cc2ccc(C(F)(F)F)c(F)c2)CC1 ZINC000091434210 571239438 /nfs/dbraw/zinc/23/94/38/571239438.db2.gz HMRSCEDOBYGJBR-UHFFFAOYSA-N 0 3 369.406 5.002 50 0 FKAAHN Cc1ccc(CN(C(=O)Nc2ccccn2)[C@@H]2CCc3ccccc32)cc1 ZINC000095389775 205751322 /nfs/dbraw/zinc/75/13/22/205751322.db2.gz QTUBCKBHOXLWNV-OAQYLSRUSA-N 0 3 357.457 5.112 50 0 FKAAHN CC[C@H](NC1CCC(O)(c2ccc(C(C)C)cc2)CC1)c1ncc(C)s1 ZINC000095454562 205757888 /nfs/dbraw/zinc/75/78/88/205757888.db2.gz JABRWJVZTJQPEM-FUHYEJFZSA-N 0 3 372.578 5.446 50 0 FKAAHN CC[C@@H](NC1CCC(O)(c2ccc(C(C)C)cc2)CC1)c1ncc(C)s1 ZINC000095454563 571329939 /nfs/dbraw/zinc/32/99/39/571329939.db2.gz JABRWJVZTJQPEM-SNCIUUNGSA-N 0 3 372.578 5.446 50 0 FKAAHN Clc1cccc2c1OCCC[C@H]2NCc1cccc(-c2cccnc2)c1 ZINC000095463792 571330351 /nfs/dbraw/zinc/33/03/51/571330351.db2.gz HBNJMVPNMGHBME-OAQYLSRUSA-N 0 3 364.876 5.406 50 0 FKAAHN Clc1cccc2c1OCCC[C@@H]2NCc1cccc(-c2cccnc2)c1 ZINC000095463793 209055213 /nfs/dbraw/zinc/05/52/13/209055213.db2.gz HBNJMVPNMGHBME-NRFANRHFSA-N 0 3 364.876 5.406 50 0 FKAAHN Clc1c2ccccc2sc1CNCc1ccc(Cn2cccn2)cc1 ZINC000095946579 571332557 /nfs/dbraw/zinc/33/25/57/571332557.db2.gz XFKLEORSBJVIAM-UHFFFAOYSA-N 0 3 367.905 5.089 50 0 FKAAHN C[C@H](NCc1ccc(Cn2ccnc2)cc1)c1cc(Cl)cc(Cl)c1 ZINC000095967279 209091649 /nfs/dbraw/zinc/09/16/49/209091649.db2.gz RCGIAZPWDUVYCT-AWEZNQCLSA-N 0 3 360.288 5.089 50 0 FKAAHN C[C@@H](NCc1ccc(Cn2ccnc2)cc1)c1cc(Cl)cc(Cl)c1 ZINC000095967280 571333206 /nfs/dbraw/zinc/33/32/06/571333206.db2.gz RCGIAZPWDUVYCT-CQSZACIVSA-N 0 3 360.288 5.089 50 0 FKAAHN CC[C@H](N[C@@H](C)c1sc(-c2ccccc2F)nc1C)c1ccncc1 ZINC000095968425 571333180 /nfs/dbraw/zinc/33/31/80/571333180.db2.gz PJSBTOJEZIVMGA-UGSOOPFHSA-N 0 3 355.482 5.455 50 0 FKAAHN CC[C@@H](N[C@@H](C)c1sc(-c2ccccc2F)nc1C)c1ccncc1 ZINC000095968426 571333165 /nfs/dbraw/zinc/33/31/65/571333165.db2.gz PJSBTOJEZIVMGA-SCLBCKFNSA-N 0 3 355.482 5.455 50 0 FKAAHN CC[C@H](N[C@H](C)c1sc(-c2ccccc2F)nc1C)c1ccncc1 ZINC000095968427 571333173 /nfs/dbraw/zinc/33/31/73/571333173.db2.gz PJSBTOJEZIVMGA-ACJLOTCBSA-N 0 3 355.482 5.455 50 0 FKAAHN CC[C@@H](N[C@H](C)c1sc(-c2ccccc2F)nc1C)c1ccncc1 ZINC000095968428 571333225 /nfs/dbraw/zinc/33/32/25/571333225.db2.gz PJSBTOJEZIVMGA-FZKQIMNGSA-N 0 3 355.482 5.455 50 0 FKAAHN c1c2ccccc2oc1[C@@H](NCC1(c2ccccc2)CC1)c1cccnc1 ZINC000095996254 209094802 /nfs/dbraw/zinc/09/48/02/209094802.db2.gz XYFRFUGTXJGEMH-QHCPKHFHSA-N 0 3 354.453 5.239 50 0 FKAAHN c1c2ccccc2oc1[C@H](NCC1(c2ccccc2)CC1)c1cccnc1 ZINC000095996255 571333595 /nfs/dbraw/zinc/33/35/95/571333595.db2.gz XYFRFUGTXJGEMH-HSZRJFAPSA-N 0 3 354.453 5.239 50 0 FKAAHN CCOc1ccc(CNCc2ccc(-c3ccccc3F)s2)cc1OC ZINC000096998250 222149069 /nfs/dbraw/zinc/14/90/69/222149069.db2.gz QPHUBSKCEQMBAO-UHFFFAOYSA-N 0 3 371.477 5.251 50 0 FKAAHN F[C@@H]1CCCCCCCCCC[C@]12NCC1(O2)C2CC3CC(C2)CC1C3 ZINC000098174873 222230268 /nfs/dbraw/zinc/23/02/68/222230268.db2.gz DKTLWAYPDODIDS-VHVONKDCSA-N 0 3 363.561 5.750 50 0 FKAAHN F[C@@H]1CCCCCCCCCC[C@@]12NCC1(O2)C2CC3CC(C2)CC1C3 ZINC000098174874 570497686 /nfs/dbraw/zinc/49/76/86/570497686.db2.gz DKTLWAYPDODIDS-XJIMYUCMSA-N 0 3 363.561 5.750 50 0 FKAAHN F[C@H]1CCCCCCCCCC[C@@]12NCC1(O2)C2CC3CC(C2)CC1C3 ZINC000098174875 222230912 /nfs/dbraw/zinc/23/09/12/222230912.db2.gz DKTLWAYPDODIDS-SWISWOKGSA-N 0 3 363.561 5.750 50 0 FKAAHN F[C@H]1CCCCCCCCCC[C@]12NCC1(O2)C2CC3CC(C2)CC1C3 ZINC000100645889 222248638 /nfs/dbraw/zinc/24/86/38/222248638.db2.gz DKTLWAYPDODIDS-GXDNHNOWSA-N 0 3 363.561 5.750 50 0 FKAAHN CC[C@@H]1[C@H](c2ccccc2)N[C@H](c2ccccc2)C[C@@]1(O)Cc1ccccc1 ZINC000101637119 209227378 /nfs/dbraw/zinc/22/73/78/209227378.db2.gz KIXGFZRPUASEFM-RSYZFUPGSA-N 0 3 371.524 5.462 50 0 FKAAHN CCC[C@@H]1[C@H](c2ccccc2)N[C@H](c2ccccc2)[C@H](C)[C@@]1(O)CCC ZINC000101652080 209381726 /nfs/dbraw/zinc/38/17/26/209381726.db2.gz UCLGIKKXOIONJU-GXWFBMCDSA-N 0 3 351.534 5.656 50 0 FKAAHN C[C@@H]1[C@H](c2ccccc2)N[C@H](c2ccccc2)C[C@@]1(O)Cc1ccccc1 ZINC000106013708 222380684 /nfs/dbraw/zinc/38/06/84/222380684.db2.gz NDHOPVCXDQDCPC-MNVNNWCQSA-N 0 3 357.497 5.072 50 0 FKAAHN Cc1c(Cl)cccc1-c1ccc(CNCCc2nc3ccccc3[nH]2)o1 ZINC000113398668 206089201 /nfs/dbraw/zinc/08/92/01/206089201.db2.gz ZNDDODAMIFQNBB-UHFFFAOYSA-N 0 3 365.864 5.117 50 0 FKAAHN Cc1ccc(-c2ccc(CNCCc3nc4ccccc4[nH]3)o2)cc1Cl ZINC000113399125 209336341 /nfs/dbraw/zinc/33/63/41/209336341.db2.gz LJMCEYHWEURYIJ-UHFFFAOYSA-N 0 3 365.864 5.117 50 0 FKAAHN Brc1ccc2c(C3=CCN(Cc4ccccc4)CC3)c[nH]c2c1 ZINC000169677334 570801692 /nfs/dbraw/zinc/80/16/92/570801692.db2.gz QQRHOHREGPLUKV-UHFFFAOYSA-N 0 3 367.290 5.220 50 0 FKAAHN CC[C@@H]1CCC[C@@H]1N[C@@H](C)c1nnc(-c2ccc(Cl)cc2Cl)o1 ZINC000170616757 571268371 /nfs/dbraw/zinc/26/83/71/571268371.db2.gz NAFUUTRIHBLRER-RWSFTLGLSA-N 0 3 354.281 5.273 50 0 FKAAHN CC[C@@H]1CCC[C@H]1N[C@@H](C)c1nnc(-c2ccc(Cl)cc2Cl)o1 ZINC000170616759 571268395 /nfs/dbraw/zinc/26/83/95/571268395.db2.gz NAFUUTRIHBLRER-FIXISWKDSA-N 0 3 354.281 5.273 50 0 FKAAHN O=c1[nH]c2cc(Cl)ccc2c(-c2ccccc2)c1CN1CCCCC1 ZINC000170619463 571268671 /nfs/dbraw/zinc/26/86/71/571268671.db2.gz VECIVJDKAHJPNM-UHFFFAOYSA-N 0 3 352.865 5.247 50 0 FKAAHN Cc1cc(NCc2ccc(Oc3cccnc3)c(F)c2)c2ccccc2n1 ZINC000195670012 263456673 /nfs/dbraw/zinc/45/66/73/263456673.db2.gz JJFODOVWLJUMDH-UHFFFAOYSA-N 0 3 359.404 5.482 50 0 FKAAHN CN1CCC[C@H](Oc2ccc(/C=C\c3ccc(C(F)(F)F)cc3)cc2)C1 ZINC000210970901 571129840 /nfs/dbraw/zinc/12/98/40/571129840.db2.gz LWJFYUCNSCJYQW-FBQMEGEOSA-N 0 3 361.407 5.349 50 0 FKAAHN COC1CCN(Cc2cccc(Oc3cccc(C(F)(F)F)c3)c2)CC1 ZINC000215602594 568079398 /nfs/dbraw/zinc/07/93/98/568079398.db2.gz UELZZLNQNDVNIC-UHFFFAOYSA-N 0 3 365.395 5.109 50 0 FKAAHN COCCCN(Cc1ccc(F)cc1)Cc1ccc2cccc(Cl)c2n1 ZINC000220341031 568336547 /nfs/dbraw/zinc/33/65/47/568336547.db2.gz UHYKMHRWPMNJIY-UHFFFAOYSA-N 0 3 372.871 5.066 50 0 FKAAHN CC[C@@H]1CCC[C@@H]1N[C@H](C)c1nnc(-c2ccc(Cl)cc2Cl)o1 ZINC000225420509 210176681 /nfs/dbraw/zinc/17/66/81/210176681.db2.gz NAFUUTRIHBLRER-HFAKWTLXSA-N 0 3 354.281 5.273 50 0 FKAAHN CC[C@@H]1CCC[C@H]1N[C@H](C)c1nnc(-c2ccc(Cl)cc2Cl)o1 ZINC000225420589 210177465 /nfs/dbraw/zinc/17/74/65/210177465.db2.gz NAFUUTRIHBLRER-UEKVPHQBSA-N 0 3 354.281 5.273 50 0 FKAAHN O=C(c1ccc(Cl)cc1)C1CCN(C[C@@H]2CCCC(F)(F)C2)CC1 ZINC000225770039 571064058 /nfs/dbraw/zinc/06/40/58/571064058.db2.gz MVQGOELRURBIEX-CQSZACIVSA-N 0 3 355.856 5.060 50 0 FKAAHN O=C(c1ccc(Cl)cc1)C1CCN(C[C@H]2CCCC(F)(F)C2)CC1 ZINC000225770052 571064046 /nfs/dbraw/zinc/06/40/46/571064046.db2.gz MVQGOELRURBIEX-AWEZNQCLSA-N 0 3 355.856 5.060 50 0 FKAAHN CCC[C@@H]1[C@H](c2ccccc2)N[C@H](c2ccccc2)[C@@H](C)[C@@]1(O)CCC ZINC000229943212 571095578 /nfs/dbraw/zinc/09/55/78/571095578.db2.gz UCLGIKKXOIONJU-HOTKZRPMSA-N 0 3 351.534 5.656 50 0 FKAAHN O[C@]12CCCC[C@H]1[C@H](c1ccc(F)cc1)N(C/C=C/c1ccccc1)CC2 ZINC000230033865 571340557 /nfs/dbraw/zinc/34/05/57/571340557.db2.gz WJIDANGHKXCJLA-MGYNFMGQSA-N 0 3 365.492 5.207 50 0 FKAAHN CNCc1ccc(Oc2ccc(Cl)c(Cl)c2)cc1Br ZINC000234423090 570981833 /nfs/dbraw/zinc/98/18/33/570981833.db2.gz LBSMXFUSYVESEJ-UHFFFAOYSA-N 0 3 361.066 5.268 50 0 FKAAHN C[C@@H]1[C@H](c2ccccc2)N[C@@H](c2ccccc2)[C@H](C)[C@@]1(O)Cc1ccccc1 ZINC000245254043 206786445 /nfs/dbraw/zinc/78/64/45/206786445.db2.gz YRMXCILLNZAXNX-QQWJIEJLSA-N 0 3 371.524 5.318 50 0 FKAAHN C[C@@H]1[C@H](c2ccccc2)N[C@H](c2ccccc2)[C@@H](C)[C@@]1(O)Cc1ccccc1 ZINC000245254044 571316823 /nfs/dbraw/zinc/31/68/23/571316823.db2.gz YRMXCILLNZAXNX-QSWKYWCCSA-N 0 3 371.524 5.318 50 0 FKAAHN C[C@@H]1[C@H](c2ccccc2)N[C@H](c2ccccc2)[C@H](C)[C@@]1(O)Cc1ccccc1 ZINC000245254045 210210734 /nfs/dbraw/zinc/21/07/34/210210734.db2.gz YRMXCILLNZAXNX-TYNUAKKSSA-N 0 3 371.524 5.318 50 0 FKAAHN CCCC[C@]1(O)[C@H](C)[C@H](c2ccccc2)N[C@@H](c2ccccc2)[C@H]1CCC ZINC000245296749 571316806 /nfs/dbraw/zinc/31/68/06/571316806.db2.gz POFXFTVXJUYYRI-VKZFYUIYSA-N 0 3 365.561 6.046 50 0 FKAAHN CCCC[C@]1(O)[C@H](C)[C@H](c2ccccc2)N[C@@H](c2ccccc2)[C@@H]1CCC ZINC000245296752 571316849 /nfs/dbraw/zinc/31/68/49/571316849.db2.gz POFXFTVXJUYYRI-WKNJGTSGSA-N 0 3 365.561 6.046 50 0 FKAAHN CCCC[C@]1(O)[C@H](C)[C@H](c2ccccc2)N[C@H](c2ccccc2)[C@H]1CCC ZINC000245296754 571316790 /nfs/dbraw/zinc/31/67/90/571316790.db2.gz POFXFTVXJUYYRI-YJMUNGTFSA-N 0 3 365.561 6.046 50 0 FKAAHN C[C@H]1[C@H](O)[C@@H](C)[C@H](c2ccc(Cl)cc2)N[C@H]1c1ccc(Cl)cc1 ZINC000245312896 525111758 /nfs/dbraw/zinc/11/17/58/525111758.db2.gz YOCSCRSTBWZYLM-AGOZMRBZSA-N 0 3 350.289 5.012 50 0 FKAAHN C[C@H]1C(O)[C@H](C)[C@H](c2ccc(Cl)cc2)N[C@H]1c1ccc(Cl)cc1 ZINC000245312898 526209362 /nfs/dbraw/zinc/20/93/62/526209362.db2.gz YOCSCRSTBWZYLM-GWIYSAMLSA-N 0 3 350.289 5.012 50 0 FKAAHN C[C@H]1[C@H](O)[C@H](C)[C@@H](c2ccc(Cl)cc2)N[C@H]1c1ccc(Cl)cc1 ZINC000245312900 525110735 /nfs/dbraw/zinc/11/07/35/525110735.db2.gz YOCSCRSTBWZYLM-OSAYUINNSA-N 0 3 350.289 5.012 50 0 FKAAHN C[C@H]1[C@H](O)[C@@H](C)[C@@H](c2ccc(Cl)cc2)N[C@H]1c1ccc(Cl)cc1 ZINC000245312902 525110544 /nfs/dbraw/zinc/11/05/44/525110544.db2.gz YOCSCRSTBWZYLM-QRODRDHMSA-N 0 3 350.289 5.012 50 0 FKAAHN Fc1ccc(Cn2cc(CNCc3cccs3)c3ccccc32)cc1 ZINC000247527734 571316912 /nfs/dbraw/zinc/31/69/12/571316912.db2.gz NTCDLGJOHLUIGI-UHFFFAOYSA-N 0 3 350.462 5.180 50 0 FKAAHN Fc1ccc(CNCc2cn(Cc3ccccc3F)c3ccccc23)cc1 ZINC000247537279 571316874 /nfs/dbraw/zinc/31/68/74/571316874.db2.gz QXOMGLRLHXDBJD-UHFFFAOYSA-N 0 3 362.423 5.258 50 0 FKAAHN Fc1ccccc1Cn1cc(CNCc2cccs2)c2ccccc21 ZINC000247553438 571316936 /nfs/dbraw/zinc/31/69/36/571316936.db2.gz WQLSKQVVABMIQQ-UHFFFAOYSA-N 0 3 350.462 5.180 50 0 FKAAHN Fc1ccc(CNCc2cn(Cc3ccc(F)cc3)c3ccccc23)cc1 ZINC000247560106 571316867 /nfs/dbraw/zinc/31/68/67/571316867.db2.gz YNQZNCWCSFTXRJ-UHFFFAOYSA-N 0 3 362.423 5.258 50 0 FKAAHN COc1ccc(CNCc2cn(Cc3ccccc3F)c3ccccc23)cc1 ZINC000247872393 571316897 /nfs/dbraw/zinc/31/68/97/571316897.db2.gz DWPYGRGBVBDAPN-UHFFFAOYSA-N 0 3 374.459 5.127 50 0 FKAAHN COc1ccc(CNCc2cn(Cc3cccc(C)c3)c3ccccc23)cc1 ZINC000247894466 571316952 /nfs/dbraw/zinc/31/69/52/571316952.db2.gz GWSQQIYSXHJVNM-UHFFFAOYSA-N 0 3 370.496 5.296 50 0 FKAAHN COc1ccc(CNCc2cn(Cc3ccc(F)cc3)c3ccccc23)cc1 ZINC000247912108 571316880 /nfs/dbraw/zinc/31/68/80/571316880.db2.gz VBGQQQVJTSUCRK-UHFFFAOYSA-N 0 3 374.459 5.127 50 0 FKAAHN Cc1cccc(Cn2cc(CN[C@@H](C)c3ccccc3)c3ccccc32)c1 ZINC000247916666 222956275 /nfs/dbraw/zinc/95/62/75/222956275.db2.gz MWMJSBJHDFTAAF-FQEVSTJZSA-N 0 3 354.497 5.849 50 0 FKAAHN Cc1cccc(Cn2cc(CN[C@H](C)c3ccccc3)c3ccccc32)c1 ZINC000247916672 571316965 /nfs/dbraw/zinc/31/69/65/571316965.db2.gz MWMJSBJHDFTAAF-HXUWFJFHSA-N 0 3 354.497 5.849 50 0 FKAAHN COc1ccccc1CNCc1cn(Cc2cccc(C)c2)c2ccccc12 ZINC000247948208 571316905 /nfs/dbraw/zinc/31/69/05/571316905.db2.gz XFGBARUZCYKFOU-UHFFFAOYSA-N 0 3 370.496 5.296 50 0 FKAAHN Cc1cccc(Cn2cc(CNCc3ccc(F)cc3)c3ccccc32)c1 ZINC000247949724 571316941 /nfs/dbraw/zinc/31/69/41/571316941.db2.gz XVSAGWZIHVLVSR-UHFFFAOYSA-N 0 3 358.460 5.427 50 0 FKAAHN Cc1cccc(Cn2nc(CNC3CCCCCC3)c(-c3ccccc3)n2)c1 ZINC000247951063 571316889 /nfs/dbraw/zinc/31/68/89/571316889.db2.gz YJGGRXCVKSRAGS-UHFFFAOYSA-N 0 3 374.532 5.114 50 0 FKAAHN Cc1ccc(CNCc2cn(Cc3cccc(C)c3)c3ccccc23)cc1 ZINC000247953774 571316969 /nfs/dbraw/zinc/31/69/69/571316969.db2.gz ZJPNVELKGDWVFA-UHFFFAOYSA-N 0 3 354.497 5.596 50 0 FKAAHN C[C@@H]1[C@H](c2ccccc2)N[C@H](c2ccccc2)C[C@@]1(O)c1ccc(F)cc1 ZINC000248024714 571317008 /nfs/dbraw/zinc/31/70/08/571317008.db2.gz KVYUHOPVUTYJPS-GMWXCSQMSA-N 0 3 361.460 5.125 50 0 FKAAHN C[C@@H]1[C@H](c2ccccc2)N[C@@H](c2ccccc2)C[C@]1(O)c1ccc(F)cc1 ZINC000248024716 571316990 /nfs/dbraw/zinc/31/69/90/571316990.db2.gz KVYUHOPVUTYJPS-SFUZCSOBSA-N 0 3 361.460 5.125 50 0 FKAAHN Cc1ccc(Cn2nc(CNC3CCCCCC3)c(-c3ccccc3)n2)cc1 ZINC000248061787 571317114 /nfs/dbraw/zinc/31/71/14/571317114.db2.gz DEFAZKAUZDIFOK-UHFFFAOYSA-N 0 3 374.532 5.114 50 0 FKAAHN Cc1ccc(CNCc2cn(Cc3ccc(C)cc3)c3ccccc23)cc1 ZINC000248069205 571317076 /nfs/dbraw/zinc/31/70/76/571317076.db2.gz FXDBJIRWUYASFL-UHFFFAOYSA-N 0 3 354.497 5.596 50 0 FKAAHN Cc1ccc(CNCc2cn(Cc3ccccc3F)c3ccccc23)cc1 ZINC000248072048 571317095 /nfs/dbraw/zinc/31/70/95/571317095.db2.gz GIAWZDKZLVJARH-UHFFFAOYSA-N 0 3 358.460 5.427 50 0 FKAAHN Cc1ccc(CNCc2cn(Cc3cccc(Cl)c3)c3ccccc23)cc1 ZINC000248073709 571317044 /nfs/dbraw/zinc/31/70/44/571317044.db2.gz GTYGQYSZBNVISH-UHFFFAOYSA-N 0 3 374.915 5.941 50 0 FKAAHN Cc1ccc(Cn2cc(CN[C@@H](C)c3ccccc3)c3ccccc32)cc1 ZINC000248078949 571317066 /nfs/dbraw/zinc/31/70/66/571317066.db2.gz IFHCQAFLMFUJDK-FQEVSTJZSA-N 0 3 354.497 5.849 50 0 FKAAHN Cc1ccc(Cn2cc(CN[C@H](C)c3ccccc3)c3ccccc32)cc1 ZINC000248078955 571317090 /nfs/dbraw/zinc/31/70/90/571317090.db2.gz IFHCQAFLMFUJDK-HXUWFJFHSA-N 0 3 354.497 5.849 50 0 FKAAHN Cc1ccc(Cn2cc(CNCc3ccc(F)cc3)c3ccccc32)cc1 ZINC000248080162 571317017 /nfs/dbraw/zinc/31/70/17/571317017.db2.gz IOXGAQCFWIDMTA-UHFFFAOYSA-N 0 3 358.460 5.427 50 0 FKAAHN COc1ccc(CNCc2cn(Cc3ccc(C)cc3)c3ccccc23)cc1 ZINC000248082014 571317030 /nfs/dbraw/zinc/31/70/30/571317030.db2.gz JCDXUVQFYKBEGV-UHFFFAOYSA-N 0 3 370.496 5.296 50 0 FKAAHN c1ccc(Cn2nc(CNC3CCCCCCC3)c(-c3ccccc3)n2)cc1 ZINC000248085987 571317054 /nfs/dbraw/zinc/31/70/54/571317054.db2.gz FKHZAMVUIPITMR-UHFFFAOYSA-N 0 3 374.532 5.196 50 0 FKAAHN Cc1ccc(CNCc2cn(Cc3ccccc3C)c3ccccc23)cc1 ZINC000248111061 571317071 /nfs/dbraw/zinc/31/70/71/571317071.db2.gz QWFVAIITFGMCFP-UHFFFAOYSA-N 0 3 354.497 5.596 50 0 FKAAHN Cc1ccc(CNCc2cn(Cc3ccc(Cl)cc3)c3ccccc23)cc1 ZINC000248114822 571317024 /nfs/dbraw/zinc/31/70/24/571317024.db2.gz SBFBCKJCWWYKAJ-UHFFFAOYSA-N 0 3 374.915 5.941 50 0 FKAAHN COc1ccccc1CNCc1cn(Cc2ccc(C)cc2)c2ccccc12 ZINC000248115965 206570628 /nfs/dbraw/zinc/57/06/28/206570628.db2.gz SKZZINNWGLORGM-UHFFFAOYSA-N 0 3 370.496 5.296 50 0 FKAAHN Cc1ccc(CNCc2cn(Cc3ccc(F)cc3)c3ccccc23)cc1 ZINC000248132034 571316997 /nfs/dbraw/zinc/31/69/97/571316997.db2.gz ZBHUHYFACVJLIL-UHFFFAOYSA-N 0 3 358.460 5.427 50 0 FKAAHN COc1ccccc1CNCc1cn(Cc2ccccc2F)c2ccccc12 ZINC000248134804 571317012 /nfs/dbraw/zinc/31/70/12/571317012.db2.gz MGLMBLQTSFWIOV-UHFFFAOYSA-N 0 3 374.459 5.127 50 0 FKAAHN COc1ccccc1CNCc1cn(Cc2ccccc2C)c2ccccc12 ZINC000248143685 571317087 /nfs/dbraw/zinc/31/70/87/571317087.db2.gz GLSTYZCIEFSUHQ-UHFFFAOYSA-N 0 3 370.496 5.296 50 0 FKAAHN COc1ccccc1CNCc1cn(Cc2ccc(F)cc2)c2ccccc12 ZINC000248150763 571317002 /nfs/dbraw/zinc/31/70/02/571317002.db2.gz VUXWISMJLFMCPZ-UHFFFAOYSA-N 0 3 374.459 5.127 50 0 FKAAHN Cc1ccccc1Cn1cc(CN[C@@H](C)c2ccccc2)c2ccccc21 ZINC000248166930 571317037 /nfs/dbraw/zinc/31/70/37/571317037.db2.gz SESLGIVFZHOHCA-FQEVSTJZSA-N 0 3 354.497 5.849 50 0 FKAAHN Cc1ccccc1Cn1cc(CN[C@H](C)c2ccccc2)c2ccccc21 ZINC000248166932 571317047 /nfs/dbraw/zinc/31/70/47/571317047.db2.gz SESLGIVFZHOHCA-HXUWFJFHSA-N 0 3 354.497 5.849 50 0 FKAAHN Cc1ccccc1Cn1nc(CNC2CCCCCC2)c(-c2ccccc2)n1 ZINC000248170292 571317199 /nfs/dbraw/zinc/31/71/99/571317199.db2.gz VOTNTVACDHCBIM-UHFFFAOYSA-N 0 3 374.532 5.114 50 0 FKAAHN COc1ccc(CNCc2cn(Cc3ccccc3C)c3ccccc23)cc1 ZINC000248170765 571317195 /nfs/dbraw/zinc/31/71/95/571317195.db2.gz VXAJGTUTSLAQDB-UHFFFAOYSA-N 0 3 370.496 5.296 50 0 FKAAHN Cc1ccccc1Cn1cc(CNCc2ccc(F)cc2)c2ccccc21 ZINC000248173352 571317145 /nfs/dbraw/zinc/31/71/45/571317145.db2.gz XQBDOBWHLNZIKT-UHFFFAOYSA-N 0 3 358.460 5.427 50 0 FKAAHN C[C@@H](NCc1cn(Cc2cccc(Cl)c2)c2ccccc12)c1ccccc1 ZINC000248230474 571317244 /nfs/dbraw/zinc/31/72/44/571317244.db2.gz BIZSYHFLUUUNTA-GOSISDBHSA-N 0 3 374.915 6.194 50 0 FKAAHN C[C@H](NCc1cn(Cc2cccc(Cl)c2)c2ccccc12)c1ccccc1 ZINC000248230495 571317168 /nfs/dbraw/zinc/31/71/68/571317168.db2.gz BIZSYHFLUUUNTA-SFHVURJKSA-N 0 3 374.915 6.194 50 0 FKAAHN CCC[C@@H](NCc1cn(Cc2ccccc2)c2ccccc12)c1ccccc1 ZINC000248234854 571317230 /nfs/dbraw/zinc/31/72/30/571317230.db2.gz MEFVURAJDIQTRP-RUZDIDTESA-N 0 3 368.524 6.321 50 0 FKAAHN CCC[C@H](NCc1cn(Cc2ccccc2)c2ccccc12)c1ccccc1 ZINC000248234857 571317238 /nfs/dbraw/zinc/31/72/38/571317238.db2.gz MEFVURAJDIQTRP-VWLOTQADSA-N 0 3 368.524 6.321 50 0 FKAAHN C[C@@H](NCc1cn(Cc2ccc(F)cc2)c2ccccc12)c1ccccc1 ZINC000248236423 571317234 /nfs/dbraw/zinc/31/72/34/571317234.db2.gz DVSGQMLQXJWUHJ-GOSISDBHSA-N 0 3 358.460 5.680 50 0 FKAAHN C[C@H](NCc1cn(Cc2ccc(F)cc2)c2ccccc12)c1ccccc1 ZINC000248236424 571317207 /nfs/dbraw/zinc/31/72/07/571317207.db2.gz DVSGQMLQXJWUHJ-SFHVURJKSA-N 0 3 358.460 5.680 50 0 FKAAHN C[C@@H](NCc1cn(Cc2ccccc2F)c2ccccc12)c1ccccc1 ZINC000248238358 571317246 /nfs/dbraw/zinc/31/72/46/571317246.db2.gz FSPCSPRUAUTEQD-GOSISDBHSA-N 0 3 358.460 5.680 50 0 FKAAHN C[C@H](NCc1cn(Cc2ccccc2F)c2ccccc12)c1ccccc1 ZINC000248238360 571317140 /nfs/dbraw/zinc/31/71/40/571317140.db2.gz FSPCSPRUAUTEQD-SFHVURJKSA-N 0 3 358.460 5.680 50 0 FKAAHN C[C@@H](NCc1cn(Cc2ccc(Cl)cc2)c2ccccc12)c1ccccc1 ZINC000248250135 571317249 /nfs/dbraw/zinc/31/72/49/571317249.db2.gz LQCPEPCFKQRNRD-GOSISDBHSA-N 0 3 374.915 6.194 50 0 FKAAHN C[C@H](NCc1cn(Cc2ccc(Cl)cc2)c2ccccc12)c1ccccc1 ZINC000248250137 571317135 /nfs/dbraw/zinc/31/71/35/571317135.db2.gz LQCPEPCFKQRNRD-SFHVURJKSA-N 0 3 374.915 6.194 50 0 FKAAHN CN1CCC[C@@H](Oc2ccc(/C=C\c3ccc(C(F)(F)F)cc3)cc2)C1 ZINC000252620045 571287419 /nfs/dbraw/zinc/28/74/19/571287419.db2.gz LWJFYUCNSCJYQW-BBIZLLLXSA-N 0 3 361.407 5.349 50 0 FKAAHN Clc1ccc(Cn2cc(CNCc3ccccc3)c3ccccc32)cc1 ZINC000253488902 571317646 /nfs/dbraw/zinc/31/76/46/571317646.db2.gz CFAVYXSJXVOCBM-UHFFFAOYSA-N 0 3 360.888 5.633 50 0 FKAAHN Clc1cccc(Cn2cc(CNCc3ccccc3)c3ccccc32)c1 ZINC000253489549 571317606 /nfs/dbraw/zinc/31/76/06/571317606.db2.gz FOUVBWWXQYSRBV-UHFFFAOYSA-N 0 3 360.888 5.633 50 0 FKAAHN Clc1cccc(Cn2cc(CNCc3cccs3)c3ccccc32)c1 ZINC000253491041 571317613 /nfs/dbraw/zinc/31/76/13/571317613.db2.gz KZBSZFHQRYLKSP-UHFFFAOYSA-N 0 3 366.917 5.694 50 0 FKAAHN Clc1cccc(Cn2cc(CNCc3cccnc3)c3ccccc32)c1 ZINC000253492612 571317629 /nfs/dbraw/zinc/31/76/29/571317629.db2.gz QLYYMDJHZUNCNB-UHFFFAOYSA-N 0 3 361.876 5.028 50 0 FKAAHN Clc1cccc(Cn2cc(CNCc3ccncc3)c3ccccc32)c1 ZINC000253494491 571317604 /nfs/dbraw/zinc/31/76/04/571317604.db2.gz XSJWWQISFGODMC-UHFFFAOYSA-N 0 3 361.876 5.028 50 0 FKAAHN Clc1ccc(Cn2cc(CNCc3cccs3)c3ccccc32)cc1 ZINC000253494519 571317648 /nfs/dbraw/zinc/31/76/48/571317648.db2.gz XUQNSZFQKBAPEJ-UHFFFAOYSA-N 0 3 366.917 5.694 50 0 FKAAHN Clc1ccc(Cn2cc(CNCc3ccncc3)c3ccccc32)cc1 ZINC000253494782 571317601 /nfs/dbraw/zinc/31/76/01/571317601.db2.gz YTLIOWDOMNXLTD-UHFFFAOYSA-N 0 3 361.876 5.028 50 0 FKAAHN Clc1ccc(Cn2cc(CNCc3cccnc3)c3ccccc32)cc1 ZINC000253495105 571317611 /nfs/dbraw/zinc/31/76/11/571317611.db2.gz ZUZVVRLAWDRFGC-UHFFFAOYSA-N 0 3 361.876 5.028 50 0 FKAAHN Cc1ccc2nc(-c3ccc(F)cc3)c(CNCc3ccsc3)cc2c1 ZINC000299761712 210012808 /nfs/dbraw/zinc/01/28/08/210012808.db2.gz NEIDPACVONDIRN-UHFFFAOYSA-N 0 3 362.473 5.701 50 0 FKAAHN CN(C)Cc1ccc([C@H]2CCCCN2C(=O)Nc2ccccc2Cl)cc1 ZINC000299762575 223084741 /nfs/dbraw/zinc/08/47/41/223084741.db2.gz NTFIHRRRKHYYLX-HXUWFJFHSA-N 0 3 371.912 5.161 50 0 FKAAHN Clc1cccc(-c2cc3c(c(OCc4ccsc4)c2)OCCNC3)c1 ZINC000299792478 210034441 /nfs/dbraw/zinc/03/44/41/210034441.db2.gz FIFSXDQDKUXHDG-UHFFFAOYSA-N 0 3 371.889 5.130 50 0 FKAAHN CC(C)[C@H]1CC(CCNCc2ccco2)(c2ccccc2)C[C@H](C(C)C)O1 ZINC000524734702 570542989 /nfs/dbraw/zinc/54/29/89/570542989.db2.gz FGZGVDGPFLBUDF-DHIUTWEWSA-N 0 3 369.549 5.557 50 0 FKAAHN CC(C)[C@@H]1CC(CCNCc2ccco2)(c2ccccc2)C[C@@H](C(C)C)O1 ZINC000524734703 570543006 /nfs/dbraw/zinc/54/30/06/570543006.db2.gz FGZGVDGPFLBUDF-GOTSBHOMSA-N 0 3 369.549 5.557 50 0 FKAAHN CC(C)[C@H]1C[C@](CCNCc2ccco2)(c2ccccc2)C[C@@H](C(C)C)O1 ZINC000524734704 570543026 /nfs/dbraw/zinc/54/30/26/570543026.db2.gz FGZGVDGPFLBUDF-UBRQYEGLSA-N 0 3 369.549 5.557 50 0 FKAAHN O=C(CCN1CCCCC1)N1c2ccccc2Sc2ccc(Cl)cc21 ZINC000575442799 571152016 /nfs/dbraw/zinc/15/20/16/571152016.db2.gz AXDYXLIGCFPHGL-UHFFFAOYSA-N 0 3 372.921 5.345 50 0 FKAAHN C[C@@H](Cc1ccccc1)NCC(=O)N1c2ccccc2Sc2ccccc21 ZINC000669368908 571173860 /nfs/dbraw/zinc/17/38/60/571173860.db2.gz PZTBMDZMMKFSOF-KRWDZBQOSA-N 0 3 374.509 5.037 50 0 FKAAHN C[C@H](Cc1ccccc1)NCC(=O)N1c2ccccc2Sc2ccccc21 ZINC000669368909 571173890 /nfs/dbraw/zinc/17/38/90/571173890.db2.gz PZTBMDZMMKFSOF-QGZVFWFLSA-N 0 3 374.509 5.037 50 0 FKAAHN Fc1ccc([C@@H]2CCCCN2Cc2cc(CN3CCCC3)cs2)cc1 ZINC000670468970 571359365 /nfs/dbraw/zinc/35/93/65/571359365.db2.gz YNKIQCUKOBVQTA-NRFANRHFSA-N 0 3 358.526 5.210 50 0 FKAAHN Fc1ccc([C@H]2CCCCN2Cc2cc(CN3CCCC3)cs2)cc1 ZINC000670468971 571359396 /nfs/dbraw/zinc/35/93/96/571359396.db2.gz YNKIQCUKOBVQTA-OAQYLSRUSA-N 0 3 358.526 5.210 50 0 FKAAHN