smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name C[C@@H](c1nc(C2CC2)no1)N1C[C@H](c2ccc(F)cc2)C[C@H]1C ZINC000076808319 185044607 /nfs/dbraw/zinc/04/46/07/185044607.db2.gz ZSBMWSYZLMTCSS-TYNCELHUSA-N 0 1 315.392 4.025 20 0 DIADMN CC(C)CC[C@H](NCc1cccnc1-n1ccnc1)c1ccoc1 ZINC000285737187 534943612 /nfs/dbraw/zinc/94/36/12/534943612.db2.gz QYDBQHZZHMSBKD-SFHVURJKSA-N 0 1 324.428 4.127 20 0 DIADMN Cc1ccc(CN[C@H](C)c2ccc(OCC(F)(F)F)cc2)o1 ZINC000063559012 190697131 /nfs/dbraw/zinc/69/71/31/190697131.db2.gz KMDKCRKJVBALPE-GFCCVEGCSA-N 0 1 313.319 4.380 20 0 DIADMN Fc1ccc2c(c1)nccc2N1CCC(C2CCOCC2)CC1 ZINC000133579764 334965869 /nfs/dbraw/zinc/96/58/69/334965869.db2.gz VPRQNADAOBHBTM-UHFFFAOYSA-N 0 1 314.404 4.017 20 0 DIADMN CSCCCN1CCC[C@@H]1c1ccc(Br)s1 ZINC000542248491 341001816 /nfs/dbraw/zinc/00/18/16/341001816.db2.gz QXBLFAQCBNQPKD-SNVBAGLBSA-N 0 1 320.321 4.401 20 0 DIADMN CCCOc1ccc(CN[C@@H](C)c2ccc(C)o2)cc1OC ZINC000072672156 191210975 /nfs/dbraw/zinc/21/09/75/191210975.db2.gz GWGSGNYWVLCFCT-AWEZNQCLSA-N 0 1 303.402 4.236 20 0 DIADMN Cc1nc(CN2CCC(c3c[nH]c4ccccc43)CC2)cs1 ZINC000073297780 191302759 /nfs/dbraw/zinc/30/27/59/191302759.db2.gz XRXNYWUQQTWICH-UHFFFAOYSA-N 0 1 311.454 4.312 20 0 DIADMN CC(C)c1ccc(NC(=O)c2coc(CN)c2)c(C(C)C)c1 ZINC000187375992 200103109 /nfs/dbraw/zinc/10/31/09/200103109.db2.gz BDZJTDKRUCVPGP-UHFFFAOYSA-N 0 1 300.402 4.237 20 0 DIADMN Cc1nccnc1[C@H](C)N[C@H](C)c1cccc(C(F)(F)F)c1 ZINC000187674078 200142443 /nfs/dbraw/zinc/14/24/43/200142443.db2.gz HBMHZBVHPVEUCN-PWSUYJOCSA-N 0 1 309.335 4.216 20 0 DIADMN Cc1noc(C)c1CN[C@@H](c1ccccc1F)C1CCCC1 ZINC000091307456 193037614 /nfs/dbraw/zinc/03/76/14/193037614.db2.gz XBUBHIOFONNVRA-GOSISDBHSA-N 0 1 302.393 4.452 20 0 DIADMN Cc1cc(CN[C@@H](c2cccc(C(F)(F)F)c2)C(C)C)on1 ZINC000091333236 193041411 /nfs/dbraw/zinc/04/14/11/193041411.db2.gz TXOICKGXXIAJHL-OAHLLOKOSA-N 0 1 312.335 4.489 20 0 DIADMN COC[C@@H](N[C@H](C)c1ccc(C)s1)c1ccc(F)c(F)c1 ZINC000091413613 193052930 /nfs/dbraw/zinc/05/29/30/193052930.db2.gz FAQSKWJEIJVOIB-IAQYHMDHSA-N 0 1 311.397 4.373 20 0 DIADMN COC[C@H](N[C@H]1CCc2cc(F)ccc21)c1ccc(F)c(F)c1 ZINC000091413293 193053423 /nfs/dbraw/zinc/05/34/23/193053423.db2.gz YAMRPKWEHNOBNA-ROUUACIJSA-N 0 1 321.342 4.069 20 0 DIADMN C[C@H](c1ccccn1)N(C)Cc1ccc(OCC(F)(F)F)cc1 ZINC000091703151 193093961 /nfs/dbraw/zinc/09/39/61/193093961.db2.gz YUVUQJUYSPFUKC-CYBMUJFWSA-N 0 1 324.346 4.216 20 0 DIADMN Cc1noc(C2CCN(Cc3ccc(-c4ccccc4)o3)CC2)n1 ZINC000091833530 193114999 /nfs/dbraw/zinc/11/49/99/193114999.db2.gz ZVARXFIFGBAWIE-UHFFFAOYSA-N 0 1 323.396 4.018 20 0 DIADMN C[C@@H](N[C@@H](C)c1ccc(F)cn1)c1ccc(Br)cc1 ZINC000092196258 193172109 /nfs/dbraw/zinc/17/21/09/193172109.db2.gz SOJIKFFTYINWMB-MNOVXSKESA-N 0 1 323.209 4.395 20 0 DIADMN C[C@@H]1C[C@H](C)CN(C(=O)Nc2ccc3nc(C(F)F)[nH]c3c2)C1 ZINC000093352728 193236981 /nfs/dbraw/zinc/23/69/81/193236981.db2.gz WFILWAWLILXMIM-AOOOYVTPSA-N 0 1 322.359 4.010 20 0 DIADMN CC(=O)Nc1ccc(CN[C@@H](C)c2ccccc2Cl)cc1 ZINC000017314494 182083137 /nfs/dbraw/zinc/08/31/37/182083137.db2.gz DDZSRRODCWTQFX-LBPRGKRZSA-N 0 1 302.805 4.149 20 0 DIADMN COc1ccccc1CN[C@H](C)c1ccc(Br)cc1 ZINC000019903156 182162449 /nfs/dbraw/zinc/16/24/49/182162449.db2.gz FHYYUEPCVYVNKP-GFCCVEGCSA-N 0 1 320.230 4.309 20 0 DIADMN COc1ccc(CN[C@@H](C)c2ccccc2Br)cc1 ZINC000019909082 182163677 /nfs/dbraw/zinc/16/36/77/182163677.db2.gz JXSOBPNPJKEPPV-LBPRGKRZSA-N 0 1 320.230 4.309 20 0 DIADMN COc1ccccc1[C@H](C)NCc1cccc(Br)c1 ZINC000020096575 182185964 /nfs/dbraw/zinc/18/59/64/182185964.db2.gz QLPVGUBGAVJJFE-LBPRGKRZSA-N 0 1 320.230 4.309 20 0 DIADMN COc1ccc([C@H](C)NCc2ccccc2Cl)cc1OC ZINC000021505775 182276042 /nfs/dbraw/zinc/27/60/42/182276042.db2.gz NUMITKOBXIDNMM-LBPRGKRZSA-N 0 1 305.805 4.208 20 0 DIADMN Cc1nc2cc(N[C@H]3CCC[C@@H](C(F)(F)F)C3)ccc2n1C ZINC000525863979 335031179 /nfs/dbraw/zinc/03/11/79/335031179.db2.gz VNPOJSOEPZORBY-NEPJUHHUSA-N 0 1 311.351 4.415 20 0 DIADMN COc1ccc(C)cc1[C@H](C)N[C@@H](C)c1sc(C)nc1C ZINC000040517841 183090296 /nfs/dbraw/zinc/09/02/96/183090296.db2.gz GUZUNNSRHTVRIS-RYUDHWBXSA-N 0 1 304.459 4.489 20 0 DIADMN Cc1ncc(CN[C@@H](C)c2ccccc2C(F)(F)F)s1 ZINC000040997385 183154982 /nfs/dbraw/zinc/15/49/82/183154982.db2.gz NTPZJQAAWICMTP-VIFPVBQESA-N 0 1 300.349 4.321 20 0 DIADMN Cn1ccnc1CN[C@@H](CCCc1ccccc1)c1ccccc1 ZINC000057627841 184042674 /nfs/dbraw/zinc/04/26/74/184042674.db2.gz YWJHUIWBUPWVMB-FQEVSTJZSA-N 0 1 319.452 4.274 20 0 DIADMN COc1cccc([C@@H](C)NCc2cnc(C(C)(C)C)s2)c1 ZINC000059181038 184135014 /nfs/dbraw/zinc/13/50/14/184135014.db2.gz UTMJWHCDTMYJFO-GFCCVEGCSA-N 0 1 304.459 4.300 20 0 DIADMN OC[C@@H](N[C@@H]1CCSc2ccc(Cl)cc21)c1ccccc1 ZINC000063000271 184265354 /nfs/dbraw/zinc/26/53/54/184265354.db2.gz ULVDVVZWSJKMJH-HZPDHXFCSA-N 0 1 319.857 4.200 20 0 DIADMN CC(=O)Nc1cccc([C@@H](C)N[C@H]2COc3c2ccc(C)c3C)c1 ZINC000271487076 129922136 /nfs/dbraw/zinc/92/21/36/129922136.db2.gz OLCYWFOTOAGTHP-KUHUBIRLSA-N 0 1 324.424 4.046 20 0 DIADMN Cc1ccncc1[C@@H](C)N[C@H]1CCSc2ccc(F)cc21 ZINC000271624663 129942305 /nfs/dbraw/zinc/94/23/05/129942305.db2.gz XPEAWUJFJAIBQV-WBMJQRKESA-N 0 1 302.418 4.417 20 0 DIADMN CC[C@H](NCc1cc(OC)cc(C)n1)c1ccc(Cl)s1 ZINC000272187823 130005736 /nfs/dbraw/zinc/00/57/36/130005736.db2.gz USOFOVGIURIFAL-ZDUSSCGKSA-N 0 1 310.850 4.354 20 0 DIADMN COCC[C@H](NCc1ccc2ncccc2c1)c1ccc(C)o1 ZINC000272220476 130008713 /nfs/dbraw/zinc/00/87/13/130008713.db2.gz DOFIFSGEFHGEQW-SFHVURJKSA-N 0 1 310.397 4.004 20 0 DIADMN Cc1n[nH]c(C(F)F)c1NC(=O)[C@@H]1CC[C@H]2CCCC[C@@H]2C1 ZINC000272289947 130017778 /nfs/dbraw/zinc/01/77/78/130017778.db2.gz CXIVPUUSXLUGMF-IJLUTSLNSA-N 0 1 311.376 4.201 20 0 DIADMN Cc1n[nH]c(C(F)F)c1NC(=O)[C@@H]1CC[C@H]2CCCC[C@H]2C1 ZINC000272289944 130017803 /nfs/dbraw/zinc/01/78/03/130017803.db2.gz CXIVPUUSXLUGMF-GRYCIOLGSA-N 0 1 311.376 4.201 20 0 DIADMN C[C@H](Cc1ccccc1C(F)(F)F)N[C@H](C)c1cscn1 ZINC000272566110 130042254 /nfs/dbraw/zinc/04/22/54/130042254.db2.gz OHBAMQJHCQAOQU-GHMZBOCLSA-N 0 1 314.376 4.444 20 0 DIADMN COCC[C@H](NCc1ccc(C(F)(F)F)cc1)c1ccco1 ZINC000272608207 130045174 /nfs/dbraw/zinc/04/51/74/130045174.db2.gz UDPAJQUAHNKAPZ-AWEZNQCLSA-N 0 1 313.319 4.166 20 0 DIADMN CCc1nc(C)c([C@@H](C)N[C@@H](CCOC)c2ccco2)s1 ZINC000272621850 130046797 /nfs/dbraw/zinc/04/67/97/130046797.db2.gz YHMKRNXILKQZFV-YPMHNXCESA-N 0 1 308.447 4.035 20 0 DIADMN CC[C@H](N[C@@H](C)c1ccc([S@@](C)=O)cc1)c1ccccc1F ZINC000272635866 130048659 /nfs/dbraw/zinc/04/86/59/130048659.db2.gz NSYMEKKMSBCGKI-KVYZTJHFSA-N 0 1 319.445 4.365 20 0 DIADMN CC(=O)Nc1ccc([C@@H](C)N[C@H]2COc3c2ccc(C)c3C)cc1 ZINC000272797752 130064917 /nfs/dbraw/zinc/06/49/17/130064917.db2.gz ZAZAHRMPKBMPJG-KUHUBIRLSA-N 0 1 324.424 4.046 20 0 DIADMN COCC[C@@H](N[C@@H](C)c1cc(C)c(OC)cc1C)c1ccco1 ZINC000273183577 130096323 /nfs/dbraw/zinc/09/63/23/130096323.db2.gz FMSQWPGGDPVUQV-DOTOQJQBSA-N 0 1 317.429 4.333 20 0 DIADMN CC(C)c1nc([C@H](C)N[C@@H]2CCCc3c(Cl)cccc32)n[nH]1 ZINC000273485577 130127810 /nfs/dbraw/zinc/12/78/10/130127810.db2.gz NGHAIZVTZSDQMM-XHDPSFHLSA-N 0 1 318.852 4.310 20 0 DIADMN Cc1cccc(CN[C@@H](C)c2cc(Br)ncc2F)c1 ZINC000273905325 130184200 /nfs/dbraw/zinc/18/42/00/130184200.db2.gz WOYKGEQIHSKGQO-NSHDSACASA-N 0 1 323.209 4.142 20 0 DIADMN c1csc(-c2cc(-c3nc([C@@H]4CCCCS4)no3)[nH]n2)c1 ZINC000273964928 130191549 /nfs/dbraw/zinc/19/15/49/130191549.db2.gz JWAUIXBEXZQJOZ-LBPRGKRZSA-N 0 1 318.427 4.146 20 0 DIADMN CC(C)c1ccc(CN(C)Cc2cn(C)nc2C(F)F)cc1 ZINC000274440825 130236546 /nfs/dbraw/zinc/23/65/46/130236546.db2.gz BXHIYGYDTOMVML-UHFFFAOYSA-N 0 1 307.388 4.113 20 0 DIADMN C[C@@H](c1ccc(Cl)cc1)N(C)Cc1cn(C)nc1C(F)F ZINC000274466733 130237941 /nfs/dbraw/zinc/23/79/41/130237941.db2.gz ISAPCMIZUSJEGY-JTQLQIEISA-N 0 1 313.779 4.204 20 0 DIADMN Cc1ccc([C@H](C)N(C)Cc2cn(C)nc2C(F)F)c(C)c1 ZINC000274455702 130238494 /nfs/dbraw/zinc/23/84/94/130238494.db2.gz GDXQYAAXPJVSJH-ZDUSSCGKSA-N 0 1 307.388 4.168 20 0 DIADMN CCCOc1ccc(CN[C@H](C)c2cncc(C)c2)cc1OC ZINC000274616077 130248730 /nfs/dbraw/zinc/24/87/30/130248730.db2.gz OLBJJRYEXDSPGI-OAHLLOKOSA-N 0 1 314.429 4.038 20 0 DIADMN Cc1cncc([C@H](C)N[C@H](C)c2ccccc2OC(F)F)c1 ZINC000274600466 130248949 /nfs/dbraw/zinc/24/89/49/130248949.db2.gz LKOAXWHAYUYOIC-QWHCGFSZSA-N 0 1 306.356 4.403 20 0 DIADMN COc1ccsc1[C@@H](C)N[C@@H](C)c1cc(C)ccc1OC ZINC000274617000 130250549 /nfs/dbraw/zinc/25/05/49/130250549.db2.gz VHAFTPUNRNANPU-QWHCGFSZSA-N 0 1 305.443 4.486 20 0 DIADMN Cn1c(CN[C@@H]2CCc3ccccc32)nc2cccc(Cl)c21 ZINC000274796139 130262294 /nfs/dbraw/zinc/26/22/94/130262294.db2.gz TVHMTBDWLYXAJO-OAHLLOKOSA-N 0 1 311.816 4.004 20 0 DIADMN Cc1csc(C2(NCCC(=O)c3ccc(C)cc3)CCC2)n1 ZINC000275245823 130299807 /nfs/dbraw/zinc/29/98/07/130299807.db2.gz XTWWKEDAVNBGPF-UHFFFAOYSA-N 0 1 314.454 4.002 20 0 DIADMN Cc1cc2c(cc1C)[C@H](N[C@@H](CO)c1ccccc1)CCS2 ZINC000275386833 130312187 /nfs/dbraw/zinc/31/21/87/130312187.db2.gz YEEWEIRDGUZFGS-MSOLQXFVSA-N 0 1 313.466 4.164 20 0 DIADMN CSCc1cccc(CN[C@H](C)c2cccnc2Cl)c1 ZINC000275708294 130368768 /nfs/dbraw/zinc/36/87/68/130368768.db2.gz LWGASZICERTPOB-GFCCVEGCSA-N 0 1 306.862 4.449 20 0 DIADMN Cc1ccc(Br)cc1CN[C@H](C)c1cncs1 ZINC000275830322 130394066 /nfs/dbraw/zinc/39/40/66/130394066.db2.gz FRATXHBHNZJPHT-SNVBAGLBSA-N 0 1 311.248 4.065 20 0 DIADMN COc1c(C)cnc(CN[C@@H](C)c2ccc(SC)cc2)c1C ZINC000281300960 130851677 /nfs/dbraw/zinc/85/16/77/130851677.db2.gz HMBUSFGSQUPVOT-AWEZNQCLSA-N 0 1 316.470 4.280 20 0 DIADMN CCOc1cc(CN(C)[C@@H](C)c2cccnc2)cc(Cl)c1O ZINC000283835323 131028395 /nfs/dbraw/zinc/02/83/95/131028395.db2.gz CUPRIADAWZFSTJ-LBPRGKRZSA-N 0 1 320.820 4.032 20 0 DIADMN CCOc1cc(CN(C)[C@H](C)c2ccncc2)cc(Cl)c1O ZINC000284032090 131042636 /nfs/dbraw/zinc/04/26/36/131042636.db2.gz LGKQXSCVJLUYTR-GFCCVEGCSA-N 0 1 320.820 4.032 20 0 DIADMN Cc1cc(CN[C@H](c2ccccc2)c2cc(C)ccc2C)n(C)n1 ZINC000284081969 131046869 /nfs/dbraw/zinc/04/68/69/131046869.db2.gz BDOMHHPZBILPQX-OAQYLSRUSA-N 0 1 319.452 4.225 20 0 DIADMN COc1ncc([C@@H](C)N[C@@H]2CCc3cc(F)ccc32)cc1Cl ZINC000284158273 131053410 /nfs/dbraw/zinc/05/34/10/131053410.db2.gz DVNCVOWSGRKYNV-QLJPJBMISA-N 0 1 320.795 4.221 20 0 DIADMN CC(C)Oc1ccc([C@H](C)N[C@H](C)c2cn[nH]c2)cc1Cl ZINC000284169166 131055579 /nfs/dbraw/zinc/05/55/79/131055579.db2.gz FGTCZBQVZFPJPK-NWDGAFQWSA-N 0 1 307.825 4.262 20 0 DIADMN CC[C@@](C)(NC[C@H](OC)c1ccccc1)c1nc(C)cs1 ZINC000284225829 131060784 /nfs/dbraw/zinc/06/07/84/131060784.db2.gz BFVGJAJYNHIOPX-DOTOQJQBSA-N 0 1 304.459 4.054 20 0 DIADMN COc1ncc([C@@H](C)N[C@H]2CCc3c2cccc3F)cc1Cl ZINC000284279212 131065672 /nfs/dbraw/zinc/06/56/72/131065672.db2.gz JTAFWGSMBWKKMA-HWPZZCPQSA-N 0 1 320.795 4.221 20 0 DIADMN C[C@@H]1CC=CC[C@H]1C(=O)Nc1ccc2nc(C(F)F)[nH]c2c1 ZINC000284318887 131069048 /nfs/dbraw/zinc/06/90/48/131069048.db2.gz VRUSCRGPPFIVBJ-MWLCHTKSSA-N 0 1 305.328 4.041 20 0 DIADMN CCCCOc1ccc([C@@H](C)NCc2c(C)noc2C)cc1 ZINC000284316963 131069551 /nfs/dbraw/zinc/06/95/51/131069551.db2.gz LPJRYWRFIGBVKK-CYBMUJFWSA-N 0 1 302.418 4.321 20 0 DIADMN CCc1nnc(CN(CC(C)C)[C@H](C)c2ccccc2C)o1 ZINC000284370286 131074150 /nfs/dbraw/zinc/07/41/50/131074150.db2.gz DXYFCZISAMACKH-OAHLLOKOSA-N 0 1 301.434 4.160 20 0 DIADMN CCn1cc(CN[C@H](C)c2ccc(OC(C)C)c(Cl)c2)cn1 ZINC000284488860 131085462 /nfs/dbraw/zinc/08/54/62/131085462.db2.gz VCRIDCVUQMQYOI-CYBMUJFWSA-N 0 1 321.852 4.194 20 0 DIADMN CCn1cc(CN[C@@H](C)c2ccc(OC(C)C)c(Cl)c2)cn1 ZINC000284488862 131085608 /nfs/dbraw/zinc/08/56/08/131085608.db2.gz VCRIDCVUQMQYOI-ZDUSSCGKSA-N 0 1 321.852 4.194 20 0 DIADMN Cc1cc(CN[C@H](c2ccccc2)c2ccc(C)cc2C)n(C)n1 ZINC000284558079 131092137 /nfs/dbraw/zinc/09/21/37/131092137.db2.gz YFFJUVCTHQKQBM-OAQYLSRUSA-N 0 1 319.452 4.225 20 0 DIADMN COc1ccccc1SC[C@@H](C)CN[C@@H](C)c1cc(C)on1 ZINC000284864523 131117478 /nfs/dbraw/zinc/11/74/78/131117478.db2.gz AQYODAGTKDHKOR-JSGCOSHPSA-N 0 1 320.458 4.071 20 0 DIADMN Oc1ccc2c(c1)[C@@H](N[C@H]1CCOc3c(F)cccc31)CCC2 ZINC000285326073 131157923 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ZINC000301232320 336295921 /nfs/dbraw/zinc/29/59/21/336295921.db2.gz BFYZZZGSNBCOFN-LLVKDONJSA-N 0 1 310.328 4.276 20 0 DIADMN COc1ccc(CNc2ccnc3cc(F)ccc32)c(OC)c1 ZINC000301287375 336298811 /nfs/dbraw/zinc/29/88/11/336298811.db2.gz RZUBMOGCXDPPQB-UHFFFAOYSA-N 0 1 312.344 4.003 20 0 DIADMN COc1ccc(CNc2ccnc3cc(F)ccc32)cc1OC ZINC000301304277 336299882 /nfs/dbraw/zinc/29/98/82/336299882.db2.gz ZFPALOBUAHQGOE-UHFFFAOYSA-N 0 1 312.344 4.003 20 0 DIADMN O[C@H](CNc1ccnc2cc(F)ccc21)c1ccccc1Cl ZINC000301352992 336302110 /nfs/dbraw/zinc/30/21/10/336302110.db2.gz LYLPKYVDKQQPEJ-QGZVFWFLSA-N 0 1 316.763 4.173 20 0 DIADMN Fc1ccc2c(c1)nccc2NCc1ccc(-n2cccn2)cc1 ZINC000301533131 336312968 /nfs/dbraw/zinc/31/29/68/336312968.db2.gz QAKPGBGKKWVIEH-UHFFFAOYSA-N 0 1 318.355 4.172 20 0 DIADMN Fc1cc(Cl)cnc1NC[C@H](c1ccco1)N1CCCCC1 ZINC000301574682 336315936 /nfs/dbraw/zinc/31/59/36/336315936.db2.gz ZJSKFMKIOKIZNK-CQSZACIVSA-N 0 1 323.799 4.106 20 0 DIADMN Fc1ccc2c(c1)nccc2NCCc1ccc(Cl)nc1 ZINC000301656881 336321192 /nfs/dbraw/zinc/32/11/92/336321192.db2.gz LGVJKKIBYONMJH-UHFFFAOYSA-N 0 1 301.752 4.077 20 0 DIADMN Cc1cc(NCc2c(C)cc(C)[nH]c2=O)c2cc(F)ccc2n1 ZINC000301674727 336322755 /nfs/dbraw/zinc/32/27/55/336322755.db2.gz PIZNGWZLSXXRQA-UHFFFAOYSA-N 0 1 311.360 4.012 20 0 DIADMN Cc1cc(NC[C@H](CCO)c2ccccc2)c2cc(F)ccc2n1 ZINC000301685798 336323325 /nfs/dbraw/zinc/32/33/25/336323325.db2.gz UMENGTVMDCPRIW-INIZCTEOSA-N 0 1 324.399 4.260 20 0 DIADMN Fc1ccc2c(c1)nccc2NCc1cccc2c1OCCCO2 ZINC000301757740 336328064 /nfs/dbraw/zinc/32/80/64/336328064.db2.gz LKXOXYHGERSAKG-UHFFFAOYSA-N 0 1 324.355 4.147 20 0 DIADMN CC[C@H](CCO)CNc1ccnc2cc(C(F)(F)F)ccc21 ZINC000301789991 336330099 /nfs/dbraw/zinc/33/00/99/336330099.db2.gz MZRVQFIZCOUKEY-LLVKDONJSA-N 0 1 312.335 4.074 20 0 DIADMN CCOC1CCN(c2ccnc3cc(C(F)(F)F)ccc32)CC1 ZINC000301791822 336330151 /nfs/dbraw/zinc/33/01/51/336330151.db2.gz NSDDCOUAPABMIV-UHFFFAOYSA-N 0 1 324.346 4.259 20 0 DIADMN CC(C)c1cc(NC[C@H](c2ccco2)N(C)C)nc(C(C)C)n1 ZINC000301799896 336330865 /nfs/dbraw/zinc/33/08/65/336330865.db2.gz BPQKDAYSXKEQBX-OAHLLOKOSA-N 0 1 316.449 4.031 20 0 DIADMN COCCC1(CNc2ccnc3cc(C(F)(F)F)ccc32)CC1 ZINC000301802211 336331096 /nfs/dbraw/zinc/33/10/96/336331096.db2.gz SXKQTARYEICEAC-UHFFFAOYSA-N 0 1 324.346 4.482 20 0 DIADMN CCc1nc2sccc2c(NCc2nc3cccc(C)c3[nH]2)n1 ZINC000301904436 336337387 /nfs/dbraw/zinc/33/73/87/336337387.db2.gz YCNPHSDPJWFATP-UHFFFAOYSA-N 0 1 323.425 4.051 20 0 DIADMN COc1cc(F)cc(CNc2ccnc3cc(F)ccc32)c1 ZINC000301942514 336339171 /nfs/dbraw/zinc/33/91/71/336339171.db2.gz XHIISYABVLJZJT-UHFFFAOYSA-N 0 1 300.308 4.134 20 0 DIADMN COC1(CNc2ccnc3cc(C(F)(F)F)ccc32)CCC1 ZINC000302009585 336342915 /nfs/dbraw/zinc/34/29/15/336342915.db2.gz BXJBMANZKJQNBP-UHFFFAOYSA-N 0 1 310.319 4.235 20 0 DIADMN Cc1cc(NC[C@@H](C)c2nccs2)c2cc(F)ccc2n1 ZINC000302140416 336350453 /nfs/dbraw/zinc/35/04/53/336350453.db2.gz OQKPAJYQUWGEHR-SNVBAGLBSA-N 0 1 301.390 4.354 20 0 DIADMN C[C@H](Nc1ncnc2[nH]cnc21)c1ccc(Cl)c2ccccc21 ZINC000302154199 336351146 /nfs/dbraw/zinc/35/11/46/336351146.db2.gz DBJGMDCAQMNYGX-JTQLQIEISA-N 0 1 323.787 4.333 20 0 DIADMN CC(C)[C@@H]1CCN([C@@H](C)c2nnc(-c3ccccc3F)s2)C1 ZINC000514111673 336364688 /nfs/dbraw/zinc/36/46/88/336364688.db2.gz SPGCFFDIAPGBJD-QWHCGFSZSA-N 0 1 319.449 4.383 20 0 DIADMN CC(C)SCCN[C@@H](c1ccc(F)cc1)c1ccccn1 ZINC000514114549 336368189 /nfs/dbraw/zinc/36/81/89/336368189.db2.gz HXOBQBWKXNREDZ-KRWDZBQOSA-N 0 1 304.434 4.041 20 0 DIADMN Oc1cc(Cl)ccc1-c1nc(-c2nccc3ccccc32)no1 ZINC000320854462 336369760 /nfs/dbraw/zinc/36/97/60/336369760.db2.gz QDFUZNHHWMLBMF-UHFFFAOYSA-N 0 1 323.739 4.311 20 0 DIADMN Fc1ccc2c(c1)nccc2N1CCC(c2ccncc2)CC1 ZINC000302800696 336369929 /nfs/dbraw/zinc/36/99/29/336369929.db2.gz SXLYCLFRMBWLBM-UHFFFAOYSA-N 0 1 307.372 4.153 20 0 DIADMN CC[C@@H](N[C@H](CCOC)c1ccc(C)o1)c1cccc(OC)c1 ZINC000352970371 336380210 /nfs/dbraw/zinc/38/02/10/336380210.db2.gz UOFYZPKIGGVKMI-QZTJIDSGSA-N 0 1 317.429 4.415 20 0 DIADMN Fc1ccc(OC2CCN(Cc3cccc(F)c3)CC2)cc1 ZINC000352977576 336380869 /nfs/dbraw/zinc/38/08/69/336380869.db2.gz QTLCAGZUNFOCLV-UHFFFAOYSA-N 0 1 303.352 4.008 20 0 DIADMN c1coc([C@@H](CNc2nc3ccccc3o2)N2CCCCC2)c1 ZINC000025249657 336387644 /nfs/dbraw/zinc/38/76/44/336387644.db2.gz FTHKTEQYCQVJDS-OAHLLOKOSA-N 0 1 311.385 4.060 20 0 DIADMN CCCc1csc(CN[C@@H]2CCCC[C@@H]2C(F)(F)F)n1 ZINC000563958116 336388321 /nfs/dbraw/zinc/38/83/21/336388321.db2.gz RJDNFBOUCCSPAK-NWDGAFQWSA-N 0 1 306.397 4.306 20 0 DIADMN Cc1cc2cc(CNCc3ccc4c(c3)COC4)oc2cc1C ZINC000532886316 336393218 /nfs/dbraw/zinc/39/32/18/336393218.db2.gz ATPSRTYRUFPWES-UHFFFAOYSA-N 0 1 307.393 4.370 20 0 DIADMN C[C@@H](NCCO[C@@H]1CCCCO1)c1cccc(Cl)c1Cl ZINC000193089389 336396381 /nfs/dbraw/zinc/39/63/81/336396381.db2.gz FCSNGKNUZBGJGU-BXUZGUMPSA-N 0 1 318.244 4.187 20 0 DIADMN C[C@H](NCc1cc(C(C)(C)C)on1)[C@H]1Oc2ccccc2[C@@H]1C ZINC000564006674 336399710 /nfs/dbraw/zinc/39/97/10/336399710.db2.gz PLDTYEORKMOSCZ-LXIYXOSZSA-N 0 1 314.429 4.015 20 0 DIADMN FC(F)(F)c1cccc(CN2CCC(OC3CCC3)CC2)c1 ZINC000418105762 336401959 /nfs/dbraw/zinc/40/19/59/336401959.db2.gz YNOPONACXVURGJ-UHFFFAOYSA-N 0 1 313.363 4.239 20 0 DIADMN CC(C)n1cc(CN[C@H](C)c2cc3cccc(F)c3o2)cn1 ZINC000353207527 336406442 /nfs/dbraw/zinc/40/64/42/336406442.db2.gz IPQXUWQTIVYOTD-GFCCVEGCSA-N 0 1 301.365 4.200 20 0 DIADMN C[C@H](N[C@H]1CCCc2c1cnn2C)c1cc2cccc(F)c2o1 ZINC000353351803 336413126 /nfs/dbraw/zinc/41/31/26/336413126.db2.gz MSOQDSVMLSZXAZ-NHYWBVRUSA-N 0 1 313.376 4.034 20 0 DIADMN Fc1ccccc1[C@@H](F)C1CCN(Cc2cccnc2)CC1 ZINC000367153245 336415803 /nfs/dbraw/zinc/41/58/03/336415803.db2.gz XORAJPVURSUQJO-SFHVURJKSA-N 0 1 302.368 4.144 20 0 DIADMN Cc1nc(C(C)C)sc1[C@H](C)NCc1ccc2cc[nH]c2n1 ZINC000353653459 336432022 /nfs/dbraw/zinc/43/20/22/336432022.db2.gz CLAQWQASAVVGTM-NSHDSACASA-N 0 1 314.458 4.302 20 0 DIADMN C[C@@H]1C[C@H](NCc2cnn3ccccc23)c2ccsc2S1 ZINC000353891625 336446289 /nfs/dbraw/zinc/44/62/89/336446289.db2.gz YDYKMJJECXSUNP-RISCZKNCSA-N 0 1 315.467 4.111 20 0 DIADMN CC[C@@H](NCc1cnn(CC)c1)c1ccc(Cl)c(Cl)c1 ZINC000353947049 336450589 /nfs/dbraw/zinc/45/05/89/336450589.db2.gz KVYSHEDARFTJCN-OAHLLOKOSA-N 0 1 312.244 4.451 20 0 DIADMN CC(C)(C)OCCCCN(Cc1ccco1)Cc1ccco1 ZINC000354881509 336486387 /nfs/dbraw/zinc/48/63/87/336486387.db2.gz AFBXQIWKTAGPIT-UHFFFAOYSA-N 0 1 305.418 4.470 20 0 DIADMN COc1ccsc1CNc1ccc(CN(C)C)c(Cl)c1 ZINC000355595191 336515786 /nfs/dbraw/zinc/51/57/86/336515786.db2.gz GEOXVDCLWBARFL-UHFFFAOYSA-N 0 1 310.850 4.084 20 0 DIADMN CCc1cnc(CNc2ccc(CN(C)C)c(Cl)c2)s1 ZINC000355597542 336515815 /nfs/dbraw/zinc/51/58/15/336515815.db2.gz JUZZGXVLRFRWAS-UHFFFAOYSA-N 0 1 309.866 4.033 20 0 DIADMN Cc1cnc(CN2CCC(Cc3ccc(F)cc3)CC2)s1 ZINC000357312726 336580230 /nfs/dbraw/zinc/58/02/30/336580230.db2.gz XWBNLOWWCLXKRE-UHFFFAOYSA-N 0 1 304.434 4.045 20 0 DIADMN COc1ccc([C@H](C)N[C@@H]2CCCOc3ccc(F)cc32)cc1 ZINC000358014752 336606078 /nfs/dbraw/zinc/60/60/78/336606078.db2.gz CYVSQJLSVHYWRU-SCLBCKFNSA-N 0 1 315.388 4.399 20 0 DIADMN Cc1cc(CN[C@@H](c2ccccc2)c2cccnc2)cc(C)c1O ZINC000367294299 336608723 /nfs/dbraw/zinc/60/87/23/336608723.db2.gz JNALBBADLZQZPX-FQEVSTJZSA-N 0 1 318.420 4.283 20 0 DIADMN CC[C@H](N[C@H](CO)c1cccc(F)c1)c1ccc(Cl)cc1 ZINC000358165499 336614403 /nfs/dbraw/zinc/61/44/03/336614403.db2.gz VWTBUKUQNLVWNT-DLBZAZTESA-N 0 1 307.796 4.253 20 0 DIADMN CCc1nc(C)c([C@@H](C)N[C@H](COC)c2ccc(F)cc2)s1 ZINC000358184221 336615596 /nfs/dbraw/zinc/61/55/96/336615596.db2.gz XBRDSRIVGQFNLJ-IAQYHMDHSA-N 0 1 322.449 4.191 20 0 DIADMN CCC[C@H](N[C@H](C)c1ccc([S@](C)=O)cc1)c1ccccn1 ZINC000358235826 336618574 /nfs/dbraw/zinc/61/85/74/336618574.db2.gz YZNDIXZUCDIVLM-GHNFSYLKSA-N 0 1 316.470 4.011 20 0 DIADMN Cc1ccsc1[C@H](CO)N[C@@H]1CCSc2ccc(F)cc21 ZINC000358390175 336627778 /nfs/dbraw/zinc/62/77/78/336627778.db2.gz XSVRBPIBONECCC-KGLIPLIRSA-N 0 1 323.458 4.056 20 0 DIADMN CC[C@@H](N[C@@H](C)c1ccc(Br)cn1)c1ccncc1 ZINC000358761676 336642308 /nfs/dbraw/zinc/64/23/08/336642308.db2.gz XDCWSAJECLZVFQ-SMDDNHRTSA-N 0 1 320.234 4.041 20 0 DIADMN Fc1cccc(CN[C@H]2CCCc3nn(-c4ccccc4)cc32)c1 ZINC000358931147 336648001 /nfs/dbraw/zinc/64/80/01/336648001.db2.gz ITRKFMKFDKPJNN-IBGZPJMESA-N 0 1 321.399 4.179 20 0 DIADMN CO[C@H](C)c1nc(CN[C@H](C)CCCC(F)(F)F)cs1 ZINC000359644044 336681515 /nfs/dbraw/zinc/68/15/15/336681515.db2.gz YTEGNFHGVCIFGP-NXEZZACHSA-N 0 1 310.385 4.061 20 0 DIADMN c1sc(CN[C@H]2CCSC2)nc1-c1cc2ccccc2o1 ZINC000359969264 336695894 /nfs/dbraw/zinc/69/58/94/336695894.db2.gz GQWWTOVKMDXWAF-LBPRGKRZSA-N 0 1 316.451 4.151 20 0 DIADMN Fc1cccc2c1OCCC[C@H]2N[C@H]1CCCc2occc21 ZINC000193273250 336696103 /nfs/dbraw/zinc/69/61/03/336696103.db2.gz AFASVSSNHSDCLL-JKSUJKDBSA-N 0 1 301.361 4.300 20 0 DIADMN CCCCOc1ncccc1CN[C@@H]1CCCc2sccc21 ZINC000360486466 336712662 /nfs/dbraw/zinc/71/26/62/336712662.db2.gz XBAJBSASALTLCM-MRXNPFEDSA-N 0 1 316.470 4.489 20 0 DIADMN COC(=O)c1cc(CN[C@@H](C)c2ccc(C3CC3)cc2)oc1C ZINC000418112986 336718580 /nfs/dbraw/zinc/71/85/80/336718580.db2.gz IHRLUNSPDRSAJK-LBPRGKRZSA-N 0 1 313.397 4.103 20 0 DIADMN Cc1cc(N2CCC[C@]3(CCCOC3)C2)c2cc(F)ccc2n1 ZINC000360884569 336725689 /nfs/dbraw/zinc/72/56/89/336725689.db2.gz SHZHQRGCGAGYNM-IBGZPJMESA-N 0 1 314.404 4.079 20 0 DIADMN CC(C)CC[C@@H](NCc1c2c(nn1C)CCCC2)c1ccoc1 ZINC000361005848 336732642 /nfs/dbraw/zinc/73/26/42/336732642.db2.gz XQSHIJHOCPJQLT-QGZVFWFLSA-N 0 1 315.461 4.159 20 0 DIADMN Cc1ccc(C2CCN(Cc3cccc(F)c3F)CC2)cn1 ZINC000361062123 336736188 /nfs/dbraw/zinc/73/61/88/336736188.db2.gz KGYOGAVKMTYSAJ-UHFFFAOYSA-N 0 1 302.368 4.048 20 0 DIADMN CCN(CCCN[C@@H](C)c1csc(C)n1)c1ccccc1 ZINC000361081655 336737618 /nfs/dbraw/zinc/73/76/18/336737618.db2.gz RISAYMXKHXKLFZ-AWEZNQCLSA-N 0 1 303.475 4.019 20 0 DIADMN CCCOc1ccc(CN[C@H]2CC(C)(C)Cc3occc32)cn1 ZINC000361219894 336744803 /nfs/dbraw/zinc/74/48/03/336744803.db2.gz HQXGMLOKUXKOHC-INIZCTEOSA-N 0 1 314.429 4.267 20 0 DIADMN C[C@H](c1cccnc1)N1CCC(Oc2ccccc2Cl)CC1 ZINC000361240765 336746426 /nfs/dbraw/zinc/74/64/26/336746426.db2.gz RIRMRNIOXUBTFX-CQSZACIVSA-N 0 1 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VAEWIOUVZOYVDH-KSSFIOAISA-N 0 1 309.400 4.164 20 0 DIADMN Fc1ccc(CN2CC[C@@H](Sc3cccc(Cl)c3)C2)nc1 ZINC000429123599 338071268 /nfs/dbraw/zinc/07/12/68/338071268.db2.gz VLNCRRAGDTWYIQ-MRXNPFEDSA-N 0 1 322.836 4.241 20 0 DIADMN CC(C)(C)OCCCCNC(C)(C)c1cc(C(F)(F)F)on1 ZINC000429268208 338075423 /nfs/dbraw/zinc/07/54/23/338075423.db2.gz AIIKVLPCDYVAMD-UHFFFAOYSA-N 0 1 322.371 4.113 20 0 DIADMN Cc1ccc(CCNC(C)(C)c2cc(C(F)(F)F)on2)cc1 ZINC000429272889 338075629 /nfs/dbraw/zinc/07/56/29/338075629.db2.gz OSAAHFQKSXAFTR-UHFFFAOYSA-N 0 1 312.335 4.069 20 0 DIADMN CSC[C@H]1CCCN(Cc2nc(-c3ccccc3)cs2)C1 ZINC000429285180 338076302 /nfs/dbraw/zinc/07/63/02/338076302.db2.gz MRIHXBZYSWBXJV-AWEZNQCLSA-N 0 1 318.511 4.385 20 0 DIADMN CCC1(CC)[C@H](NCc2csc(-c3ccoc3)n2)C[C@@H]1OC ZINC000429296704 338077008 /nfs/dbraw/zinc/07/70/08/338077008.db2.gz SCAZGVVLTYIIPJ-CABCVRRESA-N 0 1 320.458 4.086 20 0 DIADMN CCO[C@H]1C[C@@H](NCc2nc3ccc(F)cc3o2)C1(CC)CC ZINC000429340222 338077908 /nfs/dbraw/zinc/07/79/08/338077908.db2.gz UFNGCEREXIMFOS-CVEARBPZSA-N 0 1 320.408 4.040 20 0 DIADMN CCO[C@@H]1C[C@@H](NCc2nc3ccc(F)cc3o2)C1(CC)CC ZINC000429340224 338078008 /nfs/dbraw/zinc/07/80/08/338078008.db2.gz UFNGCEREXIMFOS-HZPDHXFCSA-N 0 1 320.408 4.040 20 0 DIADMN Cc1ccoc1CN(C)Cc1cc(Cl)cc2cccnc21 ZINC000429368946 338078726 /nfs/dbraw/zinc/07/87/26/338078726.db2.gz XIRNPBZJZPQUGW-UHFFFAOYSA-N 0 1 300.789 4.422 20 0 DIADMN CC[C@@H](N[C@H](CO)CC(F)F)c1ccc(Cl)cc1Cl ZINC000429462129 338081949 /nfs/dbraw/zinc/08/19/49/338081949.db2.gz PFDJJJTVJLLUDY-JOYOIKCWSA-N 0 1 312.187 4.050 20 0 DIADMN COc1cccc(-c2nc(CN(C)[C@H]3CC[C@H](C)C3)cs2)c1 ZINC000429561838 338083987 /nfs/dbraw/zinc/08/39/87/338083987.db2.gz SNPWBWVTEGSXBU-BBRMVZONSA-N 0 1 316.470 4.439 20 0 DIADMN C[C@H]1CC[C@H](N(C)Cc2csc(Cc3ccccc3)n2)C1 ZINC000429572659 338084593 /nfs/dbraw/zinc/08/45/93/338084593.db2.gz VTAHFILHUJEBMP-YOEHRIQHSA-N 0 1 300.471 4.354 20 0 DIADMN C[C@H](NCc1cc(C(C)(C)C)on1)C(C)(C)c1ccccc1 ZINC000429696921 338087735 /nfs/dbraw/zinc/08/77/35/338087735.db2.gz HTKUZXAYIGHCKN-AWEZNQCLSA-N 0 1 300.446 4.428 20 0 DIADMN CC[C@H]1CCCCCN1Cc1nc(Cc2ccccc2C)no1 ZINC000429810335 338090367 /nfs/dbraw/zinc/09/03/67/338090367.db2.gz AYVKGFDEKYWIMA-KRWDZBQOSA-N 0 1 313.445 4.123 20 0 DIADMN Cc1cncc(CNCc2cc(Cl)ccc2OCC2CC2)c1 ZINC000430041929 338094284 /nfs/dbraw/zinc/09/42/84/338094284.db2.gz BCCVNDUWEAOKIG-UHFFFAOYSA-N 0 1 316.832 4.122 20 0 DIADMN Cc1ccc2c(c1)nc(CNCc1ccc3c(c1)CCCC3)n2C ZINC000430056041 338094562 /nfs/dbraw/zinc/09/45/62/338094562.db2.gz FCYJGDVZGNKJPI-UHFFFAOYSA-N 0 1 319.452 4.050 20 0 DIADMN CC(C)(C)c1n[nH]c(SCc2cccc3c2OC(C)(C)C3)n1 ZINC000430093936 338096078 /nfs/dbraw/zinc/09/60/78/338096078.db2.gz IYCLKMOETSULOR-UHFFFAOYSA-N 0 1 317.458 4.108 20 0 DIADMN CC(C)(C)c1nc(SCc2cccc3c2OC(C)(C)C3)n[nH]1 ZINC000430093936 338096079 /nfs/dbraw/zinc/09/60/79/338096079.db2.gz IYCLKMOETSULOR-UHFFFAOYSA-N 0 1 317.458 4.108 20 0 DIADMN COc1ccc2nc(SCc3cc(C(C)(C)C)on3)[nH]c2c1 ZINC000430104394 338096801 /nfs/dbraw/zinc/09/68/01/338096801.db2.gz IMUWINFOJOVSNX-UHFFFAOYSA-N 0 1 317.414 4.149 20 0 DIADMN C[C@@H](CCN(C)Cc1nc2ccccc2n1C)c1ccccc1 ZINC000430106454 338096991 /nfs/dbraw/zinc/09/69/91/338096991.db2.gz YNGVNHABNSUIHO-INIZCTEOSA-N 0 1 307.441 4.199 20 0 DIADMN CSC[C@H]1CCCN(Cc2ccc(F)c(C(F)(F)F)c2)C1 ZINC000430192968 338100544 /nfs/dbraw/zinc/10/05/44/338100544.db2.gz QCDKSWGACIEMIN-LBPRGKRZSA-N 0 1 321.383 4.420 20 0 DIADMN CSC[C@H]1CCCN(Cc2cc(F)cc(C(F)(F)F)c2)C1 ZINC000430196737 338100700 /nfs/dbraw/zinc/10/07/00/338100700.db2.gz SDUHOILEVRGYKU-NSHDSACASA-N 0 1 321.383 4.420 20 0 DIADMN CSC[C@@H]1CCCN(Cc2ccc(C(F)(F)F)s2)C1 ZINC000430202538 338101179 /nfs/dbraw/zinc/10/11/79/338101179.db2.gz YHXSQPLQTPOCNK-SNVBAGLBSA-N 0 1 309.422 4.342 20 0 DIADMN Cc1cc([C@@H]2CCCN2C[C@H]2CCCO2)ccc1Br ZINC000430225272 338102202 /nfs/dbraw/zinc/10/22/02/338102202.db2.gz XTENHFXBIAVYRF-ZBFHGGJFSA-N 0 1 324.262 4.073 20 0 DIADMN CCc1cccc(CC)c1NC(=O)[C@H](C)N1CC(C)=C[C@H](C)C1 ZINC000430271939 338103794 /nfs/dbraw/zinc/10/37/94/338103794.db2.gz ZBXLIFOCSULTSD-HOCLYGCPSA-N 0 1 314.473 4.036 20 0 DIADMN CC1=C[C@H](C)CN(Cc2nc3cc(C(F)(F)F)ccc3o2)C1 ZINC000430271686 338103876 /nfs/dbraw/zinc/10/38/76/338103876.db2.gz YLFRKEHFLVARNG-JTQLQIEISA-N 0 1 310.319 4.245 20 0 DIADMN Clc1scc(CN[C@@H]2COc3ccccc3C2)c1Cl ZINC000432228758 338149110 /nfs/dbraw/zinc/14/91/10/338149110.db2.gz LWSMTNHLAMJRRE-NSHDSACASA-N 0 1 314.237 4.148 20 0 DIADMN C[C@H](CNCc1ccc(F)c(Cl)c1Cl)C(F)(F)F ZINC000432257001 338151531 /nfs/dbraw/zinc/15/15/31/338151531.db2.gz IJDBJZMUNVFPIY-ZCFIWIBFSA-N 0 1 304.114 4.421 20 0 DIADMN CC(C)(c1ccc(NCc2n[nH]c(C3CC3)n2)cc1)C(F)(F)F ZINC000432321534 338152951 /nfs/dbraw/zinc/15/29/51/338152951.db2.gz GJPLFCDYTMSANU-UHFFFAOYSA-N 0 1 324.350 4.134 20 0 DIADMN CS[C@H]1CCCCN(Cc2ccc(C(F)(F)F)s2)C1 ZINC000432722791 338164218 /nfs/dbraw/zinc/16/42/18/338164218.db2.gz OVNAXRISSVTTLJ-JTQLQIEISA-N 0 1 309.422 4.484 20 0 DIADMN CN(CCc1ccc(F)cc1)Cc1nc2ccc(F)cc2s1 ZINC000432741338 338165376 /nfs/dbraw/zinc/16/53/76/338165376.db2.gz KYGLCHLYYZASCY-UHFFFAOYSA-N 0 1 318.392 4.249 20 0 DIADMN CN(CCC1CCOCC1)Cc1csc(Cl)c1Cl ZINC000432751188 338166285 /nfs/dbraw/zinc/16/62/85/338166285.db2.gz SQXSWZWFABYAKA-UHFFFAOYSA-N 0 1 308.274 4.303 20 0 DIADMN Cc1cccc([C@H]2CCCN2Cc2n[nH]c(C(C)(C)C)n2)c1C ZINC000432815318 338168773 /nfs/dbraw/zinc/16/87/73/338168773.db2.gz FNOLKVUBNVCBKJ-MRXNPFEDSA-N 0 1 312.461 4.056 20 0 DIADMN Cc1ccc([C@H]2CCCCCN2Cc2n[nH]c(C(C)(C)C)n2)o1 ZINC000432816383 338168868 /nfs/dbraw/zinc/16/88/68/338168868.db2.gz PJLAIAZZRZEHDW-CQSZACIVSA-N 0 1 316.449 4.121 20 0 DIADMN COC(=O)c1cc([C@H](C)N2CCC[C@H]2c2ccc(C)o2)oc1C ZINC000432824690 338169530 /nfs/dbraw/zinc/16/95/30/338169530.db2.gz QNJJHVZCIBPMKT-WFASDCNBSA-N 0 1 317.385 4.174 20 0 DIADMN COC[C@H]1CCCCN(Cc2csc(Cl)c2Cl)C1 ZINC000432914278 338172752 /nfs/dbraw/zinc/17/27/52/338172752.db2.gz ADODJJADDNYCPP-JTQLQIEISA-N 0 1 308.274 4.303 20 0 DIADMN CN(CCc1ccncc1)Cc1ccc(F)c(Cl)c1Cl ZINC000432923567 338173275 /nfs/dbraw/zinc/17/32/75/338173275.db2.gz TTZOAIIQUOQYGN-UHFFFAOYSA-N 0 1 313.203 4.202 20 0 DIADMN CC(C)(C)c1nc(CN2CCC[C@@H]2c2cccc(Cl)c2)n[nH]1 ZINC000432925874 338173459 /nfs/dbraw/zinc/17/34/59/338173459.db2.gz UUHUCADXTSWCIV-CQSZACIVSA-N 0 1 318.852 4.093 20 0 DIADMN COC(=O)c1cc([C@H](C)N2CCC[C@@H]2c2ccsc2)oc1C ZINC000432932505 338173940 /nfs/dbraw/zinc/17/39/40/338173940.db2.gz IFTQIJANGXIOLY-XHDPSFHLSA-N 0 1 319.426 4.334 20 0 DIADMN Cc1ccc([C@@H]2CCCN2Cc2n[nH]c(C(C)(C)C)n2)cc1C ZINC000432933265 338173991 /nfs/dbraw/zinc/17/39/91/338173991.db2.gz MPXFRZPXFMHAPS-INIZCTEOSA-N 0 1 312.461 4.056 20 0 DIADMN Cc1ccc([C@H]2CCCN2Cc2n[nH]c(C(C)(C)C)n2)cc1C ZINC000432933266 338174015 /nfs/dbraw/zinc/17/40/15/338174015.db2.gz MPXFRZPXFMHAPS-MRXNPFEDSA-N 0 1 312.461 4.056 20 0 DIADMN COC(=O)c1cc([C@H](C)N2CCC[C@@H]2c2cccs2)oc1C ZINC000432936593 338174263 /nfs/dbraw/zinc/17/42/63/338174263.db2.gz HAPAYBZAMYAOIX-SMDDNHRTSA-N 0 1 319.426 4.334 20 0 DIADMN CCCN(Cc1n[nH]c(C(C)(C)C)n1)[C@@H]1CCc2ccccc21 ZINC000432939795 338174309 /nfs/dbraw/zinc/17/43/09/338174309.db2.gz PFMVOXRSJZCTQO-MRXNPFEDSA-N 0 1 312.461 4.002 20 0 DIADMN COC(=O)c1cc([C@H](C)N[C@@H](c2ccccc2)C(C)C)oc1C ZINC000432938665 338174450 /nfs/dbraw/zinc/17/44/50/338174450.db2.gz OISNXNBBSSRTSO-SCLBCKFNSA-N 0 1 315.413 4.423 20 0 DIADMN COC(=O)c1cc([C@H](C)N(C)Cc2ccc(Cl)cc2)oc1C ZINC000432940614 338174463 /nfs/dbraw/zinc/17/44/63/338174463.db2.gz VJXQXMMHIVBRKP-NSHDSACASA-N 0 1 321.804 4.221 20 0 DIADMN O[C@@H]1CCN(Cc2nc(C3CCCCC3)cs2)C12CCCC2 ZINC000433031377 338177358 /nfs/dbraw/zinc/17/73/58/338177358.db2.gz IZBITABTLUOYPV-MRXNPFEDSA-N 0 1 320.502 4.070 20 0 DIADMN CCc1c2ccccc2oc1[C@@H](C)NCc1cccn(CC)c1=O ZINC000433053111 338178728 /nfs/dbraw/zinc/17/87/28/338178728.db2.gz OCFADGVSBOFVNL-CQSZACIVSA-N 0 1 324.424 4.028 20 0 DIADMN Cc1cccc(C)c1NC(=O)CN1CCC[C@@H](c2ccccc2)C1 ZINC000433056797 338179065 /nfs/dbraw/zinc/17/90/65/338179065.db2.gz IVGUPFJCEPDGMB-LJQANCHMSA-N 0 1 322.452 4.122 20 0 DIADMN Cc1cccc(NC(=O)CN2CCC[C@H](c3ccccc3)C2)c1C ZINC000433064048 338179662 /nfs/dbraw/zinc/17/96/62/338179662.db2.gz VNPMCKJVHNROKP-IBGZPJMESA-N 0 1 322.452 4.122 20 0 DIADMN c1coc(-c2cc(CN3CCC[C@H](c4ccccc4)C3)no2)c1 ZINC000433065873 338179732 /nfs/dbraw/zinc/17/97/32/338179732.db2.gz GYVKVIHJXSYUAT-INIZCTEOSA-N 0 1 308.381 4.314 20 0 DIADMN C[C@@H](NCc1cc(F)c(Cl)cc1F)c1ccc2c(c1)COC2 ZINC000433101291 338181723 /nfs/dbraw/zinc/18/17/23/338181723.db2.gz OUOIKVHDPUSDQD-SNVBAGLBSA-N 0 1 323.770 4.499 20 0 DIADMN COc1ccc2c(c1)[C@H](NCc1cc(F)c(Cl)cc1F)CC2 ZINC000433104751 338181958 /nfs/dbraw/zinc/18/19/58/338181958.db2.gz OOPJDZZNWSLMHT-QGZVFWFLSA-N 0 1 323.770 4.404 20 0 DIADMN Clc1cccc([C@@H]2CCN(Cc3nc4ccccc4o3)C2)c1 ZINC000433299037 338190133 /nfs/dbraw/zinc/19/01/33/338190133.db2.gz PVGNKFJMTQLBSC-CQSZACIVSA-N 0 1 312.800 4.471 20 0 DIADMN Cc1cccc([C@H](C)CNCc2ncc(C(F)(F)F)s2)c1 ZINC000433307334 338190982 /nfs/dbraw/zinc/19/09/82/338190982.db2.gz UNNVNJSTNSIYLD-LLVKDONJSA-N 0 1 314.376 4.364 20 0 DIADMN C[C@@H](NCc1ccc(-c2cc[nH]n2)o1)c1ccc(Cl)s1 ZINC000433323181 338192323 /nfs/dbraw/zinc/19/23/23/338192323.db2.gz VDPQBSKRTJMXGI-SECBINFHSA-N 0 1 307.806 4.235 20 0 DIADMN Fc1cc(NCc2cnc(-c3ccccc3)[nH]2)ccc1Cl ZINC000433341485 338193470 /nfs/dbraw/zinc/19/34/70/338193470.db2.gz HTKARRUUNGZGRS-UHFFFAOYSA-N 0 1 301.752 4.481 20 0 DIADMN Cc1ccc(C(=O)Nc2cc3cn[nH]c3cc2C)c(F)c1Cl ZINC000433710523 338199964 /nfs/dbraw/zinc/19/99/64/338199964.db2.gz AMUIJTOIGUNTNV-UHFFFAOYSA-N 0 1 317.751 4.225 20 0 DIADMN O=C(c1cccc2c[nH]nc21)N1CC2(CCCC2)c2ccccc21 ZINC000434306666 338214221 /nfs/dbraw/zinc/21/42/21/338214221.db2.gz PUUCQAHDTNSDFZ-UHFFFAOYSA-N 0 1 317.392 4.035 20 0 DIADMN C[C@@H](NCc1ccccc1)c1ccc(F)cc1Br ZINC000152947495 338214364 /nfs/dbraw/zinc/21/43/64/338214364.db2.gz QAVUPJQPDZJVJA-LLVKDONJSA-N 0 1 308.194 4.439 20 0 DIADMN CCC1(CO)CCN(CCc2cccc(Cl)c2Cl)CC1 ZINC000434471951 338216720 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0 1 315.461 4.367 20 0 DIADMN CC(C)[C@H](NC[C@H](C)c1ccc(F)cc1)c1nc(C2CC2)no1 ZINC000276345617 1037717872 /nfs/dbraw/zinc/71/78/72/1037717872.db2.gz ZHYUQWAQGDPNDF-LRDDRELGSA-N 0 1 317.408 4.177 20 0 DIADMN Cc1c(C(=O)Nc2ccc(CCC(C)C)cc2)ccc2cncn21 ZINC001125512113 1037718139 /nfs/dbraw/zinc/71/81/39/1037718139.db2.gz XUHKOYUDIDMHDA-UHFFFAOYSA-N 0 1 321.424 4.484 20 0 DIADMN CC(C)[C@H](NC[C@@H](C)c1ccc(F)cc1)c1nc(C2CC2)no1 ZINC000276345623 1037718430 /nfs/dbraw/zinc/71/84/30/1037718430.db2.gz ZHYUQWAQGDPNDF-WBMJQRKESA-N 0 1 317.408 4.177 20 0 DIADMN CCc1ccc([C@@H]2CCC[N@H+]2Cc2cnn(CC(C)C)c2)o1 ZINC000341193588 1037723729 /nfs/dbraw/zinc/72/37/29/1037723729.db2.gz SZRRVKQWPWJWAT-KRWDZBQOSA-N 0 1 301.434 4.032 20 0 DIADMN CCc1ccc([C@@H]2CCCN2Cc2cnn(CC(C)C)c2)o1 ZINC000341193588 1037723748 /nfs/dbraw/zinc/72/37/48/1037723748.db2.gz SZRRVKQWPWJWAT-KRWDZBQOSA-N 0 1 301.434 4.032 20 0 DIADMN CC(C)Cn1cc(C[N@@H+](C2CC2)[C@@H]2CCc3ccccc32)cn1 ZINC000341195098 1037728908 /nfs/dbraw/zinc/72/89/08/1037728908.db2.gz VDQALTMUEHDVHV-HXUWFJFHSA-N 0 1 309.457 4.191 20 0 DIADMN CCSC[C@@H](C)N(C)Cc1ccccc1Br ZINC000707100869 1037773221 /nfs/dbraw/zinc/77/32/21/1037773221.db2.gz MGRIIWLLUDNGOC-LLVKDONJSA-N 0 1 302.281 4.023 20 0 DIADMN Cc1ccnc([C@@H]2CCN([C@@H](C)c3cc(F)ccc3F)C2)c1 ZINC000581615498 1037783002 /nfs/dbraw/zinc/78/30/02/1037783002.db2.gz IZFYTNBANFCAMM-UONOGXRCSA-N 0 1 302.368 4.219 20 0 DIADMN COc1cc(CN2CC(CC(F)(F)F)C2)cc2ccccc21 ZINC000656688077 1037792176 /nfs/dbraw/zinc/79/21/76/1037792176.db2.gz FPDXOWPYEQFWBX-UHFFFAOYSA-N 0 1 309.331 4.233 20 0 DIADMN Cc1nc2ccc(NC(=O)c3ccc(SC4CC4)cc3)cc2[nH]1 ZINC000341251618 1037806920 /nfs/dbraw/zinc/80/69/20/1037806920.db2.gz VJZCZNIMODKYDP-UHFFFAOYSA-N 0 1 323.421 4.378 20 0 DIADMN COCC[C@H](NCc1ccco1)c1ccc(Cl)c(Cl)c1 ZINC000341261169 1037818067 /nfs/dbraw/zinc/81/80/67/1037818067.db2.gz AWQPTGJTAWKKIX-HNNXBMFYSA-N 0 1 314.212 4.454 20 0 DIADMN Cc1ccc2[nH]c3c(c2c1)CN(CCCc1ccc(C)nc1)CC3 ZINC000684357448 1037826691 /nfs/dbraw/zinc/82/66/91/1037826691.db2.gz KZHJACLAROZVLS-UHFFFAOYSA-N 0 1 319.452 4.171 20 0 DIADMN Cc1ncc([C@H](C)N[C@H](C)c2ccc(OC(F)F)cc2)s1 ZINC000090401217 1037834692 /nfs/dbraw/zinc/83/46/92/1037834692.db2.gz BCCDJKPXBNIVIU-ZJUUUORDSA-N 0 1 312.385 4.465 20 0 DIADMN O=C([O-])c1ccc(Cl)c(C[N@H+]2CC[C@H](C3CCCCC3)C2)c1 ZINC000656761358 1037841468 /nfs/dbraw/zinc/84/14/68/1037841468.db2.gz PHNRNKMJENPWAD-HNNXBMFYSA-N 0 1 321.848 4.440 20 0 DIADMN Cc1ccccc1[C@H](C(=O)[O-])[N@H+]1CC[C@H](C2CCCCC2)C1 ZINC000656761658 1037841917 /nfs/dbraw/zinc/84/19/17/1037841917.db2.gz TWGLLJAPVAIGNQ-FUHWJXTLSA-N 0 1 301.430 4.023 20 0 DIADMN O=C([O-])[C@@H]1CC[N@@H+](CCC2CCCCCC2)[C@@H]2CCCC[C@@H]12 ZINC000656763649 1037843725 /nfs/dbraw/zinc/84/37/25/1037843725.db2.gz CAIGHQMGDQLXMT-RCCFBDPRSA-N 0 1 307.478 4.312 20 0 DIADMN O=C([O-])[C@@H]1CC[N@@H+](Cc2ccc3ccccc3c2)[C@H]2CCCC[C@H]12 ZINC000656763183 1037844818 /nfs/dbraw/zinc/84/48/18/1037844818.db2.gz FBCRDCQXJVDXRG-AQNXPRMDSA-N 0 1 323.436 4.305 20 0 DIADMN Cc1sc(C(=O)[O-])cc1C[N@H+]1CCC(C)(C)CC(C)(C)C1 ZINC000656763665 1037845124 /nfs/dbraw/zinc/84/51/24/1037845124.db2.gz PYVVWHSNZGZLLI-UHFFFAOYSA-N 0 1 309.475 4.403 20 0 DIADMN Cc1nc2ccc(NC(=O)C[C@@H](C)c3ccccc3C)cc2[nH]1 ZINC000341282198 1037845958 /nfs/dbraw/zinc/84/59/58/1037845958.db2.gz PETSHERBKCYCNE-CYBMUJFWSA-N 0 1 307.397 4.312 20 0 DIADMN CCC1(CC)CCC[N@@H+](Cc2c(Cl)cccc2C(=O)[O-])C1 ZINC000656763590 1037846159 /nfs/dbraw/zinc/84/61/59/1037846159.db2.gz PBZHRUXUDPZQSX-UHFFFAOYSA-N 0 1 309.837 4.440 20 0 DIADMN O=C([O-])[C@@H]1CC[N@@H+](Cc2cccc3ccccc32)[C@@H]2CCCC[C@H]12 ZINC000656762680 1037847639 /nfs/dbraw/zinc/84/76/39/1037847639.db2.gz BSDXGCFGOYXHJC-VAMGGRTRSA-N 0 1 323.436 4.305 20 0 DIADMN CCC1(CC)CCC[N@H+]([C@@H](C(=O)[O-])c2cccc(Cl)c2)C1 ZINC000656764561 1037848299 /nfs/dbraw/zinc/84/82/99/1037848299.db2.gz ZBSSPAVJCFBUAT-OAHLLOKOSA-N 0 1 309.837 4.368 20 0 DIADMN CC1(C)CC[N@@H+](Cc2ccc(C(=O)[O-])cc2F)CC(C)(C)C1 ZINC000656764269 1037848490 /nfs/dbraw/zinc/84/84/90/1037848490.db2.gz FVPNLFKIPGHCMG-UHFFFAOYSA-N 0 1 307.409 4.172 20 0 DIADMN C[N@@H+](Cc1cccc(C(=O)[O-])c1)C1CC(C)(C)CC(C)(C)C1 ZINC000656760828 1037849162 /nfs/dbraw/zinc/84/91/62/1037849162.db2.gz IHKJBQMYASQAIH-UHFFFAOYSA-N 0 1 303.446 4.422 20 0 DIADMN O=C([O-])[C@@H]1CC[N@@H+](Cc2ccc(C(F)F)cc2)[C@@H]2CCCC[C@@H]12 ZINC000656763712 1037851102 /nfs/dbraw/zinc/85/11/02/1037851102.db2.gz CNRXNRMUMXJSQJ-ARFHVFGLSA-N 0 1 323.383 4.090 20 0 DIADMN Cc1ccc(C[N@H+]2CC[C@H](C(=O)[O-])[C@@H]3CCCC[C@H]32)c(Cl)c1 ZINC000656765385 1037851350 /nfs/dbraw/zinc/85/13/50/1037851350.db2.gz KRMFUHMFWZMMFG-YQQAZPJKSA-N 0 1 321.848 4.114 20 0 DIADMN Cc1ccnc(NCc2ncc(Br)s2)c1C1CC1 ZINC000656779847 1037859713 /nfs/dbraw/zinc/85/97/13/1037859713.db2.gz VUTXLSGYYNQPFV-UHFFFAOYSA-N 0 1 324.247 4.099 20 0 DIADMN CCn1nccc1CNc1cc(O[C@@H](C)c2ccccc2)ccn1 ZINC000656781115 1037861486 /nfs/dbraw/zinc/86/14/86/1037861486.db2.gz ZWNMAISFERFJPK-HNNXBMFYSA-N 0 1 322.412 4.050 20 0 DIADMN Cc1noc(C)c1CNc1cc(O[C@@H](C)c2ccccc2)ccn1 ZINC000656779639 1037865243 /nfs/dbraw/zinc/86/52/43/1037865243.db2.gz DANMWKGMXPNFQK-AWEZNQCLSA-N 0 1 323.396 4.439 20 0 DIADMN Cc1n[nH]c(C)c1CNc1cc(O[C@@H](C)c2ccccc2)ccn1 ZINC000656779629 1037865460 /nfs/dbraw/zinc/86/54/60/1037865460.db2.gz CVVAIAWTTRWDCS-HNNXBMFYSA-N 0 1 322.412 4.174 20 0 DIADMN Cc1ccnc(NCc2cncc(Br)c2)c1C1CC1 ZINC000656779829 1037868230 /nfs/dbraw/zinc/86/82/30/1037868230.db2.gz VCHVRLXJPUORGB-UHFFFAOYSA-N 0 1 318.218 4.037 20 0 DIADMN Cc1oc(-c2ccccc2)nc1CN1CCCC(F)(F)CC1 ZINC000625765728 1037883100 /nfs/dbraw/zinc/88/31/00/1037883100.db2.gz KLEBKOXUTISBBE-UHFFFAOYSA-N 0 1 306.356 4.271 20 0 DIADMN Clc1ccc(Cl)c(CN2CCC3(CCCO3)CC2)c1 ZINC001204569134 1037905111 /nfs/dbraw/zinc/90/51/11/1037905111.db2.gz ZJPGVLJGNFQUIY-UHFFFAOYSA-N 0 1 300.229 4.138 20 0 DIADMN COc1cc(C)c([C@@H](C)N[C@H](C)c2cnc(C)s2)cc1OC ZINC000090402791 1037908476 /nfs/dbraw/zinc/90/84/76/1037908476.db2.gz BGPUUSBRIHDKHO-VXGBXAGGSA-N 0 1 320.458 4.189 20 0 DIADMN Cc1ncc([C@H](C)NCc2ccc(F)cc2C(F)(F)F)s1 ZINC000090402812 1037909708 /nfs/dbraw/zinc/90/97/08/1037909708.db2.gz YNYLSIZHXSFOKN-QMMMGPOBSA-N 0 1 318.339 4.460 20 0 DIADMN C[C@H]1CCC[N@@H+](Cc2cc(F)ccc2Br)[C@H]1C ZINC001167478560 1037910298 /nfs/dbraw/zinc/91/02/98/1037910298.db2.gz SPCXFJUFHXXWRU-QWRGUYRKSA-N 0 1 300.215 4.209 20 0 DIADMN C[C@H]1CCCN(Cc2cc(F)ccc2Br)[C@H]1C ZINC001167478560 1037910312 /nfs/dbraw/zinc/91/03/12/1037910312.db2.gz SPCXFJUFHXXWRU-QWRGUYRKSA-N 0 1 300.215 4.209 20 0 DIADMN Clc1nc2ccccc2cc1CNC1([C@H]2CCCCO2)CC1 ZINC000933377522 1037929485 /nfs/dbraw/zinc/92/94/85/1037929485.db2.gz KITMAMNQCGYFRD-MRXNPFEDSA-N 0 1 316.832 4.080 20 0 DIADMN Cc1ncc([C@@H](C)NCc2cc(Br)cs2)s1 ZINC000090403276 1037934489 /nfs/dbraw/zinc/93/44/89/1037934489.db2.gz MZBHRJPETSMSEL-SSDOTTSWSA-N 0 1 317.277 4.126 20 0 DIADMN Brc1csc(CN2CCC3(CCC3)CC2)c1 ZINC000308739796 1037953146 /nfs/dbraw/zinc/95/31/46/1037953146.db2.gz WCIQRCWWKRXIKV-UHFFFAOYSA-N 0 1 300.265 4.277 20 0 DIADMN Cc1ccc2nc([C@H]3CCCN3C(=O)C3=CCCCCC3)[nH]c2c1 ZINC000130177566 1037981637 /nfs/dbraw/zinc/98/16/37/1037981637.db2.gz BEDNNWVTIBRNMH-GOSISDBHSA-N 0 1 323.440 4.425 20 0 DIADMN COC1CCC(CN(Cc2ccco2)Cc2ccco2)CC1 ZINC000891499874 1037997134 /nfs/dbraw/zinc/99/71/34/1037997134.db2.gz ZIBFWLSEQXWLDY-UHFFFAOYSA-N 0 1 303.402 4.080 20 0 DIADMN Cc1ncc([C@@H](C)NCc2cccc(Br)c2)s1 ZINC000090406355 1038004857 /nfs/dbraw/zinc/00/48/57/1038004857.db2.gz FAWJXELWQZQYRK-SECBINFHSA-N 0 1 311.248 4.065 20 0 DIADMN Cc1cc(Br)cnc1CN1CC[C@H]2CCCC[C@@H]2C1 ZINC001232051340 1038042149 /nfs/dbraw/zinc/04/21/49/1038042149.db2.gz BDWNIWJLALQQEK-ZIAGYGMSSA-N 0 1 323.278 4.165 20 0 DIADMN COCC[C@H](N[C@@H](C)c1cc(F)ccc1OC)c1ccccc1 ZINC000341432152 1038019753 /nfs/dbraw/zinc/01/97/53/1038019753.db2.gz LKUKGPJBEYQPRP-KSSFIOAISA-N 0 1 317.404 4.263 20 0 DIADMN Cc1scc(CN(C)[C@@H](C)c2ccc([S@](C)=O)cc2)c1C ZINC000602487574 1038020495 /nfs/dbraw/zinc/02/04/95/1038020495.db2.gz WPLPWHGEASRPFN-ZSEKCTLFSA-N 0 1 321.511 4.295 20 0 DIADMN Cc1nn(C(C)(C)C)cc1[C@H](C)N[C@H](C)c1cc(O)cc(F)c1 ZINC000926189499 1038028198 /nfs/dbraw/zinc/02/81/98/1038028198.db2.gz LYEPZWJROOQEQL-NEPJUHHUSA-N 0 1 319.424 4.203 20 0 DIADMN CC[C@H]1c2ccsc2CCN1C[C@H](O)c1ccc(F)cc1F ZINC000051261883 1038041999 /nfs/dbraw/zinc/04/19/99/1038041999.db2.gz KJCZQRUKVWUKRR-HOTGVXAUSA-N 0 1 323.408 4.069 20 0 DIADMN COC(=O)c1csc(CN[C@H](C)c2ccccc2SC)c1 ZINC000602650673 1038056847 /nfs/dbraw/zinc/05/68/47/1038056847.db2.gz FXTRUSLVHRRJGT-LLVKDONJSA-N 0 1 321.467 4.107 20 0 DIADMN COC(=O)c1csc(CN[C@@H](C)c2ccc(SC)cc2)c1 ZINC000602649533 1038057035 /nfs/dbraw/zinc/05/70/35/1038057035.db2.gz VKKBRMGTPXSYOX-NSHDSACASA-N 0 1 321.467 4.107 20 0 DIADMN C[C@H]1COc2ccccc2CN1Cc1ccc2ncccc2c1 ZINC000341512250 1038065312 /nfs/dbraw/zinc/06/53/12/1038065312.db2.gz RZGZRLYVVALSTA-HNNXBMFYSA-N 0 1 304.393 4.018 20 0 DIADMN CC[C@@H]1CCCC[C@@H]1C(=O)NCc1nc2ccc(Cl)cc2[nH]1 ZINC000684439755 1038069024 /nfs/dbraw/zinc/06/90/24/1038069024.db2.gz FXBDLVSJTKLVTE-YPMHNXCESA-N 0 1 319.836 4.049 20 0 DIADMN C[C@H]1CCCN1Cc1coc(-c2ccccc2C(F)(F)F)n1 ZINC001167487498 1038081708 /nfs/dbraw/zinc/08/17/08/1038081708.db2.gz OAHDSCFDOBPBNZ-NSHDSACASA-N 0 1 310.319 4.345 20 0 DIADMN FC(F)(F)C1CCC(CNc2cnccc2-n2cccn2)CC1 ZINC000341539597 1038094392 /nfs/dbraw/zinc/09/43/92/1038094392.db2.gz TVCFXGUYYIFOHG-UHFFFAOYSA-N 0 1 324.350 4.048 20 0 DIADMN Fc1ccc(Br)c(CN2CCC3(CCCC3)C2)c1 ZINC001167488424 1038099145 /nfs/dbraw/zinc/09/91/45/1038099145.db2.gz ZXVOAQMHCJQVAH-UHFFFAOYSA-N 0 1 312.226 4.354 20 0 DIADMN OCCN(CCc1ccccc1)Cc1ccc(Cl)cc1Cl ZINC000602876126 1038103755 /nfs/dbraw/zinc/10/37/55/1038103755.db2.gz GISCRWDUPYHLTA-UHFFFAOYSA-N 0 1 324.251 4.030 20 0 DIADMN COc1ccc2c(c1)[C@H](NCc1ccc(Cl)c(F)c1)CCO2 ZINC000341546729 1038111855 /nfs/dbraw/zinc/11/18/55/1038111855.db2.gz REYIZVJFKPBGPX-MRXNPFEDSA-N 0 1 321.779 4.101 20 0 DIADMN C[C@@H](C(=O)Nc1cccc(CSC2CCCCC2)c1)N(C)C ZINC000610560460 1038130981 /nfs/dbraw/zinc/13/09/81/1038130981.db2.gz IOWMENAYKURZME-AWEZNQCLSA-N 0 1 320.502 4.141 20 0 DIADMN Fc1cccc(Cl)c1[C@@H]1C[C@H]1NCc1nc2c(s1)CCC2 ZINC000657044061 1038145175 /nfs/dbraw/zinc/14/51/75/1038145175.db2.gz LIVGUBHLWNVMLU-NOZJJQNGSA-N 0 1 322.836 4.070 20 0 DIADMN Cc1ccccc1-n1cc(CN[C@H]2CCCc3sccc32)cn1 ZINC000647202915 1038148032 /nfs/dbraw/zinc/14/80/32/1038148032.db2.gz YUOOXFYISVXUQG-KRWDZBQOSA-N 0 1 323.465 4.409 20 0 DIADMN Cc1cc(CN[C@@H](CCc2ccccc2)c2ccccc2)nn1C ZINC000341586763 1038152507 /nfs/dbraw/zinc/15/25/07/1038152507.db2.gz CDJLJEDZNPITPK-NRFANRHFSA-N 0 1 319.452 4.192 20 0 DIADMN CCCOc1ccc(CN[C@@H](C)c2cnc(C)nc2C)c(C)c1 ZINC000276728316 1038162391 /nfs/dbraw/zinc/16/23/91/1038162391.db2.gz YFDDQEHCDFXDTC-AWEZNQCLSA-N 0 1 313.445 4.041 20 0 DIADMN COc1cc(CN2CCCC[C@H]2c2cccc(C)c2C)sn1 ZINC001167490709 1038163685 /nfs/dbraw/zinc/16/36/85/1038163685.db2.gz GZEDPJOALHDXFN-KRWDZBQOSA-N 0 1 316.470 4.496 20 0 DIADMN COc1cc(CN2CCCC[C@@H]2c2cccc(C)c2C)sn1 ZINC001167490710 1038164007 /nfs/dbraw/zinc/16/40/07/1038164007.db2.gz GZEDPJOALHDXFN-QGZVFWFLSA-N 0 1 316.470 4.496 20 0 DIADMN c1ccc(CN(Cc2nc3cccnc3s2)CC2CCC2)cc1 ZINC000341600921 1038169117 /nfs/dbraw/zinc/16/91/17/1038169117.db2.gz KARJOZBYYOANHY-UHFFFAOYSA-N 0 1 323.465 4.494 20 0 DIADMN CC(C)COc1cccc(CN[C@H]2c3ccccc3O[C@H]2C)c1 ZINC000581966516 1038180356 /nfs/dbraw/zinc/18/03/56/1038180356.db2.gz FPLYQNSJNARXNK-MGPUTAFESA-N 0 1 311.425 4.333 20 0 DIADMN Cc1nc2ccc(Nc3ccncc3Oc3ccccc3)cc2o1 ZINC001213063105 1038186753 /nfs/dbraw/zinc/18/67/53/1038186753.db2.gz UGCSWSBHSADJOM-UHFFFAOYSA-N 0 1 317.348 4.489 20 0 DIADMN CC(C)(C)[C@@H]1C[C@H](NCc2c(F)cc(F)c(F)c2F)CS1 ZINC000430771927 1038193087 /nfs/dbraw/zinc/19/30/87/1038193087.db2.gz HSFHRNDWDGGTCM-UFBFGSQYSA-N 0 1 321.383 4.253 20 0 DIADMN CCOc1ccc([C@H](C)NCc2cccc(OC)c2F)cc1 ZINC000669679312 1038194874 /nfs/dbraw/zinc/19/48/74/1038194874.db2.gz MUGZCXVMFUKUNV-ZDUSSCGKSA-N 0 1 303.377 4.084 20 0 DIADMN Fc1cccc(C[N@H+]2CC[C@H](COc3ccccc3)C2)c1Cl ZINC001168414090 1038195734 /nfs/dbraw/zinc/19/57/34/1038195734.db2.gz NXBKEYKGARVHSL-AWEZNQCLSA-N 0 1 319.807 4.380 20 0 DIADMN Fc1cccc(CN2CC[C@H](COc3ccccc3)C2)c1Cl ZINC001168414090 1038195742 /nfs/dbraw/zinc/19/57/42/1038195742.db2.gz NXBKEYKGARVHSL-AWEZNQCLSA-N 0 1 319.807 4.380 20 0 DIADMN CC(C)(C)c1ccc(NC(=O)c2cn[nH]c2-c2ccncc2)cc1 ZINC000341634460 1038196103 /nfs/dbraw/zinc/19/61/03/1038196103.db2.gz DTOWAACUYNHDQG-UHFFFAOYSA-N 0 1 320.396 4.022 20 0 DIADMN COc1cccc(CN[C@@H](c2ccc(F)cc2)C(C)C)c1F ZINC000669679017 1038196557 /nfs/dbraw/zinc/19/65/57/1038196557.db2.gz FGRAOSDFIHCVDF-GOSISDBHSA-N 0 1 305.368 4.460 20 0 DIADMN COc1cccc(CN[C@H](c2ccc(F)cc2)C(C)C)c1F ZINC000669679018 1038197594 /nfs/dbraw/zinc/19/75/94/1038197594.db2.gz FGRAOSDFIHCVDF-SFHVURJKSA-N 0 1 305.368 4.460 20 0 DIADMN C[C@H](N[C@@H](CO)c1ccc(Cl)cc1)c1ccc(F)c(F)c1 ZINC000089210828 1038210271 /nfs/dbraw/zinc/21/02/71/1038210271.db2.gz PZZKRCAUFZURQO-QFYYESIMSA-N 0 1 311.759 4.002 20 0 DIADMN Fc1ccccc1CSCCN[C@@H]1CCCc2scnc21 ZINC000599022225 1038213571 /nfs/dbraw/zinc/21/35/71/1038213571.db2.gz OXIWXPDXHLPKFZ-CQSZACIVSA-N 0 1 322.474 4.183 20 0 DIADMN Cc1csc([C@H](C)NCCSCc2ccccc2F)n1 ZINC000599020728 1038213999 /nfs/dbraw/zinc/21/39/99/1038213999.db2.gz BFBZISHCHALUMH-LBPRGKRZSA-N 0 1 310.463 4.175 20 0 DIADMN COc1cccc(CN[C@@H]2c3cccc(F)c3CC[C@@H]2C)c1F ZINC000669683044 1038217305 /nfs/dbraw/zinc/21/73/05/1038217305.db2.gz GCLIPCMVTZKJNN-BUXKBTBVSA-N 0 1 317.379 4.387 20 0 DIADMN Cc1ccc2[nH]c(CN[C@H]3CCCc4cc(F)ccc43)nc2c1 ZINC000341695696 1038232373 /nfs/dbraw/zinc/23/23/73/1038232373.db2.gz CGMCBTAETUMLSU-INIZCTEOSA-N 0 1 309.388 4.178 20 0 DIADMN Cc1ccc2nc(CN[C@H]3CCCc4cc(F)ccc43)[nH]c2c1 ZINC000341695696 1038232386 /nfs/dbraw/zinc/23/23/86/1038232386.db2.gz CGMCBTAETUMLSU-INIZCTEOSA-N 0 1 309.388 4.178 20 0 DIADMN COc1cccc2c1OCC[C@H]2NCc1cc2ccccc2o1 ZINC000603518915 1038237172 /nfs/dbraw/zinc/23/71/72/1038237172.db2.gz QDTIBQOYASSZJG-MRXNPFEDSA-N 0 1 309.365 4.055 20 0 DIADMN CCOCc1ccccc1CNc1cc[nH+]c2c([O-])cccc12 ZINC000684569328 1038288762 /nfs/dbraw/zinc/28/87/62/1038288762.db2.gz UGUFTJJZWTVCGN-UHFFFAOYSA-N 0 1 308.381 4.089 20 0 DIADMN CCn1ccnc1CN1CCC(c2cccc3ccccc32)CC1 ZINC000341836078 1038289193 /nfs/dbraw/zinc/28/91/93/1038289193.db2.gz LHHNXCSPCQEOCT-UHFFFAOYSA-N 0 1 319.452 4.436 20 0 DIADMN Cc1ncc(CNC2(c3cccc(C(F)(F)F)c3)CC2)s1 ZINC000341857206 1038297017 /nfs/dbraw/zinc/29/70/17/1038297017.db2.gz FMCHXZSUWXZVKX-UHFFFAOYSA-N 0 1 312.360 4.249 20 0 DIADMN Cc1ccccc1C1(NCc2c[nH]c(-c3ccccc3)n2)CC1 ZINC000647224446 1038306133 /nfs/dbraw/zinc/30/61/33/1038306133.db2.gz IGFFTRZAEDXWEA-UHFFFAOYSA-N 0 1 303.409 4.164 20 0 DIADMN C[C@@H]1c2ccccc2CCN1Cc1ccc(C(F)(F)F)cn1 ZINC000341876295 1038306547 /nfs/dbraw/zinc/30/65/47/1038306547.db2.gz NAWRTLSYZISJQU-GFCCVEGCSA-N 0 1 306.331 4.220 20 0 DIADMN CC[C@H]1c2ccccc2CCN1C(=O)c1cc(C)cc2c[nH]nc21 ZINC000603922986 1038321654 /nfs/dbraw/zinc/32/16/54/1038321654.db2.gz QNIBUJCTAATDKA-SFHVURJKSA-N 0 1 319.408 4.021 20 0 DIADMN CC[C@H](N[C@H](C)c1ccc(C(=O)OC)o1)c1cc(C)ccc1C ZINC000599639828 1038328935 /nfs/dbraw/zinc/32/89/35/1038328935.db2.gz CYBHJNFYFLEXHD-ZBFHGGJFSA-N 0 1 315.413 4.485 20 0 DIADMN CC[C@@H]1c2ccccc2CCN1Cc1cn2cc(C)ccc2n1 ZINC000603967808 1038331308 /nfs/dbraw/zinc/33/13/08/1038331308.db2.gz FPPLFQQEHYPXNU-LJQANCHMSA-N 0 1 305.425 4.152 20 0 DIADMN Cc1[nH]nc2cc(NC(=O)C(C)(C)Cc3ccccc3)ccc12 ZINC000535818631 1038351500 /nfs/dbraw/zinc/35/15/00/1038351500.db2.gz ZGTVQVZIAYKWPL-UHFFFAOYSA-N 0 1 307.397 4.079 20 0 DIADMN C[C@@H](c1ccc2ccccc2c1)N(Cc1cnccn1)C1CC1 ZINC000563091242 1038351543 /nfs/dbraw/zinc/35/15/43/1038351543.db2.gz LNWLUNSEXBNUOD-HNNXBMFYSA-N 0 1 303.409 4.355 20 0 DIADMN COC(=O)c1cc(CN(C)[C@@H](C)c2ccc(C)cc2C)oc1C ZINC000604081338 1038353361 /nfs/dbraw/zinc/35/33/61/1038353361.db2.gz NBZKSPICNLXUTC-AWEZNQCLSA-N 0 1 315.413 4.184 20 0 DIADMN FC(F)(F)CCN(CCc1ccccc1)Cc1cccnc1 ZINC000277027821 1038355264 /nfs/dbraw/zinc/35/52/64/1038355264.db2.gz DZXUDHFIQNIRFI-UHFFFAOYSA-N 0 1 308.347 4.079 20 0 DIADMN CC[C@H](C)c1nc([C@H](C)N[C@@H](C)c2ccc(SC)cc2)n[nH]1 ZINC000277055758 1038358223 /nfs/dbraw/zinc/35/82/23/1038358223.db2.gz CVYNQKDYEWZXMM-AVGNSLFASA-N 0 1 318.490 4.452 20 0 DIADMN CC[C@H](C)c1nc([C@H](C)N[C@H](C)c2ccc(SC)cc2)n[nH]1 ZINC000277055793 1038359690 /nfs/dbraw/zinc/35/96/90/1038359690.db2.gz CVYNQKDYEWZXMM-XQQFMLRXSA-N 0 1 318.490 4.452 20 0 DIADMN CC[C@H](C)c1nc([C@@H](C)N[C@@H](C)c2cc(C)ccc2OC)n[nH]1 ZINC000277075735 1038364737 /nfs/dbraw/zinc/36/47/37/1038364737.db2.gz FIMDODTXRUGDOY-MELADBBJSA-N 0 1 316.449 4.047 20 0 DIADMN CC[C@H](C)c1nc([C@H](C)N[C@@H](C)c2ccc(F)cc2F)n[nH]1 ZINC000277108207 1038370473 /nfs/dbraw/zinc/37/04/73/1038370473.db2.gz HSMARTJNZSAGNY-DCAQKATOSA-N 0 1 308.376 4.008 20 0 DIADMN Cc1ccc([C@H](C)N(C)Cc2cc(F)cc3c2OCOC3)cc1 ZINC000048565958 1038376529 /nfs/dbraw/zinc/37/65/29/1038376529.db2.gz LNAGIWVIVQXEAU-AWEZNQCLSA-N 0 1 315.388 4.194 20 0 DIADMN Cc1ccc([C@@H](C)N(C)Cc2cc(F)cc3c2OCOC3)cc1 ZINC000048565956 1038376638 /nfs/dbraw/zinc/37/66/38/1038376638.db2.gz LNAGIWVIVQXEAU-CQSZACIVSA-N 0 1 315.388 4.194 20 0 DIADMN CC[C@H](C[C@](C)(O)CC)N[C@@H](C)c1nc(C(F)(F)F)cs1 ZINC000926314727 1038392571 /nfs/dbraw/zinc/39/25/71/1038392571.db2.gz HUZQSEPBJUKERX-OPQQBVKSSA-N 0 1 324.412 4.142 20 0 DIADMN C[C@H]1CCc2c(C(=O)Nc3cccc(Cl)c3O)csc2C1 ZINC000604266666 1038393317 /nfs/dbraw/zinc/39/33/17/1038393317.db2.gz ZWGQGVXAMHAMQU-VIFPVBQESA-N 0 1 321.829 4.484 20 0 DIADMN Cc1ccc(SCC(=O)Nc2cccc(Cl)c2O)cc1 ZINC000604266816 1038393358 /nfs/dbraw/zinc/39/33/58/1038393358.db2.gz XXWYMHGNYFCKBV-UHFFFAOYSA-N 0 1 307.802 4.085 20 0 DIADMN COc1cc(Cl)ccc1CN1CCC(c2ccccn2)CC1 ZINC000684619767 1038395868 /nfs/dbraw/zinc/39/58/68/1038395868.db2.gz OGTKAUXUQPJZJZ-UHFFFAOYSA-N 0 1 316.832 4.123 20 0 DIADMN Cc1nccc(CN[C@H](c2ccc(CC(C)C)cc2)C(C)C)n1 ZINC000684618670 1038398202 /nfs/dbraw/zinc/39/82/02/1038398202.db2.gz SICZBAYHUQUHPY-FQEVSTJZSA-N 0 1 311.473 4.470 20 0 DIADMN C[C@@H](c1nnc(-c2cccs2)o1)N1CCCC2(CC2)CC1 ZINC000626113517 1038405612 /nfs/dbraw/zinc/40/56/12/1038405612.db2.gz VZXFEPGQXOUVQR-LBPRGKRZSA-N 0 1 303.431 4.125 20 0 DIADMN CN(C)Cc1cccc(Nc2cc(Cl)ncc2Cl)c1F ZINC001216228161 1038407539 /nfs/dbraw/zinc/40/75/39/1038407539.db2.gz UBKJMYFZJOWGNQ-UHFFFAOYSA-N 0 1 314.191 4.333 20 0 DIADMN CSC1(CN[C@H](c2ccc(Cl)cc2)c2ccccn2)CC1 ZINC000926317715 1038408911 /nfs/dbraw/zinc/40/89/11/1038408911.db2.gz UHAXHCZRNBRKIL-MRXNPFEDSA-N 0 1 318.873 4.310 20 0 DIADMN COC(=O)c1cc(CN(C)Cc2ccc(C(C)C)cc2)c(C)o1 ZINC000604512575 1038424513 /nfs/dbraw/zinc/42/45/13/1038424513.db2.gz CADUVFPESPJOPQ-UHFFFAOYSA-N 0 1 315.413 4.130 20 0 DIADMN Cc1nc(-c2cc([C@H](C)NCc3cccnc3)cs2)cs1 ZINC000151088568 1038429823 /nfs/dbraw/zinc/42/98/23/1038429823.db2.gz FCMGDKPAHPTORG-NSHDSACASA-N 0 1 315.467 4.426 20 0 DIADMN Nc1ncccc1C[N@H+]1CC2(CCCCC2)[C@@H]1c1ccccc1 ZINC000657199684 1038432697 /nfs/dbraw/zinc/43/26/97/1038432697.db2.gz YFJCEXLAUNEHPH-SFHVURJKSA-N 0 1 307.441 4.171 20 0 DIADMN Nc1ncccc1CN1CC2(CCCCC2)[C@@H]1c1ccccc1 ZINC000657199684 1038432704 /nfs/dbraw/zinc/43/27/04/1038432704.db2.gz YFJCEXLAUNEHPH-SFHVURJKSA-N 0 1 307.441 4.171 20 0 DIADMN Nc1ncccc1C[N@H+]1CC2(CCCCC2)[C@H]1c1ccccc1 ZINC000657199683 1038433292 /nfs/dbraw/zinc/43/32/92/1038433292.db2.gz YFJCEXLAUNEHPH-GOSISDBHSA-N 0 1 307.441 4.171 20 0 DIADMN Nc1ncccc1CN1CC2(CCCCC2)[C@H]1c1ccccc1 ZINC000657199683 1038433298 /nfs/dbraw/zinc/43/32/98/1038433298.db2.gz YFJCEXLAUNEHPH-GOSISDBHSA-N 0 1 307.441 4.171 20 0 DIADMN Cc1[nH]c(SCc2cc(C)nc(C)n2)nc1Cc1ccccc1 ZINC000657226748 1038444619 /nfs/dbraw/zinc/44/46/19/1038444619.db2.gz SOIUQSDMBDMWPC-UHFFFAOYSA-N 0 1 324.453 4.008 20 0 DIADMN COc1ccc(Cl)cc1-c1n[nH]c(SCC2CC=CC2)n1 ZINC000657232400 1038444675 /nfs/dbraw/zinc/44/46/75/1038444675.db2.gz YVIRIQQQIKAYEN-UHFFFAOYSA-N 0 1 321.833 4.192 20 0 DIADMN CC(C)[C@@H]1C[C@@H](NCc2coc(-c3cccs3)n2)CS1 ZINC000277194945 1038448763 /nfs/dbraw/zinc/44/87/63/1038448763.db2.gz IYZICOMMZXNUCJ-RISCZKNCSA-N 0 1 308.472 4.023 20 0 DIADMN c1cc(CN(CCc2ccccc2)Cc2ccncc2)cs1 ZINC000013990049 1038452557 /nfs/dbraw/zinc/45/25/57/1038452557.db2.gz FYBLBONDNWVBRR-UHFFFAOYSA-N 0 1 308.450 4.388 20 0 DIADMN CC[C@H](C)c1nc([C@H](C)N[C@@H](C)c2ccc(F)c(F)c2)n[nH]1 ZINC000277207862 1038453004 /nfs/dbraw/zinc/45/30/04/1038453004.db2.gz KAXGSDSDYFSBNF-DCAQKATOSA-N 0 1 308.376 4.008 20 0 DIADMN c1ccc(-c2n[nH]c(SC[C@@H]3CCCc4ccccc43)n2)nc1 ZINC000604932705 1038464069 /nfs/dbraw/zinc/46/40/69/1038464069.db2.gz CPVQGDSFNKAFTF-AWEZNQCLSA-N 0 1 322.437 4.079 20 0 DIADMN CCc1nc(C)c([C@H](C)N[C@@H](C)c2n[nH]c([C@H](C)CC)n2)s1 ZINC000277266034 1038474142 /nfs/dbraw/zinc/47/41/42/1038474142.db2.gz PHGZDONTPHHCQP-SCVCMEIPSA-N 0 1 321.494 4.057 20 0 DIADMN CC[C@@H]1CCCN(Cc2nc(-c3cccc(Cl)c3)no2)CC1 ZINC000604999157 1038475929 /nfs/dbraw/zinc/47/59/29/1038475929.db2.gz QPQGCOMIBOPBSX-CYBMUJFWSA-N 0 1 319.836 4.402 20 0 DIADMN CCN(CC)C(=O)CN1CCCCC[C@@H]1c1ccc(Cl)cc1 ZINC000605000507 1038476115 /nfs/dbraw/zinc/47/61/15/1038476115.db2.gz WTPOUKAZPFOZDD-QGZVFWFLSA-N 0 1 322.880 4.126 20 0 DIADMN Cc1nn(C(C)C)c(C)c1CN1CCC[C@@H]1c1cccc(C)n1 ZINC000892051955 1038489450 /nfs/dbraw/zinc/48/94/50/1038489450.db2.gz CUAPNGKMOJBSEH-LJQANCHMSA-N 0 1 312.461 4.121 20 0 DIADMN CC[C@H](C)c1nc([C@@H](C)N[C@H]2CCc3cc(Cl)ccc32)n[nH]1 ZINC000277301382 1038494233 /nfs/dbraw/zinc/49/42/33/1038494233.db2.gz RZCFYKRFVJQLMR-RWSFTLGLSA-N 0 1 318.852 4.310 20 0 DIADMN CC[C@H](C)c1nc([C@H](C)N[C@H](C)c2cc(F)cc(F)c2)n[nH]1 ZINC000277311756 1038500765 /nfs/dbraw/zinc/50/07/65/1038500765.db2.gz SOSQEOLEBOGIKC-AXFHLTTASA-N 0 1 308.376 4.008 20 0 DIADMN Fc1c(CNCc2cccc(Cl)c2)cccc1OC1CC1 ZINC000657285599 1038501339 /nfs/dbraw/zinc/50/13/39/1038501339.db2.gz KOGVBKKXPLYKAK-UHFFFAOYSA-N 0 1 305.780 4.310 20 0 DIADMN O=C([O-])CC[C@@H]1CCC[N@@H+](Cc2cc(Cl)ccc2Cl)C1 ZINC000087761521 1038501551 /nfs/dbraw/zinc/50/15/51/1038501551.db2.gz UPUJHXAQGFPRBM-NSHDSACASA-N 0 1 316.228 4.070 20 0 DIADMN CCOc1ccccc1CNCc1ccc2[nH]c(C)c(C)c2c1 ZINC000065013673 1038506683 /nfs/dbraw/zinc/50/66/83/1038506683.db2.gz PPONPASNHQXZIG-UHFFFAOYSA-N 0 1 308.425 4.473 20 0 DIADMN COc1cccc(Cl)c1CNCCOC1CCCCCC1 ZINC000605322755 1038506912 /nfs/dbraw/zinc/50/69/12/1038506912.db2.gz BUZSSOJMCJIUKZ-UHFFFAOYSA-N 0 1 311.853 4.178 20 0 DIADMN COCc1csc(CN[C@H](C)c2cc(C)ccc2OC)c1 ZINC000657295646 1038512046 /nfs/dbraw/zinc/51/20/46/1038512046.db2.gz GTGYVVNPIZALNH-CYBMUJFWSA-N 0 1 305.443 4.062 20 0 DIADMN Cc1cc(CNCc2cc(F)ccc2OC(F)F)ccc1F ZINC000657295584 1038512189 /nfs/dbraw/zinc/51/21/89/1038512189.db2.gz UTBFHUWEBPTVLS-UHFFFAOYSA-N 0 1 313.294 4.164 20 0 DIADMN O=C(Nc1cccc(Cl)c1)c1ccc(Nc2ccncc2)cc1 ZINC000605423205 1038513501 /nfs/dbraw/zinc/51/35/01/1038513501.db2.gz OQLOHIYKUIMBHZ-UHFFFAOYSA-N 0 1 323.783 4.153 20 0 DIADMN CCC[C@@]1(C)CCC[N@@H+](Cc2ncccc2Br)C1 ZINC001167508568 1038513838 /nfs/dbraw/zinc/51/38/38/1038513838.db2.gz GZGZGTYQXFBWDW-HNNXBMFYSA-N 0 1 311.267 4.246 20 0 DIADMN CCC[C@@]1(C)CCCN(Cc2ncccc2Br)C1 ZINC001167508568 1038513842 /nfs/dbraw/zinc/51/38/42/1038513842.db2.gz GZGZGTYQXFBWDW-HNNXBMFYSA-N 0 1 311.267 4.246 20 0 DIADMN CC[C@H](C)c1nc([C@H](C)N[C@@H](C)c2ccc(OC)c(C)c2)n[nH]1 ZINC000277367168 1038522769 /nfs/dbraw/zinc/52/27/69/1038522769.db2.gz WSGUNFVGYYOGSW-UBHSHLNASA-N 0 1 316.449 4.047 20 0 DIADMN Cc1ccc(CN[C@H](CCO)c2ccc(Cl)cc2)cc1F ZINC000342300920 1038523116 /nfs/dbraw/zinc/52/31/16/1038523116.db2.gz MZLALKCBUIVCAT-QGZVFWFLSA-N 0 1 307.796 4.001 20 0 DIADMN C[C@@H](NCc1ccccn1)c1ccc(Oc2cccnc2)cc1 ZINC000342303736 1038524084 /nfs/dbraw/zinc/52/40/84/1038524084.db2.gz DSWYRHYTEMEIIT-OAHLLOKOSA-N 0 1 305.381 4.120 20 0 DIADMN C/C=C\c1ccc(NCc2cn(-c3ccncc3)nc2C)cc1 ZINC000342307018 1038524992 /nfs/dbraw/zinc/52/49/92/1038524992.db2.gz GEDBSXCSQVZHJM-ARJAWSKDSA-N 0 1 304.397 4.221 20 0 DIADMN CC[C@H](C)c1nc([C@@H](C)N[C@@H](C)c2cccc(C)c2C)n[nH]1 ZINC000277379820 1038529378 /nfs/dbraw/zinc/52/93/78/1038529378.db2.gz XMXRDWBPQLQUBA-TUKIKUTGSA-N 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/nfs/dbraw/zinc/67/52/43/1043675243.db2.gz BAOVEGGOXVYTIE-WBMJQRKESA-N 0 1 309.438 4.420 20 0 DIADMN Cc1[nH]c2ccc(CNCc3cc(F)c(F)c(F)c3)cc2c1C ZINC000076397672 1043677918 /nfs/dbraw/zinc/67/79/18/1043677918.db2.gz SIZKWDNCYONHCQ-UHFFFAOYSA-N 0 1 318.342 4.492 20 0 DIADMN Fc1cc2c(c(F)c1)CC[C@H]2N[C@H]1CCCc2cccnc21 ZINC000927063128 1043677831 /nfs/dbraw/zinc/67/78/31/1043677831.db2.gz VIHDEQFELSUBPX-SJORKVTESA-N 0 1 300.352 4.014 20 0 DIADMN C[C@H]1CN(Cc2cccc3cc[nH]c32)C[C@@H](c2ccsc2)O1 ZINC000354088107 1043679750 /nfs/dbraw/zinc/67/97/50/1043679750.db2.gz KVJPISUTJNTKFL-GUYCJALGSA-N 0 1 312.438 4.191 20 0 DIADMN O=C(Nc1ccc2nc(C3CCC3)[nH]c2c1)[C@H]1CC12CCCC2 ZINC000354074173 1043679869 /nfs/dbraw/zinc/67/98/69/1043679869.db2.gz GMUPEFGIQGQWKE-CQSZACIVSA-N 0 1 309.413 4.349 20 0 DIADMN CSC1CCN(Cc2cc3ccnc(Cl)c3s2)CC1 ZINC000895416512 1043680237 /nfs/dbraw/zinc/68/02/37/1043680237.db2.gz WSKIPRXKQRSHLX-UHFFFAOYSA-N 0 1 312.891 4.277 20 0 DIADMN COc1ccc([C@H](N[C@H]2C[C@@H](C)n3ccnc32)C2CCC2)cc1 ZINC000927069691 1043682216 /nfs/dbraw/zinc/68/22/16/1043682216.db2.gz ZTUNMCUWRZODBQ-JEBQAFNWSA-N 0 1 311.429 4.029 20 0 DIADMN C[C@H](NCc1cccc2c1OCC2)c1nccc2ccccc21 ZINC000927091419 1043685012 /nfs/dbraw/zinc/68/50/12/1043685012.db2.gz OQYAMQOUAIVTLI-AWEZNQCLSA-N 0 1 304.393 4.021 20 0 DIADMN C[C@H]1C[C@@H](NCc2cc(C3CC3)nn2C)c2ccsc2S1 ZINC000927100043 1043686426 /nfs/dbraw/zinc/68/64/26/1043686426.db2.gz SEHPYPKWDIOHJT-ZUZCIYMTSA-N 0 1 319.499 4.074 20 0 DIADMN Cn1nc(CN[C@H](c2cccs2)C2CCCC2)cc1C1CC1 ZINC000927112906 1043689695 /nfs/dbraw/zinc/68/96/95/1043689695.db2.gz SUQTWXOXDMDKAO-SFHVURJKSA-N 0 1 315.486 4.380 20 0 DIADMN Cc1cccc([C@@H](NCc2nc3c(s2)COCC3)C(C)C)c1 ZINC000927115803 1043690362 /nfs/dbraw/zinc/69/03/62/1043690362.db2.gz RPFUSXUAGKXJTQ-SFHVURJKSA-N 0 1 316.470 4.011 20 0 DIADMN CC(C)C[C@H](NCc1cc(C2CC2)n(C)n1)c1cccs1 ZINC000927113356 1043691504 /nfs/dbraw/zinc/69/15/04/1043691504.db2.gz ZVBVVAWTEQXDLM-HNNXBMFYSA-N 0 1 303.475 4.236 20 0 DIADMN C[C@@H]1CC[C@@H](NCc2nc3c(s2)COCC3)c2sccc21 ZINC000927117171 1043693472 /nfs/dbraw/zinc/69/34/72/1043693472.db2.gz KFWWTUMYINLGGW-ZWNOBZJWSA-N 0 1 320.483 4.006 20 0 DIADMN O=c1[nH]ccc2oc(CN3CCCCC[C@@H]3c3ccncc3)cc21 ZINC000876522789 1043693487 /nfs/dbraw/zinc/69/34/87/1043693487.db2.gz BYRZUKMVUNHHRC-QGZVFWFLSA-N 0 1 323.396 4.046 20 0 DIADMN Cc1nc([C@H](C)NC[C@@]2(c3ccccc3)CCCO2)c(C)s1 ZINC000927117016 1043693830 /nfs/dbraw/zinc/69/38/30/1043693830.db2.gz ZUFHEJVAHSGSKR-SCLBCKFNSA-N 0 1 316.470 4.116 20 0 DIADMN Cc1scc(CNCc2cccc(C(F)(F)F)n2)c1C ZINC000631149593 1043694028 /nfs/dbraw/zinc/69/40/28/1043694028.db2.gz SAJUMNKUHIJRES-UHFFFAOYSA-N 0 1 300.349 4.069 20 0 DIADMN CCc1onc(C)c1CN[C@H](CC(C)C)c1ccc(OC)cc1 ZINC000927133305 1043695465 /nfs/dbraw/zinc/69/54/65/1043695465.db2.gz BXISFLCDDIDKHS-GOSISDBHSA-N 0 1 316.445 4.431 20 0 DIADMN CCc1onc(C)c1CN[C@@H](c1ccc(C)o1)C1CCCC1 ZINC000927138547 1043696245 /nfs/dbraw/zinc/69/62/45/1043696245.db2.gz FWXVEEPBMIENRA-GOSISDBHSA-N 0 1 302.418 4.468 20 0 DIADMN CCC[C@H](NCc1c(C)noc1CC)c1ccc(OC)cc1 ZINC000927136572 1043696359 /nfs/dbraw/zinc/69/63/59/1043696359.db2.gz COHPIANXFOIEIC-KRWDZBQOSA-N 0 1 302.418 4.185 20 0 DIADMN Cc1ncc([C@H](C)N[C@H](C)c2cc(Cl)cc3c2OCC3)s1 ZINC000927140378 1043697132 /nfs/dbraw/zinc/69/71/32/1043697132.db2.gz NIZPJLNEZHNZAM-ZJUUUORDSA-N 0 1 322.861 4.452 20 0 DIADMN CCc1onc(C)c1CN[C@@H]1CCSc2cc(C)c(C)cc21 ZINC000927135380 1043697212 /nfs/dbraw/zinc/69/72/12/1043697212.db2.gz RWRGFFYQEJYOMV-MRXNPFEDSA-N 0 1 316.470 4.489 20 0 DIADMN CCc1onc(C)c1CN[C@H](C)c1ccc(SC)c(F)c1 ZINC000927138873 1043697254 /nfs/dbraw/zinc/69/72/54/1043697254.db2.gz HUOZEAWAHHKZCV-SNVBAGLBSA-N 0 1 308.422 4.257 20 0 DIADMN Clc1ccc(CN(C2CC2)[C@H]2CCCc3ccccc32)nn1 ZINC000876595321 1043698709 /nfs/dbraw/zinc/69/87/09/1043698709.db2.gz CWMZVFZPJFEKLF-KRWDZBQOSA-N 0 1 313.832 4.172 20 0 DIADMN CCCCN(C)[C@H](C)C(=O)c1cc(C)n(Cc2ccco2)c1C ZINC000354463973 1043700429 /nfs/dbraw/zinc/70/04/29/1043700429.db2.gz QRABAEWJYQLXCK-MRXNPFEDSA-N 0 1 316.445 4.049 20 0 DIADMN CC(C)(C)c1n[nH]c(SCc2ccc(C(F)(F)F)cc2)n1 ZINC000012260050 1043702904 /nfs/dbraw/zinc/70/29/04/1043702904.db2.gz CQBUJEUFOAKESW-UHFFFAOYSA-N 0 1 315.364 4.413 20 0 DIADMN CC(C)(C)c1nc(SCc2ccc(C(F)(F)F)cc2)n[nH]1 ZINC000012260050 1043702914 /nfs/dbraw/zinc/70/29/14/1043702914.db2.gz CQBUJEUFOAKESW-UHFFFAOYSA-N 0 1 315.364 4.413 20 0 DIADMN FC(F)Oc1ccccc1CNCc1coc2ccccc12 ZINC000114509010 1043704490 /nfs/dbraw/zinc/70/44/90/1043704490.db2.gz UQIKAUYOAWEVGV-UHFFFAOYSA-N 0 1 303.308 4.324 20 0 DIADMN CC(C)CN(Cc1nc(Cc2ccccc2)no1)CC(C)(C)C ZINC000474234350 1043704634 /nfs/dbraw/zinc/70/46/34/1043704634.db2.gz QJTNKCFVHXQCKV-UHFFFAOYSA-N 0 1 315.461 4.165 20 0 DIADMN Cc1ccc(C)c([C@@H]2CCCN2CC(=O)Nc2ccccc2C)c1 ZINC000474232353 1043705179 /nfs/dbraw/zinc/70/51/79/1043705179.db2.gz WPLBVICWTKCUFR-FQEVSTJZSA-N 0 1 322.452 4.387 20 0 DIADMN Cc1ccc(C)c([C@@H]2CCCN2Cc2cn3ccsc3n2)c1 ZINC000474234057 1043706276 /nfs/dbraw/zinc/70/62/76/1043706276.db2.gz RFCCUADEKOZJNE-KRWDZBQOSA-N 0 1 311.454 4.350 20 0 DIADMN Fc1cc(C[N@H+]2CC[C@H]3CC[C@@H](C2)S3)ccc1C(F)F ZINC000895578489 1043710752 /nfs/dbraw/zinc/71/07/52/1043710752.db2.gz LHOGUADFJGEEQW-NEPJUHHUSA-N 0 1 301.377 4.233 20 0 DIADMN O=C(Nc1ccc2nc(C3CCCCC3)[nH]c2c1)c1ccco1 ZINC000474264251 1043713740 /nfs/dbraw/zinc/71/37/40/1043713740.db2.gz INUOJJCSUQXKLO-UHFFFAOYSA-N 0 1 309.369 4.456 20 0 DIADMN COc1ccc(F)c(CNCc2cccc(C(F)(F)F)c2)c1 ZINC000559235617 1043714159 /nfs/dbraw/zinc/71/41/59/1043714159.db2.gz ZMRFPISRXJIQAG-UHFFFAOYSA-N 0 1 313.294 4.143 20 0 DIADMN CCc1ccccc1NC(=O)CN(Cc1ccccc1)C(C)(C)C ZINC000474272871 1043719060 /nfs/dbraw/zinc/71/90/60/1043719060.db2.gz CHAGKFVJKGQGAN-UHFFFAOYSA-N 0 1 324.468 4.488 20 0 DIADMN COc1cnc(F)c(CN[C@@H](c2ccc(Cl)cc2)C2CC2)c1 ZINC000876886797 1043721430 /nfs/dbraw/zinc/72/14/30/1043721430.db2.gz ZMSWDQXKCVSUGD-MRXNPFEDSA-N 0 1 320.795 4.124 20 0 DIADMN CC[C@H](NCc1ccc(OCCOC)o1)c1cc(C)ccc1C ZINC000895635754 1043722397 /nfs/dbraw/zinc/72/23/97/1043722397.db2.gz YKIAXYOYFVPMFD-SFHVURJKSA-N 0 1 317.429 4.163 20 0 DIADMN Cc1nnc(CNCC(C)(C)c2ccc3ccccc3c2)s1 ZINC000895656385 1043727065 /nfs/dbraw/zinc/72/70/65/1043727065.db2.gz LWFUOIUUUANFFK-UHFFFAOYSA-N 0 1 311.454 4.067 20 0 DIADMN COc1cnc(F)c(CN[C@@H](CC(C)C)c2cccs2)c1 ZINC000876958482 1043728251 /nfs/dbraw/zinc/72/82/51/1043728251.db2.gz FLBWZPGYNNUBMY-AWEZNQCLSA-N 0 1 308.422 4.168 20 0 DIADMN Clc1ccc([C@@H](Cc2cccnc2)NCc2ccoc2)cc1 ZINC000354960295 1043730843 /nfs/dbraw/zinc/73/08/43/1043730843.db2.gz AIQKSFBXVOFQGY-GOSISDBHSA-N 0 1 312.800 4.402 20 0 DIADMN COc1cccc(C2(NCc3ccc(C(F)F)nc3)CCC2)c1 ZINC000631176344 1043734165 /nfs/dbraw/zinc/73/41/65/1043734165.db2.gz AZPDVDVHCRGAJO-UHFFFAOYSA-N 0 1 318.367 4.197 20 0 DIADMN O=C(Nc1ncc(C(F)(F)F)[nH]1)c1ccc(C2=CCCC2)cc1 ZINC000355002433 1043734879 /nfs/dbraw/zinc/73/48/79/1043734879.db2.gz AUPWRFLBSHZPCX-UHFFFAOYSA-N 0 1 321.302 4.248 20 0 DIADMN CC(C)c1cc(CNCc2cc3nc(Cl)ccc3s2)on1 ZINC000877031462 1043735701 /nfs/dbraw/zinc/73/57/01/1043735701.db2.gz RFFWVJXKDKBCIG-UHFFFAOYSA-N 0 1 321.833 4.351 20 0 DIADMN C[C@@H]1C[C@H]1[C@@H](NCc1ccc(Cl)nn1)c1ccc(Cl)cc1 ZINC000877043274 1043737660 /nfs/dbraw/zinc/73/76/60/1043737660.db2.gz IMAPQEZSHQYGTE-HQQWDMGQSA-N 0 1 322.239 4.270 20 0 DIADMN CN(Cc1n[nH]c(C2CC2)n1)c1ccc(Oc2ccccc2)cc1 ZINC000355033580 1043739014 /nfs/dbraw/zinc/73/90/14/1043739014.db2.gz QWZUCQAVOBIJPK-UHFFFAOYSA-N 0 1 320.396 4.111 20 0 DIADMN CC[C@H](NCc1cn2cc(Cl)ccc2n1)c1cccs1 ZINC000096543830 1043739783 /nfs/dbraw/zinc/73/97/83/1043739783.db2.gz VYPSQOLXLVILDL-ZDUSSCGKSA-N 0 1 305.834 4.290 20 0 DIADMN CCC(C)(C)c1ccc(CNCc2ccc(Cl)nn2)cc1 ZINC000877111501 1043743866 /nfs/dbraw/zinc/74/38/66/1043743866.db2.gz IQMDBIACMJSERQ-UHFFFAOYSA-N 0 1 303.837 4.107 20 0 DIADMN C[C@H](N[C@@H]1CCCc2cc(F)ccc21)c1nc2c(s1)CCC2 ZINC000355114205 1043744492 /nfs/dbraw/zinc/74/44/92/1043744492.db2.gz UWSPZHFWEFDWCM-XHDPSFHLSA-N 0 1 316.445 4.499 20 0 DIADMN C[C@@H](N[C@@H]1CCCc2cc(F)ccc21)c1nc2c(s1)CCC2 ZINC000355114191 1043745520 /nfs/dbraw/zinc/74/55/20/1043745520.db2.gz UWSPZHFWEFDWCM-IAQYHMDHSA-N 0 1 316.445 4.499 20 0 DIADMN COc1ccc2nc(CN[C@@H]3CCc4ccccc43)sc2c1 ZINC000474357556 1043746864 /nfs/dbraw/zinc/74/68/64/1043746864.db2.gz QDVZSNRMUHKDRJ-OAHLLOKOSA-N 0 1 310.422 4.082 20 0 DIADMN Cc1cccc([C@@H](NC[C@@H]2CC2(Cl)Cl)c2ccccn2)c1 ZINC000877123211 1043747584 /nfs/dbraw/zinc/74/75/84/1043747584.db2.gz HLDANKNZCXKAQF-GOEBONIOSA-N 0 1 321.251 4.263 20 0 DIADMN C[C@H](NC(Cc1ccccc1)Cc1ccccc1)c1ncco1 ZINC000895764425 1043748086 /nfs/dbraw/zinc/74/80/86/1043748086.db2.gz HGCHISUYTTVTBU-INIZCTEOSA-N 0 1 306.409 4.179 20 0 DIADMN COc1ccc2nc(CN[C@@H]3CCc4cc(C)ccc43)sc2c1 ZINC000474361073 1043749351 /nfs/dbraw/zinc/74/93/51/1043749351.db2.gz ZVXBBNLUBQICAE-MRXNPFEDSA-N 0 1 324.449 4.390 20 0 DIADMN CCO[P@](C)(=O)CC[C@H](C)Nc1ccc2c(c1)nc(C)n2C ZINC000877159757 1043749471 /nfs/dbraw/zinc/74/94/71/1043749471.db2.gz KOPHYGWSPAWAJO-YTEVENLXSA-N 0 1 323.377 4.017 20 0 DIADMN Cc1ccncc1[C@H](C)NCc1cc2c(ccnc2Cl)o1 ZINC000877136087 1043749930 /nfs/dbraw/zinc/74/99/30/1043749930.db2.gz XWFCRHAMAIDAHG-NSHDSACASA-N 0 1 301.777 4.035 20 0 DIADMN CC(C)C[C@@H]1CCCN(Cc2csc(-c3ccccn3)n2)C1 ZINC000532091614 1043750326 /nfs/dbraw/zinc/75/03/26/1043750326.db2.gz GUFMDVRDJHSJEM-HNNXBMFYSA-N 0 1 315.486 4.463 20 0 DIADMN Fc1ccc([C@@H]2CCCN(Cc3ccc(Cl)nn3)CC2)cc1 ZINC000877166569 1043751136 /nfs/dbraw/zinc/75/11/36/1043751136.db2.gz BOXCTNLVWXVRSZ-CYBMUJFWSA-N 0 1 319.811 4.039 20 0 DIADMN Cc1cccc(C2=CCN(Cc3cc4c(cc[nH]c4=O)o3)CC2)c1 ZINC000877182444 1043752608 /nfs/dbraw/zinc/75/26/08/1043752608.db2.gz YOCNBOCGOUXVRZ-UHFFFAOYSA-N 0 1 320.392 4.131 20 0 DIADMN COc1cccc(CN2CCCC3(CCC3)C2)c1OC(F)F ZINC000355214213 1043752824 /nfs/dbraw/zinc/75/28/24/1043752824.db2.gz GVYNGPGXWYPSBE-UHFFFAOYSA-N 0 1 311.372 4.063 20 0 DIADMN COCc1nc(CN2CCC[C@H]2CCC2CCCC2)cs1 ZINC000355216347 1043753111 /nfs/dbraw/zinc/75/31/11/1043753111.db2.gz DYVJQRQLRCUETO-INIZCTEOSA-N 0 1 308.491 4.224 20 0 DIADMN C[C@@H]1[C@H](C(F)(F)F)CCN1Cc1cc2cc(F)ccc2o1 ZINC000355226667 1043753201 /nfs/dbraw/zinc/75/32/01/1043753201.db2.gz SFXYRUPSCGGTKQ-NOZJJQNGSA-N 0 1 301.283 4.345 20 0 DIADMN COc1ccc2nc(CN[C@@H]3c4ccccc4C[C@@H]3C)sc2c1 ZINC000474367649 1043754487 /nfs/dbraw/zinc/75/44/87/1043754487.db2.gz FZZYOUWOZYCHQQ-BUXKBTBVSA-N 0 1 324.449 4.328 20 0 DIADMN C[C@H](c1cccnc1)N(C)Cc1cc2c(ccnc2Cl)o1 ZINC000877317361 1043758151 /nfs/dbraw/zinc/75/81/51/1043758151.db2.gz KZRMICPCSLSDGM-LLVKDONJSA-N 0 1 301.777 4.069 20 0 DIADMN C[C@@H](Nc1ccc(CN(C)C)c(F)c1)c1ccc2c(c1)COC2 ZINC000777701846 1043764392 /nfs/dbraw/zinc/76/43/92/1043764392.db2.gz QGDHXEHLTWIEKB-CYBMUJFWSA-N 0 1 314.404 4.091 20 0 DIADMN CC(C)n1cc(C[N@@H+]2CC=C(c3cccc(Cl)c3)CC2)cn1 ZINC000355418665 1043765827 /nfs/dbraw/zinc/76/58/27/1043765827.db2.gz KDBHBMUGHKQHAG-UHFFFAOYSA-N 0 1 315.848 4.407 20 0 DIADMN CC(C)n1cc(CN2CC=C(c3cccc(Cl)c3)CC2)cn1 ZINC000355418665 1043765834 /nfs/dbraw/zinc/76/58/34/1043765834.db2.gz KDBHBMUGHKQHAG-UHFFFAOYSA-N 0 1 315.848 4.407 20 0 DIADMN C[C@H](Nc1ccc(CN(C)C)c(F)c1)c1cccc(F)c1F ZINC000777703782 1043765905 /nfs/dbraw/zinc/76/59/05/1043765905.db2.gz YNFLVXCEAVXAQN-NSHDSACASA-N 0 1 308.347 4.339 20 0 DIADMN CN(C)Cc1ccc(N[C@@H]2CCCc3sccc32)cc1F ZINC000777699411 1043766339 /nfs/dbraw/zinc/76/63/39/1043766339.db2.gz BUROLBJJTDZFFF-MRXNPFEDSA-N 0 1 304.434 4.438 20 0 DIADMN Cc1ccc(CN(CC[S@](=O)c2ccccc2)C(C)C)s1 ZINC000355440044 1043767467 /nfs/dbraw/zinc/76/74/67/1043767467.db2.gz QISKKEYCXVNNHF-NRFANRHFSA-N 0 1 321.511 4.075 20 0 DIADMN CCOc1ccccc1[C@H](C)Nc1ccc(CN(C)C)c(F)c1 ZINC000777699841 1043768648 /nfs/dbraw/zinc/76/86/48/1043768648.db2.gz DWYSNOUJKLBGEF-AWEZNQCLSA-N 0 1 316.420 4.459 20 0 DIADMN COc1cc(C)ccc1[C@H](C)Nc1ccc(CN(C)C)c(F)c1 ZINC000777701137 1043769079 /nfs/dbraw/zinc/76/90/79/1043769079.db2.gz QLBORCNTCONCAL-AWEZNQCLSA-N 0 1 316.420 4.377 20 0 DIADMN CCOc1cccc([C@H](C)Nc2ccc(CN(C)C)c(F)c2)c1 ZINC000777700173 1043769127 /nfs/dbraw/zinc/76/91/27/1043769127.db2.gz JXWXENCFBVDSEX-AWEZNQCLSA-N 0 1 316.420 4.459 20 0 DIADMN CCN(Cc1cc2c(ccnc2Cl)o1)[C@@H](C)c1cccnc1 ZINC000877531183 1043769521 /nfs/dbraw/zinc/76/95/21/1043769521.db2.gz JEYPFDLSRGWCQU-LBPRGKRZSA-N 0 1 315.804 4.459 20 0 DIADMN C[C@H](CCOCc1ccccc1)N[C@H](C)c1c(F)cncc1F ZINC000877520854 1043769882 /nfs/dbraw/zinc/76/98/82/1043769882.db2.gz JDSVWIDDAHPNGP-ZIAGYGMSSA-N 0 1 320.383 4.006 20 0 DIADMN Fc1ccc2c(c1)[C@H](NCc1cc(F)c(F)c(F)c1)CCC2 ZINC000355494545 1043772591 /nfs/dbraw/zinc/77/25/91/1043772591.db2.gz KXHXYOMHGZRGPU-MRXNPFEDSA-N 0 1 309.306 4.410 20 0 DIADMN Clc1ccc(CNCc2ccc(C3CCCCC3)cc2)nn1 ZINC000877548666 1043773631 /nfs/dbraw/zinc/77/36/31/1043773631.db2.gz QPKQLZSFXGBBPU-UHFFFAOYSA-N 0 1 315.848 4.468 20 0 DIADMN Cc1ncsc1CNCc1ccc(-c2c(F)cccc2F)o1 ZINC000115616867 1043777043 /nfs/dbraw/zinc/77/70/43/1043777043.db2.gz URMOYXXXFKPZBD-UHFFFAOYSA-N 0 1 320.364 4.280 20 0 DIADMN CCCc1ncc(CNCc2cc3nc(Cl)ccc3s2)o1 ZINC000877572682 1043777721 /nfs/dbraw/zinc/77/77/21/1043777721.db2.gz JCGIVXFWTAHGAM-UHFFFAOYSA-N 0 1 321.833 4.180 20 0 DIADMN CCOc1cc(C(=O)Nc2cc(F)cc(Cl)c2O)ccc1C ZINC000474430492 1043779337 /nfs/dbraw/zinc/77/93/37/1043779337.db2.gz IJCNOMVPTJBFDC-UHFFFAOYSA-N 0 1 323.751 4.144 20 0 DIADMN Cc1n[nH]c(C(F)F)c1NC(=O)[C@@H](C)c1cc2ccccc2o1 ZINC000355610717 1043780352 /nfs/dbraw/zinc/78/03/52/1043780352.db2.gz CXKCDWGKZKGJAY-QMMMGPOBSA-N 0 1 319.311 4.144 20 0 DIADMN CCO[P@](C)(=O)CC[C@H](C)Nc1nccc(C)c1C1CC1 ZINC000877625666 1043781186 /nfs/dbraw/zinc/78/11/86/1043781186.db2.gz MQXXVQIZPFGBDH-ZSEKCTLFSA-N 0 1 310.378 4.402 20 0 DIADMN Cc1ccc(C(=O)C2CCN([C@H](C)c3ccccn3)CC2)cc1 ZINC000355676143 1043783684 /nfs/dbraw/zinc/78/36/84/1043783684.db2.gz DWRMXACMBSIZEW-MRXNPFEDSA-N 0 1 308.425 4.046 20 0 DIADMN Cc1ccc(C(=O)Nc2cc(F)cc(Cl)c2O)cc1Cl ZINC000474445261 1043784380 /nfs/dbraw/zinc/78/43/80/1043784380.db2.gz LGDOXNQGNQOFHX-UHFFFAOYSA-N 0 1 314.143 4.399 20 0 DIADMN Cn1cc(CN[C@@H]2CCc3cccc4cccc2c43)c(Cl)n1 ZINC000895934414 1043785783 /nfs/dbraw/zinc/78/57/83/1043785783.db2.gz KRKWYDKSWJLAER-MRXNPFEDSA-N 0 1 311.816 4.004 20 0 DIADMN c1c(CN[C@@H]2CCc3cccc4cccc2c43)nn2c1CCCC2 ZINC000895935102 1043786387 /nfs/dbraw/zinc/78/63/87/1043786387.db2.gz OELKESXTUWLPET-HXUWFJFHSA-N 0 1 317.436 4.150 20 0 DIADMN C(=C\c1ccccc1)\CN1CCC(c2nc(C3CCC3)no2)CC1 ZINC000877735689 1043791859 /nfs/dbraw/zinc/79/18/59/1043791859.db2.gz COXBKHYIVCHKKZ-YVMONPNESA-N 0 1 323.440 4.230 20 0 DIADMN C[C@H](N[C@@H](c1nccn1C)c1ccc(Cl)cc1)C1CCCC1 ZINC000474475797 1043795293 /nfs/dbraw/zinc/79/52/93/1043795293.db2.gz IYJOHOHFODQVEO-SUMWQHHRSA-N 0 1 317.864 4.331 20 0 DIADMN C[C@@H](N[C@@H](c1nccn1C)c1ccc(Cl)cc1)C1CCCC1 ZINC000474475791 1043795330 /nfs/dbraw/zinc/79/53/30/1043795330.db2.gz IYJOHOHFODQVEO-CXAGYDPISA-N 0 1 317.864 4.331 20 0 DIADMN COc1ccccc1[C@@H]1CCCN(Cc2ncc(C)s2)CC1 ZINC000877769384 1043797774 /nfs/dbraw/zinc/79/77/74/1043797774.db2.gz HTKHZKHGVGYJTO-OAHLLOKOSA-N 0 1 316.470 4.230 20 0 DIADMN Cc1ccncc1CNC1(c2cccc(C(F)(F)F)c2)CC1 ZINC000474487359 1043799785 /nfs/dbraw/zinc/79/97/85/1043799785.db2.gz JVTBTHYCNOXPRL-UHFFFAOYSA-N 0 1 306.331 4.188 20 0 DIADMN Cc1oc(-c2cccs2)nc1CNCCSCC(C)C ZINC001308361502 1043801174 /nfs/dbraw/zinc/80/11/74/1043801174.db2.gz WIMTYPGBWICEHL-UHFFFAOYSA-N 0 1 310.488 4.190 20 0 DIADMN C[C@]1(C(F)(F)F)CCN(Cc2cnc(C3CCC3)s2)C1 ZINC000877811903 1043801862 /nfs/dbraw/zinc/80/18/62/1043801862.db2.gz BSXIMXHHVWOREV-ZDUSSCGKSA-N 0 1 304.381 4.185 20 0 DIADMN Cc1cc(C[N@H+](C)[C@H](C)c2ccc(C(F)(F)F)cc2)c(C)nn1 ZINC000929383366 1043815139 /nfs/dbraw/zinc/81/51/39/1043815139.db2.gz MFAHNSAWZJRQFX-CYBMUJFWSA-N 0 1 323.362 4.305 20 0 DIADMN Cc1cc(CN(C)[C@H](C)c2ccc(C(F)(F)F)cc2)c(C)nn1 ZINC000929383366 1043815159 /nfs/dbraw/zinc/81/51/59/1043815159.db2.gz MFAHNSAWZJRQFX-CYBMUJFWSA-N 0 1 323.362 4.305 20 0 DIADMN Cc1cc(-c2noc([C@H](C)N3CCCCCC3)n2)ccc1F ZINC000097466533 1043817389 /nfs/dbraw/zinc/81/73/89/1043817389.db2.gz QOPIGDDXILXUAY-ZDUSSCGKSA-N 0 1 303.381 4.121 20 0 DIADMN c1cn(C2CC2)c(CN[C@@H]2CCc3cccc4cccc2c43)n1 ZINC000896075635 1043820405 /nfs/dbraw/zinc/82/04/05/1043820405.db2.gz GTCPTDXSVHKRJY-GOSISDBHSA-N 0 1 303.409 4.148 20 0 DIADMN c1cn(C2CC2)c(CN[C@H]2CCc3cccc4cccc2c43)n1 ZINC000896075636 1043821230 /nfs/dbraw/zinc/82/12/30/1043821230.db2.gz GTCPTDXSVHKRJY-SFHVURJKSA-N 0 1 303.409 4.148 20 0 DIADMN C[C@H]1CO[C@H](c2ccccc2)CN1Cc1ccc2c(c1)CCC2 ZINC000522449453 1043824049 /nfs/dbraw/zinc/82/40/49/1043824049.db2.gz YVGXFLBJZJBNLN-KKSFZXQISA-N 0 1 307.437 4.137 20 0 DIADMN CC1(C2CC2)CCN(Cc2cnc([C@@H]3CCCO3)s2)CC1 ZINC000356280569 1043827748 /nfs/dbraw/zinc/82/77/48/1043827748.db2.gz KKVUNHUJZOBSTO-HNNXBMFYSA-N 0 1 306.475 4.007 20 0 DIADMN COc1cc([C@@H](C)NCc2cscc2C(F)(F)F)ccn1 ZINC000356295333 1043829176 /nfs/dbraw/zinc/82/91/76/1043829176.db2.gz BFEAMBAQFXUHIO-SECBINFHSA-N 0 1 316.348 4.021 20 0 DIADMN Fc1ccccc1-c1n[nH]c(SCCc2cccs2)n1 ZINC000121178745 1043830162 /nfs/dbraw/zinc/83/01/62/1043830162.db2.gz NSNCUUMKQNVSPB-UHFFFAOYSA-N 0 1 305.403 4.007 20 0 DIADMN C[C@@H](c1ccccc1Cl)N(C)C[C@H]1CCC2(CCOCC2)O1 ZINC000877977219 1043831440 /nfs/dbraw/zinc/83/14/40/1043831440.db2.gz WBPFGZYILNYOLC-LSDHHAIUSA-N 0 1 323.864 4.061 20 0 DIADMN Cc1ccncc1[C@H](C)NCc1ccc(Br)s1 ZINC000356313791 1043832959 /nfs/dbraw/zinc/83/29/59/1043832959.db2.gz RKGRZCAGMAZUMX-JTQLQIEISA-N 0 1 311.248 4.065 20 0 DIADMN C[C@H](c1ccc(F)nc1)N1CCC(OCC2CCCCC2)CC1 ZINC000929717458 1043835993 /nfs/dbraw/zinc/83/59/93/1043835993.db2.gz FMOHFPHNXBIEGU-OAHLLOKOSA-N 0 1 320.452 4.343 20 0 DIADMN c1nc(-c2ccccc2)oc1CN1CCC[C@H]1c1ccccn1 ZINC000929811310 1043841327 /nfs/dbraw/zinc/84/13/27/1043841327.db2.gz MXMGUPSVFJVWQR-SFHVURJKSA-N 0 1 305.381 4.074 20 0 DIADMN CN(C(=O)c1cccc2[nH]c(C(F)F)nc21)C1CCCCCC1 ZINC000929794887 1043841519 /nfs/dbraw/zinc/84/15/19/1043841519.db2.gz MNNZMTLNDPZFCY-UHFFFAOYSA-N 0 1 321.371 4.295 20 0 DIADMN CCOC(=O)c1coc(CNCc2ccc(C(C)(C)C)cc2)c1 ZINC000474606924 1043844279 /nfs/dbraw/zinc/84/42/79/1043844279.db2.gz MPYSBKOJNZGUNU-UHFFFAOYSA-N 0 1 315.413 4.044 20 0 DIADMN Fc1ccc2oc(CN3CC4(CCC4)[C@H]3[C@H]3CCCO3)cc2c1 ZINC000356529217 1043845764 /nfs/dbraw/zinc/84/57/64/1043845764.db2.gz QRWAXFSPTVOULV-QZTJIDSGSA-N 0 1 315.388 4.105 20 0 DIADMN CCSc1cccc(CN2CC[C@H](n3cc(Cl)cn3)C2)c1 ZINC000356512196 1043846149 /nfs/dbraw/zinc/84/61/49/1043846149.db2.gz ZBHKJIGOIPPHRM-HNNXBMFYSA-N 0 1 321.877 4.096 20 0 DIADMN CSc1ccc(CN2CC3(CCC3)[C@@H]2[C@H]2CCCO2)s1 ZINC000356518444 1043846756 /nfs/dbraw/zinc/84/67/56/1043846756.db2.gz DORBBIXICCHVMU-HIFRSBDPSA-N 0 1 309.500 4.004 20 0 DIADMN Cc1cn[nH]c1CNc1cccc(COCCc2ccccc2)c1 ZINC000289678872 1043859955 /nfs/dbraw/zinc/85/99/55/1043859955.db2.gz ASKATSCPBGBGRL-UHFFFAOYSA-N 0 1 321.424 4.090 20 0 DIADMN CC[C@](C)(NC[C@@H]1CC[C@H](c2ccccc2)O1)c1nccs1 ZINC000878254514 1043862441 /nfs/dbraw/zinc/86/24/41/1043862441.db2.gz YRFZBOQKHHYZJL-JZXOWHBKSA-N 0 1 316.470 4.278 20 0 DIADMN CC[C@](C)(NC[C@H]1CC[C@H](c2ccccc2)O1)c1nccs1 ZINC000878254515 1043863630 /nfs/dbraw/zinc/86/36/30/1043863630.db2.gz YRFZBOQKHHYZJL-NUJGCVRESA-N 0 1 316.470 4.278 20 0 DIADMN Cc1n[nH]cc1CN[C@H](C)c1sc(-c2ccccc2)nc1C ZINC000127020205 1043865642 /nfs/dbraw/zinc/86/56/42/1043865642.db2.gz YAYRXMDZACYQFA-GFCCVEGCSA-N 0 1 312.442 4.001 20 0 DIADMN Fc1ccc2c(c1)[C@@H](NCc1cccc(C(F)(F)F)n1)CC2 ZINC000453263050 1043872427 /nfs/dbraw/zinc/87/24/27/1043872427.db2.gz GOOYNHFHEMBBGD-AWEZNQCLSA-N 0 1 310.294 4.017 20 0 DIADMN C[C@H](NCc1nccn1CC(F)F)c1cccc2ccccc21 ZINC000878344894 1043872989 /nfs/dbraw/zinc/87/29/89/1043872989.db2.gz HNTQJJWFAFGABX-ZDUSSCGKSA-N 0 1 315.367 4.152 20 0 DIADMN CC[C@H](N[C@@H](C)c1cccc(Br)n1)c1ccncc1 ZINC000925132040 1043877963 /nfs/dbraw/zinc/87/79/63/1043877963.db2.gz WKMWISAYHVLPIX-AAEUAGOBSA-N 0 1 320.234 4.041 20 0 DIADMN Clc1ncsc1CN[C@H](C[C@@H]1CCOC1)c1ccccc1 ZINC000878367691 1043880570 /nfs/dbraw/zinc/88/05/70/1043880570.db2.gz BGYWCOBSFOPQQQ-GXTWGEPZSA-N 0 1 322.861 4.054 20 0 DIADMN COc1ccc([C@@H](C)N[C@@H](C)c2cc(C)ccc2OC)cc1O ZINC000289810010 1043881473 /nfs/dbraw/zinc/88/14/73/1043881473.db2.gz PJHRFPPTAKCNGX-KGLIPLIRSA-N 0 1 315.413 4.130 20 0 DIADMN Cc1cn[nH]c1CN[C@@H](C)c1cc(F)c(Cl)cc1Cl ZINC000289810284 1043882107 /nfs/dbraw/zinc/88/21/07/1043882107.db2.gz IUFMUYMTTANHOA-QMMMGPOBSA-N 0 1 302.180 4.015 20 0 DIADMN COC1(CN[C@H](c2cc3ccccc3o2)c2cccnc2)CCC1 ZINC000356861350 1043883236 /nfs/dbraw/zinc/88/32/36/1043883236.db2.gz ZAZRZILOHKOCNP-IBGZPJMESA-N 0 1 322.408 4.076 20 0 DIADMN CC[C@H](NC[C@H]1CC[C@@H](c2ccccc2)O1)c1nc(C)cs1 ZINC000878408066 1043885991 /nfs/dbraw/zinc/88/59/91/1043885991.db2.gz IXCTYBANSLQEBB-IKGGRYGDSA-N 0 1 316.470 4.413 20 0 DIADMN Cc1ccncc1CN[C@H]1CCSc2c(Cl)cccc21 ZINC000453320438 1043885771 /nfs/dbraw/zinc/88/57/71/1043885771.db2.gz FROLNOKSRLZHKX-HNNXBMFYSA-N 0 1 304.846 4.370 20 0 DIADMN Cc1nnsc1[C@H](C)N[C@H](C)c1cccc(C(F)(F)F)c1 ZINC000930183436 1043886544 /nfs/dbraw/zinc/88/65/44/1043886544.db2.gz PUFOETLJBCKTEI-BDAKNGLRSA-N 0 1 315.364 4.277 20 0 DIADMN CC[C@H](NC[C@@H]1CC[C@@H](c2ccccc2)O1)c1nc(C)cs1 ZINC000878408068 1043886733 /nfs/dbraw/zinc/88/67/33/1043886733.db2.gz IXCTYBANSLQEBB-ULQDDVLXSA-N 0 1 316.470 4.413 20 0 DIADMN CC[C@H](NC[C@H]1CC[C@H](c2ccccc2)O1)c1nc(C)cs1 ZINC000878408067 1043886894 /nfs/dbraw/zinc/88/68/94/1043886894.db2.gz IXCTYBANSLQEBB-IXDOHACOSA-N 0 1 316.470 4.413 20 0 DIADMN C[C@H](NCc1nccn1CC(F)F)c1cc2ccccc2s1 ZINC000878419163 1043888247 /nfs/dbraw/zinc/88/82/47/1043888247.db2.gz CTBDMYFTISLUME-NSHDSACASA-N 0 1 321.396 4.214 20 0 DIADMN Cc1nnsc1[C@H](C)N[C@@H](C)c1cccc(OC(C)C)c1 ZINC000930197775 1043890017 /nfs/dbraw/zinc/89/00/17/1043890017.db2.gz KCDPGYPSVHSGEG-RYUDHWBXSA-N 0 1 305.447 4.046 20 0 DIADMN C[C@H](NC[C@@H]1CCC2(CCC2)O1)c1ncc(-c2ccccc2)o1 ZINC000878421825 1043890319 /nfs/dbraw/zinc/89/03/19/1043890319.db2.gz DZXMQZNNPGTJQT-HOCLYGCPSA-N 0 1 312.413 4.094 20 0 DIADMN Cc1cc(C)nc(CN[C@H](C)c2ccc(OC(F)F)cc2)c1 ZINC000930196924 1043891756 /nfs/dbraw/zinc/89/17/56/1043891756.db2.gz LTOCJZWRSRCWLN-CYBMUJFWSA-N 0 1 306.356 4.151 20 0 DIADMN Cc1cccc2[nH]c(CN3CC[C@@H](O)C[C@@H]3c3ccccc3)cc21 ZINC000639372316 1043893402 /nfs/dbraw/zinc/89/34/02/1043893402.db2.gz XXQNHGRZVHBBQY-WIYYLYMNSA-N 0 1 320.436 4.174 20 0 DIADMN C[C@@H](NCc1ncccc1N(C)C)c1cccc(C(F)(F)F)c1 ZINC000289943588 1043898290 /nfs/dbraw/zinc/89/82/90/1043898290.db2.gz WDFDDZMBWPXKCC-GFCCVEGCSA-N 0 1 323.362 4.017 20 0 DIADMN C[C@H](NC[C@H]1CCC(C)(C)CO1)c1nc(C(F)(F)F)cs1 ZINC000878527017 1043898777 /nfs/dbraw/zinc/89/87/77/1043898777.db2.gz UXSYQDSERBQGMP-VHSXEESVSA-N 0 1 322.396 4.018 20 0 DIADMN C[C@@H](NC[C@H]1CCCC(C)(C)O1)c1nc(C(F)(F)F)cs1 ZINC000878526498 1043899660 /nfs/dbraw/zinc/89/96/60/1043899660.db2.gz KTMUWJFLHZQOHY-NXEZZACHSA-N 0 1 322.396 4.160 20 0 DIADMN C[C@H](NC[C@H]1CCCC(C)(C)O1)c1nc(C(F)(F)F)cs1 ZINC000878526500 1043899699 /nfs/dbraw/zinc/89/96/99/1043899699.db2.gz 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CCC[C@@H](N[C@H](CC)c1ccsc1)c1nnc2ccccn21 ZINC000453105600 1045939490 /nfs/dbraw/zinc/93/94/90/1045939490.db2.gz XFRSXWIRUXXSJP-HUUCEWRRSA-N 0 1 314.458 4.373 20 0 DIADMN CCn1cnc(CN[C@H](c2ccc(Cl)cc2)C2CCC2)c1 ZINC000902206595 1045941956 /nfs/dbraw/zinc/94/19/56/1045941956.db2.gz RFZBEUUMEYFACO-KRWDZBQOSA-N 0 1 303.837 4.187 20 0 DIADMN CC[C@H](C)Cc1noc(-c2ccc3[nH]c(C(F)F)nc3c2)n1 ZINC000632246477 1045950613 /nfs/dbraw/zinc/95/06/13/1045950613.db2.gz WEZBWEWMMKEBEA-QMMMGPOBSA-N 0 1 306.316 4.139 20 0 DIADMN C[C@H](c1cccc(Br)c1)N(C)Cc1ccc(F)nc1 ZINC001137743858 1045955313 /nfs/dbraw/zinc/95/53/13/1045955313.db2.gz COBKNCFENKPSSK-LLVKDONJSA-N 0 1 323.209 4.176 20 0 DIADMN O=C([O-])c1cc(C[N@H+]2CC[C@H](c3ccc(Cl)cc3)C2)cs1 ZINC000902253415 1045957064 /nfs/dbraw/zinc/95/70/64/1045957064.db2.gz UQDMZOBZFROLTI-ZDUSSCGKSA-N 0 1 321.829 4.089 20 0 DIADMN C[C@H]1CCSCCN1Cc1cc2ccccc2nc1Cl ZINC000192960203 1045957137 /nfs/dbraw/zinc/95/71/37/1045957137.db2.gz JOBCJRPGKWKWME-LBPRGKRZSA-N 0 1 306.862 4.216 20 0 DIADMN CC(C)(C)[C@@H]1CCC[N@@H+](Cc2ccc(/C=C\C(=O)[O-])o2)CC1 ZINC000902258143 1045957481 /nfs/dbraw/zinc/95/74/81/1045957481.db2.gz GCGIEDKOOCXNBU-QIAWRQBBSA-N 0 1 305.418 4.026 20 0 DIADMN CCCCCc1ccc(N[C@H](c2nnc[nH]2)c2ccccn2)cc1 ZINC000453175669 1045957435 /nfs/dbraw/zinc/95/74/35/1045957435.db2.gz KSWCGWDVEKGIRC-SFHVURJKSA-N 0 1 321.428 4.134 20 0 DIADMN O=C(/C=C\CCc1ccccc1)Nc1ccccc1-c1cn[nH]c1 ZINC001137760583 1045958843 /nfs/dbraw/zinc/95/88/43/1045958843.db2.gz AERZIHKZVMIXBW-QPEQYQDCSA-N 0 1 317.392 4.204 20 0 DIADMN CCCC1(C(=O)NC[C@H](c2ccc(Cl)cc2)N(C)C)CCC1 ZINC000531837143 1045958854 /nfs/dbraw/zinc/95/88/54/1045958854.db2.gz BMKGBUYCKGBBEF-MRXNPFEDSA-N 0 1 322.880 4.029 20 0 DIADMN CC(C)(CC[N@@H+](CCc1ccc(Cl)cc1)CC1CC1)C(=O)[O-] ZINC000902267841 1045959064 /nfs/dbraw/zinc/95/90/64/1045959064.db2.gz GANKVYOHXVAONN-UHFFFAOYSA-N 0 1 323.864 4.095 20 0 DIADMN C/C(=C\c1ccccc1)CN(C)C[C@H](O)c1c(F)cccc1F ZINC000755180595 1045959643 /nfs/dbraw/zinc/95/96/43/1045959643.db2.gz OIRSPLLBYQTATP-BJRSVTDJSA-N 0 1 317.379 4.034 20 0 DIADMN CCc1oc(C[N@@H+](C)C/C(C)=C\c2ccccc2)cc1C(=O)[O-] ZINC000902271086 1045961930 /nfs/dbraw/zinc/96/19/30/1045961930.db2.gz IUZOPTXPMSNIGS-UVTDQMKNSA-N 0 1 313.397 4.076 20 0 DIADMN CC(C)Oc1ccc(NC(=O)c2cn[nH]c2C(C)C)c(Cl)c1 ZINC000632678040 1045965156 /nfs/dbraw/zinc/96/51/56/1045965156.db2.gz TUOXABYAODNPOU-UHFFFAOYSA-N 0 1 321.808 4.226 20 0 DIADMN CCc1oc(C[NH2+][C@@H](CC)c2cc(F)ccc2F)cc1C(=O)[O-] ZINC000902295847 1045966916 /nfs/dbraw/zinc/96/69/16/1045966916.db2.gz IZKCVGUHIOTOTB-HNNXBMFYSA-N 0 1 323.339 4.059 20 0 DIADMN Cc1ccc(CN2CCC[C@H](C(F)F)C2)c(Br)c1 ZINC001137807336 1045971057 /nfs/dbraw/zinc/97/10/57/1045971057.db2.gz UDQQBNPXXZIXOF-LBPRGKRZSA-N 0 1 318.205 4.235 20 0 DIADMN CC[C@@H](C)c1ccc(C(=O)Nc2ccn(-c3ccncc3)n2)cc1 ZINC000755323091 1045974483 /nfs/dbraw/zinc/97/44/83/1045974483.db2.gz ZMCGCWQMRXFONI-CQSZACIVSA-N 0 1 320.396 4.033 20 0 DIADMN Clc1ccccc1C1(NCc2cccc3nsnc32)CC1 ZINC000829478873 1045978121 /nfs/dbraw/zinc/97/81/21/1045978121.db2.gz MXZSWLRENRXOEO-UHFFFAOYSA-N 0 1 315.829 4.124 20 0 DIADMN CC[C@H](NCc1cccc(C)c1Br)c1ccncc1 ZINC000453207424 1045983471 /nfs/dbraw/zinc/98/34/71/1045983471.db2.gz ASKQYEBQJDGSRC-HNNXBMFYSA-N 0 1 319.246 4.393 20 0 DIADMN CCC[N@@H+](CCc1cccs1)Cc1cc(C(=O)[O-])c(CC)o1 ZINC000902379942 1045986069 /nfs/dbraw/zinc/98/60/69/1045986069.db2.gz GHKLXBJKWFXLIN-UHFFFAOYSA-N 0 1 321.442 4.056 20 0 DIADMN CC(C)[C@H]1CCCCCN1C(=O)c1cnc(-c2ccccc2)[nH]1 ZINC001137857288 1045987599 /nfs/dbraw/zinc/98/75/99/1045987599.db2.gz SKFBZSOCYLCXLI-QGZVFWFLSA-N 0 1 311.429 4.118 20 0 DIADMN c1nc(-c2ccccc2)[nH]c1CNc1cccc2c1OCCC2 ZINC000531864082 1045989353 /nfs/dbraw/zinc/98/93/53/1045989353.db2.gz YUDJBLBDPQHHBI-UHFFFAOYSA-N 0 1 305.381 4.014 20 0 DIADMN CC[C@@H](C)C[N@@H+](CC)Cc1ccc(C(=O)[O-])cc1C(F)(F)F ZINC000902395450 1045990941 /nfs/dbraw/zinc/99/09/41/1045990941.db2.gz FBCYUTWWUJEBFE-LLVKDONJSA-N 0 1 317.351 4.272 20 0 DIADMN C[C@@H]1CCCC[N@@H+](Cc2ccc(-c3ccc(C(=O)[O-])cc3)o2)C1 ZINC000902418094 1045993838 /nfs/dbraw/zinc/99/38/38/1045993838.db2.gz NUQNFFPXWXLYLK-CQSZACIVSA-N 0 1 313.397 4.267 20 0 DIADMN CCc1oc(C[N@H+]2CC[C@@H](C)C3(CCCCC3)C2)cc1C(=O)[O-] ZINC000902437825 1045996683 /nfs/dbraw/zinc/99/66/83/1045996683.db2.gz KRBUHTBGVREZQL-CQSZACIVSA-N 0 1 319.445 4.333 20 0 DIADMN Fc1cccc(C2(NCc3cncc(C(F)(F)F)c3)CCC2)c1 ZINC000829706190 1045998511 /nfs/dbraw/zinc/99/85/11/1045998511.db2.gz AATCPOSYLCYYOA-UHFFFAOYSA-N 0 1 324.321 4.409 20 0 DIADMN CCC[N@@H+](Cc1c(F)ccc(Cl)c1F)C1CCOCC1 ZINC001137884008 1045999689 /nfs/dbraw/zinc/99/96/89/1045999689.db2.gz FQMRPPJUGABUJL-UHFFFAOYSA-N 0 1 303.780 4.009 20 0 DIADMN CCCN(Cc1c(F)ccc(Cl)c1F)C1CCOCC1 ZINC001137884008 1045999696 /nfs/dbraw/zinc/99/96/96/1045999696.db2.gz FQMRPPJUGABUJL-UHFFFAOYSA-N 0 1 303.780 4.009 20 0 DIADMN Fc1ccc([C@@H]2CCN(Cc3cc(F)c(F)cc3F)C2)cc1 ZINC001137892294 1046000618 /nfs/dbraw/zinc/00/06/18/1046000618.db2.gz NXYOEWGPJRZMFY-GFCCVEGCSA-N 0 1 309.306 4.233 20 0 DIADMN Cc1ccc(N(C)c2ccc(CN3C[C@H]4CC[C@@H](C3)O4)cc2)cc1 ZINC001137895402 1046001081 /nfs/dbraw/zinc/00/10/81/1046001081.db2.gz ZEJACXVUZJRPBR-OYRHEFFESA-N 0 1 322.452 4.126 20 0 DIADMN C[C@H](N[C@H]1CCCc2c(F)cc(F)cc21)c1cccc(O)c1 ZINC000453245220 1046002026 /nfs/dbraw/zinc/00/20/26/1046002026.db2.gz HELSATSICREYQR-VOJFVSQTSA-N 0 1 303.352 4.399 20 0 DIADMN CNc1ccccc1CN[C@H]1CCCOc2cc(Cl)ccc21 ZINC000902465904 1046002336 /nfs/dbraw/zinc/00/23/36/1046002336.db2.gz HJCJRBAWZWLHBV-KRWDZBQOSA-N 0 1 316.832 4.385 20 0 DIADMN CNc1ccc(C)cc1CN[C@@H]1CCCOc2cc(F)ccc21 ZINC000902471740 1046002814 /nfs/dbraw/zinc/00/28/14/1046002814.db2.gz RVFMZRVRQXHICN-GOSISDBHSA-N 0 1 314.404 4.179 20 0 DIADMN CCC[C@H](CN[C@@H](c1cc2ccccc2o1)c1cccnc1)OC ZINC000453248194 1046003068 /nfs/dbraw/zinc/00/30/68/1046003068.db2.gz KSFSJZQDCCDKEV-YLJYHZDGSA-N 0 1 324.424 4.322 20 0 DIADMN Cc1cn[nH]c1CSC[C@@H]1CCC[C@H](c2ccccc2)O1 ZINC000902481486 1046005188 /nfs/dbraw/zinc/00/51/88/1046005188.db2.gz PCXCVRXWRKADFB-DOTOQJQBSA-N 0 1 302.443 4.262 20 0 DIADMN COC(=O)c1csc([C@H](C)N[C@H](C)c2ccc(C)c(F)c2)c1 ZINC000453259846 1046007018 /nfs/dbraw/zinc/00/70/18/1046007018.db2.gz PIZFVQUKARHENS-NEPJUHHUSA-N 0 1 321.417 4.394 20 0 DIADMN CC(C)[C@H](N[C@@H]1C[C@@H](C)Oc2ccccc21)c1ccc(F)cn1 ZINC000453264537 1046007283 /nfs/dbraw/zinc/00/72/83/1046007283.db2.gz ADIUDUGKXRDMKP-XVSDVWIESA-N 0 1 314.404 4.420 20 0 DIADMN Cc1ccc([C@@H](NCc2csc(N)n2)C2CCCC2)cc1 ZINC000902497968 1046007907 /nfs/dbraw/zinc/00/79/07/1046007907.db2.gz CGPZBCWJODDZMN-INIZCTEOSA-N 0 1 301.459 4.055 20 0 DIADMN CC(C)C[N@@H+](Cc1ccc(-c2ccccc2C(=O)[O-])o1)C1CC1 ZINC000902511544 1046008319 /nfs/dbraw/zinc/00/83/19/1046008319.db2.gz JEAVLXAKHGXGBH-UHFFFAOYSA-N 0 1 313.397 4.265 20 0 DIADMN O=C([O-])c1ccc(C[N@H+]2CC3C[C@@H]4CC2C[C@H](C3)C4)cc1Cl ZINC000902514612 1046008595 /nfs/dbraw/zinc/00/85/95/1046008595.db2.gz HZTVDQMTLZAPGP-DGKWVBSXSA-N 0 1 319.832 4.049 20 0 DIADMN CC[N@@H+](CCC(C)(C)C(=O)[O-])[C@H](C)c1cc2ccccc2o1 ZINC000902515099 1046008970 /nfs/dbraw/zinc/00/89/70/1046008970.db2.gz PCCZPJPMHQYVFM-CYBMUJFWSA-N 0 1 303.402 4.317 20 0 DIADMN CC[C@@H](c1ccccc1)[C@H]1CCC[N@H+]1CCC(C)(C)C(=O)[O-] ZINC000902517720 1046009250 /nfs/dbraw/zinc/00/92/50/1046009250.db2.gz AGCJMPPRTCRKII-DLBZAZTESA-N 0 1 303.446 4.146 20 0 DIADMN CCc1oc(C[N@@H+](Cc2cccs2)C(C)C)cc1C(=O)[O-] ZINC000902511226 1046009519 /nfs/dbraw/zinc/00/95/19/1046009519.db2.gz HCPUGGGUFHXYIL-UHFFFAOYSA-N 0 1 307.415 4.012 20 0 DIADMN COc1ccc(Br)c(CN2CCCC3(CCC3)C2)c1 ZINC001137910841 1046009647 /nfs/dbraw/zinc/00/96/47/1046009647.db2.gz RNMGZVJLCIEXPJ-UHFFFAOYSA-N 0 1 324.262 4.224 20 0 DIADMN CC[C@@H]1C[C@@H](C)C[N@H+]1Cc1ccc(-c2ccc(C(=O)[O-])cc2)o1 ZINC000902517194 1046009914 /nfs/dbraw/zinc/00/99/14/1046009914.db2.gz BSSAUACZUQUQFY-CZUORRHYSA-N 0 1 313.397 4.265 20 0 DIADMN CC(C)[N@@H+](Cc1ccc(-c2ccccc2C(=O)[O-])o1)C1CCC1 ZINC000902522909 1046010932 /nfs/dbraw/zinc/01/09/32/1046010932.db2.gz FCSORFNYVISFBY-UHFFFAOYSA-N 0 1 313.397 4.408 20 0 DIADMN CC[C@H]1C[C@@H](C)C[N@H+]1Cc1ccc(-c2ccccc2C(=O)[O-])o1 ZINC000902519598 1046011750 /nfs/dbraw/zinc/01/17/50/1046011750.db2.gz CEHIQTDDWLFTMF-KGLIPLIRSA-N 0 1 313.397 4.265 20 0 DIADMN CCC[C@H](C)[N@@H+](C)Cc1ccc(-c2ccccc2C(=O)[O-])o1 ZINC000902524097 1046012128 /nfs/dbraw/zinc/01/21/28/1046012128.db2.gz OOLWXTAYJSKASX-ZDUSSCGKSA-N 0 1 301.386 4.265 20 0 DIADMN C[C@@H](c1ccc(Cl)cc1)[N@@H+](CCC(C)(C)C(=O)[O-])C1CC1 ZINC000902524016 1046012712 /nfs/dbraw/zinc/01/27/12/1046012712.db2.gz IXUFFDQZFCNHMB-LBPRGKRZSA-N 0 1 309.837 4.366 20 0 DIADMN O=C([O-])/C=C\c1ccc(C[N@H+]2CCC[C@@H]2CC2CCCCC2)o1 ZINC000902518229 1046012779 /nfs/dbraw/zinc/01/27/79/1046012779.db2.gz DIAQNWQAHCSNBZ-BLIJAFNYSA-N 0 1 317.429 4.312 20 0 DIADMN C[C@@H]1C[C@H]2CCCC[C@H]2[N@H+]1Cc1ccnc2c(C(=O)[O-])cccc12 ZINC000902519292 1046013069 /nfs/dbraw/zinc/01/30/69/1046013069.db2.gz URFWSIXIZBGGTJ-HBUWYVDXSA-N 0 1 324.424 4.086 20 0 DIADMN CC(C)(CC[N@@H+](CCc1cccc(F)c1)C1CCCC1)C(=O)[O-] ZINC000902526181 1046014089 /nfs/dbraw/zinc/01/40/89/1046014089.db2.gz YJXDDGZMXDTMKI-UHFFFAOYSA-N 0 1 321.436 4.114 20 0 DIADMN CC[C@@H]1CCC[C@H]1CN[C@@H](c1ncc[nH]1)c1ccc(F)cc1 ZINC000453282767 1046014303 /nfs/dbraw/zinc/01/43/03/1046014303.db2.gz IXYYVIFURJALJN-UKPHBRMFSA-N 0 1 301.409 4.054 20 0 DIADMN CC[C@H](N[C@H](C)c1nc(C)cs1)c1ccc2c(c1)CCO2 ZINC000080274913 1046014589 /nfs/dbraw/zinc/01/45/89/1046014589.db2.gz DECQTLNBGIBUNF-DOMZBBRYSA-N 0 1 302.443 4.188 20 0 DIADMN CC[C@H]1CC[C@@H](C)[N@H+]1Cc1ccc(-c2ccc(C(=O)[O-])cc2)o1 ZINC000902527837 1046014815 /nfs/dbraw/zinc/01/48/15/1046014815.db2.gz MGVHLIOXFBUDAQ-CJNGLKHVSA-N 0 1 313.397 4.408 20 0 DIADMN CCc1oc(C[N@H+](CC)[C@H](C)Cc2ccsc2)cc1C(=O)[O-] ZINC000902530601 1046015309 /nfs/dbraw/zinc/01/53/09/1046015309.db2.gz PDIHZPJVKMYSNT-GFCCVEGCSA-N 0 1 321.442 4.055 20 0 DIADMN CC(=O)c1ccc(O)c(NC(=O)CC[C@H]2CCc3ccccc32)c1 ZINC001137920868 1046015623 /nfs/dbraw/zinc/01/56/23/1046015623.db2.gz LABBFECVBZGZGE-OAHLLOKOSA-N 0 1 323.392 4.044 20 0 DIADMN O=C([O-])c1cccc(C[N@H+]2CCC[C@H]2CCC2CCCCC2)n1 ZINC000902532007 1046015596 /nfs/dbraw/zinc/01/55/96/1046015596.db2.gz YHKBRCJSXPBBMB-KRWDZBQOSA-N 0 1 316.445 4.105 20 0 DIADMN CC(C)[C@@H](C)[N@@H+](C)Cc1ccc(-c2ccc(C(=O)[O-])cc2)o1 ZINC000902526100 1046015770 /nfs/dbraw/zinc/01/57/70/1046015770.db2.gz VKHBTEULNXMGPL-CYBMUJFWSA-N 0 1 301.386 4.121 20 0 DIADMN C[C@@H]1[C@@H](C)CCC[N@H+]1Cc1ccc(-c2ccccc2C(=O)[O-])o1 ZINC000902531543 1046016253 /nfs/dbraw/zinc/01/62/53/1046016253.db2.gz VRSMPTXYSWLAPL-UONOGXRCSA-N 0 1 313.397 4.265 20 0 DIADMN C[C@@H]1CC(C)(C)C[N@H+]1Cc1ccc(C(=O)[O-])cc1C(F)(F)F ZINC000902530990 1046016296 /nfs/dbraw/zinc/01/62/96/1046016296.db2.gz BPQGESUACHTTEG-SNVBAGLBSA-N 0 1 315.335 4.024 20 0 DIADMN C[N@@H+](Cc1ccc(C(=O)[O-])o1)[C@H]1CCCC[C@H]1c1ccccc1 ZINC000902542867 1046017329 /nfs/dbraw/zinc/01/73/29/1046017329.db2.gz JQORFJKJNIXPFN-IRXDYDNUSA-N 0 1 313.397 4.136 20 0 DIADMN C[N@@H+](Cc1ccoc1C(=O)[O-])[C@H]1CCCC[C@@H]1c1ccccc1 ZINC000902541971 1046017778 /nfs/dbraw/zinc/01/77/78/1046017778.db2.gz AMNSOVPQAQNQEY-SJORKVTESA-N 0 1 313.397 4.136 20 0 DIADMN CCCC1CCC([N@@H+](C)Cc2cc(C(=O)[O-])c(CC)o2)CC1 ZINC000902536061 1046018165 /nfs/dbraw/zinc/01/81/65/1046018165.db2.gz MMCASWZDQICHIK-UHFFFAOYSA-N 0 1 307.434 4.331 20 0 DIADMN [O-]c1cccc(C[NH2+]C[C@H]2CCC[C@@H]2C2CC2)c1Br ZINC001202813115 1046018604 /nfs/dbraw/zinc/01/86/04/1046018604.db2.gz QUPAJSCKZIPGKK-TZMCWYRMSA-N 0 1 324.262 4.071 20 0 DIADMN CC(C)(CC[N@H+]1CCC[C@@]1(C)Cc1ccccc1Cl)C(=O)[O-] ZINC000902536806 1046018946 /nfs/dbraw/zinc/01/89/46/1046018946.db2.gz PKCXMTITCTUSBX-SFHVURJKSA-N 0 1 323.864 4.238 20 0 DIADMN CCOc1cccc2cc([C@@H](C)NCc3ccnc(C)c3)oc21 ZINC000453301514 1046020145 /nfs/dbraw/zinc/02/01/45/1046020145.db2.gz YXTBRCDXYFJPHP-CQSZACIVSA-N 0 1 310.397 4.386 20 0 DIADMN Cc1ccc2nc([C@@H]3CCCN3C[C@H]3CC3(Cl)Cl)[nH]c2c1 ZINC000829859430 1046021105 /nfs/dbraw/zinc/02/11/05/1046021105.db2.gz RBBSUWXSIGJBTR-RISCZKNCSA-N 0 1 324.255 4.202 20 0 DIADMN CC[C@@](C)(CN[C@H](C)c1csc(-c2ccccc2F)n1)OC ZINC000453297900 1046021326 /nfs/dbraw/zinc/02/13/26/1046021326.db2.gz IHQZXRILYAJLHM-PXAZEXFGSA-N 0 1 322.449 4.415 20 0 DIADMN CN(CCCC1CCCC1)CC(=O)Nc1ccccc1Cl ZINC000755886848 1046025111 /nfs/dbraw/zinc/02/51/11/1046025111.db2.gz DSIXRDKYIQIUBY-UHFFFAOYSA-N 0 1 308.853 4.181 20 0 DIADMN CNc1ccc(C)cc1CN[C@H](COC)c1cccc(Cl)c1 ZINC000902570595 1046025264 /nfs/dbraw/zinc/02/52/64/1046025264.db2.gz USGHHYLYDXZALA-GOSISDBHSA-N 0 1 318.848 4.167 20 0 DIADMN Cc1cccc(-c2nnc([C@@H](C)N(C)CCC(C)(C)C)o2)c1 ZINC000829928637 1046025362 /nfs/dbraw/zinc/02/53/62/1046025362.db2.gz IRVQMCBMRKDGTN-CQSZACIVSA-N 0 1 301.434 4.474 20 0 DIADMN Fc1ccc(CN2C[C@@H]3C[C@H](C2)c2ccccc23)c(F)c1F ZINC001137941628 1046028073 /nfs/dbraw/zinc/02/80/73/1046028073.db2.gz ZAVBGUYCWYHEIQ-BETUJISGSA-N 0 1 303.327 4.191 20 0 DIADMN COC[C@@H](NC[C@@H]1CCCC1(F)F)c1cccc(Cl)c1F ZINC000453314997 1046034215 /nfs/dbraw/zinc/03/42/15/1046034215.db2.gz GGDIRXVCQICSKC-GXFFZTMASA-N 0 1 321.770 4.192 20 0 DIADMN Cc1csc(CN[C@@H](C)c2nc3ccc(Cl)cc3n2C)c1 ZINC000453315616 1046034555 /nfs/dbraw/zinc/03/45/55/1046034555.db2.gz JLEQCGZEXBVKEY-NSHDSACASA-N 0 1 319.861 4.447 20 0 DIADMN Fc1c(Cl)cccc1CN1CCC[C@H]1Cc1ccccn1 ZINC001137961604 1046035355 /nfs/dbraw/zinc/03/53/55/1046035355.db2.gz ULVUITILWBMUHK-HNNXBMFYSA-N 0 1 304.796 4.081 20 0 DIADMN CNc1ccc(C)cc1CNCc1csc(C(F)(F)F)c1 ZINC000902625463 1046035496 /nfs/dbraw/zinc/03/54/96/1046035496.db2.gz FASHIUYEWWYCLH-UHFFFAOYSA-N 0 1 314.376 4.407 20 0 DIADMN Cc1nccnc1[C@H](C)N[C@@H](c1ccc(F)c(Cl)c1)C1CC1 ZINC000453320080 1046035887 /nfs/dbraw/zinc/03/58/87/1046035887.db2.gz NBGCEORSHMNHRE-APPDUMDISA-N 0 1 319.811 4.379 20 0 DIADMN C[C@@H](C1CC1)N(C(=O)c1cc2cccnc2[nH]1)c1ccccc1 ZINC000633847508 1046037300 /nfs/dbraw/zinc/03/73/00/1046037300.db2.gz GJWJCZVNNAYWOJ-ZDUSSCGKSA-N 0 1 305.381 4.008 20 0 DIADMN FC1(F)CC[C@@H]2CN(Cc3cc4ccccc4nc3Cl)C[C@@H]21 ZINC001137973852 1046040620 /nfs/dbraw/zinc/04/06/20/1046040620.db2.gz MLERVMAIZMWXLH-OCCSQVGLSA-N 0 1 322.786 4.365 20 0 DIADMN CNc1ccccc1CN[C@@H](C)c1cc(Cl)cc2c1OCC2 ZINC000902658800 1046041763 /nfs/dbraw/zinc/04/17/63/1046041763.db2.gz DBAHBLIKURWBKG-LBPRGKRZSA-N 0 1 316.832 4.167 20 0 DIADMN CC(C)(C)c1nnc(CN2CC[C@@H]([C@@H]3CCCC3(C)C)C2)o1 ZINC000830164693 1046045271 /nfs/dbraw/zinc/04/52/71/1046045271.db2.gz NKKRWUKCVUPDKL-KGLIPLIRSA-N 0 1 305.466 4.015 20 0 DIADMN CC(C)(C)c1nnc(CN2CC[C@H]([C@H]3CCCC3(C)C)C2)o1 ZINC000830164694 1046045383 /nfs/dbraw/zinc/04/53/83/1046045383.db2.gz NKKRWUKCVUPDKL-UONOGXRCSA-N 0 1 305.466 4.015 20 0 DIADMN CCn1ccnc1[C@H](C)N[C@@H](C)c1cccc(-c2ccncc2)c1 ZINC000453348749 1046049806 /nfs/dbraw/zinc/04/98/06/1046049806.db2.gz LIRZRPVHYBULMD-HOTGVXAUSA-N 0 1 320.440 4.377 20 0 DIADMN COc1ccc(F)c(CN2CCC(c3cccs3)CC2)c1 ZINC001137995031 1046050424 /nfs/dbraw/zinc/05/04/24/1046050424.db2.gz OIENTOQJNXUOAN-UHFFFAOYSA-N 0 1 305.418 4.275 20 0 DIADMN CC[C@H](C)c1ccc([C@H](N[C@H](C)c2cn(C)nn2)C(C)C)cc1 ZINC000902728951 1046052393 /nfs/dbraw/zinc/05/23/93/1046052393.db2.gz CSCBWUGLKZMADI-QMTMVMCOSA-N 0 1 314.477 4.377 20 0 DIADMN C[C@H](N[C@@H]1CCc2ccccc21)c1ccc(C(F)(F)F)cn1 ZINC000902732054 1046053776 /nfs/dbraw/zinc/05/37/76/1046053776.db2.gz VXVFGKKIKVEKCQ-MEDUHNTESA-N 0 1 306.331 4.439 20 0 DIADMN Fc1c(CN2CC[C@H](c3cccnc3)C2)cccc1C(F)(F)F ZINC001138011544 1046054822 /nfs/dbraw/zinc/05/48/22/1046054822.db2.gz YLUJCWIYACFEBY-ZDUSSCGKSA-N 0 1 324.321 4.229 20 0 DIADMN Cc1csc(CN[C@@H](CCc2cccnc2)c2ccccc2)n1 ZINC000902736718 1046057047 /nfs/dbraw/zinc/05/70/47/1046057047.db2.gz WJPCHIUGGIZKDG-SFHVURJKSA-N 0 1 323.465 4.310 20 0 DIADMN Cc1ccc(CN2CCO[C@H](c3ccccn3)C2)c2ccccc12 ZINC001138016385 1046057822 /nfs/dbraw/zinc/05/78/22/1046057822.db2.gz GHAMCUMMPIYFSM-NRFANRHFSA-N 0 1 318.420 4.117 20 0 DIADMN CCCc1ncc(CN[C@@H](CC)c2ccc(OC(F)F)cc2)o1 ZINC000453384772 1046060338 /nfs/dbraw/zinc/06/03/38/1046060338.db2.gz MYXVZDPRDRLPCE-HNNXBMFYSA-N 0 1 324.371 4.469 20 0 DIADMN COc1cccnc1CN[C@@H]1CCCc2ccc(C(C)C)cc21 ZINC000453381994 1046060481 /nfs/dbraw/zinc/06/04/81/1046060481.db2.gz YVODZRRSCYHOFS-GOSISDBHSA-N 0 1 310.441 4.381 20 0 DIADMN CC[C@H](N[C@@H](C)c1cnn(CC)c1)c1cc(Cl)ccc1OC ZINC000453381876 1046061473 /nfs/dbraw/zinc/06/14/73/1046061473.db2.gz RKZOJBOXPTTXCZ-LRDDRELGSA-N 0 1 321.852 4.367 20 0 DIADMN Cc1ccc(F)c(CN2C[C@H]3[C@H](CCC3(F)F)C2)c1Cl ZINC001138025064 1046062311 /nfs/dbraw/zinc/06/23/11/1046062311.db2.gz XPYBUWNYBPSTHW-PWSUYJOCSA-N 0 1 303.755 4.265 20 0 DIADMN COc1cccc([C@H]2C[C@H](N[C@@H](C)c3csc(C)n3)C2)c1 ZINC000453361423 1046063000 /nfs/dbraw/zinc/06/30/00/1046063000.db2.gz KUCGPYSLARFASR-CQDKDKBSSA-N 0 1 302.443 4.057 20 0 DIADMN CCC[C@@H]1CCCC[C@@H]1CN[C@H](c1ncc[nH]1)c1cccnc1 ZINC000453360888 1046064975 /nfs/dbraw/zinc/06/49/75/1046064975.db2.gz NCSWAWNMQDDUFZ-NUJGCVRESA-N 0 1 312.461 4.090 20 0 DIADMN Cc1ccc(Cl)c(CN2CC[C@H](c3cccnc3)C2)c1F ZINC001138034720 1046065857 /nfs/dbraw/zinc/06/58/57/1046065857.db2.gz QSWXOTLDYXSHMZ-AWEZNQCLSA-N 0 1 304.796 4.172 20 0 DIADMN CCc1ncc(CN[C@@H](c2cccc(C(F)(F)F)c2)C2CC2)o1 ZINC000453363903 1046066225 /nfs/dbraw/zinc/06/62/25/1046066225.db2.gz GIJHGVSSHGCMOY-MRXNPFEDSA-N 0 1 324.346 4.497 20 0 DIADMN C[C@H](N[C@H]1C[C@@H](C)n2ccnc21)c1cccc(-c2ccncc2)c1 ZINC000453379208 1046076232 /nfs/dbraw/zinc/07/62/32/1046076232.db2.gz ZZKKDRMZVIWFNR-VCBZYWHSSA-N 0 1 318.424 4.302 20 0 DIADMN C[C@@H]1CC[C@H](CN[C@@H](c2cc3ccccc3o2)c2cccnc2)O1 ZINC000453403029 1046076982 /nfs/dbraw/zinc/07/69/82/1046076982.db2.gz GQWIEZREFURZAI-WIBUTAKZSA-N 0 1 322.408 4.074 20 0 DIADMN CCCn1cc([C@@H](C)N[C@H](c2ccccc2C)C(C)(C)C)nn1 ZINC000902835718 1046083185 /nfs/dbraw/zinc/08/31/85/1046083185.db2.gz NOXKCDLBYXPNPR-CRAIPNDOSA-N 0 1 314.477 4.435 20 0 DIADMN O=C([O-])c1cccc(Cl)c1C[N@H+]1CCC[C@@H](C2CCC2)CC1 ZINC000634697986 1046087082 /nfs/dbraw/zinc/08/70/82/1046087082.db2.gz XSZJDICIMCXFEC-CQSZACIVSA-N 0 1 321.848 4.440 20 0 DIADMN Cc1cccc(C[C@]2(C)CCC[N@H+]2Cc2ccc(C(=O)[O-])cc2)c1 ZINC000634697616 1046087667 /nfs/dbraw/zinc/08/76/67/1046087667.db2.gz NGSYZWOLYDEDQI-NRFANRHFSA-N 0 1 323.436 4.290 20 0 DIADMN C[C@@H]1Cc2cn[nH]c2[C@@H](C(=O)N2CCC[C@@H](C)c3ccccc32)C1 ZINC001138106483 1046092938 /nfs/dbraw/zinc/09/29/38/1046092938.db2.gz OWSIXMRZCPSUIO-CPUCHLNUSA-N 0 1 323.440 4.006 20 0 DIADMN C[C@H]1CCc2[nH]ncc2[C@@H]1C(=O)N1CCC[C@@H](C)c2ccccc21 ZINC001138106602 1046093146 /nfs/dbraw/zinc/09/31/46/1046093146.db2.gz SRIAYVHYWTZOEB-BIENJYKASA-N 0 1 323.440 4.006 20 0 DIADMN Cc1cc2cn[nH]c2c(C(=O)N2CCC[C@H](C)c3ccccc32)c1 ZINC001138106887 1046093555 /nfs/dbraw/zinc/09/35/55/1046093555.db2.gz ZRGDYHNFWANQME-AWEZNQCLSA-N 0 1 319.408 4.415 20 0 DIADMN c1csc(-c2nc(CNCCOCC3CCCC3)cs2)c1 ZINC000453577520 1046094705 /nfs/dbraw/zinc/09/47/05/1046094705.db2.gz BJTOMARDDXYHTQ-UHFFFAOYSA-N 0 1 322.499 4.168 20 0 DIADMN C[C@@H](NCc1ccccc1N(C)C)c1ccc(C(F)(F)F)cn1 ZINC000902870646 1046096795 /nfs/dbraw/zinc/09/67/95/1046096795.db2.gz FRRKEYJPEGOWBP-GFCCVEGCSA-N 0 1 323.362 4.017 20 0 DIADMN CCOc1cccc(CNC2(c3ccc(F)cc3)CCCC2)n1 ZINC000532165432 1046108240 /nfs/dbraw/zinc/10/82/40/1046108240.db2.gz MHEIYLARDJOQKG-UHFFFAOYSA-N 0 1 314.404 4.179 20 0 DIADMN Fc1cccc(-c2nnc(C[N@H+]3CCCC[C@H]3C3CCC3)o2)c1 ZINC000830989546 1046111105 /nfs/dbraw/zinc/11/11/05/1046111105.db2.gz VXRZKVAMGXDPSR-INIZCTEOSA-N 0 1 315.392 4.030 20 0 DIADMN C[C@@H](NC1(c2ccccc2F)CC1)c1cccc(-n2ccnc2)c1 ZINC000902915413 1046111924 /nfs/dbraw/zinc/11/19/24/1046111924.db2.gz QXFKFBZMIINDGC-OAHLLOKOSA-N 0 1 321.399 4.351 20 0 DIADMN CC[C@@H](C(=O)Nc1cccc(CSC2CCCC2)c1)N(C)C ZINC000532218662 1046117047 /nfs/dbraw/zinc/11/70/47/1046117047.db2.gz HURNBDVGVAGSFQ-KRWDZBQOSA-N 0 1 320.502 4.141 20 0 DIADMN CCCCC[C@@H](C)NC(=O)CN[C@@H](C)c1cc(C)sc1C ZINC000195585699 1046123944 /nfs/dbraw/zinc/12/39/44/1046123944.db2.gz CKXMHBJXIRCIFM-OCCSQVGLSA-N 0 1 310.507 4.101 20 0 DIADMN Cc1cccc([C@@H]2CCCN2CCOc2ccccc2Cl)n1 ZINC000532238629 1046124216 /nfs/dbraw/zinc/12/42/16/1046124216.db2.gz VAIBPKSULWNFLW-KRWDZBQOSA-N 0 1 316.832 4.259 20 0 DIADMN C[C@@H](N[C@@H](CO)c1ccsc1)c1ccc(C(F)(F)F)s1 ZINC000902956236 1046127356 /nfs/dbraw/zinc/12/73/56/1046127356.db2.gz DVQRSKKMRJSHCI-SCZZXKLOSA-N 0 1 321.389 4.213 20 0 DIADMN CC(C)c1nc(CN2CC[C@@](C)(c3ccccc3)C2)cs1 ZINC000532293418 1046129080 /nfs/dbraw/zinc/12/90/80/1046129080.db2.gz WIBKAKYSKZEELL-GOSISDBHSA-N 0 1 300.471 4.430 20 0 DIADMN COc1ccc(CN2CCCC3(CCC3)C2)cc1Br ZINC001138297674 1046140251 /nfs/dbraw/zinc/14/02/51/1046140251.db2.gz MBUFUYGQDAWLIM-UHFFFAOYSA-N 0 1 324.262 4.224 20 0 DIADMN C[C@H]1CN(Cc2c3ccccc3[nH]c2C(C)(C)C)C[C@H](C)O1 ZINC001138311318 1046146216 /nfs/dbraw/zinc/14/62/16/1046146216.db2.gz ZJXHRRVZDLQECS-KBPBESRZSA-N 0 1 300.446 4.075 20 0 DIADMN CC(C)(C)c1[nH]c2ccccc2c1CN1C[C@@H]2C[C@@H]2[C@@H](F)C1 ZINC001138311269 1046146691 /nfs/dbraw/zinc/14/66/91/1046146691.db2.gz XWEJHLGESJDKNE-NOLJZWGESA-N 0 1 300.421 4.255 20 0 DIADMN Cc1ncc(CN(C)Cc2c3ccccc3[nH]c2C(C)(C)C)cn1 ZINC001138315192 1046149134 /nfs/dbraw/zinc/14/91/34/1046149134.db2.gz XOVPYCBKNQEDFF-UHFFFAOYSA-N 0 1 322.456 4.196 20 0 DIADMN CC[C@H]1COCCN1Cc1c2ccccc2[nH]c1C(C)(C)C ZINC001138314480 1046149597 /nfs/dbraw/zinc/14/95/97/1046149597.db2.gz IZIXFBDPELLNQS-AWEZNQCLSA-N 0 1 300.446 4.076 20 0 DIADMN CC(C)[C@H](N[C@H](C)c1ccc(C(C)(C)C)cc1)c1nncn1C ZINC000903061248 1046150523 /nfs/dbraw/zinc/15/05/23/1046150523.db2.gz LXHLSINRKJFEKK-PBHICJAKSA-N 0 1 314.477 4.161 20 0 DIADMN CCCCc1nc2ccc(NC(=O)c3ncc(C)cc3C)cc2[nH]1 ZINC000779865093 1046151202 /nfs/dbraw/zinc/15/12/02/1046151202.db2.gz LAUUIBQRZZHXKQ-UHFFFAOYSA-N 0 1 322.412 4.170 20 0 DIADMN Oc1cc(O)cc(CN2CCC(c3ccc(Cl)cc3)CC2)c1 ZINC001138324464 1046151172 /nfs/dbraw/zinc/15/11/72/1046151172.db2.gz OKMRFIJDADPOBS-UHFFFAOYSA-N 0 1 317.816 4.131 20 0 DIADMN CC(C)[C@H](N[C@H](C)c1ccc(C2CCC2)cc1)c1nncn1C ZINC000903065981 1046152483 /nfs/dbraw/zinc/15/24/83/1046152483.db2.gz SFKMHYOQJFGTEI-KDOFPFPSSA-N 0 1 312.461 4.131 20 0 DIADMN Cc1ccc(NC(=O)Nc2cnccc2N2CCCCC2)cc1C ZINC001202817111 1046152587 /nfs/dbraw/zinc/15/25/87/1046152587.db2.gz FRTNKMZYQPGCSC-UHFFFAOYSA-N 0 1 324.428 4.333 20 0 DIADMN CCC[C@@H](N[C@H](c1nncn1C)C(C)C)c1ccc(Cl)cc1 ZINC000903062790 1046152664 /nfs/dbraw/zinc/15/26/64/1046152664.db2.gz WYHJKMMUNVRROU-CVEARBPZSA-N 0 1 320.868 4.297 20 0 DIADMN CC(C)[C@@H](N[C@@H](C)c1ccc2ccccc2c1)c1nncn1C ZINC000903061456 1046153437 /nfs/dbraw/zinc/15/34/37/1046153437.db2.gz NZLCPNRRPCKOBA-KBXCAEBGSA-N 0 1 308.429 4.016 20 0 DIADMN CC(C)Cc1cccc([C@H](C)N[C@@H](c2nncn2C)C(C)C)c1 ZINC000903065182 1046153610 /nfs/dbraw/zinc/15/36/10/1046153610.db2.gz PPFPTXKGYLVUTE-MAUKXSAKSA-N 0 1 314.477 4.062 20 0 DIADMN Cc1nc(-c2cccc(C)c2)[nH]c1C(=O)N(C)c1ccc(C)cc1 ZINC000756965500 1046155461 /nfs/dbraw/zinc/15/54/61/1046155461.db2.gz SEPUHQLCWHXDJV-UHFFFAOYSA-N 0 1 319.408 4.279 20 0 DIADMN CCc1csc(N[C@@H](C)c2nc3ccc(Cl)cc3[nH]2)n1 ZINC000756964050 1046155916 /nfs/dbraw/zinc/15/59/16/1046155916.db2.gz NURMNNGATKRAAJ-QMMMGPOBSA-N 0 1 306.822 4.408 20 0 DIADMN CCc1csc(N[C@H](C)c2nc3ccc(Cl)cc3[nH]2)n1 ZINC000756964049 1046155967 /nfs/dbraw/zinc/15/59/67/1046155967.db2.gz NURMNNGATKRAAJ-MRVPVSSYSA-N 0 1 306.822 4.408 20 0 DIADMN CCCCCCOc1ccc(CN[C@H](C)c2cn[nH]c2)cc1 ZINC000756995148 1046157570 /nfs/dbraw/zinc/15/75/70/1046157570.db2.gz LCGCVMDUGBPROY-OAHLLOKOSA-N 0 1 301.434 4.220 20 0 DIADMN CCCCCCOc1ccc(CNCc2cc(C)ncn2)cc1 ZINC000756988992 1046157974 /nfs/dbraw/zinc/15/79/74/1046157974.db2.gz ANEOVYCMXHTIMS-UHFFFAOYSA-N 0 1 313.445 4.034 20 0 DIADMN CC(C)CN(Cc1nc2ccccc2n1C)Cc1ccccc1 ZINC001138376123 1046160358 /nfs/dbraw/zinc/16/03/58/1046160358.db2.gz LYQMFBCXCODSKM-UHFFFAOYSA-N 0 1 307.441 4.232 20 0 DIADMN C[C@@H](N[C@H](C)c1cccc(N2CCCC2)c1)c1ccns1 ZINC000925259799 1046161257 /nfs/dbraw/zinc/16/12/57/1046161257.db2.gz XHXZWRYWVARZMM-ZIAGYGMSSA-N 0 1 301.459 4.155 20 0 DIADMN Clc1cccc([C@@H](NC[C@@H]2CCCS2)c2ccccn2)c1 ZINC000925260316 1046162561 /nfs/dbraw/zinc/16/25/61/1046162561.db2.gz XUZDWHSLGLAVTC-DOTOQJQBSA-N 0 1 318.873 4.310 20 0 DIADMN COc1cccc(F)c1CN(C)CCc1cccc(Cl)c1 ZINC001138385392 1046162510 /nfs/dbraw/zinc/16/25/10/1046162510.db2.gz OZGWNOXLUUWNHF-UHFFFAOYSA-N 0 1 307.796 4.162 20 0 DIADMN Cc1cc(CN[C@@H](C)c2ccc(C(F)(F)F)s2)ccn1 ZINC000717963130 1046163087 /nfs/dbraw/zinc/16/30/87/1046163087.db2.gz RWPFKRVZAYRWRM-JTQLQIEISA-N 0 1 300.349 4.321 20 0 DIADMN Cc1cccc(CN[C@H](C)c2ccc(C(F)(F)F)s2)n1 ZINC000718013748 1046163401 /nfs/dbraw/zinc/16/34/01/1046163401.db2.gz MKCAORXEZVBYOY-SNVBAGLBSA-N 0 1 300.349 4.321 20 0 DIADMN Clc1cccc([C@@H](NC[C@H]2CCCS2)c2ccccn2)c1 ZINC000925260318 1046163593 /nfs/dbraw/zinc/16/35/93/1046163593.db2.gz XUZDWHSLGLAVTC-NVXWUHKLSA-N 0 1 318.873 4.310 20 0 DIADMN Cc1ccncc1CN[C@@H](C)c1ccc(C(F)(F)F)s1 ZINC000718011346 1046163632 /nfs/dbraw/zinc/16/36/32/1046163632.db2.gz CQYNAUFYWHWNCF-JTQLQIEISA-N 0 1 300.349 4.321 20 0 DIADMN CC(=O)OCc1cccc([C@H](C)NCc2c(C)cccc2F)c1 ZINC000903103562 1046164003 /nfs/dbraw/zinc/16/40/03/1046164003.db2.gz JVUVYMURWMUWDZ-AWEZNQCLSA-N 0 1 315.388 4.048 20 0 DIADMN Cc1c2ccccc2[nH]c1CN1CCN(c2ccc(C)cc2)CC1 ZINC001138397511 1046164656 /nfs/dbraw/zinc/16/46/56/1046164656.db2.gz VOXSIJAYAQXGKL-UHFFFAOYSA-N 0 1 319.452 4.107 20 0 DIADMN CSCc1cc(F)ccc1CN[C@@H](c1ccccn1)C1CC1 ZINC000903108642 1046165038 /nfs/dbraw/zinc/16/50/38/1046165038.db2.gz ABZFFFMZCTXLAV-GOSISDBHSA-N 0 1 316.445 4.325 20 0 DIADMN COc1cc(CN(C)Cc2[nH]c3ccccc3c2C)cc(OC)c1 ZINC001138403516 1046166634 /nfs/dbraw/zinc/16/66/34/1046166634.db2.gz PXTMXWDDDFYIAL-UHFFFAOYSA-N 0 1 324.424 4.126 20 0 DIADMN c1ccc([C@H](NCc2ccccc2OC2CCC2)C2CC2)nc1 ZINC000903121811 1046167619 /nfs/dbraw/zinc/16/76/19/1046167619.db2.gz SVLRCEBKMHKGBZ-HXUWFJFHSA-N 0 1 308.425 4.254 20 0 DIADMN Cc1nc(C(C)(C)NCc2cccc3ncccc23)sc1C ZINC000634963106 1046167922 /nfs/dbraw/zinc/16/79/22/1046167922.db2.gz KBVCYGVBXGJIHB-UHFFFAOYSA-N 0 1 311.454 4.333 20 0 DIADMN CC/C(C)=C(\C)C(=O)Nc1ccc2nc(-c3ccccn3)[nH]c2c1 ZINC000779933198 1046170006 /nfs/dbraw/zinc/17/00/06/1046170006.db2.gz HSYVRAGITDDQKA-OUKQBFOZSA-N 0 1 320.396 4.310 20 0 DIADMN CC(C)(C)Oc1ccc(CN[C@H](c2ccccn2)C2CC2)cc1 ZINC000903135624 1046171154 /nfs/dbraw/zinc/17/11/54/1046171154.db2.gz KLOHTRIFARQALM-IBGZPJMESA-N 0 1 310.441 4.500 20 0 DIADMN Cc1ccc2[nH]c(CN3CC[C@@H]3COCc3ccccc3)cc2c1 ZINC001138415724 1046171803 /nfs/dbraw/zinc/17/18/03/1046171803.db2.gz JHHIFINFEOHILH-HXUWFJFHSA-N 0 1 320.436 4.267 20 0 DIADMN Cc1c2cc(F)ccc2[nH]c1CN1CCC[C@H](C(F)(F)F)C1 ZINC001138413239 1046172955 /nfs/dbraw/zinc/17/29/55/1046172955.db2.gz RCDMQVRVWWZWMM-NSHDSACASA-N 0 1 314.326 4.390 20 0 DIADMN Cc1ncsc1CN[C@@H](C)c1cc(Cl)c(N)c(Cl)c1 ZINC000760161731 1046180684 /nfs/dbraw/zinc/18/06/84/1046180684.db2.gz ZQAQYEZDYXLWLC-ZETCQYMHSA-N 0 1 316.257 4.191 20 0 DIADMN C[C@@H](Cc1ccc(Cl)cc1)NCC(=O)c1ccc(F)cc1F ZINC001168153468 1046184157 /nfs/dbraw/zinc/18/41/57/1046184157.db2.gz JCWRHSPDMQQVOU-NSHDSACASA-N 0 1 323.770 4.022 20 0 DIADMN Cc1cccc([C@H](O)CNCc2ccc(Oc3ccccc3)o2)c1 ZINC000779978096 1046184879 /nfs/dbraw/zinc/18/48/79/1046184879.db2.gz QVLDCIHPXZHNFW-LJQANCHMSA-N 0 1 323.392 4.204 20 0 DIADMN COc1ccc(Cl)c2c1CCC[C@H]2NCc1cnccc1C ZINC000903177726 1046184966 /nfs/dbraw/zinc/18/49/66/1046184966.db2.gz AJBYRWOZVXYYAB-MRXNPFEDSA-N 0 1 316.832 4.219 20 0 DIADMN CCc1nc(C)c([C@@H](C)NCc2nccc3c2CCCC3)s1 ZINC000903183341 1046185089 /nfs/dbraw/zinc/18/50/89/1046185089.db2.gz BTIHXHAYJVLPLO-GFCCVEGCSA-N 0 1 315.486 4.139 20 0 DIADMN COc1ccc2c(c1Cl)[C@@H](NCc1ccnc(C)c1)CCC2 ZINC000903177081 1046185599 /nfs/dbraw/zinc/18/55/99/1046185599.db2.gz HICXNSXXDSFKEF-HNNXBMFYSA-N 0 1 316.832 4.219 20 0 DIADMN Fc1cc2c(c(F)c1)CC[C@H]2NCc1nccc2c1CCCC2 ZINC000903183667 1046187210 /nfs/dbraw/zinc/18/72/10/1046187210.db2.gz FCBGFCRCGHGAHE-GOSISDBHSA-N 0 1 314.379 4.016 20 0 DIADMN CC(C)=C(C)CC(=O)Nc1ccccc1-c1nnc(C(C)C)[nH]1 ZINC000635407451 1046188015 /nfs/dbraw/zinc/18/80/15/1046188015.db2.gz VMAHVPVIWQPKDU-UHFFFAOYSA-N 0 1 312.417 4.280 20 0 DIADMN C[C@@H]1C[C@@H](C)[C@H](C)N(Cc2nnc(-c3ccccc3)s2)C1 ZINC000475736322 1046188679 /nfs/dbraw/zinc/18/86/79/1046188679.db2.gz YOIRHDGTPLFHHW-MCIONIFRSA-N 0 1 301.459 4.072 20 0 DIADMN C[C@@H]1C[C@H](C)[C@@H](C)N(Cc2nc3ccccc3n2C(F)F)C1 ZINC000475730627 1046188740 /nfs/dbraw/zinc/18/87/40/1046188740.db2.gz LEOFYOUONGBKJW-FRRDWIJNSA-N 0 1 307.388 4.298 20 0 DIADMN C[C@@H](N1CCN(CCC2C[C@H](C)C[C@@H](C)C2)CC1)C(F)(F)F ZINC001307506347 1046189013 /nfs/dbraw/zinc/18/90/13/1046189013.db2.gz RCMAEMQSAJSEEQ-RBSFLKMASA-N 0 1 320.443 4.017 20 0 DIADMN CC[C@@H](NCc1cc(N(C)C)ccn1)c1sccc1Cl ZINC000903196880 1046190820 /nfs/dbraw/zinc/19/08/20/1046190820.db2.gz GNUMDCNYPSOPJN-CQSZACIVSA-N 0 1 309.866 4.103 20 0 DIADMN CSc1ccc(F)cc1CN[C@H](C)c1ccc(Cl)nc1 ZINC000760171738 1046193320 /nfs/dbraw/zinc/19/33/20/1046193320.db2.gz YXAVQYINANWDHP-SNVBAGLBSA-N 0 1 310.825 4.447 20 0 DIADMN COc1ccc(C[N@H+]2CC[C@H](c3ccc(F)cc3)C2)cc1Cl ZINC001138475440 1046193446 /nfs/dbraw/zinc/19/34/46/1046193446.db2.gz NQBZVBLXURENDK-HNNXBMFYSA-N 0 1 319.807 4.477 20 0 DIADMN COc1ccc(C[N@H+]2CCCC3(CC(F)C3)CC2)cc1Cl ZINC001138475436 1046193498 /nfs/dbraw/zinc/19/34/98/1046193498.db2.gz NPWPGSCQNGXTNS-UHFFFAOYSA-N 0 1 311.828 4.453 20 0 DIADMN C[C@@H](N[C@H](c1ccccn1)C1CCC1)c1cnn(CC2CCC2)c1 ZINC000903207590 1046194690 /nfs/dbraw/zinc/19/46/90/1046194690.db2.gz UDMSZEYJCOMWOC-QRWLVFNGSA-N 0 1 324.472 4.270 20 0 DIADMN Cc1ccc(CNCc2cn3cccc(F)c3n2)c2ccccc12 ZINC001202834273 1046198890 /nfs/dbraw/zinc/19/88/90/1046198890.db2.gz WGCAKOPLRZXQRY-UHFFFAOYSA-N 0 1 319.383 4.225 20 0 DIADMN COc1ccc([C@@H](C)N[C@@H](C)c2nc3ccccc3n2C)cc1C ZINC000903233210 1046199694 /nfs/dbraw/zinc/19/96/94/1046199694.db2.gz DICXMPPDKZQSRV-CABCVRRESA-N 0 1 323.440 4.302 20 0 DIADMN CC(C)C[C@@H](NCc1c[nH]c(=O)c2ccccc12)c1ccccn1 ZINC000903231728 1046200259 /nfs/dbraw/zinc/20/02/59/1046200259.db2.gz PBTJKCROVOXLMB-LJQANCHMSA-N 0 1 321.424 4.212 20 0 DIADMN CN(C)c1ccc(CN2CCSC[C@H]2c2ccccc2)s1 ZINC001138494427 1046200573 /nfs/dbraw/zinc/20/05/73/1046200573.db2.gz UMQINBYSYIBOJC-INIZCTEOSA-N 0 1 318.511 4.104 20 0 DIADMN C[C@@H](NCc1cnn(CC2CCC2)c1)c1coc2ccccc12 ZINC000903239741 1046204536 /nfs/dbraw/zinc/20/45/36/1046204536.db2.gz KFEIGLUZYAPVGG-CQSZACIVSA-N 0 1 309.413 4.280 20 0 DIADMN CC(C)N(Cc1ccnn1CC1CCC1)Cc1ccc(F)cc1 ZINC001204697017 1046205398 /nfs/dbraw/zinc/20/53/98/1046205398.db2.gz JGETVELVKRDDFO-UHFFFAOYSA-N 0 1 315.436 4.233 20 0 DIADMN C[C@H](NCc1cnn(CC2CCC2)c1)c1csc(Cl)c1 ZINC000903239919 1046205488 /nfs/dbraw/zinc/20/54/88/1046205488.db2.gz MRUMKSQMEOHQFF-NSHDSACASA-N 0 1 309.866 4.249 20 0 DIADMN COc1ccc(-c2ccc(CN(C)Cc3ccccn3)cc2)cc1 ZINC001138515427 1046209218 /nfs/dbraw/zinc/20/92/18/1046209218.db2.gz PAFAUCFHVSNGPX-UHFFFAOYSA-N 0 1 318.420 4.389 20 0 DIADMN CCN(CC)Cc1ccc(C(=O)Nc2ccc(F)c(Cl)c2)o1 ZINC000055544156 1046209668 /nfs/dbraw/zinc/20/96/68/1046209668.db2.gz HXUDUFSUWHZXKG-UHFFFAOYSA-N 0 1 324.783 4.166 20 0 DIADMN Cc1cccc([C@H](NC[C@@H]2CC[C@@H](C3CC3)O2)c2ccccn2)c1 ZINC000903253810 1046211229 /nfs/dbraw/zinc/21/12/29/1046211229.db2.gz RSSLLRPLCXZQOJ-JBACZVJFSA-N 0 1 322.452 4.027 20 0 DIADMN CC(C)c1cc([C@@H]2CCCN(C(=O)[C@H]3CC[C@H](C)CC3)C2)n[nH]1 ZINC000831879814 1046214628 /nfs/dbraw/zinc/21/46/28/1046214628.db2.gz NMTSZCOUQQWNSW-BZUAXINKSA-N 0 1 317.477 4.065 20 0 DIADMN CC(C)c1cc([C@@H]2CCCN(C(=O)[C@@H]3CCCC3(C)C)C2)n[nH]1 ZINC000831897802 1046216980 /nfs/dbraw/zinc/21/69/80/1046216980.db2.gz CXRHIVVYEALCLR-CABCVRRESA-N 0 1 317.477 4.065 20 0 DIADMN CCc1noc(C)c1CN1CC=C(c2c[nH]c3ccccc32)CC1 ZINC000757822366 1046217684 /nfs/dbraw/zinc/21/76/84/1046217684.db2.gz WFXIXJFXSNYGFE-UHFFFAOYSA-N 0 1 321.424 4.316 20 0 DIADMN C[C@@H](NCc1cnn(CCF)c1)c1cc(Cl)cc(Cl)c1 ZINC000903274366 1046218795 /nfs/dbraw/zinc/21/87/95/1046218795.db2.gz WQQKDRCNFOZAJS-SNVBAGLBSA-N 0 1 316.207 4.010 20 0 DIADMN COc1cc(CN2CCCC[C@](C)(F)C2)ccc1OC(F)F ZINC001138550760 1046221520 /nfs/dbraw/zinc/22/15/20/1046221520.db2.gz GUHQEHZIVBKGEQ-INIZCTEOSA-N 0 1 317.351 4.011 20 0 DIADMN CSC(C)(C)C[C@H](C)NC1(c2ccc(Cl)cc2)COC1 ZINC001258324834 1046222211 /nfs/dbraw/zinc/22/22/11/1046222211.db2.gz XQFIAKOPQUEPKB-LBPRGKRZSA-N 0 1 313.894 4.075 20 0 DIADMN Cc1cc(C)c([C@H](C)OC(=O)[C@@H]2CCCc3[nH]ncc32)c(C)c1 ZINC000757881131 1046222523 /nfs/dbraw/zinc/22/25/23/1046222523.db2.gz NDWIZTIIFHSILZ-LSDHHAIUSA-N 0 1 312.413 4.059 20 0 DIADMN CC[C@@]1(C)CCN([C@H](C)c2nc(-c3ccc(F)c(C)c3)no2)C1 ZINC001168165298 1046224361 /nfs/dbraw/zinc/22/43/61/1046224361.db2.gz XDXDJYZLALLHMQ-ACJLOTCBSA-N 0 1 317.408 4.367 20 0 DIADMN CC(C)c1cc([C@@H]2CCCN(C(=O)CCC3CCCC3)C2)n[nH]1 ZINC000831926376 1046224669 /nfs/dbraw/zinc/22/46/69/1046224669.db2.gz VDOZJNPPRKLVEV-MRXNPFEDSA-N 0 1 317.477 4.210 20 0 DIADMN Fc1ccccc1C=C1CCN(C[C@@H]2CC[C@H](C3CC3)O2)CC1 ZINC001168165277 1046224643 /nfs/dbraw/zinc/22/46/43/1046224643.db2.gz WUONVESDDXTJCY-AZUAARDMSA-N 0 1 315.432 4.263 20 0 DIADMN CC(C)c1cc([C@@H]2CCCN(C(=O)CC3CCCCC3)C2)n[nH]1 ZINC000831919083 1046225409 /nfs/dbraw/zinc/22/54/09/1046225409.db2.gz KDHZLFLVYWLXIS-MRXNPFEDSA-N 0 1 317.477 4.210 20 0 DIADMN Cc1nc([C@H](C)N[C@H]2C[C@H](c3ccc(F)cc3F)C2)cs1 ZINC000903296161 1046228295 /nfs/dbraw/zinc/22/82/95/1046228295.db2.gz GTKXWNSMOBWRLB-GAFUQQFSSA-N 0 1 308.397 4.327 20 0 DIADMN c1ncn(Cc2ccccc2)c1CN1CCC[C@@H]2CCCC[C@H]21 ZINC001138563142 1046228335 /nfs/dbraw/zinc/22/83/35/1046228335.db2.gz FYSXNSHEVGOISJ-AZUAARDMSA-N 0 1 309.457 4.086 20 0 DIADMN O=C(O[C@H]1CCc2cc(Cl)ccc21)c1c(F)cc(O)cc1F ZINC000803358731 1046228659 /nfs/dbraw/zinc/22/86/59/1046228659.db2.gz VCRHLMLZKLSOSL-AWEZNQCLSA-N 0 1 324.710 4.168 20 0 DIADMN Cc1ccc(OC(F)F)c([C@H](C)N[C@@H](C)c2cncs2)c1 ZINC000903310528 1046232668 /nfs/dbraw/zinc/23/26/68/1046232668.db2.gz KKYNSFVSJHHHDY-QWRGUYRKSA-N 0 1 312.385 4.465 20 0 DIADMN COc1cc(Cl)cc(CN2CCC[C@@H]3CCC[C@@H]32)c1OC ZINC001138745430 1046233866 /nfs/dbraw/zinc/23/38/66/1046233866.db2.gz 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FC(F)(F)[C@@H]1CCN(Cc2ccc(Cl)c3cccnc23)C1 ZINC000677716161 1046513435 /nfs/dbraw/zinc/51/34/35/1046513435.db2.gz OFSNJEUOGPGQOZ-LLVKDONJSA-N 0 1 314.738 4.272 20 0 DIADMN CC[C@@H](C)c1ccccc1NC(=O)[C@@H](C)N1CCC2(CC2)CC1 ZINC000677717212 1046515304 /nfs/dbraw/zinc/51/53/04/1046515304.db2.gz GVBRJCHMTCEHRF-HZPDHXFCSA-N 0 1 314.473 4.403 20 0 DIADMN CC[C@@H](C)c1ccccc1NC(=O)[C@H](C)N1CCC2(CC2)CC1 ZINC000677717204 1046515348 /nfs/dbraw/zinc/51/53/48/1046515348.db2.gz GVBRJCHMTCEHRF-CVEARBPZSA-N 0 1 314.473 4.403 20 0 DIADMN Fc1ccc(-c2nc(CN3CCC4(CC4)CC3)cs2)cc1 ZINC000677718480 1046515710 /nfs/dbraw/zinc/51/57/10/1046515710.db2.gz CHPFRJWJKLVCSY-UHFFFAOYSA-N 0 1 302.418 4.325 20 0 DIADMN C[C@H](c1nnc(-c2cccc(Cl)c2)o1)N1CCC2(CC2)CC1 ZINC000677717338 1046515877 /nfs/dbraw/zinc/51/58/77/1046515877.db2.gz INLVQLUSKXELIS-GFCCVEGCSA-N 0 1 317.820 4.327 20 0 DIADMN FC(F)(F)c1cnc(CNC23CC(c4ccccc4)(C2)C3)s1 ZINC000641790727 1046516255 /nfs/dbraw/zinc/51/62/55/1046516255.db2.gz RZLUMEXOGCPEEV-UHFFFAOYSA-N 0 1 324.371 4.126 20 0 DIADMN Cc1ccc(-c2cc(CN3CC[C@@H](C(F)(F)F)C3)on2)cc1 ZINC000677716856 1046516353 /nfs/dbraw/zinc/51/63/53/1046516353.db2.gz ZIEQCONZSNTBTO-CYBMUJFWSA-N 0 1 310.319 4.034 20 0 DIADMN FC1(F)CC2(CN(CCCOc3ccc4ccccc4c3)C2)C1 ZINC000677734104 1046517694 /nfs/dbraw/zinc/51/76/94/1046517694.db2.gz SJHCNABJNGQQOI-UHFFFAOYSA-N 0 1 317.379 4.340 20 0 DIADMN COc1ccc(CN(C)Cc2ccccc2C(F)F)c(OC)c1 ZINC001139799367 1046518081 /nfs/dbraw/zinc/51/80/81/1046518081.db2.gz OGNIDNNQQGFVET-UHFFFAOYSA-N 0 1 321.367 4.273 20 0 DIADMN CN(Cc1ccc(OC(F)(F)F)cc1)Cc1cccc(F)c1 ZINC000641850308 1046518853 /nfs/dbraw/zinc/51/88/53/1046518853.db2.gz GCYLFTCEXYUCHP-UHFFFAOYSA-N 0 1 313.294 4.356 20 0 DIADMN CN(CCC(=O)c1cccs1)Cc1ccccc1C(F)F ZINC001139800299 1046519651 /nfs/dbraw/zinc/51/96/51/1046519651.db2.gz JHLMDLUSHHOGGT-UHFFFAOYSA-N 0 1 309.381 4.391 20 0 DIADMN Cc1cccn2cc(CN3CCC(c4ccccc4)CC3)nc12 ZINC000641863832 1046520094 /nfs/dbraw/zinc/52/00/94/1046520094.db2.gz RXUXIGLGUKJCKO-UHFFFAOYSA-N 0 1 305.425 4.022 20 0 DIADMN Cc1ncc([C@H](C)NCc2cnc(-c3ccccc3)s2)s1 ZINC000677756505 1046525190 /nfs/dbraw/zinc/52/51/90/1046525190.db2.gz CFIIFCJCHUVGER-NSHDSACASA-N 0 1 315.467 4.426 20 0 DIADMN COCc1ccc(CN2CCC[C@@H]2c2cccc(F)c2)s1 ZINC001139826976 1046526345 /nfs/dbraw/zinc/52/63/45/1046526345.db2.gz IYKKHEOBHGYJAF-QGZVFWFLSA-N 0 1 305.418 4.371 20 0 DIADMN COCc1ccc(CN2CCC[C@H]2c2cccc(F)c2)s1 ZINC001139826975 1046526437 /nfs/dbraw/zinc/52/64/37/1046526437.db2.gz IYKKHEOBHGYJAF-KRWDZBQOSA-N 0 1 305.418 4.371 20 0 DIADMN CN(C)c1ccc(CN(C)Cc2ccc(Cl)c(Cl)c2)cn1 ZINC000677802355 1046527470 /nfs/dbraw/zinc/52/74/70/1046527470.db2.gz ORWQYXQCLIBSDX-UHFFFAOYSA-N 0 1 324.255 4.086 20 0 DIADMN C[C@H]1SCCN(Cc2cc(Cl)nc3ccccc23)[C@@H]1C ZINC000782499765 1046530109 /nfs/dbraw/zinc/53/01/09/1046530109.db2.gz VMTNLAYBRNWRIO-VXGBXAGGSA-N 0 1 306.862 4.214 20 0 DIADMN CCC[C@H](NCc1cc2cc(OC)ccc2o1)c1ccccn1 ZINC000677849425 1046530216 /nfs/dbraw/zinc/53/02/16/1046530216.db2.gz XXBLQMHYQUZWLF-KRWDZBQOSA-N 0 1 310.397 4.467 20 0 DIADMN Cc1ccc(CN2CCC(Oc3ccc(Cl)cc3)CC2)nc1 ZINC001139839684 1046530290 /nfs/dbraw/zinc/53/02/90/1046530290.db2.gz OQQOCAOOLWVPSZ-UHFFFAOYSA-N 0 1 316.832 4.087 20 0 DIADMN CN(Cc1cncnc1)Cc1cccc2c3ccccc3sc21 ZINC001139843957 1046532582 /nfs/dbraw/zinc/53/25/82/1046532582.db2.gz PKWXOMLLUWJIEI-UHFFFAOYSA-N 0 1 319.433 4.477 20 0 DIADMN CC(C)CO[C@@H]1CCN(Cc2cc(Cl)nc3ccccc23)C1 ZINC000782509717 1046532627 /nfs/dbraw/zinc/53/26/27/1046532627.db2.gz AKCFNHWOBNVEKN-OAHLLOKOSA-N 0 1 318.848 4.135 20 0 DIADMN Clc1cc(CN[C@H](c2cccnc2)C2CC2)cc(Cl)n1 ZINC000782532399 1046534364 /nfs/dbraw/zinc/53/43/64/1046534364.db2.gz ZAKAXALMRSPFCE-HNNXBMFYSA-N 0 1 308.212 4.024 20 0 DIADMN COc1ccc(CN2CCC[C@H]2c2ccc(O)cc2)cc1Cl ZINC000677893534 1046534769 /nfs/dbraw/zinc/53/47/69/1046534769.db2.gz RJNWBDPSLNYVKX-KRWDZBQOSA-N 0 1 317.816 4.391 20 0 DIADMN Fc1ccc(Br)c(CNc2ccc3c[nH]nc3c2)c1 ZINC000236274952 1046535092 /nfs/dbraw/zinc/53/50/92/1046535092.db2.gz JMTXNBHWBMMLOQ-UHFFFAOYSA-N 0 1 320.165 4.077 20 0 DIADMN C[C@H]1C[N@@H+](Cc2cccc3c4ccccc4oc32)CCCC1=O ZINC001139858215 1046535295 /nfs/dbraw/zinc/53/52/95/1046535295.db2.gz ZQJWLZCPVKGOBH-AWEZNQCLSA-N 0 1 307.393 4.387 20 0 DIADMN CCc1ccc([C@@H](C)N[C@H](CC)c2ccc3c(c2)OCCO3)o1 ZINC000133454332 1046538372 /nfs/dbraw/zinc/53/83/72/1046538372.db2.gz UMPJMSGNDLZHFN-CZUORRHYSA-N 0 1 315.413 4.415 20 0 DIADMN Cc1[nH]nc(CNc2ccc(OCCC(C)C)c(F)c2)c1C ZINC001202979747 1046542077 /nfs/dbraw/zinc/54/20/77/1046542077.db2.gz JTZAHCLQFSFXAV-UHFFFAOYSA-N 0 1 305.397 4.203 20 0 DIADMN COc1cc2c(cc1OC)CN(Cc1ccccc1C1CC1)CC2 ZINC001139882557 1046542698 /nfs/dbraw/zinc/54/26/98/1046542698.db2.gz NDBFJBNEGYBFJB-UHFFFAOYSA-N 0 1 323.436 4.140 20 0 DIADMN Cc1ccc(C(F)(F)F)cc1CN1CC[C@H](C(F)(F)F)C1 ZINC001139886066 1046544112 /nfs/dbraw/zinc/54/41/12/1046544112.db2.gz XZJJZRGVHDOUDT-LBPRGKRZSA-N 0 1 311.269 4.398 20 0 DIADMN Cc1ccc(C(F)(F)F)cc1C[N@H+]1CC[C@H]2CCCO[C@H]2C1 ZINC001139887763 1046544335 /nfs/dbraw/zinc/54/43/35/1046544335.db2.gz FLDCFXVUQKXKKQ-CJNGLKHVSA-N 0 1 313.363 4.015 20 0 DIADMN Cc1ccc(C(F)(F)F)cc1CN1CC[C@H]2CCCO[C@H]2C1 ZINC001139887763 1046544349 /nfs/dbraw/zinc/54/43/49/1046544349.db2.gz FLDCFXVUQKXKKQ-CJNGLKHVSA-N 0 1 313.363 4.015 20 0 DIADMN CCO[C@H]1CCCN(Cc2cc(C(F)(F)F)ccc2C)C1 ZINC001139885387 1046545677 /nfs/dbraw/zinc/54/56/77/1046545677.db2.gz ORUVFUIRQAXHDX-HNNXBMFYSA-N 0 1 301.352 4.015 20 0 DIADMN Cc1ccc(C(F)(F)F)cc1C[N@@H+]1CC[C@@H](OC(C)C)C1 ZINC001139886303 1046545802 /nfs/dbraw/zinc/54/58/02/1046545802.db2.gz FHRIJASSWDEWKY-OAHLLOKOSA-N 0 1 301.352 4.013 20 0 DIADMN Cc1ccc(C(F)(F)F)cc1CN1CC[C@@H](OC(C)C)C1 ZINC001139886303 1046545810 /nfs/dbraw/zinc/54/58/10/1046545810.db2.gz FHRIJASSWDEWKY-OAHLLOKOSA-N 0 1 301.352 4.013 20 0 DIADMN CCO[C@@H]1CCCN(Cc2cc(C(F)(F)F)ccc2C)C1 ZINC001139885388 1046546187 /nfs/dbraw/zinc/54/61/87/1046546187.db2.gz ORUVFUIRQAXHDX-OAHLLOKOSA-N 0 1 301.352 4.015 20 0 DIADMN Fc1ccc(CN2CCC[C@H]2c2cnccn2)c2ccccc12 ZINC001139891166 1046547419 /nfs/dbraw/zinc/54/74/19/1046547419.db2.gz RYIVKWFNZSEDFO-IBGZPJMESA-N 0 1 307.372 4.106 20 0 DIADMN CN(CCC(=O)c1cccs1)Cc1cncc2ccccc21 ZINC001139896897 1046550751 /nfs/dbraw/zinc/55/07/51/1046550751.db2.gz PQDBCKFJXITZDK-UHFFFAOYSA-N 0 1 310.422 4.001 20 0 DIADMN C[C@@H](c1ccccc1Cl)N(C)Cc1ccc2cnn(C)c2c1 ZINC001139911039 1046552558 /nfs/dbraw/zinc/55/25/58/1046552558.db2.gz GVZOLZHNADQSIL-ZDUSSCGKSA-N 0 1 313.832 4.420 20 0 DIADMN CCOc1cc(C)ccc1CN[C@H](C)c1ccc(Cl)nc1 ZINC000179139311 1046553638 /nfs/dbraw/zinc/55/36/38/1046553638.db2.gz SPBIFLAOTBAGAR-CYBMUJFWSA-N 0 1 304.821 4.293 20 0 DIADMN CC(C)(C)Oc1cccc(CNCc2ccccc2C2CC2)n1 ZINC000678078434 1046553987 /nfs/dbraw/zinc/55/39/87/1046553987.db2.gz ZBEAKTVDLQKEQD-UHFFFAOYSA-N 0 1 310.441 4.426 20 0 DIADMN COc1cccc2c1OCC[C@H]2NCc1ccc(C(C)C)cc1 ZINC001202985558 1046554265 /nfs/dbraw/zinc/55/42/65/1046554265.db2.gz IZUOAOBCQRTJMN-GOSISDBHSA-N 0 1 311.425 4.432 20 0 DIADMN CSC[C@@H]1CCCN1Cc1nc(-c2ccsc2)oc1C ZINC000135473066 1046555468 /nfs/dbraw/zinc/55/54/68/1046555468.db2.gz LBCIREDQSWTDHW-ZDUSSCGKSA-N 0 1 308.472 4.039 20 0 DIADMN c1coc(CN(Cc2cccs2)Cc2[nH]nc3ccccc32)c1 ZINC000678122493 1046556627 /nfs/dbraw/zinc/55/66/27/1046556627.db2.gz QFTICHRJVDIZTJ-UHFFFAOYSA-N 0 1 323.421 4.420 20 0 DIADMN CC(C)CCN(Cc1nc(-c2cccc(Cl)c2)no1)C1CC1 ZINC000642094152 1046561017 /nfs/dbraw/zinc/56/10/17/1046561017.db2.gz VYFGCGOAAYZXJI-UHFFFAOYSA-N 0 1 319.836 4.401 20 0 DIADMN CCOc1ccc(CN(Cc2ccc(C)o2)C2CC2)cc1OC ZINC000678134864 1046561301 /nfs/dbraw/zinc/56/13/01/1046561301.db2.gz AQDKFMYVDLRSQJ-UHFFFAOYSA-N 0 1 315.413 4.160 20 0 DIADMN CN(Cc1csc2ccccc12)Cc1n[nH]c2ccccc21 ZINC000678133259 1046562464 /nfs/dbraw/zinc/56/24/64/1046562464.db2.gz XMHAHQJYYONNGM-UHFFFAOYSA-N 0 1 307.422 4.410 20 0 DIADMN CN(Cc1csc2ccccc12)Cc1[nH]nc2ccccc21 ZINC000678133259 1046562474 /nfs/dbraw/zinc/56/24/74/1046562474.db2.gz XMHAHQJYYONNGM-UHFFFAOYSA-N 0 1 307.422 4.410 20 0 DIADMN CN(CCc1c(F)cccc1Cl)Cc1cc(Cl)cn1C ZINC001307534711 1046563079 /nfs/dbraw/zinc/56/30/79/1046563079.db2.gz NGBXIXAMQHNPGB-UHFFFAOYSA-N 0 1 315.219 4.146 20 0 DIADMN COc1ccc([C@H](C)[N@@H+](C)Cc2cc3ccccc3cn2)cc1 ZINC001140001762 1046564699 /nfs/dbraw/zinc/56/46/99/1046564699.db2.gz ZQSWRDXOQDQUMS-HNNXBMFYSA-N 0 1 306.409 4.436 20 0 DIADMN COc1ccc2cc([C@H](C)N[C@@H](C)c3nccnc3C)ccc2c1 ZINC000783230892 1046565181 /nfs/dbraw/zinc/56/51/81/1046565181.db2.gz NHJNUJQSXIEFOD-ZFWWWQNUSA-N 0 1 321.424 4.359 20 0 DIADMN FCCCN1CCC[C@H]1c1nc(-c2ccc(Cl)cc2)c[nH]1 ZINC000137507347 1046565326 /nfs/dbraw/zinc/56/53/26/1046565326.db2.gz BASOMKSXKSDKFL-HNNXBMFYSA-N 0 1 307.800 4.227 20 0 DIADMN CC(C)CCN(C)Cc1nc2cc(C(F)(F)F)ccc2n1C ZINC000678137155 1046565578 /nfs/dbraw/zinc/56/55/78/1046565578.db2.gz LBEBONCFCVBWNC-UHFFFAOYSA-N 0 1 313.367 4.070 20 0 DIADMN Cc1ccc([C@@H]2CCCN2Cc2cc3ccccc3cn2)cn1 ZINC001140000472 1046565796 /nfs/dbraw/zinc/56/57/96/1046565796.db2.gz GYVCNAXBJZQQEZ-FQEVSTJZSA-N 0 1 303.409 4.275 20 0 DIADMN CCCCCN(Cc1nc(-c2ccc(C)cc2)no1)C(C)C ZINC000642116529 1046566234 /nfs/dbraw/zinc/56/62/34/1046566234.db2.gz BHRMBUCRNUGHHQ-UHFFFAOYSA-N 0 1 301.434 4.446 20 0 DIADMN C[C@@H](c1cccc(C(F)(F)F)c1)N(Cc1cn[nH]c1)C1CC1 ZINC000678136497 1046566601 /nfs/dbraw/zinc/56/66/01/1046566601.db2.gz QNKCXWJZVRPPLA-NSHDSACASA-N 0 1 309.335 4.154 20 0 DIADMN Fc1ccc(CN(Cc2ccc3nc[nH]c3c2)C2CC2)c(F)c1 ZINC000536633521 1046569328 /nfs/dbraw/zinc/56/93/28/1046569328.db2.gz LXERLDJCNCASRY-UHFFFAOYSA-N 0 1 313.351 4.006 20 0 DIADMN CN(C)c1ccc(CN2CCC[C@@H]2c2ccc(Cl)cc2)cn1 ZINC000678140535 1046569501 /nfs/dbraw/zinc/56/95/01/1046569501.db2.gz OAIWFHZCMYXCPK-QGZVFWFLSA-N 0 1 315.848 4.138 20 0 DIADMN Oc1ccc(F)c(CN2CC[C@H](Sc3ccc(F)cc3)C2)c1 ZINC001140052150 1046574534 /nfs/dbraw/zinc/57/45/34/1046574534.db2.gz HDYXPNCPOPDJGA-INIZCTEOSA-N 0 1 321.392 4.037 20 0 DIADMN Oc1ccc(F)c(CN2CCC(c3ccc(F)cc3)CC2)c1 ZINC001140048231 1046576043 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CCC(=O)c1ccc(O)c(NC(=O)c2coc3c2cccc3C)c1 ZINC001159473095 1047852018 /nfs/dbraw/zinc/85/20/18/1047852018.db2.gz DFUIQRDENIHIKY-UHFFFAOYSA-N 0 1 323.348 4.292 20 0 DIADMN Cc1cc(-c2noc(CN(C)C[C@@H](C)C(C)(C)C)n2)ccc1F ZINC001197601902 1047852317 /nfs/dbraw/zinc/85/23/17/1047852317.db2.gz LQRALYDQQBEASQ-CYBMUJFWSA-N 0 1 319.424 4.298 20 0 DIADMN C[C@@H](N[C@@H](C)c1ccc(F)cc1OC(F)F)c1ccncc1 ZINC000152534149 1047854590 /nfs/dbraw/zinc/85/45/90/1047854590.db2.gz KKLWMSGQHHTPOS-MNOVXSKESA-N 0 1 310.319 4.234 20 0 DIADMN CCc1ccc(C)nc1N[C@H]1CCC[C@H](CCCC(=O)OC)C1 ZINC001182872589 1047855024 /nfs/dbraw/zinc/85/50/24/1047855024.db2.gz FSYURGIPZMIDAS-WBVHZDCISA-N 0 1 318.461 4.266 20 0 DIADMN Cc1ccc2nc(NC(=O)[C@H](C)c3ccc(Cl)s3)[nH]c2c1 ZINC000553474144 1047855431 /nfs/dbraw/zinc/85/54/31/1047855431.db2.gz KGZIXOFHKLBROH-SECBINFHSA-N 0 1 319.817 4.328 20 0 DIADMN COc1cccc(Cl)c1CN[C@@H]1c2ccccc2C[C@@H]1C ZINC000479271499 1047858228 /nfs/dbraw/zinc/85/82/28/1047858228.db2.gz 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COCc1csc(CN(Cc2ccccc2OC)C2CC2)c1 ZINC000667498726 1047903367 /nfs/dbraw/zinc/90/33/67/1047903367.db2.gz SRWSSBZEXVHLSO-UHFFFAOYSA-N 0 1 317.454 4.068 20 0 DIADMN COc1cc2c(cc1CN[C@H]1CCc3cc(C)ccc31)O[C@H](C)C2 ZINC000553659768 1047907324 /nfs/dbraw/zinc/90/73/24/1047907324.db2.gz FGRPTVOKXHEEQT-KUHUBIRLSA-N 0 1 323.436 4.104 20 0 DIADMN CCn1nc(C)c(CN(C)Cc2ccc3c(c2)CCCC3)c1C ZINC001183204448 1047907824 /nfs/dbraw/zinc/90/78/24/1047907824.db2.gz AKHJHRBMDLJFDD-UHFFFAOYSA-N 0 1 311.473 4.031 20 0 DIADMN Cc1ncc(CN([C@@H](C)c2ccc(Cl)cc2)C2CC2)n1C ZINC000667497713 1047908088 /nfs/dbraw/zinc/90/80/88/1047908088.db2.gz LZKCZSBSFLZFOZ-LBPRGKRZSA-N 0 1 303.837 4.108 20 0 DIADMN COc1cccc([C@@H]2CCCN2Cc2cc(F)ccc2OC)c1 ZINC000553664322 1047908591 /nfs/dbraw/zinc/90/85/91/1047908591.db2.gz RFXOFMOKEMADAI-SFHVURJKSA-N 0 1 315.388 4.180 20 0 DIADMN COc1cccc([C@H]2CCCN2Cc2cc(F)ccc2OC)c1 ZINC000553664320 1047909590 /nfs/dbraw/zinc/90/95/90/1047909590.db2.gz RFXOFMOKEMADAI-GOSISDBHSA-N 0 1 315.388 4.180 20 0 DIADMN COc1cccc([C@H](C)N[C@@H]2CCc3c2nccc3Cl)c1 ZINC000924723132 1047916106 /nfs/dbraw/zinc/91/61/06/1047916106.db2.gz JRUWQVPWXVDPIP-MEDUHNTESA-N 0 1 302.805 4.082 20 0 DIADMN Cc1cc(CN2CCC[C@H](C(F)(F)F)C2)c2c(n1)CCCC2 ZINC001183362345 1047918518 /nfs/dbraw/zinc/91/85/18/1047918518.db2.gz AXONALAZPGYECS-AWEZNQCLSA-N 0 1 312.379 4.043 20 0 DIADMN Cc1ccc2nc(-c3ccc(F)cc3)c(CN3CC(C)(C)C3)n2c1 ZINC001183355114 1047919201 /nfs/dbraw/zinc/91/92/01/1047919201.db2.gz KSIAUHKWRQFYDS-UHFFFAOYSA-N 0 1 323.415 4.291 20 0 DIADMN CCCC[N@@H+](Cc1[nH]c(C)nc1C)Cc1c(C)oc(C)c1C ZINC001198020751 1047919569 /nfs/dbraw/zinc/91/95/69/1047919569.db2.gz UNSMJTMAGNDFDV-UHFFFAOYSA-N 0 1 303.450 4.347 20 0 DIADMN CCCCN(Cc1[nH]c(C)nc1C)Cc1c(C)oc(C)c1C ZINC001198020751 1047919574 /nfs/dbraw/zinc/91/95/74/1047919574.db2.gz UNSMJTMAGNDFDV-UHFFFAOYSA-N 0 1 303.450 4.347 20 0 DIADMN [O-]c1cc(F)c(Nc2ccc([C@H]3CC[NH2+]C3)cc2)cc1Cl ZINC001159779443 1047923364 /nfs/dbraw/zinc/92/33/64/1047923364.db2.gz 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1048300808 /nfs/dbraw/zinc/30/08/08/1048300808.db2.gz PJRGWCVQZWPCTA-KRWDZBQOSA-N 0 1 301.455 4.063 20 0 DIADMN Fc1cccc(O[C@H]2CCN(Cc3sccc3Cl)C2)c1 ZINC001175427262 1048302907 /nfs/dbraw/zinc/30/29/07/1048302907.db2.gz NGWXHRVKPKRXQX-ZDUSSCGKSA-N 0 1 311.809 4.194 20 0 DIADMN COc1ccccc1[C@@H]1CN([C@@H]2CCCc3ccccc32)CCO1 ZINC001175426944 1048303149 /nfs/dbraw/zinc/30/31/49/1048303149.db2.gz MXHNSLXSJOXUPP-CTNGQTDRSA-N 0 1 323.436 4.146 20 0 DIADMN Cc1ccc2sc(NCCc3ccc4cn[nH]c4c3)nc2c1C ZINC001186422275 1048304457 /nfs/dbraw/zinc/30/44/57/1048304457.db2.gz LXOVXBJJAZVWOS-UHFFFAOYSA-N 0 1 322.437 4.444 20 0 DIADMN COc1ccc([C@H]2CN(C[C@H](C)CC(C)(C)C)CCO2)cc1 ZINC001175427765 1048304462 /nfs/dbraw/zinc/30/44/62/1048304462.db2.gz SUTRKAIJYGJTSS-CRAIPNDOSA-N 0 1 305.462 4.141 20 0 DIADMN Cc1ccc([C@@H](O)CNCc2ccc(Oc3ccccc3)o2)cc1 ZINC000775022255 1048307626 /nfs/dbraw/zinc/30/76/26/1048307626.db2.gz WOGCOSHJZNVEKM-IBGZPJMESA-N 0 1 323.392 4.204 20 0 DIADMN CC[C@H](C)CN1CCO[C@@H](c2cccc(C(F)(F)F)c2)C1 ZINC001201521547 1048308924 /nfs/dbraw/zinc/30/89/24/1048308924.db2.gz UHXJMISTDIXBAJ-SWLSCSKDSA-N 0 1 301.352 4.125 20 0 DIADMN Cc1cccc2ccnc(NCc3cccc4c3cnn4C)c12 ZINC001162592825 1048310217 /nfs/dbraw/zinc/31/02/17/1048310217.db2.gz ODUHBJMIHVCFJI-UHFFFAOYSA-N 0 1 302.381 4.042 20 0 DIADMN C[C@@H]1CC(C)(C)CC[C@H]1NCc1noc(-c2cccs2)n1 ZINC000481125216 1048313209 /nfs/dbraw/zinc/31/32/09/1048313209.db2.gz LJINDWAFVPUGPL-VXGBXAGGSA-N 0 1 305.447 4.103 20 0 DIADMN Cc1cc2ccccc2c(NCCOc2cc(Cl)ccn2)n1 ZINC001162625405 1048314536 /nfs/dbraw/zinc/31/45/36/1048314536.db2.gz ALEHWUNTFMOQDV-UHFFFAOYSA-N 0 1 313.788 4.083 20 0 DIADMN CCCC[C@@H](CC)CN1Cc2c(cnn2CC)[C@H](COCC)C1 ZINC001201560684 1048317894 /nfs/dbraw/zinc/31/78/94/1048317894.db2.gz VTUCJFWGKNTFBS-SJORKVTESA-N 0 1 321.509 4.055 20 0 DIADMN C[C@H]1CN(Cc2ccc(C(F)(F)F)nc2)Cc2ccccc21 ZINC001205359185 1048322922 /nfs/dbraw/zinc/32/29/22/1048322922.db2.gz QBQLFKYCGNHACW-LBPRGKRZSA-N 0 1 306.331 4.220 20 0 DIADMN Fc1ccccc1CCN1CCC[C@](F)(c2ccccc2)C1 ZINC001175491042 1048325589 /nfs/dbraw/zinc/32/55/89/1048325589.db2.gz INHUODLILABDIV-LJQANCHMSA-N 0 1 301.380 4.329 20 0 DIADMN CC(C)CCN1CCN(c2ccc(F)c(Cl)c2Cl)CC1 ZINC001201630353 1048328226 /nfs/dbraw/zinc/32/82/26/1048328226.db2.gz PQTWMKZCUXXZFY-UHFFFAOYSA-N 0 1 319.251 4.301 20 0 DIADMN C[C@@H](N[C@H]1CC[C@@H](C)C[C@@H]1C)c1nc(Cc2ccccc2)no1 ZINC000481190301 1048329550 /nfs/dbraw/zinc/32/95/50/1048329550.db2.gz LGEGUIRNIADCGK-DLTWYDFYSA-N 0 1 313.445 4.136 20 0 DIADMN CC(C)(C)C(=N)Nc1ccc2cccc(Br)c2n1 ZINC001162660463 1048331546 /nfs/dbraw/zinc/33/15/46/1048331546.db2.gz LJSAQGXBMLJYHX-UHFFFAOYSA-N 0 1 306.207 4.433 20 0 DIADMN CCC1(CC)[C@@H](NCc2coc(-c3ccccc3)n2)C[C@@H]1OC ZINC001201618706 1048334365 /nfs/dbraw/zinc/33/43/65/1048334365.db2.gz SXSSIIXNBXMNJS-IRXDYDNUSA-N 0 1 314.429 4.025 20 0 DIADMN C[C@H](N[C@@H]1CO[C@@H](C2CC2)C1)c1nc(-c2ccccc2)cs1 ZINC000667843898 1048337736 /nfs/dbraw/zinc/33/77/36/1048337736.db2.gz 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/nfs/dbraw/zinc/35/44/66/1048354466.db2.gz ZXBTXXRKPANENO-UHFFFAOYSA-N 0 1 322.199 4.274 20 0 DIADMN Cc1cc2[nH]ncc2cc1NC(=O)c1cc(Cl)cc(Cl)c1 ZINC000481296664 1048354500 /nfs/dbraw/zinc/35/45/00/1048354500.db2.gz TZIOLCFCKIQJTK-UHFFFAOYSA-N 0 1 320.179 4.430 20 0 DIADMN CCc1ccc([C@@H](C)C(=O)Nc2cc3cn[nH]c3cc2C)cc1 ZINC000481295837 1048354788 /nfs/dbraw/zinc/35/47/88/1048354788.db2.gz QMFHTDAUUIQNEX-CYBMUJFWSA-N 0 1 307.397 4.176 20 0 DIADMN Cc1ccc2[nH]ncc2c1Nc1ccc(Br)cc1O ZINC001175526632 1048354989 /nfs/dbraw/zinc/35/49/89/1048354989.db2.gz WSGJWZDVNJQFBX-UHFFFAOYSA-N 0 1 318.174 4.083 20 0 DIADMN Cc1nccn1-c1ccc(Nc2c3cn[nH]c3ccc2C)cc1 ZINC001175526602 1048355305 /nfs/dbraw/zinc/35/53/05/1048355305.db2.gz UTDZDLNJZIJPEM-UHFFFAOYSA-N 0 1 303.369 4.109 20 0 DIADMN COc1ccc(-c2cc(Nc3c4cn[nH]c4ccc3C)on2)cc1 ZINC001175526488 1048355504 /nfs/dbraw/zinc/35/55/04/1048355504.db2.gz WVZFJMWSAVINAD-UHFFFAOYSA-N 0 1 320.352 4.279 20 0 DIADMN Cc1ccc2[nH]ncc2c1Nc1ccc(-c2cnn(C)c2)cc1 ZINC001175525774 1048356100 /nfs/dbraw/zinc/35/61/00/1048356100.db2.gz IPLIZQCBUHGKEZ-UHFFFAOYSA-N 0 1 303.369 4.015 20 0 DIADMN COC(=O)CCCc1ccc(Nc2c3cn[nH]c3ccc2C)cc1 ZINC001175526965 1048356766 /nfs/dbraw/zinc/35/67/66/1048356766.db2.gz DPDPKQPTRMQSGD-UHFFFAOYSA-N 0 1 323.396 4.111 20 0 DIADMN Cc1ccc2[nH]ncc2c1Nc1cccc(C(F)(F)F)c1O ZINC001175527702 1048357895 /nfs/dbraw/zinc/35/78/95/1048357895.db2.gz QTHNMUWJLFITEH-UHFFFAOYSA-N 0 1 307.275 4.339 20 0 DIADMN COc1cnc2c(cccc2Nc2c3cn[nH]c3ccc2C)c1 ZINC001175527785 1048359493 /nfs/dbraw/zinc/35/94/93/1048359493.db2.gz VQWATZUDVGNSRP-UHFFFAOYSA-N 0 1 304.353 4.172 20 0 DIADMN COc1nc2ccccc2cc1CNC/C=C/c1ccccc1 ZINC001201692816 1048360178 /nfs/dbraw/zinc/36/01/78/1048360178.db2.gz HZECZEUWTNGIOX-JXMROGBWSA-N 0 1 304.393 4.046 20 0 DIADMN O[C@@H]1CCN(Cc2cccc(Cl)c2Cl)[C@H]2CCCC[C@@H]12 ZINC001175586861 1048360204 /nfs/dbraw/zinc/36/02/04/1048360204.db2.gz LGAGGWZFNQAXKW-VHDGCEQUSA-N 0 1 314.256 4.119 20 0 DIADMN Cc1c(Cl)ccc2c1CN(Cc1ccc3c[nH]nc3c1)CC2 ZINC001175587596 1048361114 /nfs/dbraw/zinc/36/11/14/1048361114.db2.gz WRXQCAZXESAOIG-UHFFFAOYSA-N 0 1 311.816 4.083 20 0 DIADMN CCC(CC)c1cc(C(=O)Nc2cc3cn[nH]c3cc2C)on1 ZINC000481302692 1048361273 /nfs/dbraw/zinc/36/12/73/1048361273.db2.gz DLIDEASPRSTLQO-UHFFFAOYSA-N 0 1 312.373 4.015 20 0 DIADMN Cc1cc2[nH]ncc2cc1NC(=O)C[C@@H](C)c1cccc(F)c1 ZINC000481311585 1048361314 /nfs/dbraw/zinc/36/13/14/1048361314.db2.gz VZXPHQPELAQWFR-LLVKDONJSA-N 0 1 311.360 4.143 20 0 DIADMN O[C@@H]1CCN(Cc2cccc(Cl)c2Cl)[C@H]2CCCC[C@H]12 ZINC001175586855 1048361366 /nfs/dbraw/zinc/36/13/66/1048361366.db2.gz LGAGGWZFNQAXKW-AEGPPILISA-N 0 1 314.256 4.119 20 0 DIADMN Cc1cc2[nH]ncc2cc1NC(=O)C[C@H](C)c1cccc(F)c1 ZINC000481311587 1048362959 /nfs/dbraw/zinc/36/29/59/1048362959.db2.gz VZXPHQPELAQWFR-NSHDSACASA-N 0 1 311.360 4.143 20 0 DIADMN Cc1cc2[nH]ncc2cc1NC(=O)c1ccccc1C(F)(F)F ZINC000481311328 1048363361 /nfs/dbraw/zinc/36/33/61/1048363361.db2.gz UZOFJETWNYBIAX-UHFFFAOYSA-N 0 1 319.286 4.142 20 0 DIADMN Cc1cc2[nH]ncc2cc1NC(=O)[C@@H](C)CCCc1ccccc1 ZINC000481323353 1048368367 /nfs/dbraw/zinc/36/83/67/1048368367.db2.gz OKRPQYLHGIMETP-AWEZNQCLSA-N 0 1 321.424 4.469 20 0 DIADMN Cc1cc2[nH]ncc2cc1NC(=O)c1ccc(F)c(Cl)c1F ZINC000481335542 1048371030 /nfs/dbraw/zinc/37/10/30/1048371030.db2.gz FNMXTIPZQRMVCU-UHFFFAOYSA-N 0 1 321.714 4.055 20 0 DIADMN c1nn(-c2ccccc2)cc1CNCc1ccc(C2CCC2)cc1 ZINC000555524871 1048374751 /nfs/dbraw/zinc/37/47/51/1048374751.db2.gz RWEHKCTWOAKVKM-UHFFFAOYSA-N 0 1 317.436 4.430 20 0 DIADMN Fc1ccc([C@@H]2CCCN(Cc3ncc(C4CC4)o3)CC2)cc1 ZINC000481342021 1048375362 /nfs/dbraw/zinc/37/53/62/1048375362.db2.gz GZAFHHXOLVLLLL-CQSZACIVSA-N 0 1 314.404 4.461 20 0 DIADMN CC[C@@H](CC(=O)Nc1cc2cn[nH]c2cc1C)c1ccccc1 ZINC000481360091 1048379681 /nfs/dbraw/zinc/37/96/81/1048379681.db2.gz OBFSPSJBGOGCRP-AWEZNQCLSA-N 0 1 307.397 4.394 20 0 DIADMN Clc1ccc2[nH]c([C@H]3CCCN3C[C@@H]3CCC=CO3)nc2c1 ZINC000775097833 1048381214 /nfs/dbraw/zinc/38/12/14/1048381214.db2.gz VYGRWRAAZJVYDH-XJKSGUPXSA-N 0 1 317.820 4.046 20 0 DIADMN CC[C@H](C)c1nnc([C@@H](C)NC2CC(c3cccc(F)c3)C2)[nH]1 ZINC000555548199 1048381859 /nfs/dbraw/zinc/38/18/59/1048381859.db2.gz LSPRXUXLOYRGMM-QFNJPPCTSA-N 0 1 316.424 4.054 20 0 DIADMN O=C(NC1(c2ccccc2Cl)CC1)c1ccc(Cl)c(O)c1 ZINC001162920496 1048388884 /nfs/dbraw/zinc/38/88/84/1048388884.db2.gz LELDRBYIBYPOKC-UHFFFAOYSA-N 0 1 322.191 4.118 20 0 DIADMN CC[C@@H](Nc1nc(Cl)nc2[nH]cnc21)c1ccc(C)c(F)c1 ZINC001162936377 1048391467 /nfs/dbraw/zinc/39/14/67/1048391467.db2.gz IEVXBUJMVYZEEO-LLVKDONJSA-N 0 1 319.771 4.017 20 0 DIADMN c1cn(C2CCCC2)nc1CN1CCC[C@H](C2CCC2)CC1 ZINC001175610916 1048393576 /nfs/dbraw/zinc/39/35/76/1048393576.db2.gz IYFQEQFHYXKNRX-KRWDZBQOSA-N 0 1 301.478 4.400 20 0 DIADMN COCC[C@@H](NCc1cc(C)cc(Cl)c1)c1ccc(C)o1 ZINC000555577745 1048394354 /nfs/dbraw/zinc/39/43/54/1048394354.db2.gz PJDMLXJUVYADQT-MRXNPFEDSA-N 0 1 307.821 4.417 20 0 DIADMN CCCCOc1c(Cl)cc(-n2cnc(C)c2N)cc1Cl ZINC001187416526 1048395504 /nfs/dbraw/zinc/39/55/04/1048395504.db2.gz 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DIADMN COc1cnc(Cl)cc1NC(=N)C12CC3CC(CC(C3)C1)C2 ZINC001163841331 1048533962 /nfs/dbraw/zinc/53/39/62/1048533962.db2.gz OVAZRMXDLMWLCV-UHFFFAOYSA-N 0 1 319.836 4.349 20 0 DIADMN COc1cnc(NC(=N)C23CC4CC(CC(C4)C2)C3)c2[nH]ccc21 ZINC001163841645 1048536393 /nfs/dbraw/zinc/53/63/93/1048536393.db2.gz SZZLIQCFAGLZOZ-UHFFFAOYSA-N 0 1 324.428 4.177 20 0 DIADMN Cc1ccc(Cl)cc1N1CCN(CCCC(F)(F)F)CC1 ZINC001202378454 1048537860 /nfs/dbraw/zinc/53/78/60/1048537860.db2.gz ZTLQLGBRHHCZFJ-UHFFFAOYSA-N 0 1 320.786 4.113 20 0 DIADMN N=C(Nc1cccc2nsnc21)C12CC3CC(CC(C3)C1)C2 ZINC001163848873 1048538010 /nfs/dbraw/zinc/53/80/10/1048538010.db2.gz ZMAGJCOVFXHKAZ-UHFFFAOYSA-N 0 1 312.442 4.297 20 0 DIADMN CC(C)(C)c1nc(CS[C@H]2CCCc3ccccc32)n[nH]1 ZINC001188677960 1048539561 /nfs/dbraw/zinc/53/95/61/1048539561.db2.gz PPVLRCJFAVFJAX-AWEZNQCLSA-N 0 1 301.459 4.413 20 0 DIADMN CC(C)(C)c1nc(CS[C@@H]2CCCc3ccccc32)n[nH]1 ZINC001188677963 1048540176 /nfs/dbraw/zinc/54/01/76/1048540176.db2.gz PPVLRCJFAVFJAX-CQSZACIVSA-N 0 1 301.459 4.413 20 0 DIADMN CC[C@@H](C)[C@H](C)Sc1nc(-c2ccc(OC)cc2OC)n[nH]1 ZINC001188682859 1048541426 /nfs/dbraw/zinc/54/14/26/1048541426.db2.gz BNILPUYWEAOMKD-MNOVXSKESA-N 0 1 321.446 4.016 20 0 DIADMN Cc1cc2[nH]c(C[N@@H+]3CC[C@H](C)[C@@H](n4ccnc4)C3)cc2c(C)c1 ZINC000482005949 1048543633 /nfs/dbraw/zinc/54/36/33/1048543633.db2.gz LPJRAZQGVKMTCO-YWZLYKJASA-N 0 1 322.456 4.064 20 0 DIADMN Cc1cccc(C)c1CN[C@H]1CCc2cc(F)c(F)c(F)c21 ZINC001202417748 1048545816 /nfs/dbraw/zinc/54/58/16/1048545816.db2.gz NTEXGCBYHGVMLV-HNNXBMFYSA-N 0 1 305.343 4.498 20 0 DIADMN FC(F)(F)Oc1cc(Cl)c(Nc2ncc[nH]2)c(Cl)c1 ZINC001176082543 1048547667 /nfs/dbraw/zinc/54/76/67/1048547667.db2.gz BCYCFVMIOSKYMV-UHFFFAOYSA-N 0 1 312.078 4.359 20 0 DIADMN CCC[C@H](CC1CCCC1)C(=O)N1CCN(C)[C@H](C(C)(C)C)C1 ZINC001163925208 1048549668 /nfs/dbraw/zinc/54/96/68/1048549668.db2.gz QFIZRESXFQLKSY-MSOLQXFVSA-N 0 1 322.537 4.172 20 0 DIADMN Fc1c(Nc2ncc[nH]2)ccc(Br)c1C(F)(F)F ZINC001176085745 1048549789 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CCOC(=O)[C@@H](c1ccccc1)N1CCC[C@H](CC(C)C)C1 ZINC001192199143 1049052424 /nfs/dbraw/zinc/05/24/24/1049052424.db2.gz MRFJZZGWKVILQC-SJLPKXTDSA-N 0 1 303.446 4.049 20 0 DIADMN CC(C)C[C@@H]1CCCN([C@H](C)C(=O)Nc2ccc(F)c(F)c2)C1 ZINC001192199535 1049052454 /nfs/dbraw/zinc/05/24/54/1049052454.db2.gz NSZWJIULTWUKJN-KGLIPLIRSA-N 0 1 324.415 4.050 20 0 DIADMN CC1(C)CC[C@@H](CN(CCC(F)(F)F)Cc2ccccc2)O1 ZINC000484815312 1049052980 /nfs/dbraw/zinc/05/29/80/1049052980.db2.gz YTOVWBGMVIIWMD-HNNXBMFYSA-N 0 1 315.379 4.399 20 0 DIADMN COc1ccc(CN2CCCC(F)(F)[C@H](F)C2)c2ccccc12 ZINC001203993453 1049052899 /nfs/dbraw/zinc/05/28/99/1049052899.db2.gz VWQSEPYXWNVXQG-QGZVFWFLSA-N 0 1 323.358 4.418 20 0 DIADMN COc1ccc(CN2CCc3c(O)cccc3C2)c2ccccc12 ZINC001203991376 1049053854 /nfs/dbraw/zinc/05/38/54/1049053854.db2.gz GKENSLSOZWOOFL-UHFFFAOYSA-N 0 1 319.404 4.112 20 0 DIADMN COc1ccc(CN2CCC(=O)[C@@H]3CCCC[C@@H]32)c2ccccc12 ZINC001203991477 1049054689 /nfs/dbraw/zinc/05/46/89/1049054689.db2.gz IVHOLBWNSSLQNY-MOPGFXCFSA-N 0 1 323.436 4.182 20 0 DIADMN COc1ccc(CN2CCC(=O)[C@H]3CCCC[C@@H]32)c2ccccc12 ZINC001203991478 1049054791 /nfs/dbraw/zinc/05/47/91/1049054791.db2.gz IVHOLBWNSSLQNY-OALUTQOASA-N 0 1 323.436 4.182 20 0 DIADMN Cc1cc(CN[C@@H](C)c2cnn(CC3CCC3)c2)ccc1Cl ZINC001203993954 1049055707 /nfs/dbraw/zinc/05/57/07/1049055707.db2.gz OKXYJSFSDHTHCM-AWEZNQCLSA-N 0 1 317.864 4.496 20 0 DIADMN CC[C@@]1(C(=O)[O-])CCC[N@@H+](C[C@@H](c2ccccc2)C(C)C)C1 ZINC000904400681 1049059627 /nfs/dbraw/zinc/05/96/27/1049059627.db2.gz KKYUVCUTHZNXBQ-IEBWSBKVSA-N 0 1 303.446 4.003 20 0 DIADMN CCCc1ccc(CN2CCO[C@]3(CCc4ccccc43)C2)cc1 ZINC001192252754 1049059942 /nfs/dbraw/zinc/05/99/42/1049059942.db2.gz KZJAKKDABRSYER-JOCHJYFZSA-N 0 1 321.464 4.313 20 0 DIADMN CC(C)c1ccccc1NC(=O)Nc1cc(O)c(F)c(F)c1 ZINC001192252044 1049060116 /nfs/dbraw/zinc/06/01/16/1049060116.db2.gz JUOKSZUPNRUZMQ-UHFFFAOYSA-N 0 1 306.312 4.438 20 0 DIADMN C[C@H]1CN(Cc2c[nH]c3ccccc23)[C@@H](c2ccccc2)CO1 ZINC001204050646 1049073460 /nfs/dbraw/zinc/07/34/60/1049073460.db2.gz ZNGYVXHLAKFDJD-MGPUTAFESA-N 0 1 306.409 4.130 20 0 DIADMN C[C@@]1(c2ccc(F)cc2)CN(Cc2c[nH]c3ccccc23)CCO1 ZINC001204048217 1049073897 /nfs/dbraw/zinc/07/38/97/1049073897.db2.gz MLKMEQKPFCYCTG-FQEVSTJZSA-N 0 1 324.399 4.055 20 0 DIADMN CCCC1CCC(N(C)CC(=O)Nc2c(F)cccc2F)CC1 ZINC000484898047 1049074602 /nfs/dbraw/zinc/07/46/02/1049074602.db2.gz JKVPCFKHXHLNEF-UHFFFAOYSA-N 0 1 324.415 4.194 20 0 DIADMN COCCC1CCN(Cc2cccc(Cl)c2Cl)CC1 ZINC001204181913 1049105332 /nfs/dbraw/zinc/10/53/32/1049105332.db2.gz FLWNKIPAPAUMQS-UHFFFAOYSA-N 0 1 302.245 4.242 20 0 DIADMN CCOc1ccc(CN2CC=C(c3cc(C)cc(C)c3)CC2)nc1 ZINC001192292429 1049075169 /nfs/dbraw/zinc/07/51/69/1049075169.db2.gz ULSLLSSXIQYADR-UHFFFAOYSA-N 0 1 322.452 4.386 20 0 DIADMN Cc1cccc(CN2CCC[C@H](Oc3ccc(Cl)cc3)C2)n1 ZINC001204067620 1049075816 /nfs/dbraw/zinc/07/58/16/1049075816.db2.gz AVTXXWMREVNPFL-SFHVURJKSA-N 0 1 316.832 4.087 20 0 DIADMN Clc1ccc([C@@]23C[C@@H]2CN(Cc2cccnc2)C3)cc1Cl ZINC001204076457 1049078093 /nfs/dbraw/zinc/07/80/93/1049078093.db2.gz XCUOFONZPHAQIN-PBHICJAKSA-N 0 1 319.235 4.162 20 0 DIADMN CC(C)CC[C@@H](O)CN1CC=C(c2ccccc2Cl)CC1 ZINC001192324747 1049079430 /nfs/dbraw/zinc/07/94/30/1049079430.db2.gz LEKTYAOQGKQHSZ-MRXNPFEDSA-N 0 1 307.865 4.226 20 0 DIADMN Fc1ccc(CNc2ccc3c(n2)CCC3)c(Br)c1 ZINC001178742355 1049080326 /nfs/dbraw/zinc/08/03/26/1049080326.db2.gz SEAXFLFDFISAFQ-UHFFFAOYSA-N 0 1 321.193 4.084 20 0 DIADMN CCCCn1nc(C)c(CNc2ccc3c(n2)CCC3)c1Cl ZINC001178742336 1049081636 /nfs/dbraw/zinc/08/16/36/1049081636.db2.gz RJPMQTGCASPKTH-UHFFFAOYSA-N 0 1 318.852 4.141 20 0 DIADMN Cc1ccc2cc(CNCc3ccnc(C(F)(F)F)c3)[nH]c2c1 ZINC001178758758 1049082589 /nfs/dbraw/zinc/08/25/89/1049082589.db2.gz HHODNZPYWSTWIA-UHFFFAOYSA-N 0 1 319.330 4.180 20 0 DIADMN c1cc2cc(-c3noc([C@@H]4NCC[C@@H]5CCCC[C@@H]45)n3)ccc2[nH]1 ZINC000904537305 1049083661 /nfs/dbraw/zinc/08/36/61/1049083661.db2.gz JZPAELHGRWYMLE-XGWLTEMNSA-N 0 1 322.412 4.059 20 0 DIADMN [O-]c1cc(F)cc(F)c1Nc1cccc(C[NH+]2CCCCC2)c1 ZINC001204109301 1049086663 /nfs/dbraw/zinc/08/66/63/1049086663.db2.gz FCSQOSCXLPIZHW-UHFFFAOYSA-N 0 1 318.367 4.400 20 0 DIADMN CCSc1cccc(F)c1NC(=O)c1cc(F)ccc1F ZINC000484928670 1049088140 /nfs/dbraw/zinc/08/81/40/1049088140.db2.gz VGYHNBPRRLZTDO-UHFFFAOYSA-N 0 1 311.328 4.468 20 0 DIADMN CCOc1cc(CN2CCC[C@@H]2c2cccc(F)c2)ccc1O ZINC001204130315 1049089782 /nfs/dbraw/zinc/08/97/82/1049089782.db2.gz GAPXIWSNOLGPQG-QGZVFWFLSA-N 0 1 315.388 4.267 20 0 DIADMN CCOc1cc(CN2Cc3ccccc3C(C)(C)C2)ccc1O ZINC001204133338 1049090144 /nfs/dbraw/zinc/09/01/44/1049090144.db2.gz QLBRSATWQZHLBI-UHFFFAOYSA-N 0 1 311.425 4.084 20 0 DIADMN c1ccc(-c2ccc(CN3CCc4cnccc4C3)cc2)cc1 ZINC001204133934 1049090517 /nfs/dbraw/zinc/09/05/17/1049090517.db2.gz JUDDASCLYHYCOV-UHFFFAOYSA-N 0 1 300.405 4.307 20 0 DIADMN FC(F)COc1ccccc1CNc1cc2c(cn1)CCCC2 ZINC001178801067 1049091437 /nfs/dbraw/zinc/09/14/37/1049091437.db2.gz RUEUAVBSSKTAFH-UHFFFAOYSA-N 0 1 318.367 4.216 20 0 DIADMN Cc1nn(C(C)C)c(C)c1CN(Cc1ccc(F)cc1)C1CC1 ZINC001204143992 1049093931 /nfs/dbraw/zinc/09/39/31/1049093931.db2.gz CWRWKWASLVTJRN-UHFFFAOYSA-N 0 1 315.436 4.385 20 0 DIADMN CN(Cc1cc2ccnc(Cl)c2s1)Cc1cccc(O)c1 ZINC001204144371 1049094002 /nfs/dbraw/zinc/09/40/02/1049094002.db2.gz GPULDEBNQRDYSB-UHFFFAOYSA-N 0 1 318.829 4.287 20 0 DIADMN CC(C)[C@H](NCc1cn(C)nc1Cl)c1ccc(Cl)cc1 ZINC000856764576 1049102159 /nfs/dbraw/zinc/10/21/59/1049102159.db2.gz GGGTUVAAAOINNS-AWEZNQCLSA-N 0 1 312.244 4.214 20 0 DIADMN Cc1ccc(CC2CCN(Cc3ncccc3Cl)CC2)cc1 ZINC001192471927 1049102192 /nfs/dbraw/zinc/10/21/92/1049102192.db2.gz SVXXHRDNBPRONM-UHFFFAOYSA-N 0 1 314.860 4.498 20 0 DIADMN Cn1cc(CN[C@H](CC(C)(C)C)c2ccccc2)c(Cl)n1 ZINC000856766405 1049102294 /nfs/dbraw/zinc/10/22/94/1049102294.db2.gz XKNMYPJNBPWAFA-OAHLLOKOSA-N 0 1 305.853 4.341 20 0 DIADMN CCCc1ccc(CNCc2nc3ccccc3n2CC)s1 ZINC000856768939 1049103500 /nfs/dbraw/zinc/10/35/00/1049103500.db2.gz DQARLMJKYYQAKG-UHFFFAOYSA-N 0 1 313.470 4.360 20 0 DIADMN FC1(F)C[C@H]2CN(Cc3cccc(Cl)c3Cl)C[C@H]2C1 ZINC001204181281 1049104124 /nfs/dbraw/zinc/10/41/24/1049104124.db2.gz LAGIASIXQVJKLP-PHIMTYICSA-N 0 1 306.183 4.471 20 0 DIADMN Cn1cc(CN[C@H](c2ccc(Cl)cc2)C2CCC2)c(Cl)n1 ZINC000856768986 1049104751 /nfs/dbraw/zinc/10/47/51/1049104751.db2.gz GLNNANXGMQTZIN-HNNXBMFYSA-N 0 1 324.255 4.358 20 0 DIADMN COC1C[C@H]2CC[C@@H](C1)N2Cc1cccc(Cl)c1Cl ZINC001204185350 1049106445 /nfs/dbraw/zinc/10/64/45/1049106445.db2.gz RRSPAINQBPNJFJ-FUNVUKJBSA-N 0 1 300.229 4.135 20 0 DIADMN CCOc1cc(CN(CC)Cc2ccccc2F)ccc1OC ZINC001204190642 1049107556 /nfs/dbraw/zinc/10/75/56/1049107556.db2.gz RXTOKFFXIBUKSH-UHFFFAOYSA-N 0 1 317.404 4.255 20 0 DIADMN Cc1ccc(-c2nc(CN[C@H]3C[C@@H](OC(C)C)C3)cs2)cc1 ZINC001178916749 1049109954 /nfs/dbraw/zinc/10/99/54/1049109954.db2.gz OZPZPEBIEVQLGO-WOVMCDHWSA-N 0 1 316.470 4.164 20 0 DIADMN Fc1ccc(F)c(CN2CCC3(CC(OCC4CC4)C3)CC2)c1 ZINC001204218705 1049113574 /nfs/dbraw/zinc/11/35/74/1049113574.db2.gz KJQNRCJFVWJHAF-UHFFFAOYSA-N 0 1 321.411 4.136 20 0 DIADMN COC1(c2ccccc2)CCN(Cc2cc(F)cc(F)c2)CC1 ZINC001204231259 1049116511 /nfs/dbraw/zinc/11/65/11/1049116511.db2.gz YLVQISFKRLSWST-UHFFFAOYSA-N 0 1 317.379 4.103 20 0 DIADMN Cc1cccc(C2(NCc3cccc4c3OCCCO4)CCC2)c1 ZINC001179020827 1049117932 /nfs/dbraw/zinc/11/79/32/1049117932.db2.gz MJOIWUCQWHDPTR-UHFFFAOYSA-N 0 1 323.436 4.325 20 0 DIADMN Clc1ccc(CO[C@H]2CCCN(Cc3ccoc3)C2)cc1 ZINC001204242849 1049118482 /nfs/dbraw/zinc/11/84/82/1049118482.db2.gz CJTHBLGPYZBGFI-KRWDZBQOSA-N 0 1 305.805 4.114 20 0 DIADMN CCCN(Cc1nc(Cl)cs1)[C@@H]1C[C@H](OCC)C1(C)C ZINC001204235570 1049119123 /nfs/dbraw/zinc/11/91/23/1049119123.db2.gz BNFAMXBNVIZFKH-NEPJUHHUSA-N 0 1 316.898 4.212 20 0 DIADMN COc1ccccc1[C@H](CC(C)C)NCc1cc(C)ns1 ZINC001192585621 1049119947 /nfs/dbraw/zinc/11/99/47/1049119947.db2.gz XYYVSJUEKKUJLM-INIZCTEOSA-N 0 1 304.459 4.337 20 0 DIADMN CC(C)[C@H]1c2ccccc2CCN1Cc1cc2c(cc[nH]c2=O)o1 ZINC001204261958 1049123589 /nfs/dbraw/zinc/12/35/89/1049123589.db2.gz SYBBOYQWMDGCRJ-IBGZPJMESA-N 0 1 322.408 4.289 20 0 DIADMN CCOC(=O)CC(C)(C)CN(CC)Cc1ccccc1Cl ZINC001204261663 1049123852 /nfs/dbraw/zinc/12/38/52/1049123852.db2.gz NEVUOHZZAQFTQY-UHFFFAOYSA-N 0 1 311.853 4.141 20 0 DIADMN CC(C)N(Cc1cccc(Cl)c1)Cc1cccnc1N(C)C ZINC001204270758 1049125284 /nfs/dbraw/zinc/12/52/84/1049125284.db2.gz SAXJLUYYKNYFEP-UHFFFAOYSA-N 0 1 317.864 4.212 20 0 DIADMN CCC1(CC)[C@H](OC)C[C@@H]1N(C)Cc1ccc(F)c(F)c1F ZINC001204279545 1049126624 /nfs/dbraw/zinc/12/66/24/1049126624.db2.gz OLYCCZVGDDGVDN-UONOGXRCSA-N 0 1 315.379 4.129 20 0 DIADMN C[C@H](Oc1ccnc(NCc2cccnc2)c1)c1ccccc1 ZINC001179095673 1049130167 /nfs/dbraw/zinc/13/01/67/1049130167.db2.gz MNRWPCRPZNHFRV-HNNXBMFYSA-N 0 1 305.381 4.229 20 0 DIADMN CCCCCCOc1ccccc1CN1CC[C@]12CCOC2 ZINC001204293822 1049130961 /nfs/dbraw/zinc/13/09/61/1049130961.db2.gz IWIJGCDWLICEDQ-LJQANCHMSA-N 0 1 303.446 4.011 20 0 DIADMN Cc1cncc(CN2CC[C@@H](c3ccc(Cl)c(Cl)c3)C2)n1 ZINC001203173552 1049133230 /nfs/dbraw/zinc/13/32/30/1049133230.db2.gz KJMDSKIOLFITOI-CYBMUJFWSA-N 0 1 322.239 4.081 20 0 DIADMN Cc1ccc2ccccc2c1NC(=O)c1c(O)ccc(F)c1F ZINC001192718180 1049134518 /nfs/dbraw/zinc/13/45/18/1049134518.db2.gz RLDGQKVZONZYPE-UHFFFAOYSA-N 0 1 313.303 4.384 20 0 DIADMN C[C@@H](N)c1nc(-c2nc(C(C)(C)C3CCCCC3)no2)cs1 ZINC000904695777 1049134718 /nfs/dbraw/zinc/13/47/18/1049134718.db2.gz TZVLRISHUBWXNX-SNVBAGLBSA-N 0 1 320.462 4.071 20 0 DIADMN O=C(Nc1ccc(F)c2ccccc12)c1c(O)ccc(F)c1F ZINC001192770426 1049136196 /nfs/dbraw/zinc/13/61/96/1049136196.db2.gz VQVMOCRFPIFEHF-UHFFFAOYSA-N 0 1 317.266 4.215 20 0 DIADMN Cc1cc([C@H]2CCCCN2C(=O)c2scc(C)c2Cl)n[nH]1 ZINC001179152823 1049137031 /nfs/dbraw/zinc/13/70/31/1049137031.db2.gz YDXVBCOVRTVWBY-GFCCVEGCSA-N 0 1 323.849 4.109 20 0 DIADMN Cc1ccccc1[C@@H](O)CN[C@H](C)c1c(F)cccc1Cl ZINC000775550110 1049139296 /nfs/dbraw/zinc/13/92/96/1049139296.db2.gz XQCKSCXCEBEEAM-WBMJQRKESA-N 0 1 307.796 4.172 20 0 DIADMN Cc1cccc2c1C[C@@H](NCc1c(F)ccc(F)c1Cl)CO2 ZINC001179222035 1049142331 /nfs/dbraw/zinc/14/23/31/1049142331.db2.gz CSNOOVSBTDYUHG-LLVKDONJSA-N 0 1 323.770 4.020 20 0 DIADMN C[C@@H](c1ccc2c(c1)CCC2)N1CCO[C@H](Cc2ccccc2)C1 ZINC001192849682 1049142762 /nfs/dbraw/zinc/14/27/62/1049142762.db2.gz UIHWFJCKHGSMEU-HTAPYJJXSA-N 0 1 321.464 4.180 20 0 DIADMN O=C(Nc1ccc(F)c2ccccc12)c1ccc(O)c(F)c1F ZINC001192841437 1049142964 /nfs/dbraw/zinc/14/29/64/1049142964.db2.gz MPQIXBCIAJQFAQ-UHFFFAOYSA-N 0 1 317.266 4.215 20 0 DIADMN Cc1ccc(-c2cc(-c3nc(-c4ccccc4F)no3)[nH]n2)cc1 ZINC000904776284 1049145198 /nfs/dbraw/zinc/14/51/98/1049145198.db2.gz UTDNLRDRBFRUIF-UHFFFAOYSA-N 0 1 320.327 4.241 20 0 DIADMN Cc1cc(C)c(/C=C\CN2CCc3ccccc3[C@H]2CO)c(C)c1 ZINC001204347734 1049147038 /nfs/dbraw/zinc/14/70/38/1049147038.db2.gz LJSKUZXDNTUFQS-NOUOYNBVSA-N 0 1 321.464 4.217 20 0 DIADMN CCc1ccc([C@@H]2COCCN2C[C@@H]2CCCC[C@@H]2CC)o1 ZINC001204350305 1049147161 /nfs/dbraw/zinc/14/71/61/1049147161.db2.gz YYURJIWCLNKHPD-BQFCYCMXSA-N 0 1 305.462 4.432 20 0 DIADMN Cc1cc(C)c(/C=C\CN2CCc3ccccc3[C@@H]2CO)c(C)c1 ZINC001204347732 1049147652 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1049157794 /nfs/dbraw/zinc/15/77/94/1049157794.db2.gz FZHWYTSQJYRQOW-IBGZPJMESA-N 0 1 319.408 4.034 20 0 DIADMN CC(=O)n1cc(CN2CCC[C@@H]2c2ccncc2)c2ccccc21 ZINC001204406552 1049158284 /nfs/dbraw/zinc/15/82/84/1049158284.db2.gz FZHWYTSQJYRQOW-LJQANCHMSA-N 0 1 319.408 4.034 20 0 DIADMN C[C@@H]1C(=O)CCN(Cc2ccc(OC(F)F)cc2)C12CCCC2 ZINC001204423890 1049159689 /nfs/dbraw/zinc/15/96/89/1049159689.db2.gz QXDPHLNHOAFNJJ-CYBMUJFWSA-N 0 1 323.383 4.012 20 0 DIADMN COc1cccc2c1CN(Cc1ccc(OC(C)C)cc1)CC2 ZINC001204453274 1049163620 /nfs/dbraw/zinc/16/36/20/1049163620.db2.gz RHTLIYRSWUVFLN-UHFFFAOYSA-N 0 1 311.425 4.041 20 0 DIADMN Cc1nn(-c2ccccc2)c(C)c1CN(C)Cc1ccccc1C ZINC001204447938 1049164562 /nfs/dbraw/zinc/16/45/62/1049164562.db2.gz HTRKFVDWEBPBAM-UHFFFAOYSA-N 0 1 319.452 4.430 20 0 DIADMN CC(C)(C)OC(=O)C[C@@H]1CCCN1Cc1ccc(Cl)s1 ZINC001204445121 1049164621 /nfs/dbraw/zinc/16/46/21/1049164621.db2.gz SXPAEPYWPHNTQQ-NSHDSACASA-N 0 1 315.866 4.098 20 0 DIADMN 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0 1 302.443 4.125 20 0 DIADMN Cc1ccc(NC(=O)CN2C[C@@H](C)CC[C@@H]2c2ccccc2)cc1 ZINC001194222202 1049346296 /nfs/dbraw/zinc/34/62/96/1049346296.db2.gz PZDDJGJXSVVLAH-FXAWDEMLSA-N 0 1 322.452 4.407 20 0 DIADMN C[C@@H](CN(C)Cc1nc(-c2cccs2)no1)CC(C)(C)C ZINC001194240956 1049347736 /nfs/dbraw/zinc/34/77/36/1049347736.db2.gz MLJRSDWAVRKTDN-GFCCVEGCSA-N 0 1 307.463 4.302 20 0 DIADMN CN(Cc1cc2ccncc2s1)Cc1ccc(F)c(F)c1 ZINC001180386985 1049348175 /nfs/dbraw/zinc/34/81/75/1049348175.db2.gz ULKRNMACVBSANT-UHFFFAOYSA-N 0 1 304.365 4.207 20 0 DIADMN C[N@@H+](Cc1ccc(-c2ccccc2C(=O)[O-])o1)C1CCCCC1 ZINC000859779507 1049348888 /nfs/dbraw/zinc/34/88/88/1049348888.db2.gz HIRJKMOHZBQQDA-UHFFFAOYSA-N 0 1 313.397 4.409 20 0 DIADMN Cc1ncsc1CCCN1CC[C@H]1c1ccc(Cl)cc1 ZINC001194268725 1049354332 /nfs/dbraw/zinc/35/43/32/1049354332.db2.gz IYZMVKFXIHIYNM-HNNXBMFYSA-N 0 1 306.862 4.485 20 0 DIADMN COCCN(Cc1cccc(C(F)(F)F)c1Cl)C(C)C ZINC001205050022 1049354384 /nfs/dbraw/zinc/35/43/84/1049354384.db2.gz OPCQEFHEGZCXQE-UHFFFAOYSA-N 0 1 309.759 4.216 20 0 DIADMN CC[C@@H](C[N@H+]1CCC[C@@H](C(C)(C)C(=O)[O-])C1)c1ccccc1 ZINC000859813561 1049354745 /nfs/dbraw/zinc/35/47/45/1049354745.db2.gz MBGPHKUBMZBQKN-DOTOQJQBSA-N 0 1 303.446 4.003 20 0 DIADMN c1ccc([C@@H]2CN(Cc3noc(C4CC4)n3)[C@H]3CCCC[C@H]23)cc1 ZINC000485856791 1049355263 /nfs/dbraw/zinc/35/52/63/1049355263.db2.gz FLSRBWXTKMXFEP-SQNIBIBYSA-N 0 1 323.440 4.105 20 0 DIADMN C[C@@](O)(CN1CC[C@H]1c1ccc(Cl)cc1)c1ccc(F)cc1 ZINC001194269321 1049355337 /nfs/dbraw/zinc/35/53/37/1049355337.db2.gz OFFPPYPWSKEMDT-ZWKOTPCHSA-N 0 1 319.807 4.134 20 0 DIADMN CC(C)N(C(=O)[C@@H](C)N[C@H](C)c1cccc(Cl)c1)C(C)C ZINC000485905554 1049361177 /nfs/dbraw/zinc/36/11/77/1049361177.db2.gz HHUHANVCDDVJJY-ZIAGYGMSSA-N 0 1 310.869 4.025 20 0 DIADMN c1cn(C2CCCC2)nc1CN1C[C@@H]2C[C@@H](c3ccccc3)[C@@H]2C1 ZINC000859930438 1049362470 /nfs/dbraw/zinc/36/24/70/1049362470.db2.gz XOASVUKLNNWKTM-DZFGPLHGSA-N 0 1 321.468 4.234 20 0 DIADMN Oc1ccc(-c2cc(N3CCCCC3)ccn2)c(C(F)(F)F)c1 ZINC001205073659 1049362643 /nfs/dbraw/zinc/36/26/43/1049362643.db2.gz XFPHSHJESSIXLE-UHFFFAOYSA-N 0 1 322.330 4.463 20 0 DIADMN CSC1(CN(C)Cc2ccccc2Br)CCC1 ZINC001180488653 1049364095 /nfs/dbraw/zinc/36/40/95/1049364095.db2.gz SCOXNHLZQQZFRT-UHFFFAOYSA-N 0 1 314.292 4.167 20 0 DIADMN CCOc1ccc(CN(C)Cc2cc(F)cc(OCC)c2)cc1 ZINC001180488344 1049365086 /nfs/dbraw/zinc/36/50/86/1049365086.db2.gz JHCJARIEYFUSSB-UHFFFAOYSA-N 0 1 317.404 4.255 20 0 DIADMN CCN(Cc1ccc(Cl)cc1)Cc1ccc2c(n1)CCC2 ZINC001204270178 1049366974 /nfs/dbraw/zinc/36/69/74/1049366974.db2.gz KQKVAZYRDBQLBC-UHFFFAOYSA-N 0 1 300.833 4.246 20 0 DIADMN CC[C@@H]1CCC[C@H](CN(C)CC(=O)Nc2ccccc2Cl)C1 ZINC001204270312 1049367184 /nfs/dbraw/zinc/36/71/84/1049367184.db2.gz LLCCRCHARDIMAZ-CABCVRRESA-N 0 1 322.880 4.427 20 0 DIADMN C[C@@H](c1ccc(Cl)c(Cl)c1)[N@H+]1C[C@@H](C)[C@@](C)(C(=O)[O-])C1 ZINC000569229430 1049369210 /nfs/dbraw/zinc/36/92/10/1049369210.db2.gz IWVBOZZWQIQMOZ-FTGAXOIBSA-N 0 1 316.228 4.097 20 0 DIADMN FC(F)(F)Cc1ccc(CN2CCc3sccc3C2)cc1 ZINC001180513306 1049369974 /nfs/dbraw/zinc/36/99/74/1049369974.db2.gz BWKRAXRGYDLTEM-UHFFFAOYSA-N 0 1 311.372 4.411 20 0 DIADMN Cc1csc2nc(C)c(CN3CCC[C@H]3c3cccs3)n12 ZINC001205087921 1049370673 /nfs/dbraw/zinc/37/06/73/1049370673.db2.gz FRNMHBKLYCMSAH-ZDUSSCGKSA-N 0 1 317.483 4.411 20 0 DIADMN C[N@H+](Cc1ccc([O-])c(F)c1F)[C@@H]1CCCc2ccccc21 ZINC001205093415 1049374904 /nfs/dbraw/zinc/37/49/04/1049374904.db2.gz DQWRISSUYZGZSA-OAHLLOKOSA-N 0 1 303.352 4.180 20 0 DIADMN C[N@@H+](Cc1ccc([O-])c(F)c1F)[C@@H]1CCCc2ccccc21 ZINC001205093415 1049374915 /nfs/dbraw/zinc/37/49/15/1049374915.db2.gz DQWRISSUYZGZSA-OAHLLOKOSA-N 0 1 303.352 4.180 20 0 DIADMN Cc1cc(CN(C)[C@@H](C)c2nc3ccc(Cl)cc3[nH]2)sn1 ZINC001194458326 1049375103 /nfs/dbraw/zinc/37/51/03/1049375103.db2.gz QZSAHDLXTDAHSA-JTQLQIEISA-N 0 1 320.849 4.174 20 0 DIADMN O=C([O-])c1c(F)ccc(-c2ccc3c(c2)[nH]c2cc[nH+]cc23)c1F ZINC001205106312 1049379404 /nfs/dbraw/zinc/37/94/04/1049379404.db2.gz DBOJJEKVCUWDLL-UHFFFAOYSA-N 0 1 324.286 4.360 20 0 DIADMN COc1ccc(CN(Cc2ccccc2OC)C2CC2)c(C)c1 ZINC001180558889 1049381999 /nfs/dbraw/zinc/38/19/99/1049381999.db2.gz YNJMNWHIOFJYAL-UHFFFAOYSA-N 0 1 311.425 4.177 20 0 DIADMN Cc1nn(C)c(CN[C@@H]2c3ccccc3CCC[C@H]2C)c1Cl ZINC001180623285 1049385579 /nfs/dbraw/zinc/38/55/79/1049385579.db2.gz PLJLTXGHUVOXRJ-XIKOKIGWSA-N 0 1 317.864 4.185 20 0 DIADMN CC(C)(C)c1cnc(CNC[C@]2(O)CCCC(C)(C)CC2)s1 ZINC001203364002 1049386464 /nfs/dbraw/zinc/38/64/64/1049386464.db2.gz ZAIQJIYNWBRZAN-SFHVURJKSA-N 0 1 324.534 4.252 20 0 DIADMN CC(C)(C)c1cnc(CNC[C@@]2(O)CCCC(C)(C)CC2)s1 ZINC001203364001 1049387230 /nfs/dbraw/zinc/38/72/30/1049387230.db2.gz ZAIQJIYNWBRZAN-GOSISDBHSA-N 0 1 324.534 4.252 20 0 DIADMN Cc1ccc(C(C)(C)C(=O)Nc2nc3cccc(C)c3[nH]2)cc1 ZINC001180602080 1049387698 /nfs/dbraw/zinc/38/76/98/1049387698.db2.gz GIKXEWIGKWDXDR-UHFFFAOYSA-N 0 1 307.397 4.096 20 0 DIADMN C[C@@H](c1ccc(F)cc1)N(C)Cc1ccc(Br)nc1 ZINC001205129881 1049388510 /nfs/dbraw/zinc/38/85/10/1049388510.db2.gz CIKIOVNTDHIIKQ-NSHDSACASA-N 0 1 323.209 4.176 20 0 DIADMN CCN(Cc1ccc(OC)cc1Br)C(C)(C)C ZINC001194654416 1049404639 /nfs/dbraw/zinc/40/46/39/1049404639.db2.gz AQKAQIFCFGQQIL-UHFFFAOYSA-N 0 1 300.240 4.078 20 0 DIADMN CC(C)[C@@H](C)N(Cc1nnn(-c2ccccc2)c1C1CC1)C1CC1 ZINC001205143379 1049392569 /nfs/dbraw/zinc/39/25/69/1049392569.db2.gz IRWFTPAFJOKTPC-OAHLLOKOSA-N 0 1 324.472 4.154 20 0 DIADMN c1cc(CN2CCCCC[C@@H]2c2ccncc2)n(CC2CCC2)n1 ZINC001205148590 1049394185 /nfs/dbraw/zinc/39/41/85/1049394185.db2.gz JDFBLCOSTLZSMW-HXUWFJFHSA-N 0 1 324.472 4.196 20 0 DIADMN CCC[C@@H](OCC)C(=O)O[C@H](C)c1nc2ccc(Cl)cc2[nH]1 ZINC000860538884 1049394600 /nfs/dbraw/zinc/39/46/00/1049394600.db2.gz AGJYXJIJIVNJQX-QMTHXVAHSA-N 0 1 324.808 4.026 20 0 DIADMN CCOc1cc(CN2CCC[C@H](CCF)C2)cc(Cl)c1O ZINC000668593057 1049397586 /nfs/dbraw/zinc/39/75/86/1049397586.db2.gz XMSHCRDDKXRYHZ-GFCCVEGCSA-N 0 1 315.816 4.016 20 0 DIADMN Cc1nc2scc(C3CC3)n2c1CN1CCC[C@H](CCF)C1 ZINC000668592991 1049398504 /nfs/dbraw/zinc/39/85/04/1049398504.db2.gz VYRQBBKKBVZHBU-CYBMUJFWSA-N 0 1 321.465 4.153 20 0 DIADMN Cn1cccc1[C@H]1CCCN1Cc1ccccc1CC(F)(F)F ZINC001205163196 1049398893 /nfs/dbraw/zinc/39/88/93/1049398893.db2.gz XBXHCYYPFHAULH-QGZVFWFLSA-N 0 1 322.374 4.467 20 0 DIADMN Cc1cccc(-c2ccc(CNCc3c(C)ccnc3N)cc2)c1 ZINC001180787365 1049405199 /nfs/dbraw/zinc/40/51/99/1049405199.db2.gz MVWRKNPMDYWKMR-UHFFFAOYSA-N 0 1 317.436 4.237 20 0 DIADMN C[C@@H]1COc2ccccc2CN1Cc1ccc(OCC2CC2)cc1 ZINC001180811168 1049409553 /nfs/dbraw/zinc/40/95/53/1049409553.db2.gz QUSZKBOTOPBYNK-MRXNPFEDSA-N 0 1 323.436 4.259 20 0 DIADMN CSC(C)(C)CCN1CCc2[nH]c3ccc(F)cc3c2C1 ZINC001180847701 1049410425 /nfs/dbraw/zinc/41/04/25/1049410425.db2.gz AXHYCFNRFPPNBL-UHFFFAOYSA-N 0 1 306.450 4.197 20 0 DIADMN Fc1cccc(F)c1CN1CCC[C@H]1COc1ccccc1 ZINC001194682907 1049410581 /nfs/dbraw/zinc/41/05/81/1049410581.db2.gz ILWODDBABBZMDO-AWEZNQCLSA-N 0 1 303.352 4.008 20 0 DIADMN Cc1cc(CN2CCC[C@@H](CC(=O)OC(C)C)C2)ccc1Cl ZINC001205231098 1049412829 /nfs/dbraw/zinc/41/28/29/1049412829.db2.gz QVAIGDQOLMWGPP-HNNXBMFYSA-N 0 1 323.864 4.202 20 0 DIADMN Cc1ccc(CN2CCC(Oc3ccc(F)cc3)CC2)cc1F ZINC001205228212 1049413411 /nfs/dbraw/zinc/41/34/11/1049413411.db2.gz REUBMTFYPYGFPI-UHFFFAOYSA-N 0 1 317.379 4.317 20 0 DIADMN CN(Cc1cc2cnccc2o1)Cc1ccc(F)c(Cl)c1 ZINC001180873030 1049413701 /nfs/dbraw/zinc/41/37/01/1049413701.db2.gz JTPMUOBKZWVXIN-UHFFFAOYSA-N 0 1 304.752 4.252 20 0 DIADMN COC(=O)c1cnc([C@@H](C)NCC[C@H](C)CC(C)(C)C)s1 ZINC001180906352 1049416706 /nfs/dbraw/zinc/41/67/06/1049416706.db2.gz KYJPVHVJBKLTTM-NWDGAFQWSA-N 0 1 312.479 4.043 20 0 DIADMN C[C@H]1CN([C@@H]2CCCc3ccc(F)cc32)Cc2ccccc2O1 ZINC001194764854 1049426987 /nfs/dbraw/zinc/42/69/87/1049426987.db2.gz OOEZJYSRGVLMJQ-IFXJQAMLSA-N 0 1 311.400 4.486 20 0 DIADMN Cc1cc(CNC(=O)C(C2CCCCC2)C2CCCCC2)n[nH]1 ZINC001180983721 1049428142 /nfs/dbraw/zinc/42/81/42/1049428142.db2.gz PMDPZTQGFGGTBE-UHFFFAOYSA-N 0 1 317.477 4.111 20 0 DIADMN CC[C@H]1CC[N@@H+](Cc2cnn(Cc3ccccc3)c2Cl)[C@@H]1C ZINC001181043218 1049430258 /nfs/dbraw/zinc/43/02/58/1049430258.db2.gz KZBWUIAYCXGSLW-ZBFHGGJFSA-N 0 1 317.864 4.205 20 0 DIADMN CC[C@H]1CCN(Cc2cnn(Cc3ccccc3)c2Cl)[C@@H]1C ZINC001181043218 1049430261 /nfs/dbraw/zinc/43/02/61/1049430261.db2.gz KZBWUIAYCXGSLW-ZBFHGGJFSA-N 0 1 317.864 4.205 20 0 DIADMN CC[C@@H]1CC[N@@H+](Cc2cc(Br)c(C)s2)[C@@H]1C ZINC001181041700 1049430426 /nfs/dbraw/zinc/43/04/26/1049430426.db2.gz BCKQJIRHKADVEB-MWLCHTKSSA-N 0 1 302.281 4.439 20 0 DIADMN C[C@]1(c2ccc(F)cc2)CN(Cc2cccc3[nH]ccc32)CCO1 ZINC001205297769 1049430850 /nfs/dbraw/zinc/43/08/50/1049430850.db2.gz JTUGPYKBXJZCEO-HXUWFJFHSA-N 0 1 324.399 4.055 20 0 DIADMN Fc1ccc(Br)cc1CN1CCC[C@@H](C2CC2)C1 ZINC001194804833 1049431212 /nfs/dbraw/zinc/43/12/12/1049431212.db2.gz FDKFFQLEUFZRTJ-GFCCVEGCSA-N 0 1 312.226 4.210 20 0 DIADMN c1nc(C2CCC2)sc1CN1CCC([C@@H]2CCCCO2)CC1 ZINC000668627120 1049433321 /nfs/dbraw/zinc/43/33/21/1049433321.db2.gz DQGQPSMLSPICST-KRWDZBQOSA-N 0 1 320.502 4.192 20 0 DIADMN CC[C@@H]1[C@@H](C)CCN1Cc1cccc(F)c1OC(F)(F)F ZINC001181102857 1049438692 /nfs/dbraw/zinc/43/86/92/1049438692.db2.gz SMJWQTDUGOPJPS-GXFFZTMASA-N 0 1 305.315 4.345 20 0 DIADMN CC1(C)CN(C/C=C\c2ccc(Cl)cc2)[C@@H]1[C@H]1CCCO1 ZINC001194863657 1049439671 /nfs/dbraw/zinc/43/96/71/1049439671.db2.gz JIUMQWYSQVSAKP-NNCADPFVSA-N 0 1 305.849 4.243 20 0 DIADMN C[C@H](NCc1ccnc(N(C)C)c1)c1ccc(Cl)cc1Cl ZINC000773903917 1049443027 /nfs/dbraw/zinc/44/30/27/1049443027.db2.gz FTNJADGWNOFMGC-NSHDSACASA-N 0 1 324.255 4.305 20 0 DIADMN COc1ccc([C@@H](Cc2ccccc2)NCc2ccns2)cc1 ZINC001194847228 1049444122 /nfs/dbraw/zinc/44/41/22/1049444122.db2.gz XXKLDHTZZPBUDK-LJQANCHMSA-N 0 1 324.449 4.225 20 0 DIADMN CC(C)(C)c1nc(CN2CC3(CCCC3)[C@@H]2c2ccccc2)n[nH]1 ZINC001194914642 1049447184 /nfs/dbraw/zinc/44/71/84/1049447184.db2.gz OYUNZAZMYIGRNF-KRWDZBQOSA-N 0 1 324.472 4.220 20 0 DIADMN C[C@H](NCC(=O)N(C)[C@@H]1CCCC[C@@H]1C)c1ccc(Cl)cc1 ZINC001194931217 1049450463 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C[C@H](c1ccco1)N(C)Cc1cccc(OCC(F)(F)F)c1 ZINC000069065305 1052778325 /nfs/dbraw/zinc/77/83/25/1052778325.db2.gz ZGZFXEIFXSLTKA-GFCCVEGCSA-N 0 1 313.319 4.414 20 0 DIADMN CCC[C@H](N[C@H]1CCc2ccc(C)cc21)c1nnc2ccccn21 ZINC000129293079 1052782501 /nfs/dbraw/zinc/78/25/01/1052782501.db2.gz QEXIXULGPCEDRY-ROUUACIJSA-N 0 1 320.440 4.156 20 0 DIADMN CCC[C@H](N[C@@H](C)c1ccc(C)cc1)c1nnc2ccccn21 ZINC000129395771 1052786726 /nfs/dbraw/zinc/78/67/26/1052786726.db2.gz IGJBDKIHFOSYCM-RDJZCZTQSA-N 0 1 308.429 4.230 20 0 DIADMN Cc1ccc(O[C@H]2CCN(Cc3ccc(Cl)cc3)C2)c(C)n1 ZINC001225433373 1052788708 /nfs/dbraw/zinc/78/87/08/1052788708.db2.gz OLRWDAIHYXQVDY-KRWDZBQOSA-N 0 1 316.832 4.005 20 0 DIADMN COc1cccc(CN[C@H](C)c2ccc(F)c3ccccc32)n1 ZINC000556076272 1052796254 /nfs/dbraw/zinc/79/62/54/1052796254.db2.gz LWYTYWAFWJNSJY-CYBMUJFWSA-N 0 1 310.372 4.233 20 0 DIADMN C[C@H](N[C@H]1COc2ccccc2C1)c1nc(C(C)(C)C)cs1 ZINC000556075651 1052796288 /nfs/dbraw/zinc/79/62/88/1052796288.db2.gz 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4.084 20 0 DIADMN Cc1nccnc1CN[C@@H](c1ccc(CC(C)C)cc1)C(C)C ZINC000621326975 1053946789 /nfs/dbraw/zinc/94/67/89/1053946789.db2.gz ZXMMGSKDQAEPPT-HXUWFJFHSA-N 0 1 311.473 4.470 20 0 DIADMN Cc1cccc(CN(C)Cc2ncc(Br)cc2C)c1 ZINC001232045477 1053947341 /nfs/dbraw/zinc/94/73/41/1053947341.db2.gz UPUSMGGNYOSWNY-UHFFFAOYSA-N 0 1 319.246 4.093 20 0 DIADMN Cc1nccnc1CNC1(c2ccc(Cl)cc2)CCCCC1 ZINC000621332859 1053949291 /nfs/dbraw/zinc/94/92/91/1053949291.db2.gz KDGQPRMTSDVGDR-UHFFFAOYSA-N 0 1 315.848 4.388 20 0 DIADMN Cc1cc(Br)cnc1CN1CCC2(C1)CCCCC2 ZINC001232051568 1053949610 /nfs/dbraw/zinc/94/96/10/1053949610.db2.gz LHUPBIAULYHICL-UHFFFAOYSA-N 0 1 323.278 4.309 20 0 DIADMN Cn1nc(C(F)F)c(C[N@H+]2CCC[C@H]3CCCC[C@@H]32)c1Cl ZINC001232055806 1053951620 /nfs/dbraw/zinc/95/16/20/1053951620.db2.gz UPVNTQVFGXKHFV-PWSUYJOCSA-N 0 1 317.811 4.166 20 0 DIADMN Cn1nc(C(F)F)c(CN2CCC[C@H]3CCCC[C@@H]32)c1Cl ZINC001232055806 1053951632 /nfs/dbraw/zinc/95/16/32/1053951632.db2.gz UPVNTQVFGXKHFV-PWSUYJOCSA-N 0 1 317.811 4.166 20 0 DIADMN CCOc1cncc(CNCc2ccc(C(F)(F)F)cc2C)c1 ZINC000621347455 1053953138 /nfs/dbraw/zinc/95/31/38/1053953138.db2.gz FQNKRDACIXWGIQ-UHFFFAOYSA-N 0 1 324.346 4.097 20 0 DIADMN Cc1cnc(CN2CCC[C@H](C)[C@H](C)C2)c(Br)c1 ZINC001232172513 1053979086 /nfs/dbraw/zinc/97/90/86/1053979086.db2.gz HTSJWBSAOMSTQJ-QWHCGFSZSA-N 0 1 311.267 4.021 20 0 DIADMN Fc1ccc([C@H]2CCN(Cc3cccc(C(F)(F)F)n3)C2)cc1 ZINC001232071920 1053955855 /nfs/dbraw/zinc/95/58/55/1053955855.db2.gz UEWLRHGZQRKYTR-ZDUSSCGKSA-N 0 1 324.321 4.229 20 0 DIADMN FC(F)(F)c1ccc(C2(NCc3ccccn3)CCC2)cc1 ZINC000621352126 1053956378 /nfs/dbraw/zinc/95/63/78/1053956378.db2.gz OLMMDLCXRSNKBL-UHFFFAOYSA-N 0 1 306.331 4.269 20 0 DIADMN CN(Cc1cccc(C(F)(F)F)n1)[C@H]1CCc2ccccc21 ZINC001232072697 1053956494 /nfs/dbraw/zinc/95/64/94/1053956494.db2.gz DZEPBIKEBHLYBX-HNNXBMFYSA-N 0 1 306.331 4.220 20 0 DIADMN CCCc1ccc(CN[C@@H](CCO)c2ccccc2F)s1 ZINC000621368128 1053956737 /nfs/dbraw/zinc/95/67/37/1053956737.db2.gz 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/nfs/dbraw/zinc/96/96/48/1053969648.db2.gz GCQWADMPYPDCCS-HZPDHXFCSA-N 0 1 315.486 4.183 20 0 DIADMN Cc1ccc(C(C)(C)CNCc2csc(C(C)C)n2)nc1 ZINC001329174665 1053971353 /nfs/dbraw/zinc/97/13/53/1053971353.db2.gz XQJSTUKSKRHSNF-UHFFFAOYSA-N 0 1 303.475 4.037 20 0 DIADMN CCC[C@@H]1CCCCN1Cc1ncc(C)cc1Br ZINC001232175123 1053978776 /nfs/dbraw/zinc/97/87/76/1053978776.db2.gz AXJKSAJBNXMWOF-CYBMUJFWSA-N 0 1 311.267 4.307 20 0 DIADMN Cn1cc(CN2CCCC[C@H]2c2ccccc2F)c(C2CC2)n1 ZINC001232171399 1053980284 /nfs/dbraw/zinc/98/02/84/1053980284.db2.gz SCNGCDUIORMZOB-SFHVURJKSA-N 0 1 313.420 4.164 20 0 DIADMN Cc1cnc(CN2CCC[C@@H]3CCCC[C@H]32)c(Br)c1 ZINC001232177529 1053980576 /nfs/dbraw/zinc/98/05/76/1053980576.db2.gz VKWWFSFBXPCNAF-XJKSGUPXSA-N 0 1 323.278 4.307 20 0 DIADMN c1cc(CN(CCc2ccccc2)Cc2ccccc2)sn1 ZINC001232191862 1053983136 /nfs/dbraw/zinc/98/31/36/1053983136.db2.gz KDOHVOWARYSBHQ-UHFFFAOYSA-N 0 1 308.450 4.388 20 0 DIADMN O=C(Nc1nc2ccc(Cl)cc2s1)c1cccc(F)c1O ZINC001354845219 1053984680 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ZINC001329590830 1053999194 /nfs/dbraw/zinc/99/91/94/1053999194.db2.gz YMKHUWYXFOGOSB-ARWYELJZSA-N 0 1 318.342 4.088 20 0 DIADMN COc1ccc(CN(C)Cc2cccn2Cc2ccccc2)cc1 ZINC001232235303 1053999263 /nfs/dbraw/zinc/99/92/63/1053999263.db2.gz JPXBUPRHKTUHOX-UHFFFAOYSA-N 0 1 320.436 4.177 20 0 DIADMN C[N@@H+](Cc1ccnc(C(F)(F)F)c1)[C@H]1CCc2ccccc21 ZINC001232242690 1054003469 /nfs/dbraw/zinc/00/34/69/1054003469.db2.gz FKZGXWOPOQFPLF-HNNXBMFYSA-N 0 1 306.331 4.220 20 0 DIADMN CCc1sc(CN2CC[C@@](C)(CF)C2)cc1Br ZINC001232288015 1054013967 /nfs/dbraw/zinc/01/39/67/1054013967.db2.gz ZQSRMTACTNVCQH-ZDUSSCGKSA-N 0 1 320.271 4.255 20 0 DIADMN COc1ccc(F)c(CN[C@@H](C)c2ccc(OC)c(Cl)c2)c1 ZINC000621766304 1054010903 /nfs/dbraw/zinc/01/09/03/1054010903.db2.gz PZDKFEQJTJQSLJ-NSHDSACASA-N 0 1 323.795 4.347 20 0 DIADMN COc1cc([C@@H](C)N[C@@H](c2nc3ccccc3[nH]2)C(C)C)ccn1 ZINC001329939320 1054011167 /nfs/dbraw/zinc/01/11/67/1054011167.db2.gz HUQAHHCZXHPXOL-FZKQIMNGSA-N 0 1 324.428 4.014 20 0 DIADMN COc1ccc(F)c(CN[C@@H]2CCCOc3cc(C)ccc32)c1 ZINC000621766333 1054011767 /nfs/dbraw/zinc/01/17/67/1054011767.db2.gz QITAVGYLVSZHAM-GOSISDBHSA-N 0 1 315.388 4.146 20 0 DIADMN Fc1ccc(N2CCCN(Cc3cc(Cl)cs3)CC2)cc1 ZINC001232283018 1054012284 /nfs/dbraw/zinc/01/22/84/1054012284.db2.gz JVRWTCZJGDCREX-UHFFFAOYSA-N 0 1 324.852 4.253 20 0 DIADMN C[C@H](NC1(c2ccc(C(F)(F)F)cc2)CCC1)c1ccncn1 ZINC000621768567 1054012628 /nfs/dbraw/zinc/01/26/28/1054012628.db2.gz RFSCETPVHZZOBF-LBPRGKRZSA-N 0 1 321.346 4.225 20 0 DIADMN C[C@H](NC1(c2ccc(C(F)(F)F)cc2)CCC1)c1ccnn1C ZINC000621768835 1054014342 /nfs/dbraw/zinc/01/43/42/1054014342.db2.gz VSHNOPBQOVYHAJ-LBPRGKRZSA-N 0 1 323.362 4.169 20 0 DIADMN CC1CC(CN[C@@H](c2cccnc2)c2ccc(F)cc2F)C1 ZINC000621771788 1054015434 /nfs/dbraw/zinc/01/54/34/1054015434.db2.gz MQCMBSWHWAMQHD-KJBLDROHSA-N 0 1 302.368 4.085 20 0 DIADMN Cc1sc(CN2CC3CCC2CC3)cc1Br ZINC001232294294 1054018238 /nfs/dbraw/zinc/01/82/38/1054018238.db2.gz ZTWQNGMPGDAOLV-UHFFFAOYSA-N 0 1 300.265 4.193 20 0 DIADMN CCOc1ccc(CN2CCC[C@@H]2c2ccc(F)cc2)c(C)n1 ZINC001232308273 1054017616 /nfs/dbraw/zinc/01/76/16/1054017616.db2.gz OPPXRRVQYKZXCR-GOSISDBHSA-N 0 1 314.404 4.265 20 0 DIADMN CCOc1ccc(CN2CCC[C@@H]2c2cccc(F)c2)c(C)n1 ZINC001232312421 1054019697 /nfs/dbraw/zinc/01/96/97/1054019697.db2.gz DRMPIDATQJZJTD-GOSISDBHSA-N 0 1 314.404 4.265 20 0 DIADMN CCOc1ccc(CN2CCC[C@H]2c2ccccc2F)c(C)n1 ZINC001232313126 1054021337 /nfs/dbraw/zinc/02/13/37/1054021337.db2.gz OATMBQYOBKBTSK-SFHVURJKSA-N 0 1 314.404 4.265 20 0 DIADMN CS[C@@H]1CC[C@H](N(C)Cc2coc(-c3cccc(F)c3)n2)C1 ZINC001330088277 1054022443 /nfs/dbraw/zinc/02/24/43/1054022443.db2.gz BFFFYWZUVLTEOE-JKSUJKDBSA-N 0 1 320.433 4.197 20 0 DIADMN COc1ccc(CN2CCC[C@H]2c2ccc(Cl)cc2)c(C)n1 ZINC001232334284 1054023875 /nfs/dbraw/zinc/02/38/75/1054023875.db2.gz YMWKCGLTMORXMV-KRWDZBQOSA-N 0 1 316.832 4.389 20 0 DIADMN COc1cc(C)c(CN(C)Cc2ccc3ccccc3c2)cn1 ZINC001232354589 1054025710 /nfs/dbraw/zinc/02/57/10/1054025710.db2.gz RGARWBAVHJKSHC-UHFFFAOYSA-N 0 1 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Cc1cc(Br)sc1C[N@H+]1CC[C@](C)(CF)C1 ZINC001236830831 1055280397 /nfs/dbraw/zinc/28/03/97/1055280397.db2.gz WULRQPHVXLWUFX-GFCCVEGCSA-N 0 1 306.244 4.001 20 0 DIADMN Cc1cc(Br)sc1CN1CC[C@](C)(CF)C1 ZINC001236830831 1055280412 /nfs/dbraw/zinc/28/04/12/1055280412.db2.gz WULRQPHVXLWUFX-GFCCVEGCSA-N 0 1 306.244 4.001 20 0 DIADMN Cc1ccc(F)c(NC(=O)c2cccc3nc(C(F)F)[nH]c32)c1 ZINC001587377796 1055283294 /nfs/dbraw/zinc/28/32/94/1055283294.db2.gz PNZWDLNRMPYESG-UHFFFAOYSA-N 0 1 319.286 4.200 20 0 DIADMN COc1cc(CN2CC[C@@H](c3ccc(F)cc3)C2)c(F)cc1F ZINC001236836131 1055283504 /nfs/dbraw/zinc/28/35/04/1055283504.db2.gz XYRXYQMVIZAHGC-CYBMUJFWSA-N 0 1 321.342 4.102 20 0 DIADMN COc1cc(CN2CCC3(CC[C@@H](F)C3)CC2)c(F)cc1F ZINC001236832162 1055285104 /nfs/dbraw/zinc/28/51/04/1055285104.db2.gz UBFBHCXUVVGCTK-CYBMUJFWSA-N 0 1 313.363 4.078 20 0 DIADMN Cc1cc(Br)sc1CN1CCC2(CCC2)C1 ZINC001236834158 1055285434 /nfs/dbraw/zinc/28/54/34/1055285434.db2.gz VGYXWGFAMIUAJW-UHFFFAOYSA-N 0 1 300.265 4.195 20 0 DIADMN CCOc1cncc(CN(C)Cc2cccc3ccccc32)c1 ZINC001236838644 1055287912 /nfs/dbraw/zinc/28/79/12/1055287912.db2.gz NOMDWKNUJVRKIG-UHFFFAOYSA-N 0 1 306.409 4.266 20 0 DIADMN Cc1cccc(CN2CCC(Oc3ccccn3)CC2)c1Cl ZINC001236853305 1055293316 /nfs/dbraw/zinc/29/33/16/1055293316.db2.gz JHLQDIQFYYMWKJ-UHFFFAOYSA-N 0 1 316.832 4.087 20 0 DIADMN CC1CC(N(C)Cc2cc3c(F)cc(F)cc3nc2Cl)C1 ZINC001236869154 1055298598 /nfs/dbraw/zinc/29/85/98/1055298598.db2.gz DSNQTLDKLSARGV-UHFFFAOYSA-N 0 1 310.775 4.397 20 0 DIADMN Cc1cc(NCc2cccc(C(F)(F)F)c2C)nc2[nH]cnc21 ZINC001168534816 1055299227 /nfs/dbraw/zinc/29/92/27/1055299227.db2.gz OKVWWYHSSCCNND-UHFFFAOYSA-N 0 1 320.318 4.206 20 0 DIADMN FC1(F)CC[C@@H]2CN(Cc3nc4ccccc4cc3Cl)C[C@@H]21 ZINC001236866855 1055299601 /nfs/dbraw/zinc/29/96/01/1055299601.db2.gz CSISAEHMECBQTL-OLZOCXBDSA-N 0 1 322.786 4.365 20 0 DIADMN CC(C)CN1Cc2cccc(NC(=O)C=C3CCCCC3)c2C1 ZINC000764932634 1055299945 /nfs/dbraw/zinc/29/99/45/1055299945.db2.gz CUCKHFGIJJFMEH-UHFFFAOYSA-N 0 1 312.457 4.487 20 0 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CC(C)c1cc([C@H]2CCCN(Cc3cc(F)cc(F)c3)C2)n[nH]1 ZINC001473773077 1061403744 /nfs/dbraw/zinc/40/37/44/1061403744.db2.gz PRWWMKUKUOVBHZ-AWEZNQCLSA-N 0 1 319.399 4.191 20 0 DIADMN Cc1cccc2nc(-c3cc(O)c(C)cc3Br)[nH]c21 ZINC001251575249 1061408655 /nfs/dbraw/zinc/40/86/55/1061408655.db2.gz UTUWEZMHVBXKSX-UHFFFAOYSA-N 0 1 317.186 4.315 20 0 DIADMN Fc1cc(-c2nc3ccc(C(F)(F)F)cc3[nH]2)cnc1Cl ZINC001251594527 1061411861 /nfs/dbraw/zinc/41/18/61/1061411861.db2.gz LVTYADXSYJVTOI-UHFFFAOYSA-N 0 1 315.657 4.436 20 0 DIADMN CCCCC[C@@](C)(CC)C(=O)NCc1nc2ccc(C)cc2[nH]1 ZINC001457145708 1061412375 /nfs/dbraw/zinc/41/23/75/1061412375.db2.gz SMZGEDRFZLMFSW-LJQANCHMSA-N 0 1 315.461 4.484 20 0 DIADMN CCC(=CC(=O)Nc1c2nn[nH]c2ccc1C)c1ccc(C)cc1 ZINC001457146193 1061412799 /nfs/dbraw/zinc/41/27/99/1061412799.db2.gz ATTICLKMBBIOCX-SDNWHVSQSA-N 0 1 320.396 4.007 20 0 DIADMN CCCCC[C@](C)(CC)C(=O)NCc1nc2ccc(C)cc2[nH]1 ZINC001457145699 1061413174 /nfs/dbraw/zinc/41/31/74/1061413174.db2.gz SMZGEDRFZLMFSW-IBGZPJMESA-N 0 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CCCC1CCN([C@@H](C)C(=O)Nc2ccc(Cl)cc2)CC1 ZINC001459604510 1062238901 /nfs/dbraw/zinc/23/89/01/1062238901.db2.gz ZWYDORMSWYLAQH-ZDUSSCGKSA-N 0 1 308.853 4.179 20 0 DIADMN CN(Cc1cc(F)ccc1F)[C@H]1CCCN(c2ccccc2)C1 ZINC001459612385 1062243097 /nfs/dbraw/zinc/24/30/97/1062243097.db2.gz DYKFAACIJNVYGA-SFHVURJKSA-N 0 1 316.395 4.066 20 0 DIADMN CC1(C)CN(C[C@H](O)c2ccc(Cl)cc2Cl)C1(C)C ZINC001459607927 1062244079 /nfs/dbraw/zinc/24/40/79/1062244079.db2.gz GULNPELHVNIPDB-ZDUSSCGKSA-N 0 1 302.245 4.147 20 0 DIADMN CC(C)[C@@H]1N(Cc2ccc(OC(F)F)cc2F)CC1(C)C ZINC001474549588 1062245382 /nfs/dbraw/zinc/24/53/82/1062245382.db2.gz KWVBPOIGIALLJV-AWEZNQCLSA-N 0 1 301.352 4.294 20 0 DIADMN CC(C)c1ccc(-c2nnc(-c3cccc4cncn43)o2)cc1 ZINC001254837201 1062259356 /nfs/dbraw/zinc/25/93/56/1062259356.db2.gz FEPHTCHNFRZNQN-UHFFFAOYSA-N 0 1 304.353 4.175 20 0 DIADMN CC[C@@H](C)N1CCN(C(=O)c2c(C)ccc3cc(C)ccc32)CC1 ZINC001468086918 1062260430 /nfs/dbraw/zinc/26/04/30/1062260430.db2.gz COILKAKNMLYNDH-QGZVFWFLSA-N 0 1 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C[C@@H](c1ccc(Cl)c(Cl)c1)N1CCC[C@@](O)(C2CC2)C1 ZINC001460388165 1062827524 /nfs/dbraw/zinc/82/75/24/1062827524.db2.gz FJISKFJRXVDEOK-ZBEGNZNMSA-N 0 1 314.256 4.291 20 0 DIADMN CC(C)Cc1nnc([C@H](c2ccccc2)N2CCCCCC2)o1 ZINC001256449862 1062829351 /nfs/dbraw/zinc/82/93/51/1062829351.db2.gz GYSSFPXQSNNLCA-SFHVURJKSA-N 0 1 313.445 4.234 20 0 DIADMN CC1(C)CC[C@H](CN2CC3(CCCC3)[C@H]2c2ccco2)OC1 ZINC001460389506 1062829821 /nfs/dbraw/zinc/82/98/21/1062829821.db2.gz JOVJGZBMMUKLNA-NVXWUHKLSA-N 0 1 303.446 4.402 20 0 DIADMN CN(Cc1cc(Cl)ccc1Cl)[C@@H](CO)Cc1ccccc1 ZINC001460419533 1062847404 /nfs/dbraw/zinc/84/74/04/1062847404.db2.gz PZCHAIGGHCLGHO-MRXNPFEDSA-N 0 1 324.251 4.029 20 0 DIADMN O=C(N[C@H]1CCc2ccc(Cl)cc21)c1ccc(O)c(Cl)c1 ZINC001470740373 1062849041 /nfs/dbraw/zinc/84/90/41/1062849041.db2.gz UEDNBYKBMQGKHT-AWEZNQCLSA-N 0 1 322.191 4.116 20 0 DIADMN COc1ccc2c(c1)CCN([C@@H]1CCc3cc(Cl)ccc31)C2 ZINC001460441020 1062855831 /nfs/dbraw/zinc/85/58/31/1062855831.db2.gz 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/nfs/dbraw/zinc/87/75/28/1062877528.db2.gz OLZFVXFPZFLUTL-NRFANRHFSA-N 0 1 324.443 4.252 20 0 DIADMN CCc1cc(=O)[n-]c(C[N@H+](C(C)C)[C@H](CC)c2ccccc2)n1 ZINC001460491898 1062880565 /nfs/dbraw/zinc/88/05/65/1062880565.db2.gz XXZKTIJZWIJURY-QGZVFWFLSA-N 0 1 313.445 4.106 20 0 DIADMN CCc1cc(=O)[n-]c(C[N@@H+](C(C)C)[C@H](CC)c2ccccc2)n1 ZINC001460491898 1062880579 /nfs/dbraw/zinc/88/05/79/1062880579.db2.gz XXZKTIJZWIJURY-QGZVFWFLSA-N 0 1 313.445 4.106 20 0 DIADMN CC(C)CC1(NCc2ncc(Br)cc2Cl)CC1 ZINC001460489621 1062882500 /nfs/dbraw/zinc/88/25/00/1062882500.db2.gz UWXJYWWJTZFUGV-UHFFFAOYSA-N 0 1 317.658 4.166 20 0 DIADMN Cc1ccc(-c2nnc(-c3cn[nH]c3-c3ccccc3)o2)cc1C ZINC001256582377 1062903669 /nfs/dbraw/zinc/90/36/69/1062903669.db2.gz HCDQQFDOHHQACO-UHFFFAOYSA-N 0 1 316.364 4.411 20 0 DIADMN Cc1ccc(-c2nnc(-c3ccc(Cl)c(O)c3)o2)cc1C ZINC001256597012 1062909340 /nfs/dbraw/zinc/90/93/40/1062909340.db2.gz XTBYVEWSFVGRTQ-UHFFFAOYSA-N 0 1 300.745 4.379 20 0 DIADMN C/C=C\C[C@H]1CCCN(CC(=O)Nc2cc(Cl)ccc2C)C1 ZINC001460555331 1062910188 /nfs/dbraw/zinc/91/01/88/1062910188.db2.gz QJSSINPBJNGRQM-JZIMQPMSSA-N 0 1 320.864 4.265 20 0 DIADMN C/C(=C\c1ccccc1)CN[C@@H](c1cnn(C)c1)c1ccccc1 ZINC001256599569 1062910553 /nfs/dbraw/zinc/91/05/53/1062910553.db2.gz QIRWUOQHHQSMMR-RYEVTAHJSA-N 0 1 317.436 4.203 20 0 DIADMN Cc1ccccc1[C@@H](C)N(C)CC(=O)N(C)[C@@H]1CCCC[C@H]1C ZINC001460558924 1062912618 /nfs/dbraw/zinc/91/26/18/1062912618.db2.gz OEJABJMBDSMXSV-ZHALLVOQSA-N 0 1 316.489 4.025 20 0 DIADMN CO[C@H](CC(C)C)CN1CCc2c(cccc2C(F)(F)F)C1 ZINC001460577629 1062921783 /nfs/dbraw/zinc/92/17/83/1062921783.db2.gz JMWWLPQVLGGEOC-CQSZACIVSA-N 0 1 315.379 4.125 20 0 DIADMN CC(C)(C)OC1CC(N2CCC[C@@](F)(c3ccccc3)C2)C1 ZINC001460651109 1062959776 /nfs/dbraw/zinc/95/97/76/1062959776.db2.gz HTWWBILQCGYSRJ-TVPLGVNVSA-N 0 1 305.437 4.293 20 0 DIADMN C[C@H](Cc1ccncc1)N1CCc2c(cccc2C(F)(F)F)C1 ZINC001256751439 1062968619 /nfs/dbraw/zinc/96/86/19/1062968619.db2.gz XWAXREJQDWPJRL-CYBMUJFWSA-N 0 1 320.358 4.090 20 0 DIADMN C[C@H]1CCC[C@@H](CCN2CCCC[C@@H]2C(=O)OC(C)(C)C)C1 ZINC001460664994 1062971086 /nfs/dbraw/zinc/97/10/86/1062971086.db2.gz HAWOPSIVEDJAOG-YESZJQIVSA-N 0 1 309.494 4.399 20 0 DIADMN C[C@@H]1CCC[C@@H](CCN2CCCC[C@@H]2C(=O)OC(C)(C)C)C1 ZINC001460664992 1062971548 /nfs/dbraw/zinc/97/15/48/1062971548.db2.gz HAWOPSIVEDJAOG-IXDOHACOSA-N 0 1 309.494 4.399 20 0 DIADMN COc1ccc(C2CC2)c(NC(=O)c2ccc(O)c(Cl)c2)c1 ZINC001471410490 1062976063 /nfs/dbraw/zinc/97/60/63/1062976063.db2.gz QNIBQYKFUORHEA-UHFFFAOYSA-N 0 1 317.772 4.184 20 0 DIADMN C[C@]1(C2CCCCC2)CCN1Cc1ccnc(Br)c1 ZINC001460683622 1062983616 /nfs/dbraw/zinc/98/36/16/1062983616.db2.gz MTIGEZHJDQNIBW-MRXNPFEDSA-N 0 1 323.278 4.389 20 0 DIADMN C[C@@]1(C2CCCCC2)CCN1Cc1ccnc(Br)c1 ZINC001460683621 1062984346 /nfs/dbraw/zinc/98/43/46/1062984346.db2.gz MTIGEZHJDQNIBW-INIZCTEOSA-N 0 1 323.278 4.389 20 0 DIADMN Clc1cccc(CN2CC[C@H](c3nccs3)C2)c1Cl ZINC001460689493 1062988605 /nfs/dbraw/zinc/98/86/05/1062988605.db2.gz OWZCIZXCLMCRLY-NSHDSACASA-N 0 1 313.253 4.439 20 0 DIADMN Cc1cc2oc(=O)cc(CN3CCC(F)CC3)c2cc1C(C)C ZINC001460688561 1062989899 /nfs/dbraw/zinc/98/98/99/1062989899.db2.gz LYQJQEDGEPQZRS-UHFFFAOYSA-N 0 1 317.404 4.159 20 0 DIADMN C[C@H](Cc1ccccc1Br)N1C[C@@H](C)C[C@H]1CF ZINC001256839047 1063009364 /nfs/dbraw/zinc/00/93/64/1063009364.db2.gz VNGOPVFUFCADOG-SCRDCRAPSA-N 0 1 314.242 4.060 20 0 DIADMN Cc1cc(CN2CC[C@H](c3cccc(Cl)c3)C2(C)C)nn1C ZINC001460718920 1063010511 /nfs/dbraw/zinc/01/05/11/1063010511.db2.gz PSVIQOZAALMCLQ-QGZVFWFLSA-N 0 1 317.864 4.150 20 0 DIADMN C[C@@H]1c2ccc(F)cc2CCN1CCc1c(F)cccc1F ZINC001460722648 1063013981 /nfs/dbraw/zinc/01/39/81/1063013981.db2.gz DSWGAORMMRIOFH-GFCCVEGCSA-N 0 1 305.343 4.266 20 0 DIADMN CCCC1(CCC)CCCN1C(=O)[C@H]1c2cn[nH]c2CC[C@H]1C ZINC001471702581 1063014069 /nfs/dbraw/zinc/01/40/69/1063014069.db2.gz PRRIOPKOKJBGSW-RHSMWYFYSA-N 0 1 317.477 4.037 20 0 DIADMN CCN(C(=O)c1ccc(Cl)c(O)c1)c1ccc(F)c(C)c1 ZINC001471732038 1063016980 /nfs/dbraw/zinc/01/69/80/1063016980.db2.gz CTXZHTVONMDPQS-UHFFFAOYSA-N 0 1 307.752 4.160 20 0 DIADMN Oc1ccc(-c2nnc(CCC3CCCCC3)o2)c(F)c1F ZINC001256854515 1063017395 /nfs/dbraw/zinc/01/73/95/1063017395.db2.gz LKEOKAZGAHJXIY-UHFFFAOYSA-N 0 1 308.328 4.233 20 0 DIADMN Oc1ccc(F)c(F)c1-c1nnc(CCC2CCCCC2)o1 ZINC001256854723 1063017834 /nfs/dbraw/zinc/01/78/34/1063017834.db2.gz PRTYLGDDRZFFBO-UHFFFAOYSA-N 0 1 308.328 4.233 20 0 DIADMN Cc1conc1CN1CC[C@@H](c2cccc(Cl)c2)C1(C)C ZINC001460732007 1063025563 /nfs/dbraw/zinc/02/55/63/1063025563.db2.gz RVLIYZZAPAVZOU-HNNXBMFYSA-N 0 1 304.821 4.405 20 0 DIADMN Fc1ccc(CN2C[C@@H]3C[C@]3(c3ccccc3)C2)cc1Cl ZINC001460757272 1063040459 /nfs/dbraw/zinc/04/04/59/1063040459.db2.gz GMYKGFNPEPJKSK-MAUKXSAKSA-N 0 1 301.792 4.253 20 0 DIADMN Fc1ccc(CN2C[C@H]3C[C@@]3(c3ccccc3)C2)cc1Cl ZINC001460757276 1063042898 /nfs/dbraw/zinc/04/28/98/1063042898.db2.gz GMYKGFNPEPJKSK-QAPCUYQASA-N 0 1 301.792 4.253 20 0 DIADMN Cc1cc([C@@H]2CCCCN2C(=O)[C@@H](C)CC2CCCCC2)n[nH]1 ZINC001472103830 1063047797 /nfs/dbraw/zinc/04/77/97/1063047797.db2.gz IFUCPAAAVBTVTQ-KSSFIOAISA-N 0 1 317.477 4.378 20 0 DIADMN O=C(Nc1ccc2cncn2c1)c1c(Cl)cc(F)cc1Cl ZINC001472133966 1063052176 /nfs/dbraw/zinc/05/21/76/1063052176.db2.gz PCUKBTBUGRUTGL-UHFFFAOYSA-N 0 1 324.142 4.033 20 0 DIADMN Cc1ccccc1Oc1cccc(NC(=O)CCc2cnc[nH]2)c1 ZINC001472167609 1063055605 /nfs/dbraw/zinc/05/56/05/1063055605.db2.gz YOARDCIVNFIOHZ-UHFFFAOYSA-N 0 1 321.380 4.082 20 0 DIADMN C[C@H](c1ccc(F)cc1F)N1CCC[C@@H](Cc2nccs2)C1 ZINC001460800165 1063067770 /nfs/dbraw/zinc/06/77/70/1063067770.db2.gz HHBAMXZVHXCSFG-OLZOCXBDSA-N 0 1 322.424 4.437 20 0 DIADMN C[C@@H](NC(=O)c1cccc2nc[nH]c21)c1csc2ccccc21 ZINC001472290048 1063068319 /nfs/dbraw/zinc/06/83/19/1063068319.db2.gz YNXDUYJVCJOTCR-LLVKDONJSA-N 0 1 321.405 4.269 20 0 DIADMN Cc1cc(C)c(CN2[C@H](C)CO[C@H](c3ccccc3)[C@H]2C)c(C)n1 ZINC001460846680 1063097452 /nfs/dbraw/zinc/09/74/52/1063097452.db2.gz ALNWWPJEICNZJX-BLIXFSHQSA-N 0 1 324.468 4.357 20 0 DIADMN CCCCC[C@@H](C(=O)Nc1cccc(-c2cn[nH]n2)c1)C(C)C ZINC001472543661 1063101405 /nfs/dbraw/zinc/10/14/05/1063101405.db2.gz ZITJSYRUVYBIPW-MRXNPFEDSA-N 0 1 314.433 4.263 20 0 DIADMN Cc1cccc2sc(N3CCN(C)C[C@@H]3c3ccccc3)nc21 ZINC001472644028 1063116445 /nfs/dbraw/zinc/11/64/45/1063116445.db2.gz YIGWDKGIHWQLOR-MRXNPFEDSA-N 0 1 323.465 4.098 20 0 DIADMN C[C@@]12CSC[C@@H]1CN(Cc1nc(C3CCCCC3)cs1)C2 ZINC001460897137 1063122593 /nfs/dbraw/zinc/12/25/93/1063122593.db2.gz BHRWLMKYRQBRIA-WMLDXEAASA-N 0 1 322.543 4.376 20 0 DIADMN CCC[C@@H](C)NCc1c(F)c(F)cc(Br)c1F ZINC001257304754 1063193260 /nfs/dbraw/zinc/19/32/60/1063193260.db2.gz PTKWJOWKWICSOJ-SSDOTTSWSA-N 0 1 310.157 4.145 20 0 DIADMN Fc1cccc(CN2CC[C@H](Cc3nccs3)C2)c1Cl ZINC001460932710 1063142239 /nfs/dbraw/zinc/14/22/39/1063142239.db2.gz SKFLIHMVMBKXSA-LLVKDONJSA-N 0 1 310.825 4.000 20 0 DIADMN FC(F)(F)c1cnccc1NCC1(Sc2ccccc2)CC1 ZINC001472686656 1063150029 /nfs/dbraw/zinc/15/00/29/1063150029.db2.gz ZISJZWGNHKFQJI-UHFFFAOYSA-N 0 1 324.371 4.259 20 0 DIADMN CCC[C@H](CC)NC1(c2ccc(C(F)(F)F)cc2)COC1 ZINC001257246068 1063156426 /nfs/dbraw/zinc/15/64/26/1063156426.db2.gz AUFFJWHGWUAMRZ-AWEZNQCLSA-N 0 1 301.352 4.099 20 0 DIADMN CCC[C@@H](CC)N[C@H]1CCN(Cc2ccccc2)CC1(F)F ZINC001257252684 1063160534 /nfs/dbraw/zinc/16/05/34/1063160534.db2.gz HKGZOKDLWDZDEI-SJORKVTESA-N 0 1 310.432 4.065 20 0 DIADMN C[C@@H]1CN(CCc2cccc(Cl)c2Cl)[C@H](C)CCO1 ZINC001460963897 1063162609 /nfs/dbraw/zinc/16/26/09/1063162609.db2.gz LZRFUJGGTSSSOK-VXGBXAGGSA-N 0 1 302.245 4.035 20 0 DIADMN CCC[C@@H](CC)N[C@@H](c1nc2ccccc2n1C)c1ccccn1 ZINC001257254823 1063162765 /nfs/dbraw/zinc/16/27/65/1063162765.db2.gz VNTISJUXKFIBRS-DNVCBOLYSA-N 0 1 322.456 4.226 20 0 DIADMN Cn1cc(CNCc2cccc(Cl)c2)c(C2CCCCC2)n1 ZINC001460999681 1063174453 /nfs/dbraw/zinc/17/44/53/1063174453.db2.gz JNNVHTHABZMPBH-UHFFFAOYSA-N 0 1 317.864 4.411 20 0 DIADMN CN(Cc1cc2ccccc2o1)c1ccncc1C(F)(F)F ZINC001472718567 1063179608 /nfs/dbraw/zinc/17/96/08/1063179608.db2.gz FOBCYMLEXQOJBD-UHFFFAOYSA-N 0 1 306.287 4.483 20 0 DIADMN COc1ccc2cc(CC[C@@H](C)N(C)Cc3ccon3)ccc2c1 ZINC001257284725 1063181310 /nfs/dbraw/zinc/18/13/10/1063181310.db2.gz JCHVQKBONXVSLS-OAHLLOKOSA-N 0 1 324.424 4.290 20 0 DIADMN Cc1nn(C(C)(C)C)c(C)c1CNCc1ccc(Cl)s1 ZINC001461011383 1063185784 /nfs/dbraw/zinc/18/57/84/1063185784.db2.gz JZLVGVHTOLBWEC-UHFFFAOYSA-N 0 1 311.882 4.260 20 0 DIADMN CCC[C@H](C)NCc1c(F)c(F)cc(Br)c1F ZINC001257304755 1063193749 /nfs/dbraw/zinc/19/37/49/1063193749.db2.gz PTKWJOWKWICSOJ-ZETCQYMHSA-N 0 1 310.157 4.145 20 0 DIADMN Cc1cccc2nc(N(C)Cc3cc(C(C)(C)C)[nH]n3)sc21 ZINC001472770326 1063220055 /nfs/dbraw/zinc/22/00/55/1063220055.db2.gz IRESQSODEGBSOI-UHFFFAOYSA-N 0 1 314.458 4.262 20 0 DIADMN c1nc(-c2ccccc2)[nH]c1CNc1cccc2cnccc21 ZINC001461074540 1063232886 /nfs/dbraw/zinc/23/28/86/1063232886.db2.gz WIJNAZPWIAYXCL-UHFFFAOYSA-N 0 1 300.365 4.237 20 0 DIADMN CCCCCC[C@@H](C)N1Cc2cnn(CC)c2[C@H](COCC)C1 ZINC001257366840 1063235856 /nfs/dbraw/zinc/23/58/56/1063235856.db2.gz YEERIPKLHASJJY-AEFFLSMTSA-N 0 1 321.509 4.198 20 0 DIADMN CCCCOC(=O)CC[C@@H](C)NCc1c(F)cccc1Cl ZINC001257389452 1063247209 /nfs/dbraw/zinc/24/72/09/1063247209.db2.gz SZUOASLQBIVEDO-GFCCVEGCSA-N 0 1 315.816 4.081 20 0 DIADMN CCC(C)(C)C1CCC(N2CCN(CC(F)(F)F)CC2)CC1 ZINC001257407441 1063254131 /nfs/dbraw/zinc/25/41/31/1063254131.db2.gz HJLBXSOJERCXII-UHFFFAOYSA-N 0 1 320.443 4.161 20 0 DIADMN CCC(C)(C)C1CCC(N(C)Cc2nnc3ccccn32)CC1 ZINC001257405802 1063254473 /nfs/dbraw/zinc/25/44/73/1063254473.db2.gz RHXHSUIZFHPPSV-UHFFFAOYSA-N 0 1 314.477 4.156 20 0 DIADMN CCCOc1ncccc1CNCc1ccc(F)c2ccccc12 ZINC001461105240 1063255969 /nfs/dbraw/zinc/25/59/69/1063255969.db2.gz KJHLVPRICJGXHW-UHFFFAOYSA-N 0 1 324.399 4.453 20 0 DIADMN CCC(C)(C)C1CCC(N2CCO[C@H](c3ccncc3)C2)CC1 ZINC001257407237 1063256235 /nfs/dbraw/zinc/25/62/35/1063256235.db2.gz CHTNCPNUPNVRHX-ACBHZAAOSA-N 0 1 316.489 4.450 20 0 DIADMN Fc1cccc(Cl)c1CNCc1cc(-n2ccnc2)cs1 ZINC001461121963 1063272255 /nfs/dbraw/zinc/27/22/55/1063272255.db2.gz QYEGTUAALDIMTL-UHFFFAOYSA-N 0 1 321.808 4.016 20 0 DIADMN CCC[C@H](NCc1ccc2c(c1)OC(F)(F)O2)c1ccccn1 ZINC001461153731 1063295799 /nfs/dbraw/zinc/29/57/99/1063295799.db2.gz FXVUZBHCQHFLEQ-ZDUSSCGKSA-N 0 1 320.339 4.034 20 0 DIADMN CCC[C@@H](C)CC[C@@H](C)N1CCCn2cnc(COCC)c2C1 ZINC001257477378 1063296482 /nfs/dbraw/zinc/29/64/82/1063296482.db2.gz JDCYXWLUTVKOGV-IAGOWNOFSA-N 0 1 321.509 4.230 20 0 DIADMN FC(F)(F)c1cnccc1NCCC1CCC(F)(F)CC1 ZINC001472898776 1063306406 /nfs/dbraw/zinc/30/64/06/1063306406.db2.gz GITHOEHDIROFAV-UHFFFAOYSA-N 0 1 308.294 4.150 20 0 DIADMN CCC[C@H](C)CC[C@@H](C)N1CCc2cnc(SC)nc2C1 ZINC001257486060 1063308559 /nfs/dbraw/zinc/30/85/59/1063308559.db2.gz SGDVWYOLNCPJHD-UONOGXRCSA-N 0 1 307.507 4.162 20 0 DIADMN CCc1onc(C)c1CSc1nc2ccc(Cl)cc2[nH]1 ZINC001472910200 1063310661 /nfs/dbraw/zinc/31/06/61/1063310661.db2.gz ATPRYNZZRXWGFW-UHFFFAOYSA-N 0 1 307.806 4.367 20 0 DIADMN CC1(C)CCC(CSc2nc(-c3ccccn3)n[nH]2)CC1 ZINC001472918865 1063313936 /nfs/dbraw/zinc/31/39/36/1063313936.db2.gz RFCDHDBIEHPJMO-UHFFFAOYSA-N 0 1 302.447 4.175 20 0 DIADMN CC(=O)c1ccc(CSc2nc(-c3ccc(C)cc3)n[nH]2)cc1 ZINC001472923671 1063316995 /nfs/dbraw/zinc/31/69/95/1063316995.db2.gz GKNSHJQMAYYAMP-UHFFFAOYSA-N 0 1 323.421 4.275 20 0 DIADMN CC(C)Cc1ccc(CN[C@@H]2CSCc3ccccc32)cn1 ZINC001461184140 1063317480 /nfs/dbraw/zinc/31/74/80/1063317480.db2.gz LEHNNWCTFZPEPH-LJQANCHMSA-N 0 1 312.482 4.358 20 0 DIADMN FC(F)(F)c1n[nH]c2ccc(-c3nnc(C4CCCC4)o3)cc21 ZINC001257518673 1063324982 /nfs/dbraw/zinc/32/49/82/1063324982.db2.gz YSOIPNXLJGYOAR-UHFFFAOYSA-N 0 1 322.290 4.289 20 0 DIADMN CC(C)(C)c1csc(CNCCOC2CCCCCC2)n1 ZINC001461202993 1063329948 /nfs/dbraw/zinc/32/99/48/1063329948.db2.gz BDGYNGMOKJUFIJ-UHFFFAOYSA-N 0 1 310.507 4.270 20 0 DIADMN Fc1ccc(F)c(CSc2n[nH]c(CCC3CCCC3)n2)c1 ZINC001472974303 1063335250 /nfs/dbraw/zinc/33/52/50/1063335250.db2.gz GOTNURHMXJAUSQ-UHFFFAOYSA-N 0 1 323.412 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334373525 /nfs/dbraw/zinc/37/35/25/334373525.db2.gz BIQACFWGHOENCO-GFCCVEGCSA-N 0 1 318.486 4.092 20 0 DIADMN Cc1nc(C(C)(C)C)sc1[C@H](C)NCc1ccccc1CO ZINC000305101192 334373677 /nfs/dbraw/zinc/37/36/77/334373677.db2.gz BIQACFWGHOENCO-LBPRGKRZSA-N 0 1 318.486 4.092 20 0 DIADMN C[C@H](NCc1ccccc1CO)c1ccc(-c2ccccc2)o1 ZINC000305133859 334375644 /nfs/dbraw/zinc/37/56/44/334375644.db2.gz NWBKKWRYMMGWDU-HNNXBMFYSA-N 0 1 307.393 4.290 20 0 DIADMN OCc1ccccc1CN[C@@H]1CCSc2ccc(Cl)cc21 ZINC000305126828 334375666 /nfs/dbraw/zinc/37/56/66/334375666.db2.gz LNYDGOLENKFGKN-MRXNPFEDSA-N 0 1 319.857 4.159 20 0 DIADMN C[C@H](NCc1ccccc1CO)c1cc(Cl)cc(Cl)c1 ZINC000305103196 334376458 /nfs/dbraw/zinc/37/64/58/334376458.db2.gz BZYJIBOHIQQQML-NSHDSACASA-N 0 1 310.224 4.337 20 0 DIADMN CCOc1ncccc1CN[C@H](C)c1ccc(SCC)cc1 ZINC000535234059 334381226 /nfs/dbraw/zinc/38/12/26/334381226.db2.gz OSUUYOVHPPKNCR-CQSZACIVSA-N 0 1 316.470 4.443 20 0 DIADMN Fc1ccc2c(c1)nccc2NCc1nc(-c2cccs2)c[nH]1 ZINC000340862715 334391176 /nfs/dbraw/zinc/39/11/76/334391176.db2.gz VXWRFBYMVOVYKM-UHFFFAOYSA-N 0 1 324.384 4.438 20 0 DIADMN Cc1cnc(CN[C@@H](CC(C)(C)C)c2ccc(F)cc2)n1C ZINC000341015236 334400043 /nfs/dbraw/zinc/40/00/43/334400043.db2.gz QDFUOMORHZRJBH-INIZCTEOSA-N 0 1 303.425 4.135 20 0 DIADMN CCOc1ccc([C@@H](C)NCc2ncccc2C)cc1OCC ZINC000341061302 334406304 /nfs/dbraw/zinc/40/63/04/334406304.db2.gz OGXZESVKPYAENA-OAHLLOKOSA-N 0 1 314.429 4.038 20 0 DIADMN Cc1ccc([C@H](C)c2noc([C@H](C)N3[C@H](C)CC[C@H]3C)n2)cc1 ZINC000443200280 338446942 /nfs/dbraw/zinc/44/69/42/338446942.db2.gz GDUTVCRNDJTMSV-WCVJEAGWSA-N 0 1 313.445 4.464 20 0 DIADMN Brc1cccc2c1CCC[C@H]2NCc1ccoc1 ZINC000341195654 334422732 /nfs/dbraw/zinc/42/27/32/334422732.db2.gz QIMLCZYEDHITAL-OAHLLOKOSA-N 0 1 306.203 4.209 20 0 DIADMN Cc1oc2ccccc2c1CNCc1ccnc(OC(F)F)c1 ZINC000341276947 334427977 /nfs/dbraw/zinc/42/79/77/334427977.db2.gz SMELRSUXIRNUBP-UHFFFAOYSA-N 0 1 318.323 4.027 20 0 DIADMN C[C@H](Cc1noc([C@H](C)N2[C@H](C)CC[C@H]2C)n1)c1ccccc1 ZINC000443213744 338447537 /nfs/dbraw/zinc/44/75/37/338447537.db2.gz LAKSDVHZAAUAEU-FPCVCCKLSA-N 0 1 313.445 4.350 20 0 DIADMN C[C@H](Cc1noc([C@H](C)N2CCCCCC2)n1)c1ccccc1 ZINC000443214358 338447606 /nfs/dbraw/zinc/44/76/06/338447606.db2.gz NGQXVNKPDCQTNV-CVEARBPZSA-N 0 1 313.445 4.353 20 0 DIADMN C[C@@H](c1nc(CCCc2ccsc2)no1)N1CCCCCC1 ZINC000443215703 338447718 /nfs/dbraw/zinc/44/77/18/338447718.db2.gz YXFUWLMIURRUTH-AWEZNQCLSA-N 0 1 319.474 4.243 20 0 DIADMN Cc1nn(C(C)C)cc1CN[C@@H](C)c1ccc2ncsc2c1 ZINC000341369745 334436181 /nfs/dbraw/zinc/43/61/81/334436181.db2.gz MNMPWIWOKLFYSA-LBPRGKRZSA-N 0 1 314.458 4.233 20 0 DIADMN Cc1cccc(CN(CCCCCF)Cc2cccc(C)n2)n1 ZINC000341914396 334491689 /nfs/dbraw/zinc/49/16/89/334491689.db2.gz SLIIBNWKZOPWNI-UHFFFAOYSA-N 0 1 315.436 4.235 20 0 DIADMN COCC[C@H](N[C@H](C)c1c(F)cccc1OC)c1ccccc1 ZINC000341995069 334499017 /nfs/dbraw/zinc/49/90/17/334499017.db2.gz GHTNCNVGOHGTTA-PBHICJAKSA-N 0 1 317.404 4.263 20 0 DIADMN CC[C@@H](NCc1c(C)nc2ccccn21)c1cc(F)ccc1F ZINC000342001707 334500026 /nfs/dbraw/zinc/50/00/26/334500026.db2.gz LERLZLHAASHYAK-MRXNPFEDSA-N 0 1 315.367 4.162 20 0 DIADMN CC[C@@H](F)CN[C@H](CCOC)c1ccc(Cl)c(Cl)c1 ZINC000342031983 334507981 /nfs/dbraw/zinc/50/79/81/334507981.db2.gz LYQPCAATPCLYPE-BXUZGUMPSA-N 0 1 308.224 4.409 20 0 DIADMN C[C@H](N[C@@H](C[S@@](C)=O)c1ccccc1)c1ccc(Cl)cc1 ZINC000342480205 334539644 /nfs/dbraw/zinc/53/96/44/334539644.db2.gz MYBJKNGECGYCPJ-IBNJYYFUSA-N 0 1 321.873 4.110 20 0 DIADMN Oc1ccc(C2CCN(Cc3nc(C4CC4)cs3)CC2)cc1 ZINC000342721777 334568803 /nfs/dbraw/zinc/56/88/03/334568803.db2.gz AJUDURJUYJXPNN-UHFFFAOYSA-N 0 1 314.454 4.106 20 0 DIADMN CC[C@H](N[C@H](C)c1cnc(OC)c(Cl)c1)c1c(C)noc1C ZINC000342730604 334569703 /nfs/dbraw/zinc/56/97/03/334569703.db2.gz JWUSTZMZTCMUMB-OTYXRUKQSA-N 0 1 323.824 4.150 20 0 DIADMN Cc1cc(CN[C@@H]2CC(C)(C)CCc3ccccc32)nc(C)n1 ZINC000342811105 334579154 /nfs/dbraw/zinc/57/91/54/334579154.db2.gz ZCHSBXNGOSRXFB-LJQANCHMSA-N 0 1 309.457 4.287 20 0 DIADMN Cc1cc(CN[C@@H](C)c2ccc(SC(C)C)cc2)nc(C)n1 ZINC000342811168 334579266 /nfs/dbraw/zinc/57/92/66/334579266.db2.gz COIMLWXNYJSTJQ-AWEZNQCLSA-N 0 1 315.486 4.445 20 0 DIADMN Cc1cc(CN2CC3(CCC3(F)F)C2)cc(C)c1OC(F)F ZINC000582153851 334605487 /nfs/dbraw/zinc/60/54/87/334605487.db2.gz PEKOOZIHOQXSLO-UHFFFAOYSA-N 0 1 317.326 4.136 20 0 DIADMN CC[C@H](NCc1cc(C(F)(F)F)n[nH]1)c1cccc(Cl)c1 ZINC000440813567 334631867 /nfs/dbraw/zinc/63/18/67/334631867.db2.gz XAYZZAQQBOCQHA-LBPRGKRZSA-N 0 1 317.742 4.323 20 0 DIADMN CC[C@H](NCc1cccnc1OCC(F)F)c1cccc(F)c1 ZINC000188288261 334672634 /nfs/dbraw/zinc/67/26/34/334672634.db2.gz QHZPTGVQGDYWIX-HNNXBMFYSA-N 0 1 324.346 4.106 20 0 DIADMN Cc1cc2c(cc1C)[C@H](N[C@H]1COCc3ccccc31)CCCO2 ZINC000417357693 334707435 /nfs/dbraw/zinc/70/74/35/334707435.db2.gz GWTKQGDLJDYIGH-UXHICEINSA-N 0 1 323.436 4.378 20 0 DIADMN COc1ccc([C@H](C)NCc2cc(F)ccc2F)cc1Cl ZINC000112544106 334715231 /nfs/dbraw/zinc/71/52/31/334715231.db2.gz NACWJTZTDCUMCD-JTQLQIEISA-N 0 1 311.759 4.478 20 0 DIADMN CCc1ccc(CN[C@H](CO)c2ccc(C(F)(F)F)cc2)cc1 ZINC000535369642 334721353 /nfs/dbraw/zinc/72/13/53/334721353.db2.gz MLYWLVHUTQOVBI-QGZVFWFLSA-N 0 1 323.358 4.091 20 0 DIADMN C[C@@H](N[C@H]1COCc2ccccc21)c1cnc2ccsc2c1 ZINC000417359887 334723357 /nfs/dbraw/zinc/72/33/57/334723357.db2.gz JCCRGNDRPNIOQP-PXAZEXFGSA-N 0 1 310.422 4.218 20 0 DIADMN C[C@H](N[C@@H]1COCc2ccccc21)c1nccc2ccccc21 ZINC000417368635 334764427 /nfs/dbraw/zinc/76/44/27/334764427.db2.gz RHKHVSDMJVGJRO-IFXJQAMLSA-N 0 1 304.393 4.157 20 0 DIADMN Cc1ccc2cc([C@@H](C)N[C@@H]3c4ccccc4C[C@@H]3O)oc2c1 ZINC000425933239 334772946 /nfs/dbraw/zinc/77/29/46/334772946.db2.gz YJMOBALVZTVIQT-ASUYLVSUSA-N 0 1 307.393 4.050 20 0 DIADMN CCc1ccc(CNCc2cnc(C(F)(F)F)s2)s1 ZINC000443982786 338465395 /nfs/dbraw/zinc/46/53/95/338465395.db2.gz VDTBHODVEDZJME-UHFFFAOYSA-N 0 1 306.378 4.076 20 0 DIADMN COc1ccccc1[C@H](N[C@H]1CC[C@@H]1SC)c1ccccc1 ZINC000425339213 334801540 /nfs/dbraw/zinc/80/15/40/334801540.db2.gz CGORRLTZOWPBTP-YTQUADARSA-N 0 1 313.466 4.268 20 0 DIADMN Fc1cc(CNCc2ccc3c(n2)CCCC3)ccc1Cl ZINC000444005631 338466755 /nfs/dbraw/zinc/46/67/55/338466755.db2.gz RRJSRGKNTDEEQR-UHFFFAOYSA-N 0 1 304.796 4.043 20 0 DIADMN C[C@H](NCc1c(Cl)ccc2cccnc21)c1cccc(O)c1 ZINC000444006416 338466802 /nfs/dbraw/zinc/46/68/02/338466802.db2.gz BGQQJZVMWJIUEB-LBPRGKRZSA-N 0 1 312.800 4.445 20 0 DIADMN CC[C@H](N[C@@H]1CC[C@@H]1SC)c1nc(C(F)(F)F)cs1 ZINC000425361242 334842251 /nfs/dbraw/zinc/84/22/51/334842251.db2.gz UDINKRKCTRFHGZ-YIZRAAEISA-N 0 1 310.410 4.097 20 0 DIADMN Cc1cccnc1CNCc1cc(Cl)cc(C(F)(F)F)c1 ZINC000189173280 334888026 /nfs/dbraw/zinc/88/80/26/334888026.db2.gz RMKOAVAEWBNXKB-UHFFFAOYSA-N 0 1 314.738 4.352 20 0 DIADMN CSCc1cccc(CNCc2cc(F)c(F)c(F)c2)c1 ZINC000189479212 334897509 /nfs/dbraw/zinc/89/75/09/334897509.db2.gz KJBFFBCIMAJCSU-UHFFFAOYSA-N 0 1 311.372 4.257 20 0 DIADMN CCS[C@@H]1CCCC[C@H]1NCc1csc([C@@H](C)OC)n1 ZINC000189500059 334897856 /nfs/dbraw/zinc/89/78/56/334897856.db2.gz BKHFUUSAYGBEGJ-MRVWCRGKSA-N 0 1 314.520 4.004 20 0 DIADMN CCCCOc1ccc(CN[C@@H](C)c2ccncc2OC)cc1 ZINC000189562365 334900508 /nfs/dbraw/zinc/90/05/08/334900508.db2.gz CRWUXYWQBFUZGP-HNNXBMFYSA-N 0 1 314.429 4.120 20 0 DIADMN COc1ccsc1CN[C@@H]1CC(C)(C)Cc2oc(C)cc21 ZINC000343623286 335182224 /nfs/dbraw/zinc/18/22/24/335182224.db2.gz NORGIZDNTXYWKT-CYBMUJFWSA-N 0 1 305.443 4.461 20 0 DIADMN Cc1cc2c(o1)CC(C)(C)C[C@H]2NCc1cnc2cccc(C)n12 ZINC000343634821 335183369 /nfs/dbraw/zinc/18/33/69/335183369.db2.gz VMNDSEJXLHXVSL-QGZVFWFLSA-N 0 1 323.440 4.347 20 0 DIADMN CC(C)c1ccc(CN(C(=O)c2cnc(C3CC3)[nH]2)C2CC2)cc1 ZINC000343651920 335185186 /nfs/dbraw/zinc/18/51/86/335185186.db2.gz KMWCJRBWMWDFEQ-UHFFFAOYSA-N 0 1 323.440 4.215 20 0 DIADMN C[C@@H](NC[C@H](C)c1nccs1)c1nc(C(F)(F)F)cs1 ZINC000343725307 335187011 /nfs/dbraw/zinc/18/70/11/335187011.db2.gz JKZQLJUFHXJZJG-JGVFFNPUSA-N 0 1 321.393 4.073 20 0 DIADMN Cc1ccc(CN[C@@H]2CCCOc3ccc(F)cc32)cc1F ZINC000343697660 335188849 /nfs/dbraw/zinc/18/88/49/335188849.db2.gz VAQCFIYZMVLNDR-QGZVFWFLSA-N 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NAQXBGLKYGVKAU-MRXNPFEDSA-N 0 1 306.394 4.221 20 0 DIADMN Cc1nc(C(F)(F)F)c(CN2CCC[C@H](C3CC3)C2)s1 ZINC000344032878 335210713 /nfs/dbraw/zinc/21/07/13/335210713.db2.gz FAQJVNHYMYFREC-NSHDSACASA-N 0 1 304.381 4.092 20 0 DIADMN CC[C@@H](NCc1ccccn1)c1cc(F)cc(Br)c1 ZINC000344035484 335211042 /nfs/dbraw/zinc/21/10/42/335211042.db2.gz RMEABJVVZWUOCI-OAHLLOKOSA-N 0 1 323.209 4.224 20 0 DIADMN Clc1cccc(-c2nnc(CN3CCC[C@@H](C4CC4)C3)o2)c1 ZINC000344085561 335216506 /nfs/dbraw/zinc/21/65/06/335216506.db2.gz HKEWWARXMXREQK-CQSZACIVSA-N 0 1 317.820 4.012 20 0 DIADMN C[C@@H]1C[C@H](NCc2ccncc2OCC(F)F)c2ccccc21 ZINC000344133028 335220488 /nfs/dbraw/zinc/22/04/88/335220488.db2.gz XXRONNBEUITBII-WBMJQRKESA-N 0 1 318.367 4.064 20 0 DIADMN CC[C@H](N[C@H]1COc2ccc(F)cc21)c1cccc(OC)c1 ZINC000344142137 335221231 /nfs/dbraw/zinc/22/12/31/335221231.db2.gz YOKVHIDHTWJLIQ-IRXDYDNUSA-N 0 1 301.361 4.009 20 0 DIADMN CC[C@@H](N[C@H]1COc2ccc(F)cc21)c1cccc(OC)c1 ZINC000344142138 335221409 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CO[C@@H]1CC[C@H](Nc2ccnc3cc(C(F)(F)F)ccc32)C1 ZINC000302763706 336368064 /nfs/dbraw/zinc/36/80/64/336368064.db2.gz KZMYMUMEJOFULX-NWDGAFQWSA-N 0 1 310.319 4.233 20 0 DIADMN C[C@@H]1COC[C@H](c2ccccc2)N1C[C@H]1CCCC(F)(F)C1 ZINC000514133921 336374650 /nfs/dbraw/zinc/37/46/50/336374650.db2.gz FHPHZWPCROMCDL-HLLBOEOZSA-N 0 1 309.400 4.274 20 0 DIADMN CSc1cccc(F)c1CNCc1ccc2ncccc2c1 ZINC000352946584 336378831 /nfs/dbraw/zinc/37/88/31/336378831.db2.gz JMIMPCWJKDOVSA-UHFFFAOYSA-N 0 1 312.413 4.386 20 0 DIADMN COc1ccc(F)c(CN2CCC(c3ccsc3)CC2)c1 ZINC000352955213 336379166 /nfs/dbraw/zinc/37/91/66/336379166.db2.gz ILAMOGOELPATAO-UHFFFAOYSA-N 0 1 305.418 4.275 20 0 DIADMN Fc1cccc2c1CC[C@H]2N[C@@H]1CCCOc2c(F)cccc21 ZINC000352969198 336379987 /nfs/dbraw/zinc/37/99/87/336379987.db2.gz QNCBTFUNIKDXAB-QZTJIDSGSA-N 0 1 315.363 4.456 20 0 DIADMN CC[C@H](N[C@@H](CCOC)c1ccc(C)o1)c1ccccc1OC ZINC000352972848 336380717 /nfs/dbraw/zinc/38/07/17/336380717.db2.gz ZIBMSZFVGQUTCP-IRXDYDNUSA-N 0 1 317.429 4.415 20 0 DIADMN CCc1ccc(CN2CCC(Oc3ccc(F)cc3)CC2)o1 ZINC000352975352 336380732 /nfs/dbraw/zinc/38/07/32/336380732.db2.gz UDUKQCYKNCBXQI-UHFFFAOYSA-N 0 1 303.377 4.025 20 0 DIADMN CC[C@@H](C)c1nc([C@H](C)NCc2ccc(C)cc2Cl)n[nH]1 ZINC000514609237 336386138 /nfs/dbraw/zinc/38/61/38/336386138.db2.gz OKOZXQXXKHYIBY-NEPJUHHUSA-N 0 1 306.841 4.131 20 0 DIADMN Cc1cc(C[N@H+]2CCC[C@@H]2CC2CCCCC2)oc1C(=O)[O-] ZINC000563966108 336388902 /nfs/dbraw/zinc/38/89/02/336388902.db2.gz HOQIBDVEUGSPNI-OAHLLOKOSA-N 0 1 305.418 4.221 20 0 DIADMN CCC[C@H](C(=O)[O-])[N@@H+](CC)Cc1ccc(Cl)c(Cl)c1 ZINC000582246545 336393306 /nfs/dbraw/zinc/39/33/06/336393306.db2.gz FDOCIBIPOCLPOG-CYBMUJFWSA-N 0 1 304.217 4.069 20 0 DIADMN CCC[C@@H](C)[N@@H+](C)Cc1csc(-c2ccc(C(=O)[O-])cc2)n1 ZINC000582246690 336393346 /nfs/dbraw/zinc/39/33/46/336393346.db2.gz MRWKOSZHTPJWKE-GFCCVEGCSA-N 0 1 318.442 4.129 20 0 DIADMN CCCCOc1ccc(CN[C@H]2COCc3ccccc32)cc1 ZINC000418101816 336401055 /nfs/dbraw/zinc/40/10/55/336401055.db2.gz SMUDHJLEDCVZBD-FQEVSTJZSA-N 0 1 311.425 4.227 20 0 DIADMN CO[C@@H](CNCc1csc(-c2ccsc2)n1)CC(C)C ZINC000418102484 336401159 /nfs/dbraw/zinc/40/11/59/336401159.db2.gz RSQYGAWWQXGKGG-CQSZACIVSA-N 0 1 310.488 4.022 20 0 DIADMN Brc1ccc(CN[C@H]2CCOc3ccccc32)s1 ZINC000034996483 336401208 /nfs/dbraw/zinc/40/12/08/336401208.db2.gz IUZQRGGLADCUEE-LBPRGKRZSA-N 0 1 324.243 4.124 20 0 DIADMN CC[C@@H](N[C@H](C)c1ccc(OC)c(O)c1)c1ccc(F)cc1F ZINC000353277996 336409676 /nfs/dbraw/zinc/40/96/76/336409676.db2.gz PPBIEKAJHPLCKF-BDJLRTHQSA-N 0 1 321.367 4.481 20 0 DIADMN C[C@@H](N[C@@H](CC(C)(C)C)c1ccc(F)cc1)c1ccc(=O)[nH]n1 ZINC000353403938 336415691 /nfs/dbraw/zinc/41/56/91/336415691.db2.gz NRKZIXBARROEHX-WBMJQRKESA-N 0 1 317.408 4.149 20 0 DIADMN CC[C@@H](NCc1cc(C)no1)c1ccc(OC(F)(F)F)cc1 ZINC000353511295 336421598 /nfs/dbraw/zinc/42/15/98/336421598.db2.gz AVUUBSYWDKGPTB-CQSZACIVSA-N 0 1 314.307 4.123 20 0 DIADMN Cc1sccc1CN[C@H](CC(=O)OC(C)C)c1ccccc1 ZINC000353519312 336422150 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336483076 /nfs/dbraw/zinc/48/30/76/336483076.db2.gz RKZYFPXRXGAGJH-UHFFFAOYSA-N 0 1 316.470 4.059 20 0 DIADMN C[C@@H](NCc1c[nH]c2nccnc12)c1cc(Cl)ccc1Cl ZINC000356156145 336538575 /nfs/dbraw/zinc/53/85/75/336538575.db2.gz AMSHHOBEJQHFHC-SECBINFHSA-N 0 1 321.211 4.067 20 0 DIADMN C[C@H](N[C@H]1CCc2ccc(Br)cc21)c1ccccn1 ZINC000193157485 336600542 /nfs/dbraw/zinc/60/05/42/336600542.db2.gz LHHDHJUMXXEPEC-ZBEGNZNMSA-N 0 1 317.230 4.182 20 0 DIADMN CSc1cc(CN[C@@H]2CCSc3ccc(F)cc32)ccn1 ZINC000357845882 336601228 /nfs/dbraw/zinc/60/12/28/336601228.db2.gz BRVPKHWJSTYSGQ-CQSZACIVSA-N 0 1 320.458 4.269 20 0 DIADMN CN(C)c1ccccc1CN[C@@H]1CC2(CCC2)Oc2ccccc21 ZINC000358049782 336608580 /nfs/dbraw/zinc/60/85/80/336608580.db2.gz RYSPHQDISMUIIL-GOSISDBHSA-N 0 1 322.452 4.289 20 0 DIADMN CSc1ccccc1CN[C@@H](C)c1cccc(NC(C)=O)c1 ZINC000358061988 336609199 /nfs/dbraw/zinc/60/91/99/336609199.db2.gz LQHBJWZNJYMSCS-ZDUSSCGKSA-N 0 1 314.454 4.218 20 0 DIADMN Cc1nc2c(s1)[C@@H](N[C@H]1COc3ccc(Cl)cc31)CCC2 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Cn1cc2c(n1)CCC[C@@H]2N[C@@H](CC(F)(F)F)c1ccccc1 ZINC000358932331 336648003 /nfs/dbraw/zinc/64/80/03/336648003.db2.gz JDZOEKDWEKDHHN-HOCLYGCPSA-N 0 1 323.362 4.081 20 0 DIADMN CC(C)[C@@H](N[C@@H]1CCCc2nn(C)cc21)c1ccc(F)cc1F ZINC000358960598 336649626 /nfs/dbraw/zinc/64/96/26/336649626.db2.gz ZLRIQLJJMJVHNS-SJLPKXTDSA-N 0 1 319.399 4.063 20 0 DIADMN CC[C@H](N[C@H]1CCCc2ccc(F)cc21)c1ccc(F)cn1 ZINC000359027516 336654141 /nfs/dbraw/zinc/65/41/41/336654141.db2.gz JKPWRXBBSTVJSG-IRXDYDNUSA-N 0 1 302.368 4.478 20 0 DIADMN CC(=O)Nc1ccc([C@H](C)N[C@@H]2CSc3ccccc32)cc1 ZINC000359228082 336663563 /nfs/dbraw/zinc/66/35/63/336663563.db2.gz HAOMPYGBLISRPE-YVEFUNNKSA-N 0 1 312.438 4.143 20 0 DIADMN CC(=O)Nc1ccc([C@@H](C)N[C@@H]2CSc3ccccc32)cc1 ZINC000359228079 336663619 /nfs/dbraw/zinc/66/36/19/336663619.db2.gz HAOMPYGBLISRPE-SJKOYZFVSA-N 0 1 312.438 4.143 20 0 DIADMN C[C@@H](N[C@@H]1CC2(CCC2)Oc2ccccc21)c1cncc(F)c1 ZINC000359254202 336664596 /nfs/dbraw/zinc/66/45/96/336664596.db2.gz 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20 0 DIADMN COC(=O)[C@H]1CC[C@@H](N[C@@H](C)c2cc(Cl)sc2Cl)C1 ZINC000193872357 337079729 /nfs/dbraw/zinc/07/97/29/337079729.db2.gz FWHGRRMGYKPBDZ-XHNCKOQMSA-N 0 1 322.257 4.047 20 0 DIADMN CC[C@@H](NCc1nc(-c2ccccc2)c[nH]1)c1ccc(OC)cc1 ZINC000194223348 337083207 /nfs/dbraw/zinc/08/32/07/337083207.db2.gz VVKIKRQOELLHHB-GOSISDBHSA-N 0 1 321.424 4.326 20 0 DIADMN CC(C)(C)c1csc(C2CCN(Cc3cncs3)CC2)n1 ZINC000360073848 337084970 /nfs/dbraw/zinc/08/49/70/337084970.db2.gz HDNGUGZOYMAEMH-UHFFFAOYSA-N 0 1 321.515 4.277 20 0 DIADMN CC(C)[C@@H](c1ccccc1)N(C)Cc1nnc(-c2ccco2)o1 ZINC000171860325 337089391 /nfs/dbraw/zinc/08/93/91/337089391.db2.gz MKRWMOAZUMYAMK-KRWDZBQOSA-N 0 1 311.385 4.159 20 0 DIADMN COC1(CCSc2nc(Cc3ccccc3)c(C)[nH]2)CCC1 ZINC000583705760 337092622 /nfs/dbraw/zinc/09/26/22/337092622.db2.gz VUHZWFAWEAACPF-UHFFFAOYSA-N 0 1 316.470 4.360 20 0 DIADMN COCc1ccc(CN2CCC(c3cccc(F)c3F)CC2)o1 ZINC000582521069 337100273 /nfs/dbraw/zinc/10/02/73/337100273.db2.gz FYUGKRUNWAHETB-UHFFFAOYSA-N 0 1 321.367 4.084 20 0 DIADMN CC[N@H+](Cc1cccs1)Cc1cccc(C(=O)[O-])c1Cl ZINC000394471561 337114397 /nfs/dbraw/zinc/11/43/97/337114397.db2.gz MVLVCQKMGRORPX-UHFFFAOYSA-N 0 1 309.818 4.122 20 0 DIADMN CC[N@@H+](Cc1cccs1)Cc1cccc(C(=O)[O-])c1Cl ZINC000394471561 337114398 /nfs/dbraw/zinc/11/43/98/337114398.db2.gz MVLVCQKMGRORPX-UHFFFAOYSA-N 0 1 309.818 4.122 20 0 DIADMN C[N@H+](Cc1ccc(Cl)cc1)Cc1cccc(C(=O)[O-])c1Cl ZINC000394474025 337114411 /nfs/dbraw/zinc/11/44/11/337114411.db2.gz GWTKZVRFLFQRLJ-UHFFFAOYSA-N 0 1 324.207 4.324 20 0 DIADMN C[N@@H+](Cc1ccc(Cl)cc1)Cc1cccc(C(=O)[O-])c1Cl ZINC000394474025 337114412 /nfs/dbraw/zinc/11/44/12/337114412.db2.gz GWTKZVRFLFQRLJ-UHFFFAOYSA-N 0 1 324.207 4.324 20 0 DIADMN c1ncc(CN2CCc3ccccc3[C@@H]2c2ccccc2)s1 ZINC000582658274 337116938 /nfs/dbraw/zinc/11/69/38/337116938.db2.gz XBWNUJQMUMAREX-IBGZPJMESA-N 0 1 306.434 4.291 20 0 DIADMN CCCOc1cccc(CN2CC3(CCC3)[C@H]2[C@H]2CCCO2)c1 ZINC000582658355 337116950 /nfs/dbraw/zinc/11/69/50/337116950.db2.gz 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CC(C)(C)c1nc(CN[C@H]2C[C@H](c3ccccc3)C2)cs1 ZINC000435787191 338249229 /nfs/dbraw/zinc/24/92/29/338249229.db2.gz LIOGOUOWIKGNTD-SHTZXODSSA-N 0 1 300.471 4.476 20 0 DIADMN COc1ccc(Cl)cc1CNCc1cc2c(cccc2F)[nH]1 ZINC000436239225 338263026 /nfs/dbraw/zinc/26/30/26/338263026.db2.gz HSEMKSAZICLPLQ-UHFFFAOYSA-N 0 1 318.779 4.259 20 0 DIADMN Cc1nc(C(C)(C)NCc2cc3c(cccc3F)[nH]2)sc1C ZINC000436251721 338263689 /nfs/dbraw/zinc/26/36/89/338263689.db2.gz JOEUHSKSQZLSNW-UHFFFAOYSA-N 0 1 317.433 4.405 20 0 DIADMN CC1=CCCN(Cc2cc(Br)cc3cccnc32)C1 ZINC000436260387 338264124 /nfs/dbraw/zinc/26/41/24/338264124.db2.gz NAAFAIFGRMRXBV-UHFFFAOYSA-N 0 1 317.230 4.149 20 0 DIADMN CC1(C)CCc2ccccc2[C@H](N[C@@H](CCO)c2ccco2)C1 ZINC000436280623 338265527 /nfs/dbraw/zinc/26/55/27/338265527.db2.gz BXONPWGLNIYUQJ-ZWKOTPCHSA-N 0 1 313.441 4.397 20 0 DIADMN CC(C)c1nnc(CN[C@@H]2CC[C@H](c3ccccc3)C2)s1 ZINC000436294097 338266860 /nfs/dbraw/zinc/26/68/60/338266860.db2.gz PKTDAXLDLQJRQU-LSDHHAIUSA-N 0 1 301.459 4.087 20 0 DIADMN CC(C)c1nnc(CN[C@H]2CC[C@@H](Cc3ccccc3)C2)s1 ZINC000436295904 338267142 /nfs/dbraw/zinc/26/71/42/338267142.db2.gz SMCQCDCIADDJTN-HOTGVXAUSA-N 0 1 315.486 4.163 20 0 DIADMN CC[C@@H](NCc1cc2c(cccc2F)[nH]1)c1c(C)noc1C ZINC000436398714 338270709 /nfs/dbraw/zinc/27/07/09/338270709.db2.gz AKRXANMUUZJNMS-OAHLLOKOSA-N 0 1 301.365 4.153 20 0 DIADMN Cc1cc(C)cc([C@H](C)NC(=O)c2ccc(O)c(Cl)c2)c1 ZINC000436485174 338273771 /nfs/dbraw/zinc/27/37/71/338273771.db2.gz JVFJIHGGFTUOMC-LBPRGKRZSA-N 0 1 303.789 4.153 20 0 DIADMN Cc1cccc([C@@H]2CCCN2C(=O)c2c(O)cccc2F)c1C ZINC000436516637 338274767 /nfs/dbraw/zinc/27/47/67/338274767.db2.gz UVXVMNIGFIIZKF-INIZCTEOSA-N 0 1 313.372 4.125 20 0 DIADMN Cc1ccc(-c2noc(-c3cc(Cl)ccc3O)n2)c(F)c1 ZINC000436537884 338275871 /nfs/dbraw/zinc/27/58/71/338275871.db2.gz GNVKAGZDNZCUST-UHFFFAOYSA-N 0 1 304.708 4.210 20 0 DIADMN Cc1noc(C)c1NC(=O)c1cc(Cl)c2ccccc2c1O ZINC000436538704 338276189 /nfs/dbraw/zinc/27/61/89/338276189.db2.gz JEBDVXDJGDALCF-UHFFFAOYSA-N 0 1 316.744 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338290958 /nfs/dbraw/zinc/29/09/58/338290958.db2.gz TZAVWPMSTCGTDP-UHFFFAOYSA-N 0 1 324.163 4.154 20 0 DIADMN O=C(NCc1ccc2ccccc2c1)c1ccc(O)c(Cl)c1 ZINC000436891348 338292167 /nfs/dbraw/zinc/29/21/67/338292167.db2.gz GCBRASUGIUAJAY-UHFFFAOYSA-N 0 1 311.768 4.129 20 0 DIADMN C[C@H](Oc1ccccc1)c1noc(-c2ccc(Cl)cc2O)n1 ZINC000436930076 338294032 /nfs/dbraw/zinc/29/40/32/338294032.db2.gz GWAJPGKXCJLRIX-JTQLQIEISA-N 0 1 316.744 4.236 20 0 DIADMN Cc1cc(-c2noc([C@H](C)c3ccccc3)n2)cc2nc[nH]c21 ZINC000436933576 338294323 /nfs/dbraw/zinc/29/43/23/338294323.db2.gz IDGVECOQLZCUNP-GFCCVEGCSA-N 0 1 304.353 4.073 20 0 DIADMN COc1cnccc1[C@H](C)N[C@@H](C)c1cc2c(s1)CCC2 ZINC000437074344 338299481 /nfs/dbraw/zinc/29/94/81/338299481.db2.gz IQIAMIQTGDSQRG-RYUDHWBXSA-N 0 1 302.443 4.052 20 0 DIADMN CCc1cccnc1[C@H](C)NCc1ccccc1N(C)C(C)C ZINC000437080092 338299661 /nfs/dbraw/zinc/29/96/61/338299661.db2.gz SHGYOHRHIMCHGV-INIZCTEOSA-N 0 1 311.473 4.339 20 0 DIADMN CC(C)C(C)(C)CN[C@@H](c1ccn(C)n1)c1ccc(Cl)cc1 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NLMCDPWBTXVSOO-GOSISDBHSA-N 0 1 313.470 4.358 20 0 DIADMN C[C@H](NC(=O)C[C@@H]1CC[C@@H](C)C1)c1nc2ccc(Cl)cc2[nH]1 ZINC000759201149 1046333668 /nfs/dbraw/zinc/33/36/68/1046333668.db2.gz KODVIEBWJLQRCY-GRYCIOLGSA-N 0 1 319.836 4.220 20 0 DIADMN C[C@H]1CC[C@@H](C(=O)[O-])C[N@H+]1Cc1ccc(-c2ccccc2)cc1 ZINC000263488753 1046333853 /nfs/dbraw/zinc/33/38/53/1046333853.db2.gz IAUSYJIHOKDWIW-HNAYVOBHSA-N 0 1 309.409 4.039 20 0 DIADMN CC[C@H](N[C@@H]1CS[C@H](C)C1)c1nc(C(F)(F)F)cs1 ZINC000638701842 1046335172 /nfs/dbraw/zinc/33/51/72/1046335172.db2.gz VPLAJAZOWBKLAF-VGMNWLOBSA-N 0 1 310.410 4.097 20 0 DIADMN CN(Cc1cc(Br)cnc1Cl)CC1CCCC1 ZINC001138945689 1046335120 /nfs/dbraw/zinc/33/51/20/1046335120.db2.gz OPAPVVGDRSHYGC-UHFFFAOYSA-N 0 1 317.658 4.120 20 0 DIADMN CC[N@@H+](Cc1occ(C(F)(F)F)c1C(=O)[O-])C1CCCCC1 ZINC000903884988 1046335495 /nfs/dbraw/zinc/33/54/95/1046335495.db2.gz FWJFOVMDKVVWOH-UHFFFAOYSA-N 0 1 319.323 4.151 20 0 DIADMN CCc1cnccc1[C@H](C)NCc1cc2cc(Cl)cnc2o1 ZINC000648492228 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4.022 20 0 DIADMN O=C([O-])[C@@H]1CC[C@@H](c2ccccc2)[N@H+]1CC1CCC2(CC2)CC1 ZINC000903907248 1046339347 /nfs/dbraw/zinc/33/93/47/1046339347.db2.gz JPFZVLYEUIKNEJ-ROUUACIJSA-N 0 1 313.441 4.247 20 0 DIADMN C[C@@H]1C[C@H](C(=O)[O-])CC[N@H+]1Cc1ccc(Cl)c2ccccc12 ZINC000903939061 1046340007 /nfs/dbraw/zinc/34/00/07/1046340007.db2.gz LSZZPLWPXGMWGB-CHWSQXEVSA-N 0 1 317.816 4.178 20 0 DIADMN CO[C@H]1CCN(Cc2cc(Cl)ccc2OC(C)C)[C@H](C)C1 ZINC001138963188 1046340397 /nfs/dbraw/zinc/34/03/97/1046340397.db2.gz XNLFXWWRVVAEFG-CJNGLKHVSA-N 0 1 311.853 4.127 20 0 DIADMN CC(C)Oc1ccc(Cl)cc1CN1CC[C@H](OC(C)C)C1 ZINC001138962875 1046340463 /nfs/dbraw/zinc/34/04/63/1046340463.db2.gz OWFKFTCDAZAHSO-INIZCTEOSA-N 0 1 311.853 4.127 20 0 DIADMN O=C([O-])c1ccc(C[N@H+]2C[C@H](C3CC3)C[C@@H]2C2CC2)cc1Cl ZINC000903933701 1046340776 /nfs/dbraw/zinc/34/07/76/1046340776.db2.gz DSOVGGBLDNOGMJ-RHSMWYFYSA-N 0 1 319.832 4.049 20 0 DIADMN CC1(C)C[C@@H](c2ccccc2)C[N@H+]1Cc1ccccc1C(=O)[O-] ZINC000903934301 1046341046 /nfs/dbraw/zinc/34/10/46/1046341046.db2.gz MERVZWLGAGMTKA-QGZVFWFLSA-N 0 1 309.409 4.153 20 0 DIADMN CC(C)Oc1ccc(Cl)cc1CN1CC[C@]2(C1)CCCOC2 ZINC001138960850 1046341651 /nfs/dbraw/zinc/34/16/51/1046341651.db2.gz WOUIGFPCEYAJEW-SFHVURJKSA-N 0 1 323.864 4.130 20 0 DIADMN CC1(C)Nc2ccccc2[C@@H]1NCc1cnc(C2CCC2)s1 ZINC000903947618 1046341882 /nfs/dbraw/zinc/34/18/82/1046341882.db2.gz CJHSZADIQNEXIW-INIZCTEOSA-N 0 1 313.470 4.446 20 0 DIADMN C[C@@H]1C[C@H](C)[N@@H+](C/C=C/c2ccc(Cl)cc2)[C@H](C)[C@H]1C(=O)[O-] ZINC000903953934 1046342732 /nfs/dbraw/zinc/34/27/32/1046342732.db2.gz VUAADVDPCXHACP-PEUWOWPCSA-N 0 1 321.848 4.173 20 0 DIADMN C[C@@H]1C[C@H](C)[N@@H+](Cc2ccc3ccccc3c2)[C@H](C)[C@H]1C(=O)[O-] ZINC000903950276 1046343890 /nfs/dbraw/zinc/34/38/90/1046343890.db2.gz PQUIRRYFSPLQIT-GJRWTSMGSA-N 0 1 311.425 4.159 20 0 DIADMN C[C@@H]1C[C@H](C)[N@@H+](Cc2ccc(C(C)(C)C)cc2)[C@H](C)[C@@H]1C(=O)[O-] ZINC000903950524 1046344043 /nfs/dbraw/zinc/34/40/43/1046344043.db2.gz QIOHDEBRIWAARD-BASYENTBSA-N 0 1 317.473 4.304 20 0 DIADMN CC(C)c1cccc(C[N@H+]2[C@H](C)C[C@H](C)[C@H](C(=O)[O-])[C@H]2C)c1 ZINC000903950731 1046344098 /nfs/dbraw/zinc/34/40/98/1046344098.db2.gz HGBCUGJHWQIMIY-BORJPKMPSA-N 0 1 303.446 4.130 20 0 DIADMN Cc1nnsc1CN[C@@H]1C[C@H]2CCC(C)(C)c3cccc1c32 ZINC000638842633 1046344394 /nfs/dbraw/zinc/34/43/94/1046344394.db2.gz WVFMIXFHSKQITK-IUODEOHRSA-N 0 1 313.470 4.236 20 0 DIADMN CC(C)COc1ccc(CN2CCC[C@@H](C(F)(F)F)C2)cc1 ZINC001138971565 1046345941 /nfs/dbraw/zinc/34/59/41/1046345941.db2.gz SJKOFDQOGNDPPO-OAHLLOKOSA-N 0 1 315.379 4.496 20 0 DIADMN CCOc1ccc(CN2CC3(C2)CCCCC3)cc1OCC ZINC001138976055 1046346180 /nfs/dbraw/zinc/34/61/80/1046346180.db2.gz RBSCXTZNXLZWGG-UHFFFAOYSA-N 0 1 303.446 4.250 20 0 DIADMN Cc1ccc(N2CCN(CCCCC(F)(F)F)CC2)cc1C ZINC000759343037 1046346339 /nfs/dbraw/zinc/34/63/39/1046346339.db2.gz KBQHYNMKABVJPE-UHFFFAOYSA-N 0 1 314.395 4.158 20 0 DIADMN Cc1cccc(C2=CC[N@H+]([C@@H](C(=O)[O-])c3ccccc3)CC2)c1C ZINC000903962404 1046346352 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CC(C)Oc1cccc(CN2CC[C@](CF)(C(F)(F)F)C2)c1 ZINC001138983731 1046350289 /nfs/dbraw/zinc/35/02/89/1046350289.db2.gz ZIGVQSGGDRBCGH-OAHLLOKOSA-N 0 1 319.342 4.198 20 0 DIADMN Cc1nc2ccc(NC(=O)c3oc4c(cccc4C)c3C)cc2[nH]1 ZINC000053191945 1046352898 /nfs/dbraw/zinc/35/28/98/1046352898.db2.gz JQMHGGSVEHFFSC-UHFFFAOYSA-N 0 1 319.364 4.487 20 0 DIADMN COc1cc(CN[C@@H]2CCCc3sccc32)c(Cl)cc1O ZINC000639052964 1046353649 /nfs/dbraw/zinc/35/36/49/1046353649.db2.gz FGDVTUXAXBNSJG-CYBMUJFWSA-N 0 1 323.845 4.283 20 0 DIADMN Cc1cnc(CNCC(C)(C)c2ccc(C(F)(F)F)cc2)o1 ZINC000639093203 1046359023 /nfs/dbraw/zinc/35/90/23/1046359023.db2.gz IHQJEANKLFPXLZ-UHFFFAOYSA-N 0 1 312.335 4.069 20 0 DIADMN FC(F)c1ccc(CN2CCC(F)(c3ccccc3)CC2)cn1 ZINC000639112994 1046359382 /nfs/dbraw/zinc/35/93/82/1046359382.db2.gz RLFFWIQAOWNUNR-UHFFFAOYSA-N 0 1 320.358 4.480 20 0 DIADMN CC(C)c1ccc2c(c1)[C@H](N[C@@H](c1nccn1C)C1CC1)CC2 ZINC000639095492 1046360030 /nfs/dbraw/zinc/36/00/30/1046360030.db2.gz SLMSUGBLCUWPCN-RTBURBONSA-N 0 1 309.457 4.272 20 0 DIADMN Cc1ccncc1CN(C)Cc1ccccc1CC(F)(F)F ZINC000639124136 1046361249 /nfs/dbraw/zinc/36/12/49/1046361249.db2.gz ITNPUMDSOYKYJT-UHFFFAOYSA-N 0 1 308.347 4.127 20 0 DIADMN Cc1cc(CN2CC[C@H](C(F)(F)F)C3(CCC3)C2)sn1 ZINC000639142745 1046364020 /nfs/dbraw/zinc/36/40/20/1046364020.db2.gz MAYKPKMJZNRGKB-LBPRGKRZSA-N 0 1 304.381 4.006 20 0 DIADMN CCn1ccnc1[C@@H]1CCCCN1Cc1cccc2ncccc12 ZINC000639131251 1046364447 /nfs/dbraw/zinc/36/44/47/1046364447.db2.gz QFMNTPDYTSEPCV-IBGZPJMESA-N 0 1 320.440 4.178 20 0 DIADMN C[C@H]1C[N@@H+](Cc2ccc(C(=O)[O-])cc2)CC[C@@H]1c1ccccc1 ZINC000263576144 1046366006 /nfs/dbraw/zinc/36/60/06/1046366006.db2.gz QAPBAFYENWESLX-KXBFYZLASA-N 0 1 309.409 4.010 20 0 DIADMN Cc1nnsc1CNCc1ccc(C2CCCCC2)cc1 ZINC000639202933 1046369049 /nfs/dbraw/zinc/36/90/49/1046369049.db2.gz NWBOEUHYYGDVRU-UHFFFAOYSA-N 0 1 301.459 4.184 20 0 DIADMN CCSc1cccc(CNCc2nc3ccccc3nc2C)c1 ZINC000639200199 1046369507 /nfs/dbraw/zinc/36/95/07/1046369507.db2.gz FCURDDTXCAWSII-UHFFFAOYSA-N 0 1 323.465 4.340 20 0 DIADMN C[C@H]1C[C@H](C(F)(F)F)CCN1Cc1ccc(C(F)F)nc1 ZINC000639226085 1046371531 /nfs/dbraw/zinc/37/15/31/1046371531.db2.gz BRDSBDVGHMUORG-GXSJLCMTSA-N 0 1 308.294 4.182 20 0 DIADMN Cc1ccc(N2CCN(Cc3cc4ccccc4o3)CC2)cc1 ZINC001139059819 1046372247 /nfs/dbraw/zinc/37/22/47/1046372247.db2.gz LHUUWUCHFJDVOT-UHFFFAOYSA-N 0 1 306.409 4.063 20 0 DIADMN Fc1ccc(-c2cccc(CN3CCc4cnccc4C3)c2)cc1 ZINC001139064748 1046372779 /nfs/dbraw/zinc/37/27/79/1046372779.db2.gz GKRBCFRUSDJHGV-UHFFFAOYSA-N 0 1 318.395 4.446 20 0 DIADMN Cc1cccc(CC2CN(Cc3ccc(C(F)F)nc3)C2)c1 ZINC000639249698 1046374308 /nfs/dbraw/zinc/37/43/08/1046374308.db2.gz LBTHTUNFRDJPAR-UHFFFAOYSA-N 0 1 302.368 4.002 20 0 DIADMN CC/C=C(/C)C(=O)Nc1cc(Cl)cc(Br)c1O ZINC000759743079 1046376298 /nfs/dbraw/zinc/37/62/98/1046376298.db2.gz XKRVVZKSDOVMEH-DAXSKMNVSA-N 0 1 318.598 4.103 20 0 DIADMN O=C(C=Cc1ccsc1)Nc1ccc2nc(C(F)F)[nH]c2c1 ZINC000759751867 1046378639 /nfs/dbraw/zinc/37/86/39/1046378639.db2.gz XRYKQBBBHHSITO-DAFODLJHSA-N 0 1 319.336 4.214 20 0 DIADMN Cc1noc(C)c1CN(C)CCCSCc1ccccc1 ZINC000090516978 1046380068 /nfs/dbraw/zinc/38/00/68/1046380068.db2.gz AUIFYPYTHMFXIQ-UHFFFAOYSA-N 0 1 304.459 4.047 20 0 DIADMN Cc1cnc(C(=O)Nc2ccc3nc(C4CCC4)[nH]c3c2)c(C)c1 ZINC000780449848 1046385985 /nfs/dbraw/zinc/38/59/85/1046385985.db2.gz JSGBZDOMOABPCF-UHFFFAOYSA-N 0 1 320.396 4.095 20 0 DIADMN CCCN(CCC)Cc1ccc(Br)nc1Cl ZINC001139108581 1046387736 /nfs/dbraw/zinc/38/77/36/1046387736.db2.gz VRCNFTNIYMDOAA-UHFFFAOYSA-N 0 1 305.647 4.120 20 0 DIADMN Cc1n[nH]c(C)c1CN(C)C(c1ccccc1)c1ccccc1 ZINC001139094644 1046387783 /nfs/dbraw/zinc/38/77/83/1046387783.db2.gz QVMYNAUGBMJSKC-UHFFFAOYSA-N 0 1 305.425 4.248 20 0 DIADMN CCn1ccc2ccc(CN3CCC(=O)[C@@H](C)C34CCCC4)cc21 ZINC001139120577 1046388292 /nfs/dbraw/zinc/38/82/92/1046388292.db2.gz WEBVXMCAKZXBHR-MRXNPFEDSA-N 0 1 324.468 4.385 20 0 DIADMN CC(C)OC(=O)O[C@@H](C)Sc1nc2ccc(Cl)cc2[nH]1 ZINC000748651940 1046390802 /nfs/dbraw/zinc/39/08/02/1046390802.db2.gz WIKOZSIPCRDILD-MRVPVSSYSA-N 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CC(C)c1cnc(CNC[C@H]2CCC3(CCCCC3)O2)s1 ZINC000480470489 1048153521 /nfs/dbraw/zinc/15/35/21/1048153521.db2.gz MRVSXMYOSMYLKU-CQSZACIVSA-N 0 1 308.491 4.238 20 0 DIADMN O=C(c1c(O)cc(Cl)cc1Cl)N1CCCC2(CC2)CC1 ZINC001161705279 1048156485 /nfs/dbraw/zinc/15/64/85/1048156485.db2.gz AOIUCHOUWBJODL-UHFFFAOYSA-N 0 1 314.212 4.105 20 0 DIADMN CC(C)(C)c1nc(Nc2cccc(C(F)(F)F)c2F)no1 ZINC001175135461 1048159011 /nfs/dbraw/zinc/15/90/11/1048159011.db2.gz MXSSGWGMCUMVTB-UHFFFAOYSA-N 0 1 303.259 4.269 20 0 DIADMN Fc1c(Nc2ccnn2-c2ccncc2)cccc1C(F)(F)F ZINC001175134545 1048159585 /nfs/dbraw/zinc/15/95/85/1048159585.db2.gz QVVSKCWFNKULMB-UHFFFAOYSA-N 0 1 322.265 4.169 20 0 DIADMN Cc1ccc2nc(SCc3nc(C4CC4)cs3)[nH]c2c1 ZINC000554729517 1048161032 /nfs/dbraw/zinc/16/10/32/1048161032.db2.gz HOWXMUCFYGWEQY-UHFFFAOYSA-N 0 1 301.440 4.498 20 0 DIADMN C[C@H]1Oc2ccccc2[C@@H]1NCc1ccc(C(F)(F)F)cc1 ZINC000554723038 1048165853 /nfs/dbraw/zinc/16/58/53/1048165853.db2.gz NKKIRDUIUHZJGO-BDJLRTHQSA-N 0 1 307.315 4.317 20 0 DIADMN Cc1ccc(CNc2ccnc3ccc(C(F)(F)F)cc32)o1 ZINC001161769751 1048168140 /nfs/dbraw/zinc/16/81/40/1048168140.db2.gz ZMDFYIDKLASQLV-UHFFFAOYSA-N 0 1 306.287 4.189 20 0 DIADMN C[C@@H](c1cccc(Cl)c1F)N1CCCC2(CCOCC2)C1 ZINC000480538701 1048170557 /nfs/dbraw/zinc/17/05/57/1048170557.db2.gz ITTAHVFVIDOPFZ-ZDUSSCGKSA-N 0 1 311.828 4.433 20 0 DIADMN CC[C@@H]1CN(Cc2cn(C3CCC3)nn2)CC[C@H]1c1ccccc1 ZINC000667690731 1048172062 /nfs/dbraw/zinc/17/20/62/1048172062.db2.gz HBFNIFNJOAZAPE-OXQOHEQNSA-N 0 1 324.472 4.019 20 0 DIADMN Cc1cc(N2CC[C@H](C(F)(F)F)[C@@H]2C)c2cc(F)ccc2n1 ZINC000480551517 1048175318 /nfs/dbraw/zinc/17/53/18/1048175318.db2.gz GWYFJLJWISXFRQ-GWCFXTLKSA-N 0 1 312.310 4.459 20 0 DIADMN CC(C)C[C@@H](C)CN1CCc2nc[nH]c2[C@@H]1c1ccc(F)cc1 ZINC001175164370 1048177843 /nfs/dbraw/zinc/17/78/43/1048177843.db2.gz KROGBWHVAZIOPG-KUHUBIRLSA-N 0 1 315.436 4.179 20 0 DIADMN CC(C)C[C@@H](C)CN1CCc2nc[nH]c2[C@H]1c1ccc(F)cc1 ZINC001175164368 1048178123 /nfs/dbraw/zinc/17/81/23/1048178123.db2.gz 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/nfs/dbraw/zinc/19/46/77/1048194677.db2.gz QTRIGFMYTUAQTH-UHFFFAOYSA-N 0 1 321.785 4.195 20 0 DIADMN CCOc1ccc([C@@H](C)Nc2cc(OC(C)C)ccn2)cc1 ZINC001161975673 1048204183 /nfs/dbraw/zinc/20/41/83/1048204183.db2.gz HHHXMGGHOYPFNJ-CQSZACIVSA-N 0 1 300.402 4.441 20 0 DIADMN C[C@H](CN(C)CC(=O)Nc1ccc(F)c(F)c1)C1CCCCC1 ZINC001175228937 1048204746 /nfs/dbraw/zinc/20/47/46/1048204746.db2.gz JQPJKRZOWAFPCR-CYBMUJFWSA-N 0 1 324.415 4.052 20 0 DIADMN Cc1ncn(C)c1Nc1ccc(OCc2ccccc2)cc1C ZINC001175230039 1048207673 /nfs/dbraw/zinc/20/76/73/1048207673.db2.gz PBUOOMIZRYKSNY-UHFFFAOYSA-N 0 1 307.397 4.360 20 0 DIADMN Cc1cnc(NCc2cccc(OC(F)F)c2)c2[nH]ccc21 ZINC001161983917 1048207916 /nfs/dbraw/zinc/20/79/16/1048207916.db2.gz LWMHWGAGXOGDMC-UHFFFAOYSA-N 0 1 303.312 4.085 20 0 DIADMN Cc1ncc(Nc2c(F)cccc2OCc2ccccc2)n1C ZINC001175279187 1048227453 /nfs/dbraw/zinc/22/74/53/1048227453.db2.gz RJPWWAPDWMKNRS-UHFFFAOYSA-N 0 1 311.360 4.190 20 0 DIADMN C[C@@H](c1ccc(Cl)cc1Cl)N1C[C@@H]2CCC[C@]2(CO)C1 ZINC001175292786 1048236173 /nfs/dbraw/zinc/23/61/73/1048236173.db2.gz OMJLNHRCCCNOTO-MQIPJXDCSA-N 0 1 314.256 4.149 20 0 DIADMN Cc1cc(C)c(CCNc2ccncc2C(F)(F)F)c(C)c1 ZINC001185888617 1048238538 /nfs/dbraw/zinc/23/85/38/1048238538.db2.gz LNYWKROQBJFQCT-UHFFFAOYSA-N 0 1 308.347 4.102 20 0 DIADMN CCc1cc(CN[C@H](C)c2oc3ccc(C)cc3c2CC)n[nH]1 ZINC000776156468 1048239192 /nfs/dbraw/zinc/23/91/92/1048239192.db2.gz KWAAWONYFBPYDS-CYBMUJFWSA-N 0 1 311.429 4.440 20 0 DIADMN CCc1cc(CN[C@H](C)c2oc3ccc(C)cc3c2CC)[nH]n1 ZINC000776156468 1048239204 /nfs/dbraw/zinc/23/92/04/1048239204.db2.gz KWAAWONYFBPYDS-CYBMUJFWSA-N 0 1 311.429 4.440 20 0 DIADMN CCC[C@@]1(C)CCC[N@@H+](CC[C@H](C(=O)[O-])c2ccccc2)C1 ZINC000567509487 1048246656 /nfs/dbraw/zinc/24/66/56/1048246656.db2.gz HDTICTFFTLUPMR-HKUYNNGSSA-N 0 1 303.446 4.147 20 0 DIADMN C[C@@]1(CNc2ccncc2C(F)(F)F)CCCc2ccccc21 ZINC001186003986 1048251666 /nfs/dbraw/zinc/25/16/66/1048251666.db2.gz JEPMONULUXWEPK-KRWDZBQOSA-N 0 1 320.358 4.228 20 0 DIADMN Fc1cccc(F)c1-c1csc(C[N@H+]2CC[C@@H](C3CC3)C2)n1 ZINC000480847154 1048257147 /nfs/dbraw/zinc/25/71/47/1048257147.db2.gz AOSGFAQWBMLNFJ-GFCCVEGCSA-N 0 1 320.408 4.320 20 0 DIADMN Fc1cccc(F)c1-c1csc(CN2CC[C@@H](C3CC3)C2)n1 ZINC000480847154 1048257161 /nfs/dbraw/zinc/25/71/61/1048257161.db2.gz AOSGFAQWBMLNFJ-GFCCVEGCSA-N 0 1 320.408 4.320 20 0 DIADMN Cc1cnc(CCN(C)[C@@H](C)c2cccc(Cl)c2F)s1 ZINC000480868216 1048259132 /nfs/dbraw/zinc/25/91/32/1048259132.db2.gz ONLFASBECYJFOH-NSHDSACASA-N 0 1 312.841 4.480 20 0 DIADMN Cc1[nH]c2ccc(CNCc3cnn(C(C)(C)C)c3)cc2c1C ZINC000065013509 1048260762 /nfs/dbraw/zinc/26/07/62/1048260762.db2.gz NITSXMKSYDHQAQ-UHFFFAOYSA-N 0 1 310.445 4.026 20 0 DIADMN Cc1nc(C(C)C)ccc1CN1CCS[C@H]2CCCC[C@@H]21 ZINC000559107749 1048262854 /nfs/dbraw/zinc/26/28/54/1048262854.db2.gz TUMZRNKPLVRHLM-ROUUACIJSA-N 0 1 304.503 4.373 20 0 DIADMN COc1nc2ccccc2cc1CNC(C)(C)c1ccc(F)cc1 ZINC000776168481 1048264843 /nfs/dbraw/zinc/26/48/43/1048264843.db2.gz OYYTVOQUVMVJRO-UHFFFAOYSA-N 0 1 324.399 4.407 20 0 DIADMN COc1ccc([C@H](C)N[C@H](C)c2ccc[nH]2)c(Br)c1 ZINC000776171567 1048267607 /nfs/dbraw/zinc/26/76/07/1048267607.db2.gz OAMICTWOHRTQRC-WDEREUQCSA-N 0 1 323.234 4.198 20 0 DIADMN C[C@@]1(O)CC[C@@H](Nc2ccc3nc(-c4ccccc4)[nH]c3c2)CC1 ZINC001162360346 1048268249 /nfs/dbraw/zinc/26/82/49/1048268249.db2.gz IOTSELSAWBAURF-SGNKCFNYSA-N 0 1 321.424 4.335 20 0 DIADMN C[C@@H]1CN(C/C(Br)=C/c2ccccc2)C2(CC2)C1 ZINC001201464505 1048271754 /nfs/dbraw/zinc/27/17/54/1048271754.db2.gz REEZAJVKDFRIGV-GRRFOWRYSA-N 0 1 306.247 4.297 20 0 DIADMN [O-]c1c(Cl)nccc1Nc1ccc(C[NH+]2CCCCC2)cc1 ZINC001175362055 1048278672 /nfs/dbraw/zinc/27/86/72/1048278672.db2.gz BZPPBQAAMOUHNN-UHFFFAOYSA-N 0 1 317.820 4.170 20 0 DIADMN C[C@H](NCc1ccc2oc(=O)oc2c1)c1ccc(Cl)c(F)c1 ZINC001201490349 1048282427 /nfs/dbraw/zinc/28/24/27/1048282427.db2.gz CAOXTAQQZCLKAB-VIFPVBQESA-N 0 1 321.735 4.029 20 0 DIADMN FC(F)(F)c1cnccc1NCCc1cccc2ccccc21 ZINC001162466801 1048285896 /nfs/dbraw/zinc/28/58/96/1048285896.db2.gz 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/nfs/dbraw/zinc/30/36/41/1048303641.db2.gz MXHNSLXSJOXUPP-PZJWPPBQSA-N 0 1 323.436 4.146 20 0 DIADMN FC(F)(F)c1nc(Cl)ccc1CN1C[C@@H]2CC=CC[C@@H]2C1 ZINC001175436537 1048306588 /nfs/dbraw/zinc/30/65/88/1048306588.db2.gz LLDMYUGSFZRBGO-PHIMTYICSA-N 0 1 316.754 4.152 20 0 DIADMN Cc1cc(F)cc(NS(=O)(=O)c2csc3ccccc32)c1 ZINC001186495233 1048308901 /nfs/dbraw/zinc/30/89/01/1048308901.db2.gz DDIJCYAWTQVNPX-UHFFFAOYSA-N 0 1 321.398 4.150 20 0 DIADMN CC[C@@H](NCc1cc(C)c2ncccc2c1)c1c(C)noc1C ZINC001201529903 1048312770 /nfs/dbraw/zinc/31/27/70/1048312770.db2.gz UZXLKQBKYHVKQQ-QGZVFWFLSA-N 0 1 309.413 4.389 20 0 DIADMN Brc1ccc2c(c1)CCN(CCc1ccccc1)C2 ZINC001201596134 1048313441 /nfs/dbraw/zinc/31/34/41/1048313441.db2.gz WHBDPNCFNRTHHY-UHFFFAOYSA-N 0 1 316.242 4.050 20 0 DIADMN C[C@H](c1ccc(Cl)cc1)N1CCC[C@@H](C(=O)OC(C)(C)C)C1 ZINC001175473203 1048314854 /nfs/dbraw/zinc/31/48/54/1048314854.db2.gz TZQASZHYHDHOLN-UKRRQHHQSA-N 0 1 323.864 4.455 20 0 DIADMN COc1ccc2c(ccnc2N[C@@H](C)c2cccc(N(C)C)c2)c1 ZINC001162630218 1048317182 /nfs/dbraw/zinc/31/71/82/1048317182.db2.gz AQHNWVKBJIEKPM-AWEZNQCLSA-N 0 1 321.424 4.483 20 0 DIADMN CCCC[C@H](CC)CN1Cc2cnn(CC)c2[C@H](COCC)C1 ZINC001201559084 1048317844 /nfs/dbraw/zinc/31/78/44/1048317844.db2.gz IRKDSDMKRHQJDK-WMZOPIPTSA-N 0 1 321.509 4.055 20 0 DIADMN CCCC[C@H](CC)CN1Cc2cn(CC)nc2[C@H](COCC)C1 ZINC001201564486 1048318834 /nfs/dbraw/zinc/31/88/34/1048318834.db2.gz ANBNABCQDRGNJF-WMZOPIPTSA-N 0 1 321.509 4.055 20 0 DIADMN CCCC[C@@H](CC)CN1Cc2cn(CC)nc2[C@H](COCC)C1 ZINC001201564483 1048319206 /nfs/dbraw/zinc/31/92/06/1048319206.db2.gz ANBNABCQDRGNJF-AEFFLSMTSA-N 0 1 321.509 4.055 20 0 DIADMN CC[C@H]1CCCC[C@@H]1NCc1nc(Cc2ccccc2C)no1 ZINC000481180336 1048320910 /nfs/dbraw/zinc/32/09/10/1048320910.db2.gz XBCQHIQUVLWJQB-RDJZCZTQSA-N 0 1 313.445 4.027 20 0 DIADMN CCc1oc(CN(Cc2cccs2)C(C)C)cc1C(=O)OC ZINC000555336083 1048325786 /nfs/dbraw/zinc/32/57/86/1048325786.db2.gz IBTPEHYACGGQOR-UHFFFAOYSA-N 0 1 321.442 4.101 20 0 DIADMN 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Cc1nc(CN2CCC[C@@]2(C)c2ccccc2)nc2ccccc12 ZINC001175741642 1048431373 /nfs/dbraw/zinc/43/13/73/1048431373.db2.gz OGBUNRIBCWLJGL-NRFANRHFSA-N 0 1 317.436 4.449 20 0 DIADMN Cc1ccc(NC(=O)[C@H](C)N2CCCC[C@@H](C)C2)c(Cl)c1 ZINC000481589765 1048435152 /nfs/dbraw/zinc/43/51/52/1048435152.db2.gz VWFXCQUOEJXZDU-KGLIPLIRSA-N 0 1 308.853 4.097 20 0 DIADMN Cc1cc(C)c(NC(=O)[C@H](C)N2CCCC[C@@H](C)C2)c(Cl)c1 ZINC000481582089 1048435556 /nfs/dbraw/zinc/43/55/56/1048435556.db2.gz YQJWXRNJZPUCLR-DOMZBBRYSA-N 0 1 322.880 4.406 20 0 DIADMN COc1c2ccccc2oc1CNCc1csc(C)c1C ZINC001202066304 1048437261 /nfs/dbraw/zinc/43/72/61/1048437261.db2.gz TYKYVBBNCCPJRB-UHFFFAOYSA-N 0 1 301.411 4.410 20 0 DIADMN C[C@@H](O)c1ccc(CN[C@@H](C)c2cc(-c3ccccc3)no2)cc1 ZINC000924764199 1048439045 /nfs/dbraw/zinc/43/90/45/1048439045.db2.gz VMXBPLMCJXGACF-LSDHHAIUSA-N 0 1 322.408 4.246 20 0 DIADMN CCc1cccc(CC)c1NC(=O)[C@@H](C)[N@H+]1CCCC[C@H](C)C1 ZINC000481621606 1048440805 /nfs/dbraw/zinc/44/08/05/1048440805.db2.gz 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O=C([O-])c1cc(Cl)ccc1C[N@H+]1CCC[C@@H]1c1cccs1 ZINC001142657253 1048497925 /nfs/dbraw/zinc/49/79/25/1048497925.db2.gz SFBVPNAXKNVKFD-CQSZACIVSA-N 0 1 321.829 4.437 20 0 DIADMN Cc1ccsc1CNCc1c(F)cccc1OC(F)F ZINC001202241680 1048500845 /nfs/dbraw/zinc/50/08/45/1048500845.db2.gz HBAJOPOPRLKSBG-UHFFFAOYSA-N 0 1 301.333 4.087 20 0 DIADMN Cc1cc2ccccc2c(N2CCN(C)C[C@@H]2c2ccccc2)n1 ZINC001163673376 1048500987 /nfs/dbraw/zinc/50/09/87/1048500987.db2.gz WCPIRWLXDPJRDO-HXUWFJFHSA-N 0 1 317.436 4.036 20 0 DIADMN Cc1cccc2c1ccnc2N1CCN(C)C[C@H]1c1ccccc1 ZINC001163672139 1048502029 /nfs/dbraw/zinc/50/20/29/1048502029.db2.gz IHIPDZGZNFNTPS-FQEVSTJZSA-N 0 1 317.436 4.036 20 0 DIADMN C[C@@H]1CCC[C@H](C)N1C(=O)c1cc(-c2ccc(Cl)cc2)[nH]n1 ZINC000481851522 1048502487 /nfs/dbraw/zinc/50/24/87/1048502487.db2.gz DNIITIJPGGUVOR-TXEJJXNPSA-N 0 1 317.820 4.133 20 0 DIADMN Cc1nccnc1[C@@H](C)NCc1cc(Cl)cc2ccccc21 ZINC001175927098 1048502717 /nfs/dbraw/zinc/50/27/17/1048502717.db2.gz VBMJZAMQKJRICU-CYBMUJFWSA-N 0 1 311.816 4.442 20 0 DIADMN CCc1cc(C)cc(CC)c1NS(=O)(=O)c1ccccc1F ZINC000481863537 1048507845 /nfs/dbraw/zinc/50/78/45/1048507845.db2.gz DDQPOHQSAUEREZ-UHFFFAOYSA-N 0 1 321.417 4.060 20 0 DIADMN C[C@@H](CN(C)CC(=O)Nc1cc(Cl)ccc1F)C(C)(C)C ZINC001175982533 1048514877 /nfs/dbraw/zinc/51/48/77/1048514877.db2.gz HQIWNEMZNLGTFY-NSHDSACASA-N 0 1 314.832 4.032 20 0 DIADMN Fc1ccc2onc(C3CCN(CCC(F)(F)F)CC3)c2c1 ZINC001202345512 1048518109 /nfs/dbraw/zinc/51/81/09/1048518109.db2.gz DNKGVLIXWWMGKR-UHFFFAOYSA-N 0 1 316.298 4.099 20 0 DIADMN c1nc2ccc(NCc3cccc(Oc4ccccn4)c3)cc2[nH]1 ZINC001202350292 1048519008 /nfs/dbraw/zinc/51/90/08/1048519008.db2.gz ZBBSPFWTAYLFRR-UHFFFAOYSA-N 0 1 316.364 4.362 20 0 DIADMN CC1(C)C=C(Nc2cnn(C3CCOCC3)c2)CC(C)(C)C1 ZINC001175946016 1048522326 /nfs/dbraw/zinc/52/23/26/1048522326.db2.gz MLNFKJMPCSLXIW-UHFFFAOYSA-N 0 1 303.450 4.377 20 0 DIADMN Fc1cc(Nc2ccc3nn[nH]c3c2)ccc1OC1CCCC1 ZINC001176005395 1048528225 /nfs/dbraw/zinc/52/82/25/1048528225.db2.gz SOQDSZPTLYLATD-UHFFFAOYSA-N 0 1 312.348 4.162 20 0 DIADMN Fc1cc(Nc2ccc3n[nH]nc3c2)ccc1OC1CCCC1 ZINC001176005395 1048528243 /nfs/dbraw/zinc/52/82/43/1048528243.db2.gz SOQDSZPTLYLATD-UHFFFAOYSA-N 0 1 312.348 4.162 20 0 DIADMN Oc1ccc(-c2ccc(Nc3ccc4nn[nH]c4c3)cc2)cc1 ZINC001176002282 1048529320 /nfs/dbraw/zinc/52/93/20/1048529320.db2.gz JYUMPGGWDHHCGY-UHFFFAOYSA-N 0 1 302.337 4.074 20 0 DIADMN Oc1ccc(-c2ccc(Nc3ccc4n[nH]nc4c3)cc2)cc1 ZINC001176002282 1048529330 /nfs/dbraw/zinc/52/93/30/1048529330.db2.gz JYUMPGGWDHHCGY-UHFFFAOYSA-N 0 1 302.337 4.074 20 0 DIADMN Cc1cc(N2CCC(C(F)(F)F)CC2)c2cc(F)ccc2n1 ZINC000481992544 1048540543 /nfs/dbraw/zinc/54/05/43/1048540543.db2.gz OWIAHCRRXUXUIJ-UHFFFAOYSA-N 0 1 312.310 4.461 20 0 DIADMN c1cc(Nc2ccc(-c3ccccn3)cc2)n(-c2ccncc2)n1 ZINC001176038311 1048542168 /nfs/dbraw/zinc/54/21/68/1048542168.db2.gz LTSNNKMKXQCCPV-UHFFFAOYSA-N 0 1 313.364 4.073 20 0 DIADMN Cc1cccc(CN[C@H]2CCc3cc(F)c(F)c(F)c32)c1C ZINC001202417055 1048543019 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ZINC001163955594 1048557924 /nfs/dbraw/zinc/55/79/24/1048557924.db2.gz YXOGORPZSBRCNG-CQSZACIVSA-N 0 1 304.393 4.367 20 0 DIADMN Cc1ccc(CN(CCCC(C)C)Cc2ccnc(N)c2)o1 ZINC001176137365 1048560953 /nfs/dbraw/zinc/56/09/53/1048560953.db2.gz NLIDAEDWPAHJGB-UHFFFAOYSA-N 0 1 301.434 4.004 20 0 DIADMN C[C@H](Nc1nc(-c2cc(Cl)cc(Cl)c2)no1)C(F)F ZINC001163990038 1048565262 /nfs/dbraw/zinc/56/52/62/1048565262.db2.gz LCMXWESCKOPIGO-YFKPBYRVSA-N 0 1 308.115 4.109 20 0 DIADMN CC[C@H](NCc1nc2c(s1)CCCC2)c1ccc(F)cc1 ZINC000776339867 1048572101 /nfs/dbraw/zinc/57/21/01/1048572101.db2.gz QUVCWKYIJQCKCC-AWEZNQCLSA-N 0 1 304.434 4.402 20 0 DIADMN CCC(CC)[C@H](NCc1ncc(Cl)n1C)c1cccs1 ZINC000775212296 1048578502 /nfs/dbraw/zinc/57/85/02/1048578502.db2.gz NVZMRABHRBMDGQ-HNNXBMFYSA-N 0 1 311.882 4.402 20 0 DIADMN Cc1ccc(CN(C)[C@@H](CO)c2ccccc2C)c(Cl)c1 ZINC001176176639 1048580006 /nfs/dbraw/zinc/58/00/06/1048580006.db2.gz RBRONGIKWCSMOA-SFHVURJKSA-N 0 1 303.833 4.122 20 0 DIADMN CCCN(Cc1cnc(CC)s1)[C@@H]1CCCc2cccnc21 ZINC000482288382 1048582572 /nfs/dbraw/zinc/58/25/72/1048582572.db2.gz BPCXTZPBZBEJGU-MRXNPFEDSA-N 0 1 315.486 4.390 20 0 DIADMN CC[C@H](CN(CC)Cc1cn(C2CCC2)nn1)c1ccccc1 ZINC000668006629 1048589740 /nfs/dbraw/zinc/58/97/40/1048589740.db2.gz ZTWKLBQWQXIKSN-MRXNPFEDSA-N 0 1 312.461 4.019 20 0 DIADMN [O-]c1cc(F)cc(F)c1Nc1cccc(C[NH+]2CCCC2)c1 ZINC001176195783 1048591790 /nfs/dbraw/zinc/59/17/90/1048591790.db2.gz LKGGBLQXQRLYGC-UHFFFAOYSA-N 0 1 304.340 4.010 20 0 DIADMN CCN(Cc1c[nH]c2ccccc12)Cc1c(C2CCC2)cnn1C ZINC000668035583 1048602294 /nfs/dbraw/zinc/60/22/94/1048602294.db2.gz PKIBGKCEBZARSA-UHFFFAOYSA-N 0 1 322.456 4.191 20 0 DIADMN Cc1nc(SC[C@@H]2C[C@H]3CCC[C@@H]3O2)[nH]c1-c1ccccc1 ZINC001189173562 1048602401 /nfs/dbraw/zinc/60/24/01/1048602401.db2.gz ICORIQREXINILA-PMPSAXMXSA-N 0 1 314.454 4.435 20 0 DIADMN Cc1nc(SC[C@@H]2C[C@@H]3CCC[C@@H]3O2)[nH]c1-c1ccccc1 ZINC001189173560 1048602625 /nfs/dbraw/zinc/60/26/25/1048602625.db2.gz 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321.714 4.055 20 0 DIADMN CCOC(=O)c1ccc(CN(C(C)C)[C@@H](C)c2ccsc2)o1 ZINC001206328729 1049713786 /nfs/dbraw/zinc/71/37/86/1049713786.db2.gz NSHCBKQRRGVWBE-ZDUSSCGKSA-N 0 1 321.442 4.489 20 0 DIADMN COc1ccc([C@@H]2CN(CCCC3CCCCC3)CCO2)cc1 ZINC001197013330 1049714068 /nfs/dbraw/zinc/71/40/68/1049714068.db2.gz RNYRGLSTYVHGRI-FQEVSTJZSA-N 0 1 317.473 4.429 20 0 DIADMN CC(C)n1ccc(CN2CC[C@H](c3ccccc3F)C2(C)C)n1 ZINC001197042133 1049714203 /nfs/dbraw/zinc/71/42/03/1049714203.db2.gz XMHGAVVIJDXORS-QGZVFWFLSA-N 0 1 315.436 4.371 20 0 DIADMN Clc1ccccc1CC1CCN(Cc2ccns2)CC1 ZINC001197021604 1049716327 /nfs/dbraw/zinc/71/63/27/1049716327.db2.gz ZGNFTDCIWNPUGH-UHFFFAOYSA-N 0 1 306.862 4.251 20 0 DIADMN CC[C@@H]1CN(Cc2cccc(-c3ccccn3)c2)C[C@H](CC)O1 ZINC001206351544 1049717313 /nfs/dbraw/zinc/71/73/13/1049717313.db2.gz VVSRPSMLNVQWJB-KDURUIRLSA-N 0 1 310.441 4.138 20 0 DIADMN C[C@H](N[C@H]1CCc2cc(F)ccc21)c1ccnn1CC1CCC1 ZINC000924842822 1049720193 /nfs/dbraw/zinc/72/01/93/1049720193.db2.gz IIWYJXDTWXFLKD-UGSOOPFHSA-N 0 1 313.420 4.160 20 0 DIADMN Fc1cc2nc(-c3c(Cl)ccnc3F)[nH]c2c(Cl)c1 ZINC001251165282 1049728381 /nfs/dbraw/zinc/72/83/81/1049728381.db2.gz DGKKUAAJOXHYKA-UHFFFAOYSA-N 0 1 300.095 4.210 20 0 DIADMN COc1ccc([C@@H]2COCCN2C[C@@H](C)CC(C)(C)C)cc1 ZINC001197231529 1049730037 /nfs/dbraw/zinc/73/00/37/1049730037.db2.gz ZADZGBJHQZRQQD-YJBOKZPZSA-N 0 1 305.462 4.141 20 0 DIADMN CCN(Cc1ccccc1OC(C)C)[C@@H](CO)c1ccccc1 ZINC001197255544 1049733721 /nfs/dbraw/zinc/73/37/21/1049733721.db2.gz KQNQRWWXDYHLHJ-IBGZPJMESA-N 0 1 313.441 4.029 20 0 DIADMN CC[C@H](C)c1nc([C@@H](C)NC(=O)[C@@H](C)CC2CCCCC2)n[nH]1 ZINC000489224256 1049734205 /nfs/dbraw/zinc/73/42/05/1049734205.db2.gz USAVWPKZONOFTD-MELADBBJSA-N 0 1 320.481 4.102 20 0 DIADMN CC[C@H](C)c1nc([C@@H](C)NC(=O)[C@H](C)CC2CCCCC2)n[nH]1 ZINC000489224245 1049734281 /nfs/dbraw/zinc/73/42/81/1049734281.db2.gz USAVWPKZONOFTD-BFHYXJOUSA-N 0 1 320.481 4.102 20 0 DIADMN CC[C@H](C)c1nc([C@H](C)NC(=O)[C@H](C)CC2CCCCC2)n[nH]1 ZINC000489224262 1049735250 /nfs/dbraw/zinc/73/52/50/1049735250.db2.gz USAVWPKZONOFTD-MJBXVCDLSA-N 0 1 320.481 4.102 20 0 DIADMN CC[C@H](C)c1nc([C@H](C)NC(=O)[C@@H](C)CC2CCCCC2)n[nH]1 ZINC000489224250 1049735264 /nfs/dbraw/zinc/73/52/64/1049735264.db2.gz USAVWPKZONOFTD-IHRRRGAJSA-N 0 1 320.481 4.102 20 0 DIADMN Cc1c[nH]nc1CN1CC[C@H](c2ccccc2Cl)C1(C)C ZINC001197317439 1049738012 /nfs/dbraw/zinc/73/80/12/1049738012.db2.gz UFKFBZZJJDSLDW-CQSZACIVSA-N 0 1 303.837 4.140 20 0 DIADMN CC[C@H](C)CN(CC)[C@H](C)c1nc(Cc2ccc(F)cc2)no1 ZINC000489286243 1049739207 /nfs/dbraw/zinc/73/92/07/1049739207.db2.gz DSBGKFSBODUGQV-UONOGXRCSA-N 0 1 319.424 4.229 20 0 DIADMN COc1ccc([C@@H](C)NCc2cc3cc(C)ccc3o2)cc1O ZINC000570411241 1049740351 /nfs/dbraw/zinc/74/03/51/1049740351.db2.gz MGOGGTQOQISBOH-CYBMUJFWSA-N 0 1 311.381 4.306 20 0 DIADMN COc1nsc(CN2CCC[C@@H]2CC2CCCC2)c1Cl ZINC001206484983 1049741315 /nfs/dbraw/zinc/74/13/15/1049741315.db2.gz OMYJVEKRXHYDPU-GFCCVEGCSA-N 0 1 314.882 4.350 20 0 DIADMN CC1(C)C[C@@H](NCc2cccn2C(F)F)c2cc(F)ccc2O1 ZINC001206545457 1049752916 /nfs/dbraw/zinc/75/29/16/1049752916.db2.gz VROKHNMMIMPHCV-CQSZACIVSA-N 0 1 324.346 4.414 20 0 DIADMN Cc1cccc(-c2noc([C@H]3C[C@@H](c4ccccc4)CCN3)n2)c1 ZINC001206565649 1049757015 /nfs/dbraw/zinc/75/70/15/1049757015.db2.gz RXNSTPBHKSZURA-FUHWJXTLSA-N 0 1 319.408 4.253 20 0 DIADMN CC[C@H]1CN(Cc2ccc(C(F)(F)F)cc2C)[C@@H](CC)CO1 ZINC001206568524 1049757675 /nfs/dbraw/zinc/75/76/75/1049757675.db2.gz MUSHASYPCIFYDU-HOTGVXAUSA-N 0 1 315.379 4.403 20 0 DIADMN C[C@@H](CSc1ccccc1)N(C)Cc1nc2ccccc2o1 ZINC001206568500 1049758036 /nfs/dbraw/zinc/75/80/36/1049758036.db2.gz MBFFGRFFWWJMLI-AWEZNQCLSA-N 0 1 312.438 4.440 20 0 DIADMN CCCOc1ccc(CN2C[C@@H](CC)OC[C@@H]2CC)c(C)c1 ZINC001206569795 1049758390 /nfs/dbraw/zinc/75/83/90/1049758390.db2.gz XYWBCMJZYSUBDO-ZWKOTPCHSA-N 0 1 305.462 4.173 20 0 DIADMN CO[C@](C)(CN1CCc2ccc(Cl)c(Cl)c2C1)C1CC1 ZINC001206585596 1049762700 /nfs/dbraw/zinc/76/27/00/1049762700.db2.gz WNPAIZIOAVYRNK-MRXNPFEDSA-N 0 1 314.256 4.167 20 0 DIADMN CC(C)C1=NCCc2ccc(-c3cc4n[nH]cc4c(F)c3)cc21 ZINC001206603236 1049767066 /nfs/dbraw/zinc/76/70/66/1049767066.db2.gz YGWRUNDMLDRVFB-UHFFFAOYSA-N 0 1 307.372 4.370 20 0 DIADMN c1nc2cccc(-c3ccc4cnn([C@H]5CCCCO5)c4c3)c2[nH]1 ZINC001206642300 1049773796 /nfs/dbraw/zinc/77/37/96/1049773796.db2.gz ATDVQBFIGNACPG-GOSISDBHSA-N 0 1 318.380 4.279 20 0 DIADMN c1nc2ccc(-c3ccc4cnn([C@@H]5CCCCO5)c4c3)cc2[nH]1 ZINC001206643270 1049774941 /nfs/dbraw/zinc/77/49/41/1049774941.db2.gz QUGFSVILEXGMJL-IBGZPJMESA-N 0 1 318.380 4.279 20 0 DIADMN CN(Cc1csc(COc2ccccc2)n1)C1(C)CCCC1 ZINC000489865437 1049786745 /nfs/dbraw/zinc/78/67/45/1049786745.db2.gz NOAKLKKNOPWWQA-UHFFFAOYSA-N 0 1 316.470 4.487 20 0 DIADMN CC[C@@H]1CCC[C@H](CN2C[C@H](C)O[C@@H](CC(F)(F)F)C2)C1 ZINC001206740604 1049787189 /nfs/dbraw/zinc/78/71/89/1049787189.db2.gz BTMAYYRXWZJHIY-XGUBFFRZSA-N 0 1 307.400 4.245 20 0 DIADMN Cc1nccnc1[C@@H](C)N[C@H](C)c1ccc(F)c2ccccc21 ZINC000489908509 1049790806 /nfs/dbraw/zinc/79/08/06/1049790806.db2.gz RBWRTNJNSJTEHY-TZMCWYRMSA-N 0 1 309.388 4.489 20 0 DIADMN CSc1nc2ccsc2c(-c2cc(F)c(O)cc2F)n1 ZINC001206756008 1049792618 /nfs/dbraw/zinc/79/26/18/1049792618.db2.gz UFNYWSWQHSYMMK-UHFFFAOYSA-N 0 1 310.350 4.064 20 0 DIADMN COc1ccc2nc(-c3cc(F)c(O)cc3F)c(C)cc2c1 ZINC001206756276 1049793303 /nfs/dbraw/zinc/79/33/03/1049793303.db2.gz ZDUWKJBTBLGSKJ-UHFFFAOYSA-N 0 1 301.292 4.203 20 0 DIADMN Cc1nc(-c2ccccc2)sc1[C@@H](C)N[C@H](C)c1ccnnc1 ZINC000924849856 1049793596 /nfs/dbraw/zinc/79/35/96/1049793596.db2.gz JGJXKZHERAOCDH-CHWSQXEVSA-N 0 1 324.453 4.320 20 0 DIADMN Oc1cc(F)c(-c2cccc(OCc3ccccc3)n2)cc1F ZINC001206768184 1049794803 /nfs/dbraw/zinc/79/48/03/1049794803.db2.gz PTRHBVJMNZNXIP-UHFFFAOYSA-N 0 1 313.303 4.311 20 0 DIADMN Cc1ccc([C@H]2C[C@@H](C)N(CC(=O)Nc3ccccc3C)C2)cc1 ZINC000490037327 1049795803 /nfs/dbraw/zinc/79/58/03/1049795803.db2.gz XYUKOWUERCSTHI-MJGOQNOKSA-N 0 1 322.452 4.120 20 0 DIADMN CC(C)(C)[C@@H]1CCc2nnc(-c3cc(F)c(O)cc3F)cc2C1 ZINC001206775749 1049798192 /nfs/dbraw/zinc/79/81/92/1049798192.db2.gz JGDWSYYEFQAWHW-LLVKDONJSA-N 0 1 318.367 4.278 20 0 DIADMN Cc1ncc(CN2CC[C@@H](c3ccc(Cl)c(Cl)c3)C2)n1C ZINC001206794221 1049799526 /nfs/dbraw/zinc/79/95/26/1049799526.db2.gz LSQVEOKFXSEWLP-CYBMUJFWSA-N 0 1 324.255 4.025 20 0 DIADMN C[C@@H]1CN(CCCc2cccc(F)c2)C[C@H](c2ccsc2)O1 ZINC000490087447 1049802095 /nfs/dbraw/zinc/80/20/95/1049802095.db2.gz IWBXARJGHHCDPC-RDTXWAMCSA-N 0 1 319.445 4.282 20 0 DIADMN Cc1ccc(C)c([C@@H](N[C@H](C)CO)c2ccccc2Cl)c1 ZINC000490117849 1049805375 /nfs/dbraw/zinc/80/53/75/1049805375.db2.gz ISFOIUCRJDVCNP-KDOFPFPSSA-N 0 1 303.833 4.017 20 0 DIADMN C[C@]1(F)CCCN(Cc2cc(-c3ccc(F)cc3)on2)CC1 ZINC001206831083 1049807383 /nfs/dbraw/zinc/80/73/83/1049807383.db2.gz JAGUQPHTFOTEML-KRWDZBQOSA-N 0 1 306.356 4.195 20 0 DIADMN COc1ccc(-c2cc(CN3CCC(C(C)C)CC3)no2)cc1 ZINC001206828648 1049808090 /nfs/dbraw/zinc/80/80/90/1049808090.db2.gz BZHAKFMPCAVTKZ-UHFFFAOYSA-N 0 1 314.429 4.218 20 0 DIADMN CC[C@@H](NCc1cccc(OCC(C)C)c1)c1ccc(F)cn1 ZINC000490192032 1049810369 /nfs/dbraw/zinc/81/03/69/1049810369.db2.gz ZSWNZMUUPJHKHK-GOSISDBHSA-N 0 1 316.420 4.496 20 0 DIADMN F[C@H]1CCC2(C1)CCN(Cc1cc(-c3ccccc3)on1)CC2 ZINC001206847460 1049812199 /nfs/dbraw/zinc/81/21/99/1049812199.db2.gz HZEAMZMNJUJPFK-INIZCTEOSA-N 0 1 314.404 4.446 20 0 DIADMN C[C@@H]1CCN(Cc2cc(-c3ccccc3)on2)CCC1(F)F ZINC001206843087 1049812684 /nfs/dbraw/zinc/81/26/84/1049812684.db2.gz ULGGRXUVCDNRBE-CYBMUJFWSA-N 0 1 306.356 4.209 20 0 DIADMN CN(CCc1cccc(F)c1)Cc1cc(-c2ccccc2)on1 ZINC001206845622 1049813798 /nfs/dbraw/zinc/81/37/98/1049813798.db2.gz AMWTZPJPYDUPAT-UHFFFAOYSA-N 0 1 310.372 4.155 20 0 DIADMN Cc1ccnc(CN(C)[C@@H](C)c2ccc(Br)cc2)c1 ZINC001206854994 1049814616 /nfs/dbraw/zinc/81/46/16/1049814616.db2.gz LBFJRXDTBLXESO-ZDUSSCGKSA-N 0 1 319.246 4.346 20 0 DIADMN Cc1cccc(C2(NCc3cn4cc(C)ccc4n3)CCC2)c1 ZINC000646021315 1049816023 /nfs/dbraw/zinc/81/60/23/1049816023.db2.gz VDUJKVSIQJQHBB-UHFFFAOYSA-N 0 1 305.425 4.120 20 0 DIADMN CSc1ccccc1[C@@H]1CCCN1Cc1cncc(F)c1 ZINC001207025125 1049821696 /nfs/dbraw/zinc/82/16/96/1049821696.db2.gz SIOHUOACVVMJQH-INIZCTEOSA-N 0 1 302.418 4.280 20 0 DIADMN O=C(Nc1nc2ccc(C(F)(F)F)cc2[nH]1)[C@H]1CC12CCCC2 ZINC000490312702 1049821892 /nfs/dbraw/zinc/82/18/92/1049821892.db2.gz ADWPVHCPVZMPFE-SNVBAGLBSA-N 0 1 323.318 4.101 20 0 DIADMN CCN(Cc1ccc(Cl)cc1Cl)Cc1ccc[nH]c1=O ZINC001207010275 1049822029 /nfs/dbraw/zinc/82/20/29/1049822029.db2.gz MNGFRJDNCBWQRD-UHFFFAOYSA-N 0 1 311.212 4.116 20 0 DIADMN O=C(Nc1ccc2ccccc2c1)c1cc(-c2ccco2)n[nH]1 ZINC000912984465 1049823381 /nfs/dbraw/zinc/82/33/81/1049823381.db2.gz CDSMDYLPCQIZRR-UHFFFAOYSA-N 0 1 303.321 4.075 20 0 DIADMN CCn1nc(C)c(CN(C)Cc2ccc(CSC)cc2)c1C ZINC001207044442 1049824873 /nfs/dbraw/zinc/82/48/73/1049824873.db2.gz NGGYSAHYKRZISU-UHFFFAOYSA-N 0 1 317.502 4.015 20 0 DIADMN CCN(Cc1ccc(Br)cc1)Cc1ccc(F)cn1 ZINC001207042428 1049825545 /nfs/dbraw/zinc/82/55/45/1049825545.db2.gz CEFCNYXZSKTENQ-UHFFFAOYSA-N 0 1 323.209 4.005 20 0 DIADMN C[C@H](c1cccc(Br)c1)N(C)Cc1ccc(F)cn1 ZINC001207045372 1049825712 /nfs/dbraw/zinc/82/57/12/1049825712.db2.gz PGXSIFUKKLRASQ-LLVKDONJSA-N 0 1 323.209 4.176 20 0 DIADMN Cc1cnc(CN2CC[C@H](c3ccc(Cl)c(Cl)c3)C2)cn1 ZINC001207079776 1049831354 /nfs/dbraw/zinc/83/13/54/1049831354.db2.gz ZSXJOGGBKJFSCA-ZDUSSCGKSA-N 0 1 322.239 4.081 20 0 DIADMN Cc1cnc(CN2CCC[C@H]2c2ccc(C(F)(F)F)cc2)cn1 ZINC001207080475 1049832408 /nfs/dbraw/zinc/83/24/08/1049832408.db2.gz NQQJTUFGHBPTJF-INIZCTEOSA-N 0 1 321.346 4.141 20 0 DIADMN CN(CCc1cccs1)Cc1c(F)cccc1OC(F)F ZINC001207113058 1049839222 /nfs/dbraw/zinc/83/92/22/1049839222.db2.gz WURVLJXGLJAHNT-UHFFFAOYSA-N 0 1 315.360 4.163 20 0 DIADMN FC(F)c1cccc(CN2CCC[C@H](Oc3cccnc3)C2)c1 ZINC001207130844 1049840225 /nfs/dbraw/zinc/84/02/25/1049840225.db2.gz GVJAEYPPQSLNPE-KRWDZBQOSA-N 0 1 318.367 4.063 20 0 DIADMN CN(Cc1sc2ccccc2c1Cl)Cc1cc[nH]c(=O)c1 ZINC001207124198 1049840563 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CC[C@@H](c1ccccc1)[C@H]1CCCN1Cc1ncc(Cl)n1C ZINC000746856377 1050886433 /nfs/dbraw/zinc/88/64/33/1050886433.db2.gz QNRXYNIIKMQKSU-JKSUJKDBSA-N 0 1 317.864 4.232 20 0 DIADMN Cc1[nH]nc2cc(NC(=O)c3nc4ccc(C)cc4s3)ccc12 ZINC001147559904 1050890249 /nfs/dbraw/zinc/89/02/49/1050890249.db2.gz HHSRGMMMZAXTLC-UHFFFAOYSA-N 0 1 322.393 4.042 20 0 DIADMN CCCCCc1cc(C(=O)N2CCCC[C@@H]2[C@@H](C)CC)n[nH]1 ZINC001147538312 1050892744 /nfs/dbraw/zinc/89/27/44/1050892744.db2.gz MVSYQTLHKHKTDM-WMLDXEAASA-N 0 1 305.466 4.183 20 0 DIADMN Cc1noc(-c2ccccc2)c1NC(=O)c1nc(Cl)cs1 ZINC000790019928 1050906800 /nfs/dbraw/zinc/90/68/00/1050906800.db2.gz LBZFVVFOYKHWBB-UHFFFAOYSA-N 0 1 319.773 4.012 20 0 DIADMN CC(C)c1cc(Cl)ccc1NC(=O)CN1[C@H](C)CC[C@@H]1C ZINC001147975320 1050910164 /nfs/dbraw/zinc/91/01/64/1050910164.db2.gz WGXSXLOXSQRBIC-BETUJISGSA-N 0 1 308.853 4.275 20 0 DIADMN C/C(=C\C(=O)N[C@H](C)c1nc2ccc(Cl)cc2[nH]1)C(C)(C)C ZINC000742663006 1050912659 /nfs/dbraw/zinc/91/26/59/1050912659.db2.gz 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DIADMN COc1cccc(CN(C)Cc2cc3ccc(Cl)cc3[nH]2)c1 ZINC001232730502 1054106775 /nfs/dbraw/zinc/10/67/75/1054106775.db2.gz TVNJYXUOCDNUBV-UHFFFAOYSA-N 0 1 314.816 4.462 20 0 DIADMN C[C@@H]1CC/C(=C/C(=O)Nc2nc3cc(Cl)c(F)cc3[nH]2)C1 ZINC001437933340 1054115070 /nfs/dbraw/zinc/11/50/70/1054115070.db2.gz TXRRRNLNONOZJY-CPJBWDMUSA-N 0 1 307.756 4.040 20 0 DIADMN Cc1c(Cl)nccc1C[N@@H+](C)CCc1cccc(Cl)c1 ZINC001232754235 1054114989 /nfs/dbraw/zinc/11/49/89/1054114989.db2.gz XXKUCZQEXIBOTJ-UHFFFAOYSA-N 0 1 309.240 4.371 20 0 DIADMN Cc1c(C[N@H+]2CC[C@H](c3cccc(F)c3)C2)ccnc1Cl ZINC001232752710 1054115122 /nfs/dbraw/zinc/11/51/22/1054115122.db2.gz ACYOMDQXIKTVAF-HNNXBMFYSA-N 0 1 304.796 4.172 20 0 DIADMN Cc1c(CN2CC[C@H](c3cccc(F)c3)C2)ccnc1Cl ZINC001232752710 1054115131 /nfs/dbraw/zinc/11/51/31/1054115131.db2.gz ACYOMDQXIKTVAF-HNNXBMFYSA-N 0 1 304.796 4.172 20 0 DIADMN COc1ccccc1[C@@H]1CC[N@@H+](Cc2ccnc(Cl)c2C)C1 ZINC001232747734 1054115692 /nfs/dbraw/zinc/11/56/92/1054115692.db2.gz 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[O-]c1c(F)ccc(C[N@H+]2CC[C@H](c3cccc(Cl)c3)C2)c1F ZINC001232936358 1054150429 /nfs/dbraw/zinc/15/04/29/1054150429.db2.gz BFNHWJJPKVMMGU-LBPRGKRZSA-N 0 1 323.770 4.313 20 0 DIADMN O=C(Nc1cccc(OC2CCCC2)c1)c1c(O)cccc1F ZINC000622295496 1054156114 /nfs/dbraw/zinc/15/61/14/1054156114.db2.gz FYWFVWRAXWAPSO-UHFFFAOYSA-N 0 1 315.344 4.105 20 0 DIADMN CC(C)CCN(C(=O)c1cccc(C(F)(F)F)c1O)C1CC1 ZINC000622296915 1054156175 /nfs/dbraw/zinc/15/61/75/1054156175.db2.gz JFRPVQCDVWQLAR-UHFFFAOYSA-N 0 1 315.335 4.062 20 0 DIADMN FC(F)Oc1ccc(CN2CCC[C@H]2c2cccs2)cn1 ZINC001232954784 1054160324 /nfs/dbraw/zinc/16/03/24/1054160324.db2.gz PEPDUNQLYJSIQJ-LBPRGKRZSA-N 0 1 310.369 4.082 20 0 DIADMN CC(C)c1csc(NC(=O)[C@@H]2CCCCN2C2CCCC2)n1 ZINC000622324532 1054163457 /nfs/dbraw/zinc/16/34/57/1054163457.db2.gz URXTXLZYFKXPBX-HNNXBMFYSA-N 0 1 321.490 4.002 20 0 DIADMN [O-]c1cc(C[N@H+]2CCC[C@H]2Cc2ccc(F)cc2)cc(F)c1F ZINC001232975287 1054163733 /nfs/dbraw/zinc/16/37/33/1054163733.db2.gz YZHIPTAUZPTJTC-HNNXBMFYSA-N 0 1 321.342 4.017 20 0 DIADMN C[C@H](CNCc1csc(C(F)(F)F)n1)Cc1cccs1 ZINC001333684866 1054166653 /nfs/dbraw/zinc/16/66/53/1054166653.db2.gz NAOCZRMENRQCIA-VIFPVBQESA-N 0 1 320.405 4.192 20 0 DIADMN COc1cccc([C@@H]2CCCCN2Cc2cc(F)cnc2C)c1 ZINC001232990377 1054166670 /nfs/dbraw/zinc/16/66/70/1054166670.db2.gz WULJBAMFSOGRCO-IBGZPJMESA-N 0 1 314.404 4.265 20 0 DIADMN Cc1ncc(F)cc1CN1CC[C@H](Sc2ccc(F)cc2)C1 ZINC001232992425 1054169094 /nfs/dbraw/zinc/16/90/94/1054169094.db2.gz LSCQFMLDXAXSOA-KRWDZBQOSA-N 0 1 320.408 4.035 20 0 DIADMN FC(F)(F)Oc1ccc(CN2C3CCC2CC3)c(Cl)c1 ZINC001232992715 1054169307 /nfs/dbraw/zinc/16/93/07/1054169307.db2.gz BTUXIJWYIUCQKL-UHFFFAOYSA-N 0 1 305.727 4.365 20 0 DIADMN CCOC(=O)c1ccsc1CN1CCCC2(CCCC2)C1 ZINC001233020022 1054173081 /nfs/dbraw/zinc/17/30/81/1054173081.db2.gz YAPGPSYVSKVYAQ-UHFFFAOYSA-N 0 1 307.459 4.081 20 0 DIADMN CC(C)(C)C[C@@H]1CCCN1C(=O)c1cc(C2CCCCC2)[nH]n1 ZINC000622337084 1054178485 /nfs/dbraw/zinc/17/84/85/1054178485.db2.gz MFPBPSOTFLWPPR-HNNXBMFYSA-N 0 1 317.477 4.498 20 0 DIADMN COc1cccc(CCCN(C)Cc2ccsc2Cl)c1 ZINC001233058813 1054179721 /nfs/dbraw/zinc/17/97/21/1054179721.db2.gz UHGHHIWFWCBRHZ-UHFFFAOYSA-N 0 1 309.862 4.475 20 0 DIADMN CCC1(C)CCN(C(=O)c2cccc(C(F)(F)F)c2O)CC1 ZINC000622342735 1054180202 /nfs/dbraw/zinc/18/02/02/1054180202.db2.gz AUXBXOLSQBQVEI-UHFFFAOYSA-N 0 1 315.335 4.063 20 0 DIADMN CC(C)n1ncc2c1[C@@H](N[C@@H](C)c1cc(O)cc(F)c1)CCC2 ZINC001334387104 1054188524 /nfs/dbraw/zinc/18/85/24/1054188524.db2.gz OAGAVDZPHUPOHX-SJCJKPOMSA-N 0 1 317.408 4.037 20 0 DIADMN COc1cccc(CN2CCCCC2)c1NC(=O)OC(C)(C)C ZINC001233124197 1054188466 /nfs/dbraw/zinc/18/84/66/1054188466.db2.gz GQCMYEHVCHZPSX-UHFFFAOYSA-N 0 1 320.433 4.028 20 0 DIADMN Cc1cc(CN(C)Cc2ccccc2C(F)(F)F)cnc1C ZINC001233162184 1054192737 /nfs/dbraw/zinc/19/27/37/1054192737.db2.gz VXNUOKKHEUUDQV-UHFFFAOYSA-N 0 1 308.347 4.349 20 0 DIADMN CC(C)Oc1ncc(Cl)cc1CN1CCC2(CCCC2)C1 ZINC001233166673 1054193597 /nfs/dbraw/zinc/19/35/97/1054193597.db2.gz JXCVKQQVWORQIM-UHFFFAOYSA-N 0 1 308.853 4.288 20 0 DIADMN Cc1cc(CN(C)Cc2cccc(C(F)(F)F)c2)cnc1C ZINC001233162198 1054193848 /nfs/dbraw/zinc/19/38/48/1054193848.db2.gz WUOFAMJPKLEYLX-UHFFFAOYSA-N 0 1 308.347 4.349 20 0 DIADMN Cc1c([C@@H](C)N[C@@H](C)c2ccc(C(F)(F)F)s2)cnn1C ZINC001334812430 1054200222 /nfs/dbraw/zinc/20/02/22/1054200222.db2.gz FRHVMCPCBCEQHG-BDAKNGLRSA-N 0 1 317.380 4.221 20 0 DIADMN C[C@H]([NH2+]Cc1ccc(F)cc1)c1ccc(Br)cc1[O-] ZINC000184832238 1054201098 /nfs/dbraw/zinc/20/10/98/1054201098.db2.gz OUABPPHMQUHPBX-JTQLQIEISA-N 0 1 324.193 4.145 20 0 DIADMN CCc1ccc(-c2n[nH]c(SC[C@@H](C)C(F)(F)F)n2)cc1 ZINC001334868528 1054202857 /nfs/dbraw/zinc/20/28/57/1054202857.db2.gz RNHZDBRLKHLRFI-SECBINFHSA-N 0 1 315.364 4.325 20 0 DIADMN COc1cc(Br)cc(CN2CC[C@@H]3CCC[C@@H]3C2)c1 ZINC001233213436 1054203730 /nfs/dbraw/zinc/20/37/30/1054203730.db2.gz PKZSJZCMABUWLU-UONOGXRCSA-N 0 1 324.262 4.080 20 0 DIADMN O=C([O-])[C@@]1(c2ccccc2)CC[N@@H+](CCC2CCCCCC2)C1 ZINC000848711196 1054204168 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CCN(CC)[C@H](C(=O)NC[C@@H]1CCC[C@H](C)C1)c1ccccc1 ZINC001355771940 1054216830 /nfs/dbraw/zinc/21/68/30/1054216830.db2.gz SVRJBCDKWKMBLI-SCTDSRPQSA-N 0 1 316.489 4.012 20 0 DIADMN Cc1nnsc1CNCc1ccccc1-c1ccc(C)cc1C ZINC001335544030 1054218996 /nfs/dbraw/zinc/21/89/96/1054218996.db2.gz PGPYZUYJOCCQIV-UHFFFAOYSA-N 0 1 323.465 4.420 20 0 DIADMN C[C@@H]([NH2+]Cc1ccccc1F)c1ccc(Br)cc1[O-] ZINC000184855985 1054220112 /nfs/dbraw/zinc/22/01/12/1054220112.db2.gz LYORYBABONCBPD-SNVBAGLBSA-N 0 1 324.193 4.145 20 0 DIADMN [S-]c1ccc(C[N@H+]2CCC[C@@H](OCc3ccccc3)C2)cc1 ZINC001233262192 1054220593 /nfs/dbraw/zinc/22/05/93/1054220593.db2.gz VBADMRJRNRLHFH-GOSISDBHSA-N 0 1 313.466 4.157 20 0 DIADMN Cc1cccc([C@@H](O)CN[C@H](C)c2nc(C(C)(C)C)cs2)c1 ZINC001335778861 1054224890 /nfs/dbraw/zinc/22/48/90/1054224890.db2.gz ALEUOGVQJWVHDW-HIFRSBDPSA-N 0 1 318.486 4.133 20 0 DIADMN Cc1cccc([C@H](O)CN[C@@H](C)c2nc(C(C)(C)C)cs2)c1 ZINC001335778860 1054224965 /nfs/dbraw/zinc/22/49/65/1054224965.db2.gz 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1054261951 /nfs/dbraw/zinc/26/19/51/1054261951.db2.gz YJYSPXLJSPWCNG-TZMCWYRMSA-N 0 1 309.837 4.209 20 0 DIADMN COc1ccc(C[N@H+]2CCC[C@H]3CCCC[C@H]32)c(Cl)c1[O-] ZINC001233400792 1054261961 /nfs/dbraw/zinc/26/19/61/1054261961.db2.gz YJYSPXLJSPWCNG-TZMCWYRMSA-N 0 1 309.837 4.209 20 0 DIADMN Cc1cccc(C[NH2+][C@H](C)c2cc(Br)ccc2[O-])c1 ZINC000184917582 1054266485 /nfs/dbraw/zinc/26/64/85/1054266485.db2.gz PKAMIUQQYOHEHO-GFCCVEGCSA-N 0 1 320.230 4.314 20 0 DIADMN C[C@@H]1CCN(C(=O)c2ccc(O)c(Cl)c2)CC12CCCCC2 ZINC000622513966 1054268915 /nfs/dbraw/zinc/26/89/15/1054268915.db2.gz HKNRFAVQLOCCAC-CYBMUJFWSA-N 0 1 321.848 4.478 20 0 DIADMN CCN(Cc1ccn(C(=O)OC(C)(C)C)c1)Cc1ccccc1 ZINC001233429477 1054269139 /nfs/dbraw/zinc/26/91/39/1054269139.db2.gz BPSYIYPYHKXGEQ-UHFFFAOYSA-N 0 1 314.429 4.293 20 0 DIADMN Cc1cccc([C@H]2CCCN2Cc2c[nH]c(Br)c2)c1 ZINC001233434739 1054269590 /nfs/dbraw/zinc/26/95/90/1054269590.db2.gz ZYGSIHWPIDLFAZ-OAHLLOKOSA-N 0 1 319.246 4.423 20 0 DIADMN 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DIADMN CC[C@H](C)Oc1ccc(NC(=O)c2ccc3cncn3c2C)cc1 ZINC001337624188 1054276247 /nfs/dbraw/zinc/27/62/47/1054276247.db2.gz OIIBEJHFVPETHO-ZDUSSCGKSA-N 0 1 323.396 4.072 20 0 DIADMN C[C@@H]([NH2+]Cc1cccc(F)c1)c1ccc(Br)cc1[O-] ZINC000184941496 1054277598 /nfs/dbraw/zinc/27/75/98/1054277598.db2.gz FSJJKELGUFMNKQ-SNVBAGLBSA-N 0 1 324.193 4.145 20 0 DIADMN Cc1ncccc1CN(C)Cc1ccc2nc(Cl)ccc2c1 ZINC001233445599 1054278439 /nfs/dbraw/zinc/27/84/39/1054278439.db2.gz LZANTLXRUDHASU-UHFFFAOYSA-N 0 1 311.816 4.224 20 0 DIADMN CCN(Cc1cc(Br)c(C)nc1Cl)C(C)C ZINC001233464671 1054279037 /nfs/dbraw/zinc/27/90/37/1054279037.db2.gz ASMYTVQHCOWGCS-UHFFFAOYSA-N 0 1 305.647 4.036 20 0 DIADMN CCC1(CC)CCCN(C(=O)c2c(C)n[nH]c2C(C)C)CC1 ZINC000622549544 1054286153 /nfs/dbraw/zinc/28/61/53/1054286153.db2.gz DPTOARRFXAUQLV-UHFFFAOYSA-N 0 1 305.466 4.274 20 0 DIADMN CC(=O)c1cc(Cl)c2ccccc2c1O[C@@H]1CCCN(C)C1 ZINC001233540262 1054290911 /nfs/dbraw/zinc/29/09/11/1054290911.db2.gz RVHFJFLWWIVQQQ-CYBMUJFWSA-N 0 1 317.816 4.169 20 0 DIADMN Fc1cccc(-n2ccc(CN3CCC[C@@H]3c3ccccc3)n2)c1 ZINC000622585516 1054292245 /nfs/dbraw/zinc/29/22/45/1054292245.db2.gz JTFOWFMJZBKQRZ-HXUWFJFHSA-N 0 1 321.399 4.349 20 0 DIADMN CC(C)c1ccccc1CN1CCC(C(=O)C(F)(F)F)CC1 ZINC000848904602 1054292915 /nfs/dbraw/zinc/29/29/15/1054292915.db2.gz YCXQATXTIJQGGO-UHFFFAOYSA-N 0 1 313.363 4.153 20 0 DIADMN COc1ccsc1[C@@H](C)NCc1cc2cccc(OC)c2o1 ZINC001338186516 1054298304 /nfs/dbraw/zinc/29/83/04/1054298304.db2.gz PHYZFLRMEMNACG-LLVKDONJSA-N 0 1 317.410 4.362 20 0 DIADMN C[C@@H](Oc1n[nH]c(=O)cc1Cl)c1cc(Cl)ccc1Cl ZINC001233591627 1054303218 /nfs/dbraw/zinc/30/32/18/1054303218.db2.gz YMJIPPRVYQRTSE-ZCFIWIBFSA-N 0 1 319.575 4.282 20 0 DIADMN CCN(Cc1ccc(C)cc1)Cn1nc(C)nc1-c1ccccc1 ZINC001338377845 1054303457 /nfs/dbraw/zinc/30/34/57/1054303457.db2.gz KPFBRZCUZRIQGH-UHFFFAOYSA-N 0 1 320.440 4.042 20 0 DIADMN CN(C)c1cccc(Cl)c1CNCc1cccc2cc[nH]c21 ZINC001338740767 1054311231 /nfs/dbraw/zinc/31/12/31/1054311231.db2.gz WGEFKIYANXAQGJ-UHFFFAOYSA-N 0 1 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C[C@@H]1C[C@@H](C)CCN1Cc1csc(-c2ccc(O)cc2)n1 ZINC001237982180 1055572451 /nfs/dbraw/zinc/57/24/51/1055572451.db2.gz ZENODRHOMJTKFX-QWHCGFSZSA-N 0 1 302.443 4.136 20 0 DIADMN C[C@H]1CCN(Cc2csc(-c3ccc(O)cc3)n2)[C@@H](C)C1 ZINC001237982181 1055573311 /nfs/dbraw/zinc/57/33/11/1055573311.db2.gz ZENODRHOMJTKFX-STQMWFEESA-N 0 1 302.443 4.136 20 0 DIADMN CC[C@@H]1CCCCN1Cc1csc(-c2ccc(O)cc2)n1 ZINC001237980404 1055573352 /nfs/dbraw/zinc/57/33/52/1055573352.db2.gz DHYCGYKFXMZGTJ-OAHLLOKOSA-N 0 1 302.443 4.280 20 0 DIADMN C[C@@H]1CCCN(Cc2csc(-c3ccc(O)cc3)n2)[C@@H]1C ZINC001237978860 1055573422 /nfs/dbraw/zinc/57/34/22/1055573422.db2.gz CKHRUWMTXVBQRD-CHWSQXEVSA-N 0 1 302.443 4.136 20 0 DIADMN C[C@H]1c2ccccc2CC[N@H+]1Cc1cc(F)c([O-])c(Cl)c1 ZINC001237983721 1055574041 /nfs/dbraw/zinc/57/40/41/1055574041.db2.gz JXCHWBLQYAOKMH-NSHDSACASA-N 0 1 305.780 4.304 20 0 DIADMN C[C@H]1c2ccccc2CC[N@@H+]1Cc1cc(F)c([O-])c(Cl)c1 ZINC001237983721 1055574048 /nfs/dbraw/zinc/57/40/48/1055574048.db2.gz 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CC[C@@H](C)N(Cc1ccccc1)C(=O)c1cccc2[nH]c(C)nc21 ZINC000338536640 1055604495 /nfs/dbraw/zinc/60/44/95/1055604495.db2.gz OWKVSCVZDAWJDE-CQSZACIVSA-N 0 1 321.424 4.312 20 0 DIADMN Cc1ccc2nc(NC(=O)[C@H](C)CCCc3ccccc3)[nH]c2c1 ZINC001595498908 1055604736 /nfs/dbraw/zinc/60/47/36/1055604736.db2.gz UIXVRDDDURGRHJ-OAHLLOKOSA-N 0 1 321.424 4.469 20 0 DIADMN CCOC(=O)C1(C)CCN(Cc2cc(C)c(Cl)c(C)c2)CC1 ZINC001238095656 1055605045 /nfs/dbraw/zinc/60/50/45/1055605045.db2.gz KYOAJYJRAUFYKQ-UHFFFAOYSA-N 0 1 323.864 4.122 20 0 DIADMN Cc1nnc(C2CCN(Cc3cc(C)c(Cl)c(C)c3)CC2)o1 ZINC001238095046 1055605471 /nfs/dbraw/zinc/60/54/71/1055605471.db2.gz HRCQASFZBUFGSA-UHFFFAOYSA-N 0 1 319.836 4.028 20 0 DIADMN Cc1nc(C2CCN(Cc3cc(C)c(Cl)c(C)c3)CC2)no1 ZINC001238095850 1055605853 /nfs/dbraw/zinc/60/58/53/1055605853.db2.gz MLPHJNZLOADTSR-UHFFFAOYSA-N 0 1 319.836 4.028 20 0 DIADMN Cc1cc(C(=O)[O-])ccc1C[N@@H+](C)CCc1ccccc1Cl ZINC001238149931 1055611048 /nfs/dbraw/zinc/61/10/48/1055611048.db2.gz 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COc1cc2[nH]c(-c3ccc(SC)c(OC)c3)nc2cc1C ZINC001251814337 1061496819 /nfs/dbraw/zinc/49/68/19/1061496819.db2.gz FYWNMOHGTZBSSA-UHFFFAOYSA-N 0 1 314.410 4.277 20 0 DIADMN Cc1ncc(-c2nc3ccc(Cl)cc3[nH]2)c(C(F)(F)F)n1 ZINC001251815332 1061497007 /nfs/dbraw/zinc/49/70/07/1061497007.db2.gz JLIDOGGMCMBCPT-UHFFFAOYSA-N 0 1 312.682 4.001 20 0 DIADMN COc1cc2nc(-c3ccc(SC)c(OC)c3)[nH]c2cc1F ZINC001251814328 1061497190 /nfs/dbraw/zinc/49/71/90/1061497190.db2.gz FNIUFWWZNJSTJQ-UHFFFAOYSA-N 0 1 318.373 4.108 20 0 DIADMN CC[C@H](C)c1nn(C)cc1-c1nc2cc(Cl)c(OC)cc2[nH]1 ZINC001251816896 1061499289 /nfs/dbraw/zinc/49/92/89/1061499289.db2.gz LJOCWZUCHGZOBF-VIFPVBQESA-N 0 1 318.808 4.139 20 0 DIADMN CCCn1c2cc(F)ccc2nc1-c1nc2ccc(OC)cc2[nH]1 ZINC001251817166 1061499492 /nfs/dbraw/zinc/49/94/92/1061499492.db2.gz WQXRLBMBEHRALR-UHFFFAOYSA-N 0 1 324.359 4.137 20 0 DIADMN Cc1cccc2nc(-c3c[nH]c4nc(Cl)nc(Cl)c34)[nH]c21 ZINC001251822388 1061502893 /nfs/dbraw/zinc/50/28/93/1061502893.db2.gz JEUYBAMPIUGELO-UHFFFAOYSA-N 0 1 318.167 4.068 20 0 DIADMN O=C(Nc1ccc(F)c(Cl)c1)c1ccc(Cl)c(O)c1 ZINC001463601095 1061503021 /nfs/dbraw/zinc/50/30/21/1061503021.db2.gz RTXUTSLSVUQTAM-UHFFFAOYSA-N 0 1 300.116 4.090 20 0 DIADMN CCOc1ccc2nc(-c3cnc(C)cc3C(F)(F)F)[nH]c2c1 ZINC001251833398 1061504403 /nfs/dbraw/zinc/50/44/03/1061504403.db2.gz OCSYCRRXGSCZGV-UHFFFAOYSA-N 0 1 321.302 4.351 20 0 DIADMN COc1ccc(C)cc1CNCc1cccc(OC(C)(C)C)c1 ZINC001473963652 1061504487 /nfs/dbraw/zinc/50/44/87/1061504487.db2.gz KGEJNTCFRVZFJJ-UHFFFAOYSA-N 0 1 313.441 4.471 20 0 DIADMN Cc1cc(-c2nc3cc(C(F)(F)F)c(F)cc3[nH]2)ns1 ZINC001251838766 1061505353 /nfs/dbraw/zinc/50/53/53/1061505353.db2.gz BNDPKGFQCCQCPC-UHFFFAOYSA-N 0 1 301.268 4.153 20 0 DIADMN CC(C)=CCC[C@H](C)CC(=O)NC[C@H](c1cccs1)N(C)C ZINC001463646963 1061508151 /nfs/dbraw/zinc/50/81/51/1061508151.db2.gz PJYZSGINFAZNEY-JKSUJKDBSA-N 0 1 322.518 4.240 20 0 DIADMN Cc1cc(-c2nc3ccc(F)cc3[nH]2)c(O)cc1Br ZINC001251859629 1061512742 /nfs/dbraw/zinc/51/27/42/1061512742.db2.gz 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ZINC001464437373 1061594562 /nfs/dbraw/zinc/59/45/62/1061594562.db2.gz AUPOSXRGGWKGEU-UHFFFAOYSA-N 0 1 319.788 4.223 20 0 DIADMN CC[C@@H](C)Oc1ccc(NC(=O)c2ccc(Cl)cc2O)cc1 ZINC001464452415 1061596321 /nfs/dbraw/zinc/59/63/21/1061596321.db2.gz WSLSNOHAEYYTQY-LLVKDONJSA-N 0 1 319.788 4.475 20 0 DIADMN FC(F)(F)c1cnccc1NCCCc1ccc(Cl)cc1 ZINC001458147954 1061598196 /nfs/dbraw/zinc/59/81/96/1061598196.db2.gz PWBCIQHLWOCHQE-UHFFFAOYSA-N 0 1 314.738 4.220 20 0 DIADMN Fc1ccc(-c2nnc(-c3nc4ccc(Cl)cc4[nH]3)o2)cc1 ZINC001252170878 1061603242 /nfs/dbraw/zinc/60/32/42/1061603242.db2.gz SECBYWSMFPLFAQ-UHFFFAOYSA-N 0 1 314.707 4.072 20 0 DIADMN C[C@@H](Cc1ccco1)C(=O)Nc1ccc2nc(C3CCC3)[nH]c2c1 ZINC001464578366 1061607365 /nfs/dbraw/zinc/60/73/65/1061607365.db2.gz RTKZGWWIRZVRBE-LBPRGKRZSA-N 0 1 323.396 4.241 20 0 DIADMN CCN(c1ccc(NCc2cccc3c[nH]nc32)cc1)C(C)C ZINC001474063180 1061611252 /nfs/dbraw/zinc/61/12/52/1061611252.db2.gz WTOBQAJDPGDTNV-UHFFFAOYSA-N 0 1 308.429 4.410 20 0 DIADMN CC(C)(C)c1ccc(CNc2cnccc2-n2cccn2)s1 ZINC001474085859 1061632712 /nfs/dbraw/zinc/63/27/12/1061632712.db2.gz GNMYEGWWJSWYLC-UHFFFAOYSA-N 0 1 312.442 4.238 20 0 DIADMN CCOc1cc(CNC/C=C\c2ccccc2)c(F)cc1OC ZINC001474088719 1061634936 /nfs/dbraw/zinc/63/49/36/1061634936.db2.gz PLSKLNYMKGRIDV-YFHOEESVSA-N 0 1 315.388 4.036 20 0 DIADMN CC(C)[C@@H](O)C(C)(C)CNCc1c(Cl)cccc1Cl ZINC001474100679 1061648815 /nfs/dbraw/zinc/64/88/15/1061648815.db2.gz SQCSVDDRZPHLEV-CQSZACIVSA-N 0 1 304.261 4.126 20 0 DIADMN CN1CCN(c2ccccc2NC[C@H]2CCCC(C)(C)C2)CC1 ZINC001474099381 1061645908 /nfs/dbraw/zinc/64/59/08/1061645908.db2.gz BWXGFGRZWSCPHB-KRWDZBQOSA-N 0 1 315.505 4.067 20 0 DIADMN CCOc1cccc(F)c1CNC[C@H]1CCC2(CCCCC2)O1 ZINC001474113259 1061661339 /nfs/dbraw/zinc/66/13/39/1061661339.db2.gz MRVJKWZGFDKKDV-OAHLLOKOSA-N 0 1 321.436 4.196 20 0 DIADMN COc1c2ccccc2oc1CNCc1ccc2cc[nH]c2c1 ZINC001474117126 1061666151 /nfs/dbraw/zinc/66/61/51/1061666151.db2.gz PUHFSSQOVBUYGJ-UHFFFAOYSA-N 0 1 306.365 4.213 20 0 DIADMN 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CCOc1ccc(CN(C)Cc2cc(F)c(F)c(F)c2)c(C)c1 ZINC001474392979 1062047135 /nfs/dbraw/zinc/04/71/35/1062047135.db2.gz FMLIWOWDPWGHLN-UHFFFAOYSA-N 0 1 323.358 4.443 20 0 DIADMN C[C@H]1CN(CCCCc2ccc(Cl)c(Cl)c2)CCO1 ZINC001474399171 1062053839 /nfs/dbraw/zinc/05/38/39/1062053839.db2.gz MDCFFXJFZCUPCA-LBPRGKRZSA-N 0 1 302.245 4.037 20 0 DIADMN CN(CCc1ccc(Cl)cc1)Cc1ccnn1CC1CCC1 ZINC001474395899 1062049544 /nfs/dbraw/zinc/04/95/44/1062049544.db2.gz DSUNYSHJFOFVTP-UHFFFAOYSA-N 0 1 317.864 4.011 20 0 DIADMN CCOc1cccc(CN2CCN(c3cc(C)ccc3C)CC2)c1 ZINC001474402616 1062059479 /nfs/dbraw/zinc/05/94/79/1062059479.db2.gz YIVPEPDHBKUXOG-UHFFFAOYSA-N 0 1 324.468 4.024 20 0 DIADMN Cc1ccc2cc(-c3nnc(Cc4ccc(Cl)cc4)o3)[nH]c2n1 ZINC001254244115 1062062935 /nfs/dbraw/zinc/06/29/35/1062062935.db2.gz FGDDPJHXCDHQGD-UHFFFAOYSA-N 0 1 324.771 4.166 20 0 DIADMN CN(Cc1ccc(Cl)s1)Cc1ccc2c(c1)CCCO2 ZINC001474404462 1062063842 /nfs/dbraw/zinc/06/38/42/1062063842.db2.gz CVEPTKPHVPOUBM-UHFFFAOYSA-N 0 1 307.846 4.359 20 0 DIADMN Cc1nn(-c2cccc(C)c2)cc1CN(C)Cc1ccccc1C ZINC001474409432 1062074390 /nfs/dbraw/zinc/07/43/90/1062074390.db2.gz BINWDDUTWXLFLR-UHFFFAOYSA-N 0 1 319.452 4.430 20 0 DIADMN Cc1ccccc1CN(C)Cc1cc(Cl)cc2c1OCC2 ZINC001474409442 1062074454 /nfs/dbraw/zinc/07/44/54/1062074454.db2.gz BXIZZYNAUIYUBR-UHFFFAOYSA-N 0 1 301.817 4.215 20 0 DIADMN C[C@@H](c1ccc(F)c(F)c1)N(C)Cc1cccn1C(F)F ZINC001474412607 1062077560 /nfs/dbraw/zinc/07/75/60/1062077560.db2.gz ZESSBFJMJCYNAN-JTQLQIEISA-N 0 1 300.299 4.354 20 0 DIADMN CCN(Cc1ccc(OC)cc1)Cc1ccc(C)c(Cl)n1 ZINC001459311993 1062081177 /nfs/dbraw/zinc/08/11/77/1062081177.db2.gz JIELQMZAYKXZMO-UHFFFAOYSA-N 0 1 304.821 4.074 20 0 DIADMN CCc1cccnc1[C@H](C)NCc1cc2cccc(OC)c2o1 ZINC001254374973 1062088001 /nfs/dbraw/zinc/08/80/01/1062088001.db2.gz ONSIERAAXILYII-ZDUSSCGKSA-N 0 1 310.397 4.250 20 0 DIADMN CCC1CCC([N@@H+](Cc2cnnn2-c2ccccc2)C2CC2)CC1 ZINC001459330010 1062093505 /nfs/dbraw/zinc/09/35/05/1062093505.db2.gz FBSFBHBXELNSIJ-UHFFFAOYSA-N 0 1 324.472 4.201 20 0 DIADMN Cc1nc2cc(-c3nnc(Cc4cccc(Cl)c4)o3)ccc2[nH]1 ZINC001254419563 1062095835 /nfs/dbraw/zinc/09/58/35/1062095835.db2.gz JUBRVDYTSRPKIQ-UHFFFAOYSA-N 0 1 324.771 4.166 20 0 DIADMN Cc1oc2ccc(NC(=O)c3cc(C)cc4cn[nH]c43)cc2c1C ZINC001467273410 1062099523 /nfs/dbraw/zinc/09/95/23/1062099523.db2.gz SCIRADLMQRGVHL-UHFFFAOYSA-N 0 1 319.364 4.487 20 0 DIADMN Cc1ccc(NC(=O)CN2CCC[C@@H]2C2CCCC2)c(Cl)c1 ZINC001459349981 1062105210 /nfs/dbraw/zinc/10/52/10/1062105210.db2.gz WHVSLPDOEGCYBA-QGZVFWFLSA-N 0 1 320.864 4.242 20 0 DIADMN CC(C)[C@H]1CCC[C@H](NC(=O)c2cc(F)cc3nc[nH]c32)CC1 ZINC001467305319 1062105468 /nfs/dbraw/zinc/10/54/68/1062105468.db2.gz JYQSHZMRZVSNKX-JSGCOSHPSA-N 0 1 317.408 4.037 20 0 DIADMN C[C@@H]1CN(CCCc2cccc(F)c2)C[C@@H](c2ccccc2)O1 ZINC001459352970 1062108133 /nfs/dbraw/zinc/10/81/33/1062108133.db2.gz SXOKHLBKQIMYKJ-UZLBHIALSA-N 0 1 313.416 4.220 20 0 DIADMN CCCN(CCOCc1ccccc1)Cc1ccc(F)cc1F ZINC001459372452 1062117658 /nfs/dbraw/zinc/11/76/58/1062117658.db2.gz CSDAYZSCIHCPPM-UHFFFAOYSA-N 0 1 319.395 4.394 20 0 DIADMN C[C@@H]1CCCN(Cc2cc(Br)ccc2F)CC1 ZINC001459383850 1062121229 /nfs/dbraw/zinc/12/12/29/1062121229.db2.gz FVCPMJHFGNIOHU-LLVKDONJSA-N 0 1 300.215 4.210 20 0 DIADMN C[C@@H]1Cc2cc(CN(C)Cc3ccc(F)c(Cl)c3)ccc2O1 ZINC001474441887 1062121800 /nfs/dbraw/zinc/12/18/00/1062121800.db2.gz FJVDPRVUCMSAEM-GFCCVEGCSA-N 0 1 319.807 4.435 20 0 DIADMN CCC1(C)CCN([C@H](C)C(=O)Nc2cccc(Cl)c2)CC1 ZINC001459388309 1062125470 /nfs/dbraw/zinc/12/54/70/1062125470.db2.gz BAHUUXWPFIASEF-CYBMUJFWSA-N 0 1 308.853 4.179 20 0 DIADMN Oc1cc(Cl)ccc1-c1nnc(Cc2cccc(Cl)c2)o1 ZINC001254477979 1062125475 /nfs/dbraw/zinc/12/54/75/1062125475.db2.gz LTYQLHFMJXZYEK-UHFFFAOYSA-N 0 1 321.163 4.340 20 0 DIADMN C[C@H](NC1CC2(C1)CCCC2)c1nc(-c2cccc(F)c2)no1 ZINC001474461057 1062141190 /nfs/dbraw/zinc/14/11/90/1062141190.db2.gz LEHNHEQYKSWRHQ-LBPRGKRZSA-N 0 1 315.392 4.249 20 0 DIADMN CCC[C@H](CCc1ccccc1)N1CCOC[C@@H]1c1cccnc1 ZINC001254498856 1062142795 /nfs/dbraw/zinc/14/27/95/1062142795.db2.gz SBOWCWFPWKUJIO-NHCUHLMSSA-N 0 1 324.468 4.256 20 0 DIADMN Clc1ccc(CN2CCC[C@@H]2C2CC2)c(Br)c1 ZINC001459437622 1062144649 /nfs/dbraw/zinc/14/46/49/1062144649.db2.gz HVNIGTFLZFMPBX-CQSZACIVSA-N 0 1 314.654 4.477 20 0 DIADMN Cc1ccccc1[C@@]1(F)CCN(Cc2cccc3c2OCC3)C1 ZINC001474473445 1062152046 /nfs/dbraw/zinc/15/20/46/1062152046.db2.gz RAISAZBFNSBXTP-HXUWFJFHSA-N 0 1 311.400 4.001 20 0 DIADMN CSC(C)(C)CCNc1ccc(CN(C)C)c(Cl)c1 ZINC001474486125 1062164102 /nfs/dbraw/zinc/16/41/02/1062164102.db2.gz CVQNVECMJNEVAA-UHFFFAOYSA-N 0 1 300.899 4.345 20 0 DIADMN Cc1cc(CN2CCCC[C@H]2C(C)C)cnc1Br ZINC001459485819 1062165960 /nfs/dbraw/zinc/16/59/60/1062165960.db2.gz GXHCNFHDUSNGGY-AWEZNQCLSA-N 0 1 311.267 4.163 20 0 DIADMN CCCCCC[N@@H+](C)CC(=O)NCC[C@@H]1C[C@H](C)CC(C)(C)C1 ZINC001467635901 1062167339 /nfs/dbraw/zinc/16/73/39/1062167339.db2.gz JDPHJAABKRWMQK-ZWKOTPCHSA-N 0 1 324.553 4.467 20 0 DIADMN CC(C)[C@H]1CN(Cc2ccnn2-c2ccncc2)c2ccccc21 ZINC001474488817 1062167573 /nfs/dbraw/zinc/16/75/73/1062167573.db2.gz PIFAQCYUGCVDRB-LJQANCHMSA-N 0 1 318.424 4.027 20 0 DIADMN CC[C@@H]1CCCN1Cc1cc(Br)ccc1Cl ZINC001459495033 1062169127 /nfs/dbraw/zinc/16/91/27/1062169127.db2.gz XXLXZSDHVKPOJG-GFCCVEGCSA-N 0 1 302.643 4.477 20 0 DIADMN Cc1ccc(CCNCc2c(F)cc(F)c(F)c2F)cc1C ZINC001474491377 1062170347 /nfs/dbraw/zinc/17/03/47/1062170347.db2.gz QGRQMRQIWCLXKH-UHFFFAOYSA-N 0 1 311.322 4.192 20 0 DIADMN Oc1c2ccoc2ccc1-c1nnc([C@@H]2C[C@@H]2c2ccccc2)o1 ZINC001254545328 1062170406 /nfs/dbraw/zinc/17/04/06/1062170406.db2.gz WHEMZUFSMLPDLN-HUUCEWRRSA-N 0 1 318.332 4.460 20 0 DIADMN C[C@H](c1nccc2ccccc21)N1CCOC2(CCCCC2)C1 ZINC001474494212 1062172215 /nfs/dbraw/zinc/17/22/15/1062172215.db2.gz OHTLWICLZXKFEF-MRXNPFEDSA-N 0 1 310.441 4.331 20 0 DIADMN CCCCCC[C@H](O)C[N@H+]1CCSC[C@H]1c1ccccc1 ZINC001459508457 1062173154 /nfs/dbraw/zinc/17/31/54/1062173154.db2.gz HHRJVQZCIQRIHI-ROUUACIJSA-N 0 1 307.503 4.108 20 0 DIADMN C[C@@H](c1nccc2ccccc21)N1CCOC2(CCCCC2)C1 ZINC001474494211 1062174087 /nfs/dbraw/zinc/17/40/87/1062174087.db2.gz OHTLWICLZXKFEF-INIZCTEOSA-N 0 1 310.441 4.331 20 0 DIADMN C[C@@H](N[C@@H](C)c1nc(C(C)(C)C)no1)[C@H]1CC2CCC1CC2 ZINC001474496669 1062177222 /nfs/dbraw/zinc/17/72/22/1062177222.db2.gz KJTJYIKHMFXFIB-MMFDQKDXSA-N 0 1 305.466 4.233 20 0 DIADMN Cc1cc(-c2noc([C@H](C)N[C@H]3C[C@@H]4CCC[C@@H]43)n2)ccc1F ZINC001474498185 1062179646 /nfs/dbraw/zinc/17/96/46/1062179646.db2.gz UKJCOHMNWOCJBD-DUPGQFARSA-N 0 1 315.392 4.023 20 0 DIADMN Cc1nsc(C)c1CN1CCC(c2ccccc2F)CC1 ZINC001459522624 1062181555 /nfs/dbraw/zinc/18/15/55/1062181555.db2.gz LDCDHCZWYGNOLK-UHFFFAOYSA-N 0 1 304.434 4.279 20 0 DIADMN COC(=O)c1ccc(CN2C[C@@H](C)CC[C@H]2c2ccccc2)o1 ZINC001474515380 1062198709 /nfs/dbraw/zinc/19/87/09/1062198709.db2.gz DSRBZPZBZYDEOZ-YOEHRIQHSA-N 0 1 313.397 4.039 20 0 DIADMN CCN(C)[C@@H](C(=O)N[C@@H](C)CC1CCCCC1)c1ccccc1 ZINC001467746736 1062199835 /nfs/dbraw/zinc/19/98/35/1062199835.db2.gz GCDUEUFLDKTPKN-QFBILLFUSA-N 0 1 316.489 4.155 20 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0 1 310.441 4.126 20 0 DIADMN CC(C)CSCCCN1C[C@H](C)OC[C@H]1c1ccccc1 ZINC001459575115 1062221905 /nfs/dbraw/zinc/22/19/05/1062221905.db2.gz KJKCHLJTBFKQMY-WMZOPIPTSA-N 0 1 307.503 4.228 20 0 DIADMN CCOc1cccc(Cl)c1CN(C)[C@H]1CC[C@@H](SC)C1 ZINC001459583992 1062224510 /nfs/dbraw/zinc/22/45/10/1062224510.db2.gz DWHXDKBSOXKVPE-QWHCGFSZSA-N 0 1 313.894 4.455 20 0 DIADMN Cc1ccccc1[C@@H]1C[C@H]1C(=O)Nc1cc(Cl)c(O)cc1F ZINC001467869287 1062226102 /nfs/dbraw/zinc/22/61/02/1062226102.db2.gz OLNFYXZYSRLBFK-NWDGAFQWSA-N 0 1 319.763 4.235 20 0 DIADMN C[C@@H]1CN(CC2CCC(F)(F)CC2)[C@H](c2ccccc2)CO1 ZINC001459587670 1062228013 /nfs/dbraw/zinc/22/80/13/1062228013.db2.gz YSINPXCZXRTMNI-PBHICJAKSA-N 0 1 309.400 4.274 20 0 DIADMN Oc1cc(-c2nnc([C@H]3C[C@@H]3c3ccccc3)o2)ccc1Cl ZINC001254681490 1062228698 /nfs/dbraw/zinc/22/86/98/1062228698.db2.gz HAQZSIPBYIBEAA-OLZOCXBDSA-N 0 1 312.756 4.367 20 0 DIADMN Cc1ccccc1[C@@H](C)N(CC(C)C)C(=O)[C@@H]1CCCCN1C ZINC001467956587 1062235079 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DIADMN CC[C@H]1CN(Cc2ccc(CC(F)(F)F)cc2)C[C@H](CC)O1 ZINC001474588906 1062299577 /nfs/dbraw/zinc/29/95/77/1062299577.db2.gz NRIUSIGDYFHCGL-HOTGVXAUSA-N 0 1 315.379 4.181 20 0 DIADMN CCOc1cc(F)cc(CN2CCC[C@@H](CC(F)(F)F)C2)c1 ZINC001474588597 1062302713 /nfs/dbraw/zinc/30/27/13/1062302713.db2.gz LDYQUGYHQIJRLR-LBPRGKRZSA-N 0 1 319.342 4.389 20 0 DIADMN CCO[C@@H]1C[C@H](N[C@@H]2C[C@@]2(F)c2ccccc2)C12CCCCC2 ZINC001474591422 1062304914 /nfs/dbraw/zinc/30/49/14/1062304914.db2.gz JFZUULHYZMOVEP-JRBPQWBISA-N 0 1 317.448 4.341 20 0 DIADMN C[C@]1(F)CCCN(C(=O)c2cc(Cl)c3ccccc3c2O)C1 ZINC001468350761 1062307055 /nfs/dbraw/zinc/30/70/55/1062307055.db2.gz DBHHRSVNAVNLNM-KRWDZBQOSA-N 0 1 321.779 4.163 20 0 DIADMN CC1(C)CCC[C@@H]1[C@H]1CCN(Cc2c(F)ccc(O)c2F)C1 ZINC001474593925 1062308934 /nfs/dbraw/zinc/30/89/34/1062308934.db2.gz BPIVHTITDJOECB-GXTWGEPZSA-N 0 1 309.400 4.319 20 0 DIADMN CN(CC(=O)Nc1cc(F)cc(F)c1)CC1CCC(C)(C)CC1 ZINC001459701109 1062316021 /nfs/dbraw/zinc/31/60/21/1062316021.db2.gz OLNKMFJJBFTBHC-UHFFFAOYSA-N 0 1 324.415 4.052 20 0 DIADMN CCC(=O)c1ccc(O)c(NC(=O)C2CCCCCCC2)c1 ZINC001468409826 1062316522 /nfs/dbraw/zinc/31/65/22/1062316522.db2.gz PBQAYLBMQZGVOT-UHFFFAOYSA-N 0 1 303.402 4.284 20 0 DIADMN C[C@@H]1CN(Cc2ncccc2F)CCc2ccc(Cl)cc21 ZINC001474611958 1062323989 /nfs/dbraw/zinc/32/39/89/1062323989.db2.gz XDZQQLZCWCXZAB-GFCCVEGCSA-N 0 1 304.796 4.036 20 0 DIADMN Cc1coc(C[N@H+]2C[C@H](C)N(Cc3ccccc3)[C@H](C)[C@H]2C)c1 ZINC001474610255 1062327150 /nfs/dbraw/zinc/32/71/50/1062327150.db2.gz VKVFFWPGSQUKTF-RCCFBDPRSA-N 0 1 312.457 4.071 20 0 DIADMN CCC[C@@H]1CCCN(Cc2cnc(Br)c(C)c2)C1 ZINC001459739080 1062350717 /nfs/dbraw/zinc/35/07/17/1062350717.db2.gz ZKOHBRPPIQPOOQ-CYBMUJFWSA-N 0 1 311.267 4.165 20 0 DIADMN C[C@H](c1cccc(O)c1)N(C)Cc1cnc(-c2ccccc2)o1 ZINC001459721128 1062331721 /nfs/dbraw/zinc/33/17/21/1062331721.db2.gz PEZKYCWZQGNXCT-CQSZACIVSA-N 0 1 308.381 4.240 20 0 DIADMN COc1cc(CN(C)C(C)(C)c2ccccc2)c(Cl)cc1O ZINC001474615504 1062336376 /nfs/dbraw/zinc/33/63/76/1062336376.db2.gz AMLBLEBQXXESCR-UHFFFAOYSA-N 0 1 319.832 4.421 20 0 DIADMN Cn1c2cc(Cl)ccc2nc1CN1CCC(C2CCC2)CC1 ZINC001474619003 1062339801 /nfs/dbraw/zinc/33/98/01/1062339801.db2.gz KLBVPRNKDZAYTK-UHFFFAOYSA-N 0 1 317.864 4.239 20 0 DIADMN CC[C@@H]1CCCC[C@H]1CNC(=O)[C@H](c1ccccc1)N(C)CC ZINC001468510039 1062340038 /nfs/dbraw/zinc/34/00/38/1062340038.db2.gz REQRPMHIDKOILD-NEWSRXKRSA-N 0 1 316.489 4.012 20 0 DIADMN C[C@]1(c2ccccc2)CN(CCCc2cccc(F)c2)CCO1 ZINC001459753276 1062365945 /nfs/dbraw/zinc/36/59/45/1062365945.db2.gz BJFAUVZPHSKEGC-HXUWFJFHSA-N 0 1 313.416 4.006 20 0 DIADMN Fc1ccccc1CN(CCOCc1ccccc1)C1CCC1 ZINC001459762768 1062369070 /nfs/dbraw/zinc/36/90/70/1062369070.db2.gz LNXJLKXFCMJYHX-UHFFFAOYSA-N 0 1 313.416 4.397 20 0 DIADMN C(CC1CCCCC1)[C@@H]1CCCN1Cc1noc2c1COCC2 ZINC001459767134 1062373743 /nfs/dbraw/zinc/37/37/43/1062373743.db2.gz BQOHORIILZMBLV-INIZCTEOSA-N 0 1 318.461 4.072 20 0 DIADMN Clc1cccc(-c2nc(CN[C@@H]3CCSC3)cs2)c1 ZINC001255278156 1062374529 /nfs/dbraw/zinc/37/45/29/1062374529.db2.gz BJMVCKMKYCSRKL-GFCCVEGCSA-N 0 1 310.875 4.059 20 0 DIADMN CCCCOC(=O)[C@@H](C)N1CCC[C@@H]1CCCc1ccccc1 ZINC001459768835 1062378247 /nfs/dbraw/zinc/37/82/47/1062378247.db2.gz PFUWGGCUDQVCLK-MJGOQNOKSA-N 0 1 317.473 4.206 20 0 DIADMN CCCCOC(=O)[C@@H](C)N1CCC[C@H]1CCCc1ccccc1 ZINC001459768833 1062379547 /nfs/dbraw/zinc/37/95/47/1062379547.db2.gz PFUWGGCUDQVCLK-IEBWSBKVSA-N 0 1 317.473 4.206 20 0 DIADMN Cc1cc(Cl)ccc1-c1nnc(CN(C)C2CCCC2)o1 ZINC001255298886 1062380471 /nfs/dbraw/zinc/38/04/71/1062380471.db2.gz GYBQFMYVTNADFU-UHFFFAOYSA-N 0 1 305.809 4.073 20 0 DIADMN C/C=C\C[C@H]1CCCN(Cc2cc(OCC)c(OC)cc2F)C1 ZINC001474652229 1062382329 /nfs/dbraw/zinc/38/23/29/1062382329.db2.gz DKGJXSDEDPHFID-VOKGJARPSA-N 0 1 321.436 4.411 20 0 DIADMN C(=C\[C@H]1CCCCCN1Cc1cc2n(n1)CCC2)\c1ccccc1 ZINC001459770303 1062385018 /nfs/dbraw/zinc/38/50/18/1062385018.db2.gz ITDXEPUVCLYYCF-GHYICZDASA-N 0 1 321.468 4.287 20 0 DIADMN Cc1ccc(C)c(NC(=O)CN2CCC[C@H](CC(C)C)C2)c1 ZINC001459772092 1062385458 /nfs/dbraw/zinc/38/54/58/1062385458.db2.gz NKQVMKFKBDHYQA-QGZVFWFLSA-N 0 1 302.462 4.000 20 0 DIADMN CCn1nc(C)c(CN(C)Cc2ccc(C)c(Cl)c2)c1C ZINC001474656177 1062387479 /nfs/dbraw/zinc/38/74/79/1062387479.db2.gz DETPHDRKLPFFEA-UHFFFAOYSA-N 0 1 305.853 4.114 20 0 DIADMN CN(CCC(=O)OC(C)(C)C)Cc1c(Cl)oc2ccccc21 ZINC001459777859 1062393491 /nfs/dbraw/zinc/39/34/91/1062393491.db2.gz WZHCRQUKUKAOCM-UHFFFAOYSA-N 0 1 323.820 4.250 20 0 DIADMN C[C@@H](CSc1ccccc1)C(=O)Nc1ccc(F)c(F)c1O ZINC001468787989 1062399489 /nfs/dbraw/zinc/39/94/89/1062399489.db2.gz BJAPAAZLGZGGKV-JTQLQIEISA-N 0 1 323.364 4.037 20 0 DIADMN CC[C@@H]1CCC[C@@H](CN2CCO[C@@H](c3ccc(OC)cc3)C2)C1 ZINC001474669573 1062399554 /nfs/dbraw/zinc/39/95/54/1062399554.db2.gz ISRAQILSKPNNPY-MBOZVWFJSA-N 0 1 317.473 4.285 20 0 DIADMN Cc1ccc(C(=O)Nc2ccc(F)c(F)c2O)c(Cl)c1C ZINC001468790883 1062401425 /nfs/dbraw/zinc/40/14/25/1062401425.db2.gz ZYSKYIAVBIACAX-UHFFFAOYSA-N 0 1 311.715 4.193 20 0 DIADMN CC[C@@H](NCC(=O)Nc1ccccc1Cl)c1ccc(F)cc1 ZINC001459796700 1062408603 /nfs/dbraw/zinc/40/86/03/1062408603.db2.gz FHALHAIFUNIGAR-OAHLLOKOSA-N 0 1 320.795 4.159 20 0 DIADMN Cc1nn(C(C)(C)C)c(C)c1CN(C)Cc1ccc2cc[nH]c2c1 ZINC001474679371 1062409977 /nfs/dbraw/zinc/40/99/77/1062409977.db2.gz GREVXWMBVXONPN-UHFFFAOYSA-N 0 1 324.472 4.368 20 0 DIADMN Brc1ccc(CN2CCC[C@@H](C3CCC3)CC2)cn1 ZINC001474680516 1062410031 /nfs/dbraw/zinc/41/00/31/1062410031.db2.gz RNGIWGIMWPDSGX-OAHLLOKOSA-N 0 1 323.278 4.246 20 0 DIADMN CN(Cc1ccn(-c2ccc(Cl)cc2)n1)C[C@@H]1CC=CCC1 ZINC001459803802 1062410289 /nfs/dbraw/zinc/41/02/89/1062410289.db2.gz BMGFSVPCGYAGKM-OAHLLOKOSA-N 0 1 315.848 4.314 20 0 DIADMN CCSc1ccccc1CN(CCO)Cc1ccc(C)cc1 ZINC001459804571 1062413397 /nfs/dbraw/zinc/41/33/97/1062413397.db2.gz CRZWGWKHJXJDJJ-UHFFFAOYSA-N 0 1 315.482 4.102 20 0 DIADMN CC[C@@H](CO)N(Cc1ccccc1)Cc1cc(Cl)ccc1F ZINC001459810910 1062415341 /nfs/dbraw/zinc/41/53/41/1062415341.db2.gz AEPMFTUMLYIWRN-KRWDZBQOSA-N 0 1 321.823 4.252 20 0 DIADMN Cc1cnc(CN[C@@H](C)c2ccc(SC(C)C)cc2)cn1 ZINC001459828332 1062430295 /nfs/dbraw/zinc/43/02/95/1062430295.db2.gz SLAQFCIGVZXBNG-AWEZNQCLSA-N 0 1 301.459 4.136 20 0 DIADMN C[C@H](N[C@H](c1ccc(F)cc1F)C1CC1)c1ccc(F)nc1 ZINC001459838568 1062438293 /nfs/dbraw/zinc/43/82/93/1062438293.db2.gz RDXDAUYHUFYBPX-BTDLBPIBSA-N 0 1 306.331 4.301 20 0 DIADMN Cc1cnc(CN[C@H](c2cccc(Cl)c2)C2CCCC2)cn1 ZINC001459841691 1062441349 /nfs/dbraw/zinc/44/13/49/1062441349.db2.gz QVHKHDCPZFRPKI-SFHVURJKSA-N 0 1 315.848 4.460 20 0 DIADMN Cc1cc(CN2C[C@@H]3C[C@H]2CN3c2ccccc2)ccc1Cl ZINC001474715530 1062443326 /nfs/dbraw/zinc/44/33/26/1062443326.db2.gz JSKXHKQGECEXDA-ROUUACIJSA-N 0 1 312.844 4.112 20 0 DIADMN COc1nscc1CN(C)C[C@@H](C)c1cccc(Cl)c1 ZINC001474722484 1062447539 /nfs/dbraw/zinc/44/75/39/1062447539.db2.gz JHMJMXGOHXSOOI-LLVKDONJSA-N 0 1 310.850 4.041 20 0 DIADMN Fc1cc(CN2CCC(F)(C3CC3)CC2)ccc1OC(F)F ZINC001474734471 1062455845 /nfs/dbraw/zinc/45/58/45/1062455845.db2.gz XKZSAWWNVXKQFF-UHFFFAOYSA-N 0 1 317.326 4.141 20 0 DIADMN CN(C)c1ccccc1CN[C@@H](c1ccc(F)cc1F)C1CC1 ZINC001459864929 1062457957 /nfs/dbraw/zinc/45/79/57/1062457957.db2.gz KQBUYVCWBNHDFV-LJQANCHMSA-N 0 1 316.395 4.272 20 0 DIADMN CSc1cc(NC(=O)c2cn[nH]c2C(C)(C)C)ccc1Cl ZINC001469020889 1062463140 /nfs/dbraw/zinc/46/31/40/1062463140.db2.gz IKQHIGSEGDJFES-UHFFFAOYSA-N 0 1 323.849 4.335 20 0 DIADMN CCC[C@H](NCc1cnc(C)cn1)c1cccc(C(F)(F)F)c1 ZINC001459876586 1062465459 /nfs/dbraw/zinc/46/54/59/1062465459.db2.gz ISDLTFMVBSTODJ-INIZCTEOSA-N 0 1 323.362 4.435 20 0 DIADMN Fc1ccc2c(c1)CN(C1CCC(C(F)(F)F)CC1)CC2 ZINC001255520526 1062472625 /nfs/dbraw/zinc/47/26/25/1062472625.db2.gz HDCSYWOGIOVBIX-UHFFFAOYSA-N 0 1 301.327 4.305 20 0 DIADMN C[C@@H](NC[C@H]1CCC2(CCC2)CO1)c1nc(C(C)(C)C)cs1 ZINC001459905973 1062488781 /nfs/dbraw/zinc/48/87/81/1062488781.db2.gz SNEFZQKMBRKMIM-ZIAGYGMSSA-N 0 1 322.518 4.441 20 0 DIADMN CCCN(CCc1cccs1)[C@@H](CC)C(=O)OC(C)(C)C ZINC001459910697 1062492111 /nfs/dbraw/zinc/49/21/11/1062492111.db2.gz XMDUQFDSWCGSTH-HNNXBMFYSA-N 0 1 311.491 4.123 20 0 DIADMN C[C@H](CC(F)(F)F)N[C@H](C)C(=O)Nc1ccc2ccccc2c1 ZINC001255639195 1062494810 /nfs/dbraw/zinc/49/48/10/1062494810.db2.gz SPWGKDBXYSPIFC-VXGBXAGGSA-N 0 1 324.346 4.097 20 0 DIADMN CC[C@@H](NCc1ccc([Si](C)(C)C)cc1)c1nc(C)cs1 ZINC001459923530 1062498077 /nfs/dbraw/zinc/49/80/77/1062498077.db2.gz HKXCCSCBFKUMRM-MRXNPFEDSA-N 0 1 318.562 4.238 20 0 DIADMN C[C@H](CC(F)(F)F)N1CCC(C(=O)c2ccc(F)cc2)CC1 ZINC001255648202 1062498760 /nfs/dbraw/zinc/49/87/60/1062498760.db2.gz ZPWWUBKDNTYLQO-LLVKDONJSA-N 0 1 317.326 4.061 20 0 DIADMN C[C@H](CC(F)(F)F)N1CC2(CC(OCc3ccccc3)C2)C1 ZINC001255659586 1062502280 /nfs/dbraw/zinc/50/22/80/1062502280.db2.gz ABRHUVOJRRLHPE-CYBMUJFWSA-N 0 1 313.363 4.009 20 0 DIADMN CCOC(=O)[C@@H](C)N(CC1CCC(C(C)(C)C)CC1)C1CC1 ZINC001459960872 1062531859 /nfs/dbraw/zinc/53/18/59/1062531859.db2.gz RAQJGSOTYVYHOR-QQFBHYJXSA-N 0 1 309.494 4.255 20 0 DIADMN CC(C)C[C@@H]1OCCC[C@H]1NCc1nccc(Cl)c1Cl ZINC001460000178 1062558674 /nfs/dbraw/zinc/55/86/74/1062558674.db2.gz WIMJFOONWABSAR-OCCSQVGLSA-N 0 1 317.260 4.072 20 0 DIADMN C[C@@H]1CCCC[C@H]1CN1CCO[C@H](c2ccc(F)cc2F)C1 ZINC001459981798 1062543597 /nfs/dbraw/zinc/54/35/97/1062543597.db2.gz BQLCVKFPOOAQSZ-GLJUWKHASA-N 0 1 309.400 4.164 20 0 DIADMN FC(F)(F)[C@H]1CCC[C@@H](N2CCc3ncc(Cl)cc3C2)C1 ZINC001255719773 1062544776 /nfs/dbraw/zinc/54/47/76/1062544776.db2.gz HYPKFRRLYBGUGB-WCQYABFASA-N 0 1 318.770 4.214 20 0 DIADMN C[C@@H]1CCCC[C@@H]1CN1CCO[C@@H](c2ccc(F)cc2F)C1 ZINC001459981799 1062545377 /nfs/dbraw/zinc/54/53/77/1062545377.db2.gz BQLCVKFPOOAQSZ-HBUWYVDXSA-N 0 1 309.400 4.164 20 0 DIADMN CC[C@@H](CN(CC)[C@@H](C)C(=O)OC(C)(C)C)c1ccccc1 ZINC001459985150 1062547336 /nfs/dbraw/zinc/54/73/36/1062547336.db2.gz FDPMWEDPSFVXCM-HOTGVXAUSA-N 0 1 305.462 4.232 20 0 DIADMN C[C@H](Cc1ccccc1Cl)N[C@H](C)c1nc(C(C)(C)C)no1 ZINC001255732342 1062555123 /nfs/dbraw/zinc/55/51/23/1062555123.db2.gz IKVXLECZJQJQFV-VXGBXAGGSA-N 0 1 321.852 4.302 20 0 DIADMN CC(C)C[C@H]1OCCC[C@@H]1NCc1nccc(Cl)c1Cl ZINC001460000166 1062558836 /nfs/dbraw/zinc/55/88/36/1062558836.db2.gz WIMJFOONWABSAR-GXTWGEPZSA-N 0 1 317.260 4.072 20 0 DIADMN C[C@H](CSc1ccc(F)cc1)N1CCC(=O)[C@H]2CCCC[C@@H]21 ZINC001255737828 1062559360 /nfs/dbraw/zinc/55/93/60/1062559360.db2.gz NPVKOZAWVWEFAO-COXVUDFISA-N 0 1 321.461 4.140 20 0 DIADMN Cc1cnc2c(c1)CN([C@@H](C)CSc1ccc(F)cc1)CC2 ZINC001255745794 1062569546 /nfs/dbraw/zinc/56/95/46/1062569546.db2.gz AAMWOWDZJYGJCJ-AWEZNQCLSA-N 0 1 316.445 4.068 20 0 DIADMN Fc1ccc(CCN2CC[C@@](F)(c3ccccc3)C2)cc1F ZINC001460017194 1062570750 /nfs/dbraw/zinc/57/07/50/1062570750.db2.gz CXDRRKZDBSPLMJ-SFHVURJKSA-N 0 1 305.343 4.078 20 0 DIADMN CC(=O)[C@@H](N[C@@H](C)CSc1ccc(C)cc1)c1ccccc1 ZINC001255753768 1062574920 /nfs/dbraw/zinc/57/49/20/1062574920.db2.gz WVHLJGFKQOFHTO-HNAYVOBHSA-N 0 1 313.466 4.396 20 0 DIADMN Cc1ccc(SC[C@H](C)NCc2cn(C3CCC3)cn2)cc1 ZINC001255758475 1062578133 /nfs/dbraw/zinc/57/81/33/1062578133.db2.gz VPAMDWCXYZNIEF-HNNXBMFYSA-N 0 1 315.486 4.187 20 0 DIADMN Cc1ccc(SC[C@H](C)NCC(=O)c2cccc(F)c2)cc1 ZINC001255757352 1062578277 /nfs/dbraw/zinc/57/82/77/1062578277.db2.gz KLQPZECKZCQSFF-AWEZNQCLSA-N 0 1 317.429 4.087 20 0 DIADMN Cc1ccc(SC[C@H](C)NCc2cc(F)cnc2Cl)cc1 ZINC001255757610 1062580482 /nfs/dbraw/zinc/58/04/82/1062580482.db2.gz YINKUZXGZQKKOQ-LBPRGKRZSA-N 0 1 324.852 4.453 20 0 DIADMN Cc1ccc(SC[C@@H](C)NCc2cc(F)cnc2Cl)cc1 ZINC001255757609 1062580526 /nfs/dbraw/zinc/58/05/26/1062580526.db2.gz YINKUZXGZQKKOQ-GFCCVEGCSA-N 0 1 324.852 4.453 20 0 DIADMN C[C@H]1CCSCCN1CCc1cc(Cl)cc(Cl)c1 ZINC001460056114 1062606154 /nfs/dbraw/zinc/60/61/54/1062606154.db2.gz QXZPDQWNRJIQBU-NSHDSACASA-N 0 1 304.286 4.363 20 0 DIADMN Fc1ccc2c(c1)[C@H](N1CCOC3(CCCCC3)C1)CCC2 ZINC001460056326 1062606338 /nfs/dbraw/zinc/60/63/38/1062606338.db2.gz OZOADJFNNLUJDL-GOSISDBHSA-N 0 1 303.421 4.238 20 0 DIADMN CCO[C@@H]1C[C@H](NCc2ncoc2C(C)C)C12CCCCC2 ZINC001460062825 1062610022 /nfs/dbraw/zinc/61/00/22/1062610022.db2.gz GTXNWRWNLDHJPS-JKSUJKDBSA-N 0 1 306.450 4.016 20 0 DIADMN C[C@H](C(=O)Nc1ccc(Nc2ccncc2)cc1)c1cccs1 ZINC001469732685 1062614369 /nfs/dbraw/zinc/61/43/69/1062614369.db2.gz LQOVLQYLJMQJEL-ZDUSSCGKSA-N 0 1 323.421 4.051 20 0 DIADMN CSc1cc(NC(=O)c2cccc3nc(C)[nH]c32)ccc1C ZINC001469736076 1062614609 /nfs/dbraw/zinc/61/46/09/1062614609.db2.gz SIOFSPJHOUPUDE-UHFFFAOYSA-N 0 1 311.410 4.154 20 0 DIADMN CCCOC(=O)[C@H](C)N([C@H](C)c1ccccc1)C1CCCC1 ZINC001460078095 1062618200 /nfs/dbraw/zinc/61/82/00/1062618200.db2.gz BWXLLSTYZMNMLT-CVEARBPZSA-N 0 1 303.446 4.334 20 0 DIADMN C[C@@H](Cc1ccccc1F)NCc1c(Cl)cncc1Cl ZINC001255836488 1062621906 /nfs/dbraw/zinc/62/19/06/1062621906.db2.gz ULWDBQQOJTTZKX-JTQLQIEISA-N 0 1 313.203 4.248 20 0 DIADMN CCCCCCN(C)CC(=O)Nc1ccccc1NC1CCC1 ZINC001469784706 1062625882 /nfs/dbraw/zinc/62/58/82/1062625882.db2.gz DLZBNAVOLICQJK-UHFFFAOYSA-N 0 1 317.477 4.102 20 0 DIADMN C[C@H](Cc1ccccc1F)NCc1nccc(Cl)c1Cl 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C[C@H]1CC(N2CCc3cc(Cl)cc(Cl)c3C2)C[C@H](C)O1 ZINC001257104864 1063113574 /nfs/dbraw/zinc/11/35/74/1063113574.db2.gz VAAOEEAOYWRBTB-QWRGUYRKSA-N 0 1 314.256 4.308 20 0 DIADMN CCC[C@@H]1CCCN1Cc1cn2cc(Cl)cc(Cl)c2n1 ZINC001460898470 1063123176 /nfs/dbraw/zinc/12/31/76/1063123176.db2.gz IEHZDORMHFZKIK-CYBMUJFWSA-N 0 1 312.244 4.406 20 0 DIADMN Cc1ccc([C@@H]2C[C@H]2c2nnc(-c3ccc4[nH]cnc4c3)o2)cc1 ZINC001257214711 1063143813 /nfs/dbraw/zinc/14/38/13/1063143813.db2.gz CHIRPMBPFOEGPA-LSDHHAIUSA-N 0 1 316.364 4.192 20 0 DIADMN Cc1ccc([C@@H]2C[C@@H]2c2nnc(-c3ccc4[nH]cnc4c3)o2)cc1 ZINC001257214708 1063144775 /nfs/dbraw/zinc/14/47/75/1063144775.db2.gz CHIRPMBPFOEGPA-GJZGRUSLSA-N 0 1 316.364 4.192 20 0 DIADMN CCc1ccc2c(c1)CCN(Cc1cnc3ccccc3c1)C2 ZINC001460971763 1063162775 /nfs/dbraw/zinc/16/27/75/1063162775.db2.gz JITZCSBXBNNIHZ-UHFFFAOYSA-N 0 1 302.421 4.356 20 0 DIADMN CCC[C@@H](CC)N[C@@H](c1nc2ccccc2n1C)c1cccnc1 ZINC001257254321 1063163237 /nfs/dbraw/zinc/16/32/37/1063163237.db2.gz 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/nfs/dbraw/zinc/19/97/09/1063199709.db2.gz HMMQIJXLFXPIDO-UHFFFAOYSA-N 0 1 324.255 4.053 20 0 DIADMN COc1ncccc1CNCc1ccc(C2CC2)c(C2CC2)c1 ZINC001461032941 1063201964 /nfs/dbraw/zinc/20/19/64/1063201964.db2.gz ZNIRTVOBUAQVTA-UHFFFAOYSA-N 0 1 308.425 4.135 20 0 DIADMN CCC[C@H](C)N1CCn2nc(-c3ccc(Cl)cc3)cc2C1 ZINC001257323792 1063205617 /nfs/dbraw/zinc/20/56/17/1063205617.db2.gz GNPJTIGPQWFPOE-ZDUSSCGKSA-N 0 1 303.837 4.208 20 0 DIADMN Cn1cc(CN[C@H](c2ccccc2)C2CCCCC2)c(Cl)n1 ZINC001461040794 1063207952 /nfs/dbraw/zinc/20/79/52/1063207952.db2.gz BPNYDKRLCXTUAY-QGZVFWFLSA-N 0 1 317.864 4.485 20 0 DIADMN Cc1ccc([C@@H]2C[C@@H]2c2nnc(-c3c(O)cccc3F)o2)cc1 ZINC001257325219 1063208804 /nfs/dbraw/zinc/20/88/04/1063208804.db2.gz PSPMWVVRBOYGKP-STQMWFEESA-N 0 1 310.328 4.161 20 0 DIADMN CCC[C@@H](C)N1CCO[C@@H](c2cccc(C(F)(F)F)c2)C1 ZINC001257327055 1063211966 /nfs/dbraw/zinc/21/19/66/1063211966.db2.gz FXBKDVWNSVLSHI-IUODEOHRSA-N 0 1 301.352 4.267 20 0 DIADMN Cc1ccc(-c2ncc(CNCc3ccc(Cl)nc3)s2)o1 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ZINC001461208942 1063333485 /nfs/dbraw/zinc/33/34/85/1063333485.db2.gz NTGBCERCEGRTCS-OAHLLOKOSA-N 0 1 323.436 4.188 20 0 DIADMN C[C@H](Sc1nc(C=Cc2ccccc2)n[nH]1)C(=O)C(C)(C)C ZINC001472974278 1063335642 /nfs/dbraw/zinc/33/56/42/1063335642.db2.gz GDBJPLDNRJMVDV-IIANPFDCSA-N 0 1 315.442 4.071 20 0 DIADMN Cc1cc(CSc2nc(C=Cc3ccccc3)n[nH]2)sn1 ZINC001472974480 1063336775 /nfs/dbraw/zinc/33/67/75/1063336775.db2.gz ISOYILLTAHLOEJ-FPLPWBNLSA-N 0 1 314.439 4.032 20 0 DIADMN CC(C)CC[C@@](C)(O)CNCc1c(Cl)cccc1Cl ZINC001461226521 1063345691 /nfs/dbraw/zinc/34/56/91/1063345691.db2.gz ISGGWJXNNQISFM-OAHLLOKOSA-N 0 1 304.261 4.270 20 0 DIADMN CC(C)CC[C@](C)(O)CNCc1c(Cl)cccc1Cl ZINC001461226520 1063346359 /nfs/dbraw/zinc/34/63/59/1063346359.db2.gz ISGGWJXNNQISFM-HNNXBMFYSA-N 0 1 304.261 4.270 20 0 DIADMN Cc1cccc(F)c1CNCc1nc(C(C)C)n2ccccc12 ZINC001461239045 1063357243 /nfs/dbraw/zinc/35/72/43/1063357243.db2.gz NIRZLWHBNBRKLF-UHFFFAOYSA-N 0 1 311.404 4.195 20 0 DIADMN COc1ccc2c(c1)OCC[C@H]2NCc1ccc(Cl)cc1C ZINC001461242844 1063360559 /nfs/dbraw/zinc/36/05/59/1063360559.db2.gz JMRGALAGIWMIAA-QGZVFWFLSA-N 0 1 317.816 4.270 20 0 DIADMN Cc1cc(C)cc(C[C@@H](C)NCc2nc(C(C)(C)C)co2)c1 ZINC001461249641 1063362931 /nfs/dbraw/zinc/36/29/31/1063362931.db2.gz FXQIOYLIJWTYNY-OAHLLOKOSA-N 0 1 300.446 4.310 20 0 DIADMN CCCN(CCC)[C@@H](C)c1nnc(CCCc2ccccc2)o1 ZINC001257736538 1063376521 /nfs/dbraw/zinc/37/65/21/1063376521.db2.gz NHRKUNGZDLQGAS-INIZCTEOSA-N 0 1 315.461 4.428 20 0 DIADMN Cc1ccc(CNCc2ccc(C)nc2)c(OCCC(C)C)c1 ZINC001461283032 1063388038 /nfs/dbraw/zinc/38/80/38/1063388038.db2.gz FBBYHGCYQULLOQ-UHFFFAOYSA-N 0 1 312.457 4.413 20 0 DIADMN CO[C@H](CN(Cc1ccc(F)cc1F)C1CC1)C1CCCC1 ZINC001473108477 1063405421 /nfs/dbraw/zinc/40/54/21/1063405421.db2.gz KJUVAEMKFGVJPS-GOSISDBHSA-N 0 1 309.400 4.134 20 0 DIADMN CN(Cc1ncc(Br)cc1Cl)CC1CCCC1 ZINC001473123659 1063425385 /nfs/dbraw/zinc/42/53/85/1063425385.db2.gz FWNFYTSOIWOHCR-UHFFFAOYSA-N 0 1 317.658 4.120 20 0 DIADMN CCCC[C@H](CC)CN1CCN(C(=O)c2ccc(C)s2)CC1 ZINC001473121199 1063426647 /nfs/dbraw/zinc/42/66/47/1063426647.db2.gz YRPYVLAHEOLOHB-INIZCTEOSA-N 0 1 322.518 4.031 20 0 DIADMN Cc1ccc(CNCc2cc(C)nc(C)c2)c(OC(C)(C)C)c1 ZINC001461341379 1063430580 /nfs/dbraw/zinc/43/05/80/1063430580.db2.gz ALFQWVFDTZNBDN-UHFFFAOYSA-N 0 1 312.457 4.474 20 0 DIADMN Cc1nc(CN(C)[C@@H]2CCC[C@H](C)C2)sc1Br ZINC001473127472 1063433659 /nfs/dbraw/zinc/43/36/59/1063433659.db2.gz HBUPBXIZGFQGEJ-GXSJLCMTSA-N 0 1 317.296 4.225 20 0 DIADMN COc1ccc(Br)c(C[N@@H+]([C@H](C)C2CC2)C2CC2)c1 ZINC001473132851 1063439612 /nfs/dbraw/zinc/43/96/12/1063439612.db2.gz IUZBWKROMRJJHA-LLVKDONJSA-N 0 1 324.262 4.221 20 0 DIADMN COc1ccc(Br)c(CN([C@H](C)C2CC2)C2CC2)c1 ZINC001473132851 1063439624 /nfs/dbraw/zinc/43/96/24/1063439624.db2.gz IUZBWKROMRJJHA-LLVKDONJSA-N 0 1 324.262 4.221 20 0 DIADMN C[N@H+](Cc1cccc(C(F)(F)F)c1)C[C@@H]1C[C@@H]2CCC[C@@H]2O1 ZINC001473133056 1063440276 /nfs/dbraw/zinc/44/02/76/1063440276.db2.gz NXTBPAJGEDHJDV-BPUTZDHNSA-N 0 1 313.363 4.095 20 0 DIADMN CCCn1cc(CN[C@@H](C)c2ccc(Cl)c(F)c2)c(C)n1 ZINC001461357265 1063442611 /nfs/dbraw/zinc/44/26/11/1063442611.db2.gz HNUWTGGGZHHGTR-NSHDSACASA-N 0 1 309.816 4.245 20 0 DIADMN Fc1ccccc1C1(N[C@@H]2COc3ccc(Cl)cc3C2)CC1 ZINC001257949630 1063442772 /nfs/dbraw/zinc/44/27/72/1063442772.db2.gz AAKXLXJNXODZLQ-AWEZNQCLSA-N 0 1 317.791 4.062 20 0 DIADMN Clc1cccc(Cl)c1CCN1CCC(c2cn[nH]c2)CC1 ZINC001473144423 1063448389 /nfs/dbraw/zinc/44/83/89/1063448389.db2.gz UMNWSPXITLCUHB-UHFFFAOYSA-N 0 1 324.255 4.139 20 0 DIADMN COc1cc(C)cc(CNCc2c(Cl)cccc2N(C)C)c1 ZINC001461366683 1063450479 /nfs/dbraw/zinc/45/04/79/1063450479.db2.gz CTADUUGFGFWFEN-UHFFFAOYSA-N 0 1 318.848 4.013 20 0 DIADMN CC(C)Oc1cc(F)ccc1NC(=O)c1ccc(Cl)c(O)c1 ZINC001546254520 1063454345 /nfs/dbraw/zinc/45/43/45/1063454345.db2.gz OQBVTSMODNDVTI-UHFFFAOYSA-N 0 1 323.751 4.224 20 0 DIADMN CCC1(CC)[C@@H](NCc2c(F)ccc(F)c2Cl)C[C@@H]1OC ZINC001461381274 1063461454 /nfs/dbraw/zinc/46/14/54/1063461454.db2.gz LGHIOHKLVDHTDE-KBPBESRZSA-N 0 1 317.807 4.302 20 0 DIADMN Cc1cc(C)c(/C=C\CNc2cnccc2-n2cccn2)c(C)c1 ZINC001461381583 1063462344 /nfs/dbraw/zinc/46/23/44/1063462344.db2.gz NNEHJLITSRUVFY-XQRVVYSFSA-N 0 1 318.424 4.318 20 0 DIADMN Cc1ccc(NC(=O)CN2CCC[C@@H](C(C)C)CC2)cc1Cl ZINC001473170571 1063473376 /nfs/dbraw/zinc/47/33/76/1063473376.db2.gz OREPZVVWZSYRHI-OAHLLOKOSA-N 0 1 322.880 4.345 20 0 DIADMN Cc1ccccc1[C@@H]1CN(Cc2ccccc2CF)[C@H](C)CO1 ZINC001473172946 1063476313 /nfs/dbraw/zinc/47/63/13/1063476313.db2.gz IHMSDXPBUVYICK-UZLBHIALSA-N 0 1 313.416 4.427 20 0 DIADMN CC[C@@H]1CCC[C@@H](CNc2ccccc2N2CCN(C)CC2)C1 ZINC001461406236 1063476724 /nfs/dbraw/zinc/47/67/24/1063476724.db2.gz OTADIRGXDNKMFW-QZTJIDSGSA-N 0 1 315.505 4.067 20 0 DIADMN CC[C@@H]1CCC[C@H](CNc2ccccc2N2CCN(C)CC2)C1 ZINC001461406220 1063477620 /nfs/dbraw/zinc/47/76/20/1063477620.db2.gz OTADIRGXDNKMFW-MSOLQXFVSA-N 0 1 315.505 4.067 20 0 DIADMN CCc1ccc([C@@H]2COCCN2C[C@H](C)C2CCCCC2)o1 ZINC001473177759 1063483233 /nfs/dbraw/zinc/48/32/33/1063483233.db2.gz 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ZINC000192669980 336258519 /nfs/dbraw/zinc/25/85/19/336258519.db2.gz DLQSJXPZBCYPLS-HNNXBMFYSA-N 0 1 307.397 4.063 20 0 DIADMN Cc1ccc(CN[C@@H](C)c2cnc(C)nc2C)c(OC(C)C)c1 ZINC000167693048 336258985 /nfs/dbraw/zinc/25/89/85/336258985.db2.gz JAUJQXYSYGEMSF-AWEZNQCLSA-N 0 1 313.445 4.040 20 0 DIADMN Cc1cccc(C)c1NC(=O)CN1CCC[C@@H](CC(C)C)C1 ZINC000468847257 336259079 /nfs/dbraw/zinc/25/90/79/336259079.db2.gz GEWQPMOEIVPBIS-KRWDZBQOSA-N 0 1 302.462 4.000 20 0 DIADMN C[C@@H](NCc1ccc(Oc2ccccc2)cc1)c1ccnn1C ZINC000192796632 336262200 /nfs/dbraw/zinc/26/22/00/336262200.db2.gz MRYAJTIRTGTKKY-OAHLLOKOSA-N 0 1 307.397 4.063 20 0 DIADMN FC(F)(F)c1ccc([C@H]2CCCCN2Cc2ccno2)cc1 ZINC000532688200 336267476 /nfs/dbraw/zinc/26/74/76/336267476.db2.gz LUTCTSQKDGPVNK-OAHLLOKOSA-N 0 1 310.319 4.421 20 0 DIADMN CCOc1ccc(-c2nc(CN(C)[C@H](C)CC)cs2)cc1 ZINC000532688817 336267597 /nfs/dbraw/zinc/26/75/97/336267597.db2.gz OJIPFTCECTZWTM-CYBMUJFWSA-N 0 1 304.459 4.439 20 0 DIADMN COc1ccc(CN(C)C2c3ccccc3-c3ccccc32)cn1 ZINC000532729417 336267848 /nfs/dbraw/zinc/26/78/48/336267848.db2.gz CFDWVJWFGSGSEO-UHFFFAOYSA-N 0 1 316.404 4.292 20 0 DIADMN CCCN(Cc1cc(-c2cccs2)on1)C[C@@H]1CCCCO1 ZINC000532715039 336267978 /nfs/dbraw/zinc/26/79/78/336267978.db2.gz ZQMFDFBWWYGXNI-HNNXBMFYSA-N 0 1 320.458 4.184 20 0 DIADMN Cc1ncc(-c2ccc(NCc3ccc4nc[nH]c4c3)cc2)o1 ZINC000532725276 336268505 /nfs/dbraw/zinc/26/85/05/336268505.db2.gz MPHRVHWDNFTJAA-UHFFFAOYSA-N 0 1 304.353 4.138 20 0 DIADMN Cc1ccc(NC(=O)C[N@H+](C)C2CCC(C)CC2)c(Cl)c1 ZINC000104883102 336271392 /nfs/dbraw/zinc/27/13/92/336271392.db2.gz AWOURLJVCFBKTB-UHFFFAOYSA-N 0 1 308.853 4.097 20 0 DIADMN Cc1cc([C@@H](C)NCc2cc(O)cc(C(F)(F)F)c2)c(C)o1 ZINC000352843580 336275827 /nfs/dbraw/zinc/27/58/27/336275827.db2.gz ZWJKCENBCPFVRI-SNVBAGLBSA-N 0 1 313.319 4.472 20 0 DIADMN Cc1cc([C@H](C)NCc2cc(O)cc(C(F)(F)F)c2)c(C)o1 ZINC000352843576 336275840 /nfs/dbraw/zinc/27/58/40/336275840.db2.gz ZWJKCENBCPFVRI-JTQLQIEISA-N 0 1 313.319 4.472 20 0 DIADMN COc1ccc2c(c1)[C@H](NCc1ccc(SC)s1)CCO2 ZINC000352843726 336276024 /nfs/dbraw/zinc/27/60/24/336276024.db2.gz CIVUDHVAEQWJMA-CQSZACIVSA-N 0 1 321.467 4.092 20 0 DIADMN Cc1cccc(Oc2cc(CNCC3(F)CC3)ccn2)c1C ZINC000526981116 336277869 /nfs/dbraw/zinc/27/78/69/336277869.db2.gz DLHUKIADRXPPBP-UHFFFAOYSA-N 0 1 300.377 4.082 20 0 DIADMN C[C@H](Nc1ccc2nn[nH]c2c1)[C@H](C)c1nc2ccccc2s1 ZINC000526988842 336278564 /nfs/dbraw/zinc/27/85/64/336278564.db2.gz LPKQIKKNUHIRFT-QWRGUYRKSA-N 0 1 323.425 4.172 20 0 DIADMN C[C@H](Nc1ccc2n[nH]nc2c1)[C@H](C)c1nc2ccccc2s1 ZINC000526988842 336278565 /nfs/dbraw/zinc/27/85/65/336278565.db2.gz LPKQIKKNUHIRFT-QWRGUYRKSA-N 0 1 323.425 4.172 20 0 DIADMN C[C@@H]1C[C@@H](C)N1Cc1cc2ccccc2nc1N1CCCCC1 ZINC000526989518 336278731 /nfs/dbraw/zinc/27/87/31/336278731.db2.gz MZAYGDOOCDEOMQ-HZPDHXFCSA-N 0 1 309.457 4.208 20 0 DIADMN Cc1ccc(C2CCN(Cc3cccc(O)c3Cl)CC2)cn1 ZINC000352853923 336280383 /nfs/dbraw/zinc/28/03/83/336280383.db2.gz PNLBRFRZRMRRPN-UHFFFAOYSA-N 0 1 316.832 4.129 20 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DIADMN Fc1ccc2c(c1)nccc2NCc1ccc(OCC2CC2)nc1 ZINC000301242656 336296375 /nfs/dbraw/zinc/29/63/75/336296375.db2.gz GQVTYVNHRHKTBI-UHFFFAOYSA-N 0 1 323.371 4.170 20 0 DIADMN Fc1ccc2c(c1)nccc2NCc1ccc(-n2ccnc2)cc1 ZINC000301273160 336297955 /nfs/dbraw/zinc/29/79/55/336297955.db2.gz ODFNVFGCSQSJAG-UHFFFAOYSA-N 0 1 318.355 4.172 20 0 DIADMN Fc1ccc2c(c1)nccc2N1CC[C@@H](Nc2ccccc2)C1 ZINC000301289023 336298974 /nfs/dbraw/zinc/29/89/74/336298974.db2.gz SNWAQNNIQIDQSU-MRXNPFEDSA-N 0 1 307.372 4.065 20 0 DIADMN COc1ccccc1[C@H]1CCN(c2ccnc3cc(F)ccc32)C1 ZINC000301331854 336301077 /nfs/dbraw/zinc/30/10/77/336301077.db2.gz APBSCODKLNDBAT-AWEZNQCLSA-N 0 1 322.383 4.376 20 0 DIADMN Fc1ccc2c(c1)nccc2N[C@H]1CCCC[C@H]1n1cccn1 ZINC000301446645 336307329 /nfs/dbraw/zinc/30/73/29/336307329.db2.gz RGTHTHHZWLHAOB-FUHWJXTLSA-N 0 1 310.376 4.166 20 0 DIADMN Fc1cc(Cl)cnc1NC[C@@H](c1ccco1)N1CCCCC1 ZINC000301574680 336315943 /nfs/dbraw/zinc/31/59/43/336315943.db2.gz ZJSKFMKIOKIZNK-AWEZNQCLSA-N 0 1 323.799 4.106 20 0 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C[C@@H](O)C[C@@H](C)CNc1ccnc2cc(C(F)(F)F)ccc21 ZINC000301801628 336331056 /nfs/dbraw/zinc/33/10/56/336331056.db2.gz SQLQVBORRJLQKF-GHMZBOCLSA-N 0 1 312.335 4.073 20 0 DIADMN Cc1cc(N[C@@H](C)C[C@@H](O)c2ccco2)c2cc(F)ccc2n1 ZINC000301878684 336335761 /nfs/dbraw/zinc/33/57/61/336335761.db2.gz HOFSTFSEPCHWHU-YVEFUNNKSA-N 0 1 314.360 4.199 20 0 DIADMN Cc1ccc(-c2noc(N[C@@H](C)c3nc4ccccc4[nH]3)n2)cc1 ZINC000302045466 336345192 /nfs/dbraw/zinc/34/51/92/336345192.db2.gz MWMHPJQWZDINTI-LBPRGKRZSA-N 0 1 319.368 4.094 20 0 DIADMN CSc1ccc(CN[C@H]2CCOc3c(C)cccc32)s1 ZINC000352891561 336356971 /nfs/dbraw/zinc/35/69/71/336356971.db2.gz KLSHJOXPFMYIPB-AWEZNQCLSA-N 0 1 305.468 4.392 20 0 DIADMN Cc1csc2nc(C)nc(NCc3nc4cccc(C)c4[nH]3)c12 ZINC000302345199 336357479 /nfs/dbraw/zinc/35/74/79/336357479.db2.gz CHHVEWNWSDEBKK-UHFFFAOYSA-N 0 1 323.425 4.105 20 0 DIADMN C[C@@](O)(CCNc1ccnc2cc(F)ccc21)c1ccccc1 ZINC000302377886 336357889 /nfs/dbraw/zinc/35/78/89/336357889.db2.gz GFMLTYIFNRKEIR-LJQANCHMSA-N 0 1 310.372 4.084 20 0 DIADMN OCC[C@H]1CCC[C@@H]1Nc1ccnc2cc(C(F)(F)F)ccc21 ZINC000302452364 336359078 /nfs/dbraw/zinc/35/90/78/336359078.db2.gz PSTFQCOLCWOGPZ-RISCZKNCSA-N 0 1 324.346 4.217 20 0 DIADMN OCC[C@H]1CCC[C@H]1Nc1ccnc2cc(C(F)(F)F)ccc21 ZINC000302452359 336359122 /nfs/dbraw/zinc/35/91/22/336359122.db2.gz PSTFQCOLCWOGPZ-BXUZGUMPSA-N 0 1 324.346 4.217 20 0 DIADMN Fc1ccc2c(c1)nccc2N[C@H]1CCOc2c(F)cccc21 ZINC000302689338 336364939 /nfs/dbraw/zinc/36/49/39/336364939.db2.gz UWNCACJUVVRMQE-INIZCTEOSA-N 0 1 312.319 4.449 20 0 DIADMN CC[C@@H](C)CN(C)[C@H](C)c1nnc(-c2ccccc2F)s1 ZINC000514114476 336368172 /nfs/dbraw/zinc/36/81/72/336368172.db2.gz HAVDQKFBDLJUJB-VXGBXAGGSA-N 0 1 307.438 4.383 20 0 DIADMN CC[C@@H](C)CN(C)[C@@H](C)c1nnc(-c2ccccc2F)s1 ZINC000514114473 336368228 /nfs/dbraw/zinc/36/82/28/336368228.db2.gz HAVDQKFBDLJUJB-NEPJUHHUSA-N 0 1 307.438 4.383 20 0 DIADMN Cc1c(Nc2nc(C(C)(C)C)ns2)cnn1C1CCCC1 ZINC000302906235 336374029 /nfs/dbraw/zinc/37/40/29/336374029.db2.gz 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0 1 317.816 4.062 20 0 DIADMN O=C(Nc1ccc(-c2ccco2)cc1F)c1c(O)cccc1F ZINC000436819536 338288412 /nfs/dbraw/zinc/28/84/12/338288412.db2.gz DJFAVPGTHPUBIO-UHFFFAOYSA-N 0 1 315.275 4.183 20 0 DIADMN CC(C)C[C@H](C)n1nccc1NC(=O)c1ccc(Cl)cc1O ZINC000436819425 338288459 /nfs/dbraw/zinc/28/84/59/338288459.db2.gz NGHIOVVTLKUVTH-NSHDSACASA-N 0 1 321.808 4.102 20 0 DIADMN CSCCc1ccc(NC(=O)c2cc(Cl)ccc2O)cc1 ZINC000436855163 338290050 /nfs/dbraw/zinc/29/00/50/338290050.db2.gz URNKNSAXBXYURF-UHFFFAOYSA-N 0 1 321.829 4.203 20 0 DIADMN C[C@@H]1CC[C@H](N(C)C(=O)c2cc(Cl)c3ccccc3c2O)C1 ZINC000436878908 338291458 /nfs/dbraw/zinc/29/14/58/338291458.db2.gz VOXGMQQGVOJBOI-NEPJUHHUSA-N 0 1 317.816 4.459 20 0 DIADMN C[C@@H](Oc1ccccc1)c1noc(-c2ccc(Cl)cc2O)n1 ZINC000436930078 338294054 /nfs/dbraw/zinc/29/40/54/338294054.db2.gz GWAJPGKXCJLRIX-SNVBAGLBSA-N 0 1 316.744 4.236 20 0 DIADMN O=C(c1c(O)cccc1F)N1CCC[C@H]1c1ccc(Cl)cc1 ZINC000436950395 338295436 /nfs/dbraw/zinc/29/54/36/338295436.db2.gz 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/nfs/dbraw/zinc/30/11/27/338301127.db2.gz XHZQWSFTRDNQPR-QZTJIDSGSA-N 0 1 315.388 4.399 20 0 DIADMN CCc1sc(-c2nnc(CN3C[C@@H](C)CC[C@H]3C)o2)cc1C ZINC000437122252 338302024 /nfs/dbraw/zinc/30/20/24/338302024.db2.gz HWQSDKJXOHBAHM-WCQYABFASA-N 0 1 319.474 4.289 20 0 DIADMN CCN(Cc1ccc(OC)nc1)[C@H](C)c1cc2ccccc2o1 ZINC000437687954 338318309 /nfs/dbraw/zinc/31/83/09/338318309.db2.gz MKZHKGATSHYGSX-CQSZACIVSA-N 0 1 310.397 4.420 20 0 DIADMN COc1cccc2c1CCN(Cc1ccc3nc(C)ccc3c1)C2 ZINC000437790193 338321614 /nfs/dbraw/zinc/32/16/14/338321614.db2.gz XKTPZRMSHKYHHZ-UHFFFAOYSA-N 0 1 318.420 4.110 20 0 DIADMN CC1=CCCN(C(=O)c2cccc3[nH]c(-c4cccs4)nc32)C1 ZINC000437982002 338327222 /nfs/dbraw/zinc/32/72/22/338327222.db2.gz DARWZFRSAKYJBL-UHFFFAOYSA-N 0 1 323.421 4.084 20 0 DIADMN CCOc1ccc(-c2nc(CN(C)CC(C)(C)C)co2)cc1 ZINC000438057596 338329272 /nfs/dbraw/zinc/32/92/72/338329272.db2.gz BETHLWWAUAUOQP-UHFFFAOYSA-N 0 1 302.418 4.218 20 0 DIADMN C[C@H](CN1CCO[C@H](c2ccsc2)C1)c1ccc(F)cc1 ZINC000438097752 338331372 /nfs/dbraw/zinc/33/13/72/338331372.db2.gz UFDBUZWYNQJLEE-DYVFJYSZSA-N 0 1 305.418 4.064 20 0 DIADMN C[C@H]1c2cc(Cl)cc(Cl)c2CCN1CC[C@H]1CCOC1 ZINC000438111106 338332361 /nfs/dbraw/zinc/33/23/61/338332361.db2.gz TWZWDDNLZVBLQB-RYUDHWBXSA-N 0 1 314.256 4.339 20 0 DIADMN CC(C)(C)C1=CCN(Cc2c[nH]nc2-c2ccsc2)CC1 ZINC000438122235 338333449 /nfs/dbraw/zinc/33/34/49/338333449.db2.gz ATPBJNUEAUOKJU-UHFFFAOYSA-N 0 1 301.459 4.316 20 0 DIADMN CC(C)c1nnc(CN[C@@H]2CC[C@](C)(c3ccccc3)C2)s1 ZINC000438182625 338335285 /nfs/dbraw/zinc/33/52/85/338335285.db2.gz XYYMMVNKDYNSQR-QAPCUYQASA-N 0 1 315.486 4.262 20 0 DIADMN CC(C)c1nnc(CN[C@H]2CC[C@@](C)(c3ccccc3)C2)s1 ZINC000438182624 338335361 /nfs/dbraw/zinc/33/53/61/338335361.db2.gz XYYMMVNKDYNSQR-MAUKXSAKSA-N 0 1 315.486 4.262 20 0 DIADMN Cc1ccc(CN2CCC[C@H]2c2nc3ccc(Cl)cc3[nH]2)o1 ZINC000438290132 338338775 /nfs/dbraw/zinc/33/87/75/338338775.db2.gz MTLDNXGUDRJZSK-INIZCTEOSA-N 0 1 315.804 4.455 20 0 DIADMN COc1ccc(C)cc1CNCc1cccc(CSC)c1 ZINC000438346886 338340747 /nfs/dbraw/zinc/34/07/47/338340747.db2.gz FCSCVGMHZMWRGZ-UHFFFAOYSA-N 0 1 301.455 4.156 20 0 DIADMN CSCc1cccc(CNCc2cnc(C(C)C)s2)c1 ZINC000438358781 338341230 /nfs/dbraw/zinc/34/12/30/338341230.db2.gz QWVKQTXYDDOAIS-UHFFFAOYSA-N 0 1 306.500 4.419 20 0 DIADMN O=C(c1cc(-c2ccccc2)n[nH]1)N(CC1CC1)c1ccccc1 ZINC000438387322 338342433 /nfs/dbraw/zinc/34/24/33/338342433.db2.gz LMMPMPKQISUKBV-UHFFFAOYSA-N 0 1 317.392 4.134 20 0 DIADMN CC(C)[C@H](CC(F)(F)F)NCc1nc2c(s1)C[C@@H](C)CC2 ZINC000438469002 338344796 /nfs/dbraw/zinc/34/47/96/338344796.db2.gz FKPVKSAUMZPDHT-JQWIXIFHSA-N 0 1 320.424 4.335 20 0 DIADMN CC(C)[C@H](CC(F)(F)F)NCc1coc(-c2ccccc2)n1 ZINC000438485549 338345747 /nfs/dbraw/zinc/34/57/47/338345747.db2.gz MANGAMHKZLRZKQ-AWEZNQCLSA-N 0 1 312.335 4.408 20 0 DIADMN CC(C)[C@@H]1CCN([C@@H](C)c2nc3ccccc3n2C(F)F)C1 ZINC000438493586 338345923 /nfs/dbraw/zinc/34/59/23/338345923.db2.gz QUSRUOHCMXAKIR-QWHCGFSZSA-N 0 1 307.388 4.470 20 0 DIADMN O=C(Nc1cccc(OC2CCCC2)c1)c1cccc2nc[nH]c21 ZINC000438569377 338348572 /nfs/dbraw/zinc/34/85/72/338348572.db2.gz NGZKZWGWYAKLLB-UHFFFAOYSA-N 0 1 321.380 4.137 20 0 DIADMN CC[C@@H](NC(=O)c1cccc2nc[nH]c21)c1ccc(Cl)cc1 ZINC000438577256 338348809 /nfs/dbraw/zinc/34/88/09/338348809.db2.gz RIAANEDDHMLNEL-CQSZACIVSA-N 0 1 313.788 4.097 20 0 DIADMN FC(F)(F)Oc1cccc(CC[N@H+]2CCC[C@@H]2c2ccc[nH]2)c1 ZINC000438759072 338351823 /nfs/dbraw/zinc/35/18/23/338351823.db2.gz XWOSFVMFVGOWLA-MRXNPFEDSA-N 0 1 324.346 4.293 20 0 DIADMN C[C@@H](N[C@@H](C)C1CCC1)c1noc(-c2ccc(Cl)cc2)n1 ZINC000438851347 338353973 /nfs/dbraw/zinc/35/39/73/338353973.db2.gz OYUCRCKZLDFBIO-WDEREUQCSA-N 0 1 305.809 4.229 20 0 DIADMN CCCC[C@@H](COC)NCc1nc(-c2ccccc2F)cs1 ZINC000438862496 338354254 /nfs/dbraw/zinc/35/42/54/338354254.db2.gz WXOBZFQOQIWETM-ZDUSSCGKSA-N 0 1 322.449 4.244 20 0 DIADMN CC[C@H](C)c1ccc(S(=O)(=O)Nc2cscc2C)cc1 ZINC000439049840 338359623 /nfs/dbraw/zinc/35/96/23/338359623.db2.gz JQDRSNMMEVMCSC-NSHDSACASA-N 0 1 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DQGMULRZJIBZSL-OAHLLOKOSA-N 0 1 313.445 4.103 20 0 DIADMN Cc1cc(NC(=O)c2ccc(O)c(Cl)c2)ccc1OC(C)C ZINC000439964377 338381829 /nfs/dbraw/zinc/38/18/29/338381829.db2.gz XMIIWTFSPLPPGJ-UHFFFAOYSA-N 0 1 319.788 4.394 20 0 DIADMN C[C@H]1CN(Cc2csc(CCc3ccccc3)n2)C[C@@H]1C ZINC000440318918 338385413 /nfs/dbraw/zinc/38/54/13/338385413.db2.gz UQGGCZHZIBMSIJ-GJZGRUSLSA-N 0 1 300.471 4.016 20 0 DIADMN C[C@@H]1C[C@H](C)N(Cc2csc(CCc3ccccc3)n2)C1 ZINC000440331284 338385853 /nfs/dbraw/zinc/38/58/53/338385853.db2.gz NIZRRYBGYZGBMK-CABCVRRESA-N 0 1 300.471 4.159 20 0 DIADMN CCSCC[C@@H](C)N(C)Cc1nc(C(C)(C)C)cs1 ZINC000440369136 338386367 /nfs/dbraw/zinc/38/63/67/338386367.db2.gz VOWBLZNTPGTTNT-GFCCVEGCSA-N 0 1 300.537 4.404 20 0 DIADMN Cc1ccc(SCCNC(C)(C)c2nccs2)cc1C ZINC000440472581 338387953 /nfs/dbraw/zinc/38/79/53/338387953.db2.gz VEFKGESOFAUQJC-UHFFFAOYSA-N 0 1 306.500 4.377 20 0 DIADMN CC(C)c1ncc(CN(C)[C@@H]2CCc3c2cccc3Cl)cn1 ZINC000440490592 338388417 /nfs/dbraw/zinc/38/84/17/338388417.db2.gz 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0 1 302.418 4.417 20 0 DIADMN OCC[C@H](N[C@@H]1CCc2cccc3cccc1c32)c1ccco1 ZINC000866339774 1043182122 /nfs/dbraw/zinc/18/21/22/1043182122.db2.gz DTXBKYCVUFYLLW-MSOLQXFVSA-N 0 1 307.393 4.133 20 0 DIADMN Cc1sc(NC(=O)C[N@H+]2CCCC(C)(C)CC2)c(C)c1C ZINC000441491238 1043182861 /nfs/dbraw/zinc/18/28/61/1043182861.db2.gz XMCYOOYACVXHAJ-UHFFFAOYSA-N 0 1 308.491 4.124 20 0 DIADMN Cc1sc(NC(=O)CN2CCCC(C)(C)CC2)c(C)c1C ZINC000441491238 1043182865 /nfs/dbraw/zinc/18/28/65/1043182865.db2.gz XMCYOOYACVXHAJ-UHFFFAOYSA-N 0 1 308.491 4.124 20 0 DIADMN Cc1cc(C)c(NC(=O)[C@H](C)[N@@H+](C)CCc2ccccc2)c(C)c1 ZINC000053047887 1043182910 /nfs/dbraw/zinc/18/29/10/1043182910.db2.gz QVCHOEKHOVJICJ-SFHVURJKSA-N 0 1 324.468 4.113 20 0 DIADMN Cc1cc(C)c(NC(=O)[C@H](C)N(C)CCc2ccccc2)c(C)c1 ZINC000053047887 1043182916 /nfs/dbraw/zinc/18/29/16/1043182916.db2.gz QVCHOEKHOVJICJ-SFHVURJKSA-N 0 1 324.468 4.113 20 0 DIADMN COCC[C@H](N[C@@H]1CCCc2c(F)cccc21)c1ccco1 ZINC000866338260 1043182969 /nfs/dbraw/zinc/18/29/69/1043182969.db2.gz ZBPWXKDCEYKCEI-SJORKVTESA-N 0 1 303.377 4.164 20 0 DIADMN C[C@@H]1CCCC[C@@H]1[N@@H+](C)Cc1nc(-c2ccc(F)c(F)c2)no1 ZINC000487392682 1043183412 /nfs/dbraw/zinc/18/34/12/1043183412.db2.gz HJJHCIWHJOVLDP-ABAIWWIYSA-N 0 1 321.371 4.025 20 0 DIADMN Cc1cncc([C@@H](C)N[C@@H]2CCOc3c(Cl)cccc32)c1 ZINC000184320774 1043183202 /nfs/dbraw/zinc/18/32/02/1043183202.db2.gz LLLNSSGJYYATTE-MLGOLLRUSA-N 0 1 302.805 4.218 20 0 DIADMN CC(C)(C)OC1CC(CCN[C@H]2c3ccccc3OC[C@H]2F)C1 ZINC000866348618 1043186503 /nfs/dbraw/zinc/18/65/03/1043186503.db2.gz QYBKUCSXGAKOMR-FLMHQWFMSA-N 0 1 321.436 4.032 20 0 DIADMN CCCN(CCc1cccs1)Cc1csc([C@@H](C)OC)n1 ZINC000184504524 1043186974 /nfs/dbraw/zinc/18/69/74/1043186974.db2.gz AQDMVVKIJZAMOV-CYBMUJFWSA-N 0 1 324.515 4.367 20 0 DIADMN Cc1ccc([C@H](NCc2cn3ccsc3n2)C2CCC2)cc1 ZINC000427583161 1043187123 /nfs/dbraw/zinc/18/71/23/1043187123.db2.gz MDBRHDZVVKIIAP-QGZVFWFLSA-N 0 1 311.454 4.335 20 0 DIADMN CCO[C@H](C)c1noc(C[N@H+]2CCCC3(CCCCC3)CC2)n1 ZINC000190326968 1043189135 /nfs/dbraw/zinc/18/91/35/1043189135.db2.gz IMADYDNIVBLXNJ-OAHLLOKOSA-N 0 1 321.465 4.104 20 0 DIADMN CCO[C@H](C)c1noc(CN2CCCC3(CCCCC3)CC2)n1 ZINC000190326968 1043189142 /nfs/dbraw/zinc/18/91/42/1043189142.db2.gz IMADYDNIVBLXNJ-OAHLLOKOSA-N 0 1 321.465 4.104 20 0 DIADMN Cc1cc(CN[C@H](C)c2cc3c(ccnc3Cl)o2)ccn1 ZINC000866366773 1043189077 /nfs/dbraw/zinc/18/90/77/1043189077.db2.gz SIYDWWGGHWTYGB-LLVKDONJSA-N 0 1 301.777 4.035 20 0 DIADMN CCc1nc(C)c(CN[C@H]2CCc3cccc4cccc2c43)o1 ZINC000866365784 1043190026 /nfs/dbraw/zinc/19/00/26/1043190026.db2.gz XQSVOBKXVLMTAZ-KRWDZBQOSA-N 0 1 306.409 4.476 20 0 DIADMN CCC[C@H](NCc1ccccc1OC(F)F)c1cccnc1 ZINC000184913327 1043190556 /nfs/dbraw/zinc/19/05/56/1043190556.db2.gz ADHXHUGXUODYJL-HNNXBMFYSA-N 0 1 306.356 4.314 20 0 DIADMN COc1cccnc1CN[C@@H]1CCc2cccc3cccc1c32 ZINC000866370160 1043190863 /nfs/dbraw/zinc/19/08/63/1043190863.db2.gz SHLYSIMZYFLYCS-QGZVFWFLSA-N 0 1 304.393 4.021 20 0 DIADMN CCc1nc2c(s1)[C@@H](N[C@@H](CC)c1c(C)noc1C)CCC2 ZINC000090887624 1043192116 /nfs/dbraw/zinc/19/21/16/1043192116.db2.gz KIPKTMXEPVGTSM-STQMWFEESA-N 0 1 319.474 4.429 20 0 DIADMN CC(C)C[C@@H](C)C(=O)Nc1ccc2nc([C@@H]3CCCO3)[nH]c2c1 ZINC000185273095 1043198324 /nfs/dbraw/zinc/19/83/24/1043198324.db2.gz QYJWWBSQSKUAKL-WBMJQRKESA-N 0 1 315.417 4.035 20 0 DIADMN C[C@H](NCc1ccc(C(F)F)cc1)c1nc2ccccc2n1C ZINC000185354492 1043200939 /nfs/dbraw/zinc/20/09/39/1043200939.db2.gz XILCQMFBTBPIGG-LBPRGKRZSA-N 0 1 315.367 4.362 20 0 DIADMN O=C([O-])CC[C@@H]1CCCC[N@H+]1CCC12CC3CC(CC(C3)C1)C2 ZINC000320396793 1043200936 /nfs/dbraw/zinc/20/09/36/1043200936.db2.gz NZUNWHRNHRSBTM-AZRLCKCBSA-N 0 1 319.489 4.312 20 0 DIADMN CCCCc1oc2ccccc2c1C[N@@H+](C)CCCCC(=O)[O-] ZINC000181540743 1043205029 /nfs/dbraw/zinc/20/50/29/1043205029.db2.gz SSGJHWCKHHMDPC-UHFFFAOYSA-N 0 1 317.429 4.462 20 0 DIADMN CC(C)C[C@@H]1CCC[N@H+]1Cc1ccn(-c2ccc(F)cc2)n1 ZINC000441526988 1043206178 /nfs/dbraw/zinc/20/61/78/1043206178.db2.gz XHIXHLVIODDUHS-SFHVURJKSA-N 0 1 301.409 4.022 20 0 DIADMN Cc1cc2c(cc1C)[C@@H](NCc1ccnc(F)c1)CCS2 ZINC000866475338 1043206933 /nfs/dbraw/zinc/20/69/33/1043206933.db2.gz WYKLPOGDAXTLRN-HNNXBMFYSA-N 0 1 302.418 4.164 20 0 DIADMN Cc1cc(Cl)cc2c1OCCC[C@@H]2NCc1ccnc(F)c1 ZINC000866472557 1043207438 /nfs/dbraw/zinc/20/74/38/1043207438.db2.gz BAKRMESZZRPQSZ-HNNXBMFYSA-N 0 1 320.795 4.186 20 0 DIADMN CSc1ccc(C[NH2+][C@H](C(=O)[O-])c2cc(C)cc(C)c2)s1 ZINC000417560978 1043208988 /nfs/dbraw/zinc/20/89/88/1043208988.db2.gz KVJNXESQEBRAST-HNNXBMFYSA-N 0 1 321.467 4.002 20 0 DIADMN COc1ccsc1[C@H](C)NCc1ccc(OC(F)F)cc1 ZINC000186082808 1043213231 /nfs/dbraw/zinc/21/32/31/1043213231.db2.gz YVGHQLBKQWSZBV-JTQLQIEISA-N 0 1 313.369 4.209 20 0 DIADMN COc1ccsc1[C@@H](C)N[C@@H](C)c1cc(OC)ccc1OC ZINC000186085729 1043213380 /nfs/dbraw/zinc/21/33/80/1043213380.db2.gz BGRIEKDZUPFHHZ-NWDGAFQWSA-N 0 1 321.442 4.186 20 0 DIADMN C[C@H](NCc1noc2ccc(F)cc21)c1cc2c(s1)CCC2 ZINC000866510881 1043214432 /nfs/dbraw/zinc/21/44/32/1043214432.db2.gz KJCZOCUWMWTONE-JTQLQIEISA-N 0 1 316.401 4.368 20 0 DIADMN CC[C@@H](N[C@@H](C)c1cnn(C(C)(C)C)c1C)c1c(C)noc1C ZINC000191396902 1043218077 /nfs/dbraw/zinc/21/80/77/1043218077.db2.gz CORUARBMYZXLCL-MEDUHNTESA-N 0 1 318.465 4.353 20 0 DIADMN CO[C@H](CN[C@H](C)c1csc(C(C)C)n1)c1ccccc1 ZINC000186265938 1043218393 /nfs/dbraw/zinc/21/83/93/1043218393.db2.gz AAOITVTVAGLGTH-CZUORRHYSA-N 0 1 304.459 4.305 20 0 DIADMN COc1ccsc1[C@H](C)NCc1ccc(OC(C)(C)C)nc1 ZINC000186280353 1043219252 /nfs/dbraw/zinc/21/92/52/1043219252.db2.gz BSKAAIVCEBYELS-LBPRGKRZSA-N 0 1 320.458 4.180 20 0 DIADMN CC(C)c1nc([C@@H](C)N[C@H](C)C[C@H](O)c2cccs2)cs1 ZINC000186392152 1043222793 /nfs/dbraw/zinc/22/27/93/1043222793.db2.gz QDEQAQHRKBKCBX-BZPMIXESSA-N 0 1 324.515 4.491 20 0 DIADMN Cc1cccc([C@H](NCc2nn(C)cc2C(F)F)C(C)C)c1 ZINC000866567146 1043223563 /nfs/dbraw/zinc/22/35/63/1043223563.db2.gz JTPHMDFEMMYBFW-MRXNPFEDSA-N 0 1 307.388 4.153 20 0 DIADMN Cc1ccc([C@H](NCc2nn(C)cc2C(F)F)C2CCC2)cc1 ZINC000866565553 1043223617 /nfs/dbraw/zinc/22/36/17/1043223617.db2.gz NBHAUDGWVHSCPO-QGZVFWFLSA-N 0 1 319.399 4.297 20 0 DIADMN Cc1cnc([C@@H](C)CN[C@@H](C)c2csc(C(C)C)n2)s1 ZINC000186504117 1043225098 /nfs/dbraw/zinc/22/50/98/1043225098.db2.gz BCPOLJRWZSWMDA-JQWIXIFHSA-N 0 1 309.504 4.486 20 0 DIADMN Cc1ccc(C)c2c1CCC[C@@H]2NCc1nn(C)cc1C(F)F ZINC000866565514 1043225044 /nfs/dbraw/zinc/22/50/44/1043225044.db2.gz MLZYYXFWQLYKKT-HNNXBMFYSA-N 0 1 319.399 4.142 20 0 DIADMN Cc1cnc([C@@H](C)CN[C@H](C)c2csc(C(C)C)n2)s1 ZINC000186504148 1043225262 /nfs/dbraw/zinc/22/52/62/1043225262.db2.gz BCPOLJRWZSWMDA-CMPLNLGQSA-N 0 1 309.504 4.486 20 0 DIADMN Cc1cc(F)ccc1[C@H](C)NCc1ccc(Br)cn1 ZINC000866569439 1043226025 /nfs/dbraw/zinc/22/60/25/1043226025.db2.gz USMLLFNRXQNCNS-NSHDSACASA-N 0 1 323.209 4.142 20 0 DIADMN CC(C)C[C@H](NCc1nn(C)cc1C(F)F)c1ccccc1 ZINC000866567536 1043227410 /nfs/dbraw/zinc/22/74/10/1043227410.db2.gz QBLUUJFHDIHSFE-HNNXBMFYSA-N 0 1 307.388 4.235 20 0 DIADMN CC(C)COc1ccc([C@@H](C)N[C@@H](CCO)c2ccco2)cc1 ZINC000186544159 1043227382 /nfs/dbraw/zinc/22/73/82/1043227382.db2.gz MPAMVVDCKVJQAU-QAPCUYQASA-N 0 1 317.429 4.089 20 0 DIADMN C[C@@H](O)[C@H](N[C@@H](C)c1ccc2c(c1)CCC2)c1ccccc1F ZINC000520593220 1043230308 /nfs/dbraw/zinc/23/03/08/1043230308.db2.gz SGWJDNLKLPBICJ-MNVSYLFESA-N 0 1 313.416 4.087 20 0 DIADMN C[C@@H](c1ccco1)[N@@H+](Cc1ccc(C(=O)[O-])c(Cl)c1)C1CC1 ZINC000520594406 1043230855 /nfs/dbraw/zinc/23/08/55/1043230855.db2.gz KERNVLLKTZWHKO-NSHDSACASA-N 0 1 319.788 4.357 20 0 DIADMN C[C@H](c1ccco1)N(C)Cc1ccc2c(c1)COC(C)(C)O2 ZINC000186613834 1043231181 /nfs/dbraw/zinc/23/11/81/1043231181.db2.gz MKKBOSUOMRWMCV-CYBMUJFWSA-N 0 1 301.386 4.118 20 0 DIADMN Cc1ccccc1[C@@H](C)N[C@@H](c1cnn(C)c1)c1ccc(F)cc1 ZINC000186635389 1043231909 /nfs/dbraw/zinc/23/19/09/1043231909.db2.gz MBZLHLISFUNJTG-FOIQADDNSA-N 0 1 323.415 4.308 20 0 DIADMN Cc1ccccc1[C@H](C)N[C@H](c1cnn(C)c1)c1ccc(F)cc1 ZINC000186635370 1043232071 /nfs/dbraw/zinc/23/20/71/1043232071.db2.gz MBZLHLISFUNJTG-YWZLYKJASA-N 0 1 323.415 4.308 20 0 DIADMN C[C@@H](N[C@@H]1CC=CC[C@H]1C(F)(F)F)c1nc2ccccc2n1C ZINC000866608511 1043233094 /nfs/dbraw/zinc/23/30/94/1043233094.db2.gz GDWHLQZWZQOIJM-JHJVBQTASA-N 0 1 323.362 4.121 20 0 DIADMN C[C@H](N[C@@H]1CCCO[C@H]1c1ccc(Cl)cc1)c1cscn1 ZINC000866607278 1043233142 /nfs/dbraw/zinc/23/31/42/1043233142.db2.gz PRBJDZYBUSQWCB-PEYYIBSZSA-N 0 1 322.861 4.367 20 0 DIADMN Fc1ccc([C@@H](NCc2noc3cc(F)ccc32)C2CC2)cc1 ZINC000866608548 1043233400 /nfs/dbraw/zinc/23/34/00/1043233400.db2.gz CIBQQKUQICYGOG-SFHVURJKSA-N 0 1 314.335 4.347 20 0 DIADMN Fc1ccc2c(c1)onc2CN[C@@H]1CCCc2c(F)cccc21 ZINC000866612220 1043234068 /nfs/dbraw/zinc/23/40/68/1043234068.db2.gz FGVGGTIWNHPNHM-MRXNPFEDSA-N 0 1 314.335 4.273 20 0 DIADMN CC[C@@H](NCc1noc2cc(F)ccc12)c1ccc(OC)cc1 ZINC000866611598 1043234086 /nfs/dbraw/zinc/23/40/86/1043234086.db2.gz VVLCBAOUXOZIND-MRXNPFEDSA-N 0 1 314.360 4.216 20 0 DIADMN Fc1cc(C2CC2)ccc1N[C@@H](c1cccs1)c1nnc[nH]1 ZINC000866610347 1043234981 /nfs/dbraw/zinc/23/49/81/1043234981.db2.gz ZSXAXXUKYCUAHO-HNNXBMFYSA-N 0 1 314.389 4.084 20 0 DIADMN CC(C)[C@H]1C[N@@H+](Cc2cccc(Br)c2)CCS1 ZINC000441621230 1043235272 /nfs/dbraw/zinc/23/52/72/1043235272.db2.gz NXWTWUNYWFAEBB-CQSZACIVSA-N 0 1 314.292 4.023 20 0 DIADMN CC(C)[C@H]1CN(Cc2cccc(Br)c2)CCS1 ZINC000441621230 1043235281 /nfs/dbraw/zinc/23/52/81/1043235281.db2.gz NXWTWUNYWFAEBB-CQSZACIVSA-N 0 1 314.292 4.023 20 0 DIADMN CC(C)c1cccc(C(C)C)c1NC(=O)N(C)Cc1cnc[nH]1 ZINC000665132530 1043237801 /nfs/dbraw/zinc/23/78/01/1043237801.db2.gz FSTTXPSBIUHHNM-UHFFFAOYSA-N 0 1 314.433 4.320 20 0 DIADMN Cc1ccc(CN(Cc2ccco2)C[C@H]2CCCCO2)s1 ZINC000053079425 1043241017 /nfs/dbraw/zinc/24/10/17/1043241017.db2.gz MJZXDDRFFPXGQK-OAHLLOKOSA-N 0 1 305.443 4.221 20 0 DIADMN Cc1ccccc1-c1noc([C@@H]2NCCC[C@H]2c2ccccc2)n1 ZINC001211871008 1043241181 /nfs/dbraw/zinc/24/11/81/1043241181.db2.gz ZDUWKTASIYZLED-ZWKOTPCHSA-N 0 1 319.408 4.253 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ZINC000361753287 1044438175 /nfs/dbraw/zinc/43/81/75/1044438175.db2.gz HTPVLXMUJZMXIQ-MLGOLLRUSA-N 0 1 318.392 4.040 20 0 DIADMN CCCc1ccc([C@H](NCc2cn(C(C)C)nn2)C(C)C)cc1 ZINC000565504850 1044438823 /nfs/dbraw/zinc/43/88/23/1044438823.db2.gz KTLHNPLQTPQDOB-LJQANCHMSA-N 0 1 314.477 4.298 20 0 DIADMN CC(C)c1ncc(CN2C[C@H](C)C[C@H]2c2cccnc2)s1 ZINC000361794831 1044443473 /nfs/dbraw/zinc/44/34/73/1044443473.db2.gz CANQFEWIJOTKKF-CJNGLKHVSA-N 0 1 301.459 4.245 20 0 DIADMN CCc1nc(C)c([C@@H](C)NCc2nc3ccc(C)cc3[nH]2)s1 ZINC000361806433 1044445358 /nfs/dbraw/zinc/44/53/58/1044445358.db2.gz IHDKODIBWJAYFW-LLVKDONJSA-N 0 1 314.458 4.049 20 0 DIADMN CSc1ccc(F)cc1CN[C@H](C)c1sc(C)nc1C ZINC000361805592 1044445736 /nfs/dbraw/zinc/44/57/36/1044445736.db2.gz VXBTZNVRYGRLMQ-SECBINFHSA-N 0 1 310.463 4.472 20 0 DIADMN CCC[C@@H](NCc1cnccn1)c1cccc(C(F)(F)F)c1 ZINC000565643238 1044448614 /nfs/dbraw/zinc/44/86/14/1044448614.db2.gz SVDXOXWNJSLJCB-OAHLLOKOSA-N 0 1 309.335 4.126 20 0 DIADMN Cc1ccc2nc(CN[C@@H]3CCSc4ccccc43)[nH]c2c1 ZINC000361812881 1044449257 /nfs/dbraw/zinc/44/92/57/1044449257.db2.gz NHZMYHXPOMGGFN-CQSZACIVSA-N 0 1 309.438 4.198 20 0 DIADMN CCC[C@@H](NCc1cncn1C)c1ccc(Cl)c(Cl)c1 ZINC000113352963 1044451585 /nfs/dbraw/zinc/45/15/85/1044451585.db2.gz RZVGFQCSQBOYEY-OAHLLOKOSA-N 0 1 312.244 4.358 20 0 DIADMN CCC[C@H](C)C(=O)N1CCC[C@H](c2nc3ccc(C)cc3[nH]2)C1 ZINC000113422157 1044451950 /nfs/dbraw/zinc/45/19/50/1044451950.db2.gz CXBSWDXWPNXBNO-GJZGRUSLSA-N 0 1 313.445 4.014 20 0 DIADMN O=C([O-])c1cc(C[N@H+]2CCC[C@@H]2CCc2ccccc2)cs1 ZINC000565721539 1044451977 /nfs/dbraw/zinc/45/19/77/1044451977.db2.gz QAXRRWLVTHDJJX-MRXNPFEDSA-N 0 1 315.438 4.044 20 0 DIADMN Cn1ccnc1[C@H](NC[C@@H]1CCCC1(C)C)c1cccc(F)c1 ZINC000565897298 1044463184 /nfs/dbraw/zinc/46/31/84/1044463184.db2.gz GPAXGSPGBLBTHD-DOTOQJQBSA-N 0 1 315.436 4.065 20 0 DIADMN C[C@@H](c1cccc(Cl)c1F)N1CC[C@@H](c2ccncc2)C1 ZINC000565900681 1044463499 /nfs/dbraw/zinc/46/34/99/1044463499.db2.gz QYGRJJWWHOQAAN-GXTWGEPZSA-N 0 1 304.796 4.425 20 0 DIADMN Clc1cnn([C@@H]2CCN(Cc3cc4ccccc4s3)C2)c1 ZINC000565924467 1044465716 /nfs/dbraw/zinc/46/57/16/1044465716.db2.gz VFESIBGPECTEFM-CQSZACIVSA-N 0 1 317.845 4.198 20 0 DIADMN CC(C)[C@@H](NCc1cnns1)c1ccc(C(F)(F)F)cc1 ZINC000294863919 1044467340 /nfs/dbraw/zinc/46/73/40/1044467340.db2.gz AJZBGZWIVDFSEO-CYBMUJFWSA-N 0 1 315.364 4.044 20 0 DIADMN c1csc(C2(NCc3ccc4ncccc4c3)CCCC2)n1 ZINC000116374175 1044470634 /nfs/dbraw/zinc/47/06/34/1044470634.db2.gz GWQYAILSPYHKJD-UHFFFAOYSA-N 0 1 309.438 4.250 20 0 DIADMN Cc1ccc2nc(SCc3nnc(C(C)C)s3)[nH]c2c1 ZINC000294912787 1044471311 /nfs/dbraw/zinc/47/13/11/1044471311.db2.gz ILXNYPOWKBHNLY-UHFFFAOYSA-N 0 1 304.444 4.139 20 0 DIADMN CC1=C[C@H](C)C[C@H](CN2CCSC[C@@H]2c2nccs2)C1 ZINC000566041541 1044471838 /nfs/dbraw/zinc/47/18/38/1044471838.db2.gz MUUZWTIGYIMRHT-AEGPPILISA-N 0 1 308.516 4.225 20 0 DIADMN C[C@H](c1ccc(Cl)cc1Cl)[N@H+]1CC[C@@H](C)[C@H](C(=O)[O-])C1 ZINC000566067930 1044472623 /nfs/dbraw/zinc/47/26/23/1044472623.db2.gz JGOITUXCMRJYBC-GIPNMCIBSA-N 0 1 316.228 4.097 20 0 DIADMN COc1cc(CNCc2ccc(C)cc2OC(C)C)ccc1C ZINC000566079392 1044473847 /nfs/dbraw/zinc/47/38/47/1044473847.db2.gz VXZYNFMUVXITCI-UHFFFAOYSA-N 0 1 313.441 4.389 20 0 DIADMN Fc1ccc([C@@H](NCc2cc(F)ncc2F)C2CCC2)cc1 ZINC000294974023 1044476394 /nfs/dbraw/zinc/47/63/94/1044476394.db2.gz GNXAKOPNKJDKLG-KRWDZBQOSA-N 0 1 306.331 4.130 20 0 DIADMN CO[C@@H]1CCN(Cc2nc(-c3ccccc3)cs2)CC1(C)C ZINC000294995881 1044477875 /nfs/dbraw/zinc/47/78/75/1044477875.db2.gz KZPGCJQJMYGNER-MRXNPFEDSA-N 0 1 316.470 4.057 20 0 DIADMN COc1ccc([C@@H](CCC(C)C)NCc2ccc(F)cn2)cc1 ZINC000362125858 1044479489 /nfs/dbraw/zinc/47/94/89/1044479489.db2.gz PYFJSMDIIMDEKH-LJQANCHMSA-N 0 1 316.420 4.496 20 0 DIADMN COCCCC[C@@H](NCc1nc(C)cs1)c1ccccc1 ZINC000348309000 1044480195 /nfs/dbraw/zinc/48/01/95/1044480195.db2.gz SJTQTPNTXGYNRE-MRXNPFEDSA-N 0 1 304.459 4.099 20 0 DIADMN Cc1nnsc1CN1CCCCC[C@@H]1/C=C/c1cccs1 ZINC000566300669 1044480720 /nfs/dbraw/zinc/48/07/20/1044480720.db2.gz IWKLVRUBULFPAF-MYSGNRETSA-N 0 1 319.499 4.366 20 0 DIADMN Cc1cccc(Cl)c1CN[C@H](C)c1ccc([S@](C)=O)cc1 ZINC000295041785 1044482787 /nfs/dbraw/zinc/48/27/87/1044482787.db2.gz SVZAJQIUPNTDNZ-ASSNKEHSSA-N 0 1 321.873 4.237 20 0 DIADMN Cc1ccccc1CN(CCOC(C)(C)C)Cc1ccccn1 ZINC000566306325 1044482724 /nfs/dbraw/zinc/48/27/24/1044482724.db2.gz LZGWGFGKRIYQGI-UHFFFAOYSA-N 0 1 312.457 4.207 20 0 DIADMN COCCN(Cc1csc(-c2ccoc2)n1)[C@H]1CC[C@@H](C)C1 ZINC000362161761 1044484258 /nfs/dbraw/zinc/48/42/58/1044484258.db2.gz KJLLZTRIRRDOGY-CJNGLKHVSA-N 0 1 320.458 4.040 20 0 DIADMN Cc1ccc([C@@H]2[C@@H](C)CCC[N@H+]2CCCCCC(=O)[O-])cc1 ZINC000566361676 1044484513 /nfs/dbraw/zinc/48/45/13/1044484513.db2.gz JSIDEDRJPHYVJW-LPHOPBHVSA-N 0 1 303.446 4.413 20 0 DIADMN CCCC[N@@H+](CC)[C@@H](C(=O)[O-])c1ccc(Cl)cc1Cl ZINC000566358839 1044485289 /nfs/dbraw/zinc/48/52/89/1044485289.db2.gz MPNFIAJMUNTHSX-CYBMUJFWSA-N 0 1 304.217 4.241 20 0 DIADMN CCCC[C@@H](C(=O)[O-])[N@@H+](C)Cc1c2ccccc2oc1CC ZINC000566359270 1044485656 /nfs/dbraw/zinc/48/56/56/1044485656.db2.gz FWXVUFQDKQPXAK-HNNXBMFYSA-N 0 1 303.402 4.070 20 0 DIADMN CC(C)(C)[C@@H]1CCC[N@@H+](CC[C@H](C(=O)[O-])c2ccccc2)CC1 ZINC000566359333 1044485718 /nfs/dbraw/zinc/48/57/18/1044485718.db2.gz IFUKWGCNTXLYFG-MSOLQXFVSA-N 0 1 317.473 4.393 20 0 DIADMN COc1ccc(OC(F)F)c(CN[C@@H](C)c2cccs2)c1 ZINC000118985739 1044486826 /nfs/dbraw/zinc/48/68/26/1044486826.db2.gz YATROKHKWVPJCD-JTQLQIEISA-N 0 1 313.369 4.209 20 0 DIADMN FC(F)(F)c1cnc(CNC[C@@H]2CCCCC2(F)F)s1 ZINC000295068816 1044486940 /nfs/dbraw/zinc/48/69/40/1044486940.db2.gz HDUZKPZJXCMAKF-QMMMGPOBSA-N 0 1 314.323 4.077 20 0 DIADMN COc1ccccc1[C@H](NC[C@H](C)CC(C)C)c1ccccn1 ZINC000566388258 1044486939 /nfs/dbraw/zinc/48/69/39/1044486939.db2.gz YQUHIHXDTADCGH-UZLBHIALSA-N 0 1 312.457 4.451 20 0 DIADMN Cn1cc(CCCN2Cc3ccccc3-c3ccccc3C2)cn1 ZINC000101919571 1044488691 /nfs/dbraw/zinc/48/86/91/1044488691.db2.gz RXYAFYHFTPGVQF-UHFFFAOYSA-N 0 1 317.436 4.036 20 0 DIADMN c1coc(CN(Cc2ccc3ncccc3c2)C[C@H]2CCCO2)c1 ZINC000119075770 1044488919 /nfs/dbraw/zinc/48/89/19/1044488919.db2.gz YKDSGNMGWCOCKS-LJQANCHMSA-N 0 1 322.408 4.009 20 0 DIADMN C[C@H](c1ccc(CN(C)Cc2ccccn2)cc1)C(F)(F)F ZINC000295104191 1044490375 /nfs/dbraw/zinc/49/03/75/1044490375.db2.gz GTMVQUQGSYUJLM-CYBMUJFWSA-N 0 1 308.347 4.379 20 0 DIADMN CC[C@H](C)Oc1cc(C)ccc1CN[C@@H](C)c1cncs1 ZINC000119211552 1044491642 /nfs/dbraw/zinc/49/16/42/1044491642.db2.gz LIPVBVPAZARYOP-KBPBESRZSA-N 0 1 304.459 4.480 20 0 DIADMN CC(C)(C)n1cc(CNC(C)(C)c2cccc(Cl)c2)cn1 ZINC000119372936 1044494021 /nfs/dbraw/zinc/49/40/21/1044494021.db2.gz GSLUGJMCMSUSNQ-UHFFFAOYSA-N 0 1 305.853 4.316 20 0 DIADMN CCn1nccc1CNC1(c2cccc(C(F)(F)F)c2)CCC1 ZINC000119385345 1044494065 /nfs/dbraw/zinc/49/40/65/1044494065.db2.gz WPYYBNZUUCVZFK-UHFFFAOYSA-N 0 1 323.362 4.091 20 0 DIADMN CCc1nc2c(s1)[C@H](NCc1ccc(C)cc1OC)CCC2 ZINC000119839670 1044498185 /nfs/dbraw/zinc/49/81/85/1044498185.db2.gz GIKUCRHXLSNUBF-CQSZACIVSA-N 0 1 316.470 4.190 20 0 DIADMN Cc1ccncc1C[N@@H+](C)Cc1ccc2c(c1)CCC(C)(C)O2 ZINC000475558635 1044499654 /nfs/dbraw/zinc/49/96/54/1044499654.db2.gz KPPXBGLBWOTYMM-UHFFFAOYSA-N 0 1 310.441 4.126 20 0 DIADMN Cc1ccncc1CN(C)Cc1ccc2c(c1)CCC(C)(C)O2 ZINC000475558635 1044499658 /nfs/dbraw/zinc/49/96/58/1044499658.db2.gz KPPXBGLBWOTYMM-UHFFFAOYSA-N 0 1 310.441 4.126 20 0 DIADMN CC[C@@H]1C[C@@H](CNc2ccc(CN(C)C)c(Cl)c2)CCO1 ZINC000475555523 1044500807 /nfs/dbraw/zinc/50/08/07/1044500807.db2.gz QFYMAXFFYIEQRH-XJKSGUPXSA-N 0 1 310.869 4.019 20 0 DIADMN COc1cc(F)c([C@H](C)NCc2csc(C)c2)cc1OC ZINC000295206208 1044500945 /nfs/dbraw/zinc/50/09/45/1044500945.db2.gz PPGKIGVJECCMNJ-NSHDSACASA-N 0 1 309.406 4.064 20 0 DIADMN Cc1ccc(F)c(CN[C@@H](c2cccs2)C(C)(C)CO)c1 ZINC000295255893 1044503065 /nfs/dbraw/zinc/50/30/65/1044503065.db2.gz XJXHIKKPOPNIOU-INIZCTEOSA-N 0 1 307.434 4.045 20 0 DIADMN CC[N@@H+](CC(C)C)[C@H](C(=O)[O-])c1ccc(Cl)c(Cl)c1 ZINC000566684478 1044507228 /nfs/dbraw/zinc/50/72/28/1044507228.db2.gz RUQNBYICKJBZSZ-ZDUSSCGKSA-N 0 1 304.217 4.097 20 0 DIADMN C[C@@H]1CCN(C(=O)c2cnc(-c3ccccc3)[nH]2)[C@@H]2CCCC[C@H]12 ZINC000566703865 1044509216 /nfs/dbraw/zinc/50/92/16/1044509216.db2.gz RHVIIEOHHOAOIH-QGPMSJSTSA-N 0 1 323.440 4.118 20 0 DIADMN Cc1nc2ccc(NC(=O)C[C@@]34CCCC[C@@H]3C4(F)F)cc2[nH]1 ZINC000665796276 1044510018 /nfs/dbraw/zinc/51/00/18/1044510018.db2.gz SWSNZIWZXFKOCZ-HOCLYGCPSA-N 0 1 319.355 4.025 20 0 DIADMN CN(CCC1CCOCC1)Cc1csc(-c2cccs2)n1 ZINC000120653502 1044513617 /nfs/dbraw/zinc/51/36/17/1044513617.db2.gz MAZHLYZPQSDBOS-UHFFFAOYSA-N 0 1 322.499 4.120 20 0 DIADMN c1sc(C2CCCCC2)nc1CN1CCC[C@@H]2COCC[C@H]21 ZINC000362446605 1044513991 /nfs/dbraw/zinc/51/39/91/1044513991.db2.gz ISFMDSUYGBZTMB-NVXWUHKLSA-N 0 1 320.502 4.192 20 0 DIADMN CCC[C@H](N[C@H](C)c1cnn(CC)c1)c1ccc(F)cc1F ZINC000120881158 1044514808 /nfs/dbraw/zinc/51/48/08/1044514808.db2.gz NMPWYIQZCZEGIH-PXAZEXFGSA-N 0 1 307.388 4.373 20 0 DIADMN C[C@@H]1CN(Cc2cccc3cccnc32)C[C@H](c2ccsc2)O1 ZINC000121130131 1044519457 /nfs/dbraw/zinc/51/94/57/1044519457.db2.gz BKCMKIOUICMROZ-RDTXWAMCSA-N 0 1 324.449 4.258 20 0 DIADMN COc1ccc2nc(CN(C)[C@H]3CCc4ccccc43)sc2c1 ZINC000475583798 1044523439 /nfs/dbraw/zinc/52/34/39/1044523439.db2.gz NGOVZCMIDIPOLX-KRWDZBQOSA-N 0 1 324.449 4.424 20 0 DIADMN C[C@H](NCc1ccncc1Cl)c1ccc2ncsc2c1 ZINC000362573082 1044530968 /nfs/dbraw/zinc/53/09/68/1044530968.db2.gz OZQFRLGWJQSFHB-JTQLQIEISA-N 0 1 303.818 4.196 20 0 DIADMN CSCC[C@H](C)N(C)Cc1cc2ccccc2nc1Cl ZINC000134849837 1044532326 /nfs/dbraw/zinc/53/23/26/1044532326.db2.gz NMURLDMOTPGMEN-LBPRGKRZSA-N 0 1 308.878 4.462 20 0 DIADMN Fc1cc(CN[C@H](CC2CCC2)c2ccccc2)c(F)cn1 ZINC000295547382 1044540719 /nfs/dbraw/zinc/54/07/19/1044540719.db2.gz YASBGGHZOGQEIA-QGZVFWFLSA-N 0 1 302.368 4.381 20 0 DIADMN O=C(Nc1ccc2nc[nH]c2c1)c1nc2ccccc2cc1Cl ZINC000362733177 1044547287 /nfs/dbraw/zinc/54/72/87/1044547287.db2.gz JBRWGWXMIZZKQK-UHFFFAOYSA-N 0 1 322.755 4.017 20 0 DIADMN Cc1cnccc1CN[C@H]1CCCOc2cc(Cl)ccc21 ZINC000295702383 1044552876 /nfs/dbraw/zinc/55/28/76/1044552876.db2.gz MOERDQYHOWXPBB-INIZCTEOSA-N 0 1 302.805 4.047 20 0 DIADMN Cc1ccc2nc(CN3CCC[C@H]3c3ccncc3)ccc2c1 ZINC001137215800 1044559426 /nfs/dbraw/zinc/55/94/26/1044559426.db2.gz LVBVSSVJNOUCHY-FQEVSTJZSA-N 0 1 303.409 4.275 20 0 DIADMN CC[C@H](NCc1ccccc1OCCOC)c1ccsc1 ZINC000295823920 1044563441 /nfs/dbraw/zinc/56/34/41/1044563441.db2.gz DKOUCZNCRCJYTF-INIZCTEOSA-N 0 1 305.443 4.014 20 0 DIADMN Cc1ccc(CN(C)Cc2cnc(-c3ccncc3)s2)s1 ZINC000353262610 1044567094 /nfs/dbraw/zinc/56/70/94/1044567094.db2.gz DMHUHJPTQAPWDF-UHFFFAOYSA-N 0 1 315.467 4.207 20 0 DIADMN CC(C)C[C@H]1CCCN1Cc1noc(-c2ccc(F)cc2F)n1 ZINC000444571813 1044567729 /nfs/dbraw/zinc/56/77/29/1044567729.db2.gz KEDFLTWRZHGGTJ-CYBMUJFWSA-N 0 1 321.371 4.025 20 0 DIADMN Cc1ccc(C(C)(C)C[N@@H+](C)Cc2ccsc2C(=O)[O-])cc1 ZINC000567509919 1044571142 /nfs/dbraw/zinc/57/11/42/1044571142.db2.gz RUZYGBGRUFNXPQ-UHFFFAOYSA-N 0 1 317.454 4.164 20 0 DIADMN Cc1ncsc1CSc1nc(C=Cc2ccccc2)n[nH]1 ZINC000567523821 1044573060 /nfs/dbraw/zinc/57/30/60/1044573060.db2.gz PXAVMORGURSMDU-FPLPWBNLSA-N 0 1 314.439 4.032 20 0 DIADMN Cc1nc(F)ccc1CNC(c1ccccc1)c1ccccc1 ZINC000785411900 1044574037 /nfs/dbraw/zinc/57/40/37/1044574037.db2.gz XKWRRDHXMRZKLT-UHFFFAOYSA-N 0 1 306.384 4.408 20 0 DIADMN CN(Cc1nc(C2CCCCC2)cs1)C[C@@H]1CCCOC1 ZINC000444603127 1044574280 /nfs/dbraw/zinc/57/42/80/1044574280.db2.gz PZPJACLUFLOTPU-AWEZNQCLSA-N 0 1 308.491 4.049 20 0 DIADMN CCCNC(=O)c1cccc(CN[C@H](CC)c2ccsc2)c1 ZINC000295917386 1044574581 /nfs/dbraw/zinc/57/45/81/1044574581.db2.gz JMILYRRNDXFJQK-QGZVFWFLSA-N 0 1 316.470 4.129 20 0 DIADMN Clc1ccc2c(n1)CCC[C@@H]2N[C@@H]1CCCc2occc21 ZINC000295917553 1044577279 /nfs/dbraw/zinc/57/72/79/1044577279.db2.gz JPGUXGUIKRMUOH-DZGCQCFKSA-N 0 1 302.805 4.373 20 0 DIADMN Cc1ccc2nc(CN3CCc4cc(C)ccc4C3)ccc2c1 ZINC001137219112 1044577489 /nfs/dbraw/zinc/57/74/89/1044577489.db2.gz ZQYHCNSGWIXSLM-UHFFFAOYSA-N 0 1 302.421 4.410 20 0 DIADMN CC[C@H]1CCCC[C@@H]1NCc1noc(-c2ccc(F)cc2F)n1 ZINC000444631607 1044578707 /nfs/dbraw/zinc/57/87/07/1044578707.db2.gz MFQIJTVERWAMEM-NHYWBVRUSA-N 0 1 321.371 4.073 20 0 DIADMN CC[C@H](O)[C@H]1CCCCN1Cc1nc(C2CCCCC2)cs1 ZINC000444634363 1044580410 /nfs/dbraw/zinc/58/04/10/1044580410.db2.gz ABJIDEDEOZSIGM-SJORKVTESA-N 0 1 322.518 4.316 20 0 DIADMN CCOC[C@@H]1CCCN(Cc2nc(C3CCCCC3)cs2)C1 ZINC000444650016 1044583079 /nfs/dbraw/zinc/58/30/79/1044583079.db2.gz RPLUONVRLYVXLG-OAHLLOKOSA-N 0 1 322.518 4.439 20 0 DIADMN CCOC[C@H]1CCCN(Cc2nc(C3CCCCC3)cs2)C1 ZINC000444650015 1044583559 /nfs/dbraw/zinc/58/35/59/1044583559.db2.gz RPLUONVRLYVXLG-HNNXBMFYSA-N 0 1 322.518 4.439 20 0 DIADMN CCn1cc([C@@H](C)N[C@@H](C)c2ccc(SC)c(OC)c2)cn1 ZINC000296048998 1044583895 /nfs/dbraw/zinc/58/38/95/1044583895.db2.gz VAKCFDKDOQHJNG-QWHCGFSZSA-N 0 1 319.474 4.045 20 0 DIADMN C[C@@H]1C[C@H]1c1ccc(CN[C@H](c2cccs2)C(C)(C)CO)o1 ZINC000296077278 1044586849 /nfs/dbraw/zinc/58/68/49/1044586849.db2.gz RPABXBKTHKZBRT-SUYBPPKGSA-N 0 1 319.470 4.314 20 0 DIADMN CC[C@H](c1ccccc1)N(CC)C(=O)c1cc(C)cc2c[nH]nc21 ZINC000523285657 1044587707 /nfs/dbraw/zinc/58/77/07/1044587707.db2.gz BSZJBZURCKCMNX-GOSISDBHSA-N 0 1 321.424 4.485 20 0 DIADMN Clc1cccc2ccc(CN3CC[C@@]4(C3)CCCCO4)nc12 ZINC001137221081 1044588766 /nfs/dbraw/zinc/58/87/66/1044588766.db2.gz BAJHAMAJGGYVHD-GOSISDBHSA-N 0 1 316.832 4.033 20 0 DIADMN CC[C@H](N[C@H](C)c1cnn(CC)c1)c1cccc(Cl)c1F ZINC000296116596 1044590992 /nfs/dbraw/zinc/59/09/92/1044590992.db2.gz ZVVKXKSCUAWVFQ-ABAIWWIYSA-N 0 1 309.816 4.497 20 0 DIADMN c1cn2c(n1)[C@H](NCCSCc1cccc3ccccc31)CC2 ZINC000296132582 1044592023 /nfs/dbraw/zinc/59/20/23/1044592023.db2.gz VWJDMIRQCHWYCK-GOSISDBHSA-N 0 1 323.465 4.004 20 0 DIADMN Cc1cc([C@H](C)NCc2cccc(N3CCCC3=O)c2)cs1 ZINC000296149706 1044592816 /nfs/dbraw/zinc/59/28/16/1044592816.db2.gz WTJMVQFHSMWCCU-AWEZNQCLSA-N 0 1 314.454 4.034 20 0 DIADMN Cc1n[nH]c(CNCc2ccc(OC3CCCCC3)cc2)c1C ZINC000885959289 1044593334 /nfs/dbraw/zinc/59/33/34/1044593334.db2.gz WTCMDAIMGPQSSA-UHFFFAOYSA-N 0 1 313.445 4.028 20 0 DIADMN CN(Cc1nc(C2CCCCC2)cs1)C1CCC(CO)CC1 ZINC000444663397 1044595016 /nfs/dbraw/zinc/59/50/16/1044595016.db2.gz OOAYLFKQMYFRHS-UHFFFAOYSA-N 0 1 322.518 4.174 20 0 DIADMN CCN(Cc1nc(Cc2ccccc2)no1)[C@H]1CCCC[C@H]1C ZINC000444672762 1044597128 /nfs/dbraw/zinc/59/71/28/1044597128.db2.gz ZZELQXXABFWPAO-WBVHZDCISA-N 0 1 313.445 4.061 20 0 DIADMN CC[C@@H]1CCCC[C@@H]1N(C)Cc1noc(-c2ccsc2)n1 ZINC000444669550 1044597201 /nfs/dbraw/zinc/59/72/01/1044597201.db2.gz DPKZUUVRHYDUMY-OCCSQVGLSA-N 0 1 305.447 4.199 20 0 DIADMN CC1(C)CCC(C[N@H+]2C[C@H](C(=O)[O-])[C@@H](c3ccccc3)C2)CC1 ZINC000567988880 1044597300 /nfs/dbraw/zinc/59/73/00/1044597300.db2.gz RHYYFTOJTWGZOC-MSOLQXFVSA-N 0 1 315.457 4.003 20 0 DIADMN OC[C@@H](NCc1ccc(-c2cccs2)cc1)c1ccsc1 ZINC000444675029 1044598492 /nfs/dbraw/zinc/59/84/92/1044598492.db2.gz QIINYDJOSJFKNK-MRXNPFEDSA-N 0 1 315.463 4.300 20 0 DIADMN C[C@@H]1C[C@H](c2ccccc2)C[N@H+]1CC[C@H](C(=O)[O-])c1ccccc1 ZINC000568062659 1044598824 /nfs/dbraw/zinc/59/88/24/1044598824.db2.gz LEJAAUKEVOFLTF-UXPWSPDFSA-N 0 1 323.436 4.123 20 0 DIADMN Cc1cc([C@H](C)[N@H+]2CCC[C@@]3(CC=CCC3)C2)oc1C(=O)[O-] ZINC000568062998 1044600019 /nfs/dbraw/zinc/60/00/19/1044600019.db2.gz YNUQBKYWRKFZKA-KSSFIOAISA-N 0 1 303.402 4.170 20 0 DIADMN C[C@H]1CC(C)(C)C[N@H+]1[C@H](C(=O)[O-])c1cccc(Cl)c1Cl ZINC000568062714 1044600372 /nfs/dbraw/zinc/60/03/72/1044600372.db2.gz MOQNEEZCQTWYCG-ZANVPECISA-N 0 1 316.228 4.240 20 0 DIADMN CC[C@@H](N[C@H](COC)c1ccc(F)c(F)c1)c1ccsc1 ZINC000296238493 1044600759 /nfs/dbraw/zinc/60/07/59/1044600759.db2.gz ARJIRCITGLDOKZ-HZPDHXFCSA-N 0 1 311.397 4.455 20 0 DIADMN C[C@H](NCCO[C@H]1CCCCO1)c1cc(Cl)ccc1Cl ZINC000444679189 1044601131 /nfs/dbraw/zinc/60/11/31/1044601131.db2.gz ZMFVJPWMFOTZBM-NHYWBVRUSA-N 0 1 318.244 4.187 20 0 DIADMN Cc1oc(C[N@@H+]2CC[C@H](c3ccccc3)C[C@H]2C)cc1C(=O)[O-] ZINC000568066942 1044602443 /nfs/dbraw/zinc/60/24/43/1044602443.db2.gz HZWWCAMYINIZCH-CJNGLKHVSA-N 0 1 313.397 4.054 20 0 DIADMN CCn1cc([C@@H](C)NCc2ccc(OC(C)C)c(Cl)c2)cn1 ZINC000296254729 1044603322 /nfs/dbraw/zinc/60/33/22/1044603322.db2.gz XOUOGECSUGPJMX-CYBMUJFWSA-N 0 1 321.852 4.194 20 0 DIADMN C[C@@]1(NCc2nc(C3CCCCC3)cs2)CCO[C@H]1C1CC1 ZINC000444690399 1044603594 /nfs/dbraw/zinc/60/35/94/1044603594.db2.gz SJABFQCNZMQGMK-ZWKOTPCHSA-N 0 1 320.502 4.238 20 0 DIADMN CN(Cc1nc2ccc(F)cc2o1)CC1(c2ccccc2)CC1 ZINC000444688714 1044603775 /nfs/dbraw/zinc/60/37/75/1044603775.db2.gz KKTPCPHVWAZSCX-UHFFFAOYSA-N 0 1 310.372 4.131 20 0 DIADMN FC(F)(F)[C@H](CNCc1ccc(Cl)cn1)c1ccccc1 ZINC000886069937 1044604501 /nfs/dbraw/zinc/60/45/01/1044604501.db2.gz MLYJZZSNZOWEQP-CQSZACIVSA-N 0 1 314.738 4.171 20 0 DIADMN CC(C)Sc1ccc(CN[C@H](CO)c2ccc(F)cc2)cc1 ZINC000568128271 1044604566 /nfs/dbraw/zinc/60/45/66/1044604566.db2.gz MRNOHBGYAFCWCP-GOSISDBHSA-N 0 1 319.445 4.149 20 0 DIADMN c1nnsc1CN[C@H](CC1CCCCC1)c1ccccc1 ZINC000296289757 1044605855 /nfs/dbraw/zinc/60/58/55/1044605855.db2.gz LRPRLLZERHIONJ-QGZVFWFLSA-N 0 1 301.459 4.339 20 0 DIADMN Cc1[nH]nc(CNc2ccc(Br)c(Cl)c2)c1C ZINC000886099552 1044606629 /nfs/dbraw/zinc/60/66/29/1044606629.db2.gz ZIZZLQNTNADHOP-UHFFFAOYSA-N 0 1 314.614 4.055 20 0 DIADMN CCOc1ccc([C@@H](C)NCc2c(C)nsc2C)cc1OC ZINC000568167484 1044608183 /nfs/dbraw/zinc/60/81/83/1044608183.db2.gz HFSUPTRJYUWIQD-LLVKDONJSA-N 0 1 320.458 4.018 20 0 DIADMN Cc1cc(C)cc(CN(C)[C@@H](C)C(=O)Nc2c(C)cccc2C)c1 ZINC000444708135 1044608265 /nfs/dbraw/zinc/60/82/65/1044608265.db2.gz YZSHOAUPXAGAJQ-SFHVURJKSA-N 0 1 324.468 4.379 20 0 DIADMN C[C@@H](N[C@H]1CCn2ccnc21)c1ccc(Cl)c2ccccc21 ZINC000296335797 1044610189 /nfs/dbraw/zinc/61/01/89/1044610189.db2.gz GPYVLDGJBSJONP-PXAZEXFGSA-N 0 1 311.816 4.485 20 0 DIADMN CC(C)OCc1ccccc1CN[C@@H](C)c1cn2ccccc2n1 ZINC000568238466 1044610179 /nfs/dbraw/zinc/61/01/79/1044610179.db2.gz VNUBIBGYQKPWOI-INIZCTEOSA-N 0 1 323.440 4.110 20 0 DIADMN Cc1ccc([C@H](C)N(C)C(=O)c2cc(-c3ccoc3)[nH]n2)c(C)c1 ZINC000523356313 1044612801 /nfs/dbraw/zinc/61/28/01/1044612801.db2.gz RPIOQUBMXHGSHL-AWEZNQCLSA-N 0 1 323.396 4.120 20 0 DIADMN Cc1nnsc1[C@H](C)N[C@@H](C)c1cccc(C(F)(F)F)c1 ZINC000930183438 1044613307 /nfs/dbraw/zinc/61/33/07/1044613307.db2.gz PUFOETLJBCKTEI-IUCAKERBSA-N 0 1 315.364 4.277 20 0 DIADMN CCc1ccccc1C[N@H+]1C[C@H](C2CCCCC2)C[C@@H]1C(=O)[O-] ZINC000568290931 1044615370 /nfs/dbraw/zinc/61/53/70/1044615370.db2.gz VSVBXQHTNWSQRQ-RTBURBONSA-N 0 1 315.457 4.104 20 0 DIADMN CC1=CCCN(Cc2cnn(-c3ccc(C(F)(F)F)cc3)c2)C1 ZINC000348364064 1044616621 /nfs/dbraw/zinc/61/66/21/1044616621.db2.gz RUIXBAVMFONKLN-UHFFFAOYSA-N 0 1 321.346 4.043 20 0 DIADMN c1sc(C2CCCCC2)nc1CN1CC[C@@H]([C@H]2CCOC2)C1 ZINC000363451928 1044618653 /nfs/dbraw/zinc/61/86/53/1044618653.db2.gz YTOBXHUIIDHEPU-CVEARBPZSA-N 0 1 320.502 4.049 20 0 DIADMN CC[C@H](C)c1nc([C@H](C)N[C@@H](C)c2ccc3c(c2)CCC3)n[nH]1 ZINC000568345323 1044619048 /nfs/dbraw/zinc/61/90/48/1044619048.db2.gz LYPJCMYPPFUKPC-IHRRRGAJSA-N 0 1 312.461 4.219 20 0 DIADMN CC[C@H](C)c1nc([C@@H](C)N[C@@H](C)c2ccc3c(c2)CCC3)n[nH]1 ZINC000568345324 1044619655 /nfs/dbraw/zinc/61/96/55/1044619655.db2.gz LYPJCMYPPFUKPC-MELADBBJSA-N 0 1 312.461 4.219 20 0 DIADMN FC(F)[C@@H]1CCCN(Cc2ccc3cccc(Cl)c3n2)C1 ZINC001137226464 1044620347 /nfs/dbraw/zinc/62/03/47/1044620347.db2.gz QXKARIMZIKIGLR-GFCCVEGCSA-N 0 1 310.775 4.365 20 0 DIADMN CC(C)[C@@H]1CCCN([C@@H](C)c2nnc(-c3cccs3)o2)C1 ZINC000444764669 1044621125 /nfs/dbraw/zinc/62/11/25/1044621125.db2.gz BPIDKGGGKKEWSP-QWHCGFSZSA-N 0 1 305.447 4.227 20 0 DIADMN Cc1nc(C)c([C@H](C)NCc2ccnc(C(F)(F)F)c2)s1 ZINC000296500226 1044622371 /nfs/dbraw/zinc/62/23/71/1044622371.db2.gz PARRCHAWHNGPAI-QMMMGPOBSA-N 0 1 315.364 4.025 20 0 DIADMN Cc1[nH]nc(CNc2ccc([C@H](F)C(F)(F)F)cc2)c1C ZINC000886187764 1044624746 /nfs/dbraw/zinc/62/47/46/1044624746.db2.gz BJZFUIQEOYGQAN-ZDUSSCGKSA-N 0 1 301.287 4.212 20 0 DIADMN FC(F)(F)c1cccc(CN[C@@H](c2cccnc2)C2CCC2)n1 ZINC000296572599 1044629571 /nfs/dbraw/zinc/62/95/71/1044629571.db2.gz SZBHZZSKTKQEAL-MRXNPFEDSA-N 0 1 321.346 4.126 20 0 DIADMN FC(F)COCCN1CCCC[C@@H]1c1cccc(Cl)c1 ZINC000444795303 1044630536 /nfs/dbraw/zinc/63/05/36/1044630536.db2.gz LYXNMQNZJVZOJL-CQSZACIVSA-N 0 1 303.780 4.149 20 0 DIADMN CC(C)[C@H](CC(F)(F)F)N=c1nc(-c2ccccc2)[nH]s1 ZINC000444822986 1044630937 /nfs/dbraw/zinc/63/09/37/1044630937.db2.gz ADSGQBWSJADIEM-NSHDSACASA-N 0 1 315.364 4.016 20 0 DIADMN Cc1cc(Cl)nc(CN[C@@H]2CCCc3nc(Cl)ccc32)c1 ZINC000296597854 1044630965 /nfs/dbraw/zinc/63/09/65/1044630965.db2.gz XJAPKIKZONDYHF-CYBMUJFWSA-N 0 1 322.239 4.259 20 0 DIADMN CCCCC[C@H](NCc1n[nH]c(C(C)C)n1)c1ccccc1 ZINC000296589176 1044632070 /nfs/dbraw/zinc/63/20/70/1044632070.db2.gz UVZSRUBCKPGDOU-INIZCTEOSA-N 0 1 300.450 4.339 20 0 DIADMN O=C1CCC(CN(Cc2c(F)cccc2F)C2CCCC2)CC1 ZINC000568566648 1044635566 /nfs/dbraw/zinc/63/55/66/1044635566.db2.gz VIOWTJFGQFTSIF-UHFFFAOYSA-N 0 1 321.411 4.469 20 0 DIADMN CCCc1nc(CN(C)[C@H](C)Cc2ccc(C)cc2)cs1 ZINC000523440331 1044637602 /nfs/dbraw/zinc/63/76/02/1044637602.db2.gz FISCFZXGFJLMAM-OAHLLOKOSA-N 0 1 302.487 4.467 20 0 DIADMN Fc1ccccc1[C@@H]1CN([C@H]2CCCc3ccccc32)CCO1 ZINC000523442338 1044639070 /nfs/dbraw/zinc/63/90/70/1044639070.db2.gz XGVYAPFCSCRFCV-PMACEKPBSA-N 0 1 311.400 4.277 20 0 DIADMN Cc1cc([C@H](C)NCc2cccc3c2OCCCO3)cs1 ZINC000296696930 1044642006 /nfs/dbraw/zinc/64/20/06/1044642006.db2.gz HLWSPWJZKRGCQQ-ZDUSSCGKSA-N 0 1 303.427 4.069 20 0 DIADMN CN(Cc1cc(C(C)(C)C)n[nH]1)c1ccnc2cc(F)ccc21 ZINC000444865638 1044642843 /nfs/dbraw/zinc/64/28/43/1044642843.db2.gz PQLDPTGPMHVTBP-UHFFFAOYSA-N 0 1 312.392 4.031 20 0 DIADMN C[C@@H]1Oc2ccccc2[C@@H]1NCc1ccc(OC(F)(F)F)cc1 ZINC000568689912 1044644510 /nfs/dbraw/zinc/64/45/10/1044644510.db2.gz WUXZBBVQXZHZLB-MEDUHNTESA-N 0 1 323.314 4.197 20 0 DIADMN CC(C)[C@@H](N[C@@H]1CCn2ccnc21)c1ccc(C(F)(F)F)cc1 ZINC000296717170 1044644640 /nfs/dbraw/zinc/64/46/40/1044644640.db2.gz 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1 307.369 4.113 20 0 DIADMN CCc1nc(C)c(CSc2n[nH]c(CCC3CCCC3)n2)o1 ZINC000450761127 1045566358 /nfs/dbraw/zinc/56/63/58/1045566358.db2.gz MQMXANVMJFKISZ-UHFFFAOYSA-N 0 1 320.462 4.079 20 0 DIADMN CCc1nc(C)c(CSc2nc(CCC3CCCC3)n[nH]2)o1 ZINC000450761127 1045566366 /nfs/dbraw/zinc/56/63/66/1045566366.db2.gz MQMXANVMJFKISZ-UHFFFAOYSA-N 0 1 320.462 4.079 20 0 DIADMN FC1(F)CC(CSc2nc(C=Cc3ccccc3)n[nH]2)C1 ZINC000450797719 1045566442 /nfs/dbraw/zinc/56/64/42/1045566442.db2.gz UUFNZWRDUCPBEP-SREVYHEPSA-N 0 1 307.369 4.113 20 0 DIADMN FC(F)(F)c1cc(CN2CC[C@H]3CC[C@@H](C2)S3)cs1 ZINC000628423307 1045581806 /nfs/dbraw/zinc/58/18/06/1045581806.db2.gz MSVRZQAWVHYQGO-MNOVXSKESA-N 0 1 307.406 4.237 20 0 DIADMN Clc1nccc(CN[C@@H]2CCO[C@H]2c2ccccc2)c1Cl ZINC000278487324 1045574409 /nfs/dbraw/zinc/57/44/09/1045574409.db2.gz BERQKHJWVYWMTG-HIFRSBDPSA-N 0 1 323.223 4.008 20 0 DIADMN CCN(Cc1c[nH]c2ccccc12)Cc1cccc(C(C)=O)c1 ZINC000450836387 1045579146 /nfs/dbraw/zinc/57/91/46/1045579146.db2.gz YSTKOQTZDWNYGX-UHFFFAOYSA-N 0 1 306.409 4.393 20 0 DIADMN Cc1ccccc1-c1ccccc1-c1nc([C@H]2CCCN2)no1 ZINC000900009189 1045588920 /nfs/dbraw/zinc/58/89/20/1045588920.db2.gz CYVJJHUPRJROIM-QGZVFWFLSA-N 0 1 305.381 4.137 20 0 DIADMN Clc1ccc2c(c1)[C@H](NCc1cnc3ccccc3n1)CCC2 ZINC000628495404 1045590033 /nfs/dbraw/zinc/59/00/33/1045590033.db2.gz PYAKIQHMPYFHHN-QGZVFWFLSA-N 0 1 323.827 4.450 20 0 DIADMN Cc1ccc([C@H]2CCN(Cc3nnc(C4CC4)s3)C2)c(C)c1 ZINC000450890458 1045590534 /nfs/dbraw/zinc/59/05/34/1045590534.db2.gz VRDOPEKKAFJIHM-HNNXBMFYSA-N 0 1 313.470 4.022 20 0 DIADMN C[C@H](C(=O)NOCc1ccccc1)c1c(Cl)cccc1Cl ZINC000751302489 1045599810 /nfs/dbraw/zinc/59/98/10/1045599810.db2.gz KVSOPEUSYAUZLQ-NSHDSACASA-N 0 1 324.207 4.345 20 0 DIADMN Cc1sc([C@@H]2CN3CCC[C@H]3CO2)nc1C1CCCCC1 ZINC000450965839 1045601857 /nfs/dbraw/zinc/60/18/57/1045601857.db2.gz ICSILUSCXGOURH-GJZGRUSLSA-N 0 1 306.475 4.035 20 0 DIADMN CC=C(C)C(=O)Nc1ccc(-c2nc3ccc(F)cc3[nH]2)cc1 ZINC000751372076 1045604074 /nfs/dbraw/zinc/60/40/74/1045604074.db2.gz BGDIEYGCKAJRMT-QDEBKDIKSA-N 0 1 309.344 4.274 20 0 DIADMN FC(F)OC[C@@H]1CCN(CCc2c(Cl)cccc2Cl)C1 ZINC000450989227 1045604085 /nfs/dbraw/zinc/60/40/85/1045604085.db2.gz DFXSKGNPQVZSLU-SNVBAGLBSA-N 0 1 324.198 4.097 20 0 DIADMN CCc1ccc([C@H](CC(C)C)[N@H+]2CC[C@@H](C(=O)[O-])[C@@H]2C)cc1 ZINC000530166365 1045605653 /nfs/dbraw/zinc/60/56/53/1045605653.db2.gz ORDGLBRYVXHVCS-QGTPRVQTSA-N 0 1 303.446 4.131 20 0 DIADMN CCSc1cccc(CNCc2cc(C)cc(Cl)n2)c1 ZINC000800285470 1045606470 /nfs/dbraw/zinc/60/64/70/1045606470.db2.gz JWTYOIMHDYSCSF-UHFFFAOYSA-N 0 1 306.862 4.445 20 0 DIADMN CCCC[C@H](CC)C[N@H+]1CCc2c(F)ccc(C(=O)[O-])c2C1 ZINC000530167657 1045606493 /nfs/dbraw/zinc/60/64/93/1045606493.db2.gz GOWNICJMPTXNAL-ZDUSSCGKSA-N 0 1 307.409 4.098 20 0 DIADMN CC(C)(C)C1CCC(C[N@H+]2CCc3occc3[C@@H]2C(=O)[O-])CC1 ZINC000530166475 1045606529 /nfs/dbraw/zinc/60/65/29/1045606529.db2.gz NKZCIPYMQDPNGJ-MQBCKMQZSA-N 0 1 319.445 4.116 20 0 DIADMN C(N1CCCC[C@@H]1c1nnc(C2CCC2)o1)C12CCC(CC1)C2 ZINC000451006235 1045608044 /nfs/dbraw/zinc/60/80/44/1045608044.db2.gz VBDQVFWCKBSGGC-NLGTXKQRSA-N 0 1 315.461 4.444 20 0 DIADMN CC(C)Oc1ccccc1[C@H](C)NCc1ccc(Cl)nc1 ZINC000751504107 1045608899 /nfs/dbraw/zinc/60/88/99/1045608899.db2.gz ZLGIOCJEJQNMGM-ZDUSSCGKSA-N 0 1 304.821 4.373 20 0 DIADMN Cc1ccc2[nH]c([C@H]3CCC[N@H+]3C[C@H]3CCC(F)(F)C3)nc2c1 ZINC000451011447 1045610339 /nfs/dbraw/zinc/61/03/39/1045610339.db2.gz CTKKBSCLGVONIM-XJKSGUPXSA-N 0 1 319.399 4.444 20 0 DIADMN Cc1cc([C@@H](C)[N@H+](C)C[C@@H](C)C2CCCCC2)oc1C(=O)[O-] ZINC000530172319 1045614030 /nfs/dbraw/zinc/61/40/30/1045614030.db2.gz GUBSYRCOIJJKEQ-ZIAGYGMSSA-N 0 1 307.434 4.495 20 0 DIADMN C[C@@H]1C[C@@H](C(=O)[O-])C[C@H](C)[N@@H+]1CCCCc1cccc(Cl)c1 ZINC000530172616 1045614216 /nfs/dbraw/zinc/61/42/16/1045614216.db2.gz JKNHQAZXTPEJPC-MIFYACCESA-N 0 1 323.864 4.236 20 0 DIADMN Cc1ccc2ccccc2c1C[N@@H+]1[C@H](C)C[C@@H](C(=O)[O-])C[C@@H]1C ZINC000530173983 1045614595 /nfs/dbraw/zinc/61/45/95/1045614595.db2.gz HGERAWVFWAPFOU-SCAQPMJSSA-N 0 1 311.425 4.222 20 0 DIADMN C[C@@H]1C[C@@H](C(=O)[O-])C[C@H](C)[N@@H+]1Cc1ccc(C(C)(C)C)cc1 ZINC000530175124 1045616452 /nfs/dbraw/zinc/61/64/52/1045616452.db2.gz FCXXVHXDJUMCFG-MIFYACCESA-N 0 1 303.446 4.058 20 0 DIADMN CCCc1ccc(S(=O)(=O)Nc2scnc2C(C)C)cc1 ZINC000451110263 1045626515 /nfs/dbraw/zinc/62/65/15/1045626515.db2.gz XMGPPOOVWQPTMY-UHFFFAOYSA-N 0 1 324.471 4.020 20 0 DIADMN COc1cc([C@@H](C)NCc2cc(C)cc(Cl)n2)ccc1F ZINC000800492541 1045631905 /nfs/dbraw/zinc/63/19/05/1045631905.db2.gz KVDQABZGOFQSFC-LLVKDONJSA-N 0 1 308.784 4.042 20 0 DIADMN CCC[C@@H](C)N(C)Cc1cnc(NC(=O)OC(C)(C)C)s1 ZINC000800507224 1045637606 /nfs/dbraw/zinc/63/76/06/1045637606.db2.gz LNJWPZPWPXEQQG-LLVKDONJSA-N 0 1 313.467 4.111 20 0 DIADMN CC(C)[C@]1(C(=O)[O-])CC[N@H+](C(c2ccccc2)c2ccccc2)C1 ZINC000392231419 1045644316 /nfs/dbraw/zinc/64/43/16/1045644316.db2.gz RVUKIDLOMCPQMP-NRFANRHFSA-N 0 1 323.436 4.209 20 0 DIADMN Cc1nc(S[C@H](C)C2CCOCC2)[nH]c1-c1ccccc1 ZINC000629175930 1045648056 /nfs/dbraw/zinc/64/80/56/1045648056.db2.gz SJSFKDRKFHJAKL-CYBMUJFWSA-N 0 1 302.443 4.292 20 0 DIADMN Cc1nc(S[C@@H](C)C2CCOCC2)[nH]c1-c1ccccc1 ZINC000629175935 1045648830 /nfs/dbraw/zinc/64/88/30/1045648830.db2.gz SJSFKDRKFHJAKL-ZDUSSCGKSA-N 0 1 302.443 4.292 20 0 DIADMN CC1=C(C(=O)N(C)Cc2cc(C(C)(C)C)[nH]n2)CCC(C)(C)C1 ZINC000451227174 1045650492 /nfs/dbraw/zinc/65/04/92/1045650492.db2.gz NJRYLLHPQQTIFV-UHFFFAOYSA-N 0 1 317.477 4.192 20 0 DIADMN CC(C)CO[C@@H](C)c1noc(CN2CCC[C@@]2(C)CC(C)C)n1 ZINC000451287558 1045658697 /nfs/dbraw/zinc/65/86/97/1045658697.db2.gz GIWUIHXYSSSENX-YJBOKZPZSA-N 0 1 323.481 4.204 20 0 DIADMN CC(C)N1CCC[C@H]1C(=O)Nc1cccc(Oc2ccccc2)c1 ZINC001124357117 1045662744 /nfs/dbraw/zinc/66/27/44/1045662744.db2.gz MAXYHQOWZDEHIV-IBGZPJMESA-N 0 1 324.424 4.290 20 0 DIADMN Cc1cc2oc(=O)cc(CN[C@H](C)c3ccsc3)c2cc1C ZINC000800882593 1045663085 /nfs/dbraw/zinc/66/30/85/1045663085.db2.gz LXHUTHQZHIUBQG-CYBMUJFWSA-N 0 1 313.422 4.322 20 0 DIADMN CS[C@H]1CCN(Cc2nc(-c3ccccc3Cl)cs2)C1 ZINC000451323675 1045663527 /nfs/dbraw/zinc/66/35/27/1045663527.db2.gz JCEUNGAGACSHHG-NSHDSACASA-N 0 1 324.902 4.401 20 0 DIADMN CC(C)CCC[C@@H](C)NC(=O)c1n[nH]c2ccc(Cl)cc21 ZINC001124360796 1045664857 /nfs/dbraw/zinc/66/48/57/1045664857.db2.gz OFGKIFYSIYNEKB-LLVKDONJSA-N 0 1 307.825 4.161 20 0 DIADMN O=C([O-])c1sc2ccccc2c1C[N@H+]1CCCC2(CC2)CC1 ZINC000629378047 1045665232 /nfs/dbraw/zinc/66/52/32/1045665232.db2.gz MFBAMEQMDDPAQR-UHFFFAOYSA-N 0 1 315.438 4.366 20 0 DIADMN C/C=C\C[C@@H]1CCC[N@@H+](Cc2c(Cl)cccc2C(=O)[O-])C1 ZINC000629375069 1045665550 /nfs/dbraw/zinc/66/55/50/1045665550.db2.gz BCXWBTAXAOIURQ-XQJDBVBESA-N 0 1 307.821 4.216 20 0 DIADMN C[C@H](N[C@H](c1ccc(F)c(Cl)c1)C1CC1)c1cnccn1 ZINC000451353401 1045669236 /nfs/dbraw/zinc/66/92/36/1045669236.db2.gz JQKRDMOSHGTGCM-QFYYESIMSA-N 0 1 305.784 4.071 20 0 DIADMN Cc1cccc(C)c1NC(=O)[C@H](C)N1CCC(C(C)(C)C)CC1 ZINC000530461826 1045671089 /nfs/dbraw/zinc/67/10/89/1045671089.db2.gz TWCBCVMFSSEFPY-INIZCTEOSA-N 0 1 316.489 4.389 20 0 DIADMN Cc1cnc([C@@H](C)N[C@@H](c2ccc(F)c(Cl)c2)C2CC2)cn1 ZINC000451359958 1045671340 /nfs/dbraw/zinc/67/13/40/1045671340.db2.gz XLNBBFPURPMWMF-PIGZYNQJSA-N 0 1 319.811 4.379 20 0 DIADMN CC(C)c1ccc(C[N@H+]2CC[C@@H](C(=O)[O-])[C@H](C)C2)c(C(C)C)c1 ZINC000629495546 1045672737 /nfs/dbraw/zinc/67/27/37/1045672737.db2.gz IVTMEMNXMAACAS-CRAIPNDOSA-N 0 1 317.473 4.476 20 0 DIADMN CC[C@@H](C)c1ccccc1NC(=O)[C@@H](C)N1CCC(CF)CC1 ZINC000451389654 1045672615 /nfs/dbraw/zinc/67/26/15/1045672615.db2.gz VVYQGIRXISWDSW-HUUCEWRRSA-N 0 1 320.452 4.209 20 0 DIADMN O=C(NC1CCCCCCC1)c1ccc(CN2CCCCC2)o1 ZINC001124378913 1045673469 /nfs/dbraw/zinc/67/34/69/1045673469.db2.gz VRHHZOMCYPHTFK-UHFFFAOYSA-N 0 1 318.461 4.108 20 0 DIADMN Cc1c(C(=O)Oc2cccc3ccccc32)ccc2cncn21 ZINC001124378849 1045673486 /nfs/dbraw/zinc/67/34/86/1045673486.db2.gz ZSCGKCQFKOZAIQ-UHFFFAOYSA-N 0 1 302.333 4.015 20 0 DIADMN O=C(Nc1ccc(-c2ccccc2)cc1)c1cccc(F)c1O ZINC001124402346 1045679912 /nfs/dbraw/zinc/67/99/12/1045679912.db2.gz DEGSCKLJJHSPOO-UHFFFAOYSA-N 0 1 307.324 4.451 20 0 DIADMN Cc1cccc(C(C)C)c1NC(=O)[C@H]1c2cn[nH]c2CC[C@@H]1C ZINC000900941349 1045686705 /nfs/dbraw/zinc/68/67/05/1045686705.db2.gz KWRSPQGNAYRJHW-YVEFUNNKSA-N 0 1 311.429 4.146 20 0 DIADMN CCO[C@@H]1CCN([C@@H](C)c2ncc(-c3ccccc3)o2)C[C@H]1C ZINC000451542083 1045694160 /nfs/dbraw/zinc/69/41/60/1045694160.db2.gz MXJMJPQCCRCZMU-HLLBOEOZSA-N 0 1 314.429 4.150 20 0 DIADMN CCC[C@H](c1nc([C@@H]2CCCN2)no1)c1cccc(Cl)c1 ZINC000629675421 1045695153 /nfs/dbraw/zinc/69/51/53/1045695153.db2.gz SHMZPLAVAPHJHJ-KBPBESRZSA-N 0 1 305.809 4.080 20 0 DIADMN FC(F)(F)c1ccccc1-c1ccc([C@H]2COCCN2)cc1 ZINC000629690755 1045695263 /nfs/dbraw/zinc/69/52/63/1045695263.db2.gz MQKLNLBOFIQFKW-MRXNPFEDSA-N 0 1 307.315 4.033 20 0 DIADMN CCCCc1ccc(N(C)C(=O)c2cccc3c[nH]nc32)cc1 ZINC000752708801 1045698080 /nfs/dbraw/zinc/69/80/80/1045698080.db2.gz 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304.796 4.172 20 0 DIADMN CCOc1ccc(CN[C@H](C)c2ccc(C(F)(F)F)cn2)cc1 ZINC000902766178 1046065727 /nfs/dbraw/zinc/06/57/27/1046065727.db2.gz YHLDPAUGLLGMSN-GFCCVEGCSA-N 0 1 324.346 4.350 20 0 DIADMN C[C@@H](NCCOC1CCCCC1)c1ccc(C(F)(F)F)cn1 ZINC000902775735 1046067745 /nfs/dbraw/zinc/06/77/45/1046067745.db2.gz AHCLHSUBOQGBGL-GFCCVEGCSA-N 0 1 316.367 4.100 20 0 DIADMN Cc1nn(C)cc1[C@@H](C)N[C@H](C)c1ccc(C(F)(F)F)s1 ZINC000902789579 1046069602 /nfs/dbraw/zinc/06/96/02/1046069602.db2.gz ICPKJTICDONUOQ-PSASIEDQSA-N 0 1 317.380 4.221 20 0 DIADMN CCCn1cc([C@@H](C)N[C@@H](c2ccccc2C)C(C)C)nn1 ZINC000902799949 1046071923 /nfs/dbraw/zinc/07/19/23/1046071923.db2.gz IFJZPTVJRBESKH-CRAIPNDOSA-N 0 1 300.450 4.044 20 0 DIADMN C[C@@H](N[C@H](c1ccc(Cl)cc1)C1CCCC1)c1cn(C)nn1 ZINC000902793806 1046072525 /nfs/dbraw/zinc/07/25/25/1046072525.db2.gz MLSXTESOFGWTLP-PXAZEXFGSA-N 0 1 318.852 4.051 20 0 DIADMN C[C@@H](N[C@H](CO)c1ccccc1)c1ccc(C(F)(F)F)s1 ZINC000902806818 1046073396 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20 0 DIADMN Cc1noc(C)c1CN(C)[C@H](C)c1ccc(Br)cc1 ZINC000194971291 1046110356 /nfs/dbraw/zinc/11/03/56/1046110356.db2.gz AQSCREHMZUGOPS-LLVKDONJSA-N 0 1 323.234 4.247 20 0 DIADMN CCCCCC(C)(C)CN[C@@H](c1ncc[nH]1)c1cccnc1 ZINC000195057213 1046112270 /nfs/dbraw/zinc/11/22/70/1046112270.db2.gz LWXJJDIHQHOGOE-MRXNPFEDSA-N 0 1 300.450 4.090 20 0 DIADMN Cc1nc(-c2ccc(CN[C@@H](C)c3cncs3)cc2)cs1 ZINC000532208879 1046115103 /nfs/dbraw/zinc/11/51/03/1046115103.db2.gz BAVNUDCQBSZDPS-NSHDSACASA-N 0 1 315.467 4.426 20 0 DIADMN FC(F)(F)Cn1ccnc1CN[C@@H](CC1CC1)c1ccccc1 ZINC000532213752 1046117572 /nfs/dbraw/zinc/11/75/72/1046117572.db2.gz BDFGXLADICTNGN-HNNXBMFYSA-N 0 1 323.362 4.076 20 0 DIADMN CC(C)n1cc([C@@H](C)N[C@H]2CC(C)(C)Cc3occc32)cn1 ZINC000532229168 1046118542 /nfs/dbraw/zinc/11/85/42/1046118542.db2.gz XDGLHKLNQSWSGD-CJNGLKHVSA-N 0 1 301.434 4.421 20 0 DIADMN Cc1ccccc1[C@H](CO)N[C@@H]1CC2(CCC2)Oc2ccccc21 ZINC000532248675 1046122154 /nfs/dbraw/zinc/12/21/54/1046122154.db2.gz AHMNYRPCHJDFHP-MOPGFXCFSA-N 0 1 323.436 4.065 20 0 DIADMN Cc1ccc2nc(CN[C@H]3CC(C)(C)Cc4occc43)[nH]c2c1 ZINC000532238734 1046124279 /nfs/dbraw/zinc/12/42/79/1046124279.db2.gz YRUAMGJIUPKBHZ-INIZCTEOSA-N 0 1 309.413 4.268 20 0 DIADMN CCCCC[C@H](C)NC(=O)CN[C@H](C)c1cc(C)sc1C ZINC000195585704 1046124343 /nfs/dbraw/zinc/12/43/43/1046124343.db2.gz CKXMHBJXIRCIFM-GXTWGEPZSA-N 0 1 310.507 4.101 20 0 DIADMN FC1(F)CCC[C@H](NCc2csc(-c3ccccc3)n2)C1 ZINC000532269810 1046126418 /nfs/dbraw/zinc/12/64/18/1046126418.db2.gz BCPGWQNZKGMJNV-ZDUSSCGKSA-N 0 1 308.397 4.478 20 0 DIADMN C[N@@H+](Cc1cc2c(cc1Cl)OCO2)[C@@H]1CCc2ccccc21 ZINC001138248127 1046126867 /nfs/dbraw/zinc/12/68/67/1046126867.db2.gz SLECHIXDJPLKPU-MRXNPFEDSA-N 0 1 315.800 4.188 20 0 DIADMN CN(Cc1cc2c(cc1Cl)OCO2)[C@@H]1CCc2ccccc21 ZINC001138248127 1046126873 /nfs/dbraw/zinc/12/68/73/1046126873.db2.gz SLECHIXDJPLKPU-MRXNPFEDSA-N 0 1 315.800 4.188 20 0 DIADMN C[C@H]1c2cc(Cl)cc(Cl)c2CCN1C[C@H]1CCCOC1 ZINC000532276045 1046128914 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1046139523 /nfs/dbraw/zinc/13/95/23/1046139523.db2.gz PWDLSAIMYRYRSZ-HXUWFJFHSA-N 0 1 322.452 4.136 20 0 DIADMN CC(C)C[C@@H]1CCCN(Cc2ccnc(Br)c2)C1 ZINC001168144490 1046141597 /nfs/dbraw/zinc/14/15/97/1046141597.db2.gz DCGYVZFMUYSMPI-ZDUSSCGKSA-N 0 1 311.267 4.102 20 0 DIADMN C[C@H](Sc1nc(-c2ccccc2O)n[nH]1)c1cccc(F)c1 ZINC000194184180 1046142846 /nfs/dbraw/zinc/14/28/46/1046142846.db2.gz PVXOLXUBAYPGBE-JTQLQIEISA-N 0 1 315.373 4.170 20 0 DIADMN COc1cccc(CN[C@H](C)c2ccc(C(F)(F)F)cn2)c1C ZINC000903060067 1046150594 /nfs/dbraw/zinc/15/05/94/1046150594.db2.gz ZNINXZAMIFRJPA-GFCCVEGCSA-N 0 1 324.346 4.268 20 0 DIADMN CN(Cc1cc(O)cc(O)c1)C(c1ccccc1)c1ccccc1 ZINC001138323423 1046151483 /nfs/dbraw/zinc/15/14/83/1046151483.db2.gz VFBXTOAXNXFXSY-UHFFFAOYSA-N 0 1 319.404 4.319 20 0 DIADMN Cc1cnc(C(=O)Nc2ccc3nc(C(C)(C)C)[nH]c3c2)c(C)c1 ZINC000779882430 1046153256 /nfs/dbraw/zinc/15/32/56/1046153256.db2.gz SHVNPIQXBGMFHA-UHFFFAOYSA-N 0 1 322.412 4.125 20 0 DIADMN CCC[C@@H](N[C@@H](c1nncn1C)C(C)C)c1cc(C)sc1C ZINC000903066566 1046153591 /nfs/dbraw/zinc/15/35/91/1046153591.db2.gz VVJFUBCTJAEHTM-HZPDHXFCSA-N 0 1 320.506 4.322 20 0 DIADMN CC(C)CC1(C(=O)Nc2ccc(CN(C)C)c(F)c2)CCC1 ZINC000756960434 1046155796 /nfs/dbraw/zinc/15/57/96/1046155796.db2.gz BNIQNGGXWBNXAX-UHFFFAOYSA-N 0 1 306.425 4.042 20 0 DIADMN Cc1ccc(CN[C@@H](CCc2ccccc2)c2cccnc2)o1 ZINC000903077984 1046157475 /nfs/dbraw/zinc/15/74/75/1046157475.db2.gz SQYDPEPEHVTEKU-FQEVSTJZSA-N 0 1 306.409 4.447 20 0 DIADMN C[C@@H](N[C@@H]1CCc2cc(F)ccc21)c1cnn(CC2CCC2)c1 ZINC000903084238 1046159121 /nfs/dbraw/zinc/15/91/21/1046159121.db2.gz VYNIZMNAMGRUNF-BFUOFWGJSA-N 0 1 313.420 4.160 20 0 DIADMN C[C@@H](N[C@H]1CCc2cc(F)ccc21)c1cnn(CC2CCC2)c1 ZINC000903084241 1046159493 /nfs/dbraw/zinc/15/94/93/1046159493.db2.gz VYNIZMNAMGRUNF-YJYMSZOUSA-N 0 1 313.420 4.160 20 0 DIADMN C[C@H](N[C@H]1CCCn2nccc21)c1ccc(C(F)(F)F)s1 ZINC000903084943 1046160863 /nfs/dbraw/zinc/16/08/63/1046160863.db2.gz 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/nfs/dbraw/zinc/98/99/21/1047989921.db2.gz YPAHNRKNDZIHIO-KRWDZBQOSA-N 0 1 311.450 4.113 20 0 DIADMN CC(C)C[C@@H]1CCC[C@@H]([NH2+][C@H](C)c2nc(C(F)(F)F)n[n-]2)C1 ZINC001184001565 1047991103 /nfs/dbraw/zinc/99/11/03/1047991103.db2.gz DLESIURXNHRDPP-GRYCIOLGSA-N 0 1 318.387 4.079 20 0 DIADMN O=C(Nc1cc(Cl)c(O)cc1F)[C@H]1CCCc2ccccc21 ZINC000554032353 1047993209 /nfs/dbraw/zinc/99/32/09/1047993209.db2.gz WBZCPQJWUOXDDD-LBPRGKRZSA-N 0 1 319.763 4.243 20 0 DIADMN CN1CCN(c2ccc(Nc3ccccc3C3CC3)cc2)CC1 ZINC001174813720 1047994213 /nfs/dbraw/zinc/99/42/13/1047994213.db2.gz BZRHZJJICKOYNS-UHFFFAOYSA-N 0 1 307.441 4.059 20 0 DIADMN Cc1nc(N=CC2CCN(C(=O)OC(C)(C)C)CC2)sc1C ZINC001174844756 1047996661 /nfs/dbraw/zinc/99/66/61/1047996661.db2.gz KYIAXDOCMPIJIL-UHFFFAOYSA-N 0 1 323.462 4.087 20 0 DIADMN COc1cc(Nc2ccc(Oc3cccnc3)cc2)ncc1C ZINC001174849318 1047998458 /nfs/dbraw/zinc/99/84/58/1047998458.db2.gz PXSGQIGWJGZUKA-UHFFFAOYSA-N 0 1 307.353 4.330 20 0 DIADMN Cc1ccc(SCCN2CC3(CCCC3)OC[C@@H]2C)cc1C ZINC001174852976 1048000385 /nfs/dbraw/zinc/00/03/85/1048000385.db2.gz HWUYNTPMEYAPIF-KRWDZBQOSA-N 0 1 319.514 4.429 20 0 DIADMN FC(F)(F)COc1cccc(Nc2ccc3nc[nH]c3c2)c1 ZINC001160224298 1048002621 /nfs/dbraw/zinc/00/26/21/1048002621.db2.gz PVRNAROMJBERGJ-UHFFFAOYSA-N 0 1 307.275 4.248 20 0 DIADMN COc1cccc(C(F)(F)F)c1Nc1ccc2nc[nH]c2c1 ZINC001160224759 1048002961 /nfs/dbraw/zinc/00/29/61/1048002961.db2.gz YCTDBJYIIZHMJK-UHFFFAOYSA-N 0 1 307.275 4.334 20 0 DIADMN C[C@@H](N[C@@H](CN(C)C)c1ccc(F)cc1)c1cccc(F)c1F ZINC000554086256 1048005953 /nfs/dbraw/zinc/00/59/53/1048005953.db2.gz LKZXIGLHHIQZCG-PXAZEXFGSA-N 0 1 322.374 4.057 20 0 DIADMN CCCC(CCC)N[C@@H](c1nccn1C)c1ccc(F)c(F)c1 ZINC001184219432 1048010510 /nfs/dbraw/zinc/01/05/10/1048010510.db2.gz VYGBQLBJDXNDGC-QGZVFWFLSA-N 0 1 321.415 4.346 20 0 DIADMN CN1CCN(c2cccc(Nc3ccc4ccccc4c3)c2)CC1 ZINC001174876039 1048010645 /nfs/dbraw/zinc/01/06/45/1048010645.db2.gz MBAVCDKJHNLZEP-UHFFFAOYSA-N 0 1 317.436 4.335 20 0 DIADMN CC[C@H](CN(CC)Cc1nnc(C(C)(C)C)o1)c1ccccc1 ZINC000775896950 1048011910 /nfs/dbraw/zinc/01/19/10/1048011910.db2.gz VOTFQZWYEPPTEN-OAHLLOKOSA-N 0 1 315.461 4.383 20 0 DIADMN CCc1ccc2c(c1)CN(Cc1ccc([Si](C)(C)C)cc1)CC2 ZINC001198852450 1048012496 /nfs/dbraw/zinc/01/24/96/1048012496.db2.gz QXVJINUNVFNQCL-UHFFFAOYSA-N 0 1 323.556 4.353 20 0 DIADMN Fc1cc(OC(F)F)ccc1CNCc1cccc(Cl)c1 ZINC001198959020 1048020466 /nfs/dbraw/zinc/02/04/66/1048020466.db2.gz HOVBVAWWNBVDOK-UHFFFAOYSA-N 0 1 315.722 4.370 20 0 DIADMN Cc1cc(F)ncc1CNC(c1ccccc1)c1ccccc1 ZINC001198952695 1048020570 /nfs/dbraw/zinc/02/05/70/1048020570.db2.gz TZQOKZQZNQWUFH-UHFFFAOYSA-N 0 1 306.384 4.408 20 0 DIADMN COc1cc(Nc2ccc(COC(C)(C)C)cc2)ncc1C ZINC001174910523 1048024252 /nfs/dbraw/zinc/02/42/52/1048024252.db2.gz NIECTGPUNIODCD-UHFFFAOYSA-N 0 1 300.402 4.457 20 0 DIADMN COc1ccc(-c2nc(C[N@@H+](C)CC3CCCC3)cs2)cc1 ZINC000064014503 1048026884 /nfs/dbraw/zinc/02/68/84/1048026884.db2.gz FSQNRUJSOPRFEW-UHFFFAOYSA-N 0 1 316.470 4.441 20 0 DIADMN COc1ccc(-c2nc(CN(C)CC3CCCC3)cs2)cc1 ZINC000064014503 1048026899 /nfs/dbraw/zinc/02/68/99/1048026899.db2.gz FSQNRUJSOPRFEW-UHFFFAOYSA-N 0 1 316.470 4.441 20 0 DIADMN COc1ccc(OC)c(CNCc2ccc(C)cc2SC)c1 ZINC000153477647 1048028389 /nfs/dbraw/zinc/02/83/89/1048028389.db2.gz NXRICIBTIYLJDF-UHFFFAOYSA-N 0 1 317.454 4.024 20 0 DIADMN CCCOc1ccc(CN(C)Cc2scnc2C)c(C)c1 ZINC000667594016 1048028931 /nfs/dbraw/zinc/02/89/31/1048028931.db2.gz SZMJDOMUMLWVKP-UHFFFAOYSA-N 0 1 304.459 4.181 20 0 DIADMN C[C@@H]1c2ccc(Cl)n2CCN1CCCCC1CCOCC1 ZINC000794434992 1048029089 /nfs/dbraw/zinc/02/90/89/1048029089.db2.gz NDKPSQRLLIIMCH-CQSZACIVSA-N 0 1 310.869 4.115 20 0 DIADMN Cc1noc([C@H](NCCc2ccc(C(C)(C)C)cc2)C(C)C)n1 ZINC001184439313 1048036312 /nfs/dbraw/zinc/03/63/12/1048036312.db2.gz MLSPXFQEMCBVQH-QGZVFWFLSA-N 0 1 315.461 4.205 20 0 DIADMN Cc1cc(C)cc(CCN2CCc3cc(F)cc(F)c3C2)c1 ZINC001184417304 1048037967 /nfs/dbraw/zinc/03/79/67/1048037967.db2.gz AFTAGMUNPDKTJI-UHFFFAOYSA-N 0 1 301.380 4.182 20 0 DIADMN CCCN(CCSC)Cc1ccccc1Br ZINC000554226871 1048040169 /nfs/dbraw/zinc/04/01/69/1048040169.db2.gz WLBSZLULMVZDHV-UHFFFAOYSA-N 0 1 302.281 4.024 20 0 DIADMN COc1ncccc1CNCc1ccc2oc3ccccc3c2c1 ZINC001199178756 1048042305 /nfs/dbraw/zinc/04/23/05/1048042305.db2.gz GZMJLBAZICXKIU-UHFFFAOYSA-N 0 1 318.376 4.279 20 0 DIADMN O=C([O-])Cc1ccc(Nc2cc[nH+]c(-c3ccccc3)c2)cc1 ZINC001174947257 1048045861 /nfs/dbraw/zinc/04/58/61/1048045861.db2.gz HYGFNHRAPILYSQ-UHFFFAOYSA-N 0 1 304.349 4.119 20 0 DIADMN Cc1[nH]nc2cc(NC(=O)[C@H](C)c3ccccc3Cl)ccc12 ZINC001184479558 1048047360 /nfs/dbraw/zinc/04/73/60/1048047360.db2.gz XUYFKEXZDLLEDF-SNVBAGLBSA-N 0 1 313.788 4.267 20 0 DIADMN Cc1cccc(Cl)c1NC(=O)Nc1cc(O)c(F)c(F)c1 ZINC001184537642 1048051195 /nfs/dbraw/zinc/05/11/95/1048051195.db2.gz PSDXOKPATFOXTG-UHFFFAOYSA-N 0 1 312.703 4.276 20 0 DIADMN Cc1ncccc1CNCc1ccc(-c2cccc(F)c2F)o1 ZINC001203320117 1048055327 /nfs/dbraw/zinc/05/53/27/1048055327.db2.gz DZNQJYHADVMSAQ-UHFFFAOYSA-N 0 1 314.335 4.218 20 0 DIADMN OCc1cc(Nc2ccc(F)c(OCc3ccccc3)c2)ccn1 ZINC001174989985 1048056371 /nfs/dbraw/zinc/05/63/71/1048056371.db2.gz RSDKICNGOGWPIT-UHFFFAOYSA-N 0 1 324.355 4.036 20 0 DIADMN C[N@H+](Cc1ccccc1C(F)(F)F)C[C@H]1CC1(Cl)Cl ZINC000898519961 1048061493 /nfs/dbraw/zinc/06/14/93/1048061493.db2.gz BYXZUCXBMFKFEZ-SNVBAGLBSA-N 0 1 312.162 4.331 20 0 DIADMN CN(Cc1ccccc1C(F)(F)F)C[C@H]1CC1(Cl)Cl ZINC000898519961 1048061505 /nfs/dbraw/zinc/06/15/05/1048061505.db2.gz BYXZUCXBMFKFEZ-SNVBAGLBSA-N 0 1 312.162 4.331 20 0 DIADMN CCCCC[C@@H]1CCCC[N@H+]1CCOc1ccccc1C(=O)[O-] ZINC000659803824 1048064664 /nfs/dbraw/zinc/06/46/64/1048064664.db2.gz OSPPVFUXDFUIAV-MRXNPFEDSA-N 0 1 319.445 4.198 20 0 DIADMN Cc1ccc(Cl)cc1CNCc1ncccc1C(F)(F)F ZINC001203934463 1048065817 /nfs/dbraw/zinc/06/58/17/1048065817.db2.gz AHZFSQSBYANGJL-UHFFFAOYSA-N 0 1 314.738 4.352 20 0 DIADMN Cc1cc(NC(=O)c2ncccc2O)ccc1-c1ccccc1 ZINC001160555630 1048066013 /nfs/dbraw/zinc/06/60/13/1048066013.db2.gz HDFFTCRKKQWKMJ-UHFFFAOYSA-N 0 1 304.349 4.015 20 0 DIADMN Cc1ccc2nc([C@H]3CCCN(C/C(Cl)=C/Cl)C3)[nH]c2c1 ZINC000774763105 1048068083 /nfs/dbraw/zinc/06/80/83/1048068083.db2.gz WYCPQCZENSSWLL-OEMOTLHWSA-N 0 1 324.255 4.370 20 0 DIADMN COCc1csc(CN(C)[C@H]2CCCc3nc(C)sc32)c1 ZINC000667630031 1048068103 /nfs/dbraw/zinc/06/81/03/1048068103.db2.gz VFSSIXYPRQAROR-HNNXBMFYSA-N 0 1 322.499 4.169 20 0 DIADMN Cc1ccc(O[C@H]2CCN(Cc3ccc(Cl)cc3C)C2)nc1 ZINC001175015966 1048072597 /nfs/dbraw/zinc/07/25/97/1048072597.db2.gz MCTNXYRKWDJJME-KRWDZBQOSA-N 0 1 316.832 4.005 20 0 DIADMN Cc1ccc(O[C@@H]2CCN(Cc3ccc(Cl)cc3C)C2)nc1 ZINC001175015967 1048072834 /nfs/dbraw/zinc/07/28/34/1048072834.db2.gz MCTNXYRKWDJJME-QGZVFWFLSA-N 0 1 316.832 4.005 20 0 DIADMN OCc1cc(Nc2ccc(OCc3ccccc3)c(F)c2)ccn1 ZINC001175019786 1048075072 /nfs/dbraw/zinc/07/50/72/1048075072.db2.gz UXLQLDQXBHOEFH-UHFFFAOYSA-N 0 1 324.355 4.036 20 0 DIADMN Clc1cnccc1CNCCOc1ccc2ccccc2c1 ZINC001199554086 1048076686 /nfs/dbraw/zinc/07/66/86/1048076686.db2.gz FITQPEYODOGHEX-UHFFFAOYSA-N 0 1 312.800 4.057 20 0 DIADMN CC[C@@H](C)c1ccc([C@H](Nc2nccnc2CN)C(C)C)cc1 ZINC001184667778 1048077022 /nfs/dbraw/zinc/07/70/22/1048077022.db2.gz ZGZSCUPLTNOWHC-RDTXWAMCSA-N 0 1 312.461 4.258 20 0 DIADMN COc1ccc(CN[C@@H](C)c2ccc(Cl)cn2)cc1Cl ZINC000480171788 1048078186 /nfs/dbraw/zinc/07/81/86/1048078186.db2.gz LKCVSLWPPZQWIZ-JTQLQIEISA-N 0 1 311.212 4.248 20 0 DIADMN Cc1ccccc1OCCNCc1c(Cl)cccc1Cl ZINC001199630047 1048082001 /nfs/dbraw/zinc/08/20/01/1048082001.db2.gz PQMYMJNNKKYUPW-UHFFFAOYSA-N 0 1 310.224 4.470 20 0 DIADMN CC(C)[C@H](N[C@H](C)CCCC(F)(F)F)c1nc(C2CC2)no1 ZINC000480187124 1048086964 /nfs/dbraw/zinc/08/69/64/1048086964.db2.gz YCPPKJVFIXUQMT-PWSUYJOCSA-N 0 1 319.371 4.355 20 0 DIADMN C[C@H](NCc1cc2ccnc(Cl)c2s1)c1ccccn1 ZINC001199784127 1048101918 /nfs/dbraw/zinc/10/19/18/1048101918.db2.gz PNDKSPLGSQXXDF-JTQLQIEISA-N 0 1 303.818 4.196 20 0 DIADMN Cc1cc(C)c(/C=C\CNCc2cn3ccsc3n2)cc1C ZINC001199802395 1048103446 /nfs/dbraw/zinc/10/34/46/1048103446.db2.gz XMYAWYRLJMPBOY-PLNGDYQASA-N 0 1 311.454 4.124 20 0 DIADMN CCCCC[C@H](NCc1csc(NC(C)=O)n1)C(C)(C)C ZINC000776024436 1048105763 /nfs/dbraw/zinc/10/57/63/1048105763.db2.gz YJYMRWHDWFIWDY-AWEZNQCLSA-N 0 1 311.495 4.186 20 0 DIADMN Cc1ccc(NC(=O)[C@H](C)N2CCCC3(CC3)CC2)c(Cl)c1 ZINC001175045332 1048106885 /nfs/dbraw/zinc/10/68/85/1048106885.db2.gz QCZJZEPTLRLYHS-AWEZNQCLSA-N 0 1 320.864 4.242 20 0 DIADMN O=C(Nc1ccc(F)c(F)c1O)[C@@H]1C[C@H]1c1ccc(Cl)cc1 ZINC001161068192 1048107471 /nfs/dbraw/zinc/10/74/71/1048107471.db2.gz WDHJAIKEVGRACX-WDEREUQCSA-N 0 1 323.726 4.066 20 0 DIADMN CCCCCCOc1ccc(-n2cnc(C)c2N)c(F)c1F ZINC001175048552 1048108980 /nfs/dbraw/zinc/10/89/80/1048108980.db2.gz PXBNBOHGDWDRFM-UHFFFAOYSA-N 0 1 309.360 4.000 20 0 DIADMN Fc1c(Cl)cccc1CNCc1ccc(-c2cnco2)cc1 ZINC001203944044 1048109761 /nfs/dbraw/zinc/10/97/61/1048109761.db2.gz HEWQEOPSBMXJLK-UHFFFAOYSA-N 0 1 316.763 4.424 20 0 DIADMN CC[C@@H](CC1CCCC1)C(=O)Nc1cccc(-c2cn[nH]n2)c1 ZINC001161135196 1048111397 /nfs/dbraw/zinc/11/13/97/1048111397.db2.gz 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/nfs/dbraw/zinc/12/71/04/1048127104.db2.gz OJKVVWWSTVNREV-OAQYLSRUSA-N 0 1 317.436 4.422 20 0 DIADMN CC(C)(C)c1nc(Nc2cc(C(F)(F)F)ccc2F)no1 ZINC001175075037 1048128820 /nfs/dbraw/zinc/12/88/20/1048128820.db2.gz DVQUVSJDUXCVNH-UHFFFAOYSA-N 0 1 303.259 4.269 20 0 DIADMN C[C@@H](CC(C)(C)C)NC(=O)c1c(O)cc(Cl)cc1Cl ZINC001161448894 1048132800 /nfs/dbraw/zinc/13/28/00/1048132800.db2.gz KBOCYFCGUPTZMF-QMMMGPOBSA-N 0 1 304.217 4.254 20 0 DIADMN Cc1ccc([C@H]2CCC[C@@H]2[N@@H+](C)Cc2cn(C3CCC3)nn2)cc1 ZINC000667670293 1048137140 /nfs/dbraw/zinc/13/71/40/1048137140.db2.gz JNQVKKFVHDGVNY-UXHICEINSA-N 0 1 324.472 4.080 20 0 DIADMN Cc1ccc([C@H]2CCC[C@@H]2N(C)Cc2cn(C3CCC3)nn2)cc1 ZINC000667670293 1048137149 /nfs/dbraw/zinc/13/71/49/1048137149.db2.gz JNQVKKFVHDGVNY-UXHICEINSA-N 0 1 324.472 4.080 20 0 DIADMN Cc1ccc([C@@H]2CCC[C@H]2[N@@H+](C)Cc2cn(C3CCC3)nn2)cc1 ZINC000667670294 1048137212 /nfs/dbraw/zinc/13/72/12/1048137212.db2.gz JNQVKKFVHDGVNY-VQTJNVASSA-N 0 1 324.472 4.080 20 0 DIADMN 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4.413 20 0 DIADMN COc1ccc2c(c1)nccc2Nc1ccc(Cl)nc1OC ZINC001203521609 1048919473 /nfs/dbraw/zinc/91/94/73/1048919473.db2.gz DUZAFBSXWCVIOW-UHFFFAOYSA-N 0 1 315.760 4.044 20 0 DIADMN COc1ccc2c(c1)nccc2Nc1cccc2oc(C)nc21 ZINC001203526169 1048921171 /nfs/dbraw/zinc/92/11/71/1048921171.db2.gz PUTFDTZQMHZQPE-UHFFFAOYSA-N 0 1 305.337 4.437 20 0 DIADMN CCOC(=O)c1oc2ccccc2c1CN1CC(C)(C)C1(C)C ZINC001191390288 1048931402 /nfs/dbraw/zinc/93/14/02/1048931402.db2.gz KGFAOQSRUFKAKP-UHFFFAOYSA-N 0 1 315.413 4.230 20 0 DIADMN c1c(CNCc2nc3c(s2)CCCC3)sc2c1CCCC2 ZINC001177729026 1048932349 /nfs/dbraw/zinc/93/23/49/1048932349.db2.gz FQCMXXWGONOFRN-UHFFFAOYSA-N 0 1 318.511 4.252 20 0 DIADMN CCCn1nc(C)c(CNc2nc3ccc(Cl)cc3[nH]2)c1C ZINC001203573364 1048932355 /nfs/dbraw/zinc/93/23/55/1048932355.db2.gz ZIKJLXDSXQWYIX-UHFFFAOYSA-N 0 1 317.824 4.052 20 0 DIADMN CNc1ccc(C)cc1CNc1nc2ccc(Cl)cc2[nH]1 ZINC001203573369 1048932501 /nfs/dbraw/zinc/93/25/01/1048932501.db2.gz ZLCMIMHOAVJJCI-UHFFFAOYSA-N 0 1 300.793 4.179 20 0 DIADMN CCC[C@H](NCc1ccc(OC(F)F)cc1)c1ccccn1 ZINC001177687836 1048933287 /nfs/dbraw/zinc/93/32/87/1048933287.db2.gz JYZZGEFLRUVMDG-HNNXBMFYSA-N 0 1 306.356 4.314 20 0 DIADMN CCCOc1ncccc1CN[C@@H](C)c1ccccc1SC ZINC000194866238 1048938268 /nfs/dbraw/zinc/93/82/68/1048938268.db2.gz YKPPXSMLGIHBCF-AWEZNQCLSA-N 0 1 316.470 4.443 20 0 DIADMN CCc1ccc2ccccc2c1CNCc1cnn(C)c1Cl ZINC001203604006 1048938690 /nfs/dbraw/zinc/93/86/90/1048938690.db2.gz ZQHQMBDHTNSJRI-UHFFFAOYSA-N 0 1 313.832 4.079 20 0 DIADMN Fc1ccc(F)c2c1CCN(CCc1ccc(Cl)cc1)C2 ZINC001191415936 1048939187 /nfs/dbraw/zinc/93/91/87/1048939187.db2.gz BMFUQQFHOOVJGS-UHFFFAOYSA-N 0 1 307.771 4.219 20 0 DIADMN CCCCCCN(C)Cc1nc(-c2ccc(C(F)F)nc2)no1 ZINC000854092935 1048939334 /nfs/dbraw/zinc/93/93/34/1048939334.db2.gz ZKCYMLQFUDVYAB-UHFFFAOYSA-N 0 1 324.375 4.081 20 0 DIADMN Cc1cc(CNCc2ccccc2OCCC(C)C)cc(C)n1 ZINC001177765553 1048940946 /nfs/dbraw/zinc/94/09/46/1048940946.db2.gz USPPZHULLPMEEX-UHFFFAOYSA-N 0 1 312.457 4.413 20 0 DIADMN CN(C(=O)c1c(O)cccc1Cl)c1ccc(F)c(Cl)c1 ZINC000776713898 1048941349 /nfs/dbraw/zinc/94/13/49/1048941349.db2.gz XULORNBTQJYFQY-UHFFFAOYSA-N 0 1 314.143 4.115 20 0 DIADMN COc1cccc2c(CNCc3cc(F)ccc3F)cccc12 ZINC001177779929 1048942613 /nfs/dbraw/zinc/94/26/13/1048942613.db2.gz QQOSEBMXDBMMRK-UHFFFAOYSA-N 0 1 313.347 4.416 20 0 DIADMN CC[C@@H](NC)c1nc(-c2ccc(-c3ccc(OC)cc3)cc2)no1 ZINC000854147214 1048942907 /nfs/dbraw/zinc/94/29/07/1048942907.db2.gz ZBJGFFFCFUTYOE-QGZVFWFLSA-N 0 1 323.396 4.083 20 0 DIADMN CC[C@@H](NC)c1nc(-c2ccc(C)cc2OC2CCCC2)no1 ZINC000854147071 1048943067 /nfs/dbraw/zinc/94/30/67/1048943067.db2.gz TUCWKTHFXBJWSM-OAHLLOKOSA-N 0 1 315.417 4.037 20 0 DIADMN CC(C)n1cc([C@H](C)NCc2ccc(C(F)(F)F)cc2)cn1 ZINC001177799529 1048945927 /nfs/dbraw/zinc/94/59/27/1048945927.db2.gz AMFQSPPTIMRHAP-LBPRGKRZSA-N 0 1 311.351 4.334 20 0 DIADMN Cn1cc(Cl)c(CNCC2CCC(c3ccccc3)CC2)n1 ZINC001177791035 1048946206 /nfs/dbraw/zinc/94/62/06/1048946206.db2.gz PLFMSILGVKTKEV-UHFFFAOYSA-N 0 1 317.864 4.137 20 0 DIADMN C[C@H]1CC(CCN2CCC[C@H]2C(=O)OC(C)(C)C)C[C@H](C)C1 ZINC001191521613 1048956614 /nfs/dbraw/zinc/95/66/14/1048956614.db2.gz TWMYDXRHTTUQOU-INMHGKMJSA-N 0 1 309.494 4.255 20 0 DIADMN C[C@@H](NC/C=C\c1ccc(F)cc1)c1nc2ccccc2n1C ZINC001177903616 1048957522 /nfs/dbraw/zinc/95/75/22/1048957522.db2.gz DNBFQBSODFRFMO-GEXIGZQTSA-N 0 1 309.388 4.076 20 0 DIADMN F[C@H]1CCN(Cc2ccccc2C(F)(F)F)CCC1(F)F ZINC001203684533 1048962846 /nfs/dbraw/zinc/96/28/46/1048962846.db2.gz ZACHUBQSUXBQON-LBPRGKRZSA-N 0 1 311.269 4.275 20 0 DIADMN CC[C@H](N[C@@H]1C[C@H](C)C[C@@H](c2ccccc2)C1)c1noc(C)n1 ZINC001177967198 1048963073 /nfs/dbraw/zinc/96/30/73/1048963073.db2.gz DKWBOBWIZYDZOD-PILAGYSTSA-N 0 1 313.445 4.391 20 0 DIADMN CCO[C@H]1C[C@@H](N(C)Cc2cccc(Cl)c2F)C12CCC2 ZINC001191549810 1048963268 /nfs/dbraw/zinc/96/32/68/1048963268.db2.gz GOVKWFZVLZNGOR-CABCVRRESA-N 0 1 311.828 4.259 20 0 DIADMN CO[C@@]1(C)C[C@H](NCc2c(Cl)cccc2Cl)C1(C)C ZINC001177929317 1048965139 /nfs/dbraw/zinc/96/51/39/1048965139.db2.gz VIAQMLHLCRERLO-ZFWWWQNUSA-N 0 1 302.245 4.287 20 0 DIADMN CO[C@@]1(C)C[C@@H](NCc2c(Cl)cccc2Cl)C1(C)C ZINC001177929314 1048965298 /nfs/dbraw/zinc/96/52/98/1048965298.db2.gz VIAQMLHLCRERLO-HIFRSBDPSA-N 0 1 302.245 4.287 20 0 DIADMN CC(C)[C@H](N)c1noc(C(F)(F)c2ccc(C(C)(C)C)cc2)n1 ZINC000904077204 1048970052 /nfs/dbraw/zinc/97/00/52/1048970052.db2.gz RCWPCFJOGLRPMV-ZDUSSCGKSA-N 0 1 323.387 4.163 20 0 DIADMN CN(Cc1cc(Cl)cn1C)[C@@H]1CCCc2ccc(F)cc21 ZINC001191636431 1048970060 /nfs/dbraw/zinc/97/00/60/1048970060.db2.gz RLDXIRDTFKHUIN-QGZVFWFLSA-N 0 1 306.812 4.327 20 0 DIADMN C[C@H](c1noc([C@@H]2CC[C@H]3CCCC[C@@H]3N2)n1)c1cccs1 ZINC000904094697 1048974836 /nfs/dbraw/zinc/97/48/36/1048974836.db2.gz SGMWKURAKMDJMR-CRWXNKLISA-N 0 1 317.458 4.266 20 0 DIADMN COc1cc(CN(C2CC2)[C@@H]2CCCc3ccccc32)sn1 ZINC001191645556 1048976649 /nfs/dbraw/zinc/97/66/49/1048976649.db2.gz DMXWNVJKOINWSR-QGZVFWFLSA-N 0 1 314.454 4.194 20 0 DIADMN O=c1[nH]cc(CNCc2cc3cc(F)ccc3o2)c2ccccc12 ZINC001203721796 1048978093 /nfs/dbraw/zinc/97/80/93/1048978093.db2.gz QRVLORCJOMADAK-UHFFFAOYSA-N 0 1 322.339 4.116 20 0 DIADMN COc1ccc(CN2CCC(=O)[C@@H](C)C23CCCC3)c(C)c1C ZINC001203727343 1048981247 /nfs/dbraw/zinc/98/12/47/1048981247.db2.gz QXKPJNKWJXKOAG-MRXNPFEDSA-N 0 1 315.457 4.036 20 0 DIADMN CCCCC[C@@H](CC)C(=O)Nc1c(=O)[nH][nH]c1-c1ccccc1 ZINC000854644803 1048983725 /nfs/dbraw/zinc/98/37/25/1048983725.db2.gz SVZYMJLYYUZLDD-CYBMUJFWSA-N 0 1 315.417 4.327 20 0 DIADMN Cc1nn(-c2ccccc2Cl)cc1CNC(C)(C)/C=C\Cl ZINC001203733002 1048984627 /nfs/dbraw/zinc/98/46/27/1048984627.db2.gz DMLNVXVDGTXHBQ-HJWRWDBZSA-N 0 1 324.255 4.455 20 0 DIADMN Cc1noc(C)c1[C@H](C)NCc1ccccc1COC(C)C ZINC000924795389 1048990941 /nfs/dbraw/zinc/99/09/41/1048990941.db2.gz MDJOHFHPQUSZIZ-ZDUSSCGKSA-N 0 1 302.418 4.067 20 0 DIADMN CC(C)c1nc(CN(C)c2ccccc2Oc2ccccc2)n[nH]1 ZINC001191731205 1048992045 /nfs/dbraw/zinc/99/20/45/1048992045.db2.gz LATMNPYPUFHMQM-UHFFFAOYSA-N 0 1 322.412 4.357 20 0 DIADMN C/C(=C/C(=O)N(C)[C@@H](C)c1nc2ccc(Cl)cc2[nH]1)C1CC1 ZINC000854818612 1048992367 /nfs/dbraw/zinc/99/23/67/1048992367.db2.gz NLTFSJPFEGKAKV-IEHMKBBKSA-N 0 1 317.820 4.092 20 0 DIADMN CC(C)=C(C)C(=O)N(C)[C@@H](C)c1nc2ccc(Cl)cc2[nH]1 ZINC000854818637 1048992467 /nfs/dbraw/zinc/99/24/67/1048992467.db2.gz NUQSXRAHQCUVJB-NSHDSACASA-N 0 1 305.809 4.092 20 0 DIADMN C/C(=C\C(=O)N(C)[C@@H](C)c1nc2ccc(Cl)cc2[nH]1)C1CC1 ZINC000854818614 1048993304 /nfs/dbraw/zinc/99/33/04/1048993304.db2.gz NLTFSJPFEGKAKV-UQSGXBNBSA-N 0 1 317.820 4.092 20 0 DIADMN CC(C(=O)N(C)[C@H](C)c1nc2ccc(Cl)cc2[nH]1)=C1CCC1 ZINC000854817555 1048993643 /nfs/dbraw/zinc/99/36/43/1048993643.db2.gz VSDNUGSRDOJCJR-LLVKDONJSA-N 0 1 317.820 4.236 20 0 DIADMN CCN(c1ccc(NCc2cccc3n[nH]cc32)cc1)C(C)C ZINC001178125072 1048994791 /nfs/dbraw/zinc/99/47/91/1048994791.db2.gz SHRLCYFKCYINEH-UHFFFAOYSA-N 0 1 308.429 4.410 20 0 DIADMN COc1ccc(F)cc1CN[C@H](C)c1ccccc1SC ZINC000194964432 1048995868 /nfs/dbraw/zinc/99/58/68/1048995868.db2.gz KTNOCEDRVDSOKT-GFCCVEGCSA-N 0 1 305.418 4.407 20 0 DIADMN CCCC[C@@H](CC)CN(C)CC(=O)Nc1cc(F)cc(F)c1 ZINC001191780158 1048998630 /nfs/dbraw/zinc/99/86/30/1048998630.db2.gz HGLFELPFMIFTMV-CYBMUJFWSA-N 0 1 312.404 4.052 20 0 DIADMN C[C@@H](NCc1cccc2[nH]c(=O)oc21)c1ccc(Cl)c(F)c1 ZINC001178208302 1048999704 /nfs/dbraw/zinc/99/97/04/1048999704.db2.gz LAUYPWVDSRAHIA-SECBINFHSA-N 0 1 320.751 4.177 20 0 DIADMN CN(C(=O)c1cc(C2CC2)[nH]n1)[C@H]1CCCC[C@@H]1c1ccccc1 ZINC000854954359 1049002051 /nfs/dbraw/zinc/00/20/51/1049002051.db2.gz YVTBTLXKAAIUFJ-APWZRJJASA-N 0 1 323.440 4.086 20 0 DIADMN CN(C(=O)c1cc(C2CC2)[nH]n1)[C@H]1CCCC[C@H]1c1ccccc1 ZINC000854954360 1049002292 /nfs/dbraw/zinc/00/22/92/1049002292.db2.gz YVTBTLXKAAIUFJ-LPHOPBHVSA-N 0 1 323.440 4.086 20 0 DIADMN Clc1ccc(CN2CCC3(CCCOC3)CC2)cc1Cl ZINC001203807026 1049002790 /nfs/dbraw/zinc/00/27/90/1049002790.db2.gz WFVAPLSCGOHBGZ-UHFFFAOYSA-N 0 1 314.256 4.386 20 0 DIADMN FC1(F)C[C@H]2CN(Cc3ccc(Cl)c(Cl)c3)C[C@H]2C1 ZINC001203804883 1049002938 /nfs/dbraw/zinc/00/29/38/1049002938.db2.gz ZPRBUZGUFZTMOP-PHIMTYICSA-N 0 1 306.183 4.471 20 0 DIADMN CCO[C@@H]1C[C@H](N(C)Cc2ccc(C)nc2Cl)C1(CC)CC ZINC001191822656 1049006937 /nfs/dbraw/zinc/00/69/37/1049006937.db2.gz XKWOKHBXHJUMJB-JKSUJKDBSA-N 0 1 324.896 4.459 20 0 DIADMN CCn1cc([C@@H](C)N[C@@H](C)c2cccc(C(F)(F)F)c2)cn1 ZINC000194983525 1049009033 /nfs/dbraw/zinc/00/90/33/1049009033.db2.gz KAWOLFSBRDUOHE-NWDGAFQWSA-N 0 1 311.351 4.334 20 0 DIADMN CCn1cc([C@@H](C)N[C@@H](C)c2ccc(C(F)(F)F)cc2)cn1 ZINC000194983808 1049009264 /nfs/dbraw/zinc/00/92/64/1049009264.db2.gz PEILGEQUCTYVPA-NWDGAFQWSA-N 0 1 311.351 4.334 20 0 DIADMN COc1ccc(Oc2cccc(CN3CCC[C@@H]3CF)c2)cc1 ZINC001203820028 1049009381 /nfs/dbraw/zinc/00/93/81/1049009381.db2.gz LXJMXHYSRBENIE-MRXNPFEDSA-N 0 1 315.388 4.421 20 0 DIADMN C[C@H]1CC[C@H](NC(=O)Nc2c(Cl)ccc(O)c2Cl)CC1 ZINC001191824000 1049009622 /nfs/dbraw/zinc/00/96/22/1049009622.db2.gz FFQNRHAPLPCMGV-KYZUINATSA-N 0 1 317.216 4.399 20 0 DIADMN COc1cccc(CN2CCc3cc(C(F)(F)F)ccc3C2)c1 ZINC001203826565 1049012406 /nfs/dbraw/zinc/01/24/06/1049012406.db2.gz XYRKZYNSFNMXHQ-UHFFFAOYSA-N 0 1 321.342 4.272 20 0 DIADMN CC(C)(C)c1nc(CNCCCNc2cccc(F)c2)cs1 ZINC001178299682 1049014318 /nfs/dbraw/zinc/01/43/18/1049014318.db2.gz FIALYMGGTFTONL-UHFFFAOYSA-N 0 1 321.465 4.172 20 0 DIADMN CCC1CCC(NCC2CCC3(CC3)CC2)(C(=O)OC)CC1 ZINC001191900894 1049017788 /nfs/dbraw/zinc/01/77/88/1049017788.db2.gz WGRJYQCKMBVTGO-UHFFFAOYSA-N 0 1 307.478 4.058 20 0 DIADMN O=C(CN1CCC[C@H]1c1ccccc1)NC1CCCCCCC1 ZINC000010088970 1049020733 /nfs/dbraw/zinc/02/07/33/1049020733.db2.gz BTOHEIUOBQRABZ-IBGZPJMESA-N 0 1 314.473 4.053 20 0 DIADMN Fc1cc(OC(F)F)ccc1CNC/C=C/c1ccccc1 ZINC001178326627 1049022781 /nfs/dbraw/zinc/02/27/81/1049022781.db2.gz MOPGEZBTZFXORR-QPJJXVBHSA-N 0 1 307.315 4.230 20 0 DIADMN COc1ccnc(NCc2ccc(Cl)c(C(F)(F)F)c2)c1 ZINC001178382965 1049025138 /nfs/dbraw/zinc/02/51/38/1049025138.db2.gz RYYQPJWTARTBAF-UHFFFAOYSA-N 0 1 316.710 4.375 20 0 DIADMN CN(Cc1cccc(Cl)c1Cl)CC1(O)CCCCC1 ZINC001191960505 1049026089 /nfs/dbraw/zinc/02/60/89/1049026089.db2.gz JKIUPHZMVBMZQS-UHFFFAOYSA-N 0 1 302.245 4.120 20 0 DIADMN COc1ccc([C@H]2CSCCN2Cc2cccc(C)c2)cc1 ZINC001203892212 1049026532 /nfs/dbraw/zinc/02/65/32/1049026532.db2.gz WTVUJBUAZVVIBN-LJQANCHMSA-N 0 1 313.466 4.294 20 0 DIADMN CNc1ccccc1CN[C@H](C)c1ccc(F)cc1OC(F)F ZINC001178398353 1049026551 /nfs/dbraw/zinc/02/65/51/1049026551.db2.gz NTJGPLICDKBWOH-LLVKDONJSA-N 0 1 324.346 4.320 20 0 DIADMN COC[C@@H](NC/C=C/c1cccc(F)c1)c1ccc(F)c(F)c1 ZINC001178359354 1049027004 /nfs/dbraw/zinc/02/70/04/1049027004.db2.gz AXOLOWFAEJQZLE-YWPBOTNQSA-N 0 1 321.342 4.094 20 0 DIADMN COC(=O)c1oc(C[N@@H+](C(C)C)[C@@H](C)c2ccsc2)cc1C ZINC001206328838 1049029745 /nfs/dbraw/zinc/02/97/45/1049029745.db2.gz PBCNFCNYQBQUTR-ZDUSSCGKSA-N 0 1 321.442 4.408 20 0 DIADMN COC(=O)c1oc(CN(C(C)C)[C@@H](C)c2ccsc2)cc1C ZINC001206328838 1049029761 /nfs/dbraw/zinc/02/97/61/1049029761.db2.gz PBCNFCNYQBQUTR-ZDUSSCGKSA-N 0 1 321.442 4.408 20 0 DIADMN Cc1c(Br)cncc1CN[C@H](C)c1ccc(F)cc1 ZINC001203917050 1049030514 /nfs/dbraw/zinc/03/05/14/1049030514.db2.gz LHUQERPFEPNZFA-LLVKDONJSA-N 0 1 323.209 4.142 20 0 DIADMN C[C@@H]1CC(CCN2CCN(C(=O)OC(C)(C)C)CC2)C[C@@H](C)C1 ZINC001192032172 1049033360 /nfs/dbraw/zinc/03/33/60/1049033360.db2.gz QIDLZBRCWKJIBI-HOTGVXAUSA-N 0 1 324.509 4.002 20 0 DIADMN COc1ccccc1O[C@H]1CCN(Cc2ccc(Cl)cc2)C1 ZINC001203921358 1049033550 /nfs/dbraw/zinc/03/35/50/1049033550.db2.gz NCUPITXCFLQBQP-INIZCTEOSA-N 0 1 317.816 4.002 20 0 DIADMN CC(C)c1nc([C@@H](C)NCc2ccc(-c3ccccc3)cc2)n[nH]1 ZINC001178408562 1049034614 /nfs/dbraw/zinc/03/46/14/1049034614.db2.gz AOMUONQHGGMUBM-OAHLLOKOSA-N 0 1 320.440 4.446 20 0 DIADMN CC(C)c1nc([C@H](C)NCc2cccc(Cl)c2Cl)n[nH]1 ZINC001178408680 1049035229 /nfs/dbraw/zinc/03/52/29/1049035229.db2.gz DDRRIJXIYINYSX-VIFPVBQESA-N 0 1 313.232 4.086 20 0 DIADMN CCSc1ccccc1CN1CCN(c2cccs2)CC1 ZINC001192061065 1049037329 /nfs/dbraw/zinc/03/73/29/1049037329.db2.gz IQMRNWLQOUDBOB-UHFFFAOYSA-N 0 1 318.511 4.182 20 0 DIADMN c1[nH]c2ccccc2c1-c1cc(-c2nc(C3CCCC3)no2)[nH]n1 ZINC000904351934 1049038918 /nfs/dbraw/zinc/03/89/18/1049038918.db2.gz OXWAWLFIILFWIV-UHFFFAOYSA-N 0 1 319.368 4.266 20 0 DIADMN C[C@@H](NCc1cnc(Cl)s1)c1ccc2ncsc2c1 ZINC000776818418 1049044410 /nfs/dbraw/zinc/04/44/10/1049044410.db2.gz AHWXMVNADNEKAE-MRVPVSSYSA-N 0 1 309.847 4.257 20 0 DIADMN c1cc(CNCc2ccc(C3CCC3)cc2)n(CC2CCC2)n1 ZINC001178488320 1049044811 /nfs/dbraw/zinc/04/48/11/1049044811.db2.gz USVFXWBNQLAUSG-UHFFFAOYSA-N 0 1 309.457 4.241 20 0 DIADMN CCCCOc1ccc(C[N@@H+]2C[C@H]3CC[C@@H](C2)C3(F)F)cc1 ZINC001203972885 1049048393 /nfs/dbraw/zinc/04/83/93/1049048393.db2.gz KDCYFWOJJSZXLG-IYBDPMFKSA-N 0 1 309.400 4.343 20 0 DIADMN CC1(C)CC[C@H](CN(CCC(F)(F)F)Cc2ccccc2)O1 ZINC000484815314 1049052473 /nfs/dbraw/zinc/05/24/73/1049052473.db2.gz YTOVWBGMVIIWMD-OAHLLOKOSA-N 0 1 315.379 4.399 20 0 DIADMN COCCN(Cc1nc(C(C)(C)C)cs1)[C@@H]1CC[C@@H](C)C1 ZINC000484852117 1049060429 /nfs/dbraw/zinc/06/04/29/1049060429.db2.gz BBYIBRLMIAPCKU-ZIAGYGMSSA-N 0 1 310.507 4.078 20 0 DIADMN c1csc(CN2CCN(c3cccc4sccc43)CC2)c1 ZINC001204018791 1049061900 /nfs/dbraw/zinc/06/19/00/1049061900.db2.gz SEHMBEKEWXUWDF-UHFFFAOYSA-N 0 1 314.479 4.285 20 0 DIADMN CC(C)Cc1noc(-c2cc(Cl)c3ccccc3c2O)n1 ZINC000904413550 1049062096 /nfs/dbraw/zinc/06/20/96/1049062096.db2.gz VSHSHELVNVBWNH-UHFFFAOYSA-N 0 1 302.761 4.447 20 0 DIADMN Cc1ccsc1CN1CCSC[C@H]1c1ccc(F)cc1 ZINC001204021107 1049062940 /nfs/dbraw/zinc/06/29/40/1049062940.db2.gz HALUAOQREYZQND-HNNXBMFYSA-N 0 1 307.459 4.486 20 0 DIADMN CC[C@@]1(C(=O)[O-])CCC[N@@H+](C[C@H](CC(C)C)c2ccccc2)C1 ZINC000904398470 1049063504 /nfs/dbraw/zinc/06/35/04/1049063504.db2.gz PYBXVLWQUYCNFX-AZUAARDMSA-N 0 1 317.473 4.393 20 0 DIADMN CCc1ccc(CN2CCC(OC3CCC(C)CC3)CC2)nc1 ZINC000338982800 1049064861 /nfs/dbraw/zinc/06/48/61/1049064861.db2.gz BUZBBQXMZKOPSH-UHFFFAOYSA-N 0 1 316.489 4.204 20 0 DIADMN C[C@@H]1CCN(Cc2cc(Br)cs2)CCC1(F)F ZINC001204026559 1049065234 /nfs/dbraw/zinc/06/52/34/1049065234.db2.gz OTMWRWQHMDHIRL-SECBINFHSA-N 0 1 324.234 4.378 20 0 DIADMN Cc1ccsc1CN1CCO[C@](C)(c2ccc(C)cc2)C1 ZINC001204023955 1049066613 /nfs/dbraw/zinc/06/66/13/1049066613.db2.gz RWWXQBAHMOVQEV-SFHVURJKSA-N 0 1 301.455 4.113 20 0 DIADMN CN(Cc1c[nH]c2ccccc12)Cc1ncccc1C(F)(F)F ZINC001204042336 1049068786 /nfs/dbraw/zinc/06/87/86/1049068786.db2.gz PIOUFRUFBPRYGD-UHFFFAOYSA-N 0 1 319.330 4.214 20 0 DIADMN Cc1ccc(F)c(CN[C@]2(CO)CC[C@@H](C)c3ccccc32)c1 ZINC001204047559 1049070854 /nfs/dbraw/zinc/07/08/54/1049070854.db2.gz GGYLUBMCTKFXLV-QRWLVFNGSA-N 0 1 313.416 4.009 20 0 DIADMN CC(C)(C)OC(=O)[C@@H]1C[C@H]2CCCC[C@@H]2N1Cc1ccsc1 ZINC001204043025 1049072517 /nfs/dbraw/zinc/07/25/17/1049072517.db2.gz SUCLARTVHFOBNO-PMPSAXMXSA-N 0 1 321.486 4.223 20 0 DIADMN COCCN(Cc1cc(-c2cccs2)on1)[C@@H]1CC[C@@H](C)C1 ZINC000484891547 1049072785 /nfs/dbraw/zinc/07/27/85/1049072785.db2.gz HJHMLBHSUNCNDU-UKRRQHHQSA-N 0 1 320.458 4.040 20 0 DIADMN Cc1cn(C)nc1CNc1ccc(N2CCCCCC2)cc1C ZINC001178688901 1049075069 /nfs/dbraw/zinc/07/50/69/1049075069.db2.gz OPHNYLZJPNQUCL-UHFFFAOYSA-N 0 1 312.461 4.029 20 0 DIADMN Clc1ccc([C@H]2CCN(Cc3cccnc3)C2)cc1Cl ZINC001204075927 1049079488 /nfs/dbraw/zinc/07/94/88/1049079488.db2.gz XDMLWMFUVHMZRJ-AWEZNQCLSA-N 0 1 307.224 4.378 20 0 DIADMN [O-]c1c(Cl)nccc1Nc1cccc(C[NH+]2CCCCC2)c1 ZINC001204094444 1049083116 /nfs/dbraw/zinc/08/31/16/1049083116.db2.gz JMTUOIROKLJELK-UHFFFAOYSA-N 0 1 317.820 4.170 20 0 DIADMN C[C@H](NCc1cc(O)cc(Cl)c1)c1cc(F)ccc1N(C)C ZINC001204111202 1049086687 /nfs/dbraw/zinc/08/66/87/1049086687.db2.gz QUEWFNXDMVYHRW-NSHDSACASA-N 0 1 322.811 4.102 20 0 DIADMN COc1cc(CN2CC[C@@H]2c2ccccc2)ccc1OC(F)F ZINC000484926579 1049087590 /nfs/dbraw/zinc/08/75/90/1049087590.db2.gz OFCXXPPNSBFUHA-OAHLLOKOSA-N 0 1 319.351 4.244 20 0 DIADMN FC1(F)Oc2ccc(CNCc3coc4ccccc34)cc2O1 ZINC001178782999 1049087565 /nfs/dbraw/zinc/08/75/65/1049087565.db2.gz MHYZHKHVOFDXNM-UHFFFAOYSA-N 0 1 317.291 4.044 20 0 DIADMN Cc1ccc(C2(CNCc3ncc(Cl)s3)CC2)c(C)c1 ZINC001178805099 1049090164 /nfs/dbraw/zinc/09/01/64/1049090164.db2.gz IVVLLGZHQTZJSZ-UHFFFAOYSA-N 0 1 306.862 4.235 20 0 DIADMN Cc1cccc(CCCN(C)Cc2nc(-c3ccccc3)c[nH]2)c1 ZINC001192414233 1049091773 /nfs/dbraw/zinc/09/17/73/1049091773.db2.gz VCUHWOYUSJFHMO-UHFFFAOYSA-N 0 1 319.452 4.450 20 0 DIADMN CC(C)(NCc1ccc2scnc2c1)c1ccccc1F ZINC001178810537 1049093032 /nfs/dbraw/zinc/09/30/32/1049093032.db2.gz MACUZAIAZYQQMF-UHFFFAOYSA-N 0 1 300.402 4.460 20 0 DIADMN CSc1ccc(CN2CC[C@@H]2COCc2ccccc2)cc1 ZINC001204142950 1049095633 /nfs/dbraw/zinc/09/56/33/1049095633.db2.gz ZXFRFDWPIMZSFZ-GOSISDBHSA-N 0 1 313.466 4.200 20 0 DIADMN C[N@@H+](Cc1cccn1C1CC1)Cc1ccc(C(F)(F)F)cc1 ZINC001204153731 1049096749 /nfs/dbraw/zinc/09/67/49/1049096749.db2.gz JPZGIQSKUSQJJL-UHFFFAOYSA-N 0 1 308.347 4.474 20 0 DIADMN CN(Cc1cccn1C1CC1)Cc1ccc(C(F)(F)F)cc1 ZINC001204153731 1049096762 /nfs/dbraw/zinc/09/67/62/1049096762.db2.gz JPZGIQSKUSQJJL-UHFFFAOYSA-N 0 1 308.347 4.474 20 0 DIADMN Cc1sc2nc([C@@H](C)N3CCCCCCC3)nc(N)c2c1C ZINC000011049601 1049097897 /nfs/dbraw/zinc/09/78/97/1049097897.db2.gz QBAOENIRAVUSNV-GFCCVEGCSA-N 0 1 318.490 4.217 20 0 DIADMN CC(C)[C@@H](NCc1cn(C)nc1Cl)c1ccc(Cl)cc1 ZINC000856764577 1049101806 /nfs/dbraw/zinc/10/18/06/1049101806.db2.gz GGGTUVAAAOINNS-CQSZACIVSA-N 0 1 312.244 4.214 20 0 DIADMN CCOc1cncc(CN[C@@H](C)c2ccccc2C(F)(F)F)c1 ZINC000856767762 1049102679 /nfs/dbraw/zinc/10/26/79/1049102679.db2.gz WVLAJVXAVZZRHM-LBPRGKRZSA-N 0 1 324.346 4.350 20 0 DIADMN CCOc1ccc(CN2CCCc3sccc3C2)cc1F ZINC001204169751 1049103145 /nfs/dbraw/zinc/10/31/45/1049103145.db2.gz APOLEILIPMAIGT-UHFFFAOYSA-N 0 1 305.418 4.234 20 0 DIADMN c1cc2ccc(-c3noc([C@@H]4NCC[C@H]5CCCC[C@@H]54)n3)cc2[nH]1 ZINC000904573431 1049103276 /nfs/dbraw/zinc/10/32/76/1049103276.db2.gz WZZWXLPDPNPRQJ-ISTRZQFTSA-N 0 1 322.412 4.059 20 0 DIADMN CC(C)c1ccc(C(C)(C)NCc2cn(C)nc2Cl)cc1 ZINC000856769172 1049103710 /nfs/dbraw/zinc/10/37/10/1049103710.db2.gz JEBYICYZZFNGIV-UHFFFAOYSA-N 0 1 305.853 4.222 20 0 DIADMN Cn1cc(CN[C@H](CC2CCC2)c2ccccc2)c(Cl)n1 ZINC000856775832 1049104151 /nfs/dbraw/zinc/10/41/51/1049104151.db2.gz JXQYXCMRIZEKQS-MRXNPFEDSA-N 0 1 303.837 4.095 20 0 DIADMN C[C@H](NCc1cn(C)nc1Cl)c1csc2ccccc21 ZINC000856769194 1049104476 /nfs/dbraw/zinc/10/44/76/1049104476.db2.gz JXMODCBVGHOVFN-JTQLQIEISA-N 0 1 305.834 4.139 20 0 DIADMN Cn1cc(CNC2(c3cccc(Cl)c3)CCCC2)c(Cl)n1 ZINC000856773563 1049104774 /nfs/dbraw/zinc/10/47/74/1049104774.db2.gz KNBVQWFKRKNHQA-UHFFFAOYSA-N 0 1 324.255 4.286 20 0 DIADMN Cn1cc(CN[C@H](CC2CCCC2)c2ccccc2)c(Cl)n1 ZINC000856775706 1049104815 /nfs/dbraw/zinc/10/48/15/1049104815.db2.gz QVTTYMLFTOKRQK-QGZVFWFLSA-N 0 1 317.864 4.485 20 0 DIADMN Fc1ccc(CNC2(c3ccc(C(F)(F)F)cc3)CCC2)nc1 ZINC000856785392 1049105547 /nfs/dbraw/zinc/10/55/47/1049105547.db2.gz OMMYPGXOBKUANY-UHFFFAOYSA-N 0 1 324.321 4.409 20 0 DIADMN C[C@H](NCCOC(C)(C)C)c1ccc(C(F)(F)F)nc1Cl ZINC000856778590 1049105577 /nfs/dbraw/zinc/10/55/77/1049105577.db2.gz OAGGZGCYGFTUQI-VIFPVBQESA-N 0 1 324.774 4.220 20 0 DIADMN CCCCOCCN[C@H](C)c1ccc(C(F)(F)F)nc1Cl ZINC000856780065 1049105870 /nfs/dbraw/zinc/10/58/70/1049105870.db2.gz DDLYVUHAFQXRHK-SNVBAGLBSA-N 0 1 324.774 4.221 20 0 DIADMN Cc1ccc(CN2CC[C@H](Oc3ccccc3Cl)C2)cc1F ZINC001192444621 1049106044 /nfs/dbraw/zinc/10/60/44/1049106044.db2.gz XQMYCUBSZFRNMD-HNNXBMFYSA-N 0 1 319.807 4.441 20 0 DIADMN Clc1cccc(CN2CC[C@@H](COCC3CC3)C2)c1Cl ZINC001204185814 1049107525 /nfs/dbraw/zinc/10/75/25/1049107525.db2.gz YHXAXNQLNABEQM-CYBMUJFWSA-N 0 1 314.256 4.242 20 0 DIADMN CCc1ccc(CNc2ccc3c(c2)nc(C)n3[C@@H](C)CO)cc1 ZINC001178904502 1049107868 /nfs/dbraw/zinc/10/78/68/1049107868.db2.gz XUTNRRXJEHKCRJ-AWEZNQCLSA-N 0 1 323.440 4.073 20 0 DIADMN CCOc1cc(CN2CC=C(c3ccccc3)CC2)ccc1OC ZINC001204190202 1049107863 /nfs/dbraw/zinc/10/78/63/1049107863.db2.gz ONZUGHAIPHEQLR-UHFFFAOYSA-N 0 1 323.436 4.383 20 0 DIADMN CC[C@@H](NCC(=O)Nc1ccc(C)c(C)c1)c1ccc(F)cc1 ZINC001192452673 1049108048 /nfs/dbraw/zinc/10/80/48/1049108048.db2.gz NVLDQIIZBJEHPZ-GOSISDBHSA-N 0 1 314.404 4.122 20 0 DIADMN COc1cccc([C@H]2CCCN(Cc3c(F)cccc3F)C2)c1 ZINC001204207995 1049111141 /nfs/dbraw/zinc/11/11/41/1049111141.db2.gz SLFWIZQWMCGLQQ-HNNXBMFYSA-N 0 1 317.379 4.353 20 0 DIADMN c1c(-c2nc(CC3CC3)no2)[nH]nc1-c1ccc2ccccc2c1 ZINC000904610284 1049114097 /nfs/dbraw/zinc/11/40/97/1049114097.db2.gz OXAFIOUPVOPQLG-UHFFFAOYSA-N 0 1 316.364 4.232 20 0 DIADMN Oc1cccc(C2CCN(Cc3cc(F)cc(F)c3)CC2)c1 ZINC001204232050 1049116152 /nfs/dbraw/zinc/11/61/52/1049116152.db2.gz DOAHGWKZXJFXQS-UHFFFAOYSA-N 0 1 303.352 4.050 20 0 DIADMN COc1ccccc1C1CCN(Cc2cc(F)cc(F)c2)CC1 ZINC001204231226 1049116414 /nfs/dbraw/zinc/11/64/14/1049116414.db2.gz VXONBFHDDLSCIJ-UHFFFAOYSA-N 0 1 317.379 4.353 20 0 DIADMN Cc1ccc(CN(Cc2cnn(C3CCC3)c2)C2CC2)cc1C ZINC001204238178 1049118722 /nfs/dbraw/zinc/11/87/22/1049118722.db2.gz OUZCCAKSMKZKAS-UHFFFAOYSA-N 0 1 309.457 4.390 20 0 DIADMN COc1cccc(OC)c1CN1CCC(c2cccs2)CC1 ZINC001204252236 1049121483 /nfs/dbraw/zinc/12/14/83/1049121483.db2.gz UAKLDRJDEOEGNW-UHFFFAOYSA-N 0 1 317.454 4.145 20 0 DIADMN COc1cccc(OC)c1C[N@H+]1CCC[C@H]1c1cccc(C)c1 ZINC001204247609 1049121942 /nfs/dbraw/zinc/12/19/42/1049121942.db2.gz LFEDQCQFFJDIBB-SFHVURJKSA-N 0 1 311.425 4.349 20 0 DIADMN COc1ccc(CN(Cc2ccccc2)C2CC2)c(OC)c1C ZINC001204262893 1049123018 /nfs/dbraw/zinc/12/30/18/1049123018.db2.gz IVDJCLSUWBWRCR-UHFFFAOYSA-N 0 1 311.425 4.177 20 0 DIADMN CCCCOc1ccccc1CNCc1cccc(C)c1OC ZINC001179044953 1049123907 /nfs/dbraw/zinc/12/39/07/1049123907.db2.gz WDADHAFRWKHCML-UHFFFAOYSA-N 0 1 313.441 4.472 20 0 DIADMN COc1ccc(OC)c(CN[C@@H](c2ccccc2F)C(C)C)c1 ZINC001179100273 1049127271 /nfs/dbraw/zinc/12/72/71/1049127271.db2.gz JGCQQNZIXNUMCR-LJQANCHMSA-N 0 1 317.404 4.330 20 0 DIADMN CC(=O)c1ccc2c(c1)CN(Cc1c(C)[nH]c3ccccc31)CC2 ZINC001204292345 1049129849 /nfs/dbraw/zinc/12/98/49/1049129849.db2.gz ACEOKUXBUKTWIC-UHFFFAOYSA-N 0 1 318.420 4.237 20 0 DIADMN CC[C@@H](NCc1cccc(COC)c1)c1cc(F)ccc1F ZINC001192690526 1049130637 /nfs/dbraw/zinc/13/06/37/1049130637.db2.gz UPAIWMYMLUCIQB-GOSISDBHSA-N 0 1 305.368 4.352 20 0 DIADMN O=c1oc2ccc(CN3CCCCC[C@@H]3c3ccco3)cc2o1 ZINC001204297506 1049132108 /nfs/dbraw/zinc/13/21/08/1049132108.db2.gz BEKSDZFWEDVDSS-CQSZACIVSA-N 0 1 313.353 4.096 20 0 DIADMN CCc1ccccc1CNCc1cc(-c2ccc(OC)cc2)no1 ZINC001179115887 1049133053 /nfs/dbraw/zinc/13/30/53/1049133053.db2.gz BHZYDOIXOHXEMN-UHFFFAOYSA-N 0 1 322.408 4.202 20 0 DIADMN CCc1ccc(C)nc1NCc1cc(C)c(Br)cn1 ZINC001179140838 1049134761 /nfs/dbraw/zinc/13/47/61/1049134761.db2.gz SYNLXUNUCNEKFW-UHFFFAOYSA-N 0 1 320.234 4.030 20 0 DIADMN Cc1cccn2c(CNCc3cc(Cl)cc(Cl)c3)cnc12 ZINC001179140573 1049135076 /nfs/dbraw/zinc/13/50/76/1049135076.db2.gz PQIQVDYUYJPBON-UHFFFAOYSA-N 0 1 320.223 4.239 20 0 DIADMN CCCCC[C@@H](CC)C(=O)N1CCCC[C@H]1c1cc(C)[nH]n1 ZINC001179151642 1049136411 /nfs/dbraw/zinc/13/64/11/1049136411.db2.gz DYFXOYDRGBDMFJ-WBVHZDCISA-N 0 1 305.466 4.378 20 0 DIADMN CCCCC[C@H](CC)C(=O)N1CCCC[C@@H]1c1cc(C)[nH]n1 ZINC001179151639 1049136442 /nfs/dbraw/zinc/13/64/42/1049136442.db2.gz DYFXOYDRGBDMFJ-DOTOQJQBSA-N 0 1 305.466 4.378 20 0 DIADMN Cc1ccc([C@@H](O)CN[C@@H](C)c2c(F)cccc2Cl)cc1 ZINC000775547636 1049137715 /nfs/dbraw/zinc/13/77/15/1049137715.db2.gz XSIOCNXEVVUACG-LRDDRELGSA-N 0 1 307.796 4.172 20 0 DIADMN Cc1cc([C@@H]2CCCCN2C(=O)[C@H](C)CC2CCCCC2)n[nH]1 ZINC001179159483 1049137960 /nfs/dbraw/zinc/13/79/60/1049137960.db2.gz IFUCPAAAVBTVTQ-KDOFPFPSSA-N 0 1 317.477 4.378 20 0 DIADMN COc1nc(CN2C[C@@H](C)C[C@@H]2c2cccc(F)c2)ccc1C ZINC001204308343 1049138331 /nfs/dbraw/zinc/13/83/31/1049138331.db2.gz SKVGSMPHHROFLW-SCLBCKFNSA-N 0 1 314.404 4.121 20 0 DIADMN CCCOc1ccc(CN(C)CCC(=O)c2cccs2)cc1 ZINC001204308571 1049139037 /nfs/dbraw/zinc/13/90/37/1049139037.db2.gz ZCAIGZWUHNKTCS-UHFFFAOYSA-N 0 1 317.454 4.242 20 0 DIADMN Cc1ccccc1[C@H](O)CN[C@@H](C)c1c(F)cccc1Cl ZINC000775550107 1049139730 /nfs/dbraw/zinc/13/97/30/1049139730.db2.gz XQCKSCXCEBEEAM-BLLLJJGKSA-N 0 1 307.796 4.172 20 0 DIADMN C[C@@H](NC[C@H](O)c1cccc(F)c1)c1c(F)cccc1Cl ZINC000775549419 1049141350 /nfs/dbraw/zinc/14/13/50/1049141350.db2.gz NLBXYEFGCGTXLB-BMIGLBTASA-N 0 1 311.759 4.002 20 0 DIADMN COc1cccc(CNCc2nc3ccccc3n2C(C)C)c1C ZINC001179205161 1049141487 /nfs/dbraw/zinc/14/14/87/1049141487.db2.gz KXTQIMJFCKFWBU-UHFFFAOYSA-N 0 1 323.440 4.224 20 0 DIADMN COc1ccc(F)c(CNCc2ccc(C(C)(C)C)cc2)c1 ZINC001179216947 1049142869 /nfs/dbraw/zinc/14/28/69/1049142869.db2.gz TWWSCKXZFMQIRC-UHFFFAOYSA-N 0 1 301.405 4.422 20 0 DIADMN Cc1c(Cl)ccc(CN2CCC[C@@H]3COCC[C@@H]32)c1Cl ZINC001204333370 1049145289 /nfs/dbraw/zinc/14/52/89/1049145289.db2.gz CGHBAHJHTBTBPR-HIFRSBDPSA-N 0 1 314.256 4.303 20 0 DIADMN CCN(Cc1ccc(OC)c(OC)c1)[C@H](C)c1ccccc1F ZINC000485003506 1049148882 /nfs/dbraw/zinc/14/88/82/1049148882.db2.gz DMRZAYKMLGPGRC-CQSZACIVSA-N 0 1 317.404 4.426 20 0 DIADMN CCOc1ccc(CN2CC=C(c3ccccc3)CC2)cc1OC ZINC001204361226 1049149168 /nfs/dbraw/zinc/14/91/68/1049149168.db2.gz DMKRJWHIMRXICP-UHFFFAOYSA-N 0 1 323.436 4.383 20 0 DIADMN Cc1c2ccccc2oc1[C@H](C)N[C@H](C)C(=O)Nc1ccccc1 ZINC000485000906 1049149480 /nfs/dbraw/zinc/14/94/80/1049149480.db2.gz ZELGLWPAVCGTPC-LSDHHAIUSA-N 0 1 322.408 4.419 20 0 DIADMN CC[C@H](NCc1cc(C(=O)OC)cs1)c1ccc(C)c(F)c1 ZINC001192881359 1049150687 /nfs/dbraw/zinc/15/06/87/1049150687.db2.gz RYPXDYCTOIVKLI-INIZCTEOSA-N 0 1 321.417 4.223 20 0 DIADMN CC(C)(C)OC(=O)c1ccc(CN[C@@H]2CCCC[C@@H]2F)s1 ZINC001179303958 1049151502 /nfs/dbraw/zinc/15/15/02/1049151502.db2.gz FDXSKGJSKAQUHW-QWHCGFSZSA-N 0 1 313.438 4.074 20 0 DIADMN CCCN(CCC)C(=O)CN[C@@H](C)c1oc2ccccc2c1C ZINC000485023304 1049153214 /nfs/dbraw/zinc/15/32/14/1049153214.db2.gz GDUGVPYVUPCGAN-HNNXBMFYSA-N 0 1 316.445 4.040 20 0 DIADMN COc1ccc(NCc2[nH]nc3ccccc32)c2ccccc12 ZINC001179308192 1049153462 /nfs/dbraw/zinc/15/34/62/1049153462.db2.gz NMMLXQQELSBIKT-UHFFFAOYSA-N 0 1 303.365 4.337 20 0 DIADMN C[C@@H]1CCN(Cc2c(Cl)cc(Cl)cc2N(C)C)[C@H]1C 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C[C@@H](c1ccccn1)[N@H+]1CCC[C@H](Oc2ccc3c(c2)CCC3)C1 ZINC001225267956 1052765857 /nfs/dbraw/zinc/76/58/57/1052765857.db2.gz SZLGTTSTWUTDRY-JXFKEZNVSA-N 0 1 322.452 4.175 20 0 DIADMN COc1ccc(O[C@H]2CC[N@@H+](Cc3ccccc3)C2)c(Cl)c1 ZINC001225344605 1052777653 /nfs/dbraw/zinc/77/76/53/1052777653.db2.gz JWXBBYWLIQGJCX-INIZCTEOSA-N 0 1 317.816 4.002 20 0 DIADMN COc1ccc(O[C@H]2CCN(Cc3ccccc3)C2)c(Cl)c1 ZINC001225344605 1052777659 /nfs/dbraw/zinc/77/76/59/1052777659.db2.gz JWXBBYWLIQGJCX-INIZCTEOSA-N 0 1 317.816 4.002 20 0 DIADMN Cc1ccc(O[C@H]2CCN(Cc3ccccc3Cl)C2)c(C)n1 ZINC001225430382 1052788198 /nfs/dbraw/zinc/78/81/98/1052788198.db2.gz AWEVEUNERPRLCO-INIZCTEOSA-N 0 1 316.832 4.005 20 0 DIADMN COc1ccc(CN(C)[C@@H](C)c2ccco2)cc1Br ZINC000069519665 1052792381 /nfs/dbraw/zinc/79/23/81/1052792381.db2.gz IFXKZUHAZWDWFX-NSHDSACASA-N 0 1 324.218 4.244 20 0 DIADMN Cn1ccnc1[C@H]1CCC[N@@H+](Cc2cc(Cl)ccc2Cl)C1 ZINC000444792142 1052793157 /nfs/dbraw/zinc/79/31/57/1052793157.db2.gz MQHIIUAGSCWDOF-LBPRGKRZSA-N 0 1 324.255 4.107 20 0 DIADMN Cn1ccnc1[C@H]1CCCN(Cc2cc(Cl)ccc2Cl)C1 ZINC000444792142 1052793164 /nfs/dbraw/zinc/79/31/64/1052793164.db2.gz MQHIIUAGSCWDOF-LBPRGKRZSA-N 0 1 324.255 4.107 20 0 DIADMN Cn1ccnc1[C@H]1CCCN(Cc2cc(Cl)cc(Cl)c2)C1 ZINC000352350570 1052798313 /nfs/dbraw/zinc/79/83/13/1052798313.db2.gz RRFLJANPJICCIT-ZDUSSCGKSA-N 0 1 324.255 4.107 20 0 DIADMN CC[C@@H](c1ccccc1)[C@H]1CCCN1Cc1noc(C2CC2)n1 ZINC000069679320 1052798703 /nfs/dbraw/zinc/79/87/03/1052798703.db2.gz YSKPFNMRKLRKJG-DLBZAZTESA-N 0 1 311.429 4.105 20 0 DIADMN CCOc1ccc([C@@H](NCc2cccnc2)c2ccccc2)cc1 ZINC000069787258 1052805461 /nfs/dbraw/zinc/80/54/61/1052805461.db2.gz NYDOBVIUKQTSDV-NRFANRHFSA-N 0 1 318.420 4.360 20 0 DIADMN C[C@H](N[C@H]1CCCC12CCC2)c1nc(C2CCCCC2)no1 ZINC000556151906 1052811414 /nfs/dbraw/zinc/81/14/14/1052811414.db2.gz JFHWWXWVQISNOA-ZFWWWQNUSA-N 0 1 303.450 4.491 20 0 DIADMN CCN(C(=O)c1cc(F)cc2[nH]cnc21)c1ccc(Cl)cc1 ZINC000918562299 1052812264 /nfs/dbraw/zinc/81/22/64/1052812264.db2.gz UGENLXNZBJBEQK-UHFFFAOYSA-N 0 1 317.751 4.022 20 0 DIADMN CSc1ccccc1O[C@@H]1CCN([C@@H](C)c2ccccn2)C1 ZINC001225670614 1052815137 /nfs/dbraw/zinc/81/51/37/1052815137.db2.gz KPBXXRISCPLQGK-LSDHHAIUSA-N 0 1 314.454 4.018 20 0 DIADMN CO[C@H](c1ccccc1Cl)[C@H](C)N[C@H](C)c1ccncc1F ZINC000556172847 1052815973 /nfs/dbraw/zinc/81/59/73/1052815973.db2.gz ARXNQMWLSJNTEG-PEBVRCNWSA-N 0 1 322.811 4.301 20 0 DIADMN c1ccc(CN2CCC(Oc3nc4ccccc4s3)CC2)cc1 ZINC001225692761 1052817775 /nfs/dbraw/zinc/81/77/75/1052817775.db2.gz HMJPGDWDKNYAIT-UHFFFAOYSA-N 0 1 324.449 4.340 20 0 DIADMN Cc1cc([C@H](C)N[C@H](C)c2ccc(F)c3ccccc32)nn1C ZINC000556194828 1052818598 /nfs/dbraw/zinc/81/85/98/1052818598.db2.gz ZNFUUPGIKPBAOH-KGLIPLIRSA-N 0 1 311.404 4.433 20 0 DIADMN C[C@H](c1ccccn1)N1CC[C@@H](Oc2cccc(Cl)c2F)C1 ZINC001225724893 1052820940 /nfs/dbraw/zinc/82/09/40/1052820940.db2.gz JORVSWDRMLWNKN-CHWSQXEVSA-N 0 1 320.795 4.088 20 0 DIADMN CC[C@H](c1ccncc1)[N@@H+](C)Cc1cc(Cl)ccc1OC ZINC000130113577 1052823919 /nfs/dbraw/zinc/82/39/19/1052823919.db2.gz ZRUDCRLTUSWVQQ-MRXNPFEDSA-N 0 1 304.821 4.327 20 0 DIADMN CC[C@H](c1ccncc1)N(C)Cc1cc(Cl)ccc1OC ZINC000130113577 1052823924 /nfs/dbraw/zinc/82/39/24/1052823924.db2.gz ZRUDCRLTUSWVQQ-MRXNPFEDSA-N 0 1 304.821 4.327 20 0 DIADMN C[C@@H](N[C@H]1CCC[C@H]1F)c1ccc(Br)c(F)c1 ZINC000556257492 1052828375 /nfs/dbraw/zinc/82/83/75/1052828375.db2.gz HBOPDZIPDUMWOR-DYLAAIIWSA-N 0 1 304.178 4.129 20 0 DIADMN Clc1cc(O[C@H]2CCN(Cc3ccccc3Cl)C2)ccn1 ZINC001225780778 1052830400 /nfs/dbraw/zinc/83/04/00/1052830400.db2.gz DZJOOUWNRIHBDM-AWEZNQCLSA-N 0 1 323.223 4.042 20 0 DIADMN Fc1ccc(O[C@H]2CCN(Cc3ccccc3)C2)c(Cl)c1 ZINC001225888204 1052842648 /nfs/dbraw/zinc/84/26/48/1052842648.db2.gz JVQHDBIGUFOKHZ-HNNXBMFYSA-N 0 1 305.780 4.132 20 0 DIADMN CCN1CCC[C@H](Oc2cccc(C(F)(F)F)c2Cl)C1 ZINC001225887879 1052842699 /nfs/dbraw/zinc/84/26/99/1052842699.db2.gz GDYPVLKINSUKBU-JTQLQIEISA-N 0 1 307.743 4.222 20 0 DIADMN CCC[C@@H]1[C@H](C)CCCN1C(=O)c1cnc(-c2ccccc2)[nH]1 ZINC000556382357 1052845622 /nfs/dbraw/zinc/84/56/22/1052845622.db2.gz UCUXTNRLMNBQAY-RHSMWYFYSA-N 0 1 311.429 4.118 20 0 DIADMN COCC1(NCc2csc(-c3ccc(Cl)cc3)n2)CCC1 ZINC000556413879 1052850028 /nfs/dbraw/zinc/85/00/28/1052850028.db2.gz OVABSOMGGCUYOD-UHFFFAOYSA-N 0 1 322.861 4.122 20 0 DIADMN C[C@@H]1CN(Cc2ccc(C(F)(F)F)cn2)[C@@H]1c1ccccc1 ZINC000556497128 1052856416 /nfs/dbraw/zinc/85/64/16/1052856416.db2.gz FCWATVAAGPGGQN-WBMJQRKESA-N 0 1 306.331 4.293 20 0 DIADMN COc1ccc2cc([C@H](C)Oc3cccc4[nH]nnc43)ccc2c1 ZINC001225991219 1052856770 /nfs/dbraw/zinc/85/67/70/1052856770.db2.gz XCOVZZNNUASXNO-LBPRGKRZSA-N 0 1 319.364 4.260 20 0 DIADMN C[C@@H](Oc1cccc2[nH]nnc21)c1cccc(C(F)(F)F)c1 ZINC001225997206 1052857436 /nfs/dbraw/zinc/85/74/36/1052857436.db2.gz OKXQOVAIANVRCZ-SECBINFHSA-N 0 1 307.275 4.117 20 0 DIADMN c1ccc(C(Oc2cccc3[nH]nnc32)c2ccccc2)cc1 ZINC001225997309 1052857857 /nfs/dbraw/zinc/85/78/57/1052857857.db2.gz 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/nfs/dbraw/zinc/86/44/01/1052864401.db2.gz NTKREPLJHONUBU-UHFFFAOYSA-N 0 1 321.380 4.116 20 0 DIADMN CCN1CC[C@@H](Oc2ccc3ccccc3c2Br)C1 ZINC001226085719 1052866426 /nfs/dbraw/zinc/86/64/26/1052866426.db2.gz LCUWNZUZNDLVHU-CYBMUJFWSA-N 0 1 320.230 4.075 20 0 DIADMN COc1ncc([C@@H](C)N[C@H]2CCc3ccc(F)cc32)cc1Cl ZINC000556586645 1052868377 /nfs/dbraw/zinc/86/83/77/1052868377.db2.gz PSBRCYVJTHCXGG-HWPZZCPQSA-N 0 1 320.795 4.221 20 0 DIADMN Clc1cc(Cl)cc(CN2CCC[C@@H]2[C@@H]2CCCO2)c1 ZINC000556605858 1052868976 /nfs/dbraw/zinc/86/89/76/1052868976.db2.gz KRYCEDSOWYCJCN-CABCVRRESA-N 0 1 300.229 4.137 20 0 DIADMN Cn1cccc1C[N@@H+](Cc1cccs1)C1Cc2ccccc2C1 ZINC000556620230 1052872199 /nfs/dbraw/zinc/87/21/99/1052872199.db2.gz XJKNMRSFOCIVFS-UHFFFAOYSA-N 0 1 322.477 4.256 20 0 DIADMN OCc1ccc(CN2CC3(CCCCC3)[C@H]2c2ccccc2)o1 ZINC000556782413 1052881732 /nfs/dbraw/zinc/88/17/32/1052881732.db2.gz XXTJYJUMYRPIJW-LJQANCHMSA-N 0 1 311.425 4.279 20 0 DIADMN CC(C)CCc1ccccc1NS(=O)(=O)c1ccsc1 ZINC000556793744 1052882911 /nfs/dbraw/zinc/88/29/11/1052882911.db2.gz SZEVLWXZFBVICA-UHFFFAOYSA-N 0 1 309.456 4.138 20 0 DIADMN FC(F)(F)c1ccc2c(c1)CC[C@H]2Oc1n[nH]c2ncccc12 ZINC001226305150 1052885450 /nfs/dbraw/zinc/88/54/50/1052885450.db2.gz HVRZXITZBRSQTQ-CYBMUJFWSA-N 0 1 319.286 4.043 20 0 DIADMN Cc1ccc(OC(F)F)c(CN(Cc2ccccn2)C(C)C)c1 ZINC000556814328 1052886141 /nfs/dbraw/zinc/88/61/41/1052886141.db2.gz MHCIHMSCLGHWHI-UHFFFAOYSA-N 0 1 320.383 4.402 20 0 DIADMN O=c1ccnc(O[C@H](c2ccccc2)c2ccc(Cl)cc2)[nH]1 ZINC001226325300 1052886498 /nfs/dbraw/zinc/88/64/98/1052886498.db2.gz ZCVGHHSMOIKOMA-MRXNPFEDSA-N 0 1 312.756 4.004 20 0 DIADMN Cc1ccc2nc(CN[C@@H](c3ncc[nH]3)C3CCCCC3)[nH]c2c1 ZINC000556872230 1052891758 /nfs/dbraw/zinc/89/17/58/1052891758.db2.gz XXVHTSQYOWEUSC-GOSISDBHSA-N 0 1 323.444 4.006 20 0 DIADMN COc1ccc([C@@H](C)Oc2cc(N)nc3ccccc32)c(F)c1 ZINC001226423205 1052894928 /nfs/dbraw/zinc/89/49/28/1052894928.db2.gz UNJSTJZNZMWGKL-LLVKDONJSA-N 0 1 312.344 4.105 20 0 DIADMN CC(C)(C)n1cc(CN2CCCCC[C@@H]2c2ccco2)cn1 ZINC000556900736 1052895516 /nfs/dbraw/zinc/89/55/16/1052895516.db2.gz FUANAFVPKCGEJW-MRXNPFEDSA-N 0 1 301.434 4.348 20 0 DIADMN C[C@H]1CN(Cc2cnc(-c3ccncc3)s2)[C@H]1c1ccccc1 ZINC000556916271 1052898151 /nfs/dbraw/zinc/89/81/51/1052898151.db2.gz SDKXPSBFBFLQLS-KBXCAEBGSA-N 0 1 321.449 4.398 20 0 DIADMN Cc1cc(Cl)cc(C(=O)Nc2ccc(CN(C)C)c(F)c2)c1 ZINC000763445033 1052898799 /nfs/dbraw/zinc/89/87/99/1052898799.db2.gz OBEPMFOIEDHKJZ-UHFFFAOYSA-N 0 1 320.795 4.101 20 0 DIADMN CC(C)[C@@H]1CN(Cc2cnc(C3CCCCC3)s2)CCCO1 ZINC000556980334 1052908347 /nfs/dbraw/zinc/90/83/47/1052908347.db2.gz BJIFMSZSFCZLBH-KRWDZBQOSA-N 0 1 322.518 4.438 20 0 DIADMN C[C@H](c1ccccn1)N1CC[C@@H](Oc2cc(Cl)ccc2F)C1 ZINC001226696926 1052922753 /nfs/dbraw/zinc/92/27/53/1052922753.db2.gz GMGYMPGIDBFXDH-TZMCWYRMSA-N 0 1 320.795 4.088 20 0 DIADMN C[C@@H](Oc1nc2ccc(F)cc2[nH]1)c1cc(-c2ccccc2)no1 ZINC001226703492 1052923598 /nfs/dbraw/zinc/92/35/98/1052923598.db2.gz CPHQKYFKQDPLQS-LLVKDONJSA-N 0 1 323.327 4.497 20 0 DIADMN Cc1c(F)cccc1O[C@H]1CCCN([C@H](C)c2ccccn2)C1 ZINC001226773989 1052930447 /nfs/dbraw/zinc/93/04/47/1052930447.db2.gz JYMFSTBBUIJVOU-CVEARBPZSA-N 0 1 314.404 4.134 20 0 DIADMN CC(C)COc1cccc(NC(=O)c2c(O)cccc2Cl)c1 ZINC000920453710 1052940045 /nfs/dbraw/zinc/94/00/45/1052940045.db2.gz JRJNLPZXBNLTHN-UHFFFAOYSA-N 0 1 319.788 4.333 20 0 DIADMN CCCOc1cccc(NC(=O)c2c(O)cccc2Cl)c1 ZINC000920446957 1052940101 /nfs/dbraw/zinc/94/01/01/1052940101.db2.gz LNSKHHNBAFPSKR-UHFFFAOYSA-N 0 1 305.761 4.087 20 0 DIADMN Cc1ccc(-c2cc(-c3nc(-c4ccc(F)cc4)no3)[nH]n2)cc1 ZINC000139651586 1052945813 /nfs/dbraw/zinc/94/58/13/1052945813.db2.gz HYTXFOYNCYVGAS-UHFFFAOYSA-N 0 1 320.327 4.241 20 0 DIADMN COc1cc(C)nc(CN[C@H](c2cccc(F)c2)C(C)(C)C)c1 ZINC000411474316 1052947826 /nfs/dbraw/zinc/94/78/26/1052947826.db2.gz LEZVHNYOAWZUSX-GOSISDBHSA-N 0 1 316.420 4.415 20 0 DIADMN CCCCCC[C@H](CCCC)Oc1[nH]c(=O)nc2cnccc21 ZINC001226976205 1052950021 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308.168 4.405 20 0 DIADMN c1ccc2c(c1)Oc1ccccc1C2Oc1nnc2c[nH]ccc1-2 ZINC001228990759 1053217830 /nfs/dbraw/zinc/21/78/30/1053217830.db2.gz TUYMIJXIGWRGPU-UHFFFAOYSA-N 0 1 315.332 4.232 20 0 DIADMN C[C@@H](Oc1nnc2c[nH]ccc1-2)c1ccc(C(F)(F)F)cc1 ZINC001228996453 1053219987 /nfs/dbraw/zinc/21/99/87/1053219987.db2.gz QZHLDNVQYPADPB-SECBINFHSA-N 0 1 307.275 4.117 20 0 DIADMN C[C@H](Oc1nnc2c[nH]ccc1-2)c1ccccc1C(F)(F)F ZINC001228995960 1053220516 /nfs/dbraw/zinc/22/05/16/1053220516.db2.gz JLQRLVCAKZZVDP-VIFPVBQESA-N 0 1 307.275 4.117 20 0 DIADMN CC(C)c1ncc(C(=O)N2CCCC3(C2)CCCCCC3)[nH]1 ZINC001319175854 1053223944 /nfs/dbraw/zinc/22/39/44/1053223944.db2.gz LPFSMAZXCIDNJU-UHFFFAOYSA-N 0 1 303.450 4.110 20 0 DIADMN CS[C@@H]1CC[C@H](N(C)Cc2coc(-c3ccccc3)n2)C1 ZINC001319182260 1053225346 /nfs/dbraw/zinc/22/53/46/1053225346.db2.gz WWJBIGJATWSPPP-JKSUJKDBSA-N 0 1 302.443 4.058 20 0 DIADMN COc1cc(F)c([C@@H](C)NCc2c(C)cccc2C)cc1OC ZINC000090468802 1053232900 /nfs/dbraw/zinc/23/29/00/1053232900.db2.gz CQGOQLDCNCLHTK-CQSZACIVSA-N 0 1 317.404 4.311 20 0 DIADMN CCOc1ccc(C(C)=O)cc1CN(C)[C@@H]1CC[C@@H](SC)C1 ZINC001319326572 1053235955 /nfs/dbraw/zinc/23/59/55/1053235955.db2.gz LZHXPHPDQYIOQT-IAGOWNOFSA-N 0 1 321.486 4.004 20 0 DIADMN COc1ccc(C[C@H](C)N(C)Cc2csc(C3CC3)n2)cc1 ZINC001319529100 1053247903 /nfs/dbraw/zinc/24/79/03/1053247903.db2.gz OTAAMFBNJBUSRI-ZDUSSCGKSA-N 0 1 316.470 4.092 20 0 DIADMN CC[C@H](CSC)N(C)Cc1coc(-c2ccc(F)cc2)n1 ZINC000091099324 1053252293 /nfs/dbraw/zinc/25/22/93/1053252293.db2.gz GRJKSRKQLNHIHL-OAHLLOKOSA-N 0 1 308.422 4.054 20 0 DIADMN CC[C@@H](CSC)N(C)Cc1nc(-c2cccs2)oc1C ZINC000091097256 1053252325 /nfs/dbraw/zinc/25/23/25/1053252325.db2.gz ULUKSZSGPVGJQJ-LBPRGKRZSA-N 0 1 310.488 4.285 20 0 DIADMN Fc1ccc(-n2ccc(CN[C@H](c3ccccc3)C3CC3)n2)cc1 ZINC000091408836 1053263468 /nfs/dbraw/zinc/26/34/68/1053263468.db2.gz CHOCDOCNMKUQKM-HXUWFJFHSA-N 0 1 321.399 4.252 20 0 DIADMN CC[C@H](N[C@H](COC)c1ccc(F)c(F)c1)c1ccccc1 ZINC000091413793 1053263575 /nfs/dbraw/zinc/26/35/75/1053263575.db2.gz ASCYNRIZPCPVJG-ZWKOTPCHSA-N 0 1 305.368 4.393 20 0 DIADMN COC[C@H](N[C@@H](C)c1ccc(C)cc1)c1ccc(F)c(F)c1 ZINC000091413788 1053263726 /nfs/dbraw/zinc/26/37/26/1053263726.db2.gz IKEKCNFRXSSNFB-UGSOOPFHSA-N 0 1 305.368 4.312 20 0 DIADMN c1csc(C(N[C@H]2CCCc3n[nH]cc32)c2cccs2)c1 ZINC000353630529 1053266672 /nfs/dbraw/zinc/26/66/72/1053266672.db2.gz IPELAMKFCHGJRQ-LBPRGKRZSA-N 0 1 315.467 4.289 20 0 DIADMN CCOc1cc(CN(C)Cc2cc3ccccc3[nH]2)ccc1OC ZINC001319718535 1053267326 /nfs/dbraw/zinc/26/73/26/1053267326.db2.gz QZEQMWCLNHLHKV-UHFFFAOYSA-N 0 1 324.424 4.207 20 0 DIADMN Fc1ccc(C2CC2)cc1CNCc1scnc1C1CC1 ZINC000449373375 1053269831 /nfs/dbraw/zinc/26/98/31/1053269831.db2.gz QSSFIPQRKTYBEF-UHFFFAOYSA-N 0 1 302.418 4.327 20 0 DIADMN CC[C@@H](CN[C@@H](C)c1nccs1)Oc1ccccc1Cl ZINC000091733310 1053270441 /nfs/dbraw/zinc/27/04/41/1053270441.db2.gz BYOAAERPNRCHOR-RYUDHWBXSA-N 0 1 310.850 4.305 20 0 DIADMN CC[C@H](C)Oc1cc(CN(C)CCC(F)(F)F)ccc1OC ZINC001319816292 1053275563 /nfs/dbraw/zinc/27/55/63/1053275563.db2.gz VXGXMZMTVKPPBH-LBPRGKRZSA-N 0 1 319.367 4.257 20 0 DIADMN Cc1ccccc1C(F)(F)C(=O)Nc1cccc(Cl)c1O ZINC001319843832 1053280477 /nfs/dbraw/zinc/28/04/77/1053280477.db2.gz ZTYLAKLHQBNOAR-UHFFFAOYSA-N 0 1 311.715 4.085 20 0 DIADMN C[C@H](NC[C@H](O)c1ccccc1F)c1c(F)cccc1Cl ZINC000181747763 1053288445 /nfs/dbraw/zinc/28/84/45/1053288445.db2.gz GASQLYSAJNBFMK-BONVTDFDSA-N 0 1 311.759 4.002 20 0 DIADMN CC(C)(C)OC(=O)Nc1ccc(CN2CC(C)(C)C2(C)C)cn1 ZINC001319948495 1053288511 /nfs/dbraw/zinc/28/85/11/1053288511.db2.gz MICSQCKQZJUPIX-UHFFFAOYSA-N 0 1 319.449 4.049 20 0 DIADMN Cc1ccc([C@@H](C)NCc2cnc(-c3ccccc3)nc2)cc1 ZINC000069755979 1053290145 /nfs/dbraw/zinc/29/01/45/1053290145.db2.gz GXEIFFPYRJHXAE-MRXNPFEDSA-N 0 1 303.409 4.303 20 0 DIADMN Cc1cnc(CN2CCC(Cc3ccc(C)cc3)CC2)s1 ZINC001320012899 1053294230 /nfs/dbraw/zinc/29/42/30/1053294230.db2.gz BAIWULZVHAOOAU-UHFFFAOYSA-N 0 1 300.471 4.215 20 0 DIADMN Cc1c(C(=O)N(C)c2ccc3ccccc3c2)ccc2cncn21 ZINC001320026734 1053295797 /nfs/dbraw/zinc/29/57/97/1053295797.db2.gz RGJQDLQRFSGLMY-UHFFFAOYSA-N 0 1 315.376 4.073 20 0 DIADMN CC[C@H](NCc1cc(C(=O)OC)sc1C)c1ccc(F)cc1 ZINC001320040353 1053297812 /nfs/dbraw/zinc/29/78/12/1053297812.db2.gz ZAXXAPGVMBHVDT-HNNXBMFYSA-N 0 1 321.417 4.223 20 0 DIADMN CN(C)c1cccc(Cl)c1CN1CCC[C@H]1c1ccccn1 ZINC001320057233 1053299972 /nfs/dbraw/zinc/29/99/72/1053299972.db2.gz CGUASJJBNTWYQQ-SFHVURJKSA-N 0 1 315.848 4.138 20 0 DIADMN COc1cccc2cc(CNCc3cnc(Cl)c(C)c3)oc21 ZINC001200023418 1053319284 /nfs/dbraw/zinc/31/92/84/1053319284.db2.gz MWJRTXFMTVNECU-UHFFFAOYSA-N 0 1 316.788 4.088 20 0 DIADMN CC[C@@H](C)Oc1c(O)ccc2c(=O)cc(-c3ccccc3)oc21 ZINC001229431878 1053319609 /nfs/dbraw/zinc/31/96/09/1053319609.db2.gz IGKSWGJYWYZLFZ-GFCCVEGCSA-N 0 1 310.349 4.343 20 0 DIADMN Cc1nc2[nH]cnc2c(O[C@@H](C)c2ccc(Cl)c(Cl)c2)n1 ZINC001229438700 1053320302 /nfs/dbraw/zinc/32/03/02/1053320302.db2.gz TVSZLBIZSNKFSD-ZETCQYMHSA-N 0 1 323.183 4.108 20 0 DIADMN Cc1nc2[nH]cnc2c(O[C@@H](C)c2c(Cl)cccc2Cl)n1 ZINC001229438277 1053320763 /nfs/dbraw/zinc/32/07/63/1053320763.db2.gz GYWXLXWIVSKBTD-ZETCQYMHSA-N 0 1 323.183 4.108 20 0 DIADMN Cc1nc2[nH]cnc2c(O[C@H](C)c2cc(Cl)ccc2Cl)n1 ZINC001229438355 1053321009 /nfs/dbraw/zinc/32/10/09/1053321009.db2.gz IYFICSFVAMPELP-SSDOTTSWSA-N 0 1 323.183 4.108 20 0 DIADMN Cc1nc2[nH]cnc2c(O[C@@H](C)c2cc3ccccc3s2)n1 ZINC001229441687 1053322149 /nfs/dbraw/zinc/32/21/49/1053322149.db2.gz WFXCFXJMHRSALP-VIFPVBQESA-N 0 1 310.382 4.016 20 0 DIADMN CC(C)(C)Sc1ccccc1NC(=S)NC[C@@H]1CCCO1 ZINC001200031378 1053323632 /nfs/dbraw/zinc/32/36/32/1053323632.db2.gz YKWHDDIVKMJVJR-LBPRGKRZSA-N 0 1 324.515 4.043 20 0 DIADMN Cc1ccc2nc(CNC(=O)/C=C\C3CCCCCC3)[nH]c2c1 ZINC001361108851 1053324413 /nfs/dbraw/zinc/32/44/13/1053324413.db2.gz ILKSVYPHEDKUCV-LUAWRHEFSA-N 0 1 311.429 4.014 20 0 DIADMN Cc1cccc2c1CC[C@@H]2N[C@@H]1CCCc2cn(C(C)C)nc21 ZINC001320387574 1053329967 /nfs/dbraw/zinc/32/99/67/1053329967.db2.gz UMMJZLQFZGEIEA-RBUKOAKNSA-N 0 1 309.457 4.427 20 0 DIADMN CC(C)n1ncc2c1[C@H](NCc1cc(F)cc(Cl)c1)CCC2 ZINC001320453673 1053335491 /nfs/dbraw/zinc/33/54/91/1053335491.db2.gz KTSNBXBYZKGVOS-MRXNPFEDSA-N 0 1 321.827 4.424 20 0 DIADMN COc1cc(CN2CC(C)(C)C2(C)C)c(SC)cc1OC ZINC001320509805 1053338834 /nfs/dbraw/zinc/33/88/34/1053338834.db2.gz SEOABJFGDLAVJX-UHFFFAOYSA-N 0 1 309.475 4.046 20 0 DIADMN CCCN1CCCC[C@H]1C(=O)Nc1cccc(C(C)(F)F)c1 ZINC001320511521 1053339046 /nfs/dbraw/zinc/33/90/46/1053339046.db2.gz ZHWWYMWOTNYESM-HNNXBMFYSA-N 0 1 310.388 4.001 20 0 DIADMN COC[C@@]1(C)CCN(c2ccnc3cc(C(F)(F)F)ccc32)C1 ZINC000450604014 1053345576 /nfs/dbraw/zinc/34/55/76/1053345576.db2.gz IPMDVRUNAWOTLK-INIZCTEOSA-N 0 1 324.346 4.116 20 0 DIADMN O=C(c1cc(Cl)c2ccccc2c1O)N1CC2CCC1CC2 ZINC001320572169 1053346537 /nfs/dbraw/zinc/34/65/37/1053346537.db2.gz RFCKEADTFKIJMR-UHFFFAOYSA-N 0 1 315.800 4.213 20 0 DIADMN COc1ccccc1[C@H]1CCCN1Cc1cnc(C2CC2)s1 ZINC000093008457 1053359067 /nfs/dbraw/zinc/35/90/67/1053359067.db2.gz JEAGYLFINLVHOE-MRXNPFEDSA-N 0 1 314.454 4.366 20 0 DIADMN COCc1cccc(CN[C@H](c2ccccc2)c2cccnc2)c1 ZINC001200077123 1053359204 /nfs/dbraw/zinc/35/92/04/1053359204.db2.gz LUVOMRQLIFJMAD-OAQYLSRUSA-N 0 1 318.420 4.107 20 0 DIADMN CC(C)(C)[C@H](NCc1cnc(Cl)cn1)c1cccc(F)c1 ZINC001320784059 1053362302 /nfs/dbraw/zinc/36/23/02/1053362302.db2.gz RPVXLODKOCRTGQ-OAHLLOKOSA-N 0 1 307.800 4.146 20 0 DIADMN C[C@H](C/N=C/c1cc(Cl)cc(Cl)c1O)c1nccs1 ZINC000182168552 1053363403 /nfs/dbraw/zinc/36/34/03/1053363403.db2.gz HZINTURDHWSCNQ-XUNMKLQISA-N 0 1 315.225 4.378 20 0 DIADMN CC[C@](C)(NCc1nc(-c2ccccc2)c[nH]1)c1ccccc1 ZINC001320866855 1053368476 /nfs/dbraw/zinc/36/84/76/1053368476.db2.gz UJWQJGGNSVCIJQ-FQEVSTJZSA-N 0 1 305.425 4.492 20 0 DIADMN CCC(CC)[C@H](C)C(=O)Nc1nc(-c2ccccc2Cl)n[nH]1 ZINC001434866870 1053370335 /nfs/dbraw/zinc/37/03/35/1053370335.db2.gz GSUKHDCXGGAQQO-JTQLQIEISA-N 0 1 320.824 4.136 20 0 DIADMN Cc1cc(CN(C)Cc2cc(F)cc(F)c2)cc2cccnc12 ZINC001320899401 1053374323 /nfs/dbraw/zinc/37/43/23/1053374323.db2.gz JMEJKKBELMAMBP-UHFFFAOYSA-N 0 1 312.363 4.453 20 0 DIADMN CC[N@H+](Cc1nc2c(s1)C[C@@H](C)CC2)C[C@H]1CC=CCC1 ZINC001474754112 1053390093 /nfs/dbraw/zinc/39/00/93/1053390093.db2.gz NYDNHFIMFIEAQA-GJZGRUSLSA-N 0 1 304.503 4.446 20 0 DIADMN CC(C)(C)c1ccc(OC(=O)[C@@]2(F)CCN(C(C)(C)C)C2)cc1 ZINC001352715942 1053390612 /nfs/dbraw/zinc/39/06/12/1053390612.db2.gz YGUYYFKCAZRTOZ-LJQANCHMSA-N 0 1 321.436 4.102 20 0 DIADMN CC[N@H+](Cc1nc2c(s1)C[C@H](C)CC2)C[C@@H]1CC=CCC1 ZINC001474754113 1053391806 /nfs/dbraw/zinc/39/18/06/1053391806.db2.gz NYDNHFIMFIEAQA-HUUCEWRRSA-N 0 1 304.503 4.446 20 0 DIADMN COc1ccc2nc(OC3CCC(C(F)(F)F)CC3)[nH]c2c1 ZINC001229729213 1053392725 /nfs/dbraw/zinc/39/27/25/1053392725.db2.gz HXFGTETZDQRORT-UHFFFAOYSA-N 0 1 314.307 4.071 20 0 DIADMN Cc1ccc(NC(=O)Nc2ccc3nc(C(F)F)[nH]c3c2)cc1 ZINC000093351580 1053394565 /nfs/dbraw/zinc/39/45/65/1053394565.db2.gz QWPVGLJRUMNRRX-UHFFFAOYSA-N 0 1 316.311 4.453 20 0 DIADMN CC[C@H](C(=O)N1CCN(C)[C@H](C(C)(C)C)C1)C1CCC(C)CC1 ZINC001300095494 1053394615 /nfs/dbraw/zinc/39/46/15/1053394615.db2.gz CTMSJXQLSNZAML-FOIPXRHGSA-N 0 1 322.537 4.028 20 0 DIADMN CSc1ccccc1[C@@H](C)N[C@H]1CCCc2nc(C)ncc21 ZINC001321181220 1053397461 /nfs/dbraw/zinc/39/74/61/1053397461.db2.gz HJALPUBIVXXXNG-WBMJQRKESA-N 0 1 313.470 4.235 20 0 DIADMN CCCCC[C@H](NC(=O)[C@H](C)Cc1cnc[nH]1)c1ccccc1 ZINC000847434027 1053399178 /nfs/dbraw/zinc/39/91/78/1053399178.db2.gz RIEIVSZPOOZFEF-QAPCUYQASA-N 0 1 313.445 4.026 20 0 DIADMN CCCCC[C@H](NC(=O)[C@@H](C)Cc1cnc[nH]1)c1ccccc1 ZINC000847434028 1053399238 /nfs/dbraw/zinc/39/92/38/1053399238.db2.gz RIEIVSZPOOZFEF-YJBOKZPZSA-N 0 1 313.445 4.026 20 0 DIADMN CCC[C@@H](CC)NC(=O)[C@H]1CCCCN1Cc1cccc(C)c1 ZINC001434956016 1053399794 /nfs/dbraw/zinc/39/97/94/1053399794.db2.gz WEVGKDXPPGVOEL-RTBURBONSA-N 0 1 316.489 4.044 20 0 DIADMN Cc1nnc(SC[C@H](C)c2ccc(C(F)(F)F)cc2)[nH]1 ZINC001321222356 1053401114 /nfs/dbraw/zinc/40/11/14/1053401114.db2.gz RZQPUNNDEGCCHC-QMMMGPOBSA-N 0 1 301.337 4.028 20 0 DIADMN CCC[C@H](NCc1cnc(-c2ccccc2)[nH]1)c1ccccn1 ZINC001200135047 1053407975 /nfs/dbraw/zinc/40/79/75/1053407975.db2.gz FUYTZPIECUGLGA-KRWDZBQOSA-N 0 1 306.413 4.103 20 0 DIADMN Cc1nnc(S[C@H](c2ccc(Cl)cc2)C2CCOCC2)[nH]1 ZINC001321325531 1053408306 /nfs/dbraw/zinc/40/83/06/1053408306.db2.gz LKJFIXKRPILLEB-CQSZACIVSA-N 0 1 323.849 4.027 20 0 DIADMN Cc1n[nH]c(S[C@H](c2ccc(Cl)cc2)C2CCOCC2)n1 ZINC001321325531 1053408312 /nfs/dbraw/zinc/40/83/12/1053408312.db2.gz LKJFIXKRPILLEB-CQSZACIVSA-N 0 1 323.849 4.027 20 0 DIADMN COc1ccc2oc(C[N@H+]3CCC[C@H]3c3cccc(C)n3)cc2c1 ZINC000093453671 1053410002 /nfs/dbraw/zinc/41/00/02/1053410002.db2.gz DPHVESVYKVFQCK-IBGZPJMESA-N 0 1 322.408 4.482 20 0 DIADMN COc1ccc2oc(CN3CCC[C@H]3c3cccc(C)n3)cc2c1 ZINC000093453671 1053410008 /nfs/dbraw/zinc/41/00/08/1053410008.db2.gz DPHVESVYKVFQCK-IBGZPJMESA-N 0 1 322.408 4.482 20 0 DIADMN COc1ccccc1[C@H](C)Oc1ccc(F)cc1CN(C)C ZINC001229853751 1053417219 /nfs/dbraw/zinc/41/72/19/1053417219.db2.gz IQWIGIRFDKGLRU-ZDUSSCGKSA-N 0 1 303.377 4.036 20 0 DIADMN CC[C@H]1CN(Cc2cnc(-c3ccsc3)s2)CCS1 ZINC000093502220 1053417914 /nfs/dbraw/zinc/41/79/14/1053417914.db2.gz MBLRDOQMCNUUDJ-LBPRGKRZSA-N 0 1 310.513 4.199 20 0 DIADMN Cc1ccc(OC[C@@H](C)Oc2ccc(F)cc2CN(C)C)cc1 ZINC001229859019 1053419553 /nfs/dbraw/zinc/41/95/53/1053419553.db2.gz VRRFCGGTJBDCNK-OAHLLOKOSA-N 0 1 317.404 4.042 20 0 DIADMN Cc1ccc(-c2ncc(CNC3(c4ccccc4)CC3)s2)o1 ZINC001200160894 1053428408 /nfs/dbraw/zinc/42/84/08/1053428408.db2.gz AOKHATAUCYIRDF-UHFFFAOYSA-N 0 1 310.422 4.490 20 0 DIADMN Cc1c(-c2nc(-c3ccccc3Cl)no2)ccc2cncn21 ZINC001321690409 1053428338 /nfs/dbraw/zinc/42/83/38/1053428338.db2.gz WYTBJEBBZIDWCL-UHFFFAOYSA-N 0 1 310.744 4.013 20 0 DIADMN C[C@H](c1noc(-c2ccccc2)n1)N1CC[C@H]2CCCC[C@@H]2C1 ZINC001321743254 1053430147 /nfs/dbraw/zinc/43/01/47/1053430147.db2.gz LWFDQOVWPNIFGC-BFYDXBDKSA-N 0 1 311.429 4.310 20 0 DIADMN Fc1cc(F)cc(CN2CC[C@@H](COCc3ccccc3)C2)c1 ZINC000093683950 1053435393 /nfs/dbraw/zinc/43/53/93/1053435393.db2.gz AZQAOLMVKZQRBH-MRXNPFEDSA-N 0 1 317.379 4.004 20 0 DIADMN Fc1cccc(F)c1CN1CC[C@H](COCc2ccccc2)C1 ZINC000093684265 1053437449 /nfs/dbraw/zinc/43/74/49/1053437449.db2.gz YSBYUKWWDLFAKS-INIZCTEOSA-N 0 1 317.379 4.004 20 0 DIADMN C[C@@H](NCc1cnc(C(C)(C)C)nc1)c1ccc(Cl)c(F)c1 ZINC001321943274 1053444559 /nfs/dbraw/zinc/44/45/59/1053444559.db2.gz IUEVIDFDIOERNK-LLVKDONJSA-N 0 1 321.827 4.417 20 0 DIADMN Cc1nc2ccc(NC(=O)c3c(O)cccc3Cl)cc2s1 ZINC001321994378 1053446276 /nfs/dbraw/zinc/44/62/76/1053446276.db2.gz FAAAQLJXVIEUIA-UHFFFAOYSA-N 0 1 318.785 4.216 20 0 DIADMN C[C@@H](Oc1nc[nH]c(=O)c1Cl)c1ccc(Cl)cc1Cl ZINC001230013139 1053454670 /nfs/dbraw/zinc/45/46/70/1053454670.db2.gz DVCXQHIOOJIPGZ-ZCFIWIBFSA-N 0 1 319.575 4.282 20 0 DIADMN C[C@H](Oc1nc[nH]c(=O)c1Cl)c1c(Cl)cccc1Cl ZINC001230016283 1053455564 /nfs/dbraw/zinc/45/55/64/1053455564.db2.gz DVIKMSKJVICZJB-LURJTMIESA-N 0 1 319.575 4.282 20 0 DIADMN Oc1cccc(F)c1-c1nc(-c2ccc3ccccc3c2)no1 ZINC000324398055 1053463044 /nfs/dbraw/zinc/46/30/44/1053463044.db2.gz NXSKVRKOCMODRB-UHFFFAOYSA-N 0 1 306.296 4.402 20 0 DIADMN C[C@@H](N[C@H](C)c1ccccc1N(C)C)c1ccc(F)cc1F ZINC000093941234 1053464473 /nfs/dbraw/zinc/46/44/73/1053464473.db2.gz XLLRVECCJMSBDA-CHWSQXEVSA-N 0 1 304.384 4.443 20 0 DIADMN CC(=CC(C)(C)C)C(=O)Nc1ccc(Nc2ccncc2)cc1 ZINC001300213780 1053492560 /nfs/dbraw/zinc/49/25/60/1053492560.db2.gz WLBJNSZZLYZCOJ-YPKPFQOOSA-N 0 1 309.413 4.178 20 0 DIADMN CCc1nn(C)c(CC)c1CN[C@H](C)c1ccccc1Cl ZINC000163097527 1053494423 /nfs/dbraw/zinc/49/44/23/1053494423.db2.gz FMUJLRCSPQZUQW-GFCCVEGCSA-N 0 1 305.853 4.049 20 0 DIADMN CCCCCCNC(=O)[C@@H]1CCCCN1Cc1cccc(C)c1 ZINC001353210746 1053511906 /nfs/dbraw/zinc/51/19/06/1053511906.db2.gz ZNWCIHJENSMVHF-IBGZPJMESA-N 0 1 316.489 4.046 20 0 DIADMN Cc1cc2sc(NC(=O)c3cccc(F)c3O)nc2c(C)c1 ZINC001353209238 1053512632 /nfs/dbraw/zinc/51/26/32/1053512632.db2.gz LFRRGVJLORPWFY-UHFFFAOYSA-N 0 1 316.357 4.010 20 0 DIADMN CCc1ccc(NC(=O)c2ccc3cncn3c2C)cc1Cl ZINC001322496785 1053513648 /nfs/dbraw/zinc/51/36/48/1053513648.db2.gz ZQILUANYHKQLCS-UHFFFAOYSA-N 0 1 313.788 4.111 20 0 DIADMN CC(C)c1ncc(C(=O)N2C[C@H](C)CC[C@H]2c2ccccc2)[nH]1 ZINC001322528193 1053519059 /nfs/dbraw/zinc/51/90/59/1053519059.db2.gz YHEAWFCICCYRDU-PBHICJAKSA-N 0 1 311.429 4.147 20 0 DIADMN CC(C)(C)[C@H](NC(=O)c1cccc(F)c1O)c1ccccc1 ZINC001353243418 1053520342 /nfs/dbraw/zinc/52/03/42/1053520342.db2.gz JITYBCVLMRUCRM-MRXNPFEDSA-N 0 1 301.361 4.049 20 0 DIADMN CCOc1ccc(CN[C@H]2CCOc3c(CC)cccc32)cc1 ZINC001200282564 1053521659 /nfs/dbraw/zinc/52/16/59/1053521659.db2.gz REJBGBRTWUFWSF-IBGZPJMESA-N 0 1 311.425 4.261 20 0 DIADMN CCOc1ccc(CN[C@H](C)c2ccc(OC)c(F)c2)cc1F ZINC000152770134 1053525292 /nfs/dbraw/zinc/52/52/92/1053525292.db2.gz AIPGXKRKBSQYRP-GFCCVEGCSA-N 0 1 321.367 4.223 20 0 DIADMN Cc1cc(CNCc2ccccc2Oc2cccc(C)c2)n[nH]1 ZINC001322610634 1053527294 /nfs/dbraw/zinc/52/72/94/1053527294.db2.gz IKJYZEXSAANPOA-UHFFFAOYSA-N 0 1 307.397 4.109 20 0 DIADMN Cc1cc(CNCc2ccccc2Oc2cccc(C)c2)[nH]n1 ZINC001322610634 1053527300 /nfs/dbraw/zinc/52/73/00/1053527300.db2.gz IKJYZEXSAANPOA-UHFFFAOYSA-N 0 1 307.397 4.109 20 0 DIADMN CC(C)(C)c1ccc(C[N@H+]2[C@@H]3CCCC[C@@H]3C[C@H]2C(=O)[O-])cc1 ZINC000261718257 1053528047 /nfs/dbraw/zinc/52/80/47/1053528047.db2.gz LSUVSPDBZLVEQX-NXHRZFHOSA-N 0 1 315.457 4.202 20 0 DIADMN C[C@@H](N[C@H](C)c1cc2ccccc2o1)C(=O)Nc1ccccc1 ZINC000152772134 1053528129 /nfs/dbraw/zinc/52/81/29/1053528129.db2.gz KDSTWGKZRHWWMC-ZIAGYGMSSA-N 0 1 308.381 4.111 20 0 DIADMN Cc1cc(F)ncc1CNCc1ccccc1OCCC(C)C ZINC001200291351 1053528746 /nfs/dbraw/zinc/52/87/46/1053528746.db2.gz BFNNOZDGSOSKFX-UHFFFAOYSA-N 0 1 316.420 4.244 20 0 DIADMN CCOc1ccc(CN[C@H](CC)c2ccccc2OC)cc1F ZINC000152806507 1053532834 /nfs/dbraw/zinc/53/28/34/1053532834.db2.gz DVQRCHQWJLWHAK-QGZVFWFLSA-N 0 1 317.404 4.474 20 0 DIADMN CSCC(C)(C)C(=O)Nc1ccc2nc(C3CCC3)[nH]c2c1 ZINC000619723738 1053541664 /nfs/dbraw/zinc/54/16/64/1053541664.db2.gz GBBMXIILQDHGDR-UHFFFAOYSA-N 0 1 317.458 4.158 20 0 DIADMN Cc1nc(CN2CCC[C@H](c3cc4ccccc4[nH]3)C2)oc1C ZINC000619724846 1053543188 /nfs/dbraw/zinc/54/31/88/1053543188.db2.gz LWEDYSISKARKCB-INIZCTEOSA-N 0 1 309.413 4.152 20 0 DIADMN O=C([O-])[C@@H]1C[C@H]2CCCC[C@@H]2[N@H+]1Cc1csc2ccccc12 ZINC000262368845 1053572059 /nfs/dbraw/zinc/57/20/59/1053572059.db2.gz XJIUXZLJYAUQQO-KCXAZCMYSA-N 0 1 315.438 4.119 20 0 DIADMN Cc1cccc(C)c1NC(=O)[C@H](C)[N@H+]1CC[C@@H]2CCCC[C@H]2C1 ZINC001323317175 1053572665 /nfs/dbraw/zinc/57/26/65/1053572665.db2.gz LFLQRYUOZIQEAM-BZSNNMDCSA-N 0 1 314.473 4.143 20 0 DIADMN CCN(Cc1ccccc1F)C[C@H](O)c1cccc(Cl)c1 ZINC001323283252 1053573271 /nfs/dbraw/zinc/57/32/71/1053573271.db2.gz OAITXRKCFYNTMR-KRWDZBQOSA-N 0 1 307.796 4.035 20 0 DIADMN Cc1cc(CN2CCC(c3cccc4ccccc43)CC2)[nH]n1 ZINC001323302879 1053573524 /nfs/dbraw/zinc/57/35/24/1053573524.db2.gz IHAFUSWIIQUEOA-UHFFFAOYSA-N 0 1 305.425 4.251 20 0 DIADMN Cc1cc(CNc2cccc(OCc3ccc(F)cc3)c2)n[nH]1 ZINC001323332232 1053574939 /nfs/dbraw/zinc/57/49/39/1053574939.db2.gz WSIDWUZLFFNELC-UHFFFAOYSA-N 0 1 311.360 4.048 20 0 DIADMN Clc1cccc([C@@H](NCc2ncc[nH]2)C2CCCCC2)c1 ZINC000153092671 1053577102 /nfs/dbraw/zinc/57/71/02/1053577102.db2.gz XNLMFSYJPIYDIW-KRWDZBQOSA-N 0 1 303.837 4.474 20 0 DIADMN Cc1ccc(Cl)c(CN2CCC[C@H]2C(C)(C)O)c1Cl ZINC001237332158 1053590628 /nfs/dbraw/zinc/59/06/28/1053590628.db2.gz TXIXYWNOXDXZTL-ZDUSSCGKSA-N 0 1 302.245 4.037 20 0 DIADMN Cc1cccnc1CNCc1ccc(OC2CCCCC2)cc1 ZINC001323659547 1053592535 /nfs/dbraw/zinc/59/25/35/1053592535.db2.gz MRPWBUXIORSREW-UHFFFAOYSA-N 0 1 310.441 4.391 20 0 DIADMN Cc1cc(CN2CCc3cc(Cl)c(Cl)cc3[C@@H]2C)n[nH]1 ZINC001323740416 1053598228 /nfs/dbraw/zinc/59/82/28/1053598228.db2.gz MMQIVKLYUXDLQC-JTQLQIEISA-N 0 1 310.228 4.144 20 0 DIADMN Cc1cc(CN2CCc3cc(Cl)c(Cl)cc3[C@H]2C)n[nH]1 ZINC001323740417 1053598990 /nfs/dbraw/zinc/59/89/90/1053598990.db2.gz MMQIVKLYUXDLQC-SNVBAGLBSA-N 0 1 310.228 4.144 20 0 DIADMN CCc1ccc(-c2n[nH]c(SCCCOC(C)(C)C)n2)cc1 ZINC001323757753 1053599876 /nfs/dbraw/zinc/59/98/76/1053599876.db2.gz VVDVBZBHQIYLQL-UHFFFAOYSA-N 0 1 319.474 4.331 20 0 DIADMN Cc1csc([C@H](N[C@H]2CCc3c2cccc3F)C2CC2)n1 ZINC001323792493 1053602244 /nfs/dbraw/zinc/60/22/44/1053602244.db2.gz OZZBEOPUVXCTDD-JKSUJKDBSA-N 0 1 302.418 4.319 20 0 DIADMN CCC[C@@H](NCc1cc2cccc(OC)c2o1)c1cccnc1 ZINC001323830653 1053603917 /nfs/dbraw/zinc/60/39/17/1053603917.db2.gz RWPGKLDJYBRWFM-QGZVFWFLSA-N 0 1 310.397 4.467 20 0 DIADMN Cc1cc2cc(CN[C@H]3CCCc4nc(C)ncc43)oc2cc1C ZINC001200377220 1053607733 /nfs/dbraw/zinc/60/77/33/1053607733.db2.gz JGOOLUXKNJESBF-SFHVURJKSA-N 0 1 321.424 4.315 20 0 DIADMN Cc1cc(CNc2ccnc(Oc3ccccc3Cl)c2)n[nH]1 ZINC001324002046 1053615317 /nfs/dbraw/zinc/61/53/17/1053615317.db2.gz XNDKXOGWYHGKRQ-UHFFFAOYSA-N 0 1 314.776 4.171 20 0 DIADMN CC1(C)OCc2cc(CNCc3cscc3Cl)ccc2O1 ZINC001353604314 1053625414 /nfs/dbraw/zinc/62/54/14/1053625414.db2.gz ISPRADWFODKJRZ-UHFFFAOYSA-N 0 1 323.845 4.336 20 0 DIADMN CCc1nc(S[C@H](C)C(=O)c2ccc(C(C)(C)C)cc2)n[nH]1 ZINC000198620560 1053626862 /nfs/dbraw/zinc/62/68/62/1053626862.db2.gz LJYZGJSLEIDIOX-LLVKDONJSA-N 0 1 317.458 4.028 20 0 DIADMN CCc1n[nH]c(S[C@H](C)C(=O)c2ccc(C(C)(C)C)cc2)n1 ZINC000198620560 1053626874 /nfs/dbraw/zinc/62/68/74/1053626874.db2.gz LJYZGJSLEIDIOX-LLVKDONJSA-N 0 1 317.458 4.028 20 0 DIADMN CCOc1ccc([C@H](C)Oc2cc3[nH]ncc3c(F)c2)cc1 ZINC001230930305 1053628790 /nfs/dbraw/zinc/62/87/90/1053628790.db2.gz BINFLJVGMYBZKT-NSHDSACASA-N 0 1 300.333 4.241 20 0 DIADMN Fc1cc(O[C@@H]2CCCc3c(Cl)ccnc32)cc2[nH]ncc21 ZINC001230934900 1053631033 /nfs/dbraw/zinc/63/10/33/1053631033.db2.gz PAJQMGYIAVLXMG-OAHLLOKOSA-N 0 1 317.751 4.207 20 0 DIADMN CC[C@@H](NC(=O)c1cccc(F)c1O)c1ccc(Cl)s1 ZINC001353637391 1053633299 /nfs/dbraw/zinc/63/32/99/1053633299.db2.gz UJEBPJQWMFUTHY-SNVBAGLBSA-N 0 1 313.781 4.127 20 0 DIADMN CC(C)CCc1noc(CN2CC[C@H](C)[C@@H]3CCCC[C@@H]32)n1 ZINC000620278121 1053635152 /nfs/dbraw/zinc/63/51/52/1053635152.db2.gz LIKRNIJSLKEKQW-JYJNAYRXSA-N 0 1 305.466 4.059 20 0 DIADMN CCN(Cc1cccnc1N(C)C)[C@@H](C)c1cc2ccccc2o1 ZINC001324346798 1053646309 /nfs/dbraw/zinc/64/63/09/1053646309.db2.gz UBBXMYIYRWUOKI-HNNXBMFYSA-N 0 1 323.440 4.477 20 0 DIADMN COc1cc(CN[C@@H]2CCCc3c(F)cc(F)cc32)ccc1F ZINC001324400358 1053649677 /nfs/dbraw/zinc/64/96/77/1053649677.db2.gz STNSCWBPKPTOIN-QGZVFWFLSA-N 0 1 321.342 4.280 20 0 DIADMN Cc1ccc([C@@H](O)CN[C@@H](c2ccco2)c2ccccc2)cc1 ZINC000183385796 1053650574 /nfs/dbraw/zinc/65/05/74/1053650574.db2.gz OQEGCNDTLSKHHT-AZUAARDMSA-N 0 1 307.393 4.001 20 0 DIADMN Cc1cccc(F)c1O[C@@H]1CCCN([C@H](C)c2ccccn2)C1 ZINC001231031882 1053656431 /nfs/dbraw/zinc/65/64/31/1053656431.db2.gz RHXPSCRFKIHHJL-HZPDHXFCSA-N 0 1 314.404 4.134 20 0 DIADMN C[C@H](c1ccc(Cl)c(Cl)c1)N1CC[C@]2(CCOC2)C1 ZINC000153627274 1053702306 /nfs/dbraw/zinc/70/23/06/1053702306.db2.gz KATKCTDSKUNDQA-ABAIWWIYSA-N 0 1 300.229 4.167 20 0 DIADMN Cc1ccnc(CN2CCC(Nc3ccccc3Cl)CC2)c1 ZINC001324533609 1053660591 /nfs/dbraw/zinc/66/05/91/1053660591.db2.gz PBYBNJARBPQKTF-UHFFFAOYSA-N 0 1 315.848 4.120 20 0 DIADMN Cc1ccc([C@@H](C)Oc2nc3cc(Cl)nc(Cl)c3[nH]2)cn1 ZINC001231048097 1053661102 /nfs/dbraw/zinc/66/11/02/1053661102.db2.gz GENWTRVJGWVOPL-MRVPVSSYSA-N 0 1 323.183 4.108 20 0 DIADMN C[C@H](Oc1nc(Cl)nc2[nH]ncc21)c1ccc2ccccc2c1 ZINC001231050564 1053661158 /nfs/dbraw/zinc/66/11/58/1053661158.db2.gz UNRPMEDJFSNLHF-JTQLQIEISA-N 0 1 324.771 4.300 20 0 DIADMN Clc1nccc(CNCc2ccc3c(c2)CCC3)c1Cl ZINC001324621676 1053667416 /nfs/dbraw/zinc/66/74/16/1053667416.db2.gz AUVRWDGYJZZRGE-UHFFFAOYSA-N 0 1 307.224 4.167 20 0 DIADMN CC(C)(C)Oc1cccc(CNCc2ccc3c(c2)CCC3)n1 ZINC001324673063 1053671307 /nfs/dbraw/zinc/67/13/07/1053671307.db2.gz KLIDFUQZZVEVQO-UHFFFAOYSA-N 0 1 310.441 4.037 20 0 DIADMN COc1cccc([C@H]2C[C@H](NCc3csc(C(C)C)n3)C2)c1 ZINC001324675642 1053671776 /nfs/dbraw/zinc/67/17/76/1053671776.db2.gz BKJKUYNSOFURAW-SHTZXODSSA-N 0 1 316.470 4.311 20 0 DIADMN CCCCNC(=S)Nc1cc(Cl)c(C)c(Cl)c1O ZINC001200457668 1053678267 /nfs/dbraw/zinc/67/82/67/1053678267.db2.gz 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ZINC001231735386 1053845298 /nfs/dbraw/zinc/84/52/98/1053845298.db2.gz NRWZMBVDFHNTJF-MRXNPFEDSA-N 0 1 319.807 4.392 20 0 DIADMN [O-]c1cc(C[N@H+]2CCC[C@@H]2Cc2ccc(F)cc2)ccc1Cl ZINC001231735386 1053845306 /nfs/dbraw/zinc/84/53/06/1053845306.db2.gz NRWZMBVDFHNTJF-MRXNPFEDSA-N 0 1 319.807 4.392 20 0 DIADMN C[N@H+](CCc1ccccc1Cl)Cc1ccc(Cl)c([O-])c1 ZINC001231734430 1053845890 /nfs/dbraw/zinc/84/58/90/1053845890.db2.gz YZRYZRLROBWIGQ-UHFFFAOYSA-N 0 1 310.224 4.374 20 0 DIADMN C[N@@H+](CCc1ccccc1Cl)Cc1ccc(Cl)c([O-])c1 ZINC001231734430 1053845904 /nfs/dbraw/zinc/84/59/04/1053845904.db2.gz YZRYZRLROBWIGQ-UHFFFAOYSA-N 0 1 310.224 4.374 20 0 DIADMN Cc1ccccc1[C@@H](C)c1noc(-c2ccc3cncn3c2C)n1 ZINC001327287682 1053847425 /nfs/dbraw/zinc/84/74/25/1053847425.db2.gz DWROOACHGPSCFP-CYBMUJFWSA-N 0 1 318.380 4.153 20 0 DIADMN C[N@@H+](Cc1cc(Cl)c([O-])c(Br)c1)C1CCCC1 ZINC001231748407 1053847689 /nfs/dbraw/zinc/84/76/89/1053847689.db2.gz JQLNWCMBYVFTSQ-UHFFFAOYSA-N 0 1 318.642 4.183 20 0 DIADMN CC[C@H](C)[N@@H+](C)Cc1cc(Cl)c([O-])c(Br)c1 ZINC001231743437 1053848509 /nfs/dbraw/zinc/84/85/09/1053848509.db2.gz APPMMONLOYRRIX-QMMMGPOBSA-N 0 1 306.631 4.038 20 0 DIADMN CC(C)Oc1ncccc1CN(C)CCc1ccc(Cl)cc1 ZINC001231759534 1053848951 /nfs/dbraw/zinc/84/89/51/1053848951.db2.gz NRYCFRLBESVMGV-UHFFFAOYSA-N 0 1 318.848 4.197 20 0 DIADMN CC[C@@H]1CCC[N@@H+]1Cc1cc(Cl)c([O-])c(Br)c1 ZINC001231747169 1053850290 /nfs/dbraw/zinc/85/02/90/1053850290.db2.gz KFRDIQZFQNYGFX-SNVBAGLBSA-N 0 1 318.642 4.183 20 0 DIADMN CC[C@@H]1CCC[N@H+]1Cc1cc(Cl)c([O-])c(Br)c1 ZINC001231747169 1053850300 /nfs/dbraw/zinc/85/03/00/1053850300.db2.gz KFRDIQZFQNYGFX-SNVBAGLBSA-N 0 1 318.642 4.183 20 0 DIADMN CCOc1ncccc1CN1CC[C@H](c2ccccc2Cl)C1 ZINC001231766352 1053854881 /nfs/dbraw/zinc/85/48/81/1053854881.db2.gz CGJJGCJWKAZAQI-AWEZNQCLSA-N 0 1 316.832 4.123 20 0 DIADMN CC[C@@H](C)N(C)Cc1c(C)nn(-c2ccc(C)cc2)c1Cl ZINC001231771591 1053855004 /nfs/dbraw/zinc/85/50/04/1053855004.db2.gz AFTSBVZNNVHNTN-CYBMUJFWSA-N 0 1 305.853 4.373 20 0 DIADMN CSc1ccccc1CN1CCOC[C@@H]1C1CCCCC1 ZINC001231786193 1053855782 /nfs/dbraw/zinc/85/57/82/1053855782.db2.gz DNVNWKLGYAZREC-QGZVFWFLSA-N 0 1 305.487 4.190 20 0 DIADMN COC[C@H](C)Oc1ccc(CN[C@H](C)c2cc(C)oc2C)cc1 ZINC001327566620 1053863709 /nfs/dbraw/zinc/86/37/09/1053863709.db2.gz VTQJCOCURGWGGA-LSDHHAIUSA-N 0 1 317.429 4.161 20 0 DIADMN Cc1ccccc1-c1ccccc1CN1CCC(=O)C(C)(C)C1 ZINC001231808930 1053864987 /nfs/dbraw/zinc/86/49/87/1053864987.db2.gz ADCYUQOMQHQALS-UHFFFAOYSA-N 0 1 307.437 4.463 20 0 DIADMN Oc1ccc2c(c1)CCN(Cc1ccc(-c3ccccc3)o1)C2 ZINC001231810158 1053868048 /nfs/dbraw/zinc/86/80/48/1053868048.db2.gz IXVDSMRLEWGRCN-UHFFFAOYSA-N 0 1 305.377 4.211 20 0 DIADMN Cc1ccccc1-c1ccccc1CN(C)Cc1cnc(C)nc1 ZINC001231809268 1053868235 /nfs/dbraw/zinc/86/82/35/1053868235.db2.gz KZIRHLHNCZTLHD-UHFFFAOYSA-N 0 1 317.436 4.392 20 0 DIADMN C[C@H](c1cccs1)N(C)Cc1cnn(-c2ccc(F)cc2)c1 ZINC000157867957 1053873063 /nfs/dbraw/zinc/87/30/63/1053873063.db2.gz XCACPXYIAOAKQY-CYBMUJFWSA-N 0 1 315.417 4.266 20 0 DIADMN CSCCCN1CCCC[C@@H]1c1nc(-c2ccccc2)no1 ZINC000157926861 1053874835 /nfs/dbraw/zinc/87/48/35/1053874835.db2.gz GLVZCFSHUVKFMV-OAHLLOKOSA-N 0 1 317.458 4.017 20 0 DIADMN C[C@@H]1[C@@H](C)CCCN1Cc1cnc(C(F)(F)F)cc1Cl ZINC001231901730 1053913144 /nfs/dbraw/zinc/91/31/44/1053913144.db2.gz KERXONFSQZVERO-VHSXEESVSA-N 0 1 306.759 4.374 20 0 DIADMN Cc1cc(CN(C)Cc2ccccc2-c2ccc(F)cc2)n(C)n1 ZINC001231823633 1053881255 /nfs/dbraw/zinc/88/12/55/1053881255.db2.gz NJLUQPUNPYJCRK-UHFFFAOYSA-N 0 1 323.415 4.167 20 0 DIADMN Cc1csc2sc(CN3CCC(=O)[C@H](C)CC3)c(C)c12 ZINC001231829318 1053884567 /nfs/dbraw/zinc/88/45/67/1053884567.db2.gz VVAPKBUGVBLPNF-SNVBAGLBSA-N 0 1 307.484 4.381 20 0 DIADMN CCC[C@@H](C)CC(=O)N1CCN([C@H](CC)c2ccccc2)CC1 ZINC001354513981 1053891706 /nfs/dbraw/zinc/89/17/06/1053891706.db2.gz HALNOWTTXBJLFM-IEBWSBKVSA-N 0 1 316.489 4.108 20 0 DIADMN CCCOc1ccc(CN[C@H]2COCc3ccccc32)c(C)c1 ZINC000671121244 1053893481 /nfs/dbraw/zinc/89/34/81/1053893481.db2.gz AYECTASJIGRCMY-FQEVSTJZSA-N 0 1 311.425 4.145 20 0 DIADMN CC(C)c1ocnc1CN[C@H]1C[C@@H](OC(C)(C)C)C12CCC2 ZINC001327914185 1053893734 /nfs/dbraw/zinc/89/37/34/1053893734.db2.gz WDPHDRVPUXYUTF-LSDHHAIUSA-N 0 1 306.450 4.014 20 0 DIADMN CC(C)c1ocnc1CN[C@H]1C[C@H](OC(C)(C)C)C12CCC2 ZINC001327914183 1053894493 /nfs/dbraw/zinc/89/44/93/1053894493.db2.gz WDPHDRVPUXYUTF-GJZGRUSLSA-N 0 1 306.450 4.014 20 0 DIADMN COC[C@H]1CCN(Cc2c(F)cccc2Oc2ccccc2)C1 ZINC001231865815 1053894405 /nfs/dbraw/zinc/89/44/05/1053894405.db2.gz XRLZKYMKNLHMFK-HNNXBMFYSA-N 0 1 315.388 4.086 20 0 DIADMN COC[C@@H]1CCCN1Cc1c(F)cccc1Oc1ccccc1 ZINC001231865493 1053894535 /nfs/dbraw/zinc/89/45/35/1053894535.db2.gz ONHRTKOSIFXIME-HNNXBMFYSA-N 0 1 315.388 4.229 20 0 DIADMN C[N@@H+](Cc1cccn1C1CC1)Cc1ccccc1N1CCCC1 ZINC001327940825 1053897389 /nfs/dbraw/zinc/89/73/89/1053897389.db2.gz SGISBEFOIIGKEJ-UHFFFAOYSA-N 0 1 309.457 4.055 20 0 DIADMN CN(Cc1cccn1C1CC1)Cc1ccccc1N1CCCC1 ZINC001327940825 1053897409 /nfs/dbraw/zinc/89/74/09/1053897409.db2.gz SGISBEFOIIGKEJ-UHFFFAOYSA-N 0 1 309.457 4.055 20 0 DIADMN Cc1cc(C(C)(C)C)cc(C)c1C[N@H+]1CCC[C@H]1CC(=O)[O-] ZINC000315305993 1053900761 /nfs/dbraw/zinc/90/07/61/1053900761.db2.gz JLLMOWKKNVZVOY-INIZCTEOSA-N 0 1 303.446 4.040 20 0 DIADMN Oc1c(Cl)cccc1NC(=S)Nc1ccc(F)c(F)c1 ZINC001200699376 1053901779 /nfs/dbraw/zinc/90/17/79/1053901779.db2.gz OLGDRDBRYGJBFT-UHFFFAOYSA-N 0 1 314.744 4.133 20 0 DIADMN Cc1sc(NC(=O)c2ccc(Cl)cc2O)nc1C(C)C ZINC001300644984 1053902080 /nfs/dbraw/zinc/90/20/80/1053902080.db2.gz NSORMMHCEIKTPF-UHFFFAOYSA-N 0 1 310.806 4.186 20 0 DIADMN Cc1cc(CN2CCC(Cc3cccc(F)c3)CC2)cnc1F ZINC001231926175 1053915634 /nfs/dbraw/zinc/91/56/34/1053915634.db2.gz LDMQTJSLDJPYMC-UHFFFAOYSA-N 0 1 316.395 4.123 20 0 DIADMN CCCOc1ccc([C@@H](C)N[C@H](C)c2ccccn2)cc1OC ZINC000158666763 1053916515 /nfs/dbraw/zinc/91/65/15/1053916515.db2.gz LQBKVMFYUCCPGY-HUUCEWRRSA-N 0 1 314.429 4.291 20 0 DIADMN CCC[C@H](NCc1ccnc(N2CCCCC2)c1)c1ccccn1 ZINC000158680619 1053917106 /nfs/dbraw/zinc/91/71/06/1053917106.db2.gz RWFGNAPFGRJYLZ-SFHVURJKSA-N 0 1 324.472 4.098 20 0 DIADMN Cc1cc(CN2CCC(CCc3ccccc3)CC2)cnc1F ZINC001231927020 1053916973 /nfs/dbraw/zinc/91/69/73/1053916973.db2.gz LJICYEBGRKZGBF-UHFFFAOYSA-N 0 1 312.432 4.374 20 0 DIADMN CCCCN(C(=O)c1cc(C2CC2)[nH]n1)[C@@H](C)c1ccc(C)o1 ZINC000621239913 1053918341 /nfs/dbraw/zinc/91/83/41/1053918341.db2.gz IHDHQSJINRXMSW-ZDUSSCGKSA-N 0 1 315.417 4.192 20 0 DIADMN C[C@H]1CCCCN1Cc1ccc(Br)c2cccnc12 ZINC001231952992 1053920305 /nfs/dbraw/zinc/92/03/05/1053920305.db2.gz HNBIVQXZHQSIFJ-LBPRGKRZSA-N 0 1 319.246 4.372 20 0 DIADMN C[C@H](c1ccccc1Br)N1CC[C@@]2(CC2(F)F)C1 ZINC000649903376 1053922220 /nfs/dbraw/zinc/92/22/20/1053922220.db2.gz MMJBMSFFUZNNFS-ZWNOBZJWSA-N 0 1 316.189 4.241 20 0 DIADMN CCN(Cc1ncccc1Cl)[C@@H](C)Cc1ccc(OC)cc1 ZINC001231958465 1053923798 /nfs/dbraw/zinc/92/37/98/1053923798.db2.gz ZGFHXGLVSOQVSE-AWEZNQCLSA-N 0 1 318.848 4.197 20 0 DIADMN COCCSc1ccc([C@@H](C)N[C@@H](C)c2ccccn2)cc1 ZINC000158991899 1053931526 /nfs/dbraw/zinc/93/15/26/1053931526.db2.gz KCBOJOFZFKFPNC-CABCVRRESA-N 0 1 316.470 4.232 20 0 DIADMN C[C@H]1CC[C@H](C)[N@@H+](Cc2c(C(=O)[O-])sc3cccc(F)c32)C1 ZINC000316198833 1053931892 /nfs/dbraw/zinc/93/18/92/1053931892.db2.gz PDXUVUZNIBSIMD-QWRGUYRKSA-N 0 1 321.417 4.359 20 0 DIADMN Cc1ccc(C)c([C@H](C)N(C)CC(=O)Nc2ccccc2C)c1 ZINC000621281338 1053933319 /nfs/dbraw/zinc/93/33/19/1053933319.db2.gz AYKZGJBXXZVFNR-KRWDZBQOSA-N 0 1 310.441 4.243 20 0 DIADMN Cc1nnc([C@H](C)NCCCCc2cccc(Cl)c2)s1 ZINC000621279388 1053933604 /nfs/dbraw/zinc/93/36/04/1053933604.db2.gz RRFVKMWKGKWXDZ-NSHDSACASA-N 0 1 309.866 4.173 20 0 DIADMN C[C@H](NCc1cncc(Cl)c1)c1ccc(OC(F)F)cc1 ZINC000621272737 1053938117 /nfs/dbraw/zinc/93/81/17/1053938117.db2.gz ATDMCJMUTGFACJ-JTQLQIEISA-N 0 1 312.747 4.187 20 0 DIADMN CCN(Cc1cccnc1)Cc1ccc(C(F)(F)F)cc1C ZINC001232006600 1053938608 /nfs/dbraw/zinc/93/86/08/1053938608.db2.gz JVLZXOCTXVNYLV-UHFFFAOYSA-N 0 1 308.347 4.431 20 0 DIADMN Cc1cc(CNC2(c3cccc(OC(F)(F)F)c3)CC2)ccn1 ZINC000621313203 1053941812 /nfs/dbraw/zinc/94/18/12/1053941812.db2.gz ZAPODYFJNQLVPN-UHFFFAOYSA-N 0 1 322.330 4.068 20 0 DIADMN FC(F)C[C@@H]1COCCN1CCCCc1cccc(Cl)c1 ZINC000621295117 1053943496 /nfs/dbraw/zinc/94/34/96/1053943496.db2.gz ZRMPZWCTOLBTKB-OAHLLOKOSA-N 0 1 317.807 4.019 20 0 DIADMN C[C@@H]1CCCCN1Cc1c[nH]c2c1cccc2Br ZINC001232015850 1053944825 /nfs/dbraw/zinc/94/48/25/1053944825.db2.gz AKMBZKZSBYNLAM-LLVKDONJSA-N 0 1 307.235 4.305 20 0 DIADMN CCCc1ccc(CNCc2cn3cc(Cl)ccc3n2)s1 ZINC000621327971 1053946668 /nfs/dbraw/zinc/94/66/68/1053946668.db2.gz AULXQHHSHABERK-UHFFFAOYSA-N 0 1 319.861 4.292 20 0 DIADMN CCCCN(CCCC)Cc1c(Cl)n(C)nc1C(F)F ZINC001232055357 1053948246 /nfs/dbraw/zinc/94/82/46/1053948246.db2.gz LRGQMHKVIOOQHQ-UHFFFAOYSA-N 0 1 307.816 4.413 20 0 DIADMN COc1ccc(CN[C@@H](C)c2cc(C)oc2C)cc1OC1CC1 ZINC001328689293 1053948450 /nfs/dbraw/zinc/94/84/50/1053948450.db2.gz MSVFHXHKOWSQRQ-ZDUSSCGKSA-N 0 1 315.413 4.297 20 0 DIADMN Cc1cc(Br)cnc1CN1CCC[C@H]2CCCC[C@H]21 ZINC001232048927 1053948542 /nfs/dbraw/zinc/94/85/42/1053948542.db2.gz OWZZRUAFLASNNK-CZUORRHYSA-N 0 1 323.278 4.307 20 0 DIADMN CCOc1cncc(CN[C@@H](C)c2ccccc2OC(C)C)c1 ZINC000621329184 1053949107 /nfs/dbraw/zinc/94/91/07/1053949107.db2.gz SOCNBCDMWQDREV-HNNXBMFYSA-N 0 1 314.429 4.118 20 0 DIADMN Cc1cc(Br)cnc1CN1C2CCCC1CCC2 ZINC001232053042 1053949286 /nfs/dbraw/zinc/94/92/86/1053949286.db2.gz TVMVHHVXMDYRCY-UHFFFAOYSA-N 0 1 309.251 4.060 20 0 DIADMN CCOc1cncc(CN[C@H](C)c2cccc(OC(C)C)c2)c1 ZINC000621328809 1053949241 /nfs/dbraw/zinc/94/92/41/1053949241.db2.gz DUDWGVFNUKURGA-OAHLLOKOSA-N 0 1 314.429 4.118 20 0 DIADMN Cc1ccc(CN(C)Cc2cccc(C(F)(F)F)n2)cc1C ZINC001232074129 1053955686 /nfs/dbraw/zinc/95/56/86/1053955686.db2.gz STYOGHBCHMAZAS-UHFFFAOYSA-N 0 1 308.347 4.349 20 0 DIADMN Fc1cccc([C@@H]2CCN(Cc3cccc(C(F)(F)F)n3)C2)c1 ZINC001232070872 1053956103 /nfs/dbraw/zinc/95/61/03/1053956103.db2.gz BFJSYBLROFKLFQ-CYBMUJFWSA-N 0 1 324.321 4.229 20 0 DIADMN CCOc1cncc(CNC2(c3cccc(Cl)c3)CCC2)c1 ZINC000621368209 1053956838 /nfs/dbraw/zinc/95/68/38/1053956838.db2.gz OZLFFUATHFUYIP-UHFFFAOYSA-N 0 1 316.832 4.303 20 0 DIADMN C[C@@H]1CC(F)(F)CCN1Cc1cnc(-c2ccccc2)s1 ZINC001328893304 1053958191 /nfs/dbraw/zinc/95/81/91/1053958191.db2.gz XVQNIRGGTPMNLE-GFCCVEGCSA-N 0 1 308.397 4.430 20 0 DIADMN Cc1ccc2c(c1)S[C@H](C(=O)Nc1cccc(Cl)c1O)C2 ZINC001328926448 1053958790 /nfs/dbraw/zinc/95/87/90/1053958790.db2.gz RSYZTNRNXNWXCO-AWEZNQCLSA-N 0 1 319.813 4.010 20 0 DIADMN CCCc1ccc(CNCc2cnccc2C(F)(F)F)s1 ZINC000621372636 1053959834 /nfs/dbraw/zinc/95/98/34/1053959834.db2.gz YPZYRZWTIMERBI-UHFFFAOYSA-N 0 1 314.376 4.404 20 0 DIADMN COc1cccc([C@@H]2CCCCN2Cc2cc3ccncc3[nH]2)c1 ZINC001232094509 1053961413 /nfs/dbraw/zinc/96/14/13/1053961413.db2.gz TWUACJGRXZSZMW-FQEVSTJZSA-N 0 1 321.424 4.299 20 0 DIADMN COc1ccc(CNCc2nc(C)c(C)s2)c2ccccc12 ZINC001200773047 1053961516 /nfs/dbraw/zinc/96/15/16/1053961516.db2.gz FKRSFBCEOLACCL-UHFFFAOYSA-N 0 1 312.438 4.212 20 0 DIADMN Cc1ncc(CN(Cc2cccc(Cl)c2)CC(C)C)cn1 ZINC000621387066 1053964660 /nfs/dbraw/zinc/96/46/60/1053964660.db2.gz ZREXREMKHRFQQG-UHFFFAOYSA-N 0 1 303.837 4.097 20 0 DIADMN C[N@@H+](Cc1nc(Cl)ccc1F)C(C)(C)Cc1ccccc1 ZINC001232161240 1053974823 /nfs/dbraw/zinc/97/48/23/1053974823.db2.gz JTGUMFQGLGTZAL-UHFFFAOYSA-N 0 1 306.812 4.327 20 0 DIADMN CN(Cc1nc(Cl)ccc1F)C(C)(C)Cc1ccccc1 ZINC001232161240 1053974837 /nfs/dbraw/zinc/97/48/37/1053974837.db2.gz JTGUMFQGLGTZAL-UHFFFAOYSA-N 0 1 306.812 4.327 20 0 DIADMN CCOc1ccc(Cl)cc1CNCc1sc(C)nc1C ZINC001200792382 1053978134 /nfs/dbraw/zinc/97/81/34/1053978134.db2.gz VAQRLXZMPKKRIL-UHFFFAOYSA-N 0 1 310.850 4.102 20 0 DIADMN CCC[C@H]1CCCCN1Cc1ncc(C)cc1Br ZINC001232175124 1053979240 /nfs/dbraw/zinc/97/92/40/1053979240.db2.gz AXJKSAJBNXMWOF-ZDUSSCGKSA-N 0 1 311.267 4.307 20 0 DIADMN CO[C@H]1CN(Cc2ccccc2-c2ccc(Cl)cc2)C[C@@H]1F ZINC001232194127 1053983478 /nfs/dbraw/zinc/98/34/78/1053983478.db2.gz JJKULYDLFBCCFD-ROUUACIJSA-N 0 1 319.807 4.176 20 0 DIADMN CN(Cc1cncnc1)Cc1ccccc1-c1ccc(Cl)cc1 ZINC001232198165 1053987153 /nfs/dbraw/zinc/98/71/53/1053987153.db2.gz JNJVDZGMJUBNQQ-UHFFFAOYSA-N 0 1 323.827 4.429 20 0 DIADMN CC[C@@H](NCc1csc(C(C)C)n1)[C@H](O)c1ccccc1F ZINC001200802000 1053988364 /nfs/dbraw/zinc/98/83/64/1053988364.db2.gz DEVIQEDDPUGYFJ-HZPDHXFCSA-N 0 1 322.449 4.007 20 0 DIADMN CO[C@@H](c1ccccc1Cl)[C@@H](C)NCc1cc(C2CC2)no1 ZINC000660225038 1053991503 /nfs/dbraw/zinc/99/15/03/1053991503.db2.gz MEADLBVDAQOYDN-PIGZYNQJSA-N 0 1 320.820 4.071 20 0 DIADMN CC(C)(C)c1cc(CN2CC[C@@](CF)(C(F)(F)F)C2)ccn1 ZINC001232213813 1053992687 /nfs/dbraw/zinc/99/26/87/1053992687.db2.gz FLEBRRLQUNPRAS-HNNXBMFYSA-N 0 1 318.358 4.103 20 0 DIADMN CCC(C)(C)CC(=O)Nc1nc2c(s1)CN(C(C)(C)C)CC2 ZINC001436944854 1053992906 /nfs/dbraw/zinc/99/29/06/1053992906.db2.gz WNRFVXLJPDMWPV-UHFFFAOYSA-N 0 1 323.506 4.065 20 0 DIADMN COc1ccc2c(c1)CN(Cc1ccnc(C(C)(C)C)c1)CCC2 ZINC001232220863 1053994946 /nfs/dbraw/zinc/99/49/46/1053994946.db2.gz RCDSFHMDHZVGPB-UHFFFAOYSA-N 0 1 324.468 4.336 20 0 DIADMN Cc1nccnc1CN(Cc1cccc(C(F)(F)F)c1)C(C)C ZINC000621712204 1053996074 /nfs/dbraw/zinc/99/60/74/1053996074.db2.gz WJSDNMNLTJFPTN-UHFFFAOYSA-N 0 1 323.362 4.214 20 0 DIADMN CN(CCC(=O)c1cccs1)Cc1ccnc(C(C)(C)C)c1 ZINC001232220179 1053996994 /nfs/dbraw/zinc/99/69/94/1053996994.db2.gz GETRZGCKEJBGQS-UHFFFAOYSA-N 0 1 316.470 4.145 20 0 DIADMN CCN(Cc1nccnc1C)[C@@H](C)c1cccc(C(F)(F)F)c1 ZINC000621711975 1053997357 /nfs/dbraw/zinc/99/73/57/1053997357.db2.gz NXKQHHBGIYNMRQ-ZDUSSCGKSA-N 0 1 323.362 4.387 20 0 DIADMN CN(Cc1cccn1Cc1ccccc1)Cc1cccc(F)c1 ZINC001232231040 1053999339 /nfs/dbraw/zinc/99/93/39/1053999339.db2.gz GFAQGFRJJGPADQ-UHFFFAOYSA-N 0 1 308.400 4.308 20 0 DIADMN C[C@H]1CN(Cc2cccn2Cc2ccccc2)CCC1(F)F ZINC001232231114 1054000363 /nfs/dbraw/zinc/00/03/63/1054000363.db2.gz IDNFKIJPRMOSAP-HNNXBMFYSA-N 0 1 304.384 4.014 20 0 DIADMN COc1ccc([C@@H](C)N(C)Cc2ccnc(C(F)(F)F)c2)cc1 ZINC001232240386 1054001649 /nfs/dbraw/zinc/00/16/49/1054001649.db2.gz FWTZIYNGOLWPSW-GFCCVEGCSA-N 0 1 324.346 4.302 20 0 DIADMN Cc1ccccc1CN(C)[C@@H](C)C(=O)N[C@@H](C)c1ccccc1C ZINC000621732294 1054003480 /nfs/dbraw/zinc/00/34/80/1054003480.db2.gz VVZFNTZXVLKEPF-ROUUACIJSA-N 0 1 324.468 4.001 20 0 DIADMN CCCN(Cc1cn2cc(C)ccc2n1)Cc1ccc(OC)cc1 ZINC000621732996 1054003758 /nfs/dbraw/zinc/00/37/58/1054003758.db2.gz JCVZNIULURFWMJ-UHFFFAOYSA-N 0 1 323.440 4.064 20 0 DIADMN CCCCC[C@H](C)CC(=O)Nc1cnccc1-n1ccnc1C ZINC001329698268 1054004338 /nfs/dbraw/zinc/00/43/38/1054004338.db2.gz MTVLTXGHSCSPEW-AWEZNQCLSA-N 0 1 314.433 4.121 20 0 DIADMN CN(Cc1ccccc1Cl)Cc1ccc(O)c2ncccc12 ZINC001232278138 1054009784 /nfs/dbraw/zinc/00/97/84/1054009784.db2.gz AMTYSEZHGOPCKK-UHFFFAOYSA-N 0 1 312.800 4.226 20 0 DIADMN Clc1csc(CN2CCC(COc3cccnc3)CC2)c1 ZINC001232278986 1054011071 /nfs/dbraw/zinc/01/10/71/1054011071.db2.gz YZNRPUBYELUXRF-UHFFFAOYSA-N 0 1 322.861 4.088 20 0 DIADMN CCc1sc(CN2CCC[C@H](CF)C2)cc1Br ZINC001232288665 1054012075 /nfs/dbraw/zinc/01/20/75/1054012075.db2.gz HQISKNQRHPBVRX-SNVBAGLBSA-N 0 1 320.271 4.255 20 0 DIADMN CCc1sc(CN2CCC[C@@H](F)CC2)cc1Br ZINC001232286373 1054012819 /nfs/dbraw/zinc/01/28/19/1054012819.db2.gz FEAZAZBBOFXRAI-SNVBAGLBSA-N 0 1 320.271 4.397 20 0 DIADMN Fc1ccc(O[C@H]2CCN(Cc3cc(Cl)cs3)C2)cc1 ZINC001232281506 1054014764 /nfs/dbraw/zinc/01/47/64/1054014764.db2.gz IIRLVPIKQOJGNS-AWEZNQCLSA-N 0 1 311.809 4.194 20 0 DIADMN Cc1sc(CN2CCC[C@@H](CF)C2)cc1Br ZINC001232293965 1054017152 /nfs/dbraw/zinc/01/71/52/1054017152.db2.gz PZPBBMWVBHTQNQ-JTQLQIEISA-N 0 1 306.244 4.001 20 0 DIADMN O=C([O-])CC[C@H]1CCCC[N@H+]1Cc1c(Cl)oc2ccccc21 ZINC000621773993 1054015707 /nfs/dbraw/zinc/01/57/07/1054015707.db2.gz HWMUTGDOOBNOIG-GFCCVEGCSA-N 0 1 321.804 4.306 20 0 DIADMN COc1ccc([C@@H](C)N(C)Cc2cnc(SC)cc2C)cc1 ZINC001232347883 1054026009 /nfs/dbraw/zinc/02/60/09/1054026009.db2.gz HSWMKULHRBXKDY-CQSZACIVSA-N 0 1 316.470 4.314 20 0 DIADMN COc1cc(C)c(CN(C)Cc2ccccc2C(F)(F)F)cn1 ZINC001232352557 1054027023 /nfs/dbraw/zinc/02/70/23/1054027023.db2.gz PFGXOSMYUICWNB-UHFFFAOYSA-N 0 1 324.346 4.049 20 0 DIADMN C[N@@H+](Cc1ccc(N)nc1)Cc1cccc(Oc2ccccc2)c1 ZINC001232369325 1054031065 /nfs/dbraw/zinc/03/10/65/1054031065.db2.gz AOQLJESAIUAOBJ-UHFFFAOYSA-N 0 1 319.408 4.088 20 0 DIADMN CN(Cc1ccc(N)nc1)Cc1cccc(Oc2ccccc2)c1 ZINC001232369325 1054031079 /nfs/dbraw/zinc/03/10/79/1054031079.db2.gz AOQLJESAIUAOBJ-UHFFFAOYSA-N 0 1 319.408 4.088 20 0 DIADMN CCOc1ccc(OC)cc1CN1CCC[C@@H]1c1cccs1 ZINC001232384262 1054032718 /nfs/dbraw/zinc/03/27/18/1054032718.db2.gz OVXSHLMXXXNLRO-MRXNPFEDSA-N 0 1 317.454 4.493 20 0 DIADMN CCOc1ccc2nc(SC[C@H](CC(C)C)OC)[nH]c2c1 ZINC001472928485 1054032912 /nfs/dbraw/zinc/03/29/12/1054032912.db2.gz JZBKGMXSSNZSCN-ZDUSSCGKSA-N 0 1 308.447 4.115 20 0 DIADMN CCOc1ccc2nc(SCc3cc(C)cc(C)n3)[nH]c2c1 ZINC001472929069 1054036301 /nfs/dbraw/zinc/03/63/01/1054036301.db2.gz WLLCOOHAIAIQJP-UHFFFAOYSA-N 0 1 313.426 4.266 20 0 DIADMN Cc1cccc(CN2CC[C@@H](F)C(F)(F)CC2)c1OC(C)C ZINC001232390433 1054037467 /nfs/dbraw/zinc/03/74/67/1054037467.db2.gz VDTONVINDZQBBR-OAHLLOKOSA-N 0 1 315.379 4.351 20 0 DIADMN Cc1ccc(OC(C)C)c(CN2C[C@H]3CC[C@@H](C2)C3(F)F)c1 ZINC001232394839 1054038119 /nfs/dbraw/zinc/03/81/19/1054038119.db2.gz AMJWYVWLKHJVFL-IYBDPMFKSA-N 0 1 309.400 4.259 20 0 DIADMN C[C@H](NCc1cnn(C(C)(C)C)c1)c1ccc(Cl)c(F)c1 ZINC001330545925 1054040088 /nfs/dbraw/zinc/04/00/88/1054040088.db2.gz YYZFTHUJTPHUBT-NSHDSACASA-N 0 1 309.816 4.281 20 0 DIADMN Cc1c(F)cc(CN2CCC[C@@H](c3ccccn3)C2)cc1F ZINC001232423606 1054041773 /nfs/dbraw/zinc/04/17/73/1054041773.db2.gz UGZHXLQNJABNDE-OAHLLOKOSA-N 0 1 302.368 4.048 20 0 DIADMN COc1ccccc1[C@H](C)N(C)Cc1cc(F)c(C)c(F)c1 ZINC001232423057 1054042214 /nfs/dbraw/zinc/04/22/14/1054042214.db2.gz ICLIRZQDQDDKGH-ZDUSSCGKSA-N 0 1 305.368 4.475 20 0 DIADMN Fc1ccc2nc(CN(Cc3ccccc3)C3CCC3)cn2c1 ZINC001232414720 1054043085 /nfs/dbraw/zinc/04/30/85/1054043085.db2.gz HMLSFEIBVHWZDN-UHFFFAOYSA-N 0 1 309.388 4.028 20 0 DIADMN Cc1cc(C)cc([C@@H]2CCCN2Cc2cn3cc(F)ccc3n2)c1 ZINC001232415858 1054044517 /nfs/dbraw/zinc/04/45/17/1054044517.db2.gz NJAAUOOPQIUSDC-IBGZPJMESA-N 0 1 323.415 4.427 20 0 DIADMN c1c(CN2CCC3(CCC3)CC2)onc1OCc1ccccc1 ZINC001232445151 1054046285 /nfs/dbraw/zinc/04/62/85/1054046285.db2.gz PQRRREAYVAKLQD-UHFFFAOYSA-N 0 1 312.413 4.020 20 0 DIADMN Cc1ncc(CN(C)Cc2sc3ccccc3c2Cl)[nH]1 ZINC001232464349 1054049433 /nfs/dbraw/zinc/04/94/33/1054049433.db2.gz ZDWWFKDAMKORSL-UHFFFAOYSA-N 0 1 305.834 4.218 20 0 DIADMN CC(C)c1ncc(C(=O)N(C)[C@@H](C)c2ccc(Cl)cc2)[nH]1 ZINC001330757008 1054051684 /nfs/dbraw/zinc/05/16/84/1054051684.db2.gz TYSKUJREDIIRNS-NSHDSACASA-N 0 1 305.809 4.020 20 0 DIADMN Cc1nc(CN2CCC(c3csc4ccccc34)CC2)c[nH]1 ZINC001232467468 1054052619 /nfs/dbraw/zinc/05/26/19/1054052619.db2.gz FVCBAUXJLGMZIG-UHFFFAOYSA-N 0 1 311.454 4.312 20 0 DIADMN Cc1cc(Br)c(CN2C[C@H](C)CC23CC3)cc1F ZINC001232467323 1054053231 /nfs/dbraw/zinc/05/32/31/1054053231.db2.gz BQDABIKIVKUMDE-SNVBAGLBSA-N 0 1 312.226 4.271 20 0 DIADMN CCc1csc(CN2CCC(c3ccc(F)cc3)CC2)n1 ZINC001232472501 1054054615 /nfs/dbraw/zinc/05/46/15/1054054615.db2.gz GZUGMJBTMRLCGW-UHFFFAOYSA-N 0 1 304.434 4.224 20 0 DIADMN CCc1csc(CN2CCC[C@@H](Cc3ccc(F)cc3)C2)n1 ZINC001232473999 1054054827 /nfs/dbraw/zinc/05/48/27/1054054827.db2.gz LZTQELRVFWBUGT-HNNXBMFYSA-N 0 1 318.461 4.299 20 0 DIADMN CCc1csc(CN2CCC[C@H](Cc3ccccc3)C2)n1 ZINC001232472465 1054054888 /nfs/dbraw/zinc/05/48/88/1054054888.db2.gz GPKWMRXPLILIOZ-MRXNPFEDSA-N 0 1 300.471 4.160 20 0 DIADMN COc1ccc(C2=CCN(Cc3c(C)cccc3F)CC2)cc1 ZINC001232485986 1054055549 /nfs/dbraw/zinc/05/55/49/1054055549.db2.gz HTRIWTCUDLZUMW-UHFFFAOYSA-N 0 1 311.400 4.432 20 0 DIADMN Fc1ccnc(CN(CCc2ccccc2)Cc2ccccc2)c1 ZINC001232494846 1054057505 /nfs/dbraw/zinc/05/75/05/1054057505.db2.gz GPKSBNCTTOITBA-UHFFFAOYSA-N 0 1 320.411 4.466 20 0 DIADMN Cc1cccc(F)c1CN1CCSC[C@H]1c1ccccc1 ZINC001232482947 1054057591 /nfs/dbraw/zinc/05/75/91/1054057591.db2.gz AANKJZBVOIZPDT-SFHVURJKSA-N 0 1 301.430 4.424 20 0 DIADMN Nc1ccc(F)cc1CN1CCC[C@H]1c1ccc(Cl)cc1 ZINC001232510892 1054059253 /nfs/dbraw/zinc/05/92/53/1054059253.db2.gz LKDQFHSBSDDARX-KRWDZBQOSA-N 0 1 304.796 4.398 20 0 DIADMN CC(C)CN1Cc2cccc(NC(=O)C3(C(C)(F)F)CC3)c2C1 ZINC001331122970 1054061639 /nfs/dbraw/zinc/06/16/39/1054061639.db2.gz GOUJGAZZXOAGCU-UHFFFAOYSA-N 0 1 322.399 4.032 20 0 DIADMN Nc1ccc(F)cc1CN1CCC(Sc2ccccc2)CC1 ZINC001232510823 1054061867 /nfs/dbraw/zinc/06/18/67/1054061867.db2.gz HBZRERIGZFQGKW-UHFFFAOYSA-N 0 1 316.445 4.165 20 0 DIADMN CN(Cc1ccccc1C(F)(F)F)Cc1cc(F)ccc1N ZINC001232511713 1054061935 /nfs/dbraw/zinc/06/19/35/1054061935.db2.gz IUFJRRAYDPUVBW-UHFFFAOYSA-N 0 1 312.310 4.059 20 0 DIADMN CCOc1ccc([C@@H]2CCCN2Cc2cc(F)ccc2N)cc1 ZINC001232512463 1054063651 /nfs/dbraw/zinc/06/36/51/1054063651.db2.gz SMQXOMYNTSMINN-IBGZPJMESA-N 0 1 314.404 4.144 20 0 DIADMN Cc1ccc(CN(C)Cc2cncc(Br)c2C)cc1 ZINC001232532051 1054064710 /nfs/dbraw/zinc/06/47/10/1054064710.db2.gz AWLOYGSEZPQWKU-UHFFFAOYSA-N 0 1 319.246 4.093 20 0 DIADMN Cn1c(CNCc2ccc3ccccc3c2)nc2cc(F)ccc21 ZINC000076332486 1054065345 /nfs/dbraw/zinc/06/53/45/1054065345.db2.gz WPDDNYXIRAAUFO-UHFFFAOYSA-N 0 1 319.383 4.155 20 0 DIADMN C[C@@H](NCCC(=O)Nc1ccccc1)c1ccc(F)cc1Cl ZINC000164964870 1054066077 /nfs/dbraw/zinc/06/60/77/1054066077.db2.gz SMLVDDQHLFRIKY-GFCCVEGCSA-N 0 1 320.795 4.159 20 0 DIADMN CN(Cc1ccc(C(F)(F)F)cc1)Cc1cccc(CF)n1 ZINC001232537453 1054067529 /nfs/dbraw/zinc/06/75/29/1054067529.db2.gz GXIAEFUKFOTEGH-UHFFFAOYSA-N 0 1 312.310 4.202 20 0 DIADMN c1cc2cc(CN3CCC[C@H](OCc4ccccc4)C3)ncc2o1 ZINC001232553712 1054068295 /nfs/dbraw/zinc/06/82/95/1054068295.db2.gz COGJVHJMBYIICM-IBGZPJMESA-N 0 1 322.408 4.009 20 0 DIADMN c1cc2cc(CN3CCC(OCc4ccccc4)CC3)ncc2o1 ZINC001232550794 1054068430 /nfs/dbraw/zinc/06/84/30/1054068430.db2.gz KBDRMZGLRPREMO-UHFFFAOYSA-N 0 1 322.408 4.009 20 0 DIADMN C[C@H](N[C@H]1CCc2sc(Br)cc21)c1cccnc1 ZINC000293589723 1054069434 /nfs/dbraw/zinc/06/94/34/1054069434.db2.gz FIFOMPPFTQLELJ-CABZTGNLSA-N 0 1 323.259 4.244 20 0 DIADMN 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O=C(Nc1c(F)cccc1F)c1cc(-c2ccc(F)cc2)no1 ZINC001355199323 1054078522 /nfs/dbraw/zinc/07/85/22/1054078522.db2.gz NEFKZRYXTGLBQR-UHFFFAOYSA-N 0 1 318.254 4.011 20 0 DIADMN c1cc2ccc(CN3CCOC4(CCCCC4)C3)cc2s1 ZINC001232617137 1054085374 /nfs/dbraw/zinc/08/53/74/1054085374.db2.gz WXSJOMDBLMJLOG-UHFFFAOYSA-N 0 1 301.455 4.436 20 0 DIADMN CC[C@H](NCc1nc2ccccc2nc1C)c1ccc(F)cc1 ZINC001331673489 1054085521 /nfs/dbraw/zinc/08/55/21/1054085521.db2.gz DWFNHLSFIQRWKQ-INIZCTEOSA-N 0 1 309.388 4.318 20 0 DIADMN C[C@H](NC[C@@H]1CC[C@H](C2CC2)O1)c1nc(C(C)(C)C)cs1 ZINC001331702459 1054085597 /nfs/dbraw/zinc/08/55/97/1054085597.db2.gz ORZYPCJJZFJWNZ-FPMFFAJLSA-N 0 1 308.491 4.049 20 0 DIADMN COc1cccc(C)c1CN1CCC(C(=O)c2ccccc2)CC1 ZINC001232621273 1054086936 /nfs/dbraw/zinc/08/69/36/1054086936.db2.gz DMGUWMZIBGRTEJ-UHFFFAOYSA-N 0 1 323.436 4.099 20 0 DIADMN CCc1ccc(-c2n[nH]c(SCCC(F)(F)Cl)n2)cc1 ZINC001331722045 1054088195 /nfs/dbraw/zinc/08/81/95/1054088195.db2.gz CDAWUBUGLJTBHK-UHFFFAOYSA-N 0 1 317.792 4.348 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FMKMZKPXWQMXDU-UHFFFAOYSA-N 0 1 305.647 4.118 20 0 DIADMN Cc1c([C@H](C)N[C@H](C)c2ccc(C(F)(F)F)s2)cnn1C ZINC001334812431 1054201407 /nfs/dbraw/zinc/20/14/07/1054201407.db2.gz FRHVMCPCBCEQHG-DTWKUNHWSA-N 0 1 317.380 4.221 20 0 DIADMN COc1cc(Br)cc(CN2CCC23CCCCC3)c1 ZINC001233212785 1054205185 /nfs/dbraw/zinc/20/51/85/1054205185.db2.gz FIYBQWTTWKVWST-UHFFFAOYSA-N 0 1 324.262 4.366 20 0 DIADMN COc1cc(Br)cc(CN2CCC[C@H]3CCC[C@@H]32)c1 ZINC001233216048 1054205353 /nfs/dbraw/zinc/20/53/53/1054205353.db2.gz ZQJXWTKXNRPMJI-CJNGLKHVSA-N 0 1 324.262 4.222 20 0 DIADMN Cc1cccc(-c2ccc(CN(C)Cc3cnn(C)c3)cc2)c1 ZINC001233221830 1054207189 /nfs/dbraw/zinc/20/71/89/1054207189.db2.gz CKVZJUMLWJNFLQ-UHFFFAOYSA-N 0 1 305.425 4.028 20 0 DIADMN Cc1cccc(-c2ccc(CN3CCCC(=O)[C@@H](C)C3)cc2)c1 ZINC001233221708 1054208000 /nfs/dbraw/zinc/20/80/00/1054208000.db2.gz ASAAJVLKSKTXBX-KRWDZBQOSA-N 0 1 307.437 4.463 20 0 DIADMN Cc1cccc(OC2CCN(Cc3ccc(C)c(O)c3)CC2)c1 ZINC001233233233 1054210338 /nfs/dbraw/zinc/21/03/38/1054210338.db2.gz BLBYNSGLHSWIQY-UHFFFAOYSA-N 0 1 311.425 4.052 20 0 DIADMN C[C@H]1CN(Cc2csc(-c3ccc(F)cc3)n2)C2(CC2)C1 ZINC001233243439 1054213418 /nfs/dbraw/zinc/21/34/18/1054213418.db2.gz RAUSLTQCSUIGGY-GFCCVEGCSA-N 0 1 302.418 4.324 20 0 DIADMN Cc1ccc(Cl)cc1CN1CCC(C(=O)OC(C)(C)C)CC1 ZINC001233250140 1054216743 /nfs/dbraw/zinc/21/67/43/1054216743.db2.gz XAMXDRNEBBTHSP-UHFFFAOYSA-N 0 1 323.864 4.202 20 0 DIADMN [S-]c1ccc(C[N@H+]2CCC[C@H](OCc3ccccc3)C2)cc1 ZINC001233262193 1054218087 /nfs/dbraw/zinc/21/80/87/1054218087.db2.gz VBADMRJRNRLHFH-SFHVURJKSA-N 0 1 313.466 4.157 20 0 DIADMN COc1c(O)cccc1CN(Cc1cccc(C)c1C)C1CC1 ZINC001233258121 1054218479 /nfs/dbraw/zinc/21/84/79/1054218479.db2.gz RDIKIXFRSSPLEY-UHFFFAOYSA-N 0 1 311.425 4.182 20 0 DIADMN CC[N@@H+](CCc1ccc(OC)cc1)Cc1ccc([S-])cc1 ZINC001233262462 1054219149 /nfs/dbraw/zinc/21/91/49/1054219149.db2.gz HTWAIPNKPIMEMQ-UHFFFAOYSA-N 0 1 301.455 4.049 20 0 DIADMN C[C@H]([NH2+]Cc1ccccc1F)c1cc(Br)ccc1[O-] 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Cc1cc(CN2CCC[C@]3(CCc4c3cccc4F)C2)sn1 ZINC001233313815 1054227889 /nfs/dbraw/zinc/22/78/89/1054227889.db2.gz OQQYYDRATFIOEI-SFHVURJKSA-N 0 1 316.445 4.071 20 0 DIADMN Cc1cc(CN2CCC(Cc3ccc(F)cc3F)CC2)sn1 ZINC001233312916 1054228371 /nfs/dbraw/zinc/22/83/71/1054228371.db2.gz UCFHNZNWGWUDEY-UHFFFAOYSA-N 0 1 322.424 4.184 20 0 DIADMN CC(C)CN(C(=O)c1c(O)cccc1F)c1ccc(Cl)cc1 ZINC000622440939 1054229089 /nfs/dbraw/zinc/22/90/89/1054229089.db2.gz QIMHLGHAGRKRAK-UHFFFAOYSA-N 0 1 321.779 4.488 20 0 DIADMN Cc1ccc(C)c([C@H]2CCCN2C(=O)c2c(O)cccc2F)c1 ZINC000622440932 1054229172 /nfs/dbraw/zinc/22/91/72/1054229172.db2.gz PVBATDUSYNHOMG-MRXNPFEDSA-N 0 1 313.372 4.125 20 0 DIADMN COc1ccc(C[C@H]2CCCN(Cc3ccc(Cl)o3)C2)cc1 ZINC001233316925 1054229944 /nfs/dbraw/zinc/22/99/44/1054229944.db2.gz LPSVUQADSBIOBI-OAHLLOKOSA-N 0 1 319.832 4.396 20 0 DIADMN CSc1cc(CNCc2ccc(C(F)F)c(F)c2)ccn1 ZINC001336063312 1054229844 /nfs/dbraw/zinc/22/98/44/1054229844.db2.gz RKLVIDQNJNGLOX-UHFFFAOYSA-N 0 1 312.360 4.170 20 0 DIADMN C[C@H]1CN(Cc2ccc(Cc3ccccc3)cc2)CCCC1=O ZINC001233330082 1054234775 /nfs/dbraw/zinc/23/47/75/1054234775.db2.gz UYKFLXRUYPJTSS-KRWDZBQOSA-N 0 1 307.437 4.078 20 0 DIADMN C[C@@H]1CN(Cc2ccc(Cc3ccccc3)cc2)CCCC1=O ZINC001233330083 1054235313 /nfs/dbraw/zinc/23/53/13/1054235313.db2.gz UYKFLXRUYPJTSS-QGZVFWFLSA-N 0 1 307.437 4.078 20 0 DIADMN COc1cc(F)c(CN(Cc2ccccc2)C(C)C)cc1F ZINC001233340972 1054238105 /nfs/dbraw/zinc/23/81/05/1054238105.db2.gz YIZRYQWRMSTWGN-UHFFFAOYSA-N 0 1 305.368 4.384 20 0 DIADMN COc1cc(F)c(CN2CCC(c3ccccc3)CC2)cc1F ZINC001233341182 1054240397 /nfs/dbraw/zinc/24/03/97/1054240397.db2.gz GSGHCGQNCDBNRV-UHFFFAOYSA-N 0 1 317.379 4.353 20 0 DIADMN c1c2cccnc2sc1C[N@@H+]1CC[C@@H]1COCc1ccccc1 ZINC001233347835 1054242981 /nfs/dbraw/zinc/24/29/81/1054242981.db2.gz DHGQYLLQZJWOHQ-QGZVFWFLSA-N 0 1 324.449 4.087 20 0 DIADMN c1c2cccnc2sc1CN1CC[C@@H]1COCc1ccccc1 ZINC001233347835 1054242993 /nfs/dbraw/zinc/24/29/93/1054242993.db2.gz DHGQYLLQZJWOHQ-QGZVFWFLSA-N 0 1 324.449 4.087 20 0 DIADMN CC(C)c1nnc(CNCCCc2cccc(Cl)c2)s1 ZINC001336717346 1054244789 /nfs/dbraw/zinc/24/47/89/1054244789.db2.gz UHKIOLBNQOQQGW-UHFFFAOYSA-N 0 1 309.866 4.037 20 0 DIADMN Cc1ncc([C@H](C)N[C@H](C)c2ccc(Cl)c(F)c2)c(C)n1 ZINC001336709402 1054245437 /nfs/dbraw/zinc/24/54/37/1054245437.db2.gz VVZHZGZRTSIEQV-ZJUUUORDSA-N 0 1 307.800 4.298 20 0 DIADMN CSc1cccc(Cl)c1CN1CCC(OC(C)C)CC1 ZINC001233352838 1054247674 /nfs/dbraw/zinc/24/76/74/1054247674.db2.gz VXSLYXBDKZHRBX-UHFFFAOYSA-N 0 1 313.894 4.451 20 0 DIADMN CSc1cccc(Cl)c1CN1CCC(SC)CC1 ZINC001233352924 1054248404 /nfs/dbraw/zinc/24/84/04/1054248404.db2.gz ZWROALTZPHYICX-UHFFFAOYSA-N 0 1 301.908 4.389 20 0 DIADMN CSc1cccc(Cl)c1C[N@H+]1CC[C@@H](c2ccncc2)C1 ZINC001233352808 1054250449 /nfs/dbraw/zinc/25/04/49/1054250449.db2.gz UOYFMBYDIKVCRE-CQSZACIVSA-N 0 1 318.873 4.446 20 0 DIADMN COc1cccc([C@@H]2CCCCN2Cc2cccc3nccn32)c1 ZINC001233363262 1054250550 /nfs/dbraw/zinc/25/05/50/1054250550.db2.gz RQQSDSSYCHNSBG-IBGZPJMESA-N 0 1 321.424 4.070 20 0 DIADMN CC[C@H](NCc1cccn1C1CC1)c1cccc(OC)c1OC ZINC001336918492 1054251215 /nfs/dbraw/zinc/25/12/15/1054251215.db2.gz OVIPSEGCTGMGCF-KRWDZBQOSA-N 0 1 314.429 4.081 20 0 DIADMN Cc1cccc([C@H]2CCCN2Cc2cc(F)c(F)cc2N)c1 ZINC001233378166 1054256969 /nfs/dbraw/zinc/25/69/69/1054256969.db2.gz IRCHZJUFDSUYRA-GOSISDBHSA-N 0 1 302.368 4.193 20 0 DIADMN Cc1ccc(NC(=O)CN[C@@H](C)c2ccc(Cl)c(F)c2)cc1 ZINC001337219912 1054259951 /nfs/dbraw/zinc/25/99/51/1054259951.db2.gz DJGOMHQRKAYQGA-LBPRGKRZSA-N 0 1 320.795 4.077 20 0 DIADMN Clc1ccn2cc(CN3CCC[C@@H]4CCCC[C@H]43)nc2c1 ZINC001233391407 1054260149 /nfs/dbraw/zinc/26/01/49/1054260149.db2.gz GTBVZWHMRYPWLW-XJKSGUPXSA-N 0 1 303.837 4.142 20 0 DIADMN Fc1cc(F)cc(-c2n[nH]cc2CN2C3CCCC2CCC3)c1 ZINC001233406433 1054264287 /nfs/dbraw/zinc/26/42/87/1054264287.db2.gz OTXLIXHQWXCHGT-UHFFFAOYSA-N 0 1 317.383 4.262 20 0 DIADMN CCC[C@@H]1CCCCN1C(=O)c1cccc(C(F)(F)F)c1O ZINC000622510067 1054264633 /nfs/dbraw/zinc/26/46/33/1054264633.db2.gz VDWZPBIFHUWHQM-LLVKDONJSA-N 0 1 315.335 4.206 20 0 DIADMN CCC[C@H]1CCCCN1C(=O)c1cc(C2CCCCC2)[nH]n1 ZINC000622509606 1054264657 /nfs/dbraw/zinc/26/46/57/1054264657.db2.gz HGFDVWSGHPUDKY-HNNXBMFYSA-N 0 1 303.450 4.252 20 0 DIADMN CCC[C@@H]1CCCCN1C(=O)c1cc(-c2ccc(C)cc2)[nH]n1 ZINC000622509782 1054265208 /nfs/dbraw/zinc/26/52/08/1054265208.db2.gz MMXUCRQSIQRQLU-MRXNPFEDSA-N 0 1 311.429 4.180 20 0 DIADMN Clc1cccn2cc(CN3C[C@@H]4C[C@H](C3)c3ccccc34)nc12 ZINC001233423940 1054266974 /nfs/dbraw/zinc/26/69/74/1054266974.db2.gz RCAYHLSZZWFJJW-OKILXGFUSA-N 0 1 323.827 4.074 20 0 DIADMN Cc1ccc([C@H](C)NCc2cc(OCC(F)F)ccn2)c(C)c1 ZINC001337398967 1054268298 /nfs/dbraw/zinc/26/82/98/1054268298.db2.gz QPKCIGLOVUAAHB-AWEZNQCLSA-N 0 1 320.383 4.193 20 0 DIADMN CCN(Cc1cn2cccc(Cl)c2n1)Cc1ccc(C)cc1 ZINC001233424467 1054271379 /nfs/dbraw/zinc/27/13/79/1054271379.db2.gz NGAYAVXUOSKWRF-UHFFFAOYSA-N 0 1 313.832 4.318 20 0 DIADMN CN(Cc1c[nH]c(Br)c1)Cc1cccc(Cl)c1 ZINC001233436355 1054271782 /nfs/dbraw/zinc/27/17/82/1054271782.db2.gz IRGCZIKYHCHRRM-UHFFFAOYSA-N 0 1 313.626 4.063 20 0 DIADMN COc1ccc(-c2csc(CNCc3ncccc3C)c2)cc1 ZINC001337567276 1054275273 /nfs/dbraw/zinc/27/52/73/1054275273.db2.gz SCIJRJFNRWJSOI-UHFFFAOYSA-N 0 1 324.449 4.417 20 0 DIADMN CCc1oc(C(=O)OC)cc1CN[C@@H](CC)c1ccc(F)cc1 ZINC001337648481 1054278539 /nfs/dbraw/zinc/27/85/39/1054278539.db2.gz FEIZWKFUVCGCJB-HNNXBMFYSA-N 0 1 319.376 4.009 20 0 DIADMN CC1(C(=O)Nc2ccc3nc(-c4cccc(F)c4)[nH]c3c2)CCC1 ZINC001356109581 1054281298 /nfs/dbraw/zinc/28/12/98/1054281298.db2.gz KYRRCRKDYZISFX-UHFFFAOYSA-N 0 1 323.371 4.498 20 0 DIADMN CCCCC(=O)Nc1ccc2nc(-c3cccc(F)c3)[nH]c2c1 ZINC001356110223 1054281607 /nfs/dbraw/zinc/28/16/07/1054281607.db2.gz ZOURVZOUPTYIAY-UHFFFAOYSA-N 0 1 311.360 4.498 20 0 DIADMN CCC[C@H](NCc1ccc(/C=C/C(=O)OC)o1)c1ccccc1 ZINC000848891343 1054285693 /nfs/dbraw/zinc/28/56/93/1054285693.db2.gz PFDJLVHFVPXQHM-HHNLSAEISA-N 0 1 313.397 4.097 20 0 DIADMN Cc1ccc(C)c([C@@H]2CCC[N@@H+]2Cc2cnc(Cl)n2C)c1 ZINC000848888010 1054286312 /nfs/dbraw/zinc/28/63/12/1054286312.db2.gz KHSKVDGQGFHDKU-INIZCTEOSA-N 0 1 303.837 4.027 20 0 DIADMN Cc1ccc(C)c([C@@H]2CCCN2Cc2cnc(Cl)n2C)c1 ZINC000848888010 1054286317 /nfs/dbraw/zinc/28/63/17/1054286317.db2.gz KHSKVDGQGFHDKU-INIZCTEOSA-N 0 1 303.837 4.027 20 0 DIADMN C[C@@H](Oc1n[nH]c(=O)cc1Cl)c1cc2ccccc2s1 ZINC001233586068 1054301532 /nfs/dbraw/zinc/30/15/32/1054301532.db2.gz CXFHWCKQMKXNRE-MRVPVSSYSA-N 0 1 306.774 4.190 20 0 DIADMN CCc1ccc(NC(=O)c2cn[nH]c2C(C)(C)C)cc1Cl ZINC000622597641 1054306687 /nfs/dbraw/zinc/30/66/87/1054306687.db2.gz UBHYJRCVWLCXPA-UHFFFAOYSA-N 0 1 305.809 4.175 20 0 DIADMN CC(C)C[C@]1(C)CCCN1C(=O)c1cc(C2CCCCC2)[nH]n1 ZINC000622637620 1054314361 /nfs/dbraw/zinc/31/43/61/1054314361.db2.gz BJHIDBHINKLLKC-IBGZPJMESA-N 0 1 317.477 4.498 20 0 DIADMN CCC[C@H](CC)C(=O)Nc1cccc(CN2CCSCC2)c1 ZINC001356377521 1054324404 /nfs/dbraw/zinc/32/44/04/1054324404.db2.gz HJJLDNRADBBZFE-INIZCTEOSA-N 0 1 320.502 4.000 20 0 DIADMN CCOc1cccc(C[NH2+][C@H](C)c2cc(Cl)ccc2[O-])c1 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CCCCCC(=O)NC[C@H](c1ccccc1Cl)N(CC)CC ZINC001440869154 1054371237 /nfs/dbraw/zinc/37/12/37/1054371237.db2.gz WSWNCWXKTUONGQ-QGZVFWFLSA-N 0 1 324.896 4.419 20 0 DIADMN CCCCCC(=O)NC[C@@H](c1ccccc1Cl)N(CC)CC ZINC001440869153 1054371931 /nfs/dbraw/zinc/37/19/31/1054371931.db2.gz WSWNCWXKTUONGQ-KRWDZBQOSA-N 0 1 324.896 4.419 20 0 DIADMN CC[C@@H](C)c1ccc([C@@H](NC(=O)[C@H]2CCCN2C)C(C)C)cc1 ZINC001440948951 1054375913 /nfs/dbraw/zinc/37/59/13/1054375913.db2.gz VPGRZMSOLHKRKV-LZQZEXGQSA-N 0 1 316.489 4.108 20 0 DIADMN CC(C)CCCCCCNC(=O)c1ccc(CN2CCCC2)o1 ZINC001441068519 1054381491 /nfs/dbraw/zinc/38/14/91/1054381491.db2.gz PCZLNLCSDQVCLW-UHFFFAOYSA-N 0 1 320.477 4.212 20 0 DIADMN CC(C)(C)[C@@H]1CCCC[C@H]1NC(=O)c1[nH]nc2c1CCCCC2 ZINC001441135133 1054384276 /nfs/dbraw/zinc/38/42/76/1054384276.db2.gz OIDKEXGDBJBPPE-GDBMZVCRSA-N 0 1 317.477 4.013 20 0 DIADMN CC[C@H]1CCCC[C@H]1NC(=O)c1cccc2nc(C(F)F)[nH]c21 ZINC001441185961 1054386892 /nfs/dbraw/zinc/38/68/92/1054386892.db2.gz 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/nfs/dbraw/zinc/57/02/49/1055570249.db2.gz LHMGAVURWLZENO-QGZVFWFLSA-N 0 1 320.433 4.230 20 0 DIADMN Fc1cccc(-c2nc(CN3CCCCC34CC4)cs2)c1 ZINC001237974765 1055570388 /nfs/dbraw/zinc/57/03/88/1055570388.db2.gz HDLFGYACNDFSNJ-UHFFFAOYSA-N 0 1 302.418 4.468 20 0 DIADMN Cc1sccc1CN1CCN([C@@H](C)c2ccc(F)cc2)CC1 ZINC001237976817 1055571301 /nfs/dbraw/zinc/57/13/01/1055571301.db2.gz UNXCANTYFFCJLG-AWEZNQCLSA-N 0 1 318.461 4.074 20 0 DIADMN C[C@H]1CC[N@@H+](Cc2cc(F)c([O-])c(Cl)c2)CCC1(F)F ZINC001237984924 1055572246 /nfs/dbraw/zinc/57/22/46/1055572246.db2.gz SCSWLALCKOAUDD-VIFPVBQESA-N 0 1 307.743 4.052 20 0 DIADMN CC[C@H]1CCCN(Cc2csc(-c3ccc(O)cc3)n2)C1 ZINC001237980911 1055572497 /nfs/dbraw/zinc/57/24/97/1055572497.db2.gz FSPYVGLQXVQSIP-ZDUSSCGKSA-N 0 1 302.443 4.138 20 0 DIADMN CC[C@H]1CCCCN1Cc1csc(-c2ccc(O)cc2)n1 ZINC001237980401 1055573179 /nfs/dbraw/zinc/57/31/79/1055573179.db2.gz DHYCGYKFXMZGTJ-HNNXBMFYSA-N 0 1 302.443 4.280 20 0 DIADMN C[C@@H]1CCN(Cc2csc(-c3ccc(O)cc3)n2)[C@H](C)C1 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CC(C)(C)Oc1ccc(CNCc2ccnn2C2CCC2)cc1 ZINC000921590749 1055579346 /nfs/dbraw/zinc/57/93/46/1055579346.db2.gz DCXHZOKIFVYUPW-UHFFFAOYSA-N 0 1 313.445 4.075 20 0 DIADMN CC(C)OC1CCC([NH2+][C@H](C)c2cc(Cl)ccc2[O-])CC1 ZINC000186160086 1055579368 /nfs/dbraw/zinc/57/93/68/1055579368.db2.gz DQKUICJXNHKXLC-LRVUVFPRSA-N 0 1 311.853 4.432 20 0 DIADMN C[C@H]1c2ccccc2CCN1Cc1cccc(N2CCCCC2)n1 ZINC001238001128 1055579467 /nfs/dbraw/zinc/57/94/67/1055579467.db2.gz ROHRYDCKOFAUHM-KRWDZBQOSA-N 0 1 321.468 4.191 20 0 DIADMN Cc1noc([C@@H](C)Nc2ccc(N3CCCCCC3)cc2C)n1 ZINC000671644257 1055580578 /nfs/dbraw/zinc/58/05/78/1055580578.db2.gz GGKCPMJJQWYORB-CQSZACIVSA-N 0 1 314.433 4.240 20 0 DIADMN Clc1ccc2c(c1)n[nH]c2CN1C[C@@H]2C[C@H](C1)c1ccccc12 ZINC001238002848 1055580748 /nfs/dbraw/zinc/58/07/48/1055580748.db2.gz FMJDBJCFRVZBJZ-BETUJISGSA-N 0 1 323.827 4.303 20 0 DIADMN CCN(Cc1[nH]nc2cc(Cl)ccc21)Cc1cccc(F)c1 ZINC001238003732 1055581146 /nfs/dbraw/zinc/58/11/46/1055581146.db2.gz KQIOMQLFIPDWCY-UHFFFAOYSA-N 0 1 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ZRBWONHXURKYHY-INIZCTEOSA-N 0 1 315.392 4.264 20 0 DIADMN COC(=O)c1cc(C[N@H+]2CC[C@@H](C(C)(C)C)C[C@H]2C)c(C)o1 ZINC001559880077 1059698983 /nfs/dbraw/zinc/69/89/83/1059698983.db2.gz XIQZOWBMLAONCS-IUODEOHRSA-N 0 1 307.434 4.021 20 0 DIADMN CC(C)CC1(C)CCN(C[C@@H](O)c2c(F)cccc2F)CC1 ZINC001559884235 1059704728 /nfs/dbraw/zinc/70/47/28/1059704728.db2.gz PHOUDICONIQBCY-MRXNPFEDSA-N 0 1 311.416 4.146 20 0 DIADMN Cc1cccc(C)c1NC(=O)CN1CCC(C)(CC(C)C)CC1 ZINC001559884410 1059705717 /nfs/dbraw/zinc/70/57/17/1059705717.db2.gz ULQBYZGNEHPOOJ-UHFFFAOYSA-N 0 1 316.489 4.390 20 0 DIADMN CC1(C)CN(CCSc2ccncc2)[C@@H]1c1cccs1 ZINC001559887199 1059707563 /nfs/dbraw/zinc/70/75/63/1059707563.db2.gz DIRYVEZWZISOPE-OAHLLOKOSA-N 0 1 304.484 4.318 20 0 DIADMN CCCCN(C(=O)c1ccc(CN2CCCCC2)o1)[C@H](C)CC ZINC001532844124 1059725411 /nfs/dbraw/zinc/72/54/11/1059725411.db2.gz FVXGVKCCWOHQDO-MRXNPFEDSA-N 0 1 320.477 4.306 20 0 DIADMN C[C@H](c1nc(-c2ccc(OC(C)(C)C)cc2)no1)N1CCCC1 ZINC001248123383 1059733888 /nfs/dbraw/zinc/73/38/88/1059733888.db2.gz VMCYFYAPTLUVFX-CYBMUJFWSA-N 0 1 315.417 4.071 20 0 DIADMN C[C@H](c1nc(-c2cc3ccoc3c(Cl)c2)no1)N1CCCC1 ZINC001248122495 1059736632 /nfs/dbraw/zinc/73/66/32/1059736632.db2.gz MAFFNHYLHYRKFS-SNVBAGLBSA-N 0 1 317.776 4.293 20 0 DIADMN Cc1ccc(Cl)cc1-c1noc(CN(C)C2CCCC2)n1 ZINC001248140112 1059738983 /nfs/dbraw/zinc/73/89/83/1059738983.db2.gz MVBSURMRZFPJJS-UHFFFAOYSA-N 0 1 305.809 4.073 20 0 DIADMN CCC(CC)CN1CCOc2cccc(Br)c2C1 ZINC001559946947 1059760246 /nfs/dbraw/zinc/76/02/46/1059760246.db2.gz GHQLBQJMTMCKEH-UHFFFAOYSA-N 0 1 312.251 4.080 20 0 DIADMN CN[C@H](CC(C)C)c1nc(-c2cc(Cl)ccc2Cl)no1 ZINC001248205123 1059748449 /nfs/dbraw/zinc/74/84/49/1059748449.db2.gz FCSFWCUQFHZPMB-GFCCVEGCSA-N 0 1 314.216 4.350 20 0 DIADMN CCOc1ccc(-c2noc([C@@H](CC(C)C)NC)n2)cc1Cl ZINC001248205611 1059750774 /nfs/dbraw/zinc/75/07/74/1059750774.db2.gz KGIKZODJISGJIF-CYBMUJFWSA-N 0 1 323.824 4.095 20 0 DIADMN C[C@@]1(Cc2ccccc2F)CCCN1Cc1cccnc1Cl ZINC001559938478 1059753414 /nfs/dbraw/zinc/75/34/14/1059753414.db2.gz JCFDJBCTKCMHNI-SFHVURJKSA-N 0 1 318.823 4.471 20 0 DIADMN C[C@H]1[C@H](c2ccc(Br)cc2)OCCN1CCC1CC1 ZINC001559983852 1059790798 /nfs/dbraw/zinc/79/07/98/1059790798.db2.gz HUIZCXYYHHHNCL-BLLLJJGKSA-N 0 1 324.262 4.011 20 0 DIADMN CC(C)CCc1noc(CN2CCC[C@H]2CC2CCCC2)n1 ZINC001559952343 1059760175 /nfs/dbraw/zinc/76/01/75/1059760175.db2.gz IFXQNIZSMAKTFX-INIZCTEOSA-N 0 1 305.466 4.203 20 0 DIADMN CCC1CCC(c2ccc(-c3noc([C@H]4CCN4)n3)cc2)CC1 ZINC001248284125 1059770326 /nfs/dbraw/zinc/77/03/26/1059770326.db2.gz IFOYXSJDWHEWHI-MQBCKMQZSA-N 0 1 311.429 4.455 20 0 DIADMN Cc1ccc(SCCN2C[C@H](C)OC3(CCC3)C2)cc1C ZINC001559965097 1059772297 /nfs/dbraw/zinc/77/22/97/1059772297.db2.gz REMSCOVQVZPBJL-INIZCTEOSA-N 0 1 305.487 4.039 20 0 DIADMN C[C@@H]1CN(CCCc2ccccc2Cl)CC2(CCCC2)O1 ZINC001559968865 1059777895 /nfs/dbraw/zinc/77/78/95/1059777895.db2.gz NMVHOSWWQYEDBD-OAHLLOKOSA-N 0 1 307.865 4.306 20 0 DIADMN Cc1cccc2nc(CN3CCC(C4CCCCC4)CC3)cn21 ZINC001559973151 1059781366 /nfs/dbraw/zinc/78/13/66/1059781366.db2.gz FUCSKTYAELXJHH-UHFFFAOYSA-N 0 1 311.473 4.435 20 0 DIADMN CSc1ccc(OCCN2CC[C@@H]2c2ccc(F)cc2)cc1 ZINC001559983913 1059787775 /nfs/dbraw/zinc/78/77/75/1059787775.db2.gz JRCRTODVVXXVHT-GOSISDBHSA-N 0 1 317.429 4.373 20 0 DIADMN CCCCC[C@@H]1CCCCN1C(=O)c1ccc2cncn2c1C ZINC001533107765 1059796596 /nfs/dbraw/zinc/79/65/96/1059796596.db2.gz HEKCZOMHMBBJSS-MRXNPFEDSA-N 0 1 313.445 4.218 20 0 DIADMN CCC(C)(C)c1ccc(CN2CCO[C@](C)(C3CC3)C2)cc1 ZINC001559992500 1059798475 /nfs/dbraw/zinc/79/84/75/1059798475.db2.gz BCXISTIYMWQHFL-FQEVSTJZSA-N 0 1 301.474 4.375 20 0 DIADMN O=C(C=Cc1cccs1)Nc1nc2cc(Cl)c(F)cc2[nH]1 ZINC001533133341 1059806509 /nfs/dbraw/zinc/80/65/09/1059806509.db2.gz ZZKHGWBNQDQYBE-ARJAWSKDSA-N 0 1 321.764 4.069 20 0 DIADMN Fc1ccc(CN2CCC([C@H]3CCCCO3)CC2)c(Cl)c1 ZINC001560004625 1059811646 /nfs/dbraw/zinc/81/16/46/1059811646.db2.gz KUNZVGKFBGYTLY-QGZVFWFLSA-N 0 1 311.828 4.260 20 0 DIADMN CCO[C@H](CN1CC[C@H]1c1ccc(Br)cc1)C1CC1 ZINC001560019668 1059828220 /nfs/dbraw/zinc/82/82/20/1059828220.db2.gz HKZCYHLYGCSGFV-JKSUJKDBSA-N 0 1 324.262 4.011 20 0 DIADMN CCN(CC)[C@@H](C(=O)Nc1cc(C)cc(F)c1)c1ccccc1 ZINC001533211688 1059829806 /nfs/dbraw/zinc/82/98/06/1059829806.db2.gz WBHAXQOJKOMQNV-GOSISDBHSA-N 0 1 314.404 4.156 20 0 DIADMN CC(C)(C)CN(CC[C@@H]1C[C@H]1C1CC1)CC(=O)OC(C)(C)C ZINC001560020588 1059832226 /nfs/dbraw/zinc/83/22/26/1059832226.db2.gz FKGVCMLMMMPBBY-CVEARBPZSA-N 0 1 309.494 4.112 20 0 DIADMN Clc1cc(CN2CCC[C@H]2c2ccccc2)c2nccn2c1 ZINC001248447140 1059837730 /nfs/dbraw/zinc/83/77/30/1059837730.db2.gz HSAPZPZCMKEERT-KRWDZBQOSA-N 0 1 311.816 4.325 20 0 DIADMN c1c(CN2CCC[C@@H](C3CCCCC3)C2)nn2c1CCCC2 ZINC001560024646 1059842725 /nfs/dbraw/zinc/84/27/25/1059842725.db2.gz OUPSGALYZGAXFS-QGZVFWFLSA-N 0 1 301.478 4.012 20 0 DIADMN CC(C)[C@H](NC/C(Cl)=C/Cl)[C@@H](O)c1ccc(Cl)cc1 ZINC001560031085 1059843928 /nfs/dbraw/zinc/84/39/28/1059843928.db2.gz OZMRADIRPPPBKO-OBFMZJQYSA-N 0 1 322.663 4.307 20 0 DIADMN Cc1ccc(O[C@@H]2CCN(Cc3ccc(C)cc3Cl)C2)nc1 ZINC001560038929 1059850617 /nfs/dbraw/zinc/85/06/17/1059850617.db2.gz ZNEVUIPIIRXGOK-MRXNPFEDSA-N 0 1 316.832 4.005 20 0 DIADMN Cc1ccccc1[C@@H](C)N(C)CC(=O)N(C)CC1CCCCC1 ZINC001560039727 1059850953 /nfs/dbraw/zinc/85/09/53/1059850953.db2.gz QIXPLCPDCNKQEO-QGZVFWFLSA-N 0 1 316.489 4.027 20 0 DIADMN Fc1ccc2occc2c1CN1CC[C@@H](F)C(F)(F)CC1 ZINC001248523927 1059864678 /nfs/dbraw/zinc/86/46/78/1059864678.db2.gz HLSKDVBUXMGCTG-CQSZACIVSA-N 0 1 301.283 4.141 20 0 DIADMN Cc1cc(Br)ccc1CN1CCC(CCF)CC1 ZINC001560053299 1059866792 /nfs/dbraw/zinc/86/67/92/1059866792.db2.gz DCUVZMCTYYCRJP-UHFFFAOYSA-N 0 1 314.242 4.329 20 0 DIADMN O[C@H](c1ccccc1)[C@H]1CCCN1Cc1cccc(Cl)c1F ZINC001560053927 1059868493 /nfs/dbraw/zinc/86/84/93/1059868493.db2.gz NAPGNOIHMXDVCQ-SJLPKXTDSA-N 0 1 319.807 4.177 20 0 DIADMN C[N@@H+](CCc1ccc(F)cc1)Cc1c2ccoc2ccc1F ZINC001248539860 1059871581 /nfs/dbraw/zinc/87/15/81/1059871581.db2.gz WSNNLKPJXXQYNK-UHFFFAOYSA-N 0 1 301.336 4.386 20 0 DIADMN Clc1ncsc1CN1C[C@H]2[C@H](C[C@@H]2c2ccccc2)C1 ZINC001560065402 1059878286 /nfs/dbraw/zinc/87/82/86/1059878286.db2.gz MQQJKLKSQACFIV-MCIONIFRSA-N 0 1 304.846 4.032 20 0 DIADMN Cc1ccc2c(CN3CCC[C@@H]3c3nccs3)cccc2n1 ZINC001248569095 1059889933 /nfs/dbraw/zinc/88/99/33/1059889933.db2.gz PMDNEGHCUIKFIS-QGZVFWFLSA-N 0 1 309.438 4.337 20 0 DIADMN CCC[C@H](CC1CCCC1)C(=O)NC[C@H]1[N@@H+](C)CCCC1(C)C ZINC001525443984 1059890845 /nfs/dbraw/zinc/89/08/45/1059890845.db2.gz XURGRNMERVQDJR-QZTJIDSGSA-N 0 1 322.537 4.220 20 0 DIADMN CC1(C)CCCC[C@H]1CN1Cc2cccnc2N2CCC[C@@H]2C1 ZINC001560082700 1059892686 /nfs/dbraw/zinc/89/26/86/1059892686.db2.gz GXNDWGMIZSZVIQ-ZWKOTPCHSA-N 0 1 313.489 4.082 20 0 DIADMN Cc1ccc2c(CN3CCc4c(F)cccc4C3)cccc2n1 ZINC001248573518 1059893139 /nfs/dbraw/zinc/89/31/39/1059893139.db2.gz JZUPHWOHQBTHJE-UHFFFAOYSA-N 0 1 306.384 4.241 20 0 DIADMN CC1(C)[C@@H](c2ccccc2F)CCN1Cc1cnc(Cl)cn1 ZINC001560078032 1059893539 /nfs/dbraw/zinc/89/35/39/1059893539.db2.gz GLFSUEQZQDTTFB-CQSZACIVSA-N 0 1 319.811 4.037 20 0 DIADMN COCc1ccc(CN2CCC[C@](F)(c3ccccc3)C2)cc1 ZINC001560081163 1059895679 /nfs/dbraw/zinc/89/56/79/1059895679.db2.gz COCAMTIDADNADR-HXUWFJFHSA-N 0 1 313.416 4.294 20 0 DIADMN FC[C@H](NC1CC(OCc2ccccc2)C1)c1ccc(F)cc1 ZINC001560086319 1059897352 /nfs/dbraw/zinc/89/73/52/1059897352.db2.gz BLUHBCFLIKDCLX-ACBHZAAOSA-N 0 1 317.379 4.174 20 0 DIADMN CCN(Cc1ccc(Cl)cc1F)[C@H](CO)c1ccccc1 ZINC001560097919 1059905809 /nfs/dbraw/zinc/90/58/09/1059905809.db2.gz SCVHAWOSSGAGAV-QGZVFWFLSA-N 0 1 307.796 4.035 20 0 DIADMN Clc1ccc(CN[C@@H](Cn2ccnc2)c2ccccc2)s1 ZINC001560099056 1059907432 /nfs/dbraw/zinc/90/74/32/1059907432.db2.gz ZYMVFBBIFNAMDY-HNNXBMFYSA-N 0 1 317.845 4.129 20 0 DIADMN FC[C@H]1CCN(Cc2cc3cc(Cl)ccc3nc2Cl)C1 ZINC001560102906 1059909799 /nfs/dbraw/zinc/90/97/99/1059909799.db2.gz BIHUGMAPFUEAPV-SNVBAGLBSA-N 0 1 313.203 4.333 20 0 DIADMN Cc1cccc(Br)c1CN1CC(c2ccccc2)C1 ZINC001248619243 1059918956 /nfs/dbraw/zinc/91/89/56/1059918956.db2.gz XNKKHDDNDMLDLW-UHFFFAOYSA-N 0 1 316.242 4.357 20 0 DIADMN Cc1nc(CN2CC[C@@H](c3ccc(F)c(F)c3)C2(C)C)[nH]c1C ZINC001560112850 1059921134 /nfs/dbraw/zinc/92/11/34/1059921134.db2.gz QGODMGWLZPZJFB-AWEZNQCLSA-N 0 1 319.399 4.073 20 0 DIADMN CC(C)Oc1ccccc1CN1CC[C@](C)(C(F)(F)F)C1 ZINC001560123835 1059924708 /nfs/dbraw/zinc/92/47/08/1059924708.db2.gz HRPXIRKHCSQLCO-HNNXBMFYSA-N 0 1 301.352 4.248 20 0 DIADMN C[C@]1(C(F)(F)F)CCN(Cc2ccccc2C(F)(F)F)C1 ZINC001560123861 1059927722 /nfs/dbraw/zinc/92/77/22/1059927722.db2.gz ICUAAXYVBPIOHX-LBPRGKRZSA-N 0 1 311.269 4.480 20 0 DIADMN OC1(C[C@H]2CCCCN2C/C(Cl)=C\Cl)CCCCC1 ZINC001560135171 1059940661 /nfs/dbraw/zinc/94/06/61/1059940661.db2.gz DOYIFYKYCCAFGH-YPDDLIOESA-N 0 1 306.277 4.245 20 0 DIADMN CC(C)(NCc1cc(C(F)(F)F)co1)c1ccc(F)cc1 ZINC001560146930 1059943010 /nfs/dbraw/zinc/94/30/10/1059943010.db2.gz CPUOIYGKOSQTLZ-UHFFFAOYSA-N 0 1 301.283 4.462 20 0 DIADMN CCC[C@@H]1CCCN1Cc1c(F)cccc1Br ZINC001560201705 1059979237 /nfs/dbraw/zinc/97/92/37/1059979237.db2.gz VEBARSZEFPXWOH-LLVKDONJSA-N 0 1 300.215 4.353 20 0 DIADMN Clc1ccc(/C=C\CN2CCC[C@H](c3ncccn3)C2)cc1 ZINC001560150215 1059947387 /nfs/dbraw/zinc/94/73/87/1059947387.db2.gz QSDDAHNHSVODMU-YDOVZFOCSA-N 0 1 313.832 4.023 20 0 DIADMN Clc1ccc(/C=C\CN2CCC[C@@H](c3ncccn3)C2)cc1 ZINC001560150213 1059948667 /nfs/dbraw/zinc/94/86/67/1059948667.db2.gz QSDDAHNHSVODMU-RKLPNKIQSA-N 0 1 313.832 4.023 20 0 DIADMN CC(C)Oc1cccc(CN[C@@]2(C)CCOc3ccccc32)c1 ZINC001560168211 1059960572 /nfs/dbraw/zinc/96/05/72/1059960572.db2.gz CYSAOQNGEVLAOQ-FQEVSTJZSA-N 0 1 311.425 4.261 20 0 DIADMN Cc1cc([C@@H]2CCCCN2Cc2nc3ccccc3s2)n[nH]1 ZINC001560173948 1059966254 /nfs/dbraw/zinc/96/62/54/1059966254.db2.gz RTPNZNUPNQWJAY-HNNXBMFYSA-N 0 1 312.442 4.055 20 0 DIADMN C[C@H](c1ccc(Cl)c(Cl)c1)N1CC[C@@H](c2ncccn2)C1 ZINC001560177430 1059966738 /nfs/dbraw/zinc/96/67/38/1059966738.db2.gz UMGBTSAGPCRMDI-DGCLKSJQSA-N 0 1 322.239 4.334 20 0 DIADMN COc1ccccc1Oc1cccc(C[N@@H+](C)CCSC)c1 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4.131 20 0 DIADMN CCOc1ccc(NC(=O)c2ccc(Cl)cc2O)c(C)c1 ZINC001464350668 1061580589 /nfs/dbraw/zinc/58/05/89/1061580589.db2.gz YNVZGAMHDUIUOY-UHFFFAOYSA-N 0 1 305.761 4.005 20 0 DIADMN C[C@@H]1CN(c2ccncc2C(F)(F)F)C[C@H](c2ccccc2)O1 ZINC001458119655 1061581686 /nfs/dbraw/zinc/58/16/86/1061581686.db2.gz PYTGGPCWLGCDOX-MLGOLLRUSA-N 0 1 322.330 4.067 20 0 DIADMN CCCn1cncc1CN[C@H](CC(C)C)c1ccccc1OC ZINC001474040602 1061585997 /nfs/dbraw/zinc/58/59/97/1061585997.db2.gz BKOFXOMERXQSFQ-GOSISDBHSA-N 0 1 315.461 4.179 20 0 DIADMN COc1ccccc1[C@H](CC(C)C)NCc1cnc(F)c(C)c1 ZINC001474040867 1061586131 /nfs/dbraw/zinc/58/61/31/1061586131.db2.gz GPVBPIGQRVXLGY-KRWDZBQOSA-N 0 1 316.420 4.415 20 0 DIADMN CC[C@H](C)Oc1ccc(NC(=O)c2ccc(Cl)cc2O)cc1 ZINC001464452419 1061597011 /nfs/dbraw/zinc/59/70/11/1061597011.db2.gz WSLSNOHAEYYTQY-NSHDSACASA-N 0 1 319.788 4.475 20 0 DIADMN COc1ccc(CC[C@@H](C)Nc2ccc3c(c2)nc(C)n3C)cc1 ZINC001474051797 1061599664 /nfs/dbraw/zinc/59/96/64/1061599664.db2.gz MBUVBYVOIFZUBF-CQSZACIVSA-N 0 1 323.440 4.324 20 0 DIADMN CC(C)CCOc1cccc(NC(=O)c2cccc3nc[nH]c32)c1 ZINC001464486497 1061600853 /nfs/dbraw/zinc/60/08/53/1061600853.db2.gz RLPJYACMXLLXSS-UHFFFAOYSA-N 0 1 323.396 4.240 20 0 DIADMN CCCN(C(=O)CCc1cc(C)[nH]n1)[C@H](CC)c1ccccc1 ZINC001464519938 1061603022 /nfs/dbraw/zinc/60/30/22/1061603022.db2.gz IOGCHHFSBGUFBJ-GOSISDBHSA-N 0 1 313.445 4.041 20 0 DIADMN Clc1ccc2c(c1)[C@@H](NCc1cc3ccncc3s1)CO2 ZINC001474065313 1061610308 /nfs/dbraw/zinc/61/03/08/1061610308.db2.gz LRUDVWCKBYYEQZ-AWEZNQCLSA-N 0 1 316.813 4.173 20 0 DIADMN c1nc2ccc(NCc3cnc(-c4ccccc4)[nH]3)cc2s1 ZINC001474094473 1061639346 /nfs/dbraw/zinc/63/93/46/1061639346.db2.gz OODSODSZCMDAFS-UHFFFAOYSA-N 0 1 306.394 4.299 20 0 DIADMN CCCCCOc1ccc(CNc2cc(OC)ccn2)cc1 ZINC001474098129 1061642295 /nfs/dbraw/zinc/64/22/95/1061642295.db2.gz BXHKPLSDNZSPHZ-UHFFFAOYSA-N 0 1 300.402 4.271 20 0 DIADMN CCCCOc1ccc(-c2nnc([C@@H](C(C)C)N(C)C)o2)cc1 ZINC001252413391 1061643194 /nfs/dbraw/zinc/64/31/94/1061643194.db2.gz WAWRZDRVKAVNSY-MRXNPFEDSA-N 0 1 317.433 4.174 20 0 DIADMN C[C@H](NCc1cnc(-c2ccccc2F)s1)c1ccc[nH]1 ZINC001474100252 1061647473 /nfs/dbraw/zinc/64/74/73/1061647473.db2.gz VOPLHMIRIRCYBE-NSHDSACASA-N 0 1 301.390 4.128 20 0 DIADMN Cc1cc(C)c(C=CCN[C@H](C)c2n[nH]c(C(C)C)n2)cc1C ZINC001474100314 1061649245 /nfs/dbraw/zinc/64/92/45/1061649245.db2.gz QSIBITDFZGOMNY-KXPUMZMLSA-N 0 1 312.461 4.217 20 0 DIADMN CCCOc1ccc(CNCc2ccc(OCC)o2)c(C)c1 ZINC001474110159 1061659347 /nfs/dbraw/zinc/65/93/47/1061659347.db2.gz DSRSINNAQXWPPI-UHFFFAOYSA-N 0 1 303.402 4.065 20 0 DIADMN Cc1c2ccccc2oc1[C@@H](C)NCc1ccc2oc(=O)oc2c1 ZINC001474110821 1061659785 /nfs/dbraw/zinc/65/97/85/1061659785.db2.gz KNYDTQFFKAEOAD-GFCCVEGCSA-N 0 1 323.348 4.291 20 0 DIADMN COc1ccc(CN[C@@H]2CCOc3ccc(F)cc32)cc1Cl ZINC001474114061 1061664376 /nfs/dbraw/zinc/66/43/76/1061664376.db2.gz XTMZNULYTPHPHN-OAHLLOKOSA-N 0 1 321.779 4.101 20 0 DIADMN COc1c2ccccc2oc1CNCc1ccc2[nH]ccc2c1 ZINC001474117160 1061666807 /nfs/dbraw/zinc/66/68/07/1061666807.db2.gz REQUSUQPVXLOTQ-UHFFFAOYSA-N 0 1 306.365 4.213 20 0 DIADMN CC(C)(C)[C@@H](Nc1nc(Cl)nc2[nH]cnc21)c1ccccc1 ZINC001458266157 1061667870 /nfs/dbraw/zinc/66/78/70/1061667870.db2.gz XZNITOSSXBTCDD-LBPRGKRZSA-N 0 1 315.808 4.206 20 0 DIADMN Fc1cccc2cc(CNCc3ccc(Cl)cc3F)cnc12 ZINC001474120018 1061669277 /nfs/dbraw/zinc/66/92/77/1061669277.db2.gz FFIWRGCFEUJMJO-UHFFFAOYSA-N 0 1 318.754 4.456 20 0 DIADMN FC(F)(F)c1cnccc1N1CC[C@@H](COc2ccccc2)C1 ZINC001458287094 1061677538 /nfs/dbraw/zinc/67/75/38/1061677538.db2.gz UYVTZGGLOTUJQI-CYBMUJFWSA-N 0 1 322.330 4.006 20 0 DIADMN Cc1ccc(-c2nnc(-c3cc4[nH]cc(Cl)cc-4n3)o2)cc1 ZINC001252624864 1061682241 /nfs/dbraw/zinc/68/22/41/1061682241.db2.gz LCQAGIQWNXKDMV-UHFFFAOYSA-N 0 1 310.744 4.242 20 0 DIADMN CC(C)CC[C@H](NC(=O)c1n[nH]c2ccccc21)C(C)(C)C ZINC001465159528 1061696436 /nfs/dbraw/zinc/69/64/36/1061696436.db2.gz STOODUSCLNSDQD-HNNXBMFYSA-N 0 1 301.434 4.144 20 0 DIADMN Cc1coc(CNC/C=C/c2ccc(Br)cc2)c1 ZINC001474157240 1061697497 /nfs/dbraw/zinc/69/74/97/1061697497.db2.gz HOPFGFDJWUBJID-NSCUHMNNSA-N 0 1 306.203 4.154 20 0 DIADMN CCCn1c(CNc2cc3c(cn2)CCCC3)nc2ccccc21 ZINC001474159068 1061700344 /nfs/dbraw/zinc/70/03/44/1061700344.db2.gz DQRLGUCWQMALJL-UHFFFAOYSA-N 0 1 320.440 4.332 20 0 DIADMN c1csc(CNc2ccc3nc(-c4ccccn4)[nH]c3c2)c1 ZINC001474172585 1061717340 /nfs/dbraw/zinc/71/73/40/1061717340.db2.gz VNQIVJUWHFIQQL-UHFFFAOYSA-N 0 1 306.394 4.299 20 0 DIADMN Cc1ccc(Oc2ccccc2CCNCc2ccon2)cc1 ZINC001474178645 1061723544 /nfs/dbraw/zinc/72/35/44/1061723544.db2.gz NPSMGGUJYNQEQD-UHFFFAOYSA-N 0 1 308.381 4.108 20 0 DIADMN CC(C)(C)c1ccc(-c2nnc([C@@H]3CCCc4[nH]cnc43)o2)cc1 ZINC001252812828 1061727166 /nfs/dbraw/zinc/72/71/66/1061727166.db2.gz KHYDDIDIDIZMMG-CQSZACIVSA-N 0 1 322.412 4.225 20 0 DIADMN CN(Cc1nnc(-c2ccc(C(C)(C)C)cc2)o1)C1CCCC1 ZINC001252817290 1061730616 /nfs/dbraw/zinc/73/06/16/1061730616.db2.gz FKXBVPHZMHPJTP-UHFFFAOYSA-N 0 1 313.445 4.409 20 0 DIADMN COc1ccc(OC)c(CNC2(c3cccc(C)c3)CCC2)c1 ZINC001474189896 1061739418 /nfs/dbraw/zinc/73/94/18/1061739418.db2.gz BQXNTZPVACBVDR-UHFFFAOYSA-N 0 1 311.425 4.181 20 0 DIADMN CCCn1cncc1CNC1(c2cccc(Cl)c2)CCC1 ZINC001474189745 1061739648 /nfs/dbraw/zinc/73/96/48/1061739648.db2.gz QMUUQLDENUMOKP-UHFFFAOYSA-N 0 1 303.837 4.116 20 0 DIADMN Cc1ccc(CNCc2cc(Cl)cc(C(F)(F)F)c2)nc1 ZINC001474192571 1061742286 /nfs/dbraw/zinc/74/22/86/1061742286.db2.gz JXYBRMZKICWFQY-UHFFFAOYSA-N 0 1 314.738 4.352 20 0 DIADMN C[C@@H](Nc1nc(Cl)nc2[nH]cnc21)c1cccc(C2CC2)c1 ZINC001458409648 1061749263 /nfs/dbraw/zinc/74/92/63/1061749263.db2.gz XIRJZOANKSQLLC-SECBINFHSA-N 0 1 313.792 4.057 20 0 DIADMN CC(C)(C)C(=O)c1ccc(NC(=O)c2ccc(O)cc2F)cc1 ZINC001465488304 1061765332 /nfs/dbraw/zinc/76/53/32/1061765332.db2.gz JUTOJOZFMMCUGW-UHFFFAOYSA-N 0 1 315.344 4.012 20 0 DIADMN CC(C)[C@@H](O)[C@@H](NCc1ccc(F)cc1Cl)c1ccccc1 ZINC001474221169 1061782056 /nfs/dbraw/zinc/78/20/56/1061782056.db2.gz BBMPIZOJUUFWQG-ZWKOTPCHSA-N 0 1 321.823 4.327 20 0 DIADMN CC(C)(NCc1[nH]nc2ccccc21)c1nc2ccccc2s1 ZINC001474222165 1061782188 /nfs/dbraw/zinc/78/21/88/1061782188.db2.gz LJRVSQFDTQMFOF-UHFFFAOYSA-N 0 1 322.437 4.198 20 0 DIADMN COc1cccc2c(CNCc3cccc(F)c3F)cccc12 ZINC001474226151 1061787826 /nfs/dbraw/zinc/78/78/26/1061787826.db2.gz KOKVTYBKOHYINT-UHFFFAOYSA-N 0 1 313.347 4.416 20 0 DIADMN COc1ccc(CNCc2ccnc(-c3ccccc3)c2)c(F)c1 ZINC001474228691 1061790507 /nfs/dbraw/zinc/79/05/07/1061790507.db2.gz JOYJQJMEOPSGGF-UHFFFAOYSA-N 0 1 322.383 4.186 20 0 DIADMN CCN(CC)[C@H](c1nnc(-c2ccccc2)o1)c1ccccc1 ZINC001253073887 1061793701 /nfs/dbraw/zinc/79/37/01/1061793701.db2.gz HHEKOINVJQSEIQ-KRWDZBQOSA-N 0 1 307.397 4.168 20 0 DIADMN Cc1c(NC(=O)c2cccc3nc[nH]c32)cccc1C(F)(F)F ZINC001465744720 1061806735 /nfs/dbraw/zinc/80/67/35/1061806735.db2.gz QHWALKGGAFSEIS-UHFFFAOYSA-N 0 1 319.286 4.142 20 0 DIADMN CCCCc1nc2ccc(NC(=O)[C@@H](C)c3ccccn3)cc2[nH]1 ZINC001465776111 1061807482 /nfs/dbraw/zinc/80/74/82/1061807482.db2.gz WFQMXCPYGQSWFC-ZDUSSCGKSA-N 0 1 322.412 4.043 20 0 DIADMN Clc1cccc(-c2cc(-c3nnc(-c4ccccc4)o3)[nH]n2)c1 ZINC001253113872 1061813719 /nfs/dbraw/zinc/81/37/19/1061813719.db2.gz NPUHQLHLUUKTEP-UHFFFAOYSA-N 0 1 322.755 4.447 20 0 DIADMN CCCOc1ccc(CNCc2ccc(C)nc2Cl)c(C)c1 ZINC001474247602 1061814635 /nfs/dbraw/zinc/81/46/35/1061814635.db2.gz BWURJEJNMBKNHL-UHFFFAOYSA-N 0 1 318.848 4.430 20 0 DIADMN COc1cc2nc(NC[C@H]3CCCC(C)(C)C3)[nH]c2cc1OC ZINC001474250895 1061820277 /nfs/dbraw/zinc/82/02/77/1061820277.db2.gz NMKSRALUDNRXKF-LBPRGKRZSA-N 0 1 317.433 4.208 20 0 DIADMN Fc1ccc(CNc2ccc3c(n2)CCCC3)c2ncccc12 ZINC001474256097 1061821678 /nfs/dbraw/zinc/82/16/78/1061821678.db2.gz GRVMMNWAMUJZGD-UHFFFAOYSA-N 0 1 307.372 4.260 20 0 DIADMN C[C@@H](NCc1ccn(C)c1)c1cc(Cl)cc(Cl)c1F ZINC001474259906 1061829002 /nfs/dbraw/zinc/82/90/02/1061829002.db2.gz LGUFMMYESIDJTD-SECBINFHSA-N 0 1 301.192 4.322 20 0 DIADMN c1cc2c(c(CNCc3ccc4c(c3)CCCC4)n1)CCCC2 ZINC001474266200 1061832779 /nfs/dbraw/zinc/83/27/79/1061832779.db2.gz OFLNURJFWYGTTA-UHFFFAOYSA-N 0 1 306.453 4.129 20 0 DIADMN Cc1nc2ccccn2c1CNCc1cc(Cl)ccc1Cl ZINC001474293350 1061861241 /nfs/dbraw/zinc/86/12/41/1061861241.db2.gz SCKVWBZZUFPDSD-UHFFFAOYSA-N 0 1 320.223 4.239 20 0 DIADMN CC(C)c1ncc(CNc2cc(C(C)(C)C)nc(C(C)C)n2)[nH]1 ZINC001458635981 1061861394 /nfs/dbraw/zinc/86/13/94/1061861394.db2.gz AGFIFIWJOSTFEA-UHFFFAOYSA-N 0 1 315.465 4.356 20 0 DIADMN Clc1ccc(Cl)c(CN[C@H]2COC[C@@H]2C2CC2)c1Cl ZINC001474294370 1061865036 /nfs/dbraw/zinc/86/50/36/1061865036.db2.gz GGDCBJDKUWZYQX-MFKMUULPSA-N 0 1 320.647 4.161 20 0 DIADMN FC(F)(F)c1nc(CNC[C@H]2C[C@H]2C2CCCC2)cs1 ZINC001474301255 1061870111 /nfs/dbraw/zinc/87/01/11/1061870111.db2.gz IJHZKKHROUOTAA-PWSUYJOCSA-N 0 1 304.381 4.078 20 0 DIADMN CCc1ccc(CSc2nc3ccc(Cl)cc3[nH]2)nc1 ZINC001458724264 1061885572 /nfs/dbraw/zinc/88/55/72/1061885572.db2.gz DFGXLIKHFWMWCE-UHFFFAOYSA-N 0 1 303.818 4.466 20 0 DIADMN CCO[C@H]1C[C@@H](N(C)Cc2nc3ccc(F)cc3s2)C1(C)C ZINC001474316471 1061886398 /nfs/dbraw/zinc/88/63/98/1061886398.db2.gz BSYADDHBHOOIHL-CABCVRRESA-N 0 1 322.449 4.071 20 0 DIADMN CCc1ccc(N2CCN(Cc3ccc4occc4c3)CC2)cc1 ZINC001474317458 1061890710 /nfs/dbraw/zinc/89/07/10/1061890710.db2.gz GPKARGOHSXKRBL-UHFFFAOYSA-N 0 1 320.436 4.317 20 0 DIADMN O=C(c1cccc(F)c1O)N1CCCCc2c(Cl)cccc21 ZINC001458757393 1061891892 /nfs/dbraw/zinc/89/18/92/1061891892.db2.gz BKVYWEOCIMGZIJ-UHFFFAOYSA-N 0 1 319.763 4.168 20 0 DIADMN CCC(CC)N(CCOC)Cc1cncc(Cl)c1Cl ZINC001474322816 1061901718 /nfs/dbraw/zinc/90/17/18/1061901718.db2.gz OZOHCNJFDBLEQI-UHFFFAOYSA-N 0 1 305.249 4.025 20 0 DIADMN CC[C@@H]1c2ccccc2CCN1Cc1ccnn1-c1ccccc1 ZINC001474322059 1061903265 /nfs/dbraw/zinc/90/32/65/1061903265.db2.gz WOVWAZJYEFZTOD-OAQYLSRUSA-N 0 1 317.436 4.382 20 0 DIADMN Cc1ccc(-c2n[nH]c(SCCN(C)c3ccccc3)n2)cc1 ZINC001458798072 1061906436 /nfs/dbraw/zinc/90/64/36/1061906436.db2.gz PGFBZJZMGIQFJX-UHFFFAOYSA-N 0 1 324.453 4.009 20 0 DIADMN Cc1ncoc1CN(Cc1ccccc1F)C1CCCCC1 ZINC001474323465 1061908743 /nfs/dbraw/zinc/90/87/43/1061908743.db2.gz PMAFTHFXMWDCQQ-UHFFFAOYSA-N 0 1 302.393 4.457 20 0 DIADMN CCC[C@@H](CN1CCSC[C@H]1c1ccc(Cl)cc1)OC ZINC001474323818 1061910001 /nfs/dbraw/zinc/91/00/01/1061910001.db2.gz ICJDQPPQTTVYKO-HOTGVXAUSA-N 0 1 313.894 4.245 20 0 DIADMN CCCCC[C@@H](O)CN(Cc1ccccc1)Cc1ccccn1 ZINC001253525971 1061910652 /nfs/dbraw/zinc/91/06/52/1061910652.db2.gz SJYVCIIXZLIYFH-HXUWFJFHSA-N 0 1 312.457 4.025 20 0 DIADMN CCc1ccc(-c2n[nH]c(SCc3ccncc3C)n2)cc1 ZINC001458821744 1061911170 /nfs/dbraw/zinc/91/11/70/1061911170.db2.gz ZKRCBFPYPQKEIF-UHFFFAOYSA-N 0 1 310.426 4.030 20 0 DIADMN Cc1ccc([C@@H]2C[C@H](C)CCN2Cc2cccc(F)c2N)o1 ZINC001474327824 1061913218 /nfs/dbraw/zinc/91/32/18/1061913218.db2.gz VWFSYFPJPVMETA-WBMJQRKESA-N 0 1 302.393 4.283 20 0 DIADMN CCCCC[C@@H](O)C[N@H+]1CCC[C@H]1c1ccc(Cl)s1 ZINC001253536647 1061914496 /nfs/dbraw/zinc/91/44/96/1061914496.db2.gz TVQIUHXQVCGDQN-OLZOCXBDSA-N 0 1 301.883 4.480 20 0 DIADMN CCCCC[C@H](O)C[N@H+]1CCc2cccc(C(F)(F)F)c2C1 ZINC001253539511 1061915660 /nfs/dbraw/zinc/91/56/60/1061915660.db2.gz XQOBQEMWESJJRS-AWEZNQCLSA-N 0 1 315.379 4.005 20 0 DIADMN CCCCC[C@H](O)CN1CCc2cccc(C(F)(F)F)c2C1 ZINC001253539511 1061915683 /nfs/dbraw/zinc/91/56/83/1061915683.db2.gz XQOBQEMWESJJRS-AWEZNQCLSA-N 0 1 315.379 4.005 20 0 DIADMN CC[C@H](C)[C@@H](CN(C)Cc1csc(Br)c1)OC ZINC001474327319 1061915979 /nfs/dbraw/zinc/91/59/79/1061915979.db2.gz HKRALVVEALKKGV-CMPLNLGQSA-N 0 1 320.296 4.004 20 0 DIADMN Oc1cccc(CN(Cc2nccc3c2CCCC3)CC2CC2)c1 ZINC001474333710 1061923097 /nfs/dbraw/zinc/92/30/97/1061923097.db2.gz RGZBKGHQWLQKGH-UHFFFAOYSA-N 0 1 322.452 4.078 20 0 DIADMN CCOc1ccc2c(c1)CN(Cc1cccc3c1NCCC3)CC2 ZINC001474334082 1061930897 /nfs/dbraw/zinc/93/08/97/1061930897.db2.gz WTXNILHKANQARS-UHFFFAOYSA-N 0 1 322.452 4.002 20 0 DIADMN CO[C@@H](CSc1nc(C=Cc2ccccc2)n[nH]1)CC(C)C ZINC001458904086 1061936256 /nfs/dbraw/zinc/93/62/56/1061936256.db2.gz OQLXVYSAKPEOHN-BOLDSZDNSA-N 0 1 317.458 4.128 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4.097 20 0 DIADMN COCCOc1cc(C)ccc1CN[C@H](C)c1csc(C)c1 ZINC000297704374 334243477 /nfs/dbraw/zinc/24/34/77/334243477.db2.gz MMSBILYIOYXSKC-OAHLLOKOSA-N 0 1 319.470 4.241 20 0 DIADMN CCN(C)[C@@H](C(=O)N(CC)Cc1ccccc1C)c1ccccc1 ZINC000520998694 334251506 /nfs/dbraw/zinc/25/15/06/334251506.db2.gz BCGPOIVOMMSWKU-HXUWFJFHSA-N 0 1 324.468 4.037 20 0 DIADMN CC(C)c1nc(C2CCN([C@@H](C)c3cccc(F)c3)CC2)no1 ZINC000299641185 334256656 /nfs/dbraw/zinc/25/66/56/334256656.db2.gz KHDIESSMVMNPGQ-ZDUSSCGKSA-N 0 1 317.408 4.273 20 0 DIADMN CC1(C)C[C@@H](NCc2sccc2Cl)c2cc(N)ccc2O1 ZINC000415035724 334260439 /nfs/dbraw/zinc/26/04/39/334260439.db2.gz MKWFBBLXHKXICS-CYBMUJFWSA-N 0 1 322.861 4.376 20 0 DIADMN COc1ccc(F)cc1CN[C@@H]1CCCOc2ccc(C)cc21 ZINC000187593291 334267122 /nfs/dbraw/zinc/26/71/22/334267122.db2.gz JXCSFCCUYLMYGS-QGZVFWFLSA-N 0 1 315.388 4.146 20 0 DIADMN CCCOc1ccc(CN[C@H]2c3ccc(F)cc3O[C@@H]2C)cc1 ZINC000582144814 334270756 /nfs/dbraw/zinc/27/07/56/334270756.db2.gz CJUITPKXVSHANM-BFUOFWGJSA-N 0 1 315.388 4.226 20 0 DIADMN CCCn1ccc(CN[C@H](COC)c2cccc(Cl)c2)c1 ZINC000582145026 334270809 /nfs/dbraw/zinc/27/08/09/334270809.db2.gz MGFKTAGBBQNKRY-QGZVFWFLSA-N 0 1 306.837 4.029 20 0 DIADMN Cc1nc(-c2cccc(C)c2)[nH]c1C(=O)Nc1ccccc1F ZINC000534495332 334277429 /nfs/dbraw/zinc/27/74/29/334277429.db2.gz SULXXGUHQHUHOV-UHFFFAOYSA-N 0 1 309.344 4.085 20 0 DIADMN CO[C@H](CN1CC=C(C(F)(F)F)CC1)c1ccc(Cl)cc1 ZINC000514095134 334278135 /nfs/dbraw/zinc/27/81/35/334278135.db2.gz NKDYZGYYXUHCMG-CQSZACIVSA-N 0 1 319.754 4.222 20 0 DIADMN CC[C@@H](C)[C@H]1CCCCN1CC(=O)Nc1c(C)cccc1Cl ZINC000534546626 334282786 /nfs/dbraw/zinc/28/27/86/334282786.db2.gz UOKQEDMLAGSZFY-CZUORRHYSA-N 0 1 322.880 4.488 20 0 DIADMN CC[C@@H](CN[C@H](c1ncc[nH]1)c1ccc(F)cc1)c1ccccc1 ZINC000187858322 334287961 /nfs/dbraw/zinc/28/79/61/334287961.db2.gz ACBSLSPJLUAJNO-KXBFYZLASA-N 0 1 323.415 4.422 20 0 DIADMN COc1ccc(CN[C@@H](C)c2oc3ccccc3c2C)cc1O ZINC000048747250 334298066 /nfs/dbraw/zinc/29/80/66/334298066.db2.gz QJQCEIPVTFMVNR-ZDUSSCGKSA-N 0 1 311.381 4.306 20 0 DIADMN Cc1c2ccccc2oc1[C@H](C)NCc1cccc2c1OCO2 ZINC000048747353 334298101 /nfs/dbraw/zinc/29/81/01/334298101.db2.gz GXQHRXRUPXXWFM-ZDUSSCGKSA-N 0 1 309.365 4.321 20 0 DIADMN CCOc1cccc(CN[C@H](c2ccc(F)c(C)c2)C2CC2)n1 ZINC000534611922 334299293 /nfs/dbraw/zinc/29/92/93/334299293.db2.gz LVOMTRPOAYVIHU-IBGZPJMESA-N 0 1 314.404 4.169 20 0 DIADMN CCN(CC)[C@@H](C(=O)Nc1ccc2c(c1)CCC2)c1ccccc1 ZINC000111034305 334300153 /nfs/dbraw/zinc/30/01/53/334300153.db2.gz JMDMNJGDPIGXAY-HXUWFJFHSA-N 0 1 322.452 4.197 20 0 DIADMN CCN(CC)[C@@H](C(=O)NCCC1=CCCCC1)c1ccccc1 ZINC000111034015 334300171 /nfs/dbraw/zinc/30/01/71/334300171.db2.gz DIXREYXZLGPRRI-LJQANCHMSA-N 0 1 314.473 4.076 20 0 DIADMN CCN(CC)[C@@H](C(=O)Nc1cccc(C)c1C)c1ccccc1 ZINC000111033780 334300196 /nfs/dbraw/zinc/30/01/96/334300196.db2.gz DRHZIIMUQZAXTM-LJQANCHMSA-N 0 1 310.441 4.325 20 0 DIADMN CC[C@@H](C)CN(C)Cc1csc(-c2ccccc2OC)n1 ZINC000111253323 334313917 /nfs/dbraw/zinc/31/39/17/334313917.db2.gz PDHRKZUVAFZUMK-CYBMUJFWSA-N 0 1 304.459 4.297 20 0 DIADMN CC[C@@H](NCc1c(C)nn(CC)c1C)c1ccc(Cl)s1 ZINC000531965414 334326827 /nfs/dbraw/zinc/32/68/27/334326827.db2.gz MAXRIGBTOUQBFH-CYBMUJFWSA-N 0 1 311.882 4.476 20 0 DIADMN Cc1ccc(C)c(OCCC(=O)Nc2cccc(Cl)c2O)c1 ZINC000534698832 334328149 /nfs/dbraw/zinc/32/81/49/334328149.db2.gz ANKZVNKWAGAYCQ-UHFFFAOYSA-N 0 1 319.788 4.070 20 0 DIADMN O=C(Nc1cccc(Cl)c1O)[C@@H]1CCCC[C@H]1C(F)(F)F ZINC000534699722 334328229 /nfs/dbraw/zinc/32/82/29/334328229.db2.gz HJANQTFPEYQILC-RKDXNWHRSA-N 0 1 321.726 4.353 20 0 DIADMN O=C(Nc1cccc(Cl)c1O)[C@H]1CCCC[C@@H]1C(F)(F)F ZINC000534699721 334328405 /nfs/dbraw/zinc/32/84/05/334328405.db2.gz HJANQTFPEYQILC-IUCAKERBSA-N 0 1 321.726 4.353 20 0 DIADMN C[C@@H]1C[C@@H]2CCCC[C@H]2N1CC(=O)Nc1ccc(F)cc1Cl ZINC000303723534 334329533 /nfs/dbraw/zinc/32/95/33/334329533.db2.gz SFJNMWSCHBVQLI-BFQNTYOBSA-N 0 1 324.827 4.071 20 0 DIADMN C[C@@H]1C[C@@H]2CCCC[C@H]2N1CC(=O)Nc1cc(Cl)ccc1F ZINC000303726884 334329602 /nfs/dbraw/zinc/32/96/02/334329602.db2.gz TYCXUESACUDJFI-BFQNTYOBSA-N 0 1 324.827 4.071 20 0 DIADMN C[C@H]1SCCN(Cc2cc(-c3ccc(Cl)cc3)no2)[C@H]1C ZINC000303743384 334329904 /nfs/dbraw/zinc/32/99/04/334329904.db2.gz ZUJHFVOCPMMSFO-NWDGAFQWSA-N 0 1 322.861 4.321 20 0 DIADMN CC(=O)c1c(C)cc(C)c(CN2CCS[C@@H](C)[C@H]2C)c1C ZINC000303733854 334329962 /nfs/dbraw/zinc/32/99/62/334329962.db2.gz WDIQCCUKFLZUKS-ZBFHGGJFSA-N 0 1 305.487 4.140 20 0 DIADMN Cc1n[nH]c(C(C)C)c1C(=O)Nc1ccc2nc(C3CC3)oc2c1 ZINC000152280064 334334374 /nfs/dbraw/zinc/33/43/74/334334374.db2.gz VLLPZCPFQYWEQG-UHFFFAOYSA-N 0 1 324.384 4.112 20 0 DIADMN Cc1cc([C@H](C)NCC(=O)Nc2ccc(Cl)cc2)c(C)s1 ZINC000049507419 334342816 /nfs/dbraw/zinc/34/28/16/334342816.db2.gz XTYHKDNEDMGXEJ-NSHDSACASA-N 0 1 322.861 4.308 20 0 DIADMN Cc1ccc(NC(=O)[C@@H](C)N2CCC3(C2)CCCCC3)c(F)c1 ZINC000303911765 334345170 /nfs/dbraw/zinc/34/51/70/334345170.db2.gz MWMQMBUAFURXPI-OAHLLOKOSA-N 0 1 318.436 4.117 20 0 DIADMN CCC[C@H](NCc1cc(OC)ccc1OC)c1ccsc1 ZINC000443086290 338443760 /nfs/dbraw/zinc/44/37/60/338443760.db2.gz GDMYRASGYBGNAV-INIZCTEOSA-N 0 1 305.443 4.396 20 0 DIADMN Oc1ccc(-c2nc(-c3ccccc3Cl)no2)cc1Cl ZINC000111688136 334353553 /nfs/dbraw/zinc/35/35/53/334353553.db2.gz ARTXKOSIWNVCQD-UHFFFAOYSA-N 0 1 307.136 4.416 20 0 DIADMN Oc1ccc(-c2nc(Cc3cccc(Cl)c3)no2)cc1Cl ZINC000111687611 334353577 /nfs/dbraw/zinc/35/35/77/334353577.db2.gz OBDKVUXXQNEVOL-UHFFFAOYSA-N 0 1 321.163 4.340 20 0 DIADMN Oc1cc(Cl)ccc1-c1nc(Cc2ccc(Cl)cc2)no1 ZINC000111686831 334353703 /nfs/dbraw/zinc/35/37/03/334353703.db2.gz GDLMFRONMOLQQC-UHFFFAOYSA-N 0 1 321.163 4.340 20 0 DIADMN Oc1ccc(-c2nc(Cc3ccccc3Cl)no2)cc1Cl ZINC000111688925 334353752 /nfs/dbraw/zinc/35/37/52/334353752.db2.gz XMDGCWLYWBJDKN-UHFFFAOYSA-N 0 1 321.163 4.340 20 0 DIADMN Cc1ccc(F)cc1-c1noc(-c2cc(Cl)ccc2O)n1 ZINC000111688633 334353884 /nfs/dbraw/zinc/35/38/84/334353884.db2.gz PNQCQUVSZVRWMK-UHFFFAOYSA-N 0 1 304.708 4.210 20 0 DIADMN CN(CCCC(=O)c1ccccc1)Cc1ccccc1Cl ZINC000049824746 334358680 /nfs/dbraw/zinc/35/86/80/334358680.db2.gz WFJRYDULGGDOIW-UHFFFAOYSA-N 0 1 301.817 4.435 20 0 DIADMN CC(=O)c1ccccc1OCCN(C)[C@H](C)c1cccs1 ZINC000049932643 334361018 /nfs/dbraw/zinc/36/10/18/334361018.db2.gz HGODHKCZMRPPES-CYBMUJFWSA-N 0 1 303.427 4.023 20 0 DIADMN CC(=O)c1ccccc1OCCN(C)[C@@H](C)c1cccs1 ZINC000049932642 334361128 /nfs/dbraw/zinc/36/11/28/334361128.db2.gz HGODHKCZMRPPES-ZDUSSCGKSA-N 0 1 303.427 4.023 20 0 DIADMN c1ccc([C@H]2CCCN2Cc2ccccc2OCC2CC2)nc1 ZINC000535067176 334363270 /nfs/dbraw/zinc/36/32/70/334363270.db2.gz JXZUWBMMZFHHDH-LJQANCHMSA-N 0 1 308.425 4.208 20 0 DIADMN Cc1ccccc1[C@H](CO)N[C@@H]1C[C@H](C)Sc2sccc21 ZINC000531993948 334367187 /nfs/dbraw/zinc/36/71/87/334367187.db2.gz SRFPQIBKKNKYCK-MAZHCROVSA-N 0 1 319.495 4.305 20 0 DIADMN CC[C@@H](N[C@H](CO)c1ccccc1C)c1ccc(F)cc1F ZINC000531994877 334369364 /nfs/dbraw/zinc/36/93/64/334369364.db2.gz KVILNXDQBKDAIK-QZTJIDSGSA-N 0 1 305.368 4.048 20 0 DIADMN Cc1ccccc1[C@H](CO)N[C@@H](C)c1ccccc1C(F)(F)F ZINC000531994580 334369430 /nfs/dbraw/zinc/36/94/30/334369430.db2.gz AWNMOLFKFBATFY-GUYCJALGSA-N 0 1 323.358 4.398 20 0 DIADMN Cc1nccnc1[C@@H](C)NCc1ccc(Oc2ccccc2)cc1 ZINC000187915782 334370691 /nfs/dbraw/zinc/37/06/91/334370691.db2.gz RVPLFNPXZNKJSH-MRXNPFEDSA-N 0 1 319.408 4.428 20 0 DIADMN Cc1cccn2cc(CNCc3ccc(CC(C)C)cc3)nc12 ZINC000532040967 334382028 /nfs/dbraw/zinc/38/20/28/334382028.db2.gz MYRWOGLVWSGKGQ-UHFFFAOYSA-N 0 1 307.441 4.131 20 0 DIADMN O=S(=O)(Nc1ccsc1)c1ccc(Cl)c2ccccc21 ZINC000532037329 334382996 /nfs/dbraw/zinc/38/29/96/334382996.db2.gz LEAQNIRAIUQCFR-UHFFFAOYSA-N 0 1 323.826 4.356 20 0 DIADMN Cc1nc(CN(C[C@H]2CCCO2)C2CCC(C)CC2)cs1 ZINC000340842814 334385748 /nfs/dbraw/zinc/38/57/48/334385748.db2.gz JJQWXTPIUNIYPZ-QWFMPGPPSA-N 0 1 308.491 4.011 20 0 DIADMN Cc1cnc(CN[C@H](c2ccc(Cl)cc2)C2CCC2)n1C ZINC000341004820 334399046 /nfs/dbraw/zinc/39/90/46/334399046.db2.gz CGKCZEZXNOXTFE-KRWDZBQOSA-N 0 1 303.837 4.013 20 0 DIADMN Cc1cnc(CN[C@H](CC(C)C)c2ccc(Cl)cc2)n1C ZINC000341005380 334399252 /nfs/dbraw/zinc/39/92/52/334399252.db2.gz FATHTDIBRBOOKY-MRXNPFEDSA-N 0 1 305.853 4.259 20 0 DIADMN CC1(C)CCN(Cc2nnc(-c3cccc(Cl)c3)o2)CC1 ZINC000341171895 334415421 /nfs/dbraw/zinc/41/54/21/334415421.db2.gz COWGJFHVWARSJG-UHFFFAOYSA-N 0 1 305.809 4.012 20 0 DIADMN Cc1ccc([C@H](C)c2noc([C@@H](C)N3CCCCCC3)n2)cc1 ZINC000443202794 338447084 /nfs/dbraw/zinc/44/70/84/338447084.db2.gz KOGLOSHCEAHZLZ-JKSUJKDBSA-N 0 1 313.445 4.467 20 0 DIADMN CCCCOC1CCN(Cc2cc(Cl)cc3c2OCC3)CC1 ZINC000341190942 334422185 /nfs/dbraw/zinc/42/21/85/334422185.db2.gz RFZQAFXBYSJQNW-UHFFFAOYSA-N 0 1 323.864 4.056 20 0 DIADMN CSc1ccc([C@@H](C)NCc2ccc(-c3cc[nH]n3)o2)cc1 ZINC000341468550 334451288 /nfs/dbraw/zinc/45/12/88/334451288.db2.gz RUODJUSMZORVQK-GFCCVEGCSA-N 0 1 313.426 4.242 20 0 DIADMN c1cc2c(s1)CCC[C@@H]2NCc1cnc([C@H]2CCCO2)s1 ZINC000341556701 334457861 /nfs/dbraw/zinc/45/78/61/334457861.db2.gz TUWYTXWUGYFUOD-UONOGXRCSA-N 0 1 320.483 4.223 20 0 DIADMN CC[C@@H](NCc1cnccc1C)c1ccccc1OC(F)F ZINC000341653791 334469187 /nfs/dbraw/zinc/46/91/87/334469187.db2.gz DWAKZBYSXNUYCI-OAHLLOKOSA-N 0 1 306.356 4.232 20 0 DIADMN CCCC(CCC)[S@](=O)C=C(O)c1cc(C)n(CC)c1C ZINC000341741844 334475859 /nfs/dbraw/zinc/47/58/59/334475859.db2.gz DHHLPFCCGZQCRX-OAQYLSRUSA-N 0 1 311.491 4.025 20 0 DIADMN COCC[C@@H](N[C@H](C)c1c(F)cccc1OC)c1ccccc1 ZINC000341995071 334498965 /nfs/dbraw/zinc/49/89/65/334498965.db2.gz GHTNCNVGOHGTTA-RHSMWYFYSA-N 0 1 317.404 4.263 20 0 DIADMN CC[C@H](NCc1cnccc1C)c1ccccc1Br ZINC000342221640 334522319 /nfs/dbraw/zinc/52/23/19/334522319.db2.gz JPDRIAURAKAEJD-INIZCTEOSA-N 0 1 319.246 4.393 20 0 DIADMN CCCc1csc(CNC[C@@H]2CC[C@H](c3ccccc3)O2)n1 ZINC000342436606 334540935 /nfs/dbraw/zinc/54/09/35/334540935.db2.gz YVMUYGLBHTUIDR-DLBZAZTESA-N 0 1 316.470 4.106 20 0 DIADMN CC[C@@H](N[C@@H](C)c1cnc(OC)c(Cl)c1)c1c(C)noc1C ZINC000342730603 334569601 /nfs/dbraw/zinc/56/96/01/334569601.db2.gz JWUSTZMZTCMUMB-LKFCYVNXSA-N 0 1 323.824 4.150 20 0 DIADMN COCc1cc(CN[C@@H](C)c2ccccc2Cl)ccc1F ZINC000112545775 334715581 /nfs/dbraw/zinc/71/55/81/334715581.db2.gz KPCRNOMQYGWBQN-LBPRGKRZSA-N 0 1 307.796 4.476 20 0 DIADMN CCOc1ncccc1CN[C@@H](C)c1ccc(C(F)(F)F)cc1 ZINC000112522205 334717191 /nfs/dbraw/zinc/71/71/91/334717191.db2.gz BKBYGYQTTONJLW-LBPRGKRZSA-N 0 1 324.346 4.350 20 0 DIADMN CCCC(=O)Nc1cccc(CN[C@@H](C)c2ccc(F)cc2)c1 ZINC000112529256 334717249 /nfs/dbraw/zinc/71/72/49/334717249.db2.gz TZFLDDDWAXKKBH-AWEZNQCLSA-N 0 1 314.404 4.415 20 0 DIADMN CCC(=O)c1ccc(O)c(NC(=O)c2cc(C)ccc2C2CC2)c1 ZINC000424840036 334743411 /nfs/dbraw/zinc/74/34/11/334743411.db2.gz XNPVQTOVTXIYLM-UHFFFAOYSA-N 0 1 323.392 4.423 20 0 DIADMN CC(C)(C)n1cc(CN2CCC(c3ccsc3)CC2)cn1 ZINC000188693618 334785548 /nfs/dbraw/zinc/78/55/48/334785548.db2.gz PFPAGKWXZSDEHE-UHFFFAOYSA-N 0 1 303.475 4.079 20 0 DIADMN Cc1ccc([C@H](C)NCc2cnc(C(F)(F)F)s2)cc1 ZINC000443982488 338465222 /nfs/dbraw/zinc/46/52/22/338465222.db2.gz GKMFVUBEGQBRNW-JTQLQIEISA-N 0 1 300.349 4.321 20 0 DIADMN Cc1cc([C@@H](C)NCc2cnc(C(F)(F)F)s2)ccc1F ZINC000443988466 338465656 /nfs/dbraw/zinc/46/56/56/338465656.db2.gz ZWBHYGIXFAXDCZ-SECBINFHSA-N 0 1 318.339 4.460 20 0 DIADMN COc1cnccc1[C@H](C)N[C@@H](C)c1cccc(OC(F)F)c1 ZINC000188767803 334871862 /nfs/dbraw/zinc/87/18/62/334871862.db2.gz UEVZIAHUVINZRQ-RYUDHWBXSA-N 0 1 322.355 4.103 20 0 DIADMN FC(F)(F)c1cccc(CN2CCC([C@@H]3CCCO3)CC2)c1 ZINC000189231615 334886813 /nfs/dbraw/zinc/88/68/13/334886813.db2.gz JPXCVCGIIYTUKT-INIZCTEOSA-N 0 1 313.363 4.096 20 0 DIADMN OCCC[C@@H](NCc1ccc(Cl)cc1F)c1ccccc1 ZINC000189165597 334887624 /nfs/dbraw/zinc/88/76/24/334887624.db2.gz ADGYIGYPJBMQIQ-QGZVFWFLSA-N 0 1 307.796 4.083 20 0 DIADMN Cc1cncc(CNCc2cc(Cl)cc(C(F)(F)F)c2)c1 ZINC000189367888 334893144 /nfs/dbraw/zinc/89/31/44/334893144.db2.gz UFVPNDGLOVUICL-UHFFFAOYSA-N 0 1 314.738 4.352 20 0 DIADMN CC[C@H](NCc1ccc2nc(C)ccc2c1)c1c(C)noc1C ZINC000189409064 334893836 /nfs/dbraw/zinc/89/38/36/334893836.db2.gz LMLGBTWNMQUBQW-KRWDZBQOSA-N 0 1 309.413 4.389 20 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C[C@H](NCc1csc(C2CC2)n1)[C@H]1Oc2ccccc2[C@@H]1C ZINC000344691099 335267180 /nfs/dbraw/zinc/26/71/80/335267180.db2.gz HZGUVWDBKJJDNF-PRXAMGSTSA-N 0 1 314.454 4.063 20 0 DIADMN Cc1ccc(CNCc2cnc(C)nc2)c(Oc2ccccc2)c1 ZINC000344908792 335284922 /nfs/dbraw/zinc/28/49/22/335284922.db2.gz SDBMSCMTCIMOFM-UHFFFAOYSA-N 0 1 319.408 4.176 20 0 DIADMN c1nc(C2CCCC2)sc1CNCc1ccc2c(c1)COC2 ZINC000344993520 335290006 /nfs/dbraw/zinc/29/00/06/335290006.db2.gz KBZBBDRIDLCCDM-UHFFFAOYSA-N 0 1 314.454 4.121 20 0 DIADMN Cc1cnc(CN(Cc2ccccc2)[C@H]2CCCC2(C)C)nc1 ZINC000535556844 335293058 /nfs/dbraw/zinc/29/30/58/335293058.db2.gz RMOUHSYYVOPMEP-SFHVURJKSA-N 0 1 309.457 4.366 20 0 DIADMN Cc1c([C@@H](C)NCc2cnc3ccccc3c2)cnn1C(C)C ZINC000345291299 335314321 /nfs/dbraw/zinc/31/43/21/335314321.db2.gz LIPIJRFDOYZONR-CQSZACIVSA-N 0 1 308.429 4.171 20 0 DIADMN CCc1cnccc1[C@H](C)N[C@@H](C)c1cnn(C(C)(C)C)c1C ZINC000345274269 335318082 /nfs/dbraw/zinc/31/80/82/335318082.db2.gz PLUFXGFVVYANRJ-KBPBESRZSA-N 0 1 314.477 4.316 20 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336326486 /nfs/dbraw/zinc/32/64/86/336326486.db2.gz BJMNLKCMSGMEGO-FZKQIMNGSA-N 0 1 302.393 4.117 20 0 DIADMN Cc1cc(N[C@@H]2[C@H]3CCO[C@@H]3C23CCC3)c2cc(F)ccc2n1 ZINC000301804997 336331261 /nfs/dbraw/zinc/33/12/61/336331261.db2.gz DTGKNKBGCYQCTL-XWIAVFTESA-N 0 1 312.388 4.052 20 0 DIADMN Cc1cc(N[C@H]2CCc3c2cccc3O)c2cc(F)ccc2n1 ZINC000302001783 336342526 /nfs/dbraw/zinc/34/25/26/336342526.db2.gz SCDLYWPATXWAGN-INIZCTEOSA-N 0 1 308.356 4.487 20 0 DIADMN CC(=O)c1ccc(CNc2cc(C)nc3ccc(F)cc32)nc1C ZINC000302076224 336347133 /nfs/dbraw/zinc/34/71/33/336347133.db2.gz YDETWMXSVGMYDQ-UHFFFAOYSA-N 0 1 323.371 4.200 20 0 DIADMN C[C@](O)(CCNc1ccnc2cc(F)ccc21)c1ccccc1 ZINC000302377885 336357857 /nfs/dbraw/zinc/35/78/57/336357857.db2.gz GFMLTYIFNRKEIR-IBGZPJMESA-N 0 1 310.372 4.084 20 0 DIADMN C[C@@H](C[N@@H+](C)Cc1cnc(-c2ccccc2)[nH]1)c1ccccc1 ZINC000514106337 336361125 /nfs/dbraw/zinc/36/11/25/336361125.db2.gz XQNNSZYCBFHBRY-INIZCTEOSA-N 0 1 305.425 4.312 20 0 DIADMN C[C@@H](C[N@H+](C)Cc1c[nH]c(-c2ccccc2)n1)c1ccccc1 ZINC000514106337 336361126 /nfs/dbraw/zinc/36/11/26/336361126.db2.gz XQNNSZYCBFHBRY-INIZCTEOSA-N 0 1 305.425 4.312 20 0 DIADMN C[C@@H]1CN(C[C@H]2CCCC(F)(F)C2)C[C@H](c2ccsc2)O1 ZINC000514110714 336362008 /nfs/dbraw/zinc/36/20/08/336362008.db2.gz HVZJGPKSPAXKSH-VNHYZAJKSA-N 0 1 315.429 4.335 20 0 DIADMN C[C@@H]1CN(C[C@@H]2CCCC(F)(F)C2)C[C@@H](c2ccsc2)O1 ZINC000514110712 336362049 /nfs/dbraw/zinc/36/20/49/336362049.db2.gz HVZJGPKSPAXKSH-NFAWXSAZSA-N 0 1 315.429 4.335 20 0 DIADMN Fc1ccc2c(c1)nccc2NCc1ccccc1-n1ccnc1 ZINC000302662164 336363899 /nfs/dbraw/zinc/36/38/99/336363899.db2.gz LYYKQCSPPPIGRU-UHFFFAOYSA-N 0 1 318.355 4.172 20 0 DIADMN CC[C@H](C)CN(C)[C@@H](C)c1nnc(-c2ccccc2F)s1 ZINC000514114475 336368211 /nfs/dbraw/zinc/36/82/11/336368211.db2.gz HAVDQKFBDLJUJB-RYUDHWBXSA-N 0 1 307.438 4.383 20 0 DIADMN Cc1ncsc1CN[C@@H](C)c1ccc(Br)s1 ZINC000070836907 336370023 /nfs/dbraw/zinc/37/00/23/336370023.db2.gz LNPCBKNHZCGSHY-ZETCQYMHSA-N 0 1 317.277 4.126 20 0 DIADMN COCC[C@H](N[C@@H]1CCCc2cc(F)ccc21)c1ccc(C)o1 ZINC000352965721 336379867 /nfs/dbraw/zinc/37/98/67/336379867.db2.gz JKOXVXCSBGYPCH-MSOLQXFVSA-N 0 1 317.404 4.472 20 0 DIADMN Fc1cccc2c1CC[C@@H]2N[C@H]1CCCOc2c(F)cccc21 ZINC000352969199 336379980 /nfs/dbraw/zinc/37/99/80/336379980.db2.gz QNCBTFUNIKDXAB-ROUUACIJSA-N 0 1 315.363 4.456 20 0 DIADMN Cc1ccccc1[C@H]1CCC[N@H+]1CCc1ccccc1C(=O)[O-] ZINC000514608541 336385988 /nfs/dbraw/zinc/38/59/88/336385988.db2.gz VQLUMIJYPHCDII-LJQANCHMSA-N 0 1 309.409 4.073 20 0 DIADMN CC[C@H](C)c1nc([C@H](C)NCc2ccc(C)cc2Cl)n[nH]1 ZINC000514609239 336386201 /nfs/dbraw/zinc/38/62/01/336386201.db2.gz OKOZXQXXKHYIBY-RYUDHWBXSA-N 0 1 306.841 4.131 20 0 DIADMN Cc1ncncc1[C@@H](C)N[C@@H]1CCCOc2cc(Cl)ccc21 ZINC000514615429 336386330 /nfs/dbraw/zinc/38/63/30/336386330.db2.gz YITOGQFDYMBEIL-MLGOLLRUSA-N 0 1 317.820 4.003 20 0 DIADMN C[C@H](C(=O)Nc1ccccc1Oc1ccccc1)N1CC[C@@H](C)C1 ZINC000261391321 336387198 /nfs/dbraw/zinc/38/71/98/336387198.db2.gz OEHWWWMNNXHDDL-HZPDHXFCSA-N 0 1 324.424 4.148 20 0 DIADMN COC(=O)c1csc([C@@H](C)NCc2ccc(SC)cc2)c1 ZINC000563984732 336389241 /nfs/dbraw/zinc/38/92/41/336389241.db2.gz VXXNWNOHKPBPPO-LLVKDONJSA-N 0 1 321.467 4.107 20 0 DIADMN FC(F)(F)C1(CNCc2ncc(-c3ccccc3)s2)CC1 ZINC000353055653 336391845 /nfs/dbraw/zinc/39/18/45/336391845.db2.gz SSUKAVHIFISYLX-UHFFFAOYSA-N 0 1 312.360 4.242 20 0 DIADMN Cc1ccc([C@@H](C)N(C)C(=O)c2ccc(O)c(Cl)c2)cc1 ZINC000193103282 336398788 /nfs/dbraw/zinc/39/87/88/336398788.db2.gz AGCSLUDUQFFFDU-GFCCVEGCSA-N 0 1 303.789 4.187 20 0 DIADMN C[C@H](NCc1cc(C(C)(C)C)on1)[C@@H]1Oc2ccccc2[C@@H]1C ZINC000564006676 336399624 /nfs/dbraw/zinc/39/96/24/336399624.db2.gz PLDTYEORKMOSCZ-ZJNRKIDTSA-N 0 1 314.429 4.015 20 0 DIADMN c1ccc2c(c1)COC[C@@H]2NCc1cccc(OC2CCCC2)c1 ZINC000418096253 336399910 /nfs/dbraw/zinc/39/99/10/336399910.db2.gz IBENLJOEPDRYHL-NRFANRHFSA-N 0 1 323.436 4.369 20 0 DIADMN CCn1cc(CNCc2ccc(F)c(-c3cccs3)c2)cn1 ZINC000353081853 336399966 /nfs/dbraw/zinc/39/99/66/336399966.db2.gz FSXJYJHHMFGHOS-UHFFFAOYSA-N 0 1 315.417 4.060 20 0 DIADMN Cc1ccc2[nH]c(CN[C@H]3COCc4ccccc43)cc2c1C ZINC000418103274 336401303 /nfs/dbraw/zinc/40/13/03/336401303.db2.gz INNIKOLIXIFNFK-FQEVSTJZSA-N 0 1 306.409 4.146 20 0 DIADMN COc1ccc(CNC(C)(C)c2ccc(C)nc2)c(Cl)c1 ZINC000353127892 336403929 /nfs/dbraw/zinc/40/39/29/336403929.db2.gz KFLIYDHRNOZERH-UHFFFAOYSA-N 0 1 304.821 4.077 20 0 DIADMN Cc1cccc2c1OCC[C@H]2NCc1cc2cc(F)ccc2o1 ZINC000353202579 336406298 /nfs/dbraw/zinc/40/62/98/336406298.db2.gz BWJOGNPWJHBHJJ-QGZVFWFLSA-N 0 1 311.356 4.494 20 0 DIADMN C[C@@H](N[C@H](CC(C)(C)C)c1ccc(F)cc1)c1ccc(=O)[nH]n1 ZINC000353403937 336415786 /nfs/dbraw/zinc/41/57/86/336415786.db2.gz NRKZIXBARROEHX-MLGOLLRUSA-N 0 1 317.408 4.149 20 0 DIADMN CC(C)Sc1ccc([C@H](C)N[C@@H](C)c2ccc(=O)[nH]n2)cc1 ZINC000353502129 336420899 /nfs/dbraw/zinc/42/08/99/336420899.db2.gz KRWGMWHHRBXLBQ-STQMWFEESA-N 0 1 317.458 4.095 20 0 DIADMN CC(C)Sc1ccc([C@@H](C)N[C@@H](C)c2ccc(=O)[nH]n2)cc1 ZINC000353502126 336420968 /nfs/dbraw/zinc/42/09/68/336420968.db2.gz KRWGMWHHRBXLBQ-OLZOCXBDSA-N 0 1 317.458 4.095 20 0 DIADMN Cc1ncc([C@@H](C)N[C@H]2CCc3sc(Cl)cc32)c(C)n1 ZINC000353569545 336425719 /nfs/dbraw/zinc/42/57/19/336425719.db2.gz RGENFKIGYBGJSN-RNCFNFMXSA-N 0 1 307.850 4.146 20 0 DIADMN Cc1nccc(N2C[C@@H](C)O[C@H](c3ccsc3)C2)c1Cl ZINC000354161346 336461950 /nfs/dbraw/zinc/46/19/50/336461950.db2.gz FTGGNPYJZRYSIS-YGRLFVJLSA-N 0 1 308.834 4.071 20 0 DIADMN C[C@H](N[C@@H]1CCCc2nn(C)cc21)c1ccc(-c2ccccc2)o1 ZINC000367177864 336477414 /nfs/dbraw/zinc/47/74/14/336477414.db2.gz DTEJTNGZMMYBPK-WMLDXEAASA-N 0 1 321.424 4.408 20 0 DIADMN C[C@@H](N[C@@H]1CCCc2nn(C)cc21)c1ccc(-c2ccccc2)o1 ZINC000367177863 336477421 /nfs/dbraw/zinc/47/74/21/336477421.db2.gz DTEJTNGZMMYBPK-RHSMWYFYSA-N 0 1 321.424 4.408 20 0 DIADMN C[C@@H](NCc1cscc1C(F)(F)F)c1cccc(O)c1 ZINC000356182271 336539687 /nfs/dbraw/zinc/53/96/87/336539687.db2.gz 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/nfs/dbraw/zinc/61/44/10/336614410.db2.gz WXRKNRCCTNYVTR-KMUNFCNLSA-N 0 1 323.458 4.136 20 0 DIADMN CC[C@H](N[C@H](COC)c1ccc(F)cc1)c1ccccc1OC ZINC000358197993 336616540 /nfs/dbraw/zinc/61/65/40/336616540.db2.gz YKBOQZYHHAWFCN-ZWKOTPCHSA-N 0 1 317.404 4.263 20 0 DIADMN CCC[C@H](N[C@H](C)c1ccc([S@@](C)=O)cc1)c1ccccn1 ZINC000358235827 336618527 /nfs/dbraw/zinc/61/85/27/336618527.db2.gz YZNDIXZUCDIVLM-JVJLVOBOSA-N 0 1 316.470 4.011 20 0 DIADMN C[C@H](N[C@H]1CC(C)(C)Oc2cc(F)ccc21)c1cncs1 ZINC000358287009 336621336 /nfs/dbraw/zinc/62/13/36/336621336.db2.gz HZNIHBHQMAGVME-GWCFXTLKSA-N 0 1 306.406 4.235 20 0 DIADMN COc1cc(F)cc(CN[C@@H]2CC(C)(C)Cc3occc32)c1 ZINC000358295372 336622216 /nfs/dbraw/zinc/62/22/16/336622216.db2.gz DQOZYIKYGWUHTG-MRXNPFEDSA-N 0 1 303.377 4.231 20 0 DIADMN CC[C@H](N[C@@H]1CCCc2ccc(OC)cc21)c1c(C)noc1C ZINC000358346646 336625277 /nfs/dbraw/zinc/62/52/77/336625277.db2.gz AHSQHUOTFBMACB-ZWKOTPCHSA-N 0 1 314.429 4.418 20 0 DIADMN Cc1ccc([C@@H](Cn2ccnc2)N[C@H](C)c2ccco2)c(C)c1 ZINC000358351910 336625562 /nfs/dbraw/zinc/62/55/62/336625562.db2.gz MJJURUWVFKNECO-SJLPKXTDSA-N 0 1 309.413 4.185 20 0 DIADMN CCc1cnccc1[C@H](C)NCc1cnc(-c2ccncc2)s1 ZINC000358502510 336632753 /nfs/dbraw/zinc/63/27/53/336632753.db2.gz CGLZNCDNMZNQPB-ZDUSSCGKSA-N 0 1 324.453 4.013 20 0 DIADMN CCc1cnccc1[C@@H](C)NCc1cnc(-c2ccncc2)s1 ZINC000358502509 336632839 /nfs/dbraw/zinc/63/28/39/336632839.db2.gz CGLZNCDNMZNQPB-CYBMUJFWSA-N 0 1 324.453 4.013 20 0 DIADMN COCCCC[C@@H](N[C@@H](C)c1ccc(F)cn1)c1ccccc1 ZINC000359023421 336653856 /nfs/dbraw/zinc/65/38/56/336653856.db2.gz ZLEAISAYRLIHKW-HNAYVOBHSA-N 0 1 316.420 4.429 20 0 DIADMN CSc1ccc(F)cc1CN[C@H](c1cccnc1)C(C)C ZINC000359319192 336667546 /nfs/dbraw/zinc/66/75/46/336667546.db2.gz WJCMHEGXETWRLV-KRWDZBQOSA-N 0 1 304.434 4.430 20 0 DIADMN Fc1ccc(CN[C@@H]2CCCOc3ccc(Cl)cc32)cc1 ZINC000359358828 336669127 /nfs/dbraw/zinc/66/91/27/336669127.db2.gz AALUUGPDFDIRNL-MRXNPFEDSA-N 0 1 305.780 4.483 20 0 DIADMN C[C@H](N[C@@H](Cc1ccccn1)c1ccccc1)c1cncs1 ZINC000359993721 336696899 /nfs/dbraw/zinc/69/68/99/336696899.db2.gz NPERSHBESGOCJT-YOEHRIQHSA-N 0 1 309.438 4.173 20 0 DIADMN CO[C@H](C)[C@H](C)NCc1nc(-c2cc3ccccc3o2)cs1 ZINC000359995613 336697012 /nfs/dbraw/zinc/69/70/12/336697012.db2.gz UPWKGKGQPXEKJG-NWDGAFQWSA-N 0 1 316.426 4.069 20 0 DIADMN C[C@@H]1CC(C)(C)CC[C@@H]1NCc1noc(-c2ccsc2)n1 ZINC000360276126 336707099 /nfs/dbraw/zinc/70/70/99/336707099.db2.gz VKBZKTVWLSZTAP-YPMHNXCESA-N 0 1 305.447 4.103 20 0 DIADMN C[C@H](NCc1cnc2n1CCCC2)c1ccc(C(F)(F)F)cc1 ZINC000367367680 336714746 /nfs/dbraw/zinc/71/47/46/336714746.db2.gz MHLYVLLGQYELTQ-LBPRGKRZSA-N 0 1 323.362 4.089 20 0 DIADMN Cc1ccc2c(c1)OCCC[C@H]2NCc1ccc(F)cc1F ZINC000360688512 336718966 /nfs/dbraw/zinc/71/89/66/336718966.db2.gz HZGBXGVIWCIPRA-QGZVFWFLSA-N 0 1 303.352 4.277 20 0 DIADMN COc1ccc2c(c1)[C@H](N[C@H](c1cccnc1)C1CCC1)CCO2 ZINC000360871538 336725014 /nfs/dbraw/zinc/72/50/14/336725014.db2.gz JMZBRVFFZGIMAE-QUCCMNQESA-N 0 1 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COc1cc2c(cc1F)CC[C@@H]2N[C@@H](C)c1cccc(F)c1F ZINC000510963582 340316491 /nfs/dbraw/zinc/31/64/91/340316491.db2.gz UVCSFWQFZSWDMW-QFYYESIMSA-N 0 1 321.342 4.451 20 0 DIADMN COc1cc2c(cc1F)CC[C@H]2N[C@H](C)c1cccc(F)c1F ZINC000510963586 340316544 /nfs/dbraw/zinc/31/65/44/340316544.db2.gz UVCSFWQFZSWDMW-QLJPJBMISA-N 0 1 321.342 4.451 20 0 DIADMN COc1cc2c(cc1F)CC[C@H]2N[C@H](C)c1cc(F)ccc1F ZINC000510976678 340316817 /nfs/dbraw/zinc/31/68/17/340316817.db2.gz GVVAGRSJUXHDNJ-BMLIUANNSA-N 0 1 321.342 4.451 20 0 DIADMN CCc1nnc(SCCCOc2cccc(C(C)(C)C)c2)[nH]1 ZINC000510980134 340317073 /nfs/dbraw/zinc/31/70/73/340317073.db2.gz VQLIVWXQXKLMKB-UHFFFAOYSA-N 0 1 319.474 4.226 20 0 DIADMN CCc1n[nH]c(SCCCOc2cccc(C(C)(C)C)c2)n1 ZINC000510980134 340317074 /nfs/dbraw/zinc/31/70/74/340317074.db2.gz VQLIVWXQXKLMKB-UHFFFAOYSA-N 0 1 319.474 4.226 20 0 DIADMN COc1cc2c(cc1F)CC[C@@H]2N[C@@H](C)c1ccc(Cl)cn1 ZINC000511042092 340319195 /nfs/dbraw/zinc/31/91/95/340319195.db2.gz AUUALTYWRVSPRM-QFYYESIMSA-N 0 1 320.795 4.221 20 0 DIADMN C[C@@H](N[C@@H](C)c1cccc(OC(F)F)c1)c1ccncc1F ZINC000511051053 340319515 /nfs/dbraw/zinc/31/95/15/340319515.db2.gz QEUTYKBWSORGGV-WDEREUQCSA-N 0 1 310.319 4.234 20 0 DIADMN Cc1cc(CN2CCC[C@H](c3cccc(C(F)(F)F)c3)C2)no1 ZINC000511073707 340320117 /nfs/dbraw/zinc/32/01/17/340320117.db2.gz QRKVZAXOBPFFJX-AWEZNQCLSA-N 0 1 324.346 4.381 20 0 DIADMN COC(=O)c1ccc(F)c(CN[C@H](C)c2cc(C)cc(C)c2)c1 ZINC000511168290 340323137 /nfs/dbraw/zinc/32/31/37/340323137.db2.gz CYJHHUDEUCGXOB-CQSZACIVSA-N 0 1 315.388 4.080 20 0 DIADMN C[C@@H]1CN(Cc2ccccc2)CCN1c1nc2ccccc2s1 ZINC000303448787 340325919 /nfs/dbraw/zinc/32/59/19/340325919.db2.gz CFEGSUVLLAYZQC-OAHLLOKOSA-N 0 1 323.465 4.007 20 0 DIADMN CCN(Cc1cnn(CC)c1)Cc1ccc(Cl)c(Cl)c1 ZINC000511486450 340328399 /nfs/dbraw/zinc/32/83/99/340328399.db2.gz FGTRVJPBHPSPOA-UHFFFAOYSA-N 0 1 312.244 4.232 20 0 DIADMN COC[C@H](NC1CC(c2ccccc2Cl)C1)c1ccco1 ZINC000511506481 340329007 /nfs/dbraw/zinc/32/90/07/340329007.db2.gz NVYYYJKBMJXUCV-ZUEPYMLJSA-N 0 1 305.805 4.156 20 0 DIADMN C[N@@H+](C/C=C\c1ccc(F)cc1)C[C@H]1OCCc2ccccc21 ZINC000511630729 340333138 /nfs/dbraw/zinc/33/31/38/340333138.db2.gz SOJPZKHXHHFAOH-BBIZLLLXSA-N 0 1 311.400 4.085 20 0 DIADMN CN(C/C=C\c1ccc(F)cc1)C[C@H]1OCCc2ccccc21 ZINC000511630729 340333139 /nfs/dbraw/zinc/33/31/39/340333139.db2.gz SOJPZKHXHHFAOH-BBIZLLLXSA-N 0 1 311.400 4.085 20 0 DIADMN C[N@@H+](C/C=C/c1ccc(F)cc1)C[C@H]1OCCc2ccccc21 ZINC000511630730 340333166 /nfs/dbraw/zinc/33/31/66/340333166.db2.gz SOJPZKHXHHFAOH-DPZZJQGRSA-N 0 1 311.400 4.085 20 0 DIADMN CN(C/C=C/c1ccc(F)cc1)C[C@H]1OCCc2ccccc21 ZINC000511630730 340333167 /nfs/dbraw/zinc/33/31/67/340333167.db2.gz SOJPZKHXHHFAOH-DPZZJQGRSA-N 0 1 311.400 4.085 20 0 DIADMN CC(C)c1noc([C@@H](C)[N@H+]2CCC[C@@](C)(c3ccccc3)C2)n1 ZINC000303553988 340333367 /nfs/dbraw/zinc/33/33/67/340333367.db2.gz HLRUZGCZGZMHEU-DNVCBOLYSA-N 0 1 313.445 4.308 20 0 DIADMN CC(C)c1noc([C@@H](C)N2CCC[C@@](C)(c3ccccc3)C2)n1 ZINC000303553988 340333368 /nfs/dbraw/zinc/33/33/68/340333368.db2.gz HLRUZGCZGZMHEU-DNVCBOLYSA-N 0 1 313.445 4.308 20 0 DIADMN CC[C@H](O)[C@H]1CCCCN1Cc1ccc(Cl)cc1Cl ZINC000303558325 340333508 /nfs/dbraw/zinc/33/35/08/340333508.db2.gz MXGJQJQQSBAEJD-CABCVRRESA-N 0 1 302.245 4.119 20 0 DIADMN CC[C@@H](O)[C@@H]1CCCCN1Cc1ccc(Cl)c(Cl)c1 ZINC000303580737 340335723 /nfs/dbraw/zinc/33/57/23/340335723.db2.gz OUGPQFADHGEKQH-LSDHHAIUSA-N 0 1 302.245 4.119 20 0 DIADMN Cc1cc(Br)ccc1CN(C)CCC(F)(F)F ZINC000511751898 340337154 /nfs/dbraw/zinc/33/71/54/340337154.db2.gz BHAWUBOQPPTDNE-UHFFFAOYSA-N 0 1 310.157 4.142 20 0 DIADMN Fc1cccc(F)c1-c1n[nH]cc1CN1CCC[C@@H]2CCC[C@H]21 ZINC000511860933 340340755 /nfs/dbraw/zinc/34/07/55/340340755.db2.gz UZDGHXMPAJYOER-BLLLJJGKSA-N 0 1 317.383 4.119 20 0 DIADMN Cc1cccc(C(C)C)c1NC(=O)CN1CCCCC[C@@H]1C ZINC000512177442 340351136 /nfs/dbraw/zinc/35/11/36/340351136.db2.gz XCTSDEVGAXCRGC-INIZCTEOSA-N 0 1 302.462 4.321 20 0 DIADMN C[C@H]1CC[C@H](c2ccccc2)N(Cc2nc(-c3ccoc3)no2)C1 ZINC000512194059 340351776 /nfs/dbraw/zinc/35/17/76/340351776.db2.gz KBPNDYSQMYWZSQ-WMLDXEAASA-N 0 1 323.396 4.303 20 0 DIADMN Cc1oc2ccccc2c1CN1CCO[C@@H](c2cccs2)C1 ZINC000512212060 340352557 /nfs/dbraw/zinc/35/25/57/340352557.db2.gz MJUTXWNNUIFJIY-QGZVFWFLSA-N 0 1 313.422 4.376 20 0 DIADMN COC(=O)c1oc(CN([C@@H](C)c2ccccc2)C2CC2)cc1C ZINC000512246981 340354096 /nfs/dbraw/zinc/35/40/96/340354096.db2.gz XVEVEIVQDDYTII-AWEZNQCLSA-N 0 1 313.397 4.100 20 0 DIADMN CCC[C@]1(NCc2csc(C3CCCCC3)n2)CCOC1 ZINC000512258907 340354515 /nfs/dbraw/zinc/35/45/15/340354515.db2.gz GXLZMIQOXSJUQR-KRWDZBQOSA-N 0 1 308.491 4.240 20 0 DIADMN Cc1cccc(C)c1NC(=O)CN([C@H](C)c1ccccc1)C1CC1 ZINC000512264220 340354561 /nfs/dbraw/zinc/35/45/61/340354561.db2.gz UTQPWAJGQBWCIR-QGZVFWFLSA-N 0 1 322.452 4.468 20 0 DIADMN CCC[C@@]1(NCc2nc(-c3ccc(C)cc3)cs2)CCOC1 ZINC000512277696 340355017 /nfs/dbraw/zinc/35/50/17/340355017.db2.gz MNFMQFWCWJYCBL-GOSISDBHSA-N 0 1 316.470 4.167 20 0 DIADMN CN(c1ccccc1)C1CCN(Cc2cc(F)cc(F)c2)CC1 ZINC000512370447 340359101 /nfs/dbraw/zinc/35/91/01/340359101.db2.gz RFAVUUSKJTWUEF-UHFFFAOYSA-N 0 1 316.395 4.066 20 0 DIADMN CCc1ccc(CN[C@]2(c3ccc(Cl)cc3)C[C@@H]2C)cn1 ZINC000512379848 340359671 /nfs/dbraw/zinc/35/96/71/340359671.db2.gz QGQWVHFCFODDHB-SCLBCKFNSA-N 0 1 300.833 4.322 20 0 DIADMN C[C@@]1(CCCO)CCCN1Cc1cc(Cl)ccc1Cl ZINC000512398536 340360447 /nfs/dbraw/zinc/36/04/47/340360447.db2.gz BDCPBLSYTNBLIS-HNNXBMFYSA-N 0 1 302.245 4.120 20 0 DIADMN CCc1cc(OC)ccc1CNCc1c(F)cccc1SC ZINC000512567684 340367337 /nfs/dbraw/zinc/36/73/37/340367337.db2.gz CQAFZJBIHZJSTO-UHFFFAOYSA-N 0 1 319.445 4.408 20 0 DIADMN CCC[N@H+](C)[C@H](CNCc1ccco1)c1ccc(Cl)cc1 ZINC000512568280 340367343 /nfs/dbraw/zinc/36/73/43/340367343.db2.gz GTBSVTUFMFYFLS-QGZVFWFLSA-N 0 1 306.837 4.106 20 0 DIADMN Fc1ccc(CN2CC[C@@H](Nc3ccccc3)C2)cc1Cl ZINC000512595467 340368337 /nfs/dbraw/zinc/36/83/37/340368337.db2.gz PZJSQCVMNFZZBX-OAHLLOKOSA-N 0 1 304.796 4.166 20 0 DIADMN C[C@H](N[C@@H]1CCC[C@H](C)[C@H]1C)c1noc(Cc2ccccc2)n1 ZINC000512660388 340371554 /nfs/dbraw/zinc/37/15/54/340371554.db2.gz MOOXTFIIIAIYED-QSJFSLAZSA-N 0 1 313.445 4.136 20 0 DIADMN FC(F)C1CCN(Cc2c(Cl)ccc3cccnc32)CC1 ZINC000512737954 340375114 /nfs/dbraw/zinc/37/51/14/340375114.db2.gz CEHWAIQJNUKPEK-UHFFFAOYSA-N 0 1 310.775 4.365 20 0 DIADMN CC[C@@H]1CN(Cc2c(Cl)ccc3cccnc32)CCS1 ZINC000512750911 340375849 /nfs/dbraw/zinc/37/58/49/340375849.db2.gz VAJHFAACRLNYJB-CYBMUJFWSA-N 0 1 306.862 4.216 20 0 DIADMN CCSCC[C@H](C)N(C)Cc1ncc(-c2ccccc2)o1 ZINC000174035370 340380615 /nfs/dbraw/zinc/38/06/15/340380615.db2.gz YPBRPAWTFUIYBW-AWEZNQCLSA-N 0 1 304.459 4.305 20 0 DIADMN Fc1ccccc1-c1ccc(CNCc2cnn3ccccc23)o1 ZINC000512849413 340380726 /nfs/dbraw/zinc/38/07/26/340380726.db2.gz DSUIGNTVWXIKDL-UHFFFAOYSA-N 0 1 321.355 4.023 20 0 DIADMN FC(F)(F)C1(CNCc2csc(-c3cccs3)n2)CC1 ZINC000512863607 340381384 /nfs/dbraw/zinc/38/13/84/340381384.db2.gz DLJVSDXVZZMVPG-UHFFFAOYSA-N 0 1 318.389 4.304 20 0 DIADMN CC(C)CCOc1ccc(CNCc2cnn3ccccc23)cc1 ZINC000512874219 340381935 /nfs/dbraw/zinc/38/19/35/340381935.db2.gz LEWRCMDYJWVCEI-UHFFFAOYSA-N 0 1 323.440 4.049 20 0 DIADMN Cn1ccnc1[C@@H](NCc1cc(-c2ccccc2)cs1)C1CC1 ZINC000512875025 340382057 /nfs/dbraw/zinc/38/20/57/340382057.db2.gz XVVPKHPWVNOFPM-SFHVURJKSA-N 0 1 323.465 4.390 20 0 DIADMN FC(F)(F)Oc1cccc([C@H](NCc2ccco2)C2CC2)c1 ZINC000512908945 340383633 /nfs/dbraw/zinc/38/36/33/340383633.db2.gz OJUXIXGTPMLVBI-OAHLLOKOSA-N 0 1 311.303 4.419 20 0 DIADMN CCOc1ccccc1CNCc1ccc(CSC)cc1 ZINC000512971742 340386276 /nfs/dbraw/zinc/38/62/76/340386276.db2.gz LAWADRYMBRYRIX-UHFFFAOYSA-N 0 1 301.455 4.238 20 0 DIADMN COc1ccc(CNC(C)(C)c2ccccc2OC)cc1Cl ZINC000174345122 340386496 /nfs/dbraw/zinc/38/64/96/340386496.db2.gz CCHMVDKZPVAHPO-UHFFFAOYSA-N 0 1 319.832 4.382 20 0 DIADMN C[C@H]1CCc2nc(CNCC3(C(F)(F)F)CCC3)sc2C1 ZINC000512994242 340387286 /nfs/dbraw/zinc/38/72/86/340387286.db2.gz XDAFQXMLZLOOHH-JTQLQIEISA-N 0 1 318.408 4.090 20 0 DIADMN CCC[C@]1(C)CCCN([C@@H](C)c2nc(-c3cccnc3)no2)C1 ZINC000174453138 340388751 /nfs/dbraw/zinc/38/87/51/340388751.db2.gz YTHVCIJMNBKSOQ-KBXCAEBGSA-N 0 1 314.433 4.095 20 0 DIADMN C[C@@H](NCc1cc(Cl)ccc1F)c1ccc2n[nH]cc2c1 ZINC000513028379 340389414 /nfs/dbraw/zinc/38/94/14/340389414.db2.gz ZJNZAOVBSWHTCE-SNVBAGLBSA-N 0 1 303.768 4.206 20 0 DIADMN C[C@@H](NCc1cnc(C(C)(C)C)s1)c1ccc2n[nH]cc2c1 ZINC000513033608 340389729 /nfs/dbraw/zinc/38/97/29/340389729.db2.gz WQPPIVYSSRBGLG-LLVKDONJSA-N 0 1 314.458 4.168 20 0 DIADMN OCc1ccc(CN[C@H](c2ccccc2)c2cccc(F)c2)cc1 ZINC000305827414 340389894 /nfs/dbraw/zinc/38/98/94/340389894.db2.gz MXRJCPLGHMIRGC-OAQYLSRUSA-N 0 1 321.395 4.197 20 0 DIADMN Cc1noc(C)c1C(C)(C)NCc1ccc(C(F)(F)F)s1 ZINC000513088805 340392852 /nfs/dbraw/zinc/39/28/52/340392852.db2.gz KCTDMGCPTZTRBV-UHFFFAOYSA-N 0 1 318.364 4.397 20 0 DIADMN COc1ccc(CNCc2ccc3[nH]c(C)cc3c2)c(Cl)c1 ZINC000513095703 340393038 /nfs/dbraw/zinc/39/30/38/340393038.db2.gz PROFTLRGOVACLG-UHFFFAOYSA-N 0 1 314.816 4.428 20 0 DIADMN Cc1cc2cc(CNCc3cc(F)c(F)cc3F)ccc2[nH]1 ZINC000513100219 340393170 /nfs/dbraw/zinc/39/31/70/340393170.db2.gz IESLEYHGPGFGFK-UHFFFAOYSA-N 0 1 304.315 4.183 20 0 DIADMN C[C@H]1CCN(Cc2ccc(Sc3ccccn3)o2)CCS1 ZINC000513236487 340398851 /nfs/dbraw/zinc/39/88/51/340398851.db2.gz MCOCVYZHMDYNCF-ZDUSSCGKSA-N 0 1 320.483 4.153 20 0 DIADMN C[C@H](NCCSC1CCCCC1)c1c(F)cncc1F ZINC000513258481 340399591 /nfs/dbraw/zinc/39/95/91/340399591.db2.gz WTKZOINGVORAJH-NSHDSACASA-N 0 1 300.418 4.076 20 0 DIADMN Cc1cccc(C)c1OCCCN[C@H](C)c1c(F)cncc1F ZINC000513267069 340400177 /nfs/dbraw/zinc/40/01/77/340400177.db2.gz OFMPFNZHQFWQOZ-CQSZACIVSA-N 0 1 320.383 4.096 20 0 DIADMN Cc1ccnc([C@H](C)NCc2ccc(Br)s2)c1 ZINC000513656871 340417579 /nfs/dbraw/zinc/41/75/79/340417579.db2.gz YNELCUAEGURAPL-JTQLQIEISA-N 0 1 311.248 4.065 20 0 DIADMN COC(=O)c1csc([C@@H](C)NCc2ccc(Cl)s2)c1 ZINC000513659903 340417763 /nfs/dbraw/zinc/41/77/63/340417763.db2.gz DXRPMWWPDYEGLD-MRVPVSSYSA-N 0 1 315.847 4.100 20 0 DIADMN CCOc1ccc([C@@H](C)N[C@@H](C)c2cc(C)ccn2)cc1OC ZINC000513712797 340421175 /nfs/dbraw/zinc/42/11/75/340421175.db2.gz FYDDSOKBILPTII-CABCVRRESA-N 0 1 314.429 4.209 20 0 DIADMN COc1ccc2ccccc2c1CN[C@H](C)c1cc(C)ccn1 ZINC000513760753 340423661 /nfs/dbraw/zinc/42/36/61/340423661.db2.gz KLPQTALKGZSFLF-OAHLLOKOSA-N 0 1 306.409 4.403 20 0 DIADMN O=C(Cc1ccc(Cl)s1)Nc1cc(F)cc(Cl)c1O ZINC000513823019 340426809 /nfs/dbraw/zinc/42/68/09/340426809.db2.gz MZPJCGGTINWQFJ-UHFFFAOYSA-N 0 1 320.172 4.081 20 0 DIADMN CSc1ccc(F)cc1CN[C@H]1CCc2c1cccc2F ZINC000513868954 340429635 /nfs/dbraw/zinc/42/96/35/340429635.db2.gz DGNVKECTYHNRBI-INIZCTEOSA-N 0 1 305.393 4.464 20 0 DIADMN FCCN[C@H](c1ccc(Br)cc1Cl)C1CC1 ZINC000309592415 340430386 /nfs/dbraw/zinc/43/03/86/340430386.db2.gz SPBBONYJJQGXLU-LBPRGKRZSA-N 0 1 306.606 4.113 20 0 DIADMN Cc1cc(CNCc2cc(Br)ccc2F)cs1 ZINC000310215268 340437764 /nfs/dbraw/zinc/43/77/64/340437764.db2.gz VSUJPHKMBQQWFX-UHFFFAOYSA-N 0 1 314.223 4.248 20 0 DIADMN CCCCOc1ncccc1CN[C@@H](C)c1cccc(OC)c1 ZINC000177254572 340438266 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BLRKHBCDCQCEJJ-BJOOFOGMSA-N 0 1 317.429 4.074 20 0 DIADMN Nc1nc2ccc(Nc3ccc(Cl)c(O)c3F)cc2s1 ZINC001159821794 1042217827 /nfs/dbraw/zinc/21/78/27/1042217827.db2.gz DXTRTCRFSZVSRF-UHFFFAOYSA-N 0 1 309.753 4.120 20 0 DIADMN CCCCC[C@@H](C)CC(=O)Nc1c(=O)[nH][nH]c1-c1ccccc1 ZINC000820465027 1042218063 /nfs/dbraw/zinc/21/80/63/1042218063.db2.gz AURIHDHYWKCFMU-CYBMUJFWSA-N 0 1 315.417 4.327 20 0 DIADMN CCCCOc1ncccc1CNC/C(C)=C\c1ccccc1 ZINC001648930915 1042218291 /nfs/dbraw/zinc/21/82/91/1042218291.db2.gz NHNZVHYJNFVRSP-VKAVYKQESA-N 0 1 310.441 4.454 20 0 DIADMN c1c2ccccc2oc1CN[C@H](c1ccccc1)[C@H]1CCCO1 ZINC001648933313 1042221605 /nfs/dbraw/zinc/22/16/05/1042221605.db2.gz PZQALNAQYMVFSV-WOJBJXKFSA-N 0 1 307.393 4.443 20 0 DIADMN C[C@@H]1[C@@H](C)CCC[N@H+]1Cc1c(C(=O)[O-])sc2cccc(F)c21 ZINC000314979629 1042225973 /nfs/dbraw/zinc/22/59/73/1042225973.db2.gz DPCUCYZGWMSTGG-WDEREUQCSA-N 0 1 321.417 4.359 20 0 DIADMN O=C(CC1CCCC1)Nc1ccc2nc(-c3ccco3)[nH]c2c1 ZINC000617133945 1042227128 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C[C@H](c1nc2ccc(Cl)cc2[nH]1)N(C)C(=O)[C@]1(C)C=CCC1 ZINC000821394842 1042249435 /nfs/dbraw/zinc/24/94/35/1042249435.db2.gz MSKLCPDEZWRWOY-PIGZYNQJSA-N 0 1 317.820 4.092 20 0 DIADMN Cc1noc([C@H](C)NCC2(c3ccccc3C)CCCCC2)n1 ZINC000585809726 1042254222 /nfs/dbraw/zinc/25/42/22/1042254222.db2.gz JWTKOJLRMJPXCJ-HNNXBMFYSA-N 0 1 313.445 4.239 20 0 DIADMN CCc1noc(CC)c1CN[C@H](C)c1ccc(SC)cc1 ZINC000166980188 1042257973 /nfs/dbraw/zinc/25/79/73/1042257973.db2.gz ARXPXOAEWBNXAB-GFCCVEGCSA-N 0 1 304.459 4.372 20 0 DIADMN COC(=O)c1oc(CN2CCC[C@H]2c2ccc(C)cc2)cc1C ZINC000025947384 1042258811 /nfs/dbraw/zinc/25/88/11/1042258811.db2.gz BBWPFJZDLXHSEJ-KRWDZBQOSA-N 0 1 313.397 4.020 20 0 DIADMN CC(C)COc1ccccc1CNCc1cccc(N(C)C)c1 ZINC001649150499 1042259198 /nfs/dbraw/zinc/25/91/98/1042259198.db2.gz SKVLCZKTGAHOIF-UHFFFAOYSA-N 0 1 312.457 4.077 20 0 DIADMN COc1ccc(CN[C@H](C)c2cc3ccccc3o2)cc1OC ZINC000026313195 1042259456 /nfs/dbraw/zinc/25/94/56/1042259456.db2.gz LQTZASVNIFMRKI-CYBMUJFWSA-N 0 1 311.381 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Cn1ncc2c1CCC[C@H]2N[C@@H](CC(F)(F)F)c1ccccc1 ZINC000320185574 1042321951 /nfs/dbraw/zinc/32/19/51/1042321951.db2.gz OPSGCDYCAAEIAA-CABCVRRESA-N 0 1 323.362 4.081 20 0 DIADMN Fc1cc(CN2CC[C@@H](c3ccc(Cl)cc3)C2)c(F)cn1 ZINC000823447233 1042326383 /nfs/dbraw/zinc/32/63/83/1042326383.db2.gz FBNLBQOUDBUTTR-GFCCVEGCSA-N 0 1 308.759 4.003 20 0 DIADMN COC[C@H](N[C@H](C)c1cnccc1C)c1ccc(Cl)cc1 ZINC000279644892 1042326859 /nfs/dbraw/zinc/32/68/59/1042326859.db2.gz BCHXYFJEALZQNN-DYVFJYSZSA-N 0 1 304.821 4.082 20 0 DIADMN CC1(C)CCN(Cc2csc(-c3ccoc3)n2)CCS1 ZINC000279656167 1042328721 /nfs/dbraw/zinc/32/87/21/1042328721.db2.gz CEWUDTTTWBUBNM-UHFFFAOYSA-N 0 1 308.472 4.121 20 0 DIADMN O=C(c1ccc(O)c(Cl)c1)N1CCCC[C@H]1c1ccccc1 ZINC000436528714 1042331317 /nfs/dbraw/zinc/33/13/17/1042331317.db2.gz PDCGCEVHPMPXCQ-INIZCTEOSA-N 0 1 315.800 4.413 20 0 DIADMN COc1ccc([C@@H](NCc2ccnc(Cl)c2F)C(C)C)cc1 ZINC000823603021 1042334878 /nfs/dbraw/zinc/33/48/78/1042334878.db2.gz ZLIFIICATDTVGO-INIZCTEOSA-N 0 1 322.811 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Nc1c(Cl)cccc1CNCc1ccccc1OC1CCC1 ZINC000877035773 1043734888 /nfs/dbraw/zinc/73/48/88/1043734888.db2.gz JTWPHHKUAYKICM-UHFFFAOYSA-N 0 1 316.832 4.143 20 0 DIADMN COc1cnc(F)c(CN[C@@H](c2ccccc2C)C(C)C)c1 ZINC000877024380 1043736142 /nfs/dbraw/zinc/73/61/42/1043736142.db2.gz BWSXKQLJPDVKDK-QGZVFWFLSA-N 0 1 302.393 4.025 20 0 DIADMN Cc1noc(C)c1[C@H](C)NCc1cc2nc(Cl)ccc2s1 ZINC000877046105 1043736706 /nfs/dbraw/zinc/73/67/06/1043736706.db2.gz INMPSSNOXWLQCE-QMMMGPOBSA-N 0 1 321.833 4.405 20 0 DIADMN Clc1csc(CN[C@H](c2ccccc2)C2CCOCC2)n1 ZINC000877041899 1043736917 /nfs/dbraw/zinc/73/69/17/1043736917.db2.gz KGBKKBZJHGFFDI-MRXNPFEDSA-N 0 1 322.861 4.054 20 0 DIADMN C[C@@H]1C[C@@H]1[C@H](NCc1ccc(Cl)nn1)c1ccc(Cl)cc1 ZINC000877043272 1043738297 /nfs/dbraw/zinc/73/82/97/1043738297.db2.gz IMAPQEZSHQYGTE-FUEDEBDSSA-N 0 1 322.239 4.270 20 0 DIADMN Clc1csc(CN[C@@H](c2ccccc2)C2CCOCC2)n1 ZINC000877041898 1043738454 /nfs/dbraw/zinc/73/84/54/1043738454.db2.gz KGBKKBZJHGFFDI-INIZCTEOSA-N 0 1 322.861 4.054 20 0 DIADMN O=C(c1cccc2c[nH]nc21)N1CCC[C@H]1CCC1CCCC1 ZINC000355011959 1043738592 /nfs/dbraw/zinc/73/85/92/1043738592.db2.gz HDDMOYGVVWSERU-INIZCTEOSA-N 0 1 311.429 4.138 20 0 DIADMN Cc1ccc([C@@H](C)NCc2cn3cc(Cl)ccc3n2)s1 ZINC000096543849 1043739329 /nfs/dbraw/zinc/73/93/29/1043739329.db2.gz DCJKRVZLJLVMOU-LLVKDONJSA-N 0 1 305.834 4.208 20 0 DIADMN CCc1nc(CN[C@@H](CCC(C)C)c2ccc(Cl)cc2)n[nH]1 ZINC000355076934 1043742015 /nfs/dbraw/zinc/74/20/15/1043742015.db2.gz LWPBEPLECMDZQF-HNNXBMFYSA-N 0 1 320.868 4.288 20 0 DIADMN Brc1ccc(CN2C3CCCC2CCC3)s1 ZINC000608499023 1043747561 /nfs/dbraw/zinc/74/75/61/1043747561.db2.gz RSQMGZTVFMZFJY-UHFFFAOYSA-N 0 1 300.265 4.418 20 0 DIADMN CC[C@H](Cc1ccc(Br)cc1)N[C@H](C)c1ncco1 ZINC000895763743 1043747698 /nfs/dbraw/zinc/74/76/98/1043747698.db2.gz BCKDWLYKWOGOBP-BXUZGUMPSA-N 0 1 323.234 4.109 20 0 DIADMN CC(C)c1ccc2c(c1)[C@H](NCc1ccc(Cl)nn1)CCC2 ZINC000877130022 1043748020 /nfs/dbraw/zinc/74/80/20/1043748020.db2.gz SMYMWHLOKDAUKE-QGZVFWFLSA-N 0 1 315.848 4.421 20 0 DIADMN CCO[C@H]1C[C@@H](N(C)Cc2cnc(C3CCC3)s2)C12CCC2 ZINC000355178209 1043748958 /nfs/dbraw/zinc/74/89/58/1043748958.db2.gz UOFJCGRYMQDPGW-CVEARBPZSA-N 0 1 320.502 4.190 20 0 DIADMN COc1ccccc1C[C@@H](C)N(C)Cc1cc(F)cc(F)c1F ZINC001137875254 1043750902 /nfs/dbraw/zinc/75/09/02/1043750902.db2.gz NUFZEXKXBWPOOB-GFCCVEGCSA-N 0 1 323.358 4.176 20 0 DIADMN C[C@@H](N[C@@H](C)CCc1cccc(F)c1)c1nc(C(C)(C)C)no1 ZINC000237332202 1043751315 /nfs/dbraw/zinc/75/13/15/1043751315.db2.gz XZXIUEMHILIHEM-QWHCGFSZSA-N 0 1 319.424 4.178 20 0 DIADMN CSc1ccccc1CN(C)Cc1ccc(-c2cc[nH]n2)o1 ZINC000355217848 1043751894 /nfs/dbraw/zinc/75/18/94/1043751894.db2.gz SSLHQUZMQALKSK-UHFFFAOYSA-N 0 1 313.426 4.024 20 0 DIADMN C[C@H]1[C@H](C(F)(F)F)CCN1Cc1cc2cc(F)ccc2o1 ZINC000355226718 1043753574 /nfs/dbraw/zinc/75/35/74/1043753574.db2.gz SFXYRUPSCGGTKQ-TVQRCGJNSA-N 0 1 301.283 4.345 20 0 DIADMN CN(CC[S@@](=O)c1ccccc1)Cc1ccc2ccccc2c1 ZINC000355252579 1043754203 /nfs/dbraw/zinc/75/42/03/1043754203.db2.gz IVLAJWGLMIFMSB-HSZRJFAPSA-N 0 1 323.461 4.079 20 0 DIADMN Brc1ccc(CNCc2ccc(C3CC3)cc2)o1 ZINC000191683111 1043755556 /nfs/dbraw/zinc/75/55/56/1043755556.db2.gz QPVMNNXEUNQNHY-UHFFFAOYSA-N 0 1 306.203 4.209 20 0 DIADMN Cc1ccsc1C(=O)Nc1ccc2nc(C3CCC3)[nH]c2c1 ZINC000355250907 1043755886 /nfs/dbraw/zinc/75/58/86/1043755886.db2.gz IIZPMSRNZCEVGR-UHFFFAOYSA-N 0 1 311.410 4.453 20 0 DIADMN COCc1cccc(-c2nc3ccc(C(F)(F)F)cc3[nH]2)c1 ZINC000261367135 1043756466 /nfs/dbraw/zinc/75/64/66/1043756466.db2.gz HNHHAXWDTWOPBY-UHFFFAOYSA-N 0 1 306.287 4.395 20 0 DIADMN c1nn(Cc2ccccc2)cc1CNCc1ccc(C2CC2)cc1 ZINC000191684299 1043757740 /nfs/dbraw/zinc/75/77/40/1043757740.db2.gz VLIFQFUKABWHKJ-UHFFFAOYSA-N 0 1 317.436 4.099 20 0 DIADMN CCC1(C(=O)Nc2[nH]nc(-c3ccc(C)o3)c2C)CCCCC1 ZINC000559989419 1043758121 /nfs/dbraw/zinc/75/81/21/1043758121.db2.gz QRPXPPXZEVWRBB-UHFFFAOYSA-N 0 1 315.417 4.586 20 0 DIADMN COc1cccc(C=C2CCN(Cc3cnccc3C)CC2)c1 ZINC000474388470 1043760190 /nfs/dbraw/zinc/76/01/90/1043760190.db2.gz FQSIVHHOXUEKPK-UHFFFAOYSA-N 0 1 308.425 4.078 20 0 DIADMN CC(C)c1ccc2c(c1)[C@H](NCc1ccc(Cl)nn1)CC2 ZINC000877438906 1043762103 /nfs/dbraw/zinc/76/21/03/1043762103.db2.gz ZIXMDPAFXGMAQX-MRXNPFEDSA-N 0 1 301.821 4.031 20 0 DIADMN Cc1ccc2nc([C@H]3CCCN3C(=O)[C@H]3CC34CCCC4)[nH]c2c1 ZINC000474403329 1043762983 /nfs/dbraw/zinc/76/29/83/1043762983.db2.gz PWHQOBNPKKGLRT-RHSMWYFYSA-N 0 1 323.440 4.115 20 0 DIADMN Cc1nn(C(C)(C)C)c(C)c1CN[C@@H]1CCc2c1cccc2F ZINC000895853554 1043766981 /nfs/dbraw/zinc/76/69/81/1043766981.db2.gz HKXQFUMSNPAAGL-GOSISDBHSA-N 0 1 315.436 4.171 20 0 DIADMN Cc1nc(C)c([C@H](C)Nc2ccc(CN(C)C)c(F)c2)s1 ZINC000777701816 1043767330 /nfs/dbraw/zinc/76/73/30/1043767330.db2.gz OXRWUJZBWAQACV-NSHDSACASA-N 0 1 307.438 4.134 20 0 DIADMN CC[C@@H](Nc1ccc(CN(C)C)c(F)c1)c1ccc(OC)cc1 ZINC000777701315 1043767779 /nfs/dbraw/zinc/76/77/79/1043767779.db2.gz LSBSVEFXXWCHKP-LJQANCHMSA-N 0 1 316.420 4.459 20 0 DIADMN CCOc1ccccc1[C@@H](C)Nc1ccc(CN(C)C)c(F)c1 ZINC000777699842 1043767857 /nfs/dbraw/zinc/76/78/57/1043767857.db2.gz DWYSNOUJKLBGEF-CQSZACIVSA-N 0 1 316.420 4.459 20 0 DIADMN COc1cccc([C@H](C)Nc2ccc(CN(C)C)c(F)c2)c1 ZINC000777699728 1043768075 /nfs/dbraw/zinc/76/80/75/1043768075.db2.gz FQOYZZDXLIMECI-ZDUSSCGKSA-N 0 1 302.393 4.069 20 0 DIADMN Cc1cccc(C(C)C)c1NC(=O)[C@H](C)N1CCC[C@@H](C)C1 ZINC000355453348 1043768532 /nfs/dbraw/zinc/76/85/32/1043768532.db2.gz FOURJRYSFUWIRE-ZBFHGGJFSA-N 0 1 302.462 4.177 20 0 DIADMN COc1ccc([C@H](C)Nc2ccc(CN(C)C)c(F)c2)cc1F ZINC000777699845 1043768598 /nfs/dbraw/zinc/76/85/98/1043768598.db2.gz DYUTZQJKOZODPJ-LBPRGKRZSA-N 0 1 320.383 4.208 20 0 DIADMN C[C@@H](Nc1ccc(CN(C)C)c(F)c1)c1cc(F)ccc1F ZINC000777701158 1043768848 /nfs/dbraw/zinc/76/88/48/1043768848.db2.gz QVUHINYLXRJVLN-LLVKDONJSA-N 0 1 308.347 4.339 20 0 DIADMN COc1ccc(C)cc1[C@@H](C)Nc1ccc(CN(C)C)c(F)c1 ZINC000777700167 1043769153 /nfs/dbraw/zinc/76/91/53/1043769153.db2.gz JWPVKCCMQOVIMQ-CQSZACIVSA-N 0 1 316.420 4.377 20 0 DIADMN C[C@H](Nc1ccc(CN(C)C)c(F)c1)c1ccc(Cl)nc1 ZINC000777700529 1043769271 /nfs/dbraw/zinc/76/92/71/1043769271.db2.gz MZCTWMVUDRDMQI-NSHDSACASA-N 0 1 307.800 4.109 20 0 DIADMN Cc1ccc([C@@H](C)Nc2ccc(CN(C)C)c(F)c2)c(C)n1 ZINC000777702436 1043771127 /nfs/dbraw/zinc/77/11/27/1043771127.db2.gz XSULJYUERBZNQT-CQSZACIVSA-N 0 1 301.409 4.072 20 0 DIADMN Nc1c(Cl)cccc1CNCc1cc(C2CC2)ccc1F ZINC000877555900 1043774745 /nfs/dbraw/zinc/77/47/45/1043774745.db2.gz GLAHCILLCPIJTL-UHFFFAOYSA-N 0 1 304.796 4.229 20 0 DIADMN COc1ccc(CN(Cc2ccc(F)c(F)c2)C2CC2)cc1 ZINC000096954341 1043774807 /nfs/dbraw/zinc/77/48/07/1043774807.db2.gz PLBVODAAQHFUCU-UHFFFAOYSA-N 0 1 303.352 4.138 20 0 DIADMN COCC[C@H](Nc1ccnc2cc(F)ccc21)c1ccco1 ZINC000355573302 1043777136 /nfs/dbraw/zinc/77/71/36/1043777136.db2.gz HHVBTXVDRHNONV-HNNXBMFYSA-N 0 1 300.333 4.157 20 0 DIADMN Fc1ccc2occ(C[N@H+]3CC[C@H](Oc4ccccc4)C3)c2c1 ZINC001141852708 1043778806 /nfs/dbraw/zinc/77/88/06/1043778806.db2.gz OKMSEVLGFMGUTM-KRWDZBQOSA-N 0 1 311.356 4.225 20 0 DIADMN CN(C)Cc1ccc(NCc2ncc(Cl)s2)cc1Cl ZINC000355583366 1043779704 /nfs/dbraw/zinc/77/97/04/1043779704.db2.gz MNXATGBLBKYOGS-UHFFFAOYSA-N 0 1 316.257 4.124 20 0 DIADMN CN(C)Cc1ccc(NCc2csc(C3CC3)n2)cc1Cl ZINC000355584077 1043779783 /nfs/dbraw/zinc/77/97/83/1043779783.db2.gz OQSXQTJNXLRNRO-UHFFFAOYSA-N 0 1 321.877 4.348 20 0 DIADMN O=C(Nc1cc(F)cc(Cl)c1O)c1cc(Cl)ccc1F ZINC000474439976 1043779984 /nfs/dbraw/zinc/77/99/84/1043779984.db2.gz WLBGXRLXQWQGNC-UHFFFAOYSA-N 0 1 318.106 4.230 20 0 DIADMN FC1(F)C[C@]12CCCN(Cc1c(Cl)cncc1Cl)C2 ZINC000877615745 1043780930 /nfs/dbraw/zinc/78/09/30/1043780930.db2.gz YCFLSGLVKIDOIE-LBPRGKRZSA-N 0 1 307.171 4.010 20 0 DIADMN CSc1ccc(C(=O)Nc2cc(F)cc(Cl)c2O)cc1 ZINC000474448428 1043782746 /nfs/dbraw/zinc/78/27/46/1043782746.db2.gz RXXOMNCOFSVHJD-UHFFFAOYSA-N 0 1 311.765 4.159 20 0 DIADMN CSc1ccccc1C(=O)Nc1cc(F)cc(Cl)c1O ZINC000474443714 1043782774 /nfs/dbraw/zinc/78/27/74/1043782774.db2.gz FAAXNHAYMBHDEM-UHFFFAOYSA-N 0 1 311.765 4.159 20 0 DIADMN O=C(Nc1cc(F)cc(Cl)c1O)c1ccoc1C(F)(F)F ZINC000355731264 1043785978 /nfs/dbraw/zinc/78/59/78/1043785978.db2.gz HQXBANWVZQJZLG-UHFFFAOYSA-N 0 1 323.629 4.049 20 0 DIADMN Cc1cc(CNCc2cn(C(F)F)c3ccccc23)sn1 ZINC000877657734 1043786161 /nfs/dbraw/zinc/78/61/61/1043786161.db2.gz NTIYENSSWUOCEU-UHFFFAOYSA-N 0 1 307.369 4.091 20 0 DIADMN O=C(Nc1cc(F)cc(Cl)c1O)c1cccc(Cl)c1 ZINC000474449200 1043786527 /nfs/dbraw/zinc/78/65/27/1043786527.db2.gz UPKMUAGJALYVHV-UHFFFAOYSA-N 0 1 300.116 4.090 20 0 DIADMN CC(C)n1ccnc1CN[C@@H]1CCc2cccc3cccc1c32 ZINC000895937520 1043787580 /nfs/dbraw/zinc/78/75/80/1043787580.db2.gz XZFFESYBOKOIOD-GOSISDBHSA-N 0 1 305.425 4.394 20 0 DIADMN C[C@H]1CCCC[C@H]1CN1CCc2c(ncn2-c2ccccc2)C1 ZINC000929065981 1043787846 /nfs/dbraw/zinc/78/78/46/1043787846.db2.gz XROZGKAVJFGRQP-IRXDYDNUSA-N 0 1 309.457 4.057 20 0 DIADMN C[C@H](c1cccc(Cl)c1)N(C)CC[S@](=O)c1ccccc1 ZINC000355754433 1043788471 /nfs/dbraw/zinc/78/84/71/1043788471.db2.gz UALHCXXJYKCOIA-SZNDQCEHSA-N 0 1 321.873 4.141 20 0 DIADMN CC1CCC(CN2CCc3c(ncn3-c3ccccc3)C2)CC1 ZINC000929065413 1043788576 /nfs/dbraw/zinc/78/85/76/1043788576.db2.gz TXNDOGNBHTVFEM-UHFFFAOYSA-N 0 1 309.457 4.057 20 0 DIADMN CC1=C[C@@H](C)C[C@@H](CN2CCc3c(ncn3-c3ccccc3)C2)C1 ZINC000929064143 1043789049 /nfs/dbraw/zinc/78/90/49/1043789049.db2.gz JYJODCSNDOGJNN-SJLPKXTDSA-N 0 1 321.468 4.223 20 0 DIADMN Cc1ncc2n1C[C@@H](c1nc(-c3ccc(C(C)C)cc3)no1)CC2 ZINC000895957743 1043792001 /nfs/dbraw/zinc/79/20/01/1043792001.db2.gz BNHYNHJUOIECER-INIZCTEOSA-N 0 1 322.412 4.095 20 0 DIADMN C[C@]1(C(F)(F)F)CCN(Cc2conc2Cc2ccccc2)C1 ZINC000877813230 1043798747 /nfs/dbraw/zinc/79/87/47/1043798747.db2.gz YBAQTRCHCDXNJY-INIZCTEOSA-N 0 1 324.346 4.040 20 0 DIADMN Cc1ccc(-c2cc(C(=O)N3CCCCCCC3)n[nH]2)c(C)c1 ZINC000777766231 1043799054 /nfs/dbraw/zinc/79/90/54/1043799054.db2.gz XERSWQXGEQRUPC-UHFFFAOYSA-N 0 1 311.429 4.100 20 0 DIADMN Cc1nn(C(C)(C)C)c(C)c1CN1CC[C@](C)(C(F)(F)F)C1 ZINC000877812904 1043799190 /nfs/dbraw/zinc/79/91/90/1043799190.db2.gz 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CC[N@H+](Cc1ccc(-c2ccc(C(=O)[O-])cc2)o1)CC(C)C ZINC000902136293 1045922526 /nfs/dbraw/zinc/92/25/26/1045922526.db2.gz NJOYCDURYOHMFF-UHFFFAOYSA-N 0 1 301.386 4.123 20 0 DIADMN CC[C@H](N[C@@H]1CCCn2nccc21)c1cccc(Cl)c1F ZINC000631810066 1045924669 /nfs/dbraw/zinc/92/46/69/1045924669.db2.gz PXKVLISVWPLDEO-UONOGXRCSA-N 0 1 307.800 4.251 20 0 DIADMN Clc1cc2c(c(Cl)c1)[C@@H](N[C@H]1CCCn3nccc31)CC2 ZINC000631810561 1045924735 /nfs/dbraw/zinc/92/47/35/1045924735.db2.gz VSAFOHHTYHYESU-KBPBESRZSA-N 0 1 322.239 4.302 20 0 DIADMN CC[C@@H](NCc1ccccc1OC1CC1)c1ccccc1OC ZINC000828656523 1045925828 /nfs/dbraw/zinc/92/58/28/1045925828.db2.gz ZUEYDCJELBXHNI-GOSISDBHSA-N 0 1 311.425 4.477 20 0 DIADMN CCC[N@H+](Cc1ccc(/C=C/C(=O)[O-])o1)CC1CCCCC1 ZINC000902169212 1045926815 /nfs/dbraw/zinc/92/68/15/1045926815.db2.gz WSCQLZGETNKQLY-ZHACJKMWSA-N 0 1 305.418 4.170 20 0 DIADMN C[C@H](NCc1ccc(OC2CCCCC2)cc1)c1ccncn1 ZINC000453080739 1045927532 /nfs/dbraw/zinc/92/75/32/1045927532.db2.gz FUPDYFSFSYYTCA-HNNXBMFYSA-N 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CC[C@H](CSc1ccc(C)c(C)c1)N[C@@H]1CCn2ccnc21 ZINC000453178124 1045959142 /nfs/dbraw/zinc/95/91/42/1045959142.db2.gz RYHOQHIXOCYEDA-NVXWUHKLSA-N 0 1 315.486 4.105 20 0 DIADMN CCn1cnc(CN[C@H](c2ccc(Cl)cc2)[C@@H]2C[C@@H]2C)c1 ZINC000902277799 1045961127 /nfs/dbraw/zinc/96/11/27/1045961127.db2.gz KMAFRTONGBGBCG-JCURWCKSSA-N 0 1 303.837 4.043 20 0 DIADMN COc1ccc(F)cc1[C@@H](C)N[C@H](C)c1ccc2c(c1)CCO2 ZINC000193009570 1045961091 /nfs/dbraw/zinc/96/10/91/1045961091.db2.gz ADVVGJVTEGTBIL-CHWSQXEVSA-N 0 1 315.388 4.181 20 0 DIADMN CCn1cnc(CN[C@H](c2ccc(Cl)cc2)[C@H]2C[C@@H]2C)c1 ZINC000902277795 1045961474 /nfs/dbraw/zinc/96/14/74/1045961474.db2.gz KMAFRTONGBGBCG-AFAVFJNCSA-N 0 1 303.837 4.043 20 0 DIADMN C[C@H]1C[N@H+](Cc2ccc(-c3ccc(C(=O)[O-])cc3)o2)CC[C@@H]1C ZINC000902282395 1045963942 /nfs/dbraw/zinc/96/39/42/1045963942.db2.gz RSESPYQAHKHYCM-KBPBESRZSA-N 0 1 313.397 4.123 20 0 DIADMN C[C@@H](NC1(c2ccccc2)CC1)c1cc(-c2ccccc2)nn1C ZINC000453170215 1045965433 /nfs/dbraw/zinc/96/54/33/1045965433.db2.gz GBJGFTZKCOPKBG-MRXNPFEDSA-N 0 1 317.436 4.427 20 0 DIADMN COC(=O)c1ccccc1C[N@@H+](Cc1ccccc1)C(C)(C)C ZINC001137784574 1045966013 /nfs/dbraw/zinc/96/60/13/1045966013.db2.gz YVLBHJNKDMJYMJ-UHFFFAOYSA-N 0 1 311.425 4.274 20 0 DIADMN COC(=O)c1ccccc1C[N@H+]1CCCC[C@@H]1c1ccccc1 ZINC001137784259 1045966490 /nfs/dbraw/zinc/96/64/90/1045966490.db2.gz DXVBKNRFKVMIHZ-LJQANCHMSA-N 0 1 309.409 4.200 20 0 DIADMN COC(=O)c1ccccc1CN1CCCC[C@@H]1c1ccccc1 ZINC001137784259 1045966499 /nfs/dbraw/zinc/96/64/99/1045966499.db2.gz DXVBKNRFKVMIHZ-LJQANCHMSA-N 0 1 309.409 4.200 20 0 DIADMN c1cc([C@@H]2CN(Cc3cccc4ccccc43)CCO2)cs1 ZINC000531833374 1045967466 /nfs/dbraw/zinc/96/74/66/1045967466.db2.gz DGBLMXPVFBQQEA-IBGZPJMESA-N 0 1 309.434 4.475 20 0 DIADMN Brc1ncccc1CN1CC[C@@H](C2CCCCC2)C1 ZINC001137799130 1045969046 /nfs/dbraw/zinc/96/90/46/1045969046.db2.gz IEPJLNOWBPETJM-CQSZACIVSA-N 0 1 323.278 4.246 20 0 DIADMN COc1cccc([C@H](C)N2CCO[C@](C)(c3ccccc3)C2)c1 ZINC000531841460 1045969532 /nfs/dbraw/zinc/96/95/32/1045969532.db2.gz ARXQMNNXKMWTFY-JXFKEZNVSA-N 0 1 311.425 4.004 20 0 DIADMN CC[C@H](C)c1ccc(C(=O)Nc2cnn(-c3ccncc3)c2)cc1 ZINC000755281759 1045970620 /nfs/dbraw/zinc/97/06/20/1045970620.db2.gz VRMUIVMXQLKZFW-AWEZNQCLSA-N 0 1 320.396 4.033 20 0 DIADMN CCCCC[C@H](C(=O)Nc1cnn(-c2ccncc2)c1)C(C)C ZINC000755281712 1045971163 /nfs/dbraw/zinc/97/11/63/1045971163.db2.gz UDLVDRUERAZQAN-KRWDZBQOSA-N 0 1 314.433 4.058 20 0 DIADMN COc1ccccc1CCN(C)Cc1cc(F)ccc1Cl ZINC001138674270 1045972140 /nfs/dbraw/zinc/97/21/40/1045972140.db2.gz MYWHVXLZFTXOQU-UHFFFAOYSA-N 0 1 307.796 4.162 20 0 DIADMN Clc1ncsc1CN1CCC[C@H](Cc2ccccc2)C1 ZINC001137821346 1045973270 /nfs/dbraw/zinc/97/32/70/1045973270.db2.gz LDNKBVMSKREHDV-CQSZACIVSA-N 0 1 306.862 4.251 20 0 DIADMN CCCCCC(CCCCC)NC(=O)c1cncc2nc[nH]c21 ZINC001137820860 1045973583 /nfs/dbraw/zinc/97/35/83/1045973583.db2.gz TVBWNQKJOAUPPU-UHFFFAOYSA-N 0 1 316.449 4.217 20 0 DIADMN CC[C@H](C)c1ccc(C(=O)Nc2cccc(-c3nnc[nH]3)c2)cc1 ZINC000755316855 1045974120 /nfs/dbraw/zinc/97/41/20/1045974120.db2.gz VSHPHWGZYIGEBO-ZDUSSCGKSA-N 0 1 320.396 4.238 20 0 DIADMN CC(C)c1ccc(C[C@@H]2CC[N@@H+](CCC(C)(C)C(=O)[O-])C2)cc1 ZINC000902359705 1045984376 /nfs/dbraw/zinc/98/43/76/1045984376.db2.gz PBUSFYUTLINIDP-KRWDZBQOSA-N 0 1 317.473 4.175 20 0 DIADMN C[C@@H](N[C@@H]1CCCc2c(F)cc(F)cc21)c1cccc(O)c1 ZINC000453229577 1045995367 /nfs/dbraw/zinc/99/53/67/1045995367.db2.gz HELSATSICREYQR-ADLMAVQZSA-N 0 1 303.352 4.399 20 0 DIADMN Cc1cccc(C)c1C[N@H+](CCC(C)(C)C(=O)[O-])CC(C)C ZINC000902433923 1045996161 /nfs/dbraw/zinc/99/61/61/1045996161.db2.gz CSVAAERVYMNDJX-UHFFFAOYSA-N 0 1 305.462 4.262 20 0 DIADMN C[N@H+](Cc1ccc(-c2ccc(C(=O)[O-])cc2)o1)C[C@H]1CC1(C)C ZINC000902454693 1045999608 /nfs/dbraw/zinc/99/96/08/1045999608.db2.gz YULNNEUEYWDSAP-OAHLLOKOSA-N 0 1 313.397 4.123 20 0 DIADMN Cc1cc([C@@H](NC2CC(C)(F)C2)c2cccnc2)ccc1F ZINC000453240215 1045999566 /nfs/dbraw/zinc/99/95/66/1045999566.db2.gz RXQAJCMCZMMGLQ-IIIMJFFVSA-N 0 1 302.368 4.099 20 0 DIADMN Cc1ccc(-c2n[nH]c(NC(=O)c3sc(C)cc3C)c2C)o1 ZINC000633421592 1046001346 /nfs/dbraw/zinc/00/13/46/1046001346.db2.gz GRYPJABQBWNONZ-UHFFFAOYSA-N 0 1 315.398 4.217 20 0 DIADMN Cc1nnsc1CN[C@@H](c1ccc(Cl)cc1)C1CCC1 ZINC000453248065 1046002871 /nfs/dbraw/zinc/00/28/71/1046002871.db2.gz XFUGONFZPFCFGS-OAHLLOKOSA-N 0 1 307.850 4.131 20 0 DIADMN CCC[C@@H](CN[C@@H](C)c1nc(-c2ccccc2)cs1)OC ZINC000453251685 1046003547 /nfs/dbraw/zinc/00/35/47/1046003547.db2.gz NRMOICGBSKFPOO-ZFWWWQNUSA-N 0 1 304.459 4.276 20 0 DIADMN CCc1oc(C[N@@H+](C2CC2)C2CCC(C)CC2)cc1C(=O)[O-] ZINC000902513282 1046008803 /nfs/dbraw/zinc/00/88/03/1046008803.db2.gz VIQPQASMZMRFMU-UHFFFAOYSA-N 0 1 305.418 4.083 20 0 DIADMN O=C([O-])c1cccc2c(C[N@H+]3CCC[C@@H]3C3CCCC3)ccnc12 ZINC000902513450 1046009278 /nfs/dbraw/zinc/00/92/78/1046009278.db2.gz XFCWMOYXPKNMLW-GOSISDBHSA-N 0 1 324.424 4.088 20 0 DIADMN CC[N@@H+](Cc1ccc(-c2ccccc2C(=O)[O-])o1)C1CCCC1 ZINC000902509367 1046010044 /nfs/dbraw/zinc/01/00/44/1046010044.db2.gz CCZLNHVWIMLKHT-UHFFFAOYSA-N 0 1 313.397 4.409 20 0 DIADMN CCCC[N@@H+](Cc1ccc(-c2ccc(C(=O)[O-])cc2)o1)C1CC1 ZINC000902512783 1046010152 /nfs/dbraw/zinc/01/01/52/1046010152.db2.gz MBGFESDYQOGGJO-UHFFFAOYSA-N 0 1 313.397 4.409 20 0 DIADMN O=C([O-])/C=C/c1ccc(C[N@H+]2CCC[C@@H]2CC2CCCCC2)o1 ZINC000902518231 1046011177 /nfs/dbraw/zinc/01/11/77/1046011177.db2.gz DIAQNWQAHCSNBZ-SIFUEBAJSA-N 0 1 317.429 4.312 20 0 DIADMN CCC[C@@H](C)[N@@H+](C)Cc1ccc(C(=O)[O-])cc1C(F)(F)F ZINC000902524548 1046011428 /nfs/dbraw/zinc/01/14/28/1046011428.db2.gz VNMGFEQVZDVQAF-SNVBAGLBSA-N 0 1 303.324 4.024 20 0 DIADMN Cc1cccc([C@H]2CCCC[N@H+]2CCC(C)(C)C(=O)[O-])c1C ZINC000902521828 1046012158 /nfs/dbraw/zinc/01/21/58/1046012158.db2.gz RARNTUFPXHEBKN-QGZVFWFLSA-N 0 1 303.446 4.331 20 0 DIADMN C[C@@H]([N@@H+](C)Cc1ccc(-c2ccc(C(=O)[O-])cc2)o1)C1(C)CC1 ZINC000902524092 1046012477 /nfs/dbraw/zinc/01/24/77/1046012477.db2.gz OMUMPIHSHHCIKS-CYBMUJFWSA-N 0 1 313.397 4.265 20 0 DIADMN C[C@@H]1C[C@@H]2CCCC[C@@H]2[N@H+]1Cc1ccnc2c(C(=O)[O-])cccc12 ZINC000902519288 1046012574 /nfs/dbraw/zinc/01/25/74/1046012574.db2.gz URFWSIXIZBGGTJ-GLJUWKHASA-N 0 1 324.424 4.086 20 0 DIADMN CC(C)(CC[N@H+]1CCCCC[C@H]1/C=C\c1ccccc1)C(=O)[O-] ZINC000902524778 1046013359 /nfs/dbraw/zinc/01/33/59/1046013359.db2.gz AKXXKSAYQSPYQJ-SQVRQVGWSA-N 0 1 315.457 4.445 20 0 DIADMN CC(C)(CC[N@H+]1CCCCC[C@@H]1/C=C/c1ccccc1)C(=O)[O-] ZINC000902524776 1046013490 /nfs/dbraw/zinc/01/34/90/1046013490.db2.gz AKXXKSAYQSPYQJ-QFQMRYFISA-N 0 1 315.457 4.445 20 0 DIADMN O=C([O-])/C=C\c1ccc(C[N@H+]2CCC[C@H]2CC2CCCCC2)o1 ZINC000902518232 1046013650 /nfs/dbraw/zinc/01/36/50/1046013650.db2.gz DIAQNWQAHCSNBZ-SNGWPZLWSA-N 0 1 317.429 4.312 20 0 DIADMN CCCN(CCOC)Cc1cc2cc(C)ccc2nc1Cl ZINC001137918571 1046014180 /nfs/dbraw/zinc/01/41/80/1046014180.db2.gz IHZQVWKVLKLSAT-UHFFFAOYSA-N 0 1 306.837 4.055 20 0 DIADMN COc1ncc(CN[C@@H]2CC(C)(C)Cc3occc32)cc1Cl ZINC000453283389 1046014325 /nfs/dbraw/zinc/01/43/25/1046014325.db2.gz FJJOZCSQMJOMJM-CQSZACIVSA-N 0 1 320.820 4.140 20 0 DIADMN CC[C@@H]1CC[C@@H](C)[N@H+]1Cc1ccc(-c2ccc(C(=O)[O-])cc2)o1 ZINC000902527838 1046014206 /nfs/dbraw/zinc/01/42/06/1046014206.db2.gz MGVHLIOXFBUDAQ-CZUORRHYSA-N 0 1 313.397 4.408 20 0 DIADMN C[C@@H](c1ccc(Cl)cc1)[C@H](C)[N@@H+](C)CCC(C)(C)C(=O)[O-] ZINC000902526127 1046014316 /nfs/dbraw/zinc/01/43/16/1046014316.db2.gz WCNUYXCVXJYVOK-OLZOCXBDSA-N 0 1 311.853 4.265 20 0 DIADMN COC[C@H]1CCCCN1Cc1cc2cc(C)ccc2nc1Cl ZINC001137918681 1046014286 /nfs/dbraw/zinc/01/42/86/1046014286.db2.gz LTBOSMMTDXJIPH-MRXNPFEDSA-N 0 1 318.848 4.198 20 0 DIADMN CC(C)(CC[N@H+]1CCCC[C@H]1CCCc1ccccc1)C(=O)[O-] ZINC000902532004 1046014592 /nfs/dbraw/zinc/01/45/92/1046014592.db2.gz YCWSIVOWXCFWPK-SFHVURJKSA-N 0 1 317.473 4.365 20 0 DIADMN C[C@H]1CC(C)(C)C[N@H+]1Cc1ccc(C(=O)[O-])cc1C(F)(F)F ZINC000902530989 1046015004 /nfs/dbraw/zinc/01/50/04/1046015004.db2.gz BPQGESUACHTTEG-JTQLQIEISA-N 0 1 315.335 4.024 20 0 DIADMN Cc1ccc([C@@H]2CCC[C@@H]2[N@@H+](C)CCC(C)(C)C(=O)[O-])cc1 ZINC000902530734 1046015072 /nfs/dbraw/zinc/01/50/72/1046015072.db2.gz BKUSKULJIYDPHE-IRXDYDNUSA-N 0 1 303.446 4.064 20 0 DIADMN C[C@@H]1CCCCC[N@H+]1Cc1ccc(-c2ccc(C(=O)[O-])cc2)o1 ZINC000902531865 1046015205 /nfs/dbraw/zinc/01/52/05/1046015205.db2.gz INAJIBSYOUKCRU-CQSZACIVSA-N 0 1 313.397 4.409 20 0 DIADMN CC(C)(CC[N@H+]1CCCC[C@H]1c1cccc(Cl)c1)C(=O)[O-] ZINC000902531210 1046015806 /nfs/dbraw/zinc/01/58/06/1046015806.db2.gz FFDRYQVOYCUNDD-HNNXBMFYSA-N 0 1 309.837 4.368 20 0 DIADMN COCC1CCN(Cc2cc3cc(C)ccc3nc2Cl)CC1 ZINC001137918745 1046016037 /nfs/dbraw/zinc/01/60/37/1046016037.db2.gz NVHFTMUTKIKASG-UHFFFAOYSA-N 0 1 318.848 4.055 20 0 DIADMN Cc1ccc([C@@H]2[C@@H](C)CCC[N@H+]2CCC(C)(C)C(=O)[O-])cc1 ZINC000902530884 1046016024 /nfs/dbraw/zinc/01/60/24/1046016024.db2.gz SCFIPVRKOBIBTL-RDJZCZTQSA-N 0 1 303.446 4.269 20 0 DIADMN C[C@@H]1CCC[N@@H+](Cc2ccc(-c3ccccc3C(=O)[O-])o2)[C@H]1C ZINC000902531542 1046016362 /nfs/dbraw/zinc/01/63/62/1046016362.db2.gz VRSMPTXYSWLAPL-KGLIPLIRSA-N 0 1 313.397 4.265 20 0 DIADMN CCc1oc(C[N@H+](CC)[C@@H](C)Cc2ccsc2)cc1C(=O)[O-] ZINC000902530604 1046016494 /nfs/dbraw/zinc/01/64/94/1046016494.db2.gz PDIHZPJVKMYSNT-LBPRGKRZSA-N 0 1 321.442 4.055 20 0 DIADMN CC(C)c1ccc([C@H]2CCC[N@H+]2CCC(C)(C)C(=O)[O-])cc1 ZINC000902544943 1046017901 /nfs/dbraw/zinc/01/79/01/1046017901.db2.gz OESBSTPLLJOTFJ-QGZVFWFLSA-N 0 1 303.446 4.448 20 0 DIADMN Cc1ccc([C@H](NCc2nnc(C(C)C)[nH]2)C2CCCC2)cc1 ZINC000453292837 1046017984 /nfs/dbraw/zinc/01/79/84/1046017984.db2.gz OVFWSCLQCSLODE-GOSISDBHSA-N 0 1 312.461 4.258 20 0 DIADMN CCC[C@H](NCc1cnc(OC)c(Cl)c1)c1ccsc1 ZINC000453301158 1046020014 /nfs/dbraw/zinc/02/00/14/1046020014.db2.gz WQTGTJHQLMAZKP-AWEZNQCLSA-N 0 1 310.850 4.436 20 0 DIADMN CC[C@](C)(CN[C@H](C)c1csc(-c2ccccc2F)n1)OC ZINC000453297902 1046021670 /nfs/dbraw/zinc/02/16/70/1046021670.db2.gz IHQZXRILYAJLHM-SJKOYZFVSA-N 0 1 322.449 4.415 20 0 DIADMN CNc1ccc(C)cc1CN[C@@H](COC)c1cccc(Cl)c1 ZINC000902570597 1046025641 /nfs/dbraw/zinc/02/56/41/1046025641.db2.gz USGHHYLYDXZALA-SFHVURJKSA-N 0 1 318.848 4.167 20 0 DIADMN O=S(=O)(Nc1cnc(-c2ccccc2)s1)C1=CCCCC1 ZINC000829902707 1046026632 /nfs/dbraw/zinc/02/66/32/1046026632.db2.gz NVIRAAYGWIGTIX-UHFFFAOYSA-N 0 1 320.439 4.010 20 0 DIADMN CC[C@@](C)(CN[C@@H](c1cc2ccccc2o1)c1cccnc1)OC ZINC000453308179 1046028539 /nfs/dbraw/zinc/02/85/39/1046028539.db2.gz WCRBKZVPOQSCOY-UXHICEINSA-N 0 1 324.424 4.322 20 0 DIADMN FC(F)(F)Sc1ccc(CN2CCC[C@@]3(CCO3)C2)cc1 ZINC001137955067 1046030003 /nfs/dbraw/zinc/03/00/03/1046030003.db2.gz FFCKKGNQQLJLFA-CQSZACIVSA-N 0 1 317.376 4.053 20 0 DIADMN FC(F)(F)Sc1ccc(CN2CC(c3cccnc3)C2)cc1 ZINC001137955247 1046033627 /nfs/dbraw/zinc/03/36/27/1046033627.db2.gz OFEZROTZHXSYJW-UHFFFAOYSA-N 0 1 324.371 4.293 20 0 DIADMN CNc1ccc(C)cc1CNCc1cccc(OC2CC2)c1F ZINC000902616185 1046034428 /nfs/dbraw/zinc/03/44/28/1046034428.db2.gz ACWSIDULFCETFN-UHFFFAOYSA-N 0 1 314.404 4.007 20 0 DIADMN COc1ccccc1[C@H]1CCN(Cc2ccc(C)c(F)c2F)C1 ZINC001137965030 1046035027 /nfs/dbraw/zinc/03/50/27/1046035027.db2.gz XKNHILBBMFXGNE-AWEZNQCLSA-N 0 1 317.379 4.271 20 0 DIADMN CCNc1ccccc1CNCc1ccc(OC(F)F)cc1F ZINC000902634496 1046037700 /nfs/dbraw/zinc/03/77/00/1046037700.db2.gz KSBPBSHLPBQRBX-UHFFFAOYSA-N 0 1 324.346 4.149 20 0 DIADMN CNc1ccc(C)cc1CNCc1ccsc1C(F)(F)F ZINC000902626723 1046038999 /nfs/dbraw/zinc/03/89/99/1046038999.db2.gz MLWHPIBLECAKMO-UHFFFAOYSA-N 0 1 314.376 4.407 20 0 DIADMN CO[C@](C)(CN[C@@H](C)c1csc(C(C)C)n1)c1ccccc1 ZINC000453328628 1046039150 /nfs/dbraw/zinc/03/91/50/1046039150.db2.gz VCYOWXJILNIZOI-KBXCAEBGSA-N 0 1 318.486 4.479 20 0 DIADMN CO[C@@](C)(CN[C@H](C)c1csc(C(C)C)n1)c1ccccc1 ZINC000453328630 1046039617 /nfs/dbraw/zinc/03/96/17/1046039617.db2.gz VCYOWXJILNIZOI-KDOFPFPSSA-N 0 1 318.486 4.479 20 0 DIADMN CC(C)(NCc1cnc([C@H]2CCCO2)s1)c1ccc(F)cc1 ZINC000756025499 1046039685 /nfs/dbraw/zinc/03/96/85/1046039685.db2.gz JINQLFXEMDRHDZ-OAHLLOKOSA-N 0 1 320.433 4.159 20 0 DIADMN Cc1csc(CN2CCC[C@H]2COc2ccc(Cl)cc2)n1 ZINC000756035119 1046042810 /nfs/dbraw/zinc/04/28/10/1046042810.db2.gz DMZIGMBHXALZAS-AWEZNQCLSA-N 0 1 322.861 4.148 20 0 DIADMN Cc1ccc2[nH]c3c(c2c1)CCC[C@@H]3N[C@@H]1C[C@@H](C)n2ccnc21 ZINC000453340927 1046044116 /nfs/dbraw/zinc/04/41/16/1046044116.db2.gz HIKUKFIWINKICV-JEBQAFNWSA-N 0 1 320.440 4.346 20 0 DIADMN COc1ccc(Cl)cc1[C@@H](C)NCc1cnc(C)cc1C ZINC000453345714 1046047977 /nfs/dbraw/zinc/04/79/77/1046047977.db2.gz FMTCLKZAHGJUFS-CYBMUJFWSA-N 0 1 304.821 4.211 20 0 DIADMN COc1ccc(Cl)cc1[C@H](C)NCc1cnc(C)cc1C ZINC000453345721 1046048083 /nfs/dbraw/zinc/04/80/83/1046048083.db2.gz FMTCLKZAHGJUFS-ZDUSSCGKSA-N 0 1 304.821 4.211 20 0 DIADMN COc1ccc(F)c(CN(C)CCc2cccc(Cl)c2)c1 ZINC001137996198 1046049936 /nfs/dbraw/zinc/04/99/36/1046049936.db2.gz AZQBECUJQPMLAL-UHFFFAOYSA-N 0 1 307.796 4.162 20 0 DIADMN CCn1ccnc1[C@@H](C)N[C@@H]1CCCc2c3ccccc3[nH]c21 ZINC000453346599 1046050653 /nfs/dbraw/zinc/05/06/53/1046050653.db2.gz KMHJQOBJCCXYNA-CXAGYDPISA-N 0 1 308.429 4.113 20 0 DIADMN CC[C@H](C)c1ccc([C@H](N[C@@H](C)c2cn(C)nn2)C(C)C)cc1 ZINC000902728952 1046051881 /nfs/dbraw/zinc/05/18/81/1046051881.db2.gz CSCBWUGLKZMADI-YZVOILCLSA-N 0 1 314.477 4.377 20 0 DIADMN C[C@@H]1CC[C@H](C)[N@@H+]1Cc1nc(-c2cccc(C(C)(F)F)c2)no1 ZINC000453356561 1046054091 /nfs/dbraw/zinc/05/40/91/1046054091.db2.gz LWKSVEALDXDQOV-TXEJJXNPSA-N 0 1 321.371 4.221 20 0 DIADMN C[C@@H]1CC[C@H](C)N1Cc1nc(-c2cccc(C(C)(F)F)c2)no1 ZINC000453356561 1046054107 /nfs/dbraw/zinc/05/41/07/1046054107.db2.gz LWKSVEALDXDQOV-TXEJJXNPSA-N 0 1 321.371 4.221 20 0 DIADMN COCc1ccccc1CN[C@@H](C)c1ccc(C(F)(F)F)cn1 ZINC000902733032 1046054699 /nfs/dbraw/zinc/05/46/99/1046054699.db2.gz MHGPSQFOCFUTBL-LBPRGKRZSA-N 0 1 324.346 4.098 20 0 DIADMN C[C@H]1CC[C@H](C)N1Cc1nc(-c2cccc(C(C)(F)F)c2)no1 ZINC000453356558 1046054738 /nfs/dbraw/zinc/05/47/38/1046054738.db2.gz LWKSVEALDXDQOV-RYUDHWBXSA-N 0 1 321.371 4.221 20 0 DIADMN COc1cccnc1CN[C@@H](c1cccs1)C1CCCC1 ZINC000453359334 1046056762 /nfs/dbraw/zinc/05/67/62/1046056762.db2.gz JTFMMQOKCQRHGV-QGZVFWFLSA-N 0 1 302.443 4.173 20 0 DIADMN Cc1csc(CN[C@H](CCc2cccnc2)c2ccccc2)n1 ZINC000902736717 1046057170 /nfs/dbraw/zinc/05/71/70/1046057170.db2.gz WJPCHIUGGIZKDG-GOSISDBHSA-N 0 1 323.465 4.310 20 0 DIADMN Cc1ccc(CN2CCC(=O)[C@@H]3CCCC[C@@H]32)c2ccccc12 ZINC001138012925 1046057247 /nfs/dbraw/zinc/05/72/47/1046057247.db2.gz GANYZKCLUUKGJB-UXHICEINSA-N 0 1 307.437 4.482 20 0 DIADMN Cc1ccc(CN[C@@H](C)c2ccc(C(F)(F)F)cn2)s1 ZINC000902750856 1046058029 /nfs/dbraw/zinc/05/80/29/1046058029.db2.gz MXSYJCNSSCKOQB-JTQLQIEISA-N 0 1 300.349 4.321 20 0 DIADMN CC[C@@H](N[C@H](C)c1cnn(CC)c1)c1cc(Cl)ccc1OC ZINC000453381878 1046060025 /nfs/dbraw/zinc/06/00/25/1046060025.db2.gz RKZOJBOXPTTXCZ-MLGOLLRUSA-N 0 1 321.852 4.367 20 0 DIADMN Cc1cc(C)c(CN[C@@H](C)c2ccccc2OC(F)(F)F)cn1 ZINC000453382702 1046060116 /nfs/dbraw/zinc/06/01/16/1046060116.db2.gz YDAXZLVITMUENG-ZDUSSCGKSA-N 0 1 324.346 4.448 20 0 DIADMN FC(F)(F)SCCNCc1csc(-c2ccsc2)n1 ZINC000193691049 1046060753 /nfs/dbraw/zinc/06/07/53/1046060753.db2.gz ZWYQDHGUGSOSSH-UHFFFAOYSA-N 0 1 324.418 4.214 20 0 DIADMN Cc1noc(C)c1CN[C@@H](CCc1cccnc1)c1ccccc1 ZINC000902764637 1046064557 /nfs/dbraw/zinc/06/45/57/1046064557.db2.gz HGRIJHPPURIKRS-FQEVSTJZSA-N 0 1 321.424 4.150 20 0 DIADMN CCc1ncc(CN[C@H](c2cccc(C(F)(F)F)c2)C2CC2)o1 ZINC000453363901 1046066017 /nfs/dbraw/zinc/06/60/17/1046066017.db2.gz GIJHGVSSHGCMOY-INIZCTEOSA-N 0 1 324.346 4.497 20 0 DIADMN CCSc1ccccc1[C@@H](C)N[C@@H](C)c1cnn(CC)c1 ZINC000453365386 1046067123 /nfs/dbraw/zinc/06/71/23/1046067123.db2.gz LXUKMTOYLQTVSQ-UONOGXRCSA-N 0 1 303.475 4.427 20 0 DIADMN Cc1cc(C)c(CN[C@H]2CCCOc3cc4c(cc32)CCC4)cn1 ZINC000453369355 1046068777 /nfs/dbraw/zinc/06/87/77/1046068777.db2.gz QSMYNUANASJXJH-FQEVSTJZSA-N 0 1 322.452 4.191 20 0 DIADMN C[C@@H]1C[C@H](c2ccccc2)[C@H](C)N1Cc1nnc(C(C)(C)C)o1 ZINC000830434243 1046069302 /nfs/dbraw/zinc/06/93/02/1046069302.db2.gz IMGSMIZTUYVOBP-YCPHGPKFSA-N 0 1 313.445 4.134 20 0 DIADMN Cc1ncccc1CNC(C)(c1ccccc1)c1ccccc1 ZINC000237588776 1046072065 /nfs/dbraw/zinc/07/20/65/1046072065.db2.gz BASBJVWYWASKJK-UHFFFAOYSA-N 0 1 302.421 4.443 20 0 DIADMN CCc1cc(CN[C@H](CCc2cccnc2)c2ccccc2)on1 ZINC000902817347 1046075816 /nfs/dbraw/zinc/07/58/16/1046075816.db2.gz ZWEKPIBOFJTNHW-HXUWFJFHSA-N 0 1 321.424 4.096 20 0 DIADMN CC(C)[C@@H]1CCC2=NN(c3nccc4sccc43)C(=O)[C@H]2C1 ZINC000634596319 1046077664 /nfs/dbraw/zinc/07/76/64/1046077664.db2.gz CDHZWHYLZAEXLW-YPMHNXCESA-N 0 1 313.426 4.071 20 0 DIADMN Cc1noc(C)c1CN(C)[C@@H](C)c1ccc(OC(F)F)cc1 ZINC000080722230 1046078865 /nfs/dbraw/zinc/07/88/65/1046078865.db2.gz DXZKUUOOVBMFKZ-NSHDSACASA-N 0 1 310.344 4.086 20 0 DIADMN Oc1ccc(CN2CCC[C@@H]2c2nccs2)c2ccccc12 ZINC001138060924 1046079483 /nfs/dbraw/zinc/07/94/83/1046079483.db2.gz BOMZOSGJUDAWKA-MRXNPFEDSA-N 0 1 310.422 4.339 20 0 DIADMN CCc1cnc(CN[C@H]2C[C@@H](C)Cc3cc(OC)ccc32)s1 ZINC000902826721 1046080728 /nfs/dbraw/zinc/08/07/28/1046080728.db2.gz URGFYPAUNKPJCY-SJCJKPOMSA-N 0 1 316.470 4.127 20 0 DIADMN CC(C)(CN[C@H](c1ncc[nH]1)c1ccc(F)cc1)C1=CCCC1 ZINC000453409615 1046080841 /nfs/dbraw/zinc/08/08/41/1046080841.db2.gz WOXFQTVHNBYPSK-KRWDZBQOSA-N 0 1 313.420 4.364 20 0 DIADMN Cc1cccc(C[C@@]2(C)CCC[N@H+]2CCCCCC(=O)[O-])c1 ZINC000634697484 1046086008 /nfs/dbraw/zinc/08/60/08/1046086008.db2.gz KQMCJFGHSVXZJD-LJQANCHMSA-N 0 1 303.446 4.037 20 0 DIADMN CCC1(CC)CCC[N@H+]([C@@H](C(=O)[O-])c2cccc(OC)c2)CC1 ZINC000634691875 1046086317 /nfs/dbraw/zinc/08/63/17/1046086317.db2.gz QBWHHRNYHSHQEV-QGZVFWFLSA-N 0 1 319.445 4.113 20 0 DIADMN CCc1cc(CN[C@H](CC)c2ccc(Br)cc2)on1 ZINC000532232505 1046122292 /nfs/dbraw/zinc/12/22/92/1046122292.db2.gz HLLJUKUSJAQJSR-OAHLLOKOSA-N 0 1 323.234 4.240 20 0 DIADMN CC1(C)C[C@@H](CN[C@@H](CCc2ccccc2)C(F)F)CCO1 ZINC000453449215 1046088752 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INLVQLUSKXELIS-LBPRGKRZSA-N 0 1 317.820 4.327 20 0 DIADMN COc1ccccc1-c1nc(CN2CCC3(CC3)CC2)cs1 ZINC000677718065 1046515757 /nfs/dbraw/zinc/51/57/57/1046515757.db2.gz VNUNWQSYHHHVDP-UHFFFAOYSA-N 0 1 314.454 4.195 20 0 DIADMN Cc1cccc(C(C)C)c1NC(=O)[C@@H](C)N1CCC2(CC2)CC1 ZINC000677718873 1046516283 /nfs/dbraw/zinc/51/62/83/1046516283.db2.gz LFRFBNVGWBMHFI-MRXNPFEDSA-N 0 1 314.473 4.321 20 0 DIADMN Cc1ccc(-c2noc([C@@H](C)N3CCC4(CC4)CC3)n2)cc1F ZINC000677717071 1046516535 /nfs/dbraw/zinc/51/65/35/1046516535.db2.gz DLSHDUDIGQTCHG-CYBMUJFWSA-N 0 1 315.392 4.121 20 0 DIADMN C[C@H](c1ccco1)N(C)Cc1c[nH]nc1-c1c(F)cccc1F ZINC000131053576 1046518218 /nfs/dbraw/zinc/51/82/18/1046518218.db2.gz OPDWPAXPCMJHLA-LLVKDONJSA-N 0 1 317.339 4.141 20 0 DIADMN FC(F)[C@H]1CCN(Cc2cc(-c3ccc(Cl)cc3)no2)C1 ZINC000677730236 1046518666 /nfs/dbraw/zinc/51/86/66/1046518666.db2.gz AVUVEGHGWLVXAQ-NSHDSACASA-N 0 1 312.747 4.082 20 0 DIADMN Cc1ccccc1NC(=O)[C@@H](C)N1CCC(c2ccccc2)CC1 ZINC000641857634 1046518880 /nfs/dbraw/zinc/51/88/80/1046518880.db2.gz QGXSZKQYNLUGLN-QGZVFWFLSA-N 0 1 322.452 4.202 20 0 DIADMN Cc1ccc(NC(=O)CN2CCC(c3ccccc3)CC2)c(C)c1 ZINC000641855657 1046518911 /nfs/dbraw/zinc/51/89/11/1046518911.db2.gz MVEDJTWABBNJOL-UHFFFAOYSA-N 0 1 322.452 4.122 20 0 DIADMN Cc1ccccc1NC(=O)[C@H](C)N1CCC(c2ccccc2)CC1 ZINC000641857633 1046519364 /nfs/dbraw/zinc/51/93/64/1046519364.db2.gz QGXSZKQYNLUGLN-KRWDZBQOSA-N 0 1 322.452 4.202 20 0 DIADMN FC(F)c1ccccc1CN1CCC[C@@H](Oc2cccnc2)C1 ZINC001139799991 1046519340 /nfs/dbraw/zinc/51/93/40/1046519340.db2.gz ATYWMOVVVFOGKU-MRXNPFEDSA-N 0 1 318.367 4.063 20 0 DIADMN COCc1ccc(CN2CCCC[C@H]2c2cccnc2)s1 ZINC001139827046 1046527618 /nfs/dbraw/zinc/52/76/18/1046527618.db2.gz MBLOWUYSBJJPHV-KRWDZBQOSA-N 0 1 302.443 4.017 20 0 DIADMN COCc1ccc(CN2CCSC[C@H]2c2ccccc2)s1 ZINC001139827498 1046527772 /nfs/dbraw/zinc/52/77/72/1046527772.db2.gz YXMUNWLKZPGHHF-KRWDZBQOSA-N 0 1 319.495 4.185 20 0 DIADMN Cc1n[nH]c(C(C)C)c1C(=O)N(C)Cc1ccc(C(C)C)cc1 ZINC000677845884 1046529382 /nfs/dbraw/zinc/52/93/82/1046529382.db2.gz FVSNJSDINKLUDV-UHFFFAOYSA-N 0 1 313.445 4.237 20 0 DIADMN COc1nc(C)cc(C)c1CN[C@@H]1CCc2ccc(Cl)cc21 ZINC000677846782 1046530318 /nfs/dbraw/zinc/53/03/18/1046530318.db2.gz WNZJWAQVHINPFZ-QGZVFWFLSA-N 0 1 316.832 4.138 20 0 DIADMN c1ccc2c(c1)sc1c2cccc1CN1CC2(C1)CCCO2 ZINC001139843530 1046531533 /nfs/dbraw/zinc/53/15/33/1046531533.db2.gz ZCNPRZVZOUHTPK-UHFFFAOYSA-N 0 1 309.434 4.419 20 0 DIADMN CC(C)CO[C@H]1CCN(Cc2cc(Cl)nc3ccccc23)C1 ZINC000782509716 1046532316 /nfs/dbraw/zinc/53/23/16/1046532316.db2.gz AKCFNHWOBNVEKN-HNNXBMFYSA-N 0 1 318.848 4.135 20 0 DIADMN CC(C)(NCc1cncn1Cc1ccccc1)c1ccc(F)cc1 ZINC000782513576 1046532591 /nfs/dbraw/zinc/53/25/91/1046532591.db2.gz UIKPQPCZWIQHFF-UHFFFAOYSA-N 0 1 323.415 4.095 20 0 DIADMN c1ccc2c(c1)sc1c2cccc1CN1CCOC2(CC2)C1 ZINC001139843562 1046532718 /nfs/dbraw/zinc/53/27/18/1046532718.db2.gz AQNXULULVASNQM-UHFFFAOYSA-N 0 1 309.434 4.419 20 0 DIADMN Cc1cc(CNc2ccc3c[nH]nc3c2)ccc1Br ZINC000091469456 1046533297 /nfs/dbraw/zinc/53/32/97/1046533297.db2.gz VKNAZRNJZWISRW-UHFFFAOYSA-N 0 1 316.202 4.246 20 0 DIADMN COc1ccc2c(c1)[C@H](NCc1cccc(Cl)c1)CCCO2 ZINC000132490279 1046533380 /nfs/dbraw/zinc/53/33/80/1046533380.db2.gz MCIZHSATUBFQNJ-QGZVFWFLSA-N 0 1 317.816 4.352 20 0 DIADMN COc1cccc([C@H]2CCCN(Cc3ccncc3Cl)C2)c1 ZINC001139849767 1046534818 /nfs/dbraw/zinc/53/48/18/1046534818.db2.gz SPBWVMCTOUDCAP-HNNXBMFYSA-N 0 1 316.832 4.123 20 0 DIADMN COc1ccc(CN2CCC[C@@H]2c2ccc(O)cc2)cc1Cl ZINC000677893535 1046535766 /nfs/dbraw/zinc/53/57/66/1046535766.db2.gz RJNWBDPSLNYVKX-QGZVFWFLSA-N 0 1 317.816 4.391 20 0 DIADMN Cc1ccc([C@@H]2CCCN2Cc2cc3ccccc3n2C)cn1 ZINC001139872147 1046537379 /nfs/dbraw/zinc/53/73/79/1046537379.db2.gz HKVXLOCJIYGDJR-FQEVSTJZSA-N 0 1 305.425 4.219 20 0 DIADMN Cc1ccccc1-c1noc(CN2CCCC3(CCCC3)C2)n1 ZINC000782638939 1046537974 /nfs/dbraw/zinc/53/79/74/1046537974.db2.gz SPBUKOIBADOGBG-UHFFFAOYSA-N 0 1 311.429 4.201 20 0 DIADMN Cn1c(CN2CCSC[C@@H]2c2ccccc2)cc2ccccc21 ZINC001139871814 1046538028 /nfs/dbraw/zinc/53/80/28/1046538028.db2.gz RVLWQECHHHMVPK-HXUWFJFHSA-N 0 1 322.477 4.468 20 0 DIADMN Cc1cccc(CN[C@H](C)c2cccc(Br)c2)n1 ZINC000051574146 1046538260 /nfs/dbraw/zinc/53/82/60/1046538260.db2.gz GNSGYWCDSLNJGW-GFCCVEGCSA-N 0 1 305.219 4.003 20 0 DIADMN CC1(C)Cc2cccc(CN3CCC[C@@H]3c3ccccn3)c2O1 ZINC000536629469 1046538678 /nfs/dbraw/zinc/53/86/78/1046538678.db2.gz PSIWTXSNLHQJNT-GOSISDBHSA-N 0 1 308.425 4.132 20 0 DIADMN CCOc1ccc2c(c1)[C@H](NCc1ccc3[nH]ccc3c1)CCO2 ZINC000655759919 1046538821 /nfs/dbraw/zinc/53/88/21/1046538821.db2.gz UFVSCCORLMOUSY-LJQANCHMSA-N 0 1 322.408 4.180 20 0 DIADMN Cc1ccc(CN(C)Cc2cccc(O)c2)cc1Br ZINC000536626437 1046538907 /nfs/dbraw/zinc/53/89/07/1046538907.db2.gz BYBPMKRWPQVGDF-UHFFFAOYSA-N 0 1 320.230 4.095 20 0 DIADMN FC(F)(F)c1ccccc1C1=CCN(Cc2ccncc2)CC1 ZINC000133419945 1046539634 /nfs/dbraw/zinc/53/96/34/1046539634.db2.gz BMQBDJOQGSYSHX-UHFFFAOYSA-N 0 1 318.342 4.390 20 0 DIADMN CSCCCN[C@H](c1cccc(Cl)c1)c1ccccn1 ZINC000133764671 1046542655 /nfs/dbraw/zinc/54/26/55/1046542655.db2.gz FDHBVZBVPSEGBM-MRXNPFEDSA-N 0 1 306.862 4.167 20 0 DIADMN Cc1ccc([C@H](NC[C@@H](C)CO)c2ccc(F)cc2Cl)cc1 ZINC000678027392 1046543689 /nfs/dbraw/zinc/54/36/89/1046543689.db2.gz AJQNLWGKUYPKGW-ACJLOTCBSA-N 0 1 321.823 4.095 20 0 DIADMN Cc1ccc(C(F)(F)F)cc1C[N@H+]1CC[C@H]2O[C@@H](C)C[C@H]2C1 ZINC001139887833 1046544837 /nfs/dbraw/zinc/54/48/37/1046544837.db2.gz GYMULYXGWABHDV-DUVNUKRYSA-N 0 1 313.363 4.013 20 0 DIADMN COC[C@@H]1CCCCN1Cc1cc(C(F)(F)F)ccc1C ZINC001139888659 1046545887 /nfs/dbraw/zinc/54/58/87/1046545887.db2.gz XVRVZPGQOWLFBG-HNNXBMFYSA-N 0 1 301.352 4.015 20 0 DIADMN Cc1ccc(CN(C)Cc2cc(C(F)(F)F)ccc2C)cn1 ZINC001139888873 1046546670 /nfs/dbraw/zinc/54/66/70/1046546670.db2.gz NYFBKYDEFSJBCM-UHFFFAOYSA-N 0 1 308.347 4.349 20 0 DIADMN Cc1cccc(C(C)C)c1NC(=O)[C@@H](C)N1CCCCCC1 ZINC000052856778 1046548763 /nfs/dbraw/zinc/54/87/63/1046548763.db2.gz BYTSJMRUDPANQA-MRXNPFEDSA-N 0 1 302.462 4.321 20 0 DIADMN Cc1cc([C@@H](C)NCc2cccc3c2OCCO3)cc(C)c1F ZINC000237336674 1046551420 /nfs/dbraw/zinc/55/14/20/1046551420.db2.gz GQQARFRCGVWLFY-CQSZACIVSA-N 0 1 315.388 4.065 20 0 DIADMN CCc1cnccc1[C@@H](C)NCc1cc(Cl)nc(Cl)c1 ZINC000783017626 1046551873 /nfs/dbraw/zinc/55/18/73/1046551873.db2.gz VZYLJSXSJQJEJO-SNVBAGLBSA-N 0 1 310.228 4.197 20 0 DIADMN CSC[C@H]1CCCN1Cc1nc(-c2cccs2)oc1C ZINC000135435346 1046555413 /nfs/dbraw/zinc/55/54/13/1046555413.db2.gz BLYVXOAOINZMPQ-GFCCVEGCSA-N 0 1 308.472 4.039 20 0 DIADMN CSC[C@@H]1CCCN1Cc1nc(-c2cccs2)oc1C ZINC000135435371 1046555553 /nfs/dbraw/zinc/55/55/53/1046555553.db2.gz BLYVXOAOINZMPQ-LBPRGKRZSA-N 0 1 308.472 4.039 20 0 DIADMN COc1cc([C@@H](C)N[C@H]2CSCc3ccccc32)ccc1F ZINC000678114891 1046557111 /nfs/dbraw/zinc/55/71/11/1046557111.db2.gz RUBDYMXPWNCIOC-PXAZEXFGSA-N 0 1 317.429 4.473 20 0 DIADMN CC(C)(C)N(Cc1cn2cccc(F)c2n1)Cc1ccccc1 ZINC000678120051 1046557972 /nfs/dbraw/zinc/55/79/72/1046557972.db2.gz IDYCIHVTKVMUAZ-UHFFFAOYSA-N 0 1 311.404 4.274 20 0 DIADMN COc1c(Cl)cccc1CNCc1ccc(SC)s1 ZINC000897482180 1046559475 /nfs/dbraw/zinc/55/94/75/1046559475.db2.gz MRQHXLGSFOQNEM-UHFFFAOYSA-N 0 1 313.875 4.422 20 0 DIADMN CCn1c2ccccc2c2cc(CN(C)Cc3cn[nH]c3)ccc21 ZINC000678127223 1046560988 /nfs/dbraw/zinc/56/09/88/1046560988.db2.gz LUPSMJCRBIUXHF-UHFFFAOYSA-N 0 1 318.424 4.170 20 0 DIADMN C[C@H](c1ccc(F)c(F)c1)N(C)Cc1[nH]nc2ccccc21 ZINC000678132090 1046562926 /nfs/dbraw/zinc/56/29/26/1046562926.db2.gz XNAYNJCJCPSUOR-LLVKDONJSA-N 0 1 301.340 4.034 20 0 DIADMN C[C@@H](CN[C@H](c1ncc[nH]1)c1ccccc1)c1cccc(F)c1 ZINC000783220769 1046564154 /nfs/dbraw/zinc/56/41/54/1046564154.db2.gz AQAPIOGCTCRJJD-KSSFIOAISA-N 0 1 309.388 4.032 20 0 DIADMN C[C@H](CN[C@H](c1ncc[nH]1)c1ccccc1)c1cccc(F)c1 ZINC000783220768 1046564827 /nfs/dbraw/zinc/56/48/27/1046564827.db2.gz AQAPIOGCTCRJJD-KDOFPFPSSA-N 0 1 309.388 4.032 20 0 DIADMN CCn1nc(C)c(CN(C)[C@@H](C)c2ccc(Cl)cc2)c1C ZINC000678137375 1046565023 /nfs/dbraw/zinc/56/50/23/1046565023.db2.gz MPOARCCNZKHNME-ZDUSSCGKSA-N 0 1 305.853 4.366 20 0 DIADMN C[C@@H]1CC[C@@H]1N[C@@H](c1nc2ccccc2n1C)c1ccccc1 ZINC000783235758 1046566922 /nfs/dbraw/zinc/56/69/22/1046566922.db2.gz BXBOEILXRCDRSQ-SIXWZSSISA-N 0 1 305.425 4.051 20 0 DIADMN C[C@@H](NCc1cnc(C2CC2)nc1)c1ccc2c(c1)CCCC2 ZINC000459372852 1046566947 /nfs/dbraw/zinc/56/69/47/1046566947.db2.gz HVXNUWAKXRZGSU-CQSZACIVSA-N 0 1 307.441 4.084 20 0 DIADMN CN(Cc1ccccc1Cl)Cc1ccccc1-c1cncnc1 ZINC001140018695 1046568066 /nfs/dbraw/zinc/56/80/66/1046568066.db2.gz FPUITKGNTJEJRM-UHFFFAOYSA-N 0 1 323.827 4.429 20 0 DIADMN c1nc(CN2CCC(c3cccnc3)CC2)oc1-c1ccccc1 ZINC000678167272 1046576083 /nfs/dbraw/zinc/57/60/83/1046576083.db2.gz HSUQFMCCPJKAOP-UHFFFAOYSA-N 0 1 319.408 4.116 20 0 DIADMN CN(C)Cc1ccc(N[C@@H]2CCC[C@@H](C(F)(F)F)C2)cc1F ZINC000783288681 1046576054 /nfs/dbraw/zinc/57/60/54/1046576054.db2.gz YSLGAOMJWMZNFP-CHWSQXEVSA-N 0 1 318.358 4.420 20 0 DIADMN C[C@@H](c1ccc(F)cc1F)N1CCC(c2cccnc2)CC1 ZINC000678170978 1046577649 /nfs/dbraw/zinc/57/76/49/1046577649.db2.gz 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DIYTWKPYHMSWFE-UHFFFAOYSA-N 0 1 314.751 4.059 20 0 DIADMN Cc1cc(F)cc(C)c1C(=O)Nc1cc(Cl)c(O)cc1F ZINC001157241935 1047738635 /nfs/dbraw/zinc/73/86/35/1047738635.db2.gz CJYIXPGQGLRXSQ-UHFFFAOYSA-N 0 1 311.715 4.193 20 0 DIADMN N#CC(C(=O)CCCC1CCCCC1)C(=O)Nc1ccccc1 ZINC000128088116 1047739750 /nfs/dbraw/zinc/73/97/50/1047739750.db2.gz BOTYJDJGHZLLTP-QGZVFWFLSA-N 0 1 312.413 4.085 20 0 DIADMN COc1cc(CN[C@H](c2ccccc2F)C2CCCC2)ccn1 ZINC000539164505 1047740059 /nfs/dbraw/zinc/74/00/59/1047740059.db2.gz RSXQEIGTFPGASN-IBGZPJMESA-N 0 1 314.404 4.250 20 0 DIADMN COc1ccc([C@H](NCc2cn3ccc(C)cc3n2)C(C)C)cc1 ZINC000539202849 1047740976 /nfs/dbraw/zinc/74/09/76/1047740976.db2.gz OHISCGTUVVTRJH-HXUWFJFHSA-N 0 1 323.440 4.138 20 0 DIADMN CCc1ccc([C@H](C)CC(=O)Nc2ccc3cncn3c2)cc1 ZINC001157396600 1047742029 /nfs/dbraw/zinc/74/20/29/1047742029.db2.gz QTWKCOPSOIXPDM-CQSZACIVSA-N 0 1 307.397 4.029 20 0 DIADMN Cn1cnc2cc(CNCc3ccc(-c4ccccc4)o3)ccc21 ZINC000539222319 1047742892 /nfs/dbraw/zinc/74/28/92/1047742892.db2.gz OPQLNJZKGKWALQ-UHFFFAOYSA-N 0 1 317.392 4.123 20 0 DIADMN COC(=O)c1oc(CN[C@@H](CC(C)C)c2ccccc2)cc1C ZINC000539242936 1047743989 /nfs/dbraw/zinc/74/39/89/1047743989.db2.gz CMXQAHICEDSYOE-KRWDZBQOSA-N 0 1 315.413 4.252 20 0 DIADMN Brc1ccc([C@@H](NCc2ccno2)C2CCC2)cc1 ZINC000539278168 1047744326 /nfs/dbraw/zinc/74/43/26/1047744326.db2.gz GAAUXWWKBLYENZ-HNNXBMFYSA-N 0 1 321.218 4.068 20 0 DIADMN Cc1nc([C@@H](C)N[C@@H]2CCCc3cc(N)ccc32)c(C)s1 ZINC000643520772 1047746017 /nfs/dbraw/zinc/74/60/17/1047746017.db2.gz MOVSBPVSYDANAD-QLJPJBMISA-N 0 1 301.459 4.070 20 0 DIADMN COc1cccc(C(F)(F)F)c1CNc1ccc(C)c(C)n1 ZINC001157694445 1047749878 /nfs/dbraw/zinc/74/98/78/1047749878.db2.gz IRDIPLSEKDVPDA-UHFFFAOYSA-N 0 1 310.319 4.338 20 0 DIADMN COc1ccc2c(ccnc2N[C@@H]2CCNc3ccccc32)c1 ZINC001157830670 1047757141 /nfs/dbraw/zinc/75/71/41/1047757141.db2.gz FZWQJMPRHZWRLV-GOSISDBHSA-N 0 1 305.381 4.212 20 0 DIADMN CC(C)n1ncc2c1C[C@H](Nc1ccnc3cc(F)ccc31)CC2 ZINC000477958624 1047760564 /nfs/dbraw/zinc/76/05/64/1047760564.db2.gz APEXYSXKWQFCLB-OAHLLOKOSA-N 0 1 324.403 4.121 20 0 DIADMN C[C@@H](N[C@H](CC(C)(C)C)c1ccc(F)cc1)c1cn(C)cn1 ZINC000924696319 1047760627 /nfs/dbraw/zinc/76/06/27/1047760627.db2.gz NYSDREXUEQGANT-CZUORRHYSA-N 0 1 303.425 4.387 20 0 DIADMN COc1cccc([C@@H]2CSCCN2c2cc(C)c(C)cn2)c1 ZINC001158258019 1047771261 /nfs/dbraw/zinc/77/12/61/1047771261.db2.gz OFOHXVGXCXLKJF-KRWDZBQOSA-N 0 1 314.454 4.002 20 0 DIADMN Cc1cc(N2CCCC2)nc(N[C@@H]2C[C@@H](C)c3ccccc32)n1 ZINC001158465599 1047781044 /nfs/dbraw/zinc/78/10/44/1047781044.db2.gz ALQOFCNPCUEAFS-CXAGYDPISA-N 0 1 308.429 4.046 20 0 DIADMN C[C@H]1C[C@@H](Nc2nc[nH]c3nc(=S)sc2-3)c2ccccc21 ZINC001158471176 1047782268 /nfs/dbraw/zinc/78/22/68/1047782268.db2.gz GGOJGDDYLCILBB-GZMMTYOYSA-N 0 1 314.439 4.035 20 0 DIADMN Cc1cccc([C@@H](C)NCc2nc3cccc(Cl)c3n2C)c1 ZINC000478439903 1047787655 /nfs/dbraw/zinc/78/76/55/1047787655.db2.gz ZIVZUHNAPFEJCE-CYBMUJFWSA-N 0 1 313.832 4.386 20 0 DIADMN CN(C)[C@@H](CNC(=O)CCCCC(C)(C)C)c1cccs1 ZINC000552697420 1047788126 /nfs/dbraw/zinc/78/81/26/1047788126.db2.gz LNDBDAWQAWNJKQ-AWEZNQCLSA-N 0 1 310.507 4.074 20 0 DIADMN COc1ccc2cnc(NC[C@@H](C)c3ccc(O)cc3)cc2c1 ZINC001158606511 1047791007 /nfs/dbraw/zinc/79/10/07/1047791007.db2.gz CUWQAPJJHFKFEU-CYBMUJFWSA-N 0 1 308.381 4.165 20 0 DIADMN CCOc1ccnc(N2CCC3(CC2)O[C@@H](C)c2ccccc23)c1 ZINC001158752307 1047796835 /nfs/dbraw/zinc/79/68/35/1047796835.db2.gz XJUNEIFLMUOGJR-HNNXBMFYSA-N 0 1 324.424 4.067 20 0 DIADMN CCC[C@H](NCc1ccc(C(=O)OC)cc1F)c1ccccc1 ZINC000552852313 1047799354 /nfs/dbraw/zinc/79/93/54/1047799354.db2.gz UGXFHMDOHHQJFJ-SFHVURJKSA-N 0 1 315.388 4.243 20 0 DIADMN CC[C@H](C)CC(=O)NC[C@@H](c1cccc(Cl)c1)N1CCCC1 ZINC000478699431 1047807968 /nfs/dbraw/zinc/80/79/68/1047807968.db2.gz ZLYJEEILFFBBOG-YOEHRIQHSA-N 0 1 322.880 4.029 20 0 DIADMN CC[C@H](CC1CCCCC1)C(=O)Nc1n[nH]c2cc(O)ccc21 ZINC001159063307 1047810551 /nfs/dbraw/zinc/81/05/51/1047810551.db2.gz JKOGNFWHRRKQPB-CYBMUJFWSA-N 0 1 315.417 4.204 20 0 DIADMN CCCCOc1ccccc1Nc1cc([C@@H]2CCCCN2)no1 ZINC001159309423 1047829798 /nfs/dbraw/zinc/82/97/98/1047829798.db2.gz UIKDMUVEQNSWLF-AWEZNQCLSA-N 0 1 315.417 4.412 20 0 DIADMN CSc1ncc(Nc2cc([C@H]3CCCCN3)no2)cc1Cl ZINC001159312417 1047829936 /nfs/dbraw/zinc/82/99/36/1047829936.db2.gz ATPBZQVDNNBINY-LLVKDONJSA-N 0 1 324.837 4.003 20 0 DIADMN CSc1ncc(Nc2cc([C@@H]3CCCCN3)no2)cc1Cl ZINC001159312418 1047830363 /nfs/dbraw/zinc/83/03/63/1047830363.db2.gz ATPBZQVDNNBINY-NSHDSACASA-N 0 1 324.837 4.003 20 0 DIADMN CCCOc1cccc(Nc2cc([C@H]3CCCCN3)no2)c1 ZINC001159309673 1047830466 /nfs/dbraw/zinc/83/04/66/1047830466.db2.gz XRQQDJODOGPEPC-OAHLLOKOSA-N 0 1 301.390 4.022 20 0 DIADMN Cc1cc(Nc2cc([C@H]3CCCCN3)no2)c(F)cc1Cl ZINC001159312689 1047830943 /nfs/dbraw/zinc/83/09/43/1047830943.db2.gz FUGZMGXFGZTFIA-GFCCVEGCSA-N 0 1 309.772 4.334 20 0 DIADMN COc1ccc(Nc2cc([C@H]3CCCCN3)no2)c2ccccc12 ZINC001159313554 1047831080 /nfs/dbraw/zinc/83/10/80/1047831080.db2.gz QMSZFPDTZBJZDO-MRXNPFEDSA-N 0 1 323.396 4.395 20 0 DIADMN CC(C)Oc1ccc(F)c(Nc2cc([C@H]3CCCCN3)no2)c1 ZINC001159313653 1047831159 /nfs/dbraw/zinc/83/11/59/1047831159.db2.gz RCEQGWKSBROZGE-CQSZACIVSA-N 0 1 319.380 4.159 20 0 DIADMN CC(C)Oc1ccc(F)c(Nc2cc([C@@H]3CCCCN3)no2)c1 ZINC001159313652 1047831482 /nfs/dbraw/zinc/83/14/82/1047831482.db2.gz RCEQGWKSBROZGE-AWEZNQCLSA-N 0 1 319.380 4.159 20 0 DIADMN COc1cccc(C2CC2)c1Nc1cc([C@H]2CCCCN2)no1 ZINC001159312891 1047831624 /nfs/dbraw/zinc/83/16/24/1047831624.db2.gz GAMVQCABUYMZGO-CQSZACIVSA-N 0 1 313.401 4.119 20 0 DIADMN Cc1cc(Nc2cc([C@@H]3CCCCN3)no2)c(F)cc1Cl ZINC001159312690 1047832079 /nfs/dbraw/zinc/83/20/79/1047832079.db2.gz FUGZMGXFGZTFIA-LBPRGKRZSA-N 0 1 309.772 4.334 20 0 DIADMN CC(C)Oc1ccc(Nc2cc([C@@H]3CCCCN3)no2)cc1F ZINC001159313741 1047833083 /nfs/dbraw/zinc/83/30/83/1047833083.db2.gz SWGTTXYFOUCCKX-AWEZNQCLSA-N 0 1 319.380 4.159 20 0 DIADMN COc1ccc(CN[C@@H](c2cc(F)ccc2F)C(C)C)cc1O ZINC000479059500 1047833744 /nfs/dbraw/zinc/83/37/44/1047833744.db2.gz LBGNCTFDCYHOOJ-GOSISDBHSA-N 0 1 321.367 4.166 20 0 DIADMN c1nc(CN2CC[C@@H]2Cc2ccccc2)oc1-c1ccccc1 ZINC000479136483 1047839441 /nfs/dbraw/zinc/83/94/41/1047839441.db2.gz VZQAMNFDCTZDJH-GOSISDBHSA-N 0 1 304.393 4.159 20 0 DIADMN Cc1csc([C@H]2CCN(Cc3cc(Cl)ccc3F)C2)n1 ZINC001197564424 1047844485 /nfs/dbraw/zinc/84/44/85/1047844485.db2.gz ISYLGZDQDUSZST-NSHDSACASA-N 0 1 310.825 4.234 20 0 DIADMN Fc1cc(F)c(Nc2ccc3c[nH]nc3c2)c(Br)c1 ZINC001174499845 1047845317 /nfs/dbraw/zinc/84/53/17/1047845317.db2.gz CDDVAUQBCZJQJS-UHFFFAOYSA-N 0 1 324.128 4.347 20 0 DIADMN Fc1cc(Nc2ccc3c[nH]nc3c2)c(F)cc1Br ZINC001174499840 1047845498 /nfs/dbraw/zinc/84/54/98/1047845498.db2.gz BXZUDHUGBFUMEZ-UHFFFAOYSA-N 0 1 324.128 4.347 20 0 DIADMN CC(C)C[C@@H](NC(=O)Cc1ccc2nc[nH]c2c1)c1ccccc1 ZINC001182845537 1047848466 /nfs/dbraw/zinc/84/84/66/1047848466.db2.gz JQRUXAKKNGMWGB-GOSISDBHSA-N 0 1 321.424 4.009 20 0 DIADMN CCCCCOc1cc(C)ccc1CNCc1cnn(CC)c1 ZINC000152516849 1047853309 /nfs/dbraw/zinc/85/33/09/1047853309.db2.gz KWCIKUBINMMRDE-UHFFFAOYSA-N 0 1 315.461 4.070 20 0 DIADMN CCc1ccc(C)nc1N[C@H](C)CCc1n[nH]c2ccccc12 ZINC001182874194 1047854385 /nfs/dbraw/zinc/85/43/85/1047854385.db2.gz PMVBZHLTLJKRHS-CQSZACIVSA-N 0 1 308.429 4.262 20 0 DIADMN COc1cccc(Cl)c1CN[C@H]1CCc2c1cccc2C ZINC000479281128 1047855751 /nfs/dbraw/zinc/85/57/51/1047855751.db2.gz JBFRPRVPCLHESN-KRWDZBQOSA-N 0 1 301.817 4.434 20 0 DIADMN CCC(C)(C)OC1CN(CCCCCOc2ccccc2)C1 ZINC001182919132 1047856884 /nfs/dbraw/zinc/85/68/84/1047856884.db2.gz VPLUHMYIABJPIV-UHFFFAOYSA-N 0 1 305.462 4.125 20 0 DIADMN COc1ccc([C@@H](C)CC(=O)Nc2nc3ccc(C)cc3[nH]2)cc1 ZINC000553473408 1047857072 /nfs/dbraw/zinc/85/70/72/1047857072.db2.gz KDWCNROQPQPEJE-ZDUSSCGKSA-N 0 1 323.396 4.012 20 0 DIADMN Cc1ccc2oc(C(=O)Nc3nc4ccc(C)cc4[nH]3)cc2c1 ZINC000553473570 1047858623 /nfs/dbraw/zinc/85/86/23/1047858623.db2.gz BLPOGVCOIXICCP-UHFFFAOYSA-N 0 1 305.337 4.178 20 0 DIADMN Cc1ccc2nc(NC(=O)c3ccc(COC(C)C)cc3)[nH]c2c1 ZINC000553473633 1047859240 /nfs/dbraw/zinc/85/92/40/1047859240.db2.gz DZZHNTLOTZUXDZ-UHFFFAOYSA-N 0 1 323.396 4.049 20 0 DIADMN CCOc1c(Cl)cc(Nc2ccnc(CO)c2)cc1Cl ZINC001174533283 1047861463 /nfs/dbraw/zinc/86/14/63/1047861463.db2.gz DPXLJVLSLPVUTB-UHFFFAOYSA-N 0 1 313.184 4.023 20 0 DIADMN Cc1cnccc1Nc1cc(-c2cccc(C(F)(F)F)c2)no1 ZINC001174536329 1047866197 /nfs/dbraw/zinc/86/61/97/1047866197.db2.gz ATRCYSWCVOZMRB-UHFFFAOYSA-N 0 1 319.286 4.229 20 0 DIADMN Cc1cnccc1Nc1cc(-c2ccc(C(F)(F)F)cc2)no1 ZINC001174537376 1047866470 /nfs/dbraw/zinc/86/64/70/1047866470.db2.gz HXQSOFMMVXPMEN-UHFFFAOYSA-N 0 1 319.286 4.229 20 0 DIADMN c1n[nH]c2cccc(Nc3cncc(Oc4ccccc4)c3)c12 ZINC001159575061 1047869840 /nfs/dbraw/zinc/86/98/40/1047869840.db2.gz SKAWBGARUOONLS-UHFFFAOYSA-N 0 1 302.337 4.494 20 0 DIADMN CN(Cc1cc(C(C)(C)C)[nH]n1)C(=O)CCCCC(C)(C)C ZINC000553545598 1047873017 /nfs/dbraw/zinc/87/30/17/1047873017.db2.gz FKGQGBKZRNJHCJ-UHFFFAOYSA-N 0 1 307.482 4.272 20 0 DIADMN COc1cccc(CN[C@@H](c2cc(F)ccc2F)C(C)C)c1 ZINC000479360024 1047876045 /nfs/dbraw/zinc/87/60/45/1047876045.db2.gz OJUONFHFMSADNI-GOSISDBHSA-N 0 1 305.368 4.460 20 0 DIADMN [O-]c1ccc(F)c(Nc2ccc(C3CC[NH2+]CC3)cc2)c1Cl ZINC001159601441 1047880134 /nfs/dbraw/zinc/88/01/34/1047880134.db2.gz ZWVSSQGEBCHHOQ-UHFFFAOYSA-N 0 1 320.795 4.395 20 0 DIADMN Cc1ccc(-c2cnc(CN3CC[C@H](c4ccncc4)C3)o2)cc1 ZINC000566922937 1047883446 /nfs/dbraw/zinc/88/34/46/1047883446.db2.gz DZMKDENRAKTHQI-SFHVURJKSA-N 0 1 319.408 4.035 20 0 DIADMN CC1(C)CC(C)(C)c2cc(NCc3n[nH]c(C4CC4)n3)ccc21 ZINC000479437383 1047889587 /nfs/dbraw/zinc/88/95/87/1047889587.db2.gz MMLBTWQXEMEURD-UHFFFAOYSA-N 0 1 310.445 4.253 20 0 DIADMN Cc1cc(Cl)cc(C)c1CN1Cc2c[nH]nc2CC(C)(C)C1 ZINC001183094701 1047892888 /nfs/dbraw/zinc/89/28/88/1047892888.db2.gz KUVYXULGSHLKRK-UHFFFAOYSA-N 0 1 317.864 4.264 20 0 DIADMN c1[nH]nc2cc(Nc3cncc(Oc4ccccc4)c3)ccc12 ZINC001159662871 1047897687 /nfs/dbraw/zinc/89/76/87/1047897687.db2.gz IXYWIAPSHFXAAR-UHFFFAOYSA-N 0 1 302.337 4.494 20 0 DIADMN COc1cccc(C(F)(F)F)c1Nc1ccc2c[nH]nc2c1 ZINC001159663377 1047897903 /nfs/dbraw/zinc/89/79/03/1047897903.db2.gz YPDVDWVCYYLNIM-UHFFFAOYSA-N 0 1 307.275 4.334 20 0 DIADMN Clc1ccc(CN2CCC[C@H](Cc3nccs3)C2)s1 ZINC001197921485 1047899398 /nfs/dbraw/zinc/89/93/98/1047899398.db2.gz URKSSJFIVJPNCP-LLVKDONJSA-N 0 1 312.891 4.313 20 0 DIADMN COCc1csc(CN2CCC[C@@H]2c2ccc(F)cc2)c1 ZINC000667492998 1047900245 /nfs/dbraw/zinc/90/02/45/1047900245.db2.gz DKWWWPOBYBMLKH-QGZVFWFLSA-N 0 1 305.418 4.371 20 0 DIADMN C[C@@H](c1cccc(C(F)(F)F)c1)N(C)Cc1cnn2c1CCC2 ZINC000667499196 1047903614 /nfs/dbraw/zinc/90/36/14/1047903614.db2.gz BUQOQGXFJVRWKH-LBPRGKRZSA-N 0 1 323.362 4.041 20 0 DIADMN CCCc1cccc(CN[C@H](COC)c2ccc(F)c(F)c2)c1 ZINC000479478548 1047904142 /nfs/dbraw/zinc/90/41/42/1047904142.db2.gz NLSZCWJUMAKOPC-LJQANCHMSA-N 0 1 319.395 4.395 20 0 DIADMN CCc1onc(C)c1CN(Cc1cccc(F)c1)C1CCC1 ZINC001197960740 1047908474 /nfs/dbraw/zinc/90/84/74/1047908474.db2.gz XQKFTEXPZFAKMD-UHFFFAOYSA-N 0 1 302.393 4.239 20 0 DIADMN CC1(C)[C@H](c2cc(F)c(F)c(F)c2)CC[N@H+]1Cc1cccnc1 ZINC001198026307 1047919132 /nfs/dbraw/zinc/91/91/32/1047919132.db2.gz CUMMYBDKRGSTBC-AWEZNQCLSA-N 0 1 320.358 4.267 20 0 DIADMN CC1(C)[C@H](c2cc(F)c(F)c(F)c2)CCN1Cc1cccnc1 ZINC001198026307 1047919139 /nfs/dbraw/zinc/91/91/39/1047919139.db2.gz CUMMYBDKRGSTBC-AWEZNQCLSA-N 0 1 320.358 4.267 20 0 DIADMN CCCC[C@@H](COC)NCc1c(Cl)cccc1OC(F)F ZINC001183355468 1047919706 /nfs/dbraw/zinc/91/97/06/1047919706.db2.gz QLMZBXDAZLAXEY-NSHDSACASA-N 0 1 321.795 4.236 20 0 DIADMN CC(C)(C)CC(C)(C)NC(=O)c1cc2c(Cl)[nH]ccc-2n1 ZINC001174600642 1047922274 /nfs/dbraw/zinc/92/22/74/1047922274.db2.gz JAVYTGOOHTWLGN-UHFFFAOYSA-N 0 1 307.825 4.161 20 0 DIADMN O=C(NC1CCC2(CC2)CC1)c1c(O)cc(Cl)cc1Cl ZINC001183387709 1047923641 /nfs/dbraw/zinc/92/36/41/1047923641.db2.gz DTJNMXZQCJVYNT-UHFFFAOYSA-N 0 1 314.212 4.152 20 0 DIADMN Clc1oc2ccccc2c1CNC1([C@H]2CCCCO2)CC1 ZINC001198084872 1047923689 /nfs/dbraw/zinc/92/36/89/1047923689.db2.gz MJDJCWZYZUDLHB-OAHLLOKOSA-N 0 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O=S(=O)(Nc1csc(Cl)c1)c1ccc(C2CC2)cc1 ZINC001190469621 1048742781 /nfs/dbraw/zinc/74/27/81/1048742781.db2.gz PWYOIZVAZZHAHV-UHFFFAOYSA-N 0 1 313.831 4.080 20 0 DIADMN CCc1ccc(NC(=O)CN2CCC[C@@H]2c2cccc(C)c2)cc1 ZINC001190475006 1048743752 /nfs/dbraw/zinc/74/37/52/1048743752.db2.gz HRBVGTLBXUZSEL-HXUWFJFHSA-N 0 1 322.452 4.333 20 0 DIADMN Fc1ccc(O[C@@H]2CCN(Cc3ccccc3Cl)C2)cc1 ZINC001203382404 1048745650 /nfs/dbraw/zinc/74/56/50/1048745650.db2.gz YDYOOYWGTPLTQQ-MRXNPFEDSA-N 0 1 305.780 4.132 20 0 DIADMN FC(F)(F)C1CCN(Cc2ccc(OCC3CC3)cc2)CC1 ZINC000483162169 1048749327 /nfs/dbraw/zinc/74/93/27/1048749327.db2.gz VEXKAZCEHYITLX-UHFFFAOYSA-N 0 1 313.363 4.250 20 0 DIADMN Cc1ncn(C)c1Nc1ccc(C(F)(F)F)cc1OC(C)C ZINC001176598495 1048750392 /nfs/dbraw/zinc/75/03/92/1048750392.db2.gz GXUQVEVTAQIIKV-UHFFFAOYSA-N 0 1 313.323 4.278 20 0 DIADMN Cc1cccc2nc(NC(=O)c3ccc(C(C)(F)F)cc3)[nH]c21 ZINC001190499363 1048751907 /nfs/dbraw/zinc/75/19/07/1048751907.db2.gz QEVXWYZLDGLPQG-UHFFFAOYSA-N 0 1 315.323 4.235 20 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324.758 4.056 20 0 DIADMN C[C@H](NCc1cc(F)cc(C(F)(F)F)c1)c1cccc(O)c1 ZINC000162513225 1048767641 /nfs/dbraw/zinc/76/76/41/1048767641.db2.gz UPUBDPIESZQLCT-JTQLQIEISA-N 0 1 313.294 4.401 20 0 DIADMN CN(Cc1cc(Cl)cn1C)Cc1ccc(OCC2CC2)cc1 ZINC000483265088 1048767782 /nfs/dbraw/zinc/76/77/82/1048767782.db2.gz XOGIEVOBKXYCQO-UHFFFAOYSA-N 0 1 318.848 4.099 20 0 DIADMN Cc1ccccc1CCCN(C)Cc1ccn(-c2ccccc2)n1 ZINC001190700550 1048771666 /nfs/dbraw/zinc/77/16/66/1048771666.db2.gz ZJDVEULDIXLLGT-UHFFFAOYSA-N 0 1 319.452 4.245 20 0 DIADMN CC(C)N(C)c1ccc(CN2C[C@H](C)[C@H]2c2ccccc2)cn1 ZINC000483288138 1048773405 /nfs/dbraw/zinc/77/34/05/1048773405.db2.gz WJVQENPPVHARDW-JXFKEZNVSA-N 0 1 309.457 4.119 20 0 DIADMN CCN(CCOc1ccc(Cl)c(F)c1)CCC(F)(F)F ZINC001190691133 1048776591 /nfs/dbraw/zinc/77/65/91/1048776591.db2.gz KULCYQNCFDILPV-UHFFFAOYSA-N 0 1 313.722 4.132 20 0 DIADMN Cc1ccccc1-c1nc(CN[C@@H]2CCCC[C@H]2C2CC2)no1 ZINC000483304627 1048776598 /nfs/dbraw/zinc/77/65/98/1048776598.db2.gz 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CC[C@H](c1ccccc1)[N@@H+](CCSC(C)(C)C)CC(=O)[O-] ZINC000851706494 1048796588 /nfs/dbraw/zinc/79/65/88/1048796588.db2.gz BBUAUDCJAYLDOW-OAHLLOKOSA-N 0 1 309.475 4.056 20 0 DIADMN O=C(Nc1cscc1Cl)c1c(O)cnc2c(F)cccc21 ZINC001176884624 1048797195 /nfs/dbraw/zinc/79/71/95/1048797195.db2.gz BSDYFJQZKHNGRF-UHFFFAOYSA-N 0 1 322.748 4.047 20 0 DIADMN CN(CC=C(Cl)Cl)C[C@@H]1CCCO[C@H]1c1ccccc1 ZINC000851741578 1048798794 /nfs/dbraw/zinc/79/87/94/1048798794.db2.gz LDSFREOPQMSSER-HOCLYGCPSA-N 0 1 314.256 4.405 20 0 DIADMN CC(C)(C)c1nc(CSc2nc3cc(F)ccc3s2)n[nH]1 ZINC001166811139 1048799123 /nfs/dbraw/zinc/79/91/23/1048799123.db2.gz LVEYTHUKXKOZEP-UHFFFAOYSA-N 0 1 322.434 4.143 20 0 DIADMN Cc1cc(Cl)ccc1CN[C@H](C)c1cnn(CC2CCC2)c1 ZINC001176848288 1048799655 /nfs/dbraw/zinc/79/96/55/1048799655.db2.gz ANSLDEIIOOHURY-CQSZACIVSA-N 0 1 317.864 4.496 20 0 DIADMN COc1ccc(C[N@H+]2CC[C@@H](C(F)(F)F)C(C)(C)C2)cc1 ZINC000483437224 1048800652 /nfs/dbraw/zinc/80/06/52/1048800652.db2.gz HPWAJGCGVBQHJZ-CQSZACIVSA-N 0 1 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/nfs/dbraw/zinc/19/37/55/1049193755.db2.gz NYLYYYJJQQODSE-UHFFFAOYSA-N 0 1 317.751 4.225 20 0 DIADMN [O-]c1cc(F)c(CC[NH2+]Cc2ccc3ccccc3c2)c(F)c1 ZINC001179665442 1049195614 /nfs/dbraw/zinc/19/56/14/1049195614.db2.gz BNYBLVYRMPMLBG-UHFFFAOYSA-N 0 1 313.347 4.156 20 0 DIADMN COc1ccc(C2(N[C@H](C)c3ccc(Cl)nc3)CC2)cc1 ZINC000776960106 1049196067 /nfs/dbraw/zinc/19/60/67/1049196067.db2.gz IBBCHAYXOPIEPO-GFCCVEGCSA-N 0 1 302.805 4.084 20 0 DIADMN Cc1cscc1CNCc1ccc(C)cc1Br ZINC000164049932 1049197315 /nfs/dbraw/zinc/19/73/15/1049197315.db2.gz SQFSWLWZOAXJOO-UHFFFAOYSA-N 0 1 310.260 4.417 20 0 DIADMN Cc1nc(C)c(CN[C@@H](Cc2ccccc2)c2ccccn2)s1 ZINC001179729068 1049200062 /nfs/dbraw/zinc/20/00/62/1049200062.db2.gz JRXDBYAGPNZERV-SFHVURJKSA-N 0 1 323.465 4.229 20 0 DIADMN Fc1ccccc1[C@H](N[C@@H]1CCCc2c[nH]nc21)C1CCCC1 ZINC000857856315 1049202178 /nfs/dbraw/zinc/20/21/78/1049202178.db2.gz IUBWCWJFMZNTOL-QZTJIDSGSA-N 0 1 313.420 4.447 20 0 DIADMN c1n[nH]c2c1CCC[C@H]2Nc1cccc(COc2ccccc2)c1 ZINC000857859983 1049203366 /nfs/dbraw/zinc/20/33/66/1049203366.db2.gz JJGHTDQZYHSFSD-LJQANCHMSA-N 0 1 319.408 4.478 20 0 DIADMN Fc1ccc([C@@H](N[C@H]2CCCc3c[nH]nc32)C2CC2)cc1Cl ZINC000857868003 1049205608 /nfs/dbraw/zinc/20/56/08/1049205608.db2.gz NAOMEHOYFYJDML-HOTGVXAUSA-N 0 1 319.811 4.321 20 0 DIADMN Fc1ccc([C@@H](N[C@@H]2CCCc3c[nH]nc32)C2CC2)cc1Cl ZINC000857868002 1049205715 /nfs/dbraw/zinc/20/57/15/1049205715.db2.gz NAOMEHOYFYJDML-CVEARBPZSA-N 0 1 319.811 4.321 20 0 DIADMN Clc1ccc2c(n1)[C@@H](N[C@H]1CSCc3ccccc31)CC2 ZINC000857903550 1049206624 /nfs/dbraw/zinc/20/66/24/1049206624.db2.gz ILHOKIFWVQGKGG-GJZGRUSLSA-N 0 1 316.857 4.300 20 0 DIADMN C[C@@H]1CO[C@H](c2cccc(Cl)c2)CN1C[C@@H]1C[C@H]2C[C@H]2C1 ZINC001193448855 1049206993 /nfs/dbraw/zinc/20/69/93/1049206993.db2.gz VNMZMTZXJBFKTJ-UHOVARLQSA-N 0 1 305.849 4.148 20 0 DIADMN COc1cccc(CN[C@H]2CCSc3ccccc32)c1F ZINC000192661938 1049208663 /nfs/dbraw/zinc/20/86/63/1049208663.db2.gz MVPAKTPZCZYBPU-AWEZNQCLSA-N 0 1 303.402 4.161 20 0 DIADMN CC(C)CCC1CCN(Cc2ccnn2CC2CCC2)CC1 ZINC001204640690 1049209778 /nfs/dbraw/zinc/20/97/78/1049209778.db2.gz RRMFGNIWFCPTPH-UHFFFAOYSA-N 0 1 303.494 4.331 20 0 DIADMN CCN(Cc1sncc1Br)[C@@H]1CCCC[C@H]1C ZINC001193413625 1049210304 /nfs/dbraw/zinc/21/03/04/1049210304.db2.gz OVGCKBWMJXCDIW-ZYHUDNBSSA-N 0 1 317.296 4.306 20 0 DIADMN Clc1ccc2c(n1)[C@H](N[C@@H](c1ccccn1)C1CCC1)CC2 ZINC000857916315 1049211546 /nfs/dbraw/zinc/21/15/46/1049211546.db2.gz ILEASMDRJCLOTD-NVXWUHKLSA-N 0 1 313.832 4.248 20 0 DIADMN CCn1cc(C[N@H+]2CCc3ccccc3C2)c(-c2ccccc2)n1 ZINC001179845251 1049213531 /nfs/dbraw/zinc/21/35/31/1049213531.db2.gz NFMATQWPIDGVLA-UHFFFAOYSA-N 0 1 317.436 4.128 20 0 DIADMN CCn1cc(CN2CCc3ccccc3C2)c(-c2ccccc2)n1 ZINC001179845251 1049213542 /nfs/dbraw/zinc/21/35/42/1049213542.db2.gz NFMATQWPIDGVLA-UHFFFAOYSA-N 0 1 317.436 4.128 20 0 DIADMN CCn1nc(CN2CCc3ccccc3[C@@H]2C)c2ccccc21 ZINC001179855257 1049216776 /nfs/dbraw/zinc/21/67/76/1049216776.db2.gz PXLFLIRLCYXZII-HNNXBMFYSA-N 0 1 305.425 4.176 20 0 DIADMN CC(C)[C@@H]1CCCN(Cc2nc3cc(Cl)ccc3n2C)C1 ZINC001193508838 1049220133 /nfs/dbraw/zinc/22/01/33/1049220133.db2.gz SVBZMDSCVYHQID-CYBMUJFWSA-N 0 1 305.853 4.095 20 0 DIADMN OCC[C@@H](NCc1ccsc1C(F)(F)F)c1cccs1 ZINC000858142560 1049221508 /nfs/dbraw/zinc/22/15/08/1049221508.db2.gz FEPCMQHQFYVEKG-SNVBAGLBSA-N 0 1 321.389 4.042 20 0 DIADMN CC(C)C[C@@H]1CCCCCN1Cc1cc(C(F)(F)F)n[nH]1 ZINC001204681234 1049221822 /nfs/dbraw/zinc/22/18/22/1049221822.db2.gz IWKUTHTYWHHHHE-ZDUSSCGKSA-N 0 1 303.372 4.219 20 0 DIADMN Fc1cc(CN[C@@H]2CCc3c2ccc(Cl)c3Cl)ccn1 ZINC000858137070 1049221940 /nfs/dbraw/zinc/22/19/40/1049221940.db2.gz ZZLAPTNWHKKDHA-CYBMUJFWSA-N 0 1 311.187 4.305 20 0 DIADMN c1coc(C2CCN(Cc3cnc(C4CCC4)s3)CC2)c1 ZINC000668461759 1049222128 /nfs/dbraw/zinc/22/21/28/1049222128.db2.gz DJZYRTKSOPIWNO-UHFFFAOYSA-N 0 1 302.443 4.383 20 0 DIADMN COc1ccccc1[C@@H](CC(C)C)NCc1ccnc(F)c1 ZINC000858148049 1049222553 /nfs/dbraw/zinc/22/25/53/1049222553.db2.gz JHZQNGXWCUFNSU-MRXNPFEDSA-N 0 1 302.393 4.106 20 0 DIADMN c1coc(C2CCN(Cc3conc3Cc3ccccc3)CC2)c1 ZINC000668462889 1049222972 /nfs/dbraw/zinc/22/29/72/1049222972.db2.gz KBXDCWPIMVKRHJ-UHFFFAOYSA-N 0 1 322.408 4.238 20 0 DIADMN CO[C@H](CN[C@@H](C)c1cc2cc(Cl)ccc2o1)C(F)(F)F ZINC000777006361 1049224836 /nfs/dbraw/zinc/22/48/36/1049224836.db2.gz INTOWFJKFLFFPB-ISVAXAHUSA-N 0 1 321.726 4.314 20 0 DIADMN CO[C@H](CN[C@H](c1cc2ccccc2o1)C(C)C)C(F)(F)F ZINC000777008810 1049225410 /nfs/dbraw/zinc/22/54/10/1049225410.db2.gz RJDVXMFBFHEAIC-CABCVRRESA-N 0 1 315.335 4.297 20 0 DIADMN CO[C@@H](CN[C@@H](C)c1cc(Cl)cc(Cl)c1)C(F)(F)F ZINC000777007541 1049225706 /nfs/dbraw/zinc/22/57/06/1049225706.db2.gz DKLHCBCJOMYCSM-CPCISQLKSA-N 0 1 316.150 4.221 20 0 DIADMN Clc1ccc2c(c1Cl)CCN(CC1CCSCC1)C2 ZINC001179873417 1049226158 /nfs/dbraw/zinc/22/61/58/1049226158.db2.gz JNFAPTUYOMQDTG-UHFFFAOYSA-N 0 1 316.297 4.495 20 0 DIADMN Cc1c(Cl)cc(NC(=O)/C=C/C(F)(F)F)c(O)c1Cl ZINC001179928232 1049229982 /nfs/dbraw/zinc/22/99/82/1049229982.db2.gz SYZQNYHCSPJJSV-NSCUHMNNSA-N 0 1 314.090 4.064 20 0 DIADMN c1coc([C@H]2CCCCCN2Cc2cc(-c3ccccn3)n[nH]2)c1 ZINC001179931929 1049230802 /nfs/dbraw/zinc/23/08/02/1049230802.db2.gz UZRJBWNEVDWBDM-GOSISDBHSA-N 0 1 322.412 4.182 20 0 DIADMN Cc1ccc(NC(=O)CN2CCC(C)(C(C)C)CC2)c(C)c1 ZINC001193615625 1049231113 /nfs/dbraw/zinc/23/11/13/1049231113.db2.gz CJHRSRHVLUMYJL-UHFFFAOYSA-N 0 1 302.462 4.000 20 0 DIADMN C[C@@H]1SCCN(Cc2cccc(F)c2N)[C@@H]1c1ccccc1 ZINC001179938707 1049232400 /nfs/dbraw/zinc/23/24/00/1049232400.db2.gz WUSMDKHRZSPCAU-UGSOOPFHSA-N 0 1 316.445 4.087 20 0 DIADMN COc1cccc(CN(Cc2ccc(F)cc2)C(C)C)c1F ZINC001204697981 1049232468 /nfs/dbraw/zinc/23/24/68/1049232468.db2.gz YOQUKDKKANOIJE-UHFFFAOYSA-N 0 1 305.368 4.384 20 0 DIADMN C[C@H](NCCOCC1CCC1)c1cc(Cl)ccc1Cl ZINC001193626719 1049232521 /nfs/dbraw/zinc/23/25/21/1049232521.db2.gz MAKRBQPWTMCEKN-NSHDSACASA-N 0 1 302.245 4.461 20 0 DIADMN Cc1nn(C)c(Cl)c1CN[C@H]1CCCc2ccc(Cl)cc21 ZINC000858296102 1049237828 /nfs/dbraw/zinc/23/78/28/1049237828.db2.gz PBLXJJUIQWQACK-HNNXBMFYSA-N 0 1 324.255 4.203 20 0 DIADMN CC[C@H]1CCN(Cc2cn3cc(Cl)cc(Cl)c3n2)[C@H]1C ZINC001193606015 1049238027 /nfs/dbraw/zinc/23/80/27/1049238027.db2.gz MDGHUKWOKKKBEI-QWRGUYRKSA-N 0 1 312.244 4.262 20 0 DIADMN Cc1cc(C(F)(F)F)ccc1CN[C@@H](C)c1ccns1 ZINC000858316646 1049240081 /nfs/dbraw/zinc/24/00/81/1049240081.db2.gz FRYYCUQXXQZNCJ-JTQLQIEISA-N 0 1 300.349 4.321 20 0 DIADMN CCCCOc1cc(CN[C@H](C)c2ccns2)ccc1OC ZINC000858317021 1049241217 /nfs/dbraw/zinc/24/12/17/1049241217.db2.gz DQKSHQXEHMKQKJ-CYBMUJFWSA-N 0 1 320.458 4.181 20 0 DIADMN Cc1ncsc1-c1ccc(CN[C@H](C)c2ccns2)cc1 ZINC000858317862 1049242041 /nfs/dbraw/zinc/24/20/41/1049242041.db2.gz FXGLFAACEUJRSG-LLVKDONJSA-N 0 1 315.467 4.426 20 0 DIADMN Clc1ccc2c(c1)[C@@H](NCc1scnc1C1CC1)CC2 ZINC000858321259 1049243110 /nfs/dbraw/zinc/24/31/10/1049243110.db2.gz XKAXUBLTUDMRKA-AWEZNQCLSA-N 0 1 304.846 4.451 20 0 DIADMN CC(C)(C)c1ncc(CN[C@@H]2CCc3ccc(Cl)cc32)cn1 ZINC000858321184 1049243341 /nfs/dbraw/zinc/24/33/41/1049243341.db2.gz VHFAQTBLEOKZGG-MRXNPFEDSA-N 0 1 315.848 4.205 20 0 DIADMN CC(C)(C)n1cc(CN[C@@H]2CCc3ccc(Cl)cc32)cn1 ZINC000858321312 1049243550 /nfs/dbraw/zinc/24/35/50/1049243550.db2.gz YWLFHWHRUADXAS-MRXNPFEDSA-N 0 1 303.837 4.069 20 0 DIADMN Cc1nn(C(C)C)cc1CN[C@@H]1CCc2ccc(Cl)cc21 ZINC000858321054 1049243653 /nfs/dbraw/zinc/24/36/53/1049243653.db2.gz QSNCZKZRKWETTM-QGZVFWFLSA-N 0 1 303.837 4.203 20 0 DIADMN COC/C(C)=C\CN1CCC(=Cc2ccc(F)c(F)c2)CC1 ZINC001193693465 1049245518 /nfs/dbraw/zinc/24/55/18/1049245518.db2.gz FQGATGZUGCXJIV-RZNTYIFUSA-N 0 1 307.384 4.037 20 0 DIADMN Cc1n[nH]c(CN(Cc2cccc(F)c2)C2CCCC2)c1C ZINC001179994093 1049245922 /nfs/dbraw/zinc/24/59/22/1049245922.db2.gz VWHOZJMGTNXTPV-UHFFFAOYSA-N 0 1 301.409 4.110 20 0 DIADMN Cc1csc([C@H](C)NC[C@H](O)c2ccc(C(C)(C)C)cc2)n1 ZINC000858365107 1049246641 /nfs/dbraw/zinc/24/66/41/1049246641.db2.gz KLAQNVGCJGEQSO-BBRMVZONSA-N 0 1 318.486 4.133 20 0 DIADMN CCCn1cncc1CN(Cc1cccc(F)c1)C1CCCC1 ZINC001179992940 1049247210 /nfs/dbraw/zinc/24/72/10/1049247210.db2.gz CHEFCNDZYPUSEV-UHFFFAOYSA-N 0 1 315.436 4.377 20 0 DIADMN Cc1csc([C@@H](C)N[C@H](c2ccccc2)C2CCOCC2)n1 ZINC000858365430 1049248238 /nfs/dbraw/zinc/24/82/38/1049248238.db2.gz NWQGGGRUWQONLT-RHSMWYFYSA-N 0 1 316.470 4.270 20 0 DIADMN CCCCO[C@@H]1C[C@@H](N(C)Cc2ccnn2C2CCC2)C1(C)C ZINC001179963439 1049252082 /nfs/dbraw/zinc/25/20/82/1049252082.db2.gz ZLFGKDDRDUBKIM-QZTJIDSGSA-N 0 1 319.493 4.024 20 0 DIADMN COc1cncc(CN2CC[C@H](C)C[C@@H]2c2ccc(C)o2)c1C ZINC001179962942 1049252472 /nfs/dbraw/zinc/25/24/72/1049252472.db2.gz URZYDHBHXOYJFE-SUMWQHHRSA-N 0 1 314.429 4.273 20 0 DIADMN C1=CC2(CCN(Cc3nc4ccccc4[nH]3)CC2)c2ccccc21 ZINC001204751511 1049253438 /nfs/dbraw/zinc/25/34/38/1049253438.db2.gz LJRXNCWKXITWKB-UHFFFAOYSA-N 0 1 315.420 4.124 20 0 DIADMN CCC[C@H](N[C@H]1CCCc2scnc21)[C@H](O)c1ccccc1 ZINC000858411214 1049254399 /nfs/dbraw/zinc/25/43/99/1049254399.db2.gz FWPCRWRPOXWYRM-RLFYNMQTSA-N 0 1 316.470 4.012 20 0 DIADMN C[C@H]1SCCN(Cc2cnc(-c3ccccc3F)s2)[C@H]1C ZINC001204768057 1049256187 /nfs/dbraw/zinc/25/61/87/1049256187.db2.gz GCHGLJCKCAWZMG-NWDGAFQWSA-N 0 1 322.474 4.275 20 0 DIADMN C[C@H]1SCCN(Cc2cnc(-c3ccccc3F)s2)[C@@H]1C ZINC001204768059 1049257519 /nfs/dbraw/zinc/25/75/19/1049257519.db2.gz GCHGLJCKCAWZMG-VXGBXAGGSA-N 0 1 322.474 4.275 20 0 DIADMN Cc1ccc2nc([C@H]3CCCN3c3nc(Cl)cs3)[nH]c2c1 ZINC000858442579 1049257860 /nfs/dbraw/zinc/25/78/60/1049257860.db2.gz JVFUWKNMKWDNSF-GFCCVEGCSA-N 0 1 318.833 4.323 20 0 DIADMN Cc1ccc([C@@H]2[C@H](C)CCCN2Cc2nccn2C2CC2)cc1 ZINC001180017996 1049259228 /nfs/dbraw/zinc/25/92/28/1049259228.db2.gz LCMSSPWIHJIPQN-UZLBHIALSA-N 0 1 309.457 4.500 20 0 DIADMN CCN(Cc1c(OC)cccc1OC)[C@H](C)c1ccc(F)cc1 ZINC001180042804 1049262083 /nfs/dbraw/zinc/26/20/83/1049262083.db2.gz JUAYKXFYHJXXRL-CQSZACIVSA-N 0 1 317.404 4.426 20 0 DIADMN Fc1ccc2c(c1)[C@@H](N[C@H](c1ccccn1)C1CCC1)CCO2 ZINC000858484300 1049264503 /nfs/dbraw/zinc/26/45/03/1049264503.db2.gz NQORAFZDXHMENW-LPHOPBHVSA-N 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O=C1OCc2cccc(Nc3cc(Cl)c(O)c(Cl)c3)c21 ZINC001210931346 1050420385 /nfs/dbraw/zinc/42/03/85/1050420385.db2.gz TXRLNYJAXCHXDU-UHFFFAOYSA-N 0 1 310.136 4.113 20 0 DIADMN CCCCCCN(C)Cc1nc(-c2cccc(Cl)c2)no1 ZINC000735790969 1050430079 /nfs/dbraw/zinc/43/00/79/1050430079.db2.gz HAEYPXXPTXJWGT-UHFFFAOYSA-N 0 1 307.825 4.402 20 0 DIADMN CCCN1CCc2c(N)sc(N=C(C)c3ccccc3)c2C1 ZINC001210984865 1050438021 /nfs/dbraw/zinc/43/80/21/1050438021.db2.gz CHASQVNOADBEKZ-UHFFFAOYSA-N 0 1 313.470 4.181 20 0 DIADMN C=C(Nc1ccnc2c(C(=O)OC)cccc12)c1ccccc1 ZINC001210984073 1050438410 /nfs/dbraw/zinc/43/84/10/1050438410.db2.gz ZQBMQEUIWSWMKB-UHFFFAOYSA-N 0 1 304.349 4.104 20 0 DIADMN Cc1nc(CN[C@](C)(Cc2ccccc2)c2ccccc2)[nH]c1C ZINC000574339977 1050439021 /nfs/dbraw/zinc/43/90/21/1050439021.db2.gz PLHIUBYYQFKNQG-OAQYLSRUSA-N 0 1 319.452 4.274 20 0 DIADMN CC[C@@H]1CC[C@H](C)[N@H+]1Cc1nc2ccccc2c(C)c1C(=O)[O-] ZINC000574331655 1050441349 /nfs/dbraw/zinc/44/13/49/1050441349.db2.gz IZLFIKLAKHUKFO-GXTWGEPZSA-N 0 1 312.413 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/nfs/dbraw/zinc/76/05/90/1050760590.db2.gz ISCMPPPHGZYVSZ-SJORKVTESA-N 0 1 320.477 4.139 20 0 DIADMN Cc1ccc(CN(C)CCc2ccncc2)c(Cl)c1Cl ZINC001231668096 1050766562 /nfs/dbraw/zinc/76/65/62/1050766562.db2.gz ZGMRRBHFKCXCSN-UHFFFAOYSA-N 0 1 309.240 4.371 20 0 DIADMN CCc1cccc(Cl)c1CNCc1ccc([C@@H](C)O)cc1 ZINC000788966100 1050767473 /nfs/dbraw/zinc/76/74/73/1050767473.db2.gz NAJNDGJEUSYBDP-CYBMUJFWSA-N 0 1 303.833 4.246 20 0 DIADMN CC[C@H](NCc1cnc(Cl)c(F)c1)c1ccc(OC)cc1 ZINC000846839623 1050770210 /nfs/dbraw/zinc/77/02/10/1050770210.db2.gz GMHPXXMGWMINOE-HNNXBMFYSA-N 0 1 308.784 4.124 20 0 DIADMN COc1ccc(C(C)C)cc1CN[C@@H](CCO)c1cccs1 ZINC000846853128 1050773312 /nfs/dbraw/zinc/77/33/12/1050773312.db2.gz RDAHPDNEQZUNST-INIZCTEOSA-N 0 1 319.470 4.093 20 0 DIADMN CC[C@H](c1cccc(OC)c1)N(C)Cc1cnc(Cl)c(F)c1 ZINC000846901992 1050780336 /nfs/dbraw/zinc/78/03/36/1050780336.db2.gz YSLVASGXIJXQJJ-MRXNPFEDSA-N 0 1 322.811 4.466 20 0 DIADMN CC(=O)C1CCN(Cc2ccccc2OCc2ccccc2)CC1 ZINC000846941544 1050781416 /nfs/dbraw/zinc/78/14/16/1050781416.db2.gz SKAZNXTZHLWFQN-UHFFFAOYSA-N 0 1 323.436 4.067 20 0 DIADMN Cc1cc(Nc2c(Cl)ccc(F)c2F)n(-c2ccncc2)n1 ZINC001213947198 1050787330 /nfs/dbraw/zinc/78/73/30/1050787330.db2.gz LNKQQBWAKGCQBH-UHFFFAOYSA-N 0 1 320.730 4.251 20 0 DIADMN CC[C@@H](Sc1nnc(C)[nH]1)c1ccc(Br)cc1 ZINC000177947218 1050794386 /nfs/dbraw/zinc/79/43/86/1050794386.db2.gz NANVXGHHYUFFND-LLVKDONJSA-N 0 1 312.236 4.119 20 0 DIADMN CC[C@@H](Sc1nc(C)n[nH]1)c1ccc(Br)cc1 ZINC000177947218 1050794397 /nfs/dbraw/zinc/79/43/97/1050794397.db2.gz NANVXGHHYUFFND-LLVKDONJSA-N 0 1 312.236 4.119 20 0 DIADMN Clc1ccccc1C1(NCc2ccc3nonc3c2)CCC1 ZINC000847008471 1050797105 /nfs/dbraw/zinc/79/71/05/1050797105.db2.gz KGRQWIQLIUZMAH-UHFFFAOYSA-N 0 1 313.788 4.045 20 0 DIADMN Cc1ccc(C2(NCc3cnc(Cl)c(F)c3)CCC2)cc1 ZINC000847008731 1050797598 /nfs/dbraw/zinc/79/75/98/1050797598.db2.gz FZPUODMAKUODBX-UHFFFAOYSA-N 0 1 304.796 4.352 20 0 DIADMN CCSc1ccc(Cl)cc1NC(=S)NC1(C)CC1 ZINC000789229971 1050806935 /nfs/dbraw/zinc/80/69/35/1050806935.db2.gz BYWDESVVTCNJED-UHFFFAOYSA-N 0 1 300.880 4.291 20 0 DIADMN CC[C@H](N[C@@H]1COc2c1ccc(C)c2C)c1ccc2c(c1)CCO2 ZINC000772960631 1050807694 /nfs/dbraw/zinc/80/76/94/1050807694.db2.gz UZCXJHDWIQBLON-RBUKOAKNSA-N 0 1 323.436 4.413 20 0 DIADMN COc1ccc2c(c1)OC(C)(C)CN(Cc1csc(C)c1)C2 ZINC001171266164 1050810180 /nfs/dbraw/zinc/81/01/80/1050810180.db2.gz DLROWWKACOQDDF-UHFFFAOYSA-N 0 1 317.454 4.238 20 0 DIADMN Cc1noc(C)c1CN(C)CCc1cccc(Cl)c1Cl ZINC000789284592 1050811095 /nfs/dbraw/zinc/81/10/95/1050811095.db2.gz LDUZYAHKDWOUSR-UHFFFAOYSA-N 0 1 313.228 4.273 20 0 DIADMN C/C(=C/C(C)(C)C)C(=O)N[C@@H](C)c1nc2ccc(Cl)cc2[nH]1 ZINC000772964211 1050811054 /nfs/dbraw/zinc/81/10/54/1050811054.db2.gz OLJHFONFQLSTAW-JUDLJHIGSA-N 0 1 319.836 4.386 20 0 DIADMN CCC[C@@H](NCc1ccc(OC)c(Cl)c1)c1ccccn1 ZINC000742369887 1050819159 /nfs/dbraw/zinc/81/91/59/1050819159.db2.gz ZPYYZHRHCCFMDL-OAHLLOKOSA-N 0 1 304.821 4.375 20 0 DIADMN CCC[C@H](NCc1ccc(OC)c(Cl)c1)c1ccccn1 ZINC000742369886 1050819720 /nfs/dbraw/zinc/81/97/20/1050819720.db2.gz ZPYYZHRHCCFMDL-HNNXBMFYSA-N 0 1 304.821 4.375 20 0 DIADMN CSCc1cnc(CN(C)C[C@H]2CCc3ccccc32)s1 ZINC000597237704 1050827698 /nfs/dbraw/zinc/82/76/98/1050827698.db2.gz CEFNXVYQLZYVEW-CQSZACIVSA-N 0 1 318.511 4.168 20 0 DIADMN CC[C@@H](NCc1ccc(Br)cc1F)c1ccncc1 ZINC000742372193 1050833533 /nfs/dbraw/zinc/83/35/33/1050833533.db2.gz JACGZXMGNIEISA-OAHLLOKOSA-N 0 1 323.209 4.224 20 0 DIADMN c1cc([C@@H]2CCCN(Cc3ccc(Oc4ccccc4)o3)C2)n[nH]1 ZINC000180423819 1050835103 /nfs/dbraw/zinc/83/51/03/1050835103.db2.gz RPAYDILRXVLHRL-OAHLLOKOSA-N 0 1 323.396 4.175 20 0 DIADMN CC1(C)CCN(C(=O)c2c(Cl)[nH]nc2C2CC2)CC(C)(C)C1 ZINC001146774200 1050842142 /nfs/dbraw/zinc/84/21/42/1050842142.db2.gz ZEBUWRCQNMOBHR-UHFFFAOYSA-N 0 1 323.868 4.229 20 0 DIADMN C[C@@H]1CCCCN1c1cccc(N[C@@H]2COCc3ccccc32)n1 ZINC001171291565 1050849374 /nfs/dbraw/zinc/84/93/74/1050849374.db2.gz FJUFHZIFFTYGEL-CRAIPNDOSA-N 0 1 323.440 4.144 20 0 DIADMN C/C=C(\CC)C(=O)N1CCC[C@@H]1c1nc2ccc(Cl)cc2[nH]1 ZINC000789656525 1050864297 /nfs/dbraw/zinc/86/42/97/1050864297.db2.gz YCQBNOHRRJEXGG-MTDDYQMPSA-N 0 1 317.820 4.236 20 0 DIADMN CCCCO[C@H]1C[C@H](NCc2ccn(C(CC)CC)n2)C1(C)C ZINC001170115982 1050875347 /nfs/dbraw/zinc/87/53/47/1050875347.db2.gz DVICLSALGPKUQZ-ROUUACIJSA-N 0 1 321.509 4.318 20 0 DIADMN Fc1cc2[nH]cnc2cc1NCc1ccccc1-c1cccnc1 ZINC001170116793 1050875872 /nfs/dbraw/zinc/87/58/72/1050875872.db2.gz VAKCDDWJVHZMIK-UHFFFAOYSA-N 0 1 318.355 4.376 20 0 DIADMN CCCCC[C@H](C)CC(=O)NC[C@H](c1ccc(F)cc1)N(C)C ZINC000742562124 1050880097 /nfs/dbraw/zinc/88/00/97/1050880097.db2.gz SFCGGTKZYYARBJ-MAUKXSAKSA-N 0 1 322.468 4.151 20 0 DIADMN C[C@@H](c1cccc(Cl)c1)N(C)Cc1cccc2c1OCCO2 ZINC000746855146 1050880046 /nfs/dbraw/zinc/88/00/46/1050880046.db2.gz JLKKVCLXVAMGBH-ZDUSSCGKSA-N 0 1 317.816 4.304 20 0 DIADMN C/C=C(/CC)C(=O)Nc1cc(Br)cc(Cl)c1O ZINC000789833301 1050887402 /nfs/dbraw/zinc/88/74/02/1050887402.db2.gz GBHLWFIIECEKJO-CLTKARDFSA-N 0 1 318.598 4.103 20 0 DIADMN C[C@@H](CN1CCC[C@H](OC(F)F)C1)c1cccc(Cl)c1 ZINC000682164335 1050903476 /nfs/dbraw/zinc/90/34/76/1050903476.db2.gz LEQBCFWTZJBDOG-FZMZJTMJSA-N 0 1 303.780 4.147 20 0 DIADMN CCCN1Cc2cccc(NC(=O)/C=C(/C)C(C)(C)C)c2C1 ZINC000742626416 1050906106 /nfs/dbraw/zinc/90/61/06/1050906106.db2.gz OGJRXZASZXCPBJ-KAMYIIQDSA-N 0 1 300.446 4.343 20 0 DIADMN CC(C)c1cc(Cl)ccc1NC(=O)CN1[C@@H](C)CC[C@@H]1C ZINC001147975327 1050911387 /nfs/dbraw/zinc/91/13/87/1050911387.db2.gz WGXSXLOXSQRBIC-STQMWFEESA-N 0 1 308.853 4.275 20 0 DIADMN CCCC[C@H](CC)CCCN(C)C(=O)c1ccc2[nH]nnc2c1 ZINC001148041497 1050916543 /nfs/dbraw/zinc/91/65/43/1050916543.db2.gz OVQBVKSTSJLLIW-AWEZNQCLSA-N 0 1 316.449 4.027 20 0 DIADMN CC(=CC(=O)Nc1nc(-c2ccccc2Cl)n[nH]1)C(C)(C)C ZINC000742684447 1050917583 /nfs/dbraw/zinc/91/75/83/1050917583.db2.gz PHUVETRAESRTSA-MDZDMXLPSA-N 0 1 318.808 4.056 20 0 DIADMN CC(=CC(=O)Nc1nc(-c2ccccc2Cl)n[nH]1)C(C)(C)C ZINC000742684446 1050918440 /nfs/dbraw/zinc/91/84/40/1050918440.db2.gz PHUVETRAESRTSA-KTKRTIGZSA-N 0 1 318.808 4.056 20 0 DIADMN C[NH+](C)CCc1ccc(Nc2cc(F)c([O-])c(Cl)c2)cc1 ZINC001214492177 1050922355 /nfs/dbraw/zinc/92/23/55/1050922355.db2.gz SCJWKXYCGLNKRX-UHFFFAOYSA-N 0 1 308.784 4.032 20 0 DIADMN Fc1ccc(Cl)c(Cl)c1Nc1ccnn1-c1ccncc1 ZINC001214506870 1050927474 /nfs/dbraw/zinc/92/74/74/1050927474.db2.gz AZENMPPCZHTWKF-UHFFFAOYSA-N 0 1 323.158 4.457 20 0 DIADMN C[C@@H]1CCCC[C@@H]1CC(=O)Nc1ccc(CN(C)C)c(F)c1 ZINC001148335386 1050932157 /nfs/dbraw/zinc/93/21/57/1050932157.db2.gz YIRZPKBSHJHJFF-ZIAGYGMSSA-N 0 1 306.425 4.042 20 0 DIADMN COc1ccc2oc(CN3CCC[C@H](C(F)(F)F)C3)cc2c1 ZINC000179625027 1050946739 /nfs/dbraw/zinc/94/67/39/1050946739.db2.gz UIPOEZGXWWOUPO-LBPRGKRZSA-N 0 1 313.319 4.216 20 0 DIADMN O=C(c1cc(-c2ccccc2)[nH]n1)N1CCCC[C@@H]1CC1CCC1 ZINC001148513316 1050947621 /nfs/dbraw/zinc/94/76/21/1050947621.db2.gz PZEALZGZNIBUPO-QGZVFWFLSA-N 0 1 323.440 4.262 20 0 DIADMN CCCCC[C@@H]1CCCCN1C(=O)[C@H]1c2cn[nH]c2CC[C@@H]1C ZINC001148506314 1050950707 /nfs/dbraw/zinc/95/07/07/1050950707.db2.gz XFLMCZVFFIEWNV-HDMKZQKVSA-N 0 1 317.477 4.037 20 0 DIADMN C[C@@H]1c2ccccc2CN1C(=O)c1cccc(C(F)(F)F)c1O ZINC001148789851 1050971787 /nfs/dbraw/zinc/97/17/87/1050971787.db2.gz KRBDNDYGIQEBIR-SNVBAGLBSA-N 0 1 321.298 4.128 20 0 DIADMN Cc1cc([C@H](C)N[C@@H](C)C(=O)Nc2cccc(Cl)c2)c(C)o1 ZINC000348096630 1050986599 /nfs/dbraw/zinc/98/65/99/1050986599.db2.gz NGRHGIPGPFPMJG-RYUDHWBXSA-N 0 1 320.820 4.228 20 0 DIADMN Cc1cc(Cl)nc(CN[C@H]2CSCCc3ccccc32)c1 ZINC000282726560 1050988696 /nfs/dbraw/zinc/98/86/96/1050988696.db2.gz MHQHHHPNNJVJRA-INIZCTEOSA-N 0 1 318.873 4.164 20 0 DIADMN C[C@H](NC[C@H]1CCC2(CCCCC2)O1)c1cccnc1Cl ZINC000790711896 1050989279 /nfs/dbraw/zinc/98/92/79/1050989279.db2.gz WJGJJBUWDSPKRA-UONOGXRCSA-N 0 1 308.853 4.268 20 0 DIADMN CC(=O)c1cc(Nc2ccncc2Oc2ccccc2)cs1 ZINC001214771477 1050999339 /nfs/dbraw/zinc/99/93/39/1050999339.db2.gz QWINGLBVOJQOSY-UHFFFAOYSA-N 0 1 310.378 4.304 20 0 DIADMN Fc1ccc([C@@H](NC[C@H]2CCCC(F)(F)C2)c2ncc[nH]2)cc1 ZINC000282784614 1050999864 /nfs/dbraw/zinc/99/98/64/1050999864.db2.gz PTZQOQWMNYAZPB-SWLSCSKDSA-N 0 1 323.362 4.053 20 0 DIADMN Cc1nc(Cl)nc(Cl)c1Nc1ccc(Cl)c(O)c1F ZINC001214794089 1051001685 /nfs/dbraw/zinc/00/16/85/1051001685.db2.gz YEUZVKKZHVRPBZ-UHFFFAOYSA-N 0 1 322.554 4.334 20 0 DIADMN CNc1ccnc(Cl)c1Nc1ccc(Cl)c(O)c1F ZINC001214794081 1051001866 /nfs/dbraw/zinc/00/18/66/1051001866.db2.gz XYWLGGWJIBMSDS-UHFFFAOYSA-N 0 1 302.136 4.018 20 0 DIADMN CCNc1ccnc(Cl)c1Nc1ccc(Cl)c(O)c1F ZINC001214793964 1051002144 /nfs/dbraw/zinc/00/21/44/1051002144.db2.gz QYKACWHBOYFDPK-UHFFFAOYSA-N 0 1 316.163 4.409 20 0 DIADMN Oc1c(Cl)ccc(Nc2ncccc2C(F)(F)F)c1F ZINC001214793990 1051002654 /nfs/dbraw/zinc/00/26/54/1051002654.db2.gz SMTTZUYMBRTOLP-UHFFFAOYSA-N 0 1 306.646 4.342 20 0 DIADMN Oc1c(Cl)ccc(Nc2cc(-c3cccnc3)ccn2)c1F ZINC001214791358 1051002716 /nfs/dbraw/zinc/00/27/16/1051002716.db2.gz SNKOTQJVJNUYBQ-UHFFFAOYSA-N 0 1 315.735 4.385 20 0 DIADMN CC(C)(C)c1nnc(Nc2ccc(Cl)c(O)c2F)s1 ZINC001214790988 1051002904 /nfs/dbraw/zinc/00/29/04/1051002904.db2.gz FIATWJLVUSJXAH-UHFFFAOYSA-N 0 1 301.774 4.077 20 0 DIADMN Cc1cc2c(ncnc2Nc2ccc(Cl)c(O)c2F)s1 ZINC001214791299 1051002949 /nfs/dbraw/zinc/00/29/49/1051002949.db2.gz PTOVZFYNLPBRPZ-UHFFFAOYSA-N 0 1 309.753 4.241 20 0 DIADMN CCc1ccc([C@H](C)N[C@H](CCO)c2ccc(Cl)cc2)o1 ZINC000348215880 1051003491 /nfs/dbraw/zinc/00/34/91/1051003491.db2.gz NHNZOTCHSJJQCI-BLLLJJGKSA-N 0 1 307.821 4.270 20 0 DIADMN Cc1cc(Nc2ccc(Cl)c(O)c2F)n(CC2CCC2)n1 ZINC001214798072 1051003773 /nfs/dbraw/zinc/00/37/73/1051003773.db2.gz KYBHAAKVWRTOFO-UHFFFAOYSA-N 0 1 309.772 4.233 20 0 DIADMN O=c1cc(C(F)(F)F)[nH]cc1Nc1ccc(Cl)c(O)c1F ZINC001214796394 1051004161 /nfs/dbraw/zinc/00/41/61/1051004161.db2.gz SJEPPEFRHVULJT-UHFFFAOYSA-N 0 1 322.645 4.048 20 0 DIADMN Oc1c(Cl)ccc(Nc2cnccc2Br)c1F ZINC001214796074 1051004625 /nfs/dbraw/zinc/00/46/25/1051004625.db2.gz GHZRGHAZAQIMIJ-UHFFFAOYSA-N 0 1 317.545 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CCO[C@H]1C[C@@H](N(C)CC=C(Cl)Cl)C12CCCCC2 ZINC001559573844 1059406116 /nfs/dbraw/zinc/40/61/16/1059406116.db2.gz NJWPFFSFRIZBEL-OLZOCXBDSA-N 0 1 306.277 4.365 20 0 DIADMN Cc1cc(Cl)cc(-c2noc([C@@H]3CCCN3C(C)C)n2)c1 ZINC001247369059 1059410791 /nfs/dbraw/zinc/41/07/91/1059410791.db2.gz RTTLDUCHVRLHTA-AWEZNQCLSA-N 0 1 305.809 4.244 20 0 DIADMN CC(C)N1CCC[C@H]1c1nc(-c2ccc(F)cc2Cl)no1 ZINC001247368157 1059410910 /nfs/dbraw/zinc/41/09/10/1059410910.db2.gz VHMOUIICCZBMCU-ZDUSSCGKSA-N 0 1 309.772 4.074 20 0 DIADMN COc1ccc(CN2CCS[C@H]3CCCC[C@@H]32)cc1Cl ZINC001559577415 1059412271 /nfs/dbraw/zinc/41/22/71/1059412271.db2.gz GYZSPAFYXLKMBH-HOCLYGCPSA-N 0 1 311.878 4.209 20 0 DIADMN CCCOC(=O)[C@@H](C)N(Cc1ccccc1)[C@@H]1CCCC1(C)C ZINC001559579152 1059412484 /nfs/dbraw/zinc/41/24/84/1059412484.db2.gz CEXGIXVDYMUQMV-SJLPKXTDSA-N 0 1 317.473 4.409 20 0 DIADMN CC/C=C(\C)c1nc(-c2ncccc2/C=C/N2CCCC2)no1 ZINC001247375125 1059415698 /nfs/dbraw/zinc/41/56/98/1059415698.db2.gz FPVKATUMKBHXDR-BTLVJFLNSA-N 0 1 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Cc1cc(C)cc([C@@H](C)NCc2cnc([C@H]3CCCO3)s2)c1 ZINC001473984808 1061525718 /nfs/dbraw/zinc/52/57/18/1061525718.db2.gz ZDOBTGMTUNVVNG-RHSMWYFYSA-N 0 1 316.470 4.462 20 0 DIADMN Cc1cccc2c1CC[C@@H]2NCc1nc2c(s1)C[C@@H](C)CC2 ZINC001473991704 1061534070 /nfs/dbraw/zinc/53/40/70/1061534070.db2.gz RXMYFMQGMMVQIN-LRDDRELGSA-N 0 1 312.482 4.353 20 0 DIADMN CCc1cccc2c1OCC[C@H]2NCc1cnc(C(C)C)s1 ZINC001473990735 1061534722 /nfs/dbraw/zinc/53/47/22/1061534722.db2.gz TWOWGYMRYACIKW-MRXNPFEDSA-N 0 1 316.470 4.442 20 0 DIADMN CCCCC[C@](C)(CC)C(=O)N1CCN(C2CCCC2)CC1 ZINC001464051972 1061548313 /nfs/dbraw/zinc/54/83/13/1061548313.db2.gz KCKPEVYMOLJLJT-IBGZPJMESA-N 0 1 308.510 4.070 20 0 DIADMN CC(C)(C)[C@@H]1CCCC[C@H]1NC(=O)c1ccc(Cl)c(O)c1 ZINC001464068075 1061551545 /nfs/dbraw/zinc/55/15/45/1061551545.db2.gz OXJRGVGRLYUWSJ-TZMCWYRMSA-N 0 1 309.837 4.380 20 0 DIADMN Cc1csc([C@H](NCc2ccc3scnc3c2)C2CC2)n1 ZINC001474021768 1061561576 /nfs/dbraw/zinc/56/15/76/1061561576.db2.gz CNRRYLWAXCVMQR-OAHLLOKOSA-N 0 1 315.467 4.302 20 0 DIADMN C[C@H](CNCc1csc(C2CC2)n1)Oc1ccc(Cl)cc1 ZINC001474022588 1061562307 /nfs/dbraw/zinc/56/23/07/1061562307.db2.gz ZTVQXCCKPKARKL-LLVKDONJSA-N 0 1 322.861 4.231 20 0 DIADMN CCCC[C@H](O)CNc1ccnc2cc(C(F)(F)F)ccc21 ZINC001252080070 1061568645 /nfs/dbraw/zinc/56/86/45/1061568645.db2.gz UUGAKAVDGHIXMF-LBPRGKRZSA-N 0 1 312.335 4.217 20 0 DIADMN CCCC[C@H](O)CNc1ccc2c(c1)C[N@H+](Cc1ccccc1)C2 ZINC001252097977 1061569216 /nfs/dbraw/zinc/56/92/16/1061569216.db2.gz SONSXGTYGLRZCH-NRFANRHFSA-N 0 1 324.468 4.165 20 0 DIADMN CCCC[C@H](O)CNc1ccc2c(c1)CN(Cc1ccccc1)C2 ZINC001252097977 1061569232 /nfs/dbraw/zinc/56/92/32/1061569232.db2.gz SONSXGTYGLRZCH-NRFANRHFSA-N 0 1 324.468 4.165 20 0 DIADMN Nc1c(Cl)cccc1CN[C@@H](c1ccc(F)cc1F)C1CC1 ZINC001474030265 1061573314 /nfs/dbraw/zinc/57/33/14/1061573314.db2.gz YRASFJXWAPRNSE-QGZVFWFLSA-N 0 1 322.786 4.441 20 0 DIADMN COc1cc(CN[C@@H](c2ccc(F)cc2F)C2CC2)ccc1F ZINC001474030123 1061573843 /nfs/dbraw/zinc/57/38/43/1061573843.db2.gz ULHMWWXGAOLMNR-GOSISDBHSA-N 0 1 321.342 4.353 20 0 DIADMN CCC[C@@H]1C[C@H]1C(=O)Nc1ccc2nc(-c3ccco3)[nH]c2c1 ZINC001464333449 1061577613 /nfs/dbraw/zinc/57/76/13/1061577613.db2.gz VTDIYFRSNYGAQV-DGCLKSJQSA-N 0 1 309.369 4.198 20 0 DIADMN CC(C)[C@]1(C)C[C@H]1C(=O)Nc1ccc2nc(-c3ccco3)[nH]c2c1 ZINC001464325488 1061577788 /nfs/dbraw/zinc/57/77/88/1061577788.db2.gz CCQLSPBJJUZZMM-DJJJIMSYSA-N 0 1 323.396 4.444 20 0 DIADMN CCCC[C@H](O)CNCc1csc(-c2ccc(Cl)cc2)n1 ZINC001252121880 1061582506 /nfs/dbraw/zinc/58/25/06/1061582506.db2.gz ICRNWTFZUIYDCV-HNNXBMFYSA-N 0 1 324.877 4.104 20 0 DIADMN COc1ccc(CN[C@H](C)c2ccc(-c3ccncc3)cc2)o1 ZINC001474039121 1061583091 /nfs/dbraw/zinc/58/30/91/1061583091.db2.gz MDZHAWTZPAUTDT-CQSZACIVSA-N 0 1 308.381 4.201 20 0 DIADMN C[C@@H](NCc1cc2ccccc2n1C)c1ccc(F)cc1F ZINC001474038992 1061584349 /nfs/dbraw/zinc/58/43/49/1061584349.db2.gz HPPHTGJBXKGGSI-GFCCVEGCSA-N 0 1 300.352 4.307 20 0 DIADMN CC[C@H](CNCc1ncc(C(C)C)s1)Oc1ccccc1F ZINC001474039664 1061586454 /nfs/dbraw/zinc/58/64/54/1061586454.db2.gz HIJPNLVXIOOEHW-CYBMUJFWSA-N 0 1 322.449 4.353 20 0 DIADMN CCOc1ccc(-c2nnc(-c3c(O)cccc3Cl)o2)cc1 ZINC001252129608 1061586512 /nfs/dbraw/zinc/58/65/12/1061586512.db2.gz YIOCVKOPKVWRGH-UHFFFAOYSA-N 0 1 316.744 4.161 20 0 DIADMN CCCCOc1ccccc1CNCc1ccc(C)cc1OC ZINC001474046863 1061595817 /nfs/dbraw/zinc/59/58/17/1061595817.db2.gz LWXSDXDKOYZLQQ-UHFFFAOYSA-N 0 1 313.441 4.472 20 0 DIADMN O=C(Cc1cc(Cl)cc(Cl)c1)Nc1ccc2nc[nH]c2c1 ZINC001464506359 1061600322 /nfs/dbraw/zinc/60/03/22/1061600322.db2.gz UZCNNGAINLVFIO-UHFFFAOYSA-N 0 1 320.179 4.051 20 0 DIADMN CCCN(C(=O)CCc1cc(C)[nH]n1)[C@@H](CC)c1ccccc1 ZINC001464519941 1061601606 /nfs/dbraw/zinc/60/16/06/1061601606.db2.gz IOGCHHFSBGUFBJ-SFHVURJKSA-N 0 1 313.445 4.041 20 0 DIADMN CCCCCc1cc(C(=O)N(C2CC2)C2CCC(C)CC2)n[nH]1 ZINC001464517092 1061602388 /nfs/dbraw/zinc/60/23/88/1061602388.db2.gz YSMRPRADSDBWEQ-UHFFFAOYSA-N 0 1 317.477 4.326 20 0 DIADMN Fc1ccc(/C=C\CN[C@H]2COc3ccc(Cl)cc32)cc1F ZINC001474065116 1061611332 /nfs/dbraw/zinc/61/13/32/1061611332.db2.gz JDXGWLGGBNWYCQ-AIMAZDRCSA-N 0 1 321.754 4.355 20 0 DIADMN CCOc1ccccc1CNCc1ccc(C)cc1SC ZINC001474067351 1061613222 /nfs/dbraw/zinc/61/32/22/1061613222.db2.gz OKYIMAVKNUACAU-UHFFFAOYSA-N 0 1 301.455 4.405 20 0 DIADMN CCc1oc2ccccc2c1CNCc1cc(F)cc(OC)c1 ZINC001474073517 1061620692 /nfs/dbraw/zinc/62/06/92/1061620692.db2.gz OYTKARVRIVYUTD-UHFFFAOYSA-N 0 1 313.372 4.433 20 0 DIADMN COc1ccc(C)cc1CN[C@H]1CCCOc2cc(F)ccc21 ZINC001474092987 1061638923 /nfs/dbraw/zinc/63/89/23/1061638923.db2.gz MYVZFHSTZYXURH-KRWDZBQOSA-N 0 1 315.388 4.146 20 0 DIADMN Fc1ccc2c(c1)OCCC[C@H]2NCc1cnc(C2CC2)s1 ZINC001474092990 1061640320 /nfs/dbraw/zinc/64/03/20/1061640320.db2.gz NATIKGHFUSTCED-OAHLLOKOSA-N 0 1 318.417 4.163 20 0 DIADMN COc1ccnc(NCc2ccc(OCc3ccccc3)cc2)c1 ZINC001474098121 1061642438 /nfs/dbraw/zinc/64/24/38/1061642438.db2.gz BISCVMJTMXBIFG-UHFFFAOYSA-N 0 1 320.392 4.281 20 0 DIADMN Cc1cc(F)c(CNCCc2csc(C(C)(C)C)n2)c(F)c1 ZINC001474097225 1061643358 /nfs/dbraw/zinc/64/33/58/1061643358.db2.gz OAAFITPIIKOSMA-UHFFFAOYSA-N 0 1 324.440 4.360 20 0 DIADMN CCc1ccc2c(c1)[C@H](NCc1cccc(COC)c1)CCO2 ZINC001474104971 1061652757 /nfs/dbraw/zinc/65/27/57/1061652757.db2.gz LQTWWFLWFKDHSU-LJQANCHMSA-N 0 1 311.425 4.009 20 0 DIADMN C[C@@H](NCc1ccc2c(n1)CCC2)c1ccc2c(c1)CCCC2 ZINC001474105141 1061652963 /nfs/dbraw/zinc/65/29/63/1061652963.db2.gz SCAASUYOPZUAIS-OAHLLOKOSA-N 0 1 306.453 4.300 20 0 DIADMN CCc1ccc2c(c1)[C@@H](NCc1ccc(C)c(OC)c1)CCO2 ZINC001474104886 1061653687 /nfs/dbraw/zinc/65/36/87/1061653687.db2.gz ICFLSPSQICRMNB-SFHVURJKSA-N 0 1 311.425 4.179 20 0 DIADMN Cc1cc(C(F)(F)F)ccc1CNCc1cc2cccnc2o1 ZINC001474114211 1061663817 /nfs/dbraw/zinc/66/38/17/1061663817.db2.gz KSMJSJHMGXZEIK-UHFFFAOYSA-N 0 1 320.314 4.445 20 0 DIADMN CSc1ccc(CNCc2ccccc2OCC(F)F)cc1 ZINC001474117854 1061666749 /nfs/dbraw/zinc/66/67/49/1061666749.db2.gz BGRDTSTZUBULCQ-UHFFFAOYSA-N 0 1 323.408 4.342 20 0 DIADMN Cc1cccc(OCCC[NH2+]Cc2cccc([O-])c2Cl)c1C ZINC001474135353 1061681187 /nfs/dbraw/zinc/68/11/87/1061681187.db2.gz XOJDJGWHZHDKTL-UHFFFAOYSA-N 0 1 319.832 4.221 20 0 DIADMN Fc1cccc(OC(F)F)c1CNC/C=C\c1ccccc1 ZINC001474134747 1061681426 /nfs/dbraw/zinc/68/14/26/1061681426.db2.gz UHAQTAFEHKGLTK-YVMONPNESA-N 0 1 307.315 4.230 20 0 DIADMN Cc1ccc(-c2nnc([C@@H]3CCCN3Cc3ccccc3)o2)cc1 ZINC001252648067 1061686122 /nfs/dbraw/zinc/68/61/22/1061686122.db2.gz CZZSMNDWKMWFNZ-SFHVURJKSA-N 0 1 319.408 4.382 20 0 DIADMN Cc1nc(CNCCn2ccc3cc(Cl)ccc32)sc1C ZINC001474143761 1061691534 /nfs/dbraw/zinc/69/15/34/1061691534.db2.gz PCDZYNRHTMHPPL-UHFFFAOYSA-N 0 1 319.861 4.158 20 0 DIADMN Fc1cccc(/C=C/CNCc2cccc(C(F)(F)F)n2)c1 ZINC001474152269 1061695554 /nfs/dbraw/zinc/69/55/54/1061695554.db2.gz FIZFPHVWWHPJDW-HWKANZROSA-N 0 1 310.294 4.043 20 0 DIADMN Cc1n[nH]c2ccc(-c3nnc(-c4ccc(Cl)cc4)o3)cc12 ZINC001252729031 1061705755 /nfs/dbraw/zinc/70/57/55/1061705755.db2.gz IFSRHEXNTGPMJT-UHFFFAOYSA-N 0 1 310.744 4.242 20 0 DIADMN Cc1ccc2sc(N(C)Cc3cc(C(C)(C)C)[nH]n3)nc2c1 ZINC001458347157 1061712759 /nfs/dbraw/zinc/71/27/59/1061712759.db2.gz SOKLKUAFZFBSMP-UHFFFAOYSA-N 0 1 314.458 4.262 20 0 DIADMN CC(C)C[C@@H]1C[C@H]1NCc1nc(Cl)ccc1Br ZINC001474175161 1061721569 /nfs/dbraw/zinc/72/15/69/1061721569.db2.gz AIJLTYYTVRBVED-MWLCHTKSSA-N 0 1 317.658 4.022 20 0 DIADMN Cc1nn(-c2ccc(Cl)cc2)c(Cl)c1CN[C@H]1CC1(C)C ZINC001474176471 1061722842 /nfs/dbraw/zinc/72/28/42/1061722842.db2.gz KBFRSIUNCJXMFR-AWEZNQCLSA-N 0 1 324.255 4.376 20 0 DIADMN CCN(C(=O)c1cc(-c2ccc3ccccc3c2)[nH]n1)C1CCC1 ZINC001465332068 1061736457 /nfs/dbraw/zinc/73/64/57/1061736457.db2.gz NEKYCXZYHWYENU-UHFFFAOYSA-N 0 1 319.408 4.245 20 0 DIADMN COc1ccccc1C1(NCc2ccc(C)c(Cl)c2)CC1 ZINC001474187868 1061737287 /nfs/dbraw/zinc/73/72/87/1061737287.db2.gz NUXTZLYWMMPEBT-UHFFFAOYSA-N 0 1 301.817 4.436 20 0 DIADMN CCCOc1ccc(CNCc2cccc(C)c2OC)c(C)c1 ZINC001474193210 1061741618 /nfs/dbraw/zinc/74/16/18/1061741618.db2.gz CEQBBYDTNHXNJA-UHFFFAOYSA-N 0 1 313.441 4.391 20 0 DIADMN Fc1ccc(/C=C/CNCc2cccc(OC3CC3)c2F)cc1 ZINC001474202839 1061758116 /nfs/dbraw/zinc/75/81/16/1061758116.db2.gz XACJNXBMZROLBU-NSCUHMNNSA-N 0 1 315.363 4.309 20 0 DIADMN CCc1ccc(-c2nnc(-c3ccc(O)c(Cl)c3)o2)cc1 ZINC001252953888 1061758193 /nfs/dbraw/zinc/75/81/93/1061758193.db2.gz NBUBWZKALSDNQQ-UHFFFAOYSA-N 0 1 300.745 4.325 20 0 DIADMN CC(C)c1ccc2ncnc(NCc3ccc4cncn4c3)c2c1 ZINC001458432558 1061758912 /nfs/dbraw/zinc/75/89/12/1061758912.db2.gz QYURYMCGJBFNPT-UHFFFAOYSA-N 0 1 317.396 4.013 20 0 DIADMN CCc1ccc(-c2nnc(-c3cc4[nH]cc(Cl)cc-4n3)o2)cc1 ZINC001252957580 1061760724 /nfs/dbraw/zinc/76/07/24/1061760724.db2.gz KUMLPOFANAOHKP-UHFFFAOYSA-N 0 1 324.771 4.496 20 0 DIADMN Cc1cc(C)cc(C[C@@H](C)NC(=O)c2ccc(Cl)c(O)c2)c1 ZINC001465476964 1061761017 /nfs/dbraw/zinc/76/10/17/1061761017.db2.gz SFBCUVYRZNUHTF-CYBMUJFWSA-N 0 1 317.816 4.023 20 0 DIADMN CCc1nnc(CNCC(CC)(CC)c2ccc(F)cc2)s1 ZINC001474219407 1061777610 /nfs/dbraw/zinc/77/76/10/1061777610.db2.gz AMVPLEHIHAOTCD-UHFFFAOYSA-N 0 1 321.465 4.087 20 0 DIADMN COC(=O)CCC[C@@H]1CCC[C@@H](NCC(F)(F)C(C)(C)C)C1 ZINC001474218849 1061779366 /nfs/dbraw/zinc/77/93/66/1061779366.db2.gz PZKCTYWDRMQGHK-UONOGXRCSA-N 0 1 319.436 4.160 20 0 DIADMN Fc1ccc(F)c(CNCc2ccnc(-c3ccccc3)c2)c1 ZINC001474228727 1061789014 /nfs/dbraw/zinc/78/90/14/1061789014.db2.gz MDZKAOFAVZUPBE-UHFFFAOYSA-N 0 1 310.347 4.317 20 0 DIADMN CCCC[C@@H](CCC)NC(=O)[C@H]1CCCN1Cc1ccccc1 ZINC001465658733 1061791798 /nfs/dbraw/zinc/79/17/98/1061791798.db2.gz VRHUGHBEESCYDH-RTBURBONSA-N 0 1 316.489 4.126 20 0 DIADMN Cc1ccc(-c2ncc(CN[C@H](C)c3cnc(C)s3)s2)o1 ZINC001474232063 1061794135 /nfs/dbraw/zinc/79/41/35/1061794135.db2.gz QGMBQVGJVKAINX-SNVBAGLBSA-N 0 1 319.455 4.327 20 0 DIADMN Cc1ccc(F)cc1CNCc1ccc(OC(F)F)cc1F ZINC001474237509 1061800225 /nfs/dbraw/zinc/80/02/25/1061800225.db2.gz PRWVMSIAPCECET-UHFFFAOYSA-N 0 1 313.294 4.164 20 0 DIADMN CC[C@H](NCc1ccc(C)cc1F)c1cccc(OC)c1OC ZINC001474241844 1061805835 /nfs/dbraw/zinc/80/58/35/1061805835.db2.gz VHCVFEGMLATKMI-KRWDZBQOSA-N 0 1 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CCCCC[C@@H](O)C[N@H+]1CCCC[C@H]1c1nc2ccccc2[nH]1 ZINC001253537021 1061915476 /nfs/dbraw/zinc/91/54/76/1061915476.db2.gz ULMYWGNVPBNLQP-QAPCUYQASA-N 0 1 315.461 4.031 20 0 DIADMN CCCCC[C@@H](O)CN1CCCC[C@H]1c1nc2ccccc2[nH]1 ZINC001253537021 1061915494 /nfs/dbraw/zinc/91/54/94/1061915494.db2.gz ULMYWGNVPBNLQP-QAPCUYQASA-N 0 1 315.461 4.031 20 0 DIADMN CC(C)CCN(Cc1nc2ccc(Cl)cc2n1C)C1CC1 ZINC001474331879 1061922029 /nfs/dbraw/zinc/92/20/29/1061922029.db2.gz ONEWYTFWOJCCCC-UHFFFAOYSA-N 0 1 305.853 4.237 20 0 DIADMN CO[C@H](CSc1nc(C=Cc2ccccc2)n[nH]1)CC(C)C ZINC001458904089 1061936330 /nfs/dbraw/zinc/93/63/30/1061936330.db2.gz OQLXVYSAKPEOHN-KVPUOBJLSA-N 0 1 317.458 4.128 20 0 DIADMN Cc1nc(CSc2nc(C(C)(C)C)n[nH]2)sc1C(C)(C)C ZINC001458902277 1061937782 /nfs/dbraw/zinc/93/77/82/1061937782.db2.gz FEUDNKGDOXHFQH-UHFFFAOYSA-N 0 1 324.519 4.457 20 0 DIADMN Cc1nc(CSc2n[nH]c(C(C)(C)C)n2)sc1C(C)(C)C ZINC001458902277 1061937802 /nfs/dbraw/zinc/93/78/02/1061937802.db2.gz FEUDNKGDOXHFQH-UHFFFAOYSA-N 0 1 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C[C@@H](c1ccccc1)N(CC[S@@](=O)c1ccccc1)C1CC1 ZINC000352833270 336270397 /nfs/dbraw/zinc/27/03/97/336270397.db2.gz QSYLFYURLHMOBU-KSFYIVLOSA-N 0 1 313.466 4.020 20 0 DIADMN C[C@@H](c1ccccc1)N(CC[S@](=O)c1ccccc1)C1CC1 ZINC000352833269 336270410 /nfs/dbraw/zinc/27/04/10/336270410.db2.gz QSYLFYURLHMOBU-AOMKIAJQSA-N 0 1 313.466 4.020 20 0 DIADMN C[C@H](c1ccccc1)N(CC[S@](=O)c1ccccc1)C1CC1 ZINC000352833272 336270560 /nfs/dbraw/zinc/27/05/60/336270560.db2.gz QSYLFYURLHMOBU-ZHRRBRCNSA-N 0 1 313.466 4.020 20 0 DIADMN CCC(CC)N(CCOC)Cc1sccc1Br ZINC000043678325 336270694 /nfs/dbraw/zinc/27/06/94/336270694.db2.gz XXFBSXFVAUBRSE-UHFFFAOYSA-N 0 1 320.296 4.148 20 0 DIADMN COc1ncc(CN2CC[C@H](c3ccccc3C)C2)cc1Cl ZINC000532779169 336270976 /nfs/dbraw/zinc/27/09/76/336270976.db2.gz NHLWHNZBLCBQKP-HNNXBMFYSA-N 0 1 316.832 4.042 20 0 DIADMN Cc1c([C@@H](C)N[C@@H](C)c2ccccc2C(F)(F)F)cnn1C ZINC000192852407 336272027 /nfs/dbraw/zinc/27/20/27/336272027.db2.gz MOXKSEBQWYSTEB-WDEREUQCSA-N 0 1 311.351 4.159 20 0 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Cc1cc(C)cc(CSc2nc(-c3ccccc3O)n[nH]2)c1 ZINC000193045063 336287407 /nfs/dbraw/zinc/28/74/07/336287407.db2.gz DBTZCOSQNBHYTJ-UHFFFAOYSA-N 0 1 311.410 4.086 20 0 DIADMN C[NH+](C)[C@H](CNc1cc[nH+]c2cc(Cl)ccc12)c1ccco1 ZINC000301060706 336287814 /nfs/dbraw/zinc/28/78/14/336287814.db2.gz RWYJNCYGVIZMRW-MRXNPFEDSA-N 0 1 315.804 4.196 20 0 DIADMN CC(C)Oc1ccc(CNc2ccnc3cc(F)ccc32)cn1 ZINC000301279358 336298388 /nfs/dbraw/zinc/29/83/88/336298388.db2.gz PPYDUJHIEJKHPE-UHFFFAOYSA-N 0 1 311.360 4.168 20 0 DIADMN Fc1ccc2c(c1)nccc2NCc1ccc2c(c1)OCCCO2 ZINC000301289574 336298955 /nfs/dbraw/zinc/29/89/55/336298955.db2.gz SPGDFKNAMLOOGZ-UHFFFAOYSA-N 0 1 324.355 4.147 20 0 DIADMN C[C@@H](O)C[C@@H]1CCCCCN1Cc1csc(C2CCCC2)n1 ZINC000352879237 336299704 /nfs/dbraw/zinc/29/97/04/336299704.db2.gz VHDMNWUWXDAILO-PBHICJAKSA-N 0 1 322.518 4.316 20 0 DIADMN Fc1ccc2c(c1)nccc2N[C@H]1CCOc2ccc(F)cc21 ZINC000301305181 336299929 /nfs/dbraw/zinc/29/99/29/336299929.db2.gz ZPRWCDYFVURRFJ-INIZCTEOSA-N 0 1 312.319 4.449 20 0 DIADMN Fc1ccc2c(c1)nccc2NCCCc1nc2ccccc2[nH]1 ZINC000301521338 336312129 /nfs/dbraw/zinc/31/21/29/336312129.db2.gz FUBUAGSATYWISF-UHFFFAOYSA-N 0 1 320.371 4.295 20 0 DIADMN Fc1cccnc1NC[C@H](c1cccc(Cl)c1)N1CCCC1 ZINC000301547687 336313990 /nfs/dbraw/zinc/31/39/90/336313990.db2.gz FAJVBHGJUBTEMW-MRXNPFEDSA-N 0 1 319.811 4.123 20 0 DIADMN OCCC1(CNc2ccnc3cc(F)ccc32)CCCCC1 ZINC000301551702 336314291 /nfs/dbraw/zinc/31/42/91/336314291.db2.gz HDPVTGBDRZTERN-UHFFFAOYSA-N 0 1 302.393 4.119 20 0 DIADMN COC[C@H](Nc1cc(C)nc2ccc(F)cc21)c1ccc(C)o1 ZINC000301662695 336321591 /nfs/dbraw/zinc/32/15/91/336321591.db2.gz KDTVOLMZUVLURF-KRWDZBQOSA-N 0 1 314.360 4.383 20 0 DIADMN Cc1cc(NC[C@@](C)(O)c2ccccc2)c2cc(F)ccc2n1 ZINC000301680844 336323052 /nfs/dbraw/zinc/32/30/52/336323052.db2.gz RUXFPQDCLIQECH-LJQANCHMSA-N 0 1 310.372 4.002 20 0 DIADMN Fc1ccc2c(c1)nccc2N[C@@H]1CCOC2(CCCC2)C1 ZINC000301716582 336325326 /nfs/dbraw/zinc/32/53/26/336325326.db2.gz XULSWJOFJXFQGA-CQSZACIVSA-N 0 1 300.377 4.278 20 0 DIADMN O[C@H]1CCC[C@H](CNc2ccnc3cc(C(F)(F)F)ccc32)C1 ZINC000301768603 336328578 /nfs/dbraw/zinc/32/85/78/336328578.db2.gz CMBOBPKGRBWRQQ-AAEUAGOBSA-N 0 1 324.346 4.217 20 0 DIADMN O[C@@H]1CCC[C@H](CNc2ccnc3cc(C(F)(F)F)ccc32)C1 ZINC000301768605 336328585 /nfs/dbraw/zinc/32/85/85/336328585.db2.gz CMBOBPKGRBWRQQ-WCQYABFASA-N 0 1 324.346 4.217 20 0 DIADMN Cc1cc(N[C@@H]2[C@@H]3CCO[C@@H]3C23CCC3)c2cc(F)ccc2n1 ZINC000301804994 336331257 /nfs/dbraw/zinc/33/12/57/336331257.db2.gz DTGKNKBGCYQCTL-VHSSKADRSA-N 0 1 312.388 4.052 20 0 DIADMN COC[C@@H](Nc1cc(C)nc2ccc(F)cc21)c1ccccc1 ZINC000301941974 336339215 /nfs/dbraw/zinc/33/92/15/336339215.db2.gz WPPMRLRUYSAHQW-LJQANCHMSA-N 0 1 310.372 4.482 20 0 DIADMN Cc1cnc([C@H](C)CNc2ccnc3cc(F)ccc32)s1 ZINC000302124305 336349634 /nfs/dbraw/zinc/34/96/34/336349634.db2.gz HOMAMGCLQJELLL-SNVBAGLBSA-N 0 1 301.390 4.354 20 0 DIADMN FC(F)(F)c1ccc2c(c1)nccc2N[C@@H]1C[C@H]2OCCC[C@@H]12 ZINC000302515313 336360654 /nfs/dbraw/zinc/36/06/54/336360654.db2.gz AJNUMWNDIRSZDQ-APHBMKBZSA-N 0 1 322.330 4.233 20 0 DIADMN CC(C)[C@H]1CCN([C@H](C)c2nnc(-c3ccccc3F)s2)C1 ZINC000514111672 336364750 /nfs/dbraw/zinc/36/47/50/336364750.db2.gz SPGCFFDIAPGBJD-OLZOCXBDSA-N 0 1 319.449 4.383 20 0 DIADMN CC(C)[C@@H]1CCN([C@H](C)c2nnc(-c3ccccc3F)s2)C1 ZINC000514111671 336364768 /nfs/dbraw/zinc/36/47/68/336364768.db2.gz SPGCFFDIAPGBJD-CHWSQXEVSA-N 0 1 319.449 4.383 20 0 DIADMN CC(C)[C@H]1CCN([C@@H](C)c2nnc(-c3ccccc3F)s2)C1 ZINC000514111674 336364811 /nfs/dbraw/zinc/36/48/11/336364811.db2.gz SPGCFFDIAPGBJD-STQMWFEESA-N 0 1 319.449 4.383 20 0 DIADMN CC[C@@H]1CCN([C@@H](C)c2nnc(-c3ccccc3F)s2)C1 ZINC000514112333 336365018 /nfs/dbraw/zinc/36/50/18/336365018.db2.gz XUXCWYAUJBIEPM-NWDGAFQWSA-N 0 1 305.422 4.137 20 0 DIADMN CO[C@H]1CC[C@H](Nc2ccnc3cc(C(F)(F)F)ccc32)C1 ZINC000302763709 336368087 /nfs/dbraw/zinc/36/80/87/336368087.db2.gz KZMYMUMEJOFULX-RYUDHWBXSA-N 0 1 310.319 4.233 20 0 DIADMN Cc1cc(N2CCC(c3ccncc3)CC2)c2cc(F)ccc2n1 ZINC000302795786 336369439 /nfs/dbraw/zinc/36/94/39/336369439.db2.gz PELSQEOTDGFSQY-UHFFFAOYSA-N 0 1 321.399 4.461 20 0 DIADMN CC[C@@](C)(NC[C@H](OC)c1ccc(Cl)cc1)c1nccs1 ZINC000514118837 336369893 /nfs/dbraw/zinc/36/98/93/336369893.db2.gz NSKOOBOESNYAQH-GOEBONIOSA-N 0 1 324.877 4.399 20 0 DIADMN Cc1ccnc([C@@H](Nc2ccnc3cc(F)ccc32)C2CC2)n1 ZINC000302814359 336370289 /nfs/dbraw/zinc/37/02/89/336370289.db2.gz HYSHRCMAQGNPME-KRWDZBQOSA-N 0 1 308.360 4.036 20 0 DIADMN COc1ccc(CN[C@@H](C)c2ccc(Cl)c(Cl)c2)nc1 ZINC000514121938 336371721 /nfs/dbraw/zinc/37/17/21/336371721.db2.gz BQLOUPGVJMXLNO-JTQLQIEISA-N 0 1 311.212 4.248 20 0 DIADMN c1cc(CNCc2ccncc2OCc2ccccc2)cs1 ZINC000352896876 336373784 /nfs/dbraw/zinc/37/37/84/336373784.db2.gz KILCYFDTMJRDNR-UHFFFAOYSA-N 0 1 310.422 4.012 20 0 DIADMN CCCCn1cc(CN[C@@H](CC)c2ccccc2F)c(C)n1 ZINC000352909264 336376405 /nfs/dbraw/zinc/37/64/05/336376405.db2.gz LAVXBVHLWUDPDA-SFHVURJKSA-N 0 1 303.425 4.372 20 0 DIADMN c1cc(Sc2ccccn2)oc1CN1CCCC2(CC2)C1 ZINC000352964800 336379776 /nfs/dbraw/zinc/37/97/76/336379776.db2.gz UWQBDGHYXGSYBU-UHFFFAOYSA-N 0 1 300.427 4.202 20 0 DIADMN CC[C@@H](NCc1ccc(Cl)o1)c1ccc(OC)c(OC)c1 ZINC000353022663 336380290 /nfs/dbraw/zinc/38/02/90/336380290.db2.gz WFFYVEASMFLDKM-CYBMUJFWSA-N 0 1 309.793 4.191 20 0 DIADMN CC[C@@H](N[C@@H](CCOC)c1ccc(C)o1)c1ccccc1OC ZINC000352972849 336380786 /nfs/dbraw/zinc/38/07/86/336380786.db2.gz ZIBMSZFVGQUTCP-SJORKVTESA-N 0 1 317.429 4.415 20 0 DIADMN Cc1csc(CN2CCC(Cc3ccc(F)cc3)CC2)n1 ZINC000352982011 336381061 /nfs/dbraw/zinc/38/10/61/336381061.db2.gz BKBQHXHJRXVEPL-UHFFFAOYSA-N 0 1 304.434 4.045 20 0 DIADMN CC(C)COc1ccccc1CN1CCC[C@@H]1c1ccccn1 ZINC000563931620 336385115 /nfs/dbraw/zinc/38/51/15/336385115.db2.gz NARYUTGXHSGUEJ-LJQANCHMSA-N 0 1 310.441 4.454 20 0 DIADMN Cc1ncncc1[C@H](C)N[C@H]1CCCOc2cc(Cl)ccc21 ZINC000514615428 336386370 /nfs/dbraw/zinc/38/63/70/336386370.db2.gz YITOGQFDYMBEIL-LRDDRELGSA-N 0 1 317.820 4.003 20 0 DIADMN C[C@H]1C[C@H]1c1ccc(CNCc2cccc(OCC(F)F)c2)o1 ZINC000105483562 336387587 /nfs/dbraw/zinc/38/75/87/336387587.db2.gz VVZMROMWXIYBEB-BLLLJJGKSA-N 0 1 321.367 4.337 20 0 DIADMN COC(=O)c1csc([C@H](C)NCc2ccc(SC)cc2)c1 ZINC000563984736 336389281 /nfs/dbraw/zinc/38/92/81/336389281.db2.gz VXXNWNOHKPBPPO-NSHDSACASA-N 0 1 321.467 4.107 20 0 DIADMN Cc1ccc(NC(=O)c2ccc(O)c(Cl)c2)c2cccnc12 ZINC000193075229 336394697 /nfs/dbraw/zinc/39/46/97/336394697.db2.gz LSLHPODPGHBANS-UHFFFAOYSA-N 0 1 312.756 4.155 20 0 DIADMN FC(F)(F)COc1ccccc1NCc1ccc2nc[nH]c2c1 ZINC000532888429 336395542 /nfs/dbraw/zinc/39/55/42/336395542.db2.gz ZMJGZKOWSAWBEU-UHFFFAOYSA-N 0 1 321.302 4.116 20 0 DIADMN Cc1ccc(NC(=O)C(C)C)cc1NCc1ccc2nc[nH]c2c1 ZINC000532890859 336397690 /nfs/dbraw/zinc/39/76/90/336397690.db2.gz KOSUPWVCPKQVRJ-UHFFFAOYSA-N 0 1 322.412 4.078 20 0 DIADMN CC[C@H](N[C@H](C)c1nccc2ccccc21)c1c(C)nn(C)c1C ZINC000353278742 336409808 /nfs/dbraw/zinc/40/98/08/336409808.db2.gz XLUZWIIWWOKQDV-KDOFPFPSSA-N 0 1 322.456 4.387 20 0 DIADMN CC(C)Sc1ccc([C@H](C)N[C@H](C)c2ccc(=O)[nH]n2)cc1 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CSc1ccc(CN2CCC(F)(c3cccnc3)CC2)s1 ZINC000356353295 336547158 /nfs/dbraw/zinc/54/71/58/336547158.db2.gz ZSYRCBIRVXTYRY-UHFFFAOYSA-N 0 1 322.474 4.326 20 0 DIADMN C[C@H](NCc1ccc(-c2ccncc2)cc1)c1ccc(F)cn1 ZINC000356700631 336558635 /nfs/dbraw/zinc/55/86/35/336558635.db2.gz QWFUCZGYFJIPKD-AWEZNQCLSA-N 0 1 307.372 4.134 20 0 DIADMN Cc1cc2[nH]c(CN[C@@H]3COCc4ccccc43)cc2c(C)c1 ZINC000418108307 336560872 /nfs/dbraw/zinc/56/08/72/336560872.db2.gz REIDCKHVJLVVTB-HXUWFJFHSA-N 0 1 306.409 4.146 20 0 DIADMN CCOc1ccc([C@H](C)NCc2ccoc2C)cc1OCC ZINC000358024810 336607019 /nfs/dbraw/zinc/60/70/19/336607019.db2.gz SAXXMRQPBRXMRE-ZDUSSCGKSA-N 0 1 303.402 4.236 20 0 DIADMN CSc1ccccc1CN[C@H](C)c1cccc(NC(C)=O)c1 ZINC000358061987 336609250 /nfs/dbraw/zinc/60/92/50/336609250.db2.gz LQHBJWZNJYMSCS-CYBMUJFWSA-N 0 1 314.454 4.218 20 0 DIADMN CCOc1ccccc1CN[C@@H]1CCCOc2ccc(C)cc21 ZINC000358093058 336611263 /nfs/dbraw/zinc/61/12/63/336611263.db2.gz ZBPPUGOOJIGQIK-GOSISDBHSA-N 0 1 311.425 4.397 20 0 DIADMN CCOc1ccccc1CN[C@H]1CCCOc2ccc(C)cc21 ZINC000358093061 336611268 /nfs/dbraw/zinc/61/12/68/336611268.db2.gz ZBPPUGOOJIGQIK-SFHVURJKSA-N 0 1 311.425 4.397 20 0 DIADMN CCc1ccc([C@H](CC)NCc2cn3c(cccc3C)n2)cc1 ZINC000358165485 336614348 /nfs/dbraw/zinc/61/43/48/336614348.db2.gz VWIAZJUZVSFKOO-IBGZPJMESA-N 0 1 307.441 4.446 20 0 DIADMN CCCCCn1cc(CN[C@@H](C)c2sc(C)nc2C)c(C)n1 ZINC000358253254 336619637 /nfs/dbraw/zinc/61/96/37/336619637.db2.gz WBNIHFRTUUCGBR-ZDUSSCGKSA-N 0 1 320.506 4.306 20 0 DIADMN Cc1nc2c(s1)[C@H](N[C@@H]1COc3ccc(Cl)cc31)CCC2 ZINC000358271921 336620623 /nfs/dbraw/zinc/62/06/23/336620623.db2.gz YUHIVFMKSDRXAD-ZIAGYGMSSA-N 0 1 320.845 4.206 20 0 DIADMN C[C@H](NCc1ccc2c(c1)COC2)c1ccc2ccccc2n1 ZINC000358301068 336622686 /nfs/dbraw/zinc/62/26/86/336622686.db2.gz OPURZLQLNQYCDV-AWEZNQCLSA-N 0 1 304.393 4.116 20 0 DIADMN Cc1cncc(CN[C@H]2CCCOc3cc4c(cc32)CCCC4)c1 ZINC000358348957 336625402 /nfs/dbraw/zinc/62/54/02/336625402.db2.gz DGXFZATWVRJMKE-FQEVSTJZSA-N 0 1 322.452 4.272 20 0 DIADMN Fc1ccccc1CN[C@@H]1CCCc2nn(-c3ccccc3)cc21 ZINC000358913976 336647254 /nfs/dbraw/zinc/64/72/54/336647254.db2.gz JQOMDMXCLQDVDE-LJQANCHMSA-N 0 1 321.399 4.179 20 0 DIADMN CC(C)[C@@H](N[C@H]1CCCc2nn(C)cc21)c1ccc(F)cc1F ZINC000358960597 336649701 /nfs/dbraw/zinc/64/97/01/336649701.db2.gz ZLRIQLJJMJVHNS-FUHWJXTLSA-N 0 1 319.399 4.063 20 0 DIADMN COCCCC[C@H](N[C@@H](C)c1ccc(F)cn1)c1ccccc1 ZINC000359023422 336653824 /nfs/dbraw/zinc/65/38/24/336653824.db2.gz ZLEAISAYRLIHKW-KXBFYZLASA-N 0 1 316.420 4.429 20 0 DIADMN CC(=O)Nc1ccc([C@H](C)NCc2ccc3ccccc3n2)cc1 ZINC000359240198 336664060 /nfs/dbraw/zinc/66/40/60/336664060.db2.gz YFJJBDQILWJGBN-AWEZNQCLSA-N 0 1 319.408 4.044 20 0 DIADMN CCS[C@H](C)c1noc(CN[C@H]2CCC(C)(C)C[C@H]2C)n1 ZINC000360285535 336707196 /nfs/dbraw/zinc/70/71/96/336707196.db2.gz NUQIYRRGJUHYOC-UPJWGTAASA-N 0 1 311.495 4.188 20 0 DIADMN C[C@@H]1Oc2cc(F)ccc2[C@@H]1N[C@@H]1CCCc2ccc(O)cc21 ZINC000361000656 336731886 /nfs/dbraw/zinc/73/18/86/336731886.db2.gz 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1 315.388 4.399 20 0 DIADMN COc1cccc(-c2nc(CN(C)[C@H](C)C3(C)CC3)cs2)c1 ZINC000437536632 338312924 /nfs/dbraw/zinc/31/29/24/338312924.db2.gz NCXGRKVBKXUHPG-CYBMUJFWSA-N 0 1 316.470 4.439 20 0 DIADMN CCS[C@@H]1CC[C@@H](N(C)Cc2ccn(C(CC)CC)n2)C1 ZINC000437575131 338313880 /nfs/dbraw/zinc/31/38/80/338313880.db2.gz GKPKFMNDUNBUQA-IAGOWNOFSA-N 0 1 309.523 4.350 20 0 DIADMN CN(Cc1ccc(Cl)s1)Cc1c[nH]nc1-c1ccsc1 ZINC000437578586 338314356 /nfs/dbraw/zinc/31/43/56/338314356.db2.gz GQHOXJYAVYIFMV-UHFFFAOYSA-N 0 1 323.874 4.485 20 0 DIADMN CC(C)CCOC1CCN(Cc2cc3c(cccc3F)[nH]2)CC1 ZINC000437583539 338314726 /nfs/dbraw/zinc/31/47/26/338314726.db2.gz SWESYYURYWRIQV-UHFFFAOYSA-N 0 1 318.436 4.334 20 0 DIADMN Oc1ccc(C2=CCN(Cc3cc4c(cccc4F)[nH]3)CC2)cc1 ZINC000437589591 338315182 /nfs/dbraw/zinc/31/51/82/338315182.db2.gz LCIHAVCZEZRACH-UHFFFAOYSA-N 0 1 322.383 4.302 20 0 DIADMN Cc1cccc(CN(C)Cc2cnn(Cc3ccc(F)cc3)c2)c1 ZINC000437589877 338315207 /nfs/dbraw/zinc/31/52/07/338315207.db2.gz LHSAWNWETBEIIQ-UHFFFAOYSA-N 0 1 323.415 4.011 20 0 DIADMN Cc1ccccc1CN(C)Cc1cnn(Cc2ccc(F)cc2)c1 ZINC000437588359 338315231 /nfs/dbraw/zinc/31/52/31/338315231.db2.gz BLPVKABDARNGOO-UHFFFAOYSA-N 0 1 323.415 4.011 20 0 DIADMN Cc1ccc2cc(CN3CCOC4(CCCCC4)C3)ccc2n1 ZINC000438120437 338333282 /nfs/dbraw/zinc/33/32/82/338333282.db2.gz WGKGGQFOHAJYSQ-UHFFFAOYSA-N 0 1 310.441 4.078 20 0 DIADMN C[C@@H](O)C[C@H]1CCCN1Cc1cc(Cl)cc(C(F)(F)F)c1 ZINC000438125314 338333712 /nfs/dbraw/zinc/33/37/12/338333712.db2.gz WGXSBZJSAWFHSF-QMTHXVAHSA-N 0 1 321.770 4.094 20 0 DIADMN Cc1ccc(CN2CCC[C@@H]2c2nc3ccc(Cl)cc3[nH]2)o1 ZINC000438290133 338338690 /nfs/dbraw/zinc/33/86/90/338338690.db2.gz MTLDNXGUDRJZSK-MRXNPFEDSA-N 0 1 315.804 4.455 20 0 DIADMN CCOc1ccccc1CNCc1ccccc1N(C)C(C)C ZINC000438343304 338340443 /nfs/dbraw/zinc/34/04/43/338340443.db2.gz BJZVPMCASGVJIV-UHFFFAOYSA-N 0 1 312.457 4.220 20 0 DIADMN CC(C)[C@@H](CC(F)(F)F)NCc1csc(-c2ccco2)n1 ZINC000438472250 338344968 /nfs/dbraw/zinc/34/49/68/338344968.db2.gz 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/nfs/dbraw/zinc/39/73/97/338397397.db2.gz WCHQDHXJSQAIOE-PBHICJAKSA-N 0 1 314.404 4.338 20 0 DIADMN CCc1cc(C(=O)N2CCCCC[C@@H]2/C=C/c2ccccc2)n[nH]1 ZINC000440861700 338398788 /nfs/dbraw/zinc/39/87/88/338398788.db2.gz SJMMKNOXPOHPGE-QFQMRYFISA-N 0 1 323.440 4.070 20 0 DIADMN Cc1nc(-c2ccc(CN[C@@H](C)c3cccc(O)c3)o2)cs1 ZINC000442645444 338426662 /nfs/dbraw/zinc/42/66/62/338426662.db2.gz INRKILWXKVPXKM-NSHDSACASA-N 0 1 314.410 4.268 20 0 DIADMN Cc1cccc([C@@H](C)NCc2ccncc2OCC(F)F)c1C ZINC000442868538 338436395 /nfs/dbraw/zinc/43/63/95/338436395.db2.gz NYTVFTUDMBAPNZ-CQSZACIVSA-N 0 1 320.383 4.193 20 0 DIADMN CCO[C@H](CNCc1ncc(C(C)C)s1)c1ccccc1 ZINC000194467670 338534143 /nfs/dbraw/zinc/53/41/43/338534143.db2.gz VZCRRSXANPJXIU-OAHLLOKOSA-N 0 1 304.459 4.134 20 0 DIADMN CC[C@H](NCc1cn2cc(Cl)ccc2n1)c1cccc(F)c1 ZINC000446756651 338535095 /nfs/dbraw/zinc/53/50/95/338535095.db2.gz LCQOMKHNULRCTJ-INIZCTEOSA-N 0 1 317.795 4.368 20 0 DIADMN C[C@@H](CN[C@H](c1ncc[nH]1)c1ccccc1)c1ccc(F)cc1 ZINC000446832075 338537388 /nfs/dbraw/zinc/53/73/88/338537388.db2.gz LRMNEYSHXNJABP-KSSFIOAISA-N 0 1 309.388 4.032 20 0 DIADMN NC1(c2nc(-c3c(Cl)cccc3Cl)no2)CCCCC1 ZINC000446849356 338538530 /nfs/dbraw/zinc/53/85/30/338538530.db2.gz NMVGKSJUGNSNDH-UHFFFAOYSA-N 0 1 312.200 4.162 20 0 DIADMN CC(C)CC1(CNC(=O)c2sccc2CN(C)C)CCCC1 ZINC000446889438 338539668 /nfs/dbraw/zinc/53/96/68/338539668.db2.gz WZWIGQBMPQXRMF-UHFFFAOYSA-N 0 1 322.518 4.146 20 0 DIADMN CN(C)Cc1ccsc1C(=O)N1CCC[C@@H](C(C)(C)C)CC1 ZINC000446910413 338540307 /nfs/dbraw/zinc/54/03/07/338540307.db2.gz ARJDXUORDMVTIO-OAHLLOKOSA-N 0 1 322.518 4.098 20 0 DIADMN CC(C)CC1(CN[C@@H](c2ncc[nH]2)c2ccc(F)cc2)CCC1 ZINC000446927694 338540830 /nfs/dbraw/zinc/54/08/30/338540830.db2.gz CHCOROARSXONLX-QGZVFWFLSA-N 0 1 315.436 4.444 20 0 DIADMN CCOc1ncccc1CN[C@H]1C[C@H](C(C)C)c2ccccc21 ZINC000447544343 338555863 /nfs/dbraw/zinc/55/58/63/338555863.db2.gz ULJZVYQFNIJRFF-MOPGFXCFSA-N 0 1 310.441 4.455 20 0 DIADMN CCOc1ncccc1CN[C@@H]1C[C@@H](C(C)C)c2ccccc21 ZINC000447544345 338555865 /nfs/dbraw/zinc/55/58/65/338555865.db2.gz ULJZVYQFNIJRFF-RBUKOAKNSA-N 0 1 310.441 4.455 20 0 DIADMN Fc1ccc2c(c1)CCC[C@@H]2NCc1ccc2c(n1)CCCC2 ZINC000447552778 338556297 /nfs/dbraw/zinc/55/62/97/338556297.db2.gz OMHMHTVUEUNVQK-FQEVSTJZSA-N 0 1 310.416 4.267 20 0 DIADMN CCOc1ccc([C@H](C)N[C@H]2CCCc3occc32)cc1OC ZINC000447554017 338556465 /nfs/dbraw/zinc/55/64/65/338556465.db2.gz YOPNGAKTRAYQPY-BBRMVZONSA-N 0 1 315.413 4.415 20 0 DIADMN CSCc1cc(F)ccc1CN[C@@H]1CCCc2occc21 ZINC000447583822 338559219 /nfs/dbraw/zinc/55/92/19/338559219.db2.gz COXMYHINEDQGHZ-MRXNPFEDSA-N 0 1 305.418 4.449 20 0 DIADMN CC(C)O[C@@H]1C[C@@H](NCc2ncc(C(C)(C)C)s2)C1(C)C ZINC000447893351 338570539 /nfs/dbraw/zinc/57/05/39/338570539.db2.gz LZAIDLXVPBORCW-CHWSQXEVSA-N 0 1 310.507 4.122 20 0 DIADMN C[C@@H](CNCc1ncc(C(C)(C)C)s1)Oc1cccc(F)c1 ZINC000447939918 338572152 /nfs/dbraw/zinc/57/21/52/338572152.db2.gz ADQHUFAQPDOXPG-LBPRGKRZSA-N 0 1 322.449 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1041810584 /nfs/dbraw/zinc/81/05/84/1041810584.db2.gz ZRBDPZVLDGDFOZ-NSHDSACASA-N 0 1 323.717 4.198 20 0 DIADMN C[C@H](Nc1ccnc2[nH]cnc21)c1ccccc1C(F)(F)F ZINC001170743652 1041813142 /nfs/dbraw/zinc/81/31/42/1041813142.db2.gz XKVDEPGUBDXFHT-VIFPVBQESA-N 0 1 306.291 4.150 20 0 DIADMN CCc1nnc([C@@H](C)N[C@H]2CC(C)(C)CCc3ccccc32)[nH]1 ZINC000660476666 1041816895 /nfs/dbraw/zinc/81/68/95/1041816895.db2.gz HJMLHNRCVHOXHK-CJNGLKHVSA-N 0 1 312.461 4.122 20 0 DIADMN CN(Cc1cc(C2CC2)no1)[C@H]1CCCC[C@H]1C(F)(F)F ZINC000660595388 1041839697 /nfs/dbraw/zinc/83/96/97/1041839697.db2.gz DGFTWPBSSIIFCI-OCCSQVGLSA-N 0 1 302.340 4.105 20 0 DIADMN Cc1nc(CN2CCC(c3ccc(F)cc3C)CC2)c(C)o1 ZINC000660606977 1041842453 /nfs/dbraw/zinc/84/24/53/1041842453.db2.gz SLOJUIFGZBVCJA-UHFFFAOYSA-N 0 1 302.393 4.119 20 0 DIADMN Cc1cc(Br)c(CN[C@@H](C)c2ccncc2)s1 ZINC000651580567 1041843897 /nfs/dbraw/zinc/84/38/97/1041843897.db2.gz JJLDNYJXVWVQFX-JTQLQIEISA-N 0 1 311.248 4.065 20 0 DIADMN Clc1cccc([C@@H]2CCN(Cc3ccnc(Cl)c3)C2)c1 ZINC000814668536 1041850420 /nfs/dbraw/zinc/85/04/20/1041850420.db2.gz VUGGUQMZIUFZMF-CQSZACIVSA-N 0 1 307.224 4.378 20 0 DIADMN Cc1cc(CN[C@H](c2ccc(F)c(Cl)c2)C2CC2)nc(C)n1 ZINC000660676374 1041850783 /nfs/dbraw/zinc/85/07/83/1041850783.db2.gz IXBXFDKHHZNYOA-KRWDZBQOSA-N 0 1 319.811 4.127 20 0 DIADMN Cc1nn(C)c(Cl)c1CN1CC[C@H](c2cccc(Cl)c2)C1 ZINC000814666051 1041851149 /nfs/dbraw/zinc/85/11/49/1041851149.db2.gz BKQIPALTXAIMNP-ZDUSSCGKSA-N 0 1 324.255 4.025 20 0 DIADMN Cc1cc(CN[C@@H](c2ccc(F)c(Cl)c2)C2CC2)nc(C)n1 ZINC000660676375 1041851530 /nfs/dbraw/zinc/85/15/30/1041851530.db2.gz IXBXFDKHHZNYOA-QGZVFWFLSA-N 0 1 319.811 4.127 20 0 DIADMN CC(C)(C)CCOCSc1nc(CCC2CCCC2)n[nH]1 ZINC000814738306 1041860260 /nfs/dbraw/zinc/86/02/60/1041860260.db2.gz VNIGHSYRROLKCJ-UHFFFAOYSA-N 0 1 311.495 4.430 20 0 DIADMN CC(C)(C)CCOCSc1n[nH]c(CCC2CCCC2)n1 ZINC000814738306 1041860269 /nfs/dbraw/zinc/86/02/69/1041860269.db2.gz VNIGHSYRROLKCJ-UHFFFAOYSA-N 0 1 311.495 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CCCCN1CCN(C(=O)OC(C)(C)C)C[C@H]1c1ccccc1 ZINC001170939414 1042199029 /nfs/dbraw/zinc/19/90/29/1042199029.db2.gz UYDSGCQCZNSVMK-KRWDZBQOSA-N 0 1 318.461 4.081 20 0 DIADMN CCN(CC)[C@H](C(=O)N[C@@H](C)c1ccc(C)cc1)c1ccccc1 ZINC000303240320 1042199899 /nfs/dbraw/zinc/19/98/99/1042199899.db2.gz JFARFLMLZOHVSM-PXNSSMCTSA-N 0 1 324.468 4.255 20 0 DIADMN C[C@H](N[C@H]1CCCc2cccnc21)c1cccc(OC(F)F)c1 ZINC000321517626 1042202926 /nfs/dbraw/zinc/20/29/26/1042202926.db2.gz CJXHDJYIERQRHW-LRDDRELGSA-N 0 1 318.367 4.411 20 0 DIADMN Clc1ccccc1C[C@@H](NCc1cccnc1)c1ccoc1 ZINC000820805713 1042228232 /nfs/dbraw/zinc/22/82/32/1042228232.db2.gz QEFJPOSFFSWTCZ-GOSISDBHSA-N 0 1 312.800 4.402 20 0 DIADMN COC(=O)c1ccc(CN[C@@H](c2ccc(Cl)cc2)C(C)C)o1 ZINC000393433926 1042236441 /nfs/dbraw/zinc/23/64/41/1042236441.db2.gz QGHVODWUVALFFS-MRXNPFEDSA-N 0 1 321.804 4.207 20 0 DIADMN COc1ccc([C@@H](N[C@@H](C)c2nc(C)cs2)C2CC2)cc1 ZINC000080273641 1042241891 /nfs/dbraw/zinc/24/18/91/1042241891.db2.gz 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CC(C)[C@@H]1CC[C@@H](C)C[C@H]1CNC(=O)c1cccc2nc[nH]c21 ZINC001136488244 1042262036 /nfs/dbraw/zinc/26/20/36/1042262036.db2.gz JHANKRLKKSPPFA-ILXRZTDVSA-N 0 1 313.445 4.001 20 0 DIADMN O=C(c1cccc2[nH]c(C(F)F)nc21)N1CCCCCCCC1 ZINC000821769457 1042264381 /nfs/dbraw/zinc/26/43/81/1042264381.db2.gz GQUUHJLIBCOKKU-UHFFFAOYSA-N 0 1 321.371 4.297 20 0 DIADMN C[C@@H](N[C@H]1CCc2cccnc21)c1cccc(C(F)(F)F)c1 ZINC000318179404 1042264806 /nfs/dbraw/zinc/26/48/06/1042264806.db2.gz DJLBKBAFFCNFLZ-ABAIWWIYSA-N 0 1 306.331 4.439 20 0 DIADMN CC1=C(C(=O)Nc2nc(-c3ccc(C(C)(C)C)cc3)n[nH]2)CCC1 ZINC001136506228 1042265723 /nfs/dbraw/zinc/26/57/23/1042265723.db2.gz HTWILWKAIUFNNO-UHFFFAOYSA-N 0 1 324.428 4.208 20 0 DIADMN CC(C)(C)SCCN[C@@H](c1ccc(F)cc1)c1ccccn1 ZINC000753676663 1042266062 /nfs/dbraw/zinc/26/60/62/1042266062.db2.gz JJRSRDYLNZUBHL-KRWDZBQOSA-N 0 1 318.461 4.431 20 0 DIADMN COCc1cccc(CN[C@H](C)c2ccc(F)cc2Cl)c1 ZINC000038010736 1042267103 /nfs/dbraw/zinc/26/71/03/1042267103.db2.gz 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CCOc1ccc(Br)cc1CN1CCC2(CCC2)C1 ZINC001138992085 1046351889 /nfs/dbraw/zinc/35/18/89/1046351889.db2.gz CUOCNOFUIDJHAD-UHFFFAOYSA-N 0 1 324.262 4.224 20 0 DIADMN CCOc1ccc(C[N@H+]2CC[C@@H]2c2ccccc2)cc1OCC ZINC001138975505 1046347727 /nfs/dbraw/zinc/34/77/27/1046347727.db2.gz JLJUARXHJYHKSV-GOSISDBHSA-N 0 1 311.425 4.431 20 0 DIADMN CCOc1ccc(CN2CC[C@@H]2c2ccccc2)cc1OCC ZINC001138975505 1046347743 /nfs/dbraw/zinc/34/77/43/1046347743.db2.gz JLJUARXHJYHKSV-GOSISDBHSA-N 0 1 311.425 4.431 20 0 DIADMN CC(C)Oc1ccc(Br)cc1CN1CC[C@@H](C)C1 ZINC001138989784 1046352145 /nfs/dbraw/zinc/35/21/45/1046352145.db2.gz JHBJXMGSSXFJRI-GFCCVEGCSA-N 0 1 312.251 4.078 20 0 DIADMN CC(C)N1CCN(Cc2ccc(-c3cccs3)s2)CC1 ZINC001139017364 1046358013 /nfs/dbraw/zinc/35/80/13/1046358013.db2.gz NXNLUHGJBYZKFU-UHFFFAOYSA-N 0 1 306.500 4.003 20 0 DIADMN CC1(C)CN(Cc2ccc(C(F)F)nc2)CC[C@H]1C(F)(F)F ZINC000639100497 1046358257 /nfs/dbraw/zinc/35/82/57/1046358257.db2.gz WZKFUWNQSRKYNX-GFCCVEGCSA-N 0 1 322.321 4.430 20 0 DIADMN 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/nfs/dbraw/zinc/41/81/29/1046418129.db2.gz QUAJFBVGCOMKRA-HNNXBMFYSA-N 0 1 318.367 4.351 20 0 DIADMN FC(F)[C@@H]1CCC[N@@H+](Cc2ccc(Oc3ccccc3)nc2)C1 ZINC001139247020 1046418391 /nfs/dbraw/zinc/41/83/91/1046418391.db2.gz QUAJFBVGCOMKRA-OAHLLOKOSA-N 0 1 318.367 4.351 20 0 DIADMN FC(F)[C@@H]1CCCN(Cc2ccc(Oc3ccccc3)nc2)C1 ZINC001139247020 1046418394 /nfs/dbraw/zinc/41/83/94/1046418394.db2.gz QUAJFBVGCOMKRA-OAHLLOKOSA-N 0 1 318.367 4.351 20 0 DIADMN COC[C@H]1CC[N@H+]1Cc1ccccc1Oc1ccc(Cl)cc1 ZINC001139261487 1046420575 /nfs/dbraw/zinc/42/05/75/1046420575.db2.gz IUIDEGAXEOCLKM-MRXNPFEDSA-N 0 1 317.816 4.353 20 0 DIADMN COC[C@H]1CCN1Cc1ccccc1Oc1ccc(Cl)cc1 ZINC001139261487 1046420578 /nfs/dbraw/zinc/42/05/78/1046420578.db2.gz IUIDEGAXEOCLKM-MRXNPFEDSA-N 0 1 317.816 4.353 20 0 DIADMN c1ccc2sc(CN3CCC[C@@H](c4cccnc4)C3)nc2c1 ZINC000639695439 1046422136 /nfs/dbraw/zinc/42/21/36/1046422136.db2.gz USGOTIBHOKNYKS-OAHLLOKOSA-N 0 1 309.438 4.071 20 0 DIADMN C[C@@H]1CCC[C@@H](C)N1Cc1[nH]c(-c2ccccc2)nc1Cl ZINC001139277113 1046422343 /nfs/dbraw/zinc/42/23/43/1046422343.db2.gz LBLYXAGYRHGFIR-CHWSQXEVSA-N 0 1 303.837 4.493 20 0 DIADMN C[C@@H]1CCN(Cc2[nH]c(-c3ccccc3)nc2Cl)[C@@H](C)C1 ZINC001139281992 1046423346 /nfs/dbraw/zinc/42/33/46/1046423346.db2.gz SMZDOMJIGVQMHY-OLZOCXBDSA-N 0 1 303.837 4.351 20 0 DIADMN Cc1nc(-c2ccccc2)oc1C[N@@H+]1CCC[C@H](OC(C)C)C1 ZINC000639719381 1046423896 /nfs/dbraw/zinc/42/38/96/1046423896.db2.gz DLHONOAEUNBDOC-KRWDZBQOSA-N 0 1 314.429 4.039 20 0 DIADMN CC[C@H]1CCCCN1Cc1[nH]c(-c2ccccc2)nc1Cl ZINC001139281812 1046424266 /nfs/dbraw/zinc/42/42/66/1046424266.db2.gz QTBGOBFQEPZPME-AWEZNQCLSA-N 0 1 303.837 4.495 20 0 DIADMN CC(C)N(Cc1[nH]c(-c2ccccc2)nc1Cl)CC1CC1 ZINC001139281632 1046424330 /nfs/dbraw/zinc/42/43/30/1046424330.db2.gz MQVBJPXYSKJKJH-UHFFFAOYSA-N 0 1 303.837 4.351 20 0 DIADMN CN(Cc1[nH]c(-c2ccccc2)nc1Cl)CC1CCCC1 ZINC001139283967 1046424449 /nfs/dbraw/zinc/42/44/49/1046424449.db2.gz AURQIUFORVAOHU-UHFFFAOYSA-N 0 1 303.837 4.352 20 0 DIADMN Clc1nc(-c2ccccc2)[nH]c1CN1CCC[C@@H]2CCC[C@H]21 ZINC001139280729 1046424465 /nfs/dbraw/zinc/42/44/65/1046424465.db2.gz BCWNTNQABXCQSP-XJKSGUPXSA-N 0 1 315.848 4.495 20 0 DIADMN C[C@@H]1CN(Cc2[nH]c(-c3ccccc3)nc2Cl)C2(CC2)C1 ZINC001139284834 1046425456 /nfs/dbraw/zinc/42/54/56/1046425456.db2.gz KPSNDIJZGPYCLJ-LBPRGKRZSA-N 0 1 301.821 4.105 20 0 DIADMN COc1ccc(-c2ccc(CN3C[C@@H](F)C[C@H]3C)s2)cc1 ZINC001139285477 1046425562 /nfs/dbraw/zinc/42/55/62/1046425562.db2.gz FIALUBXHPSTZPV-OCCSQVGLSA-N 0 1 305.418 4.356 20 0 DIADMN Cc1cnc([C@H](C)N2CCC3(CC2)c2ccccc2N=C3C)o1 ZINC000639729234 1046425665 /nfs/dbraw/zinc/42/56/65/1046425665.db2.gz LKEMJWSUFDLJJX-AWEZNQCLSA-N 0 1 309.413 4.184 20 0 DIADMN Fc1ccc(Oc2ccccc2CN2CCSCC2)cc1 ZINC001139301034 1046427035 /nfs/dbraw/zinc/42/70/35/1046427035.db2.gz RYRHZAJXAOEIRG-UHFFFAOYSA-N 0 1 303.402 4.167 20 0 DIADMN COc1ccccc1C1(NCc2ccc3c(c2)CC(C)(C)O3)CC1 ZINC001202920853 1046428146 /nfs/dbraw/zinc/42/81/46/1046428146.db2.gz BOVLKATUVKYKOW-UHFFFAOYSA-N 0 1 323.436 4.188 20 0 DIADMN F[C@H]1CCN(Cc2ccc(-c3ccc(C(F)(F)F)cn3)cc2)C1 ZINC001139330985 1046428917 /nfs/dbraw/zinc/42/89/17/1046428917.db2.gz HAGKPMCHCLYODL-HNNXBMFYSA-N 0 1 324.321 4.311 20 0 DIADMN O=C(C[N@H+]1CCCC12CCCCC2)Nc1ccc(F)c(Cl)c1 ZINC001168223396 1046432458 /nfs/dbraw/zinc/43/24/58/1046432458.db2.gz YUXBYRLMLVPPEV-UHFFFAOYSA-N 0 1 324.827 4.216 20 0 DIADMN CC(C)c1ccc(NC(=O)Nc2c(O)cc(F)cc2F)cc1 ZINC001202924555 1046432695 /nfs/dbraw/zinc/43/26/95/1046432695.db2.gz HUBUSIUBGYAJHT-UHFFFAOYSA-N 0 1 306.312 4.438 20 0 DIADMN C[C@]1(F)CCCN(Cc2cscc2Br)CC1 ZINC001139347596 1046433328 /nfs/dbraw/zinc/43/33/28/1046433328.db2.gz KJVXNYVZPDMXNM-LBPRGKRZSA-N 0 1 306.244 4.225 20 0 DIADMN C[C@H]1Cc2ccccc2C[N@H+]1Cc1ccc(N2CCCCC2)nc1 ZINC001139345133 1046433121 /nfs/dbraw/zinc/43/31/21/1046433121.db2.gz CWHOYLLDEQJDIU-KRWDZBQOSA-N 0 1 321.468 4.019 20 0 DIADMN C[C@H]1Cc2ccccc2CN1Cc1ccc(N2CCCCC2)nc1 ZINC001139345133 1046433126 /nfs/dbraw/zinc/43/31/26/1046433126.db2.gz CWHOYLLDEQJDIU-KRWDZBQOSA-N 0 1 321.468 4.019 20 0 DIADMN C[C@]1(F)CCC[N@@H+](Cc2cscc2Br)CC1 ZINC001139347596 1046433321 /nfs/dbraw/zinc/43/33/21/1046433321.db2.gz KJVXNYVZPDMXNM-LBPRGKRZSA-N 0 1 306.244 4.225 20 0 DIADMN CC[C@H](C(=O)Nc1ccc(CN(C)C)c(F)c1)c1ccccc1 ZINC000749155170 1046434462 /nfs/dbraw/zinc/43/44/62/1046434462.db2.gz RMECLAMCQXUIQG-KRWDZBQOSA-N 0 1 314.404 4.020 20 0 DIADMN C[C@@H]1Cc2cc(F)ccc2[C@H](C)N1C[C@@H](O)c1cccc(F)c1 ZINC001168233645 1046435612 /nfs/dbraw/zinc/43/56/12/1046435612.db2.gz GUCROJORUHXAOE-QHRIQVFBSA-N 0 1 317.379 4.006 20 0 DIADMN C[C@@H]1CCCCN1Cc1cccn1Cc1cnc(Cl)s1 ZINC001139364635 1046438338 /nfs/dbraw/zinc/43/83/38/1046438338.db2.gz ZZWQTJHFHUYQCA-GFCCVEGCSA-N 0 1 309.866 4.021 20 0 DIADMN Clc1ncc(Cn2cccc2CN2CC3CCC2CC3)s1 ZINC001139367340 1046439085 /nfs/dbraw/zinc/43/90/85/1046439085.db2.gz KBDSSWROPHSRKI-UHFFFAOYSA-N 0 1 321.877 4.021 20 0 DIADMN Cc1nc([C@H](C)NCCOc2c(C)cccc2C)c(C)s1 ZINC000676839798 1046441052 /nfs/dbraw/zinc/44/10/52/1046441052.db2.gz QWMZKVHFFNUXOE-ZDUSSCGKSA-N 0 1 304.459 4.106 20 0 DIADMN Cc1oc(-c2ccsc2)nc1CN1CCC(CCF)CC1 ZINC000639988417 1046441417 /nfs/dbraw/zinc/44/14/17/1046441417.db2.gz DBIQEBDOJQJSDD-UHFFFAOYSA-N 0 1 308.422 4.283 20 0 DIADMN CC(=O)c1c(C)cc(C)c(CN[C@H](C)c2cnc(C)s2)c1C ZINC000639995791 1046441661 /nfs/dbraw/zinc/44/16/61/1046441661.db2.gz ZHHVMAQOTOOXMZ-CYBMUJFWSA-N 0 1 316.470 4.430 20 0 DIADMN COc1ccc(C(C)C)cc1CN[C@@H](C)c1cnc(C)s1 ZINC000639996166 1046441888 /nfs/dbraw/zinc/44/18/88/1046441888.db2.gz GMAVGXMRRBNQGE-LBPRGKRZSA-N 0 1 304.459 4.434 20 0 DIADMN Cc1c(CN(C)Cc2cccc3ccccc32)nc2ccccn21 ZINC001137272238 1046447673 /nfs/dbraw/zinc/44/76/73/1046447673.db2.gz NKAASWJFGQGZEV-UHFFFAOYSA-N 0 1 315.420 4.428 20 0 DIADMN Cc1c(CN2CCC(c3cccs3)CC2)nc2ccccn12 ZINC001137272398 1046447908 /nfs/dbraw/zinc/44/79/08/1046447908.db2.gz UEOUCJQQFCMDJF-UHFFFAOYSA-N 0 1 311.454 4.084 20 0 DIADMN Cc1c(CN2CCC(c3ccccc3F)CC2)nc2ccccn12 ZINC001137272064 1046448042 /nfs/dbraw/zinc/44/80/42/1046448042.db2.gz GMBDQZBNJTZXAT-UHFFFAOYSA-N 0 1 323.415 4.161 20 0 DIADMN CCc1nnc(CN[C@@H]2CCC(C)(C)C[C@@H]2c2ccccc2)o1 ZINC000640107447 1046448330 /nfs/dbraw/zinc/44/83/30/1046448330.db2.gz QBTRMRYTKOIHCU-HZPDHXFCSA-N 0 1 313.445 4.084 20 0 DIADMN Cc1ncc(CN[C@@H]2CCCOc3ccc(Cl)cc32)s1 ZINC000123643074 1046449015 /nfs/dbraw/zinc/44/90/15/1046449015.db2.gz RIMMLYMKDCYQLL-CQSZACIVSA-N 0 1 308.834 4.108 20 0 DIADMN CC[C@H](CN(CC)C(=O)c1cc(C(F)F)[nH]n1)c1ccccc1 ZINC000640129876 1046449286 /nfs/dbraw/zinc/44/92/86/1046449286.db2.gz JAAXHYPXZJLFLU-GFCCVEGCSA-N 0 1 321.371 4.003 20 0 DIADMN CC[C@@H](CN(CC)C(=O)c1cc(C(F)F)[nH]n1)c1ccccc1 ZINC000640129877 1046449455 /nfs/dbraw/zinc/44/94/55/1046449455.db2.gz JAAXHYPXZJLFLU-LBPRGKRZSA-N 0 1 321.371 4.003 20 0 DIADMN Fc1cccc(F)c1-c1nc(CN2CCC[C@@H](C3CC3)C2)co1 ZINC000677040730 1046456317 /nfs/dbraw/zinc/45/63/17/1046456317.db2.gz VCNVYOSTDLYGNC-CYBMUJFWSA-N 0 1 318.367 4.242 20 0 DIADMN COc1ccc2oc(CN[C@H]3CCCOc4ccccc43)cc2c1 ZINC000124670279 1046459142 /nfs/dbraw/zinc/45/91/42/1046459142.db2.gz POAODKABRVMJIV-SFHVURJKSA-N 0 1 323.392 4.445 20 0 DIADMN c1ccc(-c2ccc(CN3CCC[C@H]3c3ccncc3)cn2)cc1 ZINC001139518158 1046460544 /nfs/dbraw/zinc/46/05/44/1046460544.db2.gz OTSWIAPFZIJQHB-NRFANRHFSA-N 0 1 315.420 4.481 20 0 DIADMN CC(C)(C)OC(=O)n1cc(CN2CC(C)(C)C2)c2ccccc21 ZINC001139526494 1046463413 /nfs/dbraw/zinc/46/34/13/1046463413.db2.gz XSBNUTIMIGDSSN-UHFFFAOYSA-N 0 1 314.429 4.266 20 0 DIADMN C[C@H](NC(=O)[C@H]1CCC(C)(C)C1)c1nc2ccc(Cl)cc2[nH]1 ZINC000781649083 1046465731 /nfs/dbraw/zinc/46/57/31/1046465731.db2.gz OFFAGQHJLLNPBZ-QWRGUYRKSA-N 0 1 319.836 4.220 20 0 DIADMN CCN(Cc1ccc(OC(F)(F)F)cc1)Cc1ccccn1 ZINC000125359523 1046466382 /nfs/dbraw/zinc/46/63/82/1046466382.db2.gz VPFUELMJZLAWTH-UHFFFAOYSA-N 0 1 310.319 4.002 20 0 DIADMN FC(F)(F)c1cnc2[nH]cc(CN3C4CCCC3CCC4)c2c1 ZINC001139540243 1046467151 /nfs/dbraw/zinc/46/71/51/1046467151.db2.gz FNYAPHPPHVSMOH-UHFFFAOYSA-N 0 1 323.362 4.489 20 0 DIADMN FC(F)(F)c1ccccc1CN1CCC[C@H]1c1ccncc1 ZINC000125449340 1046468091 /nfs/dbraw/zinc/46/80/91/1046468091.db2.gz SPNKEHDJQCMTJM-INIZCTEOSA-N 0 1 306.331 4.438 20 0 DIADMN Cc1cc(N2CCC(c3ccccn3)CC2)c2cc(F)ccc2n1 ZINC000677151224 1046469917 /nfs/dbraw/zinc/46/99/17/1046469917.db2.gz GHXGZIBHRCYIQF-UHFFFAOYSA-N 0 1 321.399 4.461 20 0 DIADMN COc1ccc(CN2CCC(OC3CCCCC3)CC2)cc1F ZINC000125590151 1046470447 /nfs/dbraw/zinc/47/04/47/1046470447.db2.gz HCEFDPPYNFJENM-UHFFFAOYSA-N 0 1 321.436 4.148 20 0 DIADMN C[C@@H](c1cc(F)ccc1F)N1CCC(c2ccccn2)CC1 ZINC000677187704 1046472871 /nfs/dbraw/zinc/47/28/71/1046472871.db2.gz DOWWMOMWLCPAAM-ZDUSSCGKSA-N 0 1 302.368 4.300 20 0 DIADMN C[C@H](c1ccc(F)c(F)c1)N1CCC(c2ccccn2)CC1 ZINC000677187854 1046473110 /nfs/dbraw/zinc/47/31/10/1046473110.db2.gz HZMAYJLHLILPAK-CYBMUJFWSA-N 0 1 302.368 4.300 20 0 DIADMN Cc1csc(CN2CCC(Oc3ccncc3)CC2)c1Cl ZINC001137287541 1046473195 /nfs/dbraw/zinc/47/31/95/1046473195.db2.gz ODPKAJWLRUIDPE-UHFFFAOYSA-N 0 1 322.861 4.148 20 0 DIADMN FC(F)(F)c1ccccc1CN1CCC(c2ccccn2)CC1 ZINC000677186575 1046473207 /nfs/dbraw/zinc/47/32/07/1046473207.db2.gz FLQJRJJBFYGKRR-UHFFFAOYSA-N 0 1 320.358 4.480 20 0 DIADMN Cc1ccccc1[C@H]1CCCN1Cc1cn2c(cccc2F)n1 ZINC001139568124 1046474760 /nfs/dbraw/zinc/47/47/60/1046474760.db2.gz IJGGCMQPNNNJPC-QGZVFWFLSA-N 0 1 309.388 4.119 20 0 DIADMN Fc1cccc2nc(CN3CCC[C@@H](c4ccccc4)CC3)cn21 ZINC001139573250 1046474989 /nfs/dbraw/zinc/47/49/89/1046474989.db2.gz CREWHERJDOBAAP-QGZVFWFLSA-N 0 1 323.415 4.243 20 0 DIADMN Cc1cc(C)c(NC(=O)Nc2ncc(Cl)cc2O)c(C)c1 ZINC001202949672 1046476445 /nfs/dbraw/zinc/47/64/45/1046476445.db2.gz GYZKNJSAMVMFRV-UHFFFAOYSA-N 0 1 305.765 4.010 20 0 DIADMN COc1nc(C)cc(C)c1CN[C@H]1CCCc2ccc(C)cc21 ZINC000677237664 1046476484 /nfs/dbraw/zinc/47/64/84/1046476484.db2.gz MYOKDCCHCBTVEO-IBGZPJMESA-N 0 1 310.441 4.183 20 0 DIADMN Cc1cnc(Cl)c(CN2CCC(c3ccccc3)CC2)c1 ZINC001139587909 1046479184 /nfs/dbraw/zinc/47/91/84/1046479184.db2.gz FACFBVGUCALRLR-UHFFFAOYSA-N 0 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321.509 4.055 20 0 DIADMN CCC[C@@H](Nc1nc(Cl)nc2[nH]cnc21)c1ccc(C)cc1 ZINC001162628251 1048317608 /nfs/dbraw/zinc/31/76/08/1048317608.db2.gz USCGVTOYOJIIQC-GFCCVEGCSA-N 0 1 315.808 4.268 20 0 DIADMN Fc1ccccc1[C@@H]1CCN(c2ccncc2C(F)(F)F)C1 ZINC001186550631 1048321126 /nfs/dbraw/zinc/32/11/26/1048321126.db2.gz UNIATBYKMWMYKD-LLVKDONJSA-N 0 1 310.294 4.233 20 0 DIADMN Oc1cncc(Nc2cc(Cl)c(Cl)c(Cl)c2O)c1 ZINC001201648040 1048344731 /nfs/dbraw/zinc/34/47/31/1048344731.db2.gz HBYDDJQZFITTLR-UHFFFAOYSA-N 0 1 305.548 4.197 20 0 DIADMN CC1(C)CC[C@@H](CN2CC=C(c3c(F)cccc3F)CC2)O1 ZINC000481193349 1048329269 /nfs/dbraw/zinc/32/92/69/1048329269.db2.gz SPBCNXDDVUEQRU-AWEZNQCLSA-N 0 1 307.384 4.012 20 0 DIADMN Cc1cccc(C)c1CNCc1nc(C(C)C)n2ccccc12 ZINC001201607779 1048329868 /nfs/dbraw/zinc/32/98/68/1048329868.db2.gz HBVHPANERICJAR-UHFFFAOYSA-N 0 1 307.441 4.364 20 0 DIADMN CCN(Cc1cc(C(F)(F)F)ccc1Cl)C[C@@H](C)OC ZINC001205926593 1048350519 /nfs/dbraw/zinc/35/05/19/1048350519.db2.gz 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1048359558 /nfs/dbraw/zinc/35/95/58/1048359558.db2.gz YRUYLARYYNAUQT-UHFFFAOYSA-N 0 1 318.174 4.083 20 0 DIADMN CC(C)(C)OC(=O)[C@@H]1CCCCN1C[C@@H]1CCCCC1(F)F ZINC001175587113 1048360919 /nfs/dbraw/zinc/36/09/19/1048360919.db2.gz PBSYMWJJHJBCNY-KBPBESRZSA-N 0 1 317.420 4.008 20 0 DIADMN Cc1cc2[nH]ncc2cc1NC(=O)[C@H](C)c1cc2ccccc2o1 ZINC000481312466 1048361085 /nfs/dbraw/zinc/36/10/85/1048361085.db2.gz SXBNVKJGHHWPAW-GFCCVEGCSA-N 0 1 319.364 4.360 20 0 DIADMN Cc1cc2[nH]ncc2cc1NC(=O)[C@@]1(C)CCCc2ccccc21 ZINC000481301999 1048362584 /nfs/dbraw/zinc/36/25/84/1048362584.db2.gz BNPDZSNZCIHWOU-FQEVSTJZSA-N 0 1 319.408 4.104 20 0 DIADMN Oc1cc(Cl)cc(CN[C@@H]2CCCOc3cc(F)ccc32)c1 ZINC001201742589 1048363548 /nfs/dbraw/zinc/36/35/48/1048363548.db2.gz QGDFXOULKCKOMJ-MRXNPFEDSA-N 0 1 321.779 4.188 20 0 DIADMN Cc1cc2[nH]ncc2cc1NC(=O)c1cc2c(s1)CCCC2 ZINC000481321700 1048364807 /nfs/dbraw/zinc/36/48/07/1048364807.db2.gz LSAQTCAPFIGRLS-UHFFFAOYSA-N 0 1 311.410 4.064 20 0 DIADMN CCC[C@@H](C(=O)Nc1cc2cn[nH]c2cc1C)c1ccccc1 ZINC000481320283 1048365368 /nfs/dbraw/zinc/36/53/68/1048365368.db2.gz ZIUNMIPSFMGCRX-MRXNPFEDSA-N 0 1 307.397 4.394 20 0 DIADMN CCC[C@H](C(=O)Nc1cc2cn[nH]c2cc1C)c1ccccc1 ZINC000481320282 1048365526 /nfs/dbraw/zinc/36/55/26/1048365526.db2.gz ZIUNMIPSFMGCRX-INIZCTEOSA-N 0 1 307.397 4.394 20 0 DIADMN Cc1cc2[nH]ncc2cc1NC(=O)c1cccc(OCC(C)C)c1 ZINC000481325222 1048367401 /nfs/dbraw/zinc/36/74/01/1048367401.db2.gz UMTOTQXNFBFTMK-UHFFFAOYSA-N 0 1 323.396 4.158 20 0 DIADMN Cc1cc2[nH]ncc2cc1NC(=O)[C@H](C)CCCc1ccccc1 ZINC000481323355 1048367961 /nfs/dbraw/zinc/36/79/61/1048367961.db2.gz OKRPQYLHGIMETP-CQSZACIVSA-N 0 1 321.424 4.469 20 0 DIADMN Cc1ccccc1C(C)(C)C(=O)Nc1cc2cn[nH]c2cc1C ZINC000481326240 1048368276 /nfs/dbraw/zinc/36/82/76/1048368276.db2.gz BFIRSCJFVMORAR-UHFFFAOYSA-N 0 1 307.397 4.096 20 0 DIADMN CC[C@H](C(=O)Nc1cc2cn[nH]c2cc1C)c1ccc(F)cc1 ZINC000481327991 1048369407 /nfs/dbraw/zinc/36/94/07/1048369407.db2.gz PDEZVTKPBGBGRW-HNNXBMFYSA-N 0 1 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C[C@H](N[C@@H]1C[C@H](C)[N@H+](C2CC2)C1)c1cc(Cl)sc1Cl ZINC000484290473 1048920455 /nfs/dbraw/zinc/92/04/55/1048920455.db2.gz DOVSGYJUKNBERV-LPEHRKFASA-N 0 1 319.301 4.331 20 0 DIADMN COc1ccc2c(c1)nccc2Nc1cccc(OC)c1OC ZINC001203526439 1048920436 /nfs/dbraw/zinc/92/04/36/1048920436.db2.gz XGRPLVWVIDTLBH-UHFFFAOYSA-N 0 1 310.353 4.004 20 0 DIADMN COc1ccc2c(c1)nccc2Nc1cc(Cl)ccc1CO ZINC001203527951 1048920640 /nfs/dbraw/zinc/92/06/40/1048920640.db2.gz IFJYHYVAKPTIMW-UHFFFAOYSA-N 0 1 314.772 4.133 20 0 DIADMN COc1ccc2c(c1)nccc2Nc1c(O)cccc1Cl ZINC001203526450 1048920952 /nfs/dbraw/zinc/92/09/52/1048920952.db2.gz XTFWUFMXBLNKNX-UHFFFAOYSA-N 0 1 300.745 4.346 20 0 DIADMN COc1ccc2c(c1)nccc2Nc1ccc(C(C)=O)cc1F ZINC001203527938 1048921079 /nfs/dbraw/zinc/92/10/79/1048921079.db2.gz HOVGBETWYLJAKG-UHFFFAOYSA-N 0 1 310.328 4.329 20 0 DIADMN COc1ccc2c(c1)nccc2Nc1cc(OC)c(OC)cc1C ZINC001203526284 1048921192 /nfs/dbraw/zinc/92/11/92/1048921192.db2.gz SBHKBIWFWLFAIV-UHFFFAOYSA-N 0 1 324.380 4.313 20 0 DIADMN CCN(Cc1ccc(Cl)cc1)Cc1cc(OC)ccc1OC ZINC001203529255 1048921274 /nfs/dbraw/zinc/92/12/74/1048921274.db2.gz WBHFXBPXOCMUBB-UHFFFAOYSA-N 0 1 319.832 4.379 20 0 DIADMN COCCOc1cccc(Nc2ccnc3cc(OC)ccc32)c1 ZINC001203528419 1048922253 /nfs/dbraw/zinc/92/22/53/1048922253.db2.gz OAWQVGXUYLFBCV-UHFFFAOYSA-N 0 1 324.380 4.012 20 0 DIADMN COc1ccc2c(c1)nccc2Nc1c(C)cc(C)c(N)c1C ZINC001203526145 1048922527 /nfs/dbraw/zinc/92/25/27/1048922527.db2.gz OVVJZCJAJAPUQX-UHFFFAOYSA-N 0 1 307.397 4.494 20 0 DIADMN COc1ccc2c(c1)nccc2Nc1cccc(C(C)=O)c1C ZINC001203528344 1048922818 /nfs/dbraw/zinc/92/28/18/1048922818.db2.gz MLBOYOPVIJYYHO-UHFFFAOYSA-N 0 1 306.365 4.498 20 0 DIADMN CCCN(Cc1cscn1)[C@H]1C[C@@H](OCC)C12CCCCC2 ZINC001191320092 1048924085 /nfs/dbraw/zinc/92/40/85/1048924085.db2.gz UYZPFCSUGOTDFU-DLBZAZTESA-N 0 1 322.518 4.483 20 0 DIADMN COc1ccc2c(c1)nccc2Nc1cc(F)c(F)c(OC)c1 ZINC001203530509 1048924714 /nfs/dbraw/zinc/92/47/14/1048924714.db2.gz ZAQRHYVQECBKII-UHFFFAOYSA-N 0 1 316.307 4.274 20 0 DIADMN CCCN(Cc1cscn1)[C@@H]1C[C@@H](OCC)C12CCCCC2 ZINC001191320093 1048924632 /nfs/dbraw/zinc/92/46/32/1048924632.db2.gz UYZPFCSUGOTDFU-IAGOWNOFSA-N 0 1 322.518 4.483 20 0 DIADMN COc1ccc2c(c1)nccc2Nc1ccc(C2(C)COC2)cc1 ZINC001203530220 1048924957 /nfs/dbraw/zinc/92/49/57/1048924957.db2.gz SIZAOPLIQYEWMF-UHFFFAOYSA-N 0 1 320.392 4.275 20 0 DIADMN COc1ccc2c(c1)nccc2Nc1ccc(CO)cc1Cl ZINC001203530533 1048925298 /nfs/dbraw/zinc/92/52/98/1048925298.db2.gz ZZVFPMRLVSRZDY-UHFFFAOYSA-N 0 1 314.772 4.133 20 0 DIADMN CCCN(Cc1cscn1)[C@H]1C[C@H](OCC)C12CCCCC2 ZINC001191320095 1048926038 /nfs/dbraw/zinc/92/60/38/1048926038.db2.gz UYZPFCSUGOTDFU-IRXDYDNUSA-N 0 1 322.518 4.483 20 0 DIADMN c1cn2cc(Nc3cncc(Oc4ccccc4)c3)ccc2n1 ZINC001203555980 1048927222 /nfs/dbraw/zinc/92/72/22/1048927222.db2.gz MTRNQWQSBSSNFW-UHFFFAOYSA-N 0 1 302.337 4.265 20 0 DIADMN Cc1ccc(CCCN(C)Cc2nc3c(s2)CCCC3)cc1 ZINC001191358796 1048927962 /nfs/dbraw/zinc/92/79/62/1048927962.db2.gz QEUQSICQDHWTRN-UHFFFAOYSA-N 0 1 314.498 4.395 20 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Cc1nc(CN2CCc3ccc(Cl)cc3[C@@H](C)C2)ccc1F ZINC001237823282 1055538555 /nfs/dbraw/zinc/53/85/55/1055538555.db2.gz IJKVPLDBRYITCY-LBPRGKRZSA-N 0 1 318.823 4.344 20 0 DIADMN CCOc1ccc([C@@H]2CCCN2Cc2occc2OC)cc1 ZINC001237872944 1055544956 /nfs/dbraw/zinc/54/49/56/1055544956.db2.gz ADTPZPDPYCTRRG-INIZCTEOSA-N 0 1 301.386 4.024 20 0 DIADMN COc1cccc(CN2CCC[C@H](C)[C@H]2C)c1Br ZINC001237860205 1055545134 /nfs/dbraw/zinc/54/51/34/1055545134.db2.gz DVCLIFPRIGALMO-NWDGAFQWSA-N 0 1 312.251 4.078 20 0 DIADMN CC(C)C[N@@H+](Cc1cc2cc(F)ccc2o1)CC(C)(C)C(=O)[O-] ZINC000901838774 1055547285 /nfs/dbraw/zinc/54/72/85/1055547285.db2.gz LRTVPMYFPWTJHW-UHFFFAOYSA-N 0 1 321.392 4.141 20 0 DIADMN C[C@H](CCc1ccccc1)CNc1ccc(F)c(-c2nc[nH]n2)c1 ZINC001620936340 1055549269 /nfs/dbraw/zinc/54/92/69/1055549269.db2.gz ZTFDTNRIYXSHTB-CQSZACIVSA-N 0 1 324.403 4.292 20 0 DIADMN CCOC(=O)c1ccccc1CN1CCC[C@H]1c1ccccc1 ZINC001237886915 1055550612 /nfs/dbraw/zinc/55/06/12/1055550612.db2.gz NUGHMQQKKDPJJL-IBGZPJMESA-N 0 1 309.409 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COC(=O)c1oc(CN(C)Cc2ccc3ccccc3c2)cc1C ZINC000025923312 1055588068 /nfs/dbraw/zinc/58/80/68/1055588068.db2.gz IAXYJPPKYXGQQV-UHFFFAOYSA-N 0 1 323.392 4.160 20 0 DIADMN Cc1ccc(-c2nc(CN3CCC[C@H](F)CC3)cs2)cc1 ZINC001238036599 1055589937 /nfs/dbraw/zinc/58/99/37/1055589937.db2.gz JLJOCEKRBOMTNE-HNNXBMFYSA-N 0 1 304.434 4.443 20 0 DIADMN CCOC(=O)c1c(Cl)cccc1CN1CCC2(CCCC2)C1 ZINC001238042673 1055590103 /nfs/dbraw/zinc/59/01/03/1055590103.db2.gz CWWMNJLSLCCGEP-UHFFFAOYSA-N 0 1 321.848 4.283 20 0 DIADMN C[C@H](c1cccc(Cl)c1)N(C)C(=O)c1cccc2[nH]cnc21 ZINC001595385848 1055591931 /nfs/dbraw/zinc/59/19/31/1055591931.db2.gz VTZCAXHEBJMKNZ-LLVKDONJSA-N 0 1 313.788 4.050 20 0 DIADMN CCOC(=O)c1c(Cl)cccc1CN1CC2CCC(CC2)C1 ZINC001238045903 1055594508 /nfs/dbraw/zinc/59/45/08/1055594508.db2.gz DAMSSKWGBMDERM-UHFFFAOYSA-N 0 1 321.848 4.139 20 0 DIADMN CCOC(=O)c1c(Cl)cccc1CN1CC[C@H]2CCC[C@H]2C1 ZINC001238047182 1055594574 /nfs/dbraw/zinc/59/45/74/1055594574.db2.gz WQTZDZKQPHJFPD-KGLIPLIRSA-N 0 1 321.848 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CCn1nc(C)c(CNCc2ccc(Cl)c(Cl)c2)c1C ZINC000066995743 1056909031 /nfs/dbraw/zinc/90/90/31/1056909031.db2.gz ABRWURWWBWSIAD-UHFFFAOYSA-N 0 1 312.244 4.116 20 0 DIADMN CCOc1cccc(Cl)c1CN[C@H]1C[C@@H](OCC)C12CCC2 ZINC001618000819 1056911872 /nfs/dbraw/zinc/91/18/72/1056911872.db2.gz JUUBKWSHXLYXLP-DLBZAZTESA-N 0 1 323.864 4.176 20 0 DIADMN CCCCOCCN(C)[C@H](C)c1nc2ccc(Cl)cc2[nH]1 ZINC001618012984 1056914095 /nfs/dbraw/zinc/91/40/95/1056914095.db2.gz UVKSTAWTZVXKDE-GFCCVEGCSA-N 0 1 309.841 4.026 20 0 DIADMN COc1cc(OC)cc(-c2cccc3nc(C(F)(F)F)[nH]c32)c1 ZINC001241132041 1056914190 /nfs/dbraw/zinc/91/41/90/1056914190.db2.gz QINANZHEOGUXTP-UHFFFAOYSA-N 0 1 322.286 4.266 20 0 DIADMN Cc1ccc(CCN2CCO[C@H](c3ccc(Cl)cc3)C2)cc1 ZINC001618107241 1056924187 /nfs/dbraw/zinc/92/41/87/1056924187.db2.gz YQFAAIFEPIJBEW-IBGZPJMESA-N 0 1 315.844 4.264 20 0 DIADMN CC(C)C[C@H](C)N1CCc2c(F)ccc(Br)c2C1 ZINC001618234363 1056935436 /nfs/dbraw/zinc/93/54/36/1056935436.db2.gz JSKMKPYYNYYCCJ-NSHDSACASA-N 0 1 314.242 4.381 20 0 DIADMN Fc1cc(F)c(-c2cnccc2CN2CCCCC2)c(F)c1 ZINC001241172003 1056944483 /nfs/dbraw/zinc/94/44/83/1056944483.db2.gz CRKZQEFBVDBBRX-UHFFFAOYSA-N 0 1 306.331 4.152 20 0 DIADMN CC1(C)CN(CCc2c(F)cccc2F)Cc2ccccc2O1 ZINC001618287459 1056945258 /nfs/dbraw/zinc/94/52/58/1056945258.db2.gz JNISVUMQOCSDTD-UHFFFAOYSA-N 0 1 317.379 4.181 20 0 DIADMN CC(C)Cc1ccccc1CN1CCC2(C1)Oc1ccccc1O2 ZINC001618294071 1056946648 /nfs/dbraw/zinc/94/66/48/1056946648.db2.gz SDQBWKVQDWNKKE-UHFFFAOYSA-N 0 1 323.436 4.259 20 0 DIADMN Cc1[nH]ncc1CCCNC(=O)[C@@H](CC1CCCCC1)C(C)C ZINC000115711618 1056947905 /nfs/dbraw/zinc/94/79/05/1056947905.db2.gz ZPOLMQNFMSPWEI-SFHVURJKSA-N 0 1 319.493 4.010 20 0 DIADMN COc1cc2[nH]cnc2cc1-c1cccc(O[C@@H]2CCCCO2)c1 ZINC001241212391 1056961409 /nfs/dbraw/zinc/96/14/09/1056961409.db2.gz HDTZDZCLVXOQRV-LJQANCHMSA-N 0 1 324.380 4.144 20 0 DIADMN Cc1nc2cccc(-c3cccc(O[C@H]4CCCCO4)c3)c2[nH]1 ZINC001241212442 1056962021 /nfs/dbraw/zinc/96/20/21/1056962021.db2.gz HQDUJNJKCZMUHP-SFHVURJKSA-N 0 1 308.381 4.444 20 0 DIADMN FC(F)(F)c1nc2cccc(-c3ccc4c(c3)OCC4)c2[nH]1 ZINC001241229265 1056969564 /nfs/dbraw/zinc/96/95/64/1056969564.db2.gz WJXVDXLJRNJTDP-UHFFFAOYSA-N 0 1 304.271 4.184 20 0 DIADMN Fc1ccc2c(c1)[C@@H](N[C@H]1CCCOc3ccc(F)cc31)CC2 ZINC000358016680 1056970460 /nfs/dbraw/zinc/97/04/60/1056970460.db2.gz GOMYRGFNEOIYNB-ROUUACIJSA-N 0 1 315.363 4.456 20 0 DIADMN CC(C)(C)c1nc2nc[nH]c2c(-c2ccc(Cl)c(F)c2)n1 ZINC001241230642 1056970644 /nfs/dbraw/zinc/97/06/44/1056970644.db2.gz VYJDFCADVGNCQH-UHFFFAOYSA-N 0 1 304.756 4.062 20 0 DIADMN Fc1ccc2c(c1)[C@H](N[C@H]1CCCOc3ccc(F)cc31)CC2 ZINC000358016682 1056971388 /nfs/dbraw/zinc/97/13/88/1056971388.db2.gz GOMYRGFNEOIYNB-ZWKOTPCHSA-N 0 1 315.363 4.456 20 0 DIADMN CCOC(=O)c1cc2cc(-c3ccc(Cl)c(F)c3)cnc2[nH]1 ZINC001241232213 1056971387 /nfs/dbraw/zinc/97/13/87/1056971387.db2.gz OZXHNAKZGBRJGD-UHFFFAOYSA-N 0 1 318.735 4.199 20 0 DIADMN C[C@H](CCCC(C)(C)O)Nc1ccc(C2C=NC(=S)N2)cc1 ZINC001168712788 1056974305 /nfs/dbraw/zinc/97/43/05/1056974305.db2.gz UCGCDQDRXGVTOO-GFCCVEGCSA-N 0 1 319.474 4.107 20 0 DIADMN Cc1nc(C)c(CN[C@@H](C)c2ccccc2OC(C)C)s1 ZINC000080693604 1056979730 /nfs/dbraw/zinc/97/97/30/1056979730.db2.gz XJKAYLCZUCHTSF-LBPRGKRZSA-N 0 1 304.459 4.398 20 0 DIADMN Cc1ccc2oc(CNCc3cnn(CC4CCC4)c3)cc2c1 ZINC000922248679 1056987395 /nfs/dbraw/zinc/98/73/95/1056987395.db2.gz SNKUBCADGWHLHO-UHFFFAOYSA-N 0 1 309.413 4.028 20 0 DIADMN CC(C)(C)c1n[nH]cc1CNCc1cc(Cl)cc(Cl)c1 ZINC000657525376 1056990127 /nfs/dbraw/zinc/99/01/27/1056990127.db2.gz YZHWOYITRKCBQR-UHFFFAOYSA-N 0 1 312.244 4.304 20 0 DIADMN CCOc1ccc(-c2nc[nH]c3nc(=S)sc2-3)c(C)c1 ZINC001241270361 1056990465 /nfs/dbraw/zinc/99/04/65/1056990465.db2.gz PNCJYTNENKSSBD-UHFFFAOYSA-N 0 1 303.412 4.075 20 0 DIADMN Brc1cc(CN[C@@H](c2ccccn2)C2CC2)cs1 ZINC000922585882 1057036635 /nfs/dbraw/zinc/03/66/35/1057036635.db2.gz HXEZKIGIHRXTQU-CQSZACIVSA-N 0 1 323.259 4.147 20 0 DIADMN Clc1cccc(Cl)c1COc1ccccc1-c1nnc[nH]1 ZINC000158101737 1056999774 /nfs/dbraw/zinc/99/97/74/1056999774.db2.gz CRGQIPAHBSJETI-UHFFFAOYSA-N 0 1 320.179 4.358 20 0 DIADMN Clc1ccc2c(c1)[C@@H](NCc1cnn(CC3CCC3)c1)CC2 ZINC000922298368 1057000441 /nfs/dbraw/zinc/00/04/41/1057000441.db2.gz PMKHVVPQSAJTLJ-SFHVURJKSA-N 0 1 315.848 4.114 20 0 DIADMN C[C@H]1CCC(C)(C)N1C(=O)c1cc(-c2ccccc2Cl)[nH]n1 ZINC001626075029 1057002415 /nfs/dbraw/zinc/00/24/15/1057002415.db2.gz GRQPJTCEHRWXIL-NSHDSACASA-N 0 1 317.820 4.133 20 0 DIADMN Oc1ccc2c(c1)[C@@H](NCc1cc(Cl)cc(Cl)c1)CC2 ZINC000657694640 1057005951 /nfs/dbraw/zinc/00/59/51/1057005951.db2.gz UTGIUOHHCFWEOI-INIZCTEOSA-N 0 1 308.208 4.476 20 0 DIADMN COc1cccc2c1OCC[C@H]2NCc1cc(Cl)cs1 ZINC000785468397 1057006223 /nfs/dbraw/zinc/00/62/23/1057006223.db2.gz INOPNYRLRKPWRH-CYBMUJFWSA-N 0 1 309.818 4.024 20 0 DIADMN CC(C)(C)c1ccc(CNCc2cccc3[nH]c(=O)oc32)s1 ZINC000922325204 1057007901 /nfs/dbraw/zinc/00/79/01/1057007901.db2.gz ZIAPNZWNLXOALR-UHFFFAOYSA-N 0 1 316.426 4.182 20 0 DIADMN Cc1nc2cc(Nc3cc(Br)cnc3C)ccc2[nH]1 ZINC001213071140 1057008302 /nfs/dbraw/zinc/00/83/02/1057008302.db2.gz BDINSKZQCDYFEM-UHFFFAOYSA-N 0 1 317.190 4.081 20 0 DIADMN FC(F)(F)c1cccc(CN2CCC=C(c3cccnc3)C2)c1 ZINC000347719513 1057022360 /nfs/dbraw/zinc/02/23/60/1057022360.db2.gz NEVYKOFZYQCBGA-UHFFFAOYSA-N 0 1 318.342 4.390 20 0 DIADMN COc1ccc(C2=CCN(c3ccccc3)CC2)cc1CN(C)C ZINC001241355476 1057025705 /nfs/dbraw/zinc/02/57/05/1057025705.db2.gz OMKFIVWZJPEFQC-UHFFFAOYSA-N 0 1 322.452 4.051 20 0 DIADMN CCC[N@H+]1CCCC[C@H]1c1ccc(-c2cccc(C(=O)[O-])c2)nc1 ZINC001241357696 1057026421 /nfs/dbraw/zinc/02/64/21/1057026421.db2.gz GTWOQFMIUVWTGK-IBGZPJMESA-N 0 1 324.424 4.384 20 0 DIADMN c1nc(C2CCCC2)sc1CN[C@@H](c1ccccn1)C1CC1 ZINC000922584601 1057037661 /nfs/dbraw/zinc/03/76/61/1057037661.db2.gz LQMXGBCTGFDNHA-QGZVFWFLSA-N 0 1 313.470 4.437 20 0 DIADMN Fc1cc(CN[C@@H](c2ccccn2)C2CC2)ccc1OC(F)F ZINC000922586155 1057037758 /nfs/dbraw/zinc/03/77/58/1057037758.db2.gz WKUZVGQZXIDLGJ-MRXNPFEDSA-N 0 1 322.330 4.063 20 0 DIADMN COC(=O)c1cc2ccc(-c3cccc4ccsc43)[nH]c-2n1 ZINC001241400901 1057040496 /nfs/dbraw/zinc/04/04/96/1057040496.db2.gz PRKMALPEQSVGON-UHFFFAOYSA-N 0 1 308.362 4.231 20 0 DIADMN CC[C@@H](NCc1cc2cccnc2o1)c1cc(F)ccc1OC ZINC000922623410 1057040577 /nfs/dbraw/zinc/04/05/77/1057040577.db2.gz UPKPTUFXDYYTNJ-MRXNPFEDSA-N 0 1 314.360 4.216 20 0 DIADMN COc1ccc(-c2cnc(C[N@H+]3CCCC4(CC4)CC3)o2)cc1 ZINC000626113942 1057044735 /nfs/dbraw/zinc/04/47/35/1057044735.db2.gz NBAGWWVDZPYGOT-UHFFFAOYSA-N 0 1 312.413 4.116 20 0 DIADMN COc1ccc([C@H](C)NCc2cnc(C3CC3)s2)cc1C ZINC000922672097 1057045687 /nfs/dbraw/zinc/04/56/87/1057045687.db2.gz LVRMYOZHUFTERC-LBPRGKRZSA-N 0 1 302.443 4.188 20 0 DIADMN CCn1nc(CN[C@@H](C)c2ccc(OC)c(C)c2)c2ccccc21 ZINC000922672068 1057045978 /nfs/dbraw/zinc/04/59/78/1057045978.db2.gz KURPAPRTVSXKBZ-HNNXBMFYSA-N 0 1 323.440 4.224 20 0 DIADMN Cc1cc(F)ccc1[C@@H](C)NCc1cncc(Br)c1 ZINC000922668080 1057047151 /nfs/dbraw/zinc/04/71/51/1057047151.db2.gz YPPKBWKNIPPWFS-LLVKDONJSA-N 0 1 323.209 4.142 20 0 DIADMN CCn1c(CN[C@@H](C)c2ccc(OC)c(C)c2)nc2ccccc21 ZINC000922671889 1057047226 /nfs/dbraw/zinc/04/72/26/1057047226.db2.gz HRTRPEZAMWMFPD-HNNXBMFYSA-N 0 1 323.440 4.224 20 0 DIADMN c1[nH]nc2ncc(-c3ccc4nc(-c5ccccc5)[nH]c4c3)cc12 ZINC001241427368 1057047423 /nfs/dbraw/zinc/04/74/23/1057047423.db2.gz VSOQDRKAXQQXOJ-UHFFFAOYSA-N 0 1 311.348 4.168 20 0 DIADMN COc1ccc([C@H](C)NCc2ccc(Br)o2)cc1C ZINC000922672662 1057047768 /nfs/dbraw/zinc/04/77/68/1057047768.db2.gz BJPLUEOQMAPQLT-NSHDSACASA-N 0 1 324.218 4.210 20 0 DIADMN COc1ccc([C@H](C)NCc2cnc(Cl)c(F)c2)cc1C ZINC000922674347 1057048155 /nfs/dbraw/zinc/04/81/55/1057048155.db2.gz IWAWBGRIBDKUJO-NSHDSACASA-N 0 1 308.784 4.042 20 0 DIADMN Cc1ccc(OC(F)F)c(CN2CC[C@H](CC(F)(F)F)C2)c1 ZINC000428986770 1057061497 /nfs/dbraw/zinc/06/14/97/1057061497.db2.gz PWUYVVFNRCSTCI-LLVKDONJSA-N 0 1 323.305 4.371 20 0 DIADMN Cc1ccc(OC(F)F)c(CN2CC[C@@H](CC(F)(F)F)C2)c1 ZINC000428986771 1057061725 /nfs/dbraw/zinc/06/17/25/1057061725.db2.gz PWUYVVFNRCSTCI-NSHDSACASA-N 0 1 323.305 4.371 20 0 DIADMN CC(C)C1=NCCc2ccc(-c3ccc([S@@](C)=O)cc3)cc21 ZINC001241488003 1057064667 /nfs/dbraw/zinc/06/46/67/1057064667.db2.gz SLQWLOPRBAJKJN-JOCHJYFZSA-N 0 1 311.450 4.092 20 0 DIADMN Cc1nn(C)cc1[C@@H](C)N[C@@H]1CCSc2c(Cl)cccc21 ZINC000361140466 1057069378 /nfs/dbraw/zinc/06/93/78/1057069378.db2.gz LECHIQJRMAIZFE-MEBBXXQBSA-N 0 1 321.877 4.270 20 0 DIADMN Cc1nn(C)cc1[C@H](C)N[C@@H]1CCSc2c(Cl)cccc21 ZINC000361140475 1057069529 /nfs/dbraw/zinc/06/95/29/1057069529.db2.gz LECHIQJRMAIZFE-ZUZCIYMTSA-N 0 1 321.877 4.270 20 0 DIADMN CCCCCOc1ccc([C@H](C)NCc2cc(CC)n[nH]2)cc1 ZINC000766002483 1057069642 /nfs/dbraw/zinc/06/96/42/1057069642.db2.gz LRTANCWFLPWAIK-HNNXBMFYSA-N 0 1 315.461 4.392 20 0 DIADMN Cc1n[nH]c(C(F)F)c1NC(=O)CC1CC(c2ccccc2)C1 ZINC000282393625 1057069783 /nfs/dbraw/zinc/06/97/83/1057069783.db2.gz PXGTTXUIEJINSN-UHFFFAOYSA-N 0 1 319.355 4.178 20 0 DIADMN COc1ccc2oc(CN[C@@H]3CCCc4cccnc43)cc2c1 ZINC000922877541 1057072216 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ZINC001241942234 1057219573 /nfs/dbraw/zinc/21/95/73/1057219573.db2.gz SYUXFBVOWXRVGL-UHFFFAOYSA-N 0 1 301.349 4.301 20 0 DIADMN COc1cc(-c2ccc3nn[nH]c3c2)ccc1-c1ccccc1 ZINC001241942234 1057219576 /nfs/dbraw/zinc/21/95/76/1057219576.db2.gz SYUXFBVOWXRVGL-UHFFFAOYSA-N 0 1 301.349 4.301 20 0 DIADMN FC(F)(F)c1ccc(-c2ccc3[nH]nnc3c2)c2cccnc21 ZINC001241941561 1057219613 /nfs/dbraw/zinc/21/96/13/1057219613.db2.gz BFOOEFZQCUGSPA-UHFFFAOYSA-N 0 1 314.270 4.192 20 0 DIADMN FC(F)(F)c1ccc(-c2ccc3nn[nH]c3c2)c2cccnc21 ZINC001241941561 1057219616 /nfs/dbraw/zinc/21/96/16/1057219616.db2.gz BFOOEFZQCUGSPA-UHFFFAOYSA-N 0 1 314.270 4.192 20 0 DIADMN FC(F)(F)c1cc2[nH]ccc2c(-c2ccc3[nH]nnc3c2)c1 ZINC001241942487 1057220691 /nfs/dbraw/zinc/22/06/91/1057220691.db2.gz NFUUYRJQMVLIBW-UHFFFAOYSA-N 0 1 302.259 4.125 20 0 DIADMN FC(F)(F)c1cc2[nH]ccc2c(-c2ccc3nn[nH]c3c2)c1 ZINC001241942487 1057220695 /nfs/dbraw/zinc/22/06/95/1057220695.db2.gz NFUUYRJQMVLIBW-UHFFFAOYSA-N 0 1 302.259 4.125 20 0 DIADMN COC[C@H](NCc1cc2ccccc2[nH]1)c1cccc(Cl)c1 ZINC000674244473 1057222161 /nfs/dbraw/zinc/22/21/61/1057222161.db2.gz MBOYLJVTQDXTMM-SFHVURJKSA-N 0 1 314.816 4.299 20 0 DIADMN CC(C)CN(C)[C@@H](c1nc(-c2ccccc2)no1)c1ccccc1 ZINC000674285662 1057226581 /nfs/dbraw/zinc/22/65/81/1057226581.db2.gz ACVIKRPGPQAYQZ-GOSISDBHSA-N 0 1 321.424 4.414 20 0 DIADMN CC(C)(C)c1cc(-c2cc3c(nn2)CNC3)cc(C(C)(C)C)c1 ZINC001241971642 1057226735 /nfs/dbraw/zinc/22/67/35/1057226735.db2.gz SXMBOSIHFLWFMA-UHFFFAOYSA-N 0 1 309.457 4.342 20 0 DIADMN Fc1ccc2cc(-c3ccccc3CN3CCOCC3)ccc2c1 ZINC001241989799 1057231673 /nfs/dbraw/zinc/23/16/73/1057231673.db2.gz OBQONTXKMQDUQC-UHFFFAOYSA-N 0 1 321.395 4.478 20 0 DIADMN C[C@H]1CCc2c(F)cccc2[C@@H]1NCc1nn(C)c2ccccc12 ZINC000674336135 1057232215 /nfs/dbraw/zinc/23/22/15/1057232215.db2.gz ZRSIKUYCMJYGSJ-RNODOKPDSA-N 0 1 323.415 4.126 20 0 DIADMN FC(F)(F)c1nc2ccc(-c3cccc4c3OCC4)cc2[nH]1 ZINC001242010358 1057238565 /nfs/dbraw/zinc/23/85/65/1057238565.db2.gz LDGSNDKTIFRGGD-UHFFFAOYSA-N 0 1 304.271 4.184 20 0 DIADMN Fc1cc(-c2cccc3c2OCC3)cc(F)c1CN1CCCC1 ZINC001242012388 1057239608 /nfs/dbraw/zinc/23/96/08/1057239608.db2.gz ZEICXLXQUYNTNB-UHFFFAOYSA-N 0 1 315.363 4.163 20 0 DIADMN C[C@H](c1ccccc1)N1C[C@H](C(F)(F)F)[C@@H](C(F)(F)F)C1 ZINC000674458897 1057244392 /nfs/dbraw/zinc/24/43/92/1057244392.db2.gz LGSRREPZICAYAA-USWWRNFRSA-N 0 1 311.269 4.420 20 0 DIADMN C[C@H](c1ccccc1)N1C[C@@H](C(F)(F)F)[C@H](C(F)(F)F)C1 ZINC000674458898 1057244833 /nfs/dbraw/zinc/24/48/33/1057244833.db2.gz LGSRREPZICAYAA-YUSALJHKSA-N 0 1 311.269 4.420 20 0 DIADMN C[C@H](CN[C@H](C)c1nc(C(F)(F)F)cs1)c1ccccn1 ZINC000658063916 1057248356 /nfs/dbraw/zinc/24/83/56/1057248356.db2.gz LJZPDEIQPOYHLZ-NXEZZACHSA-N 0 1 315.364 4.011 20 0 DIADMN CC(C)(C)c1ncc(C(=O)Nc2cccc(Cl)c2O)s1 ZINC000172357476 1057256193 /nfs/dbraw/zinc/25/61/93/1057256193.db2.gz UKKUMZFHRDGGCY-UHFFFAOYSA-N 0 1 310.806 4.052 20 0 DIADMN C[C@H]1CC[C@H](NCc2cnc(C(F)(F)F)nc2)c2ccccc21 ZINC000658078094 1057257116 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ZINC001242218560 1057297955 /nfs/dbraw/zinc/29/79/55/1057297955.db2.gz ZNTMXCZXYXDARX-UHFFFAOYSA-N 0 1 312.369 4.281 20 0 DIADMN Cc1nc2sc3c(c2c(-c2ccc(F)cc2O)n1)CCCC3 ZINC001242218480 1057298122 /nfs/dbraw/zinc/29/81/22/1057298122.db2.gz WCKXANNTCKTNFR-UHFFFAOYSA-N 0 1 314.385 4.390 20 0 DIADMN Cc1ccc(C=Cc2n[nH]c(SCCCOC(C)(C)C)n2)o1 ZINC000674924995 1057301230 /nfs/dbraw/zinc/30/12/30/1057301230.db2.gz JQIPGCKWWILITQ-HJWRWDBZSA-N 0 1 321.446 4.174 20 0 DIADMN C[C@H](c1ccc(Cl)cc1)N1CC(c2nc3ccccc3[nH]2)C1 ZINC000675022736 1057309664 /nfs/dbraw/zinc/30/96/64/1057309664.db2.gz BEOBOANMMFVDGU-GFCCVEGCSA-N 0 1 311.816 4.377 20 0 DIADMN CN(CCC(C)(C)C)CC(=O)Nc1ccccc1C(F)(F)F ZINC000675057183 1057312811 /nfs/dbraw/zinc/31/28/11/1057312811.db2.gz TZWGJHVRCJJIMN-UHFFFAOYSA-N 0 1 316.367 4.012 20 0 DIADMN CCOC(=O)CCCc1ccc(-c2cc3cn[nH]c3cc2C)cc1 ZINC001242282345 1057318999 /nfs/dbraw/zinc/31/89/99/1057318999.db2.gz BRMLGGYVOJHXOE-UHFFFAOYSA-N 0 1 322.408 4.424 20 0 DIADMN COC(=O)c1ccc(-c2cc3cn[nH]c3cc2C)c2ccccc12 ZINC001242283772 1057319795 /nfs/dbraw/zinc/31/97/95/1057319795.db2.gz YTGIIJIVRICGJS-UHFFFAOYSA-N 0 1 316.360 4.478 20 0 DIADMN COc1cc2nccc(-c3cc4cn[nH]c4cc3C)c2cc1OC ZINC001242282838 1057320045 /nfs/dbraw/zinc/32/00/45/1057320045.db2.gz CZEQBNBVQIBNLU-UHFFFAOYSA-N 0 1 319.364 4.104 20 0 DIADMN CCOC(=O)c1ccc(-c2cc3cn[nH]c3cc2C)c(C)c1C ZINC001242284083 1057320156 /nfs/dbraw/zinc/32/01/56/1057320156.db2.gz JHDWMPYESAINFK-UHFFFAOYSA-N 0 1 308.381 4.332 20 0 DIADMN Cc1cc2[nH]ncc2cc1-c1ccc(CC(=O)OC(C)(C)C)cc1 ZINC001242284460 1057320702 /nfs/dbraw/zinc/32/07/02/1057320702.db2.gz HOQIWXQBAYXNCS-UHFFFAOYSA-N 0 1 322.408 4.423 20 0 DIADMN COc1cc(-c2cc3cn[nH]c3cc2C)ccc1OC(F)(F)F ZINC001242284522 1057320791 /nfs/dbraw/zinc/32/07/91/1057320791.db2.gz QZGHTLYZECVROG-UHFFFAOYSA-N 0 1 322.286 4.446 20 0 DIADMN Cc1cc2[nH]ncc2cc1-c1cccc2c1C(C)(C)CC(=O)N2 ZINC001242284646 1057321379 /nfs/dbraw/zinc/32/13/79/1057321379.db2.gz HAVDJPPDLZKXCH-UHFFFAOYSA-N 0 1 305.381 4.158 20 0 DIADMN CCOC(=O)C1(c2ccc(-c3cc4cn[nH]c4cc3C)cc2)CC1 ZINC001242285031 1057321445 /nfs/dbraw/zinc/32/14/45/1057321445.db2.gz LYIISBAJPLYHHY-UHFFFAOYSA-N 0 1 320.392 4.133 20 0 DIADMN COc1cccc(CN[C@H](c2ccc(F)cc2F)C(C)C)c1 ZINC000675155935 1057322410 /nfs/dbraw/zinc/32/24/10/1057322410.db2.gz UBCBTLRTFFCCCN-SFHVURJKSA-N 0 1 305.368 4.460 20 0 DIADMN C[C@H](NC[C@H]1CCC[C@@H](C)O1)c1nc(-c2ccccc2)cs1 ZINC000658218839 1057325365 /nfs/dbraw/zinc/32/53/65/1057325365.db2.gz KPVYQWFXHHCGCC-IJEWVQPXSA-N 0 1 316.470 4.418 20 0 DIADMN Cc1ccc(-c2nnc([C@H](C)N(C)CCC(C)C)o2)cc1C ZINC000675179360 1057325536 /nfs/dbraw/zinc/32/55/36/1057325536.db2.gz BTUOYMRUAPAGGI-HNNXBMFYSA-N 0 1 301.434 4.392 20 0 DIADMN CCN(CC)Cc1ccc(C(=O)N2CCC[C@@H](CC(C)C)C2)o1 ZINC000675239466 1057332137 /nfs/dbraw/zinc/33/21/37/1057332137.db2.gz NIRIJYLDTCZDDJ-INIZCTEOSA-N 0 1 320.477 4.020 20 0 DIADMN Cc1nc2ccccn2c1CN1CC(C)(C)[C@@H]1c1ccccc1 ZINC000675247987 1057333476 /nfs/dbraw/zinc/33/34/76/1057333476.db2.gz WJDAPEGRXKLAAX-IBGZPJMESA-N 0 1 305.425 4.226 20 0 DIADMN COc1ccc(OC(F)(F)F)cc1-c1cc2[nH]ccc2c(C)n1 ZINC001242318757 1057333644 /nfs/dbraw/zinc/33/36/44/1057333644.db2.gz AXLOGEYKQOVRLG-UHFFFAOYSA-N 0 1 322.286 4.446 20 0 DIADMN C[C@H](N[C@H]1CCc2ccc(O)cc21)c1ccccc1OC(F)F ZINC000658237279 1057334314 /nfs/dbraw/zinc/33/43/14/1057334314.db2.gz DWYLHAIYDMGAIG-ZBEGNZNMSA-N 0 1 319.351 4.332 20 0 DIADMN COc1ccc(Cl)cc1[C@@H](C)N[C@@H]1CCc2ccc(O)cc21 ZINC000658240854 1057337298 /nfs/dbraw/zinc/33/72/98/1057337298.db2.gz SGGXYWNUAOXIJW-PIGZYNQJSA-N 0 1 317.816 4.392 20 0 DIADMN Oc1c(F)cccc1-c1nc2ccccc2nc1N1CCCCC1 ZINC001242349651 1057341401 /nfs/dbraw/zinc/34/14/01/1057341401.db2.gz VFGNHHUXUHCEBR-UHFFFAOYSA-N 0 1 323.371 4.132 20 0 DIADMN Oc1c(F)cccc1-c1nc(-c2ccncc2)nc2ccccc21 ZINC001242351094 1057341988 /nfs/dbraw/zinc/34/19/88/1057341988.db2.gz YNBDOCOXLFCJJL-UHFFFAOYSA-N 0 1 317.323 4.204 20 0 DIADMN Oc1c(F)cccc1-c1cncc(SCc2ccccc2)n1 ZINC001242350017 1057342421 /nfs/dbraw/zinc/34/24/21/1057342421.db2.gz CYPGBXYROIRSHM-UHFFFAOYSA-N 0 1 312.369 4.281 20 0 DIADMN Oc1c(F)cccc1-c1ncccc1OCc1ccccc1F ZINC001242350091 1057342593 /nfs/dbraw/zinc/34/25/93/1057342593.db2.gz GZJWINCEFBPZPW-UHFFFAOYSA-N 0 1 313.303 4.311 20 0 DIADMN [O-]c1c(Cl)cccc1-c1cccc2c1C1(C=C2)CC[NH2+]CC1 ZINC001242364077 1057346587 /nfs/dbraw/zinc/34/65/87/1057346587.db2.gz AJTLAHHLNOLHMQ-UHFFFAOYSA-N 0 1 311.812 4.361 20 0 DIADMN C[N@H+]1CCCC[C@@H]1c1ccc(-c2cccc(Cl)c2[O-])nc1 ZINC001242365904 1057346976 /nfs/dbraw/zinc/34/69/76/1057346976.db2.gz VNRRGRPDVVZHRO-MRXNPFEDSA-N 0 1 302.805 4.264 20 0 DIADMN [O-]c1c(Cl)cccc1-c1ccc(OCC[NH+]2CCCC2)cc1 ZINC001242367200 1057348494 /nfs/dbraw/zinc/34/84/94/1057348494.db2.gz KGYVRFZVTKSXAE-UHFFFAOYSA-N 0 1 317.816 4.187 20 0 DIADMN CC(C)[C@H](NCc1cc(Cl)ccc1Cl)c1cnn(C)c1 ZINC000922895624 1057351143 /nfs/dbraw/zinc/35/11/43/1057351143.db2.gz PUFRTOKPSYZYJZ-HNNXBMFYSA-N 0 1 312.244 4.214 20 0 DIADMN CCSCc1ccc(NC(=O)c2cccc(F)c2O)cc1 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CCO[C@H]1CCCN(CCc2cc(Cl)cc(Cl)c2)C1 ZINC001559554402 1059370383 /nfs/dbraw/zinc/37/03/83/1059370383.db2.gz ATTLDPJAEAXKFS-HNNXBMFYSA-N 0 1 302.245 4.037 20 0 DIADMN CC(C)N1CCC[C@H]1c1nc(-c2ccc(Cl)c(F)c2)no1 ZINC001247368744 1059409402 /nfs/dbraw/zinc/40/94/02/1059409402.db2.gz QFCJMXXCVCAISA-ZDUSSCGKSA-N 0 1 309.772 4.074 20 0 DIADMN CC(C)N1CCC[C@H]1c1nc(-c2cccc(F)c2Cl)no1 ZINC001247367850 1059409887 /nfs/dbraw/zinc/40/98/87/1059409887.db2.gz DZXHBUKOEOONPJ-LBPRGKRZSA-N 0 1 309.772 4.074 20 0 DIADMN CC[C@@H]1CCCN(CC(=O)Nc2ccc(C(C)(C)C)cc2)C1 ZINC001559583769 1059414985 /nfs/dbraw/zinc/41/49/85/1059414985.db2.gz QDXVXIGSWYNUIT-OAHLLOKOSA-N 0 1 302.462 4.045 20 0 DIADMN C[C@H]1CN(Cc2ccc(-c3ccccn3)nc2)[C@H]1c1ccccc1 ZINC001559583164 1059415596 /nfs/dbraw/zinc/41/55/96/1059415596.db2.gz ZBKOPPCIWCVTDL-HRAATJIYSA-N 0 1 315.420 4.337 20 0 DIADMN CSc1cc(Cl)ccc1NC(=O)c1ocnc1C(F)F ZINC001531797858 1059415535 /nfs/dbraw/zinc/41/55/35/1059415535.db2.gz ZKCDWYOEVLONDV-UHFFFAOYSA-N 0 1 318.732 4.240 20 0 DIADMN CCc1ccc(CCN2CCc3c(F)ccc(F)c3C2)cc1 ZINC001559584286 1059416030 /nfs/dbraw/zinc/41/60/30/1059416030.db2.gz HLHGLVHGMZTYBO-UHFFFAOYSA-N 0 1 301.380 4.128 20 0 DIADMN Fc1ccc(OCCN2CC[C@H]2Cc2ccccc2)c(Cl)c1 ZINC001559585787 1059419665 /nfs/dbraw/zinc/41/96/65/1059419665.db2.gz HFWAYVBGKRFKPP-INIZCTEOSA-N 0 1 319.807 4.175 20 0 DIADMN CCCCOC(=O)[C@H](C)N1CC[C@](C)(CCc2ccccc2)C1 ZINC001559587119 1059421477 /nfs/dbraw/zinc/42/14/77/1059421477.db2.gz SWZZIABNUPJGLK-PXNSSMCTSA-N 0 1 317.473 4.063 20 0 DIADMN COc1cccc(C=C2CCN(Cc3cc(C)cc(C)n3)CC2)c1 ZINC001559593664 1059429283 /nfs/dbraw/zinc/42/92/83/1059429283.db2.gz BWDOIBYWNDYZRE-UHFFFAOYSA-N 0 1 322.452 4.386 20 0 DIADMN C[C@@H]1CCCC[C@H]1OCCN1CCOC2(C1)CCCCCC2 ZINC001559596265 1059430764 /nfs/dbraw/zinc/43/07/64/1059430764.db2.gz QLJJAUIOIKRCCF-QZTJIDSGSA-N 0 1 309.494 4.007 20 0 DIADMN CN(Cc1cc(Cl)cn1C)[C@@H]1CCc2cc(Cl)ccc21 ZINC001559603703 1059437625 /nfs/dbraw/zinc/43/76/25/1059437625.db2.gz GJNKXVLARVLHPC-MRXNPFEDSA-N 0 1 309.240 4.451 20 0 DIADMN O=C(Nc1cccc(-c2ccccc2)c1)c1cccc(F)c1O ZINC001531882458 1059443154 /nfs/dbraw/zinc/44/31/54/1059443154.db2.gz ROVPXTXCRSGTSO-UHFFFAOYSA-N 0 1 307.324 4.451 20 0 DIADMN c1c2c(oc1-c1ccccc1)CN(CCOCC1CCC1)CC2 ZINC001559633334 1059459961 /nfs/dbraw/zinc/45/99/61/1059459961.db2.gz ZXIWYCAZZHPPJA-UHFFFAOYSA-N 0 1 311.425 4.121 20 0 DIADMN CCc1ccccc1CN1CCC[C@H]1c1nc2ccccc2n1C ZINC001559637292 1059463859 /nfs/dbraw/zinc/46/38/59/1059463859.db2.gz MFGUCROWKLSHEW-FQEVSTJZSA-N 0 1 319.452 4.473 20 0 DIADMN CCCCOC(=O)[C@H](C)N(CC)[C@H](CC)Cc1ccccc1 ZINC001559642075 1059466666 /nfs/dbraw/zinc/46/66/66/1059466666.db2.gz BMQLXLPRAMTUNE-FUHWJXTLSA-N 0 1 305.462 4.061 20 0 DIADMN CCc1ccc([C@@H](NC(=O)c2cccc(F)c2O)C(C)C)cc1 ZINC001531968439 1059469903 /nfs/dbraw/zinc/46/99/03/1059469903.db2.gz JYOKBGXZSMAECA-KRWDZBQOSA-N 0 1 315.388 4.221 20 0 DIADMN CCc1ccc(CCN2C[C@H](C)O[C@@H](c3ccsc3)C2)cc1 ZINC001559646070 1059471708 /nfs/dbraw/zinc/47/17/08/1059471708.db2.gz BNVMYWPWKSMPPW-HNAYVOBHSA-N 0 1 315.482 4.315 20 0 DIADMN CCc1nc([C@H](C)N2CCCc3cc(C(C)(C)C)ccc32)n[nH]1 ZINC001559654281 1059482563 /nfs/dbraw/zinc/48/25/63/1059482563.db2.gz GJGSHDNYUJWGJA-ZDUSSCGKSA-N 0 1 312.461 4.178 20 0 DIADMN Clc1ccc(CN2CC[C@@H](C3CC3)C2)c(Br)c1 ZINC001559658262 1059490642 /nfs/dbraw/zinc/49/06/42/1059490642.db2.gz DQXDYZAAUQXCLZ-LLVKDONJSA-N 0 1 314.654 4.334 20 0 DIADMN Cc1ccc(-c2ccccc2-c2noc(CNC(C)C)n2)cc1 ZINC001247455739 1059490600 /nfs/dbraw/zinc/49/06/00/1059490600.db2.gz AFXDLVWMBKTVOP-UHFFFAOYSA-N 0 1 307.397 4.210 20 0 DIADMN CC[C@H](c1ccccc1)N(CCCC(C)(F)F)CC(=O)OC ZINC001559662689 1059492190 /nfs/dbraw/zinc/49/21/90/1059492190.db2.gz HQABKNAPCSPVDR-OAHLLOKOSA-N 0 1 313.388 4.048 20 0 DIADMN CC[C@H](c1ccccc1)N(CC(=O)OC)C[C@@H]1CC[C@@H]2C[C@@H]2C1 ZINC001559662837 1059493760 /nfs/dbraw/zinc/49/37/60/1059493760.db2.gz LXKUFYUKZVQBRS-OQIJWPOYSA-N 0 1 315.457 4.049 20 0 DIADMN CC(C)NCc1nc(-c2ccccc2Oc2ccccc2)no1 ZINC001247461682 1059495045 /nfs/dbraw/zinc/49/50/45/1059495045.db2.gz UNIODVAPRYXJEH-UHFFFAOYSA-N 0 1 309.369 4.027 20 0 DIADMN CCc1ccc(-c2ccc(-c3noc([C@H](C)NC)n3)cc2)cc1 ZINC001247490015 1059498344 /nfs/dbraw/zinc/49/83/44/1059498344.db2.gz MJIUGHABDVTUIP-ZDUSSCGKSA-N 0 1 307.397 4.246 20 0 DIADMN CC[C@@H](O)CN[C@@H](c1ccccc1)c1cc(Cl)ccc1Cl ZINC001559671286 1059498850 /nfs/dbraw/zinc/49/88/50/1059498850.db2.gz KQBFKPFYERLZHF-PBHICJAKSA-N 0 1 324.251 4.443 20 0 DIADMN Cc1ccc(-c2ccc(-c3noc(C4(N)CCCC4)n3)cc2)cc1 ZINC001247501579 1059500524 /nfs/dbraw/zinc/50/05/24/1059500524.db2.gz UQCHSWBTGZMUSR-UHFFFAOYSA-N 0 1 319.408 4.440 20 0 DIADMN C[C@@H]1CN(Cc2cc(F)ccc2OC(F)F)CC(C)(C)C1 ZINC001559675099 1059504355 /nfs/dbraw/zinc/50/43/55/1059504355.db2.gz AMETWSWRDPCSHB-NSHDSACASA-N 0 1 301.352 4.295 20 0 DIADMN CCC[C@@H](C)c1nc(-c2ncccc2/C=C/N2CCCC2)no1 ZINC001247523197 1059512032 /nfs/dbraw/zinc/51/20/32/1059512032.db2.gz SKSMYDLUSRBCEK-KADHNRKRSA-N 0 1 312.417 4.102 20 0 DIADMN Cc1cc(Br)cc2c1CN(CCCC1CC1)CC2 ZINC001559688337 1059518019 /nfs/dbraw/zinc/51/80/19/1059518019.db2.gz NITOSRPYRYTIFZ-UHFFFAOYSA-N 0 1 308.263 4.306 20 0 DIADMN Cc1nccnc1CN[C@@H](CCc1ccccc1)c1ccccc1 ZINC001559691613 1059520595 /nfs/dbraw/zinc/52/05/95/1059520595.db2.gz OFBINIPSLQAILM-FQEVSTJZSA-N 0 1 317.436 4.249 20 0 DIADMN CCOc1ccccc1[C@H](CC)NCc1sc(C)nc1C ZINC001559699980 1059526613 /nfs/dbraw/zinc/52/66/13/1059526613.db2.gz IQTSBKHOFPJMPI-HNNXBMFYSA-N 0 1 304.459 4.400 20 0 DIADMN Cc1conc1CN[C@@H](COc1c(C)cccc1C)C(C)(C)C ZINC001559705946 1059532872 /nfs/dbraw/zinc/53/28/72/1059532872.db2.gz CWKNUBSPTCKILJ-KRWDZBQOSA-N 0 1 316.445 4.183 20 0 DIADMN Cc1cccc([C@@H](C)N2CCN(Cc3cccc(F)c3)CC2)c1 ZINC001559715253 1059543879 /nfs/dbraw/zinc/54/38/79/1059543879.db2.gz VLVKJBWONCVBSD-QGZVFWFLSA-N 0 1 312.432 4.013 20 0 DIADMN C[C@H]1CC(CCN2CCN(CC(F)(F)F)[C@@H](C)C2)C[C@H](C)C1 ZINC001559717440 1059545195 /nfs/dbraw/zinc/54/51/95/1059545195.db2.gz NRUKZYZUFUGDFW-KFWWJZLASA-N 0 1 320.443 4.017 20 0 DIADMN Brc1cc(CN2CC[C@@H]3C[C@@H]32)cc2ccccc12 ZINC001559718551 1059547793 /nfs/dbraw/zinc/54/77/93/1059547793.db2.gz QIVJBFLULLTWQW-CJNGLKHVSA-N 0 1 302.215 4.197 20 0 DIADMN C[C@H](NC[C@H]1CCCC(C)(C)O1)c1nc(C(C)(C)C)cs1 ZINC001559724528 1059556790 /nfs/dbraw/zinc/55/67/90/1059556790.db2.gz ANWHFXPJODJRTK-QWHCGFSZSA-N 0 1 310.507 4.439 20 0 DIADMN Cc1cc(C)cc(NC(=O)CN2CC(C)(C)CC(C)(C)C2)c1 ZINC001559725578 1059560127 /nfs/dbraw/zinc/56/01/27/1059560127.db2.gz AUIAKTPCBGRMFK-UHFFFAOYSA-N 0 1 302.462 4.000 20 0 DIADMN COCC[C@H](NCc1cccc(C(C)(C)C)c1)c1ccco1 ZINC001559736301 1059566581 /nfs/dbraw/zinc/56/65/81/1059566581.db2.gz HSQWFAQYWVQMAQ-KRWDZBQOSA-N 0 1 301.430 4.445 20 0 DIADMN C[C@@H]1CC[C@@H](C(F)(F)F)CN1CCc1c(F)cccc1F ZINC001559740802 1059573488 /nfs/dbraw/zinc/57/34/88/1059573488.db2.gz DWAQMESYGRRJDE-GHMZBOCLSA-N 0 1 307.306 4.170 20 0 DIADMN CCCC[C@H](NC)c1nc(-c2ccc(F)c3ccccc23)no1 ZINC001247628478 1059576717 /nfs/dbraw/zinc/57/67/17/1059576717.db2.gz PNKNMQVWMCGAGF-INIZCTEOSA-N 0 1 313.376 4.480 20 0 DIADMN Cc1c(F)ccc(-c2noc([C@@H]3NC4CCC3CC4)n2)c1Cl ZINC001247634728 1059576789 /nfs/dbraw/zinc/57/67/89/1059576789.db2.gz OJPBTEJMVWGXRT-RPFQZYLTSA-N 0 1 321.783 4.041 20 0 DIADMN c1ccc2cc(-c3noc([C@H]4NC5CCC4CC5)n3)ccc2c1 ZINC001247634243 1059578987 /nfs/dbraw/zinc/57/89/87/1059578987.db2.gz PHJMGZKTVDTMKE-IMRCBTMISA-N 0 1 305.381 4.093 20 0 DIADMN CCC[C@H](NC)c1nc(-c2ccc(C)cc2C(F)(F)F)no1 ZINC001247626953 1059579255 /nfs/dbraw/zinc/57/92/55/1059579255.db2.gz OLXXLJHCUMPDEP-LBPRGKRZSA-N 0 1 313.323 4.124 20 0 DIADMN Cc1c(F)ccc(-c2noc([C@H]3NC4CCC3CC4)n2)c1Cl ZINC001247634724 1059580089 /nfs/dbraw/zinc/58/00/89/1059580089.db2.gz OJPBTEJMVWGXRT-FDZGAKKTSA-N 0 1 321.783 4.041 20 0 DIADMN CC(C)(C)OC(=O)[C@H]1CCCN1CCCc1ccc(Cl)cc1 ZINC001559750698 1059582471 /nfs/dbraw/zinc/58/24/71/1059582471.db2.gz RKIIMMHTKHFFOL-MRXNPFEDSA-N 0 1 323.864 4.079 20 0 DIADMN CC(C)[C@@H]1CCCN(Cc2coc(-c3c(F)cccc3F)n2)C1 ZINC001559758429 1059590550 /nfs/dbraw/zinc/59/05/50/1059590550.db2.gz CJDGFQGESTUOAS-CYBMUJFWSA-N 0 1 320.383 4.488 20 0 DIADMN C(=C/N1CCCC1)\c1cccnc1-c1noc(C2=CCCCC2)n1 ZINC001247705909 1059595678 /nfs/dbraw/zinc/59/56/78/1059595678.db2.gz WZVQHAYNZPWHMP-GXDHUFHOSA-N 0 1 322.412 4.156 20 0 DIADMN Cc1cccc(Cl)c1NC(=O)[C@@H](C)N1CCCC[C@@H](C)C1 ZINC001559761556 1059598498 /nfs/dbraw/zinc/59/84/98/1059598498.db2.gz QUEHMRWQZWWUDO-TZMCWYRMSA-N 0 1 308.853 4.097 20 0 DIADMN CC[C@H](C)CCCCC(=O)Nc1ccc(F)c(-c2nc[nH]n2)c1 ZINC001524734052 1059599311 /nfs/dbraw/zinc/59/93/11/1059599311.db2.gz FANZJUOBZDQLOO-LBPRGKRZSA-N 0 1 318.396 4.156 20 0 DIADMN CCC1(CC)CCN([C@H](C(=O)OC)c2ccccc2C)CC1 ZINC001559764452 1059600726 /nfs/dbraw/zinc/60/07/26/1059600726.db2.gz UYGXAGQSUASPDT-KRWDZBQOSA-N 0 1 303.446 4.111 20 0 DIADMN CCC[C@H]1CCCC[C@H]1NCc1ncsc1Br ZINC001559773782 1059611483 /nfs/dbraw/zinc/61/14/83/1059611483.db2.gz SZBSQIUKUQQYGQ-WDEREUQCSA-N 0 1 317.296 4.354 20 0 DIADMN COc1cc(CN2CCC(c3ccc(Cl)cc3)CC2)sn1 ZINC001559779257 1059614846 /nfs/dbraw/zinc/61/48/46/1059614846.db2.gz PNTMTHRGCQCKNG-UHFFFAOYSA-N 0 1 322.861 4.185 20 0 DIADMN CC(C)Cc1ccc(CN(C)Cc2cnc(C(C)C)nc2)cc1 ZINC001559780513 1059615177 /nfs/dbraw/zinc/61/51/77/1059615177.db2.gz DVIIQSIRNBWACC-UHFFFAOYSA-N 0 1 311.473 4.431 20 0 DIADMN CC1=CCCN([C@@H](C)C(=O)N[C@@H](C)c2ccc3ccccc3c2)C1 ZINC001559790965 1059625592 /nfs/dbraw/zinc/62/55/92/1059625592.db2.gz MBSPTRFWLNHRAH-IRXDYDNUSA-N 0 1 322.452 4.058 20 0 DIADMN Cc1ccc(-c2noc([C@@H]3C[C@@H](C)CCN3)n2)c2ccccc12 ZINC001247795906 1059632983 /nfs/dbraw/zinc/63/29/83/1059632983.db2.gz HWYGYNKZJMTWSH-SJCJKPOMSA-N 0 1 307.397 4.259 20 0 DIADMN C[C@H]1CCN[C@@H](c2nc(-c3ccc(-c4ccccc4)cc3)no2)C1 ZINC001247796911 1059633339 /nfs/dbraw/zinc/63/33/39/1059633339.db2.gz NONKZZBYJBGRFB-KBXCAEBGSA-N 0 1 319.408 4.464 20 0 DIADMN C[C@H]1CCCN[C@H]1c1nc(-c2cccc(Cl)c2Cl)no1 ZINC001247813196 1059636249 /nfs/dbraw/zinc/63/62/49/1059636249.db2.gz HMOMFUQSBXUMOM-QPUJVOFHSA-N 0 1 312.200 4.104 20 0 DIADMN C[C@@H]1CC[C@H](c2nc(-c3ccc(Cl)cc3Cl)no2)NC1 ZINC001247820286 1059640188 /nfs/dbraw/zinc/64/01/88/1059640188.db2.gz OBLPKIKQGJDEMS-PRHODGIISA-N 0 1 312.200 4.104 20 0 DIADMN CCC1(c2ccc(Cl)cc2)CCN(Cc2n[nH]cc2C)CC1 ZINC001559810754 1059646184 /nfs/dbraw/zinc/64/61/84/1059646184.db2.gz VXSNQEWMQWXIGD-UHFFFAOYSA-N 0 1 317.864 4.315 20 0 DIADMN CCN(Cc1cc(F)ccc1Br)C1CCCC1 ZINC001559825048 1059658451 /nfs/dbraw/zinc/65/84/51/1059658451.db2.gz CHBQOGIWRSSVGW-UHFFFAOYSA-N 0 1 300.215 4.353 20 0 DIADMN CC(C)Oc1cccc(CN2CCOCC23CCCCC3)c1 ZINC001559839005 1059667245 /nfs/dbraw/zinc/66/72/45/1059667245.db2.gz LYJBJMZDYZJPEX-UHFFFAOYSA-N 0 1 303.446 4.009 20 0 DIADMN CC[C@@H](OCCN1CCOCC12CCCCC2)c1ccccc1 ZINC001559838685 1059668675 /nfs/dbraw/zinc/66/86/75/1059668675.db2.gz BMGMUBBLHITONZ-LJQANCHMSA-N 0 1 317.473 4.189 20 0 DIADMN CC(C)C[C@]1(C)CCCN1CC(=O)Nc1ccccc1Cl ZINC001559854027 1059677210 /nfs/dbraw/zinc/67/72/10/1059677210.db2.gz PBBPAALTLIRBEK-KRWDZBQOSA-N 0 1 308.853 4.179 20 0 DIADMN C[C@@H]1CO[C@@H](c2cccc(C(F)(F)F)c2)CN1CC1CCC1 ZINC001559859859 1059679629 /nfs/dbraw/zinc/67/96/29/1059679629.db2.gz NFFCCYBSHYUJSI-MLGOLLRUSA-N 0 1 313.363 4.267 20 0 DIADMN CCOc1cccc(Cl)c1CN1CCC[C@H](CSC)C1 ZINC001559864589 1059685373 /nfs/dbraw/zinc/68/53/73/1059685373.db2.gz LTRDEMXTSGUAEV-ZDUSSCGKSA-N 0 1 313.894 4.314 20 0 DIADMN Cc1nc([C@@](C)(NCC2CCC(C(C)(C)C)CC2)C2CC2)no1 ZINC001559863506 1059686231 /nfs/dbraw/zinc/68/62/31/1059686231.db2.gz CEIIXJCMHBTIHI-ZOJXTTQQSA-N 0 1 319.493 4.445 20 0 DIADMN Cc1cc(C)cc(-c2noc([C@H]3CCN3C3CCCCC3)n2)c1 ZINC001248033548 1059692672 /nfs/dbraw/zinc/69/26/72/1059692672.db2.gz IYWSVQLTQFHJKP-QGZVFWFLSA-N 0 1 311.429 4.433 20 0 DIADMN Cc1ccc(-c2noc([C@@H]3CCN3C3CCCCC3)n2)cc1F ZINC001248034036 1059692875 /nfs/dbraw/zinc/69/28/75/1059692875.db2.gz MYYJJCVNWLQBEL-INIZCTEOSA-N 0 1 315.392 4.264 20 0 DIADMN C[C@H]1C[C@@H](C(C)(C)C)CC[N@H+]1CC(=O)Nc1cccc(Cl)c1 ZINC001559879733 1059699716 /nfs/dbraw/zinc/69/97/16/1059699716.db2.gz 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C[C@@]1(Cc2ccccc2F)CCCN1Cc1nc2ccccc2[nH]1 ZINC001559939574 1059754021 /nfs/dbraw/zinc/75/40/21/1059754021.db2.gz UIVVSWWCBBVFKZ-FQEVSTJZSA-N 0 1 323.415 4.299 20 0 DIADMN CC(C)CCc1noc(CN2CCC[C@@H]2CC2CCCC2)n1 ZINC001559952344 1059760959 /nfs/dbraw/zinc/76/09/59/1059760959.db2.gz IFXQNIZSMAKTFX-MRXNPFEDSA-N 0 1 305.466 4.203 20 0 DIADMN C[C@]1(Cc2cccc(Cl)c2)CCCN1Cc1ccncc1F ZINC001559963734 1059772029 /nfs/dbraw/zinc/77/20/29/1059772029.db2.gz BIYLAECDRVWPKE-GOSISDBHSA-N 0 1 318.823 4.471 20 0 DIADMN CC[C@H]1CN(CCCSc2ccccc2Cl)[C@@H](C)CO1 ZINC001559963593 1059774184 /nfs/dbraw/zinc/77/41/84/1059774184.db2.gz XHNPDPAEMSSPOC-KBPBESRZSA-N 0 1 313.894 4.322 20 0 DIADMN CC[C@H](C(=O)OC(C)(C)C)N1CCC(C2CCCCC2)CC1 ZINC001559973603 1059779721 /nfs/dbraw/zinc/77/97/21/1059779721.db2.gz KVEYWURYDAGWKL-QGZVFWFLSA-N 0 1 309.494 4.399 20 0 DIADMN Cc1ccc(NC(=O)[C@@H](C)N2CCC(C3CCC3)CC2)c(C)c1 ZINC001559983689 1059789104 /nfs/dbraw/zinc/78/91/04/1059789104.db2.gz YSKYEAUQLFYJAC-MRXNPFEDSA-N 0 1 314.473 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COc1ccc(C[N@@H+](C)CCc2ccccc2)c(OC)c1Cl ZINC001248796347 1059983508 /nfs/dbraw/zinc/98/35/08/1059983508.db2.gz QJPNSTCIFNNJET-UHFFFAOYSA-N 0 1 319.832 4.032 20 0 DIADMN Cc1csc(CN2CCC(c3cc(C)ccc3C)CC2)n1 ZINC001560204848 1059985960 /nfs/dbraw/zinc/98/59/60/1059985960.db2.gz BSNOWZQRLOLRBC-UHFFFAOYSA-N 0 1 300.471 4.448 20 0 DIADMN COc1cccc([C@@H]2CSCCN2Cc2csc(C)c2)c1 ZINC001248804568 1059987775 /nfs/dbraw/zinc/98/77/75/1059987775.db2.gz LHPDCGOXVHVGNH-KRWDZBQOSA-N 0 1 319.495 4.355 20 0 DIADMN Clc1c(CN2CC[C@]3(C2)CCCCO3)cnc2ccccc12 ZINC001248810961 1059988737 /nfs/dbraw/zinc/98/87/37/1059988737.db2.gz FPWBFQGNSJMISA-SFHVURJKSA-N 0 1 316.832 4.033 20 0 DIADMN C[C@@]1(C2CC2)COCCN1Cc1ccc(Cl)c2ccccc12 ZINC001560208235 1059988641 /nfs/dbraw/zinc/98/86/41/1059988641.db2.gz ZMOIGDRMBRFPGW-IBGZPJMESA-N 0 1 315.844 4.494 20 0 DIADMN C[C@]1(C2CC2)COCCN1Cc1ccc(Cl)c2ccccc12 ZINC001560208236 1059990190 /nfs/dbraw/zinc/99/01/90/1059990190.db2.gz ZMOIGDRMBRFPGW-LJQANCHMSA-N 0 1 315.844 4.494 20 0 DIADMN Brc1cnccc1CN1CCC[C@H](C2CCCC2)C1 ZINC001560226577 1059998793 /nfs/dbraw/zinc/99/87/93/1059998793.db2.gz UVLMVPKMWMMVPB-AWEZNQCLSA-N 0 1 323.278 4.246 20 0 DIADMN CCN(Cc1ccc(F)c2cc[nH]c21)Cc1ccccc1F ZINC001248818035 1059999072 /nfs/dbraw/zinc/99/90/72/1059999072.db2.gz VGFDYOGOSACZKA-UHFFFAOYSA-N 0 1 300.352 4.468 20 0 DIADMN C[C@@H]1CC[C@@](CO)(NCc2ccc(Cl)s2)c2ccccc21 ZINC001560226484 1059999323 /nfs/dbraw/zinc/99/93/23/1059999323.db2.gz SMBCOPVFPMLBTF-PXAZEXFGSA-N 0 1 321.873 4.276 20 0 DIADMN CCOc1cccc(Cl)c1CN1CCCC[C@@H]1[C@H]1CCCO1 ZINC001560224718 1060000609 /nfs/dbraw/zinc/00/06/09/1060000609.db2.gz DHKCIPZKLHDQDE-SJLPKXTDSA-N 0 1 323.864 4.272 20 0 DIADMN COc1ccc2c(OC)ccc(CN3CCCC[C@@H](F)C3)c2c1 ZINC001248826258 1060007714 /nfs/dbraw/zinc/00/77/14/1060007714.db2.gz KAWSSXNSHBBAEY-OAHLLOKOSA-N 0 1 317.404 4.181 20 0 DIADMN CCC[N@@H+](Cc1ccccc1)Cc1ccnc(SC(C)C)n1 ZINC001248831412 1060007755 /nfs/dbraw/zinc/00/77/55/1060007755.db2.gz BGGHJTVQKHNJGS-UHFFFAOYSA-N 0 1 315.486 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Cc1nsc(C)c1CN1Cc2ccccc2OC2(CCC2)C1 ZINC001473786965 1061408213 /nfs/dbraw/zinc/40/82/13/1061408213.db2.gz VELIZLPKORBICF-UHFFFAOYSA-N 0 1 314.454 4.077 20 0 DIADMN Cc1ccc2nc(-c3cc(O)c(C)cc3Br)[nH]c2c1 ZINC001251574854 1061408885 /nfs/dbraw/zinc/40/88/85/1061408885.db2.gz QOZHKDWBRZHFCI-UHFFFAOYSA-N 0 1 317.186 4.315 20 0 DIADMN COc1cc2[nH]c(-c3cnc(-c4ccccc4)o3)nc2cc1C ZINC001251587209 1061408988 /nfs/dbraw/zinc/40/89/88/1061408988.db2.gz WELIXKITKAOUJU-UHFFFAOYSA-N 0 1 305.337 4.202 20 0 DIADMN CCC[C@@](C)(NC(=O)c1cccc2nc[nH]c21)c1ccccc1 ZINC001457119702 1061410939 /nfs/dbraw/zinc/41/09/39/1061410939.db2.gz BQXVFFZLZABNKJ-LJQANCHMSA-N 0 1 307.397 4.008 20 0 DIADMN COc1ccc2nc(-c3ccccc3NC(=O)C(C)(C)C)[nH]c2c1 ZINC001251590957 1061411388 /nfs/dbraw/zinc/41/13/88/1061411388.db2.gz PSGRKMCEJWWYIA-UHFFFAOYSA-N 0 1 323.396 4.223 20 0 DIADMN COc1ccc(OC)c(-c2nc3cc(C)cc(C)c3[nH]2)c1F ZINC001251625279 1061423854 /nfs/dbraw/zinc/42/38/54/1061423854.db2.gz DLIFYBXEDGIXOX-UHFFFAOYSA-N 0 1 300.333 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CC[C@H](C)c1nn(C)cc1-c1nc2ccc(C(F)F)cc2[nH]1 ZINC001251816756 1061498959 /nfs/dbraw/zinc/49/89/59/1061498959.db2.gz GCGJHUCUTVCNGE-VIFPVBQESA-N 0 1 304.344 4.415 20 0 DIADMN C[C@H]1C[C@@H](CCNC(=O)c2ccc(F)cc2O)CC(C)(C)C1 ZINC001457779341 1061499324 /nfs/dbraw/zinc/49/93/24/1061499324.db2.gz KTNPUEBLYYEOQB-QWHCGFSZSA-N 0 1 307.409 4.114 20 0 DIADMN CC[C@@H](C)c1nn(C)cc1-c1nc2ccc3ncccc3c2[nH]1 ZINC001251816775 1061499683 /nfs/dbraw/zinc/49/96/83/1061499683.db2.gz GUPPDBRFANXPGZ-LLVKDONJSA-N 0 1 305.385 4.025 20 0 DIADMN CC[C@@H](C(=O)Nc1ccccc1Oc1cccc(C)c1)N(C)C ZINC001463588489 1061499765 /nfs/dbraw/zinc/49/97/65/1061499765.db2.gz HWQQHLGQIZOSGH-KRWDZBQOSA-N 0 1 312.413 4.066 20 0 DIADMN COc1ccc2nc(-c3nc4ccc(F)cc4n3C(C)C)[nH]c2c1 ZINC001251817176 1061500187 /nfs/dbraw/zinc/50/01/87/1061500187.db2.gz XJDOXJKIQBGFDQ-UHFFFAOYSA-N 0 1 324.359 4.308 20 0 DIADMN CCCCOc1ncccc1CNC/C=C/c1cccc(F)c1 ZINC001473960233 1061501988 /nfs/dbraw/zinc/50/19/88/1061501988.db2.gz FLHIOQMLYSSTKG-VMPITWQZSA-N 0 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Cc1nc2cccc(C(=O)NC[C@@H](c3ccccc3)C(C)C)c2[nH]1 ZINC001464073160 1061554050 /nfs/dbraw/zinc/55/40/50/1061554050.db2.gz KFTDQVFKCXNWHP-QGZVFWFLSA-N 0 1 321.424 4.041 20 0 DIADMN Cc1nn(-c2cccc(C)c2)cc1CNCc1c(C)cccc1F ZINC001474021948 1061561973 /nfs/dbraw/zinc/56/19/73/1061561973.db2.gz IEMPCXNPLKCWNV-UHFFFAOYSA-N 0 1 323.415 4.226 20 0 DIADMN CCn1cc(CNCc2c(C)cccc2F)c(-c2ccccc2)n1 ZINC001474022355 1061562180 /nfs/dbraw/zinc/56/21/80/1061562180.db2.gz SWWUSEXYGVKBRK-UHFFFAOYSA-N 0 1 323.415 4.307 20 0 DIADMN C[C@H](CNCc1nc(C(C)(C)C)co1)c1ccc(F)cc1F ZINC001474023605 1061563977 /nfs/dbraw/zinc/56/39/77/1061563977.db2.gz ASNIOOUTJUENPQ-LLVKDONJSA-N 0 1 308.372 4.144 20 0 DIADMN CCCC[C@@H](O)CNc1ccnc2cc(C(F)(F)F)ccc21 ZINC001252080063 1061567338 /nfs/dbraw/zinc/56/73/38/1061567338.db2.gz UUGAKAVDGHIXMF-GFCCVEGCSA-N 0 1 312.335 4.217 20 0 DIADMN COCc1ccc(CNCc2ccccc2OC(C)(C)C)cc1 ZINC001474026033 1061567856 /nfs/dbraw/zinc/56/78/56/1061567856.db2.gz MTJDKHOZASDRJV-UHFFFAOYSA-N 0 1 313.441 4.300 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302.368 4.251 20 0 DIADMN CCCC[C@@H](Cc1ccccc1)N[C@H](C)c1ncc(F)cn1 ZINC001258707412 1063764375 /nfs/dbraw/zinc/76/43/75/1063764375.db2.gz HNOPYBJGEREBSK-PBHICJAKSA-N 0 1 301.409 4.068 20 0 DIADMN COc1cnc(F)c(CN(C)CCc2cccc3ccccc32)c1 ZINC001461881294 1063772037 /nfs/dbraw/zinc/77/20/37/1063772037.db2.gz NPMKKEXFLYCROU-UHFFFAOYSA-N 0 1 324.399 4.057 20 0 DIADMN CC(C)(C)c1ccc2c(c1)CCN(Cc1cccc(F)c1N)C2 ZINC001461881909 1063773199 /nfs/dbraw/zinc/77/31/99/1063773199.db2.gz PKDKMWWDMVXTDP-UHFFFAOYSA-N 0 1 312.432 4.264 20 0 DIADMN Cc1c(F)nccc1CN(Cc1ccccc1F)CC(C)C ZINC001461888762 1063778235 /nfs/dbraw/zinc/77/82/35/1063778235.db2.gz OGRVZSGCDKRHPF-UHFFFAOYSA-N 0 1 304.384 4.326 20 0 DIADMN CCOc1ccc2c(c1)CN(C/C=C/c1cccc(F)c1)CC2 ZINC001461888822 1063778459 /nfs/dbraw/zinc/77/84/59/1063778459.db2.gz QMOOGMCXWFCLCR-GQCTYLIASA-N 0 1 311.400 4.296 20 0 DIADMN C[C@@H]1C[C@@H](c2ccc(F)cc2)C[N@@H+]1Cc1ccc([O-])c(F)c1F ZINC001461893971 1063782212 /nfs/dbraw/zinc/78/22/12/1063782212.db2.gz 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/nfs/dbraw/zinc/79/77/63/1063797763.db2.gz IPGJBHIAJWOPTE-LBPRGKRZSA-N 0 1 321.251 4.378 20 0 DIADMN CCCC[C@H](CCC)N1Cc2c(cnn2CC)[C@H](COCC)C1 ZINC001258761586 1063806553 /nfs/dbraw/zinc/80/65/53/1063806553.db2.gz NUZAXXGHHVKGJD-IRXDYDNUSA-N 0 1 321.509 4.198 20 0 DIADMN Cc1ccccc1[C@H]1CN(Cc2ccc3c(c2)CCCC3)CCO1 ZINC001461928558 1063814090 /nfs/dbraw/zinc/81/40/90/1063814090.db2.gz VBWQSESFKAKDBJ-JOCHJYFZSA-N 0 1 321.464 4.447 20 0 DIADMN Cc1ccccc1[C@@H]1C[C@@H](C)N(Cc2cc(C(F)(F)F)n[nH]2)C1 ZINC001461932803 1063816493 /nfs/dbraw/zinc/81/64/93/1063816493.db2.gz DTQIAHMAILOUPB-CHWSQXEVSA-N 0 1 323.362 4.115 20 0 DIADMN Cc1ccccc1[C@H]1C[C@@H](C)N(Cc2cc(C(F)(F)F)n[nH]2)C1 ZINC001461932804 1063816613 /nfs/dbraw/zinc/81/66/13/1063816613.db2.gz DTQIAHMAILOUPB-OLZOCXBDSA-N 0 1 323.362 4.115 20 0 DIADMN Cc1ccccc1[C@H]1C[C@@H](C)N(Cc2nc(Cl)cs2)C1 ZINC001461944958 1063830820 /nfs/dbraw/zinc/83/08/20/1063830820.db2.gz XQOXOVVLTXWCIJ-OLZOCXBDSA-N 0 1 306.862 4.483 20 0 DIADMN Cc1c(Cl)ccc(CN2CCC(c3ncc[nH]3)CC2)c1Cl ZINC001461948560 1063833411 /nfs/dbraw/zinc/83/34/11/1063833411.db2.gz IKRDGSLFTPJVGE-UHFFFAOYSA-N 0 1 324.255 4.405 20 0 DIADMN CN(Cc1cc(C(F)(F)F)ccc1Cl)[C@@H](CO)C(C)(C)C ZINC001461961753 1063840458 /nfs/dbraw/zinc/84/04/58/1063840458.db2.gz UHCWUUQDYVHSKB-ZDUSSCGKSA-N 0 1 323.786 4.198 20 0 DIADMN CC1(C)CN(CCCc2c(F)cccc2Cl)CCS1 ZINC001461957004 1063838187 /nfs/dbraw/zinc/83/81/87/1063838187.db2.gz GXWIAYQOIBIBOZ-UHFFFAOYSA-N 0 1 301.858 4.239 20 0 DIADMN CC(C)C(C[NH+]1CCC(C(=O)c2ccc([O-])cc2)CC1)C(C)C ZINC001461971056 1063850994 /nfs/dbraw/zinc/85/09/94/1063850994.db2.gz NNXVGQOVUNQQQL-UHFFFAOYSA-N 0 1 317.473 4.215 20 0 DIADMN Cc1cnn(C)c1CN1CCCCC[C@H]1c1ccc(Cl)cc1 ZINC001461971743 1063851644 /nfs/dbraw/zinc/85/16/44/1063851644.db2.gz VHKGQOHGLSGOPP-KRWDZBQOSA-N 0 1 317.864 4.499 20 0 DIADMN COC(=O)c1ccc2c(c1)CN(C[C@@H](C)CC1CCCCC1)C2 ZINC001461974405 1063854122 /nfs/dbraw/zinc/85/41/22/1063854122.db2.gz LIHFBZVPDXTRIC-HNNXBMFYSA-N 0 1 315.457 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/nfs/dbraw/zinc/91/45/93/1063914593.db2.gz NIZNGOFMCZRSDQ-UHFFFAOYSA-N 0 1 321.468 4.149 20 0 DIADMN CCCN1CCCC[C@@H]1C(=O)Nc1cccc(O[C@@H](C)CC)c1 ZINC001261276465 1063918232 /nfs/dbraw/zinc/91/82/32/1063918232.db2.gz JRGZQYZHVOSPKY-MAUKXSAKSA-N 0 1 318.461 4.067 20 0 DIADMN C[C@H]1CC[C@H](C(F)(F)F)CN1Cc1ccc2scnc2c1 ZINC001462082596 1063920400 /nfs/dbraw/zinc/92/04/00/1063920400.db2.gz HUSKCNXAQAEFRN-JQWIXIFHSA-N 0 1 314.376 4.459 20 0 DIADMN C/C(=C\c1ccccc1)CN(C)Cc1cnc2ccc(C)cn12 ZINC001462089209 1063923787 /nfs/dbraw/zinc/92/37/87/1063923787.db2.gz UAHAQZHYSMTYBC-GZTJUZNOSA-N 0 1 305.425 4.178 20 0 DIADMN COc1cc(CN(C)Cc2ccc(F)c(Cl)c2)ccc1F ZINC001462092179 1063923922 /nfs/dbraw/zinc/92/39/22/1063923922.db2.gz DEAAGXUOTOTTQT-UHFFFAOYSA-N 0 1 311.759 4.259 20 0 DIADMN C/C(=C\c1ccccc1)CN(C)Cc1cnn(CC2CCC2)c1 ZINC001462092592 1063923982 /nfs/dbraw/zinc/92/39/82/1063923982.db2.gz CXXLBJSGSDTUMK-GZTJUZNOSA-N 0 1 309.457 4.219 20 0 DIADMN COC1CCC(CN(Cc2c(F)cccc2F)C2CC2)CC1 ZINC001462098903 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C[C@H](c1ccc(C(C)(C)C)cc1)[N@H+]1CC[C@@H](C)[C@@H](C(=O)[O-])C1 ZINC000564328485 341227604 /nfs/dbraw/zinc/22/76/04/341227604.db2.gz QOVQZCLWFNHHHS-CPUCHLNUSA-N 0 1 303.446 4.088 20 0 DIADMN C[C@H](N[C@H]1CCCc2sccc21)c1nc2c(s1)CCC2 ZINC000134969954 341227627 /nfs/dbraw/zinc/22/76/27/341227627.db2.gz QLAYKZODCDMNJB-JQWIXIFHSA-N 0 1 304.484 4.422 20 0 DIADMN C[C@@H](N[C@H]1CCCc2sccc21)c1nc2c(s1)CCC2 ZINC000134969972 341227636 /nfs/dbraw/zinc/22/76/36/341227636.db2.gz QLAYKZODCDMNJB-PWSUYJOCSA-N 0 1 304.484 4.422 20 0 DIADMN CC(C)(CCCc1ccccc1)c1nc(C2(N)CCCC2)no1 ZINC000564329072 341228744 /nfs/dbraw/zinc/22/87/44/341228744.db2.gz YCANKCQPQWTDMC-UHFFFAOYSA-N 0 1 313.445 4.098 20 0 DIADMN Fc1cc(Cl)ccc1CNC1(c2ccccc2)CCOCC1 ZINC000547737373 341229567 /nfs/dbraw/zinc/22/95/67/341229567.db2.gz PVEGGXSGYOJZFW-UHFFFAOYSA-N 0 1 319.807 4.275 20 0 DIADMN C[C@@H](NCc1ccccc1)c1nc2ccccc2n1C(F)F ZINC000547747837 341230111 /nfs/dbraw/zinc/23/01/11/341230111.db2.gz PYLMRQJXKJSVJO-GFCCVEGCSA-N 0 1 301.340 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322.474 4.277 20 0 DIADMN O=C(Nc1ccc(Cl)cc1F)c1cn[nH]c1-c1ccccc1 ZINC000078302016 341240070 /nfs/dbraw/zinc/24/00/70/341240070.db2.gz IVBSAAPVSSXKKU-UHFFFAOYSA-N 0 1 315.735 4.122 20 0 DIADMN O=C([O-])c1ccccc1CC[N@H+]1CCC[C@@H]1CC1CCCCC1 ZINC000564336742 341242372 /nfs/dbraw/zinc/24/23/72/341242372.db2.gz GGURTLZYTQCZQS-GOSISDBHSA-N 0 1 315.457 4.362 20 0 DIADMN CC(C)CSCCN[C@@H](c1ccccc1)c1ccccn1 ZINC000135989490 341249684 /nfs/dbraw/zinc/24/96/84/341249684.db2.gz OUXUNIGSRBYKIN-SFHVURJKSA-N 0 1 300.471 4.150 20 0 DIADMN CCC[C@H]1CCCC[C@H]1NCc1noc(-c2ccsc2)n1 ZINC000548160490 341250367 /nfs/dbraw/zinc/25/03/67/341250367.db2.gz UXDXTCJGOQATFM-GXTWGEPZSA-N 0 1 305.447 4.247 20 0 DIADMN COc1ccccc1C(C)(C)NCc1cc(-c2ccccc2)n[nH]1 ZINC000136036116 341251185 /nfs/dbraw/zinc/25/11/85/341251185.db2.gz QOCCGWLDMCGGBK-UHFFFAOYSA-N 0 1 321.424 4.110 20 0 DIADMN Cc1cccc([C@H](C)NCc2cc(Cl)cc3c2OCC3)c1 ZINC000136405049 341258638 /nfs/dbraw/zinc/25/86/38/341258638.db2.gz LYGBWKQPGMKURA-ZDUSSCGKSA-N 0 1 301.817 4.434 20 0 DIADMN CCC[C@@H]1CCCC[C@@H]1NCc1nc([C@@H](C)OCC(C)C)no1 ZINC000548488268 341263592 /nfs/dbraw/zinc/26/35/92/341263592.db2.gz BUNGKUUMGVYKBZ-OAGGEKHMSA-N 0 1 323.481 4.252 20 0 DIADMN Cc1[nH]nc2cc(NC(=O)c3coc(C4CCCCC4)n3)ccc12 ZINC000548605706 341266978 /nfs/dbraw/zinc/26/69/78/341266978.db2.gz XVJNARMXUCUTRO-UHFFFAOYSA-N 0 1 324.384 4.159 20 0 DIADMN O=C([O-])CCC[N@@H+](C1CC1)[C@H]1CCCC[C@@H]1C1CCCCC1 ZINC000548626888 341267595 /nfs/dbraw/zinc/26/75/95/341267595.db2.gz OOPXUMGUELWDSE-MSOLQXFVSA-N 0 1 307.478 4.455 20 0 DIADMN CO[C@]1(C)CCCN([C@H](C)c2ccc(Br)cc2)C1 ZINC000548752564 341272132 /nfs/dbraw/zinc/27/21/32/341272132.db2.gz FRGNPTZEGFIAGV-IUODEOHRSA-N 0 1 312.251 4.011 20 0 DIADMN CC[C@H](NC(=O)c1c(C)n[nH]c1C(C)C)c1ccc(F)cc1F ZINC000137175696 341273334 /nfs/dbraw/zinc/27/33/34/341273334.db2.gz YKCYARVLCZJNDU-AWEZNQCLSA-N 0 1 321.371 4.001 20 0 DIADMN O=C(c1ccc(O)c(Cl)c1)N1CCC[C@@H]1c1cccc(F)c1 ZINC000080436734 341273460 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C[C@@H]1CC[N@H+]([C@H](C(=O)[O-])c2ccccc2)CC12CCCCC2 ZINC000581671971 1037892035 /nfs/dbraw/zinc/89/20/35/1037892035.db2.gz PMLWNHUYBOWQGE-WBVHZDCISA-N 0 1 301.430 4.105 20 0 DIADMN Cc1cc(CNCc2c(Cl)cccc2SC(C)C)n[nH]1 ZINC000684386094 1037912499 /nfs/dbraw/zinc/91/24/99/1037912499.db2.gz MQKXUDZCMUHHGV-UHFFFAOYSA-N 0 1 309.866 4.162 20 0 DIADMN COc1cc(CN2CCC[C@@H](C)[C@H]2c2ccc(C)cc2)sn1 ZINC001167478779 1037917865 /nfs/dbraw/zinc/91/78/65/1037917865.db2.gz YDRIWWCRDWLHOJ-KDOFPFPSSA-N 0 1 316.470 4.433 20 0 DIADMN CCN1C[C@@H](C)N(C(=O)CC2CCC(C(C)(C)C)CC2)C[C@@H]1C ZINC001266802595 1037921265 /nfs/dbraw/zinc/92/12/65/1037921265.db2.gz NIERTXVHYTXROE-KNXWPPODSA-N 0 1 322.537 4.170 20 0 DIADMN O=[N+]([O-])c1ccc(F)cc1CN1CCC[C@H]1c1ccccc1 ZINC000051180487 1037938651 /nfs/dbraw/zinc/93/86/51/1037938651.db2.gz CGQOLOSWNBZGJB-INIZCTEOSA-N 0 1 300.333 4.071 20 0 DIADMN C[C@@H]1C[C@@H](N[C@@H](c2ccsc2)c2ccc(Cl)cc2)CO1 ZINC000647175315 1037945223 /nfs/dbraw/zinc/94/52/23/1037945223.db2.gz 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/nfs/dbraw/zinc/03/18/87/1038031887.db2.gz DBBRQDOLACPSSD-SNVBAGLBSA-N 0 1 309.456 4.064 20 0 DIADMN C[C@@H](c1ccc(OC(F)F)cc1)N1CCO[C@@H](C(C)(C)C)C1 ZINC000581864772 1038042442 /nfs/dbraw/zinc/04/24/42/1038042442.db2.gz RKEKSVXPJIZNRC-SWLSCSKDSA-N 0 1 313.388 4.096 20 0 DIADMN COc1cc(F)c(F)cc1CN1CC[C@@H](c2ccc(F)cc2)C1 ZINC001143399701 1038045867 /nfs/dbraw/zinc/04/58/67/1038045867.db2.gz BUFDMHOCKCFSGS-CYBMUJFWSA-N 0 1 321.342 4.102 20 0 DIADMN O=C(CCc1cnc[nH]1)Nc1cccc(Sc2ccccc2)c1 ZINC000684437595 1038052096 /nfs/dbraw/zinc/05/20/96/1038052096.db2.gz UDWNHZVARKCETO-UHFFFAOYSA-N 0 1 323.421 4.132 20 0 DIADMN COC(=O)c1csc(CN[C@H](C)c2ccc(SC)cc2)c1 ZINC000602658374 1038061867 /nfs/dbraw/zinc/06/18/67/1038061867.db2.gz VKKBRMGTPXSYOX-LLVKDONJSA-N 0 1 321.467 4.107 20 0 DIADMN COC(=O)c1csc(CN[C@@H](C)c2ccccc2SC)c1 ZINC000602654012 1038062355 /nfs/dbraw/zinc/06/23/55/1038062355.db2.gz FXTRUSLVHRRJGT-NSHDSACASA-N 0 1 321.467 4.107 20 0 DIADMN CN(C)Cc1cc(NCc2csc(C3CC3)n2)ccc1Cl ZINC000341513173 1038065821 /nfs/dbraw/zinc/06/58/21/1038065821.db2.gz PPQPPGRHURYZJV-UHFFFAOYSA-N 0 1 321.877 4.348 20 0 DIADMN CC(C)N(Cc1cccs1)Cc1cccc2[nH]c(=O)oc21 ZINC000891626301 1038087663 /nfs/dbraw/zinc/08/76/63/1038087663.db2.gz IVFPVGSSBJVAKZ-UHFFFAOYSA-N 0 1 302.399 4.006 20 0 DIADMN CC1(C)[C@@H]2CN(Cc3nc4c(s3)C(C)(C)CC(C)(C)C4)C[C@@H]21 ZINC001167488331 1038094137 /nfs/dbraw/zinc/09/41/37/1038094137.db2.gz YVNUSXUSMIUZON-BETUJISGSA-N 0 1 318.530 4.481 20 0 DIADMN C[C@@H](c1ncc(-c2ccccc2)o1)N1CCSC(C)(C)C1 ZINC000083415598 1038101107 /nfs/dbraw/zinc/10/11/07/1038101107.db2.gz XDDRVCHAXPGEMD-ZDUSSCGKSA-N 0 1 302.443 4.230 20 0 DIADMN Fc1ccc(-c2cc(-c3nc(-c4ccc(F)cc4)no3)[nH]n2)cc1 ZINC000598471813 1038103241 /nfs/dbraw/zinc/10/32/41/1038103241.db2.gz XKJREYCDFOOAML-UHFFFAOYSA-N 0 1 324.290 4.072 20 0 DIADMN COC(=O)c1cc(CN[C@@H](c2ccccc2)C(C)(C)C)oc1C ZINC000097394030 1038104302 /nfs/dbraw/zinc/10/43/02/1038104302.db2.gz OLAVKALQQXSTFI-KRWDZBQOSA-N 0 1 315.413 4.252 20 0 DIADMN COC(=O)c1cc(CN[C@H](c2ccccc2)C(C)(C)C)oc1C ZINC000097394032 1038104620 /nfs/dbraw/zinc/10/46/20/1038104620.db2.gz OLAVKALQQXSTFI-QGZVFWFLSA-N 0 1 315.413 4.252 20 0 DIADMN Cc1n[nH]c(C(F)F)c1NC(=O)c1ccc(-c2cccs2)o1 ZINC000341552015 1038127651 /nfs/dbraw/zinc/12/76/51/1038127651.db2.gz PVZNMXGOLWSLFL-UHFFFAOYSA-N 0 1 323.324 4.230 20 0 DIADMN Cc1ccc(C=Cc2n[nH]c(S[C@H](C)c3cccnc3)n2)o1 ZINC000341560800 1038136594 /nfs/dbraw/zinc/13/65/94/1038136594.db2.gz DMYZSHUISLUIOJ-ABZNLYFFSA-N 0 1 312.398 4.125 20 0 DIADMN Cc1ccc([C@H]2CCCN2Cc2nc3cccnc3s2)s1 ZINC000341576232 1038142552 /nfs/dbraw/zinc/14/25/52/1038142552.db2.gz PCXJZVMUJDCSSB-CYBMUJFWSA-N 0 1 315.467 4.398 20 0 DIADMN Cc1ccccc1[C@@H]1CCCN1Cc1nc2cccnc2s1 ZINC000341577736 1038145479 /nfs/dbraw/zinc/14/54/79/1038145479.db2.gz NREMMHVQXHTDKJ-INIZCTEOSA-N 0 1 309.438 4.337 20 0 DIADMN CC(C)(C)[C@@H](NCn1nccc1-c1cccnc1)c1ccccc1 ZINC000170637736 1038147999 /nfs/dbraw/zinc/14/79/99/1038147999.db2.gz JHTKRFKGIBIRCG-IBGZPJMESA-N 0 1 320.440 4.280 20 0 DIADMN c1cn(C2CC2)c(CN2CCC[C@@H](c3cc4ccccc4[nH]3)C2)n1 ZINC000891698415 1038148341 /nfs/dbraw/zinc/14/83/41/1038148341.db2.gz FBBMDCRUQLYOIH-MRXNPFEDSA-N 0 1 320.440 4.079 20 0 DIADMN C[C@@H](NCc1ccc(Cl)cc1F)c1ccc2c(c1)CCO2 ZINC000187582045 1038159822 /nfs/dbraw/zinc/15/98/22/1038159822.db2.gz IPRSMSBJZSJLOC-LLVKDONJSA-N 0 1 305.780 4.265 20 0 DIADMN CCN(Cc1c(C)nn(C(C)C)c1C)[C@H](C)c1cccc(O)c1 ZINC000891713725 1038159863 /nfs/dbraw/zinc/15/98/63/1038159863.db2.gz LQXXEBVUZUKDPH-OAHLLOKOSA-N 0 1 315.461 4.370 20 0 DIADMN O=C([O-])[C@H](c1ccccc1)[N@H+]1CCCC2(CCCCC2)CC1 ZINC000581948811 1038169208 /nfs/dbraw/zinc/16/92/08/1038169208.db2.gz BZTCPPSEXCHDCO-KRWDZBQOSA-N 0 1 301.430 4.249 20 0 DIADMN Cc1ccc(C[C@@H]2CCCN(Cc3nccn3C(C)C)C2)cc1 ZINC000581955600 1038172833 /nfs/dbraw/zinc/17/28/33/1038172833.db2.gz YMAWMXDXCLDKRU-IBGZPJMESA-N 0 1 311.473 4.227 20 0 DIADMN CC(C)(C)c1nnc(C[N@H+]2CCC[C@@H]2CC2CCCCC2)o1 ZINC000061040286 1038177352 /nfs/dbraw/zinc/17/73/52/1038177352.db2.gz 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/nfs/dbraw/zinc/22/27/26/1038222726.db2.gz FETNMOLQXJZTDG-UHFFFAOYSA-N 0 1 319.246 4.093 20 0 DIADMN Cc1cccc(CN(C)Cc2cccc(Br)c2C)n1 ZINC000341683603 1038222737 /nfs/dbraw/zinc/22/27/37/1038222737.db2.gz FETNMOLQXJZTDG-UHFFFAOYSA-N 0 1 319.246 4.093 20 0 DIADMN COc1ccc(C[N@@H+](C)[C@@H](C)c2cccs2)cc1OC1CC1 ZINC000628137243 1038228770 /nfs/dbraw/zinc/22/87/70/1038228770.db2.gz BURAOCDWXVSVLJ-ZDUSSCGKSA-N 0 1 317.454 4.491 20 0 DIADMN CCC(=O)Nc1cccc(CNc2ccnc3cc(F)ccc32)c1 ZINC000603493222 1038230627 /nfs/dbraw/zinc/23/06/27/1038230627.db2.gz SDKWSXMKCBTRPL-UHFFFAOYSA-N 0 1 323.371 4.335 20 0 DIADMN COc1cccc(CN[C@@H]2CCCc3ccc(F)cc32)c1F ZINC000669685042 1038234701 /nfs/dbraw/zinc/23/47/01/1038234701.db2.gz NUZRKILUMLCDHD-MRXNPFEDSA-N 0 1 303.352 4.141 20 0 DIADMN CCCCOc1ccc(CN[C@@H](C)c2ccccn2)cc1OC ZINC000060830467 1038248090 /nfs/dbraw/zinc/24/80/90/1038248090.db2.gz HMBNDGNPRGSBHU-HNNXBMFYSA-N 0 1 314.429 4.120 20 0 DIADMN C[C@H](c1nc(-c2ccc3cc[nH]c3c2)no1)[N@@H+]1[C@H](C)CC[C@@H]1C 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CCSCC[C@@H](C)N(C)Cc1coc(-c2ccccc2F)n1 ZINC000599330612 1038268568 /nfs/dbraw/zinc/26/85/68/1038268568.db2.gz NEIKUPGFSXWQJF-CYBMUJFWSA-N 0 1 322.449 4.444 20 0 DIADMN C[C@H](NC/C=C\Cl)c1cccc(NC(=O)c2ccccc2)c1 ZINC000255405273 1038277150 /nfs/dbraw/zinc/27/71/50/1038277150.db2.gz PPCOLFXBHHHISU-KGBIHWOQSA-N 0 1 314.816 4.342 20 0 DIADMN CSC[C@@H]1CCCN(Cc2nc3cc(C)ccc3s2)C1 ZINC000599426262 1038279522 /nfs/dbraw/zinc/27/95/22/1038279522.db2.gz AKFPJQXHSFLXEA-CYBMUJFWSA-N 0 1 306.500 4.180 20 0 DIADMN C[C@@H](N[C@H]1CCOc2c(F)cccc21)c1ccc2c(c1)COC2 ZINC000276926011 1038280065 /nfs/dbraw/zinc/28/00/65/1038280065.db2.gz NJAVTJJUZLQWLC-XIKOKIGWSA-N 0 1 313.372 4.030 20 0 DIADMN COc1cc2c(cc1F)nccc2N(C)Cc1ccsc1 ZINC000684565734 1038283470 /nfs/dbraw/zinc/28/34/70/1038283470.db2.gz IXQYEXNOHHYNCR-UHFFFAOYSA-N 0 1 302.374 4.080 20 0 DIADMN FC(F)(F)c1ccc(CN(Cc2ccccc2)C2CC2)nc1 ZINC000341829788 1038284905 /nfs/dbraw/zinc/28/49/05/1038284905.db2.gz CZFUKTQOZMGREF-UHFFFAOYSA-N 0 1 306.331 4.265 20 0 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1042230724 /nfs/dbraw/zinc/23/07/24/1042230724.db2.gz NFHAMSWTYDCVRA-UHFFFAOYSA-N 0 1 303.789 4.446 20 0 DIADMN C[C@@H](NC[C@@H]1CCC=CO1)c1ccc(C(F)(F)F)nc1Cl ZINC000820847044 1042231600 /nfs/dbraw/zinc/23/16/00/1042231600.db2.gz POLDHVGSSBIMJY-ZJUUUORDSA-N 0 1 320.742 4.097 20 0 DIADMN CC[C@@H](C)Sc1nc(-c2ccc(Br)cc2)n[nH]1 ZINC000059787831 1042239647 /nfs/dbraw/zinc/23/96/47/1042239647.db2.gz PRYJZVBKWOQSFR-MRVPVSSYSA-N 0 1 312.236 4.125 20 0 DIADMN CC(C)CN1Cc2cccc(NC(=O)C3(C)CC(F)(F)C3)c2C1 ZINC000821120767 1042243111 /nfs/dbraw/zinc/24/31/11/1042243111.db2.gz VFRDKTSFWQQCBA-UHFFFAOYSA-N 0 1 322.399 4.032 20 0 DIADMN CC(C)[C@H](CCc1ccccc1)C(=O)Nc1ccc2nc[nH]c2c1 ZINC001136430148 1042244528 /nfs/dbraw/zinc/24/45/28/1042244528.db2.gz FFFKHYGSVXWWKJ-KRWDZBQOSA-N 0 1 321.424 4.406 20 0 DIADMN Oc1ccc(CN[C@@H](c2ccccc2)c2ccc(F)cc2)cc1 ZINC000322531185 1042248998 /nfs/dbraw/zinc/24/89/98/1042248998.db2.gz WUKOYWXLTLPYQZ-FQEVSTJZSA-N 0 1 307.368 4.411 20 0 DIADMN COc1cccc2c1OCC[C@H]2NCc1cccc(C2CC2)c1 ZINC000643289039 1042253152 /nfs/dbraw/zinc/25/31/52/1042253152.db2.gz JZHIFKDDYVYJGM-GOSISDBHSA-N 0 1 309.409 4.186 20 0 DIADMN CC(=O)Nc1cccc([C@H](C)NCc2ccc(C)cc2Cl)c1 ZINC000318496735 1042254796 /nfs/dbraw/zinc/25/47/96/1042254796.db2.gz DMTDRRRLRAAYQM-ZDUSSCGKSA-N 0 1 316.832 4.458 20 0 DIADMN Cc1ccc(CN[C@@H](C)c2cncc(F)c2)c(OCC2CC2)c1 ZINC000166916971 1042255903 /nfs/dbraw/zinc/25/59/03/1042255903.db2.gz BYDIUOLOPMTJRX-AWEZNQCLSA-N 0 1 314.404 4.169 20 0 DIADMN C[C@H](NCc1ccc2c(c1)OCCO2)c1cc2ccccc2o1 ZINC000026313165 1042259859 /nfs/dbraw/zinc/25/98/59/1042259859.db2.gz YQIRGEHAXYQGOI-ZDUSSCGKSA-N 0 1 309.365 4.055 20 0 DIADMN C[C@@H](NCc1cncc(Cl)c1)c1ccc(OC(F)F)cc1 ZINC000621272738 1042274018 /nfs/dbraw/zinc/27/40/18/1042274018.db2.gz ATDMCJMUTGFACJ-SNVBAGLBSA-N 0 1 312.747 4.187 20 0 DIADMN C[C@@H](O)c1ccc(CN[C@H](C)c2ccc(F)cc2Cl)cc1 ZINC000178547198 1042286878 /nfs/dbraw/zinc/28/68/78/1042286878.db2.gz WOWUDFVZRHMJKB-VXGBXAGGSA-N 0 1 307.796 4.383 20 0 DIADMN C[C@@H](O)c1ccc(CN[C@@H](C)c2ccc(F)cc2Cl)cc1 ZINC000178547175 1042287183 /nfs/dbraw/zinc/28/71/83/1042287183.db2.gz WOWUDFVZRHMJKB-NWDGAFQWSA-N 0 1 307.796 4.383 20 0 DIADMN N#Cc1ccc(F)c(CN[C@H]2CCc3cc(Cl)ccc32)c1 ZINC000090117337 1042287827 /nfs/dbraw/zinc/28/78/27/1042287827.db2.gz PAFXCNFVNVTFKT-KRWDZBQOSA-N 0 1 300.764 4.128 20 0 DIADMN C[C@@H](O)c1ncc(CN2CC(C)(C)C[C@H]2c2ccccc2)s1 ZINC000822525187 1042289051 /nfs/dbraw/zinc/28/90/51/1042289051.db2.gz BPCCYSLQDZGALF-CJNGLKHVSA-N 0 1 316.470 4.170 20 0 DIADMN C[C@@H](O)c1ncc(CN2CC(C)(C)C[C@@H]2c2ccccc2)s1 ZINC000822525188 1042289241 /nfs/dbraw/zinc/28/92/41/1042289241.db2.gz BPCCYSLQDZGALF-CZUORRHYSA-N 0 1 316.470 4.170 20 0 DIADMN COc1ccc([C@H](C)N(C)Cc2cccc(F)c2OC)cc1 ZINC001143530289 1042290266 /nfs/dbraw/zinc/29/02/66/1042290266.db2.gz PSLCOZWDWLTWFW-ZDUSSCGKSA-N 0 1 303.377 4.036 20 0 DIADMN CN(CC[C@@H]1CC1(Cl)Cl)Cc1nc2ccccc2s1 ZINC000822575521 1042293182 /nfs/dbraw/zinc/29/31/82/1042293182.db2.gz SYCGDEMLSWYUNQ-SNVBAGLBSA-N 0 1 315.269 4.312 20 0 DIADMN c1c[nH]c([C@@H]2CCCCN2CCCCCOc2ccccc2)n1 ZINC000187093476 1042297743 /nfs/dbraw/zinc/29/77/43/1042297743.db2.gz YJYLCRJBHQIOQX-SFHVURJKSA-N 0 1 313.445 4.186 20 0 DIADMN CC(C)N(C)c1cccc(NC(=O)c2cc(Cl)ccc2O)c1 ZINC001136628718 1042301161 /nfs/dbraw/zinc/30/11/61/1042301161.db2.gz MUBZHBUNBDOQLB-UHFFFAOYSA-N 0 1 318.804 4.143 20 0 DIADMN CC(C)N(Cc1cccc(OC(F)F)c1)Cc1ccccn1 ZINC000050960824 1042305212 /nfs/dbraw/zinc/30/52/12/1042305212.db2.gz CBMJGDDXRVSGEF-UHFFFAOYSA-N 0 1 306.356 4.094 20 0 DIADMN C[C@@H]1CCN[C@H](c2nc(-c3ccc(Cl)cc3Cl)no2)C1 ZINC000823070079 1042311934 /nfs/dbraw/zinc/31/19/34/1042311934.db2.gz YLDVTHJXBVPCOB-PELKAZGASA-N 0 1 312.200 4.104 20 0 DIADMN CC(Cl)=CC(=O)Nc1ccccc1-c1nc2ccccc2[nH]1 ZINC001136691598 1042317837 /nfs/dbraw/zinc/31/78/37/1042317837.db2.gz WVYGUGUMHKZJQE-ZHACJKMWSA-N 0 1 311.772 4.311 20 0 DIADMN Fc1cccc2c1C[C@@H](N1CCc3cc(F)c(F)cc3C1)CC2 ZINC001171012360 1042318575 /nfs/dbraw/zinc/31/85/75/1042318575.db2.gz PFRPJCPBEBHFFL-HNNXBMFYSA-N 0 1 317.354 4.020 20 0 DIADMN C[C@@H](NC(=O)[C@]1(C)CC=CCC1)c1nc2ccc(Cl)cc2[nH]1 ZINC000823267463 1042318754 /nfs/dbraw/zinc/31/87/54/1042318754.db2.gz VRRSLRUPCHVMIH-PIGZYNQJSA-N 0 1 317.820 4.140 20 0 DIADMN CC[C@@H]1CCC[C@H]1C(=O)N[C@@H](C)c1nc2ccc(Cl)cc2[nH]1 ZINC000823267282 1042318926 /nfs/dbraw/zinc/31/89/26/1042318926.db2.gz STMOTSXPKNVIEI-DMDPSCGWSA-N 0 1 319.836 4.220 20 0 DIADMN CCc1ccc(CN[C@@H](C)c2ccc(Br)cn2)cc1 ZINC000279624905 1042326599 /nfs/dbraw/zinc/32/65/99/1042326599.db2.gz BDGNFYJPCGWIMV-LBPRGKRZSA-N 0 1 319.246 4.257 20 0 DIADMN CO[C@@H](c1ccccc1)[C@@H](C)NCc1coc(-c2ccccc2)n1 ZINC000279652754 1042328305 /nfs/dbraw/zinc/32/83/05/1042328305.db2.gz CBMYZKFKQMOLHG-DNVCBOLYSA-N 0 1 322.408 4.207 20 0 DIADMN C[C@@H](N[C@@H](c1nnc[nH]1)C1CCCCC1)c1cccc(F)c1F ZINC000638801731 1042328495 /nfs/dbraw/zinc/32/84/95/1042328495.db2.gz FJYNHLNLKQLXSU-BDJLRTHQSA-N 0 1 320.387 4.055 20 0 DIADMN Cc1n[nH]c(C)c1[C@@H]1CCCN1Cc1cccc(C(F)F)c1 ZINC000279676894 1042330532 /nfs/dbraw/zinc/33/05/32/1042330532.db2.gz GFIXGWSKJYBXHV-HNNXBMFYSA-N 0 1 305.372 4.301 20 0 DIADMN CN(CCCCCO)Cc1nc(-c2ccccc2Cl)cs1 ZINC000279700575 1042332425 /nfs/dbraw/zinc/33/24/25/1042332425.db2.gz IVKKMBHZLQPDLE-UHFFFAOYSA-N 0 1 324.877 4.058 20 0 DIADMN C[C@H](NCc1ccc(Oc2ccc(F)cc2)nc1)c1cccnc1 ZINC000112531265 1042340906 /nfs/dbraw/zinc/34/09/06/1042340906.db2.gz ACRJZNXMWSKSIS-AWEZNQCLSA-N 0 1 323.371 4.259 20 0 DIADMN C[C@H](NCc1cccnc1Oc1cccc(F)c1)c1cccnc1 ZINC000112526704 1042341318 /nfs/dbraw/zinc/34/13/18/1042341318.db2.gz WDMKQALNLQTSQU-AWEZNQCLSA-N 0 1 323.371 4.259 20 0 DIADMN Cc1ccsc1CN[C@@H](C)c1ccc(Br)cn1 ZINC000279773156 1042342005 /nfs/dbraw/zinc/34/20/05/1042342005.db2.gz KNLWKANGKWZPJQ-JTQLQIEISA-N 0 1 311.248 4.065 20 0 DIADMN C[C@H]1SCCN(Cc2ccccc2Oc2cccnc2)[C@@H]1C ZINC000112644635 1042341920 /nfs/dbraw/zinc/34/19/20/1042341920.db2.gz YPFWXCAQPMPYSS-HUUCEWRRSA-N 0 1 314.454 4.200 20 0 DIADMN CC[C@@H](NCc1ccnn1C(C)C)c1ccccc1OC(F)F ZINC000279806254 1042344270 /nfs/dbraw/zinc/34/42/70/1042344270.db2.gz FIQMPZZHUUHORR-OAHLLOKOSA-N 0 1 323.387 4.306 20 0 DIADMN Cc1ccc(C)c(CN[C@@H](C)c2ccc(Br)cn2)c1 ZINC000279831122 1042345554 /nfs/dbraw/zinc/34/55/54/1042345554.db2.gz QHQRLQWLNWVXIR-ZDUSSCGKSA-N 0 1 319.246 4.312 20 0 DIADMN COc1ccccc1-c1nc(CN(C)[C@H]2CC[C@H](C)C2)cs1 ZINC000429582580 1042365976 /nfs/dbraw/zinc/36/59/76/1042365976.db2.gz DEQFXTHCKGVHGB-ZFWWWQNUSA-N 0 1 316.470 4.439 20 0 DIADMN CC(C)CC[C@](C)(O)CNCc1csc(-c2ccccc2)n1 ZINC000236631180 1042370967 /nfs/dbraw/zinc/37/09/67/1042370967.db2.gz DHTSQGACXRTTDK-SFHVURJKSA-N 0 1 318.486 4.087 20 0 DIADMN C[C@@H](CF)NCc1cn(C(C)(C)C)nc1-c1ccccc1Cl ZINC000644890824 1042371343 /nfs/dbraw/zinc/37/13/43/1042371343.db2.gz MISWYQGSLFBYHV-LBPRGKRZSA-N 0 1 323.843 4.406 20 0 DIADMN Fc1cccc(C2(NCc3cccc(Br)c3)CC2)c1 ZINC000237739337 1042379673 /nfs/dbraw/zinc/37/96/73/1042379673.db2.gz FILQAAKCNBCLKZ-UHFFFAOYSA-N 0 1 320.205 4.367 20 0 DIADMN Cc1ccncc1CN[C@H]1CCCOc2cc(Cl)ccc21 ZINC000279931130 1042386365 /nfs/dbraw/zinc/38/63/65/1042386365.db2.gz WBNRFFLXZUEMRS-INIZCTEOSA-N 0 1 302.805 4.047 20 0 DIADMN Cc1ccsc1CNCc1cc(Br)ccc1F ZINC000041065043 1042392900 /nfs/dbraw/zinc/39/29/00/1042392900.db2.gz XRIHUGOIIDZNPS-UHFFFAOYSA-N 0 1 314.223 4.248 20 0 DIADMN CCn1cc(CN(C)Cc2ccc(SC(C)C)cc2)cn1 ZINC000540966125 1042393789 /nfs/dbraw/zinc/39/37/89/1042393789.db2.gz BLCSFEUGVVDWRM-UHFFFAOYSA-N 0 1 303.475 4.036 20 0 DIADMN Cc1ncoc1CN1CC=C(c2c(C)[nH]c3ccccc32)CC1 ZINC000893923035 1042396619 /nfs/dbraw/zinc/39/66/19/1042396619.db2.gz DMWBUHUCWVCZDM-UHFFFAOYSA-N 0 1 307.397 4.062 20 0 DIADMN Cc1ncoc1CN1CCC(Oc2ccc(C(C)C)cc2)CC1 ZINC000893966607 1042399317 /nfs/dbraw/zinc/39/93/17/1042399317.db2.gz QTSSYDOPVBHNSM-UHFFFAOYSA-N 0 1 314.429 4.150 20 0 DIADMN COc1ccc(CN[C@@H](C)c2ccc(OC(F)(F)F)cc2)o1 ZINC000893997167 1042400871 /nfs/dbraw/zinc/40/08/71/1042400871.db2.gz JBURZOAMMDAEQC-JTQLQIEISA-N 0 1 315.291 4.038 20 0 DIADMN Cc1nc(-c2ccccc2)sc1[C@H](C)NCc1ccns1 ZINC000624047611 1042404800 /nfs/dbraw/zinc/40/48/00/1042404800.db2.gz IRWBJZZYOFBQNC-NSHDSACASA-N 0 1 315.467 4.426 20 0 DIADMN O=C1[C@@H]2CCCCCC2=NN1c1nc(-c2ccccc2)cs1 ZINC000614185880 1042425537 /nfs/dbraw/zinc/42/55/37/1042425537.db2.gz ZIBGYIORDIHUGN-CYBMUJFWSA-N 0 1 311.410 4.093 20 0 DIADMN CO[C@H]1CCC[C@H]1Sc1nc2ccc(C(F)(F)F)cc2[nH]1 ZINC000645028653 1042425827 /nfs/dbraw/zinc/42/58/27/1042425827.db2.gz PTIMNLXRIXDPKW-NWDGAFQWSA-N 0 1 316.348 4.241 20 0 DIADMN C[C@@H](c1nc2ccccc2s1)N(C)C[C@@H](O)c1ccccc1 ZINC000247060312 1042428329 /nfs/dbraw/zinc/42/83/29/1042428329.db2.gz SKTLHSMTSDFRAZ-XJKSGUPXSA-N 0 1 312.438 4.023 20 0 DIADMN C[C@H](N[C@@H](C)c1ccc(Br)cn1)c1ccc(F)cc1 ZINC000279959379 1042430035 /nfs/dbraw/zinc/43/00/35/1042430035.db2.gz CEIZWIXOPFFOPA-QWRGUYRKSA-N 0 1 323.209 4.395 20 0 DIADMN CC[C@@H](CN1CCC[C@H]1c1ccc(Br)s1)OC ZINC000419238888 1042442643 /nfs/dbraw/zinc/44/26/43/1042442643.db2.gz DQGDQCBKMAHXCN-QWRGUYRKSA-N 0 1 318.280 4.073 20 0 DIADMN Fc1cc(-c2ncco2)ccc1C[N@H+]1CCC[C@H]1c1ccc[nH]1 ZINC000411333917 1042439533 /nfs/dbraw/zinc/43/95/33/1042439533.db2.gz BLOAKGRPGOIHTB-KRWDZBQOSA-N 0 1 311.360 4.146 20 0 DIADMN Fc1cc(-c2ncco2)ccc1CN1CCC[C@H]1c1ccc[nH]1 ZINC000411333917 1042439537 /nfs/dbraw/zinc/43/95/37/1042439537.db2.gz BLOAKGRPGOIHTB-KRWDZBQOSA-N 0 1 311.360 4.146 20 0 DIADMN CCC[N@@H+](Cc1ccc(-n2cccn2)cc1)Cc1ccccc1F ZINC000614223050 1042439735 /nfs/dbraw/zinc/43/97/35/1042439735.db2.gz JTUWZEOWIIKODU-UHFFFAOYSA-N 0 1 323.415 4.424 20 0 DIADMN CC[C@@H](NCCOCC1CCC1)c1nc(C(F)(F)F)cs1 ZINC000419243861 1042446113 /nfs/dbraw/zinc/44/61/13/1042446113.db2.gz MEMQEEMPUZCDIV-LLVKDONJSA-N 0 1 322.396 4.019 20 0 DIADMN CO[C@@H](CNC(C)(C)c1nc(C(F)(F)F)cs1)CC(C)C ZINC000419243929 1042446130 /nfs/dbraw/zinc/44/61/30/1042446130.db2.gz MHPMCPYTTYVCKD-SNVBAGLBSA-N 0 1 324.412 4.048 20 0 DIADMN Cc1cc(-c2nnc(CN3CCCC4(CCCC4)C3)o2)c(C)o1 ZINC000408445510 1042446569 /nfs/dbraw/zinc/44/65/69/1042446569.db2.gz 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1046066323 /nfs/dbraw/zinc/06/63/23/1046066323.db2.gz IIYOBAMOJADRMT-UHFFFAOYSA-N 0 1 301.833 4.161 20 0 DIADMN CCO[C@@H]1CCC[C@H](N[C@@H](c2nccs2)c2ccccc2)C1 ZINC000902779553 1046067145 /nfs/dbraw/zinc/06/71/45/1046067145.db2.gz WCSMODQGCHPSKG-GVDBMIGSSA-N 0 1 316.470 4.170 20 0 DIADMN COc1cc(CN[C@H](C)c2ccc(C(F)(F)F)cn2)ccc1C ZINC000902775328 1046067588 /nfs/dbraw/zinc/06/75/88/1046067588.db2.gz UBQKCKAGEGWZDK-GFCCVEGCSA-N 0 1 324.346 4.268 20 0 DIADMN CC(=CC(=O)N[C@@H](CC(C)C)c1nc2ccccc2[nH]1)C1CC1 ZINC000193761169 1046067806 /nfs/dbraw/zinc/06/78/06/1046067806.db2.gz ZUHOYLHDSRLYQZ-HVJHFUJKSA-N 0 1 311.429 4.123 20 0 DIADMN CCCn1cc([C@H](C)N[C@@H](c2ccccc2)C2CCCC2)nn1 ZINC000902779201 1046067977 /nfs/dbraw/zinc/06/79/77/1046067977.db2.gz SJXBWAXKJREZRO-KXBFYZLASA-N 0 1 312.461 4.270 20 0 DIADMN COc1ccc2c(c1)C[C@H](C)C[C@H]2N[C@@H](C)c1nc(C)cs1 ZINC000902789063 1046069065 /nfs/dbraw/zinc/06/90/65/1046069065.db2.gz HKPXSFWBEYZRAL-PLQHRBFRSA-N 0 1 316.470 4.434 20 0 DIADMN C[C@@H](N[C@H]1CCc2c1cccc2O)c1ccc(C(F)(F)F)cn1 ZINC000902793974 1046072555 /nfs/dbraw/zinc/07/25/55/1046072555.db2.gz PMEKOZOIPGUWLN-BMIGLBTASA-N 0 1 322.330 4.144 20 0 DIADMN CC(C)C[C@H](N)c1noc(Cc2cc(Cl)cc(Cl)c2)n1 ZINC000634555127 1046075029 /nfs/dbraw/zinc/07/50/29/1046075029.db2.gz ARVXJMGFUAURRG-LBPRGKRZSA-N 0 1 314.216 4.013 20 0 DIADMN COc1ccc2c(c1)C[C@H](C)C[C@@H]2N[C@H](C)c1c(C)noc1C ZINC000902803869 1046075186 /nfs/dbraw/zinc/07/51/86/1046075186.db2.gz KCIRLCJGJYJSEW-IUUKEHGRSA-N 0 1 314.429 4.274 20 0 DIADMN Cc1nc(C)c(CN[C@@H](C)c2ccc(C(F)(F)F)cn2)s1 ZINC000902819013 1046076660 /nfs/dbraw/zinc/07/66/60/1046076660.db2.gz DNHIMINWCPLEJX-QMMMGPOBSA-N 0 1 315.364 4.025 20 0 DIADMN Fc1ccc([C@@H](NCC2(C3CCC3)CCC2)c2ncc[nH]2)cc1 ZINC000453399879 1046077567 /nfs/dbraw/zinc/07/75/67/1046077567.db2.gz NYPUANTUKZNFAW-QGZVFWFLSA-N 0 1 313.420 4.198 20 0 DIADMN CC(C)(CN[C@@H](c1ncc[nH]1)c1ccc(F)cc1)C1=CCCC1 ZINC000453409616 1046079581 /nfs/dbraw/zinc/07/95/81/1046079581.db2.gz 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ZINC000634697862 1046087298 /nfs/dbraw/zinc/08/72/98/1046087298.db2.gz UQBDVUBGLIUWSB-DZGCQCFKSA-N 0 1 305.418 4.249 20 0 DIADMN CCN(Cc1ccncc1)Cc1cc(F)ccc1C(F)(F)F ZINC001138086643 1046088340 /nfs/dbraw/zinc/08/83/40/1046088340.db2.gz IFYOTVYDAZDLGQ-UHFFFAOYSA-N 0 1 312.310 4.262 20 0 DIADMN Fc1ccc(C(F)(F)F)c(CN2CC[C@@H](c3cccnc3)C2)c1 ZINC001138092545 1046090216 /nfs/dbraw/zinc/09/02/16/1046090216.db2.gz NCXBRRSZVYOURF-CYBMUJFWSA-N 0 1 324.321 4.229 20 0 DIADMN C[C@@H]1Cc2cn[nH]c2[C@H](C(=O)N2CCC[C@@H](C)c3ccccc32)C1 ZINC001138106482 1046092081 /nfs/dbraw/zinc/09/20/81/1046092081.db2.gz OWSIXMRZCPSUIO-CKEIUWERSA-N 0 1 323.440 4.006 20 0 DIADMN CN(Cc1nc2ccc(F)cc2o1)[C@H]1CCCc2ccccc21 ZINC000532072453 1046094673 /nfs/dbraw/zinc/09/46/73/1046094673.db2.gz NAAUTKPWZYVQFG-KRWDZBQOSA-N 0 1 310.372 4.476 20 0 DIADMN CCCCOc1ccc(CNCc2ccc(CC)o2)cc1OC ZINC000532114083 1046095405 /nfs/dbraw/zinc/09/54/05/1046095405.db2.gz ZYMWFWCSFBZDLM-UHFFFAOYSA-N 0 1 317.429 4.319 20 0 DIADMN CC[C@@]1(C(C)C)C[C@H]1NCc1csc(-c2ccccn2)n1 ZINC000453607754 1046098883 /nfs/dbraw/zinc/09/88/83/1046098883.db2.gz HCOOZJSMNJUGIE-WBVHZDCISA-N 0 1 301.459 4.119 20 0 DIADMN C[C@@H](N[C@@H](c1cccnc1)C1CC1)c1ccc(C(F)(F)F)cn1 ZINC000902889432 1046101740 /nfs/dbraw/zinc/10/17/40/1046101740.db2.gz JGHMICZRXKRSOX-BDJLRTHQSA-N 0 1 321.346 4.297 20 0 DIADMN CCCOc1ncccc1CN[C@H]1CCc2c1cccc2Cl ZINC000532205211 1046109047 /nfs/dbraw/zinc/10/90/47/1046109047.db2.gz SWWMUSYGWQZMPI-KRWDZBQOSA-N 0 1 316.832 4.301 20 0 DIADMN CCC(CC)N(CC)Cc1cc(O)ccc1Br ZINC001138147160 1046109238 /nfs/dbraw/zinc/10/92/38/1046109238.db2.gz LHPWWCLWAJJAOK-UHFFFAOYSA-N 0 1 300.240 4.165 20 0 DIADMN Cc1cccc2c1CC[N@@H+](Cc1ccc(N3CCCCC3)o1)C2 ZINC001138170997 1046110847 /nfs/dbraw/zinc/11/08/47/1046110847.db2.gz NEUCHYVOOIYEDJ-UHFFFAOYSA-N 0 1 310.441 4.137 20 0 DIADMN Cc1cccc2c1CCN(Cc1ccc(N3CCCCC3)o1)C2 ZINC001138170997 1046110853 /nfs/dbraw/zinc/11/08/53/1046110853.db2.gz NEUCHYVOOIYEDJ-UHFFFAOYSA-N 0 1 310.441 4.137 20 0 DIADMN C[C@@H]1CC[N@@H+](Cc2ccc(N3CCCCC3)o2)CCC1(F)F ZINC001138172573 1046111064 /nfs/dbraw/zinc/11/10/64/1046111064.db2.gz UVWYOEXVSJISBF-CQSZACIVSA-N 0 1 312.404 4.137 20 0 DIADMN CCN(Cc1ccc(N2CCCCC2)o1)Cc1cccc(F)c1 ZINC001138178496 1046113421 /nfs/dbraw/zinc/11/34/21/1046113421.db2.gz JKTXPEBUYJCHAD-UHFFFAOYSA-N 0 1 316.420 4.431 20 0 DIADMN C[C@H]1Cc2ccccc2CN1Cc1ccc(N2CCCCC2)o1 ZINC001138178724 1046113754 /nfs/dbraw/zinc/11/37/54/1046113754.db2.gz SJZVAIOWNPNDDN-INIZCTEOSA-N 0 1 310.441 4.217 20 0 DIADMN CC(C)n1cc([C@H](C)N[C@@H]2CC(C)(C)Cc3occc32)cn1 ZINC000532229171 1046119617 /nfs/dbraw/zinc/11/96/17/1046119617.db2.gz XDGLHKLNQSWSGD-XJKSGUPXSA-N 0 1 301.434 4.421 20 0 DIADMN COc1cc(C)ccc1[C@H](C)NCc1nc2ccc(C)cc2[nH]1 ZINC000532240766 1046124134 /nfs/dbraw/zinc/12/41/34/1046124134.db2.gz WKKMAYOTBUXFJT-AWEZNQCLSA-N 0 1 309.413 4.039 20 0 DIADMN CC[C@@H](CC(F)(F)F)N[C@@H](C)c1ccc(C(F)(F)F)cn1 ZINC000902953852 1046125238 /nfs/dbraw/zinc/12/52/38/1046125238.db2.gz LROPWAXXDQYKSS-WPRPVWTQSA-N 0 1 314.273 4.482 20 0 DIADMN CCCn1cc([C@H](C)N[C@@H]2c3ccccc3CCC[C@H]2C)nn1 ZINC000902953797 1046125733 /nfs/dbraw/zinc/12/57/33/1046125733.db2.gz KNCMUIQSMCPCNJ-VCBZYWHSSA-N 0 1 312.461 4.052 20 0 DIADMN c1c(CN[C@@H]2CSc3ccccc32)[nH]nc1-c1ccccc1 ZINC000532264373 1046126589 /nfs/dbraw/zinc/12/65/89/1046126589.db2.gz STJKALGSVNNZDP-QGZVFWFLSA-N 0 1 307.422 4.013 20 0 DIADMN C[C@@H](N[C@H](CO)c1ccsc1)c1ccc(C(F)(F)F)s1 ZINC000902956235 1046127323 /nfs/dbraw/zinc/12/73/23/1046127323.db2.gz DVQRSKKMRJSHCI-PSASIEDQSA-N 0 1 321.389 4.213 20 0 DIADMN C[C@@H](N[C@@H](C)CC(F)(F)F)c1ccc(C(F)(F)F)cn1 ZINC000902956359 1046127342 /nfs/dbraw/zinc/12/73/42/1046127342.db2.gz HUTOJTYEQGSKHJ-JGVFFNPUSA-N 0 1 300.246 4.092 20 0 DIADMN C[C@@H]1C[N@@H+](Cc2ccc(OCc3ccc(F)cc3)cc2)C[C@@H]1F ZINC001138247983 1046128182 /nfs/dbraw/zinc/12/81/82/1046128182.db2.gz LVMSZLOCTAVVPI-KUHUBIRLSA-N 0 1 317.379 4.195 20 0 DIADMN C[C@@H]1CN(Cc2ccc(OCc3ccc(F)cc3)cc2)C[C@@H]1F ZINC001138247983 1046128188 /nfs/dbraw/zinc/12/81/88/1046128188.db2.gz LVMSZLOCTAVVPI-KUHUBIRLSA-N 0 1 317.379 4.195 20 0 DIADMN Cc1ccc([C@H](C)N[C@H](C)c2ccnn2C2CCC2)cc1F ZINC000925254951 1046131240 /nfs/dbraw/zinc/13/12/40/1046131240.db2.gz SYSHAOUKYTUBAD-UONOGXRCSA-N 0 1 301.409 4.467 20 0 DIADMN Cc1ccc2nc([C@H]3CCCN3C(=O)C3(C4CC4)CCC3)[nH]c2c1 ZINC000902990457 1046137245 /nfs/dbraw/zinc/13/72/45/1046137245.db2.gz CKKVJEYMYLROFC-QGZVFWFLSA-N 0 1 323.440 4.115 20 0 DIADMN C[C@@H](NCC1(C(F)(F)F)CC1)c1ccc(C(F)(F)F)cn1 ZINC000902986727 1046137804 /nfs/dbraw/zinc/13/78/04/1046137804.db2.gz GPKYBFNREYKQRF-MRVPVSSYSA-N 0 1 312.257 4.094 20 0 DIADMN Cc1csc(CN[C@@H](C)c2ccc(C(F)(F)F)cn2)c1 ZINC000903008533 1046141534 /nfs/dbraw/zinc/14/15/34/1046141534.db2.gz QGAJEKVCGBYWEH-JTQLQIEISA-N 0 1 300.349 4.321 20 0 DIADMN C[C@@H]1CCN(Cc2c3ccccc3[nH]c2C(C)(C)C)CCC1=O ZINC001138310963 1046146906 /nfs/dbraw/zinc/14/69/06/1046146906.db2.gz QIUVRWIYARGWNS-CQSZACIVSA-N 0 1 312.457 4.266 20 0 DIADMN Cc1cccc(Cl)c1CN(C)CCCC(=O)c1cccnc1 ZINC001138720281 1046149101 /nfs/dbraw/zinc/14/91/01/1046149101.db2.gz RRKOOOLXUKWPMS-UHFFFAOYSA-N 0 1 316.832 4.138 20 0 DIADMN CC(C)[C@@H](N[C@H](C)c1ccc(C(C)(C)C)cc1)c1nncn1C ZINC000903061249 1046150196 /nfs/dbraw/zinc/15/01/96/1046150196.db2.gz LXHLSINRKJFEKK-RHSMWYFYSA-N 0 1 314.477 4.161 20 0 DIADMN CC(C)[C@H](N[C@@H](C)c1cccc2ccccc21)c1nncn1C ZINC000903060749 1046150847 /nfs/dbraw/zinc/15/08/47/1046150847.db2.gz FGLHXDNSMYCWOU-KSSFIOAISA-N 0 1 308.429 4.016 20 0 DIADMN COc1ccc2c(c1Cl)[C@@H](N[C@@H](C)c1cccnc1)CCC2 ZINC000903057382 1046151126 /nfs/dbraw/zinc/15/11/26/1046151126.db2.gz GMNFFVZYJAGNIB-WFASDCNBSA-N 0 1 316.832 4.472 20 0 DIADMN CC/C(C)=C(\C)C(=O)Nc1ccc2nc([C@@H]3CCCO3)[nH]c2c1 ZINC000779868853 1046151415 /nfs/dbraw/zinc/15/14/15/1046151415.db2.gz BZRLJGLSKZPXDM-PCUGXKRQSA-N 0 1 313.401 4.099 20 0 DIADMN Cc1ccc([C@@H]2CCCCN2Cc2cc(O)cc(O)c2)cc1C ZINC001138332718 1046153396 /nfs/dbraw/zinc/15/33/96/1046153396.db2.gz HRDJHTXGOONUCY-FQEVSTJZSA-N 0 1 311.425 4.442 20 0 DIADMN CC(C)(C)Oc1ccc(CNCc2cc3cccnc3o2)cc1 ZINC000648437647 1046154428 /nfs/dbraw/zinc/15/44/28/1046154428.db2.gz ISDHNBCRDXRUDV-UHFFFAOYSA-N 0 1 310.397 4.295 20 0 DIADMN CC/C(C)=C(\C)C(=O)N1CCC[C@H]1c1nc2ccc(C)cc2[nH]1 ZINC000779883541 1046154657 /nfs/dbraw/zinc/15/46/57/1046154657.db2.gz FKCFVTAIZMFMEO-CLVCIHKQSA-N 0 1 311.429 4.281 20 0 DIADMN Cc1ccc(CN[C@@H](CCc2cccnc2)c2ccccc2)o1 ZINC000903078761 1046156765 /nfs/dbraw/zinc/15/67/65/1046156765.db2.gz XSQRXPXVEPPKEV-FQEVSTJZSA-N 0 1 306.409 4.447 20 0 DIADMN CCc1cccc2c(CN3CCO[C@H](c4ccccc4)C3)c[nH]c21 ZINC001138362346 1046156703 /nfs/dbraw/zinc/15/67/03/1046156703.db2.gz YCQOKFSHWBXKIH-FQEVSTJZSA-N 0 1 320.436 4.304 20 0 DIADMN Cn1cc(Cl)c(CN[C@H]2CC[C@@H](c3ccc(Cl)cc3)C2)n1 ZINC001202821245 1046156902 /nfs/dbraw/zinc/15/69/02/1046156902.db2.gz ATBPLLSCSRQAGT-OCCSQVGLSA-N 0 1 324.255 4.153 20 0 DIADMN Cn1cc(Cl)c(CN[C@H]2CC[C@H](c3ccc(Cl)cc3)C2)n1 ZINC001202821243 1046157114 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317.473 4.008 20 0 DIADMN CCCCC[C@](C)(CC)C(=O)Nc1cccc(-c2nnc[nH]2)c1 ZINC000780695659 1046398782 /nfs/dbraw/zinc/39/87/82/1046398782.db2.gz SXSGFXGYUIWINH-SFHVURJKSA-N 0 1 314.433 4.407 20 0 DIADMN C[C@@H]1CCN(Cc2nnc(-c3cccc4ccccc43)o2)C[C@H]1C ZINC001168201225 1046398961 /nfs/dbraw/zinc/39/89/61/1046398961.db2.gz JYKCTARNFKYRQH-HUUCEWRRSA-N 0 1 321.424 4.368 20 0 DIADMN C[C@H](c1ccc(Cl)cc1Cl)N(C)Cc1cc[nH]c(=O)c1 ZINC000639441345 1046401855 /nfs/dbraw/zinc/40/18/55/1046401855.db2.gz LJKXWNFCYXIOGL-SNVBAGLBSA-N 0 1 311.212 4.287 20 0 DIADMN CCCCc1nc(Cl)c(C[N@H+]2CC[C@@H](c3ccccc3)C2)[nH]1 ZINC001139175645 1046402364 /nfs/dbraw/zinc/40/23/64/1046402364.db2.gz CKTRMMWOZXXCDM-OAHLLOKOSA-N 0 1 317.864 4.395 20 0 DIADMN CCCCc1nc(Cl)c(CN2CC[C@@H](c3ccccc3)C2)[nH]1 ZINC001139175645 1046402381 /nfs/dbraw/zinc/40/23/81/1046402381.db2.gz CKTRMMWOZXXCDM-OAHLLOKOSA-N 0 1 317.864 4.395 20 0 DIADMN Cc1ccc(-c2ncc(CN[C@H](C)c3cn[nH]c3)s2)cc1C ZINC000655751756 1046402874 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C[C@@H]1COCCN1Cc1c2ccccc2[nH]c1-c1ccccc1 ZINC001139198070 1046407965 /nfs/dbraw/zinc/40/79/65/1046407965.db2.gz FMLBEQSQMNIEKG-OAHLLOKOSA-N 0 1 306.409 4.056 20 0 DIADMN CCCCC[C@@](C)(CC)C(=O)NCc1nc2ccc(F)cc2[nH]1 ZINC000780833367 1046408368 /nfs/dbraw/zinc/40/83/68/1046408368.db2.gz RZFCWNFHTZILJF-GOSISDBHSA-N 0 1 319.424 4.315 20 0 DIADMN Cc1ccc(-c2cc(C(=O)N3CCC4(CCCC4)C3)n[nH]2)cc1C ZINC000780825855 1046408732 /nfs/dbraw/zinc/40/87/32/1046408732.db2.gz WTPJFTZNDOHPJQ-UHFFFAOYSA-N 0 1 323.440 4.100 20 0 DIADMN CC1(C)CN(C[C@H](O)c2ccc(F)cc2F)[C@@H]1c1ccccc1 ZINC000748832068 1046410412 /nfs/dbraw/zinc/41/04/12/1046410412.db2.gz DOFNNZRKHFGQDQ-ZWKOTPCHSA-N 0 1 317.379 4.081 20 0 DIADMN Cc1nc(-c2ccccc2)oc1CN1CCC[C@H]1c1ccncc1 ZINC000639548583 1046411386 /nfs/dbraw/zinc/41/13/86/1046411386.db2.gz ILAXIUBQWZHPKV-SFHVURJKSA-N 0 1 319.408 4.382 20 0 DIADMN C[C@@H](NC1(C2CC2)CC1)c1nnc(-c2ccc3ccccc3c2)o1 ZINC000639578168 1046413631 /nfs/dbraw/zinc/41/36/31/1046413631.db2.gz OUBLNZFZRSYIPU-CYBMUJFWSA-N 0 1 319.408 4.483 20 0 DIADMN C[C@@H](c1ccc(Br)cc1)N(C)Cc1cccnc1 ZINC000171146403 1046414215 /nfs/dbraw/zinc/41/42/15/1046414215.db2.gz OYZMPSUPOOCOQC-LBPRGKRZSA-N 0 1 305.219 4.037 20 0 DIADMN CC(=O)CN[C@@H](C)c1sc(-c2ccc(Cl)cc2)nc1C ZINC000639579711 1046414677 /nfs/dbraw/zinc/41/46/77/1046414677.db2.gz GQGKSFMFSHPDAK-JTQLQIEISA-N 0 1 308.834 4.012 20 0 DIADMN CC[C@@H]1c2ccccc2CCN1Cc1ccc2nsnc2c1 ZINC001139216264 1046415079 /nfs/dbraw/zinc/41/50/79/1046415079.db2.gz WMZFWCHSUAMTGC-GOSISDBHSA-N 0 1 309.438 4.201 20 0 DIADMN CCCCC[C@](C)(CC)C(=O)N[C@@H](C)c1n[nH]c(C(C)C)n1 ZINC000780972539 1046415212 /nfs/dbraw/zinc/41/52/12/1046415212.db2.gz DVPZLFZVXBDUPL-GUYCJALGSA-N 0 1 308.470 4.102 20 0 DIADMN Fc1cccc([C@H]2CCCN2Cc2ccc3nsnc3c2)c1 ZINC001139213127 1046415293 /nfs/dbraw/zinc/41/52/93/1046415293.db2.gz PYOZXFBURGWVHO-QGZVFWFLSA-N 0 1 313.401 4.168 20 0 DIADMN CN(Cc1ccc2nonc2c1)Cc1ccc(Cl)c(Cl)c1 ZINC001139220948 1046417083 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ZINC001139282050 1046423738 /nfs/dbraw/zinc/42/37/38/1046423738.db2.gz VPEQCYXLDHTNEI-BETUJISGSA-N 0 1 303.837 4.208 20 0 DIADMN CC1=Nc2ccccc2C12CCN(Cc1nccn1C(C)C)CC2 ZINC000639714623 1046424235 /nfs/dbraw/zinc/42/42/35/1046424235.db2.gz FCTRQBBPYHHOCT-UHFFFAOYSA-N 0 1 322.456 4.104 20 0 DIADMN Clc1nc(-c2ccccc2)[nH]c1CN1CCCCC12CC2 ZINC001139285341 1046425357 /nfs/dbraw/zinc/42/53/57/1046425357.db2.gz UGIRLSKJWFOAGU-UHFFFAOYSA-N 0 1 301.821 4.249 20 0 DIADMN Brc1cscc1CN1CCC[C@@H]2CCC[C@H]21 ZINC001139349605 1046426704 /nfs/dbraw/zinc/42/67/04/1046426704.db2.gz AIJMKBRMDBBAJM-GXFFZTMASA-N 0 1 300.265 4.275 20 0 DIADMN CCCCCN(C)Cc1cc(C(=O)c2ccc(F)cc2)cn1C ZINC001139314364 1046428797 /nfs/dbraw/zinc/42/87/97/1046428797.db2.gz MNQYFUQAGKVMBX-UHFFFAOYSA-N 0 1 316.420 4.017 20 0 DIADMN Oc1ccc2cc(CN3CCO[C@@H](c4ccccc4)C3)ccc2c1 ZINC001139339176 1046430738 /nfs/dbraw/zinc/43/07/38/1046430738.db2.gz QQPSDNKJEIJEBX-OAQYLSRUSA-N 0 1 319.404 4.119 20 0 DIADMN C[C@H]1C[N@@H+](Cc2ccc(N3CCCCC3)nc2)Cc2ccccc21 ZINC001139341180 1046432815 /nfs/dbraw/zinc/43/28/15/1046432815.db2.gz AGVVVMYNCVZTEZ-KRWDZBQOSA-N 0 1 321.468 4.191 20 0 DIADMN C[C@H]1CN(Cc2ccc(N3CCCCC3)nc2)Cc2ccccc21 ZINC001139341180 1046432820 /nfs/dbraw/zinc/43/28/20/1046432820.db2.gz AGVVVMYNCVZTEZ-KRWDZBQOSA-N 0 1 321.468 4.191 20 0 DIADMN CCc1nc(C(C)C)ccc1CN[C@@H](C)c1cnc(C)s1 ZINC000639996970 1046443175 /nfs/dbraw/zinc/44/31/75/1046443175.db2.gz SWQDCKFLPJLQSU-LBPRGKRZSA-N 0 1 303.475 4.383 20 0 DIADMN COc1ncc(CNC2(c3ccc(F)cc3)CCC2)cc1Cl ZINC000676892924 1046444486 /nfs/dbraw/zinc/44/44/86/1046444486.db2.gz SOHJCKJBMDXRRR-UHFFFAOYSA-N 0 1 320.795 4.052 20 0 DIADMN F[C@@H]1CSC2(CN(Cc3ccc(-c4ccccc4)s3)C2)C1 ZINC001139414204 1046445464 /nfs/dbraw/zinc/44/54/64/1046445464.db2.gz KWQGSJXCNSEQFR-AWEZNQCLSA-N 0 1 319.470 4.445 20 0 DIADMN CCN(Cc1nc2ccccn2c1C)Cc1ccc(C)c(C)c1 ZINC001137276129 1046450912 /nfs/dbraw/zinc/45/09/12/1046450912.db2.gz YPPKMBKUDZGEMY-UHFFFAOYSA-N 0 1 307.441 4.282 20 0 DIADMN Cc1ccc(-c2nc(CN3CCC[C@@H](C4CC4)C3)cs2)o1 ZINC000677029650 1046454809 /nfs/dbraw/zinc/45/48/09/1046454809.db2.gz RECVRWVHVPDSOD-CQSZACIVSA-N 0 1 302.443 4.334 20 0 DIADMN C[C@H]1CN(Cc2ccc(-c3ccsc3)nc2)CCC1(F)F ZINC001139500956 1046457773 /nfs/dbraw/zinc/45/77/73/1046457773.db2.gz HBGDTWJBNDJJRF-LBPRGKRZSA-N 0 1 308.397 4.287 20 0 DIADMN C[C@@H]1CN(Cc2ccc(-c3ccsc3)nc2)CCC1(F)F ZINC001139500955 1046457884 /nfs/dbraw/zinc/45/78/84/1046457884.db2.gz HBGDTWJBNDJJRF-GFCCVEGCSA-N 0 1 308.397 4.287 20 0 DIADMN FC(F)(F)[C@@H]1CCN(Cc2ccc(-c3ccccc3)nc2)C1 ZINC001139517987 1046459723 /nfs/dbraw/zinc/45/97/23/1046459723.db2.gz IZCOFAGBGYBIPY-OAHLLOKOSA-N 0 1 306.331 4.133 20 0 DIADMN Oc1ccc2c(c1)CCN(Cc1ccc(-c3ccccc3)nc1)C2 ZINC001139516272 1046459906 /nfs/dbraw/zinc/45/99/06/1046459906.db2.gz BJZDQGVRLDVQTC-UHFFFAOYSA-N 0 1 316.404 4.013 20 0 DIADMN CC[C@@H](N[C@@H](C)c1cc(F)ccc1F)c1c(C)nn(C)c1C ZINC000125087239 1046463858 /nfs/dbraw/zinc/46/38/58/1046463858.db2.gz 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323.396 4.037 20 0 DIADMN C[C@@]1(F)CCCN(Cc2ccnc(-c3ccc(F)cc3)c2)C1 ZINC001141116877 1047018733 /nfs/dbraw/zinc/01/87/33/1047018733.db2.gz PQUGZKFNULRCMQ-GOSISDBHSA-N 0 1 302.368 4.212 20 0 DIADMN CC(C)[C@H]1CCc2ccccc2[C@@H]1NCc1ncc(Cl)n1C ZINC000799342904 1047020588 /nfs/dbraw/zinc/02/05/88/1047020588.db2.gz SGQYJKPBDXSVOP-RDTXWAMCSA-N 0 1 317.864 4.123 20 0 DIADMN Fc1cccc(Cl)c1CN1CCC[C@H](c2ccccn2)C1 ZINC000647950300 1047022472 /nfs/dbraw/zinc/02/24/72/1047022472.db2.gz SHINWRWZSLKGNN-ZDUSSCGKSA-N 0 1 304.796 4.254 20 0 DIADMN C[C@H](c1c(F)cccc1F)N1CCC[C@@H](c2ccccn2)C1 ZINC000647950386 1047023877 /nfs/dbraw/zinc/02/38/77/1047023877.db2.gz UQGPXAFDALPOPH-ZIAGYGMSSA-N 0 1 302.368 4.300 20 0 DIADMN COc1ccc(CN2CCC[C@H](c3ccccn3)C2)cc1Cl ZINC000647950651 1047024410 /nfs/dbraw/zinc/02/44/10/1047024410.db2.gz ZUGMIMBRQFFATM-HNNXBMFYSA-N 0 1 316.832 4.123 20 0 DIADMN Cc1sc(NC(=O)[C@@H](C(C)C)N(C)C)nc1C1CCCCC1 ZINC001141141550 1047024390 /nfs/dbraw/zinc/02/43/90/1047024390.db2.gz 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ZINC001141213382 1047048871 /nfs/dbraw/zinc/04/88/71/1047048871.db2.gz GOWBOLCTTKOFOI-INIZCTEOSA-N 0 1 321.449 4.195 20 0 DIADMN CCc1ccccc1CN(C)Cc1cncc(Br)c1 ZINC001141225026 1047053474 /nfs/dbraw/zinc/05/34/74/1047053474.db2.gz WKHNSJVBAQXRMX-UHFFFAOYSA-N 0 1 319.246 4.039 20 0 DIADMN COc1ccc(CN2CC[C@H](C)[C@@H]2c2cccc(F)c2)cc1O ZINC000536666679 1047057403 /nfs/dbraw/zinc/05/74/03/1047057403.db2.gz QBIMYHVVIACAIP-ORAYPTAESA-N 0 1 315.388 4.123 20 0 DIADMN COc1ccc(CN2CC[C@@H](C)[C@H]2c2cccc(F)c2)cc1O ZINC000536666680 1047057924 /nfs/dbraw/zinc/05/79/24/1047057924.db2.gz QBIMYHVVIACAIP-YJYMSZOUSA-N 0 1 315.388 4.123 20 0 DIADMN C[C@H]1CN(Cc2c[nH]nc2-c2ccccc2F)[C@@H]1c1ccccc1 ZINC000536666090 1047057986 /nfs/dbraw/zinc/05/79/86/1047057986.db2.gz DUJIIPCGNHLPFU-XOBRGWDASA-N 0 1 321.399 4.409 20 0 DIADMN COc1cccc(CN2CC[C@H](C)C[C@@H]2c2ccco2)c1OC ZINC000536664578 1047058996 /nfs/dbraw/zinc/05/89/96/1047058996.db2.gz QKSZVSYVSJZMLV-GOEBONIOSA-N 0 1 315.413 4.270 20 0 DIADMN 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20 0 DIADMN CN(C)c1cccc(CN2CCC[C@H]2c2c(F)cccc2F)c1 ZINC001141270073 1047071491 /nfs/dbraw/zinc/07/14/91/1047071491.db2.gz FXEKHIUUAWCFKX-SFHVURJKSA-N 0 1 316.395 4.368 20 0 DIADMN Cc1nc([C@@H](C)NC2CC(OCc3ccccc3)C2)c(C)s1 ZINC000680969180 1047073307 /nfs/dbraw/zinc/07/33/07/1047073307.db2.gz GQTLZJHQTNZIPH-AXOLYNHLSA-N 0 1 316.470 4.158 20 0 DIADMN C[C@H](c1nc(-c2ccccc2)no1)N1CC[C@H](C)C2(CCC2)C1 ZINC000536694482 1047073640 /nfs/dbraw/zinc/07/36/40/1047073640.db2.gz RGRIJCZMSXATOD-LSDHHAIUSA-N 0 1 311.429 4.310 20 0 DIADMN CC(C)c1ccccc1NC(=O)CN1CC[C@@H](C)C2(CCC2)C1 ZINC000536698149 1047074490 /nfs/dbraw/zinc/07/44/90/1047074490.db2.gz GKZLVSKXWUOEFU-MRXNPFEDSA-N 0 1 314.473 4.261 20 0 DIADMN CCN(Cc1ccc(C)cc1)Cc1cc(OC)c(OC)cc1F ZINC001141285498 1047076239 /nfs/dbraw/zinc/07/62/39/1047076239.db2.gz QZPVMOUUGPVVNB-UHFFFAOYSA-N 0 1 317.404 4.173 20 0 DIADMN CC[C@@H](CN1CCO[C@@H](c2ccsc2)C1)c1ccccc1 ZINC000536695705 1047076539 /nfs/dbraw/zinc/07/65/39/1047076539.db2.gz 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CC(C)[C@@H]1c2ccccc2CCN1Cc1cn(C)nc1C(F)F ZINC000681165651 1047104582 /nfs/dbraw/zinc/10/45/82/1047104582.db2.gz KRWHWMPNZFDZQY-QGZVFWFLSA-N 0 1 319.399 4.113 20 0 DIADMN O=C([O-])c1cccc(-c2ccc(C[N@@H+](CC3CC3)C3CC3)cc2)c1 ZINC001141360849 1047105470 /nfs/dbraw/zinc/10/54/70/1047105470.db2.gz OFXLRKAJYUEILP-UHFFFAOYSA-N 0 1 321.420 4.426 20 0 DIADMN CCCCCn1cc(CN[C@@H](C)c2ccccc2OC)c(C)n1 ZINC000536836264 1047106271 /nfs/dbraw/zinc/10/62/71/1047106271.db2.gz WVBVVHCLKRYESW-INIZCTEOSA-N 0 1 315.461 4.241 20 0 DIADMN C[C@@H](N[C@H]1CCCc2c[nH]nc21)c1cc2c(s1)CCCC2 ZINC000536844222 1047109827 /nfs/dbraw/zinc/10/98/27/1047109827.db2.gz HZPYHZUJSRRRPH-RISCZKNCSA-N 0 1 301.459 4.078 20 0 DIADMN Cc1cc(C)c([C@@H](C)N[C@@H](CO)c2cccc(F)c2)cc1C ZINC000536873031 1047116412 /nfs/dbraw/zinc/11/64/12/1047116412.db2.gz ZIYOZUFOLMFLEE-BEFAXECRSA-N 0 1 301.405 4.135 20 0 DIADMN Cc1cc(CNc2cccc(COc3ccccc3)c2C)n[nH]1 ZINC001116183862 1047117447 /nfs/dbraw/zinc/11/74/47/1047117447.db2.gz 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1047234379 /nfs/dbraw/zinc/23/43/79/1047234379.db2.gz PIUOAFHWYNOBDI-UHFFFAOYSA-N 0 1 312.310 4.148 20 0 DIADMN CCN(Cc1cccc(F)c1)Cc1cc(F)c(OC)c(OC)c1 ZINC001137509307 1047234757 /nfs/dbraw/zinc/23/47/57/1047234757.db2.gz HBJNVILDBUDILS-UHFFFAOYSA-N 0 1 321.367 4.004 20 0 DIADMN Cc1cnccc1CC[N@H+]1CCC[C@H]1c1ccc(F)c(F)c1 ZINC000827920150 1047236914 /nfs/dbraw/zinc/23/69/14/1047236914.db2.gz UWXJITDCYRVRKB-SFHVURJKSA-N 0 1 302.368 4.048 20 0 DIADMN C[C@H](NCc1ccc(-c2c(F)cccc2F)o1)c1ccc[nH]1 ZINC000760444025 1047237158 /nfs/dbraw/zinc/23/71/58/1047237158.db2.gz CCTALKXRRQRTIM-NSHDSACASA-N 0 1 302.324 4.404 20 0 DIADMN Cc1nn(-c2ccc(Cl)cc2)c(Cl)c1CN1CCCC1 ZINC000839452241 1047237751 /nfs/dbraw/zinc/23/77/51/1047237751.db2.gz RLQJZZLLENAFNM-UHFFFAOYSA-N 0 1 310.228 4.083 20 0 DIADMN COc1cccc2c1OCC[C@@H]2NCc1ccc(C2CC2)cc1 ZINC000682913091 1047238642 /nfs/dbraw/zinc/23/86/42/1047238642.db2.gz QJOYYRBVTNPVGS-SFHVURJKSA-N 0 1 309.409 4.186 20 0 DIADMN Cc1nnc(SCc2ccc([C@@H](C)C(F)(F)F)cc2)[nH]1 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C[C@H](NCC[C@@H](O)c1ccccc1)c1c(F)cccc1Cl ZINC000839542403 1047246050 /nfs/dbraw/zinc/24/60/50/1047246050.db2.gz LFPNWWFYSOAIIZ-BLLLJJGKSA-N 0 1 307.796 4.253 20 0 DIADMN Cc1ccc([C@H]2CCCN2Cc2ccc3cc(F)ccc3n2)cn1 ZINC001141651018 1047248144 /nfs/dbraw/zinc/24/81/44/1047248144.db2.gz SAKLLKSQBKNPNI-HXUWFJFHSA-N 0 1 321.399 4.414 20 0 DIADMN CCCCCOCC(=O)Nc1ccc2nc(C(C)(C)C)[nH]c2c1 ZINC000476173733 1047252307 /nfs/dbraw/zinc/25/23/07/1047252307.db2.gz SBZSCJICQQKYMB-UHFFFAOYSA-N 0 1 317.433 4.006 20 0 DIADMN Cc1cc(-c2noc([C@H](C)N[C@@H](C)CC3CCC3)n2)ccc1F ZINC000682999191 1047252802 /nfs/dbraw/zinc/25/28/02/1047252802.db2.gz LWGLXONKFACNKA-STQMWFEESA-N 0 1 317.408 4.413 20 0 DIADMN C[C@@H](N[C@@H](C)Cc1cccs1)c1nc(C2CCCCC2)no1 ZINC000682999843 1047252813 /nfs/dbraw/zinc/25/28/13/1047252813.db2.gz RUESZPJZDREOBK-QWHCGFSZSA-N 0 1 319.474 4.461 20 0 DIADMN O=C(Nc1ccc(F)c(F)c1O)c1ccc(F)c2ccccc12 ZINC001625991762 1047254902 /nfs/dbraw/zinc/25/49/02/1047254902.db2.gz HIXKDBGEWPIGPH-UHFFFAOYSA-N 0 1 317.266 4.215 20 0 DIADMN Cn1cc([C@@H](NCc2cccc(C3CC3)c2)c2ccccc2)cn1 ZINC001118055049 1047255370 /nfs/dbraw/zinc/25/53/70/1047255370.db2.gz CWBBIIJSVXBTCQ-NRFANRHFSA-N 0 1 317.436 4.177 20 0 DIADMN COc1ccc(Cl)c(CN2CCC(c3cccnc3)CC2)c1 ZINC000683020078 1047256436 /nfs/dbraw/zinc/25/64/36/1047256436.db2.gz WPSPCRLYNVTIEC-UHFFFAOYSA-N 0 1 316.832 4.123 20 0 DIADMN COc1cc([C@@H](C)NCc2cc(C)ccn2)ccc1OC(C)C ZINC000683021461 1047256900 /nfs/dbraw/zinc/25/69/00/1047256900.db2.gz ZLGCTGXDZOTSTO-OAHLLOKOSA-N 0 1 314.429 4.037 20 0 DIADMN Cc1cc(-n2ccnc2)ccc1CN1CC[C@H]1c1cccc(F)c1 ZINC000683012530 1047257021 /nfs/dbraw/zinc/25/70/21/1047257021.db2.gz VVZWXLZUHQJGNN-FQEVSTJZSA-N 0 1 321.399 4.267 20 0 DIADMN O=C(NCc1csc2ccccc12)c1ccc(Cl)c(O)c1 ZINC001141699067 1047269386 /nfs/dbraw/zinc/26/93/86/1047269386.db2.gz FMQKMMKOHNISNO-UHFFFAOYSA-N 0 1 317.797 4.190 20 0 DIADMN CCN(Cc1cccc(F)c1)Cc1ccccc1OC(F)F ZINC000476285912 1047276527 /nfs/dbraw/zinc/27/65/27/1047276527.db2.gz FUWDPMPSRDOWJW-UHFFFAOYSA-N 0 1 309.331 4.449 20 0 DIADMN N#Cc1csc(CN[C@H](c2cccs2)C2CCCC2)n1 ZINC000386128086 1047277059 /nfs/dbraw/zinc/27/70/59/1047277059.db2.gz NPTXHGMYJRLFKO-HNNXBMFYSA-N 0 1 303.456 4.097 20 0 DIADMN CN[C@H](CC(C)(C)C)c1nc(C2(c3ccccc3)CCC2)no1 ZINC000386650863 1047278894 /nfs/dbraw/zinc/27/88/94/1047278894.db2.gz KGFVJWJQCZGKJK-OAHLLOKOSA-N 0 1 313.445 4.236 20 0 DIADMN CC[C@H](C(=O)[O-])[N@@H+](C)Cc1ccc(-c2ccc(Cl)cc2)cc1 ZINC000650805711 1047283125 /nfs/dbraw/zinc/28/31/25/1047283125.db2.gz IGGTZXUPKQUKEP-QGZVFWFLSA-N 0 1 317.816 4.302 20 0 DIADMN FC1(F)CC2(CN(Cc3ccc4c(c3)Cc3ccccc3-4)C2)C1 ZINC001141734894 1047283259 /nfs/dbraw/zinc/28/32/59/1047283259.db2.gz NDFOIODVDRHSSZ-UHFFFAOYSA-N 0 1 311.375 4.489 20 0 DIADMN c1ccc2c(c1)Cc1cc(CN3CCc4ccncc4C3)ccc1-2 ZINC001141738856 1047283476 /nfs/dbraw/zinc/28/34/76/1047283476.db2.gz CXPLLLDPDGJALX-UHFFFAOYSA-N 0 1 312.416 4.211 20 0 DIADMN c1ccc2c(c1)Cc1cc(CN3CCc4ncccc4C3)ccc1-2 ZINC001141739788 1047283911 /nfs/dbraw/zinc/28/39/11/1047283911.db2.gz NUVCVRIDCKMTEP-UHFFFAOYSA-N 0 1 312.416 4.211 20 0 DIADMN C[C@@H](CC[N@H+]1CCC[C@@H](C(C)(C)C(=O)[O-])C1)c1ccccc1 ZINC000387952092 1047285607 /nfs/dbraw/zinc/28/56/07/1047285607.db2.gz YOSVBVCFASVVMD-DOTOQJQBSA-N 0 1 303.446 4.003 20 0 DIADMN C[C@@H](NCCOCc1ccccc1)c1nc2ccccc2s1 ZINC000390058361 1047293378 /nfs/dbraw/zinc/29/33/78/1047293378.db2.gz QGMIJISVBKPFFW-CQSZACIVSA-N 0 1 312.438 4.164 20 0 DIADMN Clc1ccc2c(ccn2CCNCc2cccnc2Cl)c1 ZINC000796450587 1047293853 /nfs/dbraw/zinc/29/38/53/1047293853.db2.gz PBIWZMFQCHBQFF-UHFFFAOYSA-N 0 1 320.223 4.133 20 0 DIADMN COc1cccc2cc(CN[C@H](C)c3ccc(C#N)cc3)oc21 ZINC000390344232 1047296524 /nfs/dbraw/zinc/29/65/24/1047296524.db2.gz WHQVZTWENNLTTO-CYBMUJFWSA-N 0 1 306.365 4.164 20 0 DIADMN COc1cccc2cc(CN[C@@H](C)c3ccc(C#N)cc3)oc21 ZINC000390344237 1047297402 /nfs/dbraw/zinc/29/74/02/1047297402.db2.gz WHQVZTWENNLTTO-ZDUSSCGKSA-N 0 1 306.365 4.164 20 0 DIADMN O=C(c1ccccc1)[C@@H]1CCN(Cc2coc3ccc(F)cc23)C1 ZINC001141857049 1047300838 /nfs/dbraw/zinc/30/08/38/1047300838.db2.gz ZZYTZTKMMHOUEI-OAHLLOKOSA-N 0 1 323.367 4.277 20 0 DIADMN CCc1ccc(N(CC2CC2)C(=O)c2cc3cccnc3[nH]2)cc1 ZINC000840473132 1047303276 /nfs/dbraw/zinc/30/32/76/1047303276.db2.gz STPVGKQZZPPOFW-UHFFFAOYSA-N 0 1 319.408 4.182 20 0 DIADMN CC(C)(C)c1coc(CN[C@@H]2CCC[C@@H](c3cccnc3)C2)n1 ZINC000897944735 1047304051 /nfs/dbraw/zinc/30/40/51/1047304051.db2.gz RWLXJVXCIZKHMV-GDBMZVCRSA-N 0 1 313.445 4.183 20 0 DIADMN CCSc1ccccc1C(=O)Nc1ccc(F)c(F)c1O ZINC001141877454 1047304396 /nfs/dbraw/zinc/30/43/96/1047304396.db2.gz RVNHKASTYBUBJI-UHFFFAOYSA-N 0 1 309.337 4.035 20 0 DIADMN CC[C@H](N[C@H](Cn1cccn1)c1ccccc1)c1ccsc1 ZINC000651236264 1047304627 /nfs/dbraw/zinc/30/46/27/1047304627.db2.gz VJGBHHHPTNTADI-ZWKOTPCHSA-N 0 1 311.454 4.427 20 0 DIADMN c1sc(COc2ccccc2)nc1CN[C@@H]1C[C@H]2CCC[C@H]21 ZINC000897952456 1047305826 /nfs/dbraw/zinc/30/58/26/1047305826.db2.gz GKHHPRFXCWNOHY-KBRIMQKVSA-N 0 1 314.454 4.000 20 0 DIADMN Cc1cccnc1[C@@H](NCc1cccc2c1OCC2)C(C)(C)C ZINC000897993828 1047308181 /nfs/dbraw/zinc/30/81/81/1047308181.db2.gz JZMJALBUMSBMGT-LJQANCHMSA-N 0 1 310.441 4.202 20 0 DIADMN CC(C)Oc1ccc(Br)cc1CN1CCC[C@H]2C[C@H]21 ZINC001138990148 1047309023 /nfs/dbraw/zinc/30/90/23/1047309023.db2.gz UCBHIGMCGYRPFI-SWLSCSKDSA-N 0 1 324.262 4.221 20 0 DIADMN COc1cc(F)cc(CN[C@H](c2ncccc2C)C(C)(C)C)c1 ZINC000897995906 1047309673 /nfs/dbraw/zinc/30/96/73/1047309673.db2.gz UDGFHIAYJTXNEY-GOSISDBHSA-N 0 1 316.420 4.415 20 0 DIADMN CC[C@H](C)[C@@H](CN[C@H](c1ccco1)c1ccc(OC)cc1)OC ZINC000651387943 1047312489 /nfs/dbraw/zinc/31/24/89/1047312489.db2.gz SEMZABPVVAPQPE-KYNGSXCRSA-N 0 1 317.429 4.028 20 0 DIADMN C[C@@H]1C[C@H](C)C[N@H+](Cc2c3ccccc3sc2C(=O)[O-])C1 ZINC000036928937 1047315781 /nfs/dbraw/zinc/31/57/81/1047315781.db2.gz POUUJTHDPKWRHL-TXEJJXNPSA-N 0 1 303.427 4.077 20 0 DIADMN CC(C)CCc1ccccc1NC(=O)C[N@@H+](C)CC(C)(C)C ZINC001142531570 1047317094 /nfs/dbraw/zinc/31/70/94/1047317094.db2.gz CBDCUGOUUUHHKZ-UHFFFAOYSA-N 0 1 304.478 4.192 20 0 DIADMN CC(C)CCc1ccccc1NC(=O)CN(C)CC(C)(C)C ZINC001142531570 1047317112 /nfs/dbraw/zinc/31/71/12/1047317112.db2.gz CBDCUGOUUUHHKZ-UHFFFAOYSA-N 0 1 304.478 4.192 20 0 DIADMN COc1ccccc1CN(Cc1cc2cnccc2o1)C1CC1 ZINC000651612937 1047320191 /nfs/dbraw/zinc/32/01/91/1047320191.db2.gz IJTSPFAOJDVVHY-UHFFFAOYSA-N 0 1 308.381 4.001 20 0 DIADMN Cc1cc(Br)c(CNC2(C)CC(F)(F)C2)s1 ZINC001119090580 1047323501 /nfs/dbraw/zinc/32/35/01/1047323501.db2.gz GZWLKVVFSHGAJS-UHFFFAOYSA-N 0 1 310.207 4.096 20 0 DIADMN Cc1nn(-c2cccc(C)c2)cc1CN[C@@H](C)c1cccc(O)c1 ZINC000651705823 1047323899 /nfs/dbraw/zinc/32/38/99/1047323899.db2.gz HKUODLBVHXUINS-HNNXBMFYSA-N 0 1 321.424 4.046 20 0 DIADMN Cc1ccsc1-c1noc([C@@H]2CC[C@H]3CCCC[C@H]3N2)n1 ZINC000395526136 1047324520 /nfs/dbraw/zinc/32/45/20/1047324520.db2.gz QAOIRSHZBIMXGO-UPJWGTAASA-N 0 1 303.431 4.090 20 0 DIADMN CSc1ccc(CN[C@@H](C)c2cnn(CC3CCC3)c2)s1 ZINC000898182654 1047324846 /nfs/dbraw/zinc/32/48/46/1047324846.db2.gz UXDSITZCWCYSDC-LBPRGKRZSA-N 0 1 321.515 4.317 20 0 DIADMN COc1cccc2c1CC[C@H]2NCc1cc(C2CC2)ccc1OC ZINC001119290079 1047325255 /nfs/dbraw/zinc/32/52/55/1047325255.db2.gz ZRZQLWGFQIEXRQ-LJQANCHMSA-N 0 1 323.436 4.358 20 0 DIADMN COc1ccc([C@H](C)NCc2cc(C)cc(Cl)n2)c(C)c1 ZINC000840748276 1047325285 /nfs/dbraw/zinc/32/52/85/1047325285.db2.gz GJZBYPYDCSDGEN-ZDUSSCGKSA-N 0 1 304.821 4.211 20 0 DIADMN C[C@H](NC(=O)C(F)(F)F)c1ccc(Oc2ccccc2)cc1 ZINC000725901147 1047329044 /nfs/dbraw/zinc/32/90/44/1047329044.db2.gz FWGSCKPFUQILOC-NSHDSACASA-N 0 1 309.287 4.218 20 0 DIADMN COc1cc(OC)c(CNC(C)(C)c2ccccc2C)cc1F ZINC000651817434 1047329209 /nfs/dbraw/zinc/32/92/09/1047329209.db2.gz LBBXHZQXJYKIQT-UHFFFAOYSA-N 0 1 317.404 4.176 20 0 DIADMN Cc1onc(-c2ccccc2)c1CN(C)Cc1ccc(F)cc1 ZINC001141979031 1047329099 /nfs/dbraw/zinc/32/90/99/1047329099.db2.gz NJVMVEOYTQJSND-UHFFFAOYSA-N 0 1 310.372 4.421 20 0 DIADMN C[C@@H](NC(=O)C(F)(F)F)c1ccccc1Oc1ccccc1 ZINC000725902249 1047329949 /nfs/dbraw/zinc/32/99/49/1047329949.db2.gz BPHQJZLMOGCOQY-LLVKDONJSA-N 0 1 309.287 4.218 20 0 DIADMN FC(F)(F)C1CCC(N2CCC[C@H]2c2nccs2)CC1 ZINC001255521039 1047331282 /nfs/dbraw/zinc/33/12/82/1047331282.db2.gz RJKMVYRJZXCAAJ-MCIGGMRASA-N 0 1 304.381 4.401 20 0 DIADMN Cn1c2ccc(C(F)(F)F)cc2nc1CN1CCC12CCCC2 ZINC000651873712 1047332231 /nfs/dbraw/zinc/33/22/31/1047332231.db2.gz SMVLMMSQPNDPMV-UHFFFAOYSA-N 0 1 323.362 4.111 20 0 DIADMN CC(C)(C)c1ncc(CN2CCC3(CC3(F)F)CC2)s1 ZINC000651953425 1047334574 /nfs/dbraw/zinc/33/45/74/1047334574.db2.gz HIUDHZNYTHMMCL-UHFFFAOYSA-N 0 1 300.418 4.062 20 0 DIADMN CO[C@H]1CCCN(Cc2sccc2Oc2ccccc2)C1 ZINC001141994457 1047335867 /nfs/dbraw/zinc/33/58/67/1047335867.db2.gz MIESBAMNHUUGIK-HNNXBMFYSA-N 0 1 303.427 4.151 20 0 DIADMN Fc1cc(OC(F)F)ccc1CN[C@@H](c1ccncc1)C1CC1 ZINC000898318941 1047340085 /nfs/dbraw/zinc/34/00/85/1047340085.db2.gz WDOZJGKMMHHCAE-MRXNPFEDSA-N 0 1 322.330 4.063 20 0 DIADMN Clc1nccc2oc(CN[C@H](c3ccncc3)C3CC3)cc21 ZINC000898317849 1047340220 /nfs/dbraw/zinc/34/02/20/1047340220.db2.gz MICZUTUFYYFZDY-INIZCTEOSA-N 0 1 313.788 4.117 20 0 DIADMN CN(Cc1sccc1Oc1ccccc1)[C@@H]1CCCOC1 ZINC001142003407 1047341439 /nfs/dbraw/zinc/34/14/39/1047341439.db2.gz QMJBBEQKUZJFHP-CQSZACIVSA-N 0 1 303.427 4.151 20 0 DIADMN CSc1cc(C)ccc1NC(=S)NCCc1cccs1 ZINC000840857851 1047345470 /nfs/dbraw/zinc/34/54/70/1047345470.db2.gz VTDXAUJQNKBROP-UHFFFAOYSA-N 0 1 322.524 4.308 20 0 DIADMN OCC[C@H](N[C@@H](c1cccnc1)C1CCCCC1)c1ccco1 ZINC000652190277 1047347012 /nfs/dbraw/zinc/34/70/12/1047347012.db2.gz ICPUTWVCNMWZDJ-PKOBYXMFSA-N 0 1 314.429 4.009 20 0 DIADMN CSc1ccc([C@H](C)N[C@H](c2ccccc2F)[C@@H](C)O)cc1 ZINC000652230760 1047348217 /nfs/dbraw/zinc/34/82/17/1047348217.db2.gz YKVWMIVFSSRXLV-JCGVRSQUSA-N 0 1 319.445 4.320 20 0 DIADMN Cn1ncc2c1CCC[C@@H]2NC1(c2ccccc2Cl)CCC1 ZINC000652215071 1047348472 /nfs/dbraw/zinc/34/84/72/1047348472.db2.gz BOLPKDCASIMENY-INIZCTEOSA-N 0 1 315.848 4.120 20 0 DIADMN 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/nfs/dbraw/zinc/74/16/96/1047741696.db2.gz XEHLOXRZQADJFU-LJQANCHMSA-N 0 1 309.388 4.251 20 0 DIADMN Cc1ccc2nc(CN[C@@H](c3ccc(F)cc3)C3CC3)[nH]c2c1 ZINC000539214843 1047741699 /nfs/dbraw/zinc/74/16/99/1047741699.db2.gz XEHLOXRZQADJFU-LJQANCHMSA-N 0 1 309.388 4.251 20 0 DIADMN CCC(C)(C)c1ccccc1C(=O)Nc1ccc2cncn2c1 ZINC001157396584 1047742062 /nfs/dbraw/zinc/74/20/62/1047742062.db2.gz QCBUWKQJROEOFM-UHFFFAOYSA-N 0 1 307.397 4.274 20 0 DIADMN C[C@@H]1CC[C@@](C)(/C=C/C(=O)Nc2ccc3cncn3c2)C1(C)C ZINC001157396985 1047742309 /nfs/dbraw/zinc/74/23/09/1047742309.db2.gz UALYCFPNZSNZNI-XGKLZFSYSA-N 0 1 311.429 4.291 20 0 DIADMN CCC[C@H](O)CCN[C@H](C)c1csc(-c2ccccc2)n1 ZINC000927026264 1047747071 /nfs/dbraw/zinc/74/70/71/1047747071.db2.gz ZWWAVACMBKTKAQ-HIFRSBDPSA-N 0 1 304.459 4.012 20 0 DIADMN CCC[C@@H](C(=O)c1ccccc1)N(C)c1cc2[nH]ccc2c(C)n1 ZINC001157759787 1047753269 /nfs/dbraw/zinc/75/32/69/1047753269.db2.gz NXNNTMBMECVFIO-SFHVURJKSA-N 0 1 321.424 4.359 20 0 DIADMN CC(C)(c1ccnc(Cl)c1)N1CCC2(CCOC2(C)C)CC1 ZINC001157806473 1047755541 /nfs/dbraw/zinc/75/55/41/1047755541.db2.gz ZEKPSZHMCTWYPS-UHFFFAOYSA-N 0 1 322.880 4.251 20 0 DIADMN CC[C@@H](N[C@H]1CCSc2ccccc21)c1ccc(F)cn1 ZINC000161851805 1047770874 /nfs/dbraw/zinc/77/08/74/1047770874.db2.gz BNAYOTUTKNGHHJ-CABCVRRESA-N 0 1 302.418 4.499 20 0 DIADMN COc1cccc([C@@H]2CSCCN2c2ccc(C)c(C)n2)c1 ZINC001158252861 1047771740 /nfs/dbraw/zinc/77/17/40/1047771740.db2.gz SADGONQAUWSJKH-KRWDZBQOSA-N 0 1 314.454 4.002 20 0 DIADMN COc1cccc([C@H]2CSCCN2c2cc(C)c(C)cn2)c1 ZINC001158258020 1047771888 /nfs/dbraw/zinc/77/18/88/1047771888.db2.gz OFOHXVGXCXLKJF-QGZVFWFLSA-N 0 1 314.454 4.002 20 0 DIADMN Cc1ccc(-c2cc(C(=O)N(C)[C@@H]3CCC(C)(C)C3)n[nH]2)cc1 ZINC000478229844 1047774749 /nfs/dbraw/zinc/77/47/49/1047774749.db2.gz GCHXUPVZWVAFCP-OAHLLOKOSA-N 0 1 311.429 4.036 20 0 DIADMN CC1(C)CCc2cc(Nc3ccnn3-c3ccncc3)ccc2O1 ZINC001213012839 1047776867 /nfs/dbraw/zinc/77/68/67/1047776867.db2.gz YBRCSZOKCAOJQP-UHFFFAOYSA-N 0 1 320.396 4.115 20 0 DIADMN CCC[C@@H]1CCCN1C(=O)c1cc(-c2ccc(Cl)cc2)[nH]n1 ZINC001158339985 1047776901 /nfs/dbraw/zinc/77/69/01/1047776901.db2.gz UXPWVIYRNKEXCR-CQSZACIVSA-N 0 1 317.820 4.135 20 0 DIADMN COc1ccc2oc(CNCc3ccc4ccccc4n3)cc2c1 ZINC000478377406 1047783243 /nfs/dbraw/zinc/78/32/43/1047783243.db2.gz ZECYZFYGGPXXLI-UHFFFAOYSA-N 0 1 318.376 4.279 20 0 DIADMN Cc1cnc(N[C@@H](CCO)c2cccc3ccccc32)c(C)c1 ZINC001158509382 1047787238 /nfs/dbraw/zinc/78/72/38/1047787238.db2.gz JDRIGOCYENGHRX-IBGZPJMESA-N 0 1 306.409 4.387 20 0 DIADMN CN(C)[C@H](CNC(=O)CCCCC(C)(C)C)c1cccs1 ZINC000552697421 1047788141 /nfs/dbraw/zinc/78/81/41/1047788141.db2.gz LNDBDAWQAWNJKQ-CQSZACIVSA-N 0 1 310.507 4.074 20 0 DIADMN COc1ccnc(CN(C)[C@H](C)c2ccc(C(F)(F)F)cc2)c1 ZINC000552760577 1047793058 /nfs/dbraw/zinc/79/30/58/1047793058.db2.gz LWHQDZWHCASJRR-GFCCVEGCSA-N 0 1 324.346 4.302 20 0 DIADMN CCn1ccnc1[C@H](C)N[C@@H](c1ccc(OC)cc1)C1CCC1 ZINC000927068720 1047794287 /nfs/dbraw/zinc/79/42/87/1047794287.db2.gz UXLRYENSQXKSFH-KBXCAEBGSA-N 0 1 313.445 4.104 20 0 DIADMN Cc1cnc(N2CCC3(CC2)O[C@H](C)c2ccccc23)cc1C ZINC001158754397 1047797667 /nfs/dbraw/zinc/79/76/67/1047797667.db2.gz OUMOGBKZRXACNN-MRXNPFEDSA-N 0 1 308.425 4.285 20 0 DIADMN Cc1ccc(-c2cc(C(=O)N(CC3CC3)C3CCC3)n[nH]2)c(C)c1 ZINC000478579493 1047798215 /nfs/dbraw/zinc/79/82/15/1047798215.db2.gz AFLUQWIARCJJJC-UHFFFAOYSA-N 0 1 323.440 4.098 20 0 DIADMN COc1cc(Cl)ccc1[C@H](C)N[C@@H](c1cnn(C)c1)C(C)C ZINC000927071507 1047799142 /nfs/dbraw/zinc/79/91/42/1047799142.db2.gz UDYMTLOIDKCOIP-YVEFUNNKSA-N 0 1 321.852 4.130 20 0 DIADMN Cc1cc2ccccc2c(N2CCc3cc(F)c(F)cc3C2)n1 ZINC001158809771 1047799215 /nfs/dbraw/zinc/79/92/15/1047799215.db2.gz WEBUIGIVJKGEDK-UHFFFAOYSA-N 0 1 310.347 4.384 20 0 DIADMN CCC[C@@H](CC1CCCCC1)C(=O)Nc1cccc2[nH]nnc21 ZINC001158809609 1047799446 /nfs/dbraw/zinc/79/94/46/1047799446.db2.gz OPVXWTKMMXHAME-AWEZNQCLSA-N 0 1 314.433 4.283 20 0 DIADMN Cc1cc(Cl)c(NC(=O)Cc2n[nH]c3ccccc32)cc1C ZINC001158995173 1047806408 /nfs/dbraw/zinc/80/64/08/1047806408.db2.gz UCCJRCAFXLLGMY-UHFFFAOYSA-N 0 1 313.788 4.014 20 0 DIADMN CCC(C)(C)c1ccccc1C(=O)Nc1n[nH]c2cc(O)ccc21 ZINC001159063173 1047810139 /nfs/dbraw/zinc/81/01/39/1047810139.db2.gz HDLYJGUQQIIMSQ-UHFFFAOYSA-N 0 1 323.396 4.208 20 0 DIADMN CC(C)CC[C@H](N[C@@H](C)c1cnnn1C)c1ccc(Cl)cc1 ZINC000924711381 1047815463 /nfs/dbraw/zinc/81/54/63/1047815463.db2.gz SQHKQSCLWSGFPV-BBRMVZONSA-N 0 1 320.868 4.297 20 0 DIADMN CC(C)CC[C@@H](N[C@H](C)c1cnnn1C)c1ccc(Cl)cc1 ZINC000924711389 1047815909 /nfs/dbraw/zinc/81/59/09/1047815909.db2.gz SQHKQSCLWSGFPV-CZUORRHYSA-N 0 1 320.868 4.297 20 0 DIADMN CCCN1C(=O)N=NC1S[C@@H](C)c1cccc(Cl)c1F ZINC000478819813 1047818939 /nfs/dbraw/zinc/81/89/39/1047818939.db2.gz BZSUCLCJLWVAIP-QMMMGPOBSA-N 0 1 315.801 4.040 20 0 DIADMN Cc1ccc(-c2cc(C(=O)N3CC4(CCC4)[C@H]3C(C)C)n[nH]2)cc1 ZINC000553071395 1047820133 /nfs/dbraw/zinc/82/01/33/1047820133.db2.gz PKBMDBWMSSJKOR-GOSISDBHSA-N 0 1 323.440 4.036 20 0 DIADMN COc1cccc(CN[C@H](C)c2cc3ccccc3[nH]2)c1OC ZINC000924713740 1047827313 /nfs/dbraw/zinc/82/73/13/1047827313.db2.gz MBNASPWUGLPGRD-CYBMUJFWSA-N 0 1 310.397 4.036 20 0 DIADMN Fc1c(Cl)ccc(Nc2cc([C@H]3CCCCN3)no2)c1F ZINC001159311488 1047829664 /nfs/dbraw/zinc/82/96/64/1047829664.db2.gz KNGVYTRYDPCREC-SECBINFHSA-N 0 1 313.735 4.164 20 0 DIADMN CC(C)Oc1cccc(Nc2cc([C@H]3CCCCN3)no2)c1 ZINC001159309399 1047829887 /nfs/dbraw/zinc/82/98/87/1047829887.db2.gz UESZALHDWSMKHK-OAHLLOKOSA-N 0 1 301.390 4.020 20 0 DIADMN Clc1ccc(C=CNc2cc([C@H]3CCCCN3)no2)cc1 ZINC001159309029 1047829958 /nfs/dbraw/zinc/82/99/58/1047829958.db2.gz PWIIQQJYQQZNDZ-QSYFUGGGSA-N 0 1 303.793 4.225 20 0 DIADMN Clc1ccc(CC=Nc2cc([C@H]3CCCCN3)no2)cc1 ZINC001159309029 1047829964 /nfs/dbraw/zinc/82/99/64/1047829964.db2.gz PWIIQQJYQQZNDZ-QSYFUGGGSA-N 0 1 303.793 4.225 20 0 DIADMN CC(C)Oc1cccc(Nc2cc([C@@H]3CCCCN3)no2)c1 ZINC001159309397 1047830057 /nfs/dbraw/zinc/83/00/57/1047830057.db2.gz UESZALHDWSMKHK-HNNXBMFYSA-N 0 1 301.390 4.020 20 0 DIADMN c1c([C@@H]2CCCCN2)noc1Nc1cccc(-c2cccnc2)c1 ZINC001159312384 1047830096 /nfs/dbraw/zinc/83/00/96/1047830096.db2.gz AGFUFQMRGKHBBM-KRWDZBQOSA-N 0 1 320.396 4.295 20 0 DIADMN c1c([C@@H]2CCCCN2)noc1Nc1ccc(-c2cccnc2)cc1 ZINC001159312922 1047830989 /nfs/dbraw/zinc/83/09/89/1047830989.db2.gz GWJRIQMLFWOUCW-KRWDZBQOSA-N 0 1 320.396 4.295 20 0 DIADMN Cc1nc2cc(Nc3cc([C@@H]4CCCCN4)no3)ccc2s1 ZINC001159313348 1047831958 /nfs/dbraw/zinc/83/19/58/1047831958.db2.gz MLWUCILWLBBDEL-LBPRGKRZSA-N 0 1 314.414 4.151 20 0 DIADMN CC(C)(C)Oc1ccc(Nc2cc([C@H]3CCCCN3)no2)cc1 ZINC001159312698 1047832039 /nfs/dbraw/zinc/83/20/39/1047832039.db2.gz FYKMYGDLRYUPSJ-OAHLLOKOSA-N 0 1 315.417 4.410 20 0 DIADMN Cc1ccc2c(cccc2Nc2cc([C@H]3CCCCN3)no2)n1 ZINC001159313192 1047832097 /nfs/dbraw/zinc/83/20/97/1047832097.db2.gz JFVMUPQIRADGBJ-MRXNPFEDSA-N 0 1 308.385 4.089 20 0 DIADMN CSc1ccc(Nc2cc([C@H]3CCCCN3)no2)c(F)c1 ZINC001159312691 1047832383 /nfs/dbraw/zinc/83/23/83/1047832383.db2.gz FVRBYMGBMFFYMP-CYBMUJFWSA-N 0 1 307.394 4.094 20 0 DIADMN CC(C)Oc1cc(F)ccc1Nc1cc([C@@H]2CCCCN2)no1 ZINC001159314176 1047832973 /nfs/dbraw/zinc/83/29/73/1047832973.db2.gz ZVAVECLTWDOIDA-ZDUSSCGKSA-N 0 1 319.380 4.159 20 0 DIADMN CCCOc1cc(F)ccc1Nc1cc([C@H]2CCCCN2)no1 ZINC001159313873 1047833339 /nfs/dbraw/zinc/83/33/39/1047833339.db2.gz UELBSHZXGIZLLO-CYBMUJFWSA-N 0 1 319.380 4.161 20 0 DIADMN COc1ccc(CN[C@@H]2CCc3ccc(Cl)cc32)c(OC)c1 ZINC000479120153 1047840628 /nfs/dbraw/zinc/84/06/28/1047840628.db2.gz IVNNEIIFYDLGGQ-QGZVFWFLSA-N 0 1 317.816 4.134 20 0 DIADMN O=c1cc(-c2ccc(Cl)cc2)[nH]n1-c1ccccc1Cl ZINC000006773008 1047841971 /nfs/dbraw/zinc/84/19/71/1047841971.db2.gz BREXPGIMKHBWME-UHFFFAOYSA-N 0 1 305.164 4.134 20 0 DIADMN Cc1cc(Br)c(C[N@H+](C)[C@H](C)C2(C)CC2)s1 ZINC001204388825 1047842642 /nfs/dbraw/zinc/84/26/42/1047842642.db2.gz HJTXHGWGZAHFED-SNVBAGLBSA-N 0 1 302.281 4.439 20 0 DIADMN Cc1cc(Br)c(CN(C)[C@H](C)C2(C)CC2)s1 ZINC001204388825 1047842652 /nfs/dbraw/zinc/84/26/52/1047842652.db2.gz HJTXHGWGZAHFED-SNVBAGLBSA-N 0 1 302.281 4.439 20 0 DIADMN COc1ccc(CN2CC[C@@](C)(C(F)(F)F)C2)cc1Cl ZINC001197555113 1047845877 /nfs/dbraw/zinc/84/58/77/1047845877.db2.gz WFVHQDRETUZRMN-CYBMUJFWSA-N 0 1 307.743 4.123 20 0 DIADMN CC(C)c1ccc([C@@H](C)NC(=O)Cc2ccc3nc[nH]c3c2)cc1 ZINC001182846455 1047846498 /nfs/dbraw/zinc/84/64/98/1047846498.db2.gz FFOJHXQUYXUICS-CQSZACIVSA-N 0 1 321.424 4.106 20 0 DIADMN Cn1ncc(C(F)(F)F)c1CN1CCC(C)(C)CC(C)(C)C1 ZINC001182825005 1047850189 /nfs/dbraw/zinc/85/01/89/1047850189.db2.gz CNEQOBXSLDVIEI-UHFFFAOYSA-N 0 1 317.399 4.087 20 0 DIADMN Cc1ccc(-c2n[nH]c(SCc3ncc(Cl)s3)n2)cc1 ZINC000479232130 1047850717 /nfs/dbraw/zinc/85/07/17/1047850717.db2.gz NNVDMMZTCNNQSN-UHFFFAOYSA-N 0 1 322.846 4.182 20 0 DIADMN CC[C@@H](C(=O)Nc1nc2ccc(C)cc2[nH]1)c1ccc(OC)cc1 ZINC000553474549 1047859477 /nfs/dbraw/zinc/85/94/77/1047859477.db2.gz RLHNKNVUYVTKPP-OAHLLOKOSA-N 0 1 323.396 4.012 20 0 DIADMN COc1ncc(CN2CC[C@H](C)[C@@H]2c2ccccc2)cc1Cl ZINC001197661046 1047859851 /nfs/dbraw/zinc/85/98/51/1047859851.db2.gz SQMHAADCBPJWDD-SUMWQHHRSA-N 0 1 316.832 4.327 20 0 DIADMN COCc1csc(CN(Cc2ccc(F)cc2)C2CC2)c1 ZINC000667463391 1047863157 /nfs/dbraw/zinc/86/31/57/1047863157.db2.gz LWCNLYLFFGGHKY-UHFFFAOYSA-N 0 1 305.418 4.198 20 0 DIADMN CCOC(=O)c1coc2cc(Nc3ccc4c[nH]nc4c3)ccc12 ZINC001174500451 1047867857 /nfs/dbraw/zinc/86/78/57/1047867857.db2.gz JVTKBXLKURZUBH-UHFFFAOYSA-N 0 1 321.336 4.229 20 0 DIADMN c1[nH]nc2cc(Nc3ccccc3Oc3cccnc3)ccc12 ZINC001174500601 1047869280 /nfs/dbraw/zinc/86/92/80/1047869280.db2.gz UUUDRNLBFRXYLR-UHFFFAOYSA-N 0 1 302.337 4.494 20 0 DIADMN Fc1c(Nc2cccc3[nH]ncc32)cccc1OC(F)(F)F ZINC001159574625 1047869417 /nfs/dbraw/zinc/86/94/17/1047869417.db2.gz JISIFLZYEBCQJT-UHFFFAOYSA-N 0 1 311.238 4.344 20 0 DIADMN CC(C)Oc1ccc(F)c(F)c1Nc1cccc2[nH]ncc21 ZINC001159575052 1047869911 /nfs/dbraw/zinc/86/99/11/1047869911.db2.gz SGBFLYLNWNNZMQ-UHFFFAOYSA-N 0 1 303.312 4.372 20 0 DIADMN Nc1cc(F)c(C(F)(F)F)cc1Nc1ccc2c[nH]nc2c1 ZINC001174502322 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CC(C)c1nc2c(ncnc2N[C@@H](c2ccccc2)C2CC2)[nH]1 ZINC001161957557 1048199335 /nfs/dbraw/zinc/19/93/35/1048199335.db2.gz AOHPXFBAYZBCMZ-AWEZNQCLSA-N 0 1 307.401 4.040 20 0 DIADMN CC[NH+](CC)c1ccc(Nc2ccc(F)c(C(=O)[O-])c2)cc1 ZINC001175218423 1048200657 /nfs/dbraw/zinc/20/06/57/1048200657.db2.gz BVECTCWNOMOFDF-UHFFFAOYSA-N 0 1 302.349 4.114 20 0 DIADMN Cc1cc(Br)cc(CN(C)Cc2cccc(C)n2)c1 ZINC000774903188 1048202576 /nfs/dbraw/zinc/20/25/76/1048202576.db2.gz LRCJGYIBKAJNPS-UHFFFAOYSA-N 0 1 319.246 4.093 20 0 DIADMN C[C@@H](NC[C@H](C)C(F)(F)F)c1nc2ccc(Cl)cc2n1C ZINC000480669181 1048211494 /nfs/dbraw/zinc/21/14/94/1048211494.db2.gz UJOWYGQRRQNZCI-DTWKUNHWSA-N 0 1 319.758 4.076 20 0 DIADMN COc1cncc(/C=C\CCN2CC[C@@H]2c2cccc(F)c2)c1 ZINC000645812258 1048211684 /nfs/dbraw/zinc/21/16/84/1048211684.db2.gz WFHOQRXKYSHRDZ-QDVBSOPMSA-N 0 1 312.388 4.080 20 0 DIADMN CC(C)[C@@H](NCc1nccn1-c1ccccc1)c1ccccc1 ZINC000480671688 1048211804 /nfs/dbraw/zinc/21/18/04/1048211804.db2.gz NSYMJMSEEDOKCL-HXUWFJFHSA-N 0 1 305.425 4.359 20 0 DIADMN COC(=O)c1cccc(CNCc2cc(Cl)cc(Cl)c2)c1 ZINC000554874840 1048214444 /nfs/dbraw/zinc/21/44/44/1048214444.db2.gz MKQDGNVCQWDDOZ-UHFFFAOYSA-N 0 1 324.207 4.070 20 0 DIADMN CC[C@H](c1ccncc1)N(C)Cc1ccc(OC(F)F)c(F)c1 ZINC000554890449 1048218704 /nfs/dbraw/zinc/21/87/04/1048218704.db2.gz NSXXASQJLOJRCK-OAHLLOKOSA-N 0 1 324.346 4.405 20 0 DIADMN Brc1ccc2c(ccnc2N=C2CCSCC2)c1 ZINC001201327320 1048238598 /nfs/dbraw/zinc/23/85/98/1048238598.db2.gz SHQIYODPRNMSIZ-UHFFFAOYSA-N 0 1 321.243 4.430 20 0 DIADMN Brc1c2ccccc2cnc1NC1=CCSCC1 ZINC001201332965 1048243593 /nfs/dbraw/zinc/24/35/93/1048243593.db2.gz GHAOZWSVSMNZLX-UHFFFAOYSA-N 0 1 321.243 4.430 20 0 DIADMN CCN(c1ccc(NCc2cn3ccnc3s2)cc1)C(C)C ZINC001201337742 1048243771 /nfs/dbraw/zinc/24/37/71/1048243771.db2.gz DLSNEXQHPWHIEV-UHFFFAOYSA-N 0 1 314.458 4.243 20 0 DIADMN C[C@]1(CNc2ccncc2C(F)(F)F)CCCc2ccccc21 ZINC001186003987 1048251761 /nfs/dbraw/zinc/25/17/61/1048251761.db2.gz JEPMONULUXWEPK-QGZVFWFLSA-N 0 1 320.358 4.228 20 0 DIADMN Cc1cc(C2CCN([C@H](C)c3cccc(Cl)c3F)CC2)n[nH]1 ZINC000480858024 1048259452 /nfs/dbraw/zinc/25/94/52/1048259452.db2.gz PUNFCRFRKGLEQM-GFCCVEGCSA-N 0 1 321.827 4.451 20 0 DIADMN Cc1cc(C2CCN([C@H](C)c3cccc(Cl)c3F)CC2)[nH]n1 ZINC000480858024 1048259463 /nfs/dbraw/zinc/25/94/63/1048259463.db2.gz PUNFCRFRKGLEQM-GFCCVEGCSA-N 0 1 321.827 4.451 20 0 DIADMN Cc1[nH+]c2c(Nc3ccc(C(=O)[O-])c(Cl)c3)cccn2c1C ZINC001175315450 1048260499 /nfs/dbraw/zinc/26/04/99/1048260499.db2.gz HECPOGOWEVCZLG-UHFFFAOYSA-N 0 1 315.760 4.046 20 0 DIADMN CN(Cc1cccc(OC(F)F)c1)Cc1ccc(F)c(F)c1 ZINC000064992890 1048261099 /nfs/dbraw/zinc/26/10/99/1048261099.db2.gz IXKCPGTTWLOTTJ-UHFFFAOYSA-N 0 1 313.294 4.198 20 0 DIADMN Cc1nc(C(C)C)ccc1CN1CCS[C@@H]2CCCC[C@@H]21 ZINC000559107750 1048263711 /nfs/dbraw/zinc/26/37/11/1048263711.db2.gz TUMZRNKPLVRHLM-ZWKOTPCHSA-N 0 1 304.503 4.373 20 0 DIADMN CC[C@@H](NCc1ccc(Cl)cn1)c1ccc2c(c1)CCCO2 ZINC000776169109 1048267698 /nfs/dbraw/zinc/26/76/98/1048267698.db2.gz DSCOZLQZVXVQHF-QGZVFWFLSA-N 0 1 316.832 4.301 20 0 DIADMN CCS[C@@H]1CCCCN(c2ccncc2C(F)(F)F)C1 ZINC001162475730 1048286299 /nfs/dbraw/zinc/28/62/99/1048286299.db2.gz FHEKRRGCZSCIBU-LLVKDONJSA-N 0 1 304.381 4.212 20 0 DIADMN F[C@@H]1CCCC[C@H]1Nc1nc2ccc(Br)cc2[nH]1 ZINC001162508909 1048289234 /nfs/dbraw/zinc/28/92/34/1048289234.db2.gz ZHMDVFDFJMVQSI-NXEZZACHSA-N 0 1 312.186 4.018 20 0 DIADMN Cc1c(NC(=O)C(C)(C)C)ccnc1N[C@@H]1CCCC[C@H]1F ZINC001162505602 1048290014 /nfs/dbraw/zinc/29/00/14/1048290014.db2.gz HLDUJJGAFPNSPC-TZMCWYRMSA-N 0 1 307.413 4.067 20 0 DIADMN Cc1cnc(NCC2c3ccccc3-c3ccccc32)c(N)c1 ZINC001162555804 1048303624 /nfs/dbraw/zinc/30/36/24/1048303624.db2.gz KYPRZYHTICHHGE-UHFFFAOYSA-N 0 1 301.393 4.197 20 0 DIADMN CC[C@@H](C)CN1CCO[C@H](c2cccc(C(F)(F)F)c2)C1 ZINC001201521324 1048309539 /nfs/dbraw/zinc/30/95/39/1048309539.db2.gz UHXJMISTDIXBAJ-DOMZBBRYSA-N 0 1 301.352 4.125 20 0 DIADMN FC(F)(F)c1cnccc1N1CC[C@@H](Cc2ccccc2)C1 ZINC001162605214 1048311911 /nfs/dbraw/zinc/31/19/11/1048311911.db2.gz KNIARWCIYQOVAG-AWEZNQCLSA-N 0 1 306.331 4.169 20 0 DIADMN FC(F)(F)c1cnccc1NCCc1cc2ccccc2s1 ZINC001186564852 1048317551 /nfs/dbraw/zinc/31/75/51/1048317551.db2.gz GOVCXIOSQKUJHB-UHFFFAOYSA-N 0 1 322.355 4.392 20 0 DIADMN CC[C@@H]1CCCC[C@@H]1NCc1nc(Cc2ccccc2C)no1 ZINC000481180337 1048320690 /nfs/dbraw/zinc/32/06/90/1048320690.db2.gz XBCQHIQUVLWJQB-WBVHZDCISA-N 0 1 313.445 4.027 20 0 DIADMN C[C@H](N[C@@H]1CCC[C@@H](C)[C@H]1C)c1nc(Cc2ccccc2)no1 ZINC000481181135 1048322976 /nfs/dbraw/zinc/32/29/76/1048322976.db2.gz LWXDKXQDHZPLPO-PNBKFKSVSA-N 0 1 313.445 4.136 20 0 DIADMN CC(C)CCN1CCN(C(=O)OC(C)(C)C)C2=CCCC[C@H]21 ZINC001201631435 1048327734 /nfs/dbraw/zinc/32/77/34/1048327734.db2.gz SKBBMFZJCNXKPB-OAHLLOKOSA-N 0 1 308.466 4.022 20 0 DIADMN Brc1cccc(-c2cc(Nc3cncs3)on2)c1 ZINC001175494830 1048328115 /nfs/dbraw/zinc/32/81/15/1048328115.db2.gz GUNJNJSDNGTIAS-UHFFFAOYSA-N 0 1 322.187 4.304 20 0 DIADMN C[C@H](NC1(c2ccccc2)CC1)c1ccc(Br)cn1 ZINC000555377996 1048336034 /nfs/dbraw/zinc/33/60/34/1048336034.db2.gz BYEDZGWLDPERAS-LBPRGKRZSA-N 0 1 317.230 4.184 20 0 DIADMN Fc1c(Cl)nccc1NC1=CCN(Cc2ccccc2)CC1 ZINC001175504545 1048337800 /nfs/dbraw/zinc/33/78/00/1048337800.db2.gz GRIOIQQQXPNYJU-UHFFFAOYSA-N 0 1 317.795 4.076 20 0 DIADMN CCOC(=O)[C@H]1CCC[C@H](c2ccccc2)N1CCC(C)C ZINC001201626508 1048338817 /nfs/dbraw/zinc/33/88/17/1048338817.db2.gz IMNYWNLFQHBSQI-QZTJIDSGSA-N 0 1 303.446 4.191 20 0 DIADMN Fc1ccc(NC2=CCN(Cc3ccccc3)CC2)c(F)c1F ZINC001175506342 1048340323 /nfs/dbraw/zinc/34/03/23/1048340323.db2.gz VOLBIGWVKOQECB-UHFFFAOYSA-N 0 1 318.342 4.306 20 0 DIADMN O=C1CCc2c1cccc2NC1=CCN(Cc2ccccc2)CC1 ZINC001175505482 1048340777 /nfs/dbraw/zinc/34/07/77/1048340777.db2.gz DSXVBFFUHSTXTF-UHFFFAOYSA-N 0 1 318.420 4.017 20 0 DIADMN O=C1CCc2cc(NC3=CCN(Cc4ccccc4)CC3)ccc21 ZINC001175507086 1048345642 /nfs/dbraw/zinc/34/56/42/1048345642.db2.gz UZBDQACMIPSGEJ-UHFFFAOYSA-N 0 1 318.420 4.017 20 0 DIADMN Cc1cc(Br)cc(CN(C)[C@H](C)c2ccccn2)c1 ZINC000775056545 1048351730 /nfs/dbraw/zinc/35/17/30/1048351730.db2.gz KJZLIHDEMCXDOX-CYBMUJFWSA-N 0 1 319.246 4.346 20 0 DIADMN Cc1ccc(-n2nccc2Nc2c3cn[nH]c3ccc2C)cc1 ZINC001175522945 1048353281 /nfs/dbraw/zinc/35/32/81/1048353281.db2.gz BUOHSEKITACLJW-UHFFFAOYSA-N 0 1 303.369 4.109 20 0 DIADMN COc1cccc2ncc(Nc3c4cn[nH]c4ccc3C)cc21 ZINC001175524425 1048354264 /nfs/dbraw/zinc/35/42/64/1048354264.db2.gz SKDCDEQOEXMTFA-UHFFFAOYSA-N 0 1 304.353 4.172 20 0 DIADMN COc1ccc2cc(Nc3c4cn[nH]c4ccc3C)cnc2c1 ZINC001175523250 1048354522 /nfs/dbraw/zinc/35/45/22/1048354522.db2.gz CCZLRANNCDPXFF-UHFFFAOYSA-N 0 1 304.353 4.172 20 0 DIADMN COc1ccc(Nc2c3cn[nH]c3ccc2C)c2ncccc12 ZINC001175527448 1048355071 /nfs/dbraw/zinc/35/50/71/1048355071.db2.gz NWASNRLXEHBGGT-UHFFFAOYSA-N 0 1 304.353 4.172 20 0 DIADMN Cc1cc2[nH]ncc2cc1NC(=O)c1cc(C)c(F)cc1Cl ZINC000481297209 1048355103 /nfs/dbraw/zinc/35/51/03/1048355103.db2.gz WIIHYTZFDUCOGN-UHFFFAOYSA-N 0 1 317.751 4.225 20 0 DIADMN Cc1ccc2[nH]ncc2c1Nc1cncc(-c2ccccn2)c1 ZINC001175525309 1048355424 /nfs/dbraw/zinc/35/54/24/1048355424.db2.gz AKMVCKHFTRGKRO-UHFFFAOYSA-N 0 1 301.353 4.072 20 0 DIADMN Cc1ccc2[nH]ncc2c1Nc1cc(-c2ccccc2)cnn1 ZINC001175525650 1048356058 /nfs/dbraw/zinc/35/60/58/1048356058.db2.gz DZMBRVLWAKZDFV-UHFFFAOYSA-N 0 1 301.353 4.072 20 0 DIADMN Cc1cc(C)n(-c2ccc(Nc3c4cn[nH]c4ccc3C)cc2)n1 ZINC001175527644 1048356225 /nfs/dbraw/zinc/35/62/25/1048356225.db2.gz SWOWXZFFSCECNU-UHFFFAOYSA-N 0 1 317.396 4.417 20 0 DIADMN Cc1ccc2[nH]ncc2c1Nc1cc(C)c(Br)cn1 ZINC001175526490 1048356853 /nfs/dbraw/zinc/35/68/53/1048356853.db2.gz WXBNGZWQXZCNSB-UHFFFAOYSA-N 0 1 317.190 4.081 20 0 DIADMN COc1cc(Nc2c3cn[nH]c3ccc2C)cc2cccnc21 ZINC001175527851 1048358747 /nfs/dbraw/zinc/35/87/47/1048358747.db2.gz YULVLLYPXXLCCT-UHFFFAOYSA-N 0 1 304.353 4.172 20 0 DIADMN Cc1ccc2[nH]ncc2c1Nc1ccc(OC2CCOCC2)cc1 ZINC001175527854 1048359309 /nfs/dbraw/zinc/35/93/09/1048359309.db2.gz ZCYUXQJTXZDFOQ-UHFFFAOYSA-N 0 1 323.396 4.173 20 0 DIADMN COc1nc2ccccc2cc1CNC/C=C\c1ccccc1 ZINC001201692818 1048361176 /nfs/dbraw/zinc/36/11/76/1048361176.db2.gz HZECZEUWTNGIOX-YFHOEESVSA-N 0 1 304.393 4.046 20 0 DIADMN Cc1ccc(CCC(=O)Nc2cc3cn[nH]c3cc2C)c(C)c1 ZINC000481317639 1048361242 /nfs/dbraw/zinc/36/12/42/1048361242.db2.gz UEUQGEWUPWEEOM-UHFFFAOYSA-N 0 1 307.397 4.059 20 0 DIADMN CCCCOc1ccc(C(=O)Nc2cc3cn[nH]c3cc2C)cc1 ZINC000481312321 1048364859 /nfs/dbraw/zinc/36/48/59/1048364859.db2.gz XEJHQXSPZDXIRU-UHFFFAOYSA-N 0 1 323.396 4.303 20 0 DIADMN Cc1cc2[nH]ncc2cc1NC(=O)c1ccc2sccc2c1 ZINC000481318052 1048365416 /nfs/dbraw/zinc/36/54/16/1048365416.db2.gz FQWRFRQDUDLUCW-UHFFFAOYSA-N 0 1 307.378 4.338 20 0 DIADMN COc1cccc2c1CC[C@@H]2N[C@@H](C)c1cc(F)ccc1OC ZINC000481326790 1048367280 /nfs/dbraw/zinc/36/72/80/1048367280.db2.gz ZRBQXAXDKWVPDZ-SJCJKPOMSA-N 0 1 315.388 4.181 20 0 DIADMN Cc1cc2[nH]ncc2cc1NC(=O)[C@@H](c1ccccc1)C(C)C ZINC000481327200 1048368171 /nfs/dbraw/zinc/36/81/71/1048368171.db2.gz FWXREFWWFBXFKJ-GOSISDBHSA-N 0 1 307.397 4.250 20 0 DIADMN Cc1cc2[nH]ncc2cc1NC(=O)c1ccc(C2CCC2)cc1 ZINC000481332160 1048369432 /nfs/dbraw/zinc/36/94/32/1048369432.db2.gz JWCBVIUVEDXSMK-UHFFFAOYSA-N 0 1 305.381 4.391 20 0 DIADMN Cc1ccnc(NCc2ccc(C(=O)OC(C)(C)C)cc2)c1C ZINC001162834279 1048369961 /nfs/dbraw/zinc/36/99/61/1048369961.db2.gz ISEPHQZTPFGQJJ-UHFFFAOYSA-N 0 1 312.413 4.266 20 0 DIADMN CCC(C)(C)c1ccc(CN2CCN(C)c3ncccc3C2)cc1 ZINC001175622737 1048376807 /nfs/dbraw/zinc/37/68/07/1048376807.db2.gz SLKGQIYNASKSRP-UHFFFAOYSA-N 0 1 323.484 4.221 20 0 DIADMN CC[C@H](C)c1nc([C@H](C)N[C@H]2CCc3c2cccc3Cl)n[nH]1 ZINC000555548410 1048381470 /nfs/dbraw/zinc/38/14/70/1048381470.db2.gz KZISPUBGVISDEV-PGUXBMHVSA-N 0 1 318.852 4.310 20 0 DIADMN CC[C@H](C)c1nnc([C@H](C)NC2CC(c3cccc(F)c3)C2)[nH]1 ZINC000555548197 1048381897 /nfs/dbraw/zinc/38/18/97/1048381897.db2.gz LSPRXUXLOYRGMM-AVHCAHFISA-N 0 1 316.424 4.054 20 0 DIADMN CC[C@H]1[C@@H](C)CCN1Cc1csc(COc2ccccc2)n1 ZINC000481372017 1048385203 /nfs/dbraw/zinc/38/52/03/1048385203.db2.gz KJMYCBBJEOINEF-YOEHRIQHSA-N 0 1 316.470 4.343 20 0 DIADMN Clc1ccc(CO[C@H]2CCCN(Cc3ccco3)C2)cc1 ZINC001203278137 1048387387 /nfs/dbraw/zinc/38/73/87/1048387387.db2.gz CHONCXOXBCGPMC-KRWDZBQOSA-N 0 1 305.805 4.114 20 0 DIADMN CC(C)n1ccnc1CN1CCC[C@@H](c2ccc(F)cc2)CC1 ZINC000481395187 1048391335 /nfs/dbraw/zinc/39/13/35/1048391335.db2.gz YSKWJXAXWMFJGR-MRXNPFEDSA-N 0 1 315.436 4.373 20 0 DIADMN CCCOc1ncccc1CN[C@@H]1c2cc(F)ccc2C[C@@H]1C ZINC000481397246 1048391931 /nfs/dbraw/zinc/39/19/31/1048391931.db2.gz CAAYJXJNJUCRIU-UGSOOPFHSA-N 0 1 314.404 4.033 20 0 DIADMN CCCCOc1ncccc1CN[C@H]1CCc2ccc(C)cc21 ZINC000481426702 1048397545 /nfs/dbraw/zinc/39/75/45/1048397545.db2.gz UXOVXDDLUAGIFD-IBGZPJMESA-N 0 1 310.441 4.346 20 0 DIADMN Cc1[nH]nc2ccc(Nc3cc(C)cc(Br)n3)cc12 ZINC001175695152 1048399069 /nfs/dbraw/zinc/39/90/69/1048399069.db2.gz XCZOWXOXMNAWDJ-UHFFFAOYSA-N 0 1 317.190 4.081 20 0 DIADMN Cc1[nH]nc2ccc(Nc3cccnc3N3CCCCC3)cc21 ZINC001175695427 1048400380 /nfs/dbraw/zinc/40/03/80/1048400380.db2.gz HVIBJTKEPPABFT-UHFFFAOYSA-N 0 1 307.401 4.000 20 0 DIADMN Cc1cc(Nc2ccc3n[nH]c(C)c3c2)n(-c2cccc(F)c2)n1 ZINC001175693605 1048400415 /nfs/dbraw/zinc/40/04/15/1048400415.db2.gz FFHBBOBTMKQOKK-UHFFFAOYSA-N 0 1 321.359 4.248 20 0 DIADMN Cc1[nH]nc2ccc(Nc3cc(-c4ccccc4C)nn3C)cc12 ZINC001175699249 1048401405 /nfs/dbraw/zinc/40/14/05/1048401405.db2.gz OLEIXHZNGRJQFA-UHFFFAOYSA-N 0 1 317.396 4.324 20 0 DIADMN Cc1[nH]nc2ccc(Nc3ccnn3-c3ccccc3C)cc12 ZINC001175698818 1048402153 /nfs/dbraw/zinc/40/21/53/1048402153.db2.gz GHTYSTPEILVMKS-UHFFFAOYSA-N 0 1 303.369 4.109 20 0 DIADMN Cc1[nH]nc2ccc(Nc3cncc(-c4ccccn4)c3)cc21 ZINC001175698815 1048402226 /nfs/dbraw/zinc/40/22/26/1048402226.db2.gz GEYUVQVNEJWYNE-UHFFFAOYSA-N 0 1 301.353 4.072 20 0 DIADMN Cc1[nH]nc2ccc(Nc3cnc(C(F)(F)F)cc3C)cc12 ZINC001175696418 1048402673 /nfs/dbraw/zinc/40/26/73/1048402673.db2.gz XFDXQMLVKJFRNK-UHFFFAOYSA-N 0 1 306.291 4.337 20 0 DIADMN Cc1[nH]nc2ccc(Nc3c(N)cccc3C(F)(F)F)cc12 ZINC001175701873 1048404907 /nfs/dbraw/zinc/40/49/07/1048404907.db2.gz IJRJLCZEXPXGRV-UHFFFAOYSA-N 0 1 306.291 4.216 20 0 DIADMN CC(C)=CCC[C@H](C)CCN1CCO[C@H](c2ccncc2)C1 ZINC001201981598 1048405196 /nfs/dbraw/zinc/40/51/96/1048405196.db2.gz PFGZXVDCCFCNAU-HKUYNNGSSA-N 0 1 302.462 4.228 20 0 DIADMN CO[C@H]1CCOc2c(Nc3ccc4n[nH]c(C)c4c3)cccc21 ZINC001175702228 1048406506 /nfs/dbraw/zinc/40/65/06/1048406506.db2.gz PIXHBRHCWQZDRF-KRWDZBQOSA-N 0 1 309.369 4.085 20 0 DIADMN C[C@@H](c1ccc(Br)cc1)N1CCC[C@@H](CF)C1 ZINC001175732934 1048427705 /nfs/dbraw/zinc/42/77/05/1048427705.db2.gz IXCKLRJTSZEYSD-RYUDHWBXSA-N 0 1 300.215 4.192 20 0 DIADMN Cc1nsc(Nc2cnn(-c3ccc(C)cc3)c2C(C)C)n1 ZINC001163037574 1048407608 /nfs/dbraw/zinc/40/76/08/1048407608.db2.gz WUKRURZHVYIKCK-UHFFFAOYSA-N 0 1 313.430 4.208 20 0 DIADMN Cc1[nH]nc2cc(Nc3cncc(Br)c3C)ccc12 ZINC001175656523 1048408026 /nfs/dbraw/zinc/40/80/26/1048408026.db2.gz HALPJOFSSPRPHH-UHFFFAOYSA-N 0 1 317.190 4.081 20 0 DIADMN Cc1[nH]nc2cc(Nc3cc(F)c(Cl)nc3Cl)ccc12 ZINC001175657500 1048408397 /nfs/dbraw/zinc/40/83/97/1048408397.db2.gz UIDHXYQXFLEUJS-UHFFFAOYSA-N 0 1 311.147 4.456 20 0 DIADMN Cc1[nH]nc2cc(Nc3cc(Br)cnc3C)ccc12 ZINC001175656535 1048408652 /nfs/dbraw/zinc/40/86/52/1048408652.db2.gz HSRVBIMPRHHIDI-UHFFFAOYSA-N 0 1 317.190 4.081 20 0 DIADMN Cc1[nH]nc2cc(Nc3cc(C)c(Br)cn3)ccc12 ZINC001175660425 1048409249 /nfs/dbraw/zinc/40/92/49/1048409249.db2.gz ZISSJWYDBWBEGF-UHFFFAOYSA-N 0 1 317.190 4.081 20 0 DIADMN COC(=O)c1ccc(Cl)c(Nc2ccc3c(C)[nH]nc3c2)c1 ZINC001175662039 1048410421 /nfs/dbraw/zinc/41/04/21/1048410421.db2.gz ZTNVRGGGZHUGEK-UHFFFAOYSA-N 0 1 315.760 4.055 20 0 DIADMN Cc1[nH]nc2cc(Nc3cc(O)ccc3Br)ccc12 ZINC001175661794 1048410504 /nfs/dbraw/zinc/41/05/04/1048410504.db2.gz RTHZKJABBILKLO-UHFFFAOYSA-N 0 1 318.174 4.083 20 0 DIADMN Cc1cnn(-c2cccc(C)c2)c1Nc1ccc2c(C)[nH]nc2c1 ZINC001175660663 1048410535 /nfs/dbraw/zinc/41/05/35/1048410535.db2.gz UNPOFJGTUWRFGA-UHFFFAOYSA-N 0 1 317.396 4.417 20 0 DIADMN Cc1[nH]nc2cc(Nc3cc(OC(F)(F)F)ccc3O)ccc12 ZINC001175664571 1048411953 /nfs/dbraw/zinc/41/19/53/1048411953.db2.gz GKNQDANDBBFHTF-UHFFFAOYSA-N 0 1 323.274 4.219 20 0 DIADMN COC(=O)c1ccc(Nc2ccc3c(C)[nH]nc3c2)c(Cl)c1 ZINC001175666519 1048412123 /nfs/dbraw/zinc/41/21/23/1048412123.db2.gz YANXFYQQGAFUCU-UHFFFAOYSA-N 0 1 315.760 4.055 20 0 DIADMN CC(=O)Nc1ccc(Nc2ccc3c(C)[nH]nc3c2)cc1Cl ZINC001175662738 1048412143 /nfs/dbraw/zinc/41/21/43/1048412143.db2.gz YSMTWAVYLCARCQ-UHFFFAOYSA-N 0 1 314.776 4.227 20 0 DIADMN COc1cc(F)c(Cl)cc1Nc1ccc2c(C)[nH]nc2c1 ZINC001175665841 1048412306 /nfs/dbraw/zinc/41/23/06/1048412306.db2.gz TWKZOBVMJVWHTO-UHFFFAOYSA-N 0 1 305.740 4.416 20 0 DIADMN Cc1[nH]nc2cc(Nc3ccc4c(c3)C(C)(C)CC(=O)N4)ccc12 ZINC001175664524 1048412369 /nfs/dbraw/zinc/41/23/69/1048412369.db2.gz DYXMQDMAAVHVJG-UHFFFAOYSA-N 0 1 320.396 4.235 20 0 DIADMN COC(=O)c1c(Cl)cccc1Nc1ccc2c(C)[nH]nc2c1 ZINC001175663326 1048412386 /nfs/dbraw/zinc/41/23/86/1048412386.db2.gz XKPXIRVSFXCBGK-UHFFFAOYSA-N 0 1 315.760 4.055 20 0 DIADMN Cc1[nH]nc2cc(Nc3c(O)cccc3C(F)(F)F)ccc12 ZINC001175662970 1048412765 /nfs/dbraw/zinc/41/27/65/1048412765.db2.gz MEPKRURXQVEDNK-UHFFFAOYSA-N 0 1 307.275 4.339 20 0 DIADMN O[C@H](CCc1ccccc1)CNCc1c(Cl)cccc1Cl ZINC001201972197 1048415410 /nfs/dbraw/zinc/41/54/10/1048415410.db2.gz RHJLIRMOGBIPTG-CQSZACIVSA-N 0 1 324.251 4.077 20 0 DIADMN COc1cc(F)c(Cl)cc1Nc1ccc2n[nH]c(C)c2c1 ZINC001175703161 1048416082 /nfs/dbraw/zinc/41/60/82/1048416082.db2.gz XPUMGJCIIIVMBS-UHFFFAOYSA-N 0 1 305.740 4.416 20 0 DIADMN C[C@H]1c2ccccc2CC[N@@H+]1Cc1ccc(Cl)cc1C(=O)[O-] ZINC001142643288 1048418061 /nfs/dbraw/zinc/41/80/61/1048418061.db2.gz OUHRFOSQCOTDFK-LBPRGKRZSA-N 0 1 315.800 4.158 20 0 DIADMN CC(C)[N@@H+](Cc1ccccc1)Cc1ccc(Cl)cc1C(=O)[O-] ZINC001142643444 1048419264 /nfs/dbraw/zinc/41/92/64/1048419264.db2.gz VEQMVPNEGIAVNV-UHFFFAOYSA-N 0 1 317.816 4.449 20 0 DIADMN C[C@@H]1c2ccccc2CC[N@@H+]1Cc1ccc(Cl)cc1C(=O)[O-] ZINC001142643287 1048419286 /nfs/dbraw/zinc/41/92/86/1048419286.db2.gz 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/nfs/dbraw/zinc/42/27/09/1048422709.db2.gz CINUJBXMEYSMMP-UHFFFAOYSA-N 0 1 309.457 4.135 20 0 DIADMN O=C(Nc1ccc(F)c(Cl)c1)Nc1cc(O)c(F)c(F)c1 ZINC001187699780 1048429514 /nfs/dbraw/zinc/42/95/14/1048429514.db2.gz LUCYLJALXIXPED-UHFFFAOYSA-N 0 1 316.666 4.107 20 0 DIADMN Cc1csc(CN2CCC[C@H](c3ccc(F)cc3)CC2)n1 ZINC000481554172 1048429783 /nfs/dbraw/zinc/42/97/83/1048429783.db2.gz HLQQEKCEEDPFBF-AWEZNQCLSA-N 0 1 304.434 4.360 20 0 DIADMN Cc1nc(CN2CCC[C@]2(C)c2ccccc2)nc2ccccc12 ZINC001175741643 1048431192 /nfs/dbraw/zinc/43/11/92/1048431192.db2.gz OGBUNRIBCWLJGL-OAQYLSRUSA-N 0 1 317.436 4.449 20 0 DIADMN CCc1ccccc1-c1nc(CNc2ncc(C)cc2N)cs1 ZINC001163205303 1048436274 /nfs/dbraw/zinc/43/62/74/1048436274.db2.gz OOYPOPGDVNWMMT-UHFFFAOYSA-N 0 1 324.453 4.270 20 0 DIADMN CC(C)c1cc(NC(=O)c2ccc(O)c(Cl)c2)ccc1O ZINC001175756709 1048440919 /nfs/dbraw/zinc/44/09/19/1048440919.db2.gz REPWXSYSYVIVQZ-UHFFFAOYSA-N 0 1 305.761 4.127 20 0 DIADMN COc1ccc(F)cc1CNCc1cccc(OC(C)(C)C)c1 ZINC001202101305 1048450763 /nfs/dbraw/zinc/45/07/63/1048450763.db2.gz GZRXIRIJEUHZJL-UHFFFAOYSA-N 0 1 317.404 4.301 20 0 DIADMN FC(F)(F)c1cnccc1N1CCCc2ccccc2CC1 ZINC001163312585 1048450793 /nfs/dbraw/zinc/45/07/93/1048450793.db2.gz QPAPKVXOOXMJGO-UHFFFAOYSA-N 0 1 306.331 4.096 20 0 DIADMN Clc1ccc2nc(SC[C@@H]3C[C@@H]4CCC[C@@H]4O3)[nH]c2c1 ZINC001187972582 1048456146 /nfs/dbraw/zinc/45/61/46/1048456146.db2.gz UDOSNGJYFWEGKC-CHIMOYNISA-N 0 1 308.834 4.266 20 0 DIADMN COc1ccc2nc(SCc3ccc(F)cc3C)[nH]c2c1 ZINC001187987933 1048457464 /nfs/dbraw/zinc/45/74/64/1048457464.db2.gz YCPTWTLVVMFASS-UHFFFAOYSA-N 0 1 302.374 4.311 20 0 DIADMN Cc1ocnc1CNc1ccnc2cc(OC(F)(F)F)ccc21 ZINC000899874892 1048460547 /nfs/dbraw/zinc/46/05/47/1048460547.db2.gz OLAABFDBDNJZBT-UHFFFAOYSA-N 0 1 323.274 4.042 20 0 DIADMN FC(F)(F)Oc1ccc2c(c1)nccc2N1CCC2(CC2)C1 ZINC000899877344 1048462650 /nfs/dbraw/zinc/46/26/50/1048462650.db2.gz RVUDCUDZYJAAFW-UHFFFAOYSA-N 0 1 308.303 4.124 20 0 DIADMN FC(F)(F)Oc1ccc2c(c1)nccc2NC1CC(F)(F)C1 ZINC000899876828 1048462852 /nfs/dbraw/zinc/46/28/52/1048462852.db2.gz PPMAPZUMSDHSDK-UHFFFAOYSA-N 0 1 318.245 4.343 20 0 DIADMN CSc1cccc(NC(=O)Nc2cc(O)c(F)c(F)c2)c1 ZINC001188050509 1048464309 /nfs/dbraw/zinc/46/43/09/1048464309.db2.gz LSVCUHVYQQOJMG-UHFFFAOYSA-N 0 1 310.325 4.036 20 0 DIADMN CC[C@H](CN(CC)Cc1nc(C(C)(C)C)no1)c1ccccc1 ZINC000481733530 1048471568 /nfs/dbraw/zinc/47/15/68/1048471568.db2.gz HTNBCAPEDIPFLK-OAHLLOKOSA-N 0 1 315.461 4.383 20 0 DIADMN Cc1ccc(CNc2ccc(Cl)c(CN(C)C)c2)c(F)c1 ZINC001202184336 1048473131 /nfs/dbraw/zinc/47/31/31/1048473131.db2.gz QXONJCWZJVMVCU-UHFFFAOYSA-N 0 1 306.812 4.461 20 0 DIADMN CC(C)CC[C@H](O)CN1CCC[C@@H]1c1nc2ccccc2s1 ZINC000481736511 1048474647 /nfs/dbraw/zinc/47/46/47/1048474647.db2.gz BKKOWXFRNPVWQS-GOEBONIOSA-N 0 1 318.486 4.230 20 0 DIADMN COC(=O)CCCN(Cc1ccc(Cl)cc1Cl)C(C)C ZINC001202252838 1048490015 /nfs/dbraw/zinc/49/00/15/1048490015.db2.gz LTILPWWMGMQRDQ-UHFFFAOYSA-N 0 1 318.244 4.157 20 0 DIADMN COc1ccc2oc([C@H](C)NCc3cnc(C)s3)c(C)c2c1 ZINC000106472382 1048480982 /nfs/dbraw/zinc/48/09/82/1048480982.db2.gz FEIKJGOIABUJRA-NSHDSACASA-N 0 1 316.426 4.366 20 0 DIADMN Cc1ccc(-c2n[nH]c(SCCc3cccc(F)c3)n2)cc1 ZINC001188169684 1048482343 /nfs/dbraw/zinc/48/23/43/1048482343.db2.gz LLPCEZNLSDMZOK-UHFFFAOYSA-N 0 1 313.401 4.254 20 0 DIADMN COc1cc2ccnc(N3[C@@H](C)CCC[C@@H]3C)c2cc1OC ZINC001163546378 1048486014 /nfs/dbraw/zinc/48/60/14/1048486014.db2.gz OXMUARXZFCJUIV-STQMWFEESA-N 0 1 300.402 4.019 20 0 DIADMN CSc1ccc(CN[C@H](C)c2ccnn2C2CCC2)cc1 ZINC000924768917 1048489104 /nfs/dbraw/zinc/48/91/04/1048489104.db2.gz IIMBSAHTCBGEHD-CYBMUJFWSA-N 0 1 301.459 4.181 20 0 DIADMN Cc1[nH]nc2cc(NC(=O)c3ccccc3C(F)F)cc(F)c12 ZINC001188283758 1048496667 /nfs/dbraw/zinc/49/66/67/1048496667.db2.gz CHYIPULHABEWOY-UHFFFAOYSA-N 0 1 319.286 4.200 20 0 DIADMN Cc1nccnc1[C@H](C)NCc1cc(Cl)cc2ccccc21 ZINC001175927099 1048502344 /nfs/dbraw/zinc/50/23/44/1048502344.db2.gz VBMJZAMQKJRICU-ZDUSSCGKSA-N 0 1 311.816 4.442 20 0 DIADMN C[C@H]1CCC[C@H](C)N1C(=O)c1cc(-c2ccc(Cl)cc2)[nH]n1 ZINC000481851521 1048503300 /nfs/dbraw/zinc/50/33/00/1048503300.db2.gz DNIITIJPGGUVOR-RYUDHWBXSA-N 0 1 317.820 4.133 20 0 DIADMN C[C@@H]1CN(C[C@H]2CCC[C@@H](C(F)(F)F)O2)Cc2ccccc21 ZINC001175935180 1048504028 /nfs/dbraw/zinc/50/40/28/1048504028.db2.gz IIAKOZOVJGDEQH-XPKDYRNWSA-N 0 1 313.363 4.106 20 0 DIADMN Cc1ccc([C@@H]2CCCCN2C(=O)c2cc(C3CC3)[nH]n2)cc1C ZINC001188391902 1048504230 /nfs/dbraw/zinc/50/42/30/1048504230.db2.gz OYPZCQVSJUXOQN-IBGZPJMESA-N 0 1 323.440 4.271 20 0 DIADMN Oc1cccc(CCNc2cc(OCc3ccccc3)ccn2)c1 ZINC001163698285 1048507898 /nfs/dbraw/zinc/50/78/98/1048507898.db2.gz GJFNRACCHZOHRV-UHFFFAOYSA-N 0 1 320.392 4.021 20 0 DIADMN Oc1cc(Cl)cc(CN[C@H]2CCCc3ccc(F)cc32)c1 ZINC001202279383 1048508803 /nfs/dbraw/zinc/50/88/03/1048508803.db2.gz HSJIJBXCUJDMDP-KRWDZBQOSA-N 0 1 305.780 4.352 20 0 DIADMN c1nc2ccc(NCc3cccc(OC4CCCC4)c3)cc2[nH]1 ZINC001202349993 1048518848 /nfs/dbraw/zinc/51/88/48/1048518848.db2.gz 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1048877223 /nfs/dbraw/zinc/87/72/23/1048877223.db2.gz JWQVWMVIHYYCRB-HXUWFJFHSA-N 0 1 319.452 4.191 20 0 DIADMN C[C@@H](NCc1cc(F)c(F)c(F)c1)c1ccc2c(c1)CCCO2 ZINC000853094572 1048881070 /nfs/dbraw/zinc/88/10/70/1048881070.db2.gz GKPSIHSYCQLSMJ-LLVKDONJSA-N 0 1 321.342 4.280 20 0 DIADMN COCc1ccc([C@H]2CCCN2Cc2ccc(C)c(OC)c2)o1 ZINC000194709124 1048882131 /nfs/dbraw/zinc/88/21/31/1048882131.db2.gz YQKRKRADWFTNBL-QGZVFWFLSA-N 0 1 315.413 4.080 20 0 DIADMN COc1ccc(-n2c3ccccc3nc2CN2CCC[C@H]2C)cc1 ZINC001191204660 1048882127 /nfs/dbraw/zinc/88/21/27/1048882127.db2.gz UNJZQHJQWAUFNV-OAHLLOKOSA-N 0 1 321.424 4.018 20 0 DIADMN CO[C@@]1(C)C[C@@H]([N@@H+](C)Cc2ccccc2OC(C)C)C1(C)C ZINC001191201717 1048883412 /nfs/dbraw/zinc/88/34/12/1048883412.db2.gz CDXVZGRVTAHNCN-MJGOQNOKSA-N 0 1 305.462 4.109 20 0 DIADMN CCc1cnc(CNCCOc2ccc3ccccc3c2)s1 ZINC001177403863 1048884325 /nfs/dbraw/zinc/88/43/25/1048884325.db2.gz GZXRBNALDSMWPY-UHFFFAOYSA-N 0 1 312.438 4.027 20 0 DIADMN CCCc1noc(C2CCN(Cc3ccccc3Cl)CC2)n1 ZINC001203384813 1048886320 /nfs/dbraw/zinc/88/63/20/1048886320.db2.gz GZKSTBNGEHXFSD-UHFFFAOYSA-N 0 1 319.836 4.055 20 0 DIADMN COc1ccc(CNCc2ccc(C(C)C)cc2)c(F)c1OC ZINC001177464330 1048888564 /nfs/dbraw/zinc/88/85/64/1048888564.db2.gz NSIHNTUJPPTSMV-UHFFFAOYSA-N 0 1 317.404 4.256 20 0 DIADMN Cc1ccc([C@H]2CCCCCN2CC(=O)NCCC(C)(C)C)o1 ZINC001191175955 1048888569 /nfs/dbraw/zinc/88/85/69/1048888569.db2.gz VJIPIOIDHLLRPR-MRXNPFEDSA-N 0 1 320.477 4.058 20 0 DIADMN Cc1ccc([C@@H]2CCCCCN2CC(=O)NCCC(C)(C)C)o1 ZINC001191175953 1048888995 /nfs/dbraw/zinc/88/89/95/1048888995.db2.gz VJIPIOIDHLLRPR-INIZCTEOSA-N 0 1 320.477 4.058 20 0 DIADMN COc1nscc1CN1CCC[C@@H](C)[C@H]1c1ccc(C)cc1 ZINC001191184294 1048892377 /nfs/dbraw/zinc/89/23/77/1048892377.db2.gz WMNLQYNAONWTST-PBHICJAKSA-N 0 1 316.470 4.433 20 0 DIADMN CN(CCCNCc1c(F)cccc1Cl)c1ccccc1F ZINC001177434321 1048892615 /nfs/dbraw/zinc/89/26/15/1048892615.db2.gz UAKKMEQEJVPMNU-UHFFFAOYSA-N 0 1 324.802 4.234 20 0 DIADMN COc1ccc(Cl)c(CN2CC[C@H](Nc3ccccc3)C2)c1 ZINC000484070056 1048895191 /nfs/dbraw/zinc/89/51/91/1048895191.db2.gz QJJKOQCOWKRSCL-INIZCTEOSA-N 0 1 316.832 4.035 20 0 DIADMN COC[C@@]12CCC[C@@H]1CN(Cc1c(Cl)cccc1Cl)C2 ZINC001203417376 1048895151 /nfs/dbraw/zinc/89/51/51/1048895151.db2.gz VLFDXXIIUGNIEH-WBMJQRKESA-N 0 1 314.256 4.242 20 0 DIADMN Fc1ccc2onc(CNC/C=C\c3ccc(F)cc3F)c2c1 ZINC001203413667 1048895691 /nfs/dbraw/zinc/89/56/91/1048895691.db2.gz BTRCBUMBCXSCKN-UPHRSURJSA-N 0 1 318.298 4.048 20 0 DIADMN CCOc1cccc(CN[C@H](c2cccc(F)c2)C(C)(C)C)n1 ZINC001177525151 1048899450 /nfs/dbraw/zinc/89/94/50/1048899450.db2.gz ONROOSUJRHHHNL-GOSISDBHSA-N 0 1 316.420 4.496 20 0 DIADMN COc1ccccc1CN1CCC(Oc2ccccc2C)CC1 ZINC001203425336 1048900443 /nfs/dbraw/zinc/90/04/43/1048900443.db2.gz JSYWIGNLCVSCHM-UHFFFAOYSA-N 0 1 311.425 4.047 20 0 DIADMN C[C@H](O)c1ccc(CNCc2cccc(Cl)c2Cl)cc1 ZINC001177479519 1048906375 /nfs/dbraw/zinc/90/63/75/1048906375.db2.gz SSFCRSIYUXFFSZ-NSHDSACASA-N 0 1 310.224 4.337 20 0 DIADMN CCOc1cccc([C@@H](C)NCc2c[nH]c(-c3ccccc3)n2)c1 ZINC001177554466 1048907180 /nfs/dbraw/zinc/90/71/80/1048907180.db2.gz ZYORSJMYJVMTMZ-OAHLLOKOSA-N 0 1 321.424 4.326 20 0 DIADMN CCc1onc(C)c1CN1C[C@H](C)C[C@H]1c1cccc(F)c1 ZINC001191245262 1048908792 /nfs/dbraw/zinc/90/87/92/1048908792.db2.gz RLORATSZHJSPLU-PXAZEXFGSA-N 0 1 302.393 4.268 20 0 DIADMN CC1=C(Br)CN(Cc2cccc3[nH]ccc32)CC1 ZINC000797604855 1048925009 /nfs/dbraw/zinc/92/50/09/1048925009.db2.gz JOGWPMKVQNWAQY-UHFFFAOYSA-N 0 1 305.219 4.043 20 0 DIADMN COc1cccc2c(CNc3ccc4c[nH]nc4c3)cccc12 ZINC001203479690 1048912264 /nfs/dbraw/zinc/91/22/64/1048912264.db2.gz WGXHMTVSGXEQJL-UHFFFAOYSA-N 0 1 303.365 4.337 20 0 DIADMN CCc1ccc(NC(=O)CN(C)[C@H](CC)Cc2ccccc2)cc1 ZINC001191278220 1048914137 /nfs/dbraw/zinc/91/41/37/1048914137.db2.gz PVLGSCBZAAJYIE-HXUWFJFHSA-N 0 1 324.468 4.141 20 0 DIADMN CCOc1ccccc1CNCc1cc(C2CC2)ccc1OC ZINC001203511036 1048914448 /nfs/dbraw/zinc/91/44/48/1048914448.db2.gz JNSIELLNUFFDIB-UHFFFAOYSA-N 0 1 311.425 4.261 20 0 DIADMN COc1ccc2c(c1)nccc2Nc1cnc(Cl)c(OC)c1 ZINC001203524799 1048917933 /nfs/dbraw/zinc/91/79/33/1048917933.db2.gz BETIKYAQHLNDGY-UHFFFAOYSA-N 0 1 315.760 4.044 20 0 DIADMN COc1ccc2c(c1)nccc2Nc1ccc(-n2ccnc2)cc1 ZINC001203524970 1048918324 /nfs/dbraw/zinc/91/83/24/1048918324.db2.gz KIVFMIBGBNFVFC-UHFFFAOYSA-N 0 1 316.364 4.173 20 0 DIADMN COc1ccc2c(c1)nccc2Nc1cccc(-c2nnco2)c1 ZINC001203525705 1048918604 /nfs/dbraw/zinc/91/86/04/1048918604.db2.gz BUTPLTJDNSWPMP-UHFFFAOYSA-N 0 1 318.336 4.037 20 0 DIADMN CCCn1cc(CN[C@H](CC)c2ccccc2OCC)c(C)n1 ZINC001177576430 1048918637 /nfs/dbraw/zinc/91/86/37/1048918637.db2.gz ZJPIPWRMPBFSJF-GOSISDBHSA-N 0 1 315.461 4.241 20 0 DIADMN COc1ccc2c(c1)nccc2Nc1c[nH]c2cc(=O)ccc-2c1 ZINC001203525246 1048919395 /nfs/dbraw/zinc/91/93/95/1048919395.db2.gz YTCNJNBQFSLNJV-UHFFFAOYSA-N 0 1 317.348 4.241 20 0 DIADMN COc1ccc2c(c1)nccc2Nc1c(Cl)cncc1Cl ZINC001203519538 1048919529 /nfs/dbraw/zinc/91/95/29/1048919529.db2.gz KJBHVZMMADIYIG-UHFFFAOYSA-N 0 1 320.179 4.111 20 0 DIADMN COc1ccc2c(c1)nccc2Nc1ccccc1C(C)(C)O ZINC001203525889 1048919548 /nfs/dbraw/zinc/91/95/48/1048919548.db2.gz HDKLWGFDODISRG-UHFFFAOYSA-N 0 1 308.381 4.214 20 0 DIADMN COc1ccc2c(c1)nccc2Nc1cnnc(Cl)c1Cl ZINC001203525039 1048919879 /nfs/dbraw/zinc/91/98/79/1048919879.db2.gz NHFSVBSEIBLYAD-UHFFFAOYSA-N 0 1 321.167 4.084 20 0 DIADMN COc1ccc2c(c1)nccc2N1c2ccc(N)cc2CC[C@@H]1C ZINC001203526361 1048920685 /nfs/dbraw/zinc/92/06/85/1048920685.db2.gz UWCOTVROQJKWHI-ZDUSSCGKSA-N 0 1 319.408 4.298 20 0 DIADMN COc1ccc2c(c1)nccc2Nc1cccc2c1cc[nH]c2=O ZINC001203526280 1048921215 /nfs/dbraw/zinc/92/12/15/1048921215.db2.gz RYMWLAFLLYZIGT-UHFFFAOYSA-N 0 1 317.348 4.241 20 0 DIADMN COc1ccc2c(c1)nccc2N(C)c1cc(Cl)ccc1N ZINC001203528445 1048921407 /nfs/dbraw/zinc/92/14/07/1048921407.db2.gz PDMKDVATRPDODH-UHFFFAOYSA-N 0 1 313.788 4.247 20 0 DIADMN Cc1nc2c(cccc2C(=O)N2CC[C@H](C)[C@@H]2c2ccccc2)[nH]1 ZINC001177602181 1048922069 /nfs/dbraw/zinc/92/20/69/1048922069.db2.gz HQLHUOUYONDHIA-ORAYPTAESA-N 0 1 319.408 4.095 20 0 DIADMN COc1ccc2c(c1)nccc2Nc1cc(C(C)=O)ccc1C ZINC001203527539 1048921942 /nfs/dbraw/zinc/92/19/42/1048921942.db2.gz CGUNPENOBUESBD-UHFFFAOYSA-N 0 1 306.365 4.498 20 0 DIADMN COc1ccc2c(c1)nccc2Nc1c(OC)cccc1C(C)=O ZINC001203528607 1048922802 /nfs/dbraw/zinc/92/28/02/1048922802.db2.gz UFPZEEOHYLYHAV-UHFFFAOYSA-N 0 1 322.364 4.198 20 0 DIADMN COc1ccc(Cl)cc1CN1CCS[C@H]2CCCC[C@H]21 ZINC001191358261 1048924782 /nfs/dbraw/zinc/92/47/82/1048924782.db2.gz HWLSKUSDYJJXEF-ZBFHGGJFSA-N 0 1 311.878 4.209 20 0 DIADMN COc1cccc2cc(CNCc3cc(F)c(F)c(F)c3)oc21 ZINC001177631445 1048925399 /nfs/dbraw/zinc/92/53/99/1048925399.db2.gz KOQYEXUGKFBWCO-UHFFFAOYSA-N 0 1 321.298 4.149 20 0 DIADMN CCCCCNC(=O)[C@H](C)N[C@H](C)c1oc2ccccc2c1C ZINC000484346661 1048929927 /nfs/dbraw/zinc/92/99/27/1048929927.db2.gz YYNKPTFWZDEWGH-CABCVRRESA-N 0 1 316.445 4.087 20 0 DIADMN COc1ccc(CN[C@H](C)c2ccccc2SC)cc1F ZINC000194839966 1048932103 /nfs/dbraw/zinc/93/21/03/1048932103.db2.gz SEFKXYPPEKCYQB-GFCCVEGCSA-N 0 1 305.418 4.407 20 0 DIADMN Cc1csc(NC(=O)c2cc(-c3cccc(Cl)c3)n[nH]2)c1 ZINC001191362537 1048932720 /nfs/dbraw/zinc/93/27/20/1048932720.db2.gz COWCZXXSGTZPJW-UHFFFAOYSA-N 0 1 317.801 4.352 20 0 DIADMN CCSc1ccc([C@@H](C)NCc2cn3ccccc3n2)cc1 ZINC001177774909 1048936754 /nfs/dbraw/zinc/93/67/54/1048936754.db2.gz RMYNDZSBVLLDQO-CQSZACIVSA-N 0 1 311.454 4.297 20 0 DIADMN Cc1ncn(-c2ccc(-c3ccc(C(F)(F)F)cc3)cc2)c1N ZINC001203591386 1048936722 /nfs/dbraw/zinc/93/67/22/1048936722.db2.gz CSQMPRACWXZMAR-UHFFFAOYSA-N 0 1 317.314 4.449 20 0 DIADMN CCCc1ccc(CNCc2nc3c(s2)CCCC3)s1 ZINC001203593726 1048936875 /nfs/dbraw/zinc/93/68/75/1048936875.db2.gz YDMWVHGLJHZYTM-UHFFFAOYSA-N 0 1 306.500 4.326 20 0 DIADMN CCc1cccc2c1OCC[C@@H]2NCc1cc(F)cc(F)c1 ZINC001177758234 1048940539 /nfs/dbraw/zinc/94/05/39/1048940539.db2.gz SDNAMAXPUTYVBV-KRWDZBQOSA-N 0 1 303.352 4.141 20 0 DIADMN CO[C@@H](CNCc1cccc(C2CCCC2)c1)C(F)(F)F ZINC001177799811 1048944804 /nfs/dbraw/zinc/94/48/04/1048944804.db2.gz JCQBQZGSISHVBY-HNNXBMFYSA-N 0 1 301.352 4.011 20 0 DIADMN CO[C@H](CNCc1cccc(C2CCCC2)c1)C(F)(F)F ZINC001177799812 1048946288 /nfs/dbraw/zinc/94/62/88/1048946288.db2.gz JCQBQZGSISHVBY-OAHLLOKOSA-N 0 1 301.352 4.011 20 0 DIADMN CO[C@H]1C[C@@H](CN2CCc3cc(Cl)cc(Cl)c3[C@@H]2C)C1 ZINC001191444740 1048946818 /nfs/dbraw/zinc/94/68/18/1048946818.db2.gz PTECUWQBJCOYCR-COPLHBTASA-N 0 1 314.256 4.338 20 0 DIADMN c1nc(-c2ccccc2)[nH]c1CNc1ccc(OCC2CC2)cc1 ZINC001177835700 1048951697 /nfs/dbraw/zinc/95/16/97/1048951697.db2.gz UULKGENQAGTFOX-UHFFFAOYSA-N 0 1 319.408 4.478 20 0 DIADMN FC(F)c1nc2cc(-c3cnn([C@H]4CCCCO4)c3)ccc2[nH]1 ZINC000854211376 1048952558 /nfs/dbraw/zinc/95/25/58/1048952558.db2.gz WWOXWUOPQGIJQL-CQSZACIVSA-N 0 1 318.327 4.063 20 0 DIADMN Cc1c2ccccc2oc1CNCc1cn(C)nc1C1CCCC1 ZINC001177855593 1048953455 /nfs/dbraw/zinc/95/34/55/1048953455.db2.gz ZRSPDPBDMCJSMB-UHFFFAOYSA-N 0 1 323.440 4.422 20 0 DIADMN C[C@H](N(C)CC(=O)Nc1ccc(C(C)(C)C)cc1)C1(C)CC1 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Clc1ccc(CN2CC[C@H](Oc3cncc(Cl)c3)C2)cc1 ZINC001225290251 1052769335 /nfs/dbraw/zinc/76/93/35/1052769335.db2.gz WTMOLASZBWSDNA-HNNXBMFYSA-N 0 1 323.223 4.042 20 0 DIADMN Cc1cc(F)ccc1O[C@@H]1CCC[N@H+]([C@@H](C)c2ccccn2)C1 ZINC001225345515 1052777462 /nfs/dbraw/zinc/77/74/62/1052777462.db2.gz DFJCMNNWNNYXHW-DOTOQJQBSA-N 0 1 314.404 4.134 20 0 DIADMN C[C@@H](c1cccnc1)N(C)CCSc1ccc(F)cc1F ZINC000660139536 1052782795 /nfs/dbraw/zinc/78/27/95/1052782795.db2.gz BKXZSOYWNUCWMR-LBPRGKRZSA-N 0 1 308.397 4.145 20 0 DIADMN Cc1csc(C2(NCc3ccc4c(c3)COC4)CCCC2)n1 ZINC000763427585 1052793858 /nfs/dbraw/zinc/79/38/58/1052793858.db2.gz KMLSOYGAGDGYKX-UHFFFAOYSA-N 0 1 314.454 4.041 20 0 DIADMN CSc1ccccc1CN(C)Cc1cc(C(C)(C)C)[nH]n1 ZINC000556054893 1052794227 /nfs/dbraw/zinc/79/42/27/1052794227.db2.gz SALIWTJWCFXTAT-UHFFFAOYSA-N 0 1 303.475 4.061 20 0 DIADMN COc1ccc(CN(Cc2nc(C)cs2)[C@H](C)C2CC2)cc1 ZINC000129571952 1052796373 /nfs/dbraw/zinc/79/63/73/1052796373.db2.gz JNRZMNHTNQSMLL-CQSZACIVSA-N 0 1 316.470 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C[C@@H](c1ccccn1)N1CC[C@@H](Oc2ccc(F)c(Cl)c2)C1 ZINC001225917842 1052847326 /nfs/dbraw/zinc/84/73/26/1052847326.db2.gz SHQHRJPXYSUFAR-GXTWGEPZSA-N 0 1 320.795 4.088 20 0 DIADMN COc1ccc2cc([C@@H](C)Oc3cccc4[nH]nnc43)ccc2c1 ZINC001225991218 1052856530 /nfs/dbraw/zinc/85/65/30/1052856530.db2.gz XCOVZZNNUASXNO-GFCCVEGCSA-N 0 1 319.364 4.260 20 0 DIADMN C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1Oc1cccc([S-])c1 ZINC001226014082 1052860284 /nfs/dbraw/zinc/86/02/84/1052860284.db2.gz OYPNOWNFLQKPIY-DNVCBOLYSA-N 0 1 313.466 4.265 20 0 DIADMN CN(C(=O)c1cnc(-c2ccccc2)[nH]1)C1CCC(C)(C)CC1 ZINC000556596369 1052868763 /nfs/dbraw/zinc/86/87/63/1052868763.db2.gz MGMWDAJWURPWQC-UHFFFAOYSA-N 0 1 311.429 4.118 20 0 DIADMN CC(C)C(CN[C@H](c1nccn1C)c1ccccc1F)C(C)C ZINC000556595175 1052868801 /nfs/dbraw/zinc/86/88/01/1052868801.db2.gz CFMSNCRARAVATE-SFHVURJKSA-N 0 1 317.452 4.166 20 0 DIADMN Cc1cccc([C@H]2CCCN2Cc2cnc(C(C)(C)C)nc2)c1 ZINC000556602671 1052869425 /nfs/dbraw/zinc/86/94/25/1052869425.db2.gz 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Cc1[nH]nc2cc(NC(=O)c3ccc4c(c3)CCC=C4)ccc12 ZINC000556956970 1052904645 /nfs/dbraw/zinc/90/46/45/1052904645.db2.gz CJJTWTWYMOHKDH-UHFFFAOYSA-N 0 1 303.365 4.083 20 0 DIADMN COc1ccc([C@@H](C)Oc2nc3ccc(C)cc3[nH]2)c(F)c1 ZINC001226510303 1052905063 /nfs/dbraw/zinc/90/50/63/1052905063.db2.gz XPJAHZBZOKZBHS-LLVKDONJSA-N 0 1 300.333 4.159 20 0 DIADMN Cc1nc2c(o1)CCC[C@@H]2NC[C@@H](C)Oc1ccccc1Cl ZINC000925475927 1052911481 /nfs/dbraw/zinc/91/14/81/1052911481.db2.gz NWCXGWYNAMVALJ-RISCZKNCSA-N 0 1 320.820 4.071 20 0 DIADMN Cc1nc(-c2ccccc2)[nH]c1C(=O)O[C@@H]1CCc2ccccc21 ZINC000920130944 1052921418 /nfs/dbraw/zinc/92/14/18/1052921418.db2.gz XOUFOZPLVGNGEQ-QGZVFWFLSA-N 0 1 318.376 4.229 20 0 DIADMN Cc1nc(-c2ccccc2)[nH]c1C(=O)O[C@H](C)c1cccc(F)c1 ZINC000920168828 1052925420 /nfs/dbraw/zinc/92/54/20/1052925420.db2.gz CCQWYSWWRFVJGQ-CYBMUJFWSA-N 0 1 324.355 4.442 20 0 DIADMN CCCc1ccc(CNCC(=O)Nc2ccc(Cl)cc2)cc1 ZINC000920179724 1052925557 /nfs/dbraw/zinc/92/55/57/1052925557.db2.gz 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CCSc1ccc([C@@H](C)NCC(=O)Nc2ccccc2)cc1 ZINC000159163989 1053938802 /nfs/dbraw/zinc/93/88/02/1053938802.db2.gz CMIUBOSIHKBCSQ-CQSZACIVSA-N 0 1 314.454 4.088 20 0 DIADMN CO[C@H](CNCc1ccc(SC)o1)c1ccc(Cl)cc1 ZINC001200751065 1053939785 /nfs/dbraw/zinc/93/97/85/1053939785.db2.gz KWVOEWDCQXUBPF-CQSZACIVSA-N 0 1 311.834 4.132 20 0 DIADMN CC1CCN(Cc2c[nH]c3c2cccc3Br)CC1 ZINC001232017039 1053942950 /nfs/dbraw/zinc/94/29/50/1053942950.db2.gz YHVDPJGLCGGRGW-UHFFFAOYSA-N 0 1 307.235 4.162 20 0 DIADMN CCN(CC(=O)N1CCCCCC1)[C@@H](C)c1ccc(Cl)cc1 ZINC000621300169 1053944259 /nfs/dbraw/zinc/94/42/59/1053944259.db2.gz XZFHVXLCNGGFAG-HNNXBMFYSA-N 0 1 322.880 4.126 20 0 DIADMN Cc1cc(CN(C)[C@H](C)c2nc3ccc(Cl)cc3[nH]2)ccn1 ZINC000621299997 1053945230 /nfs/dbraw/zinc/94/52/30/1053945230.db2.gz YLUVTGSQQZROHS-GFCCVEGCSA-N 0 1 314.820 4.113 20 0 DIADMN CCOc1cncc(CN[C@@H](C)c2ccc(SCC)cc2)c1 ZINC000621333530 1053947663 /nfs/dbraw/zinc/94/76/63/1053947663.db2.gz HOTSXXYMMIFNJY-AWEZNQCLSA-N 0 1 316.470 4.443 20 0 DIADMN CCOc1cncc(CN[C@H](CC)c2ccc(Cl)s2)c1 ZINC000621335138 1053948583 /nfs/dbraw/zinc/94/85/83/1053948583.db2.gz CFBLYWADVQDDAI-CYBMUJFWSA-N 0 1 310.850 4.436 20 0 DIADMN CCOc1cncc(CN[C@H](C)c2ccc(OC(C)C)cc2)c1 ZINC000621329991 1053948966 /nfs/dbraw/zinc/94/89/66/1053948966.db2.gz VQTOJVOZMMDKHD-OAHLLOKOSA-N 0 1 314.429 4.118 20 0 DIADMN O=C([O-])c1cccc(Cl)c1C[N@H+]1CC[C@@H]2CCCC[C@H]2C1 ZINC001328729082 1053951600 /nfs/dbraw/zinc/95/16/00/1053951600.db2.gz BVCGUAFULNNWLB-STQMWFEESA-N 0 1 307.821 4.050 20 0 DIADMN Cc1nccnc1CN[C@H](CC(C)C)c1ccc(Cl)cc1 ZINC000621337522 1053951674 /nfs/dbraw/zinc/95/16/74/1053951674.db2.gz AWLSSYRTNUALML-MRXNPFEDSA-N 0 1 303.837 4.315 20 0 DIADMN CC(C)[C@H]1CCC[N@H+]([C@H](C(=O)[O-])c2ccccc2Cl)CC1 ZINC001328742916 1053952154 /nfs/dbraw/zinc/95/21/54/1053952154.db2.gz FVOUOWCVRFIKGD-BBRMVZONSA-N 0 1 309.837 4.224 20 0 DIADMN CCCc1ccc(CN[C@H](CCO)c2ccccc2F)s1 ZINC000621368129 1053956172 /nfs/dbraw/zinc/95/61/72/1053956172.db2.gz NROQPGVSNICBMN-QGZVFWFLSA-N 0 1 307.434 4.053 20 0 DIADMN CC1(C)C[C@H]1C(=O)Nc1ccc2nc(-c3cccc(F)c3)[nH]c2c1 ZINC001354738608 1053957040 /nfs/dbraw/zinc/95/70/40/1053957040.db2.gz XJTFSLBBWFMSRK-AWEZNQCLSA-N 0 1 323.371 4.354 20 0 DIADMN C[C@H]1CC(F)(F)CCN1Cc1cnc(-c2ccccc2)s1 ZINC001328893306 1053957919 /nfs/dbraw/zinc/95/79/19/1053957919.db2.gz XVQNIRGGTPMNLE-LBPRGKRZSA-N 0 1 308.397 4.430 20 0 DIADMN Cc1ccc(CN2CCC(c3ccc(F)cc3F)CC2)c(C)n1 ZINC001232082606 1053959880 /nfs/dbraw/zinc/95/98/80/1053959880.db2.gz ABOCJDVOZFJZDD-UHFFFAOYSA-N 0 1 316.395 4.356 20 0 DIADMN CSc1cc(NC(=O)c2cccc(F)c2O)ccc1Cl ZINC001436754875 1053965498 /nfs/dbraw/zinc/96/54/98/1053965498.db2.gz GHPYQISTZFPAQH-UHFFFAOYSA-N 0 1 311.765 4.159 20 0 DIADMN CSCCN(C)Cc1cc(F)ccc1OCc1ccccc1 ZINC001232119249 1053969881 /nfs/dbraw/zinc/96/98/81/1053969881.db2.gz QKOHJQOOXXYKQK-UHFFFAOYSA-N 0 1 319.445 4.200 20 0 DIADMN Brc1[nH]c2ccccc2c1CN1CC2(C1)CCCC2 ZINC001232141246 1053971797 /nfs/dbraw/zinc/97/17/97/1053971797.db2.gz LTESBHXRCZSCKV-UHFFFAOYSA-N 0 1 319.246 4.306 20 0 DIADMN COc1ccnc(Cl)c1CN(C)C12CC3CC(CC(C3)C1)C2 ZINC001232153533 1053975424 /nfs/dbraw/zinc/97/54/24/1053975424.db2.gz QDWNTDYEKIYTRA-UHFFFAOYSA-N 0 1 320.864 4.144 20 0 DIADMN Fc1cc(CN[C@@H](c2ccccc2F)C2CCCC2)ccn1 ZINC001329274861 1053977838 /nfs/dbraw/zinc/97/78/38/1053977838.db2.gz XEFKPGAVWGJVQU-GOSISDBHSA-N 0 1 302.368 4.381 20 0 DIADMN Cc1cnc(CN2CCCCCCCC2)c(Br)c1 ZINC001232178495 1053979545 /nfs/dbraw/zinc/97/95/45/1053979545.db2.gz WJZNBAXXZVDBGC-UHFFFAOYSA-N 0 1 311.267 4.309 20 0 DIADMN Cc1cc(CN[C@@H](c2nc3ccccc3[nH]2)C2CCCCC2)[nH]n1 ZINC001329293230 1053979548 /nfs/dbraw/zinc/97/95/48/1053979548.db2.gz SSUNJDOLVHMBMM-GOSISDBHSA-N 0 1 323.444 4.006 20 0 DIADMN CC(C)[C@H](N[C@@H]1CCCc2cnn(C(C)C)c21)c1ccccn1 ZINC001329376095 1053987420 /nfs/dbraw/zinc/98/74/20/1053987420.db2.gz QMUKBBRANLJLDQ-MSOLQXFVSA-N 0 1 312.461 4.223 20 0 DIADMN CC(C)[C@@H](N[C@@H]1CCCc2cnn(C(C)C)c21)c1ccccn1 ZINC001329376096 1053987770 /nfs/dbraw/zinc/98/77/70/1053987770.db2.gz QMUKBBRANLJLDQ-QZTJIDSGSA-N 0 1 312.461 4.223 20 0 DIADMN Cc1scnc1CN1CCC(n2ccc3ccccc32)CC1 ZINC001232206044 1053988739 /nfs/dbraw/zinc/98/87/39/1053988739.db2.gz ANLBIFPQQKLGSU-UHFFFAOYSA-N 0 1 311.454 4.243 20 0 DIADMN COc1ccccc1CN(C)Cc1ccnc2c(F)cccc12 ZINC001232209520 1053989256 /nfs/dbraw/zinc/98/92/56/1053989256.db2.gz NWEZICLILOXUPI-UHFFFAOYSA-N 0 1 310.372 4.015 20 0 DIADMN Fc1cccc2c(CN3CCC[C@H]3c3cccnc3)ccnc12 ZINC001232207460 1053989570 /nfs/dbraw/zinc/98/95/70/1053989570.db2.gz JHNXONHNVCGHGA-SFHVURJKSA-N 0 1 307.372 4.106 20 0 DIADMN COc1ccccc1/C=C\CN[C@@H](c1ncc(C)s1)C1CC1 ZINC001200803525 1053990399 /nfs/dbraw/zinc/99/03/99/1053990399.db2.gz UFJOACITMYPWLJ-XTKXOIQPSA-N 0 1 314.454 4.214 20 0 DIADMN CC(C)(C)c1cc(CN2CCC(C(F)(F)F)CC2)ccn1 ZINC001232214798 1053994072 /nfs/dbraw/zinc/99/40/72/1053994072.db2.gz ZDILAIMAAAFRMV-UHFFFAOYSA-N 0 1 300.368 4.153 20 0 DIADMN CCCCCN(Cc1ccc(F)cc1)Cc1nccnc1C ZINC000621709782 1053996478 /nfs/dbraw/zinc/99/64/78/1053996478.db2.gz DPZJTQRGHCUIGL-UHFFFAOYSA-N 0 1 301.409 4.117 20 0 DIADMN F[C@@H]1CCN(Cc2cccn2Cc2ccccc2)CCC1(F)F ZINC001232232058 1053998876 /nfs/dbraw/zinc/99/88/76/1053998876.db2.gz KHGBMVSBHLQKGE-QGZVFWFLSA-N 0 1 322.374 4.106 20 0 DIADMN c1cc(CN2CCc3ccccc3C2)n(Cc2ccccc2)c1 ZINC001232232349 1054000191 /nfs/dbraw/zinc/00/01/91/1054000191.db2.gz OBXHVYYECWSZGL-UHFFFAOYSA-N 0 1 302.421 4.095 20 0 DIADMN Cc1nccnc1CN1CCCCC[C@@H]1/C=C\c1cccs1 ZINC000621722048 1054000216 /nfs/dbraw/zinc/00/02/16/1054000216.db2.gz JOOYSPDKFQZMCW-HLRDLLSLSA-N 0 1 313.470 4.305 20 0 DIADMN c1cc(CN2CCC[C@H]2c2ccncc2)n(Cc2ccccc2)c1 ZINC001232232815 1054000291 /nfs/dbraw/zinc/00/02/91/1054000291.db2.gz VVHJWGJQTGCCPQ-NRFANRHFSA-N 0 1 317.436 4.269 20 0 DIADMN CCOc1cncc(CN(C)[C@H](CC)c2ccccc2OC)c1 ZINC000621728245 1054000542 /nfs/dbraw/zinc/00/05/42/1054000542.db2.gz HWWOHSRFYCZOCB-GOSISDBHSA-N 0 1 314.429 4.072 20 0 DIADMN F[C@H]1CCN(Cc2cccn2Cc2ccccc2)CCC1(F)F ZINC001232232056 1054000645 /nfs/dbraw/zinc/00/06/45/1054000645.db2.gz KHGBMVSBHLQKGE-KRWDZBQOSA-N 0 1 322.374 4.106 20 0 DIADMN Cc1nccnc1CN1CC2(CCCCC2)[C@@H]1c1ccccc1 ZINC000621731551 1054001523 /nfs/dbraw/zinc/00/15/23/1054001523.db2.gz SEWBFBGLBHIAFX-IBGZPJMESA-N 0 1 307.441 4.292 20 0 DIADMN Cc1ccc(C)c([C@H](C)N(C)CC(=O)N2[C@H](C)CCC[C@H]2C)c1 ZINC000621731079 1054001546 /nfs/dbraw/zinc/00/15/46/1054001546.db2.gz XJSUHCPHXOOGDX-KURKYZTESA-N 0 1 316.489 4.086 20 0 DIADMN C[N@@H+](Cc1ccnc(C(F)(F)F)c1)[C@@H]1CCc2ccccc21 ZINC001232242691 1054002003 /nfs/dbraw/zinc/00/20/03/1054002003.db2.gz FKZGXWOPOQFPLF-OAHLLOKOSA-N 0 1 306.331 4.220 20 0 DIADMN FC(F)(F)c1cc(CN2CC[C@@H](Cc3ccccc3)C2)ccn1 ZINC001232241482 1054002891 /nfs/dbraw/zinc/00/28/91/1054002891.db2.gz PUZLLTHVGNOCGY-INIZCTEOSA-N 0 1 320.358 4.165 20 0 DIADMN COc1ccc([C@H](C)N(C)Cc2ccnc(C(F)(F)F)c2)cc1 ZINC001232240387 1054003062 /nfs/dbraw/zinc/00/30/62/1054003062.db2.gz FWTZIYNGOLWPSW-LBPRGKRZSA-N 0 1 324.346 4.302 20 0 DIADMN CN(C/C=C/c1ccccc1)Cc1ccnc(C(F)(F)F)c1 ZINC001232239892 1054004278 /nfs/dbraw/zinc/00/42/78/1054004278.db2.gz AZJDMMCBVUOMIO-VMPITWQZSA-N 0 1 306.331 4.246 20 0 DIADMN COc1ccccc1[C@H](C)N(C)Cc1nccc2ccccc21 ZINC001232252658 1054004656 /nfs/dbraw/zinc/00/46/56/1054004656.db2.gz WUOGIRHDNYSKKL-HNNXBMFYSA-N 0 1 306.409 4.436 20 0 DIADMN CCc1sc(CN2CCC[C@H](F)CC2)cc1Br ZINC001232286370 1054014620 /nfs/dbraw/zinc/01/46/20/1054014620.db2.gz FEAZAZBBOFXRAI-JTQLQIEISA-N 0 1 320.271 4.397 20 0 DIADMN COc1ccc(F)c(CN[C@@H]2CCCc3c4ccccc4[nH]c32)c1 ZINC000621766374 1054011706 /nfs/dbraw/zinc/01/17/06/1054011706.db2.gz RCXLPCWYXKUOAG-LJQANCHMSA-N 0 1 324.399 4.483 20 0 DIADMN COc1ccc(F)c(CN[C@H]2CCCOc3ccc(C)cc32)c1 ZINC000621766031 1054011795 /nfs/dbraw/zinc/01/17/95/1054011795.db2.gz KQRCFODOSVEHKO-SFHVURJKSA-N 0 1 315.388 4.146 20 0 DIADMN CCc1nc2c(s1)[C@@H](NCc1cc(OC)ccc1F)CCC2 ZINC000621766713 1054011817 /nfs/dbraw/zinc/01/18/17/1054011817.db2.gz ZZYCHAUWNUAFNP-AWEZNQCLSA-N 0 1 320.433 4.020 20 0 DIADMN CCc1sc(CN2CCC3(CC3)C2)cc1Br ZINC001232287145 1054012111 /nfs/dbraw/zinc/01/21/11/1054012111.db2.gz MRNJBXBFBASCIT-UHFFFAOYSA-N 0 1 300.265 4.059 20 0 DIADMN Oc1cccc(C2CCN(Cc3cc(Cl)cs3)CC2)c1 ZINC001232282950 1054013764 /nfs/dbraw/zinc/01/37/64/1054013764.db2.gz GVJFVIRYZMRYFP-UHFFFAOYSA-N 0 1 307.846 4.487 20 0 DIADMN CCOc1ncc(CN2CCC(c3cccs3)CC2)cc1C ZINC001232305925 1054017424 /nfs/dbraw/zinc/01/74/24/1054017424.db2.gz JVHQTDNDDAZABO-UHFFFAOYSA-N 0 1 316.470 4.230 20 0 DIADMN COc1cc(C[N@@H+](C)Cc2cccc(C)c2)c(OC)cc1Cl ZINC001232370314 1054031384 /nfs/dbraw/zinc/03/13/84/1054031384.db2.gz NJWKDRBRFQVWME-UHFFFAOYSA-N 0 1 319.832 4.298 20 0 DIADMN COc1cc(CN(C)Cc2cccc(C)c2)c(OC)cc1Cl ZINC001232370314 1054031399 /nfs/dbraw/zinc/03/13/99/1054031399.db2.gz NJWKDRBRFQVWME-UHFFFAOYSA-N 0 1 319.832 4.298 20 0 DIADMN Cc1cccc(CN(C)Cc2cncc(Br)c2C)c1 ZINC001232527668 1054062915 /nfs/dbraw/zinc/06/29/15/1054062915.db2.gz LWBIIZLQTWZKHF-UHFFFAOYSA-N 0 1 319.246 4.093 20 0 DIADMN CCOc1ccc(OC)cc1CN(CC)Cc1ccc(F)cc1 ZINC001232385338 1054034268 /nfs/dbraw/zinc/03/42/68/1054034268.db2.gz NGYMANJDGKELPF-UHFFFAOYSA-N 0 1 317.404 4.255 20 0 DIADMN COc1cccc(CN(C)Cc2cccc(C)c2OC(C)C)c1 ZINC001232392239 1054035932 /nfs/dbraw/zinc/03/59/32/1054035932.db2.gz RTFHRSYZMFCHJZ-UHFFFAOYSA-N 0 1 313.441 4.423 20 0 DIADMN Cc1ccc(OC(C)C)c(CN2CC[C@@H](F)C(F)(F)CC2)c1 ZINC001232394393 1054038088 /nfs/dbraw/zinc/03/80/88/1054038088.db2.gz OWHXXZNBEZMIEV-MRXNPFEDSA-N 0 1 315.379 4.351 20 0 DIADMN Cc1ccc(OC(C)C)c(CN2CCc3ccsc3C2)c1 ZINC001232398052 1054040559 /nfs/dbraw/zinc/04/05/59/1054040559.db2.gz XVBMBSBQWVDPAC-UHFFFAOYSA-N 0 1 301.455 4.402 20 0 DIADMN Cc1cccc(CN2CCSCC2)c1OCc1ccccc1 ZINC001232397994 1054040991 /nfs/dbraw/zinc/04/09/91/1054040991.db2.gz PXYKVOXLAPWOFX-UHFFFAOYSA-N 0 1 313.466 4.123 20 0 DIADMN Cc1c(F)cc(CN2CCC(Cc3ccncc3)CC2)cc1F ZINC001232427872 1054043550 /nfs/dbraw/zinc/04/35/50/1054043550.db2.gz WLWLDGPQIVUDSU-UHFFFAOYSA-N 0 1 316.395 4.123 20 0 DIADMN CC(C)(C)c1n[nH]cc1CNCc1ccc(C(F)(F)F)s1 ZINC001330639058 1054045060 /nfs/dbraw/zinc/04/50/60/1054045060.db2.gz NUDRRXLLILTAAR-UHFFFAOYSA-N 0 1 317.380 4.077 20 0 DIADMN C=Cc1ccccc1NC(=O)N(C)Cc1cc(C(C)(C)C)[nH]n1 ZINC001330739681 1054049196 /nfs/dbraw/zinc/04/91/96/1054049196.db2.gz YYSHFMOYABVCFB-UHFFFAOYSA-N 0 1 312.417 4.014 20 0 DIADMN CCc1csc(CN2CCC(c3cccc(OC)c3)CC2)n1 ZINC001232476861 1054053148 /nfs/dbraw/zinc/05/31/48/1054053148.db2.gz FVBLRTBDQHCYBU-UHFFFAOYSA-N 0 1 316.470 4.094 20 0 DIADMN CCc1csc(CN2CCC(Cc3ccc(F)cc3)CC2)n1 ZINC001232475255 1054054751 /nfs/dbraw/zinc/05/47/51/1054054751.db2.gz KZGGLSLGHBTNNK-UHFFFAOYSA-N 0 1 318.461 4.299 20 0 DIADMN Fc1ccnc(CN2CC[C@H](c3cccc(C(F)(F)F)c3)C2)c1 ZINC001232496358 1054056211 /nfs/dbraw/zinc/05/62/11/1054056211.db2.gz RQZDDNLKQGGDHC-ZDUSSCGKSA-N 0 1 324.321 4.229 20 0 DIADMN C[C@@H](NC[C@H]1CC2(CCC2)CO1)c1nc(C(C)(C)C)cs1 ZINC001331111500 1054061195 /nfs/dbraw/zinc/06/11/95/1054061195.db2.gz VSAVSBWBNOAZEI-CHWSQXEVSA-N 0 1 308.491 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Cc1cccc(-c2nnc(-c3cc4cc(Cl)c[nH]c-4n3)o2)c1 ZINC001253619768 1061939940 /nfs/dbraw/zinc/93/99/40/1061939940.db2.gz ARNVAEIOSOXYAM-UHFFFAOYSA-N 0 1 310.744 4.242 20 0 DIADMN Fc1cc(F)c(S[C@@H]2CCN(Cc3ccccc3)C2)c(F)c1 ZINC001458910972 1061940791 /nfs/dbraw/zinc/94/07/91/1061940791.db2.gz JQUDUOZLPSXQSI-CQSZACIVSA-N 0 1 323.383 4.471 20 0 DIADMN CC(C)[C@@H](O)CCSc1nc2ccc(C(F)(F)F)cc2[nH]1 ZINC001458927414 1061945574 /nfs/dbraw/zinc/94/55/74/1061945574.db2.gz YXYOUDJPKNEVIM-LBPRGKRZSA-N 0 1 318.364 4.081 20 0 DIADMN FC(F)(F)c1ccc2nc(S[C@H]3CCSC3)[nH]c2c1 ZINC001458921395 1061945642 /nfs/dbraw/zinc/94/56/42/1061945642.db2.gz NUUKVXXXLVJIEL-QMMMGPOBSA-N 0 1 304.362 4.179 20 0 DIADMN Cc1cccc(-c2nnc([C@H]3CCCN3Cc3ccccc3)o2)c1 ZINC001253661169 1061946358 /nfs/dbraw/zinc/94/63/58/1061946358.db2.gz RBRGWJXRVKFLBN-GOSISDBHSA-N 0 1 319.408 4.382 20 0 DIADMN CCC[C@@H]1CCCN(Cc2c(C(C)C)nc3sc(C)nn23)C1 ZINC001474344441 1061948106 /nfs/dbraw/zinc/94/81/06/1061948106.db2.gz KOYVMOJCCWMJJC-CQSZACIVSA-N 0 1 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311.429 4.002 20 0 DIADMN CC[C@H](C(=O)NCc1ccc2nc[nH]c2c1)C1CCC(C)CC1 ZINC001468257730 1062288008 /nfs/dbraw/zinc/28/80/08/1062288008.db2.gz RSBREUSLPMCDPO-BCLQGDPASA-N 0 1 313.445 4.032 20 0 DIADMN CC[C@@H](C(=O)NCc1ccc2nc[nH]c2c1)C1CCC(C)CC1 ZINC001468257729 1062288051 /nfs/dbraw/zinc/28/80/51/1062288051.db2.gz RSBREUSLPMCDPO-AVVWSFFYSA-N 0 1 313.445 4.032 20 0 DIADMN CCOC(=O)c1ccc(CNCc2ccc(C)c3ccccc23)o1 ZINC001474580829 1062289373 /nfs/dbraw/zinc/28/93/73/1062289373.db2.gz FCLWCNYIUDKSOI-UHFFFAOYSA-N 0 1 323.392 4.208 20 0 DIADMN CCOc1ccc(CN2CCC[C@@H](CC(F)(F)F)C2)cc1F ZINC001474589588 1062298853 /nfs/dbraw/zinc/29/88/53/1062298853.db2.gz WGGQQUORATZFQK-ZDUSSCGKSA-N 0 1 319.342 4.389 20 0 DIADMN CCc1ccc(S(=O)(=O)Nc2csc3ccccc23)cc1 ZINC001255023217 1062301307 /nfs/dbraw/zinc/30/13/07/1062301307.db2.gz WUCMOBSRZPHLEX-UHFFFAOYSA-N 0 1 317.435 4.265 20 0 DIADMN O=C1CCCC[C@]1(NC1CCSCC1)c1ccccc1Cl ZINC001255083473 1062308081 /nfs/dbraw/zinc/30/80/81/1062308081.db2.gz VJYHVBCETBMWJW-KRWDZBQOSA-N 0 1 323.889 4.164 20 0 DIADMN CCC(=O)c1ccc(O)c(NC(=O)[C@H]2CCCC[C@H]2C2CC2)c1 ZINC001468410366 1062315593 /nfs/dbraw/zinc/31/55/93/1062315593.db2.gz ZMRIOYWXQLGCBB-GJZGRUSLSA-N 0 1 315.413 4.140 20 0 DIADMN CCC(=O)c1ccc(O)c(NC(=O)[C@@H]2CCCC[C@H]2C2CC2)c1 ZINC001468410368 1062316186 /nfs/dbraw/zinc/31/61/86/1062316186.db2.gz ZMRIOYWXQLGCBB-LSDHHAIUSA-N 0 1 315.413 4.140 20 0 DIADMN CCN(Cc1ccc(Cl)c(C)c1Cl)[C@H]1CCCOC1 ZINC001474613481 1062331990 /nfs/dbraw/zinc/33/19/90/1062331990.db2.gz FOMNCAXUDLRCMA-ZDUSSCGKSA-N 0 1 302.245 4.303 20 0 DIADMN CCCN1CCCC[C@H]1C(=O)Nc1cccc(C2CCC2)c1 ZINC001468516705 1062337955 /nfs/dbraw/zinc/33/79/55/1062337955.db2.gz WXACGIFQIPBPJO-SFHVURJKSA-N 0 1 300.446 4.157 20 0 DIADMN COc1ccc(F)cc1CN(C)[C@H](C)CSc1ccccc1 ZINC001474616914 1062338317 /nfs/dbraw/zinc/33/83/17/1062338317.db2.gz SCWRVNPLLQGBJH-CQSZACIVSA-N 0 1 319.445 4.447 20 0 DIADMN O=C(NCC1=CCCCC1)c1cc(Cl)c2ccccc2c1O ZINC001468535647 1062342054 /nfs/dbraw/zinc/34/20/54/1062342054.db2.gz XXUVJJHPLSHXGC-UHFFFAOYSA-N 0 1 315.800 4.429 20 0 DIADMN Cc1cc(CN(C)C2c3ccccc3-c3ccccc32)c(C)nn1 ZINC001459732295 1062342899 /nfs/dbraw/zinc/34/28/99/1062342899.db2.gz MLCNFDZDXQBHFJ-UHFFFAOYSA-N 0 1 315.420 4.295 20 0 DIADMN Cn1cccc1[C@H]1CCCN1CCSc1ccc(F)cc1F ZINC001459730790 1062343003 /nfs/dbraw/zinc/34/30/03/1062343003.db2.gz NJPWHEKTHMMTQY-MRXNPFEDSA-N 0 1 322.424 4.233 20 0 DIADMN CCOc1cc(CN2CCC(C3CCC3)CC2)cc(Cl)c1O ZINC001474619250 1062343454 /nfs/dbraw/zinc/34/34/54/1062343454.db2.gz RLDDUMKAQUTHJE-UHFFFAOYSA-N 0 1 323.864 4.456 20 0 DIADMN Cc1cc(CN2CC(Cc3ccco3)C2)ccc1C(F)(F)F ZINC001474625525 1062345083 /nfs/dbraw/zinc/34/50/83/1062345083.db2.gz CPSBDMBUMBSKEB-UHFFFAOYSA-N 0 1 309.331 4.281 20 0 DIADMN FCC[C@@H]1CCCN(Cc2ccc(F)cc2C(F)(F)F)C1 ZINC001474627190 1062346233 /nfs/dbraw/zinc/34/62/33/1062346233.db2.gz DYVSGMYKUKDDQT-NSHDSACASA-N 0 1 307.306 4.416 20 0 DIADMN Cc1ccc(CC2CN(C/C=C\c3ccc(F)cc3F)C2)cc1 ZINC001474631589 1062354613 /nfs/dbraw/zinc/35/46/13/1062354613.db2.gz KJEREOBNTZGJTD-IHWYPQMZSA-N 0 1 313.391 4.461 20 0 DIADMN Brc1cc2c(s1)CCN(C[C@@H]1CC=CCC1)C2 ZINC001474630335 1062355458 /nfs/dbraw/zinc/35/54/58/1062355458.db2.gz KBBRKLBGTSUWPV-LLVKDONJSA-N 0 1 312.276 4.225 20 0 DIADMN Cc1cc2c[nH]nc2c(C(=O)N2CC[C@@H](C(C)(C)C)C[C@H]2C)c1 ZINC001468610616 1062363932 /nfs/dbraw/zinc/36/39/32/1062363932.db2.gz YQGXCSGILNNNPX-UKRRQHHQSA-N 0 1 313.445 4.158 20 0 DIADMN CCN(C(=O)c1cc(-c2c[nH]c3ccccc23)[nH]n1)[C@H](C)C(C)C ZINC001468653126 1062368838 /nfs/dbraw/zinc/36/88/38/1062368838.db2.gz OTLSTBQGQDQLEQ-CYBMUJFWSA-N 0 1 324.428 4.065 20 0 DIADMN C[C@@]1(c2ccccc2)CN(CC2CCC(F)(F)CC2)CCO1 ZINC001459758862 1062370191 /nfs/dbraw/zinc/37/01/91/1062370191.db2.gz YQJPQODMSYUDJO-KRWDZBQOSA-N 0 1 309.400 4.060 20 0 DIADMN C[C@@]1(c2ccccc2)CN(CC[C@@H]2CCCC2(F)F)CCO1 ZINC001459757061 1062372407 /nfs/dbraw/zinc/37/24/07/1062372407.db2.gz QOMAYWVRZSREDB-IRXDYDNUSA-N 0 1 309.400 4.060 20 0 DIADMN CN(C)c1ccccc1CN(Cc1ccccc1F)C1CCC1 ZINC001459765236 1062374565 /nfs/dbraw/zinc/37/45/65/1062374565.db2.gz YCHYBGHNGBUGKT-UHFFFAOYSA-N 0 1 312.432 4.446 20 0 DIADMN CN(Cc1cnn(Cc2ccccc2)c1Cl)C[C@H]1CC1(C)C ZINC001474647550 1062374516 /nfs/dbraw/zinc/37/45/16/1062374516.db2.gz MPILCZPHXNPJAX-MRXNPFEDSA-N 0 1 317.864 4.063 20 0 DIADMN CCSc1cccc(CNC(=O)c2ccc(Cl)c(O)c2)c1 ZINC001468681198 1062377034 /nfs/dbraw/zinc/37/70/34/1062377034.db2.gz HWHCPJSJKPMWQN-UHFFFAOYSA-N 0 1 321.829 4.088 20 0 DIADMN CCCCOC(=O)[C@H](C)N1CCC[C@H]1CCCc1ccccc1 ZINC001459768836 1062381689 /nfs/dbraw/zinc/38/16/89/1062381689.db2.gz PFUWGGCUDQVCLK-PKOBYXMFSA-N 0 1 317.473 4.206 20 0 DIADMN Cc1cc(Cl)cc(CN2CC[C@@H](O)C[C@@H]2c2ccccc2)c1 ZINC001474657333 1062390623 /nfs/dbraw/zinc/39/06/23/1062390623.db2.gz SJMIEZYINXFFPY-RTBURBONSA-N 0 1 315.844 4.346 20 0 DIADMN CCCC[C@@H](C)NC1(c2ccc(C(F)(F)F)cc2)COC1 ZINC001255314231 1062391445 /nfs/dbraw/zinc/39/14/45/1062391445.db2.gz YXYPFFKINJURJO-GFCCVEGCSA-N 0 1 301.352 4.099 20 0 DIADMN CCCC[C@@H](C)NCc1ncc(Cl)cc1Br ZINC001255314977 1062392342 /nfs/dbraw/zinc/39/23/42/1062392342.db2.gz YNSOAZUVJLTQFS-SECBINFHSA-N 0 1 305.647 4.166 20 0 DIADMN CCc1ccccc1CCN(C)Cc1nc(-c2ccccc2)c[nH]1 ZINC001459798653 1062408541 /nfs/dbraw/zinc/40/85/41/1062408541.db2.gz UADCMLFLBOOTMD-UHFFFAOYSA-N 0 1 319.452 4.314 20 0 DIADMN CC(C)CCc1noc(CN[C@@H]2CCCC[C@@H]2C(C)(C)C)n1 ZINC001459807645 1062412845 /nfs/dbraw/zinc/41/28/45/1062412845.db2.gz ZGUVDOITMMFIPD-LSDHHAIUSA-N 0 1 307.482 4.353 20 0 DIADMN CC(C)CCc1noc(CN[C@H]2CCCC[C@H]2C(C)(C)C)n1 ZINC001459807635 1062413549 /nfs/dbraw/zinc/41/35/49/1062413549.db2.gz ZGUVDOITMMFIPD-CABCVRRESA-N 0 1 307.482 4.353 20 0 DIADMN C[C@@H]1CCC(C)(C)N1C(=O)c1cc(-c2cccc(Cl)c2)[nH]n1 ZINC001468822857 1062414518 /nfs/dbraw/zinc/41/45/18/1062414518.db2.gz FTKOYYISJCIVQA-LLVKDONJSA-N 0 1 317.820 4.133 20 0 DIADMN Cc1cc(Cl)ccc1-c1nnc(-c2c(O)ccc(F)c2F)o1 ZINC001255356556 1062415248 /nfs/dbraw/zinc/41/52/48/1062415248.db2.gz WCHOQTDJSAZTRP-UHFFFAOYSA-N 0 1 322.698 4.349 20 0 DIADMN Cc1cc(Cl)ccc1-c1nnc(-c2cc(O)c(F)c(F)c2)o1 ZINC001255355830 1062415675 /nfs/dbraw/zinc/41/56/75/1062415675.db2.gz OWMFKRBQJIHWSI-UHFFFAOYSA-N 0 1 322.698 4.349 20 0 DIADMN COc1cccc2c1OCCC[C@H]2NCc1coc2ccccc12 ZINC001474688165 1062419476 /nfs/dbraw/zinc/41/94/76/1062419476.db2.gz UKHCBEJYWUOZMM-QGZVFWFLSA-N 0 1 323.392 4.445 20 0 DIADMN C[C@@H](CCc1ccsc1)NCc1noc2c1CC(C)(C)CC2 ZINC001474693229 1062421615 /nfs/dbraw/zinc/42/16/15/1062421615.db2.gz JQCKHRWUBGAHJI-ZDUSSCGKSA-N 0 1 318.486 4.362 20 0 DIADMN C[C@@H](NCCOCc1ccccc1)c1cc(Cl)ccc1F ZINC001459817714 1062422387 /nfs/dbraw/zinc/42/23/87/1062422387.db2.gz PQILBTUKMXSAJK-CYBMUJFWSA-N 0 1 307.796 4.347 20 0 DIADMN C[C@@H]1CCN(Cc2nc3cc(Cl)ccc3n2C)CC12CCC2 ZINC001459817301 1062423041 /nfs/dbraw/zinc/42/30/41/1062423041.db2.gz LQSHLOBQVZBPIF-CYBMUJFWSA-N 0 1 317.864 4.239 20 0 DIADMN Fc1ccc(CCCNc2ccc3c(n2)CCCC3)cc1F ZINC001474695971 1062424206 /nfs/dbraw/zinc/42/42/06/1062424206.db2.gz AHAQDXRGLHOWQR-UHFFFAOYSA-N 0 1 302.368 4.283 20 0 DIADMN C[C@@H](CCO)N(Cc1ccccc1)Cc1ccccc1Cl ZINC001459822684 1062427841 /nfs/dbraw/zinc/42/78/41/1062427841.db2.gz XRLIKCIIVYMPIP-HNNXBMFYSA-N 0 1 303.833 4.113 20 0 DIADMN C[C@@H](CCO)N(Cc1ccccc1)Cc1cc(Cl)ccc1F ZINC001459822735 1062427933 /nfs/dbraw/zinc/42/79/33/1062427933.db2.gz YUOACZWPYZEFEW-AWEZNQCLSA-N 0 1 321.823 4.252 20 0 DIADMN CCc1ccc2ccccc2c1CNCc1cccc(OC)n1 ZINC001474702903 1062429523 /nfs/dbraw/zinc/42/95/23/1062429523.db2.gz RTLGOISCXVLQPY-UHFFFAOYSA-N 0 1 306.409 4.096 20 0 DIADMN COC(=O)c1cccc(CN2CC[C@@H](C)C3(CCC3)C2)c1Cl ZINC001459826355 1062430761 /nfs/dbraw/zinc/43/07/61/1062430761.db2.gz QBGVPURNZGLFPN-CYBMUJFWSA-N 0 1 321.848 4.139 20 0 DIADMN CCCCN(Cc1c(C)oc(C)c1C)Cc1c(C)ccnc1N ZINC001474718491 1062444422 /nfs/dbraw/zinc/44/44/22/1062444422.db2.gz LRQNYCRFPNYZEM-UHFFFAOYSA-N 0 1 315.461 4.293 20 0 DIADMN CC[C@@H](NCc1ccc2c(c1)COC2)c1ccc(F)cc1F ZINC001459842962 1062444553 /nfs/dbraw/zinc/44/45/53/1062444553.db2.gz IZMYNGNWDVGFGL-GOSISDBHSA-N 0 1 303.352 4.236 20 0 DIADMN CC[C@@H](NCc1ccc2c(c1)COC2)c1cc(F)ccc1F ZINC001459845604 1062445100 /nfs/dbraw/zinc/44/51/00/1062445100.db2.gz SCHOLSMKOKUXEP-GOSISDBHSA-N 0 1 303.352 4.236 20 0 DIADMN [O-]c1cc(F)c(CC[NH2+][C@H]2CCC[C@H]2c2ccccc2)c(F)c1 ZINC001474722588 1062447097 /nfs/dbraw/zinc/44/70/97/1062447097.db2.gz ZZWRFDSKJJJYIY-KXBFYZLASA-N 0 1 317.379 4.139 20 0 DIADMN CCOc1ccc(CCN(C)Cc2cscc2Cl)cc1 ZINC001474743916 1062459567 /nfs/dbraw/zinc/45/95/67/1062459567.db2.gz ZMRZELPKWAQURC-UHFFFAOYSA-N 0 1 309.862 4.475 20 0 DIADMN CCC[C@@H]1CCCC[C@H]1CNC(=O)c1cccc2nc(C)[nH]c21 ZINC001469014587 1062461341 /nfs/dbraw/zinc/46/13/41/1062461341.db2.gz ANDNHHJJHQDEAZ-CABCVRRESA-N 0 1 313.445 4.208 20 0 DIADMN CCC[C@@H]1CCCC[C@@H]1CNC(=O)c1ccc(O)c(Cl)c1 ZINC001469017746 1062463405 /nfs/dbraw/zinc/46/34/05/1062463405.db2.gz ZRZLCMHVJOSNTD-TZMCWYRMSA-N 0 1 309.837 4.382 20 0 DIADMN CSc1ncc2c(n1)CN(C1CCC(C(C)(C)C)CC1)CC2 ZINC001255505150 1062464839 /nfs/dbraw/zinc/46/48/39/1062464839.db2.gz BSKOBGAYGMNLDO-UHFFFAOYSA-N 0 1 319.518 4.162 20 0 DIADMN CCOCc1noc2c1C[N@H+](C1CCC(C(C)(C)C)CC1)CC2 ZINC001255502266 1062465002 /nfs/dbraw/zinc/46/50/02/1062465002.db2.gz BUVXMBNWHZLJNM-UHFFFAOYSA-N 0 1 320.477 4.174 20 0 DIADMN CCOCc1noc2c1CN(C1CCC(C(C)(C)C)CC1)CC2 ZINC001255502266 1062465011 /nfs/dbraw/zinc/46/50/11/1062465011.db2.gz BUVXMBNWHZLJNM-UHFFFAOYSA-N 0 1 320.477 4.174 20 0 DIADMN CCN(C)[C@H](C(=O)N[C@@H](C)[C@H]1CCC[C@@H](C)C1)c1ccccc1 ZINC001469046829 1062468090 /nfs/dbraw/zinc/46/80/90/1062468090.db2.gz UGSRIGLCDXAHCN-NEPXVJNWSA-N 0 1 316.489 4.010 20 0 DIADMN COc1ccc2c(c1)CCN(Cc1cccc(F)c1Cl)CC2 ZINC001459883192 1062468969 /nfs/dbraw/zinc/46/89/69/1062468969.db2.gz ONADWJBNSHCCDM-UHFFFAOYSA-N 0 1 319.807 4.089 20 0 DIADMN CCOC(=O)CN(C[C@H](C)CC(C)C)[C@@H](C)c1ccccc1 ZINC001459888351 1062472572 /nfs/dbraw/zinc/47/25/72/1062472572.db2.gz FYMMLCFKZNNUDS-SJORKVTESA-N 0 1 305.462 4.295 20 0 DIADMN 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4.390 20 0 DIADMN C[C@H](Cc1ccc(Cl)cc1)N(C)Cc1nc2c(o1)CCCC2 ZINC001473164507 1063469619 /nfs/dbraw/zinc/46/96/19/1063469619.db2.gz SSOQVUUYPPQQMR-CYBMUJFWSA-N 0 1 318.848 4.270 20 0 DIADMN Cc1ccc(NC(=O)CN2C[C@H](C)CCC[C@H]2C)c(Cl)c1 ZINC001473172899 1063476430 /nfs/dbraw/zinc/47/64/30/1063476430.db2.gz HUUATRXBYLCXOZ-ZIAGYGMSSA-N 0 1 308.853 4.097 20 0 DIADMN COc1ccnc(NCc2ccc(N(C)c3ccccc3)cc2)c1 ZINC001461405670 1063477224 /nfs/dbraw/zinc/47/72/24/1063477224.db2.gz SBXFFAVWPBQJRF-UHFFFAOYSA-N 0 1 319.408 4.470 20 0 DIADMN CCCN(Cc1ncc(C)s1)[C@H]1C[C@H](OCC)C12CCCC2 ZINC001473174871 1063480567 /nfs/dbraw/zinc/48/05/67/1063480567.db2.gz DIAMAYAUAJCLEO-HOTGVXAUSA-N 0 1 322.518 4.401 20 0 DIADMN COC(=O)C1(NC[C@@H]2CC[C@@H](c3ccccc3)C2)CCCCC1 ZINC001473176010 1063482113 /nfs/dbraw/zinc/48/21/13/1063482113.db2.gz RCMCIQRPIXVFRU-SJLPKXTDSA-N 0 1 315.457 4.036 20 0 DIADMN CCc1ccc([C@H]2COCCN2C[C@@H](C)C2CCCCC2)o1 ZINC001473177756 1063482673 /nfs/dbraw/zinc/48/26/73/1063482673.db2.gz NSAMPPBKSKXBCZ-CRAIPNDOSA-N 0 1 305.462 4.432 20 0 DIADMN CCc1ccc([C@@H]2COCCN2C[C@@H](C)C2CCCCC2)o1 ZINC001473177758 1063482796 /nfs/dbraw/zinc/48/27/96/1063482796.db2.gz NSAMPPBKSKXBCZ-QAPCUYQASA-N 0 1 305.462 4.432 20 0 DIADMN Cc1ccc([C@H]2CCCCCN2CCn2cc(Cl)cn2)o1 ZINC001473183355 1063488347 /nfs/dbraw/zinc/48/83/47/1063488347.db2.gz XBVUILCCZPPTKJ-OAHLLOKOSA-N 0 1 307.825 4.055 20 0 DIADMN Cc1ncsc1CCCN1CCc2cccc(F)c2[C@@H]1C ZINC001473182858 1063489093 /nfs/dbraw/zinc/48/90/93/1063489093.db2.gz NFOSTTSPPOFEHJ-ZDUSSCGKSA-N 0 1 304.434 4.143 20 0 DIADMN CCn1cc(CNC(c2ccccc2C)c2ccccc2C)cn1 ZINC001461424738 1063491273 /nfs/dbraw/zinc/49/12/73/1063491273.db2.gz GUGNFXJAWACYLF-UHFFFAOYSA-N 0 1 319.452 4.399 20 0 DIADMN C[C@@H]1CN(CC2CCC(C(C)(C)C)CC2)C[C@@H](C(F)(F)F)O1 ZINC001473185323 1063492470 /nfs/dbraw/zinc/49/24/70/1063492470.db2.gz FSZJFTZHVIDZKR-URGYJCLVSA-N 0 1 321.427 4.491 20 0 DIADMN CC(C)[C@@H]1CCCN1Cc1c(F)cccc1Br ZINC001473184612 1063494935 /nfs/dbraw/zinc/49/49/35/1063494935.db2.gz KEHWUQCJIDJIQI-AWEZNQCLSA-N 0 1 300.215 4.209 20 0 DIADMN Cc1cccc([C@@H]2CCCCN2Cc2n[nH]c(C(C)C)n2)c1C ZINC001473187594 1063497371 /nfs/dbraw/zinc/49/73/71/1063497371.db2.gz RGFLCYCLYQPPNA-KRWDZBQOSA-N 0 1 312.461 4.272 20 0 DIADMN CC(C)(C)c1coc(CN[C@@H]2CC[C@H](Cc3ccccc3)C2)n1 ZINC001461436498 1063502907 /nfs/dbraw/zinc/50/29/07/1063502907.db2.gz QNBKUOQQRLAHJV-IAGOWNOFSA-N 0 1 312.457 4.473 20 0 DIADMN Cc1coc(CN[C@@H]2CCc3c2ccc(F)c3Br)c1 ZINC001461512034 1063545617 /nfs/dbraw/zinc/54/56/17/1063545617.db2.gz COIVRPCLSBWEMA-CQSZACIVSA-N 0 1 324.193 4.267 20 0 DIADMN Fc1cccc(-n2cccn2)c1CNCc1cc(Cl)cs1 ZINC001461512597 1063549062 /nfs/dbraw/zinc/54/90/62/1063549062.db2.gz WKUPPZJHSHMWJJ-UHFFFAOYSA-N 0 1 321.808 4.016 20 0 DIADMN C[C@@H](Cc1ccco1)N1CCc2cc(Br)ccc2C1 ZINC001258186444 1063550770 /nfs/dbraw/zinc/55/07/70/1063550770.db2.gz NQFLYKVPKPBGJE-LBPRGKRZSA-N 0 1 320.230 4.031 20 0 DIADMN Cc1cc(CNc2cc3c(cn2)CCCC3)c2c(n1)CCCC2 ZINC001461537448 1063565607 /nfs/dbraw/zinc/56/56/07/1063565607.db2.gz FONGUGOSVVHWFG-UHFFFAOYSA-N 0 1 307.441 4.155 20 0 DIADMN CCc1cccc(F)c1CNCc1ccc([Si](C)(C)C)cc1 ZINC001461552945 1063578632 /nfs/dbraw/zinc/57/86/32/1063578632.db2.gz LTSZYNRKLQNITC-UHFFFAOYSA-N 0 1 315.508 4.223 20 0 DIADMN c1cc(CNc2ccc3nc(-c4ccccn4)[nH]c3c2)cs1 ZINC001461564883 1063581567 /nfs/dbraw/zinc/58/15/67/1063581567.db2.gz POUAUTDSHVVZBU-UHFFFAOYSA-N 0 1 306.394 4.299 20 0 DIADMN Cc1nc2cc(NC[C@@H]3CCCC[C@@H]3C)ccc2n1[C@@H](C)CO ZINC001461565429 1063582867 /nfs/dbraw/zinc/58/28/67/1063582867.db2.gz OXZVLYZDZJARDK-DZKIICNBSA-N 0 1 315.461 4.136 20 0 DIADMN Cc1nc2cc(NC[C@@H]3CCCC[C@H]3C)ccc2n1[C@H](C)CO ZINC001461565434 1063583210 /nfs/dbraw/zinc/58/32/10/1063583210.db2.gz OXZVLYZDZJARDK-FMKPAKJESA-N 0 1 315.461 4.136 20 0 DIADMN Cc1nc2cc(NCC(C(C)C)C(C)C)ccc2n1[C@H](C)CO ZINC001461570164 1063585530 /nfs/dbraw/zinc/58/55/30/1063585530.db2.gz ILXBNRJEJRRSCO-CQSZACIVSA-N 0 1 317.477 4.238 20 0 DIADMN CC1(C)CCC[C@@H](N2CCc3c([nH]nc3C(F)(F)F)C2)C1 ZINC001258295221 1063593865 /nfs/dbraw/zinc/59/38/65/1063593865.db2.gz YHNBSPVEGLAPPA-MFKMUULPSA-N 0 1 301.356 4.312 20 0 DIADMN CCc1coc(CN[C@H](C)CC(C)(C)SCc2ccco2)n1 ZINC001258298759 1063595650 /nfs/dbraw/zinc/59/56/50/1063595650.db2.gz TWWXCBIBCYPXDS-CYBMUJFWSA-N 0 1 322.474 4.410 20 0 DIADMN C[C@@H](CC(C)(C)SCc1ccco1)N1Cc2cccnc2C1 ZINC001258303485 1063598641 /nfs/dbraw/zinc/59/86/41/1063598641.db2.gz AWSRHXHKUVIXDN-AWEZNQCLSA-N 0 1 316.470 4.481 20 0 DIADMN C[C@@H](CC(C)(C)SCc1ccco1)N(C)Cc1ccon1 ZINC001258314295 1063606075 /nfs/dbraw/zinc/60/60/75/1063606075.db2.gz RWJJHNOFGWACKU-ZDUSSCGKSA-N 0 1 308.447 4.190 20 0 DIADMN Cc1ccnc(NCc2ccc(OC(F)F)cc2)c1C1CC1 ZINC001461614033 1063613740 /nfs/dbraw/zinc/61/37/40/1063613740.db2.gz FDVYKFWEHVSAKA-UHFFFAOYSA-N 0 1 304.340 4.481 20 0 DIADMN CCCn1cncc1CNCc1ccc(-c2cccs2)cc1 ZINC001461618680 1063617592 /nfs/dbraw/zinc/61/75/92/1063617592.db2.gz OJMQJVPTNGGXMR-UHFFFAOYSA-N 0 1 311.454 4.311 20 0 DIADMN CCCCC/C(=C/c1ccccc1)CNCc1cn(CC)nn1 ZINC001461622661 1063618540 /nfs/dbraw/zinc/61/85/40/1063618540.db2.gz YYQKCNAAEJGBCJ-AQTBWJFISA-N 0 1 312.461 4.052 20 0 DIADMN CCCCC(CCCC)NCc1ncc(Br)cn1 ZINC001258380264 1063625088 /nfs/dbraw/zinc/62/50/88/1063625088.db2.gz GROFXCKUILNGJT-UHFFFAOYSA-N 0 1 314.271 4.078 20 0 DIADMN CCCCC(CCCC)N1CC[C@@](O)(C(F)(F)F)[C@H](F)C1 ZINC001258385248 1063629348 /nfs/dbraw/zinc/62/93/48/1063629348.db2.gz RWWHPLIEZCMQBJ-KGLIPLIRSA-N 0 1 313.379 4.073 20 0 DIADMN CCCCC(CCCC)N1Cc2cnn(CC)c2[C@@H](COC)C1 ZINC001258386040 1063629431 /nfs/dbraw/zinc/62/94/31/1063629431.db2.gz QBCMGUXEVKZBFQ-QGZVFWFLSA-N 0 1 321.509 4.198 20 0 DIADMN Cc1ccc2nc(CNC(=O)CC3CCC(C)(C)CC3)[nH]c2c1 ZINC001514923193 1063632009 /nfs/dbraw/zinc/63/20/09/1063632009.db2.gz UAFXETCHJOAVAQ-UHFFFAOYSA-N 0 1 313.445 4.094 20 0 DIADMN CCCn1c(CNCc2cc(C)cc(C)c2)nc2ccccc21 ZINC001461654860 1063638377 /nfs/dbraw/zinc/63/83/77/1063638377.db2.gz UYOVBSZEQFDBCT-UHFFFAOYSA-N 0 1 307.441 4.353 20 0 DIADMN COc1ccc(CC[C@@H](C)N2CCOC3(CCCCC3)C2)cc1 ZINC001258405490 1063639932 /nfs/dbraw/zinc/63/99/32/1063639932.db2.gz GAEVARIYFFEXDG-QGZVFWFLSA-N 0 1 317.473 4.051 20 0 DIADMN CC(C)Cc1ccccc1CNCc1cnc(Cl)c(F)c1 ZINC001461665534 1063645503 /nfs/dbraw/zinc/64/55/03/1063645503.db2.gz WCBUCMHEJPMPER-UHFFFAOYSA-N 0 1 306.812 4.362 20 0 DIADMN Cc1scc(CNCc2c(Cl)cccc2N(C)C)c1C ZINC001461677745 1063652773 /nfs/dbraw/zinc/65/27/73/1063652773.db2.gz SRSDVSQOIAGCAL-UHFFFAOYSA-N 0 1 308.878 4.374 20 0 DIADMN CCCCC[C@@H](CC)N1Cc2c(cnn2CC)[C@H](COCC)C1 ZINC001258439350 1063653598 /nfs/dbraw/zinc/65/35/98/1063653598.db2.gz ITLIPNHXLFAGBG-DLBZAZTESA-N 0 1 321.509 4.198 20 0 DIADMN CC(C)(F)CNCc1cn(-c2ccccc2)nc1C(C)(C)C ZINC001461681035 1063654774 /nfs/dbraw/zinc/65/47/74/1063654774.db2.gz LWKGAYYKXBCDPI-UHFFFAOYSA-N 0 1 303.425 4.008 20 0 DIADMN CC[C@@H](NCc1cc(OC)cnc1F)c1cc(C)ccc1C ZINC001461692432 1063659450 /nfs/dbraw/zinc/65/94/50/1063659450.db2.gz GNYWTVDIVMNTRR-QGZVFWFLSA-N 0 1 302.393 4.087 20 0 DIADMN CC[C@H](NCc1cc(OC)cnc1F)c1cc(C)ccc1C ZINC001461692425 1063660244 /nfs/dbraw/zinc/66/02/44/1063660244.db2.gz GNYWTVDIVMNTRR-KRWDZBQOSA-N 0 1 302.393 4.087 20 0 DIADMN Cc1ccc(CN[C@H](CCO)c2ccc(Cl)c(F)c2)cc1 ZINC001461694388 1063662805 /nfs/dbraw/zinc/66/28/05/1063662805.db2.gz XNKMXKXTQSOKSM-QGZVFWFLSA-N 0 1 307.796 4.001 20 0 DIADMN C[C@H](CC1CC1)N1CCO[C@@H](c2cccc(C(F)(F)F)c2)C1 ZINC001258469847 1063666589 /nfs/dbraw/zinc/66/65/89/1063666589.db2.gz IVQANGUWDZDNSZ-MLGOLLRUSA-N 0 1 313.363 4.267 20 0 DIADMN C[C@@H]1[C@H](C)Sc2ccccc2N1C(=O)c1cccc(F)c1O ZINC001515323399 1063669239 /nfs/dbraw/zinc/66/92/39/1063669239.db2.gz GMXKEZRVOFHTAL-MNOVXSKESA-N 0 1 317.385 4.061 20 0 DIADMN CCOC(=O)CC[C@H](C)N(C)Cc1cccc(Cl)c1Cl ZINC001258495516 1063675593 /nfs/dbraw/zinc/67/55/93/1063675593.db2.gz JBMQTAYLIASNNG-NSHDSACASA-N 0 1 318.244 4.157 20 0 DIADMN C=C/C=C/CCNCc1csc(COc2ccc(C)cc2)n1 ZINC001461722832 1063677709 /nfs/dbraw/zinc/67/77/09/1063677709.db2.gz PCJWOMOSNUWUDM-SNAWJCMRSA-N 0 1 314.454 4.252 20 0 DIADMN [O-]c1ccc(C[NH2+]Cc2ccc(F)c3cccnc23)cc1Cl ZINC001461727721 1063681226 /nfs/dbraw/zinc/68/12/26/1063681226.db2.gz FDXKNJLCEVYXNP-UHFFFAOYSA-N 0 1 316.763 4.023 20 0 DIADMN C[C@H]1Cc2cc(CNCc3cc(Cl)ccc3F)ccc2O1 ZINC001461735224 1063686329 /nfs/dbraw/zinc/68/63/29/1063686329.db2.gz DVVPHYASDRJGTO-NSHDSACASA-N 0 1 305.780 4.092 20 0 DIADMN COc1ccc(CN[C@@H](C)c2ccc(OC)c(C)c2)c(F)c1 ZINC001461756879 1063699956 /nfs/dbraw/zinc/69/99/56/1063699956.db2.gz QWTQZDLYIFPTJP-ZDUSSCGKSA-N 0 1 303.377 4.002 20 0 DIADMN CCC1CCC(C2CCC(NCc3ncccn3)CC2)CC1 ZINC001258632808 1063718421 /nfs/dbraw/zinc/71/84/21/1063718421.db2.gz MOBUSPFFWNGYSZ-UHFFFAOYSA-N 0 1 301.478 4.341 20 0 DIADMN CCN(Cc1c(F)cccc1Cl)[C@@H](C)Cc1cccnc1 ZINC001258633007 1063719572 /nfs/dbraw/zinc/71/95/72/1063719572.db2.gz FDPLLTGQYNCRMN-ZDUSSCGKSA-N 0 1 306.812 4.327 20 0 DIADMN C[C@@H](NCc1ccc(F)c(F)c1N(C)C)c1ccc(F)cc1 ZINC001461795030 1063722064 /nfs/dbraw/zinc/72/20/64/1063722064.db2.gz AFACHNCIWKZCHR-LLVKDONJSA-N 0 1 308.347 4.021 20 0 DIADMN Cc1ccc(-n2cc(CNC/C=C/Cl)c(C(C)(C)C)n2)cc1 ZINC001461807032 1063728655 /nfs/dbraw/zinc/72/86/55/1063728655.db2.gz UGPLCEHIKNKGKO-BJMVGYQFSA-N 0 1 317.864 4.320 20 0 DIADMN CCC[C@H](Cc1ccccc1)N1CCCC[C@H]1c1noc(C)n1 ZINC001258658771 1063731706 /nfs/dbraw/zinc/73/17/06/1063731706.db2.gz LCCJQMSKDOIBNY-MSOLQXFVSA-N 0 1 313.445 4.316 20 0 DIADMN Cc1cccc(CNCc2cccc(OC(F)(F)F)c2)c1F ZINC001461820047 1063735994 /nfs/dbraw/zinc/73/59/94/1063735994.db2.gz KEQGOUFHMWADAU-UHFFFAOYSA-N 0 1 313.294 4.323 20 0 DIADMN CCCCC[C@@H](CCC)N1CCc2nc(C3CC3)ncc2C1 ZINC001258673622 1063742036 /nfs/dbraw/zinc/74/20/36/1063742036.db2.gz MUTAZPBKHXGZEY-QGZVFWFLSA-N 0 1 301.478 4.461 20 0 DIADMN CCCCC[C@H](CCC)N1CCc2nc(C3CC3)ncc2C1 ZINC001258673619 1063742825 /nfs/dbraw/zinc/74/28/25/1063742825.db2.gz MUTAZPBKHXGZEY-KRWDZBQOSA-N 0 1 301.478 4.461 20 0 DIADMN COc1ccc([C@@H]2CCCN2Cc2cccn2C(F)F)cc1 ZINC001461839557 1063742917 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/nfs/dbraw/zinc/94/22/07/129942207.db2.gz XPEAWUJFJAIBQV-BLLLJJGKSA-N 0 1 302.418 4.417 20 0 DIADMN COCC[C@@H](NCc1ccc2ncccc2c1)c1ccc(C)o1 ZINC000272220472 130009224 /nfs/dbraw/zinc/00/92/24/130009224.db2.gz DOFIFSGEFHGEQW-GOSISDBHSA-N 0 1 310.397 4.004 20 0 DIADMN Cc1n[nH]c(C(F)F)c1NC(=O)C[C@H](c1ccccc1)C(C)C ZINC000272288196 130015504 /nfs/dbraw/zinc/01/55/04/130015504.db2.gz CSCXIUDJTINQOD-ZDUSSCGKSA-N 0 1 321.371 4.424 20 0 DIADMN COCC[C@H](NCc1cccc(OC(C)C)c1)c1ccc(C)o1 ZINC000272297149 130017038 /nfs/dbraw/zinc/01/70/38/130017038.db2.gz NDLGDEDDTWJJAC-SFHVURJKSA-N 0 1 317.429 4.243 20 0 DIADMN Cc1cccc([C@@H](C)NCc2cccc(Br)n2)c1C ZINC000272447420 130031319 /nfs/dbraw/zinc/03/13/19/130031319.db2.gz VGPTZDDEHIRCKH-CYBMUJFWSA-N 0 1 319.246 4.312 20 0 DIADMN CC[C@H](N[C@H](CCOC)c1ccco1)c1cc(C)ccc1OC ZINC000272534540 130039215 /nfs/dbraw/zinc/03/92/15/130039215.db2.gz JQQFTQSOIVORIU-DLBZAZTESA-N 0 1 317.429 4.415 20 0 DIADMN CC[C@@H](N[C@H](CCOC)c1ccco1)c1ccc(OC)cc1 ZINC000272608965 130045700 /nfs/dbraw/zinc/04/57/00/130045700.db2.gz VWHBIDRGBXVJQI-IAGOWNOFSA-N 0 1 303.402 4.107 20 0 DIADMN CCc1nc(C)c([C@@H](C)N[C@H](CCOC)c2ccc(C)o2)s1 ZINC000272697240 130054590 /nfs/dbraw/zinc/05/45/90/130054590.db2.gz XZZYQJUDVSMRLA-TZMCWYRMSA-N 0 1 322.474 4.344 20 0 DIADMN CC(=O)Nc1ccc([C@@H](C)N[C@@H]2COc3c2ccc(C)c3C)cc1 ZINC000272797750 130065105 /nfs/dbraw/zinc/06/51/05/130065105.db2.gz ZAZAHRMPKBMPJG-AUUYWEPGSA-N 0 1 324.424 4.046 20 0 DIADMN COc1ncc(CN[C@H](C)c2cc(C)sc2C)cc1Cl ZINC000273363338 130110708 /nfs/dbraw/zinc/11/07/08/130110708.db2.gz WSJVMOHBQHUGMH-SNVBAGLBSA-N 0 1 310.850 4.273 20 0 DIADMN Clc1cccc2c1CCC[C@@H]2N[C@H]1CCCc2c[nH]nc21 ZINC000273358068 130111055 /nfs/dbraw/zinc/11/10/55/130111055.db2.gz DECDERPBVBILON-HOTGVXAUSA-N 0 1 301.821 4.108 20 0 DIADMN CCc1noc(CC)c1CN[C@@H](C)c1cc(C)c(OC)cc1C ZINC000273418812 130118935 /nfs/dbraw/zinc/11/89/35/130118935.db2.gz XDVLPUOBYDAKJA-AWEZNQCLSA-N 0 1 316.445 4.276 20 0 DIADMN CC(C)c1nc([C@H](C)N[C@H]2CCCc3c(Cl)cccc32)n[nH]1 ZINC000273485576 130128448 /nfs/dbraw/zinc/12/84/48/130128448.db2.gz NGHAIZVTZSDQMM-NHYWBVRUSA-N 0 1 318.852 4.310 20 0 DIADMN Cc1ccccc1CN[C@@H](C)c1cc(Br)ncc1F ZINC000273848495 130176730 /nfs/dbraw/zinc/17/67/30/130176730.db2.gz JJZVBGKKQNZEMS-NSHDSACASA-N 0 1 323.209 4.142 20 0 DIADMN C[C@@H](N[C@@H](C)c1cc(Br)ncc1F)c1ccccc1 ZINC000273855204 130177970 /nfs/dbraw/zinc/17/79/70/130177970.db2.gz KWHRPAYOAHKCJA-MNOVXSKESA-N 0 1 323.209 4.395 20 0 DIADMN Cc1nnc([C@H](C)N[C@H]2CC=C(c3ccc(F)cc3)CC2)s1 ZINC000274278293 130223010 /nfs/dbraw/zinc/22/30/10/130223010.db2.gz XYLLALGGTNOJJQ-ZBEGNZNMSA-N 0 1 317.433 4.272 20 0 DIADMN Cc1nn(C(C)(C)C)cc1[C@H](C)N[C@H](C)c1cncc(C)c1 ZINC000274398525 130231246 /nfs/dbraw/zinc/23/12/46/130231246.db2.gz PVVZXPYBHBQTKL-KGLIPLIRSA-N 0 1 300.450 4.062 20 0 DIADMN CCN(Cc1cn(C)nc1C(F)F)Cc1ccc(Cl)cc1 ZINC000274437019 130234465 /nfs/dbraw/zinc/23/44/65/130234465.db2.gz AMTAWYUUAKLHTN-UHFFFAOYSA-N 0 1 313.779 4.033 20 0 DIADMN CC[C@@H](NCc1cn(C)nc1C(F)F)c1cccc(Cl)c1 ZINC000274524990 130242432 /nfs/dbraw/zinc/24/24/32/130242432.db2.gz ZPLJAOAUEYWHDF-CYBMUJFWSA-N 0 1 313.779 4.252 20 0 DIADMN CN(Cc1csc2ccccc12)Cc1cn(C)nc1C(F)F ZINC000274519700 130243117 /nfs/dbraw/zinc/24/31/17/130243117.db2.gz XUKAHGULKJNQKM-UHFFFAOYSA-N 0 1 321.396 4.204 20 0 DIADMN CCCOc1ccc(CN[C@@H](C)c2cncc(C)c2)cc1OC ZINC000274616075 130249146 /nfs/dbraw/zinc/24/91/46/130249146.db2.gz OLBJJRYEXDSPGI-HNNXBMFYSA-N 0 1 314.429 4.038 20 0 DIADMN C[C@@H](NC[C@H]1CCC(C)(C)O1)c1nc2ccccc2n1C(F)F ZINC000275012105 130283063 /nfs/dbraw/zinc/28/30/63/130283063.db2.gz JYJYUJADQXHMBU-VXGBXAGGSA-N 0 1 323.387 4.040 20 0 DIADMN Cc1nn(C(C)C)cc1CN[C@H]1CCCc2ccc(F)cc21 ZINC000281226894 130845225 /nfs/dbraw/zinc/84/52/25/130845225.db2.gz DMVFAXVIOMCMEQ-SFHVURJKSA-N 0 1 301.409 4.079 20 0 DIADMN Cc1cc([C@H](C)N[C@H](c2ccc(F)cc2)C(C)(C)C)nn1C ZINC000282210130 130907583 /nfs/dbraw/zinc/90/75/83/130907583.db2.gz OIDVUIOXMODJBK-SUMWQHHRSA-N 0 1 303.425 4.306 20 0 DIADMN C[C@H]1C[C@H](N[C@@H]2CCCc3nn(C)cc32)c2ccsc2S1 ZINC000282291482 130912458 /nfs/dbraw/zinc/91/24/58/130912458.db2.gz CBNIWBWWSBWRPJ-ZBINZKHDSA-N 0 1 319.499 4.074 20 0 DIADMN Cc1ccc(C)c(N(C(=O)c2ccc3cncn3c2)C(C)C)c1 ZINC000284116397 131050413 /nfs/dbraw/zinc/05/04/13/131050413.db2.gz CBZBQBQEWDMKSQ-UHFFFAOYSA-N 0 1 307.397 4.006 20 0 DIADMN CC1(C)CC[C@@H]1NCc1csc(COc2ccccc2)n1 ZINC000284229757 131060933 /nfs/dbraw/zinc/06/09/33/131060933.db2.gz HQAZWNVCYWSYQU-HNNXBMFYSA-N 0 1 302.443 4.000 20 0 DIADMN C[C@@H](N[C@@H](c1cncc(Br)c1)C1CC1)c1ccco1 ZINC000284230862 131061311 /nfs/dbraw/zinc/06/13/11/131061311.db2.gz DLCBNIUPOXKSTP-MEBBXXQBSA-N 0 1 321.218 4.239 20 0 DIADMN c1cn(Cc2ccccc2)nc1CN[C@@H](c1ccccc1)C1CC1 ZINC000284309245 131068639 /nfs/dbraw/zinc/06/86/39/131068639.db2.gz JISYLEUBLKDQJC-NRFANRHFSA-N 0 1 317.436 4.172 20 0 DIADMN CC(C)Oc1ccc([C@H](C)N[C@@H](C)c2cnn(C)c2)cc1Cl ZINC000284362495 131073430 /nfs/dbraw/zinc/07/34/30/131073430.db2.gz NWGKKBUXFNVVLN-STQMWFEESA-N 0 1 321.852 4.273 20 0 DIADMN CCCCCOc1ccc([C@@H](C)NCc2cc(C)nn2C)cc1 ZINC000284422808 131079164 /nfs/dbraw/zinc/07/91/64/131079164.db2.gz QWFGSEUZTVDHLH-MRXNPFEDSA-N 0 1 315.461 4.148 20 0 DIADMN COc1cccc([C@H](C)N[C@H](C)c2cnc(OC)c(Cl)c2)c1 ZINC000284424697 131080103 /nfs/dbraw/zinc/08/01/03/131080103.db2.gz QYTQMQHAVKKPFM-NWDGAFQWSA-N 0 1 320.820 4.164 20 0 DIADMN C[C@@H](NCc1ccnc(OC(F)F)c1)c1ccc(Cl)s1 ZINC000284582171 131094467 /nfs/dbraw/zinc/09/44/67/131094467.db2.gz XKZKOPQQYWUCEQ-MRVPVSSYSA-N 0 1 318.776 4.249 20 0 DIADMN CC(C)c1nnc(-c2ccccc2NC(=O)[C@@H]2CC=CC[C@H]2C)[nH]1 ZINC000285172447 131144550 /nfs/dbraw/zinc/14/45/50/131144550.db2.gz RYNNEAIURBQWTA-ZIAGYGMSSA-N 0 1 324.428 4.136 20 0 DIADMN CCCN(Cc1csc(C2CC2)n1)[C@@H]1[C@@H]2CCO[C@H]2C1(C)C ZINC000340200161 131147216 /nfs/dbraw/zinc/14/72/16/131147216.db2.gz XCUNPKNTLFFQPP-ARFHVFGLSA-N 0 1 320.502 4.046 20 0 DIADMN Cc1cc([C@H](C)NCc2cccnc2)sc1Br ZINC000285345648 131159999 /nfs/dbraw/zinc/15/99/99/131159999.db2.gz DDGSLTUEVDIYGI-JTQLQIEISA-N 0 1 311.248 4.065 20 0 DIADMN Cc1cc([C@H](C)NCc2ccoc2)sc1Br ZINC000285547271 131179287 /nfs/dbraw/zinc/17/92/87/131179287.db2.gz UINJQQVGJFXDTI-VIFPVBQESA-N 0 1 300.221 4.263 20 0 DIADMN CO[C@@H](C)C[N@@H+](C)[C@H](C)c1nc(C)c(-c2ccc(Cl)cc2)o1 ZINC000285654967 131191125 /nfs/dbraw/zinc/19/11/25/131191125.db2.gz LVHRTFFSJGMIQC-WCQYABFASA-N 0 1 322.836 4.331 20 0 DIADMN CO[C@@H](C)CN(C)[C@H](C)c1nc(C)c(-c2ccc(Cl)cc2)o1 ZINC000285654967 131191126 /nfs/dbraw/zinc/19/11/26/131191126.db2.gz LVHRTFFSJGMIQC-WCQYABFASA-N 0 1 322.836 4.331 20 0 DIADMN Fc1cccc(N2CCCC2)c1CNCc1cccc2[nH]ccc21 ZINC000285690566 131193185 /nfs/dbraw/zinc/19/31/85/131193185.db2.gz VKKHSQRPIKJUMW-UHFFFAOYSA-N 0 1 323.415 4.197 20 0 DIADMN COC(=O)c1csc([C@H](C)NCc2cccc(Cl)c2)c1 ZINC000285699071 131194162 /nfs/dbraw/zinc/19/41/62/131194162.db2.gz OYTBOKBTWKAZEI-JTQLQIEISA-N 0 1 309.818 4.039 20 0 DIADMN Cc1ccccc1C1CC(N[C@@H](C)c2c(F)cncc2F)C1 ZINC000285714293 131195685 /nfs/dbraw/zinc/19/56/85/131195685.db2.gz PTMAJDVQYXNYPA-HSBZDZAISA-N 0 1 302.368 4.265 20 0 DIADMN COc1ccc([C@H](C)NCc2ccc3[nH]c(C)cc3c2)c(OC)c1 ZINC000285712053 131195741 /nfs/dbraw/zinc/19/57/41/131195741.db2.gz PNBGIJCDJLJQQY-AWEZNQCLSA-N 0 1 324.424 4.344 20 0 DIADMN FCC[C@@H]1CCC[C@@H]1N[C@H](c1nccs1)c1ccccc1 ZINC000285986931 131214057 /nfs/dbraw/zinc/21/40/57/131214057.db2.gz HXALMJLYUUJTMI-BPUTZDHNSA-N 0 1 304.434 4.350 20 0 DIADMN Cc1ccnc([C@@H](C)NCc2cccc(Br)c2)c1 ZINC000286126825 131221453 /nfs/dbraw/zinc/22/14/53/131221453.db2.gz OJAWTNVVBTXJJD-GFCCVEGCSA-N 0 1 305.219 4.003 20 0 DIADMN Fc1ccc(/C=C/CNCc2nc(C3CC3)cs2)cc1F ZINC000286376994 131234042 /nfs/dbraw/zinc/23/40/42/131234042.db2.gz GNCAORKMPWKEQW-OWOJBTEDSA-N 0 1 306.381 4.102 20 0 DIADMN Cc1cc([C@@H](C)N[C@H](CCO)c2ccc(Cl)cc2)oc1C ZINC000286952618 131257035 /nfs/dbraw/zinc/25/70/35/131257035.db2.gz HLENVJJYVZKBBM-MLGOLLRUSA-N 0 1 307.821 4.324 20 0 DIADMN OCC[C@H](N[C@@H]1CCCc2occc21)c1ccc(Cl)cc1 ZINC000287146893 131266397 /nfs/dbraw/zinc/26/63/97/131266397.db2.gz SOQGFLGJSCHDIH-JKSUJKDBSA-N 0 1 305.805 4.024 20 0 DIADMN C[C@H](N[C@@H](C)c1ccc(Oc2cccnc2)cc1)c1ccnn1C ZINC000287183697 131268099 /nfs/dbraw/zinc/26/80/99/131268099.db2.gz CURIKRWRHFZYAP-GJZGRUSLSA-N 0 1 322.412 4.019 20 0 DIADMN C[C@H](NCc1ccncc1OCCC(C)(C)C)c1ccncc1 ZINC000287259324 131272061 /nfs/dbraw/zinc/27/20/61/131272061.db2.gz PZJSZQXROCETCA-HNNXBMFYSA-N 0 1 313.445 4.142 20 0 DIADMN COc1cc([C@H](C)N[C@@H]2CCCc3sccc32)c(F)cn1 ZINC000287300320 131273888 /nfs/dbraw/zinc/27/38/88/131273888.db2.gz CKZYXIAOEVVAHR-IINYFYTJSA-N 0 1 306.406 4.019 20 0 DIADMN CC[C@H](N[C@H](C)c1cc(C)ccn1)c1ccc(OC)c(OC)c1 ZINC000287598145 131289531 /nfs/dbraw/zinc/28/95/31/131289531.db2.gz RXGTWQOUEPKGAK-ZBFHGGJFSA-N 0 1 314.429 4.209 20 0 DIADMN COCCCOc1ccc(CN[C@H](C)c2cc(C)c(C)o2)cc1 ZINC000287598126 131289670 /nfs/dbraw/zinc/28/96/70/131289670.db2.gz RXBZZDBMIQKLDD-OAHLLOKOSA-N 0 1 317.429 4.163 20 0 DIADMN CSc1cccc(F)c1CN[C@@H]1CCCc2nc(C)sc21 ZINC000287728657 131297271 /nfs/dbraw/zinc/29/72/71/131297271.db2.gz YHUXYWIKGABKMR-CYBMUJFWSA-N 0 1 322.474 4.480 20 0 DIADMN C[C@H](c1ccc(Cl)cc1)N1CC[C@H](OCc2ccncc2)C1 ZINC000287777417 131299536 /nfs/dbraw/zinc/29/95/36/131299536.db2.gz NFKLTIJAICBGNJ-KDOFPFPSSA-N 0 1 316.832 4.087 20 0 DIADMN C[C@@H](c1ccc(Cl)cc1)N1CC[C@@H](OCc2ccncc2)C1 ZINC000287777413 131299611 /nfs/dbraw/zinc/29/96/11/131299611.db2.gz NFKLTIJAICBGNJ-KBXCAEBGSA-N 0 1 316.832 4.087 20 0 DIADMN C[C@H](c1ccccc1Cl)N1CC[C@H](OCc2ccncc2)C1 ZINC000287812594 131300963 /nfs/dbraw/zinc/30/09/63/131300963.db2.gz PGQJHZMAVDCSOE-ZBFHGGJFSA-N 0 1 316.832 4.087 20 0 DIADMN C[C@@H](O)c1ncc(C[N@H+]2CCCCC[C@H]2c2ccccc2)s1 ZINC000289043915 131353843 /nfs/dbraw/zinc/35/38/43/131353843.db2.gz HXMSMTUYQGFKGP-PBHICJAKSA-N 0 1 316.470 4.314 20 0 DIADMN C[C@@H](O)c1ncc(CN2CCCCC[C@H]2c2ccccc2)s1 ZINC000289043915 131353844 /nfs/dbraw/zinc/35/38/44/131353844.db2.gz 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C[C@@H](O)C[C@H](C)CNc1ccnc2cc(C(F)(F)F)ccc21 ZINC000301801631 336331085 /nfs/dbraw/zinc/33/10/85/336331085.db2.gz SQLQVBORRJLQKF-WDEREUQCSA-N 0 1 312.335 4.073 20 0 DIADMN FC(F)(F)c1ccc2c(c1)nccc2NCCc1cscn1 ZINC000301812979 336331823 /nfs/dbraw/zinc/33/18/23/336331823.db2.gz YMFLECLMSRGVFR-UHFFFAOYSA-N 0 1 323.343 4.365 20 0 DIADMN Cc1csc([C@@H](C)CNc2ccnc3cc(F)ccc32)n1 ZINC000302122139 336349591 /nfs/dbraw/zinc/34/95/91/336349591.db2.gz GOHRBSWKFYTGRC-JTQLQIEISA-N 0 1 301.390 4.354 20 0 DIADMN Cc1cc(N(C)C[C@@H](C)c2nccs2)c2cc(F)ccc2n1 ZINC000302155264 336351283 /nfs/dbraw/zinc/35/12/83/336351283.db2.gz MTFGBEOEVMEZGJ-LLVKDONJSA-N 0 1 315.417 4.379 20 0 DIADMN CSc1ccc(CN[C@@H]2CCOc3c(C)cccc32)s1 ZINC000352891562 336356950 /nfs/dbraw/zinc/35/69/50/336356950.db2.gz KLSHJOXPFMYIPB-CQSZACIVSA-N 0 1 305.468 4.392 20 0 DIADMN CC(C)(O)c1ccc(CNc2ccnc3cc(F)ccc32)cc1 ZINC000302333680 336357355 /nfs/dbraw/zinc/35/73/55/336357355.db2.gz AHQHHEULRGHLKV-UHFFFAOYSA-N 0 1 310.372 4.213 20 0 DIADMN Cc1cc(N2CCC([C@H]3CCCO3)CC2)c2cc(F)ccc2n1 ZINC000302539242 336361191 /nfs/dbraw/zinc/36/11/91/336361191.db2.gz HINQSSFJDSYSBX-LJQANCHMSA-N 0 1 314.404 4.078 20 0 DIADMN C[C@@H]1CN(C[C@@H]2CCCC(F)(F)C2)C[C@H](c2ccsc2)O1 ZINC000514110713 336362106 /nfs/dbraw/zinc/36/21/06/336362106.db2.gz HVZJGPKSPAXKSH-UMVBOHGHSA-N 0 1 315.429 4.335 20 0 DIADMN CC(C)SCCN[C@H](c1ccc(F)cc1)c1ccccn1 ZINC000514114550 336368238 /nfs/dbraw/zinc/36/82/38/336368238.db2.gz HXOBQBWKXNREDZ-QGZVFWFLSA-N 0 1 304.434 4.041 20 0 DIADMN C[C@@H]1COC[C@H](c2ccccc2)N1C[C@@H]1CCCC(F)(F)C1 ZINC000514133920 336374616 /nfs/dbraw/zinc/37/46/16/336374616.db2.gz FHPHZWPCROMCDL-BFYDXBDKSA-N 0 1 309.400 4.274 20 0 DIADMN CO[C@H]1CN(Cc2cnc(C3CCCCC3)s2)CC[C@@H]1C ZINC000525892378 336375997 /nfs/dbraw/zinc/37/59/97/336375997.db2.gz CIJZSCKNWQYHIF-BBRMVZONSA-N 0 1 308.491 4.048 20 0 DIADMN CO[C@@H]1CN(Cc2cnc(C3CCCCC3)s2)CC[C@H]1C ZINC000525892380 336376062 /nfs/dbraw/zinc/37/60/62/336376062.db2.gz CIJZSCKNWQYHIF-CZUORRHYSA-N 0 1 308.491 4.048 20 0 DIADMN Cc1ccc(C)n1C1CCN(Cc2ccc(F)cc2F)CC1 ZINC000352923778 336377272 /nfs/dbraw/zinc/37/72/72/336377272.db2.gz XCCNRAHSDLBSAI-UHFFFAOYSA-N 0 1 304.384 4.220 20 0 DIADMN COc1ccc(CN2CCC(OC3CCCC3)CC2)c(Cl)c1 ZINC000352935924 336378313 /nfs/dbraw/zinc/37/83/13/336378313.db2.gz SDQWGVJNAHJLOS-UHFFFAOYSA-N 0 1 323.864 4.272 20 0 DIADMN C[C@H](C(=O)Nc1ccccc1Oc1ccccc1)N1CC[C@H](C)C1 ZINC000261391323 336387191 /nfs/dbraw/zinc/38/71/91/336387191.db2.gz OEHWWWMNNXHDDL-JKSUJKDBSA-N 0 1 324.424 4.148 20 0 DIADMN Cc1nc2c(n1Cc1ccccc1OCC(F)(F)F)CCCC2 ZINC000582253022 336395456 /nfs/dbraw/zinc/39/54/56/336395456.db2.gz ZHLNMVCVYHNETO-UHFFFAOYSA-N 0 1 324.346 4.060 20 0 DIADMN Fc1ccc(/C=C/CN2CCC(OC3CCC3)CC2)c(F)c1 ZINC000418087462 336398876 /nfs/dbraw/zinc/39/88/76/336398876.db2.gz CDIILRCOMSIEMT-NSCUHMNNSA-N 0 1 307.384 4.012 20 0 DIADMN Cc1cccc2c1OCC[C@@H]2NCc1cnc(C2CCC2)s1 ZINC000353205308 336406446 /nfs/dbraw/zinc/40/64/46/336406446.db2.gz JSHBMJUGYLNWCL-INIZCTEOSA-N 0 1 314.454 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324.424 4.058 20 0 DIADMN c1c2ccccc2oc1[C@H](N[C@H]1CCSC1)c1cccnc1 ZINC000354035384 336455698 /nfs/dbraw/zinc/45/56/98/336455698.db2.gz KZTZUVFRSCNEQE-MAUKXSAKSA-N 0 1 310.422 4.012 20 0 DIADMN CCCNc1ccc(CNCc2cc(F)c(F)c(F)c2)cc1 ZINC000193152079 336467405 /nfs/dbraw/zinc/46/74/05/336467405.db2.gz JFLHDNHJJUNIRG-UHFFFAOYSA-N 0 1 308.347 4.216 20 0 DIADMN Cn1ccc(C(=O)Nc2cc(Cl)c(O)cc2F)c1C1CCC1 ZINC000354557323 336474659 /nfs/dbraw/zinc/47/46/59/336474659.db2.gz GADNTWZIDKHTOT-UHFFFAOYSA-N 0 1 322.767 4.043 20 0 DIADMN c1nc(C2CCC2)sc1CNCc1ccc2ncccc2c1 ZINC000355276338 336501932 /nfs/dbraw/zinc/50/19/32/336501932.db2.gz BMGAMQYTTNOVBU-UHFFFAOYSA-N 0 1 309.438 4.249 20 0 DIADMN CCc1ccc(CN[C@@H](CCCCOC)c2ccccc2)o1 ZINC000355329646 336504415 /nfs/dbraw/zinc/50/44/15/336504415.db2.gz AEWMNAKVYROSKO-IBGZPJMESA-N 0 1 301.430 4.490 20 0 DIADMN C[C@H](NCc1cscc1C(F)(F)F)c1cccc(O)c1 ZINC000356182279 336539709 /nfs/dbraw/zinc/53/97/09/336539709.db2.gz GHNRNCZGBBOKOI-VIFPVBQESA-N 0 1 301.333 4.323 20 0 DIADMN CO[C@H](c1ccc(F)cc1)[C@@H](C)NCc1csc(C2CC2)n1 ZINC000356313460 336546017 /nfs/dbraw/zinc/54/60/17/336546017.db2.gz RBUWBFAGIQNERQ-BZNIZROVSA-N 0 1 320.433 4.025 20 0 DIADMN Clc1cnn(C2CCN(Cc3ccccc3Cl)CC2)c1 ZINC000356454012 336550382 /nfs/dbraw/zinc/55/03/82/336550382.db2.gz KHTMTKQPXCUZMQ-UHFFFAOYSA-N 0 1 310.228 4.027 20 0 DIADMN CCc1cccnc1[C@@H](C)N[C@@H](C)c1cccc(NC(C)=O)c1 ZINC000356882082 336564663 /nfs/dbraw/zinc/56/46/63/336564663.db2.gz VDFREAQGWDHKAH-UONOGXRCSA-N 0 1 311.429 4.014 20 0 DIADMN Cc1ccncc1[C@@H](C)NCc1ccc(Oc2ccccc2)nc1 ZINC000357776968 336597853 /nfs/dbraw/zinc/59/78/53/336597853.db2.gz GDZFKNRVYJDTGT-MRXNPFEDSA-N 0 1 319.408 4.428 20 0 DIADMN COc1cccc([C@H](C)N[C@@H]2CCCOc3ccc(F)cc32)c1 ZINC000358022389 336606845 /nfs/dbraw/zinc/60/68/45/336606845.db2.gz OZWSVZXVLYDUFW-SCLBCKFNSA-N 0 1 315.388 4.399 20 0 DIADMN CCOc1ccccc1CN[C@H]1CCCOc2cc(C)ccc21 ZINC000358080858 336610347 /nfs/dbraw/zinc/61/03/47/336610347.db2.gz HBYYSLDYARIQOC-SFHVURJKSA-N 0 1 311.425 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Cc1cncc(CN[C@H](C)c2csc(C(F)(F)F)c2)c1 ZINC000925645146 1043443085 /nfs/dbraw/zinc/44/30/85/1043443085.db2.gz NUPHAUZCZIELEF-SNVBAGLBSA-N 0 1 300.349 4.321 20 0 DIADMN CSc1ccccc1[C@H](C)N[C@H](CO)c1sccc1C ZINC000442875668 1043443096 /nfs/dbraw/zinc/44/30/96/1043443096.db2.gz ONTANLOXRJVIRG-GXTWGEPZSA-N 0 1 307.484 4.163 20 0 DIADMN Cc1cncc(CN[C@@H](C)c2csc(C(F)(F)F)c2)c1 ZINC000925645145 1043443296 /nfs/dbraw/zinc/44/32/96/1043443296.db2.gz NUPHAUZCZIELEF-JTQLQIEISA-N 0 1 300.349 4.321 20 0 DIADMN CCc1noc(C)c1CN[C@H](c1ccc(OC)cc1)C(C)C ZINC000271641435 1043445160 /nfs/dbraw/zinc/44/51/60/1043445160.db2.gz HKASEDFWVWZASH-SFHVURJKSA-N 0 1 302.418 4.041 20 0 DIADMN CCc1ccc([C@@H](C)NCc2ccncc2OCC(F)F)cc1 ZINC000442876839 1043445868 /nfs/dbraw/zinc/44/58/68/1043445868.db2.gz YJPIWIWZNGANSX-CYBMUJFWSA-N 0 1 320.383 4.139 20 0 DIADMN CC[C@H](N[C@@H](C)c1cc(C)c(C(=O)OC)o1)c1ccccc1 ZINC000271669416 1043447489 /nfs/dbraw/zinc/44/74/89/1043447489.db2.gz MSZKOGPMBLYEHG-ZFWWWQNUSA-N 0 1 301.386 4.177 20 0 DIADMN c1cc([C@@H]2CCCN2Cc2cnn(-c3ccccc3)c2)cs1 ZINC000339143567 1043454012 /nfs/dbraw/zinc/45/40/12/1043454012.db2.gz FZTDCRXWCIHAEK-SFHVURJKSA-N 0 1 309.438 4.271 20 0 DIADMN CC(C)N(C(=O)CN1CCC[C@H]1c1ccsc1)C1CCCC1 ZINC000339142968 1043454341 /nfs/dbraw/zinc/45/43/41/1043454341.db2.gz WUWUPOAPYJBQGK-KRWDZBQOSA-N 0 1 320.502 4.065 20 0 DIADMN CO[C@@H](C)c1cccc(NC(=O)c2cc(-c3ccccc3)n[nH]2)c1 ZINC000339144474 1043454367 /nfs/dbraw/zinc/45/43/67/1043454367.db2.gz SQDGILCIDOPCND-ZDUSSCGKSA-N 0 1 321.380 4.036 20 0 DIADMN CO[C@H](C)c1cccc(NC(=O)c2cc(-c3ccccc3)n[nH]2)c1 ZINC000339144459 1043455259 /nfs/dbraw/zinc/45/52/59/1043455259.db2.gz SQDGILCIDOPCND-CYBMUJFWSA-N 0 1 321.380 4.036 20 0 DIADMN CCn1nccc1CN[C@@H]1CC(C)(C)Sc2ccccc21 ZINC000872088308 1043455471 /nfs/dbraw/zinc/45/54/71/1043455471.db2.gz PRAXSHXINIKIJH-OAHLLOKOSA-N 0 1 301.459 4.008 20 0 DIADMN CCn1nccc1CN[C@H]1CC(C)(C)Sc2ccccc21 ZINC000872088307 1043455582 /nfs/dbraw/zinc/45/55/82/1043455582.db2.gz PRAXSHXINIKIJH-HNNXBMFYSA-N 0 1 301.459 4.008 20 0 DIADMN C=Cn1cc(CN2CCC([C@H](F)c3ccccc3F)CC2)cn1 ZINC000348637045 1043460275 /nfs/dbraw/zinc/46/02/75/1043460275.db2.gz SHLLEOZQQJWXKY-SFHVURJKSA-N 0 1 317.383 4.046 20 0 DIADMN Cc1cncc([C@H](C)NCc2ccc(C(F)(F)F)s2)c1 ZINC000872107318 1043461192 /nfs/dbraw/zinc/46/11/92/1043461192.db2.gz LKEUVUJSCGKLTH-JTQLQIEISA-N 0 1 300.349 4.321 20 0 DIADMN COc1cc([C@H](C)N[C@H]2C[C@H](C)Sc3sccc32)ccn1 ZINC000348676668 1043461688 /nfs/dbraw/zinc/46/16/88/1043461688.db2.gz DRTOFGFTUVYKSB-MJVIPROJSA-N 0 1 320.483 4.428 20 0 DIADMN Cc1ncc(CN2CCC=C(c3ccco3)C2)n1-c1ccccc1 ZINC000348670284 1043462112 /nfs/dbraw/zinc/46/21/12/1043462112.db2.gz IPXGDFGOFOYXBY-UHFFFAOYSA-N 0 1 319.408 4.063 20 0 DIADMN CCCN(C(=O)c1cc(C(C)C)[nH]n1)[C@H]1CCc2ccccc21 ZINC000521759245 1043466311 /nfs/dbraw/zinc/46/63/11/1043466311.db2.gz BSNOHZYODDZSDM-SFHVURJKSA-N 0 1 311.429 4.073 20 0 DIADMN c1c[nH]c([C@H](NCc2cccc3ncccc23)C2CCCCC2)n1 ZINC000872123223 1043469344 /nfs/dbraw/zinc/46/93/44/1043469344.db2.gz NFGSPSKYPWMZQG-LJQANCHMSA-N 0 1 320.440 4.369 20 0 DIADMN CO[C@@H](CN[C@@H](C)c1ncc(C)s1)c1ccc(Cl)cc1 ZINC000283297717 1043470346 /nfs/dbraw/zinc/47/03/46/1043470346.db2.gz YHLPFWQYJYQYQF-FZMZJTMJSA-N 0 1 310.850 4.143 20 0 DIADMN C[C@H](N[C@H]1CCCc2occc21)c1ccc(C(F)(F)F)nc1 ZINC000872130030 1043470687 /nfs/dbraw/zinc/47/06/87/1043470687.db2.gz DRGNODOVFMOQNW-GWCFXTLKSA-N 0 1 310.319 4.422 20 0 DIADMN C[C@@H](N[C@H](C)c1cccc(O)c1)c1ccc(C(F)(F)F)nc1 ZINC000872129611 1043470927 /nfs/dbraw/zinc/47/09/27/1043470927.db2.gz CYCLKBOTBUPBKM-GHMZBOCLSA-N 0 1 310.319 4.218 20 0 DIADMN Cc1ncc([C@@H](C)N[C@H](C)c2ccc(C(F)(F)F)nc2)s1 ZINC000872129626 1043471518 /nfs/dbraw/zinc/47/15/18/1043471518.db2.gz DJNIRFWMSOHUSP-RKDXNWHRSA-N 0 1 315.364 4.277 20 0 DIADMN Cc1ncc([C@H](C)N[C@@H](C)c2ccc(C(F)(F)F)nc2)s1 ZINC000872130022 1043471380 /nfs/dbraw/zinc/47/13/80/1043471380.db2.gz DJNIRFWMSOHUSP-IUCAKERBSA-N 0 1 315.364 4.277 20 0 DIADMN CSc1ccc2c(c1)[C@@H](N[C@H](C)c1nccnc1C)CCC2 ZINC000872131001 1043472519 /nfs/dbraw/zinc/47/25/19/1043472519.db2.gz OHZZKCPMLBPKAY-DYVFJYSZSA-N 0 1 313.470 4.235 20 0 DIADMN Cc1ccncc1[C@@H](C)N[C@H](C)c1ccc(C(F)(F)F)nc1 ZINC000872130869 1043472555 /nfs/dbraw/zinc/47/25/55/1043472555.db2.gz TZTIPJHXKFPGQI-VXGBXAGGSA-N 0 1 309.335 4.216 20 0 DIADMN C[C@@H](N[C@H](C)c1cncc(F)c1)c1ccc(C(F)(F)F)nc1 ZINC000872130395 1043473990 /nfs/dbraw/zinc/47/39/90/1043473990.db2.gz LXALGNPJKVSZNV-NXEZZACHSA-N 0 1 313.298 4.046 20 0 DIADMN CC[C@H](N[C@H](C)c1csc(C(C)C)n1)[C@H](O)c1ccccc1 ZINC000872133929 1043474759 /nfs/dbraw/zinc/47/47/59/1043474759.db2.gz TZNXTXCIQCTJFA-UKPHBRMFSA-N 0 1 318.486 4.429 20 0 DIADMN COc1ccc([C@H](C)N[C@H](C)c2nccnc2C)c2ccccc12 ZINC000872135335 1043477217 /nfs/dbraw/zinc/47/72/17/1043477217.db2.gz VOFMTVLVFLKJLJ-DZGCQCFKSA-N 0 1 321.424 4.359 20 0 DIADMN FC(F)(F)Oc1cccc(CN2CCC[C@@H]2c2cccnc2)c1 ZINC000348902408 1043478069 /nfs/dbraw/zinc/47/80/69/1043478069.db2.gz CFGAGLOXHPDHEF-MRXNPFEDSA-N 0 1 322.330 4.317 20 0 DIADMN Cc1nc([C@@H](C)N[C@H]2C[C@@H](Oc3ccccc3)C2(C)C)cs1 ZINC000558275372 1043478306 /nfs/dbraw/zinc/47/83/06/1043478306.db2.gz IUMHGKYVSCHWFX-OAUYIBNBSA-N 0 1 316.470 4.348 20 0 DIADMN Cc1ccc2c(ccc(C)c2C[N@H+]2CCCC[C@@H]2CC(=O)[O-])c1 ZINC000872159186 1043479234 /nfs/dbraw/zinc/47/92/34/1043479234.db2.gz AIEQHKLXQSHCLT-QGZVFWFLSA-N 0 1 311.425 4.286 20 0 DIADMN Cc1ccc(C[N@H+]2CCC[C@H]2CCc2ccccc2)cc1C(=O)[O-] ZINC000872156881 1043479463 /nfs/dbraw/zinc/47/94/63/1043479463.db2.gz IZPWBSMYZIDMLE-IBGZPJMESA-N 0 1 323.436 4.290 20 0 DIADMN CCC1CCC([N@@H+](Cc2cc(C(=O)[O-])cs2)C2CC2)CC1 ZINC000872157978 1043479823 /nfs/dbraw/zinc/47/98/23/1043479823.db2.gz XVAFNOMQBNKTJK-UHFFFAOYSA-N 0 1 307.459 4.380 20 0 DIADMN Cc1ccc(C[N@H+]2CCC[C@H]2/C=C/c2ccccc2)cc1C(=O)[O-] ZINC000872158815 1043479858 /nfs/dbraw/zinc/47/98/58/1043479858.db2.gz ISERJPHXBFPEFX-CVTTXWKISA-N 0 1 321.420 4.371 20 0 DIADMN Cc1ccc(C[N@@H+]2C[C@@H](c3ccccc3)C[C@H]2C)cc1C(=O)[O-] ZINC000872158345 1043480534 /nfs/dbraw/zinc/48/05/34/1043480534.db2.gz ASZHAQPTHVDEOK-QAPCUYQASA-N 0 1 309.409 4.071 20 0 DIADMN C[C@@]1(c2ccccc2)CCC[N@@H+](Cc2cc(C(=O)[O-])cs2)C1 ZINC000872159011 1043480604 /nfs/dbraw/zinc/48/06/04/1043480604.db2.gz KWLWTBWVHRSJCS-GOSISDBHSA-N 0 1 315.438 4.000 20 0 DIADMN CC[C@@H](Cc1ccc(C)cc1)[N@@H+](C)Cc1cc(C(=O)[O-])cs1 ZINC000872158780 1043480674 /nfs/dbraw/zinc/48/06/74/1043480674.db2.gz IJGVMCKGDIFXTO-INIZCTEOSA-N 0 1 317.454 4.208 20 0 DIADMN C[C@@H](C[N@H+](Cc1ccccc1)C[C@@H](C)C(=O)[O-])CC(C)(C)C ZINC000872159548 1043482191 /nfs/dbraw/zinc/48/21/91/1043482191.db2.gz JCKFTBITTSQLPF-HZPDHXFCSA-N 0 1 305.462 4.282 20 0 DIADMN Cc1ccc2c(ccc(C)c2C[N@H+]([C@@H](C)C(=O)[O-])C2CCC2)c1 ZINC000872161602 1043482301 /nfs/dbraw/zinc/48/23/01/1043482301.db2.gz DEIBPXUHOQLRJF-HNNXBMFYSA-N 0 1 311.425 4.284 20 0 DIADMN Cc1ccc(C[N@H+]2CCC[C@@H](C3CCC3)CC2)cc1C(=O)[O-] ZINC000872162316 1043482645 /nfs/dbraw/zinc/48/26/45/1043482645.db2.gz GVNYPWSZZMZPAX-QGZVFWFLSA-N 0 1 301.430 4.095 20 0 DIADMN CC(C)Oc1cccc(CNCc2ccc3ccccc3n2)c1 ZINC000521831450 1043482644 /nfs/dbraw/zinc/48/26/44/1043482644.db2.gz UBUFHUZWKIDPSK-UHFFFAOYSA-N 0 1 306.409 4.312 20 0 DIADMN Cc1ccc2c(ccc(C)c2C[N@H+](CCC(=O)[O-])CC(C)C)c1 ZINC000872160029 1043482799 /nfs/dbraw/zinc/48/27/99/1043482799.db2.gz XAHDULYLZZRJSB-UHFFFAOYSA-N 0 1 313.441 4.389 20 0 DIADMN Cc1ccc(C[N@H+]2CCC[C@@H](C3CCCCC3)C2)cc1C(=O)[O-] ZINC000872162193 1043482965 /nfs/dbraw/zinc/48/29/65/1043482965.db2.gz LUWDOXNSNDZMJL-GOSISDBHSA-N 0 1 315.457 4.486 20 0 DIADMN CC(C)(C)C1CCC(C[N@H+]2CC[C@]3(C(=O)[O-])CCC[C@H]23)CC1 ZINC000872169791 1043483960 /nfs/dbraw/zinc/48/39/60/1043483960.db2.gz XVULMPRLFNBWHZ-IADFQQGMSA-N 0 1 307.478 4.168 20 0 DIADMN CC1(C)[C@@H](c2cccc(Cl)c2)CC[N@H+]1CC1(CC(=O)[O-])CC1 ZINC000872167047 1043484002 /nfs/dbraw/zinc/48/40/02/1043484002.db2.gz ATFHDOKCGCUMIL-OAHLLOKOSA-N 0 1 321.848 4.163 20 0 DIADMN CC(C)[C@H](N)c1noc(Cc2cc(Cl)cc3ccccc32)n1 ZINC000872170177 1043484934 /nfs/dbraw/zinc/48/49/34/1043484934.db2.gz FBRDPHRTLPTNLA-INIZCTEOSA-N 0 1 315.804 4.123 20 0 DIADMN C[C@H](c1ccc(C(C)(C)C)cc1)[N@H+]1CC[C@]2(C(=O)[O-])CCC[C@H]12 ZINC000872169597 1043485024 /nfs/dbraw/zinc/48/50/24/1043485024.db2.gz SIZJCNZUIVQBEB-CFLQYTFWSA-N 0 1 315.457 4.374 20 0 DIADMN CCc1cc2c(Cc3nc([C@@H](N)C(C)C)no3)csc2s1 ZINC000872170091 1043485501 /nfs/dbraw/zinc/48/55/01/1043485501.db2.gz CIHGUJAVPJZFIC-ZDUSSCGKSA-N 0 1 321.471 4.155 20 0 DIADMN CC[C@H](c1ccccc1)N(CC)Cc1nc(-c2ccco2)no1 ZINC000521823415 1043487062 /nfs/dbraw/zinc/48/70/62/1043487062.db2.gz UKSSEBFZTVYKGM-OAHLLOKOSA-N 0 1 311.385 4.303 20 0 DIADMN CC(C)(C)c1csc(CN2CCC[C@@H](OC3CCC3)CC2)n1 ZINC000872259753 1043487514 /nfs/dbraw/zinc/48/75/14/1043487514.db2.gz ILMOQSMDSSYPIR-OAHLLOKOSA-N 0 1 322.518 4.364 20 0 DIADMN Cc1ccc(CN(CCc2ccccc2)Cc2cccnc2)nc1 ZINC000349037483 1043487951 /nfs/dbraw/zinc/48/79/51/1043487951.db2.gz SPHOHSARDIETKP-UHFFFAOYSA-N 0 1 317.436 4.030 20 0 DIADMN C[C@@H](N[C@@H]1COCc2ccccc21)c1ccc(OC(F)F)cc1 ZINC000521846364 1043489696 /nfs/dbraw/zinc/48/96/96/1043489696.db2.gz QNKNBQXCNRVMEB-SJKOYZFVSA-N 0 1 319.351 4.210 20 0 DIADMN Cc1cc([C@@H](NCCOC(C)(C)C)c2cccnc2)ccc1F ZINC000558332389 1043491328 /nfs/dbraw/zinc/49/13/28/1043491328.db2.gz CLRRTBCRGBQBPT-GOSISDBHSA-N 0 1 316.420 4.023 20 0 DIADMN CCN(CC(=O)N(C)[C@@H](C)c1ccccc1)Cc1ccc(C)cc1 ZINC000521859691 1043491983 /nfs/dbraw/zinc/49/19/83/1043491983.db2.gz OCWCNXSVJNMGDL-SFHVURJKSA-N 0 1 324.468 4.037 20 0 DIADMN CC(C)CCc1nc(CN2CCC3(CCOCC3)[C@H]2C)cs1 ZINC000349233036 1043496965 /nfs/dbraw/zinc/49/69/65/1043496965.db2.gz CKBWWTIVBDULBC-OAHLLOKOSA-N 0 1 322.518 4.123 20 0 DIADMN Fc1ccc(/C=C/CN(Cc2cccnc2)C2CC2)c(F)c1 ZINC000349290870 1043498531 /nfs/dbraw/zinc/49/85/31/1043498531.db2.gz YFVSVILJWRCHTH-DUXPYHPUSA-N 0 1 300.352 4.038 20 0 DIADMN CN(C)Cc1ccc(NC(=O)C[C@H]2CCCCC2(C)C)cc1F ZINC001137059526 1043499310 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CC[C@@H](N[C@H](c1cnn(C)c1)C(C)C)c1ccc(F)cc1F ZINC000927069009 1043681253 /nfs/dbraw/zinc/68/12/53/1043681253.db2.gz URADSVAYRPAYTI-SJORKVTESA-N 0 1 307.388 4.136 20 0 DIADMN COCCN(Cc1ccc(C)o1)Cc1ccc(OC(C)C)cc1 ZINC000354126012 1043683344 /nfs/dbraw/zinc/68/33/44/1043683344.db2.gz HRHIXPPBVVQZPV-UHFFFAOYSA-N 0 1 317.429 4.024 20 0 DIADMN C[C@@H](NCc1cc(C2CC2)nn1C)c1cc(Cl)cc(Cl)c1 ZINC000927099615 1043687152 /nfs/dbraw/zinc/68/71/52/1043687152.db2.gz QOJNQCNWLSHBFB-SNVBAGLBSA-N 0 1 324.255 4.455 20 0 DIADMN Cn1nc(CN[C@@H]2CCc3cccc4cccc2c43)cc1C1CC1 ZINC000927111462 1043689442 /nfs/dbraw/zinc/68/94/42/1043689442.db2.gz ZPIUNBDPRHRLPJ-LJQANCHMSA-N 0 1 317.436 4.228 20 0 DIADMN Cc1nc2ccc(NC(=O)c3cccc(C(F)F)c3)cc2[nH]1 ZINC000354296719 1043691193 /nfs/dbraw/zinc/69/11/93/1043691193.db2.gz OPJWEZBNSZSTCK-UHFFFAOYSA-N 0 1 301.296 4.061 20 0 DIADMN C[C@H](NCc1cc(C2CC2)n(C)n1)c1cccc2ccccc21 ZINC000927114702 1043691648 /nfs/dbraw/zinc/69/16/48/1043691648.db2.gz XAQOBXDWJLLOFW-AWEZNQCLSA-N 0 1 305.425 4.302 20 0 DIADMN CCc1onc(C)c1CN[C@H](c1cccnc1)C1CCCCC1 ZINC000927134094 1043695086 /nfs/dbraw/zinc/69/50/86/1043695086.db2.gz HBBXSZOATPRFCE-IBGZPJMESA-N 0 1 313.445 4.352 20 0 DIADMN CCc1onc(C)c1CN[C@@H]1C[C@H](C)Sc2sccc21 ZINC000927138269 1043696578 /nfs/dbraw/zinc/69/65/78/1043696578.db2.gz DOGWBSTZXXMUQY-TVQRCGJNSA-N 0 1 308.472 4.322 20 0 DIADMN CCc1onc(C)c1CN[C@H]1CCSc2cc(C)c(C)cc21 ZINC000927135379 1043696951 /nfs/dbraw/zinc/69/69/51/1043696951.db2.gz RWRGFFYQEJYOMV-INIZCTEOSA-N 0 1 316.470 4.489 20 0 DIADMN CCc1onc(C)c1CN[C@H](CC)c1ccc2c(c1)CCCO2 ZINC000927138838 1043697241 /nfs/dbraw/zinc/69/72/41/1043697241.db2.gz HPIHWBUTKNFJMZ-QGZVFWFLSA-N 0 1 314.429 4.111 20 0 DIADMN CCc1onc(C)c1CN[C@@H](C)c1cccc(-c2ccncc2)c1 ZINC000927139614 1043697285 /nfs/dbraw/zinc/69/72/85/1043697285.db2.gz MICGYQLEQLBFAI-AWEZNQCLSA-N 0 1 321.424 4.458 20 0 DIADMN CCc1onc(C)c1CN[C@H](c1ccc(F)c(C)c1)C1CC1 ZINC000927138545 1043697603 /nfs/dbraw/zinc/69/76/03/1043697603.db2.gz FVMUOBPGSQRPSG-SFHVURJKSA-N 0 1 302.393 4.234 20 0 DIADMN CCc1onc(C)c1CN[C@H](C)c1ccc(-c2ccncc2)cc1 ZINC000927138158 1043697749 /nfs/dbraw/zinc/69/77/49/1043697749.db2.gz CULQFBXWLCWRBH-CQSZACIVSA-N 0 1 321.424 4.458 20 0 DIADMN Cc1ncc([C@@H](C)N[C@@H](C)c2cc(Cl)cc3c2OCC3)s1 ZINC000927140377 1043698082 /nfs/dbraw/zinc/69/80/82/1043698082.db2.gz NIZPJLNEZHNZAM-VHSXEESVSA-N 0 1 322.861 4.452 20 0 DIADMN C[C@@H](N[C@H]1c2ccccc2CC[C@H]1O)c1csc(Cl)c1 ZINC000927142121 1043699547 /nfs/dbraw/zinc/69/95/47/1043699547.db2.gz YWNVSVQUWGPERY-HQQWDMGQSA-N 0 1 307.846 4.101 20 0 DIADMN CC(C)N(Cc1cnc2c(F)cccc2c1)Cc1ccccn1 ZINC000876624444 1043700779 /nfs/dbraw/zinc/70/07/79/1043700779.db2.gz MGUOWWBBWVSPOB-UHFFFAOYSA-N 0 1 309.388 4.180 20 0 DIADMN CCCN(Cc1cc2c(cc[nH]c2=O)o1)Cc1ccc(F)cc1 ZINC000876593393 1043700949 /nfs/dbraw/zinc/70/09/49/1043700949.db2.gz GFYOECRLHWIDQZ-UHFFFAOYSA-N 0 1 314.360 4.085 20 0 DIADMN COc1ccc(C2CC2)cc1CNCc1c(C)cccc1OC ZINC000895537858 1043702565 /nfs/dbraw/zinc/70/25/65/1043702565.db2.gz VXRQGPCCIJAWDV-UHFFFAOYSA-N 0 1 311.425 4.179 20 0 DIADMN CC(C)CCOCCN1CCCC[C@H]1c1nc2ccccc2o1 ZINC000474231177 1043705471 /nfs/dbraw/zinc/70/54/71/1043705471.db2.gz YWNOKWABFZDJGM-KRWDZBQOSA-N 0 1 316.445 4.418 20 0 DIADMN COC(=O)c1ccoc1CN1CCC[C@@H]1c1cc(C)ccc1C ZINC000474226782 1043706049 /nfs/dbraw/zinc/70/60/49/1043706049.db2.gz CPSQMGJMFSGCCY-QGZVFWFLSA-N 0 1 313.397 4.020 20 0 DIADMN Cc1cccc([C@H]2CCC[N@H+]2Cc2cc3c(cc[nH]c3=O)o2)c1C ZINC000876765079 1043708282 /nfs/dbraw/zinc/70/82/82/1043708282.db2.gz ZFYSAVIMZYZOLO-GOSISDBHSA-N 0 1 322.408 4.487 20 0 DIADMN Cc1cc(CN[C@H](c2ccccn2)C2CCC2)c2c(n1)CCCC2 ZINC000895581269 1043709580 /nfs/dbraw/zinc/70/95/80/1043709580.db2.gz OUHCERGOXSKZNC-NRFANRHFSA-N 0 1 321.468 4.295 20 0 DIADMN COc1cccc(CNC(C)(C)c2ccc(F)c(F)c2)c1F ZINC000192693408 1043710579 /nfs/dbraw/zinc/71/05/79/1043710579.db2.gz KTKQYRWBUKJBCV-UHFFFAOYSA-N 0 1 309.331 4.137 20 0 DIADMN Cc1ccc(CCCN2C[C@H](c3ccccc3C)OC[C@@H]2C)cn1 ZINC000474260106 1043714154 /nfs/dbraw/zinc/71/41/54/1043714154.db2.gz XYWQCPZLPCJWOB-GHTZIAJQSA-N 0 1 324.468 4.093 20 0 DIADMN Cc1nc(CC[N@@H+]2[C@H](C)c3ccc(F)cc3C[C@@H]2C)cs1 ZINC000354830173 1043720785 /nfs/dbraw/zinc/72/07/85/1043720785.db2.gz JRIVFZYZRMLUQB-NWDGAFQWSA-N 0 1 304.434 4.141 20 0 DIADMN COc1c(C)cnc(CN[C@H]2CCSc3ccccc32)c1C ZINC000876885416 1043721721 /nfs/dbraw/zinc/72/17/21/1043721721.db2.gz PDVLUONENBBMCI-HNNXBMFYSA-N 0 1 314.454 4.034 20 0 DIADMN Clc1nccc2oc(CN3CCC4(CCCCO4)CC3)cc21 ZINC000895655769 1043726194 /nfs/dbraw/zinc/72/61/94/1043726194.db2.gz LGTRPRPMYDKJAK-UHFFFAOYSA-N 0 1 320.820 4.016 20 0 DIADMN Clc1nccc2oc(CN[C@@H]3CCCc4occc43)cc21 ZINC000876928639 1043726952 /nfs/dbraw/zinc/72/69/52/1043726952.db2.gz AJXCPIKVCXGECN-CYBMUJFWSA-N 0 1 302.761 4.241 20 0 DIADMN COc1cc(CN[C@@H](C)c2ccc(C)s2)c(Cl)cc1O ZINC000876964658 1043728740 /nfs/dbraw/zinc/72/87/40/1043728740.db2.gz LZJSVDBZGFRCFT-JTQLQIEISA-N 0 1 311.834 4.275 20 0 DIADMN Fc1ccc([C@H](NCc2ccc(Cl)nn2)C2CCCC2)cc1 ZINC000876975497 1043729917 /nfs/dbraw/zinc/72/99/17/1043729917.db2.gz IMSUPKSTBQHSCR-QGZVFWFLSA-N 0 1 319.811 4.290 20 0 DIADMN CC(C)(C)[C@@H](NCc1ccc(Cl)nn1)c1ccc(F)cc1 ZINC000876991367 1043730218 /nfs/dbraw/zinc/73/02/18/1043730218.db2.gz MIVSYSGYJDKYTL-HNNXBMFYSA-N 0 1 307.800 4.146 20 0 DIADMN Cc1[nH]nc2cc(NC(=O)[C@H]3CCSc4ccccc43)ccc12 ZINC000354999576 1043736734 /nfs/dbraw/zinc/73/67/34/1043736734.db2.gz ILSSBHIWCQGISV-HNNXBMFYSA-N 0 1 323.421 4.089 20 0 DIADMN C[C@@H]1C[C@@H]1[C@@H](NCc1ccc(Cl)nn1)c1ccc(Cl)cc1 ZINC000877043276 1043737683 /nfs/dbraw/zinc/73/76/83/1043737683.db2.gz IMAPQEZSHQYGTE-OOVXXXAESA-N 0 1 322.239 4.270 20 0 DIADMN Cc1ccccc1[C@@H](NCc1ccc(Cl)nn1)C(C)(C)C ZINC000877082532 1043742370 /nfs/dbraw/zinc/74/23/70/1043742370.db2.gz WVKWSOHFZBFOGV-MRXNPFEDSA-N 0 1 303.837 4.315 20 0 DIADMN Clc1nccc2oc(CN[C@@H](c3cccnc3)C3CC3)cc21 ZINC000877123869 1043746813 /nfs/dbraw/zinc/74/68/13/1043746813.db2.gz PZRAGISSLDUZFU-MRXNPFEDSA-N 0 1 313.788 4.117 20 0 DIADMN CCc1cccc(Cl)c1CNCc1ccc(NC(C)=O)cc1 ZINC000474354802 1043746783 /nfs/dbraw/zinc/74/67/83/1043746783.db2.gz KRSSEUBUMCMISE-UHFFFAOYSA-N 0 1 316.832 4.151 20 0 DIADMN CC(C)C[C@H]1CCCN(Cc2csc(-c3ccccn3)n2)C1 ZINC000532091615 1043750031 /nfs/dbraw/zinc/75/00/31/1043750031.db2.gz GUFMDVRDJHSJEM-OAHLLOKOSA-N 0 1 315.486 4.463 20 0 DIADMN FC(F)c1ccc(CN2C[C@@H]3CCC[C@]3(C(F)(F)F)C2)cn1 ZINC000895788334 1043752517 /nfs/dbraw/zinc/75/25/17/1043752517.db2.gz PWGIRDNTWAMPQQ-FZMZJTMJSA-N 0 1 320.305 4.184 20 0 DIADMN C[C@H]1[C@@H](C(F)(F)F)CCN1Cc1cc2cc(F)ccc2o1 ZINC000355226719 1043753608 /nfs/dbraw/zinc/75/36/08/1043753608.db2.gz SFXYRUPSCGGTKQ-ZANVPECISA-N 0 1 301.283 4.345 20 0 DIADMN COCCCC[C@@H](NCc1nc2ccccc2[nH]1)c1ccccc1 ZINC000355334641 1043761885 /nfs/dbraw/zinc/76/18/85/1043761885.db2.gz RXXMMUHIPFFSKW-QGZVFWFLSA-N 0 1 323.440 4.211 20 0 DIADMN FC1(F)CCN(Cc2cc3nc(Cl)ccc3s2)CC1 ZINC000877492850 1043765742 /nfs/dbraw/zinc/76/57/42/1043765742.db2.gz VAAAPJCKMGUVFJ-UHFFFAOYSA-N 0 1 302.777 4.181 20 0 DIADMN C[C@H](Nc1ccc(CN(C)C)c(F)c1)c1ccc(F)cc1F ZINC000777702636 1043767013 /nfs/dbraw/zinc/76/70/13/1043767013.db2.gz ZKJFMMQANVODRJ-NSHDSACASA-N 0 1 308.347 4.339 20 0 DIADMN COc1cccc([C@@H](C)Nc2ccc(CN(C)C)c(F)c2)c1 ZINC000777699726 1043768243 /nfs/dbraw/zinc/76/82/43/1043768243.db2.gz FQOYZZDXLIMECI-CYBMUJFWSA-N 0 1 302.393 4.069 20 0 DIADMN Cc1sccc1CN(Cc1cccs1)C[C@H]1CCCO1 ZINC000350316359 1043768963 /nfs/dbraw/zinc/76/89/63/1043768963.db2.gz ZFDBKQAANMBWED-OAHLLOKOSA-N 0 1 307.484 4.299 20 0 DIADMN C[C@@H](Nc1ccc(CN(C)C)c(F)c1)c1cccnc1Cl ZINC000777700190 1043769101 /nfs/dbraw/zinc/76/91/01/1043769101.db2.gz GBVGIODHNLWGNW-LLVKDONJSA-N 0 1 307.800 4.109 20 0 DIADMN COc1ccc([C@@H](C)Nc2ccc(CN(C)C)c(F)c2)cc1F ZINC000777699844 1043769244 /nfs/dbraw/zinc/76/92/44/1043769244.db2.gz DYUTZQJKOZODPJ-GFCCVEGCSA-N 0 1 320.383 4.208 20 0 DIADMN CN(C)Cc1ccc(N[C@H]2CCc3cc(F)ccc32)cc1F ZINC000777702195 1043770987 /nfs/dbraw/zinc/77/09/87/1043770987.db2.gz WBEFDXAIDCPEPC-SFHVURJKSA-N 0 1 302.368 4.126 20 0 DIADMN CCn1ccnc1[C@@H](C)NCc1cc2nc(Cl)ccc2s1 ZINC000877570060 1043777451 /nfs/dbraw/zinc/77/74/51/1043777451.db2.gz FNIUBFVQKABZBM-SNVBAGLBSA-N 0 1 320.849 4.017 20 0 DIADMN CCc1cc(C(=O)Nc2cc(F)cc(Cl)c2O)oc1CC ZINC000474429370 1043778671 /nfs/dbraw/zinc/77/86/71/1043778671.db2.gz FXMANOLLKUDPKV-UHFFFAOYSA-N 0 1 311.740 4.155 20 0 DIADMN CCO[P@@](C)(=O)CC[C@H](C)Nc1nccc(C)c1C1CC1 ZINC000877625665 1043781066 /nfs/dbraw/zinc/78/10/66/1043781066.db2.gz MQXXVQIZPFGBDH-YEJXKQKISA-N 0 1 310.378 4.402 20 0 DIADMN O=C(Nc1cc(F)cc(Cl)c1O)[C@@H](c1ccccc1)C1CC1 ZINC000474440268 1043780934 /nfs/dbraw/zinc/78/09/34/1043780934.db2.gz XROOOQFGIREIGU-HNNXBMFYSA-N 0 1 319.763 4.317 20 0 DIADMN Cc1cc(C(=O)Nc2cc(F)cc(Cl)c2O)cc(C)c1F ZINC000474436282 1043781452 /nfs/dbraw/zinc/78/14/52/1043781452.db2.gz DANNRGKEKXVXOB-UHFFFAOYSA-N 0 1 311.715 4.193 20 0 DIADMN C[C@H](C(=O)Nc1cc(F)cc(Cl)c1O)c1ccccc1F ZINC000474445031 1043782476 /nfs/dbraw/zinc/78/24/76/1043782476.db2.gz JZVBPEKPHZUQNM-QMMMGPOBSA-N 0 1 311.715 4.066 20 0 DIADMN CC[C@H](Nc1ccccc1)C(=O)Nc1cc(F)cc(Cl)c1O ZINC000474443702 1043782578 /nfs/dbraw/zinc/78/25/78/1043782578.db2.gz DYWRFLIBZRYHPW-ZDUSSCGKSA-N 0 1 322.767 4.014 20 0 DIADMN COc1cc(F)c([C@@H](C)NCc2ccc(CF)cc2)cc1OC ZINC000777722469 1043783252 /nfs/dbraw/zinc/78/32/52/1043783252.db2.gz SIJMVHOQKVULPW-GFCCVEGCSA-N 0 1 321.367 4.163 20 0 DIADMN C[C@@H]1CN(Cc2cc3c(ccnc3Cl)o2)C[C@@H](C)C1(F)F ZINC000877650937 1043783757 /nfs/dbraw/zinc/78/37/57/1043783757.db2.gz UXJRSGQXIWSZSK-NXEZZACHSA-N 0 1 314.763 4.204 20 0 DIADMN c1c(CN[C@H]2CCc3cccc4cccc2c43)nn2c1CCCC2 ZINC000895935098 1043785767 /nfs/dbraw/zinc/78/57/67/1043785767.db2.gz OELKESXTUWLPET-FQEVSTJZSA-N 0 1 317.436 4.150 20 0 DIADMN C[C@H](c1cccc(Cl)c1)N(C)CC[S@@](=O)c1ccccc1 ZINC000355754432 1043786956 /nfs/dbraw/zinc/78/69/56/1043786956.db2.gz UALHCXXJYKCOIA-SPLOXXLWSA-N 0 1 321.873 4.141 20 0 DIADMN 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Cc1ccc(-c2n[nH]c(SCc3ccc(Cl)cn3)n2)cc1 ZINC000567301250 1044557979 /nfs/dbraw/zinc/55/79/79/1044557979.db2.gz SGPLCOFUEYNSGV-UHFFFAOYSA-N 0 1 316.817 4.121 20 0 DIADMN Cc1noc([C@H](C)N[C@@H]2CC[C@H](c3ccc(Cl)cc3)C2)n1 ZINC000567322357 1044558282 /nfs/dbraw/zinc/55/82/82/1044558282.db2.gz JSYDUCWFXFDEBG-VZJVUDMVSA-N 0 1 305.809 4.018 20 0 DIADMN Clc1ccc2c(n1)CCC[C@@H]2N[C@H]1CCOc2ccccc21 ZINC000295785211 1044560148 /nfs/dbraw/zinc/56/01/48/1044560148.db2.gz BFPFXWLCYDWOSM-HOCLYGCPSA-N 0 1 314.816 4.226 20 0 DIADMN Cc1cnc([C@H](NCc2cc3ccc(F)cc3[nH]2)C2CC2)s1 ZINC000362923218 1044562742 /nfs/dbraw/zinc/56/27/42/1044562742.db2.gz IYLQLOJSPJSZKZ-MRXNPFEDSA-N 0 1 315.417 4.313 20 0 DIADMN C[C@@H]1CSC[C@H]1N[C@@H](c1cccc(Cl)c1)c1ccccn1 ZINC000295833967 1044563285 /nfs/dbraw/zinc/56/32/85/1044563285.db2.gz VLRWKFZCNQXKJD-JLZZUVOBSA-N 0 1 318.873 4.166 20 0 DIADMN Clc1ccc([C@@H]2CCCN2CCc2cn[nH]c2)cc1Cl ZINC000567520213 1044569539 /nfs/dbraw/zinc/56/95/39/1044569539.db2.gz 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/nfs/dbraw/zinc/57/73/55/1044577355.db2.gz IKKMBRFQAKNMLG-HNNXBMFYSA-N 0 1 304.484 4.341 20 0 DIADMN CO[C@@H](C)CN(Cc1nc(C2CCCCC2)cs1)C(C)C ZINC000444647617 1044582616 /nfs/dbraw/zinc/58/26/16/1044582616.db2.gz HURATPXLFDHGNX-AWEZNQCLSA-N 0 1 310.507 4.436 20 0 DIADMN CO[C@@H]1CCN([C@@H](C)c2ncc(-c3ccccc3)o2)CC1(C)C ZINC000296056984 1044586476 /nfs/dbraw/zinc/58/64/76/1044586476.db2.gz OWFSVNVMLITEOB-WMLDXEAASA-N 0 1 314.429 4.150 20 0 DIADMN CC[C@@H](N[C@H](C)c1cnn(CC)c1)c1cc(C)ccc1OC ZINC000296070939 1044587401 /nfs/dbraw/zinc/58/74/01/1044587401.db2.gz WPYLEGDVMMTEGK-RHSMWYFYSA-N 0 1 301.434 4.022 20 0 DIADMN C[C@@H](c1nc(C2CC2)no1)N1CC[C@@H](c2ccccc2)[C@H](C)C1 ZINC000363169039 1044588668 /nfs/dbraw/zinc/58/86/68/1044588668.db2.gz JIWLBEBVWZYBBN-JKIFEVAISA-N 0 1 311.429 4.134 20 0 DIADMN Clc1cccc2ccc(CN3CC[C@]4(C3)CCCCO4)nc12 ZINC001137221082 1044590088 /nfs/dbraw/zinc/59/00/88/1044590088.db2.gz BAJHAMAJGGYVHD-SFHVURJKSA-N 0 1 316.832 4.033 20 0 DIADMN COC[C@H]1CCCCN(Cc2nc(C3CCCCC3)cs2)C1 ZINC000444686158 1044590605 /nfs/dbraw/zinc/59/06/05/1044590605.db2.gz RRCSMWFMYZYDRF-HNNXBMFYSA-N 0 1 322.518 4.439 20 0 DIADMN C[C@H](c1cnn(C)c1)N(C)Cc1ccc(-c2cccs2)cc1 ZINC000444687483 1044591104 /nfs/dbraw/zinc/59/11/04/1044591104.db2.gz GMIOZPDBYSOEOO-CQSZACIVSA-N 0 1 311.454 4.342 20 0 DIADMN CCCOc1ccc([C@@H](C)NCc2cc(C)co2)cc1OC ZINC000885923720 1044591669 /nfs/dbraw/zinc/59/16/69/1044591669.db2.gz BFGJZNDCPUDANC-CQSZACIVSA-N 0 1 303.402 4.236 20 0 DIADMN COc1ccc(CN[C@H]2CCCc3ccccc32)c(F)c1OC ZINC000885891870 1044591698 /nfs/dbraw/zinc/59/16/98/1044591698.db2.gz RNWNAORRIIJXHB-INIZCTEOSA-N 0 1 315.388 4.010 20 0 DIADMN CCOc1ccc([C@H](C)NCc2cc(C)co2)cc1OCC ZINC000885898488 1044592324 /nfs/dbraw/zinc/59/23/24/1044592324.db2.gz KULXEWAECBICPI-AWEZNQCLSA-N 0 1 303.402 4.236 20 0 DIADMN COc1ccc(CN[C@@H](C)c2cc(C)sc2C)c(F)c1OC ZINC000885916346 1044592642 /nfs/dbraw/zinc/59/26/42/1044592642.db2.gz XOVQSRGKOPXJEX-NSHDSACASA-N 0 1 323.433 4.372 20 0 DIADMN COc1cc(C)cc(CNCc2ccc(SC)cc2)c1OC ZINC000885940584 1044593278 /nfs/dbraw/zinc/59/32/78/1044593278.db2.gz MKDXEHYNPUIGJP-UHFFFAOYSA-N 0 1 317.454 4.024 20 0 DIADMN COc1ccc(CN[C@@H](C)c2ccc(C)s2)c(F)c1OC ZINC000885940641 1044593799 /nfs/dbraw/zinc/59/37/99/1044593799.db2.gz OAYPMWSJUCULPT-NSHDSACASA-N 0 1 309.406 4.064 20 0 DIADMN C[C@@H](c1ncc(-c2ccccc2)o1)N1CCC(c2cn[nH]c2)CC1 ZINC000363223517 1044595880 /nfs/dbraw/zinc/59/58/80/1044595880.db2.gz CWXAILJGOZOGTM-AWEZNQCLSA-N 0 1 322.412 4.005 20 0 DIADMN Cc1n[nH]c(CN[C@H](C)c2ccc(SC(C)C)cc2)c1C ZINC000885967324 1044596801 /nfs/dbraw/zinc/59/68/01/1044596801.db2.gz MBMDRGZEBGVRGG-CQSZACIVSA-N 0 1 303.475 4.378 20 0 DIADMN OC[C@@H](NCc1ccc(-c2ccsc2)cc1)c1ccccc1 ZINC000444673461 1044598449 /nfs/dbraw/zinc/59/84/49/1044598449.db2.gz MRUULOJEIVTBPX-LJQANCHMSA-N 0 1 309.434 4.238 20 0 DIADMN CCc1ccccc1CCN(Cc1ccco1)Cc1cccnc1 ZINC000444677548 1044600571 /nfs/dbraw/zinc/60/05/71/1044600571.db2.gz WKPNMOUETMOOOP-UHFFFAOYSA-N 0 1 320.436 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/nfs/dbraw/zinc/33/67/53/1046336753.db2.gz UHYOMVYWFGDQAX-MRXNPFEDSA-N 0 1 304.459 4.016 20 0 DIADMN O=C([O-])c1cncc(C[N@H+]2CCC[C@@H]2CCC2CCCCC2)c1 ZINC000903899020 1046336791 /nfs/dbraw/zinc/33/67/91/1046336791.db2.gz VGNBGZKBKGURCS-GOSISDBHSA-N 0 1 316.445 4.105 20 0 DIADMN CCCCOc1cccc(CN2CC[C@H](C(F)(F)F)C2)c1 ZINC001138953767 1046336805 /nfs/dbraw/zinc/33/68/05/1046336805.db2.gz IHLIYHPLYPHIJC-AWEZNQCLSA-N 0 1 301.352 4.250 20 0 DIADMN C[C@H]1C[N@@H+](Cc2cccc(C(=O)[O-])c2)CC[C@H]1c1ccccc1 ZINC000263489373 1046336966 /nfs/dbraw/zinc/33/69/66/1046336966.db2.gz QMJXHYPVMRDYAS-HNAYVOBHSA-N 0 1 309.409 4.010 20 0 DIADMN Clc1cnc2[nH]ccc2c1CN1CC=C(c2ccccc2)CC1 ZINC001138952807 1046337031 /nfs/dbraw/zinc/33/70/31/1046337031.db2.gz VKAKODSGRBVQFL-UHFFFAOYSA-N 0 1 323.827 4.457 20 0 DIADMN C[C@@H]1C[C@H](N[C@H](c2cccc(Cl)c2)c2ccccn2)CS1 ZINC000638738754 1046337428 /nfs/dbraw/zinc/33/74/28/1046337428.db2.gz OAWIWEMXDJKMFC-ISTRZQFTSA-N 0 1 318.873 4.308 20 0 DIADMN CC(C)Oc1ccc(Cl)cc1C[N@@H+]1C[C@H]2[C@H](CC2(F)F)C1 ZINC001138958250 1046337795 /nfs/dbraw/zinc/33/77/95/1046337795.db2.gz DSHSWQPEGFJOCF-OCCSQVGLSA-N 0 1 315.791 4.214 20 0 DIADMN CC(C)Oc1ccc(Cl)cc1CN1C[C@H]2[C@H](CC2(F)F)C1 ZINC001138958250 1046337804 /nfs/dbraw/zinc/33/78/04/1046337804.db2.gz DSHSWQPEGFJOCF-OCCSQVGLSA-N 0 1 315.791 4.214 20 0 DIADMN CCN(Cc1ccc(F)cc1)Cc1c2cc[nH]c2ncc1Cl ZINC001138952787 1046337950 /nfs/dbraw/zinc/33/79/50/1046337950.db2.gz USYAWRVBZYDXBG-UHFFFAOYSA-N 0 1 317.795 4.329 20 0 DIADMN CC1(C)CCC[N@@H+](Cc2occ(C(F)(F)F)c2C(=O)[O-])CC1 ZINC000903893971 1046338485 /nfs/dbraw/zinc/33/84/85/1046338485.db2.gz LVXDMFPFOVQLNS-UHFFFAOYSA-N 0 1 319.323 4.009 20 0 DIADMN CCC[C@@H](NCc1cccc(F)c1N)c1ccc(F)cc1F ZINC000638740910 1046338528 /nfs/dbraw/zinc/33/85/28/1046338528.db2.gz ATFAZZYHDZMJRF-MRXNPFEDSA-N 0 1 308.347 4.317 20 0 DIADMN C[C@H](NCc1ccc(OC(C)(C)C)cc1)c1cn2ccccc2n1 ZINC000655741087 1046339191 /nfs/dbraw/zinc/33/91/91/1046339191.db2.gz DTJXSSUSTPIRPD-HNNXBMFYSA-N 0 1 323.440 4.362 20 0 DIADMN C[C@@H]1C[C@H](C(=O)[O-])CC[N@H+]1Cc1ccc(-c2cccs2)cc1 ZINC000903938923 1046339307 /nfs/dbraw/zinc/33/93/07/1046339307.db2.gz HYTDMRUZWDOREB-CZUORRHYSA-N 0 1 315.438 4.100 20 0 DIADMN C[C@H](C[N@@H+](C)Cc1occ(C(F)(F)F)c1C(=O)[O-])C(C)(C)C ZINC000903912330 1046339600 /nfs/dbraw/zinc/33/96/00/1046339600.db2.gz AEKBMCPGIYHFFE-SECBINFHSA-N 0 1 321.339 4.111 20 0 DIADMN CC(C)c1ccccc1C[N@H+]1CC[C@H](C(=O)[O-])[C@H]2CCCC[C@@H]21 ZINC000903906172 1046339952 /nfs/dbraw/zinc/33/99/52/1046339952.db2.gz FCUKPMMAEWCYRK-QYZOEREBSA-N 0 1 315.457 4.275 20 0 DIADMN Cc1cc(C[N@H+]2C[C@H](c3ccccc3)CC2(C)C)oc1C(=O)[O-] ZINC000903933768 1046340205 /nfs/dbraw/zinc/34/02/05/1046340205.db2.gz GOADFEARABELFO-OAHLLOKOSA-N 0 1 313.397 4.054 20 0 DIADMN O=C([O-])CCC[N@H+](Cc1ccccc1)CC1CCC2(CC2)CC1 ZINC000903902041 1046340712 /nfs/dbraw/zinc/34/07/12/1046340712.db2.gz TYJQTTYUZSCURE-UHFFFAOYSA-N 0 1 315.457 4.324 20 0 DIADMN C/C=C\C[C@H]1CCC[N@@H+](Cc2ccc(C(=O)[O-])c3cccnc23)C1 ZINC000903911319 1046341061 /nfs/dbraw/zinc/34/10/61/1046341061.db2.gz BWLZGHCXSBNHIN-GWQWAINWSA-N 0 1 324.424 4.111 20 0 DIADMN COC[C@H]1CCCCN1Cc1cc(Cl)ccc1OC(C)C ZINC001138958775 1046341568 /nfs/dbraw/zinc/34/15/68/1046341568.db2.gz LOAKUJZYHOKFDI-MRXNPFEDSA-N 0 1 311.853 4.128 20 0 DIADMN C[C@@H]1C[C@H](C)[N@@H+](CCCc2ccccc2Cl)[C@@H](C)[C@H]1C(=O)[O-] ZINC000903953601 1046342538 /nfs/dbraw/zinc/34/25/38/1046342538.db2.gz ULNDEPZTZIDKMY-FHIRATQRSA-N 0 1 323.864 4.092 20 0 DIADMN Cc1cc([C@@H](N[C@H](c2nccn2C)C2CC2)C2CC2)ccc1F ZINC000638803530 1046342728 /nfs/dbraw/zinc/34/27/28/1046342728.db2.gz MNVOZYKHQUBIRV-ROUUACIJSA-N 0 1 313.420 4.060 20 0 DIADMN Cc1nnsc1CN[C@H]1C[C@H]2CCC(C)(C)c3cccc1c32 ZINC000638842632 1046344533 /nfs/dbraw/zinc/34/45/33/1046344533.db2.gz WVFMIXFHSKQITK-DOMZBBRYSA-N 0 1 313.470 4.236 20 0 DIADMN Cc1nnsc1CN[C@@H]1C[C@@H]2CCC(C)(C)c3cccc1c32 ZINC000638842634 1046344803 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CN(C[C@H]1CC1(C)C)C(=O)Nc1ccc2nc(C(F)F)[nH]c2c1 ZINC000666452812 1046350482 /nfs/dbraw/zinc/35/04/82/1046350482.db2.gz FYSHEUBHDGUCGT-SECBINFHSA-N 0 1 322.359 4.010 20 0 DIADMN CN(C[C@@H]1CC1(C)C)C(=O)Nc1ccc2nc(C(F)F)[nH]c2c1 ZINC000666452813 1046351346 /nfs/dbraw/zinc/35/13/46/1046351346.db2.gz FYSHEUBHDGUCGT-VIFPVBQESA-N 0 1 322.359 4.010 20 0 DIADMN CC(C)[N@@H+](CCCCc1ccc(Cl)c(Cl)c1)CC(=O)[O-] ZINC000263533427 1046353682 /nfs/dbraw/zinc/35/36/82/1046353682.db2.gz XWDDQMNJSKKKOH-UHFFFAOYSA-N 0 1 318.244 4.111 20 0 DIADMN CCOc1ccc(Cl)cc1CN1CC[C@H](c2ccccn2)C1 ZINC001139009229 1046354938 /nfs/dbraw/zinc/35/49/38/1046354938.db2.gz GRHAPDHIXFMXQL-AWEZNQCLSA-N 0 1 316.832 4.123 20 0 DIADMN CCCN([C@H](c1nccn1C)C1CC1)[C@@H]1CCCc2cccnc21 ZINC000639065523 1046355670 /nfs/dbraw/zinc/35/56/70/1046355670.db2.gz JLMBVXUVHNXBMW-MJGOQNOKSA-N 0 1 324.472 4.056 20 0 DIADMN CCCOC1CCN(Cc2cc(Cl)ccc2OCC)CC1 ZINC001139009928 1046355868 /nfs/dbraw/zinc/35/58/68/1046355868.db2.gz YPDMRTYLVJHMSJ-UHFFFAOYSA-N 0 1 311.853 4.130 20 0 DIADMN CC[C@@](C)(NC(=O)Nc1ccc2nc(C(F)F)[nH]c2c1)C1CC1 ZINC000666454013 1046356159 /nfs/dbraw/zinc/35/61/59/1046356159.db2.gz YDFMRQUQEBVKDD-MRXNPFEDSA-N 0 1 322.359 4.201 20 0 DIADMN Cc1ncc([C@@H](C)N2CC[C@@H](C(F)(F)F)C(C)(C)C2)c(C)n1 ZINC000639097495 1046358577 /nfs/dbraw/zinc/35/85/77/1046358577.db2.gz BFZXIPAGCUXNKM-BXUZGUMPSA-N 0 1 315.383 4.065 20 0 DIADMN C[C@@H](N[C@H](C)[C@@H]1C[C@H]1c1ccccc1)c1nc(C(C)(C)C)no1 ZINC000639098475 1046359982 /nfs/dbraw/zinc/35/99/82/1046359982.db2.gz PNVIZFBTAWXRSZ-VDERGJSUSA-N 0 1 313.445 4.210 20 0 DIADMN Cc1ccc([C@H](N[C@@H](C)[C@@H]2CC2(F)F)c2ccccn2)cc1 ZINC000639121038 1046362375 /nfs/dbraw/zinc/36/23/75/1046362375.db2.gz XHDMXPGHXQPSJD-QRTARXTBSA-N 0 1 302.368 4.113 20 0 DIADMN Cc1ccncc1CN(C)Cc1ccc(CC(F)(F)F)cc1 ZINC000639125340 1046362452 /nfs/dbraw/zinc/36/24/52/1046362452.db2.gz SCFJBRGEPUBPNB-UHFFFAOYSA-N 0 1 308.347 4.127 20 0 DIADMN Cc1cc(CN2CC[C@@H](C(F)(F)F)C3(CCC3)C2)sn1 ZINC000639142744 1046363209 /nfs/dbraw/zinc/36/32/09/1046363209.db2.gz MAYKPKMJZNRGKB-GFCCVEGCSA-N 0 1 304.381 4.006 20 0 DIADMN Cc1cnc(CN[C@H]2C[C@H](c3ccc(C(F)(F)F)cc3)C2)o1 ZINC000639147544 1046363549 /nfs/dbraw/zinc/36/35/49/1046363549.db2.gz SQVIUCYGWPVNQD-MQMHXKEQSA-N 0 1 310.319 4.038 20 0 DIADMN C[C@H](NCc1nc(-c2ccccc2F)cs1)[C@H]1CC1(F)F ZINC000639134001 1046363920 /nfs/dbraw/zinc/36/39/20/1046363920.db2.gz QPFCZHKXJUSEIG-GXSJLCMTSA-N 0 1 312.360 4.083 20 0 DIADMN COc1ccccc1-c1ccc(CN2CCCC(=O)[C@@H](C)C2)cc1 ZINC001139033895 1046365682 /nfs/dbraw/zinc/36/56/82/1046365682.db2.gz NTAHPXNLHKFGSA-INIZCTEOSA-N 0 1 323.436 4.163 20 0 DIADMN Cc1n[nH]c(C)c1[C@H]1CCCCCN1Cc1cc(C2CC2)no1 ZINC000639177176 1046366303 /nfs/dbraw/zinc/36/63/03/1046366303.db2.gz PXLLFXIQTGKGLQ-QGZVFWFLSA-N 0 1 314.433 4.009 20 0 DIADMN Cn1ccnc1[C@@H](C1CC1)N1CC[C@@H](c2cccc(Cl)c2)C1 ZINC000639206052 1046370968 /nfs/dbraw/zinc/37/09/68/1046370968.db2.gz FCRANYVRJSENDY-NVXWUHKLSA-N 0 1 315.848 4.014 20 0 DIADMN Cc1ncc([C@H](C)N2CC3(CCC3)[C@@H]2c2ccccc2)c(C)n1 ZINC000639205815 1046372884 /nfs/dbraw/zinc/37/28/84/1046372884.db2.gz CFMKKMMGWMMZCP-KXBFYZLASA-N 0 1 307.441 4.382 20 0 DIADMN Fc1ccc(-c2cccc(CN3CCCCC34COC4)c2)cc1 ZINC001139066890 1046374754 /nfs/dbraw/zinc/37/47/54/1046374754.db2.gz JMZIXQPZZUSWML-UHFFFAOYSA-N 0 1 311.400 4.248 20 0 DIADMN COc1ccc(-c2ccccc2)cc1CN1C[C@@H]2C[C@@H]2[C@H](F)C1 ZINC001139068500 1046374800 /nfs/dbraw/zinc/37/48/00/1046374800.db2.gz UNCDLJNFWOKRBE-YTQUADARSA-N 0 1 311.400 4.152 20 0 DIADMN Cc1ccc(CN[C@H](c2cccs2)C(C)(C)CO)c(F)c1 ZINC000639245305 1046375188 /nfs/dbraw/zinc/37/51/88/1046375188.db2.gz WXGMYJYVKSVHMU-MRXNPFEDSA-N 0 1 307.434 4.045 20 0 DIADMN CC=C(C=CC(=O)Nc1ccc2nc(C(F)F)[nH]c2c1)CC ZINC000759743899 1046375501 /nfs/dbraw/zinc/37/55/01/1046375501.db2.gz HGRILIKXSKYGAA-ZVBUZHGDSA-N 0 1 305.328 4.352 20 0 DIADMN CC=C(C=CC(=O)Nc1ccc2nc(C(F)F)[nH]c2c1)CC ZINC000759743897 1046375822 /nfs/dbraw/zinc/37/58/22/1046375822.db2.gz HGRILIKXSKYGAA-IKJNXXLOSA-N 0 1 305.328 4.352 20 0 DIADMN C/C(=C/C(=O)Nc1ccc2nc(C(F)F)[nH]c2c1)C(C)(C)C ZINC000759746880 1046376409 /nfs/dbraw/zinc/37/64/09/1046376409.db2.gz RINBYKOGGMIGLE-CLFYSBASSA-N 0 1 307.344 4.431 20 0 DIADMN CCCCC(CCCC)NCc1nn(C)cc1Br ZINC001258380204 1046377496 /nfs/dbraw/zinc/37/74/96/1046377496.db2.gz DYKKKUMTZWYQIL-UHFFFAOYSA-N 0 1 316.287 4.021 20 0 DIADMN Fc1ccc(-c2cccc(CN3CCOC[C@H]3C3CC3)c2)cc1 ZINC001139069408 1046379278 /nfs/dbraw/zinc/37/92/78/1046379278.db2.gz JZJGGRXOHORVES-FQEVSTJZSA-N 0 1 311.400 4.104 20 0 DIADMN Oc1ccc(Br)c(CN[C@H]2C[C@H]2C2CCCCC2)c1 ZINC001308296308 1046383361 /nfs/dbraw/zinc/38/33/61/1046383361.db2.gz YGOUBZFIMARWBZ-HOCLYGCPSA-N 0 1 324.262 4.213 20 0 DIADMN c1ccc([C@H]2CCN2Cc2ccc(Oc3ncccn3)cc2)cc1 ZINC001139081488 1046383426 /nfs/dbraw/zinc/38/34/26/1046383426.db2.gz LHNBAJXQSOYYKB-LJQANCHMSA-N 0 1 317.392 4.216 20 0 DIADMN Cc1cc(CN[C@@H](CCc2ccccc2)c2ccccn2)sn1 ZINC000639363339 1046384702 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WMCHCUGPQXCCRR-ZDUSSCGKSA-N 0 1 308.472 4.121 20 0 DIADMN COc1ccc(CN(C(C)C)[C@@H](C)c2ccccc2)c(OC)n1 ZINC001139922700 1046551990 /nfs/dbraw/zinc/55/19/90/1046551990.db2.gz AJXCRVOOFMUVBZ-HNNXBMFYSA-N 0 1 314.429 4.070 20 0 DIADMN CCOc1cc(C)ccc1CN[C@@H](C)c1ccc(Cl)nc1 ZINC000179139298 1046553068 /nfs/dbraw/zinc/55/30/68/1046553068.db2.gz SPBIFLAOTBAGAR-ZDUSSCGKSA-N 0 1 304.821 4.293 20 0 DIADMN CSC[C@@H]1CCCN1Cc1csc(-c2ccsc2)n1 ZINC000135446575 1046554599 /nfs/dbraw/zinc/55/45/99/1046554599.db2.gz KIIKGGNSVKLKLN-ZDUSSCGKSA-N 0 1 310.513 4.199 20 0 DIADMN CCN(Cc1ccc(Cl)s1)Cc1[nH]nc2ccccc21 ZINC000678124804 1046557650 /nfs/dbraw/zinc/55/76/50/1046557650.db2.gz JSGIYZYFHKHHBO-UHFFFAOYSA-N 0 1 305.834 4.300 20 0 DIADMN Clc1ccc(CN2CCC[C@H](c3nc4ccccc4o3)C2)o1 ZINC000678132945 1046560716 /nfs/dbraw/zinc/56/07/16/1046560716.db2.gz RLRLQYZWHJFXAA-LBPRGKRZSA-N 0 1 316.788 4.454 20 0 DIADMN CN(Cc1[nH]nc2ccccc21)Cc1ccccc1C(F)(F)F ZINC000678132050 1046560895 /nfs/dbraw/zinc/56/08/95/1046560895.db2.gz WJKQYNKTKRTGBU-UHFFFAOYSA-N 0 1 319.330 4.214 20 0 DIADMN CN(Cc1nn(C)c2ccccc12)Cc1cccc2ccccc21 ZINC000678133004 1046562535 /nfs/dbraw/zinc/56/25/35/1046562535.db2.gz RPPRNQOTXFRPTR-UHFFFAOYSA-N 0 1 315.420 4.359 20 0 DIADMN C[C@H](CN[C@@H](c1ncc[nH]1)c1ccccc1)c1cccc(F)c1 ZINC000783220770 1046563551 /nfs/dbraw/zinc/56/35/51/1046563551.db2.gz AQAPIOGCTCRJJD-RDTXWAMCSA-N 0 1 309.388 4.032 20 0 DIADMN Cc1ccc(C)c([C@@H](C)N(C)Cc2nn(C)c3ccccc23)c1 ZINC000678136330 1046563903 /nfs/dbraw/zinc/56/39/03/1046563903.db2.gz GCPVLFKRCCJCJA-MRXNPFEDSA-N 0 1 307.441 4.383 20 0 DIADMN Fc1cccc(O[C@@H]2CC[N@@H+](Cc3cc4ccccc4cn3)C2)c1 ZINC001140003433 1046565341 /nfs/dbraw/zinc/56/53/41/1046565341.db2.gz RLWFOTMPMUTMQS-HXUWFJFHSA-N 0 1 322.383 4.027 20 0 DIADMN C[C@H](c1cc(F)ccc1F)N(C)Cc1[nH]nc2ccccc21 ZINC000678136384 1046565701 /nfs/dbraw/zinc/56/57/01/1046565701.db2.gz HCCFLIYCPWCSCO-LLVKDONJSA-N 0 1 301.340 4.034 20 0 DIADMN c1ccc2cc(CN3CCOC[C@H]3C3CCCCC3)ncc2c1 ZINC001140000183 1046565574 /nfs/dbraw/zinc/56/55/74/1046565574.db2.gz FZDBUWYUFXWJJD-FQEVSTJZSA-N 0 1 310.441 4.016 20 0 DIADMN Cc1ccc([C@H](C)N(C)Cc2cn3cccc(F)c3n2)c(C)c1 ZINC000678137871 1046565914 /nfs/dbraw/zinc/56/59/14/1046565914.db2.gz WDDBSWPCGGGTFF-HNNXBMFYSA-N 0 1 311.404 4.283 20 0 DIADMN CN(CCOc1ccccc1Cl)Cc1cnc(C2CC2)s1 ZINC000536630640 1046567046 /nfs/dbraw/zinc/56/70/46/1046567046.db2.gz WIKOYLJFRYINFJ-UHFFFAOYSA-N 0 1 322.861 4.185 20 0 DIADMN CC[C@@H](NCc1ccc(C(=O)OC)o1)c1cccc2ccccc21 ZINC000783243708 1046567610 /nfs/dbraw/zinc/56/76/10/1046567610.db2.gz BBNQYIWXYBZEGA-GOSISDBHSA-N 0 1 323.392 4.460 20 0 DIADMN C[C@H]1C[C@@H]1c1ccc(CNCc2ccc3c(c2)CC(C)(C)O3)o1 ZINC000729677986 1046572781 /nfs/dbraw/zinc/57/27/81/1046572781.db2.gz MCJBVZNOAKOMPD-GUYCJALGSA-N 0 1 311.425 4.406 20 0 DIADMN CCCCN(Cc1cc(C(N)=O)cs1)[C@@H](C)c1ccc(C)o1 ZINC000678161807 1046574065 /nfs/dbraw/zinc/57/40/65/1046574065.db2.gz BLQHWQXZZWFCKH-ZDUSSCGKSA-N 0 1 320.458 4.112 20 0 DIADMN CCCCN(Cc1ccccc1)Cc1ccnc(SC)n1 ZINC001140037926 1046574178 /nfs/dbraw/zinc/57/41/78/1046574178.db2.gz IHBYZRLIMMYNQQ-UHFFFAOYSA-N 0 1 301.459 4.001 20 0 DIADMN C[C@H](Cc1ccccc1F)Nc1ccc(CN(C)C)c(F)c1 ZINC000783288011 1046575942 /nfs/dbraw/zinc/57/59/42/1046575942.db2.gz SUOIYTMJEYCNIQ-CYBMUJFWSA-N 0 1 304.384 4.070 20 0 DIADMN CCC[C@@H](NCc1cc2cccc(OC)c2o1)c1ccccn1 ZINC000729678673 1046576576 /nfs/dbraw/zinc/57/65/76/1046576576.db2.gz FFYRFHHQDLLWIH-MRXNPFEDSA-N 0 1 310.397 4.467 20 0 DIADMN Fc1ccc2c(c1)[C@H](NCc1ccc3ncccc3c1)CCCO2 ZINC000193693715 1046580414 /nfs/dbraw/zinc/58/04/14/1046580414.db2.gz WLVLVEJRPMSQQT-LJQANCHMSA-N 0 1 322.383 4.377 20 0 DIADMN Cn1nc(CN(C2CC2)[C@H]2CCc3ccccc32)c2ccccc21 ZINC000678195999 1046582082 /nfs/dbraw/zinc/58/20/82/1046582082.db2.gz IBFJAHUBGPRCGV-NRFANRHFSA-N 0 1 317.436 4.225 20 0 DIADMN CCCn1c(C)nn(C[N@H+]2CCC[C@@H]2C2CCCCC2)c1=S ZINC000760266905 1046582362 /nfs/dbraw/zinc/58/23/62/1046582362.db2.gz FTJXTORTSLZJQL-MRXNPFEDSA-N 0 1 322.522 4.135 20 0 DIADMN CCCn1c(C)nn(CN2CCC[C@@H]2C2CCCCC2)c1=S ZINC000760266905 1046582379 /nfs/dbraw/zinc/58/23/79/1046582379.db2.gz FTJXTORTSLZJQL-MRXNPFEDSA-N 0 1 322.522 4.135 20 0 DIADMN CCCN(CCC)Cc1cnc(Br)cc1Cl ZINC001140074795 1046583166 /nfs/dbraw/zinc/58/31/66/1046583166.db2.gz SYQNVHUDZVIQKW-UHFFFAOYSA-N 0 1 305.647 4.120 20 0 DIADMN COc1ccc([C@@H]2CCCN2Cc2ccc(O)cc2Cl)cc1 ZINC001140085974 1046583984 /nfs/dbraw/zinc/58/39/84/1046583984.db2.gz GZUXJQSOFMYNQF-SFHVURJKSA-N 0 1 317.816 4.391 20 0 DIADMN CCc1nc([C@@H]2CCCCN2C[C@@H](CC)c2ccccc2)no1 ZINC000678201305 1046584202 /nfs/dbraw/zinc/58/42/02/1046584202.db2.gz STMLBIATLLOARD-WBVHZDCISA-N 0 1 313.445 4.353 20 0 DIADMN C[C@H](OC(=O)[C@@H]1CCCCS1)c1nc2ccc(Cl)cc2[nH]1 ZINC000783376606 1046585404 /nfs/dbraw/zinc/58/54/04/1046585404.db2.gz DSGSRUZEJUGGTB-ZANVPECISA-N 0 1 324.833 4.106 20 0 DIADMN CCN(CCC(F)(F)F)Cc1cccc(OC(F)(F)F)c1 ZINC000678222085 1046589635 /nfs/dbraw/zinc/58/96/35/1046589635.db2.gz HXTGXPWJSCTPIH-UHFFFAOYSA-N 0 1 315.257 4.360 20 0 DIADMN CCOCOc1ccc(CN(C)[C@H](C)c2ccccc2F)cc1 ZINC000783397995 1046590194 /nfs/dbraw/zinc/59/01/94/1046590194.db2.gz IIVRRSZXDJMLNR-OAHLLOKOSA-N 0 1 317.404 4.392 20 0 DIADMN C[C@@H]1CN(Cc2nccc3ccccc32)C[C@H](c2ccccc2)O1 ZINC000678214576 1046590477 /nfs/dbraw/zinc/59/04/77/1046590477.db2.gz SMWWELLEXRZRTP-IIBYNOLFSA-N 0 1 318.420 4.197 20 0 DIADMN C[C@H]1CN(Cc2nccc3ccccc32)C[C@H](c2ccccc2)O1 ZINC000678214574 1046591126 /nfs/dbraw/zinc/59/11/26/1046591126.db2.gz SMWWELLEXRZRTP-HRAATJIYSA-N 0 1 318.420 4.197 20 0 DIADMN C[C@@H](c1cc(F)ccc1F)N1CCC[C@H](c2nccs2)C1 ZINC000195358572 1046591994 /nfs/dbraw/zinc/59/19/94/1046591994.db2.gz ZKFUVZPMKZWCBY-RYUDHWBXSA-N 0 1 308.397 4.362 20 0 DIADMN Cc1cccc2c(CN3CC(C)C3)cn(C(=O)OC(C)(C)C)c21 ZINC001140117862 1046593643 /nfs/dbraw/zinc/59/36/43/1046593643.db2.gz AFZWJPCZZMEHMF-UHFFFAOYSA-N 0 1 314.429 4.185 20 0 DIADMN CCOCOc1ccc(CN([C@H](C)c2ccco2)C2CC2)cc1 ZINC000783436824 1046594174 /nfs/dbraw/zinc/59/41/74/1046594174.db2.gz APOPGOXNOIQFJH-OAHLLOKOSA-N 0 1 315.413 4.378 20 0 DIADMN Fc1ccc(CNCc2ccnc(Oc3ccccc3)c2)cc1 ZINC000642341306 1046599510 /nfs/dbraw/zinc/59/95/10/1046599510.db2.gz JUMCVNSESGNHTB-UHFFFAOYSA-N 0 1 308.356 4.303 20 0 DIADMN CCc1cccc2c1OCC[C@H]2NCc1cnc2ccccc2c1 ZINC000729684652 1046600025 /nfs/dbraw/zinc/60/00/25/1046600025.db2.gz AATJGMMFMMNPSI-HXUWFJFHSA-N 0 1 318.420 4.411 20 0 DIADMN C[C@@H]1CN(Cc2c[nH]nc2-c2ccsc2)Cc2ccccc21 ZINC000783512278 1046602492 /nfs/dbraw/zinc/60/24/92/1046602492.db2.gz YHBQXOOTEZBIRR-CYBMUJFWSA-N 0 1 309.438 4.258 20 0 DIADMN Cc1cc(C)cc(CN(C)[C@@H](C)c2ccc([S@@](C)=O)cc2)c1 ZINC000245465900 1046604831 /nfs/dbraw/zinc/60/48/31/1046604831.db2.gz IYENECNSJSRXNG-KSFYIVLOSA-N 0 1 315.482 4.234 20 0 DIADMN OCCCN(Cc1cscc1Cl)[C@H]1CCc2ccccc21 ZINC000678264855 1046604888 /nfs/dbraw/zinc/60/48/88/1046604888.db2.gz MFLFEFZUGVFWTQ-KRWDZBQOSA-N 0 1 321.873 4.273 20 0 DIADMN C[N@@H+](Cc1ccc(-c2ccncc2)cc1)Cc1ccc(Cl)nc1 ZINC001140171804 1046605554 /nfs/dbraw/zinc/60/55/54/1046605554.db2.gz YBAAEBPNGBCVJP-UHFFFAOYSA-N 0 1 323.827 4.429 20 0 DIADMN CN(Cc1ccc(-c2ccncc2)cc1)Cc1ccc(Cl)nc1 ZINC001140171804 1046605559 /nfs/dbraw/zinc/60/55/59/1046605559.db2.gz YBAAEBPNGBCVJP-UHFFFAOYSA-N 0 1 323.827 4.429 20 0 DIADMN Cc1cc(CN(C)[C@H](C)c2ccc([S@@](C)=O)cc2)c(C)s1 ZINC000245469002 1046606901 /nfs/dbraw/zinc/60/69/01/1046606901.db2.gz LGUDEZMXOHYBPX-LRTDBIEQSA-N 0 1 321.511 4.295 20 0 DIADMN COc1cccc(CN2C3CCCC2CCC3)c1OC(F)F ZINC000678278689 1046608980 /nfs/dbraw/zinc/60/89/80/1046608980.db2.gz FKMFUKRDEFSPBO-UHFFFAOYSA-N 0 1 311.372 4.204 20 0 DIADMN c1ccc2c(c1)[nH]c1c2CCN(C[C@H]2CCOc3ccccc32)C1 ZINC000678284274 1046610650 /nfs/dbraw/zinc/61/06/50/1046610650.db2.gz AIMYPVXPOAQKKW-OAHLLOKOSA-N 0 1 318.420 4.092 20 0 DIADMN O[C@H](CN1CC2(CCC2)[C@H]1c1ccccc1)c1ccccc1F ZINC000834379065 1046611235 /nfs/dbraw/zinc/61/12/35/1046611235.db2.gz UMYFWXCQMQWGEB-RTBURBONSA-N 0 1 311.400 4.086 20 0 DIADMN O[C@@H](CN1CC2(CCC2)[C@H]1c1ccccc1)c1ccccc1F ZINC000834379064 1046612426 /nfs/dbraw/zinc/61/24/26/1046612426.db2.gz UMYFWXCQMQWGEB-RBUKOAKNSA-N 0 1 311.400 4.086 20 0 DIADMN C[C@@H](N[C@@H]1CSCc2ccccc21)c1ccccc1N(C)C ZINC000678302972 1046615113 /nfs/dbraw/zinc/61/51/13/1046615113.db2.gz QDUYFIXLWGQPIB-RDTXWAMCSA-N 0 1 312.482 4.391 20 0 DIADMN CN(Cc1ccc(C(C)(C)C)s1)[C@@H]1CCCc2c1cnn2C ZINC000678295646 1046615812 /nfs/dbraw/zinc/61/58/12/1046615812.db2.gz LWSWBODBLHEPRV-OAHLLOKOSA-N 0 1 317.502 4.289 20 0 DIADMN CCc1ccc(NC(=O)c2cc(C)cc3cn[nH]c32)cc1Cl ZINC001140226227 1046619004 /nfs/dbraw/zinc/61/90/04/1046619004.db2.gz FONGYAAEGKEWND-UHFFFAOYSA-N 0 1 313.788 4.339 20 0 DIADMN CCc1ccc(NC(=O)c2cc(F)cc3[nH]cnc32)cc1Cl ZINC001140227122 1046619237 /nfs/dbraw/zinc/61/92/37/1046619237.db2.gz VXXHFKQWTWTDHG-UHFFFAOYSA-N 0 1 317.751 4.170 20 0 DIADMN Cc1[nH]nc2cc(NC(=O)c3oc4c(cccc4F)c3C)ccc12 ZINC000678329207 1046619611 /nfs/dbraw/zinc/61/96/11/1046619611.db2.gz GPQRBFVUGKIHLT-UHFFFAOYSA-N 0 1 323.327 4.317 20 0 DIADMN Clc1cscc1CNCCNc1ccc2ccccc2n1 ZINC000678345229 1046623476 /nfs/dbraw/zinc/62/34/76/1046623476.db2.gz VKLQDODNBWYMLO-UHFFFAOYSA-N 0 1 317.845 4.151 20 0 DIADMN Cc1ccncc1[C@@H](C)NCc1cc(F)cc(C(F)(F)F)c1 ZINC000678362592 1046626019 /nfs/dbraw/zinc/62/60/19/1046626019.db2.gz IJEUPTDKMZZNFQ-LLVKDONJSA-N 0 1 312.310 4.399 20 0 DIADMN Cc1ccncc1[C@@H](C)NCc1cnc(C2CCCC2)s1 ZINC000678362670 1046627412 /nfs/dbraw/zinc/62/74/12/1046627412.db2.gz KSXQHJSFYAYNOB-CYBMUJFWSA-N 0 1 301.459 4.355 20 0 DIADMN C[C@@H]1C[C@H](CNc2ccnc3cc(C(F)(F)F)ccc32)CCO1 ZINC000678408458 1046629147 /nfs/dbraw/zinc/62/91/47/1046629147.db2.gz URZCQWSSLJKNFE-VXGBXAGGSA-N 0 1 324.346 4.481 20 0 DIADMN COc1ccc(F)cc1[C@@H](C)N[C@H](C)c1ccc(C)nc1C ZINC000678413088 1046630868 /nfs/dbraw/zinc/63/08/68/1046630868.db2.gz FBXFTJGPLCEHMN-ZIAGYGMSSA-N 0 1 302.393 4.258 20 0 DIADMN CCN(Cc1csc(-c2ccc(Cl)cc2)n1)CC(C)(C)O ZINC000532960114 1046634080 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Cc1cccc(Cl)c1C(=O)Nc1cc(Cl)c(O)cc1F ZINC001140279060 1046637155 /nfs/dbraw/zinc/63/71/55/1046637155.db2.gz KRIBBABSVTXVQT-UHFFFAOYSA-N 0 1 314.143 4.399 20 0 DIADMN Cc1ccc(OC(F)F)c(CN[C@@H](C)c2ccc(C)nc2C)c1 ZINC000678428644 1046638105 /nfs/dbraw/zinc/63/81/05/1046638105.db2.gz RCTAVHNCLCOUNO-ZDUSSCGKSA-N 0 1 320.383 4.459 20 0 DIADMN Clc1nc(N2CCCCC2)sc1CN1CCCCCC1 ZINC001140288520 1046639925 /nfs/dbraw/zinc/63/99/25/1046639925.db2.gz OSLUURZARFQYCN-UHFFFAOYSA-N 0 1 313.898 4.163 20 0 DIADMN CN(Cc1sc(N2CCCCC2)nc1Cl)CC(C)(C)C ZINC001140292454 1046641121 /nfs/dbraw/zinc/64/11/21/1046641121.db2.gz WMBJAMKYUKZGIN-UHFFFAOYSA-N 0 1 315.914 4.265 20 0 DIADMN CN(Cc1sc(N2CCCCC2)nc1Cl)C1CCCC1 ZINC001140292183 1046641659 /nfs/dbraw/zinc/64/16/59/1046641659.db2.gz MTGCTAPZRZPZFE-UHFFFAOYSA-N 0 1 313.898 4.161 20 0 DIADMN O[C@H](CN(Cc1ccsc1)Cc1ccccc1)c1ccco1 ZINC000093866907 1046641978 /nfs/dbraw/zinc/64/19/78/1046641978.db2.gz SPFKWYRKEIHOAW-QGZVFWFLSA-N 0 1 313.422 4.077 20 0 DIADMN 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/nfs/dbraw/zinc/07/12/44/1047071244.db2.gz XXXAXAAXEKWLFQ-LJQANCHMSA-N 0 1 316.395 4.368 20 0 DIADMN COc1cccc([C@@H]2CCCN(Cc3cccnc3Cl)C2)c1 ZINC001137428826 1047081291 /nfs/dbraw/zinc/08/12/91/1047081291.db2.gz XUEPJZIKWRMROP-OAHLLOKOSA-N 0 1 316.832 4.123 20 0 DIADMN CC(C)c1ccc(CCN2C[C@@H](C)O[C@@](C)(C(F)F)C2)cc1 ZINC001206721019 1047084710 /nfs/dbraw/zinc/08/47/10/1047084710.db2.gz RHUCVMNOCVCVON-RDTXWAMCSA-N 0 1 311.416 4.097 20 0 DIADMN C[C@@H](N[C@H]1CCC(F)(F)C1)c1nc(C(F)(F)F)cs1 ZINC000681054636 1047089821 /nfs/dbraw/zinc/08/98/21/1047089821.db2.gz YYMCZSKHKRHZEC-RQJHMYQMSA-N 0 1 300.296 4.000 20 0 DIADMN COc1ccsc1CN1CCC(Oc2ccccc2C)CC1 ZINC001141318648 1047089838 /nfs/dbraw/zinc/08/98/38/1047089838.db2.gz XGOYFJHYRVXENT-UHFFFAOYSA-N 0 1 317.454 4.109 20 0 DIADMN Cc1nn(C(C)(C)C)cc1[C@H](C)N[C@@H](C)c1ccc(C)nc1C ZINC000681055792 1047090141 /nfs/dbraw/zinc/09/01/41/1047090141.db2.gz FTIUIFVDKYECJC-GJZGRUSLSA-N 0 1 314.477 4.370 20 0 DIADMN Cc1csc(CN2CC[C@H](c3cc(C)c(Cl)cc3O)C2)n1 ZINC000827506869 1047090263 /nfs/dbraw/zinc/09/02/63/1047090263.db2.gz MWQGUTZQAMFXSU-LBPRGKRZSA-N 0 1 322.861 4.108 20 0 DIADMN CN1CCC[C@H](NCc2cscc2Cl)c2ccccc21 ZINC000648805597 1047091656 /nfs/dbraw/zinc/09/16/56/1047091656.db2.gz SXEXBSYKBOICOU-HNNXBMFYSA-N 0 1 306.862 4.462 20 0 DIADMN Cc1cnc([C@@H](C)N2CC[C@@H](CSc3ccccc3)C2)o1 ZINC000536740264 1047094645 /nfs/dbraw/zinc/09/46/45/1047094645.db2.gz KKDGUUPHLWCDHQ-HUUCEWRRSA-N 0 1 302.443 4.158 20 0 DIADMN COc1cc(Cl)ncc1CN1CCC[C@@H](c2ccccc2)C1 ZINC001141340944 1047099269 /nfs/dbraw/zinc/09/92/69/1047099269.db2.gz MLRFFHOUZAKIDI-OAHLLOKOSA-N 0 1 316.832 4.123 20 0 DIADMN Cn1c2ccccc2nc1C(C)(C)NCc1ccccc1C1CC1 ZINC000681134154 1047102021 /nfs/dbraw/zinc/10/20/21/1047102021.db2.gz LCCQMEAEPHBVOI-UHFFFAOYSA-N 0 1 319.452 4.476 20 0 DIADMN C[C@H](CC(=O)OC(C)(C)C)NCc1cccc(Cl)c1Cl ZINC001116019233 1047102008 /nfs/dbraw/zinc/10/20/08/1047102008.db2.gz UMIMOPAVPLWLRY-SNVBAGLBSA-N 0 1 318.244 4.203 20 0 DIADMN C[C@@H](NCc1cccc(N(C)C)n1)c1ccc(C(C)(C)C)cc1 ZINC000536828348 1047103056 /nfs/dbraw/zinc/10/30/56/1047103056.db2.gz SIVFEGXUCLFYRE-OAHLLOKOSA-N 0 1 311.473 4.296 20 0 DIADMN CCCN1CCCC[C@H]1C(=O)Nc1cccc(SCC)c1 ZINC001116061506 1047103453 /nfs/dbraw/zinc/10/34/53/1047103453.db2.gz YUQOLBDXDKLVRL-INIZCTEOSA-N 0 1 306.475 4.002 20 0 DIADMN CCn1nc(CN2CCC[C@H]2c2ccc(O)cc2)c2ccccc21 ZINC000681162928 1047104249 /nfs/dbraw/zinc/10/42/49/1047104249.db2.gz BXZJKZVSJVSSGT-IBGZPJMESA-N 0 1 321.424 4.099 20 0 DIADMN C[C@@H](N[C@H](c1cccnc1)C1CC1)c1ccccc1OC(F)F ZINC000536834487 1047105927 /nfs/dbraw/zinc/10/59/27/1047105927.db2.gz SKONXXKMDRQWRH-PXAZEXFGSA-N 0 1 318.367 4.485 20 0 DIADMN CCCCc1ccc([C@H](C)NCc2cccc(N(C)C)n2)cc1 ZINC000536835195 1047105960 /nfs/dbraw/zinc/10/59/60/1047105960.db2.gz VSHREKVTDASVKH-INIZCTEOSA-N 0 1 311.473 4.341 20 0 DIADMN CC(C)Oc1ccc(C(=O)Nc2cc(F)cc(Cl)c2O)cc1 ZINC000681201432 1047106250 /nfs/dbraw/zinc/10/62/50/1047106250.db2.gz SYJYWWANGXGSOE-UHFFFAOYSA-N 0 1 323.751 4.224 20 0 DIADMN COC[C@H](N[C@H]1CCc2ccc(Cl)cc21)c1ccccc1 ZINC000536837472 1047106895 /nfs/dbraw/zinc/10/68/95/1047106895.db2.gz GMTIMWZATWIRKY-ROUUACIJSA-N 0 1 301.817 4.305 20 0 DIADMN COc1cc(F)cc(CN[C@H](C)c2ccc(Cl)c(F)c2)c1 ZINC000536842240 1047107899 /nfs/dbraw/zinc/10/78/99/1047107899.db2.gz ZWLZOSFYAAIHDN-SNVBAGLBSA-N 0 1 311.759 4.478 20 0 DIADMN CC[C@@H](CN[C@@H](C)c1cscn1)Oc1cccc(Cl)c1 ZINC000536843307 1047108709 /nfs/dbraw/zinc/10/87/09/1047108709.db2.gz DJCSNXNLVBCADI-AAEUAGOBSA-N 0 1 310.850 4.305 20 0 DIADMN CC[C@@H](N[C@H]1COc2ccc(C)cc21)c1cc(C)ccc1OC ZINC000536842997 1047109849 /nfs/dbraw/zinc/10/98/49/1047109849.db2.gz BTPDGVBHFCSJPT-MSOLQXFVSA-N 0 1 311.425 4.486 20 0 DIADMN COC[C@@H](N[C@@H](C)c1ccc(OC)c(Cl)c1)c1ccccc1 ZINC000536853486 1047111809 /nfs/dbraw/zinc/11/18/09/1047111809.db2.gz UJKMFZCKICPWFI-SUMWQHHRSA-N 0 1 319.832 4.387 20 0 DIADMN CS[C@H]1CC[C@@H](N(C)Cc2csc(-c3ccc(C)o3)n2)C1 ZINC001116149840 1047113697 /nfs/dbraw/zinc/11/36/97/1047113697.db2.gz BDGDBZQPHYXSQO-KGLIPLIRSA-N 0 1 322.499 4.427 20 0 DIADMN Clc1cc(CN2CC[C@@H](Cc3ccccc3)C2)cc(Cl)n1 ZINC001116150249 1047114277 /nfs/dbraw/zinc/11/42/77/1047114277.db2.gz HKLIXAKWFNYZQZ-AWEZNQCLSA-N 0 1 321.251 4.453 20 0 DIADMN CCCCN(C(=O)c1cnc(C(C)C)[nH]1)[C@H](C)c1ccc(C)o1 ZINC001116173324 1047115823 /nfs/dbraw/zinc/11/58/23/1047115823.db2.gz OQKFFZUIXWVHNS-CQSZACIVSA-N 0 1 317.433 4.438 20 0 DIADMN CCN(CC)c1ccc(Nc2cc(C)nn2-c2ccncc2)cc1 ZINC001212968940 1047116471 /nfs/dbraw/zinc/11/64/71/1047116471.db2.gz COAAFIBHSTUTGP-UHFFFAOYSA-N 0 1 321.428 4.166 20 0 DIADMN CCOc1ccc2c(c1)[C@@H](NCc1cc(C)ccc1C)CCO2 ZINC000681368130 1047117749 /nfs/dbraw/zinc/11/77/49/1047117749.db2.gz DWHURCAJMOHHPH-IBGZPJMESA-N 0 1 311.425 4.316 20 0 DIADMN Cc1ccc(C(=O)CCN2CCCO[C@H](c3ccccc3)C2)cc1 ZINC000681403103 1047122303 /nfs/dbraw/zinc/12/23/03/1047122303.db2.gz YBWLSQAZZSOKHR-NRFANRHFSA-N 0 1 323.436 4.031 20 0 DIADMN CCCN(Cc1cnc2ccccn12)[C@H]1CCCc2cccnc21 ZINC000681468997 1047125005 /nfs/dbraw/zinc/12/50/05/1047125005.db2.gz WMSGLSADQURDOS-SFHVURJKSA-N 0 1 320.440 4.019 20 0 DIADMN CCc1cnccc1[C@H](C)N[C@@H](C)c1cc(F)c(F)c(F)c1 ZINC000537012598 1047130708 /nfs/dbraw/zinc/13/07/08/1047130708.db2.gz XOJROMMPFXILPK-QWRGUYRKSA-N 0 1 308.347 4.473 20 0 DIADMN CCC[C@H](NCc1cc(C(=O)OC)oc1C)c1ccccc1 ZINC000537040057 1047133196 /nfs/dbraw/zinc/13/31/96/1047133196.db2.gz DDQAQZPFKIRAIS-INIZCTEOSA-N 0 1 301.386 4.006 20 0 DIADMN Cc1cc(Br)cc(NCc2[nH]nc3ccccc32)c1 ZINC000681595257 1047133597 /nfs/dbraw/zinc/13/35/97/1047133597.db2.gz WNXGVDJQCPFCQM-UHFFFAOYSA-N 0 1 316.202 4.246 20 0 DIADMN CCCCCc1cc(C(=O)N(Cc2cccs2)C2CC2)n[nH]1 ZINC001141450194 1047134878 /nfs/dbraw/zinc/13/48/78/1047134878.db2.gz ZIMOFJWGNDZZJD-UHFFFAOYSA-N 0 1 317.458 4.009 20 0 DIADMN CC(C)Oc1ccnc(CN(C)[C@@H](C)c2ccc(F)cc2)c1 ZINC000649472244 1047135717 /nfs/dbraw/zinc/13/57/17/1047135717.db2.gz IGJRSLNFGWIKDY-AWEZNQCLSA-N 0 1 302.393 4.201 20 0 DIADMN Cc1cncc(CC[N@H+](C)[C@@H](C)c2ccc(Cl)cc2Cl)n1 ZINC000649478828 1047136388 /nfs/dbraw/zinc/13/63/88/1047136388.db2.gz RZIRDPBWPVJIJH-LBPRGKRZSA-N 0 1 324.255 4.327 20 0 DIADMN Cc1cncc(CCN(C)[C@@H](C)c2ccc(Cl)cc2Cl)n1 ZINC000649478828 1047136393 /nfs/dbraw/zinc/13/63/93/1047136393.db2.gz RZIRDPBWPVJIJH-LBPRGKRZSA-N 0 1 324.255 4.327 20 0 DIADMN COc1ccc(CN(C)Cc2cc(F)cc(Cl)c2)cc1OC ZINC000681628677 1047136402 /nfs/dbraw/zinc/13/64/02/1047136402.db2.gz MKIQTNIEYCHSQU-UHFFFAOYSA-N 0 1 323.795 4.128 20 0 DIADMN C[C@@H](C1CC1)N(Cc1cc2n(n1)CCCC2)Cc1ccccc1 ZINC000649487990 1047137994 /nfs/dbraw/zinc/13/79/94/1047137994.db2.gz XKTACNJGQXPISP-INIZCTEOSA-N 0 1 309.457 4.020 20 0 DIADMN Cc1cncc(CCN([C@@H](C)c2ccccc2Cl)C2CC2)n1 ZINC000649506399 1047139295 /nfs/dbraw/zinc/13/92/95/1047139295.db2.gz MRLVJIYXKWMGGT-AWEZNQCLSA-N 0 1 315.848 4.207 20 0 DIADMN CC(C)Oc1ccnc(CN[C@H](c2ccc(F)cc2)C(C)C)c1 ZINC000649553478 1047140619 /nfs/dbraw/zinc/14/06/19/1047140619.db2.gz SFNZUVPNRYNJMD-IBGZPJMESA-N 0 1 316.420 4.495 20 0 DIADMN C[C@@H]1CCc2nc(CN(C)CCc3cccs3)sc2C1 ZINC001116444705 1047142391 /nfs/dbraw/zinc/14/23/91/1047142391.db2.gz DTSMKTZRAJWNHW-GFCCVEGCSA-N 0 1 306.500 4.004 20 0 DIADMN COc1ccc(C2CCN(Cc3ncoc3C(C)C)CC2)cc1 ZINC001116457544 1047144175 /nfs/dbraw/zinc/14/41/75/1047144175.db2.gz DHCVLVIFNZWLAT-UHFFFAOYSA-N 0 1 314.429 4.186 20 0 DIADMN C[C@@H](c1cccc(C(F)(F)F)c1)N(C)Cc1cncc(F)c1 ZINC000681750460 1047145105 /nfs/dbraw/zinc/14/51/05/1047145105.db2.gz RFYAQQCBTBBRPD-NSHDSACASA-N 0 1 312.310 4.433 20 0 DIADMN FC(F)(F)Oc1cccc(CN(Cc2ccncc2)C2CC2)c1 ZINC000649569370 1047145427 /nfs/dbraw/zinc/14/54/27/1047145427.db2.gz JPKPSFDMSYJGQQ-UHFFFAOYSA-N 0 1 322.330 4.145 20 0 DIADMN FC1(F)C[C@]12CCN(CCc1cc(Cl)ccc1Cl)C2 ZINC000649907813 1047189184 /nfs/dbraw/zinc/18/91/84/1047189184.db2.gz ADUBOAULNKKBGU-ZDUSSCGKSA-N 0 1 306.183 4.267 20 0 DIADMN CCC(CC)[C@@H](NCc1cc2n(n1)CCCC2)c1ccccc1 ZINC000649574432 1047146821 /nfs/dbraw/zinc/14/68/21/1047146821.db2.gz KMHZPVGJNJMCMW-HXUWFJFHSA-N 0 1 311.473 4.487 20 0 DIADMN CCOc1cccc([C@H](C)NCc2cc(OC(C)C)ccn2)c1 ZINC000649574231 1047147206 /nfs/dbraw/zinc/14/72/06/1047147206.db2.gz FBLGQWHWGOQZPD-HNNXBMFYSA-N 0 1 314.429 4.118 20 0 DIADMN Cc1nnsc1CN[C@@H](c1cccc(F)c1)C1CCCC1 ZINC000649576342 1047147490 /nfs/dbraw/zinc/14/74/90/1047147490.db2.gz VTXLTJSRGDFANK-MRXNPFEDSA-N 0 1 305.422 4.007 20 0 DIADMN CC[C@H](OCCN[C@@H](COC)c1ccc(C)o1)c1ccccc1 ZINC000649583449 1047148445 /nfs/dbraw/zinc/14/84/45/1047148445.db2.gz NHIFGEBWMRCDRO-ROUUACIJSA-N 0 1 317.429 4.033 20 0 DIADMN Cc1ccccc1[C@H]1CCCN1Cc1ccc(C(F)(F)F)nn1 ZINC001141488064 1047149615 /nfs/dbraw/zinc/14/96/15/1047149615.db2.gz GSVMTXPFCJBVJC-OAHLLOKOSA-N 0 1 321.346 4.141 20 0 DIADMN CC[C@@H](OCCN[C@@H](CC)c1nccs1)c1ccccc1 ZINC000649583667 1047149851 /nfs/dbraw/zinc/14/98/51/1047149851.db2.gz VLQHJJUITWQNLZ-JKSUJKDBSA-N 0 1 304.459 4.352 20 0 DIADMN C[C@@H](c1nc2ccccc2o1)N1CCC(Nc2ccccc2)CC1 ZINC001116501251 1047150157 /nfs/dbraw/zinc/15/01/57/1047150157.db2.gz YTQTWUCAZJIOCC-HNNXBMFYSA-N 0 1 321.424 4.465 20 0 DIADMN COc1cccc([C@@H](C)NC2(c3ccccc3OC)CCC2)c1 ZINC001116494400 1047150406 /nfs/dbraw/zinc/15/04/06/1047150406.db2.gz CVNYHQFGUWIECB-OAHLLOKOSA-N 0 1 311.425 4.434 20 0 DIADMN Cc1c(C(=O)N2CCCCC[C@H]2CC(C)C)ccc2cncn21 ZINC001116538326 1047152909 /nfs/dbraw/zinc/15/29/09/1047152909.db2.gz IUDBTTWOWHMSGK-INIZCTEOSA-N 0 1 313.445 4.074 20 0 DIADMN Cc1ccc(C2(NCc3cc(OC(C)C)ccn3)CCC2)cc1 ZINC000649636433 1047154896 /nfs/dbraw/zinc/15/48/96/1047154896.db2.gz XYHJUSQDQWKEEM-UHFFFAOYSA-N 0 1 310.441 4.346 20 0 DIADMN Cc1cc(-c2noc([C@H](C)NCC3CC(C)(C)C3)n2)ccc1F ZINC000681958595 1047155953 /nfs/dbraw/zinc/15/59/53/1047155953.db2.gz HKQUTDMXXCZSKH-LBPRGKRZSA-N 0 1 317.408 4.271 20 0 DIADMN Brc1ccc2oc(CN3CCC34CCCC4)nc2c1 ZINC000649658660 1047159129 /nfs/dbraw/zinc/15/91/29/1047159129.db2.gz SVSPNOIYDNGGLJ-UHFFFAOYSA-N 0 1 321.218 4.109 20 0 DIADMN Cc1nc(CN2CCC3(CCc4ccccc4C3)CC2)oc1C ZINC000649647941 1047159353 /nfs/dbraw/zinc/15/93/53/1047159353.db2.gz CMIIQNIKQDZMTN-UHFFFAOYSA-N 0 1 310.441 4.063 20 0 DIADMN Cc1ccc([C@H](C)N[C@@H]2CCCc3cnn(C(C)C)c32)c(C)n1 ZINC001116629084 1047163635 /nfs/dbraw/zinc/16/36/35/1047163635.db2.gz IJBAKRDAVGLUOA-MAUKXSAKSA-N 0 1 312.461 4.204 20 0 DIADMN CCN(c1ccc(NCc2cnc(C3CC3)nc2)cc1)C(C)C ZINC000838864276 1047164739 /nfs/dbraw/zinc/16/47/39/1047164739.db2.gz ZTKKRCCBVJOFCJ-UHFFFAOYSA-N 0 1 310.445 4.201 20 0 DIADMN CC[C@H](NCC(=O)Nc1ccc(C)cc1C)c1ccccc1F ZINC000649739311 1047168766 /nfs/dbraw/zinc/16/87/66/1047168766.db2.gz OEELVFNVGAGISP-KRWDZBQOSA-N 0 1 314.404 4.122 20 0 DIADMN C[C@@H]1C[C@H]1c1ccc(CN[C@H](c2cnn(C)c2)C(C)(C)C)o1 ZINC000537328979 1047169450 /nfs/dbraw/zinc/16/94/50/1047169450.db2.gz JJNILVLCGKVBES-SRCQZFHVSA-N 0 1 301.434 4.014 20 0 DIADMN CCc1ccccc1C[NH+]1CCC(C(=O)c2ccc([O-])cc2)CC1 ZINC000682084778 1047170248 /nfs/dbraw/zinc/17/02/48/1047170248.db2.gz QPYYIIMFZOOROX-UHFFFAOYSA-N 0 1 323.436 4.050 20 0 DIADMN Clc1ccc(C2=CCN(CCOCC3CCCC3)CC2)cn1 ZINC000838910841 1047171426 /nfs/dbraw/zinc/17/14/26/1047171426.db2.gz KEADNIDFCRLDMB-UHFFFAOYSA-N 0 1 320.864 4.031 20 0 DIADMN C[C@H](NCc1cccc(C(F)F)c1)c1nc2ccccc2n1C ZINC001116721847 1047172206 /nfs/dbraw/zinc/17/22/06/1047172206.db2.gz URBWTBAQLCABML-LBPRGKRZSA-N 0 1 315.367 4.362 20 0 DIADMN CC(C)[C@H](CC(F)(F)F)NCc1nc2c(s1)CCCC2 ZINC000682089282 1047172534 /nfs/dbraw/zinc/17/25/34/1047172534.db2.gz KZPWICPBQKEWCP-NSHDSACASA-N 0 1 306.397 4.089 20 0 DIADMN Cc1ccc(CCCN[C@@H](c2ncc[nH]2)c2ccccc2)c(C)c1 ZINC000682131154 1047174545 /nfs/dbraw/zinc/17/45/45/1047174545.db2.gz SALXJZVDACOBSM-HXUWFJFHSA-N 0 1 319.452 4.338 20 0 DIADMN Clc1cccc(-c2cnc(CNC3(C4CCC4)CC3)o2)c1 ZINC000649806762 1047177679 /nfs/dbraw/zinc/17/76/79/1047177679.db2.gz BBNVLIFDMZICJS-UHFFFAOYSA-N 0 1 302.805 4.417 20 0 DIADMN Fc1cc2c(c(F)c1)CC[C@@H]2N[C@@H]1CCOc2c(F)cccc21 ZINC000682144343 1047177878 /nfs/dbraw/zinc/17/78/78/1047177878.db2.gz NBSAMWHHXMIGIG-DLBZAZTESA-N 0 1 319.326 4.205 20 0 DIADMN Cc1ccc(-c2noc([C@H](C)NC3(C4CCC4)CC3)n2)cc1F ZINC000649808185 1047178060 /nfs/dbraw/zinc/17/80/60/1047178060.db2.gz VBLACIVOJARLNP-LBPRGKRZSA-N 0 1 315.392 4.167 20 0 DIADMN CCc1sc(-c2nnc(CNC3(C4CCC4)CC3)o2)cc1C ZINC000649806277 1047178373 /nfs/dbraw/zinc/17/83/73/1047178373.db2.gz QLEBODOMLFFEMC-UHFFFAOYSA-N 0 1 317.458 4.091 20 0 DIADMN Cc1ccc(-c2nnc([C@H](C)NC3(C4CCC4)CC3)o2)cc1C ZINC000649808404 1047178430 /nfs/dbraw/zinc/17/84/30/1047178430.db2.gz CEIRDEYLMRZUGL-AWEZNQCLSA-N 0 1 311.429 4.337 20 0 DIADMN Cc1ccc(CNC(C)(C)COCc2ccccc2)c(Cl)n1 ZINC000838978764 1047179590 /nfs/dbraw/zinc/17/95/90/1047179590.db2.gz BSFYAATWHJDCID-UHFFFAOYSA-N 0 1 318.848 4.128 20 0 DIADMN Cc1c2cccc(C)c2oc1CN(C)[C@H](C)c1cnc(C)cn1 ZINC000649820087 1047180132 /nfs/dbraw/zinc/18/01/32/1047180132.db2.gz QLKJLDOKFWORNR-OAHLLOKOSA-N 0 1 309.413 4.341 20 0 DIADMN COc1nc2ccccc2cc1CNC(C)(C)CC(F)(F)F ZINC000682167872 1047180827 /nfs/dbraw/zinc/18/08/27/1047180827.db2.gz ODNJBCIEXMSGMZ-UHFFFAOYSA-N 0 1 312.335 4.064 20 0 DIADMN O=C(Nc1ccc2nc(C(F)F)[nH]c2c1)[C@@H]1C[C@@H]1C1CCCC1 ZINC000649870518 1047184745 /nfs/dbraw/zinc/18/47/45/1047184745.db2.gz BVVLRYGSPLNSSB-VXGBXAGGSA-N 0 1 319.355 4.265 20 0 DIADMN Cc1ccc(CNC2(c3ccc(C(F)(F)F)cc3)CC2)nc1 ZINC000649886171 1047184944 /nfs/dbraw/zinc/18/49/44/1047184944.db2.gz PONFXAWBFLDOLS-UHFFFAOYSA-N 0 1 306.331 4.188 20 0 DIADMN C[C@@H](c1cccc2ccccc21)[N@H+]1C[C@@H]2CCC[C@@]2(C(=O)[O-])C1 ZINC000537430019 1047185216 /nfs/dbraw/zinc/18/52/16/1047185216.db2.gz FRFZPHMHKJYDJD-DKICVRJWSA-N 0 1 309.409 4.088 20 0 DIADMN CC(C)n1nccc1CNC1(c2ccc(C(F)(F)F)cc2)CC1 ZINC000649886619 1047185412 /nfs/dbraw/zinc/18/54/12/1047185412.db2.gz IRDOZUKUZAOVHQ-UHFFFAOYSA-N 0 1 323.362 4.262 20 0 DIADMN CCC[C@H](NCc1ccc(-c2cnn(C)c2)cc1)c1ccccn1 ZINC001116871183 1047185881 /nfs/dbraw/zinc/18/58/81/1047185881.db2.gz KGJJGFONGYZDDU-IBGZPJMESA-N 0 1 320.440 4.113 20 0 DIADMN FC1(F)C[C@@]12CCN(Cc1nc(-c3ccccc3)cs1)C2 ZINC000649907965 1047188294 /nfs/dbraw/zinc/18/82/94/1047188294.db2.gz CZERTWHQELJQQQ-OAHLLOKOSA-N 0 1 306.381 4.041 20 0 DIADMN FC1(F)C[C@@]12CCN(CCc1cc(Cl)ccc1Cl)C2 ZINC000649907812 1047189154 /nfs/dbraw/zinc/18/91/54/1047189154.db2.gz ADUBOAULNKKBGU-CYBMUJFWSA-N 0 1 306.183 4.267 20 0 DIADMN CCc1ccc(CN2CCC[C@@H]3O[C@H](c4ccccc4)C[C@@H]32)nc1 ZINC000649917029 1047190247 /nfs/dbraw/zinc/19/02/47/1047190247.db2.gz WVDBGJJXNZFFRI-ACRUOGEOSA-N 0 1 322.452 4.139 20 0 DIADMN CCc1ccc(C(=O)[C@H](C)Sc2nnc(C(C)(C)C)[nH]2)cc1 ZINC000031800191 1047193058 /nfs/dbraw/zinc/19/30/58/1047193058.db2.gz LGVUPIQQBBLICY-NSHDSACASA-N 0 1 317.458 4.028 20 0 DIADMN COc1ccc2c(c1)[C@H](N[C@H](C)c1c(C)noc1C)CCS2 ZINC000682436706 1047195558 /nfs/dbraw/zinc/19/55/58/1047195558.db2.gz LVIYVYYOTLSJOM-MEBBXXQBSA-N 0 1 318.442 4.188 20 0 DIADMN CC(C)c1ccc(NC(=O)CCN2CC[C@H](F)C2)c(C(C)C)c1 ZINC001141572180 1047197154 /nfs/dbraw/zinc/19/71/54/1047197154.db2.gz ZWDHTQALXJAJSF-INIZCTEOSA-N 0 1 320.452 4.306 20 0 DIADMN FC(F)(F)CC1CN(Cc2ccccc2N2CCCCC2)C1 ZINC000839138207 1047197213 /nfs/dbraw/zinc/19/72/13/1047197213.db2.gz MBVVLTZIBHJOBQ-UHFFFAOYSA-N 0 1 312.379 4.061 20 0 DIADMN Cc1ccc(CNCc2ccc(SC(F)F)cc2)nc1C ZINC000839162810 1047200837 /nfs/dbraw/zinc/20/08/37/1047200837.db2.gz BODMGQLMYOLUIT-UHFFFAOYSA-N 0 1 308.397 4.303 20 0 DIADMN CN(Cc1cc(F)ncc1F)[C@H]1CCC[C@H]1c1ccccc1 ZINC000839171096 1047201052 /nfs/dbraw/zinc/20/10/52/1047201052.db2.gz UZAQDYVQUWJVMP-RDJZCZTQSA-N 0 1 302.368 4.128 20 0 DIADMN CCC[C@H](N[C@H](C)c1cnn(C(C)C)c1C)c1ccccn1 ZINC000682494305 1047201322 /nfs/dbraw/zinc/20/13/22/1047201322.db2.gz GZMAWQSEIWVMQT-KDOFPFPSSA-N 0 1 300.450 4.359 20 0 DIADMN Fc1ccc(CN2CCC(c3cccnc3)CC2)cc1Cl ZINC000682532712 1047202137 /nfs/dbraw/zinc/20/21/37/1047202137.db2.gz YMORDSCNTUVXRW-UHFFFAOYSA-N 0 1 304.796 4.254 20 0 DIADMN COc1ccccc1CN(C)Cc1c[nH]c2cc(Cl)ccc12 ZINC001141583917 1047204319 /nfs/dbraw/zinc/20/43/19/1047204319.db2.gz XRMFPZRMRKLXTJ-UHFFFAOYSA-N 0 1 314.816 4.462 20 0 DIADMN Clc1ccc2c(CN3CCOc4ccccc4C3)c[nH]c2c1 ZINC001141583817 1047205268 /nfs/dbraw/zinc/20/52/68/1047205268.db2.gz SVMWGEXVENBBGX-UHFFFAOYSA-N 0 1 312.800 4.216 20 0 DIADMN Cc1cc(C)c(CNCc2cc(F)cc(C(F)(F)F)c2)cn1 ZINC000397005856 1047205921 /nfs/dbraw/zinc/20/59/21/1047205921.db2.gz AJUCNYKNCMPTBT-UHFFFAOYSA-N 0 1 312.310 4.146 20 0 DIADMN C[C@H]1CC[C@H](C(=O)[O-])C[N@H+]1Cc1sc2ccccc2c1Cl ZINC000397058958 1047210448 /nfs/dbraw/zinc/21/04/48/1047210448.db2.gz VRCRNAZPMUANKT-QWRGUYRKSA-N 0 1 323.845 4.240 20 0 DIADMN C[C@H]1CC[C@@H](C(=O)[O-])C[N@H+]1Cc1sc2ccccc2c1Cl ZINC000397058960 1047210787 /nfs/dbraw/zinc/21/07/87/1047210787.db2.gz VRCRNAZPMUANKT-WDEREUQCSA-N 0 1 323.845 4.240 20 0 DIADMN C[C@H]1CC[C@H](CSc2nc3ccc(C(F)(F)F)cc3[nH]2)O1 ZINC000682713759 1047214283 /nfs/dbraw/zinc/21/42/83/1047214283.db2.gz YJEUIKSDJHFANG-WCBMZHEXSA-N 0 1 316.348 4.241 20 0 DIADMN CCCOc1ccc(CNCc2cccc(F)c2F)c(C)c1 ZINC000682731199 1047216876 /nfs/dbraw/zinc/21/68/76/1047216876.db2.gz VPRATCAUYGYOEV-UHFFFAOYSA-N 0 1 305.368 4.352 20 0 DIADMN CCCCN(C(=O)c1cc(-c2cccc(Cl)c2)[nH]n1)C1CC1 ZINC001141603475 1047216978 /nfs/dbraw/zinc/21/69/78/1047216978.db2.gz PUSZZLDCCAHFIM-UHFFFAOYSA-N 0 1 317.820 4.135 20 0 DIADMN CC(C)(C)OCCC[N@H+]1CCCC[C@H]1c1nc2ccccc2[nH]1 ZINC000650199660 1047221156 /nfs/dbraw/zinc/22/11/56/1047221156.db2.gz LYJORQAXYDCRKP-KRWDZBQOSA-N 0 1 315.461 4.295 20 0 DIADMN CC(C)(C)OCCCN1CCCC[C@H]1c1nc2ccccc2[nH]1 ZINC000650199660 1047221163 /nfs/dbraw/zinc/22/11/63/1047221163.db2.gz LYJORQAXYDCRKP-KRWDZBQOSA-N 0 1 315.461 4.295 20 0 DIADMN Cc1ccc2nc(-c3ccccc3NC(=O)[C@@H]3CC34CC4)[nH]c2c1 ZINC000650185187 1047221599 /nfs/dbraw/zinc/22/15/99/1047221599.db2.gz UBPAVEBLIPPVHO-AWEZNQCLSA-N 0 1 317.392 4.277 20 0 DIADMN COc1cc(C(F)(F)F)ccc1CN1CCC(C(F)F)CC1 ZINC001141611476 1047224607 /nfs/dbraw/zinc/22/46/07/1047224607.db2.gz ZBWFAHCQFCLPMI-UHFFFAOYSA-N 0 1 323.305 4.191 20 0 DIADMN Cc1ccc(CN(C)Cc2ccc(Br)c(C)c2)nc1 ZINC000682788664 1047224821 /nfs/dbraw/zinc/22/48/21/1047224821.db2.gz TYIWKISLXHYDOR-UHFFFAOYSA-N 0 1 319.246 4.093 20 0 DIADMN Fc1cccc(CNCc2cc(Cl)ccc2OC(F)F)c1 ZINC000035256176 1047225162 /nfs/dbraw/zinc/22/51/62/1047225162.db2.gz HQZGHNUTLIPBDC-UHFFFAOYSA-N 0 1 315.722 4.370 20 0 DIADMN CC(C)(NCc1cnsc1)c1ccc(Cl)c(Cl)c1 ZINC001648990313 1047225392 /nfs/dbraw/zinc/22/53/92/1047225392.db2.gz ANIUDXPUBOMMHW-UHFFFAOYSA-N 0 1 301.242 4.475 20 0 DIADMN Cc1cc(C2CCN(C(=O)C(C)(C)C3CCCCC3)CC2)n[nH]1 ZINC000760426744 1047231344 /nfs/dbraw/zinc/23/13/44/1047231344.db2.gz LDKHYDOJUAZPQU-UHFFFAOYSA-N 0 1 317.477 4.031 20 0 DIADMN Cc1ccc(-c2cc(C(=O)N3CCC(C)(C4CC4)CC3)n[nH]2)cc1 ZINC001141621974 1047232199 /nfs/dbraw/zinc/23/21/99/1047232199.db2.gz MQICWCZOLYCSRM-UHFFFAOYSA-N 0 1 323.440 4.037 20 0 DIADMN CC[C@H](c1ccncc1)[N@@H+](C)Cc1ccc(-c2cnn(C)c2)cc1 ZINC001117645187 1047232256 /nfs/dbraw/zinc/23/22/56/1047232256.db2.gz ZLFJVVYLCQBGOP-HXUWFJFHSA-N 0 1 320.440 4.065 20 0 DIADMN CS[C@H]1CC[C@H](N(C)Cc2ccnc(Cl)c2Cl)C1 ZINC001117642230 1047234053 /nfs/dbraw/zinc/23/40/53/1047234053.db2.gz WGHJDHROUCNKIN-QWRGUYRKSA-N 0 1 305.274 4.104 20 0 DIADMN Fc1cc2ncccc2cc1C[N@H+]1CC[C@@H](Oc2ccccc2)C1 ZINC001141628743 1047236807 /nfs/dbraw/zinc/23/68/07/1047236807.db2.gz HPOZNZBGBZJDJW-GOSISDBHSA-N 0 1 322.383 4.027 20 0 DIADMN Fc1cc2ncccc2cc1CN1CC[C@@H](Oc2ccccc2)C1 ZINC001141628743 1047236815 /nfs/dbraw/zinc/23/68/15/1047236815.db2.gz HPOZNZBGBZJDJW-GOSISDBHSA-N 0 1 322.383 4.027 20 0 DIADMN CCN(Cc1cccc(OC)c1)Cc1cc2cccnc2cc1F ZINC001141631083 1047239367 /nfs/dbraw/zinc/23/93/67/1047239367.db2.gz KXFDNRBYGISJOT-UHFFFAOYSA-N 0 1 324.399 4.405 20 0 DIADMN c1cc(CNCc2cnc(-c3ccccc3)s2)n(C2CC2)c1 ZINC001117743819 1047239366 /nfs/dbraw/zinc/23/93/66/1047239366.db2.gz LTTAJQIQIWNCCB-UHFFFAOYSA-N 0 1 309.438 4.236 20 0 DIADMN CN(Cc1cc2cccnc2cc1F)[C@H]1CCc2ccccc21 ZINC001141636975 1047240223 /nfs/dbraw/zinc/24/02/23/1047240223.db2.gz KDEYRYRQEKCWEN-FQEVSTJZSA-N 0 1 306.384 4.493 20 0 DIADMN Fc1ccc2nc(CN3CCC(C(F)(F)F)CC3)ccc2c1 ZINC001141640082 1047242955 /nfs/dbraw/zinc/24/29/55/1047242955.db2.gz MTAWUNZYLGMTIW-UHFFFAOYSA-N 0 1 312.310 4.148 20 0 DIADMN CC[C@@H](N[C@H](c1cnn(C)c1)c1ccccc1)c1ccsc1 ZINC001117779017 1047245125 /nfs/dbraw/zinc/24/51/25/1047245125.db2.gz DLZYYGYSBIFQKO-MSOLQXFVSA-N 0 1 311.454 4.312 20 0 DIADMN Cc1cc2[nH]ncc2cc1NC(=O)CCc1ccc([C@@H]2C[C@H]2C)o1 ZINC000682955300 1047245830 /nfs/dbraw/zinc/24/58/30/1047245830.db2.gz NASVLHWFOWVWOF-IAQYHMDHSA-N 0 1 323.396 4.159 20 0 DIADMN Cc1cccc(C(=O)Nc2ccc3nc(C(C)(C)C)[nH]c3c2)c1 ZINC000476158013 1047246644 /nfs/dbraw/zinc/24/66/44/1047246644.db2.gz NJYMILFOFZCYTC-UHFFFAOYSA-N 0 1 307.397 4.421 20 0 DIADMN C[C@H](NCc1cccc(C(=O)C(F)(F)F)c1)c1ccsc1 ZINC000839594336 1047247836 /nfs/dbraw/zinc/24/78/36/1047247836.db2.gz POLIXFKUHCTQEF-JTQLQIEISA-N 0 1 313.344 4.344 20 0 DIADMN C[C@@H]1Cc2ccccc2CN1Cc1ccc2cc(F)ccc2n1 ZINC001141650844 1047248637 /nfs/dbraw/zinc/24/86/37/1047248637.db2.gz KSQITHSLJUEMSA-CQSZACIVSA-N 0 1 306.384 4.321 20 0 DIADMN Cc1ccncc1CN1CC(Cc2ccccc2C(F)(F)F)C1 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302.368 4.260 20 0 DIADMN C[C@@H]1CC[C@](C)(/C=C/C(=O)Nc2ccc3cncn3c2)C1(C)C ZINC001157396986 1047742321 /nfs/dbraw/zinc/74/23/21/1047742321.db2.gz UALYCFPNZSNZNI-YFZXRXBPSA-N 0 1 311.429 4.291 20 0 DIADMN Cc1ccc2c(ccc(C)c2C(=O)Nc2ccc3cncn3c2)c1 ZINC001157404831 1047743198 /nfs/dbraw/zinc/74/31/98/1047743198.db2.gz JWEQJZUAOKZXSR-UHFFFAOYSA-N 0 1 315.376 4.357 20 0 DIADMN COC(=O)c1oc([C@H](C)N2C[C@@H](C)[C@H]2c2ccccc2)cc1C ZINC000539249263 1047743361 /nfs/dbraw/zinc/74/33/61/1047743361.db2.gz KYSXBTJQSRNXEV-KEYYUXOJSA-N 0 1 313.397 4.129 20 0 DIADMN CCC[C@@H](O)CCN[C@H](C)c1csc(-c2ccccc2)n1 ZINC000927026265 1047746745 /nfs/dbraw/zinc/74/67/45/1047746745.db2.gz ZWWAVACMBKTKAQ-UKRRQHHQSA-N 0 1 304.459 4.012 20 0 DIADMN CCSc1ccc([C@H](C)NCC(=O)NCCC(C)(C)C)cc1 ZINC000539304062 1047746967 /nfs/dbraw/zinc/74/69/67/1047746967.db2.gz UHOXKXAOIKBRKO-AWEZNQCLSA-N 0 1 322.518 4.002 20 0 DIADMN CCC[C@H](O)CCN[C@@H](C)c1csc(-c2ccccc2)n1 ZINC000927026266 1047747161 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C[C@@H]1C[C@@H](Nc2nc[nH]c3nc(=S)sc2-3)c2ccccc21 ZINC001158471184 1047782465 /nfs/dbraw/zinc/78/24/65/1047782465.db2.gz GGOJGDDYLCILBB-LDYMZIIASA-N 0 1 314.439 4.035 20 0 DIADMN Cc1ccc(N[C@H](CCO)c2cccc3ccccc32)nc1C ZINC001158507542 1047787575 /nfs/dbraw/zinc/78/75/75/1047787575.db2.gz XIUKXHBSLBAKEW-LJQANCHMSA-N 0 1 306.409 4.387 20 0 DIADMN Cc1cnc(N[C@H](CCO)c2cccc3ccccc32)cc1C ZINC001158513339 1047788040 /nfs/dbraw/zinc/78/80/40/1047788040.db2.gz JJKHFQJMVCNNOI-LJQANCHMSA-N 0 1 306.409 4.387 20 0 DIADMN CC(C)(C)[C@H]1CCCN(C(=O)c2cc(-c3cccs3)[nH]n2)C1 ZINC000478495969 1047790473 /nfs/dbraw/zinc/79/04/73/1047790473.db2.gz WPHNXVWVQMVJBH-LBPRGKRZSA-N 0 1 317.458 4.037 20 0 DIADMN CN(C)[C@@H](CNC(=O)CCCCC(C)(C)C)c1ccsc1 ZINC000552756271 1047791998 /nfs/dbraw/zinc/79/19/98/1047791998.db2.gz DJYBKYMGRLENIG-HNNXBMFYSA-N 0 1 310.507 4.074 20 0 DIADMN Cc1cccc2ccnc(N[C@@H]3CCc4ccccc4[C@H]3O)c12 ZINC001158679486 1047794268 /nfs/dbraw/zinc/79/42/68/1047794268.db2.gz BRDVGDYNRRYWKG-IEBWSBKVSA-N 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/nfs/dbraw/zinc/80/92/33/1047809233.db2.gz IKIHWPGBCJWASI-AWEZNQCLSA-N 0 1 323.223 4.023 20 0 DIADMN CCCC[C@H](C)N(CCCC)C(=O)c1cccc2c[nH]nc21 ZINC001159126280 1047814507 /nfs/dbraw/zinc/81/45/07/1047814507.db2.gz MWTIJQGQFYSAKT-AWEZNQCLSA-N 0 1 301.434 4.384 20 0 DIADMN Nc1nc2ccccc2n1-c1ccc(NCc2ccccc2)cc1 ZINC001159123428 1047814772 /nfs/dbraw/zinc/81/47/72/1047814772.db2.gz CBSHOJVQUOZTLG-UHFFFAOYSA-N 0 1 314.392 4.220 20 0 DIADMN COc1ccc(CN(Cc2cccc(Cl)c2)C(C)C)nc1 ZINC000553093226 1047822264 /nfs/dbraw/zinc/82/22/64/1047822264.db2.gz DBGRKQYURRBNEK-UHFFFAOYSA-N 0 1 304.821 4.154 20 0 DIADMN Oc1c(Cl)cc(Cl)c2ccc(/C=C\c3cocn3)nc12 ZINC000478922795 1047827048 /nfs/dbraw/zinc/82/70/48/1047827048.db2.gz YKQBGSYLPOIWGS-UPHRSURJSA-N 0 1 307.136 4.406 20 0 DIADMN CCOc1cc(C)cc(F)c1Nc1cc([C@H]2CCCCN2)no1 ZINC001159311706 1047829476 /nfs/dbraw/zinc/82/94/76/1047829476.db2.gz OXGRVFLEOUUWHU-CYBMUJFWSA-N 0 1 319.380 4.079 20 0 DIADMN CC(C)Oc1cc(Nc2cc([C@H]3CCCCN3)no2)ccc1F ZINC001159312979 1047831139 /nfs/dbraw/zinc/83/11/39/1047831139.db2.gz HUTREGLIYZHVJY-CQSZACIVSA-N 0 1 319.380 4.159 20 0 DIADMN c1c([C@@H]2CCCCN2)noc1Nc1cccc(-c2ccncc2)c1 ZINC001159313169 1047831642 /nfs/dbraw/zinc/83/16/42/1047831642.db2.gz IYBRMSVUDGFHQQ-KRWDZBQOSA-N 0 1 320.396 4.295 20 0 DIADMN CC(C)Oc1cccc(Nc2cc([C@@H]3CCCCN3)no2)c1F ZINC001159312644 1047832278 /nfs/dbraw/zinc/83/22/78/1047832278.db2.gz DIYOJVWOSNDRHZ-LBPRGKRZSA-N 0 1 319.380 4.159 20 0 DIADMN CCCOc1ccc(Nc2cc([C@H]3CCCCN3)no2)c(F)c1 ZINC001159312893 1047832401 /nfs/dbraw/zinc/83/24/01/1047832401.db2.gz GBDVFCFUMNEJSR-OAHLLOKOSA-N 0 1 319.380 4.161 20 0 DIADMN CC(C)Oc1ccc(Nc2cc([C@H]3CCCCN3)no2)cc1F ZINC001159313742 1047832672 /nfs/dbraw/zinc/83/26/72/1047832672.db2.gz SWGTTXYFOUCCKX-CQSZACIVSA-N 0 1 319.380 4.159 20 0 DIADMN COc1cccc(CN[C@H]2CCc3ccc(Cl)cc32)c1OC ZINC000479118291 1047840712 /nfs/dbraw/zinc/84/07/12/1047840712.db2.gz APYWKYWZNWFASM-INIZCTEOSA-N 0 1 317.816 4.134 20 0 DIADMN CC(C)c1cc([C@@H]2CCCN(Cc3c(F)cccc3F)C2)[nH]n1 ZINC001197543657 1047842991 /nfs/dbraw/zinc/84/29/91/1047842991.db2.gz SOAJYQXYODZOLP-CYBMUJFWSA-N 0 1 319.399 4.191 20 0 DIADMN CC(C)c1cc([C@@H]2CCCN(Cc3c(F)cccc3F)C2)n[nH]1 ZINC001197543657 1047843005 /nfs/dbraw/zinc/84/30/05/1047843005.db2.gz SOAJYQXYODZOLP-CYBMUJFWSA-N 0 1 319.399 4.191 20 0 DIADMN COc1ccc(CN2CC[C@](C)(C(F)(F)F)C2)cc1Cl ZINC001197555114 1047844630 /nfs/dbraw/zinc/84/46/30/1047844630.db2.gz WFVHQDRETUZRMN-ZDUSSCGKSA-N 0 1 307.743 4.123 20 0 DIADMN COCC1(N(C)Cc2nc(-c3ccc(C)cc3)cs2)CCC1 ZINC001197582372 1047850702 /nfs/dbraw/zinc/85/07/02/1047850702.db2.gz OQJNTLBHWJETNC-UHFFFAOYSA-N 0 1 316.470 4.119 20 0 DIADMN Cc1sc2[nH]c(CN(C)C[C@H](C)C(C)(C)C)nc(=O)c2c1C ZINC001197600793 1047852056 /nfs/dbraw/zinc/85/20/56/1047852056.db2.gz FAIOWZQKEBVIMS-JTQLQIEISA-N 0 1 321.490 4.128 20 0 DIADMN CCC(=O)c1ccc(O)c(NC(=O)[C@H]2[C@@H]3CCCCCC[C@@H]32)c1 ZINC001159474320 1047851956 /nfs/dbraw/zinc/85/19/56/1047851956.db2.gz TZKDHJVNTCSCJQ-UOIKSKOESA-N 0 1 315.413 4.140 20 0 DIADMN CCC(=O)c1ccc(O)c(NC(=O)C2(C3CCCCC3)CC2)c1 ZINC001159473653 1047852502 /nfs/dbraw/zinc/85/25/02/1047852502.db2.gz NNWTXVRDUQRZSA-UHFFFAOYSA-N 0 1 315.413 4.284 20 0 DIADMN C[C@H](N[C@@H](C)c1ccc(F)cc1OC(F)F)c1ccncc1 ZINC000152534067 1047856094 /nfs/dbraw/zinc/85/60/94/1047856094.db2.gz KKLWMSGQHHTPOS-QWRGUYRKSA-N 0 1 310.319 4.234 20 0 DIADMN Cc1ccc2nc(CNc3ncc(Cl)cc3Cl)[nH]c2c1 ZINC000553487273 1047863044 /nfs/dbraw/zinc/86/30/44/1047863044.db2.gz QNBBQYBAJXBRIT-UHFFFAOYSA-N 0 1 307.184 4.185 20 0 DIADMN Cc1ccc2nc(NC(=O)[C@H](C)c3cccc(Cl)c3)[nH]c2c1 ZINC000553487115 1047863548 /nfs/dbraw/zinc/86/35/48/1047863548.db2.gz WQBIOUQCDACRBI-LLVKDONJSA-N 0 1 313.788 4.267 20 0 DIADMN COC[C@@H](C)Oc1ccc(CN2CC[C@@H]2c2ccccc2)cc1 ZINC000667464470 1047864181 /nfs/dbraw/zinc/86/41/81/1047864181.db2.gz RVULDFRJLHEZIP-OXQOHEQNSA-N 0 1 311.425 4.047 20 0 DIADMN NC(=O)c1csc(CNC2CCCCCCCCCCC2)n1 ZINC001182941234 1047865782 /nfs/dbraw/zinc/86/57/82/1047865782.db2.gz KJXQHADPNRMZBM-UHFFFAOYSA-N 0 1 323.506 4.005 20 0 DIADMN Cc1ccc2sc(CN3CCC[C@H]3COC(C)(C)C)nc2c1 ZINC001197639578 1047867245 /nfs/dbraw/zinc/86/72/45/1047867245.db2.gz RQDVCYCKWNYCCE-AWEZNQCLSA-N 0 1 318.486 4.384 20 0 DIADMN FC1(F)C[C@@]2(CCN(Cc3ccc(Cl)cc3)C2)C1(F)F ZINC001197719132 1047868032 /nfs/dbraw/zinc/86/80/32/1047868032.db2.gz FAAHQFRNHUQGFN-GFCCVEGCSA-N 0 1 307.718 4.206 20 0 DIADMN COc1cc(Nc2ccc3c[nH]nc3c2)cc(C(F)(F)F)c1 ZINC001174500603 1047869248 /nfs/dbraw/zinc/86/92/48/1047869248.db2.gz UXGFFKLTHKOCDX-UHFFFAOYSA-N 0 1 307.275 4.334 20 0 DIADMN CC(C)Oc1cc(F)c(Nc2cccc3[nH]ncc32)c(F)c1 ZINC001159574366 1047869344 /nfs/dbraw/zinc/86/93/44/1047869344.db2.gz DTBHBOFDQMJWRR-UHFFFAOYSA-N 0 1 303.312 4.372 20 0 DIADMN [O-]c1c(Cl)cc(Cl)cc1Nc1ccc2c(c1)CC[NH2+]C2 ZINC001159590971 1047874528 /nfs/dbraw/zinc/87/45/28/1047874528.db2.gz BRMGVOHSCHLOLV-UHFFFAOYSA-N 0 1 309.196 4.088 20 0 DIADMN C[C@@H](CCN1C[C@@H](C)O[C@H](CC(F)(F)F)C1)c1ccccc1 ZINC001182999747 1047874985 /nfs/dbraw/zinc/87/49/85/1047874985.db2.gz JALRXZMPNZQLLO-SQWLQELKSA-N 0 1 315.379 4.222 20 0 DIADMN COc1ccc(CN(C)Cc2cc3c(cccc3C)[nH]2)cc1OC ZINC000667476044 1047878620 /nfs/dbraw/zinc/87/86/20/1047878620.db2.gz KVJZLJCESQZYBI-UHFFFAOYSA-N 0 1 324.424 4.126 20 0 DIADMN CC[C@@H](c1ccc(Cl)cc1)N1Cc2c[nH]nc2C[C@@H](C)C1 ZINC001197785768 1047881750 /nfs/dbraw/zinc/88/17/50/1047881750.db2.gz KWTKZQANOPAWDV-PXAZEXFGSA-N 0 1 303.837 4.209 20 0 DIADMN CCO[C@@H]1C[C@@H](NCC(F)(F)C(C)(C)C)C12CCCCC2 ZINC001183026264 1047881823 /nfs/dbraw/zinc/88/18/23/1047881823.db2.gz ZFNAAMPIDOLMEB-ZIAGYGMSSA-N 0 1 303.437 4.385 20 0 DIADMN c1ncn(Cc2ccccc2)c1Nc1ccc2c(c1)NCCC2 ZINC001159608633 1047882710 /nfs/dbraw/zinc/88/27/10/1047882710.db2.gz DKRBIXBJASYTPC-UHFFFAOYSA-N 0 1 304.397 4.033 20 0 DIADMN CC[C@H](c1ccc(Cl)cc1)N1Cc2c[nH]nc2C[C@H](C)C1 ZINC001197785771 1047882734 /nfs/dbraw/zinc/88/27/34/1047882734.db2.gz KWTKZQANOPAWDV-YVEFUNNKSA-N 0 1 303.837 4.209 20 0 DIADMN CC(C)=CCC[C@@H](C)CCN1CCOc2ccc(O)cc2C1 ZINC001183022915 1047883103 /nfs/dbraw/zinc/88/31/03/1047883103.db2.gz AGYQRENJEXPUIJ-MRXNPFEDSA-N 0 1 303.446 4.359 20 0 DIADMN Cn1ncc(C2CCC2)c1CN1CCC[C@@H]1c1cccs1 ZINC000667481658 1047883249 /nfs/dbraw/zinc/88/32/49/1047883249.db2.gz BYBPZLMYLBHQMT-OAHLLOKOSA-N 0 1 301.459 4.086 20 0 DIADMN CCC[C@H](CNCc1ccc(C(F)(F)F)nc1Cl)OCC ZINC001183064891 1047886720 /nfs/dbraw/zinc/88/67/20/1047886720.db2.gz AFEJKBBNPJCVPC-LLVKDONJSA-N 0 1 324.774 4.049 20 0 DIADMN COc1cccc(CNC(C)(C)c2ccc(F)cc2F)c1C ZINC001197819011 1047890836 /nfs/dbraw/zinc/89/08/36/1047890836.db2.gz SLXSJLKCHPCTIG-UHFFFAOYSA-N 0 1 305.368 4.307 20 0 DIADMN COc1ccc(OC(F)(F)F)cc1Nc1ccc2c[nH]nc2c1 ZINC001159662702 1047895626 /nfs/dbraw/zinc/89/56/26/1047895626.db2.gz AEJDTUOVAIYLNZ-UHFFFAOYSA-N 0 1 323.274 4.214 20 0 DIADMN CC(C)Oc1cc(F)c(F)cc1Nc1ccc2c[nH]nc2c1 ZINC001159662941 1047897029 /nfs/dbraw/zinc/89/70/29/1047897029.db2.gz MGKCDDUURAVQED-UHFFFAOYSA-N 0 1 303.312 4.372 20 0 DIADMN CC(C)Oc1cc(F)c(Nc2ccc3c[nH]nc3c2)c(F)c1 ZINC001159662984 1047897590 /nfs/dbraw/zinc/89/75/90/1047897590.db2.gz OXTFASYCJVHUOX-UHFFFAOYSA-N 0 1 303.312 4.372 20 0 DIADMN Clc1ccc(CN2CCC[C@H](Cc3nccs3)C2)cc1 ZINC001197920550 1047900136 /nfs/dbraw/zinc/90/01/36/1047900136.db2.gz DCHDAQCDZIGAFN-CQSZACIVSA-N 0 1 306.862 4.251 20 0 DIADMN CCCc1cccc(CNCc2cccc3c2OCCCO3)c1 ZINC000479464779 1047900130 /nfs/dbraw/zinc/90/01/30/1047900130.db2.gz MZCMGJDTUTXNPF-UHFFFAOYSA-N 0 1 311.425 4.090 20 0 DIADMN C[C@@H](CC1CCCCC1)C(=O)Nc1cccc(-c2cn[nH]n2)c1 ZINC001183165714 1047904109 /nfs/dbraw/zinc/90/41/09/1047904109.db2.gz KSSOIZHFEJVONE-ZDUSSCGKSA-N 0 1 312.417 4.017 20 0 DIADMN COc1cccc([C@@H](C)N[C@H]2CCc3c2nccc3Cl)c1 ZINC000924723127 1047915679 /nfs/dbraw/zinc/91/56/79/1047915679.db2.gz JRUWQVPWXVDPIP-BZNIZROVSA-N 0 1 302.805 4.082 20 0 DIADMN [O-]c1cc(F)c(Nc2cccc(C3CC[NH2+]CC3)c2)cc1Cl ZINC001159763935 1047917604 /nfs/dbraw/zinc/91/76/04/1047917604.db2.gz JSQVNQQQGXMAFX-UHFFFAOYSA-N 0 1 320.795 4.395 20 0 DIADMN OC[C@@H](N[C@@H]1CCC12CCCC2)c1c(Cl)cccc1Cl ZINC000479510473 1047918145 /nfs/dbraw/zinc/91/81/45/1047918145.db2.gz IWIJRSLKUBCKQG-ZIAGYGMSSA-N 0 1 314.256 4.339 20 0 DIADMN Cc1cc(C[N@H+]2CC[C@@H](c3cc(F)c(F)c(F)c3)C2(C)C)on1 ZINC001198026390 1047920456 /nfs/dbraw/zinc/92/04/56/1047920456.db2.gz FWGGFZCNKHLLAS-ZDUSSCGKSA-N 0 1 324.346 4.168 20 0 DIADMN Cc1cc(CN2CC[C@@H](c3cc(F)c(F)c(F)c3)C2(C)C)on1 ZINC001198026390 1047920462 /nfs/dbraw/zinc/92/04/62/1047920462.db2.gz FWGGFZCNKHLLAS-ZDUSSCGKSA-N 0 1 324.346 4.168 20 0 DIADMN CC(C)CCC[C@H](C)NC(=O)c1cc2c(Cl)[nH]ccc-2n1 ZINC001174600127 1047922474 /nfs/dbraw/zinc/92/24/74/1047922474.db2.gz FZZXPWFHZFKFPT-NSHDSACASA-N 0 1 307.825 4.161 20 0 DIADMN C[C@@H]1CC[C@H](CN[C@@H](c2ccn(C)n2)c2ccc(Cl)cc2)C1 ZINC000479544572 1047923172 /nfs/dbraw/zinc/92/31/72/1047923172.db2.gz NWPJODWUVCTIDY-QWQRMKEZSA-N 0 1 317.864 4.189 20 0 DIADMN [O-]c1c(F)cc(Nc2ccc([C@H]3CC[NH2+]C3)cc2)cc1Cl ZINC001159779516 1047923513 /nfs/dbraw/zinc/92/35/13/1047923513.db2.gz XXGBOMXIOSPHAW-NSHDSACASA-N 0 1 306.768 4.005 20 0 DIADMN CC/C=C/CCN1CCc2cc(C)c(Br)cc2C1 ZINC001198094213 1047925664 /nfs/dbraw/zinc/92/56/64/1047925664.db2.gz NHRXWMAHOWZPRE-SNAWJCMRSA-N 0 1 308.263 4.472 20 0 DIADMN CC1(C)CCC[C@@H](CN2Cc3cccnc3N3CCC[C@@H]3C2)C1 ZINC001183420110 1047925997 /nfs/dbraw/zinc/92/59/97/1047925997.db2.gz VLZATVOEJNNCLF-SJLPKXTDSA-N 0 1 313.489 4.082 20 0 DIADMN Cc1cc([C@H]2CCCCN2Cc2ccc(Cl)c(F)c2)n[nH]1 ZINC001198129761 1047927136 /nfs/dbraw/zinc/92/71/36/1047927136.db2.gz AGBITXDZQZFWCW-MRXNPFEDSA-N 0 1 307.800 4.238 20 0 DIADMN Cc1cc([C@@H]2CCCCN2Cc2ccc(Cl)c(F)c2)n[nH]1 ZINC001198129757 1047927251 /nfs/dbraw/zinc/92/72/51/1047927251.db2.gz AGBITXDZQZFWCW-INIZCTEOSA-N 0 1 307.800 4.238 20 0 DIADMN Cc1cc([C@H]2CCCCN2Cc2cnc3ccc(C)cc3c2)[nH]n1 ZINC001198129799 1047928148 /nfs/dbraw/zinc/92/81/48/1047928148.db2.gz AMAGIOWSPSQBOU-HXUWFJFHSA-N 0 1 320.440 4.302 20 0 DIADMN CC[C@@H]1CCC[C@@H](CN2Cc3ccccc3NC(=O)[C@@H]2C)C1 ZINC001183411275 1047929970 /nfs/dbraw/zinc/92/99/70/1047929970.db2.gz ZZKVAHAQQIBBKA-ARFHVFGLSA-N 0 1 300.446 4.046 20 0 DIADMN CCN1CCN(c2ccc(NC[C@H](C)C(C)(C)C)cc2F)CC1 ZINC001183464866 1047932130 /nfs/dbraw/zinc/93/21/30/1047932130.db2.gz ZUCWBYZGXGFOQI-HNNXBMFYSA-N 0 1 321.484 4.062 20 0 DIADMN Cc1ccc(NC(=O)[C@@H](C)N(C)Cc2c(C)cccc2C)c(C)c1 ZINC001198195019 1047936230 /nfs/dbraw/zinc/93/62/30/1047936230.db2.gz PQBBYWBUHGZAIQ-GOSISDBHSA-N 0 1 324.468 4.379 20 0 DIADMN COc1cccc([C@H](C)N[C@@H](C)c2ccnn2CC2CCC2)c1 ZINC000924724450 1047938277 /nfs/dbraw/zinc/93/82/77/1047938277.db2.gz PXYRHDZUOBPJPH-GJZGRUSLSA-N 0 1 313.445 4.104 20 0 DIADMN Cc1cccc2ncc(CNC3(c4ccc(Cl)cc4)CC3)n21 ZINC000553776552 1047938841 /nfs/dbraw/zinc/93/88/41/1047938841.db2.gz SJNKAFNQZNEUDA-UHFFFAOYSA-N 0 1 311.816 4.075 20 0 DIADMN Cc1ccc(C(C)(C)CNCc2c(Cl)ccnc2Cl)nc1 ZINC001206672922 1047939107 /nfs/dbraw/zinc/93/91/07/1047939107.db2.gz UAISWVWCAKDIKD-UHFFFAOYSA-N 0 1 324.255 4.159 20 0 DIADMN COc1c(Cl)cc(Cl)cc1CNC[C@@H](C)C(F)(F)F ZINC000479614036 1047940888 /nfs/dbraw/zinc/94/08/88/1047940888.db2.gz KRLRIKQJQCEWBZ-SSDOTTSWSA-N 0 1 316.150 4.290 20 0 DIADMN Cc1cccc2ccnc(N[C@H]3CCc4ccc(O)cc4C3)c12 ZINC001159895377 1047943413 /nfs/dbraw/zinc/94/34/13/1047943413.db2.gz ILNVECQXFIWMHK-KRWDZBQOSA-N 0 1 304.393 4.218 20 0 DIADMN C[C@@H]1CN(C[C@H](O)c2ccc(F)cc2Cl)[C@H]1c1ccccc1 ZINC000774650922 1047945607 /nfs/dbraw/zinc/94/56/07/1047945607.db2.gz ROJUFNFOQVMQHI-OCBCSQNSSA-N 0 1 319.807 4.206 20 0 DIADMN C[C@@H](c1ccc(F)c(Cl)c1)N1CCC(O)(C2CCC2)CC1 ZINC001198346073 1047947074 /nfs/dbraw/zinc/94/70/74/1047947074.db2.gz CHINFMYQLFQSOB-LBPRGKRZSA-N 0 1 311.828 4.167 20 0 DIADMN COc1ccc(C[N@H+]2CCC[C@@H]2C2CCC2)cc1Br ZINC000479666954 1047947723 /nfs/dbraw/zinc/94/77/23/1047947723.db2.gz QMWSDDSSBOKFLY-OAHLLOKOSA-N 0 1 324.262 4.222 20 0 DIADMN COc1ccccc1[C@@H](C)CC(=O)Nc1nc2ccc(C)cc2[nH]1 ZINC000553813379 1047948291 /nfs/dbraw/zinc/94/82/91/1047948291.db2.gz BXHPBZLCKIXZLF-ZDUSSCGKSA-N 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/nfs/dbraw/zinc/70/01/32/1048700132.db2.gz WMSQBYPAXOHUEJ-UHFFFAOYSA-N 0 1 324.459 4.002 20 0 DIADMN C[C@H](O)[C@H](N[C@@H]1CCSc2c(F)cccc21)c1ccccc1 ZINC000850584855 1048701323 /nfs/dbraw/zinc/70/13/23/1048701323.db2.gz UCHORQJFNPDODW-VUCTXSBTSA-N 0 1 317.429 4.074 20 0 DIADMN FC(F)(F)c1cnccc1NC1CCC(C(F)(F)F)CC1 ZINC001165624551 1048702201 /nfs/dbraw/zinc/70/22/01/1048702201.db2.gz JWRJFHZISGDPMQ-UHFFFAOYSA-N 0 1 312.257 4.055 20 0 DIADMN CCCN[C@@H](C)c1nc(Cc2ccc(Cl)cc2Cl)no1 ZINC000109502344 1048705715 /nfs/dbraw/zinc/70/57/15/1048705715.db2.gz QHGSUEPWRQDSQR-VIFPVBQESA-N 0 1 314.216 4.028 20 0 DIADMN Cc1cnc(N2CCC[C@]3(C[C@H](c4ccccc4)CO3)C2)cc1C ZINC001165721462 1048710251 /nfs/dbraw/zinc/71/02/51/1048710251.db2.gz CRHFUAHKOZTZLZ-FPOVZHCZSA-N 0 1 322.452 4.242 20 0 DIADMN Cc1cc(CN2[C@H](C)CO[C@@H](c3ccccc3)[C@@H]2C)cs1 ZINC001176532729 1048710548 /nfs/dbraw/zinc/71/05/48/1048710548.db2.gz NJZAMQASPFXZSV-QIIPPGSGSA-N 0 1 301.455 4.407 20 0 DIADMN CCCN[C@@H](C)c1nc(Cc2c(Cl)cccc2Cl)no1 ZINC000109520340 1048711149 /nfs/dbraw/zinc/71/11/49/1048711149.db2.gz AXGHEZWXKZZSJH-VIFPVBQESA-N 0 1 314.216 4.028 20 0 DIADMN O=C(NOc1ccc(F)cc1)[C@H]1C[C@@H]1c1ccc2ccccc2c1 ZINC001165800957 1048717192 /nfs/dbraw/zinc/71/71/92/1048717192.db2.gz RBCBKJYDTUOHEZ-MOPGFXCFSA-N 0 1 321.351 4.193 20 0 DIADMN O=C([O-])C1(c2ccc(Nc3cccc4cc[nH+]cc43)cc2)CC1 ZINC001176590790 1048719057 /nfs/dbraw/zinc/71/90/57/1048719057.db2.gz XEEFCBAEDWIWHW-UHFFFAOYSA-N 0 1 304.349 4.095 20 0 DIADMN C[C@H]1CC[C@@](C)(CNC(=O)c2ccc(O)c(Cl)c2)C1(C)C ZINC001165820174 1048719634 /nfs/dbraw/zinc/71/96/34/1048719634.db2.gz GHGHXSMKBZSBBA-GTNSWQLSSA-N 0 1 309.837 4.238 20 0 DIADMN Cc1ccncc1CN(C)Cc1ccc(OC(C)C)c(Cl)c1 ZINC000483000827 1048722572 /nfs/dbraw/zinc/72/25/72/1048722572.db2.gz PXJCJBUREGSEIW-UHFFFAOYSA-N 0 1 318.848 4.463 20 0 DIADMN CC(C)COc1cccc(CNCc2ccc(Cl)cn2)c1 ZINC000776497208 1048723249 /nfs/dbraw/zinc/72/32/49/1048723249.db2.gz QWCZYXCJIAATQJ-UHFFFAOYSA-N 0 1 304.821 4.060 20 0 DIADMN CO[C@@H](Cc1ccccc1)CN(C)[C@@H](C)c1cc(F)ccc1F ZINC001190381574 1048724466 /nfs/dbraw/zinc/72/44/66/1048724466.db2.gz BYHRGZRXHXDSAY-YOEHRIQHSA-N 0 1 319.395 4.215 20 0 DIADMN C[C@@H](c1cccs1)N(C)Cc1cccc2c1OC(F)(F)O2 ZINC001190367217 1048728424 /nfs/dbraw/zinc/72/84/24/1048728424.db2.gz XCTIBVXTLKHADX-JTQLQIEISA-N 0 1 311.353 4.263 20 0 DIADMN CC1(C)CCN(C(=O)c2ccc(O)c(Cl)c2)CC(C)(C)C1 ZINC001166012496 1048728348 /nfs/dbraw/zinc/72/83/48/1048728348.db2.gz IDFHRXLYPDYASR-UHFFFAOYSA-N 0 1 309.837 4.334 20 0 DIADMN FC(F)(F)OCCCN1CCC[C@@H]1c1ccccc1Cl ZINC001190407606 1048731388 /nfs/dbraw/zinc/73/13/88/1048731388.db2.gz QAWFTOWGCWUROG-CYBMUJFWSA-N 0 1 307.743 4.403 20 0 DIADMN CCc1ccc(NC(=O)CN2CCC[C@H]2c2ccccc2C)cc1 ZINC001190407843 1048733047 /nfs/dbraw/zinc/73/30/47/1048733047.db2.gz QYLLZVADWZQUOX-FQEVSTJZSA-N 0 1 322.452 4.333 20 0 DIADMN C[C@@H](c1ccc(F)nc1)N1CCC[C@@]2(C=Cc3ccccc3O2)C1 ZINC001176609862 1048736393 /nfs/dbraw/zinc/73/63/93/1048736393.db2.gz GZYCYHXSVKKYBY-MGPUTAFESA-N 0 1 324.399 4.222 20 0 DIADMN CCCCc1noc([C@@H](C)N2CC[C@H](c3ccc(F)cc3)C2)n1 ZINC000483107233 1048738406 /nfs/dbraw/zinc/73/84/06/1048738406.db2.gz DJGCVIPYINDPRW-HIFRSBDPSA-N 0 1 317.408 4.102 20 0 DIADMN FC(F)(F)COc1ccnc(NC/C=C/c2ccccc2)c1 ZINC001166154367 1048738584 /nfs/dbraw/zinc/73/85/84/1048738584.db2.gz YNBNTMBJSNATFK-QPJJXVBHSA-N 0 1 308.303 4.148 20 0 DIADMN CC(C)(C)c1cnc(CN2CC[C@@H](c3ccc(F)cc3)C2)o1 ZINC000483118373 1048740722 /nfs/dbraw/zinc/74/07/22/1048740722.db2.gz HTPGRTAGFBUGDT-CQSZACIVSA-N 0 1 302.393 4.101 20 0 DIADMN CN(Cc1nc(-c2ccc(F)c(F)c2)no1)[C@@H]1CCC(C)(C)C1 ZINC000483127382 1048741594 /nfs/dbraw/zinc/74/15/94/1048741594.db2.gz XDAQYRLMBLIHSW-GFCCVEGCSA-N 0 1 321.371 4.025 20 0 DIADMN CN(Cc1nc(-c2ccc(F)c(F)c2)no1)[C@H]1CCC(C)(C)C1 ZINC000483127384 1048742149 /nfs/dbraw/zinc/74/21/49/1048742149.db2.gz XDAQYRLMBLIHSW-LBPRGKRZSA-N 0 1 321.371 4.025 20 0 DIADMN CN(Cc1cn(C(C)(C)C)nn1)C1CCC(C(C)(C)C)CC1 ZINC000483172166 1048751706 /nfs/dbraw/zinc/75/17/06/1048751706.db2.gz KQZFDASUTZENNU-UHFFFAOYSA-N 0 1 306.498 4.070 20 0 DIADMN CSc1ccc(Cl)c(NC(=O)c2c(O)cccc2F)c1 ZINC001166464527 1048753122 /nfs/dbraw/zinc/75/31/22/1048753122.db2.gz SMFYRYSHZSAEPG-UHFFFAOYSA-N 0 1 311.765 4.159 20 0 DIADMN CCCN(Cc1cn(C(C)(C)C)nn1)[C@H](CC)c1ccccc1 ZINC000483184510 1048754642 /nfs/dbraw/zinc/75/46/42/1048754642.db2.gz LQNWHPRGGGQLAH-GOSISDBHSA-N 0 1 314.477 4.396 20 0 DIADMN CC[C@H](c1ccc(Cl)cc1)N1C[C@]2(CCOC2)OC(C)(C)C1 ZINC000483204650 1048755800 /nfs/dbraw/zinc/75/58/00/1048755800.db2.gz SFABVZJZYJPHJV-AEFFLSMTSA-N 0 1 323.864 4.061 20 0 DIADMN CCCN(CC)CC(=O)Nc1cccc(Oc2ccccc2)c1 ZINC001190604414 1048764647 /nfs/dbraw/zinc/76/46/47/1048764647.db2.gz DLLIAEBPFGGTOD-UHFFFAOYSA-N 0 1 312.413 4.149 20 0 DIADMN CCCN(CCc1cnn(CC)c1)Cc1c(F)cccc1Cl ZINC001190627576 1048768709 /nfs/dbraw/zinc/76/87/09/1048768709.db2.gz IYBYIQSRZAVCSL-UHFFFAOYSA-N 0 1 323.843 4.150 20 0 DIADMN CCS[C@H]1CCCCN(Cc2ccc(Br)o2)C1 ZINC000483290040 1048771916 /nfs/dbraw/zinc/77/19/16/1048771916.db2.gz FYPDLYUGGGLCNA-LBPRGKRZSA-N 0 1 318.280 4.150 20 0 DIADMN COc1ccc2c(c1)CN(C/C=C/c1ccc(Cl)cc1)CC2 ZINC001190706687 1048775052 /nfs/dbraw/zinc/77/50/52/1048775052.db2.gz BKQRMCROFAIVOO-NSCUHMNNSA-N 0 1 313.828 4.420 20 0 DIADMN Cc1nnsc1[C@@H](C)N(C)CCc1cccc2ccccc21 ZINC001190682619 1048777382 /nfs/dbraw/zinc/77/73/82/1048777382.db2.gz KGMUOBNVFIINII-CQSZACIVSA-N 0 1 311.454 4.235 20 0 DIADMN C[C@H](OC(=O)[C@@H]1CC[C@@H](C)C1)c1nc2ccc(Cl)cc2[nH]1 ZINC000776528742 1048778883 /nfs/dbraw/zinc/77/88/83/1048778883.db2.gz XIROAALFQGBHHG-OUAUKWLOSA-N 0 1 306.793 4.257 20 0 DIADMN Clc1sccc1CN1CC[C@@H](COc2ccccc2)C1 ZINC000483322307 1048779926 /nfs/dbraw/zinc/77/99/26/1048779926.db2.gz SBAIJRDTFXIKIZ-CYBMUJFWSA-N 0 1 307.846 4.302 20 0 DIADMN COc1ccc([C@H]2CCN(Cc3cc(Cl)ccc3F)C2)cc1 ZINC001190740931 1048781971 /nfs/dbraw/zinc/78/19/71/1048781971.db2.gz BREUHMGZZKDQQL-AWEZNQCLSA-N 0 1 319.807 4.477 20 0 DIADMN C[C@H]1CCc2ccccc2[C@H]1NCc1nc2cc(F)ccc2n1C ZINC000775410649 1048783486 /nfs/dbraw/zinc/78/34/86/1048783486.db2.gz LYALAJZNKBNWOS-RBZFPXEDSA-N 0 1 323.415 4.126 20 0 DIADMN C[C@H](c1ccccc1Cl)N1CC(C)(C)O[C@]2(CCCOC2)C1 ZINC000483362040 1048783735 /nfs/dbraw/zinc/78/37/35/1048783735.db2.gz XCDQTCGZLSPZDF-RDTXWAMCSA-N 0 1 323.864 4.061 20 0 DIADMN C[C@H]1N(C(=O)c2cc(F)cc3[nH]cnc32)c2ccccc2C1(C)C ZINC001166721871 1048786051 /nfs/dbraw/zinc/78/60/51/1048786051.db2.gz VEBQEQDSXKFGGA-LLVKDONJSA-N 0 1 323.371 4.029 20 0 DIADMN COCCN(Cc1csc(C(C)(C)C)n1)[C@@H]1CC[C@@H](C)C1 ZINC000483398524 1048786504 /nfs/dbraw/zinc/78/65/04/1048786504.db2.gz AFYWZLRVRYHRCE-UKRRQHHQSA-N 0 1 310.507 4.078 20 0 DIADMN C1=C(CN2CCCC[C@@H]2c2nc(-c3ccccc3)no2)CCC1 ZINC001190854681 1048792671 /nfs/dbraw/zinc/79/26/71/1048792671.db2.gz JLJFDKWJRFEQOQ-QGZVFWFLSA-N 0 1 309.413 4.374 20 0 DIADMN Cc1ccc(-c2nc(CN3CCSCC[C@H]3C)cs2)cc1 ZINC000483423478 1048793542 /nfs/dbraw/zinc/79/35/42/1048793542.db2.gz AQINNJUFGYABMO-CQSZACIVSA-N 0 1 318.511 4.446 20 0 DIADMN COc1ccc(CN2CC3(C2)CC(F)(F)C3)c2ccccc12 ZINC001203992103 1048795860 /nfs/dbraw/zinc/79/58/60/1048795860.db2.gz RJSIRQZPSNVYJA-UHFFFAOYSA-N 0 1 303.352 4.080 20 0 DIADMN C/C(=C\C[N@@H+](Cc1ccccc1)[C@H](C)Cc1ccccc1)C(=O)[O-] ZINC000851709819 1048796391 /nfs/dbraw/zinc/79/63/91/1048796391.db2.gz ZCEFHIYZMUXOEG-VJSYINPZSA-N 0 1 323.436 4.151 20 0 DIADMN COc1ccc([C@H]2CCCN2Cc2cc3ccccc3o2)nc1 ZINC001176871492 1048796883 /nfs/dbraw/zinc/79/68/83/1048796883.db2.gz MIJYYLHFRVBZNZ-GOSISDBHSA-N 0 1 308.381 4.174 20 0 DIADMN CCOc1ccc(CN(Cc2cccc(F)n2)C(C)C)cc1 ZINC000851739140 1048798387 /nfs/dbraw/zinc/79/83/87/1048798387.db2.gz DFQSDDPXJFAEDW-UHFFFAOYSA-N 0 1 302.393 4.030 20 0 DIADMN CN(CC=C(Cl)Cl)C[C@@H]1CCCO[C@@H]1c1ccccc1 ZINC000851741576 1048798507 /nfs/dbraw/zinc/79/85/07/1048798507.db2.gz LDSFREOPQMSSER-GOEBONIOSA-N 0 1 314.256 4.405 20 0 DIADMN CCc1ncc(C[N@H+]2CC[C@H](C(F)(F)F)C(C)(C)C2)s1 ZINC000483438088 1048798751 /nfs/dbraw/zinc/79/87/51/1048798751.db2.gz ASQJTHWJILLCNL-NSHDSACASA-N 0 1 306.397 4.116 20 0 DIADMN CCc1ncc(CN2CC[C@H](C(F)(F)F)C(C)(C)C2)s1 ZINC000483438088 1048798763 /nfs/dbraw/zinc/79/87/63/1048798763.db2.gz ASQJTHWJILLCNL-NSHDSACASA-N 0 1 306.397 4.116 20 0 DIADMN COc1ccc(C[N@H+]2CC[C@@H](C(F)(F)F)C(C)(C)C2)cc1F ZINC000483439819 1048799546 /nfs/dbraw/zinc/79/95/46/1048799546.db2.gz LETLTICSGHFZRR-CQSZACIVSA-N 0 1 319.342 4.245 20 0 DIADMN COc1ccc(CN2CC[C@@H](C(F)(F)F)C(C)(C)C2)cc1F ZINC000483439819 1048799563 /nfs/dbraw/zinc/79/95/63/1048799563.db2.gz LETLTICSGHFZRR-CQSZACIVSA-N 0 1 319.342 4.245 20 0 DIADMN O=[N+]([O-])c1cccc2c1CC[C@@H]2NC1(c2cccc(F)c2)CC1 ZINC000568237490 1048799645 /nfs/dbraw/zinc/79/96/45/1048799645.db2.gz AXLPWSKIAXFLAB-INIZCTEOSA-N 0 1 312.344 4.000 20 0 DIADMN CCc1ccc([C@H]2C[N@@H+](Cc3cccc4[nH]ccc43)CCO2)cc1 ZINC000483439906 1048800931 /nfs/dbraw/zinc/80/09/31/1048800931.db2.gz FODABNGZVDSHDE-OAQYLSRUSA-N 0 1 320.436 4.304 20 0 DIADMN CCc1ccc([C@H]2CN(Cc3cccc4[nH]ccc43)CCO2)cc1 ZINC000483439906 1048800949 /nfs/dbraw/zinc/80/09/49/1048800949.db2.gz FODABNGZVDSHDE-OAQYLSRUSA-N 0 1 320.436 4.304 20 0 DIADMN Clc1ccccc1CN1CCO[C@@H](c2ccccc2)CC1 ZINC001176939336 1048803119 /nfs/dbraw/zinc/80/31/19/1048803119.db2.gz HEBNCXMXFGVATP-GOSISDBHSA-N 0 1 301.817 4.304 20 0 DIADMN ClC(Cl)=CCNC1(c2ccc(Cl)cc2)CCOCC1 ZINC000851839705 1048805449 /nfs/dbraw/zinc/80/54/49/1048805449.db2.gz BNLSICRWTZGZHY-UHFFFAOYSA-N 0 1 320.647 4.254 20 0 DIADMN CCCN(CCc1cccc(F)c1)Cc1csc(NCC)n1 ZINC001190945133 1048806569 /nfs/dbraw/zinc/80/65/69/1048806569.db2.gz ZWLFLFGOPYDGCB-UHFFFAOYSA-N 0 1 321.465 4.169 20 0 DIADMN Cc1cc(F)cc(-c2noc(-c3ccc(Cl)cc3O)n2)c1 ZINC000162788741 1048809103 /nfs/dbraw/zinc/80/91/03/1048809103.db2.gz OLMZIYDCIRWCJR-UHFFFAOYSA-N 0 1 304.708 4.210 20 0 DIADMN CCO[C@@H](C)c1noc(CN2CCCCC23CCCCCC3)n1 ZINC001176959655 1048811213 /nfs/dbraw/zinc/81/12/13/1048811213.db2.gz NUUBYOZDLXAPGM-HNNXBMFYSA-N 0 1 321.465 4.246 20 0 DIADMN COc1cccc([C@H]2CN([C@H](C)c3cccc(C)c3)CCO2)c1 ZINC000483527324 1048811935 /nfs/dbraw/zinc/81/19/35/1048811935.db2.gz TZLVOVDCLAIWTR-OXQOHEQNSA-N 0 1 311.425 4.138 20 0 DIADMN CN(CC=C(Cl)Cl)[C@@H]1CCO[C@@H](c2ccc(F)cc2)C1 ZINC000851935945 1048812531 /nfs/dbraw/zinc/81/25/31/1048812531.db2.gz ZDZOCBQCZFZZDG-ZIAGYGMSSA-N 0 1 318.219 4.297 20 0 DIADMN Fc1cccc(CNC2(c3cccc(Cl)c3)CCCC2)n1 ZINC000851905378 1048813303 /nfs/dbraw/zinc/81/33/03/1048813303.db2.gz DPOODJLPUPDLJE-UHFFFAOYSA-N 0 1 304.796 4.433 20 0 DIADMN C[C@@H]1C[C@H]1[C@H](NCc1cccc(F)n1)c1ccc(Cl)cc1 ZINC000851909240 1048814169 /nfs/dbraw/zinc/81/41/69/1048814169.db2.gz ZQYXSAUBHJWIRG-RGYTYGDFSA-N 0 1 304.796 4.361 20 0 DIADMN CC[C@@H](NCc1cc(C2CC2)no1)c1ccc(OC(F)F)cc1 ZINC000851907396 1048814860 /nfs/dbraw/zinc/81/48/60/1048814860.db2.gz SLVYCGVLTOYBBU-OAHLLOKOSA-N 0 1 322.355 4.394 20 0 DIADMN Cc1ccc(-c2cc(CN3CCC(C(F)F)CC3)on2)cc1 ZINC000483532460 1048815952 /nfs/dbraw/zinc/81/59/52/1048815952.db2.gz OUQQTHPNTBXWEE-UHFFFAOYSA-N 0 1 306.356 4.127 20 0 DIADMN Cc1ccc(CNCc2c(C)ccc(Br)c2F)cc1 ZINC001177066370 1048819444 /nfs/dbraw/zinc/81/94/44/1048819444.db2.gz VWPNQEHZWCESRL-UHFFFAOYSA-N 0 1 322.221 4.495 20 0 DIADMN Fc1ccc([C@H]2CCCN2CCOCc2ccccc2)cc1F ZINC001191040039 1048820701 /nfs/dbraw/zinc/82/07/01/1048820701.db2.gz VIEVEJNOBYVSHO-LJQANCHMSA-N 0 1 317.379 4.319 20 0 DIADMN COc1cccc(COc2ccc(CNCc3ccco3)cc2)c1 ZINC001177081727 1048821054 /nfs/dbraw/zinc/82/10/54/1048821054.db2.gz NRGLJEMBIBBRSQ-UHFFFAOYSA-N 0 1 323.392 4.157 20 0 DIADMN CC[C@@H](C)CN(C)Cc1c(C)nn(Cc2ccccc2)c1Cl ZINC001191022465 1048824389 /nfs/dbraw/zinc/82/43/89/1048824389.db2.gz SOLHTMZUEPOURR-CQSZACIVSA-N 0 1 319.880 4.371 20 0 DIADMN Fc1cccc(CN[C@@H](c2ccc(F)c(Cl)c2)C2CC2)n1 ZINC000852114684 1048827749 /nfs/dbraw/zinc/82/77/49/1048827749.db2.gz VDEZGUMQULLHEB-MRXNPFEDSA-N 0 1 308.759 4.254 20 0 DIADMN CC[C@@H]1CCC[C@@H](N[C@H](C)c2nc(Cc3ccccc3)no2)C1 ZINC000483648449 1048829450 /nfs/dbraw/zinc/82/94/50/1048829450.db2.gz CLFXDCDSESCITD-BFYDXBDKSA-N 0 1 313.445 4.280 20 0 DIADMN CC[C@H]1C[C@@H](CN(Cc2c(F)cccc2F)C2CC2)CCO1 ZINC000483642891 1048829647 /nfs/dbraw/zinc/82/96/47/1048829647.db2.gz XCKIGUARAFUBTG-ZFWWWQNUSA-N 0 1 309.400 4.134 20 0 DIADMN COc1ccc(C[N@H+]2CCS[C@@H](C)[C@@H]2c2ccccc2)cc1 ZINC001191030055 1048830835 /nfs/dbraw/zinc/83/08/35/1048830835.db2.gz LKDDIXYCCYVTIW-HNAYVOBHSA-N 0 1 313.466 4.374 20 0 DIADMN CC(C)[C@@H]1CCC[C@@H]1N[C@@H](C)c1nc(Cc2ccccc2)no1 ZINC000483644016 1048831489 /nfs/dbraw/zinc/83/14/89/1048831489.db2.gz DGOQDZQRPBNZEU-XIRDDKMYSA-N 0 1 313.445 4.136 20 0 DIADMN COc1ccc([C@H](C)N(C)Cc2cc(C)nc(Cl)c2)cc1 ZINC000797589315 1048832390 /nfs/dbraw/zinc/83/23/90/1048832390.db2.gz FZDUDGBWBJYUNK-ZDUSSCGKSA-N 0 1 304.821 4.245 20 0 DIADMN C[C@@H](CCc1ccsc1)N[C@@H](C)c1nc(C(C)(C)C)no1 ZINC000483637992 1048833541 /nfs/dbraw/zinc/83/35/41/1048833541.db2.gz ISYKWOYIZSKNPB-RYUDHWBXSA-N 0 1 307.463 4.101 20 0 DIADMN CCCC[C@@H](C)N[C@@H](C)c1nc(-c2ccc(C)c(F)c2)no1 ZINC000483636478 1048833878 /nfs/dbraw/zinc/83/38/78/1048833878.db2.gz NJEGSKXQVQUOGJ-OLZOCXBDSA-N 0 1 305.397 4.413 20 0 DIADMN Cc1nn(C(C)(C)C)c(C)c1CN1CCc2cc(C)ccc2C1 ZINC000483658597 1048834923 /nfs/dbraw/zinc/83/49/23/1048834923.db2.gz VGOIDAPLDCCBKG-UHFFFAOYSA-N 0 1 311.473 4.122 20 0 DIADMN Fc1ccc(F)c(CNCCCOc2ccccc2)c1Cl ZINC001177149018 1048837468 /nfs/dbraw/zinc/83/74/68/1048837468.db2.gz YCBYNCXEBHWPKJ-UHFFFAOYSA-N 0 1 311.759 4.177 20 0 DIADMN C[C@H](NCc1cc2cnccc2o1)c1ccccc1OC(F)F ZINC001177162718 1048839769 /nfs/dbraw/zinc/83/97/69/1048839769.db2.gz PNSYTDHBSKPODI-NSHDSACASA-N 0 1 318.323 4.280 20 0 DIADMN Clc1ccc(CNCc2c[nH]c(-c3ccccc3)n2)s1 ZINC001177162289 1048839912 /nfs/dbraw/zinc/83/99/12/1048839912.db2.gz KOVFGNACIQLXRG-UHFFFAOYSA-N 0 1 303.818 4.081 20 0 DIADMN Clc1ccc(CNCc2cnc(-c3ccccc3)[nH]2)s1 ZINC001177162289 1048839923 /nfs/dbraw/zinc/83/99/23/1048839923.db2.gz KOVFGNACIQLXRG-UHFFFAOYSA-N 0 1 303.818 4.081 20 0 DIADMN FC(F)(F)c1ccc(CNCc2cc3cnccc3o2)cc1 ZINC001177153642 1048841305 /nfs/dbraw/zinc/84/13/05/1048841305.db2.gz 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COc1ccc(Cl)cc1CN1CCS[C@@H]2CCCC[C@@H]21 ZINC001191358259 1048925859 /nfs/dbraw/zinc/92/58/59/1048925859.db2.gz HWLSKUSDYJJXEF-GOEBONIOSA-N 0 1 311.878 4.209 20 0 DIADMN CCOc1cc(F)cc(CNC2(c3ccc(OC)cc3)CC2)c1 ZINC001177664092 1048928807 /nfs/dbraw/zinc/92/88/07/1048928807.db2.gz KRERFCZKEOEJCE-UHFFFAOYSA-N 0 1 315.388 4.012 20 0 DIADMN Fc1cc2cccnc2c(CNc2ccc3c(n2)CCCC3)c1 ZINC001203566562 1048930814 /nfs/dbraw/zinc/93/08/14/1048930814.db2.gz VIMZRVNZEHXCSE-UHFFFAOYSA-N 0 1 307.372 4.260 20 0 DIADMN Fc1cccc([C@H]2CCN2CCc2nsc3ccccc32)c1 ZINC001191389865 1048931226 /nfs/dbraw/zinc/93/12/26/1048931226.db2.gz GKSWVVCJTFUKPI-QGZVFWFLSA-N 0 1 312.413 4.425 20 0 DIADMN Oc1cccc(CNc2nc3ccc(Cl)cc3[nH]2)c1Cl ZINC001203571928 1048933823 /nfs/dbraw/zinc/93/38/23/1048933823.db2.gz LYIDWTDUAGFCEH-UHFFFAOYSA-N 0 1 308.168 4.187 20 0 DIADMN COc1cc(CNC2(c3ccccc3)CC2)cc(C(F)(F)F)c1 ZINC001177702662 1048933795 /nfs/dbraw/zinc/93/37/95/1048933795.db2.gz KBJINSSYAQJEOJ-UHFFFAOYSA-N 0 1 321.342 4.493 20 0 DIADMN Cc1cc(CNc2ccc3c(n2)CCCC3)cc2cccnc12 ZINC001203570748 1048933915 /nfs/dbraw/zinc/93/39/15/1048933915.db2.gz AHOCZTVFALZWHP-UHFFFAOYSA-N 0 1 303.409 4.429 20 0 DIADMN C[C@@H](COCC(F)(F)F)NCc1cccc(Cl)c1Cl ZINC001177707476 1048934079 /nfs/dbraw/zinc/93/40/79/1048934079.db2.gz KPEFYFBCKBRXPO-QMMMGPOBSA-N 0 1 316.150 4.050 20 0 DIADMN Fc1cc(OC(F)F)ccc1CNC1(c2ccccc2)CC1 ZINC001177702272 1048935008 /nfs/dbraw/zinc/93/50/08/1048935008.db2.gz GEMFMXMVERHHRU-UHFFFAOYSA-N 0 1 307.315 4.206 20 0 DIADMN Fc1cccc(CCCN2CCc3c(F)ccc(F)c3C2)c1 ZINC001191417060 1048938991 /nfs/dbraw/zinc/93/89/91/1048938991.db2.gz MDWCMANLPMZCOY-UHFFFAOYSA-N 0 1 305.343 4.095 20 0 DIADMN [O-]c1cccc(C[NH2+]CCCc2ccc(Cl)cc2)c1Cl ZINC001177753728 1048941163 /nfs/dbraw/zinc/94/11/63/1048941163.db2.gz MQGWPKUAXJZEPM-UHFFFAOYSA-N 0 1 310.224 4.421 20 0 DIADMN CCc1cccc2c1OCC[C@H]2NCc1ccc(F)c(F)c1 ZINC001177758387 1048941594 /nfs/dbraw/zinc/94/15/94/1048941594.db2.gz XQHWVMJPNAIXSG-QGZVFWFLSA-N 0 1 303.352 4.141 20 0 DIADMN CC(C)[C@H](N)c1noc(-c2cccc(SC(F)(F)F)c2)n1 ZINC000854132609 1048942712 /nfs/dbraw/zinc/94/27/12/1048942712.db2.gz DGYGLHGTLOGGMJ-JTQLQIEISA-N 0 1 317.336 4.004 20 0 DIADMN CC(C)c1ncc(CN[C@@H]2CSCc3ccccc32)s1 ZINC001177779449 1048942717 /nfs/dbraw/zinc/94/27/17/1048942717.db2.gz IPZQOIHJCKRZLK-OAHLLOKOSA-N 0 1 304.484 4.344 20 0 DIADMN CC[C@H](NC)c1nc(-c2ccc(OC3CCCCC3)cc2)no1 ZINC000854146221 1048943119 /nfs/dbraw/zinc/94/31/19/1048943119.db2.gz GJKWJXWEEXSHCE-INIZCTEOSA-N 0 1 315.417 4.119 20 0 DIADMN CCOc1cc2c(cc1CN[C@H](C)c1cccs1)O[C@@H](C)C2 ZINC000194885548 1048943853 /nfs/dbraw/zinc/94/38/53/1048943853.db2.gz OYCBQMBKBKQHRN-QWHCGFSZSA-N 0 1 317.454 4.321 20 0 DIADMN C[C@H](OC(=O)C=Cc1ccco1)c1nc2ccc(Cl)cc2[nH]1 ZINC000111990806 1048944629 /nfs/dbraw/zinc/94/46/29/1048944629.db2.gz XLBIKXYLGDDEPL-STUBTGCMSA-N 0 1 316.744 4.127 20 0 DIADMN C[C@@H](OC(=O)Cc1ccsc1)c1nc2ccc(Cl)cc2[nH]1 ZINC000111989685 1048944683 /nfs/dbraw/zinc/94/46/83/1048944683.db2.gz RUAUVABUUUIOLM-SECBINFHSA-N 0 1 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CCCCCCOc1ccc(NC(=O)[C@@H](C)N2CCCC2)cc1 ZINC001180582887 1049385545 /nfs/dbraw/zinc/38/55/45/1049385545.db2.gz JTYFDFYVSBIWAE-MRXNPFEDSA-N 0 1 318.461 4.069 20 0 DIADMN c1ccc(CSCC[N@H+]2CCC=C(c3ccccn3)C2)cc1 ZINC001194571022 1049394357 /nfs/dbraw/zinc/39/43/57/1049394357.db2.gz QKOQLNUQSBAQAI-UHFFFAOYSA-N 0 1 310.466 4.104 20 0 DIADMN C[C@H]1CCN(Cc2nnn(-c3ccccc3)c2C2CC2)CC1(C)C ZINC001180674163 1049398382 /nfs/dbraw/zinc/39/83/82/1049398382.db2.gz SYJHUWKHRVWIDV-HNNXBMFYSA-N 0 1 324.472 4.013 20 0 DIADMN COc1cc(CN2CCc3sccc3C2)cc2ccccc21 ZINC001205171221 1049401803 /nfs/dbraw/zinc/40/18/03/1049401803.db2.gz YBCIHAZYIPBDSA-UHFFFAOYSA-N 0 1 309.434 4.468 20 0 DIADMN Nc1ccc(F)c(CN2CCCC[C@H]2c2ccccc2)c1F ZINC001205171423 1049402063 /nfs/dbraw/zinc/40/20/63/1049402063.db2.gz QCSWIDABZACBOL-KRWDZBQOSA-N 0 1 302.368 4.274 20 0 DIADMN Cc1ccc(CN(C)CCSc2cccc(Cl)c2)nc1 ZINC001194648308 1049403588 /nfs/dbraw/zinc/40/35/88/1049403588.db2.gz IRVGFTURAYWGAF-UHFFFAOYSA-N 0 1 306.862 4.268 20 0 DIADMN 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DIADMN FC(F)(F)Oc1cccc(CN[C@@H]2CCCc3occc32)c1 ZINC000102780394 1049719586 /nfs/dbraw/zinc/71/95/86/1049719586.db2.gz DDNWMHWMBMJLEV-CQSZACIVSA-N 0 1 311.303 4.345 20 0 DIADMN FC[C@@H](NCCc1c(F)cccc1Cl)c1ccc(F)cc1 ZINC001197136181 1049720030 /nfs/dbraw/zinc/72/00/30/1049720030.db2.gz WSSRQQYOESPYRE-MRXNPFEDSA-N 0 1 313.750 4.461 20 0 DIADMN C[C@@H]1CCC[C@H](CCN2Cc3cccnc3N3CCC[C@H]3C2)C1 ZINC001197145112 1049723511 /nfs/dbraw/zinc/72/35/11/1049723511.db2.gz KMUPVUYVFZSAFC-LMMKCTJWSA-N 0 1 313.489 4.082 20 0 DIADMN C[C@@H]1CN(Cc2ccccc2OCc2ccccc2)CCS1 ZINC001197194704 1049726297 /nfs/dbraw/zinc/72/62/97/1049726297.db2.gz STHYQOBXNHREAD-MRXNPFEDSA-N 0 1 313.466 4.203 20 0 DIADMN C[C@H](NCc1ccc(F)c(Cl)c1)c1cc2cnccc2o1 ZINC001197230354 1049729847 /nfs/dbraw/zinc/72/98/47/1049729847.db2.gz MPHMRHUXMUBALE-JTQLQIEISA-N 0 1 304.752 4.471 20 0 DIADMN C[C@]1(C2CCCCC2)CCN1Cc1nccn1Cc1ccccc1 ZINC001197238420 1049729886 /nfs/dbraw/zinc/72/98/86/1049729886.db2.gz FFVWVRHUBLFLFY-OAQYLSRUSA-N 0 1 323.484 4.476 20 0 DIADMN COc1ccc([C@H]2COCCN2C[C@H](C)CC(C)(C)C)cc1 ZINC001197231524 1049729913 /nfs/dbraw/zinc/72/99/13/1049729913.db2.gz ZADZGBJHQZRQQD-CRAIPNDOSA-N 0 1 305.462 4.141 20 0 DIADMN COc1ccnc([C@H](C)N[C@@H]2CCc3c2cccc3Cl)c1 ZINC000924844176 1049731517 /nfs/dbraw/zinc/73/15/17/1049731517.db2.gz QXXYPXIRWXKBIT-MEDUHNTESA-N 0 1 302.805 4.082 20 0 DIADMN CCN(Cc1ccccc1OC(C)C)[C@H](CO)c1ccccc1 ZINC001197255546 1049733050 /nfs/dbraw/zinc/73/30/50/1049733050.db2.gz KQNQRWWXDYHLHJ-LJQANCHMSA-N 0 1 313.441 4.029 20 0 DIADMN CC[C@@H](C)c1nc([C@@H](C)NC(=O)C2(CC(C)C)CCCC2)n[nH]1 ZINC000489181880 1049733621 /nfs/dbraw/zinc/73/36/21/1049733621.db2.gz VFJDLEBXYAORHP-ZIAGYGMSSA-N 0 1 320.481 4.102 20 0 DIADMN COc1ccc(Cl)c(CN2CCSC[C@H]2C(C)(C)C)c1 ZINC001197297461 1049735624 /nfs/dbraw/zinc/73/56/24/1049735624.db2.gz PHKSYTLPVXPCJY-HNNXBMFYSA-N 0 1 313.894 4.312 20 0 DIADMN CC[C@H](C)c1nc([C@H](C)NC(=O)C[C@@H]2CCCCC2(C)C)n[nH]1 ZINC000489237502 1049736807 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c1cc2cnc(-c3ccc4cnn([C@@H]5CCCCO5)c4c3)cc2[nH]1 ZINC001206615602 1049769687 /nfs/dbraw/zinc/76/96/87/1049769687.db2.gz QJPMWVMVEAYOMM-IBGZPJMESA-N 0 1 318.380 4.279 20 0 DIADMN c1ncn2cc(-c3ccc4cnn([C@H]5CCCCO5)c4c3)ccc12 ZINC001206657909 1049776319 /nfs/dbraw/zinc/77/63/19/1049776319.db2.gz YFWVOCVMQKBFEN-LJQANCHMSA-N 0 1 318.380 4.050 20 0 DIADMN COc1cc([C@H](C)N[C@H](c2ccc(F)cc2)C2CCCC2)on1 ZINC000924848036 1049777188 /nfs/dbraw/zinc/77/71/88/1049777188.db2.gz RCMPLIWNVXXNRM-SGTLLEGYSA-N 0 1 318.392 4.404 20 0 DIADMN CC[C@@H](N[C@H]1CSCc2ccccc21)c1cccc(OC)n1 ZINC000924849220 1049785611 /nfs/dbraw/zinc/78/56/11/1049785611.db2.gz LKKWNQDXAXZZOJ-WBVHZDCISA-N 0 1 314.454 4.119 20 0 DIADMN CN(Cc1csc(Cc2ccccc2)n1)C1(C)CCCC1 ZINC000489867879 1049786348 /nfs/dbraw/zinc/78/63/48/1049786348.db2.gz CTKBHMZYTHXKTI-UHFFFAOYSA-N 0 1 300.471 4.498 20 0 DIADMN Cc1ccc(-c2cc(C(=O)N(C)C[C@H]3CC=CCC3)n[nH]2)c(C)c1 ZINC000489973135 1049792344 /nfs/dbraw/zinc/79/23/44/1049792344.db2.gz 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CCCOc1ncccc1CN[C@H]1c2cc(C)ccc2C[C@@H]1C ZINC000490171818 1049809203 /nfs/dbraw/zinc/80/92/03/1049809203.db2.gz IMXWMTIPLBHROL-HNAYVOBHSA-N 0 1 310.441 4.202 20 0 DIADMN COc1cccc(CCN(C)Cc2cc(-c3ccccc3)on2)c1 ZINC001206845871 1049812884 /nfs/dbraw/zinc/81/28/84/1049812884.db2.gz IQZXCDJPZDBVBF-UHFFFAOYSA-N 0 1 322.408 4.025 20 0 DIADMN Cc1ccnc(CN2CCC(Oc3cccc(Cl)c3)CC2)c1 ZINC001206854585 1049815120 /nfs/dbraw/zinc/81/51/20/1049815120.db2.gz JLNPCEGORCXZPE-UHFFFAOYSA-N 0 1 316.832 4.087 20 0 DIADMN COc1cncc(CN2CCCC[C@H]2c2ccc(C)c(C)c2)c1 ZINC001206998425 1049818665 /nfs/dbraw/zinc/81/86/65/1049818665.db2.gz PWCJNIXLTDDPCA-FQEVSTJZSA-N 0 1 310.441 4.434 20 0 DIADMN Cc1cc(CN2CCc3c(O)cccc3C2)ccc1C(F)(F)F ZINC001207049813 1049826721 /nfs/dbraw/zinc/82/67/21/1049826721.db2.gz NMCTZYFLJOYQHP-UHFFFAOYSA-N 0 1 321.342 4.278 20 0 DIADMN Cc1cnc(CN2CCC(CCCc3ccccc3)CC2)cn1 ZINC001207073609 1049829108 /nfs/dbraw/zinc/82/91/08/1049829108.db2.gz ZBTPTSORUHXUSU-UHFFFAOYSA-N 0 1 309.457 4.020 20 0 DIADMN O=c1cccc(CN2CC[C@H](c3ccc(Cl)c(Cl)c3)C2)[nH]1 ZINC001207073921 1049829645 /nfs/dbraw/zinc/82/96/45/1049829645.db2.gz NVNZTKPZIGWLHM-LBPRGKRZSA-N 0 1 323.223 4.084 20 0 DIADMN Cc1ccccc1C[C@H](C)N(C)Cc1cc(-c2ccco2)on1 ZINC000490459482 1049829993 /nfs/dbraw/zinc/82/99/93/1049829993.db2.gz UYQAZEJZVBRUNB-HNNXBMFYSA-N 0 1 310.397 4.306 20 0 DIADMN CN(Cc1ccc(Oc2ccccc2)cc1)Cc1cccc(=O)[nH]1 ZINC001207073418 1049830517 /nfs/dbraw/zinc/83/05/17/1049830517.db2.gz IZCXNHNLONHFGN-UHFFFAOYSA-N 0 1 320.392 4.212 20 0 DIADMN Cc1cnc(CN2CCC(c3ccc4ccccc4c3)CC2)cn1 ZINC001207077333 1049832521 /nfs/dbraw/zinc/83/25/21/1049832521.db2.gz HZLJYHLXTWURQR-UHFFFAOYSA-N 0 1 317.436 4.318 20 0 DIADMN CCc1nccc(CN(C)C(c2ccccc2)c2ccccc2)n1 ZINC001207082465 1049833256 /nfs/dbraw/zinc/83/32/56/1049833256.db2.gz LHQYVPQXSQQQSR-UHFFFAOYSA-N 0 1 317.436 4.260 20 0 DIADMN COc1ccccc1-c1ncc(CN[C@H](C)c2ccccc2)cn1 ZINC000490530859 1049839719 /nfs/dbraw/zinc/83/97/19/1049839719.db2.gz HUIHZHYVQLMRER-OAHLLOKOSA-N 0 1 319.408 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1052120953 /nfs/dbraw/zinc/12/09/53/1052120953.db2.gz GNLOHOAHFZXEDV-UHFFFAOYSA-N 0 1 316.470 4.109 20 0 DIADMN CC[C@@](C)(COc1ncccc1Cl)NC/C(Cl)=C/Cl ZINC000769917972 1052122221 /nfs/dbraw/zinc/12/22/21/1052122221.db2.gz KCRNPGBEKISBJF-SZNGSJQDSA-N 0 1 323.651 4.191 20 0 DIADMN Fc1cc(C(F)(F)F)ccc1Nc1ccnn1-c1ccncc1 ZINC001174401218 1052122711 /nfs/dbraw/zinc/12/27/11/1052122711.db2.gz SZKHXHMESMDJTN-UHFFFAOYSA-N 0 1 322.265 4.169 20 0 DIADMN CCc1noc(C)c1[C@H](C)NCc1ccc(-c2cccnc2)cc1 ZINC000769874809 1052125638 /nfs/dbraw/zinc/12/56/38/1052125638.db2.gz MIVSFCRIGLTOSJ-AWEZNQCLSA-N 0 1 321.424 4.458 20 0 DIADMN Cc1cc(Nc2ccnc(C(F)(F)F)c2)c2ccccc2n1 ZINC001174359359 1052126138 /nfs/dbraw/zinc/12/61/38/1052126138.db2.gz BQNNOCQKUJJMKQ-UHFFFAOYSA-N 0 1 303.287 4.123 20 0 DIADMN Cc1cccc(-c2nnc([C@@H]3NCCC[C@@H]3c3ccccc3)o2)c1 ZINC001217750386 1052132104 /nfs/dbraw/zinc/13/21/04/1052132104.db2.gz SREOFNICNKUNEJ-QZTJIDSGSA-N 0 1 319.408 4.253 20 0 DIADMN CCCCC[C@H](NC)c1nnc(Cc2ccc(Cl)cc2)o1 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CC(C)c1ncsc1NC1=CCN(C(=O)OC(C)(C)C)CC1 ZINC001174440521 1052158294 /nfs/dbraw/zinc/15/82/94/1052158294.db2.gz OEOWWTWQYVRRON-UHFFFAOYSA-N 0 1 323.462 4.203 20 0 DIADMN CC(C)(C)OC(=O)N1CCC(=Nc2cc(Cl)cs2)CC1 ZINC001174440102 1052158853 /nfs/dbraw/zinc/15/88/53/1052158853.db2.gz ABHLCYXKYGHMEA-UHFFFAOYSA-N 0 1 314.838 4.338 20 0 DIADMN Cc1ccc(OC2CCN(C/C=C/c3ccncc3)CC2)cc1C ZINC000494924605 1052175963 /nfs/dbraw/zinc/17/59/63/1052175963.db2.gz UUBCEDVZHQKDSK-ONEGZZNKSA-N 0 1 322.452 4.255 20 0 DIADMN Clc1cc(Br)cnc1Nc1ccc2cn[nH]c2c1 ZINC001174499458 1052177933 /nfs/dbraw/zinc/17/79/33/1052177933.db2.gz QYDZEYJIVJSRQZ-UHFFFAOYSA-N 0 1 323.581 4.117 20 0 DIADMN Cc1cc(Nc2ccc3c[nH]nc3c2)n(-c2cccc(C)c2)n1 ZINC001174498578 1052178377 /nfs/dbraw/zinc/17/83/77/1052178377.db2.gz PRRQHQGGTDTUAA-UHFFFAOYSA-N 0 1 303.369 4.109 20 0 DIADMN Clc1ccccc1-n1nccc1Nc1ccc2c[nH]nc2c1 ZINC001174499565 1052178567 /nfs/dbraw/zinc/17/85/67/1052178567.db2.gz ZCTVATBNPXBOLE-UHFFFAOYSA-N 0 1 309.760 4.146 20 0 DIADMN FC(F)(F)c1cc(Cl)c(Nc2ccc3c[nH]nc3c2)cn1 ZINC001174498778 1052178578 /nfs/dbraw/zinc/17/85/78/1052178578.db2.gz SIYFZEDPOOUXTF-UHFFFAOYSA-N 0 1 312.682 4.374 20 0 DIADMN CCOc1ccccc1C1=CCN(C/C=C\c2ccncc2)CC1 ZINC000494936497 1052179906 /nfs/dbraw/zinc/17/99/06/1052179906.db2.gz KOCGSXJDQSEPIB-WAYWQWQTSA-N 0 1 320.436 4.283 20 0 DIADMN COc1ccc(C(C)(C)C)cc1NC(=O)c1cccc2[nH]ncc21 ZINC000642317483 1052187634 /nfs/dbraw/zinc/18/76/34/1052187634.db2.gz IXVBNQSINSGDPS-UHFFFAOYSA-N 0 1 323.396 4.121 20 0 DIADMN Clc1ccc2c(c1Cl)CCN(C[C@H]1CCSC1)C2 ZINC000495000701 1052192051 /nfs/dbraw/zinc/19/20/51/1052192051.db2.gz YAWUWLXHIVBYCH-SNVBAGLBSA-N 0 1 302.270 4.105 20 0 DIADMN CCOc1c(Cl)cccc1CN1CCC[C@@]2(CCCOC2)C1 ZINC000494999007 1052192416 /nfs/dbraw/zinc/19/24/16/1052192416.db2.gz SNXXDTQWDVWBHW-GOSISDBHSA-N 0 1 323.864 4.131 20 0 DIADMN COc1ccc(CN2CCC[C@H]3CCC[C@H]32)cc1Br ZINC000228042260 1052197410 /nfs/dbraw/zinc/19/74/10/1052197410.db2.gz RZZHHGYUUBFUTK-UKRRQHHQSA-N 0 1 324.262 4.222 20 0 DIADMN COCCc1ncc(CN(C)Cc2ccc(C(C)C)cc2)s1 ZINC000637848691 1052197811 /nfs/dbraw/zinc/19/78/11/1052197811.db2.gz DHLAKURVLSSNJC-UHFFFAOYSA-N 0 1 318.486 4.087 20 0 DIADMN Fc1cccc(CCCN[C@H](Cc2ccccc2)c2ncco2)c1 ZINC000653912837 1052214048 /nfs/dbraw/zinc/21/40/48/1052214048.db2.gz VZLOZMOGOCEFIP-LJQANCHMSA-N 0 1 324.399 4.320 20 0 DIADMN CCc1ccccc1NC(=O)[C@@H](C)N1CC[C@@H](c2ccccc2)C1 ZINC000250203235 1052222867 /nfs/dbraw/zinc/22/28/67/1052222867.db2.gz GEPIDELXLCBUPY-VQIMIIECSA-N 0 1 322.452 4.066 20 0 DIADMN CN(C/C=C/c1ccncc1)Cc1cc(Br)cs1 ZINC000495159047 1052240604 /nfs/dbraw/zinc/24/06/04/1052240604.db2.gz SGGUWABRUIHZPY-NSCUHMNNSA-N 0 1 323.259 4.051 20 0 DIADMN CC(C)c1ccc(CNC2(C(=O)Nc3ccccc3)CC2)cc1 ZINC000495166211 1052242364 /nfs/dbraw/zinc/24/23/64/1052242364.db2.gz UWQVWXNOURCRBC-UHFFFAOYSA-N 0 1 308.425 4.071 20 0 DIADMN CCSc1cc(CNCc2cnc(C3CCC3)s2)ccn1 ZINC000495172244 1052245156 /nfs/dbraw/zinc/24/51/56/1052245156.db2.gz KGCKAFHZXCOBHX-UHFFFAOYSA-N 0 1 319.499 4.207 20 0 DIADMN C[C@@H]1CC[C@@](CO)(N(C)Cc2csc(C3CCCCC3)n2)C1 ZINC000495202510 1052255456 /nfs/dbraw/zinc/25/54/56/1052255456.db2.gz OLPRUKJAOVPABY-RDTXWAMCSA-N 0 1 322.518 4.174 20 0 DIADMN CCN(Cc1cc(-c2ccco2)on1)[C@@H](C)Cc1ccsc1 ZINC000495209987 1052257372 /nfs/dbraw/zinc/25/73/72/1052257372.db2.gz COQSGUINQYMIQO-ZDUSSCGKSA-N 0 1 316.426 4.449 20 0 DIADMN C[C@@H](NC[C@H](O)c1ccco1)c1cc(F)c(Cl)cc1Cl ZINC000914795207 1052259408 /nfs/dbraw/zinc/25/94/08/1052259408.db2.gz MMXIACXBCVFTKU-OQPBUACISA-N 0 1 318.175 4.110 20 0 DIADMN Cc1cnc(NCc2ccccc2OCc2ccccc2)c(N)c1 ZINC000310340149 1052265335 /nfs/dbraw/zinc/26/53/35/1052265335.db2.gz MLZKPEWYJXGGSO-UHFFFAOYSA-N 0 1 319.408 4.163 20 0 DIADMN COc1ccc(CN[C@@H](C)c2csc(Cl)c2)c(OC)c1 ZINC000230408171 1052267541 /nfs/dbraw/zinc/26/75/41/1052267541.db2.gz ZNNGVTHMHVYSAA-JTQLQIEISA-N 0 1 311.834 4.270 20 0 DIADMN CC(=O)OC1CCN(Cc2sc3ccccc3c2Cl)CC1 ZINC000153384362 1052271403 /nfs/dbraw/zinc/27/14/03/1052271403.db2.gz GDGTWZXYWOIJQR-UHFFFAOYSA-N 0 1 323.845 4.082 20 0 DIADMN CCCCCCN(C)Cc1nc(-c2cccc3cnccc32)no1 ZINC000761970126 1052281668 /nfs/dbraw/zinc/28/16/68/1052281668.db2.gz JDDZPKVOIMCOSI-UHFFFAOYSA-N 0 1 324.428 4.297 20 0 DIADMN O=C(Nc1ccc(-c2nc3ccc(F)cc3[nH]2)cc1)C1CCCC1 ZINC000303306467 1052320927 /nfs/dbraw/zinc/32/09/27/1052320927.db2.gz RAJQEPANHHZKFV-UHFFFAOYSA-N 0 1 323.371 4.498 20 0 DIADMN CC(C)CCC[C@H](C)NC(=O)[C@H](N)c1ccc2ccccc2c1 ZINC001220252372 1052326473 /nfs/dbraw/zinc/32/64/73/1052326473.db2.gz YCNSGKWCBOXMNK-HNAYVOBHSA-N 0 1 312.457 4.171 20 0 DIADMN CC(C)(C)CC(C)(C)NC(=O)[C@@H](N)c1ccc2ccccc2c1 ZINC001220289316 1052327386 /nfs/dbraw/zinc/32/73/86/1052327386.db2.gz ZAUSAOBPDNYTDP-KRWDZBQOSA-N 0 1 312.457 4.171 20 0 DIADMN CCc1ccccc1NC(=O)CN1CCC[C@@]2(CC=CCC2)C1 ZINC000303573947 1052332884 /nfs/dbraw/zinc/33/28/84/1052332884.db2.gz NHWAAJPATRWEMP-FQEVSTJZSA-N 0 1 312.457 4.010 20 0 DIADMN CC(C(=O)N1CCC[C@H]1c1nc2ccc(C)cc2[nH]1)=C1CCCC1 ZINC000176591937 1052334019 /nfs/dbraw/zinc/33/40/19/1052334019.db2.gz 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CC[C@H](C)N(C)CC(=O)Nc1ccc(Cl)cc1C(F)(F)F ZINC000068449649 1052745407 /nfs/dbraw/zinc/74/54/07/1052745407.db2.gz SYFKBXDAYLEKIM-VIFPVBQESA-N 0 1 322.758 4.028 20 0 DIADMN C[C@@H](NCc1nc(Cc2ccccc2)no1)C1CCCCCC1 ZINC000321794196 1052749341 /nfs/dbraw/zinc/74/93/41/1052749341.db2.gz LBZRRFNTNSUOKW-OAHLLOKOSA-N 0 1 313.445 4.109 20 0 DIADMN CC[C@H](C)[C@@H](NC(=O)C=C(C)C1CC1)c1nc2ccccc2[nH]1 ZINC000917692453 1052751515 /nfs/dbraw/zinc/75/15/15/1052751515.db2.gz DUJIYKUCFAUBLR-JRSJBJMTSA-N 0 1 311.429 4.123 20 0 DIADMN CCC[C@@H](N[C@H](C)c1ccc(C)s1)c1nnc2ccccn21 ZINC000128969103 1052764278 /nfs/dbraw/zinc/76/42/78/1052764278.db2.gz PKCIHUJJPWYCNO-ZIAGYGMSSA-N 0 1 314.458 4.291 20 0 DIADMN C[C@@H](c1ccccn1)[N@H+]1CCC[C@@H](Oc2ccc3c(c2)CCC3)C1 ZINC001225267961 1052766026 /nfs/dbraw/zinc/76/60/26/1052766026.db2.gz SZLGTTSTWUTDRY-OXJNMPFZSA-N 0 1 322.452 4.175 20 0 DIADMN C[C@@H](c1ccccn1)[N@H+]1CC[C@@H](Oc2ccc3ccccc3c2)C1 ZINC001225268208 1052766287 /nfs/dbraw/zinc/76/62/87/1052766287.db2.gz USBHPPIQPPJHNI-OXJNMPFZSA-N 0 1 318.420 4.449 20 0 DIADMN CCC[C@@H](N[C@H]1CCc2c1cccc2C)c1nnc2ccccn21 ZINC000129023428 1052769310 /nfs/dbraw/zinc/76/93/10/1052769310.db2.gz OUCZWPGOUIGSSF-ZWKOTPCHSA-N 0 1 320.440 4.156 20 0 DIADMN Cc1cc(O[C@@H]2CCC[N@H+]([C@@H](C)c3ccccn3)C2)ccc1F ZINC001225325922 1052773696 /nfs/dbraw/zinc/77/36/96/1052773696.db2.gz UNZFGSJUWPIVRB-DOTOQJQBSA-N 0 1 314.404 4.134 20 0 DIADMN COc1ccc(O[C@@H]2CC[N@@H+](Cc3ccccc3)C2)c(Cl)c1 ZINC001225344606 1052777447 /nfs/dbraw/zinc/77/74/47/1052777447.db2.gz JWXBBYWLIQGJCX-MRXNPFEDSA-N 0 1 317.816 4.002 20 0 DIADMN COc1ccc(O[C@@H]2CCN(Cc3ccccc3)C2)c(Cl)c1 ZINC001225344606 1052777451 /nfs/dbraw/zinc/77/74/51/1052777451.db2.gz JWXBBYWLIQGJCX-MRXNPFEDSA-N 0 1 317.816 4.002 20 0 DIADMN Cc1ccc(F)c(O[C@H]2CCCN([C@@H](C)c3ccccn3)C2)c1 ZINC001225353576 1052778974 /nfs/dbraw/zinc/77/89/74/1052778974.db2.gz QBYWMAUQTFAYJY-HOTGVXAUSA-N 0 1 314.404 4.134 20 0 DIADMN Cn1ccnc1[C@H]1CCC[N@@H+](Cc2ccc(Cl)cc2Cl)C1 ZINC000444790753 1052793131 /nfs/dbraw/zinc/79/31/31/1052793131.db2.gz KIZMKCMGARYNAP-ZDUSSCGKSA-N 0 1 324.255 4.107 20 0 DIADMN Cn1ccnc1[C@H]1CCCN(Cc2ccc(Cl)cc2Cl)C1 ZINC000444790753 1052793136 /nfs/dbraw/zinc/79/31/36/1052793136.db2.gz KIZMKCMGARYNAP-ZDUSSCGKSA-N 0 1 324.255 4.107 20 0 DIADMN C[C@@H](c1ccc(F)c(Cl)c1)[N@H+]1CCC[C@@H](c2nccn2C)C1 ZINC000444796332 1052793495 /nfs/dbraw/zinc/79/34/95/1052793495.db2.gz BGHPMFUOZGWIEU-GXTWGEPZSA-N 0 1 321.827 4.153 20 0 DIADMN C[C@@H](N[C@H]1COc2ccccc2C1)c1nc(C(C)(C)C)cs1 ZINC000556075655 1052796520 /nfs/dbraw/zinc/79/65/20/1052796520.db2.gz DITZVGRRYZKGDF-TZMCWYRMSA-N 0 1 316.470 4.095 20 0 DIADMN Cn1ccnc1[C@H]1CCCN(Cc2ccc(Cl)c(Cl)c2)C1 ZINC000444806144 1052799824 /nfs/dbraw/zinc/79/98/24/1052799824.db2.gz SXNVNTROPWYEKH-ZDUSSCGKSA-N 0 1 324.255 4.107 20 0 DIADMN C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1Oc1ccc([S-])cc1 ZINC001225555371 1052802680 /nfs/dbraw/zinc/80/26/80/1052802680.db2.gz MGBPOJGEUFXYHT-KXBFYZLASA-N 0 1 313.466 4.265 20 0 DIADMN Cc1ccsc1CNCc1nc(-c2ccccc2)cs1 ZINC000069785173 1052804730 /nfs/dbraw/zinc/80/47/30/1052804730.db2.gz ONNQIIHILBUPHC-UHFFFAOYSA-N 0 1 300.452 4.470 20 0 DIADMN COc1ccc([C@H](C)N[C@H]2CSc3ccccc32)cc1F ZINC000129802133 1052812194 /nfs/dbraw/zinc/81/21/94/1052812194.db2.gz RAUMBLCJBCXPIU-NHYWBVRUSA-N 0 1 303.402 4.332 20 0 DIADMN Fc1ccccc1CN1CCC[C@H](Oc2ccc3cc[nH]c3c2)C1 ZINC001225654274 1052813550 /nfs/dbraw/zinc/81/35/50/1052813550.db2.gz USTKJIIKIKPVSH-SFHVURJKSA-N 0 1 324.399 4.350 20 0 DIADMN CC[C@@H](NCc1csc(-c2ccc(Cl)cc2)n1)[C@@H](O)CC ZINC000556173608 1052816150 /nfs/dbraw/zinc/81/61/50/1052816150.db2.gz HMHJWECVNGVZAU-CABCVRRESA-N 0 1 324.877 4.103 20 0 DIADMN Cc1cc([C@@H](C)N[C@@H](C)c2ccc(F)c3ccccc32)nn1C ZINC000556194829 1052818690 /nfs/dbraw/zinc/81/86/90/1052818690.db2.gz ZNFUUPGIKPBAOH-UONOGXRCSA-N 0 1 311.404 4.433 20 0 DIADMN CC(C)=CC(=O)Nc1ccccc1-c1nc(-c2ccccc2)n[nH]1 ZINC000918650708 1052819622 /nfs/dbraw/zinc/81/96/22/1052819622.db2.gz PXSOVJYZTDXBMP-UHFFFAOYSA-N 0 1 318.380 4.043 20 0 DIADMN CCN(CC(=O)Nc1c(C)cccc1C)C[C@@H](C)c1ccccc1 ZINC000130042183 1052819818 /nfs/dbraw/zinc/81/98/18/1052819818.db2.gz ATCHHGYCQUBTBI-GOSISDBHSA-N 0 1 324.468 4.368 20 0 DIADMN CN(C(=O)c1cc(-c2ccco2)n[nH]1)c1ccc(C(C)(C)C)cc1 ZINC000918685398 1052822302 /nfs/dbraw/zinc/82/23/02/1052822302.db2.gz QPXXVJRUVAUREO-UHFFFAOYSA-N 0 1 323.396 4.244 20 0 DIADMN Clc1ccc(CN2CC[C@H](Oc3ccnc(Cl)c3)C2)cc1 ZINC001225781177 1052830356 /nfs/dbraw/zinc/83/03/56/1052830356.db2.gz KBGSXUVXKOYUJX-HNNXBMFYSA-N 0 1 323.223 4.042 20 0 DIADMN Cc1cccc2nc(CNC(=O)[C@@H](C)CC3CCCCC3)[nH]c21 ZINC000498394939 1052830448 /nfs/dbraw/zinc/83/04/48/1052830448.db2.gz AKTDAFSQMBOFML-AWEZNQCLSA-N 0 1 313.445 4.094 20 0 DIADMN CCC[C@@H](C(=O)NCc1nc2cccc(C)c2[nH]1)c1ccccc1 ZINC000498421122 1052834046 /nfs/dbraw/zinc/83/40/46/1052834046.db2.gz RYPWYAQEVXTYAZ-MRXNPFEDSA-N 0 1 321.424 4.071 20 0 DIADMN COc1ccc2c(c1)C[N@H+](CCSC)[C@H](c1ccccc1)C2 ZINC000556321225 1052836852 /nfs/dbraw/zinc/83/68/52/1052836852.db2.gz GXGGJMDDJDSWNG-IBGZPJMESA-N 0 1 313.466 4.158 20 0 DIADMN Cc1cc(NC(=O)c2cn[nH]c2C(C)(C)C)ccc1OC(C)C ZINC000556327639 1052838140 /nfs/dbraw/zinc/83/81/40/1052838140.db2.gz YLQINTVHQLJSJU-UHFFFAOYSA-N 0 1 315.417 4.055 20 0 DIADMN C[C@H]1CN(Cc2ccccc2)C[C@@H]1Oc1c(F)ccc(F)c1F ZINC001225871708 1052840406 /nfs/dbraw/zinc/84/04/06/1052840406.db2.gz VJXMDTRCEBYSQT-LRDDRELGSA-N 0 1 321.342 4.003 20 0 DIADMN O=C(Cc1cc(Cl)ccc1Cl)Nc1ccc2nc[nH]c2c1 ZINC000498502674 1052842426 /nfs/dbraw/zinc/84/24/26/1052842426.db2.gz IYDLITZADGAZME-UHFFFAOYSA-N 0 1 320.179 4.051 20 0 DIADMN Fc1ccc(O[C@@H]2CCN(Cc3ccccc3)C2)c(Cl)c1 ZINC001225888205 1052842920 /nfs/dbraw/zinc/84/29/20/1052842920.db2.gz JVQHDBIGUFOKHZ-OAHLLOKOSA-N 0 1 305.780 4.132 20 0 DIADMN CCC(CC)N(C(=O)c1ccc2cncn2c1)c1cccc(C)c1 ZINC000556438780 1052851329 /nfs/dbraw/zinc/85/13/29/1052851329.db2.gz RIIVEAGARCEJCS-UHFFFAOYSA-N 0 1 321.424 4.478 20 0 DIADMN Cc1cccc(NC(=O)CNC(C)(C)c2ccc(Cl)cc2)c1 ZINC000556517941 1052860237 /nfs/dbraw/zinc/86/02/37/1052860237.db2.gz WSIKCEAJWMVJMF-UHFFFAOYSA-N 0 1 316.832 4.112 20 0 DIADMN Cc1ccc(-c2cc(C(=O)O[C@H](C)c3cccc(F)c3)[nH]n2)o1 ZINC000919328610 1052863593 /nfs/dbraw/zinc/86/35/93/1052863593.db2.gz QKOFLSFTDBVBIZ-LLVKDONJSA-N 0 1 314.316 4.035 20 0 DIADMN COc1ncc([C@H](C)N[C@H]2CCc3ccc(F)cc32)cc1Cl ZINC000556586647 1052868831 /nfs/dbraw/zinc/86/88/31/1052868831.db2.gz PSBRCYVJTHCXGG-QFYYESIMSA-N 0 1 320.795 4.221 20 0 DIADMN CC(C)(C)c1ncc(CN2CCC[C@@H]2/C=C/c2ccccc2)cn1 ZINC000556603308 1052870885 /nfs/dbraw/zinc/87/08/85/1052870885.db2.gz GWLFQICOPNGUHL-TZZQJPOUSA-N 0 1 321.468 4.452 20 0 DIADMN O=C(Nc1ccc(F)cc1)c1cn[nH]c1-c1ccc(Cl)cc1 ZINC000010192005 1052872659 /nfs/dbraw/zinc/87/26/59/1052872659.db2.gz KSDJTTWUOTWKGI-UHFFFAOYSA-N 0 1 315.735 4.122 20 0 DIADMN CC(C)[C@@H](C(=O)NOCCC(F)(F)F)c1cccc(Cl)c1 ZINC000154993949 1052873610 /nfs/dbraw/zinc/87/36/10/1052873610.db2.gz RZEYDEWQKMONMC-GFCCVEGCSA-N 0 1 323.742 4.080 20 0 DIADMN FC(F)(F)c1ccc2c(c1)CC[C@@H]2Oc1n[nH]c2ncccc12 ZINC001226305158 1052885408 /nfs/dbraw/zinc/88/54/08/1052885408.db2.gz HVRZXITZBRSQTQ-ZDUSSCGKSA-N 0 1 319.286 4.043 20 0 DIADMN Cc1cc(-c2noc([C@H](C)N[C@@H]3CC=C(C)CC3)n2)ccc1F ZINC000556845952 1052889700 /nfs/dbraw/zinc/88/97/00/1052889700.db2.gz SIZBPGNAAXCJHW-DZGCQCFKSA-N 0 1 315.392 4.334 20 0 DIADMN CC(C)[C@@H]1CC[C@@H]1N[C@@H](CO)c1c(Cl)cccc1Cl ZINC000556887891 1052893063 /nfs/dbraw/zinc/89/30/63/1052893063.db2.gz NRQUPDNZHCBYJL-BPNCWPANSA-N 0 1 302.245 4.051 20 0 DIADMN C[C@H](Oc1cc(N)nc2ccccc21)c1cccc(N(C)C)c1 ZINC001226421365 1052894902 /nfs/dbraw/zinc/89/49/02/1052894902.db2.gz DYRJOWPYKOSPCH-ZDUSSCGKSA-N 0 1 307.397 4.023 20 0 DIADMN CCc1cc(OC)ccc1CN1CC(C)(C)[C@H]1c1ccncc1 ZINC000556892590 1052895657 /nfs/dbraw/zinc/89/56/57/1052895657.db2.gz TZFVFPDFLQRVCN-LJQANCHMSA-N 0 1 310.441 4.236 20 0 DIADMN Cc1nc2ccccn2c1CN1CC2(CCC2)[C@H]1c1ccccc1 ZINC000556910193 1052897421 /nfs/dbraw/zinc/89/74/21/1052897421.db2.gz WURCDGDSGYVTKV-HXUWFJFHSA-N 0 1 317.436 4.370 20 0 DIADMN C[C@@H](N[C@H](c1nccn1C)C1CC1)c1cc2ccccc2s1 ZINC000556914078 1052899385 /nfs/dbraw/zinc/89/93/85/1052899385.db2.gz YHVYNYQNPOMUGU-PXAZEXFGSA-N 0 1 311.454 4.437 20 0 DIADMN CCc1nocc1CN(C)Cc1ccc(OC)c2ccccc12 ZINC000556941606 1052902823 /nfs/dbraw/zinc/90/28/23/1052902823.db2.gz XMGMLYZFEHILHW-UHFFFAOYSA-N 0 1 310.397 4.031 20 0 DIADMN CCc1ncc(CN2CC[C@H](Oc3ccc(Cl)cc3)C2)s1 ZINC000556950857 1052904021 /nfs/dbraw/zinc/90/40/21/1052904021.db2.gz WNZARYTXKZFGMM-AWEZNQCLSA-N 0 1 322.861 4.012 20 0 DIADMN COc1ccc([C@H](C)Oc2nc3ccc(C)cc3[nH]2)cc1OC ZINC001226507678 1052904430 /nfs/dbraw/zinc/90/44/30/1052904430.db2.gz CKNYPUDVPAUVLO-LBPRGKRZSA-N 0 1 312.369 4.029 20 0 DIADMN CC(C)[N@H+](Cc1cccc(F)c1)C[C@@H](O)c1c(F)cccc1F ZINC000920089879 1052918024 /nfs/dbraw/zinc/91/80/24/1052918024.db2.gz XMTDITWRHRGHMH-QGZVFWFLSA-N 0 1 323.358 4.048 20 0 DIADMN Oc1cccc(O[C@@H]2CCCN(Cc3ccccc3)C2)c1Cl ZINC001226708764 1052923890 /nfs/dbraw/zinc/92/38/90/1052923890.db2.gz IZGCIEHQEHIWAI-OAHLLOKOSA-N 0 1 317.816 4.089 20 0 DIADMN Fc1ccc2nc(O[C@@H]3CCc4c3cc(F)cc4F)[nH]c2c1 ZINC001226704205 1052923977 /nfs/dbraw/zinc/92/39/77/1052923977.db2.gz HWSLLANCIWZYMQ-OAHLLOKOSA-N 0 1 304.271 4.047 20 0 DIADMN CCCCC(=O)c1ccc(OC2CCN(C3CC3)CC2)cc1 ZINC001226772490 1052929684 /nfs/dbraw/zinc/92/96/84/1052929684.db2.gz YLXGISCERWXCKD-UHFFFAOYSA-N 0 1 301.430 4.065 20 0 DIADMN CC(C)=CC(=O)Nc1ccc2nc(Cc3ccccc3F)[nH]c2c1 ZINC000920251824 1052930683 /nfs/dbraw/zinc/93/06/83/1052930683.db2.gz SDISYEJPPGMMFM-UHFFFAOYSA-N 0 1 323.371 4.198 20 0 DIADMN Cc1nn(-c2ccccc2C)c(C)c1CNCc1ccc(F)cc1 ZINC000920413415 1052938820 /nfs/dbraw/zinc/93/88/20/1052938820.db2.gz YIDJHNHWJXIIBY-UHFFFAOYSA-N 0 1 323.415 4.226 20 0 DIADMN c1nc2ccc(O[C@@H](c3ccccc3)c3ccccn3)cc2[nH]1 ZINC001226928292 1052945512 /nfs/dbraw/zinc/94/55/12/1052945512.db2.gz JQJFWVBVRMPIKM-IBGZPJMESA-N 0 1 301.349 4.126 20 0 DIADMN O=C(OCc1csc2ccccc12)c1cc(-c2ccco2)n[nH]1 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C[C@@H]1CN(C)[C@@H](C)CN1Cc1sc(Cl)c2ccccc21 ZINC001249051850 1060131370 /nfs/dbraw/zinc/13/13/70/1060131370.db2.gz TUVNJDGKXTVKSA-NWDGAFQWSA-N 0 1 308.878 4.079 20 0 DIADMN COc1ccc2c(c1)OCC[C@H]2NCc1cccc(Cl)c1C ZINC001560354009 1060140493 /nfs/dbraw/zinc/14/04/93/1060140493.db2.gz CBKCVQPNOLRMLH-QGZVFWFLSA-N 0 1 317.816 4.270 20 0 DIADMN COc1ccsc1CN[C@@H](c1ccc(F)cc1F)C1CC1 ZINC001560359562 1060145603 /nfs/dbraw/zinc/14/56/03/1060145603.db2.gz NOQUHQHZOZHJNB-MRXNPFEDSA-N 0 1 309.381 4.276 20 0 DIADMN Cc1nc(F)ccc1CN[C@H](c1ccc(F)cc1F)C1CC1 ZINC001560359432 1060145693 /nfs/dbraw/zinc/14/56/93/1060145693.db2.gz LJGOMGULHLYBFT-KRWDZBQOSA-N 0 1 306.331 4.048 20 0 DIADMN CC[C@@H](C[NH2+]Cc1cccc([O-])c1Cl)Oc1cccc(F)c1 ZINC001560365652 1060150278 /nfs/dbraw/zinc/15/02/78/1060150278.db2.gz DSDKHDQQJAKEQM-AWEZNQCLSA-N 0 1 323.795 4.132 20 0 DIADMN CCCCO[C@H]1C[C@@H](NCc2c(F)cccc2OCC)C1(C)C ZINC001560368797 1060155108 /nfs/dbraw/zinc/15/51/08/1060155108.db2.gz DQQOGDDSICTQFK-MSOLQXFVSA-N 0 1 323.452 4.298 20 0 DIADMN COc1ccc(-c2csc(CNCc3cc(C)no3)c2)cc1 ZINC001560369081 1060155619 /nfs/dbraw/zinc/15/56/19/1060155619.db2.gz MVEPAGBCRKRRJB-UHFFFAOYSA-N 0 1 314.410 4.010 20 0 DIADMN CSCc1cc(F)ccc1CNCc1cccc(C)c1F ZINC001560372811 1060157668 /nfs/dbraw/zinc/15/76/68/1060157668.db2.gz ZPSCMDJNNWUROR-UHFFFAOYSA-N 0 1 307.409 4.426 20 0 DIADMN CC(C)OC1(CNCc2nc3ccccc3o2)CCCCC1 ZINC001560373343 1060161036 /nfs/dbraw/zinc/16/10/36/1060161036.db2.gz BJXTZALMZNKKES-UHFFFAOYSA-N 0 1 302.418 4.045 20 0 DIADMN Cc1cc(Cl)ccc1-c1noc(Cc2ccc3nc[nH]c3c2)n1 ZINC001249108978 1060161320 /nfs/dbraw/zinc/16/13/20/1060161320.db2.gz KPXWWDAKZROJJF-UHFFFAOYSA-N 0 1 324.771 4.166 20 0 DIADMN Cc1cc(-c2noc(Cc3ccc4nc[nH]c4c3)n2)ccc1Cl ZINC001249109482 1060161430 /nfs/dbraw/zinc/16/14/30/1060161430.db2.gz VITFZPLPVFHVHL-UHFFFAOYSA-N 0 1 324.771 4.166 20 0 DIADMN Cc1cccc(-c2noc(Cc3ccc4nc[nH]c4c3)n2)c1Cl ZINC001249108599 1060161693 /nfs/dbraw/zinc/16/16/93/1060161693.db2.gz AOCSBISEXDKHLU-UHFFFAOYSA-N 0 1 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ZINC001249382952 1060230906 /nfs/dbraw/zinc/23/09/06/1060230906.db2.gz IZYBDCOWUWMXMV-GFCCVEGCSA-N 0 1 308.397 4.015 20 0 DIADMN CCCCN(C)Cc1c(F)cccc1NC(=O)OC(C)(C)C ZINC001249382263 1060231532 /nfs/dbraw/zinc/23/15/32/1060231532.db2.gz ISEXOKVDZDTJJA-UHFFFAOYSA-N 0 1 310.413 4.405 20 0 DIADMN F[C@@H]1CCCN(Cc2coc(-c3ccc(Cl)cc3)n2)CC1 ZINC001249372455 1060231582 /nfs/dbraw/zinc/23/15/82/1060231582.db2.gz PALWGEFCDJZLGK-CQSZACIVSA-N 0 1 308.784 4.319 20 0 DIADMN CC(C)(C)OC(=O)Nc1cccc(F)c1CN1CCCCC1 ZINC001249382531 1060232633 /nfs/dbraw/zinc/23/26/33/1060232633.db2.gz SPUMCURNWFABDX-UHFFFAOYSA-N 0 1 308.397 4.159 20 0 DIADMN CC[C@H](C)c1nn(C)cc1CN1CCC[C@@H]1c1ccccc1F ZINC001249407370 1060236067 /nfs/dbraw/zinc/23/60/67/1060236067.db2.gz GSYXOEBOFWOUCN-KBXCAEBGSA-N 0 1 315.436 4.410 20 0 DIADMN C[C@H](NCc1cc2cccnc2o1)c1ccc2ncsc2c1 ZINC001560445603 1060236484 /nfs/dbraw/zinc/23/64/84/1060236484.db2.gz BTUGEQXMLPNHKZ-NSHDSACASA-N 0 1 309.394 4.288 20 0 DIADMN CC[C@@H](C)c1nn(C)cc1CN1CCC[C@@H]1c1ccc(F)cc1 ZINC001249403027 1060237052 /nfs/dbraw/zinc/23/70/52/1060237052.db2.gz YAPXRTCFVLAOLF-RDTXWAMCSA-N 0 1 315.436 4.410 20 0 DIADMN CC(C)c1ccc2c(c1)[C@@H](NCc1ccc3c(n1)CCC3)CC2 ZINC001560448088 1060238759 /nfs/dbraw/zinc/23/87/59/1060238759.db2.gz RHVJWUGXOREKCF-NRFANRHFSA-N 0 1 306.453 4.471 20 0 DIADMN CCCN(Cc1ccccc1)Cc1cnc(C)nc1C(F)(F)F ZINC001249398861 1060238917 /nfs/dbraw/zinc/23/89/17/1060238917.db2.gz KIKMXFROISQJDC-UHFFFAOYSA-N 0 1 323.362 4.216 20 0 DIADMN COc1ccc2[nH]c(CN3CCC4(CCCCC4)CC3)nc2c1 ZINC001249411657 1060240522 /nfs/dbraw/zinc/24/05/22/1060240522.db2.gz FHFNOTSRGLIRJI-UHFFFAOYSA-N 0 1 313.445 4.118 20 0 DIADMN CC[C@H](C)c1nn(C)cc1CN1Cc2ccccc2C(C)(C)C1 ZINC001249409460 1060241926 /nfs/dbraw/zinc/24/19/26/1060241926.db2.gz ZYWMLVKBXRQHLS-HNNXBMFYSA-N 0 1 311.473 4.227 20 0 DIADMN CC[C@@H](C)c1nn(C)cc1CN1CC=C(c2ccccc2)CC1 ZINC001249408587 1060244393 /nfs/dbraw/zinc/24/43/93/1060244393.db2.gz HKVXFEKPRSKKRO-MRXNPFEDSA-N 0 1 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1 305.462 4.480 20 0 DIADMN CC(C)=CCC[C@H](C)N1CCN(c2ccc(C(C)=O)cc2)CC1 ZINC001258099080 1063521400 /nfs/dbraw/zinc/52/14/00/1063521400.db2.gz IGUPLHGWCSJVGB-KRWDZBQOSA-N 0 1 314.473 4.146 20 0 DIADMN C[C@H](NCc1cnsc1)c1ccc(Oc2cccnc2)cc1 ZINC001461485038 1063531343 /nfs/dbraw/zinc/53/13/43/1063531343.db2.gz AQFIJRKFUHEHTN-ZDUSSCGKSA-N 0 1 311.410 4.181 20 0 DIADMN C[C@H]1C[C@H](N2CCO[C@H](c3ccc(F)c(F)c3)C2)C[C@@H](C)C1 ZINC001258172209 1063544628 /nfs/dbraw/zinc/54/46/28/1063544628.db2.gz VUBMVILUNPEBLW-OJIVJNGMSA-N 0 1 309.400 4.163 20 0 DIADMN Cc1ccc2nc(-c3nnc(-c4ccc5c(c4)CCC5)o3)[nH]c2c1 ZINC001258175376 1063547595 /nfs/dbraw/zinc/54/75/95/1063547595.db2.gz SQGHFJRCMKMUOK-UHFFFAOYSA-N 0 1 316.364 4.077 20 0 DIADMN C[C@H](Cc1ccco1)N1CCc2c(cccc2C(F)(F)F)C1 ZINC001258194687 1063554284 /nfs/dbraw/zinc/55/42/84/1063554284.db2.gz JTIUCEIYZNKMSN-GFCCVEGCSA-N 0 1 309.331 4.288 20 0 DIADMN C[C@@H](Cc1ccco1)N1CCc2c(Br)cccc2C1 ZINC001258195483 1063558722 /nfs/dbraw/zinc/55/87/22/1063558722.db2.gz RCPYNXNBONAKRL-LBPRGKRZSA-N 0 1 320.230 4.031 20 0 DIADMN Cc1cc(CCNCc2nc(C(C)(C)C)co2)ccc1Cl ZINC001461526769 1063559140 /nfs/dbraw/zinc/55/91/40/1063559140.db2.gz ATTQUOURYSESBW-UHFFFAOYSA-N 0 1 306.837 4.266 20 0 DIADMN CSCC[C@@H](C)[N@@H+](Cc1ccccc1)Cc1ccccn1 ZINC001258215259 1063562408 /nfs/dbraw/zinc/56/24/08/1063562408.db2.gz NVROLJMIYTUDGB-MRXNPFEDSA-N 0 1 300.471 4.225 20 0 DIADMN CSCC[C@@H](C)[N@H+]1CCn2cccc2[C@@H]1c1ccccc1 ZINC001258213427 1063562961 /nfs/dbraw/zinc/56/29/61/1063562961.db2.gz PGPJDSQZDVWQMO-QAPCUYQASA-N 0 1 300.471 4.035 20 0 DIADMN CSCC[C@H](C)[N@@H+](Cc1ccccc1)Cc1ccccn1 ZINC001258215258 1063563810 /nfs/dbraw/zinc/56/38/10/1063563810.db2.gz NVROLJMIYTUDGB-INIZCTEOSA-N 0 1 300.471 4.225 20 0 DIADMN Oc1cc(-c2nnc(-c3ccc4c(c3)CCC4)o2)ccc1Cl ZINC001258242429 1063578667 /nfs/dbraw/zinc/57/86/67/1063578667.db2.gz LHSKTDMUYXESFM-UHFFFAOYSA-N 0 1 312.756 4.251 20 0 DIADMN CCCN(CCC)c1ccc(NCc2snnc2C)cc1 ZINC001461615769 1063614879 /nfs/dbraw/zinc/61/48/79/1063614879.db2.gz JFSVGQVVYXJGFH-UHFFFAOYSA-N 0 1 304.463 4.085 20 0 DIADMN CC(C)CCc1nnc(-c2cc(-c3cccc(Cl)c3)n[nH]2)o1 ZINC001258332291 1063615637 /nfs/dbraw/zinc/61/56/37/1063615637.db2.gz MCHARDCBNVSBJJ-UHFFFAOYSA-N 0 1 316.792 4.369 20 0 DIADMN COc1ccc(-c2cc(CNCc3ccc(C)s3)on2)cc1 ZINC001461620719 1063619116 /nfs/dbraw/zinc/61/91/16/1063619116.db2.gz WZKXMXSJTBNACF-UHFFFAOYSA-N 0 1 314.410 4.010 20 0 DIADMN Fc1cccc(/C=C\CNCc2cccc(OC3CC3)c2F)c1 ZINC001461623253 1063621008 /nfs/dbraw/zinc/62/10/08/1063621008.db2.gz ZWZGXGVOCMKNIJ-HYXAFXHYSA-N 0 1 315.363 4.309 20 0 DIADMN COc1cccc(OC)c1CNCc1ccc(C(C)(C)C)cc1 ZINC001461623196 1063621149 /nfs/dbraw/zinc/62/11/49/1063621149.db2.gz XMXNLDQDXQILKJ-UHFFFAOYSA-N 0 1 313.441 4.291 20 0 DIADMN Fc1cc(OC(F)F)ccc1CNCc1ccc2occc2c1 ZINC001461623099 1063621385 /nfs/dbraw/zinc/62/13/85/1063621385.db2.gz VQCQJKBDVUYIKQ-UHFFFAOYSA-N 0 1 321.298 4.463 20 0 DIADMN CCCCC(CCCC)N1Cc2cn(C)nc2[C@@H](COCC)C1 ZINC001258386381 1063629082 /nfs/dbraw/zinc/62/90/82/1063629082.db2.gz ZETOKUHIICVEAQ-QGZVFWFLSA-N 0 1 321.509 4.105 20 0 DIADMN CCCCC(CCCC)N1Cc2c(cnn2C)[C@@H](COCC)C1 ZINC001258385052 1063629286 /nfs/dbraw/zinc/62/92/86/1063629286.db2.gz PEIKCPVKALKTDI-MRXNPFEDSA-N 0 1 321.509 4.105 20 0 DIADMN CCCCC(CCCC)N1Cc2ccnn2C[C@@H](COCC)C1 ZINC001258386180 1063629391 /nfs/dbraw/zinc/62/93/91/1063629391.db2.gz SMFDSUWMPAANSY-KRWDZBQOSA-N 0 1 321.509 4.100 20 0 DIADMN CCCCCCOc1ccc(CNCc2ccnc(F)c2)cc1 ZINC001461672322 1063649479 /nfs/dbraw/zinc/64/94/79/1063649479.db2.gz ONFMXAWPMRWWQH-UHFFFAOYSA-N 0 1 316.420 4.470 20 0 DIADMN CCCCC[C@@H](CC)N1Cc2cnn(CC)c2[C@@H](COCC)C1 ZINC001258438431 1063654076 /nfs/dbraw/zinc/65/40/76/1063654076.db2.gz CSWFJMNTTBFZJR-QZTJIDSGSA-N 0 1 321.509 4.198 20 0 DIADMN CCCCC[C@H](CC)N1Cc2cnn(CC)c2[C@@H](COCC)C1 ZINC001258438430 1063654630 /nfs/dbraw/zinc/65/46/30/1063654630.db2.gz CSWFJMNTTBFZJR-MSOLQXFVSA-N 0 1 321.509 4.198 20 0 DIADMN CC(C)(F)CNCc1cc2cc(Br)ccc2o1 ZINC001461687597 1063658459 /nfs/dbraw/zinc/65/84/59/1063658459.db2.gz ZAMAIVXKXKGZEE-UHFFFAOYSA-N 0 1 300.171 4.033 20 0 DIADMN C[C@@H](CC1CC1)N[C@]1(c2ccccc2Cl)CCCCC1=O ZINC001258454256 1063660742 /nfs/dbraw/zinc/66/07/42/1063660742.db2.gz GRLBXJLFIPMVCB-UGSOOPFHSA-N 0 1 305.849 4.457 20 0 DIADMN CCOC(=O)CC[C@@H](C)N[C@H](C)c1c(Cl)cccc1Cl ZINC001258478722 1063671854 /nfs/dbraw/zinc/67/18/54/1063671854.db2.gz ALEJKZBRKBHAOT-GHMZBOCLSA-N 0 1 318.244 4.376 20 0 DIADMN CCCn1cc(CNCc2cccc(OC(C)(C)C)c2)c(C)n1 ZINC001461728836 1063681518 /nfs/dbraw/zinc/68/15/18/1063681518.db2.gz IFDNFKOLJRFQCX-UHFFFAOYSA-N 0 1 315.461 4.069 20 0 DIADMN CSc1ccc(CNCc2cccc(OC(C)(C)C)c2)o1 ZINC001461732777 1063685704 /nfs/dbraw/zinc/68/57/04/1063685704.db2.gz XNTOZUPSLKOIGQ-UHFFFAOYSA-N 0 1 305.443 4.469 20 0 DIADMN COc1ccc(Cl)cc1CNc1ccc2c(n1)CCCC2 ZINC001461733332 1063686026 /nfs/dbraw/zinc/68/60/26/1063686026.db2.gz JELYVOQRNDGFFL-UHFFFAOYSA-N 0 1 302.805 4.235 20 0 DIADMN Cc1ccc(CNCc2ccc3c(c2)C[C@@H](C)O3)c(Cl)c1 ZINC001461735807 1063688002 /nfs/dbraw/zinc/68/80/02/1063688002.db2.gz JHOJHSAMNSALPG-CYBMUJFWSA-N 0 1 301.817 4.262 20 0 DIADMN CC=C(C)C(=O)Nc1ccc2nc(-c3ccc(F)cc3)[nH]c2c1 ZINC001515570202 1063689379 /nfs/dbraw/zinc/68/93/79/1063689379.db2.gz MTOIQGJRUKXWRY-JYOAFUTRSA-N 0 1 309.344 4.274 20 0 DIADMN FC1(F)CCC[C@H]1NC1CCN(c2ccccc2Cl)CC1 ZINC001258537996 1063689771 /nfs/dbraw/zinc/68/97/71/1063689771.db2.gz HSMPVACEQPKINP-OAHLLOKOSA-N 0 1 314.807 4.086 20 0 DIADMN O=C(Nc1nc2c(cccc2Cl)s1)c1cccc(F)c1O ZINC001515595369 1063691593 /nfs/dbraw/zinc/69/15/93/1063691593.db2.gz KRXZXEJIWIOYFO-UHFFFAOYSA-N 0 1 322.748 4.047 20 0 DIADMN CC1(C)CC[C@H](NC2(c3ccc(C(F)(F)F)cc3)COC2)C1 ZINC001258595069 1063698479 /nfs/dbraw/zinc/69/84/79/1063698479.db2.gz QMUFFWGHZGWOJJ-AWEZNQCLSA-N 0 1 313.363 4.099 20 0 DIADMN Cc1nn(-c2ccc(Cl)cc2)cc1CNC(C)(C)/C=C\Cl ZINC001461764404 1063703339 /nfs/dbraw/zinc/70/33/39/1063703339.db2.gz HDLXBAYYJQBYBR-HJWRWDBZSA-N 0 1 324.255 4.455 20 0 DIADMN CC1(C)CCc2cccc(NCc3[nH]nc4ccccc43)c2O1 ZINC001461765945 1063704473 /nfs/dbraw/zinc/70/44/73/1063704473.db2.gz GVSDEVHNRINTMY-UHFFFAOYSA-N 0 1 307.397 4.279 20 0 DIADMN CC(C)Cc1ccc(C[NH2+]CCc2c(F)cc([O-])cc2F)cc1 ZINC001461788895 1063717438 /nfs/dbraw/zinc/71/74/38/1063717438.db2.gz YAKPBOLIOILQIL-UHFFFAOYSA-N 0 1 319.395 4.201 20 0 DIADMN Cc1ccccc1CN[C@@H](C)c1cc(Cl)cc2c1OCC2 ZINC001461789428 1063718419 /nfs/dbraw/zinc/71/84/19/1063718419.db2.gz ZSENTWCIMZVELS-ZDUSSCGKSA-N 0 1 301.817 4.434 20 0 DIADMN CCN(Cc1c(F)cccc1Cl)[C@H](C)Cc1cccnc1 ZINC001258633006 1063718743 /nfs/dbraw/zinc/71/87/43/1063718743.db2.gz FDPLLTGQYNCRMN-CYBMUJFWSA-N 0 1 306.812 4.327 20 0 DIADMN CCC[C@H](Cc1ccccc1)N1Cc2cccc(C(=O)OC)c2C1 ZINC001258662165 1063730283 /nfs/dbraw/zinc/73/02/83/1063730283.db2.gz GQBBWBGIHVMKAY-GOSISDBHSA-N 0 1 323.436 4.200 20 0 DIADMN CCCCC[C@@H](CCC)N1Cc2c(cnn2C)[C@H](COCC)C1 ZINC001258670280 1063736980 /nfs/dbraw/zinc/73/69/80/1063736980.db2.gz ZNJZWONVBMXAIJ-DLBZAZTESA-N 0 1 321.509 4.105 20 0 DIADMN CCc1coc(CN[C@@H](C)Cc2ccc(Cl)cc2Cl)n1 ZINC001258672909 1063740651 /nfs/dbraw/zinc/74/06/51/1063740651.db2.gz LCUCJSDBADWRSD-JTQLQIEISA-N 0 1 313.228 4.265 20 0 DIADMN Cc1nc(CN[C@H](C)Cc2ccc(Cl)cc2Cl)c(C)o1 ZINC001258672973 1063740976 /nfs/dbraw/zinc/74/09/76/1063740976.db2.gz MJZMBIVPNCPBHK-SECBINFHSA-N 0 1 313.228 4.319 20 0 DIADMN C[C@@H](Cc1ccc(Cl)cc1Cl)N1CCc2cnccc2C1 ZINC001258677922 1063743704 /nfs/dbraw/zinc/74/37/04/1063743704.db2.gz JTLPKSGLLWSXQV-LBPRGKRZSA-N 0 1 321.251 4.378 20 0 DIADMN Cc1ccc(C[C@H]2CCCN(Cc3cc(F)ncc3F)C2)cc1 ZINC001461848584 1063749096 /nfs/dbraw/zinc/74/90/96/1063749096.db2.gz WYMYUBAFSGTTQB-MRXNPFEDSA-N 0 1 316.395 4.123 20 0 DIADMN C[C@H]1[C@@H](Cc2ccccc2)CCN1Cc1c(F)ccc(O)c1F ZINC001461848692 1063749504 /nfs/dbraw/zinc/74/95/04/1063749504.db2.gz GEMIHYDACHTVAY-DZGCQCFKSA-N 0 1 317.379 4.124 20 0 DIADMN CCOc1cc(F)cc(CN2CCCc3sccc3C2)c1 ZINC001461848786 1063749717 /nfs/dbraw/zinc/74/97/17/1063749717.db2.gz IYXJNKWMYZLYPX-UHFFFAOYSA-N 0 1 305.418 4.234 20 0 DIADMN CO[C@H](CC(C)C)CN(C)Cc1ccc(Cl)cc1Cl ZINC001461867677 1063759994 /nfs/dbraw/zinc/75/99/94/1063759994.db2.gz JUUGXQKVJAHAOM-CQSZACIVSA-N 0 1 304.261 4.486 20 0 DIADMN CCCC[C@H](Cc1ccccc1)N[C@H](C)c1ncc(F)cn1 ZINC001258707413 1063764596 /nfs/dbraw/zinc/76/45/96/1063764596.db2.gz HNOPYBJGEREBSK-RHSMWYFYSA-N 0 1 301.409 4.068 20 0 DIADMN CCCC[C@@H](Cc1ccccc1)NCc1nccc(Cl)n1 ZINC001258708032 1063766730 /nfs/dbraw/zinc/76/67/30/1063766730.db2.gz QSVRYBFTTGJRJE-HNNXBMFYSA-N 0 1 303.837 4.021 20 0 DIADMN CC[C@@]1(C)CCCN(Cc2nnn(-c3ccccc3)c2C2CC2)C1 ZINC001461878422 1063770705 /nfs/dbraw/zinc/77/07/05/1063770705.db2.gz SDUQSZYNWOMBDW-FQEVSTJZSA-N 0 1 324.472 4.157 20 0 DIADMN Fc1ccc(C[C@@H]2CCCN2Cc2ccc(F)c(F)c2F)cc1 ZINC001461881571 1063771710 /nfs/dbraw/zinc/77/17/10/1063771710.db2.gz ATCQONYSGUMFOS-HNNXBMFYSA-N 0 1 323.333 4.450 20 0 DIADMN CCOc1ccc2c(c1)CN(C/C=C\c1cccc(F)c1)CC2 ZINC001461888823 1063778198 /nfs/dbraw/zinc/77/81/98/1063778198.db2.gz QMOOGMCXWFCLCR-XQRVVYSFSA-N 0 1 311.400 4.296 20 0 DIADMN CCCCN(Cc1ccccc1F)Cc1cccc(F)c1N ZINC001461913635 1063794008 /nfs/dbraw/zinc/79/40/08/1063794008.db2.gz WSHZJNFGCORZNL-UHFFFAOYSA-N 0 1 304.384 4.349 20 0 DIADMN C[C@@H]1C[C@@H]1[C@H]1C[C@H]1C(=O)Nc1nc2cc(Cl)cc(Cl)c2[nH]1 ZINC001461917698 1063800808 /nfs/dbraw/zinc/80/08/08/1063800808.db2.gz MOGJDXLYTIIHHA-XCWAXFADSA-N 0 1 324.211 4.100 20 0 DIADMN CCO[C@H]1C[C@@H](N(C)Cc2cncn2C(C)C)C12CCCCC2 ZINC001461918863 1063801643 /nfs/dbraw/zinc/80/16/43/1063801643.db2.gz CZQUEURQMXDHAF-MSOLQXFVSA-N 0 1 319.493 4.024 20 0 DIADMN Cc1cccc(N2CCN(C/C=C/c3cccc(F)c3)CC2)c1C ZINC001461931220 1063816639 /nfs/dbraw/zinc/81/66/39/1063816639.db2.gz FJOWDQRLGWQCMK-VMPITWQZSA-N 0 1 324.443 4.278 20 0 DIADMN CC(C)[C@@H]1CN(Cc2cc3c(ccnc3Cl)o2)CCS1 ZINC001461935274 1063819867 /nfs/dbraw/zinc/81/98/67/1063819867.db2.gz HPBDONLGGRYJEO-AWEZNQCLSA-N 0 1 310.850 4.055 20 0 DIADMN CCOC[C@@H]1CN([C@@H](CC)C[C@H](C)CC)Cc2cnn(CC)c21 ZINC001258792376 1063827949 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20 0 DIADMN FC(F)c1ccc(CNCc2cnc([C@@H]3CCCO3)s2)cc1 ZINC000274064274 130203180 /nfs/dbraw/zinc/20/31/80/130203180.db2.gz ATRIKBHGHOJFSZ-AWEZNQCLSA-N 0 1 324.396 4.222 20 0 DIADMN Cc1nnc([C@H](C)N[C@@H]2CC=C(c3ccc(F)cc3)CC2)s1 ZINC000274278291 130223744 /nfs/dbraw/zinc/22/37/44/130223744.db2.gz XYLLALGGTNOJJQ-MEDUHNTESA-N 0 1 317.433 4.272 20 0 DIADMN CCC[C@@H](N[C@H]1CCOc2ccc(OC)cc21)c1cccnc1 ZINC000274335427 130227333 /nfs/dbraw/zinc/22/73/33/130227333.db2.gz BSKCMLROFRAPHK-MSOLQXFVSA-N 0 1 312.413 4.045 20 0 DIADMN C[C@H](NCCc1ccccc1F)c1nc(C(F)(F)F)cs1 ZINC000274657360 130252212 /nfs/dbraw/zinc/25/22/12/130252212.db2.gz VWRGBPGVOFANKD-VIFPVBQESA-N 0 1 318.339 4.194 20 0 DIADMN Cc1cccnc1[C@H](N[C@@H](C)c1ccc(Cl)cn1)C(C)C ZINC000274982894 130281464 /nfs/dbraw/zinc/28/14/64/130281464.db2.gz ZMUMYMQHHQLFHS-XJKSGUPXSA-N 0 1 303.837 4.486 20 0 DIADMN COc1ccccc1[C@@H](CC(C)C)NCc1cncc(F)c1 ZINC000275058114 130288328 /nfs/dbraw/zinc/28/83/28/130288328.db2.gz ONSOWIACVHMUKU-QGZVFWFLSA-N 0 1 302.393 4.106 20 0 DIADMN COCC[C@H](NCc1ccc2nc(C)ccc2c1)c1ccc(C)o1 ZINC000275424983 130318274 /nfs/dbraw/zinc/31/82/74/130318274.db2.gz ASMPWIFNBZBRPE-IBGZPJMESA-N 0 1 324.424 4.312 20 0 DIADMN CC(C)C(C)(C)C(=O)Nc1ccc2nc([C@H]3CCCO3)[nH]c2c1 ZINC000275757779 130379486 /nfs/dbraw/zinc/37/94/86/130379486.db2.gz FDZAGLYQCQHIHN-OAHLLOKOSA-N 0 1 315.417 4.035 20 0 DIADMN CCC(CC)(CN[C@H](c1ncc[nH]1)c1ccccc1)SC ZINC000275847239 130397100 /nfs/dbraw/zinc/39/71/00/130397100.db2.gz KGJBMFRGFURNHN-HNNXBMFYSA-N 0 1 303.475 4.011 20 0 DIADMN CCc1ccc([C@H](C)N[C@@H](C)c2n[nH]c([C@@H](C)CC)n2)s1 ZINC000277112142 130582596 /nfs/dbraw/zinc/58/25/96/130582596.db2.gz IDBPACQLPZOWMH-SRVKXCTJSA-N 0 1 306.479 4.354 20 0 DIADMN Cc1coc(C)c1C(=O)Nc1ccccc1-c1nnc(C(C)C)[nH]1 ZINC000284005049 131040063 /nfs/dbraw/zinc/04/00/63/131040063.db2.gz QKWHKZAPWVAYML-UHFFFAOYSA-N 0 1 324.384 4.057 20 0 DIADMN CSc1ccccc1[C@H](C)NCc1cnc(C(C)(C)C)nc1 ZINC000284206109 131059098 /nfs/dbraw/zinc/05/90/98/131059098.db2.gz BYFNCXUHTXOGOZ-ZDUSSCGKSA-N 0 1 315.486 4.347 20 0 DIADMN C[C@H](NCc1cnc(C(C)(C)C)nc1)c1cc2ccccc2o1 ZINC000284248520 131063145 /nfs/dbraw/zinc/06/31/45/131063145.db2.gz FMHJPUCTLFORPI-ZDUSSCGKSA-N 0 1 309.413 4.371 20 0 DIADMN CC(C)(C)c1ncc(CN2CCC[C@H]2c2cccs2)cn1 ZINC000284282683 131066769 /nfs/dbraw/zinc/06/67/69/131066769.db2.gz HRMPYRKCBRNVNY-AWEZNQCLSA-N 0 1 301.459 4.173 20 0 DIADMN CCc1nnc(CN(CC(C)C)[C@@H](C)c2ccccc2C)o1 ZINC000284370281 131074845 /nfs/dbraw/zinc/07/48/45/131074845.db2.gz DXYFCZISAMACKH-HNNXBMFYSA-N 0 1 301.434 4.160 20 0 DIADMN Cc1cc(CN[C@@H](C)c2ccc(OCCC(C)C)cc2)n(C)n1 ZINC000284387286 131076380 /nfs/dbraw/zinc/07/63/80/131076380.db2.gz PBBTXSYNVZYXIX-INIZCTEOSA-N 0 1 315.461 4.004 20 0 DIADMN C[C@@H](NCc1ccnc(OC(F)F)c1)c1cccc(Cl)c1 ZINC000284621752 131097533 /nfs/dbraw/zinc/09/75/33/131097533.db2.gz ZRICCGYPAINFOE-SNVBAGLBSA-N 0 1 312.747 4.187 20 0 DIADMN C[C@H](NCc1ccnc(OC(F)F)c1)c1cccc(Cl)c1 ZINC000284621749 131097793 /nfs/dbraw/zinc/09/77/93/131097793.db2.gz ZRICCGYPAINFOE-JTQLQIEISA-N 0 1 312.747 4.187 20 0 DIADMN COCC[C@H](N[C@@H]1CCCc2ccc(O)cc21)c1ccc(C)o1 ZINC000284963233 131126461 /nfs/dbraw/zinc/12/64/61/131126461.db2.gz FNCOKZOMDQGRCM-MSOLQXFVSA-N 0 1 315.413 4.038 20 0 DIADMN CC[C@H](C)CCC(=O)N1CCC[C@H]1c1nc2ccc(C)cc2[nH]1 ZINC000285035235 131132194 /nfs/dbraw/zinc/13/21/94/131132194.db2.gz BTMYQMUOSKBHOK-GUYCJALGSA-N 0 1 313.445 4.361 20 0 DIADMN C[C@@H](CN(C)Cc1cc(-c2ccccc2)on1)c1nccs1 ZINC000285182310 131145798 /nfs/dbraw/zinc/14/57/98/131145798.db2.gz VPDUHGXOPIHVGE-ZDUSSCGKSA-N 0 1 313.426 4.034 20 0 DIADMN CCCN(Cc1csc(C2CC2)n1)[C@@H]1[C@H]2CCO[C@H]2C1(C)C ZINC000340200163 131147420 /nfs/dbraw/zinc/14/74/20/131147420.db2.gz XCUNPKNTLFFQPP-BZUAXINKSA-N 0 1 320.502 4.046 20 0 DIADMN Cc1nn(C)cc1CNc1ccc(N2CCCCCC2)cc1C ZINC000285362823 131160987 /nfs/dbraw/zinc/16/09/87/131160987.db2.gz BOOBLDHOXFYGJG-UHFFFAOYSA-N 0 1 312.461 4.029 20 0 DIADMN CCCCOc1ccc(CNC(C)(C)c2c(C)noc2C)cc1 ZINC000285367764 131161555 /nfs/dbraw/zinc/16/15/55/131161555.db2.gz BUCLFTLVTPHKTG-UHFFFAOYSA-N 0 1 316.445 4.495 20 0 DIADMN CCOc1ccc([C@H](C)N[C@@H](C)c2ccncc2F)cc1OC ZINC000340205353 131164764 /nfs/dbraw/zinc/16/47/64/131164764.db2.gz PIKQEPZJHBMZPP-STQMWFEESA-N 0 1 318.392 4.040 20 0 DIADMN CC(C)CC[C@@H](NCc1cccnc1-n1cccn1)c1ccoc1 ZINC000285530490 131177895 /nfs/dbraw/zinc/17/78/95/131177895.db2.gz FKRMWQGCKMLVLR-GOSISDBHSA-N 0 1 324.428 4.127 20 0 DIADMN Cc1cc([C@@H](C)NCc2ccoc2)sc1Br ZINC000285547268 131179625 /nfs/dbraw/zinc/17/96/25/131179625.db2.gz UINJQQVGJFXDTI-SECBINFHSA-N 0 1 300.221 4.263 20 0 DIADMN C[C@@H](NC1CC(c2ccc(F)cc2)C1)c1c(F)cncc1F ZINC000285573556 131182678 /nfs/dbraw/zinc/18/26/78/131182678.db2.gz GTTGUORMFFNWCO-PWQPVHBWSA-N 0 1 306.331 4.096 20 0 DIADMN Cc1noc(C)c1C(C)(C)NCc1cccc(OC(C)C)c1 ZINC000285641013 131188661 /nfs/dbraw/zinc/18/86/61/131188661.db2.gz ZHJRFIQODBEEOH-UHFFFAOYSA-N 0 1 302.418 4.104 20 0 DIADMN C[C@@H]1CC[C@H](c2ccccc2)N(Cc2nnc(-c3ccco3)o2)C1 ZINC000285683898 131192774 /nfs/dbraw/zinc/19/27/74/131192774.db2.gz UXJQKNJKBMDXQD-GDBMZVCRSA-N 0 1 323.396 4.303 20 0 DIADMN Cc1ccnc([C@H](C)NCc2ccc(F)cc2C(F)(F)F)c1 ZINC000285694322 131194634 /nfs/dbraw/zinc/19/46/34/131194634.db2.gz OOHRMHLOTBPQDG-NSHDSACASA-N 0 1 312.310 4.399 20 0 DIADMN Cc1ccnc([C@H](C)N[C@H](C)c2cccc(N3CCCC3)c2)c1 ZINC000285922968 131209680 /nfs/dbraw/zinc/20/96/80/131209680.db2.gz DWKVJRJROLRJBG-SJORKVTESA-N 0 1 309.457 4.402 20 0 DIADMN COC(=O)c1csc([C@H](C)N[C@@H]2CCc3c2cccc3F)c1 ZINC000285980813 131213399 /nfs/dbraw/zinc/21/33/99/131213399.db2.gz HOWZUDWZGGNJPO-ZUZCIYMTSA-N 0 1 319.401 4.012 20 0 DIADMN COC(=O)c1csc([C@@H](C)N[C@H]2CCc3c2cccc3F)c1 ZINC000285980807 131213544 /nfs/dbraw/zinc/21/35/44/131213544.db2.gz HOWZUDWZGGNJPO-BMIGLBTASA-N 0 1 319.401 4.012 20 0 DIADMN Cc1cnn(C)c1CNC(c1ccccc1C)c1ccccc1C ZINC000286072089 131218120 /nfs/dbraw/zinc/21/81/20/131218120.db2.gz RYGVYUUPWRJETE-UHFFFAOYSA-N 0 1 319.452 4.225 20 0 DIADMN CCS[C@H]1CCC[C@@H]1NCc1ncc(-c2ccccc2)o1 ZINC000286140854 131222324 /nfs/dbraw/zinc/22/23/24/131222324.db2.gz NCRUJAKMBMQNOP-HOCLYGCPSA-N 0 1 302.443 4.105 20 0 DIADMN CCS[C@@H]1CCC[C@H]1NCc1ncc(-c2ccccc2)o1 ZINC000286140841 131222477 /nfs/dbraw/zinc/22/24/77/131222477.db2.gz NCRUJAKMBMQNOP-GDBMZVCRSA-N 0 1 302.443 4.105 20 0 DIADMN CN(Cc1csc(-c2ccoc2)n1)C1CCC(F)(F)CC1 ZINC000286713368 131246820 /nfs/dbraw/zinc/24/68/20/131246820.db2.gz FULBMVXOHCDMBS-UHFFFAOYSA-N 0 1 312.385 4.413 20 0 DIADMN CC(C)[C@@H](N[C@H](C)c1nncn1C)c1ccc(C(C)(C)C)cc1 ZINC000287013715 131259704 /nfs/dbraw/zinc/25/97/04/131259704.db2.gz RNGIHBWYTUOHRO-RHSMWYFYSA-N 0 1 314.477 4.161 20 0 DIADMN FC(F)c1ccnc(CNC2CCC(c3ccccc3)CC2)n1 ZINC000287085306 131263389 /nfs/dbraw/zinc/26/33/89/131263389.db2.gz PAMANBDMGDIXBS-UHFFFAOYSA-N 0 1 317.383 4.230 20 0 DIADMN COc1cc([C@H](C)N[C@@H](C)c2cc(C)sc2C)c(F)cn1 ZINC000287275576 131273285 /nfs/dbraw/zinc/27/32/85/131273285.db2.gz BEEUBZMDKNNRBB-QWRGUYRKSA-N 0 1 308.422 4.319 20 0 DIADMN C[C@H](NCCn1ccc2cc(Cl)ccc21)c1nccs1 ZINC000287720397 131296929 /nfs/dbraw/zinc/29/69/29/131296929.db2.gz XZSHIYWVIOQNJT-NSHDSACASA-N 0 1 305.834 4.102 20 0 DIADMN C[C@H](c1ccc(Cl)cc1)N1CC[C@@H](OCc2ccncc2)C1 ZINC000287777427 131299799 /nfs/dbraw/zinc/29/97/99/131299799.db2.gz NFKLTIJAICBGNJ-RDTXWAMCSA-N 0 1 316.832 4.087 20 0 DIADMN C[C@@H](c1ccccc1Cl)N1CC[C@H](OCc2ccncc2)C1 ZINC000287812588 131301133 /nfs/dbraw/zinc/30/11/33/131301133.db2.gz PGQJHZMAVDCSOE-HOCLYGCPSA-N 0 1 316.832 4.087 20 0 DIADMN Clc1ccccc1-c1nnc(CN2CCC[C@H](C3CC3)C2)o1 ZINC000288799997 131339457 /nfs/dbraw/zinc/33/94/57/131339457.db2.gz CYKMDNMHKAPGJZ-ZDUSSCGKSA-N 0 1 317.820 4.012 20 0 DIADMN CC[C@H](NCc1cnc([C@@H](C)O)s1)c1cccc(Cl)c1 ZINC000289267065 131370538 /nfs/dbraw/zinc/37/05/38/131370538.db2.gz NCZLQPLUIUHGRC-YGRLFVJLSA-N 0 1 310.850 4.091 20 0 DIADMN CCc1noc(CC)c1CN[C@H]1CCCc2c3ccccc3[nH]c21 ZINC000289345637 131376425 /nfs/dbraw/zinc/37/64/25/131376425.db2.gz XKIZCYGTQIXYAN-SFHVURJKSA-N 0 1 323.440 4.448 20 0 DIADMN C[C@@H](O)c1ncc(CN(Cc2ccc(F)cc2)C(C)(C)C)s1 ZINC000289436985 131386369 /nfs/dbraw/zinc/38/63/69/131386369.db2.gz WEHQKHHFVMVETK-GFCCVEGCSA-N 0 1 322.449 4.136 20 0 DIADMN CSCc1cnc(CNC2CC(c3ccccc3)C2)s1 ZINC000293507642 131742319 /nfs/dbraw/zinc/74/23/19/131742319.db2.gz HURWEXBDKASRMA-UHFFFAOYSA-N 0 1 304.484 4.042 20 0 DIADMN Cc1nocc1CN[C@H](c1cccc(C(F)(F)F)c1)C(C)C ZINC000293576170 131747129 /nfs/dbraw/zinc/74/71/29/131747129.db2.gz NIVXZRHIDJHNED-HNNXBMFYSA-N 0 1 312.335 4.489 20 0 DIADMN C[C@@H](N[C@H]1CCCc2c(F)cc(F)cc21)c1ccc(F)cn1 ZINC000297488485 132018947 /nfs/dbraw/zinc/01/89/47/132018947.db2.gz ZUCOSLDTIKMSLI-QGHHPUGFSA-N 0 1 306.331 4.227 20 0 DIADMN Cc1cc([C@@H](C)NCc2ccc(OCC3CC3)nc2)cs1 ZINC000297551363 132021774 /nfs/dbraw/zinc/02/17/74/132021774.db2.gz FQYFCEYVAWRWSN-CYBMUJFWSA-N 0 1 302.443 4.091 20 0 DIADMN Cc1nc2ccc(NC(=O)c3cccc(-c4ccoc4)c3)cc2[nH]1 ZINC000340573002 132022268 /nfs/dbraw/zinc/02/22/68/132022268.db2.gz PNYCAIIQEYFAFL-UHFFFAOYSA-N 0 1 317.348 4.384 20 0 DIADMN CC(C)(C)c1nnc(CNC2CC(C)(c3ccccc3)C2)s1 ZINC000297568393 132023485 /nfs/dbraw/zinc/02/34/85/132023485.db2.gz HOSSXRYNHQQJDR-UHFFFAOYSA-N 0 1 315.486 4.046 20 0 DIADMN CC(C)[C@H](N[C@@H]1CCn2ccnc21)c1cccc(C(F)(F)F)c1 ZINC000297815260 132035355 /nfs/dbraw/zinc/03/53/55/132035355.db2.gz RBRRJAPZHAWEEB-CABCVRRESA-N 0 1 323.362 4.334 20 0 DIADMN Cc1cccc(C(C)C)c1NC(=O)NCc1ccc2cncn2c1 ZINC000297913652 132039863 /nfs/dbraw/zinc/03/98/63/132039863.db2.gz SLMQTXRDXUOIBD-UHFFFAOYSA-N 0 1 322.412 4.088 20 0 DIADMN CCOc1cc(CN[C@@H]2CCCc3occc32)cc(Cl)c1O ZINC000298381072 132059408 /nfs/dbraw/zinc/05/94/08/132059408.db2.gz CLWICIMNEBVTIG-CQSZACIVSA-N 0 1 321.804 4.205 20 0 DIADMN C[C@H](NCc1ccc([C@H]2C[C@@H]2C)o1)c1ccc2c(c1)CCC(=O)N2 ZINC000298589470 132069066 /nfs/dbraw/zinc/06/90/66/132069066.db2.gz YLIQEQXGINPALH-DCGLDWPTSA-N 0 1 324.424 4.139 20 0 DIADMN 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332162951 /nfs/dbraw/zinc/16/29/51/332162951.db2.gz DGLZCRPSDODOAC-OAHLLOKOSA-N 0 1 315.461 4.279 20 0 DIADMN Cc1ccc(-c2cc(C(=O)N(CC(C)C)C(C)C)n[nH]2)c(C)c1 ZINC000427000385 332165107 /nfs/dbraw/zinc/16/51/07/332165107.db2.gz CITRHQHZMDXQFO-UHFFFAOYSA-N 0 1 313.445 4.200 20 0 DIADMN CC(C)(C)c1ncc(C[N@H+]2CC[C@H](Nc3ccccc3)C2)s1 ZINC000092758162 332170278 /nfs/dbraw/zinc/17/02/78/332170278.db2.gz OPKSHGOWFVHJLX-HNNXBMFYSA-N 0 1 315.486 4.127 20 0 DIADMN CC(C)(C)c1ncc(CN2CC[C@H](Nc3ccccc3)C2)s1 ZINC000092758162 332170279 /nfs/dbraw/zinc/17/02/79/332170279.db2.gz OPKSHGOWFVHJLX-HNNXBMFYSA-N 0 1 315.486 4.127 20 0 DIADMN Cc1ccc2c(c1)[C@H](NCc1ccn(C3CCCC3)n1)[C@@H](C)C2 ZINC000180969830 332170384 /nfs/dbraw/zinc/17/03/84/332170384.db2.gz GMOVFPHZOYMJOR-MGPUTAFESA-N 0 1 309.457 4.330 20 0 DIADMN Cc1c(Cl)cccc1C(=O)Nc1cc(F)cc(Cl)c1O ZINC000427184284 332182516 /nfs/dbraw/zinc/18/25/16/332182516.db2.gz YXGUQUJPGRBCFN-UHFFFAOYSA-N 0 1 314.143 4.399 20 0 DIADMN Cc1ccc(-c2cc(C(=O)N3CCC[C@H]4CCC[C@@H]43)n[nH]2)c(C)c1 ZINC000427231702 332185897 /nfs/dbraw/zinc/18/58/97/332185897.db2.gz XMSBILCPJLSRJB-BEFAXECRSA-N 0 1 323.440 4.098 20 0 DIADMN Cc1ccc2sc(CN(C)C[C@H](C)c3nccs3)nc2c1 ZINC000528442858 332199165 /nfs/dbraw/zinc/19/91/65/332199165.db2.gz UDUCSJXBSRMHHW-LBPRGKRZSA-N 0 1 317.483 4.297 20 0 DIADMN Cc1csc([C@H](NCCOc2ccccc2Cl)C2CC2)n1 ZINC000181601969 332202297 /nfs/dbraw/zinc/20/22/97/332202297.db2.gz YZWRUZGOUOLNMZ-OAHLLOKOSA-N 0 1 322.861 4.225 20 0 DIADMN C[C@H](C[N@@H+](Cc1ccccc1)C[C@@H](C)C1CCCCC1)C(=O)[O-] ZINC000569611217 332205495 /nfs/dbraw/zinc/20/54/95/332205495.db2.gz DQRGFQAOFZZJKA-IAGOWNOFSA-N 0 1 317.473 4.426 20 0 DIADMN COc1cc(C)nc(CN(Cc2ccoc2)C2CCCCC2)c1 ZINC000533839570 332218281 /nfs/dbraw/zinc/21/82/81/332218281.db2.gz PPHIMZIMUBDJPN-UHFFFAOYSA-N 0 1 314.429 4.327 20 0 DIADMN CC(C)CCc1ccccc1NC(=O)CN1[C@H](C)CC[C@H]1C ZINC000531048449 332231617 /nfs/dbraw/zinc/23/16/17/332231617.db2.gz UMFMNQNLLDDBPY-HZPDHXFCSA-N 0 1 302.462 4.087 20 0 DIADMN Cc1cccc(C(C)C)c1NC(=O)CN1CC[C@@H](CC2CC2)C1 ZINC000559411666 332257422 /nfs/dbraw/zinc/25/74/22/332257422.db2.gz UQJGBZOVEWIZBX-KRWDZBQOSA-N 0 1 314.473 4.179 20 0 DIADMN Fc1cccc(F)c1-c1nc(CN2CC[C@H](CC3CC3)C2)co1 ZINC000559418062 332257526 /nfs/dbraw/zinc/25/75/26/332257526.db2.gz KSJPWVRPACZYKZ-CYBMUJFWSA-N 0 1 318.367 4.242 20 0 DIADMN CC(C)[C@]1(CO)CCC[N@@H+](C/C=C/c2ccc(Cl)cc2)C1 ZINC000559425680 332257549 /nfs/dbraw/zinc/25/75/49/332257549.db2.gz OWPOJVCDOQFUBF-YWPBOTNQSA-N 0 1 307.865 4.084 20 0 DIADMN CC1(C)C[N@@H+](Cc2csc(-c3ccccn3)n2)[C@@H]2CCC[C@H]21 ZINC000559425725 332257693 /nfs/dbraw/zinc/25/76/93/332257693.db2.gz SHQVAWQEHPZWFQ-GDBMZVCRSA-N 0 1 313.470 4.216 20 0 DIADMN Cc1ccccc1NC(=O)CN1CCCC[C@@H]1Cc1ccccc1 ZINC000559447391 332260217 /nfs/dbraw/zinc/26/02/17/332260217.db2.gz PFFSVXFQUIXPBI-LJQANCHMSA-N 0 1 322.452 4.031 20 0 DIADMN Cc1coc(C)c1C(=O)Nc1ccc2nc(C(C)(C)C)[nH]c2c1 ZINC000559503879 332267367 /nfs/dbraw/zinc/26/73/67/332267367.db2.gz GFLFZPZPTWCYJC-UHFFFAOYSA-N 0 1 311.385 4.323 20 0 DIADMN CCN(C(=O)c1cc(-c2ccccc2)[nH]n1)[C@H]1CCCC[C@@H]1C ZINC000559702711 332277434 /nfs/dbraw/zinc/27/74/34/332277434.db2.gz FXKDRODIVSCLLT-KSSFIOAISA-N 0 1 311.429 4.118 20 0 DIADMN Cc1ccc(Oc2ccccc2CN[C@H](C)c2cn[nH]c2)cc1 ZINC000559895912 332290818 /nfs/dbraw/zinc/29/08/18/332290818.db2.gz XUOZPJSBXMDGAT-OAHLLOKOSA-N 0 1 307.397 4.361 20 0 DIADMN Cc1ccc([C@@H](C)N[C@@H](C)c2ccc(-n3cccn3)c(F)c2)o1 ZINC000559897857 332291053 /nfs/dbraw/zinc/29/10/53/332291053.db2.gz SCPRTEACHOFHNA-UONOGXRCSA-N 0 1 313.376 4.325 20 0 DIADMN Cc1ccc([C@H](C)N[C@@H](C)c2ccc(-n3cccn3)c(F)c2)o1 ZINC000559897856 332291177 /nfs/dbraw/zinc/29/11/77/332291177.db2.gz SCPRTEACHOFHNA-KBPBESRZSA-N 0 1 313.376 4.325 20 0 DIADMN CCN(CC)c1ncc(CN[C@H](C)c2cc(C)oc2C)s1 ZINC000044729820 332291794 /nfs/dbraw/zinc/29/17/94/332291794.db2.gz RQEHNTIFXHFBBV-GFCCVEGCSA-N 0 1 307.463 4.050 20 0 DIADMN CC[C@@H](C)[C@H]1CCCCN1C(=O)c1cnc(-c2ccccc2)[nH]1 ZINC000559927583 332293893 /nfs/dbraw/zinc/29/38/93/332293893.db2.gz VGQDIFRPKMAWOU-RHSMWYFYSA-N 0 1 311.429 4.118 20 0 DIADMN Cc1cc([C@H](C)NCc2ccnc(OC3CCCC3)c2)c(C)o1 ZINC000559985301 332299721 /nfs/dbraw/zinc/29/97/21/332299721.db2.gz OMWFHBUXDRHJSK-AWEZNQCLSA-N 0 1 314.429 4.464 20 0 DIADMN CCOc1ccc(CNCc2ccccc2Br)cc1 ZINC000048819422 332305558 /nfs/dbraw/zinc/30/55/58/332305558.db2.gz PICNSRIRECXHSV-UHFFFAOYSA-N 0 1 320.230 4.138 20 0 DIADMN CCCc1ccc([C@@H](C)NCc2cn3cc(C)ccc3n2)cc1 ZINC000560049949 332306629 /nfs/dbraw/zinc/30/66/29/332306629.db2.gz XFQTXICQGFGEQB-MRXNPFEDSA-N 0 1 307.441 4.446 20 0 DIADMN CCCc1ccc([C@H](C)NCc2cn3cc(C)ccc3n2)cc1 ZINC000560049948 332306643 /nfs/dbraw/zinc/30/66/43/332306643.db2.gz XFQTXICQGFGEQB-INIZCTEOSA-N 0 1 307.441 4.446 20 0 DIADMN CCc1ncc(CN[C@@H]2CCCc3ccc(SC)cc32)o1 ZINC000564970017 332319394 /nfs/dbraw/zinc/31/93/94/332319394.db2.gz ARXZZVIPCRTXKS-MRXNPFEDSA-N 0 1 302.443 4.126 20 0 DIADMN CC(C)(C)c1ncc(CN2CCCCC[C@H]2c2ccco2)cn1 ZINC000560261818 332325120 /nfs/dbraw/zinc/32/51/20/332325120.db2.gz XTOODLJBTRAUJT-INIZCTEOSA-N 0 1 313.445 4.484 20 0 DIADMN CCO[C@@H]1CCN(Cc2ccc(C(F)(F)F)s2)C[C@H]1C ZINC000449512455 332329482 /nfs/dbraw/zinc/32/94/82/332329482.db2.gz ZUHUALCIDGZXCE-ZYHUDNBSSA-N 0 1 307.381 4.014 20 0 DIADMN CCO[C@H]1CCN(Cc2ccc(C(F)(F)F)s2)C[C@H]1C ZINC000449512448 332329505 /nfs/dbraw/zinc/32/95/05/332329505.db2.gz ZUHUALCIDGZXCE-PWSUYJOCSA-N 0 1 307.381 4.014 20 0 DIADMN COc1ncc(CN([C@H](C)c2ccccc2)C2CC2)cc1Cl ZINC000560491796 332345638 /nfs/dbraw/zinc/34/56/38/332345638.db2.gz BQVIVRWPSSJVEJ-CYBMUJFWSA-N 0 1 316.832 4.469 20 0 DIADMN CCc1ccc(-c2noc([C@@H](C)N[C@@H]3CC=C(C)CC3)n2)cc1 ZINC000560503101 332347120 /nfs/dbraw/zinc/34/71/20/332347120.db2.gz GXCVHGAJTCWLAQ-RHSMWYFYSA-N 0 1 311.429 4.448 20 0 DIADMN OCC1([C@H](NCc2ccccc2Cl)c2ccccc2)CCC1 ZINC000560569573 332360891 /nfs/dbraw/zinc/36/08/91/332360891.db2.gz NCFDYPMBMIDSOQ-GOSISDBHSA-N 0 1 315.844 4.334 20 0 DIADMN OCC1([C@@H](NCc2ccccc2Cl)c2ccccc2)CCC1 ZINC000560569577 332361054 /nfs/dbraw/zinc/36/10/54/332361054.db2.gz NCFDYPMBMIDSOQ-SFHVURJKSA-N 0 1 315.844 4.334 20 0 DIADMN CCCc1csc(C[N@H+]2CC[C@@H](c3ccccc3F)C2)n1 ZINC000560587515 332366071 /nfs/dbraw/zinc/36/60/71/332366071.db2.gz UZQMBNNPXYOAAY-CYBMUJFWSA-N 0 1 304.434 4.224 20 0 DIADMN CCCc1csc(CN2CC[C@@H](c3ccccc3F)C2)n1 ZINC000560587515 332366073 /nfs/dbraw/zinc/36/60/73/332366073.db2.gz UZQMBNNPXYOAAY-CYBMUJFWSA-N 0 1 304.434 4.224 20 0 DIADMN CC[C@@H](C)Oc1cc(C)ccc1CN[C@H](C)c1cnn(CC)c1 ZINC000119216825 332367092 /nfs/dbraw/zinc/36/70/92/332367092.db2.gz ARNLRNIHXLIMNJ-HZPDHXFCSA-N 0 1 315.461 4.240 20 0 DIADMN Oc1ccc(F)c(CN[C@H]2C[C@H](c3ccccc3Cl)C2)c1F ZINC000560627966 332371621 /nfs/dbraw/zinc/37/16/21/332371621.db2.gz NWZBBXLPCJNSQB-XYPYZODXSA-N 0 1 323.770 4.360 20 0 DIADMN O=C(CCC[N@H+](Cc1ccccc1F)C1CC1)c1ccccc1 ZINC000560848333 332390149 /nfs/dbraw/zinc/39/01/49/332390149.db2.gz WFPSQMUGHNPURU-UHFFFAOYSA-N 0 1 311.400 4.453 20 0 DIADMN O=C(CCCN(Cc1ccccc1F)C1CC1)c1ccccc1 ZINC000560848333 332390151 /nfs/dbraw/zinc/39/01/51/332390151.db2.gz WFPSQMUGHNPURU-UHFFFAOYSA-N 0 1 311.400 4.453 20 0 DIADMN CC[C@H]1CC[C@@H](C)N1Cc1csc(COc2ccccc2)n1 ZINC000560861346 332390903 /nfs/dbraw/zinc/39/09/03/332390903.db2.gz VBLJMPDQFDCZTP-ZBFHGGJFSA-N 0 1 316.470 4.485 20 0 DIADMN Cc1nc([C@@H](C)[S@@](=O)c2ccc(C3CCCCC3)cc2)n[nH]1 ZINC000560889513 332391924 /nfs/dbraw/zinc/39/19/24/332391924.db2.gz XUTMXCLCENPDME-VERVWZFWSA-N 0 1 317.458 4.030 20 0 DIADMN Cc1nc([C@@H](C)[S@](=O)c2ccc(C3CCCCC3)cc2)n[nH]1 ZINC000560889512 332391982 /nfs/dbraw/zinc/39/19/82/332391982.db2.gz XUTMXCLCENPDME-IPQOISQHSA-N 0 1 317.458 4.030 20 0 DIADMN CC[C@@H](c1cccc(OC)c1)N(C)Cc1cnc2cccc(C)n12 ZINC000583408688 332391989 /nfs/dbraw/zinc/39/19/89/332391989.db2.gz JLJJEJUAOLHQJS-IBGZPJMESA-N 0 1 323.440 4.234 20 0 DIADMN CC[C@@H](CN[C@@H](C)c1csc(C)n1)Oc1cccc(C)c1 ZINC000560910430 332394020 /nfs/dbraw/zinc/39/40/20/332394020.db2.gz IIKOHXYLIWCGKH-ZFWWWQNUSA-N 0 1 304.459 4.268 20 0 DIADMN COc1cccc(Cl)c1CN1CCC[C@H](c2nccs2)C1 ZINC000092788572 332397214 /nfs/dbraw/zinc/39/72/14/332397214.db2.gz RWRFJNAVUBCRQT-LBPRGKRZSA-N 0 1 322.861 4.185 20 0 DIADMN Cc1cnc([C@@H](C)N[C@H](Cc2ccccc2)c2cccs2)cn1 ZINC000427447179 332428036 /nfs/dbraw/zinc/42/80/36/332428036.db2.gz UQJRDVQHHOVXIQ-NVXWUHKLSA-N 0 1 323.465 4.481 20 0 DIADMN CC[C@H](Nc1ccnc(C)c1Cl)c1ccc(OC)c(OC)c1 ZINC000561358472 332440753 /nfs/dbraw/zinc/44/07/53/332440753.db2.gz CFUMQSXZYVQWTB-ZDUSSCGKSA-N 0 1 320.820 4.046 20 0 DIADMN CCc1nc(C)c([C@H](C)N[C@H]2COc3c2ccc(C)c3C)s1 ZINC000537976665 332478792 /nfs/dbraw/zinc/47/87/92/332478792.db2.gz FYWOGOYBLLDJOC-WFASDCNBSA-N 0 1 316.470 4.415 20 0 DIADMN Cc1cc2c(cc1C)[C@H](NCc1ccc(F)cn1)CCS2 ZINC000427704256 332493369 /nfs/dbraw/zinc/49/33/69/332493369.db2.gz IHWQJRDAUCSGFV-MRXNPFEDSA-N 0 1 302.418 4.164 20 0 DIADMN CCCOc1ccc(CN[C@@H](C)c2ccc(CC)o2)cc1OC ZINC000151075434 332506594 /nfs/dbraw/zinc/50/65/94/332506594.db2.gz CQUXSUNKTSHVFE-AWEZNQCLSA-N 0 1 317.429 4.490 20 0 DIADMN Cc1ccccc1[C@@H](C)NCc1cccnc1OCC(F)(F)F ZINC000151122136 332526084 /nfs/dbraw/zinc/52/60/84/332526084.db2.gz NWTLPCPJTOMWMJ-CYBMUJFWSA-N 0 1 324.346 4.182 20 0 DIADMN COC[C@@H](NCc1ccc(-c2cccnc2)cc1)c1ccccc1 ZINC000562040612 332535913 /nfs/dbraw/zinc/53/59/13/332535913.db2.gz BSROCWIWVLMVHO-OAQYLSRUSA-N 0 1 318.420 4.226 20 0 DIADMN CC1(c2ccccc2)CCN(Cc2ccc(Cl)cn2)CC1 ZINC000562261737 332565466 /nfs/dbraw/zinc/56/54/66/332565466.db2.gz BKDWDIXLIKAYSR-UHFFFAOYSA-N 0 1 300.833 4.289 20 0 DIADMN CC[C@@H](C)CC(=O)NC[C@@H](c1ccccc1Cl)N1CCCC1 ZINC000562309364 332573160 /nfs/dbraw/zinc/57/31/60/332573160.db2.gz XEDSWKUQLPJKDC-PBHICJAKSA-N 0 1 322.880 4.029 20 0 DIADMN C[C@H](N[C@H]1CCC1(C)C)c1nnc(-c2cccc(Cl)c2)o1 ZINC000566805021 332575904 /nfs/dbraw/zinc/57/59/04/332575904.db2.gz MGHPUVPCOMCAOT-GWCFXTLKSA-N 0 1 305.809 4.229 20 0 DIADMN CC[C@H](NC1(C(=O)Nc2ccccc2)CC1)c1ccc(F)cc1 ZINC000427981712 332580675 /nfs/dbraw/zinc/58/06/75/332580675.db2.gz DFFGLXJRNVWERX-KRWDZBQOSA-N 0 1 312.388 4.038 20 0 DIADMN CCCOc1ccc(CNCc2cccc(C(F)(F)F)n2)cc1 ZINC000562668925 332615176 /nfs/dbraw/zinc/61/51/76/332615176.db2.gz JYNRUDBCKODOJF-UHFFFAOYSA-N 0 1 324.346 4.179 20 0 DIADMN c1c(CNC2(c3ccccc3)CCCCC2)nc2ccccn12 ZINC000525696109 332619960 /nfs/dbraw/zinc/61/99/60/332619960.db2.gz PAAVDEDWHBRHPY-UHFFFAOYSA-N 0 1 305.425 4.284 20 0 DIADMN Cc1nn(C(C)(C)C)cc1[C@H](C)NCc1ccc(Cl)cc1 ZINC000152905499 332708327 /nfs/dbraw/zinc/70/83/27/332708327.db2.gz RCTYYDSFRLAGIJ-LBPRGKRZSA-N 0 1 305.853 4.451 20 0 DIADMN CN(C)[C@H](CN[C@@H](c1ccccc1)C(F)(F)F)c1ccccc1 ZINC000570074362 332709253 /nfs/dbraw/zinc/70/92/53/332709253.db2.gz YTNJIIXWRUJCLI-SJORKVTESA-N 0 1 322.374 4.183 20 0 DIADMN CN(C)[C@@H](CN[C@H](c1ccccc1)C(F)(F)F)c1ccccc1 ZINC000570074355 332709279 /nfs/dbraw/zinc/70/92/79/332709279.db2.gz YTNJIIXWRUJCLI-DLBZAZTESA-N 0 1 322.374 4.183 20 0 DIADMN COc1cc2c(cc1CN[C@H](C)c1cccc(C)c1)O[C@@H](C)C2 ZINC000322865040 332717457 /nfs/dbraw/zinc/71/74/57/332717457.db2.gz WFGFMOMCFQDEMT-LSDHHAIUSA-N 0 1 311.425 4.178 20 0 DIADMN CCOC[C@@H](NCc1csc(-c2ccc(F)cc2)n1)C(C)C ZINC000188862348 334877452 /nfs/dbraw/zinc/87/74/52/334877452.db2.gz YPCMRGIPZAPYQX-MRXNPFEDSA-N 0 1 322.449 4.100 20 0 DIADMN COc1cnccc1[C@@H](C)N[C@H]1CCc2c1cccc2Cl ZINC000187116214 332958804 /nfs/dbraw/zinc/95/88/04/332958804.db2.gz DIHPONKGCISVMS-BZNIZROVSA-N 0 1 302.805 4.082 20 0 DIADMN C[C@@H](N[C@H]1CCSc2ccc(F)cc21)c1cncc(F)c1 ZINC000177843825 332998106 /nfs/dbraw/zinc/99/81/06/332998106.db2.gz OZQPPPZXPGFSMP-BMIGLBTASA-N 0 1 306.381 4.248 20 0 DIADMN C[C@@H](NCCc1cscn1)c1cc(Cl)sc1Cl ZINC000178471776 333013415 /nfs/dbraw/zinc/01/34/15/333013415.db2.gz KUTRJUMUIXRKGG-SSDOTTSWSA-N 0 1 307.271 4.405 20 0 DIADMN Cc1cccc2nc(CCC(=O)Nc3ccc(C)c(C)c3)[nH]c21 ZINC000178848794 333021370 /nfs/dbraw/zinc/02/13/70/333021370.db2.gz IDUNELGGTPPKGZ-UHFFFAOYSA-N 0 1 307.397 4.059 20 0 DIADMN Cc1cccc2nc(CCC(=O)Nc3cccc(C)c3C)[nH]c21 ZINC000178848557 333021551 /nfs/dbraw/zinc/02/15/51/333021551.db2.gz DJIOKSXJVPGRIP-UHFFFAOYSA-N 0 1 307.397 4.059 20 0 DIADMN CC1(C)CCC(N[C@H](c2ncc[nH]2)c2ccc(F)cc2)CC1 ZINC000188068458 333024216 /nfs/dbraw/zinc/02/42/16/333024216.db2.gz YZDVXEZKCWRWIL-INIZCTEOSA-N 0 1 301.409 4.197 20 0 DIADMN COc1ccc(F)cc1CN[C@@H](C)c1ccc(SC)cc1 ZINC000180169856 333026951 /nfs/dbraw/zinc/02/69/51/333026951.db2.gz IXQRRVLPIBUTSB-LBPRGKRZSA-N 0 1 305.418 4.407 20 0 DIADMN Cc1ccc(C)c(NC(=O)CN[C@H](C)c2ccc(C)c(F)c2)c1 ZINC000181342127 333029955 /nfs/dbraw/zinc/02/99/55/333029955.db2.gz PPHPZYHLQFDTLO-OAHLLOKOSA-N 0 1 314.404 4.040 20 0 DIADMN F[C@@H]1CCC[C@@H]1NCc1ccc(Br)c(Cl)c1 ZINC000378731780 333048243 /nfs/dbraw/zinc/04/82/43/333048243.db2.gz DKYXVMNFSUSYRM-NEPJUHHUSA-N 0 1 306.606 4.083 20 0 DIADMN Cc1ncsc1CN(C)Cc1cc(Cl)cc2cccnc21 ZINC000171751196 333053886 /nfs/dbraw/zinc/05/38/86/333053886.db2.gz LEVFJHDUROGAAJ-UHFFFAOYSA-N 0 1 317.845 4.285 20 0 DIADMN COc1cnccc1[C@H](C)N[C@H](C)c1ccc(SC)c(F)c1 ZINC000188769293 333054773 /nfs/dbraw/zinc/05/47/73/333054773.db2.gz INNOAGMVMVCLLJ-NEPJUHHUSA-N 0 1 320.433 4.363 20 0 DIADMN CCC[C@H](CN[C@H](C)c1ccc(F)cc1Br)OC ZINC000378841783 333055892 /nfs/dbraw/zinc/05/58/92/333055892.db2.gz YJEINVGEDMLSGL-ZYHUDNBSSA-N 0 1 318.230 4.054 20 0 DIADMN COCc1cc(CN[C@@H](C)c2cc(F)ccc2F)ccc1F ZINC000171982958 333056935 /nfs/dbraw/zinc/05/69/35/333056935.db2.gz TUDZPGCGDPJYEK-NSHDSACASA-N 0 1 309.331 4.101 20 0 DIADMN CC(C)Oc1ccccc1NC(=O)c1ccc(O)c(Cl)c1 ZINC000183406060 333057412 /nfs/dbraw/zinc/05/74/12/333057412.db2.gz IVMNEWRUUPAEMC-UHFFFAOYSA-N 0 1 305.761 4.085 20 0 DIADMN COC[C@H](NCc1ccccc1C(F)(F)F)c1ccccc1 ZINC000378873092 333058128 /nfs/dbraw/zinc/05/81/28/333058128.db2.gz SSHMQZUNLBTQCK-INIZCTEOSA-N 0 1 309.331 4.183 20 0 DIADMN O=C(c1ccc(O)c(Cl)c1)N(Cc1ccco1)C1CCCC1 ZINC000183464848 333058466 /nfs/dbraw/zinc/05/84/66/333058466.db2.gz RUNCADRSAIWOEM-UHFFFAOYSA-N 0 1 319.788 4.224 20 0 DIADMN COC[C@H](N[C@@H](C)c1ccc(F)c(OC)c1)c1ccc(F)cc1 ZINC000537984063 333058922 /nfs/dbraw/zinc/05/89/22/333058922.db2.gz HRRBOZYHLZPRIB-SJCJKPOMSA-N 0 1 321.367 4.012 20 0 DIADMN C[C@@H](c1ccncc1)N(C)Cc1ccc(F)c(Br)c1 ZINC000111208358 333062422 /nfs/dbraw/zinc/06/24/22/333062422.db2.gz PLVWPEYUIGLGJU-NSHDSACASA-N 0 1 323.209 4.176 20 0 DIADMN COCc1ccc(CN[C@@H](C)c2ccccc2OC(C)C)cc1 ZINC000378909069 333062904 /nfs/dbraw/zinc/06/29/04/333062904.db2.gz RKWZGYOJBZNKPO-INIZCTEOSA-N 0 1 313.441 4.471 20 0 DIADMN Cc1ccc(NC(=O)CN[C@@H](C)c2cc3ccccc3o2)cc1 ZINC000181756497 333066973 /nfs/dbraw/zinc/06/69/73/333066973.db2.gz HRMFRYZNOGVITA-AWEZNQCLSA-N 0 1 308.381 4.031 20 0 DIADMN CCCC[C@@H]1CCC[C@@H]1NCc1nc([C@H](C)SCC)no1 ZINC000460356985 333070546 /nfs/dbraw/zinc/07/05/46/333070546.db2.gz QJQLNKKPPDRLPN-MJBXVCDLSA-N 0 1 311.495 4.332 20 0 DIADMN CC(C)c1nc([C@@H](C)NCCOc2ccc(F)cc2)cs1 ZINC000460362411 333071602 /nfs/dbraw/zinc/07/16/02/333071602.db2.gz KPLZLIFZDWNNQO-GFCCVEGCSA-N 0 1 308.422 4.135 20 0 DIADMN C[N@H+](Cc1nc2ccc(Br)cc2[nH]1)C1CCCCC1 ZINC000460384539 333076220 /nfs/dbraw/zinc/07/62/20/333076220.db2.gz JKZRCWOHROZINT-UHFFFAOYSA-N 0 1 322.250 4.090 20 0 DIADMN C[N@@H+](Cc1nc2ccc(Br)cc2[nH]1)C1CCCCC1 ZINC000460384539 333076222 /nfs/dbraw/zinc/07/62/22/333076222.db2.gz JKZRCWOHROZINT-UHFFFAOYSA-N 0 1 322.250 4.090 20 0 DIADMN COC(=O)c1cccc(CN[C@@H](C)c2cc3ccccc3o2)c1 ZINC000181766973 333077099 /nfs/dbraw/zinc/07/70/99/333077099.db2.gz MPLARIAZQZGWQS-ZDUSSCGKSA-N 0 1 309.365 4.070 20 0 DIADMN COc1cc(CN[C@@H](C)c2cnn(C(C)C)c2)cc2ccccc21 ZINC000520963727 333084511 /nfs/dbraw/zinc/08/45/11/333084511.db2.gz IACMPYZOBGNPBE-HNNXBMFYSA-N 0 1 323.440 4.477 20 0 DIADMN Cc1ccc(CNCc2ccc(Br)c(C)c2)nc1C ZINC000314137785 333089704 /nfs/dbraw/zinc/08/97/04/333089704.db2.gz FYGCZQWZLHWWCK-UHFFFAOYSA-N 0 1 319.246 4.059 20 0 DIADMN COc1cccc(Cl)c1CNC[C@@H](C)Oc1cccc(F)c1 ZINC000462737485 333102554 /nfs/dbraw/zinc/10/25/54/333102554.db2.gz PSUQJFPLANAONF-GFCCVEGCSA-N 0 1 323.795 4.045 20 0 DIADMN C[C@@H](NCc1cnc(C(C)(C)C)nc1)c1ccc(Cl)cc1 ZINC000314398693 333108301 /nfs/dbraw/zinc/10/83/01/333108301.db2.gz VZQZAANXIQPXPD-GFCCVEGCSA-N 0 1 303.837 4.278 20 0 DIADMN CS[C@@H](C)CN[C@@H](C)c1csc(-c2ccccc2F)n1 ZINC000462811100 333117931 /nfs/dbraw/zinc/11/79/31/333117931.db2.gz WGJVWAFVIFLDRV-QWRGUYRKSA-N 0 1 310.463 4.351 20 0 DIADMN CS[C@@H](C)CN[C@H](C)c1csc(-c2ccccc2F)n1 ZINC000462811101 333118018 /nfs/dbraw/zinc/11/80/18/333118018.db2.gz WGJVWAFVIFLDRV-WDEREUQCSA-N 0 1 310.463 4.351 20 0 DIADMN CC(C)[C@](C)(O)CN[C@@H](C)c1csc(-c2ccccc2F)n1 ZINC000462822868 333120366 /nfs/dbraw/zinc/12/03/66/333120366.db2.gz XIXGPHRZZCVUAF-YVEFUNNKSA-N 0 1 322.449 4.007 20 0 DIADMN CCOc1ncccc1CNCc1ccc(C(F)(F)F)cc1C ZINC000190835011 335123725 /nfs/dbraw/zinc/12/37/25/335123725.db2.gz RDSCGYUXYBTVRZ-UHFFFAOYSA-N 0 1 324.346 4.097 20 0 DIADMN CCC[C@H](N[C@H](C)c1cn(C)nc1C)c1ccc(F)cc1F ZINC000178459255 333139158 /nfs/dbraw/zinc/13/91/58/333139158.db2.gz GBPUELCMLSDMBF-DIFFPNOSSA-N 0 1 307.388 4.199 20 0 DIADMN CCC[C@@H](N[C@H](C)c1cn(C)nc1C)c1ccc(F)cc1F ZINC000178459260 333139255 /nfs/dbraw/zinc/13/92/55/333139255.db2.gz GBPUELCMLSDMBF-PIGZYNQJSA-N 0 1 307.388 4.199 20 0 DIADMN CCOc1ccc(Cl)cc1[C@H](C)N[C@@H](C)c1cn(C)nc1C ZINC000178717992 333142699 /nfs/dbraw/zinc/14/26/99/333142699.db2.gz OFMKCTMJFSVLME-RYUDHWBXSA-N 0 1 321.852 4.192 20 0 DIADMN Cc1nn(C)cc1[C@@H](C)N[C@@H]1C[C@H](C)Sc2sccc21 ZINC000178718036 333142951 /nfs/dbraw/zinc/14/29/51/333142951.db2.gz OFUKPEBDGWMAPF-IMSIIYSGSA-N 0 1 307.488 4.066 20 0 DIADMN Cc1nn(C)cc1[C@@H](C)N[C@@H](C)c1ccc(-c2ccccc2)o1 ZINC000178723255 333143142 /nfs/dbraw/zinc/14/31/42/333143142.db2.gz MHAVNSJDECHJDL-HIFRSBDPSA-N 0 1 309.413 4.400 20 0 DIADMN CCCC[N@@H+](CC)[C@@H](C(=O)[O-])c1cccc(Cl)c1Cl ZINC000580319450 333146508 /nfs/dbraw/zinc/14/65/08/333146508.db2.gz LWLRTXSIMCDIBB-CYBMUJFWSA-N 0 1 304.217 4.241 20 0 DIADMN CCN(Cc1ccccc1)[C@H](C)C(=O)Nc1ccc(C)cc1C ZINC000216201266 333149299 /nfs/dbraw/zinc/14/92/99/333149299.db2.gz XNEYODIMPWPTHG-QGZVFWFLSA-N 0 1 310.441 4.153 20 0 DIADMN Cc1cccc(C(C)C)c1NC(=O)CN1CCCC[C@@H](C)C1 ZINC000187924384 333153862 /nfs/dbraw/zinc/15/38/62/333153862.db2.gz AKAISCGBDCYVTM-OAHLLOKOSA-N 0 1 302.462 4.179 20 0 DIADMN Cc1cccc(C(C)C)c1NC(=O)CN1CCCC[C@H](C)C1 ZINC000187924357 333154028 /nfs/dbraw/zinc/15/40/28/333154028.db2.gz AKAISCGBDCYVTM-HNNXBMFYSA-N 0 1 302.462 4.179 20 0 DIADMN CCc1ccccc1C(=O)Nc1ccc2nc(C(F)F)[nH]c2c1 ZINC000179855717 333155861 /nfs/dbraw/zinc/15/58/61/333155861.db2.gz AKGWNECJIBGEER-UHFFFAOYSA-N 0 1 315.323 4.315 20 0 DIADMN Cc1ccc(-c2cc(C(=O)N3CCCC[C@H]3C(C)C)n[nH]2)cc1 ZINC000522676131 333161758 /nfs/dbraw/zinc/16/17/58/333161758.db2.gz MPFPQUFWLIHIFR-SFHVURJKSA-N 0 1 311.429 4.036 20 0 DIADMN COc1ccc2cc(CN[C@@H]3c4ccccc4O[C@H]3C)ccc2c1 ZINC000520879613 333168980 /nfs/dbraw/zinc/16/89/80/333168980.db2.gz LBQXKOZBKWHHNO-QKKBWIMNSA-N 0 1 319.404 4.460 20 0 DIADMN COc1ccc2cc(CN[C@H]3c4ccccc4O[C@@H]3C)ccc2c1 ZINC000520879614 333169018 /nfs/dbraw/zinc/16/90/18/333169018.db2.gz LBQXKOZBKWHHNO-SPLOXXLWSA-N 0 1 319.404 4.460 20 0 DIADMN C/C(Cl)=C\CN1CCC([C@H](O)c2ccc(Cl)cc2)CC1 ZINC000528376019 333173463 /nfs/dbraw/zinc/17/34/63/333173463.db2.gz ANRKCPUSYYFANI-GXDWLZFVSA-N 0 1 314.256 4.228 20 0 DIADMN COC(=O)c1cccc(CN[C@H](C)c2ccc(C)cc2)c1Cl ZINC000382049475 333180331 /nfs/dbraw/zinc/18/03/31/333180331.db2.gz FLSBKDHAUZIOJE-CYBMUJFWSA-N 0 1 317.816 4.286 20 0 DIADMN COC(=O)c1cccc(CN[C@@H](C)c2ccc(C)cc2)c1Cl ZINC000382049478 333180366 /nfs/dbraw/zinc/18/03/66/333180366.db2.gz FLSBKDHAUZIOJE-ZDUSSCGKSA-N 0 1 317.816 4.286 20 0 DIADMN CCN(CC)[C@@H](CNCc1ncc(C(C)C)s1)c1ccco1 ZINC000183578457 333186065 /nfs/dbraw/zinc/18/60/65/333186065.db2.gz RDDAVCPNEWSUNH-AWEZNQCLSA-N 0 1 321.490 4.032 20 0 DIADMN Cc1ccccc1[C@H](C(=O)[O-])[N@@H+]1CC[C@@H](c2ccccc2)[C@@H](C)C1 ZINC000582067966 333196844 /nfs/dbraw/zinc/19/68/44/333196844.db2.gz RISZACNBSYVNDT-ILZDJORESA-N 0 1 323.436 4.246 20 0 DIADMN COc1ccccc1[C@@H]1CCCN1Cc1c[nH]nc1C(C)(C)C ZINC000093008331 333218313 /nfs/dbraw/zinc/21/83/13/333218313.db2.gz YSFBMVVBBSZNCZ-INIZCTEOSA-N 0 1 313.445 4.053 20 0 DIADMN Cc1cc(-c2noc([C@H](C)N[C@H](C)CC3CC3)n2)ccc1F ZINC000497294507 333232526 /nfs/dbraw/zinc/23/25/26/333232526.db2.gz PEOJCBMVGQJHKC-NEPJUHHUSA-N 0 1 303.381 4.023 20 0 DIADMN Cc1ccc(-c2noc([C@@H](C)N[C@H](C)CC3CC3)n2)cc1F ZINC000497309366 333234668 /nfs/dbraw/zinc/23/46/68/333234668.db2.gz FWJBTPBMJLILQH-VXGBXAGGSA-N 0 1 303.381 4.023 20 0 DIADMN Cc1ccc([C@H](C)N(C)C(=O)c2[nH]nc3ccccc32)c(C)c1 ZINC000497391836 333244014 /nfs/dbraw/zinc/24/40/14/333244014.db2.gz WRLCNUMVFNYFTL-AWEZNQCLSA-N 0 1 307.397 4.013 20 0 DIADMN COc1cccc(CN(C)[C@@H](C)c2cccc(C(F)(F)F)c2)n1 ZINC000497476224 333254885 /nfs/dbraw/zinc/25/48/85/333254885.db2.gz ITUPSFXRMVNMPF-LBPRGKRZSA-N 0 1 324.346 4.302 20 0 DIADMN CN(CCOc1cc(Cl)ccc1Cl)Cc1ccoc1 ZINC000497478129 333255149 /nfs/dbraw/zinc/25/51/49/333255149.db2.gz XUXAFRQHVUYDCO-UHFFFAOYSA-N 0 1 300.185 4.097 20 0 DIADMN C[C@H](c1cccc(Cl)c1)N1CCN(c2ccccc2)CC1 ZINC000497584151 333266021 /nfs/dbraw/zinc/26/60/21/333266021.db2.gz BJGFNYQNZSCCMI-OAHLLOKOSA-N 0 1 300.833 4.223 20 0 DIADMN COc1ccc(CN(C)[C@@H](C)c2ccc(F)c(F)c2)cc1OC ZINC000497590851 333266535 /nfs/dbraw/zinc/26/65/35/333266535.db2.gz OZDFATBCGVBEGF-LBPRGKRZSA-N 0 1 321.367 4.175 20 0 DIADMN FC1(F)CCC[C@H]1CN[C@H](c1ccccc1)c1ccccn1 ZINC000390612834 333307025 /nfs/dbraw/zinc/30/70/25/333307025.db2.gz XFRSFJPBFDVBDP-DOTOQJQBSA-N 0 1 302.368 4.196 20 0 DIADMN CCc1nn(C)c(CC)c1CN[C@@H](C)c1ccccc1SC ZINC000194937905 333317950 /nfs/dbraw/zinc/31/79/50/333317950.db2.gz QMXXBDJLIGULEH-ZDUSSCGKSA-N 0 1 317.502 4.118 20 0 DIADMN Cc1nc(CN2CC[C@](C)(CCc3ccccc3)C2)cs1 ZINC000531202362 333330736 /nfs/dbraw/zinc/33/07/36/333330736.db2.gz UGFNXHWEQKGTSC-SFHVURJKSA-N 0 1 300.471 4.296 20 0 DIADMN Cc1ccsc1[C@@H](CO)NCc1ccc(-c2ccccc2)o1 ZINC000531206706 333330953 /nfs/dbraw/zinc/33/09/53/333330953.db2.gz CTIBNGLPUVNUPL-MRXNPFEDSA-N 0 1 313.422 4.140 20 0 DIADMN CCc1ccc(C(C)(C)NCc2cc(OC)ccc2OC)cc1 ZINC000531199828 333331161 /nfs/dbraw/zinc/33/11/61/333331161.db2.gz YONLXHCWCDKBJT-UHFFFAOYSA-N 0 1 313.441 4.291 20 0 DIADMN Cc1nn(-c2ccccc2)cc1CNC1(c2ccc(F)cc2)CC1 ZINC000531206410 333331177 /nfs/dbraw/zinc/33/11/77/333331177.db2.gz BSMBGVIPMGYLDU-UHFFFAOYSA-N 0 1 321.399 4.099 20 0 DIADMN Fc1ccccc1CN[C@H]1CCc2cc(Br)ccc21 ZINC000040226318 333341649 /nfs/dbraw/zinc/34/16/49/333341649.db2.gz DJBOVOSNDVRFKH-INIZCTEOSA-N 0 1 320.205 4.365 20 0 DIADMN CC1(C)CCCCN(Cc2nnc(-c3ccccc3Cl)o2)C1 ZINC000446067469 333342189 /nfs/dbraw/zinc/34/21/89/333342189.db2.gz FMFAWCJPTIVQTH-UHFFFAOYSA-N 0 1 319.836 4.402 20 0 DIADMN CC(C)[C@H](C)C(=O)Nc1cc(Cl)cc(Br)c1O ZINC000531372340 333346746 /nfs/dbraw/zinc/34/67/46/333346746.db2.gz BKQWDHQYRUCYRF-ZETCQYMHSA-N 0 1 320.614 4.039 20 0 DIADMN CCc1nc(CNCCOc2ccccc2C(C)(C)C)cs1 ZINC000518793655 333346935 /nfs/dbraw/zinc/34/69/35/333346935.db2.gz UTCWDIADODXXJW-UHFFFAOYSA-N 0 1 318.486 4.172 20 0 DIADMN Cc1ccc(OCc2nc(CN3C[C@H](C)[C@H](C)C3)cs2)cc1 ZINC000531448465 333354222 /nfs/dbraw/zinc/35/42/22/333354222.db2.gz LWPFYYLYDIHHDO-GASCZTMLSA-N 0 1 316.470 4.118 20 0 DIADMN Clc1cccc(Cl)c1[C@H](NCC1=CCCOC1)C1CC1 ZINC000583469241 333360220 /nfs/dbraw/zinc/36/02/20/333360220.db2.gz CFOFMGOYXRNPID-MRXNPFEDSA-N 0 1 312.240 4.381 20 0 DIADMN Clc1cccc(Cl)c1[C@@H](NCC1=CCCOC1)C1CC1 ZINC000583469240 333360262 /nfs/dbraw/zinc/36/02/62/333360262.db2.gz CFOFMGOYXRNPID-INIZCTEOSA-N 0 1 312.240 4.381 20 0 DIADMN C[C@@H](NCc1ccc(C(C)(C)O)cc1)c1ccc(F)cc1F ZINC000184674574 333364047 /nfs/dbraw/zinc/36/40/47/333364047.db2.gz MFMIZXLMYPUOEI-GFCCVEGCSA-N 0 1 305.368 4.043 20 0 DIADMN CC(=O)Nc1cccc([C@H](C)NCc2ccccc2Cl)c1 ZINC000020551915 333365527 /nfs/dbraw/zinc/36/55/27/333365527.db2.gz IOEWLHWMXOYBOF-LBPRGKRZSA-N 0 1 302.805 4.149 20 0 DIADMN C[C@@H](CN[C@@H](c1ccccc1)c1ccccn1)c1nccs1 ZINC000186751452 333378268 /nfs/dbraw/zinc/37/82/68/333378268.db2.gz WTGAWHFSGKTQQQ-YOEHRIQHSA-N 0 1 309.438 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/nfs/dbraw/zinc/41/78/81/334417881.db2.gz QHSCSBAPPMTIAQ-MRXNPFEDSA-N 0 1 311.404 4.436 20 0 DIADMN Brc1cccc2c1CCC[C@@H]2NCc1ccco1 ZINC000341213240 334418054 /nfs/dbraw/zinc/41/80/54/334418054.db2.gz VTWIOBHVAQLZFD-HNNXBMFYSA-N 0 1 306.203 4.209 20 0 DIADMN CCOc1ccc(CNCc2sc(C)nc2C)cc1Cl ZINC000341406202 334439740 /nfs/dbraw/zinc/43/97/40/334439740.db2.gz NVIHGSAXKMPTEX-UHFFFAOYSA-N 0 1 310.850 4.102 20 0 DIADMN COCC[C@@H](N[C@H](C)c1cc(F)ccc1OC)c1ccccc1 ZINC000341432154 334445515 /nfs/dbraw/zinc/44/55/15/334445515.db2.gz LKUKGPJBEYQPRP-RDTXWAMCSA-N 0 1 317.404 4.263 20 0 DIADMN c1cnc2sc(CN3CCC4(CCCCC4)CC3)nc2c1 ZINC000341611471 334461846 /nfs/dbraw/zinc/46/18/46/334461846.db2.gz HPRCEEMRRVYZMI-UHFFFAOYSA-N 0 1 301.459 4.238 20 0 DIADMN O=C(Nc1cccc(C(F)F)c1Cl)c1ccc2cncn2c1 ZINC000341689039 334470678 /nfs/dbraw/zinc/47/06/78/334470678.db2.gz XNSMDJVFFCAHHE-UHFFFAOYSA-N 0 1 321.714 4.178 20 0 DIADMN COCC[C@H](N[C@@H](C)c1c(F)cccc1OC)c1ccccc1 ZINC000341995075 334499267 /nfs/dbraw/zinc/49/92/67/334499267.db2.gz GHTNCNVGOHGTTA-YOEHRIQHSA-N 0 1 317.404 4.263 20 0 DIADMN COCC[C@H]1CCCCN(c2cc(C)nc3ccc(F)cc32)C1 ZINC000342007394 334500697 /nfs/dbraw/zinc/50/06/97/334500697.db2.gz SOECKJQZHWUUNQ-OAHLLOKOSA-N 0 1 316.420 4.325 20 0 DIADMN CCCc1csc(CNC[C@H]2CC[C@@H](c3ccccc3)O2)n1 ZINC000342436609 334540969 /nfs/dbraw/zinc/54/09/69/334540969.db2.gz YVMUYGLBHTUIDR-SJORKVTESA-N 0 1 316.470 4.106 20 0 DIADMN CC(C)(C)c1ncc(CN[C@H]2CCCc3cc(F)ccc32)cn1 ZINC000342795790 334572342 /nfs/dbraw/zinc/57/23/42/334572342.db2.gz CUTGBKNGSQEDDJ-KRWDZBQOSA-N 0 1 313.420 4.080 20 0 DIADMN CCSc1ccc([C@H](C)NCc2cc(C)nc(C)n2)cc1 ZINC000342812447 334579587 /nfs/dbraw/zinc/57/95/87/334579587.db2.gz APZCPKFXIQXBOG-ZDUSSCGKSA-N 0 1 301.459 4.056 20 0 DIADMN Cc1cc(CN[C@H](CC(C)(C)C)c2ccc(F)cc2)nc(C)n1 ZINC000342815692 334580098 /nfs/dbraw/zinc/58/00/98/334580098.db2.gz QYLKYEFYIBNDOY-GOSISDBHSA-N 0 1 315.436 4.500 20 0 DIADMN Cc1ccc(CNCc2ccc(OC(C)C)nc2)cc1Cl ZINC000443958182 338464326 /nfs/dbraw/zinc/46/43/26/338464326.db2.gz CHQZEYFYFGHMGH-UHFFFAOYSA-N 0 1 304.821 4.120 20 0 DIADMN COc1ccccc1[C@H](N[C@@H]1CC[C@@H]1SC)c1ccccc1 ZINC000425339211 334801704 /nfs/dbraw/zinc/80/17/04/334801704.db2.gz CGORRLTZOWPBTP-NZSAHSFTSA-N 0 1 313.466 4.268 20 0 DIADMN c1cc(OCC2CC2)ccc1CNCc1ccc2c(n1)CCCC2 ZINC000444019394 338467417 /nfs/dbraw/zinc/46/74/17/338467417.db2.gz XSXHNHAVRZSXTA-UHFFFAOYSA-N 0 1 322.452 4.039 20 0 DIADMN C/C(=C\c1ccccc1OC(F)F)CN1CC(CC(F)F)C1 ZINC000425366194 334859496 /nfs/dbraw/zinc/85/94/96/334859496.db2.gz OPKNLEOXJDCLMO-IZZDOVSWSA-N 0 1 317.326 4.278 20 0 DIADMN C[C@@H](NCCOCC(F)F)c1cc(F)c(Cl)cc1Cl ZINC000189818915 334911264 /nfs/dbraw/zinc/91/12/64/334911264.db2.gz AUZGAXHNVRQAHR-SSDOTTSWSA-N 0 1 316.150 4.065 20 0 DIADMN C[C@@H](O)CCCNC1(c2c(Cl)cccc2Cl)CCC1 ZINC000450876088 338710048 /nfs/dbraw/zinc/71/00/48/338710048.db2.gz RTWHSMOBHWLVPV-LLVKDONJSA-N 0 1 302.245 4.123 20 0 DIADMN Cc1nn(C(C)C)cc1CN1CC[C@@H](C)C[C@H]1c1ccco1 ZINC000343631270 335183099 /nfs/dbraw/zinc/18/30/99/335183099.db2.gz YQRHQUIVCWQIST-PBHICJAKSA-N 0 1 301.434 4.339 20 0 DIADMN Cc1oc2ccccc2c1CN1CCCC[C@@H]1c1ccnn1C ZINC000343635484 335183445 /nfs/dbraw/zinc/18/34/45/335183445.db2.gz GLLONGYZEAANIR-GOSISDBHSA-N 0 1 309.413 4.202 20 0 DIADMN CCCN(C(=O)c1cnc(C2CC2)[nH]1)[C@@H](CC)c1ccccc1 ZINC000343645264 335184343 /nfs/dbraw/zinc/18/43/43/335184343.db2.gz JOLPTHSZWGZNEK-KRWDZBQOSA-N 0 1 311.429 4.291 20 0 DIADMN C[C@@H](NCc1cccc(-c2cccnc2)c1)c1ccc(F)cn1 ZINC000343715070 335186204 /nfs/dbraw/zinc/18/62/04/335186204.db2.gz BHNMUSVAMSKFPA-CQSZACIVSA-N 0 1 307.372 4.134 20 0 DIADMN Fc1ccc2c(c1)[C@H](NCc1ccc3ccccc3n1)CCCO2 ZINC000343688417 335188210 /nfs/dbraw/zinc/18/82/10/335188210.db2.gz FWJRKPBJXIREBE-LJQANCHMSA-N 0 1 322.383 4.377 20 0 DIADMN C[C@@H](Nc1ccnc2cc(F)ccc21)c1c(F)cncc1F ZINC000343803645 335194078 /nfs/dbraw/zinc/19/40/78/335194078.db2.gz FTROBBVNZQHBCY-SECBINFHSA-N 0 1 303.287 4.220 20 0 DIADMN CCO[C@@H]1C[C@H](N[C@@H](C)c2nc(C(F)(F)F)cs2)C1(C)C ZINC000343817115 335195262 /nfs/dbraw/zinc/19/52/62/335195262.db2.gz NNSKQCJWXOYHNH-ATZCPNFKSA-N 0 1 322.396 4.016 20 0 DIADMN CCO[C@@H](CCN[C@H](C)c1nc(C(F)(F)F)cs1)C(C)C ZINC000343850947 335197035 /nfs/dbraw/zinc/19/70/35/335197035.db2.gz GHHVECOHVVPEPL-MNOVXSKESA-N 0 1 324.412 4.264 20 0 DIADMN Cc1ccoc1CN[C@H]1CCCc2cc(OC(F)F)ccc21 ZINC000343848427 335197168 /nfs/dbraw/zinc/19/71/68/335197168.db2.gz HMHNMBJNCOBNHE-HNNXBMFYSA-N 0 1 307.340 4.357 20 0 DIADMN COc1cccc([C@H]2C[C@@H](C)CN2Cc2ncc(C)s2)c1 ZINC000344027245 335210199 /nfs/dbraw/zinc/21/01/99/335210199.db2.gz KRXDFXHDCYKLLF-MLGOLLRUSA-N 0 1 302.443 4.043 20 0 DIADMN CC[C@H](NCc1ccccn1)c1cc(F)cc(Br)c1 ZINC000344035483 335211016 /nfs/dbraw/zinc/21/10/16/335211016.db2.gz RMEABJVVZWUOCI-HNNXBMFYSA-N 0 1 323.209 4.224 20 0 DIADMN COc1cccc([C@H]2C[C@H](C)CN2Cc2nc(C)cs2)c1 ZINC000344012394 335212457 /nfs/dbraw/zinc/21/24/57/335212457.db2.gz BVDRZRLPWHKMHL-BLLLJJGKSA-N 0 1 302.443 4.043 20 0 DIADMN CCCCO[C@@H]1C[C@H](NCc2csc(C3CC3)n2)C1(C)C ZINC000344167502 335226847 /nfs/dbraw/zinc/22/68/47/335226847.db2.gz LEBOZGXPNQKPSO-LSDHHAIUSA-N 0 1 308.491 4.094 20 0 DIADMN COc1ccc(CN(Cc2nc(C)cs2)C(C)(C)C)cc1 ZINC000344261858 335233653 /nfs/dbraw/zinc/23/36/53/335233653.db2.gz KSNFBSBROOTHGZ-UHFFFAOYSA-N 0 1 304.459 4.261 20 0 DIADMN COC[C@H](N[C@H]1CCCc2ccc(F)cc21)c1ccc(F)cc1 ZINC000344292064 335237234 /nfs/dbraw/zinc/23/72/34/335237234.db2.gz OFDNMXLWAMGOSY-OALUTQOASA-N 0 1 317.379 4.320 20 0 DIADMN Cc1cc(CN[C@H](CC(C)(C)C)c2ccc(F)cc2)ncn1 ZINC000344328700 335241173 /nfs/dbraw/zinc/24/11/73/335241173.db2.gz MCNJQDQVJUGYKB-QGZVFWFLSA-N 0 1 301.409 4.191 20 0 DIADMN COCC[C@H](NCc1cc(C)c2ncccc2c1)c1ccco1 ZINC000344345546 335243180 /nfs/dbraw/zinc/24/31/80/335243180.db2.gz FCZSMFQIWIHIND-KRWDZBQOSA-N 0 1 310.397 4.004 20 0 DIADMN COCC[C@H](NCc1cc(C)c2ncccc2c1)c1ccc(C)o1 ZINC000344323878 335245588 /nfs/dbraw/zinc/24/55/88/335245588.db2.gz JZIFZXHMXYVYAX-SFHVURJKSA-N 0 1 324.424 4.312 20 0 DIADMN CCCCc1nc2ccc(NC(=O)c3cc(C)n(C)c3C)cc2[nH]1 ZINC000344445597 335249604 /nfs/dbraw/zinc/24/96/04/335249604.db2.gz JOSNHQRJVFJMLL-UHFFFAOYSA-N 0 1 324.428 4.113 20 0 DIADMN CCc1ncc(CNCc2ccc(-c3ccncc3)cc2)s1 ZINC000344473384 335251794 /nfs/dbraw/zinc/25/17/94/335251794.db2.gz LJJZPJMVLJWVEA-UHFFFAOYSA-N 0 1 309.438 4.057 20 0 DIADMN O=C(Nc1nc(C2CCC2)cs1)c1ccc(O)c(Cl)c1 ZINC000444522927 338474604 /nfs/dbraw/zinc/47/46/04/338474604.db2.gz CJDMZTIFXZHWJP-UHFFFAOYSA-N 0 1 308.790 4.022 20 0 DIADMN Cc1[nH]nc2cc(NC(=O)Cc3c(C)oc4ccccc43)ccc12 ZINC000344559932 335258312 /nfs/dbraw/zinc/25/83/12/335258312.db2.gz YSSODYILSQWDQV-UHFFFAOYSA-N 0 1 319.364 4.107 20 0 DIADMN CC(C)n1cc(CN[C@H](C)c2ccc(C(F)(F)F)cc2)cn1 ZINC000190902985 335273720 /nfs/dbraw/zinc/27/37/20/335273720.db2.gz SZGNLPSDDXMTDG-GFCCVEGCSA-N 0 1 311.351 4.334 20 0 DIADMN CC1(C)CN(Cc2cnc([C@@H]3CCCO3)s2)CC(C)(C)C1 ZINC000344889022 335282979 /nfs/dbraw/zinc/28/29/79/335282979.db2.gz KYFPGDFVFFXDMN-AWEZNQCLSA-N 0 1 308.491 4.253 20 0 DIADMN C[C@H]1C[C@H](c2ccccc2)CCN1Cc1nnc(-c2ccco2)o1 ZINC000366884215 335286105 /nfs/dbraw/zinc/28/61/05/335286105.db2.gz NFLDZFBHDKKNAL-GOEBONIOSA-N 0 1 323.396 4.098 20 0 DIADMN COc1ccccc1CN[C@@H]1CC(C)(C)Oc2cc(F)ccc21 ZINC000345005183 335290881 /nfs/dbraw/zinc/29/08/81/335290881.db2.gz AEKFUGIYONHYAJ-MRXNPFEDSA-N 0 1 315.388 4.226 20 0 DIADMN Cc1cnn(-c2ccncc2NCc2c(C)oc3ccccc32)c1 ZINC000345013666 335291312 /nfs/dbraw/zinc/29/13/12/335291312.db2.gz NPABMKKRJCXXHZ-UHFFFAOYSA-N 0 1 318.380 4.242 20 0 DIADMN CCc1cnccc1[C@@H](C)NCc1c(C)nn(C(C)(C)C)c1C ZINC000345195957 335306906 /nfs/dbraw/zinc/30/69/06/335306906.db2.gz DSBVRIHNAOOXPC-CYBMUJFWSA-N 0 1 314.477 4.063 20 0 DIADMN CC[C@@H]1CCCC[C@H]1NCc1noc(-c2ccc(F)cc2F)n1 ZINC000444631604 338477395 /nfs/dbraw/zinc/47/73/95/338477395.db2.gz MFQIJTVERWAMEM-IAQYHMDHSA-N 0 1 321.371 4.073 20 0 DIADMN CC[C@@H]1CCCC[C@@H]1NCc1noc(-c2ccc(F)cc2F)n1 ZINC000444631601 338477434 /nfs/dbraw/zinc/47/74/34/338477434.db2.gz MFQIJTVERWAMEM-ABAIWWIYSA-N 0 1 321.371 4.073 20 0 DIADMN Cc1n[nH]c(C(F)F)c1NC(=O)c1ccc(-c2ccccc2)o1 ZINC000345267161 335312989 /nfs/dbraw/zinc/31/29/89/335312989.db2.gz PFAQKRPIYAXMKT-UHFFFAOYSA-N 0 1 317.295 4.168 20 0 DIADMN Cc1c([C@H](C)NCc2ccc3ccccc3n2)cnn1C(C)C ZINC000345285295 335313480 /nfs/dbraw/zinc/31/34/80/335313480.db2.gz UGDWQYVBOYUZOY-AWEZNQCLSA-N 0 1 308.429 4.171 20 0 DIADMN CC[C@H](NCc1cn2cc(Cl)ccc2n1)c1ccc(F)cc1 ZINC000113330728 335324943 /nfs/dbraw/zinc/32/49/43/335324943.db2.gz VRKKDZLVLFQXMH-INIZCTEOSA-N 0 1 317.795 4.368 20 0 DIADMN Cc1ncc(CN[C@H]2C[C@H]3CCC(C)(C)c4cccc2c43)cn1 ZINC000345700401 335343161 /nfs/dbraw/zinc/34/31/61/335343161.db2.gz BYNWMKXAYKXPSU-QAPCUYQASA-N 0 1 307.441 4.175 20 0 DIADMN Cc1ncc(CN[C@H]2C[C@@H]3CCC(C)(C)c4cccc2c43)cn1 ZINC000345700402 335343217 /nfs/dbraw/zinc/34/32/17/335343217.db2.gz BYNWMKXAYKXPSU-YJBOKZPZSA-N 0 1 307.441 4.175 20 0 DIADMN COc1cc(C)c(NC(=O)c2cc(C)cc3cn[nH]c32)c(C)c1C ZINC000345895276 335359162 /nfs/dbraw/zinc/35/91/62/335359162.db2.gz BNLCQKJBSZSEDG-UHFFFAOYSA-N 0 1 323.396 4.057 20 0 DIADMN C[N@@H+](Cc1cc2ccccc2o1)Cc1cc(-n2ccnc2)cs1 ZINC000346168505 335384732 /nfs/dbraw/zinc/38/47/32/335384732.db2.gz LHKXXSPMFFOQFD-UHFFFAOYSA-N 0 1 323.421 4.312 20 0 DIADMN COc1ccc(C2(N[C@H](C)c3sc(C)nc3C)CC2)cc1 ZINC000346745803 335433846 /nfs/dbraw/zinc/43/38/46/335433846.db2.gz ZGSWIFLSAUNJSU-GFCCVEGCSA-N 0 1 302.443 4.108 20 0 DIADMN Fc1ccc2c(c1)OCCC[C@@H]2N[C@@H]1CCc2c1cccc2F ZINC000347333119 335486978 /nfs/dbraw/zinc/48/69/78/335486978.db2.gz IXLHSUOVVXXWCQ-ZWKOTPCHSA-N 0 1 315.363 4.456 20 0 DIADMN Cc1cc(CN[C@@H]2CCCOc3c(F)cccc32)cc(C)c1O ZINC000348118369 335549174 /nfs/dbraw/zinc/54/91/74/335549174.db2.gz PLFOAOSUFAQZTQ-QGZVFWFLSA-N 0 1 315.388 4.152 20 0 DIADMN Cc1cc([C@@H](C)N[C@@H](C)C(=O)Nc2ccc(C)c(F)c2)c(C)o1 ZINC000348093224 335552557 /nfs/dbraw/zinc/55/25/57/335552557.db2.gz BKWUEGJVJOXDQS-OLZOCXBDSA-N 0 1 318.392 4.022 20 0 DIADMN C[C@@H](N[C@@H](CO)c1ccsc1)c1ccccc1C(F)(F)F ZINC000348170343 335560137 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CCc1ccc(-c2nc(CN[C@]3(C)CCO[C@H]3C)cs2)cc1 ZINC000494205332 339943661 /nfs/dbraw/zinc/94/36/61/339943661.db2.gz PHBMGYXNXHQMTC-SCLBCKFNSA-N 0 1 316.470 4.030 20 0 DIADMN C[C@H]1OCC[C@@]1(C)NCc1nc(-c2ccccc2Cl)cs1 ZINC000494258399 339944937 /nfs/dbraw/zinc/94/49/37/339944937.db2.gz ZRCUCULAOBAQTI-BDJLRTHQSA-N 0 1 322.861 4.121 20 0 DIADMN COc1cccc(Cl)c1CN[C@@H](C)[C@@H](OC)c1ccccc1 ZINC000494498497 339951630 /nfs/dbraw/zinc/95/16/30/339951630.db2.gz VKUACWXPZYTXEU-SCLBCKFNSA-N 0 1 319.832 4.214 20 0 DIADMN COC[C@H](NC1(c2ccc(F)cc2)CC1)c1ccc(Cl)cc1 ZINC000494643864 339956446 /nfs/dbraw/zinc/95/64/46/339956446.db2.gz VUHZYDVEKAGZDS-KRWDZBQOSA-N 0 1 319.807 4.446 20 0 DIADMN CCN(CC)[C@@H](CNC(=O)C1(C)CCC1)c1ccccc1Cl ZINC000495210228 339978878 /nfs/dbraw/zinc/97/88/78/339978878.db2.gz CGQAYHDOZXRMMJ-INIZCTEOSA-N 0 1 322.880 4.029 20 0 DIADMN Cc1csc([C@H](NCCO[C@@H]2CCCC[C@H]2C)C2CC2)n1 ZINC000495464728 339985461 /nfs/dbraw/zinc/98/54/61/339985461.db2.gz FGIYFXMTOSDSMH-DAXOMENPSA-N 0 1 308.491 4.088 20 0 DIADMN CC(C)[C@H](Cc1ccc(F)cc1)NCc1ncc(C(C)(C)C)o1 ZINC000495484951 339985764 /nfs/dbraw/zinc/98/57/64/339985764.db2.gz QOJBBIFZCAEBIA-INIZCTEOSA-N 0 1 318.436 4.468 20 0 DIADMN Cc1cccc2nc(CNC(=O)C3(CC(C)C)CCCC3)[nH]c21 ZINC000498608641 340020926 /nfs/dbraw/zinc/02/09/26/340020926.db2.gz XKXGYPWAFXMIPY-UHFFFAOYSA-N 0 1 313.445 4.094 20 0 DIADMN CCC[C@@](C)(O)CN[C@H](c1cc2ccccc2o1)c1cccnc1 ZINC000498916712 340025827 /nfs/dbraw/zinc/02/58/27/340025827.db2.gz LGYOVMZGVODUCN-VQTJNVASSA-N 0 1 324.424 4.058 20 0 DIADMN Cc1cccc(NC(=O)[C@@H](C)N2CCCc3ccccc3C2)c1C ZINC000498917691 340025845 /nfs/dbraw/zinc/02/58/45/340025845.db2.gz YBJHAJXKYGCEJK-QGZVFWFLSA-N 0 1 322.452 4.079 20 0 DIADMN CCOc1cc(C)ccc1CN[C@H](c1ccc(F)cn1)C(C)C ZINC000498925562 340026079 /nfs/dbraw/zinc/02/60/79/340026079.db2.gz RSIFQTWGHBRDLL-IBGZPJMESA-N 0 1 316.420 4.415 20 0 DIADMN c1c2ccccc2oc1[C@@H](NC[C@H]1CCCS1)c1cccnc1 ZINC000498951409 340026882 /nfs/dbraw/zinc/02/68/82/340026882.db2.gz MCEJYGTTWYTGID-APWZRJJASA-N 0 1 324.449 4.402 20 0 DIADMN Cc1cc(NC(=O)c2cccc3cn[nH]c32)ccc1C(F)(F)F ZINC000499346837 340035197 /nfs/dbraw/zinc/03/51/97/340035197.db2.gz BTWYUAXOQUFOQB-UHFFFAOYSA-N 0 1 319.286 4.142 20 0 DIADMN C[C@H]1COC[C@H](c2ccccc2)N1CCCCC1CCOCC1 ZINC000499600759 340040427 /nfs/dbraw/zinc/04/04/27/340040427.db2.gz RAQIWODWTXBTJJ-FXAWDEMLSA-N 0 1 317.473 4.045 20 0 DIADMN CC(C)[C@H](NCc1ccnn1C(C)C)c1ccc(F)cc1F ZINC000499606621 340040521 /nfs/dbraw/zinc/04/05/21/340040521.db2.gz OTYZIZQSUHWDJZ-KRWDZBQOSA-N 0 1 307.388 4.229 20 0 DIADMN COc1cccc([C@@H]2C[C@H](C)CN2Cc2ccnn2C(C)C)c1 ZINC000499622665 340041397 /nfs/dbraw/zinc/04/13/97/340041397.db2.gz APQAAUXPQRCOOJ-KXBFYZLASA-N 0 1 313.445 4.056 20 0 DIADMN COc1cccc(-c2noc([C@@H](C)NCCCC(C)(C)C)n2)c1 ZINC000499627450 340041575 /nfs/dbraw/zinc/04/15/75/340041575.db2.gz UEXPTMYNLMDPPC-CYBMUJFWSA-N 0 1 317.433 4.222 20 0 DIADMN CSc1ccc([C@H](C)NCC(=O)Nc2cccc(C)c2)cc1 ZINC000500228027 340053492 /nfs/dbraw/zinc/05/34/92/340053492.db2.gz VZCUFASDZYGIHX-AWEZNQCLSA-N 0 1 314.454 4.006 20 0 DIADMN COc1cc(NCc2cnc(-c3ccccc3)[nH]2)c(C)c(OC)c1 ZINC000500401998 340056898 /nfs/dbraw/zinc/05/68/98/340056898.db2.gz KJMUJWCFIKDQPH-UHFFFAOYSA-N 0 1 323.396 4.014 20 0 DIADMN CCc1ncc(CN[C@@]2(c3ccc(Cl)cc3)C[C@H]2C)s1 ZINC000500405399 340057030 /nfs/dbraw/zinc/05/70/30/340057030.db2.gz RDHUOYFGPWGHMN-BZNIZROVSA-N 0 1 306.862 4.384 20 0 DIADMN C[C@H]1C[C@]1(NCc1cc(O)cc(F)c1)c1ccc(Cl)cc1 ZINC000500431000 340058479 /nfs/dbraw/zinc/05/84/79/340058479.db2.gz WKIGTMNFXHXUQX-APPDUMDISA-N 0 1 305.780 4.210 20 0 DIADMN COc1ccc(OC)c(CNc2ccnc3cc(F)ccc32)c1 ZINC000500456733 340059359 /nfs/dbraw/zinc/05/93/59/340059359.db2.gz LORWCZOZIKCWEJ-UHFFFAOYSA-N 0 1 312.344 4.003 20 0 DIADMN CN(CCOc1ccccc1F)c1ccnc2cc(F)ccc21 ZINC000500456919 340059496 /nfs/dbraw/zinc/05/94/96/340059496.db2.gz MKJOKCDFDHWPKY-UHFFFAOYSA-N 0 1 314.335 4.028 20 0 DIADMN Cc1nc(C)c(CN[C@]2(c3ccc(Cl)cc3)C[C@H]2C)s1 ZINC000500461912 340059542 /nfs/dbraw/zinc/05/95/42/340059542.db2.gz KTSFIXAOVWOUEJ-QLJPJBMISA-N 0 1 306.862 4.438 20 0 DIADMN Fc1ccc(OCCNc2ccnc3cc(F)ccc32)cc1 ZINC000500466238 340059884 /nfs/dbraw/zinc/05/98/84/340059884.db2.gz RRZRSUHXMZSKBI-UHFFFAOYSA-N 0 1 300.308 4.004 20 0 DIADMN CC[C@H]1C[C@]1(NCc1cnn(CC(C)C)c1)c1cccc(C)c1 ZINC000500482167 340060210 /nfs/dbraw/zinc/06/02/10/340060210.db2.gz BPJKRKSBAHIZPE-AZUAARDMSA-N 0 1 311.473 4.263 20 0 DIADMN CCc1ncc(CN[C@@]2(c3cccc(C)c3)C[C@H]2CC)s1 ZINC000500488149 340060382 /nfs/dbraw/zinc/06/03/82/340060382.db2.gz XBYLPYWEAOESCD-KDOFPFPSSA-N 0 1 300.471 4.429 20 0 DIADMN CC[C@@H]1C[C@]1(NCc1cn2ccccc2n1)c1cccc(C)c1 ZINC000500494690 340060648 /nfs/dbraw/zinc/06/06/48/340060648.db2.gz DXWVLVDWSZVJEM-OXQOHEQNSA-N 0 1 305.425 4.058 20 0 DIADMN CC[C@H]1C[C@@]1(NCc1sccc1OC)c1cccc(C)c1 ZINC000500538209 340061809 /nfs/dbraw/zinc/06/18/09/340061809.db2.gz VNOGEGRLDBDASQ-KSSFIOAISA-N 0 1 301.455 4.480 20 0 DIADMN CC(C)COCCN1CCc2sccc2[C@H]1c1cccs1 ZINC000500951731 340070812 /nfs/dbraw/zinc/07/08/12/340070812.db2.gz YVCBNVVUOSSKNO-KRWDZBQOSA-N 0 1 321.511 4.430 20 0 DIADMN Cc1csc(C2(NCCSC3CCCCC3)CCC2)n1 ZINC000501065344 340073567 /nfs/dbraw/zinc/07/35/67/340073567.db2.gz XNYRCQGULXVRCN-UHFFFAOYSA-N 0 1 310.532 4.486 20 0 DIADMN CC[C@H](Cc1ccccc1)N(CC)C(=O)c1cccc2c[nH]nc21 ZINC000501274840 340077826 /nfs/dbraw/zinc/07/78/26/340077826.db2.gz LKNSMESTLITFHT-QGZVFWFLSA-N 0 1 321.424 4.046 20 0 DIADMN C[C@@H]1CCN(Cc2nc3cc(C(F)(F)F)ccc3o2)C[C@@H]1C ZINC000501773294 340088316 /nfs/dbraw/zinc/08/83/16/340088316.db2.gz IHPCXJLMGDUFNM-MNOVXSKESA-N 0 1 312.335 4.325 20 0 DIADMN C[C@H]1CN(CC(=O)Nc2ccccc2-c2ccccc2)CC[C@@H]1C ZINC000501778845 340088518 /nfs/dbraw/zinc/08/85/18/340088518.db2.gz VVIKHPXWMJVESP-IRXDYDNUSA-N 0 1 322.452 4.270 20 0 DIADMN FC(F)(F)Oc1ccc(CN2CCc3sccc3C2)cc1 ZINC000501780854 340088753 /nfs/dbraw/zinc/08/87/53/340088753.db2.gz HLEMIBTWTXBSIJ-UHFFFAOYSA-N 0 1 313.344 4.205 20 0 DIADMN Cc1cccc(C(C)C)c1NC(=O)[C@H](C)N1CC[C@H](C)[C@H](C)C1 ZINC000501788102 340088833 /nfs/dbraw/zinc/08/88/33/340088833.db2.gz DEDFBTGXIKZFBA-UAGQMJEPSA-N 0 1 316.489 4.423 20 0 DIADMN CCc1sc(-c2nnc(CN3CC[C@@H](C)[C@H](C)C3)o2)cc1C ZINC000501807753 340089238 /nfs/dbraw/zinc/08/92/38/340089238.db2.gz YSCPRVOLXJLCFH-DGCLKSJQSA-N 0 1 319.474 4.147 20 0 DIADMN CCc1cccc(CC)c1NC(=O)[C@H](C)N1CC[C@H](C)[C@@H](C)C1 ZINC000501812289 340089404 /nfs/dbraw/zinc/08/94/04/340089404.db2.gz FNNJDYSMIRRLLJ-JYJNAYRXSA-N 0 1 316.489 4.116 20 0 DIADMN Cc1cc([C@@H]2CN(c3ccnc(C)c3Cl)CCO2)ccc1F ZINC000501984799 340092091 /nfs/dbraw/zinc/09/20/91/340092091.db2.gz FRCUMHUBNVSDLZ-INIZCTEOSA-N 0 1 320.795 4.069 20 0 DIADMN C[C@H](NCCOc1cccc(Cl)c1)c1nc2c(s1)CCC2 ZINC000502019807 340093160 /nfs/dbraw/zinc/09/31/60/340093160.db2.gz STBOOLSNGFCJEB-NSHDSACASA-N 0 1 322.861 4.015 20 0 DIADMN C[C@H](NCCOc1ccccc1Cl)c1nc2c(s1)CCC2 ZINC000502052308 340094212 /nfs/dbraw/zinc/09/42/12/340094212.db2.gz OFSVDOQBORBAIE-NSHDSACASA-N 0 1 322.861 4.015 20 0 DIADMN CC(C)(C)c1ccc(NC(=O)c2cccc(-c3nnc[nH]3)c2)cc1 ZINC000502256176 340098049 /nfs/dbraw/zinc/09/80/49/340098049.db2.gz WHIVKUSWHHRMNG-UHFFFAOYSA-N 0 1 320.396 4.022 20 0 DIADMN CCOc1ccccc1CN[C@H](C)c1cnn(C2CCCC2)c1 ZINC000502441979 340103701 /nfs/dbraw/zinc/10/37/01/340103701.db2.gz HOQQTSUBAXLKEI-OAHLLOKOSA-N 0 1 313.445 4.248 20 0 DIADMN CC[C@@H]1C[C@@]1(NCc1cn2cc(C)ccc2n1)c1cccc(C)c1 ZINC000502486753 340105767 /nfs/dbraw/zinc/10/57/67/340105767.db2.gz RZIJTWDYAPYBDW-UTKZUKDTSA-N 0 1 319.452 4.366 20 0 DIADMN Cc1cccc2nc(CN[C@@H](c3ccc(F)cc3)C(C)C)cn21 ZINC000502488408 340105951 /nfs/dbraw/zinc/10/59/51/340105951.db2.gz RWOOAXOEFYSAAZ-LJQANCHMSA-N 0 1 311.404 4.269 20 0 DIADMN CC[C@@H]1C[C@]1(NCc1nc2cccnc2s1)c1cccc(C)c1 ZINC000502511166 340106498 /nfs/dbraw/zinc/10/64/98/340106498.db2.gz SFCRTAPILRCYGE-AUUYWEPGSA-N 0 1 323.465 4.415 20 0 DIADMN Cc1ccc2nc(CN[C@H](c3ccc(F)cc3)C(C)C)cn2c1 ZINC000502562752 340107850 /nfs/dbraw/zinc/10/78/50/340107850.db2.gz IKATWDGMWGLCMG-IBGZPJMESA-N 0 1 311.404 4.269 20 0 DIADMN COC(=O)c1ccc([C@H](C)N[C@H](c2ccc(F)cc2)C(C)C)o1 ZINC000502580767 340108383 /nfs/dbraw/zinc/10/83/83/340108383.db2.gz JEOHHBVYGJUCRK-SJCJKPOMSA-N 0 1 319.376 4.253 20 0 DIADMN CC[C@H]1C[C@@]1(NCc1ncc(C)c(OC)c1C)c1cccc(C)c1 ZINC000502580268 340108425 /nfs/dbraw/zinc/10/84/25/340108425.db2.gz SUMXCIRXSAZVFL-UWJYYQICSA-N 0 1 324.468 4.430 20 0 DIADMN COC(=O)c1ccc([C@H](C)N[C@@H](c2ccc(F)cc2)C(C)C)o1 ZINC000502580769 340108429 /nfs/dbraw/zinc/10/84/29/340108429.db2.gz JEOHHBVYGJUCRK-YVEFUNNKSA-N 0 1 319.376 4.253 20 0 DIADMN C[C@@H](N[C@H]1CSc2ccccc21)c1cnn(C2CCCC2)c1 ZINC000502687578 340110552 /nfs/dbraw/zinc/11/05/52/340110552.db2.gz PSTGROKZIFYUOV-DYVFJYSZSA-N 0 1 313.470 4.496 20 0 DIADMN CCOc1cccc(CN[C@@H](C)c2cnn(C3CCCC3)c2)c1 ZINC000502696400 340111076 /nfs/dbraw/zinc/11/10/76/340111076.db2.gz DVAGZKJJVFAJCA-HNNXBMFYSA-N 0 1 313.445 4.248 20 0 DIADMN CCOc1ccc(CN[C@H](C)c2cnn(C3CCCC3)c2)cc1 ZINC000502726202 340112411 /nfs/dbraw/zinc/11/24/11/340112411.db2.gz ZHNRSMBTLKRAQE-OAHLLOKOSA-N 0 1 313.445 4.248 20 0 DIADMN Cc1ccc(-c2n[nH]c(SCc3c(F)cccc3F)n2)cc1 ZINC000502883690 340115421 /nfs/dbraw/zinc/11/54/21/340115421.db2.gz UCGKZJMUABUULG-UHFFFAOYSA-N 0 1 317.364 4.351 20 0 DIADMN C[C@@H](c1ccccc1Cl)N(CCO[C@H]1CCCCO1)C1CC1 ZINC000502884012 340115636 /nfs/dbraw/zinc/11/56/36/340115636.db2.gz BCJDLZAEKSOVJQ-KSSFIOAISA-N 0 1 323.864 4.409 20 0 DIADMN CCC[C@@]1(C)CCCN([C@H](C)C(=O)c2c[nH]c3ncccc23)C1 ZINC000502888674 340115770 /nfs/dbraw/zinc/11/57/70/340115770.db2.gz QTURIRLPZGECIU-KUHUBIRLSA-N 0 1 313.445 4.036 20 0 DIADMN CCN(C)[C@H](C(=O)N[C@@H](C)c1cc(C)cc(C)c1)c1ccccc1 ZINC000502986310 340118087 /nfs/dbraw/zinc/11/80/87/340118087.db2.gz XOFZJDPJDYSBBA-PXNSSMCTSA-N 0 1 324.468 4.174 20 0 DIADMN CCCCCn1cc(CNCc2ccc(F)cc2C)c(C)n1 ZINC000503243113 340123709 /nfs/dbraw/zinc/12/37/09/340123709.db2.gz FYHKPOWOEVXVFS-UHFFFAOYSA-N 0 1 303.425 4.119 20 0 DIADMN Cc1cc([C@H](C)NCCCc2cccc(C(F)(F)F)c2)no1 ZINC000503238698 340123728 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COCC[C@@H](NCc1ccnc2ccccc12)c1ccc(C)o1 ZINC000539771378 340899254 /nfs/dbraw/zinc/89/92/54/340899254.db2.gz OGIPDMFCVJYFSV-GOSISDBHSA-N 0 1 310.397 4.004 20 0 DIADMN CCc1ccc([C@@H](C)NCc2cccc(Br)c2)o1 ZINC000540141979 340916532 /nfs/dbraw/zinc/91/65/32/340916532.db2.gz MMOYULOZSGTUFN-LLVKDONJSA-N 0 1 308.219 4.455 20 0 DIADMN C[C@H](N[C@H](c1cccnc1)C1CC1)c1cc(F)c(F)c(F)c1 ZINC000540151808 340917735 /nfs/dbraw/zinc/91/77/35/340917735.db2.gz QPZMICASARWMLK-BTDLBPIBSA-N 0 1 306.331 4.301 20 0 DIADMN Cc1cc(C)c([C@@H](C)NCc2cn3c(cccc3C)n2)cc1C ZINC000540182438 340921366 /nfs/dbraw/zinc/92/13/66/340921366.db2.gz LMCRAFHUJQXZRR-QGZVFWFLSA-N 0 1 307.441 4.419 20 0 DIADMN COc1ccc([C@H](NCc2ccc(OC)cc2F)C2CC2)cc1 ZINC000540314934 340926435 /nfs/dbraw/zinc/92/64/35/340926435.db2.gz CCRABMUIIKWAGR-LJQANCHMSA-N 0 1 315.388 4.084 20 0 DIADMN CCc1noc(C)c1CN[C@@H](C)c1cccc(OC(C)C)c1 ZINC000540328580 340927303 /nfs/dbraw/zinc/92/73/03/340927303.db2.gz YDRAYPCFZCTDND-ZDUSSCGKSA-N 0 1 302.418 4.183 20 0 DIADMN COC(=O)c1ccc([C@H](C)N[C@@H](C)c2cccc(C)c2C)o1 ZINC000540386736 340929063 /nfs/dbraw/zinc/92/90/63/340929063.db2.gz DSNSHQZCQPMNAV-KBPBESRZSA-N 0 1 301.386 4.095 20 0 DIADMN Cc1ccncc1CNC(C)(c1ccccc1)c1ccccc1 ZINC000540404990 340929859 /nfs/dbraw/zinc/92/98/59/340929859.db2.gz UFCNLKQGYZQQKU-UHFFFAOYSA-N 0 1 302.421 4.443 20 0 DIADMN Fc1ccc([C@@H](NCCc2cccc(F)c2)c2ccccn2)cc1 ZINC000541552310 340973984 /nfs/dbraw/zinc/97/39/84/340973984.db2.gz FFHWLUOGRUQVSI-HXUWFJFHSA-N 0 1 324.374 4.282 20 0 DIADMN Fc1ccc([C@H](NC[C@H]2CCCCS2)c2ccccc2)nc1 ZINC000541568552 340975111 /nfs/dbraw/zinc/97/51/11/340975111.db2.gz WEXOZIFYRZMUDD-SJLPKXTDSA-N 0 1 316.445 4.185 20 0 DIADMN Cc1nc(C2(NC[C@@H](C)Cc3ccccc3)CCCCC2)no1 ZINC000541586519 340976029 /nfs/dbraw/zinc/97/60/29/340976029.db2.gz YHCRDAUXWMUOQP-HNNXBMFYSA-N 0 1 313.445 4.006 20 0 DIADMN CCn1c(CNC(C)(C)c2cccs2)nc2cc(F)ccc21 ZINC000541641278 340979056 /nfs/dbraw/zinc/97/90/56/340979056.db2.gz UIRCCYJYLFGALU-UHFFFAOYSA-N 0 1 317.433 4.282 20 0 DIADMN C[C@H](NCC/C=C\c1ccc(Br)cc1)c1ccon1 ZINC000541719031 340980904 /nfs/dbraw/zinc/98/09/04/340980904.db2.gz VYPXXLDQAKGOQT-QQHVMHFCSA-N 0 1 321.218 4.191 20 0 DIADMN CC[C@H](N[C@@H](C)c1ccc(-c2cccnc2)cc1)c1ccn(C)n1 ZINC000541733444 340981281 /nfs/dbraw/zinc/98/12/81/340981281.db2.gz VOTADJUGOWSXHX-KXBFYZLASA-N 0 1 320.440 4.284 20 0 DIADMN Cc1oncc1CN[C@H](c1ccc(C(F)(F)F)cc1)C(C)C ZINC000129943375 340989338 /nfs/dbraw/zinc/98/93/38/340989338.db2.gz AIHUYUHYOJDVKX-HNNXBMFYSA-N 0 1 312.335 4.489 20 0 DIADMN Cc1ccc(-c2nc(CN(C)C[C@H]3CC=CCC3)cs2)o1 ZINC000542245282 341001725 /nfs/dbraw/zinc/00/17/25/341001725.db2.gz CJFNSUMIYGEJSJ-AWEZNQCLSA-N 0 1 302.443 4.500 20 0 DIADMN COc1ccnc(CN[C@@H](c2cccc(F)c2)C2CCCC2)c1 ZINC000542253308 341002024 /nfs/dbraw/zinc/00/20/24/341002024.db2.gz JSTDTDAKCMLWQO-LJQANCHMSA-N 0 1 314.404 4.250 20 0 DIADMN COc1ccnc(CN[C@H](c2cccc(F)c2)C2CCCC2)c1 ZINC000542253307 341002073 /nfs/dbraw/zinc/00/20/73/341002073.db2.gz JSTDTDAKCMLWQO-IBGZPJMESA-N 0 1 314.404 4.250 20 0 DIADMN C[C@H]1CN(Cc2ccc(Oc3ccccc3)nn2)CC(C)(C)C1 ZINC000542252866 341002134 /nfs/dbraw/zinc/00/21/34/341002134.db2.gz ARJBVZJSJUWLIU-OAHLLOKOSA-N 0 1 311.429 4.137 20 0 DIADMN C[C@@H]1CN(Cc2nnc(-c3cccc(Cl)c3)o2)CC(C)(C)C1 ZINC000542255328 341002230 /nfs/dbraw/zinc/00/22/30/341002230.db2.gz WPOLXFQWODIOHP-LBPRGKRZSA-N 0 1 319.836 4.258 20 0 DIADMN CS[C@H](CNCc1coc(-c2ccccc2)n1)C(C)(C)C ZINC000542312802 341004046 /nfs/dbraw/zinc/00/40/46/341004046.db2.gz DXJHEEFBFGWDNW-OAHLLOKOSA-N 0 1 304.459 4.209 20 0 DIADMN c1nc(CNCCn2c3ccccc3c3ccccc32)cs1 ZINC000542314701 341004312 /nfs/dbraw/zinc/00/43/12/341004312.db2.gz WCZYHCKRIICSEQ-UHFFFAOYSA-N 0 1 307.422 4.041 20 0 DIADMN Cc1cccc([C@@H]2CCN([C@H](C)C(=O)Nc3ccccc3C)C2)c1 ZINC000542321093 341004900 /nfs/dbraw/zinc/00/49/00/341004900.db2.gz ZOGIJDOVQVPPGK-IEBWSBKVSA-N 0 1 322.452 4.120 20 0 DIADMN Cc1ccc(CN[C@H](C)c2nc3c(s2)CCCC3)c(C)c1 ZINC000130239420 341008125 /nfs/dbraw/zinc/00/81/25/341008125.db2.gz 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/nfs/dbraw/zinc/01/11/86/341011186.db2.gz ZOTSDJNDWKBHFN-CYBMUJFWSA-N 0 1 316.470 4.217 20 0 DIADMN CC[C@H](NCC(=O)N(C)c1ccccc1)c1ccc(Cl)s1 ZINC000542558017 341013636 /nfs/dbraw/zinc/01/36/36/341013636.db2.gz WYCSMLRZAZGAOT-ZDUSSCGKSA-N 0 1 322.861 4.105 20 0 DIADMN CCc1ccc([C@@H](COC)NCCSc2ccc(F)cc2)o1 ZINC000542559554 341013653 /nfs/dbraw/zinc/01/36/53/341013653.db2.gz UNUOHDFBSPYLCA-MRXNPFEDSA-N 0 1 323.433 4.051 20 0 DIADMN CCOC(=O)c1sc([C@H](C)NCCCC2CCCC2)nc1C ZINC000542615484 341015152 /nfs/dbraw/zinc/01/51/52/341015152.db2.gz VBBYSASOGBBOAY-ZDUSSCGKSA-N 0 1 324.490 4.249 20 0 DIADMN C[C@@H](NCCCOc1cccc(C(C)(C)C)c1)c1ccon1 ZINC000542647422 341015529 /nfs/dbraw/zinc/01/55/29/341015529.db2.gz FZLCGFNRQZEBMI-CQSZACIVSA-N 0 1 302.418 4.092 20 0 DIADMN CC(C)[C@H](C)CN[C@@H](c1ccn(C)n1)c1ccc(Cl)cc1 ZINC000542663447 341015927 /nfs/dbraw/zinc/01/59/27/341015927.db2.gz GJFNIRBEKHJQGU-CXAGYDPISA-N 0 1 305.853 4.045 20 0 DIADMN CCCC[C@@H](N[C@H](CC)c1ccn(C)n1)c1ccc(OC)cc1 ZINC000542668860 341016440 /nfs/dbraw/zinc/01/64/40/341016440.db2.gz REZRKCXREGVMRW-QZTJIDSGSA-N 0 1 315.461 4.401 20 0 DIADMN Fc1ccc(/C=C/CN2CCC[C@@H]2c2ccccn2)c(F)c1 ZINC000542703591 341018164 /nfs/dbraw/zinc/01/81/64/341018164.db2.gz RLTZMGAEWUFUJG-YWPBOTNQSA-N 0 1 300.352 4.210 20 0 DIADMN Cc1cccc2c1OC[C@@H](N[C@@H](c1ccco1)c1ccccc1)C2 ZINC000564258985 341019804 /nfs/dbraw/zinc/01/98/04/341019804.db2.gz JUVRVKNHMQZWTQ-AZUAARDMSA-N 0 1 319.404 4.271 20 0 DIADMN Cc1cccc(Cl)c1NC(=O)C[N@H+](C)[C@@H]1CCC[C@H](C)C1 ZINC000130512526 341025287 /nfs/dbraw/zinc/02/52/87/341025287.db2.gz KARKFROAEXUWPQ-GXTWGEPZSA-N 0 1 308.853 4.097 20 0 DIADMN Fc1ccccc1C1(NCc2ccc(OC(F)F)cc2)CC1 ZINC000130536606 341026805 /nfs/dbraw/zinc/02/68/05/341026805.db2.gz KRJNBNLDSOUPDT-UHFFFAOYSA-N 0 1 307.315 4.206 20 0 DIADMN Cc1ccccc1-c1nc(CN2C[C@H](C)[C@@H]3CCCC[C@@H]32)no1 ZINC000542978855 341027717 /nfs/dbraw/zinc/02/77/17/341027717.db2.gz IRHCTUIXOOGVOC-ZOBUZTSGSA-N 0 1 311.429 4.056 20 0 DIADMN Clc1ccc([C@H](N[C@H]2CCOC2)c2ccccc2Cl)cc1 ZINC000543067651 341030404 /nfs/dbraw/zinc/03/04/04/341030404.db2.gz RKCVRHVZUFAOOS-YOEHRIQHSA-N 0 1 322.235 4.461 20 0 DIADMN CCc1cccc(CC)c1NC(=O)CN1C[C@H](C)CC(C)(C)C1 ZINC000543179359 341035378 /nfs/dbraw/zinc/03/53/78/341035378.db2.gz XNZHPZQFGAIQDC-OAHLLOKOSA-N 0 1 316.489 4.118 20 0 DIADMN CN(Cc1nc(-c2ccc(Cl)cc2)no1)C[C@H]1CC=CCC1 ZINC000543177758 341035448 /nfs/dbraw/zinc/03/54/48/341035448.db2.gz KBIAZOIXWLJZSB-ZDUSSCGKSA-N 0 1 317.820 4.178 20 0 DIADMN C[C@@]1(NCc2c(Cl)cccc2Cl)CCO[C@@H]1C1CC1 ZINC000543235775 341037431 /nfs/dbraw/zinc/03/74/31/341037431.db2.gz KMAZEUIMBQUCFJ-HUUCEWRRSA-N 0 1 300.229 4.041 20 0 DIADMN Cc1csc(CNCCn2c3ccccc3c3ccccc32)n1 ZINC000543244147 341037980 /nfs/dbraw/zinc/03/79/80/341037980.db2.gz SXBJHNQDCVSDRL-UHFFFAOYSA-N 0 1 321.449 4.349 20 0 DIADMN CCCOc1ccc(C[N@@H+](C)C[C@@H](C)c2nccs2)cc1 ZINC000543393001 341041520 /nfs/dbraw/zinc/04/15/20/341041520.db2.gz NLXJFCYLKITCGH-CQSZACIVSA-N 0 1 304.459 4.167 20 0 DIADMN COc1ccc(CCCN(C)Cc2ncc(C(C)C)s2)cc1 ZINC000543397318 341042033 /nfs/dbraw/zinc/04/20/33/341042033.db2.gz HMXMNJCFOYKIFU-UHFFFAOYSA-N 0 1 318.486 4.340 20 0 DIADMN CCCC(O)(CCC)CN[C@@H](c1ccco1)c1ccccc1 ZINC000543404353 341042485 /nfs/dbraw/zinc/04/24/85/341042485.db2.gz ZWDOISFUGWOJRT-GOSISDBHSA-N 0 1 301.430 4.290 20 0 DIADMN O=C(Nc1ccc(F)cc1)[C@H](NC1(C2CC2)CC1)c1ccccc1 ZINC000543455272 341045683 /nfs/dbraw/zinc/04/56/83/341045683.db2.gz VSIHPSRPQZKECE-GOSISDBHSA-N 0 1 324.399 4.038 20 0 DIADMN CCc1cccc(OCCN[C@H](CC)c2nc(C)cs2)c1 ZINC000543486378 341047228 /nfs/dbraw/zinc/04/72/28/341047228.db2.gz NNYYAQAMVDQTQM-MRXNPFEDSA-N 0 1 304.459 4.134 20 0 DIADMN CCc1nc([C@H](C)NCCCOc2ccccc2C)cs1 ZINC000543504471 341047745 /nfs/dbraw/zinc/04/77/45/341047745.db2.gz URNNXODNIWQSET-AWEZNQCLSA-N 0 1 304.459 4.134 20 0 DIADMN CCc1nc([C@H](C)NCCCOc2ccc(C)c(C)c2)cs1 ZINC000543505491 341047989 /nfs/dbraw/zinc/04/79/89/341047989.db2.gz JEATVUKZNCMYBI-HNNXBMFYSA-N 0 1 318.486 4.442 20 0 DIADMN 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CC(C)c1cc(C(=O)N2CCC[C@H]2CC2CCCCC2)n[nH]1 ZINC000520300845 1043033247 /nfs/dbraw/zinc/03/32/47/1043033247.db2.gz PRYYRAVJHSMFFU-HNNXBMFYSA-N 0 1 303.450 4.108 20 0 DIADMN CC(C)N(Cc1ccccc1F)Cc1ccccc1N(C)C ZINC000441272820 1043033582 /nfs/dbraw/zinc/03/35/82/1043033582.db2.gz AJRIQGATXVMAPP-UHFFFAOYSA-N 0 1 300.421 4.302 20 0 DIADMN COC(=O)c1oc([C@@H](C)N(C)Cc2ccc(Cl)cc2)cc1C ZINC000441329895 1043037211 /nfs/dbraw/zinc/03/72/11/1043037211.db2.gz YRGJZMWIZGMKRW-GFCCVEGCSA-N 0 1 321.804 4.221 20 0 DIADMN COC(=O)c1oc([C@H](C)N(C)Cc2ccc(Cl)cc2)cc1C ZINC000441329896 1043037231 /nfs/dbraw/zinc/03/72/31/1043037231.db2.gz YRGJZMWIZGMKRW-LBPRGKRZSA-N 0 1 321.804 4.221 20 0 DIADMN CC[C@@H](Cc1ccc(C)cc1)N(C)Cc1nc(CC(C)C)no1 ZINC000441350037 1043038441 /nfs/dbraw/zinc/03/84/41/1043038441.db2.gz GXUBBFBNEXDEKN-KRWDZBQOSA-N 0 1 315.461 4.030 20 0 DIADMN CO[C@@H]1CCN(Cc2cc(Cl)ccc2OCC2CC2)[C@@H](C)C1 ZINC000441343528 1043039639 /nfs/dbraw/zinc/03/96/39/1043039639.db2.gz AAWSYBCOOPPJSS-SUMWQHHRSA-N 0 1 323.864 4.128 20 0 DIADMN CO[C@@H]1CCN(CCc2cc(Cl)cc(Cl)c2)[C@@H](C)C1 ZINC000441363618 1043040025 /nfs/dbraw/zinc/04/00/25/1043040025.db2.gz XRTUXCHIGGOHOQ-XHDPSFHLSA-N 0 1 302.245 4.035 20 0 DIADMN CC(C)c1ccc([C@H](NC(=O)CN(C)C2CCC2)C(C)C)cc1 ZINC000441366177 1043040429 /nfs/dbraw/zinc/04/04/29/1043040429.db2.gz DBQFILOFPOHNGW-HXUWFJFHSA-N 0 1 316.489 4.108 20 0 DIADMN N=C(N)N(c1ccc(F)cc1)c1ccc(Oc2ccccc2)nc1 ZINC001167992023 1043052119 /nfs/dbraw/zinc/05/21/19/1043052119.db2.gz NWZOUOXITPHKJS-UHFFFAOYSA-N 0 1 322.343 4.045 20 0 DIADMN Cc1ccc(C)c(CNCc2sccc2Br)c1 ZINC000112838516 1043060235 /nfs/dbraw/zinc/06/02/35/1043060235.db2.gz ILUVNPSFBJCUBV-UHFFFAOYSA-N 0 1 310.260 4.417 20 0 DIADMN Cc1ccc(CNCc2cc3ccnc(Cl)c3s2)nc1C ZINC000894987101 1043062035 /nfs/dbraw/zinc/06/20/35/1043062035.db2.gz SWNRWOBDASRHOB-UHFFFAOYSA-N 0 1 317.845 4.251 20 0 DIADMN COCc1ccc(CNC2(c3nc(C)cs3)CCCC2)cc1 ZINC000174385271 1043066302 /nfs/dbraw/zinc/06/63/02/1043066302.db2.gz OXWDUBNBODZMMC-UHFFFAOYSA-N 0 1 316.470 4.157 20 0 DIADMN CC[C@@](C)(NCc1cccc2cccnc21)c1nc(C)cs1 ZINC000174502332 1043067081 /nfs/dbraw/zinc/06/70/81/1043067081.db2.gz KXXUWZIYSSHRIA-GOSISDBHSA-N 0 1 311.454 4.415 20 0 DIADMN CC[C@@](C)(NCc1ccc(COC)cc1)c1nc(C)cs1 ZINC000174498835 1043067333 /nfs/dbraw/zinc/06/73/33/1043067333.db2.gz SEOCHPWLGNNRNK-QGZVFWFLSA-N 0 1 304.459 4.013 20 0 DIADMN CC[C@](C)(NCc1ccc(COC)cc1)c1nc(C)cs1 ZINC000174498823 1043067421 /nfs/dbraw/zinc/06/74/21/1043067421.db2.gz SEOCHPWLGNNRNK-KRWDZBQOSA-N 0 1 304.459 4.013 20 0 DIADMN Fc1cccc(C2(NCc3ccccc3Cl)CCOCC2)c1 ZINC000174645945 1043069715 /nfs/dbraw/zinc/06/97/15/1043069715.db2.gz UDVPJFYFFZEJDA-UHFFFAOYSA-N 0 1 319.807 4.275 20 0 DIADMN CC(C)c1nnc(-c2ccccc2NC(=O)C=CC2CCCC2)[nH]1 ZINC000843771684 1043071191 /nfs/dbraw/zinc/07/11/91/1043071191.db2.gz MWUZYKIPFSOECU-VAWYXSNFSA-N 0 1 324.428 4.280 20 0 DIADMN C[C@H](N[C@H]1CCCC[C@H]1C)c1nc(Cc2ccc(F)cc2)no1 ZINC000124062997 1043072398 /nfs/dbraw/zinc/07/23/98/1043072398.db2.gz 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/nfs/dbraw/zinc/09/30/45/1043093045.db2.gz QHJMBEGOHWYHAZ-SFHVURJKSA-N 0 1 308.381 4.083 20 0 DIADMN CC(C)(C)[C@@H](NCc1cc2c(cc[nH]c2=O)o1)c1ccccc1 ZINC000865411620 1043094639 /nfs/dbraw/zinc/09/46/39/1043094639.db2.gz GMNNBAVAJTVSDU-KRWDZBQOSA-N 0 1 310.397 4.410 20 0 DIADMN COc1cncc(CN[C@H](C)c2ccccc2C(F)(F)F)c1C ZINC000865428354 1043096006 /nfs/dbraw/zinc/09/60/06/1043096006.db2.gz NMXQNMFOUZVPCO-GFCCVEGCSA-N 0 1 324.346 4.268 20 0 DIADMN CC(C)(C)c1ccc(CNCc2cc3c(cc[nH]c3=O)o2)cc1 ZINC000865437058 1043097563 /nfs/dbraw/zinc/09/75/63/1043097563.db2.gz XYFZGMUFFGWKHH-UHFFFAOYSA-N 0 1 310.397 4.121 20 0 DIADMN COc1ccc(CN[C@@H](C)c2c(C)noc2C)cc1C(C)(C)C ZINC000865462423 1043101657 /nfs/dbraw/zinc/10/16/57/1043101657.db2.gz NXTWBDBZFXEORP-LBPRGKRZSA-N 0 1 316.445 4.448 20 0 DIADMN C[C@H](OC(=O)C(C)(Cl)Cl)c1nc2ccc(Cl)cc2[nH]1 ZINC000777319167 1043101874 /nfs/dbraw/zinc/10/18/74/1043101874.db2.gz ZFQAQHQTVYZGCX-LURJTMIESA-N 0 1 321.591 4.014 20 0 DIADMN C[C@@H]1C[C@H]1[C@@H](NCc1cn(C2CC2)cn1)c1ccc(Cl)cc1 ZINC000865476013 1043103413 /nfs/dbraw/zinc/10/34/13/1043103413.db2.gz IWULMTMXUXTQLV-PJSAGSTRSA-N 0 1 315.848 4.358 20 0 DIADMN C[C@@H](N(C)CC(=O)Nc1c(Cl)cccc1Cl)C1(C)CC1 ZINC000177250246 1043104318 /nfs/dbraw/zinc/10/43/18/1043104318.db2.gz YDSKKXFNEPWHLK-SNVBAGLBSA-N 0 1 315.244 4.052 20 0 DIADMN CO[C@@H](C)c1nc(CSc2nc3ccc(C)cc3[nH]2)cs1 ZINC000177165895 1043104667 /nfs/dbraw/zinc/10/46/67/1043104667.db2.gz PKAGMESSTQIJKP-JTQLQIEISA-N 0 1 319.455 4.328 20 0 DIADMN CC[C@H](NCc1cnc2c(F)cccc2c1)c1c(C)noc1C ZINC000865512746 1043108022 /nfs/dbraw/zinc/10/80/22/1043108022.db2.gz SPJBGLQHNYBCRG-INIZCTEOSA-N 0 1 313.376 4.220 20 0 DIADMN C[C@H](C[C@H](O)c1ccccc1)NCc1nc(C(C)(C)C)cs1 ZINC000865515094 1043108802 /nfs/dbraw/zinc/10/88/02/1043108802.db2.gz KKGATMDFIBRUGU-HIFRSBDPSA-N 0 1 318.486 4.042 20 0 DIADMN CCOc1cc(F)cc(CN[C@H](CC)c2c(C)noc2C)c1 ZINC000865513432 1043108928 /nfs/dbraw/zinc/10/89/28/1043108928.db2.gz 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/nfs/dbraw/zinc/05/40/49/1046054049.db2.gz YASVODMSJCVAAF-LLVKDONJSA-N 0 1 312.310 4.399 20 0 DIADMN Cc1nc2c(s1)[C@H](N[C@H]1CCc3c1c(F)ccc3F)CCC2 ZINC000779753584 1046057282 /nfs/dbraw/zinc/05/72/82/1046057282.db2.gz ROZBBSMBDYWOHT-DZGCQCFKSA-N 0 1 320.408 4.384 20 0 DIADMN Cc1nc2c(s1)[C@@H](N[C@H]1CCc3c1c(F)ccc3F)CCC2 ZINC000779753600 1046057313 /nfs/dbraw/zinc/05/73/13/1046057313.db2.gz ROZBBSMBDYWOHT-ZFWWWQNUSA-N 0 1 320.408 4.384 20 0 DIADMN Cc1ccc(CN2CCC[C@H]2c2ncccn2)c2ccccc12 ZINC001138018034 1046060211 /nfs/dbraw/zinc/06/02/11/1046060211.db2.gz GXPJUCJZPSIICF-IBGZPJMESA-N 0 1 303.409 4.275 20 0 DIADMN CC1(C)CCc2ccccc2[C@@H](NCc2cnc(Cl)cn2)C1 ZINC000799338764 1046063902 /nfs/dbraw/zinc/06/39/02/1046063902.db2.gz AUBDEPBKMGBNMU-INIZCTEOSA-N 0 1 315.848 4.323 20 0 DIADMN C[C@H](NCc1ccccc1CO)c1ccc(C(F)(F)F)s1 ZINC000902762014 1046064939 /nfs/dbraw/zinc/06/49/39/1046064939.db2.gz DNQWEVLHCDHMCH-JTQLQIEISA-N 0 1 315.360 4.110 20 0 DIADMN COc1cccnc1CN[C@@H](CC1CC1)c1ccc(Cl)cc1 ZINC000453366732 1046068167 /nfs/dbraw/zinc/06/81/67/1046068167.db2.gz OAQIMQZMVPXMAU-INIZCTEOSA-N 0 1 316.832 4.375 20 0 DIADMN CCn1ccnc1[C@H](C)N[C@H](C)c1cc2c(s1)CCCC2 ZINC000453368290 1046068656 /nfs/dbraw/zinc/06/86/56/1046068656.db2.gz UURVSGXKCXIWTR-OLZOCXBDSA-N 0 1 303.475 4.255 20 0 DIADMN C[C@@H]1C[C@H](c2ccccc2)[C@@H](C)N1Cc1nnc(C(C)(C)C)o1 ZINC000830434231 1046068958 /nfs/dbraw/zinc/06/89/58/1046068958.db2.gz IMGSMIZTUYVOBP-FMKPAKJESA-N 0 1 313.445 4.134 20 0 DIADMN Cc1ncsc1CN[C@H](CCc1ccccc1)c1cccnc1 ZINC000902793507 1046071100 /nfs/dbraw/zinc/07/11/00/1046071100.db2.gz JJOLJWMARLSDJO-GOSISDBHSA-N 0 1 323.465 4.310 20 0 DIADMN Cc1cc(C)c(CN[C@@H]2CC3(CCC3)Oc3ccccc32)cn1 ZINC000453375811 1046071836 /nfs/dbraw/zinc/07/18/36/1046071836.db2.gz UIEKFACYDZBQNC-GOSISDBHSA-N 0 1 308.425 4.235 20 0 DIADMN C[C@@H](N[C@@H]1CCc2c1cccc2O)c1ccc(C(F)(F)F)cn1 ZINC000902793976 1046071775 /nfs/dbraw/zinc/07/17/75/1046071775.db2.gz PMEKOZOIPGUWLN-MEBBXXQBSA-N 0 1 322.330 4.144 20 0 DIADMN CCCn1cc([C@@H](C)N[C@H](c2ccccc2C)C(C)C)nn1 ZINC000902799951 1046072736 /nfs/dbraw/zinc/07/27/36/1046072736.db2.gz IFJZPTVJRBESKH-QAPCUYQASA-N 0 1 300.450 4.044 20 0 DIADMN CC[C@H](N[C@@H](C)c1ccc(C(F)(F)F)cn1)c1ccncc1 ZINC000902817111 1046076999 /nfs/dbraw/zinc/07/69/99/1046076999.db2.gz VPRRKNGTKQPCNV-FZMZJTMJSA-N 0 1 309.335 4.297 20 0 DIADMN O=C1[C@@H]2CCCCCC2=NN1c1nc2ccc(Cl)cc2s1 ZINC000634595402 1046077166 /nfs/dbraw/zinc/07/71/66/1046077166.db2.gz ACGVWVQUNWODDQ-SNVBAGLBSA-N 0 1 319.817 4.233 20 0 DIADMN CCc1ncc(CN[C@H](Cc2ccc(F)cc2)c2ccccc2)o1 ZINC000453400562 1046077875 /nfs/dbraw/zinc/07/78/75/1046077875.db2.gz YJBIKHVHLFBBHI-LJQANCHMSA-N 0 1 324.399 4.450 20 0 DIADMN Cc1cnc(CCN[C@@H](C)c2cc(Cl)sc2Cl)cn1 ZINC000453408759 1046078864 /nfs/dbraw/zinc/07/88/64/1046078864.db2.gz SZHJAQMJDRONKP-VIFPVBQESA-N 0 1 316.257 4.047 20 0 DIADMN Oc1ccc(CN2CCO[C@H](c3ccccc3)C2)c2ccccc12 ZINC001138060384 1046078944 /nfs/dbraw/zinc/07/89/44/1046078944.db2.gz ZTLXNFHTJJXBDJ-NRFANRHFSA-N 0 1 319.404 4.119 20 0 DIADMN Oc1ccc(C[N@H+]2CCc3c(F)cccc3C2)c2ccccc12 ZINC001138062708 1046080073 /nfs/dbraw/zinc/08/00/73/1046080073.db2.gz WXYAMDUUGKPNEV-UHFFFAOYSA-N 0 1 307.368 4.243 20 0 DIADMN Oc1ccc(CN2CCc3c(F)cccc3C2)c2ccccc12 ZINC001138062708 1046080084 /nfs/dbraw/zinc/08/00/84/1046080084.db2.gz WXYAMDUUGKPNEV-UHFFFAOYSA-N 0 1 307.368 4.243 20 0 DIADMN CC[C@H]1Cc2ccccc2CN1C(=O)c1ccc(Cl)c(O)c1 ZINC001138069300 1046081071 /nfs/dbraw/zinc/08/10/71/1046081071.db2.gz JBAHUNNDYSUPDJ-HNNXBMFYSA-N 0 1 315.800 4.023 20 0 DIADMN CCn1nc(C)c(CN[C@H](c2ccc(F)cc2F)C(C)C)c1C ZINC000634679434 1046083972 /nfs/dbraw/zinc/08/39/72/1046083972.db2.gz VEDDRJLNUFSQKZ-SFHVURJKSA-N 0 1 321.415 4.285 20 0 DIADMN C[C@@H](N[C@@H](CO)c1ccccc1)c1ccc(C(F)(F)F)s1 ZINC000902843330 1046084763 /nfs/dbraw/zinc/08/47/63/1046084763.db2.gz OTASRQMEKVOGDV-PWSUYJOCSA-N 0 1 315.360 4.151 20 0 DIADMN CCCc1ncc(CN[C@@H]2c3cccc(F)c3CC[C@@H]2C)o1 ZINC000453397657 1046085166 /nfs/dbraw/zinc/08/51/66/1046085166.db2.gz WABOENCYQPASJT-SGTLLEGYSA-N 0 1 302.393 4.179 20 0 DIADMN Cc1cccc(C[C@@]2(C)CCC[N@H+]2Cc2ccccc2C(=O)[O-])c1 ZINC000634697550 1046085824 /nfs/dbraw/zinc/08/58/24/1046085824.db2.gz LYQLEGVLYVPIAB-OAQYLSRUSA-N 0 1 323.436 4.290 20 0 DIADMN O=C([O-])c1ccc(Cl)c(C[N@H+]2CCC[C@H](C3CCC3)CC2)c1 ZINC000634697245 1046086797 /nfs/dbraw/zinc/08/67/97/1046086797.db2.gz DPOQTCSUGYHHPH-AWEZNQCLSA-N 0 1 321.848 4.440 20 0 DIADMN Cc1cccc(C[C@@]2(C)CCC[N@H+]2Cc2cccc(C(=O)[O-])c2)c1 ZINC000634697806 1046086971 /nfs/dbraw/zinc/08/69/71/1046086971.db2.gz SDMUWGIKQGARGD-OAQYLSRUSA-N 0 1 323.436 4.290 20 0 DIADMN COCCN(Cc1csc(C2CCCC2)n1)C1CCCC1 ZINC000063994372 1046088373 /nfs/dbraw/zinc/08/83/73/1046088373.db2.gz JEWCBPGUBMNBNC-UHFFFAOYSA-N 0 1 308.491 4.192 20 0 DIADMN CCOc1cccc(C[N@H+]2CCCc3ccc(OC)cc3C2)c1 ZINC001138102508 1046089002 /nfs/dbraw/zinc/08/90/02/1046089002.db2.gz PIEZPAKJAHLHIH-UHFFFAOYSA-N 0 1 311.425 4.042 20 0 DIADMN CCOc1cccc(C[N@H+]2CC[C@H](Oc3ccccc3C)C2)c1 ZINC001138100589 1046089722 /nfs/dbraw/zinc/08/97/22/1046089722.db2.gz ZVOHPAGTJQRDDK-IBGZPJMESA-N 0 1 311.425 4.047 20 0 DIADMN CCOc1cccc(C[N@H+]2CCC[C@@H]2c2cccc(OC)c2)c1 ZINC001138101067 1046090714 /nfs/dbraw/zinc/09/07/14/1046090714.db2.gz IGNLZXGWKYUYEP-HXUWFJFHSA-N 0 1 311.425 4.431 20 0 DIADMN Fc1ccc(C(F)(F)F)c(CN2CC[C@H](c3ccccn3)C2)c1 ZINC001138092609 1046091673 /nfs/dbraw/zinc/09/16/73/1046091673.db2.gz PPYBQMBJRLBCNQ-LBPRGKRZSA-N 0 1 324.321 4.229 20 0 DIADMN c1ccc(N2CCC(Nc3ccc4cnccc4c3)CC2)cc1 ZINC000453597650 1046091692 /nfs/dbraw/zinc/09/16/92/1046091692.db2.gz DBDQYFSXZRMNNV-UHFFFAOYSA-N 0 1 303.409 4.316 20 0 DIADMN c1ccc(COC[C@H]2CC[N@H+]2Cc2ccc3ncccc3c2)cc1 ZINC001138110723 1046095744 /nfs/dbraw/zinc/09/57/44/1046095744.db2.gz XNTWBJGRPNRERC-HXUWFJFHSA-N 0 1 318.420 4.026 20 0 DIADMN CCC(C)(C)OCCNCc1ccc(Sc2ccccn2)o1 ZINC000453615873 1046100623 /nfs/dbraw/zinc/10/06/23/1046100623.db2.gz PETWKIGVTNQUAQ-UHFFFAOYSA-N 0 1 320.458 4.121 20 0 DIADMN CCOC(=O)[C@@H]1CC[C@@H](Nc2ccc3cnccc3c2)C[C@H]1C ZINC000453615360 1046100638 /nfs/dbraw/zinc/10/06/38/1046100638.db2.gz NFPOOLLBFQXEAL-MZMPZRCHSA-N 0 1 312.413 4.015 20 0 DIADMN Cc1cncc(CN[C@@H](C)c2ccc(C(F)(F)F)s2)c1 ZINC000902889304 1046101879 /nfs/dbraw/zinc/10/18/79/1046101879.db2.gz GQQFWNNBTDAXIX-JTQLQIEISA-N 0 1 300.349 4.321 20 0 DIADMN Cc1ccc(CC(=O)Nc2cccc(Cl)c2O)c(Cl)c1 ZINC000532145097 1046103259 /nfs/dbraw/zinc/10/32/59/1046103259.db2.gz IZNARNGZXNNMPB-UHFFFAOYSA-N 0 1 310.180 4.189 20 0 DIADMN COc1ccc2c(c1)C[C@H](C)C[C@H]2NCc1ccc(Cl)cn1 ZINC000902896892 1046104093 /nfs/dbraw/zinc/10/40/93/1046104093.db2.gz MQLKGSWVQQLECG-KPZWWZAWSA-N 0 1 316.832 4.157 20 0 DIADMN CCCn1cc([C@@H](C)Nc2ccc(N(CC)C(C)C)cc2)nn1 ZINC000902899889 1046104448 /nfs/dbraw/zinc/10/44/48/1046104448.db2.gz XIJFWUNCUBDFCE-OAHLLOKOSA-N 0 1 315.465 4.096 20 0 DIADMN CCCN(Cc1cc(O)ccc1Br)[C@@H](C)CC ZINC001138142410 1046105303 /nfs/dbraw/zinc/10/53/03/1046105303.db2.gz WGMBTXUISAABBA-NSHDSACASA-N 0 1 300.240 4.165 20 0 DIADMN CC[N@@H+](Cc1ccc(N2CCCCC2)o1)Cc1ccc(F)cc1 ZINC001138177117 1046110799 /nfs/dbraw/zinc/11/07/99/1046110799.db2.gz HFWCVBNEJGXBFU-UHFFFAOYSA-N 0 1 316.420 4.431 20 0 DIADMN CCN(Cc1ccc(N2CCCCC2)o1)Cc1ccc(F)cc1 ZINC001138177117 1046110806 /nfs/dbraw/zinc/11/08/06/1046110806.db2.gz HFWCVBNEJGXBFU-UHFFFAOYSA-N 0 1 316.420 4.431 20 0 DIADMN Cc1nc(-c2ccc(CN[C@H](C)c3cncs3)cc2)cs1 ZINC000532208875 1046115151 /nfs/dbraw/zinc/11/51/51/1046115151.db2.gz BAVNUDCQBSZDPS-LLVKDONJSA-N 0 1 315.467 4.426 20 0 DIADMN CC(C)Oc1cccc(CN(C)C[C@@H]2CC2(Cl)Cl)c1 ZINC000756642032 1046116179 /nfs/dbraw/zinc/11/61/79/1046116179.db2.gz JGPXEEYNBSMMBV-ZDUSSCGKSA-N 0 1 302.245 4.099 20 0 DIADMN CC(C)Oc1cccc(CN(C)C[C@H]2CC2(Cl)Cl)c1 ZINC000756642031 1046116582 /nfs/dbraw/zinc/11/65/82/1046116582.db2.gz JGPXEEYNBSMMBV-CYBMUJFWSA-N 0 1 302.245 4.099 20 0 DIADMN FC(F)(F)Cn1ccnc1CN[C@H](CC1CC1)c1ccccc1 ZINC000532213753 1046116706 /nfs/dbraw/zinc/11/67/06/1046116706.db2.gz BDFGXLADICTNGN-OAHLLOKOSA-N 0 1 323.362 4.076 20 0 DIADMN Cc1ccc(C[C@H](NCc2cc[nH]n2)c2ccc(C)cc2)cc1 ZINC000532231133 1046118986 /nfs/dbraw/zinc/11/89/86/1046118986.db2.gz CJAMDJGDAYXVHQ-FQEVSTJZSA-N 0 1 305.425 4.100 20 0 DIADMN c1c2ccccc2oc1[C@@H](NC[C@H]1CCCS1)c1ccccn1 ZINC000925255952 1046130966 /nfs/dbraw/zinc/13/09/66/1046130966.db2.gz CMCFZQQNAHOKQW-BEFAXECRSA-N 0 1 324.449 4.402 20 0 DIADMN Cc1nc2ccccn2c1CN[C@@H](C)c1cc2cccc(F)c2o1 ZINC000475691187 1046132856 /nfs/dbraw/zinc/13/28/56/1046132856.db2.gz DHYMMXACCLAJDJ-ZDUSSCGKSA-N 0 1 323.371 4.379 20 0 DIADMN C[C@@H](NC[C@H]1CCCS1)c1ncc(C(F)(F)F)cc1Cl ZINC000925256817 1046135098 /nfs/dbraw/zinc/13/50/98/1046135098.db2.gz HUUVOQPPEGOMFT-PSASIEDQSA-N 0 1 324.799 4.300 20 0 DIADMN CN(C/C=C/c1ccccc1)Cc1cccc(OC(C)(C)C)n1 ZINC001138283906 1046138112 /nfs/dbraw/zinc/13/81/12/1046138112.db2.gz PHPMVXLPXCBUOV-FMIVXFBMSA-N 0 1 310.441 4.404 20 0 DIADMN CCn1cc([C@@H](C)N[C@@H](C)c2ccc(C(F)(F)F)s2)cn1 ZINC000903011760 1046141355 /nfs/dbraw/zinc/14/13/55/1046141355.db2.gz IGVJHULPGYMSEW-ZJUUUORDSA-N 0 1 317.380 4.395 20 0 DIADMN Cc1ccc(Cl)cc1NC(=O)CN1CCC[C@@H](CC(C)C)C1 ZINC001168144765 1046141993 /nfs/dbraw/zinc/14/19/93/1046141993.db2.gz HEXHATFVFLCHQW-HNNXBMFYSA-N 0 1 322.880 4.345 20 0 DIADMN C[C@H](NCc1cccc(O)c1)c1ccc(C(F)(F)F)s1 ZINC000717921689 1046146018 /nfs/dbraw/zinc/14/60/18/1046146018.db2.gz MMWMYRUCHDRKAF-VIFPVBQESA-N 0 1 301.333 4.323 20 0 DIADMN CC[C@@H]1COCCN1Cc1c2ccccc2[nH]c1C(C)(C)C ZINC001138314481 1046149672 /nfs/dbraw/zinc/14/96/72/1046149672.db2.gz IZIXFBDPELLNQS-CQSZACIVSA-N 0 1 300.446 4.076 20 0 DIADMN CC(C)[C@H](N[C@@H](C)c1ccc(C(C)(C)C)cc1)c1nncn1C ZINC000903061251 1046150354 /nfs/dbraw/zinc/15/03/54/1046150354.db2.gz LXHLSINRKJFEKK-YOEHRIQHSA-N 0 1 314.477 4.161 20 0 DIADMN Fc1ccccc1CN[C@H](c1ccccc1F)C1CCOCC1 ZINC000903057062 1046150758 /nfs/dbraw/zinc/15/07/58/1046150758.db2.gz ANPGOLZNMBSNSF-IBGZPJMESA-N 0 1 317.379 4.222 20 0 DIADMN CC(C)[C@@H](N[C@@H](C)c1cccc2ccccc21)c1nncn1C ZINC000903060747 1046150946 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C[C@@H]1CCCC[C@]1(C)NC(=O)c1cccc(C(F)(F)F)c1O ZINC001160887343 1048093127 /nfs/dbraw/zinc/09/31/27/1048093127.db2.gz BWHCIXMMDUSTGU-BMIGLBTASA-N 0 1 315.335 4.110 20 0 DIADMN Clc1cccc2c1OCC[C@@H]2NCc1cccc2c1CCC2 ZINC001199751373 1048097073 /nfs/dbraw/zinc/09/70/73/1048097073.db2.gz QKCUPDDLLAPJMD-SFHVURJKSA-N 0 1 313.828 4.442 20 0 DIADMN CCCCCN(CCCCC)c1nc(Cl)nc2[nH]cnc21 ZINC001184885458 1048097410 /nfs/dbraw/zinc/09/74/10/1048097410.db2.gz MTZSLMWPVBCKLJ-UHFFFAOYSA-N 0 1 309.845 4.193 20 0 DIADMN CCc1onc(C)c1CN[C@H](C)c1sc(C(C)C)nc1C ZINC000927139216 1048099110 /nfs/dbraw/zinc/09/91/10/1048099110.db2.gz IQRXKCWFBRMZPP-LLVKDONJSA-N 0 1 307.463 4.285 20 0 DIADMN Clc1ccc(CSc2n[nH]c(CCC3CCCC3)n2)nc1 ZINC000554426396 1048099188 /nfs/dbraw/zinc/09/91/88/1048099188.db2.gz SGIJERKVAHXDFJ-UHFFFAOYSA-N 0 1 322.865 4.268 20 0 DIADMN Clc1ccc(CSc2nc(CCC3CCCC3)n[nH]2)nc1 ZINC000554426396 1048099196 /nfs/dbraw/zinc/09/91/96/1048099196.db2.gz SGIJERKVAHXDFJ-UHFFFAOYSA-N 0 1 322.865 4.268 20 0 DIADMN 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COc1nscc1C[N@@H+](C)[C@@H]1CCC[C@@H]1c1ccc(C)cc1 ZINC001191214037 1048886207 /nfs/dbraw/zinc/88/62/07/1048886207.db2.gz LRVSOSVABGUVSB-IAGOWNOFSA-N 0 1 316.470 4.228 20 0 DIADMN COc1nscc1CN(C)[C@@H]1CCC[C@@H]1c1ccc(C)cc1 ZINC001191214037 1048886228 /nfs/dbraw/zinc/88/62/28/1048886228.db2.gz LRVSOSVABGUVSB-IAGOWNOFSA-N 0 1 316.470 4.228 20 0 DIADMN CC[C@]1(C)CCC[N@@H+](CC(=O)[C@H]2CC[C@@H](C(F)(F)F)CC2)C1 ZINC001191212855 1048886540 /nfs/dbraw/zinc/88/65/40/1048886540.db2.gz CTSZFTQZOPCPNJ-IJEWVQPXSA-N 0 1 319.411 4.436 20 0 DIADMN CCC[C@]1(C)CCCN(CC(=O)Nc2cccc(Cl)c2C)C1 ZINC001191256136 1048895972 /nfs/dbraw/zinc/89/59/72/1048895972.db2.gz FOVUBFZLNSATTG-GOSISDBHSA-N 0 1 322.880 4.489 20 0 DIADMN Clc1cccc(Cl)c1CN1CC[C@@H](COCC2CC2)C1 ZINC001203423022 1048898455 /nfs/dbraw/zinc/89/84/55/1048898455.db2.gz NIXFBUBCVSLKAD-CYBMUJFWSA-N 0 1 314.256 4.242 20 0 DIADMN Cc1ccc([C@@H](C)NCc2cnc([C@H]3CCCO3)s2)s1 ZINC001177496387 1048902782 /nfs/dbraw/zinc/90/27/82/1048902782.db2.gz 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/nfs/dbraw/zinc/91/13/70/1048911370.db2.gz GCGHKNBEKSADLI-AWEZNQCLSA-N 0 1 304.459 4.132 20 0 DIADMN Cc1ccc(F)c(CNCc2ccccc2COC(C)C)c1 ZINC001177537279 1048911514 /nfs/dbraw/zinc/91/15/14/1048911514.db2.gz MZQHAWRXAGPAJS-UHFFFAOYSA-N 0 1 301.405 4.349 20 0 DIADMN CCCCC1CCN(Cc2cc(OC)c(OC)cc2OC)CC1 ZINC001203488188 1048912895 /nfs/dbraw/zinc/91/28/95/1048912895.db2.gz MYCCODPJBFKNDT-UHFFFAOYSA-N 0 1 321.461 4.115 20 0 DIADMN Fc1cccc(/C=C/CNCc2ccccc2Br)c1 ZINC001177542522 1048913145 /nfs/dbraw/zinc/91/31/45/1048913145.db2.gz OJFHMQFRBFBICR-GQCTYLIASA-N 0 1 320.205 4.391 20 0 DIADMN Oc1ccc(Cl)c(CNC/C=C/c2ccc(F)cc2F)c1 ZINC001203497788 1048914416 /nfs/dbraw/zinc/91/44/16/1048914416.db2.gz YDRJRRXXEXFFGY-OWOJBTEDSA-N 0 1 309.743 4.127 20 0 DIADMN CC[C@H](Cc1ccccc1)N(C)Cc1nc(C(C)(C)C)co1 ZINC001191276696 1048914541 /nfs/dbraw/zinc/91/45/41/1048914541.db2.gz DCJOQMRQHKYXAM-MRXNPFEDSA-N 0 1 300.446 4.425 20 0 DIADMN COc1cccc2c1OCCC[C@@H]2NCc1ccc(F)c(C)c1 ZINC001203511487 1048916649 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/nfs/dbraw/zinc/92/15/61/1048921561.db2.gz FKGNGEWNDXMMFQ-GOSISDBHSA-N 0 1 315.388 4.180 20 0 DIADMN Cc1cccc2nc(NC(=O)c3ccc(F)c(C)c3Cl)[nH]c21 ZINC001191355149 1048923129 /nfs/dbraw/zinc/92/31/29/1048923129.db2.gz WCNXHDMACPVYRH-UHFFFAOYSA-N 0 1 317.751 4.225 20 0 DIADMN CC(C)C1CCC(CNc2nc3cc4c(cc3[nH]2)OCO4)CC1 ZINC001203530163 1048924536 /nfs/dbraw/zinc/92/45/36/1048924536.db2.gz PANHQYPNVWATIT-UHFFFAOYSA-N 0 1 315.417 4.166 20 0 DIADMN Cc1cccc(CN(C)CCc2cccs2)c1Br ZINC001191320719 1048924495 /nfs/dbraw/zinc/92/44/95/1048924495.db2.gz VXNVUONZEZFCHN-UHFFFAOYSA-N 0 1 324.287 4.494 20 0 DIADMN Cc1cccc2c1nc(N)n2-c1cncc(Oc2ccccc2)c1 ZINC001203555043 1048926002 /nfs/dbraw/zinc/92/60/02/1048926002.db2.gz FBHFGLDFJPXPRC-UHFFFAOYSA-N 0 1 316.364 4.103 20 0 DIADMN Cc1ccc(CN2CC[C@H](C(F)(F)F)C(C)(C)C2)c(C)n1 ZINC000484361173 1048930142 /nfs/dbraw/zinc/93/01/42/1048930142.db2.gz OUPSMSNZEMXWHK-AWEZNQCLSA-N 0 1 300.368 4.109 20 0 DIADMN Fc1ccc2c(c1)CC[C@@H]2NCc1cc(Cl)cc2c1OCC2 ZINC001177650683 1048930307 /nfs/dbraw/zinc/93/03/07/1048930307.db2.gz KOFMEOHOAUOPMY-KRWDZBQOSA-N 0 1 317.791 4.191 20 0 DIADMN Fc1cccc(C2(NCc3cc(Cl)nc(Cl)c3)CC2)c1 ZINC000775453748 1048932154 /nfs/dbraw/zinc/93/21/54/1048932154.db2.gz FJUGCDJFHQSRCA-UHFFFAOYSA-N 0 1 311.187 4.306 20 0 DIADMN CCOc1ncccc1CN[C@H](C)c1ccccc1SC ZINC000194845612 1048933430 /nfs/dbraw/zinc/93/34/30/1048933430.db2.gz IGLDFXHGOMRTIR-CYBMUJFWSA-N 0 1 302.443 4.053 20 0 DIADMN Cc1ccn2cc(CNCc3cc4ccccc4s3)nc2c1 ZINC001177737048 1048937207 /nfs/dbraw/zinc/93/72/07/1048937207.db2.gz IMSGZWUTDMGCFC-UHFFFAOYSA-N 0 1 307.422 4.147 20 0 DIADMN CCn1cnc(Cl)c1CN[C@@H]1CCC(C)(C)c2ccccc21 ZINC001177749517 1048938206 /nfs/dbraw/zinc/93/82/06/1048938206.db2.gz XLCKZSCDDITGHU-OAHLLOKOSA-N 0 1 317.864 4.459 20 0 DIADMN CC[C@H](NC)c1nc(-c2ccc(-c3ccc(OC)cc3)cc2)no1 ZINC000854147213 1048942925 /nfs/dbraw/zinc/94/29/25/1048942925.db2.gz ZBJGFFFCFUTYOE-KRWDZBQOSA-N 0 1 323.396 4.083 20 0 DIADMN C[C@@H]1[C@H](c2ccccc2)CCN1Cc1cnc(Cl)c(F)c1 ZINC001191443637 1048947793 /nfs/dbraw/zinc/94/77/93/1048947793.db2.gz DSXUEIFNECKEIE-IUODEOHRSA-N 0 1 304.796 4.252 20 0 DIADMN Cc1nn(Cc2ccccc2)c(Cl)c1CN1CC[C@H](C)[C@@H]1C ZINC001191487239 1048952777 /nfs/dbraw/zinc/95/27/77/1048952777.db2.gz YMFOXKRXWGOMIU-ZFWWWQNUSA-N 0 1 317.864 4.124 20 0 DIADMN FC(F)c1nc2cc(-c3cnn([C@@H]4CCCCO4)c3)ccc2[nH]1 ZINC000854211375 1048952971 /nfs/dbraw/zinc/95/29/71/1048952971.db2.gz WWOXWUOPQGIJQL-AWEZNQCLSA-N 0 1 318.327 4.063 20 0 DIADMN Cc1ccc(C)c(N2CCN([C@H]3CCc4ccc(F)cc43)CC2)c1 ZINC001191521774 1048958176 /nfs/dbraw/zinc/95/81/76/1048958176.db2.gz VCQJEHLHAYFWPD-FQEVSTJZSA-N 0 1 324.443 4.252 20 0 DIADMN C[C@H](c1ccccc1Br)N1CCSC(C)(C)C1 ZINC001191511824 1048958935 /nfs/dbraw/zinc/95/89/35/1048958935.db2.gz YWZCUGIKYMOSDK-LLVKDONJSA-N 0 1 314.292 4.338 20 0 DIADMN CC(C)N(Cc1ccn(-c2ccc(Cl)cc2)n1)C1CCC1 ZINC001191590826 1048964144 /nfs/dbraw/zinc/96/41/44/1048964144.db2.gz GFWGPHZDILRIFM-UHFFFAOYSA-N 0 1 303.837 4.289 20 0 DIADMN CC[C@H]1CCN(Cc2ccc(Cl)cc2Br)C1 ZINC001191560136 1048965593 /nfs/dbraw/zinc/96/55/93/1048965593.db2.gz XRXHIZHHCZANKW-JTQLQIEISA-N 0 1 302.643 4.334 20 0 DIADMN CC[C@H]1CCN(Cc2cc(Cl)cc(Br)c2)C1 ZINC001191557946 1048965884 /nfs/dbraw/zinc/96/58/84/1048965884.db2.gz APJJAJAPDAPKTQ-JTQLQIEISA-N 0 1 302.643 4.334 20 0 DIADMN c1cc2c(cccc2-c2noc([C@@H]3CC[C@H]4CCCC[C@H]4N3)n2)[nH]1 ZINC000904088389 1048971634 /nfs/dbraw/zinc/97/16/34/1048971634.db2.gz XOWGDXRSGCGXBU-VMGRFDJRSA-N 0 1 322.412 4.201 20 0 DIADMN Cc1ccc2c(c1)[C@@H](NCc1ccc(OC(F)(F)F)cc1)CO2 ZINC001178003636 1048972676 /nfs/dbraw/zinc/97/26/76/1048972676.db2.gz UHGOTSRNGQTKED-HNNXBMFYSA-N 0 1 323.314 4.117 20 0 DIADMN c1cc2ccc(-c3noc([C@@H]4CC[C@H]5CCCC[C@@H]5N4)n3)cc2[nH]1 ZINC000904088407 1048973200 /nfs/dbraw/zinc/97/32/00/1048973200.db2.gz AGSLNDOLARBWQC-KCXAZCMYSA-N 0 1 322.412 4.201 20 0 DIADMN COc1cc(CN(C2CC2)[C@H]2CCCc3ccccc32)sn1 ZINC001191645553 1048976064 /nfs/dbraw/zinc/97/60/64/1048976064.db2.gz 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Cn1cc(N=C2CCC(C(F)(F)F)CC2)c(C(F)(F)F)n1 ZINC001196769159 1049684779 /nfs/dbraw/zinc/68/47/79/1049684779.db2.gz YMRHVZZMKBDSIH-SSDOTTSWSA-N 0 1 313.245 4.097 20 0 DIADMN CCC1(c2ccccc2)CN(Cc2ccc(CC(C)C)nc2)C1 ZINC001206223823 1049686019 /nfs/dbraw/zinc/68/60/19/1049686019.db2.gz DNYXJGFLARRCJJ-UHFFFAOYSA-N 0 1 308.469 4.444 20 0 DIADMN COc1nc(CNC2(c3cccc(Cl)c3)CCC2)ccc1C ZINC001182542751 1049686355 /nfs/dbraw/zinc/68/63/55/1049686355.db2.gz FRZALZVFJIKZGF-UHFFFAOYSA-N 0 1 316.832 4.221 20 0 DIADMN Cc1[nH]nc2cc(NC(=O)c3ccc(OC(C)C)cc3C)ccc12 ZINC001196768992 1049687437 /nfs/dbraw/zinc/68/74/37/1049687437.db2.gz HVLRNUWMPJHJOB-UHFFFAOYSA-N 0 1 323.396 4.219 20 0 DIADMN CCCCC[C@H](CC)C(=O)NCc1ccc(F)c(CN(C)C)c1 ZINC000775747219 1049696226 /nfs/dbraw/zinc/69/62/26/1049696226.db2.gz UYUDOCXPVYPIBF-INIZCTEOSA-N 0 1 322.468 4.110 20 0 DIADMN COC(=O)c1nc2ccc(-c3ccc(Cl)c(C)c3F)cc2[nH]1 ZINC001206277783 1049698157 /nfs/dbraw/zinc/69/81/57/1049698157.db2.gz FKYUUGFMXFNLPK-UHFFFAOYSA-N 0 1 318.735 4.117 20 0 DIADMN CO[C@@H](CNC(C)(C)c1nc2cc(Cl)ccc2o1)C1CCC1 ZINC001196869125 1049699897 /nfs/dbraw/zinc/69/98/97/1049699897.db2.gz GSKCPNNNWVRPGL-HNNXBMFYSA-N 0 1 322.836 4.121 20 0 DIADMN CN(Cc1ncc(Cl)n1C)[C@H]1CCCC[C@@H]1c1ccccc1 ZINC001206293411 1049703788 /nfs/dbraw/zinc/70/37/88/1049703788.db2.gz QBSPESZFWGCRGS-CVEARBPZSA-N 0 1 317.864 4.232 20 0 DIADMN COc1ccc2c(c1)CCN(Cc1cc3ccc(C)cc3[nH]1)CC2 ZINC000911592386 1049705582 /nfs/dbraw/zinc/70/55/82/1049705582.db2.gz WXMPJAWRFCOKHC-UHFFFAOYSA-N 0 1 320.436 4.086 20 0 DIADMN C[C@H](CN1C[C@H](C)OC2(CCCC2)C1)c1cccc(Cl)c1 ZINC001182726211 1049707076 /nfs/dbraw/zinc/70/70/76/1049707076.db2.gz PLQHAMNQWQMYJU-CABCVRRESA-N 0 1 307.865 4.477 20 0 DIADMN CC[C@@H]1c2ccc(OC)c(OC)c2CCN1Cc1ccoc1C ZINC001182726475 1049707792 /nfs/dbraw/zinc/70/77/92/1049707792.db2.gz TWMUMSMNUQMMKM-QGZVFWFLSA-N 0 1 315.413 4.115 20 0 DIADMN CCCN(Cc1conc1CC)[C@H](C)c1ccccc1OC ZINC000659860045 1049712288 /nfs/dbraw/zinc/71/22/88/1049712288.db2.gz 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Cc1conc1C[N@H+]1CC[C@H](c2ccc(F)c(F)c2)C1(C)C ZINC001197420838 1049749661 /nfs/dbraw/zinc/74/96/61/1049749661.db2.gz CAOPLWAIRZLKRG-CYBMUJFWSA-N 0 1 306.356 4.029 20 0 DIADMN Cc1conc1CN1CC[C@H](c2ccc(F)c(F)c2)C1(C)C ZINC001197420838 1049749668 /nfs/dbraw/zinc/74/96/68/1049749668.db2.gz CAOPLWAIRZLKRG-CYBMUJFWSA-N 0 1 306.356 4.029 20 0 DIADMN CCOc1cccc(F)c1CN1CC2(CC=CC2)[C@H]1C(C)C ZINC001206523323 1049749728 /nfs/dbraw/zinc/74/97/28/1049749728.db2.gz JIQXQHITFCXYMB-GOSISDBHSA-N 0 1 303.421 4.401 20 0 DIADMN Cc1nc(CN2CC[C@H](c3ccc(F)c(F)c3)C2(C)C)oc1C ZINC001197423827 1049751976 /nfs/dbraw/zinc/75/19/76/1049751976.db2.gz YHUXQNSJGLYHQI-CQSZACIVSA-N 0 1 320.383 4.338 20 0 DIADMN COc1ccc(Cl)c(N2CCN(CCCCC(C)C)CC2)c1 ZINC001206538059 1049753142 /nfs/dbraw/zinc/75/31/42/1049753142.db2.gz SAASVIJSNUHIGY-UHFFFAOYSA-N 0 1 324.896 4.297 20 0 DIADMN Fc1ccccc1-c1noc([C@H]2C[C@@H](c3ccccc3)CCN2)n1 ZINC001206566392 1049756624 /nfs/dbraw/zinc/75/66/24/1049756624.db2.gz WVVDNHROMYJFIT-WMLDXEAASA-N 0 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/nfs/dbraw/zinc/30/35/31/1052303531.db2.gz FGGXNNGCTXQGTC-SFHVURJKSA-N 0 1 324.468 4.117 20 0 DIADMN COc1c(Cl)cc(Cl)cc1CNCCOCCC(C)C ZINC000303073231 1052313816 /nfs/dbraw/zinc/31/38/16/1052313816.db2.gz PZZCGVVHUIMOMH-UHFFFAOYSA-N 0 1 320.260 4.154 20 0 DIADMN C[C@H](O)C1CCN(CCCc2c(Cl)cccc2Cl)CC1 ZINC000193244428 1052329746 /nfs/dbraw/zinc/32/97/46/1052329746.db2.gz LQUBYTHMLISGLY-LBPRGKRZSA-N 0 1 316.272 4.019 20 0 DIADMN CCC1(NC(=O)[C@H](N)c2ccc3ccccc3c2)CCCCC1 ZINC001220339282 1052329863 /nfs/dbraw/zinc/32/98/63/1052329863.db2.gz XQBXSMFUQRVEQG-GOSISDBHSA-N 0 1 310.441 4.069 20 0 DIADMN C[C@H](CC(C)(C)C)[NH2+]Cc1cccc([O-])c1Br ZINC000315137685 1052333210 /nfs/dbraw/zinc/33/32/10/1052333210.db2.gz QHSMAHMYCXHMSQ-SNVBAGLBSA-N 0 1 300.240 4.069 20 0 DIADMN CN(Cc1csc(C(C)(C)C)n1)[C@H]1CCc2ccccc2C1 ZINC000303597641 1052333333 /nfs/dbraw/zinc/33/33/33/1052333333.db2.gz UKYVGTXBFHSZAX-KRWDZBQOSA-N 0 1 314.498 4.430 20 0 DIADMN O=C(CN1CCC[C@@]2(CC=CCC2)C1)Nc1cccc(Cl)c1 ZINC000303626633 1052334527 /nfs/dbraw/zinc/33/45/27/1052334527.db2.gz XWQBRSSITFBJHT-SFHVURJKSA-N 0 1 318.848 4.101 20 0 DIADMN CC[C@H](C)C[C@H](C)[NH2+]Cc1cccc([O-])c1Br ZINC000315334143 1052335496 /nfs/dbraw/zinc/33/54/96/1052335496.db2.gz JJWJQRRYJFGIBL-QWRGUYRKSA-N 0 1 300.240 4.069 20 0 DIADMN CCC[N@@H+](Cc1cccc([O-])c1Br)CC(C)C ZINC000315548333 1052344213 /nfs/dbraw/zinc/34/42/13/1052344213.db2.gz BJACDQIPHXJTKE-UHFFFAOYSA-N 0 1 300.240 4.023 20 0 DIADMN CCC[N@H+](Cc1cccc([O-])c1Br)CC(C)C ZINC000315548333 1052344220 /nfs/dbraw/zinc/34/42/20/1052344220.db2.gz BJACDQIPHXJTKE-UHFFFAOYSA-N 0 1 300.240 4.023 20 0 DIADMN CC[C@@]1(C(=O)[O-])CCC[N@H+]([C@H](C)c2ccc(C(C)C)cc2)C1 ZINC000315850647 1052355369 /nfs/dbraw/zinc/35/53/69/1052355369.db2.gz IJYWTFNOBYEJAH-DNVCBOLYSA-N 0 1 303.446 4.448 20 0 DIADMN c1csc(-c2ccn(CN3CCC(c4ccccc4)CC3)n2)c1 ZINC000731657466 1052375275 /nfs/dbraw/zinc/37/52/75/1052375275.db2.gz XAYHRHROGYVYAB-UHFFFAOYSA-N 0 1 323.465 4.449 20 0 DIADMN CC/C=C(\C)C(=O)Nc1cc(Br)cc(Cl)c1O ZINC000762393194 1052375533 /nfs/dbraw/zinc/37/55/33/1052375533.db2.gz WXGQKXDUTLWRIR-QPJJXVBHSA-N 0 1 318.598 4.103 20 0 DIADMN COC(=O)c1ccccc1CN(C)[C@@H](C)c1ccc(Cl)cc1 ZINC000317000131 1052378511 /nfs/dbraw/zinc/37/85/11/1052378511.db2.gz VFDZUMSLOVHQQA-ZDUSSCGKSA-N 0 1 317.816 4.320 20 0 DIADMN O[C@H](CNCc1csc(Cl)c1Cl)c1ccccc1F ZINC000762420933 1052379840 /nfs/dbraw/zinc/37/98/40/1052379840.db2.gz OMNYSRDLXJJPMY-LLVKDONJSA-N 0 1 320.216 4.017 20 0 DIADMN C[C@@H](NCC1(C)CCC1)c1nc(-c2ccc(Cl)cc2)no1 ZINC000762642441 1052410003 /nfs/dbraw/zinc/41/00/03/1052410003.db2.gz SJWKCYGQQNJQBH-LLVKDONJSA-N 0 1 305.809 4.231 20 0 DIADMN CCCN(Cc1ccc(OC(C)=O)cc1)Cc1ccccc1F ZINC000762633693 1052410147 /nfs/dbraw/zinc/41/01/47/1052410147.db2.gz SQOQHEWIISPDOQ-UHFFFAOYSA-N 0 1 315.388 4.163 20 0 DIADMN C[C@@H](N[C@@H](C)CC1CC1)c1nc(-c2ccc(Cl)cc2)no1 ZINC000762634170 1052410300 /nfs/dbraw/zinc/41/03/00/1052410300.db2.gz DAYSJCRRKLCJCD-WDEREUQCSA-N 0 1 305.809 4.229 20 0 DIADMN Cc1cc(Cl)c(CN2CC[C@@H](C)[C@@](C)(O)CC2)c(Cl)c1 ZINC001235178406 1052411509 /nfs/dbraw/zinc/41/15/09/1052411509.db2.gz ZKTIHRGQOCFEKU-WBMJQRKESA-N 0 1 316.272 4.285 20 0 DIADMN CC(C)[C@H](NC(=O)CN(C)[C@@H](C)c1ccccc1)c1ccccc1 ZINC000011289207 1052418361 /nfs/dbraw/zinc/41/83/61/1052418361.db2.gz VDZCLFWQZQTEMC-UWJYYQICSA-N 0 1 324.468 4.193 20 0 DIADMN Cc1ccc2nc(SCc3ccc([N+](=O)[O-])cc3F)[nH]c2c1 ZINC000319229164 1052421627 /nfs/dbraw/zinc/42/16/27/1052421627.db2.gz UWLNLILVMVKNBB-UHFFFAOYSA-N 0 1 317.345 4.211 20 0 DIADMN Cn1nc(CN2CCCC[C@H]2c2ccccc2)c2ccccc21 ZINC000762795860 1052423572 /nfs/dbraw/zinc/42/35/72/1052423572.db2.gz ZICZKJCZACJERS-IBGZPJMESA-N 0 1 305.425 4.301 20 0 DIADMN CC(C)c1ccc(CCN[C@H](C)c2nc(C(C)(C)C)no2)cc1 ZINC000236645150 1052428727 /nfs/dbraw/zinc/42/87/27/1052428727.db2.gz MEVSAKVHHCVKOZ-CQSZACIVSA-N 0 1 315.461 4.384 20 0 DIADMN COc1ccc(CNCc2cccc(Oc3ccccc3)c2)cn1 ZINC000237265931 1052438978 /nfs/dbraw/zinc/43/89/78/1052438978.db2.gz BUXGRIODLXNDLA-UHFFFAOYSA-N 0 1 320.392 4.172 20 0 DIADMN CC[NH+](CC)Cc1cc(C)ccc1-c1cc(F)c([O-])cc1F ZINC001222083227 1052439955 /nfs/dbraw/zinc/43/99/55/1052439955.db2.gz UWKJUCFRQZTAMC-UHFFFAOYSA-N 0 1 305.368 4.488 20 0 DIADMN C[NH+]1CCC(c2cccc(-c3cc(F)c([O-])cc3F)c2)CC1 ZINC001222083188 1052440016 /nfs/dbraw/zinc/44/00/16/1052440016.db2.gz SFLDXDADVDPMQJ-UHFFFAOYSA-N 0 1 303.352 4.147 20 0 DIADMN [O-]c1cc(F)c(-c2ccc(F)c(C[NH+]3CCCC3)c2)cc1F ZINC001222083337 1052440042 /nfs/dbraw/zinc/44/00/42/1052440042.db2.gz ZZWYBTMVXIUMAJ-UHFFFAOYSA-N 0 1 307.315 4.072 20 0 DIADMN Fc1cccc(N2CCCC2)c1CN[C@@H]1CCc2ccccc21 ZINC000237800003 1052445653 /nfs/dbraw/zinc/44/56/53/1052445653.db2.gz VRDIUVZULOXIBC-LJQANCHMSA-N 0 1 310.416 4.203 20 0 DIADMN Cc1[nH]ncc1C(=O)Nc1ccccc1Sc1ccccc1 ZINC000315985350 1052455499 /nfs/dbraw/zinc/45/54/99/1052455499.db2.gz YNTAQGIVYWKRGK-UHFFFAOYSA-N 0 1 309.394 4.122 20 0 DIADMN CCc1cc(CN2CCC(n3ccc4ccccc43)CC2)on1 ZINC001203227366 1052455681 /nfs/dbraw/zinc/45/56/81/1052455681.db2.gz XZQYGPCLZKFGGE-UHFFFAOYSA-N 0 1 309.413 4.029 20 0 DIADMN CCOc1cccc(-c2noc(-c3ccc(Cl)cc3O)n2)c1 ZINC000315978700 1052456074 /nfs/dbraw/zinc/45/60/74/1052456074.db2.gz GQDJIPJDVRVROX-UHFFFAOYSA-N 0 1 316.744 4.161 20 0 DIADMN Oc1ccc(Cl)cc1-c1nc([C@H]2CCc3ccccc32)no1 ZINC000316100511 1052456887 /nfs/dbraw/zinc/45/68/87/1052456887.db2.gz DAOHNFGOSKVEBP-ZDUSSCGKSA-N 0 1 312.756 4.174 20 0 DIADMN Oc1cc(Cl)ccc1-c1nc([C@@H]2CCc3ccccc32)no1 ZINC000316235964 1052457759 /nfs/dbraw/zinc/45/77/59/1052457759.db2.gz TWRTZENZSCLWJP-CYBMUJFWSA-N 0 1 312.756 4.174 20 0 DIADMN Cc1[nH]c(SCc2cc(C)nnc2C)nc1Cc1ccccc1 ZINC000915512936 1052459458 /nfs/dbraw/zinc/45/94/58/1052459458.db2.gz RGIAVVSOLPMKAX-UHFFFAOYSA-N 0 1 324.453 4.008 20 0 DIADMN CC(C)(C)c1nc2ccc(NC(=O)C=Cc3ccco3)cc2[nH]1 ZINC000032496744 1052460430 /nfs/dbraw/zinc/46/04/30/1052460430.db2.gz VDANRGAFKSOQSY-VQHVLOKHSA-N 0 1 309.369 4.105 20 0 DIADMN COCc1ccc(Cl)c(-c2cccc(CN(C)C)c2F)c1 ZINC001222278699 1052472310 /nfs/dbraw/zinc/47/23/10/1052472310.db2.gz CBIUHKQBTTVHCE-UHFFFAOYSA-N 0 1 307.796 4.354 20 0 DIADMN CCOC(=O)c1cc2cc(-c3ccccc3Cl)cnc2[nH]1 ZINC001222440659 1052500663 /nfs/dbraw/zinc/50/06/63/1052500663.db2.gz GRJCCDDAGOXNID-UHFFFAOYSA-N 0 1 300.745 4.060 20 0 DIADMN COc1ccc2c(c1)nccc2Nc1cc(F)nc(F)c1Cl ZINC001203521577 1052515385 /nfs/dbraw/zinc/51/53/85/1052515385.db2.gz CRVLVOYZHREMSU-UHFFFAOYSA-N 0 1 321.714 4.314 20 0 DIADMN Cc1cc(C)c(-c2cc(C(=O)[O-])cc(C(F)(F)F)c2)c(C)[nH+]1 ZINC001222625814 1052520575 /nfs/dbraw/zinc/52/05/75/1052520575.db2.gz HGBAUFBZSDIKTD-UHFFFAOYSA-N 0 1 309.287 4.391 20 0 DIADMN CCCCc1ccc(NC(=O)c2cc(=O)c3ccccc3[nH]2)cc1 ZINC000055542692 1052533459 /nfs/dbraw/zinc/53/34/59/1052533459.db2.gz YCZKXKMJTPBDMA-UHFFFAOYSA-N 0 1 320.392 4.123 20 0 DIADMN Clc1cc(CNC[C@@H]2C[C@@H]3CCC[C@@H]3O2)c(Cl)s1 ZINC000720787826 1052561218 /nfs/dbraw/zinc/56/12/18/1052561218.db2.gz SPFDQZQJMQVTQV-LSJOCFKGSA-N 0 1 306.258 4.102 20 0 DIADMN Cc1nnc([C@H]2Cc3ccccc3CN2C[C@H](C)C(C)(C)C)o1 ZINC000670262714 1052538988 /nfs/dbraw/zinc/53/89/88/1052538988.db2.gz DMHCEJREDCCNCX-SUMWQHHRSA-N 0 1 313.445 4.160 20 0 DIADMN COc1ccc2c(c1)nccc2Nc1ccnc(Cl)c1F ZINC001203523529 1052541039 /nfs/dbraw/zinc/54/10/39/1052541039.db2.gz RFXKXDBVQPYTGC-UHFFFAOYSA-N 0 1 303.724 4.175 20 0 DIADMN Cc1cccc([C@H]2CCCN2CC(=O)Nc2ccccc2C)c1 ZINC000055911284 1052545516 /nfs/dbraw/zinc/54/55/16/1052545516.db2.gz IJLNECAOUNPZTM-LJQANCHMSA-N 0 1 308.425 4.079 20 0 DIADMN CCCCCC[C@@H](CC)C(=O)N[C@@H](C)c1n[nH]c(C(C)C)n1 ZINC000763224119 1052549041 /nfs/dbraw/zinc/54/90/41/1052549041.db2.gz UEMWAGZICNCRTO-UONOGXRCSA-N 0 1 308.470 4.102 20 0 DIADMN FC(F)(F)[C@H]1CCN(Cc2n[nH]c3ccccc32)CC12CCC2 ZINC000670272346 1052549723 /nfs/dbraw/zinc/54/97/23/1052549723.db2.gz WTCNLBZICWGMKA-HNNXBMFYSA-N 0 1 323.362 4.117 20 0 DIADMN FC(F)(F)[C@H]1CCN(Cc2[nH]nc3ccccc32)CC12CCC2 ZINC000670272346 1052549735 /nfs/dbraw/zinc/54/97/35/1052549735.db2.gz WTCNLBZICWGMKA-HNNXBMFYSA-N 0 1 323.362 4.117 20 0 DIADMN Cl/C=C(/Cl)CSc1nc(C=Cc2ccccc2)n[nH]1 ZINC000763256128 1052552057 /nfs/dbraw/zinc/55/20/57/1052552057.db2.gz WUEFFVMNDXDFFF-BQGCWICQSA-N 0 1 312.225 4.386 20 0 DIADMN COc1ccc2cc(CC[C@H](C)OCc3cnc[nH]3)ccc2c1 ZINC001223007632 1052557422 /nfs/dbraw/zinc/55/74/22/1052557422.db2.gz MFKGWBDFXCLHTD-AWEZNQCLSA-N 0 1 310.397 4.109 20 0 DIADMN S=c1snc(-c2ccccc2)n1CN1CC[C@@H](C2CC2)C1 ZINC000763335703 1052564811 /nfs/dbraw/zinc/56/48/11/1052564811.db2.gz ZTGKPUDNUCTQLO-CQSZACIVSA-N 0 1 317.483 4.030 20 0 DIADMN CCOC[C@@H]1CCC[N@@H+](Cc2ccccc2CC(F)(F)F)C1 ZINC000638084754 1052569797 /nfs/dbraw/zinc/56/97/97/1052569797.db2.gz LYYUABUPQGNWPF-CQSZACIVSA-N 0 1 315.379 4.040 20 0 DIADMN CN1CCC[C@@H](OC(Cl)(c2ccccc2)c2ccccc2)C1 ZINC001223160074 1052573962 /nfs/dbraw/zinc/57/39/62/1052573962.db2.gz PSSVGTROEFDGIJ-GOSISDBHSA-N 0 1 315.844 4.237 20 0 DIADMN C[C@@H](NC[C@H](O)c1ccccc1)c1cc(Cl)sc1Cl ZINC000153812092 1052582068 /nfs/dbraw/zinc/58/20/68/1052582068.db2.gz RCOYDIITVMAPCU-SKDRFNHKSA-N 0 1 316.253 4.439 20 0 DIADMN Cc1nc(CN[C@H]2c3cccc(F)c3CC[C@@H]2C)sc1C ZINC000153833782 1052588019 /nfs/dbraw/zinc/58/80/19/1052588019.db2.gz JKAKERIEKHDTOQ-DYZYQPBXSA-N 0 1 304.434 4.312 20 0 DIADMN Fc1ccccc1CN1CCC[C@@H](OCc2ccsc2)C1 ZINC001223334955 1052590015 /nfs/dbraw/zinc/59/00/15/1052590015.db2.gz BDBIKFKTPRFUMJ-MRXNPFEDSA-N 0 1 305.418 4.068 20 0 DIADMN CC[C@@H](NCc1ncc(C)s1)c1ccc2c(c1)CCCO2 ZINC000154018122 1052610129 /nfs/dbraw/zinc/61/01/29/1052610129.db2.gz ICBZINYOLNYCOJ-OAHLLOKOSA-N 0 1 302.443 4.017 20 0 DIADMN C[C@H](Cn1cccn1)N[C@H](C)c1cc(F)c(Cl)cc1Cl ZINC000037319917 1052622033 /nfs/dbraw/zinc/62/20/33/1052622033.db2.gz KJIWMILAWPFGJE-NXEZZACHSA-N 0 1 316.207 4.068 20 0 DIADMN C[C@H](NCc1cccc(Br)c1)c1ccccc1F ZINC000037493775 1052625208 /nfs/dbraw/zinc/62/52/08/1052625208.db2.gz NFWGMNDOAFOWNT-NSHDSACASA-N 0 1 308.194 4.439 20 0 DIADMN COc1ccc2nc(SCc3csc(C4CC4)n3)[nH]c2c1 ZINC000124159600 1052637514 /nfs/dbraw/zinc/63/75/14/1052637514.db2.gz 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C[C@@H]1CCC[C@@H](C[NH+]2CCC(C(=O)c3ccc([O-])cc3)CC2)C1 ZINC001559615403 1059445590 /nfs/dbraw/zinc/44/55/90/1059445590.db2.gz BOMVUOOGOHWXIY-HZPDHXFCSA-N 0 1 315.457 4.113 20 0 DIADMN CC(C)c1ccccc1CN(C)[C@H]1CCN(c2ccccc2)C1=O ZINC001559622010 1059450490 /nfs/dbraw/zinc/45/04/90/1059450490.db2.gz PZLZSSPWMBJKLS-FQEVSTJZSA-N 0 1 322.452 4.047 20 0 DIADMN CCc1ccc([C@@H](NCc2c(C)nn(C)c2Cl)C(C)C)cc1 ZINC001559629374 1059454828 /nfs/dbraw/zinc/45/48/28/1059454828.db2.gz IPNWUANLYBIKCP-KRWDZBQOSA-N 0 1 319.880 4.431 20 0 DIADMN CCc1ccccc1CN1CCC[C@@H]1c1nc2ccccc2n1C ZINC001559637293 1059463755 /nfs/dbraw/zinc/46/37/55/1059463755.db2.gz MFGUCROWKLSHEW-HXUWFJFHSA-N 0 1 319.452 4.473 20 0 DIADMN CC[C@H](C)[C@@H](C)N1CCc2c(F)cc(Br)cc2C1 ZINC001559648330 1059465333 /nfs/dbraw/zinc/46/53/33/1059465333.db2.gz DBMXMVNCKLHGBW-WDEREUQCSA-N 0 1 314.242 4.381 20 0 DIADMN CCCN(CCC)[C@@H](C)c1nc(-c2ccccc2C(C)=O)no1 ZINC001247417148 1059468419 /nfs/dbraw/zinc/46/84/19/1059468419.db2.gz 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CCCc1ccc([C@@H](NCc2nc(CO)cs2)C(C)C)cc1 ZINC001473982742 1061526805 /nfs/dbraw/zinc/52/68/05/1061526805.db2.gz CUOHBXRRZNQDMG-SFHVURJKSA-N 0 1 318.486 4.075 20 0 DIADMN C[C@H](c1ccc(Cl)cc1Cl)N1C[C@H]2CCC[C@@H](C1)C2O ZINC001251895038 1061527207 /nfs/dbraw/zinc/52/72/07/1061527207.db2.gz NBJKSEWZUWJWBT-HUOYYHSISA-N 0 1 314.256 4.147 20 0 DIADMN CC1(C)CN(C(=O)c2ccc(F)cc2O)c2ccc(Cl)cc21 ZINC001457974324 1061531519 /nfs/dbraw/zinc/53/15/19/1061531519.db2.gz RKKWUYWPXCUWSG-UHFFFAOYSA-N 0 1 319.763 4.123 20 0 DIADMN O=C(C=C1CCCC1)Nc1ccc2nc(-c3ccncc3)[nH]c2c1 ZINC001457980633 1061532499 /nfs/dbraw/zinc/53/24/99/1061532499.db2.gz AUQCMHWPVZAEPS-UHFFFAOYSA-N 0 1 318.380 4.064 20 0 DIADMN COc1ccc(Cl)cc1CN[C@H]1CCc2c1cccc2C ZINC001473991322 1061535094 /nfs/dbraw/zinc/53/50/94/1061535094.db2.gz ICBJRDIMPYPKJC-KRWDZBQOSA-N 0 1 301.817 4.434 20 0 DIADMN CC(C)[C@H](C(=O)NOCc1ccccc1)c1cccc(Cl)c1 ZINC001463936117 1061536695 /nfs/dbraw/zinc/53/66/95/1061536695.db2.gz UQCXBZBVCYGRLW-KRWDZBQOSA-N 0 1 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YJIOCSZMEWMRBZ-SFHVURJKSA-N 0 1 324.811 4.371 20 0 DIADMN Cc1oc(-c2cccs2)nc1CNC[C@H]1C(C)(C)C1(F)F ZINC001474219936 1061779425 /nfs/dbraw/zinc/77/94/25/1061779425.db2.gz SGPIFSONMVUXGI-LBPRGKRZSA-N 0 1 312.385 4.092 20 0 DIADMN CCCCC1(C(=O)Nc2ccc3nc(C(F)F)[nH]c3c2)CC1 ZINC001458470569 1061781176 /nfs/dbraw/zinc/78/11/76/1061781176.db2.gz PIDMZUCJGTVBRM-UHFFFAOYSA-N 0 1 307.344 4.409 20 0 DIADMN CC(C)[C@H](O)[C@@H](NCc1ccc(F)cc1Cl)c1ccccc1 ZINC001474221168 1061781285 /nfs/dbraw/zinc/78/12/85/1061781285.db2.gz BBMPIZOJUUFWQG-ROUUACIJSA-N 0 1 321.823 4.327 20 0 DIADMN Cc1ccccc1[C@@H](Nc1nccnc1CN)C1CCC(C)CC1 ZINC001458470175 1061782814 /nfs/dbraw/zinc/78/28/14/1061782814.db2.gz QVPYLZUCMGCNIK-KJXMEXGPSA-N 0 1 324.472 4.223 20 0 DIADMN CCc1ccc(CNCc2cc(F)ccc2OC(F)F)cc1 ZINC001474222637 1061783637 /nfs/dbraw/zinc/78/36/37/1061783637.db2.gz VZVLBFXKJFMTBK-UHFFFAOYSA-N 0 1 309.331 4.279 20 0 DIADMN CCc1ccc(-c2nnc(-c3ccc(Cl)c(O)c3)o2)cc1 ZINC001253021184 1061789047 /nfs/dbraw/zinc/78/90/47/1061789047.db2.gz IZPJVOACCWVVNK-UHFFFAOYSA-N 0 1 300.745 4.325 20 0 DIADMN c1ccc(CN2CCC[C@H]2c2nnc(-c3ccccc3)o2)cc1 ZINC001253088645 1061800155 /nfs/dbraw/zinc/80/01/55/1061800155.db2.gz SFKLJUQABGEITN-KRWDZBQOSA-N 0 1 305.381 4.074 20 0 DIADMN CCOc1ccc(CNCc2ccc(C(C)(C)C)o2)cc1OC ZINC001474237442 1061801118 /nfs/dbraw/zinc/80/11/18/1061801118.db2.gz NJWAKVPMAORPDX-UHFFFAOYSA-N 0 1 317.429 4.274 20 0 DIADMN Cc1cccc2nc(NC[C@@H]3CCN3Cc3ccccc3)sc21 ZINC001458502440 1061804333 /nfs/dbraw/zinc/80/43/33/1061804333.db2.gz PSXHXXBSMNVLND-INIZCTEOSA-N 0 1 323.465 4.291 20 0 DIADMN Clc1nccc(CNCc2cccc3ncccc23)c1Cl ZINC001474258847 1061826921 /nfs/dbraw/zinc/82/69/21/1061826921.db2.gz QMHCLXHBLBCJPA-UHFFFAOYSA-N 0 1 318.207 4.226 20 0 DIADMN Brc1cc(CNCc2ccco2)cc2ccccc12 ZINC001474264664 1061830444 /nfs/dbraw/zinc/83/04/44/1061830444.db2.gz BWHMXJQYAGZCFG-UHFFFAOYSA-N 0 1 316.198 4.485 20 0 DIADMN CCCCCc1cc(C(=O)N2CCC(CCC(C)C)CC2)n[nH]1 ZINC001465933638 1061841177 /nfs/dbraw/zinc/84/11/77/1061841177.db2.gz YZHKXOJMTHWULU-UHFFFAOYSA-N 0 1 319.493 4.431 20 0 DIADMN Cc1ccc(CN[C@H](C)c2cc(Cl)cc3c2OCC3)s1 ZINC001474279366 1061848058 /nfs/dbraw/zinc/84/80/58/1061848058.db2.gz ROXOPONNLIMMJG-LLVKDONJSA-N 0 1 307.846 4.496 20 0 DIADMN c1cc(Oc2ccccc2)oc1CNC[C@H]1CC[C@@H](C2CC2)O1 ZINC001474284084 1061853614 /nfs/dbraw/zinc/85/36/14/1061853614.db2.gz JLKBZSTZJMBLLK-AEFFLSMTSA-N 0 1 313.397 4.119 20 0 DIADMN Cc1nc(CC(C)C)c(NC(=O)c2ccc(Cl)cc2O)s1 ZINC001466034893 1061863581 /nfs/dbraw/zinc/86/35/81/1061863581.db2.gz SAQSWSPCZUJTMU-UHFFFAOYSA-N 0 1 324.833 4.261 20 0 DIADMN CCc1ccc(NC(=O)c2cn[nH]c2-c2ccc(F)cc2)cc1C ZINC001466125612 1061882027 /nfs/dbraw/zinc/88/20/27/1061882027.db2.gz CIRVXJDCSYEGRR-UHFFFAOYSA-N 0 1 323.371 4.339 20 0 DIADMN COc1ccc2nc(SCCO[C@H]3CCCC[C@@H]3C)[nH]c2c1 ZINC001458738484 1061888051 /nfs/dbraw/zinc/88/80/51/1061888051.db2.gz YTKBSKYVTFECLL-LRDDRELGSA-N 0 1 320.458 4.259 20 0 DIADMN C[C@@H]1CN(Cc2ccccc2)CCN1Cc1cc(Cl)cs1 ZINC001474316525 1061892543 /nfs/dbraw/zinc/89/25/43/1061892543.db2.gz RIAZQWPLEFIBMX-CQSZACIVSA-N 0 1 320.889 4.108 20 0 DIADMN CSc1ccccc1NC(=O)CN(C)C[C@H]1CCC[C@H](C)C1 ZINC001474319725 1061896458 /nfs/dbraw/zinc/89/64/58/1061896458.db2.gz PLBASDYUDGCVQW-GJZGRUSLSA-N 0 1 320.502 4.105 20 0 DIADMN c1coc([C@H]2CCCCCN2Cc2cnn(CC3CCC3)c2)c1 ZINC001474321182 1061896769 /nfs/dbraw/zinc/89/67/69/1061896769.db2.gz ANGMNJHZYNKHRA-GOSISDBHSA-N 0 1 313.445 4.394 20 0 DIADMN CSc1ccccc1NC(=O)CN(C)C[C@H]1CCC[C@@H](C)C1 ZINC001474319724 1061897876 /nfs/dbraw/zinc/89/78/76/1061897876.db2.gz PLBASDYUDGCVQW-CABCVRRESA-N 0 1 320.502 4.105 20 0 DIADMN CC[C@H](C)[C@H](CN(C)Cc1csc(Br)c1)OC ZINC001474327321 1061911340 /nfs/dbraw/zinc/91/13/40/1061911340.db2.gz HKRALVVEALKKGV-JQWIXIFHSA-N 0 1 320.296 4.004 20 0 DIADMN CCCCC[C@@H](O)C[N@H+]1CCc2cccc(C(F)(F)F)c2C1 ZINC001253539512 1061914133 /nfs/dbraw/zinc/91/41/33/1061914133.db2.gz XQOBQEMWESJJRS-CQSZACIVSA-N 0 1 315.379 4.005 20 0 DIADMN CCCCC[C@@H](O)CN1CCc2cccc(C(F)(F)F)c2C1 ZINC001253539512 1061914154 /nfs/dbraw/zinc/91/41/54/1061914154.db2.gz XQOBQEMWESJJRS-CQSZACIVSA-N 0 1 315.379 4.005 20 0 DIADMN CCCCC[C@H](O)CN(Cc1ccccc1)Cc1cccnc1 ZINC001253533914 1061914602 /nfs/dbraw/zinc/91/46/02/1061914602.db2.gz XNUYEXXGCZJJEB-FQEVSTJZSA-N 0 1 312.457 4.025 20 0 DIADMN C=Cn1cc(CN(Cc2ccccc2)Cc2ccccc2C)cn1 ZINC001474337206 1061933029 /nfs/dbraw/zinc/93/30/29/1061933029.db2.gz VJIYFWWNKUYICW-UHFFFAOYSA-N 0 1 317.436 4.494 20 0 DIADMN ClC(Cl)=CCSc1nnc(CCC2CCCC2)[nH]1 ZINC001458904654 1061937201 /nfs/dbraw/zinc/93/72/01/1061937201.db2.gz RPPWECQRAIOKGE-UHFFFAOYSA-N 0 1 306.262 4.339 20 0 DIADMN ClC(Cl)=CCSc1nc(CCC2CCCC2)n[nH]1 ZINC001458904654 1061937218 /nfs/dbraw/zinc/93/72/18/1061937218.db2.gz RPPWECQRAIOKGE-UHFFFAOYSA-N 0 1 306.262 4.339 20 0 DIADMN Fc1ccccc1CCSc1nnc(CCC2CCCC2)[nH]1 ZINC001458904184 1061937644 /nfs/dbraw/zinc/93/76/44/1061937644.db2.gz RDTBHXRYVKCQNJ-UHFFFAOYSA-N 0 1 319.449 4.401 20 0 DIADMN Fc1ccccc1CCSc1nc(CCC2CCCC2)n[nH]1 ZINC001458904184 1061937663 /nfs/dbraw/zinc/93/76/63/1061937663.db2.gz RDTBHXRYVKCQNJ-UHFFFAOYSA-N 0 1 319.449 4.401 20 0 DIADMN Cc1ccc([C@@H]2CCCCCN2Cc2ccnn2CC2CC2)o1 ZINC001474337934 1061937864 /nfs/dbraw/zinc/93/78/64/1061937864.db2.gz DXPKWIBNAQXYBF-SFHVURJKSA-N 0 1 313.445 4.312 20 0 DIADMN Clc1ccccc1C[C@@H]1CCCN1Cc1cn(C2CC2)cn1 ZINC001474341132 1061941904 /nfs/dbraw/zinc/94/19/04/1061941904.db2.gz LLKOAPYCFAVUGJ-KRWDZBQOSA-N 0 1 315.848 4.079 20 0 DIADMN FC(F)(F)c1ccc2nc(SCc3ccns3)[nH]c2c1 ZINC001458919821 1061944659 /nfs/dbraw/zinc/94/46/59/1061944659.db2.gz JAXMQBSMTHGYMA-UHFFFAOYSA-N 0 1 315.345 4.331 20 0 DIADMN FC(F)(F)c1ccc2nc(S[C@@H]3CCSC3)[nH]c2c1 ZINC001458921391 1061946266 /nfs/dbraw/zinc/94/62/66/1061946266.db2.gz NUUKVXXXLVJIEL-MRVPVSSYSA-N 0 1 304.362 4.179 20 0 DIADMN COc1ncc(CN2CCC[C@H]2c2cc(C)ccc2C)s1 ZINC001474344771 1061947159 /nfs/dbraw/zinc/94/71/59/1061947159.db2.gz SVROUAQUGCYLTD-INIZCTEOSA-N 0 1 302.443 4.106 20 0 DIADMN Cc1cccc(-c2nnc(-c3cn[nH]c3-c3ccccc3)o2)c1 ZINC001253683818 1061950691 /nfs/dbraw/zinc/95/06/91/1061950691.db2.gz RYBKBGXCUAGCFH-UHFFFAOYSA-N 0 1 302.337 4.102 20 0 DIADMN O=C(c1cc(C2CCCCC2)[nH]n1)N1CC[C@H]2CCCC[C@H]2C1 ZINC001253685370 1061953324 /nfs/dbraw/zinc/95/33/24/1061953324.db2.gz AVCXXMXJLSOFKD-ZBFHGGJFSA-N 0 1 315.461 4.110 20 0 DIADMN Cc1cccc(-c2nnc(-c3ccc(O)c(C(F)(F)F)c3)o2)c1 ZINC001253712130 1061960146 /nfs/dbraw/zinc/96/01/46/1061960146.db2.gz ZYTJXMRCBCLKAE-UHFFFAOYSA-N 0 1 320.270 4.436 20 0 DIADMN C[C@@H]1Cc2ccccc2CN1Cc1ccc2ccc(F)c(F)c2n1 ZINC001474351641 1061962512 /nfs/dbraw/zinc/96/25/12/1061962512.db2.gz KREGEWFGAHBIBN-CYBMUJFWSA-N 0 1 324.374 4.460 20 0 DIADMN CCN(CCCO)Cc1c(Cl)cccc1Oc1ccccc1 ZINC001474351636 1061963484 /nfs/dbraw/zinc/96/34/84/1061963484.db2.gz KGHOCVNWIPHXAE-UHFFFAOYSA-N 0 1 319.832 4.337 20 0 DIADMN CN(CCOCc1ccccc1)Cc1ccc(C(F)F)c(F)c1 ZINC001474353480 1061967685 /nfs/dbraw/zinc/96/76/85/1061967685.db2.gz PZUZNKGWKMKADJ-UHFFFAOYSA-N 0 1 323.358 4.412 20 0 DIADMN CCc1ccc(F)cc1C(=O)Nc1cccc2c1CN(C1CC1)C2 ZINC001466605634 1061969766 /nfs/dbraw/zinc/96/97/66/1061969766.db2.gz DABLRKNERYFGJR-UHFFFAOYSA-N 0 1 324.399 4.118 20 0 DIADMN CC[C@H]1CCC[C@@]1(C)C(=O)Nc1cccc2c1CN(C1CC1)C2 ZINC001466605843 1061970126 /nfs/dbraw/zinc/97/01/26/1061970126.db2.gz JXQRELMACAUAQC-MGPUTAFESA-N 0 1 312.457 4.320 20 0 DIADMN Oc1ccc(CN(Cc2ccccc2F)C2CCC2)cc1F ZINC001474354074 1061971365 /nfs/dbraw/zinc/97/13/65/1061971365.db2.gz IXGXQXRCGUQWRE-UHFFFAOYSA-N 0 1 303.352 4.225 20 0 DIADMN CCS[C@H]1CC[C@H](N(C)Cc2ccc(F)c(F)c2F)C1 ZINC001474361254 1061985983 /nfs/dbraw/zinc/98/59/83/1061985983.db2.gz ZIUOEPZIZGUSJY-RYUDHWBXSA-N 0 1 303.393 4.210 20 0 DIADMN Cn1cccc1[C@H]1CCCCN1Cc1ccc2scnc2c1 ZINC001474358564 1061979123 /nfs/dbraw/zinc/97/91/23/1061979123.db2.gz KOKWMXOKPHUHQY-QGZVFWFLSA-N 0 1 311.454 4.362 20 0 DIADMN CCc1[nH]nc(Cl)c1CN1CCC[C@@](C)(c2ccccc2)C1 ZINC001474358433 1061981003 /nfs/dbraw/zinc/98/10/03/1061981003.db2.gz PTLGCUPWANBEGB-GOSISDBHSA-N 0 1 317.864 4.179 20 0 DIADMN Clc1cccc(-c2nnc(-c3cn[nH]c3-c3ccccc3)o2)c1 ZINC001253781116 1061981319 /nfs/dbraw/zinc/98/13/19/1061981319.db2.gz MISIHUMIYCIXMJ-UHFFFAOYSA-N 0 1 322.755 4.447 20 0 DIADMN CO[C@@H](CN(C)[C@H](C)c1ccc(Cl)cc1Cl)C1CC1 ZINC001474364683 1061997772 /nfs/dbraw/zinc/99/77/72/1061997772.db2.gz ISDMZYIBEDREKU-BMIGLBTASA-N 0 1 302.245 4.411 20 0 DIADMN Oc1ccc(-c2nnc(-c3cccc(Cl)c3)o2)c(F)c1F ZINC001253806559 1061986324 /nfs/dbraw/zinc/98/63/24/1061986324.db2.gz HOXWPDLTQZVGQF-UHFFFAOYSA-N 0 1 308.671 4.041 20 0 DIADMN Oc1cc(Cl)ccc1-c1nnc(-c2cccc(Cl)c2)o1 ZINC001253801348 1061987843 /nfs/dbraw/zinc/98/78/43/1061987843.db2.gz FAOZGOZCFXXJFN-UHFFFAOYSA-N 0 1 307.136 4.416 20 0 DIADMN CC[C@@H](c1ccccc1)[C@@H]1CCCN1Cc1nn(C)cc1Cl ZINC001474364249 1061990751 /nfs/dbraw/zinc/99/07/51/1061990751.db2.gz BMQOVCMEMOFJJD-YJBOKZPZSA-N 0 1 317.864 4.232 20 0 DIADMN CC(C)N(Cc1cnn(C2CCC2)c1)Cc1ccc(F)cc1 ZINC001474363050 1061991907 /nfs/dbraw/zinc/99/19/07/1061991907.db2.gz XJOBDFXARYVFAG-UHFFFAOYSA-N 0 1 301.409 4.158 20 0 DIADMN C[C@@H]1CCCc2ccccc2[C@@H]1NC(=O)c1cccc2nc[nH]c21 ZINC001466708404 1061992656 /nfs/dbraw/zinc/99/26/56/1061992656.db2.gz DQVDVQDJRUECKK-FZKQIMNGSA-N 0 1 319.408 4.006 20 0 DIADMN [O-]c1ccc(C[N@@H+]2CCCC[C@@H]2Cc2ccc(F)cc2)cc1F ZINC001474368092 1062001535 /nfs/dbraw/zinc/00/15/35/1062001535.db2.gz UPCVSXZOMRKTGF-QGZVFWFLSA-N 0 1 317.379 4.268 20 0 DIADMN [O-]c1ccc(C[N@H+]2CCCC[C@@H]2Cc2ccc(F)cc2)cc1F ZINC001474368092 1062001555 /nfs/dbraw/zinc/00/15/55/1062001555.db2.gz UPCVSXZOMRKTGF-QGZVFWFLSA-N 0 1 317.379 4.268 20 0 DIADMN [O-]c1ccc(C[N@@H+]2CCCC[C@H]2Cc2ccc(F)cc2)cc1F ZINC001474368090 1062002810 /nfs/dbraw/zinc/00/28/10/1062002810.db2.gz UPCVSXZOMRKTGF-KRWDZBQOSA-N 0 1 317.379 4.268 20 0 DIADMN [O-]c1ccc(C[N@H+]2CCCC[C@H]2Cc2ccc(F)cc2)cc1F ZINC001474368090 1062002833 /nfs/dbraw/zinc/00/28/33/1062002833.db2.gz UPCVSXZOMRKTGF-KRWDZBQOSA-N 0 1 317.379 4.268 20 0 DIADMN C[C@H]1C[N@H+](Cc2cccc(F)c2OCC(F)(F)F)CC[C@@H]1C 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CCN1CCN(Cc2sc3c(cccc3Cl)c2C)C[C@@H]1C ZINC001474380141 1062023368 /nfs/dbraw/zinc/02/33/68/1062023368.db2.gz MFAKLDIVWPNGJY-LBPRGKRZSA-N 0 1 322.905 4.389 20 0 DIADMN COc1ccc(C2CCN(Cc3cccn3C(F)F)CC2)cc1 ZINC001474380781 1062024295 /nfs/dbraw/zinc/02/42/95/1062024295.db2.gz BXQMEOZFASAOSW-UHFFFAOYSA-N 0 1 320.383 4.271 20 0 DIADMN Clc1ccc(-c2cc(-c3nnc(C4CC4)o3)[nH]n2)c(Cl)c1 ZINC001254102055 1062024569 /nfs/dbraw/zinc/02/45/69/1062024569.db2.gz DGHOLWVLZHEDEM-UHFFFAOYSA-N 0 1 321.167 4.311 20 0 DIADMN Cc1ccc(N2CCN(Cc3cc4ccc(C)cc4[nH]3)CC2)cc1 ZINC001474385625 1062034242 /nfs/dbraw/zinc/03/42/42/1062034242.db2.gz ADZDAPBJWQHYAX-UHFFFAOYSA-N 0 1 319.452 4.107 20 0 DIADMN CCC1(C)CCN(Cc2nc3ccc(Cl)cc3n2C)CC1 ZINC001474384436 1062035514 /nfs/dbraw/zinc/03/55/14/1062035514.db2.gz ZETVDTCXDPSPAL-UHFFFAOYSA-N 0 1 305.853 4.239 20 0 DIADMN CCCO[C@H]1CCCN(Cc2c(F)cccc2OCC)CC1 ZINC001474384580 1062036105 /nfs/dbraw/zinc/03/61/05/1062036105.db2.gz GXPAEDQMXHQUSS-HNNXBMFYSA-N 0 1 309.425 4.006 20 0 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CCCCC(CCCC)N1CC[C@@](O)(C(F)(F)F)[C@@H](F)C1 ZINC001258385246 1063628788 /nfs/dbraw/zinc/62/87/88/1063628788.db2.gz RWWHPLIEZCMQBJ-KBPBESRZSA-N 0 1 313.379 4.073 20 0 DIADMN CCCCC(CCCC)N1Cc2ccnn2C[C@H](COCC)C1 ZINC001258386181 1063628900 /nfs/dbraw/zinc/62/89/00/1063628900.db2.gz SMFDSUWMPAANSY-QGZVFWFLSA-N 0 1 321.509 4.100 20 0 DIADMN Cc1ccc(CN[C@H](c2ccccc2)[C@H](O)C(C)C)c(Cl)c1 ZINC001461654622 1063638864 /nfs/dbraw/zinc/63/88/64/1063638864.db2.gz SUSPWILDFOEQON-RTBURBONSA-N 0 1 317.860 4.496 20 0 DIADMN CC1(C)C[C@@]1(NCc1cnn(CC2CCC2)c1)c1ccccc1 ZINC001461653933 1063639109 /nfs/dbraw/zinc/63/91/09/1063639109.db2.gz ARERHBSMLHCOMM-HXUWFJFHSA-N 0 1 309.457 4.098 20 0 DIADMN Cc1cccc2c1CCC[C@@H]2NCc1nc2c(s1)CCCC2 ZINC001461653391 1063639369 /nfs/dbraw/zinc/63/93/69/1063639369.db2.gz PQAUPKKZVUNJRJ-INIZCTEOSA-N 0 1 312.482 4.498 20 0 DIADMN C[C@H](CC1CC1)N1CCO[C@H](c2cccc(C(F)(F)F)c2)C1 ZINC001258469848 1063665723 /nfs/dbraw/zinc/66/57/23/1063665723.db2.gz IVQANGUWDZDNSZ-WBMJQRKESA-N 0 1 313.363 4.267 20 0 DIADMN Oc1ccc(CNCc2cnc(-c3ccco3)s2)cc1Cl ZINC001461728828 1063682354 /nfs/dbraw/zinc/68/23/54/1063682354.db2.gz IENAEYJEIFDRRS-UHFFFAOYSA-N 0 1 320.801 4.052 20 0 DIADMN CC(C)(O)c1ccc(CNc2nc3ccc(Cl)cc3[nH]2)cc1 ZINC001461733085 1063686037 /nfs/dbraw/zinc/68/60/37/1063686037.db2.gz XTSYFAZOTDYTMQ-UHFFFAOYSA-N 0 1 315.804 4.056 20 0 DIADMN Cc1oc(C(C)(C)C)cc1CNCc1ccc2c(c1)C[C@@H](C)O2 ZINC001461738924 1063687983 /nfs/dbraw/zinc/68/79/83/1063687983.db2.gz WUOIMSMQNCEBNX-CYBMUJFWSA-N 0 1 313.441 4.499 20 0 DIADMN O=C(Nc1nc2cc(Cl)c(F)cc2[nH]1)[C@@H]1C[C@@H]2CCCC[C@H]12 ZINC001461741683 1063689964 /nfs/dbraw/zinc/68/99/64/1063689964.db2.gz ARYUFRRAXGTLCC-LPEHRKFASA-N 0 1 321.783 4.120 20 0 DIADMN CC(C)c1nc(CNCc2cscc2Cl)c2ccccn21 ZINC001461750778 1063694238 /nfs/dbraw/zinc/69/42/38/1063694238.db2.gz BLCDBEZZPXOOMQ-UHFFFAOYSA-N 0 1 319.861 4.462 20 0 DIADMN C[C@H]1CCC[C@@H](C(=O)Nc2nc3cc(Cl)c(F)cc3[nH]2)C1 ZINC001461750748 1063695383 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1063748990 /nfs/dbraw/zinc/74/89/90/1063748990.db2.gz PMBFQYZCAQZMIJ-UHFFFAOYSA-N 0 1 303.808 4.470 20 0 DIADMN COC(=O)C1(N(C)C[C@@H](C)c2cccc(Cl)c2)CCCCC1 ZINC001461857072 1063751002 /nfs/dbraw/zinc/75/10/02/1063751002.db2.gz FTQDWXMOGQWHBX-CQSZACIVSA-N 0 1 323.864 4.251 20 0 DIADMN CC[C@@H]1c2ccccc2CCN1Cc1cnn(CC2CCC2)c1 ZINC001461865777 1063760595 /nfs/dbraw/zinc/76/05/95/1063760595.db2.gz GVFFMZZTRUPAOJ-HXUWFJFHSA-N 0 1 309.457 4.193 20 0 DIADMN CCN(Cc1ccccc1C)Cc1ccc(OC)c(OC)c1F ZINC001461874313 1063763446 /nfs/dbraw/zinc/76/34/46/1063763446.db2.gz WVTBFUZLDRLVTL-UHFFFAOYSA-N 0 1 317.404 4.173 20 0 DIADMN Cc1ccc2ncc(CN3C[C@H](C)C[C@@H]3c3cccc(F)c3)n2c1 ZINC001461875001 1063766120 /nfs/dbraw/zinc/76/61/20/1063766120.db2.gz RGDGCIHYWDWYAP-DNVCBOLYSA-N 0 1 323.415 4.365 20 0 DIADMN CCOc1cc(CN2CCC[C@@](C)(CC)C2)cc(Cl)c1O ZINC001461877089 1063766864 /nfs/dbraw/zinc/76/68/64/1063766864.db2.gz OLTNATUXJWAQIP-QGZVFWFLSA-N 0 1 311.853 4.456 20 0 DIADMN Cc1cccc2nc(-c3nnc(-c4ccc(C)c(F)c4)o3)[nH]c21 ZINC001258727581 1063781327 /nfs/dbraw/zinc/78/13/27/1063781327.db2.gz GCCJTJZUVQAOHI-UHFFFAOYSA-N 0 1 308.316 4.036 20 0 DIADMN Cc1ccc(-c2ccccc2CN(C)Cc2cnccn2)c(C)c1 ZINC001461895664 1063782791 /nfs/dbraw/zinc/78/27/91/1063782791.db2.gz HECVKSDMOIZSEU-UHFFFAOYSA-N 0 1 317.436 4.392 20 0 DIADMN C[C@@H]1CN(Cc2ccc(Oc3ccccc3)o2)C[C@@H](C)S1 ZINC001461896881 1063782853 /nfs/dbraw/zinc/78/28/53/1063782853.db2.gz IOCJFVQMIDTLND-ZIAGYGMSSA-N 0 1 303.427 4.398 20 0 DIADMN Cc1ccc2cc(-c3nnc(-c4ccc(C)c(F)c4)o3)[nH]c2n1 ZINC001258737090 1063786648 /nfs/dbraw/zinc/78/66/48/1063786648.db2.gz JWFMCWRWMYHGID-UHFFFAOYSA-N 0 1 308.316 4.036 20 0 DIADMN CCN(Cc1cnn(Cc2ccccc2)c1Cl)[C@H](C)C(C)C ZINC001461902274 1063786824 /nfs/dbraw/zinc/78/68/24/1063786824.db2.gz VFENWVRQLPYBGF-OAHLLOKOSA-N 0 1 319.880 4.451 20 0 DIADMN C[C@@H](CN1CCN(c2cccs2)CC1)c1cccc(Cl)c1 ZINC001461902665 1063788249 /nfs/dbraw/zinc/78/82/49/1063788249.db2.gz PUMTURHXDKGDMH-AWEZNQCLSA-N 0 1 320.889 4.327 20 0 DIADMN C[C@@H](Cc1cccc(Cl)c1)NCc1c(F)ccc(F)c1F ZINC001258739165 1063788511 /nfs/dbraw/zinc/78/85/11/1063788511.db2.gz RIHMBYYXZYCOQG-JTQLQIEISA-N 0 1 313.750 4.478 20 0 DIADMN CCc1ccc([C@@H]2CCCCCN2Cc2[nH]nc(C)c2C)o1 ZINC001461906839 1063791795 /nfs/dbraw/zinc/79/17/95/1063791795.db2.gz WYJFSQOFHVINTE-KRWDZBQOSA-N 0 1 301.434 4.299 20 0 DIADMN Clc1cscc1CN1CCC[C@H](Nc2ccccc2)C1 ZINC001461911383 1063794482 /nfs/dbraw/zinc/79/44/82/1063794482.db2.gz GSIHPUGVSMNYFX-HNNXBMFYSA-N 0 1 306.862 4.478 20 0 DIADMN CCOC(=O)C1(N(C)CCc2ccc(C)c(C)c2)CCCCC1 ZINC001461913135 1063795371 /nfs/dbraw/zinc/79/53/71/1063795371.db2.gz NRZSXMUSXIVKJH-UHFFFAOYSA-N 0 1 317.473 4.044 20 0 DIADMN Nc1c(Cl)cc(Cl)cc1CN1CC[C@@H]1Cc1ccccc1 ZINC001461911851 1063795524 /nfs/dbraw/zinc/79/55/24/1063795524.db2.gz FKDVKTIUOIAHIM-OAHLLOKOSA-N 0 1 321.251 4.393 20 0 DIADMN Cc1cc([C@H]2CCCN2[C@@H](C)Cc2cccc(Cl)c2)no1 ZINC001258745741 1063796208 /nfs/dbraw/zinc/79/62/08/1063796208.db2.gz 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CCn1cc(CN(C)[C@H](C)c2ccco2)c(-c2ccccc2)n1 ZINC001462019771 1063884451 /nfs/dbraw/zinc/88/44/51/1063884451.db2.gz OLYGPKZOAYTQEY-OAHLLOKOSA-N 0 1 309.413 4.356 20 0 DIADMN COCCN(C/C=C/c1ccc(F)cc1F)Cc1cccs1 ZINC001462031657 1063891809 /nfs/dbraw/zinc/89/18/09/1063891809.db2.gz GZMIIBFZRHNODL-DUXPYHPUSA-N 0 1 323.408 4.188 20 0 DIADMN CO[C@H](Cc1ccccc1)CN(C)Cc1ccccc1Cl ZINC001462040273 1063895896 /nfs/dbraw/zinc/89/58/96/1063895896.db2.gz NTOHVFZFCYYQIO-QGZVFWFLSA-N 0 1 303.833 4.030 20 0 DIADMN COCc1ccc([C@@H]2CCC[N@H+]2Cc2ccc(OC)cc2C)o1 ZINC001462044279 1063897496 /nfs/dbraw/zinc/89/74/96/1063897496.db2.gz GVVFFSCXOLEMHM-SFHVURJKSA-N 0 1 315.413 4.080 20 0 DIADMN CCCN(CC(=O)OC(C)(C)C)C[C@@]1(C)C[C@@H]1c1ccccc1 ZINC001462065635 1063910938 /nfs/dbraw/zinc/91/09/38/1063910938.db2.gz OCZAUNXWDYXFDH-YLJYHZDGSA-N 0 1 317.473 4.234 20 0 DIADMN CCN(C)c1ccc(CN2CC=C(c3cccc(C)c3)CC2)cn1 ZINC001462068666 1063911925 /nfs/dbraw/zinc/91/19/25/1063911925.db2.gz CUOPZDCDABSFJY-UHFFFAOYSA-N 0 1 321.468 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PJFSYTSIAQVCID-LLVKDONJSA-N 0 1 307.463 4.193 20 0 DIADMN C[C@H](c1ccc(Cl)cc1Cl)N1CC[C@@H](c2nccn2C)C1 ZINC000560389178 332336360 /nfs/dbraw/zinc/33/63/60/332336360.db2.gz VTFCGOQSAFSWPM-VXGBXAGGSA-N 0 1 324.255 4.277 20 0 DIADMN Cc1cc(-c2ccccc2)ccc1NS(=O)(=O)c1ccoc1 ZINC000560439879 332339919 /nfs/dbraw/zinc/33/99/19/332339919.db2.gz HOHFFBDVTUERHF-UHFFFAOYSA-N 0 1 313.378 4.056 20 0 DIADMN COC(=O)c1csc([C@@H](C)N[C@@H]2CSc3ccccc32)c1 ZINC000560525016 332351484 /nfs/dbraw/zinc/35/14/84/332351484.db2.gz VKMGWDLIQAJKMC-ZWNOBZJWSA-N 0 1 319.451 4.032 20 0 DIADMN COC(=O)c1csc([C@@H](C)NCc2ccc(Cl)c(C)c2)c1 ZINC000560548063 332357508 /nfs/dbraw/zinc/35/75/08/332357508.db2.gz CUCQPPOSWQLKDS-LLVKDONJSA-N 0 1 323.845 4.347 20 0 DIADMN CCc1nn(C)c(CC)c1CN1CC2(CCC2)[C@H]1c1ccccc1 ZINC000560568768 332360723 /nfs/dbraw/zinc/36/07/23/332360723.db2.gz GWFJYUVGOZTJFF-HXUWFJFHSA-N 0 1 323.484 4.272 20 0 DIADMN CSc1cc(C)ccc1CN[C@@H](C)c1cnn(C(C)C)c1 ZINC000119289609 332368782 /nfs/dbraw/zinc/36/87/82/332368782.db2.gz DMAJODMYYNZXLL-AWEZNQCLSA-N 0 1 303.475 4.345 20 0 DIADMN CC(C)C[C@H]1CCCC[N@H+]1Cc1cccc(C(=O)[O-])c1Cl ZINC000566363544 332379137 /nfs/dbraw/zinc/37/91/37/332379137.db2.gz OFYXRXIEFDYUIU-CQSZACIVSA-N 0 1 309.837 4.439 20 0 DIADMN C[C@@]1(Cc2ccccc2)CCC[N@H+]1Cc1csc(C(=O)[O-])c1 ZINC000583386653 332379144 /nfs/dbraw/zinc/37/91/44/332379144.db2.gz GKKCCDVBWMRBAP-SFHVURJKSA-N 0 1 315.438 4.044 20 0 DIADMN C[C@]1(Cc2ccccc2)CCC[N@H+]1Cc1csc(C(=O)[O-])c1 ZINC000583386652 332379211 /nfs/dbraw/zinc/37/92/11/332379211.db2.gz GKKCCDVBWMRBAP-GOSISDBHSA-N 0 1 315.438 4.044 20 0 DIADMN C[C@@H](c1cc(Cl)ccc1Cl)[N@H+]1C[C@@H](C)[C@@](C)(C(=O)[O-])C1 ZINC000566367299 332382037 /nfs/dbraw/zinc/38/20/37/332382037.db2.gz OVLRDXFTUJFYCQ-FTGAXOIBSA-N 0 1 316.228 4.097 20 0 DIADMN C[C@H](N[C@@H](CO)c1ccc(F)cc1)c1ccc2ccccc2c1 ZINC000560904979 332393568 /nfs/dbraw/zinc/39/35/68/332393568.db2.gz YSZOAVSUYRPFPO-XOBRGWDASA-N 0 1 309.384 4.363 20 0 DIADMN O=C([O-])[C@@H]1C[C@@H]2CCCC[C@H]2[N@H+]1C/C=C/c1ccc(Cl)cc1 ZINC000560928005 332395389 /nfs/dbraw/zinc/39/53/89/332395389.db2.gz USUUWIQKBYJOFZ-UUABHQEXSA-N 0 1 319.832 4.071 20 0 DIADMN C[C@H]1COCC[C@H]1CNc1ccnc2cc(C(F)(F)F)ccc21 ZINC000561397756 332446563 /nfs/dbraw/zinc/44/65/63/332446563.db2.gz ZGJVIAAUUMQBSH-RYUDHWBXSA-N 0 1 324.346 4.338 20 0 DIADMN Cc1ccc(CNCc2ccc3c[nH]nc3c2)c(OC(C)(C)C)c1 ZINC000150970649 332464759 /nfs/dbraw/zinc/46/47/59/332464759.db2.gz MBXAVEMJJYTJEV-UHFFFAOYSA-N 0 1 323.440 4.338 20 0 DIADMN Cc1ccc(CN2CC(c3cccc(C(F)(F)F)c3)C2)nc1 ZINC000449659640 332466894 /nfs/dbraw/zinc/46/68/94/332466894.db2.gz BTMAQCRPAZUKKT-UHFFFAOYSA-N 0 1 306.331 4.008 20 0 DIADMN C[C@@H]1Cc2ccc(F)cc2[C@H]1NCc1cnn(-c2ccccc2)c1 ZINC000151035178 332488370 /nfs/dbraw/zinc/48/83/70/332488370.db2.gz JTGGXGLGSYBHNX-VLIAUNLRSA-N 0 1 321.399 4.035 20 0 DIADMN CC(C)(C)CCOc1cnccc1CNCc1cccs1 ZINC000561750765 332490536 /nfs/dbraw/zinc/49/05/36/332490536.db2.gz UEROGCXJYIXBFY-UHFFFAOYSA-N 0 1 304.459 4.248 20 0 DIADMN COC[C@@H](NCc1cc(C)sc1C)c1cccc(Cl)c1 ZINC000561752806 332490845 /nfs/dbraw/zinc/49/08/45/332490845.db2.gz LRWHAIIVLMZONQ-MRXNPFEDSA-N 0 1 309.862 4.496 20 0 DIADMN COc1ccncc1CN[C@H](c1ccc(Cl)cc1)[C@@H]1C[C@H]1C ZINC000561856421 332507290 /nfs/dbraw/zinc/50/72/90/332507290.db2.gz LSIDCENCZBEEFX-XHBKTUGNSA-N 0 1 316.832 4.231 20 0 DIADMN CC[C@H](NCc1ccc(Cl)cc1F)c1c(C)nn(C)c1C ZINC000427883385 332554812 /nfs/dbraw/zinc/55/48/12/332554812.db2.gz QKNLSCYQFOMNCZ-HNNXBMFYSA-N 0 1 309.816 4.070 20 0 DIADMN C[C@H](NC1(C(=O)Nc2ccccc2)CC1)c1cccc(Cl)c1 ZINC000427968479 332576062 /nfs/dbraw/zinc/57/60/62/332576062.db2.gz GAKHAOWSTZMBCA-ZDUSSCGKSA-N 0 1 314.816 4.162 20 0 DIADMN CCc1ccc([C@H](C)NC2(C(=O)Nc3ccccc3)CC2)cc1 ZINC000427980148 332578860 /nfs/dbraw/zinc/57/88/60/332578860.db2.gz LGAROXFOLLIGEA-HNNXBMFYSA-N 0 1 308.425 4.071 20 0 DIADMN C[C@H](N[C@@H](C)c1ccc(F)c(F)c1)c1ccc([S@](C)=O)cc1 ZINC000133277663 332586078 /nfs/dbraw/zinc/58/60/78/332586078.db2.gz OTZQNPCREAZZRO-YEZLUTFDSA-N 0 1 323.408 4.114 20 0 DIADMN Cc1ccc(CN[C@H]2CCOc3ccc(F)cc32)cc1Cl ZINC000443970249 332646768 /nfs/dbraw/zinc/64/67/68/332646768.db2.gz RCCMBZVKHBPNIP-INIZCTEOSA-N 0 1 305.780 4.401 20 0 DIADMN Fc1cccc2c1CC[C@@H]2NCc1cnc(C(F)(F)F)s1 ZINC000443978707 332646986 /nfs/dbraw/zinc/64/69/86/332646986.db2.gz LCJTTXSDJKPDFP-LBPRGKRZSA-N 0 1 316.323 4.078 20 0 DIADMN CC[C@H](N[C@@H](C)c1cncnc1C)c1ccccc1OC(F)F ZINC000565219520 332647320 /nfs/dbraw/zinc/64/73/20/332647320.db2.gz YAMYQGVWYUDSQB-WFASDCNBSA-N 0 1 321.371 4.188 20 0 DIADMN COc1cc2c(cc1F)nccc2N[C@H]1COc2ccc(C)cc21 ZINC000569752395 332675717 /nfs/dbraw/zinc/67/57/17/332675717.db2.gz YGKYGJHUCBUTQF-KRWDZBQOSA-N 0 1 324.355 4.237 20 0 DIADMN c1coc([C@H](NCC2(c3ccccn3)CCC2)c2ccccc2)c1 ZINC000569981668 332698885 /nfs/dbraw/zinc/69/88/85/332698885.db2.gz MYTCLGKGTWBOST-HXUWFJFHSA-N 0 1 318.420 4.476 20 0 DIADMN COc1ccc([C@H](C)NCc2cc3cc(C)ccc3o2)cc1O ZINC000570411242 332751978 /nfs/dbraw/zinc/75/19/78/332751978.db2.gz MGOGGTQOQISBOH-ZDUSSCGKSA-N 0 1 311.381 4.306 20 0 DIADMN FC(F)n1c2ccccc2nc1CN1C[C@H]2CCCC[C@@H]2C1 ZINC000177523213 332990162 /nfs/dbraw/zinc/99/01/62/332990162.db2.gz UPWHPWZWQLLWEX-CHWSQXEVSA-N 0 1 305.372 4.053 20 0 DIADMN CC(C)Oc1ccc([C@H](C)N[C@@H](C)c2cncc(F)c2)cc1 ZINC000178143133 333002122 /nfs/dbraw/zinc/00/21/22/333002122.db2.gz LFWACETYUGMPIY-KBPBESRZSA-N 0 1 302.393 4.420 20 0 DIADMN C[C@@H]1CC[C@H](C(=O)[O-])[C@H](C)[N@H+]1CC1CCC(C(C)(C)C)CC1 ZINC000580214294 333014032 /nfs/dbraw/zinc/01/40/32/333014032.db2.gz QKAONJXKGUUVIQ-CWHQUEMWSA-N 0 1 309.494 4.413 20 0 DIADMN Cc1cccc2nc(CCC(=O)Nc3ccc(Cl)cc3)[nH]c21 ZINC000178850522 333021516 /nfs/dbraw/zinc/02/15/16/333021516.db2.gz CDZBYCZOMSOKRE-UHFFFAOYSA-N 0 1 313.788 4.096 20 0 DIADMN CCC(CC)[C@H](NCc1cn(C(C)C)nn1)c1ccccc1 ZINC000320661142 335116601 /nfs/dbraw/zinc/11/66/01/335116601.db2.gz IAKDZVBNFWRPCB-SFHVURJKSA-N 0 1 300.450 4.126 20 0 DIADMN CC[C@@H](N[C@@H](C)c1ccc2c(c1)OCO2)c1ccccc1F ZINC000180054134 333026724 /nfs/dbraw/zinc/02/67/24/333026724.db2.gz BWIMSEIJESGBOO-BLLLJJGKSA-N 0 1 301.361 4.356 20 0 DIADMN O=C(Nc1ccccc1OCC1CC1)c1ccc(O)c(Cl)c1 ZINC000180057597 333026779 /nfs/dbraw/zinc/02/67/79/333026779.db2.gz HCWCVIASRFPYOS-UHFFFAOYSA-N 0 1 317.772 4.087 20 0 DIADMN CC[C@@H](NCc1cnn(Cc2ccccc2)c1)c1ccccc1F ZINC000180096278 333027358 /nfs/dbraw/zinc/02/73/58/333027358.db2.gz ZFNQFGCVGPLMII-HXUWFJFHSA-N 0 1 323.415 4.311 20 0 DIADMN Cc1ccc(NC(=O)CN[C@H](C)c2ccc(C)c(F)c2)c(C)c1 ZINC000181336857 333029977 /nfs/dbraw/zinc/02/99/77/333029977.db2.gz RLPDIKYHTZRCSJ-OAHLLOKOSA-N 0 1 314.404 4.040 20 0 DIADMN CC[C@@H](NCc1cccc2c1OCCCO2)c1cccc(F)c1 ZINC000188248836 333040542 /nfs/dbraw/zinc/04/05/42/333040542.db2.gz URBDDJHSEFKTRY-QGZVFWFLSA-N 0 1 315.388 4.228 20 0 DIADMN O=C(C[C@H]1C=CCCC1)Nc1ccc2nc(C(F)F)[nH]c2c1 ZINC000188861952 333057264 /nfs/dbraw/zinc/05/72/64/333057264.db2.gz MYEMHRAOIWQYKL-JTQLQIEISA-N 0 1 305.328 4.185 20 0 DIADMN Cc1cccc(CN(C)Cc2ccc(C)c(Br)c2)n1 ZINC000313769466 333068615 /nfs/dbraw/zinc/06/86/15/333068615.db2.gz OXAAYGCFJWRNHP-UHFFFAOYSA-N 0 1 319.246 4.093 20 0 DIADMN Cc1csc(C2(NCCOc3ccccc3Cl)CCC2)n1 ZINC000460350747 333069214 /nfs/dbraw/zinc/06/92/14/333069214.db2.gz RJPQEHWOQRUTHR-UHFFFAOYSA-N 0 1 322.861 4.153 20 0 DIADMN Cc1ccc(CN[C@H](C)c2cccc(Br)c2)nc1C ZINC000313860853 333073587 /nfs/dbraw/zinc/07/35/87/333073587.db2.gz WFHOJHFKRBSGCC-CYBMUJFWSA-N 0 1 319.246 4.312 20 0 DIADMN COc1cccc2cc([C@@H](C)NCc3ccc(C)c(C)n3)oc21 ZINC000313869744 333073814 /nfs/dbraw/zinc/07/38/14/333073814.db2.gz YRFUNVWFZJRVAG-CQSZACIVSA-N 0 1 310.397 4.304 20 0 DIADMN CC=Cc1ccc(N[C@H](c2nnc[nH]2)c2ccc(F)cc2)cc1 ZINC000580302033 333080352 /nfs/dbraw/zinc/08/03/52/333080352.db2.gz IPRBRFPBUHUPQU-YATRRXNKSA-N 0 1 308.360 4.178 20 0 DIADMN Clc1cccc(CNCc2cc(Cl)c3c(c2)OCCO3)c1 ZINC000022771512 335120015 /nfs/dbraw/zinc/12/00/15/335120015.db2.gz VCHFMABEKSCUSL-UHFFFAOYSA-N 0 1 324.207 4.054 20 0 DIADMN Cc1ccc(CN[C@H](C)c2ccc(Br)cc2)nc1C ZINC000314143975 333089291 /nfs/dbraw/zinc/08/92/91/333089291.db2.gz GNPVRFLINSOHPN-CYBMUJFWSA-N 0 1 319.246 4.312 20 0 DIADMN COc1ccc(CN[C@@H](C)c2cc(C)c(F)c(C)c2)c(F)c1 ZINC000540161706 333106717 /nfs/dbraw/zinc/10/67/17/333106717.db2.gz UNQYNOBEOZOEIP-ZDUSSCGKSA-N 0 1 305.368 4.441 20 0 DIADMN C[C@H](N=c1nc(-c2ccccc2)[nH]s1)c1c(F)cccc1F ZINC000462778850 333110635 /nfs/dbraw/zinc/11/06/35/333110635.db2.gz KWQLEACYQMXMOX-JTQLQIEISA-N 0 1 317.364 4.078 20 0 DIADMN CCCOc1ccc([C@@H](C)NCc2cc(F)ccc2OC)cc1 ZINC000462799044 333114208 /nfs/dbraw/zinc/11/42/08/333114208.db2.gz VZBQRLPWAKMNLC-CQSZACIVSA-N 0 1 317.404 4.474 20 0 DIADMN CS[C@H](C)CN[C@H](C)c1csc(-c2ccccc2F)n1 ZINC000462811098 333117997 /nfs/dbraw/zinc/11/79/97/333117997.db2.gz WGJVWAFVIFLDRV-GHMZBOCLSA-N 0 1 310.463 4.351 20 0 DIADMN Cc1ncncc1[C@H](C)N[C@H](C)c1ccc(-c2cccnc2)cc1 ZINC000516663329 333120415 /nfs/dbraw/zinc/12/04/15/333120415.db2.gz LLPREGZCMYEHFN-ZBFHGGJFSA-N 0 1 318.424 4.259 20 0 DIADMN CC(C)(C)c1nc2ccc(NC(=O)[C@H]3Cc4ccccc43)cc2[nH]1 ZINC000460695564 333125804 /nfs/dbraw/zinc/12/58/04/333125804.db2.gz HUALHLKBRXBCKM-HNNXBMFYSA-N 0 1 319.408 4.139 20 0 DIADMN CCC(C)(C)c1ccc(C[N@@H+](C[C@H](C)C(=O)[O-])C2CC2)cc1 ZINC000516656385 333136455 /nfs/dbraw/zinc/13/64/55/333136455.db2.gz ALOCPSAABHXRAJ-AWEZNQCLSA-N 0 1 303.446 4.059 20 0 DIADMN CCC(C)(C)c1ccc(C[N@@H+](C[C@@H](C)C(=O)[O-])C2CC2)cc1 ZINC000516656386 333136499 /nfs/dbraw/zinc/13/64/99/333136499.db2.gz ALOCPSAABHXRAJ-CQSZACIVSA-N 0 1 303.446 4.059 20 0 DIADMN CC(C)O[C@H]1C[C@H](NCc2csc(-c3ccco3)n2)C1(C)C ZINC000463027981 333140727 /nfs/dbraw/zinc/14/07/27/333140727.db2.gz ISHSSPVQMXEKHG-GJZGRUSLSA-N 0 1 320.458 4.085 20 0 DIADMN Cc1nn(C)cc1[C@H](C)N[C@@H](C)c1cc(C)ccc1OC(F)F ZINC000178716606 333142610 /nfs/dbraw/zinc/14/26/10/333142610.db2.gz WZOQJUQCSKFNSQ-RYUDHWBXSA-N 0 1 323.387 4.050 20 0 DIADMN Cc1nn(C)cc1[C@H](C)N[C@H]1C[C@H](C)Sc2sccc21 ZINC000178718066 333142827 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333173137 /nfs/dbraw/zinc/17/31/37/333173137.db2.gz YRSQIAZGYGJAJB-MRXNPFEDSA-N 0 1 302.462 4.008 20 0 DIADMN Cc1ccc(NC(=O)c2ccc(Br)c(O)c2)cc1C ZINC000228315483 333176361 /nfs/dbraw/zinc/17/63/61/333176361.db2.gz VOECWNBCZJCVNP-UHFFFAOYSA-N 0 1 320.186 4.024 20 0 DIADMN CCc1cnccc1[C@H](C)NCc1ccccc1Br ZINC000540203892 333180405 /nfs/dbraw/zinc/18/04/05/333180405.db2.gz ARRNXLPZDXPFBU-LBPRGKRZSA-N 0 1 319.246 4.257 20 0 DIADMN Cc1ccccc1[C@H](C(=O)[O-])[N@@H+]1CC[C@H](c2ccccc2)[C@@H](C)C1 ZINC000582067968 333196998 /nfs/dbraw/zinc/19/69/98/333196998.db2.gz RISZACNBSYVNDT-XKGZKEIXSA-N 0 1 323.436 4.246 20 0 DIADMN CCOc1ccccc1[C@@H](CC)N[C@@H](C)c1ccnc(OC)c1 ZINC000580345673 335123187 /nfs/dbraw/zinc/12/31/87/335123187.db2.gz PEBQHDWAPJWELW-WMLDXEAASA-N 0 1 314.429 4.291 20 0 DIADMN Clc1ccc(-c2cnc(CN3CCCC4(CC4)C3)o2)cc1 ZINC000186967487 333225674 /nfs/dbraw/zinc/22/56/74/333225674.db2.gz ZIIRJKFRHROJFP-UHFFFAOYSA-N 0 1 302.805 4.371 20 0 DIADMN O=C(Nc1cccc(Cl)c1O)c1ccc(OC2CCC2)cc1 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DIADMN Cc1cccc2c1OCC[C@H]2N[C@H](C)c1ccccc1N(C)C ZINC000189377301 337279029 /nfs/dbraw/zinc/27/90/29/337279029.db2.gz HJXWFSAKFWANMF-CRAIPNDOSA-N 0 1 310.441 4.235 20 0 DIADMN Cc1cccc2c1OCC[C@H]2N[C@H]1CCCOc2ccccc21 ZINC000189378634 337279076 /nfs/dbraw/zinc/27/90/76/337279076.db2.gz DMYUSYUEGRVASW-ZWKOTPCHSA-N 0 1 309.409 4.322 20 0 DIADMN Cc1cccc2c1OCC[C@@H]2N[C@H](C)c1ccccc1N(C)C ZINC000189467044 337279409 /nfs/dbraw/zinc/27/94/09/337279409.db2.gz HJXWFSAKFWANMF-QAPCUYQASA-N 0 1 310.441 4.235 20 0 DIADMN Oc1cccc2c1CCC[C@@H]2NCc1ccc2ccccc2n1 ZINC000191659902 337298272 /nfs/dbraw/zinc/29/82/72/337298272.db2.gz JLGBOWNODKVLNY-IBGZPJMESA-N 0 1 304.393 4.108 20 0 DIADMN Cc1nc(C)c(CN2CC[C@H](C(F)(F)F)C(C)(C)C2)s1 ZINC000191658978 337298315 /nfs/dbraw/zinc/29/83/15/337298315.db2.gz AVGXXKQDFXPGNV-LBPRGKRZSA-N 0 1 306.397 4.170 20 0 DIADMN C[C@H]1CCSCCN1Cc1ncc(-c2ccccc2)s1 ZINC000191814266 337300242 /nfs/dbraw/zinc/30/02/42/337300242.db2.gz WKEASYJXBBWEPA-ZDUSSCGKSA-N 0 1 304.484 4.138 20 0 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/nfs/dbraw/zinc/39/33/26/337393326.db2.gz NMPQJAWHYRQOMM-CYBMUJFWSA-N 0 1 317.433 4.002 20 0 DIADMN CC[C@H]1CC[C@@H](C)N1C(=O)c1cc(-c2ccccc2Cl)[nH]n1 ZINC000536804861 337394686 /nfs/dbraw/zinc/39/46/86/337394686.db2.gz CTBBYMUKLZFSJW-NEPJUHHUSA-N 0 1 317.820 4.133 20 0 DIADMN Cc1cc(Cl)cc2c1OCCC[C@@H]2NCc1cccnc1 ZINC000121758116 337396552 /nfs/dbraw/zinc/39/65/52/337396552.db2.gz LSLOXCGRQQQYAD-INIZCTEOSA-N 0 1 302.805 4.047 20 0 DIADMN Cc1noc(C)c1CN[C@H]1CCCOc2ccc(C(C)C)cc21 ZINC000126599432 337417309 /nfs/dbraw/zinc/41/73/09/337417309.db2.gz GVSZOPHSVXXEQL-SFHVURJKSA-N 0 1 314.429 4.418 20 0 DIADMN COc1cnccc1[C@@H](C)N[C@H](C)c1ccc(Cl)c(F)c1 ZINC000527099961 337469124 /nfs/dbraw/zinc/46/91/24/337469124.db2.gz YZXIKDIEXSASHD-GHMZBOCLSA-N 0 1 308.784 4.295 20 0 DIADMN N[C@H](C(=O)Nc1ccc2c(c1)oc1ccccc12)c1ccccc1 ZINC000238040430 337469888 /nfs/dbraw/zinc/46/98/88/337469888.db2.gz ZTTKSBYJBFITSD-IBGZPJMESA-N 0 1 316.360 4.225 20 0 DIADMN Cc1ccc(NC(=O)[C@H](NCC[C@H](C)F)c2ccccc2)cc1 ZINC000419178380 337475899 /nfs/dbraw/zinc/47/58/99/337475899.db2.gz UAKWYIPRQABNCE-MAUKXSAKSA-N 0 1 314.404 4.013 20 0 DIADMN COC1(C(F)(F)F)CCN([C@@H](C)c2cccc(Cl)c2)CC1 ZINC000419361171 337480944 /nfs/dbraw/zinc/48/09/44/337480944.db2.gz XKZZBTIQPYXPNM-NSHDSACASA-N 0 1 321.770 4.444 20 0 DIADMN C[C@@H](N[C@@H](C)c1nc2ccccc2o1)[C@H]1COc2ccccc21 ZINC000246098566 337510133 /nfs/dbraw/zinc/51/01/33/337510133.db2.gz KWLWLMBFEJWXDP-VNHYZAJKSA-N 0 1 308.381 4.043 20 0 DIADMN Cc1ccc(-c2noc(-c3ccc(O)c(Cl)c3)n2)c(F)c1 ZINC000445384315 337515982 /nfs/dbraw/zinc/51/59/82/337515982.db2.gz IBRMWINUSQDTIR-UHFFFAOYSA-N 0 1 304.708 4.210 20 0 DIADMN C[C@H](CF)NCc1cnn(C2CCCC2)c1-c1ccccc1 ZINC000421351419 337528032 /nfs/dbraw/zinc/52/80/32/337528032.db2.gz CAKFLOLBJNEODP-CQSZACIVSA-N 0 1 301.409 4.113 20 0 DIADMN CC(C)(C)n1cc(CN[C@@H](CC(F)F)c2ccccc2)cn1 ZINC000421366229 337532467 /nfs/dbraw/zinc/53/24/67/337532467.db2.gz CCXLFRQQJGCNFO-HNNXBMFYSA-N 0 1 307.388 4.124 20 0 DIADMN C[C@@H](NC[C@@H]1CC[C@@H](C)O1)c1nc(-c2ccccc2)cs1 ZINC000248971389 337569086 /nfs/dbraw/zinc/56/90/86/337569086.db2.gz CQJUAFBRMLTLRS-NFAWXSAZSA-N 0 1 302.443 4.028 20 0 DIADMN CCc1ccc([C@H](C)N[C@H](c2ccccc2F)[C@@H](C)O)cc1 ZINC000571690684 337569866 /nfs/dbraw/zinc/56/98/66/337569866.db2.gz BZFUPJLQIDHVNC-KSMMKXTCSA-N 0 1 301.405 4.161 20 0 DIADMN NC1(c2noc(C3CCC(c4ccccc4)CC3)n2)CCCC1 ZINC000261842754 337611467 /nfs/dbraw/zinc/61/14/67/337611467.db2.gz SEDUDPXJFYENSL-UHFFFAOYSA-N 0 1 311.429 4.239 20 0 DIADMN COc1ccc(CN[C@@H](c2ccc(OC)cc2F)C2CC2)cc1 ZINC000421803391 337644712 /nfs/dbraw/zinc/64/47/12/337644712.db2.gz QRGDQFSJLYVYGA-LJQANCHMSA-N 0 1 315.388 4.084 20 0 DIADMN COC1([C@H](C)NCc2coc(-c3ccccc3)n2)CCCCC1 ZINC000421830677 337647535 /nfs/dbraw/zinc/64/75/35/337647535.db2.gz KCSCWPMNHDNQAD-HNNXBMFYSA-N 0 1 314.429 4.169 20 0 DIADMN C[C@H](NCc1ccc(OC(F)F)cc1)c1ccncc1Cl ZINC000421811803 337647762 /nfs/dbraw/zinc/64/77/62/337647762.db2.gz ABYOAHFRSRQAKJ-JTQLQIEISA-N 0 1 312.747 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CN(CCCCc1ccccc1)Cc1cc(-c2ccco2)on1 ZINC000518994913 1042928588 /nfs/dbraw/zinc/92/85/88/1042928588.db2.gz LYHSGXBTEQFGHO-UHFFFAOYSA-N 0 1 310.397 4.389 20 0 DIADMN C[C@H](CCc1ccccc1)N1CCO[C@@H](c2ccc(F)cc2)C1 ZINC000519068761 1042931992 /nfs/dbraw/zinc/93/19/92/1042931992.db2.gz RHJSBWHWFNAFQP-OXQOHEQNSA-N 0 1 313.416 4.220 20 0 DIADMN C[C@H](CCc1ccccc1)N1CCO[C@H](c2ccc(F)cc2)C1 ZINC000519068762 1042932139 /nfs/dbraw/zinc/93/21/39/1042932139.db2.gz RHJSBWHWFNAFQP-UZLBHIALSA-N 0 1 313.416 4.220 20 0 DIADMN CCCCCN(C(=O)N[C@@H](C)Cc1cc(C)[nH]n1)[C@@H](C)CCC ZINC000426529920 1042932238 /nfs/dbraw/zinc/93/22/38/1042932238.db2.gz MWTMRADLKYMLPU-HOCLYGCPSA-N 0 1 322.497 4.040 20 0 DIADMN C[C@H](O)CN(Cc1csc(C2CCCC2)n1)C1CCCCC1 ZINC000519192375 1042937452 /nfs/dbraw/zinc/93/74/52/1042937452.db2.gz DRZIREPVDDJCJI-AWEZNQCLSA-N 0 1 322.518 4.316 20 0 DIADMN CCC[C@H](CN[C@@H](CC)c1nc(C(F)(F)F)cs1)OC ZINC000638700367 1042947279 /nfs/dbraw/zinc/94/72/79/1042947279.db2.gz GMAYRKUFGDMBPO-ZJUUUORDSA-N 0 1 310.385 4.018 20 0 DIADMN CC(C)C[C@H]1CCCCC[N@H+]1CCOc1cccc(C(=O)[O-])c1 ZINC000519412725 1042947435 /nfs/dbraw/zinc/94/74/35/1042947435.db2.gz IVWNGPLVIVAVOW-QGZVFWFLSA-N 0 1 319.445 4.054 20 0 DIADMN FC(F)(F)c1ccc(N2CCCCC2)c(NCc2cnc[nH]2)c1 ZINC000894421857 1042957571 /nfs/dbraw/zinc/95/75/71/1042957571.db2.gz IFLFCUHLHQFQJC-UHFFFAOYSA-N 0 1 324.350 4.031 20 0 DIADMN Cc1noc(C)c1C(C)(C)NCc1ccc(C(F)F)c(F)c1 ZINC000894435279 1042958277 /nfs/dbraw/zinc/95/82/77/1042958277.db2.gz BIFFYXOWWQFANR-UHFFFAOYSA-N 0 1 312.335 4.393 20 0 DIADMN CC[C@@H](N[C@H](c1ncccc1C)C(C)C)c1cccc(OC)n1 ZINC000925072712 1042958718 /nfs/dbraw/zinc/95/87/18/1042958718.db2.gz UVTDCVFHFFKURL-QAPCUYQASA-N 0 1 313.445 4.232 20 0 DIADMN Cn1ncc(CN2CC3(CCC3)[C@@H]2c2ccccc2)c1C1CC1 ZINC000894610645 1042970353 /nfs/dbraw/zinc/97/03/53/1042970353.db2.gz MEMUADCCPMWFOE-IBGZPJMESA-N 0 1 307.441 4.025 20 0 DIADMN C[C@H](c1ccc(OC(F)F)cc1)N1CCC[C@H](OC(F)F)C1 ZINC000679683280 1042970859 /nfs/dbraw/zinc/97/08/59/1042970859.db2.gz LIXWYMWMHKALMR-MFKMUULPSA-N 0 1 321.314 4.053 20 0 DIADMN CC(C)(C)c1ccc(C[NH2+][C@@H](C(=O)[O-])c2cccc(F)c2)s1 ZINC000426770717 1042980259 /nfs/dbraw/zinc/98/02/59/1042980259.db2.gz VFRKOFPPGYSXLU-OAHLLOKOSA-N 0 1 321.417 4.100 20 0 DIADMN Cc1cc(Cl)cc(CN2CC3(CCC3)[C@@H]2[C@H]2CCCO2)c1 ZINC000519656635 1042997411 /nfs/dbraw/zinc/99/74/11/1042997411.db2.gz OLBLYXMLZGXBAT-SJORKVTESA-N 0 1 305.849 4.182 20 0 DIADMN C[C@H](N[C@@H]1CCC1(C)C)c1nnc(-c2ccccc2F)s1 ZINC000519699819 1042998722 /nfs/dbraw/zinc/99/87/22/1042998722.db2.gz FBZPFVMAUSQCOA-GXFFZTMASA-N 0 1 305.422 4.183 20 0 DIADMN CCC[C@@]1(C)CCC[N@@H+](Cc2ccc(C(=O)[O-])c(Cl)c2)C1 ZINC000519703439 1042998820 /nfs/dbraw/zinc/99/88/20/1042998820.db2.gz KLXHCUBEPPGHIZ-KRWDZBQOSA-N 0 1 309.837 4.440 20 0 DIADMN CC[C@H](c1ccccc1OC)N(C)Cc1cnn(CC(C)C)c1 ZINC000519692093 1042999603 /nfs/dbraw/zinc/99/96/03/1042999603.db2.gz IYFVZTJTSSYYBW-GOSISDBHSA-N 0 1 315.461 4.131 20 0 DIADMN CCc1oc(C(=O)[O-])cc1C[N@H+]1CCCCC[C@@H]1CC(C)C ZINC000519708615 1043000091 /nfs/dbraw/zinc/00/00/91/1043000091.db2.gz PENNUCIASUQFHA-OAHLLOKOSA-N 0 1 307.434 4.331 20 0 DIADMN Clc1ccc([C@@H](Cc2cccnc2)NCc2ccco2)cc1 ZINC000519792958 1043002206 /nfs/dbraw/zinc/00/22/06/1043002206.db2.gz MIYJYNPTJKJLAU-GOSISDBHSA-N 0 1 312.800 4.402 20 0 DIADMN C[C@H]1Oc2ccccc2[C@@H]1NCc1cccc(OC(F)(F)F)c1 ZINC000519779423 1043003136 /nfs/dbraw/zinc/00/31/36/1043003136.db2.gz NTDVDBBDNCWORN-BDJLRTHQSA-N 0 1 323.314 4.197 20 0 DIADMN CCc1sc(-c2nnc(CN(C(C)C)C3CCC3)o2)cc1C ZINC000440665115 1043003398 /nfs/dbraw/zinc/00/33/98/1043003398.db2.gz QUQIPHJCMXDRPX-UHFFFAOYSA-N 0 1 319.474 4.432 20 0 DIADMN CSCCCN[C@H](c1ccc(Cl)cc1)c1ccccn1 ZINC000925092935 1043006522 /nfs/dbraw/zinc/00/65/22/1043006522.db2.gz FGPQQAHBPQXGJA-MRXNPFEDSA-N 0 1 306.862 4.167 20 0 DIADMN C[N@@H+](Cc1c([O-])ccc2cc(Br)ccc21)CC1CC1 ZINC000048961386 1043006557 /nfs/dbraw/zinc/00/65/57/1043006557.db2.gz RZGNTODLNBLTSO-UHFFFAOYSA-N 0 1 320.230 4.150 20 0 DIADMN C[N@H+](Cc1c([O-])ccc2cc(Br)ccc21)CC1CC1 ZINC000048961386 1043006572 /nfs/dbraw/zinc/00/65/72/1043006572.db2.gz RZGNTODLNBLTSO-UHFFFAOYSA-N 0 1 320.230 4.150 20 0 DIADMN Cc1cc(C)cc(CCN[C@H](c2ncc[nH]2)c2ccc(F)cc2)c1 ZINC000188058189 1043009133 /nfs/dbraw/zinc/00/91/33/1043009133.db2.gz UPVLWIGFKZLZFH-IBGZPJMESA-N 0 1 323.415 4.087 20 0 DIADMN CC[C@H](F)C[N@@H+](CCc1ccccn1)Cc1ccc(F)cc1 ZINC000440782858 1043009579 /nfs/dbraw/zinc/00/95/79/1043009579.db2.gz PAJARGGTMDDJDX-INIZCTEOSA-N 0 1 304.384 4.014 20 0 DIADMN CC[C@H](F)CN(CCc1ccccn1)Cc1ccc(F)cc1 ZINC000440782858 1043009584 /nfs/dbraw/zinc/00/95/84/1043009584.db2.gz PAJARGGTMDDJDX-INIZCTEOSA-N 0 1 304.384 4.014 20 0 DIADMN CC(C)C[C@H]1CCCCCN1C(=O)c1ccc(O)c(Cl)c1 ZINC000440925878 1043013982 /nfs/dbraw/zinc/01/39/82/1043013982.db2.gz YWPBBEAJAYIAAP-CQSZACIVSA-N 0 1 309.837 4.477 20 0 DIADMN Cc1nccnc1[C@@H](C)N[C@H](Cc1ccccc1)c1cccs1 ZINC000188204475 1043015712 /nfs/dbraw/zinc/01/57/12/1043015712.db2.gz GDZDGBPGNMVEDR-NVXWUHKLSA-N 0 1 323.465 4.481 20 0 DIADMN CC(C)CC1(CN[C@@H](c2ncc[nH]2)c2ccc(F)cc2)CC1 ZINC000188230029 1043017738 /nfs/dbraw/zinc/01/77/38/1043017738.db2.gz CYUFGUARLWAPDU-MRXNPFEDSA-N 0 1 301.409 4.054 20 0 DIADMN Cc1cccc(C)c1CCN[C@@H](c1ncc[nH]1)c1ccc(F)cc1 ZINC000188241167 1043018406 /nfs/dbraw/zinc/01/84/06/1043018406.db2.gz UETVAWHUQYJWST-LJQANCHMSA-N 0 1 323.415 4.087 20 0 DIADMN CC(C)c1noc([C@H](C)N2C[C@@H](c3ccccc3)C(C)(C)C2)n1 ZINC000441075955 1043018584 /nfs/dbraw/zinc/01/85/84/1043018584.db2.gz CJBSQXBRYPWFAV-HOCLYGCPSA-N 0 1 313.445 4.380 20 0 DIADMN C[C@H](c1nc(C2CC2)no1)N1C[C@@H](c2ccccc2)C(C)(C)C1 ZINC000441094763 1043019079 /nfs/dbraw/zinc/01/90/79/1043019079.db2.gz QGNHHLIOMVWALT-CJNGLKHVSA-N 0 1 311.429 4.134 20 0 DIADMN CCOc1ccc(C(C)=O)cc1CN1CCCC[C@@H](SC)C1 ZINC000441099491 1043019313 /nfs/dbraw/zinc/01/93/13/1043019313.db2.gz FDEIEUJXDGNTGH-QGZVFWFLSA-N 0 1 321.486 4.005 20 0 DIADMN CCCN(Cc1nc(-c2ccco2)no1)[C@H]1CCc2ccccc21 ZINC000520172020 1043020724 /nfs/dbraw/zinc/02/07/24/1043020724.db2.gz PHMWNXJSDKRPEG-INIZCTEOSA-N 0 1 323.396 4.229 20 0 DIADMN CCCCOc1ncccc1CNCc1cc(C)c(C)cc1C ZINC000520217156 1043025238 /nfs/dbraw/zinc/02/52/38/1043025238.db2.gz JLLLCDZNPLFSMJ-UHFFFAOYSA-N 0 1 312.457 4.476 20 0 DIADMN Cc1sc(NC(=O)CN(C)CC2CCCCC2)c(C)c1C ZINC000441235858 1043028448 /nfs/dbraw/zinc/02/84/48/1043028448.db2.gz PVZWKKLTFGCVSA-UHFFFAOYSA-N 0 1 308.491 4.124 20 0 DIADMN C[C@@H](c1c(F)cccc1F)N(C)CCc1ccc2c(c1)CCO2 ZINC000441237008 1043029362 /nfs/dbraw/zinc/02/93/62/1043029362.db2.gz VRHALJVEJXBZDG-ZDUSSCGKSA-N 0 1 317.379 4.135 20 0 DIADMN CSC[C@@H](C)N[C@H](C)c1ncc(C(F)(F)F)cc1Cl ZINC000925099280 1043029416 /nfs/dbraw/zinc/02/94/16/1043029416.db2.gz XGLXPOMBEYGMHG-HTQZYQBOSA-N 0 1 312.788 4.156 20 0 DIADMN CSc1ccc(OCCN(C)Cc2ccccc2F)cc1 ZINC000441226844 1043029783 /nfs/dbraw/zinc/02/97/83/1043029783.db2.gz OUUQJHVZDKDGBV-UHFFFAOYSA-N 0 1 305.418 4.058 20 0 DIADMN C[C@@H](c1cc(F)ccc1F)[N@@H+](C)CCc1ccc2c(c1)CCO2 ZINC000441232539 1043030130 /nfs/dbraw/zinc/03/01/30/1043030130.db2.gz LTRICWHYENJNHL-ZDUSSCGKSA-N 0 1 317.379 4.135 20 0 DIADMN c1coc(CN(CCc2ccc3c(c2)CCO3)Cc2ccco2)c1 ZINC000441246440 1043030160 /nfs/dbraw/zinc/03/01/60/1043030160.db2.gz PAUPTZHFDCXLEN-UHFFFAOYSA-N 0 1 323.392 4.052 20 0 DIADMN CO[C@@H]1CCN(Cc2cc3ccnc(Cl)c3s2)CC1(C)C ZINC000894906005 1043034721 /nfs/dbraw/zinc/03/47/21/1043034721.db2.gz XNSVDUFYQSQOTH-CYBMUJFWSA-N 0 1 324.877 4.197 20 0 DIADMN COC(=O)c1cc(CN(C)[C@@H](C)c2cccc(Cl)c2)c(C)o1 ZINC000520353182 1043038315 /nfs/dbraw/zinc/03/83/15/1043038315.db2.gz VYSIMABYPMPRKD-NSHDSACASA-N 0 1 321.804 4.221 20 0 DIADMN CO[C@H]1CCN(Cc2cc(Cl)ccc2OCC2CC2)[C@@H](C)C1 ZINC000441343526 1043039047 /nfs/dbraw/zinc/03/90/47/1043039047.db2.gz AAWSYBCOOPPJSS-GUYCJALGSA-N 0 1 323.864 4.128 20 0 DIADMN CN(C)c1cccc([C@@H]2CCCN2Cc2ccc(F)c(F)c2)c1 ZINC000441369998 1043041274 /nfs/dbraw/zinc/04/12/74/1043041274.db2.gz PEHOWRQEZYJHMD-IBGZPJMESA-N 0 1 316.395 4.368 20 0 DIADMN Cc1ccc([C@@H]2CCC[C@H]2N(C)Cc2nc(C(C)C)no2)cc1 ZINC000441379580 1043041842 /nfs/dbraw/zinc/04/18/42/1043041842.db2.gz PFBIOPNCIQNRHZ-DLBZAZTESA-N 0 1 313.445 4.270 20 0 DIADMN Cc1nc(C(C)C)sc1[C@H](C)N[C@@H]1COCc2ccccc21 ZINC000417354802 1043044118 /nfs/dbraw/zinc/04/41/18/1043044118.db2.gz CRUPXNJYLLYDHL-BLLLJJGKSA-N 0 1 316.470 4.497 20 0 DIADMN COC(=O)c1coc([C@H](C)N[C@@H](C)c2ccc(C3CC3)cc2)c1 ZINC000417358186 1043044207 /nfs/dbraw/zinc/04/42/07/1043044207.db2.gz SRLBDGAGAMPTGS-STQMWFEESA-N 0 1 313.397 4.355 20 0 DIADMN CCOc1ccc(CN[C@H](C)c2ccc(F)c(F)c2)cc1F ZINC000112544747 1043047924 /nfs/dbraw/zinc/04/79/24/1043047924.db2.gz JZDQXKXXTLLJCT-LLVKDONJSA-N 0 1 309.331 4.353 20 0 DIADMN Cc1cc(C)c2nc(N(C(=N)N)c3ccc(F)cc3)ccc2c1 ZINC001167991762 1043055393 /nfs/dbraw/zinc/05/53/93/1043055393.db2.gz FNLYBKPDGGXEIH-UHFFFAOYSA-N 0 1 308.360 4.022 20 0 DIADMN Cc1cccc2nc(CNc3nc(-c4ccccc4)ns3)[nH]c21 ZINC000123183238 1043058973 /nfs/dbraw/zinc/05/89/73/1043058973.db2.gz MMLGGRSKEFWUAR-UHFFFAOYSA-N 0 1 321.409 4.002 20 0 DIADMN COc1cc(F)c([C@H](C)N[C@@H](C)c2cccc(F)c2)cc1OC ZINC000174094723 1043059755 /nfs/dbraw/zinc/05/97/55/1043059755.db2.gz MCSXMVQQNPPVBL-RYUDHWBXSA-N 0 1 321.367 4.394 20 0 DIADMN C[C@@H](c1nc(-c2cccnc2)no1)N(C)CCC1CCCCC1 ZINC000112979461 1043059783 /nfs/dbraw/zinc/05/97/83/1043059783.db2.gz ZEDOAWNFRKJURO-AWEZNQCLSA-N 0 1 314.433 4.095 20 0 DIADMN Brc1ccsc1CNCc1cccc2[nH]ccc21 ZINC000112838145 1043060657 /nfs/dbraw/zinc/06/06/57/1043060657.db2.gz ZGSQJUSTDGPVBV-UHFFFAOYSA-N 0 1 321.243 4.282 20 0 DIADMN CCN(c1ccc(N[C@H]2CCCc3nn(C)cc32)cc1)C(C)C ZINC000794815962 1043060924 /nfs/dbraw/zinc/06/09/24/1043060924.db2.gz JUCYXTRFGVXADZ-SFHVURJKSA-N 0 1 312.461 4.144 20 0 DIADMN c1cc2c(o1)CCC[C@@H]2NCc1ccc(Oc2cnccn2)cc1 ZINC000174406216 1043066409 /nfs/dbraw/zinc/06/64/09/1043066409.db2.gz MGJWLCNHRREWCC-KRWDZBQOSA-N 0 1 321.380 4.029 20 0 DIADMN CC[C@](C)(NCc1cccc2cccnc21)c1nc(C)cs1 ZINC000174502322 1043067566 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4.089 20 0 DIADMN Cc1ccc([C@H]2OCCC[C@@H]2NCc2nc3ccccc3o2)cc1 ZINC000638729198 1046338778 /nfs/dbraw/zinc/33/87/78/1046338778.db2.gz KBQRPFKXHOAZPS-FXAWDEMLSA-N 0 1 322.408 4.146 20 0 DIADMN Cc1cnc(CNCC[C@H](C)c2cccc(C(F)(F)F)c2)o1 ZINC000638734352 1046339003 /nfs/dbraw/zinc/33/90/03/1046339003.db2.gz KWTDMMSXHSQWSY-NSHDSACASA-N 0 1 312.335 4.285 20 0 DIADMN CC(C)(C)c1ccncc1CNCc1nccc2ccccc21 ZINC000666417213 1046339150 /nfs/dbraw/zinc/33/91/50/1046339150.db2.gz MJTQWHFOOBEPRL-UHFFFAOYSA-N 0 1 305.425 4.217 20 0 DIADMN CCN(Cc1ccc(C)cc1)Cc1c2cc[nH]c2ncc1Cl ZINC001138952971 1046339175 /nfs/dbraw/zinc/33/91/75/1046339175.db2.gz HNOOXTFSPCHRLO-UHFFFAOYSA-N 0 1 313.832 4.498 20 0 DIADMN CC1(C)C[C@H](c2ccccc2)C[N@H+]1Cc1ccsc1C(=O)[O-] ZINC000903934863 1046339371 /nfs/dbraw/zinc/33/93/71/1046339371.db2.gz SEOJBHVCVXHURL-HNNXBMFYSA-N 0 1 315.438 4.214 20 0 DIADMN C[C@@]1(Cc2cccs2)CCC[N@H+]1Cc1csc(C(=O)[O-])c1 ZINC000903933485 1046339423 /nfs/dbraw/zinc/33/94/23/1046339423.db2.gz AAFKCPIFHMZGAC-INIZCTEOSA-N 0 1 321.467 4.105 20 0 DIADMN C[C@@]1(Cc2cccs2)CCC[N@H+]1Cc1cc(C(=O)[O-])cs1 ZINC000903934974 1046340092 /nfs/dbraw/zinc/34/00/92/1046340092.db2.gz SVTDOCGXCBFZJI-INIZCTEOSA-N 0 1 321.467 4.105 20 0 DIADMN CC(C)c1ccccc1C[N@H+]1CC[C@H](C(=O)[O-])[C@H]2CCCC[C@H]21 ZINC000903906168 1046340937 /nfs/dbraw/zinc/34/09/37/1046340937.db2.gz FCUKPMMAEWCYRK-CEXWTWQISA-N 0 1 315.457 4.275 20 0 DIADMN Cc1ccc(C[N@H+]2C[C@@H](c3ccccc3)CC2(C)C)cc1C(=O)[O-] ZINC000903933766 1046341030 /nfs/dbraw/zinc/34/10/30/1046341030.db2.gz GNEXUDZAPIGODM-SFHVURJKSA-N 0 1 323.436 4.461 20 0 DIADMN CC(C)c1ccccc1C[N@H+]1CC[C@H](C(=O)[O-])[C@@H]2CCCC[C@H]21 ZINC000903906170 1046341417 /nfs/dbraw/zinc/34/14/17/1046341417.db2.gz FCUKPMMAEWCYRK-GBESFXJTSA-N 0 1 315.457 4.275 20 0 DIADMN C[C@@H]1C[C@H](C)[N@@H+](CCCc2ccc(Cl)cc2)[C@H](C)[C@@H]1C(=O)[O-] ZINC000903948088 1046342985 /nfs/dbraw/zinc/34/29/85/1046342985.db2.gz BUVQIDZNAKHZHH-UMPJEAMMSA-N 0 1 323.864 4.092 20 0 DIADMN CC(C)O[C@H](CNCc1nc(C2CC2)cs1)c1ccccc1 ZINC000638770848 1046343166 /nfs/dbraw/zinc/34/31/66/1046343166.db2.gz SSGHVLDGKWNUBI-QGZVFWFLSA-N 0 1 316.470 4.276 20 0 DIADMN CCOc1ccc(Br)cc1CN1C[C@@H](C)CC12CC2 ZINC001138992071 1046351133 /nfs/dbraw/zinc/35/11/33/1046351133.db2.gz CKSFCZTVGBFPMA-LBPRGKRZSA-N 0 1 324.262 4.222 20 0 DIADMN C[C@@H]1C[C@H](C)[N@@H+](CCCc2ccc(Cl)cc2)[C@@H](C)[C@@H]1C(=O)[O-] ZINC000903948089 1046344118 /nfs/dbraw/zinc/34/41/18/1046344118.db2.gz BUVQIDZNAKHZHH-XJIUQZFPSA-N 0 1 323.864 4.092 20 0 DIADMN c1nnc([C@@H](Nc2cncc3ccccc32)C2CCCCC2)[nH]1 ZINC000638817535 1046344338 /nfs/dbraw/zinc/34/43/38/1046344338.db2.gz NEQKRBKPRCUNFB-KRWDZBQOSA-N 0 1 307.401 4.086 20 0 DIADMN Cc1cc(CN[C@@H]2c3ccccc3NC2(C)C)cnc1Cl ZINC000903948334 1046344307 /nfs/dbraw/zinc/34/43/07/1046344307.db2.gz NVAFNLDLBWGJJA-OAHLLOKOSA-N 0 1 301.821 4.078 20 0 DIADMN Nc1c(F)cccc1CN[C@H]1CCCOc2cc(Cl)ccc21 ZINC000638838897 1046345786 /nfs/dbraw/zinc/34/57/86/1046345786.db2.gz SDVOKQVVNGJUIQ-HNNXBMFYSA-N 0 1 320.795 4.065 20 0 DIADMN Cc1cccc(C2=CC[N@@H+](Cc3cccc(C(=O)[O-])c3)CC2)c1C ZINC000903963092 1046346291 /nfs/dbraw/zinc/34/62/91/1046346291.db2.gz WGSWHCCPIZMXIV-UHFFFAOYSA-N 0 1 321.420 4.291 20 0 DIADMN CC(C)COc1ccc(CN2CC[C@@H](C(F)(F)F)C2)cc1 ZINC001138970889 1046346922 /nfs/dbraw/zinc/34/69/22/1046346922.db2.gz ALQJJKVNAFYLOW-CQSZACIVSA-N 0 1 301.352 4.106 20 0 DIADMN CCCCc1oc2ccccc2c1C[N@H+]1CC[C@@](C)(C(=O)[O-])C1 ZINC000263523209 1046348777 /nfs/dbraw/zinc/34/87/77/1046348777.db2.gz RZCAXHWXOLVDOR-LJQANCHMSA-N 0 1 315.413 4.072 20 0 DIADMN CC(C)Oc1cccc(CN(C)CCC(=O)c2cccs2)c1 ZINC001138985942 1046350475 /nfs/dbraw/zinc/35/04/75/1046350475.db2.gz SJQQTXJKVONWIU-UHFFFAOYSA-N 0 1 317.454 4.240 20 0 DIADMN CCSc1cccc(C[N@@H+]2[C@H](C(=O)[O-])C[C@H]3CCCC[C@@H]32)c1 ZINC000263535805 1046352550 /nfs/dbraw/zinc/35/25/50/1046352550.db2.gz ZCVAPNCPGIMPIT-PVAVHDDUSA-N 0 1 319.470 4.016 20 0 DIADMN Cc1nc2ccccc2nc1CN[C@H]1CCCc2sccc21 ZINC000639055766 1046355110 /nfs/dbraw/zinc/35/51/10/1046355110.db2.gz YNBWAXODDCPYHX-AWEZNQCLSA-N 0 1 309.438 4.167 20 0 DIADMN CC[C@](C)(NC(=O)Nc1ccc2nc(C(F)F)[nH]c2c1)C1CC1 ZINC000666454011 1046355060 /nfs/dbraw/zinc/35/50/60/1046355060.db2.gz YDFMRQUQEBVKDD-INIZCTEOSA-N 0 1 322.359 4.201 20 0 DIADMN COc1cc(CN[C@@H]2CCc3ccc(C(C)C)cc32)sn1 ZINC000639088118 1046355502 /nfs/dbraw/zinc/35/55/02/1046355502.db2.gz GIQSDNSRNHPRNY-MRXNPFEDSA-N 0 1 302.443 4.052 20 0 DIADMN C[C@@H]1CN(Cc2cncc3ccccc32)Cc2ccccc2O1 ZINC000795435795 1046356223 /nfs/dbraw/zinc/35/62/23/1046356223.db2.gz PDIPHWRYHBZVHM-OAHLLOKOSA-N 0 1 304.393 4.018 20 0 DIADMN Cc1nc([C@H]2CCCN2Cc2cccc3ncccc23)cs1 ZINC000639059631 1046357591 /nfs/dbraw/zinc/35/75/91/1046357591.db2.gz KMUMRGNIZJOSKU-GOSISDBHSA-N 0 1 309.438 4.337 20 0 DIADMN CC1(C)CN(Cc2ccc(C(F)F)nc2)CC[C@@H]1C(F)(F)F ZINC000639100498 1046358151 /nfs/dbraw/zinc/35/81/51/1046358151.db2.gz WZKFUWNQSRKYNX-LBPRGKRZSA-N 0 1 322.321 4.430 20 0 DIADMN CC(C)c1ccc2c(c1)[C@@H](N[C@H](c1nccn1C)C1CC1)CC2 ZINC000639095490 1046359111 /nfs/dbraw/zinc/35/91/11/1046359111.db2.gz SLMSUGBLCUWPCN-OALUTQOASA-N 0 1 309.457 4.272 20 0 DIADMN CN(CC(=O)Nc1ccc(-c2ccco2)cc1F)CC(C)(C)C ZINC001139042094 1046366926 /nfs/dbraw/zinc/36/69/26/1046366926.db2.gz GYXSWHWTDJVPDM-UHFFFAOYSA-N 0 1 318.392 4.002 20 0 DIADMN CCCn1cc(CN(Cc2ccccn2)C2CCCCC2)cn1 ZINC001139039870 1046367756 /nfs/dbraw/zinc/36/77/56/1046367756.db2.gz CZVZEBJEASYXSP-UHFFFAOYSA-N 0 1 312.461 4.023 20 0 DIADMN CC[C@H](c1ccccc1OC)N(C)[C@H](C)c1cnc(C)nc1C ZINC000639182737 1046368573 /nfs/dbraw/zinc/36/85/73/1046368573.db2.gz KPNXFSDPHCUDMC-RDTXWAMCSA-N 0 1 313.445 4.246 20 0 DIADMN Cc1cccc(C(C)C)c1NC(=O)CN1[C@@H](C)CCC[C@@H]1C ZINC000104077782 1046369154 /nfs/dbraw/zinc/36/91/54/1046369154.db2.gz IZARNGDIROXRHY-HOTGVXAUSA-N 0 1 302.462 4.320 20 0 DIADMN COc1ccc(CNCc2ccc(Cl)c(F)c2)cc1Cl ZINC000718897737 1046371301 /nfs/dbraw/zinc/37/13/01/1046371301.db2.gz DFQNSGCYHGWMQZ-UHFFFAOYSA-N 0 1 314.187 4.431 20 0 DIADMN COc1ccc(CNCc2cccc(Cl)c2F)cc1Cl ZINC000718898210 1046371926 /nfs/dbraw/zinc/37/19/26/1046371926.db2.gz IWJQEWZWUCSRRS-UHFFFAOYSA-N 0 1 314.187 4.431 20 0 DIADMN Nc1c(F)cccc1CN[C@@H]1CCCc2sc(Cl)cc21 ZINC000639225656 1046372782 /nfs/dbraw/zinc/37/27/82/1046372782.db2.gz ZLPCRHLJQKORMN-GFCCVEGCSA-N 0 1 310.825 4.290 20 0 DIADMN CCC/C=C\C(=O)Nc1cc(Cl)cc(Br)c1O ZINC000759742715 1046375941 /nfs/dbraw/zinc/37/59/41/1046375941.db2.gz UMGZZLINZCBPEK-PLNGDYQASA-N 0 1 318.598 4.103 20 0 DIADMN CC(C)N([C@H](C)c1ccsc1)[C@@H](c1nccn1C)C1CC1 ZINC000639277150 1046376532 /nfs/dbraw/zinc/37/65/32/1046376532.db2.gz SPCOCYOHQGAGAF-CZUORRHYSA-N 0 1 303.475 4.404 20 0 DIADMN Cc1ccc([C@H](C)C(=O)Nc2ccc3nc(C(F)F)[nH]c3c2)o1 ZINC000759748086 1046378809 /nfs/dbraw/zinc/37/88/09/1046378809.db2.gz WIIGXUPUBRVDJG-VIFPVBQESA-N 0 1 319.311 4.144 20 0 DIADMN Nc1c(F)cccc1CNC1(c2ccc(C(F)(F)F)cc2)CC1 ZINC000639294364 1046379177 /nfs/dbraw/zinc/37/91/77/1046379177.db2.gz AOCHBLWCTILTEA-UHFFFAOYSA-N 0 1 324.321 4.206 20 0 DIADMN COc1cc(CNCc2sc3c(cccc3Cl)c2C)on1 ZINC000639327131 1046379630 /nfs/dbraw/zinc/37/96/30/1046379630.db2.gz ZLCLLNSNDAMAMP-UHFFFAOYSA-N 0 1 322.817 4.150 20 0 DIADMN COc1ccc(-c2ccccc2)cc1CN1CCC(C(C)=O)CC1 ZINC001139070699 1046381324 /nfs/dbraw/zinc/38/13/24/1046381324.db2.gz UEHKTAOYTINZJP-UHFFFAOYSA-N 0 1 323.436 4.163 20 0 DIADMN CC[C@@](C)(NCc1cnc2ccccc2n1)c1ccc(F)cc1 ZINC000639360562 1046382602 /nfs/dbraw/zinc/38/26/02/1046382602.db2.gz XSXQTOOSLHBQTL-LJQANCHMSA-N 0 1 309.388 4.184 20 0 DIADMN CN(C)c1ccccc1CNCc1csc(C(F)(F)F)c1 ZINC000623425209 1046383721 /nfs/dbraw/zinc/38/37/21/1046383721.db2.gz VDYTUCHAHPISBY-UHFFFAOYSA-N 0 1 314.376 4.123 20 0 DIADMN c1ccc([C@@H]2CCN2Cc2ccc(Oc3ncccn3)cc2)cc1 ZINC001139081487 1046383990 /nfs/dbraw/zinc/38/39/90/1046383990.db2.gz LHNBAJXQSOYYKB-IBGZPJMESA-N 0 1 317.392 4.216 20 0 DIADMN C[C@@H]1C[C@@H]1c1ccc(CN2CC[C@H](O)C[C@@H]2c2ccccc2)o1 ZINC000639367953 1046385766 /nfs/dbraw/zinc/38/57/66/1046385766.db2.gz VIVXAQMVCAVWDW-TWKWOARYSA-N 0 1 311.425 4.101 20 0 DIADMN CSc1ccc(CN2CC[C@H](O)C[C@H]2c2ccccc2)s1 ZINC000639368394 1046385938 /nfs/dbraw/zinc/38/59/38/1046385938.db2.gz WSXZOGYGEHOSLQ-HOCLYGCPSA-N 0 1 319.495 4.168 20 0 DIADMN CC[C@H](N[C@H](C)c1cc(C(=O)OC)c(C)o1)c1ccccc1 ZINC000292389530 1046388948 /nfs/dbraw/zinc/38/89/48/1046388948.db2.gz ICZJQOUQMBAYKC-WBMJQRKESA-N 0 1 301.386 4.177 20 0 DIADMN CCn1ccc2ccc(CN(C)Cc3ccccc3OC)cc21 ZINC001139122635 1046389193 /nfs/dbraw/zinc/38/91/93/1046389193.db2.gz KKZGADVLNGSJAH-UHFFFAOYSA-N 0 1 308.425 4.302 20 0 DIADMN COc1cc(O)ccc1CN1CCC[C@H]1c1ccccc1Cl ZINC001139141482 1046391272 /nfs/dbraw/zinc/39/12/72/1046391272.db2.gz AHEALEFYPILWJQ-KRWDZBQOSA-N 0 1 317.816 4.391 20 0 DIADMN CC(C)(C)OC(=O)NC[C@@H](c1cccc(Cl)c1)N1CCCC1 ZINC000780698875 1046398248 /nfs/dbraw/zinc/39/82/48/1046398248.db2.gz BNWSHWZRUQPTLM-HNNXBMFYSA-N 0 1 324.852 4.002 20 0 DIADMN C[C@H]1CCN(Cc2nnc(-c3cccc4ccccc43)o2)C[C@H]1C ZINC001168201226 1046398446 /nfs/dbraw/zinc/39/84/46/1046398446.db2.gz 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317.816 4.142 20 0 DIADMN OC[C@H](NCc1ccc2oc3ccccc3c2c1)c1ccccc1 ZINC000782051680 1046492049 /nfs/dbraw/zinc/49/20/49/1046492049.db2.gz BHTIGVPETCHYIY-IBGZPJMESA-N 0 1 317.388 4.409 20 0 DIADMN CCN(Cc1ccc(-c2cccnc2)cc1)Cc1cccnc1 ZINC001139646952 1046495098 /nfs/dbraw/zinc/49/50/98/1046495098.db2.gz JQRXSBPREWVWTQ-UHFFFAOYSA-N 0 1 303.409 4.166 20 0 DIADMN C[C@@H]1CCCCCN1Cc1[nH]nc2ccc(Br)cc21 ZINC001139659834 1046495486 /nfs/dbraw/zinc/49/54/86/1046495486.db2.gz VOMWMJSNGAOFBG-LLVKDONJSA-N 0 1 322.250 4.090 20 0 DIADMN CN(Cc1ccnc(Cl)c1F)C(C)(C)Cc1ccccc1 ZINC001139665866 1046497105 /nfs/dbraw/zinc/49/71/05/1046497105.db2.gz JWBZDZUBBRNSNM-UHFFFAOYSA-N 0 1 306.812 4.327 20 0 DIADMN Cc1nn(-c2ccc(C)cc2)cc1CN[C@H](C)c1cnccc1C ZINC000655756228 1046498770 /nfs/dbraw/zinc/49/87/70/1046498770.db2.gz BQVFKIUIHGLDTA-QGZVFWFLSA-N 0 1 320.440 4.043 20 0 DIADMN Cc1cccc2nc(CN(C)Cc3cccc4ccccc43)cn21 ZINC001137299036 1046498876 /nfs/dbraw/zinc/49/88/76/1046498876.db2.gz ADSSLQBFKLTAAD-UHFFFAOYSA-N 0 1 315.420 4.428 20 0 DIADMN CN(Cc1csc2ccccc12)C(=O)c1cccc2c[nH]nc21 ZINC000047181826 1046500191 /nfs/dbraw/zinc/50/01/91/1046500191.db2.gz LUFOASLAMZKLJQ-UHFFFAOYSA-N 0 1 321.405 4.050 20 0 DIADMN Cc1cc([C@@H](NCc2nn(C)c3ccccc23)C2CC2)ccc1F ZINC000677520823 1046500504 /nfs/dbraw/zinc/50/05/04/1046500504.db2.gz HCLKGKZEKWAKJH-FQEVSTJZSA-N 0 1 323.415 4.262 20 0 DIADMN O=C(c1cc(C2CCCCC2)[nH]n1)N1C2CCCC1CCC2 ZINC000677557370 1046502515 /nfs/dbraw/zinc/50/25/15/1046502515.db2.gz JGPDPEHISHTWON-UHFFFAOYSA-N 0 1 301.434 4.005 20 0 DIADMN Cc1cccc2nc(C[N@@H+](Cc3ccccc3)C3CCC3)cn21 ZINC001137302846 1046503245 /nfs/dbraw/zinc/50/32/45/1046503245.db2.gz ZJAWSZWHWOPZIH-UHFFFAOYSA-N 0 1 305.425 4.197 20 0 DIADMN Cc1cccc2nc(CN(Cc3ccccc3)C3CCC3)cn21 ZINC001137302846 1046503256 /nfs/dbraw/zinc/50/32/56/1046503256.db2.gz ZJAWSZWHWOPZIH-UHFFFAOYSA-N 0 1 305.425 4.197 20 0 DIADMN CC[N@@H+](Cc1cn2c(cccc2C)n1)Cc1ccc(C)c(C)c1 ZINC001137302459 1046503372 /nfs/dbraw/zinc/50/33/72/1046503372.db2.gz 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/nfs/dbraw/zinc/52/28/73/1046522873.db2.gz OSNBJYBVAZLQHT-UHFFFAOYSA-N 0 1 317.658 4.120 20 0 DIADMN CCc1cc(CNC(=O)N(c2ccccc2)c2ccccc2)n[nH]1 ZINC000782449154 1046526091 /nfs/dbraw/zinc/52/60/91/1046526091.db2.gz MKDQBFJAHMOYEN-UHFFFAOYSA-N 0 1 320.396 4.020 20 0 DIADMN Cc1ccc2ncc(CN(Cc3cccc(C)c3C)C3CC3)n2c1 ZINC001137312432 1046526925 /nfs/dbraw/zinc/52/69/25/1046526925.db2.gz VTGJGLXZKFAVMM-UHFFFAOYSA-N 0 1 319.452 4.424 20 0 DIADMN Cc1ccc(CN2CCC[C@@H](Oc3ccc(Cl)cc3)C2)nc1 ZINC001139840402 1046530219 /nfs/dbraw/zinc/53/02/19/1046530219.db2.gz PDDDVYSRVXTTJK-GOSISDBHSA-N 0 1 316.832 4.087 20 0 DIADMN CC(C)Oc1ncccc1CN[C@@H]1CCc2ccc(Cl)cc21 ZINC000677846352 1046530180 /nfs/dbraw/zinc/53/01/80/1046530180.db2.gz QKOZINILBJLUPO-QGZVFWFLSA-N 0 1 316.832 4.299 20 0 DIADMN Fc1cc(CN2CCC(c3cccc(Cl)c3)CC2)ccn1 ZINC001139836348 1046530625 /nfs/dbraw/zinc/53/06/25/1046530625.db2.gz ISTCENBXSMETLJ-UHFFFAOYSA-N 0 1 304.796 4.254 20 0 DIADMN Clc1ccccc1[C@H]1CCN(Cc2ccncc2Cl)C1 ZINC001139847102 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ZINC001139882625 1046541352 /nfs/dbraw/zinc/54/13/52/1046541352.db2.gz RJFPSKCZGWAZJM-UHFFFAOYSA-N 0 1 318.464 4.024 20 0 DIADMN CO[C@@H]1CCC[N@@H+](Cc2cc(C(F)(F)F)ccc2C)CC1 ZINC001139887057 1046544077 /nfs/dbraw/zinc/54/40/77/1046544077.db2.gz LJFRVSGXQRXHEJ-OAHLLOKOSA-N 0 1 301.352 4.015 20 0 DIADMN CCOC1CCN(Cc2cc(C(F)(F)F)ccc2C)CC1 ZINC001139885734 1046545502 /nfs/dbraw/zinc/54/55/02/1046545502.db2.gz VCCHQPVHFIKBCM-UHFFFAOYSA-N 0 1 301.352 4.015 20 0 DIADMN CO[C@H]1CCC[N@@H+](Cc2cc(C(F)(F)F)ccc2C)CC1 ZINC001139887055 1046545900 /nfs/dbraw/zinc/54/59/00/1046545900.db2.gz LJFRVSGXQRXHEJ-HNNXBMFYSA-N 0 1 301.352 4.015 20 0 DIADMN CS[C@@H]1CCCC[N@@H+](Cc2csc(-c3ccco3)n2)C1 ZINC000134601244 1046548384 /nfs/dbraw/zinc/54/83/84/1046548384.db2.gz WMCHCUGPQXCCRR-CYBMUJFWSA-N 0 1 308.472 4.121 20 0 DIADMN CS[C@@H]1CCCCN(Cc2csc(-c3ccco3)n2)C1 ZINC000134601244 1046548392 /nfs/dbraw/zinc/54/83/92/1046548392.db2.gz WMCHCUGPQXCCRR-CYBMUJFWSA-N 0 1 308.472 4.121 20 0 DIADMN COc1ccccc1[C@H](C)N(C)Cc1cncc2ccccc21 ZINC001139896718 1046549625 /nfs/dbraw/zinc/54/96/25/1046549625.db2.gz MSKYTEDIAHRWRS-HNNXBMFYSA-N 0 1 306.409 4.436 20 0 DIADMN c1c2ccccc2[nH]c1CN1CCC2(COc3ccccc32)CC1 ZINC001137320821 1046550699 /nfs/dbraw/zinc/55/06/99/1046550699.db2.gz MIQMJLJCVWSZEQ-UHFFFAOYSA-N 0 1 318.420 4.094 20 0 DIADMN Cn1ncc2ccc(CN3CCCC[C@H]3c3ccccc3F)cc21 ZINC001139908550 1046552935 /nfs/dbraw/zinc/55/29/35/1046552935.db2.gz KIRKCLXFPACKJC-IBGZPJMESA-N 0 1 323.415 4.440 20 0 DIADMN Cc1ccc(CN2CCC(Oc3ccc(Cl)cc3)CC2)cn1 ZINC001139929244 1046553140 /nfs/dbraw/zinc/55/31/40/1046553140.db2.gz SQJSPPBPQBNGGF-UHFFFAOYSA-N 0 1 316.832 4.087 20 0 DIADMN CSC[C@H]1CCCN1Cc1nc(-c2ccsc2)oc1C ZINC000135473046 1046554462 /nfs/dbraw/zinc/55/44/62/1046554462.db2.gz LBCIREDQSWTDHW-CYBMUJFWSA-N 0 1 308.472 4.039 20 0 DIADMN Cc1ccc(CN(C)[C@H](C)c2cccc(Br)c2)cn1 ZINC001139933657 1046554785 /nfs/dbraw/zinc/55/47/85/1046554785.db2.gz MAMQMKYOYPHERS-CYBMUJFWSA-N 0 1 319.246 4.346 20 0 DIADMN 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COc1cccc(C2CC2)c1Nc1cc([C@@H]2CCCCN2)no1 ZINC001159312890 1047831860 /nfs/dbraw/zinc/83/18/60/1047831860.db2.gz GAMVQCABUYMZGO-AWEZNQCLSA-N 0 1 313.401 4.119 20 0 DIADMN Fc1cc(Nc2cc([C@H]3CCCCN3)no2)cc(F)c1Cl ZINC001159313311 1047831971 /nfs/dbraw/zinc/83/19/71/1047831971.db2.gz LRURIFZCKDPVMA-LLVKDONJSA-N 0 1 313.735 4.164 20 0 DIADMN COCc1ccc(Cl)c(Nc2cc([C@@H]3CCCCN3)no2)c1 ZINC001159312997 1047832350 /nfs/dbraw/zinc/83/23/50/1047832350.db2.gz IAHDZRXINAALDD-ZDUSSCGKSA-N 0 1 321.808 4.033 20 0 DIADMN CCOc1cc(Nc2cc([C@H]3CCCCN3)no2)ccc1Cl ZINC001159313337 1047832418 /nfs/dbraw/zinc/83/24/18/1047832418.db2.gz MINIXEZVYWSQAH-CYBMUJFWSA-N 0 1 321.808 4.285 20 0 DIADMN CCCOc1ccc(Nc2cc([C@@H]3CCCCN3)no2)cc1 ZINC001159314023 1047832554 /nfs/dbraw/zinc/83/25/54/1047832554.db2.gz XFMKBNDIJXHATH-HNNXBMFYSA-N 0 1 301.390 4.022 20 0 DIADMN Fc1cc(F)c(Cl)c(Nc2cc([C@@H]3CCCCN3)no2)c1 ZINC001159314173 1047833110 /nfs/dbraw/zinc/83/31/10/1047833110.db2.gz ZSUFRTFMONMJGX-JTQLQIEISA-N 0 1 313.735 4.164 20 0 DIADMN COc1cc2ccccc2c(Nc2cc([C@@H]3CCCCN3)no2)c1 ZINC001159313737 1047833280 /nfs/dbraw/zinc/83/32/80/1047833280.db2.gz STPFDLHGKCBISJ-INIZCTEOSA-N 0 1 323.396 4.395 20 0 DIADMN Oc1ccc2cc(Nc3cc([C@H]4CCCCN4)no3)ccc2c1 ZINC001159313934 1047833296 /nfs/dbraw/zinc/83/32/96/1047833296.db2.gz VQIFDPLGBSSGBB-MRXNPFEDSA-N 0 1 309.369 4.092 20 0 DIADMN Fc1ccc(-c2nc(CN3CC[C@H]3Cc3ccccc3)co2)cc1 ZINC000479114815 1047838911 /nfs/dbraw/zinc/83/89/11/1047838911.db2.gz IWCNLIFRUSPWBC-IBGZPJMESA-N 0 1 322.383 4.298 20 0 DIADMN CC[C@H](C)CC(=O)N1CCC[C@H]1c1nc2ccc(Cl)cc2[nH]1 ZINC000479142909 1047840348 /nfs/dbraw/zinc/84/03/48/1047840348.db2.gz RFANXXWKIPJEMF-NHYWBVRUSA-N 0 1 319.836 4.316 20 0 DIADMN O=c1cc(-c2ccc(Cl)cc2)[nH]n1-c1cccc(Cl)c1 ZINC000006773905 1047842100 /nfs/dbraw/zinc/84/21/00/1047842100.db2.gz KZHVSBZOPDUSLS-UHFFFAOYSA-N 0 1 305.164 4.134 20 0 DIADMN Fc1c(CN2CCC(C3CCC3)CC2)cccc1OC1CC1 ZINC001182805993 1047845023 /nfs/dbraw/zinc/84/50/23/1047845023.db2.gz 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4.138 20 0 DIADMN COc1cccc([C@@H]2CN([C@H](C)c3ccccc3C)CCO2)c1 ZINC000483510989 1048813032 /nfs/dbraw/zinc/81/30/32/1048813032.db2.gz HAYXZRAUBYJWJK-UZLBHIALSA-N 0 1 311.425 4.138 20 0 DIADMN Cc1ccc([C@H]2CSCCN2CCOC2CCCCC2)cc1 ZINC001190954912 1048814801 /nfs/dbraw/zinc/81/48/01/1048814801.db2.gz RVUCVMOJHQSBNE-LJQANCHMSA-N 0 1 319.514 4.434 20 0 DIADMN CC[C@@](O)(CN(C)Cc1csc2ccccc12)C(F)(F)F ZINC001166990420 1048823638 /nfs/dbraw/zinc/82/36/38/1048823638.db2.gz KMUUAOYOFFJHNY-CQSZACIVSA-N 0 1 317.376 4.037 20 0 DIADMN CC[C@@H]1c2ccccc2CC[N@@H+]1CC(=O)Nc1ccc(C)c(C)c1 ZINC001191039828 1048830362 /nfs/dbraw/zinc/83/03/62/1048830362.db2.gz SDHNCCYPABIVKH-HXUWFJFHSA-N 0 1 322.452 4.251 20 0 DIADMN CC[C@@H]1c2ccccc2CCN1CC(=O)Nc1ccc(C)c(C)c1 ZINC001191039828 1048830379 /nfs/dbraw/zinc/83/03/79/1048830379.db2.gz SDHNCCYPABIVKH-HXUWFJFHSA-N 0 1 322.452 4.251 20 0 DIADMN C[C@H](N[C@H]1CCCC(C)(C)C1)c1nc(Cc2ccccc2)no1 ZINC000483643730 1048831118 /nfs/dbraw/zinc/83/11/18/1048831118.db2.gz OOLDDHMSLJNYKA-HOCLYGCPSA-N 0 1 313.445 4.280 20 0 DIADMN C[C@H](N[C@H]1C[C@H](C)C[C@H](C)C1)c1nc(Cc2ccccc2)no1 ZINC000483634045 1048832572 /nfs/dbraw/zinc/83/25/72/1048832572.db2.gz GZAAPQVMPZQYBZ-QSJFSLAZSA-N 0 1 313.445 4.136 20 0 DIADMN FC(F)(F)c1nc(CNCCc2ccc(Cl)cc2)cs1 ZINC001177109018 1048833610 /nfs/dbraw/zinc/83/36/10/1048833610.db2.gz XSUIYIZMGOQCID-UHFFFAOYSA-N 0 1 320.767 4.148 20 0 DIADMN CC[C@H](CN[C@@H](C)c1nc(C(C)(C)C)no1)c1ccccc1 ZINC000483650158 1048835223 /nfs/dbraw/zinc/83/52/23/1048835223.db2.gz PSXRXERMJCHDLQ-UONOGXRCSA-N 0 1 301.434 4.212 20 0 DIADMN CC[C@@H](NCc1cc2c(cc[nH]c2=O)o1)c1ccc(Cl)cc1 ZINC001177191152 1048848993 /nfs/dbraw/zinc/84/89/93/1048848993.db2.gz LXHCTSJOVZIEFE-OAHLLOKOSA-N 0 1 316.788 4.428 20 0 DIADMN COc1ccc([C@@H]2CCCN2C[C@@H]2CC2(Cl)Cl)cc1F ZINC000852522253 1048848772 /nfs/dbraw/zinc/84/87/72/1048848772.db2.gz YJCWBZICGATNGO-AAEUAGOBSA-N 0 1 318.219 4.165 20 0 DIADMN FCC[C@@H]1CCCN(Cc2cc3ccccc3c(Cl)n2)C1 ZINC000852533371 1048848834 /nfs/dbraw/zinc/84/88/34/1048848834.db2.gz TVZAZWDYBHYEIM-ZDUSSCGKSA-N 0 1 306.812 4.460 20 0 DIADMN CN(Cc1cccn1C)Cc1cccc(Oc2ccccc2)c1 ZINC001203267357 1048854944 /nfs/dbraw/zinc/85/49/44/1048854944.db2.gz MBLAQFQXBCNXSF-UHFFFAOYSA-N 0 1 306.409 4.449 20 0 DIADMN COc1cccc(C2(NCc3cnc(Cl)c(F)c3)CCC2)c1 ZINC000852690876 1048854797 /nfs/dbraw/zinc/85/47/97/1048854797.db2.gz AUOBEEKWLCASBV-UHFFFAOYSA-N 0 1 320.795 4.052 20 0 DIADMN CCc1ccc([C@H]2COCCN2C[C@H]2CCCCC2(C)C)o1 ZINC001191119765 1048855507 /nfs/dbraw/zinc/85/55/07/1048855507.db2.gz ATLVCPGCDFXLRV-NVXWUHKLSA-N 0 1 305.462 4.432 20 0 DIADMN Fc1ccc(OC2CCN(Cc3ccco3)CC2)c(Cl)c1 ZINC001203278263 1048857705 /nfs/dbraw/zinc/85/77/05/1048857705.db2.gz IUGVDXZTVIBDRC-UHFFFAOYSA-N 0 1 309.768 4.116 20 0 DIADMN Cc1cnc([C@H](C)N[C@@H](C(C)C)[C@H](O)c2ccc(Cl)cc2)o1 ZINC000852729399 1048857707 /nfs/dbraw/zinc/85/77/07/1048857707.db2.gz MYYIOGYFBAXHHT-VBNZEHGJSA-N 0 1 322.836 4.045 20 0 DIADMN CC1(C)C[C@@]1(NCc1cnc(Cl)c(F)c1)c1ccccc1 ZINC000852772979 1048858198 /nfs/dbraw/zinc/85/81/98/1048858198.db2.gz SBGNKMDYLWDKEU-QGZVFWFLSA-N 0 1 304.796 4.289 20 0 DIADMN C[C@@H](NCc1ccccc1OC1CC1)c1ccc2c(c1)CCCO2 ZINC000852781317 1048860337 /nfs/dbraw/zinc/86/03/37/1048860337.db2.gz NFZWGDFRKLZUOO-OAHLLOKOSA-N 0 1 323.436 4.404 20 0 DIADMN CC[C@H](C)c1ccc(C(=O)Nc2cc(C(C)=O)ccc2O)cc1 ZINC000781434567 1048863818 /nfs/dbraw/zinc/86/38/18/1048863818.db2.gz IOEMIBQNIUSFIC-LBPRGKRZSA-N 0 1 311.381 4.361 20 0 DIADMN Cc1ccc2[nH]c(CN[C@@H](C)c3cc4c(s3)CCC4)nc2c1 ZINC000483850641 1048866142 /nfs/dbraw/zinc/86/61/42/1048866142.db2.gz BWNGROHNCJKMBL-LBPRGKRZSA-N 0 1 311.454 4.272 20 0 DIADMN Cc1ccc2nc(CN[C@@H](C)c3cc4c(s3)CCC4)[nH]c2c1 ZINC000483850641 1048866155 /nfs/dbraw/zinc/86/61/55/1048866155.db2.gz BWNGROHNCJKMBL-LBPRGKRZSA-N 0 1 311.454 4.272 20 0 DIADMN Cc1ccc2[nH]c(CN[C@H](C)c3cc4c(s3)CCC4)nc2c1 ZINC000483850633 1048866888 /nfs/dbraw/zinc/86/68/88/1048866888.db2.gz BWNGROHNCJKMBL-GFCCVEGCSA-N 0 1 311.454 4.272 20 0 DIADMN Cc1ccc2nc(CN[C@H](C)c3cc4c(s3)CCC4)[nH]c2c1 ZINC000483850633 1048866899 /nfs/dbraw/zinc/86/68/99/1048866899.db2.gz BWNGROHNCJKMBL-GFCCVEGCSA-N 0 1 311.454 4.272 20 0 DIADMN CSc1ccc(F)cc1CN[C@H](C)c1ccc2c(c1)OCO2 ZINC000483859290 1048872538 /nfs/dbraw/zinc/87/25/38/1048872538.db2.gz GQXDALMDZMFHDR-LLVKDONJSA-N 0 1 319.401 4.127 20 0 DIADMN CC[C@H](C)[C@H]1CCCCN1CC(=O)Nc1ccc(C)cc1Cl ZINC001191134296 1048874294 /nfs/dbraw/zinc/87/42/94/1048874294.db2.gz XUXATKGTPOZQQS-WMLDXEAASA-N 0 1 322.880 4.488 20 0 DIADMN CC[C@@H](N[C@@H](COC)CC(C)C)c1nc(C(F)(F)F)cs1 ZINC000483870093 1048874275 /nfs/dbraw/zinc/87/42/75/1048874275.db2.gz YYGPJNGFKNJGSB-GHMZBOCLSA-N 0 1 324.412 4.264 20 0 DIADMN CC[C@@H](C)[C@H]1CCCC[N@H+]1Cc1ccncc1Br ZINC001191132774 1048874609 /nfs/dbraw/zinc/87/46/09/1048874609.db2.gz MGKFTWUFQJSLGD-IUODEOHRSA-N 0 1 311.267 4.245 20 0 DIADMN Cc1ccc2[nH]c(CN[C@H]3c4cc(F)ccc4C[C@H]3C)nc2c1 ZINC000483853125 1048879496 /nfs/dbraw/zinc/87/94/96/1048879496.db2.gz TXFVDEPJFCNLOF-CWTRNNRKSA-N 0 1 309.388 4.034 20 0 DIADMN Cc1ccc2nc(CN[C@H]3c4cc(F)ccc4C[C@H]3C)[nH]c2c1 ZINC000483853125 1048879516 /nfs/dbraw/zinc/87/95/16/1048879516.db2.gz TXFVDEPJFCNLOF-CWTRNNRKSA-N 0 1 309.388 4.034 20 0 DIADMN CC(C)c1cccc(CNCc2nc3cc(F)ccc3n2C)c1 ZINC000853087353 1048880524 /nfs/dbraw/zinc/88/05/24/1048880524.db2.gz YVRCZSGOWMSIPG-UHFFFAOYSA-N 0 1 311.404 4.126 20 0 DIADMN COCc1ccc([C@@H]2CCCN2Cc2ccc(C)c(OC)c2)o1 ZINC000194709139 1048881689 /nfs/dbraw/zinc/88/16/89/1048881689.db2.gz YQKRKRADWFTNBL-KRWDZBQOSA-N 0 1 315.413 4.080 20 0 DIADMN CCn1cc(CN(Cc2cc3ccc(C)cc3[nH]2)C(C)C)cn1 ZINC000668287179 1048884253 /nfs/dbraw/zinc/88/42/53/1048884253.db2.gz YLNKPKAGFIJKBS-UHFFFAOYSA-N 0 1 310.445 4.103 20 0 DIADMN COc1c(C)cc(CNCc2cnccc2C(F)(F)F)cc1C ZINC000853095733 1048884129 /nfs/dbraw/zinc/88/41/29/1048884129.db2.gz VIZNXQHIXRRBHN-UHFFFAOYSA-N 0 1 324.346 4.016 20 0 DIADMN COc1ccc(F)c(CN[C@@H](C)c2ccc3c(c2)CCCO3)c1 ZINC000853094958 1048884272 /nfs/dbraw/zinc/88/42/72/1048884272.db2.gz QGFWVRRTRTZHCF-ZDUSSCGKSA-N 0 1 315.388 4.010 20 0 DIADMN Cc1nc(CNCCOc2ccc3ccccc3c2)sc1C ZINC001177404161 1048885006 /nfs/dbraw/zinc/88/50/06/1048885006.db2.gz XWXANSVYJXCEGK-UHFFFAOYSA-N 0 1 312.438 4.082 20 0 DIADMN Cc1c2ccccc2oc1[C@@H](C)NCc1cccc2[nH]c(=O)oc21 ZINC001177453527 1048885928 /nfs/dbraw/zinc/88/59/28/1048885928.db2.gz AYBSKGVOFCTGGC-GFCCVEGCSA-N 0 1 322.364 4.439 20 0 DIADMN CC[C@@]1(C)CCC[N@@H+](Cc2ccn(-c3c(F)cccc3F)n2)C1 ZINC001191213805 1048886015 /nfs/dbraw/zinc/88/60/15/1048886015.db2.gz KSCFYAFWRVPTGV-SFHVURJKSA-N 0 1 319.399 4.163 20 0 DIADMN CC[C@@]1(C)CCCN(Cc2ccn(-c3c(F)cccc3F)n2)C1 ZINC001191213805 1048886035 /nfs/dbraw/zinc/88/60/35/1048886035.db2.gz KSCFYAFWRVPTGV-SFHVURJKSA-N 0 1 319.399 4.163 20 0 DIADMN COCC[C@@H]1CCCCN1Cc1ccc(Cl)cc1Cl ZINC001203395551 1048890653 /nfs/dbraw/zinc/89/06/53/1048890653.db2.gz ZGTIGYHFWVKJIO-AWEZNQCLSA-N 0 1 302.245 4.384 20 0 DIADMN C[C@H]1CC[C@H](C)N(Cc2cc(F)ccc2Br)C1 ZINC001191191422 1048892593 /nfs/dbraw/zinc/89/25/93/1048892593.db2.gz BCVOKTAPGSOQKS-QWRGUYRKSA-N 0 1 300.215 4.209 20 0 DIADMN Clc1cccc(Cl)c1CN1CC[C@@H](c2cccnc2)C1 ZINC001203418318 1048895344 /nfs/dbraw/zinc/89/53/44/1048895344.db2.gz DMEMJXWTZJCPKJ-CYBMUJFWSA-N 0 1 307.224 4.378 20 0 DIADMN Clc1cccc(Cl)c1CN1CCC2(CCCOC2)CC1 ZINC001203424638 1048897979 /nfs/dbraw/zinc/89/79/79/1048897979.db2.gz YNOBDDKUEQUEOV-UHFFFAOYSA-N 0 1 314.256 4.386 20 0 DIADMN COc1ccc(C)cc1CN[C@H](c1ccccc1)[C@@H]1CCCO1 ZINC001177506048 1048901702 /nfs/dbraw/zinc/90/17/02/1048901702.db2.gz DDGZKRBVUPKMRP-VQTJNVASSA-N 0 1 311.425 4.014 20 0 DIADMN Cc1ccc([C@H](C)NCc2cnc([C@@H]3CCCO3)s2)s1 ZINC001177496386 1048902473 /nfs/dbraw/zinc/90/24/73/1048902473.db2.gz FTXQAQNWSZOMBV-AAEUAGOBSA-N 0 1 308.472 4.215 20 0 DIADMN Cc1ccc([C@@H](C)NCc2cnc([C@@H]3CCCO3)s2)s1 ZINC001177496389 1048903223 /nfs/dbraw/zinc/90/32/23/1048903223.db2.gz FTXQAQNWSZOMBV-YPMHNXCESA-N 0 1 308.472 4.215 20 0 DIADMN Cc1ccc(F)cc1CN[C@H](c1ccc(F)cc1)[C@H]1CCCO1 ZINC001177520225 1048904499 /nfs/dbraw/zinc/90/44/99/1048904499.db2.gz XSYNQNHKWCMSJR-RTBURBONSA-N 0 1 317.379 4.283 20 0 DIADMN Cc1ccc(F)cc1CN[C@@H](c1ccc(F)cc1)[C@@H]1CCCO1 ZINC001177520088 1048904718 /nfs/dbraw/zinc/90/47/18/1048904718.db2.gz XSYNQNHKWCMSJR-OALUTQOASA-N 0 1 317.379 4.283 20 0 DIADMN Fc1ccc2c(c1)CC[C@H]2NCc1ccccc1OCC1CC1 ZINC000484142846 1048905304 /nfs/dbraw/zinc/90/53/04/1048905304.db2.gz ILSFBMYFJYVHSY-LJQANCHMSA-N 0 1 311.400 4.392 20 0 DIADMN C[C@H](N[C@@H]1C[C@@H](C)[N@H+](C2CC2)C1)c1cc(Cl)sc1Cl ZINC000484290472 1048921077 /nfs/dbraw/zinc/92/10/77/1048921077.db2.gz DOVSGYJUKNBERV-KXUCPTDWSA-N 0 1 319.301 4.331 20 0 DIADMN CC[C@@H](c1ccccc1)N1CCN(C/C(Cl)=C/Cl)CC1 ZINC001191245322 1048909453 /nfs/dbraw/zinc/90/94/53/1048909453.db2.gz SNJSCGRJWLGNPF-IRVMHKCDSA-N 0 1 313.272 4.074 20 0 DIADMN CC[C@H](c1ccc(F)cc1F)N1CCC(c2cn[nH]c2)CC1 ZINC000347396977 1048911496 /nfs/dbraw/zinc/91/14/96/1048911496.db2.gz XMIKZKLVIYLCLO-QGZVFWFLSA-N 0 1 305.372 4.019 20 0 DIADMN Cc1ccc2[nH]c(NCc3cccc(OC4CC4)c3F)nc2c1 ZINC001203478806 1048911495 /nfs/dbraw/zinc/91/14/95/1048911495.db2.gz JEKCAUSVMXZKJR-UHFFFAOYSA-N 0 1 311.360 4.164 20 0 DIADMN COc1ccc2c(c1)nccc2Nc1c[nH]c(=O)c2ccccc12 ZINC001203521638 1048917849 /nfs/dbraw/zinc/91/78/49/1048917849.db2.gz FWVHMNWIWXGNSH-UHFFFAOYSA-N 0 1 317.348 4.241 20 0 DIADMN COc1ccc2c(c1)nccc2Nc1ccc2c(c1)OCCCO2 ZINC001203525142 1048918634 /nfs/dbraw/zinc/91/86/34/1048918634.db2.gz TVLLIIOMJRSEQE-UHFFFAOYSA-N 0 1 322.364 4.148 20 0 DIADMN COc1ccc2c(c1)nccc2Nc1cc(OC)cc(Cl)n1 ZINC001203525103 1048918659 /nfs/dbraw/zinc/91/86/59/1048918659.db2.gz QVVAEPLSKJBVRC-UHFFFAOYSA-N 0 1 315.760 4.044 20 0 DIADMN COc1ccc2c(c1)nccc2Nc1cnc2ccc(O)cc2c1 ZINC001203521635 1048918695 /nfs/dbraw/zinc/91/86/95/1048918695.db2.gz FQUUOJQBFORQGE-UHFFFAOYSA-N 0 1 317.348 4.241 20 0 DIADMN COc1ccc2c(c1)nccc2Nc1cc(Cl)nnc1Cl ZINC001203519263 1048919285 /nfs/dbraw/zinc/91/92/85/1048919285.db2.gz BHNOBOABDMXQIA-UHFFFAOYSA-N 0 1 321.167 4.084 20 0 DIADMN CC[C@H](NCc1cccc2nsnc21)c1ccc(F)cc1F ZINC000775448891 1048920334 /nfs/dbraw/zinc/92/03/34/1048920334.db2.gz FZHQWEAHCYHXGE-AWEZNQCLSA-N 0 1 319.380 4.210 20 0 DIADMN COc1ccc2c(c1)nccc2Nc1ccc2c(C)nn(C)c2c1 ZINC001203527635 1048921581 /nfs/dbraw/zinc/92/15/81/1048921581.db2.gz DFGKJJDGJZUDGY-UHFFFAOYSA-N 0 1 318.380 4.182 20 0 DIADMN COc1ccc2c(c1)nccc2Nc1cccc(F)c1C(C)=O ZINC001203527653 1048921764 /nfs/dbraw/zinc/92/17/64/1048921764.db2.gz DUWPUDKQUOPKST-UHFFFAOYSA-N 0 1 310.328 4.329 20 0 DIADMN C=CC(=O)Nc1cccc(Nc2ccnc3cc(OC)ccc32)c1 ZINC001203529626 1048922064 /nfs/dbraw/zinc/92/20/64/1048922064.db2.gz GHQJMZXHTYOEKA-UHFFFAOYSA-N 0 1 319.364 4.112 20 0 DIADMN Brc1ccc2nc(NCC3CCCCC3)[nH]c2c1 ZINC001203529857 1048923466 /nfs/dbraw/zinc/92/34/66/1048923466.db2.gz KYNWFLPMRUEFQJ-UHFFFAOYSA-N 0 1 308.223 4.318 20 0 DIADMN CCCC1CCN([C@H](C)C(=O)Nc2ccc(C)cc2C)CC1 ZINC001191358665 1048924697 /nfs/dbraw/zinc/92/46/97/1048924697.db2.gz OBHAJRSSTHCOBM-MRXNPFEDSA-N 0 1 302.462 4.143 20 0 DIADMN CCCC[C@@H](NCc1cn2ccccc2n1)c1ccc(OC)cc1 ZINC001177674344 1048927450 /nfs/dbraw/zinc/92/74/50/1048927450.db2.gz TXPKKUAPHMMVIW-LJQANCHMSA-N 0 1 323.440 4.364 20 0 DIADMN CCCCN(CC)C(=O)CN[C@H](C)c1oc2ccccc2c1C ZINC000484343532 1048929534 /nfs/dbraw/zinc/92/95/34/1048929534.db2.gz VZTGNOUNMXAMOP-OAHLLOKOSA-N 0 1 316.445 4.040 20 0 DIADMN c1nn(-c2ccncc2)cc1NCc1csc2ccccc12 ZINC001177647103 1048929732 /nfs/dbraw/zinc/92/97/32/1048929732.db2.gz WPKUKIOEGCISDT-UHFFFAOYSA-N 0 1 306.394 4.094 20 0 DIADMN Cc1ccc(CN2CC[C@@H](C(F)(F)F)C(C)(C)C2)c(C)n1 ZINC000484361174 1048930320 /nfs/dbraw/zinc/93/03/20/1048930320.db2.gz OUPSMSNZEMXWHK-CQSZACIVSA-N 0 1 300.368 4.109 20 0 DIADMN c1nn(-c2ccncc2)cc1NCc1ccc2ccccc2c1 ZINC001177647093 1048930598 /nfs/dbraw/zinc/93/05/98/1048930598.db2.gz WLZXDKRWZSQCHE-UHFFFAOYSA-N 0 1 300.365 4.033 20 0 DIADMN COc1cc(CNCc2ccc(C)cc2F)cc(Cl)c1OC ZINC001177693390 1048935388 /nfs/dbraw/zinc/93/53/88/1048935388.db2.gz 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/nfs/dbraw/zinc/93/93/30/1048939330.db2.gz XLCKZSCDDITGHU-HNNXBMFYSA-N 0 1 317.864 4.459 20 0 DIADMN COc1cc(F)c([C@@H](C)NCc2ccccc2C)cc1OC ZINC001177816298 1048940977 /nfs/dbraw/zinc/94/09/77/1048940977.db2.gz JWTUVLHPDOFYKK-CYBMUJFWSA-N 0 1 303.377 4.002 20 0 DIADMN CC[C@H](NC)c1nc(-c2cc3cc(Cl)cc(C)c3o2)no1 ZINC000854152780 1048945196 /nfs/dbraw/zinc/94/51/96/1048945196.db2.gz ARKWCACSVFPCHN-NSHDSACASA-N 0 1 305.765 4.115 20 0 DIADMN Cc1cccc2nc(CNCc3ccc(F)c4ccccc34)cn21 ZINC001177809957 1048946856 /nfs/dbraw/zinc/94/68/56/1048946856.db2.gz FNYKWEKBEUOYKV-UHFFFAOYSA-N 0 1 319.383 4.225 20 0 DIADMN CO[C@@H](CNCc1ccc(C2CCCC2)cc1)C(F)(F)F ZINC001177800291 1048947749 /nfs/dbraw/zinc/94/77/49/1048947749.db2.gz XPIUTWXNKWOGSU-HNNXBMFYSA-N 0 1 301.352 4.011 20 0 DIADMN OC[C@@H](NCc1ccc(-c2ccccc2)cc1)c1cccc(F)c1 ZINC001177830074 1048949630 /nfs/dbraw/zinc/94/96/30/1048949630.db2.gz UCMXMFLVFYSTQX-OAQYLSRUSA-N 0 1 321.395 4.316 20 0 DIADMN COC(=O)c1ccc(CNCc2oc3ccccc3c2C)cc1C ZINC001177855277 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COc1cc(CN[C@@H](c2ccc(CC(C)C)cc2)C(C)C)on1 ZINC001191664468 1048979091 /nfs/dbraw/zinc/97/90/91/1048979091.db2.gz UHNSHLPQJXDAOU-LJQANCHMSA-N 0 1 316.445 4.369 20 0 DIADMN Cc1ccc(Cl)c(NC(=O)Nc2c(O)cc(F)cc2F)c1 ZINC001191704406 1048980701 /nfs/dbraw/zinc/98/07/01/1048980701.db2.gz HCGDTOCCQIYRMW-UHFFFAOYSA-N 0 1 312.703 4.276 20 0 DIADMN Cc1c(Cl)ccc(S(=O)(=O)Nc2ccccc2)c1Cl ZINC001191721412 1048982829 /nfs/dbraw/zinc/98/28/29/1048982829.db2.gz AUWQHBXDTFAIGV-UHFFFAOYSA-N 0 1 316.209 4.103 20 0 DIADMN CC(=O)c1ccc2c(c1)CN(Cc1c(C)cc(C)cc1C)CC2 ZINC001203746874 1048989666 /nfs/dbraw/zinc/98/96/66/1048989666.db2.gz ZPEGJRVMCJUOJS-UHFFFAOYSA-N 0 1 307.437 4.373 20 0 DIADMN C[C@H](c1nc2ccc(Cl)cc2[nH]1)N(C)C(=O)/C=C\C(C)(C)C ZINC000854816255 1048992245 /nfs/dbraw/zinc/99/22/45/1048992245.db2.gz CCRSIKPMSPQFBX-TYBABMIJSA-N 0 1 319.836 4.338 20 0 DIADMN C[C@H](c1nc2ccc(Cl)cc2[nH]1)N(C)C(=O)C=C1CCCC1 ZINC000854818217 1048992841 /nfs/dbraw/zinc/99/28/41/1048992841.db2.gz IQXNKWULSZVOKC-LLVKDONJSA-N 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/nfs/dbraw/zinc/73/32/04/1051733204.db2.gz DWWVDNUSEHIDHU-CYBMUJFWSA-N 0 1 318.461 4.215 20 0 DIADMN Cc1cc(Nc2ccnn2-c2ccncc2)c(OC(C)C)cc1C ZINC001216379899 1051735140 /nfs/dbraw/zinc/73/51/40/1051735140.db2.gz KVRIKBABYXGUGN-UHFFFAOYSA-N 0 1 322.412 4.415 20 0 DIADMN Cc1cc(Nc2cncn2C)c(OCc2ccccc2)cc1C ZINC001216378533 1051735267 /nfs/dbraw/zinc/73/52/67/1051735267.db2.gz GTORICHTLFHPLT-UHFFFAOYSA-N 0 1 307.397 4.360 20 0 DIADMN Cc1ccc(-c2cccc(CN[C@H](CCO)c3ccco3)c2)cc1 ZINC000184514309 1051736691 /nfs/dbraw/zinc/73/66/91/1051736691.db2.gz NHDZNPWZBNEQTE-HXUWFJFHSA-N 0 1 321.420 4.468 20 0 DIADMN C[C@@H](CCc1ccc(Cl)c(Cl)c1)N1CCOC[C@H]1C ZINC001173545702 1051739610 /nfs/dbraw/zinc/73/96/10/1051739610.db2.gz CSRHMIIYVMDPJE-NWDGAFQWSA-N 0 1 302.245 4.035 20 0 DIADMN C[C@H](CCc1ccc(Cl)c(Cl)c1)N(C)Cc1ncccn1 ZINC001173546483 1051740055 /nfs/dbraw/zinc/74/00/55/1051740055.db2.gz JLBUBHPNBGJWPP-GFCCVEGCSA-N 0 1 324.255 4.237 20 0 DIADMN CC(C)c1nc([C@@H](C)NCCOc2cccc(F)c2)cs1 ZINC000184721290 1051745990 /nfs/dbraw/zinc/74/59/90/1051745990.db2.gz CXFGWTNGYWNRRM-GFCCVEGCSA-N 0 1 308.422 4.135 20 0 DIADMN Cc1cc(F)cc(Cl)c1Nc1ccnn1-c1ccncc1 ZINC001216403503 1051749176 /nfs/dbraw/zinc/74/91/76/1051749176.db2.gz JCAPWJBTXZWPFT-UHFFFAOYSA-N 0 1 302.740 4.112 20 0 DIADMN C[C@H](CCc1ccc(Cl)c(Cl)c1)N1C[C@H]2CC[C@@H]1CO2 ZINC001173551090 1051751732 /nfs/dbraw/zinc/75/17/32/1051751732.db2.gz PYWLMOJDMGTQER-MRVWCRGKSA-N 0 1 314.256 4.178 20 0 DIADMN C[C@@H]1CCCc2ccccc2[C@H]1NCc1cn2ccccc2n1 ZINC000185084035 1051755235 /nfs/dbraw/zinc/75/52/35/1051755235.db2.gz YPHSKAYOGFIHJR-QRWLVFNGSA-N 0 1 305.425 4.138 20 0 DIADMN CC(C)[C@@H]1C[C@H]1NCc1c(F)c(Cl)ccc1Br ZINC001204128585 1051774950 /nfs/dbraw/zinc/77/49/50/1051774950.db2.gz LTRSIQJQPLHXLH-QPUJVOFHSA-N 0 1 320.633 4.376 20 0 DIADMN Cc1cc(CNC(C)(C)c2nc3ccccc3n2C)c(C)s1 ZINC000185639056 1051778226 /nfs/dbraw/zinc/77/82/26/1051778226.db2.gz XQZUYLWGARQVGJ-UHFFFAOYSA-N 0 1 313.470 4.277 20 0 DIADMN CC(C)c1cnc(C[NH2+][C@H](C)[C@H](c2ccccc2)N(C)C)s1 ZINC000185677293 1051778908 /nfs/dbraw/zinc/77/89/08/1051778908.db2.gz GXGHQMAEJUWDIC-RDTXWAMCSA-N 0 1 317.502 4.048 20 0 DIADMN Oc1ccc(-c2nc(-c3ccccc3F)no2)cc1C(F)(F)F ZINC001216483273 1051785233 /nfs/dbraw/zinc/78/52/33/1051785233.db2.gz XWXZIUVSPMMOOB-UHFFFAOYSA-N 0 1 324.233 4.267 20 0 DIADMN O=C(CCN(Cc1ccccc1C(F)(F)F)C1CC1)C1CC1 ZINC000767349040 1051792405 /nfs/dbraw/zinc/79/24/05/1051792405.db2.gz NUPAZEKDOIFBTJ-UHFFFAOYSA-N 0 1 311.347 4.039 20 0 DIADMN Cc1cc(CNCc2ccc(Oc3ccccc3)nc2)c(C)o1 ZINC000767363919 1051794253 /nfs/dbraw/zinc/79/42/53/1051794253.db2.gz MBNKJYDJYMKYEI-UHFFFAOYSA-N 0 1 308.381 4.374 20 0 DIADMN CCOc1cc(C)ccc1CN[C@@H](C)c1sccc1OC ZINC000186193140 1051800252 /nfs/dbraw/zinc/80/02/52/1051800252.db2.gz WFSJHOSZZFCXPD-ZDUSSCGKSA-N 0 1 305.443 4.315 20 0 DIADMN Cc1ccc(F)c(-c2noc(-c3c(O)cccc3Cl)n2)c1 ZINC001216522260 1051800845 /nfs/dbraw/zinc/80/08/45/1051800845.db2.gz MTMKEHLPNKSQHW-UHFFFAOYSA-N 0 1 304.708 4.210 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320.458 4.086 20 0 DIADMN FC(F)(F)c1ccc(Nc2cncn2Cc2ccccc2)cn1 ZINC001216549993 1051812750 /nfs/dbraw/zinc/81/27/50/1051812750.db2.gz DPDHDSIOHYLHQT-UHFFFAOYSA-N 0 1 318.302 4.089 20 0 DIADMN c1cc2ncc(Nc3cncn3Cc3ccccc3)cc2s1 ZINC001216550702 1051812780 /nfs/dbraw/zinc/81/27/80/1051812780.db2.gz OMRPUNOWXXAJJN-UHFFFAOYSA-N 0 1 306.394 4.285 20 0 DIADMN c1ncn(Cc2ccccc2)c1Nc1cnccc1C1CCC1 ZINC001216550674 1051813083 /nfs/dbraw/zinc/81/30/83/1051813083.db2.gz NCGCLTSVILKXEO-UHFFFAOYSA-N 0 1 304.397 4.338 20 0 DIADMN Cc1nc2cc(Nc3cncn3Cc3ccccc3)ccc2o1 ZINC001216553420 1051814692 /nfs/dbraw/zinc/81/46/92/1051814692.db2.gz BEEBZWOIXJZLOJ-UHFFFAOYSA-N 0 1 304.353 4.125 20 0 DIADMN Fc1cc(Nc2cncn2Cc2ccccc2)c(F)c(F)c1F ZINC001216553789 1051815017 /nfs/dbraw/zinc/81/50/17/1051815017.db2.gz MWMRSFMCCOOINR-UHFFFAOYSA-N 0 1 321.277 4.231 20 0 DIADMN CN1CCCc2ccc(Nc3cncn3Cc3ccccc3)cc21 ZINC001216553540 1051815101 /nfs/dbraw/zinc/81/51/01/1051815101.db2.gz FHHHRIOBKHOMHG-UHFFFAOYSA-N 0 1 318.424 4.057 20 0 DIADMN Fc1cc(Cl)ccc1Nc1cncn1Cc1ccccc1 ZINC001216553776 1051815245 /nfs/dbraw/zinc/81/52/45/1051815245.db2.gz MMAHALCPRLFCQE-UHFFFAOYSA-N 0 1 301.752 4.468 20 0 DIADMN CO[C@@H](CN[C@H](C)c1csc(C(C)C)n1)c1ccc(F)cc1 ZINC000186415769 1051815301 /nfs/dbraw/zinc/81/53/01/1051815301.db2.gz NMFPZMFHPMSSQP-WBMJQRKESA-N 0 1 322.449 4.444 20 0 DIADMN c1ncn(Cc2ccccc2)c1Nc1cccc(C2CCC2)n1 ZINC001216552678 1051815368 /nfs/dbraw/zinc/81/53/68/1051815368.db2.gz XEURUTATLGZQCX-UHFFFAOYSA-N 0 1 304.397 4.338 20 0 DIADMN c1ncn(Cc2ccccc2)c1Nc1ccc2sncc2c1 ZINC001216553630 1051815670 /nfs/dbraw/zinc/81/56/70/1051815670.db2.gz QSBREODNDCHBNU-UHFFFAOYSA-N 0 1 306.394 4.285 20 0 DIADMN O=C1CCCc2cccc(Nc3cncn3Cc3ccccc3)c21 ZINC001216554201 1051815701 /nfs/dbraw/zinc/81/57/01/1051815701.db2.gz CSSRGTIBFLRPEX-UHFFFAOYSA-N 0 1 317.392 4.194 20 0 DIADMN Fc1cc(Cl)cc(Nc2cncn2Cc2ccccc2)c1 ZINC001216553627 1051815914 /nfs/dbraw/zinc/81/59/14/1051815914.db2.gz JECPOQPSYWOIKU-UHFFFAOYSA-N 0 1 301.752 4.468 20 0 DIADMN CCCCCC(=O)N1C[C@H](C)N(Cc2ccccc2)[C@@H](C)[C@H]1C ZINC001130668049 1051816931 /nfs/dbraw/zinc/81/69/31/1051816931.db2.gz BGBAGGJQRRRPBM-OKZBNKHCSA-N 0 1 316.489 4.077 20 0 DIADMN Nc1cc(F)cc(Nc2cncn2Cc2ccccc2)c1Cl ZINC001216555127 1051818645 /nfs/dbraw/zinc/81/86/45/1051818645.db2.gz WCKFRSXQCZNCMB-UHFFFAOYSA-N 0 1 316.767 4.050 20 0 DIADMN CCCn1c(C)nnc1CN(CC)C[C@H](CC)c1ccccc1 ZINC000186608784 1051823962 /nfs/dbraw/zinc/82/39/62/1051823962.db2.gz ZNLSJCBSLDMQRE-KRWDZBQOSA-N 0 1 314.477 4.012 20 0 DIADMN COc1ccc(-c2nc(CN3CCCC4(CC4)C3)cs2)cc1 ZINC000186624514 1051825685 /nfs/dbraw/zinc/82/56/85/1051825685.db2.gz KRTBPUVEYFSCRF-UHFFFAOYSA-N 0 1 314.454 4.195 20 0 DIADMN Cc1ccc(-c2noc([C@@H](C)N3CCCC4(CC4)C3)n2)cc1F ZINC000186968173 1051833670 /nfs/dbraw/zinc/83/36/70/1051833670.db2.gz CCSYJNHWSVJEED-CYBMUJFWSA-N 0 1 315.392 4.121 20 0 DIADMN S=c1ncccn1CN1CCC[C@H]1CCCc1ccccc1 ZINC000767764028 1051848034 /nfs/dbraw/zinc/84/80/34/1051848034.db2.gz QFTFUNKDMGQCOO-QGZVFWFLSA-N 0 1 313.470 4.057 20 0 DIADMN Cc1cc(CN[C@H](c2ccc(F)cc2)C2CCCC2)nc(C)n1 ZINC000671303105 1051855322 /nfs/dbraw/zinc/85/53/22/1051855322.db2.gz WMHQSIZTVAONMJ-IBGZPJMESA-N 0 1 313.420 4.254 20 0 DIADMN CC(C)c1ccc(Nc2ccc(N3CCN(C)CC3)cc2)cc1 ZINC001173893373 1051859035 /nfs/dbraw/zinc/85/90/35/1051859035.db2.gz CNWIOLMXNCQMAB-UHFFFAOYSA-N 0 1 309.457 4.305 20 0 DIADMN OCCCN(C/C=C/Cl)C(c1ccccc1)c1ccccc1 ZINC000767894231 1051861151 /nfs/dbraw/zinc/86/11/51/1051861151.db2.gz UPWXTYPEFMQYNC-NTUHNPAUSA-N 0 1 315.844 4.213 20 0 DIADMN C/C(=C/c1ccccc1)CN(C)Cc1c(C)nc2ccccn21 ZINC000494263482 1051866473 /nfs/dbraw/zinc/86/64/73/1051866473.db2.gz YLLKRCNVHDLUAS-SSZFMOIBSA-N 0 1 305.425 4.178 20 0 DIADMN C/C(=C/c1ccccc1)CN(C)[C@@H](C)C(=O)N(C)c1ccccc1 ZINC000494286596 1051870905 /nfs/dbraw/zinc/87/09/05/1051870905.db2.gz BBQUUBIZKLBDGL-SOBQPUOHSA-N 0 1 322.452 4.073 20 0 DIADMN COc1ccc(C(C)C)cc1Nc1ccnn1-c1ccncc1 ZINC001173917616 1051876813 /nfs/dbraw/zinc/87/68/13/1051876813.db2.gz SKIVDWSGVWTMNK-UHFFFAOYSA-N 0 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MUBXOGJNQSDFGQ-UHFFFAOYSA-N 0 1 316.744 4.080 20 0 DIADMN CC(C)c1ccc(CN(C)CC[S@@](=O)c2ccccc2)cc1 ZINC000609193327 1051880714 /nfs/dbraw/zinc/88/07/14/1051880714.db2.gz JEZFDIPOUSYKFO-JOCHJYFZSA-N 0 1 315.482 4.050 20 0 DIADMN Cc1ncc2c(n1)CCC[C@H]2N[C@H](C)c1ccc(Cl)c(F)c1 ZINC000768105291 1051883943 /nfs/dbraw/zinc/88/39/43/1051883943.db2.gz MWVBLIOXUUMLLO-QLJPJBMISA-N 0 1 319.811 4.306 20 0 DIADMN CC(C)(C)OC(=O)Nc1cc(Nc2ccncc2)ccc1Cl ZINC001173885361 1051888394 /nfs/dbraw/zinc/88/83/94/1051888394.db2.gz WJBWBGWYGQYXNA-UHFFFAOYSA-N 0 1 319.792 4.248 20 0 DIADMN CC(C)(C)OC(=O)Nc1cc(Cl)ccc1Nc1ccncc1 ZINC001173885001 1051888513 /nfs/dbraw/zinc/88/85/13/1051888513.db2.gz CAHIJIVBTSJVEH-UHFFFAOYSA-N 0 1 319.792 4.248 20 0 DIADMN Cc1ccc(Nc2ccncc2)c(NC(=O)OC(C)(C)C)c1C ZINC001173885156 1051888773 /nfs/dbraw/zinc/88/87/73/1051888773.db2.gz LUJJZOYEESCKAW-UHFFFAOYSA-N 0 1 313.401 4.211 20 0 DIADMN Cc1ccc(CN(C)Cc2sc3nc(C)nc(C)c3c2C)o1 ZINC000768168222 1051891818 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ZINC001232901391 1054143991 /nfs/dbraw/zinc/14/39/91/1054143991.db2.gz KJWHBZGIBHPBBJ-OAQYLSRUSA-N 0 1 315.420 4.481 20 0 DIADMN Cc1nc(C)c(CN[C@@H](Cc2ccccc2)c2ccccc2F)[nH]1 ZINC001333175550 1054146019 /nfs/dbraw/zinc/14/60/19/1054146019.db2.gz SBGBCCWHVJWPPE-IBGZPJMESA-N 0 1 323.415 4.239 20 0 DIADMN Cn1c(Cl)ncc1CNCc1ccc(C2CCCCC2)cc1 ZINC000848554316 1054146487 /nfs/dbraw/zinc/14/64/87/1054146487.db2.gz XVVCXEKLKGWZCE-UHFFFAOYSA-N 0 1 317.864 4.411 20 0 DIADMN Cc1nnc(SCc2ccc(Cl)c(C(F)(F)F)c2)[nH]1 ZINC001333262672 1054148678 /nfs/dbraw/zinc/14/86/78/1054148678.db2.gz XVDJWZNMEVIXKQ-UHFFFAOYSA-N 0 1 307.728 4.078 20 0 DIADMN Cc1n[nH]c(SCc2ccc(Cl)c(C(F)(F)F)c2)n1 ZINC001333262672 1054148682 /nfs/dbraw/zinc/14/86/82/1054148682.db2.gz XVDJWZNMEVIXKQ-UHFFFAOYSA-N 0 1 307.728 4.078 20 0 DIADMN FC(F)(F)Sc1cccc(CN2CCC[C@]3(CCO3)C2)c1 ZINC001232948152 1054155577 /nfs/dbraw/zinc/15/55/77/1054155577.db2.gz OCPVKALBWKSPLM-AWEZNQCLSA-N 0 1 317.376 4.053 20 0 DIADMN [O-]c1cc(C[N@H+]2CCC[C@H](c3ccccc3)C2)cc(F)c1F ZINC001232971845 1054163523 /nfs/dbraw/zinc/16/35/23/1054163523.db2.gz QHUNZCMBTYHXDH-HNNXBMFYSA-N 0 1 303.352 4.050 20 0 DIADMN [O-]c1cc(C[N@H+]2CCC[C@@H]2Cc2ccc(F)cc2)cc(F)c1F ZINC001232975288 1054163696 /nfs/dbraw/zinc/16/36/96/1054163696.db2.gz YZHIPTAUZPTJTC-OAHLLOKOSA-N 0 1 321.342 4.017 20 0 DIADMN c1ccc(C[C@@H]2COCCN2Cc2ccc(C3CC3)cc2)cc1 ZINC001232986156 1054166141 /nfs/dbraw/zinc/16/61/41/1054166141.db2.gz FVTRWQPCYHRKOB-OAQYLSRUSA-N 0 1 307.437 4.008 20 0 DIADMN CCn1cc(CN[C@@H](C)c2ccccc2C(F)(F)F)c(C)n1 ZINC001333708710 1054167974 /nfs/dbraw/zinc/16/79/74/1054167974.db2.gz YRCMACHRIQARGS-LBPRGKRZSA-N 0 1 311.351 4.081 20 0 DIADMN CC1CC([N@@H+](C)Cc2cnn(-c3cccc(C(F)(F)F)c3)c2)C1 ZINC001233038422 1054174892 /nfs/dbraw/zinc/17/48/92/1054174892.db2.gz PETXPJPEWDHKCI-UHFFFAOYSA-N 0 1 323.362 4.121 20 0 DIADMN Cc1nnsc1[C@H](C)N[C@H](C)c1ccc(-c2ccncc2)cc1 ZINC001333889812 1054175879 /nfs/dbraw/zinc/17/58/79/1054175879.db2.gz ACMRAHOCLNFCLO-OLZOCXBDSA-N 0 1 324.453 4.320 20 0 DIADMN [O-]c1cnc(Cl)cc1C[N@H+]1CCC[C@H](c2ccccc2)CC1 ZINC001233039339 1054178056 /nfs/dbraw/zinc/17/80/56/1054178056.db2.gz UGFGFMZHEVSFAS-HNNXBMFYSA-N 0 1 316.832 4.210 20 0 DIADMN CC(C)(C)C[C@H]1CCCN1C(=O)c1cc(C2CCCCC2)[nH]n1 ZINC000622337085 1054178739 /nfs/dbraw/zinc/17/87/39/1054178739.db2.gz MFPBPSOTFLWPPR-OAHLLOKOSA-N 0 1 317.477 4.498 20 0 DIADMN C[C@H](c1ccccc1)N1CCN(Cc2ccsc2Cl)CC1 ZINC001233058769 1054180328 /nfs/dbraw/zinc/18/03/28/1054180328.db2.gz SEOHECXPLXQBEE-CQSZACIVSA-N 0 1 320.889 4.280 20 0 DIADMN COc1cc(Br)cc(F)c1CN(C)CC(C)(C)C ZINC001233066087 1054180901 /nfs/dbraw/zinc/18/09/01/1054180901.db2.gz YLNQOPSBJPGWIJ-UHFFFAOYSA-N 0 1 318.230 4.075 20 0 DIADMN c1nc(-c2ccccc2)sc1CNCc1cnn(C2CCC2)c1 ZINC001334323291 1054185844 /nfs/dbraw/zinc/18/58/44/1054185844.db2.gz ZURKQDDYMFZJJB-UHFFFAOYSA-N 0 1 324.453 4.021 20 0 DIADMN Cn1cc(CNCc2cccc(C(F)F)c2)c(C2CCCC2)n1 ZINC001334317776 1054187018 /nfs/dbraw/zinc/18/70/18/1054187018.db2.gz AAMQTKUUARBPIF-UHFFFAOYSA-N 0 1 319.399 4.305 20 0 DIADMN FC(F)c1noc(CNCC2CCC(c3ccccc3)CC2)n1 ZINC001334305164 1054187081 /nfs/dbraw/zinc/18/70/81/1054187081.db2.gz YSPFGZVJNSSGCM-UHFFFAOYSA-N 0 1 321.371 4.071 20 0 DIADMN CCN(Cc1n[nH]c2cc(F)ccc21)Cc1cccc(F)c1F ZINC001233128475 1054188632 /nfs/dbraw/zinc/18/86/32/1054188632.db2.gz LLHNLQGRVLCULV-UHFFFAOYSA-N 0 1 319.330 4.002 20 0 DIADMN Fc1ccc([C@H]2CCCN2Cc2[nH]nc3cc(F)ccc32)cc1 ZINC001233119562 1054189298 /nfs/dbraw/zinc/18/92/98/1054189298.db2.gz MALYKIUFJJPPLJ-GOSISDBHSA-N 0 1 313.351 4.178 20 0 DIADMN Fc1ccc([C@H]2CCCN2Cc2n[nH]c3cc(F)ccc32)cc1 ZINC001233119562 1054189303 /nfs/dbraw/zinc/18/93/03/1054189303.db2.gz MALYKIUFJJPPLJ-GOSISDBHSA-N 0 1 313.351 4.178 20 0 DIADMN CCN(Cc1cc2c(C)ccc(C)c2nc1Cl)CC(C)(C)O ZINC001233135913 1054191489 /nfs/dbraw/zinc/19/14/89/1054191489.db2.gz HYIZUZGGKZUBNN-UHFFFAOYSA-N 0 1 320.864 4.098 20 0 DIADMN Cc1ccc(OC2CCN(Cc3cnc(C)c(C)c3)CC2)cc1 ZINC001233164200 1054192796 /nfs/dbraw/zinc/19/27/96/1054192796.db2.gz TVQVUYCLJKUGSR-UHFFFAOYSA-N 0 1 310.441 4.050 20 0 DIADMN CC(C)Oc1ncc(Cl)cc1CN1CC2CCC(CC2)C1 ZINC001233166014 1054194498 /nfs/dbraw/zinc/19/44/98/1054194498.db2.gz YIYJWFFYCLYNAL-UHFFFAOYSA-N 0 1 308.853 4.144 20 0 DIADMN CC(C)Oc1ncc(Cl)cc1CN1CCC[C@H]2CCC[C@H]21 ZINC001233167322 1054195206 /nfs/dbraw/zinc/19/52/06/1054195206.db2.gz QJXMBBXOGXOTRB-CZUORRHYSA-N 0 1 308.853 4.287 20 0 DIADMN CC(C)COc1ccccc1CN[C@H](c1ccccn1)C1CC1 ZINC001334685180 1054196067 /nfs/dbraw/zinc/19/60/67/1054196067.db2.gz KFEZVCFUPUKVJD-FQEVSTJZSA-N 0 1 310.441 4.357 20 0 DIADMN CCCc1[nH]ncc1C(=O)N1CC(CC)(CC)c2ccccc21 ZINC001334794286 1054199056 /nfs/dbraw/zinc/19/90/56/1054199056.db2.gz LKOLJDGZLWAKPU-UHFFFAOYSA-N 0 1 311.429 4.080 20 0 DIADMN CN(CCc1cccs1)Cc1ccc(Cl)c(F)c1F ZINC001233210445 1054201459 /nfs/dbraw/zinc/20/14/59/1054201459.db2.gz INDGTVDGQOHBNC-UHFFFAOYSA-N 0 1 301.789 4.354 20 0 DIADMN COc1cc(Br)cc(CN2CCC[C@@H]3CCC[C@@H]32)c1 ZINC001233216047 1054204268 /nfs/dbraw/zinc/20/42/68/1054204268.db2.gz ZQJXWTKXNRPMJI-BBRMVZONSA-N 0 1 324.262 4.222 20 0 DIADMN Clc1ccc(-c2ccc(CN3CCCC34COC4)cc2)cc1 ZINC001233220293 1054205936 /nfs/dbraw/zinc/20/59/36/1054205936.db2.gz RYFKUSQFTNXAHN-UHFFFAOYSA-N 0 1 313.828 4.372 20 0 DIADMN Cc1c(C)c(CN2CCC[C@@H](CF)C2)ccc1Br ZINC001233222505 1054207538 /nfs/dbraw/zinc/20/75/38/1054207538.db2.gz RGUYJRCSHYRDBY-ZDUSSCGKSA-N 0 1 314.242 4.247 20 0 DIADMN C[C@@H]1Cc2ccccc2CN1Cc1ccc(O)c(OCC2CC2)c1 ZINC001233227879 1054210266 /nfs/dbraw/zinc/21/02/66/1054210266.db2.gz FBDDGSJDMFDRGA-OAHLLOKOSA-N 0 1 323.436 4.128 20 0 DIADMN CO[C@@H]1CC[C@@H](N[C@H](c2cc3ccccc3o2)c2ccccn2)C1 ZINC001335267324 1054212060 /nfs/dbraw/zinc/21/20/60/1054212060.db2.gz NGVAUXBCNWIZCH-QINHECLXSA-N 0 1 322.408 4.074 20 0 DIADMN Cc1ccc(CN2CCc3cc(C(F)(F)F)ccc3C2)cc1O ZINC001233234977 1054213648 /nfs/dbraw/zinc/21/36/48/1054213648.db2.gz KUGZAXQNDJJWMB-UHFFFAOYSA-N 0 1 321.342 4.278 20 0 DIADMN COC[C@@H](NCc1ccc(C(F)F)c(F)c1)c1ccccc1 ZINC001335464487 1054217049 /nfs/dbraw/zinc/21/70/49/1054217049.db2.gz ITPLZDORSMLMKW-MRXNPFEDSA-N 0 1 309.331 4.241 20 0 DIADMN Cc1ccc(Cl)cc1CN1CC[C@H](C(=O)c2ccccc2)C1 ZINC001233250879 1054217614 /nfs/dbraw/zinc/21/76/14/1054217614.db2.gz DBROMKXVQRPKLU-INIZCTEOSA-N 0 1 313.828 4.353 20 0 DIADMN C[C@@H]1Oc2ccccc2[C@@H]1NCc1ccc(C(F)F)c(F)c1 ZINC001335532990 1054220266 /nfs/dbraw/zinc/22/02/66/1054220266.db2.gz ILWHRMLYLPXFNW-MGPLVRAMSA-N 0 1 307.315 4.375 20 0 DIADMN Fc1ccc([C@@H]2CCCN2Cc2cccc3c2CCO3)c(F)c1 ZINC001233277870 1054220632 /nfs/dbraw/zinc/22/06/32/1054220632.db2.gz UWIJFRKQJGETPD-SFHVURJKSA-N 0 1 315.363 4.237 20 0 DIADMN COc1cccc(C[C@H]2CCCN(Cc3ccc(Cl)o3)C2)c1 ZINC001233317408 1054227620 /nfs/dbraw/zinc/22/76/20/1054227620.db2.gz LMZMAVRKBFMNRL-OAHLLOKOSA-N 0 1 319.832 4.396 20 0 DIADMN CC[C@H](F)C(=O)N1CCCC[C@H]1c1nc2ccc(Cl)cc2[nH]1 ZINC001335947080 1054227992 /nfs/dbraw/zinc/22/79/92/1054227992.db2.gz BGWAFKMFIYRVDU-FZMZJTMJSA-N 0 1 323.799 4.018 20 0 DIADMN COc1cccc([C@@H]2CCCN(Cc3ccc(Cl)o3)C2)c1 ZINC001233317357 1054229776 /nfs/dbraw/zinc/22/97/76/1054229776.db2.gz JSTYNVKJDXIJJQ-CQSZACIVSA-N 0 1 305.805 4.321 20 0 DIADMN Clc1ccc(CN2CCC3(CC(OCC4CC4)C3)CC2)o1 ZINC001233316174 1054230252 /nfs/dbraw/zinc/23/02/52/1054230252.db2.gz RTQDXZCZKRGEHH-UHFFFAOYSA-N 0 1 309.837 4.104 20 0 DIADMN CCN(Cc1sncc1C)Cc1ccc(C(F)(F)F)cc1 ZINC001233321765 1054231311 /nfs/dbraw/zinc/23/13/11/1054231311.db2.gz CAKCMBAFVXRZHF-UHFFFAOYSA-N 0 1 314.376 4.492 20 0 DIADMN COc1cccc([C@@H]2CCCCN2Cc2sncc2C)c1 ZINC001233320913 1054233236 /nfs/dbraw/zinc/23/32/36/1054233236.db2.gz SDGYDGFVAWUYJB-INIZCTEOSA-N 0 1 302.443 4.187 20 0 DIADMN CCC1(CC)CN(C(=O)c2cn[nH]c2C(C)C)c2ccccc21 ZINC000622459514 1054233759 /nfs/dbraw/zinc/23/37/59/1054233759.db2.gz ZNHQYXDMUDAFSM-UHFFFAOYSA-N 0 1 311.429 4.251 20 0 DIADMN c1ccc(Cc2ccc(CN3CCc4cnccc4C3)cc2)cc1 ZINC001233330070 1054235997 /nfs/dbraw/zinc/23/59/97/1054235997.db2.gz UQGGTYRQQNTDTG-UHFFFAOYSA-N 0 1 314.432 4.231 20 0 DIADMN CC(=CC(=O)Nc1nc2ccc(Cl)cc2[nH]1)c1ccccc1 ZINC001439084299 1054238338 /nfs/dbraw/zinc/23/83/38/1054238338.db2.gz DNOGEFBLUGARDZ-PKNBQFBNSA-N 0 1 311.772 4.258 20 0 DIADMN O=C(c1c(O)cccc1F)N1CCC[C@@H]1CCC1CCCC1 ZINC000622447223 1054239942 /nfs/dbraw/zinc/23/99/42/1054239942.db2.gz CFIXCVRTOCSUAN-CQSZACIVSA-N 0 1 305.393 4.106 20 0 DIADMN FC(F)(F)CCCN1CC[C@H](Oc2ccccc2Cl)C1 ZINC001336658301 1054241802 /nfs/dbraw/zinc/24/18/02/1054241802.db2.gz MBIOUIZTIXZXNC-NSHDSACASA-N 0 1 307.743 4.136 20 0 DIADMN COc1cc(F)c(CN2CCCC3(CC(F)C3)CC2)cc1F ZINC001233343775 1054243050 /nfs/dbraw/zinc/24/30/50/1054243050.db2.gz AKROCPPZLDRJMA-UHFFFAOYSA-N 0 1 313.363 4.078 20 0 DIADMN Cc1cc(CN[C@@H](C)c2ccccc2C(F)(F)F)cnc1F ZINC001336707199 1054243333 /nfs/dbraw/zinc/24/33/33/1054243333.db2.gz JEORWRZGJZIEDS-NSHDSACASA-N 0 1 312.310 4.399 20 0 DIADMN CC1(C)CC[C@H](NC(=O)c2cn[nH]c2-c2ccc(Cl)s2)C1 ZINC000622478171 1054245862 /nfs/dbraw/zinc/24/58/62/1054245862.db2.gz WVVFOVQDZOLPFP-VIFPVBQESA-N 0 1 323.849 4.100 20 0 DIADMN CSc1cccc(Cl)c1CN1CC[C@]2(C1)CCCCO2 ZINC001233350601 1054246088 /nfs/dbraw/zinc/24/60/88/1054246088.db2.gz MTKLZTMHZQPZSF-INIZCTEOSA-N 0 1 311.878 4.207 20 0 DIADMN CC(C)[N@@H+](Cc1cnc2cccc(Cl)n12)Cc1ccccc1 ZINC001233355614 1054247981 /nfs/dbraw/zinc/24/79/81/1054247981.db2.gz DZRUBUZPWIVXPO-UHFFFAOYSA-N 0 1 313.832 4.398 20 0 DIADMN Clc1cccc2ncc(C[N@H+]3CCC[C@@H]4CCCC[C@H]43)n21 ZINC001233359267 1054248026 /nfs/dbraw/zinc/24/80/26/1054248026.db2.gz POBPGAKJJJYDDC-DZGCQCFKSA-N 0 1 303.837 4.142 20 0 DIADMN Clc1cccc2ncc(CN3CCC[C@@H]4CCCC[C@H]43)n21 ZINC001233359267 1054248040 /nfs/dbraw/zinc/24/80/40/1054248040.db2.gz POBPGAKJJJYDDC-DZGCQCFKSA-N 0 1 303.837 4.142 20 0 DIADMN COC1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1c(Cl)cccc1SC ZINC001233353354 1054248289 /nfs/dbraw/zinc/24/82/89/1054248289.db2.gz QYXRTCYJFXJDPN-FUNVUKJBSA-N 0 1 311.878 4.204 20 0 DIADMN Fc1ccccc1[C@@H]1CCCCN1Cc1cccc2nccn21 ZINC001233362877 1054248347 /nfs/dbraw/zinc/24/83/47/1054248347.db2.gz 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/nfs/dbraw/zinc/25/13/75/1054251375.db2.gz GLHQZGDXKBVQQY-NSHDSACASA-N 0 1 320.824 4.280 20 0 DIADMN Cc1ncc(CN2CCC(Cc3cccc(Cl)c3)CC2)o1 ZINC001233364871 1054252420 /nfs/dbraw/zinc/25/24/20/1054252420.db2.gz IHHFLTLQBUKCCP-UHFFFAOYSA-N 0 1 304.821 4.091 20 0 DIADMN CCN(Cc1ccc(Cl)cc1)Cc1cc(F)c(F)cc1N ZINC001233381467 1054255159 /nfs/dbraw/zinc/25/51/59/1054255159.db2.gz FXADIZRHGKDJTJ-UHFFFAOYSA-N 0 1 310.775 4.223 20 0 DIADMN COc1ccc(C[N@@H+](C)CCCc2ccccc2)c(Cl)c1O ZINC001233399972 1054259078 /nfs/dbraw/zinc/25/90/78/1054259078.db2.gz QLMIMDZOZUJDSO-UHFFFAOYSA-N 0 1 319.832 4.119 20 0 DIADMN COc1ccc(CN(C)CCCc2ccccc2)c(Cl)c1O ZINC001233399972 1054259091 /nfs/dbraw/zinc/25/90/91/1054259091.db2.gz QLMIMDZOZUJDSO-UHFFFAOYSA-N 0 1 319.832 4.119 20 0 DIADMN Cc1ccccc1NC(=O)CN[C@H](C)c1ccc(Cl)c(F)c1 ZINC001337221948 1054260098 /nfs/dbraw/zinc/26/00/98/1054260098.db2.gz UWNHDYNAEJKNGR-GFCCVEGCSA-N 0 1 320.795 4.077 20 0 DIADMN Clc1ncnc(Cl)c1CN1CCC[C@H]1C1CCCCC1 ZINC001233411193 1054262366 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CCCN(CC)Cc1nn(C(=O)OC(C)(C)C)c2ccccc12 ZINC001237779876 1055530103 /nfs/dbraw/zinc/53/01/03/1055530103.db2.gz JPAZXZVTNZNUKY-UHFFFAOYSA-N 0 1 317.433 4.051 20 0 DIADMN c1csc(C2CCN(Cc3cnc(C4CC4)s3)CC2)c1 ZINC001237790669 1055530393 /nfs/dbraw/zinc/53/03/93/1055530393.db2.gz YLFDDDDOQJEHQD-UHFFFAOYSA-N 0 1 304.484 4.462 20 0 DIADMN Cc1ccc(C)c(CNCc2ccc(F)cc2Br)c1 ZINC001620907752 1055531414 /nfs/dbraw/zinc/53/14/14/1055531414.db2.gz BEJFZRHNDBDSLK-UHFFFAOYSA-N 0 1 322.221 4.495 20 0 DIADMN CCCn1cncc1CNC1(c2ccc(Cl)c(Cl)c2)CC1 ZINC001620912883 1055534931 /nfs/dbraw/zinc/53/49/31/1055534931.db2.gz KHOVDIUXGDBZKK-UHFFFAOYSA-N 0 1 324.255 4.379 20 0 DIADMN COC[C@@H](NCc1csc(C)c1C)c1ccc(Cl)cc1 ZINC001620917725 1055539167 /nfs/dbraw/zinc/53/91/67/1055539167.db2.gz PHMHTXKBCKSABO-MRXNPFEDSA-N 0 1 309.862 4.496 20 0 DIADMN Cc1nc(CN2CCC(Cc3cccc(F)c3)CC2)ccc1F ZINC001237827356 1055540049 /nfs/dbraw/zinc/54/00/49/1055540049.db2.gz PQYKBRVYMURFKK-UHFFFAOYSA-N 0 1 316.395 4.123 20 0 DIADMN 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CC(C)C1=NCCc2ccc(CN3CCC[C@H]3C(F)(F)F)cc21 ZINC001237881839 1055548815 /nfs/dbraw/zinc/54/88/15/1055548815.db2.gz WJJZSTPIGVIFOE-INIZCTEOSA-N 0 1 324.390 4.215 20 0 DIADMN CCN(Cc1[nH]c(-c2ccc[nH]2)cc1OC)Cc1ccccc1 ZINC001237874397 1055549193 /nfs/dbraw/zinc/54/91/93/1055549193.db2.gz VIISMKSWKRCOJT-UHFFFAOYSA-N 0 1 309.413 4.041 20 0 DIADMN FC(F)(F)c1cccc(CNCc2ccc3occc3c2)n1 ZINC001620942462 1055555942 /nfs/dbraw/zinc/55/59/42/1055555942.db2.gz HGSZJBYKICNIAD-UHFFFAOYSA-N 0 1 306.287 4.136 20 0 DIADMN CCOc1cc(F)cc(CN2CCC3(CCC(C)(C)O3)CC2)c1 ZINC001237922547 1055561255 /nfs/dbraw/zinc/56/12/55/1055561255.db2.gz FQLXRUPNCWQZEI-UHFFFAOYSA-N 0 1 321.436 4.148 20 0 DIADMN COc1cc(C)cc(C[NH2+][C@H](C)c2cc(Cl)ccc2[O-])c1 ZINC000186156116 1055562407 /nfs/dbraw/zinc/56/24/07/1055562407.db2.gz BEAIWSRDAFYOMJ-GFCCVEGCSA-N 0 1 305.805 4.213 20 0 DIADMN CCC[C@H](CNCc1csc(-c2ccc(Cl)cc2)n1)OC ZINC001620949287 1055563964 /nfs/dbraw/zinc/56/39/64/1055563964.db2.gz JIMPWTBZEBTGPY-OAHLLOKOSA-N 0 1 324.877 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/nfs/dbraw/zinc/60/91/88/1055609188.db2.gz XPVGNCZVUMSLTE-UHFFFAOYSA-N 0 1 321.342 4.278 20 0 DIADMN CCN(CC)[C@@H](C(=O)Nc1csc(C)c1)c1ccccc1 ZINC001595540862 1055609794 /nfs/dbraw/zinc/60/97/94/1055609794.db2.gz LCAXBXLEAZAXTE-MRXNPFEDSA-N 0 1 302.443 4.078 20 0 DIADMN Cc1nc2cccc(C(=O)N[C@H](c3ccccc3)C3CCC3)c2[nH]1 ZINC000338541663 1055610080 /nfs/dbraw/zinc/61/00/80/1055610080.db2.gz YLEUFEFDGTYGFD-GOSISDBHSA-N 0 1 319.408 4.143 20 0 DIADMN Cc1nc2c(cccc2C(=O)N2CCC[C@@H](C(C)(C)C)CC2)[nH]1 ZINC000338540587 1055611843 /nfs/dbraw/zinc/61/18/43/1055611843.db2.gz ROXWAJNEDAUMTA-CQSZACIVSA-N 0 1 313.445 4.160 20 0 DIADMN C[C@H]1CN(Cc2cc(Cl)c(O)cc2F)Cc2ccccc21 ZINC001238142544 1055612626 /nfs/dbraw/zinc/61/26/26/1055612626.db2.gz GJNPKXXGWOAYHD-NSHDSACASA-N 0 1 305.780 4.304 20 0 DIADMN CSc1cccc(NC(=O)c2cn[nH]c2-c2ccccc2)c1 ZINC000028927548 1055612846 /nfs/dbraw/zinc/61/28/46/1055612846.db2.gz XLJYVFJKOIYNJY-UHFFFAOYSA-N 0 1 309.394 4.051 20 0 DIADMN Cc1ccc2c(c1)CCN(Cc1cc(Cl)c(O)cc1F)C2 ZINC001238155254 1055613401 /nfs/dbraw/zinc/61/34/01/1055613401.db2.gz NFDGGQMQGTYAPJ-UHFFFAOYSA-N 0 1 305.780 4.051 20 0 DIADMN COc1ccc(CN(C)Cc2cccc(-c3cccs3)n2)cc1 ZINC001238208938 1055620414 /nfs/dbraw/zinc/62/04/14/1055620414.db2.gz JRRVIMMEGQMOFW-UHFFFAOYSA-N 0 1 324.449 4.451 20 0 DIADMN CCCOC1CCN(Cc2cccc(-c3cccs3)n2)CC1 ZINC001238217637 1055622117 /nfs/dbraw/zinc/62/21/17/1055622117.db2.gz GLOXCZMSWYYGMT-UHFFFAOYSA-N 0 1 316.470 4.201 20 0 DIADMN Cc1nc([C@@H]2CCCN(Cc3ccc(Cl)c(C)c3C)C2)no1 ZINC001238216290 1055623336 /nfs/dbraw/zinc/62/33/36/1055623336.db2.gz UHLJJAADFVMUIZ-OAHLLOKOSA-N 0 1 319.836 4.028 20 0 DIADMN Clc1cccc(Cl)c1C1(NCCc2ccns2)CC1 ZINC001168563870 1055624934 /nfs/dbraw/zinc/62/49/34/1055624934.db2.gz ODLOMRQOVGWEJO-UHFFFAOYSA-N 0 1 313.253 4.271 20 0 DIADMN O=C([O-])c1cc(F)ccc1C[N@H+]1CCC[C@@H]1c1cccc(F)c1 ZINC001238233629 1055627864 /nfs/dbraw/zinc/62/78/64/1055627864.db2.gz AMMLOVIDMHAITC-QGZVFWFLSA-N 0 1 317.335 4.000 20 0 DIADMN Cc1cccc([C@@H]2CCC[N@H+]2Cc2ccc(F)cc2C(=O)[O-])c1 ZINC001238238746 1055627887 /nfs/dbraw/zinc/62/78/87/1055627887.db2.gz VCABKNJEEMUIPP-SFHVURJKSA-N 0 1 313.372 4.169 20 0 DIADMN Cc1ccc(-c2cc(C(=O)N(C)[C@@H]3CCCC[C@@H]3C)n[nH]2)cc1 ZINC000030378045 1055628902 /nfs/dbraw/zinc/62/89/02/1055628902.db2.gz YYFNFIMHKQMCFX-KBXCAEBGSA-N 0 1 311.429 4.036 20 0 DIADMN Cc1cc(Cl)c(Cl)cc1C[N@H+]1CCC[C@](C)(O)CC1 ZINC001238264826 1055631382 /nfs/dbraw/zinc/63/13/82/1055631382.db2.gz VWBSLSKYQXDHSG-HNNXBMFYSA-N 0 1 302.245 4.039 20 0 DIADMN Cc1cc(Cl)c(Cl)cc1CN1CCC[C@](C)(O)CC1 ZINC001238264826 1055631385 /nfs/dbraw/zinc/63/13/85/1055631385.db2.gz VWBSLSKYQXDHSG-HNNXBMFYSA-N 0 1 302.245 4.039 20 0 DIADMN Cc1cc(Cl)c(Cl)cc1C[N@@H+]1CC[C@@H](C)[C@](C)(O)CC1 ZINC001238261891 1055631573 /nfs/dbraw/zinc/63/15/73/1055631573.db2.gz DNWMABHMVQUYIN-MLGOLLRUSA-N 0 1 316.272 4.285 20 0 DIADMN Cc1cc(Cl)c(Cl)cc1CN1CC[C@@H](OC(C)C)C1 ZINC001238257686 1055631673 /nfs/dbraw/zinc/63/16/73/1055631673.db2.gz 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ZINC001616179633 1056615762 /nfs/dbraw/zinc/61/57/62/1056615762.db2.gz HGAGNBMJLUXIMO-UHFFFAOYSA-N 0 1 302.393 4.321 20 0 DIADMN Cc1nn(C)c(CN[C@@H]2CC[C@@H](C)c3ccccc32)c1Cl ZINC000921928266 1056633579 /nfs/dbraw/zinc/63/35/79/1056633579.db2.gz STXANLNTSIBNGQ-IAQYHMDHSA-N 0 1 303.837 4.110 20 0 DIADMN CCc1ccc(CN(C)[C@H](C)C(=O)Nc2cc(C)ccc2C)cc1 ZINC000008529786 1056634217 /nfs/dbraw/zinc/63/42/17/1056634217.db2.gz KKADVXATXLGDRP-QGZVFWFLSA-N 0 1 324.468 4.325 20 0 DIADMN CC[C@]1(C)CCN(Cc2cc(F)ccc2Br)C1 ZINC001616338930 1056637150 /nfs/dbraw/zinc/63/71/50/1056637150.db2.gz RKUXKQTWDMKPRR-CQSZACIVSA-N 0 1 300.215 4.210 20 0 DIADMN CC(C)c1cccc(CN2CCO[C@@]3(CCc4ccccc43)C2)c1 ZINC001616373999 1056645645 /nfs/dbraw/zinc/64/56/45/1056645645.db2.gz COQHAQQFNXQQAO-QFIPXVFZSA-N 0 1 321.464 4.484 20 0 DIADMN Oc1ccc(F)cc1-c1cc(F)c(CN2CCCC2)c(F)c1 ZINC001240697371 1056648173 /nfs/dbraw/zinc/64/81/73/1056648173.db2.gz GQHMEDDDGHTFDK-UHFFFAOYSA-N 0 1 307.315 4.072 20 0 DIADMN CCO[C@H](C)c1noc(CN2CCC[C@@H]2CC2CCCCC2)n1 ZINC000076723758 1056651853 /nfs/dbraw/zinc/65/18/53/1056651853.db2.gz KLQOFJMSAIXIBI-GDBMZVCRSA-N 0 1 321.465 4.102 20 0 DIADMN C[C@@H]1Cc2cc(F)ccc2[C@H](C)N1CCOCC1CCCC1 ZINC001616404070 1056652404 /nfs/dbraw/zinc/65/24/04/1056652404.db2.gz XFZXXIDSUGRPQC-CABCVRRESA-N 0 1 305.437 4.340 20 0 DIADMN c1sc(COc2ccccc2)nc1CNCCCC1CC1 ZINC000076768079 1056656523 /nfs/dbraw/zinc/65/65/23/1056656523.db2.gz WJEFLBACXCPIBD-UHFFFAOYSA-N 0 1 302.443 4.002 20 0 DIADMN Fc1ccc2c(c1)CCC[C@@H]2NCc1c(Cl)n[nH]c1C1CC1 ZINC000921949648 1056666847 /nfs/dbraw/zinc/66/68/47/1056666847.db2.gz RSAWZKKLATWHKA-HNNXBMFYSA-N 0 1 319.811 4.247 20 0 DIADMN CC(C)(C)[C@H]1CCCN(C(=O)c2c(Cl)[nH]nc2C2CC2)CC1 ZINC001586086822 1056669458 /nfs/dbraw/zinc/66/94/58/1056669458.db2.gz RUORKUXMJPRBJQ-LBPRGKRZSA-N 0 1 323.868 4.229 20 0 DIADMN CC(C)(C)[C@@H]1CCC[C@@H](NC(=O)c2cccc3nc[nH]c32)CC1 ZINC001616519015 1056669729 /nfs/dbraw/zinc/66/97/29/1056669729.db2.gz HVYBLBWCQDFWIF-ZIAGYGMSSA-N 0 1 313.445 4.288 20 0 DIADMN COc1cc(C(=O)[O-])ccc1-c1ccc2[nH]c3cc[nH+]cc3c2c1 ZINC001240738870 1056670099 /nfs/dbraw/zinc/67/00/99/1056670099.db2.gz PDEIOBQVIICMKT-UHFFFAOYSA-N 0 1 318.332 4.090 20 0 DIADMN C[C@@H](NC(=O)c1cccc(F)c1O)c1csc2ccccc21 ZINC001586095135 1056670457 /nfs/dbraw/zinc/67/04/57/1056670457.db2.gz RZOGDDWXDYTNEE-SNVBAGLBSA-N 0 1 315.369 4.237 20 0 DIADMN CC(C)[C@H]1CN(Cc2ccc([C@@H](C)C(F)(F)F)cc2)CCO1 ZINC001616601115 1056683906 /nfs/dbraw/zinc/68/39/06/1056683906.db2.gz PCBIZPMWXVGFEG-CZUORRHYSA-N 0 1 315.379 4.209 20 0 DIADMN C[C@@H]1CCN(CCCOc2ccc3ccccc3c2)C[C@@H]1F ZINC001616601207 1056684240 /nfs/dbraw/zinc/68/42/40/1056684240.db2.gz QNITXQBQXYBBHY-BEFAXECRSA-N 0 1 301.405 4.289 20 0 DIADMN CC[C@@H](NCc1noc(-c2ccccc2C)n1)C1CCCCC1 ZINC001616637227 1056691947 /nfs/dbraw/zinc/69/19/47/1056691947.db2.gz SSHPSLYUNRWSRO-QGZVFWFLSA-N 0 1 313.445 4.494 20 0 DIADMN CC[C@H](NCc1noc(-c2ccccc2C)n1)C1CCCCC1 ZINC001616637225 1056692152 /nfs/dbraw/zinc/69/21/52/1056692152.db2.gz SSHPSLYUNRWSRO-KRWDZBQOSA-N 0 1 313.445 4.494 20 0 DIADMN CSc1ccc(OCCNC2(c3ccccc3F)CC2)cc1 ZINC001616713501 1056705148 /nfs/dbraw/zinc/70/51/48/1056705148.db2.gz AVNKTUNWKPRZIJ-UHFFFAOYSA-N 0 1 317.429 4.205 20 0 DIADMN Brc1ccc2c(c1)[C@@H](NCc1ccoc1)CCC2 ZINC000356686699 1056707148 /nfs/dbraw/zinc/70/71/48/1056707148.db2.gz VMJOWWPXPSICRI-HNNXBMFYSA-N 0 1 306.203 4.209 20 0 DIADMN Cc1cncc(-c2ccc3c(n2)CCN(Cc2ccccc2)C3)c1 ZINC001240800711 1056708368 /nfs/dbraw/zinc/70/83/68/1056708368.db2.gz WTXWXTYBUZJSFQ-UHFFFAOYSA-N 0 1 315.420 4.010 20 0 DIADMN Clc1cccc2c1C[C@@H](NCc1cc(-c3ccccc3)on1)C2 ZINC001168698948 1056710970 /nfs/dbraw/zinc/71/09/70/1056710970.db2.gz MIKIYBKQNVEMEV-HNNXBMFYSA-N 0 1 324.811 4.252 20 0 DIADMN CC(C)CCN(C)[C@@H](C)c1nnc(-c2cccc(Cl)c2)o1 ZINC000077211675 1056711060 /nfs/dbraw/zinc/71/10/60/1056711060.db2.gz MPBXAVKZDUYNQO-LBPRGKRZSA-N 0 1 307.825 4.429 20 0 DIADMN CC(C)(C)c1nc2nc[nH]c2c(-c2ccc(C(F)(F)F)cc2)n1 ZINC001240817132 1056713417 /nfs/dbraw/zinc/71/34/17/1056713417.db2.gz DGTTVAZSGMBKGX-UHFFFAOYSA-N 0 1 320.318 4.336 20 0 DIADMN Cc1c[nH]nc1CNC1(c2ccc(Cl)cc2)CCCCC1 ZINC000685614857 1056716752 /nfs/dbraw/zinc/71/67/52/1056716752.db2.gz BZOVTJHHHDWAPG-UHFFFAOYSA-N 0 1 303.837 4.321 20 0 DIADMN c1coc(CNCc2ccc(-c3nc4ccccc4[nH]3)cc2)c1 ZINC000113355796 1056717042 /nfs/dbraw/zinc/71/70/42/1056717042.db2.gz ZXECZLQOXAABNH-UHFFFAOYSA-N 0 1 303.365 4.113 20 0 DIADMN Brc1ccccc1[C@H]1CCCN1CCOC1CCC1 ZINC000672545732 1056719428 /nfs/dbraw/zinc/71/94/28/1056719428.db2.gz SWULWVMBGLBMPI-MRXNPFEDSA-N 0 1 324.262 4.155 20 0 DIADMN CN(Cc1cn[nH]c1)Cc1cccc(SCc2ccccc2)c1 ZINC000672551380 1056720670 /nfs/dbraw/zinc/72/06/70/1056720670.db2.gz PFLUEXMQEMLSIP-UHFFFAOYSA-N 0 1 323.465 4.334 20 0 DIADMN COc1cccc2c1OCC[C@@H]2NCc1ccc(SC)s1 ZINC000685616078 1056721988 /nfs/dbraw/zinc/72/19/88/1056721988.db2.gz UXKHTYHMUUPKMS-ZDUSSCGKSA-N 0 1 321.467 4.092 20 0 DIADMN Cn1ccc2cc(-c3ccc4nc(C(F)(F)F)[nH]c4c3)cnc21 ZINC001240835279 1056724006 /nfs/dbraw/zinc/72/40/06/1056724006.db2.gz IHBMNHIHMAVUFU-UHFFFAOYSA-N 0 1 316.286 4.135 20 0 DIADMN CCOC(=O)CN(CC1CC2(CCC2)C1)[C@@H](C)c1ccccc1 ZINC001616921059 1056740474 /nfs/dbraw/zinc/74/04/74/1056740474.db2.gz JMWKPOOSGNBZPY-INIZCTEOSA-N 0 1 315.457 4.193 20 0 DIADMN Cc1cc(CNCc2cnn(CCF)c2)ccc1-c1ccccc1 ZINC000922017305 1056742750 /nfs/dbraw/zinc/74/27/50/1056742750.db2.gz UPTFMIYJPGZWMY-UHFFFAOYSA-N 0 1 323.415 4.118 20 0 DIADMN Cc1ccc([C@H](C)N[C@@H](CCO)c2ccc(Cl)cc2)c(C)n1 ZINC000672617620 1056745275 /nfs/dbraw/zinc/74/52/75/1056745275.db2.gz LQDWBEIROYIPJP-KSSFIOAISA-N 0 1 318.848 4.126 20 0 DIADMN Cc1ccc(C[C@@H](C)N(C)C(=O)c2ccc(Cl)c(O)c2)cc1 ZINC001586486605 1056745949 /nfs/dbraw/zinc/74/59/49/1056745949.db2.gz SRZCHLYCUPLURT-CYBMUJFWSA-N 0 1 317.816 4.057 20 0 DIADMN CC[C@H](NCc1cc(OC)cc(C)n1)c1ccc(Cl)cc1 ZINC000347680859 1056750305 /nfs/dbraw/zinc/75/03/05/1056750305.db2.gz KQQBGUGVZRGYBP-KRWDZBQOSA-N 0 1 304.821 4.293 20 0 DIADMN CC(C)C[C@H](C)N(C)C(=O)CN1CCCC[C@@H]1c1ccccc1 ZINC001616975116 1056751384 /nfs/dbraw/zinc/75/13/84/1056751384.db2.gz ULHHUWIIKNADKL-PKOBYXMFSA-N 0 1 316.489 4.107 20 0 DIADMN C[C@H](NCCOC1CCCCC1)c1nc(C(C)(C)C)cs1 ZINC001616998736 1056757159 /nfs/dbraw/zinc/75/71/59/1056757159.db2.gz RAQHJEWFNLFQKT-ZDUSSCGKSA-N 0 1 310.507 4.441 20 0 DIADMN CN(C)c1ccc(-c2ccc3nc(C(F)(F)F)[nH]c3c2)cc1 ZINC001240914432 1056758323 /nfs/dbraw/zinc/75/83/23/1056758323.db2.gz JLKBUNFZSAYYCR-UHFFFAOYSA-N 0 1 305.303 4.315 20 0 DIADMN C[C@H](NCC1CC2(CCC2)C1)c1nc(-c2cccc(F)c2)no1 ZINC001617040875 1056766109 /nfs/dbraw/zinc/76/61/09/1056766109.db2.gz UKPBBXUURYSSIG-LBPRGKRZSA-N 0 1 315.392 4.107 20 0 DIADMN CC(C)=CCCN[C@@H](C)c1nc(-c2ccc(C)c(F)c2)no1 ZINC001617050271 1056767639 /nfs/dbraw/zinc/76/76/39/1056767639.db2.gz WFHLEPFDWOGWSX-ZDUSSCGKSA-N 0 1 303.381 4.191 20 0 DIADMN CC[C@H](C)c1nc([C@@H](C)NCc2ccc(CSC)cc2)n[nH]1 ZINC000922053699 1056770793 /nfs/dbraw/zinc/77/07/93/1056770793.db2.gz IXFHAJRJOUXKLC-QWHCGFSZSA-N 0 1 318.490 4.032 20 0 DIADMN CC(C)(C)OC1CC(CCNCc2nc(C(C)(C)C)co2)C1 ZINC000922059272 1056772735 /nfs/dbraw/zinc/77/27/35/1056772735.db2.gz JZVTULZUXSUBDI-UHFFFAOYSA-N 0 1 308.466 4.046 20 0 DIADMN Cc1ccc(CNCc2cccc3c2OCC3)c(OCC2CC2)c1 ZINC001620833770 1056773332 /nfs/dbraw/zinc/77/33/32/1056773332.db2.gz JYZWNVHOVOFIEL-UHFFFAOYSA-N 0 1 323.436 4.009 20 0 DIADMN C[C@H]1CCN(CC(=O)Nc2ccc(C(C)(C)C)cc2)CC1(C)C ZINC001617081442 1056774078 /nfs/dbraw/zinc/77/40/78/1056774078.db2.gz OVMHIPYNJXSRBF-HNNXBMFYSA-N 0 1 316.489 4.291 20 0 DIADMN OCC[C@@H](NCc1cc(Cl)ccc1Cl)c1cccs1 ZINC001617095318 1056775326 /nfs/dbraw/zinc/77/53/26/1056775326.db2.gz FPIALUUOWWUPMB-CYBMUJFWSA-N 0 1 316.253 4.268 20 0 DIADMN FC(F)O[C@H]1CCC[N@H+]([C@@H]2CCc3c2cccc3Cl)C1 ZINC000679681507 1056777512 /nfs/dbraw/zinc/77/75/12/1056777512.db2.gz IKPSFLGSNWTMOL-IINYFYTJSA-N 0 1 301.764 4.031 20 0 DIADMN FC(F)O[C@H]1CCCN([C@@H]2CCc3c2cccc3Cl)C1 ZINC000679681507 1056777520 /nfs/dbraw/zinc/77/75/20/1056777520.db2.gz IKPSFLGSNWTMOL-IINYFYTJSA-N 0 1 301.764 4.031 20 0 DIADMN CC[C@H](C)Sc1nc(-c2ccccc2Br)n[nH]1 ZINC000077908254 1056779438 /nfs/dbraw/zinc/77/94/38/1056779438.db2.gz NWXDHNGROGUIFU-QMMMGPOBSA-N 0 1 312.236 4.125 20 0 DIADMN CC(C)(C)OCCSc1nc2ccc(C(F)(F)F)cc2[nH]1 ZINC000065692275 1056779476 /nfs/dbraw/zinc/77/94/76/1056779476.db2.gz FPSLDEGJLWZSMB-UHFFFAOYSA-N 0 1 318.364 4.489 20 0 DIADMN Cc1ccc2nc(-c3ccccc3NC(=O)c3ccoc3)[nH]c2c1 ZINC001586689781 1056784200 /nfs/dbraw/zinc/78/42/00/1056784200.db2.gz WKYWUMDJZNXEIX-UHFFFAOYSA-N 0 1 317.348 4.384 20 0 DIADMN CC1CC(CN2CCO[C@@H](c3ccc(C(F)(F)F)cc3)C2)C1 ZINC001617162532 1056785495 /nfs/dbraw/zinc/78/54/95/1056785495.db2.gz XUFYVOYLAKZIAY-SEEARECTSA-N 0 1 313.363 4.125 20 0 DIADMN Cc1cccc2c1CN(Cc1ccc(-c3ncco3)cc1F)CC2 ZINC001617176284 1056787161 /nfs/dbraw/zinc/78/71/61/1056787161.db2.gz VDMYTPOXJMIEPP-UHFFFAOYSA-N 0 1 322.383 4.347 20 0 DIADMN CCc1ccc([C@@H]2CN(CC3CCC(F)(F)CC3)CCO2)cc1 ZINC001617214898 1056794190 /nfs/dbraw/zinc/79/41/90/1056794190.db2.gz DKHKACIMGXRDMN-SFHVURJKSA-N 0 1 323.427 4.448 20 0 DIADMN CCc1ccc([C@H]2CN(CC3CCC(F)(F)CC3)CCO2)cc1 ZINC001617214896 1056795033 /nfs/dbraw/zinc/79/50/33/1056795033.db2.gz DKHKACIMGXRDMN-GOSISDBHSA-N 0 1 323.427 4.448 20 0 DIADMN COc1ccc([C@H](C)N[C@H](C)c2c(C)noc2C)cc1Cl ZINC000113951849 1056798305 /nfs/dbraw/zinc/79/83/05/1056798305.db2.gz WEQHJNNIMQAVHV-VHSXEESVSA-N 0 1 308.809 4.365 20 0 DIADMN COc1nscc1CN[C@H](C)c1cc2ccccc2s1 ZINC001617252548 1056802210 /nfs/dbraw/zinc/80/22/10/1056802210.db2.gz QLUVBMIVSHHTEB-SNVBAGLBSA-N 0 1 304.440 4.217 20 0 DIADMN CC[C@@]1(C)CN(CCCOc2cccc(C(C)(C)C)c2)CCO1 ZINC001617259063 1056803102 /nfs/dbraw/zinc/80/31/02/1056803102.db2.gz HWBPLEUIMXIKCM-FQEVSTJZSA-N 0 1 319.489 4.254 20 0 DIADMN Cc1ccc(C(=O)[O-])cc1-c1c[nH+]c(N2CCCCC2)cc1C ZINC001241000320 1056804772 /nfs/dbraw/zinc/80/47/72/1056804772.db2.gz BLVKCTFVNPZPND-UHFFFAOYSA-N 0 1 310.397 4.054 20 0 DIADMN C[C@@H]1CC[C@H](C(=O)Nc2nc3cc(Cl)c(F)cc3[nH]2)C[C@@H]1C ZINC001586818789 1056811560 /nfs/dbraw/zinc/81/15/60/1056811560.db2.gz NINITUHTRZCCSN-UTLUCORTSA-N 0 1 323.799 4.366 20 0 DIADMN C[C@@H]1CC[C@H](CC(=O)Nc2nc3cc(Cl)c(F)cc3[nH]2)C1 ZINC001586819054 1056811825 /nfs/dbraw/zinc/81/18/25/1056811825.db2.gz YYAHGKRJLHVSCR-BDAKNGLRSA-N 0 1 309.772 4.120 20 0 DIADMN COc1cccc(F)c1-c1ccc2[nH]c(C(F)(F)F)nc2c1 ZINC001241010812 1056815666 /nfs/dbraw/zinc/81/56/66/1056815666.db2.gz INIVENKKUIXZTL-UHFFFAOYSA-N 0 1 310.250 4.396 20 0 DIADMN CCc1ccc(CN2CCN([C@H](C)c3ccsc3)CC2)cc1 ZINC001617382615 1056822764 /nfs/dbraw/zinc/82/27/64/1056822764.db2.gz WFKWHGQLWNPSQB-MRXNPFEDSA-N 0 1 314.498 4.189 20 0 DIADMN CCCCCC[C@H](CC)C(=O)NCc1nc2ccc(F)cc2[nH]1 ZINC001586876690 1056823181 /nfs/dbraw/zinc/82/31/81/1056823181.db2.gz TXFSIRHMUSVUBP-ZDUSSCGKSA-N 0 1 319.424 4.315 20 0 DIADMN CCCc1ccc(NC(=O)c2cc(-c3cccs3)n[nH]2)cc1 ZINC001586908969 1056828916 /nfs/dbraw/zinc/82/89/16/1056828916.db2.gz ITBKWVBITIMYLG-UHFFFAOYSA-N 0 1 311.410 4.343 20 0 DIADMN Cc1cc2cc(CNCc3nccc4c3CCCC4)ccc2[nH]1 ZINC000922128830 1056831280 /nfs/dbraw/zinc/83/12/80/1056831280.db2.gz ZQJGLHUUCUEQGX-UHFFFAOYSA-N 0 1 305.425 4.040 20 0 DIADMN COc1cc(CN[C@H](C)c2ccc(C)o2)ccc1OC(C)C ZINC000078379012 1056832058 /nfs/dbraw/zinc/83/20/58/1056832058.db2.gz GZKVSPWGVVQPIT-CQSZACIVSA-N 0 1 303.402 4.235 20 0 DIADMN Cc1ccc(-c2nccc(SCc3ccccc3)n2)c(O)c1 ZINC001241036000 1056834025 /nfs/dbraw/zinc/83/40/25/1056834025.db2.gz MNQDAQUHMYMGIS-UHFFFAOYSA-N 0 1 308.406 4.450 20 0 DIADMN CCSc1cccc(CNCc2cnn(C3CCC3)c2)c1 ZINC000922142820 1056841236 /nfs/dbraw/zinc/84/12/36/1056841236.db2.gz IKXNVCBURNZYMP-UHFFFAOYSA-N 0 1 301.459 4.010 20 0 DIADMN CCCN1CCCC[C@@H]1C(=O)Nc1ccc(C(C)(C)C)cc1 ZINC001586985727 1056845030 /nfs/dbraw/zinc/84/50/30/1056845030.db2.gz SLSSMIYUYQZPBV-QGZVFWFLSA-N 0 1 302.462 4.187 20 0 DIADMN FC(F)Oc1ccc(CN2CC[C@@](F)(c3ccccc3)C2)cc1 ZINC001617532107 1056845412 /nfs/dbraw/zinc/84/54/12/1056845412.db2.gz KVNQSHUMBYYFBK-SFHVURJKSA-N 0 1 321.342 4.359 20 0 DIADMN CCc1noc(C)c1CNCc1cccc(Oc2ccccn2)c1 ZINC000922146799 1056848756 /nfs/dbraw/zinc/84/87/56/1056848756.db2.gz XLKCWXXXHSDUJK-UHFFFAOYSA-N 0 1 323.396 4.023 20 0 DIADMN CC1=C(C)CN([C@H](C)C(=O)Nc2ccc3ccccc3c2)CC1 ZINC001617598103 1056854607 /nfs/dbraw/zinc/85/46/07/1056854607.db2.gz TWDIHTAZKKDEIK-MRXNPFEDSA-N 0 1 308.425 4.209 20 0 DIADMN Cc1noc([C@@H](C)NCC2(c3ccc(F)cc3)CCCCC2)n1 ZINC000066390528 1056854698 /nfs/dbraw/zinc/85/46/98/1056854698.db2.gz MPBHINVOBQIQQN-CYBMUJFWSA-N 0 1 317.408 4.070 20 0 DIADMN CC(C)c1nc(CN2C[C@H](c3ccccc3)c3ccccc32)n[nH]1 ZINC001617610383 1056857880 /nfs/dbraw/zinc/85/78/80/1056857880.db2.gz HKMUVUNRTOHOPK-QGZVFWFLSA-N 0 1 318.424 4.080 20 0 DIADMN CO[C@@H]1C[C@H](N[C@@H](c2cccc(C)c2)c2ccccn2)C12CCC2 ZINC000453161589 1056862530 /nfs/dbraw/zinc/86/25/30/1056862530.db2.gz IXEMCBRGMYSKPD-ZCNNSNEGSA-N 0 1 322.452 4.027 20 0 DIADMN CCOc1cc(-c2cc(F)c3c(c2)CN(C)CC3)ccc1F ZINC001241071966 1056864575 /nfs/dbraw/zinc/86/45/75/1056864575.db2.gz RNLFBHYXDGDFSG-UHFFFAOYSA-N 0 1 303.352 4.018 20 0 DIADMN C[C@H]1CN(c2ccccc2F)CCN1Cc1ccccc1CF ZINC001617674512 1056866520 /nfs/dbraw/zinc/86/65/20/1056866520.db2.gz KGZVVSYYMSFMCN-HNNXBMFYSA-N 0 1 316.395 4.006 20 0 DIADMN COc1cc2[nH]cnc2cc1-c1cc(F)cc(OCC(C)C)c1 ZINC001241076491 1056868822 /nfs/dbraw/zinc/86/88/22/1056868822.db2.gz OFHCLVUJRKMCNW-UHFFFAOYSA-N 0 1 314.360 4.412 20 0 DIADMN C[C@@H](CCCC(F)(F)F)N[C@@H]1COc2cc(F)cc(F)c21 ZINC000681397417 1056870143 /nfs/dbraw/zinc/87/01/43/1056870143.db2.gz GEXKWRLRKCROJB-GZMMTYOYSA-N 0 1 309.278 4.109 20 0 DIADMN COc1ccccc1[C@@H]1CCCCN1Cc1ccc(C)nc1C ZINC000681402567 1056871008 /nfs/dbraw/zinc/87/10/08/1056871008.db2.gz DLZAQBAIBMFVAD-IBGZPJMESA-N 0 1 310.441 4.434 20 0 DIADMN CCOC(=O)[C@H](CC)N1CCC(C)(c2ccc(Cl)cc2)CC1 ZINC001617719848 1056873666 /nfs/dbraw/zinc/87/36/66/1056873666.db2.gz NBKSGIMKBGIROE-INIZCTEOSA-N 0 1 323.864 4.035 20 0 DIADMN CCSCC[N@@H+](C)Cc1ccc(Br)cc1Cl ZINC001617741657 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313.441 4.108 20 0 DIADMN CC[C@@H](C)[C@H]1CCCCN1Cc1cncc(Br)c1 ZINC001559553597 1059364767 /nfs/dbraw/zinc/36/47/67/1059364767.db2.gz IEFYEKUFTLWTAH-IUODEOHRSA-N 0 1 311.267 4.245 20 0 DIADMN Cc1ccc([C@@H]2[C@H](C)CCCN2Cc2cc3n(n2)CCC3)cc1 ZINC001559559138 1059375618 /nfs/dbraw/zinc/37/56/18/1059375618.db2.gz KYGATJXQEKADGN-UZLBHIALSA-N 0 1 309.457 4.111 20 0 DIADMN CC[C@H]1C[C@@H](C)CN1Cc1c(F)cccc1Br ZINC001559565837 1059392831 /nfs/dbraw/zinc/39/28/31/1059392831.db2.gz SSQSWOOIDUXIFS-MNOVXSKESA-N 0 1 300.215 4.209 20 0 DIADMN C[C@H]1C[C@H](c2cccc(F)c2)N(Cc2cc(CO)ccc2F)C1 ZINC001559566630 1059393312 /nfs/dbraw/zinc/39/33/12/1059393312.db2.gz KDHGUZUMUVSURQ-ORAYPTAESA-N 0 1 317.379 4.040 20 0 DIADMN Cc1ccc(-c2noc([C@@H]3CCCN3C(C)C)n2)cc1Cl ZINC001247369035 1059409814 /nfs/dbraw/zinc/40/98/14/1059409814.db2.gz RLWGBAWLRHDVJP-AWEZNQCLSA-N 0 1 305.809 4.244 20 0 DIADMN CCCOC(=O)[C@H](C)N(Cc1ccccc1)[C@H]1CCCC1(C)C ZINC001559579153 1059412346 /nfs/dbraw/zinc/41/23/46/1059412346.db2.gz CEXGIXVDYMUQMV-WMZOPIPTSA-N 0 1 317.473 4.409 20 0 DIADMN CC(C)(C)N(Cc1ccsc1)C(=O)c1cccc(F)c1O ZINC001531797746 1059415726 /nfs/dbraw/zinc/41/57/26/1059415726.db2.gz WBDDEOJBNZJKSX-UHFFFAOYSA-N 0 1 307.390 4.034 20 0 DIADMN Fc1ccc(F)c2c1CCN(CCCCc1ccccc1)C2 ZINC001559584579 1059419072 /nfs/dbraw/zinc/41/90/72/1059419072.db2.gz QXTJIMZUBZJZFS-UHFFFAOYSA-N 0 1 301.380 4.346 20 0 DIADMN COc1ccc([C@@H](C)CN2CCc3c(F)ccc(F)c3C2)cc1 ZINC001559584473 1059420445 /nfs/dbraw/zinc/42/04/45/1059420445.db2.gz MWMQHVXSEJOVAT-ZDUSSCGKSA-N 0 1 317.379 4.135 20 0 DIADMN CC[C@@H]1CN(Cc2ccc(Cl)nn2)CC[C@H]1c1ccccc1 ZINC001559588588 1059422381 /nfs/dbraw/zinc/42/23/81/1059422381.db2.gz ZDIYTKPSQVGYMN-RHSMWYFYSA-N 0 1 315.848 4.146 20 0 DIADMN Fc1cccc([C@H]2C[C@H]2N2CCOC3(C2)CCCCCC3)c1 ZINC001559596016 1059427515 /nfs/dbraw/zinc/42/75/15/1059427515.db2.gz NDCRCQNUGMMZGE-QZTJIDSGSA-N 0 1 303.421 4.107 20 0 DIADMN Fc1cccc([C@H]2C[C@@H]2N2CCOC3(C2)CCCCCC3)c1 ZINC001559596015 1059427617 /nfs/dbraw/zinc/42/76/17/1059427617.db2.gz NDCRCQNUGMMZGE-MSOLQXFVSA-N 0 1 303.421 4.107 20 0 DIADMN Oc1ccc2c(c1)CCN(Cc1cc(Cl)ccc1Cl)CC2 ZINC001559599718 1059430823 /nfs/dbraw/zinc/43/08/23/1059430823.db2.gz SSBMFOQZTJDTBD-UHFFFAOYSA-N 0 1 322.235 4.300 20 0 DIADMN CC[C@H]1CCN(Cc2c(C)nn(Cc3ccccc3)c2Cl)C1 ZINC001559597250 1059432811 /nfs/dbraw/zinc/43/28/11/1059432811.db2.gz DMCDCZONGADKJG-HNNXBMFYSA-N 0 1 317.864 4.125 20 0 DIADMN C[C@@H](C[NH+]1CCC(C(=O)c2ccc([O-])cc2)CC1)CC(C)(C)C ZINC001559615590 1059445947 /nfs/dbraw/zinc/44/59/47/1059445947.db2.gz GGAOADINEZYXGN-OAHLLOKOSA-N 0 1 317.473 4.359 20 0 DIADMN FCc1ccccc1CN1CCN(c2ccc(Cl)cc2)CC1 ZINC001559630189 1059458705 /nfs/dbraw/zinc/45/87/05/1059458705.db2.gz IPIGCPZSNSORJK-UHFFFAOYSA-N 0 1 318.823 4.132 20 0 DIADMN CCCCOC(=O)[C@@H](C)N(CC)[C@H](CC)Cc1ccccc1 ZINC001559642076 1059466091 /nfs/dbraw/zinc/46/60/91/1059466091.db2.gz BMQLXLPRAMTUNE-SJLPKXTDSA-N 0 1 305.462 4.061 20 0 DIADMN CCc1ccc([C@H](NC(=O)c2cccc(F)c2O)C(C)C)cc1 ZINC001531968440 1059469348 /nfs/dbraw/zinc/46/93/48/1059469348.db2.gz JYOKBGXZSMAECA-QGZVFWFLSA-N 0 1 315.388 4.221 20 0 DIADMN Cc1sc(NC(=O)CN2CCC[C@H](CC(C)C)C2)c(C)c1C ZINC001559649272 1059476016 /nfs/dbraw/zinc/47/60/16/1059476016.db2.gz CJGQUWGGROWUQN-MRXNPFEDSA-N 0 1 322.518 4.370 20 0 DIADMN C[C@H]1CN(CC(=O)Nc2ccc(-c3ccccc3)cc2)CC[C@@H]1C ZINC001559655219 1059485126 /nfs/dbraw/zinc/48/51/26/1059485126.db2.gz USAFETDBFQXJMG-IRXDYDNUSA-N 0 1 322.452 4.270 20 0 DIADMN CC[C@@H](O)CN(Cc1ccccc1)Cc1ccc(Cl)cc1F ZINC001559662002 1059493447 /nfs/dbraw/zinc/49/34/47/1059493447.db2.gz MTOKAAIINLVLAU-QGZVFWFLSA-N 0 1 321.823 4.252 20 0 DIADMN NC1(c2nc(-c3ccc(Oc4ccccc4)cc3)no2)CCCC1 ZINC001247501672 1059500298 /nfs/dbraw/zinc/50/02/98/1059500298.db2.gz ZJRDPYGCGNWNSQ-UHFFFAOYSA-N 0 1 321.380 4.257 20 0 DIADMN CC1(C)CCCC[C@@H]1CN1CCc2c(ncn2-c2ccccc2)C1 ZINC001559677970 1059505877 /nfs/dbraw/zinc/50/58/77/1059505877.db2.gz OMYUVVBKABMDOG-QGZVFWFLSA-N 0 1 323.484 4.447 20 0 DIADMN Cc1cn(C)nc1CN[C@@H](c1ccc(CC(C)C)cc1)C1CC1 ZINC001559682323 1059511098 /nfs/dbraw/zinc/51/10/98/1059511098.db2.gz FGGCSAGYZGQRPK-FQEVSTJZSA-N 0 1 311.473 4.168 20 0 DIADMN C[C@@H](NCc1ccnc(F)c1)c1ccc(-c2ccncc2)cc1 ZINC001559696501 1059525824 /nfs/dbraw/zinc/52/58/24/1059525824.db2.gz ZKTOGSUQJVAGPA-CQSZACIVSA-N 0 1 307.372 4.134 20 0 DIADMN c1ccc(C[C@H]2CN(Cc3cccc4ccccc43)CCO2)cc1 ZINC001559705904 1059531205 /nfs/dbraw/zinc/53/12/05/1059531205.db2.gz BTTDTFYWWMIKIG-NRFANRHFSA-N 0 1 317.432 4.283 20 0 DIADMN C[C@@H]1CN(C(=O)OC(C)(C)C)CCN1CC[C@H]1CCC[C@H](C)C1 ZINC001559718421 1059546022 /nfs/dbraw/zinc/54/60/22/1059546022.db2.gz HCIBKKNFZVRYTH-GVDBMIGSSA-N 0 1 324.509 4.144 20 0 DIADMN CCCOC(=O)[C@H](C)N1CC[C@@H](Cc2ccc(C(C)C)cc2)C1 ZINC001559723139 1059554289 /nfs/dbraw/zinc/55/42/89/1059554289.db2.gz MPKJNEZRKRETEN-WMZOPIPTSA-N 0 1 317.473 4.016 20 0 DIADMN Cc1cccc(C)c1NC(=O)[C@@H](C)N1CC(C)(C)CC(C)(C)C1 ZINC001559725872 1059558658 /nfs/dbraw/zinc/55/86/58/1059558658.db2.gz DWHYORSIFYNLQF-MRXNPFEDSA-N 0 1 316.489 4.389 20 0 DIADMN CCC1(CC)CN(Cc2ccc(Cl)c(OC)c2)CCS1 ZINC001559729035 1059561109 /nfs/dbraw/zinc/56/11/09/1059561109.db2.gz JVUXHXRIEUQEMV-UHFFFAOYSA-N 0 1 313.894 4.456 20 0 DIADMN C[C@H]1COc2ccccc2CN1C[C@@H]1CC2(CO1)CCCCC2 ZINC001559742291 1059573186 /nfs/dbraw/zinc/57/31/86/1059573186.db2.gz IRWVQVLSWNHRNG-WMZOPIPTSA-N 0 1 315.457 4.009 20 0 DIADMN C[C@H]1COc2ccccc2CN1C[C@H]1CC2(CO1)CCCCC2 ZINC001559742289 1059573913 /nfs/dbraw/zinc/57/39/13/1059573913.db2.gz IRWVQVLSWNHRNG-FUHWJXTLSA-N 0 1 315.457 4.009 20 0 DIADMN C[C@H]1CC[C@H](C(F)(F)F)CN1CCc1c(F)cccc1F ZINC001559740804 1059575675 /nfs/dbraw/zinc/57/56/75/1059575675.db2.gz DWAQMESYGRRJDE-QWRGUYRKSA-N 0 1 307.306 4.170 20 0 DIADMN Cc1ccc(-c2noc([C@@H]3NC4CCC3CC4)n2)c2ccccc12 ZINC001247635283 1059576391 /nfs/dbraw/zinc/57/63/91/1059576391.db2.gz XCAZXAYWCYDMFE-WTNGLUPJSA-N 0 1 319.408 4.401 20 0 DIADMN CN[C@@H](CC(C)C)c1nc(-c2cc(Cl)cc(Cl)c2)no1 ZINC001247629327 1059579291 /nfs/dbraw/zinc/57/92/91/1059579291.db2.gz AOVPMOQOINWHRC-LBPRGKRZSA-N 0 1 314.216 4.350 20 0 DIADMN Cc1c(Cl)cccc1NC(=O)[C@@H](C)N1CCCC(C)(C)C1 ZINC001559753850 1059585594 /nfs/dbraw/zinc/58/55/94/1059585594.db2.gz VYUJOLQBZRFDRJ-CYBMUJFWSA-N 0 1 308.853 4.097 20 0 DIADMN Cc1c(Cl)cccc1NC(=O)[C@H](C)N1CCCC(C)(C)C1 ZINC001559753851 1059586834 /nfs/dbraw/zinc/58/68/34/1059586834.db2.gz VYUJOLQBZRFDRJ-ZDUSSCGKSA-N 0 1 308.853 4.097 20 0 DIADMN CCCCC[C@@H](C)CC(=O)Nc1ccc(F)c(-c2nc[nH]n2)c1 ZINC001524733924 1059599365 /nfs/dbraw/zinc/59/93/65/1059599365.db2.gz DAEGTXKRDHGLFV-GFCCVEGCSA-N 0 1 318.396 4.156 20 0 DIADMN CCOC(=O)[C@@H](CC)N(Cc1cccc2ccccc21)C1CC1 ZINC001559765783 1059600870 /nfs/dbraw/zinc/60/08/70/1059600870.db2.gz OYYOXEZMJVQULE-LJQANCHMSA-N 0 1 311.425 4.146 20 0 DIADMN CC[C@H]1[C@@H](C)CCN1Cc1c(F)cccc1Br ZINC001559774967 1059613610 /nfs/dbraw/zinc/61/36/10/1059613610.db2.gz LRIXTRZUWPUBPY-HZMBPMFUSA-N 0 1 300.215 4.209 20 0 DIADMN Cc1ccc(-c2noc([C@@H]3CCCCN3C)n2)c2ccccc12 ZINC001247747525 1059613488 /nfs/dbraw/zinc/61/34/88/1059613488.db2.gz XIHXQEPZHAWAHR-KRWDZBQOSA-N 0 1 307.397 4.355 20 0 DIADMN Cc1nccnc1CN[C@@H](C)c1ccc(Cl)c2ccccc21 ZINC001559778747 1059615906 /nfs/dbraw/zinc/61/59/06/1059615906.db2.gz YMRSUNZVOGPFRQ-LBPRGKRZSA-N 0 1 311.816 4.442 20 0 DIADMN Cc1nnsc1[C@H](C)N1CCC(c2cccc(Cl)c2)CC1 ZINC001559784124 1059617602 /nfs/dbraw/zinc/61/76/02/1059617602.db2.gz MKGHBRPDUIDXLF-LBPRGKRZSA-N 0 1 321.877 4.441 20 0 DIADMN Cc1cc(F)cc2c1CN(CCc1ccccc1Cl)CC2 ZINC001559784859 1059618748 /nfs/dbraw/zinc/61/87/48/1059618748.db2.gz IYYLBGZGOAOMLV-UHFFFAOYSA-N 0 1 303.808 4.388 20 0 DIADMN COCc1cccc(CN2CC[C@@](F)(c3ccccc3C)C2)c1 ZINC001559786521 1059622135 /nfs/dbraw/zinc/62/21/35/1059622135.db2.gz FTGRXKWCMBLTMZ-FQEVSTJZSA-N 0 1 313.416 4.212 20 0 DIADMN C[C@@H]1CCCN[C@@H]1c1nc(-c2cccc(Cl)c2Cl)no1 ZINC001247813192 1059636849 /nfs/dbraw/zinc/63/68/49/1059636849.db2.gz HMOMFUQSBXUMOM-PELKAZGASA-N 0 1 312.200 4.104 20 0 DIADMN c1ccc(Oc2ccccc2-c2noc([C@H]3CCCCN3)n2)cc1 ZINC001247803871 1059637110 /nfs/dbraw/zinc/63/71/10/1059637110.db2.gz YOIXJYYQXYELOQ-MRXNPFEDSA-N 0 1 321.380 4.344 20 0 DIADMN C[C@@H]1CCC[C@H]1c1nc(-c2ncccc2/C=C/N2CCCC2)no1 ZINC001247815101 1059640022 /nfs/dbraw/zinc/64/00/22/1059640022.db2.gz RLBKYLLWCCALLB-YUOYJMCBSA-N 0 1 324.428 4.102 20 0 DIADMN CC(C)C[C@H](C)CN1CCCC[C@@H]1C(=O)OCc1ccccc1 ZINC001559804282 1059640328 /nfs/dbraw/zinc/64/03/28/1059640328.db2.gz GCTAZYCBFGOLDT-PKOBYXMFSA-N 0 1 317.473 4.267 20 0 DIADMN C[C@@H]1CCCN[C@@H]1c1nc(-c2ccc(-c3ccccc3)cc2)no1 ZINC001247814613 1059641078 /nfs/dbraw/zinc/64/10/78/1059641078.db2.gz PUERTQQVASEKDU-KDOFPFPSSA-N 0 1 319.408 4.464 20 0 DIADMN Cc1ccc(-c2noc([C@@H]3NCCC[C@H]3C)n2)c2ccccc12 ZINC001247814408 1059641142 /nfs/dbraw/zinc/64/11/42/1059641142.db2.gz OPYKDQISWSZKKG-CXAGYDPISA-N 0 1 307.397 4.259 20 0 DIADMN NC1(c2nc(-c3cc4ccoc4c(Cl)c3)no2)CCCCC1 ZINC001247839644 1059643327 /nfs/dbraw/zinc/64/33/27/1059643327.db2.gz XIRDBPARFOCIDQ-UHFFFAOYSA-N 0 1 317.776 4.254 20 0 DIADMN CC[C@H](c1ccc(F)cc1)N(CC)CC(=O)N1CCCCCC1 ZINC001559817040 1059652695 /nfs/dbraw/zinc/65/26/95/1059652695.db2.gz QRMCKIBNPUXLIO-GOSISDBHSA-N 0 1 320.452 4.001 20 0 DIADMN C[C@@H](NC[C@H]1CCC2(CCCCCC2)O1)c1c(F)cncc1F ZINC001559821698 1059655619 /nfs/dbraw/zinc/65/56/19/1059655619.db2.gz ZAJYMIWTQMEWRR-ZIAGYGMSSA-N 0 1 324.415 4.282 20 0 DIADMN C[C@H](c1ccccc1)[C@@H](O)CN1CC[C@@H]1c1ccc(Cl)cc1 ZINC001559829586 1059661979 /nfs/dbraw/zinc/66/19/79/1059661979.db2.gz XEYAUMZTNBBVRH-ZMYBRWDISA-N 0 1 315.844 4.251 20 0 DIADMN COC(=O)[C@@H]1CCCC[C@@H]1CN1CC[C@H]1c1ccc(Cl)cc1 ZINC001559828947 1059662416 /nfs/dbraw/zinc/66/24/16/1059662416.db2.gz HJQVTCWAPZBHBC-OIISXLGYSA-N 0 1 321.848 4.066 20 0 DIADMN CCCCN(Cc1scnc1Cl)[C@@H]1CCCC[C@H]1OC ZINC001559837389 1059667823 /nfs/dbraw/zinc/66/78/23/1059667823.db2.gz XYZXPEWRGKCMQK-CHWSQXEVSA-N 0 1 316.898 4.356 20 0 DIADMN Clc1ccnc(CN2CCCc3ccccc3CC2)c1Cl ZINC001559841326 1059671751 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4.353 20 0 DIADMN COc1ccc(OC)c(-c2nc3ccc(C(F)F)cc3[nH]2)c1 ZINC001250452959 1060814429 /nfs/dbraw/zinc/81/44/29/1060814429.db2.gz XPPIMAIUBQAZCH-UHFFFAOYSA-N 0 1 304.296 4.185 20 0 DIADMN Cc1cc(F)cc2[nH]c(-c3cc(Br)ccc3O)nc21 ZINC001250458117 1060816391 /nfs/dbraw/zinc/81/63/91/1060816391.db2.gz OWUCWMUTMJHPFZ-UHFFFAOYSA-N 0 1 321.149 4.146 20 0 DIADMN CN(C)c1ccc2[nH]c(-c3cc(Cl)cc(Cl)c3[O-])[nH+]c2c1 ZINC001250457867 1060817137 /nfs/dbraw/zinc/81/71/37/1060817137.db2.gz XOQLDJNTKQVACO-UHFFFAOYSA-N 0 1 322.195 4.308 20 0 DIADMN FC(F)(F)c1ccccc1-c1nc2cc3c(cc2[nH]1)OCC3 ZINC001250459271 1060818692 /nfs/dbraw/zinc/81/86/92/1060818692.db2.gz VNPCPSBNPCGKAO-UHFFFAOYSA-N 0 1 304.271 4.184 20 0 DIADMN Fc1cc2nc(-c3cccc(Cl)c3)[nH]c2cc1-n1ccnc1 ZINC001250462417 1060820304 /nfs/dbraw/zinc/82/03/04/1060820304.db2.gz BBQCSDNVQDNQSL-UHFFFAOYSA-N 0 1 312.735 4.208 20 0 DIADMN COc1ccc(-c2nc3ccc(-c4ccncc4)cc3[nH]2)cc1F ZINC001250462854 1060821677 /nfs/dbraw/zinc/82/16/77/1060821677.db2.gz QJUFRBNGMUUFEO-UHFFFAOYSA-N 0 1 319.339 4.440 20 0 DIADMN Cc1ccc(CN2CC[C@@H](O)C[C@@H]2c2ccccc2)cc1Cl ZINC001560958953 1060823900 /nfs/dbraw/zinc/82/39/00/1060823900.db2.gz FEGVAODXQWITHG-IEBWSBKVSA-N 0 1 315.844 4.346 20 0 DIADMN CCn1nc(C)c(CN(C)Cc2c(C)cc(Cl)cc2C)c1C ZINC001560959259 1060825092 /nfs/dbraw/zinc/82/50/92/1060825092.db2.gz KCDCCJMQUYQAQT-UHFFFAOYSA-N 0 1 319.880 4.422 20 0 DIADMN C[C@H]1C[C@@H](N2CCO[C@@H](C(F)F)CC2)c2ccsc2S1 ZINC001560964513 1060830548 /nfs/dbraw/zinc/83/05/48/1060830548.db2.gz DZGVKAVUNNMOLX-MVWJERBFSA-N 0 1 319.442 4.030 20 0 DIADMN CC(=O)Oc1ccc(-c2nc3cc(C)c(Cl)cc3[nH]2)cc1 ZINC001250471009 1060831120 /nfs/dbraw/zinc/83/11/20/1060831120.db2.gz CQGXAYKWXNBWBP-UHFFFAOYSA-N 0 1 300.745 4.117 20 0 DIADMN CN(Cc1ccn(C)c1)Cc1ccccc1OCc1ccccc1 ZINC001560967634 1060832804 /nfs/dbraw/zinc/83/28/04/1060832804.db2.gz NBCSRONTWWOPNF-UHFFFAOYSA-N 0 1 320.436 4.236 20 0 DIADMN COc1cc(CN2CCC(F)(F)CC2)cc2c1NC(C)(C)C=C2 ZINC001250478473 1060835758 /nfs/dbraw/zinc/83/57/58/1060835758.db2.gz RHGMIKSGAYOVJI-UHFFFAOYSA-N 0 1 322.399 4.144 20 0 DIADMN Fc1cccc(N2CCN(Cc3ccc(C4CCC4)cc3)CC2)c1 ZINC001560973194 1060838091 /nfs/dbraw/zinc/83/80/91/1060838091.db2.gz MENIDULKFWSRQV-UHFFFAOYSA-N 0 1 324.443 4.415 20 0 DIADMN COCOc1ccc2nc(-c3c(C)[nH]c4ccccc43)[nH]c2c1 ZINC001250485076 1060839550 /nfs/dbraw/zinc/83/95/50/1060839550.db2.gz AHKZZSYSIRYDAM-UHFFFAOYSA-N 0 1 307.353 4.002 20 0 DIADMN C[C@H](CC1CCCCC1)CN1Cc2ccccc2NC(=O)[C@@H]1C ZINC001560975149 1060839976 /nfs/dbraw/zinc/83/99/76/1060839976.db2.gz VCGVODKRGAGLNP-CVEARBPZSA-N 0 1 314.473 4.436 20 0 DIADMN CC[C@H](CN1Cc2cccnc2N2CCC[C@@H]2C1)c1ccccc1 ZINC001560975958 1060840107 /nfs/dbraw/zinc/84/01/07/1060840107.db2.gz MIAOBZNZFGBMNB-YLJYHZDGSA-N 0 1 321.468 4.060 20 0 DIADMN CCOc1ccc2nc(-c3ccc(OC(F)F)cc3)[nH]c2c1 ZINC001250490398 1060844943 /nfs/dbraw/zinc/84/49/43/1060844943.db2.gz GLNIVZOXAKYQKO-UHFFFAOYSA-N 0 1 304.296 4.230 20 0 DIADMN CC(=O)n1cc(-c2nc3ccc(C)c(C)c3[nH]2)c2ccccc21 ZINC001250492033 1060847827 /nfs/dbraw/zinc/84/78/27/1060847827.db2.gz IKKPPBPLQAOLCE-UHFFFAOYSA-N 0 1 303.365 4.462 20 0 DIADMN CC(C)Oc1ccc(-c2nc3c([nH]2)c(F)c(F)cc3F)cc1 ZINC001250493004 1060848291 /nfs/dbraw/zinc/84/82/91/1060848291.db2.gz AGMCSDHHLLNKKU-UHFFFAOYSA-N 0 1 306.287 4.434 20 0 DIADMN CC(=O)n1cc(-c2nc3ccc(Cl)cc3[nH]2)c2ccccc21 ZINC001250492148 1060848526 /nfs/dbraw/zinc/84/85/26/1060848526.db2.gz LRXVDISFBGLDPG-UHFFFAOYSA-N 0 1 309.756 4.498 20 0 DIADMN Cc1ccc(CCN2CCc3cc(F)c(F)cc3C2)cc1C ZINC001560985888 1060849442 /nfs/dbraw/zinc/84/94/42/1060849442.db2.gz PBMBHHKOVIRIJL-UHFFFAOYSA-N 0 1 301.380 4.182 20 0 DIADMN Cc1c(-c2nc3ccc(Oc4ccccc4)cc3[nH]2)cnn1C ZINC001250495861 1060850011 /nfs/dbraw/zinc/85/00/11/1060850011.db2.gz MRYBYRKXCXSLNV-UHFFFAOYSA-N 0 1 304.353 4.064 20 0 DIADMN FC[C@@H]1CCCN(Cc2ccc(Oc3ccc(F)cc3)nc2)C1 ZINC001560985307 1060850362 /nfs/dbraw/zinc/85/03/62/1060850362.db2.gz WKTXILBQKKQHCN-AWEZNQCLSA-N 0 1 318.367 4.195 20 0 DIADMN Fc1cc2nc(-c3cc(F)c(F)c(F)c3)[nH]c2c(Cl)c1 ZINC001250495152 1060850512 /nfs/dbraw/zinc/85/05/12/1060850512.db2.gz FNVCQFMGCJPEJC-UHFFFAOYSA-N 0 1 300.642 4.440 20 0 DIADMN CCCn1c2ccc(C(F)(F)F)cc2nc1-c1[nH]cnc1C ZINC001250497880 1060850731 /nfs/dbraw/zinc/85/07/31/1060850731.db2.gz CZJGHYQESQVPPD-UHFFFAOYSA-N 0 1 308.307 4.164 20 0 DIADMN CCCc1ccc(CN2CC[C@@H](C(F)(F)F)O[C@@H](C)C2)s1 ZINC001560993563 1060853645 /nfs/dbraw/zinc/85/36/45/1060853645.db2.gz KIUNDZCVVOYGSG-FZMZJTMJSA-N 0 1 321.408 4.242 20 0 DIADMN C[C@@]1(C(F)(F)F)CCN(C/C=C/c2ccc(F)cc2F)C1 ZINC001560997244 1060856473 /nfs/dbraw/zinc/85/64/73/1060856473.db2.gz OSYYFCYQEDAORR-BAABZTOOSA-N 0 1 305.290 4.252 20 0 DIADMN C[C@@H](CNc1ccc2c(n1)CCCC2)c1cc(F)cc(F)c1 ZINC001560997007 1060856829 /nfs/dbraw/zinc/85/68/29/1060856829.db2.gz IOUULKUFIHIRDC-LBPRGKRZSA-N 0 1 302.368 4.454 20 0 DIADMN COC(=O)c1oc(CNCc2ccc(C(C)(C)C)s2)cc1C ZINC001560998692 1060859315 /nfs/dbraw/zinc/85/93/15/1060859315.db2.gz DYSGGTKTMCWRAY-UHFFFAOYSA-N 0 1 321.442 4.023 20 0 DIADMN FC(F)c1ccc2nc(-c3cccc(Br)n3)[nH]c2c1 ZINC001250508523 1060861703 /nfs/dbraw/zinc/86/17/03/1060861703.db2.gz BKKLBMDFDNQWMA-UHFFFAOYSA-N 0 1 324.128 4.325 20 0 DIADMN COCOc1ccc2nc(-c3cc(Cl)ccc3F)[nH]c2c1 ZINC001250509188 1060861804 /nfs/dbraw/zinc/86/18/04/1060861804.db2.gz KMKMEDAROADGRS-UHFFFAOYSA-N 0 1 306.724 4.005 20 0 DIADMN Cc1nc(C)c(-c2nc3cc(C(F)(F)F)c(F)cc3[nH]2)s1 ZINC001250510843 1060862200 /nfs/dbraw/zinc/86/22/00/1060862200.db2.gz WPZXCPFEHHAJMC-UHFFFAOYSA-N 0 1 315.295 4.461 20 0 DIADMN Cc1nc(-c2nc3ccc(OCc4ccccc4)cc3[nH]2)co1 ZINC001250509745 1060862318 /nfs/dbraw/zinc/86/23/18/1060862318.db2.gz VRDGZUJFIICZMP-UHFFFAOYSA-N 0 1 305.337 4.105 20 0 DIADMN Cc1cccc(CN2CC[C@@H](c3c(F)cccc3F)C2)c1F ZINC001561005630 1060865011 /nfs/dbraw/zinc/86/50/11/1060865011.db2.gz QGXQQHPBDZJGKJ-CYBMUJFWSA-N 0 1 305.343 4.402 20 0 DIADMN COc1ncccc1-c1nc2ccc(-c3ccccc3)cc2[nH]1 ZINC001250517458 1060866519 /nfs/dbraw/zinc/86/65/19/1060866519.db2.gz WYISVTDJMDBSTH-UHFFFAOYSA-N 0 1 301.349 4.301 20 0 DIADMN O=c1[nH]cccc1-c1nc2cc(C(F)(F)F)c(Cl)cc2[nH]1 ZINC001250522373 1060869134 /nfs/dbraw/zinc/86/91/34/1060869134.db2.gz NXVLHZGIXZVZFC-UHFFFAOYSA-N 0 1 313.666 4.003 20 0 DIADMN COc1nscc1CN(C)[C@@H]1CC[C@@](C)(c2ccccc2)C1 ZINC001561022408 1060879886 /nfs/dbraw/zinc/87/98/86/1060879886.db2.gz OLMJPRQSSRHVFJ-SJLPKXTDSA-N 0 1 316.470 4.094 20 0 DIADMN O=c1cc(-c2nc3cc(C(F)(F)F)c(Cl)cc3[nH]2)cc[nH]1 ZINC001250532735 1060880918 /nfs/dbraw/zinc/88/09/18/1060880918.db2.gz AWBKITXDOJHBKL-UHFFFAOYSA-N 0 1 313.666 4.003 20 0 DIADMN Cc1cc2nc([C@H]3CCCN3C(=O)OC(C)(C)C)[nH]c2c(C)c1 ZINC001250546048 1060885304 /nfs/dbraw/zinc/88/53/04/1060885304.db2.gz WPLLKWPTAWMPQQ-CQSZACIVSA-N 0 1 315.417 4.252 20 0 DIADMN CC(C)(C)OC(=O)N1CCCC[C@H]1c1nc2ccc(F)cc2[nH]1 ZINC001250543563 1060885771 /nfs/dbraw/zinc/88/57/71/1060885771.db2.gz SSKKHKVPZFWMFT-AWEZNQCLSA-N 0 1 319.380 4.164 20 0 DIADMN Cc1cccc2nc([C@@H]3CCCCN3C(=O)OC(C)(C)C)[nH]c21 ZINC001250543712 1060885853 /nfs/dbraw/zinc/88/58/53/1060885853.db2.gz TVEWKLDBSWCGLW-AWEZNQCLSA-N 0 1 315.417 4.333 20 0 DIADMN Cc1cc2nc([C@@H]3CCCN3C(=O)OC(C)(C)C)[nH]c2cc1F ZINC001250544633 1060886145 /nfs/dbraw/zinc/88/61/45/1060886145.db2.gz ITNBPZJPALGVQP-AWEZNQCLSA-N 0 1 319.380 4.082 20 0 DIADMN Fc1cc2nc(C3CCC(F)(F)CC3)[nH]c2cc1-n1cccn1 ZINC001250545682 1060886263 /nfs/dbraw/zinc/88/62/63/1060886263.db2.gz SKAAWYJOUDKZPG-UHFFFAOYSA-N 0 1 320.318 4.181 20 0 DIADMN Fc1ccccc1Cc1nc2ccc(-c3ccncc3)cc2[nH]1 ZINC001250553382 1060890105 /nfs/dbraw/zinc/89/01/05/1060890105.db2.gz WTOKPGDAFGZOPB-UHFFFAOYSA-N 0 1 303.340 4.355 20 0 DIADMN COc1ccc(CCc2nc3cc(Cl)c(OC)cc3[nH]2)cc1 ZINC001250553499 1060890375 /nfs/dbraw/zinc/89/03/75/1060890375.db2.gz FTTXBGLEEWNBME-UHFFFAOYSA-N 0 1 316.788 4.019 20 0 DIADMN CN(Cc1cc(-c2ccccc2)n[nH]1)Cc1cccc2ccoc21 ZINC001561041548 1060893282 /nfs/dbraw/zinc/89/32/82/1060893282.db2.gz WWDFMDJAPLLUQS-UHFFFAOYSA-N 0 1 317.392 4.455 20 0 DIADMN COc1cccc(CCc2nc3cc(F)cc(Cl)c3[nH]2)c1 ZINC001250553964 1060893987 /nfs/dbraw/zinc/89/39/87/1060893987.db2.gz TXKXXOYZZBKQEM-UHFFFAOYSA-N 0 1 304.752 4.149 20 0 DIADMN Fc1cccc(CCc2nc3cc(N4CCCC4)ccc3[nH]2)c1 ZINC001250556367 1060895009 /nfs/dbraw/zinc/89/50/09/1060895009.db2.gz MJMNMLZRUFJUFT-UHFFFAOYSA-N 0 1 309.388 4.087 20 0 DIADMN FC(F)(F)Oc1ccc2nc(C3CCSCC3)[nH]c2c1 ZINC001250556482 1060895370 /nfs/dbraw/zinc/89/53/70/1060895370.db2.gz SZOPRCQVXFCOPZ-UHFFFAOYSA-N 0 1 302.321 4.072 20 0 DIADMN CCOc1ccc2nc(C[C@@H](C)CCCC(C)(C)O)[nH]c2c1 ZINC001250557060 1060895435 /nfs/dbraw/zinc/89/54/35/1060895435.db2.gz YCEMVCVOJPFTNM-ZDUSSCGKSA-N 0 1 304.434 4.081 20 0 DIADMN Fc1cc2nc(CCCc3ccccc3)[nH]c2cc1-n1ccnc1 ZINC001250556049 1060896123 /nfs/dbraw/zinc/89/61/23/1060896123.db2.gz HTGZKYYANYIJPL-UHFFFAOYSA-N 0 1 320.371 4.063 20 0 DIADMN CC1(c2nc3cc(Cl)c(C(F)(F)F)cc3[nH]2)CCOCC1 ZINC001250562078 1060898135 /nfs/dbraw/zinc/89/81/35/1060898135.db2.gz DCNBEXOICVQUDJ-UHFFFAOYSA-N 0 1 318.726 4.303 20 0 DIADMN CC1(C)OC[C@H](c2nc3cc(-c4cccs4)ccc3[nH]2)O1 ZINC001250560836 1060898744 /nfs/dbraw/zinc/89/87/44/1060898744.db2.gz PMHVRQLYRWVHJA-CYBMUJFWSA-N 0 1 300.383 4.115 20 0 DIADMN CC(C)(C)[C@@H]1CCN(C/C=C/c2ccc(F)cc2F)CCO1 ZINC001561051871 1060901263 /nfs/dbraw/zinc/90/12/63/1060901263.db2.gz LHJCDOOCQLBHHH-BDUNBXCCSA-N 0 1 309.400 4.115 20 0 DIADMN CC(C)(C)OC(=O)Oc1ccc2nc([C@@H]3CCCCO3)[nH]c2c1 ZINC001250563436 1060901766 /nfs/dbraw/zinc/90/17/66/1060901766.db2.gz ZOOKPYUOSZNQFI-AWEZNQCLSA-N 0 1 318.373 4.118 20 0 DIADMN CC1(c2nc3ccc(Oc4ccccc4)cc3[nH]2)CCOCC1 ZINC001250562764 1060902174 /nfs/dbraw/zinc/90/21/74/1060902174.db2.gz NRRAMKJHLZKJJC-UHFFFAOYSA-N 0 1 308.381 4.423 20 0 DIADMN Fc1cccc(Cc2nc3cc(F)cc(C(F)(F)F)c3[nH]2)c1 ZINC001250567118 1060903146 /nfs/dbraw/zinc/90/31/46/1060903146.db2.gz HHDXATODRWWNIH-UHFFFAOYSA-N 0 1 312.241 4.451 20 0 DIADMN Cc1noc([C@@H](N[C@@H](C)Cc2coc3ccccc23)C(C)C)n1 ZINC001561056204 1060904543 /nfs/dbraw/zinc/90/45/43/1060904543.db2.gz IWXJHPGSNFSJQS-SJCJKPOMSA-N 0 1 313.401 4.042 20 0 DIADMN Cc1cc(F)cc2[nH]c([C@@H](C)Cc3ccc4c(c3)OCO4)nc21 ZINC001250568141 1060905400 /nfs/dbraw/zinc/90/54/00/1060905400.db2.gz RTTZIUDJSBSPQA-NSHDSACASA-N 0 1 312.344 4.085 20 0 DIADMN Cc1ccc([C@@H](C)Cc2nc3cc(F)c(-n4cccn4)cc3[nH]2)o1 ZINC001250568739 1060906027 /nfs/dbraw/zinc/90/60/27/1060906027.db2.gz BIXALDRQAMHVDI-NSHDSACASA-N 0 1 324.359 4.135 20 0 DIADMN Fc1cc2[nH]c([C@H]3COC4(CCCCC4)O3)nc2cc1Cl ZINC001250573500 1060908639 /nfs/dbraw/zinc/90/86/39/1060908639.db2.gz LZASIGKBFLXESQ-CYBMUJFWSA-N 0 1 310.756 4.104 20 0 DIADMN FC(F)c1ccc2nc([C@H]3COC4(CCCCC4)O3)[nH]c2c1 ZINC001250573324 1060909839 /nfs/dbraw/zinc/90/98/39/1060909839.db2.gz JJNJNYHMOJMSGB-CYBMUJFWSA-N 0 1 308.328 4.249 20 0 DIADMN COC(=O)[C@H]1CC[C@H](c2nc3ccc(C(C)(C)C)cc3[nH]2)CC1 ZINC001250576065 1060912132 /nfs/dbraw/zinc/91/21/32/1060912132.db2.gz YKNWBNBQWUGXSW-JOCQHMNTSA-N 0 1 314.429 4.307 20 0 DIADMN COc1ccc2nc(CCc3ccc(C(F)(F)F)cc3)[nH]c2c1 ZINC001250576101 1060912398 /nfs/dbraw/zinc/91/23/98/1060912398.db2.gz ADOUIFKHFVLWMV-UHFFFAOYSA-N 0 1 320.314 4.376 20 0 DIADMN CC(=O)Nc1ccc2nc(C3(c4ccccc4)CCCC3)[nH]c2c1 ZINC001250578334 1060913159 /nfs/dbraw/zinc/91/31/59/1060913159.db2.gz LARXVDNCAKVUJW-UHFFFAOYSA-N 0 1 319.408 4.381 20 0 DIADMN COc1ccc2nc(CCc3ccccc3C(F)(F)F)[nH]c2c1 ZINC001250583507 1060916929 /nfs/dbraw/zinc/91/69/29/1060916929.db2.gz KTONBYJYSMSBPC-UHFFFAOYSA-N 0 1 320.314 4.376 20 0 DIADMN COc1ccccc1CCc1nc2cc(Cl)c(OC)cc2[nH]1 ZINC001250583422 1060917272 /nfs/dbraw/zinc/91/72/72/1060917272.db2.gz FRGIBIMDFGJIEZ-UHFFFAOYSA-N 0 1 316.788 4.019 20 0 DIADMN CCOC(=O)[C@H]1CC[C@H](c2nc3cc(C)cc(C)c3[nH]2)CC1 ZINC001250589807 1060924939 /nfs/dbraw/zinc/92/49/39/1060924939.db2.gz KCLSOSWWWOSVFB-HDJSIYSDSA-N 0 1 300.402 4.017 20 0 DIADMN FC(F)(F)c1cccc(Cc2nc3cc4c(cc3[nH]2)OCC4)c1 ZINC001250594207 1060925202 /nfs/dbraw/zinc/92/52/02/1060925202.db2.gz CFVYQBDJXJLFLY-UHFFFAOYSA-N 0 1 318.298 4.107 20 0 DIADMN CC(C)c1ccc2nc([C@@H]3CCN3C(=O)OC(C)(C)C)[nH]c2c1 ZINC001250589870 1060925753 /nfs/dbraw/zinc/92/57/53/1060925753.db2.gz MQGHAWIZNGSRRC-HNNXBMFYSA-N 0 1 315.417 4.368 20 0 DIADMN CCOC(=O)[C@H]1CC[C@H](c2nc3ccc(Cl)cc3[nH]2)CC1 ZINC001250589230 1060925868 /nfs/dbraw/zinc/92/58/68/1060925868.db2.gz FCYWPOWURYPCLV-XYPYZODXSA-N 0 1 306.793 4.053 20 0 DIADMN CCOC(=O)[C@H]1CC[C@H](c2nc3cc(C)c(Cl)cc3[nH]2)CC1 ZINC001250590070 1060926676 /nfs/dbraw/zinc/92/66/76/1060926676.db2.gz QMGIGTVYWHHKQD-HAQNSBGRSA-N 0 1 320.820 4.362 20 0 DIADMN Fc1ccc(Cc2nc3c([nH]2)c(F)c(F)cc3F)c(Cl)c1 ZINC001250594761 1060927363 /nfs/dbraw/zinc/92/73/63/1060927363.db2.gz SNNHJNKDJWZYKZ-UHFFFAOYSA-N 0 1 314.669 4.364 20 0 DIADMN COc1cc2nc(Cc3cccc(C(F)(F)F)c3)[nH]c2cc1F ZINC001250594765 1060928108 /nfs/dbraw/zinc/92/81/08/1060928108.db2.gz SSJCXBFMGQCYMD-UHFFFAOYSA-N 0 1 324.277 4.320 20 0 DIADMN CN(C)c1ccc2nc(Cc3ccc(F)cc3Cl)[nH]c2c1 ZINC001250594427 1060929114 /nfs/dbraw/zinc/92/91/14/1060929114.db2.gz LNOGOBSFTCWJEM-UHFFFAOYSA-N 0 1 303.768 4.012 20 0 DIADMN Cc1cc2nc(CCc3cccnc3)[nH]c2cc1C(F)(F)F ZINC001250599140 1060930010 /nfs/dbraw/zinc/93/00/10/1060930010.db2.gz DSQBSMVPWDHMKK-UHFFFAOYSA-N 0 1 305.303 4.070 20 0 DIADMN Fc1cc2nc(Cc3cccs3)[nH]c2c(C(F)(F)F)c1 ZINC001250604579 1060932255 /nfs/dbraw/zinc/93/22/55/1060932255.db2.gz JIDCORHHVNCNSP-UHFFFAOYSA-N 0 1 300.280 4.373 20 0 DIADMN c1csc(-c2ccc3[nH]c(CCc4cccnc4)nc3c2)c1 ZINC001250600143 1060933321 /nfs/dbraw/zinc/93/33/21/1060933321.db2.gz ZSDJXNNMGGFQQU-UHFFFAOYSA-N 0 1 305.406 4.472 20 0 DIADMN Fc1cc(F)c(Cc2nc3ccc4ncccc4c3[nH]2)cc1F ZINC001250605040 1060935943 /nfs/dbraw/zinc/93/59/43/1060935943.db2.gz HMRRUXNNYQSTJD-UHFFFAOYSA-N 0 1 313.282 4.119 20 0 DIADMN Cc1nc(CN(C)CC(C)(C)c2ccc(C)cc2)c(C)s1 ZINC001473189556 1060941722 /nfs/dbraw/zinc/94/17/22/1060941722.db2.gz AVMJGLDLLPHQQB-UHFFFAOYSA-N 0 1 302.487 4.478 20 0 DIADMN CCC(CC)(CC)CNCc1noc(-c2ccccc2C)n1 ZINC001462125246 1060945980 /nfs/dbraw/zinc/94/59/80/1060945980.db2.gz 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ZINC001251799483 1061492004 /nfs/dbraw/zinc/49/20/04/1061492004.db2.gz ZLZQCKPPUUAHJT-UHFFFAOYSA-N 0 1 300.724 4.207 20 0 DIADMN COc1cc2nc(-c3nc4ccc(C)cc4[nH]3)[nH]c2cc1Cl ZINC001251799079 1061492569 /nfs/dbraw/zinc/49/25/69/1061492569.db2.gz CJQPDHKNAFSWCB-UHFFFAOYSA-N 0 1 312.760 4.077 20 0 DIADMN COc1cc2[nH]c(-c3nc4cc(C)ccc4[nH]3)nc2cc1Cl ZINC001251799079 1061492581 /nfs/dbraw/zinc/49/25/81/1061492581.db2.gz CJQPDHKNAFSWCB-UHFFFAOYSA-N 0 1 312.760 4.077 20 0 DIADMN COc1cc2[nH]c(-c3nc4ccc(C)cc4[nH]3)nc2cc1Cl ZINC001251799079 1061492587 /nfs/dbraw/zinc/49/25/87/1061492587.db2.gz CJQPDHKNAFSWCB-UHFFFAOYSA-N 0 1 312.760 4.077 20 0 DIADMN Cc1nonc1-c1nc2ccc(Sc3ccccc3)cc2[nH]1 ZINC001251802312 1061493812 /nfs/dbraw/zinc/49/38/12/1061493812.db2.gz IKNWENTXWKNOTB-UHFFFAOYSA-N 0 1 308.366 4.073 20 0 DIADMN Fc1ccc2nc(-c3ccc(OCc4ccccc4)cn3)[nH]c2c1 ZINC001251802391 1061494399 /nfs/dbraw/zinc/49/43/99/1061494399.db2.gz LJGBFCIPBAQMON-UHFFFAOYSA-N 0 1 319.339 4.343 20 0 DIADMN Cc1ccc2nc(-c3csc(-c4ccncc4)n3)[nH]c2c1C ZINC001251812239 1061496291 /nfs/dbraw/zinc/49/62/91/1061496291.db2.gz MGDDIPUQFGKMFC-UHFFFAOYSA-N 0 1 306.394 4.365 20 0 DIADMN CCOc1cccc(F)c1CNCCOc1cc(C)cc(C)c1 ZINC001473956560 1061496723 /nfs/dbraw/zinc/49/67/23/1061496723.db2.gz UMHBTFZBHYOKPO-UHFFFAOYSA-N 0 1 317.404 4.010 20 0 DIADMN CCOc1ccc2nc(-c3ccc(SC)c(OC)c3)[nH]c2c1 ZINC001251814631 1061497095 /nfs/dbraw/zinc/49/70/95/1061497095.db2.gz YRKVHKLBOICTRD-UHFFFAOYSA-N 0 1 314.410 4.359 20 0 DIADMN C[C@H](COc1ccccc1F)NCc1nc(C(C)(C)C)cs1 ZINC001473954400 1061497306 /nfs/dbraw/zinc/49/73/06/1061497306.db2.gz ACDVPDMJSPHBLS-GFCCVEGCSA-N 0 1 322.449 4.137 20 0 DIADMN Cc1cc(C)nc(-c2nc3ccc(-c4ccccc4)cc3[nH]2)n1 ZINC001251807770 1061497473 /nfs/dbraw/zinc/49/74/73/1061497473.db2.gz YMYIPZZNDYUESB-UHFFFAOYSA-N 0 1 300.365 4.304 20 0 DIADMN COc1ccc2nc(-c3nc4cc(F)ccc4n3C(C)C)[nH]c2c1 ZINC001251816923 1061500036 /nfs/dbraw/zinc/50/00/36/1061500036.db2.gz MLRAMASPTAHYHH-UHFFFAOYSA-N 0 1 324.359 4.308 20 0 DIADMN CCCCOc1ncccc1CNC/C=C\c1cccc(F)c1 ZINC001473960234 1061500978 /nfs/dbraw/zinc/50/09/78/1061500978.db2.gz FLHIOQMLYSSTKG-YVMONPNESA-N 0 1 314.404 4.203 20 0 DIADMN O=C(CSC1CC1)Nc1ccc2nc(-c3ccccc3)[nH]c2c1 ZINC001457800300 1061504824 /nfs/dbraw/zinc/50/48/24/1061504824.db2.gz BBCHOHJZNOVTJX-UHFFFAOYSA-N 0 1 323.421 4.064 20 0 DIADMN Fc1cc2cc[nH]c2c(-c2nc3c([nH]2)c(F)c(F)cc3F)c1 ZINC001251833206 1061504985 /nfs/dbraw/zinc/50/49/85/1061504985.db2.gz DBQBKFVTRQLBOO-UHFFFAOYSA-N 0 1 305.234 4.268 20 0 DIADMN CCOc1cc(OC)ccc1-c1nc2c(cc(F)cc2C)[nH]1 ZINC001251856703 1061511171 /nfs/dbraw/zinc/51/11/71/1061511171.db2.gz DESPHXULQHMNHW-UHFFFAOYSA-N 0 1 300.333 4.085 20 0 DIADMN CCOc1cc(OC)ccc1-c1nc2c([nH]1)c(F)c(F)cc2F ZINC001251859729 1061511997 /nfs/dbraw/zinc/51/19/97/1061511997.db2.gz LZZSQXXXGNAJGW-UHFFFAOYSA-N 0 1 322.286 4.055 20 0 DIADMN CCOc1cc(C)ccc1-c1nc2cc(OC)c(F)cc2[nH]1 ZINC001251859933 1061513528 /nfs/dbraw/zinc/51/35/28/1061513528.db2.gz XMBAUDCOMBZQMB-UHFFFAOYSA-N 0 1 300.333 4.085 20 0 DIADMN COc1cc(F)c(C)cc1-c1nc2cc(Cl)c(F)cc2[nH]1 ZINC001251859938 1061513863 /nfs/dbraw/zinc/51/38/63/1061513863.db2.gz XRTIJXQOPAGXHC-UHFFFAOYSA-N 0 1 308.715 4.479 20 0 DIADMN COCOc1ccc2nc(-c3ccc(C)c(Cl)c3C)[nH]c2c1 ZINC001251862733 1061515083 /nfs/dbraw/zinc/51/50/83/1061515083.db2.gz CJQWIVIEQBABDU-UHFFFAOYSA-N 0 1 316.788 4.483 20 0 DIADMN CCn1ccnc1CN[C@H](c1ccc(CC(C)C)cc1)C1CC1 ZINC001473970100 1061515223 /nfs/dbraw/zinc/51/52/23/1061515223.db2.gz GTQBHXZCWIFOHP-HXUWFJFHSA-N 0 1 311.473 4.342 20 0 DIADMN Fc1ccc(CNCc2ccc(C(F)F)nc2)cc1Cl ZINC001473971593 1061515451 /nfs/dbraw/zinc/51/54/51/1061515451.db2.gz WPQGNHLYJGSXMB-UHFFFAOYSA-N 0 1 300.711 4.102 20 0 DIADMN CCOc1ccc2nc(-c3c(F)ccc(C)c3OC)[nH]c2c1 ZINC001251863139 1061515853 /nfs/dbraw/zinc/51/58/53/1061515853.db2.gz QXBFPUAKXNCSTP-UHFFFAOYSA-N 0 1 300.333 4.085 20 0 DIADMN CCOc1nccc(-c2nc3ccc(F)c(C)c3[nH]2)c1Cl ZINC001251864996 1061517346 /nfs/dbraw/zinc/51/73/46/1061517346.db2.gz FPOOFDCWTFMEFF-UHFFFAOYSA-N 0 1 305.740 4.125 20 0 DIADMN CC[C@@H](NCc1ccc(OC)c(OC)c1F)c1ccc(C)cc1 ZINC001473977917 1061520411 /nfs/dbraw/zinc/52/04/11/1061520411.db2.gz OQHPQGBWKXUPIE-MRXNPFEDSA-N 0 1 317.404 4.392 20 0 DIADMN CCc1oc2ccccc2c1CNc1cnn(-c2ccncc2)c1 ZINC001473977950 1061521998 /nfs/dbraw/zinc/52/19/98/1061521998.db2.gz XXVLSHVEWLBQSU-UHFFFAOYSA-N 0 1 318.380 4.188 20 0 DIADMN CCC[C@@H](NCc1ccc(SC)c(OC)c1)c1ccccn1 ZINC001473982554 1061525827 /nfs/dbraw/zinc/52/58/27/1061525827.db2.gz STKONVBTXZEGLB-OAHLLOKOSA-N 0 1 316.470 4.443 20 0 DIADMN O=C(Nc1cccc2c1CCCC2)c1cc(-c2cccs2)n[nH]1 ZINC001463898107 1061532630 /nfs/dbraw/zinc/53/26/30/1061532630.db2.gz XJSRFMQSAMZQOD-UHFFFAOYSA-N 0 1 323.421 4.269 20 0 DIADMN CCN(CC)[C@H](C(=O)N1Cc2ccccc2[C@H]1C)c1ccccc1 ZINC000541229767 1061532698 /nfs/dbraw/zinc/53/26/98/1061532698.db2.gz RGJGZOWZSNMNJD-UZLBHIALSA-N 0 1 322.452 4.173 20 0 DIADMN CN(C(=O)c1ccc(O)c(Cl)c1)[C@H]1CCCc2ccccc21 ZINC001463955385 1061537127 /nfs/dbraw/zinc/53/71/27/1061537127.db2.gz WSHWKXDPYWDXFK-INIZCTEOSA-N 0 1 315.800 4.195 20 0 DIADMN Fc1cccc(/C=C\CNC2(c3nccs3)CCCC2)c1 ZINC001474001821 1061542587 /nfs/dbraw/zinc/54/25/87/1061542587.db2.gz AIRQDHLRPSMKEU-XQRVVYSFSA-N 0 1 302.418 4.355 20 0 DIADMN CC[C@H](NC(=O)[C@H]1CCCC[N@H+]1CC)c1cccc2ccccc21 ZINC001458025559 1061542776 /nfs/dbraw/zinc/54/27/76/1061542776.db2.gz WFURPYLZDCNHGU-VQTJNVASSA-N 0 1 324.468 4.282 20 0 DIADMN CC[C@H](NC(=O)[C@H]1CCCCN1CC)c1cccc2ccccc21 ZINC001458025559 1061542790 /nfs/dbraw/zinc/54/27/90/1061542790.db2.gz WFURPYLZDCNHGU-VQTJNVASSA-N 0 1 324.468 4.282 20 0 DIADMN [O-]c1cccc(C[NH2+][C@@H]2CC[C@H]3CCC[C@@H]3C2)c1Br ZINC001474003657 1061544482 /nfs/dbraw/zinc/54/44/82/1061544482.db2.gz ZJICIHQTGOTDHF-YRGRVCCFSA-N 0 1 324.262 4.213 20 0 DIADMN [O-]c1cccc(C[NH2+][C@@H]2CC[C@@H]3CCC[C@H]3C2)c1Br ZINC001474003656 1061545051 /nfs/dbraw/zinc/54/50/51/1061545051.db2.gz ZJICIHQTGOTDHF-SGMGOOAPSA-N 0 1 324.262 4.213 20 0 DIADMN CCCCC[C@@](C)(CC)C(=O)N1CCN(C2CCCC2)CC1 ZINC001464051975 1061548890 /nfs/dbraw/zinc/54/88/90/1061548890.db2.gz KCKPEVYMOLJLJT-LJQANCHMSA-N 0 1 308.510 4.070 20 0 DIADMN CC[C@](C)(NCc1ccc(OC)c(OC)c1F)c1ccccc1 ZINC001474007729 1061550368 /nfs/dbraw/zinc/55/03/68/1061550368.db2.gz NJQJKSNSXPNSDL-IBGZPJMESA-N 0 1 317.404 4.258 20 0 DIADMN Cc1ccnc(CN[C@H](C)CCC(C)(C)C)c1Br ZINC001474012172 1061551969 /nfs/dbraw/zinc/55/19/69/1061551969.db2.gz YGQHSKZWENWAKM-GFCCVEGCSA-N 0 1 313.283 4.457 20 0 DIADMN Cc1nc2cccc(C(=O)NC[C@H](c3ccccc3)C(C)C)c2[nH]1 ZINC001464073157 1061553988 /nfs/dbraw/zinc/55/39/88/1061553988.db2.gz KFTDQVFKCXNWHP-KRWDZBQOSA-N 0 1 321.424 4.041 20 0 DIADMN Cc1cc(-c2ccccc2)ccc1NC(=O)C(C)(C)c1cnc[nH]1 ZINC001464087653 1061555867 /nfs/dbraw/zinc/55/58/67/1061555867.db2.gz JVZOWKYDVKIPOM-UHFFFAOYSA-N 0 1 319.408 4.301 20 0 DIADMN O=C(NCc1ccsc1)c1cc(Cl)c2ccccc2c1O ZINC001464180685 1061562221 /nfs/dbraw/zinc/56/22/21/1061562221.db2.gz XPWTXYMIUOQAAJ-UHFFFAOYSA-N 0 1 317.797 4.190 20 0 DIADMN CO[C@H](CNCc1nc(C(C)(C)C)cs1)c1ccc(F)cc1 ZINC001474023463 1061564442 /nfs/dbraw/zinc/56/44/42/1061564442.db2.gz ZSWRKLFUNJBCFE-CQSZACIVSA-N 0 1 322.449 4.057 20 0 DIADMN COc1ccc2c(c1)OCC[C@@H]2NCc1ccc(Cl)c(C)c1 ZINC001474025609 1061566250 /nfs/dbraw/zinc/56/62/50/1061566250.db2.gz VLMIAPSQRGAHNP-KRWDZBQOSA-N 0 1 317.816 4.270 20 0 DIADMN COc1ccc2c(c1)OCC[C@H]2NCc1ccc(Cl)c(C)c1 ZINC001474025610 1061567766 /nfs/dbraw/zinc/56/77/66/1061567766.db2.gz VLMIAPSQRGAHNP-QGZVFWFLSA-N 0 1 317.816 4.270 20 0 DIADMN CCCCCCN(C)CC(=O)N1CC[C@@H](C)c2ccccc21 ZINC001464296262 1061571558 /nfs/dbraw/zinc/57/15/58/1061571558.db2.gz ZBPFEYRFZAOCLN-MRXNPFEDSA-N 0 1 302.462 4.039 20 0 DIADMN CCCC[C@H](O)CNCc1csc(-c2cccc(Cl)c2)n1 ZINC001252123210 1061581506 /nfs/dbraw/zinc/58/15/06/1061581506.db2.gz PXQJONDCOKQMIA-HNNXBMFYSA-N 0 1 324.877 4.104 20 0 DIADMN CSCc1cc(F)ccc1CNCc1ccc(C)cc1F ZINC001474043816 1061589028 /nfs/dbraw/zinc/58/90/28/1061589028.db2.gz UOQSHGLBJCVPFK-UHFFFAOYSA-N 0 1 307.409 4.426 20 0 DIADMN Cc1ccc2c(c1)[C@@H](NCc1cccc(OC(F)(F)F)c1)CO2 ZINC001474047388 1061595941 /nfs/dbraw/zinc/59/59/41/1061595941.db2.gz ZVRCMEWIBVFWNB-HNNXBMFYSA-N 0 1 323.314 4.117 20 0 DIADMN Cc1ccccc1[C@H](C)N(C)Cc1cncc(Br)c1 ZINC000541280695 1061606460 /nfs/dbraw/zinc/60/64/60/1061606460.db2.gz IAEUTRDOVZQIJD-ZDUSSCGKSA-N 0 1 319.246 4.346 20 0 DIADMN CC(C)N(Cc1ccccc1F)C(=O)c1ccc(Cl)c(O)c1 ZINC001464562613 1061607591 /nfs/dbraw/zinc/60/75/91/1061607591.db2.gz HWJODIVYBHNJQC-UHFFFAOYSA-N 0 1 321.779 4.236 20 0 DIADMN CCN(c1ccc(NCc2cccc3nccn32)cc1)C(C)C ZINC001474063173 1061610370 /nfs/dbraw/zinc/61/03/70/1061610370.db2.gz VWRXPWZDAOMZPV-UHFFFAOYSA-N 0 1 308.429 4.181 20 0 DIADMN Fc1ccc(/C=C/CN[C@@H]2COc3ccc(Cl)cc32)cc1F ZINC001474065119 1061610393 /nfs/dbraw/zinc/61/03/93/1061610393.db2.gz JDXGWLGGBNWYCQ-XGBNDESESA-N 0 1 321.754 4.355 20 0 DIADMN CC[C@@H](C)Oc1cc(C)ccc1CNCc1cccc(OC)c1 ZINC001474069228 1061616203 /nfs/dbraw/zinc/61/62/03/1061616203.db2.gz CGHQUVYSOKAIFS-MRXNPFEDSA-N 0 1 313.441 4.471 20 0 DIADMN COc1cc(F)cc(CNCc2cccc(OC(C)(C)C)c2)c1 ZINC001474073449 1061618462 /nfs/dbraw/zinc/61/84/62/1061618462.db2.gz NYIBDGFGPACPGM-UHFFFAOYSA-N 0 1 317.404 4.301 20 0 DIADMN CCN(CC)CC(=O)Nc1ccc(CCCc2ccccc2)cc1 ZINC001464705363 1061624367 /nfs/dbraw/zinc/62/43/67/1061624367.db2.gz CPWVUSPHGBHVGV-UHFFFAOYSA-N 0 1 324.468 4.142 20 0 DIADMN O[C@H](c1ccccc1)C1(CNCc2c(F)cccc2Cl)CC1 ZINC001474080560 1061627422 /nfs/dbraw/zinc/62/74/22/1061627422.db2.gz CWWAARFFCQDFJB-QGZVFWFLSA-N 0 1 319.807 4.083 20 0 DIADMN CCOc1cccc(CNCc2ccc(C(C)(C)CC)cc2)n1 ZINC001474081708 1061629944 /nfs/dbraw/zinc/62/99/44/1061629944.db2.gz BFFZKOLSCGKGCO-UHFFFAOYSA-N 0 1 312.457 4.458 20 0 DIADMN Cc1ccc([C@@H](Cn2ccnc2)NCc2ccccc2F)c(C)c1 ZINC001474082315 1061630338 /nfs/dbraw/zinc/63/03/38/1061630338.db2.gz PHONPFYUSYNUOT-HXUWFJFHSA-N 0 1 323.415 4.170 20 0 DIADMN COc1nsc(CN[C@H]2c3ccccc3CC[C@H]2C)c1Cl ZINC001474087651 1061634434 /nfs/dbraw/zinc/63/44/34/1061634434.db2.gz ITBSOAZDBSVIBY-MEBBXXQBSA-N 0 1 322.861 4.218 20 0 DIADMN COc1ccc(CN[C@H](C)c2cc(Cl)ccc2F)cc1F ZINC001474093246 1061639897 /nfs/dbraw/zinc/63/98/97/1061639897.db2.gz CXWQXDFSFFOVMM-SNVBAGLBSA-N 0 1 311.759 4.478 20 0 DIADMN C[C@H](NCc1cccc(Oc2ccc(F)cc2)c1)c1cn[nH]c1 ZINC001474097578 1061642363 /nfs/dbraw/zinc/64/23/63/1061642363.db2.gz SOQLZEGHTQLAMA-ZDUSSCGKSA-N 0 1 311.360 4.192 20 0 DIADMN COc1ccnc(NC/C(C)=C/c2ccccc2OC(F)F)c1 ZINC001474098471 1061644986 /nfs/dbraw/zinc/64/49/86/1061644986.db2.gz ZYIASKKBSSKLHF-FMIVXFBMSA-N 0 1 320.339 4.207 20 0 DIADMN CN1CCN(c2ccccc2NC[C@@H]2CCCC(C)(C)C2)CC1 ZINC001474099382 1061645287 /nfs/dbraw/zinc/64/52/87/1061645287.db2.gz BWXGFGRZWSCPHB-QGZVFWFLSA-N 0 1 315.505 4.067 20 0 DIADMN CCCOC1(CNc2ccncc2C(F)(F)F)CCCCC1 ZINC001458227764 1061646322 /nfs/dbraw/zinc/64/63/22/1061646322.db2.gz FBWGWSMVRRZEFD-UHFFFAOYSA-N 0 1 316.367 4.064 20 0 DIADMN Cc1[nH]nc(CN[C@H](CC(F)(F)F)c2ccc(C)cc2)c1C ZINC001474101945 1061647654 /nfs/dbraw/zinc/64/76/54/1061647654.db2.gz DLAMGIZIDMISQT-CQSZACIVSA-N 0 1 311.351 4.118 20 0 DIADMN CCN(C)[C@H](C(=O)N[C@H]1CCC[C@H](C(C)C)C1)c1ccccc1 ZINC001464968222 1061656668 /nfs/dbraw/zinc/65/66/68/1061656668.db2.gz CFYWOAYAWWWBSV-FHWLQOOXSA-N 0 1 316.489 4.010 20 0 DIADMN CN1CCC[C@H]1c1nnc(-c2ccc(-c3ccccc3)cc2)o1 ZINC001252543674 1061661172 /nfs/dbraw/zinc/66/11/72/1061661172.db2.gz BKYIFNYLJMMSRK-KRWDZBQOSA-N 0 1 305.381 4.170 20 0 DIADMN Cc1cc(C[C@H](C)Nc2nc3c(cc(Cl)cc3F)s2)[nH]n1 ZINC001458257339 1061662583 /nfs/dbraw/zinc/66/25/83/1061662583.db2.gz AQKKMSLEFIBNCF-ZETCQYMHSA-N 0 1 324.812 4.163 20 0 DIADMN C[C@H]1CC[C@H](NC(=O)c2cn[nH]c2-c2ccc(Cl)s2)CC1 ZINC001464999337 1061663400 /nfs/dbraw/zinc/66/34/00/1061663400.db2.gz JYGCTZFLSOKHOE-MGCOHNPYSA-N 0 1 323.849 4.100 20 0 DIADMN Cc1[nH]ncc1-c1nnc(-c2ccc(-c3ccccc3)cc2)o1 ZINC001252572610 1061667133 /nfs/dbraw/zinc/66/71/33/1061667133.db2.gz NJBJASVXOYXBMY-UHFFFAOYSA-N 0 1 302.337 4.102 20 0 DIADMN CCCCC[C@@H](NC(=O)c1cc(F)cc(F)c1O)C(C)(C)C ZINC001465108926 1061679807 /nfs/dbraw/zinc/67/98/07/1061679807.db2.gz CGMFWOSXSYEWJJ-CQSZACIVSA-N 0 1 313.388 4.395 20 0 DIADMN CC/C=C(/F)C(=O)N[C@@H](c1ccccc1)c1ccc2nc[nH]c2c1 ZINC001465132146 1061687221 /nfs/dbraw/zinc/68/72/21/1061687221.db2.gz OQNFLTMYCLJVKE-WCLIJEPQSA-N 0 1 323.371 4.032 20 0 DIADMN Fc1cccc(-c2ccc(CNc3cccc4[nH]nnc43)s2)c1 ZINC001474151225 1061696303 /nfs/dbraw/zinc/69/63/03/1061696303.db2.gz DESVQGRXTQWART-UHFFFAOYSA-N 0 1 324.384 4.438 20 0 DIADMN Cc1cc(Cl)c(NCc2ccnn2-c2ccncc2)cc1C ZINC001474156328 1061697708 /nfs/dbraw/zinc/69/77/08/1061697708.db2.gz VBUVENWSHSRRAY-UHFFFAOYSA-N 0 1 312.804 4.150 20 0 DIADMN FC(F)(F)c1cnccc1N[C@H]1CC[C@H](Cc2ccccc2)C1 ZINC001458328568 1061700094 /nfs/dbraw/zinc/70/00/94/1061700094.db2.gz RFTQXEYEVVCJAM-CABCVRRESA-N 0 1 320.358 4.346 20 0 DIADMN CC[C@](C)(NC(=O)c1ccc(Cl)c(O)c1)c1ccccc1 ZINC001465191300 1061703595 /nfs/dbraw/zinc/70/35/95/1061703595.db2.gz AMBSNXCVJAAUDL-KRWDZBQOSA-N 0 1 303.789 4.101 20 0 DIADMN Cc1ccc2cc(-c3nnc(-c4ccc(Cl)cc4)o3)[nH]c2n1 ZINC001252729051 1061703513 /nfs/dbraw/zinc/70/35/13/1061703513.db2.gz IIFFWVDHWGFVRA-UHFFFAOYSA-N 0 1 310.744 4.242 20 0 DIADMN Clc1ccc(-c2nnc([C@H]3CCN3C3CCCCC3)o2)cc1 ZINC001252740034 1061706724 /nfs/dbraw/zinc/70/67/24/1061706724.db2.gz UPPYXAJSHWZMLL-OAHLLOKOSA-N 0 1 317.820 4.470 20 0 DIADMN Cc1ccc(-c2cc(NC(=O)Nc3ccc(Cl)cc3)[nH]n2)o1 ZINC001465201479 1061709802 /nfs/dbraw/zinc/70/98/02/1061709802.db2.gz ZZXRZZVERYJWOG-UHFFFAOYSA-N 0 1 316.748 4.276 20 0 DIADMN Clc1ccc(-c2nnc(-c3cc(-c4ccccc4)n[nH]3)o2)cc1 ZINC001252763959 1061710685 /nfs/dbraw/zinc/71/06/85/1061710685.db2.gz IZAMISRIUMDHJL-UHFFFAOYSA-N 0 1 322.755 4.447 20 0 DIADMN CC(C)c1nn(C)cc1Nc1nc(C2CCCCC2)ns1 ZINC001458349258 1061712189 /nfs/dbraw/zinc/71/21/89/1061712189.db2.gz YPIKWYBDUWSMIZ-UHFFFAOYSA-N 0 1 305.451 4.186 20 0 DIADMN CC(C)Nc1cc(F)ccc1NC(=O)c1ccc(O)c(Cl)c1 ZINC001465293249 1061728298 /nfs/dbraw/zinc/72/82/98/1061728298.db2.gz KKUKYAMABLMGGT-UHFFFAOYSA-N 0 1 322.767 4.257 20 0 DIADMN c1ccc2c(c1)COC[C@@H]2NCc1cccc(-c2cccnc2)c1 ZINC001474183631 1061729758 /nfs/dbraw/zinc/72/97/58/1061729758.db2.gz GZFWJEKVVPQGIR-NRFANRHFSA-N 0 1 316.404 4.110 20 0 DIADMN COc1cccc(OC)c1CNCc1ccc(C)c2ccccc12 ZINC001474182005 1061731209 /nfs/dbraw/zinc/73/12/09/1061731209.db2.gz VRXXLBHNNRBJOY-UHFFFAOYSA-N 0 1 321.420 4.455 20 0 DIADMN COc1ccccc1C1(NCc2ccc3c(c2)CCCC3)CC1 ZINC001474188135 1061736656 /nfs/dbraw/zinc/73/66/56/1061736656.db2.gz VHSVDHHOIMQUCC-UHFFFAOYSA-N 0 1 307.437 4.353 20 0 DIADMN CCSCc1cccc(NC(=O)c2cccc3nc[nH]c32)c1 ZINC001465350591 1061737899 /nfs/dbraw/zinc/73/78/99/1061737899.db2.gz GLLSKTPXQQOCQH-UHFFFAOYSA-N 0 1 311.410 4.068 20 0 DIADMN Cc1cc(CNC2(c3cccc(Cl)c3)CCC2)cnc1F ZINC001474189727 1061739201 /nfs/dbraw/zinc/73/92/01/1061739201.db2.gz QATLBYNWBZLDDA-UHFFFAOYSA-N 0 1 304.796 4.352 20 0 DIADMN CCN(CC)c1ccc(NC[C@H](O)c2ccc(F)cc2)c(C)c1 ZINC001252854322 1061744762 /nfs/dbraw/zinc/74/47/62/1061744762.db2.gz VIISQEPRNINPEL-IBGZPJMESA-N 0 1 316.420 4.126 20 0 DIADMN CC1(C)CN(c2ccncc2C(F)(F)F)Cc2ccccc2O1 ZINC001458407303 1061745722 /nfs/dbraw/zinc/74/57/22/1061745722.db2.gz TXIICXISZATBHI-UHFFFAOYSA-N 0 1 322.330 4.278 20 0 DIADMN Fc1ccc(/C=C\CNCc2cccc(OC3CC3)c2F)cc1 ZINC001474202838 1061756352 /nfs/dbraw/zinc/75/63/52/1061756352.db2.gz XACJNXBMZROLBU-IHWYPQMZSA-N 0 1 315.363 4.309 20 0 DIADMN CCc1ccc(C)nc1NCc1cccc(F)c1Br ZINC001474207348 1061763824 /nfs/dbraw/zinc/76/38/24/1061763824.db2.gz QSERFBMMHDOTIQ-UHFFFAOYSA-N 0 1 323.209 4.466 20 0 DIADMN Cc1c(NC(=O)Nc2ccc(F)c(C)c2)[nH]nc1-c1ccccc1 ZINC001465543335 1061774322 /nfs/dbraw/zinc/77/43/22/1061774322.db2.gz JQPNKIJKNIYJOW-UHFFFAOYSA-N 0 1 324.359 4.477 20 0 DIADMN Fc1ccc(C2(NCc3nccc4c3CCCC4)CCC2)cc1 ZINC001474218802 1061777231 /nfs/dbraw/zinc/77/72/31/1061777231.db2.gz IVWOCJXESXRZSZ-UHFFFAOYSA-N 0 1 310.416 4.269 20 0 DIADMN CCOc1cccc(CNCc2ccc(-c3ccccc3)s2)n1 ZINC001474219766 1061778752 /nfs/dbraw/zinc/77/87/52/1061778752.db2.gz MMVNOGAXCRAHLP-UHFFFAOYSA-N 0 1 324.449 4.499 20 0 DIADMN CCC[C@@H]1[C@H](C)CCCN1C(=O)c1cc(C2CCCCC2)[nH]n1 ZINC001465567895 1061779387 /nfs/dbraw/zinc/77/93/87/1061779387.db2.gz NSDLLARABNSSRO-RDTXWAMCSA-N 0 1 317.477 4.498 20 0 DIADMN FC1(F)Oc2cccc(CNCc3cccc4ccoc43)c2O1 ZINC001474222727 1061785082 /nfs/dbraw/zinc/78/50/82/1061785082.db2.gz HYHQRMZBHHTDAY-UHFFFAOYSA-N 0 1 317.291 4.044 20 0 DIADMN Fc1ccccc1-c1ncc(CN[C@@H]2CCCC[C@@H]2F)s1 ZINC001474228726 1061789078 /nfs/dbraw/zinc/78/90/78/1061789078.db2.gz MCCXHRJEJHHPDG-LSDHHAIUSA-N 0 1 308.397 4.320 20 0 DIADMN C[C@H](NCc1cc2nc(Cl)ccc2s1)c1ccns1 ZINC001474228277 1061790802 /nfs/dbraw/zinc/79/08/02/1061790802.db2.gz UWJLJSMGEDFQKS-QMMMGPOBSA-N 0 1 309.847 4.257 20 0 DIADMN CCCCCC[C@](C)(CC)C(=O)Nc1ccc2[nH]nnc2c1 ZINC001465666921 1061792480 /nfs/dbraw/zinc/79/24/80/1061792480.db2.gz OVVGEVGJCOLPSL-KRWDZBQOSA-N 0 1 302.422 4.283 20 0 DIADMN c1nc2ccc(CNc3nc(C4CCCCC4)ns3)cc2[nH]1 ZINC001458487441 1061792748 /nfs/dbraw/zinc/79/27/48/1061792748.db2.gz CPXZLKKTMVLTTQ-UHFFFAOYSA-N 0 1 313.430 4.074 20 0 DIADMN C[C@](O)(CNc1ccc(N2CCCCCC2)cc1)c1ccccc1 ZINC001253110877 1061811432 /nfs/dbraw/zinc/81/14/32/1061811432.db2.gz UDQYFQBGIBOXHX-NRFANRHFSA-N 0 1 324.468 4.387 20 0 DIADMN CCN(CC)c1ccc(NC[C@](C)(O)c2ccccc2)c(C)c1 ZINC001253111939 1061812183 /nfs/dbraw/zinc/81/21/83/1061812183.db2.gz POAGESKAHJZLPR-FQEVSTJZSA-N 0 1 312.457 4.161 20 0 DIADMN COc1ccc2c(c1)[C@@H](NCc1cccc(Cl)c1F)CC2 ZINC001253116326 1061812919 /nfs/dbraw/zinc/81/29/19/1061812919.db2.gz REWFXIKQAFLIOC-INIZCTEOSA-N 0 1 305.780 4.265 20 0 DIADMN Cc1ccc2[nH]c(NCc3csc(C(C)(C)C)n3)nc2c1 ZINC001474248900 1061815890 /nfs/dbraw/zinc/81/58/90/1061815890.db2.gz RFAQIRFHIPBOJZ-UHFFFAOYSA-N 0 1 300.431 4.237 20 0 DIADMN CC[C@@H](C)CCC(=O)Nc1ccc2nc(-c3ccccn3)[nH]c2c1 ZINC001458521799 1061819023 /nfs/dbraw/zinc/81/90/23/1061819023.db2.gz RBPVBSPLZMHUFB-CYBMUJFWSA-N 0 1 322.412 4.390 20 0 DIADMN c1ccc(OCC2CC2)c(CNc2ccc3c(n2)CCCC3)c1 ZINC001474256676 1061826462 /nfs/dbraw/zinc/82/64/62/1061826462.db2.gz SMMJOHZEDJUFBN-UHFFFAOYSA-N 0 1 308.425 4.361 20 0 DIADMN Cc1cc2cc(CNCc3ccc4c(c3)ncn4C)oc2cc1C ZINC001474270382 1061838824 /nfs/dbraw/zinc/83/88/24/1061838824.db2.gz XYKWSDZEYWEVGY-UHFFFAOYSA-N 0 1 319.408 4.226 20 0 DIADMN CC(C)(/C=C/Cl)NCc1cnn(-c2ccc(Cl)cc2)c1 ZINC001474274338 1061842653 /nfs/dbraw/zinc/84/26/53/1061842653.db2.gz ZSJZPZCNGZTOAK-BQYQJAHWSA-N 0 1 310.228 4.146 20 0 DIADMN COc1cccc(-c2cc(CNCc3ccc(C)s3)on2)c1 ZINC001474280279 1061847451 /nfs/dbraw/zinc/84/74/51/1061847451.db2.gz SBDKTCLWXPIAFW-UHFFFAOYSA-N 0 1 314.410 4.010 20 0 DIADMN COc1ccc(Cl)cc1CN[C@@H]1CCc2cc(F)ccc21 ZINC001474287501 1061856906 /nfs/dbraw/zinc/85/69/06/1061856906.db2.gz JBVHTEBDVRCCJI-MRXNPFEDSA-N 0 1 305.780 4.265 20 0 DIADMN Clc1ccc(Cl)c(CN[C@@H]2COC[C@H]2C2CC2)c1Cl ZINC001474294368 1061864198 /nfs/dbraw/zinc/86/41/98/1061864198.db2.gz GGDCBJDKUWZYQX-GXFFZTMASA-N 0 1 320.647 4.161 20 0 DIADMN CC(C)Sc1ccccc1NC(=O)[C@H](C)N1CCCCCC1 ZINC001466052750 1061866936 /nfs/dbraw/zinc/86/69/36/1061866936.db2.gz ZDFGVUDAYIPGIU-HNNXBMFYSA-N 0 1 320.502 4.390 20 0 DIADMN CC[C@@H]1CCN(C(=O)Nc2ccc3nc(C(F)F)[nH]c3c2)[C@H]1C ZINC001466066596 1061868084 /nfs/dbraw/zinc/86/80/84/1061868084.db2.gz PZBRXXCNQYIINX-VHSXEESVSA-N 0 1 322.359 4.153 20 0 DIADMN COc1ccc(Cl)cc1CN(C)Cc1cc(C)c(O)c(C)c1 ZINC001474311694 1061881311 /nfs/dbraw/zinc/88/13/11/1061881311.db2.gz UQGNQJCKMFTSRZ-UHFFFAOYSA-N 0 1 319.832 4.303 20 0 DIADMN CSc1ccccc1NC(=O)CN(C)C[C@@H]1CCC[C@@H](C)C1 ZINC001474319726 1061896916 /nfs/dbraw/zinc/89/69/16/1061896916.db2.gz PLBASDYUDGCVQW-HUUCEWRRSA-N 0 1 320.502 4.105 20 0 DIADMN CC[C@H]1CCCCCN1Cc1cc(C)c(Br)cn1 ZINC001474323170 1061904397 /nfs/dbraw/zinc/90/43/97/1061904397.db2.gz CLKUZGVNWBXEAF-AWEZNQCLSA-N 0 1 311.267 4.307 20 0 DIADMN Cc1cccc(NC[C@@H]2CCCN2Cc2cc(Cl)cs2)n1 ZINC001474323789 1061909304 /nfs/dbraw/zinc/90/93/04/1061909304.db2.gz HPEWZUAOFGLPBI-AWEZNQCLSA-N 0 1 321.877 4.181 20 0 DIADMN COc1nsc(CN(CC(C)C)CC(C)(C)C)c1Cl ZINC001474325269 1061909542 /nfs/dbraw/zinc/90/95/42/1061909542.db2.gz WQHMSPPCTMDGIC-UHFFFAOYSA-N 0 1 304.887 4.309 20 0 DIADMN CC[C@@H]1CCCN(Cc2cc(C)c(Br)cn2)CC1 ZINC001474324622 1061910421 /nfs/dbraw/zinc/91/04/21/1061910421.db2.gz ZVUGWQAIXIFMNF-CYBMUJFWSA-N 0 1 311.267 4.165 20 0 DIADMN Cc1ccc([C@H]2C[C@@H](C)CCN2Cc2cccc(F)c2N)o1 ZINC001474327821 1061912195 /nfs/dbraw/zinc/91/21/95/1061912195.db2.gz VWFSYFPJPVMETA-BLLLJJGKSA-N 0 1 302.393 4.283 20 0 DIADMN CC[C@@H]1CN(Cc2cc(F)ncc2F)CC[C@@H]1c1ccccc1 ZINC001474327356 1061915281 /nfs/dbraw/zinc/91/52/81/1061915281.db2.gz RJCSVNXQBAQTRN-PBHICJAKSA-N 0 1 316.395 4.376 20 0 DIADMN CO[C@H]1CCC[C@@H](Sc2nc(-c3ccc(Cl)cc3)n[nH]2)C1 ZINC001458854805 1061921075 /nfs/dbraw/zinc/92/10/75/1061921075.db2.gz UOCXPQVMJDLEKD-QWHCGFSZSA-N 0 1 323.849 4.175 20 0 DIADMN CO[C@H](CN(Cc1ccccc1)Cc1ccccc1F)C1CC1 ZINC001474336987 1061931567 /nfs/dbraw/zinc/93/15/67/1061931567.db2.gz RAGADLRREOETDH-HXUWFJFHSA-N 0 1 313.416 4.253 20 0 DIADMN COc1nc(CN2CCCCC[C@@H]2c2ccc(C)o2)ccc1C ZINC001474338610 1061933540 /nfs/dbraw/zinc/93/35/40/1061933540.db2.gz XJWIBGBHBBJLSC-QGZVFWFLSA-N 0 1 314.429 4.417 20 0 DIADMN Cc1ccc([C@H]2CCCCCN2Cc2ccnn2CC2CC2)o1 ZINC001474337933 1061934736 /nfs/dbraw/zinc/93/47/36/1061934736.db2.gz DXPKWIBNAQXYBF-GOSISDBHSA-N 0 1 313.445 4.312 20 0 DIADMN Cc1scc(CN2CCN(c3ccc(Cl)cc3)CC2)c1C ZINC001474340625 1061936007 /nfs/dbraw/zinc/93/60/07/1061936007.db2.gz QYCPJRFEDLMJHY-UHFFFAOYSA-N 0 1 320.889 4.341 20 0 DIADMN CO[C@@H](CSc1nc(C=Cc2ccccc2)n[nH]1)CC(C)C ZINC001458904088 1061936420 /nfs/dbraw/zinc/93/64/20/1061936420.db2.gz OQLXVYSAKPEOHN-FJVVXJACSA-N 0 1 317.458 4.128 20 0 DIADMN CSc1ccc(C)c(NC(=O)c2ccc(Cl)cc2O)c1 ZINC001546156255 1061939960 /nfs/dbraw/zinc/93/99/60/1061939960.db2.gz MELWWXISKVVRNY-UHFFFAOYSA-N 0 1 307.802 4.328 20 0 DIADMN Cc1nc2sccn2c1CN(C)Cc1cccc2ccoc21 ZINC001474342652 1061940515 /nfs/dbraw/zinc/94/05/15/1061940515.db2.gz CLJIONOBQSGHJB-UHFFFAOYSA-N 0 1 311.410 4.082 20 0 DIADMN Cc1nc([C@H](C)SCc2c(Cl)cccc2Cl)n[nH]1 ZINC001458937150 1061947206 /nfs/dbraw/zinc/94/72/06/1061947206.db2.gz NHCRFOQTXLDXGD-ZETCQYMHSA-N 0 1 302.230 4.414 20 0 DIADMN O=C(c1cc(C2CCCCC2)[nH]n1)N1CC[C@@H]2CCCC[C@@H]2C1 ZINC001253685368 1061952819 /nfs/dbraw/zinc/95/28/19/1061952819.db2.gz AVCXXMXJLSOFKD-GOEBONIOSA-N 0 1 315.461 4.110 20 0 DIADMN FC(F)=C(F)CCSc1nc(-c2cc(F)cc(F)c2)n[nH]1 ZINC001458960964 1061957432 /nfs/dbraw/zinc/95/74/32/1061957432.db2.gz RUZMMZFTIZVGGN-UHFFFAOYSA-N 0 1 321.274 4.310 20 0 DIADMN Fc1cccc2c(-c3nnc(-c4cccc(Cl)c4)o3)n[nH]c21 ZINC001253740760 1061969313 /nfs/dbraw/zinc/96/93/13/1061969313.db2.gz HIMSXYHLBFSMSB-UHFFFAOYSA-N 0 1 314.707 4.072 20 0 DIADMN COc1ccc(F)cc1CN(Cc1ccc(F)cc1)CC1CC1 ZINC001474355597 1061970355 /nfs/dbraw/zinc/97/03/55/1061970355.db2.gz PVWBYRDFROVBMA-UHFFFAOYSA-N 0 1 317.379 4.386 20 0 DIADMN CC[C@@H]1CCC[C@@]1(C)C(=O)Nc1cccc2c1CN(C1CC1)C2 ZINC001466605842 1061970941 /nfs/dbraw/zinc/97/09/41/1061970941.db2.gz JXQRELMACAUAQC-FOIQADDNSA-N 0 1 312.457 4.320 20 0 DIADMN C[C@]1(c2ccccc2)CCCN(Cc2cn3cccc(F)c3n2)C1 ZINC001474357844 1061976159 /nfs/dbraw/zinc/97/61/59/1061976159.db2.gz JNOJGPUBZJZKQL-FQEVSTJZSA-N 0 1 323.415 4.027 20 0 DIADMN CC(C)[C@@H](O)CN(C)Cc1cc(F)ccc1Oc1ccccc1 ZINC001253764701 1061977575 /nfs/dbraw/zinc/97/75/75/1061977575.db2.gz DJYDFPLWNZSOJP-SFHVURJKSA-N 0 1 317.404 4.067 20 0 DIADMN CC(C)C1(CN2CCN(c3ccc(F)cc3Cl)CC2)CC1 ZINC001474358514 1061981432 /nfs/dbraw/zinc/98/14/32/1061981432.db2.gz JXHINEYVVAHRPW-UHFFFAOYSA-N 0 1 310.844 4.037 20 0 DIADMN CC(C)[C@H]1CN(Cc2ccc(C(F)F)c(F)c2)CCS1 ZINC001474361132 1061986318 /nfs/dbraw/zinc/98/63/18/1061986318.db2.gz YQRKMSZQCXVRHW-CQSZACIVSA-N 0 1 303.393 4.337 20 0 DIADMN COc1cc(CN(Cc2ccc(F)cc2)C2CC2)ccc1F ZINC001253963007 1062004151 /nfs/dbraw/zinc/00/41/51/1062004151.db2.gz IHWNAIDGJRGUFF-UHFFFAOYSA-N 0 1 303.352 4.138 20 0 DIADMN C[C@H]1C[N@H+](Cc2ccc(OCC(F)(F)F)c(F)c2)CC[C@@H]1C ZINC001474370204 1062009279 /nfs/dbraw/zinc/00/92/79/1062009279.db2.gz QDOHYLDVEBYQFW-RYUDHWBXSA-N 0 1 319.342 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CCn1nc(CN[C@H](C)c2ccc3c(c2)CCC3)c2ccccc21 ZINC001461405634 1063477771 /nfs/dbraw/zinc/47/77/71/1063477771.db2.gz QXIDIKABRBZPKX-OAHLLOKOSA-N 0 1 319.452 4.396 20 0 DIADMN CCn1c2cccc(F)c2nc1CN1C[C@@H](C)CCC[C@H]1C ZINC001473174096 1063479298 /nfs/dbraw/zinc/47/92/98/1063479298.db2.gz QWAOADPIDSNOFA-UONOGXRCSA-N 0 1 303.425 4.206 20 0 DIADMN Cc1c2ccccc2sc1[C@@H](C)NCc1cn(C)nc1Cl ZINC001461419211 1063489796 /nfs/dbraw/zinc/48/97/96/1063489796.db2.gz ZBCFOHRFXJBMLX-LLVKDONJSA-N 0 1 319.861 4.447 20 0 DIADMN Cc1cc(C)c(/C=C\CNCc2nn(C)c3ccccc23)c(C)c1 ZINC001461423298 1063491778 /nfs/dbraw/zinc/49/17/78/1063491778.db2.gz KDMWLOHOVMTART-CLFYSBASSA-N 0 1 319.452 4.302 20 0 DIADMN CCCCOC(=O)[C@H](C)N(C)[C@@H]1CCC[C@H]1c1ccc(C)cc1 ZINC001473186201 1063493250 /nfs/dbraw/zinc/49/32/50/1063493250.db2.gz KHOKLJWMVYKUNE-YTQUADARSA-N 0 1 317.473 4.295 20 0 DIADMN C[C@@H]1CCCN(Cc2c(F)cccc2Br)[C@@H]1C ZINC001473186617 1063494294 /nfs/dbraw/zinc/49/42/94/1063494294.db2.gz OPFQCEUPRNMLQJ-GHMZBOCLSA-N 0 1 300.215 4.209 20 0 DIADMN CC(C)C[C@H](C)C[C@H](C)n1nc(COCC2CC2)c2c1CNC2 ZINC001258063996 1063494093 /nfs/dbraw/zinc/49/40/93/1063494093.db2.gz ILMFXHJQEKEILL-GJZGRUSLSA-N 0 1 319.493 4.046 20 0 DIADMN CC1(C)[C@@H]2CN(Cc3ccc(Cl)cc3Br)C[C@@H]21 ZINC001473187035 1063497946 /nfs/dbraw/zinc/49/79/46/1063497946.db2.gz YRVUAEYCPUGFAS-TXEJJXNPSA-N 0 1 314.654 4.190 20 0 DIADMN Fc1cccc2c1OCC[C@H]2NCc1ccc2scnc2c1 ZINC001461433995 1063501262 /nfs/dbraw/zinc/50/12/62/1063501262.db2.gz KFEGGBDXTCIJOD-CQSZACIVSA-N 0 1 314.385 4.049 20 0 DIADMN C[C@H]1C[C@H](N2CCO[C@@H](c3ccc(F)c(F)c3)C2)C[C@@H](C)C1 ZINC001258172211 1063542853 /nfs/dbraw/zinc/54/28/53/1063542853.db2.gz VUBMVILUNPEBLW-VAGZCVSGSA-N 0 1 309.400 4.163 20 0 DIADMN C[C@@H](Cc1ccco1)NCc1ncc(C(F)(F)F)cc1Cl ZINC001258176373 1063546545 /nfs/dbraw/zinc/54/65/45/1063546545.db2.gz SGTKHRSHFJUHKT-VIFPVBQESA-N 0 1 318.726 4.068 20 0 DIADMN O=C(Nc1cccc(Cl)c1O)c1cc(Cl)nc(C2CC2)c1 ZINC001546332507 1063550467 /nfs/dbraw/zinc/55/04/67/1063550467.db2.gz HITQEUAWQSLOFO-UHFFFAOYSA-N 0 1 323.179 4.224 20 0 DIADMN Fc1cc2c(c(F)c1F)[C@@H](NCc1ccc3cc[nH]c3c1)CC2 ZINC001461515996 1063550773 /nfs/dbraw/zinc/55/07/73/1063550773.db2.gz QFVLFKRRUQJLFW-AWEZNQCLSA-N 0 1 316.326 4.362 20 0 DIADMN FC(F)(F)COc1ccc(CNc2ccc3c(n2)CCC3)cc1 ZINC001461515939 1063551882 /nfs/dbraw/zinc/55/18/82/1063551882.db2.gz LZYNEKCDMSJSGE-UHFFFAOYSA-N 0 1 322.330 4.124 20 0 DIADMN c1cc(-c2nnc([C@@H]3CCN3C3CCCCC3)o2)cc2c1CCC2 ZINC001258194948 1063554091 /nfs/dbraw/zinc/55/40/91/1063554091.db2.gz HYPHWVDMFWIXNP-SFHVURJKSA-N 0 1 323.440 4.305 20 0 DIADMN C[C@@H](Cc1ccco1)N1CCO[C@@](C)(c2ccc(Cl)cc2)C1 ZINC001258194482 1063556161 /nfs/dbraw/zinc/55/61/61/1063556161.db2.gz HKEVYOCEANRBST-KBXCAEBGSA-N 0 1 319.832 4.112 20 0 DIADMN Fc1cccc2c1CCC[C@H]2NCc1nccc2c1CCCC2 ZINC001461541370 1063568543 /nfs/dbraw/zinc/56/85/43/1063568543.db2.gz VXKWSWAKPQIEEX-LJQANCHMSA-N 0 1 310.416 4.267 20 0 DIADMN Cc1nc2cc(NC[C@@H]3CCCC[C@H]3C)ccc2n1[C@@H](C)CO ZINC001461565445 1063583068 /nfs/dbraw/zinc/58/30/68/1063583068.db2.gz OXZVLYZDZJARDK-YCPHGPKFSA-N 0 1 315.461 4.136 20 0 DIADMN Cc1coc(CN[C@H](C)CC(C)(C)SCc2ccco2)n1 ZINC001258293681 1063589372 /nfs/dbraw/zinc/58/93/72/1063589372.db2.gz ALPNSHVSOYWBBF-GFCCVEGCSA-N 0 1 308.447 4.156 20 0 DIADMN CC1(C)CCC[C@@H](N2CCc3ncc(C(F)(F)F)cc3C2)C1 ZINC001258288947 1063590896 /nfs/dbraw/zinc/59/08/96/1063590896.db2.gz KRORANODIFSVJD-CQSZACIVSA-N 0 1 312.379 4.427 20 0 DIADMN Clc1ccccc1C1(NCc2ccc3nccnc3c2)CC1 ZINC001461592327 1063601738 /nfs/dbraw/zinc/60/17/38/1063601738.db2.gz MKHXTMBVNSRPEH-UHFFFAOYSA-N 0 1 309.800 4.062 20 0 DIADMN C[C@H](Oc1ccnc(NCc2cnsc2)c1)c1ccccc1 ZINC001461615244 1063613119 /nfs/dbraw/zinc/61/31/19/1063613119.db2.gz DGTRIYZAZUJJEB-ZDUSSCGKSA-N 0 1 311.410 4.290 20 0 DIADMN Cc1ccccc1-n1cc(CNCc2ccc3occc3c2)cn1 ZINC001461620191 1063616587 /nfs/dbraw/zinc/61/65/87/1063616587.db2.gz JDSSNCWFKINNMX-UHFFFAOYSA-N 0 1 317.392 4.217 20 0 DIADMN CN(C)c1cccc(Cl)c1CN[C@@H]1CCc2ccccc21 ZINC001461620060 1063617503 /nfs/dbraw/zinc/61/75/03/1063617503.db2.gz WRYICXGPRBTPPK-QGZVFWFLSA-N 0 1 300.833 4.183 20 0 DIADMN CCCCC(CCCC)N1CCCn2cnc(COCC)c2C1 ZINC001258386341 1063628447 /nfs/dbraw/zinc/62/84/47/1063628447.db2.gz XLXKQJVUEUJBTF-UHFFFAOYSA-N 0 1 321.509 4.374 20 0 DIADMN Cc1cc(C)cc(CNCc2cnn(-c3ccccc3C)c2)c1 ZINC001461655701 1063641370 /nfs/dbraw/zinc/64/13/70/1063641370.db2.gz ZKGPQZSROJIMFN-UHFFFAOYSA-N 0 1 305.425 4.087 20 0 DIADMN CC(C)[C@H](O)[C@H](NCc1ccc(Cl)c(F)c1)c1ccccc1 ZINC001461662995 1063644400 /nfs/dbraw/zinc/64/44/00/1063644400.db2.gz VEPKQMVUOIMYKJ-MSOLQXFVSA-N 0 1 321.823 4.327 20 0 DIADMN CCCCC[C@H](CC)N1CCc2nc(C(=O)OCC)sc2C1 ZINC001258443325 1063657027 /nfs/dbraw/zinc/65/70/27/1063657027.db2.gz LEKCJMSWRJUHPB-ZDUSSCGKSA-N 0 1 324.490 4.037 20 0 DIADMN CCCCC[C@@H](CC)N1CCCn2cnc(COC(C)C)c2C1 ZINC001258445403 1063658821 /nfs/dbraw/zinc/65/88/21/1063658821.db2.gz HBACBNAIYLFKSV-QGZVFWFLSA-N 0 1 321.509 4.373 20 0 DIADMN C[C@H](CC1CC1)N[C@]1(c2ccccc2Cl)CCCCC1=O ZINC001258454251 1063661695 /nfs/dbraw/zinc/66/16/95/1063661695.db2.gz GRLBXJLFIPMVCB-ACJLOTCBSA-N 0 1 305.849 4.457 20 0 DIADMN Cc1ccc(CN[C@@H](CCO)c2ccc(Cl)c(F)c2)cc1 ZINC001461694386 1063662568 /nfs/dbraw/zinc/66/25/68/1063662568.db2.gz XNKMXKXTQSOKSM-KRWDZBQOSA-N 0 1 307.796 4.001 20 0 DIADMN C[C@@H](CC1CC1)N1CCn2nc(-c3ccc(Cl)cc3)cc2C1 ZINC001258469360 1063667295 /nfs/dbraw/zinc/66/72/95/1063667295.db2.gz ATBCSXSAJUHLLY-ZDUSSCGKSA-N 0 1 315.848 4.208 20 0 DIADMN COc1nc2ccccc2cc1CNc1nc2cc(C)ccc2[nH]1 ZINC001461712766 1063673846 /nfs/dbraw/zinc/67/38/46/1063673846.db2.gz YJHJQXGNJWYSPO-UHFFFAOYSA-N 0 1 318.380 4.040 20 0 DIADMN COc1ccc(Cl)cc1CNc1nc2cc(C)ccc2[nH]1 ZINC001461719846 1063677902 /nfs/dbraw/zinc/67/79/02/1063677902.db2.gz YQJDELGBBOEQJH-UHFFFAOYSA-N 0 1 301.777 4.145 20 0 DIADMN Oc1ccc(CNCc2cscc2C(F)(F)F)cc1Cl ZINC001461730654 1063683555 /nfs/dbraw/zinc/68/35/55/1063683555.db2.gz NUGZSYXUBFWZTR-UHFFFAOYSA-N 0 1 321.751 4.416 20 0 DIADMN C[C@@H]1Cc2cc(CNCc3cc(Cl)ccc3F)ccc2O1 ZINC001461735223 1063686371 /nfs/dbraw/zinc/68/63/71/1063686371.db2.gz DVVPHYASDRJGTO-LLVKDONJSA-N 0 1 305.780 4.092 20 0 DIADMN O=C(C[C@@H]1C=CCCC1)Nc1nc2cc(Cl)c(F)cc2[nH]1 ZINC001461743696 1063690385 /nfs/dbraw/zinc/69/03/85/1063690385.db2.gz DGNRVSKJDSBMDQ-SECBINFHSA-N 0 1 307.756 4.040 20 0 DIADMN C[C@@H]1CC(C)(C)CC[C@@H]1NC(=O)c1n[nH]c2ccc(Cl)cc21 ZINC001516036366 1063717982 /nfs/dbraw/zinc/71/79/82/1063717982.db2.gz GUGGHWBBFCUGSF-MFKMUULPSA-N 0 1 319.836 4.161 20 0 DIADMN C[C@H](Cc1cccnc1)N1CCc2c(cccc2C(F)(F)F)C1 ZINC001258635400 1063718831 /nfs/dbraw/zinc/71/88/31/1063718831.db2.gz ZRZXGBBOVCBCBQ-CYBMUJFWSA-N 0 1 320.358 4.090 20 0 DIADMN COc1cc(CN[C@H](C)c2ncccc2C)ccc1OC(C)C ZINC001461814927 1063732860 /nfs/dbraw/zinc/73/28/60/1063732860.db2.gz GTJBACXUFOPNHK-OAHLLOKOSA-N 0 1 314.429 4.037 20 0 DIADMN CCCCC[C@@H](CCC)N1CCCn2cnc(COCC)c2C1 ZINC001258669200 1063737310 /nfs/dbraw/zinc/73/73/10/1063737310.db2.gz IVYNPLCGEBHGTK-QGZVFWFLSA-N 0 1 321.509 4.374 20 0 DIADMN CCCCC[C@@H](CCC)N1Cc2cnn(CC)c2[C@H](COC)C1 ZINC001258669270 1063737502 /nfs/dbraw/zinc/73/75/02/1063737502.db2.gz KBUAPDMVHOAVNB-ZWKOTPCHSA-N 0 1 321.509 4.198 20 0 DIADMN CCCCC[C@H](CCC)N1Cc2cnn(CC)c2[C@@H](COC)C1 ZINC001258669267 1063738936 /nfs/dbraw/zinc/73/89/36/1063738936.db2.gz KBUAPDMVHOAVNB-MSOLQXFVSA-N 0 1 321.509 4.198 20 0 DIADMN CCCN(Cc1c(F)cc(Br)cc1F)CC1CC1 ZINC001461847068 1063749039 /nfs/dbraw/zinc/74/90/39/1063749039.db2.gz SLSQBLNFOVBQCT-UHFFFAOYSA-N 0 1 318.205 4.349 20 0 DIADMN Cc1ccc(C[C@@H]2CCCN(Cc3cc(F)ncc3F)C2)cc1 ZINC001461848581 1063749147 /nfs/dbraw/zinc/74/91/47/1063749147.db2.gz WYMYUBAFSGTTQB-INIZCTEOSA-N 0 1 316.395 4.123 20 0 DIADMN Cc1ccc(CN(Cc2c(C3CC3)cnn2C)C2CC2)cc1C ZINC001461857684 1063751042 /nfs/dbraw/zinc/75/10/42/1063751042.db2.gz DPMOKGVVZDDNGQ-UHFFFAOYSA-N 0 1 309.457 4.079 20 0 DIADMN CCCC[C@H](Cc1ccccc1)n1c2ccccc2nc1CN ZINC001258701522 1063760029 /nfs/dbraw/zinc/76/00/29/1063760029.db2.gz JHZJZCCMWFLZEY-QGZVFWFLSA-N 0 1 307.441 4.469 20 0 DIADMN Cc1n[nH]c(CN(C)C2c3ccccc3-c3ccccc32)c1C ZINC001461871525 1063762295 /nfs/dbraw/zinc/76/22/95/1063762295.db2.gz RBBCTIXHZFTJDT-UHFFFAOYSA-N 0 1 303.409 4.228 20 0 DIADMN CCCC[C@H](Cc1ccccc1)NCc1nccc(Cl)n1 ZINC001258708033 1063766516 /nfs/dbraw/zinc/76/65/16/1063766516.db2.gz QSVRYBFTTGJRJE-OAHLLOKOSA-N 0 1 303.837 4.021 20 0 DIADMN CC[C@]1(C)CCCN(Cc2nnn(-c3ccccc3)c2C2CC2)C1 ZINC001461878423 1063769927 /nfs/dbraw/zinc/76/99/27/1063769927.db2.gz SDUQSZYNWOMBDW-HXUWFJFHSA-N 0 1 324.472 4.157 20 0 DIADMN CCN(Cc1cccnc1N)[C@H](C)c1cccc(C(F)(F)F)c1 ZINC001461877310 1063770644 /nfs/dbraw/zinc/77/06/44/1063770644.db2.gz VZWICGXDUKRBKQ-GFCCVEGCSA-N 0 1 323.362 4.266 20 0 DIADMN CCN(Cc1c(C)nn(C(C)C)c1C)Cc1ccc(OC)cc1 ZINC001461893691 1063781088 /nfs/dbraw/zinc/78/10/88/1063781088.db2.gz BUBVKNFYHUTGDB-UHFFFAOYSA-N 0 1 315.461 4.112 20 0 DIADMN CCOC(=O)C1(N(C)Cc2cccc3ccoc32)CCCCC1 ZINC001461911400 1063794616 /nfs/dbraw/zinc/79/46/16/1063794616.db2.gz HCMNFOFEMMIASQ-UHFFFAOYSA-N 0 1 315.413 4.131 20 0 DIADMN Clc1cc2c(c(CN3CC[C@H]3Cc3ccccc3)c1)OCC2 ZINC001461914294 1063798411 /nfs/dbraw/zinc/79/84/11/1063798411.db2.gz MPFNUMPCGIISJM-SFHVURJKSA-N 0 1 313.828 4.092 20 0 DIADMN CCO[C@H]1C[C@H](N(C)Cc2cncn2C(C)C)C12CCCCC2 ZINC001461918867 1063799427 /nfs/dbraw/zinc/79/94/27/1063799427.db2.gz CZQUEURQMXDHAF-ROUUACIJSA-N 0 1 319.493 4.024 20 0 DIADMN C[C@@H]1CN(Cc2cccc3c2CCC3)[C@@H](c2ccccc2)CO1 ZINC001461920465 1063801156 /nfs/dbraw/zinc/80/11/56/1063801156.db2.gz CRZWIUNAMOXNJK-IIBYNOLFSA-N 0 1 307.437 4.137 20 0 DIADMN Cc1ccccc1[C@@H]1CN(Cc2ccc3c(c2)CCCC3)CCO1 ZINC001461928560 1063814688 /nfs/dbraw/zinc/81/46/88/1063814688.db2.gz VBWQSESFKAKDBJ-QFIPXVFZSA-N 0 1 321.464 4.447 20 0 DIADMN Cc1ccc(-c2nnc(-c3cc(-c4ccccc4)n[nH]3)o2)cc1F ZINC001258772924 1063816590 /nfs/dbraw/zinc/81/65/90/1063816590.db2.gz PLCFJZJUVDSFAS-UHFFFAOYSA-N 0 1 320.327 4.241 20 0 DIADMN Cc1cccc(N2CCN(C/C=C\c3cccc(F)c3)CC2)c1C ZINC001461931221 1063816763 /nfs/dbraw/zinc/81/67/63/1063816763.db2.gz FJOWDQRLGWQCMK-YVMONPNESA-N 0 1 324.443 4.278 20 0 DIADMN Cc1ccccc1[C@@H]1C[C@@H](C)N(Cc2nc(Cl)cs2)C1 ZINC001461944954 1063829759 /nfs/dbraw/zinc/82/97/59/1063829759.db2.gz XQOXOVVLTXWCIJ-CHWSQXEVSA-N 0 1 306.862 4.483 20 0 DIADMN C[C@@H]1CN(Cc2c(Cl)cc(Cl)cc2N(C)C)C[C@H]1C ZINC001461964912 1063845261 /nfs/dbraw/zinc/84/52/61/1063845261.db2.gz YJMNLJKBLGCBHF-GHMZBOCLSA-N 0 1 301.261 4.147 20 0 DIADMN CCN(Cc1ccnn1CC(C)C)[C@@H](C)c1cccc(OC)c1 ZINC001461961807 1063840667 /nfs/dbraw/zinc/84/06/67/1063840667.db2.gz CKRIBIBFEWKEHW-INIZCTEOSA-N 0 1 315.461 4.131 20 0 DIADMN CCN(Cc1cnn(C)c1C1CC1)Cc1ccc2ccccc2c1 ZINC001461960676 1063841961 /nfs/dbraw/zinc/84/19/61/1063841961.db2.gz BBBNIZGKFMWHKX-UHFFFAOYSA-N 0 1 319.452 4.473 20 0 DIADMN CCCCN(Cc1c2c(nn1C)CCC2)[C@@H](C)c1ccc(C)o1 ZINC001461966203 1063844314 /nfs/dbraw/zinc/84/43/14/1063844314.db2.gz XVQJQLZVHKMDTC-HNNXBMFYSA-N 0 1 315.461 4.174 20 0 DIADMN COc1cccc2c(CN3CCC[C@H]3c3cc(C)on3)cccc12 ZINC001461967053 1063846596 /nfs/dbraw/zinc/84/65/96/1063846596.db2.gz ZISFMDOXSPEMDR-IBGZPJMESA-N 0 1 322.408 4.482 20 0 DIADMN Cc1ccccc1[C@@H]1CCN(Cc2c(Cl)ccnc2F)C1 ZINC001461976951 1063854857 /nfs/dbraw/zinc/85/48/57/1063854857.db2.gz BCIBKGVCWMSPDX-CYBMUJFWSA-N 0 1 304.796 4.172 20 0 DIADMN Cc1ccnc(CN2CC[C@@H](CC(C)C)C2)c1Br ZINC001461983574 1063859016 /nfs/dbraw/zinc/85/90/16/1063859016.db2.gz PFPHSSQOAUUDCW-ZDUSSCGKSA-N 0 1 311.267 4.021 20 0 DIADMN Cc1ccnc(CN2CC[C@H](CC(C)C)C2)c1Br ZINC001461983572 1063859612 /nfs/dbraw/zinc/85/96/12/1063859612.db2.gz PFPHSSQOAUUDCW-CYBMUJFWSA-N 0 1 311.267 4.021 20 0 DIADMN CC[C@@H](Cc1ccccc1)n1c(-c2ccccc2)cnc1CN ZINC001258844518 1063865506 /nfs/dbraw/zinc/86/55/06/1063865506.db2.gz RYWPUXAKFSLEPG-SFHVURJKSA-N 0 1 305.425 4.203 20 0 DIADMN C[C@H]1Cc2cc(CN(C)Cc3ccc(Cl)s3)ccc2O1 ZINC001462018888 1063880432 /nfs/dbraw/zinc/88/04/32/1063880432.db2.gz GHQXVLVUNZIUNK-NSHDSACASA-N 0 1 307.846 4.357 20 0 DIADMN Cc1ccc(S(=O)(=O)Nc2csc3ccccc23)cc1C ZINC001259162934 1063885598 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/nfs/dbraw/zinc/33/25/69/338332569.db2.gz DPHZUSJBQGNULK-WBVHZDCISA-N 0 1 317.864 4.150 20 0 DIADMN COc1ccc(CN2CCCCC[C@H]2c2ccc(C)o2)cn1 ZINC000438118054 338333103 /nfs/dbraw/zinc/33/31/03/338333103.db2.gz PWZKFIFYUJHHIB-INIZCTEOSA-N 0 1 300.402 4.109 20 0 DIADMN C[C@H](O)C[C@H]1CCCN1Cc1cc(Cl)cc(C(F)(F)F)c1 ZINC000438125311 338333631 /nfs/dbraw/zinc/33/36/31/338333631.db2.gz WGXSBZJSAWFHSF-IINYFYTJSA-N 0 1 321.770 4.094 20 0 DIADMN CCC(CC)n1ccc(CN(C[C@H]2CCCO2)C2CCCC2)n1 ZINC000438194842 338335972 /nfs/dbraw/zinc/33/59/72/338335972.db2.gz YSQRKXHSASPURW-LJQANCHMSA-N 0 1 319.493 4.168 20 0 DIADMN Clc1ccc2nc([C@@H]3CCCN3Cc3ccco3)[nH]c2c1 ZINC000438261038 338338099 /nfs/dbraw/zinc/33/80/99/338338099.db2.gz PUQLIGVOJOPVFU-HNNXBMFYSA-N 0 1 301.777 4.146 20 0 DIADMN CC(C)[C@H]1CCCN(Cc2csc(-c3ccccn3)n2)C1 ZINC000438343120 338340345 /nfs/dbraw/zinc/34/03/45/338340345.db2.gz WGHRVAJEDFVWBJ-AWEZNQCLSA-N 0 1 301.459 4.073 20 0 DIADMN CC(C)CCn1cccc1CN[C@@H]1CCOc2c(F)cccc21 ZINC000438465866 338344600 /nfs/dbraw/zinc/34/46/00/338344600.db2.gz NLTNHPLPHYZMQD-GOSISDBHSA-N 0 1 316.420 4.287 20 0 DIADMN Cc1oc2ccccc2c1CN[C@@H]1CCOc2c(F)cccc21 ZINC000438484968 338345717 /nfs/dbraw/zinc/34/57/17/338345717.db2.gz KGVXTSWGOAFEFJ-QGZVFWFLSA-N 0 1 311.356 4.494 20 0 DIADMN CCn1nc(CN[C@@H](CC(F)(F)F)C(C)C)c2ccccc21 ZINC000438486157 338345736 /nfs/dbraw/zinc/34/57/36/338345736.db2.gz OJIOLDFHHCQNEO-ZDUSSCGKSA-N 0 1 313.367 4.123 20 0 DIADMN CCCOc1cccc(CN[C@@H]2CCOc3c(F)cccc32)c1 ZINC000438489532 338345913 /nfs/dbraw/zinc/34/59/13/338345913.db2.gz XWKRKTJMGCYDMF-GOSISDBHSA-N 0 1 315.388 4.228 20 0 DIADMN Cc1cc(C)c(NC(=O)[C@@H](C)N2CC[C@@H](C(C)C)C2)c(Cl)c1 ZINC000438493333 338346043 /nfs/dbraw/zinc/34/60/43/338346043.db2.gz VEJIOIWNEWJMIL-HUUCEWRRSA-N 0 1 322.880 4.262 20 0 DIADMN Cc1sc2[nH]c([C@H](C)N3CC[C@H](C(C)C)C3)nc(=O)c2c1C ZINC000438494302 338346075 /nfs/dbraw/zinc/34/60/75/338346075.db2.gz NKAKALJARHMOIJ-AAEUAGOBSA-N 0 1 319.474 4.053 20 0 DIADMN CCC(CC)n1ccc(CN(C)[C@H](C)Cc2ccc(O)cc2)n1 ZINC000438613587 338349947 /nfs/dbraw/zinc/34/99/47/338349947.db2.gz MPAYICVRTCSIQT-OAHLLOKOSA-N 0 1 315.461 4.013 20 0 DIADMN C[C@@H](N[C@@H](C)CC1CC1)c1noc(-c2ccc(Cl)cc2)n1 ZINC000438845984 338353635 /nfs/dbraw/zinc/35/36/35/338353635.db2.gz GSKMWFXTWALTBK-WDEREUQCSA-N 0 1 305.809 4.229 20 0 DIADMN Cc1ccc(-c2n[nH]c(SC[C@H](C)C(F)(F)F)n2)cc1 ZINC000439046303 338359487 /nfs/dbraw/zinc/35/94/87/338359487.db2.gz WYYLFVBLXFRPRM-VIFPVBQESA-N 0 1 301.337 4.071 20 0 DIADMN C[C@@H]1C[C@@H](c2ccccc2)CCN1Cc1cn2ccsc2n1 ZINC000439315523 338366959 /nfs/dbraw/zinc/36/69/59/338366959.db2.gz JHCJTGYGAQTOOA-ZBFHGGJFSA-N 0 1 311.454 4.164 20 0 DIADMN C[C@@H]1C[C@H](c2ccccc2)CCN1Cc1cn2ccsc2n1 ZINC000439315520 338367013 /nfs/dbraw/zinc/36/70/13/338367013.db2.gz JHCJTGYGAQTOOA-GDBMZVCRSA-N 0 1 311.454 4.164 20 0 DIADMN C[C@H]1C[C@H](c2ccccc2)CCN1Cc1nc2cccnc2s1 ZINC000439325111 338367406 /nfs/dbraw/zinc/36/74/06/338367406.db2.gz SYPVMQUGALKAOW-GOEBONIOSA-N 0 1 323.465 4.459 20 0 DIADMN CC[C@H](C)NC(=O)CCN[C@@H](C)c1cc(Cl)sc1Cl ZINC000156532135 338367900 /nfs/dbraw/zinc/36/79/00/338367900.db2.gz OXQCDJSCVPHOFH-IUCAKERBSA-N 0 1 323.289 4.010 20 0 DIADMN CO[C@H](C)c1nc(CNc2ccnc3cc(F)ccc32)cs1 ZINC000439604584 338374335 /nfs/dbraw/zinc/37/43/35/338374335.db2.gz RJPHAPAHZIUTOT-SNVBAGLBSA-N 0 1 317.389 4.150 20 0 DIADMN Cc1ccccc1CNCc1cccc(F)c1Br ZINC000156704069 338380398 /nfs/dbraw/zinc/38/03/98/338380398.db2.gz BOWRLSDHGGJRKY-UHFFFAOYSA-N 0 1 308.194 4.186 20 0 DIADMN CC[C@H](F)CN[C@@H](Cc1ccc(Cl)cc1)c1ccccn1 ZINC000440497647 338388549 /nfs/dbraw/zinc/38/85/49/338388549.db2.gz WCYKOINIUJVIRH-RDJZCZTQSA-N 0 1 306.812 4.357 20 0 DIADMN Cc1ccc(Oc2ccccc2)c(NC(=O)CN(C)C(C)C)c1 ZINC000440614898 338392533 /nfs/dbraw/zinc/39/25/33/338392533.db2.gz BFIIJVRFGCMTIP-UHFFFAOYSA-N 0 1 312.413 4.066 20 0 DIADMN c1n[nH]c2c1CCC[C@@H]2Nc1ncnc2sc3ccccc3c21 ZINC000440667269 338394778 /nfs/dbraw/zinc/39/47/78/338394778.db2.gz IECQVRSYUMLJHP-LBPRGKRZSA-N 0 1 321.409 4.057 20 0 DIADMN CC(C)[C@@H](C)C(=O)N1CCC[C@@H]1c1nc2ccc(Cl)cc2[nH]1 ZINC000440748811 338396494 /nfs/dbraw/zinc/39/64/94/338396494.db2.gz PLYWEBPFJLBWEE-IAQYHMDHSA-N 0 1 319.836 4.172 20 0 DIADMN CC(C)[C@@H](C)C(=O)N1CCC[C@H]1c1nc2ccc(Cl)cc2[nH]1 ZINC000440748810 338396571 /nfs/dbraw/zinc/39/65/71/338396571.db2.gz PLYWEBPFJLBWEE-ABAIWWIYSA-N 0 1 319.836 4.172 20 0 DIADMN CSc1ccccc1[C@H](C)NCc1cnc2cc(C)ccn12 ZINC000441336843 338409163 /nfs/dbraw/zinc/40/91/63/338409163.db2.gz TUVMOSVSBWYCKH-AWEZNQCLSA-N 0 1 311.454 4.215 20 0 DIADMN CC[C@@H](NCc1ccncc1OCC(F)F)c1ccc(F)cc1 ZINC000442088746 338421211 /nfs/dbraw/zinc/42/12/11/338421211.db2.gz ACBOYCHHRWWJPH-OAHLLOKOSA-N 0 1 324.346 4.106 20 0 DIADMN Cc1nc(-c2ccc(CN[C@H](C)c3cccc(O)c3)o2)cs1 ZINC000442645441 338426668 /nfs/dbraw/zinc/42/66/68/338426668.db2.gz INRKILWXKVPXKM-LLVKDONJSA-N 0 1 314.410 4.268 20 0 DIADMN Cc1cncc(CN2CCC(c3c(F)cccc3F)CC2)c1 ZINC000442890602 338438617 /nfs/dbraw/zinc/43/86/17/338438617.db2.gz 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0 1 304.365 4.425 20 0 DIADMN C[C@H](CCCC(F)(F)F)NCc1cc(COC(C)(C)C)on1 ZINC000485702048 339710081 /nfs/dbraw/zinc/71/00/81/339710081.db2.gz AAUNVHWHULGREJ-LLVKDONJSA-N 0 1 322.371 4.200 20 0 DIADMN CCc1cnc(CNC[C@H](c2ccccc2)C(F)(F)F)s1 ZINC000485732055 339711661 /nfs/dbraw/zinc/71/16/61/339711661.db2.gz LUEFAUMICRAIBM-CYBMUJFWSA-N 0 1 314.376 4.141 20 0 DIADMN C[C@@H](N[C@@H](C)C(=O)N1[C@H](C)CCC[C@@H]1C)c1ccccc1Cl ZINC000485926474 339716385 /nfs/dbraw/zinc/71/63/85/339716385.db2.gz QPBXMJHOHRCXPI-BARDWOONSA-N 0 1 322.880 4.169 20 0 DIADMN Brc1ccc2c(c1)[C@@H](NCc1ccccc1)CS2 ZINC000486811007 339735513 /nfs/dbraw/zinc/73/55/13/339735513.db2.gz SUEXLXDGNJSJBJ-AWEZNQCLSA-N 0 1 320.255 4.386 20 0 DIADMN Fc1cccc2c1CC[C@H]2NCc1cnc(-c2ccco2)s1 ZINC000486974337 339740967 /nfs/dbraw/zinc/74/09/67/339740967.db2.gz WZPJUAXIAHVBDE-OAHLLOKOSA-N 0 1 314.385 4.319 20 0 DIADMN CC(C)(C)[C@@H]1C[C@H](Nc2ccnc3cc(F)ccc32)CCO1 ZINC000487180644 339745522 /nfs/dbraw/zinc/74/55/22/339745522.db2.gz 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340020963 /nfs/dbraw/zinc/02/09/63/340020963.db2.gz ARMHRHCIXULSDM-FQEVSTJZSA-N 0 1 322.452 4.413 20 0 DIADMN FC(F)[C@@H](CCc1ccccc1)NC1CCC(F)(F)CC1 ZINC000498771511 340023079 /nfs/dbraw/zinc/02/30/79/340023079.db2.gz TXXGEXKAQKJGNH-CQSZACIVSA-N 0 1 303.343 4.420 20 0 DIADMN COC[C@@H]1CCCN([C@@H](C)c2ccc(Cl)c(Cl)c2)C1 ZINC000499144987 340031205 /nfs/dbraw/zinc/03/12/05/340031205.db2.gz DVEDPTAZIGUTFH-NWDGAFQWSA-N 0 1 302.245 4.413 20 0 DIADMN CCC[C@](C)(O)CN[C@@H](c1cc2ccccc2o1)c1cccnc1 ZINC000498916710 340025874 /nfs/dbraw/zinc/02/58/74/340025874.db2.gz LGYOVMZGVODUCN-UXHICEINSA-N 0 1 324.424 4.058 20 0 DIADMN C[C@H](c1nc(-c2ccccc2)no1)N1CCCc2ccccc2C1 ZINC000498922333 340025976 /nfs/dbraw/zinc/02/59/76/340025976.db2.gz BYVYGJOWTQQMLL-OAHLLOKOSA-N 0 1 319.408 4.246 20 0 DIADMN CC[C@H](N[C@@H](CCc1ccccc1)C(F)F)C1CCOCC1 ZINC000498932612 340026448 /nfs/dbraw/zinc/02/64/48/340026448.db2.gz WBHHCDSELMKYDT-IRXDYDNUSA-N 0 1 311.416 4.048 20 0 DIADMN CCN(Cc1ccccc1)Cc1ccc(Oc2ccccc2)nn1 ZINC000498953409 340026893 /nfs/dbraw/zinc/02/68/93/340026893.db2.gz AMERXVXGWKANAN-UHFFFAOYSA-N 0 1 319.408 4.291 20 0 DIADMN c1c2ccccc2oc1[C@H](NC[C@@H]1CCCS1)c1cccnc1 ZINC000498951413 340026900 /nfs/dbraw/zinc/02/69/00/340026900.db2.gz MCEJYGTTWYTGID-QFBILLFUSA-N 0 1 324.449 4.402 20 0 DIADMN COC[C@H]1CCCN([C@H](C)c2ccc(Cl)cc2Cl)C1 ZINC000499046679 340028340 /nfs/dbraw/zinc/02/83/40/340028340.db2.gz YSUCOCVDNYJUMD-NEPJUHHUSA-N 0 1 302.245 4.413 20 0 DIADMN COC[C@H]1CCCN([C@H](C)c2ccc(Cl)c(Cl)c2)C1 ZINC000499144986 340031147 /nfs/dbraw/zinc/03/11/47/340031147.db2.gz DVEDPTAZIGUTFH-NEPJUHHUSA-N 0 1 302.245 4.413 20 0 DIADMN Cc1cccc(Oc2ccccc2NC(=O)CN(C)C(C)C)c1 ZINC000499816790 340045163 /nfs/dbraw/zinc/04/51/63/340045163.db2.gz NFNGGSZBILATNG-UHFFFAOYSA-N 0 1 312.413 4.066 20 0 DIADMN Clc1ccc(CN2CCC[C@H](Oc3ccccc3)C2)s1 ZINC000500169727 340051916 /nfs/dbraw/zinc/05/19/16/340051916.db2.gz GJZJKQDKGLVWCQ-AWEZNQCLSA-N 0 1 307.846 4.445 20 0 DIADMN Fc1ccc(CN2CCC[C@@H](Oc3ccccc3)C2)cc1F 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C[C@H]1C[C@@]1(NCc1cccc2c1OCO2)c1ccc(Cl)cc1 ZINC000500417620 340057646 /nfs/dbraw/zinc/05/76/46/340057646.db2.gz ULJVIGCFDDCLQR-SGTLLEGYSA-N 0 1 315.800 4.094 20 0 DIADMN C[C@@H]1C[C@@]1(NCc1cnn(C(C)(C)C)c1)c1ccc(Cl)cc1 ZINC000500452844 340059223 /nfs/dbraw/zinc/05/92/23/340059223.db2.gz SHZRTFSKHCUGQD-ACJLOTCBSA-N 0 1 317.864 4.316 20 0 DIADMN C[C@H]1C[C@@]1(NCc1cnn(C(C)(C)C)c1)c1ccc(Cl)cc1 ZINC000500452847 340059254 /nfs/dbraw/zinc/05/92/54/340059254.db2.gz SHZRTFSKHCUGQD-UGSOOPFHSA-N 0 1 317.864 4.316 20 0 DIADMN Cc1nc(C)c(CN[C@@]2(c3ccc(Cl)cc3)C[C@@H]2C)s1 ZINC000500461909 340059369 /nfs/dbraw/zinc/05/93/69/340059369.db2.gz KTSFIXAOVWOUEJ-QFYYESIMSA-N 0 1 306.862 4.438 20 0 DIADMN CCc1ncc(CN[C@@]2(c3cccc(C)c3)C[C@@H]2CC)s1 ZINC000500488150 340060456 /nfs/dbraw/zinc/06/04/56/340060456.db2.gz XBYLPYWEAOESCD-KSSFIOAISA-N 0 1 300.471 4.429 20 0 DIADMN CC[C@H]1C[C@]1(NCc1cnn(C(C)(C)C)c1)c1cccc(C)c1 ZINC000500506334 340061041 /nfs/dbraw/zinc/06/10/41/340061041.db2.gz 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340088240 /nfs/dbraw/zinc/08/82/40/340088240.db2.gz NQHVIDWCJDHKSQ-ZIAGYGMSSA-N 0 1 316.470 4.297 20 0 DIADMN c1cc2c(s1)CCN(CCOc1ccc3ccccc3c1)C2 ZINC000501877954 340090258 /nfs/dbraw/zinc/09/02/58/340090258.db2.gz WBSRKQXTNLSYCR-UHFFFAOYSA-N 0 1 309.434 4.338 20 0 DIADMN CC(C)COCCN(CCC(F)(F)F)Cc1ccccc1 ZINC000501954896 340091415 /nfs/dbraw/zinc/09/14/15/340091415.db2.gz SUTCRMUCFDDVJZ-UHFFFAOYSA-N 0 1 303.368 4.114 20 0 DIADMN Cc1cccc([C@H](Nc2ccnc(C)c2Cl)c2ccccn2)c1 ZINC000501991418 340092138 /nfs/dbraw/zinc/09/21/38/340092138.db2.gz UBXWHPDIUFZHJG-IBGZPJMESA-N 0 1 323.827 4.370 20 0 DIADMN CCCn1nccc1C1CCN(Cc2ccsc2Cl)CC1 ZINC000502322865 340099821 /nfs/dbraw/zinc/09/98/21/340099821.db2.gz SGKDOPJEVJQVEW-UHFFFAOYSA-N 0 1 323.893 4.388 20 0 DIADMN CC(C)(C)C1=CCN(C(=O)c2[nH]nc3ccc(Cl)cc32)CC1 ZINC000502334215 340100098 /nfs/dbraw/zinc/10/00/98/340100098.db2.gz DHEJJHRFOWOYJJ-UHFFFAOYSA-N 0 1 317.820 4.035 20 0 DIADMN C[C@@H](NC1(c2ccc(F)cc2)CC1)c1cnn(C2CCCC2)c1 ZINC000502391318 340101537 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DVXHZUNICCXZRB-CYBMUJFWSA-N 0 1 324.321 4.229 20 0 DIADMN CCc1nocc1CN1CCC(F)(c2ccc(Cl)cc2)CC1 ZINC000513460391 1042544475 /nfs/dbraw/zinc/54/44/75/1042544475.db2.gz FBKLEUVQDMRYHX-UHFFFAOYSA-N 0 1 322.811 4.351 20 0 DIADMN Cc1cscc1CNCc1csc(Br)c1 ZINC000087309353 1042545557 /nfs/dbraw/zinc/54/55/57/1042545557.db2.gz MSAHHVFHHROTAQ-UHFFFAOYSA-N 0 1 302.262 4.170 20 0 DIADMN C[C@@H](Cc1ccc(O)cc1)Nc1ccc(Cl)c(CN(C)C)c1 ZINC000513479667 1042547349 /nfs/dbraw/zinc/54/73/49/1042547349.db2.gz POMNFSZPWXYUSN-ZDUSSCGKSA-N 0 1 318.848 4.150 20 0 DIADMN CC(C)n1nccc1CNCc1ccc(OC2CCCC2)cc1 ZINC000280227693 1042568122 /nfs/dbraw/zinc/56/81/22/1042568122.db2.gz JIIFTQPEHBXAOU-UHFFFAOYSA-N 0 1 313.445 4.075 20 0 DIADMN CO[C@]1(C)CCCN(Cc2csc(-c3ccsc3)n2)CC1 ZINC000280322086 1042571068 /nfs/dbraw/zinc/57/10/68/1042571068.db2.gz QLWFVLXHCIYNDG-MRXNPFEDSA-N 0 1 322.499 4.263 20 0 DIADMN Cc1ccc([C@H]2CCN([C@H](C)c3nc(C4CC4)no3)C2)c(C)c1 ZINC000280449807 1042573415 /nfs/dbraw/zinc/57/34/15/1042573415.db2.gz 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/nfs/dbraw/zinc/60/76/00/1042607600.db2.gz VGDDATPXVWUADN-JTQLQIEISA-N 0 1 311.838 4.389 20 0 DIADMN C[C@@H](c1cc(Cl)ccc1Cl)N1C[C@H](C)C[C@H](CO)C1 ZINC000420931375 1042615382 /nfs/dbraw/zinc/61/53/82/1042615382.db2.gz DCHRCGJZXBFYIW-WOPDTQHZSA-N 0 1 302.245 4.005 20 0 DIADMN Fc1cccc2[nH]c(CN3CCSC4(CCC4)CC3)cc21 ZINC000414481197 1042616988 /nfs/dbraw/zinc/61/69/88/1042616988.db2.gz VOUNNAMYANQXCS-UHFFFAOYSA-N 0 1 304.434 4.169 20 0 DIADMN CCn1ccc(CNC/C(C)=C\c2ccccc2C(F)(F)F)n1 ZINC000414485353 1042618787 /nfs/dbraw/zinc/61/87/87/1042618787.db2.gz RLHNWECRPWYLEL-RAXLEYEMSA-N 0 1 323.362 4.115 20 0 DIADMN COC(=O)c1cc(CNCc2ccc(C)c3ccccc23)oc1C ZINC000414483466 1042618878 /nfs/dbraw/zinc/61/88/78/1042618878.db2.gz OKHFBNHVBLQNNB-UHFFFAOYSA-N 0 1 323.392 4.126 20 0 DIADMN CC1(C)[C@@H](c2ccccc2)CCN1Cc1nccn1C(F)F ZINC000421016418 1042622461 /nfs/dbraw/zinc/62/24/61/1042622461.db2.gz JCAUEQPFQJRIPP-CQSZACIVSA-N 0 1 305.372 4.046 20 0 DIADMN CC(C)Oc1cccc(CNCc2cnccc2C(C)(C)C)c1 ZINC000414494263 1042624261 /nfs/dbraw/zinc/62/42/61/1042624261.db2.gz DORTZDYGLTUJIG-UHFFFAOYSA-N 0 1 312.457 4.456 20 0 DIADMN COCc1ccccc1/C=C(/C)CN[C@@H](C)c1nccs1 ZINC000414497580 1042624813 /nfs/dbraw/zinc/62/48/13/1042624813.db2.gz UATRMFQGUHJIGA-ZVHGMHCTSA-N 0 1 302.443 4.044 20 0 DIADMN CC(C)(C)c1ccncc1CNCc1cccc(OC(F)F)c1 ZINC000414499816 1042625526 /nfs/dbraw/zinc/62/55/26/1042625526.db2.gz PGUZLZWVRVAHNG-UHFFFAOYSA-N 0 1 320.383 4.270 20 0 DIADMN CCCCOc1cc(CN[C@@H](C)c2cccnc2)ccc1OC ZINC000072672026 1042627093 /nfs/dbraw/zinc/62/70/93/1042627093.db2.gz GCXGTXUCOWLXPZ-HNNXBMFYSA-N 0 1 314.429 4.120 20 0 DIADMN Cc1cc(CN[C@@H](C)c2ccccc2Br)cc(C)n1 ZINC000421204701 1042628013 /nfs/dbraw/zinc/62/80/13/1042628013.db2.gz RRYLEUBEXYZLOC-ZDUSSCGKSA-N 0 1 319.246 4.312 20 0 DIADMN COc1ccc(CN[C@@H](CC(F)F)c2ccccc2)c(OC)c1 ZINC000421367225 1042632613 /nfs/dbraw/zinc/63/26/13/1042632613.db2.gz DHCNMHNIYRWCMX-INIZCTEOSA-N 0 1 321.367 4.190 20 0 DIADMN CC(C)N(Cc1cnc(C2CC2)nc1)[C@H](C)c1ccsc1 ZINC000421378660 1042634250 /nfs/dbraw/zinc/63/42/50/1042634250.db2.gz VNKGHFRIMCZLEY-CYBMUJFWSA-N 0 1 301.459 4.387 20 0 DIADMN CC(C)N(Cc1ccc([S@](C)=O)cc1)[C@H](C)c1ccsc1 ZINC000421380637 1042634336 /nfs/dbraw/zinc/63/43/36/1042634336.db2.gz YQWOAWQWOMORND-SZNDQCEHSA-N 0 1 321.511 4.457 20 0 DIADMN Cc1cc(CNCc2cc(C(F)(F)F)ccc2F)cc(C)n1 ZINC000421386040 1042635260 /nfs/dbraw/zinc/63/52/60/1042635260.db2.gz QXPWRQQYXPJOEP-UHFFFAOYSA-N 0 1 312.310 4.146 20 0 DIADMN COc1ccc(CNCc2cc(Cl)cc(Cl)c2)cc1F ZINC000237212598 1042637122 /nfs/dbraw/zinc/63/71/22/1042637122.db2.gz BSNJGUFXISHIKC-UHFFFAOYSA-N 0 1 314.187 4.431 20 0 DIADMN COc1cccc(SC)c1NC(=O)c1ccc(Cl)cc1O ZINC001626742340 1042652613 /nfs/dbraw/zinc/65/26/13/1042652613.db2.gz YCCFYCZJXJKDRI-UHFFFAOYSA-N 0 1 323.801 4.028 20 0 DIADMN COc1cc(Cl)ccc1[C@H](C)NCc1cccc(N(C)C)c1 ZINC000421825013 1042653250 /nfs/dbraw/zinc/65/32/50/1042653250.db2.gz LHRKXRBKWPZDKV-ZDUSSCGKSA-N 0 1 318.848 4.265 20 0 DIADMN COc1ccc([C@@H](NCc2cnc(C)s2)C(C)C)c(F)c1 ZINC000421825416 1042654363 /nfs/dbraw/zinc/65/43/63/1042654363.db2.gz NMLHOQXAEANDMH-INIZCTEOSA-N 0 1 308.422 4.086 20 0 DIADMN COC1([C@@H](C)NCc2coc(-c3ccccc3)n2)CCCCC1 ZINC000421830684 1042654789 /nfs/dbraw/zinc/65/47/89/1042654789.db2.gz KCSCWPMNHDNQAD-OAHLLOKOSA-N 0 1 314.429 4.169 20 0 DIADMN COc1cc(Cl)ccc1[C@H](C)NCc1ccc2c(c1)COC2 ZINC000421846716 1042659545 /nfs/dbraw/zinc/65/95/45/1042659545.db2.gz UJRNTXPMTCBLHW-LBPRGKRZSA-N 0 1 317.816 4.230 20 0 DIADMN COc1ccc([C@@H](C)N[C@H](CC(F)F)c2ccccc2)cc1O ZINC000421886698 1042661070 /nfs/dbraw/zinc/66/10/70/1042661070.db2.gz VHTKEMVSPUXOGP-IUODEOHRSA-N 0 1 321.367 4.448 20 0 DIADMN COc1cccc2cc([C@@H](C)NCc3cc(C)nc(C)c3)oc21 ZINC000421896431 1042662280 /nfs/dbraw/zinc/66/22/80/1042662280.db2.gz ZMPDUPQPJGQOSN-CQSZACIVSA-N 0 1 310.397 4.304 20 0 DIADMN CCOc1ccccc1[C@H](CC)NCc1ccnn1C(C)C ZINC000280769770 1042665309 /nfs/dbraw/zinc/66/53/09/1042665309.db2.gz DYUNVNUIUYWUGM-KRWDZBQOSA-N 0 1 301.434 4.104 20 0 DIADMN Cc1ccc2c(c1)CC[C@H]2N[C@H](C)c1nc2ccccc2n1C ZINC000271706003 1042666589 /nfs/dbraw/zinc/66/65/89/1042666589.db2.gz MBWPJMOLJKWWAX-RHSMWYFYSA-N 0 1 305.425 4.220 20 0 DIADMN CCc1noc(C)c1CN[C@H](CC)c1ccc(OC(F)F)cc1 ZINC000271780494 1042667899 /nfs/dbraw/zinc/66/78/99/1042667899.db2.gz KUQCVVPOKZATTK-OAHLLOKOSA-N 0 1 324.371 4.388 20 0 DIADMN Cc1ccc2nc(CN[C@H](c3ccc(F)cc3)C3CC3)cn2c1 ZINC000271788101 1042668430 /nfs/dbraw/zinc/66/84/30/1042668430.db2.gz WJXKSGUJUOGZKP-IBGZPJMESA-N 0 1 309.388 4.023 20 0 DIADMN CCc1noc(C)c1CN[C@@H](C)c1ccc(OC(C)C)cc1 ZINC000271803151 1042668655 /nfs/dbraw/zinc/66/86/55/1042668655.db2.gz SHVUJZKCUSAYJL-ZDUSSCGKSA-N 0 1 302.418 4.183 20 0 DIADMN CCn1cc(CN[C@@H](c2ccc(Cl)c(Cl)c2)C2CC2)cn1 ZINC000271800718 1042668724 /nfs/dbraw/zinc/66/87/24/1042668724.db2.gz XQMJSXMZPHELTQ-MRXNPFEDSA-N 0 1 324.255 4.451 20 0 DIADMN CCc1noc(C)c1CN[C@H](C)c1ccc(OC(C)C)cc1 ZINC000271803147 1042668785 /nfs/dbraw/zinc/66/87/85/1042668785.db2.gz SHVUJZKCUSAYJL-CYBMUJFWSA-N 0 1 302.418 4.183 20 0 DIADMN Cc1ccncc1CNC1(c2ccc(F)cc2F)CCCC1 ZINC000271835251 1042669493 /nfs/dbraw/zinc/66/94/93/1042669493.db2.gz YAPBOUJUFUYYHG-UHFFFAOYSA-N 0 1 302.368 4.227 20 0 DIADMN Cc1nc([C@@H](C)N[C@H]2CCN(c3ccc(Cl)cc3)C2)cs1 ZINC000271845174 1042670488 /nfs/dbraw/zinc/67/04/88/1042670488.db2.gz BZANNBWCVQFBOW-RISCZKNCSA-N 0 1 321.877 4.034 20 0 DIADMN CO[C@H](c1ccccc1F)[C@H](C)N[C@H](C)c1cccnc1Cl ZINC000271857116 1042671250 /nfs/dbraw/zinc/67/12/50/1042671250.db2.gz JOFFWZARLXMASY-WQGACYEGSA-N 0 1 322.811 4.301 20 0 DIADMN C[C@H](NC1(c2ccc(Cl)c(Cl)c2)CC1)c1cnn(C)c1 ZINC000271927058 1042672866 /nfs/dbraw/zinc/67/28/66/1042672866.db2.gz CKKWQHIOEOZPKG-JTQLQIEISA-N 0 1 310.228 4.067 20 0 DIADMN O=C(c1cccc(F)c1O)N1CCCC2(CCCCC2)CC1 ZINC001269281843 1042679489 /nfs/dbraw/zinc/67/94/89/1042679489.db2.gz LJVXXCAKCNGGLW-UHFFFAOYSA-N 0 1 305.393 4.108 20 0 DIADMN Cc1cccnc1[C@H](NCc1nccc2ccccc21)C(C)C ZINC000894269084 1042680881 /nfs/dbraw/zinc/68/08/81/1042680881.db2.gz MPHXDLDDIIPVPH-LJQANCHMSA-N 0 1 305.425 4.425 20 0 DIADMN C[N@@H+](CC1CCCC1)[C@H](C(=O)[O-])c1cccc(Cl)c1Cl ZINC000577381494 1042681303 /nfs/dbraw/zinc/68/13/03/1042681303.db2.gz YVGXCOUSJHRGIN-AWEZNQCLSA-N 0 1 316.228 4.241 20 0 DIADMN C[C@@H](NCc1ccc2c(c1)CCCN2)c1cccc(F)c1F ZINC000423449193 1042712647 /nfs/dbraw/zinc/71/26/47/1042712647.db2.gz RAKJZNOOHXEVMG-GFCCVEGCSA-N 0 1 302.368 4.174 20 0 DIADMN Cc1cc(N)cc(CN[C@@H](C)c2ccc(F)cc2OC(F)F)c1 ZINC000423470563 1042714732 /nfs/dbraw/zinc/71/47/32/1042714732.db2.gz CZPHLRCTLMBBOM-NSHDSACASA-N 0 1 324.346 4.169 20 0 DIADMN COc1ccc([C@@H](C)NCc2cc(F)cc(OC)c2)c(Cl)c1 ZINC000424296169 1042732509 /nfs/dbraw/zinc/73/25/09/1042732509.db2.gz YNRLSAHMEJQLPV-LLVKDONJSA-N 0 1 323.795 4.347 20 0 DIADMN C/C(=C/c1ccccc1Cl)c1nc(C2(N)CCCCC2)no1 ZINC000424333752 1042734505 /nfs/dbraw/zinc/73/45/05/1042734505.db2.gz DPDHBBDGSIPNGX-QXMHVHEDSA-N 0 1 317.820 4.402 20 0 DIADMN C/C(=C\c1ccccc1Cl)c1nc(C2(N)CCCCC2)no1 ZINC000424333754 1042734652 /nfs/dbraw/zinc/73/46/52/1042734652.db2.gz DPDHBBDGSIPNGX-VAWYXSNFSA-N 0 1 317.820 4.402 20 0 DIADMN C[C@@H](Cc1cccc(Cl)c1)c1nc(C2(N)CCCCC2)no1 ZINC000424347470 1042735349 /nfs/dbraw/zinc/73/53/49/1042735349.db2.gz RKNORPGAECNIEI-LBPRGKRZSA-N 0 1 319.836 4.187 20 0 DIADMN C[C@@H](c1ccc(Cl)s1)c1nc(C2(N)CCCCC2)no1 ZINC000424351792 1042736093 /nfs/dbraw/zinc/73/60/93/1042736093.db2.gz ZTORMGCLPXVMQX-VIFPVBQESA-N 0 1 311.838 4.054 20 0 DIADMN C[C@H](CCc1cccc(F)c1)c1nc(C2(N)CCCCC2)no1 ZINC000424340742 1042737613 /nfs/dbraw/zinc/73/76/13/1042737613.db2.gz HJQONHKYZXFHGV-CYBMUJFWSA-N 0 1 317.408 4.063 20 0 DIADMN CC[C@@H](Cc1ccccc1C)c1nc([C@H](N)CC(C)C)no1 ZINC000424342709 1042738201 /nfs/dbraw/zinc/73/82/01/1042738201.db2.gz ZDPDTUDMIJBHDO-GOEBONIOSA-N 0 1 301.434 4.160 20 0 DIADMN COc1cc2ccnc(NCC[C@@]3(C)CC3(F)F)c2cc1OC ZINC000664398660 1042749523 /nfs/dbraw/zinc/74/95/23/1042749523.db2.gz OZAPFUFSHSMIHB-INIZCTEOSA-N 0 1 322.355 4.099 20 0 DIADMN 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ZINC000569127111 1044676773 /nfs/dbraw/zinc/67/67/73/1044676773.db2.gz YSXNHNGNFZZSAU-CQSZACIVSA-N 0 1 311.454 4.048 20 0 DIADMN CSc1ccc2c(c1)[C@@H](NCc1cc(C3CC3)no1)CCC2 ZINC000886684150 1044678747 /nfs/dbraw/zinc/67/87/47/1044678747.db2.gz GDKDYPPDZQZTER-KRWDZBQOSA-N 0 1 314.454 4.441 20 0 DIADMN CCCCc1noc([C@H](C)N2C[C@@H](c3ccccc3)C[C@@H]2C)n1 ZINC000523790516 1044685969 /nfs/dbraw/zinc/68/59/69/1044685969.db2.gz NVJRGEHKLBMTBB-ZOBUZTSGSA-N 0 1 313.445 4.351 20 0 DIADMN C[C@@H](c1cccs1)c1noc(-c2ccc(O)c(Cl)c2)n1 ZINC000445231537 1044686904 /nfs/dbraw/zinc/68/69/04/1044686904.db2.gz QCANPRSUCHQLAC-QMMMGPOBSA-N 0 1 306.774 4.309 20 0 DIADMN CCCC[C@H](CC)C[N@H+]1[C@H](C(=O)[O-])CC[C@H]1c1ccccc1 ZINC000569260587 1044687529 /nfs/dbraw/zinc/68/75/29/1044687529.db2.gz XKXADQADONDSHA-SZMVWBNQSA-N 0 1 303.446 4.493 20 0 DIADMN Oc1ccc(-c2nc(-c3cccc4cnccc43)no2)cc1Cl ZINC000445238015 1044690673 /nfs/dbraw/zinc/69/06/73/1044690673.db2.gz YOTDPYQBVXABJN-UHFFFAOYSA-N 0 1 323.739 4.311 20 0 DIADMN CN(CCc1cccs1)Cc1csc(-c2ccoc2)n1 ZINC000075966878 1044691260 /nfs/dbraw/zinc/69/12/60/1044691260.db2.gz UZSFTSQUJKGPIG-UHFFFAOYSA-N 0 1 304.440 4.139 20 0 DIADMN CCCCC[C@H]([NH2+]Cc1nnc(CSC)[n-]1)c1ccccc1 ZINC000886753547 1044693084 /nfs/dbraw/zinc/69/30/84/1044693084.db2.gz NQPSAOWQOVHZRX-HNNXBMFYSA-N 0 1 318.490 4.079 20 0 DIADMN CCCCC[C@@H]([NH2+]Cc1nnc(CSC)[n-]1)c1ccccc1 ZINC000886753548 1044693843 /nfs/dbraw/zinc/69/38/43/1044693843.db2.gz NQPSAOWQOVHZRX-OAHLLOKOSA-N 0 1 318.490 4.079 20 0 DIADMN CC[C@@H](c1ccc(Cl)cc1)N1CC[C@](CO)(C(F)(F)F)C1 ZINC000886796911 1044700332 /nfs/dbraw/zinc/70/03/32/1044700332.db2.gz LQXJEMJCIGGSDN-KBPBESRZSA-N 0 1 321.770 4.038 20 0 DIADMN CC[C@H](c1ccc(Cl)cc1)N1CC[C@@](CO)(C(F)(F)F)C1 ZINC000886796914 1044701187 /nfs/dbraw/zinc/70/11/87/1044701187.db2.gz LQXJEMJCIGGSDN-ZIAGYGMSSA-N 0 1 321.770 4.038 20 0 DIADMN Cc1ccc(-c2cccc(C[N@@H+]3CC[C@@H](C)[C@H](C(=O)[O-])C3)c2)cc1 ZINC000569723609 1044707747 /nfs/dbraw/zinc/70/77/47/1044707747.db2.gz 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/nfs/dbraw/zinc/71/93/07/1044719307.db2.gz JRGWOEWDXLNJOG-KRWDZBQOSA-N 0 1 308.491 4.192 20 0 DIADMN CC(C)(C)n1cc(CN[C@@H]2CCc3sc(Cl)cc32)cn1 ZINC000569916088 1044721567 /nfs/dbraw/zinc/72/15/67/1044721567.db2.gz AGMSBEOHBAHVBZ-GFCCVEGCSA-N 0 1 309.866 4.130 20 0 DIADMN CC[C@@H](CSC)N(C)Cc1ncc(-c2ccccc2)s1 ZINC000570031764 1044729410 /nfs/dbraw/zinc/72/94/10/1044729410.db2.gz LWQQMZVLPMTXRB-AWEZNQCLSA-N 0 1 306.500 4.384 20 0 DIADMN C[C@@H](C[N@@H+](C)Cc1c(Cl)cccc1C(=O)[O-])c1ccccc1 ZINC000570169235 1044737735 /nfs/dbraw/zinc/73/77/35/1044737735.db2.gz QBBWCRRTCOVNOK-ZDUSSCGKSA-N 0 1 317.816 4.274 20 0 DIADMN Cc1ccc(-c2n[nH]c(NC(=O)C3CCC(F)(F)CC3)c2C)o1 ZINC000089512543 1044739868 /nfs/dbraw/zinc/73/98/68/1044739868.db2.gz NJSXIZZSIFKJOR-UHFFFAOYSA-N 0 1 323.343 4.051 20 0 DIADMN Cc1ccc(C)c([C@H]2CCCN2Cc2cnc([C@@H](C)O)s2)c1 ZINC000367376607 1044740749 /nfs/dbraw/zinc/74/07/49/1044740749.db2.gz BZDVJIHIVSBOOR-RHSMWYFYSA-N 0 1 316.470 4.150 20 0 DIADMN COc1ccccc1[C@H](C)NCc1cccc(OCC(F)F)c1 ZINC000089543139 1044742910 /nfs/dbraw/zinc/74/29/10/1044742910.db2.gz QUXSTDZORHHEJW-ZDUSSCGKSA-N 0 1 321.367 4.190 20 0 DIADMN COc1ccccc1[C@@H](C)NCc1cccc(OCC(F)F)c1 ZINC000089543141 1044743160 /nfs/dbraw/zinc/74/31/60/1044743160.db2.gz QUXSTDZORHHEJW-CYBMUJFWSA-N 0 1 321.367 4.190 20 0 DIADMN COC[C@H](N[C@@H](C)c1ccc(OC(F)F)cc1)c1ccccc1 ZINC000089668064 1044744405 /nfs/dbraw/zinc/74/44/05/1044744405.db2.gz ANXYPZIAQSXZNM-GUYCJALGSA-N 0 1 321.367 4.326 20 0 DIADMN CO[C@H](c1ccc(Cl)cc1)[C@@H](C)N[C@H](C)c1nccs1 ZINC000090035147 1044747067 /nfs/dbraw/zinc/74/70/67/1044747067.db2.gz IGGSWWKPOHQEON-GYSYKLTISA-N 0 1 310.850 4.223 20 0 DIADMN CO[C@H](c1ccc(Cl)cc1)[C@@H](C)N[C@@H](C)c1nccs1 ZINC000090035145 1044747448 /nfs/dbraw/zinc/74/74/48/1044747448.db2.gz IGGSWWKPOHQEON-SUNKGSAMSA-N 0 1 310.850 4.223 20 0 DIADMN CCn1c2ccccc2nc1[C@H](C)N[C@@H]1CCc2ccccc21 ZINC000090036607 1044747681 /nfs/dbraw/zinc/74/76/81/1044747681.db2.gz 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/nfs/dbraw/zinc/75/21/86/1044752186.db2.gz URICQVHIGLSHIT-VIFPVBQESA-N 0 1 313.294 4.102 20 0 DIADMN c1ccc2c(c1)cccc2-c1nnc(CNC2(C3CC3)CCC2)o1 ZINC000887148520 1044754357 /nfs/dbraw/zinc/75/43/57/1044754357.db2.gz HANVGTTUNXOICA-UHFFFAOYSA-N 0 1 319.408 4.312 20 0 DIADMN O=C([O-])c1coc(C[N@H+]2CCC[C@@H]2CCC2CCCCC2)c1 ZINC000570521370 1044763808 /nfs/dbraw/zinc/76/38/08/1044763808.db2.gz BMMHTHHGBCZJGG-MRXNPFEDSA-N 0 1 305.418 4.303 20 0 DIADMN CC(C)n1ncc2c1[C@H](N[C@@H](C)c1ccccc1F)CCC2 ZINC000368136896 1044767525 /nfs/dbraw/zinc/76/75/25/1044767525.db2.gz YQMVLYZHZJNJKN-SUMWQHHRSA-N 0 1 301.409 4.331 20 0 DIADMN Cc1nc([C@H](C)N[C@](C)(Cc2ccc(Cl)cc2)C(C)C)no1 ZINC000570616921 1044770520 /nfs/dbraw/zinc/77/05/20/1044770520.db2.gz YERDMCJGQQHDNB-YVEFUNNKSA-N 0 1 321.852 4.339 20 0 DIADMN CC(C)(C)CCC[N@@H+](CCC(=O)[O-])Cc1ccc(F)c(F)c1 ZINC000570639010 1044770897 /nfs/dbraw/zinc/77/08/97/1044770897.db2.gz PGBGWDDQZZTXCL-UHFFFAOYSA-N 0 1 313.388 4.068 20 0 DIADMN C[C@H](C[N@@H+](C)[C@@H](c1ccccc1)c1ccc(Cl)cc1)C(=O)[O-] ZINC000570639360 1044771092 /nfs/dbraw/zinc/77/10/92/1044771092.db2.gz ZFHHKDVUULLAMB-DYVFJYSZSA-N 0 1 317.816 4.082 20 0 DIADMN C[C@@H]1[C@H](NCc2nnc(C(C)(C)C)s2)C[C@H]1c1ccccc1 ZINC000368360914 1044773157 /nfs/dbraw/zinc/77/31/57/1044773157.db2.gz LCLQKSDLVCAUSP-NWANDNLSSA-N 0 1 315.486 4.117 20 0 DIADMN OCc1ccc(CN2CCCC[C@H]2c2nc3ccccc3o2)cc1 ZINC000368403221 1044774758 /nfs/dbraw/zinc/77/47/58/1044774758.db2.gz QIKVGAJSBXTGQO-SFHVURJKSA-N 0 1 322.408 4.047 20 0 DIADMN Fc1cccc([C@H]2CCN(Cc3ccn(-c4ccccc4)n3)C2)c1 ZINC000570669284 1044775190 /nfs/dbraw/zinc/77/51/90/1044775190.db2.gz JTEADFYXWDOEJN-KRWDZBQOSA-N 0 1 321.399 4.001 20 0 DIADMN CC(C)CC1(C(=O)NC[C@H](c2cccs2)N(C)C)CCCC1 ZINC000445642183 1044779328 /nfs/dbraw/zinc/77/93/28/1044779328.db2.gz LNFYSCSMBFFFDZ-OAHLLOKOSA-N 0 1 322.518 4.074 20 0 DIADMN CC(=O)N1CC[C@H](N[C@H](C)c2cc(C)c(C)o2)c2ccccc21 ZINC000368522379 1044780162 /nfs/dbraw/zinc/78/01/62/1044780162.db2.gz NQUVPDYBJORLEA-DYVFJYSZSA-N 0 1 312.413 4.045 20 0 DIADMN Cc1cccc2c1OCC[C@H]2N[C@@H]1CCCc2ccc(O)cc21 ZINC000368497527 1044780289 /nfs/dbraw/zinc/78/02/89/1044780289.db2.gz ZNJBGPWRNMPNEP-RTBURBONSA-N 0 1 309.409 4.191 20 0 DIADMN Cc1nc2c(s1)[C@H](N[C@@H]1c3ccc(F)cc3O[C@@H]1C)CCC2 ZINC000368586260 1044781580 /nfs/dbraw/zinc/78/15/80/1044781580.db2.gz XFFCQXRAZKQJET-BIZFCNDTSA-N 0 1 318.417 4.080 20 0 DIADMN Cc1ccc(CNCc2cc(C)c(O)c(C)c2)c(OC(C)C)c1 ZINC000570822439 1044786217 /nfs/dbraw/zinc/78/62/17/1044786217.db2.gz IFXYCRHTGZTDPO-UHFFFAOYSA-N 0 1 313.441 4.394 20 0 DIADMN Cc1cn[nH]c1C[S@@](=O)[C@H](C)c1ccc(C(C)(C)C)cc1 ZINC000887376023 1044794069 /nfs/dbraw/zinc/79/40/69/1044794069.db2.gz LXDYPJFTFBEOFS-LRTDBIEQSA-N 0 1 304.459 4.026 20 0 DIADMN C[C@@H]1CN(CCSc2cc(Cl)ccc2Cl)CCCO1 ZINC000524307499 1044794481 /nfs/dbraw/zinc/79/44/81/1044794481.db2.gz GYQFOCGMKYUNJW-LLVKDONJSA-N 0 1 320.285 4.196 20 0 DIADMN Cc1ccc(CN[C@H](C)c2cccnc2)c(OCC(F)(F)F)c1 ZINC000125010259 1044796280 /nfs/dbraw/zinc/79/62/80/1044796280.db2.gz VPUGOIOPQISJNU-CYBMUJFWSA-N 0 1 324.346 4.182 20 0 DIADMN C[C@H](c1nnc(-c2cccc(Cl)c2)o1)[N@@H+](C)CC1CCC1 ZINC000369177054 1044798733 /nfs/dbraw/zinc/79/87/33/1044798733.db2.gz NXDDMWVDZNQFJN-LLVKDONJSA-N 0 1 305.809 4.183 20 0 DIADMN Cc1nnc([C@@H](C)NCC2(c3ccccc3)CCCCCC2)o1 ZINC000369242930 1044800554 /nfs/dbraw/zinc/80/05/54/1044800554.db2.gz KAWALXFKQIZAMZ-OAHLLOKOSA-N 0 1 313.445 4.321 20 0 DIADMN O=C([O-])c1sccc1C[N@H+]1CCCCC[C@H]1c1ccco1 ZINC000571172447 1044802038 /nfs/dbraw/zinc/80/20/38/1044802038.db2.gz WUJIVTFOCMODST-ZDUSSCGKSA-N 0 1 305.399 4.157 20 0 DIADMN CC(C)CC1(C(=O)NC[C@H](c2ccsc2)N(C)C)CCCC1 ZINC000445744387 1044802478 /nfs/dbraw/zinc/80/24/78/1044802478.db2.gz SLMSTBCGAXEOBM-MRXNPFEDSA-N 0 1 322.518 4.074 20 0 DIADMN CC[C@@H](c1ccccc1OC)[N@@H+](C)Cc1ccc2c(c1)ncn2C ZINC000571247094 1044805244 /nfs/dbraw/zinc/80/52/44/1044805244.db2.gz SQDQTMHSMUQVDD-SFHVURJKSA-N 0 1 323.440 4.165 20 0 DIADMN 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ZINC000903934554 1046340356 /nfs/dbraw/zinc/34/03/56/1046340356.db2.gz PETPLEBDSTYUIQ-MRXNPFEDSA-N 0 1 321.467 4.105 20 0 DIADMN C[C@@]1(Cc2cccs2)CCC[N@H+]1Cc1ccc(C(=O)[O-])s1 ZINC000903934551 1046341544 /nfs/dbraw/zinc/34/15/44/1046341544.db2.gz PETPLEBDSTYUIQ-INIZCTEOSA-N 0 1 321.467 4.105 20 0 DIADMN CSC1CCN(Cc2cc(Cl)ccc2OC(C)C)CC1 ZINC001138960995 1046341697 /nfs/dbraw/zinc/34/16/97/1046341697.db2.gz ZSVRUOIOAXEJTJ-UHFFFAOYSA-N 0 1 313.894 4.455 20 0 DIADMN CC(C)c1ccccc1C[N@H+]1[C@H](C)C[C@H](C)[C@H](C(=O)[O-])[C@@H]1C ZINC000903952353 1046342049 /nfs/dbraw/zinc/34/20/49/1046342049.db2.gz OWWMMFBOXHPFBG-KRXQYRFLSA-N 0 1 303.446 4.130 20 0 DIADMN CCc1cnccc1[C@H](C)NCc1cc(Cl)cc(Cl)c1N ZINC000638849107 1046344595 /nfs/dbraw/zinc/34/45/95/1046344595.db2.gz CMQAYTOSJATDCI-JTQLQIEISA-N 0 1 324.255 4.384 20 0 DIADMN Cc1cccc([C@H](N[C@@H](C)[C@H]2CC2(F)F)c2ccccn2)c1 ZINC000638814457 1046344740 /nfs/dbraw/zinc/34/47/40/1046344740.db2.gz ZRKQWRCBEOFSSP-LXZKKBNFSA-N 0 1 302.368 4.113 20 0 DIADMN Cc1nnsc1CN[C@H]1C[C@@H]2CCC(C)(C)c3cccc1c32 ZINC000638842635 1046345280 /nfs/dbraw/zinc/34/52/80/1046345280.db2.gz WVFMIXFHSKQITK-WFASDCNBSA-N 0 1 313.470 4.236 20 0 DIADMN Cc1nc2ccccn2c1CN1CC=C(c2ccc(C)cc2)CC1 ZINC000759331902 1046345862 /nfs/dbraw/zinc/34/58/62/1046345862.db2.gz HHYZUBQTWBWMSW-UHFFFAOYSA-N 0 1 317.436 4.240 20 0 DIADMN Nc1c(F)cccc1CN[C@@H]1CCCOc2cc(Cl)ccc21 ZINC000638838898 1046345912 /nfs/dbraw/zinc/34/59/12/1046345912.db2.gz SDVOKQVVNGJUIQ-OAHLLOKOSA-N 0 1 320.795 4.065 20 0 DIADMN CCOc1ccc(C[N@H+]2CCC[C@](C)(F)CC2)c(OCC)c1 ZINC001138977282 1046346228 /nfs/dbraw/zinc/34/62/28/1046346228.db2.gz KGUQZSXRFOXBAI-SFHVURJKSA-N 0 1 309.425 4.198 20 0 DIADMN CCOc1ccc(C[N@H+]2CCC[C@@](C)(F)CC2)c(OCC)c1 ZINC001138977281 1046347323 /nfs/dbraw/zinc/34/73/23/1046347323.db2.gz KGUQZSXRFOXBAI-GOSISDBHSA-N 0 1 309.425 4.198 20 0 DIADMN CC(C)Oc1ccc(Br)cc1CN1CCC[C@H]1C ZINC001138987570 1046348858 /nfs/dbraw/zinc/34/88/58/1046348858.db2.gz VHBRFSRLIILJFB-GFCCVEGCSA-N 0 1 312.251 4.221 20 0 DIADMN OCC[C@@H]1CCC[N@@H+](Cc2sc3ccccc3c2Cl)C1 ZINC000051917210 1046348900 /nfs/dbraw/zinc/34/89/00/1046348900.db2.gz UKMBVFMAGVWEIB-LBPRGKRZSA-N 0 1 309.862 4.149 20 0 DIADMN CCN(Cc1cccc(OC)c1)Cc1ccc(C(F)(F)F)cn1 ZINC001139014818 1046354460 /nfs/dbraw/zinc/35/44/60/1046354460.db2.gz GJHGPBCGZCKUBD-UHFFFAOYSA-N 0 1 324.346 4.131 20 0 DIADMN C[C@@H](c1cccnc1)N(C)Cc1ccc(CC(F)(F)F)cc1 ZINC000639040510 1046354341 /nfs/dbraw/zinc/35/43/41/1046354341.db2.gz JLOXDCYQMKRQCW-ZDUSSCGKSA-N 0 1 308.347 4.379 20 0 DIADMN Cc1nc2ccccc2nc1CN[C@H]1CCCc2ccc(F)cc21 ZINC000639124203 1046360784 /nfs/dbraw/zinc/36/07/84/1046360784.db2.gz QUFWKKUBQGDGLO-KRWDZBQOSA-N 0 1 321.399 4.245 20 0 DIADMN Cc1cnc(C2CCN(Cc3ccc(C(F)F)nc3)CC2)s1 ZINC000639115299 1046362117 /nfs/dbraw/zinc/36/21/17/1046362117.db2.gz AQVFRGANGNIPNZ-UHFFFAOYSA-N 0 1 323.412 4.164 20 0 DIADMN Brc1ccc(-c2ccc(CN3CC=CC3)o2)cc1 ZINC001139031163 1046364039 /nfs/dbraw/zinc/36/40/39/1046364039.db2.gz MQHVRGSAGXPUOO-UHFFFAOYSA-N 0 1 304.187 4.081 20 0 DIADMN FC(F)c1ccc(CN2CC(c3ccc(Cl)cc3)C2)cn1 ZINC000639233188 1046371783 /nfs/dbraw/zinc/37/17/83/1046371783.db2.gz AWDVGNZPEVDAAI-UHFFFAOYSA-N 0 1 308.759 4.272 20 0 DIADMN CC/C=C(\C)C(=O)Nc1cc(Cl)cc(Br)c1O ZINC000759743081 1046376203 /nfs/dbraw/zinc/37/62/03/1046376203.db2.gz XKRVVZKSDOVMEH-QPJJXVBHSA-N 0 1 318.598 4.103 20 0 DIADMN CC(C)OCCN(CCOC(C)C)Cc1cc2ccccc2o1 ZINC001139066567 1046376116 /nfs/dbraw/zinc/37/61/16/1046376116.db2.gz XTVKEPJXWDLWJT-UHFFFAOYSA-N 0 1 319.445 4.085 20 0 DIADMN COc1ccc(-c2ccccc2)cc1CN1C[C@@H]2C[C@@H]2[C@@H](F)C1 ZINC001139068497 1046376181 /nfs/dbraw/zinc/37/61/81/1046376181.db2.gz UNCDLJNFWOKRBE-WDSOQIARSA-N 0 1 311.400 4.152 20 0 DIADMN CC(C)=C(C)C(=O)Nc1cc(Cl)cc(Br)c1O ZINC000759741873 1046376617 /nfs/dbraw/zinc/37/66/17/1046376617.db2.gz ILQTXIKGSBPITE-UHFFFAOYSA-N 0 1 318.598 4.103 20 0 DIADMN Cc1ccc([C@@H](C)C(=O)Nc2ccc3nc(C(F)F)[nH]c3c2)o1 ZINC000759748083 1046377146 /nfs/dbraw/zinc/37/71/46/1046377146.db2.gz 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1046383985 /nfs/dbraw/zinc/38/39/85/1046383985.db2.gz VIVXAQMVCAVWDW-JZGRTCEGSA-N 0 1 311.425 4.101 20 0 DIADMN Cc1n[nH]c(C)c1CN(C)Cc1cccc(Oc2ccccc2)c1 ZINC001139100116 1046386759 /nfs/dbraw/zinc/38/67/59/1046386759.db2.gz FAFPOEPYHKTSSK-UHFFFAOYSA-N 0 1 321.424 4.451 20 0 DIADMN FC(F)(F)[C@@H]1CCCN(Cc2cc3cc(Cl)cnc3o2)C1 ZINC000639387831 1046387419 /nfs/dbraw/zinc/38/74/19/1046387419.db2.gz SIYTXVLAKVHWTJ-SNVBAGLBSA-N 0 1 318.726 4.256 20 0 DIADMN CC(C)c1nc(CNCc2cccc3[nH]ccc32)c2ccccn21 ZINC000639397616 1046389809 /nfs/dbraw/zinc/38/98/09/1046389809.db2.gz FQUMEIXEGHLHAL-UHFFFAOYSA-N 0 1 318.424 4.229 20 0 DIADMN CSCc1ccc(CN[C@H]2C[C@]2(F)c2ccccc2)cc1 ZINC001202901239 1046392032 /nfs/dbraw/zinc/39/20/32/1046392032.db2.gz FIJSSSWUWCKQHU-ROUUACIJSA-N 0 1 301.430 4.277 20 0 DIADMN COc1cc(O)ccc1CN(Cc1cccc(C)c1C)C1CC1 ZINC001139145005 1046396209 /nfs/dbraw/zinc/39/62/09/1046396209.db2.gz QBKOPXMCKHXHHP-UHFFFAOYSA-N 0 1 311.425 4.182 20 0 DIADMN COc1ccccc1[C@@H](C)[N@@H+](C)Cc1cccc2c1ccn2C 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/nfs/dbraw/zinc/64/96/55/1047649655.db2.gz YZEXGFPJGAZZQE-UHFFFAOYSA-N 0 1 319.408 4.148 20 0 DIADMN CCCOc1ncccc1CN[C@@H](c1ccc(F)cc1)C1CC1 ZINC000538102324 1047658449 /nfs/dbraw/zinc/65/84/49/1047658449.db2.gz IVVHAFWFJWXPQX-GOSISDBHSA-N 0 1 314.404 4.250 20 0 DIADMN CCC1(CN[C@H](c2ccn(C)n2)c2ccc(F)cc2)CCCC1 ZINC000538290879 1047666559 /nfs/dbraw/zinc/66/65/59/1047666559.db2.gz NVULNXXJOCOPOY-SFHVURJKSA-N 0 1 315.436 4.209 20 0 DIADMN CC(C)COc1cccc(CN2CCC[C@@H]2c2ccccn2)c1 ZINC000538308308 1047669554 /nfs/dbraw/zinc/66/95/54/1047669554.db2.gz TZUJXQYXLPKJIG-HXUWFJFHSA-N 0 1 310.441 4.454 20 0 DIADMN Cc1cc(C)nc(N2CCC(n3ccc4ccccc43)CC2)c1 ZINC001155240178 1047673422 /nfs/dbraw/zinc/67/34/22/1047673422.db2.gz SJSSSEVGMLKPMF-UHFFFAOYSA-N 0 1 305.425 4.495 20 0 DIADMN Cc1cc(CN(Cc2ccccc2)c2ccc(C)c(C)n2)on1 ZINC001155281738 1047675150 /nfs/dbraw/zinc/67/51/50/1047675150.db2.gz IVBNPXCATWUHFE-UHFFFAOYSA-N 0 1 307.397 4.202 20 0 DIADMN COc1cccnc1CN1CCC[C@@H]1c1ccccc1SC ZINC001206655895 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C[C@H]1CN(Cc2cnc(-c3ccccn3)s2)[C@H]1c1ccccc1 ZINC000538763667 1047710122 /nfs/dbraw/zinc/71/01/22/1047710122.db2.gz PTHDUTQVRNLXTM-KBXCAEBGSA-N 0 1 321.449 4.398 20 0 DIADMN Fc1ccc(F)c(CN(Cc2ccncc2)C2CCCC2)c1 ZINC000538762014 1047710167 /nfs/dbraw/zinc/71/01/67/1047710167.db2.gz RYUOVLRWCOABRA-UHFFFAOYSA-N 0 1 302.368 4.305 20 0 DIADMN CS[C@H]1CCCCN(Cc2cc(Br)cs2)C1 ZINC000538800047 1047712816 /nfs/dbraw/zinc/71/28/16/1047712816.db2.gz LKBGHHIWINWVGB-NSHDSACASA-N 0 1 320.321 4.228 20 0 DIADMN O=C(Nc1ccccc1Nc1ccncc1)[C@H]1CCC=CCCC1 ZINC001156431873 1047713286 /nfs/dbraw/zinc/71/32/86/1047713286.db2.gz JOENKZUHLOGPGT-INIZCTEOSA-N 0 1 321.424 4.322 20 0 DIADMN C[C@@H]1CCN(Cc2ncc(-c3cccs3)o2)CC12CCC2 ZINC000538942646 1047719789 /nfs/dbraw/zinc/71/97/89/1047719789.db2.gz DQYOWWLNLXPQBK-CYBMUJFWSA-N 0 1 302.443 4.415 20 0 DIADMN CC[C@H]1CCC[C@@H]1NC(=O)Nc1ccc2nc(C(F)F)[nH]c2c1 ZINC000538982678 1047722938 /nfs/dbraw/zinc/72/29/38/1047722938.db2.gz SMLXAOARTBRNLS-ONGXEEELSA-N 0 1 322.359 4.201 20 0 DIADMN CC[C@@H](C)c1nc([C@H](C)NC(=O)[C@H](C)CC2CCCCC2)n[nH]1 ZINC001156832922 1047723805 /nfs/dbraw/zinc/72/38/05/1047723805.db2.gz USAVWPKZONOFTD-MCIONIFRSA-N 0 1 320.481 4.102 20 0 DIADMN COc1ccnc([C@@H](C)N[C@@H](C)c2cccc(OC(C)C)c2)c1 ZINC000924680457 1047724469 /nfs/dbraw/zinc/72/44/69/1047724469.db2.gz FUJANBAVIQUZEL-LSDHHAIUSA-N 0 1 314.429 4.289 20 0 DIADMN COc1ccc2c(c1)[C@H](N[C@H]1COc3ccc(C)cc31)CCC2 ZINC000539058917 1047729690 /nfs/dbraw/zinc/72/96/90/1047729690.db2.gz ANYFYTQVWMNYCS-MOPGFXCFSA-N 0 1 309.409 4.104 20 0 DIADMN Cc1cc(C)n(-c2ccc(CNc3ccc(C)c(C)n3)cc2)n1 ZINC001156995636 1047731673 /nfs/dbraw/zinc/73/16/73/1047731673.db2.gz RWJLWVIRRQVHLZ-UHFFFAOYSA-N 0 1 306.413 4.113 20 0 DIADMN Clc1ccc2c(c1)[C@@H](N[C@H]1CCCc3c[nH]nc31)CCC2 ZINC000539066271 1047733918 /nfs/dbraw/zinc/73/39/18/1047733918.db2.gz ZCUGWKIYQFAIGJ-HOTGVXAUSA-N 0 1 301.821 4.108 20 0 DIADMN COc1ccccc1S[C@@H]1CCN(c2cc(C)cc(C)n2)C1 ZINC001157120270 1047735201 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ZINC001157424388 1047743270 /nfs/dbraw/zinc/74/32/70/1047743270.db2.gz QBOGSJCKFTXGGR-UHFFFAOYSA-N 0 1 323.396 4.301 20 0 DIADMN CCCCc1noc([C@@H](C)N[C@@H](C)C(C)(C)c2ccccc2)n1 ZINC000539255040 1047743779 /nfs/dbraw/zinc/74/37/79/1047743779.db2.gz VGBTUNURZONNBI-CABCVRRESA-N 0 1 315.461 4.429 20 0 DIADMN COc1cccc(CN[C@H](c2ccc(Cl)cc2)C2CCC2)n1 ZINC000539308650 1047746407 /nfs/dbraw/zinc/74/64/07/1047746407.db2.gz OOHLJHZVUIIUEY-SFHVURJKSA-N 0 1 316.832 4.375 20 0 DIADMN CC(C)(C)C1CCN(C(=O)[C@@H](N)c2ccc3ccccc3c2)CC1 ZINC001157693854 1047750047 /nfs/dbraw/zinc/75/00/47/1047750047.db2.gz HJRDIKSMKKTNQN-IBGZPJMESA-N 0 1 324.468 4.124 20 0 DIADMN C[C@@H]1CC[N@@H+](Cc2cccc3nccn32)[C@@H]1c1cccc(F)c1 ZINC000539381703 1047751054 /nfs/dbraw/zinc/75/10/54/1047751054.db2.gz NUQRBYJOLMRTKH-KUHUBIRLSA-N 0 1 309.388 4.057 20 0 DIADMN Cc1cc([C@H](C)NCc2cccc3c2OCCO3)cc(C)c1F ZINC000237497361 1047752761 /nfs/dbraw/zinc/75/27/61/1047752761.db2.gz GQQARFRCGVWLFY-AWEZNQCLSA-N 0 1 315.388 4.065 20 0 DIADMN C[C@H](NC[C@H]1CCC2(CCCCC2)O1)c1nc2c(s1)CCC2 ZINC000477855080 1047756044 /nfs/dbraw/zinc/75/60/44/1047756044.db2.gz WLBQMUCHBIPOFD-UONOGXRCSA-N 0 1 320.502 4.164 20 0 DIADMN C[C@@H](NC[C@H]1CCC2(CCCCC2)O1)c1nc2c(s1)CCC2 ZINC000477855082 1047756120 /nfs/dbraw/zinc/75/61/20/1047756120.db2.gz WLBQMUCHBIPOFD-ZIAGYGMSSA-N 0 1 320.502 4.164 20 0 DIADMN COc1ccc2cnc(NCCCCc3ccccn3)cc2c1 ZINC001157975193 1047765914 /nfs/dbraw/zinc/76/59/14/1047765914.db2.gz FKDSRZALXOBUPM-UHFFFAOYSA-N 0 1 307.397 4.073 20 0 DIADMN COc1ccc2c(ccnc2N[C@H](C2CCC2)C(F)(F)F)c1 ZINC001158400306 1047778551 /nfs/dbraw/zinc/77/85/51/1047778551.db2.gz RMQRHHQNWLBZII-CQSZACIVSA-N 0 1 310.319 4.386 20 0 DIADMN COCC[C@H](NCc1ccc(Cl)c(F)c1)c1ccc(C)o1 ZINC000478285277 1047779387 /nfs/dbraw/zinc/77/93/87/1047779387.db2.gz ZDYYKQTWRPAVMZ-HNNXBMFYSA-N 0 1 311.784 4.248 20 0 DIADMN CCCOc1cccc(CN[C@@H](CCOC)c2ccc(C)o2)c1 ZINC000478354468 1047782491 /nfs/dbraw/zinc/78/24/91/1047782491.db2.gz UGJBGLHTRAIDIQ-SFHVURJKSA-N 0 1 317.429 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Cc1c(Cl)ccc(Nc2cc([C@@H]3CCCCN3)no2)c1F ZINC001159313019 1047831189 /nfs/dbraw/zinc/83/11/89/1047831189.db2.gz IMHFFQJPRQQHRO-NSHDSACASA-N 0 1 309.772 4.334 20 0 DIADMN Cc1ccc(OC(C)C)cc1Nc1cc([C@@H]2CCCCN2)no1 ZINC001159313319 1047831224 /nfs/dbraw/zinc/83/12/24/1047831224.db2.gz LVMRHHUHBLBLJY-HNNXBMFYSA-N 0 1 315.417 4.328 20 0 DIADMN Fc1ccc(C2CC2)c(F)c1Nc1cc([C@H]2CCCCN2)no1 ZINC001159313263 1047831255 /nfs/dbraw/zinc/83/12/55/1047831255.db2.gz KVENUPBOIJMPAX-CYBMUJFWSA-N 0 1 319.355 4.388 20 0 DIADMN Fc1ccc(C2CC2)c(F)c1[N-]c1cc([C@H]2CCCC[NH2+]2)no1 ZINC001159313263 1047831260 /nfs/dbraw/zinc/83/12/60/1047831260.db2.gz KVENUPBOIJMPAX-CYBMUJFWSA-N 0 1 319.355 4.388 20 0 DIADMN CSc1ccc(F)cc1Nc1cc([C@@H]2CCCCN2)no1 ZINC001159312907 1047831465 /nfs/dbraw/zinc/83/14/65/1047831465.db2.gz GJQNXKQROREFBU-NSHDSACASA-N 0 1 307.394 4.094 20 0 DIADMN CCCOc1cccc(F)c1Nc1cc([C@H]2CCCCN2)no1 ZINC001159312902 1047831747 /nfs/dbraw/zinc/83/17/47/1047831747.db2.gz GCPUDEKTZHGAMN-CYBMUJFWSA-N 0 1 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COc1ccc(C)cc1CN1CCC[C@@H](C(F)(F)F)[C@@H]1C ZINC000481746292 1048472599 /nfs/dbraw/zinc/47/25/99/1048472599.db2.gz PXPTWDIDBMVFTN-GXTWGEPZSA-N 0 1 301.352 4.166 20 0 DIADMN Cc1cc([NH+]=C([O-])Nc2c(C)cccc2C)c2ccccc2n1 ZINC001202193926 1048478076 /nfs/dbraw/zinc/47/80/76/1048478076.db2.gz VRSVAOWGBZFMBF-UHFFFAOYSA-N 0 1 305.381 4.226 20 0 DIADMN C[C@@H]1[C@H](C(F)(F)F)CCCN1Cc1cccc(OC(F)F)c1 ZINC000481750378 1048478768 /nfs/dbraw/zinc/47/87/68/1048478768.db2.gz OCMUCNCEPQVPNV-ZWNOBZJWSA-N 0 1 323.305 4.451 20 0 DIADMN CCOc1ccc2nc(SCCOCC3CCCC3)[nH]c2c1 ZINC001188217023 1048491588 /nfs/dbraw/zinc/49/15/88/1048491588.db2.gz HDIQLGNKPYVONZ-UHFFFAOYSA-N 0 1 320.458 4.261 20 0 DIADMN CCOc1ccc2nc(SCOC3CCCCC3)[nH]c2c1 ZINC001188218465 1048491699 /nfs/dbraw/zinc/49/16/99/1048491699.db2.gz WMXCSEGCCPWQFE-UHFFFAOYSA-N 0 1 306.431 4.361 20 0 DIADMN Cc1[nH]nc2cc(NC(=O)c3ccc(C(C)(C)C)s3)ccc12 ZINC001188252624 1048492792 /nfs/dbraw/zinc/49/27/92/1048492792.db2.gz MQWFGRXBNHTPJM-UHFFFAOYSA-N 0 1 313.426 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4.191 20 0 DIADMN Cc1ccc2c(CN3Cc4ccccc4[C@@H](C)C3)cc(=O)oc2c1 ZINC000916152651 1052594039 /nfs/dbraw/zinc/59/40/39/1052594039.db2.gz WNVMTUBLJJUHCT-HNNXBMFYSA-N 0 1 319.404 4.221 20 0 DIADMN COc1ccc([C@H](C)N[C@H](C)c2ccco2)cc1Br ZINC000037105962 1052600555 /nfs/dbraw/zinc/60/05/55/1052600555.db2.gz NRXMBHYNEHIEIN-WDEREUQCSA-N 0 1 324.218 4.463 20 0 DIADMN C[C@H](NCc1ccc(F)c(Br)c1)c1cccc(O)c1 ZINC000037151365 1052607169 /nfs/dbraw/zinc/60/71/69/1052607169.db2.gz HXYKTRCZCALSRM-JTQLQIEISA-N 0 1 324.193 4.145 20 0 DIADMN O=C(CNCc1cccc(Cl)c1)Nc1cccc2ccccc21 ZINC000916568517 1052617045 /nfs/dbraw/zinc/61/70/45/1052617045.db2.gz IGEUBIXCSQAJDN-UHFFFAOYSA-N 0 1 324.811 4.222 20 0 DIADMN C[C@H](N[C@H](CO)c1ccccc1)c1cc(Cl)cc(Cl)c1 ZINC000123654240 1052633244 /nfs/dbraw/zinc/63/32/44/1052633244.db2.gz LWZRKFGPFCWREJ-MEDUHNTESA-N 0 1 310.224 4.378 20 0 DIADMN CN(CCCc1ccccc1)Cc1csc(-c2ccccn2)n1 ZINC000123948013 1052636561 /nfs/dbraw/zinc/63/65/61/1052636561.db2.gz FEKWBOCYWCMVIX-UHFFFAOYSA-N 0 1 323.465 4.270 20 0 DIADMN CC(C)(NCc1cnn(-c2ccccc2)c1)c1cccc(F)c1 ZINC000124680811 1052642561 /nfs/dbraw/zinc/64/25/61/1052642561.db2.gz XHRRGEPNBZBSRV-UHFFFAOYSA-N 0 1 309.388 4.036 20 0 DIADMN COC(=O)c1ccc([C@H](C)N[C@H](C)c2ccc(Cl)cc2)o1 ZINC000124895818 1052645015 /nfs/dbraw/zinc/64/50/15/1052645015.db2.gz VYLOVJXOLDUXIY-MNOVXSKESA-N 0 1 307.777 4.131 20 0 DIADMN CC[C@@H]1CC[N@H+]([C@@H](C)c2nc(Cc3ccc(Cl)cc3)no2)C1 ZINC000125167267 1052645631 /nfs/dbraw/zinc/64/56/31/1052645631.db2.gz XHRHUCHUCNVMTJ-QWHCGFSZSA-N 0 1 319.836 4.107 20 0 DIADMN CC[C@@H]1CCN([C@@H](C)c2nc(Cc3ccc(Cl)cc3)no2)C1 ZINC000125167267 1052645635 /nfs/dbraw/zinc/64/56/35/1052645635.db2.gz XHRHUCHUCNVMTJ-QWHCGFSZSA-N 0 1 319.836 4.107 20 0 DIADMN C[C@@H](Cc1ccc(O)cc1)N(C)Cc1nc(C(C)(C)C)cs1 ZINC000125385856 1052648546 /nfs/dbraw/zinc/64/85/46/1052648546.db2.gz MMUSAJOEFVUTHZ-ZDUSSCGKSA-N 0 1 318.486 4.209 20 0 DIADMN CN(CCC(F)(F)F)Cc1ccc(Cl)c2cccnc12 ZINC000064635879 1052649804 /nfs/dbraw/zinc/64/98/04/1052649804.db2.gz ASHQUBOVUDMYBE-UHFFFAOYSA-N 0 1 302.727 4.272 20 0 DIADMN c1c[nH]c([C@H](NCCCSc2ccccc2)c2ccccc2)n1 ZINC000125537246 1052650556 /nfs/dbraw/zinc/65/05/56/1052650556.db2.gz LTZSJTWMFLUAAI-GOSISDBHSA-N 0 1 323.465 4.271 20 0 DIADMN c1c[nH]c([C@H](NC[C@@H]2CCCc3ccccc32)c2ccccc2)n1 ZINC000125656209 1052650711 /nfs/dbraw/zinc/65/07/11/1052650711.db2.gz FMNOWYDEYVOVCN-AZUAARDMSA-N 0 1 317.436 4.209 20 0 DIADMN COc1ccc([C@H](C)N(C)Cc2cnc(C(C)C)s2)cc1 ZINC000125799113 1052653857 /nfs/dbraw/zinc/65/38/57/1052653857.db2.gz LQJJRDOXJCYWCW-ZDUSSCGKSA-N 0 1 304.459 4.468 20 0 DIADMN CCc1cccc(OC(=O)c2[nH]c(-c3ccccc3)nc2C)c1 ZINC000916857043 1052661224 /nfs/dbraw/zinc/66/12/24/1052661224.db2.gz USZGPDZONOTCIE-UHFFFAOYSA-N 0 1 306.365 4.167 20 0 DIADMN COc1ccc(CN(C)[C@@H](C)c2cc3ccccc3o2)cc1O ZINC000126016438 1052665218 /nfs/dbraw/zinc/66/52/18/1052665218.db2.gz CNLMHYRPYHWYRR-ZDUSSCGKSA-N 0 1 311.381 4.340 20 0 DIADMN COCc1ccc(CN[C@@H](C)c2ccccc2C(F)(F)F)o1 ZINC000126089580 1052665915 /nfs/dbraw/zinc/66/59/15/1052665915.db2.gz GTUGXUMSEHZUQO-NSHDSACASA-N 0 1 313.319 4.296 20 0 DIADMN Clc1ccc(CN2CC[C@@H](O[C@@H]3Cc4ccccc43)C2)cc1 ZINC001224070600 1052665994 /nfs/dbraw/zinc/66/59/94/1052665994.db2.gz GIRFCPUCDNJWJF-IEBWSBKVSA-N 0 1 313.828 4.228 20 0 DIADMN Oc1cccc([C@H]2CN(Cc3cccc4ccccc43)CCO2)c1 ZINC000126519580 1052671717 /nfs/dbraw/zinc/67/17/17/1052671717.db2.gz MGHLXNUJEAEIEB-OAQYLSRUSA-N 0 1 319.404 4.119 20 0 DIADMN CC(C)CC[C@@H](NC(=O)CN1CCCC1)c1ccc(Cl)cc1 ZINC000916970193 1052675695 /nfs/dbraw/zinc/67/56/95/1052675695.db2.gz MKDPUAZMYYYHIM-QGZVFWFLSA-N 0 1 322.880 4.029 20 0 DIADMN COc1ccccc1[C@H]1CCN(Cc2csc(Cl)c2)C1 ZINC001142760114 1052679335 /nfs/dbraw/zinc/67/93/35/1052679335.db2.gz HEVFLHBPNGJITH-ZDUSSCGKSA-N 0 1 307.846 4.400 20 0 DIADMN CC[C@H](NCc1cccc(C)n1)c1ccc(OC(F)F)cc1 ZINC000127306427 1052692454 /nfs/dbraw/zinc/69/24/54/1052692454.db2.gz LFQBFEUXLVYLRJ-INIZCTEOSA-N 0 1 306.356 4.232 20 0 DIADMN Cc1ccc(-c2ncc(CN[C@@H](C)c3cccc(O)c3)s2)o1 ZINC000127366000 1052693476 /nfs/dbraw/zinc/69/34/76/1052693476.db2.gz CEMNJSYJVLJAHB-LBPRGKRZSA-N 0 1 314.410 4.268 20 0 DIADMN CC[C@@H](CSc1ccc(Cl)cc1)NCc1cscn1 ZINC000127401035 1052694497 /nfs/dbraw/zinc/69/44/97/1052694497.db2.gz BFTCDFVMRLORDE-LBPRGKRZSA-N 0 1 312.891 4.457 20 0 DIADMN Cc1cc(C)c(NC(=O)CN(C)C[C@@H](C)c2ccccc2)c(C)c1 ZINC000066854397 1052696328 /nfs/dbraw/zinc/69/63/28/1052696328.db2.gz TYUPYOGBVBJQJX-GOSISDBHSA-N 0 1 324.468 4.286 20 0 DIADMN Clc1ccc(C[C@H](NCc2cc[nH]n2)c2ccccc2)cc1 ZINC000066990601 1052699761 /nfs/dbraw/zinc/69/97/61/1052699761.db2.gz FPRLFSRBOLCATN-SFHVURJKSA-N 0 1 311.816 4.137 20 0 DIADMN C[C@H](c1cccnc1)N(C)Cc1ccc(Br)c(F)c1 ZINC000127844546 1052702985 /nfs/dbraw/zinc/70/29/85/1052702985.db2.gz JAQAYWLEXCVTHG-LLVKDONJSA-N 0 1 323.209 4.176 20 0 DIADMN CN(CCc1ccc(F)cc1)Cc1ncc(-c2cccs2)o1 ZINC000067378000 1052703562 /nfs/dbraw/zinc/70/35/62/1052703562.db2.gz YOPZIINRIZWVSH-UHFFFAOYSA-N 0 1 316.401 4.217 20 0 DIADMN CC[C@@H](NCc1cc2cc(OC)ccc2o1)c1c(C)noc1C ZINC000127997299 1052706970 /nfs/dbraw/zinc/70/69/70/1052706970.db2.gz VLYPPRWNNHVOHD-MRXNPFEDSA-N 0 1 314.385 4.287 20 0 DIADMN CCOc1ccc(CN(C)[C@H](C)c2ccco2)cc1OCC ZINC000128204575 1052712486 /nfs/dbraw/zinc/71/24/86/1052712486.db2.gz JBQIYDHGZVOPAN-CQSZACIVSA-N 0 1 303.402 4.270 20 0 DIADMN CC[C@H](C#N)Oc1cccc(CN[C@H](C)c2ccccc2OC)c1 ZINC000089724368 1052715497 /nfs/dbraw/zinc/71/54/97/1052715497.db2.gz JLVJUPOBVZCZPE-NVXWUHKLSA-N 0 1 324.424 4.227 20 0 DIADMN CCc1ccc([C@@H](C)NCc2cccc(O[C@@H](C#N)CC)c2)o1 ZINC000089724935 1052716736 /nfs/dbraw/zinc/71/67/36/1052716736.db2.gz MVMTVVLARWZZMR-RHSMWYFYSA-N 0 1 312.413 4.374 20 0 DIADMN Cc1ccc([C@@H](OC[C@H]2CCCCN2C)C(F)(F)F)cc1 ZINC001224701073 1052717471 /nfs/dbraw/zinc/71/74/71/1052717471.db2.gz CNMVSVZFHPHFRL-HUUCEWRRSA-N 0 1 301.352 4.099 20 0 DIADMN CN1CCCC[C@H]1CO[C@@H](C(=O)c1ccccc1)c1ccccc1 ZINC001224702451 1052718253 /nfs/dbraw/zinc/71/82/53/1052718253.db2.gz MQPYIAUPUHMWPA-PZJWPPBQSA-N 0 1 323.436 4.112 20 0 DIADMN Fc1ccccc1CN1CCC[C@H](OCCc2cccs2)C1 ZINC001224785457 1052725169 /nfs/dbraw/zinc/72/51/69/1052725169.db2.gz HLFYAFSMCORJJO-INIZCTEOSA-N 0 1 319.445 4.111 20 0 DIADMN C[C@H](NC[C@@H](O)c1ccsc1)c1cccc(Cl)c1Cl ZINC000154427385 1052732372 /nfs/dbraw/zinc/73/23/72/1052732372.db2.gz RGBAHFKAYGBYJG-TVQRCGJNSA-N 0 1 316.253 4.439 20 0 DIADMN O[C@H](CN(C/C=C/Cl)Cc1ccccc1)c1ccsc1 ZINC000154434910 1052733263 /nfs/dbraw/zinc/73/32/63/1052733263.db2.gz BUQVHRVJWHCITP-KZJSRBBCSA-N 0 1 307.846 4.036 20 0 DIADMN C[C@H](NC[C@H](O)c1ccsc1)c1cc(Cl)ccc1Cl ZINC000154588929 1052766751 /nfs/dbraw/zinc/76/67/51/1052766751.db2.gz ZKBKBRUTBKDKPH-XPTSAGLGSA-N 0 1 316.253 4.439 20 0 DIADMN Fc1ccccc1O[C@H]1CCN(Cc2ccccc2Cl)C1 ZINC001225200556 1052753730 /nfs/dbraw/zinc/75/37/30/1052753730.db2.gz KSCZCIGDDNZFEU-AWEZNQCLSA-N 0 1 305.780 4.132 20 0 DIADMN C[C@H](c1ccccn1)[N@H+]1CCC[C@H](Oc2ccc3c(c2)CCC3)C1 ZINC001225267968 1052766088 /nfs/dbraw/zinc/76/60/88/1052766088.db2.gz SZLGTTSTWUTDRY-UZLBHIALSA-N 0 1 322.452 4.175 20 0 DIADMN C[C@H](c1ccccn1)[N@H+]1CCC[C@@H](Oc2ccc3c(c2)CCC3)C1 ZINC001225267964 1052766110 /nfs/dbraw/zinc/76/61/10/1052766110.db2.gz SZLGTTSTWUTDRY-OXQOHEQNSA-N 0 1 322.452 4.175 20 0 DIADMN Clc1ccc(O[C@@H]2CCN(Cc3ccccc3Cl)C2)nc1 ZINC001225274749 1052767859 /nfs/dbraw/zinc/76/78/59/1052767859.db2.gz MRVFSHZLPXXQRX-CQSZACIVSA-N 0 1 323.223 4.042 20 0 DIADMN Fc1ccc(SCCN(Cc2cccnc2)C2CC2)c(F)c1 ZINC000660138154 1052768257 /nfs/dbraw/zinc/76/82/57/1052768257.db2.gz RYDIKGHPIJLQCA-UHFFFAOYSA-N 0 1 320.408 4.117 20 0 DIADMN Clc1cncc(O[C@@H]2CCN(Cc3ccccc3Cl)C2)c1 ZINC001225289864 1052768467 /nfs/dbraw/zinc/76/84/67/1052768467.db2.gz PRAZTKBZMWBHGA-CQSZACIVSA-N 0 1 323.223 4.042 20 0 DIADMN Cc1ccc(O[C@@H]2CC[N@H+]([C@H](C)c3ccccn3)C2)c(Cl)c1 ZINC001225345107 1052776982 /nfs/dbraw/zinc/77/69/82/1052776982.db2.gz QLILHKCRCKSNTB-HUUCEWRRSA-N 0 1 316.832 4.258 20 0 DIADMN Cc1ccc(O[C@@H]2CCN([C@H](C)c3ccccn3)C2)c(Cl)c1 ZINC001225345107 1052776986 /nfs/dbraw/zinc/77/69/86/1052776986.db2.gz QLILHKCRCKSNTB-HUUCEWRRSA-N 0 1 316.832 4.258 20 0 DIADMN CCc1[nH]ncc1C(=O)Nc1ccc(-c2ccccc2)cc1F ZINC000918076976 1052778608 /nfs/dbraw/zinc/77/86/08/1052778608.db2.gz PJRPRHIBGOMMTB-UHFFFAOYSA-N 0 1 309.344 4.031 20 0 DIADMN CCCN(C)[C@H](C)C(=O)Nc1ccc(Cl)cc1C(F)(F)F ZINC000069091875 1052779002 /nfs/dbraw/zinc/77/90/02/1052779002.db2.gz YYARUNKNXOLAJQ-SECBINFHSA-N 0 1 322.758 4.028 20 0 DIADMN Cc1oncc1CN1CCC(Sc2ccc(Cl)cc2)CC1 ZINC000129301768 1052782319 /nfs/dbraw/zinc/78/23/19/1052782319.db2.gz MWMAYVSPMLYROZ-UHFFFAOYSA-N 0 1 322.861 4.393 20 0 DIADMN CCOC(=O)c1cc2[nH]c(-c3ccc(Cl)cc3)ccc-2n1 ZINC001236086977 1052789433 /nfs/dbraw/zinc/78/94/33/1052789433.db2.gz MZNJJPWWKDFDTM-UHFFFAOYSA-N 0 1 300.745 4.060 20 0 DIADMN COc1cc(CN(C)[C@H](C)c2ccco2)ccc1OC(F)F ZINC000069519256 1052792251 /nfs/dbraw/zinc/79/22/51/1052792251.db2.gz MKWMQYGRKSIILS-LLVKDONJSA-N 0 1 311.328 4.083 20 0 DIADMN CC[C@H](SC)C(=O)Nc1cccc2c1CN(CCC(C)C)C2 ZINC000129530834 1052793984 /nfs/dbraw/zinc/79/39/84/1052793984.db2.gz DFNCSOAZPGXLNC-KRWDZBQOSA-N 0 1 320.502 4.128 20 0 DIADMN COc1ccc(CN[C@H](C)c2cccc(C3CC3)c2)c(OC)c1 ZINC000556059345 1052794434 /nfs/dbraw/zinc/79/44/34/1052794434.db2.gz YBJOIQBHDKEVFB-CQSZACIVSA-N 0 1 311.425 4.432 20 0 DIADMN Cc1ccc(F)c([C@@H](C)[C@H](c2nc[nH]n2)c2ccc(F)cc2)c1 ZINC000556104259 1052798139 /nfs/dbraw/zinc/79/81/39/1052798139.db2.gz QDKXNJNQYCNCKM-PXAZEXFGSA-N 0 1 313.351 4.327 20 0 DIADMN C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1Oc1ccc([S-])cc1 ZINC001225555369 1052802645 /nfs/dbraw/zinc/80/26/45/1052802645.db2.gz MGBPOJGEUFXYHT-HNAYVOBHSA-N 0 1 313.466 4.265 20 0 DIADMN C[C@H]1CCN(Cc2ccccc2)C[C@@H]1Oc1cccnc1Cl ZINC001225581604 1052804823 /nfs/dbraw/zinc/80/48/23/1052804823.db2.gz JZDRGVONRDEZCF-YOEHRIQHSA-N 0 1 316.832 4.024 20 0 DIADMN C[C@@H]1CCN(Cc2ccccc2)C[C@@H]1Oc1cccnc1Cl ZINC001225581601 1052804896 /nfs/dbraw/zinc/80/48/96/1052804896.db2.gz 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1053387679 /nfs/dbraw/zinc/38/76/79/1053387679.db2.gz UALMENRKVREKTG-ICSRJNTNSA-N 0 1 309.457 4.365 20 0 DIADMN CC[N@H+](Cc1nc2c(s1)C[C@H](C)CC2)C[C@H]1CC=CCC1 ZINC001474754111 1053391164 /nfs/dbraw/zinc/39/11/64/1053391164.db2.gz NYDNHFIMFIEAQA-CABCVRRESA-N 0 1 304.503 4.446 20 0 DIADMN CCCCCC[C@@H](C)Cc1nc([C@@H]2CN3CCC2CC3)no1 ZINC001321124587 1053392751 /nfs/dbraw/zinc/39/27/51/1053392751.db2.gz PMQCMJNPSIWVOF-GDBMZVCRSA-N 0 1 305.466 4.028 20 0 DIADMN c1sc(CN2CC[C@@H]3OCCC[C@@H]3C2)nc1C1CCCCC1 ZINC001321204739 1053398506 /nfs/dbraw/zinc/39/85/06/1053398506.db2.gz QPVUPHLDHAYLHN-WBVHZDCISA-N 0 1 320.502 4.192 20 0 DIADMN CO[C@@H](CN[C@@H](C)c1nc2c(s1)CCCC2)c1ccccc1 ZINC000093400085 1053400138 /nfs/dbraw/zinc/40/01/38/1053400138.db2.gz YGJYYHAAQICCRR-BBRMVZONSA-N 0 1 316.470 4.060 20 0 DIADMN Cc1nnc(SC[C@@H](C)c2ccc(C(F)(F)F)cc2)[nH]1 ZINC001321222352 1053401934 /nfs/dbraw/zinc/40/19/34/1053401934.db2.gz RZQPUNNDEGCCHC-MRVPVSSYSA-N 0 1 301.337 4.028 20 0 DIADMN Cc1cccc([C@H]2CCCN2Cc2c[nH]nc2-c2cccs2)n1 ZINC000093445077 1053408793 /nfs/dbraw/zinc/40/87/93/1053408793.db2.gz QDWLUQCRCOAUJD-MRXNPFEDSA-N 0 1 324.453 4.179 20 0 DIADMN Cc1ncsc1C[N@H+]1CCSC[C@@H]1c1ccc(C)cc1 ZINC000093458918 1053410952 /nfs/dbraw/zinc/41/09/52/1053410952.db2.gz FDYWHYNTFNPXAG-OAHLLOKOSA-N 0 1 304.484 4.050 20 0 DIADMN Cc1ncsc1CN1CCSC[C@@H]1c1ccc(C)cc1 ZINC000093458918 1053410960 /nfs/dbraw/zinc/41/09/60/1053410960.db2.gz FDYWHYNTFNPXAG-OAHLLOKOSA-N 0 1 304.484 4.050 20 0 DIADMN CCN(CC(=O)Nc1c(C)cccc1C)[C@H]1CCc2ccccc21 ZINC000618986657 1053412494 /nfs/dbraw/zinc/41/24/94/1053412494.db2.gz YIUBIRLHAAIXML-IBGZPJMESA-N 0 1 322.452 4.251 20 0 DIADMN C[C@@H](O)C[C@H]1CCCN1Cc1ccc(Cl)c(C(F)(F)F)c1 ZINC000093483092 1053415197 /nfs/dbraw/zinc/41/51/97/1053415197.db2.gz RXXANGOEGHRSQY-ZYHUDNBSSA-N 0 1 321.770 4.094 20 0 DIADMN CC(C)CCN1Cc2cccc(NC(=O)[C@@H]3C[C@@H]3C(C)C)c2C1 ZINC001435015164 1053415527 /nfs/dbraw/zinc/41/55/27/1053415527.db2.gz BHYYCVNZHJTIMQ-IAGOWNOFSA-N 0 1 314.473 4.279 20 0 DIADMN COc1ccc(CN[C@H](C)c2ccsc2)c(Cl)c1OC ZINC000110823230 1053417248 /nfs/dbraw/zinc/41/72/48/1053417248.db2.gz DVVOCKJJRKIGRP-SNVBAGLBSA-N 0 1 311.834 4.270 20 0 DIADMN CN(C)Cc1cc(F)ccc1O[C@H]1CCc2c1nccc2Cl ZINC001229852968 1053417304 /nfs/dbraw/zinc/41/73/04/1053417304.db2.gz ACNFQLXYNQLXLU-INIZCTEOSA-N 0 1 320.795 4.002 20 0 DIADMN C[C@H]1SCCN(Cc2cnc(-c3cccs3)s2)[C@@H]1C ZINC000093501136 1053417367 /nfs/dbraw/zinc/41/73/67/1053417367.db2.gz KWWFPRITBLUASF-GHMZBOCLSA-N 0 1 310.513 4.197 20 0 DIADMN COc1ccc([C@@H](C)Oc2ccc(F)cc2CN(C)C)cc1 ZINC001229853180 1053418186 /nfs/dbraw/zinc/41/81/86/1053418186.db2.gz DMQWRPXWFXRIFP-CYBMUJFWSA-N 0 1 303.377 4.036 20 0 DIADMN C[C@@H](Oc1ccc(F)cc1CN(C)C)c1cccnc1Cl ZINC001229853178 1053418280 /nfs/dbraw/zinc/41/82/80/1053418280.db2.gz DKLIIHNWIJIQBF-LLVKDONJSA-N 0 1 308.784 4.076 20 0 DIADMN C[C@H](Oc1ccc(F)cc1CN(C)C)c1cccc(N(C)C)c1 ZINC001229858224 1053419167 /nfs/dbraw/zinc/41/91/67/1053419167.db2.gz JOFDZAPMCQTAKF-AWEZNQCLSA-N 0 1 316.420 4.093 20 0 DIADMN C[C@@H](Oc1ccc(F)cc1CN(C)C)c1ccc(F)c(F)c1 ZINC001229859145 1053419987 /nfs/dbraw/zinc/41/99/87/1053419987.db2.gz ZIVRUSREMNLPOE-LLVKDONJSA-N 0 1 309.331 4.306 20 0 DIADMN Cc1cccc(OC[C@H](C)Oc2ccc(F)cc2CN(C)C)c1 ZINC001229859071 1053420290 /nfs/dbraw/zinc/42/02/90/1053420290.db2.gz WSPOYFKSJUPTDP-HNNXBMFYSA-N 0 1 317.404 4.042 20 0 DIADMN C[C@H]1CCc2nc(CNCc3cccc4ncccc34)sc2C1 ZINC001352864808 1053421154 /nfs/dbraw/zinc/42/11/54/1053421154.db2.gz UWEVVTMTQMEUBB-ZDUSSCGKSA-N 0 1 323.465 4.106 20 0 DIADMN C[C@H](c1cc2ccccc2o1)N(C)C(=O)c1cccc(F)c1O ZINC001352896063 1053428423 /nfs/dbraw/zinc/42/84/23/1053428423.db2.gz BQGOQSAENUAWRL-LLVKDONJSA-N 0 1 313.328 4.111 20 0 DIADMN Cc1cc(C)c2c(c1)CCN(Cc1nc3ccccc3nc1C)C2 ZINC001474760707 1053428497 /nfs/dbraw/zinc/42/84/97/1053428497.db2.gz WEXDMAGNMYIKNS-UHFFFAOYSA-N 0 1 317.436 4.113 20 0 DIADMN CCCC(C)=CC(=O)Nc1ccc(-c2nc3ccccc3[nH]2)cn1 ZINC001352904197 1053429269 /nfs/dbraw/zinc/42/92/69/1053429269.db2.gz GDHMJUSMDXFCFC-QBFSEMIESA-N 0 1 320.396 4.310 20 0 DIADMN c1cn(-c2ccccc2)c(NCc2cnc3ccccc3c2)n1 ZINC001321880730 1053440058 /nfs/dbraw/zinc/44/00/58/1053440058.db2.gz XADMLLKCTAQHJU-UHFFFAOYSA-N 0 1 300.365 4.033 20 0 DIADMN Cn1ccnc1[C@H]1CCCN(Cc2cccc(Cl)c2Cl)C1 ZINC000446835760 1053440226 /nfs/dbraw/zinc/44/02/26/1053440226.db2.gz QCXMQHDXXWHYJG-ZDUSSCGKSA-N 0 1 324.255 4.107 20 0 DIADMN Brc1ccc(CN[C@H]2CCCc3ccccc32)nc1 ZINC000070395669 1053443722 /nfs/dbraw/zinc/44/37/22/1053443722.db2.gz FGZXRQUKLDVZJV-INIZCTEOSA-N 0 1 317.230 4.011 20 0 DIADMN C[C@@H](Oc1nc[nH]c(=O)c1Cl)c1ccc(Cl)c(Cl)c1 ZINC001230013914 1053455463 /nfs/dbraw/zinc/45/54/63/1053455463.db2.gz JIFQCZBQSWAQPW-ZCFIWIBFSA-N 0 1 319.575 4.282 20 0 DIADMN C[C@@H]1CN([C@H]2CCc3c2cccc3F)C[C@@H](c2ccccc2)O1 ZINC001322271855 1053475344 /nfs/dbraw/zinc/47/53/44/1053475344.db2.gz IGFCHCBTFUEOIZ-UAOJZALGSA-N 0 1 311.400 4.275 20 0 DIADMN Cc1nc(CN2CCC(c3ccc(F)c(F)c3)CC2)c(C)s1 ZINC001322277730 1053477631 /nfs/dbraw/zinc/47/76/31/1053477631.db2.gz LKWULARHMUMNDH-UHFFFAOYSA-N 0 1 322.424 4.418 20 0 DIADMN Cc1nc(-c2ccccc2)[nH]c1C(=O)Nc1ccc2cc[nH]c2c1 ZINC001322312161 1053482988 /nfs/dbraw/zinc/48/29/88/1053482988.db2.gz GFDHKGQGOULHKD-UHFFFAOYSA-N 0 1 316.364 4.119 20 0 DIADMN C[C@H]1CC[C@H](C(=O)Nc2ccc(Nc3ccncc3)cc2)CC1 ZINC001300214158 1053492424 /nfs/dbraw/zinc/49/24/24/1053492424.db2.gz HCPSYWJBJJMGAG-SHTZXODSSA-N 0 1 309.413 4.012 20 0 DIADMN CCCCC[C@H](CC)C(=O)N1CCN(C)CC12CCCCC2 ZINC001435294439 1053502314 /nfs/dbraw/zinc/50/23/14/1053502314.db2.gz AIHDYSRVMBGLLO-KRWDZBQOSA-N 0 1 308.510 4.070 20 0 DIADMN COc1ccc([C@H](C)N[C@H](C)c2ccoc2)cc1Br ZINC000094868586 1053513009 /nfs/dbraw/zinc/51/30/09/1053513009.db2.gz CTXHTYWBHGRQMA-WDEREUQCSA-N 0 1 324.218 4.463 20 0 DIADMN CC(=O)c1cccc(C)c1O[C@H]1CCCN(Cc2ccccc2)C1 ZINC001230319845 1053519788 /nfs/dbraw/zinc/51/97/88/1053519788.db2.gz ZHVIIDRIJBNTAL-IBGZPJMESA-N 0 1 323.436 4.241 20 0 DIADMN Cc1ncc(CN[C@@H]2CCCc3c4cccc(Cl)c4[nH]c32)o1 ZINC001353355185 1053548362 /nfs/dbraw/zinc/54/83/62/1053548362.db2.gz YFCBBVHODACDIS-OAHLLOKOSA-N 0 1 315.804 4.285 20 0 DIADMN COc1ccc(OCCCNCc2c(F)cccc2Cl)cc1 ZINC000619776866 1053556155 /nfs/dbraw/zinc/55/61/55/1053556155.db2.gz CEXZQONQEJSZQY-UHFFFAOYSA-N 0 1 323.795 4.046 20 0 DIADMN CCOC(=O)c1csc([C@H]2CCCN2C[C@@H](C)C(C)(C)C)n1 ZINC000619845983 1053566151 /nfs/dbraw/zinc/56/61/51/1053566151.db2.gz HUYHXYAUPXTNNK-TZMCWYRMSA-N 0 1 324.490 4.139 20 0 DIADMN CC(C)(C)c1n[nH]cc1CN[C@H]1CCc2sc(Cl)cc21 ZINC000572565928 1053573626 /nfs/dbraw/zinc/57/36/26/1053573626.db2.gz QWXWKPXUZJMWNE-NSHDSACASA-N 0 1 309.866 4.199 20 0 DIADMN C[C@H](Cc1ccc(Cl)cc1)[N@@H+](C)Cc1ccc(C(=O)[O-])cc1 ZINC000262532365 1053577764 /nfs/dbraw/zinc/57/77/64/1053577764.db2.gz PUSRKEISTBHXKC-CYBMUJFWSA-N 0 1 317.816 4.101 20 0 DIADMN Clc1cc(Cl)c2nc(CN3CC4CCC3CC4)cn2c1 ZINC001323380955 1053578088 /nfs/dbraw/zinc/57/80/88/1053578088.db2.gz NHTGHTDNAROUGY-UHFFFAOYSA-N 0 1 310.228 4.016 20 0 DIADMN Cc1ccc(Cl)c(CN2CC[C@@H](C)[C@@](C)(O)CC2)c1Cl ZINC001237328557 1053578390 /nfs/dbraw/zinc/57/83/90/1053578390.db2.gz PZJKRUNZLJOZIA-WBMJQRKESA-N 0 1 316.272 4.285 20 0 DIADMN COc1cc([C@@H](C)NCc2ccccc2OC(C)C)ccc1F ZINC000153101013 1053579635 /nfs/dbraw/zinc/57/96/35/1053579635.db2.gz FAEXZWSFTFWBHS-CQSZACIVSA-N 0 1 317.404 4.472 20 0 DIADMN CN(C)Cc1ccc(N[C@H]2CCc3nc(Cl)ccc32)cc1F ZINC001323418236 1053580375 /nfs/dbraw/zinc/58/03/75/1053580375.db2.gz WEEUWRHUQQOHFA-HNNXBMFYSA-N 0 1 319.811 4.035 20 0 DIADMN CC(C)c1nn(Cc2ccccc2)c(Cl)c1CNC1(C)CC1 ZINC001323475295 1053582814 /nfs/dbraw/zinc/58/28/14/1053582814.db2.gz JYMDBCGXNMZTGL-UHFFFAOYSA-N 0 1 317.864 4.350 20 0 DIADMN CCOc1ccccc1CN[C@H](C)c1ccc(F)c(OC)c1 ZINC000153127615 1053586497 /nfs/dbraw/zinc/58/64/97/1053586497.db2.gz QOXJNJKOUHANNN-CYBMUJFWSA-N 0 1 303.377 4.084 20 0 DIADMN Cc1ccc(C(=O)C2CCN([C@H](C)c3ccncc3)CC2)c(C)c1 ZINC000619970195 1053588980 /nfs/dbraw/zinc/58/89/80/1053588980.db2.gz XGOAJKGPEFTMKN-QGZVFWFLSA-N 0 1 322.452 4.354 20 0 DIADMN O=C(c1cc(Cl)c2ccccc2c1O)N1C[C@H]2CCCC[C@H]21 ZINC001300327838 1053596437 /nfs/dbraw/zinc/59/64/37/1053596437.db2.gz DRFOPIFHPSKIOJ-BDJLRTHQSA-N 0 1 315.800 4.213 20 0 DIADMN C[C@H]1c2ccsc2CCN1Cc1ccccc1N1CCCC1 ZINC001323795525 1053601377 /nfs/dbraw/zinc/60/13/77/1053601377.db2.gz ZISJTMZKZYNUFB-HNNXBMFYSA-N 0 1 312.482 4.468 20 0 DIADMN CC(=O)c1cc2c(cc1O[C@@H]1CCC[N@H+](C(C)C)C1)CCCC2 ZINC001230790744 1053604183 /nfs/dbraw/zinc/60/41/83/1053604183.db2.gz TVNRBCYHXUMHAE-GOSISDBHSA-N 0 1 315.457 4.020 20 0 DIADMN CC(C)N1CC[C@@H](Oc2c(Cl)cccc2C(F)(F)F)C1 ZINC001230825288 1053608086 /nfs/dbraw/zinc/60/80/86/1053608086.db2.gz ATAWHKDXYAAXCB-SNVBAGLBSA-N 0 1 307.743 4.220 20 0 DIADMN Oc1ccc(CN[C@@H]2CCCOc3c(Cl)cccc32)cc1F ZINC000153403371 1053611781 /nfs/dbraw/zinc/61/17/81/1053611781.db2.gz OXMDTRJCSWZWFK-OAHLLOKOSA-N 0 1 321.779 4.188 20 0 DIADMN CO[C@@H](C)c1nc(CN[C@H](C)Cc2ccccc2Cl)cs1 ZINC001324005305 1053615166 /nfs/dbraw/zinc/61/51/66/1053615166.db2.gz VSHGYWKHRRKGCU-NEPJUHHUSA-N 0 1 324.877 4.225 20 0 DIADMN COc1cccc2cc(CN[C@H](C)c3ccnc(Cl)c3)oc21 ZINC001323991959 1053615297 /nfs/dbraw/zinc/61/52/97/1053615297.db2.gz PDELPSAHUFOXTQ-LLVKDONJSA-N 0 1 316.788 4.341 20 0 DIADMN COc1ccc(CN[C@@H](C)c2ccc(SC)cc2)c(F)c1 ZINC000404653675 1053616829 /nfs/dbraw/zinc/61/68/29/1053616829.db2.gz LVUNPMIHVYUIGM-LBPRGKRZSA-N 0 1 305.418 4.407 20 0 DIADMN CC(C)CCc1noc(CN2CC[C@H](C)[C@H]3CCCC[C@@H]32)n1 ZINC000620278122 1053636206 /nfs/dbraw/zinc/63/62/06/1053636206.db2.gz LIKRNIJSLKEKQW-XHSDSOJGSA-N 0 1 305.466 4.059 20 0 DIADMN CCc1ccc(-c2n[nH]c(S[C@@H]3C[C@@H](C)O[C@@H](C)C3)n2)cc1 ZINC001324254538 1053638080 /nfs/dbraw/zinc/63/80/80/1053638080.db2.gz VXLBUQNYNYZCCG-JJLQDPRZSA-N 0 1 317.458 4.082 20 0 DIADMN CCN(Cc1ccccc1F)C[C@@H](O)c1cc2ccccc2o1 ZINC001324258863 1053638850 /nfs/dbraw/zinc/63/88/50/1053638850.db2.gz RIIKNRSFLGALPV-QGZVFWFLSA-N 0 1 313.372 4.127 20 0 DIADMN C[C@H](NCc1cccn1C1CC1)c1ccc(F)cc1OC(F)F ZINC001324371405 1053648436 /nfs/dbraw/zinc/64/84/36/1053648436.db2.gz ZPYFHTYLDAQTCX-NSHDSACASA-N 0 1 324.346 4.414 20 0 DIADMN CC(C)[C@]1(CO)CCN([C@H](C)c2ccc(Cl)c(Cl)c2)C1 ZINC001324571812 1053662765 /nfs/dbraw/zinc/66/27/65/1053662765.db2.gz SMEQJKQOKSTTTA-MLGOLLRUSA-N 0 1 316.272 4.395 20 0 DIADMN Cc1cc[nH]c2nc(O[C@@H](C)c3cc(-c4ccccc4)no3)nc1-2 ZINC001231063303 1053664803 /nfs/dbraw/zinc/66/48/03/1053664803.db2.gz FTWJPQWHBVARHH-LBPRGKRZSA-N 0 1 320.352 4.061 20 0 DIADMN CCCn1c2ccccc2nc1CN(C)[C@H]1CC[C@H](SC)C1 ZINC001324753883 1053677400 /nfs/dbraw/zinc/67/74/00/1053677400.db2.gz ZPPXTSHYKULULL-GJZGRUSLSA-N 0 1 317.502 4.162 20 0 DIADMN C(=Cc1ccccc1)c1n[nH]c(SCc2ncoc2C2CC2)n1 ZINC001324779791 1053680078 /nfs/dbraw/zinc/68/00/78/1053680078.db2.gz ZQUFXTGMVHIXTL-TWGQIWQCSA-N 0 1 324.409 4.133 20 0 DIADMN Fc1c(Cl)cccc1CNCc1ccc2cnccc2c1 ZINC001324824005 1053683092 /nfs/dbraw/zinc/68/30/92/1053683092.db2.gz KLDDLNAZVXBOTO-UHFFFAOYSA-N 0 1 300.764 4.317 20 0 DIADMN Cc1ccc(C)n1C1CCN(Cc2ncoc2C(C)C)CC1 ZINC001324804554 1053683354 /nfs/dbraw/zinc/68/33/54/1053683354.db2.gz YJZDNRDNYGHXIW-UHFFFAOYSA-N 0 1 301.434 4.053 20 0 DIADMN COc1ccccc1C1(NCc2cnc(Cl)c(C)c2)CCC1 ZINC001324923887 1053689604 /nfs/dbraw/zinc/68/96/04/1053689604.db2.gz HQVZSEIFGFEIGV-UHFFFAOYSA-N 0 1 316.832 4.221 20 0 DIADMN O=C(c1cc(-c2ccccc2)[nH]n1)N1CC[C@@H](C2CCCCC2)C1 ZINC001300437849 1053691815 /nfs/dbraw/zinc/69/18/15/1053691815.db2.gz LNAPFBPELYNNRG-QGZVFWFLSA-N 0 1 323.440 4.119 20 0 DIADMN COC1=CC[C@H](Oc2ccccc2C(=O)c2ccccc2O)CC1 ZINC001231214445 1053701286 /nfs/dbraw/zinc/70/12/86/1053701286.db2.gz GNMSCBHLAWOUIY-HNNXBMFYSA-N 0 1 324.376 4.085 20 0 DIADMN CCCCCC(=O)c1ccc(O[C@@H]2CC[N@H+](C(C)C)C2)cc1 ZINC001231256934 1053711303 /nfs/dbraw/zinc/71/13/03/1053711303.db2.gz JPWVCZIAOPFORK-GOSISDBHSA-N 0 1 303.446 4.311 20 0 DIADMN C[C@H]1C[C@@H](NCc2cc(OCC(F)F)ccn2)c2ccccc21 ZINC001325343569 1053715645 /nfs/dbraw/zinc/71/56/45/1053715645.db2.gz 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O=C([O-])c1ccc(F)c(C[N@H+]2CCCC[C@H]2c2ccccc2)c1 ZINC001231457222 1053755050 /nfs/dbraw/zinc/75/50/50/1053755050.db2.gz PFPJAOXKPBSBNC-SFHVURJKSA-N 0 1 313.372 4.251 20 0 DIADMN Cc1cccc2nc(CNC(=O)CC[C@@H](C)c3ccccc3)[nH]c21 ZINC000154985977 1053755299 /nfs/dbraw/zinc/75/52/99/1053755299.db2.gz FTUFPFLGKBEYOD-CQSZACIVSA-N 0 1 321.424 4.071 20 0 DIADMN Cc1ncccc1CN(C)Cc1ccc2cc(N(C)C)ccc2c1 ZINC001231443246 1053756051 /nfs/dbraw/zinc/75/60/51/1053756051.db2.gz GSLUUGKOVGZJPJ-UHFFFAOYSA-N 0 1 319.452 4.241 20 0 DIADMN C[N@@H+](Cc1ccc(C(=O)[O-])s1)Cc1ccc2ccccc2c1 ZINC001231466049 1053758180 /nfs/dbraw/zinc/75/81/80/1053758180.db2.gz QKLDZMJEFINNNY-UHFFFAOYSA-N 0 1 311.406 4.232 20 0 DIADMN Cc1cc(C)cc([C@@H]2CCC[N@H+]2Cc2ccc(C(=O)[O-])s2)c1 ZINC001231465655 1053758336 /nfs/dbraw/zinc/75/83/36/1053758336.db2.gz OBZKJLADFXPDMV-INIZCTEOSA-N 0 1 315.438 4.400 20 0 DIADMN Brc1ccc(CNCc2ccc3c(c2)CCCC3)o1 ZINC001326125348 1053758760 /nfs/dbraw/zinc/75/87/60/1053758760.db2.gz 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COc1cc(C)c(CN[C@H](C)c2ccc(F)cc2F)cc1OC ZINC000156024632 1053795009 /nfs/dbraw/zinc/79/50/09/1053795009.db2.gz KGUUREVNHPWKDV-GFCCVEGCSA-N 0 1 321.367 4.141 20 0 DIADMN c1oc(-c2ccccc2)nc1CN[C@@H]1C[C@H]1Cc1ccccc1 ZINC001200589496 1053795185 /nfs/dbraw/zinc/79/51/85/1053795185.db2.gz CBOVRDXBOQAENS-IEBWSBKVSA-N 0 1 304.393 4.062 20 0 DIADMN Oc1ccc([C@H]2CCCN2Cc2ccccc2OC(F)F)cc1 ZINC000620934731 1053797117 /nfs/dbraw/zinc/79/71/17/1053797117.db2.gz OYQOKWQRDWFEPF-MRXNPFEDSA-N 0 1 319.351 4.331 20 0 DIADMN COc1ccc2c(c1)[C@H](NCc1ccccc1OCC1CC1)CC2 ZINC000156175507 1053799066 /nfs/dbraw/zinc/79/90/66/1053799066.db2.gz ZGVWAPCTMVMLDZ-HXUWFJFHSA-N 0 1 323.436 4.261 20 0 DIADMN COc1cc(F)ccc1CN1CCC(c2ccc(F)cc2)CC1 ZINC001231603971 1053801977 /nfs/dbraw/zinc/80/19/77/1053801977.db2.gz SARGFNSBBATRSI-UHFFFAOYSA-N 0 1 317.379 4.353 20 0 DIADMN Cc1cc(CN2CC=C(c3ccc(Cl)nc3)CC2)cs1 ZINC001326755672 1053802395 /nfs/dbraw/zinc/80/23/95/1053802395.db2.gz BSIXTUYBGLYJHT-UHFFFAOYSA-N 0 1 304.846 4.394 20 0 DIADMN COc1cccc([C@@H]2CCCN2Cc2ccc(F)cc2OC)c1 ZINC001231607145 1053802623 /nfs/dbraw/zinc/80/26/23/1053802623.db2.gz WKYZEEUHMKWMDW-SFHVURJKSA-N 0 1 315.388 4.180 20 0 DIADMN CCO[C@H]1C[C@@H](NCc2csc(C(C)C)n2)C12CCCCC2 ZINC001200601198 1053803477 /nfs/dbraw/zinc/80/34/77/1053803477.db2.gz MLIFRQFEDHDOQH-CVEARBPZSA-N 0 1 322.518 4.484 20 0 DIADMN COc1ccccc1[C@@H](C)NCc1ccccc1OCC1CC1 ZINC000156193196 1053803219 /nfs/dbraw/zinc/80/32/19/1053803219.db2.gz AGYRXXPGHUNDBA-OAHLLOKOSA-N 0 1 311.425 4.335 20 0 DIADMN COc1cc(C)c(CN2CC3(C2)CC(F)(F)C3)cc1C(C)C ZINC001231625361 1053804102 /nfs/dbraw/zinc/80/41/02/1053804102.db2.gz UOLDXNNNYRLVSK-UHFFFAOYSA-N 0 1 309.400 4.358 20 0 DIADMN FC(F)c1cccc(CN[C@@H]2CCc3c2nccc3Cl)c1 ZINC001354241009 1053805121 /nfs/dbraw/zinc/80/51/21/1053805121.db2.gz HFNXCJYNFUQTDZ-CQSZACIVSA-N 0 1 308.759 4.450 20 0 DIADMN COc1cccc(CCN(C)Cc2coc(-c3ccccc3)n2)c1 ZINC001231631570 1053808203 /nfs/dbraw/zinc/80/82/03/1053808203.db2.gz DABFINSODLIUHK-UHFFFAOYSA-N 0 1 322.408 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CCCC(C)(C)C(=O)Nc1nc2ccc(Br)cc2[nH]1 ZINC001354623369 1053926477 /nfs/dbraw/zinc/92/64/77/1053926477.db2.gz YDCWYDIFHZKHSE-UHFFFAOYSA-N 0 1 324.222 4.090 20 0 DIADMN Fc1ccc(F)c([C@H]2CCCN2Cc2cccc3c[nH]nc32)c1 ZINC001231972818 1053926638 /nfs/dbraw/zinc/92/66/38/1053926638.db2.gz VJZWBIZDBVYWRT-QGZVFWFLSA-N 0 1 313.351 4.178 20 0 DIADMN O=C([O-])c1sc2ccccc2c1C[N@H+]1CCC[C@H]2CCC[C@@H]21 ZINC000316096622 1053928293 /nfs/dbraw/zinc/92/82/93/1053928293.db2.gz QTNAVZHMYPLYBR-DOMZBBRYSA-N 0 1 315.438 4.364 20 0 DIADMN CCCCN(CCCC)Cc1ncc(Br)cc1F ZINC001231989267 1053930589 /nfs/dbraw/zinc/93/05/89/1053930589.db2.gz YSOPQFOIODKOAQ-UHFFFAOYSA-N 0 1 317.246 4.385 20 0 DIADMN COc1cccc([C@H]2CCCCN2Cc2cnc(F)cc2C)c1 ZINC001231982611 1053930847 /nfs/dbraw/zinc/93/08/47/1053930847.db2.gz ACCGXSXRUCABPU-GOSISDBHSA-N 0 1 314.404 4.265 20 0 DIADMN Cc1cc(CN(C)Cc2cccc(C(F)(F)F)c2)cc(C)n1 ZINC001232000668 1053934570 /nfs/dbraw/zinc/93/45/70/1053934570.db2.gz RLCPMPDZQXKBQS-UHFFFAOYSA-N 0 1 308.347 4.349 20 0 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C[N@@H+]1CCCC[C@H]1c1ccc(-c2c(F)ccc([O-])c2Cl)nc1 ZINC001245829591 1058523810 /nfs/dbraw/zinc/52/38/10/1058523810.db2.gz AZUJMCBRIUZISG-AWEZNQCLSA-N 0 1 320.795 4.404 20 0 DIADMN C[N@H+]1CCCC[C@H]1c1ccc(-c2c(F)ccc([O-])c2Cl)nc1 ZINC001245829591 1058523832 /nfs/dbraw/zinc/52/38/32/1058523832.db2.gz AZUJMCBRIUZISG-AWEZNQCLSA-N 0 1 320.795 4.404 20 0 DIADMN C[N@H+]1CC[C@H](c2ccc(-c3c(F)ccc(O)c3Cl)cc2)C1 ZINC001245833772 1058537724 /nfs/dbraw/zinc/53/77/24/1058537724.db2.gz BKQOHRGTGALFNL-ZDUSSCGKSA-N 0 1 305.780 4.271 20 0 DIADMN C[N@@H+]1CC[C@H](c2ccc(-c3c(F)ccc([O-])c3Cl)cc2)C1 ZINC001245833772 1058537746 /nfs/dbraw/zinc/53/77/46/1058537746.db2.gz BKQOHRGTGALFNL-ZDUSSCGKSA-N 0 1 305.780 4.271 20 0 DIADMN C[N@H+]1CC[C@H](c2ccc(-c3c(F)ccc([O-])c3Cl)cc2)C1 ZINC001245833772 1058537758 /nfs/dbraw/zinc/53/77/58/1058537758.db2.gz BKQOHRGTGALFNL-ZDUSSCGKSA-N 0 1 305.780 4.271 20 0 DIADMN COc1cc(-c2cccc3nc(C)[nH]c32)c(F)c(F)c1Cl ZINC001245860196 1058568501 /nfs/dbraw/zinc/56/85/01/1058568501.db2.gz BOVGJMIHEDQNIP-UHFFFAOYSA-N 0 1 308.715 4.479 20 0 DIADMN CC(C)[C@H](C(=O)NOC1CCCCC1)c1cccc(Cl)c1 ZINC001556300446 1058576671 /nfs/dbraw/zinc/57/66/71/1058576671.db2.gz TVDANMPGUAXFKJ-INIZCTEOSA-N 0 1 309.837 4.460 20 0 DIADMN CC[C@H](C)c1nc([C@H](C)NC(=O)CCC2CCCCCC2)n[nH]1 ZINC001556485195 1058600084 /nfs/dbraw/zinc/60/00/84/1058600084.db2.gz RGPJJZRPOIDBFT-KBPBESRZSA-N 0 1 320.481 4.246 20 0 DIADMN COc1ccc(F)c(-c2cnc3nc(C)[nH]c3c2C)c1Cl ZINC001245889391 1058601284 /nfs/dbraw/zinc/60/12/84/1058601284.db2.gz WTBMCGQBOKTVJP-UHFFFAOYSA-N 0 1 305.740 4.043 20 0 DIADMN CSc1cnc(-c2ccc3cncn3c2)c(C(F)(F)F)c1 ZINC001245895507 1058603953 /nfs/dbraw/zinc/60/39/53/1058603953.db2.gz YRHMRCFLMOUUCR-UHFFFAOYSA-N 0 1 309.316 4.137 20 0 DIADMN Fc1cc(O[C@@H]2CCCCO2)ccc1-c1ccc2cncn2c1 ZINC001245900914 1058606536 /nfs/dbraw/zinc/60/65/36/1058606536.db2.gz WFGAYHNPGCQIDU-GOSISDBHSA-N 0 1 312.344 4.046 20 0 DIADMN c1coc(-c2csc3ncnc(-c4ccc5cncn5c4)c23)c1 ZINC001245897578 1058606651 /nfs/dbraw/zinc/60/66/51/1058606651.db2.gz AWSYLERRVWCFDZ-UHFFFAOYSA-N 0 1 318.361 4.266 20 0 DIADMN COc1ccc(-c2ccccn2)cc1-c1ccc2cncn2c1 ZINC001245896768 1058606874 /nfs/dbraw/zinc/60/68/74/1058606874.db2.gz QDMASORGXBZILK-UHFFFAOYSA-N 0 1 301.349 4.072 20 0 DIADMN COc1ccc(-c2cccnc2)cc1-c1ccc2cncn2c1 ZINC001245896132 1058608100 /nfs/dbraw/zinc/60/81/00/1058608100.db2.gz KJWXGDRGOGERDP-UHFFFAOYSA-N 0 1 301.349 4.072 20 0 DIADMN O=c1cc(C2CC2)[nH]n1-c1cccc(OCc2ccccc2)c1 ZINC001245911520 1058613640 /nfs/dbraw/zinc/61/36/40/1058613640.db2.gz TXCAAQXJZCLXID-UHFFFAOYSA-N 0 1 306.365 4.034 20 0 DIADMN O=c1cc(C2CC2)[nH]n1-c1ccc(Cl)cc1C(F)(F)F ZINC001245910528 1058613710 /nfs/dbraw/zinc/61/37/10/1058613710.db2.gz KCVBVCYVBXJBPV-UHFFFAOYSA-N 0 1 302.683 4.128 20 0 DIADMN COc1ccc(-n2[nH]c(-c3ccc(Cl)cc3)cc2=O)cc1F ZINC001245911648 1058615995 /nfs/dbraw/zinc/61/59/95/1058615995.db2.gz CVKIPKMHQDJNQZ-UHFFFAOYSA-N 0 1 318.735 4.046 20 0 DIADMN CC[C@@H](NC(=O)c1cccc2nc(C(F)F)[nH]c21)C1CCCC1 ZINC001556591622 1058616136 /nfs/dbraw/zinc/61/61/36/1058616136.db2.gz DOZLOUCEIPTKHD-GFCCVEGCSA-N 0 1 321.371 4.199 20 0 DIADMN O=C1CC(c2ccc(F)cc2)=NN1[C@H]1CCc2ccccc2C1 ZINC001245917988 1058621470 /nfs/dbraw/zinc/62/14/70/1058621470.db2.gz PREWHTZKUDXEKF-KRWDZBQOSA-N 0 1 308.356 4.125 20 0 DIADMN Cc1ccc(-c2cc(=O)n(-c3ccc4ncccc4c3)[nH]2)cc1 ZINC001245919217 1058621529 /nfs/dbraw/zinc/62/15/29/1058621529.db2.gz OHSBCVHQRWHMFJ-UHFFFAOYSA-N 0 1 301.349 4.102 20 0 DIADMN O=c1cc(C2CCC2)[nH]n1-c1ccc(SC(F)(F)F)cc1 ZINC001245923187 1058625684 /nfs/dbraw/zinc/62/56/84/1058625684.db2.gz MUIYUTACILQUEC-UHFFFAOYSA-N 0 1 314.332 4.457 20 0 DIADMN C[C@@H]1CC(C)(C)N(C(=O)c2cccc(F)c2O)c2ccccc21 ZINC001520513591 1058627821 /nfs/dbraw/zinc/62/78/21/1058627821.db2.gz KTHSNYLBDDYPMY-GFCCVEGCSA-N 0 1 313.372 4.464 20 0 DIADMN O=c1cc(Cc2cc(F)c(F)cc2F)[nH]n1CC1CCCCC1 ZINC001245928561 1058628973 /nfs/dbraw/zinc/62/89/73/1058628973.db2.gz BDNDNSODBWNVSP-UHFFFAOYSA-N 0 1 324.346 4.177 20 0 DIADMN O=c1cc(Cc2ccccc2F)[nH]n1-c1cc(F)cc(Cl)c1 ZINC001245935431 1058632137 /nfs/dbraw/zinc/63/21/37/1058632137.db2.gz OHUNQSLCBUJUPL-UHFFFAOYSA-N 0 1 320.726 4.100 20 0 DIADMN O=c1cc(Cc2ccccc2F)[nH]n1-c1ccc(Cl)cc1F ZINC001245932288 1058632928 /nfs/dbraw/zinc/63/29/28/1058632928.db2.gz LCRBWFREIHXUDE-UHFFFAOYSA-N 0 1 320.726 4.100 20 0 DIADMN O=c1cc(Cc2ccccc2F)[nH]n1-c1cccc(F)c1Cl ZINC001245935390 1058633680 /nfs/dbraw/zinc/63/36/80/1058633680.db2.gz NJLACCODQQBMNM-UHFFFAOYSA-N 0 1 320.726 4.100 20 0 DIADMN Cc1ccccc1-c1cc(=O)n(-c2cnc3ccccc3c2)[nH]1 ZINC001245936701 1058635879 /nfs/dbraw/zinc/63/58/79/1058635879.db2.gz QQKCRVFNLMTWKA-UHFFFAOYSA-N 0 1 301.349 4.102 20 0 DIADMN O=c1cc(Cc2ccccc2F)[nH]n1-c1ccc(F)cc1Cl ZINC001245936531 1058636878 /nfs/dbraw/zinc/63/68/78/1058636878.db2.gz WWVJNPBMVSZHHC-UHFFFAOYSA-N 0 1 320.726 4.100 20 0 DIADMN CCC(=O)c1ccc(O)c(NC(=O)[C@@H]2[C@H](C=C(C)C)C2(C)C)c1 ZINC001556762955 1058638016 /nfs/dbraw/zinc/63/80/16/1058638016.db2.gz BIKVHRJNYZLOIK-GUYCJALGSA-N 0 1 315.413 4.162 20 0 DIADMN O=c1cc(-c2ccc(O)cc2)[nH]n1-c1cccc2ccccc21 ZINC001245942425 1058640334 /nfs/dbraw/zinc/64/03/34/1058640334.db2.gz VQRLKCIEMPBIOW-UHFFFAOYSA-N 0 1 302.333 4.104 20 0 DIADMN O=c1cc(C2CCOCC2)[nH]n1-c1ccccc1-c1ccccc1 ZINC001245944019 1058640710 /nfs/dbraw/zinc/64/07/10/1058640710.db2.gz ZOXGBRTUIHWJTP-UHFFFAOYSA-N 0 1 320.392 4.139 20 0 DIADMN O=c1cc(C2CCOCC2)[nH]n1-c1ccc(-c2ccccc2)cc1 ZINC001245943975 1058640933 /nfs/dbraw/zinc/64/09/33/1058640933.db2.gz YYIVVVIEFWDMHC-UHFFFAOYSA-N 0 1 320.392 4.139 20 0 DIADMN Cc1ccc2nc(NC(=O)c3cc(C)ccc3NC3CC3)[nH]c2c1 ZINC001556788805 1058641714 /nfs/dbraw/zinc/64/17/14/1058641714.db2.gz JGCIIGWPFURFLE-UHFFFAOYSA-N 0 1 320.396 4.006 20 0 DIADMN CCCCN(C(=O)c1cc(CCC)[nH]n1)[C@H]1CCC[C@H](C)C1 ZINC001556806350 1058644511 /nfs/dbraw/zinc/64/45/11/1058644511.db2.gz JRRJVCIPFQDHJW-HOCLYGCPSA-N 0 1 305.466 4.183 20 0 DIADMN Cc1ccc(/C=C\CC(=O)Nc2ccc(F)c(F)c2O)cc1 ZINC001556934195 1058669546 /nfs/dbraw/zinc/66/95/46/1058669546.db2.gz AVJDOGNSSBSZDG-IHWYPQMZSA-N 0 1 303.308 4.021 20 0 DIADMN CCN(C)[C@@H](C(=O)NC[C@H]1CCCC(C)(C)C1)c1ccccc1 ZINC001557039969 1058689411 /nfs/dbraw/zinc/68/94/11/1058689411.db2.gz MTFLTELYQJFDEE-FUHWJXTLSA-N 0 1 316.489 4.012 20 0 DIADMN CCCCCc1cc(C(=O)N(C)[C@@H]2CCC[C@H]2C(C)(C)C)n[nH]1 ZINC001557081364 1058694232 /nfs/dbraw/zinc/69/42/32/1058694232.db2.gz DECXBVYDDLPPGJ-NVXWUHKLSA-N 0 1 319.493 4.429 20 0 DIADMN CCN1[C@H](C)CN(C(=O)C=C2CCC(C(C)(C)C)CC2)C[C@@H]1C ZINC001557273238 1058722457 /nfs/dbraw/zinc/72/24/57/1058722457.db2.gz KZEYHOJIBFXGCO-BYICEURKSA-N 0 1 320.521 4.090 20 0 DIADMN Cc1ccc(C)c([C@@H](C)OC(=O)[C@@]2(F)CCN(C(C)(C)C)C2)c1 ZINC001521051232 1058743793 /nfs/dbraw/zinc/74/37/93/1058743793.db2.gz IYURSIOPPVZAMV-DNVCBOLYSA-N 0 1 321.436 4.120 20 0 DIADMN CC(C)Nc1ccccc1NC(=O)c1cc(-c2ccccc2)n[nH]1 ZINC001557530844 1058764810 /nfs/dbraw/zinc/76/48/10/1058764810.db2.gz YSLCROQTKOKHPL-UHFFFAOYSA-N 0 1 320.396 4.149 20 0 DIADMN CCCC[C@H](CC)CCCN(C)C(=O)c1cc(C(F)F)[nH]n1 ZINC001557561068 1058770270 /nfs/dbraw/zinc/77/02/70/1058770270.db2.gz IXGCXNQVNIDWQQ-LBPRGKRZSA-N 0 1 315.408 4.416 20 0 DIADMN CC[C@@H]1CCC[C@H](C)N1C(=O)c1ccc(CN2CCCCC2)o1 ZINC001529665668 1058788041 /nfs/dbraw/zinc/78/80/41/1058788041.db2.gz CWZWKOCQVZYFOO-JKSUJKDBSA-N 0 1 318.461 4.059 20 0 DIADMN CCC[C@@H](C(=O)Nc1nc2cc(Cl)c(F)cc2[nH]1)C(C)C ZINC001529674672 1058793970 /nfs/dbraw/zinc/79/39/70/1058793970.db2.gz NIUKEQWIXRFLJY-SECBINFHSA-N 0 1 311.788 4.366 20 0 DIADMN CCCC[C@@H](CC)CNC(=O)c1ccc(CN2CCCCC2)o1 ZINC001521258388 1058802369 /nfs/dbraw/zinc/80/23/69/1058802369.db2.gz MOKQCITYIJHVKO-MRXNPFEDSA-N 0 1 320.477 4.212 20 0 DIADMN Cc1ccc2sc(NC(=O)c3c(O)cccc3F)nc2c1C ZINC001557949277 1058819406 /nfs/dbraw/zinc/81/94/06/1058819406.db2.gz IAPFBOSPTFPASD-UHFFFAOYSA-N 0 1 316.357 4.010 20 0 DIADMN CCCCCC[N@@H+](C)CC(=O)N1CCC[C@@]1(C)c1ccccc1 ZINC001558121901 1058842577 /nfs/dbraw/zinc/84/25/77/1058842577.db2.gz BZNFUDOZZLATJA-FQEVSTJZSA-N 0 1 316.489 4.036 20 0 DIADMN CC(=O)c1c(C)cc(NC(=O)c2ccc(Cl)c(O)c2)cc1C ZINC001558148180 1058846416 /nfs/dbraw/zinc/84/64/16/1058846416.db2.gz JAICIZYGEKCQRQ-UHFFFAOYSA-N 0 1 317.772 4.117 20 0 DIADMN O=C(CCCCCc1cccs1)Nc1ccc2cncn2c1 ZINC001558590761 1058887361 /nfs/dbraw/zinc/88/73/61/1058887361.db2.gz ZXMDUVNNYPXMTP-UHFFFAOYSA-N 0 1 313.426 4.137 20 0 DIADMN CCCCCc1ccc(NC(=O)[C@@H]2CCCC[N@H+]2CC)cc1 ZINC001558907656 1058920790 /nfs/dbraw/zinc/92/07/90/1058920790.db2.gz CXAILLJFMGBDIF-SFHVURJKSA-N 0 1 302.462 4.232 20 0 DIADMN CCCCCc1ccc(NC(=O)[C@@H]2CCCCN2CC)cc1 ZINC001558907656 1058920808 /nfs/dbraw/zinc/92/08/08/1058920808.db2.gz CXAILLJFMGBDIF-SFHVURJKSA-N 0 1 302.462 4.232 20 0 DIADMN CC1(C)CCC(CC(=O)Nc2cccc(-c3cn[nH]n3)c2)CC1 ZINC001558963172 1058931337 /nfs/dbraw/zinc/93/13/37/1058931337.db2.gz ABCVISHCBJXNLR-UHFFFAOYSA-N 0 1 312.417 4.017 20 0 DIADMN CN(C)c1ccc2cc(NC(=O)c3ccc(F)cc3O)ccc2c1 ZINC001558982921 1058932646 /nfs/dbraw/zinc/93/26/46/1058932646.db2.gz PERZOBZPDFSVCR-UHFFFAOYSA-N 0 1 324.355 4.003 20 0 DIADMN CC1(C)CCC[C@H]1CNC(=O)c1c(O)cc(Cl)cc1Cl ZINC001558986889 1058934904 /nfs/dbraw/zinc/93/49/04/1058934904.db2.gz AOXHGTKFSKLOON-VIFPVBQESA-N 0 1 316.228 4.255 20 0 DIADMN O=C(CCCC1CC1)Nc1ccc2nc(-c3ccncc3)[nH]c2c1 ZINC001559030454 1058939906 /nfs/dbraw/zinc/93/99/06/1058939906.db2.gz TYZYQCWTBXVRSA-UHFFFAOYSA-N 0 1 320.396 4.144 20 0 DIADMN FC(F)(F)c1cnccc1N1CCC(Oc2ccccc2)CC1 ZINC001559066312 1058962208 /nfs/dbraw/zinc/96/22/08/1058962208.db2.gz RZOOCTOXFSRYBB-UHFFFAOYSA-N 0 1 322.330 4.148 20 0 DIADMN C[C@@H](CCC1CCCCC1)Nc1nc(Cl)nc2[nH]cnc21 ZINC001559104601 1058990339 /nfs/dbraw/zinc/99/03/39/1058990339.db2.gz QAPPNVIJMGPDIR-JTQLQIEISA-N 0 1 307.829 4.167 20 0 DIADMN Cc1nc2scc(CC(C)C)c2c(N2CCc3cnccc32)n1 ZINC001559120328 1059008742 /nfs/dbraw/zinc/00/87/42/1059008742.db2.gz BANIDTOJSIXIQK-UHFFFAOYSA-N 0 1 324.453 4.287 20 0 DIADMN FC(F)(F)c1ccc(CN2CC=C(c3ccccc3)CC2)nc1 ZINC000341832888 1059042547 /nfs/dbraw/zinc/04/25/47/1059042547.db2.gz CGODIRZPVWXOGG-UHFFFAOYSA-N 0 1 318.342 4.390 20 0 DIADMN Cc1cccc(OC(=O)c2ccc(CN3CCCCC3)o2)c1C ZINC001522494873 1059106598 /nfs/dbraw/zinc/10/65/98/1059106598.db2.gz IBDSBONWGPIBAO-UHFFFAOYSA-N 0 1 313.397 4.102 20 0 DIADMN FC(F)(F)c1cnccc1NCC1(C(F)(F)F)CCCC1 ZINC001559249821 1059120589 /nfs/dbraw/zinc/12/05/89/1059120589.db2.gz MIQJOGRTQYLWDJ-UHFFFAOYSA-N 0 1 312.257 4.057 20 0 DIADMN CCOc1ccc2nc(S[C@@H]3CCC[C@@H](OC)C3)[nH]c2c1 ZINC001559328138 1059167754 /nfs/dbraw/zinc/16/77/54/1059167754.db2.gz NNFYKWMEUXTHKM-DGCLKSJQSA-N 0 1 306.431 4.011 20 0 DIADMN CCCCCC[C@@H](C)C(=O)Nc1ccc(-c2nnc[nH]2)cc1F ZINC001530908453 1059183882 /nfs/dbraw/zinc/18/38/82/1059183882.db2.gz UPAKIHDBHYGKQI-GFCCVEGCSA-N 0 1 318.396 4.156 20 0 DIADMN CNc1ccc(-c2nc3ccc(OC(F)(F)F)cc3[nH]2)cc1 ZINC001247009474 1059239011 /nfs/dbraw/zinc/23/90/11/1059239011.db2.gz ZSNKKYMZJPVGPO-UHFFFAOYSA-N 0 1 307.275 4.170 20 0 DIADMN Nc1c(F)cccc1-c1nc2cc(C(F)(F)F)c(F)cc2[nH]1 ZINC001247014258 1059243075 /nfs/dbraw/zinc/24/30/75/1059243075.db2.gz HRNXTCMVZZOHBM-UHFFFAOYSA-N 0 1 313.229 4.109 20 0 DIADMN N[C@H](c1nc2cc(Oc3ccccc3)ccc2[nH]1)c1ccccc1 ZINC001247012648 1059243120 /nfs/dbraw/zinc/24/31/20/1059243120.db2.gz QMEHVRSMATXABK-IBGZPJMESA-N 0 1 315.376 4.403 20 0 DIADMN Fc1cc2[nH]c(-c3ccc4c(c3)NCC4)nc2cc1C(F)(F)F ZINC001247014360 1059243935 /nfs/dbraw/zinc/24/39/35/1059243935.db2.gz LVLQDSIQUWEEKH-UHFFFAOYSA-N 0 1 321.277 4.356 20 0 DIADMN c1cc(N2CCCC2)cc2[nH]c(-c3ccc4c(c3)CCCN4)nc12 ZINC001247015527 1059247011 /nfs/dbraw/zinc/24/70/11/1059247011.db2.gz SMBBTMHBQYUCKM-UHFFFAOYSA-N 0 1 318.424 4.188 20 0 DIADMN N[C@H](c1nc2cc(-c3cccs3)ccc2[nH]1)c1ccccc1 ZINC001247018447 1059247654 /nfs/dbraw/zinc/24/76/54/1059247654.db2.gz APJADAJYSVPMMW-KRWDZBQOSA-N 0 1 305.406 4.340 20 0 DIADMN N[C@H](c1nc2ccc(-c3cccs3)cc2[nH]1)c1ccccc1 ZINC001247018447 1059247669 /nfs/dbraw/zinc/24/76/69/1059247669.db2.gz 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CC[C@H](CCC(F)(F)F)N[C@H]1c2ccccc2OC[C@@H]1F ZINC001474705253 1062431330 /nfs/dbraw/zinc/43/13/30/1062431330.db2.gz KOIZKCTUWCXFRB-OSMZGAPFSA-N 0 1 305.315 4.169 20 0 DIADMN CC1(C)[C@H](Oc2ccccc2)C[C@@H]1NCc1nc2ccccc2o1 ZINC001474715737 1062442760 /nfs/dbraw/zinc/44/27/60/1062442760.db2.gz PNOKYLCQXDDOCB-ZWKOTPCHSA-N 0 1 322.408 4.164 20 0 DIADMN CCCc1ccc(CNCc2ccc(Br)o2)cc1 ZINC001255425064 1062446514 /nfs/dbraw/zinc/44/65/14/1062446514.db2.gz SCROSCYPXLYFDW-UHFFFAOYSA-N 0 1 308.219 4.284 20 0 DIADMN CC(C)Oc1ccnc(CN[C@H](C)c2ccc3c(c2)CCC3)c1 ZINC001459861210 1062453973 /nfs/dbraw/zinc/45/39/73/1062453973.db2.gz RCLFOLPUGNQTDU-OAHLLOKOSA-N 0 1 310.441 4.208 20 0 DIADMN CN(C)c1ccccc1CN[C@H](c1ccc(F)cc1F)C1CC1 ZINC001459864928 1062457402 /nfs/dbraw/zinc/45/74/02/1062457402.db2.gz KQBUYVCWBNHDFV-IBGZPJMESA-N 0 1 316.395 4.272 20 0 DIADMN Clc1ccc2sc(CN3CC(Cc4ccoc4)C3)cc2n1 ZINC001474740885 1062457776 /nfs/dbraw/zinc/45/77/76/1062457776.db2.gz RGBQDWZGRWWIHD-UHFFFAOYSA-N 0 1 318.829 4.217 20 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/nfs/dbraw/zinc/44/49/43/1063444943.db2.gz DOGMTQHQWAQQHF-UHFFFAOYSA-N 0 1 317.348 4.384 20 0 DIADMN Cc1nc(-c2cccc(C)c2)[nH]c1C(=O)Nc1c(C)cccc1F ZINC001546241104 1063445246 /nfs/dbraw/zinc/44/52/46/1063445246.db2.gz SDPLUATUYJAKLF-UHFFFAOYSA-N 0 1 323.371 4.393 20 0 DIADMN CCCCN(Cc1ccnc(N(C)C)c1)Cc1ccccc1F ZINC001473139818 1063446996 /nfs/dbraw/zinc/44/69/96/1063446996.db2.gz CUXDFJZQNSSXHI-UHFFFAOYSA-N 0 1 315.436 4.089 20 0 DIADMN CC1(C)CCCC[C@@H]1CN1CCO[C@H](c2cccc(F)c2)C1 ZINC001473145713 1063453193 /nfs/dbraw/zinc/45/31/93/1063453193.db2.gz XHIKELIZNFCZSA-AEFFLSMTSA-N 0 1 305.437 4.415 20 0 DIADMN CCC(CC)(NC1CCC(c2ccccc2)CC1)C(=O)OC ZINC001257996130 1063455159 /nfs/dbraw/zinc/45/51/59/1063455159.db2.gz NIVRCOFDQNBLSB-UHFFFAOYSA-N 0 1 303.446 4.034 20 0 DIADMN C[C@H](C(=O)Nc1cccc(F)c1)N1CCCC2(CCCCC2)C1 ZINC001473152309 1063455615 /nfs/dbraw/zinc/45/56/15/1063455615.db2.gz RVNFVTCQHCWYGA-OAHLLOKOSA-N 0 1 318.436 4.199 20 0 DIADMN CCOc1cc(Cl)ccc1CNCc1cccc(COC)c1 ZINC001461374915 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4.295 20 0 DIADMN CC(C)[C@H]1CN(Cc2ccc(-c3ncco3)cc2F)CCS1 ZINC001473188957 1063497404 /nfs/dbraw/zinc/49/74/04/1063497404.db2.gz MQBSQNAHDCVVIW-MRXNPFEDSA-N 0 1 320.433 4.054 20 0 DIADMN CSc1ncc2c(n1)CN([C@@H](C)C[C@@H](C)CC(C)C)CC2 ZINC001258075215 1063502194 /nfs/dbraw/zinc/50/21/94/1063502194.db2.gz SMULQWUTGCNLSG-KBPBESRZSA-N 0 1 307.507 4.017 20 0 DIADMN COc1cc2c(cc1OC)CN([C@@H](C)C[C@H](C)CC(C)C)C2 ZINC001258078294 1063506541 /nfs/dbraw/zinc/50/65/41/1063506541.db2.gz VWGZFPJILCCRKL-CABCVRRESA-N 0 1 305.462 4.480 20 0 DIADMN Fc1cc(CNCc2ccc3[nH]ccc3c2)c(F)cc1Cl ZINC001461475469 1063529746 /nfs/dbraw/zinc/52/97/46/1063529746.db2.gz TUBZMEPSQADSBJ-UHFFFAOYSA-N 0 1 306.743 4.389 20 0 DIADMN CC[C@H](CSC)NC(=O)c1cc(Cl)c2ccccc2c1O ZINC001546313236 1063532060 /nfs/dbraw/zinc/53/20/60/1063532060.db2.gz XLONZGCZMLXLIE-SNVBAGLBSA-N 0 1 323.845 4.070 20 0 DIADMN CC(=O)c1ccc(O)c(NC(=O)CCC2CCCCCC2)c1 ZINC001546315398 1063539186 /nfs/dbraw/zinc/53/91/86/1063539186.db2.gz 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ZINC001258290511 1063589881 /nfs/dbraw/zinc/58/98/81/1063589881.db2.gz UECYYBFIOKBWJF-ZDUSSCGKSA-N 0 1 309.251 4.129 20 0 DIADMN COc1cc(CN[C@H]2COCc3ccccc32)cc2ccccc21 ZINC001461587608 1063597567 /nfs/dbraw/zinc/59/75/67/1063597567.db2.gz IFHRIIGLRXOXOG-FQEVSTJZSA-N 0 1 319.404 4.210 20 0 DIADMN C[C@@H](CC(C)(C)SCc1ccco1)N1CC2(C1)CCCCO2 ZINC001258304937 1063601149 /nfs/dbraw/zinc/60/11/49/1063601149.db2.gz JMYKDEGZMQTKQI-HNNXBMFYSA-N 0 1 323.502 4.325 20 0 DIADMN C[C@@H](CC(C)(C)SCc1ccco1)N1Cc2ccncc2C1 ZINC001258314706 1063606739 /nfs/dbraw/zinc/60/67/39/1063606739.db2.gz XFMDXHRHBFDUKW-AWEZNQCLSA-N 0 1 316.470 4.481 20 0 DIADMN COc1ccc(CNc2nccc(C)c2C2CC2)c(F)c1OC ZINC001461613849 1063613696 /nfs/dbraw/zinc/61/36/96/1063613696.db2.gz ATEWNRKYBKWZMO-UHFFFAOYSA-N 0 1 316.376 4.036 20 0 DIADMN COC[C@H](NCc1cccc(Cl)c1C)c1cccc(OC)c1 ZINC001461617192 1063615662 /nfs/dbraw/zinc/61/56/62/1063615662.db2.gz WPDNADCRZBFOGC-SFHVURJKSA-N 0 1 319.832 4.134 20 0 DIADMN Cc1cc(CNC[C@H](OC2CCCC2)C(F)(F)F)ccc1F ZINC001461622573 1063618607 /nfs/dbraw/zinc/61/86/07/1063618607.db2.gz WUDGYFYSBBRZBV-HNNXBMFYSA-N 0 1 319.342 4.114 20 0 DIADMN CO[C@H](C)CNCc1c(Cl)cccc1Oc1ccccc1 ZINC001461622098 1063619801 /nfs/dbraw/zinc/61/98/01/1063619801.db2.gz TXXMZYGBWMZNFC-CYBMUJFWSA-N 0 1 305.805 4.257 20 0 DIADMN CSC(C)(C)C[C@H](C)N1CCc2c([nH]nc2C(F)(F)F)C1 ZINC001258343543 1063620157 /nfs/dbraw/zinc/62/01/57/1063620157.db2.gz ANQFIRHKSTWOHS-CABZTGNLSA-N 0 1 321.412 4.263 20 0 DIADMN CCC(O)(CC)C(C)(C)CNCc1c(Cl)cncc1Cl ZINC001461628377 1063622426 /nfs/dbraw/zinc/62/24/26/1063622426.db2.gz MVCTXSFFGLGMBP-UHFFFAOYSA-N 0 1 319.276 4.055 20 0 DIADMN Clc1cc(Cl)cc(CNCc2cc3cnccc3o2)c1 ZINC001461636864 1063628562 /nfs/dbraw/zinc/62/85/62/1063628562.db2.gz WODKTFUMTWAVOE-UHFFFAOYSA-N 0 1 307.180 4.424 20 0 DIADMN Cc1ccccc1Cc1nnc(-c2cc3[nH]cc(Cl)cc-3n2)o1 ZINC001258386625 1063628853 /nfs/dbraw/zinc/62/88/53/1063628853.db2.gz GWYAQWLMGPQYAH-UHFFFAOYSA-N 0 1 324.771 4.166 20 0 DIADMN COc1ccc(C(C)(C)NCc2ccc(C)cc2F)cc1F ZINC001461642285 1063630127 /nfs/dbraw/zinc/63/01/27/1063630127.db2.gz JTJORELMNCKLKZ-UHFFFAOYSA-N 0 1 305.368 4.307 20 0 DIADMN O[C@H]1C[C@H](NCc2c(Cl)ccc(Cl)c2Cl)C12CCC2 ZINC001461648807 1063635003 /nfs/dbraw/zinc/63/50/03/1063635003.db2.gz WIICVQSMSLTSNC-RYUDHWBXSA-N 0 1 320.647 4.040 20 0 DIADMN COc1ccc(CC[C@@H](C)N(C)Cc2cnc(Cl)s2)cc1 ZINC001258397068 1063637784 /nfs/dbraw/zinc/63/77/84/1063637784.db2.gz FGTHXMRNTGVHIN-GFCCVEGCSA-N 0 1 324.877 4.258 20 0 DIADMN COc1ccc(CC[C@H](C)N(C)Cc2cnc(Cl)s2)cc1 ZINC001258397069 1063638253 /nfs/dbraw/zinc/63/82/53/1063638253.db2.gz FGTHXMRNTGVHIN-LBPRGKRZSA-N 0 1 324.877 4.258 20 0 DIADMN CC(C)[C@@H](O)[C@@H](NCc1ccc(Cl)c(F)c1)c1ccccc1 ZINC001461663012 1063644456 /nfs/dbraw/zinc/64/44/56/1063644456.db2.gz VEPKQMVUOIMYKJ-ZWKOTPCHSA-N 0 1 321.823 4.327 20 0 DIADMN Clc1cccc(Cl)c1CNC[C@@H]1Cc2ccccc2CO1 ZINC001461667713 1063647850 /nfs/dbraw/zinc/64/78/50/1063647850.db2.gz GIFCSBSCTGJWMD-AWEZNQCLSA-N 0 1 322.235 4.225 20 0 DIADMN Cc1ccc(CNCc2ccnc(-c3ccccc3)c2)c(F)c1 ZINC001461677074 1063652655 /nfs/dbraw/zinc/65/26/55/1063652655.db2.gz MAKYUYXJBLEODA-UHFFFAOYSA-N 0 1 306.384 4.486 20 0 DIADMN CC(C)n1ncnc1CNCC(C)(C)c1ccc2ccccc2c1 ZINC001461678194 1063653527 /nfs/dbraw/zinc/65/35/27/1063653527.db2.gz PPZVCICXHWAEQO-UHFFFAOYSA-N 0 1 322.456 4.080 20 0 DIADMN CCCCC[C@@H](CC)N1CCc2nc(C(=O)OCC)sc2C1 ZINC001258443324 1063657411 /nfs/dbraw/zinc/65/74/11/1063657411.db2.gz LEKCJMSWRJUHPB-CYBMUJFWSA-N 0 1 324.490 4.037 20 0 DIADMN c1sc(COc2ccccc2)nc1CNCCCCC1CC1 ZINC001461699787 1063666276 /nfs/dbraw/zinc/66/62/76/1063666276.db2.gz YOMMMEJBWMCYKG-UHFFFAOYSA-N 0 1 316.470 4.392 20 0 DIADMN C[C@@H]1Sc2ccccc2N(C(=O)c2cccc(F)c2O)[C@H]1C ZINC001515323407 1063668442 /nfs/dbraw/zinc/66/84/42/1063668442.db2.gz GMXKEZRVOFHTAL-QWRGUYRKSA-N 0 1 317.385 4.061 20 0 DIADMN Clc1ccc(-c2n[nH]cc2CNc2ccc3c[nH]nc3c2)cc1 ZINC001461709418 1063671847 /nfs/dbraw/zinc/67/18/47/1063671847.db2.gz MJCMPUAMNPWVBV-UHFFFAOYSA-N 0 1 323.787 4.219 20 0 DIADMN CCCCCCOc1cccc(CN[C@@H](C)c2ccnn2C)c1 ZINC001461709353 1063671948 /nfs/dbraw/zinc/67/19/48/1063671948.db2.gz YAHUNKBZQLHDBC-INIZCTEOSA-N 0 1 315.461 4.230 20 0 DIADMN CCOC(=O)CC[C@H](C)N1CCC[C@H]1c1ccc(Cl)s1 ZINC001258495339 1063676740 /nfs/dbraw/zinc/67/67/40/1063676740.db2.gz HVWWRNCBXTXMLC-RYUDHWBXSA-N 0 1 315.866 4.270 20 0 DIADMN COc1cccc2c1OCCC[C@@H]2NCc1cc(C)ccc1F ZINC001461731271 1063684187 /nfs/dbraw/zinc/68/41/87/1063684187.db2.gz XNQQFRPNEOGECC-KRWDZBQOSA-N 0 1 315.388 4.146 20 0 DIADMN Cc1cc(F)c(CNc2nc3ccc(Cl)cc3[nH]2)c(F)c1 ZINC001461733611 1063685809 /nfs/dbraw/zinc/68/58/09/1063685809.db2.gz NSRZEXOPEPEFMO-UHFFFAOYSA-N 0 1 307.731 4.415 20 0 DIADMN FC(F)(F)Oc1cccc(CNc2ccc3c(n2)CCCC3)c1 ZINC001461733247 1063686480 /nfs/dbraw/zinc/68/64/80/1063686480.db2.gz FRPUDJNTPXCPDF-UHFFFAOYSA-N 0 1 322.330 4.471 20 0 DIADMN Cc1ccccc1-n1nccc1CNc1ccc2c(n1)CCCC2 ZINC001461733487 1063686764 /nfs/dbraw/zinc/68/67/64/1063686764.db2.gz KOOVVKZHKLEAJJ-UHFFFAOYSA-N 0 1 318.424 4.067 20 0 DIADMN Cc1c(NC(=O)c2cccc(F)c2O)cccc1C(F)(F)F ZINC001515627582 1063692831 /nfs/dbraw/zinc/69/28/31/1063692831.db2.gz MPUZKFXOPBGKMY-UHFFFAOYSA-N 0 1 313.250 4.111 20 0 DIADMN C[C@@H](C(=O)Nc1nc2cc(Cl)c(F)cc2[nH]1)c1ccccc1 ZINC001461752665 1063695123 /nfs/dbraw/zinc/69/51/23/1063695123.db2.gz WSYRYFQEDPZNTR-SECBINFHSA-N 0 1 317.751 4.098 20 0 DIADMN Cc1cc(C(=O)Nc2nc3cc(Cl)c(F)cc3[nH]2)ccc1F ZINC001461752677 1063695709 /nfs/dbraw/zinc/69/57/09/1063695709.db2.gz WZIBZGLKMGIIFL-UHFFFAOYSA-N 0 1 321.714 4.055 20 0 DIADMN CCOc1cccc(CN[C@H](CC)c2cc(F)ccc2OC)c1 ZINC001461764963 1063703253 /nfs/dbraw/zinc/70/32/53/1063703253.db2.gz GDABOXJJNBTJDI-GOSISDBHSA-N 0 1 317.404 4.474 20 0 DIADMN C[C@@H](NCc1cc2ccncc2s1)c1c(F)cccc1F ZINC001461772008 1063708012 /nfs/dbraw/zinc/70/80/12/1063708012.db2.gz BPBRJLSKIBLIKQ-SNVBAGLBSA-N 0 1 304.365 4.425 20 0 DIADMN C[C@H](Cc1cccnc1)N1CCc2ccc(C(F)(F)F)cc2C1 ZINC001258627938 1063715319 /nfs/dbraw/zinc/71/53/19/1063715319.db2.gz MBZBJSZJTZZCSZ-CYBMUJFWSA-N 0 1 320.358 4.090 20 0 DIADMN C[C@@H]1C[C@H](N2Cc3cc(Br)cnc3C2)CC(C)(C)C1 ZINC001258700577 1063760577 /nfs/dbraw/zinc/76/05/77/1063760577.db2.gz MZPSRAACWCGOLX-RISCZKNCSA-N 0 1 323.278 4.375 20 0 DIADMN CCCCC[C@@H](CCC)NCc1nn(C)cc1Br ZINC001258664379 1063733140 /nfs/dbraw/zinc/73/31/40/1063733140.db2.gz IWWGNCVRUUNCIL-GFCCVEGCSA-N 0 1 316.287 4.021 20 0 DIADMN CCc1coc(CN[C@H](C)Cc2ccc(Cl)cc2Cl)n1 ZINC001258672910 1063740301 /nfs/dbraw/zinc/74/03/01/1063740301.db2.gz LCUCJSDBADWRSD-SNVBAGLBSA-N 0 1 313.228 4.265 20 0 DIADMN CCCCC[C@@H](CCC)N1Cc2ccnn2C[C@@H](COCC)C1 ZINC001258672212 1063740795 /nfs/dbraw/zinc/74/07/95/1063740795.db2.gz WEOSJOPRNHQKST-ZWKOTPCHSA-N 0 1 321.509 4.100 20 0 DIADMN Cc1nc(CN[C@H](C)Cc2ccc(Cl)cc2Cl)cs1 ZINC001258673971 1063742150 /nfs/dbraw/zinc/74/21/50/1063742150.db2.gz WWSJKSMIILPFKZ-SECBINFHSA-N 0 1 315.269 4.479 20 0 DIADMN C[C@H](Cc1ccc(Cl)cc1Cl)N1CC2(C1)CCCOC2 ZINC001258676820 1063745092 /nfs/dbraw/zinc/74/50/92/1063745092.db2.gz BGJLWAASSIUZKV-GFCCVEGCSA-N 0 1 314.256 4.037 20 0 DIADMN C[C@@H](Cc1ccc(Cl)cc1Cl)N1CCc2ncccc2C1 ZINC001258682687 1063750119 /nfs/dbraw/zinc/75/01/19/1063750119.db2.gz PVZOGJFZYAAALY-LBPRGKRZSA-N 0 1 321.251 4.378 20 0 DIADMN CC(=O)C1CCN([C@H](C)Cc2ccc(Cl)cc2Cl)CC1 ZINC001258682929 1063750144 /nfs/dbraw/zinc/75/01/44/1063750144.db2.gz RBKMYZQOFBAOAD-LLVKDONJSA-N 0 1 314.256 4.225 20 0 DIADMN Oc1ccc(-c2nnc(CC3CCCC3)o2)cc1C(F)(F)F ZINC001258691351 1063755581 /nfs/dbraw/zinc/75/55/81/1063755581.db2.gz VXPQVYRYEHCGRT-UHFFFAOYSA-N 0 1 312.291 4.194 20 0 DIADMN CCCC[C@@H](Cc1ccccc1)n1c2ccccc2nc1CN ZINC001258701520 1063759512 /nfs/dbraw/zinc/75/95/12/1063759512.db2.gz JHZJZCCMWFLZEY-KRWDZBQOSA-N 0 1 307.441 4.469 20 0 DIADMN CCOc1cncc(CN2C[C@@H](C)C[C@@H]2c2cccc(F)c2)c1 ZINC001461867112 1063759776 /nfs/dbraw/zinc/75/97/76/1063759776.db2.gz GXRNVVKBBCMUEP-IFXJQAMLSA-N 0 1 314.404 4.203 20 0 DIADMN CCc1nc(C)c([C@H](C)N(C)Cc2ccccc2NC)s1 ZINC001461866642 1063759873 /nfs/dbraw/zinc/75/98/73/1063759873.db2.gz WIHJYPSXADVCNS-ZDUSSCGKSA-N 0 1 303.475 4.249 20 0 DIADMN CCOc1cncc(CN2C[C@H](C)C[C@@H]2c2cccc(F)c2)c1 ZINC001461867109 1063760163 /nfs/dbraw/zinc/76/01/63/1063760163.db2.gz GXRNVVKBBCMUEP-AUUYWEPGSA-N 0 1 314.404 4.203 20 0 DIADMN CCCCCN(Cc1sc(N(C)C)nc1Cl)C(C)C ZINC001461870093 1063763751 /nfs/dbraw/zinc/76/37/51/1063763751.db2.gz PQERQWOLPZMQKT-UHFFFAOYSA-N 0 1 303.903 4.263 20 0 DIADMN Cc1cc(F)ncc1CN1C[C@H](C)C[C@@H]1c1ccccc1F ZINC001461874776 1063766212 /nfs/dbraw/zinc/76/62/12/1063766212.db2.gz QQVSYSLCGFQTOW-SJKOYZFVSA-N 0 1 302.368 4.251 20 0 DIADMN CCCN(CC(=O)Nc1ccccc1C)Cc1cccc(CC)c1 ZINC001461876538 1063766244 /nfs/dbraw/zinc/76/62/44/1063766244.db2.gz WLRCZAJEWHBJJQ-UHFFFAOYSA-N 0 1 324.468 4.408 20 0 DIADMN Cc1ccc2ncc(CN3C[C@@H](C)C[C@@H]3c3cccc(F)c3)n2c1 ZINC001461875005 1063766500 /nfs/dbraw/zinc/76/65/00/1063766500.db2.gz RGDGCIHYWDWYAP-HNAYVOBHSA-N 0 1 323.415 4.365 20 0 DIADMN Cc1cc(F)ncc1CN1C[C@H](C)C[C@H]1c1ccccc1F ZINC001461874764 1063767380 /nfs/dbraw/zinc/76/73/80/1063767380.db2.gz QQVSYSLCGFQTOW-PXAZEXFGSA-N 0 1 302.368 4.251 20 0 DIADMN CCc1ccc([C@@H]2C[C@@H](C)CCN2Cc2ccc(OC)o2)o1 ZINC001461879377 1063768478 /nfs/dbraw/zinc/76/84/78/1063768478.db2.gz FAHPAWPQDUOVDJ-BBRMVZONSA-N 0 1 303.402 4.417 20 0 DIADMN CC(C)C[C@@H]1CCCN(Cc2cccnc2Br)C1 ZINC001461914479 1063797046 /nfs/dbraw/zinc/79/70/46/1063797046.db2.gz OKCXSYWZMPLPPX-ZDUSSCGKSA-N 0 1 311.267 4.102 20 0 DIADMN C[C@@H]1CN(Cc2ccc(Oc3ccccc3)o2)C[C@H](C)S1 ZINC001461896875 1063782472 /nfs/dbraw/zinc/78/24/72/1063782472.db2.gz IOCJFVQMIDTLND-OKILXGFUSA-N 0 1 303.427 4.398 20 0 DIADMN C[C@H](Cc1cccc(Cl)c1)NCC(=O)c1ccc(F)cc1F ZINC001258737938 1063787174 /nfs/dbraw/zinc/78/71/74/1063787174.db2.gz KMNHHXHVJWFZHL-LLVKDONJSA-N 0 1 323.770 4.022 20 0 DIADMN Cc1ccc([C@H]2[C@H](C)CCCN2Cc2cn(C)nc2Cl)cc1 ZINC001461905232 1063788156 /nfs/dbraw/zinc/78/81/56/1063788156.db2.gz RJFYAIMWKBGSEG-RHSMWYFYSA-N 0 1 317.864 4.355 20 0 DIADMN c1csc(N2CCN(Cc3ccc(C4CCC4)cc3)CC2)c1 ZINC001461910005 1063792568 /nfs/dbraw/zinc/79/25/68/1063792568.db2.gz DMEQBHGJSCQREK-UHFFFAOYSA-N 0 1 312.482 4.338 20 0 DIADMN CCCn1nccc1CN1CCC[C@@H]1Cc1ccccc1Cl ZINC001461912967 1063793732 /nfs/dbraw/zinc/79/37/32/1063793732.db2.gz MXHRLWWZJHOCLV-MRXNPFEDSA-N 0 1 317.864 4.154 20 0 DIADMN FC(F)(F)Cc1ccc(CN2CCOc3ccccc3C2)cc1 ZINC001461915197 1063796983 /nfs/dbraw/zinc/79/69/83/1063796983.db2.gz TVWLDUCKPGJHHL-UHFFFAOYSA-N 0 1 321.342 4.186 20 0 DIADMN CN(Cc1cc2ccccc2[nH]1)Cc1ccc2scnc2c1 ZINC001461920237 1063801097 /nfs/dbraw/zinc/80/10/97/1063801097.db2.gz JNTHDESRIGWORU-UHFFFAOYSA-N 0 1 307.422 4.410 20 0 DIADMN CCO[C@@H]1C[C@@H](N(C)Cc2cncn2C(C)C)C12CCCCC2 ZINC001461918865 1063801201 /nfs/dbraw/zinc/80/12/01/1063801201.db2.gz CZQUEURQMXDHAF-QZTJIDSGSA-N 0 1 319.493 4.024 20 0 DIADMN C[C@@H]1C[C@@H]1[C@H]1C[C@@H]1C(=O)Nc1nc2cc(Cl)cc(Cl)c2[nH]1 ZINC001461917696 1063802128 /nfs/dbraw/zinc/80/21/28/1063802128.db2.gz MOGJDXLYTIIHHA-NEPJDUFXSA-N 0 1 324.211 4.100 20 0 DIADMN CCCC[C@H](CCC)N1Cc2cn(CC)nc2[C@@H](COCC)C1 ZINC001258762032 1063806036 /nfs/dbraw/zinc/80/60/36/1063806036.db2.gz SIFKHCDLPGDDAD-MSOLQXFVSA-N 0 1 321.509 4.198 20 0 DIADMN Cc1cc(F)ncc1CN1C[C@H]2CCCC[C@]21c1ccccc1 ZINC001461929016 1063813378 /nfs/dbraw/zinc/81/33/78/1063813378.db2.gz QKMJEQUMXPVRNN-QUCCMNQESA-N 0 1 310.416 4.430 20 0 DIADMN CCCN(CCc1cccc(F)c1)Cc1c(Cl)n[nH]c1CC ZINC001461935316 1063821044 /nfs/dbraw/zinc/82/10/44/1063821044.db2.gz FBTWIQXBJMTYRA-UHFFFAOYSA-N 0 1 323.843 4.219 20 0 DIADMN CCO[C@H]1C[C@@H](N(C)Cc2cnc(CC(C)C)s2)C12CCC2 ZINC001461946871 1063829224 /nfs/dbraw/zinc/82/92/24/1063829224.db2.gz UPWSUTMIUWGVOK-CVEARBPZSA-N 0 1 322.518 4.121 20 0 DIADMN CCOC[C@@H]1CN([C@@H](CC)C[C@H](C)CC)Cc2c1cnn2CC ZINC001258789631 1063829891 /nfs/dbraw/zinc/82/98/91/1063829891.db2.gz CHGBOJUJUHGUBX-IKGGRYGDSA-N 0 1 321.509 4.054 20 0 DIADMN CC[C@@H](C)C[C@H](CC)N1CCCn2cnc(COC(C)C)c2C1 ZINC001258794667 1063830679 /nfs/dbraw/zinc/83/06/79/1063830679.db2.gz MJDSSQVQCJKBIY-SJORKVTESA-N 0 1 321.509 4.229 20 0 DIADMN CCCN(Cc1cn(CCC)nn1)[C@@H](CC)c1ccccc1 ZINC001461961949 1063841727 /nfs/dbraw/zinc/84/17/27/1063841727.db2.gz GCMPZTUZTAOMEQ-SFHVURJKSA-N 0 1 300.450 4.051 20 0 DIADMN CCCCN(Cc1c2c(nn1C)CCC2)[C@H](C)c1ccc(C)o1 ZINC001461966212 1063846042 /nfs/dbraw/zinc/84/60/42/1063846042.db2.gz XVQJQLZVHKMDTC-OAHLLOKOSA-N 0 1 315.461 4.174 20 0 DIADMN CNc1ccccc1CN1CC[C@@H](Oc2ccccc2Cl)C1 ZINC001461972390 1063849881 /nfs/dbraw/zinc/84/98/81/1063849881.db2.gz ZYZOAWSDPYJUFZ-OAHLLOKOSA-N 0 1 316.832 4.035 20 0 DIADMN CC(C)C[C@@H]1COCCN1Cc1cc2nc(Cl)ccc2s1 ZINC001461976406 1063853776 /nfs/dbraw/zinc/85/37/76/1063853776.db2.gz LTWGKCJAMPDZDU-GFCCVEGCSA-N 0 1 324.877 4.197 20 0 DIADMN C[C@@H]1CCN(Cc2ccnn2-c2ccccc2)[C@@H]2CCCC[C@H]12 ZINC001461981195 1063855574 /nfs/dbraw/zinc/85/55/74/1063855574.db2.gz ZIZPVBGPVYDZIG-NSISKUIASA-N 0 1 309.457 4.273 20 0 DIADMN Cc1cc(C)cc(CCN(C)Cc2nc3c(s2)CCCC3)c1 ZINC001461982766 1063855652 /nfs/dbraw/zinc/85/56/52/1063855652.db2.gz KJRFFXXMRQIJNG-UHFFFAOYSA-N 0 1 314.498 4.313 20 0 DIADMN C[C@H]1CN(Cc2ccsc2Br)CC(C)(C)C1 ZINC001462003559 1063874027 /nfs/dbraw/zinc/87/40/27/1063874027.db2.gz TXSFZKKPSFFYGA-SNVBAGLBSA-N 0 1 302.281 4.379 20 0 DIADMN COc1ccc(F)c(CN2CCC(Cc3ccccc3)CC2)c1 ZINC001462009491 1063877330 /nfs/dbraw/zinc/87/73/30/1063877330.db2.gz WWLGKRHCXGHHMM-UHFFFAOYSA-N 0 1 313.416 4.289 20 0 DIADMN C[C@H](C1CC1)[N@@H+](Cc1ccccc1)Cc1ccc([O-])c(F)c1F ZINC001462016551 1063879381 /nfs/dbraw/zinc/87/93/81/1063879381.db2.gz CKJIMBXQUHHKHF-CYBMUJFWSA-N 0 1 317.379 4.471 20 0 DIADMN C[C@@H](C1CC1)[N@@H+](Cc1ccccc1)Cc1ccc([O-])c(F)c1F ZINC001462016552 1063879970 /nfs/dbraw/zinc/87/99/70/1063879970.db2.gz CKJIMBXQUHHKHF-ZDUSSCGKSA-N 0 1 317.379 4.471 20 0 DIADMN CN(C(=O)c1ccc(O)c(Cl)c1)[C@@H]1CCC[C@@H]1C(C)(C)C ZINC001299556685 1063881678 /nfs/dbraw/zinc/88/16/78/1063881678.db2.gz IKFYGCQGWPOHIU-GXTWGEPZSA-N 0 1 309.837 4.332 20 0 DIADMN CCOc1cc(C[N@@H+](C)[C@@H]2CCC[C@H](C)C2)cc(Cl)c1O ZINC001462020386 1063883757 /nfs/dbraw/zinc/88/37/57/1063883757.db2.gz RJBLCDOUOLZSGM-GXTWGEPZSA-N 0 1 311.853 4.455 20 0 DIADMN CO[C@H](CSc1nnc(CCC2CCCC2)[nH]1)CC(C)C ZINC001307285521 1063886709 /nfs/dbraw/zinc/88/67/09/1063886709.db2.gz ZNLPKOBTKQADRO-AWEZNQCLSA-N 0 1 311.495 4.081 20 0 DIADMN CO[C@H](CSc1nc(CCC2CCCC2)n[nH]1)CC(C)C ZINC001307285521 1063886723 /nfs/dbraw/zinc/88/67/23/1063886723.db2.gz ZNLPKOBTKQADRO-AWEZNQCLSA-N 0 1 311.495 4.081 20 0 DIADMN CC[C@@H](C)c1ccccc1NS(=O)(=O)c1ccccc1OC ZINC001259294176 1063886822 /nfs/dbraw/zinc/88/68/22/1063886822.db2.gz HMJGHJKKSDDMMZ-CYBMUJFWSA-N 0 1 319.426 4.010 20 0 DIADMN Cc1ccccc1CN(C)Cc1cccc(F)c1OC(F)F ZINC001462029682 1063888299 /nfs/dbraw/zinc/88/82/99/1063888299.db2.gz CMUCPUUXTIZCAF-UHFFFAOYSA-N 0 1 309.331 4.368 20 0 DIADMN CN(Cc1ccc(C(C)(C)C)cc1)Cc1cccc(F)c1N ZINC001462030498 1063891871 /nfs/dbraw/zinc/89/18/71/1063891871.db2.gz IZAKXEZRLKDANV-UHFFFAOYSA-N 0 1 300.421 4.337 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0 1 310.319 4.169 20 0 DIADMN CC(C)c1ccccc1N(C)C(=O)c1cc(-c2ccco2)n[nH]1 ZINC000426366494 338029103 /nfs/dbraw/zinc/02/91/03/338029103.db2.gz RDASIKPREIXNGO-UHFFFAOYSA-N 0 1 309.369 4.070 20 0 DIADMN CCCn1nc(C)c(CN(C)C/C(C)=C\c2ccccc2)c1C ZINC000426393423 338030323 /nfs/dbraw/zinc/03/03/23/338030323.db2.gz DQVOXAMEBYQHEG-SSZFMOIBSA-N 0 1 311.473 4.445 20 0 DIADMN CCCn1nc(C)c(CN(C)C/C(C)=C/c2ccccc2)c1C ZINC000426393422 338030370 /nfs/dbraw/zinc/03/03/70/338030370.db2.gz DQVOXAMEBYQHEG-DTQAZKPQSA-N 0 1 311.473 4.445 20 0 DIADMN C/C(=C/c1ccccc1)CN(C)Cc1cn(C)nc1C(C)(C)C ZINC000426395218 338030422 /nfs/dbraw/zinc/03/04/22/338030422.db2.gz LZARWJIMVWSVOT-VBKFSLOCSA-N 0 1 311.473 4.253 20 0 DIADMN CCCc1csc(CN2CC[C@@H](c3ccc(OC)cc3)C2)n1 ZINC000426417400 338031463 /nfs/dbraw/zinc/03/14/63/338031463.db2.gz ARGGZAHJZJZHIP-OAHLLOKOSA-N 0 1 316.470 4.094 20 0 DIADMN CC[C@@H]1CCCCN1C(=O)c1cc(-c2ccc(C)cc2C)[nH]n1 ZINC000426581694 338035109 /nfs/dbraw/zinc/03/51/09/338035109.db2.gz RQHLXQGTTWLZHC-OAHLLOKOSA-N 0 1 311.429 4.098 20 0 DIADMN CC1(C(=O)Nc2ccc(-c3nc4ccc(F)cc4[nH]3)cc2)CCC1 ZINC000426726276 338039461 /nfs/dbraw/zinc/03/94/61/338039461.db2.gz ILMBCGBUHNZNRY-UHFFFAOYSA-N 0 1 323.371 4.498 20 0 DIADMN CCN(Cc1oc(C(C)C)nc1C)[C@H](C)c1cccc(O)c1 ZINC000428200958 338042230 /nfs/dbraw/zinc/04/22/30/338042230.db2.gz AEGKFZYDZNFNEU-CQSZACIVSA-N 0 1 302.418 4.395 20 0 DIADMN CCc1nc(C)c(CN2CCC(OC3CCC(C)CC3)CC2)o1 ZINC000428222302 338042999 /nfs/dbraw/zinc/04/29/99/338042999.db2.gz HQONFYSCUQLKSD-UHFFFAOYSA-N 0 1 320.477 4.105 20 0 DIADMN Cc1ccc([C@@H]2CCC[C@H]2N(C)Cc2nnc(C(C)C)[nH]2)cc1 ZINC000428236765 338043572 /nfs/dbraw/zinc/04/35/72/338043572.db2.gz GVWCBJBWIYLFJY-DLBZAZTESA-N 0 1 312.461 4.005 20 0 DIADMN CCCCN(Cc1n[nH]c(C(C)C)n1)[C@@H](C)c1ccccc1 ZINC000428249020 338044296 /nfs/dbraw/zinc/04/42/96/338044296.db2.gz UDPLZUBOJLZLSO-HNNXBMFYSA-N 0 1 300.450 4.291 20 0 DIADMN CCc1nc(C)c(CN2C[C@@H](C)C[C@@H]2c2ccccc2F)o1 ZINC000428252906 338044550 /nfs/dbraw/zinc/04/45/50/338044550.db2.gz MRSZRXPINRXLQY-BLLLJJGKSA-N 0 1 302.393 4.268 20 0 DIADMN CCc1nc(C)c(CN2C[C@@H](C)C[C@H]2c2ccccc2F)o1 ZINC000428252907 338044636 /nfs/dbraw/zinc/04/46/36/338044636.db2.gz MRSZRXPINRXLQY-LRDDRELGSA-N 0 1 302.393 4.268 20 0 DIADMN Cc1nc(-c2ccc([C@H](C)NCc3cc(C)ncn3)cc2)cs1 ZINC000428324825 338047414 /nfs/dbraw/zinc/04/74/14/338047414.db2.gz YXKDVWINBBDABC-ZDUSSCGKSA-N 0 1 324.453 4.068 20 0 DIADMN Cc1ccc(OC(F)F)c(CN[C@H](c2cccnc2)C2CC2)c1 ZINC000428341822 338047914 /nfs/dbraw/zinc/04/79/14/338047914.db2.gz QGFACJNVAZEZFD-KRWDZBQOSA-N 0 1 318.367 4.232 20 0 DIADMN CC[C@H](NC[C@H](OC(C)C)c1ccccc1)c1nccs1 ZINC000428346726 338048252 /nfs/dbraw/zinc/04/82/52/338048252.db2.gz HYLUCEJWVCPQKB-HOTGVXAUSA-N 0 1 304.459 4.350 20 0 DIADMN CC[C@@H](NC[C@@H](OC(C)C)c1ccccc1)c1nccs1 ZINC000428346727 338048259 /nfs/dbraw/zinc/04/82/59/338048259.db2.gz HYLUCEJWVCPQKB-HZPDHXFCSA-N 0 1 304.459 4.350 20 0 DIADMN Cc1cc(C[N@H+]2CCC[C@H](CCCc3ccccc3)C2)ncn1 ZINC000428375606 338049474 /nfs/dbraw/zinc/04/94/74/338049474.db2.gz PDVQPNGTOSQSNV-IBGZPJMESA-N 0 1 309.457 4.020 20 0 DIADMN CCCc1nc(C)c(CN2CCC(c3ccsc3)CC2)o1 ZINC000428416755 338050499 /nfs/dbraw/zinc/05/04/99/338050499.db2.gz AZOPEPLJJQPYSY-UHFFFAOYSA-N 0 1 304.459 4.377 20 0 DIADMN CCc1nc(C)c(CN(CC)[C@H](C)c2cccc(OC)c2)o1 ZINC000428450852 338052410 /nfs/dbraw/zinc/05/24/10/338052410.db2.gz ZKGMKJMBIBNMJX-CQSZACIVSA-N 0 1 302.418 4.137 20 0 DIADMN COCCN(Cc1oc(C(C)C)nc1C)[C@@H](C)c1ccccc1 ZINC000428460838 338053233 /nfs/dbraw/zinc/05/32/33/338053233.db2.gz HHEAVYVEDWOLSG-INIZCTEOSA-N 0 1 316.445 4.316 20 0 DIADMN Cc1nc(C(C)C)oc1CN(C)CCOc1cccc(Cl)c1 ZINC000428465981 338053666 /nfs/dbraw/zinc/05/36/66/338053666.db2.gz UOMVAAPDEONSDZ-UHFFFAOYSA-N 0 1 322.836 4.271 20 0 DIADMN COc1ccc([C@@H](C)N(C)Cc2oc(C(C)C)nc2C)cc1 ZINC000428471561 338054231 /nfs/dbraw/zinc/05/42/31/338054231.db2.gz XZTABDYUNPNFFX-CQSZACIVSA-N 0 1 302.418 4.308 20 0 DIADMN CCCN(Cc1n[nH]c(C(C)C)n1)Cc1c(F)cccc1Cl ZINC000428490648 338054863 /nfs/dbraw/zinc/05/48/63/338054863.db2.gz ZSLMOWRQXMUISC-UHFFFAOYSA-N 0 1 324.831 4.133 20 0 DIADMN CC1(CC(=O)N2CCC[C@H]2c2nc3ccc(Cl)cc3[nH]2)CC1 ZINC000428495347 338054896 /nfs/dbraw/zinc/05/48/96/338054896.db2.gz CDOKFTYUSMPJND-AWEZNQCLSA-N 0 1 317.820 4.070 20 0 DIADMN CC(C)c1cnc(CNC[C@H](C)Oc2ccc(Cl)cc2)s1 ZINC000428563015 338056387 /nfs/dbraw/zinc/05/63/87/338056387.db2.gz YOWSPNMNUSTZFT-LBPRGKRZSA-N 0 1 324.877 4.477 20 0 DIADMN CCCOc1ccc(CNC2CC(F)(F)C2)c(OCCC)c1 ZINC000428637548 338057477 /nfs/dbraw/zinc/05/74/77/338057477.db2.gz FDFNKQDBBJUZJY-UHFFFAOYSA-N 0 1 313.388 4.152 20 0 DIADMN CN(C(=O)c1cc(-c2ccc(Cl)cc2)[nH]n1)C1(C)CCCC1 ZINC000428668506 338058135 /nfs/dbraw/zinc/05/81/35/338058135.db2.gz ZTPRMHSAVZSWSW-UHFFFAOYSA-N 0 1 317.820 4.135 20 0 DIADMN CCOC1(C)CCN(Cc2ncc(-c3ccccc3)s2)CC1 ZINC000428714621 338059290 /nfs/dbraw/zinc/05/92/90/338059290.db2.gz SWESAQPFEQWVSN-UHFFFAOYSA-N 0 1 316.470 4.201 20 0 DIADMN Cc1cccc(CN(C)[C@@H](C)C(=O)Nc2ccccc2C)c1C ZINC000428716345 338059307 /nfs/dbraw/zinc/05/93/07/338059307.db2.gz AYVKZVIHPGQNPX-KRWDZBQOSA-N 0 1 310.441 4.071 20 0 DIADMN CC(C)C[C@@H]1CCCCN1Cc1noc(-c2ccsc2)n1 ZINC000428850820 338062175 /nfs/dbraw/zinc/06/21/75/338062175.db2.gz OOAZJQGVGBGJCU-AWEZNQCLSA-N 0 1 305.447 4.199 20 0 DIADMN Cc1ccc(CNCc2nc3ccc(F)cc3s2)c(C)c1 ZINC000428851316 338062461 /nfs/dbraw/zinc/06/24/61/338062461.db2.gz RBPRACJAAHLNQF-UHFFFAOYSA-N 0 1 300.402 4.342 20 0 DIADMN C[C@@H](NCc1ccc(C(F)(F)F)s1)c1cncc(F)c1 ZINC000428863668 338063139 /nfs/dbraw/zinc/06/31/39/338063139.db2.gz AKILACHMACTTNY-MRVPVSSYSA-N 0 1 304.312 4.152 20 0 DIADMN C[C@@H](CNCc1ccc(C(F)(F)F)s1)[N@@H+]1CCCC[C@@H]1C ZINC000428866647 338063151 /nfs/dbraw/zinc/06/31/51/338063151.db2.gz YMFIGQJZKKQISB-RYUDHWBXSA-N 0 1 320.424 4.119 20 0 DIADMN CC(C)N(Cc1nc(-c2ccoc2)no1)[C@H](C)c1ccccc1 ZINC000428871199 338063833 /nfs/dbraw/zinc/06/38/33/338063833.db2.gz HLKMGYNDZKZAHT-CQSZACIVSA-N 0 1 311.385 4.301 20 0 DIADMN C[C@@H]1CCCC[C@H]1OCCNCc1nc2ccc(F)cc2s1 ZINC000428875221 338063910 /nfs/dbraw/zinc/06/39/10/338063910.db2.gz DUXSUCZHHRKPCQ-IUODEOHRSA-N 0 1 322.449 4.120 20 0 DIADMN C[C@H]1CCCC[C@@H]1OCCNCc1nc2ccc(F)cc2s1 ZINC000428875223 338063938 /nfs/dbraw/zinc/06/39/38/338063938.db2.gz DUXSUCZHHRKPCQ-WFASDCNBSA-N 0 1 322.449 4.120 20 0 DIADMN CC[C@H](C)N1C[C@@H](C)O[C@H](c2cccc(C(F)(F)F)c2)C1 ZINC000428945197 338066143 /nfs/dbraw/zinc/06/61/43/338066143.db2.gz KAJIBBHSMOENEZ-ZOWXZIJZSA-N 0 1 301.352 4.266 20 0 DIADMN CCCc1nc(C)c(CN(C)[C@H]2CCCC[C@H]2C(F)(F)F)o1 ZINC000428984838 338067519 /nfs/dbraw/zinc/06/75/19/338067519.db2.gz YPMNSFMOCKDANJ-OLZOCXBDSA-N 0 1 318.383 4.488 20 0 DIADMN C[C@H](c1ccc(F)c(Cl)c1)N1CCOC[C@@H](C2CCC2)C1 ZINC000429001024 338068466 /nfs/dbraw/zinc/06/84/66/338068466.db2.gz UCWUFGXDNXBDLC-DOMZBBRYSA-N 0 1 311.828 4.289 20 0 DIADMN Cc1ncc(CN2CC[C@H](Sc3cccc(Cl)c3)C2)s1 ZINC000429123634 338071173 /nfs/dbraw/zinc/07/11/73/338071173.db2.gz VYKYHPJVFFWHPV-AWEZNQCLSA-N 0 1 324.902 4.472 20 0 DIADMN Cc1oncc1CN1CC[C@H](Sc2cccc(Cl)c2)C1 ZINC000429126772 338071322 /nfs/dbraw/zinc/07/13/22/338071322.db2.gz IUFMLNWXYUWCQO-HNNXBMFYSA-N 0 1 308.834 4.003 20 0 DIADMN CC(C)CSCCCNC(C)(C)c1cc(C(F)(F)F)on1 ZINC000429258814 338075043 /nfs/dbraw/zinc/07/50/43/338075043.db2.gz WBABSQUUUUOOBT-UHFFFAOYSA-N 0 1 324.412 4.297 20 0 DIADMN CSC[C@@H]1CCCN(Cc2ncc(-c3ccc(C)cc3)o2)C1 ZINC000429268831 338075468 /nfs/dbraw/zinc/07/54/68/338075468.db2.gz ABWUTLVVAYTUHN-OAHLLOKOSA-N 0 1 316.470 4.225 20 0 DIADMN CSC[C@H]1CCCN(Cc2sc(C)nc2C(F)(F)F)C1 ZINC000429283637 338075965 /nfs/dbraw/zinc/07/59/65/338075965.db2.gz HQXOWVCZLZJSEK-JTQLQIEISA-N 0 1 324.437 4.045 20 0 DIADMN CSC[C@H]1CCCN(Cc2csc(CCC(C)C)n2)C1 ZINC000429283899 338076196 /nfs/dbraw/zinc/07/61/96/338076196.db2.gz KHHMBSDXYGUFHQ-AWEZNQCLSA-N 0 1 312.548 4.307 20 0 DIADMN Cc1ccc(C)c(CN(C)Cc2cncc(Br)c2)c1 ZINC000429291415 338076723 /nfs/dbraw/zinc/07/67/23/338076723.db2.gz IHXORILZICUKFN-UHFFFAOYSA-N 0 1 319.246 4.093 20 0 DIADMN CCC1(CC)[C@H](OC)C[C@@H]1NCc1ncc(-c2ccccc2)o1 ZINC000429292114 338076901 /nfs/dbraw/zinc/07/69/01/338076901.db2.gz JXVQLAFIYHTTKK-DLBZAZTESA-N 0 1 314.429 4.025 20 0 DIADMN CCC1(CC)[C@H](NCc2csc(-c3ccoc3)n2)C[C@H]1OC ZINC000429296708 338077117 /nfs/dbraw/zinc/07/71/17/338077117.db2.gz SCAZGVVLTYIIPJ-HUUCEWRRSA-N 0 1 320.458 4.086 20 0 DIADMN CSC[C@@H]1CCCN(Cc2coc(-c3ccc(C)cc3)n2)C1 ZINC000429310989 338077472 /nfs/dbraw/zinc/07/74/72/338077472.db2.gz VCLGRIYUYLKIKF-OAHLLOKOSA-N 0 1 316.470 4.225 20 0 DIADMN Cc1ccoc1CN(C)Cc1ccc(OCc2ccncc2)cc1 ZINC000429371364 338078885 /nfs/dbraw/zinc/07/88/85/338078885.db2.gz IBRQSEIQKRCAQD-UHFFFAOYSA-N 0 1 322.408 4.194 20 0 DIADMN Cc1ccoc1CN(C)Cc1ccc(OCc2cccnc2)cc1 ZINC000429381159 338079241 /nfs/dbraw/zinc/07/92/41/338079241.db2.gz DIKDBSHXLIMCND-UHFFFAOYSA-N 0 1 322.408 4.194 20 0 DIADMN Fc1ccc([C@@H](N[C@@H]2CC23CCCC3)c2cccnc2)c(F)c1 ZINC000429420290 338080420 /nfs/dbraw/zinc/08/04/20/338080420.db2.gz CQGXCFDRQZWJNM-MSOLQXFVSA-N 0 1 314.379 4.372 20 0 DIADMN CO[C@@H]1CCCC[C@H]1NCc1coc(-c2cccc(Cl)c2)n1 ZINC000429511224 338082740 /nfs/dbraw/zinc/08/27/40/338082740.db2.gz VJTKFLRDHPQQEX-HZPDHXFCSA-N 0 1 320.820 4.042 20 0 DIADMN COc1ccc(Cl)c(CN2CCC(c3ccncc3)CC2)c1 ZINC000429533836 338083183 /nfs/dbraw/zinc/08/31/83/338083183.db2.gz YELLTMSIXHFSBP-UHFFFAOYSA-N 0 1 316.832 4.123 20 0 DIADMN C[C@@H]1CC[C@@H](N(C)Cc2nc(-c3ccc(Cl)cc3)no2)C1 ZINC000429559007 338084127 /nfs/dbraw/zinc/08/41/27/338084127.db2.gz KJCPBHDYZIQTTQ-BXUZGUMPSA-N 0 1 305.809 4.010 20 0 DIADMN C[C@@H]1CC[C@@H](N(C)Cc2nnc(-c3ccccc3Cl)o2)C1 ZINC000429570016 338084533 /nfs/dbraw/zinc/08/45/33/338084533.db2.gz NVESOAXAWUYTIU-VXGBXAGGSA-N 0 1 305.809 4.010 20 0 DIADMN C[C@@H]1CC[C@@H](N(C)Cc2nnc(-c3cccc(Cl)c3)o2)C1 ZINC000429584929 338085278 /nfs/dbraw/zinc/08/52/78/338085278.db2.gz PAXIAAICQDNIAE-BXUZGUMPSA-N 0 1 305.809 4.010 20 0 DIADMN CCO[C@H]1C[C@@H](NCc2ncc(C(C)(C)C)o2)C12CCCCC2 ZINC000429770719 338089403 /nfs/dbraw/zinc/08/94/03/338089403.db2.gz 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/nfs/dbraw/zinc/14/55/95/535145595.db2.gz JKIXXVITGJDVRA-UHFFFAOYSA-N 0 1 323.440 4.116 20 0 DIADMN CCOc1ccc([C@H](C)N[C@@H](CCOC)c2ccc(C)o2)cc1 ZINC000272587557 535421159 /nfs/dbraw/zinc/42/11/59/535421159.db2.gz HLIZQOZTAJIKHA-YJBOKZPZSA-N 0 1 317.429 4.415 20 0 DIADMN CCOc1ccccc1[C@@H](C)NCc1ccc(C(C)(C)O)cc1 ZINC000274771400 535539853 /nfs/dbraw/zinc/53/98/53/535539853.db2.gz MRQMXDYQYZLVKG-OAHLLOKOSA-N 0 1 313.441 4.164 20 0 DIADMN CCCn1cc(CN[C@@H](C)c2cc3cccc(F)c3o2)cn1 ZINC000353193909 535613591 /nfs/dbraw/zinc/61/35/91/535613591.db2.gz PKVLNZRYYMFPKQ-LBPRGKRZSA-N 0 1 301.365 4.029 20 0 DIADMN CCC[C@H](C)N(C)CC(=O)Nc1c(Cl)cccc1Cl ZINC000298365160 535630675 /nfs/dbraw/zinc/63/06/75/535630675.db2.gz AMJBNZPZKLGDCF-JTQLQIEISA-N 0 1 303.233 4.052 20 0 DIADMN CCc1c2ccccc2oc1[C@@H](C)NCc1n[nH]c(C(C)C)n1 ZINC000296583627 536083363 /nfs/dbraw/zinc/08/33/63/536083363.db2.gz UMMRWGPBLGRRCA-GFCCVEGCSA-N 0 1 312.417 4.088 20 0 DIADMN COc1ccc(F)cc1[C@@H](C)N[C@H]1CCCc2c(O)cccc21 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COCC[C@H](N[C@H]1CCCc2cc(F)ccc21)c1ccco1 ZINC000272574403 536819975 /nfs/dbraw/zinc/81/99/75/536819975.db2.gz POEBJZCPXPDCCW-IRXDYDNUSA-N 0 1 303.377 4.164 20 0 DIADMN COc1cc([C@@H](C)N[C@H](C)c2cc(C)sc2C)c(F)cn1 ZINC000287275570 536881784 /nfs/dbraw/zinc/88/17/84/536881784.db2.gz BEEUBZMDKNNRBB-GHMZBOCLSA-N 0 1 308.422 4.319 20 0 DIADMN COc1ccc2c(c1F)CC[C@@H]2N[C@@H](C)c1ccccc1OC ZINC000289322658 537022346 /nfs/dbraw/zinc/02/23/46/537022346.db2.gz UWPPIWGIFFFKIQ-LRDDRELGSA-N 0 1 315.388 4.181 20 0 DIADMN COc1ccc2oc([C@H](C)NCc3cnccc3C)c(C)c2c1 ZINC000273319668 537056835 /nfs/dbraw/zinc/05/68/35/537056835.db2.gz QSDJDGCEOCYTNG-AWEZNQCLSA-N 0 1 310.397 4.304 20 0 DIADMN C[C@@H]1CN(C)[C@@H](C)CN1c1c(Cl)ccc2ccc(Cl)nc21 ZINC001164633256 719250834 /nfs/dbraw/zinc/25/08/34/719250834.db2.gz KLUWOCRRFPZXNH-WDEREUQCSA-N 0 1 324.255 4.070 20 0 DIADMN OCc1ccc(F)cc1Nc1cc(Cl)c(O)c(Cl)c1 ZINC001210929221 1037060361 /nfs/dbraw/zinc/06/03/61/1037060361.db2.gz VOKMYYILDOHKON-UHFFFAOYSA-N 0 1 302.132 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CC[C@H](CC(F)(F)F)C(=O)Nc1cc(Cl)c(O)cc1F ZINC000451747219 1045721179 /nfs/dbraw/zinc/72/11/79/1045721179.db2.gz SUHHSEXHLOSHNI-ZCFIWIBFSA-N 0 1 313.678 4.102 20 0 DIADMN Cc1ccc(CN[C@@H](C)c2cc(Br)ccc2F)cn1 ZINC000149617847 1047735518 /nfs/dbraw/zinc/73/55/18/1047735518.db2.gz XBDDRHLFYZGVJF-NSHDSACASA-N 0 1 323.209 4.142 20 0 DIADMN C[C@H](Cc1c(F)cccc1Cl)N1CC[C@@H](C(F)(F)F)C1 ZINC001172856473 1051542606 /nfs/dbraw/zinc/54/26/06/1051542606.db2.gz KBQAXDPOGZDSKC-NXEZZACHSA-N 0 1 309.734 4.294 20 0 DIADMN CCCCCN(C)CC(=O)Nc1ccc(Cl)c(Cl)c1 ZINC000302834024 1052305362 /nfs/dbraw/zinc/30/53/62/1052305362.db2.gz RMEKNPYKSWLTHX-UHFFFAOYSA-N 0 1 303.233 4.054 20 0 DIADMN Cc1ccc([C@@H](C)NCc2cc(C)c(Br)cn2)cc1 ZINC000623363248 1054571613 /nfs/dbraw/zinc/57/16/13/1054571613.db2.gz JCGBOLQIQIWLBK-CYBMUJFWSA-N 0 1 319.246 4.312 20 0 DIADMN CCOc1ccc(CN2CC[C@@H](CC)C2)cc1Br ZINC001236673868 1055223083 /nfs/dbraw/zinc/22/30/83/1055223083.db2.gz PYRQWGIYJTZGBH-GFCCVEGCSA-N 0 1 312.251 4.080 20 0 DIADMN Clc1ccc2nc(-c3ncc(Br)s3)[nH]c2c1 ZINC001250966759 1061149781 /nfs/dbraw/zinc/14/97/81/1061149781.db2.gz KJWGKZTUEUAMOO-UHFFFAOYSA-N 0 1 314.595 4.102 20 0 DIADMN Cc1ccnc(CN(CCC2CC2)CC2CC2)c1Br ZINC001308875507 1066354728 /nfs/dbraw/zinc/35/47/28/1066354728.db2.gz VAJYLPQTBYPRTL-UHFFFAOYSA-N 0 1 323.278 4.165 20 0 DIADMN Cc1occc1CN(C)Cc1cc(Br)c(C)s1 ZINC001308616257 1066120210 /nfs/dbraw/zinc/12/02/10/1066120210.db2.gz PSUGVRWCRVMWPD-UHFFFAOYSA-N 0 1 314.248 4.352 20 0 DIADMN COc1cc([C@@H](C)N[C@H](C)c2ccccc2OC)ccc1F ZINC000317114316 1035502765 /nfs/dbraw/zinc/50/27/65/1035502765.db2.gz LKYSWHKESOCFSB-CHWSQXEVSA-N 0 1 303.377 4.255 20 0 DIADMN CC(C)N(Cc1ccc(Cl)cc1Cl)C[C@@H]1CCCO1 ZINC001207888016 1035509229 /nfs/dbraw/zinc/50/92/29/1035509229.db2.gz VIBCCWBTSZIROT-AWEZNQCLSA-N 0 1 302.245 4.383 20 0 DIADMN Cc1ccc(-c2csc(C[N@@H+]3CC[C@@H](OC(C)C)C3)n2)cc1 ZINC000579709509 1035524944 /nfs/dbraw/zinc/52/49/44/1035524944.db2.gz UTBMJRJIFFLFCG-MRXNPFEDSA-N 0 1 316.470 4.118 20 0 DIADMN Cc1ccc(-c2csc(CN3CC[C@@H](OC(C)C)C3)n2)cc1 ZINC000579709509 1035524949 /nfs/dbraw/zinc/52/49/49/1035524949.db2.gz UTBMJRJIFFLFCG-MRXNPFEDSA-N 0 1 316.470 4.118 20 0 DIADMN CC[C@H](NCc1nc(C)c(C)s1)c1ccc(OC)c(OC)c1 ZINC000153879643 1035527777 /nfs/dbraw/zinc/52/77/77/1035527777.db2.gz PTOCUPCNLSJYEX-AWEZNQCLSA-N 0 1 320.458 4.018 20 0 DIADMN COc1ccc(OC)c([C@H](C)NCc2ccc(Cl)s2)c1 ZINC000035046693 1035531706 /nfs/dbraw/zinc/53/17/06/1035531706.db2.gz PHAMHHVKGSSMMA-JTQLQIEISA-N 0 1 311.834 4.270 20 0 DIADMN COc1cccc(CN[C@H]2CCSc3ccc(F)cc32)c1 ZINC000035043588 1035532602 /nfs/dbraw/zinc/53/26/02/1035532602.db2.gz KFSLGWJAJHZBEE-INIZCTEOSA-N 0 1 303.402 4.161 20 0 DIADMN Oc1cccc(CN[C@@H]2CCSc3ccc(Cl)cc32)c1 ZINC000035047185 1035532839 /nfs/dbraw/zinc/53/28/39/1035532839.db2.gz SVGVLZVPONVHPD-OAHLLOKOSA-N 0 1 305.830 4.372 20 0 DIADMN CCC/C=C/C(=O)NC[C@@H](c1ccccc1Cl)N(CC)CC ZINC000063721924 1035591981 /nfs/dbraw/zinc/59/19/81/1035591981.db2.gz YZUQQLBHPGCDOX-YJJOXIQCSA-N 0 1 322.880 4.195 20 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Cc1nc(CN2CC[C@@H](c3ccncc3)C2)sc1C(C)(C)C ZINC000930517081 1043936216 /nfs/dbraw/zinc/93/62/16/1043936216.db2.gz SPYXDDUIVUEGBN-OAHLLOKOSA-N 0 1 315.486 4.134 20 0 DIADMN Cc1n[nH]c(C(=O)N[C@@H](CC(C)C)c2ccc(Cl)cc2)c1C ZINC000357298411 1043938669 /nfs/dbraw/zinc/93/86/69/1043938669.db2.gz NMRVWZYHDUVRIB-HNNXBMFYSA-N 0 1 319.836 4.197 20 0 DIADMN CC[C@H](c1ccncc1)N(C)Cc1c(C)nn(C(C)(C)C)c1C ZINC000290379660 1043945784 /nfs/dbraw/zinc/94/57/84/1043945784.db2.gz IAHOZAKDUVNJAH-GOSISDBHSA-N 0 1 314.477 4.233 20 0 DIADMN CC(C)(NCCc1cscn1)c1nc2cc(Cl)ccc2o1 ZINC000879160129 1043947812 /nfs/dbraw/zinc/94/78/12/1043947812.db2.gz QUFITYYFYRLPPN-UHFFFAOYSA-N 0 1 321.833 4.005 20 0 DIADMN COC[C@H](N[C@H](C)c1sc(C)nc1C)c1cccc(Cl)c1 ZINC000290420722 1043949155 /nfs/dbraw/zinc/94/91/55/1043949155.db2.gz USBNSQVRWZVVBI-ABAIWWIYSA-N 0 1 324.877 4.452 20 0 DIADMN C[C@H](C(=O)Nc1cccc(Cl)c1O)c1c(F)cccc1F ZINC000179300076 1043954617 /nfs/dbraw/zinc/95/46/17/1043954617.db2.gz FASHXSJEAPTQCE-QMMMGPOBSA-N 0 1 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Cc1nn(C(C)C)cc1CNCc1ccc(-c2ccncc2)cc1 ZINC000369752425 1044814435 /nfs/dbraw/zinc/81/44/35/1044814435.db2.gz AXUNRDJQEUFYEG-UHFFFAOYSA-N 0 1 320.440 4.124 20 0 DIADMN CC1(C)CN(Cc2ccnc3ccccc23)[C@H]1c1cccnc1 ZINC000571716175 1044823995 /nfs/dbraw/zinc/82/39/95/1044823995.db2.gz JZHFGMRZEBCZER-IBGZPJMESA-N 0 1 303.409 4.213 20 0 DIADMN COc1ccc(OC)c([C@H](C)NCc2cnc3ccccc3c2)c1 ZINC000263848690 1044831719 /nfs/dbraw/zinc/83/17/19/1044831719.db2.gz MQYYJORIFHUXNM-AWEZNQCLSA-N 0 1 322.408 4.103 20 0 DIADMN Cc1ccc(CN(C)Cc2cc(Cl)c3c(c2)OCCO3)s1 ZINC000524434922 1044835010 /nfs/dbraw/zinc/83/50/10/1044835010.db2.gz SINDDORMDWMTAI-UHFFFAOYSA-N 0 1 323.845 4.113 20 0 DIADMN C[C@@H](CN(C)[C@H](C)c1nc2ccccc2c(=O)[nH]1)c1ccccc1 ZINC000263896964 1044835490 /nfs/dbraw/zinc/83/54/90/1044835490.db2.gz XPRZPBOYWIIQDZ-LSDHHAIUSA-N 0 1 321.424 4.132 20 0 DIADMN Cc1ccncc1CN[C@H]1CCOc2c(Cl)c(Cl)ccc21 ZINC000370485634 1044839125 /nfs/dbraw/zinc/83/91/25/1044839125.db2.gz SINHHMHATUNBBH-AWEZNQCLSA-N 0 1 323.223 4.310 20 0 DIADMN C[C@H](N[C@H]1CC(C)(C)Oc2cc(F)ccc21)c1ccncc1 ZINC000370577658 1044842852 /nfs/dbraw/zinc/84/28/52/1044842852.db2.gz KQRAPZUKICJZAG-LRDDRELGSA-N 0 1 300.377 4.174 20 0 DIADMN COc1cccc2c1OCC[C@@H]2N[C@@H](C)c1ccc(F)cc1 ZINC000370574086 1044843450 /nfs/dbraw/zinc/84/34/50/1044843450.db2.gz PFVMWZKKPLLDNA-LRDDRELGSA-N 0 1 301.361 4.009 20 0 DIADMN CCc1noc([C@@H](C)NCC2(c3ccccc3)CCCCC2)n1 ZINC000524447230 1044844465 /nfs/dbraw/zinc/84/44/65/1044844465.db2.gz GLVMHICJZHOXSX-OAHLLOKOSA-N 0 1 313.445 4.185 20 0 DIADMN CSc1ccc(NC(=O)CN2CCCC3(CCCC3)C2)cc1 ZINC000445871753 1044844913 /nfs/dbraw/zinc/84/49/13/1044844913.db2.gz NSLDLIUODOUCAG-UHFFFAOYSA-N 0 1 318.486 4.003 20 0 DIADMN CC(C)[C@H](NCc1cnn2ccccc12)c1cc(F)ccc1F ZINC000572186007 1044847109 /nfs/dbraw/zinc/84/71/09/1044847109.db2.gz GUXFGRWYULKFPK-SFHVURJKSA-N 0 1 315.367 4.099 20 0 DIADMN Cc1ccc(Oc2ccccc2NC(=O)CN(C)C(C)C)cc1 ZINC000524470732 1044847678 /nfs/dbraw/zinc/84/76/78/1044847678.db2.gz ZQXPRGZLSYHSDY-UHFFFAOYSA-N 0 1 312.413 4.066 20 0 DIADMN c1ccc2c(c1)CCC[C@H]2Sc1nc(-c2cccnc2)n[nH]1 ZINC000524467504 1044848433 /nfs/dbraw/zinc/84/84/33/1044848433.db2.gz WVRFQSGHAICNTH-OAHLLOKOSA-N 0 1 308.410 4.036 20 0 DIADMN C[C@@]1(C(=O)[O-])CC[N@@H+](Cc2ccc(C3CCCCC3)cc2)C1 ZINC000572332699 1044854195 /nfs/dbraw/zinc/85/41/95/1044854195.db2.gz MORPYDBFENPTJS-LJQANCHMSA-N 0 1 301.430 4.031 20 0 DIADMN c1cc(-c2noc(CN3CCC[C@@]4(CC=CCC4)C3)n2)cs1 ZINC000114495659 1044863679 /nfs/dbraw/zinc/86/36/79/1044863679.db2.gz KEDRDIHPYSLWBK-KRWDZBQOSA-N 0 1 315.442 4.120 20 0 DIADMN C[C@H](N[C@@H]1c2cccc(F)c2CC[C@@H]1C)c1ccncc1F ZINC000572667277 1044869440 /nfs/dbraw/zinc/86/94/40/1044869440.db2.gz OOYXBPXLISPXOB-PZROIBLQSA-N 0 1 302.368 4.334 20 0 DIADMN Clc1ccc(CN[C@@H](c2ncc[nH]2)C2CCCCC2)cc1 ZINC000572707720 1044872730 /nfs/dbraw/zinc/87/27/30/1044872730.db2.gz FHDVYGCJEUNDRT-MRXNPFEDSA-N 0 1 303.837 4.474 20 0 DIADMN C[C@@H](c1ccco1)[N@@H+](CC[C@H](C(=O)[O-])c1ccccc1)C1CC1 ZINC000572728232 1044873156 /nfs/dbraw/zinc/87/31/56/1044873156.db2.gz DYNXFTRHRPVTBX-YOEHRIQHSA-N 0 1 313.397 4.064 20 0 DIADMN COc1ccncc1CN[C@@H](c1cc2ccccc2o1)C(C)C ZINC000572741496 1044873973 /nfs/dbraw/zinc/87/39/73/1044873973.db2.gz HKFVQHZJILAZEG-LJQANCHMSA-N 0 1 310.397 4.323 20 0 DIADMN CN(Cc1csc(C2CCCC2)n1)C1Cc2ccccc2C1 ZINC000572997491 1044886312 /nfs/dbraw/zinc/88/63/12/1044886312.db2.gz WHBSYBILMRUKAV-UHFFFAOYSA-N 0 1 312.482 4.400 20 0 DIADMN Clc1cccnc1S[C@H]1CCN(Cc2ccccc2)C1 ZINC000572979536 1044886721 /nfs/dbraw/zinc/88/67/21/1044886721.db2.gz PKUAHKGTCNCXJY-AWEZNQCLSA-N 0 1 304.846 4.102 20 0 DIADMN C[C@@H](c1nnc(-c2cccs2)o1)N1CCCCC(C)(C)C1 ZINC000446068364 1044892713 /nfs/dbraw/zinc/89/27/13/1044892713.db2.gz HVWNUWTUCUSQEB-LBPRGKRZSA-N 0 1 305.447 4.371 20 0 DIADMN Cc1cc([C@H](C)NCc2ccnc(N3CCCCC3)c2)oc1C ZINC000337412829 1044893727 /nfs/dbraw/zinc/89/37/27/1044893727.db2.gz XCSQAAHUVABZJT-HNNXBMFYSA-N 0 1 313.445 4.133 20 0 DIADMN C[C@H](c1nc(-c2cccs2)no1)N1CCCCC(C)(C)C1 ZINC000446085728 1044893846 /nfs/dbraw/zinc/89/38/46/1044893846.db2.gz WYWSKIPPLDRESE-GFCCVEGCSA-N 0 1 305.447 4.371 20 0 DIADMN COc1ccc2ncc(Nc3ccc4[nH]c(C)nc4c3)cc2c1 ZINC001213071316 1044895104 /nfs/dbraw/zinc/89/51/04/1044895104.db2.gz LHNNZIJXBMYUKP-UHFFFAOYSA-N 0 1 304.353 4.172 20 0 DIADMN Cc1nc2cc(Nc3cncc(N4CCCCC4)c3)ccc2[nH]1 ZINC001213072365 1044899302 /nfs/dbraw/zinc/89/93/02/1044899302.db2.gz PKPOVQNBWOMWSI-UHFFFAOYSA-N 0 1 307.401 4.000 20 0 DIADMN C[C@@H](N[C@H]1CCc2ccc(Br)cc21)c1ccccn1 ZINC000193157499 1044899781 /nfs/dbraw/zinc/89/97/81/1044899781.db2.gz LHHDHJUMXXEPEC-BZNIZROVSA-N 0 1 317.230 4.182 20 0 DIADMN C[C@@H](N[C@@H](c1cccnc1)C1CC1)c1cnn(C2CCCC2)c1 ZINC000337445591 1044901165 /nfs/dbraw/zinc/90/11/65/1044901165.db2.gz GMUGTXPKJHTZNG-AUUYWEPGSA-N 0 1 310.445 4.195 20 0 DIADMN CC[C@H](C)N(Cc1ccccc1)C(=O)c1cc(C)cc2c[nH]nc21 ZINC000524680217 1044901867 /nfs/dbraw/zinc/90/18/67/1044901867.db2.gz PQAWDQHVKDLRMM-HNNXBMFYSA-N 0 1 321.424 4.312 20 0 DIADMN Cc1ccc2c(C3=CCN([C@H](C)c4cnccn4)CC3)c[nH]c2c1 ZINC000372049572 1044902883 /nfs/dbraw/zinc/90/28/83/1044902883.db2.gz UGMQAOFACVWGRQ-OAHLLOKOSA-N 0 1 318.424 4.117 20 0 DIADMN CC(C)c1ncc(-c2nc3cnc(C(F)(F)F)cc3[nH]2)s1 ZINC000446144557 1044904758 /nfs/dbraw/zinc/90/47/58/1044904758.db2.gz MKQCQAWJEXGUGW-UHFFFAOYSA-N 0 1 312.320 4.224 20 0 DIADMN CC(C)c1ncc(-c2nc3cc(C(F)(F)F)ncc3[nH]2)s1 ZINC000446144557 1044904768 /nfs/dbraw/zinc/90/47/68/1044904768.db2.gz MKQCQAWJEXGUGW-UHFFFAOYSA-N 0 1 312.320 4.224 20 0 DIADMN FC(F)O[C@@H]1CCC[C@H]1NCc1csc(C2CCCC2)n1 ZINC000348449333 1044907405 /nfs/dbraw/zinc/90/74/05/1044907405.db2.gz FZWRYVCUXMUJSR-CHWSQXEVSA-N 0 1 316.417 4.051 20 0 DIADMN FC(F)O[C@@H]1CCC[C@@H]1NCc1csc(C2CCCC2)n1 ZINC000348449335 1044908087 /nfs/dbraw/zinc/90/80/87/1044908087.db2.gz FZWRYVCUXMUJSR-QWHCGFSZSA-N 0 1 316.417 4.051 20 0 DIADMN C[C@@H](NCc1ccc2ccccc2n1)c1cnn(C2CCCC2)c1 ZINC000337491279 1044909766 /nfs/dbraw/zinc/90/97/66/1044909766.db2.gz WHPQZZOSOPVYHF-OAHLLOKOSA-N 0 1 320.440 4.397 20 0 DIADMN CCC[C@]1(CO)CCN(Cc2ccc(Oc3ccccc3)o2)C1 ZINC000573487210 1044910110 /nfs/dbraw/zinc/91/01/10/1044910110.db2.gz IGBYUGKWNRFHAW-IBGZPJMESA-N 0 1 315.413 4.056 20 0 DIADMN O=C(Nc1ccc2ccc(Cl)cc2n1)c1cccc2nc[nH]c21 ZINC000337515540 1044911806 /nfs/dbraw/zinc/91/18/06/1044911806.db2.gz PXEYYVIEAATPLZ-UHFFFAOYSA-N 0 1 322.755 4.017 20 0 DIADMN Fc1ccccc1[C@H]1CC[N@@H+](Cc2cnn(-c3ccccc3)c2)C1 ZINC000337505540 1044912046 /nfs/dbraw/zinc/91/20/46/1044912046.db2.gz OJJDYWIHURIQPK-KRWDZBQOSA-N 0 1 321.399 4.001 20 0 DIADMN CC[C@@H](Nc1cnn(CC)c1)c1ccc(Cl)c(Cl)c1O ZINC000157471225 1044913099 /nfs/dbraw/zinc/91/30/99/1044913099.db2.gz ITABGYCEHOPLHW-GFCCVEGCSA-N 0 1 314.216 4.479 20 0 DIADMN CC(C)c1nc([C@H](C)N[C@@H]2CCC[C@H]2OC(F)F)cs1 ZINC000337550989 1044918080 /nfs/dbraw/zinc/91/80/80/1044918080.db2.gz ONKOFDDHWSUZDQ-HOSYDEDBSA-N 0 1 304.406 4.077 20 0 DIADMN CC(C)c1nc([C@H](C)N[C@H]2CCC[C@@H]2OC(F)F)cs1 ZINC000337550991 1044918660 /nfs/dbraw/zinc/91/86/60/1044918660.db2.gz ONKOFDDHWSUZDQ-NHCYSSNCSA-N 0 1 304.406 4.077 20 0 DIADMN CCc1ccc(-c2ccc(CN[C@H](CO)c3ccccc3)o2)cc1 ZINC000524773379 1044919345 /nfs/dbraw/zinc/91/93/45/1044919345.db2.gz SARKXDJYKZHQPK-HXUWFJFHSA-N 0 1 321.420 4.332 20 0 DIADMN Cc1nnsc1CN1CCCCC[C@@H]1/C=C/c1ccccc1 ZINC000573763636 1044921149 /nfs/dbraw/zinc/92/11/49/1044921149.db2.gz ZPXXVLRGHOZEAQ-FMQWLBJXSA-N 0 1 313.470 4.305 20 0 DIADMN O=C(Nc1ccc2ccc(Cl)cc2n1)c1cccc2c[nH]nc21 ZINC000337572481 1044923028 /nfs/dbraw/zinc/92/30/28/1044923028.db2.gz ZWPPDJLKNMVTDH-UHFFFAOYSA-N 0 1 322.755 4.017 20 0 DIADMN c1ncn2cc(-c3nc(-c4ccc5ccccc5c4)no3)ccc12 ZINC000573842771 1044926316 /nfs/dbraw/zinc/92/63/16/1044926316.db2.gz FBOQNPQPEVOLGN-UHFFFAOYSA-N 0 1 312.332 4.205 20 0 DIADMN C[C@@H](c1ccccc1F)N(C)Cc1ccc(-n2ccnc2)cc1 ZINC000337619189 1044927093 /nfs/dbraw/zinc/92/70/93/1044927093.db2.gz DFWIBVZTBUWIJJ-HNNXBMFYSA-N 0 1 309.388 4.204 20 0 DIADMN Cc1nn(C(C)(C)C)cc1[C@H](C)N[C@H](C)c1cccc(F)c1 ZINC000133140636 1044927602 /nfs/dbraw/zinc/92/76/02/1044927602.db2.gz JACPMBWELHABTA-OLZOCXBDSA-N 0 1 303.425 4.497 20 0 DIADMN CC(=O)Nc1cccc(C[N@H+]([C@@H](C)c2ccccc2)C2CC2)c1 ZINC000337660309 1044937160 /nfs/dbraw/zinc/93/71/60/1044937160.db2.gz LADIXKCXGCJERC-HNNXBMFYSA-N 0 1 308.425 4.371 20 0 DIADMN c1sc(CN2CCC3(C2)CCOCC3)nc1C1CCCCC1 ZINC000373073558 1044937666 /nfs/dbraw/zinc/93/76/66/1044937666.db2.gz DZNKLQIBHGUATM-UHFFFAOYSA-N 0 1 320.502 4.193 20 0 DIADMN CCC(CC)[C@@H](NCc1cn(C(C)C)nn1)c1cccs1 ZINC000574072482 1044938457 /nfs/dbraw/zinc/93/84/57/1044938457.db2.gz HXSIDVZZYJWJOP-MRXNPFEDSA-N 0 1 306.479 4.188 20 0 DIADMN CCOC(=O)c1nc(CN2CCCCC[C@H]2CC(C)C)cs1 ZINC000524893777 1044942700 /nfs/dbraw/zinc/94/27/00/1044942700.db2.gz MUQKRQGAGPXPJP-HNNXBMFYSA-N 0 1 324.490 4.111 20 0 DIADMN C[C@H]1CCCC[N@@H+](Cc2c3ccccc3sc2C(=O)[O-])C1 ZINC000574165309 1044943036 /nfs/dbraw/zinc/94/30/36/1044943036.db2.gz URHHPTMVGBQCMF-LBPRGKRZSA-N 0 1 303.427 4.222 20 0 DIADMN CCOC(=O)c1nc(CN2CCCCC[C@@H]2CC(C)C)cs1 ZINC000524893778 1044944488 /nfs/dbraw/zinc/94/44/88/1044944488.db2.gz MUQKRQGAGPXPJP-OAHLLOKOSA-N 0 1 324.490 4.111 20 0 DIADMN Cc1cnc(CN[C@H]2CCC[C@H]2c2ccccc2C(F)(F)F)o1 ZINC000134204818 1044954639 /nfs/dbraw/zinc/95/46/39/1044954639.db2.gz HHBQLYUIDJEHPC-ZFWWWQNUSA-N 0 1 324.346 4.428 20 0 DIADMN C[C@@H]1CC[C@H](C)N1CC(=O)Nc1ccc(Oc2ccccc2)cc1 ZINC000524961625 1044957400 /nfs/dbraw/zinc/95/74/00/1044957400.db2.gz ZPWFMSVVCAHOSN-IYBDPMFKSA-N 0 1 324.424 4.290 20 0 DIADMN Cc1ncc(CN[C@H](C)c2ccccc2Oc2ccccc2)cn1 ZINC000337865902 1044959084 /nfs/dbraw/zinc/95/90/84/1044959084.db2.gz OQDWQKXQEIXIAL-OAHLLOKOSA-N 0 1 319.408 4.428 20 0 DIADMN COc1cccc2c(C(=O)Nc3cccc4ccsc43)n[nH]c21 ZINC000574605905 1044963309 /nfs/dbraw/zinc/96/33/09/1044963309.db2.gz AQIOMELUBBROJN-UHFFFAOYSA-N 0 1 323.377 4.039 20 0 DIADMN COc1cccc2cc([C@@H](C)N[C@@H]3CCc4c3cccc4O)oc21 ZINC000134705939 1044965208 /nfs/dbraw/zinc/96/52/08/1044965208.db2.gz XKBYXWHDBBLGFA-MLGOLLRUSA-N 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CCC[C@@H]([NH2+]Cc1cc(C(=O)[O-])c(C)o1)c1ccc(F)cc1F ZINC000902382842 1045989031 /nfs/dbraw/zinc/98/90/31/1045989031.db2.gz VLWXYVVCJYADIF-MRXNPFEDSA-N 0 1 323.339 4.195 20 0 DIADMN CC(C)[C@H]([NH2+]Cc1ccc(/C=C/C(=O)[O-])o1)c1ccccc1F ZINC000902383755 1045989056 /nfs/dbraw/zinc/98/90/56/1045989056.db2.gz ZXZVOYRFXQFNMB-BBVFFXRHSA-N 0 1 317.360 4.003 20 0 DIADMN Fc1cc(CN2CC[C@H](c3ccncc3)C2)cc(C(F)(F)F)c1 ZINC001137864867 1045990875 /nfs/dbraw/zinc/99/08/75/1045990875.db2.gz QHEPCHXAEFDEMJ-AWEZNQCLSA-N 0 1 324.321 4.229 20 0 DIADMN CCn1ccnc1[C@H](C)NC[C@@H](C)Oc1ccc(C(C)C)cc1 ZINC000453221851 1045991108 /nfs/dbraw/zinc/99/11/08/1045991108.db2.gz KOWTWTGBWPCYOM-CVEARBPZSA-N 0 1 315.461 4.145 20 0 DIADMN Cc1nc2c(n1C[C@@H]1[C@@H](c3ccccc3)C1(F)F)CCCC2 ZINC000902422649 1045994493 /nfs/dbraw/zinc/99/44/93/1045994493.db2.gz MHTUJQNWUCRUOI-RHSMWYFYSA-N 0 1 302.368 4.119 20 0 DIADMN C[C@H]1CCCC[N@@H+](Cc2ccc(-c3ccc(C(=O)[O-])cc3)o2)C1 ZINC000902418091 1045994894 /nfs/dbraw/zinc/99/48/94/1045994894.db2.gz NUQNFFPXWXLYLK-AWEZNQCLSA-N 0 1 313.397 4.267 20 0 DIADMN Fc1cc(F)c(F)c(CN2CCCC3(CC(F)C3)CC2)c1 ZINC001137873367 1045994659 /nfs/dbraw/zinc/99/46/59/1045994659.db2.gz BMQMEWKLJIEBMQ-UHFFFAOYSA-N 0 1 301.327 4.208 20 0 DIADMN CCC[C@H](CN[C@H](c1cc2ccccc2o1)c1cccnc1)OC ZINC000453248190 1046002496 /nfs/dbraw/zinc/00/24/96/1046002496.db2.gz KSFSJZQDCCDKEV-XLIONFOSSA-N 0 1 324.424 4.322 20 0 DIADMN Cc1ccc(N(C)c2ccc(CN3CC(C(F)F)C3)cc2)cc1 ZINC001137898089 1046005422 /nfs/dbraw/zinc/00/54/22/1046005422.db2.gz FCPDZUSTEOQHNT-UHFFFAOYSA-N 0 1 316.395 4.460 20 0 DIADMN Cc1ccc([C@H](NCc2csc(N)n2)C2CCCC2)cc1 ZINC000902497971 1046007456 /nfs/dbraw/zinc/00/74/56/1046007456.db2.gz CGPZBCWJODDZMN-MRXNPFEDSA-N 0 1 301.459 4.055 20 0 DIADMN Cc1nc(C)c([C@H](C)NCc2cccc(C(F)(F)F)n2)s1 ZINC000453264261 1046007646 /nfs/dbraw/zinc/00/76/46/1046007646.db2.gz IIHDGLHBIVIULV-QMMMGPOBSA-N 0 1 315.364 4.025 20 0 DIADMN CCc1oc(C[N@@H+](CC2CCCCC2)C2CC2)cc1C(=O)[O-] ZINC000902512467 1046008851 /nfs/dbraw/zinc/00/88/51/1046008851.db2.gz NSCOQXMOGODZKK-UHFFFAOYSA-N 0 1 305.418 4.085 20 0 DIADMN CC[C@H](NCc1cccc(C(F)(F)F)n1)c1cccs1 ZINC000453268936 1046008914 /nfs/dbraw/zinc/00/89/14/1046008914.db2.gz OWIGQRMIYQSEJV-NSHDSACASA-N 0 1 300.349 4.403 20 0 DIADMN CC(C)c1nc(CN[C@H](C)c2ccccc2C(C)(C)C)n[nH]1 ZINC000453278285 1046011183 /nfs/dbraw/zinc/01/11/83/1046011183.db2.gz COKXUZDATPSDLZ-CYBMUJFWSA-N 0 1 300.450 4.076 20 0 DIADMN CC(C)[C@@H]1CCC[N@H+]1Cc1ccc(-c2ccccc2C(=O)[O-])o1 ZINC000902525364 1046011511 /nfs/dbraw/zinc/01/15/11/1046011511.db2.gz SWNRPKHYFJBTMX-KRWDZBQOSA-N 0 1 313.397 4.265 20 0 DIADMN c1c[nH]c([C@H](NCC[C@H]2CCc3ccccc32)c2ccccc2)n1 ZINC000453243383 1046011603 /nfs/dbraw/zinc/01/16/03/1046011603.db2.gz FXOYKZFGKKJIAN-YLJYHZDGSA-N 0 1 317.436 4.209 20 0 DIADMN C[C@@H]1C[C@H]2CCCC[C@@H]2[N@H+]1Cc1ccnc2c(C(=O)[O-])cccc12 ZINC000902519295 1046011945 /nfs/dbraw/zinc/01/19/45/1046011945.db2.gz URFWSIXIZBGGTJ-LBTNJELSSA-N 0 1 324.424 4.086 20 0 DIADMN C[C@@H](N[C@H]1CCCc2c(F)cccc21)c1nc2ccccc2n1C ZINC000453241799 1046012019 /nfs/dbraw/zinc/01/20/19/1046012019.db2.gz WHUFDFSIUXUNPG-DYVFJYSZSA-N 0 1 323.415 4.441 20 0 DIADMN COc1nccc(CN[C@H](CCCC(C)C)c2ccccc2)n1 ZINC000453242142 1046012692 /nfs/dbraw/zinc/01/26/92/1046012692.db2.gz FGVXBSQAKKXSFB-GOSISDBHSA-N 0 1 313.445 4.142 20 0 DIADMN CCC[C@@H](C)[N@@H+](C)Cc1ccc(-c2ccccc2C(=O)[O-])o1 ZINC000902524096 1046013014 /nfs/dbraw/zinc/01/30/14/1046013014.db2.gz OOLWXTAYJSKASX-CYBMUJFWSA-N 0 1 301.386 4.265 20 0 DIADMN CC(C)[C@H]1CCC[N@H+]1Cc1ccc(-c2ccc(C(=O)[O-])cc2)o1 ZINC000902524693 1046013277 /nfs/dbraw/zinc/01/32/77/1046013277.db2.gz OHWYALRLJXEJCR-QGZVFWFLSA-N 0 1 313.397 4.265 20 0 DIADMN CC(C)[C@@H]1CCC[N@H+]1Cc1ccc(C(=O)[O-])cc1C(F)(F)F ZINC000902524343 1046013710 /nfs/dbraw/zinc/01/37/10/1046013710.db2.gz MFXVLLUQUBHFQT-AWEZNQCLSA-N 0 1 315.335 4.024 20 0 DIADMN CC[C@@H]1CCC[C@H]1CN[C@H](c1ncc[nH]1)c1ccc(F)cc1 ZINC000453282763 1046013990 /nfs/dbraw/zinc/01/39/90/1046013990.db2.gz IXYYVIFURJALJN-KMFMINBZSA-N 0 1 301.409 4.054 20 0 DIADMN CC(C)CCC[C@H](NCc1n[nH]c(C2CC2)n1)c1ccccc1 ZINC000453284230 1046014099 /nfs/dbraw/zinc/01/40/99/1046014099.db2.gz IBOVSZKCJYDQLX-KRWDZBQOSA-N 0 1 312.461 4.339 20 0 DIADMN C[C@H]1CCC[N@@H+](Cc2ccc(-c3ccc(C(=O)[O-])cc3)o2)[C@H]1C ZINC000902532095 1046014341 /nfs/dbraw/zinc/01/43/41/1046014341.db2.gz WISQXGDQWLZIQZ-KBPBESRZSA-N 0 1 313.397 4.265 20 0 DIADMN Cc1ccc([C@H]2CCC[C@H]2[N@@H+](C)CCC(C)(C)C(=O)[O-])cc1 ZINC000902530732 1046014666 /nfs/dbraw/zinc/01/46/66/1046014666.db2.gz BKUSKULJIYDPHE-IAGOWNOFSA-N 0 1 303.446 4.064 20 0 DIADMN C[C@@H](c1ccc(Cl)c(Cl)c1)[N@@H+](C)CCC(C)(C)C(=O)[O-] ZINC000902530831 1046014710 /nfs/dbraw/zinc/01/47/10/1046014710.db2.gz RCJIDHFPOWKQOC-JTQLQIEISA-N 0 1 318.244 4.487 20 0 DIADMN CNc1ccc(C)cc1CN[C@@H](COC)c1ccc(Cl)cc1 ZINC000902530889 1046014913 /nfs/dbraw/zinc/01/49/13/1046014913.db2.gz REHTYVRNRYUMMR-SFHVURJKSA-N 0 1 318.848 4.167 20 0 DIADMN CC(C)(CC[N@@H+](CCc1ccc(F)cc1)C1CCCC1)C(=O)[O-] ZINC000902531934 1046015360 /nfs/dbraw/zinc/01/53/60/1046015360.db2.gz VONULBHASFYXAH-UHFFFAOYSA-N 0 1 321.436 4.114 20 0 DIADMN CC(=O)c1ccc(O)c(NC(=O)CC[C@@H]2CCc3ccccc32)c1 ZINC001137920867 1046015716 /nfs/dbraw/zinc/01/57/16/1046015716.db2.gz LABBFECVBZGZGE-HNNXBMFYSA-N 0 1 323.392 4.044 20 0 DIADMN CNc1ccc(C)cc1CN[C@H](COC)c1ccc(Cl)cc1 ZINC000902530888 1046015858 /nfs/dbraw/zinc/01/58/58/1046015858.db2.gz REHTYVRNRYUMMR-GOSISDBHSA-N 0 1 318.848 4.167 20 0 DIADMN C[C@@H]1CC(C)(C)C[N@H+]1Cc1ccc(-c2ccccc2C(=O)[O-])o1 ZINC000902532756 1046016220 /nfs/dbraw/zinc/01/62/20/1046016220.db2.gz SKZZYUYFNNDKDN-CYBMUJFWSA-N 0 1 313.397 4.265 20 0 DIADMN C[N@@H+](Cc1ccc(C(=O)[O-])o1)[C@@H]1CCCC[C@@H]1c1ccccc1 ZINC000902542866 1046016766 /nfs/dbraw/zinc/01/67/66/1046016766.db2.gz JQORFJKJNIXPFN-IAGOWNOFSA-N 0 1 313.397 4.136 20 0 DIADMN CCCC1CCC([N@@H+](C)Cc2ccc(/C=C\C(=O)[O-])o2)CC1 ZINC000902537291 1046016813 /nfs/dbraw/zinc/01/68/13/1046016813.db2.gz RLNMHSGNHHLZNU-QXMHVHEDSA-N 0 1 305.418 4.168 20 0 DIADMN C[C@@H]1C[C@@H](c2ccccc2)[C@@H](C)[N@H+]1Cc1cc(C(=O)[O-])cs1 ZINC000902540244 1046017112 /nfs/dbraw/zinc/01/71/12/1046017112.db2.gz DRRYVSNUNXCUBE-PBFPGSCMSA-N 0 1 315.438 4.213 20 0 DIADMN C[C@@H]1C[C@@H](c2ccccc2)[C@H](C)[N@H+]1Cc1cc(C(=O)[O-])cs1 ZINC000902540236 1046018220 /nfs/dbraw/zinc/01/82/20/1046018220.db2.gz DRRYVSNUNXCUBE-IIYDPXPESA-N 0 1 315.438 4.213 20 0 DIADMN Cc1oc(C[N@H+]2[C@H](C)C[C@@H](c3ccccc3)[C@@H]2C)cc1C(=O)[O-] ZINC000902543828 1046018519 /nfs/dbraw/zinc/01/85/19/1046018519.db2.gz VWAYXQISRSWLRR-IIYDPXPESA-N 0 1 313.397 4.053 20 0 DIADMN Cc1ccc([C@H]2C[C@H](C)[N@H+](Cc3csc(C(=O)[O-])c3)C2)cc1 ZINC000902545736 1046018798 /nfs/dbraw/zinc/01/87/98/1046018798.db2.gz KPANVMFKDIOOGQ-BBRMVZONSA-N 0 1 315.438 4.133 20 0 DIADMN C[C@@H]1C[N@@H+](Cc2ccc(C(=O)[O-])c(Cl)c2)[C@@H]2CCCC[C@@H]21 ZINC000902540627 1046019392 /nfs/dbraw/zinc/01/93/92/1046019392.db2.gz GHMJKERJAHXNSS-AXAPSJFSSA-N 0 1 307.821 4.049 20 0 DIADMN CC[C@@](C)(CN[C@@H](C)c1csc(-c2ccccc2F)n1)OC ZINC000453297901 1046020409 /nfs/dbraw/zinc/02/04/09/1046020409.db2.gz IHQZXRILYAJLHM-SJCJKPOMSA-N 0 1 322.449 4.415 20 0 DIADMN CCc1oc(CN[C@@](C)(CC)c2ccccc2)cc1C(=O)OC ZINC000802645635 1046022364 /nfs/dbraw/zinc/02/23/64/1046022364.db2.gz WKNYSNCCVBJAQE-IBGZPJMESA-N 0 1 315.413 4.044 20 0 DIADMN Cc1cccc2c1CC[C@H]2NCc1cccc(C(F)(F)F)n1 ZINC000453274912 1046022608 /nfs/dbraw/zinc/02/26/08/1046022608.db2.gz XNVHIWOPDGNGNQ-OAHLLOKOSA-N 0 1 306.331 4.186 20 0 DIADMN Fc1ccc(CN2CCCC3(CC(F)C3)CC2)c(F)c1F ZINC001137940260 1046025441 /nfs/dbraw/zinc/02/54/41/1046025441.db2.gz PYAZXRPNYXMMDX-UHFFFAOYSA-N 0 1 301.327 4.208 20 0 DIADMN CC(=O)C1CCN(Cc2ccc(SC(F)(F)F)cc2)CC1 ZINC001137955123 1046029744 /nfs/dbraw/zinc/02/97/44/1046029744.db2.gz HLPBSSILGVANTQ-UHFFFAOYSA-N 0 1 317.376 4.100 20 0 DIADMN CC[C@@H]1C[C@H]1CN[C@@H](c1cccnc1)c1ccc(F)cc1F ZINC000453313327 1046031521 /nfs/dbraw/zinc/03/15/21/1046031521.db2.gz WNPIDTNRUPNTFE-IAISJRAMSA-N 0 1 302.368 4.085 20 0 DIADMN Cc1ccc(CN2CCC(c3cccc(O)c3)CC2)c(F)c1F ZINC001137971405 1046039507 /nfs/dbraw/zinc/03/95/07/1046039507.db2.gz RTJIQJSWVURGHC-UHFFFAOYSA-N 0 1 317.379 4.358 20 0 DIADMN COc1cccc([C@@H]2CCN(Cc3ccc(C)c(F)c3F)C2)c1 ZINC001137971289 1046039547 /nfs/dbraw/zinc/03/95/47/1046039547.db2.gz NBXYDGBXBAAQOB-OAHLLOKOSA-N 0 1 317.379 4.271 20 0 DIADMN CC[C@H](NCc1ccccc1NC)c1cc(F)ccc1OC ZINC000902654736 1046040338 /nfs/dbraw/zinc/04/03/38/1046040338.db2.gz XDLXQIQGZOIORG-INIZCTEOSA-N 0 1 302.393 4.117 20 0 DIADMN Cc1ccncc1CN[C@H]1CCCOc2c(C)cc(Cl)cc21 ZINC000453326011 1046040961 /nfs/dbraw/zinc/04/09/61/1046040961.db2.gz MXPADZRGHONFRR-KRWDZBQOSA-N 0 1 316.832 4.355 20 0 DIADMN C[C@@H]1CCc2c(F)cccc2[C@@H]1NCc1cnc(C2CC2)o1 ZINC000453342126 1046044550 /nfs/dbraw/zinc/04/45/50/1046044550.db2.gz FTYKVNIOSHTJKN-PIGZYNQJSA-N 0 1 300.377 4.104 20 0 DIADMN Cc1cccnc1[C@@H](N[C@@H](C)c1cncc(F)c1)C(C)(C)C ZINC000902695095 1046045253 /nfs/dbraw/zinc/04/52/53/1046045253.db2.gz PFCUOFQYCYRFBZ-SUMWQHHRSA-N 0 1 301.409 4.362 20 0 DIADMN Cc1cc([C@H](NCc2cnc(C3CC3)o2)C2CC2)ccc1F ZINC000453346621 1046050873 /nfs/dbraw/zinc/05/08/73/1046050873.db2.gz IIUBLRCESVERMN-QGZVFWFLSA-N 0 1 300.377 4.240 20 0 DIADMN COc1cccnc1CN[C@@H](C)c1ccc(OC)c2ccccc21 ZINC000453351720 1046052187 /nfs/dbraw/zinc/05/21/87/1046052187.db2.gz FIFDWPDGXYGVRC-AWEZNQCLSA-N 0 1 322.408 4.103 20 0 DIADMN CSCCCCCOC(=O)c1[nH]c(-c2ccccc2)nc1C ZINC000756135837 1046053502 /nfs/dbraw/zinc/05/35/02/1046053502.db2.gz IXTQLQSKVXJFKT-UHFFFAOYSA-N 0 1 318.442 4.075 20 0 DIADMN CCC[C@H](N[C@@H](C)c1nccn1CC)c1ccc(OC)cc1 ZINC000453349638 1046053813 /nfs/dbraw/zinc/05/38/13/1046053813.db2.gz LRXJITOPTKGPDE-YOEHRIQHSA-N 0 1 301.434 4.104 20 0 DIADMN Cc1ccc(CN2CCC(=O)[C@@H]3CCCC[C@H]32)c2ccccc12 ZINC001138012927 1046057542 /nfs/dbraw/zinc/05/75/42/1046057542.db2.gz GANYZKCLUUKGJB-WOJBJXKFSA-N 0 1 307.437 4.482 20 0 DIADMN C[C@@H](N[C@@H]1CCCN(C)c2ccccc21)c1ccc(Cl)cn1 ZINC000453360170 1046058010 /nfs/dbraw/zinc/05/80/10/1046058010.db2.gz KIWWBIPXTBGEQM-CXAGYDPISA-N 0 1 315.848 4.357 20 0 DIADMN Cc1ccc(CN2CCO[C@H](c3ccncc3)C2)c2ccccc12 ZINC001138018315 1046059285 /nfs/dbraw/zinc/05/92/85/1046059285.db2.gz SHNAJHLWYSRMFE-NRFANRHFSA-N 0 1 318.420 4.117 20 0 DIADMN C[C@H](c1nc2c(s1)CCCC2)N1CCC[C@@]2(CCSC2)C1 ZINC000453384099 1046059362 /nfs/dbraw/zinc/05/93/62/1046059362.db2.gz ZJYCMCXYIUVBRJ-CXAGYDPISA-N 0 1 322.543 4.302 20 0 DIADMN COCc1cccc(CN[C@@H](C)c2ccc(C(F)(F)F)cn2)c1 ZINC000902749147 1046059654 /nfs/dbraw/zinc/05/96/54/1046059654.db2.gz QEFXJTLXNKQJTB-LBPRGKRZSA-N 0 1 324.346 4.098 20 0 DIADMN Cc1ccc(OC(F)F)c([C@H](C)NCc2cnc(C)cc2C)c1 ZINC000453384121 1046060148 /nfs/dbraw/zinc/06/01/48/1046060148.db2.gz ZKPFCWDJYPSAQJ-AWEZNQCLSA-N 0 1 320.383 4.459 20 0 DIADMN C[C@@H](NCc1ccc([C@H](C)O)cc1)c1ccc(C(F)(F)F)cn1 ZINC000902762723 1046064509 /nfs/dbraw/zinc/06/45/09/1046064509.db2.gz 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CC1(C)CN[C@@H]1c1nc(-c2cccc(Oc3ccccc3)c2)no1 ZINC000666570878 1046376934 /nfs/dbraw/zinc/37/69/34/1046376934.db2.gz AZPWXFNGWIYMNO-MRXNPFEDSA-N 0 1 321.380 4.199 20 0 DIADMN Fc1ccc(-c2cccc(CN3CCc4cccnc4C3)c2)cc1 ZINC001139069660 1046379994 /nfs/dbraw/zinc/37/99/94/1046379994.db2.gz SVLXHDCMWYUWGZ-UHFFFAOYSA-N 0 1 318.395 4.446 20 0 DIADMN Cc1ccc(-c2n[nH]c(SCc3ccnc(Cl)c3)n2)cc1 ZINC000748586607 1046384681 /nfs/dbraw/zinc/38/46/81/1046384681.db2.gz KPZLYUDNEQQHFG-UHFFFAOYSA-N 0 1 316.817 4.121 20 0 DIADMN COc1cc(O)ccc1CN(C)Cc1ccc2ccccc2c1 ZINC001139144548 1046391468 /nfs/dbraw/zinc/39/14/68/1046391468.db2.gz HESADFXKCFKPCQ-UHFFFAOYSA-N 0 1 307.393 4.186 20 0 DIADMN COc1cc(O)ccc1CN1CCC[C@H]1c1cccc(Cl)c1 ZINC001139144559 1046392229 /nfs/dbraw/zinc/39/22/29/1046392229.db2.gz HRDXWQKFSHQPCY-KRWDZBQOSA-N 0 1 317.816 4.391 20 0 DIADMN CC(C)c1nnc(CN[C@H]2CC[C@H](c3ccc(F)cc3)C2)s1 ZINC000780535467 1046392392 /nfs/dbraw/zinc/39/23/92/1046392392.db2.gz FORUCCNSXYFXSZ-ZFWWWQNUSA-N 0 1 319.449 4.227 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CCCCCC[C@@H](C)C(=O)Nc1ccc2nc(N(C)C)[nH]c2c1 ZINC001139218404 1046414961 /nfs/dbraw/zinc/41/49/61/1046414961.db2.gz RMQKKIPIKJSVDH-CYBMUJFWSA-N 0 1 316.449 4.174 20 0 DIADMN CCCCC[C@@](C)(CC)C(=O)N[C@H](C)c1n[nH]c(C(C)C)n1 ZINC000780972537 1046415275 /nfs/dbraw/zinc/41/52/75/1046415275.db2.gz DVPZLFZVXBDUPL-CXAGYDPISA-N 0 1 308.470 4.102 20 0 DIADMN Clc1ccc([C@H]2CCCN2Cc2ccc3nonc3c2)cc1 ZINC001139221953 1046416231 /nfs/dbraw/zinc/41/62/31/1046416231.db2.gz XSKPDMKGQJYUFT-QGZVFWFLSA-N 0 1 313.788 4.213 20 0 DIADMN CC/C(C)=C(\C)C(=O)Nc1cccc2c1CN(CC(C)C)C2 ZINC000780987011 1046416192 /nfs/dbraw/zinc/41/61/92/1046416192.db2.gz SRRNKHUHHADJNF-CCEZHUSRSA-N 0 1 300.446 4.343 20 0 DIADMN CCCCC[C@@](C)(CC)C(=O)N1CCC(c2cc(C)[nH]n2)CC1 ZINC000780989819 1046416703 /nfs/dbraw/zinc/41/67/03/1046416703.db2.gz HKVUKCIPRDGJBP-LJQANCHMSA-N 0 1 319.493 4.421 20 0 DIADMN Clc1cccc([C@H]2CCCN2Cc2ccc3nonc3c2)c1 ZINC001139223689 1046417161 /nfs/dbraw/zinc/41/71/61/1046417161.db2.gz WUEJILQWGPJKHW-QGZVFWFLSA-N 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CETMVOHHHNECLD-XYZKALLWSA-N 0 1 321.848 4.044 20 0 DIADMN F[C@H]1CCN(Cc2c[nH]c3cc(OCc4ccccc4)ccc23)C1 ZINC001140227880 1046619156 /nfs/dbraw/zinc/61/91/56/1046619156.db2.gz JQBHTHXYYLSZNS-KRWDZBQOSA-N 0 1 324.399 4.291 20 0 DIADMN Cc1cc(C)c(CN(C)Cc2cccc(OC(F)(F)F)c2)[nH]1 ZINC001137333454 1046620157 /nfs/dbraw/zinc/62/01/57/1046620157.db2.gz IBJICZGWQSOIPK-UHFFFAOYSA-N 0 1 312.335 4.162 20 0 DIADMN CN(C(=O)c1ccc(Cl)cc1O)c1ccc2ccccc2c1 ZINC000834475198 1046623317 /nfs/dbraw/zinc/62/33/17/1046623317.db2.gz NAVDZGCMHCSUIP-UHFFFAOYSA-N 0 1 311.768 4.475 20 0 DIADMN Cc1cnc([C@@H](C)Sc2n[nH]c(CCC3CCCC3)n2)o1 ZINC000678353415 1046623591 /nfs/dbraw/zinc/62/35/91/1046623591.db2.gz SMKRJHWGENCOOV-LLVKDONJSA-N 0 1 306.435 4.077 20 0 DIADMN Cc1cnc([C@@H](C)Sc2nc(CCC3CCCC3)n[nH]2)o1 ZINC000678353415 1046623592 /nfs/dbraw/zinc/62/35/92/1046623592.db2.gz SMKRJHWGENCOOV-LLVKDONJSA-N 0 1 306.435 4.077 20 0 DIADMN Cc1ccncc1[C@@H](C)NCc1cc(C(F)(F)F)ccc1F ZINC000678362295 1046624587 /nfs/dbraw/zinc/62/45/87/1046624587.db2.gz AMPGTKMYHGUQLX-LLVKDONJSA-N 0 1 312.310 4.399 20 0 DIADMN Cc1ccncc1[C@@H](C)NCc1ccc(Br)cc1F ZINC000678362005 1046625442 /nfs/dbraw/zinc/62/54/42/1046625442.db2.gz POQGGFNWDPZWCT-LLVKDONJSA-N 0 1 323.209 4.142 20 0 DIADMN Cc1ccc2ncnc(NCc3nc4ccc(Cl)cc4[nH]3)c2c1 ZINC000678401915 1046626732 /nfs/dbraw/zinc/62/67/32/1046626732.db2.gz REAHBPYORUILBG-UHFFFAOYSA-N 0 1 323.787 4.080 20 0 DIADMN Cc1ccncc1[C@H](C)NCc1cnc(C2CCCC2)s1 ZINC000678362671 1046627056 /nfs/dbraw/zinc/62/70/56/1046627056.db2.gz KSXQHJSFYAYNOB-ZDUSSCGKSA-N 0 1 301.459 4.355 20 0 DIADMN CCCCc1ccc(C(=O)Nc2ccccc2-c2nnc[nH]2)cc1 ZINC000678371599 1046627440 /nfs/dbraw/zinc/62/74/40/1046627440.db2.gz KLOQSVVFQPDJLZ-UHFFFAOYSA-N 0 1 320.396 4.067 20 0 DIADMN C[C@H]1C[C@H](CNc2ccnc3cc(C(F)(F)F)ccc32)CCO1 ZINC000678408456 1046628837 /nfs/dbraw/zinc/62/88/37/1046628837.db2.gz URZCQWSSLJKNFE-NWDGAFQWSA-N 0 1 324.346 4.481 20 0 DIADMN C[C@@H]1CN(Cc2cccc3[nH]ccc32)C[C@@H](c2ccsc2)O1 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DIADMN Cc1ccc([C@H](C)NCc2ccccc2OCC2CC2)c(C)n1 ZINC000678425806 1046636593 /nfs/dbraw/zinc/63/65/93/1046636593.db2.gz AUXJIQMDUYXRAF-HNNXBMFYSA-N 0 1 310.441 4.338 20 0 DIADMN COc1ccc(Cl)cc1-c1n[nH]c(SCC2CCCC2)n1 ZINC000643093233 1046639021 /nfs/dbraw/zinc/63/90/21/1046639021.db2.gz OQACCVKAHNGQAK-UHFFFAOYSA-N 0 1 323.849 4.416 20 0 DIADMN CCCCCSc1nc(-c2cc(Cl)ccc2OC)n[nH]1 ZINC000643093069 1046639288 /nfs/dbraw/zinc/63/92/88/1046639288.db2.gz CLACLYBRVNWGEZ-UHFFFAOYSA-N 0 1 311.838 4.416 20 0 DIADMN CC(C)N(Cc1sc(N2CCCCC2)nc1Cl)C(C)C ZINC001140288179 1046640027 /nfs/dbraw/zinc/64/00/27/1046640027.db2.gz JVEJEUSLQYFPLJ-UHFFFAOYSA-N 0 1 315.914 4.406 20 0 DIADMN CC[C@H](C)N(C)Cc1nnc(-c2c(Cl)cccc2Cl)o1 ZINC000533046624 1046644014 /nfs/dbraw/zinc/64/40/14/1046644014.db2.gz WKTGYHKPHADJAG-VIFPVBQESA-N 0 1 314.216 4.274 20 0 DIADMN C[C@H](c1ccc(F)cc1F)N1CC[C@@H](Nc2ccccc2)C1 ZINC000533043043 1046644727 /nfs/dbraw/zinc/64/47/27/1046644727.db2.gz NVCOMLAEQIAZEB-CZUORRHYSA-N 0 1 302.368 4.212 20 0 DIADMN Cc1cnc(=S)n(CN2C[C@@H](C)CC[C@@H]2c2ccccc2)c1 ZINC000795704192 1046648019 /nfs/dbraw/zinc/64/80/19/1046648019.db2.gz NZDGFFIWYZSBJY-WMLDXEAASA-N 0 1 313.470 4.352 20 0 DIADMN O=C1CCN(Cc2ccccc2-c2cccnc2)[C@@H]2CCCC[C@H]12 ZINC001140312353 1046650086 /nfs/dbraw/zinc/65/00/86/1046650086.db2.gz BFMPRRFUQXYADT-VQTJNVASSA-N 0 1 320.436 4.082 20 0 DIADMN Cc1cnc(CN(C)C[C@H]2CCCO[C@H]2c2ccccc2)s1 ZINC000678514841 1046650123 /nfs/dbraw/zinc/65/01/23/1046650123.db2.gz MLSAGYOIKXBODH-AEFFLSMTSA-N 0 1 316.470 4.051 20 0 DIADMN C[C@H]1CN(Cc2sc(NC(C)(C)C)nc2Cl)C2(CC2)C1 ZINC001140395011 1046686229 /nfs/dbraw/zinc/68/62/29/1046686229.db2.gz ZCUATRCLDDAVFJ-SNVBAGLBSA-N 0 1 313.898 4.381 20 0 DIADMN COc1ncc(CN(C)[C@@H](C)c2ccc(C)cc2)cc1Cl ZINC000533099814 1046653049 /nfs/dbraw/zinc/65/30/49/1046653049.db2.gz ULRABXVZTXAXSP-ZDUSSCGKSA-N 0 1 304.821 4.245 20 0 DIADMN Cn1c(CN[C@@H]2CCc3ccc(Cl)cc32)nc2ccccc21 ZINC000784061282 1046656985 /nfs/dbraw/zinc/65/69/85/1046656985.db2.gz NOCFUSQWLQVXSD-OAHLLOKOSA-N 0 1 311.816 4.004 20 0 DIADMN O=C(Nc1ccc(-c2nc3ccc(F)cc3[nH]2)cc1)[C@@H]1CC12CC2 ZINC000643304932 1046658178 /nfs/dbraw/zinc/65/81/78/1046658178.db2.gz KAKFTXMITDGZAV-AWEZNQCLSA-N 0 1 321.355 4.108 20 0 DIADMN Oc1cccc2c1CCC[C@@H]2N[C@@H]1CSCc2ccccc21 ZINC000643308614 1046658400 /nfs/dbraw/zinc/65/84/00/1046658400.db2.gz WOTWZBVNABFHMP-ZWKOTPCHSA-N 0 1 311.450 4.347 20 0 DIADMN Cc1ccc2nc(CNC(=O)Nc3ccc(C4CC4)cc3)[nH]c2c1 ZINC000678563987 1046659008 /nfs/dbraw/zinc/65/90/08/1046659008.db2.gz RSPNABKCTXUDSE-UHFFFAOYSA-N 0 1 320.396 4.070 20 0 DIADMN COc1ccc(C)cc1CN[C@H]1CCCOc2cc(C)ccc21 ZINC000678581486 1046660959 /nfs/dbraw/zinc/66/09/59/1046660959.db2.gz UFVIZFVGHPAHSO-SFHVURJKSA-N 0 1 311.425 4.316 20 0 DIADMN CC(C)c1nc([C@H](C)N[C@H](C)C[C@@H](O)c2ccco2)cs1 ZINC000249039190 1046661197 /nfs/dbraw/zinc/66/11/97/1046661197.db2.gz URMQLDYJHSOENR-MBNYWOFBSA-N 0 1 308.447 4.022 20 0 DIADMN CC(C)c1nc([C@@H](C)N[C@H](C)C[C@@H](O)c2ccco2)cs1 ZINC000249039191 1046661216 /nfs/dbraw/zinc/66/12/16/1046661216.db2.gz URMQLDYJHSOENR-YRGRVCCFSA-N 0 1 308.447 4.022 20 0 DIADMN COc1ccccc1CN(C)Cc1cccc(-c2nccs2)c1 ZINC001140335282 1046663149 /nfs/dbraw/zinc/66/31/49/1046663149.db2.gz VTMAXELRIDNHRG-UHFFFAOYSA-N 0 1 324.449 4.451 20 0 DIADMN Cc1ccc([C@H](C)N[C@@H]2CCOc3ccc(F)cc32)c(C)n1 ZINC000678584125 1046663327 /nfs/dbraw/zinc/66/33/27/1046663327.db2.gz LFCFRAWGKJIHNX-SUMWQHHRSA-N 0 1 300.377 4.012 20 0 DIADMN CC(C)N(CC(=O)c1ccccc1)Cc1c[nH]c2ccc(F)cc12 ZINC001137341424 1046664229 /nfs/dbraw/zinc/66/42/29/1046664229.db2.gz MNJYKXHBVADSKL-UHFFFAOYSA-N 0 1 324.399 4.400 20 0 DIADMN CCCCCOc1ccc([C@H](C)NCc2cnn(CC)c2)cc1 ZINC000678589023 1046664885 /nfs/dbraw/zinc/66/48/85/1046664885.db2.gz GVDKNZCLTZCJTF-INIZCTEOSA-N 0 1 315.461 4.323 20 0 DIADMN CCCCN(CC)Cc1sc(N2CCCC2)nc1Cl ZINC001140361024 1046671600 /nfs/dbraw/zinc/67/16/00/1046671600.db2.gz WGVNAOPTJJFYFQ-UHFFFAOYSA-N 0 1 301.887 4.019 20 0 DIADMN Cc1noc(C)c1CN(C)CCSc1ccc(C)c(C)c1 ZINC000079879368 1046671776 /nfs/dbraw/zinc/67/17/76/1046671776.db2.gz URSTXMRWUZCLKF-UHFFFAOYSA-N 0 1 304.459 4.132 20 0 DIADMN Fc1cccc2oc(NCc3nc4ccc(Cl)cc4[nH]3)nc21 ZINC000784190067 1046671782 /nfs/dbraw/zinc/67/17/82/1046671782.db2.gz WSBBUDUJPJCDGJ-UHFFFAOYSA-N 0 1 316.723 4.109 20 0 DIADMN Clc1ccc2c(c1Cl)CC[C@H]2N[C@H]1CCCc2c[nH]nc21 ZINC000678599136 1046672092 /nfs/dbraw/zinc/67/20/92/1046672092.db2.gz UPRMYAWISKYWGC-KGLIPLIRSA-N 0 1 322.239 4.371 20 0 DIADMN C[C@H](c1ccccc1)N(C(=O)c1ccc(Cl)c(O)c1)C1CC1 ZINC001140364708 1046674269 /nfs/dbraw/zinc/67/42/69/1046674269.db2.gz VKSDARDWLQJNTH-GFCCVEGCSA-N 0 1 315.800 4.411 20 0 DIADMN CCCN(Cc1sc(N2CCCC2)nc1Cl)CC1CC1 ZINC001140362527 1046674501 /nfs/dbraw/zinc/67/45/01/1046674501.db2.gz PFACFNPJAOMOSO-UHFFFAOYSA-N 0 1 313.898 4.019 20 0 DIADMN Cc1nc([C@H](C)NCCOc2ccccc2Cl)c(C)s1 ZINC000678604120 1046675730 /nfs/dbraw/zinc/67/57/30/1046675730.db2.gz BMGDVUCZOCOIBB-JTQLQIEISA-N 0 1 310.850 4.143 20 0 DIADMN Cc1ccc([C@H]2CCCN2Cc2c[nH]c3ccc(F)cc23)cn1 ZINC001137341149 1046677495 /nfs/dbraw/zinc/67/74/95/1046677495.db2.gz ABVGXUARBXAZCG-LJQANCHMSA-N 0 1 309.388 4.348 20 0 DIADMN CCCCn1cc(CNc2ccnc3cc(F)ccc32)c(C)n1 ZINC000678613485 1046679981 /nfs/dbraw/zinc/67/99/81/1046679981.db2.gz HMGWEOVQTLVEEF-UHFFFAOYSA-N 0 1 312.392 4.291 20 0 DIADMN COc1ccc([C@H](CCC(C)C)N[C@@H]2CCn3ccnc32)cc1 ZINC000834836411 1046680397 /nfs/dbraw/zinc/68/03/97/1046680397.db2.gz NBTRMIXUQSBSRK-ZWKOTPCHSA-N 0 1 313.445 4.104 20 0 DIADMN Fc1cnc(Cl)c(CN[C@H]2CCCCc3ccccc32)c1 ZINC000834840308 1046682122 /nfs/dbraw/zinc/68/21/22/1046682122.db2.gz IXBABRGPCPYYFO-INIZCTEOSA-N 0 1 304.796 4.431 20 0 DIADMN COc1cccc([C@@H]2C[C@@H](C)CN2Cc2cccc(Cl)n2)c1 ZINC000784347199 1046682547 /nfs/dbraw/zinc/68/25/47/1046682547.db2.gz AWJCZYVDALKLLJ-DYVFJYSZSA-N 0 1 316.832 4.327 20 0 DIADMN Clc1ccc2c(c1)[C@@H](N[C@@H]1CCn3ccnc31)CCCC2 ZINC000834837803 1046683022 /nfs/dbraw/zinc/68/30/22/1046683022.db2.gz ZCHYELVKHPUEPI-JKSUJKDBSA-N 0 1 301.821 4.039 20 0 DIADMN COc1cccc(-c2nc(CN(C)CC(C)(C)C)cs2)c1 ZINC000533279035 1046683232 /nfs/dbraw/zinc/68/32/32/1046683232.db2.gz VIGMZBXNPRHPDI-UHFFFAOYSA-N 0 1 304.459 4.297 20 0 DIADMN COc1cccc([C@@H]2C[C@H](C)CN2Cc2ccc(Cl)nc2)c1 ZINC000784357161 1046684746 /nfs/dbraw/zinc/68/47/46/1046684746.db2.gz UAZAOQJANCIPTF-GUYCJALGSA-N 0 1 316.832 4.327 20 0 DIADMN C[C@@H]1CCc2ccccc2[C@@H]1NCc1cc(F)cnc1Cl ZINC000834840864 1046685011 /nfs/dbraw/zinc/68/50/11/1046685011.db2.gz NAVYRRVYLMTELE-BDJLRTHQSA-N 0 1 304.796 4.287 20 0 DIADMN COc1cccc([C@@H]2C[C@H](C)CN2Cc2cccnc2Cl)c1 ZINC000784354387 1046685594 /nfs/dbraw/zinc/68/55/94/1046685594.db2.gz NHYYRVJARDJWED-GUYCJALGSA-N 0 1 316.832 4.327 20 0 DIADMN CC[C@@H](C)CN(C)CC(=O)Nc1ccccc1Cc1ccccc1 ZINC000533286597 1046687875 /nfs/dbraw/zinc/68/78/75/1046687875.db2.gz KBDSDNNYYSKJJZ-QGZVFWFLSA-N 0 1 324.468 4.194 20 0 DIADMN Cc1cc(CN[C@H](c2ccc(Cl)c(Cl)c2)C2CC2)[nH]n1 ZINC000678689836 1046689039 /nfs/dbraw/zinc/68/90/39/1046689039.db2.gz MXQSCUDYILAJHR-HNNXBMFYSA-N 0 1 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Cc1ccc(-n2[nH]c(-c3ccc(Cl)cc3)cc2=O)cc1Cl ZINC001115861659 1047088690 /nfs/dbraw/zinc/08/86/90/1047088690.db2.gz JUBRLCHCZRWNNB-UHFFFAOYSA-N 0 1 319.191 4.443 20 0 DIADMN Cc1nn(C(C)(C)C)cc1[C@@H](C)N[C@@H](C)c1ccc(C)nc1C ZINC000681055796 1047088868 /nfs/dbraw/zinc/08/88/68/1047088868.db2.gz FTIUIFVDKYECJC-LSDHHAIUSA-N 0 1 314.477 4.370 20 0 DIADMN CCc1[nH]ncc1C(=O)Nc1ccc(S[C@@H](C)CC)cc1C ZINC000648757284 1047088889 /nfs/dbraw/zinc/08/88/89/1047088889.db2.gz ICNVKZCTRSGBBA-LBPRGKRZSA-N 0 1 317.458 4.423 20 0 DIADMN C[C@H]1c2cc(Cl)c(Cl)cc2CCN1CCCCCO ZINC000536742333 1047090487 /nfs/dbraw/zinc/09/04/87/1047090487.db2.gz FVUQICJLIDLHSG-NSHDSACASA-N 0 1 302.245 4.075 20 0 DIADMN Cc1nn(C)cc1[C@@H]1CCCN1Cc1ccc(Cl)cc1C ZINC000681081359 1047091717 /nfs/dbraw/zinc/09/17/17/1047091717.db2.gz BBTVIFNWZLDOPY-KRWDZBQOSA-N 0 1 303.837 4.027 20 0 DIADMN CCCc1[nH]ncc1C(=O)Nc1ccc2c(c1)Cc1ccccc1-2 ZINC001115910574 1047091860 /nfs/dbraw/zinc/09/18/60/1047091860.db2.gz OKIHCJVGMOSYAC-UHFFFAOYSA-N 0 1 317.392 4.186 20 0 DIADMN CCCCOc1ccccc1CN1CCC[C@@H](OC(F)F)C1 ZINC000681082663 1047093028 /nfs/dbraw/zinc/09/30/28/1047093028.db2.gz NPQYYQQOBJFHBE-OAHLLOKOSA-N 0 1 313.388 4.069 20 0 DIADMN Cc1cccc(NCc2[nH]nc3ccccc32)c1Br ZINC000681094554 1047093453 /nfs/dbraw/zinc/09/34/53/1047093453.db2.gz HXQMXSNOCXFRGN-UHFFFAOYSA-N 0 1 316.202 4.246 20 0 DIADMN Fc1cccc(-n2ccc(CN3CC[C@H]4CCCC[C@@H]4C3)n2)c1 ZINC001115944880 1047095068 /nfs/dbraw/zinc/09/50/68/1047095068.db2.gz JDCLEFIRDDOZOK-HZPDHXFCSA-N 0 1 313.420 4.024 20 0 DIADMN COc1cc(Cl)ncc1CN1CCC[C@H](c2ccccc2)C1 ZINC001141340942 1047098377 /nfs/dbraw/zinc/09/83/77/1047098377.db2.gz MLRFFHOUZAKIDI-HNNXBMFYSA-N 0 1 316.832 4.123 20 0 DIADMN CC(C)[C@@H]1CCN(C(=O)Nc2ccc3nc(C(F)F)[nH]c3c2)C1 ZINC000536769209 1047098969 /nfs/dbraw/zinc/09/89/69/1047098969.db2.gz WQFADBYXQMOMPT-SNVBAGLBSA-N 0 1 322.359 4.010 20 0 DIADMN Cc1n[nH]c(C(C)C)c1C(=O)Nc1ccc(C)c(C)c1Cl ZINC000648967389 1047101202 /nfs/dbraw/zinc/10/12/02/1047101202.db2.gz YRBDBZUEBGCPGU-UHFFFAOYSA-N 0 1 305.809 4.364 20 0 DIADMN Cc1ccc(C)c2c1CCC[C@H]2Nc1cnn(-c2ccncc2)c1 ZINC000681138039 1047101782 /nfs/dbraw/zinc/10/17/82/1047101782.db2.gz CKRVZIUJJDPNCX-LJQANCHMSA-N 0 1 318.424 4.374 20 0 DIADMN CCc1ccc([C@H](CO)N[C@@H](C)c2cccc(Cl)c2)cc1 ZINC000536829019 1047103531 /nfs/dbraw/zinc/10/35/31/1047103531.db2.gz VFSXZBHSMFFHPD-UGSOOPFHSA-N 0 1 303.833 4.287 20 0 DIADMN C[N@H+](Cc1ccc(-c2cccc(C(=O)[O-])c2)cc1)CC1CCC1 ZINC001141357504 1047103978 /nfs/dbraw/zinc/10/39/78/1047103978.db2.gz SNYSQKMWJJLZJI-UHFFFAOYSA-N 0 1 309.409 4.284 20 0 DIADMN O=C([O-])c1cccc(-c2ccc(C[N@H+]3CC4CCC3CC4)cc2)c1 ZINC001141359801 1047105359 /nfs/dbraw/zinc/10/53/59/1047105359.db2.gz GFZNZTWYQRWACS-UHFFFAOYSA-N 0 1 321.420 4.426 20 0 DIADMN C[C@@H](N[C@@H](c1cccnc1)C1CC1)c1ccccc1OC(F)F ZINC000536834492 1047105915 /nfs/dbraw/zinc/10/59/15/1047105915.db2.gz SKONXXKMDRQWRH-SJKOYZFVSA-N 0 1 318.367 4.485 20 0 DIADMN Cc1cc2cc([C@@H](C)NC[C@@](C)(O)C(F)(F)F)oc2cc1C ZINC000536836598 1047106945 /nfs/dbraw/zinc/10/69/45/1047106945.db2.gz BHAVQUHBWOAVSL-IAQYHMDHSA-N 0 1 315.335 4.014 20 0 DIADMN CC[C@@H](N[C@@H]1COc2ccc(C)cc21)c1cc(C)ccc1OC ZINC000536843006 1047110399 /nfs/dbraw/zinc/11/03/99/1047110399.db2.gz BTPDGVBHFCSJPT-QZTJIDSGSA-N 0 1 311.425 4.486 20 0 DIADMN CC(C)c1cc(C(=O)N2CC3(CC=CC3)[C@@H]2c2ccccc2)n[nH]1 ZINC000649156816 1047113698 /nfs/dbraw/zinc/11/36/98/1047113698.db2.gz JGACABPZBJEXSY-SFHVURJKSA-N 0 1 321.424 4.067 20 0 DIADMN F[C@@H]1CSC2(CN(Cc3cccc(-c4ccsc4)c3)C2)C1 ZINC001141386301 1047114026 /nfs/dbraw/zinc/11/40/26/1047114026.db2.gz CVEHHXOQQYAHDT-INIZCTEOSA-N 0 1 319.470 4.445 20 0 DIADMN CN(Cc1ccc(Cl)cc1Cl)CC1CCC(=O)CC1 ZINC000649225011 1047116978 /nfs/dbraw/zinc/11/69/78/1047116978.db2.gz QWVRNTNOVQXUMH-UHFFFAOYSA-N 0 1 300.229 4.185 20 0 DIADMN CC[C@H](CSC)N(C)Cc1ncc(-c2ccccc2C)o1 ZINC000536886734 1047120005 /nfs/dbraw/zinc/12/00/05/1047120005.db2.gz WQGGVFSJGWNLIN-CQSZACIVSA-N 0 1 304.459 4.223 20 0 DIADMN CC(=O)c1cccc(CN2CCS[C@@H](c3ccccc3)C2)c1 ZINC000649317013 1047121000 /nfs/dbraw/zinc/12/10/00/1047121000.db2.gz RVBBMVPXICITSK-LJQANCHMSA-N 0 1 311.450 4.179 20 0 DIADMN Cc1nn(C)cc1[C@@H]1CCCN1Cc1c(C)cccc1Cl ZINC000649350710 1047121546 /nfs/dbraw/zinc/12/15/46/1047121546.db2.gz BQNUKZDUQLDZBE-KRWDZBQOSA-N 0 1 303.837 4.027 20 0 DIADMN Cc1ccc(C(=O)CCN2C[C@@H](C(F)(F)F)CC[C@@H]2C)cc1 ZINC000681409501 1047122134 /nfs/dbraw/zinc/12/21/34/1047122134.db2.gz AKMIHPKTYNWESU-ZFWWWQNUSA-N 0 1 313.363 4.231 20 0 DIADMN CC(C(=O)N1CCC[C@@H](c2nc3ccc(C)cc3[nH]2)C1)=C1CCC1 ZINC000827561991 1047122183 /nfs/dbraw/zinc/12/21/83/1047122183.db2.gz GFJTZWZZYWBWTJ-MRXNPFEDSA-N 0 1 323.440 4.078 20 0 DIADMN CCCCC[C@@H](C(=O)NC[C@H](c1ccsc1)N(C)C)C(C)C ZINC001141413775 1047122448 /nfs/dbraw/zinc/12/24/48/1047122448.db2.gz HVOPMBZHZZNNSD-IAGOWNOFSA-N 0 1 324.534 4.320 20 0 DIADMN CCCCC[C@H](C(=O)NC[C@@H](c1ccsc1)N(C)C)C(C)C ZINC001141413776 1047122651 /nfs/dbraw/zinc/12/26/51/1047122651.db2.gz HVOPMBZHZZNNSD-IRXDYDNUSA-N 0 1 324.534 4.320 20 0 DIADMN CCC(=O)c1ccc(O)c(NC(=O)[C@H](C)CCC(C)(C)C)c1 ZINC001141416539 1047124318 /nfs/dbraw/zinc/12/43/18/1047124318.db2.gz LESXMWOPLNWSPY-GFCCVEGCSA-N 0 1 305.418 4.386 20 0 DIADMN CCC(=O)c1ccc(O)c(NC(=O)C/C=C/Cc2ccccc2)c1 ZINC001141416361 1047124350 /nfs/dbraw/zinc/12/43/50/1047124350.db2.gz CPHHKKHYSWJZPF-VOTSOKGWSA-N 0 1 323.392 4.112 20 0 DIADMN CCOc1ncccc1CN[C@H](c1ccc(F)c(C)c1)C1CC1 ZINC000536962211 1047126290 /nfs/dbraw/zinc/12/62/90/1047126290.db2.gz FRNOMALOVKGSKO-SFHVURJKSA-N 0 1 314.404 4.169 20 0 DIADMN CCC[N@H+](Cc1n[nH]c2ccccc21)[C@H]1CCCc2cccnc21 ZINC000681496372 1047127531 /nfs/dbraw/zinc/12/75/31/1047127531.db2.gz MGSHCSYWQJFFFF-IBGZPJMESA-N 0 1 320.440 4.248 20 0 DIADMN CCC[N@@H+](Cc1n[nH]c2ccccc21)[C@H]1CCCc2cccnc21 ZINC000681496372 1047127536 /nfs/dbraw/zinc/12/75/36/1047127536.db2.gz MGSHCSYWQJFFFF-IBGZPJMESA-N 0 1 320.440 4.248 20 0 DIADMN Cc1cc(CNc2cccc(CO[C@@H]3CCC[C@@H](C)C3)c2)n[nH]1 ZINC001116317776 1047129753 /nfs/dbraw/zinc/12/97/53/1047129753.db2.gz FKDYURRHGSTINR-AUUYWEPGSA-N 0 1 313.445 4.426 20 0 DIADMN Cc1nc(C(F)(F)F)ccc1CN1CCC[C@H]1c1ccccn1 ZINC001141430810 1047129915 /nfs/dbraw/zinc/12/99/15/1047129915.db2.gz NXSPUWKRCPNSKQ-HNNXBMFYSA-N 0 1 321.346 4.141 20 0 DIADMN Cc1cncc(CC[N@H+](C)[C@H](C)c2ccc(Cl)cc2Cl)n1 ZINC000649478827 1047135966 /nfs/dbraw/zinc/13/59/66/1047135966.db2.gz RZIRDPBWPVJIJH-GFCCVEGCSA-N 0 1 324.255 4.327 20 0 DIADMN Cc1cncc(CCN(C)[C@H](C)c2ccc(Cl)cc2Cl)n1 ZINC000649478827 1047135971 /nfs/dbraw/zinc/13/59/71/1047135971.db2.gz RZIRDPBWPVJIJH-GFCCVEGCSA-N 0 1 324.255 4.327 20 0 DIADMN Cc1ncc([C@H](C)N(C)Cc2ccc(C(F)(F)F)cc2)c(C)n1 ZINC000681639865 1047136067 /nfs/dbraw/zinc/13/60/67/1047136067.db2.gz HOHOYUSFRXIJDU-LBPRGKRZSA-N 0 1 323.362 4.305 20 0 DIADMN CC(C)[C@@H](NCC(=O)N1CCCCCC1)c1ccccc1Cl ZINC000537086318 1047136421 /nfs/dbraw/zinc/13/64/21/1047136421.db2.gz MDEBGRRIVVDLKP-GOSISDBHSA-N 0 1 322.880 4.029 20 0 DIADMN COc1cc(CNC(C)(c2ccccc2)c2ccccc2)ccn1 ZINC000537103757 1047136776 /nfs/dbraw/zinc/13/67/76/1047136776.db2.gz OYWIZFNPDRNLEM-UHFFFAOYSA-N 0 1 318.420 4.144 20 0 DIADMN Cc1cncc(CCN([C@H](C)c2ccccc2Cl)C2CC2)n1 ZINC000649506400 1047139484 /nfs/dbraw/zinc/13/94/84/1047139484.db2.gz MRLVJIYXKWMGGT-CQSZACIVSA-N 0 1 315.848 4.207 20 0 DIADMN COc1cc(CN2CCCCC[C@@H]2c2ccncc2)ccc1F ZINC001116438881 1047140728 /nfs/dbraw/zinc/14/07/28/1047140728.db2.gz UETLMWMZRTWWRF-GOSISDBHSA-N 0 1 314.404 4.347 20 0 DIADMN CC(C)c1ccc2c(c1)[C@H](NCc1cn3cccc(F)c3n1)CC2 ZINC000681701148 1047141371 /nfs/dbraw/zinc/14/13/71/1047141371.db2.gz NKGIBMNGDMJJMR-LJQANCHMSA-N 0 1 323.415 4.374 20 0 DIADMN CC[C@@H]1c2ccccc2CCN1Cc1cnc(C(F)(F)F)nc1 ZINC001141464601 1047141613 /nfs/dbraw/zinc/14/16/13/1047141613.db2.gz CHHGPMSTWGPHNV-OAHLLOKOSA-N 0 1 321.346 4.005 20 0 DIADMN Cc1ccc(CN2CCC(Nc3ccccc3Cl)CC2)o1 ZINC001116443084 1047141990 /nfs/dbraw/zinc/14/19/90/1047141990.db2.gz FGYHTTNINXSJKE-UHFFFAOYSA-N 0 1 304.821 4.318 20 0 DIADMN Cc1cc(CN(Cc2ccc(Cl)c(Cl)c2)C(C)C)n[nH]1 ZINC001116442402 1047142408 /nfs/dbraw/zinc/14/24/08/1047142408.db2.gz UZQVBLFKFJDUQG-UHFFFAOYSA-N 0 1 312.244 4.436 20 0 DIADMN CC(C)Oc1ccnc(CN[C@@H](c2ccccc2)C2CCC2)c1 ZINC000649559048 1047143646 /nfs/dbraw/zinc/14/36/46/1047143646.db2.gz NCLMNHXUUFWLBY-FQEVSTJZSA-N 0 1 310.441 4.500 20 0 DIADMN CCN(Cc1nc2c(s1)CCC2)[C@@H](C)Cc1ccsc1 ZINC000681755390 1047144857 /nfs/dbraw/zinc/14/48/57/1047144857.db2.gz SSINUXVXBSIYJO-LBPRGKRZSA-N 0 1 306.500 4.146 20 0 DIADMN Cc1ccc2nc(NC(=O)c3cc4c(cc(C)cc4C)[nH]3)[nH]c2c1 ZINC001141480153 1047144709 /nfs/dbraw/zinc/14/47/09/1047144709.db2.gz YXZCXLQFCDBRRB-UHFFFAOYSA-N 0 1 318.380 4.222 20 0 DIADMN CC(=CC(=O)Nc1nc2ccc(C)cc2[nH]1)c1ccccc1C ZINC001141479290 1047145211 /nfs/dbraw/zinc/14/52/11/1047145211.db2.gz HKTIKQDCNDXEAB-SDNWHVSQSA-N 0 1 305.381 4.222 20 0 DIADMN CC(=CC(=O)Nc1nc2ccc(C)cc2[nH]1)c1ccccc1C ZINC001141479289 1047145438 /nfs/dbraw/zinc/14/54/38/1047145438.db2.gz HKTIKQDCNDXEAB-KAMYIIQDSA-N 0 1 305.381 4.222 20 0 DIADMN CCCCNc1ccccc1C(=O)Nc1nc2ccc(C)cc2[nH]1 ZINC001141479324 1047145914 /nfs/dbraw/zinc/14/59/14/1047145914.db2.gz IXLZIEUSKDJOGP-UHFFFAOYSA-N 0 1 322.412 4.336 20 0 DIADMN Cc1ccccc1[C@H](NCc1cc2n(n1)CCCC2)C(C)(C)C ZINC000649576350 1047146368 /nfs/dbraw/zinc/14/63/68/1047146368.db2.gz WNASATRYNPKCGA-IBGZPJMESA-N 0 1 311.473 4.405 20 0 DIADMN CC(C)Oc1ccnc(CNC(C)(C)c2cccc(F)c2)c1 ZINC000649575526 1047146807 /nfs/dbraw/zinc/14/68/07/1047146807.db2.gz SCRPSXXCGWAVMW-UHFFFAOYSA-N 0 1 302.393 4.033 20 0 DIADMN CC(C)c1ccc([C@H](NCc2cc3n(n2)CCC3)C(C)C)cc1 ZINC000649573941 1047147013 /nfs/dbraw/zinc/14/70/13/1047147013.db2.gz VREVYKRWXIWNDN-HXUWFJFHSA-N 0 1 311.473 4.440 20 0 DIADMN Cc1nnsc1CN[C@H](c1cccc(F)c1)C1CCCC1 ZINC000649576341 1047147126 /nfs/dbraw/zinc/14/71/26/1047147126.db2.gz VTXLTJSRGDFANK-INIZCTEOSA-N 0 1 305.422 4.007 20 0 DIADMN Clc1ccc([C@@H](NCc2cc3n(n2)CCC3)C2CCC2)cc1 ZINC000649575278 1047147406 /nfs/dbraw/zinc/14/74/06/1047147406.db2.gz 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310.422 4.082 20 0 DIADMN Cc1cccc(OCCN[C@H](C)c2nc3ccccc3s2)c1 ZINC000386992962 1047279705 /nfs/dbraw/zinc/27/97/05/1047279705.db2.gz GBTLAVHMJLNDOL-CQSZACIVSA-N 0 1 312.438 4.334 20 0 DIADMN CCCSC[C@@H](C)N[C@H](CO)c1cccc(Cl)c1Cl ZINC001462451976 1047280590 /nfs/dbraw/zinc/28/05/90/1047280590.db2.gz MJKGVSNWVMCWAX-ZWNOBZJWSA-N 0 1 322.301 4.148 20 0 DIADMN CC[C@@H](C(=O)[O-])[N@@H+](C)CCCCc1ccc(Cl)c(Cl)c1 ZINC000650805594 1047282017 /nfs/dbraw/zinc/28/20/17/1047282017.db2.gz FDCAODCSAVIPAD-AWEZNQCLSA-N 0 1 318.244 4.111 20 0 DIADMN CC[C@@H](C(=O)[O-])[N@@H+](C)Cc1ccc(-c2cccc(Cl)c2)s1 ZINC000650807606 1047282190 /nfs/dbraw/zinc/28/21/90/1047282190.db2.gz CKBWNWNFMLGMCF-AWEZNQCLSA-N 0 1 323.845 4.364 20 0 DIADMN C[C@@H](CC[N@H+]1CCC[C@H](C(C)(C)C(=O)[O-])C1)c1ccccc1 ZINC000387952097 1047284845 /nfs/dbraw/zinc/28/48/45/1047284845.db2.gz YOSVBVCFASVVMD-RDJZCZTQSA-N 0 1 303.446 4.003 20 0 DIADMN CC(C)(C)Oc1cccc(NCc2ccnn2-c2ccncc2)c1 ZINC000897753048 1047284856 /nfs/dbraw/zinc/28/48/56/1047284856.db2.gz FTPBKHLYTFMNDO-UHFFFAOYSA-N 0 1 322.412 4.057 20 0 DIADMN C[C@@H](N[C@@H]1CCc2cccnc21)c1cccc(OC(F)F)c1 ZINC000389257731 1047290159 /nfs/dbraw/zinc/29/01/59/1047290159.db2.gz HPYRZIDQEPEKOM-IAQYHMDHSA-N 0 1 304.340 4.021 20 0 DIADMN Cc1ccc(-c2n[nH]c(NC(=O)[C@@H]3CC[C@H](C)[C@H](C)C3)c2C)o1 ZINC001141831701 1047295583 /nfs/dbraw/zinc/29/55/83/1047295583.db2.gz UUKDDRWTZWYUAO-MISXGVKJSA-N 0 1 315.417 4.297 20 0 DIADMN C[C@@H](NCc1ccc(C(=O)OC(C)(C)C)s1)c1cncs1 ZINC000897931035 1047298262 /nfs/dbraw/zinc/29/82/62/1047298262.db2.gz UYAVYHDRLROEPS-SNVBAGLBSA-N 0 1 324.471 4.011 20 0 DIADMN CC[C@H](OCCSc1n[nH]c(C(C)(C)C)n1)c1ccccc1 ZINC000651186880 1047299064 /nfs/dbraw/zinc/29/90/64/1047299064.db2.gz KDIYLQPVISAVOU-AWEZNQCLSA-N 0 1 319.474 4.362 20 0 DIADMN CC[C@H](OCCSc1nc(C(C)(C)C)n[nH]1)c1ccccc1 ZINC000651186880 1047299055 /nfs/dbraw/zinc/29/90/55/1047299055.db2.gz KDIYLQPVISAVOU-AWEZNQCLSA-N 0 1 319.474 4.362 20 0 DIADMN CCCOc1ccc(CN[C@@H](C)c2cncs2)cc1OCC ZINC000897934396 1047300640 /nfs/dbraw/zinc/30/06/40/1047300640.db2.gz ISBXFRWPSFCXOH-ZDUSSCGKSA-N 0 1 320.458 4.181 20 0 DIADMN COc1ccc(CN[C@@H](C)c2cncs2)cc1OCC(C)C ZINC000897934855 1047301688 /nfs/dbraw/zinc/30/16/88/1047301688.db2.gz QKKQZLQVUDOVHK-ZDUSSCGKSA-N 0 1 320.458 4.037 20 0 DIADMN COc1ccc(F)cc1[C@H](C)NCc1cccc2c1NCCC2 ZINC000390844895 1047301778 /nfs/dbraw/zinc/30/17/78/1047301778.db2.gz CVQITAKFZPEIHI-ZDUSSCGKSA-N 0 1 314.404 4.043 20 0 DIADMN c1coc([C@@H]2N(Cc3ccc4c(c3)CCC4)CC23CCOCC3)c1 ZINC001118568420 1047302884 /nfs/dbraw/zinc/30/28/84/1047302884.db2.gz STEVSDNBDLCWNZ-FQEVSTJZSA-N 0 1 323.436 4.122 20 0 DIADMN Cc1ccc(-c2ncc(CN[C@@H](C)c3cncs3)s2)cc1 ZINC000897935651 1047303480 /nfs/dbraw/zinc/30/34/80/1047303480.db2.gz XVYNXKHZTBQMCV-LBPRGKRZSA-N 0 1 315.467 4.426 20 0 DIADMN CC[C@@H](N[C@@H](Cn1cccn1)c1ccccc1)c1ccsc1 ZINC000651236261 1047304048 /nfs/dbraw/zinc/30/40/48/1047304048.db2.gz VJGBHHHPTNTADI-MSOLQXFVSA-N 0 1 311.454 4.427 20 0 DIADMN CC/C(=C\C(=O)Nc1ccc(F)c(F)c1O)c1ccc(C)cc1 ZINC001141879960 1047304012 /nfs/dbraw/zinc/30/40/12/1047304012.db2.gz LFGWJWFUJFQDAA-ZRDIBKRKSA-N 0 1 317.335 4.411 20 0 DIADMN CC[C@@H](C)Oc1cc(C)ccc1CNCc1cncn1C(C)C ZINC000424161429 1047304352 /nfs/dbraw/zinc/30/43/52/1047304352.db2.gz YJWHUYOWXXWQMR-MRXNPFEDSA-N 0 1 315.461 4.240 20 0 DIADMN Cc1cc2cc(C(=O)Nc3ccc(F)c(F)c3O)oc2cc1C ZINC001141879513 1047304366 /nfs/dbraw/zinc/30/43/66/1047304366.db2.gz CLTMRGHVCKJCFY-UHFFFAOYSA-N 0 1 317.291 4.286 20 0 DIADMN c1sc(COc2ccccc2)nc1CN[C@@H]1C[C@@H]2CCC[C@H]12 ZINC000897952457 1047304641 /nfs/dbraw/zinc/30/46/41/1047304641.db2.gz GKHHPRFXCWNOHY-RRQGHBQHSA-N 0 1 314.454 4.000 20 0 DIADMN CC[C@@H](NCc1cnc(C(C)(C)C)nc1)c1ccccc1OC ZINC000392112721 1047304970 /nfs/dbraw/zinc/30/49/70/1047304970.db2.gz OMQQDHPFVGDSRE-MRXNPFEDSA-N 0 1 313.445 4.024 20 0 DIADMN c1sc(COc2ccccc2)nc1CN[C@@H]1C[C@@H]2CCC[C@@H]12 ZINC000897952455 1047305630 /nfs/dbraw/zinc/30/56/30/1047305630.db2.gz GKHHPRFXCWNOHY-IAOVAPTHSA-N 0 1 314.454 4.000 20 0 DIADMN Cc1cccnc1[C@@H](NCc1ccc(-c2cc[nH]n2)o1)C(C)(C)C ZINC000897994669 1047306461 /nfs/dbraw/zinc/30/64/61/1047306461.db2.gz IMNHWIBCJYNAJB-GOSISDBHSA-N 0 1 324.428 4.250 20 0 DIADMN CC[C@@H](N[C@H]1CCOc2c(OC)cccc21)c1ccsc1 ZINC000651262283 1047306869 /nfs/dbraw/zinc/30/68/69/1047306869.db2.gz HGBUQRHADDNMRT-CABCVRRESA-N 0 1 303.427 4.321 20 0 DIADMN Cc1ncc([C@H](C)N[C@@H](c2ncccc2C)C(C)(C)C)c(C)n1 ZINC000897994730 1047307460 /nfs/dbraw/zinc/30/74/60/1047307460.db2.gz RYMIZZWWVLLFLW-KSSFIOAISA-N 0 1 312.461 4.235 20 0 DIADMN COc1ccc(CN[C@H](c2ncccc2C)C(C)(C)C)c(F)c1 ZINC000897994651 1047307634 /nfs/dbraw/zinc/30/76/34/1047307634.db2.gz IDKSOVAGERIFNB-GOSISDBHSA-N 0 1 316.420 4.415 20 0 DIADMN CCOc1cncc(CN[C@@H](c2ncccc2C)C(C)(C)C)c1 ZINC000897994160 1047308071 /nfs/dbraw/zinc/30/80/71/1047308071.db2.gz NHLYWFKLGPKQAO-SFHVURJKSA-N 0 1 313.445 4.061 20 0 DIADMN COc1cc(F)cc(CN[C@@H](c2ncccc2C)C(C)(C)C)c1 ZINC000897995907 1047308791 /nfs/dbraw/zinc/30/87/91/1047308791.db2.gz UDGFHIAYJTXNEY-SFHVURJKSA-N 0 1 316.420 4.415 20 0 DIADMN Cc1cccnc1[C@H](NCc1cnn(C(C)C)c1)C(C)(C)C ZINC000897998641 1047309551 /nfs/dbraw/zinc/30/95/51/1047309551.db2.gz WGJSDNLIVRZYPO-KRWDZBQOSA-N 0 1 300.450 4.044 20 0 DIADMN Cc1cccnc1[C@H](NCc1cnc2cccc(C)n12)C(C)(C)C ZINC000897998407 1047310680 /nfs/dbraw/zinc/31/06/80/1047310680.db2.gz TWULFVIDICHDPI-IBGZPJMESA-N 0 1 322.456 4.223 20 0 DIADMN C[C@@H](NCc1ccc(OC(F)F)cc1)c1ccccc1[N+](=O)[O-] ZINC000393445417 1047310984 /nfs/dbraw/zinc/31/09/84/1047310984.db2.gz ABQHVDSTMGAKSN-LLVKDONJSA-N 0 1 322.311 4.047 20 0 DIADMN CCCCC[C@@H](CC)C(=O)NC[C@H](c1ccc(F)cc1)N(C)C ZINC001141922713 1047311701 /nfs/dbraw/zinc/31/17/01/1047311701.db2.gz ZMACOVKZNLZRKH-CRAIPNDOSA-N 0 1 322.468 4.151 20 0 DIADMN Cc1ncc([C@@H](C)N[C@@H]2CCCc3c(F)cc(F)cc32)s1 ZINC000651357667 1047313182 /nfs/dbraw/zinc/31/31/82/1047313182.db2.gz LXQMYNPATJPBOI-RFAUZJTJSA-N 0 1 308.397 4.458 20 0 DIADMN Fc1ccc(CC2CCN(Cc3ccc(Cl)nc3)CC2)cc1 ZINC000725803531 1047316010 /nfs/dbraw/zinc/31/60/10/1047316010.db2.gz CMWXZLYUHCULMX-UHFFFAOYSA-N 0 1 318.823 4.329 20 0 DIADMN COc1cc(CN[C@H]2CCCOc3ccccc32)ccc1Cl ZINC000651467949 1047316465 /nfs/dbraw/zinc/31/64/65/1047316465.db2.gz OERCIDMMGZHTMR-INIZCTEOSA-N 0 1 317.816 4.352 20 0 DIADMN C[C@@H](c1ccc(Cl)cc1)N(C)Cc1cccc2c1OCO2 ZINC001141958528 1047316765 /nfs/dbraw/zinc/31/67/65/1047316765.db2.gz JZOJQYGHQDQXKD-LBPRGKRZSA-N 0 1 303.789 4.262 20 0 DIADMN c1ccc(CN(Cc2cccc3c2OCO3)C2CCCCC2)nc1 ZINC001141958737 1047317664 /nfs/dbraw/zinc/31/76/64/1047317664.db2.gz WQYAIISZUGARSG-UHFFFAOYSA-N 0 1 324.424 4.145 20 0 DIADMN C[C@H]1CCCCN(Cc2ncc(C(F)(F)F)cc2Cl)C1 ZINC001142534225 1047318863 /nfs/dbraw/zinc/31/88/63/1047318863.db2.gz AMFFLZVBQBWOHR-JTQLQIEISA-N 0 1 306.759 4.376 20 0 DIADMN C[C@@H](N[C@H](C)c1csc2ccccc12)c1cc2n(n1)CCC2 ZINC000840721210 1047320416 /nfs/dbraw/zinc/32/04/16/1047320416.db2.gz BNKSYRFUHSOLCH-CHWSQXEVSA-N 0 1 311.454 4.456 20 0 DIADMN CCOc1ccccc1[C@H](CC)NCc1cc2cnccc2o1 ZINC000651694050 1047322567 /nfs/dbraw/zinc/32/25/67/1047322567.db2.gz OGMWMMKHJPZFBX-KRWDZBQOSA-N 0 1 310.397 4.467 20 0 DIADMN Cc1nn(-c2cccc(C)c2)cc1CNCc1cccc(C)c1 ZINC000651671526 1047322818 /nfs/dbraw/zinc/32/28/18/1047322818.db2.gz VIDQSLQPWYPHDJ-UHFFFAOYSA-N 0 1 305.425 4.087 20 0 DIADMN CC(C)Oc1ccccc1[C@H](C)NCc1cc2cnccc2o1 ZINC000651680049 1047323048 /nfs/dbraw/zinc/32/30/48/1047323048.db2.gz VGCBAVQAHMRXRP-AWEZNQCLSA-N 0 1 310.397 4.466 20 0 DIADMN O=C([O-])[C@@H]1C[N@@H+](CCCC2CCCCC2)Cc2ccccc21 ZINC000395177256 1047323924 /nfs/dbraw/zinc/32/39/24/1047323924.db2.gz OAZAVOJHSVTFGS-GOSISDBHSA-N 0 1 301.430 4.031 20 0 DIADMN C[C@@H](N[C@H](C)c1cc2cnccc2o1)c1cnn(CC2CCC2)c1 ZINC000898182415 1047324820 /nfs/dbraw/zinc/32/48/20/1047324820.db2.gz TVRLGEQLJREEEW-ZIAGYGMSSA-N 0 1 324.428 4.236 20 0 DIADMN C[C@@H](NC[C@H]1CC1(Cl)Cl)c1nc(C(C)(C)C)cs1 ZINC001119292836 1047325529 /nfs/dbraw/zinc/32/55/29/1047325529.db2.gz GWBRMVYUSPSKBP-RKDXNWHRSA-N 0 1 307.290 4.285 20 0 DIADMN C[C@@H](NCc1cc(F)cc(Cl)c1)c1cnn(CC2CCC2)c1 ZINC000898180159 1047325583 /nfs/dbraw/zinc/32/55/83/1047325583.db2.gz UMJCCRIXXUMJQG-GFCCVEGCSA-N 0 1 321.827 4.327 20 0 DIADMN Cc1scc(CN[C@@H](C)c2cnn(CC3CCC3)c2)c1C ZINC000898181212 1047325995 /nfs/dbraw/zinc/32/59/95/1047325995.db2.gz COACGLSURZBPDY-ZDUSSCGKSA-N 0 1 303.475 4.212 20 0 DIADMN C[C@@H](N[C@@H](C)c1cc2cnccc2o1)c1cnn(CC2CCC2)c1 ZINC000898182413 1047326391 /nfs/dbraw/zinc/32/63/91/1047326391.db2.gz TVRLGEQLJREEEW-KGLIPLIRSA-N 0 1 324.428 4.236 20 0 DIADMN COc1cc(CN[C@@H](C)c2ccccc2C(F)(F)F)sn1 ZINC000399227295 1047327253 /nfs/dbraw/zinc/32/72/53/1047327253.db2.gz YBCAUMAJNXTSBO-VIFPVBQESA-N 0 1 316.348 4.021 20 0 DIADMN Cc1nn(-c2cccc(C)c2)cc1CN[C@H](C)c1cnccc1C ZINC000651748382 1047326968 /nfs/dbraw/zinc/32/69/68/1047326968.db2.gz JHRBOXGPMKTYIU-QGZVFWFLSA-N 0 1 320.440 4.043 20 0 DIADMN COc1cc([C@H](C)NCc2cncn2C(C)C)cc2ccccc21 ZINC000898242332 1047327816 /nfs/dbraw/zinc/32/78/16/1047327816.db2.gz QXIHAFADBVGTRD-HNNXBMFYSA-N 0 1 323.440 4.477 20 0 DIADMN Cc1ccccc1C1(NCc2cnc(C(C)(C)C)nc2)CCC1 ZINC000651862243 1047330965 /nfs/dbraw/zinc/33/09/65/1047330965.db2.gz HWYYCNXPFXORFG-UHFFFAOYSA-N 0 1 309.457 4.252 20 0 DIADMN FC1(F)C(F)(F)C12CCN(CCc1cccc(Cl)c1)CC2 ZINC000651900783 1047331810 /nfs/dbraw/zinc/33/18/10/1047331810.db2.gz JBLGJAISTNTYIM-UHFFFAOYSA-N 0 1 321.745 4.249 20 0 DIADMN CCN(Cc1cnn(C)c1)Cc1ccc2oc3ccccc3c2c1 ZINC000726070482 1047333020 /nfs/dbraw/zinc/33/30/20/1047333020.db2.gz ACXNCUPKGCBRFQ-UHFFFAOYSA-N 0 1 319.408 4.342 20 0 DIADMN CC[C@H](NCc1cnc(N(CC)CC)s1)c1ccccc1F ZINC000651932015 1047333414 /nfs/dbraw/zinc/33/34/14/1047333414.db2.gz JHMIDOMDQDDLBK-INIZCTEOSA-N 0 1 321.465 4.369 20 0 DIADMN COc1cccc(CN[C@@H]2CC(C)(C)Oc3ccc(F)cc32)c1 ZINC000651949886 1047333672 /nfs/dbraw/zinc/33/36/72/1047333672.db2.gz XNQXNGPFEJZHGQ-QGZVFWFLSA-N 0 1 315.388 4.226 20 0 DIADMN Cc1noc2ncc(CN[C@H](C)c3ccc(Cl)c(F)c3)cc12 ZINC001119445235 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1050811517 /nfs/dbraw/zinc/81/15/17/1050811517.db2.gz CVFMPUANNYYHCP-CQSZACIVSA-N 0 1 313.445 4.280 20 0 DIADMN CC(C)[C@@H](c1ccccc1)N(C)C(=O)c1cccc2[nH]cnc21 ZINC001146219458 1050816709 /nfs/dbraw/zinc/81/67/09/1050816709.db2.gz USWQKLVNVUBRAM-SFHVURJKSA-N 0 1 307.397 4.032 20 0 DIADMN Cc1cccc(F)c1CNCc1ccc(OCC(C)C)cc1 ZINC000742381608 1050825507 /nfs/dbraw/zinc/82/55/07/1050825507.db2.gz YZTXKKOPPKMZLL-UHFFFAOYSA-N 0 1 301.405 4.459 20 0 DIADMN CCCCC[C@H](NC(=O)[C@@H]1c2cn[nH]c2CC[C@H]1C)C(C)(C)C ZINC001146537690 1050827954 /nfs/dbraw/zinc/82/79/54/1050827954.db2.gz DPOCRYDOQGVDQQ-COXVUDFISA-N 0 1 319.493 4.187 20 0 DIADMN CCCCC[C@H](NC(=O)[C@H]1c2cn[nH]c2CC[C@@H]1C)C(C)(C)C ZINC001146537692 1050828600 /nfs/dbraw/zinc/82/86/00/1050828600.db2.gz DPOCRYDOQGVDQQ-RRQGHBQHSA-N 0 1 319.493 4.187 20 0 DIADMN COCc1ccc(CN[C@@H](C)c2nc3ccccc3s2)cc1 ZINC000742371186 1050831576 /nfs/dbraw/zinc/83/15/76/1050831576.db2.gz JGVQTRZSTMTIKY-ZDUSSCGKSA-N 0 1 312.438 4.294 20 0 DIADMN COCc1ccc(CN[C@H](C)c2nc3ccccc3s2)cc1 ZINC000742371185 1050832552 /nfs/dbraw/zinc/83/25/52/1050832552.db2.gz JGVQTRZSTMTIKY-CYBMUJFWSA-N 0 1 312.438 4.294 20 0 DIADMN CC[C@H](NCc1ccc(Br)cc1F)c1ccncc1 ZINC000742372189 1050833417 /nfs/dbraw/zinc/83/34/17/1050833417.db2.gz JACGZXMGNIEISA-HNNXBMFYSA-N 0 1 323.209 4.224 20 0 DIADMN Cc1c(Cl)cc(NC(=O)C2=CCCCC2)c(O)c1Cl ZINC001146724546 1050838094 /nfs/dbraw/zinc/83/80/94/1050838094.db2.gz YNWBONPASYLSBU-UHFFFAOYSA-N 0 1 300.185 4.446 20 0 DIADMN Cc1ccc(N2CCC[C@H](NCc3c(F)cccc3F)C2)cc1 ZINC000742380017 1050839422 /nfs/dbraw/zinc/83/94/22/1050839422.db2.gz JYWVSRKLYFGFCM-HNNXBMFYSA-N 0 1 316.395 4.032 20 0 DIADMN Cc1cccc(F)c1CNCc1ccc(Br)cc1 ZINC000742381103 1050839915 /nfs/dbraw/zinc/83/99/15/1050839915.db2.gz WXWRTGMNCQVRAX-UHFFFAOYSA-N 0 1 308.194 4.186 20 0 DIADMN C[C@@H]1CCCCN1c1cccc(N[C@H]2COCc3ccccc32)n1 ZINC001171291570 1050848340 /nfs/dbraw/zinc/84/83/40/1050848340.db2.gz FJUFHZIFFTYGEL-QAPCUYQASA-N 0 1 323.440 4.144 20 0 DIADMN CCCCC[C@@H](C)CC(=O)NC[C@@H](c1ccco1)N1CCCC1 ZINC000742481953 1050858874 /nfs/dbraw/zinc/85/88/74/1050858874.db2.gz FBCWAQDPXWDAHD-SJORKVTESA-N 0 1 320.477 4.139 20 0 DIADMN CCCCC[C@H](C)CC(=O)NC[C@H](c1cccs1)N(C)C ZINC000742480129 1050861803 /nfs/dbraw/zinc/86/18/03/1050861803.db2.gz KVDHIJKFSZTJOI-LSDHHAIUSA-N 0 1 310.507 4.074 20 0 DIADMN COc1cccc2c1CCC[C@@H]2N[C@H](C)c1c(C)noc1C ZINC000669614961 1050862908 /nfs/dbraw/zinc/86/29/08/1050862908.db2.gz GLEJMTHHASMKIW-BZNIZROVSA-N 0 1 300.402 4.028 20 0 DIADMN Cc1nc(-c2ccccc2)[nH]c1C(=O)Oc1ccc(C)c(F)c1 ZINC000789655733 1050864390 /nfs/dbraw/zinc/86/43/90/1050864390.db2.gz PVIYKRWCFQCASI-UHFFFAOYSA-N 0 1 310.328 4.052 20 0 DIADMN Cn1c(CNCc2ccc(C(C)(C)C)s2)nc2ccccc21 ZINC000761223220 1050866909 /nfs/dbraw/zinc/86/69/09/1050866909.db2.gz XSOSBDMITNBRGK-UHFFFAOYSA-N 0 1 313.470 4.222 20 0 DIADMN CC(C)C[C@H]1CCCCCN1C(=O)c1c2[nH]cnc2ccc1F ZINC001147278154 1050873047 /nfs/dbraw/zinc/87/30/47/1050873047.db2.gz ZYWNWMCDMOAFHO-CYBMUJFWSA-N 0 1 317.408 4.133 20 0 DIADMN Cc1ccc2nc(CN[C@@H](C)c3ccc(Cl)s3)[nH]c2c1 ZINC000498491059 1050874823 /nfs/dbraw/zinc/87/48/23/1050874823.db2.gz UDUMQXVPJSZBNP-JTQLQIEISA-N 0 1 305.834 4.437 20 0 DIADMN CC(C)N(Cc1cccc(F)c1)Cc1cccc2c1OCCO2 ZINC000746850257 1050876355 /nfs/dbraw/zinc/87/63/55/1050876355.db2.gz HONPXJLVFVOJOF-UHFFFAOYSA-N 0 1 315.388 4.008 20 0 DIADMN O=C(C=CC1CC1)Nc1ccc(-c2nc3ccccc3[nH]2)cc1 ZINC000742512056 1050878004 /nfs/dbraw/zinc/87/80/04/1050878004.db2.gz UWPZDIOVXGVUHN-KPKJPENVSA-N 0 1 303.365 4.135 20 0 DIADMN CCCCC[C@@H](C)CC(=O)NC[C@H](c1ccc(F)cc1)N(C)C ZINC000742562123 1050880275 /nfs/dbraw/zinc/88/02/75/1050880275.db2.gz SFCGGTKZYYARBJ-CRAIPNDOSA-N 0 1 322.468 4.151 20 0 DIADMN CCCCC[C@@H](C)CC(=O)NC[C@@H](c1ccc(F)cc1)N(C)C ZINC000742562125 1050880944 /nfs/dbraw/zinc/88/09/44/1050880944.db2.gz SFCGGTKZYYARBJ-QAPCUYQASA-N 0 1 322.468 4.151 20 0 DIADMN CCCCCc1cc(C(=O)N2CCCC[C@H]2[C@H](C)CC)n[nH]1 ZINC001147538310 1050891625 /nfs/dbraw/zinc/89/16/25/1050891625.db2.gz MVSYQTLHKHKTDM-PBHICJAKSA-N 0 1 305.466 4.183 20 0 DIADMN O=C(C=CC1CC1)Nc1ccc(-c2nc3ccc(F)cc3[nH]2)cc1 ZINC000742641431 1050909028 /nfs/dbraw/zinc/90/90/28/1050909028.db2.gz DBMDRNPPTDWEEF-XCVCLJGOSA-N 0 1 321.355 4.274 20 0 DIADMN CCCCC[C@@H](C)CC(=O)NCc1nc2ccc(Cl)cc2[nH]1 ZINC000742662532 1050912625 /nfs/dbraw/zinc/91/26/25/1050912625.db2.gz CHJFNZHZLPFXRF-GFCCVEGCSA-N 0 1 321.852 4.439 20 0 DIADMN C[C@@H](NCc1coc2ccccc12)c1cnn(-c2ccccc2)c1 ZINC000772984830 1050919785 /nfs/dbraw/zinc/91/97/85/1050919785.db2.gz QWPRQRXTTKPOSQ-OAHLLOKOSA-N 0 1 317.392 4.469 20 0 DIADMN CC[C@H](OCCN1C[C@@H](CC)O[C@@H](CC)C1)c1ccccc1 ZINC001171323541 1050922015 /nfs/dbraw/zinc/92/20/15/1050922015.db2.gz VXRFGHMGEKKJHQ-OTWHNJEPSA-N 0 1 305.462 4.044 20 0 DIADMN CC(C)(C)c1cnc(NC(=O)c2cc(Cl)ccc2O)s1 ZINC001148211396 1050925420 /nfs/dbraw/zinc/92/54/20/1050925420.db2.gz ZFWIBMSNXQVEPQ-UHFFFAOYSA-N 0 1 310.806 4.052 20 0 DIADMN C[C@H]1CCCC[C@H]1CC(=O)Nc1ccc(CN(C)C)c(F)c1 ZINC001148335329 1050932260 /nfs/dbraw/zinc/93/22/60/1050932260.db2.gz YIRZPKBSHJHJFF-KBPBESRZSA-N 0 1 306.425 4.042 20 0 DIADMN Cc1ccc(OC[C@H](C)NCc2ncc(C(C)(C)C)s2)cc1 ZINC000790468972 1050966985 /nfs/dbraw/zinc/96/69/85/1050966985.db2.gz GUTHPIAVRCOJQQ-AWEZNQCLSA-N 0 1 318.486 4.306 20 0 DIADMN Cc1n[nH]cc1[C@H](C)NCc1ccc(C)cc1OC(C)(C)C ZINC000180734968 1050973269 /nfs/dbraw/zinc/97/32/69/1050973269.db2.gz WZFCTXRZZHKNRI-ZDUSSCGKSA-N 0 1 301.434 4.055 20 0 DIADMN CN(C)c1ccncc1-c1nc(-c2ccc3ccccc3c2)no1 ZINC001214669573 1050975172 /nfs/dbraw/zinc/97/51/72/1050975172.db2.gz BJHBQJMKICMAEV-UHFFFAOYSA-N 0 1 316.364 4.018 20 0 DIADMN CC[C@@H](C)Oc1cc(C)ccc1CN[C@@H](C)c1c[nH]nc1C ZINC000180755225 1050981409 /nfs/dbraw/zinc/98/14/09/1050981409.db2.gz XGJKGQQCNYMJLK-KGLIPLIRSA-N 0 1 301.434 4.055 20 0 DIADMN Cc1ccc([C@H](C)NCc2nc3cc(F)ccc3n2C)cc1C ZINC000772996339 1050983470 /nfs/dbraw/zinc/98/34/70/1050983470.db2.gz CSRMZUVYCVOKJW-AWEZNQCLSA-N 0 1 311.404 4.180 20 0 DIADMN Cc1cc([C@H](C)N[C@H](C)C(=O)Nc2cc(C)cc(C)c2)c(C)o1 ZINC000348098582 1050985473 /nfs/dbraw/zinc/98/54/73/1050985473.db2.gz UFHNZJKNVUBGIY-LSDHHAIUSA-N 0 1 314.429 4.191 20 0 DIADMN C[C@H]1[C@@H](c2ccccc2)CCN1C(=O)c1ccc(Cl)c(O)c1 ZINC001149020008 1050986726 /nfs/dbraw/zinc/98/67/26/1050986726.db2.gz QBRMZEZFWWVAPG-WFASDCNBSA-N 0 1 315.800 4.064 20 0 DIADMN Cc1n[nH]cc1[C@H](C)N[C@@H](C)c1ccc(OCC2CC2)c(F)c1 ZINC000180770263 1050987653 /nfs/dbraw/zinc/98/76/53/1050987653.db2.gz CUKNTIHUXOHXJG-RYUDHWBXSA-N 0 1 317.408 4.058 20 0 DIADMN C[C@H](NC[C@@H]1CCC2(CCCCC2)O1)c1cccnc1Cl ZINC000790711894 1050987964 /nfs/dbraw/zinc/98/79/64/1050987964.db2.gz WJGJJBUWDSPKRA-KBPBESRZSA-N 0 1 308.853 4.268 20 0 DIADMN Cc1cc(Cl)nc(CN[C@@H]2CSCCc3ccccc32)c1 ZINC000282726561 1050989497 /nfs/dbraw/zinc/98/94/97/1050989497.db2.gz MHQHHHPNNJVJRA-MRXNPFEDSA-N 0 1 318.873 4.164 20 0 DIADMN CCSCCCN[C@H](c1ccccc1)c1ccc(F)cn1 ZINC000282739216 1050992220 /nfs/dbraw/zinc/99/22/20/1050992220.db2.gz NAHCEGPXXMHUHN-QGZVFWFLSA-N 0 1 304.434 4.043 20 0 DIADMN CCc1nnc(CN(CC(C)C)[C@H](CC)c2ccccc2)o1 ZINC000348137433 1050993898 /nfs/dbraw/zinc/99/38/98/1050993898.db2.gz DRKWXRJALPAQLK-MRXNPFEDSA-N 0 1 301.434 4.241 20 0 DIADMN C[C@@H](N[C@H](CO)c1ccsc1)c1ccccc1C(F)(F)F ZINC000348170341 1050997747 /nfs/dbraw/zinc/99/77/47/1050997747.db2.gz DRMRLSVJBQNJNY-QMTHXVAHSA-N 0 1 315.360 4.151 20 0 DIADMN COC[C@H](N[C@@H]1CCSc2c(F)cccc21)c1ccccc1 ZINC000180841707 1050997947 /nfs/dbraw/zinc/99/79/47/1050997947.db2.gz QRITZJGBWJFHRB-SJORKVTESA-N 0 1 317.429 4.340 20 0 DIADMN COc1ccc2nc(CN3CCCC4(CCC4)C3)sc2c1 ZINC000348169324 1050998089 /nfs/dbraw/zinc/99/80/89/1050998089.db2.gz OYIXSIBQXFRDRZ-UHFFFAOYSA-N 0 1 302.443 4.071 20 0 DIADMN Cc1ccc(-c2nnc([C@@H](C)N3CCCC4(CCC4)C3)o2)cc1 ZINC000348182256 1051000888 /nfs/dbraw/zinc/00/08/88/1051000888.db2.gz PYHJNAYJPQCUKC-OAHLLOKOSA-N 0 1 311.429 4.372 20 0 DIADMN Fc1ccc([C@H](NC[C@@H]2CCCC(F)(F)C2)c2ncc[nH]2)cc1 ZINC000282784611 1051001261 /nfs/dbraw/zinc/00/12/61/1051001261.db2.gz PTZQOQWMNYAZPB-DOMZBBRYSA-N 0 1 323.362 4.053 20 0 DIADMN Fc1cccc(-c2cnc(CN3CCCC4(CCC4)C3)o2)c1 ZINC000348171944 1051001925 /nfs/dbraw/zinc/00/19/25/1051001925.db2.gz WRJJRUKENAAVFW-UHFFFAOYSA-N 0 1 300.377 4.247 20 0 DIADMN Oc1c(Cl)ccc(Nc2ncc(Cl)nc2Cl)c1F ZINC001214791524 1051002668 /nfs/dbraw/zinc/00/26/68/1051002668.db2.gz WJBPMUJMADTEOH-UHFFFAOYSA-N 0 1 308.527 4.025 20 0 DIADMN Oc1c(Cl)ccc(Nc2csc(Br)n2)c1F ZINC001214796512 1051004366 /nfs/dbraw/zinc/00/43/66/1051004366.db2.gz ZMHRHHWGNKWOJD-UHFFFAOYSA-N 0 1 323.574 4.147 20 0 DIADMN Cc1nc2c(Nc3ccc(Cl)c(O)c3F)cccn2c1C ZINC001214798473 1051004692 /nfs/dbraw/zinc/00/46/92/1051004692.db2.gz TXEAKKYDUBXZLF-UHFFFAOYSA-N 0 1 305.740 4.193 20 0 DIADMN Oc1c(Cl)ccc(Nc2csc(-c3ccncc3)n2)c1F ZINC001214798103 1051004792 /nfs/dbraw/zinc/00/47/92/1051004792.db2.gz LLAUMOWAEBOQJT-UHFFFAOYSA-N 0 1 321.764 4.447 20 0 DIADMN Cc1cc(Nc2ccc(Cl)c(O)c2F)cnc1OC(C)C ZINC001214797658 1051005132 /nfs/dbraw/zinc/00/51/32/1051005132.db2.gz CMMQMSPDSUTIAO-UHFFFAOYSA-N 0 1 310.756 4.419 20 0 DIADMN Cc1cc(C)cc([C@@H](O)CN(C)Cc2ccccc2Cl)c1 ZINC000743249681 1051005102 /nfs/dbraw/zinc/00/51/02/1051005102.db2.gz KADYPVBPCILBCU-SFHVURJKSA-N 0 1 303.833 4.122 20 0 DIADMN COc1ccc2ncc(Nc3ccc(Cl)c(O)c3F)cc2c1 ZINC001214795930 1051005217 /nfs/dbraw/zinc/00/52/17/1051005217.db2.gz BVSAZJJVYVHPSK-UHFFFAOYSA-N 0 1 318.735 4.485 20 0 DIADMN Oc1c(Cl)ccc(Nc2cccc(Cn3ccnc3)c2)c1F ZINC001214799161 1051005341 /nfs/dbraw/zinc/00/53/41/1051005341.db2.gz OKPYDGSDETXJJM-UHFFFAOYSA-N 0 1 317.751 4.173 20 0 DIADMN Oc1c(Cl)ccc(Nc2nc(Cl)cnc2Cl)c1F ZINC001214795951 1051005692 /nfs/dbraw/zinc/00/56/92/1051005692.db2.gz CIAKUULNATXLMK-UHFFFAOYSA-N 0 1 308.527 4.025 20 0 DIADMN Oc1c(Cl)ccc(Nc2ccc(OC(F)(F)F)nc2)c1F ZINC001214795904 1051005927 /nfs/dbraw/zinc/00/59/27/1051005927.db2.gz BFRCNBZIWADAFR-UHFFFAOYSA-N 0 1 322.645 4.222 20 0 DIADMN OCc1ccc(Cl)cc1Nc1ccc(Cl)c(O)c1F ZINC001214803714 1051006340 /nfs/dbraw/zinc/00/63/40/1051006340.db2.gz FKIGOAKBPPBSCA-UHFFFAOYSA-N 0 1 302.132 4.074 20 0 DIADMN COc1c(F)c(F)ccc1Nc1ccc(Cl)c(O)c1F ZINC001214806244 1051006618 /nfs/dbraw/zinc/00/66/18/1051006618.db2.gz BDYHGDBKKZPUDF-UHFFFAOYSA-N 0 1 303.667 4.215 20 0 DIADMN C[C@H]1c2ccsc2CCN1C[C@H](O)c1cccc(Cl)c1 ZINC000743255465 1051007076 /nfs/dbraw/zinc/00/70/76/1051007076.db2.gz GWFBMWCPFVHJEV-NHYWBVRUSA-N 0 1 307.846 4.054 20 0 DIADMN Cc1c(Cl)ccc(N)c1Nc1ccc(Cl)c(O)c1F ZINC001214803903 1051007027 /nfs/dbraw/zinc/00/70/27/1051007027.db2.gz KBNSBRJJBNUYAP-UHFFFAOYSA-N 0 1 301.148 4.472 20 0 DIADMN Cc1c2ccc(Nc3ccc(Cl)c(O)c3F)cc2nn1C ZINC001214801185 1051007162 /nfs/dbraw/zinc/00/71/62/1051007162.db2.gz CPZOYUHKNXDTCV-UHFFFAOYSA-N 0 1 305.740 4.123 20 0 DIADMN Cc1nn(C)c2cc(Nc3ccc(Cl)c(O)c3F)ccc12 ZINC001214801194 1051007340 /nfs/dbraw/zinc/00/73/40/1051007340.db2.gz DCRWPNWEXZULND-UHFFFAOYSA-N 0 1 305.740 4.123 20 0 DIADMN CCc1ccc([C@H](C)NCc2nc3cc(F)ccc3n2C)cc1 ZINC000772998311 1051007552 /nfs/dbraw/zinc/00/75/52/1051007552.db2.gz GOJQANDAKXQQKM-ZDUSSCGKSA-N 0 1 311.404 4.126 20 0 DIADMN Cc1ccc2c(c1)[C@H](NCc1nc3cc(F)ccc3n1C)CCC2 ZINC000772998159 1051008055 /nfs/dbraw/zinc/00/80/55/1051008055.db2.gz FZRKFPQPRVPIJX-QGZVFWFLSA-N 0 1 323.415 4.188 20 0 DIADMN COC(=O)c1cccc(C)c1Nc1ccc(Cl)c(O)c1F ZINC001214801291 1051008039 /nfs/dbraw/zinc/00/80/39/1051008039.db2.gz IAFKHAUTBHGAIL-UHFFFAOYSA-N 0 1 309.724 4.023 20 0 DIADMN CC(=O)c1cc(Nc2ccc(Cl)c(O)c2F)cc(C(C)=O)c1 ZINC001214807295 1051008762 /nfs/dbraw/zinc/00/87/62/1051008762.db2.gz YBKJSMYKGFENFW-UHFFFAOYSA-N 0 1 321.735 4.334 20 0 DIADMN C[C@@H]1C(=O)N(CN2CCC[C@H]2c2ccccc2)[C@@H]1c1ccccc1 ZINC000743352515 1051015023 /nfs/dbraw/zinc/01/50/23/1051015023.db2.gz NJNKSRMLCINWLA-VDGAXYAQSA-N 0 1 320.436 4.001 20 0 DIADMN CC1CCC(N(C)CN2C(=O)C[C@@H]2c2ccc(Cl)cc2)CC1 ZINC000743352784 1051015561 /nfs/dbraw/zinc/01/55/61/1051015561.db2.gz OKUGVAJISXZLFI-QWFMPGPPSA-N 0 1 320.864 4.081 20 0 DIADMN CC[C@@H](NCc1nc2cc(F)ccc2n1C)c1ccc(F)cc1 ZINC000773000209 1051016235 /nfs/dbraw/zinc/01/62/35/1051016235.db2.gz LTBKRKQZRJCLHN-OAHLLOKOSA-N 0 1 315.367 4.092 20 0 DIADMN CCC[C@@H]1CC(=O)N(CN2CCCC[C@@H]2c2ccc(C)cc2)C1 ZINC000743369703 1051017027 /nfs/dbraw/zinc/01/70/27/1051017027.db2.gz IISYJLDQARMBIP-IEBWSBKVSA-N 0 1 314.473 4.128 20 0 DIADMN Cc1cccc([C@H]2CCCCN2CN2CCSC2=S)c1C ZINC000743389274 1051020586 /nfs/dbraw/zinc/02/05/86/1051020586.db2.gz VNJMXUHEGKEXKK-MRXNPFEDSA-N 0 1 320.527 4.122 20 0 DIADMN Cc1cccc([C@@H]2CCCCN2Cn2cccnc2=S)c1C ZINC000743388146 1051020848 /nfs/dbraw/zinc/02/08/48/1051020848.db2.gz NQZXDZMZVCALEN-KRWDZBQOSA-N 0 1 313.470 4.414 20 0 DIADMN Cc1cccc(C)c1CN1CCC[C@@H](C)[C@H]1C(=O)OC(C)(C)C ZINC001171371718 1051023549 /nfs/dbraw/zinc/02/35/49/1051023549.db2.gz ZRADKGHVIOOCHV-AEFFLSMTSA-N 0 1 317.473 4.246 20 0 DIADMN Cc1cc2[nH]ncc2cc1NC(=O)C=CSc1ccccc1 ZINC000791055741 1051024000 /nfs/dbraw/zinc/02/40/00/1051024000.db2.gz PCYWPWZJXOXRCM-FPLPWBNLSA-N 0 1 309.394 4.116 20 0 DIADMN Cc1cc2[nH]ncc2cc1NC(=O)c1ccccc1OCC(C)C ZINC000791057238 1051024768 /nfs/dbraw/zinc/02/47/68/1051024768.db2.gz PGRLAVLEZOKGRK-UHFFFAOYSA-N 0 1 323.396 4.158 20 0 DIADMN CCC[C@]1(C)CCCN(CN2C(=O)[C@H](C)[C@@H]2c2ccccc2)C1 ZINC000743404976 1051025251 /nfs/dbraw/zinc/02/52/51/1051025251.db2.gz DBGSRVQNDNWDBR-YVWKXTFCSA-N 0 1 314.473 4.066 20 0 DIADMN C[C@H](OC(=O)c1c(F)cc(O)cc1F)c1ccc(Cl)cc1 ZINC000746986316 1051033294 /nfs/dbraw/zinc/03/32/94/1051033294.db2.gz HWLOTCJDLIFFRF-QMMMGPOBSA-N 0 1 312.699 4.242 20 0 DIADMN C[C@@H](OC(=O)c1c(F)cc(O)cc1F)c1ccc(Cl)cc1 ZINC000746986313 1051033600 /nfs/dbraw/zinc/03/36/00/1051033600.db2.gz HWLOTCJDLIFFRF-MRVPVSSYSA-N 0 1 312.699 4.242 20 0 DIADMN C[C@@H](CSC(C)(C)C)NCc1c(F)cccc1OC(F)F ZINC000773045408 1051039218 /nfs/dbraw/zinc/03/92/18/1051039218.db2.gz QWJQIJZIYTYHQY-JTQLQIEISA-N 0 1 321.408 4.437 20 0 DIADMN CCCCCC(C)(C)CNC(=O)c1c(C)n[nH]c1C(F)(F)F ZINC000755545184 1051039462 /nfs/dbraw/zinc/03/94/62/1051039462.db2.gz 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Cc1nccnc1CN[C@H](c1ccc(CC(C)C)cc1)C1CC1 ZINC000621332804 1053949705 /nfs/dbraw/zinc/94/97/05/1053949705.db2.gz IEHWTKSRSDTLLM-HXUWFJFHSA-N 0 1 309.457 4.224 20 0 DIADMN CCOc1cncc(CN[C@H](C)c2ccc(SCC)cc2)c1 ZINC000621333531 1053949946 /nfs/dbraw/zinc/94/99/46/1053949946.db2.gz HOTSXXYMMIFNJY-CQSZACIVSA-N 0 1 316.470 4.443 20 0 DIADMN CN(Cc1cc2ncccc2[nH]1)Cc1ccc(C(F)(F)F)cc1 ZINC001232065341 1053950897 /nfs/dbraw/zinc/95/08/97/1053950897.db2.gz SYKJBHJWZOYYOR-UHFFFAOYSA-N 0 1 319.330 4.214 20 0 DIADMN CCC[N@H+](Cc1nc(Cl)ccc1Br)CC(C)C ZINC001232059202 1053951117 /nfs/dbraw/zinc/95/11/17/1053951117.db2.gz AXDFQBBKRIXOLW-UHFFFAOYSA-N 0 1 319.674 4.366 20 0 DIADMN CCCN(Cc1nc(Cl)ccc1Br)CC(C)C ZINC001232059202 1053951129 /nfs/dbraw/zinc/95/11/29/1053951129.db2.gz AXDFQBBKRIXOLW-UHFFFAOYSA-N 0 1 319.674 4.366 20 0 DIADMN Cn1nc(C(F)F)c(C[N@H+]2CCC[C@@H]3CCCC[C@@H]32)c1Cl ZINC001232055805 1053951656 /nfs/dbraw/zinc/95/16/56/1053951656.db2.gz UPVNTQVFGXKHFV-JQWIXIFHSA-N 0 1 317.811 4.166 20 0 DIADMN Cn1nc(C(F)F)c(CN2CCC[C@@H]3CCCC[C@@H]32)c1Cl ZINC001232055805 1053951667 /nfs/dbraw/zinc/95/16/67/1053951667.db2.gz UPVNTQVFGXKHFV-JQWIXIFHSA-N 0 1 317.811 4.166 20 0 DIADMN CC(C)(C)[C@@H](N[C@@H]1CCCc2c[nH]nc21)c1cccc(F)c1 ZINC001328726310 1053951794 /nfs/dbraw/zinc/95/17/94/1053951794.db2.gz PXMSENDFTPSQFU-WBVHZDCISA-N 0 1 301.409 4.303 20 0 DIADMN O=C([O-])[C@@H](c1ccccc1Cl)[N@H+]1CCC2(C1)CCCCC2 ZINC001328745304 1053952458 /nfs/dbraw/zinc/95/24/58/1053952458.db2.gz QLPHAHZCLAVHSM-OAHLLOKOSA-N 0 1 307.821 4.122 20 0 DIADMN CN(Cc1cc2ncccc2[nH]1)Cc1ccccc1C(F)(F)F ZINC001232065440 1053952354 /nfs/dbraw/zinc/95/23/54/1053952354.db2.gz WIRVTWUPVXVOGQ-UHFFFAOYSA-N 0 1 319.330 4.214 20 0 DIADMN CCCc1ccc(CNCc2ccc3c(n2)CCCC3)s1 ZINC000621350325 1053953717 /nfs/dbraw/zinc/95/37/17/1053953717.db2.gz FIDZDJUERWRWOC-UHFFFAOYSA-N 0 1 300.471 4.264 20 0 DIADMN CCOc1cncc(CN[C@@H](C)c2ccc(SC)cc2)c1 ZINC000621351523 1053954217 /nfs/dbraw/zinc/95/42/17/1053954217.db2.gz VYYDLAYDJKFKJD-ZDUSSCGKSA-N 0 1 302.443 4.053 20 0 DIADMN CCc1ccc(CN(C)Cc2cccc(C(F)(F)F)n2)cc1 ZINC001232070976 1053956653 /nfs/dbraw/zinc/95/66/53/1053956653.db2.gz CLBZZUQIVWZHAM-UHFFFAOYSA-N 0 1 308.347 4.295 20 0 DIADMN CCCc1ccc(CN[C@H](c2ccccc2F)[C@@H](C)O)s1 ZINC000621367914 1053957266 /nfs/dbraw/zinc/95/72/66/1053957266.db2.gz IVNFOVYEPRCWMD-PXAZEXFGSA-N 0 1 307.434 4.051 20 0 DIADMN Cc1ccc(CN2CCc3cc(C(F)(F)F)ccc3C2)c(C)n1 ZINC001232084516 1053959131 /nfs/dbraw/zinc/95/91/31/1053959131.db2.gz MCQAEBJZXPDGSB-UHFFFAOYSA-N 0 1 320.358 4.276 20 0 DIADMN Fc1ccccc1C1CCN(Cc2cc3ccncc3[nH]2)CC1 ZINC001232092721 1053959673 /nfs/dbraw/zinc/95/96/73/1053959673.db2.gz QCSQJMWHYDDIGQ-UHFFFAOYSA-N 0 1 309.388 4.082 20 0 DIADMN COc1cccc([C@H]2CCCCN2Cc2cc3ccncc3[nH]2)c1 ZINC001232094512 1053962549 /nfs/dbraw/zinc/96/25/49/1053962549.db2.gz TWUACJGRXZSZMW-HXUWFJFHSA-N 0 1 321.424 4.299 20 0 DIADMN Cc1cc(CN(Cc2cccc(Cl)c2)CC(C)C)ncn1 ZINC000621386952 1053964311 /nfs/dbraw/zinc/96/43/11/1053964311.db2.gz QMJKHVIARVPWDD-UHFFFAOYSA-N 0 1 303.837 4.097 20 0 DIADMN Cc1cnn(CCCCCN[C@@H](C(F)F)C2CCCCC2)c1 ZINC000621404093 1053968009 /nfs/dbraw/zinc/96/80/09/1053968009.db2.gz IGJMGHRFKLBITM-MRXNPFEDSA-N 0 1 313.436 4.165 20 0 DIADMN Fc1cc(-c2ccc(CN3CC[C@@H](F)C3)cc2)cnc1Cl ZINC001232135665 1053969065 /nfs/dbraw/zinc/96/90/65/1053969065.db2.gz WZOPWYOXCYQAPY-CQSZACIVSA-N 0 1 308.759 4.085 20 0 DIADMN Fc1cc(-c2ccc(CN3CC[C@H](F)C3)cc2)cnc1Cl ZINC001232135664 1053969680 /nfs/dbraw/zinc/96/96/80/1053969680.db2.gz WZOPWYOXCYQAPY-AWEZNQCLSA-N 0 1 308.759 4.085 20 0 DIADMN FC(F)(F)c1cnccc1N[C@@H]1CCc2ccc(Cl)cc21 ZINC001472845021 1053975032 /nfs/dbraw/zinc/97/50/32/1053975032.db2.gz LPXPBOICLCVZRE-CYBMUJFWSA-N 0 1 312.722 4.275 20 0 DIADMN Cc1ccc2nc(CNC(=O)C[C@@H]3CCCCC3(C)C)[nH]c2c1 ZINC001354824265 1053980598 /nfs/dbraw/zinc/98/05/98/1053980598.db2.gz IGRYNVWHUJCDBR-AWEZNQCLSA-N 0 1 313.445 4.094 20 0 DIADMN Cc1ccc2nc(CNC(=O)C[C@H]3CCCCC3(C)C)[nH]c2c1 ZINC001354824268 1053980823 /nfs/dbraw/zinc/98/08/23/1053980823.db2.gz IGRYNVWHUJCDBR-CQSZACIVSA-N 0 1 313.445 4.094 20 0 DIADMN Cc1scnc1CN1CCC[C@@H](CCc2ccccc2)C1 ZINC001232205115 1053987217 /nfs/dbraw/zinc/98/72/17/1053987217.db2.gz HEYHSTNNQILKAX-KRWDZBQOSA-N 0 1 300.471 4.296 20 0 DIADMN CN(Cc1ccncn1)Cc1ccccc1-c1ccc(Cl)cc1 ZINC001232196572 1053987314 /nfs/dbraw/zinc/98/73/14/1053987314.db2.gz BIPBPMWUAHFFKH-UHFFFAOYSA-N 0 1 323.827 4.429 20 0 DIADMN Fc1cccc2c(CN3CCC[C@@H](C(F)(F)F)C3)ccnc12 ZINC001232209214 1053987987 /nfs/dbraw/zinc/98/79/87/1053987987.db2.gz MHQYNRBAPBYIFM-GFCCVEGCSA-N 0 1 312.310 4.148 20 0 DIADMN Cc1scnc1CN1CCC(c2ccc(Cl)cc2)CC1 ZINC001232211230 1053988284 /nfs/dbraw/zinc/98/82/84/1053988284.db2.gz ZHZBJSNOXQNHSC-UHFFFAOYSA-N 0 1 306.862 4.485 20 0 DIADMN Cc1cnc([C@H](NC/C=C\c2ccc(F)cc2)C2CC2)s1 ZINC001200801958 1053988328 /nfs/dbraw/zinc/98/83/28/1053988328.db2.gz DBAJAQFSRMBZCR-RXYHWBRQSA-N 0 1 302.418 4.345 20 0 DIADMN Fc1cccc2c(CN3CCC[C@@H]3c3ccccn3)ccnc12 ZINC001232210082 1053990366 /nfs/dbraw/zinc/99/03/66/1053990366.db2.gz VYTLVXJBYLDVOD-GOSISDBHSA-N 0 1 307.372 4.106 20 0 DIADMN CO[C@@H](c1ccccc1Cl)[C@H](C)NCc1cc(C2CC2)no1 ZINC000660225025 1053990732 /nfs/dbraw/zinc/99/07/32/1053990732.db2.gz MEADLBVDAQOYDN-APPDUMDISA-N 0 1 320.820 4.071 20 0 DIADMN O=C(Nc1ccc2nc(-c3ccco3)[nH]c2c1)c1cccc(F)c1 ZINC000199417792 1053993773 /nfs/dbraw/zinc/99/37/73/1053993773.db2.gz RWXOVGMZVRCLKT-UHFFFAOYSA-N 0 1 321.311 4.214 20 0 DIADMN CCN(Cc1cccc(OC)c1)Cc1ccnc(C(C)(C)C)c1 ZINC001232218121 1053993765 /nfs/dbraw/zinc/99/37/65/1053993765.db2.gz VMBNLNMSYSJWFL-UHFFFAOYSA-N 0 1 312.457 4.410 20 0 DIADMN Cc1nccnc1CN(Cc1ccc2ccccc2c1)C1CC1 ZINC000621711222 1053995526 /nfs/dbraw/zinc/99/55/26/1053995526.db2.gz KHNXMXUPXMGPQJ-UHFFFAOYSA-N 0 1 303.409 4.103 20 0 DIADMN CSc1ccccc1[C@H](C)N[C@H](c1ccccc1)[C@H](C)O ZINC001329587417 1053999553 /nfs/dbraw/zinc/99/95/53/1053999553.db2.gz GGCOMFZJHFPWTH-DEYYWGMASA-N 0 1 301.455 4.181 20 0 DIADMN Cc1nccnc1CN1CC2(CCCCC2)[C@H]1c1ccccc1 ZINC000621731552 1054001024 /nfs/dbraw/zinc/00/10/24/1054001024.db2.gz SEWBFBGLBHIAFX-LJQANCHMSA-N 0 1 307.441 4.292 20 0 DIADMN Cc1ccc(C)c([C@H](C)N(C)CC(=O)N2[C@@H](C)CCC[C@@H]2C)c1 ZINC000621731076 1054001573 /nfs/dbraw/zinc/00/15/73/1054001573.db2.gz XJSUHCPHXOOGDX-BZSNNMDCSA-N 0 1 316.489 4.086 20 0 DIADMN Cc1nccnc1CN1CCCCC[C@@H]1/C=C/c1cccs1 ZINC000621722050 1054001614 /nfs/dbraw/zinc/00/16/14/1054001614.db2.gz JOOYSPDKFQZMCW-ROJDOSBLSA-N 0 1 313.470 4.305 20 0 DIADMN Fc1ccc([C@H]2CCN(Cc3ccnc(C(F)(F)F)c3)C2)cc1 ZINC001232240930 1054001912 /nfs/dbraw/zinc/00/19/12/1054001912.db2.gz WLUOUYSBKPKMEQ-AWEZNQCLSA-N 0 1 324.321 4.229 20 0 DIADMN c1ccc(COC[C@H]2CC[N@H+]2Cc2nccc3ccccc32)cc1 ZINC001232248710 1054003014 /nfs/dbraw/zinc/00/30/14/1054003014.db2.gz VOSSGRQVJJAYHX-LJQANCHMSA-N 0 1 318.420 4.026 20 0 DIADMN c1ccc(COC[C@H]2CCN2Cc2nccc3ccccc32)cc1 ZINC001232248710 1054003029 /nfs/dbraw/zinc/00/30/29/1054003029.db2.gz VOSSGRQVJJAYHX-LJQANCHMSA-N 0 1 318.420 4.026 20 0 DIADMN CCc1sc(CN2CC[C@](C)(CF)C2)cc1Br ZINC001232288014 1054013315 /nfs/dbraw/zinc/01/33/15/1054013315.db2.gz ZQSRMTACTNVCQH-CYBMUJFWSA-N 0 1 320.271 4.255 20 0 DIADMN COCc1cccc(CN(C)Cc2ccc3ccccc3c2)n1 ZINC001232259671 1054006158 /nfs/dbraw/zinc/00/61/58/1054006158.db2.gz HHPDFDGBSJXPLE-UHFFFAOYSA-N 0 1 306.409 4.013 20 0 DIADMN COc1cc(F)cc(CN[C@@H](c2ccc(F)cc2F)C2CC2)c1 ZINC001200819887 1054006606 /nfs/dbraw/zinc/00/66/06/1054006606.db2.gz FBWQIFKVXSFLKO-GOSISDBHSA-N 0 1 321.342 4.353 20 0 DIADMN Cc1ccnc(CN[C@@H]2C[C@@H]2C2CCCCC2)c1Br ZINC001200822470 1054008386 /nfs/dbraw/zinc/00/83/86/1054008386.db2.gz SRBAUBALBJWBGD-ZIAGYGMSSA-N 0 1 323.278 4.211 20 0 DIADMN COc1ccc(F)c(CN[C@H](CC(C)C)c2ccncc2)c1 ZINC000621766415 1054010152 /nfs/dbraw/zinc/01/01/52/1054010152.db2.gz SFTGZAONQKEOEN-GOSISDBHSA-N 0 1 302.393 4.106 20 0 DIADMN COc1ccc([C@@H](C)NCc2cc(OC)ccc2F)c(C)c1 ZINC000621765838 1054011088 /nfs/dbraw/zinc/01/10/88/1054011088.db2.gz GBPKMKKQEFYNOP-CYBMUJFWSA-N 0 1 303.377 4.002 20 0 DIADMN Fc1ccc([C@@H](NCC[C@@H]2CC2(F)F)c2cccnc2)c(F)c1 ZINC000621769078 1054015510 /nfs/dbraw/zinc/01/55/10/1054015510.db2.gz YJSNHKMSAMFYPA-WBMJQRKESA-N 0 1 324.321 4.084 20 0 DIADMN CC1CC(CN[C@H](c2cccnc2)c2ccc(F)cc2F)C1 ZINC000621771789 1054015571 /nfs/dbraw/zinc/01/55/71/1054015571.db2.gz MQCMBSWHWAMQHD-PWGQDJSOSA-N 0 1 302.368 4.085 20 0 DIADMN Cc1sc(CN2CC[C@@](C)(CF)C2)cc1Br ZINC001232290707 1054015821 /nfs/dbraw/zinc/01/58/21/1054015821.db2.gz CMQAQVNZFNNILW-LBPRGKRZSA-N 0 1 306.244 4.001 20 0 DIADMN COCc1ccc(CN2CCC[C@H]2c2cc(F)ccc2F)cc1 ZINC001232300127 1054016526 /nfs/dbraw/zinc/01/65/26/1054016526.db2.gz IYQGXRFWRYFZBW-IBGZPJMESA-N 0 1 317.379 4.448 20 0 DIADMN CCOc1ncc(CN(C)Cc2ccc(Cl)cc2)cc1C ZINC001232305233 1054017393 /nfs/dbraw/zinc/01/73/93/1054017393.db2.gz CTYGGYLRSMCHBG-UHFFFAOYSA-N 0 1 304.821 4.074 20 0 DIADMN COCc1ccc(CN2CCC[C@@H]2c2cc(F)cc(F)c2)cc1 ZINC001232303448 1054017719 /nfs/dbraw/zinc/01/77/19/1054017719.db2.gz GKVSEMLEFIWZSY-LJQANCHMSA-N 0 1 317.379 4.448 20 0 DIADMN Cc1sc(CN2CCC(CF)CC2)cc1Br ZINC001232294019 1054018107 /nfs/dbraw/zinc/01/81/07/1054018107.db2.gz RYTRKOTYFINQJQ-UHFFFAOYSA-N 0 1 306.244 4.001 20 0 DIADMN CS[C@@H]1CC[C@@H](N(C)Cc2coc(-c3cccc(F)c3)n2)C1 ZINC001330088276 1054021837 /nfs/dbraw/zinc/02/18/37/1054021837.db2.gz BFFFYWZUVLTEOE-HZPDHXFCSA-N 0 1 320.433 4.197 20 0 DIADMN COc1ccc(CN(C)[C@H](C)c2ccc(Cl)cc2)c(C)n1 ZINC001232336937 1054023094 /nfs/dbraw/zinc/02/30/94/1054023094.db2.gz VVJAGGCBVLVQMD-CYBMUJFWSA-N 0 1 304.821 4.245 20 0 DIADMN COc1cc(C)c(CN(C)Cc2cccc(C(F)(F)F)c2)cn1 ZINC001232351996 1054026169 /nfs/dbraw/zinc/02/61/69/1054026169.db2.gz BFPSZFQAPFGPIF-UHFFFAOYSA-N 0 1 324.346 4.049 20 0 DIADMN Cc1ccc2nc(SCc3cccc4c3CCOC4)[nH]c2c1 ZINC001472927710 1054030661 /nfs/dbraw/zinc/03/06/61/1054030661.db2.gz RXAKKQMAMCVKSZ-UHFFFAOYSA-N 0 1 310.422 4.236 20 0 DIADMN CCCCN(Cc1ccccc1F)C(=O)c1cnc(C(C)C)[nH]1 ZINC001330271283 1054033472 /nfs/dbraw/zinc/03/34/72/1054033472.db2.gz QCOHBYAYEBUWTP-UHFFFAOYSA-N 0 1 317.408 4.115 20 0 DIADMN COc1cc(CN2C3CCCC2CCC3)c(OC)cc1Cl ZINC001232375239 1054033875 /nfs/dbraw/zinc/03/38/75/1054033875.db2.gz IELLHGQXWKUVRG-UHFFFAOYSA-N 0 1 309.837 4.264 20 0 DIADMN Cc1ccc(OC(C)C)c(CN2CC[C@H](C(F)(F)F)C2)c1 ZINC001232397564 1054039084 /nfs/dbraw/zinc/03/90/84/1054039084.db2.gz QGVGZYJRHWYVAL-AWEZNQCLSA-N 0 1 301.352 4.166 20 0 DIADMN Fc1ccc2nc(CN3CCC4(CCCCC4)CC3)cn2c1 ZINC001232409855 1054039561 /nfs/dbraw/zinc/03/95/61/1054039561.db2.gz VBPQFPXIQTVTCI-UHFFFAOYSA-N 0 1 301.409 4.020 20 0 DIADMN Cc1ccccc1[C@@H]1CCCN1Cc1cn2cc(F)ccc2n1 ZINC001232411884 1054041971 /nfs/dbraw/zinc/04/19/71/1054041971.db2.gz VRQZHVXTVJDGNM-SFHVURJKSA-N 0 1 309.388 4.119 20 0 DIADMN CC[C@@H](c1ccccc1)N(Cc1cn(C(C)C)nn1)C(C)C ZINC001330581339 1054042842 /nfs/dbraw/zinc/04/28/42/1054042842.db2.gz JBJYIYONBVYHPC-SFHVURJKSA-N 0 1 300.450 4.221 20 0 DIADMN CN(Cc1cn2cc(F)ccc2n1)Cc1cccc2ccccc21 ZINC001232413145 1054043458 /nfs/dbraw/zinc/04/34/58/1054043458.db2.gz PFAYTMCVRBPOHS-UHFFFAOYSA-N 0 1 319.383 4.259 20 0 DIADMN CC[C@@H](NCc1ccc(F)c(OC)c1)c1ccccc1OC ZINC001330639624 1054045941 /nfs/dbraw/zinc/04/59/41/1054045941.db2.gz SXYIZTJXEMRBFN-MRXNPFEDSA-N 0 1 303.377 4.084 20 0 DIADMN O=C(CCCF)Nc1ccc2nc(C3CCCCC3)[nH]c2c1 ZINC001355066359 1054048571 /nfs/dbraw/zinc/04/85/71/1054048571.db2.gz QLHNZEDCPGYAGD-UHFFFAOYSA-N 0 1 303.381 4.299 20 0 DIADMN C[C@@H]1c2ccccc2CCN1Cc1c[nH]c2nccc(Cl)c12 ZINC001232456579 1054048922 /nfs/dbraw/zinc/04/89/22/1054048922.db2.gz VLATVOMHEPXVPQ-GFCCVEGCSA-N 0 1 311.816 4.336 20 0 DIADMN CCOc1cc(CN[C@H](C)c2ccoc2)ccc1OC(F)F ZINC000163883892 1054049217 /nfs/dbraw/zinc/04/92/17/1054049217.db2.gz NMKCVCUOFCOFRE-LLVKDONJSA-N 0 1 311.328 4.131 20 0 DIADMN CC(C)c1cc([C@@H]2CCCN(Cc3ncoc3C(C)C)C2)[nH]n1 ZINC001330723408 1054049451 /nfs/dbraw/zinc/04/94/51/1054049451.db2.gz UCHHACDRCGGTQN-CQSZACIVSA-N 0 1 316.449 4.024 20 0 DIADMN CC(C)c1cc([C@@H]2CCCN(Cc3ncoc3C(C)C)C2)n[nH]1 ZINC001330723408 1054049467 /nfs/dbraw/zinc/04/94/67/1054049467.db2.gz UCHHACDRCGGTQN-CQSZACIVSA-N 0 1 316.449 4.024 20 0 DIADMN C[C@H]1c2ccccc2CCN1Cc1c[nH]c2nccc(Cl)c12 ZINC001232456581 1054050163 /nfs/dbraw/zinc/05/01/63/1054050163.db2.gz VLATVOMHEPXVPQ-LBPRGKRZSA-N 0 1 311.816 4.336 20 0 DIADMN CC(=O)Nc1cccc([C@@H](C)N[C@@H]2CCCc3ccc(O)cc32)c1 ZINC000291321242 1054051801 /nfs/dbraw/zinc/05/18/01/1054051801.db2.gz UTGPIUQXQILXOY-ZUOKHONESA-N 0 1 324.424 4.079 20 0 DIADMN CCc1csc(CN2CCC[C@@H](c3cccc(OC)c3)C2)n1 ZINC001232477737 1054053542 /nfs/dbraw/zinc/05/35/42/1054053542.db2.gz PDWIGHRJPMIJTF-OAHLLOKOSA-N 0 1 316.470 4.094 20 0 DIADMN Cc1cc(Br)c(CN2CCC3(CC3)CC2)cc1F ZINC001232466791 1054054289 /nfs/dbraw/zinc/05/42/89/1054054289.db2.gz UGZXJIVVSGSFGS-UHFFFAOYSA-N 0 1 312.226 4.273 20 0 DIADMN Cc1ccc2c(c1)C1(CC2)CCN(Cc2cc(F)ccn2)CC1 ZINC001232492931 1054056641 /nfs/dbraw/zinc/05/66/41/1054056641.db2.gz BDJCXEBAWAQQSB-UHFFFAOYSA-N 0 1 310.416 4.009 20 0 DIADMN Cc1cccc(F)c1CN1CC[C@@H](Oc2cc(F)ccc2F)C1 ZINC001232484971 1054057048 /nfs/dbraw/zinc/05/70/48/1054057048.db2.gz OJUQUDDDVDSSEF-CQSZACIVSA-N 0 1 321.342 4.066 20 0 DIADMN Cc1ccccc1OC1CCN(Cc2c(C)cccc2F)CC1 ZINC001232481816 1054057528 /nfs/dbraw/zinc/05/75/28/1054057528.db2.gz IRZCRQOJUFJFPB-UHFFFAOYSA-N 0 1 313.416 4.486 20 0 DIADMN Nc1ccc(F)cc1CN1CCC[C@H]1c1ccccc1Cl ZINC001232510672 1054061405 /nfs/dbraw/zinc/06/14/05/1054061405.db2.gz GYZQEDWTTLRXHY-KRWDZBQOSA-N 0 1 304.796 4.398 20 0 DIADMN C[C@H](NC[C@H]1CC2(CCC2)CO1)c1nc(C(C)(C)C)cs1 ZINC001331111519 1054061785 /nfs/dbraw/zinc/06/17/85/1054061785.db2.gz VSAVSBWBNOAZEI-QWHCGFSZSA-N 0 1 308.491 4.050 20 0 DIADMN C[C@H](NCCC(=O)Nc1ccccc1)c1ccc(F)cc1Cl ZINC000164964748 1054066109 /nfs/dbraw/zinc/06/61/09/1054066109.db2.gz SMLVDDQHLFRIKY-LBPRGKRZSA-N 0 1 320.795 4.159 20 0 DIADMN CCC[C@@H]1CCCCN1Cc1cncc(Br)c1C ZINC001232533718 1054066911 /nfs/dbraw/zinc/06/69/11/1054066911.db2.gz QGAUQYSEMOFGPI-CQSZACIVSA-N 0 1 311.267 4.307 20 0 DIADMN C[C@H](N[C@H]1CCc2sc(Br)cc21)c1ccccn1 ZINC000293574473 1054068939 /nfs/dbraw/zinc/06/89/39/1054068939.db2.gz DQNLZIALGUOVQV-CABZTGNLSA-N 0 1 323.259 4.244 20 0 DIADMN Cc1ccccc1O[C@H]1CCCN(Cc2cc3ccoc3cn2)C1 ZINC001232552274 1054070426 /nfs/dbraw/zinc/07/04/26/1054070426.db2.gz BQPWXFCTYIUFQB-SFHVURJKSA-N 0 1 322.408 4.180 20 0 DIADMN Cc1ccc(-c2n[nH]c(NC(=O)[C@H](C)c3ccccc3)c2C)o1 ZINC000165146399 1054071066 /nfs/dbraw/zinc/07/10/66/1054071066.db2.gz UTUCESQIGGRRFK-GFCCVEGCSA-N 0 1 309.369 4.029 20 0 DIADMN CCN(CC)[C@H](C(=O)N[C@@H](C)CCCC(C)C)c1ccccc1 ZINC001355165174 1054071614 /nfs/dbraw/zinc/07/16/14/1054071614.db2.gz UJKILFLNMJPXSQ-HKUYNNGSSA-N 0 1 318.505 4.401 20 0 DIADMN C[C@@H]1C[C@@H](N[C@H](c2ccc(F)cc2)C(C)(C)C)c2nccn21 ZINC000293840520 1054071584 /nfs/dbraw/zinc/07/15/84/1054071584.db2.gz BZJSEWGYZXNXMT-DAXOMENPSA-N 0 1 301.409 4.405 20 0 DIADMN CCN(CC)[C@@H](C(=O)N[C@H](C)CCCC(C)C)c1ccccc1 ZINC001355165175 1054071705 /nfs/dbraw/zinc/07/17/05/1054071705.db2.gz UJKILFLNMJPXSQ-IEBWSBKVSA-N 0 1 318.505 4.401 20 0 DIADMN C[C@@H]1C[C@H](N[C@H](c2ccc(F)cc2)C(C)(C)C)c2nccn21 ZINC000293840533 1054071844 /nfs/dbraw/zinc/07/18/44/1054071844.db2.gz BZJSEWGYZXNXMT-UHOFOFEASA-N 0 1 301.409 4.405 20 0 DIADMN Cc1ccc(O[C@@H]2CCCN(Cc3nc4ccccc4o3)C2)cc1 ZINC001232558895 1054071845 /nfs/dbraw/zinc/07/18/45/1054071845.db2.gz IXSUFEQNYUVOMC-QGZVFWFLSA-N 0 1 322.408 4.180 20 0 DIADMN CCOc1ccnc(C[N@H+]2CC[C@@H](c3ccc(Cl)cc3)C2)c1 ZINC001232584437 1054072363 /nfs/dbraw/zinc/07/23/63/1054072363.db2.gz FCFXOWACMLAFPO-OAHLLOKOSA-N 0 1 316.832 4.123 20 0 DIADMN CN(Cc1ccccc1)Cc1cc(OCc2ccccc2)ccn1 ZINC001232586121 1054077860 /nfs/dbraw/zinc/07/78/60/1054077860.db2.gz WPVQVNIXSHFBIZ-UHFFFAOYSA-N 0 1 318.420 4.293 20 0 DIADMN Clc1cc(-n2cccn2)ccc1CN1CC2(C1)CCCCC2 ZINC001232595641 1054080347 /nfs/dbraw/zinc/08/03/47/1054080347.db2.gz GJVNXCOBLKYHKK-UHFFFAOYSA-N 0 1 315.848 4.292 20 0 DIADMN [O-]c1c(Cl)ccc(C[N@H+]2CCCC3(CCC3)C2)c1Cl ZINC001232628910 1054088773 /nfs/dbraw/zinc/08/87/73/1054088773.db2.gz JFOUBEGHFCPSMU-UHFFFAOYSA-N 0 1 300.229 4.465 20 0 DIADMN Cc1ncoc1CN1CCC(F)(c2ccc(Cl)cc2)CC1 ZINC001331566782 1054082405 /nfs/dbraw/zinc/08/24/05/1054082405.db2.gz CPGBFKYNFVYQTD-UHFFFAOYSA-N 0 1 308.784 4.097 20 0 DIADMN C[C@@H]1CCCCC[N@H+]1Cc1cc(F)c([O-])c(Br)c1 ZINC001232640888 1054092453 /nfs/dbraw/zinc/09/24/53/1054092453.db2.gz SWYUJLPLQGNKCO-SNVBAGLBSA-N 0 1 316.214 4.058 20 0 DIADMN C[N@@H+](CCc1ccccc1)Cc1ccc(Cl)c([O-])c1Cl ZINC001232624435 1054086963 /nfs/dbraw/zinc/08/69/63/1054086963.db2.gz PDEUAJNYBRLRNM-UHFFFAOYSA-N 0 1 310.224 4.374 20 0 DIADMN [O-]c1c(Cl)ccc(C[N@H+]2CCC[C@H]3CCC[C@@H]32)c1Cl ZINC001232626754 1054087867 /nfs/dbraw/zinc/08/78/67/1054087867.db2.gz AFQHTEZCSBEARK-MFKMUULPSA-N 0 1 300.229 4.464 20 0 DIADMN [O-]c1c(Cl)ccc(C[NH+]2CCC3(CC(F)C3)CC2)c1Cl ZINC001232626475 1054088113 /nfs/dbraw/zinc/08/81/13/1054088113.db2.gz ZDLNNCHTULMDFA-UHFFFAOYSA-N 0 1 318.219 4.413 20 0 DIADMN COC(C)(C)[C@H]1CCC[N@H+]1Cc1ccc(Cl)c([O-])c1Cl ZINC001232631603 1054088158 /nfs/dbraw/zinc/08/81/58/1054088158.db2.gz OCUHVKRYXOPOGA-GFCCVEGCSA-N 0 1 318.244 4.088 20 0 DIADMN [O-]c1c(Cl)ccc(C[N@H+]2CCC[C@H]3CCC[C@H]32)c1Cl ZINC001232626755 1054088730 /nfs/dbraw/zinc/08/87/30/1054088730.db2.gz AFQHTEZCSBEARK-ZWNOBZJWSA-N 0 1 300.229 4.464 20 0 DIADMN CC(C)[N@@H+](CCCCCO)Cc1ccc(Cl)c([O-])c1Cl ZINC001232628485 1054088972 /nfs/dbraw/zinc/08/89/72/1054088972.db2.gz GITUZOUAIKOWDW-UHFFFAOYSA-N 0 1 320.260 4.072 20 0 DIADMN CC[C@@H]1CCCC[C@H]1C[N@@H+](C)Cc1nc(=O)c2sccc2[n-]1 ZINC001331792285 1054090155 /nfs/dbraw/zinc/09/01/55/1054090155.db2.gz UFHKJLXCHHUBSA-OLZOCXBDSA-N 0 1 319.474 4.045 20 0 DIADMN Cc1cc2cc([C@@H](C)N[C@@H]3c4ccccc4C[C@@H]3O)oc2cc1C ZINC000166579258 1054093536 /nfs/dbraw/zinc/09/35/36/1054093536.db2.gz WUVCNSHNIOEHRW-YMTYPPQLSA-N 0 1 321.420 4.359 20 0 DIADMN CCN(Cc1ccccc1)Cc1ccc(Br)c(C)n1 ZINC001232663873 1054096008 /nfs/dbraw/zinc/09/60/08/1054096008.db2.gz MOUGJGVSBNMBLC-UHFFFAOYSA-N 0 1 319.246 4.175 20 0 DIADMN CCOc1ccc([C@@H](C)NCc2c(CC)noc2CC)cc1 ZINC000167001264 1054099591 /nfs/dbraw/zinc/09/95/91/1054099591.db2.gz PHTNTNRFEVWEDJ-CYBMUJFWSA-N 0 1 302.418 4.049 20 0 DIADMN CNc1ccccc1CN1CCC[C@@H]1c1cc(F)cc(F)c1 ZINC001232676275 1054100217 /nfs/dbraw/zinc/10/02/17/1054100217.db2.gz VZZWEZPEUBOFIY-GOSISDBHSA-N 0 1 302.368 4.344 20 0 DIADMN Brc1ccc(CN2CCC[C@@H](c3ccccc3)C2)[nH]1 ZINC001232689477 1054101822 /nfs/dbraw/zinc/10/18/22/1054101822.db2.gz NEBOFTXNGPLEJS-CQSZACIVSA-N 0 1 319.246 4.157 20 0 DIADMN COc1ccc(CN(C)Cc2cc3ccc(Cl)cc3[nH]2)cc1 ZINC001232727480 1054108423 /nfs/dbraw/zinc/10/84/23/1054108423.db2.gz AYEJICYIPGDPPG-UHFFFAOYSA-N 0 1 314.816 4.462 20 0 DIADMN CC(=O)c1ccc(CN(Cc2ccc(C)nc2)CC2CC2)cc1 ZINC001332136245 1054108593 /nfs/dbraw/zinc/10/85/93/1054108593.db2.gz LSNBPJUCHNXVGP-UHFFFAOYSA-N 0 1 308.425 4.005 20 0 DIADMN FC(F)(F)[C@H]1CCN(Cc2cc3ccc(Cl)cc3[nH]2)C1 ZINC001232732275 1054109619 /nfs/dbraw/zinc/10/96/19/1054109619.db2.gz QQVZWOGKABCYKA-JTQLQIEISA-N 0 1 302.727 4.206 20 0 DIADMN FC[C@@]1(C(F)(F)F)CCN(Cc2ccc3ncsc3c2)C1 ZINC001232736663 1054110391 /nfs/dbraw/zinc/11/03/91/1054110391.db2.gz IFDILXPPKOLQTC-ZDUSSCGKSA-N 0 1 318.339 4.020 20 0 DIADMN CC(C)(C)[C@H]1CCC[C@H](NCc2nc(C(F)F)no2)CC1 ZINC001355332198 1054111211 /nfs/dbraw/zinc/11/12/11/1054111211.db2.gz ICEXRMRPUOPNPF-QWRGUYRKSA-N 0 1 301.381 4.092 20 0 DIADMN COc1cccc([C@@H]2CC[N@@H+](Cc3ccnc(Cl)c3C)C2)c1 ZINC001232754874 1054114781 /nfs/dbraw/zinc/11/47/81/1054114781.db2.gz LOARQWDRUNOICK-MRXNPFEDSA-N 0 1 316.832 4.042 20 0 DIADMN Cc1cccc(C(=O)Nc2nc3cc(Cl)c(F)cc3[nH]2)c1F ZINC001437931549 1054115737 /nfs/dbraw/zinc/11/57/37/1054115737.db2.gz OOPNVQWNTCNTMK-UHFFFAOYSA-N 0 1 321.714 4.055 20 0 DIADMN Cc1ccccc1O[C@H]1CC[N@@H+](Cc2ccnc(Cl)c2C)C1 ZINC001232751879 1054116009 /nfs/dbraw/zinc/11/60/09/1054116009.db2.gz BZYFOZHRRIGBIH-INIZCTEOSA-N 0 1 316.832 4.005 20 0 DIADMN Cc1ccccc1O[C@H]1CCN(Cc2ccnc(Cl)c2C)C1 ZINC001232751879 1054116014 /nfs/dbraw/zinc/11/60/14/1054116014.db2.gz BZYFOZHRRIGBIH-INIZCTEOSA-N 0 1 316.832 4.005 20 0 DIADMN COc1ccc([C@H](C)[N@@H+](C)Cc2ccnc(Cl)c2C)cc1 ZINC001232752717 1054116657 /nfs/dbraw/zinc/11/66/57/1054116657.db2.gz AHAYWKGHGXUNTG-ZDUSSCGKSA-N 0 1 304.821 4.245 20 0 DIADMN COc1ccc([C@H](C)N(C)Cc2ccnc(Cl)c2C)cc1 ZINC001232752717 1054116665 /nfs/dbraw/zinc/11/66/65/1054116665.db2.gz AHAYWKGHGXUNTG-ZDUSSCGKSA-N 0 1 304.821 4.245 20 0 DIADMN CC[C@H](N[C@@H](C)c1cn2c(n1)CCCC2)c1ccc(F)cc1 ZINC001332410910 1054117660 /nfs/dbraw/zinc/11/76/60/1054117660.db2.gz BCBMBSWMYOIDQR-BBRMVZONSA-N 0 1 301.409 4.160 20 0 DIADMN COc1cccc([C@@H]2CC[N@H+](Cc3cccc([O-])c3Cl)C2)c1 ZINC001232789524 1054121152 /nfs/dbraw/zinc/12/11/52/1054121152.db2.gz LDMWOGUTHBFBIB-CQSZACIVSA-N 0 1 317.816 4.044 20 0 DIADMN COc1cccc([C@@H]2CC[N@@H+](Cc3cccc([O-])c3Cl)C2)c1 ZINC001232789524 1054121157 /nfs/dbraw/zinc/12/11/57/1054121157.db2.gz LDMWOGUTHBFBIB-CQSZACIVSA-N 0 1 317.816 4.044 20 0 DIADMN FC(F)(F)c1ccc(CN(CC2CC2)C2CC2)c(Cl)n1 ZINC001232795176 1054121404 /nfs/dbraw/zinc/12/14/04/1054121404.db2.gz HBWMCEARIMLJRR-UHFFFAOYSA-N 0 1 304.743 4.128 20 0 DIADMN CCCN(Cc1ccc(C(F)(F)F)nc1Cl)CC1CC1 ZINC001232790382 1054121713 /nfs/dbraw/zinc/12/17/13/1054121713.db2.gz PMEGLLWMIRQTPK-UHFFFAOYSA-N 0 1 306.759 4.376 20 0 DIADMN C[C@H]1CCN(Cc2ccc(C(F)(F)F)nc2Cl)[C@@H](C)C1 ZINC001232793178 1054121771 /nfs/dbraw/zinc/12/17/71/1054121771.db2.gz TZCIBHJWLJGJBH-UWVGGRQHSA-N 0 1 306.759 4.374 20 0 DIADMN CCCn1cnc(CN2CCC3(CCCc4ccccc43)CC2)c1 ZINC001232798290 1054122032 /nfs/dbraw/zinc/12/20/32/1054122032.db2.gz WPHVIKLWKUZYIV-UHFFFAOYSA-N 0 1 323.484 4.163 20 0 DIADMN CCCn1cnc(CN2CCC3(CCc4ccc(C)cc43)CC2)c1 ZINC001232796472 1054122119 /nfs/dbraw/zinc/12/21/19/1054122119.db2.gz XSWIEKGUQNWKHM-UHFFFAOYSA-N 0 1 323.484 4.082 20 0 DIADMN C[C@H]1CCCCN(Cc2ccc(C(F)(F)F)nc2Cl)C1 ZINC001232790023 1054122389 /nfs/dbraw/zinc/12/23/89/1054122389.db2.gz FVKFSBNADXRLGW-JTQLQIEISA-N 0 1 306.759 4.376 20 0 DIADMN C[C@]1(F)CCCN(Cc2ccc(C(F)(F)F)nc2Cl)CC1 ZINC001232790377 1054122909 /nfs/dbraw/zinc/12/29/09/1054122909.db2.gz PDWCSLQFDCXEQP-ZDUSSCGKSA-N 0 1 324.749 4.468 20 0 DIADMN CCN(Cc1cc(Br)co1)Cc1ccc(OC)cc1 ZINC001232856123 1054132557 /nfs/dbraw/zinc/13/25/57/1054132557.db2.gz MYPQEVBSEFOJFL-UHFFFAOYSA-N 0 1 324.218 4.073 20 0 DIADMN Cc1cnc([C@@H](NCc2ccc3c(c2)C[C@@H](C)O3)C2CC2)s1 ZINC001332780872 1054127804 /nfs/dbraw/zinc/12/78/04/1054127804.db2.gz IVKXYIAPDDUEKZ-DIFFPNOSSA-N 0 1 314.454 4.016 20 0 DIADMN CCN(c1ccc(NCc2cc3n(n2)CCCC3)cc1)C(C)C ZINC000848531203 1054129009 /nfs/dbraw/zinc/12/90/09/1054129009.db2.gz OYNZRFMNCNXAKQ-UHFFFAOYSA-N 0 1 312.461 4.066 20 0 DIADMN C[C@@H](N[C@@H](C)c1ncccn1)[C@H](C)c1ccccc1C(F)(F)F ZINC001332855121 1054129579 /nfs/dbraw/zinc/12/95/79/1054129579.db2.gz VBGRIUSNKHQZEO-XQQFMLRXSA-N 0 1 323.362 4.338 20 0 DIADMN Brc1coc(CN2CC[C@@H](Cc3ccccc3)C2)c1 ZINC001232855160 1054132315 /nfs/dbraw/zinc/13/23/15/1054132315.db2.gz ZCBYJAPBTNBRSJ-AWEZNQCLSA-N 0 1 320.230 4.107 20 0 DIADMN COc1ccc([C@@H](C)[N@@H+](C)Cc2cc(Br)co2)cc1 ZINC001232856950 1054132954 /nfs/dbraw/zinc/13/29/54/1054132954.db2.gz JISSYRLQONOAEA-LLVKDONJSA-N 0 1 324.218 4.244 20 0 DIADMN COc1ccc([C@@H](C)N(C)Cc2cc(Br)co2)cc1 ZINC001232856950 1054132959 /nfs/dbraw/zinc/13/29/59/1054132959.db2.gz JISSYRLQONOAEA-LLVKDONJSA-N 0 1 324.218 4.244 20 0 DIADMN CC(C)[C@@H](NCc1cnc(Cl)n1C)c1ccccc1Cl ZINC000848538413 1054133014 /nfs/dbraw/zinc/13/30/14/1054133014.db2.gz YBALWMKJDOHAAP-CQSZACIVSA-N 0 1 312.244 4.214 20 0 DIADMN FC(F)c1ccc(CN2CCC(Nc3ccccc3)CC2)cn1 ZINC001332961961 1054133189 /nfs/dbraw/zinc/13/31/89/1054133189.db2.gz RWJHERIQTPUYNS-UHFFFAOYSA-N 0 1 317.383 4.096 20 0 DIADMN COc1ccc([C@H](C)[N@@H+](C)Cc2cc(Br)co2)cc1 ZINC001232856951 1054133724 /nfs/dbraw/zinc/13/37/24/1054133724.db2.gz JISSYRLQONOAEA-NSHDSACASA-N 0 1 324.218 4.244 20 0 DIADMN COc1ccc([C@H](C)N(C)Cc2cc(Br)co2)cc1 ZINC001232856951 1054133730 /nfs/dbraw/zinc/13/37/30/1054133730.db2.gz JISSYRLQONOAEA-NSHDSACASA-N 0 1 324.218 4.244 20 0 DIADMN CCN(Cc1c[nH]c2ccc(O)cc12)Cc1cccc(F)c1F ZINC001232868461 1054135965 /nfs/dbraw/zinc/13/59/65/1054135965.db2.gz LSUDLVDGIYPWNC-UHFFFAOYSA-N 0 1 316.351 4.174 20 0 DIADMN Cc1ccc(C)c(NC(=O)c2cccc(C(F)(F)F)c2O)c1 ZINC000622272170 1054136910 /nfs/dbraw/zinc/13/69/10/1054136910.db2.gz JSEALTREBADYIZ-UHFFFAOYSA-N 0 1 309.287 4.280 20 0 DIADMN Cc1cc(O)cc(CN(C)Cc2ccc(Br)cc2)c1 ZINC001232882137 1054138103 /nfs/dbraw/zinc/13/81/03/1054138103.db2.gz VZGLBOMYKPFMOY-UHFFFAOYSA-N 0 1 320.230 4.095 20 0 DIADMN C[C@H]1CN(Cc2ccc(-c3cccc(F)c3)nc2)CCC1(F)F ZINC001232887007 1054142180 /nfs/dbraw/zinc/14/21/80/1054142180.db2.gz XVJPZDSXAACIDQ-ZDUSSCGKSA-N 0 1 320.358 4.365 20 0 DIADMN COc1ccc2c(c1)[C@@H](NCc1ccccc1C(C)C)CCO2 ZINC000848546912 1054142436 /nfs/dbraw/zinc/14/24/36/1054142436.db2.gz IUANIUBGYOMZQS-IBGZPJMESA-N 0 1 311.425 4.432 20 0 DIADMN CCN(Cc1ccncc1)Cc1cncc(-c2ccccc2)c1 ZINC001232898120 1054143583 /nfs/dbraw/zinc/14/35/83/1054143583.db2.gz ZVEQNKJIOGLZGH-UHFFFAOYSA-N 0 1 303.409 4.166 20 0 DIADMN O=C([O-])[C@H](c1ccccc1Cl)[N@H+]1CC[C@H](C2CCCCC2)C1 ZINC001333145798 1054144723 /nfs/dbraw/zinc/14/47/23/1054144723.db2.gz QZNTYTLWBXHOSM-YOEHRIQHSA-N 0 1 321.848 4.368 20 0 DIADMN Cc1cc(CN2CC[C@H]3CCCC[C@@H]3C2)ncc1Br ZINC001232906481 1054145995 /nfs/dbraw/zinc/14/59/95/1054145995.db2.gz CWOHYIHMEXUFNQ-ZIAGYGMSSA-N 0 1 323.278 4.165 20 0 DIADMN COc1cccc(CN[C@H](c2nc(C)cs2)C2CC2)c1C ZINC001333192894 1054146813 /nfs/dbraw/zinc/14/68/13/1054146813.db2.gz PVVACWVRBCRNFR-INIZCTEOSA-N 0 1 302.443 4.009 20 0 DIADMN Cc1cc(CN2CCC[C@@H]3CCCC[C@@H]32)ncc1Br ZINC001232907164 1054147848 /nfs/dbraw/zinc/14/78/48/1054147848.db2.gz MILVFQKBURUSRO-BBRMVZONSA-N 0 1 323.278 4.307 20 0 DIADMN C[C@H]1C(=O)CC[N@@H+](Cc2ccccc2-n2cccc2)C12CCCC2 ZINC001232913933 1054149627 /nfs/dbraw/zinc/14/96/27/1054149627.db2.gz ZKEHIGYRFRYJKB-KRWDZBQOSA-N 0 1 322.452 4.201 20 0 DIADMN 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0 1 308.425 4.087 20 0 DIADMN Cc1cc(Cl)c(Cl)cc1CN1CCCOC(C)(C)C1 ZINC001238256114 1055632191 /nfs/dbraw/zinc/63/21/91/1055632191.db2.gz DRGQRVOGVHQWHO-UHFFFAOYSA-N 0 1 302.245 4.303 20 0 DIADMN CCOC(=O)c1c(Cl)cccc1CN1CCC[C@@H]2CCC[C@H]21 ZINC001238043761 1055593710 /nfs/dbraw/zinc/59/37/10/1055593710.db2.gz JHYTVNDRPXPTFN-XJKSGUPXSA-N 0 1 321.848 4.281 20 0 DIADMN CCOC(=O)c1c(Cl)cccc1CN1C[C@H]2CCCC[C@@H]2C1 ZINC001238046861 1055594240 /nfs/dbraw/zinc/59/42/40/1055594240.db2.gz PYFWTUGLWHBXIA-ZIAGYGMSSA-N 0 1 321.848 4.139 20 0 DIADMN CCOC(=O)c1c(Cl)cccc1CN1CCC[C@@H]2CCC[C@@H]21 ZINC001238043756 1055595460 /nfs/dbraw/zinc/59/54/60/1055595460.db2.gz JHYTVNDRPXPTFN-BBRMVZONSA-N 0 1 321.848 4.281 20 0 DIADMN Fc1cc(Br)c(F)c(CN(CC2CC2)C2CC2)c1 ZINC001238081286 1055603039 /nfs/dbraw/zinc/60/30/39/1055603039.db2.gz OFPLLNHLEXFGBH-UHFFFAOYSA-N 0 1 316.189 4.102 20 0 DIADMN Cc1nc2c(cccc2C(=O)N2CCCC3(CCCCC3)C2)[nH]1 ZINC000338536013 1055604980 /nfs/dbraw/zinc/60/49/80/1055604980.db2.gz JTRZZXJXISHSRQ-UHFFFAOYSA-N 0 1 311.429 4.058 20 0 DIADMN CC(C)(C)c1ccc(NC(=O)c2cc(-c3ccco3)n[nH]2)cc1 ZINC000028268124 1055608903 /nfs/dbraw/zinc/60/89/03/1055608903.db2.gz WJOBINBRKYNIJF-UHFFFAOYSA-N 0 1 309.369 4.220 20 0 DIADMN CN(Cc1cccc(Cl)c1Cl)Cc1cccc2cncn21 ZINC001238114394 1055610278 /nfs/dbraw/zinc/61/02/78/1055610278.db2.gz UEIJSLQGVOWBKQ-UHFFFAOYSA-N 0 1 320.223 4.273 20 0 DIADMN Oc1cc(F)c(CN2CCCC[C@@H]2C(F)(F)F)cc1Cl ZINC001238147663 1055611071 /nfs/dbraw/zinc/61/10/71/1055611071.db2.gz AEKXCXVRIZSDAH-GFCCVEGCSA-N 0 1 311.706 4.102 20 0 DIADMN O=C(NCCC1CCCCC1)c1cccc(C(F)(F)F)c1O ZINC001595563052 1055611793 /nfs/dbraw/zinc/61/17/93/1055611793.db2.gz ITCLENPAICCMMQ-UHFFFAOYSA-N 0 1 315.335 4.111 20 0 DIADMN Cc1ncncc1CN1CCC[C@@H]1c1ccc(C(F)(F)F)cc1 ZINC001238172276 1055614109 /nfs/dbraw/zinc/61/41/09/1055614109.db2.gz DSWHHWDWRYIDKR-MRXNPFEDSA-N 0 1 321.346 4.141 20 0 DIADMN Cc1ncncc1CN1CCC[C@H]1c1ccc(C(F)(F)F)cc1 ZINC001238176772 1055614150 /nfs/dbraw/zinc/61/41/50/1055614150.db2.gz DSWHHWDWRYIDKR-INIZCTEOSA-N 0 1 321.346 4.141 20 0 DIADMN Cc1ncncc1CN1CC[C@@H](c2ccc(Cl)c(Cl)c2)C1 ZINC001238167023 1055614785 /nfs/dbraw/zinc/61/47/85/1055614785.db2.gz HTYVVKHUEKVSIQ-CYBMUJFWSA-N 0 1 322.239 4.081 20 0 DIADMN [O-]c1cc(F)c(C[N@@H+]2CCCc3ccccc3C2)cc1Cl ZINC001238152768 1055615312 /nfs/dbraw/zinc/61/53/12/1055615312.db2.gz RBXOQFSYDBWMJS-UHFFFAOYSA-N 0 1 305.780 4.133 20 0 DIADMN [O-]c1cc(F)c(C[N@H+]2CCCc3ccccc3C2)cc1Cl ZINC001238152768 1055615319 /nfs/dbraw/zinc/61/53/19/1055615319.db2.gz RBXOQFSYDBWMJS-UHFFFAOYSA-N 0 1 305.780 4.133 20 0 DIADMN [O-]c1cc(F)c(C[N@@H+]2CC[C@@H](c3cccc(F)c3)C2)cc1Cl ZINC001238150706 1055615381 /nfs/dbraw/zinc/61/53/81/1055615381.db2.gz XTEVSPOEQRWZHE-GFCCVEGCSA-N 0 1 323.770 4.313 20 0 DIADMN [O-]c1cc(F)c(C[N@H+]2CC[C@@H](c3cccc(F)c3)C2)cc1Cl ZINC001238150706 1055615387 /nfs/dbraw/zinc/61/53/87/1055615387.db2.gz XTEVSPOEQRWZHE-GFCCVEGCSA-N 0 1 323.770 4.313 20 0 DIADMN COc1c(C)cnc(CN2Cc3ccccc3C(C)(C)C2)c1C ZINC001238175595 1055615495 /nfs/dbraw/zinc/61/54/95/1055615495.db2.gz UBMHKDGUPNYERH-UHFFFAOYSA-N 0 1 310.441 4.000 20 0 DIADMN CCN(Cc1ccncc1)Cc1cccc(-c2cccs2)n1 ZINC001238205635 1055619875 /nfs/dbraw/zinc/61/98/75/1055619875.db2.gz OYUMFGGGPYKIEN-UHFFFAOYSA-N 0 1 309.438 4.227 20 0 DIADMN CCN(Cc1cccc(-c2cc[nH]n2)c1)Cc1ccccc1F ZINC001238202290 1055619958 /nfs/dbraw/zinc/61/99/58/1055619958.db2.gz HPSFIQBNURPOGX-UHFFFAOYSA-N 0 1 309.388 4.238 20 0 DIADMN C[C@H]1CN(Cc2cccc(-c3cccs3)n2)CCC1(F)F ZINC001238208955 1055620662 /nfs/dbraw/zinc/62/06/62/1055620662.db2.gz KDUBGZJFLBZVEC-LBPRGKRZSA-N 0 1 308.397 4.287 20 0 DIADMN Cc1nc2cccc(C(=O)Nc3ccc(-c4ccc[nH]4)cc3)c2[nH]1 ZINC000338553351 1055621414 /nfs/dbraw/zinc/62/14/14/1055621414.db2.gz YMDWVZMSYFXNCK-UHFFFAOYSA-N 0 1 316.364 4.119 20 0 DIADMN COC(=O)C[C@H]1CCCN(Cc2ccc(Cl)c(C(C)C)c2)C1 ZINC001238224210 1055624159 /nfs/dbraw/zinc/62/41/59/1055624159.db2.gz GJAFNPCAJLTSJO-CQSZACIVSA-N 0 1 323.864 4.239 20 0 DIADMN CC(C)c1cc(CN2CCC[C@@]3(CCC(=O)O3)C2)ccc1Cl ZINC001238224720 1055624195 /nfs/dbraw/zinc/62/41/95/1055624195.db2.gz JAIBJPHEXNMDAN-GOSISDBHSA-N 0 1 321.848 4.135 20 0 DIADMN FC(F)[C@@H]1CCCN(Cc2cccc(-c3cccs3)n2)C1 ZINC001238221664 1055624420 /nfs/dbraw/zinc/62/44/20/1055624420.db2.gz WDKZAVWZJZCZQL-GFCCVEGCSA-N 0 1 308.397 4.287 20 0 DIADMN COC(=O)C[C@@H]1CCCN(Cc2ccc(Cl)c(C(C)C)c2)C1 ZINC001238224209 1055625120 /nfs/dbraw/zinc/62/51/20/1055625120.db2.gz GJAFNPCAJLTSJO-AWEZNQCLSA-N 0 1 323.864 4.239 20 0 DIADMN Cc1ccccc1[C@H]1CCC[N@H+]1Cc1ccc(F)cc1C(=O)[O-] ZINC001238231331 1055626834 /nfs/dbraw/zinc/62/68/34/1055626834.db2.gz AODMJAANDMTGPA-GOSISDBHSA-N 0 1 313.372 4.169 20 0 DIADMN O=C(Nc1nc2cc(Cl)cc(Cl)c2[nH]1)[C@@H]1C[C@H]1C1CCC1 ZINC001595735491 1055627838 /nfs/dbraw/zinc/62/78/38/1055627838.db2.gz ZABDHUYUJRPHIT-VHSXEESVSA-N 0 1 324.211 4.244 20 0 DIADMN Cn1ccc(CNc2ccc3nc(-c4ccc(F)cc4)[nH]c3c2)c1 ZINC001620962100 1055628834 /nfs/dbraw/zinc/62/88/34/1055628834.db2.gz OTTTWLHECQJMJK-UHFFFAOYSA-N 0 1 320.371 4.320 20 0 DIADMN CCOc1cc(Br)cc(CN2CC3CCC2CC3)c1 ZINC001238251840 1055628868 /nfs/dbraw/zinc/62/88/68/1055628868.db2.gz GYQVQXFBQZIVFO-UHFFFAOYSA-N 0 1 324.262 4.222 20 0 DIADMN CO[C@@H]1CCN(Cc2cc(Cl)c(Cl)cc2C)[C@@H](C)C1 ZINC001238256146 1055632003 /nfs/dbraw/zinc/63/20/03/1055632003.db2.gz DZBXDLRWBFSSGV-WCQYABFASA-N 0 1 302.245 4.301 20 0 DIADMN COc1c(Br)cc(C)cc1CN1CCC12CCCC2 ZINC001238310815 1055638654 /nfs/dbraw/zinc/63/86/54/1055638654.db2.gz ATLSXMMUFMLRJO-UHFFFAOYSA-N 0 1 324.262 4.285 20 0 DIADMN CC(C)Oc1c(F)cccc1CN1C[C@H]2CC[C@@H](C1)C2(F)F ZINC001238317538 1055638728 /nfs/dbraw/zinc/63/87/28/1055638728.db2.gz DFCNEVJWOJHKPR-OKILXGFUSA-N 0 1 313.363 4.090 20 0 DIADMN COc1c(Br)cc(C)cc1CN1CCCC[C@H]1C ZINC001238317609 1055639455 /nfs/dbraw/zinc/63/94/55/1055639455.db2.gz JVIYBTBLENEWCY-GFCCVEGCSA-N 0 1 312.251 4.141 20 0 DIADMN CCN(C)[C@@H](C(=O)NCC(CC)(CC)CC)c1ccccc1 ZINC001595861314 1055641517 /nfs/dbraw/zinc/64/15/17/1055641517.db2.gz 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QYQMELBPPZQHNY-UHFFFAOYSA-N 0 1 323.864 4.272 20 0 DIADMN CCCc1ccc(NC(=O)c2cc(-c3ccc(F)cc3)n[nH]2)cc1 ZINC001538540297 1055653058 /nfs/dbraw/zinc/65/30/58/1055653058.db2.gz ASRIIKFKZWIOJX-UHFFFAOYSA-N 0 1 323.371 4.421 20 0 DIADMN Cn1nccc1CNc1ccc2[nH]c(CC3CCCCC3)nc2c1 ZINC001620963746 1055653746 /nfs/dbraw/zinc/65/37/46/1055653746.db2.gz LOMFGEPJFSEMOA-UHFFFAOYSA-N 0 1 323.444 4.031 20 0 DIADMN Cc1cc(CN2CC[C@@H](c3cccc(F)c3)C2)ncc1Cl ZINC001238421572 1055655205 /nfs/dbraw/zinc/65/52/05/1055655205.db2.gz HMDRVFWSPCLIGF-CQSZACIVSA-N 0 1 304.796 4.172 20 0 DIADMN Cc1cc(CN2CCC(c3cccs3)CC2)ncc1Cl ZINC001238419293 1055655260 /nfs/dbraw/zinc/65/52/60/1055655260.db2.gz XJRHJVCGXWYLNW-UHFFFAOYSA-N 0 1 306.862 4.485 20 0 DIADMN CC(C)Oc1cccc(CN2CC[C@@H](C)C(F)(F)CC2)c1F ZINC001238425699 1055655999 /nfs/dbraw/zinc/65/59/99/1055655999.db2.gz ZWWMXUFFUAJBPB-CYBMUJFWSA-N 0 1 315.379 4.480 20 0 DIADMN Cc1nc2cccc(C(=O)N3CC[C@@H](C)c4ccccc43)c2[nH]1 ZINC000338582894 1055657224 /nfs/dbraw/zinc/65/72/24/1055657224.db2.gz UMWCUKHCFZANLF-GFCCVEGCSA-N 0 1 305.381 4.025 20 0 DIADMN CC(C)CC[C@H]1CCCCN1C(=O)c1ccc(O)c(Cl)c1 ZINC001595993083 1055658242 /nfs/dbraw/zinc/65/82/42/1055658242.db2.gz UHDDEIVGHVDNBS-CQSZACIVSA-N 0 1 309.837 4.477 20 0 DIADMN Cc1ccc(OC2CCN(Cc3ncc(C)cc3C)CC2)cc1 ZINC001238430223 1055658638 /nfs/dbraw/zinc/65/86/38/1055658638.db2.gz RGUPCUXRIKZHSQ-UHFFFAOYSA-N 0 1 310.441 4.050 20 0 DIADMN CC(C)Oc1cc(CN2CCC(F)(F)C(C)(C)C2)ccc1F ZINC001238454293 1055663060 /nfs/dbraw/zinc/66/30/60/1055663060.db2.gz NOHLQWIBSCSFOS-UHFFFAOYSA-N 0 1 315.379 4.480 20 0 DIADMN CCN(Cc1ccncc1)Cc1ccc(F)c(OC(C)C)c1 ZINC001238461924 1055665507 /nfs/dbraw/zinc/66/55/07/1055665507.db2.gz HUYJZEGJBOTJEY-UHFFFAOYSA-N 0 1 302.393 4.030 20 0 DIADMN CCCOc1ccc([C@H](C)NCc2ccnn2C2CCC2)cc1 ZINC000921622174 1055668793 /nfs/dbraw/zinc/66/87/93/1055668793.db2.gz RTKBELOUKOJDCN-HNNXBMFYSA-N 0 1 313.445 4.248 20 0 DIADMN COc1c(CN2CC[C@@H](Cc3ccccc3)C2)ccc(F)c1F ZINC001238478385 1055669083 /nfs/dbraw/zinc/66/90/83/1055669083.db2.gz UGVSHOAROBOMBO-HNNXBMFYSA-N 0 1 317.379 4.038 20 0 DIADMN C[C@H]1CC(CNC(=O)c2n[nH]c3ccc(Cl)cc32)C[C@H](C)C1 ZINC001538598195 1055670036 /nfs/dbraw/zinc/67/00/36/1055670036.db2.gz MKCXBMVCSPQFAT-GHMZBOCLSA-N 0 1 319.836 4.018 20 0 DIADMN COc1ccccc1CN(C)Cc1cc(OC(C)C)ccc1C ZINC001238485985 1055670292 /nfs/dbraw/zinc/67/02/92/1055670292.db2.gz PIYMPHZYLRRJAY-UHFFFAOYSA-N 0 1 313.441 4.423 20 0 DIADMN CCN(CC(=O)Nc1c(C)cccc1C)Cc1cccc(C)c1 ZINC000042146030 1055673705 /nfs/dbraw/zinc/67/37/05/1055673705.db2.gz FEGRZOYUKQEZJE-UHFFFAOYSA-N 0 1 310.441 4.072 20 0 DIADMN CN(Cc1ccc2c(c1)OCO2)Cc1ccc(F)c(C2CC2)c1 ZINC001238512460 1055676611 /nfs/dbraw/zinc/67/66/11/1055676611.db2.gz SLHAJCARGJWNJS-UHFFFAOYSA-N 0 1 313.372 4.064 20 0 DIADMN Cc1cc(C(=O)Nc2ccc3nc(C4CCC4)[nH]c3c2)cs1 ZINC000671680062 1055676907 /nfs/dbraw/zinc/67/69/07/1055676907.db2.gz SSHSLQYANWKZEG-UHFFFAOYSA-N 0 1 311.410 4.453 20 0 DIADMN Cc1cc(CN2C[C@H]3CC[C@@H](C2)C3=O)ccc1Oc1ccccc1 ZINC001238522542 1055678191 /nfs/dbraw/zinc/67/81/91/1055678191.db2.gz FOBOEZHKONUGDL-HDICACEKSA-N 0 1 321.420 4.198 20 0 DIADMN C/C(=C/c1ccccc1)CN(C)C(=O)c1cccc2[nH]c(C)nc21 ZINC000338606201 1055680305 /nfs/dbraw/zinc/68/03/05/1055680305.db2.gz IJDXAGFKYWPKRD-OWBHPGMISA-N 0 1 319.408 4.047 20 0 DIADMN COC[C@H]1CCN1Cc1ccc(Oc2ccc(F)cc2)c(C)c1 ZINC001238527792 1055680197 /nfs/dbraw/zinc/68/01/97/1055680197.db2.gz YHAYUPDFILLWNT-QGZVFWFLSA-N 0 1 315.388 4.147 20 0 DIADMN C/C(=C\c1ccccc1)CN(C)C(=O)c1cccc2[nH]c(C)nc21 ZINC000338606202 1055680770 /nfs/dbraw/zinc/68/07/70/1055680770.db2.gz IJDXAGFKYWPKRD-WYMLVPIESA-N 0 1 319.408 4.047 20 0 DIADMN Cc1cc(CN2CCOC[C@@H]2C)cc(C)c1-c1ccc(F)cc1 ZINC001238547351 1055682631 /nfs/dbraw/zinc/68/26/31/1055682631.db2.gz VURMZPOAHZCCTK-INIZCTEOSA-N 0 1 313.416 4.330 20 0 DIADMN Fc1ccc(CN2CC(c3cccnc3)C2)cc1-c1ccccc1 ZINC001238551197 1055685497 /nfs/dbraw/zinc/68/54/97/1055685497.db2.gz JNYKTFUPEYLXAT-UHFFFAOYSA-N 0 1 318.395 4.487 20 0 DIADMN CC(C)=C[C@@H]1[C@@H](c2nc(-c3ccn4cncc4c3)no2)C1(C)C ZINC000351071925 1055685620 /nfs/dbraw/zinc/68/56/20/1055685620.db2.gz GSAQSOSZXLDPIY-CABCVRRESA-N 0 1 308.385 4.090 20 0 DIADMN COc1cc(C)cc(F)c1CN1C[C@@H]2C[C@H](C1)c1ccccc12 ZINC001238596345 1055693760 /nfs/dbraw/zinc/69/37/60/1055693760.db2.gz VBPFMFPLZHJEJZ-GASCZTMLSA-N 0 1 311.400 4.229 20 0 DIADMN COc1ccccc1[C@@H](C)N(C)Cc1cnc(C2CC2)c(C)c1 ZINC001238628181 1055703617 /nfs/dbraw/zinc/70/36/17/1055703617.db2.gz NQZQFZDBDBLEIM-OAHLLOKOSA-N 0 1 310.441 4.469 20 0 DIADMN FC[C@H]1[C@@H]2CN(Cc3cc(-c4ccccc4)ncc3Cl)C[C@H]12 ZINC001238628321 1055703930 /nfs/dbraw/zinc/70/39/30/1055703930.db2.gz ZJOXDVZPONACMC-PHZGNYQRSA-N 0 1 316.807 4.049 20 0 DIADMN Cc1cc(CN2CCSc3ccccc3C2)cnc1C1CC1 ZINC001238627041 1055704453 /nfs/dbraw/zinc/70/44/53/1055704453.db2.gz ZCJHNWBEVYPMJR-UHFFFAOYSA-N 0 1 310.466 4.375 20 0 DIADMN CCN(Cc1ccccn1)Cc1cc(C)cnc1-c1ccccc1 ZINC001238626314 1055704911 /nfs/dbraw/zinc/70/49/11/1055704911.db2.gz SUEHPXABFKGKNH-UHFFFAOYSA-N 0 1 317.436 4.474 20 0 DIADMN CCN(Cc1ccc2c(c1)OCO2)Cc1cnc(C2CC2)c(C)c1 ZINC001238632899 1055705903 /nfs/dbraw/zinc/70/59/03/1055705903.db2.gz VTHAICIENJDFAY-UHFFFAOYSA-N 0 1 324.424 4.018 20 0 DIADMN FCC1CCN(Cc2cc(-c3ccccc3)cnc2F)CC1 ZINC001238664152 1055711281 /nfs/dbraw/zinc/71/12/81/1055711281.db2.gz PJPVFLZQVZXPRP-UHFFFAOYSA-N 0 1 302.368 4.069 20 0 DIADMN CC(C)(C)CN(Cc1ccccc1)C(=O)c1cccc2[nH]cnc21 ZINC001565670866 1055718024 /nfs/dbraw/zinc/71/80/24/1055718024.db2.gz GSGQVGZJWQZSAW-UHFFFAOYSA-N 0 1 321.424 4.251 20 0 DIADMN CCC[N@H+]1CCCC[C@@H]1C(=O)Nc1ccc(Cl)c(Cl)c1 ZINC001538807182 1055721338 /nfs/dbraw/zinc/72/13/38/1055721338.db2.gz COWMJVMGNPUDGS-CQSZACIVSA-N 0 1 315.244 4.196 20 0 DIADMN CCCN1CCCC[C@@H]1C(=O)Nc1ccc(Cl)c(Cl)c1 ZINC001538807182 1055721349 /nfs/dbraw/zinc/72/13/49/1055721349.db2.gz COWMJVMGNPUDGS-CQSZACIVSA-N 0 1 315.244 4.196 20 0 DIADMN CCOc1cccc(CN2CCC(C)(C)C2)c1Br ZINC001238687992 1055722098 /nfs/dbraw/zinc/72/20/98/1055722098.db2.gz RGLFNSCKMSPFAM-UHFFFAOYSA-N 0 1 312.251 4.080 20 0 DIADMN CSc1cc(C)cc(CN(C)Cc2cccc3c2OCO3)c1 ZINC001238689481 1055722269 /nfs/dbraw/zinc/72/22/69/1055722269.db2.gz JUFCIFNPOVNVLC-UHFFFAOYSA-N 0 1 315.438 4.078 20 0 DIADMN Cc1cc(C=O)c(O)c(C(=O)Nc2ccc(Cl)c(Cl)c2)c1 ZINC001538812794 1055724235 /nfs/dbraw/zinc/72/42/35/1055724235.db2.gz IOVMFVPTYIYJRP-UHFFFAOYSA-N 0 1 324.163 4.072 20 0 DIADMN CCOc1cccc(CN(CC)C(C)C)c1Br ZINC001238691351 1055724369 /nfs/dbraw/zinc/72/43/69/1055724369.db2.gz DZTJEOKFBXKGOR-UHFFFAOYSA-N 0 1 300.240 4.078 20 0 DIADMN CCOc1cccc(CN2CCC3(CCC3)C2)c1Br ZINC001238696981 1055725362 /nfs/dbraw/zinc/72/53/62/1055725362.db2.gz UNZUNZSEODDMJA-UHFFFAOYSA-N 0 1 324.262 4.224 20 0 DIADMN CCOc1cccc(CN(C)CCC2CC2)c1Br ZINC001238696725 1055726830 /nfs/dbraw/zinc/72/68/30/1055726830.db2.gz RUHHASOXCIKNBB-UHFFFAOYSA-N 0 1 312.251 4.080 20 0 DIADMN Cc1ccc(-c2noc([C@H](C)N3CCCCCC3)n2)cc1F ZINC000045840379 1055729857 /nfs/dbraw/zinc/72/98/57/1055729857.db2.gz HPMNBKSPULUCKC-ZDUSSCGKSA-N 0 1 303.381 4.121 20 0 DIADMN CC[C@H]1CCC[C@H](NC(=O)c2cccc3nc(C(F)F)[nH]c32)C1 ZINC001565812410 1055732137 /nfs/dbraw/zinc/73/21/37/1055732137.db2.gz VTPBPOAVYNTFFI-QWRGUYRKSA-N 0 1 321.371 4.199 20 0 DIADMN Cc1nc2ccc(NC(=O)c3cc(C)cc4cn[nH]c43)cc2s1 ZINC000338642226 1055732770 /nfs/dbraw/zinc/73/27/70/1055732770.db2.gz IFGRQQLKFYQGAA-UHFFFAOYSA-N 0 1 322.393 4.042 20 0 DIADMN CCC(CC)[C@H](NC(=O)[C@H]1CCN1C(C)(C)C)c1ccccc1 ZINC001565883946 1055733126 /nfs/dbraw/zinc/73/31/26/1055733126.db2.gz DYWMKQXSOZZYCW-MSOLQXFVSA-N 0 1 316.489 4.153 20 0 DIADMN CCC(CC)[C@@H](NC(=O)[C@H]1CCN1C(C)(C)C)c1ccccc1 ZINC001565883947 1055733764 /nfs/dbraw/zinc/73/37/64/1055733764.db2.gz DYWMKQXSOZZYCW-QZTJIDSGSA-N 0 1 316.489 4.153 20 0 DIADMN COCC[C@@H]1CCCCN1Cc1ccc(C(C)C)nc1Cl ZINC001238727577 1055733881 /nfs/dbraw/zinc/73/38/81/1055733881.db2.gz JYPIMGCLKHROPR-HNNXBMFYSA-N 0 1 310.869 4.249 20 0 DIADMN O=C(c1ccc(Cl)c(O)c1)N1CCC[C@@H]1C1CCCCC1 ZINC001596688494 1055735871 /nfs/dbraw/zinc/73/58/71/1055735871.db2.gz ZRCUKUISIWIULF-OAHLLOKOSA-N 0 1 307.821 4.231 20 0 DIADMN CC(C)c1ccc(CN2CC[C@@H](COCC3CC3)C2)c(Cl)n1 ZINC001238732595 1055736275 /nfs/dbraw/zinc/73/62/75/1055736275.db2.gz ZLKRYKMXVRFOBL-OAHLLOKOSA-N 0 1 322.880 4.107 20 0 DIADMN Cc1cc(CN2CC3(C2)C[C@H](F)CS3)cc(C)c1OC(C)C ZINC001238751619 1055740246 /nfs/dbraw/zinc/74/02/46/1055740246.db2.gz HSJJLYCIKMKVEG-INIZCTEOSA-N 0 1 323.477 4.120 20 0 DIADMN COc1cc(C)c(C)cc1CN1CCC[C@H](C(F)(F)F)C1 ZINC001238764619 1055743656 /nfs/dbraw/zinc/74/36/56/1055743656.db2.gz VYKZVHCEJBXAAB-AWEZNQCLSA-N 0 1 301.352 4.086 20 0 DIADMN CCC(CC)N(C)Cc1ccc(F)c(F)c1Br ZINC001238770723 1055746576 /nfs/dbraw/zinc/74/65/76/1055746576.db2.gz NJRFKCVQNCGEBS-UHFFFAOYSA-N 0 1 306.194 4.348 20 0 DIADMN CC(C)Oc1cc(CN(C)CCCc2ccccc2)c(F)cn1 ZINC001238804773 1055755341 /nfs/dbraw/zinc/75/53/41/1055755341.db2.gz SKSOWPUNGJPGOC-UHFFFAOYSA-N 0 1 316.420 4.073 20 0 DIADMN CC(C)Oc1cc(CN2CCC[C@H]3CCCC[C@@H]32)c(F)cn1 ZINC001238803135 1055755618 /nfs/dbraw/zinc/75/56/18/1055755618.db2.gz YBZSMUXSHQFTCZ-PBHICJAKSA-N 0 1 306.425 4.163 20 0 DIADMN CCCCc1nc2ccc(NC(=O)c3cc4occc4[nH]3)cc2[nH]1 ZINC001566270829 1055758058 /nfs/dbraw/zinc/75/80/58/1055758058.db2.gz HOROXRWSMFWPCB-UHFFFAOYSA-N 0 1 322.368 4.232 20 0 DIADMN CCCC[C@H](CCC)CNC(=O)c1cccc2nc(C)[nH]c21 ZINC001566301790 1055761390 /nfs/dbraw/zinc/76/13/90/1055761390.db2.gz ZQVRTXRWSTZLBK-AWEZNQCLSA-N 0 1 301.434 4.208 20 0 DIADMN Cc1ccc(-c2ccc(C3CC3)cc2)c(CN2CCOCC2)c1 ZINC001238838474 1055761479 /nfs/dbraw/zinc/76/14/79/1055761479.db2.gz TVQWVLNFENJWNU-UHFFFAOYSA-N 0 1 307.437 4.372 20 0 DIADMN Cc1nc2ccc(NC(=O)c3sccc3C(F)F)cc2[nH]1 ZINC001566329763 1055762770 /nfs/dbraw/zinc/76/27/70/1055762770.db2.gz KKXLYBZPGLHFFU-UHFFFAOYSA-N 0 1 307.325 4.123 20 0 DIADMN CSc1ccccc1[C@@H](C)NCc1cnc2ccc(C)cn12 ZINC000282169981 1055766626 /nfs/dbraw/zinc/76/66/26/1055766626.db2.gz YLQUPHHYAMNYCF-CQSZACIVSA-N 0 1 311.454 4.215 20 0 DIADMN Cc1nc2c[nH]cc(-c3ccnc(Oc4ccccc4)c3)c-2n1 ZINC001238853888 1055769291 /nfs/dbraw/zinc/76/92/91/1055769291.db2.gz RILNFPAOADEVMP-UHFFFAOYSA-N 0 1 302.337 4.121 20 0 DIADMN Cc1nc2c(cncc2-c2ccnc(Oc3ccccc3)c2)[nH]1 ZINC001238853888 1055769298 /nfs/dbraw/zinc/76/92/98/1055769298.db2.gz RILNFPAOADEVMP-UHFFFAOYSA-N 0 1 302.337 4.121 20 0 DIADMN C[C@@H]1CC(C)(C)c2cccc(NC(=O)CN3[C@H](C)CC[C@@H]3C)c21 ZINC001597037728 1055778861 /nfs/dbraw/zinc/77/88/61/1055778861.db2.gz WZYUAOAVSFXEKO-KFWWJZLASA-N 0 1 314.473 4.283 20 0 DIADMN COC(=O)c1cc2ccc(-c3csc4ccccc43)[nH]c-2n1 ZINC001238886487 1055779914 /nfs/dbraw/zinc/77/99/14/1055779914.db2.gz LKESKNZHJNIAOJ-UHFFFAOYSA-N 0 1 308.362 4.231 20 0 DIADMN Fc1cccc(F)c1CNCC1(c2c(F)cccc2F)CCC1 ZINC001620972384 1055780931 /nfs/dbraw/zinc/78/09/31/1055780931.db2.gz UZWNCDQUVUKQMV-UHFFFAOYSA-N 0 1 323.333 4.455 20 0 DIADMN CC(C)(C)Cc1csc(NC(=O)c2[nH]cnc2C(C)(C)C)n1 ZINC001566951720 1055789722 /nfs/dbraw/zinc/78/97/22/1055789722.db2.gz UVAQMPHCZJRKGP-UHFFFAOYSA-N 0 1 320.462 4.005 20 0 DIADMN COc1ccccc1-c1nc(CN2C[C@@H](C)C[C@H](C)C2)cs1 ZINC000057831802 1055791137 /nfs/dbraw/zinc/79/11/37/1055791137.db2.gz OLNPMUKKWVOXQO-KBPBESRZSA-N 0 1 316.470 4.297 20 0 DIADMN COc1ccc(C)cc1[C@@H](C)NCc1cccc(OC(F)F)c1 ZINC000057959946 1055793571 /nfs/dbraw/zinc/79/35/71/1055793571.db2.gz GINLXAYUPDKFEP-CYBMUJFWSA-N 0 1 321.367 4.456 20 0 DIADMN C[C@H]([C@H](C)C(=O)Nc1nc2ccc(Cl)cc2[nH]1)C(C)(C)C ZINC001597145508 1055795231 /nfs/dbraw/zinc/79/52/31/1055795231.db2.gz QCNCYJZDFVYPIZ-VHSXEESVSA-N 0 1 307.825 4.473 20 0 DIADMN CCC[C@H]1CCC[C@@H]1C(=O)Nc1nc2ccc(Cl)cc2[nH]1 ZINC001597145129 1055795449 /nfs/dbraw/zinc/79/54/49/1055795449.db2.gz HHZWLKKGVWNWCZ-JQWIXIFHSA-N 0 1 305.809 4.371 20 0 DIADMN O=C(Nc1nc2ccc(Cl)cc2[nH]1)c1ccc(F)c(Cl)c1 ZINC001597145616 1055795642 /nfs/dbraw/zinc/79/56/42/1055795642.db2.gz RJCJGBDZOXXFRM-UHFFFAOYSA-N 0 1 324.142 4.261 20 0 DIADMN CCCCOc1ccc(NC(=O)CN(C)CC(C)(C)C)c(C)c1 ZINC001597223130 1055802573 /nfs/dbraw/zinc/80/25/73/1055802573.db2.gz AZWWVUJRWHQDPA-UHFFFAOYSA-N 0 1 320.477 4.090 20 0 DIADMN CCOC(=O)c1cc2cc(-c3cccc(Cl)c3F)cnc2[nH]1 ZINC001238957833 1055802732 /nfs/dbraw/zinc/80/27/32/1055802732.db2.gz AJFXCQVLYPLSRE-UHFFFAOYSA-N 0 1 318.735 4.199 20 0 DIADMN CCCCOc1ccc(NC(=O)c2c(O)cccc2F)c(C)c1 ZINC001597223262 1055803438 /nfs/dbraw/zinc/80/34/38/1055803438.db2.gz DMEIAUPIDMHTBE-UHFFFAOYSA-N 0 1 317.360 4.271 20 0 DIADMN CCC1CCN(Cc2ccc(Sc3ccccn3)o2)CC1 ZINC001621120579 1055804627 /nfs/dbraw/zinc/80/46/27/1055804627.db2.gz IILMHHJTNWTZIV-UHFFFAOYSA-N 0 1 302.443 4.448 20 0 DIADMN CCCc1nc(CN2CCC[C@@H]2[C@H](CC)c2ccccc2)no1 ZINC000058523761 1055805536 /nfs/dbraw/zinc/80/55/36/1055805536.db2.gz PHOMCZVICUOEQC-IAGOWNOFSA-N 0 1 313.445 4.180 20 0 DIADMN C[C@@H](NCc1ccc(OC(F)F)c(F)c1)c1ccsc1 ZINC000282207921 1055808454 /nfs/dbraw/zinc/80/84/54/1055808454.db2.gz ITSYATGJHFRZQM-SECBINFHSA-N 0 1 301.333 4.339 20 0 DIADMN CC[C@@H]([NH2+][C@H](C)c1cc(Cl)ccc1[O-])c1c(C)noc1C 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CC[C@H](C)N(CC(=O)Nc1cccc(F)c1)Cc1ccccc1 ZINC000060471660 1055837382 /nfs/dbraw/zinc/83/73/82/1055837382.db2.gz XGFRUPMQOQAZTO-HNNXBMFYSA-N 0 1 314.404 4.065 20 0 DIADMN CCC[C@H](CC1CCCCC1)C(=O)NCCN1CC=C(C)CC1 ZINC001568457462 1055837602 /nfs/dbraw/zinc/83/76/02/1055837602.db2.gz ADETZRRDTGPPPA-LJQANCHMSA-N 0 1 320.521 4.141 20 0 DIADMN Cc1nc(CN2CCC(CCc3ccc(C)cc3)CC2)oc1C ZINC000060569363 1055843479 /nfs/dbraw/zinc/84/34/79/1055843479.db2.gz VMOQVVCTRPXTCB-UHFFFAOYSA-N 0 1 312.457 4.445 20 0 DIADMN CCO[C@@H](C)c1nc(CN(C)C2CCC(F)(F)CC2)cs1 ZINC000347575117 1055846024 /nfs/dbraw/zinc/84/60/24/1055846024.db2.gz CPFGYJMGRGKKMR-NSHDSACASA-N 0 1 318.433 4.250 20 0 DIADMN C[C@H](c1ccc(Cl)cc1)N1CCC(Oc2ccccn2)CC1 ZINC000347584114 1055864351 /nfs/dbraw/zinc/86/43/51/1055864351.db2.gz JVDSQHBQMNBEPX-CQSZACIVSA-N 0 1 316.832 4.339 20 0 DIADMN CCCc1[nH]ncc1C(=O)Nc1ccc2c(ccn2CC(C)C)c1 ZINC001597697478 1055865593 /nfs/dbraw/zinc/86/55/93/1055865593.db2.gz AMKZRWKQDOSICE-UHFFFAOYSA-N 0 1 324.428 4.225 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[O-]c1ccc(F)c(-c2cc(C[NH+]3CCCCC3)ccn2)c1Cl ZINC001245829757 1058525271 /nfs/dbraw/zinc/52/52/71/1058525271.db2.gz CABIHSJMAOUSLY-UHFFFAOYSA-N 0 1 320.795 4.233 20 0 DIADMN [O-]c1ccc(F)c(-c2cncc(C[NH+]3CCCCC3)c2)c1Cl ZINC001245832516 1058533074 /nfs/dbraw/zinc/53/30/74/1058533074.db2.gz XVPXWFUGJZGVDO-UHFFFAOYSA-N 0 1 320.795 4.233 20 0 DIADMN CCc1[nH]ncc1C(=O)Nc1ccc2c(c1)C(C)(C)CC2(C)C ZINC001556049924 1058536855 /nfs/dbraw/zinc/53/68/55/1058536855.db2.gz DNZNDUOOPGBCMJ-UHFFFAOYSA-N 0 1 311.429 4.183 20 0 DIADMN CCOc1nccc(-c2cccc(C3=NCCC3)c2)c1Cl ZINC001245847061 1058553569 /nfs/dbraw/zinc/55/35/69/1058553569.db2.gz LGBYFPAAYDPODH-UHFFFAOYSA-N 0 1 300.789 4.384 20 0 DIADMN CC(C)(CC1CCCCCC1)NC(=O)c1cccc2nc[nH]c21 ZINC001556224671 1058561102 /nfs/dbraw/zinc/56/11/02/1058561102.db2.gz IBMMKLGAGLEEAA-UHFFFAOYSA-N 0 1 313.445 4.432 20 0 DIADMN CC[C@@H](C)c1cccc(NC(=O)N2CCN(CC)C[C@@H]2CC)c1 ZINC001563083954 1058564823 /nfs/dbraw/zinc/56/48/23/1058564823.db2.gz SOAZBWTVPCTLFJ-QAPCUYQASA-N 0 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322.383 4.244 20 0 DIADMN CC[C@@H]1CCCN(C(=O)[C@@H](c2ccccc2)N(CC)CC)CC1 ZINC001529204880 1058640609 /nfs/dbraw/zinc/64/06/09/1058640609.db2.gz JEVKUXORTXDOKK-IEBWSBKVSA-N 0 1 316.489 4.108 20 0 DIADMN C[C@@H](c1ccc(Cl)cc1)N1N=C(c2ccccc2N)CC1=O ZINC001245947223 1058641487 /nfs/dbraw/zinc/64/14/87/1058641487.db2.gz UYWJZGYWAVWVHX-NSHDSACASA-N 0 1 313.788 4.101 20 0 DIADMN CCCCN(C(=O)c1cc(CCC)[nH]n1)[C@H]1CCC[C@@H](C)C1 ZINC001556806351 1058646159 /nfs/dbraw/zinc/64/61/59/1058646159.db2.gz JRRJVCIPFQDHJW-ZBFHGGJFSA-N 0 1 305.466 4.183 20 0 DIADMN O=c1cc(CC2CC2)[nH]n1C(c1ccccc1)c1ccccc1 ZINC001245953183 1058649779 /nfs/dbraw/zinc/64/97/79/1058649779.db2.gz LPXIRRCGKVCIPY-UHFFFAOYSA-N 0 1 304.393 4.179 20 0 DIADMN O=C(Nc1ccc(F)c(F)c1O)c1ccc(Cl)c2occc21 ZINC001556934907 1058669300 /nfs/dbraw/zinc/66/93/00/1058669300.db2.gz DCQPJFYVEPGIAD-UHFFFAOYSA-N 0 1 323.682 4.322 20 0 DIADMN Cc1cc2c[nH]nc2c(C(=O)N(C)[C@H]2CCC[C@@H]2C(C)(C)C)c1 ZINC001557081944 1058695423 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CC1(C)C[C@@H](c2ccccc2)N(C(=O)c2cccc(F)c2O)C1 ZINC001529696535 1058800283 /nfs/dbraw/zinc/80/02/83/1058800283.db2.gz UVYXNVBXMFOSRH-INIZCTEOSA-N 0 1 313.372 4.145 20 0 DIADMN CCCCCC[C@](C)(CC)C(=O)N1CCN(C)[C@@H](C(C)C)C1 ZINC001557984444 1058823624 /nfs/dbraw/zinc/82/36/24/1058823624.db2.gz UCLMPRZBSZGXKI-MJGOQNOKSA-N 0 1 310.526 4.172 20 0 DIADMN CC(F)(F)c1c(F)cccc1NC(=O)c1c(O)cccc1F ZINC001558028643 1058829583 /nfs/dbraw/zinc/82/95/83/1058829583.db2.gz ROKQUFTZQPXVQR-UHFFFAOYSA-N 0 1 313.250 4.034 20 0 DIADMN CCCCCCN(C)CC(=O)N(CC)c1ccc(Cl)cc1 ZINC001558493776 1058875351 /nfs/dbraw/zinc/87/53/51/1058875351.db2.gz DVOOORPIWBVFQW-UHFFFAOYSA-N 0 1 310.869 4.205 20 0 DIADMN Cc1cc([C@@H]2CCCCN2C(=O)[C@@H](F)CC2CCCCC2)n[nH]1 ZINC001558569921 1058885361 /nfs/dbraw/zinc/88/53/61/1058885361.db2.gz MRAZBCWMXKKMGL-RDJZCZTQSA-N 0 1 321.440 4.080 20 0 DIADMN Cc1cc([C@H]2CCCCN2C(=O)CCCCC(C)(C)C)n[nH]1 ZINC001558569946 1058886239 /nfs/dbraw/zinc/88/62/39/1058886239.db2.gz NMVUOWGCBDGVOE-MRXNPFEDSA-N 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ZINC001250323482 1060779772 /nfs/dbraw/zinc/77/97/72/1060779772.db2.gz GLXDGCACOGDMEY-UHFFFAOYSA-N 0 1 316.364 4.149 20 0 DIADMN Fc1cccc(-c2ccnc(Nc3ccc4cncn4c3)c2)c1 ZINC001250324392 1060781198 /nfs/dbraw/zinc/78/11/98/1060781198.db2.gz SDKDQNJTANLMIW-UHFFFAOYSA-N 0 1 304.328 4.279 20 0 DIADMN Fc1ccccc1Oc1ncccc1Nc1ccc2cncn2c1 ZINC001250327497 1060781749 /nfs/dbraw/zinc/78/17/49/1060781749.db2.gz ZTLSJSZWELJUIQ-UHFFFAOYSA-N 0 1 320.327 4.404 20 0 DIADMN CC[C@@H]1CN(Cc2cccc(-c3ccccn3)c2)[C@H](CC)CO1 ZINC001560920022 1060782232 /nfs/dbraw/zinc/78/22/32/1060782232.db2.gz UMGSCLITAJMFBL-RTBURBONSA-N 0 1 310.441 4.138 20 0 DIADMN Clc1cc(Cl)c(Nc2ccc3cncn3c2)c(Cl)n1 ZINC001250329741 1060783618 /nfs/dbraw/zinc/78/36/18/1060783618.db2.gz NIFICNOFFFDDED-UHFFFAOYSA-N 0 1 313.575 4.433 20 0 DIADMN C[C@@H](CSc1ccccc1)N(C)Cc1cnn(C2CCC2)c1 ZINC001560920135 1060784063 /nfs/dbraw/zinc/78/40/63/1060784063.db2.gz WTMDSGCVMSBPMS-HNNXBMFYSA-N 0 1 315.486 4.221 20 0 DIADMN COc1ccc(Nc2ccc3cncn3c2)cc1C(F)(F)F ZINC001250328796 1060784384 /nfs/dbraw/zinc/78/43/84/1060784384.db2.gz VWEMWGZHAFVIJD-UHFFFAOYSA-N 0 1 307.275 4.105 20 0 DIADMN COc1cc(C(F)(F)F)ccc1Nc1ccc2cncn2c1 ZINC001250331283 1060784541 /nfs/dbraw/zinc/78/45/41/1060784541.db2.gz LMFLHXOASDRWKF-UHFFFAOYSA-N 0 1 307.275 4.105 20 0 DIADMN Fc1cc(OC(F)(F)F)ccc1Nc1ccc2cncn2c1 ZINC001250331122 1060785010 /nfs/dbraw/zinc/78/50/10/1060785010.db2.gz JTFWSAPUIHKLEI-UHFFFAOYSA-N 0 1 311.238 4.116 20 0 DIADMN CCOC(=O)c1coc2cc(Nc3ccc4cncn4c3)ccc12 ZINC001250334656 1060785963 /nfs/dbraw/zinc/78/59/63/1060785963.db2.gz AIVYTRPEHBZSGS-UHFFFAOYSA-N 0 1 321.336 4.001 20 0 DIADMN COc1cc(C)c(C)cc1N[C@@H](c1nnc[nH]1)C1CCCCC1 ZINC001560930292 1060791782 /nfs/dbraw/zinc/79/17/82/1060791782.db2.gz XOOZIULORYZZOL-QGZVFWFLSA-N 0 1 314.433 4.164 20 0 DIADMN C[C@H]1CN(Cc2cc(O)c(Cl)c(F)c2F)Cc2ccccc21 ZINC001250387546 1060793438 /nfs/dbraw/zinc/79/34/38/1060793438.db2.gz KEJGZQGABIPSNX-JTQLQIEISA-N 0 1 323.770 4.443 20 0 DIADMN Cc1c(Cl)ccc(CN2CC[C@]3(C2)CCCOC3)c1Cl ZINC001560929581 1060793551 /nfs/dbraw/zinc/79/35/51/1060793551.db2.gz DMSRGEHRUUVQGN-INIZCTEOSA-N 0 1 314.256 4.304 20 0 DIADMN CCc1ccc(C)nc1NCc1cc(C(=O)OC)ccc1Cl ZINC001560929896 1060793595 /nfs/dbraw/zinc/79/35/95/1060793595.db2.gz LNDKQGYVAVWJOF-UHFFFAOYSA-N 0 1 318.804 4.005 20 0 DIADMN CN(C/C=C/c1ccccc1)Cc1cc(O)c(Cl)c(F)c1F ZINC001250410492 1060794625 /nfs/dbraw/zinc/79/46/25/1060794625.db2.gz KXFSTYQMNYAIIK-VMPITWQZSA-N 0 1 323.770 4.469 20 0 DIADMN CCOC(=O)C(C)(C)CCC[C@@H](C)NCC(F)(F)C(C)(C)C ZINC001560943527 1060807930 /nfs/dbraw/zinc/80/79/30/1060807930.db2.gz UJSFPXNWTZQDTR-CYBMUJFWSA-N 0 1 321.452 4.406 20 0 DIADMN [O-]c1cc(C[N@@H+]2CCC[C@H]3CCCC[C@@H]32)c(F)c(F)c1Cl ZINC001250409571 1060795970 /nfs/dbraw/zinc/79/59/70/1060795970.db2.gz WOIGAIZHEMIAMJ-PWSUYJOCSA-N 0 1 315.791 4.478 20 0 DIADMN [O-]c1cc(C[N@H+]2CCC[C@H]3CCCC[C@@H]32)c(F)c(F)c1Cl ZINC001250409571 1060795980 /nfs/dbraw/zinc/79/59/80/1060795980.db2.gz WOIGAIZHEMIAMJ-PWSUYJOCSA-N 0 1 315.791 4.478 20 0 DIADMN c1ccc(Oc2ccc3nc(CC4CCOCC4)[nH]c3c2)cc1 ZINC001250431093 1060799923 /nfs/dbraw/zinc/79/99/23/1060799923.db2.gz BVYOEJAGAPVGMF-UHFFFAOYSA-N 0 1 308.381 4.324 20 0 DIADMN FC(F)(F)Oc1cc2[nH]c(C3CCOCC3)nc2cc1Cl ZINC001250433787 1060802705 /nfs/dbraw/zinc/80/27/05/1060802705.db2.gz YKOCEIWVOXJNRQ-UHFFFAOYSA-N 0 1 320.698 4.009 20 0 DIADMN Cc1cc(-c2nc3ccc(Sc4ccccc4)cc3[nH]2)n[nH]1 ZINC001250439042 1060802785 /nfs/dbraw/zinc/80/27/85/1060802785.db2.gz GNNUCPGCPIGUNI-UHFFFAOYSA-N 0 1 306.394 4.413 20 0 DIADMN Cc1ccc(CN2CC[C@@H](Oc3ccccc3)C2)cc1Cl ZINC001560939698 1060803176 /nfs/dbraw/zinc/80/31/76/1060803176.db2.gz NZVPZLLUGCDJCQ-QGZVFWFLSA-N 0 1 301.817 4.302 20 0 DIADMN CCCCn1c2cc(F)ccc2nc1-c1[nH]c(CC)nc1C ZINC001250446539 1060803678 /nfs/dbraw/zinc/80/36/78/1060803678.db2.gz RIMDVYBPRKVYKE-UHFFFAOYSA-N 0 1 300.381 4.236 20 0 DIADMN CCc1nc(C)c(-c2nc3cc(Cl)ccc3n2C2CC2)[nH]1 ZINC001250445998 1060804570 /nfs/dbraw/zinc/80/45/70/1060804570.db2.gz RGYADRFEHGYKHP-UHFFFAOYSA-N 0 1 300.793 4.286 20 0 DIADMN CCc1nc(C)c(-c2nc3ccccc3n2-c2ccccc2)[nH]1 ZINC001250446695 1060806766 /nfs/dbraw/zinc/80/67/66/1060806766.db2.gz WVIKCYGHUNMHSY-UHFFFAOYSA-N 0 1 302.381 4.286 20 0 DIADMN COc1ccccc1-c1nc2cc(F)cc(C(F)(F)F)c2[nH]1 ZINC001250450013 1060807644 /nfs/dbraw/zinc/80/76/44/1060807644.db2.gz FFIKMKHPIIRLOC-UHFFFAOYSA-N 0 1 310.250 4.396 20 0 DIADMN CCc1nc(-c2nc3ccc(-c4ccccc4)cc3[nH]2)c(C)[nH]1 ZINC001250446668 1060807932 /nfs/dbraw/zinc/80/79/32/1060807932.db2.gz VVLXFSOLFAEMOR-UHFFFAOYSA-N 0 1 302.381 4.491 20 0 DIADMN CCOc1ccccc1-c1nc2cc(Cl)c(OC)cc2[nH]1 ZINC001250451996 1060810169 /nfs/dbraw/zinc/81/01/69/1060810169.db2.gz HOVCSRCPJHNCMR-UHFFFAOYSA-N 0 1 302.761 4.291 20 0 DIADMN COc1ccccc1-c1nc2ccc(-c3ccncc3)cc2[nH]1 ZINC001250450829 1060810598 /nfs/dbraw/zinc/81/05/98/1060810598.db2.gz SPHIUQQANPIANM-UHFFFAOYSA-N 0 1 301.349 4.301 20 0 DIADMN COc1nc(C)cc(C)c1CN(C)CCc1cccc(Cl)c1 ZINC001560947842 1060814828 /nfs/dbraw/zinc/81/48/28/1060814828.db2.gz JEEPBLKQYSZHIU-UHFFFAOYSA-N 0 1 318.848 4.035 20 0 DIADMN COc1ccc(O)c(-c2nc3cc(C)c(C(F)(F)F)cc3[nH]2)c1 ZINC001250458102 1060815145 /nfs/dbraw/zinc/81/51/45/1060815145.db2.gz OCQUMKKNGJLUBZ-UHFFFAOYSA-N 0 1 322.286 4.271 20 0 DIADMN CN(c1ccccc1)[C@@H]1CCN(Cc2cc(F)cc(Cl)c2)C1 ZINC001560950568 1060816132 /nfs/dbraw/zinc/81/61/32/1060816132.db2.gz GSADRVZZJFPCAK-GOSISDBHSA-N 0 1 318.823 4.190 20 0 DIADMN Cc1ccc(-c2nc3cc(F)c(-n4ccnc4)cc3[nH]2)c(C)c1 ZINC001250458734 1060816866 /nfs/dbraw/zinc/81/68/66/1060816866.db2.gz HGOOVZLJKQCTQP-UHFFFAOYSA-N 0 1 306.344 4.172 20 0 DIADMN COc1cc(C)c(-c2nc3ccc4ncccc4c3[nH]2)cc1C ZINC001250459295 1060819504 /nfs/dbraw/zinc/81/95/04/1060819504.db2.gz QBSIIIBJFRECAP-UHFFFAOYSA-N 0 1 303.365 4.404 20 0 DIADMN CC(=O)Nc1ccc2nc(-c3ccc(Cl)c(Cl)c3)[nH]c2c1 ZINC001250462811 1060819540 /nfs/dbraw/zinc/81/95/40/1060819540.db2.gz OWEZMOIUZFETAX-UHFFFAOYSA-N 0 1 320.179 4.495 20 0 DIADMN Cc1nn(-c2ccccc2Cl)cc1CN1CCC(C)(F)CC1 ZINC001560954013 1060820156 /nfs/dbraw/zinc/82/01/56/1060820156.db2.gz DKZXIOIQZAZRTB-UHFFFAOYSA-N 0 1 321.827 4.158 20 0 DIADMN COc1ccc(-c2nc3cc(Cl)c(OC)cc3[nH]2)cc1F ZINC001250463399 1060822690 /nfs/dbraw/zinc/82/26/90/1060822690.db2.gz NDXXQIKFJWTIGV-UHFFFAOYSA-N 0 1 306.724 4.040 20 0 DIADMN COC(=O)c1oc(CN[C@H](c2cccc(C)c2)C(C)C)cc1C ZINC001560963477 1060826837 /nfs/dbraw/zinc/82/68/37/1060826837.db2.gz SDKZWRVSXVKYIX-KRWDZBQOSA-N 0 1 315.413 4.170 20 0 DIADMN CCCCOc1ccc(-c2nc3ccc(NC(C)=O)cc3[nH]2)cc1 ZINC001250471522 1060829905 /nfs/dbraw/zinc/82/99/05/1060829905.db2.gz NJOLKABJMUCJCV-UHFFFAOYSA-N 0 1 323.396 4.367 20 0 DIADMN c1ccc2c(c1)nccc2-c1nc2ccc(N3CCCC3)cc2[nH]1 ZINC001250477317 1060832443 /nfs/dbraw/zinc/83/24/43/1060832443.db2.gz DBXILQZJEJZHLV-UHFFFAOYSA-N 0 1 314.392 4.378 20 0 DIADMN COc1cc(CN2CCCC[C@@H](F)C2)cc2c1NC(C)(C)C=C2 ZINC001250478850 1060834800 /nfs/dbraw/zinc/83/48/00/1060834800.db2.gz YAUHVVWDBXRHPF-MRXNPFEDSA-N 0 1 318.436 4.237 20 0 DIADMN CSc1ccc(-c2nc3cc(F)c(-n4ccnc4)cc3[nH]2)cc1 ZINC001250479300 1060835578 /nfs/dbraw/zinc/83/55/78/1060835578.db2.gz GOAHEOPLLYHUGK-UHFFFAOYSA-N 0 1 324.384 4.277 20 0 DIADMN CCOc1cc(-c2nc3c(cc(F)cc3C)[nH]2)ccc1OC ZINC001250480124 1060835809 /nfs/dbraw/zinc/83/58/09/1060835809.db2.gz DSCKVNLGZWMRKS-UHFFFAOYSA-N 0 1 300.333 4.085 20 0 DIADMN C[C@@H](CC1CCCCC1)CN1Cc2ccccc2NC(=O)[C@H]1C ZINC001560975152 1060840642 /nfs/dbraw/zinc/84/06/42/1060840642.db2.gz VCGVODKRGAGLNP-JKSUJKDBSA-N 0 1 314.473 4.436 20 0 DIADMN C[C@@H](CC1CCCCC1)CN1Cc2ccccc2NC(=O)[C@@H]1C ZINC001560975150 1060841085 /nfs/dbraw/zinc/84/10/85/1060841085.db2.gz VCGVODKRGAGLNP-HOTGVXAUSA-N 0 1 314.473 4.436 20 0 DIADMN CC[C@@H]1CCC[C@H](CN2Cc3cccnc3N3CCC[C@H]3C2)C1 ZINC001560977977 1060843222 /nfs/dbraw/zinc/84/32/22/1060843222.db2.gz MMUGPKMPXFRBNH-AOIWGVFYSA-N 0 1 313.489 4.082 20 0 DIADMN Fc1cc2nc(-c3ccc(Cl)s3)[nH]c2cc1-n1cccn1 ZINC001250491013 1060844689 /nfs/dbraw/zinc/84/46/89/1060844689.db2.gz TVYDIRNASIQTMS-UHFFFAOYSA-N 0 1 318.764 4.270 20 0 DIADMN CC(=O)n1cc(-c2nc3cc(C)c(F)cc3[nH]2)c2ccccc21 ZINC001250492491 1060847787 /nfs/dbraw/zinc/84/77/87/1060847787.db2.gz XJCZJUKSCRTCFE-UHFFFAOYSA-N 0 1 307.328 4.292 20 0 DIADMN FC[C@H]1CCCN(Cc2ccc(Oc3ccc(F)cc3)nc2)C1 ZINC001560985308 1060849814 /nfs/dbraw/zinc/84/98/14/1060849814.db2.gz WKTXILBQKKQHCN-CQSZACIVSA-N 0 1 318.367 4.195 20 0 DIADMN Clc1cc2nc(-c3nc4ccccc4[nH]3)[nH]c2c(Cl)c1 ZINC001250500791 1060853329 /nfs/dbraw/zinc/85/33/29/1060853329.db2.gz LTNIVMDQNWKNST-UHFFFAOYSA-N 0 1 303.152 4.413 20 0 DIADMN Cc1cc2nc(-c3nc4ccccc4[nH]3)[nH]c2cc1C(F)(F)F ZINC001250501094 1060855765 /nfs/dbraw/zinc/85/57/65/1060855765.db2.gz WOWUWJOOIFRYKN-UHFFFAOYSA-N 0 1 316.286 4.433 20 0 DIADMN Cc1csc2nc(C)c(CN3Cc4ccccc4[C@@H](C)C3)n12 ZINC001560996860 1060856218 /nfs/dbraw/zinc/85/62/18/1060856218.db2.gz DQJZGSDUNRCNTL-LBPRGKRZSA-N 0 1 311.454 4.132 20 0 DIADMN C[C@H](CN(C)Cc1nc(Br)cs1)C(C)(C)C ZINC001560998609 1060859060 /nfs/dbraw/zinc/85/90/60/1060859060.db2.gz BRADUHHKOCMMQU-SECBINFHSA-N 0 1 305.285 4.020 20 0 DIADMN CSc1ccc2nc(-c3cncc(Br)c3)[nH]c2c1 ZINC001250510849 1060863285 /nfs/dbraw/zinc/86/32/85/1060863285.db2.gz WTXJVNQEGQLQDB-UHFFFAOYSA-N 0 1 320.215 4.109 20 0 DIADMN COc1ncccc1-c1nc2ccc(Oc3ccccc3)cc2[nH]1 ZINC001250517471 1060866882 /nfs/dbraw/zinc/86/68/82/1060866882.db2.gz XMUUZMVKBMEINO-UHFFFAOYSA-N 0 1 317.348 4.426 20 0 DIADMN Cc1cc(-c2nc3cc(C(F)(F)F)c(Cl)cc3[nH]2)no1 ZINC001250520597 1060867398 /nfs/dbraw/zinc/86/73/98/1060867398.db2.gz SYSYBECMOFBIQM-UHFFFAOYSA-N 0 1 301.655 4.199 20 0 DIADMN COc1cccc(CN2CC3(C2)CCCCC3)c1OCC1CC1 ZINC001250527658 1060874658 /nfs/dbraw/zinc/87/46/58/1060874658.db2.gz KEDJUWNQLQCEEO-UHFFFAOYSA-N 0 1 315.457 4.250 20 0 DIADMN Cc1noc(C)c1-c1nc2ccc(OCc3ccccc3)cc2[nH]1 ZINC001250531110 1060878608 /nfs/dbraw/zinc/87/86/08/1060878608.db2.gz GOVDPERHUGYIBR-UHFFFAOYSA-N 0 1 319.364 4.414 20 0 DIADMN Fc1cnc(-c2nc3cc(F)cc(C(F)(F)F)c3[nH]2)c(F)c1 ZINC001250531785 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20 0 DIADMN CC[C@@H]1CO[C@H](C)CN1CCCOc1cccc(C(C)(C)C)c1 ZINC001459309059 1062075680 /nfs/dbraw/zinc/07/56/80/1062075680.db2.gz DMXQJWPHNUTAPB-SJLPKXTDSA-N 0 1 319.489 4.252 20 0 DIADMN Oc1ccc(Cl)cc1-c1nnc(Cc2ccccc2Cl)o1 ZINC001254335791 1062077777 /nfs/dbraw/zinc/07/77/77/1062077777.db2.gz JOQFRLQXLORPFW-UHFFFAOYSA-N 0 1 321.163 4.340 20 0 DIADMN Cc1ccc2cc(-c3nnc(Cc4ccccc4Cl)o3)[nH]c2n1 ZINC001254346498 1062080846 /nfs/dbraw/zinc/08/08/46/1062080846.db2.gz RTDKKDUMXJMUBF-UHFFFAOYSA-N 0 1 324.771 4.166 20 0 DIADMN Cc1ccc2nc(-c3nnc(Cc4ccccc4Cl)o3)[nH]c2c1 ZINC001254341583 1062081629 /nfs/dbraw/zinc/08/16/29/1062081629.db2.gz IXFCEHXMUGIHIK-UHFFFAOYSA-N 0 1 324.771 4.166 20 0 DIADMN Fc1cccc(CN(C2CC2)C2CCCC2)c1Br ZINC001474415540 1062082547 /nfs/dbraw/zinc/08/25/47/1062082547.db2.gz VYVQJBBELYROQM-UHFFFAOYSA-N 0 1 312.226 4.495 20 0 DIADMN Cc1cc(F)ncc1CN(Cc1ccc(Cl)cc1)C1CC1 ZINC001474415096 1062084207 /nfs/dbraw/zinc/08/42/07/1062084207.db2.gz SABXXPLWTJHSMI-UHFFFAOYSA-N 0 1 304.796 4.347 20 0 DIADMN COC1(CN(Cc2ccc(F)cc2F)C2CC2)CCCCC1 ZINC001474415295 1062086120 /nfs/dbraw/zinc/08/61/20/1062086120.db2.gz WOTJBEAUYIJNDW-UHFFFAOYSA-N 0 1 309.400 4.279 20 0 DIADMN Oc1cccc(Cl)c1-c1nnc(Cc2ccccc2Cl)o1 ZINC001254398353 1062093871 /nfs/dbraw/zinc/09/38/71/1062093871.db2.gz PUNFNKMMBODHSV-UHFFFAOYSA-N 0 1 321.163 4.340 20 0 DIADMN Cc1oc2ccc(NC(=O)c3[nH]cnc3C(C)(C)C)cc2c1C ZINC001467271717 1062099388 /nfs/dbraw/zinc/09/93/88/1062099388.db2.gz CRWKUMOPWZXIFP-UHFFFAOYSA-N 0 1 311.385 4.323 20 0 DIADMN CC(C)[C@@H](O)CCN(Cc1ccccc1)Cc1ccccc1F ZINC001459364615 1062114390 /nfs/dbraw/zinc/11/43/90/1062114390.db2.gz VMNGGRGWAOWYNM-FQEVSTJZSA-N 0 1 315.432 4.235 20 0 DIADMN C[C@@H](CN1Cc2ccccc2OC[C@@H]1C)c1cc(F)cc(F)c1 ZINC001474437686 1062114526 /nfs/dbraw/zinc/11/45/26/1062114526.db2.gz MUFYURQIGVUMQW-KBPBESRZSA-N 0 1 317.379 4.351 20 0 DIADMN COc1cc(CN2CCSCC[C@@H]2C)cc(C(F)(F)F)c1 ZINC001474443069 1062120892 /nfs/dbraw/zinc/12/08/92/1062120892.db2.gz PVEIBFUSHCZXAD-NSHDSACASA-N 0 1 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Cc1nc2cc(-c3nnc([C@@H]4C[C@@H]4c4ccccc4)o3)ccc2[nH]1 ZINC001254528311 1062161112 /nfs/dbraw/zinc/16/11/12/1062161112.db2.gz OFPAPEJCEUULBX-HUUCEWRRSA-N 0 1 316.364 4.192 20 0 DIADMN CCCCCC[N@@H+](C)CC(=O)NCC[C@H]1C[C@H](C)CC(C)(C)C1 ZINC001467635900 1062168162 /nfs/dbraw/zinc/16/81/62/1062168162.db2.gz JDPHJAABKRWMQK-ROUUACIJSA-N 0 1 324.553 4.467 20 0 DIADMN Cc1cc(C(F)(F)F)ccc1CN1CCO[C@@H](C(C)(C)C)C1 ZINC001474492531 1062169133 /nfs/dbraw/zinc/16/91/33/1062169133.db2.gz XWIGBLFISPGZQX-OAHLLOKOSA-N 0 1 315.379 4.261 20 0 DIADMN CC[C@@H]1c2ccccc2CCN1C[C@H]1CC[C@H](C(F)(F)F)O1 ZINC001459505196 1062171702 /nfs/dbraw/zinc/17/17/02/1062171702.db2.gz BWAICQWFXKKEOT-FVQBIDKESA-N 0 1 313.363 4.106 20 0 DIADMN CCCCCC[C@H](O)CN1C[C@@H](c2ccccc2C)OC[C@H]1C ZINC001459518156 1062179092 /nfs/dbraw/zinc/17/90/92/1062179092.db2.gz MMMADSBFZQCSNI-HBFSDRIKSA-N 0 1 319.489 4.088 20 0 DIADMN C[C@@H](c1ccc(F)nc1)N1CCC(c2ccccc2F)CC1 ZINC001459530740 1062189874 /nfs/dbraw/zinc/18/98/74/1062189874.db2.gz 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303.425 4.206 20 0 DIADMN CCn1c2cccc(F)c2nc1CN1C[C@H](C)CCC[C@@H]1C ZINC001473174094 1063480466 /nfs/dbraw/zinc/48/04/66/1063480466.db2.gz QWAOADPIDSNOFA-KGLIPLIRSA-N 0 1 303.425 4.206 20 0 DIADMN CC(C)C[C@H](C)C[C@@H](C)NCc1nnc(-c2ccccc2)o1 ZINC001258050862 1063481241 /nfs/dbraw/zinc/48/12/41/1063481241.db2.gz GYDZTKGPOGYMCG-LSDHHAIUSA-N 0 1 301.434 4.287 20 0 DIADMN Cc1cnn(-c2ccncc2NCc2ccc(C(C)(C)C)cc2)c1 ZINC001461411032 1063481076 /nfs/dbraw/zinc/48/10/76/1063481076.db2.gz XOZHYMGKTVMDGO-UHFFFAOYSA-N 0 1 320.440 4.485 20 0 DIADMN CSc1ncc(Cl)c(CN[C@H](C)C[C@@H](C)CC(C)C)n1 ZINC001258056491 1063487794 /nfs/dbraw/zinc/48/77/94/1063487794.db2.gz ADIJSUAIDWDZGR-NWDGAFQWSA-N 0 1 315.914 4.402 20 0 DIADMN CSc1ncc(Cl)c(CN[C@H](C)C[C@H](C)CC(C)C)n1 ZINC001258056493 1063487938 /nfs/dbraw/zinc/48/79/38/1063487938.db2.gz ADIJSUAIDWDZGR-VXGBXAGGSA-N 0 1 315.914 4.402 20 0 DIADMN C[C@@H]1C[C@H](C)CN1Cc1cc(Br)ccc1Cl ZINC001473183187 1063489164 /nfs/dbraw/zinc/48/91/64/1063489164.db2.gz TZFMSKYHZKGHRU-VHSXEESVSA-N 0 1 302.643 4.333 20 0 DIADMN CSc1ncc2c(n1)CN([C@@H](C)C[C@H](C)CC(C)C)CC2 ZINC001258075216 1063502868 /nfs/dbraw/zinc/50/28/68/1063502868.db2.gz SMULQWUTGCNLSG-KGLIPLIRSA-N 0 1 307.507 4.017 20 0 DIADMN C[C@H](NCc1ccc2ccc(F)c(F)c2n1)c1cccs1 ZINC001461439166 1063504921 /nfs/dbraw/zinc/50/49/21/1063504921.db2.gz UDHUGJPRAVZTHH-JTQLQIEISA-N 0 1 304.365 4.425 20 0 DIADMN CCc1cccc(CNCc2ccc(F)cc2Br)c1 ZINC001461449526 1063512484 /nfs/dbraw/zinc/51/24/84/1063512484.db2.gz MWQCXDQXJUXUAC-UHFFFAOYSA-N 0 1 322.221 4.440 20 0 DIADMN CC(C)=CCC[C@@H](C)N1CCCn2cnc(COC(C)C)c2C1 ZINC001258094677 1063513535 /nfs/dbraw/zinc/51/35/35/1063513535.db2.gz RBQUWDYGYYSIBU-QGZVFWFLSA-N 0 1 319.493 4.149 20 0 DIADMN COc1cc(C)ccc1CNc1ccc(Cl)c(CN(C)C)c1 ZINC001461462007 1063522740 /nfs/dbraw/zinc/52/27/40/1063522740.db2.gz JDLCXXPFKGGYPW-UHFFFAOYSA-N 0 1 318.848 4.331 20 0 DIADMN CC(C)(NCc1cc2c(cc[nH]c2=O)o1)c1ccc(Cl)cc1 ZINC001461501481 1063540513 /nfs/dbraw/zinc/54/05/13/1063540513.db2.gz IIKGBQXITACECU-UHFFFAOYSA-N 0 1 316.788 4.212 20 0 DIADMN C[C@H](Cc1ccco1)NCc1ncc(C(F)(F)F)cc1Cl ZINC001258176372 1063546183 /nfs/dbraw/zinc/54/61/83/1063546183.db2.gz SGTKHRSHFJUHKT-SECBINFHSA-N 0 1 318.726 4.068 20 0 DIADMN Cc1n[nH]c2ccc(-c3nnc(-c4ccc5c(c4)CCC5)o3)cc12 ZINC001258183320 1063551394 /nfs/dbraw/zinc/55/13/94/1063551394.db2.gz CUOMBQXHAAXDSW-UHFFFAOYSA-N 0 1 316.364 4.077 20 0 DIADMN C[C@@H](Cc1ccco1)N1CCc2c(cccc2C(F)(F)F)C1 ZINC001258194688 1063553534 /nfs/dbraw/zinc/55/35/34/1063553534.db2.gz JTIUCEIYZNKMSN-LBPRGKRZSA-N 0 1 309.331 4.288 20 0 DIADMN CC1(C)Cc2cc(CNc3cc4c(cn3)CCCC4)ccc2O1 ZINC001461537334 1063567022 /nfs/dbraw/zinc/56/70/22/1063567022.db2.gz DYJONLGDMYCHOZ-UHFFFAOYSA-N 0 1 308.425 4.286 20 0 DIADMN FC(F)Oc1cccc(CNc2cc3c(cn2)CCCC3)c1 ZINC001461540936 1063568562 /nfs/dbraw/zinc/56/85/62/1063568562.db2.gz PQYYIXBCPSWUGK-UHFFFAOYSA-N 0 1 304.340 4.174 20 0 DIADMN Brc1cnc2c(c1)CN(C1CCCCCCC1)CC2 ZINC001258240552 1063577362 /nfs/dbraw/zinc/57/73/62/1063577362.db2.gz PCGCDXYBNDYMCN-UHFFFAOYSA-N 0 1 323.278 4.315 20 0 DIADMN CC(C)(C)c1coc(CN[C@](C)(Cc2ccccc2)C2CC2)n1 ZINC001461582898 1063592870 /nfs/dbraw/zinc/59/28/70/1063592870.db2.gz OEBKRCNLBQHJHA-HXUWFJFHSA-N 0 1 312.457 4.473 20 0 DIADMN CC1(C)CCC[C@@H](N2CCO[C@H](c3ccc(F)c(F)c3)C2)C1 ZINC001258295363 1063593281 /nfs/dbraw/zinc/59/32/81/1063593281.db2.gz YVUSNMVDMLRISV-PBHICJAKSA-N 0 1 309.400 4.307 20 0 DIADMN CC1(C)CCC[C@H](N2CCc3c([nH]nc3C(F)(F)F)C2)C1 ZINC001258295218 1063594051 /nfs/dbraw/zinc/59/40/51/1063594051.db2.gz YHNBSPVEGLAPPA-GXFFZTMASA-N 0 1 301.356 4.312 20 0 DIADMN C[C@H](CC(C)(C)SCc1ccco1)N1CC2(C1)CCCCO2 ZINC001258304939 1063601292 /nfs/dbraw/zinc/60/12/92/1063601292.db2.gz JMYKDEGZMQTKQI-OAHLLOKOSA-N 0 1 323.502 4.325 20 0 DIADMN C[C@H](CC(C)(C)SCc1ccco1)N1CCn2cccc2C1 ZINC001258314051 1063605367 /nfs/dbraw/zinc/60/53/67/1063605367.db2.gz OYKOBVPVIBTOMZ-OAHLLOKOSA-N 0 1 318.486 4.387 20 0 DIADMN CCCOC1CN([C@H](C)CC(C)(C)SCc2ccco2)C1 ZINC001258314232 1063606602 /nfs/dbraw/zinc/60/66/02/1063606602.db2.gz RQLNQYLBVJBPCE-CQSZACIVSA-N 0 1 311.491 4.181 20 0 DIADMN C[C@H](Oc1ccnc(NCc2ccncc2)c1)c1ccccc1 ZINC001461617337 1063615611 /nfs/dbraw/zinc/61/56/11/1063615611.db2.gz XYBJCRCMISHDGZ-HNNXBMFYSA-N 0 1 305.381 4.229 20 0 DIADMN CC[C@@H](OCCNCc1ccc(F)cc1F)c1ccccc1 ZINC001461622998 1063621894 /nfs/dbraw/zinc/62/18/94/1063621894.db2.gz JYKKGFYPDMGLCA-GOSISDBHSA-N 0 1 305.368 4.222 20 0 DIADMN CCCOc1ccc(CNc2nc(C)ccc2CC)cc1OC ZINC001461632831 1063625916 /nfs/dbraw/zinc/62/59/16/1063625916.db2.gz NJPBCYGUKZUSCG-UHFFFAOYSA-N 0 1 314.429 4.362 20 0 DIADMN CCCCC(CCCC)N1Cc2c(cnn2C)[C@H](COCC)C1 ZINC001258385051 1063629264 /nfs/dbraw/zinc/62/92/64/1063629264.db2.gz PEIKCPVKALKTDI-INIZCTEOSA-N 0 1 321.509 4.105 20 0 DIADMN CC(C)(C)O[C@@H]1C[C@H]([NH2+]Cc2cccc([O-])c2Cl)C12CCC2 ZINC001461645549 1063632828 /nfs/dbraw/zinc/63/28/28/1063632828.db2.gz LUDXCNWSPTYWEP-LSDHHAIUSA-N 0 1 323.864 4.262 20 0 DIADMN CCCCC(CCCC)N1CCc2nc(C3CC3)ncc2C1 ZINC001258389520 1063633728 /nfs/dbraw/zinc/63/37/28/1063633728.db2.gz WKEWRJVEIRUCPV-UHFFFAOYSA-N 0 1 301.478 4.461 20 0 DIADMN Cc1ccccc1Cc1nnc(-c2cc(-c3cccs3)n[nH]2)o1 ZINC001258429359 1063648044 /nfs/dbraw/zinc/64/80/44/1063648044.db2.gz HXUKQPYVTKJPHT-UHFFFAOYSA-N 0 1 322.393 4.087 20 0 DIADMN Cc1ccccc1Cc1nnc(-c2cn[nH]c2-c2ccccc2)o1 ZINC001258435614 1063652353 /nfs/dbraw/zinc/65/23/53/1063652353.db2.gz JNXSLOUAPWRKRI-UHFFFAOYSA-N 0 1 316.364 4.026 20 0 DIADMN Cc1cc(CNCc2ccnc(-c3ccccc3)c2)cnc1Cl ZINC001461676488 1063652957 /nfs/dbraw/zinc/65/29/57/1063652957.db2.gz OUENGKVCFCRCKI-UHFFFAOYSA-N 0 1 323.827 4.395 20 0 DIADMN CCCCC[C@H](CC)N1Cc2cnn(CC)c2[C@H](COCC)C1 ZINC001258438432 1063653807 /nfs/dbraw/zinc/65/38/07/1063653807.db2.gz CSWFJMNTTBFZJR-ROUUACIJSA-N 0 1 321.509 4.198 20 0 DIADMN CCCCC[C@H](CC)N1Cc2c(cnn2CC)[C@@H](COCC)C1 ZINC001258439353 1063654227 /nfs/dbraw/zinc/65/42/27/1063654227.db2.gz ITLIPNHXLFAGBG-SJORKVTESA-N 0 1 321.509 4.198 20 0 DIADMN CC[C@](C)(NCc1nn(C)c2ccccc12)c1ccc(F)cc1 ZINC001461682494 1063654881 /nfs/dbraw/zinc/65/48/81/1063654881.db2.gz HAARRQFOAWNBGQ-IBGZPJMESA-N 0 1 311.404 4.127 20 0 DIADMN Cc1ccncc1CN[C@H](CCc1ccccc1)c1ccccn1 ZINC001461696447 1063662526 /nfs/dbraw/zinc/66/25/26/1063662526.db2.gz ATJZJZVIAINUQW-OAQYLSRUSA-N 0 1 317.436 4.249 20 0 DIADMN CCOC(=O)CC[C@@H](C)N1CCC[C@H]1c1ccc(Cl)s1 ZINC001258495337 1063673833 /nfs/dbraw/zinc/67/38/33/1063673833.db2.gz HVWWRNCBXTXMLC-NEPJUHHUSA-N 0 1 315.866 4.270 20 0 DIADMN CNc1ccccc1CNCc1ccc(Cl)cc1OC(C)C ZINC001461723128 1063677417 /nfs/dbraw/zinc/67/74/17/1063677417.db2.gz RPDNZLHDNCLTLY-UHFFFAOYSA-N 0 1 318.848 4.459 20 0 DIADMN C[C@@H](NC1CCN(c2ccccc2Cl)CC1)c1cscn1 ZINC001258535218 1063687675 /nfs/dbraw/zinc/68/76/75/1063687675.db2.gz DJOKNBXBAZJADJ-GFCCVEGCSA-N 0 1 321.877 4.116 20 0 DIADMN C[C@H](C(=O)Nc1ccc2nc(-c3ccc(F)cc3)[nH]c2c1)C1CC1 ZINC001515569229 1063689106 /nfs/dbraw/zinc/68/91/06/1063689106.db2.gz GKCVEFZLYURVEC-NSHDSACASA-N 0 1 323.371 4.354 20 0 DIADMN Cc1ccc(C(=O)Nc2nc3cc(Cl)c(F)cc3[nH]2)cc1C ZINC001461750609 1063695726 /nfs/dbraw/zinc/69/57/26/1063695726.db2.gz VBZKVQZTLXQMHZ-UHFFFAOYSA-N 0 1 317.751 4.225 20 0 DIADMN O=C(C=C1CCCCC1)Nc1nc2cc(Cl)c(F)cc2[nH]1 ZINC001461750536 1063695905 /nfs/dbraw/zinc/69/59/05/1063695905.db2.gz USFZLBIFXNODOX-UHFFFAOYSA-N 0 1 307.756 4.184 20 0 DIADMN CC1(C)Cc2cc(CNCc3cscc3Cl)ccc2O1 ZINC001461757409 1063699717 /nfs/dbraw/zinc/69/97/17/1063699717.db2.gz ZNZAIBMKPYJEAA-UHFFFAOYSA-N 0 1 307.846 4.405 20 0 DIADMN Cc1[nH]ncc1CNc1cccc(C)c1OCc1ccccc1 ZINC001461782787 1063714580 /nfs/dbraw/zinc/71/45/80/1063714580.db2.gz NHTBLFOUKLNTCA-UHFFFAOYSA-N 0 1 307.397 4.218 20 0 DIADMN C[C@@H]1CC(C)(C)CC[C@H]1NC(=O)c1n[nH]c2ccc(Cl)cc21 ZINC001516036368 1063717824 /nfs/dbraw/zinc/71/78/24/1063717824.db2.gz GUGGHWBBFCUGSF-ZWNOBZJWSA-N 0 1 319.836 4.161 20 0 DIADMN Fc1cccc(CN[C@@H](Cc2ccccc2)c2ccccn2)c1 ZINC001461806688 1063726087 /nfs/dbraw/zinc/72/60/87/1063726087.db2.gz LWEDOOQBQCLRQF-FQEVSTJZSA-N 0 1 306.384 4.294 20 0 DIADMN [O-]c1cccc(C[NH2+]C[C@@H]2C[C@H]2Cc2ccccc2)c1Cl ZINC001461820053 1063736048 /nfs/dbraw/zinc/73/60/48/1063736048.db2.gz KFBKLXPNSMLKTC-CVEARBPZSA-N 0 1 301.817 4.014 20 0 DIADMN CCCCC[C@@H](CCC)N1Cc2ccnn2C[C@H](COCC)C1 ZINC001258672210 1063740827 /nfs/dbraw/zinc/74/08/27/1063740827.db2.gz WEOSJOPRNHQKST-QZTJIDSGSA-N 0 1 321.509 4.100 20 0 DIADMN COc1ccc([C@H]2CCCN2Cc2cccn2C(F)F)cc1 ZINC001461839559 1063744068 /nfs/dbraw/zinc/74/40/68/1063744068.db2.gz VUWHOALMTTZSGM-MRXNPFEDSA-N 0 1 306.356 4.229 20 0 DIADMN C[C@@H]1c2ccccc2CCN1Cc1cn(C)nc1C1CCCC1 ZINC001461842631 1063746255 /nfs/dbraw/zinc/74/62/55/1063746255.db2.gz KOTDBMXSSZGNTL-OAHLLOKOSA-N 0 1 309.457 4.197 20 0 DIADMN C[C@@H](Cc1ccc(Cl)cc1Cl)N1CCc2cccnc2C1 ZINC001258683797 1063748986 /nfs/dbraw/zinc/74/89/86/1063748986.db2.gz HGCOJLJMOPQSLF-LBPRGKRZSA-N 0 1 321.251 4.378 20 0 DIADMN Cc1cc(F)ncc1CN1C[C@@H](C)C[C@@H]1c1ccccc1F 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Cc1cc(CN(Cc2ccccc2F)C2CCCCC2)ncn1 ZINC000428235470 338043546 /nfs/dbraw/zinc/04/35/46/338043546.db2.gz BKQBZOLRKYIGKK-UHFFFAOYSA-N 0 1 313.420 4.259 20 0 DIADMN Cc1ccc([C@H]2CCC[C@@H]2N(C)Cc2nnc(C(C)C)[nH]2)cc1 ZINC000428236768 338043591 /nfs/dbraw/zinc/04/35/91/338043591.db2.gz GVWCBJBWIYLFJY-SJORKVTESA-N 0 1 312.461 4.005 20 0 DIADMN Cc1ccc([C@H]2CCC[C@H]2N(C)Cc2nnc(C(C)C)[nH]2)cc1 ZINC000428236766 338043655 /nfs/dbraw/zinc/04/36/55/338043655.db2.gz GVWCBJBWIYLFJY-IAGOWNOFSA-N 0 1 312.461 4.005 20 0 DIADMN CCOc1ccc(C2=CCN([C@@H](C)c3cnc(C)cn3)CC2)cc1 ZINC000428282772 338045415 /nfs/dbraw/zinc/04/54/15/338045415.db2.gz GGZLJWUSZUSNKW-INIZCTEOSA-N 0 1 323.440 4.034 20 0 DIADMN CCc1nc(C)c(CN[C@H](C)c2ccc(-c3cccnc3)cc2)o1 ZINC000428352479 338048548 /nfs/dbraw/zinc/04/85/48/338048548.db2.gz QFJHASKVTKGAPX-CQSZACIVSA-N 0 1 321.424 4.458 20 0 DIADMN Cc1cc2[nH]c(CN3CCC[C@@H](OCC4CC4)C3)cc2c(C)c1 ZINC000428396938 338050151 /nfs/dbraw/zinc/05/01/51/338050151.db2.gz IOOUULSKXJGNOY-GOSISDBHSA-N 0 1 312.457 4.176 20 0 DIADMN CC(C)(O)CN(Cc1cc(C(F)(F)F)ccc1Cl)C1CC1 ZINC000428411486 338050571 /nfs/dbraw/zinc/05/05/71/338050571.db2.gz HZHAXVVHSMEIII-UHFFFAOYSA-N 0 1 321.770 4.094 20 0 DIADMN Cc1nc(C(C)C)oc1CN1CCC(OC2CCCC2)CC1 ZINC000428424392 338050821 /nfs/dbraw/zinc/05/08/21/338050821.db2.gz RPPVOYHHAMWZAF-UHFFFAOYSA-N 0 1 306.450 4.030 20 0 DIADMN CCCc1nc(C)c(CN2CC[C@@H](c3c(F)cccc3F)C2)o1 ZINC000428440347 338051467 /nfs/dbraw/zinc/05/14/67/338051467.db2.gz SJHSRJRKAMCSDG-CYBMUJFWSA-N 0 1 320.383 4.203 20 0 DIADMN CCCc1nc(C)c(CN2CCC[C@@H]2c2cccc(OC)c2)o1 ZINC000428460257 338053066 /nfs/dbraw/zinc/05/30/66/338053066.db2.gz NLCRUQLJBAWLSK-QGZVFWFLSA-N 0 1 314.429 4.281 20 0 DIADMN CCCc1nc(C)c(CN(C)CCOc2ccc(Cl)cc2)o1 ZINC000428466736 338053790 /nfs/dbraw/zinc/05/37/90/338053790.db2.gz VUWCHOFWPRMIFR-UHFFFAOYSA-N 0 1 322.836 4.100 20 0 DIADMN Cc1nc(C(C)C)oc1CN1CC2(CCCC2)OC(C)(C)C1 ZINC000428479208 338054564 /nfs/dbraw/zinc/05/45/64/338054564.db2.gz IGFACTDCVMZJLV-UHFFFAOYSA-N 0 1 306.450 4.030 20 0 DIADMN CCCc1nc(C)c(CN2CC[C@@H](C(F)(F)F)C2(C)C)o1 ZINC000428484202 338054739 /nfs/dbraw/zinc/05/47/39/338054739.db2.gz UEXRUYFZPLXOFS-GFCCVEGCSA-N 0 1 304.356 4.098 20 0 DIADMN CCCCCN(C)c1ccc(F)cc1CNC1CC(F)(F)C1 ZINC000428649024 338057828 /nfs/dbraw/zinc/05/78/28/338057828.db2.gz KTXBEOQLVMZZKR-UHFFFAOYSA-N 0 1 314.395 4.339 20 0 DIADMN Cc1ccc(-c2cc(C(=O)N(C)C3(C)CCCC3)n[nH]2)cc1C ZINC000428667246 338058147 /nfs/dbraw/zinc/05/81/47/338058147.db2.gz UZDVMXRPNATYBR-UHFFFAOYSA-N 0 1 311.429 4.098 20 0 DIADMN CCOC1(C)CCN(CCc2cc(Cl)ccc2Cl)CC1 ZINC000428719162 338059537 /nfs/dbraw/zinc/05/95/37/338059537.db2.gz HIVQSFNRPSRGGT-UHFFFAOYSA-N 0 1 316.272 4.427 20 0 DIADMN CCOc1ccccc1CNCc1ccc(C(F)(F)F)s1 ZINC000428855879 338062622 /nfs/dbraw/zinc/06/26/22/338062622.db2.gz IYDBELRVUNOPDJ-UHFFFAOYSA-N 0 1 315.360 4.455 20 0 DIADMN CCOc1cccc(CNCc2ccc(C(F)(F)F)s2)c1 ZINC000428856473 338062781 /nfs/dbraw/zinc/06/27/81/338062781.db2.gz MWJWXENPESRWLQ-UHFFFAOYSA-N 0 1 315.360 4.455 20 0 DIADMN COc1ccc([C@@H](C)NCc2nc3ccc(F)cc3s2)cc1 ZINC000428864086 338062999 /nfs/dbraw/zinc/06/29/99/338062999.db2.gz BFFSWXVFKIBEKC-LLVKDONJSA-N 0 1 316.401 4.295 20 0 DIADMN COc1ccc([C@H](C)NCc2nc3ccc(F)cc3s2)cc1 ZINC000428864087 338063044 /nfs/dbraw/zinc/06/30/44/338063044.db2.gz BFFSWXVFKIBEKC-NSHDSACASA-N 0 1 316.401 4.295 20 0 DIADMN Fc1ccc(C2(CNCc3cocn3)CCCC2)c(Cl)c1 ZINC000428865234 338063223 /nfs/dbraw/zinc/06/32/23/338063223.db2.gz VRQAPKOJXYAWOW-UHFFFAOYSA-N 0 1 308.784 4.069 20 0 DIADMN CCc1ccc(CNCc2nc3ccc(F)cc3s2)s1 ZINC000428867410 338063341 /nfs/dbraw/zinc/06/33/41/338063341.db2.gz MZEZBLVVOACDBA-UHFFFAOYSA-N 0 1 306.431 4.349 20 0 DIADMN Clc1ccccc1C1(CNCc2cocn2)CCCCC1 ZINC000428877778 338064252 /nfs/dbraw/zinc/06/42/52/338064252.db2.gz AEBOMZXYBQLNDB-UHFFFAOYSA-N 0 1 304.821 4.320 20 0 DIADMN C[C@H]1CN(Cc2cnc3ccccc3c2)Cc2ccccc2O1 ZINC000429141447 338071679 /nfs/dbraw/zinc/07/16/79/338071679.db2.gz LIHYLGCQUMFRLQ-HNNXBMFYSA-N 0 1 304.393 4.018 20 0 DIADMN Cc1cc(C(=O)CN(C2CCC2)C2CCC2)c(C)n1C1CC1 ZINC000429161886 338072187 /nfs/dbraw/zinc/07/21/87/338072187.db2.gz RCFTWOKVDYCUTJ-UHFFFAOYSA-N 0 1 300.446 4.030 20 0 DIADMN CC(C)(NCc1cncn1Cc1ccccc1)c1ccccc1F ZINC000429233964 338074053 /nfs/dbraw/zinc/07/40/53/338074053.db2.gz FRNRHTUHQZCDDG-UHFFFAOYSA-N 0 1 323.415 4.095 20 0 DIADMN CC(C)(NCc1cncc(C(F)(F)F)c1)c1ccccc1F ZINC000429259177 338075057 /nfs/dbraw/zinc/07/50/57/338075057.db2.gz JIDFBPHKMFBENP-UHFFFAOYSA-N 0 1 312.310 4.264 20 0 DIADMN Fc1ccc([C@H](N[C@H]2CC23CCCC3)c2cccnc2)c(F)c1 ZINC000429420302 338080466 /nfs/dbraw/zinc/08/04/66/338080466.db2.gz CQGXCFDRQZWJNM-ZWKOTPCHSA-N 0 1 314.379 4.372 20 0 DIADMN C[C@H](NC1CC(F)(F)C1)c1ccc(F)cc1Br ZINC000429447003 338081213 /nfs/dbraw/zinc/08/12/13/338081213.db2.gz DWVWNLODZKMFBI-ZETCQYMHSA-N 0 1 308.141 4.037 20 0 DIADMN C[C@@H]1CC[C@H](N(C)Cc2nnc(-c3ccccc3Cl)o2)C1 ZINC000429570013 338084521 /nfs/dbraw/zinc/08/45/21/338084521.db2.gz NVESOAXAWUYTIU-NEPJUHHUSA-N 0 1 305.809 4.010 20 0 DIADMN C[C@H]1CC[C@@H](N(C)Cc2csc(Cc3ccccc3)n2)C1 ZINC000429572658 338084547 /nfs/dbraw/zinc/08/45/47/338084547.db2.gz VTAHFILHUJEBMP-WMLDXEAASA-N 0 1 300.471 4.354 20 0 DIADMN C[C@H]1CC[C@H](N(C)Cc2nnc(-c3ccc(Cl)cc3)o2)C1 ZINC000429587310 338085339 /nfs/dbraw/zinc/08/53/39/338085339.db2.gz FKIJKSZESFNBDB-FZMZJTMJSA-N 0 1 305.809 4.010 20 0 DIADMN CCn1nccc1CN(C)CCCc1cccc2ccccc21 ZINC000429709060 338088000 /nfs/dbraw/zinc/08/80/00/338088000.db2.gz OONUOJPMPYGLQY-UHFFFAOYSA-N 0 1 307.441 4.121 20 0 DIADMN Cc1ccc(CNCc2cc(Cl)ccc2OCC2CC2)cn1 ZINC000430001819 338093167 /nfs/dbraw/zinc/09/31/67/338093167.db2.gz MTCLLBZLUGXSKD-UHFFFAOYSA-N 0 1 316.832 4.122 20 0 DIADMN Cc1cc2[nH]c(CN3CC[C@@]4(C)[C@@H](C3)C4(F)F)cc2c(C)c1 ZINC000430108303 338097222 /nfs/dbraw/zinc/09/72/22/338097222.db2.gz UMOSCADUYYDXJJ-SJORKVTESA-N 0 1 304.384 4.262 20 0 DIADMN Brc1cscc1CN(C1CCC1)C1CCC1 ZINC000430132189 338098314 /nfs/dbraw/zinc/09/83/14/338098314.db2.gz NLHBVIUIMRUMAL-UHFFFAOYSA-N 0 1 300.265 4.418 20 0 DIADMN CC[C@@H](Cc1ccccc1)[N@@H+](CC)Cc1cc(C(=O)[O-])oc1C ZINC000580720832 338100303 /nfs/dbraw/zinc/10/03/03/338100303.db2.gz PBUMFSYBBDMEOY-KRWDZBQOSA-N 0 1 315.413 4.129 20 0 DIADMN Clc1cccc(S[C@H]2CCN(Cc3cncs3)C2)c1 ZINC000430192193 338100439 /nfs/dbraw/zinc/10/04/39/338100439.db2.gz AXRUEIKAKAHKEH-ZDUSSCGKSA-N 0 1 310.875 4.163 20 0 DIADMN CSC[C@@H]1CCCN(Cc2ccc(F)c(C(F)(F)F)c2)C1 ZINC000430192967 338100495 /nfs/dbraw/zinc/10/04/95/338100495.db2.gz QCDKSWGACIEMIN-GFCCVEGCSA-N 0 1 321.383 4.420 20 0 DIADMN C=Cn1cc(CN2CC[C@@H](Sc3cccc(Cl)c3)C2)cn1 ZINC000430199418 338100982 /nfs/dbraw/zinc/10/09/82/338100982.db2.gz URUHKNLDBFJQCT-MRXNPFEDSA-N 0 1 319.861 4.004 20 0 DIADMN Cc1cc([C@H]2CCCN2C[C@H]2CCCO2)ccc1Br ZINC000430225263 338102255 /nfs/dbraw/zinc/10/22/55/338102255.db2.gz XTENHFXBIAVYRF-GDBMZVCRSA-N 0 1 324.262 4.073 20 0 DIADMN Cc1cc([C@@H]2CCCN2C[C@@H]2CCCO2)ccc1Br ZINC000430225269 338102260 /nfs/dbraw/zinc/10/22/60/338102260.db2.gz XTENHFXBIAVYRF-HOCLYGCPSA-N 0 1 324.262 4.073 20 0 DIADMN Cc1cccc(C(C)C)c1NC(=O)[C@@H](C)N1CC(C)=C[C@@H](C)C1 ZINC000430271101 338103764 /nfs/dbraw/zinc/10/37/64/338103764.db2.gz WQBZQXYJOUSMBQ-RHSMWYFYSA-N 0 1 314.473 4.343 20 0 DIADMN C[C@@H](c1cccc(Cl)c1)N1C[C@H](C)O[C@@]2(CCO[C@H](C)C2)C1 ZINC000430275127 338104020 /nfs/dbraw/zinc/10/40/20/338104020.db2.gz SYZRLGCJVHMUKF-LDDOYCOJSA-N 0 1 323.864 4.059 20 0 DIADMN Cn1nccc1-c1ccccc1-c1nc2ccc(Cl)cc2[nH]1 ZINC000430916183 338118758 /nfs/dbraw/zinc/11/87/58/338118758.db2.gz GQKAVVZDOAVHST-UHFFFAOYSA-N 0 1 308.772 4.284 20 0 DIADMN Clc1ccc(CNCc2ccccc2)c(Br)c1 ZINC000149698969 338119588 /nfs/dbraw/zinc/11/95/88/338119588.db2.gz JNIQEWGAWQTEAI-UHFFFAOYSA-N 0 1 310.622 4.392 20 0 DIADMN COC(=O)c1cc([C@@H](C)N[C@H](C)c2ccc(Cl)cc2)oc1C ZINC000431128888 338123540 /nfs/dbraw/zinc/12/35/40/338123540.db2.gz TWJCOFGIKBJLLX-GHMZBOCLSA-N 0 1 321.804 4.440 20 0 DIADMN COC(=O)c1cc([C@@H](C)N[C@H](C)c2ccc(F)c(C)c2)oc1C ZINC000431130969 338123566 /nfs/dbraw/zinc/12/35/66/338123566.db2.gz XMOHJEDFTMWRSG-VXGBXAGGSA-N 0 1 319.376 4.234 20 0 DIADMN CCCN1C(=O)N=NC1S[C@@H](C)CCSc1ccccc1 ZINC000431224350 338126288 /nfs/dbraw/zinc/12/62/88/338126288.db2.gz WNPYEEJXKYSPEV-LBPRGKRZSA-N 0 1 323.487 4.057 20 0 DIADMN C[C@]1(NCc2csc(Cl)c2Cl)CCO[C@@H]1C1CC1 ZINC000432254702 338149363 /nfs/dbraw/zinc/14/93/63/338149363.db2.gz PGDYIMJEBOYYKK-YPMHNXCESA-N 0 1 306.258 4.102 20 0 DIADMN Oc1cccc2c1C[C@@H](NCc1csc(Cl)c1Cl)C2 ZINC000432239431 338149837 /nfs/dbraw/zinc/14/98/37/338149837.db2.gz CLHZXDUHEYATSV-JTQLQIEISA-N 0 1 314.237 4.018 20 0 DIADMN Fc1ccc(CNc2ccc3nn[nH]c3c2)c(Cl)c1Cl ZINC000432253272 338151310 /nfs/dbraw/zinc/15/13/10/338151310.db2.gz JSYKSQKADWCFEJ-UHFFFAOYSA-N 0 1 311.147 4.016 20 0 DIADMN Fc1ccc(CNc2ccc3n[nH]nc3c2)c(Cl)c1Cl ZINC000432253272 338151311 /nfs/dbraw/zinc/15/13/11/338151311.db2.gz JSYKSQKADWCFEJ-UHFFFAOYSA-N 0 1 311.147 4.016 20 0 DIADMN C[C@@H]1CC[C@H](CNC(=O)Nc2ccc3nc(C(F)F)[nH]c3c2)C1 ZINC000432297435 338152401 /nfs/dbraw/zinc/15/24/01/338152401.db2.gz JNALCFPPYXROBD-ZJUUUORDSA-N 0 1 322.359 4.058 20 0 DIADMN C[C@@H](NC1CC(c2cccc(Br)c2)C1)c1ccon1 ZINC000432450861 338156657 /nfs/dbraw/zinc/15/66/57/338156657.db2.gz YLGIWUQDKXVJMK-PWQPVHBWSA-N 0 1 321.218 4.034 20 0 DIADMN CCSCC[C@H](C)[N@@H+](C)Cc1nc2ccc(F)cc2s1 ZINC000432721630 338164000 /nfs/dbraw/zinc/16/40/00/338164000.db2.gz YTHWFFFORDNMCB-NSHDSACASA-N 0 1 312.479 4.399 20 0 DIADMN CCSCC[C@H](C)N(C)Cc1nc2ccc(F)cc2s1 ZINC000432721630 338164001 /nfs/dbraw/zinc/16/40/01/338164001.db2.gz YTHWFFFORDNMCB-NSHDSACASA-N 0 1 312.479 4.399 20 0 DIADMN Fc1ccccc1CCSc1nc(-c2ccccc2F)n[nH]1 ZINC000432727429 338164388 /nfs/dbraw/zinc/16/43/88/338164388.db2.gz HDRWCRVNBVFNKS-UHFFFAOYSA-N 0 1 317.364 4.085 20 0 DIADMN CCCN(Cc1nc2ccc(F)cc2s1)C[C@H]1CCCCO1 ZINC000432741052 338165412 /nfs/dbraw/zinc/16/54/12/338165412.db2.gz ZBLFXJZHVOPUIA-CQSZACIVSA-N 0 1 322.449 4.217 20 0 DIADMN CN(CCc1cccs1)Cc1nc2ccc(F)cc2s1 ZINC000432750746 338166334 /nfs/dbraw/zinc/16/63/34/338166334.db2.gz NKBBXUADNXIPMO-UHFFFAOYSA-N 0 1 306.431 4.171 20 0 DIADMN Cc1ccc(C)c([C@@H]2CCCN2Cc2n[nH]c(C(C)(C)C)n2)c1 ZINC000432829763 338169590 /nfs/dbraw/zinc/16/95/90/338169590.db2.gz CCXSDNTYMTZBCM-INIZCTEOSA-N 0 1 312.461 4.056 20 0 DIADMN CC(C)(C)c1nc(CN(C2CC2)[C@H]2CCCc3ccccc32)n[nH]1 ZINC000432829073 338169621 /nfs/dbraw/zinc/16/96/21/338169621.db2.gz MLXNLLSGSYLZDT-KRWDZBQOSA-N 0 1 324.472 4.144 20 0 DIADMN CC(C)(C)c1nc(CN[C@H](c2cccc(F)c2)C(C)(C)C)n[nH]1 ZINC000432861933 338171174 /nfs/dbraw/zinc/17/11/74/338171174.db2.gz YBTUATLLAPBVJQ-OAHLLOKOSA-N 0 1 318.440 4.118 20 0 DIADMN C[C@H](c1cc2ccccc2o1)N(C)Cc1n[nH]c(C(C)(C)C)n1 ZINC000432935353 338173958 /nfs/dbraw/zinc/17/39/58/338173958.db2.gz CTXYIHJHMSTRSZ-GFCCVEGCSA-N 0 1 312.417 4.041 20 0 DIADMN CCCN(Cc1nc(C(=O)OCC)cs1)CC1CCCCC1 ZINC000432940729 338174428 /nfs/dbraw/zinc/17/44/28/338174428.db2.gz SHDANZDZLOMWDQ-UHFFFAOYSA-N 0 1 324.490 4.112 20 0 DIADMN Clc1ccc2c(c1Cl)CCN(CCC1CCOCC1)C2 ZINC000432940420 338174490 /nfs/dbraw/zinc/17/44/90/338174490.db2.gz VIKMBEQBKLDIIC-UHFFFAOYSA-N 0 1 314.256 4.168 20 0 DIADMN COC(=O)c1cc([C@@H](C)N(C)Cc2cccc(Cl)c2)oc1C ZINC000432944264 338174679 /nfs/dbraw/zinc/17/46/79/338174679.db2.gz RGONYKKOEWLPLV-LLVKDONJSA-N 0 1 321.804 4.221 20 0 DIADMN CCCC[C@H](CC)CN[C@H](C)c1ncc(Br)cn1 ZINC000432998645 338175851 /nfs/dbraw/zinc/17/58/51/338175851.db2.gz JGOUTWNSDOIQDB-NEPJUHHUSA-N 0 1 314.271 4.106 20 0 DIADMN Cc1ccc(C)c(NC(=O)CN2CCC[C@@H](c3ccccc3)C2)c1 ZINC000433059264 338179203 /nfs/dbraw/zinc/17/92/03/338179203.db2.gz CJLJKAOTLSFXMU-LJQANCHMSA-N 0 1 322.452 4.122 20 0 DIADMN CC(C)CCc1noc(CN2CCC[C@H](c3ccccc3)C2)n1 ZINC000433064162 338179604 /nfs/dbraw/zinc/17/96/04/338179604.db2.gz WFTJQPOOVDWQQP-KRWDZBQOSA-N 0 1 313.445 4.038 20 0 DIADMN CCc1ccc([C@@H]2CCN([C@@H](C)c3nc(C4CC4)no3)C2)cc1 ZINC000433077127 338180534 /nfs/dbraw/zinc/18/05/34/338180534.db2.gz QKVZOQSDHBMBCL-SUMWQHHRSA-N 0 1 311.429 4.060 20 0 DIADMN CCCCc1noc([C@H](C)N2CCC[C@@H](c3ccccc3)C2)n1 ZINC000433083416 338180821 /nfs/dbraw/zinc/18/08/21/338180821.db2.gz PAVWPLJLGKNOTC-DOTOQJQBSA-N 0 1 313.445 4.353 20 0 DIADMN Cc1cnc(C2CCN(CCc3cccc(F)c3F)CC2)s1 ZINC000433159806 338183549 /nfs/dbraw/zinc/18/35/49/338183549.db2.gz FVEGTEUZQALVNU-UHFFFAOYSA-N 0 1 322.424 4.152 20 0 DIADMN Fc1cc(CNCc2cccc3cc[nH]c32)c(F)cc1Cl ZINC000433194239 338185241 /nfs/dbraw/zinc/18/52/41/338185241.db2.gz MPZRHODHQQLKFX-UHFFFAOYSA-N 0 1 306.743 4.389 20 0 DIADMN Clc1cccc([C@@H]2CCN(Cc3ccncc3Cl)C2)c1 ZINC000433295457 338189887 /nfs/dbraw/zinc/18/98/87/338189887.db2.gz PCHHVVKQGYNJPE-CYBMUJFWSA-N 0 1 307.224 4.378 20 0 DIADMN Fc1cc(CSc2cn[nH]n2)ccc1Oc1ccccc1 ZINC000433375819 338194132 /nfs/dbraw/zinc/19/41/32/338194132.db2.gz LWAISEDLWFOGGB-UHFFFAOYSA-N 0 1 301.346 4.028 20 0 DIADMN CC(C)n1ncnc1CN1CCC[C@H]1CCC1CCCCC1 ZINC000434476682 338217176 /nfs/dbraw/zinc/21/71/76/338217176.db2.gz KXGYBJZRNHCIJQ-KRWDZBQOSA-N 0 1 304.482 4.184 20 0 DIADMN Cc1c(F)cccc1NC(=O)CC[N@H+](C)[C@@H](C)c1cccs1 ZINC000434653640 338222534 /nfs/dbraw/zinc/22/25/34/338222534.db2.gz BOOARQXTBWRWJS-ZDUSSCGKSA-N 0 1 320.433 4.217 20 0 DIADMN C[C@@H](c1nnc(-c2cccs2)o1)N1CCSC(C)(C)CC1 ZINC000434714197 338223873 /nfs/dbraw/zinc/22/38/73/338223873.db2.gz OBWCJHPHAZWQJD-NSHDSACASA-N 0 1 323.487 4.077 20 0 DIADMN Cc1ccc(-c2nc(CN3CCSC(C)(C)CC3)co2)cc1 ZINC000434713479 338224005 /nfs/dbraw/zinc/22/40/05/338224005.db2.gz HSFFHUJOEZVCOS-UHFFFAOYSA-N 0 1 316.470 4.368 20 0 DIADMN Cc1ccc([C@@]2(C)CCN(Cc3ncc(C(C)(C)C)o3)C2)cc1 ZINC000434752440 338224933 /nfs/dbraw/zinc/22/49/33/338224933.db2.gz BFSFJIDWXYPBEP-FQEVSTJZSA-N 0 1 312.457 4.444 20 0 DIADMN Cc1ccc(CNCc2ccc(C)cc2Br)s1 ZINC000159289322 338522652 /nfs/dbraw/zinc/52/26/52/338522652.db2.gz SPDJDNLBSAYXIE-UHFFFAOYSA-N 0 1 310.260 4.417 20 0 DIADMN CN(Cc1ccccc1)Cc1ccccc1OCc1cccnc1 ZINC000154474072 338244043 /nfs/dbraw/zinc/24/40/43/338244043.db2.gz VJSACKKRQNCPLE-UHFFFAOYSA-N 0 1 318.420 4.293 20 0 DIADMN CSc1ccc2nc(-c3cnc(-c4ccncc4)s3)[nH]c2c1 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ZINC000499523493 340038581 /nfs/dbraw/zinc/03/85/81/340038581.db2.gz QONNGSBPPSCBJM-UHFFFAOYSA-N 0 1 303.837 4.286 20 0 DIADMN COc1ccc(F)cc1[C@@H](C)NCc1cnc2ccccc2c1 ZINC000499604178 340040571 /nfs/dbraw/zinc/04/05/71/340040571.db2.gz VJFWAWGJBZBANG-CYBMUJFWSA-N 0 1 310.372 4.233 20 0 DIADMN CC(C)n1nccc1CN[C@H](C)c1ccccc1C(F)(F)F ZINC000499604340 340040591 /nfs/dbraw/zinc/04/05/91/340040591.db2.gz DAUCYEOOLFCQCO-GFCCVEGCSA-N 0 1 311.351 4.334 20 0 DIADMN COc1cccc(-c2noc([C@H](C)NCCCC(C)(C)C)n2)c1 ZINC000499627451 340041531 /nfs/dbraw/zinc/04/15/31/340041531.db2.gz UEXPTMYNLMDPPC-ZDUSSCGKSA-N 0 1 317.433 4.222 20 0 DIADMN CCCN(Cc1ccnn1C(C)C)[C@H]1CCCc2cccnc21 ZINC000499632216 340041820 /nfs/dbraw/zinc/04/18/20/340041820.db2.gz DKARRRQTXAGCHZ-SFHVURJKSA-N 0 1 312.461 4.149 20 0 DIADMN CC[C@@H]1CCCCN1Cc1nc(-c2cccc(Cl)c2)no1 ZINC000499686275 340042301 /nfs/dbraw/zinc/04/23/01/340042301.db2.gz KJZYERLTJLXBQG-CQSZACIVSA-N 0 1 305.809 4.155 20 0 DIADMN CC[C@H]1CCCCN1Cc1nc(-c2cccc(Cl)c2)no1 ZINC000499686273 340042322 /nfs/dbraw/zinc/04/23/22/340042322.db2.gz KJZYERLTJLXBQG-AWEZNQCLSA-N 0 1 305.809 4.155 20 0 DIADMN COC(=O)c1nc([C@H]2CCCN2C[C@@H](C)CC(C)C)sc1C ZINC000499770944 340044642 /nfs/dbraw/zinc/04/46/42/340044642.db2.gz GYUSNEZATRUNSE-GXTWGEPZSA-N 0 1 324.490 4.057 20 0 DIADMN CN(Cc1c[nH]cn1)[C@H](c1ccc(Cl)cc1)C1CCCC1 ZINC000499914025 340046959 /nfs/dbraw/zinc/04/69/59/340046959.db2.gz UCLCODIVNROFRP-KRWDZBQOSA-N 0 1 303.837 4.426 20 0 DIADMN Cc1ccc(C[C@@H]2CCC[N@H+]2Cc2cn3c(cccc3C)n2)cc1 ZINC000500190529 340052563 /nfs/dbraw/zinc/05/25/63/340052563.db2.gz VRTGNNUSDDNGLC-FQEVSTJZSA-N 0 1 319.452 4.158 20 0 DIADMN Cc1ccc(C[C@H]2CCC[N@H+]2Cc2cn3c(cccc3C)n2)cc1 ZINC000500190532 340052584 /nfs/dbraw/zinc/05/25/84/340052584.db2.gz VRTGNNUSDDNGLC-HXUWFJFHSA-N 0 1 319.452 4.158 20 0 DIADMN CC(C)c1cnc(CNC(C)(C)COCc2ccccc2)s1 ZINC000500417979 340057557 /nfs/dbraw/zinc/05/75/57/340057557.db2.gz WROSKDZIBPAXQS-UHFFFAOYSA-N 0 1 318.486 4.352 20 0 DIADMN Cn1nccc1[C@@H]1CCCCN1CCCc1ccccc1Cl ZINC000500418238 340057844 /nfs/dbraw/zinc/05/78/44/340057844.db2.gz YTTYPNRPXZNAPE-SFHVURJKSA-N 0 1 317.864 4.233 20 0 DIADMN CCS[C@H]1CCCCN(c2ccnc3cc(F)ccc32)C1 ZINC000500429330 340058302 /nfs/dbraw/zinc/05/83/02/340058302.db2.gz VJWGNRFVOQVEFC-AWEZNQCLSA-N 0 1 304.434 4.486 20 0 DIADMN Cn1nccc1[C@H]1CCCCN1C/C=C\c1ccc(Cl)cc1 ZINC000500446005 340058980 /nfs/dbraw/zinc/05/89/80/340058980.db2.gz JOLBFSXLUSKYAJ-PYTPGESOSA-N 0 1 315.848 4.314 20 0 DIADMN CSc1ccccc1[C@@H](C)NCc1cc(C(F)(F)F)n[nH]1 ZINC000500443583 340058998 /nfs/dbraw/zinc/05/89/98/340058998.db2.gz ZVKRPJKAODBIAF-SECBINFHSA-N 0 1 315.364 4.001 20 0 DIADMN CCOc1cccc(CN[C@H](c2ccc(F)cc2)C(C)C)n1 ZINC000500477482 340060137 /nfs/dbraw/zinc/06/01/37/340060137.db2.gz WNTCGRZDYQXCTL-SFHVURJKSA-N 0 1 302.393 4.106 20 0 DIADMN CC[C@H]1C[C@]1(NCc1nc2ccccc2n1C)c1cccc(C)c1 ZINC000500509561 340061133 /nfs/dbraw/zinc/06/11/33/340061133.db2.gz TYEYIRAZBNBSHI-HRAATJIYSA-N 0 1 319.452 4.297 20 0 DIADMN CC[C@@H]1C[C@]1(NCc1cc(C(F)(F)F)n[nH]1)c1cccc(C)c1 ZINC000500537606 340061865 /nfs/dbraw/zinc/06/18/65/340061865.db2.gz UGLKQSLUZZBWFY-MLGOLLRUSA-N 0 1 323.362 4.152 20 0 DIADMN O=C(N[C@@H]1CCCC[C@@H]1c1ccccc1)c1n[nH]c2ccccc21 ZINC000500576927 340062728 /nfs/dbraw/zinc/06/27/28/340062728.db2.gz BMRACUHVXPEREA-NVXWUHKLSA-N 0 1 319.408 4.019 20 0 DIADMN COCC1(C)CCN(Cc2ccc(F)c(C(F)(F)F)c2)CC1 ZINC000500772298 340066181 /nfs/dbraw/zinc/06/61/81/340066181.db2.gz MKNOZEWJVGAVFM-UHFFFAOYSA-N 0 1 319.342 4.093 20 0 DIADMN CCc1cc(OC)ccc1CNCc1cc(F)ccc1SC ZINC000501386262 340079351 /nfs/dbraw/zinc/07/93/51/340079351.db2.gz HLTLJRFLSZPGOV-UHFFFAOYSA-N 0 1 319.445 4.408 20 0 DIADMN CCc1cc(OC)ccc1CN[C@@H](CC)c1nc(C)cs1 ZINC000501426912 340080819 /nfs/dbraw/zinc/08/08/19/340080819.db2.gz VVWUFTGAWINCRH-INIZCTEOSA-N 0 1 304.459 4.263 20 0 DIADMN CCC[C@@H](NC/C(C)=C\c1ccccc1)c1nnc2ccccn21 ZINC000501468782 340081811 /nfs/dbraw/zinc/08/18/11/340081811.db2.gz SPSICAVMRNTDAN-HRYDCMBCSA-N 0 1 320.440 4.264 20 0 DIADMN C[C@H](c1nc2ccccc2n1C(F)F)N1CC[C@@H](C)[C@@H](C)C1 ZINC000501773796 340088306 /nfs/dbraw/zinc/08/83/06/340088306.db2.gz MARHTJJULPAAAX-FRRDWIJNSA-N 0 1 307.388 4.470 20 0 DIADMN C[C@@H]1CCN(Cc2nc3cc(C(F)(F)F)ccc3o2)C[C@H]1C ZINC000501773287 340088337 /nfs/dbraw/zinc/08/83/37/340088337.db2.gz IHPCXJLMGDUFNM-GHMZBOCLSA-N 0 1 312.335 4.325 20 0 DIADMN C[C@@H]1CCN(CC(=O)Nc2ccccc2-c2ccccc2)C[C@H]1C ZINC000501778842 340088564 /nfs/dbraw/zinc/08/85/64/340088564.db2.gz VVIKHPXWMJVESP-IAGOWNOFSA-N 0 1 322.452 4.270 20 0 DIADMN C[C@H]1CCN(Cc2coc(-c3c(F)cccc3F)n2)C[C@H]1C ZINC000501802225 340089051 /nfs/dbraw/zinc/08/90/51/340089051.db2.gz FFFUASNRXXKBJS-NWDGAFQWSA-N 0 1 306.356 4.098 20 0 DIADMN COc1cc(CN[C@@H](C)c2cc(C)c(C)o2)c2ccccc2n1 ZINC000502454575 340104248 /nfs/dbraw/zinc/10/42/48/340104248.db2.gz NMPCCCZMDOPQOV-ZDUSSCGKSA-N 0 1 310.397 4.304 20 0 DIADMN Cc1ccc(CC(=O)Nc2ccc3nc(C4CCC4)[nH]c3c2)cc1 ZINC000502459014 340104455 /nfs/dbraw/zinc/10/44/55/340104455.db2.gz VBBKQNBXVYYSCL-UHFFFAOYSA-N 0 1 319.408 4.320 20 0 DIADMN Cc1cc([C@@H](C)NCCCOc2ccc3ccccc3c2)nn1C ZINC000502472973 340105174 /nfs/dbraw/zinc/10/51/74/340105174.db2.gz BBWHNLZPDUDWIT-MRXNPFEDSA-N 0 1 323.440 4.001 20 0 DIADMN Cc1cc([C@H](C)N[C@H](c2ccc(Cl)cc2)C2CC2)nn1C ZINC000502478800 340105437 /nfs/dbraw/zinc/10/54/37/340105437.db2.gz CHGXPLNCVWLJBI-SJCJKPOMSA-N 0 1 303.837 4.184 20 0 DIADMN Cc1cc([C@H](C)N[C@H]2CC(C)(C)CCc3ccccc32)nn1C ZINC000502486790 340105833 /nfs/dbraw/zinc/10/58/33/340105833.db2.gz MVOIQPTYPQOVJP-KXBFYZLASA-N 0 1 311.473 4.483 20 0 DIADMN Cc1cccc2nc(CN[C@H](c3ccc(F)cc3)C(C)C)cn21 ZINC000502488403 340105938 /nfs/dbraw/zinc/10/59/38/340105938.db2.gz RWOOAXOEFYSAAZ-IBGZPJMESA-N 0 1 311.404 4.269 20 0 DIADMN Clc1c2ccccc2sc1CN1CCN(C2CCC2)CC1 ZINC000502543016 340107289 /nfs/dbraw/zinc/10/72/89/340107289.db2.gz XJZSLWRSSLPHKY-UHFFFAOYSA-N 0 1 320.889 4.225 20 0 DIADMN CC[C@@H]1C[C@]1(NCc1ccncc1Cl)c1cccc(C)c1 ZINC000502554773 340107584 /nfs/dbraw/zinc/10/75/84/340107584.db2.gz WLCMCPDNVMMNRG-CRAIPNDOSA-N 0 1 300.833 4.458 20 0 DIADMN CC[C@@H]1C[C@]1(NCc1cn(C)nc1C(F)F)c1cccc(C)c1 ZINC000502592153 340108635 /nfs/dbraw/zinc/10/86/35/340108635.db2.gz PFRTYKHYHTUECW-RDTXWAMCSA-N 0 1 319.399 4.081 20 0 DIADMN Cc1nc(CCN2CCCC[C@H]2c2ccc(F)cc2F)cs1 ZINC000503072500 340120384 /nfs/dbraw/zinc/12/03/84/340120384.db2.gz BRQHEDRSZCGCOE-KRWDZBQOSA-N 0 1 322.424 4.499 20 0 DIADMN CC[C@@H](C)[C@@H](C)C(=O)Nc1ccc2nc(-c3ccccn3)[nH]c2c1 ZINC000503080401 340120435 /nfs/dbraw/zinc/12/04/35/340120435.db2.gz FPYBUAKGTURXGF-CHWSQXEVSA-N 0 1 322.412 4.246 20 0 DIADMN CCCCCn1cc(CNCc2cccc(Cl)c2)c(C)n1 ZINC000503262380 340124231 /nfs/dbraw/zinc/12/42/31/340124231.db2.gz GNAYIVUGUAUURS-UHFFFAOYSA-N 0 1 305.853 4.325 20 0 DIADMN CCCC[C@@H](C)C(=O)Nc1cccc(CN2CCSCC2)c1 ZINC000503466009 340128767 /nfs/dbraw/zinc/12/87/67/340128767.db2.gz MJNUGXCKRWWLGE-OAHLLOKOSA-N 0 1 320.502 4.000 20 0 DIADMN c1cc(Oc2ccccc2)oc1CNCCOC1CCCC1 ZINC000503568524 340130823 /nfs/dbraw/zinc/13/08/23/340130823.db2.gz IDUOOJMIVYKKQW-UHFFFAOYSA-N 0 1 301.386 4.121 20 0 DIADMN COC[C@H](NCc1ccc(Cl)c(C)c1)c1ccc(F)cc1 ZINC000503593500 340131967 /nfs/dbraw/zinc/13/19/67/340131967.db2.gz ZFKNCBXIJLPRMH-KRWDZBQOSA-N 0 1 307.796 4.265 20 0 DIADMN CCCC[C@@H](C)C(=O)Nc1cccc2c1CN(CC(C)C)C2 ZINC000503722006 340134134 /nfs/dbraw/zinc/13/41/34/340134134.db2.gz NBTHUXQCWMHCQV-OAHLLOKOSA-N 0 1 302.462 4.423 20 0 DIADMN Fc1ccccc1[C@@H]1CCN(Cc2ncc(-c3ccccc3)o2)C1 ZINC000503747956 340134237 /nfs/dbraw/zinc/13/42/37/340134237.db2.gz NHCKYAPHSFREHL-MRXNPFEDSA-N 0 1 322.383 4.470 20 0 DIADMN COCC[C@H](NC/C=C\c1ccc(Cl)cc1)c1ccco1 ZINC000503937265 340137598 /nfs/dbraw/zinc/13/75/98/340137598.db2.gz QHGYNQGYMBVACM-OUMXJLHTSA-N 0 1 305.805 4.314 20 0 DIADMN COCC[C@H](NC/C=C/c1ccc(Cl)cc1)c1ccco1 ZINC000503937264 340137617 /nfs/dbraw/zinc/13/76/17/340137617.db2.gz QHGYNQGYMBVACM-ICTCPBKTSA-N 0 1 305.805 4.314 20 0 DIADMN Cc1ccc([C@@H]2CCCN2Cc2cn3c(cccc3C)n2)cc1 ZINC000503952418 340138324 /nfs/dbraw/zinc/13/83/24/340138324.db2.gz IODNIHVLAMVTFS-IBGZPJMESA-N 0 1 305.425 4.288 20 0 DIADMN C[C@H](c1ccc(C(F)(F)F)cc1)N1C[C@@H](C)OC(C)(C)C1 ZINC000503985239 340139152 /nfs/dbraw/zinc/13/91/52/340139152.db2.gz HUHJACRUTAASHH-VXGBXAGGSA-N 0 1 301.352 4.266 20 0 DIADMN C[C@@H](c1ccc(C(F)(F)F)cc1)N1C[C@@H](C)OC(C)(C)C1 ZINC000503985236 340139264 /nfs/dbraw/zinc/13/92/64/340139264.db2.gz HUHJACRUTAASHH-NEPJUHHUSA-N 0 1 301.352 4.266 20 0 DIADMN CCCN(Cc1cn2c(cccc2C)n1)Cc1ccc(F)cc1 ZINC000503990334 340139330 /nfs/dbraw/zinc/13/93/30/340139330.db2.gz ARPPKVGATKLKPN-UHFFFAOYSA-N 0 1 311.404 4.194 20 0 DIADMN CC(C)(C)c1[nH]ncc1C(=O)Nc1cccc(C(C)(F)F)c1 ZINC000504199228 340142892 /nfs/dbraw/zinc/14/28/92/340142892.db2.gz LDQHZZLQFGUUGW-UHFFFAOYSA-N 0 1 307.344 4.071 20 0 DIADMN CCN(CC)[C@@H](c1nc(-c2cccs2)no1)c1ccccc1 ZINC000504246129 340143769 /nfs/dbraw/zinc/14/37/69/340143769.db2.gz IZOUGEQDNXIQMC-OAHLLOKOSA-N 0 1 313.426 4.229 20 0 DIADMN CCCCCn1cc(CN[C@H](C)c2cccc(F)c2)c(C)n1 ZINC000504382248 340146642 /nfs/dbraw/zinc/14/66/42/340146642.db2.gz RNXLHKDHMDOFPA-CQSZACIVSA-N 0 1 303.425 4.372 20 0 DIADMN FC(F)(F)c1cc2nc(-c3ccc4occc4c3)[nH]c2cn1 ZINC000504495003 340148408 /nfs/dbraw/zinc/14/84/08/340148408.db2.gz BXHCGURXGIVGLO-UHFFFAOYSA-N 0 1 303.243 4.390 20 0 DIADMN COc1ccc([C@H]2CC[N@@H+](Cc3ccc(F)cc3Cl)C2)cc1 ZINC000504537636 340148854 /nfs/dbraw/zinc/14/88/54/340148854.db2.gz AZWLBDHWKXXQSD-AWEZNQCLSA-N 0 1 319.807 4.477 20 0 DIADMN Cc1cc(CNc2cc(C)nc3c(C)cc(Cl)cc23)on1 ZINC000505175128 340163251 /nfs/dbraw/zinc/16/32/51/340163251.db2.gz RSJBRXCZJLXKBM-UHFFFAOYSA-N 0 1 301.777 4.414 20 0 DIADMN c1cc([C@@H]2CCCCC[N@@H+]2Cc2ccc3c(c2)CCO3)ccn1 ZINC000505254573 340165049 /nfs/dbraw/zinc/16/50/49/340165049.db2.gz NQHKIULAUNLRMD-IBGZPJMESA-N 0 1 308.425 4.134 20 0 DIADMN Cn1c2ccccc2nc1CN(Cc1ccccc1)C(C)(C)C ZINC000505434322 340168276 /nfs/dbraw/zinc/16/82/76/340168276.db2.gz WOJXIVFKUPTXSP-UHFFFAOYSA-N 0 1 307.441 4.374 20 0 DIADMN Cc1ccc(-c2n[nH]c(SCc3ccncc3Cl)n2)cc1 ZINC000505445042 340168642 /nfs/dbraw/zinc/16/86/42/340168642.db2.gz VFFAFDLUTAPWDK-UHFFFAOYSA-N 0 1 316.817 4.121 20 0 DIADMN CCc1ccc(CN(C)Cc2ccc(Br)cn2)cc1 ZINC000505596526 340172231 /nfs/dbraw/zinc/17/22/31/340172231.db2.gz LKNGYHZGDBZIJS-UHFFFAOYSA-N 0 1 319.246 4.039 20 0 DIADMN CCCCc1oc2ccccc2c1CN(C)Cc1cnn(C)c1 ZINC000505601780 340172476 /nfs/dbraw/zinc/17/24/76/340172476.db2.gz IYCOKCIFQSUWPG-UHFFFAOYSA-N 0 1 311.429 4.141 20 0 DIADMN CCc1ccc(CN(C)Cc2cnc(-c3ccccn3)s2)cc1 ZINC000505608893 340172694 /nfs/dbraw/zinc/17/26/94/340172694.db2.gz MIVLLPHFRUKQGW-UHFFFAOYSA-N 0 1 323.465 4.400 20 0 DIADMN COc1cc(CN(C)Cc2cccs2)cc(Cl)c1OC ZINC000505628253 340173526 /nfs/dbraw/zinc/17/35/26/340173526.db2.gz DBCRRBJVWSWOAF-UHFFFAOYSA-N 0 1 311.834 4.051 20 0 DIADMN CN(Cc1cccc(F)c1)Cc1ccc(OC(F)F)c(F)c1 ZINC000505636531 340173716 /nfs/dbraw/zinc/17/37/16/340173716.db2.gz LHDSGODGSCPMRH-UHFFFAOYSA-N 0 1 313.294 4.198 20 0 DIADMN COc1cc(CN(C)Cc2cccc(F)c2)ccc1OC(C)C ZINC000505642011 340174055 /nfs/dbraw/zinc/17/40/55/340174055.db2.gz VUZQVBRSWAWROM-UHFFFAOYSA-N 0 1 317.404 4.254 20 0 DIADMN COc1ccc2cc(CN3CCn4cccc4[C@H]3C)ccc2c1 ZINC000505666573 340174727 /nfs/dbraw/zinc/17/47/27/340174727.db2.gz XEZWFCZBWDRNIA-OAHLLOKOSA-N 0 1 306.409 4.227 20 0 DIADMN CCN(Cc1cnc(C)cn1)[C@H](C)c1cccc(C(F)(F)F)c1 ZINC000505808889 340178582 /nfs/dbraw/zinc/17/85/82/340178582.db2.gz JTSXAUNHFKDAHD-CYBMUJFWSA-N 0 1 323.362 4.387 20 0 DIADMN COc1cccc(CN(C)Cc2sccc2C)c1OC(C)C ZINC000506018062 340183453 /nfs/dbraw/zinc/18/34/53/340183453.db2.gz XOOZGHRROGYENP-UHFFFAOYSA-N 0 1 319.470 4.484 20 0 DIADMN COCCN(Cc1cccs1)Cc1ccc(F)c(Cl)c1 ZINC000506021887 340183573 /nfs/dbraw/zinc/18/35/73/340183573.db2.gz NWOFQHHQXXQQKI-UHFFFAOYSA-N 0 1 313.825 4.189 20 0 DIADMN CCN(Cc1c(C)nn(C(C)(C)C)c1C)Cc1cccc(F)c1 ZINC000506052446 340184582 /nfs/dbraw/zinc/18/45/82/340184582.db2.gz ZUAGGTCFOKYOQB-UHFFFAOYSA-N 0 1 317.452 4.416 20 0 DIADMN 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ZINC000296056992 1042916562 /nfs/dbraw/zinc/91/65/62/1042916562.db2.gz OWFSVNVMLITEOB-YOEHRIQHSA-N 0 1 314.429 4.150 20 0 DIADMN Cn1c(CNC2(c3nccs3)CCCC2)cc2ccccc21 ZINC000638625941 1042919841 /nfs/dbraw/zinc/91/98/41/1042919841.db2.gz VRIZDNXQNBENJZ-UHFFFAOYSA-N 0 1 311.454 4.194 20 0 DIADMN Cc1nc(C(C)(C)NCc2cc3ccccc3n2C)sc1C ZINC000638631912 1042920620 /nfs/dbraw/zinc/92/06/20/1042920620.db2.gz UVFZLNQQVFHULQ-UHFFFAOYSA-N 0 1 313.470 4.277 20 0 DIADMN CCN(CC)[C@H](C(=O)N(C)c1cccc(C)c1)c1ccccc1 ZINC000518802082 1042921379 /nfs/dbraw/zinc/92/13/79/1042921379.db2.gz MTXJMMXBNMPEFF-IBGZPJMESA-N 0 1 310.441 4.041 20 0 DIADMN CCc1sc(-c2nnc(CN3CC[C@@H]4CCC[C@@H]43)o2)cc1C ZINC000426464774 1042923326 /nfs/dbraw/zinc/92/33/26/1042923326.db2.gz XMNBRMCEJQHXJZ-STQMWFEESA-N 0 1 317.458 4.043 20 0 DIADMN Cc1oc(C[N@H+](C)[C@H]2CCc3ccc(Cl)cc32)cc1C(=O)[O-] ZINC000518990577 1042928320 /nfs/dbraw/zinc/92/83/20/1042928320.db2.gz KWNKZIWUTUSWOO-INIZCTEOSA-N 0 1 319.788 4.059 20 0 DIADMN CCCCCN(C(=O)N[C@H](C)Cc1cc(C)[nH]n1)[C@@H](C)CCC ZINC000426529921 1042932447 /nfs/dbraw/zinc/93/24/47/1042932447.db2.gz MWTMRADLKYMLPU-ZBFHGGJFSA-N 0 1 322.497 4.040 20 0 DIADMN CC(C)N(CC(=O)N(Cc1ccccc1)c1ccccc1)C1CC1 ZINC000519222896 1042938555 /nfs/dbraw/zinc/93/85/55/1042938555.db2.gz IGBPIGXVSCLPEG-UHFFFAOYSA-N 0 1 322.452 4.093 20 0 DIADMN C[C@H](C[N@@H+](C)Cc1cn2c(n1)CCCC2)c1cccc(Cl)c1 ZINC000519233461 1042939524 /nfs/dbraw/zinc/93/95/24/1042939524.db2.gz HLYXWGBJFBWAFA-CQSZACIVSA-N 0 1 317.864 4.108 20 0 DIADMN C[C@H](CN(C)Cc1cn2c(n1)CCCC2)c1cccc(Cl)c1 ZINC000519233461 1042939528 /nfs/dbraw/zinc/93/95/28/1042939528.db2.gz HLYXWGBJFBWAFA-CQSZACIVSA-N 0 1 317.864 4.108 20 0 DIADMN CCc1ccc(-c2noc(C[N@H+](CC)[C@@H](C)C(C)C)n2)cc1 ZINC000519274422 1042940990 /nfs/dbraw/zinc/94/09/90/1042940990.db2.gz WXDACTXYOHHUCY-AWEZNQCLSA-N 0 1 301.434 4.165 20 0 DIADMN CCCCCC[C@H](C)C(=O)N1CCN(C)CC12CCCCC2 ZINC001126473333 1042948684 /nfs/dbraw/zinc/94/86/84/1042948684.db2.gz YGMPGWHHGVEPIK-KRWDZBQOSA-N 0 1 308.510 4.070 20 0 DIADMN Cc1ccc(-c2cc(C(=O)N(C)c3ccc(F)cc3)[nH]n2)c(C)c1 ZINC000426639042 1042949900 /nfs/dbraw/zinc/94/99/00/1042949900.db2.gz UHOCRSDFTOQDKZ-UHFFFAOYSA-N 0 1 323.371 4.109 20 0 DIADMN Cc1cccnc1[C@@H](N[C@H](C)c1cc(O)cc(F)c1)C(C)C ZINC000925072027 1042956438 /nfs/dbraw/zinc/95/64/38/1042956438.db2.gz PVMWCSBMYFZVJS-DYVFJYSZSA-N 0 1 302.393 4.283 20 0 DIADMN Cc1cccnc1[C@H](N[C@@H](C)c1ccnn1C1CCC1)C(C)C ZINC000925073214 1042959961 /nfs/dbraw/zinc/95/99/61/1042959961.db2.gz XNDJFKUZCJDSJK-MAUKXSAKSA-N 0 1 312.461 4.359 20 0 DIADMN Cc1cccnc1[C@H](N[C@@H]1CCc2c1nccc2Cl)C(C)C ZINC000925073205 1042960429 /nfs/dbraw/zinc/96/04/29/1042960429.db2.gz XJZKPQQMZYNGNZ-HZPDHXFCSA-N 0 1 315.848 4.413 20 0 DIADMN CC(C)[C@@H]1N(Cc2cnc(CC(F)(F)F)s2)CC12CCC2 ZINC000894584666 1042969867 /nfs/dbraw/zinc/96/98/67/1042969867.db2.gz KIRSJIWTYYQOOU-ZDUSSCGKSA-N 0 1 318.408 4.258 20 0 DIADMN Cc1ccncc1CN(C)Cc1cc2ccnc(Cl)c2s1 ZINC000894617657 1042970506 /nfs/dbraw/zinc/97/05/06/1042970506.db2.gz CAAYWBWMZBSENO-UHFFFAOYSA-N 0 1 317.845 4.285 20 0 DIADMN Cc1ccc(-c2ccccc2CN[C@@H]2CCn3ccnc32)c(C)c1 ZINC000894668185 1042971894 /nfs/dbraw/zinc/97/18/94/1042971894.db2.gz KWDBMZKYXXIBKD-HXUWFJFHSA-N 0 1 317.436 4.402 20 0 DIADMN CCc1occc1C(=O)Nc1ccccc1-c1nnc(C(C)C)[nH]1 ZINC000280781271 1042972458 /nfs/dbraw/zinc/97/24/58/1042972458.db2.gz JZQXPNFMUUJWPT-UHFFFAOYSA-N 0 1 324.384 4.003 20 0 DIADMN Cc1ncoc1CN(Cc1cccs1)C1Cc2ccccc2C1 ZINC000894690102 1042973618 /nfs/dbraw/zinc/97/36/18/1042973618.db2.gz LLLRGGYIODFKNH-UHFFFAOYSA-N 0 1 324.449 4.214 20 0 DIADMN CCn1cc(CN[C@@H](c2ccc(F)c(Cl)c2)C2CC2)c(C)n1 ZINC000894699187 1042974304 /nfs/dbraw/zinc/97/43/04/1042974304.db2.gz GEUZHTBLJCBBFD-QGZVFWFLSA-N 0 1 321.827 4.245 20 0 DIADMN CCn1cc(CN[C@H](c2ccc(F)c(Cl)c2)C2CC2)c(C)n1 ZINC000894699164 1042974463 /nfs/dbraw/zinc/97/44/63/1042974463.db2.gz GEUZHTBLJCBBFD-KRWDZBQOSA-N 0 1 321.827 4.245 20 0 DIADMN CCN(Cc1cc2ccnc(Cl)c2s1)Cc1ccncc1 ZINC000894759867 1042975876 /nfs/dbraw/zinc/97/58/76/1042975876.db2.gz AHTASOIMCGCZFM-UHFFFAOYSA-N 0 1 317.845 4.367 20 0 DIADMN CCN(Cc1[nH]nc(C)c1C)Cc1cccc(-c2ccncc2)c1 ZINC000894778857 1042977142 /nfs/dbraw/zinc/97/71/42/1042977142.db2.gz SXRIBDHCBXBARS-UHFFFAOYSA-N 0 1 320.440 4.111 20 0 DIADMN COc1cccc(CN[C@H](C)c2ccc3ccccc3n2)c1C ZINC000658354330 1042979348 /nfs/dbraw/zinc/97/93/48/1042979348.db2.gz VBOSXSARRSZDDK-OAHLLOKOSA-N 0 1 306.409 4.403 20 0 DIADMN CCc1ccc([C@H](C)NC(=O)CN(C)[C@@H](C)c2ccccc2)cc1 ZINC000015372058 1042982706 /nfs/dbraw/zinc/98/27/06/1042982706.db2.gz WVOAAMSMHWZRDT-IRXDYDNUSA-N 0 1 324.468 4.119 20 0 DIADMN Clc1cccnc1CSc1n[nH]c(CCC2CCCC2)n1 ZINC000629113129 1042984778 /nfs/dbraw/zinc/98/47/78/1042984778.db2.gz HHYDHSZOOMBVFL-UHFFFAOYSA-N 0 1 322.865 4.268 20 0 DIADMN Clc1cccnc1CSc1nc(CCC2CCCC2)n[nH]1 ZINC000629113129 1042984780 /nfs/dbraw/zinc/98/47/80/1042984780.db2.gz HHYDHSZOOMBVFL-UHFFFAOYSA-N 0 1 322.865 4.268 20 0 DIADMN COc1ccccc1-c1ncc(-c2nc3cccc(C)c3[nH]2)cn1 ZINC000427443593 1042988688 /nfs/dbraw/zinc/98/86/88/1042988688.db2.gz VLSJDSNYLXANPZ-UHFFFAOYSA-N 0 1 316.364 4.004 20 0 DIADMN Fc1cccc([C@H]2C[C@H](N[C@H](c3ncc[nH]3)c3ccccc3)C2)c1 ZINC000280786976 1042990710 /nfs/dbraw/zinc/99/07/10/1042990710.db2.gz IZJWQIGTJBUABO-WDSOQIARSA-N 0 1 321.399 4.174 20 0 DIADMN Nc1c(F)cccc1CNCc1ccc(OC2CCCC2)cc1 ZINC000638864700 1042994435 /nfs/dbraw/zinc/99/44/35/1042994435.db2.gz BWDGYLGXXQNXLE-UHFFFAOYSA-N 0 1 314.404 4.019 20 0 DIADMN C[C@@H]1C[C@@H](NCc2cccc3c2NCCC3)c2ccccc2O1 ZINC000894881345 1042997711 /nfs/dbraw/zinc/99/77/11/1042997711.db2.gz OHWJGFKJLQXTIE-RDTXWAMCSA-N 0 1 308.425 4.047 20 0 DIADMN CCC[C@]1(C)CCC[N@@H+](Cc2ccc(C(=O)[O-])c(Cl)c2)C1 ZINC000519703445 1042998843 /nfs/dbraw/zinc/99/88/43/1042998843.db2.gz KLXHCUBEPPGHIZ-QGZVFWFLSA-N 0 1 309.837 4.440 20 0 DIADMN Cc1cccc2c1CCN(Cc1cnc(-c3ccccc3)nc1)C2 ZINC000729480431 1043003496 /nfs/dbraw/zinc/00/34/96/1043003496.db2.gz YWNWVSVLGHMOSA-UHFFFAOYSA-N 0 1 315.420 4.010 20 0 DIADMN COc1cc(F)c(CN[C@@H]2CCCc3sccc32)cc1OC ZINC000519819649 1043004683 /nfs/dbraw/zinc/00/46/83/1043004683.db2.gz AWFQFTHNOFWYHU-CQSZACIVSA-N 0 1 321.417 4.072 20 0 DIADMN CC[N@@H+](CC[C@H]1C[C@H](C)C[C@H](C)C1)C1CCC(C(=O)[O-])CC1 ZINC000519835837 1043004833 /nfs/dbraw/zinc/00/48/33/1043004833.db2.gz YNTKTGIVVVOISW-HTWWFHKTSA-N 0 1 309.494 4.414 20 0 DIADMN CC[C@H](c1ccccc1)N(CC)C(=O)c1cc(-c2ccoc2)[nH]n1 ZINC000519887461 1043007371 /nfs/dbraw/zinc/00/73/71/1043007371.db2.gz PMEHYTBZFHZCGV-GOSISDBHSA-N 0 1 323.396 4.283 20 0 DIADMN Cc1ccc2nc(C[N@@H+](Cc3ccc(F)cc3)C(C)C)cn2c1 ZINC000519918369 1043009733 /nfs/dbraw/zinc/00/97/33/1043009733.db2.gz ONXUQYWVGQOXTI-UHFFFAOYSA-N 0 1 311.404 4.192 20 0 DIADMN Cc1ccc2nc(CN(Cc3ccc(F)cc3)C(C)C)cn2c1 ZINC000519918369 1043009736 /nfs/dbraw/zinc/00/97/36/1043009736.db2.gz ONXUQYWVGQOXTI-UHFFFAOYSA-N 0 1 311.404 4.192 20 0 DIADMN CC[C@@H](F)C[N@@H+](CCc1ccccn1)Cc1ccc(F)cc1 ZINC000440782859 1043010021 /nfs/dbraw/zinc/01/00/21/1043010021.db2.gz PAJARGGTMDDJDX-MRXNPFEDSA-N 0 1 304.384 4.014 20 0 DIADMN CC[C@@H](F)CN(CCc1ccccn1)Cc1ccc(F)cc1 ZINC000440782859 1043010025 /nfs/dbraw/zinc/01/00/25/1043010025.db2.gz PAJARGGTMDDJDX-MRXNPFEDSA-N 0 1 304.384 4.014 20 0 DIADMN Cc1oc(-c2cccs2)nc1CN(C)CCc1ccccc1 ZINC000519969456 1043012243 /nfs/dbraw/zinc/01/22/43/1043012243.db2.gz CYJVAFKJUNOWPO-UHFFFAOYSA-N 0 1 312.438 4.386 20 0 DIADMN CCCCCCC(=O)N1CCN([C@@H](CC)c2ccccc2)CC1 ZINC001126497942 1043016616 /nfs/dbraw/zinc/01/66/16/1043016616.db2.gz QZDHKDDFTCDSTI-IBGZPJMESA-N 0 1 316.489 4.252 20 0 DIADMN CC(C)CC1(CN[C@H](c2ncc[nH]2)c2ccc(F)cc2)CC1 ZINC000188230005 1043017732 /nfs/dbraw/zinc/01/77/32/1043017732.db2.gz CYUFGUARLWAPDU-INIZCTEOSA-N 0 1 301.409 4.054 20 0 DIADMN CS[C@@H]1CCCCN([C@@H](C)c2nnc(-c3cccs3)o2)C1 ZINC000441096842 1043018954 /nfs/dbraw/zinc/01/89/54/1043018954.db2.gz BWURQYUZKSSEDE-NWDGAFQWSA-N 0 1 323.487 4.077 20 0 DIADMN CCCN(Cc1occc1C(=O)OC)[C@H](CC)c1ccccc1 ZINC000520172106 1043020816 /nfs/dbraw/zinc/02/08/16/1043020816.db2.gz SYFUAFCSRVSVOC-QGZVFWFLSA-N 0 1 315.413 4.430 20 0 DIADMN CC(C)N(Cc1ccco1)Cc1cc2c(c(Cl)c1)OCO2 ZINC000520168933 1043021552 /nfs/dbraw/zinc/02/15/52/1043021552.db2.gz IOXSNCYNDHVHSG-UHFFFAOYSA-N 0 1 307.777 4.072 20 0 DIADMN COC(=O)c1ccc(CN(Cc2ccccc2F)C(C)C)cc1 ZINC000520173827 1043021950 /nfs/dbraw/zinc/02/19/50/1043021950.db2.gz DAGJQVHMHFWNLB-UHFFFAOYSA-N 0 1 315.388 4.023 20 0 DIADMN CC(C)c1ccc([C@H](C)OC(=O)[C@H]2CCCc3[nH]ncc32)cc1 ZINC000783457453 1043023207 /nfs/dbraw/zinc/02/32/07/1043023207.db2.gz YUDHKBKSSYWBNP-BBRMVZONSA-N 0 1 312.413 4.257 20 0 DIADMN c1sc(C2CCCC2)nc1CN1CCC[C@H]([C@H]2CCOC2)C1 ZINC000441210853 1043028964 /nfs/dbraw/zinc/02/89/64/1043028964.db2.gz RBVUVQLWPORGMA-HOTGVXAUSA-N 0 1 320.502 4.049 20 0 DIADMN Fc1ccc(-n2ccc(CN3CCC[C@H]3c3ccccc3)n2)cc1 ZINC000441240691 1043029449 /nfs/dbraw/zinc/02/94/49/1043029449.db2.gz RBXXXDURRVGMGL-FQEVSTJZSA-N 0 1 321.399 4.349 20 0 DIADMN C[C@H](c1c(F)cccc1F)N(C)CCc1ccc2c(c1)CCO2 ZINC000441237005 1043029531 /nfs/dbraw/zinc/02/95/31/1043029531.db2.gz VRHALJVEJXBZDG-CYBMUJFWSA-N 0 1 317.379 4.135 20 0 DIADMN O=C(c1cc(C2CC2)[nH]n1)N(Cc1ccccc1)C1CCCCC1 ZINC000520272602 1043029766 /nfs/dbraw/zinc/02/97/66/1043029766.db2.gz VTABHQQRPRHBDL-UHFFFAOYSA-N 0 1 323.440 4.262 20 0 DIADMN CN(Cc1nc(CCc2ccccc2)no1)C1CCCCCC1 ZINC000441251984 1043030419 /nfs/dbraw/zinc/03/04/19/1043030419.db2.gz VHSORCBARILRLD-UHFFFAOYSA-N 0 1 313.445 4.009 20 0 DIADMN C[N@@H+](Cc1nc(CCc2ccccc2)no1)C1CCCCCC1 ZINC000441251984 1043030414 /nfs/dbraw/zinc/03/04/14/1043030414.db2.gz VHSORCBARILRLD-UHFFFAOYSA-N 0 1 313.445 4.009 20 0 DIADMN CCC[N@@H+](CCC(C)(C)CC)CC(=O)Nc1ccccc1OC ZINC000441245434 1043030457 /nfs/dbraw/zinc/03/04/57/1043030457.db2.gz FIZUGVNWDPHPQW-UHFFFAOYSA-N 0 1 320.477 4.172 20 0 DIADMN CO[C@H]1CCCC[C@H]1NCc1nc(C2CCCCC2)cs1 ZINC000441254918 1043031479 /nfs/dbraw/zinc/03/14/79/1043031479.db2.gz JSYXEPZXIIRQRC-ZBFHGGJFSA-N 0 1 308.491 4.238 20 0 DIADMN CCCCN(C)Cc1ncc(-c2ccc(Br)cc2)o1 ZINC000441263074 1043031919 /nfs/dbraw/zinc/03/19/19/1043031919.db2.gz PGHPJALBWWSXMF-UHFFFAOYSA-N 0 1 323.234 4.336 20 0 DIADMN CCCCc1noc(CN(C)[C@@H](CC)Cc2ccc(C)cc2)n1 ZINC000441337983 1043036698 /nfs/dbraw/zinc/03/66/98/1043036698.db2.gz VZSIZJVVLPMTEK-KRWDZBQOSA-N 0 1 315.461 4.174 20 0 DIADMN CN(Cc1nnc(-c2c(Cl)cccc2Cl)o1)C1CCC1 ZINC000441341049 1043039553 /nfs/dbraw/zinc/03/95/53/1043039553.db2.gz SFYYFCCLYJPMQN-UHFFFAOYSA-N 0 1 312.200 4.028 20 0 DIADMN CCCc1noc(CN(CC)[C@@H](CC)Cc2ccc(C)cc2)n1 ZINC000441366698 1043039996 /nfs/dbraw/zinc/03/99/96/1043039996.db2.gz VAOLOPDWLSEZTJ-KRWDZBQOSA-N 0 1 315.461 4.174 20 0 DIADMN CC(C)[C@H](C)[N@@H+](C)Cc1csc(COc2ccc(F)cc2)n1 ZINC000520386858 1043041537 /nfs/dbraw/zinc/04/15/37/1043041537.db2.gz BZBRYSJEEKOTMZ-ZDUSSCGKSA-N 0 1 322.449 4.338 20 0 DIADMN CC(C)[C@H](C)N(C)Cc1csc(COc2ccc(F)cc2)n1 ZINC000520386858 1043041538 /nfs/dbraw/zinc/04/15/38/1043041538.db2.gz BZBRYSJEEKOTMZ-ZDUSSCGKSA-N 0 1 322.449 4.338 20 0 DIADMN Cc1ccc([C@H]2CCC[C@@H]2N(C)Cc2nc(C(C)C)no2)cc1 ZINC000441379585 1043041693 /nfs/dbraw/zinc/04/16/93/1043041693.db2.gz PFBIOPNCIQNRHZ-SJORKVTESA-N 0 1 313.445 4.270 20 0 DIADMN Cc1cccc(NC(=O)CN2CCC[C@H]2c2ccc(C)c(C)c2)c1 ZINC000520392143 1043041732 /nfs/dbraw/zinc/04/17/32/1043041732.db2.gz MKVQRBSCBDSTJO-FQEVSTJZSA-N 0 1 322.452 4.387 20 0 DIADMN Fc1ccc(-n2ccc(CN3CCC4(CCCC4)CC3)n2)cc1 ZINC000441408989 1043044814 /nfs/dbraw/zinc/04/48/14/1043044814.db2.gz YIMMBJCBFCYZMW-UHFFFAOYSA-N 0 1 313.420 4.168 20 0 DIADMN CC(C)c1nc(CNC2(c3ccc(F)cc3)CC2)c2ccccn21 ZINC000520414912 1043045887 /nfs/dbraw/zinc/04/58/87/1043045887.db2.gz AJSGVCCHNCGUII-UHFFFAOYSA-N 0 1 323.415 4.376 20 0 DIADMN CC[C@@](C)(NC[C@H](O)c1cccc(Cl)c1)c1nc(C)cs1 ZINC000173941321 1043057147 /nfs/dbraw/zinc/05/71/47/1043057147.db2.gz PFGYUCMIDLKAGC-GOEBONIOSA-N 0 1 324.877 4.053 20 0 DIADMN CCc1ccc(CNCc2sccc2Br)cc1 ZINC000112838450 1043060710 /nfs/dbraw/zinc/06/07/10/1043060710.db2.gz 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/nfs/dbraw/zinc/38/48/10/1044384810.db2.gz MAMDXIDNGCNPPW-AWEZNQCLSA-N 0 1 319.445 4.333 20 0 DIADMN CCCC[C@H](C)N(C)C(=O)c1cccc2[nH]c(C(F)F)nc21 ZINC000936056664 1044385022 /nfs/dbraw/zinc/38/50/22/1044385022.db2.gz LOFSLFZWXXQLHD-JTQLQIEISA-N 0 1 309.360 4.151 20 0 DIADMN CC[C@@]1(C)CC[N@H+]([C@H](C(=O)[O-])c2cc(Cl)cc(Cl)c2)C1 ZINC000564463076 1044385125 /nfs/dbraw/zinc/38/51/25/1044385125.db2.gz QEMQHLWZHIAHCY-ZFWWWQNUSA-N 0 1 316.228 4.241 20 0 DIADMN COc1ccc([C@H](C)N(C)Cc2cncc(C(F)(F)F)c2)cc1 ZINC000361295004 1044385091 /nfs/dbraw/zinc/38/50/91/1044385091.db2.gz HDZRPDKUCLJTNF-LBPRGKRZSA-N 0 1 324.346 4.302 20 0 DIADMN CCCO[C@H]1CCCN(Cc2coc(-c3cccs3)n2)CC1 ZINC000108397494 1044385845 /nfs/dbraw/zinc/38/58/45/1044385845.db2.gz GKDWBIPZNRTXLE-HNNXBMFYSA-N 0 1 320.458 4.184 20 0 DIADMN CCS[C@@H]1CC[C@@H]([N@@H+](C)Cc2cncc(C(F)(F)F)c2)C1 ZINC000361318862 1044390950 /nfs/dbraw/zinc/39/09/50/1044390950.db2.gz QQIDHRXOZIOIKV-ZIAGYGMSSA-N 0 1 318.408 4.206 20 0 DIADMN CCN(CC(=O)Nc1c(C)cccc1C)[C@@H]1C[C@@H]1c1ccccc1 ZINC000361324760 1044392690 /nfs/dbraw/zinc/39/26/90/1044392690.db2.gz PMFUJAOIGPHRTN-RTBURBONSA-N 0 1 322.452 4.120 20 0 DIADMN COc1ccc([C@@H](NCc2cccc(O)c2Cl)C2CC2)cc1 ZINC000294249290 1044399485 /nfs/dbraw/zinc/39/94/85/1044399485.db2.gz UMXBERLQFUTLDP-SFHVURJKSA-N 0 1 317.816 4.295 20 0 DIADMN Cc1ccncc1CN(C)Cc1cccc(Br)c1C ZINC000361411841 1044402339 /nfs/dbraw/zinc/40/23/39/1044402339.db2.gz CHMQZSUOFVPOET-UHFFFAOYSA-N 0 1 319.246 4.093 20 0 DIADMN C[C@@H](NCc1ccccc1OC(F)F)c1ccc2c(c1)CCO2 ZINC000192942879 1044404854 /nfs/dbraw/zinc/40/48/54/1044404854.db2.gz MCZSQGYNPRGEIM-GFCCVEGCSA-N 0 1 319.351 4.074 20 0 DIADMN CCOc1ccc([C@H]2CCCN2Cc2nc(C)c(C)s2)cc1 ZINC000348283791 1044405085 /nfs/dbraw/zinc/40/50/85/1044405085.db2.gz RZYRPSVNDDNSHP-QGZVFWFLSA-N 0 1 316.470 4.496 20 0 DIADMN Cc1nocc1CNCc1ccc(OCc2cccc(C)c2)cc1 ZINC000294312989 1044406029 /nfs/dbraw/zinc/40/60/29/1044406029.db2.gz XMAWYCLGAGBNBZ-UHFFFAOYSA-N 0 1 322.408 4.160 20 0 DIADMN C[C@H](NCc1cccc(-n2ccnc2)c1)c1ccc(F)cc1F ZINC000361484376 1044408075 /nfs/dbraw/zinc/40/80/75/1044408075.db2.gz IVBNLWMOSKTWRQ-ZDUSSCGKSA-N 0 1 313.351 4.001 20 0 DIADMN Cc1nc2ccccc2nc1CN1C[C@@H](C)[C@H]1c1ccccc1 ZINC000248358609 1044408885 /nfs/dbraw/zinc/40/88/85/1044408885.db2.gz QZEGINQXVQEDON-VLIAUNLRSA-N 0 1 303.409 4.131 20 0 DIADMN Cc1ccccc1CN(CCc1cscn1)Cc1ccccn1 ZINC000565047747 1044409461 /nfs/dbraw/zinc/40/94/61/1044409461.db2.gz GTCVYFBQOJYRME-UHFFFAOYSA-N 0 1 323.465 4.091 20 0 DIADMN O=C([O-])c1ccccc1C[N@H+]1CCC[C@@H]1/C=C/c1ccccc1 ZINC000565102863 1044412732 /nfs/dbraw/zinc/41/27/32/1044412732.db2.gz CEHXDQTZRCPNCQ-QFQMRYFISA-N 0 1 307.393 4.063 20 0 DIADMN COc1cc(F)c(CN[C@@H](C)c2cccc(C)c2C)cc1OC ZINC000565079979 1044412889 /nfs/dbraw/zinc/41/28/89/1044412889.db2.gz ATXWKTMSDXYFSV-AWEZNQCLSA-N 0 1 317.404 4.311 20 0 DIADMN Cc1ccnc([C@@H]2CCN([C@@H](C)c3c(F)cccc3F)C2)c1 ZINC000565170398 1044417984 /nfs/dbraw/zinc/41/79/84/1044417984.db2.gz 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CC(C)c1nc(CN[C@H]2CCc3c2cccc3F)c2ccccn21 ZINC000565367032 1044429643 /nfs/dbraw/zinc/42/96/43/1044429643.db2.gz AABYLPFKGSMQDM-KRWDZBQOSA-N 0 1 323.415 4.374 20 0 DIADMN COc1cc(CN(C)[C@H](C)c2ccncc2)ccc1SC ZINC000111209321 1044429852 /nfs/dbraw/zinc/42/98/52/1044429852.db2.gz VMPKWQKOWWSYQV-CYBMUJFWSA-N 0 1 302.443 4.005 20 0 DIADMN CC[C@@H](c1ccccc1)[C@H]1CCC[N@H+]1Cc1ccoc1C(=O)[O-] ZINC000565425321 1044433592 /nfs/dbraw/zinc/43/35/92/1044433592.db2.gz FULWRXDCEWTPHT-DLBZAZTESA-N 0 1 313.397 4.136 20 0 DIADMN CC(C)CC1(C)CCN(Cc2nnc(-c3ccccc3)o2)CC1 ZINC000565442798 1044433703 /nfs/dbraw/zinc/43/37/03/1044433703.db2.gz DPBGSEAXIREVHM-UHFFFAOYSA-N 0 1 313.445 4.385 20 0 DIADMN COc1ccc(Cl)c(CNC(C)(C)c2ccc(C)nc2)c1 ZINC000361767660 1044442014 /nfs/dbraw/zinc/44/20/14/1044442014.db2.gz PXBAKTAXWUSSEF-UHFFFAOYSA-N 0 1 304.821 4.077 20 0 DIADMN CC[C@H](C)c1ccc(S(=O)(=O)Nc2nc(C)c(C)s2)cc1 ZINC000302791532 1044443397 /nfs/dbraw/zinc/44/33/97/1044443397.db2.gz GLAGVRCYUONYLN-JTQLQIEISA-N 0 1 324.471 4.074 20 0 DIADMN COCc1cc(CN[C@H](C)c2ccc(F)c(F)c2)ccc1F ZINC000112545768 1044443748 /nfs/dbraw/zinc/44/37/48/1044443748.db2.gz AEICDGKBHRURPZ-LLVKDONJSA-N 0 1 309.331 4.101 20 0 DIADMN CC(C)Oc1ccc(CNCc2cccc(C(F)(F)F)n2)cc1 ZINC000294668581 1044445305 /nfs/dbraw/zinc/44/53/05/1044445305.db2.gz APJPIXNURQLUJK-UHFFFAOYSA-N 0 1 324.346 4.177 20 0 DIADMN CO[C@@H](CN[C@@H](C)c1nc(-c2ccccc2)cs1)C(C)C ZINC000361805391 1044445575 /nfs/dbraw/zinc/44/55/75/1044445575.db2.gz TXZOZSFQOMUJEK-BBRMVZONSA-N 0 1 304.459 4.132 20 0 DIADMN c1cc2cc(CNCc3nccc4c3CCCC4)ccc2s1 ZINC001202656561 1044445600 /nfs/dbraw/zinc/44/56/00/1044445600.db2.gz XSKKOKRXGSQICZ-UHFFFAOYSA-N 0 1 308.450 4.465 20 0 DIADMN Cc1ccc2nc(CN[C@@H]3CCCOc4cc(C)ccc43)[nH]c2c1 ZINC000361813029 1044447915 /nfs/dbraw/zinc/44/79/15/1044447915.db2.gz NUOBCILNBDCZMI-MRXNPFEDSA-N 0 1 321.424 4.183 20 0 DIADMN CC[C@H](NCc1nc2ccc(C)cc2[nH]1)c1ccccc1OC ZINC000361814099 1044449185 /nfs/dbraw/zinc/44/91/85/1044449185.db2.gz 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FC1(F)C[C@@]12CCN(Cc1c(Cl)ncc3ccccc31)C2 ZINC001140721880 1046875325 /nfs/dbraw/zinc/87/53/25/1046875325.db2.gz CPNWRTOGIHGDEK-OAHLLOKOSA-N 0 1 308.759 4.119 20 0 DIADMN Clc1ncc2ccccc2c1CN1CC[C@@]2(C1)CCCCO2 ZINC001140720970 1046875989 /nfs/dbraw/zinc/87/59/89/1046875989.db2.gz DKFWJRUDDUYOCL-GOSISDBHSA-N 0 1 316.832 4.033 20 0 DIADMN CC(C)(C)c1ncc(CN[C@H]2CCCc3sccc32)cn1 ZINC000284311266 1046879225 /nfs/dbraw/zinc/87/92/25/1046879225.db2.gz JLPFVYZKPFFKJK-AWEZNQCLSA-N 0 1 301.459 4.003 20 0 DIADMN COc1cccc(Cl)c1CN1C[C@@H]2C[C@H](C1)c1ccccc12 ZINC001140730763 1046879353 /nfs/dbraw/zinc/87/93/53/1046879353.db2.gz ZWNYUKDBQXRWMP-OKILXGFUSA-N 0 1 313.828 4.435 20 0 DIADMN CC(C)(C)c1ccc(CN2CC[C@H](C(=O)c3ccccc3)C2)[nH]1 ZINC001137378863 1046881963 /nfs/dbraw/zinc/88/19/63/1046881963.db2.gz DYLZLZFHOIVRDP-INIZCTEOSA-N 0 1 310.441 4.017 20 0 DIADMN CC(C)(C)c1ncc(CNCc2ccc(C(F)(F)F)cc2)cn1 ZINC000284489874 1046887864 /nfs/dbraw/zinc/88/78/64/1046887864.db2.gz WYUDIQNARVDAAA-UHFFFAOYSA-N 0 1 323.362 4.083 20 0 DIADMN CCc1ccc(CN(C)Cc2cc(Br)ccn2)cc1 ZINC001140766737 1046891085 /nfs/dbraw/zinc/89/10/85/1046891085.db2.gz QNUYKMZLAXCESY-UHFFFAOYSA-N 0 1 319.246 4.039 20 0 DIADMN Clc1ccc2cccnc2c1CNCc1ccc2c(c1)COC2 ZINC000679720606 1046894307 /nfs/dbraw/zinc/89/43/07/1046894307.db2.gz VTEHXZOJHSPEGK-UHFFFAOYSA-N 0 1 324.811 4.208 20 0 DIADMN Cc1cc2c(o1)CC(C)(C)C[C@H]2NCc1cnc2ccccn12 ZINC000237835549 1046901404 /nfs/dbraw/zinc/90/14/04/1046901404.db2.gz ZSOJVIOOCHNOKV-MRXNPFEDSA-N 0 1 309.413 4.039 20 0 DIADMN Cc1ccccc1-c1noc(CN2CC[C@@]3(CC[C@@H](C)C3)C2)n1 ZINC000679835421 1046906752 /nfs/dbraw/zinc/90/67/52/1046906752.db2.gz JYEOGJOHRTYBOA-AUUYWEPGSA-N 0 1 311.429 4.057 20 0 DIADMN Cc1ccccc1-c1noc(CN2CC[C@@]3(CC[C@H](C)C3)C2)n1 ZINC000679835422 1046906793 /nfs/dbraw/zinc/90/67/93/1046906793.db2.gz JYEOGJOHRTYBOA-IFXJQAMLSA-N 0 1 311.429 4.057 20 0 DIADMN Cc1nn(C)cc1CN[C@H](C)c1ccccc1Oc1ccccc1 ZINC000161659715 1046910052 /nfs/dbraw/zinc/91/00/52/1046910052.db2.gz UMLLDTHGCRUKAB-MRXNPFEDSA-N 0 1 321.424 4.372 20 0 DIADMN Cc1nc2ccc(NC(=O)CC(C3CCC3)C3CCC3)cc2[nH]1 ZINC001137392629 1046911594 /nfs/dbraw/zinc/91/15/94/1046911594.db2.gz CUZBSCFAJILOCK-UHFFFAOYSA-N 0 1 311.429 4.416 20 0 DIADMN CCCCc1ccc(NC(=O)[C@H]2C[C@@H](C)Cc3cn[nH]c32)cc1 ZINC000646581589 1046912498 /nfs/dbraw/zinc/91/24/98/1046912498.db2.gz YWRLSJVMKRRYDB-GUYCJALGSA-N 0 1 311.429 4.057 20 0 DIADMN CCCCc1ccc(NC(=O)[C@@H]2C[C@H](C)Cc3cn[nH]c32)cc1 ZINC000646581587 1046913017 /nfs/dbraw/zinc/91/30/17/1046913017.db2.gz YWRLSJVMKRRYDB-CXAGYDPISA-N 0 1 311.429 4.057 20 0 DIADMN c1ccc2cc(C3CCN(Cc4cncnc4)CC3)ccc2c1 ZINC001137668044 1046914278 /nfs/dbraw/zinc/91/42/78/1046914278.db2.gz QMPYFJSRBNQJBP-UHFFFAOYSA-N 0 1 303.409 4.009 20 0 DIADMN COc1ccc(CN2CCC3(CC(F)(F)C3)CC2)c(Cl)c1 ZINC001140819973 1046914511 /nfs/dbraw/zinc/91/45/11/1046914511.db2.gz RXIPQLYYBQIUES-UHFFFAOYSA-N 0 1 315.791 4.360 20 0 DIADMN COc1ccc(CN(C)[C@@H]2CCc3ccccc32)c(Cl)c1 ZINC001140824149 1046917308 /nfs/dbraw/zinc/91/73/08/1046917308.db2.gz ZJMIDOZLKZTXGX-GOSISDBHSA-N 0 1 301.817 4.468 20 0 DIADMN C[N@@H+](Cc1ccc(F)cc1)Cc1cc(Cl)c([O-])c(Cl)c1 ZINC001140829415 1046917730 /nfs/dbraw/zinc/91/77/30/1046917730.db2.gz IWKUHDPMWWOBMZ-UHFFFAOYSA-N 0 1 314.187 4.470 20 0 DIADMN Cc1n[nH]c(C(C)C)c1C(=O)N[C@@H](C)c1ccc(F)cc1Cl ZINC000161897360 1046918283 /nfs/dbraw/zinc/91/82/83/1046918283.db2.gz KPPHSLLYLWCKPO-VIFPVBQESA-N 0 1 323.799 4.125 20 0 DIADMN CC1(C)Cc2ccccc2N(C(=O)c2ccc(O)c(Cl)c2)C1 ZINC000646752783 1046918753 /nfs/dbraw/zinc/91/87/53/1046918753.db2.gz WHYGOAMJLYFCPB-UHFFFAOYSA-N 0 1 315.800 4.275 20 0 DIADMN C[C@H](C1CC1)N(Cc1nnc(-c2ccccc2Cl)o1)C1CC1 ZINC000078535190 1046924060 /nfs/dbraw/zinc/92/40/60/1046924060.db2.gz VOEWTWDMQGXQBC-LLVKDONJSA-N 0 1 317.820 4.153 20 0 DIADMN CCC[C@H](N[C@@H](C)C[C@H](O)c1ccco1)c1ncccc1Cl ZINC000925295740 1046935207 /nfs/dbraw/zinc/93/52/07/1046935207.db2.gz ZNWQRFZOGOWCGN-QEJZJMRPSA-N 0 1 322.836 4.271 20 0 DIADMN CN(Cn1cc(-c2ccccc2)n(C)c1=S)C1CCCC1 ZINC000798196008 1046936799 /nfs/dbraw/zinc/93/67/99/1046936799.db2.gz RSKDCYMVVVVGEO-UHFFFAOYSA-N 0 1 301.459 4.055 20 0 DIADMN C[C@@H]1CN(c2ccnc3cc(F)ccc32)C[C@H](c2ccccc2)O1 ZINC000078695003 1046939526 /nfs/dbraw/zinc/93/95/26/1046939526.db2.gz ODEDXBRSTKSHLW-JLTOFOAXSA-N 0 1 322.383 4.340 20 0 DIADMN COc1cccc([C@@H]2CCCCN2Cc2c(N)cccc2F)c1 ZINC001140875376 1046939401 /nfs/dbraw/zinc/93/94/01/1046939401.db2.gz JOTKFNYGHMPHPW-IBGZPJMESA-N 0 1 314.404 4.144 20 0 DIADMN Fc1cc(CN2CC3CCC2CC3)cc(F)c1C(F)(F)F ZINC001140882674 1046940882 /nfs/dbraw/zinc/94/08/82/1046940882.db2.gz MRERJKDXLQRNJG-UHFFFAOYSA-N 0 1 305.290 4.358 20 0 DIADMN C[C@H]1CN(Cc2cc(F)c(C(F)(F)F)c(F)c2)C2(CC2)C1 ZINC001140882568 1046941149 /nfs/dbraw/zinc/94/11/49/1046941149.db2.gz IQNCCNPFGDUEJN-SECBINFHSA-N 0 1 305.290 4.358 20 0 DIADMN C[C@H](c1nc(C2(N)CCCC2)no1)c1ccc2ccccc2c1 ZINC000261605917 1046942862 /nfs/dbraw/zinc/94/28/62/1046942862.db2.gz ADGKRRAVNKGYQZ-ZDUSSCGKSA-N 0 1 307.397 4.103 20 0 DIADMN C/C(=C\c1nc([C@@H]2CCCN2)no1)c1ccc(C(F)(F)F)cc1 ZINC000647150716 1046945715 /nfs/dbraw/zinc/94/57/15/1046945715.db2.gz MJVXXLRJSPVKAM-LXKVQUBZSA-N 0 1 323.318 4.073 20 0 DIADMN COc1ccc(CN2CCCC[C@H]2c2ccccc2F)cc1N ZINC001140899354 1046946044 /nfs/dbraw/zinc/94/60/44/1046946044.db2.gz JGPNVFAFBKXFPP-SFHVURJKSA-N 0 1 314.404 4.144 20 0 DIADMN C[C@@H]1CC[C@@H](C(F)(F)F)CN1CCc1cccc(F)c1F ZINC000680077471 1046946212 /nfs/dbraw/zinc/94/62/12/1046946212.db2.gz HDUDVKWUBREOQN-ZYHUDNBSSA-N 0 1 307.306 4.170 20 0 DIADMN C[C@@H]1C[C@H](N[C@H](c2ccsc2)c2ccc(Cl)cc2)CO1 ZINC000647175317 1046949109 /nfs/dbraw/zinc/94/91/09/1046949109.db2.gz JEXVULQIVDTWNO-RLCCDNCMSA-N 0 1 307.846 4.258 20 0 DIADMN Clc1ccc(CN2CCC([C@H]3CCOC3)CC2)cc1Cl ZINC000680085266 1046949191 /nfs/dbraw/zinc/94/91/91/1046949191.db2.gz PCRXKDNEDLFGMR-AWEZNQCLSA-N 0 1 314.256 4.242 20 0 DIADMN CC[C@H](C)CCCCC(=O)NC[C@H](c1cccs1)N(C)C ZINC000680134300 1046949916 /nfs/dbraw/zinc/94/99/16/1046949916.db2.gz YMEZHSAPNIJCBL-LSDHHAIUSA-N 0 1 310.507 4.074 20 0 DIADMN Cc1cc(CN[C@@H]2COc3c2cccc3Cl)cc2cccnc12 ZINC000680129279 1046950620 /nfs/dbraw/zinc/95/06/20/1046950620.db2.gz PQKGSSXADOEEEJ-QGZVFWFLSA-N 0 1 324.811 4.420 20 0 DIADMN CC[C@@H](C)CCCCC(=O)NC[C@@H](c1ccsc1)N(C)C ZINC000680134548 1046950671 /nfs/dbraw/zinc/95/06/71/1046950671.db2.gz CFUJTIRIJPFARX-ZBFHGGJFSA-N 0 1 310.507 4.074 20 0 DIADMN COc1ccc([C@H](C)N(C)Cc2cnccc2C(F)(F)F)cc1 ZINC001140919443 1046951024 /nfs/dbraw/zinc/95/10/24/1046951024.db2.gz RJRGLPZPBFXKHI-LBPRGKRZSA-N 0 1 324.346 4.302 20 0 DIADMN C[C@H]([C@H](Oc1ccccc1)c1ccccc1)N(C)Cc1cnco1 ZINC001140933646 1046952698 /nfs/dbraw/zinc/95/26/98/1046952698.db2.gz BLBNFPGJQHDCJO-UZLBHIALSA-N 0 1 322.408 4.315 20 0 DIADMN COc1cc2c(cc1CNCc1ccc(Cl)s1)O[C@@H](C)C2 ZINC000096838440 1046953897 /nfs/dbraw/zinc/95/38/97/1046953897.db2.gz UYEZVVLQCFLTCC-JTQLQIEISA-N 0 1 323.845 4.023 20 0 DIADMN NC1(c2noc([C@@H]3C[C@@H]3c3cccc4ccccc43)n2)CCCC1 ZINC000261896444 1046954322 /nfs/dbraw/zinc/95/43/22/1046954322.db2.gz YAPDTLMCGBPXPM-IAGOWNOFSA-N 0 1 319.408 4.222 20 0 DIADMN COc1ccccc1C1(NCc2ccc3cnccc3c2)CC1 ZINC000647233141 1046958803 /nfs/dbraw/zinc/95/88/03/1046958803.db2.gz VZPGALCKNVLAKG-UHFFFAOYSA-N 0 1 304.393 4.022 20 0 DIADMN COc1cc(CNC2(c3ccccc3F)CCC2)cc(OC)c1 ZINC000647237361 1046958868 /nfs/dbraw/zinc/95/88/68/1046958868.db2.gz UOUFFPLQKVQGBF-UHFFFAOYSA-N 0 1 315.388 4.012 20 0 DIADMN COc1ccccc1C1(NCc2ccc(SC)s2)CC1 ZINC000647232958 1046959291 /nfs/dbraw/zinc/95/92/91/1046959291.db2.gz KNDNSIOZACDUKA-UHFFFAOYSA-N 0 1 305.468 4.258 20 0 DIADMN C[C@@H](c1cccs1)[N@@H+](CCCC(=O)[O-])Cc1ccccc1 ZINC000262288299 1046963594 /nfs/dbraw/zinc/96/35/94/1046963594.db2.gz XCUBGFDBHZXOFM-AWEZNQCLSA-N 0 1 303.427 4.176 20 0 DIADMN C[C@@H]1CCCC[C@@H]1CN1CCCC[C@H]1c1noc(C2CC2)n1 ZINC000680327551 1046963646 /nfs/dbraw/zinc/96/36/46/1046963646.db2.gz RWKRWENXKHCHBM-BMFZPTHFSA-N 0 1 303.450 4.300 20 0 DIADMN Fc1cccc([C@@H]2CCN2Cc2cc(-n3ccnc3)cs2)c1 ZINC000680328262 1046963691 /nfs/dbraw/zinc/96/36/91/1046963691.db2.gz DPFGMCFBAMNBLK-KRWDZBQOSA-N 0 1 313.401 4.020 20 0 DIADMN Cc1cc(CN2CCCC[C@@H]2c2ccccc2C(F)(F)F)n[nH]1 ZINC001203082954 1046964717 /nfs/dbraw/zinc/96/47/17/1046964717.db2.gz DRUJQZHFMGKTFF-MRXNPFEDSA-N 0 1 323.362 4.464 20 0 DIADMN Cc1cccc([C@@H]2CCCN2CC(=O)Nc2cc(C)ccc2C)c1 ZINC000615099626 1046967263 /nfs/dbraw/zinc/96/72/63/1046967263.db2.gz GZXKOZQUAUWXDS-FQEVSTJZSA-N 0 1 322.452 4.387 20 0 DIADMN Cc1cc2c[nH]nc2c(C(=O)N2C[C@@H](C)C[C@H]2c2ccccc2)c1 ZINC000343632180 1046968101 /nfs/dbraw/zinc/96/81/01/1046968101.db2.gz RRGANRHAPUGTJL-KSSFIOAISA-N 0 1 319.408 4.095 20 0 DIADMN Cc1cccc([C@@H]2CCCN2CC(=O)N[C@H](C)c2ccccc2)c1 ZINC000615099651 1046968261 /nfs/dbraw/zinc/96/82/61/1046968261.db2.gz RAXZSNPHQNWXJG-XLIONFOSSA-N 0 1 322.452 4.009 20 0 DIADMN COc1cc(C)c([C@H](C)Nc2cnn(-c3ccncc3)c2)cc1C ZINC000680345801 1046968249 /nfs/dbraw/zinc/96/82/49/1046968249.db2.gz BLHGQGHQMGINNO-HNNXBMFYSA-N 0 1 322.412 4.066 20 0 DIADMN CC[C@H]1c2ccccc2CC[N@@H+]1Cc1cc(F)c([O-])c(F)c1 ZINC001140990674 1046969941 /nfs/dbraw/zinc/96/99/41/1046969941.db2.gz MUENHHDJCIUIFF-KRWDZBQOSA-N 0 1 303.352 4.180 20 0 DIADMN CC[C@H]1c2ccccc2CCN1Cc1cc(F)c(O)c(F)c1 ZINC001140990674 1046969948 /nfs/dbraw/zinc/96/99/48/1046969948.db2.gz MUENHHDJCIUIFF-KRWDZBQOSA-N 0 1 303.352 4.180 20 0 DIADMN CSc1ccc2c(c1)[C@H](N[C@H](CO)c1ccsc1)CCC2 ZINC000647299913 1046971539 /nfs/dbraw/zinc/97/15/39/1046971539.db2.gz JRGDYCQEGKKYBT-IAGOWNOFSA-N 0 1 319.495 4.171 20 0 DIADMN FC1(F)CC2(CN(Cc3ccc(-c4ccccn4)s3)C2)C1 ZINC001141002615 1046975091 /nfs/dbraw/zinc/97/50/91/1046975091.db2.gz DSSWEBFNUROQOC-UHFFFAOYSA-N 0 1 306.381 4.041 20 0 DIADMN Cc1csc([C@@H](NCCOc2cc(C)cc(C)c2)C2CC2)n1 ZINC000680386780 1046976551 /nfs/dbraw/zinc/97/65/51/1046976551.db2.gz OKJANRQOLTUOEO-KRWDZBQOSA-N 0 1 316.470 4.188 20 0 DIADMN CC[C@H](NCc1ccc(CO)cc1)c1cccc(Cl)c1F ZINC000647322035 1046976977 /nfs/dbraw/zinc/97/69/77/1046976977.db2.gz CNUGGTKNUWDRMS-INIZCTEOSA-N 0 1 307.796 4.212 20 0 DIADMN Cc1noc([C@H](C)N[C@@H](C)C(c2ccccc2)c2ccccc2)n1 ZINC000680389111 1046977249 /nfs/dbraw/zinc/97/72/49/1046977249.db2.gz CPWAZRYSHHGIJW-GJZGRUSLSA-N 0 1 321.424 4.249 20 0 DIADMN CC[C@H](NCc1ccc(CO)cc1)c1cc(Cl)ccc1OC ZINC000647322924 1046977554 /nfs/dbraw/zinc/97/75/54/1046977554.db2.gz VCKXOYIDPGAWQJ-KRWDZBQOSA-N 0 1 319.832 4.082 20 0 DIADMN COc1ccc2c(c1)CCC[C@H]2NC1(c2ccccc2OC)CC1 ZINC000647329225 1046978372 /nfs/dbraw/zinc/97/83/72/1046978372.db2.gz JJTLCGCLLPKSLS-LJQANCHMSA-N 0 1 323.436 4.360 20 0 DIADMN Nc1ccc(Nc2ccncc2Oc2ccccc2)cc1Cl ZINC001212103613 1046978903 /nfs/dbraw/zinc/97/89/03/1046978903.db2.gz XJAFJZXGZXAQCE-UHFFFAOYSA-N 0 1 311.772 4.275 20 0 DIADMN COc1ccc([C@H](C)NC2(c3ccccc3OC)CC2)c(C)c1 ZINC000647329123 1046978840 /nfs/dbraw/zinc/97/88/40/1046978840.db2.gz HGFWFEJRBHOGGH-HNNXBMFYSA-N 0 1 311.425 4.352 20 0 DIADMN CC(F)(F)c1ccccc1NC(=O)c1ccc(Cl)c(O)c1 ZINC001141012909 1046979903 /nfs/dbraw/zinc/97/99/03/1046979903.db2.gz BSHNPYKSLCKFBK-UHFFFAOYSA-N 0 1 311.715 4.410 20 0 DIADMN COc1ccccc1C1(N[C@H]2CCCc3ccc(O)cc32)CC1 ZINC000647329501 1046980438 /nfs/dbraw/zinc/98/04/38/1046980438.db2.gz QNUHLGYXMWOFKO-SFHVURJKSA-N 0 1 309.409 4.057 20 0 DIADMN Oc1cccc2ccc(CN3CCC[C@H]3c3ccccc3F)nc12 ZINC001141023706 1046981499 /nfs/dbraw/zinc/98/14/99/1046981499.db2.gz TVZSEXOSJIZIKB-SFHVURJKSA-N 0 1 322.383 4.417 20 0 DIADMN CN(C/C=C/c1ccccc1)Cc1ccc2cccc(O)c2n1 ZINC001141021815 1046981626 /nfs/dbraw/zinc/98/16/26/1046981626.db2.gz LKSFWFHMLOEOIV-RMKNXTFCSA-N 0 1 304.393 4.086 20 0 DIADMN CN(Cc1cccc(Cl)c1)Cc1ccc2cccc(O)c2n1 ZINC001141023067 1046981957 /nfs/dbraw/zinc/98/19/57/1046981957.db2.gz DVFZORVYRFXGMO-UHFFFAOYSA-N 0 1 312.800 4.226 20 0 DIADMN Cc1ccccc1-c1cccc(C[N@@H+]2C[C@@H](C(=O)[O-])CC[C@H]2C)c1 ZINC000263108054 1046981977 /nfs/dbraw/zinc/98/19/77/1046981977.db2.gz BMFPQCBJROOONV-APWZRJJASA-N 0 1 323.436 4.347 20 0 DIADMN C[C@H](N[C@H]1C[C@@H](OC(C)(C)C)C1)c1nc(C(F)(F)F)cs1 ZINC000647343149 1046983774 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C[C@H](CN1CCO[C@@H](C(F)(F)F)CC1)c1cccc(Cl)c1 ZINC001183643371 1047951807 /nfs/dbraw/zinc/95/18/07/1047951807.db2.gz PZIRJVGRKFAICM-BXUZGUMPSA-N 0 1 321.770 4.097 20 0 DIADMN CCC[C@H]1CCC[N@H+]1Cc1nc2cc(Br)ccc2[nH]1 ZINC001198431654 1047955859 /nfs/dbraw/zinc/95/58/59/1047955859.db2.gz ZOWAKADGDSBGSA-LBPRGKRZSA-N 0 1 322.250 4.090 20 0 DIADMN CC1(C)CCC(C)(C)N(Cc2nc(-c3ccccc3F)no2)C1 ZINC001174724666 1047956752 /nfs/dbraw/zinc/95/67/52/1047956752.db2.gz JMNVXIIUTCOKIW-UHFFFAOYSA-N 0 1 317.408 4.276 20 0 DIADMN Cc1cc2cc(C(=O)Nc3cc(C(F)(F)F)n[nH]3)oc2cc1C ZINC000479706184 1047958247 /nfs/dbraw/zinc/95/82/47/1047958247.db2.gz QNWAFWLDNQFAMI-UHFFFAOYSA-N 0 1 323.274 4.044 20 0 DIADMN Cc1cc(Nc2cncc(C(F)(F)F)c2)c2ccccc2n1 ZINC001174740615 1047961131 /nfs/dbraw/zinc/96/11/31/1047961131.db2.gz PBGOJGJTOWYKJY-UHFFFAOYSA-N 0 1 303.287 4.123 20 0 DIADMN FC(F)(F)c1ccc(Nc2ccnn2-c2ccncc2)cc1 ZINC001174773359 1047967698 /nfs/dbraw/zinc/96/76/98/1047967698.db2.gz YJBCAIXFNOZFED-UHFFFAOYSA-N 0 1 304.275 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C[C@@H]1CO[C@H](c2ccccc2)CN1c1ccnc2ccccc21 ZINC000480037882 1048030075 /nfs/dbraw/zinc/03/00/75/1048030075.db2.gz AILPRLGXGUUCFP-QRWLVFNGSA-N 0 1 304.393 4.201 20 0 DIADMN CC(=O)Nc1ccc(CNCc2cc(Cl)ccc2Cl)cc1 ZINC001199078519 1048034301 /nfs/dbraw/zinc/03/43/01/1048034301.db2.gz RYUUAZHFKKRUCL-UHFFFAOYSA-N 0 1 323.223 4.242 20 0 DIADMN C[C@H](c1ccccc1Cl)N1Cc2c[nH]nc2CC(C)(C)C1 ZINC001174974148 1048036198 /nfs/dbraw/zinc/03/61/98/1048036198.db2.gz COMASMGYGOESEL-GFCCVEGCSA-N 0 1 303.837 4.209 20 0 DIADMN O=C(c1ccc(F)cc1O)N1CCC(CC2CCCCC2)CC1 ZINC001184371676 1048037670 /nfs/dbraw/zinc/03/76/70/1048037670.db2.gz XQVHGVWOYXFRJF-UHFFFAOYSA-N 0 1 319.420 4.354 20 0 DIADMN CCc1onc(C)c1CN[C@H]1c2cc(F)ccc2CC[C@@H]1C ZINC000927132799 1048043669 /nfs/dbraw/zinc/04/36/69/1048043669.db2.gz RHDCMAULWNVJNL-BBATYDOGSA-N 0 1 302.393 4.098 20 0 DIADMN C[C@H]1CO[C@H](c2ccccc2)CN1c1ccnc2cc(F)ccc21 ZINC000480066285 1048044681 /nfs/dbraw/zinc/04/46/81/1048044681.db2.gz CWGQFZZVICFTEV-XOBRGWDASA-N 0 1 322.383 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CCc1onc(C)c1CN[C@H](C)c1cccc(C(F)(F)F)c1 ZINC000927140818 1048111215 /nfs/dbraw/zinc/11/12/15/1048111215.db2.gz PSAULHXIZACNDY-SNVBAGLBSA-N 0 1 312.335 4.415 20 0 DIADMN C[C@H]1C[C@@H](c2ccccc2F)N(Cc2c(C3CC3)cnn2C)C1 ZINC000667654531 1048112531 /nfs/dbraw/zinc/11/25/31/1048112531.db2.gz DFILBLWZFUPYEW-UGSOOPFHSA-N 0 1 313.420 4.020 20 0 DIADMN C[C@@H]1C[C@H](c2ccccc2F)N(Cc2c(C3CC3)cnn2C)C1 ZINC000667654529 1048113442 /nfs/dbraw/zinc/11/34/42/1048113442.db2.gz DFILBLWZFUPYEW-FZKQIMNGSA-N 0 1 313.420 4.020 20 0 DIADMN Clc1ccccc1CCNCc1c(Cl)cncc1Cl ZINC001199883669 1048114206 /nfs/dbraw/zinc/11/42/06/1048114206.db2.gz LDWDCKNIALPNSA-UHFFFAOYSA-N 0 1 315.631 4.374 20 0 DIADMN CC[C@@H]1CCC[C@H]1CNC(=O)c1c(O)cc(Cl)cc1Cl ZINC001161338042 1048122855 /nfs/dbraw/zinc/12/28/55/1048122855.db2.gz HFVCKRHXTREMEW-ZJUUUORDSA-N 0 1 316.228 4.255 20 0 DIADMN Cc1ccc2c(c1C)OC[C@@H]2NCc1ccc(OCC2CC2)cc1 ZINC000480344615 1048127846 /nfs/dbraw/zinc/12/78/46/1048127846.db2.gz RGJRBJCNPIXNQK-FQEVSTJZSA-N 0 1 323.436 4.316 20 0 DIADMN CCc1ncc(CNCc2cccc(-c3cccc(C)c3)c2)cn1 ZINC001199981461 1048131636 /nfs/dbraw/zinc/13/16/36/1048131636.db2.gz UDFABBCJYUPHCS-UHFFFAOYSA-N 0 1 317.436 4.304 20 0 DIADMN COc1ccc(CNCc2ccc(OC3CCCCC3)cc2)o1 ZINC001199979743 1048131746 /nfs/dbraw/zinc/13/17/46/1048131746.db2.gz BBCYQIMJYDMRFQ-UHFFFAOYSA-N 0 1 315.413 4.290 20 0 DIADMN C[C@H](c1ccccc1)N1CC[C@H]([NH2+]Cc2ccsc2Cl)C1 ZINC000480397301 1048136385 /nfs/dbraw/zinc/13/63/85/1048136385.db2.gz QOAHQMSPKPOLHN-CJNGLKHVSA-N 0 1 320.889 4.327 20 0 DIADMN Fc1c(Nc2ccncc2)ccc(OCc2ccccc2)c1F ZINC001175084646 1048136672 /nfs/dbraw/zinc/13/66/72/1048136672.db2.gz UOGIYYUVJUBFEH-UHFFFAOYSA-N 0 1 312.319 4.104 20 0 DIADMN C[C@H](c1ccccc1)N1CC[C@@H]([NH2+]Cc2ccsc2Cl)C1 ZINC000480397302 1048136690 /nfs/dbraw/zinc/13/66/90/1048136690.db2.gz QOAHQMSPKPOLHN-CZUORRHYSA-N 0 1 320.889 4.327 20 0 DIADMN Cc1ccc([C@@H]2CCC[C@@H]2[N@@H+](C)Cc2cn(C3CCC3)nn2)cc1 ZINC000667670292 1048136778 /nfs/dbraw/zinc/13/67/78/1048136778.db2.gz JNQVKKFVHDGVNY-PMACEKPBSA-N 0 1 324.472 4.080 20 0 DIADMN Cc1ccc([C@@H]2CCC[C@@H]2N(C)Cc2cn(C3CCC3)nn2)cc1 ZINC000667670292 1048136790 /nfs/dbraw/zinc/13/67/90/1048136790.db2.gz JNQVKKFVHDGVNY-PMACEKPBSA-N 0 1 324.472 4.080 20 0 DIADMN CCC1(Nc2ccc3c(n2)CC[N@H+](Cc2ccccc2)C3)CCC1 ZINC001161562650 1048139275 /nfs/dbraw/zinc/13/92/75/1048139275.db2.gz NLHPCSLFHKGRFC-UHFFFAOYSA-N 0 1 321.468 4.385 20 0 DIADMN CCC1(Nc2ccc3c(n2)CCN(Cc2ccccc2)C3)CCC1 ZINC001161562650 1048139290 /nfs/dbraw/zinc/13/92/90/1048139290.db2.gz NLHPCSLFHKGRFC-UHFFFAOYSA-N 0 1 321.468 4.385 20 0 DIADMN C[C@@H]1CCN(Cc2c(C3CC3)cnn2C)[C@@H]1c1cccc(F)c1 ZINC000667675291 1048142757 /nfs/dbraw/zinc/14/27/57/1048142757.db2.gz CYONQKSQOADIBA-YJYMSZOUSA-N 0 1 313.420 4.020 20 0 DIADMN Cc1ccccc1CNc1cnc2cccc(Br)n12 ZINC001161624339 1048148102 /nfs/dbraw/zinc/14/81/02/1048148102.db2.gz XPQDJTXNVREOKU-UHFFFAOYSA-N 0 1 316.202 4.017 20 0 DIADMN CC(C)(C)CNc1nccc2c1CCN(Cc1ccccc1)C2 ZINC001161634871 1048149378 /nfs/dbraw/zinc/14/93/78/1048149378.db2.gz QEDDJYZPQZXWSO-UHFFFAOYSA-N 0 1 309.457 4.098 20 0 DIADMN COc1ccc2c(ccnc2NCC(C)(C)c2cccc(C)n2)c1 ZINC001161638974 1048149750 /nfs/dbraw/zinc/14/97/50/1048149750.db2.gz WBENGJMVWMSQRQ-UHFFFAOYSA-N 0 1 321.424 4.337 20 0 DIADMN Brc1ccc([C@H]2CCCN2C[C@@H]2CCC=CO2)cc1 ZINC000774844977 1048150399 /nfs/dbraw/zinc/15/03/99/1048150399.db2.gz BTQFABVMIRGYRI-JKSUJKDBSA-N 0 1 322.246 4.279 20 0 DIADMN CCOc1ccccc1CN[C@H](C)c1ccc(C(C)(C)O)cc1 ZINC000924742777 1048159893 /nfs/dbraw/zinc/15/98/93/1048159893.db2.gz SHHSOAITLNBWRG-OAHLLOKOSA-N 0 1 313.441 4.164 20 0 DIADMN C[C@H]1CN(Cc2nc(-c3c(F)cccc3F)cs2)C[C@H]1C ZINC000480522043 1048161314 /nfs/dbraw/zinc/16/13/14/1048161314.db2.gz FGKOQJOKNINNSI-PHIMTYICSA-N 0 1 308.397 4.176 20 0 DIADMN Cc1ccc(CN[C@H](C)c2nccn2-c2ccccc2)cc1C ZINC000554719847 1048165265 /nfs/dbraw/zinc/16/52/65/1048165265.db2.gz OQJXRZLZGKPYJC-QGZVFWFLSA-N 0 1 305.425 4.340 20 0 DIADMN CCC[C@H](C)CCNC(=O)c1c(O)cc(Cl)cc1Cl ZINC001161769566 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CCOCc1noc2c1CN(CC[C@H](C)CCC=C(C)C)CC2 ZINC001201974077 1048414896 /nfs/dbraw/zinc/41/48/96/1048414896.db2.gz UTMZLQFUOMHRJD-MRXNPFEDSA-N 0 1 320.477 4.342 20 0 DIADMN c1ccc([C@H]2c3ccccc3CCN2Cc2cccnc2)cc1 ZINC000555659502 1048417053 /nfs/dbraw/zinc/41/70/53/1048417053.db2.gz RPQFGXBNPRJRMN-NRFANRHFSA-N 0 1 300.405 4.229 20 0 DIADMN Cc1[nH]nc2ccc(Nc3nc(-c4ccncc4)cs3)cc12 ZINC001175692701 1048419469 /nfs/dbraw/zinc/41/94/69/1048419469.db2.gz GDHGAMCBDBYHJR-UHFFFAOYSA-N 0 1 307.382 4.133 20 0 DIADMN Cc1cc(CN2CCC(Cc3ccncc3)CC2)cc(F)c1F ZINC001143609671 1048422190 /nfs/dbraw/zinc/42/21/90/1048422190.db2.gz IEZPUMDQJFHZEP-UHFFFAOYSA-N 0 1 316.395 4.123 20 0 DIADMN Cc1cc(CN2CC[C@H](Oc3ccc(F)cc3)C2)cc(F)c1F ZINC001143606986 1048423211 /nfs/dbraw/zinc/42/32/11/1048423211.db2.gz KJFDNGUMQZZWDF-INIZCTEOSA-N 0 1 321.342 4.066 20 0 DIADMN Cc1cc(CN2CC[C@@H](Oc3ccc(F)cc3)C2)cc(F)c1F ZINC001143606987 1048423451 /nfs/dbraw/zinc/42/34/51/1048423451.db2.gz KJFDNGUMQZZWDF-MRXNPFEDSA-N 0 1 321.342 4.066 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C[C@@H]1CC[C@H](C)N(CC(=O)Nc2ccc(-c3ccccc3)cc2)C1 ZINC001191193644 1048877314 /nfs/dbraw/zinc/87/73/14/1048877314.db2.gz NFYMCISPLIKONZ-SJORKVTESA-N 0 1 322.452 4.413 20 0 DIADMN Cc1ccc2[nH]c(CN[C@H]3c4cccc(F)c4CC[C@@H]3C)nc2c1 ZINC000483871803 1048877934 /nfs/dbraw/zinc/87/79/34/1048877934.db2.gz VCQWNUIZPYFBHX-RNODOKPDSA-N 0 1 323.415 4.424 20 0 DIADMN Cc1ccc2nc(CN[C@H]3c4cccc(F)c4CC[C@@H]3C)[nH]c2c1 ZINC000483871803 1048877955 /nfs/dbraw/zinc/87/79/55/1048877955.db2.gz VCQWNUIZPYFBHX-RNODOKPDSA-N 0 1 323.415 4.424 20 0 DIADMN Fc1cccc(CN2CC=C(c3ccc(Cl)nc3)CC2)c1 ZINC000773658780 1048883289 /nfs/dbraw/zinc/88/32/89/1048883289.db2.gz MKERKYXULMBZLA-UHFFFAOYSA-N 0 1 302.780 4.163 20 0 DIADMN Clc1ccc(C2=CCN(C[C@@H]3CC3(Cl)Cl)CC2)cn1 ZINC000773663609 1048884014 /nfs/dbraw/zinc/88/40/14/1048884014.db2.gz CBEFQFKUNYGWAM-LBPRGKRZSA-N 0 1 317.647 4.018 20 0 DIADMN Clc1ccc(CN2CC[C@H](COCC3CC3)C2)c(Cl)c1 ZINC001203392519 1048888656 /nfs/dbraw/zinc/88/86/56/1048888656.db2.gz BZTIUUVGIZLPBT-ZDUSSCGKSA-N 0 1 314.256 4.242 20 0 DIADMN COC[C@@]12CCC[C@@H]1CN(Cc1ccc(Cl)cc1Cl)C2 ZINC001203390272 1048891165 /nfs/dbraw/zinc/89/11/65/1048891165.db2.gz APJYGCMHQIXTHG-CJNGLKHVSA-N 0 1 314.256 4.242 20 0 DIADMN C[C@@H]1CC[C@@H](C)N(Cc2cc(F)ccc2Br)C1 ZINC001191191418 1048892410 /nfs/dbraw/zinc/89/24/10/1048892410.db2.gz BCVOKTAPGSOQKS-GHMZBOCLSA-N 0 1 300.215 4.209 20 0 DIADMN Clc1cccc(Cl)c1CN1CC[C@H](c2cccnc2)C1 ZINC001203418319 1048895990 /nfs/dbraw/zinc/89/59/90/1048895990.db2.gz DMEMJXWTZJCPKJ-ZDUSSCGKSA-N 0 1 307.224 4.378 20 0 DIADMN CCc1ccc([C@@H]2C[C@H](C)CCN2Cc2cc(C)nc(C)n2)o1 ZINC001191257704 1048896772 /nfs/dbraw/zinc/89/67/72/1048896772.db2.gz KCDTVGFLGCAAAT-ACJLOTCBSA-N 0 1 313.445 4.222 20 0 DIADMN CCOc1ccc(CNCc2ccccc2OCC(F)F)cc1 ZINC001177487975 1048897752 /nfs/dbraw/zinc/89/77/52/1048897752.db2.gz YRPWVGKGDDVQEC-UHFFFAOYSA-N 0 1 321.367 4.019 20 0 DIADMN CCOc1cc(F)cc(CN[C@@H](C)c2ccccc2OC)c1 ZINC001203428988 1048901103 /nfs/dbraw/zinc/90/11/03/1048901103.db2.gz SRVNUKSPNCCRJH-ZDUSSCGKSA-N 0 1 303.377 4.084 20 0 DIADMN O=C([O-])CC[C@@H]1CCCC[N@H+]1Cc1csc2ccccc12 ZINC000111312644 1048902792 /nfs/dbraw/zinc/90/27/92/1048902792.db2.gz OEMRXYXPQOPBLY-AWEZNQCLSA-N 0 1 303.427 4.121 20 0 DIADMN CCCCOc1ncccc1CNC/C=C/c1ccc(F)cc1 ZINC001177501035 1048902697 /nfs/dbraw/zinc/90/26/97/1048902697.db2.gz AFPGPMUGGLQDTL-GQCTYLIASA-N 0 1 314.404 4.203 20 0 DIADMN C[C@@H]1Cc2ccccc2N1CCNCc1c(F)cccc1Cl ZINC001177515111 1048904120 /nfs/dbraw/zinc/90/41/20/1048904120.db2.gz BJKDLDPXPWOGOP-CYBMUJFWSA-N 0 1 318.823 4.020 20 0 DIADMN CC[C@H](C)Oc1cccc(NC(=O)c2c(C)n[nH]c2C(C)C)c1 ZINC000484138874 1048904500 /nfs/dbraw/zinc/90/45/00/1048904500.db2.gz WMLAGPOSDDWHQX-LBPRGKRZSA-N 0 1 315.417 4.271 20 0 DIADMN C[C@@H](O)c1ccc(CNCc2cccc(Cl)c2Cl)cc1 ZINC001177479518 1048906568 /nfs/dbraw/zinc/90/65/68/1048906568.db2.gz SSFCRSIYUXFFSZ-LLVKDONJSA-N 0 1 310.224 4.337 20 0 DIADMN CC[C@H](c1ccccc1)N1CCN(C/C(Cl)=C\Cl)CC1 ZINC001191245321 1048908673 /nfs/dbraw/zinc/90/86/73/1048908673.db2.gz SNJSCGRJWLGNPF-ASNKMWSDSA-N 0 1 313.272 4.074 20 0 DIADMN Cc1ccc2[nH]c(NCc3ccsc3Br)nc2c1 ZINC001203479077 1048912941 /nfs/dbraw/zinc/91/29/41/1048912941.db2.gz OESAWGSBKXYDLP-UHFFFAOYSA-N 0 1 322.231 4.307 20 0 DIADMN Cc1cnc(COc2ccc(CN3CCCC3)c(Cl)c2)s1 ZINC000853725829 1048916788 /nfs/dbraw/zinc/91/67/88/1048916788.db2.gz DVCUXURTPLJIEH-UHFFFAOYSA-N 0 1 322.861 4.280 20 0 DIADMN COc1ccc2c(c1)nccc2Nc1cnccc1C(F)(F)F ZINC001203520313 1048917695 /nfs/dbraw/zinc/91/76/95/1048917695.db2.gz PQAIFHSSZFMIFD-UHFFFAOYSA-N 0 1 319.286 4.401 20 0 DIADMN COc1ccc2c(c1)nccc2Nc1ccc(C(F)F)nc1 ZINC001203522050 1048918113 /nfs/dbraw/zinc/91/81/13/1048918113.db2.gz HWOFAGYODNJGFF-UHFFFAOYSA-N 0 1 301.296 4.320 20 0 DIADMN COc1ccc2c(c1)nccc2Nc1ccc(C(F)F)cn1 ZINC001203525137 1048919071 /nfs/dbraw/zinc/91/90/71/1048919071.db2.gz STSWVABJMDITBG-UHFFFAOYSA-N 0 1 301.296 4.320 20 0 DIADMN COc1ccc2c(c1)nccc2Nc1cc(C)nn1C1CCC1 ZINC001203524840 1048919980 /nfs/dbraw/zinc/91/99/80/1048919980.db2.gz DEPSDRDQBHTXEG-UHFFFAOYSA-N 0 1 308.385 4.217 20 0 DIADMN COc1ccc2c(c1)nccc2Nc1ccc(C)c(NC(C)=O)c1 ZINC001203526414 1048921451 /nfs/dbraw/zinc/92/14/51/1048921451.db2.gz WFKNLFGNBLOITJ-UHFFFAOYSA-N 0 1 321.380 4.254 20 0 DIADMN COc1ccc2c(c1)nccc2Nc1cccc(Cl)c1CO ZINC001203527913 1048921695 /nfs/dbraw/zinc/92/16/95/1048921695.db2.gz GRZFWEZNUIZEDX-UHFFFAOYSA-N 0 1 314.772 4.133 20 0 DIADMN COc1ccc2c(c1)nccc2Nc1ccc2c(c1)c(C)nn2C ZINC001203527921 1048921913 /nfs/dbraw/zinc/92/19/13/1048921913.db2.gz GWQVPKBYZSWKRL-UHFFFAOYSA-N 0 1 318.380 4.182 20 0 DIADMN CCc1ccc(N2CCN([C@H](C)c3cccc(F)c3)CC2)cc1 ZINC001191350479 1048922326 /nfs/dbraw/zinc/92/23/26/1048922326.db2.gz MQBIKKZFGXXZCP-MRXNPFEDSA-N 0 1 312.432 4.271 20 0 DIADMN COc1ccc2c(c1)nccc2Nc1c(OC)cccc1OC ZINC001203526315 1048922431 /nfs/dbraw/zinc/92/24/31/1048922431.db2.gz SRPYOPAOAZOAJD-UHFFFAOYSA-N 0 1 310.353 4.004 20 0 DIADMN Cc1ccc(NC(=O)CN2CCCC3(C2)CCCCCC3)cc1 ZINC001191350203 1048922718 /nfs/dbraw/zinc/92/27/18/1048922718.db2.gz IFBKAQYTVMUWHH-UHFFFAOYSA-N 0 1 314.473 4.370 20 0 DIADMN Cc1ccccc1C(C)(C)C[NH2+]Cc1cccc([O-])c1Cl ZINC001177599450 1048922614 /nfs/dbraw/zinc/92/26/14/1048922614.db2.gz JZFVAFRIIZNCOS-UHFFFAOYSA-N 0 1 303.833 4.421 20 0 DIADMN CCc1ccc(N2CCN([C@@H](C)c3cccc(F)c3)CC2)cc1 ZINC001191350478 1048923106 /nfs/dbraw/zinc/92/31/06/1048923106.db2.gz MQBIKKZFGXXZCP-INIZCTEOSA-N 0 1 312.432 4.271 20 0 DIADMN Cc1noc(C)c1CN[C@H](Cc1ccccc1)c1ccccc1 ZINC000194803197 1048925417 /nfs/dbraw/zinc/92/54/17/1048925417.db2.gz UOJDSPZVLVSWCN-HXUWFJFHSA-N 0 1 306.409 4.365 20 0 DIADMN CC1=C[C@@H](C)CN(Cc2cc3cnn(C(C)C)c3nc2Cl)C1 ZINC000797605712 1048927445 /nfs/dbraw/zinc/92/74/45/1048927445.db2.gz VMTIDODEOABGTL-GFCCVEGCSA-N 0 1 318.852 4.064 20 0 DIADMN FC(F)Oc1ccc(CNc2nc3ccc(Cl)cc3[nH]2)cc1 ZINC001203573164 1048932249 /nfs/dbraw/zinc/93/22/49/1048932249.db2.gz VUAZXKKHTHDTPS-UHFFFAOYSA-N 0 1 323.730 4.430 20 0 DIADMN COc1ccc(CN[C@@H](C)c2ccccc2SC)cc1F ZINC000194839954 1048932318 /nfs/dbraw/zinc/93/23/18/1048932318.db2.gz SEFKXYPPEKCYQB-LBPRGKRZSA-N 0 1 305.418 4.407 20 0 DIADMN Fc1ccc(F)c(CNC2CC(Nc3ccccc3)C2)c1Cl ZINC001203580037 1048934542 /nfs/dbraw/zinc/93/45/42/1048934542.db2.gz GIYPMUMLWNFDJM-UHFFFAOYSA-N 0 1 322.786 4.351 20 0 DIADMN C[C@H](COCC(F)(F)F)NCc1cccc(Cl)c1Cl ZINC001177707475 1048934958 /nfs/dbraw/zinc/93/49/58/1048934958.db2.gz KPEFYFBCKBRXPO-MRVPVSSYSA-N 0 1 316.150 4.050 20 0 DIADMN Cc1nc(C2(NC[C@H]3CCCC(C)(C)C3)CCCCC2)no1 ZINC001177697844 1048935324 /nfs/dbraw/zinc/93/53/24/1048935324.db2.gz HPVHBMAMOKWKGZ-HNNXBMFYSA-N 0 1 305.466 4.343 20 0 DIADMN CCN(C)c1ccccc1CNCc1ccccc1OC(F)F ZINC001177693814 1048935349 /nfs/dbraw/zinc/93/53/49/1048935349.db2.gz ZGUGMTJZSVKICU-UHFFFAOYSA-N 0 1 320.383 4.034 20 0 DIADMN CN(C)c1cccc(CNCc2cc(Cl)ccc2Cl)c1 ZINC001177718751 1048937489 /nfs/dbraw/zinc/93/74/89/1048937489.db2.gz JPTHNNQEZPSFAQ-UHFFFAOYSA-N 0 1 309.240 4.349 20 0 DIADMN CCn1nc(CN[C@H](C)c2ccc(F)cc2C)c2ccccc21 ZINC001203598499 1048939245 /nfs/dbraw/zinc/93/92/45/1048939245.db2.gz TVHSSCFMNORCAG-CQSZACIVSA-N 0 1 311.404 4.355 20 0 DIADMN CCCCCCN1CC(C)(c2nnc(-c3cccc(F)c3)o2)C1 ZINC000854088598 1048939969 /nfs/dbraw/zinc/93/99/69/1048939969.db2.gz SBQZNGUGWKTOGM-UHFFFAOYSA-N 0 1 317.408 4.029 20 0 DIADMN Cc1cc(C)c(/C=C\C[NH2+][C@H](C(=O)[O-])c2ccsc2)c(C)c1 ZINC000904002285 1048940439 /nfs/dbraw/zinc/94/04/39/1048940439.db2.gz RNHXLEPMSCXXFJ-CHYADLBTSA-N 0 1 315.438 4.102 20 0 DIADMN C[C@H](NCc1cnc(C(C)(C)C)s1)c1cccc([N+](=O)[O-])c1 ZINC000067975083 1048940429 /nfs/dbraw/zinc/94/04/29/1048940429.db2.gz OBFMBNQNWDHFBZ-NSHDSACASA-N 0 1 319.430 4.200 20 0 DIADMN CC[C@@H](NC)c1nc(-c2ccc(OC3CCCCC3)cc2)no1 ZINC000854146222 1048943085 /nfs/dbraw/zinc/94/30/85/1048943085.db2.gz GJKWJXWEEXSHCE-MRXNPFEDSA-N 0 1 315.417 4.119 20 0 DIADMN CCOc1cc2c(cc1CN[C@H](C)c1cccs1)O[C@H](C)C2 ZINC000194885512 1048943902 /nfs/dbraw/zinc/94/39/02/1048943902.db2.gz OYCBQMBKBKQHRN-CHWSQXEVSA-N 0 1 317.454 4.321 20 0 DIADMN COc1ccc(Cl)c(CN2CC[C@@H]2Cc2ccccc2)c1 ZINC001191437383 1048945909 /nfs/dbraw/zinc/94/59/09/1048945909.db2.gz SJKHZMIGFBGHQC-MRXNPFEDSA-N 0 1 301.817 4.166 20 0 DIADMN COc1ccccc1C1(NCc2ccc3scnc3c2)CCC1 ZINC001177865330 1048946993 /nfs/dbraw/zinc/94/69/93/1048946993.db2.gz XBJWGUSLMIQFPZ-UHFFFAOYSA-N 0 1 324.449 4.474 20 0 DIADMN COc1ccc(Cl)c(CN2CC[C@H]2Cc2ccccc2)c1 ZINC001191437382 1048947063 /nfs/dbraw/zinc/94/70/63/1048947063.db2.gz SJKHZMIGFBGHQC-INIZCTEOSA-N 0 1 301.817 4.166 20 0 DIADMN C[C@@H](OC(=O)Cc1cccs1)c1nc2ccc(Cl)cc2[nH]1 ZINC000111991105 1048947643 /nfs/dbraw/zinc/94/76/43/1048947643.db2.gz YOUFAOAHHLDSBK-SECBINFHSA-N 0 1 320.801 4.125 20 0 DIADMN Cc1cc(C)c(/C=C\CNCc2cn3c(cccc3C)n2)c(C)c1 ZINC001177810668 1048947788 /nfs/dbraw/zinc/94/77/88/1048947788.db2.gz NSSLVWRBPFVQIZ-VURMDHGXSA-N 0 1 319.452 4.371 20 0 DIADMN c1cc(Nc2cccnc2-c2ccccc2)n(-c2ccncc2)n1 ZINC001203649929 1048949148 /nfs/dbraw/zinc/94/91/48/1048949148.db2.gz YKKGGTAVEPICHP-UHFFFAOYSA-N 0 1 313.364 4.073 20 0 DIADMN C[C@@H](CCC1CCCCC1)NCc1cnn(-c2ccccc2)n1 ZINC001177844703 1048951660 /nfs/dbraw/zinc/95/16/60/1048951660.db2.gz SXMUEARZMIXLKT-INIZCTEOSA-N 0 1 312.461 4.106 20 0 DIADMN C[C@@H]1[C@@H](C)CCN1Cc1cccc(Br)c1Cl ZINC001191486935 1048952710 /nfs/dbraw/zinc/95/27/10/1048952710.db2.gz WMDRSXOEPWRYFU-VHSXEESVSA-N 0 1 302.643 4.333 20 0 DIADMN Cc1cccc(-c2cccc(CNCc3cnc(C)nc3)c2)c1 ZINC000338959237 1048954131 /nfs/dbraw/zinc/95/41/31/1048954131.db2.gz WBFIWDKJTLHQFR-UHFFFAOYSA-N 0 1 303.409 4.050 20 0 DIADMN CC1(C)CN(C(=O)c2cccc(F)c2O)c2ccccc2S1 ZINC001126985701 1048955277 /nfs/dbraw/zinc/95/52/77/1048955277.db2.gz JOAZKHOOLWQECC-UHFFFAOYSA-N 0 1 317.385 4.062 20 0 DIADMN Cc1[nH]c(SC[C@H]2CCC(C)(C)O2)nc1Cc1ccccc1 ZINC000484503608 1048955710 /nfs/dbraw/zinc/95/57/10/1048955710.db2.gz PJKPXMAQHASPTM-OAHLLOKOSA-N 0 1 316.470 4.359 20 0 DIADMN CO[C@@H]1CCN([C@@H](c2ccc(F)cc2)c2ccc(Cl)cc2)C1 ZINC001191455115 1048956029 /nfs/dbraw/zinc/95/60/29/1048956029.db2.gz UXXFXEISULDVBU-QZTJIDSGSA-N 0 1 319.807 4.289 20 0 DIADMN C[C@@H](NC/C=C/c1ccc(F)cc1)c1nc2ccccc2n1C ZINC001177903806 1048957905 /nfs/dbraw/zinc/95/79/05/1048957905.db2.gz DNBFQBSODFRFMO-VBROQKIQSA-N 0 1 309.388 4.076 20 0 DIADMN CC(C)[C@@H]1CCN(Cc2c(F)cccc2Br)C1 ZINC001191540981 1048960413 /nfs/dbraw/zinc/96/04/13/1048960413.db2.gz KXQKHCROXDOAAW-LLVKDONJSA-N 0 1 300.215 4.066 20 0 DIADMN CC[C@@H]1CCN(Cc2cc(Cl)cc(Br)c2)C1 ZINC001191557947 1048965249 /nfs/dbraw/zinc/96/52/49/1048965249.db2.gz APJJAJAPDAPKTQ-SNVBAGLBSA-N 0 1 302.643 4.334 20 0 DIADMN CCc1ccccc1NC(=O)CN1CCC[C@H]1c1ccc(C)cc1 ZINC000484573244 1048971854 /nfs/dbraw/zinc/97/18/54/1048971854.db2.gz QWBAFKUMPSQHSQ-FQEVSTJZSA-N 0 1 322.452 4.333 20 0 DIADMN c1cc2ccc(-c3noc([C@@H]4CC[C@@H]5CCCC[C@@H]5N4)n3)cc2[nH]1 ZINC000904088410 1048972038 /nfs/dbraw/zinc/97/20/38/1048972038.db2.gz AGSLNDOLARBWQC-RCBQFDQVSA-N 0 1 322.412 4.201 20 0 DIADMN C[C@H](c1noc([C@@H]2CC[C@@H]3CCCC[C@@H]3N2)n1)c1cccs1 ZINC000904094700 1048974676 /nfs/dbraw/zinc/97/46/76/1048974676.db2.gz SGMWKURAKMDJMR-XUXIUFHCSA-N 0 1 317.458 4.266 20 0 DIADMN CC[C@H](NCc1ccc(Cl)o1)c1ccc2c(c1)CCCO2 ZINC000776746415 1048975196 /nfs/dbraw/zinc/97/51/96/1048975196.db2.gz ZTZLSIAAYIIQPU-HNNXBMFYSA-N 0 1 305.805 4.499 20 0 DIADMN Cc1cn(C)nc1CN[C@@H](c1ccc(CC(C)C)cc1)C(C)C ZINC001191664738 1048979342 /nfs/dbraw/zinc/97/93/42/1048979342.db2.gz YQUMRGWAANNHPR-HXUWFJFHSA-N 0 1 313.489 4.414 20 0 DIADMN Cc1ccc(Cl)c(NC(=O)Nc2cc(O)c(F)c(F)c2)c1 ZINC001191703624 1048980925 /nfs/dbraw/zinc/98/09/25/1048980925.db2.gz XOWWJWDGPJASNB-UHFFFAOYSA-N 0 1 312.703 4.276 20 0 DIADMN Cc1ccc(CN(C)Cc2cncc(Br)c2)c(C)c1 ZINC001203731031 1048984086 /nfs/dbraw/zinc/98/40/86/1048984086.db2.gz BPIIJZQJXYQMCB-UHFFFAOYSA-N 0 1 319.246 4.093 20 0 DIADMN CCCCC[C@H](CC)C(=O)Nc1c(=O)[nH][nH]c1-c1ccccc1 ZINC000854644804 1048984276 /nfs/dbraw/zinc/98/42/76/1048984276.db2.gz SVZYMJLYYUZLDD-ZDUSSCGKSA-N 0 1 315.417 4.327 20 0 DIADMN COc1ccc([C@@H](C)NCc2ccc(Cl)nc2)cc1Cl 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Cc1nc(CN[C@@H]2CCCC[C@@H]2Oc2cccc(C)c2)oc1C ZINC000484633504 1048999753 /nfs/dbraw/zinc/99/97/53/1048999753.db2.gz OZMMPSMEITWDQE-MSOLQXFVSA-N 0 1 314.429 4.080 20 0 DIADMN CN(C(=O)c1cc(C2CC2)[nH]n1)[C@@H]1CCCC[C@H]1c1ccccc1 ZINC000854954576 1049001215 /nfs/dbraw/zinc/00/12/15/1049001215.db2.gz YVTBTLXKAAIUFJ-QFBILLFUSA-N 0 1 323.440 4.086 20 0 DIADMN CN(C(=O)c1cc(C2CC2)[nH]n1)[C@@H]1CCCC[C@@H]1c1ccccc1 ZINC000854954578 1049002113 /nfs/dbraw/zinc/00/21/13/1049002113.db2.gz YVTBTLXKAAIUFJ-VQIMIIECSA-N 0 1 323.440 4.086 20 0 DIADMN COC[C@@]12CCC[C@@H]1CN(Cc1cc(Cl)cc(Cl)c1)C2 ZINC001203808208 1049005143 /nfs/dbraw/zinc/00/51/43/1049005143.db2.gz JMKMQXDRLKSEFU-CJNGLKHVSA-N 0 1 314.256 4.242 20 0 DIADMN [O-]c1cc(Nc2ccc(C[NH+]3CCCC3)cc2)cc(F)c1F ZINC001203816493 1049006805 /nfs/dbraw/zinc/00/68/05/1049006805.db2.gz BDYODMFCCVTZFV-UHFFFAOYSA-N 0 1 304.340 4.010 20 0 DIADMN COc1ccc(Oc2cccc(CN3CCSCC3)c2)cc1 ZINC001203813718 1049007869 /nfs/dbraw/zinc/00/78/69/1049007869.db2.gz 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DIADMN Cc1nc(CN(C)[C@@H]2CCC(C)(C)C2)sc1Br ZINC001194042532 1049305684 /nfs/dbraw/zinc/30/56/84/1049305684.db2.gz VZIZXXREPWVQQJ-SNVBAGLBSA-N 0 1 317.296 4.225 20 0 DIADMN FC(F)(F)c1cc(CN(Cc2ccccc2)CC2CCC2)[nH]n1 ZINC001204908177 1049305532 /nfs/dbraw/zinc/30/55/32/1049305532.db2.gz MXGFFHUMTVNIAF-UHFFFAOYSA-N 0 1 323.362 4.231 20 0 DIADMN CCCn1cncc1CN(Cc1ccc(F)cc1)C(C)(C)C ZINC001204908182 1049306371 /nfs/dbraw/zinc/30/63/71/1049306371.db2.gz NAXOSEPSGPZWOR-UHFFFAOYSA-N 0 1 303.425 4.233 20 0 DIADMN Cc1nc(C[N@H+](C)[C@H]2CCC(C)(C)C2)sc1Br ZINC001194042529 1049306935 /nfs/dbraw/zinc/30/69/35/1049306935.db2.gz VZIZXXREPWVQQJ-JTQLQIEISA-N 0 1 317.296 4.225 20 0 DIADMN Cc1nc(CN(C)[C@H]2CCC(C)(C)C2)sc1Br ZINC001194042529 1049306943 /nfs/dbraw/zinc/30/69/43/1049306943.db2.gz VZIZXXREPWVQQJ-JTQLQIEISA-N 0 1 317.296 4.225 20 0 DIADMN CCCOc1cccc(CN2CCOC3(CCCCC3)C2)c1 ZINC001194058424 1049310562 /nfs/dbraw/zinc/31/05/62/1049310562.db2.gz PGWUKQLBKDHGDM-UHFFFAOYSA-N 0 1 303.446 4.011 20 0 DIADMN COc1ccc([C@H]2CCCN2Cc2ccc(OC)cc2F)cc1 ZINC001204928043 1049311684 /nfs/dbraw/zinc/31/16/84/1049311684.db2.gz GUIDOYAWYNTVHJ-LJQANCHMSA-N 0 1 315.388 4.180 20 0 DIADMN CC[C@H]1CCCN(Cc2ccc(C(F)(F)F)nc2Cl)C1 ZINC001180199675 1049314555 /nfs/dbraw/zinc/31/45/55/1049314555.db2.gz WIHIGMVOWPIPAG-JTQLQIEISA-N 0 1 306.759 4.376 20 0 DIADMN COc1ccc([C@@H](C)N(C)Cc2ccc(OC)cc2F)cc1 ZINC001204933740 1049315061 /nfs/dbraw/zinc/31/50/61/1049315061.db2.gz GSCCJGNCLNGDAE-CYBMUJFWSA-N 0 1 303.377 4.036 20 0 DIADMN Cc1ccc(NC(=O)CN2CC[C@@H](c3ccc(C)cc3C)C2)cc1 ZINC001194074071 1049315895 /nfs/dbraw/zinc/31/58/95/1049315895.db2.gz PHWDMFIAYSAMKL-GOSISDBHSA-N 0 1 322.452 4.040 20 0 DIADMN Cc1ccc(NC(=O)CN2CC[C@H](c3ccc(C)cc3C)C2)cc1 ZINC001194074075 1049316225 /nfs/dbraw/zinc/31/62/25/1049316225.db2.gz PHWDMFIAYSAMKL-SFHVURJKSA-N 0 1 322.452 4.040 20 0 DIADMN c1c(CN[C@@H](c2ccccc2)C2CCCCC2)nnn1C1CC1 ZINC000906279634 1049318308 /nfs/dbraw/zinc/31/83/08/1049318308.db2.gz GBKLLRXLSXIOME-IBGZPJMESA-N 0 1 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4.168 20 0 DIADMN CN(CCOc1cccc(Cl)c1)Cc1cccn1C(F)F ZINC001180437386 1049358927 /nfs/dbraw/zinc/35/89/27/1049358927.db2.gz DYRZJIFPLZGLBS-UHFFFAOYSA-N 0 1 314.763 4.047 20 0 DIADMN CCC1(CC)CCN(Cc2nnc(-c3ccc(C)cc3)o2)CC1 ZINC000485878299 1049359564 /nfs/dbraw/zinc/35/95/64/1049359564.db2.gz AHSWYZKWIHBDRT-UHFFFAOYSA-N 0 1 313.445 4.447 20 0 DIADMN Cc1cc(CN(C)Cc2cccc(Br)c2)c(C)o1 ZINC001205061309 1049360352 /nfs/dbraw/zinc/36/03/52/1049360352.db2.gz RXVNDDGSIIPDOR-UHFFFAOYSA-N 0 1 308.219 4.291 20 0 DIADMN CC[C@@H](NCc1c(C)nn(C)c1Cl)c1cc(C)ccc1C ZINC000859935579 1049361504 /nfs/dbraw/zinc/36/15/04/1049361504.db2.gz SDNJSWOUAXWGON-MRXNPFEDSA-N 0 1 305.853 4.240 20 0 DIADMN CC(C)(C)c1cnc(CN2C[C@@H]3C[C@@H](c4ccccc4)[C@@H]3C2)o1 ZINC000859930278 1049362992 /nfs/dbraw/zinc/36/29/92/1049362992.db2.gz RHGNHXVFGPHUKX-YESZJQIVSA-N 0 1 310.441 4.208 20 0 DIADMN C[C@H](N[C@@H]1CCSc2ccc(Cl)cc21)c1ccnnc1 ZINC000924808336 1049364706 /nfs/dbraw/zinc/36/47/06/1049364706.db2.gz 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CC[C@@H]1CC[N@@H+](Cc2cccc(F)c2OC(F)(F)F)[C@H]1C ZINC001181042373 1049430473 /nfs/dbraw/zinc/43/04/73/1049430473.db2.gz DVHQGEJFNQUZJA-WDEREUQCSA-N 0 1 305.315 4.345 20 0 DIADMN CC[C@@H]1CCN(Cc2cccc(F)c2OC(F)(F)F)[C@H]1C ZINC001181042373 1049430478 /nfs/dbraw/zinc/43/04/78/1049430478.db2.gz DVHQGEJFNQUZJA-WDEREUQCSA-N 0 1 305.315 4.345 20 0 DIADMN CCOc1ccc(CN2CCC([C@@H]3CCCCO3)CC2)cc1F ZINC000668627015 1049432934 /nfs/dbraw/zinc/43/29/34/1049432934.db2.gz CBPVVHQKHQKZIG-SFHVURJKSA-N 0 1 321.436 4.006 20 0 DIADMN Cc1ccccc1C1CCN(Cc2ccnn2CC(C)C)CC1 ZINC001205305663 1049433280 /nfs/dbraw/zinc/43/32/80/1049433280.db2.gz IMVCUUROAZZETR-UHFFFAOYSA-N 0 1 311.473 4.227 20 0 DIADMN CSCc1cc(F)ccc1CNCc1cc(F)cc(F)c1 ZINC000163168060 1049436498 /nfs/dbraw/zinc/43/64/98/1049436498.db2.gz KIAWGJLKNBCRIJ-UHFFFAOYSA-N 0 1 311.372 4.257 20 0 DIADMN COC(=O)c1sccc1CN[C@@H](c1ccc(C)cc1)C1CC1 ZINC000775617766 1049442300 /nfs/dbraw/zinc/44/23/00/1049442300.db2.gz KCORXQSGVMSGEZ-INIZCTEOSA-N 0 1 315.438 4.084 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[O-]c1cccc(C[N@H+]2CCC[C@@H]3CCCC[C@@H]32)c1Br ZINC000315927225 1052356868 /nfs/dbraw/zinc/35/68/68/1052356868.db2.gz RQDMNTTZVQCITF-JSGCOSHPSA-N 0 1 324.262 4.309 20 0 DIADMN Oc1cccc(CN2CCC3(CCCC3)CC2)c1Br ZINC000316123971 1052362292 /nfs/dbraw/zinc/36/22/92/1052362292.db2.gz OIWBIINASLUDLZ-UHFFFAOYSA-N 0 1 324.262 4.311 20 0 DIADMN CC(C)N(CC1CC1)Cn1ccn(Cc2ccccc2)c1=S ZINC000915207913 1052367826 /nfs/dbraw/zinc/36/78/26/1052367826.db2.gz IQVADNPPRSGXLO-UHFFFAOYSA-N 0 1 315.486 4.145 20 0 DIADMN CC(C)[C@H](C)N(C)Cn1ccn(Cc2ccccc2)c1=S ZINC000915209064 1052367840 /nfs/dbraw/zinc/36/78/40/1052367840.db2.gz RRWSWAZYIXGBJY-HNNXBMFYSA-N 0 1 303.475 4.001 20 0 DIADMN CCC[C@H](C)[N@@H+](C)CC(=O)Nc1ccc(SC(F)F)cc1 ZINC000915218589 1052368998 /nfs/dbraw/zinc/36/89/98/1052368998.db2.gz APRFNGMVSZOOPP-NSHDSACASA-N 0 1 316.417 4.060 20 0 DIADMN CCC[C@H](C)N(C)CC(=O)Nc1ccc(SC(F)F)cc1 ZINC000915218589 1052369005 /nfs/dbraw/zinc/36/90/05/1052369005.db2.gz APRFNGMVSZOOPP-NSHDSACASA-N 0 1 316.417 4.060 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/nfs/dbraw/zinc/54/53/76/1052545376.db2.gz BZNHNNVPKNYXNL-SFHVURJKSA-N 0 1 319.408 4.382 20 0 DIADMN CCCCCC[C@@H](CC)C(=O)N[C@H](C)c1n[nH]c(C(C)C)n1 ZINC000763224121 1052548265 /nfs/dbraw/zinc/54/82/65/1052548265.db2.gz UEMWAGZICNCRTO-ZIAGYGMSSA-N 0 1 308.470 4.102 20 0 DIADMN F[C@@]1(c2ccccc2)CCN(Cc2nccc3ccccc32)C1 ZINC000670272137 1052548855 /nfs/dbraw/zinc/54/88/55/1052548855.db2.gz MBRIOXYIBXJJKI-FQEVSTJZSA-N 0 1 306.384 4.306 20 0 DIADMN CCCCCC[C@H](CC)C(=O)N[C@H](C)c1n[nH]c(C(C)C)n1 ZINC000763224117 1052549119 /nfs/dbraw/zinc/54/91/19/1052549119.db2.gz UEMWAGZICNCRTO-KGLIPLIRSA-N 0 1 308.470 4.102 20 0 DIADMN CCCN[C@@H](C)c1nc(C(c2ccccc2)c2ccccc2)no1 ZINC000324522993 1052552991 /nfs/dbraw/zinc/55/29/91/1052552991.db2.gz AFBYJWMDQIACAW-HNNXBMFYSA-N 0 1 321.424 4.310 20 0 DIADMN CCCN[C@H](C)c1nc(C(c2ccccc2)c2ccccc2)no1 ZINC000324522994 1052553273 /nfs/dbraw/zinc/55/32/73/1052553273.db2.gz AFBYJWMDQIACAW-OAHLLOKOSA-N 0 1 321.424 4.310 20 0 DIADMN CN1CCC(OC2(Cl)c3ccccc3-c3ccccc32)CC1 ZINC001223112678 1052567965 /nfs/dbraw/zinc/56/79/65/1052567965.db2.gz VRUVDWHFXJYJFS-UHFFFAOYSA-N 0 1 313.828 4.218 20 0 DIADMN CCN1CCC(OC(Cl)(Cl)c2ccc(Cl)cc2)CC1 ZINC001223128437 1052569791 /nfs/dbraw/zinc/56/97/91/1052569791.db2.gz HLRZKJBJBSNXRM-UHFFFAOYSA-N 0 1 322.663 4.429 20 0 DIADMN C[C@H]1CCN(Cc2coc(-c3ccccc3F)n2)CC12CCC2 ZINC001168508357 1052586543 /nfs/dbraw/zinc/58/65/43/1052586543.db2.gz BPMGTGPWDRWOPH-AWEZNQCLSA-N 0 1 314.404 4.493 20 0 DIADMN FCCN1CCC(OC(c2ccccc2)c2ccccc2)CC1 ZINC001223320522 1052588320 /nfs/dbraw/zinc/58/83/20/1052588320.db2.gz NBOVSSSTJPDMPS-UHFFFAOYSA-N 0 1 313.416 4.227 20 0 DIADMN Clc1ccc(CN2CC[C@@H](OCc3ccsc3)C2)cc1 ZINC001223336982 1052590927 /nfs/dbraw/zinc/59/09/27/1052590927.db2.gz SHTISMLBFDIHDW-MRXNPFEDSA-N 0 1 307.846 4.193 20 0 DIADMN O=C(Oc1ccc2oc3ccccc3c2c1)c1[nH]nc2c1CCC2 ZINC000916164374 1052593524 /nfs/dbraw/zinc/59/35/24/1052593524.db2.gz ZKRDMOPERPRAAR-UHFFFAOYSA-N 0 1 318.332 4.017 20 0 DIADMN [O-]c1cccc(C[NH2+]CCCn2ccc3ccccc32)c1Cl ZINC000328311049 1052613119 /nfs/dbraw/zinc/61/31/19/1052613119.db2.gz FZDSYKUJNYNKJN-UHFFFAOYSA-N 0 1 314.816 4.180 20 0 DIADMN Cc1cnc(CN[C@@H](c2ccc(CC(C)C)cc2)C2CC2)cn1 ZINC001168510436 1052616279 /nfs/dbraw/zinc/61/62/79/1052616279.db2.gz WPJRLKXCBZDBSA-FQEVSTJZSA-N 0 1 309.457 4.224 20 0 DIADMN C[C@@H](c1ccccn1)N1CC[C@@H](OCc2cc3ccccc3o2)C1 ZINC001223640457 1052622940 /nfs/dbraw/zinc/62/29/40/1052622940.db2.gz KHHMGLAECUVVRY-DOTOQJQBSA-N 0 1 322.408 4.180 20 0 DIADMN c1c2ccccc2oc1CO[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC001223648188 1052623816 /nfs/dbraw/zinc/62/38/16/1052623816.db2.gz NHODURNZLZWCLJ-GOSISDBHSA-N 0 1 307.393 4.224 20 0 DIADMN CCC(CC)CC(=O)Nc1ccccc1-c1nnc(C(C)C)[nH]1 ZINC000123624324 1052632785 /nfs/dbraw/zinc/63/27/85/1052632785.db2.gz FUJOBNKJFUCORC-UHFFFAOYSA-N 0 1 314.433 4.360 20 0 DIADMN C[C@@H](O)C[C@@H]1CCCCN1Cc1ccc(Cl)c(Cl)c1 ZINC000123661034 1052633428 /nfs/dbraw/zinc/63/34/28/1052633428.db2.gz BPJNPDSWFFOAPP-YPMHNXCESA-N 0 1 302.245 4.119 20 0 DIADMN Cc1ccc2ccccc2c1COC1CCN(CCF)CC1 ZINC001223820454 1052641430 /nfs/dbraw/zinc/64/14/30/1052641430.db2.gz GSGASJZFIFHGGT-UHFFFAOYSA-N 0 1 301.405 4.099 20 0 DIADMN C[C@H](Cc1ccc(O)cc1)N(C)Cc1nc(C(C)(C)C)cs1 ZINC000125385973 1052647861 /nfs/dbraw/zinc/64/78/61/1052647861.db2.gz MMUSAJOEFVUTHZ-CYBMUJFWSA-N 0 1 318.486 4.209 20 0 DIADMN FC(F)(F)c1cccnc1CN(Cc1ccccc1)C1CC1 ZINC000125418609 1052648087 /nfs/dbraw/zinc/64/80/87/1052648087.db2.gz CHJMXFOIJNMSLA-UHFFFAOYSA-N 0 1 306.331 4.265 20 0 DIADMN CC[C@](C)(NCCSc1ccc(F)cc1)c1nccs1 ZINC000125457259 1052649652 /nfs/dbraw/zinc/64/96/52/1052649652.db2.gz OXAULKWKJMKKJJ-HNNXBMFYSA-N 0 1 310.463 4.289 20 0 DIADMN C[C@H](O[C@@H]1CCN(Cc2ccc(Cl)cc2)C1)c1ccccn1 ZINC001223997368 1052659149 /nfs/dbraw/zinc/65/91/49/1052659149.db2.gz ZHFVWQJNCDGIDD-WMLDXEAASA-N 0 1 316.832 4.087 20 0 DIADMN C[C@@H](O[C@@H]1CCN(Cc2ccc(Cl)cc2)C1)c1ccccn1 ZINC001223997367 1052659197 /nfs/dbraw/zinc/65/91/97/1052659197.db2.gz ZHFVWQJNCDGIDD-RHSMWYFYSA-N 0 1 316.832 4.087 20 0 DIADMN COc1ccc(-c2n[nH]c(SCCC(C)(C)C)n2)c(OC)c1 ZINC000126230325 1052667977 /nfs/dbraw/zinc/66/79/77/1052667977.db2.gz CLDYAIMVYZUTJD-UHFFFAOYSA-N 0 1 321.446 4.017 20 0 DIADMN COc1ccc(CN[C@@H](C)c2ccc(-c3ccccc3)o2)cn1 ZINC000126476702 1052670324 /nfs/dbraw/zinc/67/03/24/1052670324.db2.gz BSGBGJWDVVFCJB-AWEZNQCLSA-N 0 1 308.381 4.201 20 0 DIADMN COc1ccc(CN[C@H]2CCc3c2ccc(Cl)c3Cl)cn1 ZINC000126484394 1052672044 /nfs/dbraw/zinc/67/20/44/1052672044.db2.gz ZAKDOQDUWJTMTC-AWEZNQCLSA-N 0 1 323.223 4.174 20 0 DIADMN CC(C)(CN[C@@H](c1ncc[nH]1)c1ccccc1)c1ccc(F)cc1 ZINC000126683645 1052673758 /nfs/dbraw/zinc/67/37/58/1052673758.db2.gz ZPTKIWBMPPXRAD-GOSISDBHSA-N 0 1 323.415 4.206 20 0 DIADMN CC(C)(CN[C@@H](c1ncc[nH]1)c1ccccc1)c1cccc(F)c1 ZINC000127103280 1052687849 /nfs/dbraw/zinc/68/78/49/1052687849.db2.gz KOTQXVXLUYLLFO-GOSISDBHSA-N 0 1 323.415 4.206 20 0 DIADMN Cc1ccc(C[N@@H+](C[C@@H](O)c2ccc3ccccc3c2)C2CC2)o1 ZINC000917062346 1052688085 /nfs/dbraw/zinc/68/80/85/1052688085.db2.gz OXROTYSVNVHLFH-OAQYLSRUSA-N 0 1 321.420 4.439 20 0 DIADMN CN(Cc1cccc(C(F)(F)F)c1)C[C@@H]1CC1(Cl)Cl ZINC000917065285 1052689082 /nfs/dbraw/zinc/68/90/82/1052689082.db2.gz UOLJAEFUVJUFOF-NSHDSACASA-N 0 1 312.162 4.331 20 0 DIADMN Cc1ccc([C@@H](C)CN[C@@H](c2ncc[nH]2)c2ccccc2)cc1 ZINC000127168243 1052690334 /nfs/dbraw/zinc/69/03/34/1052690334.db2.gz ZJLHTVOKGXBWGZ-QFBILLFUSA-N 0 1 305.425 4.201 20 0 DIADMN Cc1cccn2cc(CNCc3ccc(C(C)(C)C)s3)nc12 ZINC000127418974 1052695368 /nfs/dbraw/zinc/69/53/68/1052695368.db2.gz UDUZYEXYQMUJMF-UHFFFAOYSA-N 0 1 313.470 4.292 20 0 DIADMN COc1cc(CNCc2ccco2)c(-c2ccccc2)cc1OC ZINC000067645016 1052707845 /nfs/dbraw/zinc/70/78/45/1052707845.db2.gz JSZOEPXNRICKFM-UHFFFAOYSA-N 0 1 323.392 4.254 20 0 DIADMN C[C@H](c1ccccn1)N(C)Cc1ccc(Br)c(F)c1 ZINC000128072710 1052708484 /nfs/dbraw/zinc/70/84/84/1052708484.db2.gz YIBOMQPKMCHSEB-LLVKDONJSA-N 0 1 323.209 4.176 20 0 DIADMN C[C@H](c1ccccn1)N(C)Cc1ccc(Cl)c2cccnc12 ZINC000128123344 1052709594 /nfs/dbraw/zinc/70/95/94/1052709594.db2.gz ATTHASJIAFBEFJ-CYBMUJFWSA-N 0 1 311.816 4.476 20 0 DIADMN CCc1ccc2c(CN3CCC[C@H]3c3ccc[nH]3)cc(=O)oc2c1 ZINC000917139867 1052711276 /nfs/dbraw/zinc/71/12/76/1052711276.db2.gz JPGHZRFRHLHEGE-SFHVURJKSA-N 0 1 322.408 4.021 20 0 DIADMN CC1CCC(N(C)CN2c3cccc4cccc(c34)C2=O)CC1 ZINC000917456972 1052729302 /nfs/dbraw/zinc/72/93/02/1052729302.db2.gz XBWYCPFNWARXHF-UHFFFAOYSA-N 0 1 308.425 4.268 20 0 DIADMN CC[C@H](C)N(Cc1ccccc1)CN1C(=O)C[C@H]1c1ccccc1 ZINC000917455310 1052729519 /nfs/dbraw/zinc/72/95/19/1052729519.db2.gz SNKSYWNTJFAYFH-PXNSSMCTSA-N 0 1 322.452 4.218 20 0 DIADMN CCCN(Cc1ccc(C)cc1)CN1C(=O)C[C@@H]1c1ccccc1 ZINC000917455560 1052730034 /nfs/dbraw/zinc/73/00/34/1052730034.db2.gz XCHNYERIRKNWLF-HXUWFJFHSA-N 0 1 322.452 4.138 20 0 DIADMN CC[N@@H+](CCc1ccccc1)Cn1ccn(C(C)C)c1=S ZINC000917469139 1052730537 /nfs/dbraw/zinc/73/05/37/1052730537.db2.gz PVBIGZVHVOJGOV-UHFFFAOYSA-N 0 1 303.475 4.122 20 0 DIADMN CCN(CCc1ccccc1)Cn1ccn(C(C)C)c1=S ZINC000917469139 1052730540 /nfs/dbraw/zinc/73/05/40/1052730540.db2.gz PVBIGZVHVOJGOV-UHFFFAOYSA-N 0 1 303.475 4.122 20 0 DIADMN CC=CC=CC(=O)Nc1ccc2nc(-c3cccc(F)c3)[nH]c2c1 ZINC000917756801 1052755160 /nfs/dbraw/zinc/75/51/60/1052755160.db2.gz ISKYPDUOERYBGK-HOJFPOIOSA-N 0 1 321.355 4.440 20 0 DIADMN Fc1cccc(F)c1O[C@@H]1CCCN(Cc2ccccc2)C1 ZINC001225207125 1052755574 /nfs/dbraw/zinc/75/55/74/1052755574.db2.gz NMTBIWXXXSLWEZ-OAHLLOKOSA-N 0 1 303.352 4.008 20 0 DIADMN COc1cccc(O[C@H]2CCN(Cc3ccccc3Cl)C2)c1 ZINC001225238346 1052760917 /nfs/dbraw/zinc/76/09/17/1052760917.db2.gz JBCOMAWYQUHTLL-KRWDZBQOSA-N 0 1 317.816 4.002 20 0 DIADMN Cc1ccc(O[C@@H]2CCC[N@H+]([C@@H](C)c3ccccn3)C2)cc1C ZINC001225246383 1052762712 /nfs/dbraw/zinc/76/27/12/1052762712.db2.gz WXWRPZDBHBUPLO-PKOBYXMFSA-N 0 1 310.441 4.303 20 0 DIADMN Cc1ccc(O[C@H]2CCC[N@H+]([C@H](C)c3ccccn3)C2)cc1C ZINC001225246382 1052763075 /nfs/dbraw/zinc/76/30/75/1052763075.db2.gz WXWRPZDBHBUPLO-MJGOQNOKSA-N 0 1 310.441 4.303 20 0 DIADMN Cc1ccc(O[C@@H]2CCC[N@H+]([C@H](C)c3ccccn3)C2)cc1C ZINC001225246381 1052763091 /nfs/dbraw/zinc/76/30/91/1052763091.db2.gz WXWRPZDBHBUPLO-IEBWSBKVSA-N 0 1 310.441 4.303 20 0 DIADMN C[C@H](OC(=O)c1cccc2[nH]ncc21)c1ccc(Cl)cc1 ZINC000917942257 1052765078 /nfs/dbraw/zinc/76/50/78/1052765078.db2.gz YCYVAQUBXICJJP-JTQLQIEISA-N 0 1 300.745 4.134 20 0 DIADMN Fc1ccccc1CN1CCC[C@@H](Oc2ccc3[nH]ccc3c2)C1 ZINC001225274436 1052767711 /nfs/dbraw/zinc/76/77/11/1052767711.db2.gz YMBKPWZJLNRBAC-GOSISDBHSA-N 0 1 324.399 4.350 20 0 DIADMN CCC(CC)CN(CC)Cc1nnc(Cc2ccccc2C)o1 ZINC000129032078 1052769092 /nfs/dbraw/zinc/76/90/92/1052769092.db2.gz FUSSSWXCFMIXRM-UHFFFAOYSA-N 0 1 315.461 4.227 20 0 DIADMN Cc1cc(CN(C)C/C=C/Cl)cc(C)c1OCC(F)(F)F ZINC000918021275 1052773802 /nfs/dbraw/zinc/77/38/02/1052773802.db2.gz MJCVJDGEDYRLHU-SNAWJCMRSA-N 0 1 321.770 4.429 20 0 DIADMN CCN(C(=O)c1[nH]c(-c2ccccc2)nc1C)c1ccc(C)cc1 ZINC000918069863 1052776241 /nfs/dbraw/zinc/77/62/41/1052776241.db2.gz NIJGZIBLPXOHHH-UHFFFAOYSA-N 0 1 319.408 4.360 20 0 DIADMN CCN(C(=O)c1cc(-c2cccs2)n[nH]1)c1ccc(C)cc1 ZINC000918070103 1052776259 /nfs/dbraw/zinc/77/62/59/1052776259.db2.gz PNQNKKMILGGBEX-UHFFFAOYSA-N 0 1 311.410 4.113 20 0 DIADMN Cc1cc(F)ccc1O[C@@H]1CCC[N@H+]([C@H](C)c2ccccn2)C1 ZINC001225345516 1052777089 /nfs/dbraw/zinc/77/70/89/1052777089.db2.gz DFJCMNNWNNYXHW-NVXWUHKLSA-N 0 1 314.404 4.134 20 0 DIADMN CCC[C@H](N[C@H](CC)c1cccs1)c1nnc2ccccn21 ZINC000129145102 1052778255 /nfs/dbraw/zinc/77/82/55/1052778255.db2.gz NWCQKITXJAWLHZ-KGLIPLIRSA-N 0 1 314.458 4.373 20 0 DIADMN CCC[C@@H](N[C@@H](C)c1sccc1C)c1nnc2ccccn21 ZINC000129159538 1052778450 /nfs/dbraw/zinc/77/84/50/1052778450.db2.gz BITTWOIJVAQSJT-UONOGXRCSA-N 0 1 314.458 4.291 20 0 DIADMN CCC[C@@H](N[C@H](C)c1sccc1C)c1nnc2ccccn21 ZINC000129159955 1052778583 /nfs/dbraw/zinc/77/85/83/1052778583.db2.gz BITTWOIJVAQSJT-ZIAGYGMSSA-N 0 1 314.458 4.291 20 0 DIADMN CC[C@@H](SC)C(=O)Nc1cccc2c1CN(CCC(C)C)C2 ZINC000129531041 1052794450 /nfs/dbraw/zinc/79/44/50/1052794450.db2.gz DFNCSOAZPGXLNC-QGZVFWFLSA-N 0 1 320.502 4.128 20 0 DIADMN CC[C@@H](c1ccccc1)[C@@H]1CCCN1Cc1noc(C2CC2)n1 ZINC000069679313 1052799108 /nfs/dbraw/zinc/79/91/08/1052799108.db2.gz YSKPFNMRKLRKJG-IRXDYDNUSA-N 0 1 311.429 4.105 20 0 DIADMN C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1Oc1ccc([S-])cc1 ZINC001225555364 1052802212 /nfs/dbraw/zinc/80/22/12/1052802212.db2.gz MGBPOJGEUFXYHT-BEFAXECRSA-N 0 1 313.466 4.265 20 0 DIADMN CCC(C)(C)c1ccc(Oc2ccc(NC(=O)CN)cc2)cc1 ZINC000556119313 1052804245 /nfs/dbraw/zinc/80/42/45/1052804245.db2.gz VJTZZHRPNRATKQ-UHFFFAOYSA-N 0 1 312.413 4.064 20 0 DIADMN C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1Oc1ccccc1[S-] ZINC001225587446 1052805715 /nfs/dbraw/zinc/80/57/15/1052805715.db2.gz KOHLPRWRDZCEKB-DOTOQJQBSA-N 0 1 313.466 4.265 20 0 DIADMN CCCOc1c(Cl)cc(CNCc2ccoc2)cc1OC ZINC000069833070 1052810252 /nfs/dbraw/zinc/81/02/52/1052810252.db2.gz GTHAILFKYCHHKK-UHFFFAOYSA-N 0 1 309.793 4.020 20 0 DIADMN Cc1oncc1CN[C@H](CCc1ccccc1)c1ccccc1 ZINC000129785806 1052811508 /nfs/dbraw/zinc/81/15/08/1052811508.db2.gz IVDLBGPIBBZQFA-HXUWFJFHSA-N 0 1 306.409 4.447 20 0 DIADMN Cc1oncc1CN[C@@H](c1cccc(C(F)(F)F)c1)C(C)C ZINC000129828239 1052812441 /nfs/dbraw/zinc/81/24/41/1052812441.db2.gz MAEPXVZEBZURRM-OAHLLOKOSA-N 0 1 312.335 4.489 20 0 DIADMN CCn1cc(CN([C@@H](C)c2ccc(Cl)cc2)C2CC2)cn1 ZINC000129875282 1052813006 /nfs/dbraw/zinc/81/30/06/1052813006.db2.gz CPJSHHYMYDKHHF-ZDUSSCGKSA-N 0 1 303.837 4.282 20 0 DIADMN Cc1nn(C)cc1CN([C@@H](C)c1ccc(Cl)cc1)C1CC1 ZINC000129873891 1052813799 /nfs/dbraw/zinc/81/37/99/1052813799.db2.gz FFLSKSLGSUMROG-ZDUSSCGKSA-N 0 1 303.837 4.108 20 0 DIADMN C[C@H](NCCCC(C)(C)C)c1ncc(Br)s1 ZINC000129969177 1052816070 /nfs/dbraw/zinc/81/60/70/1052816070.db2.gz OYEUGZPXQXBGBT-VIFPVBQESA-N 0 1 305.285 4.383 20 0 DIADMN O=C(C=C1CCCC1)Nc1ccc2nc(-c3ccco3)[nH]c2c1 ZINC000918653579 1052819731 /nfs/dbraw/zinc/81/97/31/1052819731.db2.gz LOAWVTASSAXQOZ-UHFFFAOYSA-N 0 1 307.353 4.262 20 0 DIADMN c1c[nH]c([C@H](NC[C@@H](c2ccccc2)C2CC2)c2ccccc2)n1 ZINC000556210448 1052820981 /nfs/dbraw/zinc/82/09/81/1052820981.db2.gz RPQQZHIBBIRMQE-VQTJNVASSA-N 0 1 317.436 4.283 20 0 DIADMN CC[C@@H](c1ccncc1)[N@@H+](C)Cc1cc(Cl)ccc1OC ZINC000130113356 1052823628 /nfs/dbraw/zinc/82/36/28/1052823628.db2.gz ZRUDCRLTUSWVQQ-INIZCTEOSA-N 0 1 304.821 4.327 20 0 DIADMN CC[C@@H](c1ccncc1)N(C)Cc1cc(Cl)ccc1OC ZINC000130113356 1052823631 /nfs/dbraw/zinc/82/36/31/1052823631.db2.gz ZRUDCRLTUSWVQQ-INIZCTEOSA-N 0 1 304.821 4.327 20 0 DIADMN C[C@@H](N[C@H]1CCCc2ccc(F)cc21)c1cn2ccccc2n1 ZINC000556242646 1052825413 /nfs/dbraw/zinc/82/54/13/1052825413.db2.gz RKOZHQLMTZCGGD-DYVFJYSZSA-N 0 1 309.388 4.202 20 0 DIADMN Cc1ccc(C(Oc2[nH]c(=O)ncc2F)c2ccc(C)cc2)cc1 ZINC001225881717 1052841893 /nfs/dbraw/zinc/84/18/93/1052841893.db2.gz LYXSHUDGYUEQLH-UHFFFAOYSA-N 0 1 324.355 4.107 20 0 DIADMN COc1ccc([C@H](C)NCc2ccc([C@H]3C[C@H]3C)o2)cc1F ZINC000071010071 1052843333 /nfs/dbraw/zinc/84/33/33/1052843333.db2.gz ROFJRTQJBLFWSN-XUJVJEKNSA-N 0 1 303.377 4.402 20 0 DIADMN FC(F)(F)c1ccc2c(c1)CC[C@@H]2Oc1cccc2[nH]nnc21 ZINC001225991647 1052856563 /nfs/dbraw/zinc/85/65/63/1052856563.db2.gz FLZAVVHCEWAVDW-ZDUSSCGKSA-N 0 1 319.286 4.043 20 0 DIADMN C[C@H]1CN(Cc2ccc(C(F)(F)F)cn2)[C@H]1c1ccccc1 ZINC000556497115 1052856743 /nfs/dbraw/zinc/85/67/43/1052856743.db2.gz FCWATVAAGPGGQN-BLLLJJGKSA-N 0 1 306.331 4.293 20 0 DIADMN Cc1ccc(F)cc1O[C@H]1CCCN([C@H](C)c2ccccn2)C1 ZINC001225996707 1052857656 /nfs/dbraw/zinc/85/76/56/1052857656.db2.gz MGSUXWNPHSMTOY-WBVHZDCISA-N 0 1 314.404 4.134 20 0 DIADMN Oc1cccc(CNC2(c3cccc(C(F)(F)F)c3)CC2)c1 ZINC000556503492 1052858480 /nfs/dbraw/zinc/85/84/80/1052858480.db2.gz ZANOGEPNPXFBNG-UHFFFAOYSA-N 0 1 307.315 4.190 20 0 DIADMN Clc1ccc(Cl)c(CN2CCC[C@H]2[C@H]2CCCO2)c1 ZINC000556517301 1052859757 /nfs/dbraw/zinc/85/97/57/1052859757.db2.gz AMKRKVDXMBGIPV-LSDHHAIUSA-N 0 1 300.229 4.137 20 0 DIADMN Clc1ccc(Cl)c(CN2CCC[C@H]2[C@@H]2CCCO2)c1 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317.383 4.004 20 0 DIADMN Cc1nc(-c2ccccc2)[nH]c1C(=O)Nc1cc(C)ccc1F ZINC000615338748 1053013815 /nfs/dbraw/zinc/01/38/15/1053013815.db2.gz QHNYXRCJNVCINN-UHFFFAOYSA-N 0 1 309.344 4.085 20 0 DIADMN Cc1nccc([C@@H]2CCCN([C@H](C)c3cc(F)ccc3F)C2)n1 ZINC000615347276 1053013862 /nfs/dbraw/zinc/01/38/62/1053013862.db2.gz RBSORODWCQVFDS-TZMCWYRMSA-N 0 1 317.383 4.004 20 0 DIADMN Cc1cccc([C@H]2CCCN2Cc2cn3cc(C)ccc3n2)c1 ZINC000615462882 1053019312 /nfs/dbraw/zinc/01/93/12/1053019312.db2.gz ZNCQVQFQAIGHHJ-LJQANCHMSA-N 0 1 305.425 4.288 20 0 DIADMN Cc1ccc(C)c(NC(=O)CN(C)[C@H](C)c2ccccc2C)c1 ZINC000615463224 1053019539 /nfs/dbraw/zinc/01/95/39/1053019539.db2.gz YMUNBTWDFQKAPL-QGZVFWFLSA-N 0 1 310.441 4.243 20 0 DIADMN C[C@H](c1ccccn1)N1CC[C@@H](Oc2cc(F)cc(Cl)c2)C1 ZINC001227856679 1053022030 /nfs/dbraw/zinc/02/20/30/1053022030.db2.gz CJFCGGOXXJFXRX-IUODEOHRSA-N 0 1 320.795 4.088 20 0 DIADMN CC(C)[N@@H+](Cc1ccc(C#N)cc1)Cc1cccc(Cl)c1[O-] ZINC000179696111 1053022287 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DIADMN CCCCC[C@H](NC)c1nc(-c2ccc3c(ccn3C)c2)no1 ZINC001212279735 1053048366 /nfs/dbraw/zinc/04/83/66/1053048366.db2.gz ZFPMURMSQBGBGO-HNNXBMFYSA-N 0 1 312.417 4.069 20 0 DIADMN CCCCC[C@H](NC)c1nc(-c2ccc3ncccc3c2)no1 ZINC001212279512 1053049266 /nfs/dbraw/zinc/04/92/66/1053049266.db2.gz UNCYFXRNNZNVTC-INIZCTEOSA-N 0 1 310.401 4.126 20 0 DIADMN [O-]c1ccc(Cl)cc1C[NH2+]C1(c2ccc(Cl)cc2)CC1 ZINC000238062328 1053049619 /nfs/dbraw/zinc/04/96/19/1053049619.db2.gz MWJAWOGKEZSERP-UHFFFAOYSA-N 0 1 308.208 4.478 20 0 DIADMN CCCCC[C@H](NC)c1nc(-c2cccc3ccncc32)no1 ZINC001212281099 1053051883 /nfs/dbraw/zinc/05/18/83/1053051883.db2.gz HJQLPYTXULGSLM-INIZCTEOSA-N 0 1 310.401 4.126 20 0 DIADMN CCCCC[C@H](NC)c1nc(-c2ccc(F)c(CC)c2)no1 ZINC001212281360 1053052765 /nfs/dbraw/zinc/05/27/65/1053052765.db2.gz VDGBPPSSYIGUPK-HNNXBMFYSA-N 0 1 305.397 4.279 20 0 DIADMN O=c1cc(Nc2cc(Cl)c(Cl)c(Cl)c2O)cc[nH]1 ZINC001212281792 1053054453 /nfs/dbraw/zinc/05/44/53/1053054453.db2.gz OZKMAHAWHDWWQK-UHFFFAOYSA-N 0 1 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310.319 4.092 20 0 DIADMN O=C(Nc1ccc2c3c(cccc31)CC2)c1cccc(F)c1O ZINC001434881457 1053375715 /nfs/dbraw/zinc/37/57/15/1053375715.db2.gz GYLFQKAYOJUKMS-UHFFFAOYSA-N 0 1 307.324 4.035 20 0 DIADMN Oc1c(Cl)cc(Cl)cc1/C=N/CC[C@H]1CCCCO1 ZINC000182203229 1053375898 /nfs/dbraw/zinc/37/58/98/1053375898.db2.gz RYRJUZYDNRJUBW-UDPFGDFPSA-N 0 1 302.201 4.077 20 0 DIADMN Cc1cncc(CN2CCC(Nc3ccccc3Cl)CC2)c1 ZINC001320923687 1053376003 /nfs/dbraw/zinc/37/60/03/1053376003.db2.gz QBAVIJVKSOMRJK-UHFFFAOYSA-N 0 1 315.848 4.120 20 0 DIADMN COc1ccccc1/C=C/CN(C)[C@@H](C)c1sc(C)nc1C ZINC000093275311 1053376965 /nfs/dbraw/zinc/37/69/65/1053376965.db2.gz WDLMGRNQWRQNCW-PLWJUESGSA-N 0 1 316.470 4.475 20 0 DIADMN CN(Cc1c[nH]nc1-c1cccs1)Cc1cc(F)cc(F)c1 ZINC001321025492 1053385638 /nfs/dbraw/zinc/38/56/38/1053385638.db2.gz PLOHYZAWRWYXTC-UHFFFAOYSA-N 0 1 319.380 4.048 20 0 DIADMN C[C@@]1(CO)CCCN(CCCc2c(Cl)cccc2Cl)C1 ZINC001321095041 1053389261 /nfs/dbraw/zinc/38/92/61/1053389261.db2.gz PBCORECVFSMXCR-MRXNPFEDSA-N 0 1 316.272 4.020 20 0 DIADMN CC(C)C(=O)c1ccc(NC(=O)c2cc(Cl)ccc2O)cc1 ZINC001300093564 1053391856 /nfs/dbraw/zinc/39/18/56/1053391856.db2.gz ZRTKOCUTBUGOIS-UHFFFAOYSA-N 0 1 317.772 4.137 20 0 DIADMN CCC(C)(CC)NC(=O)Nc1ccc2nc(C(F)F)[nH]c2c1 ZINC000093351672 1053393977 /nfs/dbraw/zinc/39/39/77/1053393977.db2.gz BJNSRRQUUOZRSZ-UHFFFAOYSA-N 0 1 310.348 4.201 20 0 DIADMN CC1(C)CCC[C@@H]1NC(=O)Nc1ccc2nc(C(F)F)[nH]c2c1 ZINC000093353245 1053394401 /nfs/dbraw/zinc/39/44/01/1053394401.db2.gz XSOUQZJBOXWMOG-LBPRGKRZSA-N 0 1 322.359 4.201 20 0 DIADMN CC[C@@H](C)[C@H](C)NC(=O)Nc1ccc2nc(C(F)F)[nH]c2c1 ZINC000093351150 1053394653 /nfs/dbraw/zinc/39/46/53/1053394653.db2.gz AQPMQQYIZFQHQL-BDAKNGLRSA-N 0 1 310.348 4.057 20 0 DIADMN COc1ccc2nc(O[C@@H](c3ccccc3)C(F)(F)F)[nH]c2c1 ZINC001229731638 1053395201 /nfs/dbraw/zinc/39/52/01/1053395201.db2.gz XAPYYSFJOJFYTM-AWEZNQCLSA-N 0 1 322.286 4.254 20 0 DIADMN CSc1ccccc1[C@H](C)N[C@H]1CCCc2nc(C)ncc21 ZINC001321181218 1053396994 /nfs/dbraw/zinc/39/69/94/1053396994.db2.gz HJALPUBIVXXXNG-LRDDRELGSA-N 0 1 313.470 4.235 20 0 DIADMN Cc1ccc2c(c1)CC[C@H]2N[C@H]1CCCc2cn(C(C)C)nc21 ZINC001321186631 1053398886 /nfs/dbraw/zinc/39/88/86/1053398886.db2.gz WVXQJISZOJWDCY-MOPGFXCFSA-N 0 1 309.457 4.427 20 0 DIADMN Cc1ccc2c(c1)CC[C@@H]2N[C@H]1CCCc2cn(C(C)C)nc21 ZINC001321186634 1053399943 /nfs/dbraw/zinc/39/99/43/1053399943.db2.gz WVXQJISZOJWDCY-OALUTQOASA-N 0 1 309.457 4.427 20 0 DIADMN C[C@H](NCCOc1ccc(C(C)(C)C)cc1)c1nccs1 ZINC000093401788 1053400560 /nfs/dbraw/zinc/40/05/60/1053400560.db2.gz GFTVTLOIFQIWTJ-ZDUSSCGKSA-N 0 1 304.459 4.170 20 0 DIADMN CCOC[C@@H]1CCCN(Cc2cc(F)cc(C(F)(F)F)c2)C1 ZINC000093419301 1053402972 /nfs/dbraw/zinc/40/29/72/1053402972.db2.gz ZSVLHXUHARRUOC-GFCCVEGCSA-N 0 1 319.342 4.093 20 0 DIADMN CCOC[C@H]1CCCN(Cc2ccc(F)c(C(F)(F)F)c2)C1 ZINC000093419170 1053403049 /nfs/dbraw/zinc/40/30/49/1053403049.db2.gz LWCHGSMYLCBQOU-ZDUSSCGKSA-N 0 1 319.342 4.093 20 0 DIADMN CCOC[C@@H]1CCCN(Cc2ccc(F)cc2C(F)(F)F)C1 ZINC000093419579 1053404837 /nfs/dbraw/zinc/40/48/37/1053404837.db2.gz FZYXQSPFCRIKDV-GFCCVEGCSA-N 0 1 319.342 4.093 20 0 DIADMN Cc1cccc([C@@H]2CCCN2Cc2c[nH]nc2-c2cccs2)n1 ZINC000093445076 1053408466 /nfs/dbraw/zinc/40/84/66/1053408466.db2.gz QDWLUQCRCOAUJD-INIZCTEOSA-N 0 1 324.453 4.179 20 0 DIADMN CCN(CC(=O)Nc1c(C)cccc1C)[C@@H]1CCc2ccccc21 ZINC000618986658 1053412306 /nfs/dbraw/zinc/41/23/06/1053412306.db2.gz YIUBIRLHAAIXML-LJQANCHMSA-N 0 1 322.452 4.251 20 0 DIADMN CC(C)CCN1Cc2cccc(NC(=O)[C@H]3C[C@H]3C(C)C)c2C1 ZINC001435015175 1053415159 /nfs/dbraw/zinc/41/51/59/1053415159.db2.gz BHYYCVNZHJTIMQ-IRXDYDNUSA-N 0 1 314.473 4.279 20 0 DIADMN CCCCCCOc1ccc(CNCc2ccc(F)cn2)cc1 ZINC000763518624 1053417021 /nfs/dbraw/zinc/41/70/21/1053417021.db2.gz MMIHINPOSQLUDV-UHFFFAOYSA-N 0 1 316.420 4.470 20 0 DIADMN CCCCN(CCCC)C(=O)c1ccc(CN2CCCCC2)o1 ZINC001352857274 1053418851 /nfs/dbraw/zinc/41/88/51/1053418851.db2.gz RBBNVCHWUHVORT-UHFFFAOYSA-N 0 1 320.477 4.308 20 0 DIADMN CCOc1ccc([C@@H](C)Oc2ccc(F)cc2CN(C)C)cc1 ZINC001229858959 1053419730 /nfs/dbraw/zinc/41/97/30/1053419730.db2.gz UUKTVQCIEHLGQH-CQSZACIVSA-N 0 1 317.404 4.426 20 0 DIADMN Cc1ccc(OC[C@H](C)Oc2ccc(F)cc2CN(C)C)cc1 ZINC001229859018 1053420575 /nfs/dbraw/zinc/42/05/75/1053420575.db2.gz VRRFCGGTJBDCNK-HNNXBMFYSA-N 0 1 317.404 4.042 20 0 DIADMN C[C@@H](c1cccc(Cl)c1)N(C)C(=O)c1cccc(F)c1O ZINC001352868378 1053421865 /nfs/dbraw/zinc/42/18/65/1053421865.db2.gz YNUCTOKHXWSOEQ-JTQLQIEISA-N 0 1 307.752 4.018 20 0 DIADMN C[C@H](c1noc(-c2ccccc2)n1)N1CC[C@@H]2CCCC[C@@H]2C1 ZINC001321743256 1053430846 /nfs/dbraw/zinc/43/08/46/1053430846.db2.gz LWFDQOVWPNIFGC-HLLBOEOZSA-N 0 1 311.429 4.310 20 0 DIADMN C[C@H](NCc1cnc(C(C)(C)C)nc1)c1ccc(Cl)c(F)c1 ZINC001321943276 1053444306 /nfs/dbraw/zinc/44/43/06/1053444306.db2.gz IUEVIDFDIOERNK-NSHDSACASA-N 0 1 321.827 4.417 20 0 DIADMN CC[C@@H](NC[C@H](OC)C(F)(F)F)c1cccc(Cl)c1F ZINC000763539019 1053467732 /nfs/dbraw/zinc/46/77/32/1053467732.db2.gz HJZFYSGXYLLCOE-MNOVXSKESA-N 0 1 313.722 4.097 20 0 DIADMN CC(C)(C)n1c2ccccc2nc1NCc1ccc2nc[nH]c2c1 ZINC001353003007 1053453477 /nfs/dbraw/zinc/45/34/77/1053453477.db2.gz JBNJLEFGRDIVTD-UHFFFAOYSA-N 0 1 319.412 4.280 20 0 DIADMN CCc1ccc(-c2ccc(C(=O)Nc3nc(C(C)C)n[nH]3)o2)cc1 ZINC001322096317 1053457945 /nfs/dbraw/zinc/45/79/45/1053457945.db2.gz WJWCQNFYCZIYAB-UHFFFAOYSA-N 0 1 324.384 4.003 20 0 DIADMN CCc1ccc(-c2ccc(C(=O)Nc3n[nH]c(C(C)C)n3)o2)cc1 ZINC001322096317 1053457951 /nfs/dbraw/zinc/45/79/51/1053457951.db2.gz WJWCQNFYCZIYAB-UHFFFAOYSA-N 0 1 324.384 4.003 20 0 DIADMN C[C@@H](N[C@@H](C)c1ccc(F)cc1F)c1ccccc1N(C)C ZINC000093941232 1053463709 /nfs/dbraw/zinc/46/37/09/1053463709.db2.gz XLLRVECCJMSBDA-QWHCGFSZSA-N 0 1 304.384 4.443 20 0 DIADMN Cc1ccc(-c2n[nH]c(SCCSC(C)(C)C)n2)cc1 ZINC000801653230 1053464919 /nfs/dbraw/zinc/46/49/19/1053464919.db2.gz AEGWJDGCMPDJAK-UHFFFAOYSA-N 0 1 307.488 4.404 20 0 DIADMN CCN(CC)[C@H](C(=O)N[C@H](C)CCC(C)(C)C)c1ccccc1 ZINC001435204750 1053470263 /nfs/dbraw/zinc/47/02/63/1053470263.db2.gz AFQZLOJWKGMAAG-AEFFLSMTSA-N 0 1 318.505 4.401 20 0 DIADMN CN1CCN(C(=O)CC2CCC(C)(C)CC2)C2(CCCCC2)C1 ZINC001435294653 1053502523 /nfs/dbraw/zinc/50/25/23/1053502523.db2.gz BONRFLQZVXBIFD-UHFFFAOYSA-N 0 1 320.521 4.070 20 0 DIADMN CCC(CC)CC(=O)Nc1nc2ccc(Br)cc2[nH]1 ZINC001435319209 1053511383 /nfs/dbraw/zinc/51/13/83/1053511383.db2.gz YZNOOEFFEZYNBA-UHFFFAOYSA-N 0 1 324.222 4.090 20 0 DIADMN Brc1ccc(CN[C@H](c2cccnc2)C2CCC2)o1 ZINC001322476514 1053511487 /nfs/dbraw/zinc/51/14/87/1053511487.db2.gz YXEKWRRZERNFBH-HNNXBMFYSA-N 0 1 321.218 4.068 20 0 DIADMN COc1ccc([C@@H](C)N[C@@H](C)c2ccoc2)cc1Br ZINC000094868585 1053512460 /nfs/dbraw/zinc/51/24/60/1053512460.db2.gz CTXHTYWBHGRQMA-MNOVXSKESA-N 0 1 324.218 4.463 20 0 DIADMN CC(C)c1nc(CN[C@H]2C[C@H](c3cccc(F)c3)C2)cs1 ZINC001322531147 1053518203 /nfs/dbraw/zinc/51/82/03/1053518203.db2.gz XIGODMGYDCYKAF-CTYIDZIISA-N 0 1 304.434 4.441 20 0 DIADMN CC(C)c1ncc(C(=O)N2C[C@@H](C)CC[C@H]2c2ccccc2)[nH]1 ZINC001322528199 1053519014 /nfs/dbraw/zinc/51/90/14/1053519014.db2.gz YHEAWFCICCYRDU-YOEHRIQHSA-N 0 1 311.429 4.147 20 0 DIADMN Cc1occc1CN[C@H](COc1ccccc1)c1ccccc1 ZINC001200300205 1053536264 /nfs/dbraw/zinc/53/62/64/1053536264.db2.gz AFERPOSRDCAHLP-HXUWFJFHSA-N 0 1 307.393 4.498 20 0 DIADMN c1ccc2[nH]c(C3CN(CCSC4CCCCC4)C3)nc2c1 ZINC000619719657 1053540674 /nfs/dbraw/zinc/54/06/74/1053540674.db2.gz SALAIMTWGBZYIN-UHFFFAOYSA-N 0 1 315.486 4.028 20 0 DIADMN C[C@H](c1ccc(OC(F)F)cc1)[N@H+]1CCOc2ccccc2C1 ZINC000619725555 1053541410 /nfs/dbraw/zinc/54/14/10/1053541410.db2.gz ZUUCCELNKQMLKP-CYBMUJFWSA-N 0 1 319.351 4.244 20 0 DIADMN C[C@H](c1ccc(OC(F)F)cc1)N1CCOc2ccccc2C1 ZINC000619725555 1053541423 /nfs/dbraw/zinc/54/14/23/1053541423.db2.gz ZUUCCELNKQMLKP-CYBMUJFWSA-N 0 1 319.351 4.244 20 0 DIADMN Cc1cc(CN(Cc2cccc(C(F)(F)F)c2)C(C)C)[nH]n1 ZINC001323285271 1053573158 /nfs/dbraw/zinc/57/31/58/1053573158.db2.gz FFZRFQZLQSNPNM-UHFFFAOYSA-N 0 1 311.351 4.148 20 0 DIADMN Cc1cc(CN(Cc2cccc(C(F)(F)F)c2)C(C)C)n[nH]1 ZINC001323285271 1053573174 /nfs/dbraw/zinc/57/31/74/1053573174.db2.gz FFZRFQZLQSNPNM-UHFFFAOYSA-N 0 1 311.351 4.148 20 0 DIADMN C[C@H](NCc1ccc2c(c1)CCC2)c1nc2c(s1)CCCC2 ZINC001323395889 1053579966 /nfs/dbraw/zinc/57/99/66/1053579966.db2.gz FQYHTYLYRWVDCM-ZDUSSCGKSA-N 0 1 312.482 4.361 20 0 DIADMN COc1ccccc1C1(N[C@@H](C)c2ccc(Cl)nc2)CCC1 ZINC001323504283 1053584919 /nfs/dbraw/zinc/58/49/19/1053584919.db2.gz CLMVEBWTVQOXHJ-ZDUSSCGKSA-N 0 1 316.832 4.474 20 0 DIADMN Cc1cc(CNC(c2cccc(C)c2)c2cccc(C)c2)[nH]n1 ZINC001323623901 1053591139 /nfs/dbraw/zinc/59/11/39/1053591139.db2.gz ASUKOAGBBNSAHQ-UHFFFAOYSA-N 0 1 305.425 4.214 20 0 DIADMN CC(C)COC[C@H](NCCc1ccc(F)cc1F)c1ccco1 ZINC001323660023 1053592613 /nfs/dbraw/zinc/59/26/13/1053592613.db2.gz OCXRXGLYXCOAGI-KRWDZBQOSA-N 0 1 323.383 4.104 20 0 DIADMN CCc1ccc(-c2n[nH]c(SCc3scnc3C)n2)cc1 ZINC001323865779 1053607434 /nfs/dbraw/zinc/60/74/34/1053607434.db2.gz MNEWZYRUNIQFGB-UHFFFAOYSA-N 0 1 316.455 4.091 20 0 DIADMN CCN1CCC[C@H](Oc2c(Cl)cccc2C(F)(F)F)C1 ZINC001230826597 1053608141 /nfs/dbraw/zinc/60/81/41/1053608141.db2.gz PUSQMIBWUZNXFY-JTQLQIEISA-N 0 1 307.743 4.222 20 0 DIADMN CCCc1ccccc1NC(=O)NCc1nc2cccc(C)c2[nH]1 ZINC000153393755 1053610532 /nfs/dbraw/zinc/61/05/32/1053610532.db2.gz CKPHLKRFWDLLHM-UHFFFAOYSA-N 0 1 322.412 4.146 20 0 DIADMN Cc1ccoc1CN[C@@H](C)c1ccc(OCC2CC2)c(F)c1 ZINC000153416867 1053613083 /nfs/dbraw/zinc/61/30/83/1053613083.db2.gz RNIZIFQSWKPGQC-ZDUSSCGKSA-N 0 1 303.377 4.367 20 0 DIADMN Oc1ccc2c(c1)C1(CC1)CN([C@@H]1CCc3c1cccc3F)C2 ZINC001324045810 1053619314 /nfs/dbraw/zinc/61/93/14/1053619314.db2.gz BLXQDGSORMHMCD-LJQANCHMSA-N 0 1 309.384 4.066 20 0 DIADMN Cc1cccc2nc(CNCc3ccc(C(C)(C)C)s3)cn21 ZINC001200390127 1053621371 /nfs/dbraw/zinc/62/13/71/1053621371.db2.gz GOGBEBSTNLEZGN-UHFFFAOYSA-N 0 1 313.470 4.292 20 0 DIADMN Fc1cc(O[C@@H](c2ccccc2)C(F)(F)F)cc2[nH]ncc21 ZINC001230931179 1053628880 /nfs/dbraw/zinc/62/88/80/1053628880.db2.gz LWCDLZRUZGRNPB-AWEZNQCLSA-N 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Cc1cc(O)cc(CN(C)Cc2ccc(C(F)(F)F)cc2)c1 ZINC001232885652 1054140086 /nfs/dbraw/zinc/14/00/86/1054140086.db2.gz LVBIZFFCBPVYPW-UHFFFAOYSA-N 0 1 309.331 4.351 20 0 DIADMN CC(C)c1ccccc1CNCc1cccnc1OCC(F)F ZINC000848544526 1054141453 /nfs/dbraw/zinc/14/14/53/1054141453.db2.gz MZPQPMIQHUQQOY-UHFFFAOYSA-N 0 1 320.383 4.139 20 0 DIADMN Cc1cc(F)ccc1NC(=O)c1cccc(C(F)(F)F)c1O ZINC000622277162 1054143180 /nfs/dbraw/zinc/14/31/80/1054143180.db2.gz SCHRUZOWCJNFDM-UHFFFAOYSA-N 0 1 313.250 4.111 20 0 DIADMN CC(C)(C)OCc1ccc(NC(=O)c2cccc(F)c2O)cc1 ZINC001355469253 1054144531 /nfs/dbraw/zinc/14/45/31/1054144531.db2.gz KCUUBXYWIANDDC-UHFFFAOYSA-N 0 1 317.360 4.099 20 0 DIADMN Cc1cc(CN2CCC[C@H]3CCCC[C@@H]32)ncc1Br ZINC001232907167 1054146085 /nfs/dbraw/zinc/14/60/85/1054146085.db2.gz MILVFQKBURUSRO-CJNGLKHVSA-N 0 1 323.278 4.307 20 0 DIADMN Cc1cc([C@@H]2CCCN2Cc2ccccc2-n2cccc2)no1 ZINC001232909798 1054146359 /nfs/dbraw/zinc/14/63/59/1054146359.db2.gz WNWSWBQEVIZZAN-IBGZPJMESA-N 0 1 307.397 4.111 20 0 DIADMN c1ccn(-c2ccccc2CN2CCC[C@H]2c2nccs2)c1 ZINC001232910390 1054150946 /nfs/dbraw/zinc/15/09/46/1054150946.db2.gz KFPBOECXVIXAKM-KRWDZBQOSA-N 0 1 309.438 4.271 20 0 DIADMN [O-]c1c(F)ccc(C[N@H+]2CCC[C@H]2Cc2ccc(F)cc2)c1F ZINC001232938522 1054152300 /nfs/dbraw/zinc/15/23/00/1054152300.db2.gz FGRJLCFSEIEJJG-HNNXBMFYSA-N 0 1 321.342 4.017 20 0 DIADMN Cc1ccc(OC2CCN(Cc3ccc4ncoc4c3)CC2)cc1 ZINC001232940583 1054152416 /nfs/dbraw/zinc/15/24/16/1054152416.db2.gz CNOIPYFROKJJCO-UHFFFAOYSA-N 0 1 322.408 4.180 20 0 DIADMN C[N@@H+](Cc1ccc(F)c([O-])c1F)C(C)(C)Cc1ccccc1 ZINC001232939102 1054153768 /nfs/dbraw/zinc/15/37/68/1054153768.db2.gz FABNJYGKAQQGOG-UHFFFAOYSA-N 0 1 305.368 4.124 20 0 DIADMN [O-]c1c(F)ccc(C[N@H+]2CC[C@@H](c3ccc(Cl)cc3)C2)c1F ZINC001232938007 1054154142 /nfs/dbraw/zinc/15/41/42/1054154142.db2.gz XTFUTQWNZNHJBZ-GFCCVEGCSA-N 0 1 323.770 4.313 20 0 DIADMN c1c(CN2C[C@H]3CCCC[C@]32c2ccccc2)onc1C1CC1 ZINC001333587212 1054161223 /nfs/dbraw/zinc/16/12/23/1054161223.db2.gz 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Cc1nnsc1[C@@H](C)N[C@H](C)c1ccccc1C(F)(F)F ZINC001334641510 1054194043 /nfs/dbraw/zinc/19/40/43/1054194043.db2.gz BSAKYVUOEUNZGW-RKDXNWHRSA-N 0 1 315.364 4.277 20 0 DIADMN CCOc1cncc(CN[C@@H](C)c2ccc(Cl)c(F)c2)c1 ZINC001334647483 1054194098 /nfs/dbraw/zinc/19/40/98/1054194098.db2.gz RNRBLLPEWCUDEG-NSHDSACASA-N 0 1 308.784 4.124 20 0 DIADMN C[C@@H](c1ccc(F)nc1)[N@H+]1CCC[C@@H](c2nc3ccccc3[nH]2)C1 ZINC001334613052 1054194463 /nfs/dbraw/zinc/19/44/63/1054194463.db2.gz DRLKIZIKKXCXMR-DZGCQCFKSA-N 0 1 324.403 4.038 20 0 DIADMN CC(C)Oc1ncc(Cl)cc1CN1C[C@@H]2CCCC[C@@H]2C1 ZINC001233167517 1054195483 /nfs/dbraw/zinc/19/54/83/1054195483.db2.gz SCKJZANNIBMAPQ-OKILXGFUSA-N 0 1 308.853 4.144 20 0 DIADMN FC(F)(F)c1cc(CN2CCC3(CCCOC3)CC2)cs1 ZINC001233177328 1054196230 /nfs/dbraw/zinc/19/62/30/1054196230.db2.gz KFUIXPAMOQGWHU-UHFFFAOYSA-N 0 1 319.392 4.160 20 0 DIADMN CC[C@@H]1CCCN(C(=O)c2cc(C3CCCCC3)[nH]n2)CC1 ZINC000622378314 1054196234 /nfs/dbraw/zinc/19/62/34/1054196234.db2.gz 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COc1cccc([C@@H](C)N[C@@H]2CCCOc3cc(F)ccc32)c1 ZINC000179966034 1054721510 /nfs/dbraw/zinc/72/15/10/1054721510.db2.gz NUYCOKWSWAOSBY-FZKQIMNGSA-N 0 1 315.388 4.399 20 0 DIADMN COc1cc(C[N@@H+](C)Cc2ccc(Cl)cc2)cc(F)c1F ZINC001235443902 1054721957 /nfs/dbraw/zinc/72/19/57/1054721957.db2.gz DTVWZNPGVDPQAK-UHFFFAOYSA-N 0 1 311.759 4.259 20 0 DIADMN COc1cc(CN(C)Cc2ccc(Cl)cc2)cc(F)c1F ZINC001235443902 1054721978 /nfs/dbraw/zinc/72/19/78/1054721978.db2.gz DTVWZNPGVDPQAK-UHFFFAOYSA-N 0 1 311.759 4.259 20 0 DIADMN CCOc1cc(CN2CCC(C)(C)C2)ccc1Br ZINC001235447851 1054724742 /nfs/dbraw/zinc/72/47/42/1054724742.db2.gz IXUFTOKJMYMLLC-UHFFFAOYSA-N 0 1 312.251 4.080 20 0 DIADMN COc1cc(C)nc(CN[C@H]2CCCc3ccc(Cl)cc32)c1 ZINC000623752113 1054724683 /nfs/dbraw/zinc/72/46/83/1054724683.db2.gz ZWFCLORCLMTCDZ-SFHVURJKSA-N 0 1 316.832 4.219 20 0 DIADMN CCOc1cc(CN2CCC[C@H]2CC)ccc1Br ZINC001235449802 1054725851 /nfs/dbraw/zinc/72/58/51/1054725851.db2.gz PTECEYOXLVRLGC-CYBMUJFWSA-N 0 1 312.251 4.222 20 0 DIADMN CC(C)O[C@@H]1C[C@H](NCc2nc(Cl)ccc2Cl)C1(C)C ZINC001473483735 1054726489 /nfs/dbraw/zinc/72/64/89/1054726489.db2.gz OQCCYKLPGKUCCF-QWHCGFSZSA-N 0 1 317.260 4.070 20 0 DIADMN CCCCCCN(C)CC(=O)Nc1nc(C(C)C)c(C)s1 ZINC001453233132 1054730163 /nfs/dbraw/zinc/73/01/63/1054730163.db2.gz VDFCTGUUCKZNEY-UHFFFAOYSA-N 0 1 311.495 4.026 20 0 DIADMN Fc1ccc(C[C@@H]2CCCN2Cc2cncc(F)c2Cl)cc1 ZINC001235505735 1054734449 /nfs/dbraw/zinc/73/44/49/1054734449.db2.gz VIYNFNDPINCMPR-HNNXBMFYSA-N 0 1 322.786 4.220 20 0 DIADMN CC[C@H](CCc1ccccc1)NC(=O)c1ccc(Cl)c(O)c1 ZINC001453460776 1054736417 /nfs/dbraw/zinc/73/64/17/1054736417.db2.gz BKDKOGVQUWPCQS-OAHLLOKOSA-N 0 1 317.816 4.187 20 0 DIADMN COc1ccc(Br)cc1CN1[C@H](C)CCC1(C)C ZINC001473543997 1054737900 /nfs/dbraw/zinc/73/79/00/1054737900.db2.gz JTJWIZBIDVUJTG-LLVKDONJSA-N 0 1 312.251 4.221 20 0 DIADMN Cc1ccnc(CN2CC[C@@H](c3cccc(F)c3)C2)c1Cl ZINC001235578487 1054744212 /nfs/dbraw/zinc/74/42/12/1054744212.db2.gz CENHZESHOAGZHT-CQSZACIVSA-N 0 1 304.796 4.172 20 0 DIADMN Cc1ccnc(CN2CC[C@H](c3ccccc3F)C2)c1Cl ZINC001235583640 1054744687 /nfs/dbraw/zinc/74/46/87/1054744687.db2.gz FQLXEQHUBNONQX-ZDUSSCGKSA-N 0 1 304.796 4.172 20 0 DIADMN Cc1ccnc(CN2CC[C@H](c3ccc(F)cc3)C2)c1Cl ZINC001235587897 1054746116 /nfs/dbraw/zinc/74/61/16/1054746116.db2.gz IUSIJKIVBZMOMX-AWEZNQCLSA-N 0 1 304.796 4.172 20 0 DIADMN CCc1ccccc1NC(=O)CN[C@@H](C)c1cc(C)sc1C ZINC000180376908 1054752370 /nfs/dbraw/zinc/75/23/70/1054752370.db2.gz HIZISADYLNAGCE-ZDUSSCGKSA-N 0 1 316.470 4.217 20 0 DIADMN C[C@@H]1c2cccn2CC[N@@H+]1Cc1ccccc1-c1ccncc1 ZINC001235617173 1054756155 /nfs/dbraw/zinc/75/61/55/1054756155.db2.gz ACHHGJZSPMHBFC-MRXNPFEDSA-N 0 1 303.409 4.127 20 0 DIADMN C[C@@H]1c2cccn2CCN1Cc1ccccc1-c1ccncc1 ZINC001235617173 1054756165 /nfs/dbraw/zinc/75/61/65/1054756165.db2.gz ACHHGJZSPMHBFC-MRXNPFEDSA-N 0 1 303.409 4.127 20 0 DIADMN Cc1cncc(Br)c1CN(C)CC1CCCCC1 ZINC001235640496 1054759049 /nfs/dbraw/zinc/75/90/49/1054759049.db2.gz AUWTVNHBQVPNRX-UHFFFAOYSA-N 0 1 311.267 4.165 20 0 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CC1=C(Br)CN(C[C@@H](C)c2ccc(F)cc2)CC1 ZINC001560791007 1060651577 /nfs/dbraw/zinc/65/15/77/1060651577.db2.gz YFUFLIBCQNVDCH-GFCCVEGCSA-N 0 1 312.226 4.304 20 0 DIADMN Cc1ccc(-c2noc([C@H](C)N[C@@H](C)CC3CCC3)n2)cc1F ZINC001560807069 1060669229 /nfs/dbraw/zinc/66/92/29/1060669229.db2.gz UTMQODYWWKFMBM-STQMWFEESA-N 0 1 317.408 4.413 20 0 DIADMN FC(F)(F)Cc1ccc(CN(Cc2cccnc2)C2CC2)cc1 ZINC001560813661 1060672434 /nfs/dbraw/zinc/67/24/34/1060672434.db2.gz FGNSSUMSAFOGJI-UHFFFAOYSA-N 0 1 320.358 4.351 20 0 DIADMN Cc1nc2ccc(Cc3ccc(OC(F)(F)F)cc3)cc2[nH]1 ZINC001250199116 1060677712 /nfs/dbraw/zinc/67/77/12/1060677712.db2.gz IHLKSYPLBNMBEK-UHFFFAOYSA-N 0 1 306.287 4.361 20 0 DIADMN Cn1cc(Cl)c(CNCC2CCC3(CCCCC3)CC2)n1 ZINC001560839927 1060695875 /nfs/dbraw/zinc/69/58/75/1060695875.db2.gz DYEYMNIMJXOCSQ-UHFFFAOYSA-N 0 1 309.885 4.304 20 0 DIADMN CCCCC[C@@H](C)N[C@H](CCNC(=O)OC(C)(C)C)C(F)F ZINC001560841282 1060697490 /nfs/dbraw/zinc/69/74/90/1060697490.db2.gz NVUQXMGGGBDFPO-CHWSQXEVSA-N 0 1 322.440 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323.358 4.145 20 0 DIADMN Oc1c(F)cc(Cl)cc1-c1nc2c([nH]1)c(F)cc(F)c2F ZINC001251634305 1061427072 /nfs/dbraw/zinc/42/70/72/1061427072.db2.gz AJXBRANPWQEWAZ-UHFFFAOYSA-N 0 1 316.641 4.145 20 0 DIADMN Cc1coc(-c2nc3cc(Cl)c(OC(F)(F)F)cc3[nH]2)n1 ZINC001251639058 1061427187 /nfs/dbraw/zinc/42/71/87/1061427187.db2.gz ZDBKKJGGGHALSB-UHFFFAOYSA-N 0 1 317.654 4.078 20 0 DIADMN CCCCCC[C@H](O)CN1[C@H](C)CO[C@H](c2ccccc2)[C@@H]1C ZINC001473834804 1061428352 /nfs/dbraw/zinc/42/83/52/1061428352.db2.gz WEORWJVVABNDNN-UMGGQSCQSA-N 0 1 319.489 4.168 20 0 DIADMN Fc1cc2[nH]c(-c3cccc4c3OCC4)nc2cc1C(F)(F)F ZINC001251648265 1061429635 /nfs/dbraw/zinc/42/96/35/1061429635.db2.gz KEOZULPDWCRJGL-UHFFFAOYSA-N 0 1 322.261 4.323 20 0 DIADMN CCc1n[nH]cc1-c1nc2cc(C(F)(F)F)cc(Cl)c2[nH]1 ZINC001251641277 1061429705 /nfs/dbraw/zinc/42/97/05/1061429705.db2.gz GQLBFNGQUKSSQK-UHFFFAOYSA-N 0 1 314.698 4.188 20 0 DIADMN C[C@@]1(Cc2cccs2)CCCN1Cc1ncc(Cl)s1 ZINC001473846715 1061434704 /nfs/dbraw/zinc/43/47/04/1061434704.db2.gz OTBCCBLDKCZFBT-AWEZNQCLSA-N 0 1 312.891 4.455 20 0 DIADMN Cc1cc2nc(-c3cccc(-c4ccccn4)n3)[nH]c2c(C)c1 ZINC001251662626 1061435123 /nfs/dbraw/zinc/43/51/23/1061435123.db2.gz IYDRQXBVLBLZSW-UHFFFAOYSA-N 0 1 300.365 4.304 20 0 DIADMN CCc1ncc(-c2nc3ccc(OC(F)(F)F)cc3[nH]2)s1 ZINC001251662198 1061435437 /nfs/dbraw/zinc/43/54/37/1061435437.db2.gz ACBHWVVPUBENTM-UHFFFAOYSA-N 0 1 313.304 4.147 20 0 DIADMN Fc1cccc(CN2CCC(c3ccc4[nH]ccc4c3)CC2)n1 ZINC001473861364 1061436249 /nfs/dbraw/zinc/43/62/49/1061436249.db2.gz VZFWYABLAORHJG-UHFFFAOYSA-N 0 1 309.388 4.082 20 0 DIADMN COc1cc2[nH]c(-c3cccc(-c4ccccn4)n3)nc2cc1C ZINC001251666300 1061436691 /nfs/dbraw/zinc/43/66/91/1061436691.db2.gz IQSDBWHQMCTZSC-UHFFFAOYSA-N 0 1 316.364 4.004 20 0 DIADMN Brc1cnsc1CNC1(C2CCCCC2)CC1 ZINC001473869960 1061442252 /nfs/dbraw/zinc/44/22/52/1061442252.db2.gz JJKDSGJTBHBESR-UHFFFAOYSA-N 0 1 315.280 4.108 20 0 DIADMN Cc1cc2nc(-c3ccccc3Oc3cnccn3)[nH]c2cc1F ZINC001251695600 1061445393 /nfs/dbraw/zinc/44/53/93/1061445393.db2.gz HPTOCGRVCIATQN-UHFFFAOYSA-N 0 1 320.327 4.260 20 0 DIADMN CC[N@H+](Cc1nc2c(s1)C[C@H](C)CC2)C[C@@H](COC)C(C)C ZINC001473892273 1061450660 /nfs/dbraw/zinc/45/06/60/1061450660.db2.gz IWNMYSJVHVVDKS-CABCVRRESA-N 0 1 324.534 4.008 20 0 DIADMN Clc1ccc2[nH]c(-c3cccc4cncn43)nc2c1Cl ZINC001251706961 1061451344 /nfs/dbraw/zinc/45/13/44/1061451344.db2.gz CAEPXSJLCYOQEB-UHFFFAOYSA-N 0 1 303.152 4.184 20 0 DIADMN COc1cnc(F)c(-c2nc3cc(Cl)cc(Cl)c3[nH]2)c1 ZINC001251707581 1061451488 /nfs/dbraw/zinc/45/14/88/1061451488.db2.gz ZEWILYNBVUAPLN-UHFFFAOYSA-N 0 1 312.131 4.079 20 0 DIADMN CCCCn1c2cc(F)ccc2nc1-c1cccc2cncn21 ZINC001251707003 1061451833 /nfs/dbraw/zinc/45/18/33/1061451833.db2.gz FPLHUCUNVKVRNH-UHFFFAOYSA-N 0 1 308.360 4.290 20 0 DIADMN FC(F)(F)c1cccc(CN2CCCC[C@]23CCCOC3)c1 ZINC001473901505 1061452254 /nfs/dbraw/zinc/45/22/54/1061452254.db2.gz KGCZWPCKTKKTQA-MRXNPFEDSA-N 0 1 313.363 4.241 20 0 DIADMN COc1cc2nc(-c3cc(Cl)c(O)cc3F)[nH]c2cc1C ZINC001251711124 1061453372 /nfs/dbraw/zinc/45/33/72/1061453372.db2.gz XYIZOORQDGKIPY-UHFFFAOYSA-N 0 1 306.724 4.045 20 0 DIADMN C1=CC2(CCCCC2)N(Cc2nnc(-c3ccccc3)s2)C1 ZINC001473900392 1061453876 /nfs/dbraw/zinc/45/38/76/1061453876.db2.gz XMZGTUWXABIZFL-UHFFFAOYSA-N 0 1 311.454 4.280 20 0 DIADMN Oc1cc(F)c(-c2nc3cc4c(cc3[nH]2)CCC4)cc1Cl ZINC001251710588 1061453991 /nfs/dbraw/zinc/45/39/91/1061453991.db2.gz LEVWSUFMNGCIOL-UHFFFAOYSA-N 0 1 302.736 4.217 20 0 DIADMN Nc1ccnc(F)c1-c1nc2ccc(-c3cccs3)cc2[nH]1 ZINC001251714257 1061454298 /nfs/dbraw/zinc/45/42/98/1061454298.db2.gz QQPKPZRTELTQPO-UHFFFAOYSA-N 0 1 310.357 4.075 20 0 DIADMN COc1c(C)cnc(-c2nc3cc(Cl)c(F)cc3[nH]2)c1C ZINC001251718511 1061456740 /nfs/dbraw/zinc/45/67/40/1061456740.db2.gz NIJJSAQHPWDFAU-UHFFFAOYSA-N 0 1 305.740 4.043 20 0 DIADMN Fc1ccnc(Cl)c1-c1nc2ccc(C(F)(F)F)cc2[nH]1 ZINC001251724782 1061458603 /nfs/dbraw/zinc/45/86/03/1061458603.db2.gz OBKVSLGSPATYBH-UHFFFAOYSA-N 0 1 315.657 4.436 20 0 DIADMN c1csc(-c2cccc(-c3nc4cc5c(cc4[nH]3)OCC5)n2)c1 ZINC001251724470 1061458730 /nfs/dbraw/zinc/45/87/30/1061458730.db2.gz IFPUWEKQBKIVKZ-UHFFFAOYSA-N 0 1 319.389 4.288 20 0 DIADMN Fc1cc(F)c(F)c2[nH]c(-c3cccc(-c4cc[nH]n4)c3)nc21 ZINC001251722354 1061458925 /nfs/dbraw/zinc/45/89/25/1061458925.db2.gz YTNYHUTUUCYVGD-UHFFFAOYSA-N 0 1 314.270 4.037 20 0 DIADMN CC(C)Oc1c(F)cccc1-c1nc2ccc(N(C)C)cc2[nH]1 ZINC001251732368 1061462081 /nfs/dbraw/zinc/46/20/81/1061462081.db2.gz FMHJKVNBENVYTA-UHFFFAOYSA-N 0 1 313.376 4.222 20 0 DIADMN COc1ccc2nc(-c3cccc(F)c3OC(C)C)[nH]c2c1 ZINC001251732506 1061462184 /nfs/dbraw/zinc/46/21/84/1061462184.db2.gz ITRXFJSUECYPMI-UHFFFAOYSA-N 0 1 300.333 4.165 20 0 DIADMN Fc1ccc2nc(-c3cncc(OCc4ccccc4)c3)[nH]c2c1 ZINC001251734747 1061462344 /nfs/dbraw/zinc/46/23/44/1061462344.db2.gz AHJPDTPGABVQHF-UHFFFAOYSA-N 0 1 319.339 4.343 20 0 DIADMN CCOc1cccc(F)c1CNCCOc1ccc(Cl)cc1 ZINC001473915096 1061463231 /nfs/dbraw/zinc/46/32/31/1061463231.db2.gz ZQTSCIZICNROKZ-UHFFFAOYSA-N 0 1 323.795 4.046 20 0 DIADMN FC(F)(F)c1cccnc1CN[C@@H]1CCSc2ccccc21 ZINC001473915377 1061464234 /nfs/dbraw/zinc/46/42/34/1061464234.db2.gz VGOFGKOLGPXZHW-CYBMUJFWSA-N 0 1 324.371 4.427 20 0 DIADMN COc1cc(-c2nc3ccc(SC)cc3[nH]2)c(Cl)cn1 ZINC001251735088 1061464424 /nfs/dbraw/zinc/46/44/24/1061464424.db2.gz MHEUEINEGPSVPN-UHFFFAOYSA-N 0 1 305.790 4.009 20 0 DIADMN Fc1ccc2c(c1)[C@@H](NCc1cc3cccnc3o1)CCS2 ZINC001473919014 1061467700 /nfs/dbraw/zinc/46/77/00/1061467700.db2.gz IJEPMXQGZJUYDB-HNNXBMFYSA-N 0 1 314.385 4.294 20 0 DIADMN CCCn1cc(CN[C@@H]2CCSc3ccc(F)cc32)c(C)n1 ZINC001473918815 1061468873 /nfs/dbraw/zinc/46/88/73/1061468873.db2.gz CWSARXAGNAAIKD-MRXNPFEDSA-N 0 1 319.449 4.067 20 0 DIADMN CC(C)Oc1cncc(-c2nc3cc(F)cc(Cl)c3[nH]2)c1 ZINC001251744821 1061469706 /nfs/dbraw/zinc/46/97/06/1061469706.db2.gz HHRYDUZKZAEOJN-UHFFFAOYSA-N 0 1 305.740 4.205 20 0 DIADMN CCOc1ccc2nc(-c3c(F)cc(C)cc3OC)[nH]c2c1 ZINC001251753053 1061474604 /nfs/dbraw/zinc/47/46/04/1061474604.db2.gz YVNZSULISQQPQP-UHFFFAOYSA-N 0 1 300.333 4.085 20 0 DIADMN CC(C)c1ccc(-c2nc3ccc(N(C)C)cc3[nH]2)c(Cl)n1 ZINC001251764122 1061476119 /nfs/dbraw/zinc/47/61/19/1061476119.db2.gz BLGGUXIEPIJBTL-UHFFFAOYSA-N 0 1 314.820 4.468 20 0 DIADMN CCCn1cc(CN[C@H]2CCSc3c(F)cccc32)c(C)n1 ZINC001473928526 1061476124 /nfs/dbraw/zinc/47/61/24/1061476124.db2.gz RCZHZXOMWZKZIV-INIZCTEOSA-N 0 1 319.449 4.067 20 0 DIADMN CN(C)c1ccc2nc(-c3cc(F)cc(N4CCCC4)c3)[nH]c2c1 ZINC001251763178 1061476365 /nfs/dbraw/zinc/47/63/65/1061476365.db2.gz SHPZLKOEMULKGC-UHFFFAOYSA-N 0 1 324.403 4.035 20 0 DIADMN COc1cc(F)c(-c2nc3ccc(N(C)C)cc3[nH]2)cc1Cl ZINC001251770278 1061479324 /nfs/dbraw/zinc/47/93/24/1061479324.db2.gz GMCVXBIXHDTQQQ-UHFFFAOYSA-N 0 1 319.767 4.097 20 0 DIADMN C[C@H]1CCCC[C@H]1OCCNCc1cccc(OC2CC2)c1F ZINC001473934932 1061479959 /nfs/dbraw/zinc/47/99/59/1061479959.db2.gz ZRTBOTISGHTQTB-WMLDXEAASA-N 0 1 321.436 4.052 20 0 DIADMN CC(=O)Nc1ccc2nc(-c3c4ccoc4ccc3F)[nH]c2c1 ZINC001251778740 1061481148 /nfs/dbraw/zinc/48/11/48/1061481148.db2.gz NZUNTKCLAUIQNJ-UHFFFAOYSA-N 0 1 309.300 4.074 20 0 DIADMN COc1cc2nc(-c3c4ccoc4ccc3F)[nH]c2cc1F ZINC001251778945 1061481700 /nfs/dbraw/zinc/48/17/00/1061481700.db2.gz VHPVYPORFOCUIW-UHFFFAOYSA-N 0 1 300.264 4.263 20 0 DIADMN Cc1ccc([C@H](C)NCc2cnc([C@@H]3CCCO3)s2)cc1 ZINC001473941033 1061485077 /nfs/dbraw/zinc/48/50/77/1061485077.db2.gz KOIXOHDOBKPCPJ-BBRMVZONSA-N 0 1 302.443 4.154 20 0 DIADMN COc1nccc(Cl)c1-c1nc2ccc(C(C)C)cc2[nH]1 ZINC001251791809 1061487295 /nfs/dbraw/zinc/48/72/95/1061487295.db2.gz GQNZAMMPLCKOOA-UHFFFAOYSA-N 0 1 301.777 4.410 20 0 DIADMN Fc1cc(C(F)(F)F)cnc1-c1nc2ccc(Cl)cc2[nH]1 ZINC001251790108 1061487539 /nfs/dbraw/zinc/48/75/39/1061487539.db2.gz UMGIDMQYTVHBGC-UHFFFAOYSA-N 0 1 315.657 4.436 20 0 DIADMN Cc1cc2nc(-c3ncc(C(F)(F)F)cc3F)[nH]c2c(C)c1 ZINC001251789980 1061487567 /nfs/dbraw/zinc/48/75/67/1061487567.db2.gz RCPAUTJRJGABHL-UHFFFAOYSA-N 0 1 309.266 4.400 20 0 DIADMN COc1ccc(-c2nc3cc(C)c(F)cc3[nH]2)c(OC)c1Cl ZINC001251792208 1061489348 /nfs/dbraw/zinc/48/93/48/1061489348.db2.gz RMNSTKZDAIXYHF-UHFFFAOYSA-N 0 1 320.751 4.348 20 0 DIADMN Cc1ccc2nc(-c3nc4c(ccc(F)c4Cl)[nH]3)[nH]c2c1 ZINC001251799248 1061492494 /nfs/dbraw/zinc/49/24/94/1061492494.db2.gz MSRFOHVURDEALX-UHFFFAOYSA-N 0 1 300.724 4.207 20 0 DIADMN COc1cc2[nH]c(-c3ccc(Cl)c(C)n3)nc2cc1Cl ZINC001251804891 1061494327 /nfs/dbraw/zinc/49/43/27/1061494327.db2.gz UEXWMLCDKZGADP-UHFFFAOYSA-N 0 1 308.168 4.249 20 0 DIADMN Cc1cc(-c2nc3c([nH]2)c(F)c(F)cc3F)c(Cl)nc1C ZINC001251809958 1061496600 /nfs/dbraw/zinc/49/66/00/1061496600.db2.gz WHVDQTQTMMJYJC-UHFFFAOYSA-N 0 1 311.694 4.312 20 0 DIADMN CC(C)COc1cccc(CNCc2cccc(Cl)c2N)c1 ZINC001473954475 1061496875 /nfs/dbraw/zinc/49/68/75/1061496875.db2.gz DNYPGYYYGUJBRU-UHFFFAOYSA-N 0 1 318.848 4.247 20 0 DIADMN CC(C)c1ccc(CNCc2cnn(-c3ccc(F)cc3)c2)cc1 ZINC001473955104 1061497091 /nfs/dbraw/zinc/49/70/91/1061497091.db2.gz TWLGWIDJHQYBDA-UHFFFAOYSA-N 0 1 323.415 4.425 20 0 DIADMN CC[C@H](C)c1nn(C)cc1-c1nc2cc(F)cc(Cl)c2[nH]1 ZINC001251817200 1061499089 /nfs/dbraw/zinc/49/90/89/1061499089.db2.gz XZDLWCQLDSCEIY-QMMMGPOBSA-N 0 1 306.772 4.269 20 0 DIADMN CC[C@@H](C)c1nn(C)cc1-c1nc2ccc(Cl)c(C)c2[nH]1 ZINC001251817076 1061500343 /nfs/dbraw/zinc/50/03/43/1061500343.db2.gz SESMHKZPSVBKNC-SECBINFHSA-N 0 1 302.809 4.439 20 0 DIADMN CC(=CC(=O)Nc1nc(-c2cc3ccccc3o2)n[nH]1)C(C)(C)C ZINC001457781102 1061501767 /nfs/dbraw/zinc/50/17/67/1061501767.db2.gz RRYIKFKTCIOYIG-LUAWRHEFSA-N 0 1 324.384 4.149 20 0 DIADMN Cc1cc(C(F)(F)F)c(-c2nc3ccc(N(C)C)cc3[nH]2)cn1 ZINC001251833195 1061504329 /nfs/dbraw/zinc/50/43/29/1061504329.db2.gz CQEIIPBGANJBTE-UHFFFAOYSA-N 0 1 320.318 4.018 20 0 DIADMN COc1cc2[nH]c(-c3nc(C4CC4)cs3)nc2cc1Cl ZINC001251833296 1061505476 /nfs/dbraw/zinc/50/54/76/1061505476.db2.gz HYZHOSAWGRSVJR-UHFFFAOYSA-N 0 1 305.790 4.226 20 0 DIADMN CCc1coc(NC(=O)c2cc(Cl)c3ccccc3c2O)n1 ZINC001457810859 1061506217 /nfs/dbraw/zinc/50/62/17/1061506217.db2.gz 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316.489 4.478 20 0 DIADMN Cc1cccc([C@H](O)CNCc2cc(Cl)sc2Cl)c1 ZINC001474063905 1061611150 /nfs/dbraw/zinc/61/11/50/1061611150.db2.gz JYGIJXDUPFBCNG-GFCCVEGCSA-N 0 1 316.253 4.187 20 0 DIADMN Fc1ccc(-c2nnc(-c3cc(-c4ccccc4F)n[nH]3)o2)cc1 ZINC001252223862 1061611721 /nfs/dbraw/zinc/61/17/21/1061611721.db2.gz DJRPNMRPNAVKSO-UHFFFAOYSA-N 0 1 324.290 4.072 20 0 DIADMN COc1nsc(CN[C@@H]2c3ccccc3CC[C@H]2C)c1Cl ZINC001474087649 1061633795 /nfs/dbraw/zinc/63/37/95/1061633795.db2.gz ITBSOAZDBSVIBY-BMIGLBTASA-N 0 1 322.861 4.218 20 0 DIADMN CCCCC[C@H](NC(=O)CN1CCC(C)CC1)c1ccccc1 ZINC001464791258 1061634616 /nfs/dbraw/zinc/63/46/16/1061634616.db2.gz NTWBKUOSWZBQKC-IBGZPJMESA-N 0 1 316.489 4.156 20 0 DIADMN CCCCOc1ccc(-c2nnc([C@H](C)N3CCCC3)o2)cc1 ZINC001252406420 1061642158 /nfs/dbraw/zinc/64/21/58/1061642158.db2.gz YLHAYDMCNGMILJ-AWEZNQCLSA-N 0 1 315.417 4.072 20 0 DIADMN CC(C)c1nc([C@@H](C)NCc2cccc(CC3CCC3)c2)n[nH]1 ZINC001474100604 1061647298 /nfs/dbraw/zinc/64/72/98/1061647298.db2.gz 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CCc1ccc(-c2nnc([C@H]3CCN3C3CCCCC3)o2)cc1 ZINC001252972316 1061766439 /nfs/dbraw/zinc/76/64/39/1061766439.db2.gz CEIXTXPVDKCGBQ-QGZVFWFLSA-N 0 1 311.429 4.379 20 0 DIADMN Oc1ccc2c(c1)[C@H](NCc1c(Cl)ccc3cccnc31)CC2 ZINC001474215393 1061773019 /nfs/dbraw/zinc/77/30/19/1061773019.db2.gz YJIOCSZMEWMRBZ-GOSISDBHSA-N 0 1 324.811 4.371 20 0 DIADMN Cc1oc(-c2cccs2)nc1CNC[C@@H]1C(C)(C)C1(F)F ZINC001474219935 1061776905 /nfs/dbraw/zinc/77/69/05/1061776905.db2.gz SGPIFSONMVUXGI-GFCCVEGCSA-N 0 1 312.385 4.092 20 0 DIADMN CCc1cc2c(nc(C)nc2NCc2ccc3nc[nH]c3c2)s1 ZINC001458491148 1061794624 /nfs/dbraw/zinc/79/46/24/1061794624.db2.gz PPEBTFVJPRCTKI-UHFFFAOYSA-N 0 1 323.425 4.051 20 0 DIADMN Cc1ccc(-c2ncc(CN[C@@H](C)c3cnc(C)s3)s2)o1 ZINC001474232062 1061795605 /nfs/dbraw/zinc/79/56/05/1061795605.db2.gz QGMBQVGJVKAINX-JTQLQIEISA-N 0 1 319.455 4.327 20 0 DIADMN Fc1ccc2onc(CNCc3csc4ccccc34)c2c1 ZINC001474240538 1061802399 /nfs/dbraw/zinc/80/23/99/1061802399.db2.gz HWDIWZUSGGYKLO-UHFFFAOYSA-N 0 1 312.369 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322.537 4.362 20 0 DIADMN CCOc1ccc(CN[C@@H](c2ccc(OC)cc2)C2CCC2)o1 ZINC001474286671 1061855184 /nfs/dbraw/zinc/85/51/84/1061855184.db2.gz LMPMMRKENUYDDC-LJQANCHMSA-N 0 1 315.413 4.318 20 0 DIADMN Cc1ccc(-c2nc(CNC[C@]3(C)CCCCO3)cs2)cc1 ZINC001474285067 1061855311 /nfs/dbraw/zinc/85/53/11/1061855311.db2.gz QAJLWRJTCSMIAS-SFHVURJKSA-N 0 1 316.470 4.167 20 0 DIADMN Cc1cccnc1[C@H](C)NCc1ccc2c(c1)CCC(C)(C)O2 ZINC001474297562 1061866425 /nfs/dbraw/zinc/86/64/25/1061866425.db2.gz DWGIPVBOBYWDTD-HNNXBMFYSA-N 0 1 310.441 4.344 20 0 DIADMN C[C@@H](NCc1cc(Cl)cs1)c1cc(F)ccc1N(C)C ZINC001474304870 1061873319 /nfs/dbraw/zinc/87/33/19/1061873319.db2.gz BFCAFCHVGQYJGD-SNVBAGLBSA-N 0 1 312.841 4.457 20 0 DIADMN Cc1nn(C)c(CN2CC[C@H](c3ccccc3)[C@H](C)C2)c1Cl ZINC001474312003 1061880739 /nfs/dbraw/zinc/88/07/39/1061880739.db2.gz CNUOTDDRNXJSBI-CJNGLKHVSA-N 0 1 317.864 4.008 20 0 DIADMN COc1ccc2nc(SCc3nc(C(C)(C)C)co3)[nH]c2c1 ZINC001458736941 1061888866 /nfs/dbraw/zinc/88/88/66/1061888866.db2.gz 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CCCCCC(C)(C)C(=O)Nc1ccc2nc(N(C)C)[nH]c2c1 ZINC001467526148 1062143857 /nfs/dbraw/zinc/14/38/57/1062143857.db2.gz RCYANAAKHFXMMH-UHFFFAOYSA-N 0 1 316.449 4.174 20 0 DIADMN COc1ccc(CN(C)Cc2ccc(Cl)cc2OC)cc1C ZINC001459438358 1062144777 /nfs/dbraw/zinc/14/47/77/1062144777.db2.gz OGGBNXCETSZYCR-UHFFFAOYSA-N 0 1 319.832 4.298 20 0 DIADMN C[N@@H+](CC(=O)N1C[C@H](C(C)(C)C)c2ccccc21)CC(C)(C)C ZINC001467608177 1062150968 /nfs/dbraw/zinc/15/09/68/1062150968.db2.gz GZTUSBIYTZVCMK-INIZCTEOSA-N 0 1 316.489 4.141 20 0 DIADMN CN(CC(=O)N1C[C@H](C(C)(C)C)c2ccccc21)CC(C)(C)C ZINC001467608177 1062150984 /nfs/dbraw/zinc/15/09/84/1062150984.db2.gz GZTUSBIYTZVCMK-INIZCTEOSA-N 0 1 316.489 4.141 20 0 DIADMN CC(C)CC[N@@H+](CC(=O)OCc1ccccc1)C1CCCC1 ZINC001459458383 1062152328 /nfs/dbraw/zinc/15/23/28/1062152328.db2.gz RXJQTXLFYHTNDO-UHFFFAOYSA-N 0 1 303.446 4.021 20 0 DIADMN Oc1ccc(-c2nnc([C@@H]3C[C@H]3c3ccccc3)o2)cc1Cl ZINC001254514692 1062156086 /nfs/dbraw/zinc/15/60/86/1062156086.db2.gz 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CN(C)c1cccc([C@@H]2CCCN2Cc2cc(F)ccc2F)c1 ZINC001459523359 1062183345 /nfs/dbraw/zinc/18/33/45/1062183345.db2.gz RYPHRKLDIJKTIB-IBGZPJMESA-N 0 1 316.395 4.368 20 0 DIADMN CCCN(Cc1c(F)cccc1F)[C@@H]1C[C@H](OCC)C1(C)C ZINC001459537628 1062192532 /nfs/dbraw/zinc/19/25/32/1062192532.db2.gz SDQKWIUKEBIRGM-SJORKVTESA-N 0 1 311.416 4.380 20 0 DIADMN Cc1cc(N2CCCCCC2)ccc1NCCC[C@H]1CCO1 ZINC001474513266 1062195085 /nfs/dbraw/zinc/19/50/85/1062195085.db2.gz NEZOMYQMBWYAGY-SFHVURJKSA-N 0 1 302.462 4.356 20 0 DIADMN COc1cc(C)nc(CN2CCCC[C@@H]2c2ccc(C)cc2)c1 ZINC001459545173 1062195828 /nfs/dbraw/zinc/19/58/28/1062195828.db2.gz XGAWUKWXLUWGBN-HXUWFJFHSA-N 0 1 310.441 4.434 20 0 DIADMN C[C@@H]1C[C@H](C)CN1Cc1cccc(Br)c1Cl ZINC001459541045 1062198040 /nfs/dbraw/zinc/19/80/40/1062198040.db2.gz JYYSUCXOQANULG-VHSXEESVSA-N 0 1 302.643 4.333 20 0 DIADMN C[C@@H]1CC[C@@H](C)[N@@H+](CC(=O)N[C@H](c2cccs2)C(C)(C)C)C1 ZINC001459546178 1062199034 /nfs/dbraw/zinc/19/90/34/1062199034.db2.gz ZWDWMDXKCDLXOS-CKEIUWERSA-N 0 1 322.518 4.072 20 0 DIADMN C[C@@H]1CC[C@@H](C)N(CC(=O)N[C@H](c2cccs2)C(C)(C)C)C1 ZINC001459546178 1062199046 /nfs/dbraw/zinc/19/90/46/1062199046.db2.gz ZWDWMDXKCDLXOS-CKEIUWERSA-N 0 1 322.518 4.072 20 0 DIADMN Cc1cc(Cl)ccc1NC(=O)C[N@H+]1CCC2(C1)CCCCC2 ZINC001459547447 1062199543 /nfs/dbraw/zinc/19/95/43/1062199543.db2.gz FSBZSVBMFYIOBK-UHFFFAOYSA-N 0 1 320.864 4.243 20 0 DIADMN Cc1cc(Cl)ccc1NC(=O)CN1CCC2(C1)CCCCC2 ZINC001459547447 1062199549 /nfs/dbraw/zinc/19/95/49/1062199549.db2.gz FSBZSVBMFYIOBK-UHFFFAOYSA-N 0 1 320.864 4.243 20 0 DIADMN CCC(CC)[C@H](c1ccc(Cl)cc1)N(C)C(=O)[C@@H](C)N(C)C ZINC001467775074 1062207230 /nfs/dbraw/zinc/20/72/30/1062207230.db2.gz MTDCKWRZAGJMFN-CXAGYDPISA-N 0 1 324.896 4.226 20 0 DIADMN COc1nscc1CN1CCCC[C@@H]1c1cccc(C)c1C ZINC001459558193 1062209530 /nfs/dbraw/zinc/20/95/30/1062209530.db2.gz FJSXHWPHKSDQTK-QGZVFWFLSA-N 0 1 316.470 4.496 20 0 DIADMN Cc1cccc(Cl)c1NC(=O)[C@@H](C)N1CCCC(C)(C)CC1 ZINC001459561035 1062210977 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CC(C)Cc1ccc(CN2CC[C@H](C(F)(F)F)C[C@H]2C)cn1 ZINC001474538977 1062228574 /nfs/dbraw/zinc/22/85/74/1062228574.db2.gz ZYAAQIFQANIGHQ-HIFRSBDPSA-N 0 1 314.395 4.443 20 0 DIADMN CC(C)Cc1ccc(CN2CC[C@@H](C(F)(F)F)C[C@H]2C)cn1 ZINC001474538978 1062228949 /nfs/dbraw/zinc/22/89/49/1062228949.db2.gz ZYAAQIFQANIGHQ-UKRRQHHQSA-N 0 1 314.395 4.443 20 0 DIADMN Cc1[nH]nc(CN2CC[C@@H](C(F)(F)F)c3ccccc32)c1C ZINC001474540338 1062229247 /nfs/dbraw/zinc/22/92/47/1062229247.db2.gz FPPKGNRKSUJBMY-CYBMUJFWSA-N 0 1 309.335 4.083 20 0 DIADMN Oc1cc(-c2nnc([C@H]3C[C@H]3c3ccccc3)o2)ccc1Cl ZINC001254681492 1062230532 /nfs/dbraw/zinc/23/05/32/1062230532.db2.gz HAQZSIPBYIBEAA-STQMWFEESA-N 0 1 312.756 4.367 20 0 DIADMN CN(Cc1ccc(Cl)nc1)C[C@@H]1CC[C@H](c2ccccc2)O1 ZINC001459604601 1062236502 /nfs/dbraw/zinc/23/65/02/1062236502.db2.gz ARJWVGWHYPLIMA-DLBZAZTESA-N 0 1 316.832 4.087 20 0 DIADMN C[C@H]1C[C@@H](N(C)[C@H](CO)c2ccccc2)c2ccsc2S1 ZINC001474543571 1062237223 /nfs/dbraw/zinc/23/72/23/1062237223.db2.gz ZJKYQVNCULOVHW-APHBMKBZSA-N 0 1 319.495 4.339 20 0 DIADMN C[C@H]1C[C@@H](N(C)[C@@H](CO)c2ccccc2)c2ccsc2S1 ZINC001474543572 1062237654 /nfs/dbraw/zinc/23/76/54/1062237654.db2.gz ZJKYQVNCULOVHW-MAZHCROVSA-N 0 1 319.495 4.339 20 0 DIADMN CC[C@@H](NC(=O)c1cccc(C(F)(F)F)c1O)C1CCCC1 ZINC001468000902 1062243978 /nfs/dbraw/zinc/24/39/78/1062243978.db2.gz YMGKKQRTIWBRCZ-CYBMUJFWSA-N 0 1 315.335 4.110 20 0 DIADMN Cc1csc2nc(C)c(CNC(C)(C)c3ccccc3F)n12 ZINC001474548124 1062244598 /nfs/dbraw/zinc/24/45/98/1062244598.db2.gz UTELYSXMMPHEQW-UHFFFAOYSA-N 0 1 317.433 4.177 20 0 DIADMN CSc1ccc(OCCN2CC[C@@H]2c2cccc(F)c2)cc1 ZINC001459614694 1062245808 /nfs/dbraw/zinc/24/58/08/1062245808.db2.gz NGGAVDNJOOJKQO-GOSISDBHSA-N 0 1 317.429 4.373 20 0 DIADMN CC(C)[C@H]1N(Cc2ccc(OC(F)F)cc2F)CC1(C)C ZINC001474549590 1062246915 /nfs/dbraw/zinc/24/69/15/1062246915.db2.gz KWVBPOIGIALLJV-CQSZACIVSA-N 0 1 301.352 4.294 20 0 DIADMN C[C@@H]1CN(CCc2cccc(Cl)c2)Cc2ccccc2O1 ZINC001474553956 1062254370 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C[C@H](Cc1ccccc1Cl)NCc1nnc(C(C)(C)C)s1 ZINC001254997213 1062296322 /nfs/dbraw/zinc/29/63/22/1062296322.db2.gz OOKKYYXWGFGGMT-LLVKDONJSA-N 0 1 323.893 4.210 20 0 DIADMN CCOc1ccc(CN2C[C@H]3CCCC[C@@]32c2ccccc2)nc1 ZINC001459674370 1062296525 /nfs/dbraw/zinc/29/65/25/1062296525.db2.gz GXUGDORDWMWKRZ-WIYYLYMNSA-N 0 1 322.452 4.382 20 0 DIADMN CC(C)C1(c2ccccc2)CN(Cc2cccn2C(F)F)C1 ZINC001474585438 1062296850 /nfs/dbraw/zinc/29/68/50/1062296850.db2.gz SSJGDUHNMHBWQI-UHFFFAOYSA-N 0 1 304.384 4.293 20 0 DIADMN Cc1ccc2c(c1)CCN(Cc1cnc3c(F)cccc3c1)C2 ZINC001474588613 1062301293 /nfs/dbraw/zinc/30/12/93/1062301293.db2.gz MXWZUBPDAMXEHO-UHFFFAOYSA-N 0 1 306.384 4.241 20 0 DIADMN CCO[C@@H]1C[C@H](N[C@H]2C[C@@]2(F)c2ccccc2)C12CCCCC2 ZINC001474591423 1062304069 /nfs/dbraw/zinc/30/40/69/1062304069.db2.gz JFZUULHYZMOVEP-PNYFIKQUSA-N 0 1 317.448 4.341 20 0 DIADMN COC1(CN2CCc3sc(Cl)cc3C2)CCCCCC1 ZINC001474598707 1062311642 /nfs/dbraw/zinc/31/16/42/1062311642.db2.gz IFLFHUYOBIHXRT-UHFFFAOYSA-N 0 1 313.894 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1063565222 /nfs/dbraw/zinc/56/52/22/1063565222.db2.gz CXARZHRFGRBKOH-BBRMVZONSA-N 0 1 313.894 4.029 20 0 DIADMN CC1(C)CCC[C@@H](N2CCO[C@@H](c3ccc(F)c(F)c3)C2)C1 ZINC001258295364 1063591640 /nfs/dbraw/zinc/59/16/40/1063591640.db2.gz YVUSNMVDMLRISV-RHSMWYFYSA-N 0 1 309.400 4.307 20 0 DIADMN C[C@@]1(O)C[C@H](NCc2c(Cl)cccc2Oc2ccccc2)C1 ZINC001461587727 1063598533 /nfs/dbraw/zinc/59/85/33/1063598533.db2.gz JLSICGHOLLKCJR-QGGXVJLZSA-N 0 1 317.816 4.135 20 0 DIADMN Cc1cc(Br)c(CN[C@H]2CC23CC3)cc1Cl ZINC001461592711 1063601922 /nfs/dbraw/zinc/60/19/22/1063601922.db2.gz ICUCTMPEBKAWSH-LBPRGKRZSA-N 0 1 300.627 4.053 20 0 DIADMN CSC(C)(C)C[C@@H](C)NC1(c2cccc(Cl)c2)COC1 ZINC001258323318 1063610277 /nfs/dbraw/zinc/61/02/77/1063610277.db2.gz FZJJEWONHOCMGB-GFCCVEGCSA-N 0 1 313.894 4.075 20 0 DIADMN Cc1cc(CNCc2ccc(-c3cccs3)cc2)sn1 ZINC001461620431 1063618952 /nfs/dbraw/zinc/61/89/52/1063618952.db2.gz CWSUTXKSAGAONO-UHFFFAOYSA-N 0 1 300.452 4.470 20 0 DIADMN Clc1oc2ccccc2c1CNCc1cn2ccnc2s1 ZINC001461630368 1063624503 /nfs/dbraw/zinc/62/45/03/1063624503.db2.gz QUVWXUYSJXXLNY-UHFFFAOYSA-N 0 1 317.801 4.085 20 0 DIADMN CCCCC(CCCC)N1Cc2cn(C)nc2[C@H](COCC)C1 ZINC001258386380 1063629325 /nfs/dbraw/zinc/62/93/25/1063629325.db2.gz ZETOKUHIICVEAQ-KRWDZBQOSA-N 0 1 321.509 4.105 20 0 DIADMN Cc1ccc(CN[C@@H](c2ccccc2)[C@@H](O)C(C)C)c(Cl)c1 ZINC001461654614 1063638232 /nfs/dbraw/zinc/63/82/32/1063638232.db2.gz SUSPWILDFOEQON-OALUTQOASA-N 0 1 317.860 4.496 20 0 DIADMN Cn1c(Cl)ncc1CNCc1ccc(-c2ccccc2)s1 ZINC001461657635 1063640773 /nfs/dbraw/zinc/64/07/73/1063640773.db2.gz SIQPXYGERJTCRL-UHFFFAOYSA-N 0 1 317.845 4.092 20 0 DIADMN CC1(C)C[C@]1(NCc1cccc2c1OCCCO2)c1ccccc1 ZINC001461655935 1063640828 /nfs/dbraw/zinc/64/08/28/1063640828.db2.gz JWHCTQZCDRIOQM-NRFANRHFSA-N 0 1 323.436 4.263 20 0 DIADMN Cn1cc(CNCc2ccc(-c3ccccc3)s2)c(Cl)n1 ZINC001461657580 1063640974 /nfs/dbraw/zinc/64/09/74/1063640974.db2.gz RXLMKWLPXUGBAK-UHFFFAOYSA-N 0 1 317.845 4.092 20 0 DIADMN CN(c1ccccc1)c1ccc(CN[C@@H]2CCCC[C@@H]2F)cn1 ZINC001461674914 1063650962 /nfs/dbraw/zinc/65/09/62/1063650962.db2.gz BFJVSOCPSAKAJS-ZWKOTPCHSA-N 0 1 313.420 4.220 20 0 DIADMN Cc1ccc(F)c(CNCc2ccnc(-c3ccccc3)c2)c1 ZINC001461676305 1063651095 /nfs/dbraw/zinc/65/10/95/1063651095.db2.gz MGEVHWPILNTNDP-UHFFFAOYSA-N 0 1 306.384 4.486 20 0 DIADMN Cn1nc(-c2ccccc2)c(CN[C@@H]2CCCC[C@@H]2F)c1Cl ZINC001461678475 1063653563 /nfs/dbraw/zinc/65/35/63/1063653563.db2.gz SSHDTXRSPYQYHW-LSDHHAIUSA-N 0 1 321.827 4.111 20 0 DIADMN Cc1nn(C)c(CN[C@H]2C[C@@H](C(C)C)c3ccccc32)c1Cl ZINC001461686924 1063657681 /nfs/dbraw/zinc/65/76/81/1063657681.db2.gz ZCCUQWNOPKHSJV-HOTGVXAUSA-N 0 1 317.864 4.356 20 0 DIADMN CCCCC[C@H](CC)N1CCCn2cnc(COC(C)C)c2C1 ZINC001258445400 1063658505 /nfs/dbraw/zinc/65/85/05/1063658505.db2.gz HBACBNAIYLFKSV-KRWDZBQOSA-N 0 1 321.509 4.373 20 0 DIADMN CC(F)(F)c1c(F)cccc1NCc1[nH]nc2ccccc21 ZINC001461702091 1063668253 /nfs/dbraw/zinc/66/82/53/1063668253.db2.gz NROJIZTWECONGO-UHFFFAOYSA-N 0 1 305.303 4.426 20 0 DIADMN COc1ccc(C2CC2)cc1CNCc1ccc(CC(C)C)nc1 ZINC001461729805 1063681773 /nfs/dbraw/zinc/68/17/73/1063681773.db2.gz RORUKRGXZSGSRA-UHFFFAOYSA-N 0 1 324.468 4.456 20 0 DIADMN C[C@@H](COCC1CCCCC1)NCc1nc2cc(F)ccc2o1 ZINC001461777395 1063710500 /nfs/dbraw/zinc/71/05/00/1063710500.db2.gz IXKNVHHZKLVDFD-ZDUSSCGKSA-N 0 1 320.408 4.042 20 0 DIADMN CCOc1cc(CN[C@H](C)c2ccc(F)cc2)c(F)cc1OC ZINC001461800186 1063724930 /nfs/dbraw/zinc/72/49/30/1063724930.db2.gz WNYZODAHHXWUJP-GFCCVEGCSA-N 0 1 321.367 4.223 20 0 DIADMN Fc1cccc(CN[C@H](Cc2ccccc2)c2ccccn2)c1 ZINC001461806689 1063727305 /nfs/dbraw/zinc/72/73/05/1063727305.db2.gz LWEDOOQBQCLRQF-HXUWFJFHSA-N 0 1 306.384 4.294 20 0 DIADMN COc1cccc(CN[C@@H](Cc2ccccc2)c2ccccn2)c1 ZINC001461807821 1063728404 /nfs/dbraw/zinc/72/84/04/1063728404.db2.gz QMYKLWLOQXAVNO-NRFANRHFSA-N 0 1 318.420 4.164 20 0 DIADMN CCCCC[C@H](CCC)NCc1nn(C)cc1Br ZINC001258664380 1063732579 /nfs/dbraw/zinc/73/25/79/1063732579.db2.gz IWWGNCVRUUNCIL-LBPRGKRZSA-N 0 1 316.287 4.021 20 0 DIADMN CCCCC[C@@H](CCC)N1CC[C@@](O)(C(F)(F)F)[C@H](F)C1 ZINC001258667602 1063734485 /nfs/dbraw/zinc/73/44/85/1063734485.db2.gz PJQIJGRZHZVBMR-MCIONIFRSA-N 0 1 313.379 4.073 20 0 DIADMN COC1(CNCc2coc(-c3ccccc3)n2)CCCCCC1 ZINC001461820984 1063734972 /nfs/dbraw/zinc/73/49/72/1063734972.db2.gz VFTWYQPVUXAOQM-UHFFFAOYSA-N 0 1 314.429 4.171 20 0 DIADMN CCCCC[C@H](CCC)N1Cc2cn(C)nc2[C@H](COCC)C1 ZINC001258669866 1063738508 /nfs/dbraw/zinc/73/85/08/1063738508.db2.gz ULDKLQUEFOOXRE-ROUUACIJSA-N 0 1 321.509 4.105 20 0 DIADMN COc1ccc(SCCN2CC[C@@H]2c2cccc(F)c2)cc1 ZINC001461840710 1063744442 /nfs/dbraw/zinc/74/44/42/1063744442.db2.gz CMERTKXPRHQUSS-GOSISDBHSA-N 0 1 317.429 4.373 20 0 DIADMN CC(C)C1CCN(Cc2nnn(-c3ccccc3)c2C2CC2)CC1 ZINC001461855589 1063752710 /nfs/dbraw/zinc/75/27/10/1063752710.db2.gz YAINPTJTFBDQJE-UHFFFAOYSA-N 0 1 324.472 4.013 20 0 DIADMN Cc1ccc(CN(Cc2cccc3[nH]c(=O)oc32)C2CC2)cc1C ZINC001461862040 1063757743 /nfs/dbraw/zinc/75/77/43/1063757743.db2.gz RRKVCEMVHZRDGT-UHFFFAOYSA-N 0 1 322.408 4.315 20 0 DIADMN C[C@@H]1C[C@@H](N2Cc3cc(Br)cnc3C2)CC(C)(C)C1 ZINC001258700575 1063759026 /nfs/dbraw/zinc/75/90/26/1063759026.db2.gz MZPSRAACWCGOLX-BXUZGUMPSA-N 0 1 323.278 4.375 20 0 DIADMN CCc1nn(C)c(CC)c1CN(CC)Cc1ccc(Cl)cc1 ZINC001461864692 1063760947 /nfs/dbraw/zinc/76/09/47/1063760947.db2.gz GXRDAOKOIPEZLO-UHFFFAOYSA-N 0 1 319.880 4.220 20 0 DIADMN CCCC[C@H](Cc1ccccc1)NCc1ncc(Cl)cn1 ZINC001258706199 1063763450 /nfs/dbraw/zinc/76/34/50/1063763450.db2.gz ONTNEEXZXTWUQG-MRXNPFEDSA-N 0 1 303.837 4.021 20 0 DIADMN COC1CC(CN2CCc3cc(Cl)cc(Cl)c3[C@@H]2C)C1 ZINC001461876223 1063765656 /nfs/dbraw/zinc/76/56/56/1063765656.db2.gz PTECUWQBJCOYCR-IFQILLTASA-N 0 1 314.256 4.338 20 0 DIADMN CO[C@@]1(C)C[C@H](N(C)Cc2nc3ccc(F)cc3s2)C1(C)C ZINC001461880520 1063768511 /nfs/dbraw/zinc/76/85/11/1063768511.db2.gz JLNVQJIENOGVIT-YOEHRIQHSA-N 0 1 322.449 4.071 20 0 DIADMN COCc1csc(CN2CC[C@@H](C)C[C@@H]2c2ccco2)c1 ZINC001461877282 1063768654 /nfs/dbraw/zinc/76/86/54/1063768654.db2.gz ZPBGDDNLGJBJGJ-CZUORRHYSA-N 0 1 305.443 4.461 20 0 DIADMN Cc1nn(C)cc1[C@H]1CCCN1Cc1cc(C(C)(C)C)oc1C ZINC001461883578 1063772481 /nfs/dbraw/zinc/77/24/81/1063772481.db2.gz KJVQASQQXSAGKF-QGZVFWFLSA-N 0 1 315.461 4.265 20 0 DIADMN Cc1ccc(-c2nnc(-c3ccc(O)c(Cl)c3)o2)cc1F ZINC001258719531 1063775449 /nfs/dbraw/zinc/77/54/49/1063775449.db2.gz ZGNDWXTVEDYHMT-UHFFFAOYSA-N 0 1 304.708 4.210 20 0 DIADMN COCCN(Cc1cccn1C(F)F)Cc1ccc(C)cc1C ZINC001461893342 1063780281 /nfs/dbraw/zinc/78/02/81/1063780281.db2.gz ZZHZPZQKFWEBBJ-UHFFFAOYSA-N 0 1 322.399 4.149 20 0 DIADMN CCN(Cc1ccc(C)c(OC)n1)[C@@H](C)c1ccc(F)cc1 ZINC001461895289 1063783631 /nfs/dbraw/zinc/78/36/31/1063783631.db2.gz FSQNFYFOHSOOEA-AWEZNQCLSA-N 0 1 302.393 4.121 20 0 DIADMN Cc1[nH]nc2cc(-c3nnc(-c4ccc(C)c(F)c4)o3)ccc12 ZINC001258737324 1063786396 /nfs/dbraw/zinc/78/63/96/1063786396.db2.gz LZAKNIUEOUFZLD-UHFFFAOYSA-N 0 1 308.316 4.036 20 0 DIADMN C[C@H]1CC[C@@H](C(=O)Nc2nc3cc(Cl)cc(Cl)c3[nH]2)C1 ZINC001461909125 1063791137 /nfs/dbraw/zinc/79/11/37/1063791137.db2.gz PRGOMHJDKBCOTH-JGVFFNPUSA-N 0 1 312.200 4.244 20 0 DIADMN C[C@H](Cc1cccc(Cl)c1)NCC(=O)c1cc(F)ccc1F ZINC001258741994 1063791566 /nfs/dbraw/zinc/79/15/66/1063791566.db2.gz RCUWVFWPTJWPNS-LLVKDONJSA-N 0 1 323.770 4.022 20 0 DIADMN CCCCN(Cc1n[nH]c(C)c1C)Cc1ccccc1Cl ZINC001461912372 1063793234 /nfs/dbraw/zinc/79/32/34/1063793234.db2.gz RKGHLVMJJRVBGF-UHFFFAOYSA-N 0 1 305.853 4.482 20 0 DIADMN CCC[C@@H]1CCCN(Cc2nnn(-c3ccccc3)c2C2CC2)C1 ZINC001461915535 1063797227 /nfs/dbraw/zinc/79/72/27/1063797227.db2.gz UWGSQFBICKRFSG-MRXNPFEDSA-N 0 1 324.472 4.157 20 0 DIADMN C[C@H](Cc1cccc(Cl)c1)N1CCc2ncc(Cl)cc2C1 ZINC001258751370 1063797974 /nfs/dbraw/zinc/79/79/74/1063797974.db2.gz MHCIQDYLSIWBPZ-GFCCVEGCSA-N 0 1 321.251 4.378 20 0 DIADMN CC[C@H](Cc1ccccc1)[N@@H+](C)Cc1ccc([O-])c(F)c1F ZINC001461923652 1063807204 /nfs/dbraw/zinc/80/72/04/1063807204.db2.gz VIFKAJYBRQOFHK-OAHLLOKOSA-N 0 1 305.368 4.124 20 0 DIADMN CCN(Cc1ccc(OC)c(OC)c1)Cc1cccc(C)c1F ZINC001461925022 1063808662 /nfs/dbraw/zinc/80/86/62/1063808662.db2.gz CVWLBJCPXAOIRT-UHFFFAOYSA-N 0 1 317.404 4.173 20 0 DIADMN CC(C)Oc1cccc(CN(C)Cc2nccc3c2CCCC3)c1 ZINC001461925421 1063809267 /nfs/dbraw/zinc/80/92/67/1063809267.db2.gz HBIOBZPDPXEWDH-UHFFFAOYSA-N 0 1 324.468 4.380 20 0 DIADMN CCCC[C@@H](CCC)N1CCCn2cnc(COC(C)C)c2C1 ZINC001258763220 1063809345 /nfs/dbraw/zinc/80/93/45/1063809345.db2.gz LGHHKNTYSSFLCV-QGZVFWFLSA-N 0 1 321.509 4.373 20 0 DIADMN Cc1ccccc1[C@@H]1C[C@H](C)N(Cc2cc(C(F)(F)F)n[nH]2)C1 ZINC001461932805 1063816171 /nfs/dbraw/zinc/81/61/71/1063816171.db2.gz DTQIAHMAILOUPB-QWHCGFSZSA-N 0 1 323.362 4.115 20 0 DIADMN CN(Cc1cccn1C1CC1)Cc1cccc(OC(F)(F)F)c1 ZINC001461930468 1063817747 /nfs/dbraw/zinc/81/77/47/1063817747.db2.gz WSCKQNSQFLIOBD-UHFFFAOYSA-N 0 1 324.346 4.354 20 0 DIADMN C[C@@H]1c2ccccc2OCCN1Cc1ccc(OCC2CC2)cc1 ZINC001461934373 1063820042 /nfs/dbraw/zinc/82/00/42/1063820042.db2.gz JGNIJKDJRWUFKA-MRXNPFEDSA-N 0 1 323.436 4.431 20 0 DIADMN CCOC[C@@H]1CN([C@H](CC)C[C@H](C)CC)Cc2cnn(CC)c21 ZINC001258792373 1063827753 /nfs/dbraw/zinc/82/77/53/1063827753.db2.gz WCBFKAJMOQCETN-BPQIPLTHSA-N 0 1 321.509 4.054 20 0 DIADMN Cc1ccccc1[C@@H]1C[C@H](C)N(Cc2nc(Cl)cs2)C1 ZINC001461944961 1063830944 /nfs/dbraw/zinc/83/09/44/1063830944.db2.gz XQOXOVVLTXWCIJ-QWHCGFSZSA-N 0 1 306.862 4.483 20 0 DIADMN CC[C@@H](C)N(CCc1ccccc1F)Cc1cnn(C)c1Cl ZINC001461960447 1063840961 /nfs/dbraw/zinc/84/09/61/1063840961.db2.gz NHVHMEZHFWDWCF-CYBMUJFWSA-N 0 1 323.843 4.056 20 0 DIADMN CCCOc1ccc(CN2CCC[C@@H]2c2cc(C)no2)cc1C ZINC001461969510 1063848431 /nfs/dbraw/zinc/84/84/31/1063848431.db2.gz AXKBKKQVMDHZRO-QGZVFWFLSA-N 0 1 314.429 4.417 20 0 DIADMN CCC[C@@H](C)N(C)Cc1nc(-c2cccc(OC)c2)cs1 ZINC001461977415 1063854603 /nfs/dbraw/zinc/85/46/03/1063854603.db2.gz LVFHLSVQZFFERX-CYBMUJFWSA-N 0 1 304.459 4.439 20 0 DIADMN CCNc1ccccc1CN(C)[C@H](C)c1sc(C)nc1C ZINC001461974022 1063854791 /nfs/dbraw/zinc/85/47/91/1063854791.db2.gz 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DIADMN OCC[C@@H](N[C@@H](CC1CC1)c1ccc(Cl)cc1)c1ccco1 ZINC000345276980 335318401 /nfs/dbraw/zinc/31/84/01/335318401.db2.gz RRPOLSWSYGMHCL-SJORKVTESA-N 0 1 319.832 4.488 20 0 DIADMN Fc1ccc(CN[C@@H]2CCCOc3c(Cl)cccc32)cc1 ZINC000345717278 335345444 /nfs/dbraw/zinc/34/54/44/335345444.db2.gz YIHGBAMGBSECJB-MRXNPFEDSA-N 0 1 305.780 4.483 20 0 DIADMN Cc1cccc2nc(C3CCN(CCC(F)(F)F)CC3)oc21 ZINC000444668680 338480621 /nfs/dbraw/zinc/48/06/21/338480621.db2.gz CVOJYMDDHFBZFK-UHFFFAOYSA-N 0 1 312.335 4.268 20 0 DIADMN FC(F)(F)c1cccc([C@@H]2CCCCN2CCn2ccnc2)c1 ZINC000346196889 335389354 /nfs/dbraw/zinc/38/93/54/335389354.db2.gz PGZJYKBPXSKVIL-INIZCTEOSA-N 0 1 323.362 4.129 20 0 DIADMN Cc1cc(N2CCC[C@@H]2C2CCOCC2)c2cc(F)ccc2n1 ZINC000346268730 335396333 /nfs/dbraw/zinc/39/63/33/335396333.db2.gz UJJMBSFFBWQHQN-GOSISDBHSA-N 0 1 314.404 4.078 20 0 DIADMN Fc1ccc2c(c1)OCCC[C@H]2NCc1ccc2ccccc2n1 ZINC000346663406 335427667 /nfs/dbraw/zinc/42/76/67/335427667.db2.gz FWDOLMNUOXLZKM-LJQANCHMSA-N 0 1 322.383 4.377 20 0 DIADMN CCc1nc2c(s1)[C@@H](NCc1ccc3ccccc3n1)CCC2 ZINC000346784031 335440641 /nfs/dbraw/zinc/44/06/41/335440641.db2.gz WFOLBPNFQVRBKB-INIZCTEOSA-N 0 1 323.465 4.421 20 0 DIADMN CCC[C@H](NCc1ccc(N2CCCCC2)nc1)c1ccccn1 ZINC000346977378 335460831 /nfs/dbraw/zinc/46/08/31/335460831.db2.gz CHUVHXGZIJUXBA-SFHVURJKSA-N 0 1 324.472 4.098 20 0 DIADMN COc1cc(CN[C@H](CC(F)(F)F)c2ccccc2C)ccn1 ZINC000444775796 338488003 /nfs/dbraw/zinc/48/80/03/338488003.db2.gz ANXSXUSECLXKLB-OAHLLOKOSA-N 0 1 324.346 4.182 20 0 DIADMN Cc1ccnc(CN[C@H](C)[C@H](C)c2ccccc2C(F)(F)F)n1 ZINC000348282302 335571028 /nfs/dbraw/zinc/57/10/28/335571028.db2.gz PPPXIFOCMYBYPT-QWHCGFSZSA-N 0 1 323.362 4.086 20 0 DIADMN Cc1cc(C(F)(F)F)ccc1CNCc1ccc(Cl)cn1 ZINC000191069774 335581394 /nfs/dbraw/zinc/58/13/94/335581394.db2.gz YSQFSUXLNWNEHF-UHFFFAOYSA-N 0 1 314.738 4.352 20 0 DIADMN CCCOc1cccc(CN[C@H]2CCOc3c(F)cccc32)c1 ZINC000191126626 335605232 /nfs/dbraw/zinc/60/52/32/335605232.db2.gz XWKRKTJMGCYDMF-SFHVURJKSA-N 0 1 315.388 4.228 20 0 DIADMN Cc1cccn2c(CN[C@H](C)c3cc4ccccc4o3)cnc12 ZINC000191130515 335607568 /nfs/dbraw/zinc/60/75/68/335607568.db2.gz CYLLRKQEDCESPC-CQSZACIVSA-N 0 1 305.381 4.240 20 0 DIADMN C[C@@H](N[C@H]1C[C@@H](C)C[C@H](c2ccccc2)C1)c1csnn1 ZINC000398394327 335648398 /nfs/dbraw/zinc/64/83/98/335648398.db2.gz SFXLTLHGMDDPCA-XRGAULLZSA-N 0 1 301.459 4.161 20 0 DIADMN COc1ccsc1[C@@H](C)N[C@H]1CCCOc2ccc(F)cc21 ZINC000349308803 335661904 /nfs/dbraw/zinc/66/19/04/335661904.db2.gz BAMGOWXSFMQFBX-RISCZKNCSA-N 0 1 321.417 4.460 20 0 DIADMN CCC[C@H](NCc1ccnc(OC2CCC2)c1)c1cccnc1 ZINC000349803789 335701943 /nfs/dbraw/zinc/70/19/43/335701943.db2.gz SOCQVDBMBSFCDT-SFHVURJKSA-N 0 1 311.429 4.039 20 0 DIADMN C[C@@H](N[C@@H](C)c1ccon1)[C@@H](C)c1nc2ccccc2s1 ZINC000349830405 335704416 /nfs/dbraw/zinc/70/44/16/335704416.db2.gz FYZPDPOYWJTWDN-UTUOFQBUSA-N 0 1 301.415 4.127 20 0 DIADMN Clc1ccc2c(c1)[C@@H](NCc1cn3ccsc3n1)CCC2 ZINC000535685389 335729223 /nfs/dbraw/zinc/72/92/23/335729223.db2.gz IJCYYBJKEPMCCL-HNNXBMFYSA-N 0 1 317.845 4.216 20 0 DIADMN CCc1ccc(CN[C@@H](C)c2ccc(Br)cc2)o1 ZINC000051724859 335764374 /nfs/dbraw/zinc/76/43/74/335764374.db2.gz DIMFQLSCQDWVNN-NSHDSACASA-N 0 1 308.219 4.455 20 0 DIADMN C[C@@H](N[C@H](COc1ccccc1F)C(C)(C)C)c1cscn1 ZINC000535777135 335764928 /nfs/dbraw/zinc/76/49/28/335764928.db2.gz MPGNCVORBCUITR-MLGOLLRUSA-N 0 1 322.449 4.427 20 0 DIADMN C[C@H](c1ccc(F)c(F)c1)N1CCC(c2ccncc2)CC1 ZINC000191617215 335776058 /nfs/dbraw/zinc/77/60/58/335776058.db2.gz RMEFRPFFMSMFOV-CYBMUJFWSA-N 0 1 302.368 4.300 20 0 DIADMN Cc1ccc([C@H]2CCCN2C(=O)c2ccc(O)c(Cl)c2)s1 ZINC000114801111 335824325 /nfs/dbraw/zinc/82/43/25/335824325.db2.gz PAWKVHBUGVYLPM-CYBMUJFWSA-N 0 1 321.829 4.393 20 0 DIADMN Nc1ccc2c(c1)CC[C@@H]2NCc1cc(Cl)ccc1Cl ZINC000519642504 335884438 /nfs/dbraw/zinc/88/44/38/335884438.db2.gz CTWJLIWMEIWHAJ-INIZCTEOSA-N 0 1 307.224 4.353 20 0 DIADMN C[C@@H]1Oc2ccccc2[C@@H]1NCc1cccc(OC(F)(F)F)c1 ZINC000519779443 335894248 /nfs/dbraw/zinc/89/42/48/335894248.db2.gz NTDVDBBDNCWORN-MEDUHNTESA-N 0 1 323.314 4.197 20 0 DIADMN CC(C)(C)[C@@H]1C[C@@H](NCc2c(F)cc(F)c(F)c2F)CS1 ZINC000430771924 335896504 /nfs/dbraw/zinc/89/65/04/335896504.db2.gz HSFHRNDWDGGTCM-PELKAZGASA-N 0 1 321.383 4.253 20 0 DIADMN CCC(=O)Nc1cccc(CN[C@H](C)c2ccccc2F)c1 ZINC000532194219 335913727 /nfs/dbraw/zinc/91/37/27/335913727.db2.gz NVQOKFFOSAYOHT-CYBMUJFWSA-N 0 1 300.377 4.025 20 0 DIADMN Cc1ccn2cc(CN[C@@H]3CCc4c3cccc4Cl)nc2c1 ZINC000532215191 335919629 /nfs/dbraw/zinc/91/96/29/335919629.db2.gz YNBSZANBDGDYSP-QGZVFWFLSA-N 0 1 311.816 4.073 20 0 DIADMN Cc1ccc2oc(-c3noc(CN4[C@@H](C)CC[C@@H]4C)n3)cc2c1 ZINC000445753537 338507366 /nfs/dbraw/zinc/50/73/66/338507366.db2.gz ZLJBQVLRDDNFDF-STQMWFEESA-N 0 1 311.385 4.164 20 0 DIADMN COc1ccccc1[C@H]1CCCN1Cc1c(C)nsc1C ZINC000583639114 336006808 /nfs/dbraw/zinc/00/68/08/336006808.db2.gz WIYUCFCLQCRUFE-MRXNPFEDSA-N 0 1 302.443 4.106 20 0 DIADMN CCc1noc(C)c1CN[C@@H](C)[C@@H](OC)c1ccccc1Cl ZINC000351204125 336022397 /nfs/dbraw/zinc/02/23/97/336022397.db2.gz PBXCKSYUWJLBPZ-APPDUMDISA-N 0 1 322.836 4.065 20 0 DIADMN CC(C)Oc1ccc(N(C)C(=O)c2ccc(O)c(Cl)c2)cc1 ZINC000192264063 336024161 /nfs/dbraw/zinc/02/41/61/336024161.db2.gz DMRHONXYEOOCAR-UHFFFAOYSA-N 0 1 319.788 4.109 20 0 DIADMN CCCCc1nc2ccc(NC(=O)c3ccoc3Cl)cc2[nH]1 ZINC000192291490 336027407 /nfs/dbraw/zinc/02/74/07/336027407.db2.gz LTWJGOPMIAVLFQ-UHFFFAOYSA-N 0 1 317.776 4.404 20 0 DIADMN CCn1cncc1CNC1(c2ccc(F)cc2F)CCCCC1 ZINC000417954702 336031137 /nfs/dbraw/zinc/03/11/37/336031137.db2.gz CBWSTZASQRJKGD-UHFFFAOYSA-N 0 1 319.399 4.130 20 0 DIADMN CC[C@@H](NCc1nc2ccc(C)cc2[nH]1)c1ccc(F)cc1F ZINC000351390047 336031959 /nfs/dbraw/zinc/03/19/59/336031959.db2.gz UTXPPKKMDPSVPK-OAHLLOKOSA-N 0 1 315.367 4.390 20 0 DIADMN Cc1nnc(CN(C2CC2)[C@H]2CCCC[C@H]2C2CCCCC2)o1 ZINC000351514616 336039586 /nfs/dbraw/zinc/03/95/86/336039586.db2.gz PPZQDXVIVSZPRI-ROUUACIJSA-N 0 1 317.477 4.482 20 0 DIADMN Cc1nc2ccc(NC(=O)C3(c4ccccc4C)CCC3)cc2[nH]1 ZINC000351539529 336041651 /nfs/dbraw/zinc/04/16/51/336041651.db2.gz AKUGZSOOYSOGST-UHFFFAOYSA-N 0 1 319.408 4.240 20 0 DIADMN CC(C)Cn1ccnc1NCc1cnc(-c2ccsc2)s1 ZINC000351547550 336042452 /nfs/dbraw/zinc/04/24/52/336042452.db2.gz YHTCNYJZNYCOCQ-UHFFFAOYSA-N 0 1 318.471 4.336 20 0 DIADMN CC(C)Cn1ccnc1NCc1cccc(-c2ccccn2)c1 ZINC000351549526 336042622 /nfs/dbraw/zinc/04/26/22/336042622.db2.gz BSYRLLFUKXXGAA-UHFFFAOYSA-N 0 1 306.413 4.213 20 0 DIADMN FC(F)Cn1cc(CN(Cc2ccoc2)C2CCCCC2)cn1 ZINC000351639034 336054057 /nfs/dbraw/zinc/05/40/57/336054057.db2.gz AEEMAZORQHBMNR-UHFFFAOYSA-N 0 1 323.387 4.076 20 0 DIADMN Cc1ccc(-c2csc(CN3CCCSCC3)n2)cc1 ZINC000351734166 336063515 /nfs/dbraw/zinc/06/35/15/336063515.db2.gz HHEAWXYEUYCCEY-UHFFFAOYSA-N 0 1 304.484 4.057 20 0 DIADMN Cc1ncc(CN2CCCCC[C@H]2/C=C\c2cccs2)cn1 ZINC000351755277 336065330 /nfs/dbraw/zinc/06/53/30/336065330.db2.gz HTGQCGSSEPQBOB-JJEJIETFSA-N 0 1 313.470 4.305 20 0 DIADMN Cc1cccc(-c2c[nH]c([C@@H]3CCCN3CC[C@@H](C)F)n2)c1 ZINC000351857152 336073842 /nfs/dbraw/zinc/07/38/42/336073842.db2.gz IJKRNKBYBZDHPM-PBHICJAKSA-N 0 1 301.409 4.270 20 0 DIADMN C[C@@H]1CCN(Cc2cnccn2)[C@@H]1c1ccc(C(F)(F)F)cc1 ZINC000520750570 336079653 /nfs/dbraw/zinc/07/96/53/336079653.db2.gz ZLEXDIUTDQMZSM-WBMJQRKESA-N 0 1 321.346 4.079 20 0 DIADMN C[C@H]1CCN(Cc2cnccn2)[C@H]1c1ccc(C(F)(F)F)cc1 ZINC000520750567 336079820 /nfs/dbraw/zinc/07/98/20/336079820.db2.gz ZLEXDIUTDQMZSM-BLLLJJGKSA-N 0 1 321.346 4.079 20 0 DIADMN c1ccc([C@@H]2C[C@H]2CNC2(c3noc(C4CC4)n3)CCCC2)cc1 ZINC000329812645 336084938 /nfs/dbraw/zinc/08/49/38/336084938.db2.gz NEWJUWIAFSSTQL-IRXDYDNUSA-N 0 1 323.440 4.110 20 0 DIADMN C[C@@H](N[C@@H]1COCc2ccccc21)c1ccc2c(c1)CCCC2 ZINC000324112665 336089365 /nfs/dbraw/zinc/08/93/65/336089365.db2.gz RAMBUQUXEYHUJO-QVKFZJNVSA-N 0 1 307.437 4.488 20 0 DIADMN CC(C)[C@H](CC(F)(F)F)NCc1csc(-c2ccoc2)n1 ZINC000445881340 338514220 /nfs/dbraw/zinc/51/42/20/338514220.db2.gz SFNCFRLQVQDOTJ-LBPRGKRZSA-N 0 1 318.364 4.470 20 0 DIADMN CC(C)c1nc(CNC2(c3cccc(Cl)c3)CCCC2)n[nH]1 ZINC000330301004 336145782 /nfs/dbraw/zinc/14/57/82/336145782.db2.gz IUHUKRILDBTAEY-UHFFFAOYSA-N 0 1 318.852 4.141 20 0 DIADMN C[C@@H]1[C@H](C)CN(C(=O)Nc2ccc3nc(C(F)F)[nH]c3c2)[C@H]1C ZINC000332259487 336165400 /nfs/dbraw/zinc/16/54/00/336165400.db2.gz UUAJAAQJENFBTL-BBBLOLIVSA-N 0 1 322.359 4.009 20 0 DIADMN Oc1ccc2c(c1)CN(Cc1cccc(-c3cccnc3)c1)CC2 ZINC000351960000 336183329 /nfs/dbraw/zinc/18/33/29/336183329.db2.gz RLDOMIPBADVDNQ-UHFFFAOYSA-N 0 1 316.404 4.013 20 0 DIADMN CC1CCC(OC2CCN(Cc3cc(O)cc(F)c3)CC2)CC1 ZINC000352002704 336187802 /nfs/dbraw/zinc/18/78/02/336187802.db2.gz MSGAYRMYHIRIDD-UHFFFAOYSA-N 0 1 321.436 4.091 20 0 DIADMN CC1(C)CC[C@@H](N[C@H](CO)c2ccsc2)c2ccccc21 ZINC000352033663 336190661 /nfs/dbraw/zinc/19/06/61/336190661.db2.gz VLFWJAZLLYXOEY-IAGOWNOFSA-N 0 1 301.455 4.184 20 0 DIADMN CC[C@H](C)CCC(=O)Nc1cccc(CN2CCSCC2)c1 ZINC000352097980 336194675 /nfs/dbraw/zinc/19/46/75/336194675.db2.gz YDIAIQCMPAFKOZ-HNNXBMFYSA-N 0 1 320.502 4.000 20 0 DIADMN CC[C@@H](C)CCC(=O)Nc1cccc(CN2CCSCC2)c1 ZINC000352097981 336194800 /nfs/dbraw/zinc/19/48/00/336194800.db2.gz YDIAIQCMPAFKOZ-OAHLLOKOSA-N 0 1 320.502 4.000 20 0 DIADMN CCc1nnc([C@H](C)N2CCC[C@@](C)(c3ccccc3)CC2)o1 ZINC000352200551 336201708 /nfs/dbraw/zinc/20/17/08/336201708.db2.gz ATQMEVMCPBGDJE-HNAYVOBHSA-N 0 1 313.445 4.137 20 0 DIADMN COc1ccccc1[C@H]1CC[C@@H](C)CN1Cc1c(C)noc1C ZINC000352241151 336206000 /nfs/dbraw/zinc/20/60/00/336206000.db2.gz LAOUUCRXVAMPAI-FZKQIMNGSA-N 0 1 314.429 4.273 20 0 DIADMN Clc1ccc(CN2CCC[C@@H](c3ncc[nH]3)C2)cc1Cl ZINC000352345175 336213470 /nfs/dbraw/zinc/21/34/70/336213470.db2.gz JVZFZIDTHLTGRW-GFCCVEGCSA-N 0 1 310.228 4.096 20 0 DIADMN CO[C@@]1(C)CCCN(Cc2nc(-c3ccc(C)cc3)cs2)C1 ZINC000352412813 336216898 /nfs/dbraw/zinc/21/68/98/336216898.db2.gz JERAKPQLVGPDHI-SFHVURJKSA-N 0 1 316.470 4.119 20 0 DIADMN COc1cc(CN2CCC=C(c3ccco3)C2)ccc1SC ZINC000352571309 336225209 /nfs/dbraw/zinc/22/52/09/336225209.db2.gz SXAAMBIJWFTIIS-UHFFFAOYSA-N 0 1 315.438 4.299 20 0 DIADMN O=C(C[C@@H]1CCCc2ccccc21)Nc1ccc2nc[nH]c2c1 ZINC000352629288 336227775 /nfs/dbraw/zinc/22/77/75/336227775.db2.gz GRIIGLADJXXPOT-AWEZNQCLSA-N 0 1 305.381 4.012 20 0 DIADMN CC[C@@H](N[C@H](c1ccccc1)c1ccncc1)c1ccncc1 ZINC000352782059 336236337 /nfs/dbraw/zinc/23/63/37/336236337.db2.gz FKMHXRRSRACALZ-WOJBJXKFSA-N 0 1 303.409 4.307 20 0 DIADMN COc1cc(F)cc(CNCc2cscc2C(F)(F)F)c1 ZINC000352797688 336237774 /nfs/dbraw/zinc/23/77/74/336237774.db2.gz MVHDMMXZOGQEOY-UHFFFAOYSA-N 0 1 319.323 4.204 20 0 DIADMN C[C@H]1C[C@@H]1c1ccc(CNCc2ccc(Br)cc2)o1 ZINC000042352261 336239643 /nfs/dbraw/zinc/23/96/43/336239643.db2.gz ZHGSMZJUVXWYHB-NHYWBVRUSA-N 0 1 320.230 4.455 20 0 DIADMN CCC(=O)Nc1cccc(CN[C@H](C)c2cc(F)cc(F)c2)c1 ZINC000532446424 336247788 /nfs/dbraw/zinc/24/77/88/336247788.db2.gz ZKLBYHYOEPNBRX-GFCCVEGCSA-N 0 1 318.367 4.164 20 0 DIADMN CN(CCC(C)(C)C)CC(=O)Nc1c(Cl)cccc1Cl ZINC000532469600 336249442 /nfs/dbraw/zinc/24/94/42/336249442.db2.gz OUDJMGDWEXSPBP-UHFFFAOYSA-N 0 1 317.260 4.300 20 0 DIADMN CC[N@@H+](Cc1ccc(C)cc1)Cc1cnc(-c2ccccc2)nc1 ZINC000532491167 336250251 /nfs/dbraw/zinc/25/02/51/336250251.db2.gz RRLRQFNHXJMEJN-UHFFFAOYSA-N 0 1 317.436 4.474 20 0 DIADMN CCN(Cc1ccc(C)cc1)Cc1cnc(-c2ccccc2)nc1 ZINC000532491167 336250252 /nfs/dbraw/zinc/25/02/52/336250252.db2.gz RRLRQFNHXJMEJN-UHFFFAOYSA-N 0 1 317.436 4.474 20 0 DIADMN C[C@@H](N(C)Cc1nc(-c2ccc(Cl)cc2)no1)C(C)(C)C ZINC000532489572 336250368 /nfs/dbraw/zinc/25/03/68/336250368.db2.gz DLBKDBKHOPHTMX-LLVKDONJSA-N 0 1 307.825 4.256 20 0 DIADMN CCSc1ccccc1[C@@H](C)NCc1c(C)nn(CC)c1C ZINC000532497005 336250977 /nfs/dbraw/zinc/25/09/77/336250977.db2.gz OAKMFKVSXJPMJQ-CYBMUJFWSA-N 0 1 317.502 4.483 20 0 DIADMN CCn1nc(C)c(CN[C@H](C)c2ccc(SC)c(F)c2)c1C ZINC000532497063 336251006 /nfs/dbraw/zinc/25/10/06/336251006.db2.gz QVTPBJSOSNENFF-LLVKDONJSA-N 0 1 321.465 4.232 20 0 DIADMN CCn1nc(C)c(CN[C@@H](C)c2ccc(F)c(Cl)c2)c1C ZINC000532497844 336251046 /nfs/dbraw/zinc/25/10/46/336251046.db2.gz YMEXJFDSMDHIJB-JTQLQIEISA-N 0 1 309.816 4.163 20 0 DIADMN CCc1cc(CN[C@@H](CC)c2cccc(Br)c2)on1 ZINC000532516868 336253359 /nfs/dbraw/zinc/25/33/59/336253359.db2.gz HQYBNOOGUKCKDI-HNNXBMFYSA-N 0 1 323.234 4.240 20 0 DIADMN CC[C@H](N[C@@H](CO)c1ccccc1C)c1cc(F)ccc1F ZINC000532548878 336254971 /nfs/dbraw/zinc/25/49/71/336254971.db2.gz AMJRJSDXGXXMFK-ROUUACIJSA-N 0 1 305.368 4.048 20 0 DIADMN CC[C@H](N[C@H](CO)c1ccccc1C)c1cc(F)ccc1F ZINC000532548879 336255040 /nfs/dbraw/zinc/25/50/40/336255040.db2.gz AMJRJSDXGXXMFK-ZWKOTPCHSA-N 0 1 305.368 4.048 20 0 DIADMN CCc1ccc(CN[C@@H](CC)c2ccccc2OC(F)F)cn1 ZINC000352819533 336255052 /nfs/dbraw/zinc/25/50/52/336255052.db2.gz PNFDNKLSLDEUNO-INIZCTEOSA-N 0 1 320.383 4.486 20 0 DIADMN CC[C@](C)(NCCSCc1ccccc1)c1nccs1 ZINC000192680410 336258677 /nfs/dbraw/zinc/25/86/77/336258677.db2.gz GPHUJFGFJDLKRG-INIZCTEOSA-N 0 1 306.500 4.291 20 0 DIADMN C[C@H](NCc1ccc(Oc2ccccc2)cc1)c1ccnn1C ZINC000192796622 336262303 /nfs/dbraw/zinc/26/23/03/336262303.db2.gz MRYAJTIRTGTKKY-HNNXBMFYSA-N 0 1 307.397 4.063 20 0 DIADMN Cc1nc(C2(NC[C@@H](C)c3ccccc3)CCCCCC2)no1 ZINC000532663330 336266370 /nfs/dbraw/zinc/26/63/70/336266370.db2.gz WVYYEFDVYHBVRB-OAHLLOKOSA-N 0 1 313.445 4.321 20 0 DIADMN C[C@@H](c1c(F)cccc1F)N1CC[C@@H](Nc2ccccc2)C1 ZINC000532681863 336266475 /nfs/dbraw/zinc/26/64/75/336266475.db2.gz QNMDLLBWRZDOFX-DZGCQCFKSA-N 0 1 302.368 4.212 20 0 DIADMN C[C@H](c1ccccc1)N(CC[S@@](=O)c1ccccc1)C1CC1 ZINC000352833271 336270378 /nfs/dbraw/zinc/27/03/78/336270378.db2.gz QSYLFYURLHMOBU-OPAMFIHVSA-N 0 1 313.466 4.020 20 0 DIADMN Cc1c[nH]nc1CN[C@@H](C)c1ccc(-c2csc(C)n2)cc1 ZINC000352842605 336275479 /nfs/dbraw/zinc/27/54/79/336275479.db2.gz WIBWZGRAQMHLQV-LBPRGKRZSA-N 0 1 312.442 4.001 20 0 DIADMN Fc1ccccc1Oc1ccc(CNCC2(F)CC2)cc1F ZINC000526988735 336278610 /nfs/dbraw/zinc/27/86/10/336278610.db2.gz JUYRPGYNQHARJR-UHFFFAOYSA-N 0 1 307.315 4.349 20 0 DIADMN 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DIADMN CC(C)[C@@H](CC(F)(F)F)NCc1nc2c(s1)C[C@@H](C)CC2 ZINC000438469000 338344822 /nfs/dbraw/zinc/34/48/22/338344822.db2.gz FKPVKSAUMZPDHT-CMPLNLGQSA-N 0 1 320.424 4.335 20 0 DIADMN CC[C@H]1CC[N@H+]([C@H](C)C(=O)Nc2ccccc2-c2ccccc2)C1 ZINC000438476110 338345179 /nfs/dbraw/zinc/34/51/79/338345179.db2.gz FBXFELMAKBWFHR-SJORKVTESA-N 0 1 322.452 4.413 20 0 DIADMN Fc1ccc(CN[C@@H]2CCOc3c(F)cccc32)cc1Cl ZINC000438489945 338346039 /nfs/dbraw/zinc/34/60/39/338346039.db2.gz YTUWDOUUKNHZRC-OAHLLOKOSA-N 0 1 309.743 4.232 20 0 DIADMN CC(C)[C@H]1CCN([C@H](C)c2nc3ccccc3n2C(F)F)C1 ZINC000438493585 338346049 /nfs/dbraw/zinc/34/60/49/338346049.db2.gz QUSRUOHCMXAKIR-OLZOCXBDSA-N 0 1 307.388 4.470 20 0 DIADMN CCOc1ccc(-c2nc(CN(C)[C@@H](C)C3(C)CC3)co2)cc1 ZINC000438567019 338348440 /nfs/dbraw/zinc/34/84/40/338348440.db2.gz KOISFSXPJXPHEY-AWEZNQCLSA-N 0 1 314.429 4.361 20 0 DIADMN COc1ccnc(CN([C@@H](C)c2ccc(Cl)cc2)C2CC2)c1 ZINC000438730697 338351278 /nfs/dbraw/zinc/35/12/78/338351278.db2.gz YRLISKWRSNAYDG-ZDUSSCGKSA-N 0 1 316.832 4.469 20 0 DIADMN COc1ccnc(C[N@@H+]([C@H](C)c2ccc(Cl)cc2)C2CC2)c1 ZINC000438730696 338351358 /nfs/dbraw/zinc/35/13/58/338351358.db2.gz YRLISKWRSNAYDG-CYBMUJFWSA-N 0 1 316.832 4.469 20 0 DIADMN COc1ccnc(CN([C@H](C)c2ccc(Cl)cc2)C2CC2)c1 ZINC000438730696 338351359 /nfs/dbraw/zinc/35/13/59/338351359.db2.gz YRLISKWRSNAYDG-CYBMUJFWSA-N 0 1 316.832 4.469 20 0 DIADMN CC(C)(C)c1ncc(CNc2nccn2-c2ccccc2)s1 ZINC000438935683 338356515 /nfs/dbraw/zinc/35/65/15/338356515.db2.gz ZLXDOPWTUMRXTB-UHFFFAOYSA-N 0 1 312.442 4.238 20 0 DIADMN Cc1ccsc1CCCC(=O)Nc1ccc2nc(C)[nH]c2c1 ZINC000439017165 338358545 /nfs/dbraw/zinc/35/85/45/338358545.db2.gz AOPAUXYFVAYIFB-UHFFFAOYSA-N 0 1 313.426 4.203 20 0 DIADMN Cc1ccc(C=Cc2n[nH]c(SC[C@@H](C)C(F)(F)F)n2)o1 ZINC000439048700 338359619 /nfs/dbraw/zinc/35/96/19/338359619.db2.gz UQXLGBTZBRKZIT-HQZHTGGTSA-N 0 1 317.336 4.167 20 0 DIADMN C[C@@H](CSc1nc(-c2cc(F)cc(F)c2)n[nH]1)C(F)(F)F ZINC000439051812 338359743 /nfs/dbraw/zinc/35/97/43/338359743.db2.gz WHCONSAOIAREIN-LURJTMIESA-N 0 1 323.290 4.040 20 0 DIADMN C[C@]1(C(=O)Nc2cccc(Cl)c2O)CCc2ccccc2C1 ZINC000439260199 338365154 /nfs/dbraw/zinc/36/51/54/338365154.db2.gz PQMLCABZCNOCGA-SFHVURJKSA-N 0 1 315.800 4.179 20 0 DIADMN Clc1ccc(CN2CCC([C@@H]3CCCO3)CC2)cc1Cl ZINC000439274351 338365736 /nfs/dbraw/zinc/36/57/36/338365736.db2.gz LVXOGQILBBABIE-INIZCTEOSA-N 0 1 314.256 4.384 20 0 DIADMN C[C@H](c1cccc(Cl)c1F)N1CCC([C@H]2CCCO2)CC1 ZINC000439291893 338366284 /nfs/dbraw/zinc/36/62/84/338366284.db2.gz FHBMQXRGGIVOEU-MLGOLLRUSA-N 0 1 311.828 4.431 20 0 DIADMN C[C@H]1CN(Cc2csc(CCc3ccccc3)n2)C[C@H]1C ZINC000440318917 338385393 /nfs/dbraw/zinc/38/53/93/338385393.db2.gz UQGGCZHZIBMSIJ-GASCZTMLSA-N 0 1 300.471 4.016 20 0 DIADMN C[C@H]1CCN(Cc2csc(CCc3ccccc3)n2)[C@H]1C ZINC000440328852 338385727 /nfs/dbraw/zinc/38/57/27/338385727.db2.gz UBHPABVJODDBDT-GJZGRUSLSA-N 0 1 300.471 4.159 20 0 DIADMN C[C@@H]1C[C@H](C)CN1Cc1csc(CCc2ccccc2)n1 ZINC000440331292 338385826 /nfs/dbraw/zinc/38/58/26/338385826.db2.gz NIZRRYBGYZGBMK-LSDHHAIUSA-N 0 1 300.471 4.159 20 0 DIADMN CCc1ccccc1NC(=O)[C@@H](c1ccccc1)N(CC)CC ZINC000440416055 338386982 /nfs/dbraw/zinc/38/69/82/338386982.db2.gz NOLNBSYLBHHBFT-LJQANCHMSA-N 0 1 310.441 4.271 20 0 DIADMN CC(C)c1ncc(C[N@@H+](C)Cc2cccc3ccccc32)cn1 ZINC000440475965 338388077 /nfs/dbraw/zinc/38/80/77/338388077.db2.gz FXUMLDBRDOIABI-UHFFFAOYSA-N 0 1 305.425 4.385 20 0 DIADMN CC(C)c1ncc(CN(C)Cc2cccc3ccccc32)cn1 ZINC000440475965 338388078 /nfs/dbraw/zinc/38/80/78/338388078.db2.gz FXUMLDBRDOIABI-UHFFFAOYSA-N 0 1 305.425 4.385 20 0 DIADMN CC(C)c1ncc(CN(C)[C@H]2CCc3ccc(Cl)cc32)cn1 ZINC000440478558 338388286 /nfs/dbraw/zinc/38/82/86/338388286.db2.gz LMMNASWLHPEDEY-KRWDZBQOSA-N 0 1 315.848 4.373 20 0 DIADMN CC[C@H](F)CN(Cc1ccc(OC(F)F)c(OC)c1)C1CC1 ZINC000440702063 338395594 /nfs/dbraw/zinc/39/55/94/338395594.db2.gz KBEJMNOHQIZMRI-LBPRGKRZSA-N 0 1 317.351 4.009 20 0 DIADMN CCC[C@H](C)C(=O)N1CCC[C@H]1c1nc2ccc(Cl)cc2[nH]1 ZINC000440735929 338396303 /nfs/dbraw/zinc/39/63/03/338396303.db2.gz XCGUCVWMGFLXTD-NHYWBVRUSA-N 0 1 319.836 4.316 20 0 DIADMN CC[C@@H](F)CN[C@@H](C)c1ccc(OC2CCCC2)c(OC)c1 ZINC000440784973 338397353 /nfs/dbraw/zinc/39/73/53/338397353.db2.gz PGHFNEGIDFTLQX-DZGCQCFKSA-N 0 1 309.425 4.415 20 0 DIADMN CC[C@@H](F)CN[C@H](C)c1ccc(OC2CCCC2)c(OC)c1 ZINC000440784977 338397361 /nfs/dbraw/zinc/39/73/61/338397361.db2.gz PGHFNEGIDFTLQX-UKRRQHHQSA-N 0 1 309.425 4.415 20 0 DIADMN CC(C)c1nnc(CNCCc2ccc(C(C)(C)C)cc2)s1 ZINC000580504448 338426244 /nfs/dbraw/zinc/42/62/44/338426244.db2.gz ZGGMQLAVCDIHRH-UHFFFAOYSA-N 0 1 317.502 4.291 20 0 DIADMN Cc1ccc([C@@H](C)NCc2ccncc2OCC(F)F)c(C)c1 ZINC000442856147 338435047 /nfs/dbraw/zinc/43/50/47/338435047.db2.gz NUUFKNVESIJNCW-CQSZACIVSA-N 0 1 320.383 4.193 20 0 DIADMN Cc1cc(C)cc([C@@H](C)NCc2ccncc2OCC(F)F)c1 ZINC000442874233 338437108 /nfs/dbraw/zinc/43/71/08/338437108.db2.gz SSYXIUDLTOWBLV-CQSZACIVSA-N 0 1 320.383 4.193 20 0 DIADMN Cc1nccnc1[C@@H](C)N[C@@H](C)c1ccccc1C(F)(F)F ZINC000446755850 338535111 /nfs/dbraw/zinc/53/51/11/338535111.db2.gz ZQUZJOMALSEYDM-CMPLNLGQSA-N 0 1 309.335 4.216 20 0 DIADMN C[C@@H](NCc1ccc2c(n1)CCCC2)c1cc2c(s1)CCC2 ZINC000447575698 338558321 /nfs/dbraw/zinc/55/83/21/338558321.db2.gz ZBLYUXRSHSZMAB-CYBMUJFWSA-N 0 1 312.482 4.361 20 0 DIADMN CC(C)[C@@H]1C[C@@H](N[C@@H](CO)c2ccsc2)c2ccccc21 ZINC000447602355 338561594 /nfs/dbraw/zinc/56/15/94/338561594.db2.gz SECQLOJSGNLEQX-KSZLIROESA-N 0 1 301.455 4.256 20 0 DIADMN CCO[C@H]1C[C@@H](NCc2ncc(C(C)(C)C)s2)C12CCCC2 ZINC000447938690 338572131 /nfs/dbraw/zinc/57/21/31/338572131.db2.gz GZAXSJYFYHAEMP-KGLIPLIRSA-N 0 1 322.518 4.268 20 0 DIADMN C(=C/c1ccccc1)\CCc1nc(-c2ccn3cncc3c2)no1 ZINC000447948940 338572619 /nfs/dbraw/zinc/57/26/19/338572619.db2.gz SPIYUUZHDGAQKH-XBXARRHUSA-N 0 1 316.364 4.030 20 0 DIADMN Cc1ccccc1[C@@H](C)Cc1nc(-c2ccn3cncc3c2)no1 ZINC000447955633 338572889 /nfs/dbraw/zinc/57/28/89/338572889.db2.gz PTIXXAAENZKFML-AWEZNQCLSA-N 0 1 318.380 4.039 20 0 DIADMN Cc1ccccc1[C@H](C)Cc1nc(-c2ccn3cncc3c2)no1 ZINC000447955634 338572910 /nfs/dbraw/zinc/57/29/10/338572910.db2.gz PTIXXAAENZKFML-CQSZACIVSA-N 0 1 318.380 4.039 20 0 DIADMN Cc1[nH]c2ccccc2c1C1CCN(Cc2ccncc2F)CC1 ZINC000449016137 338583385 /nfs/dbraw/zinc/58/33/85/338583385.db2.gz NCTNKHFPXYDKAG-UHFFFAOYSA-N 0 1 323.415 4.390 20 0 DIADMN c1cc(CN[C@@H]2CCSc3ccccc32)n(C2CCCC2)n1 ZINC000449060497 338589266 /nfs/dbraw/zinc/58/92/66/338589266.db2.gz SLHKNZBEQCEGCL-QGZVFWFLSA-N 0 1 313.470 4.325 20 0 DIADMN C[C@@H](NCc1ccnn1C1CCCC1)c1ccc(F)c(F)c1 ZINC000449063507 338589541 /nfs/dbraw/zinc/58/95/41/338589541.db2.gz PSZDSEGQLNZIMF-GFCCVEGCSA-N 0 1 305.372 4.127 20 0 DIADMN CCn1nnc(C)c1CN[C@@H](C)c1ccc(-c2ccccc2)cc1 ZINC000449067660 338590133 /nfs/dbraw/zinc/59/01/33/338590133.db2.gz NINRVMKWDDDBKC-HNNXBMFYSA-N 0 1 320.440 4.124 20 0 DIADMN CCOc1ccc([C@H](C)NCc2cccc(C)c2F)cc1OC ZINC000449074267 338590944 /nfs/dbraw/zinc/59/09/44/338590944.db2.gz UMYFAVWWRGOPQH-AWEZNQCLSA-N 0 1 317.404 4.392 20 0 DIADMN CCCCOc1cccc(CNCc2cc3cccnc3o2)c1 ZINC000449088535 338592305 /nfs/dbraw/zinc/59/23/05/338592305.db2.gz HWNZQOCCEPIYQR-UHFFFAOYSA-N 0 1 310.397 4.297 20 0 DIADMN Cc1cc(CN[C@@H](c2ccc(F)cc2)[C@@H]2CCCO2)cs1 ZINC000449098419 338593331 /nfs/dbraw/zinc/59/33/31/338593331.db2.gz JHKKBTADGGLOIM-IRXDYDNUSA-N 0 1 305.418 4.206 20 0 DIADMN Fc1ccc([C@H](NCc2ccncc2F)C2CCCC2)cc1 ZINC000449100157 338593381 /nfs/dbraw/zinc/59/33/81/338593381.db2.gz PVWPMVOHKRQLBE-GOSISDBHSA-N 0 1 302.368 4.381 20 0 DIADMN CCn1nnc(C)c1CN[C@H](CC(C)C)c1ccc(Cl)cc1 ZINC000449162875 338598246 /nfs/dbraw/zinc/59/82/46/338598246.db2.gz KIPMKVXVYBMIDX-MRXNPFEDSA-N 0 1 320.868 4.137 20 0 DIADMN C[C@@H](CC(C)(C)C)N[C@@H](c1nccn1C)c1ccc(F)cc1 ZINC000449221895 338603695 /nfs/dbraw/zinc/60/36/95/338603695.db2.gz UWKZNQSKIXUIFJ-XJKSGUPXSA-N 0 1 303.425 4.063 20 0 DIADMN Cc1cc(CN[C@@H](CC(=O)OC(C)C)c2ccccc2)cs1 ZINC000449331717 338613894 /nfs/dbraw/zinc/61/38/94/338613894.db2.gz PEZQXGHZXDWDME-KRWDZBQOSA-N 0 1 317.454 4.229 20 0 DIADMN FCC(CF)N[C@H]1CCC[C@H]1c1ccc(C(F)(F)F)cc1 ZINC000449382023 338619609 /nfs/dbraw/zinc/61/96/09/338619609.db2.gz UTOUJXVABXNHSM-KBPBESRZSA-N 0 1 307.306 4.239 20 0 DIADMN FC1(F)CCC[C@H]1CNCc1csc(-c2ccccc2)n1 ZINC000449491947 338630737 /nfs/dbraw/zinc/63/07/37/338630737.db2.gz ICMOHXCHRJISFI-ZDUSSCGKSA-N 0 1 308.397 4.335 20 0 DIADMN COc1cccc([C@H]2C[C@H](NCc3csc(C4CC4)n3)C2)c1 ZINC000449619683 338641873 /nfs/dbraw/zinc/64/18/73/338641873.db2.gz QBGXBIIBANIXJX-SHTZXODSSA-N 0 1 314.454 4.065 20 0 DIADMN CN1CCC[C@H](NCc2ccc(F)cc2F)c2ccccc21 ZINC000449649810 338644332 /nfs/dbraw/zinc/64/43/32/338644332.db2.gz JNNDDOYRTHVDJQ-KRWDZBQOSA-N 0 1 302.368 4.026 20 0 DIADMN OCC1([C@H](NCc2ccc(F)cc2F)c2cccs2)CCC1 ZINC000449764484 338651025 /nfs/dbraw/zinc/65/10/25/338651025.db2.gz BLWGHZTZPNNPFR-MRXNPFEDSA-N 0 1 323.408 4.020 20 0 DIADMN CCCCc1ccc([C@H](NCc2cnns2)C(C)C)cc1 ZINC000450595142 338693059 /nfs/dbraw/zinc/69/30/59/338693059.db2.gz DURKMCITUJAHNE-QGZVFWFLSA-N 0 1 303.475 4.368 20 0 DIADMN Fc1ccc([C@@H](NC[C@@H]2CCCC2(F)F)c2ccccn2)cc1 ZINC000450595922 338693117 /nfs/dbraw/zinc/69/31/17/338693117.db2.gz LCQFYYMPKWVIOO-WMLDXEAASA-N 0 1 320.358 4.335 20 0 DIADMN CC(C)COC[C@@H](NC[C@@H]1CCCCC1(F)F)c1ccco1 ZINC000450711660 338700356 /nfs/dbraw/zinc/70/03/56/338700356.db2.gz CZJLWXOJIUAXMP-LSDHHAIUSA-N 0 1 315.404 4.408 20 0 DIADMN FC(F)(F)c1ccc2c(c1)nccc2N[C@H]1CC12CCOCC2 ZINC000450796561 338705854 /nfs/dbraw/zinc/70/58/54/338705854.db2.gz RCDQVYCCMQLIMQ-HNNXBMFYSA-N 0 1 322.330 4.235 20 0 DIADMN CCCCc1nc(CN2CCC3(CCC(O)CC3)CC2)cs1 ZINC000451146609 338723054 /nfs/dbraw/zinc/72/30/54/338723054.db2.gz NXRGIIIIWYCKJF-UHFFFAOYSA-N 0 1 322.518 4.003 20 0 DIADMN CC[C@@H](CC(C)C)C(=O)Nc1cccc2c1OCC[C@@H]2N(C)C ZINC000451296924 338728675 /nfs/dbraw/zinc/72/86/75/338728675.db2.gz GPUQSLAPGFFCQI-YOEHRIQHSA-N 0 1 318.461 4.083 20 0 DIADMN Fc1ccccc1-c1cnc(CN[C@H]2CCC23CCCC3)o1 ZINC000451464051 338735656 /nfs/dbraw/zinc/73/56/56/338735656.db2.gz YCLIHBOJVKQREO-INIZCTEOSA-N 0 1 300.377 4.293 20 0 DIADMN C[C@@H](N[C@@H](C)C1CCCC1)c1nc(Cc2ccc(F)cc2)no1 ZINC000451989030 338750453 /nfs/dbraw/zinc/75/04/53/338750453.db2.gz BBWIHRROTJUATM-QWHCGFSZSA-N 0 1 317.408 4.029 20 0 DIADMN C[C@@H](N[C@@H](CC(C)(C)C)c1ccc(F)cc1)c1ccncn1 ZINC000453055864 338788240 /nfs/dbraw/zinc/78/82/40/338788240.db2.gz BDYXIZDPLCSOIK-DYVFJYSZSA-N 0 1 301.409 4.444 20 0 DIADMN C[C@H](N[C@@H]1CCc2ccccc21)c1ncc(-c2ccccc2)n1C ZINC000453073269 338790511 /nfs/dbraw/zinc/79/05/11/338790511.db2.gz NREPMROKVIZRRZ-HNAYVOBHSA-N 0 1 317.436 4.425 20 0 DIADMN C[C@H]1CC[C@@H](NCc2cn3ccsc3n2)c2sccc21 ZINC000453074827 338790678 /nfs/dbraw/zinc/79/06/78/338790678.db2.gz KARUGHLAMALSOR-GXFFZTMASA-N 0 1 303.456 4.186 20 0 DIADMN CC[C@H](N[C@@H](c1ccc(F)cc1)[C@@H]1CCCO1)c1ccncc1 ZINC000453076377 338790872 /nfs/dbraw/zinc/79/08/72/338790872.db2.gz GSYLIOIOAIXNAT-FHWLQOOXSA-N 0 1 314.404 4.182 20 0 DIADMN C[C@@H]1C[C@@H](N[C@@H](c2ccc(Cl)cc2)C2CC2)c2nccn21 ZINC000453083195 338791684 /nfs/dbraw/zinc/79/16/84/338791684.db2.gz LUJJXCBDYJPEDY-HFBAOOFYSA-N 0 1 301.821 4.283 20 0 DIADMN C[C@@H]1CC[C@H](C)[C@@H](N[C@H](c2nccn2C)c2ccccc2F)C1 ZINC000453085876 338791945 /nfs/dbraw/zinc/79/19/45/338791945.db2.gz XOIVCJZSANVGBI-BODMPHMZSA-N 0 1 315.436 4.063 20 0 DIADMN Cc1ccn2cc(CN[C@@H]3CC[C@@H](C)c4ccsc43)nc2c1 ZINC000453102837 338794094 /nfs/dbraw/zinc/79/40/94/338794094.db2.gz BSALEGBKCPXNTN-CZUORRHYSA-N 0 1 311.454 4.432 20 0 DIADMN CC[C@@H](CN[C@@H](C)c1nccn1CC)Oc1ccccc1Cl ZINC000453124231 338796712 /nfs/dbraw/zinc/79/67/12/338796712.db2.gz GFXOXMNNKCRUOL-KBPBESRZSA-N 0 1 321.852 4.065 20 0 DIADMN C[C@H](N[C@H](c1ccc(Cl)cc1)[C@@H]1C[C@@H]1C)c1ccncn1 ZINC000453154764 338800463 /nfs/dbraw/zinc/80/04/63/338800463.db2.gz SHXXYDOVNCHICH-ZILJWTLNSA-N 0 1 301.821 4.178 20 0 DIADMN CC[C@H](CSc1ccc(C)c(C)c1)N[C@H]1CCn2ccnc21 ZINC000453178127 338803152 /nfs/dbraw/zinc/80/31/52/338803152.db2.gz 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Cc1cc(C(=O)N(CCC(C)C)[C@H](C)CCCC(C)C)n[nH]1 ZINC000464273566 339138676 /nfs/dbraw/zinc/13/86/76/339138676.db2.gz BONPGTWEAOTDCW-MRXNPFEDSA-N 0 1 307.482 4.421 20 0 DIADMN CCC1(CC)CN([C@H](C)c2nc3ccccc3o2)CCS1 ZINC000464585893 339146375 /nfs/dbraw/zinc/14/63/75/339146375.db2.gz HKOHWBNQWMYMAY-CYBMUJFWSA-N 0 1 304.459 4.496 20 0 DIADMN CC[C@H]1CCCN(Cc2nnc(-c3ccccc3)s2)CC1 ZINC000464690593 339148847 /nfs/dbraw/zinc/14/88/47/339148847.db2.gz MBHMGUXXVZESHI-AWEZNQCLSA-N 0 1 301.459 4.217 20 0 DIADMN CCC[C@@H]1[C@@H](C)CCCN1Cc1ccc(Br)cn1 ZINC000464729729 339150218 /nfs/dbraw/zinc/15/02/18/339150218.db2.gz IALQPDMXAPCXGR-SWLSCSKDSA-N 0 1 311.267 4.245 20 0 DIADMN Cc1sc(NC(=O)CN2CCC[C@@H]2C(C)(C)C)c(C)c1C ZINC000464726713 339150331 /nfs/dbraw/zinc/15/03/31/339150331.db2.gz ATLFGOKXMPSDRB-CQSZACIVSA-N 0 1 308.491 4.122 20 0 DIADMN CCC[C@@H]1[C@H](C)CCCN1Cc1nc(Cc2ccccc2)no1 ZINC000464735576 339150577 /nfs/dbraw/zinc/15/05/77/339150577.db2.gz QDGMOUWKNJABQG-NVXWUHKLSA-N 0 1 313.445 4.061 20 0 DIADMN CC[C@H](C)NC(=O)CN(C)[C@@H](C)c1ccc(-c2ccccc2)cc1 ZINC000464763932 339151650 /nfs/dbraw/zinc/15/16/50/339151650.db2.gz SQUMLOMMXWPEPN-IRXDYDNUSA-N 0 1 324.468 4.261 20 0 DIADMN CC(C)[C@@H]1CN(Cc2cccc(C(F)(F)F)c2)CCS1 ZINC000464766622 339151890 /nfs/dbraw/zinc/15/18/90/339151890.db2.gz AZLXJAVEGGISEX-AWEZNQCLSA-N 0 1 303.393 4.279 20 0 DIADMN CC[C@]1(C)CCCN(Cc2coc(-c3ccc(OC)cc3)n2)C1 ZINC000464779162 339153124 /nfs/dbraw/zinc/15/31/24/339153124.db2.gz RCVZFHSNTFDBTI-LJQANCHMSA-N 0 1 314.429 4.362 20 0 DIADMN CC[C@]1(C)CCCN(Cc2coc(-c3cccc(F)c3)n2)C1 ZINC000464782053 339153445 /nfs/dbraw/zinc/15/34/45/339153445.db2.gz XJYRCPMAFZKHPZ-GOSISDBHSA-N 0 1 302.393 4.493 20 0 DIADMN CC[C@@]1(C)CCCN([C@H](C)C(=O)Nc2cc(C)ccc2C)C1 ZINC000464782510 339153524 /nfs/dbraw/zinc/15/35/24/339153524.db2.gz XLPDTVBDOVGSRF-APWZRJJASA-N 0 1 302.462 4.143 20 0 DIADMN CC[C@@H]1CN(Cc2c(C)cc(C)c(C(C)=O)c2C)CCS1 ZINC000464787023 339153700 /nfs/dbraw/zinc/15/37/00/339153700.db2.gz VZNDZKIVJKYDRM-MRXNPFEDSA-N 0 1 305.487 4.142 20 0 DIADMN Cc1ccc(NC(=O)[C@@H](c2ccccc2)N2CCC(C)(C)C2)cc1 ZINC000464799600 339154324 /nfs/dbraw/zinc/15/43/24/339154324.db2.gz QLGHCHAFMZNKOS-LJQANCHMSA-N 0 1 322.452 4.407 20 0 DIADMN Cc1nc(C(C)(C)NCCO[C@@H]2CCCC[C@@H]2C)sc1C ZINC000464803338 339154610 /nfs/dbraw/zinc/15/46/10/339154610.db2.gz WUXSJTKCYUNSEV-SWLSCSKDSA-N 0 1 310.507 4.180 20 0 DIADMN CC[C@](C)(NCCOc1ccc(Cl)cc1)c1nc(C)cs1 ZINC000464807080 339154801 /nfs/dbraw/zinc/15/48/01/339154801.db2.gz SASZJMVCBACLOI-INIZCTEOSA-N 0 1 324.877 4.399 20 0 DIADMN COc1cccc(-c2nc(CN3C[C@H](C)CC[C@H]3C)cs2)c1 ZINC000464817320 339155098 /nfs/dbraw/zinc/15/50/98/339155098.db2.gz HAVCGRMXMIYNJF-ZIAGYGMSSA-N 0 1 316.470 4.439 20 0 DIADMN C[C@@H]1CC[C@@H](C)N(Cc2csc(Cc3ccccc3)n2)C1 ZINC000464815213 339155140 /nfs/dbraw/zinc/15/51/40/339155140.db2.gz PHUACRBYTHLLKY-HUUCEWRRSA-N 0 1 300.471 4.354 20 0 DIADMN COc1ccccc1-c1nc(CN2C[C@H](C)CC[C@H]2C)cs1 ZINC000464815491 339155152 /nfs/dbraw/zinc/15/51/52/339155152.db2.gz STMBJPZJGAUPAX-ZIAGYGMSSA-N 0 1 316.470 4.439 20 0 DIADMN C[C@H]1CC[C@H](C)N(Cc2nc(-c3ccc(Cl)cc3)no2)C1 ZINC000464833233 339156083 /nfs/dbraw/zinc/15/60/83/339156083.db2.gz RTRXJSNHGNDOOT-RYUDHWBXSA-N 0 1 305.809 4.010 20 0 DIADMN CCC[C@]1(C)CCCN([C@H](C)C(=O)Nc2ccccc2CC)C1 ZINC000464835406 339156191 /nfs/dbraw/zinc/15/61/91/339156191.db2.gz IIIHGRRRUJDUSI-OXQOHEQNSA-N 0 1 316.489 4.478 20 0 DIADMN CCC[C@]1(C)CCCN(Cc2nc(-c3ccc(F)cc3)no2)C1 ZINC000464842018 339157079 /nfs/dbraw/zinc/15/70/79/339157079.db2.gz ZVJOIUAZIQOGQN-GOSISDBHSA-N 0 1 317.408 4.278 20 0 DIADMN CCC[C@]1(C)CCCN(CC(=O)Nc2c(C)cccc2CC)C1 ZINC000464845411 339157301 /nfs/dbraw/zinc/15/73/01/339157301.db2.gz FMMVOAAOOHZIKY-HXUWFJFHSA-N 0 1 316.489 4.398 20 0 DIADMN COc1c(C)cnc(CN2CC[C@H](C)C[C@@H]2c2ccco2)c1C ZINC000464848983 339157443 /nfs/dbraw/zinc/15/74/43/339157443.db2.gz JORDKBKVFYNXMU-SUMWQHHRSA-N 0 1 314.429 4.273 20 0 DIADMN CCC[C@@]1(C)CCCN([C@@H](C)C(=O)Nc2ccccc2C)C1 ZINC000464857844 339158400 /nfs/dbraw/zinc/15/84/00/339158400.db2.gz WGWCZDLCITXCQS-LPHOPBHVSA-N 0 1 302.462 4.224 20 0 DIADMN Fc1ccc2oc(CN3CC[C@H](c4cccc(F)c4)C3)nc2c1 ZINC000464872119 339159554 /nfs/dbraw/zinc/15/95/54/339159554.db2.gz VXIPWNYACXJGHE-ZDUSSCGKSA-N 0 1 314.335 4.096 20 0 DIADMN Fc1ccc2oc(CN3CC[C@@H](c4cccc(F)c4)C3)nc2c1 ZINC000464872117 339159636 /nfs/dbraw/zinc/15/96/36/339159636.db2.gz VXIPWNYACXJGHE-CYBMUJFWSA-N 0 1 314.335 4.096 20 0 DIADMN Fc1ccc([C@@H]2CCN(Cc3nc4cc(F)ccc4o3)C2)cc1 ZINC000464879899 339160032 /nfs/dbraw/zinc/16/00/32/339160032.db2.gz QXBPBYGMLWDENK-CYBMUJFWSA-N 0 1 314.335 4.096 20 0 DIADMN CSCCCN1CCSC[C@H]1c1ccc(Cl)cc1 ZINC000464883057 339160132 /nfs/dbraw/zinc/16/01/32/339160132.db2.gz MNEQORNUFWDFBX-AWEZNQCLSA-N 0 1 301.908 4.183 20 0 DIADMN CSCCCN1CCSC[C@@H]1c1ccc(Cl)cc1 ZINC000464883058 339160193 /nfs/dbraw/zinc/16/01/93/339160193.db2.gz MNEQORNUFWDFBX-CQSZACIVSA-N 0 1 301.908 4.183 20 0 DIADMN CC[C@H](CC1CCCC1)C(=O)NCc1nc2ccc(C)cc2[nH]1 ZINC000465199365 339171362 /nfs/dbraw/zinc/17/13/62/339171362.db2.gz ZLFBXMRVBAKUKR-OAHLLOKOSA-N 0 1 313.445 4.094 20 0 DIADMN CO[C@]1(C)C[C@@H](N[C@@H](C)c2ncc(-c3ccccc3)o2)C1(C)C ZINC000465395406 339175290 /nfs/dbraw/zinc/17/52/90/339175290.db2.gz AKCUFIZJCBJPQG-URKNILKWSA-N 0 1 314.429 4.196 20 0 DIADMN CC(C)C[C@@H]1CCN(Cc2nc(-c3cccc(Cl)c3)no2)C1 ZINC000466721163 339214229 /nfs/dbraw/zinc/21/42/29/339214229.db2.gz CVCMWWDVFCJLOU-ZDUSSCGKSA-N 0 1 319.836 4.258 20 0 DIADMN CC(C)C[C@@H]1CCN([C@H](C)c2nc(-c3cccs3)no2)C1 ZINC000466720464 339214268 /nfs/dbraw/zinc/21/42/68/339214268.db2.gz VEVJLVGPFPKACI-OLZOCXBDSA-N 0 1 305.447 4.227 20 0 DIADMN CC(C)C[C@@H]1CCN(CC(=O)Nc2ccccc2C(C)C)C1 ZINC000466744676 339215406 /nfs/dbraw/zinc/21/54/06/339215406.db2.gz SDWXMWWWZXCBJJ-INIZCTEOSA-N 0 1 302.462 4.117 20 0 DIADMN CC[C@H](C)[C@H]1CCCCN1Cc1nc([C@@H](C)OCC(C)C)no1 ZINC000466744252 339215414 /nfs/dbraw/zinc/21/54/14/339215414.db2.gz UDBRNGLSIMGFFC-ARFHVFGLSA-N 0 1 323.481 4.204 20 0 DIADMN CC(C)C[C@@H]1CCN(Cc2nc3ccccc3n2C(F)F)C1 ZINC000466743505 339215500 /nfs/dbraw/zinc/21/55/00/339215500.db2.gz NPMNEHBFCYPAJQ-ZDUSSCGKSA-N 0 1 307.388 4.299 20 0 DIADMN Cc1ccc2nc(CNC(=O)Nc3ccc(C(C)C)cc3)[nH]c2c1 ZINC000466758741 339216071 /nfs/dbraw/zinc/21/60/71/339216071.db2.gz ORKGYZKIWKWMHL-UHFFFAOYSA-N 0 1 322.412 4.316 20 0 DIADMN CC/C=C/CCN(C)CC(=O)Nc1c(Cl)cccc1Cl ZINC000466832188 339218586 /nfs/dbraw/zinc/21/85/86/339218586.db2.gz BKPLWAXEFDDXFA-SNAWJCMRSA-N 0 1 315.244 4.220 20 0 DIADMN C[C@]1(c2ccccc2)CCN(Cc2nc3ccc(F)cc3o2)C1 ZINC000466958235 339222630 /nfs/dbraw/zinc/22/26/30/339222630.db2.gz SJHDPBQXGHUURJ-IBGZPJMESA-N 0 1 310.372 4.131 20 0 DIADMN COC(=O)c1ccc(CN2CCCCC[C@H]2c2ccco2)s1 ZINC000466959322 339222759 /nfs/dbraw/zinc/22/27/59/339222759.db2.gz IIZMNPBWLCAZPB-AWEZNQCLSA-N 0 1 319.426 4.245 20 0 DIADMN COCc1ccc([C@H]2CCCN2Cc2cc(C)ccc2OC)o1 ZINC000467014495 339224743 /nfs/dbraw/zinc/22/47/43/339224743.db2.gz DHDVHZVLRLQXRY-QGZVFWFLSA-N 0 1 315.413 4.080 20 0 DIADMN CCCCCN(C(=O)[C@H]1CCCc2[nH]ncc21)[C@H](C)CCC ZINC000467101556 339226244 /nfs/dbraw/zinc/22/62/44/339226244.db2.gz PMIFBPGUCQEYQB-CABCVRRESA-N 0 1 305.466 4.037 20 0 DIADMN CC(C)c1noc(CNC2(Cc3ccccc3)CCCCC2)n1 ZINC000467179047 339227385 /nfs/dbraw/zinc/22/73/85/339227385.db2.gz DJBDRHNEIFJNSP-UHFFFAOYSA-N 0 1 313.445 4.228 20 0 DIADMN CCCc1noc(CNC2(Cc3ccccc3)CCCCC2)n1 ZINC000467197688 339227829 /nfs/dbraw/zinc/22/78/29/339227829.db2.gz PUQYATLFXJBNIE-UHFFFAOYSA-N 0 1 313.445 4.057 20 0 DIADMN CC(=O)c1cc(Cl)ccc1OCc1ccc2nc(C)[nH]c2c1 ZINC000467205191 339228217 /nfs/dbraw/zinc/22/82/17/339228217.db2.gz FPSXFIMVXXZNAS-UHFFFAOYSA-N 0 1 314.772 4.306 20 0 DIADMN COCC[C@@H]1CCCCN(Cc2csc(C(C)(C)C)n2)C1 ZINC000467270210 339229404 /nfs/dbraw/zinc/22/94/04/339229404.db2.gz XSVNICOBXNZSKV-AWEZNQCLSA-N 0 1 310.507 4.079 20 0 DIADMN COC[C@H]1CCCCN(Cc2csc(C3CCCCC3)n2)C1 ZINC000467277971 339229686 /nfs/dbraw/zinc/22/96/86/339229686.db2.gz KNOKLMCMMSXPDP-HNNXBMFYSA-N 0 1 322.518 4.439 20 0 DIADMN C[C@H](CCN[C@@H](c1ncc[nH]1)c1ccccc1)c1ccccc1 ZINC000467410423 339237109 /nfs/dbraw/zinc/23/71/09/339237109.db2.gz HBZZSSHSPRHXAU-VQIMIIECSA-N 0 1 305.425 4.283 20 0 DIADMN C[C@@H](CCN[C@@H](c1ncc[nH]1)c1ccccc1)c1ccccc1 ZINC000467410422 339237138 /nfs/dbraw/zinc/23/71/38/339237138.db2.gz HBZZSSHSPRHXAU-QFBILLFUSA-N 0 1 305.425 4.283 20 0 DIADMN C[C@H](CCN[C@H](c1ncc[nH]1)c1ccccc1)c1ccccc1 ZINC000467410420 339237151 /nfs/dbraw/zinc/23/71/51/339237151.db2.gz HBZZSSHSPRHXAU-APWZRJJASA-N 0 1 305.425 4.283 20 0 DIADMN C[C@H](CC1CCOCC1)Nc1ccc(Cl)c(CN(C)C)c1 ZINC000467435826 339238528 /nfs/dbraw/zinc/23/85/28/339238528.db2.gz UVTKWOVGTCYXFH-CYBMUJFWSA-N 0 1 310.869 4.019 20 0 DIADMN Cc1nn(C(C)C)cc1CN1CC[C@H](C)[C@@H]1c1cccc(F)c1 ZINC000467439612 339238767 /nfs/dbraw/zinc/23/87/67/339238767.db2.gz NCBUSNZQQXPPAQ-IFXJQAMLSA-N 0 1 315.436 4.495 20 0 DIADMN CCN(Cc1cn(C(C)C)nc1C)Cc1cccc(Cl)c1 ZINC000467451153 339239436 /nfs/dbraw/zinc/23/94/36/339239436.db2.gz ZDSITFPZQQSSIG-UHFFFAOYSA-N 0 1 305.853 4.448 20 0 DIADMN C[C@@H]1CCC[C@@H]1CN[C@H](c1ccn(C)n1)c1ccc(Cl)cc1 ZINC000467458120 339239751 /nfs/dbraw/zinc/23/97/51/339239751.db2.gz QFROTUOZRGRGCR-SIIHOXLZSA-N 0 1 317.864 4.189 20 0 DIADMN Cc1nn(C(C)C)cc1CN1C[C@@H](C)C[C@@H]1c1cccc(F)c1 ZINC000467457992 339239800 /nfs/dbraw/zinc/23/98/00/339239800.db2.gz PXFQIHTYNVTVJD-IFXJQAMLSA-N 0 1 315.436 4.495 20 0 DIADMN CC(C)[C@H]1C[C@H](Nc2ccc(Cl)c(CN(C)C)c2)CS1 ZINC000467547438 339240704 /nfs/dbraw/zinc/24/07/04/339240704.db2.gz HCHFLKWLRUDESY-GOEBONIOSA-N 0 1 312.910 4.344 20 0 DIADMN CCc1nc(CN2CC[C@H](c3ccccc3)C[C@H]2C)cs1 ZINC000467553581 339242196 /nfs/dbraw/zinc/24/21/96/339242196.db2.gz KNHCRDGQQVQODW-ZBFHGGJFSA-N 0 1 300.471 4.474 20 0 DIADMN FC1(c2cccc(Cl)c2)CCN(Cc2ccccn2)CC1 ZINC000467553812 339242229 /nfs/dbraw/zinc/24/22/29/339242229.db2.gz LSCDQSUCJVIDNJ-UHFFFAOYSA-N 0 1 304.796 4.196 20 0 DIADMN C[C@@H](NCCCOC1CCCC1)c1nc(C(F)(F)F)cs1 ZINC000467749248 339245625 /nfs/dbraw/zinc/24/56/25/339245625.db2.gz 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313.832 4.386 20 0 DIADMN CC[C@@H]1CCCC[C@H]1NCc1nc(Cc2ccccc2C)no1 ZINC000481180335 339597471 /nfs/dbraw/zinc/59/74/71/339597471.db2.gz XBCQHIQUVLWJQB-NVXWUHKLSA-N 0 1 313.445 4.027 20 0 DIADMN COc1ccc(F)cc1[C@@H](C)N[C@H](C)c1ccc2c(c1)COC2 ZINC000481315023 339600871 /nfs/dbraw/zinc/60/08/71/339600871.db2.gz MGVDEJFCJBHBLT-CHWSQXEVSA-N 0 1 315.388 4.276 20 0 DIADMN CC[C@@H](N[C@H](CC)c1nnc2n1CCCCC2)c1cccs1 ZINC000481909263 339616443 /nfs/dbraw/zinc/61/64/43/339616443.db2.gz NTVBZJUXSKSHTH-ZIAGYGMSSA-N 0 1 318.490 4.258 20 0 DIADMN Cc1nccnc1[C@@H](C)NC1CC(F)(c2cccc(Cl)c2)C1 ZINC000482058744 339621293 /nfs/dbraw/zinc/62/12/93/339621293.db2.gz CLTVAMWGBUFJRA-OLJMKKDRSA-N 0 1 319.811 4.116 20 0 DIADMN CC(C)=CCC[C@H](C)CCN1CCN([C@H](C)C(F)(F)F)CC1 ZINC000482170942 339625558 /nfs/dbraw/zinc/62/55/58/339625558.db2.gz OCHRHKIPUQUADM-JKSUJKDBSA-N 0 1 320.443 4.327 20 0 DIADMN CCCc1cccc(CNCc2nc3cc(C)ccc3n2C)c1 ZINC000482524268 339634532 /nfs/dbraw/zinc/63/45/32/339634532.db2.gz BYWDMDBHWPBFBE-UHFFFAOYSA-N 0 1 307.441 4.124 20 0 DIADMN Cc1noc([C@H](C)NC[C@@H](C)Cc2ccc(C(C)(C)C)cc2)n1 ZINC000483333406 339661897 /nfs/dbraw/zinc/66/18/97/339661897.db2.gz BOCWVJJASUJURF-KBPBESRZSA-N 0 1 315.461 4.205 20 0 DIADMN C[C@@H](N[C@@H](C)CC1CCCC1)c1nc(-c2cccc(F)c2)no1 ZINC000483362079 339662578 /nfs/dbraw/zinc/66/25/78/339662578.db2.gz ZHJWWIRYFZTHHR-QWHCGFSZSA-N 0 1 317.408 4.495 20 0 DIADMN C[C@H](CCCC(F)(F)F)N[C@@H](C)c1nc(C(C)(C)C)no1 ZINC000483634009 339670059 /nfs/dbraw/zinc/67/00/59/339670059.db2.gz GTYOBGCTRZHARG-ZJUUUORDSA-N 0 1 307.360 4.139 20 0 DIADMN C[C@@H](N[C@@H](C)CCc1ccsc1)c1nc(C(C)(C)C)no1 ZINC000483637991 339670207 /nfs/dbraw/zinc/67/02/07/339670207.db2.gz ISYKWOYIZSKNPB-NWDGAFQWSA-N 0 1 307.463 4.101 20 0 DIADMN CCCC[C@H](C)N[C@H](C)c1nc(-c2ccc(C)c(F)c2)no1 ZINC000483636480 339670290 /nfs/dbraw/zinc/67/02/90/339670290.db2.gz NJEGSKXQVQUOGJ-QWHCGFSZSA-N 0 1 305.397 4.413 20 0 DIADMN C[C@@H](N[C@H]1CCCC(C)(C)C1)c1nc(Cc2ccccc2)no1 ZINC000483643731 339670459 /nfs/dbraw/zinc/67/04/59/339670459.db2.gz OOLDDHMSLJNYKA-ZBFHGGJFSA-N 0 1 313.445 4.280 20 0 DIADMN Cc1cccc(CC[C@H](C)N[C@H](C)c2nc(C(C)(C)C)no2)c1 ZINC000483646220 339670568 /nfs/dbraw/zinc/67/05/68/339670568.db2.gz BVMVKIAXFBRSNQ-LSDHHAIUSA-N 0 1 315.461 4.347 20 0 DIADMN COc1cccc(-c2noc([C@H](C)N[C@H](C)CCC(C)C)n2)c1 ZINC000483672287 339671379 /nfs/dbraw/zinc/67/13/79/339671379.db2.gz SWYLRTXONGXWMD-KGLIPLIRSA-N 0 1 317.433 4.221 20 0 DIADMN CCCC[C@H](CC)C(=O)NC[C@H](c1ccco1)N1CCCCC1 ZINC000483733603 339673150 /nfs/dbraw/zinc/67/31/50/339673150.db2.gz PPHWVKKEBJVCAX-DLBZAZTESA-N 0 1 320.477 4.139 20 0 DIADMN COc1ccccc1[C@H](C)NCc1cc(F)ccc1SC ZINC000483842917 339676004 /nfs/dbraw/zinc/67/60/04/339676004.db2.gz RSPCLFZMNVHKQR-LBPRGKRZSA-N 0 1 305.418 4.407 20 0 DIADMN Cc1nc(CN[C@@H]2CCCC[C@H]2Oc2ccccc2C)oc1C ZINC000484638762 339691326 /nfs/dbraw/zinc/69/13/26/339691326.db2.gz FKVWIZIQLOZQND-SJLPKXTDSA-N 0 1 314.429 4.080 20 0 DIADMN CC(C)N(C(=O)[C@H](C)N[C@H](C)c1ccccc1Cl)C(C)C ZINC000485900928 339715812 /nfs/dbraw/zinc/71/58/12/339715812.db2.gz ZLZKSSUUJDZNQS-KGLIPLIRSA-N 0 1 310.869 4.025 20 0 DIADMN C[C@H](N[C@@H](c1nccn1C)c1ccc(Cl)cc1)[C@@H]1CC1(C)C ZINC000486940248 339739091 /nfs/dbraw/zinc/73/90/91/339739091.db2.gz SLWLPQKNZQASEL-VBNZEHGJSA-N 0 1 317.864 4.187 20 0 DIADMN CCc1ccc(CN[C@H](COC)c2ccc(Cl)cc2)s1 ZINC000487170054 339745103 /nfs/dbraw/zinc/74/51/03/339745103.db2.gz WANGTRYVKWDOFX-MRXNPFEDSA-N 0 1 309.862 4.441 20 0 DIADMN COC[C@H](NCc1ccc(C)c(F)c1)c1ccc(Cl)cc1 ZINC000487212366 339746530 /nfs/dbraw/zinc/74/65/30/339746530.db2.gz TTYCSZFZLJPXGV-KRWDZBQOSA-N 0 1 307.796 4.265 20 0 DIADMN CCOc1c(Cl)cccc1CNCc1cccc(N(C)C)c1 ZINC000487313574 339750749 /nfs/dbraw/zinc/75/07/49/339750749.db2.gz ZQLWIXDVVIPHCO-UHFFFAOYSA-N 0 1 318.848 4.095 20 0 DIADMN CCOc1ccc(CN[C@H](CC)c2c(C)noc2C)cc1F ZINC000487548345 339756546 /nfs/dbraw/zinc/75/65/46/339756546.db2.gz KHHALMKURWZQBY-OAHLLOKOSA-N 0 1 306.381 4.070 20 0 DIADMN Cc1cccc(C)c1NC(=O)CN[C@H](C)c1cccc(Cl)c1 ZINC000487948104 339766643 /nfs/dbraw/zinc/76/66/43/339766643.db2.gz ZFDALFAJQUYVSK-CQSZACIVSA-N 0 1 316.832 4.246 20 0 DIADMN CC(C)N(C(=O)CN[C@H](C)c1cccc(Cl)c1)C1CCCC1 ZINC000487949634 339766657 /nfs/dbraw/zinc/76/66/57/339766657.db2.gz NGTJNXUCNMXOHJ-CQSZACIVSA-N 0 1 322.880 4.170 20 0 DIADMN Cc1cccc([C@H](C)NCc2nc3cc(Cl)ccc3n2C)c1 ZINC000488192633 339772982 /nfs/dbraw/zinc/77/29/82/339772982.db2.gz YNHRJPFNGJGXTA-ZDUSSCGKSA-N 0 1 313.832 4.386 20 0 DIADMN C[C@@H](NC/C=C/c1ccccc1)c1nccn1-c1ccccc1 ZINC000488376296 339779015 /nfs/dbraw/zinc/77/90/15/339779015.db2.gz VOWGGSLYRUGIEI-VGMNTSGFSA-N 0 1 303.409 4.236 20 0 DIADMN CC(C)(C)c1csc(CN[C@H]2CS[C@@H](C(C)(C)C)C2)n1 ZINC000488452835 339783403 /nfs/dbraw/zinc/78/34/03/339783403.db2.gz GSUIJKLRNOTUOX-DGCLKSJQSA-N 0 1 312.548 4.450 20 0 DIADMN COCC1CCN([C@H](C)c2ccc(Cl)cc2Cl)CC1 ZINC000488657762 339790042 /nfs/dbraw/zinc/79/00/42/339790042.db2.gz SJRMWSCVFDPQOH-LLVKDONJSA-N 0 1 302.245 4.413 20 0 DIADMN CC(C)O[C@@H](C(=O)Nc1cccc(Cl)c1O)c1ccccc1 ZINC000490742920 339839336 /nfs/dbraw/zinc/83/93/36/339839336.db2.gz AKXRQTHPKKWRQC-MRXNPFEDSA-N 0 1 319.788 4.150 20 0 DIADMN Cc1ccc([C@H](NCC2(O)CCC2)c2ccccc2Cl)cc1 ZINC000492267329 339895913 /nfs/dbraw/zinc/89/59/13/339895913.db2.gz GXLVHXDYMLHNAM-SFHVURJKSA-N 0 1 315.844 4.242 20 0 DIADMN COC[C@@H](N[C@H]1CCc2c1cccc2F)c1ccc(Cl)cc1 ZINC000492275769 339896221 /nfs/dbraw/zinc/89/62/21/339896221.db2.gz OVJWTFALCKHMGG-ZWKOTPCHSA-N 0 1 319.807 4.444 20 0 DIADMN c1ccc(C[C@@H]2C[C@H]2N[C@H](c2ccccc2)c2ccccn2)cc1 ZINC000493997473 339938386 /nfs/dbraw/zinc/93/83/86/339938386.db2.gz WKUNZOLRHDFRKN-CEMLEFRQSA-N 0 1 314.432 4.392 20 0 DIADMN CC[C@@H](NCc1ccc2nc(C)sc2c1)c1c(C)noc1C ZINC000494187288 339943186 /nfs/dbraw/zinc/94/31/86/339943186.db2.gz ZVSCMIWNVWCDHK-CQSZACIVSA-N 0 1 315.442 4.450 20 0 DIADMN CCc1cnccc1[C@H](C)N[C@@H](COC)c1ccc(Cl)cc1 ZINC000494621604 339955692 /nfs/dbraw/zinc/95/56/92/339955692.db2.gz QCGICTXMYNSDJC-UGSOOPFHSA-N 0 1 318.848 4.336 20 0 DIADMN CC(C)c1ccc2c(c1)[C@@H](NCc1cccc3c1OCO3)CC2 ZINC000495154745 339976762 /nfs/dbraw/zinc/97/67/62/339976762.db2.gz YHAYFSKJPAUAAU-SFHVURJKSA-N 0 1 309.409 4.316 20 0 DIADMN CCCOc1ncccc1CN[C@@H](C)c1ccc(Cl)cc1 ZINC000495504571 339986085 /nfs/dbraw/zinc/98/60/85/339986085.db2.gz VOHPNPPTXIDOGC-ZDUSSCGKSA-N 0 1 304.821 4.375 20 0 DIADMN CC[C@@H](NCc1cccc(NC(=O)OC)c1)c1ccccc1F ZINC000495820232 339992838 /nfs/dbraw/zinc/99/28/38/339992838.db2.gz XLRXIUKBTJBYCB-QGZVFWFLSA-N 0 1 316.376 4.245 20 0 DIADMN Cc1[nH]nc2cc(NC(=O)c3nsc4ccc(C)cc43)ccc12 ZINC000496844796 340014324 /nfs/dbraw/zinc/01/43/24/340014324.db2.gz FOYIEEDVZXHRSS-UHFFFAOYSA-N 0 1 322.393 4.042 20 0 DIADMN CC(C)c1ccccc1NC(=O)CN1CCCc2ccccc2C1 ZINC000498913268 340025714 /nfs/dbraw/zinc/02/57/14/340025714.db2.gz FZGXTTJZAWVIRO-UHFFFAOYSA-N 0 1 322.452 4.197 20 0 DIADMN Cc1cccc2nc(CNC(=O)Nc3cccc(C(C)C)c3)[nH]c21 ZINC000498915133 340025752 /nfs/dbraw/zinc/02/57/52/340025752.db2.gz UMEUDFJBOPFEOV-UHFFFAOYSA-N 0 1 322.412 4.316 20 0 DIADMN c1c2ccccc2oc1[C@@H](N[C@@H]1CCCSC1)c1cccnc1 ZINC000498930360 340026351 /nfs/dbraw/zinc/02/63/51/340026351.db2.gz QLCZTGVWUAPLSM-APWZRJJASA-N 0 1 324.449 4.402 20 0 DIADMN Cc1ccc(NC(=O)[C@H](C)N2CCCc3ccccc3C2)c(C)c1 ZINC000498943580 340026773 /nfs/dbraw/zinc/02/67/73/340026773.db2.gz XTDBNUYYVYQBHR-KRWDZBQOSA-N 0 1 322.452 4.079 20 0 DIADMN c1c2ccccc2oc1[C@@H](NC[C@@H]1CCCS1)c1cccnc1 ZINC000498951411 340026973 /nfs/dbraw/zinc/02/69/73/340026973.db2.gz MCEJYGTTWYTGID-LPHOPBHVSA-N 0 1 324.449 4.402 20 0 DIADMN CC[C@H](C)c1ccc([C@@H](NC(=O)[C@H]2CCCN2C)C(C)C)cc1 ZINC000499224056 340032645 /nfs/dbraw/zinc/03/26/45/340032645.db2.gz VPGRZMSOLHKRKV-IPELMVKDSA-N 0 1 316.489 4.108 20 0 DIADMN COc1ccc(C2(NCc3cnc4ccccc4c3)CC2)cc1 ZINC000499608563 340040937 /nfs/dbraw/zinc/04/09/37/340040937.db2.gz VEVCNSSMBXWRNF-UHFFFAOYSA-N 0 1 304.393 4.022 20 0 DIADMN CC(C)n1nccc1CN1CCC(c2ccc(Cl)cc2)CC1 ZINC000499637543 340041899 /nfs/dbraw/zinc/04/18/99/340041899.db2.gz QNBQYCYOULGSJK-UHFFFAOYSA-N 0 1 317.864 4.497 20 0 DIADMN CCc1cc(C(=O)N(C)[C@@H](c2ccccc2Cl)C(C)C)n[nH]1 ZINC000499710085 340043228 /nfs/dbraw/zinc/04/32/28/340043228.db2.gz CQKLLNMQOYNGDM-MRXNPFEDSA-N 0 1 319.836 4.095 20 0 DIADMN CCOC(=O)c1csc([C@H]2CCCN2C[C@H](C)CC(C)C)n1 ZINC000499717386 340043366 /nfs/dbraw/zinc/04/33/66/340043366.db2.gz GOLLCTYKCPKROG-UKRRQHHQSA-N 0 1 324.490 4.139 20 0 DIADMN CC(C)c1nc(CN(Cc2ccccn2)C(C)C)c2ccccn21 ZINC000516574654 340050001 /nfs/dbraw/zinc/05/00/01/340050001.db2.gz REPMRSKFSYVKRU-UHFFFAOYSA-N 0 1 322.456 4.263 20 0 DIADMN FC1(c2ccc(Cl)cc2)CCN(Cc2cccnc2)CC1 ZINC000500158238 340051617 /nfs/dbraw/zinc/05/16/17/340051617.db2.gz XBRIDUNLZOMZOZ-UHFFFAOYSA-N 0 1 304.796 4.196 20 0 DIADMN Cn1nccc1[C@H]1CCCCN1Cc1ccc(C(F)(F)F)cc1 ZINC000500384159 340056247 /nfs/dbraw/zinc/05/62/47/340056247.db2.gz NHEQNNSMYFWPLG-MRXNPFEDSA-N 0 1 323.362 4.166 20 0 DIADMN COc1ccccc1CN[C@@]1(c2ccc(Cl)cc2)C[C@@H]1C ZINC000500396650 340056620 /nfs/dbraw/zinc/05/66/20/340056620.db2.gz KKIYNRANHICLNO-UGSOOPFHSA-N 0 1 301.817 4.374 20 0 DIADMN COc1ccc(CN[C@]2(c3ccc(Cl)cc3)C[C@H]2C)cc1O ZINC000500402149 340056942 /nfs/dbraw/zinc/05/69/42/340056942.db2.gz YMCKMSPPZXAUJR-KZULUSFZSA-N 0 1 317.816 4.079 20 0 DIADMN CCc1ncc(CN[C@]2(c3ccc(Cl)cc3)C[C@H]2C)s1 ZINC000500405398 340057089 /nfs/dbraw/zinc/05/70/89/340057089.db2.gz RDHUOYFGPWGHMN-BDJLRTHQSA-N 0 1 306.862 4.384 20 0 DIADMN Cn1nccc1[C@H]1CCCCN1C/C=C/c1ccc(Cl)cc1 ZINC000500446006 340058901 /nfs/dbraw/zinc/05/89/01/340058901.db2.gz JOLBFSXLUSKYAJ-SHCNBLLESA-N 0 1 315.848 4.314 20 0 DIADMN Cc1cc(C)c(NC(=O)CN2CCC[C@@H]2CC(C)C)c(Cl)c1 ZINC000500456105 340059474 /nfs/dbraw/zinc/05/94/74/340059474.db2.gz IPVHVNIGQBTBLK-OAHLLOKOSA-N 0 1 322.880 4.406 20 0 DIADMN C[C@@H]1C[C@]1(NCc1cnn2ccccc12)c1ccc(Cl)cc1 ZINC000500463724 340059590 /nfs/dbraw/zinc/05/95/90/340059590.db2.gz QLLALODNUAAVLQ-FZKQIMNGSA-N 0 1 311.816 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CN(Cc1nc(C2CC2)no1)[C@@H]1CCCC[C@H]1c1ccccc1 ZINC000412001357 1045046278 /nfs/dbraw/zinc/04/62/78/1045046278.db2.gz YPYDGNCXOCYSJN-DLBZAZTESA-N 0 1 311.429 4.105 20 0 DIADMN C[C@@H]1CC(C)(C)C[C@@H]1N[C@H](c1ccn(C)n1)c1ccc(F)cc1 ZINC000446825612 1045046719 /nfs/dbraw/zinc/04/67/19/1045046719.db2.gz KBCTZBAUQHIARR-BVGQSLNGSA-N 0 1 315.436 4.063 20 0 DIADMN COC1([C@@H](C)NCc2ncc(-c3cccc(Cl)c3)o2)CCC1 ZINC000412020659 1045047583 /nfs/dbraw/zinc/04/75/83/1045047583.db2.gz LNGNTEQLCGLYDY-GFCCVEGCSA-N 0 1 320.820 4.042 20 0 DIADMN CCN(Cc1nnc(-c2cccc(Cl)c2)o1)C1CC(C)(C)C1 ZINC000412033046 1045048361 /nfs/dbraw/zinc/04/83/61/1045048361.db2.gz HXBVKJOCLSGUPN-UHFFFAOYSA-N 0 1 319.836 4.401 20 0 DIADMN CSC[C@H](CCO)Nc1c(C)c(C)nc2c(Cl)cccc21 ZINC000576274075 1045048769 /nfs/dbraw/zinc/04/87/69/1045048769.db2.gz WVVPLRHCHVPFNP-LBPRGKRZSA-N 0 1 324.877 4.031 20 0 DIADMN CCOc1ccc(CN[C@@H](CC(C)C)c2ccccn2)cc1F ZINC000152755781 1045049269 /nfs/dbraw/zinc/04/92/69/1045049269.db2.gz 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1045051291 /nfs/dbraw/zinc/05/12/91/1045051291.db2.gz RRFQBFUJCCBPPC-UHFFFAOYSA-N 0 1 316.489 4.260 20 0 DIADMN C[C@@H](CN[C@@H](C)c1csnn1)c1ccc(C(F)(F)F)cc1 ZINC000412040985 1045051601 /nfs/dbraw/zinc/05/16/01/1045051601.db2.gz MZIIMTFJHSNXKK-UWVGGRQHSA-N 0 1 315.364 4.011 20 0 DIADMN Cc1ccc2c(c1)[C@@H](NCc1cc(C)cc(Cl)n1)CCCO2 ZINC000374360117 1045053506 /nfs/dbraw/zinc/05/35/06/1045053506.db2.gz OZTLGCJLKFWTSA-INIZCTEOSA-N 0 1 316.832 4.355 20 0 DIADMN Cc1ccc2c(c1)[C@H](NCc1cc(C)cc(Cl)n1)CCCO2 ZINC000374360118 1045053779 /nfs/dbraw/zinc/05/37/79/1045053779.db2.gz OZTLGCJLKFWTSA-MRXNPFEDSA-N 0 1 316.832 4.355 20 0 DIADMN CC(=O)c1ccc2c(c1)CCN(CCCCC(F)(F)F)CC2 ZINC000374388344 1045054638 /nfs/dbraw/zinc/05/46/38/1045054638.db2.gz RXSOQENDHZZZET-UHFFFAOYSA-N 0 1 313.363 4.022 20 0 DIADMN CCO[C@H](CNCc1c(Cl)cccc1OC)c1ccccc1 ZINC000446854492 1045057472 /nfs/dbraw/zinc/05/74/72/1045057472.db2.gz ZHRGDYLZNJFGCN-GOSISDBHSA-N 0 1 319.832 4.216 20 0 DIADMN C[C@H](c1cc(Cl)ccc1Cl)N1[C@@H]2CC[C@H]1CC(O)C2 ZINC000153475299 1045057407 /nfs/dbraw/zinc/05/74/07/1045057407.db2.gz QGGJEVRHINRKJL-MDFVCYEDSA-N 0 1 300.229 4.042 20 0 DIADMN Cc1ncsc1CN[C@H](C)c1ccc(OCC2CC2)c(F)c1 ZINC000153448148 1045057611 /nfs/dbraw/zinc/05/76/11/1045057611.db2.gz CASJISXEJIPPCF-LLVKDONJSA-N 0 1 320.433 4.230 20 0 DIADMN C/C=C\c1ccc(NC2CCN(Cc3ccccn3)CC2)cc1 ZINC000576406487 1045057969 /nfs/dbraw/zinc/05/79/69/1045057969.db2.gz QQZGWRPSXNXCJB-DJWKRKHSSA-N 0 1 307.441 4.191 20 0 DIADMN Cc1nc2c(s1)[C@H](N[C@@H](C)c1ccc(F)cc1F)CCC2 ZINC000153572826 1045059251 /nfs/dbraw/zinc/05/92/51/1045059251.db2.gz OQIQTFNQWICLAK-LKFCYVNXSA-N 0 1 308.397 4.458 20 0 DIADMN Cc1cccc([C@H]2CCN([C@H](C)c3nc(C(C)(C)C)no3)C2)c1 ZINC000576547265 1045063418 /nfs/dbraw/zinc/06/34/18/1045063418.db2.gz FKAIVFGKHOAPTP-ZBFHGGJFSA-N 0 1 313.445 4.226 20 0 DIADMN C[C@@H]1C[C@@H]1c1ccc(CN[C@@H](c2ccccc2)[C@H]2CCOC2)o1 ZINC000374499123 1045065146 /nfs/dbraw/zinc/06/51/46/1045065146.db2.gz 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/nfs/dbraw/zinc/76/97/93/1045769793.db2.gz GJMUUVSLXUCRGN-OAHLLOKOSA-N 0 1 322.518 4.439 20 0 DIADMN C[C@H]1CCCC[C@@H]1C[N@@H+](CC(=O)[O-])Cc1ccc(Cl)cc1 ZINC000901590581 1045772207 /nfs/dbraw/zinc/77/22/07/1045772207.db2.gz MGFWQQCHUKTNSH-DZGCQCFKSA-N 0 1 309.837 4.053 20 0 DIADMN Cc1cc(C)c(/C=C/C[N@H+](C)Cc2ccc(C(=O)[O-])cc2)cc1C ZINC000901591074 1045772363 /nfs/dbraw/zinc/77/23/63/1045772363.db2.gz RHAKTNABFNWBLB-AATRIKPKSA-N 0 1 323.436 4.455 20 0 DIADMN CC1=C[C@@H](C)C[C@H](C[N@@H+](CC(=O)[O-])Cc2ccc(Cl)cc2)C1 ZINC000901590310 1045773001 /nfs/dbraw/zinc/77/30/01/1045773001.db2.gz HFFSIHZPCMSIMV-CJNGLKHVSA-N 0 1 321.848 4.219 20 0 DIADMN C[N@@H+](Cc1ccc(C(=O)[O-])cc1)[C@H]1CC[C@](C)(c2ccccc2)C1 ZINC000901591674 1045773244 /nfs/dbraw/zinc/77/32/44/1045773244.db2.gz DTEKEHAJDMAFMU-FPOVZHCZSA-N 0 1 323.436 4.327 20 0 DIADMN CC[N@@H+](CCC(=O)[O-])Cc1ccc(-c2cccc(Cl)c2)s1 ZINC000901604817 1045777111 /nfs/dbraw/zinc/77/71/11/1045777111.db2.gz CLFKOJDTRAOKDZ-UHFFFAOYSA-N 0 1 323.845 4.365 20 0 DIADMN O=C([O-])C[N@@H+](CCCC1CCCCC1)Cc1ccc(F)cc1 ZINC000901629297 1045780817 /nfs/dbraw/zinc/78/08/17/1045780817.db2.gz YOAPZCRHNXOPRV-UHFFFAOYSA-N 0 1 307.409 4.073 20 0 DIADMN COc1cc(C)c([C@@H](C)N[C@H](C)c2c(C)noc2C)cc1C ZINC000753663933 1045786930 /nfs/dbraw/zinc/78/69/30/1045786930.db2.gz NPFIIPVSBWVCGL-CHWSQXEVSA-N 0 1 302.418 4.329 20 0 DIADMN Fc1ccc([C@@H](NCCNc2ccccc2)c2ccccn2)cc1 ZINC000753676750 1045788354 /nfs/dbraw/zinc/78/83/54/1045788354.db2.gz YGHABEBOLSAISW-HXUWFJFHSA-N 0 1 321.399 4.012 20 0 DIADMN O=C([O-])c1ccc2c(c1)CC[N@H+](CCCC1CCCCC1)C2 ZINC000901670067 1045790141 /nfs/dbraw/zinc/79/01/41/1045790141.db2.gz ZZGWWADNQRRFAO-UHFFFAOYSA-N 0 1 301.430 4.103 20 0 DIADMN CCC[C@H](C[N@H+]1CCc2cc(C(=O)[O-])ccc2C1)c1ccccc1 ZINC000901669030 1045790355 /nfs/dbraw/zinc/79/03/55/1045790355.db2.gz MKZJWUHHQGDMFK-LJQANCHMSA-N 0 1 323.436 4.327 20 0 DIADMN C[C@@H](CCc1ccccc1)C[N@H+]1CCc2cc(C(=O)[O-])ccc2C1 ZINC000901669024 1045790942 /nfs/dbraw/zinc/79/09/42/1045790942.db2.gz MGYBZYJGGFWIJH-INIZCTEOSA-N 0 1 323.436 4.012 20 0 DIADMN CC[C@@H](C)C[C@H]([NH2+]Cc1ccc(Oc2ccccc2)o1)C(=O)[O-] ZINC000901681456 1045792809 /nfs/dbraw/zinc/79/28/09/1045792809.db2.gz KSFQRKAEAUEUDN-CJNGLKHVSA-N 0 1 317.385 4.051 20 0 DIADMN C[C@]1(C(=O)[O-])CCC[N@@H+](Cc2cc(-c3ccccc3)cs2)C1 ZINC000901699194 1045795944 /nfs/dbraw/zinc/79/59/44/1045795944.db2.gz MQSAEXROBRNNIR-SFHVURJKSA-N 0 1 315.438 4.102 20 0 DIADMN C[C@@]1(C(=O)[O-])CCC[N@@H+](Cc2cc(-c3ccccc3)cs2)C1 ZINC000901699191 1045795979 /nfs/dbraw/zinc/79/59/79/1045795979.db2.gz MQSAEXROBRNNIR-GOSISDBHSA-N 0 1 315.438 4.102 20 0 DIADMN CCC/C=C\C(=O)N1CCC[C@@H]1c1nc2ccc(Cl)cc2[nH]1 ZINC000753729366 1045796904 /nfs/dbraw/zinc/79/69/04/1045796904.db2.gz FPESFYCPVNLDFX-IJVDHGTGSA-N 0 1 317.820 4.236 20 0 DIADMN CCC/C=C\C(=O)N1CCC[C@H]1c1nc2ccc(Cl)cc2[nH]1 ZINC000753729369 1045797385 /nfs/dbraw/zinc/79/73/85/1045797385.db2.gz FPESFYCPVNLDFX-QZDDGCDVSA-N 0 1 317.820 4.236 20 0 DIADMN CC(C)(C)C(=O)CCN1CCCC[C@@H]1c1nc2ccccc2o1 ZINC000753744987 1045798418 /nfs/dbraw/zinc/79/84/18/1045798418.db2.gz BJMZMHMSWSTGGW-OAHLLOKOSA-N 0 1 314.429 4.360 20 0 DIADMN CC(C)COc1ccccc1CNCc1ccc(C(F)F)nc1 ZINC000631049519 1045803685 /nfs/dbraw/zinc/80/36/85/1045803685.db2.gz ZHRHKJQYVQAUDZ-UHFFFAOYSA-N 0 1 320.383 4.344 20 0 DIADMN CC(C)COc1cccc(CNCc2ccc(C(F)F)nc2)c1 ZINC000631051921 1045804496 /nfs/dbraw/zinc/80/44/96/1045804496.db2.gz YITMIJBJAPLQQI-UHFFFAOYSA-N 0 1 320.383 4.344 20 0 DIADMN CCS[C@H]1CC[C@@H](N(C)Cc2nc(Cl)ccc2Cl)C1 ZINC000753917064 1045819114 /nfs/dbraw/zinc/81/91/14/1045819114.db2.gz DKKMPLBQZIZLJV-MNOVXSKESA-N 0 1 319.301 4.494 20 0 DIADMN CC(C)c1nc([C@@H](C)NCc2oc3ccccc3c2Cl)n[nH]1 ZINC000631102787 1045819917 /nfs/dbraw/zinc/81/99/17/1045819917.db2.gz WCQFRLUNJWVCIY-SNVBAGLBSA-N 0 1 318.808 4.179 20 0 DIADMN C[C@@H]1C[C@@H](NCc2ccc(C(F)F)nc2)c2ccccc2O1 ZINC000631147318 1045825290 /nfs/dbraw/zinc/82/52/90/1045825290.db2.gz MAAUHMLKQQUBCV-IAQYHMDHSA-N 0 1 304.340 4.021 20 0 DIADMN C[C@@H]1CCCC[C@H]1C[N@@H+](CCCC(=O)[O-])Cc1ccccc1 ZINC000901802386 1045825754 /nfs/dbraw/zinc/82/57/54/1045825754.db2.gz IRQMIDAGADULIP-AEFFLSMTSA-N 0 1 303.446 4.180 20 0 DIADMN Clc1ccc(OCCCCCCNCc2cocn2)cc1 ZINC000192344929 1045825933 /nfs/dbraw/zinc/82/59/33/1045825933.db2.gz BXNSNXMVTLCGGT-UHFFFAOYSA-N 0 1 308.809 4.057 20 0 DIADMN Cc1ccc2oc(CNCc3ccnn3CC3CCC3)cc2c1 ZINC000631175100 1045828054 /nfs/dbraw/zinc/82/80/54/1045828054.db2.gz STHKKBXEIRLJOA-UHFFFAOYSA-N 0 1 309.413 4.028 20 0 DIADMN O=C([O-])[C@@]1(c2ccccc2)CC[N@@H+](CCCC2CCCCC2)C1 ZINC000901827857 1045831887 /nfs/dbraw/zinc/83/18/87/1045831887.db2.gz KFVDOKSHSWRAHM-FQEVSTJZSA-N 0 1 315.457 4.075 20 0 DIADMN Cc1scc(CNCc2nc3ccc(Cl)cc3n2C)c1C ZINC000631208074 1045834961 /nfs/dbraw/zinc/83/49/61/1045834961.db2.gz ZQPPRPCHGZKGSR-UHFFFAOYSA-N 0 1 319.861 4.195 20 0 DIADMN CC(C)C[N@@H+](Cc1ccc2c(c1)CCCC2)CC(C)(C)C(=O)[O-] ZINC000901838006 1045837809 /nfs/dbraw/zinc/83/78/09/1045837809.db2.gz GHQSMPNJTNFRCH-UHFFFAOYSA-N 0 1 317.473 4.134 20 0 DIADMN CN(C)c1cc(CN2CCCC[C@H]2c2ccc(F)cc2)ccn1 ZINC000754050170 1045841503 /nfs/dbraw/zinc/84/15/03/1045841503.db2.gz IIGYUPLNZMCHHG-SFHVURJKSA-N 0 1 313.420 4.014 20 0 DIADMN C[C@H](NC(=O)[C@@H]1CCC(C)(C)C1)c1nc2ccc(Cl)cc2[nH]1 ZINC000781649084 1045843392 /nfs/dbraw/zinc/84/33/92/1045843392.db2.gz OFFAGQHJLLNPBZ-WDEREUQCSA-N 0 1 319.836 4.220 20 0 DIADMN Cc1ccccc1[C@@H](C)NCc1cnc([C@H]2CCCO2)s1 ZINC000631248778 1045844384 /nfs/dbraw/zinc/84/43/84/1045844384.db2.gz YCHJBHNULCQJHH-CZUORRHYSA-N 0 1 302.443 4.154 20 0 DIADMN CCCn1c(CNCc2cccc3[nH]ccc32)nc2ccccc21 ZINC000631306512 1045847618 /nfs/dbraw/zinc/84/76/18/1045847618.db2.gz HJPJZRYUMYNLFX-UHFFFAOYSA-N 0 1 318.424 4.217 20 0 DIADMN Clc1c2ccccc2sc1CN[C@@H]1CCCn2nccc21 ZINC000631301280 1045849189 /nfs/dbraw/zinc/84/91/89/1045849189.db2.gz OVVSKKDEHMLIFM-GFCCVEGCSA-N 0 1 317.845 4.376 20 0 DIADMN Cc1ccc(-c2nc(CN3CC[C@@H]3Cc3ccccc3)co2)cc1 ZINC000531472459 1045852316 /nfs/dbraw/zinc/85/23/16/1045852316.db2.gz OYNMWERQBJKJQF-HXUWFJFHSA-N 0 1 318.420 4.467 20 0 DIADMN Cc1ccccc1CN(Cc1nc2ccccc2nc1C)C1CC1 ZINC000520175049 1045856855 /nfs/dbraw/zinc/85/68/55/1045856855.db2.gz RBVQLOAPVFZTRR-UHFFFAOYSA-N 0 1 317.436 4.411 20 0 DIADMN CC[C@@H]1CCCC[C@H]1C[N@H+]1C[C@H](C(=O)[O-])[C@@H](c2ccccc2)C1 ZINC000901892005 1045866496 /nfs/dbraw/zinc/86/64/96/1045866496.db2.gz ZKPGNFRJMYTVKW-LULLPPNCSA-N 0 1 315.457 4.003 20 0 DIADMN CCC[C@@H](NCc1ccc(N2CCCC2)nc1)c1cc(C)ccn1 ZINC000631565323 1045866870 /nfs/dbraw/zinc/86/68/70/1045866870.db2.gz HSPCVFXXFMOTGJ-GOSISDBHSA-N 0 1 324.472 4.016 20 0 DIADMN CC[C@H](N[C@H]1CCCc2occc21)c1cccc(OC)c1OC ZINC000631567154 1045870985 /nfs/dbraw/zinc/87/09/85/1045870985.db2.gz VBKSLBXDTGXJAT-HOTGVXAUSA-N 0 1 315.413 4.415 20 0 DIADMN COc1ccc(C2(NCc3cnc(C(C)C)s3)CC2)cc1 ZINC000531564443 1045871645 /nfs/dbraw/zinc/87/16/45/1045871645.db2.gz GLZMDHHEMNZJQX-UHFFFAOYSA-N 0 1 302.443 4.054 20 0 DIADMN CC1(C)CCC[C@@H](C[N@H+]2CCc3c(F)ccc(C(=O)[O-])c3C2)C1 ZINC000901919928 1045874337 /nfs/dbraw/zinc/87/43/37/1045874337.db2.gz HEDSAESALPCXPD-CYBMUJFWSA-N 0 1 319.420 4.098 20 0 DIADMN Fc1ccc2c(c1)[C@@H](N[C@@H]1CCCc3ncccc31)CCCO2 ZINC000631576435 1045875660 /nfs/dbraw/zinc/87/56/60/1045875660.db2.gz IIRGAAASGKSJLD-MSOLQXFVSA-N 0 1 312.388 4.102 20 0 DIADMN CSc1ccc(F)cc1CN[C@@H]1CCCc2ncccc21 ZINC000631586466 1045878233 /nfs/dbraw/zinc/87/82/33/1045878233.db2.gz VJHYQEKRRFEPSZ-MRXNPFEDSA-N 0 1 302.418 4.110 20 0 DIADMN CC[C@H](N[C@@H](C)c1cnccc1C)c1cccc(OC)c1OC ZINC000631588855 1045880294 /nfs/dbraw/zinc/88/02/94/1045880294.db2.gz FXUTZDSLGGUEPO-YOEHRIQHSA-N 0 1 314.429 4.209 20 0 DIADMN CC(C)[N@@H+](CCC(=O)[O-])Cc1ccc(Cl)c(C(F)(F)F)c1 ZINC000901977978 1045881080 /nfs/dbraw/zinc/88/10/80/1045881080.db2.gz CGMHNLKBITWCEF-UHFFFAOYSA-N 0 1 323.742 4.044 20 0 DIADMN CC[C@@H](C)[N@@H+](CC(=O)[O-])Cc1ccc(-c2ccc(Cl)cc2)o1 ZINC000901989532 1045883382 /nfs/dbraw/zinc/88/33/82/1045883382.db2.gz RTUGMZXMINUIHA-GFCCVEGCSA-N 0 1 321.804 4.285 20 0 DIADMN CC(C)c1ccc(CC[N@H+]2CCc3ccccc3[C@@H]2C(=O)[O-])cc1 ZINC000901989948 1045884392 /nfs/dbraw/zinc/88/43/92/1045884392.db2.gz OBXSQHZONKHWCA-HXUWFJFHSA-N 0 1 323.436 4.037 20 0 DIADMN CCCC1(C(=O)N2CCC[C@@H]2c2nc3ccc(C)cc3[nH]2)CC1 ZINC000531600031 1045884155 /nfs/dbraw/zinc/88/41/55/1045884155.db2.gz JUDUOSRQAMVQHC-MRXNPFEDSA-N 0 1 311.429 4.115 20 0 DIADMN C[C@]1(c2ccccc2)CC[C@H]([N@H+]2CCCC[C@H]2CCC(=O)[O-])C1 ZINC000901996074 1045885532 /nfs/dbraw/zinc/88/55/32/1045885532.db2.gz DUIVNJOJNIDDCX-BJLQDIEVSA-N 0 1 315.457 4.216 20 0 DIADMN O=C([O-])CC[C@H]1CCCC[N@H+]1Cc1ccc(-c2ccccc2)o1 ZINC000901998038 1045886511 /nfs/dbraw/zinc/88/65/11/1045886511.db2.gz RFMBHJFBEOZUHK-MRXNPFEDSA-N 0 1 313.397 4.166 20 0 DIADMN Fc1ccc(C2(N[C@@H]3CCCc4ncccc43)CCC2)c(F)c1 ZINC000631611912 1045887977 /nfs/dbraw/zinc/88/79/77/1045887977.db2.gz PQKGSAWSFRZPNT-GOSISDBHSA-N 0 1 314.379 4.406 20 0 DIADMN CC[C@H](NCc1cscc1C)c1cccc(OC)c1OC ZINC000631622931 1045888769 /nfs/dbraw/zinc/88/87/69/1045888769.db2.gz RTBZIXOQXRGQSF-HNNXBMFYSA-N 0 1 305.443 4.315 20 0 DIADMN O=C([O-])C[C@H]1CCC[N@H+]1Cc1ccc(-c2ccc(Cl)cc2)o1 ZINC000902010022 1045888825 /nfs/dbraw/zinc/88/88/25/1045888825.db2.gz LNEVRIQQCDILJR-CQSZACIVSA-N 0 1 319.788 4.039 20 0 DIADMN C[C@@H]1CC[N@@H+](Cc2cccc(C3CCCC3)c2)[C@H](C(=O)[O-])C1 ZINC000902013713 1045890181 /nfs/dbraw/zinc/89/01/81/1045890181.db2.gz YITOJLAOXRTAOX-KDOFPFPSSA-N 0 1 301.430 4.029 20 0 DIADMN CCCCCC(C)(C)C(=O)N[C@H](C)c1n[nH]c([C@H](C)CC)n1 ZINC000754425955 1045890434 /nfs/dbraw/zinc/89/04/34/1045890434.db2.gz NSDKWUNAGXXELS-CHWSQXEVSA-N 0 1 308.470 4.102 20 0 DIADMN C[C@@H]1CCC[C@H](C[N@H+]2[C@H](C(=O)[O-])CC[C@H]2c2ccccc2)C1 ZINC000902044718 1045895457 /nfs/dbraw/zinc/89/54/57/1045895457.db2.gz ARVNTDZNGLIHAL-FZCLSBEQSA-N 0 1 301.430 4.103 20 0 DIADMN C[C@@H]1CCCC[C@@H]1C[N@H+]1[C@H](C(=O)[O-])CC[C@H]1c1ccccc1 ZINC000902047775 1045896761 /nfs/dbraw/zinc/89/67/61/1045896761.db2.gz 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311.772 4.252 20 0 DIADMN Cc1nc2c(s1)[C@@H](N[C@@H](C)c1ccc(Cl)cn1)CCC2 ZINC000775545662 1049138076 /nfs/dbraw/zinc/13/80/76/1049138076.db2.gz DBDWCHKMVDBHES-ZANVPECISA-N 0 1 307.850 4.228 20 0 DIADMN Cc1c2ccccc2oc1[C@H](C)NCC(=O)Nc1cccc(C)c1 ZINC000484998250 1049138307 /nfs/dbraw/zinc/13/83/07/1049138307.db2.gz OYWKAHATSOSSCC-HNNXBMFYSA-N 0 1 322.408 4.339 20 0 DIADMN Cc1cc([C@H]2CCCCN2C(=O)[C@H](C)CC2CCCCC2)n[nH]1 ZINC001179159484 1049138361 /nfs/dbraw/zinc/13/83/61/1049138361.db2.gz IFUCPAAAVBTVTQ-RDTXWAMCSA-N 0 1 317.477 4.378 20 0 DIADMN Cc1ccc2ccccc2c1NC(=O)c1ccc(O)c(F)c1F ZINC001192818908 1049139363 /nfs/dbraw/zinc/13/93/63/1049139363.db2.gz SSYKGLJCJIGSNW-UHFFFAOYSA-N 0 1 313.303 4.384 20 0 DIADMN CCOc1ccc(Cl)cc1CNCc1cccc(OC)c1C ZINC001179211139 1049141217 /nfs/dbraw/zinc/14/12/17/1049141217.db2.gz URDHTCVLQFVXML-UHFFFAOYSA-N 0 1 319.832 4.346 20 0 DIADMN CC(C)Cc1ccc(CN2CC=C(c3ccc(O)cc3)CC2)cn1 ZINC001204322716 1049142911 /nfs/dbraw/zinc/14/29/11/1049142911.db2.gz 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C[C@H]1C[C@H]1c1noc(-c2cc(-c3ccc4ccccc4c3)n[nH]2)n1 ZINC000904821544 1049154739 /nfs/dbraw/zinc/15/47/39/1049154739.db2.gz MCCJJLBDSAUEEU-XHDPSFHLSA-N 0 1 316.364 4.403 20 0 DIADMN CO[C@@H](CN1CCc2c(Cl)cc(Cl)cc2[C@H]1C)C1CC1 ZINC001204400241 1049155254 /nfs/dbraw/zinc/15/52/54/1049155254.db2.gz DJRLXUCGUIQZOO-HWPZZCPQSA-N 0 1 314.256 4.338 20 0 DIADMN Cc1ncc([C@@H](C)NCc2cnc(-c3ccsc3)s2)s1 ZINC001179333150 1049157294 /nfs/dbraw/zinc/15/72/94/1049157294.db2.gz RCNFBBMJXREAIP-SECBINFHSA-N 0 1 321.496 4.487 20 0 DIADMN Cc1ccc(OC2CCN(Cc3cccn3C3CC3)CC2)cc1 ZINC001204410618 1049157484 /nfs/dbraw/zinc/15/74/84/1049157484.db2.gz FXFPUKYZVMCKJN-UHFFFAOYSA-N 0 1 310.441 4.175 20 0 DIADMN FC(F)(F)Oc1cccc(CN(Cc2ccco2)C2CC2)c1 ZINC001204434903 1049162586 /nfs/dbraw/zinc/16/25/86/1049162586.db2.gz ZGYWHQAYHPLABC-UHFFFAOYSA-N 0 1 311.303 4.343 20 0 DIADMN C[C@@H](NCc1nccc2ccccc21)c1cc2cnccc2o1 ZINC001179429512 1049162942 /nfs/dbraw/zinc/16/29/42/1049162942.db2.gz CYAPRMXSHPXNJX-CYBMUJFWSA-N 0 1 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/nfs/dbraw/zinc/17/01/79/1049170179.db2.gz SABFOQQDHDUFNU-CYBMUJFWSA-N 0 1 324.321 4.229 20 0 DIADMN Cc1cc(CNc2nc3ccc(Br)cc3[nH]2)cs1 ZINC001179484045 1049170756 /nfs/dbraw/zinc/17/07/56/1049170756.db2.gz AECSAPFLRFUWLQ-UHFFFAOYSA-N 0 1 322.231 4.307 20 0 DIADMN CC[C@H]1CCC[C@H](CNc2nc3cc(OC)c(OC)cc3[nH]2)C1 ZINC001179478863 1049171200 /nfs/dbraw/zinc/17/12/00/1049171200.db2.gz HFHVSZHDIVWCFK-STQMWFEESA-N 0 1 317.433 4.208 20 0 DIADMN COc1cc(C)ccc1CNc1nc2ccc(Cl)cc2[nH]1 ZINC001179516053 1049172895 /nfs/dbraw/zinc/17/28/95/1049172895.db2.gz PWDHEMRRWPOBQL-UHFFFAOYSA-N 0 1 301.777 4.145 20 0 DIADMN Clc1n[nH]c(C2CC2)c1CNc1nc2ccc(Cl)cc2[nH]1 ZINC001179516235 1049172938 /nfs/dbraw/zinc/17/29/38/1049172938.db2.gz VHSLMMXHSQQPLE-UHFFFAOYSA-N 0 1 322.199 4.082 20 0 DIADMN CCCn1c(CNc2ccc3c(n2)CCCC3)nc2ccccc21 ZINC001179516530 1049173166 /nfs/dbraw/zinc/17/31/66/1049173166.db2.gz ZYFVGMRLVXGJQT-UHFFFAOYSA-N 0 1 320.440 4.332 20 0 DIADMN C[C@@H](c1ccccc1Cl)N(C)Cc1ccc2c(c1)CCO2 ZINC001204494078 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CCC(CC)n1ccc(CN(CCOC)C[C@@H]2CC=CCC2)n1 ZINC000485140655 1049192109 /nfs/dbraw/zinc/19/21/09/1049192109.db2.gz IGFLOJYHZMREMX-QGZVFWFLSA-N 0 1 319.493 4.049 20 0 DIADMN COc1c(Cl)cccc1CNCc1cccc2ccoc21 ZINC001179690867 1049192639 /nfs/dbraw/zinc/19/26/39/1049192639.db2.gz PEIIHMJOCOYENA-UHFFFAOYSA-N 0 1 301.773 4.385 20 0 DIADMN CSc1cccc(NC(=O)c2c(O)cccc2Cl)c1C ZINC000775588970 1049193928 /nfs/dbraw/zinc/19/39/28/1049193928.db2.gz ULOPYKFLWRDDJS-UHFFFAOYSA-N 0 1 307.802 4.328 20 0 DIADMN Cc1nc[nH]c1CN1CC[C@@H](c2ccc(Cl)c(Cl)c2)C1 ZINC001204591227 1049194652 /nfs/dbraw/zinc/19/46/52/1049194652.db2.gz XZPHNQVUUFXECC-GFCCVEGCSA-N 0 1 310.228 4.014 20 0 DIADMN Cc1nc[nH]c1CN1CCC(Sc2ccc(Cl)cc2)CC1 ZINC001204592773 1049194975 /nfs/dbraw/zinc/19/49/75/1049194975.db2.gz QUBLJDHDPDMLCM-UHFFFAOYSA-N 0 1 321.877 4.128 20 0 DIADMN [O-]c1cccc(C[N@@H+]2CC[C@H](Cc3ccccc3)C2)c1Cl ZINC001204585645 1049195063 /nfs/dbraw/zinc/19/50/63/1049195063.db2.gz VRYXNGOJMKOWNM-OAHLLOKOSA-N 0 1 301.817 4.110 20 0 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Fc1cccc(CN2CC[C@@H](c3ccco3)C2)c1Br ZINC001204866423 1049289768 /nfs/dbraw/zinc/28/97/68/1049289768.db2.gz MZGKTMSZAYHYIZ-LLVKDONJSA-N 0 1 324.193 4.171 20 0 DIADMN Fc1ccc(CN(Cc2ccnn2C2CCC2)CC2CC2)cc1 ZINC001180124801 1049292021 /nfs/dbraw/zinc/29/20/21/1049292021.db2.gz LFDYGDMPLUQDEW-UHFFFAOYSA-N 0 1 313.420 4.159 20 0 DIADMN Cc1scc(CN2CCO[C@@H](c3ccccc3C)C2)c1C ZINC001180120323 1049293255 /nfs/dbraw/zinc/29/32/55/1049293255.db2.gz HGIIRLDVLFXSIP-GOSISDBHSA-N 0 1 301.455 4.247 20 0 DIADMN C[C@H](NC1(c2cccc(F)c2)CC1)c1cnn(-c2ccccc2)c1 ZINC000777059367 1049294625 /nfs/dbraw/zinc/29/46/25/1049294625.db2.gz PXBGMCMIDBSENK-HNNXBMFYSA-N 0 1 321.399 4.351 20 0 DIADMN COc1ccccc1C[C@@H](C)N(C)Cc1cscc1Cl ZINC001180184477 1049296729 /nfs/dbraw/zinc/29/67/29/1049296729.db2.gz QBJVFORRRVJZRQ-GFCCVEGCSA-N 0 1 309.862 4.473 20 0 DIADMN CC1(C)CC(CN2CCCC[C@@H]2C(=O)OCc2ccccc2)C1 ZINC001194010697 1049298046 /nfs/dbraw/zinc/29/80/46/1049298046.db2.gz YGCIIVIZEQZUCK-GOSISDBHSA-N 0 1 315.457 4.021 20 0 DIADMN CC1(C)CC(CN2CCCC[C@H]2C(=O)OCc2ccccc2)C1 ZINC001194010698 1049298492 /nfs/dbraw/zinc/29/84/92/1049298492.db2.gz YGCIIVIZEQZUCK-SFHVURJKSA-N 0 1 315.457 4.021 20 0 DIADMN CN[C@H](c1nc(-c2ccc(Cl)cc2Cl)no1)C(C)(C)C ZINC001204887916 1049298720 /nfs/dbraw/zinc/29/87/20/1049298720.db2.gz CIERGVJPPBUQDR-LLVKDONJSA-N 0 1 314.216 4.350 20 0 DIADMN CC[C@@H](NC1(c2ccccc2F)CC1)c1ccc2c(c1)CCO2 ZINC000777062498 1049299189 /nfs/dbraw/zinc/29/91/89/1049299189.db2.gz XVXQJPVPDNZFMM-GOSISDBHSA-N 0 1 311.400 4.491 20 0 DIADMN Cc1ccc(-c2cnc([C@@H]3CCCCN3)nc2)cc1C(F)(F)F ZINC000906177787 1049299495 /nfs/dbraw/zinc/29/94/95/1049299495.db2.gz AAOMCUXMEMLXMA-HNNXBMFYSA-N 0 1 321.346 4.285 20 0 DIADMN CCN(Cc1ccc(C(F)(F)F)cc1)Cc1c(C)ccnc1N ZINC001180158631 1049302357 /nfs/dbraw/zinc/30/23/57/1049302357.db2.gz YVWSCSZAJTXRKF-UHFFFAOYSA-N 0 1 323.362 4.013 20 0 DIADMN FC(F)(F)c1cc(CN2CCC[C@H]2CC2CCCCC2)[nH]n1 ZINC001180170611 1049304614 /nfs/dbraw/zinc/30/46/14/1049304614.db2.gz PGCYMNWDFOVEEV-AWEZNQCLSA-N 0 1 315.383 4.363 20 0 DIADMN CC(C)c1cccc2c1CC[N@@H+](Cc1cccc3nsnc31)C2 ZINC001194041420 1049305739 /nfs/dbraw/zinc/30/57/39/1049305739.db2.gz COAVEZUVOYCCTR-UHFFFAOYSA-N 0 1 323.465 4.373 20 0 DIADMN CC(C)c1cccc2c1CCN(Cc1cccc3nsnc31)C2 ZINC001194041420 1049305747 /nfs/dbraw/zinc/30/57/47/1049305747.db2.gz COAVEZUVOYCCTR-UHFFFAOYSA-N 0 1 323.465 4.373 20 0 DIADMN Cc1ccc2ncc(CN3CCOC4(CCCCC4)C3)cc2c1 ZINC001194066344 1049311572 /nfs/dbraw/zinc/31/15/72/1049311572.db2.gz HVGKLUXHYURWTB-UHFFFAOYSA-N 0 1 310.441 4.078 20 0 DIADMN CC[C@H](C)[C@@H](C)N(Cc1cccnc1Br)C1CC1 ZINC001180189732 1049311927 /nfs/dbraw/zinc/31/19/27/1049311927.db2.gz VOOIRMWABZMLCT-NWDGAFQWSA-N 0 1 311.267 4.243 20 0 DIADMN COc1ccc(CN(C)Cc2cccc3cccnc32)c(F)c1 ZINC001204927958 1049313241 /nfs/dbraw/zinc/31/32/41/1049313241.db2.gz AIMNLRMGOQMNOK-UHFFFAOYSA-N 0 1 310.372 4.015 20 0 DIADMN C[C@@H](CCC1CCCC1)NCc1cc(COC(C)(C)C)on1 ZINC000485690793 1049315252 /nfs/dbraw/zinc/31/52/52/1049315252.db2.gz CDEIBYYTKDPJCX-AWEZNQCLSA-N 0 1 308.466 4.438 20 0 DIADMN CCOc1cc(C)ccc1CNCc1cc(F)cc(Cl)c1 ZINC000485711047 1049319704 /nfs/dbraw/zinc/31/97/04/1049319704.db2.gz IKWQJDQOVXHOKY-UHFFFAOYSA-N 0 1 307.796 4.476 20 0 DIADMN Cn1nc(CN[C@@H](c2ccccc2)C2CCCC2)cc1Cl ZINC000859190569 1049319897 /nfs/dbraw/zinc/31/98/97/1049319897.db2.gz ULVNWSIWDSPNBG-KRWDZBQOSA-N 0 1 303.837 4.095 20 0 DIADMN CCN(Cc1cc(F)ccc1N(C)C)[C@@H](C)c1cccc(O)c1 ZINC001180240004 1049320008 /nfs/dbraw/zinc/32/00/08/1049320008.db2.gz RRSNUTNEXMZLIW-AWEZNQCLSA-N 0 1 316.420 4.180 20 0 DIADMN CCCn1cc(CN(CC)[C@@H](C)c2cccc(OC)c2)c(C)n1 ZINC001180240020 1049320045 /nfs/dbraw/zinc/32/00/45/1049320045.db2.gz RWOGOWLRYFNRRX-INIZCTEOSA-N 0 1 315.461 4.193 20 0 DIADMN CCCN(Cc1cnn(CC2CCC2)c1)Cc1ccc(F)cc1 ZINC001180249010 1049321983 /nfs/dbraw/zinc/32/19/83/1049321983.db2.gz AKRJJGYHASWEHF-UHFFFAOYSA-N 0 1 315.436 4.235 20 0 DIADMN CCC[C@H](C)N(C)Cc1ccc(OC)cc1Br ZINC001180275921 1049322853 /nfs/dbraw/zinc/32/28/53/1049322853.db2.gz YLXUIOVMVVKWJO-NSHDSACASA-N 0 1 300.240 4.078 20 0 DIADMN Cc1ccccc1[C@H](NCc1cc(Cl)n(C)n1)C(C)(C)C ZINC000859235577 1049323382 /nfs/dbraw/zinc/32/33/82/1049323382.db2.gz SYSLDVILQKEMGL-INIZCTEOSA-N 0 1 305.853 4.259 20 0 DIADMN Cc1cc(CN2CCOC[C@@H]2CC(C)C)ccc1C(F)(F)F ZINC001180272104 1049325323 /nfs/dbraw/zinc/32/53/23/1049325323.db2.gz ZWKIHVNSHRQTAR-HNNXBMFYSA-N 0 1 315.379 4.261 20 0 DIADMN CC(C)n1cc2c(n1)[C@H](NCc1cccc3cc[nH]c31)CCC2 ZINC000780765031 1049326090 /nfs/dbraw/zinc/32/60/90/1049326090.db2.gz UWFXHKJGRBFGSQ-QGZVFWFLSA-N 0 1 308.429 4.113 20 0 DIADMN Fc1ccc([C@H]2CCCN(Cc3ncccc3F)CC2)cc1 ZINC001204969556 1049326023 /nfs/dbraw/zinc/32/60/23/1049326023.db2.gz ZYERCJLEODZTRF-AWEZNQCLSA-N 0 1 302.368 4.130 20 0 DIADMN Cc1nnc([C@H](C)NC[C@H](C)CSc2ccccc2C)s1 ZINC000859253604 1049326115 /nfs/dbraw/zinc/32/61/15/1049326115.db2.gz ZRUVBYDYXFAUNC-AAEUAGOBSA-N 0 1 321.515 4.234 20 0 DIADMN Fc1cc(CN2CCC(c3ccnc4ccccc43)CC2)ccn1 ZINC000859322057 1049328797 /nfs/dbraw/zinc/32/87/97/1049328797.db2.gz FPGBHOVIVOYPGC-UHFFFAOYSA-N 0 1 321.399 4.149 20 0 DIADMN COc1ccc(CN(C)Cc2cc(F)c(F)c(F)c2)c(C)c1 ZINC001204976348 1049329330 /nfs/dbraw/zinc/32/93/30/1049329330.db2.gz PSHQSJXKVYDTRB-UHFFFAOYSA-N 0 1 309.331 4.053 20 0 DIADMN CC[C@@H]1CN(Cc2ccc(C(F)(F)F)cc2C)C[C@H](C)O1 ZINC001180279556 1049334949 /nfs/dbraw/zinc/33/49/49/1049334949.db2.gz BSVPEKILFPAIST-SWLSCSKDSA-N 0 1 301.352 4.013 20 0 DIADMN Cc1ccc2c(c1)C[N@H+](CCc1nsc3ccccc31)CCO2 ZINC001194230425 1049337246 /nfs/dbraw/zinc/33/72/46/1049337246.db2.gz CWBCMNSBJQJADM-UHFFFAOYSA-N 0 1 324.449 4.042 20 0 DIADMN Cc1ccc2c(c1)CN(CCc1nsc3ccccc31)CCO2 ZINC001194230425 1049337257 /nfs/dbraw/zinc/33/72/57/1049337257.db2.gz CWBCMNSBJQJADM-UHFFFAOYSA-N 0 1 324.449 4.042 20 0 DIADMN Cc1ccc2c(c1)C[N@H+](CCc1ccc(Cl)cc1)CCO2 ZINC001194230627 1049337896 /nfs/dbraw/zinc/33/78/96/1049337896.db2.gz FNEGAGLCNOTWQM-UHFFFAOYSA-N 0 1 301.817 4.086 20 0 DIADMN Cc1cc(CN[C@H](c2ccccn2)C2CCC2)cc(Cl)n1 ZINC000859568299 1049339554 /nfs/dbraw/zinc/33/95/54/1049339554.db2.gz TZDWUQVYUWUZDI-KRWDZBQOSA-N 0 1 301.821 4.069 20 0 DIADMN Clc1cc(CN[C@@H](c2ccccn2)C2CCC2)cc(Cl)n1 ZINC000859563326 1049339746 /nfs/dbraw/zinc/33/97/46/1049339746.db2.gz RAIMGDZUNNJTRX-MRXNPFEDSA-N 0 1 322.239 4.414 20 0 DIADMN Fc1cccc2c1OCCC[C@@H]2NCc1cccn1C(F)F ZINC001180345503 1049342678 /nfs/dbraw/zinc/34/26/78/1049342678.db2.gz XMPHCVSULMDTNS-AWEZNQCLSA-N 0 1 310.319 4.026 20 0 DIADMN CCCCCCOC(=O)Nc1c(C)c(=O)[nH]n1-c1ccccc1 ZINC001194206957 1049343067 /nfs/dbraw/zinc/34/30/67/1049343067.db2.gz WOSWXRWBHKNQIG-UHFFFAOYSA-N 0 1 317.389 4.015 20 0 DIADMN CC[C@H](NCc1cc(C)c(C(=O)OC)o1)c1ccc(C)c(F)c1 ZINC001205017479 1049344861 /nfs/dbraw/zinc/34/48/61/1049344861.db2.gz XVYSYFAOKHDKFO-INIZCTEOSA-N 0 1 319.376 4.063 20 0 DIADMN CO[C@@H](CC(C)C)CN(Cc1ccco1)Cc1ccccc1 ZINC001205024478 1049345995 /nfs/dbraw/zinc/34/59/95/1049345995.db2.gz YOIQZPPUXXPZFR-IBGZPJMESA-N 0 1 301.430 4.343 20 0 DIADMN CC(C)c1ccccc1CN1CCN(c2ccccc2F)CC1 ZINC001180375319 1049346597 /nfs/dbraw/zinc/34/65/97/1049346597.db2.gz PIPUQLGWRMOIHK-UHFFFAOYSA-N 0 1 312.432 4.271 20 0 DIADMN Cc1ccc(F)cc1CN(C)Cc1ccccc1N1CCCC1 ZINC001205024020 1049346884 /nfs/dbraw/zinc/34/68/84/1049346884.db2.gz NEWFQFFSKSCAHQ-UHFFFAOYSA-N 0 1 312.432 4.366 20 0 DIADMN CC[C@@H](C)C[N@@H+](C)Cc1ccc(-c2ccccc2C(=O)[O-])o1 ZINC000859786315 1049349457 /nfs/dbraw/zinc/34/94/57/1049349457.db2.gz RYVSILDWGINZTK-CYBMUJFWSA-N 0 1 301.386 4.123 20 0 DIADMN CCc1ccccc1CN(C)Cc1ccc(Br)o1 ZINC001180394913 1049351063 /nfs/dbraw/zinc/35/10/63/1049351063.db2.gz ZKGRODWNKLAHGB-UHFFFAOYSA-N 0 1 308.219 4.237 20 0 DIADMN CCc1cccnc1[C@H](C)NCc1ccc(-c2cnco2)cc1 ZINC000906524018 1049351272 /nfs/dbraw/zinc/35/12/72/1049351272.db2.gz BTKDHVFBYHZNDJ-AWEZNQCLSA-N 0 1 307.397 4.150 20 0 DIADMN CCCOc1ccc(CN2CCN(c3ccccc3)CC2)cc1C ZINC001205046857 1049351716 /nfs/dbraw/zinc/35/17/16/1049351716.db2.gz VUJFJIKNLIHMRF-UHFFFAOYSA-N 0 1 324.468 4.106 20 0 DIADMN Cc1c([C@H](C)NCc2ccc(-c3cnco3)cc2)cnn1C(C)C ZINC000906525791 1049351883 /nfs/dbraw/zinc/35/18/83/1049351883.db2.gz OXGJLBSTJPONOS-AWEZNQCLSA-N 0 1 324.428 4.278 20 0 DIADMN Cc1ncsc1CCCN1CC[C@@H]1c1ccc(Cl)cc1 ZINC001194268726 1049355028 /nfs/dbraw/zinc/35/50/28/1049355028.db2.gz IYZMVKFXIHIYNM-OAHLLOKOSA-N 0 1 306.862 4.485 20 0 DIADMN Clc1cccc(CCN2CCC[C@@H]2[C@@H]2CCCO2)c1Cl ZINC001194306873 1049356334 /nfs/dbraw/zinc/35/63/34/1049356334.db2.gz MTKPXSJGPLLHSJ-CABCVRRESA-N 0 1 314.256 4.179 20 0 DIADMN OCC[C@@H]1CCCCCN1Cc1cc(Cl)ccc1Cl ZINC001194307521 1049356675 /nfs/dbraw/zinc/35/66/75/1049356675.db2.gz SJLLKSIURBWCME-AWEZNQCLSA-N 0 1 302.245 4.120 20 0 DIADMN CCCCCN(CCCCC)Cc1nc(Br)c[nH]1 ZINC001180438025 1049358356 /nfs/dbraw/zinc/35/83/56/1049358356.db2.gz UJDASBUOUHCGFJ-UHFFFAOYSA-N 0 1 316.287 4.355 20 0 DIADMN CC(C)(O)[C@@H]1CCCN1Cc1cccc(C(F)(F)F)c1Cl ZINC001205056141 1049358219 /nfs/dbraw/zinc/35/82/19/1049358219.db2.gz RFXSEOPOJBLTMX-LBPRGKRZSA-N 0 1 321.770 4.094 20 0 DIADMN Cc1ccccc1OCCN(C)Cc1ccc(CC(C)C)nc1 ZINC001180444510 1049358487 /nfs/dbraw/zinc/35/84/87/1049358487.db2.gz HGMYZYJQRBYJEW-UHFFFAOYSA-N 0 1 312.457 4.099 20 0 DIADMN CCCCCN(Cc1cnc(Cl)n1C)Cc1ccc(F)cc1 ZINC001180422305 1049361426 /nfs/dbraw/zinc/36/14/26/1049361426.db2.gz HUULUZLULUVWJY-UHFFFAOYSA-N 0 1 323.843 4.405 20 0 DIADMN CN(Cc1ccc(-c2cccc(F)c2F)o1)CC1=CCCOC1 ZINC000668568364 1049365436 /nfs/dbraw/zinc/36/54/36/1049365436.db2.gz CZEQCFZBHLJQFV-UHFFFAOYSA-N 0 1 319.351 4.003 20 0 DIADMN CC(=O)CCN(Cc1cccs1)Cc1ccc2[nH]ccc2c1 ZINC000860067255 1049369122 /nfs/dbraw/zinc/36/91/22/1049369122.db2.gz GYHPPCFYISVMJQ-UHFFFAOYSA-N 0 1 312.438 4.211 20 0 DIADMN CCOc1ccc(CN2CCC[C@@H]2c2cccc(OC)c2)o1 ZINC001180514921 1049369453 /nfs/dbraw/zinc/36/94/53/1049369453.db2.gz WVZLMAFOZAYYMH-QGZVFWFLSA-N 0 1 301.386 4.024 20 0 DIADMN CC[C@@H](C)N(Cc1cn2cccc(F)c2n1)Cc1ccccc1 ZINC001205093687 1049373743 /nfs/dbraw/zinc/37/37/43/1049373743.db2.gz JUNMYDAGSCNVQV-OAHLLOKOSA-N 0 1 311.404 4.274 20 0 DIADMN CC(C)CCc1nc(CN[C@H]2C[C@@H](OC(C)C)C2(C)C)cs1 ZINC001194445779 1049378279 /nfs/dbraw/zinc/37/82/79/1049378279.db2.gz LGGPCRFHOSPSSA-JKSUJKDBSA-N 0 1 324.534 4.413 20 0 DIADMN CN(Cc1ccc(F)c(Cl)c1)C[C@H]1OCCc2ccccc21 ZINC001194487049 1049383048 /nfs/dbraw/zinc/38/30/48/1049383048.db2.gz BLTCMDOUHYUVPV-GOSISDBHSA-N 0 1 319.807 4.225 20 0 DIADMN CO[C@@H](CN[C@@H]1CCCc2cn(C(C)C)nc21)C1CCCCC1 ZINC001180613436 1049384185 /nfs/dbraw/zinc/38/41/85/1049384185.db2.gz PNXFOJDWGYINDG-MSOLQXFVSA-N 0 1 319.493 4.026 20 0 DIADMN Cc1ccccc1-c1cccc(NC(=O)[C@H](C)N2CCCC2)c1 ZINC001180583765 1049386297 /nfs/dbraw/zinc/38/62/97/1049386297.db2.gz RWUAILUQXYPTNC-INIZCTEOSA-N 0 1 308.425 4.085 20 0 DIADMN COc1ccc(Cl)c(CN2CC[C@@H](c3ccccc3F)C2)c1 ZINC001194598646 1049394846 /nfs/dbraw/zinc/39/48/46/1049394846.db2.gz CZQPFMOXUGPUGP-CYBMUJFWSA-N 0 1 319.807 4.477 20 0 DIADMN COCCN(Cc1cccs1)Cc1ccc(Cl)cc1C ZINC001205162601 1049398753 /nfs/dbraw/zinc/39/87/53/1049398753.db2.gz PYLVVUAHGKBDHC-UHFFFAOYSA-N 0 1 309.862 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Cc1nc(CN2CC[C@H](c3ccccc3Cl)C2)ccc1F ZINC001237818368 1055538229 /nfs/dbraw/zinc/53/82/29/1055538229.db2.gz RISISOQLUDZYRA-ZDUSSCGKSA-N 0 1 304.796 4.172 20 0 DIADMN C[C@H](NCC1=CCCOC1)c1cc(Cl)cc(Cl)c1F ZINC000692387313 1055550291 /nfs/dbraw/zinc/55/02/91/1055550291.db2.gz BUNIOPCTZYVFAJ-VIFPVBQESA-N 0 1 304.192 4.130 20 0 DIADMN CN(C/C=C/c1ccccc1)Cc1cccc(-c2ccccn2)n1 ZINC001237838125 1055539152 /nfs/dbraw/zinc/53/91/52/1055539152.db2.gz QHEACTKMOJLBMU-DHZHZOJOSA-N 0 1 315.420 4.289 20 0 DIADMN C[C@@H]1Cc2ccccc2CN1Cc1cccc(-c2ccccn2)n1 ZINC001237835797 1055541207 /nfs/dbraw/zinc/54/12/07/1055541207.db2.gz IXTQMWFQHZUWDK-MRXNPFEDSA-N 0 1 315.420 4.090 20 0 DIADMN COc1cccc(CN2CCC23CCCCC3)c1Br ZINC001237856633 1055544108 /nfs/dbraw/zinc/54/41/08/1055544108.db2.gz FRCQBLXHZJMNKZ-UHFFFAOYSA-N 0 1 324.262 4.366 20 0 DIADMN Fc1cc(-c2ccco2)ccc1CNCc1cccc2n[nH]cc21 ZINC001620924644 1055544595 /nfs/dbraw/zinc/54/45/95/1055544595.db2.gz FESXMLRKMLYSAE-UHFFFAOYSA-N 0 1 321.355 4.252 20 0 DIADMN CCCCN(CC)Cc1cccc(OC)c1Br ZINC001237862988 1055545452 /nfs/dbraw/zinc/54/54/52/1055545452.db2.gz QJUFRODJKBQIRV-UHFFFAOYSA-N 0 1 300.240 4.080 20 0 DIADMN Cc1cc(N2CCCCCC2)ccc1NCc1ccc(=O)[nH]c1 ZINC001620931864 1055547120 /nfs/dbraw/zinc/54/71/20/1055547120.db2.gz NRMPAOPZDHIVDU-UHFFFAOYSA-N 0 1 311.429 4.088 20 0 DIADMN CCOC(=O)c1ccccc1CN1CCC[C@@H]1c1cccs1 ZINC001237887348 1055550397 /nfs/dbraw/zinc/55/03/97/1055550397.db2.gz RLAYWISQAKVYGP-MRXNPFEDSA-N 0 1 315.438 4.262 20 0 DIADMN Cc1cc(CN[C@@H]2CCc3cc(F)c(F)c(F)c32)ccc1F ZINC001620938024 1055551100 /nfs/dbraw/zinc/55/11/00/1055551100.db2.gz JTPPDGMUYUGFFH-CQSZACIVSA-N 0 1 309.306 4.329 20 0 DIADMN CCCOc1cc(F)ccc1CN(C)Cc1ccc(OC)cc1 ZINC001237906218 1055553832 /nfs/dbraw/zinc/55/38/32/1055553832.db2.gz LZCJTNILPNGEFX-UHFFFAOYSA-N 0 1 317.404 4.255 20 0 DIADMN CCOc1cc(F)cc(CN(CC)Cc2cccc(OC)c2)c1 ZINC001237918707 1055557775 /nfs/dbraw/zinc/55/77/75/1055557775.db2.gz ARIOISSELSYPCW-UHFFFAOYSA-N 0 1 317.404 4.255 20 0 DIADMN CCn1c(CN[C@@H]2CCCc3sccc32)nc2ccccc21 ZINC000387286814 1055558070 /nfs/dbraw/zinc/55/80/70/1055558070.db2.gz LDDZRYNEPMOHGN-CQSZACIVSA-N 0 1 311.454 4.285 20 0 DIADMN CC(C)(C)c1ccc(NC(=O)c2cccc3nc[nH]c32)cc1F ZINC001593662282 1055559738 /nfs/dbraw/zinc/55/97/38/1055559738.db2.gz KONPTKJTYYNQEQ-UHFFFAOYSA-N 0 1 311.360 4.252 20 0 DIADMN CN(Cc1ccc(COc2ccccc2)cc1)Cc1ccccn1 ZINC001237926723 1055560562 /nfs/dbraw/zinc/56/05/62/1055560562.db2.gz KKYKVJDMURRTHX-UHFFFAOYSA-N 0 1 318.420 4.293 20 0 DIADMN CCC[C@@H](CNCc1csc(-c2ccc(Cl)cc2)n1)OC ZINC001620949286 1055562601 /nfs/dbraw/zinc/56/26/01/1055562601.db2.gz JIMPWTBZEBTGPY-HNNXBMFYSA-N 0 1 324.877 4.368 20 0 DIADMN Cc1cccc(CCN(C)Cc2cnc(C(F)(F)F)s2)c1 ZINC001237947689 1055563048 /nfs/dbraw/zinc/56/30/48/1055563048.db2.gz SSIXBQYQUMSPPK-UHFFFAOYSA-N 0 1 314.376 4.145 20 0 DIADMN CCc1ccc(CNC/C=C/c2ccc(Br)cc2)o1 ZINC001620948793 1055563311 /nfs/dbraw/zinc/56/33/11/1055563311.db2.gz QTKJAFRAZIOXBO-ONEGZZNKSA-N 0 1 320.230 4.408 20 0 DIADMN C[C@H](NCCSc1ccncc1)c1c(F)cccc1Cl ZINC001168552607 1055565676 /nfs/dbraw/zinc/56/56/76/1055565676.db2.gz HERCKYRGXLHUPL-NSHDSACASA-N 0 1 310.825 4.317 20 0 DIADMN CC/C=C\CNCc1c(C)nn(Cc2ccc(C)cc2)c1Cl ZINC001620950738 1055567570 /nfs/dbraw/zinc/56/75/70/1055567570.db2.gz LMWXUUJGOMNJLU-WAYWQWQTSA-N 0 1 317.864 4.257 20 0 DIADMN Fc1cccc(-c2nc(CN(CC3CC3)C3CC3)cs2)c1 ZINC001237971542 1055568215 /nfs/dbraw/zinc/56/82/15/1055568215.db2.gz AQJGMROEMHSHST-UHFFFAOYSA-N 0 1 302.418 4.324 20 0 DIADMN CCCC1(CCC)CCCN1C(=O)c1cc(F)cc(F)c1O ZINC001594586246 1055569053 /nfs/dbraw/zinc/56/90/53/1055569053.db2.gz JRBYQQWTEAIRCB-UHFFFAOYSA-N 0 1 311.372 4.245 20 0 DIADMN CC(C)c1cc([C@H]2CCCN(C(=O)C=C3CCCCC3)C2)n[nH]1 ZINC001594671824 1055571861 /nfs/dbraw/zinc/57/18/61/1055571861.db2.gz VNGDOXYHVQFRIS-INIZCTEOSA-N 0 1 315.461 4.130 20 0 DIADMN [O-]c1c(F)cc(C[N@H+]2CC[C@@H](c3ccccc3)C2)cc1Cl ZINC001237984499 1055573464 /nfs/dbraw/zinc/57/34/64/1055573464.db2.gz QKAPNHKHRKDJHB-CQSZACIVSA-N 0 1 305.780 4.174 20 0 DIADMN Clc1cccc(-c2nc(CN3C[C@H]4CC[C@@H]3C4)cs2)c1 ZINC001237989567 1055576373 /nfs/dbraw/zinc/57/63/73/1055576373.db2.gz VDVVWRHPIGUPHM-XHDPSFHLSA-N 0 1 304.846 4.448 20 0 DIADMN Cc1cc(C)n(CCN[C@H](C)c2ccc(Cl)cc2Cl)n1 ZINC000387391734 1055576714 /nfs/dbraw/zinc/57/67/14/1055576714.db2.gz KGDXYFLXPCWNRI-GFCCVEGCSA-N 0 1 312.244 4.158 20 0 DIADMN CC1(C)CN(Cc2[nH]nc3cc(Cl)ccc32)CCC1(F)F ZINC001237993750 1055577210 /nfs/dbraw/zinc/57/72/10/1055577210.db2.gz QSYODZFOENUWJN-UHFFFAOYSA-N 0 1 313.779 4.084 20 0 DIADMN CC(C)N(CCCO)Cc1csc(-c2cccc(Cl)c2)n1 ZINC001237987756 1055578021 /nfs/dbraw/zinc/57/80/21/1055578021.db2.gz MYVXKERHBGEHFM-UHFFFAOYSA-N 0 1 324.877 4.056 20 0 DIADMN CN(Cc1n[nH]c2cc(Cl)ccc21)Cc1ccc(F)cc1F ZINC001238003736 1055579574 /nfs/dbraw/zinc/57/95/74/1055579574.db2.gz KUTHTFVKWQXBRW-UHFFFAOYSA-N 0 1 321.758 4.127 20 0 DIADMN CN(C/C=C/c1ccccc1)Cc1[nH]nc2cc(Cl)ccc21 ZINC001238002729 1055581001 /nfs/dbraw/zinc/58/10/01/1055581001.db2.gz DNJAVLUYQVYRAZ-VMPITWQZSA-N 0 1 311.816 4.362 20 0 DIADMN Cc1c2cc(F)ccc2oc1CNCc1cnn(C2CCC2)c1 ZINC000921595670 1055581013 /nfs/dbraw/zinc/58/10/13/1055581013.db2.gz HKJVULFEAQUPMX-UHFFFAOYSA-N 0 1 313.376 4.092 20 0 DIADMN C[N@@H+](Cc1ccc(F)cc1)Cc1ccccc1Oc1cnccn1 ZINC001238016990 1055584245 /nfs/dbraw/zinc/58/42/45/1055584245.db2.gz NHOZNJHRYJKSCC-UHFFFAOYSA-N 0 1 323.371 4.040 20 0 DIADMN CN(Cc1ccc(F)cc1)Cc1ccccc1Oc1cnccn1 ZINC001238016990 1055584254 /nfs/dbraw/zinc/58/42/54/1055584254.db2.gz NHOZNJHRYJKSCC-UHFFFAOYSA-N 0 1 323.371 4.040 20 0 DIADMN c1ccc([C@@H]2CC[N@@H+]2Cc2ccccc2Oc2cnccn2)cc1 ZINC001238020957 1055585036 /nfs/dbraw/zinc/58/50/36/1055585036.db2.gz XRSIDHCSJXHSIS-SFHVURJKSA-N 0 1 317.392 4.216 20 0 DIADMN c1ccc([C@@H]2CCN2Cc2ccccc2Oc2cnccn2)cc1 ZINC001238020957 1055585049 /nfs/dbraw/zinc/58/50/49/1055585049.db2.gz XRSIDHCSJXHSIS-SFHVURJKSA-N 0 1 317.392 4.216 20 0 DIADMN FC1CC2(C1)CCC[N@@H+](Cc1cncc(Cl)c1Cl)CC2 ZINC001238011374 1055585417 /nfs/dbraw/zinc/58/54/17/1055585417.db2.gz 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/nfs/dbraw/zinc/60/18/73/1055601873.db2.gz WNCJEECLYVRKQC-FQEVSTJZSA-N 0 1 315.457 4.011 20 0 DIADMN Cc1cc(CN(C)Cc2cnc3ccccn23)cc(C)c1Cl ZINC001238088082 1055603534 /nfs/dbraw/zinc/60/35/34/1055603534.db2.gz DGXZMGMHWXBCDU-UHFFFAOYSA-N 0 1 313.832 4.237 20 0 DIADMN CCOC(=O)C[C@H]1CCCN(Cc2cc(C)c(Cl)c(C)c2)C1 ZINC001238090884 1055606142 /nfs/dbraw/zinc/60/61/42/1055606142.db2.gz SGWOUPSTPFTEKU-OAHLLOKOSA-N 0 1 323.864 4.122 20 0 DIADMN Cc1cc(CN(CCO)Cc2cccs2)cc(C)c1Cl ZINC001238090166 1055606189 /nfs/dbraw/zinc/60/61/89/1055606189.db2.gz GFPLXFMLHUHZIF-UHFFFAOYSA-N 0 1 309.862 4.013 20 0 DIADMN CCOC(=O)C[C@@H]1CCCN(Cc2cc(C)c(Cl)c(C)c2)C1 ZINC001238090883 1055606864 /nfs/dbraw/zinc/60/68/64/1055606864.db2.gz SGWOUPSTPFTEKU-HNNXBMFYSA-N 0 1 323.864 4.122 20 0 DIADMN C[C@H]1c2ccccc2CCN1Cc1cc(Cl)c(O)cc1F ZINC001238143599 1055611233 /nfs/dbraw/zinc/61/12/33/1055611233.db2.gz OGPBCLIEGHGPGH-NSHDSACASA-N 0 1 305.780 4.304 20 0 DIADMN Cc1cc(C(=O)[O-])ccc1C[N@H+]1CCC[C@@H]1c1ccc(F)cc1 ZINC001238135918 1055611751 /nfs/dbraw/zinc/61/17/51/1055611751.db2.gz DPDYFUIKUAHIIK-GOSISDBHSA-N 0 1 313.372 4.169 20 0 DIADMN Cc1cc(C(=O)[O-])ccc1C[N@H+]1CCC[C@H]1c1ccc(F)cc1 ZINC001238135919 1055611960 /nfs/dbraw/zinc/61/19/60/1055611960.db2.gz DPDYFUIKUAHIIK-SFHVURJKSA-N 0 1 313.372 4.169 20 0 DIADMN C[N@@H+](CC/C=C/c1cccnc1)Cc1cc(Cl)c([O-])cc1F ZINC001238149632 1055612054 /nfs/dbraw/zinc/61/20/54/1055612054.db2.gz KAONUHONVOADFE-GORDUTHDSA-N 0 1 320.795 4.115 20 0 DIADMN Cc1cc(C(=O)[O-])ccc1C[N@H+]1CCC[C@H](Cc2ccccc2)C1 ZINC001238137766 1055612207 /nfs/dbraw/zinc/61/22/07/1055612207.db2.gz COTFBBCRUASVEX-GOSISDBHSA-N 0 1 323.436 4.148 20 0 DIADMN Oc1cc(F)c(CN2CCCC[C@H]2C(F)(F)F)cc1Cl ZINC001238147666 1055612236 /nfs/dbraw/zinc/61/22/36/1055612236.db2.gz AEKXCXVRIZSDAH-LBPRGKRZSA-N 0 1 311.706 4.102 20 0 DIADMN Cc1cc(C(=O)[O-])ccc1C[N@H+]1CC[C@H](C2CCCCC2)C1 ZINC001238150529 1055613754 /nfs/dbraw/zinc/61/37/54/1055613754.db2.gz ZGERXMGDGBAVJS-SFHVURJKSA-N 0 1 301.430 4.095 20 0 DIADMN Cc1ncncc1CN1CCC(c2csc3ccccc32)CC1 ZINC001238172350 1055614957 /nfs/dbraw/zinc/61/49/57/1055614957.db2.gz FRPIJQJAIBEXGO-UHFFFAOYSA-N 0 1 323.465 4.379 20 0 DIADMN Cc1ccc(OC2CCN(Cc3cncc(C4CC4)c3)CC2)cc1 ZINC001238183964 1055615904 /nfs/dbraw/zinc/61/59/04/1055615904.db2.gz GLGJQWSLOZFRBG-UHFFFAOYSA-N 0 1 322.452 4.311 20 0 DIADMN COc1cccc([C@H]2CCCN2Cc2cncc(C3CC3)c2)c1 ZINC001238195179 1055617978 /nfs/dbraw/zinc/61/79/78/1055617978.db2.gz VQRHBPOJHYIWDT-HXUWFJFHSA-N 0 1 308.425 4.305 20 0 DIADMN CSc1cccc(NC(=O)c2cccc3nc(C)[nH]c32)c1C ZINC000338551647 1055618387 /nfs/dbraw/zinc/61/83/87/1055618387.db2.gz KHMDMOBFUHOBKL-UHFFFAOYSA-N 0 1 311.410 4.154 20 0 DIADMN C[C@@H]1CN(Cc2cccc(-c3cccs3)n2)CCC1(F)F ZINC001238208954 1055619752 /nfs/dbraw/zinc/61/97/52/1055619752.db2.gz KDUBGZJFLBZVEC-GFCCVEGCSA-N 0 1 308.397 4.287 20 0 DIADMN Cc1nc(C2CCN(Cc3ccc(Cl)c(C)c3C)CC2)no1 ZINC001238219853 1055621992 /nfs/dbraw/zinc/62/19/92/1055621992.db2.gz RQAXHJBGYXNDBU-UHFFFAOYSA-N 0 1 319.836 4.028 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COc1cc2[nH]c(-c3ccc(C(F)F)c(OC)c3)nc2cc1C ZINC001251565600 1061404188 /nfs/dbraw/zinc/40/41/88/1061404188.db2.gz DMAPQWVQWBKOPE-UHFFFAOYSA-N 0 1 318.323 4.493 20 0 DIADMN CN(C)c1ccc2nc(-c3ccc4nccc(Cl)c4c3)[nH]c2c1 ZINC001251566206 1061404509 /nfs/dbraw/zinc/40/45/09/1061404509.db2.gz PCFJTWNWWOZMJT-UHFFFAOYSA-N 0 1 322.799 4.498 20 0 DIADMN Oc1cc(F)cc(-c2nc3ccc(-c4ccncc4)cc3[nH]2)c1 ZINC001251570507 1061406496 /nfs/dbraw/zinc/40/64/96/1061406496.db2.gz UCVKJXCYKICKMI-UHFFFAOYSA-N 0 1 305.312 4.137 20 0 DIADMN C[C@H](CN(C)Cc1ccn(-c2ccccc2F)n1)C(C)(C)C ZINC001473778520 1061406514 /nfs/dbraw/zinc/40/65/14/1061406514.db2.gz CJWOSZWQSMRNKJ-CQSZACIVSA-N 0 1 303.425 4.125 20 0 DIADMN Fc1cc2[nH]c(-c3ccncc3C(F)(F)F)nc2cc1Cl ZINC001251570539 1061406872 /nfs/dbraw/zinc/40/68/72/1061406872.db2.gz WKWQPKQPXAUASN-UHFFFAOYSA-N 0 1 315.657 4.436 20 0 DIADMN COc1cc2nc(-c3cnc(-c4ccccc4)o3)[nH]c2cc1F ZINC001251586459 1061408148 /nfs/dbraw/zinc/40/81/48/1061408148.db2.gz CBOZYWPYDCJUSV-UHFFFAOYSA-N 0 1 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ZINC001473959250 1061502271 /nfs/dbraw/zinc/50/22/71/1061502271.db2.gz UFMKOQQOLRUZEB-UHFFFAOYSA-N 0 1 305.368 4.432 20 0 DIADMN c1sc(-c2nc3ccc(N4CCCC4)cc3[nH]2)nc1C1CC1 ZINC001251833424 1061503983 /nfs/dbraw/zinc/50/39/83/1061503983.db2.gz PTXMGTMNZPFTJT-UHFFFAOYSA-N 0 1 310.426 4.164 20 0 DIADMN Cc1cc(C)c(CNCc2c(Cl)n[nH]c2C2CC2)c(C)c1 ZINC001473963854 1061505860 /nfs/dbraw/zinc/50/58/60/1061505860.db2.gz VIOGMPMLTPJJHC-UHFFFAOYSA-N 0 1 303.837 4.156 20 0 DIADMN Fc1ccc(OCCCNCc2c(F)cccc2Cl)cc1 ZINC001473963850 1061507724 /nfs/dbraw/zinc/50/77/24/1061507724.db2.gz UVAAQDLHAVIWIS-UHFFFAOYSA-N 0 1 311.759 4.177 20 0 DIADMN Fc1ccc(CNCc2ccc(CC(F)(F)F)cc2)c(F)c1 ZINC001473965999 1061509976 /nfs/dbraw/zinc/50/99/76/1061509976.db2.gz WVXILVMPRRAKHC-UHFFFAOYSA-N 0 1 315.285 4.359 20 0 DIADMN COc1ccc(-c2nc3ccc(-c4ccncc4)cc3[nH]2)nc1C ZINC001251854244 1061510859 /nfs/dbraw/zinc/51/08/59/1061510859.db2.gz YCNPDHSFWCZZOT-UHFFFAOYSA-N 0 1 316.364 4.004 20 0 DIADMN COc1ccc(-c2nc3cc(C)c(C(F)(F)F)cc3[nH]2)nc1C ZINC001251854110 1061511009 /nfs/dbraw/zinc/51/10/09/1061511009.db2.gz QBXCMPNNMQEAPQ-UHFFFAOYSA-N 0 1 321.302 4.269 20 0 DIADMN CCOc1cc(OC)ccc1-c1nc2cc(Cl)c(F)cc2[nH]1 ZINC001251857015 1061512338 /nfs/dbraw/zinc/51/23/38/1061512338.db2.gz NOPLCYHKJDCDNJ-UHFFFAOYSA-N 0 1 320.751 4.430 20 0 DIADMN Cc1nc(C)c(C(=O)Oc2ccc3oc4ccccc4c3c2)[nH]1 ZINC001463751738 1061516084 /nfs/dbraw/zinc/51/60/84/1061516084.db2.gz BEZQSOXZJKTHEN-UHFFFAOYSA-N 0 1 306.321 4.145 20 0 DIADMN COc1cc(-c2nc3ccc(F)c(C)c3[nH]2)cc2c1OCC=C2 ZINC001251872467 1061519536 /nfs/dbraw/zinc/51/95/36/1061519536.db2.gz HKMOMTNFXOFOTO-UHFFFAOYSA-N 0 1 310.328 4.092 20 0 DIADMN COc1cc(-c2nc3c(cc(F)cc3C)[nH]2)cc2c1OCC=C2 ZINC001251872879 1061519583 /nfs/dbraw/zinc/51/95/83/1061519583.db2.gz XENAOYJGFYMCHB-UHFFFAOYSA-N 0 1 310.328 4.092 20 0 DIADMN Cc1cc(C)cc([C@H](C)NCc2cn3cc(Cl)ccc3n2)c1 ZINC001473984730 1061525630 /nfs/dbraw/zinc/52/56/30/1061525630.db2.gz VSLURQRAQWFUOJ-AWEZNQCLSA-N 0 1 313.832 4.455 20 0 DIADMN CCOc1ccc(Cl)cc1CN[C@@H]1CCc2c1cccc2O ZINC001473989671 1061532721 /nfs/dbraw/zinc/53/27/21/1061532721.db2.gz GACUWKNORXYDJM-MRXNPFEDSA-N 0 1 317.816 4.221 20 0 DIADMN CCN(Cc1ccccc1)C(=O)c1cccc(C(F)(F)F)c1O ZINC001463897357 1061533299 /nfs/dbraw/zinc/53/32/99/1061533299.db2.gz SXDSFCMADFPANF-UHFFFAOYSA-N 0 1 323.314 4.073 20 0 DIADMN CC[C@@H](C)c1ccc([C@H](NC(=O)c2[nH]ncc2F)C(C)C)cc1 ZINC001463962208 1061540044 /nfs/dbraw/zinc/54/00/44/1061540044.db2.gz NZQTYRPIOXMHMH-MLGOLLRUSA-N 0 1 317.408 4.189 20 0 DIADMN CCN(c1ccc(NC(=O)c2c(O)cccc2F)cc1)C(C)C ZINC001463965823 1061540110 /nfs/dbraw/zinc/54/01/10/1061540110.db2.gz GFTJHEAHPZZRCA-UHFFFAOYSA-N 0 1 316.376 4.018 20 0 DIADMN Fc1cccc(/C=C/CNC2(c3nccs3)CCCC2)c1 ZINC001474001813 1061541385 /nfs/dbraw/zinc/54/13/85/1061541385.db2.gz AIRQDHLRPSMKEU-GQCTYLIASA-N 0 1 302.418 4.355 20 0 DIADMN Cc1cc2sc(NC[C@H](c3ccco3)N(C)C)nc2c(C)c1 ZINC001458055059 1061548609 /nfs/dbraw/zinc/54/86/09/1061548609.db2.gz 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1061565975 /nfs/dbraw/zinc/56/59/75/1061565975.db2.gz JHPIMDNAMJYUSF-OAHLLOKOSA-N 0 1 317.820 4.164 20 0 DIADMN Nc1c(Cl)cccc1CN[C@H](c1ccc(F)cc1F)C1CC1 ZINC001474030264 1061572970 /nfs/dbraw/zinc/57/29/70/1061572970.db2.gz YRASFJXWAPRNSE-KRWDZBQOSA-N 0 1 322.786 4.441 20 0 DIADMN CC[C@@H](CNCc1ncc(C(C)C)s1)Oc1ccccc1F ZINC001474039665 1061585741 /nfs/dbraw/zinc/58/57/41/1061585741.db2.gz HIJPNLVXIOOEHW-ZDUSSCGKSA-N 0 1 322.449 4.353 20 0 DIADMN O=C(c1cccc2[nH]cnc21)N(Cc1ccccc1)CC1CCC1 ZINC001464432486 1061593966 /nfs/dbraw/zinc/59/39/66/1061593966.db2.gz QLGLMZRMYGUGDY-UHFFFAOYSA-N 0 1 319.408 4.005 20 0 DIADMN Fc1ccccc1-c1ccc(CNCc2ccc3c(c2)COC3)o1 ZINC001474049143 1061594741 /nfs/dbraw/zinc/59/47/41/1061594741.db2.gz PNBNFLNWCFVSFN-UHFFFAOYSA-N 0 1 323.367 4.406 20 0 DIADMN CCc1oc2ccccc2c1CC(=O)Nc1ccc2nc[nH]c2c1 ZINC001464502266 1061599138 /nfs/dbraw/zinc/59/91/38/1061599138.db2.gz GATCAXPAXKUAEH-UHFFFAOYSA-N 0 1 319.364 4.053 20 0 DIADMN CCn1cnc(Cl)c1CN[C@H]1CC(C)(C)c2ccccc21 ZINC001474057135 1061603465 /nfs/dbraw/zinc/60/34/65/1061603465.db2.gz SOLKWIZWVPYCRX-AWEZNQCLSA-N 0 1 303.837 4.069 20 0 DIADMN Cc1cc(C)c(CNCc2cccc3c2OCCCO3)cc1C ZINC001474059809 1061606146 /nfs/dbraw/zinc/60/61/46/1061606146.db2.gz KTDAFQBRXXVIDA-UHFFFAOYSA-N 0 1 311.425 4.063 20 0 DIADMN Cc1cccc([C@@H](O)CNCc2cc(Cl)sc2Cl)c1 ZINC001474063906 1061610441 /nfs/dbraw/zinc/61/04/41/1061610441.db2.gz JYGIJXDUPFBCNG-LBPRGKRZSA-N 0 1 316.253 4.187 20 0 DIADMN Cc1[nH]nc(CNc2ccc(OCC(C)C)c(Cl)c2)c1C ZINC001474063250 1061611540 /nfs/dbraw/zinc/61/15/40/1061611540.db2.gz CFHHJMAWSUVUBH-UHFFFAOYSA-N 0 1 307.825 4.327 20 0 DIADMN CC[C@H](C)Oc1cc(C)ccc1CNCc1cccc(OC)c1 ZINC001474069227 1061617180 /nfs/dbraw/zinc/61/71/80/1061617180.db2.gz CGHQUVYSOKAIFS-INIZCTEOSA-N 0 1 313.441 4.471 20 0 DIADMN CCn1cnc(Cl)c1CN[C@@H](c1ccc(F)c(C)c1)C1CC1 ZINC001474074768 1061621072 /nfs/dbraw/zinc/62/10/72/1061621072.db2.gz BRFRWONHJXRCGZ-MRXNPFEDSA-N 0 1 321.827 4.245 20 0 DIADMN c1nc(C2CC2)c(CN2Cc3ccccc3C3(CCC3)C2)s1 ZINC000348677366 1061622484 /nfs/dbraw/zinc/62/24/84/1061622484.db2.gz UWOIHNVGDFYSQD-UHFFFAOYSA-N 0 1 310.466 4.458 20 0 DIADMN CCCCC[C@@H](NC(=O)CN1CCC(C)CC1)c1ccccc1 ZINC001464791833 1061633465 /nfs/dbraw/zinc/63/34/65/1061633465.db2.gz NTWBKUOSWZBQKC-LJQANCHMSA-N 0 1 316.489 4.156 20 0 DIADMN COc1nsc(CN[C@@H]2c3ccccc3CC[C@@H]2C)c1Cl ZINC001474087650 1061634103 /nfs/dbraw/zinc/63/41/03/1061634103.db2.gz ITBSOAZDBSVIBY-BONVTDFDSA-N 0 1 322.861 4.218 20 0 DIADMN Cc1ccc(F)cc1CN[C@H]1CCCOc2cc(F)ccc21 ZINC001474092652 1061639466 /nfs/dbraw/zinc/63/94/66/1061639466.db2.gz OUGBRJBSAVTRST-KRWDZBQOSA-N 0 1 303.352 4.277 20 0 DIADMN Fc1ccc2c(c1)OCCC[C@H]2NCc1ccc(Cl)cc1 ZINC001474093366 1061640400 /nfs/dbraw/zinc/64/04/00/1061640400.db2.gz RYWKEWDCDIAYOX-MRXNPFEDSA-N 0 1 305.780 4.483 20 0 DIADMN O[C@H](CNCc1cscc1Cl)c1ccc(Cl)c(F)c1 ZINC001474097817 1061643445 /nfs/dbraw/zinc/64/34/45/1061643445.db2.gz YKHMXJZCWPLYAA-CYBMUJFWSA-N 0 1 320.216 4.017 20 0 DIADMN C[C@]1(C[NH2+]Cc2cccc([O-])c2Cl)CCCc2ccccc21 ZINC001474098677 1061646238 /nfs/dbraw/zinc/64/62/38/1061646238.db2.gz LAVKIDDGCSLKCV-LJQANCHMSA-N 0 1 315.844 4.429 20 0 DIADMN CCN(CC)Cc1nnc(-c2ccc(Oc3ccccc3)cc2)o1 ZINC001252476467 1061647865 /nfs/dbraw/zinc/64/78/65/1061647865.db2.gz MPBNYXSTVMCDKE-UHFFFAOYSA-N 0 1 323.396 4.371 20 0 DIADMN Cc1cc(C)c(C=CCN[C@H](C)c2n[nH]c(C(C)C)n2)cc1C ZINC001474100317 1061647929 /nfs/dbraw/zinc/64/79/29/1061647929.db2.gz QSIBITDFZGOMNY-XITLMJRVSA-N 0 1 312.461 4.217 20 0 DIADMN CC(C)c1nc([C@H](C)NCc2cccc(CC3CCC3)c2)n[nH]1 ZINC001474100603 1061649087 /nfs/dbraw/zinc/64/90/87/1061649087.db2.gz VSSXKZVSVIWIBD-AWEZNQCLSA-N 0 1 312.461 4.122 20 0 DIADMN CCc1ccc2c(c1)[C@H](NCc1nccc3ccccc31)CCO2 ZINC001474104732 1061653786 /nfs/dbraw/zinc/65/37/86/1061653786.db2.gz AQIKCSVLYQCGMI-LJQANCHMSA-N 0 1 318.420 4.411 20 0 DIADMN Cc1ccc(CNCc2cc3ccccc3o2)c(N2CCCC2)n1 ZINC001474107786 1061656756 /nfs/dbraw/zinc/65/67/56/1061656756.db2.gz QTGFKTCZEYKUMJ-UHFFFAOYSA-N 0 1 321.424 4.026 20 0 DIADMN Cc1cc(C[C@@H](C)Nc2nc3c(cc(Cl)cc3F)s2)[nH]n1 ZINC001458257335 1061662053 /nfs/dbraw/zinc/66/20/53/1061662053.db2.gz AQKKMSLEFIBNCF-SSDOTTSWSA-N 0 1 324.812 4.163 20 0 DIADMN Fc1cccc(Cl)c1CNC[C@H]1CCC2(CCCCC2)O1 ZINC001474113282 1061661961 /nfs/dbraw/zinc/66/19/61/1061661961.db2.gz NLXLTTWSVFLJDZ-CYBMUJFWSA-N 0 1 311.828 4.451 20 0 DIADMN Cc1cnc(CNCC2(c3ccc(F)cc3Cl)CCCC2)o1 ZINC001474120429 1061671565 /nfs/dbraw/zinc/67/15/65/1061671565.db2.gz MCCJIFJBWPATFQ-UHFFFAOYSA-N 0 1 322.811 4.377 20 0 DIADMN Cc1ccc(-c2nnc(-c3nc4ccc(Cl)cc4[nH]3)o2)cc1 ZINC001252617487 1061679339 /nfs/dbraw/zinc/67/93/39/1061679339.db2.gz ZYBZWWATPKYHEY-UHFFFAOYSA-N 0 1 310.744 4.242 20 0 DIADMN [O-]c1cccc(C[NH2+]CCCc2cccc(Cl)c2)c1Cl ZINC001474132687 1061679685 /nfs/dbraw/zinc/67/96/85/1061679685.db2.gz RHOCHXFWTOGCFZ-UHFFFAOYSA-N 0 1 310.224 4.421 20 0 DIADMN Cc1ccc(-c2nnc(-c3cnc4[nH]ccc(Cl)c3-4)o2)cc1 ZINC001252625180 1061683110 /nfs/dbraw/zinc/68/31/10/1061683110.db2.gz SSPRGBBKXBVASP-UHFFFAOYSA-N 0 1 310.744 4.242 20 0 DIADMN COc1ccc2ccccc2c1CNc1ccc2c(n1)CCC2 ZINC001474150794 1061696155 /nfs/dbraw/zinc/69/61/55/1061696155.db2.gz ZVWCUHSAGOLSSA-UHFFFAOYSA-N 0 1 304.393 4.344 20 0 DIADMN Cc1csc(CNCc2ccc(Sc3ccccn3)o2)c1 ZINC001474151120 1061696274 /nfs/dbraw/zinc/69/62/74/1061696274.db2.gz ILZRJPIJHCTBHX-UHFFFAOYSA-N 0 1 316.451 4.486 20 0 DIADMN CCSc1cccc(NC(=O)c2ncc3ccccc3c2O)c1 ZINC001465211396 1061712315 /nfs/dbraw/zinc/71/23/15/1061712315.db2.gz GKNULJFTGFXCSP-UHFFFAOYSA-N 0 1 324.405 4.305 20 0 DIADMN Oc1cc(Cl)ccc1-c1nnc(-c2ccc(Cl)cc2)o1 ZINC001252782725 1061715878 /nfs/dbraw/zinc/71/58/78/1061715878.db2.gz YRZSJKGNVBTWKP-UHFFFAOYSA-N 0 1 307.136 4.416 20 0 DIADMN CC(C)C[C@@H]1CCCCCN1C(=O)c1cc(F)cc(F)c1O ZINC001465275597 1061725384 /nfs/dbraw/zinc/72/53/84/1061725384.db2.gz QUNFUVPLURWUQO-ZDUSSCGKSA-N 0 1 311.372 4.101 20 0 DIADMN CCCc1n[nH]cc1-c1nnc(-c2ccc(C(C)(C)C)cc2)o1 ZINC001252827682 1061733060 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Cc1ccc(CN(C)CCCCc2ccccc2)c(Cl)n1 ZINC001459307618 1062078836 /nfs/dbraw/zinc/07/88/36/1062078836.db2.gz DZYBOXWREQKALC-UHFFFAOYSA-N 0 1 302.849 4.498 20 0 DIADMN CN(CCCCc1ccccc1)[C@@H](C(=O)OC(C)(C)C)C1CC1 ZINC001459310960 1062079479 /nfs/dbraw/zinc/07/94/79/1062079479.db2.gz SLSKFVCONAWSEA-GOSISDBHSA-N 0 1 317.473 4.061 20 0 DIADMN Cc1[nH]nc2cc(-c3nnc(Cc4ccccc4Cl)o3)ccc12 ZINC001254346541 1062081515 /nfs/dbraw/zinc/08/15/15/1062081515.db2.gz UFBKIUUDUHHCDR-UHFFFAOYSA-N 0 1 324.771 4.166 20 0 DIADMN COc1ccc(CN(Cc2cccn2C(F)F)C2CC2)cc1 ZINC001474416292 1062089087 /nfs/dbraw/zinc/08/90/87/1062089087.db2.gz YGZAGRHAJZKVEB-UHFFFAOYSA-N 0 1 306.356 4.056 20 0 DIADMN CCC[N@@H+](C[C@H](C)OC)[C@H](C)c1ccccc1Br ZINC001459330057 1062092033 /nfs/dbraw/zinc/09/20/33/1062092033.db2.gz FJDCDCUWRBAIGC-QWHCGFSZSA-N 0 1 314.267 4.257 20 0 DIADMN C[C@@H]1C[C@@H](c2cccnc2)N(Cc2ccc3scnc3c2)C1 ZINC001474421147 1062094546 /nfs/dbraw/zinc/09/45/46/1062094546.db2.gz GWBJKJVNLRDYFI-DYVFJYSZSA-N 0 1 309.438 4.274 20 0 DIADMN C[C@@H]1CCN(Cc2sccc2Br)CC1(C)C ZINC001474424346 1062097793 /nfs/dbraw/zinc/09/77/93/1062097793.db2.gz IJVPCNXZAYCRNM-SNVBAGLBSA-N 0 1 302.281 4.379 20 0 DIADMN C[C@@H](c1ccccc1F)N(C)CCN1CCCc2ccccc21 ZINC001459345852 1062100440 /nfs/dbraw/zinc/10/04/40/1062100440.db2.gz ZZOBNDBKTCIKDQ-INIZCTEOSA-N 0 1 312.432 4.271 20 0 DIADMN CC(C)[C@@H]1CCC[C@@H](NC(=O)c2cc(F)cc3nc[nH]c32)CC1 ZINC001467305321 1062104925 /nfs/dbraw/zinc/10/49/25/1062104925.db2.gz JYQSHZMRZVSNKX-TZMCWYRMSA-N 0 1 317.408 4.037 20 0 DIADMN Cc1ccc(NC(=O)CN2CCC[C@H]2C2CCCC2)c(Cl)c1 ZINC001459349975 1062104944 /nfs/dbraw/zinc/10/49/44/1062104944.db2.gz WHVSLPDOEGCYBA-KRWDZBQOSA-N 0 1 320.864 4.242 20 0 DIADMN COc1ccc2c(c1)C[C@H](C)N(Cc1cccc3c1OCC3)[C@H]2C ZINC001474432052 1062106340 /nfs/dbraw/zinc/10/63/40/1062106340.db2.gz VQVYOVPGIDVIBV-GJZGRUSLSA-N 0 1 323.436 4.138 20 0 DIADMN C[C@H]1CN(CCCc2cccc(F)c2)C[C@@H](c2ccccc2)O1 ZINC001459352964 1062108107 /nfs/dbraw/zinc/10/81/07/1062108107.db2.gz SXOKHLBKQIMYKJ-JXFKEZNVSA-N 0 1 313.416 4.220 20 0 DIADMN C[C@@H](CN1Cc2ccccc2OC[C@H]1C)c1cc(F)cc(F)c1 ZINC001474437688 1062115042 /nfs/dbraw/zinc/11/50/42/1062115042.db2.gz MUFYURQIGVUMQW-UONOGXRCSA-N 0 1 317.379 4.351 20 0 DIADMN COc1cc(CN2CCSCC[C@H]2C)cc(C(F)(F)F)c1 ZINC001474443068 1062120142 /nfs/dbraw/zinc/12/01/42/1062120142.db2.gz PVEIBFUSHCZXAD-LLVKDONJSA-N 0 1 319.392 4.041 20 0 DIADMN C[C@H]1Cc2cc(CN(C)Cc3ccc(F)c(Cl)c3)ccc2O1 ZINC001474441888 1062120714 /nfs/dbraw/zinc/12/07/14/1062120714.db2.gz FJVDPRVUCMSAEM-LBPRGKRZSA-N 0 1 319.807 4.435 20 0 DIADMN CC[C@H](OCCN1CCOc2ccccc2C1)c1ccccc1 ZINC001459388660 1062123030 /nfs/dbraw/zinc/12/30/30/1062123030.db2.gz BVDLTVBMDCFRGZ-IBGZPJMESA-N 0 1 311.425 4.049 20 0 DIADMN COCCN(CCCc1ccccc1)Cc1ccc(F)cc1F ZINC001459392707 1062123473 /nfs/dbraw/zinc/12/34/73/1062123473.db2.gz PBPNHZBVVXHQGU-UHFFFAOYSA-N 0 1 319.395 4.046 20 0 DIADMN CC[C@H](c1ccccc1)N(CC)CC(=O)Nc1ccc(C)cc1 ZINC001459398007 1062127633 /nfs/dbraw/zinc/12/76/33/1062127633.db2.gz JZLLBFBWXZQUHW-LJQANCHMSA-N 0 1 310.441 4.407 20 0 DIADMN C[C@@H]1CCC[C@@H]1CNC(=O)c1cc(Cl)c2ccccc2c1O ZINC001467440831 1062129478 /nfs/dbraw/zinc/12/94/78/1062129478.db2.gz AGEAZNQZELYIDI-VXGBXAGGSA-N 0 1 317.816 4.365 20 0 DIADMN O=C(CC1CCCCC1)N1CCN(CCCC2CCCC2)CC1 ZINC001459411458 1062135100 /nfs/dbraw/zinc/13/51/00/1062135100.db2.gz IDYROXAZUMAAJT-UHFFFAOYSA-N 0 1 320.521 4.071 20 0 DIADMN C[C@H](NCc1cnc2ccccc2n1)c1ccc2ncsc2c1 ZINC001474459498 1062136750 /nfs/dbraw/zinc/13/67/50/1062136750.db2.gz DSAQKTPBJBFWGZ-LBPRGKRZSA-N 0 1 320.421 4.090 20 0 DIADMN CC1=CCC[C@H](C)[C@@H]1CN1CCO[C@H](c2ccc(F)cc2F)C1 ZINC001474461010 1062139607 /nfs/dbraw/zinc/13/96/07/1062139607.db2.gz KBPXRGYOBUYTHK-YJLNNSPDSA-N 0 1 321.411 4.331 20 0 DIADMN CCC[C@H](CCc1ccccc1)N1CCO[C@H](c2ccccn2)C1 ZINC001254498460 1062140682 /nfs/dbraw/zinc/14/06/82/1062140682.db2.gz KYWRWMQORSMNTP-CTNGQTDRSA-N 0 1 324.468 4.256 20 0 DIADMN CC1=CCC[C@H](C)[C@@H]1CN1CCO[C@@H](c2ccc(F)cc2F)C1 ZINC001474461008 1062140897 /nfs/dbraw/zinc/14/08/97/1062140897.db2.gz KBPXRGYOBUYTHK-POZUXBRTSA-N 0 1 321.411 4.331 20 0 DIADMN CCNc1nc(CN2CCC[C@@H](c3ccccc3)CC2)cs1 ZINC001459430403 1062142013 /nfs/dbraw/zinc/14/20/13/1062142013.db2.gz CLGJRVXHUJEBER-MRXNPFEDSA-N 0 1 315.486 4.345 20 0 DIADMN CC(C)c1ccc(CN(C)[C@H]2CCCCNC2=O)c(C(C)C)c1 ZINC001459437539 1062145255 /nfs/dbraw/zinc/14/52/55/1062145255.db2.gz MFMMGESVLXBWST-IBGZPJMESA-N 0 1 316.489 4.034 20 0 DIADMN C[C@@H]1CCC[C@H](CCN2CCN(C(=O)OC(C)(C)C)C[C@H]2C)C1 ZINC001459444209 1062146007 /nfs/dbraw/zinc/14/60/07/1062146007.db2.gz HCIBKKNFZVRYTH-BRWVUGGUSA-N 0 1 324.509 4.144 20 0 DIADMN CC(C)(C)[C@@H](NC(=O)CN1CCC(C)(C)CC1)c1cccs1 ZINC001459435347 1062146273 /nfs/dbraw/zinc/14/62/73/1062146273.db2.gz OETCLLUCIMKOBM-INIZCTEOSA-N 0 1 322.518 4.074 20 0 DIADMN c1ccc(C[C@H]2CCCN(Cc3nc4c(o3)CCCC4)C2)cc1 ZINC001459449290 1062148137 /nfs/dbraw/zinc/14/81/37/1062148137.db2.gz NTVHIFNILQZWBD-QGZVFWFLSA-N 0 1 310.441 4.008 20 0 DIADMN Cc1ccc(NC(=O)C[N@H+]2CCCC3(CCCCC3)C2)cc1C ZINC001459462329 1062150786 /nfs/dbraw/zinc/15/07/86/1062150786.db2.gz GOOOHWIGPUODMW-UHFFFAOYSA-N 0 1 314.473 4.288 20 0 DIADMN Cc1ccc(NC(=O)CN2CCCC3(CCCCC3)C2)cc1C ZINC001459462329 1062150801 /nfs/dbraw/zinc/15/08/01/1062150801.db2.gz GOOOHWIGPUODMW-UHFFFAOYSA-N 0 1 314.473 4.288 20 0 DIADMN C[C@H](c1ccccc1Cl)[N@@H+](CC[C@H]1COC(C)(C)O1)C1CC1 ZINC001459459007 1062152231 /nfs/dbraw/zinc/15/22/31/1062152231.db2.gz VRFOEOJDZWZXMT-HIFRSBDPSA-N 0 1 323.864 4.407 20 0 DIADMN COc1ccccc1[C@H]1CCCC[N@H+]1Cc1cc(C)cc(C)n1 ZINC001459455361 1062152285 /nfs/dbraw/zinc/15/22/85/1062152285.db2.gz ZXBXAPDVEHKCRB-LJQANCHMSA-N 0 1 310.441 4.434 20 0 DIADMN COc1ccccc1[C@H]1CCCCN1Cc1cc(C)cc(C)n1 ZINC001459455361 1062152289 /nfs/dbraw/zinc/15/22/89/1062152289.db2.gz ZXBXAPDVEHKCRB-LJQANCHMSA-N 0 1 310.441 4.434 20 0 DIADMN Clc1nc2cc(Cl)ccn2c1CN(CC1CC1)C1CCC1 ZINC001474475216 1062155523 /nfs/dbraw/zinc/15/55/23/1062155523.db2.gz XHWVAINZVSERFU-UHFFFAOYSA-N 0 1 324.255 4.406 20 0 DIADMN CN(C)Cc1cc(N[C@@H]2CCOC3(CCCC3)C2)ccc1Cl ZINC001474479784 1062157302 /nfs/dbraw/zinc/15/73/02/1062157302.db2.gz RDYZLTYIKUHMPH-MRXNPFEDSA-N 0 1 322.880 4.305 20 0 DIADMN Cc1ccc(C[C@@H]2CCC[N@@H+]2Cc2nc3ccccc3n2C)cc1 ZINC001459481701 1062161214 /nfs/dbraw/zinc/16/12/14/1062161214.db2.gz MZQQJLONQPCCMA-SFHVURJKSA-N 0 1 319.452 4.089 20 0 DIADMN Cc1ccc(Br)c(F)c1CN1CCC2(CCC2)C1 ZINC001474483163 1062162424 /nfs/dbraw/zinc/16/24/24/1062162424.db2.gz BORNYUJJATZPCB-UHFFFAOYSA-N 0 1 312.226 4.273 20 0 DIADMN C[C@@H]1[C@H](C)SCCN1CCc1c(Cl)cccc1Cl ZINC001459486645 1062163970 /nfs/dbraw/zinc/16/39/70/1062163970.db2.gz ITAMLBYTDVFTMX-MNOVXSKESA-N 0 1 304.286 4.362 20 0 DIADMN C[C@@H]1SCCN(CCc2c(Cl)cccc2Cl)[C@H]1C ZINC001459486649 1062165894 /nfs/dbraw/zinc/16/58/94/1062165894.db2.gz ITAMLBYTDVFTMX-QWRGUYRKSA-N 0 1 304.286 4.362 20 0 DIADMN C[C@@H]1CN(c2ccccc2F)CCN1Cc1cccc(C2CC2)c1 ZINC001474491073 1062169675 /nfs/dbraw/zinc/16/96/75/1062169675.db2.gz BSLFFVUSFAGFKA-MRXNPFEDSA-N 0 1 324.443 4.414 20 0 DIADMN C[C@]1(CN2CCSC[C@@H]2c2ccccc2)CC1(Cl)Cl ZINC001459505136 1062171252 /nfs/dbraw/zinc/17/12/52/1062171252.db2.gz BAGJESFYYOOBCV-ZIAGYGMSSA-N 0 1 316.297 4.360 20 0 DIADMN Cc1n[nH]c2ccc(-c3nnc([C@H]4C[C@@H]4c4ccccc4)o3)cc12 ZINC001254555455 1062176541 /nfs/dbraw/zinc/17/65/41/1062176541.db2.gz OFZNCXNLGVNSBZ-CVEARBPZSA-N 0 1 316.364 4.192 20 0 DIADMN O=C(Nc1ccccc1Nc1ccncc1)[C@@H]1C[C@@H]2CCCC[C@H]12 ZINC001467662229 1062177018 /nfs/dbraw/zinc/17/70/18/1062177018.db2.gz CARFWUGVWCBKEY-BHYGNILZSA-N 0 1 321.424 4.012 20 0 DIADMN C[C@H]1CCCC[C@H]1C(=O)Nc1ccccc1Nc1ccncc1 ZINC001467663982 1062177054 /nfs/dbraw/zinc/17/70/54/1062177054.db2.gz PXJYXJYLSCKPCL-GOEBONIOSA-N 0 1 309.413 4.012 20 0 DIADMN C[C@H]1CCCC[C@@H]1C(=O)Nc1ccccc1Nc1ccncc1 ZINC001467663985 1062177107 /nfs/dbraw/zinc/17/71/07/1062177107.db2.gz PXJYXJYLSCKPCL-HOCLYGCPSA-N 0 1 309.413 4.012 20 0 DIADMN CC(C)C[C@H](C)CC(=O)Nc1ccccc1Nc1ccncc1 ZINC001467662393 1062177580 /nfs/dbraw/zinc/17/75/80/1062177580.db2.gz GMIULGPGMRJQKD-HNNXBMFYSA-N 0 1 311.429 4.258 20 0 DIADMN Cc1[nH]nc2cc(-c3nnc([C@H]4C[C@@H]4c4ccccc4)o3)ccc21 ZINC001254558817 1062179999 /nfs/dbraw/zinc/17/99/99/1062179999.db2.gz ZAYUZUFVWNGAEQ-CVEARBPZSA-N 0 1 316.364 4.192 20 0 DIADMN CN(c1ccccc1)c1ccc(CN2CC3(C2)CCCC3)cn1 ZINC001474504600 1062187648 /nfs/dbraw/zinc/18/76/48/1062187648.db2.gz GNGFTRWTYMKMQA-UHFFFAOYSA-N 0 1 307.441 4.226 20 0 DIADMN CCO[C@@H]1CCCN(CCc2cccc(Cl)c2Cl)C1 ZINC001459531563 1062189476 /nfs/dbraw/zinc/18/94/76/1062189476.db2.gz SLHROGSIINIQFD-CYBMUJFWSA-N 0 1 302.245 4.037 20 0 DIADMN COC(=O)c1ccc(CN2C[C@H](C)CC[C@@H]2c2ccccc2)o1 ZINC001474515378 1062196644 /nfs/dbraw/zinc/19/66/44/1062196644.db2.gz DSRBZPZBZYDEOZ-RHSMWYFYSA-N 0 1 313.397 4.039 20 0 DIADMN COC(=O)c1ccc(CN2C[C@@H](C)CC[C@@H]2c2ccccc2)o1 ZINC001474515379 1062197241 /nfs/dbraw/zinc/19/72/41/1062197241.db2.gz DSRBZPZBZYDEOZ-WMLDXEAASA-N 0 1 313.397 4.039 20 0 DIADMN CC[C@@H](C)[C@H]1CCCCN1Cc1sncc1Br ZINC001459540990 1062197572 /nfs/dbraw/zinc/19/75/72/1062197572.db2.gz OFZIBBQTEQAGHD-ZYHUDNBSSA-N 0 1 317.296 4.306 20 0 DIADMN C[C@@H]1C[C@@H](C)N(Cc2cccc(Br)c2Cl)C1 ZINC001459541040 1062197829 /nfs/dbraw/zinc/19/78/29/1062197829.db2.gz JYYSUCXOQANULG-NXEZZACHSA-N 0 1 302.643 4.333 20 0 DIADMN CC[C@]1(C)CCCN(Cc2cc3c(cc2Cl)OCCO3)C1 ZINC001459556573 1062208735 /nfs/dbraw/zinc/20/87/35/1062208735.db2.gz CNTPKOUMXNAEKM-QGZVFWFLSA-N 0 1 309.837 4.123 20 0 DIADMN Brc1cscc1CN1C[C@H](C2CC2)[C@H]1C1CC1 ZINC001474531079 1062215518 /nfs/dbraw/zinc/21/55/18/1062215518.db2.gz JAYYDIHOUGLAHL-TZMCWYRMSA-N 0 1 312.276 4.131 20 0 DIADMN Cc1nsc(C)c1CN1C[C@@H](C)C[C@H]1c1ccccc1F ZINC001459586085 1062224634 /nfs/dbraw/zinc/22/46/34/1062224634.db2.gz TWBLZOCIVNORBD-GTNSWQLSSA-N 0 1 304.434 4.482 20 0 DIADMN C[C@H]1C[C@H](c2cccc(F)c2)N(CCSC(F)(F)F)C1 ZINC001459583556 1062224687 /nfs/dbraw/zinc/22/46/87/1062224687.db2.gz VPMHEJBRNNMSMQ-GXFFZTMASA-N 0 1 307.356 4.462 20 0 DIADMN C[C@@H]1C[C@@H]1CN1C[C@H](c2cccc(C(F)(F)F)c2)OC[C@@H]1C ZINC001474540458 1062229003 /nfs/dbraw/zinc/22/90/03/1062229003.db2.gz CSDPFRKZOJMASP-FAXLKDOZSA-N 0 1 313.363 4.123 20 0 DIADMN C[C@@H]1CN(C[C@@H]2CCCCC2(F)F)[C@H](c2ccccc2)CO1 ZINC001459586643 1062231323 /nfs/dbraw/zinc/23/13/23/1062231323.db2.gz XZFRESZCRWTZDF-PVAVHDDUSA-N 0 1 309.400 4.274 20 0 DIADMN Cc1cccc(Cl)c1NC(=O)[C@H](C)N1CC[C@H](CC(C)C)C1 ZINC001459599610 1062233797 /nfs/dbraw/zinc/23/37/97/1062233797.db2.gz QQSBNZBDZWFULQ-LSDHHAIUSA-N 0 1 322.880 4.343 20 0 DIADMN Cc1cn(C)nc1CN(Cc1ccccc1)[C@@H]1CCCC1(C)C ZINC001459602763 1062236299 /nfs/dbraw/zinc/23/62/99/1062236299.db2.gz INBOMKHWFRTNGU-LJQANCHMSA-N 0 1 311.473 4.309 20 0 DIADMN CN(Cc1ccc(Cl)nc1)C[C@H]1CC[C@H](c2ccccc2)O1 ZINC001459604605 1062238973 /nfs/dbraw/zinc/23/89/73/1062238973.db2.gz ARJWVGWHYPLIMA-IAGOWNOFSA-N 0 1 316.832 4.087 20 0 DIADMN CN(CC1CCC2(CCCCC2)CC1)[C@@H]1CC(C)(C)OC1=O ZINC001474547793 1062242569 /nfs/dbraw/zinc/24/25/69/1062242569.db2.gz LBBQTSIKXBIOIF-MRXNPFEDSA-N 0 1 307.478 4.153 20 0 DIADMN CC[C@H](NC(=O)c1cccc(C(F)(F)F)c1O)C1CCCC1 ZINC001468000904 1062244657 /nfs/dbraw/zinc/24/46/57/1062244657.db2.gz YMGKKQRTIWBRCZ-ZDUSSCGKSA-N 0 1 315.335 4.110 20 0 DIADMN Fc1ccc(F)c2c1CCN(CC1CCC(F)(F)CC1)C2 ZINC001459613545 1062247428 /nfs/dbraw/zinc/24/74/28/1062247428.db2.gz LVAFMTDUNUVCKN-UHFFFAOYSA-N 0 1 301.327 4.148 20 0 DIADMN CC[C@H](C)N1CCN(C(=O)c2c(C)ccc3cc(C)ccc32)CC1 ZINC001468086889 1062259502 /nfs/dbraw/zinc/25/95/02/1062259502.db2.gz COILKAKNMLYNDH-KRWDZBQOSA-N 0 1 324.468 4.013 20 0 DIADMN C[C@@H]1[C@@H](C)CCN1Cc1ccc(Cl)cc1Br ZINC001459628510 1062268607 /nfs/dbraw/zinc/26/86/07/1062268607.db2.gz CJSRGQMHLGDYJZ-VHSXEESVSA-N 0 1 302.643 4.333 20 0 DIADMN CC1(C)CN(Cc2cc3ccccc3[nH]2)Cc2ccccc2O1 ZINC001474558683 1062262648 /nfs/dbraw/zinc/26/26/48/1062262648.db2.gz SMPBJNCQNNDEGD-UHFFFAOYSA-N 0 1 306.409 4.341 20 0 DIADMN C[C@@H]1[C@@H](C)CCN1Cc1cc(Br)ccc1Cl 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4.160 20 0 DIADMN CC1(C)CCC[C@H]1[C@H]1CCN(Cc2c(F)ccc(O)c2F)C1 ZINC001474593926 1062307862 /nfs/dbraw/zinc/30/78/62/1062307862.db2.gz BPIVHTITDJOECB-JSGCOSHPSA-N 0 1 309.400 4.319 20 0 DIADMN CC[C@@H]1CCC[C@H](CN2CCN(c3c(F)cccc3F)CC2)C1 ZINC001474597078 1062310308 /nfs/dbraw/zinc/31/03/08/1062310308.db2.gz HSDAJTZVSZSTSE-CVEARBPZSA-N 0 1 322.443 4.303 20 0 DIADMN C[C@@H]1CCCC[C@@H]1C[NH+]1CCC(C(=O)c2ccc([O-])cc2)CC1 ZINC001459706577 1062321907 /nfs/dbraw/zinc/32/19/07/1062321907.db2.gz AMDXLIPOUASXAP-CRAIPNDOSA-N 0 1 315.457 4.113 20 0 DIADMN C[C@@H]1CCCC[C@H]1C[NH+]1CCC(C(=O)c2ccc([O-])cc2)CC1 ZINC001459706641 1062323073 /nfs/dbraw/zinc/32/30/73/1062323073.db2.gz AMDXLIPOUASXAP-QAPCUYQASA-N 0 1 315.457 4.113 20 0 DIADMN Cc1cc(CN2C[C@@H](C)OCC23CCC3)ccc1C(F)(F)F ZINC001474612212 1062324278 /nfs/dbraw/zinc/32/42/78/1062324278.db2.gz CSBFGJDFGNIWSY-CYBMUJFWSA-N 0 1 313.363 4.157 20 0 DIADMN Cc1coc(C[N@H+]2C[C@H](C)N(Cc3ccccc3)[C@@H](C)[C@H]2C)c1 ZINC001474610253 1062326033 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COc1ccc2c(c1)[C@@H](NCc1ccc(F)c(F)c1F)CCC2 ZINC001461358404 1063442754 /nfs/dbraw/zinc/44/27/54/1063442754.db2.gz DWWOIUOESXCZLW-INIZCTEOSA-N 0 1 321.342 4.280 20 0 DIADMN C[C@H](c1cccc(C(F)(F)F)c1)N(CC1=NOCC1)C1CC1 ZINC001473138113 1063443149 /nfs/dbraw/zinc/44/31/49/1063443149.db2.gz IVCXCPAQVSQEFF-LLVKDONJSA-N 0 1 312.335 4.007 20 0 DIADMN Cc1cccn2c(CN[C@@H](C)c3ccc(Cl)c(F)c3)cnc12 ZINC001461362742 1063445405 /nfs/dbraw/zinc/44/54/05/1063445405.db2.gz RNUMBCQKLAGSCQ-LBPRGKRZSA-N 0 1 317.795 4.286 20 0 DIADMN Cc1nc2c(s1)[C@H](NCc1cc(F)c(F)c(F)c1)CCC2 ZINC001461378495 1063459557 /nfs/dbraw/zinc/45/95/57/1063459557.db2.gz BDXXNUWKPZOUPF-GFCCVEGCSA-N 0 1 312.360 4.036 20 0 DIADMN C[C@]1(c2ccccc2)CCCN(Cc2cncc(Cl)c2)C1 ZINC001473157630 1063460095 /nfs/dbraw/zinc/46/00/95/1063460095.db2.gz JWEDCCLUAZVVHF-SFHVURJKSA-N 0 1 300.833 4.289 20 0 DIADMN Cc1nc2c(s1)[C@@H](NCc1cc(F)c(F)c(F)c1)CCC2 ZINC001461378498 1063460238 /nfs/dbraw/zinc/46/02/38/1063460238.db2.gz BDXXNUWKPZOUPF-LBPRGKRZSA-N 0 1 312.360 4.036 20 0 DIADMN CC/C=C\CCN1CCN([C@@H](CC)c2ccc(F)cc2F)CC1 ZINC001473164633 1063470039 /nfs/dbraw/zinc/47/00/39/1063470039.db2.gz UTVGEARVJUNJCD-VOFKWLDRSA-N 0 1 322.443 4.390 20 0 DIADMN CCNc1nc(CN2C[C@H](c3ccc(F)cc3)C[C@H]2C)cs1 ZINC001473174583 1063478737 /nfs/dbraw/zinc/47/87/37/1063478737.db2.gz VRKLHFQPTZBBCZ-TZMCWYRMSA-N 0 1 319.449 4.092 20 0 DIADMN CCO[C@H]1C[C@H](N(C)Cc2nc(C)c(C(C)(C)C)s2)C1(C)C ZINC001473181989 1063489353 /nfs/dbraw/zinc/48/93/53/1063489353.db2.gz RWVTXOIZLHEOIB-KBPBESRZSA-N 0 1 324.534 4.384 20 0 DIADMN Fc1ccc(CNC[C@H]2CCC3(CCCCC3)O2)c(F)c1F ZINC001461430782 1063495807 /nfs/dbraw/zinc/49/58/07/1063495807.db2.gz GEQLYIRLKJWZOV-CYBMUJFWSA-N 0 1 313.363 4.075 20 0 DIADMN CC(C)=CCC[C@@H](C)N1CCc2nn(-c3ccccc3)cc2C1 ZINC001258096855 1063518242 /nfs/dbraw/zinc/51/82/42/1063518242.db2.gz VXDOZTUXVBTPBR-QGZVFWFLSA-N 0 1 309.457 4.365 20 0 DIADMN CSc1ccc([C@H](C)NCc2cccc3[nH]c(=O)oc32)cc1 ZINC001461466224 1063525083 /nfs/dbraw/zinc/52/50/83/1063525083.db2.gz VTVQQIDXANNPLI-NSHDSACASA-N 0 1 314.410 4.106 20 0 DIADMN FC(F)SCc1ccc(CNc2ccc3nc[nH]c3c2)o1 ZINC001461490150 1063533847 /nfs/dbraw/zinc/53/38/47/1063533847.db2.gz DFOIJQCUEFCWKI-UHFFFAOYSA-N 0 1 309.341 4.224 20 0 DIADMN C[C@H]1CC(N2CCc3ncc(Br)cc3C2)C[C@H](C)C1 ZINC001258167254 1063538201 /nfs/dbraw/zinc/53/82/01/1063538201.db2.gz HYHHYZMUOBWZBT-VXGBXAGGSA-N 0 1 323.278 4.027 20 0 DIADMN C[C@H]1CC([N@H+]2CCc3ncc(C(F)(F)F)cc3C2)C[C@H](C)C1 ZINC001258168449 1063541853 /nfs/dbraw/zinc/54/18/53/1063541853.db2.gz PCCHLKCURUYLBG-VXGBXAGGSA-N 0 1 312.379 4.283 20 0 DIADMN C[C@H]1CC(N2CCc3ncc(C(F)(F)F)cc3C2)C[C@H](C)C1 ZINC001258168449 1063541869 /nfs/dbraw/zinc/54/18/69/1063541869.db2.gz PCCHLKCURUYLBG-VXGBXAGGSA-N 0 1 312.379 4.283 20 0 DIADMN C[C@H]1CC(N2CCO[C@@H](c3ccc(F)c(F)c3)C2)C[C@H](C)C1 ZINC001258172210 1063543222 /nfs/dbraw/zinc/54/32/22/1063543222.db2.gz VUBMVILUNPEBLW-SNUQEOBHSA-N 0 1 309.400 4.163 20 0 DIADMN C[C@H]1CC(N2CCc3c([nH]nc3C(F)(F)F)C2)C[C@H](C)C1 ZINC001258170113 1063544739 /nfs/dbraw/zinc/54/47/39/1063544739.db2.gz IXHFGEDXUSJGII-GPCCPHFNSA-N 0 1 301.356 4.168 20 0 DIADMN Fc1cc2c(c(F)c1F)[C@H](NCc1cc3ccccc3[nH]1)CC2 ZINC001461515048 1063547642 /nfs/dbraw/zinc/54/76/42/1063547642.db2.gz MVSXDVKZMSSYIO-OAHLLOKOSA-N 0 1 316.326 4.362 20 0 DIADMN C[C@@H](Cc1ccco1)N1CCc2cccc(Br)c2C1 ZINC001258187208 1063551987 /nfs/dbraw/zinc/55/19/87/1063551987.db2.gz DFGNLUAHUKARIA-LBPRGKRZSA-N 0 1 320.230 4.031 20 0 DIADMN C[C@H](Cc1ccco1)N1CCc2ccc(C(F)(F)F)cc2C1 ZINC001258192230 1063555156 /nfs/dbraw/zinc/55/51/56/1063555156.db2.gz JMRFHYGZCZKAQP-GFCCVEGCSA-N 0 1 309.331 4.288 20 0 DIADMN C[C@@H](Cc1ccco1)N1CCc2ccc(Br)cc2C1 ZINC001258191374 1063555885 /nfs/dbraw/zinc/55/58/85/1063555885.db2.gz BCYQIDVISDVFMR-LBPRGKRZSA-N 0 1 320.230 4.031 20 0 DIADMN C[C@@H](Cc1ccco1)N1CCc2ccc(C(F)(F)F)cc2C1 ZINC001258192232 1063555980 /nfs/dbraw/zinc/55/59/80/1063555980.db2.gz JMRFHYGZCZKAQP-LBPRGKRZSA-N 0 1 309.331 4.288 20 0 DIADMN CSCC[C@@H](C)N1CCO[C@](C)(c2ccc(Cl)cc2)C1 ZINC001258223431 1063564738 /nfs/dbraw/zinc/56/47/38/1063564738.db2.gz CXARZHRFGRBKOH-CJNGLKHVSA-N 0 1 313.894 4.029 20 0 DIADMN Brc1ccc2oc(CNCC3=CCCCC3)nc2c1 ZINC001461537226 1063566001 /nfs/dbraw/zinc/56/60/01/1063566001.db2.gz HZEWPMXJOORXOM-UHFFFAOYSA-N 0 1 321.218 4.180 20 0 DIADMN CSCC[C@H](C)N(Cc1cc(C)no1)Cc1ccccc1 ZINC001258226890 1063569716 /nfs/dbraw/zinc/56/97/16/1063569716.db2.gz SDMOYUQRJATKNX-HNNXBMFYSA-N 0 1 304.459 4.127 20 0 DIADMN Clc1ccc(CN[C@H]2COCc3ccccc32)c2ncccc12 ZINC001461589821 1063597792 /nfs/dbraw/zinc/59/77/92/1063597792.db2.gz SGIGXTODULWIMZ-SFHVURJKSA-N 0 1 324.811 4.249 20 0 DIADMN Clc1ccc(CN[C@@H]2COCc3ccccc32)c2ncccc12 ZINC001461589820 1063598236 /nfs/dbraw/zinc/59/82/36/1063598236.db2.gz SGIGXTODULWIMZ-GOSISDBHSA-N 0 1 324.811 4.249 20 0 DIADMN C[C@H](CC(C)(C)SCc1ccco1)N1CCC(=O)C[C@@H]1C ZINC001258303782 1063601169 /nfs/dbraw/zinc/60/11/69/1063601169.db2.gz CPZUPLHLQUTASX-UONOGXRCSA-N 0 1 309.475 4.123 20 0 DIADMN CSC(C)(C)C[C@H](C)n1c2cc(Cl)ccc2nc1CN ZINC001258314779 1063605450 /nfs/dbraw/zinc/60/54/50/1063605450.db2.gz HSZBMPKYWQESMX-JTQLQIEISA-N 0 1 311.882 4.241 20 0 DIADMN COc1c(C)cccc1CNCc1ccc(CC(F)(F)F)cc1 ZINC001461602745 1063606286 /nfs/dbraw/zinc/60/62/86/1063606286.db2.gz BCKJPAVZQNOCJU-UHFFFAOYSA-N 0 1 323.358 4.398 20 0 DIADMN CCc1cccc(CNCc2cccc(OC)c2OC(C)C)c1 ZINC001461618278 1063616666 /nfs/dbraw/zinc/61/66/66/1063616666.db2.gz YKONGVRHZQEZEN-UHFFFAOYSA-N 0 1 313.441 4.335 20 0 DIADMN Cc1ccccc1Cc1nnc(-c2nc3ccc(Cl)cc3[nH]2)o1 ZINC001258381944 1063627192 /nfs/dbraw/zinc/62/71/92/1063627192.db2.gz SPTGCVBUPRSNCK-UHFFFAOYSA-N 0 1 324.771 4.166 20 0 DIADMN CCCCC(CCCC)n1nc(COCC2CC2)c2c1CNC2 ZINC001258385672 1063628947 /nfs/dbraw/zinc/62/89/47/1063628947.db2.gz IGFPOYGEJLEBNU-UHFFFAOYSA-N 0 1 319.493 4.334 20 0 DIADMN CC1(C)C[C@]1(NCc1cnn(CC2CCC2)c1)c1ccccc1 ZINC001461653932 1063638713 /nfs/dbraw/zinc/63/87/13/1063638713.db2.gz ARERHBSMLHCOMM-FQEVSTJZSA-N 0 1 309.457 4.098 20 0 DIADMN Cc1ccc(CN[C@@H](c2ccccc2)[C@H](O)C(C)C)c(Cl)c1 ZINC001461654617 1063639409 /nfs/dbraw/zinc/63/94/09/1063639409.db2.gz SUSPWILDFOEQON-RBUKOAKNSA-N 0 1 317.860 4.496 20 0 DIADMN Cc1cccc2c1CCC[C@H]2NCc1nc2c(s1)CCCC2 ZINC001461653394 1063639564 /nfs/dbraw/zinc/63/95/64/1063639564.db2.gz PQAUPKKZVUNJRJ-MRXNPFEDSA-N 0 1 312.482 4.498 20 0 DIADMN CCCCC[C@@H](CC)N1Cc2c(cnn2CC)[C@@H](COCC)C1 ZINC001258439351 1063654596 /nfs/dbraw/zinc/65/45/96/1063654596.db2.gz ITLIPNHXLFAGBG-IAGOWNOFSA-N 0 1 321.509 4.198 20 0 DIADMN CCCCC[C@@H](CC)N1Cc2cn(CC)nc2[C@H](COCC)C1 ZINC001258441453 1063656022 /nfs/dbraw/zinc/65/60/22/1063656022.db2.gz LFLYGUTUAVSQJY-ZWKOTPCHSA-N 0 1 321.509 4.198 20 0 DIADMN CCCCC[C@H](CC)N1Cc2cn(CC)nc2[C@@H](COCC)C1 ZINC001258441450 1063657073 /nfs/dbraw/zinc/65/70/73/1063657073.db2.gz LFLYGUTUAVSQJY-MSOLQXFVSA-N 0 1 321.509 4.198 20 0 DIADMN C[C@@H](CC1CC1)N[C@@]1(c2ccccc2Cl)CCCCC1=O ZINC001258454255 1063660876 /nfs/dbraw/zinc/66/08/76/1063660876.db2.gz GRLBXJLFIPMVCB-SCLBCKFNSA-N 0 1 305.849 4.457 20 0 DIADMN CC(C)(C)c1ccc(CNCc2ccc3scnc3c2)o1 ZINC001461697240 1063663791 /nfs/dbraw/zinc/66/37/91/1063663791.db2.gz HDJVGJQPRRMHEC-UHFFFAOYSA-N 0 1 300.427 4.477 20 0 DIADMN Cc1ncccc1CN[C@@H](CCc1ccccc1)c1ccccn1 ZINC001461697884 1063664915 /nfs/dbraw/zinc/66/49/15/1063664915.db2.gz MMRBBGSYYVZENH-NRFANRHFSA-N 0 1 317.436 4.249 20 0 DIADMN Fc1ccc2c(CNCc3cccc4ccccc43)noc2c1 ZINC001461701082 1063666855 /nfs/dbraw/zinc/66/68/55/1063666855.db2.gz DSYFIQUQUDIOQD-UHFFFAOYSA-N 0 1 306.340 4.410 20 0 DIADMN CCOC(=O)CC[C@H](C)N(C)Cc1ccc(Cl)cc1Cl ZINC001258489935 1063672992 /nfs/dbraw/zinc/67/29/92/1063672992.db2.gz UMVCZLHVHGMBAK-NSHDSACASA-N 0 1 318.244 4.157 20 0 DIADMN COc1cc2nc(NC/C(C)=C/c3ccccc3)[nH]c2cc1OC ZINC001461723331 1063677553 /nfs/dbraw/zinc/67/75/53/1063677553.db2.gz ANBIZYYATAYOOP-UKTHLTGXSA-N 0 1 323.396 4.096 20 0 DIADMN COc1ccc(C2CC2)cc1CNCc1cc2ccccc2n1C ZINC001461727201 1063681998 /nfs/dbraw/zinc/68/19/98/1063681998.db2.gz NAQIWZLLWQUXMZ-UHFFFAOYSA-N 0 1 320.436 4.354 20 0 DIADMN CCCc1occc1C(=O)Nc1nc2cc(Cl)c(F)cc2[nH]1 ZINC001461743883 1063692699 /nfs/dbraw/zinc/69/26/99/1063692699.db2.gz FAFSYCBTJKPFKQ-UHFFFAOYSA-N 0 1 321.739 4.153 20 0 DIADMN C[C@@H](Cc1cccnc1)N1CCc2c(cccc2C(F)(F)F)C1 ZINC001258635401 1063718120 /nfs/dbraw/zinc/71/81/20/1063718120.db2.gz ZRZXGBBOVCBCBQ-ZDUSSCGKSA-N 0 1 320.358 4.090 20 0 DIADMN CC(C)(C)c1cnc(CNCCCOc2cccc(F)c2)s1 ZINC001461808946 1063729149 /nfs/dbraw/zinc/72/91/49/1063729149.db2.gz CKVZUCOZZQYPCD-UHFFFAOYSA-N 0 1 322.449 4.138 20 0 DIADMN Cl/C=C\CNCc1cc(Cl)ccc1OCc1cccnc1 ZINC001461807075 1063729495 /nfs/dbraw/zinc/72/94/95/1063729495.db2.gz UNDUDZIQVPVNNY-KXFIGUGUSA-N 0 1 323.223 4.156 20 0 DIADMN CCCCC[C@H](CCC)N1CCCn2cnc(COCC)c2C1 ZINC001258669199 1063736714 /nfs/dbraw/zinc/73/67/14/1063736714.db2.gz IVYNPLCGEBHGTK-KRWDZBQOSA-N 0 1 321.509 4.374 20 0 DIADMN CCCCC[C@@H](CCC)N1Cc2c(cnn2C)[C@@H](COCC)C1 ZINC001258670281 1063737673 /nfs/dbraw/zinc/73/76/73/1063737673.db2.gz ZNJZWONVBMXAIJ-IAGOWNOFSA-N 0 1 321.509 4.105 20 0 DIADMN CCCCC[C@@H](CCC)N1Cc2cn(C)nc2[C@H](COCC)C1 ZINC001258669867 1063738211 /nfs/dbraw/zinc/73/82/11/1063738211.db2.gz ULDKLQUEFOOXRE-ZWKOTPCHSA-N 0 1 321.509 4.105 20 0 DIADMN Fc1ccc(CN(Cc2nccc3c2CCCC3)C2CC2)cc1 ZINC001461839825 1063743625 /nfs/dbraw/zinc/74/36/25/1063743625.db2.gz YMHQNZGZCORAHP-UHFFFAOYSA-N 0 1 310.416 4.264 20 0 DIADMN CCN(CCN(C(=O)OC(C)(C)C)C(C)(C)C)Cc1ccoc1 ZINC001461842591 1063745408 /nfs/dbraw/zinc/74/54/08/1063745408.db2.gz JJXSFGLZULOARJ-UHFFFAOYSA-N 0 1 324.465 4.137 20 0 DIADMN Cc1nn(C)c(CN2CCCC3(C2)CCCCCC3)c1Cl ZINC001461845038 1063748190 /nfs/dbraw/zinc/74/81/90/1063748190.db2.gz PJFVRKDSPXZOEQ-UHFFFAOYSA-N 0 1 309.885 4.318 20 0 DIADMN C[C@H]1[C@H](Cc2ccccc2)CCN1Cc1c(F)ccc(O)c1F ZINC001461848698 1063748416 /nfs/dbraw/zinc/74/84/16/1063748416.db2.gz GEMIHYDACHTVAY-ZFWWWQNUSA-N 0 1 317.379 4.124 20 0 DIADMN C[C@H](c1ccccc1)N(Cc1cn(C)nc1Cl)CC1CCC1 ZINC001461857697 1063751699 /nfs/dbraw/zinc/75/16/99/1063751699.db2.gz DXRRUCPBLKSWIN-CQSZACIVSA-N 0 1 317.864 4.437 20 0 DIADMN CCOc1cncc(CN2C[C@H](C)C[C@H]2c2cccc(F)c2)c1 ZINC001461867116 1063758844 /nfs/dbraw/zinc/75/88/44/1063758844.db2.gz GXRNVVKBBCMUEP-KUHUBIRLSA-N 0 1 314.404 4.203 20 0 DIADMN Cc1cc(F)ncc1CN1C[C@H](C)C[C@@H]1c1cccc(F)c1 ZINC001461867203 1063758899 /nfs/dbraw/zinc/75/88/99/1063758899.db2.gz HDFBZEGZEOYXEW-SJKOYZFVSA-N 0 1 302.368 4.251 20 0 DIADMN CCN(Cc1cnn(CC2CCC2)c1)Cc1ccc(Cl)cc1 ZINC001461867570 1063759094 /nfs/dbraw/zinc/75/90/94/1063759094.db2.gz JALIUFSAKHYXDJ-UHFFFAOYSA-N 0 1 317.864 4.359 20 0 DIADMN C[C@H]1C[C@H](N2Cc3cc(Br)cnc3C2)CC(C)(C)C1 ZINC001258700576 1063759793 /nfs/dbraw/zinc/75/97/93/1063759793.db2.gz MZPSRAACWCGOLX-FZMZJTMJSA-N 0 1 323.278 4.375 20 0 DIADMN CSc1ccccc1NC(=O)CN(C)CCCCC(C)C ZINC001461870811 1063762767 /nfs/dbraw/zinc/76/27/67/1063762767.db2.gz LLSPSUAIPCEKPP-UHFFFAOYSA-N 0 1 308.491 4.105 20 0 DIADMN CCOc1cc(CN2CCC[C@](C)(CC)C2)cc(Cl)c1O ZINC001461877088 1063765376 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Cc1ccc2nc(-c3nnc(-c4ccc(C)c(F)c4)o3)[nH]c2c1 ZINC001258727122 1063778131 /nfs/dbraw/zinc/77/81/31/1063778131.db2.gz BRCIUEKDHOIZBF-UHFFFAOYSA-N 0 1 308.316 4.036 20 0 DIADMN CN(Cc1cc2cccnc2o1)Cc1cccc(C(F)(F)F)c1 ZINC001461891845 1063781584 /nfs/dbraw/zinc/78/15/84/1063781584.db2.gz IWNKJQIORKCAHV-UHFFFAOYSA-N 0 1 320.314 4.479 20 0 DIADMN CC(=O)[C@@H](N[C@@H](C)Cc1cccc(Cl)c1)c1ccccc1 ZINC001258737197 1063786156 /nfs/dbraw/zinc/78/61/56/1063786156.db2.gz DGQUNVAWBZOKBD-SCLBCKFNSA-N 0 1 301.817 4.191 20 0 DIADMN CCCOc1ccc(CN2CCOc3ccccc3C2)cc1C ZINC001461908852 1063792146 /nfs/dbraw/zinc/79/21/46/1063792146.db2.gz DBHVGQUUFKEZKU-UHFFFAOYSA-N 0 1 311.425 4.178 20 0 DIADMN CCCC[C@H](CCC)N1Cc2c(cnn2CC)[C@@H](COCC)C1 ZINC001258761587 1063808203 /nfs/dbraw/zinc/80/82/03/1063808203.db2.gz NUZAXXGHHVKGJD-SJORKVTESA-N 0 1 321.509 4.198 20 0 DIADMN CC[C@H](C)[C@@H](CN(C)Cc1cccc(Cl)c1Cl)OC ZINC001461929912 1063813341 /nfs/dbraw/zinc/81/33/41/1063813341.db2.gz QFOGBNKDZNKVKL-SMDDNHRTSA-N 0 1 304.261 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COc1ccc([C@H](C)N[C@H](C)c2cc(F)ccc2OC)cc1F ZINC000192808777 1044318093 /nfs/dbraw/zinc/31/80/93/1044318093.db2.gz UWSCBEJYFBTNCW-NWDGAFQWSA-N 0 1 321.367 4.394 20 0 DIADMN Cc1cccc(OC[C@@H](C)N[C@H](C)c2cccnc2Cl)c1 ZINC000132289130 1044318968 /nfs/dbraw/zinc/31/89/68/1044318968.db2.gz GIZRYDYOGSVFON-ZIAGYGMSSA-N 0 1 304.821 4.162 20 0 DIADMN CSCc1cnc(CNCCc2cc3ccccc3o2)s1 ZINC000293738541 1044319884 /nfs/dbraw/zinc/31/98/84/1044319884.db2.gz ZXLFDLSPGUFGNC-UHFFFAOYSA-N 0 1 318.467 4.085 20 0 DIADMN CSc1cccc(NC(=O)C2=C(C)N(C(C)C)CC2)c1C ZINC000935244918 1044320329 /nfs/dbraw/zinc/32/03/29/1044320329.db2.gz ZFVRRKAMKBGPHG-UHFFFAOYSA-N 0 1 304.459 4.044 20 0 DIADMN Cc1nnsc1CN[C@@H](CCc1ccccc1)c1ccccc1 ZINC000293745929 1044322005 /nfs/dbraw/zinc/32/20/05/1044322005.db2.gz RAURDXKYUNZBMF-SFHVURJKSA-N 0 1 323.465 4.310 20 0 DIADMN Cc1nnsc1CN[C@H](CCc1ccccc1)c1ccccc1 ZINC000293745926 1044322707 /nfs/dbraw/zinc/32/27/07/1044322707.db2.gz RAURDXKYUNZBMF-GOSISDBHSA-N 0 1 323.465 4.310 20 0 DIADMN CC(C)n1cc([C@@H](C)NCc2ccc(C(C)(F)F)cc2)cn1 ZINC000293766899 1044326165 /nfs/dbraw/zinc/32/61/65/1044326165.db2.gz RUJXASWARXEPEU-CYBMUJFWSA-N 0 1 307.388 4.427 20 0 DIADMN CC(C)[C@@H](C[N@@H+](C)Cc1cn2c(n1)CCCC2)c1ccccc1 ZINC000475214336 1044328307 /nfs/dbraw/zinc/32/83/07/1044328307.db2.gz YQUSRDSGMQZEJT-LJQANCHMSA-N 0 1 311.473 4.091 20 0 DIADMN COc1ccc(C(=O)Nc2cccc(Cl)c2O)cc1C1CC1 ZINC000444332170 1044330175 /nfs/dbraw/zinc/33/01/75/1044330175.db2.gz RSSCJSCVPMAZSK-UHFFFAOYSA-N 0 1 317.772 4.184 20 0 DIADMN Cc1cnc(=S)n(CN(C)[C@@H](c2ccccc2)C(C)C)c1 ZINC000132696105 1044330714 /nfs/dbraw/zinc/33/07/14/1044330714.db2.gz XSHKGZXBPPXHDC-MRXNPFEDSA-N 0 1 301.459 4.208 20 0 DIADMN C[C@@H]1[C@@H](C(F)(F)F)CC[N@H+]1C/C=C/c1ccc(F)cc1F ZINC000475264576 1044333547 /nfs/dbraw/zinc/33/35/47/1044333547.db2.gz GCHHFHKUXBAXCX-YRFZCRBASA-N 0 1 305.290 4.251 20 0 DIADMN C[C@@H]1[C@@H](C(F)(F)F)CCN1C/C=C/c1ccc(F)cc1F ZINC000475264576 1044333559 /nfs/dbraw/zinc/33/35/59/1044333559.db2.gz GCHHFHKUXBAXCX-YRFZCRBASA-N 0 1 305.290 4.251 20 0 DIADMN CCc1noc(C)c1CN[C@@H]1c2cccc(F)c2CC[C@@H]1C ZINC000293840086 1044336133 /nfs/dbraw/zinc/33/61/33/1044336133.db2.gz XRTZWTJTKHSQBN-VOJFVSQTSA-N 0 1 302.393 4.098 20 0 DIADMN NC1(c2noc(/C=C\c3cc4ccccc4o3)n2)CCCCC1 ZINC000564075167 1044337268 /nfs/dbraw/zinc/33/72/68/1044337268.db2.gz IRVOJHVFWQXYGT-HJWRWDBZSA-N 0 1 309.369 4.104 20 0 DIADMN C[C@@H](Cc1ccsc1)N1C[C@@H](C)O[C@@H](c2ccsc2)C1 ZINC000564068145 1044337296 /nfs/dbraw/zinc/33/72/96/1044337296.db2.gz QXNHBUUDCNFGPZ-WOSRLPQWSA-N 0 1 307.484 4.203 20 0 DIADMN COc1cc(CN(C)[C@@H](C)c2cccnc2)ccc1SC ZINC000101547114 1044337283 /nfs/dbraw/zinc/33/72/83/1044337283.db2.gz LNJAZJRZTDORHM-ZDUSSCGKSA-N 0 1 302.443 4.005 20 0 DIADMN CO[C@@H](C)c1nc(CN[C@H](C)CCc2ccsc2)cs1 ZINC000360983913 1044339103 /nfs/dbraw/zinc/33/91/03/1044339103.db2.gz OSBLYRQMPJXTTN-NEPJUHHUSA-N 0 1 310.488 4.023 20 0 DIADMN Cc1nc([C@H](C)N[C@@H]2CCCO[C@H]2c2ccc(C)cc2)cs1 ZINC000361005870 1044343462 /nfs/dbraw/zinc/34/34/62/1044343462.db2.gz XTXZZEULZOSEHH-XCRHUMRWSA-N 0 1 316.470 4.331 20 0 DIADMN Fc1ccc(C=Cc2nc(-c3ccc4[nH]cnc4c3)no2)cc1F ZINC000564125932 1044343555 /nfs/dbraw/zinc/34/35/55/1044343555.db2.gz JTYLKKXYMCVEMF-QHHAFSJGSA-N 0 1 324.290 4.062 20 0 DIADMN O=C(Cc1n[nH]c2ccccc12)Nc1cc(Cl)cc(Cl)c1 ZINC000523015627 1044343982 /nfs/dbraw/zinc/34/39/82/1044343982.db2.gz HQVXBSSADVWUHF-UHFFFAOYSA-N 0 1 320.179 4.051 20 0 DIADMN C[C@H](CC(F)(F)CN)c1nc(-c2ccc3sccc3c2)no1 ZINC001211895541 1044344851 /nfs/dbraw/zinc/34/48/51/1044344851.db2.gz FYQWBZVQWYTDHG-SECBINFHSA-N 0 1 323.368 4.039 20 0 DIADMN Cc1ccc(NC(=O)CN2CCC[C@@H]2c2ccccc2)c(C)c1 ZINC000140751858 1044349504 /nfs/dbraw/zinc/34/95/04/1044349504.db2.gz HMGKYORTRZPRCB-LJQANCHMSA-N 0 1 308.425 4.079 20 0 DIADMN Cc1cc2[nH]ncc2cc1NC(=O)c1cc(C2CC2)oc1C1CC1 ZINC000935613956 1044350448 /nfs/dbraw/zinc/35/04/48/1044350448.db2.gz NVFJAZPDTQTAJG-UHFFFAOYSA-N 0 1 321.380 4.471 20 0 DIADMN Cc1ccc(C2CCN(Cc3ccc(F)c(F)c3)CC2)cn1 ZINC000361044360 1044351571 /nfs/dbraw/zinc/35/15/71/1044351571.db2.gz HWXYQIVZVWXJER-UHFFFAOYSA-N 0 1 302.368 4.048 20 0 DIADMN Fc1cc(OC(F)F)ccc1CNc1cc2c(cn1)CCCC2 ZINC001202561358 1044352687 /nfs/dbraw/zinc/35/26/87/1044352687.db2.gz TXAYZPTYCPHILC-UHFFFAOYSA-N 0 1 322.330 4.313 20 0 DIADMN CC1(C)CN(Cc2ccc3ncccc3c2)[C@@H]1c1ccncc1 ZINC000293941241 1044356145 /nfs/dbraw/zinc/35/61/45/1044356145.db2.gz OGYZPJBDKCRMTI-LJQANCHMSA-N 0 1 303.409 4.213 20 0 DIADMN COc1cc(F)c(CN[C@H](C)c2ccc(C)c(F)c2)cc1OC ZINC000564217481 1044359011 /nfs/dbraw/zinc/35/90/11/1044359011.db2.gz NOHSMSJPSPTVFA-GFCCVEGCSA-N 0 1 321.367 4.141 20 0 DIADMN CC(C)c1nc([C@@H](C)NC[C@@H](CO)C2CCCCC2)cs1 ZINC000564223858 1044360756 /nfs/dbraw/zinc/36/07/56/1044360756.db2.gz ZQLPHRPHWKERDK-HIFRSBDPSA-N 0 1 310.507 4.106 20 0 DIADMN CCCCOc1ccc([C@@H](C)NCc2cnccc2OC)cc1 ZINC000293964328 1044361443 /nfs/dbraw/zinc/36/14/43/1044361443.db2.gz AHCFNEYQHVKREK-OAHLLOKOSA-N 0 1 314.429 4.120 20 0 DIADMN CC(F)(F)c1ccc(CNCc2cc3cnccc3o2)cc1 ZINC001202580151 1044362927 /nfs/dbraw/zinc/36/29/27/1044362927.db2.gz XTKPKEMABUCFTP-UHFFFAOYSA-N 0 1 302.324 4.229 20 0 DIADMN CC(=O)Nc1ccccc1C[N@H+]1CC2(CCC2)[C@H]1c1ccccc1 ZINC000293994962 1044363721 /nfs/dbraw/zinc/36/37/21/1044363721.db2.gz SHKDDURYAFLPGD-HXUWFJFHSA-N 0 1 320.436 4.372 20 0 DIADMN CC(=O)Nc1ccccc1CN1CC2(CCC2)[C@H]1c1ccccc1 ZINC000293994962 1044363733 /nfs/dbraw/zinc/36/37/33/1044363733.db2.gz SHKDDURYAFLPGD-HXUWFJFHSA-N 0 1 320.436 4.372 20 0 DIADMN C[C@@H]1[C@H](C(F)(F)F)CCN1CCc1ccc(F)cc1Cl ZINC000564536640 1044388639 /nfs/dbraw/zinc/38/86/39/1044388639.db2.gz JLUWUODJRKSTBP-BXKDBHETSA-N 0 1 309.734 4.294 20 0 DIADMN CN(C(=O)c1cccc2[nH]c(C(F)F)nc21)[C@@H]1CCC(C)(C)C1 ZINC000935763711 1044367064 /nfs/dbraw/zinc/36/70/64/1044367064.db2.gz AEEWTLGMAVJSLP-SNVBAGLBSA-N 0 1 321.371 4.151 20 0 DIADMN Cc1ccc([C@H]2CCCN2Cc2cn(C)nc2C(F)F)cc1 ZINC000361176397 1044369283 /nfs/dbraw/zinc/36/92/83/1044369283.db2.gz CHHYFAZPBJLDAU-OAHLLOKOSA-N 0 1 305.372 4.003 20 0 DIADMN C[C@H](CC(F)(F)CN)c1nc(-c2ccc(C(C)(C)C)cc2)no1 ZINC001211895940 1044374506 /nfs/dbraw/zinc/37/45/06/1044374506.db2.gz QECSCHNIBXWWNW-LLVKDONJSA-N 0 1 323.387 4.122 20 0 DIADMN CCN(CC)[C@@H](CNC(=O)CC1(C)CC1)c1ccccc1Cl ZINC000428340591 1044375218 /nfs/dbraw/zinc/37/52/18/1044375218.db2.gz QUZWFWGCJWSWBW-INIZCTEOSA-N 0 1 322.880 4.029 20 0 DIADMN C[C@@H](CC(F)(F)CN)c1nc(-c2ccc(C(C)(C)C)cc2)no1 ZINC001211895941 1044375815 /nfs/dbraw/zinc/37/58/15/1044375815.db2.gz QECSCHNIBXWWNW-NSHDSACASA-N 0 1 323.387 4.122 20 0 DIADMN COc1cccc(CN[C@@H]2CCc3sc(Cl)cc32)c1OC ZINC000564407305 1044377441 /nfs/dbraw/zinc/37/74/41/1044377441.db2.gz YRLVMLVIFGHGKM-GFCCVEGCSA-N 0 1 323.845 4.196 20 0 DIADMN COc1cc(Cl)ccc1CN1CCC[C@@H](c2nccs2)C1 ZINC000361261700 1044382115 /nfs/dbraw/zinc/38/21/15/1044382115.db2.gz QRTKCFPPVCOSOL-CYBMUJFWSA-N 0 1 322.861 4.185 20 0 DIADMN CC[C@]1(C)CC[N@H+]([C@H](C(=O)[O-])c2cc(Cl)cc(Cl)c2)C1 ZINC000564463061 1044384378 /nfs/dbraw/zinc/38/43/78/1044384378.db2.gz QEMQHLWZHIAHCY-DZGCQCFKSA-N 0 1 316.228 4.241 20 0 DIADMN FC(F)OC[C@H]1CCN(Cc2ccc(Oc3ccccc3)o2)C1 ZINC000564496468 1044385945 /nfs/dbraw/zinc/38/59/45/1044385945.db2.gz LCJZBPWNLMUPLE-ZDUSSCGKSA-N 0 1 323.339 4.133 20 0 DIADMN CCc1nc(C)c(CN2[C@H](C)Cc3cc(OC)ccc3[C@H]2C)o1 ZINC000428341802 1044387449 /nfs/dbraw/zinc/38/74/49/1044387449.db2.gz PZGDUDAJPSHYNG-TZMCWYRMSA-N 0 1 314.429 4.062 20 0 DIADMN Cc1cc(CN2CC3(CCC3)[C@H]2[C@H]2CCCO2)ccc1Cl ZINC000564538232 1044388274 /nfs/dbraw/zinc/38/82/74/1044388274.db2.gz PBAUDXDCNZVTDB-IAGOWNOFSA-N 0 1 305.849 4.182 20 0 DIADMN COC[C@H](NCc1cc(C)cc(OC)c1)c1cccc(Cl)c1 ZINC000564615946 1044395903 /nfs/dbraw/zinc/39/59/03/1044395903.db2.gz LZLJLOFPFMQYMA-SFHVURJKSA-N 0 1 319.832 4.134 20 0 DIADMN Cc1ccnc(CN[C@@H](C)[C@H](C)c2ccccc2C(F)(F)F)n1 ZINC000348282304 1044397620 /nfs/dbraw/zinc/39/76/20/1044397620.db2.gz PPPXIFOCMYBYPT-STQMWFEESA-N 0 1 323.362 4.086 20 0 DIADMN C[C@@H](C[N@@H+](Cc1ccc(Cl)c2ccccc12)C1CC1)C(=O)[O-] ZINC000564738644 1044399074 /nfs/dbraw/zinc/39/90/74/1044399074.db2.gz JQOQBLPKSQNHOI-LBPRGKRZSA-N 0 1 317.816 4.178 20 0 DIADMN Cc1ccncc1CN(C)[C@@H](C)c1ccc(OC(F)F)cc1 ZINC000361413899 1044400857 /nfs/dbraw/zinc/40/08/57/1044400857.db2.gz SNZKVMSAUOBGGT-ZDUSSCGKSA-N 0 1 306.356 4.184 20 0 DIADMN C[C@@H]1CCC[N@@H+](Cc2ccc(C3CCCCC3)cc2)[C@@H]1C(=O)[O-] ZINC000564831959 1044405665 /nfs/dbraw/zinc/40/56/65/1044405665.db2.gz NOJHJUGDFSPHOU-BEFAXECRSA-N 0 1 315.457 4.419 20 0 DIADMN Cc1nc(C(C)(C)C)sc1[C@H](C)N[C@@H](C)c1cnn(C)c1C ZINC000193026092 1044409443 /nfs/dbraw/zinc/40/94/43/1044409443.db2.gz DXLRAHJMXDRNPA-QWRGUYRKSA-N 0 1 320.506 4.203 20 0 DIADMN C[C@H](CO)N(Cc1nc(C2CCCCC2)cs1)CC1CCC1 ZINC000361501044 1044410891 /nfs/dbraw/zinc/41/08/91/1044410891.db2.gz LZEWWOCMFFDILE-CQSZACIVSA-N 0 1 322.518 4.174 20 0 DIADMN CC(C)c1nc(CNCc2ccc(F)cc2F)c2ccccn21 ZINC000565079581 1044412392 /nfs/dbraw/zinc/41/23/92/1044412392.db2.gz KZROZUFKZSPCIY-UHFFFAOYSA-N 0 1 315.367 4.026 20 0 DIADMN O=C([O-])c1occc1C[N@H+]1CCCC[C@@H]1c1cc2ccccc2[nH]1 ZINC000565101737 1044412962 /nfs/dbraw/zinc/41/29/62/1044412962.db2.gz VPLKDJYBUWOUKX-QGZVFWFLSA-N 0 1 324.380 4.186 20 0 DIADMN CCN(C)c1ccc(CN2CCC[C@@H]2c2cccc(F)c2)cn1 ZINC000361508949 1044413068 /nfs/dbraw/zinc/41/30/68/1044413068.db2.gz RMUWEWIIHGTDQE-GOSISDBHSA-N 0 1 313.420 4.014 20 0 DIADMN Cc1oc(C(=O)[O-])cc1C[N@H+](C)[C@H](C)c1cc2ccccc2o1 ZINC000565104791 1044414267 /nfs/dbraw/zinc/41/42/67/1044414267.db2.gz WAZLJNHFFNXSMJ-LLVKDONJSA-N 0 1 313.353 4.225 20 0 DIADMN C[C@H]1C[N@@H+](Cc2ccccc2C(=O)[O-])CC[C@H]1c1ccccc1 ZINC000565108186 1044414666 /nfs/dbraw/zinc/41/46/66/1044414666.db2.gz ZWPRPEOYLSZSSZ-MAUKXSAKSA-N 0 1 309.409 4.010 20 0 DIADMN CCCC[C@H](CC)C[N@@H+](CC(=O)[O-])Cc1ccc(Cl)cc1 ZINC000565106298 1044415218 /nfs/dbraw/zinc/41/52/18/1044415218.db2.gz RYDRZRDCKRUSRI-AWEZNQCLSA-N 0 1 311.853 4.443 20 0 DIADMN COCC[N@@H+](Cc1csc(-c2ccco2)n1)[C@@H]1CC[C@H](C)C1 ZINC000361629843 1044425394 /nfs/dbraw/zinc/42/53/94/1044425394.db2.gz LNPQMSQGBREPPY-DZGCQCFKSA-N 0 1 320.458 4.040 20 0 DIADMN COCCN(Cc1csc(-c2ccco2)n1)[C@@H]1CC[C@H](C)C1 ZINC000361629843 1044425400 /nfs/dbraw/zinc/42/54/00/1044425400.db2.gz LNPQMSQGBREPPY-DZGCQCFKSA-N 0 1 320.458 4.040 20 0 DIADMN Cc1ccc(C[N@H+]2C[C@@H](C3CCCCC3)C[C@@H]2C(=O)[O-])c(C)c1 ZINC000565312670 1044425792 /nfs/dbraw/zinc/42/57/92/1044425792.db2.gz BTEPIEIDCGPVHL-RBUKOAKNSA-N 0 1 315.457 4.159 20 0 DIADMN O=C([O-])[C@@H]1C[C@@H](C2CCCCC2)C[N@H+]1CCC1=CCCCC1 ZINC000565372060 1044429998 /nfs/dbraw/zinc/42/99/98/1044429998.db2.gz GYUQEBVAIKCYDI-MSOLQXFVSA-N 0 1 305.462 4.232 20 0 DIADMN CC[C@H](c1ccccc1)[C@@H]1CCC[N@H+]1Cc1ccoc1C(=O)[O-] ZINC000565425335 1044434490 /nfs/dbraw/zinc/43/44/90/1044434490.db2.gz FULWRXDCEWTPHT-SJORKVTESA-N 0 1 313.397 4.136 20 0 DIADMN CCCN(CCc1ccccn1)Cc1c(Cl)cccc1OC ZINC000565451702 1044436322 /nfs/dbraw/zinc/43/63/22/1044436322.db2.gz UBBPOPGIKTWSQM-UHFFFAOYSA-N 0 1 318.848 4.198 20 0 DIADMN Cc1ccc2c(c1)CCN(Cc1cn(C)nc1-c1cccs1)C2 ZINC000361728745 1044437352 /nfs/dbraw/zinc/43/73/52/1044437352.db2.gz QULKBQZYKUWOEU-UHFFFAOYSA-N 0 1 323.465 4.015 20 0 DIADMN Cc1[nH]nc2cc(NC(=O)COc3ccccc3C(C)C)ccc12 ZINC000565552723 1044441508 /nfs/dbraw/zinc/44/15/08/1044441508.db2.gz BDPYWKZPJVYNTC-UHFFFAOYSA-N 0 1 323.396 4.012 20 0 DIADMN Cc1ccc2nc(CN[C@@H]3CCCOc4ccc(C)cc43)[nH]c2c1 ZINC000361805247 1044445442 /nfs/dbraw/zinc/44/54/42/1044445442.db2.gz SBORMYFWZBIRKF-MRXNPFEDSA-N 0 1 321.424 4.183 20 0 DIADMN COc1cccc(CNC2(c3nc(C)cs3)CCCC2)c1 ZINC000112711060 1044445625 /nfs/dbraw/zinc/44/56/25/1044445625.db2.gz PPQLPUYXLSYGBA-UHFFFAOYSA-N 0 1 302.443 4.019 20 0 DIADMN CC[C@@H](NCc1nc2cc(C)ccc2[nH]1)c1ccc(OC)cc1 ZINC000361804377 1044445865 /nfs/dbraw/zinc/44/58/65/1044445865.db2.gz MVSDARXQCIFLHW-MRXNPFEDSA-N 0 1 309.413 4.121 20 0 DIADMN CC[C@@H](NCc1nc2ccc(C)cc2[nH]1)c1ccc(OC)cc1 ZINC000361804377 1044445869 /nfs/dbraw/zinc/44/58/69/1044445869.db2.gz 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ZINC001140921335 1046951614 /nfs/dbraw/zinc/95/16/14/1046951614.db2.gz BIMQTGZNDNMCMF-INIZCTEOSA-N 0 1 306.331 4.220 20 0 DIADMN CN(Cc1cnccc1C(F)(F)F)[C@H]1CCc2ccccc21 ZINC001140921335 1046951618 /nfs/dbraw/zinc/95/16/18/1046951618.db2.gz BIMQTGZNDNMCMF-INIZCTEOSA-N 0 1 306.331 4.220 20 0 DIADMN Cc1cn(C2CCCCC2)nc1NCc1[nH]nc2ccccc21 ZINC000680138265 1046952358 /nfs/dbraw/zinc/95/23/58/1046952358.db2.gz FGRBKLVSGXHLPT-UHFFFAOYSA-N 0 1 309.417 4.185 20 0 DIADMN C[C@H](c1ccc(Cl)cc1)N(Cc1cnc(N)s1)C1CC1 ZINC000261910136 1046953677 /nfs/dbraw/zinc/95/36/77/1046953677.db2.gz XWXVFPKOMXXOEH-SNVBAGLBSA-N 0 1 307.850 4.104 20 0 DIADMN Cc1nc2cc(C)ccn2c1CN1CCC[C@@H]1c1cccc(F)c1 ZINC001139680016 1046953672 /nfs/dbraw/zinc/95/36/72/1046953672.db2.gz NRWHNBILCASYSF-GOSISDBHSA-N 0 1 323.415 4.427 20 0 DIADMN Nc1ncc(CN(Cc2ccc3ccccc3c2)C2CC2)s1 ZINC000261901750 1046953946 /nfs/dbraw/zinc/95/39/46/1046953946.db2.gz WESDMQRGROTCLH-UHFFFAOYSA-N 0 1 309.438 4.043 20 0 DIADMN Cc1ccccc1C1(NCc2cnc(-c3ccccn3)s2)CC1 ZINC000647224778 1046955719 /nfs/dbraw/zinc/95/57/19/1046955719.db2.gz ZAGZGSMUOCEICP-UHFFFAOYSA-N 0 1 321.449 4.292 20 0 DIADMN FC1(F)[C@@H]2C[C@@H](CN(Cc3ccco3)Cc3ccco3)C[C@@H]21 ZINC000929090881 1046956643 /nfs/dbraw/zinc/95/66/43/1046956643.db2.gz IEZDAYVOYLZGKC-DVSIDAKKSA-N 0 1 307.340 4.166 20 0 DIADMN CC(C)Oc1ccccc1CN1CC=C(c2ccc(O)cc2)CC1 ZINC000615090317 1046957050 /nfs/dbraw/zinc/95/70/50/1046957050.db2.gz ZGMLHYWOGRBXGR-UHFFFAOYSA-N 0 1 323.436 4.469 20 0 DIADMN COc1cccc(CNC2(c3cccc(F)c3)CCC2)c1F ZINC000647233151 1046959071 /nfs/dbraw/zinc/95/90/71/1046959071.db2.gz XAJSMFBCGDDXNJ-UHFFFAOYSA-N 0 1 303.352 4.142 20 0 DIADMN COc1ccc(-c2cccc(CN3CCCC[C@@H](F)C3)n2)cc1 ZINC001140954240 1046959521 /nfs/dbraw/zinc/95/95/21/1046959521.db2.gz ILHOQYYKAAJMMJ-MRXNPFEDSA-N 0 1 314.404 4.081 20 0 DIADMN Cc1nc2c(cccc2C(=O)N2C[C@@H](C)C[C@@H]2c2ccccc2)[nH]1 ZINC000343612321 1046961080 /nfs/dbraw/zinc/96/10/80/1046961080.db2.gz AMHBPUSOPGYYHP-SCLBCKFNSA-N 0 1 319.408 4.095 20 0 DIADMN COc1ccc(-c2cccc(CN(C)Cc3ccccc3)n2)cc1 ZINC001140954820 1046961754 /nfs/dbraw/zinc/96/17/54/1046961754.db2.gz MCMHKECNJKSNJY-UHFFFAOYSA-N 0 1 318.420 4.389 20 0 DIADMN Cc1ccc(C2(NCc3nn(C)c4ccccc34)CCC2)cc1 ZINC000647255332 1046962023 /nfs/dbraw/zinc/96/20/23/1046962023.db2.gz UKWQXJFLSHDCKF-UHFFFAOYSA-N 0 1 305.425 4.051 20 0 DIADMN CC[C@H](NCc1cc2c(cc1OC)OCO2)c1csc(C)c1 ZINC000647254555 1046963098 /nfs/dbraw/zinc/96/30/98/1046963098.db2.gz WZMPHQGSOUWNHS-AWEZNQCLSA-N 0 1 319.426 4.035 20 0 DIADMN Clc1cc(Cl)cc(CN2CCC([C@@H]3CCOC3)CC2)c1 ZINC000680332994 1046963880 /nfs/dbraw/zinc/96/38/80/1046963880.db2.gz HDRQZNIFYVOTTD-CQSZACIVSA-N 0 1 314.256 4.242 20 0 DIADMN Cc1ccc(CN(C)Cc2ccc(OC(F)(F)F)cc2C)cn1 ZINC001140966176 1046964332 /nfs/dbraw/zinc/96/43/32/1046964332.db2.gz SPPPVTVGAGALNE-UHFFFAOYSA-N 0 1 324.346 4.229 20 0 DIADMN Cc1cc(CN2CCC(Oc3ccc(Cl)cc3)CC2)ccn1 ZINC001137408940 1046964327 /nfs/dbraw/zinc/96/43/27/1046964327.db2.gz VRRXIZFITZZYPN-UHFFFAOYSA-N 0 1 316.832 4.087 20 0 DIADMN C[C@@H](NCc1cc2ccccc2s1)c1cc2n(n1)CCCC2 ZINC000647284986 1046967361 /nfs/dbraw/zinc/96/73/61/1046967361.db2.gz YRDKXOZZICAESM-CYBMUJFWSA-N 0 1 311.454 4.285 20 0 DIADMN CCCOc1ncccc1CN[C@H](CC(C)C)c1ccncc1 ZINC000647284924 1046967549 /nfs/dbraw/zinc/96/75/49/1046967549.db2.gz SNEVPZUBDMRCAN-GOSISDBHSA-N 0 1 313.445 4.142 20 0 DIADMN COc1ccc(F)cc1CN[C@@H](CC(C)C)c1ccncc1 ZINC000647300419 1046973258 /nfs/dbraw/zinc/97/32/58/1046973258.db2.gz OEJYGFVAXHAVTP-KRWDZBQOSA-N 0 1 302.393 4.106 20 0 DIADMN Cc1ccccc1-c1noc(CN[C@@H](C)[C@H](C)c2ccccc2)n1 ZINC000680384437 1046976940 /nfs/dbraw/zinc/97/69/40/1046976940.db2.gz FIUAOAQQCIENBA-HOTGVXAUSA-N 0 1 321.424 4.327 20 0 DIADMN CC[C@@H](NCc1ccc(CO)cc1)c1cccc(Cl)c1F ZINC000647322036 1046977369 /nfs/dbraw/zinc/97/73/69/1046977369.db2.gz CNUGGTKNUWDRMS-MRXNPFEDSA-N 0 1 307.796 4.212 20 0 DIADMN Cc1noc([C@@H](C)N[C@@H](C)C(c2ccccc2)c2ccccc2)n1 ZINC000680389116 1046977716 /nfs/dbraw/zinc/97/77/16/1046977716.db2.gz CPWAZRYSHHGIJW-LSDHHAIUSA-N 0 1 321.424 4.249 20 0 DIADMN COc1ccccc1C1(N[C@@H](C)c2ccccc2N(C)C)CC1 ZINC000647329237 1046979061 /nfs/dbraw/zinc/97/90/61/1046979061.db2.gz JRVYTCYIADIGKF-HNNXBMFYSA-N 0 1 310.441 4.101 20 0 DIADMN CCc1nc(C)c([C@H](C)NC2(c3ccccc3OC)CC2)s1 ZINC000647329731 1046980249 /nfs/dbraw/zinc/98/02/49/1046980249.db2.gz VNLPCCKKTWQNTJ-ZDUSSCGKSA-N 0 1 316.470 4.362 20 0 DIADMN CC[C@H]1C[N@@H+](Cc2cccc(C(=O)[O-])c2)CC[C@@H]1c1ccccc1 ZINC000262952586 1046980527 /nfs/dbraw/zinc/98/05/27/1046980527.db2.gz AXFBNZQVRZCRQG-PXNSSMCTSA-N 0 1 323.436 4.401 20 0 DIADMN Oc1cccc2ccc(CN3CCC[C@H]3c3ccc(F)cc3)nc12 ZINC001141019960 1046980574 /nfs/dbraw/zinc/98/05/74/1046980574.db2.gz VFVAMQWEUNJNHB-SFHVURJKSA-N 0 1 322.383 4.417 20 0 DIADMN Oc1cccc2ccc(CN3CCCC[C@H]3c3cccnc3)nc12 ZINC001141023382 1046981158 /nfs/dbraw/zinc/98/11/58/1046981158.db2.gz KJJUFRDEJMALHT-SFHVURJKSA-N 0 1 319.408 4.063 20 0 DIADMN C[C@@H](CCC(C)(C)C)C(=O)NCc1nc2ccc(Cl)cc2[nH]1 ZINC000680438121 1046982208 /nfs/dbraw/zinc/98/22/08/1046982208.db2.gz MMSZZMCENJIHHC-NSHDSACASA-N 0 1 321.852 4.295 20 0 DIADMN CC(C)C[C@H](C[N@H+]1C[C@@H](C(=O)[O-])CC[C@H]1C)c1ccccc1 ZINC000263104666 1046982625 /nfs/dbraw/zinc/98/26/25/1046982625.db2.gz BFHOWZSVFMXQDV-BPQIPLTHSA-N 0 1 303.446 4.001 20 0 DIADMN C[C@@H](NCCCOC(C)(C)C)c1ncc(-c2ccccc2)o1 ZINC000680423201 1046982857 /nfs/dbraw/zinc/98/28/57/1046982857.db2.gz DULQWRPCZMYVFZ-CQSZACIVSA-N 0 1 302.418 4.197 20 0 DIADMN C[C@H](CN[C@@H](c1ccn(C)n1)c1ccc(Cl)cc1)C(C)(C)C ZINC000680466108 1046984797 /nfs/dbraw/zinc/98/47/97/1046984797.db2.gz XYPXDZBTHASBBE-CXAGYDPISA-N 0 1 319.880 4.435 20 0 DIADMN C[C@H](N[C@@H](CCO)c1ccccc1F)c1ccc2c(c1)CCC2 ZINC000647345838 1046985234 /nfs/dbraw/zinc/98/52/34/1046985234.db2.gz OEWHEVRWPBDQLP-XOBRGWDASA-N 0 1 313.416 4.089 20 0 DIADMN C[C@H](N[C@H](CCO)c1ccccc1F)c1cccc(C2CC2)c1 ZINC000647344759 1046985299 /nfs/dbraw/zinc/98/52/99/1046985299.db2.gz YVBUKVIVZDKOMN-VBKZILBWSA-N 0 1 313.416 4.477 20 0 DIADMN CCc1ccc([C@H](C)N[C@@H](CCO)c2ccccc2F)s1 ZINC000647346098 1046985520 /nfs/dbraw/zinc/98/55/20/1046985520.db2.gz RFWNZTZCNNPJLV-LRDDRELGSA-N 0 1 307.434 4.224 20 0 DIADMN C[C@@H]1CC[C@@H](C(=O)[O-])C[N@H+]1CC1CCC(c2ccccc2)CC1 ZINC000263314965 1046985896 /nfs/dbraw/zinc/98/58/96/1046985896.db2.gz IMZCSLCUMBLQLY-JVGQSUMCSA-N 0 1 315.457 4.146 20 0 DIADMN Cc1cc([C@H](C)N[C@H](CCO)c2ccccc2F)cc(C)c1F ZINC000647345005 1046986529 /nfs/dbraw/zinc/98/65/29/1046986529.db2.gz CIAKBLCYFVKHTK-KBXCAEBGSA-N 0 1 319.395 4.356 20 0 DIADMN Cc1cccc(F)c1CN[C@H](C)c1ccnn1-c1ccccc1 ZINC000798929271 1046987263 /nfs/dbraw/zinc/98/72/63/1046987263.db2.gz PAGQMRHVNTXKOY-OAHLLOKOSA-N 0 1 309.388 4.171 20 0 DIADMN OCC[C@@H](N[C@@H]1CCSc2ccccc21)c1ccccc1F ZINC000647346394 1046987699 /nfs/dbraw/zinc/98/76/99/1046987699.db2.gz VPCGQXIWPTVGRK-IAGOWNOFSA-N 0 1 317.429 4.076 20 0 DIADMN Cc1cccc(F)c1CN[C@@H](C)c1ccnn1-c1ccccc1 ZINC000798929270 1046987729 /nfs/dbraw/zinc/98/77/29/1046987729.db2.gz PAGQMRHVNTXKOY-HNNXBMFYSA-N 0 1 309.388 4.171 20 0 DIADMN CCC[C@H](N[C@H](CCO)c1ccccc1F)c1ccccc1 ZINC000647345721 1046987901 /nfs/dbraw/zinc/98/79/01/1046987901.db2.gz MSHCDIAWHZWHFX-RBUKOAKNSA-N 0 1 301.405 4.380 20 0 DIADMN O=C([O-])c1cccc(C[N@H+]2CCC[C@H](c3ccccc3)CC2)c1 ZINC000263378576 1046987967 /nfs/dbraw/zinc/98/79/67/1046987967.db2.gz CLFKLTQLVKHIJP-SFHVURJKSA-N 0 1 309.409 4.155 20 0 DIADMN C[C@H]1C[C@@H](C(=O)[O-])C[N@@H+](CC2CCC(c3ccccc3)CC2)C1 ZINC000263320113 1046988034 /nfs/dbraw/zinc/98/80/34/1046988034.db2.gz JJPWEEXODLOBKG-NHFHULPWSA-N 0 1 315.457 4.003 20 0 DIADMN C[C@H](N[C@H](CCO)c1ccccc1F)c1cccc(Cl)c1 ZINC000647346698 1046988326 /nfs/dbraw/zinc/98/83/26/1046988326.db2.gz ZPOZGPMBXKGMDG-YVEFUNNKSA-N 0 1 307.796 4.253 20 0 DIADMN Cc1c(C[N@H+]2CCC[C@H](C(=O)[O-])C2)sc2c1cccc2Cl ZINC000263434007 1046989955 /nfs/dbraw/zinc/98/99/55/1046989955.db2.gz TWXWVLBMAVSKTD-NSHDSACASA-N 0 1 323.845 4.160 20 0 DIADMN Clc1cccc([C@@H]2CCCN2Cc2ccn3ccnc3c2)c1 ZINC001141046525 1046989980 /nfs/dbraw/zinc/98/99/80/1046989980.db2.gz DMWYIIWVRUQGRB-KRWDZBQOSA-N 0 1 311.816 4.325 20 0 DIADMN Cc1nccnc1[C@H](C)NC1(c2cccc(Cl)c2)CCC1 ZINC000647348923 1046990394 /nfs/dbraw/zinc/99/03/94/1046990394.db2.gz HWPWQQPFZDVBDX-ZDUSSCGKSA-N 0 1 301.821 4.168 20 0 DIADMN Cc1c(C[N@H+]2CCC[C@@H](C(=O)[O-])C2)sc2c1cccc2Cl ZINC000263434004 1046990564 /nfs/dbraw/zinc/99/05/64/1046990564.db2.gz TWXWVLBMAVSKTD-LLVKDONJSA-N 0 1 323.845 4.160 20 0 DIADMN C[N@@H+](Cc1ccc(C(=O)[O-])cc1)[C@@H]1CCC[C@@H]1c1ccccc1 ZINC000263426275 1046990942 /nfs/dbraw/zinc/99/09/42/1046990942.db2.gz QQNAVFOPMGKKDW-RTBURBONSA-N 0 1 309.409 4.153 20 0 DIADMN O=C([O-])c1ccc(C[N@H+]2C[C@H](c3ccccc3)[C@@H]3CCC[C@H]32)cc1 ZINC000263434632 1046991080 /nfs/dbraw/zinc/99/10/80/1046991080.db2.gz UCHWYADBSXTRRQ-XUVXKRRUSA-N 0 1 321.420 4.153 20 0 DIADMN COc1cc2c(cc1F)CC[C@H]2N[C@@H](C)c1ccc(Cl)nc1 ZINC000798934401 1046991150 /nfs/dbraw/zinc/99/11/50/1046991150.db2.gz FSDABUPNSYJDPN-ZUZCIYMTSA-N 0 1 320.795 4.221 20 0 DIADMN C[C@@H]1SCC[C@H]1N[C@H](c1cc2ccccc2o1)c1cccnc1 ZINC000647359853 1046992552 /nfs/dbraw/zinc/99/25/52/1046992552.db2.gz MGTPEPVMECEDFG-CRFBAAHOSA-N 0 1 324.449 4.401 20 0 DIADMN Cc1ccc(-c2ccc(C[N@H+]3CC[C@@](C)(C(=O)[O-])C3)s2)cc1 ZINC000263497830 1046992535 /nfs/dbraw/zinc/99/25/35/1046992535.db2.gz KAQFUPBHXNAASV-GOSISDBHSA-N 0 1 315.438 4.020 20 0 DIADMN O=C(Nc1nc(-c2cccs2)n[nH]1)c1cccc(C2CCC2)c1 ZINC000798950999 1046992992 /nfs/dbraw/zinc/99/29/92/1046992992.db2.gz NOZAXYUZIYJXRX-UHFFFAOYSA-N 0 1 324.409 4.053 20 0 DIADMN Clc1ccc(CN2CC[C@H](c3ccccn3)C2)cc1Cl ZINC000798963282 1046993197 /nfs/dbraw/zinc/99/31/97/1046993197.db2.gz BXRQITDLCJLDMQ-ZDUSSCGKSA-N 0 1 307.224 4.378 20 0 DIADMN Cc1cc(C)cc(-c2ccc(C[N@H+]3CCC[C@@H]3C(=O)[O-])cc2)c1 ZINC000263424698 1046993458 /nfs/dbraw/zinc/99/34/58/1046993458.db2.gz QBEVXANIYKNVBP-LJQANCHMSA-N 0 1 309.409 4.019 20 0 DIADMN 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1 319.246 4.346 20 0 DIADMN c1coc(CN(CC[C@@H]2CCCCO2)Cc2cccs2)c1 ZINC000347401742 1047000846 /nfs/dbraw/zinc/00/08/46/1047000846.db2.gz RKUSDHYKWFQORS-HNNXBMFYSA-N 0 1 305.443 4.303 20 0 DIADMN Cc1cc2ccccc2c(NC(=O)[C@H]2c3cn[nH]c3CC[C@@H]2C)c1 ZINC001141077367 1047001470 /nfs/dbraw/zinc/00/14/70/1047001470.db2.gz UKMFJWPMOCGQBX-ORAYPTAESA-N 0 1 319.408 4.176 20 0 DIADMN C[C@@H]1C[C@@H](C)CCN1Cc1ccncc1NC(=O)OC(C)(C)C ZINC001141086156 1047002755 /nfs/dbraw/zinc/00/27/55/1047002755.db2.gz YOGKCGFCDKIMTL-UONOGXRCSA-N 0 1 319.449 4.049 20 0 DIADMN Clc1cnc(CN[C@@H](c2ccccc2)C2CCCC2)cn1 ZINC000799137347 1047002660 /nfs/dbraw/zinc/00/26/60/1047002660.db2.gz WEPLTSYEMHTBJO-KRWDZBQOSA-N 0 1 301.821 4.151 20 0 DIADMN CC[C@H](C)CCC(=O)N[C@H](C)c1nc2ccc(Cl)cc2[nH]1 ZINC000796382839 1047009651 /nfs/dbraw/zinc/00/96/51/1047009651.db2.gz HRNSRWSLZXXHFL-WDEREUQCSA-N 0 1 307.825 4.220 20 0 DIADMN CC(C)[C@H]1COCCN1Cc1ccccc1-c1cccs1 ZINC001141097075 1047011524 /nfs/dbraw/zinc/01/15/24/1047011524.db2.gz 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Cc1ccccc1[C@H](NCc1cnccn1)C1CCC(C)CC1 ZINC000838954634 1047177501 /nfs/dbraw/zinc/17/75/01/1047177501.db2.gz MYVAJLQSVBVUBW-MKJPBZQASA-N 0 1 309.457 4.442 20 0 DIADMN C[C@H](NC1(C2CCC2)CC1)c1nnc(-c2cccc(Cl)c2)o1 ZINC000649807016 1047177396 /nfs/dbraw/zinc/17/73/96/1047177396.db2.gz ITKOXEWFLDXFGK-NSHDSACASA-N 0 1 317.820 4.373 20 0 DIADMN CCO[C@@H]1C[C@H](N[C@@H](C)c2csc(CC)n2)C1(CC)CC ZINC000537400182 1047179121 /nfs/dbraw/zinc/17/91/21/1047179121.db2.gz NFYSSGNGKKBIGT-AEGPPILISA-N 0 1 310.507 4.340 20 0 DIADMN c1ccc2c(c1)OC1(CCC1)C[C@@H]2NCc1ccc2c(n1)CCC2 ZINC000838981837 1047179159 /nfs/dbraw/zinc/17/91/59/1047179159.db2.gz SWFQYESWRXFNBJ-IBGZPJMESA-N 0 1 320.436 4.106 20 0 DIADMN Cc1nc(F)ccc1CN1C[C@H]2CCCC[C@@]21c1ccccc1 ZINC001116828252 1047180948 /nfs/dbraw/zinc/18/09/48/1047180948.db2.gz ZLJQLKFPWZFLNW-UYAOXDASSA-N 0 1 310.416 4.430 20 0 DIADMN COc1ccc(C2(N[C@H](C)c3cc(F)c(F)c(F)c3)CC2)cc1 ZINC000537422602 1047183174 /nfs/dbraw/zinc/18/31/74/1047183174.db2.gz 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/nfs/dbraw/zinc/19/57/39/1047195739.db2.gz BILUBLTVTUZXFS-ZIAGYGMSSA-N 0 1 311.828 4.118 20 0 DIADMN COc1ccc2c(c1)[C@H](N[C@H](C)c1cnccc1C)CCS2 ZINC000682435657 1047196152 /nfs/dbraw/zinc/19/61/52/1047196152.db2.gz CEQGGJBEJIHKBB-CXAGYDPISA-N 0 1 314.454 4.286 20 0 DIADMN CN(Cc1nnc(C(C)(C)C)o1)[C@@H]1CCC[C@H]1c1ccccc1 ZINC000839170600 1047202132 /nfs/dbraw/zinc/20/21/32/1047202132.db2.gz OQRVAXFOMCBRPO-JKSUJKDBSA-N 0 1 313.445 4.135 20 0 DIADMN Cc1ccccc1[C@H](O)C1CCN(Cc2ccccc2F)CC1 ZINC000796411721 1047203299 /nfs/dbraw/zinc/20/32/99/1047203299.db2.gz ALTHMVNOBLCRMZ-HXUWFJFHSA-N 0 1 313.416 4.080 20 0 DIADMN F[C@H]1CCN(Cc2ccc3cc(Br)ccc3c2)C1 ZINC001141614074 1047225891 /nfs/dbraw/zinc/22/58/91/1047225891.db2.gz MFCHAHQVHSDHDY-HNNXBMFYSA-N 0 1 308.194 4.146 20 0 DIADMN Cc1cc(C)c(CN[C@@H]2C[C@H](C)Sc3sccc32)cn1 ZINC000397022081 1047207370 /nfs/dbraw/zinc/20/73/70/1047207370.db2.gz MJIALVXBFLEQGM-SWLSCSKDSA-N 0 1 304.484 4.475 20 0 DIADMN COc1cc(CN(C)Cc2ccc(Cl)cc2)cc(F)c1OC ZINC001137506441 1047222765 /nfs/dbraw/zinc/22/27/65/1047222765.db2.gz VCVNLRWUQCIKGF-UHFFFAOYSA-N 0 1 323.795 4.128 20 0 DIADMN CCCc1[nH]ncc1C(=O)Nc1cccc(-c2ccccc2)c1 ZINC001117286485 1047225984 /nfs/dbraw/zinc/22/59/84/1047225984.db2.gz LEDBKMSVMKCHIT-UHFFFAOYSA-N 0 1 305.381 4.282 20 0 DIADMN C=C/C(C)=C\CC(=O)Nc1ccccc1-c1nnc(C(C)C)[nH]1 ZINC000682829772 1047227607 /nfs/dbraw/zinc/22/76/07/1047227607.db2.gz UFVVUZHHWOEYMZ-RAXLEYEMSA-N 0 1 310.401 4.056 20 0 DIADMN Fc1cc2ncccc2cc1CN1CCC[C@@H]1c1cccnc1 ZINC001141620975 1047230574 /nfs/dbraw/zinc/23/05/74/1047230574.db2.gz NATISMVULLUTBA-LJQANCHMSA-N 0 1 307.372 4.106 20 0 DIADMN CCCCC[C@H](C(=O)N1CCC(c2cc(C)[nH]n2)CC1)C(C)C ZINC000760428577 1047231544 /nfs/dbraw/zinc/23/15/44/1047231544.db2.gz UMZYGPZFNHEQPA-KRWDZBQOSA-N 0 1 319.493 4.277 20 0 DIADMN CCCCCC(C)(C)C(=O)N1CCC(c2cc(C)[nH]n2)CC1 ZINC000760425254 1047231898 /nfs/dbraw/zinc/23/18/98/1047231898.db2.gz AXRYCWQHEQDZLG-UHFFFAOYSA-N 0 1 305.466 4.031 20 0 DIADMN CS[C@@H]1CC[C@H](N(C)Cc2ccnc(Cl)c2Cl)C1 ZINC001117642231 1047233030 /nfs/dbraw/zinc/23/30/30/1047233030.db2.gz WGHJDHROUCNKIN-WDEREUQCSA-N 0 1 305.274 4.104 20 0 DIADMN CCN(Cc1ccc(F)cc1)Cc1cc(F)c(OC)c(OC)c1 ZINC001137509257 1047235270 /nfs/dbraw/zinc/23/52/70/1047235270.db2.gz DXFHINWRNKYQEO-UHFFFAOYSA-N 0 1 321.367 4.004 20 0 DIADMN CN(C)Cc1ccc(N[C@H]2CCCc3c(O)cccc32)cc1F ZINC001117656851 1047235310 /nfs/dbraw/zinc/23/53/10/1047235310.db2.gz QKWSMDCTLJFTEM-SFHVURJKSA-N 0 1 314.404 4.082 20 0 DIADMN Fc1cc2ncccc2cc1C[N@H+]1CCC[C@H]1c1ccccn1 ZINC001141628946 1047237068 /nfs/dbraw/zinc/23/70/68/1047237068.db2.gz PKUJKXDHGLSYIS-IBGZPJMESA-N 0 1 307.372 4.106 20 0 DIADMN Fc1cc2ncccc2cc1CN1CCC[C@H]1c1ccccn1 ZINC001141628946 1047237080 /nfs/dbraw/zinc/23/70/80/1047237080.db2.gz PKUJKXDHGLSYIS-IBGZPJMESA-N 0 1 307.372 4.106 20 0 DIADMN Oc1ccc2c(c1)[C@H](NCc1cccc(Cl)c1F)CCC2 ZINC001117696905 1047238006 /nfs/dbraw/zinc/23/80/06/1047238006.db2.gz DATDUYKQGZPGDI-MRXNPFEDSA-N 0 1 305.780 4.352 20 0 DIADMN C[C@@H]1Cc2ccccc2CN1Cc1cc2cccnc2cc1F ZINC001141634552 1047241295 /nfs/dbraw/zinc/24/12/95/1047241295.db2.gz IEEJIWDWLMVPTI-CQSZACIVSA-N 0 1 306.384 4.321 20 0 DIADMN Fc1ccc(C2(NCc3ccc(Br)o3)CCC2)cc1 ZINC000682940732 1047242083 /nfs/dbraw/zinc/24/20/83/1047242083.db2.gz DDNCGWUQCJJXTO-UHFFFAOYSA-N 0 1 324.193 4.350 20 0 DIADMN Cc1cc2[nH]ncc2cc1NC(=O)c1cc2cccc(F)c2o1 ZINC000682956428 1047245285 /nfs/dbraw/zinc/24/52/85/1047245285.db2.gz XZCQCGVOQROTMN-UHFFFAOYSA-N 0 1 309.300 4.009 20 0 DIADMN Cc1cc2[nH]ncc2cc1NC(=O)c1ccc(-c2ccco2)s1 ZINC000682955566 1047245384 /nfs/dbraw/zinc/24/53/84/1047245384.db2.gz HZYKSTJMQLNIIE-UHFFFAOYSA-N 0 1 323.377 4.445 20 0 DIADMN COc1ccc2c(c1)OCC[C@@H]2NCc1cccc2ccoc21 ZINC001117791145 1047245583 /nfs/dbraw/zinc/24/55/83/1047245583.db2.gz QDKIFRRHOUSQPJ-KRWDZBQOSA-N 0 1 309.365 4.055 20 0 DIADMN C[C@@H](NCC[C@@H](O)c1ccccc1)c1c(F)cccc1Cl ZINC000839542405 1047246016 /nfs/dbraw/zinc/24/60/16/1047246016.db2.gz LFPNWWFYSOAIIZ-MLGOLLRUSA-N 0 1 307.796 4.253 20 0 DIADMN CC(C)c1ccc(C[N@H+](CC(=O)[O-])CC2CC2)c(C(C)C)c1 ZINC000650510693 1047246002 /nfs/dbraw/zinc/24/60/02/1047246002.db2.gz MNPDZGNGJNHGBM-UHFFFAOYSA-N 0 1 303.446 4.230 20 0 DIADMN COc1cc(C)nc(CN[C@@H](C)c2csc3ccccc23)c1 ZINC000839554476 1047246364 /nfs/dbraw/zinc/24/63/64/1047246364.db2.gz YYCOIAVDTXPSMP-ZDUSSCGKSA-N 0 1 312.438 4.464 20 0 DIADMN C[C@H]1Cc2ccccc2CN1Cc1ccc2cc(F)ccc2n1 ZINC001141650843 1047246993 /nfs/dbraw/zinc/24/69/93/1047246993.db2.gz KSQITHSLJUEMSA-AWEZNQCLSA-N 0 1 306.384 4.321 20 0 DIADMN CC(C)(C)c1ccc2c(c1)CCN2C(=O)c1cc2cccnc2[nH]1 ZINC000839619308 1047251955 /nfs/dbraw/zinc/25/19/55/1047251955.db2.gz TYHXYDOVUCFQDK-UHFFFAOYSA-N 0 1 319.408 4.063 20 0 DIADMN Cc1ccnc(CN2CCC(c3cccc(F)c3F)CC2)c1 ZINC000683025966 1047261459 /nfs/dbraw/zinc/26/14/59/1047261459.db2.gz YCGCAUKXQYTTJO-UHFFFAOYSA-N 0 1 302.368 4.048 20 0 DIADMN CCc1c(NC(=O)[C@H](C)CC(C)(C)C)[nH]nc1-c1ccncc1 ZINC000476238725 1047266935 /nfs/dbraw/zinc/26/69/35/1047266935.db2.gz ZKURGQCUSZAKQQ-GFCCVEGCSA-N 0 1 314.433 4.045 20 0 DIADMN CN[C@H](CC(C)(C)C)c1nc(-c2cc(C)c3ccccc3n2)no1 ZINC000386710960 1047278821 /nfs/dbraw/zinc/27/88/21/1047278821.db2.gz XBAHCSSIJNGOFM-MRXNPFEDSA-N 0 1 324.428 4.290 20 0 DIADMN CC[C@@H](C(=O)[O-])[N@@H+](C)Cc1ccc(-c2ccc(Cl)cc2)cc1 ZINC000650805710 1047281576 /nfs/dbraw/zinc/28/15/76/1047281576.db2.gz IGGTZXUPKQUKEP-KRWDZBQOSA-N 0 1 317.816 4.302 20 0 DIADMN CC[C@H](C(=O)[O-])[N@@H+](C)Cc1ccc(-c2ccc(C)cc2)s1 ZINC000650806657 1047282407 /nfs/dbraw/zinc/28/24/07/1047282407.db2.gz FZBQZYXXQKZUMX-OAHLLOKOSA-N 0 1 303.427 4.019 20 0 DIADMN CC(C)(C(=O)[O-])[C@@H]1CCC[N@@H+](Cc2csc3ccccc23)C1 ZINC000387560297 1047282774 /nfs/dbraw/zinc/28/27/74/1047282774.db2.gz KBRKAEURFFATFP-CQSZACIVSA-N 0 1 317.454 4.224 20 0 DIADMN CCC[C@@H](C(=O)NOC/C=C/Cl)c1cccc(Cl)c1 ZINC001141763293 1047287508 /nfs/dbraw/zinc/28/75/08/1047287508.db2.gz MKTLLSVNZBEWCK-FLUIGGAXSA-N 0 1 302.201 4.024 20 0 DIADMN COc1cc(CN[C@H](C)c2cncs2)cc(C(F)(F)F)c1 ZINC000897931395 1047297297 /nfs/dbraw/zinc/29/72/97/1047297297.db2.gz YOAVDGVSCGMZAQ-SECBINFHSA-N 0 1 316.348 4.021 20 0 DIADMN Cc1ccc2cc(CN[C@@H]3CCCc4cn(C(C)C)nc43)[nH]c2c1 ZINC001118482765 1047299030 /nfs/dbraw/zinc/29/90/30/1047299030.db2.gz SKEKFZBAABGGMS-GOSISDBHSA-N 0 1 322.456 4.421 20 0 DIADMN CCCCOc1cc(CN[C@H](C)c2cncs2)ccc1OC ZINC000897934367 1047300514 /nfs/dbraw/zinc/30/05/14/1047300514.db2.gz IMIMEIZTAZUQBC-CYBMUJFWSA-N 0 1 320.458 4.181 20 0 DIADMN COc1ccc(F)cc1[C@@H](C)NCc1cccc2c1NCCC2 ZINC000390844892 1047301131 /nfs/dbraw/zinc/30/11/31/1047301131.db2.gz CVQITAKFZPEIHI-CYBMUJFWSA-N 0 1 314.404 4.043 20 0 DIADMN C[C@H](NCc1ccc(CC(F)(F)F)cc1)c1cncs1 ZINC000897929934 1047301412 /nfs/dbraw/zinc/30/14/12/1047301412.db2.gz FABFQVUOIKSNGC-JTQLQIEISA-N 0 1 300.349 4.099 20 0 DIADMN Cc1nc(SCc2cc3n(n2)CCCC3)[nH]c1-c1ccccc1 ZINC000651193716 1047301534 /nfs/dbraw/zinc/30/15/34/1047301534.db2.gz FNAVSFXYQLCGCF-UHFFFAOYSA-N 0 1 324.453 4.210 20 0 DIADMN O=C(Nc1ccc(F)c(F)c1O)c1ccccc1C1CCC1 ZINC001141879944 1047303787 /nfs/dbraw/zinc/30/37/87/1047303787.db2.gz KXLDXAFVYLXRLO-UHFFFAOYSA-N 0 1 303.308 4.190 20 0 DIADMN CC(C)(C)c1coc(CN[C@H]2CCC[C@H](c3cccnc3)C2)n1 ZINC000897944739 1047304673 /nfs/dbraw/zinc/30/46/73/1047304673.db2.gz RWLXJVXCIZKHMV-HOCLYGCPSA-N 0 1 313.445 4.183 20 0 DIADMN CC(C)(C)c1coc(CN[C@H]2CCC[C@H](C3CCOCC3)C2)n1 ZINC000897942078 1047304945 /nfs/dbraw/zinc/30/49/45/1047304945.db2.gz KVWOOTOWOJFSSA-HOTGVXAUSA-N 0 1 320.477 4.047 20 0 DIADMN Cc1cc([C@@H](C)N[C@H](Cn2cccn2)c2ccccc2)cs1 ZINC000651236251 1047305181 /nfs/dbraw/zinc/30/51/81/1047305181.db2.gz QXDGIRNAFUYEEQ-CRAIPNDOSA-N 0 1 311.454 4.345 20 0 DIADMN Cc1noc2ncc(CN[C@@H](c3ncccc3C)C(C)(C)C)cc12 ZINC000897994133 1047306753 /nfs/dbraw/zinc/30/67/53/1047306753.db2.gz MRAJLTYYSZTJDI-KRWDZBQOSA-N 0 1 324.428 4.112 20 0 DIADMN Cc1cccnc1[C@@H](NCc1ccnc(F)c1C)C(C)(C)C ZINC000897995047 1047306847 /nfs/dbraw/zinc/30/68/47/1047306847.db2.gz VXQAQTTYLVCDKE-MRXNPFEDSA-N 0 1 301.409 4.110 20 0 DIADMN Cc1cccnc1[C@H](NCc1ccc2c(n1)CCC2)C(C)(C)C ZINC000897994299 1047308139 /nfs/dbraw/zinc/30/81/39/1047308139.db2.gz FIDRUHBZSZIUNZ-IBGZPJMESA-N 0 1 309.457 4.151 20 0 DIADMN Cc1cccnc1[C@@H](NCc1cc2cccnc2o1)C(C)(C)C ZINC000897996147 1047309944 /nfs/dbraw/zinc/30/99/44/1047309944.db2.gz XSKHNTXTWJAWRM-QGZVFWFLSA-N 0 1 309.413 4.408 20 0 DIADMN CCCCC[C@H](CC)C(=O)NC[C@@H](c1ccc(F)cc1)N(C)C ZINC001141922716 1047310456 /nfs/dbraw/zinc/31/04/56/1047310456.db2.gz ZMACOVKZNLZRKH-YJBOKZPZSA-N 0 1 322.468 4.151 20 0 DIADMN CC[C@@H](NCc1nnc(C2CC2)[nH]1)c1cccc2ccccc21 ZINC000651390337 1047312447 /nfs/dbraw/zinc/31/24/47/1047312447.db2.gz HYOYMLIBUYVKEC-QGZVFWFLSA-N 0 1 306.413 4.076 20 0 DIADMN Fc1cccc(OC2CCN(Cc3cccn3C3CC3)CC2)c1 ZINC001118883997 1047315157 /nfs/dbraw/zinc/31/51/57/1047315157.db2.gz QFBVYMJLMSHRHN-UHFFFAOYSA-N 0 1 314.404 4.006 20 0 DIADMN CC(C)CCc1ccccc1NC(=O)[C@@H](C)[N@@H+]1[C@H](C)CC[C@@H]1C ZINC001142531900 1047317502 /nfs/dbraw/zinc/31/75/02/1047317502.db2.gz PGSMXUUJKOMKET-IXDOHACOSA-N 0 1 316.489 4.475 20 0 DIADMN CSc1ccc(Cl)cc1NC(=S)NC1(C)CCC1 ZINC000840718986 1047320623 /nfs/dbraw/zinc/32/06/23/1047320623.db2.gz HQNOCXUGXAFORC-UHFFFAOYSA-N 0 1 300.880 4.291 20 0 DIADMN c1c2cnccc2oc1CN1CCSC[C@H]1c1ccccc1 ZINC000651612495 1047320665 /nfs/dbraw/zinc/32/06/65/1047320665.db2.gz QYKZPMHAFZYMMU-KRWDZBQOSA-N 0 1 310.422 4.118 20 0 DIADMN CCOc1ccccc1[C@@H](CC)NCc1cc2cnccc2o1 ZINC000651694051 1047321737 /nfs/dbraw/zinc/32/17/37/1047321737.db2.gz OGMWMMKHJPZFBX-QGZVFWFLSA-N 0 1 310.397 4.467 20 0 DIADMN COCc1cc(CNCc2ccc(C)cc2Cl)ccc1F ZINC000651701677 1047321781 /nfs/dbraw/zinc/32/17/81/1047321781.db2.gz YDJCYPSDQWLMNH-UHFFFAOYSA-N 0 1 307.796 4.224 20 0 DIADMN CCC[C@@](C)(O)CNCc1c(Cl)ccc(Cl)c1Cl ZINC000226249647 1047322587 /nfs/dbraw/zinc/32/25/87/1047322587.db2.gz OQTCFOFXQNEDRL-CYBMUJFWSA-N 0 1 310.652 4.288 20 0 DIADMN COc1ccc(CNC2(c3ccc(F)cc3)CCC2)c(F)c1 ZINC000651694406 1047323580 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COC1(CSc2nc(C)c(-c3ccccc3)[nH]2)CCCC1 ZINC000478727874 1047810155 /nfs/dbraw/zinc/81/01/55/1047810155.db2.gz WCZRZCVQOLWGOW-UHFFFAOYSA-N 0 1 302.443 4.436 20 0 DIADMN CCC1(C)CN(C(=O)c2cc(-c3ccc4ccccc4c3)[nH]n2)C1 ZINC001159118677 1047814838 /nfs/dbraw/zinc/81/48/38/1047814838.db2.gz FIAXMGIWJLHNJE-UHFFFAOYSA-N 0 1 319.408 4.102 20 0 DIADMN CCCCCC[C@@H](C)CC(=O)Nc1c2nn[nH]c2ccc1C ZINC001159304284 1047827808 /nfs/dbraw/zinc/82/78/08/1047827808.db2.gz DIDXCUFDSUNJNZ-GFCCVEGCSA-N 0 1 302.422 4.201 20 0 DIADMN FC(F)(F)c1cccc(Nc2cc([C@@H]3CCCCN3)no2)c1 ZINC001159308573 1047829236 /nfs/dbraw/zinc/82/92/36/1047829236.db2.gz KWWMVMFLTYHNDM-LBPRGKRZSA-N 0 1 311.307 4.252 20 0 DIADMN CC(C)c1ccc(Nc2cc([C@H]3CCCCN3)no2)c(Cl)n1 ZINC001159311739 1047830484 /nfs/dbraw/zinc/83/04/84/1047830484.db2.gz PHTCJRHWCPNQQC-GFCCVEGCSA-N 0 1 320.824 4.405 20 0 DIADMN CCCOc1ccccc1Nc1cc([C@H]2CCCCN2)no1 ZINC001159312371 1047830685 /nfs/dbraw/zinc/83/06/85/1047830685.db2.gz ABIGGHRPPVYTLK-CYBMUJFWSA-N 0 1 301.390 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C[C@@H](NCCCC(C)(F)F)c1nc(C2CCCCC2)no1 ZINC001335787467 1054224252 /nfs/dbraw/zinc/22/42/52/1054224252.db2.gz WAZZIDMWFDWIEI-LLVKDONJSA-N 0 1 301.381 4.203 20 0 DIADMN CSc1cccc(Cl)c1C[N@@H+](C(C)C)C1CCOCC1 ZINC001233353490 1054247407 /nfs/dbraw/zinc/24/74/07/1054247407.db2.gz XZYDJXFDBAEJGI-UHFFFAOYSA-N 0 1 313.894 4.451 20 0 DIADMN Clc1ccc(CN2CCC(n3cnc4ccccc43)CC2)o1 ZINC001233318257 1054227670 /nfs/dbraw/zinc/22/76/70/1054227670.db2.gz WVRAVMXSUGIQOK-UHFFFAOYSA-N 0 1 315.804 4.120 20 0 DIADMN Cc1c([C@H](C)N[C@H]2CCc3cc(Cl)cc(Cl)c32)cnn1C ZINC001335973897 1054229062 /nfs/dbraw/zinc/22/90/62/1054229062.db2.gz ZJYVSBVRXLOXRJ-VFZGTOFNSA-N 0 1 324.255 4.373 20 0 DIADMN CCNc1ccccc1CN[C@@H]1CCCc2cnn(C(C)C)c21 ZINC001336264524 1054235416 /nfs/dbraw/zinc/23/54/16/1054235416.db2.gz YYNDEJHQKNMIPH-GOSISDBHSA-N 0 1 312.461 4.063 20 0 DIADMN Cc1cccc(CCC(=O)Nc2nc3ccc(Cl)cc3[nH]2)c1 ZINC001439084801 1054237667 /nfs/dbraw/zinc/23/76/67/1054237667.db2.gz IHEREHHCQSGPOL-UHFFFAOYSA-N 0 1 313.788 4.096 20 0 DIADMN CN(CCC(F)(F)F)Cc1cc2nc(Cl)ccc2s1 ZINC001336720424 1054244715 /nfs/dbraw/zinc/24/47/15/1054244715.db2.gz INWWFRLYMLEPGS-UHFFFAOYSA-N 0 1 308.756 4.334 20 0 DIADMN Cc1ncc([C@@H](C)N[C@H](C)c2ccc(Cl)c(F)c2)c(C)n1 ZINC001336709368 1054244997 /nfs/dbraw/zinc/24/49/97/1054244997.db2.gz VVZHZGZRTSIEQV-NXEZZACHSA-N 0 1 307.800 4.298 20 0 DIADMN C[C@@H](NC[C@@H]1CCC2(CCC2)O1)c1nc(C(C)(C)C)cs1 ZINC001336776494 1054246905 /nfs/dbraw/zinc/24/69/05/1054246905.db2.gz VLQSGLNDGOGHSS-OLZOCXBDSA-N 0 1 308.491 4.193 20 0 DIADMN C[C@@H](NC[C@H]1CCC2(CCC2)O1)c1nc(C(C)(C)C)cs1 ZINC001336776480 1054247714 /nfs/dbraw/zinc/24/77/14/1054247714.db2.gz VLQSGLNDGOGHSS-CHWSQXEVSA-N 0 1 308.491 4.193 20 0 DIADMN CSc1cccc(Cl)c1C[N@H+]1CC[C@@]2(C1)CCCOC2 ZINC001233353312 1054248636 /nfs/dbraw/zinc/24/86/36/1054248636.db2.gz OMPNLSSDVMCQCW-MRXNPFEDSA-N 0 1 311.878 4.064 20 0 DIADMN Cc1ncc(CN2CC[C@@H](c3ccc(Cl)c(Cl)c3)C2)o1 ZINC001233367488 1054251600 /nfs/dbraw/zinc/25/16/00/1054251600.db2.gz 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Cc1ccccc1CN(C)Cc1ccn(C(=O)OC(C)(C)C)c1 ZINC001233431958 1054269336 /nfs/dbraw/zinc/26/93/36/1054269336.db2.gz SBTHYYQBERDXON-UHFFFAOYSA-N 0 1 314.429 4.212 20 0 DIADMN CCc1ccc([C@H](C)C(=O)Nc2cc(F)cc(Cl)c2O)cc1 ZINC000622519192 1054270017 /nfs/dbraw/zinc/27/00/17/1054270017.db2.gz UDZQPYGXZUIQJD-JTQLQIEISA-N 0 1 321.779 4.489 20 0 DIADMN CC(C)C1CCN(Cc2ccn(C(=O)OC(C)(C)C)c2)CC1 ZINC001233432949 1054270015 /nfs/dbraw/zinc/27/00/15/1054270015.db2.gz HEDNUZGMEXPHGI-UHFFFAOYSA-N 0 1 306.450 4.139 20 0 DIADMN Cc1ccc(CN(C)Cc2ccn(C(=O)OC(C)(C)C)c2)cc1 ZINC001233431972 1054270373 /nfs/dbraw/zinc/27/03/73/1054270373.db2.gz TUUSLSXZVIEKFD-UHFFFAOYSA-N 0 1 314.429 4.212 20 0 DIADMN Brc1cc(CN2CCC(c3ccccc3)CC2)c[nH]1 ZINC001233434861 1054271565 /nfs/dbraw/zinc/27/15/65/1054271565.db2.gz FKXDUISNTKUHCZ-UHFFFAOYSA-N 0 1 319.246 4.157 20 0 DIADMN CC1CC([N@@H+](C)Cc2cc(Br)c(Cl)cc2F)C1 ZINC001233439939 1054274558 /nfs/dbraw/zinc/27/45/58/1054274558.db2.gz XHFZEDLBEBMVON-UHFFFAOYSA-N 0 1 320.633 4.472 20 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C[C@H](NCCc1ccc(F)cc1)c1nc(C2CCCCC2)no1 ZINC001560805687 1060666611 /nfs/dbraw/zinc/66/66/11/1060666611.db2.gz BYMVCHGBSDVYSF-ZDUSSCGKSA-N 0 1 317.408 4.150 20 0 DIADMN Cc1nc(C2CCN(Cc3ccc(C)c(Cl)c3C)CC2)no1 ZINC001250195893 1060674969 /nfs/dbraw/zinc/67/49/69/1060674969.db2.gz BTZAOMXPARJHHU-UHFFFAOYSA-N 0 1 319.836 4.028 20 0 DIADMN Cc1[nH]nc2ccc(Cc3ccc(OC(F)(F)F)cc3)cc12 ZINC001250199017 1060677665 /nfs/dbraw/zinc/67/76/65/1060677665.db2.gz BJJWMLBJFBCQHY-UHFFFAOYSA-N 0 1 306.287 4.361 20 0 DIADMN COc1c(C)cc(Br)cc1CN1CCC2(CCC2)C1 ZINC001250223532 1060702829 /nfs/dbraw/zinc/70/28/29/1060702829.db2.gz VAZBJUHZDHALKB-UHFFFAOYSA-N 0 1 324.262 4.142 20 0 DIADMN CCOc1cc(Nc2nc(C(C)(C)C)ns2)c(Cl)cn1 ZINC001250210062 1060690939 /nfs/dbraw/zinc/69/09/39/1060690939.db2.gz JUUKNWSMYUHGGK-UHFFFAOYSA-N 0 1 312.826 4.026 20 0 DIADMN CO[C@@H]1CCN(Cc2ccc(Cl)c(C)c2Cl)C[C@H]1C ZINC001560840566 1060697716 /nfs/dbraw/zinc/69/77/16/1060697716.db2.gz URRIDKZWGNRDFR-QMTHXVAHSA-N 0 1 302.245 4.159 20 0 DIADMN CCCCC[C@@H](C)N[C@@H](CCNC(=O)OC(C)(C)C)C(F)F ZINC001560841283 1060697989 /nfs/dbraw/zinc/69/79/89/1060697989.db2.gz NVUQXMGGGBDFPO-OLZOCXBDSA-N 0 1 322.440 4.093 20 0 DIADMN COc1nsc(CN2CCC[C@]2(C)CC(C)C)c1Cl ZINC001560844645 1060700032 /nfs/dbraw/zinc/70/00/32/1060700032.db2.gz KFTXWUCXDXKFCJ-CQSZACIVSA-N 0 1 302.871 4.206 20 0 DIADMN Cc1[nH]nc2cc(Cc3cccc(OC(F)(F)F)c3)ccc12 ZINC001250222430 1060700821 /nfs/dbraw/zinc/70/08/21/1060700821.db2.gz MVJQKOMLZFUXJB-UHFFFAOYSA-N 0 1 306.287 4.361 20 0 DIADMN CCOc1ccc(Cl)cc1CN1CCC(C)(OCC)CC1 ZINC001560855948 1060714073 /nfs/dbraw/zinc/71/40/73/1060714073.db2.gz FZVZQOSUNYODRG-UHFFFAOYSA-N 0 1 311.853 4.130 20 0 DIADMN CC(C)[C@@H]1CN(Cc2ccc(Oc3ccccc3)o2)CCCO1 ZINC001560857658 1060714267 /nfs/dbraw/zinc/71/42/67/1060714267.db2.gz FQYAENSKKJJKNX-SFHVURJKSA-N 0 1 315.413 4.319 20 0 DIADMN C[C@@H]1CCc2nc(CN3CCC(C)(C4CC4)CC3)sc2C1 ZINC001560862075 1060718860 /nfs/dbraw/zinc/71/88/60/1060718860.db2.gz FZEVGCCIBAQTDR-CYBMUJFWSA-N 0 1 304.503 4.280 20 0 DIADMN C[C@H](CN1Cc2ccccc2O[C@@H](C)C1)c1cc(F)cc(F)c1 ZINC001560861894 1060720296 /nfs/dbraw/zinc/72/02/96/1060720296.db2.gz ZZNCMNSXNORSFR-KGLIPLIRSA-N 0 1 317.379 4.351 20 0 DIADMN CCc1ccc(CN2CC(Cc3c(F)cccc3F)C2)cc1 ZINC001560875626 1060736491 /nfs/dbraw/zinc/73/64/91/1060736491.db2.gz YISVFUDPAABRDE-UHFFFAOYSA-N 0 1 301.380 4.202 20 0 DIADMN FC(F)(F)c1ccc(CN2CCC[C@@]3(CCSC3)C2)s1 ZINC001560883005 1060743488 /nfs/dbraw/zinc/74/34/88/1060743488.db2.gz GPXJUSNEXPWSLK-CYBMUJFWSA-N 0 1 321.433 4.486 20 0 DIADMN C[C@@H](C(=O)OC(C)(C)C)N(C[C@H]1CCCC(C)(C)C1)C1CC1 ZINC001560882119 1060744469 /nfs/dbraw/zinc/74/44/69/1060744469.db2.gz ZJZKIKFHPZYXPX-GJZGRUSLSA-N 0 1 309.494 4.397 20 0 DIADMN Cc1cc(F)ccc1[C@H]1CCCN1Cc1cccc(F)c1N ZINC001560885083 1060746993 /nfs/dbraw/zinc/74/69/93/1060746993.db2.gz RHVMEXNJHJKJAZ-QGZVFWFLSA-N 0 1 302.368 4.193 20 0 DIADMN c1ccc2cc(-c3ccccc3CCN3CCOCC3)ccc2c1 ZINC001250275610 1060749849 /nfs/dbraw/zinc/74/98/49/1060749849.db2.gz NIOFDRDKXWDYKV-UHFFFAOYSA-N 0 1 317.432 4.382 20 0 DIADMN CCOc1cc(CN(CC)Cc2occc2C)cc(Cl)c1O ZINC001560891841 1060753160 /nfs/dbraw/zinc/75/31/60/1060753160.db2.gz WPBYXSBUGAZPTQ-UHFFFAOYSA-N 0 1 323.820 4.368 20 0 DIADMN COC(=O)c1ccc(CN2CC(C)(C)C[C@@H]2c2ccccc2)o1 ZINC001560898791 1060760977 /nfs/dbraw/zinc/76/09/77/1060760977.db2.gz RUFGKILBBGPIAN-MRXNPFEDSA-N 0 1 313.397 4.039 20 0 DIADMN CC(C)(C)OC(=O)c1cccc(Cc2cccc3nc[nH]c32)c1 ZINC001250300637 1060767090 /nfs/dbraw/zinc/76/70/90/1060767090.db2.gz URMPVSXAINJABL-UHFFFAOYSA-N 0 1 308.381 4.109 20 0 DIADMN CCc1csc(CC2CCN(Cc3cc(C)co3)CC2)n1 ZINC001560908990 1060772684 /nfs/dbraw/zinc/77/26/84/1060772684.db2.gz HXGKXGJYKFXXLT-UHFFFAOYSA-N 0 1 304.459 4.062 20 0 DIADMN CC[C@H]1CN(Cc2ccc(C(F)(F)F)cc2C)[C@@H](C)CO1 ZINC001560915329 1060777354 /nfs/dbraw/zinc/77/73/54/1060777354.db2.gz JKEANHGRWWCNLN-WFASDCNBSA-N 0 1 301.352 4.013 20 0 DIADMN CC(C)(C)OC(=O)c1ccc(Nc2ccc3cncn3c2)cc1 ZINC001250328065 1060779664 /nfs/dbraw/zinc/77/96/64/1060779664.db2.gz GITVADNIWRWNIL-UHFFFAOYSA-N 0 1 309.369 4.033 20 0 DIADMN CCc1cccc(F)c1CN1CCC2(CC1)C(F)(F)C2(F)F ZINC001560918505 1060780218 /nfs/dbraw/zinc/78/02/18/1060780218.db2.gz WYZGABPGVKVDTF-UHFFFAOYSA-N 0 1 319.317 4.255 20 0 DIADMN Nc1ccc(-c2ccc(Nc3ccc4cncn4c3)cc2)cc1 ZINC001250328476 1060780208 /nfs/dbraw/zinc/78/02/08/1060780208.db2.gz MQDQQJKDSWLCOB-UHFFFAOYSA-N 0 1 300.365 4.327 20 0 DIADMN c1ncn2cc(Nc3ccc(Oc4cccnc4)cc3)ccc12 ZINC001250328089 1060781077 /nfs/dbraw/zinc/78/10/77/1060781077.db2.gz GZWZXBLKMSCYFP-UHFFFAOYSA-N 0 1 302.337 4.265 20 0 DIADMN Clc1ccc(-c2cc(Nc3ccc4cncn4c3)no2)s1 ZINC001250328196 1060781920 /nfs/dbraw/zinc/78/19/20/1060781920.db2.gz MSVUPKOBTDJURB-UHFFFAOYSA-N 0 1 316.773 4.448 20 0 DIADMN COc1cccc(-c2csc(CN3CCC34CCCC4)n2)c1 ZINC001560919835 1060781957 /nfs/dbraw/zinc/78/19/57/1060781957.db2.gz OQHGJHQEYXZKKJ-UHFFFAOYSA-N 0 1 314.454 4.337 20 0 DIADMN c1ncn2cc(Nc3ccc(OCc4ccncc4)cc3)ccc12 ZINC001250331994 1060782682 /nfs/dbraw/zinc/78/26/82/1060782682.db2.gz NSYAERXLXGXBEF-UHFFFAOYSA-N 0 1 316.364 4.052 20 0 DIADMN Cc1cc(Br)cc(Nc2ccc3cncn3c2)c1 ZINC001250328495 1060783167 /nfs/dbraw/zinc/78/31/67/1060783167.db2.gz NFWCBQBYQXLEKB-UHFFFAOYSA-N 0 1 302.175 4.149 20 0 DIADMN c1ncn2cc(Nc3ccc(Cc4cccnc4)cc3)ccc12 ZINC001250332055 1060783388 /nfs/dbraw/zinc/78/33/88/1060783388.db2.gz QWBKNIPTNUZAAY-UHFFFAOYSA-N 0 1 300.365 4.064 20 0 DIADMN CC[C@H]1CN(Cc2cccc(-c3ccccn3)c2)[C@@H](CC)CO1 ZINC001560920020 1060783837 /nfs/dbraw/zinc/78/38/37/1060783837.db2.gz UMGSCLITAJMFBL-OALUTQOASA-N 0 1 310.441 4.138 20 0 DIADMN Clc1nc2cc(Nc3ccc4cncn4c3)ccc2s1 ZINC001250330711 1060783907 /nfs/dbraw/zinc/78/39/07/1060783907.db2.gz CJRPKSCOBWNJLF-UHFFFAOYSA-N 0 1 300.774 4.341 20 0 DIADMN FC(F)Oc1ccc(Nc2ccc3cncn3c2)cc1Cl ZINC001250328887 1060784454 /nfs/dbraw/zinc/78/44/54/1060784454.db2.gz ZTTGLFTVXADGSR-UHFFFAOYSA-N 0 1 309.703 4.333 20 0 DIADMN Fc1cc(Nc2ccc3cncn3c2)cc(F)c1C(F)(F)F ZINC001250335669 1060786608 /nfs/dbraw/zinc/78/66/08/1060786608.db2.gz NEMDBSPXFRTKRX-UHFFFAOYSA-N 0 1 313.229 4.375 20 0 DIADMN CCOc1nccc(CN2CC[C@H](c3ccccc3)C2)c1Cl ZINC001250360640 1060790471 /nfs/dbraw/zinc/79/04/71/1060790471.db2.gz CRMUWCARZQTZCL-HNNXBMFYSA-N 0 1 316.832 4.123 20 0 DIADMN C[C@@H]1CN(Cc2cc(O)c(Cl)c(F)c2F)Cc2ccccc21 ZINC001250387549 1060792947 /nfs/dbraw/zinc/79/29/47/1060792947.db2.gz KEJGZQGABIPSNX-SNVBAGLBSA-N 0 1 323.770 4.443 20 0 DIADMN Oc1cc(CN(Cc2ccccc2)C2CC2)c(F)c(F)c1Cl ZINC001250410441 1060795790 /nfs/dbraw/zinc/79/57/90/1060795790.db2.gz JXNAOIJYQPWWOE-UHFFFAOYSA-N 0 1 323.770 4.488 20 0 DIADMN CC(C)=CCC[C@@H](C)c1nc2cc(N3CCOCC3)ccc2[nH]1 ZINC001250422866 1060796316 /nfs/dbraw/zinc/79/63/16/1060796316.db2.gz ZTDYCXLLOHBYFC-OAHLLOKOSA-N 0 1 313.445 4.249 20 0 DIADMN c1ccc(COc2ccc3nc(C4CCOCC4)[nH]c3c2)cc1 ZINC001250432923 1060800511 /nfs/dbraw/zinc/80/05/11/1060800511.db2.gz DLAOTIGMNFSMJX-UHFFFAOYSA-N 0 1 308.381 4.036 20 0 DIADMN OCc1ccc(-c2nc3ccc(-c4ccccc4)cc3[nH]2)cc1 ZINC001250441291 1060803775 /nfs/dbraw/zinc/80/37/75/1060803775.db2.gz MUPYVGYLZMRTOI-UHFFFAOYSA-N 0 1 300.361 4.389 20 0 DIADMN Cc1ncc(-c2nc3cc(C(F)(F)F)cc(Cl)c3[nH]2)cn1 ZINC001250441467 1060804505 /nfs/dbraw/zinc/80/45/05/1060804505.db2.gz ZSEUEUKJQMZJLC-UHFFFAOYSA-N 0 1 312.682 4.001 20 0 DIADMN CCCOc1ccc2nc(-c3[nH]c(CC)nc3C)n(CC)c2c1 ZINC001250444913 1060805718 /nfs/dbraw/zinc/80/57/18/1060805718.db2.gz BYHBUKLYKOYAAX-UHFFFAOYSA-N 0 1 312.417 4.106 20 0 DIADMN Fc1cc2nc(-c3ccccc3Cl)[nH]c2cc1-n1ccnc1 ZINC001250449059 1060807478 /nfs/dbraw/zinc/80/74/78/1060807478.db2.gz UBTINCNHLVNOGK-UHFFFAOYSA-N 0 1 312.735 4.208 20 0 DIADMN Cc1ccc(-c2nc3ccc(OC(=O)OC(C)(C)C)cc3[nH]2)o1 ZINC001250447244 1060808357 /nfs/dbraw/zinc/80/83/57/1060808357.db2.gz BTALWOKIAIXRFG-UHFFFAOYSA-N 0 1 314.341 4.445 20 0 DIADMN CC(C)(C)c1csc(CN2CC[C@@H](c3ccc(O)cc3)C2)n1 ZINC001560955145 1060819520 /nfs/dbraw/zinc/81/95/20/1060819520.db2.gz MAOAIOZWUANILL-CQSZACIVSA-N 0 1 316.470 4.136 20 0 DIADMN C[C@@]1(CN2CCc3cccc(C(F)(F)F)c3C2)CCCCO1 ZINC001560960081 1060825673 /nfs/dbraw/zinc/82/56/73/1060825673.db2.gz UOXUAKBEEWYTBE-INIZCTEOSA-N 0 1 313.363 4.023 20 0 DIADMN COC(=O)c1oc(CN[C@@H](c2cccc(C)c2)C(C)C)cc1C ZINC001560963478 1060827276 /nfs/dbraw/zinc/82/72/76/1060827276.db2.gz SDKZWRVSXVKYIX-QGZVFWFLSA-N 0 1 315.413 4.170 20 0 DIADMN CC(=O)Oc1ccc(-c2nc3ccc(C(F)(F)F)cc3[nH]2)cc1 ZINC001250468518 1060827792 /nfs/dbraw/zinc/82/77/92/1060827792.db2.gz AHBFDROPFGGTMP-UHFFFAOYSA-N 0 1 320.270 4.174 20 0 DIADMN CCOC(=O)c1ccc(CN[C@](C)(CC)c2ccc(F)cc2)o1 ZINC001560964751 1060829080 /nfs/dbraw/zinc/82/90/80/1060829080.db2.gz QICHUYJKWZWIEK-GOSISDBHSA-N 0 1 319.376 4.010 20 0 DIADMN COc1ccc2ccccc2c1-c1nc2cc3c(cc2[nH]1)OCC3 ZINC001250469678 1060829131 /nfs/dbraw/zinc/82/91/31/1060829131.db2.gz LBEVJIHMBUIXOU-UHFFFAOYSA-N 0 1 316.360 4.327 20 0 DIADMN Fc1cc2nc(-c3ccc4c(c3)OCO4)[nH]c2c(C(F)(F)F)c1 ZINC001250473739 1060833864 /nfs/dbraw/zinc/83/38/64/1060833864.db2.gz HENODEWJKLOKBO-UHFFFAOYSA-N 0 1 324.233 4.117 20 0 DIADMN COCOc1ccc2nc(-c3ccc(C(F)(F)F)cc3)[nH]c2c1 ZINC001250479722 1060834733 /nfs/dbraw/zinc/83/47/33/1060834733.db2.gz IDCFYEDMBFCJGM-UHFFFAOYSA-N 0 1 322.286 4.231 20 0 DIADMN FC(F)(F)c1ccc(-c2nc3cc4c(cc3[nH]2)OCC4)cc1 ZINC001250479841 1060834979 /nfs/dbraw/zinc/83/49/79/1060834979.db2.gz LXRGSNCYHVKXMQ-UHFFFAOYSA-N 0 1 304.271 4.184 20 0 DIADMN CCOc1cc(-c2nc3ccc(F)c(C)c3[nH]2)ccc1OC ZINC001250480114 1060835708 /nfs/dbraw/zinc/83/57/08/1060835708.db2.gz DEAIBTCTRQDQIW-UHFFFAOYSA-N 0 1 300.333 4.085 20 0 DIADMN CSc1ccc(-c2nc3cc(F)c(-n4cccn4)cc3[nH]2)cc1 ZINC001250479315 1060835788 /nfs/dbraw/zinc/83/57/88/1060835788.db2.gz HHMFDYWWEXOYOY-UHFFFAOYSA-N 0 1 324.384 4.277 20 0 DIADMN C[C@H](CC1CCCCC1)CN1Cc2ccccc2NC(=O)[C@H]1C ZINC001560975151 1060840514 /nfs/dbraw/zinc/84/05/14/1060840514.db2.gz VCGVODKRGAGLNP-HZPDHXFCSA-N 0 1 314.473 4.436 20 0 DIADMN CCOc1ccc(-c2nc3ccc(SC)cc3[nH]2)cc1OC ZINC001250488873 1060843223 /nfs/dbraw/zinc/84/32/23/1060843223.db2.gz QAGKJEIRZFMHSM-UHFFFAOYSA-N 0 1 314.410 4.359 20 0 DIADMN CC[C@H]1CCC[C@H](CN2Cc3cccnc3N3CCC[C@H]3C2)C1 ZINC001560977981 1060843301 /nfs/dbraw/zinc/84/33/01/1060843301.db2.gz MMUGPKMPXFRBNH-LNLFQRSKSA-N 0 1 313.489 4.082 20 0 DIADMN FC(F)(F)Oc1cc2[nH]c(-c3nccs3)nc2cc1Cl ZINC001250495086 1060850043 /nfs/dbraw/zinc/85/00/43/1060850043.db2.gz BBRPSJAXNRDWCJ-UHFFFAOYSA-N 0 1 319.695 4.238 20 0 DIADMN CC(C)(C)OC(=O)Oc1ccc2nc(-c3nccs3)[nH]c2c1 ZINC001250495322 1060851618 /nfs/dbraw/zinc/85/16/18/1060851618.db2.gz GRVGFERMEQHBGV-UHFFFAOYSA-N 0 1 317.370 4.000 20 0 DIADMN COc1ccc(-c2nc3cc(Cl)c(OC)cc3[nH]2)c(F)c1 ZINC001250500728 1060854272 /nfs/dbraw/zinc/85/42/72/1060854272.db2.gz IBDMNCULNFHWKS-UHFFFAOYSA-N 0 1 306.724 4.040 20 0 DIADMN Cc1cc(-c2nc3cc(F)c(-n4ccnc4)cc3[nH]2)ccc1F ZINC001250501134 1060856401 /nfs/dbraw/zinc/85/64/01/1060856401.db2.gz KBPCSHOPXDZGAP-UHFFFAOYSA-N 0 1 310.307 4.002 20 0 DIADMN C[C@@H](CN(C)Cc1nc(Br)cs1)C(C)(C)C ZINC001560998610 1060858751 /nfs/dbraw/zinc/85/87/51/1060858751.db2.gz BRADUHHKOCMMQU-VIFPVBQESA-N 0 1 305.285 4.020 20 0 DIADMN C[C@H](N[C@H]1c2ccccc2OC[C@@H]1F)C1CCC(F)(F)CC1 ZINC001561005051 1060863500 /nfs/dbraw/zinc/86/35/00/1060863500.db2.gz CZLVNMFADUQBJL-PJODQICGSA-N 0 1 313.363 4.262 20 0 DIADMN Fc1cnccc1-c1nc2cc(Cl)c(C(F)(F)F)cc2[nH]1 ZINC001250516880 1060863843 /nfs/dbraw/zinc/86/38/43/1060863843.db2.gz FPXPQKLHCRMYKN-UHFFFAOYSA-N 0 1 315.657 4.436 20 0 DIADMN COc1cc(C)ccc1-c1nc2ccc(N3CCCC3)cc2[nH]1 ZINC001250517164 1060864360 /nfs/dbraw/zinc/86/43/60/1060864360.db2.gz LXLJKNHQDKZKBB-UHFFFAOYSA-N 0 1 307.397 4.147 20 0 DIADMN COc1cc(CN2CC[C@@H]2c2ccccc2)cc2c1OCC=C2 ZINC001250511610 1060864872 /nfs/dbraw/zinc/86/48/72/1060864872.db2.gz HSVHTJLJUQXUFU-GOSISDBHSA-N 0 1 307.393 4.048 20 0 DIADMN COc1ccc(F)c(CN2CC[C@@H](c3c(F)cccc3F)C2)c1 ZINC001561006208 1060865246 /nfs/dbraw/zinc/86/52/46/1060865246.db2.gz ZPOXLCSDSDCHTF-GFCCVEGCSA-N 0 1 321.342 4.102 20 0 DIADMN 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C[C@H]1CC(C)(C)CN1Cc1sc(N2CCCC2)nc1Cl ZINC001474582725 1062292035 /nfs/dbraw/zinc/29/20/35/1062292035.db2.gz OHRVLZQXGQKJIB-NSHDSACASA-N 0 1 313.898 4.017 20 0 DIADMN C[C@H]1CC(C)(C)CN1Cc1cccc(F)c1Br ZINC001474582338 1062293663 /nfs/dbraw/zinc/29/36/63/1062293663.db2.gz HYKDDGWUHLPDKR-JTQLQIEISA-N 0 1 300.215 4.209 20 0 DIADMN Fc1cccc2c1CC[C@H]2N1CCOC2(C1)CCCCCC2 ZINC001459675226 1062294701 /nfs/dbraw/zinc/29/47/01/1062294701.db2.gz YYUUTTAUBOSVGK-GOSISDBHSA-N 0 1 303.421 4.238 20 0 DIADMN C[C@@]1(F)CCCN(C(=O)c2cc(Cl)c3ccccc3c2O)C1 ZINC001468350763 1062305514 /nfs/dbraw/zinc/30/55/14/1062305514.db2.gz DBHHRSVNAVNLNM-QGZVFWFLSA-N 0 1 321.779 4.163 20 0 DIADMN COC(=O)c1cnc([C@@H](C)N2CCC[C@@H]2CC2CCCC2)s1 ZINC001474605188 1062317174 /nfs/dbraw/zinc/31/71/74/1062317174.db2.gz IWFIJGUETPIDCL-TZMCWYRMSA-N 0 1 322.474 4.035 20 0 DIADMN C[C@H]1CCC[C@@H](CCN(C)CC(=O)Nc2cc(F)cc(F)c2)C1 ZINC001459701117 1062317583 /nfs/dbraw/zinc/31/75/83/1062317583.db2.gz OTIVZCDESXQQIW-KBPBESRZSA-N 0 1 324.415 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1062360377 /nfs/dbraw/zinc/36/03/77/1062360377.db2.gz HGMXWUIGJRVASS-UHFFFAOYSA-N 0 1 316.788 4.088 20 0 DIADMN CC(C)CC[C@H]1CCCN1Cc1ncccc1Br ZINC001459754782 1062365404 /nfs/dbraw/zinc/36/54/04/1062365404.db2.gz HKAKLUFHJFQUGM-CYBMUJFWSA-N 0 1 311.267 4.245 20 0 DIADMN C[C@@]1(c2ccccc2)CN(CCCc2cccc(F)c2)CCO1 ZINC001459753273 1062366492 /nfs/dbraw/zinc/36/64/92/1062366492.db2.gz BJFAUVZPHSKEGC-FQEVSTJZSA-N 0 1 313.416 4.006 20 0 DIADMN Fc1ccc(C(F)(F)F)cc1[C@H]1CCCN1[C@H]1CCSC1 ZINC001255293590 1062381315 /nfs/dbraw/zinc/38/13/15/1062381315.db2.gz FVKDZAATWZFNLO-SMDDNHRTSA-N 0 1 319.367 4.487 20 0 DIADMN Cc1cc(CN2CCc3c(F)cccc3C2)c2ccccc2n1 ZINC001459776163 1062388264 /nfs/dbraw/zinc/38/82/64/1062388264.db2.gz NDUJFRQDCLIQGT-UHFFFAOYSA-N 0 1 306.384 4.241 20 0 DIADMN CC(C)C[C@@H]1CCCN(Cc2ccn(-c3ccccc3F)n2)C1 ZINC001459773101 1062389063 /nfs/dbraw/zinc/38/90/63/1062389063.db2.gz PPDUCQSETBVRCX-INIZCTEOSA-N 0 1 315.436 4.270 20 0 DIADMN CCCC[C@H](C)NC1(c2ccc(C(F)(F)F)cc2)COC1 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CCC/C=C\C(=O)Nc1cccc(Cc2nc3ccccc3[nH]2)c1 ZINC001469272843 1062516336 /nfs/dbraw/zinc/51/63/36/1062516336.db2.gz DNDGDMWJAGKSFU-QCDXTXTGSA-N 0 1 319.408 4.449 20 0 DIADMN F[C@@H]1CN([C@@H]2CCC[C@H](C(F)(F)F)C2)CCCC1(F)F ZINC001255706597 1062532140 /nfs/dbraw/zinc/53/21/40/1062532140.db2.gz VTPISBYLXQWBQD-HBNTYKKESA-N 0 1 303.290 4.177 20 0 DIADMN FC(F)(F)[C@@H]1CCC[C@@H](N2CCC[C@@H]2c2nccs2)C1 ZINC001255719091 1062538362 /nfs/dbraw/zinc/53/83/62/1062538362.db2.gz YTOXECPDYDNEFO-IJLUTSLNSA-N 0 1 304.381 4.401 20 0 DIADMN FC(F)(F)[C@@H]1CCC[C@@H](N2CCC[C@H]2c2nccs2)C1 ZINC001255719092 1062538724 /nfs/dbraw/zinc/53/87/24/1062538724.db2.gz YTOXECPDYDNEFO-UTUOFQBUSA-N 0 1 304.381 4.401 20 0 DIADMN Fc1cc2c(cc1F)CN([C@H]1CCC[C@@H](C(F)(F)F)C1)CC2 ZINC001255722940 1062540882 /nfs/dbraw/zinc/54/08/82/1062540882.db2.gz CYJPMOKLJIUWED-OLZOCXBDSA-N 0 1 319.317 4.444 20 0 DIADMN FC(F)(F)[C@@H]1CCC[C@@H](N2CCc3ncc(Cl)cc3C2)C1 ZINC001255719772 1062541751 /nfs/dbraw/zinc/54/17/51/1062541751.db2.gz 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ZINC001460058230 1062605297 /nfs/dbraw/zinc/60/52/97/1062605297.db2.gz MIDJUBCGXHHNPV-UHFFFAOYSA-N 0 1 317.436 4.030 20 0 DIADMN C[C@@H]1CCC[C@]1(C)C(=O)Nc1ccc(Nc2ccncc2)cc1 ZINC001469732065 1062613876 /nfs/dbraw/zinc/61/38/76/1062613876.db2.gz DEKBVMLIWLDQND-KUHUBIRLSA-N 0 1 309.413 4.012 20 0 DIADMN C[C@H](Cc1ccccc1F)n1c2cc(Cl)ccc2nc1CN ZINC001255830975 1062615316 /nfs/dbraw/zinc/61/53/16/1062615316.db2.gz VMEUMILSLBVFFQ-LLVKDONJSA-N 0 1 317.795 4.091 20 0 DIADMN Clc1ccc([C@@H]2CCCCC[C@H]2NCc2cnsn2)cc1 ZINC001460102677 1062639737 /nfs/dbraw/zinc/63/97/37/1062639737.db2.gz WETNMDZTRJAXOP-JKSUJKDBSA-N 0 1 321.877 4.398 20 0 DIADMN C[C@@H](Cc1ccc(F)cc1)n1cncc1CNCc1ccccc1 ZINC001255879419 1062651544 /nfs/dbraw/zinc/65/15/44/1062651544.db2.gz ZSKMFFOMCJRLOR-INIZCTEOSA-N 0 1 323.415 4.116 20 0 DIADMN O=C(Nc1ccc2ccn(C(F)F)c2c1)c1c(O)cccc1F ZINC001469907030 1062653543 /nfs/dbraw/zinc/65/35/43/1062653543.db2.gz LOOIQNYJYPPQAL-UHFFFAOYSA-N 0 1 320.270 4.133 20 0 DIADMN CO[C@@H]1CCN([C@@H](C)c2cc(Cl)ccc2Cl)C[C@H]1C ZINC001460134096 1062654126 /nfs/dbraw/zinc/65/41/26/1062654126.db2.gz YLVFWDPVHZUSFB-JRPNMDOOSA-N 0 1 302.245 4.411 20 0 DIADMN CC(C)CCc1noc(CN[C@H]2CCCCC23CCCC3)n1 ZINC001460138319 1062654544 /nfs/dbraw/zinc/65/45/44/1062654544.db2.gz PYQNHTCCFNROGL-HNNXBMFYSA-N 0 1 305.466 4.251 20 0 DIADMN C[C@@H](CN1C[C@@H](C(F)(F)F)OC(C)(C)C1)C1CCCCC1 ZINC001460135468 1062655530 /nfs/dbraw/zinc/65/55/30/1062655530.db2.gz AUERXEJJPRIXEM-JSGCOSHPSA-N 0 1 307.400 4.245 20 0 DIADMN CO[C@@H]1CCN([C@H](C)c2cc(Cl)ccc2Cl)C[C@@H]1C ZINC001460134095 1062655768 /nfs/dbraw/zinc/65/57/68/1062655768.db2.gz YLVFWDPVHZUSFB-FIXISWKDSA-N 0 1 302.245 4.411 20 0 DIADMN CCc1ccc([C@H]2CCN(Cc3cnc(Cl)c(F)c3)C2)cc1 ZINC001460166990 1062675948 /nfs/dbraw/zinc/67/59/48/1062675948.db2.gz RGLHYGRKSNYGQZ-INIZCTEOSA-N 0 1 318.823 4.426 20 0 DIADMN CCN1CCCC[C@H]1c1nnc(-c2ccc3ccccc3c2)o1 ZINC001256014724 1062682276 /nfs/dbraw/zinc/68/22/76/1062682276.db2.gz FOIGKQOQRMHHTK-KRWDZBQOSA-N 0 1 307.397 4.437 20 0 DIADMN CCCN(C(=O)c1ccc2cncn2c1C)c1ccc(CC)cc1 ZINC001460190288 1062687819 /nfs/dbraw/zinc/68/78/19/1062687819.db2.gz PDEPUMGNHAHRIP-UHFFFAOYSA-N 0 1 321.424 4.262 20 0 DIADMN c1coc(-c2ncc(CNCc3ccc4c(c3)CCC4)s2)c1 ZINC001256071063 1062694695 /nfs/dbraw/zinc/69/46/95/1062694695.db2.gz SYOCGWRANLCYFM-UHFFFAOYSA-N 0 1 310.422 4.182 20 0 DIADMN C[C@@H]1CCC(C)(C)N1Cc1c(F)cccc1Br ZINC001460232048 1062714266 /nfs/dbraw/zinc/71/42/66/1062714266.db2.gz RUCQDSPHKSAXBA-SNVBAGLBSA-N 0 1 300.215 4.351 20 0 DIADMN Cc1cnc2c(c1)CN([C@H]1CCC[C@H](c3ccccc3)C1)CC2 ZINC001256121682 1062719230 /nfs/dbraw/zinc/71/92/30/1062719230.db2.gz YUDBIAHRTLOSKP-ICSRJNTNSA-N 0 1 306.453 4.475 20 0 DIADMN Cc1ccccc1-c1nc(CN[C@@H](C)[C@@H]2CCC[C@@H](C)C2)no1 ZINC001460250417 1062729614 /nfs/dbraw/zinc/72/96/14/1062729614.db2.gz MJMDHODGWOKQPX-VNQPRFMTSA-N 0 1 313.445 4.349 20 0 DIADMN CC[C@H](C)c1cccc(NC(=O)CN(C)CCc2ccccc2)c1 ZINC001470267756 1062737848 /nfs/dbraw/zinc/73/78/48/1062737848.db2.gz SBQKSDWZIIMIKX-KRWDZBQOSA-N 0 1 324.468 4.313 20 0 DIADMN C[C@@H](Cc1cccc(Br)c1)N1CC2(C1)CCCC2 ZINC001256180877 1062744130 /nfs/dbraw/zinc/74/41/30/1062744130.db2.gz BCANCYYSYMTBKY-ZDUSSCGKSA-N 0 1 308.263 4.256 20 0 DIADMN CC[C@@H]1CN(C[C@@H]2CCC[C@@H](c3ccccc3)O2)C[C@H](CC)O1 ZINC001460266044 1062741060 /nfs/dbraw/zinc/74/10/60/1062741060.db2.gz KEHIWBDPVKKTIX-YRPNKDGESA-N 0 1 317.473 4.186 20 0 DIADMN Cc1nn(C)c(Cl)c1CN1CC(C)(C)C[C@H]1c1ccccc1 ZINC001460276407 1062750381 /nfs/dbraw/zinc/75/03/81/1062750381.db2.gz PPWQRDBDVZQHTP-INIZCTEOSA-N 0 1 317.864 4.355 20 0 DIADMN COc1cccc(CNC(C)(C)c2cc(Cl)ccc2OC)c1 ZINC001460285936 1062759521 /nfs/dbraw/zinc/75/95/21/1062759521.db2.gz OZBPDJDBCWLLRS-UHFFFAOYSA-N 0 1 319.832 4.382 20 0 DIADMN CCCOc1ccc(-c2nnc(-c3c(C)n[nH]c3C3CC3)o2)cc1 ZINC001256286328 1062761231 /nfs/dbraw/zinc/76/12/31/1062761231.db2.gz FJNGJXCZSHIKBF-UHFFFAOYSA-N 0 1 324.384 4.101 20 0 DIADMN C[C@@H](NC1CCN(c2ccc(Cl)cc2)CC1)c1cscn1 ZINC001256300803 1062768618 /nfs/dbraw/zinc/76/86/18/1062768618.db2.gz YMLRGPJVLMAFRT-GFCCVEGCSA-N 0 1 321.877 4.116 20 0 DIADMN O=S(=O)(Nc1cccc2sccc21)c1ccccc1Cl ZINC001256316196 1062773155 /nfs/dbraw/zinc/77/31/55/1062773155.db2.gz GVLBQJUATUPTLF-UHFFFAOYSA-N 0 1 323.826 4.356 20 0 DIADMN Fc1ccc(F)c(C[C@H]2CCCN2Cc2ccc(F)c(F)c2)c1 ZINC001460306264 1062773089 /nfs/dbraw/zinc/77/30/89/1062773089.db2.gz WNHMIGZOXOAHRP-OAHLLOKOSA-N 0 1 323.333 4.450 20 0 DIADMN Cc1cc(C)c(NS(=O)(=O)c2ccccc2Cl)cc1C ZINC001256317215 1062773361 /nfs/dbraw/zinc/77/33/61/1062773361.db2.gz SXHCURWITKKHII-UHFFFAOYSA-N 0 1 309.818 4.066 20 0 DIADMN CSc1ccccc1CN1C[C@@H](C)OC2(CCCCC2)C1 ZINC001460318006 1062776520 /nfs/dbraw/zinc/77/65/20/1062776520.db2.gz OUHBPTQXNJDQNH-OAHLLOKOSA-N 0 1 305.487 4.332 20 0 DIADMN Cl/C=C/CNC1(c2ccccc2Br)CCC1 ZINC001460332288 1062784206 /nfs/dbraw/zinc/78/42/06/1062784206.db2.gz OGOYGLKTTCXJNQ-RUDMXATFSA-N 0 1 300.627 4.170 20 0 DIADMN c1cn(-c2ccccc2)c(CN2CCC3(CCCCC3)CC2)n1 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CSCC[C@H](C)[N@H+]1CCn2cccc2[C@H]1c1ccccc1 ZINC001258213426 1063563958 /nfs/dbraw/zinc/56/39/58/1063563958.db2.gz PGPJDSQZDVWQMO-MAUKXSAKSA-N 0 1 300.471 4.035 20 0 DIADMN COc1ccc(F)c(CN[C@@H]2CCCc3c(F)cc(F)cc32)c1 ZINC001461543094 1063570195 /nfs/dbraw/zinc/57/01/95/1063570195.db2.gz YAOLXETVJGGRHE-GOSISDBHSA-N 0 1 321.342 4.280 20 0 DIADMN Oc1cc(Cl)ccc1-c1nnc(-c2ccc3c(c2)CCC3)o1 ZINC001258242697 1063579717 /nfs/dbraw/zinc/57/97/17/1063579717.db2.gz PMJGTGVUIONDFA-UHFFFAOYSA-N 0 1 312.756 4.251 20 0 DIADMN Cc1nc2cc(NC[C@@H]3CCCC[C@@H]3C)ccc2n1[C@H](C)CO ZINC001461565439 1063581849 /nfs/dbraw/zinc/58/18/49/1063581849.db2.gz OXZVLYZDZJARDK-LZWOXQAQSA-N 0 1 315.461 4.136 20 0 DIADMN CC(C)CCc1nnc(-c2ccc3[nH]nc(C(F)(F)F)c3c2)o1 ZINC001258282987 1063587318 /nfs/dbraw/zinc/58/73/18/1063587318.db2.gz UKZURAVPMUKGKP-UHFFFAOYSA-N 0 1 324.306 4.220 20 0 DIADMN CC1(C)CCC[C@H](N2CCO[C@H](c3ccc(F)c(F)c3)C2)C1 ZINC001258295366 1063592524 /nfs/dbraw/zinc/59/25/24/1063592524.db2.gz YVUSNMVDMLRISV-YOEHRIQHSA-N 0 1 309.400 4.307 20 0 DIADMN CC(C)(C)c1coc(CN[C@@](C)(Cc2ccccc2)C2CC2)n1 ZINC001461582895 1063592588 /nfs/dbraw/zinc/59/25/88/1063592588.db2.gz OEBKRCNLBQHJHA-FQEVSTJZSA-N 0 1 312.457 4.473 20 0 DIADMN COc1cc2ccccc2cc1CNCc1cccc(C)c1OC ZINC001461604819 1063607103 /nfs/dbraw/zinc/60/71/03/1063607103.db2.gz HMRJJBFIPWMJOQ-UHFFFAOYSA-N 0 1 321.420 4.455 20 0 DIADMN Cc1ccccc1-n1cc(CNc2nccc(C)c2C2CC2)cn1 ZINC001461616712 1063614680 /nfs/dbraw/zinc/61/46/80/1063614680.db2.gz WENFIZDLCFPIJU-UHFFFAOYSA-N 0 1 318.424 4.374 20 0 DIADMN Cc1cc(CNC[C@@H](OC2CCCC2)C(F)(F)F)ccc1F ZINC001461622574 1063619149 /nfs/dbraw/zinc/61/91/49/1063619149.db2.gz WUDGYFYSBBRZBV-OAHLLOKOSA-N 0 1 319.342 4.114 20 0 DIADMN CSC(C)(C)C[C@@H](C)N1CCc2c([nH]nc2C(F)(F)F)C1 ZINC001258343542 1063621548 /nfs/dbraw/zinc/62/15/48/1063621548.db2.gz ANQFIRHKSTWOHS-BXKDBHETSA-N 0 1 321.412 4.263 20 0 DIADMN CC[C@H](OCCNCc1ccc(F)cc1F)c1ccccc1 ZINC001461622999 1063621766 /nfs/dbraw/zinc/62/17/66/1063621766.db2.gz JYKKGFYPDMGLCA-SFHVURJKSA-N 0 1 305.368 4.222 20 0 DIADMN COC(=O)CC[C@H](C)NCc1c(Cl)ccc(Cl)c1Cl ZINC001258354704 1063622729 /nfs/dbraw/zinc/62/27/29/1063622729.db2.gz AGFKLYMHJSNJHQ-QMMMGPOBSA-N 0 1 324.635 4.078 20 0 DIADMN CCc1ccc(C)nc1NCc1cn(-c2cccc(F)c2)nc1C ZINC001461630413 1063624020 /nfs/dbraw/zinc/62/40/20/1063624020.db2.gz HTVNYEZJYSLFRC-UHFFFAOYSA-N 0 1 324.403 4.198 20 0 DIADMN CC(C)(C)O[C@H]1C[C@@H]([NH2+]Cc2cccc([O-])c2Cl)C12CCC2 ZINC001461645538 1063632549 /nfs/dbraw/zinc/63/25/49/1063632549.db2.gz LUDXCNWSPTYWEP-CABCVRRESA-N 0 1 323.864 4.262 20 0 DIADMN Fc1cccc(Cl)c1CNC[C@@H]1C[C@H](c2ccccc2)CO1 ZINC001461648857 1063633515 /nfs/dbraw/zinc/63/35/15/1063633515.db2.gz VLKFVLNBAMAOCT-GJZGRUSLSA-N 0 1 319.807 4.141 20 0 DIADMN COc1ccccc1-c1cc(CNC/C=C/c2ccccc2)on1 ZINC001461672889 1063649611 /nfs/dbraw/zinc/64/96/11/1063649611.db2.gz VRYVQZQHAAHEBX-JXMROGBWSA-N 0 1 320.392 4.153 20 0 DIADMN C[C@H](CC1CC1)N[C@@]1(c2ccccc2Cl)CCCCC1=O ZINC001258454252 1063661797 /nfs/dbraw/zinc/66/17/97/1063661797.db2.gz GRLBXJLFIPMVCB-FZKQIMNGSA-N 0 1 305.849 4.457 20 0 DIADMN C[C@@H](CC1CC1)N1CCO[C@H](c2cccc(C(F)(F)F)c2)C1 ZINC001258469846 1063666672 /nfs/dbraw/zinc/66/66/72/1063666672.db2.gz IVQANGUWDZDNSZ-LRDDRELGSA-N 0 1 313.363 4.267 20 0 DIADMN C[C@H]1Sc2ccccc2N(C(=O)c2cccc(F)c2O)[C@H]1C ZINC001515323414 1063668764 /nfs/dbraw/zinc/66/87/64/1063668764.db2.gz GMXKEZRVOFHTAL-WDEREUQCSA-N 0 1 317.385 4.061 20 0 DIADMN CCCCCCOc1cccc(CN[C@H](C)c2ccnn2C)c1 ZINC001461709354 1063672113 /nfs/dbraw/zinc/67/21/13/1063672113.db2.gz YAHUNKBZQLHDBC-MRXNPFEDSA-N 0 1 315.461 4.230 20 0 DIADMN COc1cccc2c1OCCC[C@@H]2NCc1ccc(Cl)cc1 ZINC001461726220 1063679428 /nfs/dbraw/zinc/67/94/28/1063679428.db2.gz JOAGZMGASKYOSD-INIZCTEOSA-N 0 1 317.816 4.352 20 0 DIADMN COc1cccc2c1OCCC[C@H]2NCc1ccc(Cl)cc1 ZINC001461726226 1063680209 /nfs/dbraw/zinc/68/02/09/1063680209.db2.gz JOAGZMGASKYOSD-MRXNPFEDSA-N 0 1 317.816 4.352 20 0 DIADMN COc1cccc2c1OCCC[C@H]2NCc1cc(C)ccc1F ZINC001461731277 1063683883 /nfs/dbraw/zinc/68/38/83/1063683883.db2.gz XNQQFRPNEOGECC-QGZVFWFLSA-N 0 1 315.388 4.146 20 0 DIADMN FC(F)COc1ccccc1CNc1ccc2c(n1)CCCC2 ZINC001461733224 1063685950 /nfs/dbraw/zinc/68/59/50/1063685950.db2.gz DLCPCGGLSXRQON-UHFFFAOYSA-N 0 1 318.367 4.216 20 0 DIADMN C[C@H]1CCC[C@H](C(=O)Nc2nc3cc(Cl)c(F)cc3[nH]2)C1 ZINC001461750758 1063696195 /nfs/dbraw/zinc/69/61/95/1063696195.db2.gz VOPSOWDHZDUODH-IUCAKERBSA-N 0 1 309.772 4.120 20 0 DIADMN CC1(C)CC[C@H](NC2(c3cccc(C(F)(F)F)c3)COC2)C1 ZINC001258595464 1063697808 /nfs/dbraw/zinc/69/78/08/1063697808.db2.gz WYTJKEGDZFDXJE-AWEZNQCLSA-N 0 1 313.363 4.099 20 0 DIADMN COc1ccc([C@H](C)NCc2cc(F)ccc2OC)cc1C ZINC001461755293 1063698011 /nfs/dbraw/zinc/69/80/11/1063698011.db2.gz NMAJSXUGPKUUBW-ZDUSSCGKSA-N 0 1 303.377 4.002 20 0 DIADMN CC1(C)CC[C@@H](NC2(c3cccc(C(F)(F)F)c3)COC2)C1 ZINC001258595465 1063698056 /nfs/dbraw/zinc/69/80/56/1063698056.db2.gz WYTJKEGDZFDXJE-CQSZACIVSA-N 0 1 313.363 4.099 20 0 DIADMN C[C@@H](COCC1CCCCC1)NCc1nc2c(s1)CCCC2 ZINC001461777271 1063710796 /nfs/dbraw/zinc/71/07/96/1063710796.db2.gz IRTMUKWZIPANPW-AWEZNQCLSA-N 0 1 322.518 4.097 20 0 DIADMN Cc1ccc(Cl)cc1CNCc1ccc(F)c(F)c1N(C)C ZINC001461793189 1063721043 /nfs/dbraw/zinc/72/10/43/1063721043.db2.gz CRINXZMWSQJTMV-UHFFFAOYSA-N 0 1 324.802 4.282 20 0 DIADMN FC(F)(F)c1ccc(CN2CCC[C@@H]([C@H]3CCCCO3)C2)o1 ZINC001549375346 1063722328 /nfs/dbraw/zinc/72/23/28/1063722328.db2.gz UYCRULSMSPFWLP-TZMCWYRMSA-N 0 1 317.351 4.080 20 0 DIADMN CC(C)n1c(CNC[C@H]2CCCC(C)(C)O2)nc2ccccc21 ZINC001461805750 1063726603 /nfs/dbraw/zinc/72/66/03/1063726603.db2.gz LYGDHSJYNLYYPT-OAHLLOKOSA-N 0 1 315.461 4.055 20 0 DIADMN [O-]c1cccc(C[NH2+]C[C@@H]2C[C@@H]2Cc2ccccc2)c1Cl ZINC001461820056 1063735681 /nfs/dbraw/zinc/73/56/81/1063735681.db2.gz KFBKLXPNSMLKTC-HOTGVXAUSA-N 0 1 301.817 4.014 20 0 DIADMN CCCCC[C@@H](CCC)N1Cc2cnn(C)c2[C@@H](COCC)C1 ZINC001258669166 1063736610 /nfs/dbraw/zinc/73/66/10/1063736610.db2.gz HYXYAEJFCLZBFT-QZTJIDSGSA-N 0 1 321.509 4.105 20 0 DIADMN COc1ccc(SCCN2CC[C@H]2c2cccc(F)c2)cc1 ZINC001461840712 1063742680 /nfs/dbraw/zinc/74/26/80/1063742680.db2.gz CMERTKXPRHQUSS-SFHVURJKSA-N 0 1 317.429 4.373 20 0 DIADMN C[C@@H](Cc1ccc(Cl)cc1Cl)N1CC(c2cccnc2)C1 ZINC001258683902 1063748866 /nfs/dbraw/zinc/74/88/66/1063748866.db2.gz IZPAVJVXDWWBIO-LBPRGKRZSA-N 0 1 321.251 4.419 20 0 DIADMN C[C@@H](Cc1ccc(Cl)cc1Cl)N1[C@@H]2CC[C@H]1CC(=O)C2 ZINC001258682001 1063749648 /nfs/dbraw/zinc/74/96/48/1063749648.db2.gz PJQIXOSJLTXVAX-LEWSCRJBSA-N 0 1 312.240 4.120 20 0 DIADMN CC(C)N(Cc1cnn(Cc2ccccc2)c1Cl)C1CCC1 ZINC001461859028 1063753701 /nfs/dbraw/zinc/75/37/01/1063753701.db2.gz JWIFMKHDTNQVKI-UHFFFAOYSA-N 0 1 317.864 4.348 20 0 DIADMN Cc1ccc2ncc(CN3C[C@H](C)C[C@H]3c3cccc(F)c3)n2c1 ZINC001461874996 1063765083 /nfs/dbraw/zinc/76/50/83/1063765083.db2.gz RGDGCIHYWDWYAP-BEFAXECRSA-N 0 1 323.415 4.365 20 0 DIADMN CCCC[C@@H](Cc1ccccc1)N1CCOC[C@H]1c1cccnc1 ZINC001258713266 1063768180 /nfs/dbraw/zinc/76/81/80/1063768180.db2.gz DMULJRICCYEIBI-SFTDATJTSA-N 0 1 324.468 4.256 20 0 DIADMN C[C@H]1C[C@@H](c2ccc(F)cc2)C[N@@H+]1Cc1ccc([O-])c(F)c1F ZINC001461893998 1063783128 /nfs/dbraw/zinc/78/31/28/1063783128.db2.gz AUYLMYJZMKTSFL-SMDDNHRTSA-N 0 1 321.342 4.188 20 0 DIADMN C[C@H]1C[C@@H](c2ccc(F)cc2)C[N@H+]1Cc1ccc([O-])c(F)c1F ZINC001461893998 1063783138 /nfs/dbraw/zinc/78/31/38/1063783138.db2.gz AUYLMYJZMKTSFL-SMDDNHRTSA-N 0 1 321.342 4.188 20 0 DIADMN Cc1n[nH]c2ccc(-c3nnc(-c4ccc(C)c(F)c4)o3)cc12 ZINC001258738129 1063786548 /nfs/dbraw/zinc/78/65/48/1063786548.db2.gz YKTSXHPNJPFZMF-UHFFFAOYSA-N 0 1 308.316 4.036 20 0 DIADMN C[C@H](Cc1cccc(Cl)c1)NCc1c(F)ccc(F)c1F ZINC001258739166 1063788396 /nfs/dbraw/zinc/78/83/96/1063788396.db2.gz RIHMBYYXZYCOQG-SNVBAGLBSA-N 0 1 313.750 4.478 20 0 DIADMN CCc1ccc([C@H]2CCCCCN2Cc2[nH]nc(C)c2C)o1 ZINC001461906843 1063792254 /nfs/dbraw/zinc/79/22/54/1063792254.db2.gz WYJFSQOFHVINTE-QGZVFWFLSA-N 0 1 301.434 4.299 20 0 DIADMN O=C(C[C@@H]1CC[C@@H]2C[C@@H]21)Nc1nc2cc(Cl)cc(Cl)c2[nH]1 ZINC001461910143 1063795616 /nfs/dbraw/zinc/79/56/16/1063795616.db2.gz SAGAGPBIIDRGLN-WEDXCCLWSA-N 0 1 324.211 4.244 20 0 DIADMN Cc1cc([C@@H]2CCCN2[C@@H](C)Cc2cccc(Cl)c2)no1 ZINC001258745739 1063796239 /nfs/dbraw/zinc/79/62/39/1063796239.db2.gz UYVOVAGIYHJGFE-SJCJKPOMSA-N 0 1 304.821 4.405 20 0 DIADMN C[C@H]1CN(Cc2cccc3c2CCC3)[C@H](c2ccccc2)CO1 ZINC001461920466 1063802030 /nfs/dbraw/zinc/80/20/30/1063802030.db2.gz CRZWIUNAMOXNJK-KKSFZXQISA-N 0 1 307.437 4.137 20 0 DIADMN CCCC[C@@H](CCC)N1Cc2cnn(CC)c2[C@H](COCC)C1 ZINC001258762389 1063808017 /nfs/dbraw/zinc/80/80/17/1063808017.db2.gz WQWFRYVICTUPHT-ZWKOTPCHSA-N 0 1 321.509 4.198 20 0 DIADMN CC(C)CO[C@@H]1CCN(Cc2cc3ccnc(Cl)c3s2)C1 ZINC001461924907 1063808297 /nfs/dbraw/zinc/80/82/97/1063808297.db2.gz FVNBDCAQCGIKMH-CYBMUJFWSA-N 0 1 324.877 4.197 20 0 DIADMN Cc1cc(F)ncc1CN1C[C@@H]2CCCC[C@]21c1ccccc1 ZINC001461929010 1063812991 /nfs/dbraw/zinc/81/29/91/1063812991.db2.gz QKMJEQUMXPVRNN-ICSRJNTNSA-N 0 1 310.416 4.430 20 0 DIADMN COc1ccc(SCCN(C)Cc2ccccc2F)cc1 ZINC001461941777 1063826159 /nfs/dbraw/zinc/82/61/59/1063826159.db2.gz FUSNADXFJIGFPI-UHFFFAOYSA-N 0 1 305.418 4.058 20 0 DIADMN CCCN(Cc1cn(CCC)nn1)[C@H](CC)c1ccccc1 ZINC001461961945 1063842729 /nfs/dbraw/zinc/84/27/29/1063842729.db2.gz GCMPZTUZTAOMEQ-GOSISDBHSA-N 0 1 300.450 4.051 20 0 DIADMN CCC[C@H](CN(Cc1ccco1)Cc1ccc(C)s1)OC ZINC001461969545 1063847764 /nfs/dbraw/zinc/84/77/64/1063847764.db2.gz SPKKBMORZWNDHS-OAHLLOKOSA-N 0 1 307.459 4.467 20 0 DIADMN Cc1ccccc1[C@H]1CCN(Cc2c(Cl)ccnc2F)C1 ZINC001461976953 1063852699 /nfs/dbraw/zinc/85/26/99/1063852699.db2.gz BCIBKGVCWMSPDX-ZDUSSCGKSA-N 0 1 304.796 4.172 20 0 DIADMN CCC1(CC)CCN(Cc2nccc(C)c2Br)C1 ZINC001461978613 1063857419 /nfs/dbraw/zinc/85/74/19/1063857419.db2.gz WYPWZEMTANWCRE-UHFFFAOYSA-N 0 1 311.267 4.165 20 0 DIADMN CC[C@H](Cc1ccccc1)N1CCc2ncc(Cl)cc2C1 ZINC001258853519 1063867997 /nfs/dbraw/zinc/86/79/97/1063867997.db2.gz ZOLQNGYJPRQVPH-QGZVFWFLSA-N 0 1 300.833 4.114 20 0 DIADMN CC[C@@H](Cc1ccccc1)N1CCc2nc(Cl)ccc2C1 ZINC001258849721 1063868039 /nfs/dbraw/zinc/86/80/39/1063868039.db2.gz SOGGUVOMRUENGD-INIZCTEOSA-N 0 1 300.833 4.114 20 0 DIADMN CCc1oc2ccccc2c1CN(C)Cc1cn(C)nc1C1CC1 ZINC001462008800 1063874895 /nfs/dbraw/zinc/87/48/95/1063874895.db2.gz NCZTWXPVRIFCHL-UHFFFAOYSA-N 0 1 323.440 4.238 20 0 DIADMN Cc1ccc(F)cc1S(=O)(=O)Nc1csc2ccccc12 ZINC001258921287 1063880674 /nfs/dbraw/zinc/88/06/74/1063880674.db2.gz NLSCYCOVVAHIHZ-UHFFFAOYSA-N 0 1 321.398 4.150 20 0 DIADMN CCN(Cc1ccnn1-c1ccccc1C)Cc1ccccc1 ZINC001462017631 1063881021 /nfs/dbraw/zinc/88/10/21/1063881021.db2.gz VFFKHOCCDHILLS-UHFFFAOYSA-N 0 1 305.425 4.203 20 0 DIADMN CN(C(=O)c1ccc(O)c(Cl)c1)[C@H]1CCC[C@H]1C(C)(C)C ZINC001299556690 1063881735 /nfs/dbraw/zinc/88/17/35/1063881735.db2.gz IKFYGCQGWPOHIU-OCCSQVGLSA-N 0 1 309.837 4.332 20 0 DIADMN CCOc1cc(C[N@@H+](C)[C@H]2CCC[C@H](C)C2)cc(Cl)c1O ZINC001462020389 1063883712 /nfs/dbraw/zinc/88/37/12/1063883712.db2.gz RJBLCDOUOLZSGM-JSGCOSHPSA-N 0 1 311.853 4.455 20 0 DIADMN CNc1ccc(C)cc1C[N@H+]1CCC[C@H]1c1ccc(COC)o1 ZINC001462044701 1063897178 /nfs/dbraw/zinc/89/71/78/1063897178.db2.gz KATQDNFQGTTWFT-SFHVURJKSA-N 0 1 314.429 4.113 20 0 DIADMN CNc1ccc(C)cc1C[N@H+]1CCC[C@@H]1c1ccc(COC)o1 ZINC001462044697 1063897699 /nfs/dbraw/zinc/89/76/99/1063897699.db2.gz KATQDNFQGTTWFT-GOSISDBHSA-N 0 1 314.429 4.113 20 0 DIADMN Cc1nn(C(C)C)c(C)c1CN(C)Cc1ccc(Cl)cc1 ZINC001462041583 1063897957 /nfs/dbraw/zinc/89/79/57/1063897957.db2.gz VFTARZNHDGXHPM-UHFFFAOYSA-N 0 1 305.853 4.366 20 0 DIADMN Clc1ccc(CN(Cc2cccc3c2OCO3)C2CC2)cc1 ZINC001462044955 1063899794 /nfs/dbraw/zinc/89/97/94/1063899794.db2.gz NFUCLIWKFBRGFI-UHFFFAOYSA-N 0 1 315.800 4.233 20 0 DIADMN COc1ccc([C@@H]2CCCN2Cc2csc(C)c2)c(OC)c1 ZINC001462054100 1063903482 /nfs/dbraw/zinc/90/34/82/1063903482.db2.gz MJCJKDGPCSIGHA-KRWDZBQOSA-N 0 1 317.454 4.411 20 0 DIADMN CCc1ccc2c(c1)[C@H](NCc1cccn1C(F)F)CCO2 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4.405 20 0 DIADMN CCCN(Cc1ccc(F)c(OC)c1)Cc1ccccc1F ZINC001308863179 1066344383 /nfs/dbraw/zinc/34/43/83/1066344383.db2.gz KRKRHTKXHKRFNZ-UHFFFAOYSA-N 0 1 305.368 4.386 20 0 DIADMN c1ccc(CCCCCCNCc2nnc(C3CC3)s2)cc1 ZINC001308865999 1066347749 /nfs/dbraw/zinc/34/77/49/1066347749.db2.gz SKBNNLMPSOYDSR-UHFFFAOYSA-N 0 1 315.486 4.308 20 0 DIADMN CC(C)C1CCC(CN2C[C@@H](C)O[C@H](CC(F)(F)F)C2)CC1 ZINC001308876392 1066355245 /nfs/dbraw/zinc/35/52/45/1066355245.db2.gz VEUVLJNZVLIWBR-PRLABOORSA-N 0 1 321.427 4.491 20 0 DIADMN CCOc1ccc(CN2CCC[C@@H](c3ccc(F)c(F)c3)C2)o1 ZINC001308875257 1066355459 /nfs/dbraw/zinc/35/54/59/1066355459.db2.gz ARIKUQPJVCZMHX-CQSZACIVSA-N 0 1 321.367 4.336 20 0 DIADMN FC(F)[C@H](CCc1ccccc1)NCC[C@@H]1CC1(Cl)Cl ZINC001308875864 1066355907 /nfs/dbraw/zinc/35/59/07/1066355907.db2.gz IUUZQDBKZDPNBW-OLZOCXBDSA-N 0 1 322.226 4.426 20 0 DIADMN CC(C)(C)O[C@@H]1C[C@H](N[C@@H](CF)c2ccc(F)cc2)C1(C)C ZINC001308912838 1066391912 /nfs/dbraw/zinc/39/19/12/1066391912.db2.gz SKPXWAWOHFLZCR-HRCADAONSA-N 0 1 311.416 4.408 20 0 DIADMN C[C@H]1CN(Cc2ccc3c(c2)OCCCCO3)Cc2ccccc21 ZINC001308928388 1066402675 /nfs/dbraw/zinc/40/26/75/1066402675.db2.gz OLHNJSLLHIAXAQ-INIZCTEOSA-N 0 1 323.436 4.357 20 0 DIADMN Cc1csc([C@H]2CCN(C/C=C/c3ccc(F)cc3F)C2)n1 ZINC001308927473 1066403652 /nfs/dbraw/zinc/40/36/52/1066403652.db2.gz ISITZSCAGPAPDK-HSWBROFVSA-N 0 1 320.408 4.232 20 0 DIADMN C[C@H](Cc1ccc(Cl)cc1)N[C@@H]1c2ccccc2OC[C@@H]1F ZINC001308937822 1066408273 /nfs/dbraw/zinc/40/82/73/1066408273.db2.gz ZDVDBAUVTKYPNA-PZPSRYQVSA-N 0 1 319.807 4.332 20 0 DIADMN CC(C)(C)c1cc2n(n1)CCN(C[C@@H]1CCCC(C)(C)C1)C2 ZINC001308963240 1066421766 /nfs/dbraw/zinc/42/17/66/1066421766.db2.gz ILSGJOPRQNPRHP-OAHLLOKOSA-N 0 1 303.494 4.213 20 0 DIADMN Cc1c[nH]c(=O)c(CN[C@@H](C)c2ccc(-c3ccccc3)cn2)c1 ZINC001308969767 1066426395 /nfs/dbraw/zinc/42/63/95/1066426395.db2.gz ZJAZAKKPDZLFNN-HNNXBMFYSA-N 0 1 319.408 4.008 20 0 DIADMN CSc1ccccc1C[C@@H](C)NCc1nc(C(C)(C)C)co1 ZINC001308970521 1066426595 /nfs/dbraw/zinc/42/65/95/1066426595.db2.gz CASHQCCWLGSGMZ-CYBMUJFWSA-N 0 1 318.486 4.415 20 0 DIADMN CCc1ccc2c(c1)CN(Cc1ccc(CC(C)C)nc1)CC2 ZINC001308986533 1066432751 /nfs/dbraw/zinc/43/27/51/1066432751.db2.gz BCQMQLIXVDEITL-UHFFFAOYSA-N 0 1 308.469 4.401 20 0 DIADMN CCCCCC[C@H]1CCC[C@@H]1[NH2+]Cc1nc(C(F)(F)F)n[n-]1 ZINC001308988938 1066434789 /nfs/dbraw/zinc/43/47/89/1066434789.db2.gz GTNKOATZEPDTCP-RYUDHWBXSA-N 0 1 318.387 4.052 20 0 DIADMN C[C@@H](N[C@H](C)c1ccccc1F)c1ccc2c(c1)OCCO2 ZINC000078989376 185141857 /nfs/dbraw/zinc/14/18/57/185141857.db2.gz HEHBPWDJPABHNO-CHWSQXEVSA-N 0 1 301.361 4.009 20 0 DIADMN COc1ccc([C@@H](C)NCc2cnc(C(C)(C)C)s2)cc1 ZINC000088218869 185242389 /nfs/dbraw/zinc/24/23/89/185242389.db2.gz UEIFNTKINYUYHC-GFCCVEGCSA-N 0 1 304.459 4.300 20 0 DIADMN CCCCN(CC)CC(=O)Nc1ccc(Cl)cc1Cl ZINC000096970234 185394642 /nfs/dbraw/zinc/39/46/42/185394642.db2.gz SLFNXLJTYWAOJO-UHFFFAOYSA-N 0 1 303.233 4.054 20 0 DIADMN CCCc1ccc([C@H](N[C@@H](C(N)=O)c2ccccc2)C(C)C)cc1 ZINC000097010345 185396728 /nfs/dbraw/zinc/39/67/28/185396728.db2.gz JWKCSWPFXVMVDI-WOJBJXKFSA-N 0 1 324.468 4.152 20 0 DIADMN CCCc1ccc([C@@H](N[C@@H](C(N)=O)c2ccccc2)C(C)C)cc1 ZINC000097010348 185396756 /nfs/dbraw/zinc/39/67/56/185396756.db2.gz JWKCSWPFXVMVDI-VQTJNVASSA-N 0 1 324.468 4.152 20 0 DIADMN CCCc1ccc([C@H](N[C@H](C(N)=O)c2ccccc2)C(C)C)cc1 ZINC000097010339 185396814 /nfs/dbraw/zinc/39/68/14/185396814.db2.gz JWKCSWPFXVMVDI-UXHICEINSA-N 0 1 324.468 4.152 20 0 DIADMN C[C@@H](NCCC(F)(F)F)c1ccc(F)cc1Br ZINC000224511028 340555963 /nfs/dbraw/zinc/55/59/63/340555963.db2.gz VSSOLWLROYILMI-SSDOTTSWSA-N 0 1 314.120 4.191 20 0 DIADMN C=Cn1cc(CN[C@@H](c2ccc(Cl)cc2F)C(C)C)cn1 ZINC000194413792 338526548 /nfs/dbraw/zinc/52/65/48/338526548.db2.gz HJZLGBOXONHLPN-MRXNPFEDSA-N 0 1 307.800 4.263 20 0 DIADMN CCOc1ccccc1[C@@H](CC(C)C)NCc1ccc(CO)o1 ZINC000072756780 191226091 /nfs/dbraw/zinc/22/60/91/191226091.db2.gz LJFVYCQYXSNHPC-GOSISDBHSA-N 0 1 317.429 4.048 20 0 DIADMN Cc1nccnc1[C@@H](C)N[C@H](C)c1cccc(C(F)(F)F)c1 ZINC000187674057 200142408 /nfs/dbraw/zinc/14/24/08/200142408.db2.gz HBMHZBVHPVEUCN-ZYHUDNBSSA-N 0 1 309.335 4.216 20 0 DIADMN Cc1noc(C)c1CN[C@H](c1ccc(F)cc1)C1CCCC1 ZINC000091307450 193037029 /nfs/dbraw/zinc/03/70/29/193037029.db2.gz DYAOTWYJYVQIRV-SFHVURJKSA-N 0 1 302.393 4.452 20 0 DIADMN C[C@@H](N[C@@H]1CCO[C@@H]1c1ccc(Cl)c(F)c1)c1ccco1 ZINC000091412533 193053143 /nfs/dbraw/zinc/05/31/43/193053143.db2.gz YONMUFZTJZXYFK-QSGSBWRWSA-N 0 1 309.768 4.253 20 0 DIADMN C[C@@H](N[C@@H]1CCCN(c2ccccc2Cl)C1)c1nccs1 ZINC000091727923 193097600 /nfs/dbraw/zinc/09/76/00/193097600.db2.gz MCTARKOZMFQASU-CHWSQXEVSA-N 0 1 321.877 4.116 20 0 DIADMN C[C@H]1C[C@H](C)CN(C(=O)Nc2ccc3nc(C(F)F)[nH]c3c2)C1 ZINC000093352729 193236935 /nfs/dbraw/zinc/23/69/35/193236935.db2.gz WFILWAWLILXMIM-UWVGGRQHSA-N 0 1 322.359 4.010 20 0 DIADMN C[C@H]1CN(C(=O)Nc2ccc3nc(C(F)F)[nH]c3c2)CC[C@@H]1C ZINC000093353040 193237168 /nfs/dbraw/zinc/23/71/68/193237168.db2.gz ZTZNXPMKWNBSQU-UWVGGRQHSA-N 0 1 322.359 4.010 20 0 DIADMN CCc1cccc(C)c1NS(=O)(=O)c1ccccc1Cl ZINC000016101242 182034225 /nfs/dbraw/zinc/03/42/25/182034225.db2.gz NAQJWPYFOAWIOE-UHFFFAOYSA-N 0 1 309.818 4.012 20 0 DIADMN CC[C@@H](NCc1ccccn1)c1ccc(Br)cc1 ZINC000019957664 182169840 /nfs/dbraw/zinc/16/98/40/182169840.db2.gz IFFPAXIRLBOHHL-OAHLLOKOSA-N 0 1 305.219 4.085 20 0 DIADMN Cc1cccc(CNCc2cc(Br)ccc2F)c1 ZINC000020133826 182190479 /nfs/dbraw/zinc/19/04/79/182190479.db2.gz ROFKZQFKYSCJRH-UHFFFAOYSA-N 0 1 308.194 4.186 20 0 DIADMN Brc1ccc(CN[C@H]2CCCc3ccccc32)o1 ZINC000020133482 182190829 /nfs/dbraw/zinc/19/08/29/182190829.db2.gz DJFAHMNRPMAPEU-AWEZNQCLSA-N 0 1 306.203 4.209 20 0 DIADMN Brc1ccc(CN[C@H]2CCCc3occc32)s1 ZINC000020204813 182197424 /nfs/dbraw/zinc/19/74/24/182197424.db2.gz TUQWYDXUAISFQJ-NSHDSACASA-N 0 1 312.232 4.271 20 0 DIADMN Fc1ccc(CN[C@H]2CCCc3occc32)cc1Br ZINC000020204748 182197535 /nfs/dbraw/zinc/19/75/35/182197535.db2.gz UZSOKZQPMSFXOV-AWEZNQCLSA-N 0 1 324.193 4.348 20 0 DIADMN COc1ccc(CN[C@@H](C)c2ccccc2Cl)cc1OC ZINC000021796650 182289893 /nfs/dbraw/zinc/28/98/93/182289893.db2.gz POSOWNLPKUOHIG-LBPRGKRZSA-N 0 1 305.805 4.208 20 0 DIADMN Cc1nc2cc(NCc3ccc(Cl)cc3F)ccc2n1C ZINC000525863896 335031121 /nfs/dbraw/zinc/03/11/21/335031121.db2.gz FVWSSIBWXFVXLO-UHFFFAOYSA-N 0 1 303.768 4.286 20 0 DIADMN COc1cccc2cc([C@H](C)NCc3cnc(C)s3)oc21 ZINC000040437497 183067080 /nfs/dbraw/zinc/06/70/80/183067080.db2.gz ZZFCJQGGVDAYSL-JTQLQIEISA-N 0 1 302.399 4.057 20 0 DIADMN Cc1nc(C)c([C@@H](C)NCc2ccccc2OC(C)C)s1 ZINC000040518190 183090073 /nfs/dbraw/zinc/09/00/73/183090073.db2.gz XTOIUTSKAXRDIH-GFCCVEGCSA-N 0 1 304.459 4.398 20 0 DIADMN Cc1ncc(CN[C@@H](C)c2ccc(Br)s2)s1 ZINC000040997857 183154922 /nfs/dbraw/zinc/15/49/22/183154922.db2.gz JDJVYVHUBVOBLJ-ZETCQYMHSA-N 0 1 317.277 4.126 20 0 DIADMN Cc1cc(C)cc(CNCc2ccccc2Br)c1 ZINC000042304847 183252461 /nfs/dbraw/zinc/25/24/61/183252461.db2.gz UMZGXBXMUBLASP-UHFFFAOYSA-N 0 1 304.231 4.356 20 0 DIADMN O=C(Nc1ccc(Cl)cc1F)c1cc(Cl)ccc1O ZINC000042336098 183256002 /nfs/dbraw/zinc/25/60/02/183256002.db2.gz BYOLJAWIFMRPOU-UHFFFAOYSA-N 0 1 300.116 4.090 20 0 DIADMN COc1ccc2nc(SCc3ccc(F)c(F)c3)[nH]c2c1 ZINC000042922591 183318518 /nfs/dbraw/zinc/31/85/18/183318518.db2.gz VIMVBNSBMXZSMJ-UHFFFAOYSA-N 0 1 306.337 4.142 20 0 DIADMN C[C@H](NCc1sccc1Br)c1cccs1 ZINC000043674961 183378129 /nfs/dbraw/zinc/37/81/29/183378129.db2.gz JJVODMKUMKKVBD-QMMMGPOBSA-N 0 1 302.262 4.423 20 0 DIADMN COc1ccc(CN[C@H](C)c2ccccc2)c(Cl)c1OC ZINC000106366347 194202949 /nfs/dbraw/zinc/20/29/49/194202949.db2.gz LJQOFTWPBUEYPZ-GFCCVEGCSA-N 0 1 305.805 4.208 20 0 DIADMN CN(Cc1csc(COc2ccccc2)n1)C1CCCCC1 ZINC000060460046 184149757 /nfs/dbraw/zinc/14/97/57/184149757.db2.gz PUHKDWKMYVVSMC-UHFFFAOYSA-N 0 1 316.470 4.487 20 0 DIADMN Cc1ccc([C@@H]2CCCN2C(=O)c2[nH]nc3ccccc32)cc1C ZINC000060093638 184143993 /nfs/dbraw/zinc/14/39/93/184143993.db2.gz PWJGVTVHVSOZOP-SFHVURJKSA-N 0 1 319.408 4.157 20 0 DIADMN Cc1ccc(Br)cc1CN[C@H](C)c1ccccn1 ZINC000190694836 335048366 /nfs/dbraw/zinc/04/83/66/335048366.db2.gz MICZXGCVCMSBAQ-GFCCVEGCSA-N 0 1 305.219 4.003 20 0 DIADMN OCc1ccc(CN2CCC[C@@H]2c2nc3ccccc3s2)cc1 ZINC000272260274 130013849 /nfs/dbraw/zinc/01/38/49/130013849.db2.gz BNWTYPRYUQANQV-QGZVFWFLSA-N 0 1 324.449 4.126 20 0 DIADMN COc1cccc(C2(N[C@H](C)c3sc(C)nc3C)CC2)c1 ZINC000272254688 130014038 /nfs/dbraw/zinc/01/40/38/130014038.db2.gz KXSUVKNRDQUDKA-GFCCVEGCSA-N 0 1 302.443 4.108 20 0 DIADMN Cc1cccc([C@H](C)NCc2cccc(Br)n2)c1C ZINC000272447422 130031435 /nfs/dbraw/zinc/03/14/35/130031435.db2.gz VGPTZDDEHIRCKH-ZDUSSCGKSA-N 0 1 319.246 4.312 20 0 DIADMN COc1c(O)cccc1CNC(C)(C)c1cccc(Cl)c1 ZINC000272484905 130035531 /nfs/dbraw/zinc/03/55/31/130035531.db2.gz TXIAWXAGIQGKCN-UHFFFAOYSA-N 0 1 305.805 4.079 20 0 DIADMN COCC[C@@H](NCc1cccc(-c2ccccn2)c1)c1ccco1 ZINC000272608132 130045380 /nfs/dbraw/zinc/04/53/80/130045380.db2.gz UAIMTRZTWYOTFT-LJQANCHMSA-N 0 1 322.408 4.209 20 0 DIADMN CC(=O)Nc1ccc([C@H](C)N[C@@H]2COc3c2ccc(C)c3C)cc1 ZINC000272797751 130064828 /nfs/dbraw/zinc/06/48/28/130064828.db2.gz ZAZAHRMPKBMPJG-IFXJQAMLSA-N 0 1 324.424 4.046 20 0 DIADMN Clc1cccc2c1CCC[C@@H]2NCc1cn2ccsc2n1 ZINC000273396740 130115683 /nfs/dbraw/zinc/11/56/83/130115683.db2.gz MDLSWHSTXUWLLQ-HNNXBMFYSA-N 0 1 317.845 4.216 20 0 DIADMN Cc1nnc([C@@H](C)N[C@@H]2CC=C(c3ccc(F)cc3)CC2)s1 ZINC000274278287 130222980 /nfs/dbraw/zinc/22/29/80/130222980.db2.gz XYLLALGGTNOJJQ-BDJLRTHQSA-N 0 1 317.433 4.272 20 0 DIADMN CCOc1cccc([C@H](C)NCc2nn(CC)c3ccccc23)c1 ZINC000274415586 130232337 /nfs/dbraw/zinc/23/23/37/130232337.db2.gz JCIYIVQLHPHFDP-HNNXBMFYSA-N 0 1 323.440 4.306 20 0 DIADMN COCc1ccc([C@@H]2CCCN2Cc2cnc3ccccc3c2)o1 ZINC000274435600 130233920 /nfs/dbraw/zinc/23/39/20/130233920.db2.gz RCDLXMMXHJLOLH-IBGZPJMESA-N 0 1 322.408 4.311 20 0 DIADMN CC(C)c1nc([C@@H](C)NC[C@H](c2ccsc2)N(C)C)cs1 ZINC000274476523 130239962 /nfs/dbraw/zinc/23/99/62/130239962.db2.gz QPTQWQWTKMAZCZ-IUODEOHRSA-N 0 1 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/nfs/dbraw/zinc/20/63/38/332206338.db2.gz PVXAVWQWUPNXLM-LJQANCHMSA-N 0 1 323.436 4.154 20 0 DIADMN Cc1ncc(CNC(c2cccs2)c2cccs2)s1 ZINC000040997787 332208130 /nfs/dbraw/zinc/20/81/30/332208130.db2.gz KLOFUEKORIJOKE-UHFFFAOYSA-N 0 1 306.481 4.454 20 0 DIADMN Cc1ccsc1[C@H](CO)N[C@H](C)c1cc2ccc(C)cc2o1 ZINC000426059535 335094690 /nfs/dbraw/zinc/09/46/90/335094690.db2.gz FMCOXUAKNAZLCI-HIFRSBDPSA-N 0 1 315.438 4.495 20 0 DIADMN COCC(C)(C)C[N@H+]1CCc2sccc2[C@@H]1c1cccs1 ZINC000426061363 335094952 /nfs/dbraw/zinc/09/49/52/335094952.db2.gz KKEZSJINSBTNKF-MRXNPFEDSA-N 0 1 321.511 4.430 20 0 DIADMN CO[C@H]1CCCN(Cc2csc(-c3ccc(C)cc3)n2)CC1 ZINC000363670681 332215656 /nfs/dbraw/zinc/21/56/56/332215656.db2.gz GAQNGDDIYWRMMM-KRWDZBQOSA-N 0 1 316.470 4.119 20 0 DIADMN Cc1ccc2cc([C@H](C)N[C@@H](CO)c3ccc(F)cc3)oc2c1 ZINC000426051388 335095701 /nfs/dbraw/zinc/09/57/01/335095701.db2.gz UAWAHIHXJQPEEY-GUYCJALGSA-N 0 1 313.372 4.265 20 0 DIADMN COc1ncc(CNCc2ccc(C(C)(C)C)s2)cc1Cl ZINC000449462981 332235374 /nfs/dbraw/zinc/23/53/74/332235374.db2.gz VTOVXEWOIFPBHJ-UHFFFAOYSA-N 0 1 324.877 4.392 20 0 DIADMN CCC[C@@H](NCc1ccc(OC)cc1F)c1ccc(OC)cc1 ZINC000537960244 332240372 /nfs/dbraw/zinc/24/03/72/332240372.db2.gz NVJDYDSKZWCRIS-LJQANCHMSA-N 0 1 317.404 4.474 20 0 DIADMN CCC[C@H](NCc1ccc(OC)cc1F)c1ccc(OC)cc1 ZINC000537960243 332240403 /nfs/dbraw/zinc/24/04/03/332240403.db2.gz NVJDYDSKZWCRIS-IBGZPJMESA-N 0 1 317.404 4.474 20 0 DIADMN COc1cc(CN(C)[C@@H](C)c2ccc(C(F)(F)F)cc2)ccn1 ZINC000536475091 332251070 /nfs/dbraw/zinc/25/10/70/332251070.db2.gz CYQNMJHHXFFCBP-LBPRGKRZSA-N 0 1 324.346 4.302 20 0 DIADMN CC1(C)CN(Cc2nnc(-c3ccccc3)s2)[C@H]2CCC[C@H]21 ZINC000559432958 332258297 /nfs/dbraw/zinc/25/82/97/332258297.db2.gz RYPIEBYZCJJMAL-CABCVRRESA-N 0 1 313.470 4.216 20 0 DIADMN Cc1ccc(-c2cc(C(=O)N3C[C@H](C)CCC[C@@H]3C)n[nH]2)cc1 ZINC000525618464 332260141 /nfs/dbraw/zinc/26/01/41/332260141.db2.gz VZWALULOKXEGNW-CABCVRRESA-N 0 1 311.429 4.036 20 0 DIADMN COc1ccccc1-c1nc(CN2CCC[C@@H](C)[C@@H]2C)cs1 ZINC000531101291 332261718 /nfs/dbraw/zinc/26/17/18/332261718.db2.gz CSQZLAZYUPRGMH-KGLIPLIRSA-N 0 1 316.470 4.439 20 0 DIADMN CN(CCCc1ccccc1)Cc1nc2c(s1)CCCC2 ZINC000531103489 332262942 /nfs/dbraw/zinc/26/29/42/332262942.db2.gz DNNCRSGOYFQFRP-UHFFFAOYSA-N 0 1 300.471 4.087 20 0 DIADMN CCCCN(CC(=O)Nc1cccc(Cl)c1Cl)C1CC1 ZINC000531103784 332263108 /nfs/dbraw/zinc/26/31/08/332263108.db2.gz KDDMUESOBFWROW-UHFFFAOYSA-N 0 1 315.244 4.196 20 0 DIADMN COc1ccc([C@@H](N[C@@H](C)c2ccncc2F)C2CC2)cc1 ZINC000559736315 332278586 /nfs/dbraw/zinc/27/85/86/332278586.db2.gz RBIYRCLMKAKGNZ-SGTLLEGYSA-N 0 1 300.377 4.031 20 0 DIADMN C[N@@H+](CCc1cccs1)Cc1ccccc1Br ZINC000109865567 332284932 /nfs/dbraw/zinc/28/49/32/332284932.db2.gz CSGCBFGGTLOXRL-UHFFFAOYSA-N 0 1 310.260 4.185 20 0 DIADMN CN(CCc1cccs1)Cc1ccccc1Br ZINC000109865567 332284934 /nfs/dbraw/zinc/28/49/34/332284934.db2.gz CSGCBFGGTLOXRL-UHFFFAOYSA-N 0 1 310.260 4.185 20 0 DIADMN Cc1ccc2c(c1C)OC[C@@H]2N[C@H](C)c1ccc2c(c1)COC2 ZINC000537974719 332286273 /nfs/dbraw/zinc/28/62/73/332286273.db2.gz NBXCFCNEVVNAJW-KUHUBIRLSA-N 0 1 309.409 4.118 20 0 DIADMN C[C@H](NCc1coc2ccccc12)c1ccnn1-c1ccccc1 ZINC000559860124 332286288 /nfs/dbraw/zinc/28/62/88/332286288.db2.gz GXAKLCQPVHHRIP-HNNXBMFYSA-N 0 1 317.392 4.469 20 0 DIADMN CCCCOc1cccc(CN[C@H](C)c2ccncc2F)c1 ZINC000559895632 332290880 /nfs/dbraw/zinc/29/08/80/332290880.db2.gz TWARPKATSUVVOP-CQSZACIVSA-N 0 1 302.393 4.250 20 0 DIADMN C[C@H](NCc1ccc(OC(F)F)c(F)c1)c1cccc(F)c1 ZINC000559898087 332291392 /nfs/dbraw/zinc/29/13/92/332291392.db2.gz YGIDNTKGETWYPM-JTQLQIEISA-N 0 1 313.294 4.417 20 0 DIADMN Cc1ccc([C@@H](NCc2cn3cc(C)ccc3n2)C2CC2)cc1 ZINC000560050160 332306508 /nfs/dbraw/zinc/30/65/08/332306508.db2.gz BKWNGDJORSAWAM-HXUWFJFHSA-N 0 1 305.425 4.192 20 0 DIADMN Oc1cc(F)cc(CNC2(c3ccc(Cl)cc3)CCC2)c1 ZINC000560071764 332308666 /nfs/dbraw/zinc/30/86/66/332308666.db2.gz GQKRALGGXYEYLT-UHFFFAOYSA-N 0 1 305.780 4.354 20 0 DIADMN Cc1cc(C(C)(C)C)cc(C)c1C[N@H+]1CCCC[C@H]1C(=O)[O-] ZINC000261607403 332311304 /nfs/dbraw/zinc/31/13/04/332311304.db2.gz DGHFUUHHGNGXQL-KRWDZBQOSA-N 0 1 303.446 4.040 20 0 DIADMN CC[C@H](c1ccc(F)cc1F)N1CCC(c2c[nH]nc2C)CC1 ZINC000560183864 332317706 /nfs/dbraw/zinc/31/77/06/332317706.db2.gz OVINRDPZCJBXFP-GOSISDBHSA-N 0 1 319.399 4.327 20 0 DIADMN O=C(CCCN1CCC[C@@H]1c1ccccn1)c1ccc(F)cc1 ZINC000560220395 332319935 /nfs/dbraw/zinc/31/99/35/332319935.db2.gz FJIORKZMVGJWIR-GOSISDBHSA-N 0 1 312.388 4.021 20 0 DIADMN C[C@@H](CCC(C)(C)C)N[C@@H](c1nccn1C)c1ccc(F)cc1 ZINC000560248391 332323199 /nfs/dbraw/zinc/32/31/99/332323199.db2.gz LBTVGMCFOFRRCS-WMLDXEAASA-N 0 1 317.452 4.453 20 0 DIADMN CC(C)(C)c1ncc(CNCc2cc3c(s2)CCCC3)cn1 ZINC000560253771 332323632 /nfs/dbraw/zinc/32/36/32/332323632.db2.gz MOJXRRAFFUHTGW-UHFFFAOYSA-N 0 1 315.486 4.004 20 0 DIADMN CCS[C@H](C)c1noc(CN(C)CC(C(C)C)C(C)C)n1 ZINC000560257502 332324402 /nfs/dbraw/zinc/32/44/02/332324402.db2.gz OZNNCAUQFJORSW-CYBMUJFWSA-N 0 1 313.511 4.244 20 0 DIADMN CC(C)c1nc([C@H](C)N[C@@H]2CC[C@H](C)c3ccsc32)n[nH]1 ZINC000560345180 332333068 /nfs/dbraw/zinc/33/30/68/332333068.db2.gz XJKFHZLVOOIKDH-GMXVVIOVSA-N 0 1 304.463 4.279 20 0 DIADMN Cc1nnsc1CN([C@H](C)c1ccccc1)C1CCCC1 ZINC000582125578 332341995 /nfs/dbraw/zinc/34/19/95/332341995.db2.gz XNPKZXWXFTXJNB-CQSZACIVSA-N 0 1 301.459 4.352 20 0 DIADMN CCc1ccc(-c2noc([C@H](C)N[C@@H]3CC=C(C)CC3)n2)cc1 ZINC000560503102 332347151 /nfs/dbraw/zinc/34/71/51/332347151.db2.gz GXCVHGAJTCWLAQ-WMLDXEAASA-N 0 1 311.429 4.448 20 0 DIADMN CCn1cccc1CN(C)Cc1ccc2cc(OC)ccc2c1 ZINC000560544498 332356354 /nfs/dbraw/zinc/35/63/54/332356354.db2.gz OKHWPAKAKLSMMY-UHFFFAOYSA-N 0 1 308.425 4.302 20 0 DIADMN COc1ccc(CN2CC3(CCC3)[C@H]2c2ccccc2)cc1OC ZINC000560569881 332361725 /nfs/dbraw/zinc/36/17/25/332361725.db2.gz VKRKWEIOAWJSFX-HXUWFJFHSA-N 0 1 323.436 4.431 20 0 DIADMN CSc1ccccc1C[C@H](C)N[C@@H](C)c1c(F)cncc1F ZINC000560578479 332361785 /nfs/dbraw/zinc/36/17/85/332361785.db2.gz NWSBATWWACXKSY-RYUDHWBXSA-N 0 1 322.424 4.364 20 0 DIADMN CC(C)(C)N1CC[C@](F)(c2nc(-c3cccc(Cl)c3)no2)C1 ZINC000564690698 332362233 /nfs/dbraw/zinc/36/22/33/332362233.db2.gz ZMNLTPBVWJNHMZ-MRXNPFEDSA-N 0 1 323.799 4.059 20 0 DIADMN C[C@@H](N[C@@H](c1nccn1C)C1CC1)c1cccc2ccccc21 ZINC000560571436 332362517 /nfs/dbraw/zinc/36/25/17/332362517.db2.gz KJHPPOQNLOTWQN-AUUYWEPGSA-N 0 1 305.425 4.375 20 0 DIADMN CC(C)(C)c1ccc(C2(NCc3cnccn3)CCCC2)cc1 ZINC000560604122 332367085 /nfs/dbraw/zinc/36/70/85/332367085.db2.gz VNKODYPRGAQFPI-UHFFFAOYSA-N 0 1 309.457 4.333 20 0 DIADMN C[C@H](Cc1ccsc1)N1CCO[C@H](c2ccc(Cl)cc2)C1 ZINC000560622920 332370079 /nfs/dbraw/zinc/37/00/79/332370079.db2.gz QYTADWLBOFVZQN-DYVFJYSZSA-N 0 1 321.873 4.406 20 0 DIADMN c1ccc(Sc2ccc(CN3CC4(C3)CCOC4)cc2)cc1 ZINC000560638040 332371823 /nfs/dbraw/zinc/37/18/23/332371823.db2.gz DGNWNWVKOVZNSR-UHFFFAOYSA-N 0 1 311.450 4.060 20 0 DIADMN Cc1[nH]nc2cc(NC(=O)C3(c4cc(C)cc(C)c4)CC3)ccc12 ZINC000560653888 332373949 /nfs/dbraw/zinc/37/39/49/332373949.db2.gz JQVICWNJULLAJK-UHFFFAOYSA-N 0 1 319.408 4.158 20 0 DIADMN O=C([O-])c1cc(F)ccc1C[N@@H+](CC1CC1)C1CCCCC1 ZINC000566359209 332376775 /nfs/dbraw/zinc/37/67/75/332376775.db2.gz RELBQGFVPYRADC-UHFFFAOYSA-N 0 1 305.393 4.069 20 0 DIADMN O=C([O-])CCCCC[N@@H+](CCc1ccc(F)cc1)C1CCCC1 ZINC000566362800 332379287 /nfs/dbraw/zinc/37/92/87/332379287.db2.gz VMHCQSRGNPWTEY-UHFFFAOYSA-N 0 1 321.436 4.258 20 0 DIADMN CCC(=O)c1ccc(O)c(NC(=O)Cc2cccc(C3CC3)c2)c1 ZINC000560748696 332384555 /nfs/dbraw/zinc/38/45/55/332384555.db2.gz SVSWMRKKSNRMMW-UHFFFAOYSA-N 0 1 323.392 4.044 20 0 DIADMN O=C([O-])[C@@H]1C[C@@H]2CCCC[C@@H]2[N@H+]1C/C=C/c1ccc(Cl)cc1 ZINC000560927993 332395340 /nfs/dbraw/zinc/39/53/40/332395340.db2.gz USUUWIQKBYJOFZ-GHKOJRRNSA-N 0 1 319.832 4.071 20 0 DIADMN CCOc1ccccc1[C@@H](CC)NCc1c(C)nsc1C ZINC000566417099 332395955 /nfs/dbraw/zinc/39/59/55/332395955.db2.gz RWSBJDWNYPGEMV-MRXNPFEDSA-N 0 1 304.459 4.400 20 0 DIADMN Cc1c([C@@H](C)N[C@@H]2CCc3ccc(F)cc32)cnn1C(C)(C)C ZINC000526050428 332418926 /nfs/dbraw/zinc/41/89/26/332418926.db2.gz IADFIGVRBCHEDA-KZULUSFZSA-N 0 1 315.436 4.424 20 0 DIADMN CC1=C[C@H](C)C[C@@H](CNCc2noc(-c3ccccc3C)n2)C1 ZINC000428282638 332426832 /nfs/dbraw/zinc/42/68/32/332426832.db2.gz XEHGZXDQEYGWMM-XJKSGUPXSA-N 0 1 311.429 4.127 20 0 DIADMN Cc1ncncc1[C@@H](C)N[C@H]1CCSc2ccc(Cl)cc21 ZINC000566474739 332439794 /nfs/dbraw/zinc/43/97/94/332439794.db2.gz IQYWNUUWAZCUCS-ABAIWWIYSA-N 0 1 319.861 4.326 20 0 DIADMN Cc1ncncc1[C@@H](C)N[C@@H]1CCSc2ccc(Cl)cc21 ZINC000566474742 332439803 /nfs/dbraw/zinc/43/98/03/332439803.db2.gz IQYWNUUWAZCUCS-IAQYHMDHSA-N 0 1 319.861 4.326 20 0 DIADMN C[C@H](NCc1ccc(C(F)(F)F)s1)c1cncc(F)c1 ZINC000428863669 332442385 /nfs/dbraw/zinc/44/23/85/332442385.db2.gz AKILACHMACTTNY-QMMMGPOBSA-N 0 1 304.312 4.152 20 0 DIADMN Fc1ccc2c(c1)CC[C@H]2NCc1nc2ccc(F)cc2s1 ZINC000428866331 332443416 /nfs/dbraw/zinc/44/34/16/332443416.db2.gz YLMSDIGNKGBPGW-CQSZACIVSA-N 0 1 316.376 4.352 20 0 DIADMN Cc1ccccc1CCC(=O)Nc1cc(Cl)c(O)cc1F ZINC000561651640 332474161 /nfs/dbraw/zinc/47/41/61/332474161.db2.gz MLRKLPNTVQIDRM-UHFFFAOYSA-N 0 1 307.752 4.064 20 0 DIADMN COc1cc(C)ccc1CNCc1ccc(C(F)(F)F)cc1 ZINC000151014571 332479498 /nfs/dbraw/zinc/47/94/98/332479498.db2.gz JKZJPTKXGYMZGR-UHFFFAOYSA-N 0 1 309.331 4.312 20 0 DIADMN C[C@@H]1Cc2ccc(F)cc2[C@@H]1NCc1cnn(-c2ccccc2)c1 ZINC000151035088 332488401 /nfs/dbraw/zinc/48/84/01/332488401.db2.gz JTGGXGLGSYBHNX-JLTOFOAXSA-N 0 1 321.399 4.035 20 0 DIADMN CCCOc1ccc(CN[C@H]2C[C@@H]2C(F)F)c(OCCC)c1 ZINC000561749786 332490373 /nfs/dbraw/zinc/49/03/73/332490373.db2.gz IUGSBLSZKWEDNA-GJZGRUSLSA-N 0 1 313.388 4.007 20 0 DIADMN C[C@H](NC/C=C\c1ccc(F)cc1)c1nccn1-c1ccccc1 ZINC000561748183 332491388 /nfs/dbraw/zinc/49/13/88/332491388.db2.gz YBEUCFNUGSLFML-KJPDOMRESA-N 0 1 321.399 4.375 20 0 DIADMN CCSc1cc(CN[C@H](c2ccc(F)cn2)C(C)C)ccn1 ZINC000427893935 332556952 /nfs/dbraw/zinc/55/69/52/332556952.db2.gz PTTNOGFCRYLUMG-KRWDZBQOSA-N 0 1 319.449 4.215 20 0 DIADMN CCc1nc(C)c([C@H](C)N[C@@H](C)c2cnn(C(C)C)c2)s1 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/nfs/dbraw/zinc/09/72/98/334097298.db2.gz PGIAOPXFLDZPNW-SFHVURJKSA-N 0 1 316.420 4.415 20 0 DIADMN CCCOc1ccc([C@@H](C)NCc2scnc2C)cc1OC ZINC000343604479 335176768 /nfs/dbraw/zinc/17/67/68/335176768.db2.gz KTHAOZJURHLHIQ-GFCCVEGCSA-N 0 1 320.458 4.100 20 0 DIADMN c1coc([C@H]2N(C[C@H]3CCC4(CCCC4)O3)CC23CCC3)c1 ZINC000520969908 334124858 /nfs/dbraw/zinc/12/48/58/334124858.db2.gz HNZJTTAAAYIUCH-NVXWUHKLSA-N 0 1 301.430 4.298 20 0 DIADMN C[C@H](CSc1nc(-c2cc(F)cc(F)c2)n[nH]1)C(F)(F)F ZINC000439051813 334148768 /nfs/dbraw/zinc/14/87/68/334148768.db2.gz WHCONSAOIAREIN-ZCFIWIBFSA-N 0 1 323.290 4.040 20 0 DIADMN Cc1ccc([C@H]2[C@H](C)CCCN2C(=O)c2cnc(C3CC3)[nH]2)cc1 ZINC000343596668 335180515 /nfs/dbraw/zinc/18/05/15/335180515.db2.gz LDZVXSXJDVWGNW-RDTXWAMCSA-N 0 1 323.440 4.209 20 0 DIADMN CC[C@H]1CN([C@@H](C)c2cccc(Br)c2)CCCO1 ZINC000439466764 334180894 /nfs/dbraw/zinc/18/08/94/334180894.db2.gz HRSFCDHPWJJLQB-WFASDCNBSA-N 0 1 312.251 4.011 20 0 DIADMN Cc1ccc([C@H](NCc2cc(F)cnc2Cl)C2CC2)cc1 ZINC000295052709 334216024 /nfs/dbraw/zinc/21/60/24/334216024.db2.gz FYCQONCSWUPQSO-INIZCTEOSA-N 0 1 304.796 4.423 20 0 DIADMN CC(C)c1nnc(CN2CC[C@H](c3ccccc3)[C@H]2C)s1 ZINC000295141249 334219764 /nfs/dbraw/zinc/21/97/64/334219764.db2.gz ZOXDBZWZPWKFCL-HIFRSBDPSA-N 0 1 301.459 4.040 20 0 DIADMN Cc1ncc([C@@H](C)N[C@@H]2CCCc3c(F)cc(F)cc32)c(C)n1 ZINC000297396214 334241073 /nfs/dbraw/zinc/24/10/73/334241073.db2.gz SDGXUQCOYVKPMI-ADLMAVQZSA-N 0 1 317.383 4.100 20 0 DIADMN c1c(CNCc2ccc(C3CCCCC3)cc2)nc2ncccn12 ZINC000297404431 334241193 /nfs/dbraw/zinc/24/11/93/334241193.db2.gz KUCBMABTZHEKJW-UHFFFAOYSA-N 0 1 320.440 4.067 20 0 DIADMN CCSc1cc(CN[C@@H](CC)c2ccccc2OC)ccn1 ZINC000187794152 334274968 /nfs/dbraw/zinc/27/49/68/334274968.db2.gz IRTONNQRZSLWMP-INIZCTEOSA-N 0 1 316.470 4.443 20 0 DIADMN C[C@@H](NCCOc1ccc(Cl)c(Cl)c1)c1nccs1 ZINC000453292811 334250055 /nfs/dbraw/zinc/25/00/55/334250055.db2.gz OTKKGJPLNJTUFG-SECBINFHSA-N 0 1 317.241 4.180 20 0 DIADMN COc1cccc2c1CC[C@H]2NCc1ccc(Cl)cc1F ZINC000187585019 334265675 /nfs/dbraw/zinc/26/56/75/334265675.db2.gz ANLGEZWEAQXIHM-MRXNPFEDSA-N 0 1 305.780 4.265 20 0 DIADMN CCCCN(C)CC(=O)Nc1ccccc1Oc1ccccc1 ZINC000016476580 334266223 /nfs/dbraw/zinc/26/62/23/334266223.db2.gz HXCONWNGFOGLCZ-UHFFFAOYSA-N 0 1 312.413 4.149 20 0 DIADMN Cc1ccccc1-c1cnc(CN2CC[C@@H]2Cc2ccccc2)o1 ZINC000534529100 334279230 /nfs/dbraw/zinc/27/92/30/334279230.db2.gz XQBBIDZTFSKUKI-GOSISDBHSA-N 0 1 318.420 4.467 20 0 DIADMN Clc1ccc(CNCc2cccc3c2NCC3)c(Cl)c1 ZINC000415098960 334281349 /nfs/dbraw/zinc/28/13/49/334281349.db2.gz GEVNRNAYEJEFOH-UHFFFAOYSA-N 0 1 307.224 4.251 20 0 DIADMN CCC[C@@H]1[C@@H](C)CCCN1CC(=O)Nc1c(C)cccc1Cl ZINC000534550973 334281465 /nfs/dbraw/zinc/28/14/65/334281465.db2.gz CTQXNPJDDJJCIP-XJKSGUPXSA-N 0 1 322.880 4.488 20 0 DIADMN Fc1ccc(SCCN2CC=C(C(F)(F)F)CC2)cc1 ZINC000534545365 334282429 /nfs/dbraw/zinc/28/24/29/334282429.db2.gz UNEIZQUTZWTRCO-UHFFFAOYSA-N 0 1 305.340 4.112 20 0 DIADMN C[C@@H](c1nc2ccccc2s1)N(C)CCOc1ccccc1 ZINC000302603578 334287557 /nfs/dbraw/zinc/28/75/57/334287557.db2.gz QIBJQFMIZVXJNW-AWEZNQCLSA-N 0 1 312.438 4.368 20 0 DIADMN C[C@@H](c1ccccc1Cl)[N@H+](C)Cc1ccsc1C(=O)[O-] ZINC000110956826 334296269 /nfs/dbraw/zinc/29/62/69/334296269.db2.gz HQDCBLGZBGZRKV-JTQLQIEISA-N 0 1 309.818 4.293 20 0 DIADMN C[C@@H](c1ccccc1Cl)[N@@H+](C)Cc1ccsc1C(=O)[O-] ZINC000110956826 334296271 /nfs/dbraw/zinc/29/62/71/334296271.db2.gz HQDCBLGZBGZRKV-JTQLQIEISA-N 0 1 309.818 4.293 20 0 DIADMN C[C@H](c1ccccc1Cl)[N@H+](C)Cc1ccsc1C(=O)[O-] ZINC000110956828 334296300 /nfs/dbraw/zinc/29/63/00/334296300.db2.gz HQDCBLGZBGZRKV-SNVBAGLBSA-N 0 1 309.818 4.293 20 0 DIADMN C[C@H](c1ccccc1Cl)[N@@H+](C)Cc1ccsc1C(=O)[O-] ZINC000110956828 334296301 /nfs/dbraw/zinc/29/63/01/334296301.db2.gz HQDCBLGZBGZRKV-SNVBAGLBSA-N 0 1 309.818 4.293 20 0 DIADMN CCN(CC)[C@H](C(=O)Nc1ccc(C)c(F)c1)c1ccccc1 ZINC000111034449 334300183 /nfs/dbraw/zinc/30/01/83/334300183.db2.gz ANRQUEDQEBBHRB-SFHVURJKSA-N 0 1 314.404 4.156 20 0 DIADMN CCN(CC)[C@@H](C(=O)Nc1ccc(C)c(F)c1)c1ccccc1 ZINC000111034452 334300301 /nfs/dbraw/zinc/30/03/01/334300301.db2.gz ANRQUEDQEBBHRB-GOSISDBHSA-N 0 1 314.404 4.156 20 0 DIADMN CC(C)OCc1ccccc1CN[C@@H](C)c1cnn(C(C)C)c1 ZINC000531948582 334302811 /nfs/dbraw/zinc/30/28/11/334302811.db2.gz WRAYDYCYSPZGAK-INIZCTEOSA-N 0 1 315.461 4.240 20 0 DIADMN C[C@@H](NCCn1cccn1)c1ccc(Cl)c(Cl)c1Cl ZINC000049075360 334316056 /nfs/dbraw/zinc/31/60/56/334316056.db2.gz FSSGUPLANFQHFR-SECBINFHSA-N 0 1 318.635 4.194 20 0 DIADMN C[C@H]1[C@@H](Cc2ccccc2)CCN1Cc1csc(C2CC2)n1 ZINC000534672286 334320495 /nfs/dbraw/zinc/32/04/95/334320495.db2.gz ZZROLTLPMPEYKL-WMLDXEAASA-N 0 1 312.482 4.474 20 0 DIADMN Cc1cc(N[C@H](C)c2cnn(C(C)C)c2)c2cc(F)ccc2n1 ZINC000531962721 334320647 /nfs/dbraw/zinc/32/06/47/334320647.db2.gz FGECPRYTNBHJQF-CYBMUJFWSA-N 0 1 312.392 4.055 20 0 DIADMN CC[C@@H](C)CN(C)Cc1csc(-c2cccc(OC)c2)n1 ZINC000303511851 334324140 /nfs/dbraw/zinc/32/41/40/334324140.db2.gz XCKXFSXIFDRGSU-CYBMUJFWSA-N 0 1 304.459 4.297 20 0 DIADMN CCC1(C)CCN(C(=O)c2cc(C3CCCCC3)[nH]n2)CC1 ZINC000534695659 334327672 /nfs/dbraw/zinc/32/76/72/334327672.db2.gz KJHHDIIMQKYCSK-UHFFFAOYSA-N 0 1 303.450 4.110 20 0 DIADMN CC(=O)c1c(C)cc(C)c(CN2CCS[C@@H](C)[C@@H]2C)c1C ZINC000303733853 334329892 /nfs/dbraw/zinc/32/98/92/334329892.db2.gz WDIQCCUKFLZUKS-HOCLYGCPSA-N 0 1 305.487 4.140 20 0 DIADMN Cc1ccc(C[C@@H](C)N(C)CC(=O)Nc2cc(C)ccc2C)cc1 ZINC000303739237 334330078 /nfs/dbraw/zinc/33/00/78/334330078.db2.gz HVJPRVNOLUMWJQ-GOSISDBHSA-N 0 1 324.468 4.113 20 0 DIADMN Cc1n[nH]cc1CN[C@H](C)c1ccc(Oc2ccccc2)cc1 ZINC000101599299 334336526 /nfs/dbraw/zinc/33/65/26/334336526.db2.gz FMQNONVATBCBRK-CQSZACIVSA-N 0 1 307.397 4.361 20 0 DIADMN Cc1c(Br)cccc1CN(C)CCC(F)(F)F ZINC000534914601 334346190 /nfs/dbraw/zinc/34/61/90/334346190.db2.gz WAXDCSQIABCKKC-UHFFFAOYSA-N 0 1 310.157 4.142 20 0 DIADMN C[C@H](NCCOC1CCCC1)c1sccc1Br ZINC000111634227 334348169 /nfs/dbraw/zinc/34/81/69/334348169.db2.gz LKFVCKTYKOEZOK-JTQLQIEISA-N 0 1 318.280 4.120 20 0 DIADMN Oc1cc(Cl)ccc1-c1nc(-c2ccc(F)c(F)c2)no1 ZINC000111688019 334353530 /nfs/dbraw/zinc/35/35/30/334353530.db2.gz WPYBWMWAEBSYGB-UHFFFAOYSA-N 0 1 308.671 4.041 20 0 DIADMN Cc1cc(-c2noc(-c3ccc(O)c(Cl)c3)n2)ccc1F ZINC000111688074 334353622 /nfs/dbraw/zinc/35/36/22/334353622.db2.gz NJXWTCIBKGFFDQ-UHFFFAOYSA-N 0 1 304.708 4.210 20 0 DIADMN CC(C)(C)CCN1CCO[C@@H](c2ccc(OC(F)F)cc2)C1 ZINC000535033781 334357257 /nfs/dbraw/zinc/35/72/57/334357257.db2.gz JBZBGIGAOLTQQH-OAHLLOKOSA-N 0 1 313.388 4.098 20 0 DIADMN CSc1cccc(N(C)C(=O)c2ccc(Cl)cc2O)c1 ZINC000101837653 334358747 /nfs/dbraw/zinc/35/87/47/334358747.db2.gz SBRXALLKWFIXFA-UHFFFAOYSA-N 0 1 307.802 4.044 20 0 DIADMN CSc1cccc(N(C)C(=O)c2cc(-c3ccccc3)n[nH]2)c1 ZINC000101870475 334360235 /nfs/dbraw/zinc/36/02/35/334360235.db2.gz ZFGBZTZBCHCDFY-UHFFFAOYSA-N 0 1 323.421 4.075 20 0 DIADMN CCN(Cc1ccccc1)Cc1cnc(-c2ccccc2)nc1 ZINC000535063086 334362097 /nfs/dbraw/zinc/36/20/97/334362097.db2.gz VKDPHIZAZOZWCO-UHFFFAOYSA-N 0 1 303.409 4.166 20 0 DIADMN CC(C)c1ccc(OC2CCN(Cc3cccn3C)CC2)cc1 ZINC000535079670 334365752 /nfs/dbraw/zinc/36/57/52/334365752.db2.gz DTYWOUHTWQYFCR-UHFFFAOYSA-N 0 1 312.457 4.192 20 0 DIADMN CCCOc1ccc(CN2CCC(C(F)(F)F)CC2)cc1 ZINC000535080691 334365904 /nfs/dbraw/zinc/36/59/04/334365904.db2.gz FTZPOIOATZBDPX-UHFFFAOYSA-N 0 1 301.352 4.250 20 0 DIADMN Cc1ccccc1[C@@H](CO)N[C@@H]1C[C@H](C)Sc2sccc21 ZINC000531993947 334367220 /nfs/dbraw/zinc/36/72/20/334367220.db2.gz SRFPQIBKKNKYCK-APHBMKBZSA-N 0 1 319.495 4.305 20 0 DIADMN CC[C@@H](N[C@@H](CO)c1ccccc1C)c1ccc(F)cc1F ZINC000531994876 334369298 /nfs/dbraw/zinc/36/92/98/334369298.db2.gz KVILNXDQBKDAIK-MSOLQXFVSA-N 0 1 305.368 4.048 20 0 DIADMN Cc1nccnc1[C@H](C)NCc1ccc(Oc2ccccc2)cc1 ZINC000187915808 334370716 /nfs/dbraw/zinc/37/07/16/334370716.db2.gz RVPLFNPXZNKJSH-INIZCTEOSA-N 0 1 319.408 4.428 20 0 DIADMN OCc1ccccc1CN[C@H]1CCSc2ccc(Cl)cc21 ZINC000305126824 334375668 /nfs/dbraw/zinc/37/56/68/334375668.db2.gz LNYDGOLENKFGKN-INIZCTEOSA-N 0 1 319.857 4.159 20 0 DIADMN Cc1noc(C)c1CC[N@H+]1C[C@H](C)C[C@H]1c1cccc(F)c1 ZINC000535204242 334380289 /nfs/dbraw/zinc/38/02/89/334380289.db2.gz CNNMGAGTPYYTDM-XIKOKIGWSA-N 0 1 302.393 4.056 20 0 DIADMN CCC1(CC)CCN(Cc2csc(-c3ccccn3)n2)C1 ZINC000532038460 334382990 /nfs/dbraw/zinc/38/29/90/334382990.db2.gz RNVWEDLWQHJJRA-UHFFFAOYSA-N 0 1 301.459 4.217 20 0 DIADMN Fc1ccc2c(c1)nccc2NCc1nccn1-c1ccccc1 ZINC000340925632 334394196 /nfs/dbraw/zinc/39/41/96/334394196.db2.gz ODRHXTQWKSIXPY-UHFFFAOYSA-N 0 1 318.355 4.172 20 0 DIADMN Cc1ccc([C@H](C)c2noc([C@H](C)N3[C@@H](C)CC[C@@H]3C)n2)cc1 ZINC000443200277 338447127 /nfs/dbraw/zinc/44/71/27/338447127.db2.gz GDUTVCRNDJTMSV-VGWMRTNUSA-N 0 1 313.445 4.464 20 0 DIADMN CO[C@@H](C)CN[C@H](c1ccc(F)cc1)c1cnc2ccccc2c1 ZINC000443208340 338447455 /nfs/dbraw/zinc/44/74/55/338447455.db2.gz BALUGGQOCKDEHO-VBKZILBWSA-N 0 1 324.399 4.088 20 0 DIADMN Cc1ccccc1[C@H](C)c1noc([C@H](C)N2[C@H](C)CC[C@H]2C)n1 ZINC000443218319 338447737 /nfs/dbraw/zinc/44/77/37/338447737.db2.gz RBNGLXCIYWNYRQ-WCVJEAGWSA-N 0 1 313.445 4.464 20 0 DIADMN Cc1[nH]c2ccc(-c3noc(CN4[C@@H](C)CC[C@@H]4C)n3)cc2c1C ZINC000443221778 338447941 /nfs/dbraw/zinc/44/79/41/338447941.db2.gz MDYVSMGHOBQQBK-RYUDHWBXSA-N 0 1 324.428 4.208 20 0 DIADMN CSc1cc(C)ccc1CNCc1cn(C(C)C)nc1C ZINC000341410234 334443249 /nfs/dbraw/zinc/44/32/49/334443249.db2.gz VAMSZNLVKSSTIP-UHFFFAOYSA-N 0 1 303.475 4.093 20 0 DIADMN Cc1cc(CN[C@H](CC(C)(C)C)c2ccc(F)cc2)nn1C ZINC000341469650 334451337 /nfs/dbraw/zinc/45/13/37/334451337.db2.gz VOXPLLVPGOQXER-QGZVFWFLSA-N 0 1 303.425 4.135 20 0 DIADMN Cc1ccc(C2CCN(Cc3cnc(C(C)C)s3)CC2)cn1 ZINC000341522436 334454104 /nfs/dbraw/zinc/45/41/04/334454104.db2.gz DMRVWABDEUBFPR-UHFFFAOYSA-N 0 1 315.486 4.350 20 0 DIADMN COc1ccc2c(c1)[C@H](NCc1coc3ccccc13)CCO2 ZINC000341552579 334457376 /nfs/dbraw/zinc/45/73/76/334457376.db2.gz VBELRBVOXWPSAY-QGZVFWFLSA-N 0 1 309.365 4.055 20 0 DIADMN COc1ccc2c(c1)[C@@H](NCc1ccc(Cl)c(C)c1)CCO2 ZINC000341552536 334457593 /nfs/dbraw/zinc/45/75/93/334457593.db2.gz GRNRZYIGCLUAHD-KRWDZBQOSA-N 0 1 317.816 4.270 20 0 DIADMN c1cc2c(s1)CCC[C@H]2NCc1cnc([C@H]2CCCO2)s1 ZINC000341556703 334457830 /nfs/dbraw/zinc/45/78/30/334457830.db2.gz TUWYTXWUGYFUOD-ZIAGYGMSSA-N 0 1 320.483 4.223 20 0 DIADMN c1ccc(C2CCN(Cc3nc4cccnc4s3)CC2)cc1 ZINC000341609313 334461411 /nfs/dbraw/zinc/46/14/11/334461411.db2.gz SQHLIGMTIRKZGD-UHFFFAOYSA-N 0 1 309.438 4.071 20 0 DIADMN Clc1cnc(CNCCc2cccc3ccccc32)s1 ZINC000472064130 334475647 /nfs/dbraw/zinc/47/56/47/334475647.db2.gz HLKDDSCPAINJIJ-UHFFFAOYSA-N 0 1 302.830 4.282 20 0 DIADMN Cc1ccc2cc(CN[C@@H]3c4ccc(F)cc4O[C@@H]3C)ccc2n1 ZINC000342282156 334524333 /nfs/dbraw/zinc/52/43/33/334524333.db2.gz PAAACHLGRGVDHM-XCLFUZPHSA-N 0 1 322.383 4.294 20 0 DIADMN Cc1ccc2cc(CN[C@H]3c4ccc(F)cc4O[C@H]3C)ccc2n1 ZINC000342282149 334524355 /nfs/dbraw/zinc/52/43/55/334524355.db2.gz PAAACHLGRGVDHM-RNODOKPDSA-N 0 1 322.383 4.294 20 0 DIADMN C[C@@H]1CCc2nc(CNCc3cccc4cc[nH]c43)sc2C1 ZINC000342315565 334531512 /nfs/dbraw/zinc/53/15/12/334531512.db2.gz QHGQYAVPULRBIY-GFCCVEGCSA-N 0 1 311.454 4.039 20 0 DIADMN C[C@@H](NCc1cncc(F)c1)c1ccc(Oc2cccnc2)cc1 ZINC000342318749 334532188 /nfs/dbraw/zinc/53/21/88/334532188.db2.gz SRBOVIIAPKVJAA-CQSZACIVSA-N 0 1 323.371 4.259 20 0 DIADMN CC[C@H](N[C@@H](C)c1cnc(OC)c(Cl)c1)c1c(C)noc1C ZINC000342730605 334569935 /nfs/dbraw/zinc/56/99/35/334569935.db2.gz JWUSTZMZTCMUMB-XPTSAGLGSA-N 0 1 323.824 4.150 20 0 DIADMN CCc1ccc(C(C)(C)NCc2cc(C(F)(F)F)n[nH]2)cc1 ZINC000440627359 334607714 /nfs/dbraw/zinc/60/77/14/334607714.db2.gz PZCZZSKWLILPLC-UHFFFAOYSA-N 0 1 311.351 4.016 20 0 DIADMN Cc1nc(C2(NC[C@@H]3C(C)=CCC[C@H]3C)CCCCC2)no1 ZINC000443642297 338458598 /nfs/dbraw/zinc/45/85/98/338458598.db2.gz NVAJUXORUPHWAR-GDBMZVCRSA-N 0 1 303.450 4.119 20 0 DIADMN COC(=O)c1coc([C@@H](C)N[C@H](C)c2ccc(C3CC3)cc2)c1 ZINC000417358183 334707489 /nfs/dbraw/zinc/70/74/89/334707489.db2.gz SRLBDGAGAMPTGS-CHWSQXEVSA-N 0 1 313.397 4.355 20 0 DIADMN C[C@@H](N[C@@H]1COCc2ccccc21)c1cnc2ccsc2c1 ZINC000417359889 334723265 /nfs/dbraw/zinc/72/32/65/334723265.db2.gz JCCRGNDRPNIOQP-SJKOYZFVSA-N 0 1 310.422 4.218 20 0 DIADMN C[C@H](N[C@H]1CCCC[C@@H]1C)c1nc(Cc2ccc(F)cc2)no1 ZINC000124063195 334743535 /nfs/dbraw/zinc/74/35/35/334743535.db2.gz NBJAUSWXEFCCCB-XEZPLFJOSA-N 0 1 317.408 4.029 20 0 DIADMN CCCOc1ncccc1CNCc1ccc(C)c(Cl)c1 ZINC000443991430 338465799 /nfs/dbraw/zinc/46/57/99/338465799.db2.gz WFZZVPWXXPSTKW-UHFFFAOYSA-N 0 1 304.821 4.122 20 0 DIADMN CC(C)c1nn(-c2ccccc2)cc1CN1CC(CC(F)F)C1 ZINC000425353490 334820603 /nfs/dbraw/zinc/82/06/03/334820603.db2.gz JDRPWCIPBGWZCV-UHFFFAOYSA-N 0 1 319.399 4.083 20 0 DIADMN c1c2ccccc2sc1CNCc1ccc2c(n1)CCCC2 ZINC000444040074 338467670 /nfs/dbraw/zinc/46/76/70/338467670.db2.gz ZJLWHRVWBYBGCS-UHFFFAOYSA-N 0 1 308.450 4.465 20 0 DIADMN Fc1ccc(CC2CCN(Cc3ccncc3Cl)CC2)cc1 ZINC000441537928 334857509 /nfs/dbraw/zinc/85/75/09/334857509.db2.gz YAUSUGRZPPIPQT-UHFFFAOYSA-N 0 1 318.823 4.329 20 0 DIADMN CC[C@H](N[C@H](C)c1ccncc1OC)c1cc(C)ccc1OC ZINC000188761529 334871177 /nfs/dbraw/zinc/87/11/77/334871177.db2.gz SYIKQJUUKPQSOH-PBHICJAKSA-N 0 1 314.429 4.209 20 0 DIADMN CCSc1ccc([C@H](C)NCc2cncc(OC)c2)cc1 ZINC000343712948 335186091 /nfs/dbraw/zinc/18/60/91/335186091.db2.gz GTVFVGZOVCWDAG-ZDUSSCGKSA-N 0 1 302.443 4.053 20 0 DIADMN CCSc1ccc([C@@H](C)NCc2cncc(OC)c2)cc1 ZINC000343712934 335186124 /nfs/dbraw/zinc/18/61/24/335186124.db2.gz GTVFVGZOVCWDAG-CYBMUJFWSA-N 0 1 302.443 4.053 20 0 DIADMN C[C@@H](NC1CC(OC(C)(C)C)C1)c1nc(C(F)(F)F)cs1 ZINC000343719696 335186352 /nfs/dbraw/zinc/18/63/52/335186352.db2.gz FKMNTEVMCGFPJN-XNWIYYODSA-N 0 1 322.396 4.159 20 0 DIADMN C[C@H](O)CCCNC1(c2c(Cl)cccc2Cl)CCC1 ZINC000450876089 338710074 /nfs/dbraw/zinc/71/00/74/338710074.db2.gz RTWHSMOBHWLVPV-NSHDSACASA-N 0 1 302.245 4.123 20 0 DIADMN C[C@H](NCCc1ccsc1)c1nc(C(F)(F)F)cs1 ZINC000343827433 335196055 /nfs/dbraw/zinc/19/60/55/335196055.db2.gz BGGJRAJTRXSESS-QMMMGPOBSA-N 0 1 306.378 4.117 20 0 DIADMN CCSCC[C@@H](C)N[C@H](C)c1nc(C(F)(F)F)cs1 ZINC000343844367 335196808 /nfs/dbraw/zinc/19/68/08/335196808.db2.gz VETAQPPXQULSSU-RKDXNWHRSA-N 0 1 312.426 4.344 20 0 DIADMN Cc1cncc([C@H](C)N[C@H](c2ccc(F)cc2)[C@H]2CCCO2)c1 ZINC000343838523 335201083 /nfs/dbraw/zinc/20/10/83/335201083.db2.gz JNCYYOHHDVGSIG-GDIGMMSISA-N 0 1 314.404 4.100 20 0 DIADMN COC[C@H](N[C@@H](C)c1cnccc1C)c1cccc(Cl)c1 ZINC000343936983 335203136 /nfs/dbraw/zinc/20/31/36/335203136.db2.gz PFQBXNNEEYOATM-GUYCJALGSA-N 0 1 304.821 4.082 20 0 DIADMN COc1cccc([C@H]2C[C@@H](C)CN2Cc2nc(C)c(C)s2)c1 ZINC000344070132 335214485 /nfs/dbraw/zinc/21/44/85/335214485.db2.gz PZVKQLLLCQLOSH-SJKOYZFVSA-N 0 1 316.470 4.352 20 0 DIADMN CCC[C@@H](N[C@@H]1CCOc2ccc(OC)cc21)c1ccccn1 ZINC000344101993 335223057 /nfs/dbraw/zinc/22/30/57/335223057.db2.gz DUMOLLAMCKKBGY-SJLPKXTDSA-N 0 1 312.413 4.045 20 0 DIADMN CC[C@@]1(C)CCN([C@H](C)C(=O)Nc2c(C)cc(C)cc2C)C1 ZINC000344213087 335225608 /nfs/dbraw/zinc/22/56/08/335225608.db2.gz HMQJLEWVKPVBFG-APWZRJJASA-N 0 1 302.462 4.061 20 0 DIADMN Clc1cccc(CNCc2cnc(-c3ccncc3)s2)c1 ZINC000344215560 335225831 /nfs/dbraw/zinc/22/58/31/335225831.db2.gz PJPVNNPDOQLIKW-UHFFFAOYSA-N 0 1 315.829 4.148 20 0 DIADMN CC[C@]1(C)CCN(Cc2nnc(-c3cccc(Cl)c3)o2)C1 ZINC000344240288 335231312 /nfs/dbraw/zinc/23/13/12/335231312.db2.gz BVEILGWXOISYFZ-MRXNPFEDSA-N 0 1 305.809 4.012 20 0 DIADMN Cc1cc2cc[nH]c2cc1NC(=O)c1cc(Cl)ccc1O ZINC000444459454 338473691 /nfs/dbraw/zinc/47/36/91/338473691.db2.gz YNFXPZOTWGUQSW-UHFFFAOYSA-N 0 1 300.745 4.088 20 0 DIADMN Cc1nn(C(C)(C)C)c(C)c1CN[C@@H]1CSc2ccccc21 ZINC000344457156 335250240 /nfs/dbraw/zinc/25/02/40/335250240.db2.gz JMPZJJZDOSTRSU-MRXNPFEDSA-N 0 1 315.486 4.192 20 0 DIADMN Cc1cc2cc(CN[C@@H](CCO)c3ccccc3)oc2cc1C ZINC000344455784 335250355 /nfs/dbraw/zinc/25/03/55/335250355.db2.gz GUMRUXBZOZZLDU-IBGZPJMESA-N 0 1 309.409 4.263 20 0 DIADMN Cc1cc2occ(CC(=O)Nc3ccc4nc[nH]c4c3)c2cc1C ZINC000344474144 335251839 /nfs/dbraw/zinc/25/18/39/335251839.db2.gz YMHFJJKBUGRKOF-UHFFFAOYSA-N 0 1 319.364 4.107 20 0 DIADMN C[C@@H](c1cnccn1)N1CCC(F)(c2ccc(Cl)cc2)CC1 ZINC000366867998 335256039 /nfs/dbraw/zinc/25/60/39/335256039.db2.gz XJVDBLWJRKVODZ-ZDUSSCGKSA-N 0 1 319.811 4.152 20 0 DIADMN C[C@H](c1cnccn1)N1CCC(F)(c2ccc(Cl)cc2)CC1 ZINC000366867997 335256153 /nfs/dbraw/zinc/25/61/53/335256153.db2.gz XJVDBLWJRKVODZ-CYBMUJFWSA-N 0 1 319.811 4.152 20 0 DIADMN C[C@H](NCc1csc(C2CC2)n1)[C@@H]1Oc2ccccc2[C@@H]1C ZINC000344691096 335267015 /nfs/dbraw/zinc/26/70/15/335267015.db2.gz HZGUVWDBKJJDNF-NVGCLXPQSA-N 0 1 314.454 4.063 20 0 DIADMN Cn1cc([C@H](NCc2cc3cc(F)ccc3o2)C(C)(C)C)cn1 ZINC000344802754 335278512 /nfs/dbraw/zinc/27/85/12/335278512.db2.gz DOZMCEVEYRBZPX-KRWDZBQOSA-N 0 1 315.392 4.182 20 0 DIADMN O=C(Nc1ccc2nc(-c3ccco3)[nH]c2c1)C12CCC(CC1)C2 ZINC000344841566 335279391 /nfs/dbraw/zinc/27/93/91/335279391.db2.gz IYIVQGZUUSVSMM-UHFFFAOYSA-N 0 1 321.380 4.342 20 0 DIADMN Cc1n[nH]c(C(F)F)c1NC(=O)c1cc(F)c2ccccc2c1 ZINC000344849848 335279652 /nfs/dbraw/zinc/27/96/52/335279652.db2.gz RISNIACPRCDISR-UHFFFAOYSA-N 0 1 319.286 4.200 20 0 DIADMN COc1cccc(CN[C@H]2CC(C)(C)Cc3occc32)c1OC ZINC000165953511 335282551 /nfs/dbraw/zinc/28/25/51/335282551.db2.gz SFYKWDGNEPSBOZ-HNNXBMFYSA-N 0 1 315.413 4.100 20 0 DIADMN CSC[C@H](C)N[C@@H](c1cc2ccccc2o1)c1cccnc1 ZINC000345056201 335295810 /nfs/dbraw/zinc/29/58/10/335295810.db2.gz JNIWNNYYUQKODK-SCLBCKFNSA-N 0 1 312.438 4.258 20 0 DIADMN Cc1sc2ncnc(NCc3nc4cccc(C)c4[nH]3)c2c1C ZINC000345157933 335302423 /nfs/dbraw/zinc/30/24/23/335302423.db2.gz CNSSHWISLASFJP-UHFFFAOYSA-N 0 1 323.425 4.105 20 0 DIADMN Cc1c([C@@H](C)NCc2cnc3ccccc3c2)cnn1C(C)(C)C ZINC000345289205 335314124 /nfs/dbraw/zinc/31/41/24/335314124.db2.gz IYAYXQGHMDGFTD-CQSZACIVSA-N 0 1 322.456 4.346 20 0 DIADMN Cc1c([C@@H](C)N[C@H]2CSc3ccccc32)cnn1C(C)C ZINC000345329623 335317644 /nfs/dbraw/zinc/31/76/44/335317644.db2.gz ZIFORJXNKFYBHW-WBMJQRKESA-N 0 1 301.459 4.270 20 0 DIADMN CSc1ccc(F)cc1CN[C@@H](C)c1cnn(C(C)C)c1C ZINC000345330092 335317944 /nfs/dbraw/zinc/31/79/44/335317944.db2.gz RMANBOKCYPQVJP-LBPRGKRZSA-N 0 1 321.465 4.484 20 0 DIADMN OCC[C@@H](N[C@H](CC1CC1)c1ccc(Cl)cc1)c1ccco1 ZINC000345276978 335318490 /nfs/dbraw/zinc/31/84/90/335318490.db2.gz RRPOLSWSYGMHCL-IAGOWNOFSA-N 0 1 319.832 4.488 20 0 DIADMN Cc1csc(C2(NCCO[C@@H]3CCCC[C@H]3C)CCC2)n1 ZINC000345677490 335340914 /nfs/dbraw/zinc/34/09/14/335340914.db2.gz ZOKNFQVYQJSTQR-UKRRQHHQSA-N 0 1 308.491 4.016 20 0 DIADMN CC[C@@H](c1ccccc1)N(CC)C(=O)c1cccc2n[nH]cc21 ZINC000345833722 335354224 /nfs/dbraw/zinc/35/42/24/335354224.db2.gz MCDHXQXPSSJPEO-SFHVURJKSA-N 0 1 307.397 4.176 20 0 DIADMN Cc1cccc2nc(CNC(=O)c3ccc4sccc4c3)[nH]c21 ZINC000345856697 335356094 /nfs/dbraw/zinc/35/60/94/335356094.db2.gz VJDDSYBGMGAOKL-UHFFFAOYSA-N 0 1 321.405 4.016 20 0 DIADMN CCOc1cc(C)ccc1CN[C@@H]1CCCOc2ccccc21 ZINC000346083442 335377321 /nfs/dbraw/zinc/37/73/21/335377321.db2.gz BTVOIDDHYYKKCH-GOSISDBHSA-N 0 1 311.425 4.397 20 0 DIADMN FC(F)(F)c1cccc([C@H]2CCCCN2CCn2ccnc2)c1 ZINC000346196892 335389230 /nfs/dbraw/zinc/38/92/30/335389230.db2.gz PGZJYKBPXSKVIL-MRXNPFEDSA-N 0 1 323.362 4.129 20 0 DIADMN Cc1[nH+]ccn1CC[N@H+](C)[C@H](c1ccccc1Cl)C(C)C ZINC000346314600 335399236 /nfs/dbraw/zinc/39/92/36/335399236.db2.gz SBZGJQUHKDMILF-KRWDZBQOSA-N 0 1 305.853 4.174 20 0 DIADMN C[C@@H](NCc1ccc(F)cn1)c1ccc(-c2ccncc2)cc1 ZINC000346507778 335413908 /nfs/dbraw/zinc/41/39/08/335413908.db2.gz UXGIOTFPVWSEKS-CQSZACIVSA-N 0 1 307.372 4.134 20 0 DIADMN CC[C@@H](N[C@H](CCOC)c1ccccc1)c1nc(C)cs1 ZINC000347646420 335516830 /nfs/dbraw/zinc/51/68/30/335516830.db2.gz YTLLYKVKFBUEMM-HZPDHXFCSA-N 0 1 304.459 4.270 20 0 DIADMN Cc1ccnc(CN[C@@H](C)[C@@H](C)c2ccccc2C(F)(F)F)n1 ZINC000348282300 335571034 /nfs/dbraw/zinc/57/10/34/335571034.db2.gz PPPXIFOCMYBYPT-OLZOCXBDSA-N 0 1 323.362 4.086 20 0 DIADMN COc1cc([C@H](C)N[C@@H]2CCSc3ccc(F)cc32)ccn1 ZINC000348641907 335601254 /nfs/dbraw/zinc/60/12/54/335601254.db2.gz MKEWVCAHRWPQKJ-XHDPSFHLSA-N 0 1 318.417 4.117 20 0 DIADMN Cc1oc2ccccc2c1CN[C@H]1CCOc2c(F)cccc21 ZINC000191128537 335605587 /nfs/dbraw/zinc/60/55/87/335605587.db2.gz KGVXTSWGOAFEFJ-KRWDZBQOSA-N 0 1 311.356 4.494 20 0 DIADMN C[C@@H](c1nc(-c2ccccc2Cl)no1)N1CCCCCC1 ZINC000191172123 335627801 /nfs/dbraw/zinc/62/78/01/335627801.db2.gz WZKUUYZXZDPKHR-LBPRGKRZSA-N 0 1 305.809 4.327 20 0 DIADMN Cc1nc(C(C)C)sc1[C@H](C)N[C@@H](CO)c1ccsc1 ZINC000349375482 335667448 /nfs/dbraw/zinc/66/74/48/335667448.db2.gz CCYPOAHXXZHCGZ-GWCFXTLKSA-N 0 1 310.488 4.021 20 0 DIADMN Cc1nc(C(C)C)sc1[C@@H](C)N[C@@H](CO)c1ccsc1 ZINC000349375484 335667589 /nfs/dbraw/zinc/66/75/89/335667589.db2.gz CCYPOAHXXZHCGZ-MFKMUULPSA-N 0 1 310.488 4.021 20 0 DIADMN C[C@@H](N[C@H](C)c1ccc(NC(N)=O)cc1)c1csc(Cl)c1 ZINC000191286482 335671080 /nfs/dbraw/zinc/67/10/80/335671080.db2.gz AFNYDJDWWXIOBC-NXEZZACHSA-N 0 1 323.849 4.304 20 0 DIADMN OC[C@@H](N[C@H]1CCCc2c(Cl)cccc21)c1ccc(F)cc1 ZINC000349538030 335678994 /nfs/dbraw/zinc/67/89/94/335678994.db2.gz PXEYUANMWAVUPU-ZWKOTPCHSA-N 0 1 319.807 4.180 20 0 DIADMN CCCCn1cc(CN[C@H](CCC)c2cccnc2)c(C)n1 ZINC000349782385 335697728 /nfs/dbraw/zinc/69/77/28/335697728.db2.gz IWZGFDDBDYAWJD-GOSISDBHSA-N 0 1 300.450 4.018 20 0 DIADMN CCCCn1cc(CN[C@@H](CCC)c2cccnc2)c(C)n1 ZINC000349782386 335697810 /nfs/dbraw/zinc/69/78/10/335697810.db2.gz IWZGFDDBDYAWJD-SFHVURJKSA-N 0 1 300.450 4.018 20 0 DIADMN CCC[C@@H](NCc1ccnc(OC2CCC2)c1)c1cccnc1 ZINC000349803788 335701962 /nfs/dbraw/zinc/70/19/62/335701962.db2.gz SOCQVDBMBSFCDT-GOSISDBHSA-N 0 1 311.429 4.039 20 0 DIADMN Cc1ccc(F)cc1CN[C@H]1CCCOc2ccc(F)cc21 ZINC000350628930 335767513 /nfs/dbraw/zinc/76/75/13/335767513.db2.gz YGNQQOFQMWZYTB-KRWDZBQOSA-N 0 1 303.352 4.277 20 0 DIADMN FC(F)C1CCN(Cc2cnc(-c3ccccc3)s2)CC1 ZINC000536678214 335859729 /nfs/dbraw/zinc/85/97/29/335859729.db2.gz IAKKRQYZPVEBDU-UHFFFAOYSA-N 0 1 308.397 4.287 20 0 DIADMN CC(C)(C)[C@H]1C[C@H](NCc2c(F)cc(F)c(F)c2F)CS1 ZINC000430771926 335896650 /nfs/dbraw/zinc/89/66/50/335896650.db2.gz HSFHRNDWDGGTCM-QPUJVOFHSA-N 0 1 321.383 4.253 20 0 DIADMN Fc1cc(CNC2(c3ccccc3)CC2)ccc1Br ZINC000532165344 335907864 /nfs/dbraw/zinc/90/78/64/335907864.db2.gz AKJPIJRSZFLCID-UHFFFAOYSA-N 0 1 320.205 4.367 20 0 DIADMN CC(C)=CCC[C@@H](C)N[C@H](c1nccn1C)c1ccc(F)cc1 ZINC000532199118 335914930 /nfs/dbraw/zinc/91/49/30/335914930.db2.gz OPPIFPIFKJOOLY-QAPCUYQASA-N 0 1 315.436 4.373 20 0 DIADMN Cc1cc(N2CCC[C@H]2c2ccccn2)c2cc(F)ccc2n1 ZINC000532205581 335915496 /nfs/dbraw/zinc/91/54/96/335915496.db2.gz NSIKBIHRSPIVBP-SFHVURJKSA-N 0 1 307.372 4.419 20 0 DIADMN Cc1ccc([C@]2(C)CCN(Cc3ccc(Cl)cn3)C2)cc1 ZINC000582219063 336013297 /nfs/dbraw/zinc/01/32/97/336013297.db2.gz SZCVUDOKIWURKP-GOSISDBHSA-N 0 1 300.833 4.207 20 0 DIADMN CO[C@@H](c1ccccc1Cl)[C@@H](C)NCc1nc(C)c(C)s1 ZINC000351258033 336024430 /nfs/dbraw/zinc/02/44/30/336024430.db2.gz SROXVRFJPPSNHY-BDJLRTHQSA-N 0 1 324.877 4.279 20 0 DIADMN CC(C)Sc1cccc(Cl)c1CN(C)CC[C@@H](C)O ZINC000351406320 336032946 /nfs/dbraw/zinc/03/29/46/336032946.db2.gz DIQAFGJALPDWIL-GFCCVEGCSA-N 0 1 301.883 4.043 20 0 DIADMN Fc1cccc2[nH]c(CNc3nccn3-c3ccccc3)cc21 ZINC000351567368 336045089 /nfs/dbraw/zinc/04/50/89/336045089.db2.gz JBKNDVXPQCKPPS-UHFFFAOYSA-N 0 1 306.344 4.105 20 0 DIADMN Cc1nc2ccc(CNc3nccn3-c3ccccc3)cc2s1 ZINC000351570742 336045623 /nfs/dbraw/zinc/04/56/23/336045623.db2.gz PBMBGMKHRGVOHJ-UHFFFAOYSA-N 0 1 320.421 4.403 20 0 DIADMN CCc1nc(C(C)C)ccc1C[N@H+]1CC(C)(C)[C@@H]1[C@H]1CCCO1 ZINC000563902045 336050617 /nfs/dbraw/zinc/05/06/17/336050617.db2.gz QKKZRTNIUSMPBF-MOPGFXCFSA-N 0 1 316.489 4.157 20 0 DIADMN CCc1nc(C(C)C)ccc1CN1CC(C)(C)[C@@H]1[C@H]1CCCO1 ZINC000563902045 336050618 /nfs/dbraw/zinc/05/06/18/336050618.db2.gz QKKZRTNIUSMPBF-MOPGFXCFSA-N 0 1 316.489 4.157 20 0 DIADMN CCN(Cc1cnc(C)nc1)[C@H](C)c1cccc(C(F)(F)F)c1 ZINC000351621365 336051699 /nfs/dbraw/zinc/05/16/99/336051699.db2.gz CAVMBNQLXOJVIK-GFCCVEGCSA-N 0 1 323.362 4.387 20 0 DIADMN C[C@H]1CC[C@@H](N(CCO)Cc2csc(C3CCCCC3)n2)C1 ZINC000351627383 336053087 /nfs/dbraw/zinc/05/30/87/336053087.db2.gz 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COc1ccccc1[C@H]1CC[C@@H](C)CN1Cc1cnc(C)s1 ZINC000352245909 336206516 /nfs/dbraw/zinc/20/65/16/336206516.db2.gz KRWAOWUCBXZERF-CXAGYDPISA-N 0 1 316.470 4.433 20 0 DIADMN CCc1ccc(CN[C@@H](C)c2ccccc2OC(F)F)cn1 ZINC000352250925 336206935 /nfs/dbraw/zinc/20/69/35/336206935.db2.gz MNXFORRTCUMFPV-LBPRGKRZSA-N 0 1 306.356 4.096 20 0 DIADMN C[C@@H](C(=O)Nc1cccc2ccccc21)N1CCCC2(CC2)C1 ZINC000352266502 336208533 /nfs/dbraw/zinc/20/85/33/336208533.db2.gz NUOOXDUDCNNQRR-HNNXBMFYSA-N 0 1 308.425 4.043 20 0 DIADMN C[C@H](NCc1cccc2cc[nH]c21)c1nccn1-c1ccccc1 ZINC000352325715 336212490 /nfs/dbraw/zinc/21/24/90/336212490.db2.gz VXSVGXRYRXAVEG-HNNXBMFYSA-N 0 1 316.408 4.204 20 0 DIADMN CCc1ccc(CN2CCC(Oc3ccc(F)cc3F)CC2)o1 ZINC000352345495 336213352 /nfs/dbraw/zinc/21/33/52/336213352.db2.gz MFEGMHFXJVCFCM-UHFFFAOYSA-N 0 1 321.367 4.164 20 0 DIADMN Cc1cnccc1OC1CCN(Cc2cccc(Cl)c2)CC1 ZINC000352348647 336213552 /nfs/dbraw/zinc/21/35/52/336213552.db2.gz CEGRMMQXKFKUKU-UHFFFAOYSA-N 0 1 316.832 4.087 20 0 DIADMN 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317.336 4.167 20 0 DIADMN C[C@@H](CSc1nc(C=Cc2ccccc2)n[nH]1)C(F)(F)F ZINC000439049668 338359605 /nfs/dbraw/zinc/35/96/05/338359605.db2.gz WSBPOSUVNRIEJA-JARNTUPDSA-N 0 1 313.348 4.266 20 0 DIADMN O=C(CC1CCC1)Nc1ccc2nc(-c3cccc(F)c3)[nH]c2c1 ZINC000439054387 338359714 /nfs/dbraw/zinc/35/97/14/338359714.db2.gz YPAFIPDPPJLLIR-UHFFFAOYSA-N 0 1 323.371 4.498 20 0 DIADMN Clc1ccc(Cl)c(CN2CCC([C@H]3CCCO3)CC2)c1 ZINC000439288083 338366128 /nfs/dbraw/zinc/36/61/28/338366128.db2.gz YUPBDBLOBMCDHZ-MRXNPFEDSA-N 0 1 314.256 4.384 20 0 DIADMN CSc1ccc(OCCN2CCC[C@@H](C(F)(F)F)C2)cc1 ZINC000439318574 338367005 /nfs/dbraw/zinc/36/70/05/338367005.db2.gz PGTFIPWVWKXNOI-GFCCVEGCSA-N 0 1 319.392 4.062 20 0 DIADMN Cc1ccccc1NC(=O)CN1CC[C@@H](c2ccccc2)C[C@H]1C ZINC000439327774 338367267 /nfs/dbraw/zinc/36/72/67/338367267.db2.gz VLKSGKXSEITBCC-IEBWSBKVSA-N 0 1 322.452 4.202 20 0 DIADMN CCN(C(=O)c1ccc(O)c(Cl)c1)[C@H](C)c1ccc(F)cc1 ZINC000439345071 338367781 /nfs/dbraw/zinc/36/77/81/338367781.db2.gz RWFKFWLIYIIDDL-LLVKDONJSA-N 0 1 321.779 4.408 20 0 DIADMN CC[C@@H](C)NC(=O)CCN[C@@H](C)c1cc(Cl)sc1Cl ZINC000156532010 338367837 /nfs/dbraw/zinc/36/78/37/338367837.db2.gz OXQCDJSCVPHOFH-BDAKNGLRSA-N 0 1 323.289 4.010 20 0 DIADMN CC[C@H](C)c1ccccc1NC(=O)[C@H](C)N(C)CCCSC ZINC000439470791 338370532 /nfs/dbraw/zinc/37/05/32/338370532.db2.gz PKBYKQALIUVDCR-GJZGRUSLSA-N 0 1 322.518 4.212 20 0 DIADMN CC[C@H]1CN(Cc2nc3ccccc3c(C)c2Cl)CCCO1 ZINC000439472481 338370720 /nfs/dbraw/zinc/37/07/20/338370720.db2.gz JGBPUIRQFYSCHV-AWEZNQCLSA-N 0 1 318.848 4.198 20 0 DIADMN CSc1ccc([C@@H](C)NCC(=O)Nc2cccc(C)c2)cc1 ZINC000439473933 338370729 /nfs/dbraw/zinc/37/07/29/338370729.db2.gz VZCUFASDZYGIHX-CQSZACIVSA-N 0 1 314.454 4.006 20 0 DIADMN Cc1ccc(CNCc2cccc(F)c2Br)s1 ZINC000156739239 338382395 /nfs/dbraw/zinc/38/23/95/338382395.db2.gz UDPXZLWMQMPAOI-UHFFFAOYSA-N 0 1 314.223 4.248 20 0 DIADMN CC[C@H]1CCCN1Cc1csc(CCc2ccccc2)n1 ZINC000440310637 338385327 /nfs/dbraw/zinc/38/53/27/338385327.db2.gz 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/nfs/dbraw/zinc/39/73/17/338397317.db2.gz PGHFNEGIDFTLQX-HIFRSBDPSA-N 0 1 309.425 4.415 20 0 DIADMN CC[C@H](F)CN[C@@H](C)c1cccc(NC(=O)c2ccccc2)c1 ZINC000440785028 338397390 /nfs/dbraw/zinc/39/73/90/338397390.db2.gz WCHQDHXJSQAIOE-YOEHRIQHSA-N 0 1 314.404 4.338 20 0 DIADMN CC[C@@H](F)CN[C@H](C)c1cccc(NC(=O)c2ccccc2)c1 ZINC000440785025 338397402 /nfs/dbraw/zinc/39/74/02/338397402.db2.gz WCHQDHXJSQAIOE-RHSMWYFYSA-N 0 1 314.404 4.338 20 0 DIADMN Cc1cc2c[nH]nc2c(C(=O)N2CC[C@@H](C)C[C@@H]2c2ccco2)c1 ZINC000440836187 338398467 /nfs/dbraw/zinc/39/84/67/338398467.db2.gz TWBMYMHTABWJTI-MLGOLLRUSA-N 0 1 323.396 4.078 20 0 DIADMN CC(C)OC(=O)CCN(Cc1cccs1)Cc1cccs1 ZINC000441255634 338406756 /nfs/dbraw/zinc/40/67/56/338406756.db2.gz FIZABKAUSCYXEM-UHFFFAOYSA-N 0 1 323.483 4.154 20 0 DIADMN CSc1cccc(NC(=O)[C@H](C)N2CCC(C(C)C)CC2)c1 ZINC000441467393 338414635 /nfs/dbraw/zinc/41/46/35/338414635.db2.gz PEVLTJFIWQFVTA-AWEZNQCLSA-N 0 1 320.502 4.104 20 0 DIADMN CC[C@@H](NCc1cn2cc(Cl)ccc2n1)c1cccc(F)c1 ZINC000446756652 338535121 /nfs/dbraw/zinc/53/51/21/338535121.db2.gz LCQOMKHNULRCTJ-MRXNPFEDSA-N 0 1 317.795 4.368 20 0 DIADMN Fc1ccc([C@H](N[C@@H]2CC[C@@H]3CCC[C@@H]3C2)c2ncc[nH]2)cc1 ZINC000446841788 338537894 /nfs/dbraw/zinc/53/78/94/338537894.db2.gz SJTKXSJMAZINQI-NZPGVSJUSA-N 0 1 313.420 4.197 20 0 DIADMN CCC[C@@H](N[C@@H](C)c1cc(C(=O)OC)co1)c1ccccc1 ZINC000447509433 338553131 /nfs/dbraw/zinc/55/31/31/338553131.db2.gz MQXWZTXZKBHCFS-XJKSGUPXSA-N 0 1 301.386 4.258 20 0 DIADMN CCOc1ccc([C@@H](C)N[C@@H]2CCCc3occc32)cc1OC ZINC000447554021 338556486 /nfs/dbraw/zinc/55/64/86/338556486.db2.gz YOPNGAKTRAYQPY-CZUORRHYSA-N 0 1 315.413 4.415 20 0 DIADMN C[C@@H](CC(C)(C)C)N[C@H](c1nccn1C)c1cccc(F)c1 ZINC000449056311 338588819 /nfs/dbraw/zinc/58/88/19/338588819.db2.gz OLVFXKKJLAGLHD-BBRMVZONSA-N 0 1 303.425 4.063 20 0 DIADMN C[C@H](NCc1ccnn1C1CCCC1)c1ccc(F)c(F)c1 ZINC000449063508 338589758 /nfs/dbraw/zinc/58/97/58/338589758.db2.gz PSZDSEGQLNZIMF-LBPRGKRZSA-N 0 1 305.372 4.127 20 0 DIADMN CCOc1cccc(CN[C@H]2CCc3cc(F)c(F)c(F)c32)c1 ZINC000449082259 338591732 /nfs/dbraw/zinc/59/17/32/338591732.db2.gz LXZPEIPPCUXXTL-HNNXBMFYSA-N 0 1 321.342 4.280 20 0 DIADMN Clc1cccc2c1CC[C@@H]2NCc1ccnn1C1CCCC1 ZINC000449098523 338593221 /nfs/dbraw/zinc/59/32/21/338593221.db2.gz PWVTWZDICWNILF-SFHVURJKSA-N 0 1 315.848 4.429 20 0 DIADMN CC(C)COc1cccc(CNCc2cc3cccnc3o2)c1 ZINC000449100991 338593589 /nfs/dbraw/zinc/59/35/89/338593589.db2.gz YFDJIYYISLKGKU-UHFFFAOYSA-N 0 1 310.397 4.152 20 0 DIADMN COc1cccc2c(CN[C@H](C)c3nc(C)cs3)cccc12 ZINC000449114747 338594711 /nfs/dbraw/zinc/59/47/11/338594711.db2.gz DYKUQMYPFPXWDS-CYBMUJFWSA-N 0 1 312.438 4.464 20 0 DIADMN COc1cc(F)cc(CNCc2ccccc2OC2CCC2)c1 ZINC000449137714 338596328 /nfs/dbraw/zinc/59/63/28/338596328.db2.gz ABPJGKQTZVRMBW-UHFFFAOYSA-N 0 1 315.388 4.055 20 0 DIADMN CC[C@H](NCc1cc2ccccc2cc1OC)c1ccncc1 ZINC000449162678 338598239 /nfs/dbraw/zinc/59/82/39/338598239.db2.gz KBESTYKCSOZDQY-IBGZPJMESA-N 0 1 306.409 4.484 20 0 DIADMN COc1cc2ccccc2cc1CNCc1sc(C)nc1C ZINC000449178446 338599733 /nfs/dbraw/zinc/59/97/33/338599733.db2.gz UWJGAQMIHORXEZ-UHFFFAOYSA-N 0 1 312.438 4.212 20 0 DIADMN CCCOc1cc(C)ccc1CNCc1cc2cccnc2o1 ZINC000449194183 338601285 /nfs/dbraw/zinc/60/12/85/338601285.db2.gz OUWAYAGCQQUMHU-UHFFFAOYSA-N 0 1 310.397 4.215 20 0 DIADMN COc1cc(C)cc(CN[C@H]2CCc3cc(F)c(F)c(F)c32)c1 ZINC000449200930 338601990 /nfs/dbraw/zinc/60/19/90/338601990.db2.gz HVXCCJYFWWBSFL-HNNXBMFYSA-N 0 1 321.342 4.198 20 0 DIADMN COc1cc(C)cc(CN[C@@H]2CCc3cc(F)c(F)c(F)c32)c1 ZINC000449200931 338601996 /nfs/dbraw/zinc/60/19/96/338601996.db2.gz HVXCCJYFWWBSFL-OAHLLOKOSA-N 0 1 321.342 4.198 20 0 DIADMN COc1cccc2c(CN[C@H](C)c3ccncc3OC)cccc12 ZINC000449268013 338608241 /nfs/dbraw/zinc/60/82/41/338608241.db2.gz CVUUNIFAHOQSSB-CQSZACIVSA-N 0 1 322.408 4.103 20 0 DIADMN COc1cc(C)ccc1CN1CCC(CC(F)(F)F)CC1 ZINC000449310653 338611641 /nfs/dbraw/zinc/61/16/41/338611641.db2.gz HRKDOZUQIDGWMB-UHFFFAOYSA-N 0 1 301.352 4.168 20 0 DIADMN C[C@@H](NCc1cc(C(F)(F)F)n[nH]1)c1cccc(C2CC2)c1 ZINC000449348181 338615954 /nfs/dbraw/zinc/61/59/54/338615954.db2.gz FWFFXBWVOYBWEJ-SNVBAGLBSA-N 0 1 309.335 4.157 20 0 DIADMN Cc1ccnc([C@H](C)N[C@H]2CCCc3c(F)cc(F)cc32)c1 ZINC000449352960 338616994 /nfs/dbraw/zinc/61/69/94/338616994.db2.gz XIWUAHGRNSKSAK-SJCJKPOMSA-N 0 1 302.368 4.396 20 0 DIADMN COc1ccc(OC)c(CN[C@H](C)c2ccc(F)c(C)c2)c1 ZINC000449374040 338619064 /nfs/dbraw/zinc/61/90/64/338619064.db2.gz WBIVPKLAACZWMW-CYBMUJFWSA-N 0 1 303.377 4.002 20 0 DIADMN CC(C)(C)c1cnc(CNC[C@@H]2CCCCC2(F)F)s1 ZINC000449381448 338619663 /nfs/dbraw/zinc/61/96/63/338619663.db2.gz YVUWROIPZOMZFR-NSHDSACASA-N 0 1 302.434 4.356 20 0 DIADMN Cc1cc(CNCc2cccc(C(F)(F)F)n2)ccc1Cl ZINC000449399449 338620726 /nfs/dbraw/zinc/62/07/26/338620726.db2.gz AUGZIODXKWLGGE-UHFFFAOYSA-N 0 1 314.738 4.352 20 0 DIADMN FCC1(NCc2cccc(Oc3ccccc3)c2)CCOCC1 ZINC000449446471 338624836 /nfs/dbraw/zinc/62/48/36/338624836.db2.gz RJVQESGVYVTAIH-UHFFFAOYSA-N 0 1 315.388 4.087 20 0 DIADMN CCCn1nc(C)c(CN2CC(c3ccc(Cl)cc3)C2)c1C ZINC000449558023 338637408 /nfs/dbraw/zinc/63/74/08/338637408.db2.gz UULORWNCOISYQB-UHFFFAOYSA-N 0 1 317.864 4.163 20 0 DIADMN CCn1ccnc1[C@H](C)NC/C(C)=C/c1ccc(Cl)cc1 ZINC000449560925 338637673 /nfs/dbraw/zinc/63/76/73/338637673.db2.gz AALGWASADIGLDX-CMPYXILNSA-N 0 1 303.837 4.311 20 0 DIADMN CN1CCC[C@@H](NCc2sccc2Cl)c2ccccc21 ZINC000449650891 338644283 /nfs/dbraw/zinc/64/42/83/338644283.db2.gz MGSHHRKCYJXLOB-CQSZACIVSA-N 0 1 306.862 4.462 20 0 DIADMN Clc1ccc([C@H]2CCC[C@H](NCc3csnn3)C2)cc1 ZINC000449732080 338648406 /nfs/dbraw/zinc/64/84/06/338648406.db2.gz KVUDPVKXDMRIOF-JSGCOSHPSA-N 0 1 307.850 4.008 20 0 DIADMN C[C@H](NC[C@@H]1CCC(F)(F)C1)c1nc(C2CCCCC2)no1 ZINC000450734887 338702336 /nfs/dbraw/zinc/70/23/36/338702336.db2.gz DPNCYYSSFORXKF-NWDGAFQWSA-N 0 1 313.392 4.203 20 0 DIADMN Cc1cc(=O)[nH]c([C@H](C)N[C@@H](c2ccc(Cl)cc2)C(C)C)n1 ZINC000451796607 338744367 /nfs/dbraw/zinc/74/43/67/338744367.db2.gz HIORDQIYXXLLMD-BLLLJJGKSA-N 0 1 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1 309.457 4.452 20 0 DIADMN C[C@@H](NCc1cc2cc(Br)ccc2[nH]1)c1ccco1 ZINC000184676860 340495127 /nfs/dbraw/zinc/49/51/27/340495127.db2.gz FBYYVABPSKMXSJ-SNVBAGLBSA-N 0 1 319.202 4.374 20 0 DIADMN Fc1cc(CNCc2ccc(C(F)F)cc2)cc(F)c1F ZINC000185181404 340498580 /nfs/dbraw/zinc/49/85/80/340498580.db2.gz QMGXPVCCSUSCLT-UHFFFAOYSA-N 0 1 301.258 4.331 20 0 DIADMN CCSc1cccc(CN[C@H](COC)c2ccccc2)c1 ZINC000185534755 340502475 /nfs/dbraw/zinc/50/24/75/340502475.db2.gz OOXIRONTHRLONJ-GOSISDBHSA-N 0 1 301.455 4.276 20 0 DIADMN CO[C@@H](CN[C@@H](C)c1csc(C(C)C)n1)c1ccc(F)cc1 ZINC000186415789 340512393 /nfs/dbraw/zinc/51/23/93/340512393.db2.gz NMFPZMFHPMSSQP-LRDDRELGSA-N 0 1 322.449 4.444 20 0 DIADMN COc1ccc2nc(CN[C@H](C)c3cccs3)sc2c1 ZINC000187493793 340520595 /nfs/dbraw/zinc/52/05/95/340520595.db2.gz OXIDJLGJBXIBMG-SNVBAGLBSA-N 0 1 304.440 4.217 20 0 DIADMN C[C@@H](O)CCN[C@@H](c1ccccc1)c1cc(Cl)ccc1Cl ZINC000521687191 340528945 /nfs/dbraw/zinc/52/89/45/340528945.db2.gz MYAOKRLIDFUNCK-PXAZEXFGSA-N 0 1 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RWZBEYNQWLINEQ-YVEFUNNKSA-N 0 1 301.821 4.322 20 0 DIADMN C[C@@H](NCc1ccnc(N2CCCC2)c1)c1cc2ccccc2o1 ZINC000131520484 525546023 /nfs/dbraw/zinc/54/60/23/525546023.db2.gz HHWSENWLAFAXSS-OAHLLOKOSA-N 0 1 321.424 4.279 20 0 DIADMN C[C@H](N[C@@H]1CCCOc2cc(Cl)ccc21)c1ccccn1 ZINC000182170079 525556162 /nfs/dbraw/zinc/55/61/62/525556162.db2.gz LWIOVYPUTABLEN-BLLLJJGKSA-N 0 1 302.805 4.300 20 0 DIADMN COc1ccc2c(c1)[C@H](NCc1ccc(Cl)nc1)CCS2 ZINC000191498197 525588891 /nfs/dbraw/zinc/58/88/91/525588891.db2.gz BUOMLDWJHJFXJP-CQSZACIVSA-N 0 1 320.845 4.070 20 0 DIADMN C[C@H](N[C@H](Cc1ccccc1)c1ccccc1F)c1cnn(C)c1 ZINC000159314648 525597966 /nfs/dbraw/zinc/59/79/66/525597966.db2.gz WAPJUFFXNMAWJT-MGPUTAFESA-N 0 1 323.415 4.194 20 0 DIADMN Cc1cc2c(cc1C)[C@@H](N[C@@H](CCO)c1ccco1)CCS2 ZINC000187562078 525601369 /nfs/dbraw/zinc/60/13/69/525601369.db2.gz XZQCBBZZOTYXCD-HOTGVXAUSA-N 0 1 317.454 4.147 20 0 DIADMN C[C@@H](N[C@@H](Cc1ccccc1)c1ccccc1F)c1cnn(C)c1 ZINC000159314495 525629996 /nfs/dbraw/zinc/62/99/96/525629996.db2.gz WAPJUFFXNMAWJT-QRWLVFNGSA-N 0 1 323.415 4.194 20 0 DIADMN C[C@@H](N[C@@H](c1ccc(Cl)cc1)C1CCC1)c1cnccn1 ZINC000132229208 525630076 /nfs/dbraw/zinc/63/00/76/525630076.db2.gz RWZBEYNQWLINEQ-SJKOYZFVSA-N 0 1 301.821 4.322 20 0 DIADMN C[C@H](N[C@H]1CCc2c1cccc2O)c1cnc2ccsc2c1 ZINC000130575444 525630702 /nfs/dbraw/zinc/63/07/02/525630702.db2.gz WPRVNDCGZQNADU-NHYWBVRUSA-N 0 1 310.422 4.340 20 0 DIADMN Cc1ccnc(C2CCN([C@@H](C)c3ccc(F)cc3F)CC2)n1 ZINC000363799105 525639631 /nfs/dbraw/zinc/63/96/31/525639631.db2.gz PSXBHOPFKDUREJ-ZDUSSCGKSA-N 0 1 317.383 4.004 20 0 DIADMN C[C@@H](N[C@@H]1CCc2c1cccc2O)c1cnc2ccsc2c1 ZINC000130575221 525650629 /nfs/dbraw/zinc/65/06/29/525650629.db2.gz WPRVNDCGZQNADU-IAQYHMDHSA-N 0 1 310.422 4.340 20 0 DIADMN C[C@@H](N[C@H](CCO)c1ccco1)c1cc2ccccc2s1 ZINC000188479807 525667540 /nfs/dbraw/zinc/66/75/40/525667540.db2.gz CHLZREXPIWOGJK-TZMCWYRMSA-N 0 1 301.411 4.269 20 0 DIADMN C[C@@H](N[C@H]1CCCOc2cc(F)ccc21)c1ccc(Cl)nc1 ZINC000179965898 525677516 /nfs/dbraw/zinc/67/75/16/525677516.db2.gz HOYMQOSHESTAIU-ABAIWWIYSA-N 0 1 320.795 4.439 20 0 DIADMN C[C@@H](N[C@H]1CCCOc2cc(Cl)ccc21)c1cncc(F)c1 ZINC000182166960 525677722 /nfs/dbraw/zinc/67/77/22/525677722.db2.gz WBCGYPRDKHDNED-BZNIZROVSA-N 0 1 320.795 4.439 20 0 DIADMN Cc1ccc([C@@H](C)N[C@@H](C)c2ccc(NC(=O)C3CC3)cc2)o1 ZINC000121908548 525741660 /nfs/dbraw/zinc/74/16/60/525741660.db2.gz VDAFJENVVSOOMI-UONOGXRCSA-N 0 1 312.413 4.348 20 0 DIADMN CSCc1cnc(CNC2CC(c3ccccc3F)C2)s1 ZINC000339386127 525748317 /nfs/dbraw/zinc/74/83/17/525748317.db2.gz WBCCJTJYGJSKMT-UHFFFAOYSA-N 0 1 322.474 4.181 20 0 DIADMN CSCc1cnc(CNCCCSc2ccccc2)s1 ZINC000339163149 525749308 /nfs/dbraw/zinc/74/93/08/525749308.db2.gz BVOYBHLOWOTNGV-UHFFFAOYSA-N 0 1 324.540 4.278 20 0 DIADMN Cc1ccc(-c2ccc(C[N@H+](CCC(=O)[O-])C(C)C)s2)cc1 ZINC000236777908 525749543 /nfs/dbraw/zinc/74/95/43/525749543.db2.gz WZNPCWYKWIURNW-UHFFFAOYSA-N 0 1 317.454 4.409 20 0 DIADMN Cc1ccc(-c2ccc(CN[C@H]3CCCc4c3cnn4C)o2)cc1 ZINC000237729806 525752474 /nfs/dbraw/zinc/75/24/74/525752474.db2.gz YRRDIJOWPWNWKE-SFHVURJKSA-N 0 1 321.424 4.156 20 0 DIADMN Cc1c([C@H](C)NCc2cccc(Cl)c2)cnn1C(C)(C)C ZINC000191104003 525919869 /nfs/dbraw/zinc/91/98/69/525919869.db2.gz RYGZJJDHMNICKX-LBPRGKRZSA-N 0 1 305.853 4.451 20 0 DIADMN Cc1c([C@H](C)NCc2ccc(OC(C)C)c(Cl)c2)cnn1C ZINC000188390197 525920329 /nfs/dbraw/zinc/92/03/29/525920329.db2.gz ZCSHPGUQQWDMBW-LBPRGKRZSA-N 0 1 321.852 4.020 20 0 DIADMN Cc1c([C@H](C)N[C@H]2C[C@@H](C)Sc3sccc32)cnn1C ZINC000336826256 525926821 /nfs/dbraw/zinc/92/68/21/525926821.db2.gz KWDYTGCNBQMPQJ-BFVZDQMLSA-N 0 1 307.488 4.066 20 0 DIADMN C[C@@H](c1ccccn1)N(C)Cc1cccc(OCC(F)(F)F)c1 ZINC000127964114 526111700 /nfs/dbraw/zinc/11/17/00/526111700.db2.gz DMLPCJDPAYATKS-ZDUSSCGKSA-N 0 1 324.346 4.216 20 0 DIADMN Cc1ccc2cc([C@@H](C)N[C@@H]3CCCc4nn(C)cc43)oc2c1 ZINC000338024723 526232158 /nfs/dbraw/zinc/23/21/58/526232158.db2.gz WAMADTMWYNCJBV-CZUORRHYSA-N 0 1 309.413 4.203 20 0 DIADMN O=C([O-])c1ccc(C[N@H+]2CCC[C@H]2CCC2CCCC2)cc1 ZINC000263559697 526365336 /nfs/dbraw/zinc/36/53/36/526365336.db2.gz BEALHXNSVJQMTM-SFHVURJKSA-N 0 1 301.430 4.320 20 0 DIADMN Cc1nnc([C@@H](C)N2C[C@H](c3ccccc3)C(C)(C)C2)s1 ZINC000338272219 526395441 /nfs/dbraw/zinc/39/54/41/526395441.db2.gz SDWYAWUUMVHPBH-IUODEOHRSA-N 0 1 301.459 4.033 20 0 DIADMN Cc1nnc([C@@H](C)Sc2nc3ccc(Cl)cc3[nH]2)s1 ZINC000181704274 526399057 /nfs/dbraw/zinc/39/90/57/526399057.db2.gz NUJDEBKJGAGDOP-ZCFIWIBFSA-N 0 1 310.835 4.230 20 0 DIADMN Fc1cccc2c1OCC[C@@H]2N[C@@H]1CCSc2ccccc21 ZINC000188049153 526402814 /nfs/dbraw/zinc/40/28/14/526402814.db2.gz ZWXBPUXVJAULNS-JKSUJKDBSA-N 0 1 315.413 4.476 20 0 DIADMN Cc1nnc([C@H](C)Sc2nc3ccc(Cl)cc3[nH]2)s1 ZINC000181704293 526407095 /nfs/dbraw/zinc/40/70/95/526407095.db2.gz NUJDEBKJGAGDOP-LURJTMIESA-N 0 1 310.835 4.230 20 0 DIADMN O=C(CCCC1CCCCC1)Nc1ccccc1-c1nnc[nH]1 ZINC000364815951 526420005 /nfs/dbraw/zinc/42/00/05/526420005.db2.gz UHJNYIAIQYJFDE-UHFFFAOYSA-N 0 1 312.417 4.161 20 0 DIADMN Cc1nc(C)c([C@@H](C)N[C@@H]2CCCOc3c(F)cccc32)s1 ZINC000181321581 526745994 /nfs/dbraw/zinc/74/59/94/526745994.db2.gz PPRNJKFEMMAFJF-IAQYHMDHSA-N 0 1 320.433 4.464 20 0 DIADMN Cc1nc(C)c([C@@H](C)N[C@H]2CCOc3c(F)cccc32)s1 ZINC000188053920 526748042 /nfs/dbraw/zinc/74/80/42/526748042.db2.gz NEUVGIXFVJKGMR-YGRLFVJLSA-N 0 1 306.406 4.073 20 0 DIADMN Cc1occc1CN[C@H]1CCc2c1cccc2Br ZINC000359312335 526828788 /nfs/dbraw/zinc/82/87/88/526828788.db2.gz LVEKGYVPKOBFBT-HNNXBMFYSA-N 0 1 306.203 4.128 20 0 DIADMN Cc1oncc1CN1CCC(F)(c2ccc(Cl)cc2)CC1 ZINC000337225899 526859029 /nfs/dbraw/zinc/85/90/29/526859029.db2.gz QKBYCAVXYHRMAM-UHFFFAOYSA-N 0 1 308.784 4.097 20 0 DIADMN Cc1sc(NC(=O)CN[C@@H](C)c2cccs2)c(C)c1C ZINC000182549073 526881001 /nfs/dbraw/zinc/88/10/01/526881001.db2.gz KHQLHQTVRBUDFZ-NSHDSACASA-N 0 1 308.472 4.024 20 0 DIADMN Cc1sccc1CNCc1ccncc1OCc1ccccc1 ZINC000339391675 526915078 /nfs/dbraw/zinc/91/50/78/526915078.db2.gz NJAMVAYTFMCYPH-UHFFFAOYSA-N 0 1 324.449 4.320 20 0 DIADMN Cc1sccc1CN[C@H](c1ccc(F)cc1)[C@@H]1CCCO1 ZINC000339217456 526920304 /nfs/dbraw/zinc/92/03/04/526920304.db2.gz XOLAHIFWRAUHIS-DLBZAZTESA-N 0 1 305.418 4.206 20 0 DIADMN Clc1ccc(CN(Cc2cccnc2)C2CC2)c2ncccc12 ZINC000124766425 526943336 /nfs/dbraw/zinc/94/33/36/526943336.db2.gz JBAVREOUIQZXST-UHFFFAOYSA-N 0 1 323.827 4.448 20 0 DIADMN Clc1ccc(CN[C@H](Cc2ccccn2)c2cccnc2)cc1 ZINC000338201095 526948862 /nfs/dbraw/zinc/94/88/62/526948862.db2.gz QBGDTDUNPPQTNX-LJQANCHMSA-N 0 1 323.827 4.204 20 0 DIADMN Clc1ccc2ncc(CNCc3coc4ccccc34)n2c1 ZINC000339408309 526971334 /nfs/dbraw/zinc/97/13/34/526971334.db2.gz YBAAXUGKVFNOSH-UHFFFAOYSA-N 0 1 311.772 4.024 20 0 DIADMN Cc1nc([C@H](C)N(C)CC(C)(C)O)oc1-c1ccc(Cl)cc1 ZINC000127944808 527057306 /nfs/dbraw/zinc/05/73/06/527057306.db2.gz TUCIIRLLJSRFKG-LBPRGKRZSA-N 0 1 322.836 4.067 20 0 DIADMN Cc1ncc(C(=O)N2CCCCC[C@H]2c2ccc(Cl)cc2)[nH]1 ZINC000339226013 527228290 /nfs/dbraw/zinc/22/82/90/527228290.db2.gz DNTFJJFRCQQSKN-INIZCTEOSA-N 0 1 317.820 4.129 20 0 DIADMN Cc1nccn1-c1ccc([C@H](C)N[C@H](C)c2ccncc2F)cc1 ZINC000338008275 527382662 /nfs/dbraw/zinc/38/26/62/527382662.db2.gz PMZSYUVAACDXAL-UONOGXRCSA-N 0 1 324.403 4.127 20 0 DIADMN Cc1nccnc1[C@H](C)NC1(c2ccc(Cl)cc2)CCC1 ZINC000188341252 527456253 /nfs/dbraw/zinc/45/62/53/527456253.db2.gz KTVZYHVLMUYYJB-ZDUSSCGKSA-N 0 1 301.821 4.168 20 0 DIADMN O=C([O-])CCCC[N@H+]1CCC[C@H]1c1ccc(Cl)c(Cl)c1 ZINC000181545171 527582236 /nfs/dbraw/zinc/58/22/36/527582236.db2.gz HBQXVIMMBJWSPB-AWEZNQCLSA-N 0 1 316.228 4.385 20 0 DIADMN Cc1nn(C(C)(C)C)cc1[C@@H](C)N[C@@H](C)c1cnn(C(C)C)c1 ZINC000164134582 527584096 /nfs/dbraw/zinc/58/40/96/527584096.db2.gz YMHNKYYIIPBMOA-UONOGXRCSA-N 0 1 317.481 4.136 20 0 DIADMN Cc1nn(C(C)(C)C)cc1[C@@H](C)N[C@H]1CCc2c1cccc2F ZINC000163583183 527585187 /nfs/dbraw/zinc/58/51/87/527585187.db2.gz JODBLLJIHJEKRP-XIKOKIGWSA-N 0 1 315.436 4.424 20 0 DIADMN Cc1nn(C(C)(C)C)cc1[C@@H](C)N[C@@H]1CCc2c1cccc2F ZINC000163582939 527585601 /nfs/dbraw/zinc/58/56/01/527585601.db2.gz JODBLLJIHJEKRP-KZULUSFZSA-N 0 1 315.436 4.424 20 0 DIADMN OCc1ccc(CN[C@@H](c2ccc(Cl)cc2)C2CCCC2)o1 ZINC000174358686 527633787 /nfs/dbraw/zinc/63/37/87/527633787.db2.gz MPGHPBPWGNQYJC-GOSISDBHSA-N 0 1 319.832 4.446 20 0 DIADMN FC(F)(F)c1cnc(CNC[C@H]2C[C@@H]2c2ccccc2)s1 ZINC000339513004 527688819 /nfs/dbraw/zinc/68/88/19/527688819.db2.gz OSNCEQKSUCJTLM-VXGBXAGGSA-N 0 1 312.360 4.055 20 0 DIADMN CCCC[C@@H](N[C@@H](C)c1nccn1CC)c1ccc(OC)cc1 ZINC000297666240 534937499 /nfs/dbraw/zinc/93/74/99/534937499.db2.gz KTRLETPUTLJTEP-MAUKXSAKSA-N 0 1 315.461 4.494 20 0 DIADMN CCCCCc1ccc(N[C@H](c2nnc[nH]2)c2cccnc2)cc1 ZINC000285208644 535142109 /nfs/dbraw/zinc/14/21/09/535142109.db2.gz OLHXFTVOJACEOY-SFHVURJKSA-N 0 1 321.428 4.134 20 0 DIADMN CCCNc1ccc(CN[C@@H](C)c2cccnc2Cl)cc1 ZINC000278847971 535202069 /nfs/dbraw/zinc/20/20/69/535202069.db2.gz VJBSEJJASSUHBY-ZDUSSCGKSA-N 0 1 303.837 4.408 20 0 DIADMN CC(C)[C@@H](N[C@@H]1CCn2ccnc21)c1cccc(C(F)(F)F)c1 ZINC000297815263 535225668 /nfs/dbraw/zinc/22/56/68/535225668.db2.gz RBRRJAPZHAWEEB-HUUCEWRRSA-N 0 1 323.362 4.334 20 0 DIADMN CCCCOc1ccc([C@H](C)N[C@H]2CCCc3c[nH]nc32)cc1 ZINC000284259231 535326972 /nfs/dbraw/zinc/32/69/72/535326972.db2.gz IWMVPYWXEWEFIU-KSSFIOAISA-N 0 1 313.445 4.317 20 0 DIADMN CCOc1ccc([C@@H](C)N[C@H](C)c2ccncc2F)cc1OC ZINC000340205339 535412990 /nfs/dbraw/zinc/41/29/90/535412990.db2.gz PIKQEPZJHBMZPP-CHWSQXEVSA-N 0 1 318.392 4.040 20 0 DIADMN CCOc1ccc([C@H](C)N[C@H](C)c2ccncc2F)cc1OC ZINC000340205350 535421249 /nfs/dbraw/zinc/42/12/49/535421249.db2.gz PIKQEPZJHBMZPP-QWHCGFSZSA-N 0 1 318.392 4.040 20 0 DIADMN CCCc1cccc(C(C)C)c1NS(=O)(=O)c1ccoc1 ZINC000285194193 535431266 /nfs/dbraw/zinc/43/12/66/535431266.db2.gz VSPDAUDFSNQTQU-UHFFFAOYSA-N 0 1 307.415 4.156 20 0 DIADMN CCOc1ccc(CN[C@H](c2ncc[nH]2)C2CCCCC2)cc1 ZINC000285964721 535727143 /nfs/dbraw/zinc/72/71/43/535727143.db2.gz 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/nfs/dbraw/zinc/94/03/38/1045940338.db2.gz GXSMGIMOROLURN-JTQLQIEISA-N 0 1 323.387 4.255 20 0 DIADMN F[C@@H]1CCN(Cc2c[nH]c3ccc(Cl)cc23)CCC1(F)F ZINC001137708592 1045940616 /nfs/dbraw/zinc/94/06/16/1045940616.db2.gz ZJWLESUNJIGZTJ-CQSZACIVSA-N 0 1 316.754 4.391 20 0 DIADMN CCNc1ccccc1CNCc1ccc(Cl)cc1OC ZINC000902219037 1045946264 /nfs/dbraw/zinc/94/62/64/1045946264.db2.gz WIAJDSUJXZNBSD-UHFFFAOYSA-N 0 1 304.821 4.070 20 0 DIADMN COC(=O)CC[C@H](N[C@H](C)c1csc(C)c1)c1ccccc1 ZINC000453153453 1045950290 /nfs/dbraw/zinc/95/02/90/1045950290.db2.gz CYOPIRMSZLLABM-PBHICJAKSA-N 0 1 317.454 4.402 20 0 DIADMN CCCCCC[C@H](CC)C(=O)N1CCc2nc[nH]c2C12CCC2 ZINC000829084637 1045954589 /nfs/dbraw/zinc/95/45/89/1045954589.db2.gz LIDKOTRAZXCODG-HNNXBMFYSA-N 0 1 317.477 4.170 20 0 DIADMN CCn1cnc(CNC2(c3ccc(Cl)cc3)CCCC2)c1 ZINC000902247320 1045956413 /nfs/dbraw/zinc/95/64/13/1045956413.db2.gz IKHUYJFLJILGBM-UHFFFAOYSA-N 0 1 303.837 4.116 20 0 DIADMN C[C@@H](N[C@@H](C)c1ccc2c(c1)CCO2)c1ccc(F)cc1F ZINC000192977688 1045957987 /nfs/dbraw/zinc/95/79/87/1045957987.db2.gz UUBUXDWFTBSHTN-NWDGAFQWSA-N 0 1 303.352 4.312 20 0 DIADMN COc1ccc(F)cc1[C@@H](C)N[C@@H](C)c1ccc2c(c1)CCO2 ZINC000193009559 1045960242 /nfs/dbraw/zinc/96/02/42/1045960242.db2.gz ADVVGJVTEGTBIL-QWHCGFSZSA-N 0 1 315.388 4.181 20 0 DIADMN CCc1oc(C[NH2+][C@H](CC)c2ccc(F)cc2F)cc1C(=O)[O-] ZINC000902286161 1045962830 /nfs/dbraw/zinc/96/28/30/1045962830.db2.gz GAXSUOMYEDVONN-OAHLLOKOSA-N 0 1 323.339 4.059 20 0 DIADMN C[C@H](NC1(c2cccc(C(F)(F)F)c2)CCC1)c1ccncn1 ZINC000453168642 1045965975 /nfs/dbraw/zinc/96/59/75/1045965975.db2.gz RJXKNEKKQCPKHY-LBPRGKRZSA-N 0 1 321.346 4.225 20 0 DIADMN C[C@H](N[C@@H](c1cccc(C(F)(F)F)c1)C1CC1)c1ccncn1 ZINC000453171880 1045966122 /nfs/dbraw/zinc/96/61/22/1045966122.db2.gz XAFWLDFABPRXNU-MEDUHNTESA-N 0 1 321.346 4.297 20 0 DIADMN CNc1ccc(C)cc1CNCc1cc(F)ccc1SC ZINC000902289041 1045966217 /nfs/dbraw/zinc/96/62/17/1045966217.db2.gz NYVSAMYFUKCVPL-UHFFFAOYSA-N 0 1 304.434 4.188 20 0 DIADMN COc1ccc(CCN(C)Cc2cc(F)ccc2Cl)cc1 ZINC001138673986 1045970210 /nfs/dbraw/zinc/97/02/10/1045970210.db2.gz HFBPRGALWAGBHL-UHFFFAOYSA-N 0 1 307.796 4.162 20 0 DIADMN CCc1oc(C[N@@H+](C)C[C@@H](C)C2CCCCC2)cc1C(=O)[O-] ZINC000902326490 1045974366 /nfs/dbraw/zinc/97/43/66/1045974366.db2.gz UAZDZDNKYCSUNY-CYBMUJFWSA-N 0 1 307.434 4.188 20 0 DIADMN C[C@@H](C[N@@H+](C)Cc1ccc(/C=C\C(=O)[O-])o1)C1CCCCC1 ZINC000902327371 1045976934 /nfs/dbraw/zinc/97/69/34/1045976934.db2.gz XHNRJCVCSXISKF-BMSUMIBZSA-N 0 1 305.418 4.026 20 0 DIADMN COCCCC[C@H](N[C@H]1C[C@H](C)n2ccnc21)c1ccccc1 ZINC000453201111 1045981717 /nfs/dbraw/zinc/98/17/17/1045981717.db2.gz ABOFGAGLVADPHA-SZMVWBNQSA-N 0 1 313.445 4.037 20 0 DIADMN CC[C@]1(C)CC[N@@H+](Cc2ccc(C(=O)[O-])cc2C(F)(F)F)C1 ZINC000902350455 1045983474 /nfs/dbraw/zinc/98/34/74/1045983474.db2.gz UZBRHFNNXABHTH-OAHLLOKOSA-N 0 1 315.335 4.026 20 0 DIADMN Cc1cc([C@@H](NCCC(C)(F)F)c2cccnc2)ccc1F ZINC000453220746 1045991206 /nfs/dbraw/zinc/99/12/06/1045991206.db2.gz OGNFGWLNPBYNLU-MRXNPFEDSA-N 0 1 308.347 4.253 20 0 DIADMN CCOc1cc(Cl)ccc1CNCc1ccccc1NC ZINC000902410186 1045991728 /nfs/dbraw/zinc/99/17/28/1045991728.db2.gz PPZPCVZFHWRZQI-UHFFFAOYSA-N 0 1 304.821 4.070 20 0 DIADMN C[C@H](NC1(c2ccc(OC(F)(F)F)cc2)CC1)c1cccnc1 ZINC000453240806 1045992122 /nfs/dbraw/zinc/99/21/22/1045992122.db2.gz SPQVYIPPMVHNHS-LBPRGKRZSA-N 0 1 322.330 4.320 20 0 DIADMN CCOc1ccc(Cl)c(NC(=O)c2[nH]cnc2C(C)(C)C)c1 ZINC000633268796 1045993581 /nfs/dbraw/zinc/99/35/81/1045993581.db2.gz WOEXQRAKHDMBQV-UHFFFAOYSA-N 0 1 321.808 4.012 20 0 DIADMN CN(CC/C=C/c1cccnc1)Cc1cc(F)cc(F)c1F ZINC001137875467 1045993696 /nfs/dbraw/zinc/99/36/96/1045993696.db2.gz XMWOJGNIZCAQAW-GORDUTHDSA-N 0 1 306.331 4.034 20 0 DIADMN CC[C@@H](C)c1nc(C2(NC(=O)C(F)(F)F)CCCC2)cs1 ZINC000829627279 1045993870 /nfs/dbraw/zinc/99/38/70/1045993870.db2.gz DGUONMHKSZTXIN-SECBINFHSA-N 0 1 320.380 4.104 20 0 DIADMN Fc1cc(F)c(F)c(CN2C[C@@H]3C[C@H](C2)c2ccccc23)c1 ZINC001137875449 1045995671 /nfs/dbraw/zinc/99/56/71/1045995671.db2.gz WROGPSKPNZOFTP-TXEJJXNPSA-N 0 1 303.327 4.191 20 0 DIADMN C[C@@H](NC1(c2ccc(OC(F)(F)F)cc2)CC1)c1ccncc1 ZINC000453235369 1045996974 /nfs/dbraw/zinc/99/69/74/1045996974.db2.gz KCTSZZYJXHGSJH-GFCCVEGCSA-N 0 1 322.330 4.320 20 0 DIADMN CCn1ccnc1[C@@H](C)N[C@@H](CCCCOC)c1ccccc1 ZINC000453232389 1045997299 /nfs/dbraw/zinc/99/72/99/1045997299.db2.gz WYEWIFFEDNYRKA-AEFFLSMTSA-N 0 1 315.461 4.112 20 0 DIADMN Cc1ccc([C@@H]2CC[N@@H+](Cc3csc(C(=O)[O-])c3)C2)c(C)c1 ZINC000902449555 1045998235 /nfs/dbraw/zinc/99/82/35/1045998235.db2.gz BSIVPZOTDLFCSV-OAHLLOKOSA-N 0 1 315.438 4.053 20 0 DIADMN CCc1oc(C[N@H+]2CC[C@@H]([C@@H]3CCCC3(C)C)C2)cc1C(=O)[O-] ZINC000902470132 1046001928 /nfs/dbraw/zinc/00/19/28/1046001928.db2.gz ZRAMVLSWWNZMNA-CJNGLKHVSA-N 0 1 319.445 4.188 20 0 DIADMN CCC[C@@H](CN[C@H](c1cc2ccccc2o1)c1cccnc1)OC ZINC000453248187 1046003890 /nfs/dbraw/zinc/00/38/90/1046003890.db2.gz KSFSJZQDCCDKEV-PXNSSMCTSA-N 0 1 324.424 4.322 20 0 DIADMN CCc1oc(C[N@H+]2CCCC3(CCCC3)CC2)cc1C(=O)[O-] ZINC000902477469 1046003913 /nfs/dbraw/zinc/00/39/13/1046003913.db2.gz QSTSDXOEQOPRHH-UHFFFAOYSA-N 0 1 305.418 4.087 20 0 DIADMN CCC[C@@H](CN[C@H](c1cccnc1)c1ccc(F)c(C)c1)OC ZINC000453260958 1046007729 /nfs/dbraw/zinc/00/77/29/1046007729.db2.gz YHXIFQLQFMXMTA-HKUYNNGSSA-N 0 1 316.420 4.023 20 0 DIADMN O=C([O-])c1cccc2c(C[N@@H+](C3CC3)C3CCCCC3)ccnc12 ZINC000902514297 1046008549 /nfs/dbraw/zinc/00/85/49/1046008549.db2.gz AQUQOFAKEZOUMF-UHFFFAOYSA-N 0 1 324.424 4.230 20 0 DIADMN CC(C)(CC[N@H+]1CCC[C@@H]1c1cccc2ccccc21)C(=O)[O-] ZINC000902515533 1046009177 /nfs/dbraw/zinc/00/91/77/1046009177.db2.gz WPSRVDLUVCTOBI-GOSISDBHSA-N 0 1 311.425 4.478 20 0 DIADMN CC(C)[N@@H+](Cc1ccc(-c2ccc(C(=O)[O-])cc2)o1)C1CCC1 ZINC000902522899 1046011612 /nfs/dbraw/zinc/01/16/12/1046011612.db2.gz DSJGDSFANZSLHT-UHFFFAOYSA-N 0 1 313.397 4.408 20 0 DIADMN CCc1oc(C[N@@H+](CC2CC2)C2CCCCC2)cc1C(=O)[O-] ZINC000902519990 1046012385 /nfs/dbraw/zinc/01/23/85/1046012385.db2.gz SFKJDCBJAKFRHG-UHFFFAOYSA-N 0 1 305.418 4.085 20 0 DIADMN CC(C)[C@@H]1CCC[N@H+]1Cc1ccc(-c2ccc(C(=O)[O-])cc2)o1 ZINC000902524691 1046012429 /nfs/dbraw/zinc/01/24/29/1046012429.db2.gz OHWYALRLJXEJCR-KRWDZBQOSA-N 0 1 313.397 4.265 20 0 DIADMN Cc1ccc2nc(Cl)c(CN3CC[C@](C)(CF)C3)cc2c1 ZINC001137918397 1046014079 /nfs/dbraw/zinc/01/40/79/1046014079.db2.gz ASACQHQBBXQUCG-QGZVFWFLSA-N 0 1 306.812 4.378 20 0 DIADMN C[C@@H]1CCC[N@@H+](Cc2ccc(-c3ccc(C(=O)[O-])cc3)o2)[C@@H]1C ZINC000902532100 1046014481 /nfs/dbraw/zinc/01/44/81/1046014481.db2.gz WISQXGDQWLZIQZ-ZIAGYGMSSA-N 0 1 313.397 4.265 20 0 DIADMN CC(C)[C@H](C)[N@@H+](C)Cc1ccc(-c2ccccc2C(=O)[O-])o1 ZINC000902525603 1046015225 /nfs/dbraw/zinc/01/52/25/1046015225.db2.gz IVCUQBKUDUJWIG-ZDUSSCGKSA-N 0 1 301.386 4.121 20 0 DIADMN C[N@@H+](CCC(C)(C)C(=O)[O-])C1c2ccccc2-c2ccccc21 ZINC000902531138 1046015476 /nfs/dbraw/zinc/01/54/76/1046015476.db2.gz XTTKUFFZJTXYSP-UHFFFAOYSA-N 0 1 309.409 4.189 20 0 DIADMN CC(C)c1nc(CN[C@H](CC2CC2)c2ccc(Cl)cc2)n[nH]1 ZINC000453285533 1046016601 /nfs/dbraw/zinc/01/66/01/1046016601.db2.gz JDYGJZHTWCXDMW-OAHLLOKOSA-N 0 1 318.852 4.213 20 0 DIADMN CC(C)c1ccc([C@@H]2CCC[N@H+]2CCC(C)(C)C(=O)[O-])cc1 ZINC000902544942 1046017176 /nfs/dbraw/zinc/01/71/76/1046017176.db2.gz OESBSTPLLJOTFJ-KRWDZBQOSA-N 0 1 303.446 4.448 20 0 DIADMN Cc1oc(C(=O)[O-])cc1C[N@H+]1[C@H](C)C[C@@H](c2ccccc2)[C@@H]1C ZINC000902543250 1046017208 /nfs/dbraw/zinc/01/72/08/1046017208.db2.gz RBRGKJCUUIFRQP-IIYDPXPESA-N 0 1 313.397 4.053 20 0 DIADMN C[N@@H+](Cc1ccc(C(=O)[O-])o1)[C@H]1CCCC[C@@H]1c1ccccc1 ZINC000902542868 1046017441 /nfs/dbraw/zinc/01/74/41/1046017441.db2.gz JQORFJKJNIXPFN-SJORKVTESA-N 0 1 313.397 4.136 20 0 DIADMN C[C@@H]1C[C@@H](c2ccccc2)[C@@H](C)[N@H+]1Cc1csc(C(=O)[O-])c1 ZINC000902541876 1046018070 /nfs/dbraw/zinc/01/80/70/1046018070.db2.gz MACWSHNFRJNYLF-XJKCOSOUSA-N 0 1 315.438 4.213 20 0 DIADMN Cc1ccc([C@H]2C[C@@H](C)[N@H+](Cc3csc(C(=O)[O-])c3)C2)cc1 ZINC000902545737 1046018318 /nfs/dbraw/zinc/01/83/18/1046018318.db2.gz KPANVMFKDIOOGQ-CJNGLKHVSA-N 0 1 315.438 4.133 20 0 DIADMN C[N@@H+](Cc1cc(C(=O)[O-])co1)[C@@H]1CCCC[C@H]1c1ccccc1 ZINC000902544102 1046018595 /nfs/dbraw/zinc/01/85/95/1046018595.db2.gz ZUIRVOQCTZOVQP-ZWKOTPCHSA-N 0 1 313.397 4.136 20 0 DIADMN C[C@H]([N@@H+](C)Cc1ccc(C(=O)[O-])cc1C(F)(F)F)C(C)(C)C ZINC000902535750 1046018918 /nfs/dbraw/zinc/01/89/18/1046018918.db2.gz LEKIWTWKXOUINL-JTQLQIEISA-N 0 1 317.351 4.270 20 0 DIADMN Cc1ccc(F)c(Cc2noc([C@@H](C)N3[C@H](C)CC[C@@H]3C)n2)c1 ZINC000453296098 1046019646 /nfs/dbraw/zinc/01/96/46/1046019646.db2.gz QVESKTUAKXOBTJ-HZSPNIEDSA-N 0 1 317.408 4.042 20 0 DIADMN Cc1cc(CN[C@H]2CCCOc3ccc(Cl)cc32)ccn1 ZINC000453301036 1046020274 /nfs/dbraw/zinc/02/02/74/1046020274.db2.gz XSAJBHFIQKROET-INIZCTEOSA-N 0 1 302.805 4.047 20 0 DIADMN CC(C)c1nc(CN[C@H]2CCCCc3ccc(Cl)cc32)n[nH]1 ZINC000453301088 1046020460 /nfs/dbraw/zinc/02/04/60/1046020460.db2.gz XZYJQWUFYGEIEJ-HNNXBMFYSA-N 0 1 318.852 4.139 20 0 DIADMN C[C@@H]1C[N@@H+](CC2CCC3(CCCCC3)CC2)C[C@H]1CC(=O)[O-] ZINC000902561018 1046023509 /nfs/dbraw/zinc/02/35/09/1046023509.db2.gz CAGLQYCAQWILGW-NVXWUHKLSA-N 0 1 307.478 4.170 20 0 DIADMN CC(C)(C)Cc1ncc(C(=O)Nc2cccc(Cl)c2O)s1 ZINC001137932923 1046023863 /nfs/dbraw/zinc/02/38/63/1046023863.db2.gz OLTYYMWXMIOAQJ-UHFFFAOYSA-N 0 1 324.833 4.343 20 0 DIADMN Fc1ccc(F)c(CN2CC[C@H](Cc3ccccc3)C2)c1F ZINC001137930568 1046024027 /nfs/dbraw/zinc/02/40/27/1046024027.db2.gz UFEDLIFRFVXSGG-CQSZACIVSA-N 0 1 305.343 4.169 20 0 DIADMN C[C@@H](CC(C)(C)O)N[C@H](c1cc2ccccc2o1)c1cccnc1 ZINC000453331025 1046025205 /nfs/dbraw/zinc/02/52/05/1046025205.db2.gz VIYCBCIFCRYXED-LIRRHRJNSA-N 0 1 324.424 4.056 20 0 DIADMN Cc1ccc(OC(F)F)c([C@@H](C)NCc2ccnc(C)c2)c1 ZINC000453301882 1046025228 /nfs/dbraw/zinc/02/52/28/1046025228.db2.gz ZKQGTAUCFBCDKX-CYBMUJFWSA-N 0 1 306.356 4.151 20 0 DIADMN CCNc1ccccc1CNCc1cccc(OC2CC2)c1F ZINC000902616431 1046034836 /nfs/dbraw/zinc/03/48/36/1046034836.db2.gz FENLZBSKBOOKHP-UHFFFAOYSA-N 0 1 314.404 4.089 20 0 DIADMN 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20 0 DIADMN COc1ccc([C@@H](CCC(C)C)N[C@H]2CCn3ccnc32)cc1 ZINC000834836405 1046680089 /nfs/dbraw/zinc/68/00/89/1046680089.db2.gz NBTRMIXUQSBSRK-MSOLQXFVSA-N 0 1 313.445 4.104 20 0 DIADMN C[C@H](NCC1=CCCCC1)c1cc(Br)ncc1F ZINC000834835354 1046680126 /nfs/dbraw/zinc/68/01/26/1046680126.db2.gz HPCDTFUEFWZCHP-JTQLQIEISA-N 0 1 313.214 4.134 20 0 DIADMN Cn1ccc([C@H](NCC2CCCCCC2)c2ccc(F)cc2)n1 ZINC000678623219 1046680253 /nfs/dbraw/zinc/68/02/53/1046680253.db2.gz CIIITXBCEHPAMA-LJQANCHMSA-N 0 1 315.436 4.209 20 0 DIADMN Cc1nc2c(s1)CN(Cc1ccc(-c3ccccn3)cc1)CC2 ZINC001140381005 1046681190 /nfs/dbraw/zinc/68/11/90/1046681190.db2.gz NCHPWQLNQJKIJJ-UHFFFAOYSA-N 0 1 321.449 4.072 20 0 DIADMN CC[C@@H](CSc1ccc(Cl)cc1)N[C@H]1CCn2ccnc21 ZINC000834837516 1046682420 /nfs/dbraw/zinc/68/24/20/1046682420.db2.gz XDFIXFCBKZXERU-ZFWWWQNUSA-N 0 1 321.877 4.142 20 0 DIADMN CC[C@H](N[C@H]1CCn2ccnc21)c1ccc2cc(OC)ccc2c1 ZINC000834837097 1046682734 /nfs/dbraw/zinc/68/27/34/1046682734.db2.gz RZIOSGPHEIFSJI-OALUTQOASA-N 0 1 321.424 4.231 20 0 DIADMN C[C@@H]1CCc2c(F)cccc2[C@H]1NCc1cc(F)cnc1Cl ZINC000834839935 1046682850 /nfs/dbraw/zinc/68/28/50/1046682850.db2.gz FYRKYNASXGOVRK-HWPZZCPQSA-N 0 1 322.786 4.426 20 0 DIADMN COc1cccc([C@@H]2C[C@@H](C)CN2Cc2ccnc(Cl)c2)c1 ZINC000784350921 1046682828 /nfs/dbraw/zinc/68/28/28/1046682828.db2.gz TYHVYOCFVOGMKI-DYVFJYSZSA-N 0 1 316.832 4.327 20 0 DIADMN CC1(C)C[C@H](NCc2cc(F)cnc2Cl)c2ccccc21 ZINC000834840229 1046683008 /nfs/dbraw/zinc/68/30/08/1046683008.db2.gz GIAUIEMVWZVZBA-HNNXBMFYSA-N 0 1 304.796 4.386 20 0 DIADMN CCc1ccc(CNCc2ccsc2Br)s1 ZINC000309653761 1046683130 /nfs/dbraw/zinc/68/31/30/1046683130.db2.gz OYRNJCQJZJWNNY-UHFFFAOYSA-N 0 1 316.289 4.424 20 0 DIADMN COc1cccc([C@H]2C[C@H](C)CN2Cc2ccc(Cl)nc2)c1 ZINC000784357162 1046685059 /nfs/dbraw/zinc/68/50/59/1046685059.db2.gz UAZAOQJANCIPTF-SUMWQHHRSA-N 0 1 316.832 4.327 20 0 DIADMN COc1ccccc1-c1nc(CN2CCC(C)(C)CC2)cs1 ZINC000533265382 1046685523 /nfs/dbraw/zinc/68/55/23/1046685523.db2.gz BYNQJVROSLLXFB-UHFFFAOYSA-N 0 1 316.470 4.441 20 0 DIADMN CC[C@H](C)[C@@H]1CCCCN1CC(=O)Nc1ccccc1Cl ZINC000533289802 1046687488 /nfs/dbraw/zinc/68/74/88/1046687488.db2.gz CVSWIDRKBHRKHH-BBRMVZONSA-N 0 1 308.853 4.179 20 0 DIADMN CC[C@@H](C)[C@@H]1CCCCN1CC(=O)Nc1ccccc1Cl ZINC000533289803 1046687601 /nfs/dbraw/zinc/68/76/01/1046687601.db2.gz CVSWIDRKBHRKHH-CJNGLKHVSA-N 0 1 308.853 4.179 20 0 DIADMN CCc1cccc(C)c1NC(=O)CN(CC)Cc1ccccc1C ZINC000042133393 1046687701 /nfs/dbraw/zinc/68/77/01/1046687701.db2.gz RQMUVWDEPIJXMX-UHFFFAOYSA-N 0 1 324.468 4.326 20 0 DIADMN C[C@@H]1CCC[C@@H](C)C1NC(=O)c1cccc2nc(C(F)F)[nH]c21 ZINC001140401078 1046689030 /nfs/dbraw/zinc/68/90/30/1046689030.db2.gz GFEODHSDXSYXRZ-NXEZZACHSA-N 0 1 321.371 4.055 20 0 DIADMN CC[C@H]1CCCN([C@H](C)c2nc(-c3cccs3)no2)CC1 ZINC000533299931 1046692022 /nfs/dbraw/zinc/69/20/22/1046692022.db2.gz RTJJPYUGXQVPLV-OLZOCXBDSA-N 0 1 305.447 4.371 20 0 DIADMN CCc1cnc(CN2CC[C@@H](c3cccc(C(F)(F)F)c3)C2)o1 ZINC000784485726 1046692163 /nfs/dbraw/zinc/69/21/63/1046692163.db2.gz TURNCEYRAGDZBB-CYBMUJFWSA-N 0 1 324.346 4.245 20 0 DIADMN CC[C@@H]1CCCN([C@H](C)C(=O)Nc2ccccc2Cl)CC1 ZINC000533299722 1046692395 /nfs/dbraw/zinc/69/23/95/1046692395.db2.gz RTCQJRRFRMGVPX-ZIAGYGMSSA-N 0 1 308.853 4.179 20 0 DIADMN CCOc1ccc(-c2nc(C[N@@H+](C)[C@@H](C)C(C)C)co2)cc1 ZINC000533324544 1046695698 /nfs/dbraw/zinc/69/56/98/1046695698.db2.gz RKYWSHPJSYOVJW-AWEZNQCLSA-N 0 1 302.418 4.217 20 0 DIADMN Cc1cccc([C@@H]2CCCN2C(=O)c2cccc3[nH]cnc32)c1C ZINC000533326671 1046695982 /nfs/dbraw/zinc/69/59/82/1046695982.db2.gz KNCZNBSVQXDVNG-SFHVURJKSA-N 0 1 319.408 4.157 20 0 DIADMN C[C@@H](N[C@@H](Cc1ccc(F)cc1)c1ccccc1)c1nccn1C ZINC000678767887 1046696377 /nfs/dbraw/zinc/69/63/77/1046696377.db2.gz FOSFZMYJSVVUOU-BEFAXECRSA-N 0 1 323.415 4.194 20 0 DIADMN C[C@H](N[C@@H](Cc1ccc(F)cc1)c1ccccc1)c1nccn1C ZINC000678767893 1046696655 /nfs/dbraw/zinc/69/66/55/1046696655.db2.gz FOSFZMYJSVVUOU-KXBFYZLASA-N 0 1 323.415 4.194 20 0 DIADMN C[C@H](CN(C)Cc1cc(Cl)nc(Cl)c1)c1nccs1 ZINC000784575997 1046698110 /nfs/dbraw/zinc/69/81/10/1046698110.db2.gz GPDLSOFLQPUFOX-SECBINFHSA-N 0 1 316.257 4.080 20 0 DIADMN CCN(Cc1[nH]nc2ccccc21)Cc1c(F)cccc1Cl ZINC001137351081 1046702964 /nfs/dbraw/zinc/70/29/64/1046702964.db2.gz OMGJDGITFGQNHT-UHFFFAOYSA-N 0 1 317.795 4.378 20 0 DIADMN C[C@H]1C[C@@H](CF)N(Cc2cnc(-c3cccc(F)c3)s2)C1 ZINC001140416367 1046705727 /nfs/dbraw/zinc/70/57/27/1046705727.db2.gz BAELFZFNNINISY-FZMZJTMJSA-N 0 1 308.397 4.129 20 0 DIADMN CCc1nn(C)cc1CN([C@@H](C)c1ccc(Cl)cc1)C1CC1 ZINC000678813533 1046708604 /nfs/dbraw/zinc/70/86/04/1046708604.db2.gz CHSJKHXTDKTINS-ZDUSSCGKSA-N 0 1 317.864 4.362 20 0 DIADMN CC[C@H](C)Oc1cc(CNCc2occc2C)ccc1OC ZINC000644432824 1046712834 /nfs/dbraw/zinc/71/28/34/1046712834.db2.gz XCKMOGWYGBZDLY-AWEZNQCLSA-N 0 1 303.402 4.064 20 0 DIADMN CC1(C)CCc2ccccc2[C@H](N[C@H]2CCCn3ccnc32)C1 ZINC000655762159 1046712965 /nfs/dbraw/zinc/71/29/65/1046712965.db2.gz BFBHRPWPGBQVDG-ZWKOTPCHSA-N 0 1 309.457 4.411 20 0 DIADMN Cc1c([C@@H](C)NCc2cnc(C)cc2C)cnn1-c1ccccc1 ZINC000834902653 1046714947 /nfs/dbraw/zinc/71/49/47/1046714947.db2.gz KCZBQYDSELYQDD-MRXNPFEDSA-N 0 1 320.440 4.043 20 0 DIADMN CC(C)(C)N(Cc1nc2c(s1)CCC2)Cc1ccccc1 ZINC000678833289 1046715677 /nfs/dbraw/zinc/71/56/77/1046715677.db2.gz XYTFTHZDUAKXID-UHFFFAOYSA-N 0 1 300.471 4.433 20 0 DIADMN c1cn2c(CN3C4CCCC3CCC4)c(C3CC3)nc2s1 ZINC000678837589 1046716067 /nfs/dbraw/zinc/71/60/67/1046716067.db2.gz AEZHMKFLYXPEDJ-UHFFFAOYSA-N 0 1 301.459 4.180 20 0 DIADMN O=C(Nc1cccc(Cl)c1O)[C@H]1CCc2c1cccc2Cl ZINC000678860855 1046722231 /nfs/dbraw/zinc/72/22/31/1046722231.db2.gz AXUFBQKLPAHNDI-NSHDSACASA-N 0 1 322.191 4.368 20 0 DIADMN CC[C@@H](NCc1ncccc1C(F)(F)F)c1ccc(OC)cc1 ZINC000678858695 1046722348 /nfs/dbraw/zinc/72/23/48/1046722348.db2.gz OIIYMFDRDXMZAV-OAHLLOKOSA-N 0 1 324.346 4.350 20 0 DIADMN Cc1nc([C@H](C)N[C@@H](C)[C@H]2OCCc3sccc32)c(C)s1 ZINC000644558758 1046723613 /nfs/dbraw/zinc/72/36/13/1046723613.db2.gz CXARCSUNBSHZMT-XQJJYNOISA-N 0 1 322.499 4.175 20 0 DIADMN Cc1ccc(Cl)nc1CN1CCC(c2ccc(O)cc2)CC1 ZINC001140446511 1046726340 /nfs/dbraw/zinc/72/63/40/1046726340.db2.gz KIYNOLVWCIOOOO-UHFFFAOYSA-N 0 1 316.832 4.129 20 0 DIADMN O=C(Nc1ccc2c3c(cccc31)CC2)c1cccc2nc[nH]c21 ZINC000533463017 1046726638 /nfs/dbraw/zinc/72/66/38/1046726638.db2.gz BIMMZEBRVRCVLF-UHFFFAOYSA-N 0 1 313.360 4.067 20 0 DIADMN CC(C)Oc1ncccc1CN[C@@H]1CCCc2ccc(F)cc21 ZINC000678923966 1046731883 /nfs/dbraw/zinc/73/18/83/1046731883.db2.gz HUULWJBIWRTPPO-GOSISDBHSA-N 0 1 314.404 4.175 20 0 DIADMN CC(C)O[C@H](CN1CCCC[C@H]1c1ncc[nH]1)c1ccccc1 ZINC000644673617 1046731827 /nfs/dbraw/zinc/73/18/27/1046731827.db2.gz PFCUDLOQRVYMDA-ZWKOTPCHSA-N 0 1 313.445 4.103 20 0 DIADMN CCCCN(Cc1n[nH]c(C(C)C)n1)[C@H](C)c1ccc(C)o1 ZINC000644661071 1046733573 /nfs/dbraw/zinc/73/35/73/1046733573.db2.gz AYJVCNNIELQNLO-CQSZACIVSA-N 0 1 304.438 4.193 20 0 DIADMN Fc1cccc(-c2cnc(CN3CCC(C4CC4)CC3)o2)c1 ZINC000644718710 1046739768 /nfs/dbraw/zinc/73/97/68/1046739768.db2.gz LFEKGIGDNFVACJ-UHFFFAOYSA-N 0 1 300.377 4.103 20 0 DIADMN COc1cc(F)cc(CN2CCC[C@H]2c2ccc(F)cc2)c1 ZINC001140477554 1046741023 /nfs/dbraw/zinc/74/10/23/1046741023.db2.gz GPVYVTZWXADKQI-SFHVURJKSA-N 0 1 303.352 4.311 20 0 DIADMN CCCCC[C@H](CCC)NCc1ncc(Br)cn1 ZINC001258665270 1046743493 /nfs/dbraw/zinc/74/34/93/1046743493.db2.gz WSEPQSNSEAXSFT-ZDUSSCGKSA-N 0 1 314.271 4.078 20 0 DIADMN FC(F)n1ccnc1CNC1(c2ccccc2)CCCCC1 ZINC000533527580 1046744502 /nfs/dbraw/zinc/74/45/02/1046744502.db2.gz PHEGZEDNGRKJLV-UHFFFAOYSA-N 0 1 305.372 4.227 20 0 DIADMN CCc1nc2c(s1)[C@H](N(C)Cc1ccc(F)cc1)CCC2 ZINC000533537176 1046745474 /nfs/dbraw/zinc/74/54/74/1046745474.db2.gz JNDKJYPJSNHKSA-OAHLLOKOSA-N 0 1 304.434 4.354 20 0 DIADMN Clc1cccc(Cl)c1C[N@H+]1CCC[C@@H]([C@H]2CCOC2)C1 ZINC000533539134 1046745712 /nfs/dbraw/zinc/74/57/12/1046745712.db2.gz YNVQJQIWIGPUDD-OLZOCXBDSA-N 0 1 314.256 4.242 20 0 DIADMN Clc1cccc(Cl)c1CN1CCC[C@@H]([C@H]2CCOC2)C1 ZINC000533539134 1046745724 /nfs/dbraw/zinc/74/57/24/1046745724.db2.gz YNVQJQIWIGPUDD-OLZOCXBDSA-N 0 1 314.256 4.242 20 0 DIADMN CC(C)n1cncc1CN1CCC(c2ccc(F)c(F)c2)CC1 ZINC000644901456 1046747213 /nfs/dbraw/zinc/74/72/13/1046747213.db2.gz UAQNXBLYHHYOQV-UHFFFAOYSA-N 0 1 319.399 4.122 20 0 DIADMN C[C@@H](CF)NCc1cccc(OCCCc2ccccc2)c1 ZINC000644892145 1046747871 /nfs/dbraw/zinc/74/78/71/1046747871.db2.gz YRKMISXIRLFYMC-INIZCTEOSA-N 0 1 301.405 4.146 20 0 DIADMN FC(F)Oc1cccc(Cl)c1CN[C@@H]1CCC(F)(F)C1 ZINC000678993968 1046749244 /nfs/dbraw/zinc/74/92/44/1046749244.db2.gz AUGFVIUIROTGAQ-MRVPVSSYSA-N 0 1 311.706 4.219 20 0 DIADMN COc1ccc(CN2CCCC[C@](C)(F)C2)cc1OCC1CC1 ZINC001140487908 1046749902 /nfs/dbraw/zinc/74/99/02/1046749902.db2.gz HDLNHDNIUWRFGQ-IBGZPJMESA-N 0 1 321.436 4.198 20 0 DIADMN c1n[nH]c2c1[C@H](Nc1ccc(COC3CCCC3)cc1)CCC2 ZINC000796880494 1046751538 /nfs/dbraw/zinc/75/15/38/1046751538.db2.gz DGRYSJVXBOBYRK-GOSISDBHSA-N 0 1 311.429 4.358 20 0 DIADMN Cc1[nH]c(C[N@H+](C)C2CCC(C(C)(C)C)CC2)c(C)c1C(=O)[O-] ZINC001140497912 1046754612 /nfs/dbraw/zinc/75/46/12/1046754612.db2.gz WSLJNGIGCJYPPV-UHFFFAOYSA-N 0 1 320.477 4.366 20 0 DIADMN FC(F)(F)c1cccnc1CN1CCC[C@H](c2ccccc2)C1 ZINC000645009230 1046755303 /nfs/dbraw/zinc/75/53/03/1046755303.db2.gz SXQMOLBGCFIEGV-HNNXBMFYSA-N 0 1 320.358 4.480 20 0 DIADMN O=C([O-])c1ccccc1C[N@H+]1CCC[C@H]1c1cccc(Cl)c1 ZINC001140502915 1046756059 /nfs/dbraw/zinc/75/60/59/1046756059.db2.gz HELILVFHAUHDOL-KRWDZBQOSA-N 0 1 315.800 4.375 20 0 DIADMN C[N@@H+](Cc1ccc(C(F)(F)F)cc1)Cc1ccccc1C(=O)[O-] ZINC001140504043 1046756158 /nfs/dbraw/zinc/75/61/58/1046756158.db2.gz VQUFLTFKVXOSAE-UHFFFAOYSA-N 0 1 323.314 4.036 20 0 DIADMN CC(C)n1cc([C@H](C)NCc2ccc(OC(C)(C)C)cc2)cn1 ZINC000679011685 1046756289 /nfs/dbraw/zinc/75/62/89/1046756289.db2.gz GNYMCLOYWVFBAK-HNNXBMFYSA-N 0 1 315.461 4.492 20 0 DIADMN Cc1c(N[C@@H]2CCCc3[nH]ncc32)cnn1-c1cc(C)ccc1C ZINC000796920025 1046758901 /nfs/dbraw/zinc/75/89/01/1046758901.db2.gz 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DIADMN CN1CCN(Cc2coc3ccc(F)cc23)[C@@H](c2ccccc2)C1 ZINC001141846592 1047298120 /nfs/dbraw/zinc/29/81/20/1047298120.db2.gz FFBPNVOXKSONGA-LJQANCHMSA-N 0 1 324.399 4.061 20 0 DIADMN CC(C)n1ncc2c1[C@@H](N[C@H](C)c1cc3cnccc3o1)CCC2 ZINC001118486516 1047298639 /nfs/dbraw/zinc/29/86/39/1047298639.db2.gz GYCKTIVAAJEHDR-CJNGLKHVSA-N 0 1 324.428 4.333 20 0 DIADMN CN(CCC(=O)c1cccs1)Cc1coc2ccc(F)cc12 ZINC001141856681 1047300971 /nfs/dbraw/zinc/30/09/71/1047300971.db2.gz LVCPNQMDNMIESW-UHFFFAOYSA-N 0 1 317.385 4.338 20 0 DIADMN c1coc([C@H]2N(Cc3ccc4c(c3)CCC4)CC23CCOCC3)c1 ZINC001118568421 1047302788 /nfs/dbraw/zinc/30/27/88/1047302788.db2.gz STEVSDNBDLCWNZ-HXUWFJFHSA-N 0 1 323.436 4.122 20 0 DIADMN O=C(C[C@H]1CCCc2ccccc21)Nc1ccc(F)c(F)c1O ZINC001141879591 1047303906 /nfs/dbraw/zinc/30/39/06/1047303906.db2.gz DSGMNBPJBZXLPM-GFCCVEGCSA-N 0 1 317.335 4.119 20 0 DIADMN CCc1ccc2occ(C(=O)Nc3ccc(F)c(F)c3O)c2c1 ZINC001141880016 1047303980 /nfs/dbraw/zinc/30/39/80/1047303980.db2.gz 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COc1ccc(CN[C@@H]2CCc3ccc(F)c(Cl)c32)cc1 ZINC000651667110 1047323348 /nfs/dbraw/zinc/32/33/48/1047323348.db2.gz YWPCHWHCAZDOEE-OAHLLOKOSA-N 0 1 305.780 4.265 20 0 DIADMN COc1ccc([C@@H](C)NCc2cc(C)cc(Cl)n2)c(C)c1 ZINC000840748275 1047323823 /nfs/dbraw/zinc/32/38/23/1047323823.db2.gz GJZBYPYDCSDGEN-CYBMUJFWSA-N 0 1 304.821 4.211 20 0 DIADMN COc1cc(OC)c(CN[C@H](C)c2ccc(C)c(F)c2)cc1F ZINC000651737996 1047325160 /nfs/dbraw/zinc/32/51/60/1047325160.db2.gz XMKMKEVXNVALHL-GFCCVEGCSA-N 0 1 321.367 4.141 20 0 DIADMN CSc1ccc(CN[C@H](C)c2cnn(CC3CCC3)c2)s1 ZINC000898182653 1047326063 /nfs/dbraw/zinc/32/60/63/1047326063.db2.gz UXDSITZCWCYSDC-GFCCVEGCSA-N 0 1 321.515 4.317 20 0 DIADMN CC(C)c1ncc(CN[C@@H](C)c2cnn(CC3CCC3)c2)s1 ZINC000898179286 1047326720 /nfs/dbraw/zinc/32/67/20/1047326720.db2.gz ITKRMFOXARJYPN-ZDUSSCGKSA-N 0 1 318.490 4.114 20 0 DIADMN Cc1nn(-c2cccc(C)c2)cc1CN[C@@H](C)c1cnccc1C ZINC000651748381 1047328041 /nfs/dbraw/zinc/32/80/41/1047328041.db2.gz JHRBOXGPMKTYIU-KRWDZBQOSA-N 0 1 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312.360 4.292 20 0 DIADMN FC(F)(F)Sc1ccccc1CNCc1ccns1 ZINC000898278346 1047333245 /nfs/dbraw/zinc/33/32/45/1047333245.db2.gz GKOOATFQTDHGRU-UHFFFAOYSA-N 0 1 304.362 4.045 20 0 DIADMN FC(F)(F)Sc1ccccc1CN[C@@H]1CCc2cccnc21 ZINC000898278869 1047333580 /nfs/dbraw/zinc/33/35/80/1047333580.db2.gz OQHZPCXHTVUTHS-CYBMUJFWSA-N 0 1 324.371 4.471 20 0 DIADMN Fc1cccc(N2CCCC2)c1CN1CCC2(CC2(F)F)CC1 ZINC000651953597 1047334015 /nfs/dbraw/zinc/33/40/15/1047334015.db2.gz NQSNSWZKEHQHDH-UHFFFAOYSA-N 0 1 324.390 4.047 20 0 DIADMN C[C@@H](N[C@H](Cc1ccccc1)c1nccn1C)c1ccccc1 ZINC000651960880 1047335850 /nfs/dbraw/zinc/33/58/50/1047335850.db2.gz HEFMRUFHYVVQAE-VQIMIIECSA-N 0 1 305.425 4.055 20 0 DIADMN Cc1ccc2c(c1)[C@H](NCc1cnc([C@H]3CCCO3)s1)CC2 ZINC000651959326 1047335916 /nfs/dbraw/zinc/33/59/16/1047335916.db2.gz ILESMNUIXFAENN-IAGOWNOFSA-N 0 1 314.454 4.080 20 0 DIADMN CC[C@H](C)N(Cc1nc(-c2ccco2)no1)Cc1ccccc1 ZINC000044071914 1047336770 /nfs/dbraw/zinc/33/67/70/1047336770.db2.gz 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ZINC001158002867 1047766576 /nfs/dbraw/zinc/76/65/76/1047766576.db2.gz IMVAYUOYUWLNPC-GASCZTMLSA-N 0 1 322.880 4.202 20 0 DIADMN CC(C)CN(C(=O)CN1[C@@H](C)CC[C@@H]1C)c1cccc(Cl)c1 ZINC001158002869 1047766726 /nfs/dbraw/zinc/76/67/26/1047766726.db2.gz IMVAYUOYUWLNPC-GJZGRUSLSA-N 0 1 322.880 4.202 20 0 DIADMN C[C@H]1C[C@H](N2CC(Cc3ccco3)C2)c2ccsc2S1 ZINC001206663942 1047767924 /nfs/dbraw/zinc/76/79/24/1047767924.db2.gz MHUKCKFYVCWYHB-NHYWBVRUSA-N 0 1 305.468 4.441 20 0 DIADMN CN(C(=O)c1cc(C2CCCCC2)[nH]n1)[C@@H]1CCC(C)(C)C1 ZINC000478190605 1047772452 /nfs/dbraw/zinc/77/24/52/1047772452.db2.gz CSXRVAWVASDSFI-CQSZACIVSA-N 0 1 303.450 4.108 20 0 DIADMN CCCCNC(=O)CN([C@H](C)c1ccc2ccccc2c1)C1CC1 ZINC000552594398 1047780940 /nfs/dbraw/zinc/78/09/40/1047780940.db2.gz PXRPRFNHOIACHJ-MRXNPFEDSA-N 0 1 324.468 4.282 20 0 DIADMN CCCN(Cc1ccccc1)[C@H](C)C(=O)Nc1ccccc1C ZINC000552651214 1047784986 /nfs/dbraw/zinc/78/49/86/1047784986.db2.gz DXICLRWIZWGEDB-QGZVFWFLSA-N 0 1 310.441 4.234 20 0 DIADMN COc1ccc([C@H](C)N[C@H]2CCCc3cccnc32)cc1Cl ZINC000927063480 1047787158 /nfs/dbraw/zinc/78/71/58/1047787158.db2.gz ZIBXQGBOHWRWQS-LRDDRELGSA-N 0 1 316.832 4.472 20 0 DIADMN COc1ccc([C@@H](C)N[C@H]2CCCc3cccnc32)cc1Cl ZINC000927063482 1047787170 /nfs/dbraw/zinc/78/71/70/1047787170.db2.gz ZIBXQGBOHWRWQS-WBMJQRKESA-N 0 1 316.832 4.472 20 0 DIADMN Cc1cccc([C@H](C)NCc2nc3cccc(Cl)c3n2C)c1 ZINC000478439904 1047787804 /nfs/dbraw/zinc/78/78/04/1047787804.db2.gz ZIVZUHNAPFEJCE-ZDUSSCGKSA-N 0 1 313.832 4.386 20 0 DIADMN CC(C)(C)[C@@H]1CCCN(C(=O)c2cc(-c3cccs3)[nH]n2)C1 ZINC000478495967 1047790745 /nfs/dbraw/zinc/79/07/45/1047790745.db2.gz WPHNXVWVQMVJBH-GFCCVEGCSA-N 0 1 317.458 4.037 20 0 DIADMN CC[C@@H](C)NC(=O)CN(CC)C(c1ccccc1)c1ccccc1 ZINC000552738847 1047791128 /nfs/dbraw/zinc/79/11/28/1047791128.db2.gz TYFXFVSKJOPYQI-QGZVFWFLSA-N 0 1 324.468 4.013 20 0 DIADMN Cc1cc2ccccc2c(N[C@@H]2CCc3ccccc3[C@H]2O)n1 ZINC001158684886 1047794537 /nfs/dbraw/zinc/79/45/37/1047794537.db2.gz 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ZINC001159311095 1047829465 /nfs/dbraw/zinc/82/94/65/1047829465.db2.gz GISFOWRNKDJCGS-AWEZNQCLSA-N 0 1 315.417 4.248 20 0 DIADMN CC(C)Oc1ccccc1Nc1cc([C@@H]2CCCCN2)no1 ZINC001159312424 1047830114 /nfs/dbraw/zinc/83/01/14/1047830114.db2.gz AWZFMIXEUPPJRV-ZDUSSCGKSA-N 0 1 301.390 4.020 20 0 DIADMN CSc1ccc(F)c(Nc2cc([C@H]3CCCCN3)no2)c1 ZINC001159311213 1047830195 /nfs/dbraw/zinc/83/01/95/1047830195.db2.gz IAPSEEMQCWUUQO-GFCCVEGCSA-N 0 1 307.394 4.094 20 0 DIADMN CC(C)COc1cccc(Nc2cc([C@@H]3CCCCN3)no2)c1 ZINC001159312603 1047830753 /nfs/dbraw/zinc/83/07/53/1047830753.db2.gz CKYBSMUWVJGIIQ-INIZCTEOSA-N 0 1 315.417 4.268 20 0 DIADMN Cc1ccc(OC(C)C)cc1Nc1cc([C@H]2CCCCN2)no1 ZINC001159313320 1047831023 /nfs/dbraw/zinc/83/10/23/1047831023.db2.gz LVMRHHUHBLBLJY-OAHLLOKOSA-N 0 1 315.417 4.328 20 0 DIADMN c1c([C@H]2CCCCN2)noc1Nc1cccc(-c2ccncc2)c1 ZINC001159313170 1047831037 /nfs/dbraw/zinc/83/10/37/1047831037.db2.gz IYBRMSVUDGFHQQ-QGZVFWFLSA-N 0 1 320.396 4.295 20 0 DIADMN Fc1ccc(Nc2cc([C@H]3CCCCN3)no2)c(Cl)c1F ZINC001159312679 1047831174 /nfs/dbraw/zinc/83/11/74/1047831174.db2.gz FMMYAHUUZZUAEU-SECBINFHSA-N 0 1 313.735 4.164 20 0 DIADMN CC(C)COc1ccccc1Nc1cc([C@H]2CCCCN2)no1 ZINC001159313516 1047831420 /nfs/dbraw/zinc/83/14/20/1047831420.db2.gz PXKHXURWSBNEIL-CQSZACIVSA-N 0 1 315.417 4.268 20 0 DIADMN Fc1cc(Nc2cc([C@@H]3CCCCN3)no2)c(F)cc1Cl ZINC001159313556 1047831812 /nfs/dbraw/zinc/83/18/12/1047831812.db2.gz QNHCCYYPORKXMM-NSHDSACASA-N 0 1 313.735 4.164 20 0 DIADMN CC(C)Oc1cccc(Nc2cc([C@H]3CCCCN3)no2)c1F ZINC001159312643 1047831888 /nfs/dbraw/zinc/83/18/88/1047831888.db2.gz DIYOJVWOSNDRHZ-GFCCVEGCSA-N 0 1 319.380 4.159 20 0 DIADMN CSc1cc(C)ccc1Nc1cc([C@@H]2CCCCN2)no1 ZINC001159313635 1047832142 /nfs/dbraw/zinc/83/21/42/1047832142.db2.gz QYJAFHPCMQFPCT-LBPRGKRZSA-N 0 1 303.431 4.263 20 0 DIADMN c1c([C@@H]2CCCCN2)noc1Nc1ccc(-c2ccccc2)nc1 ZINC001159312633 1047832468 /nfs/dbraw/zinc/83/24/68/1047832468.db2.gz DDSZZBKZFPHMGF-KRWDZBQOSA-N 0 1 320.396 4.295 20 0 DIADMN CC(C)Oc1cccc(F)c1Nc1cc([C@H]2CCCCN2)no1 ZINC001159314169 1047832876 /nfs/dbraw/zinc/83/28/76/1047832876.db2.gz ZRFHESDSYIQORK-CYBMUJFWSA-N 0 1 319.380 4.159 20 0 DIADMN Cc1cccc(C(C)C)c1NS(=O)(=O)c1c(C)cccc1F ZINC000479150740 1047842240 /nfs/dbraw/zinc/84/22/40/1047842240.db2.gz BQRPAEOPRKCAAP-UHFFFAOYSA-N 0 1 321.417 4.367 20 0 DIADMN FC(F)(F)c1cnc(Cl)cc1Nc1ccc2c[nH]nc2c1 ZINC001174499829 1047844804 /nfs/dbraw/zinc/84/48/04/1047844804.db2.gz ZCGHCGHNPSQHJA-UHFFFAOYSA-N 0 1 312.682 4.374 20 0 DIADMN Fc1cc(Br)ccc1Nc1ccc2c[nH]nc2c1 ZINC001174499844 1047845615 /nfs/dbraw/zinc/84/56/15/1047845615.db2.gz CAUZAZSJMBYBSO-UHFFFAOYSA-N 0 1 306.138 4.208 20 0 DIADMN Cc1ccc(CSc2nc(C=Cc3ccccc3)n[nH]2)c(C)n1 ZINC000479202163 1047845483 /nfs/dbraw/zinc/84/54/83/1047845483.db2.gz OXHVDOBXXVVHOV-PKNBQFBNSA-N 0 1 322.437 4.279 20 0 DIADMN CCCOc1ncccc1CN[C@H]1CCc2ccc(Cl)cc21 ZINC000479224428 1047848184 /nfs/dbraw/zinc/84/81/84/1047848184.db2.gz NJNDEXKMVYNQMF-KRWDZBQOSA-N 0 1 316.832 4.301 20 0 DIADMN CN(Cc1csc(Cc2ccccc2)n1)CC1CCCC1 ZINC000553429914 1047850083 /nfs/dbraw/zinc/85/00/83/1047850083.db2.gz ZMVMUIZESZOPBP-UHFFFAOYSA-N 0 1 300.471 4.356 20 0 DIADMN CCC(=O)c1ccc(O)c(NC(=O)C2[C@@H]3CCCCCC[C@@H]23)c1 ZINC001159474321 1047852394 /nfs/dbraw/zinc/85/23/94/1047852394.db2.gz TZKDHJVNTCSCJQ-ZIAGYGMSSA-N 0 1 315.413 4.140 20 0 DIADMN C[C@@H](CN(C)Cc1ccn(-c2ccc(F)cc2F)n1)C(C)(C)C ZINC001197602677 1047852157 /nfs/dbraw/zinc/85/21/57/1047852157.db2.gz RJMZTXPVVJCRBQ-ZDUSSCGKSA-N 0 1 321.415 4.265 20 0 DIADMN COc1ccc(CN(C)Cc2cccc(C3CCCC3)c2)cn1 ZINC001182855738 1047853449 /nfs/dbraw/zinc/85/34/49/1047853449.db2.gz QYDUUYFYQZXONZ-UHFFFAOYSA-N 0 1 310.441 4.380 20 0 DIADMN CCc1ccc(C)nc1N[C@H]1CCC[C@@H](CCCC(=O)OC)C1 ZINC001182872588 1047855761 /nfs/dbraw/zinc/85/57/61/1047855761.db2.gz FSYURGIPZMIDAS-RDJZCZTQSA-N 0 1 318.461 4.266 20 0 DIADMN CC(C)=CCCN[C@@H](c1ccn(C)n1)c1ccc(Cl)cc1 ZINC000479287858 1047859646 /nfs/dbraw/zinc/85/96/46/1047859646.db2.gz SNPLFSSBLADHQB-QGZVFWFLSA-N 0 1 303.837 4.109 20 0 DIADMN Cc1cccc(NC(=O)CN2CC[C@@H](C)[C@H]2c2ccccc2)c1C ZINC001197660992 1047859924 /nfs/dbraw/zinc/85/99/24/1047859924.db2.gz RWKRUSIAFNYTDH-IERDGZPVSA-N 0 1 322.452 4.325 20 0 DIADMN CC[C@@H]1CN(Cc2c(Cl)cnn2C)CC[C@H]1c1ccccc1 ZINC001204357997 1047860559 /nfs/dbraw/zinc/86/05/59/1047860559.db2.gz HPAYJDIFIBCXMO-GDBMZVCRSA-N 0 1 317.864 4.089 20 0 DIADMN Cc1cccc(-c2nn(-c3ccncc3C)c3ccc(N)cc32)c1 ZINC001174538648 1047866723 /nfs/dbraw/zinc/86/67/23/1047866723.db2.gz OOPRVOWAGIUEKO-UHFFFAOYSA-N 0 1 314.392 4.287 20 0 DIADMN c1[nH]nc2cc(Nc3ccc(Oc4cccnc4)cc3)ccc12 ZINC001174500515 1047868502 /nfs/dbraw/zinc/86/85/02/1047868502.db2.gz QPGNXIMLAJXDOR-UHFFFAOYSA-N 0 1 302.337 4.494 20 0 DIADMN CC(C)Oc1ccc(F)c(Nc2cccc3[nH]ncc32)c1F ZINC001159574958 1047870274 /nfs/dbraw/zinc/87/02/74/1047870274.db2.gz RAQJFFKOPNPWRQ-UHFFFAOYSA-N 0 1 303.312 4.372 20 0 DIADMN Nc1cccc(Cc2cccc(Nc3ccc4c[nH]nc4c3)c2)c1 ZINC001174501240 1047870275 /nfs/dbraw/zinc/87/02/75/1047870275.db2.gz ITSJBLRUMBEGFP-UHFFFAOYSA-N 0 1 314.392 4.480 20 0 DIADMN Fc1cc(Nc2cccc3[nH]ncc32)cc(F)c1OC(F)F ZINC001159575282 1047871673 /nfs/dbraw/zinc/87/16/73/1047871673.db2.gz VCWOTPQZENFJPW-UHFFFAOYSA-N 0 1 311.238 4.186 20 0 DIADMN COc1ccc(OC(F)(F)F)cc1Nc1cccc2[nH]ncc21 ZINC001159575334 1047871729 /nfs/dbraw/zinc/87/17/29/1047871729.db2.gz XDIVIFIQQITGFC-UHFFFAOYSA-N 0 1 323.274 4.214 20 0 DIADMN C[C@@H](CCN1C[C@@H](C)O[C@@H](CC(F)(F)F)C1)c1ccccc1 ZINC001182999744 1047875555 /nfs/dbraw/zinc/87/55/55/1047875555.db2.gz JALRXZMPNZQLLO-LZWOXQAQSA-N 0 1 315.379 4.222 20 0 DIADMN [O-]c1cc(Nc2ccc(C3CC[NH2+]CC3)cc2)c(F)c(F)c1F ZINC001159601397 1047879604 /nfs/dbraw/zinc/87/96/04/1047879604.db2.gz YCLDHYRZLPEUMB-UHFFFAOYSA-N 0 1 322.330 4.020 20 0 DIADMN Cc1[nH]nc2cc(NC(=O)c3cccc(C(F)F)c3)cc(F)c12 ZINC001197814511 1047887972 /nfs/dbraw/zinc/88/79/72/1047887972.db2.gz CYZYFXAQBAZNGW-UHFFFAOYSA-N 0 1 319.286 4.200 20 0 DIADMN 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DIADMN Cc1nc2cccc(C(=O)Nc3cccc(OCC(C)C)c3)c2[nH]1 ZINC000555082535 1048266962 /nfs/dbraw/zinc/26/69/62/1048266962.db2.gz FJMZWNAOMWETDG-UHFFFAOYSA-N 0 1 323.396 4.158 20 0 DIADMN CCOCc1ncn2c1C[N@@H+](C[C@@H](C)CCC=C(C)C)CCC2 ZINC001201486867 1048279456 /nfs/dbraw/zinc/27/94/56/1048279456.db2.gz NOEAHGNTYPRCKL-KRWDZBQOSA-N 0 1 319.493 4.008 20 0 DIADMN C[C@@H](NCc1ccc2oc(=O)oc2c1)c1ccc(Cl)c(F)c1 ZINC001201490348 1048283442 /nfs/dbraw/zinc/28/34/42/1048283442.db2.gz CAOXTAQQZCLKAB-SECBINFHSA-N 0 1 321.735 4.029 20 0 DIADMN CC[C@@H](Nc1nc(C)cc(N(C)CC)n1)c1ccc(F)c(F)c1 ZINC001162463195 1048284708 /nfs/dbraw/zinc/28/47/08/1048284708.db2.gz FXLCAVBXIPWVBA-OAHLLOKOSA-N 0 1 320.387 4.083 20 0 DIADMN CCS[C@H]1CCCCN(c2ccncc2C(F)(F)F)C1 ZINC001162475731 1048285716 /nfs/dbraw/zinc/28/57/16/1048285716.db2.gz FHEKRRGCZSCIBU-NSHDSACASA-N 0 1 304.381 4.212 20 0 DIADMN COc1cc2c(cc1OC)CN(C[C@@H](C)CCC=C(C)C)C2 ZINC001201500159 1048287766 /nfs/dbraw/zinc/28/77/66/1048287766.db2.gz 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311.353 4.263 20 0 DIADMN CC(C)(C)CCNC(=O)CN1CCC(CC2CCCCC2)CC1 ZINC001176577219 1048734316 /nfs/dbraw/zinc/73/43/16/1048734316.db2.gz CEWFRNRYPOPZHY-UHFFFAOYSA-N 0 1 322.537 4.221 20 0 DIADMN CN(Cc1nnc(-c2ccccc2)s1)[C@H]1CCC(C)(C)C1 ZINC000483102227 1048734442 /nfs/dbraw/zinc/73/44/42/1048734442.db2.gz DTAOOCFPVOJWOL-AWEZNQCLSA-N 0 1 301.459 4.216 20 0 DIADMN CC[N@@H+](CC1CCC1)[C@H](C)C(=O)Nc1c(C)cc(C)cc1Cl ZINC000483119846 1048738763 /nfs/dbraw/zinc/73/87/63/1048738763.db2.gz MXAQLVIAUKGTNT-CQSZACIVSA-N 0 1 322.880 4.406 20 0 DIADMN COCc1csc(CN2CC[C@H](C(F)(F)F)C[C@@H]2C)c1 ZINC000668212511 1048743955 /nfs/dbraw/zinc/74/39/55/1048743955.db2.gz FTAJQGINMDHUOZ-JQWIXIFHSA-N 0 1 307.381 4.057 20 0 DIADMN CC[C@](C)(NCc1ccn(-c2ccc(F)cc2)n1)c1ccccc1 ZINC000775390600 1048743905 /nfs/dbraw/zinc/74/39/05/1048743905.db2.gz OIYCRFKFLYHRCF-FQEVSTJZSA-N 0 1 323.415 4.426 20 0 DIADMN CC[C@H](c1ccc(Cl)cc1)N1C[C@@]2(CCOC2)OC(C)(C)C1 ZINC000483204652 1048753679 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/nfs/dbraw/zinc/76/48/68/1048764868.db2.gz RKYHMJSKBGCBLA-UHFFFAOYSA-N 0 1 316.420 4.420 20 0 DIADMN CCO[C@@H](C)c1nc(CN2CCC[C@H](C(C)(C)C)C2)cs1 ZINC000483251325 1048765574 /nfs/dbraw/zinc/76/55/74/1048765574.db2.gz ROFIJVFARZFAOK-KBPBESRZSA-N 0 1 310.507 4.499 20 0 DIADMN Cc1cc(F)ccc1[C@H]1CCCN1Cc1c(C2CC2)cnn1C ZINC000668226864 1048766065 /nfs/dbraw/zinc/76/60/65/1048766065.db2.gz VKDOAHBDPSOJTE-GOSISDBHSA-N 0 1 313.420 4.082 20 0 DIADMN FC1CC2(C1)CN(Cc1cc3cc(Br)ccc3o1)C2 ZINC000668232082 1048769264 /nfs/dbraw/zinc/76/92/64/1048769264.db2.gz BJQODMNNQLVFRP-UHFFFAOYSA-N 0 1 324.193 4.129 20 0 DIADMN CN(CC[C@@H]1CCCC1(F)F)Cc1ccn(-c2ccccc2)n1 ZINC001190699260 1048772918 /nfs/dbraw/zinc/77/29/18/1048772918.db2.gz GOXSHEXPTGTFHU-HNNXBMFYSA-N 0 1 319.399 4.130 20 0 DIADMN Clc1sccc1CN1CC[C@H](n2ncc3ccccc32)C1 ZINC000483317050 1048774660 /nfs/dbraw/zinc/77/46/60/1048774660.db2.gz SWWGLZWEGIGPOA-AWEZNQCLSA-N 0 1 317.845 4.198 20 0 DIADMN CC[C@H](Cc1ccccc1)NCc1noc(-c2ccccc2C)n1 ZINC000483307850 1048777091 /nfs/dbraw/zinc/77/70/91/1048777091.db2.gz MJJRENZAZSSSFV-QGZVFWFLSA-N 0 1 321.424 4.156 20 0 DIADMN Cn1ccnc1[C@H](NCCC1CCCCC1)c1ccc(F)cc1 ZINC000483307817 1048777119 /nfs/dbraw/zinc/77/71/19/1048777119.db2.gz MHHZNLLDOMBSHF-GOSISDBHSA-N 0 1 315.436 4.209 20 0 DIADMN Cc1ccccc1-c1nc(CNC[C@H](C)Cc2ccccc2)no1 ZINC000483309693 1048778252 /nfs/dbraw/zinc/77/82/52/1048778252.db2.gz QFEMEISMJZGRLI-OAHLLOKOSA-N 0 1 321.424 4.013 20 0 DIADMN Cc1cc2ccccc2c(N2CC[C@H]2COCc2ccccc2)n1 ZINC001166671199 1048778517 /nfs/dbraw/zinc/77/85/17/1048778517.db2.gz VZOOUDAMUZCWGF-IBGZPJMESA-N 0 1 318.420 4.339 20 0 DIADMN COC[C@H](Cc1ccccc1)N(C)Cc1ccsc1Cl ZINC000483335506 1048778818 /nfs/dbraw/zinc/77/88/18/1048778818.db2.gz IQQKOSRMILCKPE-HNNXBMFYSA-N 0 1 309.862 4.091 20 0 DIADMN CCCCN(Cc1ccnc(N)c1)Cc1ccccc1Cl ZINC001190752154 1048781741 /nfs/dbraw/zinc/78/17/41/1048781741.db2.gz HTGHTTADMMXVPX-UHFFFAOYSA-N 0 1 303.837 4.120 20 0 DIADMN COc1ccccc1CN1CC[C@H](C(F)(F)F)C(C)(C)C1 ZINC000483431132 1048791944 /nfs/dbraw/zinc/79/19/44/1048791944.db2.gz ZWYBZWIVHUBXFD-AWEZNQCLSA-N 0 1 301.352 4.106 20 0 DIADMN COc1ccccc1CN1CC[C@@H](C(F)(F)F)C(C)(C)C1 ZINC000483431133 1048792356 /nfs/dbraw/zinc/79/23/56/1048792356.db2.gz ZWYBZWIVHUBXFD-CQSZACIVSA-N 0 1 301.352 4.106 20 0 DIADMN CN(CCSC(C)(C)C)Cc1cc(-c2ccccc2)n[nH]1 ZINC001176837266 1048794477 /nfs/dbraw/zinc/79/44/77/1048794477.db2.gz JCOFOQHDLNOECN-UHFFFAOYSA-N 0 1 303.475 4.040 20 0 DIADMN Cc1noc(C)c1CN(C)CCSc1cccc(Cl)c1 ZINC000851725655 1048794981 /nfs/dbraw/zinc/79/49/81/1048794981.db2.gz CWAITOBWJAXQAN-UHFFFAOYSA-N 0 1 310.850 4.169 20 0 DIADMN COc1cccc(C[N@H+]2CC[C@@H](C(F)(F)F)C(C)(C)C2)c1 ZINC000483428385 1048795096 /nfs/dbraw/zinc/79/50/96/1048795096.db2.gz NIOOHBKQGUGDSH-CQSZACIVSA-N 0 1 301.352 4.106 20 0 DIADMN CCc1cccc(CN(C)Cc2cc(-c3ccccc3)n[nH]2)c1 ZINC001176837424 1048794793 /nfs/dbraw/zinc/79/47/93/1048794793.db2.gz OZBIKQAYPDFDNW-UHFFFAOYSA-N 0 1 305.425 4.271 20 0 DIADMN C[C@@H](c1ccc(C(F)(F)F)cc1)N(C)Cc1cccc(F)n1 ZINC000851738120 1048797109 /nfs/dbraw/zinc/79/71/09/1048797109.db2.gz ARNCGHIUZRRBGY-NSHDSACASA-N 0 1 312.310 4.433 20 0 DIADMN COc1ccc(C[N@H+]2CC[C@H](C(F)(F)F)C(C)(C)C2)cc1F ZINC000483439817 1048800593 /nfs/dbraw/zinc/80/05/93/1048800593.db2.gz LETLTICSGHFZRR-AWEZNQCLSA-N 0 1 319.342 4.245 20 0 DIADMN COc1ccc(CN2CC[C@H](C(F)(F)F)C(C)(C)C2)cc1F ZINC000483439817 1048800617 /nfs/dbraw/zinc/80/06/17/1048800617.db2.gz LETLTICSGHFZRR-AWEZNQCLSA-N 0 1 319.342 4.245 20 0 DIADMN CCCCN(Cc1ccccc1Cl)C[C@@H](O)c1ccccn1 ZINC000851746129 1048802149 /nfs/dbraw/zinc/80/21/49/1048802149.db2.gz HQCAYDPHFOTHLM-GOSISDBHSA-N 0 1 318.848 4.071 20 0 DIADMN Fc1cccc(F)c1CN(CCOC1CCC1)C1CCCC1 ZINC001190903526 1048803861 /nfs/dbraw/zinc/80/38/61/1048803861.db2.gz CPYDHKXHAKKUHX-UHFFFAOYSA-N 0 1 309.400 4.279 20 0 DIADMN Cc1cccnc1[C@H](C)NCc1ccc(OCC(F)(F)F)cc1 ZINC001176896515 1048806217 /nfs/dbraw/zinc/80/62/17/1048806217.db2.gz HEWPJDRMCVMTKD-ZDUSSCGKSA-N 0 1 324.346 4.182 20 0 DIADMN O[C@@H](C[C@H]1CCCN1CC=C(Cl)Cl)c1ccc(F)cc1 ZINC000851860162 1048807459 /nfs/dbraw/zinc/80/74/59/1048807459.db2.gz FYDBLALMSHPFHH-KGLIPLIRSA-N 0 1 318.219 4.033 20 0 DIADMN C[C@@H](c1cn(-c2ccccc2)nn1)N1CCC[C@]2(CC=CCC2)C1 ZINC001190978081 1048810794 /nfs/dbraw/zinc/81/07/94/1048810794.db2.gz XJOCCMPIBLORNQ-FXAWDEMLSA-N 0 1 322.456 4.151 20 0 DIADMN COc1cccc([C@@H]2C[N@H+]([C@@H]3CCCc4ccccc43)CCO2)c1 ZINC000483520069 1048811229 /nfs/dbraw/zinc/81/12/29/1048811229.db2.gz SKRHXOLVWYPCGD-RTWAWAEBSA-N 0 1 323.436 4.146 20 0 DIADMN COc1cccc([C@@H]2CN([C@@H]3CCCc4ccccc43)CCO2)c1 ZINC000483520069 1048811244 /nfs/dbraw/zinc/81/12/44/1048811244.db2.gz SKRHXOLVWYPCGD-RTWAWAEBSA-N 0 1 323.436 4.146 20 0 DIADMN CCN(CCC1(OC)CCC1)Cc1nc2c(s1)C[C@H](C)CC2 ZINC001176966089 1048811634 /nfs/dbraw/zinc/81/16/34/1048811634.db2.gz TUCDZANOLZZACU-CQSZACIVSA-N 0 1 322.518 4.049 20 0 DIADMN COc1cc(CN[C@H](C)c2csc3ccccc23)sn1 ZINC000851931178 1048812811 /nfs/dbraw/zinc/81/28/11/1048812811.db2.gz MPEFLYWSJPFTSE-SNVBAGLBSA-N 0 1 304.440 4.217 20 0 DIADMN COc1cccc([C@H]2C[N@H+]([C@H]3CCCc4ccccc43)CCO2)c1 ZINC000483520063 1048813122 /nfs/dbraw/zinc/81/31/22/1048813122.db2.gz SKRHXOLVWYPCGD-LEWJYISDSA-N 0 1 323.436 4.146 20 0 DIADMN COc1cccc([C@H]2CN([C@H]3CCCc4ccccc43)CCO2)c1 ZINC000483520063 1048813130 /nfs/dbraw/zinc/81/31/30/1048813130.db2.gz SKRHXOLVWYPCGD-LEWJYISDSA-N 0 1 323.436 4.146 20 0 DIADMN CCCOc1ccc(C(C)(C)NCc2cccc(F)n2)cc1 ZINC000852004747 1048818518 /nfs/dbraw/zinc/81/85/18/1048818518.db2.gz TVNHXLDRJHQECT-UHFFFAOYSA-N 0 1 302.393 4.034 20 0 DIADMN CC1(C)CCCN1Cc1cc(Cl)cc(Br)c1 ZINC001191013825 1048820007 /nfs/dbraw/zinc/82/00/07/1048820007.db2.gz OYGMZFIYQBODCQ-UHFFFAOYSA-N 0 1 302.643 4.477 20 0 DIADMN O=C(Cc1n[nH]c2ccccc21)Nc1ccc2c(c1)C=CCCC2 ZINC001166974127 1048820567 /nfs/dbraw/zinc/82/05/67/1048820567.db2.gz LPFLGAYQRJORFQ-UHFFFAOYSA-N 0 1 317.392 4.094 20 0 DIADMN CC[C@@H]1CCCN1Cc1cc(Cl)cc(Br)c1 ZINC001191028734 1048825098 /nfs/dbraw/zinc/82/50/98/1048825098.db2.gz ANCKZTSMQAMOJA-CYBMUJFWSA-N 0 1 302.643 4.477 20 0 DIADMN C[C@@H](c1nc2ccc(Cl)cc2[nH]1)N(C)Cc1ccsc1 ZINC000852126785 1048827650 /nfs/dbraw/zinc/82/76/50/1048827650.db2.gz HLGXDNYAENKMTD-JTQLQIEISA-N 0 1 305.834 4.471 20 0 DIADMN C[C@H](c1nc2ccc(Cl)cc2[nH]1)N(C)CC(F)(F)C(F)F ZINC000852128393 1048827710 /nfs/dbraw/zinc/82/77/10/1048827710.db2.gz NBWZUVVPCBBVMD-SSDOTTSWSA-N 0 1 323.721 4.110 20 0 DIADMN Fc1ccc(OC(F)F)c(CN2CCC[C@@]3(CC3(F)F)C2)c1 ZINC000852213537 1048830234 /nfs/dbraw/zinc/83/02/34/1048830234.db2.gz MDYVGRZQCAQRTB-CQSZACIVSA-N 0 1 321.289 4.048 20 0 DIADMN C[C@H](NC[C@@H]1CCCC[C@H]1C)c1nc(Cc2ccccc2)no1 ZINC000483636720 1048834086 /nfs/dbraw/zinc/83/40/86/1048834086.db2.gz KDYAXOTWOPZHTN-VYDXJSESSA-N 0 1 313.445 4.137 20 0 DIADMN C[C@@H](N[C@@H](C)CCCC(F)(F)F)c1nc(C(C)(C)C)no1 ZINC000483634008 1048835330 /nfs/dbraw/zinc/83/53/30/1048835330.db2.gz GTYOBGCTRZHARG-VHSXEESVSA-N 0 1 307.360 4.139 20 0 DIADMN COC(=O)c1ccc(CN(C)[C@@H](C)c2ccc(C)cc2)c(F)c1 ZINC001167037595 1048836114 /nfs/dbraw/zinc/83/61/14/1048836114.db2.gz DBKZMJUQKXGIOZ-AWEZNQCLSA-N 0 1 315.388 4.114 20 0 DIADMN C[C@H](NC1CCC(C)(C)CC1)c1nc(Cc2ccccc2)no1 ZINC000483652812 1048836470 /nfs/dbraw/zinc/83/64/70/1048836470.db2.gz TYLNEMGFWLYNIA-AWEZNQCLSA-N 0 1 313.445 4.280 20 0 DIADMN O[C@@H](CN1CC2(CCCC2)[C@@H]1c1ccco1)c1cccc(F)c1 ZINC000852425825 1048840516 /nfs/dbraw/zinc/84/05/16/1048840516.db2.gz DPYHIKGSFFFYCF-WMZOPIPTSA-N 0 1 315.388 4.069 20 0 DIADMN CCc1ccccc1CN[C@@H]1CCc2ccccc2-n2ccnc21 ZINC001203188770 1048843588 /nfs/dbraw/zinc/84/35/88/1048843588.db2.gz XDTFHFHCQRORDC-LJQANCHMSA-N 0 1 317.436 4.212 20 0 DIADMN CO[C@@H]1CCCC[C@H]1NCc1csc(C2CCCCC2)n1 ZINC000483719548 1048843692 /nfs/dbraw/zinc/84/36/92/1048843692.db2.gz DIZZLKJKMAGIQZ-HZPDHXFCSA-N 0 1 308.491 4.238 20 0 DIADMN CCn1nccc1CNCc1ccc2oc3ccccc3c2c1 ZINC001203186799 1048844081 /nfs/dbraw/zinc/84/40/81/1048844081.db2.gz BOYSJIWURUOCQQ-UHFFFAOYSA-N 0 1 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/nfs/dbraw/zinc/87/32/13/1048873213.db2.gz CAQSCSQBMSPZAM-UHFFFAOYSA-N 0 1 318.848 4.331 20 0 DIADMN Cc1cc2c(o1)CC(C)(C)C[C@@H]2NCc1cnc(F)c(C)c1 ZINC001177308560 1048873832 /nfs/dbraw/zinc/87/38/32/1048873832.db2.gz XJHHPHGZSSDLHI-HNNXBMFYSA-N 0 1 302.393 4.234 20 0 DIADMN Cn1ncc(C2CC2)c1CN1CC2(CC=CC2)[C@@H]1c1ccccc1 ZINC000668277535 1048876981 /nfs/dbraw/zinc/87/69/81/1048876981.db2.gz JWQVWMVIHYYCRB-FQEVSTJZSA-N 0 1 319.452 4.191 20 0 DIADMN CCc1nc(C)c([C@@H](C)[N@@H+](C)C[C@H]2CCC3(CCC3)CO2)s1 ZINC001191146081 1048877746 /nfs/dbraw/zinc/87/77/46/1048877746.db2.gz TVPQAYKAZWRYPN-HUUCEWRRSA-N 0 1 322.518 4.356 20 0 DIADMN Cc1ccc([C@@H]2CCCC[N@H+]2Cc2cc(CO)ccc2F)cc1 ZINC001191194944 1048878797 /nfs/dbraw/zinc/87/87/97/1048878797.db2.gz VRRCAIWKIDHDDE-FQEVSTJZSA-N 0 1 313.416 4.354 20 0 DIADMN Cc1ccc([C@@H]2CCCCN2Cc2cc(CO)ccc2F)cc1 ZINC001191194944 1048878811 /nfs/dbraw/zinc/87/88/11/1048878811.db2.gz VRRCAIWKIDHDDE-FQEVSTJZSA-N 0 1 313.416 4.354 20 0 DIADMN Cc1cc(Cl)ccc1NC(=O)[C@H](C)[N@H+]1CCC2(CCCC2)C1 ZINC001191193664 1048880012 /nfs/dbraw/zinc/88/00/12/1048880012.db2.gz NQUNMMZNJLONBU-AWEZNQCLSA-N 0 1 320.864 4.242 20 0 DIADMN Cc1ccc(CN[C@@H](CCc2ccccc2)c2ccccc2)nn1 ZINC001177363400 1048881033 /nfs/dbraw/zinc/88/10/33/1048881033.db2.gz QUUXDSGBHSFUOZ-NRFANRHFSA-N 0 1 317.436 4.249 20 0 DIADMN C[C@H](NCc1cc(F)c(F)cc1F)c1ccc2c(c1)CCCO2 ZINC000853094365 1048881448 /nfs/dbraw/zinc/88/14/48/1048881448.db2.gz BVZBMWBBICGAAA-NSHDSACASA-N 0 1 321.342 4.280 20 0 DIADMN CCC[C@@H](NCc1cnc(C)nc1)c1cccc(C(F)(F)F)c1 ZINC000338955078 1048885848 /nfs/dbraw/zinc/88/58/48/1048885848.db2.gz DEVKLENIJFAWSR-MRXNPFEDSA-N 0 1 323.362 4.435 20 0 DIADMN COc1nscc1CN(C)[C@H]1CCC[C@@H]1c1ccc(C)cc1 ZINC001191214039 1048888408 /nfs/dbraw/zinc/88/84/08/1048888408.db2.gz LRVSOSVABGUVSB-SJORKVTESA-N 0 1 316.470 4.228 20 0 DIADMN C[C@@H](N[C@H](C)c1cccnc1Cl)c1ccc2c(c1)CCCO2 ZINC000853240866 1048891913 /nfs/dbraw/zinc/89/19/13/1048891913.db2.gz 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ZINC001203528275 1048920564 /nfs/dbraw/zinc/92/05/64/1048920564.db2.gz KYEYAADWWSSMIV-UHFFFAOYSA-N 0 1 322.364 4.032 20 0 DIADMN COc1ccc2c(c1)nccc2Nc1ccc2nc(C)oc2c1 ZINC001203526147 1048921435 /nfs/dbraw/zinc/92/14/35/1048921435.db2.gz OYYYNPXNTLQBIP-UHFFFAOYSA-N 0 1 305.337 4.437 20 0 DIADMN CC(C)(C)c1coc(CNCC2(c3ccc(F)cc3)CCC2)n1 ZINC001177595195 1048921797 /nfs/dbraw/zinc/92/17/97/1048921797.db2.gz WMRADHNKDDRULX-UHFFFAOYSA-N 0 1 316.420 4.323 20 0 DIADMN CC(C)C[C@H]1CCN(Cc2c(F)cccc2Br)C1 ZINC001191344639 1048922402 /nfs/dbraw/zinc/92/24/02/1048922402.db2.gz ZIVJTJKBGWEYGQ-GFCCVEGCSA-N 0 1 314.242 4.456 20 0 DIADMN CC(C)[C@@H](CNc1nc2cc3c(cc2[nH]1)OCO3)c1ccccc1 ZINC001203530245 1048924339 /nfs/dbraw/zinc/92/43/39/1048924339.db2.gz QDXRUWQQUBPOJJ-CQSZACIVSA-N 0 1 323.396 4.143 20 0 DIADMN CCOc1ccccc1CN1CCSC[C@H]1c1ccccc1 ZINC001203541141 1048924626 /nfs/dbraw/zinc/92/46/26/1048924626.db2.gz PBQSEPDRDYGKEC-SFHVURJKSA-N 0 1 313.466 4.375 20 0 DIADMN COc1ccc(Cl)cc1CN1CCS[C@@H]2CCCC[C@H]21 ZINC001191358258 1048925434 /nfs/dbraw/zinc/92/54/34/1048925434.db2.gz HWLSKUSDYJJXEF-GDBMZVCRSA-N 0 1 311.878 4.209 20 0 DIADMN C[C@@H]1CCC[C@H](C)N1Cc1cc(F)ccc1Br ZINC001191320806 1048925810 /nfs/dbraw/zinc/92/58/10/1048925810.db2.gz WWTCXRBVXBSYEH-PHIMTYICSA-N 0 1 300.215 4.351 20 0 DIADMN CC1(C)CN(CCOc2ccccc2F)CC[C@@H]1C(F)(F)F ZINC000484350372 1048930469 /nfs/dbraw/zinc/93/04/69/1048930469.db2.gz LKLSXBMLPPVLPV-AWEZNQCLSA-N 0 1 319.342 4.115 20 0 DIADMN Clc1ccc(CNc2cnn(-c3ccncc3)c2)c(Cl)c1 ZINC001177647081 1048931009 /nfs/dbraw/zinc/93/10/09/1048931009.db2.gz WHGQVACIGGJQDB-UHFFFAOYSA-N 0 1 319.195 4.186 20 0 DIADMN Cc1nccnc1[C@H](C)NCc1ccc(C2CC2)c(C2CC2)c1 ZINC001203565823 1048931590 /nfs/dbraw/zinc/93/15/90/1048931590.db2.gz JUVHMADMINEFJG-AWEZNQCLSA-N 0 1 307.441 4.391 20 0 DIADMN O=C(Nc1ccsc1)c1cc(-c2cccc(Cl)c2)n[nH]1 ZINC001191359511 1048933382 /nfs/dbraw/zinc/93/33/82/1048933382.db2.gz BCUIQGOEAAQCAQ-UHFFFAOYSA-N 0 1 303.774 4.044 20 0 DIADMN Cc1nc(C2(NC[C@@H]3CCCC(C)(C)C3)CCCCC2)no1 ZINC001177697845 1048933816 /nfs/dbraw/zinc/93/38/16/1048933816.db2.gz HPVHBMAMOKWKGZ-OAHLLOKOSA-N 0 1 305.466 4.343 20 0 DIADMN Cc1ccn2cc(CNCc3ccc4ccccc4c3)nc2c1 ZINC001177733940 1048937019 /nfs/dbraw/zinc/93/70/19/1048937019.db2.gz YUNIGYQIJMCLSZ-UHFFFAOYSA-N 0 1 301.393 4.086 20 0 DIADMN CC1(C)CC[C@@H](NCc2cn3cccc(F)c3n2)c2ccccc21 ZINC001177749574 1048938693 /nfs/dbraw/zinc/93/86/93/1048938693.db2.gz ZRTFSFMPPOOJOQ-GOSISDBHSA-N 0 1 323.415 4.376 20 0 DIADMN COc1cc(F)c([C@H](C)NCc2ccccc2C)cc1OC ZINC001177816299 1048940921 /nfs/dbraw/zinc/94/09/21/1048940921.db2.gz JWTUVLHPDOFYKK-ZDUSSCGKSA-N 0 1 303.377 4.002 20 0 DIADMN CCc1cccc2c1OCC[C@@H]2NCc1cc(C)ccc1OC ZINC001177757926 1048941135 /nfs/dbraw/zinc/94/11/35/1048941135.db2.gz FWTVVFSQUFIURR-SFHVURJKSA-N 0 1 311.425 4.179 20 0 DIADMN CC[C@H](NC)c1nc(-c2ccc(C)cc2OC2CCCC2)no1 ZINC000854147070 1048943308 /nfs/dbraw/zinc/94/33/08/1048943308.db2.gz TUCWKTHFXBJWSM-HNNXBMFYSA-N 0 1 315.417 4.037 20 0 DIADMN Cc1cc(C)c(/C=C/CNCc2cn3c(cccc3C)n2)c(C)c1 ZINC001177810666 1048947244 /nfs/dbraw/zinc/94/72/44/1048947244.db2.gz NSSLVWRBPFVQIZ-SOFGYWHQSA-N 0 1 319.452 4.371 20 0 DIADMN COc1ccc(C[C@@H]2CCN2[C@@H](C)c2ccc(F)cc2F)cc1 ZINC001191498038 1048950072 /nfs/dbraw/zinc/95/00/72/1048950072.db2.gz WORMZOAUCAPGMZ-BBRMVZONSA-N 0 1 317.379 4.351 20 0 DIADMN C[C@@H]1CCN(Cc2cccc(Br)c2Cl)[C@@H]1C ZINC001191486933 1048952425 /nfs/dbraw/zinc/95/24/25/1048952425.db2.gz WMDRSXOEPWRYFU-NXEZZACHSA-N 0 1 302.643 4.333 20 0 DIADMN C[C@H]1CCN(Cc2cccc(Br)c2Cl)[C@H]1C ZINC001191486934 1048952863 /nfs/dbraw/zinc/95/28/63/1048952863.db2.gz WMDRSXOEPWRYFU-UWVGGRQHSA-N 0 1 302.643 4.333 20 0 DIADMN CC(C)Oc1ccnc(CN2CCSC3(CCCCC3)C2)c1 ZINC001191465317 1048954254 /nfs/dbraw/zinc/95/42/54/1048954254.db2.gz ZTRCBPWZXRZIRW-UHFFFAOYSA-N 0 1 320.502 4.121 20 0 DIADMN COc1cc(Cl)ccc1CNCc1ccc2c(c1)CCC2 ZINC001177892840 1048958450 /nfs/dbraw/zinc/95/84/50/1048958450.db2.gz CCNTYRDYNKODNT-UHFFFAOYSA-N 0 1 301.817 4.127 20 0 DIADMN CC(C)[C@@H]1CCN(Cc2cn3cc(Cl)cc(Cl)c3n2)C1 ZINC001191541024 1048960210 /nfs/dbraw/zinc/96/02/10/1048960210.db2.gz LSVAUEJULRTQSS-LLVKDONJSA-N 0 1 312.244 4.119 20 0 DIADMN CCO[C@H]1C[C@H](N(C)Cc2cccc(Cl)c2F)C12CCC2 ZINC001191549812 1048963027 /nfs/dbraw/zinc/96/30/27/1048963027.db2.gz GOVKWFZVLZNGOR-GJZGRUSLSA-N 0 1 311.828 4.259 20 0 DIADMN Cc1c(Cl)ccc(CNCc2cc(N(C)C)ccn2)c1Cl ZINC001203691529 1048964897 /nfs/dbraw/zinc/96/48/97/1048964897.db2.gz TZMFZMWDNXGNDA-UHFFFAOYSA-N 0 1 324.255 4.053 20 0 DIADMN C[C@H]1CN(CCCC2CCCCC2)CCN1C(=O)OC(C)(C)C ZINC001191617796 1048966930 /nfs/dbraw/zinc/96/69/30/1048966930.db2.gz NJRGSZFETVRGKA-INIZCTEOSA-N 0 1 324.509 4.288 20 0 DIADMN C[C@@H]1CN(CCCC2CCCCC2)CCN1C(=O)OC(C)(C)C ZINC001191617804 1048967831 /nfs/dbraw/zinc/96/78/31/1048967831.db2.gz NJRGSZFETVRGKA-MRXNPFEDSA-N 0 1 324.509 4.288 20 0 DIADMN Fc1cccc2sc(-c3nc([C@@H]4CCCN4)no3)c(Cl)c21 ZINC000904075221 1048970110 /nfs/dbraw/zinc/97/01/10/1048970110.db2.gz 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CC1(C)[C@@H](c2ccc(F)cc2)CCN1Cc1cnc(Cl)cn1 ZINC000859805066 1049353178 /nfs/dbraw/zinc/35/31/78/1049353178.db2.gz JYBHVZAPIBVLTK-OAHLLOKOSA-N 0 1 319.811 4.037 20 0 DIADMN c1ncc(-c2ccc(CN[C@@H](c3ccccn3)C3CCC3)cc2)o1 ZINC000906526001 1049353595 /nfs/dbraw/zinc/35/35/95/1049353595.db2.gz BGRRUPWCIOCIEM-HXUWFJFHSA-N 0 1 319.408 4.368 20 0 DIADMN COc1ccc(CN(C)Cc2ccccc2OCC(C)C)cc1 ZINC001180422993 1049354253 /nfs/dbraw/zinc/35/42/53/1049354253.db2.gz QXWUGUIFWCNURI-UHFFFAOYSA-N 0 1 313.441 4.362 20 0 DIADMN CCc1ncc(CN2CCC(CCc3ccc(C)cc3)CC2)cn1 ZINC001180369000 1049354290 /nfs/dbraw/zinc/35/42/90/1049354290.db2.gz YQKLQEGOKVTTHJ-UHFFFAOYSA-N 0 1 323.484 4.192 20 0 DIADMN CC[C@H]1CCCCN1Cc1cc(Br)c(OC)s1 ZINC001180372383 1049354383 /nfs/dbraw/zinc/35/43/83/1049354383.db2.gz SEBOCTXHKNACAR-JTQLQIEISA-N 0 1 318.280 4.284 20 0 DIADMN C[C@@H](N[C@H](C)c1cccc(Cl)c1)C(=O)N1[C@H](C)CCC[C@@H]1C ZINC000485895254 1049358481 /nfs/dbraw/zinc/35/84/81/1049358481.db2.gz MKPAQCCMHPIJRA-LXTVHRRPSA-N 0 1 322.880 4.169 20 0 DIADMN CC[C@H](NCc1c(C)nn(C)c1Cl)c1cc(C)ccc1C ZINC000859935561 1049362819 /nfs/dbraw/zinc/36/28/19/1049362819.db2.gz SDNJSWOUAXWGON-INIZCTEOSA-N 0 1 305.853 4.240 20 0 DIADMN CC(C)Oc1ccc(CN[C@H](C)c2ccns2)cc1Cl ZINC000860058574 1049366801 /nfs/dbraw/zinc/36/68/01/1049366801.db2.gz NBCFDKOJNHTODM-LLVKDONJSA-N 0 1 310.850 4.435 20 0 DIADMN O=S(=O)(Nc1ccsc1)c1cccc2c(Cl)cccc21 ZINC001194402909 1049369513 /nfs/dbraw/zinc/36/95/13/1049369513.db2.gz BRGZEAMDUVEFKE-UHFFFAOYSA-N 0 1 323.826 4.356 20 0 DIADMN CC[C@H](C)N(Cc1cnnn1-c1ccccc1)Cc1ccccc1 ZINC001205094046 1049373085 /nfs/dbraw/zinc/37/30/85/1049373085.db2.gz OFQLNUIXZWKFRL-KRWDZBQOSA-N 0 1 320.440 4.068 20 0 DIADMN CCC[C@@H](NCc1noc(-c2ccccc2C)n1)C(C)(C)C ZINC001194425265 1049373236 /nfs/dbraw/zinc/37/32/36/1049373236.db2.gz CASVZHUSELKCCT-OAHLLOKOSA-N 0 1 301.434 4.349 20 0 DIADMN CC[C@H](C)[N@@H+](Cc1ccccc1)Cc1ccc([O-])c(F)c1F ZINC001205094567 1049373619 /nfs/dbraw/zinc/37/36/19/1049373619.db2.gz 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C[C@]1(c2ccc(F)cc2)CN(Cc2cccc3cc[nH]c32)CCO1 ZINC001144717279 1050668325 /nfs/dbraw/zinc/66/83/25/1050668325.db2.gz IIGRXBKFDADRCF-HXUWFJFHSA-N 0 1 324.399 4.055 20 0 DIADMN Cn1cc(CN2CCC[C@]3(CC3(F)F)C2)c(C2CCCCC2)n1 ZINC000846105957 1050669351 /nfs/dbraw/zinc/66/93/51/1050669351.db2.gz ZHDVMFXAZYGCHW-KRWDZBQOSA-N 0 1 323.431 4.089 20 0 DIADMN Fc1ccc(-c2noc(-c3cc(Cl)[nH]n3)n2)c2ccccc12 ZINC001213498199 1050672091 /nfs/dbraw/zinc/67/20/91/1050672091.db2.gz BHQRJNCCFWLFFE-UHFFFAOYSA-N 0 1 314.707 4.072 20 0 DIADMN Fc1cc(Cl)c(CN2CCC[C@@H]2Cc2ccccn2)cc1F ZINC001144726888 1050676425 /nfs/dbraw/zinc/67/64/25/1050676425.db2.gz PSCVSHRVIGCJKY-CQSZACIVSA-N 0 1 322.786 4.220 20 0 DIADMN O=C(c1ccc(F)cc1F)C1CCN(Cc2ccccc2)CC1 ZINC000716334978 1050685992 /nfs/dbraw/zinc/68/59/92/1050685992.db2.gz OUFJPCPSTPEILA-UHFFFAOYSA-N 0 1 315.363 4.060 20 0 DIADMN Cc1cc(F)ccc1[C@H](C)N[C@@H](c1ccccc1F)[C@H](C)O ZINC000846181734 1050688244 /nfs/dbraw/zinc/68/82/44/1050688244.db2.gz DHUSMNMVPDGDAF-ZJNRKIDTSA-N 0 1 305.368 4.046 20 0 DIADMN CCCN(CCC)c1ccc(N[C@@H](C)c2nccn2C)cc1 ZINC000846200948 1050694236 /nfs/dbraw/zinc/69/42/36/1050694236.db2.gz JVLSFSBPQSLFPH-HNNXBMFYSA-N 0 1 300.450 4.220 20 0 DIADMN CC(C)c1nc(CN[C@H](C(C)C)[C@H](O)c2ccccc2)cs1 ZINC000788536583 1050698267 /nfs/dbraw/zinc/69/82/67/1050698267.db2.gz QMEXNDIJVLVPDQ-IAGOWNOFSA-N 0 1 318.486 4.114 20 0 DIADMN CC(C)c1nc(CN[C@@H](C(C)C)[C@@H](O)c2ccccc2)cs1 ZINC000788536584 1050699111 /nfs/dbraw/zinc/69/91/11/1050699111.db2.gz QMEXNDIJVLVPDQ-IRXDYDNUSA-N 0 1 318.486 4.114 20 0 DIADMN C/C(=C/C[N@H+](C)[C@@H](C)c1ccc(Cl)c(Cl)c1)C(=O)[O-] ZINC000846238057 1050699161 /nfs/dbraw/zinc/69/91/61/1050699161.db2.gz SHDVSGXNWSNGDA-MBACFSSFSA-N 0 1 302.201 4.017 20 0 DIADMN Cc1ccc(C[N@@H+](Cc2ccccc2CC(=O)[O-])C(C)C)s1 ZINC000846242032 1050701818 /nfs/dbraw/zinc/70/18/18/1050701818.db2.gz MKLHCAGZUFZARW-UHFFFAOYSA-N 0 1 317.454 4.094 20 0 DIADMN CCC[C@H](Cc1ccccc1)[N@H+](C/C=C(/C)C(=O)[O-])CCC ZINC000846244533 1050702367 /nfs/dbraw/zinc/70/23/67/1050702367.db2.gz SKOAEDPWDOOYPK-XSVZSIDJSA-N 0 1 303.446 4.141 20 0 DIADMN C/C(=C/C[N@H+](C)[C@@H](C)c1ccc(Cl)cc1Cl)C(=O)[O-] ZINC000846240828 1050702390 /nfs/dbraw/zinc/70/23/90/1050702390.db2.gz ZTUQGCNDAWMVJI-MBACFSSFSA-N 0 1 302.201 4.017 20 0 DIADMN O=C(c1ccccc1)[C@H]1CC[N@@H+](Cc2ccc3scnc3c2)C1 ZINC001144743865 1050705268 /nfs/dbraw/zinc/70/52/68/1050705268.db2.gz CKRMLTXCWGKEIN-INIZCTEOSA-N 0 1 322.433 4.001 20 0 DIADMN O=C(c1ccccc1)[C@H]1CCN(Cc2ccc3scnc3c2)C1 ZINC001144743865 1050705281 /nfs/dbraw/zinc/70/52/81/1050705281.db2.gz CKRMLTXCWGKEIN-INIZCTEOSA-N 0 1 322.433 4.001 20 0 DIADMN CC(C)COc1cccc(Nc2ccnn2-c2ccncc2)c1 ZINC001213640405 1050705769 /nfs/dbraw/zinc/70/57/69/1050705769.db2.gz XVGCRUOMDROFKK-UHFFFAOYSA-N 0 1 308.385 4.046 20 0 DIADMN C/C(=C/C[N@H+]1CCCCC[C@@H]1/C=C\c1cccs1)C(=O)[O-] ZINC000846260302 1050706636 /nfs/dbraw/zinc/70/66/36/1050706636.db2.gz XSHSNVPUCFIWDA-FWUUVJEGSA-N 0 1 305.443 4.037 20 0 DIADMN O=C([O-])Cc1ccccc1C[N@H+]1CCCCC[C@H]1c1ccco1 ZINC000846246630 1050709105 /nfs/dbraw/zinc/70/91/05/1050709105.db2.gz OTTGXNZHMNUGED-KRWDZBQOSA-N 0 1 313.397 4.024 20 0 DIADMN CC(C)(C)C1CCC(C[N@H+]2C[C@H]3CCC[C@@]3(C(=O)[O-])C2)CC1 ZINC000846283867 1050709364 /nfs/dbraw/zinc/70/93/64/1050709364.db2.gz JSEPZPUGAWGCLE-YBSITQRDSA-N 0 1 307.478 4.026 20 0 DIADMN O=C([O-])[C@@]12CCC[C@@H]1C[N@@H+](Cc1ccc(C3CCCC3)cc1)C2 ZINC000846281871 1050709490 /nfs/dbraw/zinc/70/94/90/1050709490.db2.gz RDFAWBOFKOOWNM-UYAOXDASSA-N 0 1 313.441 4.031 20 0 DIADMN CC[N@@H+](C/C=C(/C)C(=O)[O-])[C@H](C)c1cccc(C(F)(F)F)c1 ZINC000846248123 1050709759 /nfs/dbraw/zinc/70/97/59/1050709759.db2.gz FEUXLFDTPQXZGC-NXIHDVOMSA-N 0 1 315.335 4.119 20 0 DIADMN C[C@H](C(=O)Nc1ccc(F)cc1F)N1CC[C@@H](CC(C)(C)C)C1 ZINC001171230559 1050727136 /nfs/dbraw/zinc/72/71/36/1050727136.db2.gz OONFAVKWEWNQNQ-OLZOCXBDSA-N 0 1 324.415 4.050 20 0 DIADMN Fc1ccc([C@@H](Nc2ccc3ccccc3c2)c2c[nH]nn2)cc1 ZINC000788690047 1050727348 /nfs/dbraw/zinc/72/73/48/1050727348.db2.gz JSJZXXUZIFNOAZ-LJQANCHMSA-N 0 1 318.355 4.299 20 0 DIADMN Clc1ccc2c(n1)[C@@H](N[C@H]1CCCc3sccc31)CC2 ZINC000788752085 1050737402 /nfs/dbraw/zinc/73/74/02/1050737402.db2.gz UMRDYVHGDFLBIC-STQMWFEESA-N 0 1 304.846 4.451 20 0 DIADMN CCCC1(C(=O)O[C@@H](C)c2nc3ccc(Cl)cc3[nH]2)CC1 ZINC000761175139 1050741252 /nfs/dbraw/zinc/74/12/52/1050741252.db2.gz XZOFIXHDUGYSGD-JTQLQIEISA-N 0 1 306.793 4.401 20 0 DIADMN Cc1sc(CN[C@@H](C)c2ccccn2)cc1Br ZINC000227773644 1050741643 /nfs/dbraw/zinc/74/16/43/1050741643.db2.gz HXOGBXFYLBJJJW-VIFPVBQESA-N 0 1 311.248 4.065 20 0 DIADMN CCc1noc(C)c1[C@H](C)N[C@@H]1CCSc2ccccc21 ZINC000772949835 1050742982 /nfs/dbraw/zinc/74/29/82/1050742982.db2.gz VQHUBZCQEPWQDP-XHDPSFHLSA-N 0 1 302.443 4.433 20 0 DIADMN Clc1ccc2c(n1)[C@@H](NCc1ccc3ncccc3c1)CC2 ZINC000788808586 1050750702 /nfs/dbraw/zinc/75/07/02/1050750702.db2.gz XFDHHIZPWFSKKN-INIZCTEOSA-N 0 1 309.800 4.060 20 0 DIADMN Cc1cc(C2CC2)ccc1Nc1ccccc1N1CCN(C)CC1 ZINC001213864664 1050769185 /nfs/dbraw/zinc/76/91/85/1050769185.db2.gz UQYUTNJPYJJYOM-UHFFFAOYSA-N 0 1 321.468 4.368 20 0 DIADMN CCCN1Cc2cccc(NC(=O)/C(C)=C/c3ccco3)c2C1 ZINC000846854831 1050772386 /nfs/dbraw/zinc/77/23/86/1050772386.db2.gz MLQGIUZLPLWTEB-SDNWHVSQSA-N 0 1 310.397 4.047 20 0 DIADMN CSc1ccccc1[C@H](C)NCc1cnc(Cl)c(F)c1 ZINC000846889015 1050778205 /nfs/dbraw/zinc/77/82/05/1050778205.db2.gz LRLRFOCDSJLUTQ-JTQLQIEISA-N 0 1 310.825 4.447 20 0 DIADMN CC(=O)C1CCN(Cc2ccc(Cl)c3ccccc23)CC1 ZINC000846939083 1050781794 /nfs/dbraw/zinc/78/17/94/1050781794.db2.gz KXFJNVXSDGZMPX-UHFFFAOYSA-N 0 1 301.817 4.294 20 0 DIADMN CCN(Cc1ccccc1)C(=O)[C@@H](c1ccccc1)N(CC)CC ZINC000596940167 1050789254 /nfs/dbraw/zinc/78/92/54/1050789254.db2.gz FEGQDNSCMWGJIG-HXUWFJFHSA-N 0 1 324.468 4.118 20 0 DIADMN CCN(Cc1ccccc1)C(=O)[C@H](c1ccccc1)N(CC)CC ZINC000596940166 1050790012 /nfs/dbraw/zinc/79/00/12/1050790012.db2.gz FEGQDNSCMWGJIG-FQEVSTJZSA-N 0 1 324.468 4.118 20 0 DIADMN CC[C@H](Sc1nnc(C)[nH]1)c1ccc(Br)cc1 ZINC000177947206 1050795753 /nfs/dbraw/zinc/79/57/53/1050795753.db2.gz NANVXGHHYUFFND-NSHDSACASA-N 0 1 312.236 4.119 20 0 DIADMN CC[C@H](Sc1nc(C)n[nH]1)c1ccc(Br)cc1 ZINC000177947206 1050795759 /nfs/dbraw/zinc/79/57/59/1050795759.db2.gz NANVXGHHYUFFND-NSHDSACASA-N 0 1 312.236 4.119 20 0 DIADMN Fc1cccc(C2(NCc3cnc(Cl)c(F)c3)CCC2)c1 ZINC000847004096 1050797758 /nfs/dbraw/zinc/79/77/58/1050797758.db2.gz NFAOMKNYIATDLU-UHFFFAOYSA-N 0 1 308.759 4.182 20 0 DIADMN Cc1[nH]ncc1C(=O)Nc1ccc(Oc2ccccc2)cc1C ZINC000597017708 1050798337 /nfs/dbraw/zinc/79/83/37/1050798337.db2.gz VYPJHBZFOWRKNP-UHFFFAOYSA-N 0 1 307.353 4.071 20 0 DIADMN CCCCCC[C@H](C)C(=O)NCc1ccc(F)c(CN(C)C)c1 ZINC000742077051 1050801929 /nfs/dbraw/zinc/80/19/29/1050801929.db2.gz QPZROPTVTBVCRT-HNNXBMFYSA-N 0 1 322.468 4.110 20 0 DIADMN CCOc1cccc([C@@H](C)N[C@@H]2COc3c2ccc(C)c3C)c1 ZINC000772961081 1050807753 /nfs/dbraw/zinc/80/77/53/1050807753.db2.gz ZPVPAOQWXLHQFX-DNVCBOLYSA-N 0 1 311.425 4.486 20 0 DIADMN C[C@@H](NC(=O)[C@H]1CCCC1(C)C)c1nc2ccc(Cl)cc2[nH]1 ZINC000772965033 1050810873 /nfs/dbraw/zinc/81/08/73/1050810873.db2.gz VSPFBAYXXJFPNE-ZYHUDNBSSA-N 0 1 319.836 4.220 20 0 DIADMN Cc1ccc([C@H]2CCCCN2Cn2c3ccccc3oc2=O)cc1 ZINC000742157497 1050810762 /nfs/dbraw/zinc/81/07/62/1050810762.db2.gz RKAMVSMRJZQKNE-QGZVFWFLSA-N 0 1 322.408 4.088 20 0 DIADMN FC(F)(F)c1ccc2c(c1)nccc2NCc1nccs1 ZINC000180405838 1050819082 /nfs/dbraw/zinc/81/90/82/1050819082.db2.gz BWXGEPVEDMTCIX-UHFFFAOYSA-N 0 1 309.316 4.322 20 0 DIADMN Cc1cccc(-c2n[nH]cc2CNCc2c(C)cccc2F)c1 ZINC000742381597 1050825179 /nfs/dbraw/zinc/82/51/79/1050825179.db2.gz YPYOWMKZXWRDAW-UHFFFAOYSA-N 0 1 309.388 4.122 20 0 DIADMN Cc1cccc(F)c1CNCc1cc(Br)cs1 ZINC000742380951 1050825816 /nfs/dbraw/zinc/82/58/16/1050825816.db2.gz UESGCSYXXSMASR-UHFFFAOYSA-N 0 1 314.223 4.248 20 0 DIADMN Cc1ncn(C)c1Nc1cc(Cl)ccc1NC(=O)C(C)(C)C ZINC001214127753 1050827517 /nfs/dbraw/zinc/82/75/17/1050827517.db2.gz YAGRQTQQVJCPIY-UHFFFAOYSA-N 0 1 320.824 4.110 20 0 DIADMN C[C@H](NCc1cccc(F)c1F)c1cccc(-n2ccnc2)c1 ZINC000742393564 1050829165 /nfs/dbraw/zinc/82/91/65/1050829165.db2.gz YQPYACHWTJMBNG-ZDUSSCGKSA-N 0 1 313.351 4.001 20 0 DIADMN C[C@@H](NCc1ccc(F)cc1F)c1cccc(-n2ccnc2)c1 ZINC000742393220 1050829569 /nfs/dbraw/zinc/82/95/69/1050829569.db2.gz XAFSWTOAXNGKOI-CYBMUJFWSA-N 0 1 313.351 4.001 20 0 DIADMN C[C@@H](NCc1cc(F)ccc1F)c1cccc(-n2ccnc2)c1 ZINC000742393232 1050830810 /nfs/dbraw/zinc/83/08/10/1050830810.db2.gz XJEBJPTVJBHSTC-CYBMUJFWSA-N 0 1 313.351 4.001 20 0 DIADMN CN(C(=O)c1cccc2[nH]cnc21)C1CC(C)(C)CC(C)(C)C1 ZINC001146577773 1050831701 /nfs/dbraw/zinc/83/17/01/1050831701.db2.gz ZXUYOXYBNPLQLI-UHFFFAOYSA-N 0 1 313.445 4.240 20 0 DIADMN CCN(Cc1cccs1)Cc1cc(=O)oc2cc(C)ccc12 ZINC000302589122 1050838611 /nfs/dbraw/zinc/83/86/11/1050838611.db2.gz HSWJFLAEIRANAM-UHFFFAOYSA-N 0 1 313.422 4.185 20 0 DIADMN C[C@@H](N[C@H]1CCOc2ccc(F)cc21)c1ccnc(Cl)c1 ZINC000772978614 1050848959 /nfs/dbraw/zinc/84/89/59/1050848959.db2.gz PNUBDOUDBKZOPF-YGRLFVJLSA-N 0 1 306.768 4.049 20 0 DIADMN c1ccc2c(c1)COC[C@@H]2Nc1ccc2c(c1)nc1cc[nH]cc2-1 ZINC001171293187 1050852925 /nfs/dbraw/zinc/85/29/25/1050852925.db2.gz BUIQUHYXVMQOAO-FQEVSTJZSA-N 0 1 315.376 4.400 20 0 DIADMN Cc1cccc(C)c1[C@H]1CCCN1C(=O)c1[nH]nc2ccccc21 ZINC001146970912 1050853791 /nfs/dbraw/zinc/85/37/91/1050853791.db2.gz HCGIOFXXZQPYLG-QGZVFWFLSA-N 0 1 319.408 4.157 20 0 DIADMN CCCCC[C@@H](C)CC(=O)NC[C@H](c1cccs1)N(C)C ZINC000742480128 1050861833 /nfs/dbraw/zinc/86/18/33/1050861833.db2.gz KVDHIJKFSZTJOI-HUUCEWRRSA-N 0 1 310.507 4.074 20 0 DIADMN CCc1nn(C)cc1CN(C)C1c2ccccc2-c2ccccc21 ZINC000180479617 1050864624 /nfs/dbraw/zinc/86/46/24/1050864624.db2.gz DTVOUKAUEQIURO-UHFFFAOYSA-N 0 1 317.436 4.184 20 0 DIADMN C[C@@H]1CN(Cc2cn3cc(Cl)cc(Cl)c3n2)[C@@H](C)[C@H]1C ZINC001171298627 1050864487 /nfs/dbraw/zinc/86/44/87/1050864487.db2.gz USEFHFQXNLEJKX-VWYCJHECSA-N 0 1 312.244 4.117 20 0 DIADMN CCCCC[C@H](C)CC(=O)NC[C@H](c1cccc(F)c1)N(C)C ZINC000742492342 1050865122 /nfs/dbraw/zinc/86/51/22/1050865122.db2.gz YYYRIJQEWKNEQZ-MAUKXSAKSA-N 0 1 322.468 4.151 20 0 DIADMN COCCC[C@@H](NCc1ccc(Cl)o1)c1ccc(F)cc1 ZINC000669616697 1050871904 /nfs/dbraw/zinc/87/19/04/1050871904.db2.gz PUWHRRMHYOQAOD-OAHLLOKOSA-N 0 1 311.784 4.330 20 0 DIADMN c1nc2ccc(NCc3ccccc3-c3cccnc3)cc2[nH]1 ZINC001170116886 1050875945 /nfs/dbraw/zinc/87/59/45/1050875945.db2.gz ZOSHVZMXJNVNKP-UHFFFAOYSA-N 0 1 300.365 4.237 20 0 DIADMN Cc1ccc(C2=CCN(Cc3cccc4c3OCCO4)CC2)cc1 ZINC000746851506 1050877025 /nfs/dbraw/zinc/87/70/25/1050877025.db2.gz OFFIMMIVADZIDR-UHFFFAOYSA-N 0 1 321.420 4.056 20 0 DIADMN CCCCC[C@H](C)CC(=O)NC[C@@H](c1ccc(F)cc1)N(C)C ZINC000742562127 1050880542 /nfs/dbraw/zinc/88/05/42/1050880542.db2.gz SFCGGTKZYYARBJ-YJBOKZPZSA-N 0 1 322.468 4.151 20 0 DIADMN O=C(Nc1ccc2nc(C(F)F)[nH]c2c1)[C@]12C[C@H]1CCCC2 ZINC000867022219 1050885744 /nfs/dbraw/zinc/88/57/44/1050885744.db2.gz PYHWEXSJGRTJJG-JDNHERCYSA-N 0 1 305.328 4.019 20 0 DIADMN CSc1ccc(Cl)cc1NC(=O)c1nc(Cl)cs1 ZINC000789909851 1050895474 /nfs/dbraw/zinc/89/54/74/1050895474.db2.gz LBKYJZMDEHSJGQ-UHFFFAOYSA-N 0 1 319.238 4.424 20 0 DIADMN CCN(C)[C@H](C(=O)N(CC)Cc1ccc(C)cc1)c1ccccc1 ZINC000597702912 1050898105 /nfs/dbraw/zinc/89/81/05/1050898105.db2.gz JXSOCGFPUMDZCO-FQEVSTJZSA-N 0 1 324.468 4.037 20 0 DIADMN Nc1cncn1-c1c(OCc2ccccc2)ccc2ccccc21 ZINC001214415973 1050898534 /nfs/dbraw/zinc/89/85/34/1050898534.db2.gz IUDVPOLZCOQPOE-UHFFFAOYSA-N 0 1 315.376 4.187 20 0 DIADMN Cc1ccc([C@H](C)C(=O)Nc2ccc3nc(C4CCC4)[nH]c3c2)o1 ZINC000742605499 1050899811 /nfs/dbraw/zinc/89/98/11/1050899811.db2.gz VCEAFGJGTQNKLG-LBPRGKRZSA-N 0 1 323.396 4.474 20 0 DIADMN Cc1ccc([C@@H](C)C(=O)Nc2ccc3nc(C4CCC4)[nH]c3c2)o1 ZINC000742605498 1050900033 /nfs/dbraw/zinc/90/00/33/1050900033.db2.gz VCEAFGJGTQNKLG-GFCCVEGCSA-N 0 1 323.396 4.474 20 0 DIADMN COc1ccc(Cl)c2c1C[C@@H](N1CCC[C@](C)(F)C1)CC2 ZINC001171314066 1050902472 /nfs/dbraw/zinc/90/24/72/1050902472.db2.gz CGPXVCLTYMZXPI-SJCJKPOMSA-N 0 1 311.828 4.030 20 0 DIADMN CN(C)Cc1ccc(NC(=O)[C@H]2CCCCC2(C)C)cc1F ZINC000789974838 1050903230 /nfs/dbraw/zinc/90/32/30/1050903230.db2.gz ZCKRZYKLIYLSBB-OAHLLOKOSA-N 0 1 306.425 4.042 20 0 DIADMN CC(C)c1cc(Cl)ccc1NC(=O)CN1[C@H](C)CC[C@H]1C ZINC001147975324 1050911363 /nfs/dbraw/zinc/91/13/63/1050911363.db2.gz WGXSXLOXSQRBIC-CHWSQXEVSA-N 0 1 308.853 4.275 20 0 DIADMN CC[C@H](C)c1cccc(NC(=O)Cc2n[nH]c3ccccc23)c1 ZINC001148023369 1050912296 /nfs/dbraw/zinc/91/22/96/1050912296.db2.gz KPDZWJOJAZMDOG-ZDUSSCGKSA-N 0 1 307.397 4.258 20 0 DIADMN CSc1ccc(Nc2ccnc(CO)c2)cc1C(F)(F)F ZINC001214468992 1050914400 /nfs/dbraw/zinc/91/44/00/1050914400.db2.gz TVCZMWAOFXMXCF-UHFFFAOYSA-N 0 1 314.332 4.058 20 0 DIADMN CCCc1cc(C(=O)N(C)[C@@H](c2ccccc2C)C(C)C)n[nH]1 ZINC000602209537 1050914730 /nfs/dbraw/zinc/91/47/30/1050914730.db2.gz JCBFTVAJMGEYSW-GOSISDBHSA-N 0 1 313.445 4.140 20 0 DIADMN CCCC[C@@H](CC)CCCN(C)C(=O)c1ccc2[nH]nnc2c1 ZINC001148041687 1050916378 /nfs/dbraw/zinc/91/63/78/1050916378.db2.gz OVQBVKSTSJLLIW-CQSZACIVSA-N 0 1 316.449 4.027 20 0 DIADMN CSc1cc(-n2c(N)nc3ccccc32)cc(C(F)(F)F)c1 ZINC001214499063 1050926083 /nfs/dbraw/zinc/92/60/83/1050926083.db2.gz TZTDNFXDWYXOTQ-UHFFFAOYSA-N 0 1 323.343 4.348 20 0 DIADMN C[C@@H]1CCC[C@H](C)N1C(=O)c1cc(-c2cccc(Cl)c2)[nH]n1 ZINC001148422417 1050941755 /nfs/dbraw/zinc/94/17/55/1050941755.db2.gz UMWRQZNHDLXUMN-TXEJJXNPSA-N 0 1 317.820 4.133 20 0 DIADMN Cc1ncn(-c2c(Cl)ccc(C(F)(F)F)c2Cl)c1N ZINC001214567592 1050946909 /nfs/dbraw/zinc/94/69/09/1050946909.db2.gz NHNJSNDYGKCXPF-UHFFFAOYSA-N 0 1 310.106 4.089 20 0 DIADMN CCCCC[C@@H]1CCCCN1C(=O)[C@H]1c2cn[nH]c2CC[C@H]1C ZINC001148506315 1050950513 /nfs/dbraw/zinc/95/05/13/1050950513.db2.gz XFLMCZVFFIEWNV-IIDMSEBBSA-N 0 1 317.477 4.037 20 0 DIADMN CCC(CC)[C@H](C)C(=O)NC[C@H](c1ccc(Cl)cc1)N(C)C ZINC001148652904 1050957947 /nfs/dbraw/zinc/95/79/47/1050957947.db2.gz HPTMKLUGWKQHOF-SUMWQHHRSA-N 0 1 324.896 4.131 20 0 DIADMN Cc1cccc2c1CCC[C@@H]2NC(=O)c1ccc(O)c(Cl)c1 ZINC001148775789 1050973713 /nfs/dbraw/zinc/97/37/13/1050973713.db2.gz LLIYBTMKMTXNAY-INIZCTEOSA-N 0 1 315.800 4.161 20 0 DIADMN CC[C@H](C)Oc1cc(C)ccc1CN[C@@H](C)c1c[nH]nc1C ZINC000180755245 1050981617 /nfs/dbraw/zinc/98/16/17/1050981617.db2.gz XGJKGQQCNYMJLK-KBPBESRZSA-N 0 1 301.434 4.055 20 0 DIADMN COCC[C@H](NCc1ccoc1)c1ccc(Cl)c(Cl)c1 ZINC000790614979 1050981561 /nfs/dbraw/zinc/98/15/61/1050981561.db2.gz RIJAVRZJASDERG-HNNXBMFYSA-N 0 1 314.212 4.454 20 0 DIADMN Cc1n[nH]cc1[C@H](C)N[C@H](c1ccccc1F)C1CCCC1 ZINC000180752326 1050982314 /nfs/dbraw/zinc/98/23/14/1050982314.db2.gz AHRNNVDFTMTMFJ-SGTLLEGYSA-N 0 1 301.409 4.439 20 0 DIADMN Cc1n[nH]cc1[C@@H](C)N[C@H](c1ccccc1F)C1CCCC1 ZINC000180752310 1050982971 /nfs/dbraw/zinc/98/29/71/1050982971.db2.gz AHRNNVDFTMTMFJ-XIKOKIGWSA-N 0 1 301.409 4.439 20 0 DIADMN CO[C@H](C)c1nc(CN[C@H](C)Cc2cccc(Cl)c2)cs1 ZINC000282724649 1050989428 /nfs/dbraw/zinc/98/94/28/1050989428.db2.gz SBSVICZFKKLBQT-VXGBXAGGSA-N 0 1 324.877 4.225 20 0 DIADMN Fc1ccc(-c2nc(CN3CCCC4(CCC4)C3)co2)cc1 ZINC000348193196 1050997698 /nfs/dbraw/zinc/99/76/98/1050997698.db2.gz LVSMXLRMEWQFSV-UHFFFAOYSA-N 0 1 300.377 4.247 20 0 DIADMN Fc1cccc(-c2nc(CN3CCCC4(CCC4)C3)co2)c1 ZINC000348192644 1050997891 /nfs/dbraw/zinc/99/78/91/1050997891.db2.gz IODJBYAZVDNUEX-UHFFFAOYSA-N 0 1 300.377 4.247 20 0 DIADMN COc1cc(CN2CCSC[C@H]2C2CCC2)ccc1Cl ZINC001171343534 1050998171 /nfs/dbraw/zinc/99/81/71/1050998171.db2.gz JJJXNUVHXUDYLD-HNNXBMFYSA-N 0 1 311.878 4.066 20 0 DIADMN COC[C@@H](N[C@@H]1CCSc2c(F)cccc21)c1ccccc1 ZINC000180841727 1050998495 /nfs/dbraw/zinc/99/84/95/1050998495.db2.gz QRITZJGBWJFHRB-IAGOWNOFSA-N 0 1 317.429 4.340 20 0 DIADMN COc1ccc(-c2cnc(CN3CCCC4(CCC4)C3)o2)cc1 ZINC000348167053 1050998863 /nfs/dbraw/zinc/99/88/63/1050998863.db2.gz IMJCAQBSMHJLOZ-UHFFFAOYSA-N 0 1 312.413 4.116 20 0 DIADMN Clc1ccc(OC2CCN(Cc3ccsc3)CC2)cc1 ZINC001204034363 1050999276 /nfs/dbraw/zinc/99/92/76/1050999276.db2.gz DZBRYWKQLQQRSE-UHFFFAOYSA-N 0 1 307.846 4.445 20 0 DIADMN Fc1ccc([C@@H](NC[C@@H]2CCCC(F)(F)C2)c2ncc[nH]2)cc1 ZINC000282784612 1051000666 /nfs/dbraw/zinc/00/06/66/1051000666.db2.gz PTZQOQWMNYAZPB-IUODEOHRSA-N 0 1 323.362 4.053 20 0 DIADMN Cc1cc(C)c(NC(=O)[C@@H](C)N2CCCC3(CCC3)C2)c(C)c1 ZINC000348185007 1051000712 /nfs/dbraw/zinc/00/07/12/1051000712.db2.gz XXDNLUNTAZPHEL-QGZVFWFLSA-N 0 1 314.473 4.205 20 0 DIADMN CCc1cccnc1[C@H](C)N[C@@H](CCO)c1ccc(Cl)cc1 ZINC000348198664 1051004769 /nfs/dbraw/zinc/00/47/69/1051004769.db2.gz OSQYFYQEFFIPIW-GUYCJALGSA-N 0 1 318.848 4.072 20 0 DIADMN Cc1ccc([C@H](O)CN(C)Cc2ccc(Cl)cc2Cl)cc1 ZINC000743249652 1051004700 /nfs/dbraw/zinc/00/47/00/1051004700.db2.gz JJOCUCDFOBGCBE-QGZVFWFLSA-N 0 1 324.251 4.467 20 0 DIADMN CC1(C)C(=O)Nc2cc(Nc3ccc(Cl)c(O)c3F)ccc21 ZINC001214803846 1051006226 /nfs/dbraw/zinc/00/62/26/1051006226.db2.gz IHBXMIUJVMRRIH-UHFFFAOYSA-N 0 1 320.751 4.158 20 0 DIADMN COC(=O)c1ccc(C)cc1Nc1ccc(Cl)c(O)c1F ZINC001214801441 1051006453 /nfs/dbraw/zinc/00/64/53/1051006453.db2.gz KLRJKUGBDDAHHQ-UHFFFAOYSA-N 0 1 309.724 4.023 20 0 DIADMN CCOC(=O)Nc1ccc(Nc2ccc(Cl)c(O)c2F)cc1 ZINC001214804401 1051006718 /nfs/dbraw/zinc/00/67/18/1051006718.db2.gz RKUXENCVSMMBHV-UHFFFAOYSA-N 0 1 324.739 4.497 20 0 DIADMN COC(=O)CCc1ccc(Nc2ccc(Cl)c(O)c2F)cc1 ZINC001214804297 1051007814 /nfs/dbraw/zinc/00/78/14/1051007814.db2.gz PILXXZWEOUTYNE-UHFFFAOYSA-N 0 1 323.751 4.034 20 0 DIADMN COc1ccc(F)c(F)c1Nc1ccc(Cl)c(O)c1F ZINC001214802088 1051008126 /nfs/dbraw/zinc/00/81/26/1051008126.db2.gz VJSJRUDFDBXFLV-UHFFFAOYSA-N 0 1 303.667 4.215 20 0 DIADMN O=c1ccc2cc(Nc3ccc(Cl)c(O)c3F)ccc2o1 ZINC001214807112 1051010153 /nfs/dbraw/zinc/01/01/53/1051010153.db2.gz SXZDAPNECDGDSJ-UHFFFAOYSA-N 0 1 305.692 4.035 20 0 DIADMN CC[C@@](C)(NCc1nccn1-c1ccccc1)c1ccccc1 ZINC000790961542 1051010454 /nfs/dbraw/zinc/01/04/54/1051010454.db2.gz XEQUEIIIGDRTBQ-HXUWFJFHSA-N 0 1 305.425 4.287 20 0 DIADMN C[C@@H]1C(=O)N(CN(C)CCC2CCCCC2)[C@H]1c1ccccc1 ZINC000743360062 1051017693 /nfs/dbraw/zinc/01/76/93/1051017693.db2.gz JTMVSBSHGXABID-QFBILLFUSA-N 0 1 314.473 4.066 20 0 DIADMN CCC1CCC(N(C)CN2C(=O)[C@@H](C)[C@@H]2c2ccccc2)CC1 ZINC000743355335 1051018604 /nfs/dbraw/zinc/01/86/04/1051018604.db2.gz CDYPWBSLWWVLCU-NHFHULPWSA-N 0 1 314.473 4.064 20 0 DIADMN O[C@@H](CNCc1ccsc1Cl)c1ccc(Cl)c(F)c1 ZINC000790981876 1051021423 /nfs/dbraw/zinc/02/14/23/1051021423.db2.gz ZNVMKVMAPPXTML-LBPRGKRZSA-N 0 1 320.216 4.017 20 0 DIADMN CC(=Cc1ccc(C)cc1)C(=O)Nc1cc2cn[nH]c2cc1C ZINC000791057320 1051024208 /nfs/dbraw/zinc/02/42/08/1051024208.db2.gz QZOKEWCZJFRSRW-ZSOIEALJSA-N 0 1 305.381 4.222 20 0 DIADMN CC(=CC(=O)Nc1cc2cn[nH]c2cc1C)c1ccc(F)cc1 ZINC000791057134 1051024981 /nfs/dbraw/zinc/02/49/81/1051024981.db2.gz LPSHYUKZBUMSHE-DHZHZOJOSA-N 0 1 309.344 4.052 20 0 DIADMN Cc1cc2[nH]ncc2cc1NC(=O)C=Cc1ccc(Cl)cc1 ZINC000791054303 1051025228 /nfs/dbraw/zinc/02/52/28/1051025228.db2.gz DCQLITGYOZFNSA-DAXSKMNVSA-N 0 1 311.772 4.177 20 0 DIADMN CCC[C@]1(C)CCCN(CN2C(=O)[C@H](C)[C@H]2c2ccccc2)C1 ZINC000743404972 1051026607 /nfs/dbraw/zinc/02/66/07/1051026607.db2.gz DBGSRVQNDNWDBR-IMFGXOCKSA-N 0 1 314.473 4.066 20 0 DIADMN Cc1c(CN[C@@H](C)c2ccccc2SC(C)(C)C)cnn1C ZINC000791134860 1051032160 /nfs/dbraw/zinc/03/21/60/1051032160.db2.gz FNPYPMDXSSAGIF-ZDUSSCGKSA-N 0 1 317.502 4.470 20 0 DIADMN CC(C)CCCCN[C@H](C)c1nc(Cc2ccccc2)no1 ZINC000743477053 1051037189 /nfs/dbraw/zinc/03/71/89/1051037189.db2.gz FDKWKRWUFSGSLT-OAHLLOKOSA-N 0 1 301.434 4.137 20 0 DIADMN C[C@@H](N[C@H](C)c1cccc(OC(F)(F)F)c1)c1cncs1 ZINC000773043939 1051038041 /nfs/dbraw/zinc/03/80/41/1051038041.db2.gz OJRGZYKKJJMRRW-NXEZZACHSA-N 0 1 316.348 4.454 20 0 DIADMN C[C@H](CSC(C)(C)C)NCc1c(F)c(F)cc(F)c1F ZINC000773044395 1051038523 /nfs/dbraw/zinc/03/85/23/1051038523.db2.gz GPQQJXRHCVARGP-MRVPVSSYSA-N 0 1 309.372 4.253 20 0 DIADMN COc1ccc(CN[C@H](C)c2nc3ccccc3s2)c(C)c1 ZINC000773053780 1051040919 /nfs/dbraw/zinc/04/09/19/1051040919.db2.gz SJYYFLUAYQAXCW-CYBMUJFWSA-N 0 1 312.438 4.464 20 0 DIADMN CC(C)c1nc2c(ncnc2NCc2cccc3sccc32)[nH]1 ZINC001171378254 1051048633 /nfs/dbraw/zinc/04/86/33/1051048633.db2.gz ZPIALGKMOJPQBF-UHFFFAOYSA-N 0 1 323.425 4.303 20 0 DIADMN Cc1cccc(C)c1CN[C@@H](C)c1nc2c(s1)CCCC2 ZINC000773069524 1051051078 /nfs/dbraw/zinc/05/10/78/1051051078.db2.gz TXUXIQDXKBDAAZ-AWEZNQCLSA-N 0 1 300.471 4.490 20 0 DIADMN ClC1(Cl)C[C@@H]1CNCc1csc(-c2ccccc2)n1 ZINC000743654502 1051053136 /nfs/dbraw/zinc/05/31/36/1051053136.db2.gz ZRFBLBOJHIQSJQ-LLVKDONJSA-N 0 1 313.253 4.094 20 0 DIADMN Fc1cccc(CN[C@H]2CCCCc3ccc(Cl)cc32)n1 ZINC000773089505 1051056946 /nfs/dbraw/zinc/05/69/46/1051056946.db2.gz RCSLHVWKRULODR-INIZCTEOSA-N 0 1 304.796 4.431 20 0 DIADMN C[C@H](NCc1cccc(F)n1)c1cccc(-c2ccncc2)c1 ZINC000773091371 1051058647 /nfs/dbraw/zinc/05/86/47/1051058647.db2.gz WQKNZPMMXQDLTK-AWEZNQCLSA-N 0 1 307.372 4.134 20 0 DIADMN C[C@H](NCc1cccc(F)n1)c1ccc(SC(F)F)cc1 ZINC000773091353 1051059409 /nfs/dbraw/zinc/05/94/09/1051059409.db2.gz WKXZKOPQGHYSCF-JTQLQIEISA-N 0 1 312.360 4.386 20 0 DIADMN Fc1cc(F)c2c(c1)C[C@H](N1CCC[C@@H](C(F)(F)F)C1)CC2 ZINC001171382254 1051061161 /nfs/dbraw/zinc/06/11/61/1051061161.db2.gz YNHCARXUOTUIKM-DGCLKSJQSA-N 0 1 319.317 4.096 20 0 DIADMN CCc1ccc([C@H](C)N[C@H](C)c2cc(C)c(C(=O)OC)o2)cc1 ZINC000181450097 1051062207 /nfs/dbraw/zinc/06/22/07/1051062207.db2.gz UBADIELBGGUXBS-UONOGXRCSA-N 0 1 315.413 4.349 20 0 DIADMN Fc1cccc(CC2CCN(Cc3cccc(Cl)n3)CC2)c1 ZINC000743841525 1051066600 /nfs/dbraw/zinc/06/66/00/1051066600.db2.gz UVJFDCMLCANWJL-UHFFFAOYSA-N 0 1 318.823 4.329 20 0 DIADMN Cc1ccc([C@@H](NC[C@H]2CC2(Cl)Cl)c2ccccn2)cc1 ZINC000791638050 1051068647 /nfs/dbraw/zinc/06/86/47/1051068647.db2.gz KFUMJWVONVVGAJ-GDBMZVCRSA-N 0 1 321.251 4.263 20 0 DIADMN COC[C@H](N[C@H](C)c1ccc[nH]1)c1cccc(C(F)(F)F)c1 ZINC000773121561 1051069914 /nfs/dbraw/zinc/06/99/14/1051069914.db2.gz RXFVXNPIJRDOKM-ABAIWWIYSA-N 0 1 312.335 4.072 20 0 DIADMN C[C@@H]1CO[C@H](c2ccccc2)[C@H](C)N1Cc1ccccc1N(C)C ZINC000743849319 1051071503 /nfs/dbraw/zinc/07/15/03/1051071503.db2.gz NNLOMVMAFYNLKD-WWMYMODYSA-N 0 1 324.468 4.103 20 0 DIADMN C[C@@H]1CO[C@@H](c2ccccc2)[C@H](C)N1Cc1ccccc1N(C)C ZINC000743849316 1051071631 /nfs/dbraw/zinc/07/16/31/1051071631.db2.gz NNLOMVMAFYNLKD-LLGFUMIMSA-N 0 1 324.468 4.103 20 0 DIADMN C[C@@H]1CN(Cc2cccc(Cl)n2)CC[C@@H]1c1ccccc1 ZINC000743850100 1051073817 /nfs/dbraw/zinc/07/38/17/1051073817.db2.gz FWJGKYMKISSXPK-PBHICJAKSA-N 0 1 300.833 4.361 20 0 DIADMN Cc1cccc(-c2nnc([C@@H](C)N3CCC(C(C)C)CC3)o2)c1 ZINC000743852409 1051074168 /nfs/dbraw/zinc/07/41/68/1051074168.db2.gz YRNDBKYSZDDGJW-OAHLLOKOSA-N 0 1 313.445 4.474 20 0 DIADMN Fc1ccc2c(c1)CN([C@H]1CCc3c(F)cc(F)cc3C1)CC2 ZINC001171389349 1051075402 /nfs/dbraw/zinc/07/54/02/1051075402.db2.gz SENSNDYHXGYLGM-KRWDZBQOSA-N 0 1 317.354 4.020 20 0 DIADMN CC[C@@H](Cc1ccc(C)cc1)N(CC)Cc1ncc(Cl)n1C ZINC000743856319 1051079117 /nfs/dbraw/zinc/07/91/17/1051079117.db2.gz BKIOTZPMDNJCRV-INIZCTEOSA-N 0 1 319.880 4.225 20 0 DIADMN Cc1ccc([C@H]2CCC[C@@H]2N(C)Cc2ncc(Cl)n2C)cc1 ZINC000743856896 1051079805 /nfs/dbraw/zinc/07/98/05/1051079805.db2.gz KJKMIRMFDFKHFD-CVEARBPZSA-N 0 1 317.864 4.150 20 0 DIADMN CCCN(Cc1ccc(OC)cc1)Cc1cccc(Cl)n1 ZINC000743843161 1051082174 /nfs/dbraw/zinc/08/21/74/1051082174.db2.gz SSUYIORNODYDIP-UHFFFAOYSA-N 0 1 304.821 4.156 20 0 DIADMN C[C@@H](c1nnc(-c2cccs2)o1)N1CCC2(CCCC2)C1 ZINC000743864272 1051086216 /nfs/dbraw/zinc/08/62/16/1051086216.db2.gz ZBERDUNCUXHVQI-LBPRGKRZSA-N 0 1 303.431 4.125 20 0 DIADMN CC(C)c1nc([C@H](C)N[C@H]2CCc3ccccc3OC2)cs1 ZINC000510957748 1051086871 /nfs/dbraw/zinc/08/68/71/1051086871.db2.gz IXXRUXUKZZYOBI-ZFWWWQNUSA-N 0 1 316.470 4.311 20 0 DIADMN CCOc1ccc(Br)cc1N[C@@H](C)c1cn[nH]c1C ZINC000181191124 1051088123 /nfs/dbraw/zinc/08/81/23/1051088123.db2.gz VBHQQKXRZJSGKC-VIFPVBQESA-N 0 1 324.222 4.052 20 0 DIADMN COc1ccc(-c2noc(-c3cc(Cl)ccc3O)n2)c(C)c1 ZINC001215151609 1051089828 /nfs/dbraw/zinc/08/98/28/1051089828.db2.gz FKVRADBBSYODKO-UHFFFAOYSA-N 0 1 316.744 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Fc1ccc(O[C@@H]2CCC[N@@H+](Cc3ccccc3F)C2)cc1 ZINC001225248096 1052762692 /nfs/dbraw/zinc/76/26/92/1052762692.db2.gz IWTDTAJTWKJHHU-QGZVFWFLSA-N 0 1 303.352 4.008 20 0 DIADMN Fc1ccc(O[C@@H]2CCCN(Cc3ccccc3F)C2)cc1 ZINC001225248096 1052762694 /nfs/dbraw/zinc/76/26/94/1052762694.db2.gz IWTDTAJTWKJHHU-QGZVFWFLSA-N 0 1 303.352 4.008 20 0 DIADMN Cc1ccc(O[C@H]2CCC[N@H+]([C@@H](C)c3ccccn3)C2)cc1C ZINC001225246380 1052762893 /nfs/dbraw/zinc/76/28/93/1052762893.db2.gz WXWRPZDBHBUPLO-HKUYNNGSSA-N 0 1 310.441 4.303 20 0 DIADMN C[C@@H](OC(=O)c1cc(-c2ccco2)n[nH]1)c1ccc(Cl)cc1 ZINC000917941949 1052764936 /nfs/dbraw/zinc/76/49/36/1052764936.db2.gz HIZVGGDPNJRZHM-SNVBAGLBSA-N 0 1 316.744 4.241 20 0 DIADMN CCC[C@H](N[C@H](C)c1ccc(CC)cc1)c1nnc2ccccn21 ZINC000129011977 1052765805 /nfs/dbraw/zinc/76/58/05/1052765805.db2.gz XTRKRGANMLRFDQ-QAPCUYQASA-N 0 1 322.456 4.484 20 0 DIADMN CCN1CCC[C@@H](Oc2cc(C(F)(F)F)ccc2Cl)C1 ZINC001225324254 1052773946 /nfs/dbraw/zinc/77/39/46/1052773946.db2.gz 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/nfs/dbraw/zinc/80/13/50/1052801350.db2.gz DOXBMHFSXQZUFE-UHFFFAOYSA-N 0 1 306.365 4.051 20 0 DIADMN Cc1ccc(-c2cc(C(=O)OCc3cc4ccccc4o3)[nH]n2)o1 ZINC000918500265 1052801512 /nfs/dbraw/zinc/80/15/12/1052801512.db2.gz CVCARIGEWCBLAT-UHFFFAOYSA-N 0 1 322.320 4.081 20 0 DIADMN C[C@@H]1CCN(Cc2ccccc2)C[C@H]1Oc1cccnc1Cl ZINC001225581602 1052804864 /nfs/dbraw/zinc/80/48/64/1052804864.db2.gz JZDRGVONRDEZCF-RHSMWYFYSA-N 0 1 316.832 4.024 20 0 DIADMN C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1Oc1ccccc1[S-] ZINC001225587449 1052805516 /nfs/dbraw/zinc/80/55/16/1052805516.db2.gz KOHLPRWRDZCEKB-WBVHZDCISA-N 0 1 313.466 4.265 20 0 DIADMN Fc1ccc([C@H](Nc2csc3ccccc23)c2nnc[nH]2)cc1 ZINC000556168769 1052814503 /nfs/dbraw/zinc/81/45/03/1052814503.db2.gz YGSTZABRJPFXMU-INIZCTEOSA-N 0 1 324.384 4.360 20 0 DIADMN CO[C@H](c1ccccc1Cl)[C@@H](C)N[C@@H](C)c1ccncc1F ZINC000556172846 1052816213 /nfs/dbraw/zinc/81/62/13/1052816213.db2.gz ARXNQMWLSJNTEG-JKDFXYPNSA-N 0 1 322.811 4.301 20 0 DIADMN CCN(CC)Cc1ccc(C(=O)N(C)c2ccc(C)c(C)c2)o1 ZINC000918702364 1052824694 /nfs/dbraw/zinc/82/46/94/1052824694.db2.gz NVBVPCRGORMREU-UHFFFAOYSA-N 0 1 314.429 4.015 20 0 DIADMN CC1=CC[C@H](Nc2cccc(CN3C[C@H](C)O[C@@H](C)C3)c2)CC1 ZINC000556254217 1052827566 /nfs/dbraw/zinc/82/75/66/1052827566.db2.gz PLAMYVURDRPBQF-LNLFQRSKSA-N 0 1 314.473 4.207 20 0 DIADMN Cc1c([C@H](C)N[C@@H]2CCC[C@@H]2F)cnn1-c1cccc(Cl)c1 ZINC000556253299 1052827914 /nfs/dbraw/zinc/82/79/14/1052827914.db2.gz PXCPECXLBJADNX-MZPVMMEZSA-N 0 1 321.827 4.375 20 0 DIADMN O=C(c1c(O)cccc1F)N1CC2(CC=CC2)[C@@H]1c1ccccc1 ZINC000649154634 1052831847 /nfs/dbraw/zinc/83/18/47/1052831847.db2.gz RLVOBGVRUNUFFH-SFHVURJKSA-N 0 1 323.367 4.065 20 0 DIADMN C[C@H]1CN(Cc2ccccc2)C[C@@H]1Oc1c(F)cc(F)cc1F ZINC001225929212 1052849559 /nfs/dbraw/zinc/84/95/59/1052849559.db2.gz GKGPUXGHTGQYEC-SJCJKPOMSA-N 0 1 321.342 4.003 20 0 DIADMN Fc1cc(F)c(O[C@H]2CCCN(Cc3ccccc3)C2)c(F)c1 ZINC001225934410 1052849592 /nfs/dbraw/zinc/84/95/92/1052849592.db2.gz 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302.443 4.053 20 0 DIADMN FC(F)(F)c1ccc(C2(NCc3cncs3)CCC2)cc1 ZINC000621351370 1053964071 /nfs/dbraw/zinc/96/40/71/1053964071.db2.gz PIRQTLBVEXFCRI-UHFFFAOYSA-N 0 1 312.360 4.331 20 0 DIADMN CCCc1ccc(CNCc2cccc(C(F)(F)F)n2)s1 ZINC000621358870 1053965370 /nfs/dbraw/zinc/96/53/70/1053965370.db2.gz XTIXHLPMSXZJPK-UHFFFAOYSA-N 0 1 314.376 4.404 20 0 DIADMN Fc1cccc([C@H]2CCCN2Cc2cnc(-c3cccnc3)o2)c1 ZINC001232134610 1053967340 /nfs/dbraw/zinc/96/73/40/1053967340.db2.gz FLUDUYZYAIBUGZ-GOSISDBHSA-N 0 1 323.371 4.213 20 0 DIADMN CC1(C)CN(Cc2cnc(-c3cccnc3)o2)Cc2ccccc21 ZINC001232132956 1053967520 /nfs/dbraw/zinc/96/75/20/1053967520.db2.gz BXNOQUCWSDPKJU-UHFFFAOYSA-N 0 1 319.408 4.030 20 0 DIADMN FC(F)(F)c1cnccc1NCC1CCc2ccccc2CC1 ZINC001472842645 1053970798 /nfs/dbraw/zinc/97/07/98/1053970798.db2.gz VSDKYIBOYCTHSW-UHFFFAOYSA-N 0 1 320.358 4.129 20 0 DIADMN CN(CCC1CC1)Cc1c(Br)[nH]c2ccccc21 ZINC001232144221 1053973192 /nfs/dbraw/zinc/97/31/92/1053973192.db2.gz MCCYRTUZHPKIJI-UHFFFAOYSA-N 0 1 307.235 4.162 20 0 DIADMN COc1ccnc(Cl)c1CN1CC[C@@H](C2CCCCC2)C1 ZINC001232154214 1053975393 /nfs/dbraw/zinc/97/53/93/1053975393.db2.gz KCJMCNARJQRKLG-CQSZACIVSA-N 0 1 308.853 4.146 20 0 DIADMN CCN(Cc1ncc(C)cc1Br)C1CCCCC1 ZINC001232172586 1053978976 /nfs/dbraw/zinc/97/89/76/1053978976.db2.gz FBKXULJBZVZJIR-UHFFFAOYSA-N 0 1 311.267 4.307 20 0 DIADMN Cc1cnc(CN2CCC[C@@H](C)[C@@H](C)C2)c(Br)c1 ZINC001232172511 1053979278 /nfs/dbraw/zinc/97/92/78/1053979278.db2.gz HTSJWBSAOMSTQJ-OLZOCXBDSA-N 0 1 311.267 4.021 20 0 DIADMN CCN(Cc1ccc(NC(C)=O)cc1C)Cc1ccccc1F ZINC001232187670 1053982642 /nfs/dbraw/zinc/98/26/42/1053982642.db2.gz PYUWBTITKDLXBF-UHFFFAOYSA-N 0 1 314.404 4.115 20 0 DIADMN CCC(O)(CC)CNCc1csc(-c2ccc(Cl)cc2)n1 ZINC000621564208 1053983171 /nfs/dbraw/zinc/98/31/71/1053983171.db2.gz POADHHMGIFVREQ-UHFFFAOYSA-N 0 1 324.877 4.104 20 0 DIADMN c1cc(CN(Cc2ccccc2)C2CCSCC2)sn1 ZINC001232193386 1053983647 /nfs/dbraw/zinc/98/36/47/1053983647.db2.gz CTDQHKRIIMWGIL-UHFFFAOYSA-N 0 1 304.484 4.041 20 0 DIADMN Fc1cccc(Cl)c1CC1CCN(Cc2ccns2)CC1 ZINC001232192232 1053984032 /nfs/dbraw/zinc/98/40/32/1053984032.db2.gz YPFYFINQTLIPDJ-UHFFFAOYSA-N 0 1 324.852 4.390 20 0 DIADMN FC(F)(F)c1cnccc1N1CCC(Nc2ccccc2)CC1 ZINC001329348884 1053984461 /nfs/dbraw/zinc/98/44/61/1053984461.db2.gz JLVBBLHHGSNOEZ-UHFFFAOYSA-N 0 1 321.346 4.181 20 0 DIADMN Clc1ccc(-c2ccccc2CN2C[C@H]3CC[C@@H](C2)O3)cc1 ZINC001232196176 1053985649 /nfs/dbraw/zinc/98/56/49/1053985649.db2.gz YFRFNYNMNFVTEX-HDICACEKSA-N 0 1 313.828 4.370 20 0 DIADMN Cc1scnc1CN1CCC[C@H](CCc2ccccc2)C1 ZINC001232205116 1053987456 /nfs/dbraw/zinc/98/74/56/1053987456.db2.gz HEYHSTNNQILKAX-QGZVFWFLSA-N 0 1 300.471 4.296 20 0 DIADMN Fc1cccc2c(CN3CCC[C@H]3c3ccncc3)ccnc12 ZINC001232208132 1053989295 /nfs/dbraw/zinc/98/92/95/1053989295.db2.gz DOCAKOXDNONBFW-SFHVURJKSA-N 0 1 307.372 4.106 20 0 DIADMN Cc1scnc1CN1CCC[C@@H](Cc2ccc(F)cc2)C1 ZINC001232213134 1053992422 /nfs/dbraw/zinc/99/24/22/1053992422.db2.gz XAYAADBBMFSTQO-HNNXBMFYSA-N 0 1 304.434 4.045 20 0 DIADMN CC(C)(C)c1cc(CN2CCC3(CCC(=O)CC3)CC2)ccn1 ZINC001232220638 1053995278 /nfs/dbraw/zinc/99/52/78/1053995278.db2.gz OGEKDUOQIZIJFU-UHFFFAOYSA-N 0 1 314.473 4.104 20 0 DIADMN FC(F)(F)C1CCN(Cc2cccn2Cc2ccccc2)CC1 ZINC001232234906 1053997794 /nfs/dbraw/zinc/99/77/94/1053997794.db2.gz DPUOZOSUYOTJDD-UHFFFAOYSA-N 0 1 322.374 4.311 20 0 DIADMN COc1cccc(CN(C)Cc2cccn2Cc2ccccc2)c1 ZINC001232231413 1053998012 /nfs/dbraw/zinc/99/80/12/1053998012.db2.gz BJNKCWFNUYBAHH-UHFFFAOYSA-N 0 1 320.436 4.177 20 0 DIADMN COc1ccc2c(c1)C[N@H+](Cc1nccc3ccccc31)CCC2 ZINC001232249523 1054001479 /nfs/dbraw/zinc/00/14/79/1054001479.db2.gz KUNOCWPNGZJYTQ-UHFFFAOYSA-N 0 1 318.420 4.192 20 0 DIADMN Fc1ccc(O[C@@H]2CC[N@@H+](Cc3nccc4ccccc43)C2)cc1 ZINC001232249276 1054001783 /nfs/dbraw/zinc/00/17/83/1054001783.db2.gz JWNWPQFRYGOXQO-GOSISDBHSA-N 0 1 322.383 4.027 20 0 DIADMN c1ccc2c(c1)ccnc2CN1CCSc2ccccc2C1 ZINC001232250447 1054003400 /nfs/dbraw/zinc/00/34/00/1054003400.db2.gz YHAIXJWJNQTMKE-UHFFFAOYSA-N 0 1 306.434 4.343 20 0 DIADMN c1ccc2c(c1)ccnc2C[N@H+]1CCOC[C@@H]1C1CCCCC1 ZINC001232249106 1054004185 /nfs/dbraw/zinc/00/41/85/1054004185.db2.gz HBJPNFYXBSLJGC-HXUWFJFHSA-N 0 1 310.441 4.016 20 0 DIADMN c1ccc2c(c1)ccnc2CN1CCOC[C@@H]1C1CCCCC1 ZINC001232249106 1054004195 /nfs/dbraw/zinc/00/41/95/1054004195.db2.gz HBJPNFYXBSLJGC-HXUWFJFHSA-N 0 1 310.441 4.016 20 0 DIADMN Cc1nccnc1[C@@H](C)N[C@@H]1CCCc2c(Cl)cccc21 ZINC001329703880 1054004209 /nfs/dbraw/zinc/00/42/09/1054004209.db2.gz XWMVDYCHGHIEHS-MLGOLLRUSA-N 0 1 301.821 4.167 20 0 DIADMN COCc1cccc(CN(C)[C@H](C)c2ccc(Cl)cc2)n1 ZINC001232256959 1054005433 /nfs/dbraw/zinc/00/54/33/1054005433.db2.gz GJCZJCUZWLBDRR-CYBMUJFWSA-N 0 1 304.821 4.074 20 0 DIADMN COc1cc(CN2CC(Cc3ccsc3)C2)ccc1SC ZINC000621741442 1054006229 /nfs/dbraw/zinc/00/62/29/1054006229.db2.gz RRFLZRSLSLAGJL-UHFFFAOYSA-N 0 1 319.495 4.153 20 0 DIADMN COCc1cccc(CN(C)[C@@H](C)c2ccc(Cl)cc2)n1 ZINC001232256960 1054006431 /nfs/dbraw/zinc/00/64/31/1054006431.db2.gz GJCZJCUZWLBDRR-ZDUSSCGKSA-N 0 1 304.821 4.074 20 0 DIADMN Fc1cccc(Cl)c1CCN[C@H]1CCCc2scnc21 ZINC001329744845 1054006881 /nfs/dbraw/zinc/00/68/81/1054006881.db2.gz FLYXFFUOAOHONE-ZDUSSCGKSA-N 0 1 310.825 4.145 20 0 DIADMN Clc1cnc2oc(CN3CC(Cc4ccsc4)C3)cc2c1 ZINC000621741409 1054007112 /nfs/dbraw/zinc/00/71/12/1054007112.db2.gz QNHFEMRKRVJAGB-UHFFFAOYSA-N 0 1 318.829 4.217 20 0 DIADMN COCc1cccc(CN(Cc2cccc(C)c2C)C2CC2)n1 ZINC001232259074 1054008019 /nfs/dbraw/zinc/00/80/19/1054008019.db2.gz REXTYFHHPODWGV-UHFFFAOYSA-N 0 1 310.441 4.009 20 0 DIADMN COc1ccc(F)c(CN[C@@H](CC(C)C)c2ccncc2)c1 ZINC000621766416 1054011118 /nfs/dbraw/zinc/01/11/18/1054011118.db2.gz SFTGZAONQKEOEN-SFHVURJKSA-N 0 1 302.393 4.106 20 0 DIADMN COc1ccccc1O[C@H]1CCN(Cc2cc(Cl)cs2)C1 ZINC001232279879 1054014078 /nfs/dbraw/zinc/01/40/78/1054014078.db2.gz HBKYQVCIWHHSJF-ZDUSSCGKSA-N 0 1 323.845 4.063 20 0 DIADMN CCc1sc(CN2CCC[C@@H](CF)C2)cc1Br ZINC001232288664 1054014835 /nfs/dbraw/zinc/01/48/35/1054014835.db2.gz HQISKNQRHPBVRX-JTQLQIEISA-N 0 1 320.271 4.255 20 0 DIADMN CCOc1ncc(CN2CCC[C@@H]2c2ccc(F)cc2)cc1C ZINC001232303253 1054016420 /nfs/dbraw/zinc/01/64/20/1054016420.db2.gz YGSFTOASZZYMST-GOSISDBHSA-N 0 1 314.404 4.265 20 0 DIADMN Cc1ccc(CN(C)Cc2ccc(Br)nc2C)cc1 ZINC001232322906 1054021161 /nfs/dbraw/zinc/02/11/61/1054021161.db2.gz QRFDXTNEYFDHKB-UHFFFAOYSA-N 0 1 319.246 4.093 20 0 DIADMN Cc1nc(Br)ccc1CN1CCCCCCCC1 ZINC001232325740 1054021185 /nfs/dbraw/zinc/02/11/85/1054021185.db2.gz DQGLBIUCAAERMM-UHFFFAOYSA-N 0 1 311.267 4.309 20 0 DIADMN c1nc(C2CC2)oc1CN1CCC(c2nc3ccccc3o2)CC1 ZINC001330091926 1054022595 /nfs/dbraw/zinc/02/25/95/1054022595.db2.gz PDEYMBFJDIBFLF-UHFFFAOYSA-N 0 1 323.396 4.073 20 0 DIADMN COc1ccc(CN(C)Cc2cccc(C(F)(F)F)c2)c(C)n1 ZINC001232334829 1054023843 /nfs/dbraw/zinc/02/38/43/1054023843.db2.gz MGBNQZOSUWNSIE-UHFFFAOYSA-N 0 1 324.346 4.049 20 0 DIADMN COc1cc(C[N@@H+](C)Cc2ccc(C)cc2)c(OC)cc1Cl ZINC001232372177 1054031700 /nfs/dbraw/zinc/03/17/00/1054031700.db2.gz KFPZXIYLBBFDOF-UHFFFAOYSA-N 0 1 319.832 4.298 20 0 DIADMN COc1cc(CN(C)Cc2ccc(C)cc2)c(OC)cc1Cl ZINC001232372177 1054031711 /nfs/dbraw/zinc/03/17/11/1054031711.db2.gz KFPZXIYLBBFDOF-UHFFFAOYSA-N 0 1 319.832 4.298 20 0 DIADMN CCOc1ccc2nc(SCCOCCC(C)C)[nH]c2c1 ZINC001472928278 1054032800 /nfs/dbraw/zinc/03/28/00/1054032800.db2.gz GCWALAVSBWTMOJ-UHFFFAOYSA-N 0 1 308.447 4.116 20 0 DIADMN Cc1cccc(CN2CCc3ccsc3C2)c1OC(C)C ZINC001232392668 1054038226 /nfs/dbraw/zinc/03/82/26/1054038226.db2.gz XVRVOIMWTGGFMZ-UHFFFAOYSA-N 0 1 301.455 4.402 20 0 DIADMN C[C@H](c1cccc2ccccc21)N(C)Cc1[nH]nc2c1CCC2 ZINC001232430720 1054043421 /nfs/dbraw/zinc/04/34/21/1054043421.db2.gz CDRULVYZBGUYTP-CQSZACIVSA-N 0 1 305.425 4.245 20 0 DIADMN CCc1ccc(-c2n[nH]c(SCC3CC(F)(F)C3)n2)cc1 ZINC001330592215 1054043792 /nfs/dbraw/zinc/04/37/92/1054043792.db2.gz LVMITISHNOSPJB-UHFFFAOYSA-N 0 1 309.385 4.172 20 0 DIADMN Cc1ccccc1[C@H]1CCCN1Cc1cn2cc(F)ccc2n1 ZINC001232411883 1054044287 /nfs/dbraw/zinc/04/42/87/1054044287.db2.gz VRQZHVXTVJDGNM-GOSISDBHSA-N 0 1 309.388 4.119 20 0 DIADMN CN(CCc1ccccc1F)Cc1ccc(C(F)(F)F)o1 ZINC001232446288 1054045836 /nfs/dbraw/zinc/04/58/36/1054045836.db2.gz KLBJANXOFLVNPN-UHFFFAOYSA-N 0 1 301.283 4.112 20 0 DIADMN CCN(Cc1ccc(C(F)(F)F)o1)Cc1cccc(OC)c1 ZINC001232443689 1054046116 /nfs/dbraw/zinc/04/61/16/1054046116.db2.gz BOMJJXGHLAVUQG-UHFFFAOYSA-N 0 1 313.319 4.329 20 0 DIADMN CCN(Cc1ccc(C(F)(F)F)o1)Cc1ccc(OC)cc1 ZINC001232444730 1054046552 /nfs/dbraw/zinc/04/65/52/1054046552.db2.gz BHGUNPYMYDLYHW-UHFFFAOYSA-N 0 1 313.319 4.329 20 0 DIADMN CC(C)c1cc([C@H]2CCCN(Cc3ncoc3C(C)C)C2)[nH]n1 ZINC001330723407 1054049134 /nfs/dbraw/zinc/04/91/34/1054049134.db2.gz UCHHACDRCGGTQN-AWEZNQCLSA-N 0 1 316.449 4.024 20 0 DIADMN CC(C)c1cc([C@H]2CCCN(Cc3ncoc3C(C)C)C2)n[nH]1 ZINC001330723407 1054049143 /nfs/dbraw/zinc/04/91/43/1054049143.db2.gz UCHHACDRCGGTQN-AWEZNQCLSA-N 0 1 316.449 4.024 20 0 DIADMN Cc1c(C(=O)Oc2ccc(C(C)(C)C)cc2)ccc2cncn21 ZINC001355078467 1054051269 /nfs/dbraw/zinc/05/12/69/1054051269.db2.gz OELZCMPQSNSOSP-UHFFFAOYSA-N 0 1 308.381 4.159 20 0 DIADMN CCc1csc(CN2CCC(Cc3ccccc3)CC2)n1 ZINC001232470788 1054052284 /nfs/dbraw/zinc/05/22/84/1054052284.db2.gz VLFBWANIGSNPGZ-UHFFFAOYSA-N 0 1 300.471 4.160 20 0 DIADMN Fc1ccnc(CN2CC[C@@H](c3cccc(C(F)(F)F)c3)C2)c1 ZINC001232496357 1054057373 /nfs/dbraw/zinc/05/73/73/1054057373.db2.gz RQZDDNLKQGGDHC-CYBMUJFWSA-N 0 1 324.321 4.229 20 0 DIADMN CCc1nc(C)c(CN[C@H]2CCCc3c4ccccc4[nH]c32)o1 ZINC000291878363 1054057904 /nfs/dbraw/zinc/05/79/04/1054057904.db2.gz JHZOCYWJTHFRLT-INIZCTEOSA-N 0 1 309.413 4.194 20 0 DIADMN CN(Cc1cccc(C(F)(F)F)c1)Cc1cc(F)ccc1N ZINC001232511235 1054059072 /nfs/dbraw/zinc/05/90/72/1054059072.db2.gz ZPPDPYAIDXXOTE-UHFFFAOYSA-N 0 1 312.310 4.059 20 0 DIADMN CCN(Cc1ccccc1)Cc1cncc(Br)c1C ZINC001232528023 1054063475 /nfs/dbraw/zinc/06/34/75/1054063475.db2.gz SQENXJIFJDGCRP-UHFFFAOYSA-N 0 1 319.246 4.175 20 0 DIADMN CC(C)C[C@H](NCc1nccn1CC(C)C)c1cccs1 ZINC000164820015 1054064888 /nfs/dbraw/zinc/06/48/88/1054064888.db2.gz SWRPZHULDBUOLB-HNNXBMFYSA-N 0 1 305.491 4.478 20 0 DIADMN FCc1cccc(CN2CCC(Sc3ccccc3)CC2)n1 ZINC001232538737 1054066682 /nfs/dbraw/zinc/06/66/82/1054066682.db2.gz UOEIBYWVMAESIM-UHFFFAOYSA-N 0 1 316.445 4.308 20 0 DIADMN c1cc2cc(CN3CCC[C@@H](OCc4ccccc4)C3)ncc2o1 ZINC001232553713 1054068704 /nfs/dbraw/zinc/06/87/04/1054068704.db2.gz COGJVHJMBYIICM-LJQANCHMSA-N 0 1 322.408 4.009 20 0 DIADMN Clc1ccccc1[C@@H]1CCN(Cc2cc3ccoc3cn2)C1 ZINC001232553336 1054068756 /nfs/dbraw/zinc/06/87/56/1054068756.db2.gz OSZADTDCBVHZKL-CQSZACIVSA-N 0 1 312.800 4.471 20 0 DIADMN C[C@H](N[C@@H]1CCc2sc(Br)cc21)c1cccnc1 ZINC000293589726 1054070024 /nfs/dbraw/zinc/07/00/24/1054070024.db2.gz FIFOMPPFTQLELJ-JOYOIKCWSA-N 0 1 323.259 4.244 20 0 DIADMN Cc1cccc(OC2CCN(Cc3cc4ccoc4cn3)CC2)c1 ZINC001232554478 1054070210 /nfs/dbraw/zinc/07/02/10/1054070210.db2.gz VXVOLDVHCCDSBI-UHFFFAOYSA-N 0 1 322.408 4.180 20 0 DIADMN CCN(CC)[C@H](C(=O)N[C@H](C)CCCC(C)C)c1ccccc1 ZINC001355165176 1054070672 /nfs/dbraw/zinc/07/06/72/1054070672.db2.gz UJKILFLNMJPXSQ-MJGOQNOKSA-N 0 1 318.505 4.401 20 0 DIADMN Fc1ccccc1CC1CCN(Cc2cc3ccoc3cn2)CC1 ZINC001232553347 1054070796 /nfs/dbraw/zinc/07/07/96/1054070796.db2.gz OZLAIXHGBBNMBT-UHFFFAOYSA-N 0 1 324.399 4.422 20 0 DIADMN CCOC(=O)c1ccc(CN2CCCCC23CC3)c(Cl)c1 ZINC001232593245 1054076247 /nfs/dbraw/zinc/07/62/47/1054076247.db2.gz AKGIMCNQOKIFCL-UHFFFAOYSA-N 0 1 307.821 4.035 20 0 DIADMN c1ccc(COc2ccnc(CN3CCCCC34CC4)c2)cc1 ZINC001232586719 1054077152 /nfs/dbraw/zinc/07/71/52/1054077152.db2.gz FUGRSJDJRRNXDY-UHFFFAOYSA-N 0 1 308.425 4.179 20 0 DIADMN Clc1cncc(CSc2n[nH]c(CCC3CCCC3)n2)c1 ZINC000621993203 1054077992 /nfs/dbraw/zinc/07/79/92/1054077992.db2.gz AQEHDKWVIXOXPY-UHFFFAOYSA-N 0 1 322.865 4.268 20 0 DIADMN Clc1cncc(CSc2nc(CCC3CCCC3)n[nH]2)c1 ZINC000621993203 1054078002 /nfs/dbraw/zinc/07/80/02/1054078002.db2.gz AQEHDKWVIXOXPY-UHFFFAOYSA-N 0 1 322.865 4.268 20 0 DIADMN CN(Cc1cnc2ccccn12)Cc1ccc2ccsc2c1 ZINC001232610748 1054084089 /nfs/dbraw/zinc/08/40/89/1054084089.db2.gz 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1054093693 /nfs/dbraw/zinc/09/36/93/1054093693.db2.gz WIZJQPPZKFJFFM-SFHVURJKSA-N 0 1 302.368 4.344 20 0 DIADMN COc1ccc(CN[C@H]2CCc3c2ccc(Cl)c3Cl)o1 ZINC001355251416 1054095469 /nfs/dbraw/zinc/09/54/69/1054095469.db2.gz DHJUMVFOMXAFCA-ZDUSSCGKSA-N 0 1 312.196 4.372 20 0 DIADMN Cc1nc(CN2CCC[C@@H](C)[C@@H](C)C2)ccc1Br ZINC001232662199 1054095836 /nfs/dbraw/zinc/09/58/36/1054095836.db2.gz QNKGADUBQAGAAQ-NEPJUHHUSA-N 0 1 311.267 4.021 20 0 DIADMN CNc1ccccc1CN(C)Cc1ccccc1C(F)(F)F ZINC001232670468 1054096381 /nfs/dbraw/zinc/09/63/81/1054096381.db2.gz DHJAVLHFRODLAE-UHFFFAOYSA-N 0 1 308.347 4.379 20 0 DIADMN C[C@@H]1CC[N@@H+](Cc2ccc(-c3ccccc3)s2)[C@H](C(=O)[O-])C1 ZINC001331933475 1054102069 /nfs/dbraw/zinc/10/20/69/1054102069.db2.gz CZZVKOUYRVSKAH-CJNGLKHVSA-N 0 1 315.438 4.100 20 0 DIADMN CC[C@H](N[C@H]1CCc2nc(Cl)ccc21)c1ccccc1OC ZINC001331945338 1054102587 /nfs/dbraw/zinc/10/25/87/1054102587.db2.gz HOFIMPXDLBIIGG-GJZGRUSLSA-N 0 1 316.832 4.472 20 0 DIADMN 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CC(C)Oc1ncc(Cl)cc1CN1CCC[C@H]2CCC[C@@H]21 ZINC001233167321 1054196366 /nfs/dbraw/zinc/19/63/66/1054196366.db2.gz QJXMBBXOGXOTRB-CJNGLKHVSA-N 0 1 308.853 4.287 20 0 DIADMN CCCN(Cc1ccnc(Cl)c1Br)CC1CC1 ZINC001233177410 1054196852 /nfs/dbraw/zinc/19/68/52/1054196852.db2.gz HPIYGGAPPCPOMT-UHFFFAOYSA-N 0 1 317.658 4.120 20 0 DIADMN Clc1nccc(CN2CCCCC23CC3)c1Br ZINC001233184076 1054198156 /nfs/dbraw/zinc/19/81/56/1054198156.db2.gz LPRRXABRCSNJDW-UHFFFAOYSA-N 0 1 315.642 4.016 20 0 DIADMN FC(F)(F)c1cc(CN2CC[C@H](COCC3CC3)C2)cs1 ZINC001233178010 1054198684 /nfs/dbraw/zinc/19/86/84/1054198684.db2.gz REFLCAYVEMWFFW-LBPRGKRZSA-N 0 1 319.392 4.015 20 0 DIADMN Fc1ccc(Oc2cccc(CN3CC4(CSC4)C3)c2)cc1 ZINC001233210722 1054202320 /nfs/dbraw/zinc/20/23/20/1054202320.db2.gz FIKOFELNCDCESD-UHFFFAOYSA-N 0 1 315.413 4.167 20 0 DIADMN Clc1ccc(-c2ccc(CN3C[C@H]4CC[C@@H]3CO4)cc2)cc1 ZINC001233220445 1054208139 /nfs/dbraw/zinc/20/81/39/1054208139.db2.gz UMGSLJDLQHNEHF-RTBURBONSA-N 0 1 313.828 4.370 20 0 DIADMN 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Fc1cc(F)cc(-c2n[nH]cc2CN2CC3(C2)CCCCC3)c1 ZINC001233405660 1054262549 /nfs/dbraw/zinc/26/25/49/1054262549.db2.gz HVTVAXPAEGWZNF-UHFFFAOYSA-N 0 1 317.383 4.121 20 0 DIADMN CCCCc1nc2ccc(NC(=O)[C@@H]3C[C@@H]3[C@@H]3C[C@@H]3C)cc2[nH]1 ZINC001356026492 1054264014 /nfs/dbraw/zinc/26/40/14/1054264014.db2.gz GBTDBZJYYDSJGD-ZGKBOVNRSA-N 0 1 311.429 4.136 20 0 DIADMN COc1ccccc1C1(N[C@H](C)c2sc(C)nc2C)CCC1 ZINC001337310190 1054264170 /nfs/dbraw/zinc/26/41/70/1054264170.db2.gz VLNXTDVANRXBID-CYBMUJFWSA-N 0 1 316.470 4.499 20 0 DIADMN Cc1n[nH]c(C(C)C)c1C(=O)N1CC[C@@H](C)C2(CCCCC2)C1 ZINC000622514267 1054266418 /nfs/dbraw/zinc/26/64/18/1054266418.db2.gz OOSSSHLEEMQANN-CQSZACIVSA-N 0 1 317.477 4.274 20 0 DIADMN Brc1cc(CN2CC[C@H]3CCC[C@@H]3C2)cs1 ZINC001233412808 1054267540 /nfs/dbraw/zinc/26/75/40/1054267540.db2.gz VWBOLXOAQLQWDY-VXGBXAGGSA-N 0 1 300.265 4.133 20 0 DIADMN Cc1n[nH]c(C(C)C)c1C(=O)N1CC[C@H](C)C2(CCCCC2)C1 ZINC000622514266 1054267604 /nfs/dbraw/zinc/26/76/04/1054267604.db2.gz 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C[C@H]1C[C@H](C(C)(C)C)CCN1CC(=O)Nc1cccc(Cl)c1 ZINC001559879735 1059698741 /nfs/dbraw/zinc/69/87/41/1059698741.db2.gz POHXXROAKXHSRX-UONOGXRCSA-N 0 1 322.880 4.425 20 0 DIADMN Cc1ccc(C[N@H+]2CCC[C@H](C3CC3)C2)cc1Br ZINC001559880613 1059701010 /nfs/dbraw/zinc/70/10/10/1059701010.db2.gz NDSXORIWRLDKMK-HNNXBMFYSA-N 0 1 308.263 4.380 20 0 DIADMN O=C(Nc1ccc(OC2CCCC2)cc1)c1cccc(F)c1O ZINC001532795989 1059711759 /nfs/dbraw/zinc/71/17/59/1059711759.db2.gz BBPVMPXNRUYUMX-UHFFFAOYSA-N 0 1 315.344 4.105 20 0 DIADMN CCCCCC[C@@H](CC)C(=O)N1CCN(C)CC12CCCCC2 ZINC001532809430 1059715195 /nfs/dbraw/zinc/71/51/95/1059715195.db2.gz LQVWTTFYCMCMDV-GOSISDBHSA-N 0 1 322.537 4.460 20 0 DIADMN CCCCCC[C@H](C)CC(=O)N1CCN(C)CC12CCCCC2 ZINC001532818362 1059716530 /nfs/dbraw/zinc/71/65/30/1059716530.db2.gz IAYHZEXGKNFYJD-SFHVURJKSA-N 0 1 322.537 4.460 20 0 DIADMN Fc1ccc([C@H]2CCCN2C[C@@H]2CC3(CCC3)CO2)c(F)c1 ZINC001559907225 1059722247 /nfs/dbraw/zinc/72/22/47/1059722247.db2.gz CIRFYLRKNZLXAH-WMLDXEAASA-N 0 1 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/nfs/dbraw/zinc/73/94/89/1059739489.db2.gz INOQNHKMWUCPJS-UHFFFAOYSA-N 0 1 305.809 4.073 20 0 DIADMN Cc1ccccc1SC[C@@H](C)CN1CCC(=O)CC12CCC2 ZINC001559933479 1059743748 /nfs/dbraw/zinc/74/37/48/1059743748.db2.gz VUXMXOKOZANNAQ-HNNXBMFYSA-N 0 1 317.498 4.311 20 0 DIADMN C[C@@H](CC1CCCCC1)NC(=O)c1n[nH]c2ccc(Cl)cc21 ZINC001525080492 1059744842 /nfs/dbraw/zinc/74/48/42/1059744842.db2.gz DRDOGBROXXYFPU-NSHDSACASA-N 0 1 319.836 4.305 20 0 DIADMN C[C@H]1[C@H](c2cccc(F)c2)OCCN1CC12CCC(CC1)C2 ZINC001559937563 1059753285 /nfs/dbraw/zinc/75/32/85/1059753285.db2.gz GIOMDYDMYALYAX-MZMPVIPJSA-N 0 1 303.421 4.168 20 0 DIADMN Cc1cnc(CN2CCC[C@]2(C)Cc2ccccc2F)s1 ZINC001559939795 1059754806 /nfs/dbraw/zinc/75/48/06/1059754806.db2.gz YPPHGUJGLRTSDF-QGZVFWFLSA-N 0 1 304.434 4.188 20 0 DIADMN Brc1cccc2c1CN(CC1CCCCC1)CCO2 ZINC001559945139 1059756270 /nfs/dbraw/zinc/75/62/70/1059756270.db2.gz IRGNYMIGDUBPMT-UHFFFAOYSA-N 0 1 324.262 4.224 20 0 DIADMN Fc1cc(Cl)ccc1CN1CCC[C@H](c2cccnc2)C1 ZINC001559944203 1059758121 /nfs/dbraw/zinc/75/81/21/1059758121.db2.gz JGWUJUIMVPPWOJ-AWEZNQCLSA-N 0 1 304.796 4.254 20 0 DIADMN Cc1ccc(SCCN2C[C@@H](C)OC3(CCC3)C2)cc1C ZINC001559965098 1059773961 /nfs/dbraw/zinc/77/39/61/1059773961.db2.gz REMSCOVQVZPBJL-MRXNPFEDSA-N 0 1 305.487 4.039 20 0 DIADMN C[C@@H](CSc1ccccc1)N(C)CC1(Br)CC1 ZINC001559974019 1059778984 /nfs/dbraw/zinc/77/89/84/1059778984.db2.gz NZGVESDFSRCZSZ-LBPRGKRZSA-N 0 1 314.292 4.027 20 0 DIADMN CC[C@@H](C(=O)OC(C)(C)C)N1CCC(C2CCCCC2)CC1 ZINC001559973601 1059781694 /nfs/dbraw/zinc/78/16/94/1059781694.db2.gz KVEYWURYDAGWKL-KRWDZBQOSA-N 0 1 309.494 4.399 20 0 DIADMN COC(=O)[C@@H](c1ccccc1)N1CCC(C)(C)CC(C)(C)C1 ZINC001559987593 1059792021 /nfs/dbraw/zinc/79/20/21/1059792021.db2.gz OZCCUEUZNWGRGQ-MRXNPFEDSA-N 0 1 303.446 4.049 20 0 DIADMN CCc1ccc(C(=O)Nc2nc3cc(Cl)c(F)cc3[nH]2)cc1 ZINC001533132201 1059801864 /nfs/dbraw/zinc/80/18/64/1059801864.db2.gz LZCXXDMQVRPMEM-UHFFFAOYSA-N 0 1 317.751 4.170 20 0 DIADMN C[C@H](c1ccccc1Br)N1CC[C@@H](C)O[C@@H](C)C1 ZINC001560001542 1059804268 /nfs/dbraw/zinc/80/42/68/1059804268.db2.gz LKZLKAZUOASLKS-FRRDWIJNSA-N 0 1 312.251 4.009 20 0 DIADMN COc1cccc([C@@]2(C)CCN(Cc3ccc(F)c(F)c3)C2)c1 ZINC001560001178 1059807661 /nfs/dbraw/zinc/80/76/61/1059807661.db2.gz YEIPVVXMNZOEPC-IBGZPJMESA-N 0 1 317.379 4.137 20 0 DIADMN COc1ccc2c(c1)CCN(Cc1ccc(CC(C)C)cc1)C2 ZINC001560003749 1059810848 /nfs/dbraw/zinc/81/08/48/1059810848.db2.gz CZKOSQDLQCIHNZ-UHFFFAOYSA-N 0 1 309.453 4.452 20 0 DIADMN CC1(C)CCC(C)(C)N(Cc2cccc(Br)n2)C1 ZINC001560012122 1059816370 /nfs/dbraw/zinc/81/63/70/1059816370.db2.gz NIDZSGVLYJBPEB-UHFFFAOYSA-N 0 1 311.267 4.245 20 0 DIADMN C[C@@H](c1noc(-c2ccccc2)n1)N1CCC[C@H](C2CCC2)C1 ZINC001560011162 1059818945 /nfs/dbraw/zinc/81/89/45/1059818945.db2.gz BYGLPXKRCXEFDT-YOEHRIQHSA-N 0 1 311.429 4.310 20 0 DIADMN COCCCN1CCc2sccc2[C@H]1c1ccc(Cl)cc1 ZINC001560009126 1059819548 /nfs/dbraw/zinc/81/95/48/1059819548.db2.gz OQSGGPMHABJMIM-QGZVFWFLSA-N 0 1 321.873 4.386 20 0 DIADMN Cc1ccc2ccccc2c1CN1CCO[C@@](C)(C(F)F)C1 ZINC001560016264 1059823671 /nfs/dbraw/zinc/82/36/71/1059823671.db2.gz ZTXKXGZRYYJPKP-GOSISDBHSA-N 0 1 305.368 4.004 20 0 DIADMN CC(C)C[C@H]1COCCN1CCSc1ccc(Cl)cc1 ZINC001560022516 1059836504 /nfs/dbraw/zinc/83/65/04/1059836504.db2.gz XJCQRMMZYCWLFZ-HNNXBMFYSA-N 0 1 313.894 4.179 20 0 DIADMN CCN(Cc1ccc(F)cc1)Cc1cc(Cl)cn2ccnc12 ZINC001248452047 1059838909 /nfs/dbraw/zinc/83/89/09/1059838909.db2.gz VXGGDLFGNWQAEZ-UHFFFAOYSA-N 0 1 317.795 4.149 20 0 DIADMN CCc1oc(C(=O)OC)cc1CN(C)[C@@H](C)c1ccccc1C ZINC001560039657 1059850505 /nfs/dbraw/zinc/85/05/05/1059850505.db2.gz KMLATLGVFGYJCL-AWEZNQCLSA-N 0 1 315.413 4.130 20 0 DIADMN CCC(CC)CN(CC)C(=O)c1ccc(CN2CCCCC2)o1 ZINC001525371854 1059852241 /nfs/dbraw/zinc/85/22/41/1059852241.db2.gz ASALFTLKQFSAML-UHFFFAOYSA-N 0 1 320.477 4.164 20 0 DIADMN C/C=C\C[C@@H]1CCCN(Cc2ccn(CCc3ccccc3)n2)C1 ZINC001560041690 1059855882 /nfs/dbraw/zinc/85/58/82/1059855882.db2.gz UJLNLIUSACRFAA-ZBADOCLRSA-N 0 1 323.484 4.304 20 0 DIADMN Fc1cccc(F)c1C1(NC[C@@H]2CCC3(CCCC3)O2)CCC1 ZINC001560046047 1059860425 /nfs/dbraw/zinc/86/04/25/1059860425.db2.gz AKQBZNGYZZTNLG-AWEZNQCLSA-N 0 1 321.411 4.425 20 0 DIADMN C[N@@H+](CCc1ccccc1F)Cc1c2ccoc2ccc1F ZINC001248545459 1059878420 /nfs/dbraw/zinc/87/84/20/1059878420.db2.gz CFMXXPYFHLFTKG-UHFFFAOYSA-N 0 1 301.336 4.386 20 0 DIADMN C[N@H+](Cc1c2ccoc2ccc1F)C[C@@H]1Cc2ccccc2O1 ZINC001248545858 1059880311 /nfs/dbraw/zinc/88/03/11/1059880311.db2.gz SAQKOEIWSJAQPT-AWEZNQCLSA-N 0 1 311.356 4.007 20 0 DIADMN CN(Cc1c2ccoc2ccc1F)C[C@@H]1Cc2ccccc2O1 ZINC001248545858 1059880337 /nfs/dbraw/zinc/88/03/37/1059880337.db2.gz SAQKOEIWSJAQPT-AWEZNQCLSA-N 0 1 311.356 4.007 20 0 DIADMN Cc1cccc(Br)c1CN1CCC[C@@H](C(F)F)C1 ZINC001248613841 1059908773 /nfs/dbraw/zinc/90/87/73/1059908773.db2.gz USWMUTPZPWHEAE-LLVKDONJSA-N 0 1 318.205 4.235 20 0 DIADMN CC1(C)[C@H](c2ccccc2F)CCN1Cc1nc2ccccc2[nH]1 ZINC001560078300 1059894253 /nfs/dbraw/zinc/89/42/53/1059894253.db2.gz OPVDMJWMCAMTTQ-HNNXBMFYSA-N 0 1 323.415 4.470 20 0 DIADMN C[C@@H](c1c(F)cccc1F)N1CCC[C@H](OC2CCC2)CC1 ZINC001560080278 1059895791 /nfs/dbraw/zinc/89/57/91/1059895791.db2.gz VIJYJCXBUBJXND-ZFWWWQNUSA-N 0 1 309.400 4.449 20 0 DIADMN Cc1ccc2c(CN(C)Cc3ccc(F)cc3F)cccc2n1 ZINC001248574384 1059897042 /nfs/dbraw/zinc/89/70/42/1059897042.db2.gz WYMVSYRGAHUAOA-UHFFFAOYSA-N 0 1 312.363 4.453 20 0 DIADMN Cc1ccc(NC(=O)CN2CCC[C@@H](C3CCC3)CC2)c(C)c1 ZINC001560091804 1059903226 /nfs/dbraw/zinc/90/32/26/1059903226.db2.gz PLYPYUBTXUETKA-GOSISDBHSA-N 0 1 314.473 4.144 20 0 DIADMN Brc1nc2ccc(CN3CCC[C@H]4C[C@H]43)cc2s1 ZINC001248596575 1059905697 /nfs/dbraw/zinc/90/56/97/1059905697.db2.gz UTNSXEZMWWDLFM-CMPLNLGQSA-N 0 1 323.259 4.043 20 0 DIADMN CC(C)(C)[C@H](NC(=O)c1cccc(F)c1O)c1ccc(F)cc1 ZINC001525475153 1059905750 /nfs/dbraw/zinc/90/57/50/1059905750.db2.gz YHTPQSKKZYDFBZ-MRXNPFEDSA-N 0 1 319.351 4.188 20 0 DIADMN Clc1ccc(CN[C@H](Cn2ccnc2)c2ccccc2)s1 ZINC001560099057 1059906845 /nfs/dbraw/zinc/90/68/45/1059906845.db2.gz ZYMVFBBIFNAMDY-OAHLLOKOSA-N 0 1 317.845 4.129 20 0 DIADMN CCN(Cc1ccc(Cl)cc1F)[C@@H](CO)c1ccccc1 ZINC001560097918 1059908239 /nfs/dbraw/zinc/90/82/39/1059908239.db2.gz SCVHAWOSSGAGAV-KRWDZBQOSA-N 0 1 307.796 4.035 20 0 DIADMN FC[C@@H]1CCN(Cc2cc3cc(Cl)ccc3nc2Cl)C1 ZINC001560102905 1059912295 /nfs/dbraw/zinc/91/22/95/1059912295.db2.gz BIHUGMAPFUEAPV-JTQLQIEISA-N 0 1 313.203 4.333 20 0 DIADMN c1cnc([C@@H]2CCCCN2Cc2cccc3ccccc32)nc1 ZINC001560114426 1059918578 /nfs/dbraw/zinc/91/85/78/1059918578.db2.gz NDUCYFXAKXCPEX-IBGZPJMESA-N 0 1 303.409 4.357 20 0 DIADMN Fc1cccc(C2CCN(Cc3ccc(F)c(F)c3)CC2)c1 ZINC001560119176 1059919765 /nfs/dbraw/zinc/91/97/65/1059919765.db2.gz PQDGGRFDIOSVTE-UHFFFAOYSA-N 0 1 305.343 4.484 20 0 DIADMN Fc1cccc(C2CCN(Cc3cc(F)ccc3F)CC2)c1 ZINC001560118928 1059920038 /nfs/dbraw/zinc/92/00/38/1059920038.db2.gz HDRQTCWGISZFNJ-UHFFFAOYSA-N 0 1 305.343 4.484 20 0 DIADMN CC(C)(C)c1cccc(CN2CCO[C@H](C(F)(F)F)CC2)c1 ZINC001560117820 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Cc1occc1CN(C)CCOc1ccccc1C(C)(C)C ZINC001474481677 1062160051 /nfs/dbraw/zinc/16/00/51/1062160051.db2.gz CQKUEYIYSCTMNE-UHFFFAOYSA-N 0 1 301.430 4.396 20 0 DIADMN Fc1cccc2c(-c3nnc([C@@H]4C[C@H]4c4ccccc4)o3)n[nH]c21 ZINC001254528870 1062160452 /nfs/dbraw/zinc/16/04/52/1062160452.db2.gz QDPLKAAEMDRQOI-QWHCGFSZSA-N 0 1 320.327 4.023 20 0 DIADMN CC[C@@H]1CCC[N@@H+](Cc2cc(F)ccc2OC(F)F)CC1 ZINC001459482310 1062161706 /nfs/dbraw/zinc/16/17/06/1062161706.db2.gz UKISPCQQYCQTQU-GFCCVEGCSA-N 0 1 301.352 4.439 20 0 DIADMN CC[C@@H]1CCCN(Cc2cc(F)ccc2OC(F)F)CC1 ZINC001459482310 1062161719 /nfs/dbraw/zinc/16/17/19/1062161719.db2.gz UKISPCQQYCQTQU-GFCCVEGCSA-N 0 1 301.352 4.439 20 0 DIADMN Clc1ccc(C2=NO[C@@H](CN3C4CCCC3CCC4)C2)cc1 ZINC001459483547 1062162632 /nfs/dbraw/zinc/16/26/32/1062162632.db2.gz CLJJIMCMFFNGHI-OFLPRAFFSA-N 0 1 318.848 4.240 20 0 DIADMN Cc1cc(CN2CCCC[C@@H]2C(C)C)cnc1Br ZINC001459485823 1062164319 /nfs/dbraw/zinc/16/43/19/1062164319.db2.gz GXHCNFHDUSNGGY-CQSZACIVSA-N 0 1 311.267 4.163 20 0 DIADMN CC[C@@H]1CCCN(CC(=O)Nc2ccc(Cl)cc2C)CC1 ZINC001459495421 1062168991 /nfs/dbraw/zinc/16/89/91/1062168991.db2.gz WYWAGFKVHZLNEE-CQSZACIVSA-N 0 1 308.853 4.099 20 0 DIADMN C[C@@]1(CN2CCSC[C@H]2c2ccccc2)CC1(Cl)Cl ZINC001459505121 1062172008 /nfs/dbraw/zinc/17/20/08/1062172008.db2.gz BAGJESFYYOOBCV-KBPBESRZSA-N 0 1 316.297 4.360 20 0 DIADMN Cc1cc(C[N@@H+]2C[C@H](c3ccccc3C)OC[C@H]2C)cs1 ZINC001459508215 1062172334 /nfs/dbraw/zinc/17/23/34/1062172334.db2.gz ABYNKLCCDKPRAZ-RDTXWAMCSA-N 0 1 301.455 4.327 20 0 DIADMN Cc1cc(CN2C[C@H](c3ccccc3C)OC[C@H]2C)cs1 ZINC001459508215 1062172360 /nfs/dbraw/zinc/17/23/60/1062172360.db2.gz ABYNKLCCDKPRAZ-RDTXWAMCSA-N 0 1 301.455 4.327 20 0 DIADMN Cc1cc(-c2noc([C@@H](C)N[C@H]3C[C@@H]4CCC[C@@H]43)n2)ccc1F ZINC001474498184 1062180791 /nfs/dbraw/zinc/18/07/91/1062180791.db2.gz UKJCOHMNWOCJBD-DSPQJCBJSA-N 0 1 315.392 4.023 20 0 DIADMN Clc1ccc(-n2ccc(CN3CCC[C@H]4CCC[C@@H]43)n2)cc1 ZINC001459527017 1062186736 /nfs/dbraw/zinc/18/67/36/1062186736.db2.gz QMDJYCUZURTYFO-KDOFPFPSSA-N 0 1 315.848 4.290 20 0 DIADMN CC[C@H]1CCCCCN1CC(=O)Nc1ccc(C)cc1Cl ZINC001459528085 1062186972 /nfs/dbraw/zinc/18/69/72/1062186972.db2.gz HSRGJNPYMBJLEZ-AWEZNQCLSA-N 0 1 308.853 4.242 20 0 DIADMN CC[C@@H](OCCN1CC(C)(C)OCC1(C)C)c1ccccc1 ZINC001459530851 1062188784 /nfs/dbraw/zinc/18/87/84/1062188784.db2.gz XWUJUCDHVAZJMJ-QGZVFWFLSA-N 0 1 305.462 4.044 20 0 DIADMN CCc1ccc([C@H]2CCCCCN2Cc2cnn(CCF)c2)o1 ZINC001459539678 1062192713 /nfs/dbraw/zinc/19/27/13/1062192713.db2.gz XRYOBVGOFXFBGX-QGZVFWFLSA-N 0 1 319.424 4.125 20 0 DIADMN CC[C@H](C)[C@H]1CCCCN1Cc1sncc1Br ZINC001459540981 1062195769 /nfs/dbraw/zinc/19/57/69/1062195769.db2.gz OFZIBBQTEQAGHD-CMPLNLGQSA-N 0 1 317.296 4.306 20 0 DIADMN CN(CCCN1CCc2c(Cl)cccc2C1)c1ccccc1 ZINC001459543897 1062195968 /nfs/dbraw/zinc/19/59/68/1062195968.db2.gz WHCOORMRQGRXDF-UHFFFAOYSA-N 0 1 314.860 4.225 20 0 DIADMN C[C@]1(c2ccccc2)CCC[N@H+](Cc2ccc([O-])c(F)c2)CC1 ZINC001474517062 1062201644 /nfs/dbraw/zinc/20/16/44/1062201644.db2.gz LFQDQPCQXWGLGO-FQEVSTJZSA-N 0 1 313.416 4.475 20 0 DIADMN C[C@]1(c2ccccc2)CCC[N@@H+](Cc2ccc([O-])c(F)c2)CC1 ZINC001474517062 1062201668 /nfs/dbraw/zinc/20/16/68/1062201668.db2.gz LFQDQPCQXWGLGO-FQEVSTJZSA-N 0 1 313.416 4.475 20 0 DIADMN Brc1cscc1CN1C[C@H](C2CC2)[C@@H]1C1CC1 ZINC001474531078 1062216387 /nfs/dbraw/zinc/21/63/87/1062216387.db2.gz JAYYDIHOUGLAHL-OCCSQVGLSA-N 0 1 312.276 4.131 20 0 DIADMN C[C@@H]1CN(Cc2cccc3ncccc23)[C@H](c2ccccc2)CO1 ZINC001459572353 1062221459 /nfs/dbraw/zinc/22/14/59/1062221459.db2.gz IDRZBGIUWKDVPB-IERDGZPVSA-N 0 1 318.420 4.197 20 0 DIADMN CCOc1cccc(Cl)c1CN(C)[C@@H]1CC[C@@H](SC)C1 ZINC001459583975 1062223806 /nfs/dbraw/zinc/22/38/06/1062223806.db2.gz DWHXDKBSOXKVPE-CHWSQXEVSA-N 0 1 313.894 4.455 20 0 DIADMN CC1(C)CN(CCc2cccc(Cl)c2)[C@@H]1c1ccncc1 ZINC001474538085 1062226171 /nfs/dbraw/zinc/22/61/71/1062226171.db2.gz PMEHSVHBRBTAGR-QGZVFWFLSA-N 0 1 300.833 4.361 20 0 DIADMN C[C@@H]1CN(C[C@H]2CCCCC2(F)F)[C@@H](c2ccccc2)CO1 ZINC001459586581 1062229960 /nfs/dbraw/zinc/22/99/60/1062229960.db2.gz XZFRESZCRWTZDF-DJIMGWMZSA-N 0 1 309.400 4.274 20 0 DIADMN Cc1cc([C@H](C)NCC(=O)Nc2cccc(C(C)C)c2)c(C)o1 ZINC001254676883 1062230029 /nfs/dbraw/zinc/23/00/29/1062230029.db2.gz ZVLDRNBGNQKVND-AWEZNQCLSA-N 0 1 314.429 4.309 20 0 DIADMN Cc1ccccc1[C@H](C)N(CC(C)C)C(=O)[C@@H]1CCCCN1C ZINC001467956586 1062233709 /nfs/dbraw/zinc/23/37/09/1062233709.db2.gz IPHUONLXGVTXMO-HKUYNNGSSA-N 0 1 316.489 4.025 20 0 DIADMN C[C@@H]1Cc2ccccc2CN1Cc1cccc(OC(C)(C)C)n1 ZINC001459600219 1062234176 /nfs/dbraw/zinc/23/41/76/1062234176.db2.gz ZETJQWKLZIJURO-OAHLLOKOSA-N 0 1 310.441 4.206 20 0 DIADMN Fc1cccc([C@H]2CCN2C[C@H]2CC3(CO2)CCCCC3)c1 ZINC001459604745 1062240278 /nfs/dbraw/zinc/24/02/78/1062240278.db2.gz BCYKFYDLSVSERJ-QZTJIDSGSA-N 0 1 303.421 4.312 20 0 DIADMN CCc1cccc(Cl)c1CN1CC2(CCC2)[C@@H]1[C@H]1CCCO1 ZINC001474554618 1062253291 /nfs/dbraw/zinc/25/32/91/1062253291.db2.gz MAUSEHYAQRWIGB-MSOLQXFVSA-N 0 1 319.876 4.436 20 0 DIADMN C[C@@H]1CN(C[C@@H]2CCC[C@H](C(F)(F)F)O2)[C@H]1c1ccccc1 ZINC001459621864 1062256153 /nfs/dbraw/zinc/25/61/53/1062256153.db2.gz ZPDKFKURBDGEES-SLBVQIDZSA-N 0 1 313.363 4.179 20 0 DIADMN CC(C)c1ccc(-c2nnc([C@@H]3CCCc4[nH]cnc43)o2)cc1 ZINC001254842304 1062262126 /nfs/dbraw/zinc/26/21/26/1062262126.db2.gz CMFSBVQWTZVEIN-CQSZACIVSA-N 0 1 308.385 4.051 20 0 DIADMN C[C@H]1CCN(Cc2ccc(Cl)cc2Br)[C@H]1C ZINC001459628508 1062268985 /nfs/dbraw/zinc/26/89/85/1062268985.db2.gz CJSRGQMHLGDYJZ-UWVGGRQHSA-N 0 1 302.643 4.333 20 0 DIADMN CC[C@@H](c1ccccc1OC)N(C)Cc1cnn(C2CCC2)c1 ZINC001474564415 1062269307 /nfs/dbraw/zinc/26/93/07/1062269307.db2.gz YZVYSUKARPKRQD-SFHVURJKSA-N 0 1 313.445 4.200 20 0 DIADMN FC(F)(F)Cc1ccccc1CN1CC(Cc2ccccc2)C1 ZINC001474568264 1062273436 /nfs/dbraw/zinc/27/34/36/1062273436.db2.gz XXLLIPARSAHUFG-UHFFFAOYSA-N 0 1 319.370 4.466 20 0 DIADMN CC(C)C1(O)CN(Cc2cccc(-c3ccc(Cl)cc3)c2)C1 ZINC001474568310 1062274504 /nfs/dbraw/zinc/27/45/04/1062274504.db2.gz YNFCPWAGRURTKY-UHFFFAOYSA-N 0 1 315.844 4.210 20 0 DIADMN Cc1cc(Cl)cc(CN2CC(Cc3ccc(F)cc3)C2)c1 ZINC001474568554 1062274625 /nfs/dbraw/zinc/27/46/25/1062274625.db2.gz YIVCIGOWCNOZEY-UHFFFAOYSA-N 0 1 303.808 4.462 20 0 DIADMN Cc1cc2ccccc2c(NC(=O)c2cc(C(F)F)n[nH]2)c1 ZINC001468192109 1062275254 /nfs/dbraw/zinc/27/52/54/1062275254.db2.gz HNQDPHWBJAYTSB-UHFFFAOYSA-N 0 1 301.296 4.061 20 0 DIADMN C[C@H](CC(C)(C)C)NCc1nc2ccccn2c1Br ZINC001474569076 1062276682 /nfs/dbraw/zinc/27/66/82/1062276682.db2.gz NFDFKIKFXSZKCS-LLVKDONJSA-N 0 1 324.266 4.011 20 0 DIADMN CC(C)[C@H]1CCN(Cc2cc(F)c(C(F)(F)F)cc2F)C1 ZINC001459644299 1062276527 /nfs/dbraw/zinc/27/65/27/1062276527.db2.gz BBNNXBYFADSQGL-JTQLQIEISA-N 0 1 307.306 4.462 20 0 DIADMN C[C@@H](c1ccc(F)nc1)N1CCC(Cc2ccccc2F)CC1 ZINC001459658852 1062279606 /nfs/dbraw/zinc/27/96/06/1062279606.db2.gz SOBMBQRTIZCJOU-AWEZNQCLSA-N 0 1 316.395 4.376 20 0 DIADMN CN1CCC[C@H]1c1nnc(-c2cccc(Oc3ccccc3)c2)o1 ZINC001254924778 1062281776 /nfs/dbraw/zinc/28/17/76/1062281776.db2.gz KYPKWJIOZGKDEX-KRWDZBQOSA-N 0 1 321.380 4.296 20 0 DIADMN Cc1cc(F)ccc1[C@H]1CCCN1Cc1cn2ccnc2s1 ZINC001474578830 1062286024 /nfs/dbraw/zinc/28/60/24/1062286024.db2.gz KOSBSSPJCWFIAI-MRXNPFEDSA-N 0 1 315.417 4.180 20 0 DIADMN CC1(C)CC(C(=O)NCc2ccc3nc[nH]c3c2)CC(C)(C)C1 ZINC001468257370 1062287485 /nfs/dbraw/zinc/28/74/85/1062287485.db2.gz PZQJHTHAHQYUJX-UHFFFAOYSA-N 0 1 313.445 4.032 20 0 DIADMN Cc1cccc(CN2C[C@@H](C(=O)OC(C)(C)C)CC[C@@H]2C)c1F ZINC001474589693 1062302497 /nfs/dbraw/zinc/30/24/97/1062302497.db2.gz YQSITQFTRODGJU-HOCLYGCPSA-N 0 1 321.436 4.076 20 0 DIADMN COC(=O)C1([N@@H+](C)Cc2c(C)c(C)c(C)c(C)c2C)CCCC1 ZINC001459693732 1062310902 /nfs/dbraw/zinc/31/09/02/1062310902.db2.gz KJRYIRYRENXEIM-UHFFFAOYSA-N 0 1 317.473 4.146 20 0 DIADMN COC(=O)C1(N(C)Cc2c(C)c(C)c(C)c(C)c2C)CCCC1 ZINC001459693732 1062310928 /nfs/dbraw/zinc/31/09/28/1062310928.db2.gz KJRYIRYRENXEIM-UHFFFAOYSA-N 0 1 317.473 4.146 20 0 DIADMN C[C@H]1CCC[C@H](CCN(C)CC(=O)Nc2cc(F)cc(F)c2)C1 ZINC001459701127 1062315957 /nfs/dbraw/zinc/31/59/57/1062315957.db2.gz OTIVZCDESXQQIW-UONOGXRCSA-N 0 1 324.415 4.052 20 0 DIADMN CCN(Cc1cnn(C)c1)Cc1ccc(C2CCCCC2)cc1 ZINC001459703041 1062320735 /nfs/dbraw/zinc/32/07/35/1062320735.db2.gz BVBBZBCYDDWSNK-UHFFFAOYSA-N 0 1 311.473 4.490 20 0 DIADMN CC(C)n1nccc1CN1CCc2ccc(Cl)cc2[C@H](C)C1 ZINC001474610802 1062323928 /nfs/dbraw/zinc/32/39/28/1062323928.db2.gz BUGQCVNJMTWWGK-CQSZACIVSA-N 0 1 317.864 4.279 20 0 DIADMN Cc1coc(C[N@H+]2C[C@H](C)N(Cc3ccccc3)[C@@H](C)[C@@H]2C)c1 ZINC001474610252 1062324420 /nfs/dbraw/zinc/32/44/20/1062324420.db2.gz VKVFFWPGSQUKTF-BZSNNMDCSA-N 0 1 312.457 4.071 20 0 DIADMN CC[C@@H]1CCCC[C@@H]1CNC(=O)[C@@H](c1ccccc1)N(C)CC ZINC001468510036 1062338808 /nfs/dbraw/zinc/33/88/08/1062338808.db2.gz REQRPMHIDKOILD-BHIYHBOVSA-N 0 1 316.489 4.012 20 0 DIADMN CC(C)c1ccc2c(c1)CN(Cc1ccc3nccnc3c1)CC2 ZINC001474618647 1062339546 /nfs/dbraw/zinc/33/95/46/1062339546.db2.gz YAAYVBXAJBKAFJ-UHFFFAOYSA-N 0 1 317.436 4.312 20 0 DIADMN Cc1cnccc1CN1CCc2cc(-c3ccccc3)oc2C1 ZINC001459732579 1062344633 /nfs/dbraw/zinc/34/46/33/1062344633.db2.gz FDHVSCJNEMCHJG-UHFFFAOYSA-N 0 1 304.393 4.208 20 0 DIADMN CC1(c2ccccc2)CN(CCc2ccc(F)cc2Cl)C1 ZINC001474638445 1062364952 /nfs/dbraw/zinc/36/49/52/1062364952.db2.gz GCHQUPMKDMKUAP-UHFFFAOYSA-N 0 1 303.808 4.295 20 0 DIADMN CC(C)CCOCCN1CCC(=Cc2ccccc2F)CC1 ZINC001459762169 1062368813 /nfs/dbraw/zinc/36/88/13/1062368813.db2.gz IBTOVGACAIMRTO-UHFFFAOYSA-N 0 1 305.437 4.368 20 0 DIADMN C/C=C/C[C@H]1CCCN(Cc2cc(OCC)c(OC)cc2F)C1 ZINC001474652228 1062383679 /nfs/dbraw/zinc/38/36/79/1062383679.db2.gz DKGJXSDEDPHFID-DRDHIDPGSA-N 0 1 321.436 4.411 20 0 DIADMN CC(C)(C)OC(=O)c1cccc(CN2CC(c3ccccc3)C2)c1 ZINC001474661653 1062391715 /nfs/dbraw/zinc/39/17/15/1062391715.db2.gz DAIYBBONFWLNJG-UHFFFAOYSA-N 0 1 323.436 4.241 20 0 DIADMN Fc1ccc(N2CCN([C@H]3C=CCCCCC3)CC2)c(Cl)c1 ZINC001459778171 1062391685 /nfs/dbraw/zinc/39/16/85/1062391685.db2.gz HJPYWYASCCONBC-INIZCTEOSA-N 0 1 322.855 4.490 20 0 DIADMN CCCC[C@@H](C)N[C@H](c1nc2ccccc2n1C)c1cccnc1 ZINC001255320005 1062395679 /nfs/dbraw/zinc/39/56/79/1062395679.db2.gz NHMBDDFFTZISDT-BEFAXECRSA-N 0 1 322.456 4.226 20 0 DIADMN Clc1ccccc1C1=CCN(CCc2ccns2)CC1 ZINC001459783582 1062396885 /nfs/dbraw/zinc/39/68/85/1062396885.db2.gz CQWGIRCXBLTNTL-UHFFFAOYSA-N 0 1 304.846 4.128 20 0 DIADMN CCCC[C@@H](C)N[C@H](c1nc2ccccc2n1C)c1ccncc1 ZINC001255320531 1062398496 /nfs/dbraw/zinc/39/84/96/1062398496.db2.gz RDFJDCGHHHMDSF-BEFAXECRSA-N 0 1 322.456 4.226 20 0 DIADMN CCc1oc2ccccc2c1C(=O)Nc1ccc(F)c(F)c1O ZINC001468788673 1062399567 /nfs/dbraw/zinc/39/95/67/1062399567.db2.gz HPJDJHWNAYTIFR-UHFFFAOYSA-N 0 1 317.291 4.231 20 0 DIADMN C[C@H]1CCC[C@H](C2CN(Cc3cnc(C(C)(C)C)nc3)C2)C1 ZINC001474676662 1062408529 /nfs/dbraw/zinc/40/85/29/1062408529.db2.gz RXCBROIJTATLHR-HOCLYGCPSA-N 0 1 301.478 4.032 20 0 DIADMN Cc1cccc([C@@H](C)N(C)Cc2cc(Br)cn2C)c1 ZINC001459803947 1062410453 /nfs/dbraw/zinc/41/04/53/1062410453.db2.gz LPTXCHDPXIWWRV-CYBMUJFWSA-N 0 1 321.262 4.289 20 0 DIADMN Brc1ccc(CN2CCC[C@H](C3CCC3)CC2)cn1 ZINC001474680514 1062410300 /nfs/dbraw/zinc/41/03/00/1062410300.db2.gz RNGIWGIMWPDSGX-HNNXBMFYSA-N 0 1 323.278 4.246 20 0 DIADMN Cc1cc(OCCC[C@H](C)N[C@@H](C)C(F)F)ccc1Cl ZINC001474681419 1062414260 /nfs/dbraw/zinc/41/42/60/1062414260.db2.gz GPDQLPJMRJUSBL-RYUDHWBXSA-N 0 1 305.796 4.439 20 0 DIADMN CN(Cc1nn(-c2ccccc2)c2c1CCC2)C[C@@H]1CC=CCC1 ZINC001459808980 1062415413 /nfs/dbraw/zinc/41/54/13/1062415413.db2.gz WEXQFPSSIDXTHC-QGZVFWFLSA-N 0 1 321.468 4.149 20 0 DIADMN CN(Cc1cc(F)ccc1Br)C[C@@H]1CC=CCC1 ZINC001459808795 1062415758 /nfs/dbraw/zinc/41/57/58/1062415758.db2.gz VWZZMWJFCXIXPW-GFCCVEGCSA-N 0 1 312.226 4.376 20 0 DIADMN C[C@@H](CN1CCc2cc(F)c(F)cc2C1)c1ccc(F)cc1 ZINC001474683704 1062416276 /nfs/dbraw/zinc/41/62/76/1062416276.db2.gz ADNLJAPKVLSBEJ-LBPRGKRZSA-N 0 1 305.343 4.266 20 0 DIADMN CC(C)(C)[C@@H]1C[C@H](NCc2noc3c2CC(C)(C)CC3)CS1 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COc1ccc(-c2ccc(CNCc3cnc(C)o3)s2)cc1 ZINC001461272323 1063380892 /nfs/dbraw/zinc/38/08/92/1063380892.db2.gz BCDUEOLZHUWWSS-UHFFFAOYSA-N 0 1 314.410 4.010 20 0 DIADMN CCOc1ccc(OC)cc1NCc1cnc(-c2ccccc2)[nH]1 ZINC001461285946 1063392159 /nfs/dbraw/zinc/39/21/59/1063392159.db2.gz GKUWFUJZPBYEOQ-UHFFFAOYSA-N 0 1 323.396 4.096 20 0 DIADMN Cc1ccc2c(c1)[C@@H](NC/C=C\c1ccc(F)cc1F)CO2 ZINC001461287940 1063392437 /nfs/dbraw/zinc/39/24/37/1063392437.db2.gz OZRZXVGJOLUGQM-KYVUIXNKSA-N 0 1 301.336 4.010 20 0 DIADMN CC(C)CCc1ccc(NCc2ccnn2-c2ccncc2)cc1 ZINC001461297574 1063400286 /nfs/dbraw/zinc/40/02/86/1063400286.db2.gz ATDIFJXAPZJWBW-UHFFFAOYSA-N 0 1 320.440 4.468 20 0 DIADMN CC[C@H]1CO[C@@H](C)CN1Cc1ccc(-c2cccs2)cc1 ZINC001473105266 1063402165 /nfs/dbraw/zinc/40/21/65/1063402165.db2.gz HFZZWWPFFIFRCX-YOEHRIQHSA-N 0 1 301.455 4.414 20 0 DIADMN CCCCN(Cc1ccn(-c2ccc(Cl)cc2)n1)C1CC1 ZINC001473106588 1063407118 /nfs/dbraw/zinc/40/71/18/1063407118.db2.gz RVRMEJJSMPSSDB-UHFFFAOYSA-N 0 1 303.837 4.290 20 0 DIADMN C[C@H](c1ccccc1F)N(C)C[C@H]1CCC[C@@H](C(F)(F)F)O1 ZINC001473110903 1063413528 /nfs/dbraw/zinc/41/35/28/1063413528.db2.gz CJEQREYACKOIHE-JMSVASOKSA-N 0 1 319.342 4.319 20 0 DIADMN CCN(c1ccc(NCc2c(C)nn(CC)c2C)cc1)C(C)C ZINC001461333155 1063424194 /nfs/dbraw/zinc/42/41/94/1063424194.db2.gz MYNMFWSFYFNSEM-UHFFFAOYSA-N 0 1 314.477 4.367 20 0 DIADMN Clc1cncc(Cl)c1CNCCCc1cccs1 ZINC001461348919 1063432214 /nfs/dbraw/zinc/43/22/14/1063432214.db2.gz XJWDRIYXUAESPB-UHFFFAOYSA-N 0 1 301.242 4.172 20 0 DIADMN Cc1nc(CN(C)[C@H]2CCC[C@H](C)C2)sc1Br ZINC001473127478 1063434116 /nfs/dbraw/zinc/43/41/16/1063434116.db2.gz HBUPBXIZGFQGEJ-ONGXEEELSA-N 0 1 317.296 4.225 20 0 DIADMN CC(C)(CNCc1csc(C(F)(F)F)n1)C1CCCC1 ZINC001461357149 1063439657 /nfs/dbraw/zinc/43/96/57/1063439657.db2.gz ZQGSHXNIXHVLDQ-UHFFFAOYSA-N 0 1 306.397 4.468 20 0 DIADMN C[N@H+](Cc1cccc(C(F)(F)F)c1)C[C@@H]1C[C@@H]2CCC[C@H]2O1 ZINC001473133057 1063439708 /nfs/dbraw/zinc/43/97/08/1063439708.db2.gz NXTBPAJGEDHJDV-CWRNSKLLSA-N 0 1 313.363 4.095 20 0 DIADMN CCC[N@H+](Cc1cc(F)ccc1Br)CC(C)C ZINC001473132161 1063441080 /nfs/dbraw/zinc/44/10/80/1063441080.db2.gz UPYPDJNWMWGTSE-UHFFFAOYSA-N 0 1 302.231 4.456 20 0 DIADMN CC1(C)CN([C@H]2COc3ccc(Cl)cc3C2)CCC1(F)F ZINC001257957152 1063446685 /nfs/dbraw/zinc/44/66/85/1063446685.db2.gz ORDADUPMMZPJFU-CYBMUJFWSA-N 0 1 315.791 4.011 20 0 DIADMN C[C@H](N[C@H]1COc2ccc(Cl)cc2C1)c1c(F)cccc1F ZINC001257952617 1063447266 /nfs/dbraw/zinc/44/72/66/1063447266.db2.gz JMYGQRGMEQDWTC-GXFFZTMASA-N 0 1 323.770 4.273 20 0 DIADMN CCCN(CCc1cccc(F)c1)[C@H](CC(C)C)C(=O)OCC ZINC001473158019 1063461897 /nfs/dbraw/zinc/46/18/97/1063461897.db2.gz QNKYGZOXTGTTNB-GOSISDBHSA-N 0 1 323.452 4.058 20 0 DIADMN CCC1(CC)[C@H](OC)C[C@@H]1NCc1c(F)ccc(F)c1Cl ZINC001461381283 1063462004 /nfs/dbraw/zinc/46/20/04/1063462004.db2.gz LGHIOHKLVDHTDE-UONOGXRCSA-N 0 1 317.807 4.302 20 0 DIADMN Cc1cc(CN[C@H]2CCCOc3c(F)cccc32)cnc1Cl ZINC001461387147 1063468313 /nfs/dbraw/zinc/46/83/13/1063468313.db2.gz FVXBFNGONCPHKY-HNNXBMFYSA-N 0 1 320.795 4.186 20 0 DIADMN FC1(F)CCC[C@@H]1CCN(Cc1cc[nH]n1)Cc1ccccc1 ZINC001473170112 1063471613 /nfs/dbraw/zinc/47/16/13/1063471613.db2.gz FDDBPZCVCOKWSL-MRXNPFEDSA-N 0 1 319.399 4.237 20 0 DIADMN CC[C@H]1c2ccccc2CCN1Cc1cc(OC(C)C)ccn1 ZINC001473169279 1063472191 /nfs/dbraw/zinc/47/21/91/1063472191.db2.gz WNNRZQPFENILJK-FQEVSTJZSA-N 0 1 310.441 4.378 20 0 DIADMN FC1(F)CCC[C@H]1CCN(Cc1cc[nH]n1)Cc1ccccc1 ZINC001473170111 1063473593 /nfs/dbraw/zinc/47/35/93/1063473593.db2.gz FDDBPZCVCOKWSL-INIZCTEOSA-N 0 1 319.399 4.237 20 0 DIADMN Cc1cnn(-c2ccncc2NCc2cccc(C(C)C)c2)c1 ZINC001461408255 1063478692 /nfs/dbraw/zinc/47/86/92/1063478692.db2.gz NMRNDAPTXCSZOL-UHFFFAOYSA-N 0 1 306.413 4.311 20 0 DIADMN CCCCn1nc(C)c(CNCCSCC(C)C)c1Cl ZINC001461407467 1063480388 /nfs/dbraw/zinc/48/03/88/1063480388.db2.gz ORZZCZWLMZACQW-UHFFFAOYSA-N 0 1 317.930 4.124 20 0 DIADMN C[C@]1(CN2CCc3c(Cl)cccc3C2)CC1(Cl)Cl ZINC001473178595 1063485050 /nfs/dbraw/zinc/48/50/50/1063485050.db2.gz 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Clc1cccc(Oc2ccccc2)c1CNC[C@H]1CCCO1 ZINC001461515393 1063548897 /nfs/dbraw/zinc/54/88/97/1063548897.db2.gz WIRFIZSDXCIZAX-OAHLLOKOSA-N 0 1 317.816 4.401 20 0 DIADMN COc1ccc(/C(C)=C\C(=O)Nc2cccc(Cl)c2O)cc1 ZINC001546332934 1063552451 /nfs/dbraw/zinc/55/24/51/1063552451.db2.gz PJRFWKFOCXEXBW-KHPPLWFESA-N 0 1 317.772 4.096 20 0 DIADMN O=C(Nc1cccc(Cl)c1O)c1ccc(C(F)F)c(F)c1 ZINC001546332956 1063552690 /nfs/dbraw/zinc/55/26/90/1063552690.db2.gz QMLPSTOWULOUJT-UHFFFAOYSA-N 0 1 315.678 4.375 20 0 DIADMN CC(C)(NCc1ccc(Br)nc1)c1ccccc1F ZINC001461540418 1063569525 /nfs/dbraw/zinc/56/95/25/1063569525.db2.gz GRAADJXZRSRPBC-UHFFFAOYSA-N 0 1 323.209 4.008 20 0 DIADMN CSCC[C@@H](C)N(Cc1cc(C)no1)Cc1ccccc1 ZINC001258226891 1063567852 /nfs/dbraw/zinc/56/78/52/1063567852.db2.gz SDMOYUQRJATKNX-OAHLLOKOSA-N 0 1 304.459 4.127 20 0 DIADMN Cc1cc(CN[C@@H](C)CC(C)(C)SCc2ccco2)no1 ZINC001258297619 1063595137 /nfs/dbraw/zinc/59/51/37/1063595137.db2.gz HTMFICGKXJOEJY-LBPRGKRZSA-N 0 1 308.447 4.156 20 0 DIADMN 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O[C@H]1C[C@@H](NCc2c(Cl)ccc(Cl)c2Cl)C12CCC2 ZINC001461648803 1063634725 /nfs/dbraw/zinc/63/47/25/1063634725.db2.gz WIICVQSMSLTSNC-NEPJUHHUSA-N 0 1 320.647 4.040 20 0 DIADMN O[C@@H]1C[C@H](NCc2c(Cl)ccc(Cl)c2Cl)C12CCC2 ZINC001461648805 1063635095 /nfs/dbraw/zinc/63/50/95/1063635095.db2.gz WIICVQSMSLTSNC-NWDGAFQWSA-N 0 1 320.647 4.040 20 0 DIADMN COc1ccc(CC[C@@H](C)N2Cc3cccc(OC)c3C2)cc1 ZINC001258407236 1063642806 /nfs/dbraw/zinc/64/28/06/1063642806.db2.gz XRYMZAQUSXSFQL-OAHLLOKOSA-N 0 1 311.425 4.041 20 0 DIADMN CC(C)Cc1ccccc1CNCc1nc2ccccc2n1C ZINC001461665368 1063644439 /nfs/dbraw/zinc/64/44/39/1063644439.db2.gz VOYGLPOSUAJFJS-UHFFFAOYSA-N 0 1 307.441 4.062 20 0 DIADMN CCCCC[C@H](CC)N1CC(N2Cc3ccccc3NC2=O)C1 ZINC001258443281 1063655807 /nfs/dbraw/zinc/65/58/07/1063655807.db2.gz KHCXHQZJRJIFOU-INIZCTEOSA-N 0 1 315.461 4.077 20 0 DIADMN CCCCC[C@@H](CC)N1CC(N2Cc3ccccc3NC2=O)C1 ZINC001258443282 1063656603 /nfs/dbraw/zinc/65/66/03/1063656603.db2.gz KHCXHQZJRJIFOU-MRXNPFEDSA-N 0 1 315.461 4.077 20 0 DIADMN C[C@H]1Sc2ccccc2N(C(=O)c2cccc(F)c2O)[C@@H]1C ZINC001515323390 1063667104 /nfs/dbraw/zinc/66/71/04/1063667104.db2.gz GMXKEZRVOFHTAL-GHMZBOCLSA-N 0 1 317.385 4.061 20 0 DIADMN CC(C)n1c(CNc2ccc3c[nH]nc3c2)nc2ccccc21 ZINC001461707406 1063672058 /nfs/dbraw/zinc/67/20/58/1063672058.db2.gz BQEHYJIHNMANGJ-UHFFFAOYSA-N 0 1 305.385 4.106 20 0 DIADMN COc1ccc(CNc2nc3cc(C)ccc3[nH]2)c(Cl)c1 ZINC001461708206 1063672461 /nfs/dbraw/zinc/67/24/61/1063672461.db2.gz GFSVHKXRMPFCTF-UHFFFAOYSA-N 0 1 301.777 4.145 20 0 DIADMN c1cc(OCC2CC2)ccc1CNc1ccc2c(n1)CCCC2 ZINC001461734090 1063685981 /nfs/dbraw/zinc/68/59/81/1063685981.db2.gz VEMLHMOODTUDQI-UHFFFAOYSA-N 0 1 308.425 4.361 20 0 DIADMN Cc1oc(C(C)(C)C)cc1CNCc1ccc2c(c1)C[C@H](C)O2 ZINC001461738928 1063688909 /nfs/dbraw/zinc/68/89/09/1063688909.db2.gz WUOIMSMQNCEBNX-ZDUSSCGKSA-N 0 1 313.441 4.499 20 0 DIADMN CC1(C)CC[C@H](NC2(c3ccccc3C(F)(F)F)COC2)C1 ZINC001258596071 1063699860 /nfs/dbraw/zinc/69/98/60/1063699860.db2.gz RQYZEBUIYMHNHP-LBPRGKRZSA-N 0 1 313.363 4.099 20 0 DIADMN CC(C)Cc1ccc(CNCc2nccc3c2CCCC3)cc1 ZINC001461756905 1063700051 /nfs/dbraw/zinc/70/00/51/1063700051.db2.gz XDRRIDDREKXINQ-UHFFFAOYSA-N 0 1 308.469 4.449 20 0 DIADMN Cc1nn(-c2ccc(Cl)cc2)cc1CNC(C)(C)/C=C/Cl ZINC001461764402 1063703713 /nfs/dbraw/zinc/70/37/13/1063703713.db2.gz HDLXBAYYJQBYBR-CMDGGOBGSA-N 0 1 324.255 4.455 20 0 DIADMN C[C@H](NCc1cc2ccncc2s1)c1c(F)cccc1F ZINC001461772007 1063708477 /nfs/dbraw/zinc/70/84/77/1063708477.db2.gz BPBRJLSKIBLIKQ-JTQLQIEISA-N 0 1 304.365 4.425 20 0 DIADMN CC(C)c1ccc(C[NH2+]CCc2c(F)cc([O-])cc2F)cc1 ZINC001461783311 1063714200 /nfs/dbraw/zinc/71/42/00/1063714200.db2.gz BZPFWOPIRPWRAS-UHFFFAOYSA-N 0 1 305.368 4.126 20 0 DIADMN C[C@H]1CC(C)(C)CC[C@H]1NC(=O)c1n[nH]c2ccc(Cl)cc21 ZINC001516036364 1063717285 /nfs/dbraw/zinc/71/72/85/1063717285.db2.gz GUGGHWBBFCUGSF-GXFFZTMASA-N 0 1 319.836 4.161 20 0 DIADMN C[C@@H](Cc1cccnc1)N1CCc2ccc(C(F)(F)F)cc2C1 ZINC001258627939 1063717413 /nfs/dbraw/zinc/71/74/13/1063717413.db2.gz MBZBJSZJTZZCSZ-ZDUSSCGKSA-N 0 1 320.358 4.090 20 0 DIADMN Cc1cc(CN(Cc2ccccc2)[C@@H](C)Cc2cccnc2)on1 ZINC001258633194 1063718557 /nfs/dbraw/zinc/71/85/57/1063718557.db2.gz GTRYUQAFFOBYNR-KRWDZBQOSA-N 0 1 321.424 4.011 20 0 DIADMN CC(C)c1nc(CN[C@H](C)c2ccc(F)cc2)c2ccccn21 ZINC001461794959 1063722580 /nfs/dbraw/zinc/72/25/80/1063722580.db2.gz ACENLDXMXUICDW-CQSZACIVSA-N 0 1 311.404 4.448 20 0 DIADMN Cc1ccc(Cl)cc1CNCc1nccc2c1CCCC2 ZINC001461796096 1063723011 /nfs/dbraw/zinc/72/30/11/1063723011.db2.gz MXKXHTQSPZYTEV-UHFFFAOYSA-N 0 1 300.833 4.212 20 0 DIADMN [O-]c1cccc(C[NH2+]C[C@H]2C[C@H]2Cc2ccccc2)c1Cl ZINC001461820059 1063734332 /nfs/dbraw/zinc/73/43/32/1063734332.db2.gz KFBKLXPNSMLKTC-HZPDHXFCSA-N 0 1 301.817 4.014 20 0 DIADMN C[C@H]1C[C@@H](NCC(F)(F)C2(O)CCCCC2)CC(C)(C)C1 ZINC001461819879 1063734720 /nfs/dbraw/zinc/73/47/20/1063734720.db2.gz VKVVPWMRMKJPID-UONOGXRCSA-N 0 1 303.437 4.121 20 0 DIADMN CCCCC[C@@H](CCC)N1Cc2cnn(CC)c2[C@@H](COC)C1 ZINC001258669268 1063738234 /nfs/dbraw/zinc/73/82/34/1063738234.db2.gz KBUAPDMVHOAVNB-QZTJIDSGSA-N 0 1 321.509 4.198 20 0 DIADMN C[C@H]1c2ccccc2CCN1Cc1cn(C)nc1C1CCCC1 ZINC001461842625 1063746360 /nfs/dbraw/zinc/74/63/60/1063746360.db2.gz KOTDBMXSSZGNTL-HNNXBMFYSA-N 0 1 309.457 4.197 20 0 DIADMN C[C@H](Cc1ccc(Cl)cc1Cl)N1CC(c2cccnc2)C1 ZINC001258683901 1063748699 /nfs/dbraw/zinc/74/86/99/1063748699.db2.gz IZPAVJVXDWWBIO-GFCCVEGCSA-N 0 1 321.251 4.419 20 0 DIADMN CC(C)[C@H](c1ccccc1)[N@@H+](C)Cc1ccc([O-])c(F)c1F ZINC001461855830 1063751408 /nfs/dbraw/zinc/75/14/08/1063751408.db2.gz XHHQYBCKZPNHIR-GOSISDBHSA-N 0 1 305.368 4.500 20 0 DIADMN CCc1ccc([C@H]2C[C@H](C)CCN2Cc2ccc(OC)o2)o1 ZINC001461879459 1063770230 /nfs/dbraw/zinc/77/02/30/1063770230.db2.gz FAHPAWPQDUOVDJ-CZUORRHYSA-N 0 1 303.402 4.417 20 0 DIADMN CC(C)CCOC1CCN(Cc2ccc(CC(C)C)nc2)CC1 ZINC001461879829 1063770621 /nfs/dbraw/zinc/77/06/21/1063770621.db2.gz FAHLEQUGAXNHAC-UHFFFAOYSA-N 0 1 318.505 4.307 20 0 DIADMN COCc1csc(CN2CC[C@H](C)C[C@@H]2c2ccco2)c1 ZINC001461877285 1063770663 /nfs/dbraw/zinc/77/06/63/1063770663.db2.gz ZPBGDDNLGJBJGJ-XJKSGUPXSA-N 0 1 305.443 4.461 20 0 DIADMN Oc1cc(Cl)cc(CN(CCC(F)(F)F)CC2CC2)c1 ZINC001461882625 1063772367 /nfs/dbraw/zinc/77/23/67/1063772367.db2.gz OUSIEKAOHWVIPW-UHFFFAOYSA-N 0 1 307.743 4.210 20 0 DIADMN CC[C@H]1C[N@@H+](Cc2cnc(C3CC3)nc2)CC[C@H]1c1ccccc1 ZINC001461886714 1063775902 /nfs/dbraw/zinc/77/59/02/1063775902.db2.gz XRKLMJUETWXYKU-FXAWDEMLSA-N 0 1 321.468 4.370 20 0 DIADMN C[C@@H]1C[C@H](c2ccc(F)cc2)C[N@@H+]1Cc1ccc([O-])c(F)c1F ZINC001461893990 1063782122 /nfs/dbraw/zinc/78/21/22/1063782122.db2.gz AUYLMYJZMKTSFL-RISCZKNCSA-N 0 1 321.342 4.188 20 0 DIADMN C[C@@H]1C[C@H](c2ccc(F)cc2)C[N@H+]1Cc1ccc([O-])c(F)c1F ZINC001461893990 1063782131 /nfs/dbraw/zinc/78/21/31/1063782131.db2.gz AUYLMYJZMKTSFL-RISCZKNCSA-N 0 1 321.342 4.188 20 0 DIADMN CCN(Cc1cnn(C)c1C1CC1)[C@H](C)c1ccc(F)cc1 ZINC001461895219 1063782283 /nfs/dbraw/zinc/78/22/83/1063782283.db2.gz FDNHHBXTUQZVCD-CYBMUJFWSA-N 0 1 301.409 4.020 20 0 DIADMN COC(=O)c1ccc(CN(C)Cc2cc3ccccc3o2)cc1C ZINC001461905200 1063788584 /nfs/dbraw/zinc/78/85/84/1063788584.db2.gz WFLGDDDAZNTGDT-UHFFFAOYSA-N 0 1 323.392 4.160 20 0 DIADMN Cc1sc(CN2CCC(C)(C)CC2)cc1Br ZINC001461909250 1063791579 /nfs/dbraw/zinc/79/15/79/1063791579.db2.gz LXDSQBDBTVVYHA-UHFFFAOYSA-N 0 1 302.281 4.441 20 0 DIADMN C[C@H](Cc1cccc(Cl)c1)N1CCOc2ccccc2C1 ZINC001258750596 1063796993 /nfs/dbraw/zinc/79/69/93/1063796993.db2.gz VBTRETFLQGVSHF-CQSZACIVSA-N 0 1 301.817 4.166 20 0 DIADMN Cc1cc(F)ncc1CN1C[C@H]2CCCC[C@@]21c1ccccc1 ZINC001461929022 1063813229 /nfs/dbraw/zinc/81/32/29/1063813229.db2.gz QKMJEQUMXPVRNN-UYAOXDASSA-N 0 1 310.416 4.430 20 0 DIADMN C[C@H]1c2ccccc2OCCN1Cc1ccc(OCC2CC2)cc1 ZINC001461934362 1063819140 /nfs/dbraw/zinc/81/91/40/1063819140.db2.gz JGNIJKDJRWUFKA-INIZCTEOSA-N 0 1 323.436 4.431 20 0 DIADMN CCC(CC)CN(CC)Cc1sc(N(C)C)nc1Cl ZINC001461939707 1063822362 /nfs/dbraw/zinc/82/23/62/1063822362.db2.gz KLXTZQLLKCIFJA-UHFFFAOYSA-N 0 1 303.903 4.121 20 0 DIADMN CCOC[C@@H]1CN([C@H](CC)C[C@H](C)CC)Cc2c1cnn2CC ZINC001258789632 1063828855 /nfs/dbraw/zinc/82/88/55/1063828855.db2.gz CHGBOJUJUHGUBX-IXDOHACOSA-N 0 1 321.509 4.054 20 0 DIADMN CC[C@H](C)C[C@H](CC)N1CCCn2cnc(COC(C)C)c2C1 ZINC001258794666 1063831065 /nfs/dbraw/zinc/83/10/65/1063831065.db2.gz MJDSSQVQCJKBIY-IRXDYDNUSA-N 0 1 321.509 4.229 20 0 DIADMN Cc1cccc(CN2CCC[C@@H]2c2ccc3c(c2)OCO3)c1F ZINC001461958207 1063838590 /nfs/dbraw/zinc/83/85/90/1063838590.db2.gz QESQHCYFOASYSV-MRXNPFEDSA-N 0 1 313.372 4.200 20 0 DIADMN Cc1c(Cl)ccc(CN2CCC[C@@H]2C[C@H](C)O)c1Cl ZINC001461956524 1063839716 /nfs/dbraw/zinc/83/97/16/1063839716.db2.gz SJWHNLRJPZFQRP-GXFFZTMASA-N 0 1 302.245 4.037 20 0 DIADMN COc1cccc2c(CN3CCC[C@@H]3c3cc(C)on3)cccc12 ZINC001461967057 1063844276 /nfs/dbraw/zinc/84/42/76/1063844276.db2.gz ZISFMDOXSPEMDR-LJQANCHMSA-N 0 1 322.408 4.482 20 0 DIADMN CC[C@H](C)N(CCc1ccccc1F)Cc1ncccc1F ZINC001461965538 1063846535 /nfs/dbraw/zinc/84/65/35/1063846535.db2.gz WVTMKTBFORSVEY-AWEZNQCLSA-N 0 1 304.384 4.203 20 0 DIADMN CC(C)CCCCN(Cc1nc2ccccc2c(=O)[nH]1)C(C)C ZINC001461964802 1063846772 /nfs/dbraw/zinc/84/67/72/1063846772.db2.gz PQUVTXCKTSVQCS-UHFFFAOYSA-N 0 1 315.461 4.372 20 0 DIADMN Cc1cnn(C)c1CN1CCCCC[C@@H]1c1ccc(Cl)cc1 ZINC001461971745 1063851108 /nfs/dbraw/zinc/85/11/08/1063851108.db2.gz VHKGQOHGLSGOPP-QGZVFWFLSA-N 0 1 317.864 4.499 20 0 DIADMN CCC[C@H](C)N(C)Cc1nc(-c2cccc(OC)c2)cs1 ZINC001461977416 1063853085 /nfs/dbraw/zinc/85/30/85/1063853085.db2.gz LVFHLSVQZFFERX-ZDUSSCGKSA-N 0 1 304.459 4.439 20 0 DIADMN CCOc1cc(F)cc(CN(C)[C@H](C)c2sc(C)nc2C)c1 ZINC001461977521 1063853701 /nfs/dbraw/zinc/85/37/01/1063853701.db2.gz ULDVTLIJDOXVQK-GFCCVEGCSA-N 0 1 322.449 4.491 20 0 DIADMN CC[C@H](Cc1ccccc1)N1CCc2nc(Cl)ccc2C1 ZINC001258849722 1063867217 /nfs/dbraw/zinc/86/72/17/1063867217.db2.gz SOGGUVOMRUENGD-MRXNPFEDSA-N 0 1 300.833 4.114 20 0 DIADMN Brc1sccc1CN(C1CC1)C1CCCC1 ZINC001462043173 1063897814 /nfs/dbraw/zinc/89/78/14/1063897814.db2.gz CTFSCJHFHQOEJO-UHFFFAOYSA-N 0 1 300.265 4.418 20 0 DIADMN CCn1ccc(CN2CCC(CCc3ccc(C)cc3)CC2)n1 ZINC001462006068 1063875323 /nfs/dbraw/zinc/87/53/23/1063875323.db2.gz BEDDLKNWAFRILH-UHFFFAOYSA-N 0 1 311.473 4.056 20 0 DIADMN Cc1ccc(C)c(N2CCN(C/C=C/c3cccc(F)c3)CC2)c1 ZINC001462014207 1063877646 /nfs/dbraw/zinc/87/76/46/1063877646.db2.gz AGIVGKLZZCWBJM-GQCTYLIASA-N 0 1 324.443 4.278 20 0 DIADMN COC(=O)c1ccc(CN(C)[C@H](C)c2ccccc2F)cc1C ZINC001462020755 1063882431 /nfs/dbraw/zinc/88/24/31/1063882431.db2.gz URRYJLPYDJXHEA-CQSZACIVSA-N 0 1 315.388 4.114 20 0 DIADMN CN(C(=O)c1ccc(O)c(Cl)c1)[C@@H]1CCC[C@H]1C(C)(C)C ZINC001299556694 1063882561 /nfs/dbraw/zinc/88/25/61/1063882561.db2.gz IKFYGCQGWPOHIU-TZMCWYRMSA-N 0 1 309.837 4.332 20 0 DIADMN C[C@H](c1cccc(Cl)c1F)[N@H+]1CC[C@@]2(O)CCCC[C@H]2C1 ZINC000480568140 1063884896 /nfs/dbraw/zinc/88/48/96/1063884896.db2.gz ORDHTHAPWNNVPU-IGCXYCKISA-N 0 1 311.828 4.167 20 0 DIADMN C[C@H](c1cccc(Cl)c1F)N1CC[C@@]2(O)CCCC[C@H]2C1 ZINC000480568140 1063884900 /nfs/dbraw/zinc/88/49/00/1063884900.db2.gz ORDHTHAPWNNVPU-IGCXYCKISA-N 0 1 311.828 4.167 20 0 DIADMN Cc1ccc(S(=O)(=O)Nc2csc(Cl)c2)cc1Cl ZINC001259130355 1063885430 /nfs/dbraw/zinc/88/54/30/1063885430.db2.gz MQNBAAXCCPSRLI-UHFFFAOYSA-N 0 1 322.238 4.164 20 0 DIADMN Cc1ccccc1CN1CCN(Cc2ccc3occc3c2)CC1 ZINC001462022974 1063887525 /nfs/dbraw/zinc/88/75/25/1063887525.db2.gz ZSWXKHABLYUZRR-UHFFFAOYSA-N 0 1 320.436 4.059 20 0 DIADMN CC[C@H](C)c1ccccc1NS(=O)(=O)c1ccccc1OC ZINC001259294177 1063887744 /nfs/dbraw/zinc/88/77/44/1063887744.db2.gz HMJGHJKKSDDMMZ-ZDUSSCGKSA-N 0 1 319.426 4.010 20 0 DIADMN COc1ccccc1CN(C)C/C=C/c1ccc(F)cc1F ZINC001462028202 1063889178 /nfs/dbraw/zinc/88/91/78/1063889178.db2.gz LRIVSMIQVTWNDO-FNORWQNLSA-N 0 1 303.352 4.119 20 0 DIADMN CCc1cccc(F)c1CN(C)CCOc1ccccc1C ZINC001462026702 1063889744 /nfs/dbraw/zinc/88/97/44/1063889744.db2.gz PIRIBBMYLVNDEI-UHFFFAOYSA-N 0 1 301.405 4.207 20 0 DIADMN Cn1cccc1[C@@H]1CCCN1Cc1ccc(C(F)F)c(F)c1 ZINC001462032051 1063890741 /nfs/dbraw/zinc/89/07/41/1063890741.db2.gz RGYGPTRLTZDDTN-INIZCTEOSA-N 0 1 308.347 4.439 20 0 DIADMN COCCN(C/C=C\c1ccc(F)cc1F)Cc1cccs1 ZINC001462031658 1063890822 /nfs/dbraw/zinc/89/08/22/1063890822.db2.gz GZMIIBFZRHNODL-RQOWECAXSA-N 0 1 323.408 4.188 20 0 DIADMN CN(Cc1c(F)cccc1Cl)CC1Cc2ccccc2C1 ZINC001462038003 1063894778 /nfs/dbraw/zinc/89/47/78/1063894778.db2.gz LZUJTKBIHFGPCH-UHFFFAOYSA-N 0 1 303.808 4.326 20 0 DIADMN CC(C)c1ccc(C[C@@H]2CC[N@@H+](Cc3ncccc3F)C2)cc1 ZINC001462049577 1063901132 /nfs/dbraw/zinc/90/11/32/1063901132.db2.gz FXTHGGPYNFGSOO-KRWDZBQOSA-N 0 1 312.432 4.409 20 0 DIADMN O=S(=O)(Cc1cccc(Cl)c1)Nc1cccc2ccoc21 ZINC001260834431 1063906135 /nfs/dbraw/zinc/90/61/35/1063906135.db2.gz RTGQSEHAUVCSEB-UHFFFAOYSA-N 0 1 321.785 4.028 20 0 DIADMN CCOC(=O)c1ccc(CN2CCCC[C@@H]2c2ccccc2)o1 ZINC001462055140 1063906948 /nfs/dbraw/zinc/90/69/48/1063906948.db2.gz PIOKMZJCAVPRDF-QGZVFWFLSA-N 0 1 313.397 4.184 20 0 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1 303.793 4.153 20 0 DIADMN COc1ccc([C@H](C)N[C@@H](C)c2ccc(F)cc2F)cc1OC ZINC000078970958 185137196 /nfs/dbraw/zinc/13/71/96/185137196.db2.gz AMHINQDSKPMVAY-RYUDHWBXSA-N 0 1 321.367 4.394 20 0 DIADMN COCCCCN(Cc1nc(C)c(C)s1)Cc1ccccc1 ZINC000088579828 185258592 /nfs/dbraw/zinc/25/85/92/185258592.db2.gz WDDPPSKKEJXWJA-UHFFFAOYSA-N 0 1 318.486 4.189 20 0 DIADMN Cc1csc(CN2CC[C@H](CSc3ccccc3)C2)n1 ZINC000088602236 185259685 /nfs/dbraw/zinc/25/96/85/185259685.db2.gz MJGBEMLOYFOXLL-AWEZNQCLSA-N 0 1 304.484 4.066 20 0 DIADMN CCC(CC)(NCc1ccc(CO)o1)c1ccc(Cl)cc1 ZINC000088725844 185263767 /nfs/dbraw/zinc/26/37/67/185263767.db2.gz IKGJCVIBNJQZPU-UHFFFAOYSA-N 0 1 307.821 4.230 20 0 DIADMN c1ccc([C@H]2CCC[C@@H]2NCc2nc(C3CCCC3)no2)cc1 ZINC000133675250 334963474 /nfs/dbraw/zinc/96/34/74/334963474.db2.gz NDKKIPNHPTYODC-SJORKVTESA-N 0 1 311.429 4.153 20 0 DIADMN CCOc1ccc(CN[C@H]2CCCc3occc32)cc1OCC ZINC000069058481 190796140 /nfs/dbraw/zinc/79/61/40/190796140.db2.gz HWPOQTAFFRLQKZ-INIZCTEOSA-N 0 1 315.413 4.244 20 0 DIADMN CCCOc1ccc(CN[C@H](C)c2ccc(C)o2)cc1OC ZINC000072672158 191212444 /nfs/dbraw/zinc/21/24/44/191212444.db2.gz GWGSGNYWVLCFCT-CQSZACIVSA-N 0 1 303.402 4.236 20 0 DIADMN CSCC[C@H](C)N(C)Cc1nc2ccccc2n1C(F)F ZINC000072666034 191210968 /nfs/dbraw/zinc/21/09/68/191210968.db2.gz IWBCEOLUDZMBCG-NSHDSACASA-N 0 1 313.417 4.005 20 0 DIADMN C[C@H]1CCCCN1CC(=O)Nc1ccccc1-c1ccccc1 ZINC000003538850 181031769 /nfs/dbraw/zinc/03/17/69/181031769.db2.gz SIFQSFXDTQMHOE-INIZCTEOSA-N 0 1 308.425 4.167 20 0 DIADMN NCc1cc(C(=O)Nc2ccccc2SC2CCCC2)co1 ZINC000187402999 200107487 /nfs/dbraw/zinc/10/74/87/200107487.db2.gz RMSDDZLWFFJTEY-UHFFFAOYSA-N 0 1 316.426 4.025 20 0 DIADMN Cc1nc2c(s1)[C@H](N[C@@H](C)c1cccc(F)c1F)CCC2 ZINC000090963402 192966372 /nfs/dbraw/zinc/96/63/72/192966372.db2.gz FLBZVUGENAXNSL-TVQRCGJNSA-N 0 1 308.397 4.458 20 0 DIADMN COc1ccc([C@H](NCc2nc(C)c(C)s2)C(C)C)cc1 ZINC000091349926 193045234 /nfs/dbraw/zinc/04/52/34/193045234.db2.gz DBZCOCGIMYEMKV-QGZVFWFLSA-N 0 1 304.459 4.255 20 0 DIADMN COC[C@H](N[C@@H](C)c1ccc(OC)cc1)c1ccc(F)c(F)c1 ZINC000091413243 193052951 /nfs/dbraw/zinc/05/29/51/193052951.db2.gz DRGYAJVDWDEJGU-SGTLLEGYSA-N 0 1 321.367 4.012 20 0 DIADMN C[C@H](N[C@@H]1CCO[C@@H]1c1ccc(Cl)c(F)c1)c1ccco1 ZINC000091412531 193053085 /nfs/dbraw/zinc/05/30/85/193053085.db2.gz YONMUFZTJZXYFK-DRZCJDIDSA-N 0 1 309.768 4.253 20 0 DIADMN Cc1cc(CN[C@@H](C)c2ccccn2)ccc1Br ZINC000091467380 193060521 /nfs/dbraw/zinc/06/05/21/193060521.db2.gz AICAYSUAIVSPJX-LBPRGKRZSA-N 0 1 305.219 4.003 20 0 DIADMN CO[C@@H](C)CN(Cc1csc(-c2ccsc2)n1)C(C)C ZINC000353797599 335011993 /nfs/dbraw/zinc/01/19/93/335011993.db2.gz RXHIKEQEZYYRSE-LBPRGKRZSA-N 0 1 310.488 4.117 20 0 DIADMN CN(C(=O)Nc1ccc2nc(C(F)F)[nH]c2c1)C1CCCCC1 ZINC000093351130 193236361 /nfs/dbraw/zinc/23/63/61/193236361.db2.gz HXTZFUDABDYNSA-UHFFFAOYSA-N 0 1 322.359 4.297 20 0 DIADMN C[C@H](NCCc1csc(-c2ccccc2)n1)c1nccs1 ZINC000093370429 193239972 /nfs/dbraw/zinc/23/99/72/193239972.db2.gz QAUCZOPZGQTYTH-LBPRGKRZSA-N 0 1 315.467 4.160 20 0 DIADMN C[C@@H](NCCc1csc(-c2ccccc2)n1)c1nccs1 ZINC000093370430 193240105 /nfs/dbraw/zinc/24/01/05/193240105.db2.gz QAUCZOPZGQTYTH-GFCCVEGCSA-N 0 1 315.467 4.160 20 0 DIADMN Cc1nc(-c2ccccc2)sc1[C@H](C)N(C)Cc1cnc[nH]1 ZINC000093612719 193273553 /nfs/dbraw/zinc/27/35/53/193273553.db2.gz MLARWXKXQFZKHJ-ZDUSSCGKSA-N 0 1 312.442 4.035 20 0 DIADMN Cc1nn(C)c(C)c1CN[C@H](C)c1ccc(Cl)c(Cl)c1 ZINC000017315003 182083052 /nfs/dbraw/zinc/08/30/52/182083052.db2.gz YIKNDUZMMOSRJK-SECBINFHSA-N 0 1 312.244 4.195 20 0 DIADMN COc1ccccc1[C@H](C)NCc1ccc(Br)cc1 ZINC000020096568 182185841 /nfs/dbraw/zinc/18/58/41/182185841.db2.gz SJMOBGDCYGXPQL-LBPRGKRZSA-N 0 1 320.230 4.309 20 0 DIADMN Brc1ccc(CN[C@@H]2CCCc3occc32)cc1 ZINC000020203837 182197638 /nfs/dbraw/zinc/19/76/38/182197638.db2.gz WHPBQCBZNUAGDV-CQSZACIVSA-N 0 1 306.203 4.209 20 0 DIADMN C[C@@H](N[C@H]1CCc2cc(Br)ccc21)c1ccccn1 ZINC000040226435 183048129 /nfs/dbraw/zinc/04/81/29/183048129.db2.gz CHAODZPOMNHZGZ-BZNIZROVSA-N 0 1 317.230 4.182 20 0 DIADMN COc1cc(CNCc2ccccc2Cl)ccc1OC(C)C ZINC000040729502 183125309 /nfs/dbraw/zinc/12/53/09/183125309.db2.gz GLFKQDBENAQUOP-UHFFFAOYSA-N 0 1 319.832 4.426 20 0 DIADMN c1cc2c(s1)CCC[C@H]2NCc1cnn(Cc2ccccc2)c1 ZINC000102196834 193867733 /nfs/dbraw/zinc/86/77/33/193867733.db2.gz GHXGRQZAWNAJHI-GOSISDBHSA-N 0 1 323.465 4.160 20 0 DIADMN Cc1ccc(CN[C@H](C)c2ccc(Br)s2)cn1 ZINC000062051519 184203167 /nfs/dbraw/zinc/20/31/67/184203167.db2.gz VBHXIPUQWSMXEV-SNVBAGLBSA-N 0 1 311.248 4.065 20 0 DIADMN OC[C@H](N[C@H]1CCSc2ccc(Cl)cc21)c1ccccc1 ZINC000063000274 184265614 /nfs/dbraw/zinc/26/56/14/184265614.db2.gz ULVDVVZWSJKMJH-HOTGVXAUSA-N 0 1 319.857 4.200 20 0 DIADMN Cc1nn(-c2ccccc2)c(C)c1CN[C@@H](C)c1cnccc1C ZINC000271474560 129920716 /nfs/dbraw/zinc/92/07/16/129920716.db2.gz RRMDZHQUGOMCQT-HNNXBMFYSA-N 0 1 320.440 4.043 20 0 DIADMN COc1cccc(C2(N[C@@H](C)c3ccc(Cl)nc3)CC2)c1 ZINC000272343461 130021852 /nfs/dbraw/zinc/02/18/52/130021852.db2.gz ZYOGUXIAXASPKR-LBPRGKRZSA-N 0 1 302.805 4.084 20 0 DIADMN Brc1cccc(CNC2(c3ccccc3)CCC2)n1 ZINC000272374400 130023645 /nfs/dbraw/zinc/02/36/45/130023645.db2.gz CIGGVZVIUWTUAL-UHFFFAOYSA-N 0 1 317.230 4.013 20 0 DIADMN COc1c(O)cccc1CNCc1cc(C)cc2c(C)c(C)[nH]c21 ZINC000272369676 130023885 /nfs/dbraw/zinc/02/38/85/130023885.db2.gz GLHRPGQTEWBLPW-UHFFFAOYSA-N 0 1 324.424 4.097 20 0 DIADMN COc1c(O)cccc1CNC1(c2ccc(Cl)cc2)CCC1 ZINC000272369706 130024815 /nfs/dbraw/zinc/02/48/15/130024815.db2.gz GMGCNBBEEMVDOM-UHFFFAOYSA-N 0 1 317.816 4.223 20 0 DIADMN CC[C@@H](N[C@H](CCOC)c1ccco1)c1cc(C)ccc1OC ZINC000272534544 130038571 /nfs/dbraw/zinc/03/85/71/130038571.db2.gz JQQFTQSOIVORIU-IAGOWNOFSA-N 0 1 317.429 4.415 20 0 DIADMN COCC[C@H](NCc1csc2ccccc12)c1ccco1 ZINC000272539210 130038769 /nfs/dbraw/zinc/03/87/69/130038769.db2.gz KWACNNTYAIBKLV-HNNXBMFYSA-N 0 1 301.411 4.362 20 0 DIADMN C[C@@H](N[C@@H](C)Cc1ccccc1C(F)(F)F)c1cscn1 ZINC000272566116 130042023 /nfs/dbraw/zinc/04/20/23/130042023.db2.gz OHBAMQJHCQAOQU-WDEREUQCSA-N 0 1 314.376 4.444 20 0 DIADMN COCC[C@H](NCc1cccc(-c2ccccn2)c1)c1ccco1 ZINC000272607413 130044914 /nfs/dbraw/zinc/04/49/14/130044914.db2.gz UAIMTRZTWYOTFT-IBGZPJMESA-N 0 1 322.408 4.209 20 0 DIADMN COCC[C@@H](NCc1ccc(C(F)(F)F)cc1)c1ccco1 ZINC000272608209 130045295 /nfs/dbraw/zinc/04/52/95/130045295.db2.gz UDPAJQUAHNKAPZ-CQSZACIVSA-N 0 1 313.319 4.166 20 0 DIADMN CCc1nc(C)c([C@@H](C)N[C@H](CCOC)c2ccco2)s1 ZINC000272621847 130046334 /nfs/dbraw/zinc/04/63/34/130046334.db2.gz YHMKRNXILKQZFV-DGCLKSJQSA-N 0 1 308.447 4.035 20 0 DIADMN Cc1ccncc1[C@H](C)N[C@H]1CCCOc2c(F)cccc21 ZINC000272662053 130051970 /nfs/dbraw/zinc/05/19/70/130051970.db2.gz RPYQUKRAKIZWIY-GUYCJALGSA-N 0 1 300.377 4.094 20 0 DIADMN CC[C@@H](N[C@@H](C)c1cncc(F)c1)c1ccc(OC)c(OC)c1 ZINC000272720861 130057381 /nfs/dbraw/zinc/05/73/81/130057381.db2.gz FKAOCHNOUFGPSU-BLLLJJGKSA-N 0 1 318.392 4.040 20 0 DIADMN COc1ncc(CN[C@@H](CC(C)C)c2ccccn2)cc1Cl ZINC000272882541 130070936 /nfs/dbraw/zinc/07/09/36/130070936.db2.gz VUXPIFQWOIABDO-INIZCTEOSA-N 0 1 319.836 4.016 20 0 DIADMN CO[C@@H](C)c1nc(CNC2CC(c3cccc(F)c3)C2)cs1 ZINC000272935533 130076098 /nfs/dbraw/zinc/07/60/98/130076098.db2.gz LBXZLYGTNKHHPV-ZOODHJKOSA-N 0 1 320.433 4.025 20 0 DIADMN COc1ccnc(CN[C@H](c2ccc(F)cc2)C(C)(C)C)c1 ZINC000273329056 130108610 /nfs/dbraw/zinc/10/86/10/130108610.db2.gz LQFARRVAGBTFOX-QGZVFWFLSA-N 0 1 302.393 4.106 20 0 DIADMN CC(C)c1nc([C@@H](C)N[C@@H]2CCCc3c(Cl)cccc32)n[nH]1 ZINC000273485575 130128199 /nfs/dbraw/zinc/12/81/99/130128199.db2.gz NGHAIZVTZSDQMM-IAQYHMDHSA-N 0 1 318.852 4.310 20 0 DIADMN Cc1ccc(CN[C@@H](C)c2cc(Br)ncc2F)cc1 ZINC000273841653 130176270 /nfs/dbraw/zinc/17/62/70/130176270.db2.gz HVOFVTDSMUQXLA-NSHDSACASA-N 0 1 323.209 4.142 20 0 DIADMN CCC1(CNC(=O)c2c[nH]c3ccccc3c2=O)CCCCC1 ZINC000273920448 130187198 /nfs/dbraw/zinc/18/71/98/130187198.db2.gz ZJBQVKUHMZCTNC-UHFFFAOYSA-N 0 1 312.413 4.031 20 0 DIADMN Cc1nnc([C@@H](C)N[C@H]2CC=C(c3ccc(F)cc3)CC2)s1 ZINC000274278289 130223976 /nfs/dbraw/zinc/22/39/76/130223976.db2.gz XYLLALGGTNOJJQ-BZNIZROVSA-N 0 1 317.433 4.272 20 0 DIADMN C[C@H](c1cccc(Cl)c1)N(C)Cc1cn(C)nc1C(F)F ZINC000274439454 130235291 /nfs/dbraw/zinc/23/52/91/130235291.db2.gz BLWAOTKZNAFMKY-SNVBAGLBSA-N 0 1 313.779 4.204 20 0 DIADMN C[C@@H](c1cccc(Cl)c1)N(C)Cc1cn(C)nc1C(F)F ZINC000274439452 130235998 /nfs/dbraw/zinc/23/59/98/130235998.db2.gz BLWAOTKZNAFMKY-JTQLQIEISA-N 0 1 313.779 4.204 20 0 DIADMN CN(Cc1cn(C)nc1C(F)F)Cc1ccc2ccccc2c1 ZINC000274494684 130241310 /nfs/dbraw/zinc/24/13/10/130241310.db2.gz PWGCRXVKISFKCB-UHFFFAOYSA-N 0 1 315.367 4.143 20 0 DIADMN COCC[C@H](N[C@@H](C)c1sccc1OC)c1ccc(C)o1 ZINC000274610155 130249598 /nfs/dbraw/zinc/24/95/98/130249598.db2.gz SRIIJJWNYYUOFZ-STQMWFEESA-N 0 1 309.431 4.087 20 0 DIADMN Cc1n[nH]c(C(F)F)c1NC(=O)c1coc2cc(C)c(C)cc12 ZINC000274728257 130257163 /nfs/dbraw/zinc/25/71/63/130257163.db2.gz TXDILQNXHZEESN-UHFFFAOYSA-N 0 1 319.311 4.271 20 0 DIADMN Cc1cc2c(cc1C)[C@@H](N[C@@H](CO)c1ccccc1)CCS2 ZINC000275386840 130313017 /nfs/dbraw/zinc/31/30/17/130313017.db2.gz YEEWEIRDGUZFGS-ROUUACIJSA-N 0 1 313.466 4.164 20 0 DIADMN COCCC1(CNc2ccc3c(c2)CN(C)C3)CCCCC1 ZINC000275430326 130318981 /nfs/dbraw/zinc/31/89/81/130318981.db2.gz CVZFQNSZEDHSGY-UHFFFAOYSA-N 0 1 302.462 4.031 20 0 DIADMN CC[C@H](NCc1ccccc1OCCOC)c1cccc(F)c1 ZINC000275662667 130356963 /nfs/dbraw/zinc/35/69/63/130356963.db2.gz BKPCLZYTXRDTAG-SFHVURJKSA-N 0 1 317.404 4.092 20 0 DIADMN Cc1cc([C@H](C)NCc2ccc(NC(=O)C(C)C)cc2)c(C)o1 ZINC000278336610 130683012 /nfs/dbraw/zinc/68/30/12/130683012.db2.gz WYLUJHOYJLAGCU-AWEZNQCLSA-N 0 1 314.429 4.342 20 0 DIADMN COC(=O)c1coc([C@H](C)N[C@@H](c2ccccc2C)C2CC2)c1 ZINC000278906466 130726024 /nfs/dbraw/zinc/72/60/24/130726024.db2.gz ZTHMOPUCVOBGDP-SCLBCKFNSA-N 0 1 313.397 4.177 20 0 DIADMN Cn1ccnc1[C@H](N[C@@H]1CCC12CCC2)c1ccc(Cl)cc1 ZINC000282038258 130898190 /nfs/dbraw/zinc/89/81/90/130898190.db2.gz FWTOQRVLWSVGJO-HZPDHXFCSA-N 0 1 315.848 4.085 20 0 DIADMN Cc1cc(CN[C@@H](c2ccc(Cl)c(Cl)c2)C2CC2)n(C)n1 ZINC000284093710 131048419 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301.773 4.396 20 0 DIADMN CCC[C@H](C)C(=O)Nc1cc(Br)cc(Cl)c1O ZINC000534206790 333568418 /nfs/dbraw/zinc/56/84/18/333568418.db2.gz YGDUCYFSJHOGLZ-ZETCQYMHSA-N 0 1 320.614 4.183 20 0 DIADMN COc1cc(C)nc(CN[C@@H](c2ccc(Cl)cc2)C2CC2)c1 ZINC000411442235 333672898 /nfs/dbraw/zinc/67/28/98/333672898.db2.gz WGINRKCBCOKKCL-GOSISDBHSA-N 0 1 316.832 4.293 20 0 DIADMN COC(=O)c1cc(CN[C@H](C)c2ccc(Cl)s2)cs1 ZINC000411542638 333690903 /nfs/dbraw/zinc/69/09/03/333690903.db2.gz YOWZONTWDONWMF-MRVPVSSYSA-N 0 1 315.847 4.100 20 0 DIADMN CO[C@](C)([C@@H](C)NCc1csc(C2CCCC2)n1)C1CC1 ZINC000411934588 333714183 /nfs/dbraw/zinc/71/41/83/333714183.db2.gz AGVNJGAPBLDZTM-SJKOYZFVSA-N 0 1 308.491 4.094 20 0 DIADMN CCc1noc(C)c1CN[C@H](C)c1cc2c(s1)CCCC2 ZINC000571349381 333770085 /nfs/dbraw/zinc/77/00/85/333770085.db2.gz MRGAJLVAIADQLX-LLVKDONJSA-N 0 1 304.459 4.337 20 0 DIADMN CC[C@@H](C)Sc1ccc(NC(=O)[C@@H](CC)N(C)C)c(C)c1 ZINC000413275633 333841283 /nfs/dbraw/zinc/84/12/83/333841283.db2.gz 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CCC(CC)(NCc1ccc(C)nn1)c1ccc(Cl)cc1 ZINC000414389691 333957750 /nfs/dbraw/zinc/95/77/50/333957750.db2.gz GVENJLKFZFRTJC-UHFFFAOYSA-N 0 1 303.837 4.244 20 0 DIADMN CCc1ncc(CN[C@H](c2ccccc2Cl)C(C)C)cn1 ZINC000414397230 333960693 /nfs/dbraw/zinc/96/06/93/333960693.db2.gz TWBLQYKSJSMYGJ-KRWDZBQOSA-N 0 1 303.837 4.179 20 0 DIADMN Cc1ccc(CN[C@H]2C[C@H]3CCC(C)(C)c4cccc2c43)nn1 ZINC000414423465 333969601 /nfs/dbraw/zinc/96/96/01/333969601.db2.gz AHFSKAVJDFVPIE-KDOFPFPSSA-N 0 1 307.441 4.175 20 0 DIADMN COc1ccc2oc([C@@H](C)NCc3scnc3C)c(C)c2c1 ZINC000266209863 333972171 /nfs/dbraw/zinc/97/21/71/333972171.db2.gz NZMVTUMFKGXEIQ-GFCCVEGCSA-N 0 1 316.426 4.366 20 0 DIADMN Cc1nn(C(C)C)cc1CN1CC[C@@H](c2c(F)cccc2F)C1 ZINC000343549535 335171595 /nfs/dbraw/zinc/17/15/95/335171595.db2.gz GUMGCLLCPVXDEV-CQSZACIVSA-N 0 1 319.399 4.040 20 0 DIADMN Cc1ncc([C@H](C)N[C@@H]2CCc3cc(Cl)ccc32)c(C)n1 ZINC000269033381 333997678 /nfs/dbraw/zinc/99/76/78/333997678.db2.gz SEIHOIXKIAFNLE-APPDUMDISA-N 0 1 301.821 4.085 20 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DIADMN CC1=C[C@H](C)CN([C@H](C)c2nnc(-c3cccc(Cl)c3)o2)C1 ZINC000430261871 334039528 /nfs/dbraw/zinc/03/95/28/334039528.db2.gz KJRFJRVFUNAYCU-WCQYABFASA-N 0 1 317.820 4.349 20 0 DIADMN COCC[C@H](N[C@@H](C)c1ccc(OC)c(C)c1)c1ccco1 ZINC000272801616 334039649 /nfs/dbraw/zinc/03/96/49/334039649.db2.gz ARZGTTMTBIXYFB-HOCLYGCPSA-N 0 1 303.402 4.025 20 0 DIADMN Cc1ccc(-c2nc(CNCCOC(C)(C)C)cs2)cc1 ZINC000522197563 334041197 /nfs/dbraw/zinc/04/11/97/334041197.db2.gz ADYXXDVVXKVSLQ-UHFFFAOYSA-N 0 1 304.459 4.023 20 0 DIADMN C/C(=C/c1cccc(Cl)c1)c1nc([C@H](N)CC(C)C)no1 ZINC000414615265 334041211 /nfs/dbraw/zinc/04/12/11/334041211.db2.gz IHGCFXLRJQNTBN-KOTGUFOOSA-N 0 1 305.809 4.329 20 0 DIADMN CC(C)(C)c1nnc(CNC2CC(c3cccc(F)c3)C2)s1 ZINC000272970665 334041536 /nfs/dbraw/zinc/04/15/36/334041536.db2.gz RUEROZQOCTVAIJ-UHFFFAOYSA-N 0 1 319.449 4.011 20 0 DIADMN CC(C)C[C@@H](N)c1noc([C@@H](C)Cc2ccccc2Cl)n1 ZINC000414622862 334044934 /nfs/dbraw/zinc/04/49/34/334044934.db2.gz SWWIXVDMNFGAKC-SMDDNHRTSA-N 0 1 307.825 4.115 20 0 DIADMN CC(C)C[C@@H](N)c1noc([C@@H](C)CSCc2ccccc2)n1 ZINC000414625442 334045897 /nfs/dbraw/zinc/04/58/97/334045897.db2.gz WUDCWQGGCSXLTC-DZGCQCFKSA-N 0 1 319.474 4.152 20 0 DIADMN CC(C)C[C@@H](N)c1noc(-c2cccc3c4c([nH]c32)CCCC4)n1 ZINC000414627049 334046187 /nfs/dbraw/zinc/04/61/87/334046187.db2.gz YPKCNQSRKSYRNZ-OAHLLOKOSA-N 0 1 324.428 4.143 20 0 DIADMN Cc1cccc2c1[C@H](C)C[C@@H]2Cc1nc([C@@H](N)CC(C)C)no1 ZINC000414627721 334046514 /nfs/dbraw/zinc/04/65/14/334046514.db2.gz ZRHCGRIDYLZQQF-FMKPAKJESA-N 0 1 313.445 4.257 20 0 DIADMN Cc1cccc2c1[C@H](C)C[C@H]2Cc1nc([C@@H](N)CC(C)C)no1 ZINC000414627728 334046518 /nfs/dbraw/zinc/04/65/18/334046518.db2.gz ZRHCGRIDYLZQQF-YCPHGPKFSA-N 0 1 313.445 4.257 20 0 DIADMN NC1(c2noc(C3=C(c4ccccc4)CCCC3)n2)CCCC1 ZINC000414630396 334047616 /nfs/dbraw/zinc/04/76/16/334047616.db2.gz UAYMDHNOUCZQAC-UHFFFAOYSA-N 0 1 309.413 4.282 20 0 DIADMN C[N@@H+](CCCC(=O)[O-])Cc1ccc(-c2ccccc2Cl)s1 ZINC000414635332 334049416 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IVUPVSLPKHAPIE-OLZOCXBDSA-N 0 1 309.866 4.253 20 0 DIADMN CC[C@H](NCc1cnc(OC)c(Cl)c1)c1ccccc1F ZINC000295051331 334216043 /nfs/dbraw/zinc/21/60/43/334216043.db2.gz POJWITIFIICFJB-HNNXBMFYSA-N 0 1 308.784 4.124 20 0 DIADMN C[C@@H]1C[C@@H](NCc2ccccc2OC(F)F)c2ccccc2O1 ZINC000295117540 334218818 /nfs/dbraw/zinc/21/88/18/334218818.db2.gz WBPSPVAQLDCZIV-IUODEOHRSA-N 0 1 319.351 4.290 20 0 DIADMN CCC(CC)n1ccc(CN2CCC[C@@H](c3ccncc3)C2)n1 ZINC000295675180 334226545 /nfs/dbraw/zinc/22/65/45/334226545.db2.gz BRRQGFLMRSOJLD-QGZVFWFLSA-N 0 1 312.461 4.019 20 0 DIADMN Fc1cc(Cl)ccc1CNCc1ccc2c(c1)CCCN2 ZINC000414983329 334227010 /nfs/dbraw/zinc/22/70/10/334227010.db2.gz SZPBJSPYVQTZGH-UHFFFAOYSA-N 0 1 304.796 4.127 20 0 DIADMN CCOc1ccccc1CN[C@@H]1CCCc2nc(Cl)ccc21 ZINC000295923577 334228381 /nfs/dbraw/zinc/22/83/81/334228381.db2.gz JXIJQGAKJOVGAW-OAHLLOKOSA-N 0 1 316.832 4.301 20 0 DIADMN Fc1c(Cl)cccc1CNCc1ccc2c(c1)CCCN2 ZINC000414988273 334229196 /nfs/dbraw/zinc/22/91/96/334229196.db2.gz 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CSCc1cc(F)ccc1CNCc1cn(C(C)C)nc1C ZINC000341367754 334435940 /nfs/dbraw/zinc/43/59/40/334435940.db2.gz AIGQTSJQNNUOSH-UHFFFAOYSA-N 0 1 321.465 4.064 20 0 DIADMN COc1ccc2c(c1)[C@H](NCc1ccc(Cl)c(C)c1)CCO2 ZINC000341552538 334457561 /nfs/dbraw/zinc/45/75/61/334457561.db2.gz GRNRZYIGCLUAHD-QGZVFWFLSA-N 0 1 317.816 4.270 20 0 DIADMN CC[C@H](NCc1nnc(C(C)C)o1)C12CC3CC(CC(C3)C1)C2 ZINC000341813486 334485082 /nfs/dbraw/zinc/48/50/82/334485082.db2.gz RMQLVIWUDNSXJS-DZPQGLOJSA-N 0 1 317.477 4.278 20 0 DIADMN COc1ccc(CN[C@@H]2CCCc3cc(F)ccc32)c(F)c1 ZINC000341881519 334489377 /nfs/dbraw/zinc/48/93/77/334489377.db2.gz RSKSUMUYPCSSQO-GOSISDBHSA-N 0 1 303.352 4.141 20 0 DIADMN CC[C@H](NCc1c(C)nc2ccccn21)c1cc(F)ccc1F ZINC000342001700 334500063 /nfs/dbraw/zinc/50/00/63/334500063.db2.gz LERLZLHAASHYAK-INIZCTEOSA-N 0 1 315.367 4.162 20 0 DIADMN C[C@H](NCc1ccc([S@@](C)=O)cc1)c1cc2ccccc2o1 ZINC000342293628 334525612 /nfs/dbraw/zinc/52/56/12/334525612.db2.gz BRIIKOCGNALILT-WHEQGISXSA-N 0 1 313.422 4.021 20 0 DIADMN Cc1ccc2c(c1)[C@@H](NCc1nccn1-c1ccccc1)CCC2 ZINC000342318920 334532124 /nfs/dbraw/zinc/53/21/24/334532124.db2.gz UAPPDVRTQOZVOQ-FQEVSTJZSA-N 0 1 317.436 4.348 20 0 DIADMN Cc1cccc(N2CCN(CCCCC(F)(F)F)CC2)c1C ZINC000443463220 338452222 /nfs/dbraw/zinc/45/22/22/338452222.db2.gz BWOKOTSSBKZLNJ-UHFFFAOYSA-N 0 1 314.395 4.158 20 0 DIADMN CCc1cnccc1[C@@H](C)N[C@@H](C)c1cnc(OC)c(Cl)c1 ZINC000342695527 334562363 /nfs/dbraw/zinc/56/23/63/334562363.db2.gz AGZOJPXBFDXHKZ-NWDGAFQWSA-N 0 1 319.836 4.113 20 0 DIADMN CCOc1ccc(CN[C@H]2CCCc3occc32)cc1Cl ZINC000342805917 334578364 /nfs/dbraw/zinc/57/83/64/334578364.db2.gz LLFZWHLYCBSBPV-HNNXBMFYSA-N 0 1 305.805 4.499 20 0 DIADMN COc1cc([C@@H](C)NCc2scnc2C)ccc1OC(C)C ZINC000343163485 334604987 /nfs/dbraw/zinc/60/49/87/334604987.db2.gz SDCXYNTXJHPSIZ-GFCCVEGCSA-N 0 1 320.458 4.098 20 0 DIADMN Cc1nc(CN2CCC(COc3ccccc3)CC2)c(C)s1 ZINC000443623962 338457647 /nfs/dbraw/zinc/45/76/47/338457647.db2.gz FKDINESRNGOEPV-UHFFFAOYSA-N 0 1 316.470 4.051 20 0 DIADMN 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310.507 4.121 20 0 DIADMN CC(C)(C)c1ncc(CN2CCC(OC3CCCC3)CC2)s1 ZINC000092758942 337908039 /nfs/dbraw/zinc/90/80/39/337908039.db2.gz MIWWXJSESRUBOL-UHFFFAOYSA-N 0 1 322.518 4.364 20 0 DIADMN COc1ccc([C@@H](NCc2cccn2C)c2ccc(C)cc2)cc1 ZINC000537290951 337928509 /nfs/dbraw/zinc/92/85/09/337928509.db2.gz SVBTUEFSBOTEEV-NRFANRHFSA-N 0 1 320.436 4.221 20 0 DIADMN COc1ccc([C@H](NCc2cccn2C)c2ccc(C)cc2)cc1 ZINC000537290954 337928531 /nfs/dbraw/zinc/92/85/31/337928531.db2.gz SVBTUEFSBOTEEV-OAQYLSRUSA-N 0 1 320.436 4.221 20 0 DIADMN C[C@H](NCc1ccccc1OC(F)(F)F)c1ccsc1 ZINC000061360651 337934999 /nfs/dbraw/zinc/93/49/99/337934999.db2.gz CUHQCUIBDBMBMH-JTQLQIEISA-N 0 1 301.333 4.498 20 0 DIADMN C[C@@H](NCc1cc(Cl)c2c(c1)OCCCO2)c1ccsc1 ZINC000061361112 337935099 /nfs/dbraw/zinc/93/50/99/337935099.db2.gz DHVXTYATTZPEAW-LLVKDONJSA-N 0 1 323.845 4.414 20 0 DIADMN COc1ccc(C2(N[C@@H](C)c3cc(F)c(F)c(F)c3)CC2)cc1 ZINC000537422605 337935724 /nfs/dbraw/zinc/93/57/24/337935724.db2.gz NIQCKFXIKLIQDK-NSHDSACASA-N 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CCc1nc(C)c(CN2CC=C(c3cccc(Cl)c3)CC2)o1 ZINC000428956918 338066624 /nfs/dbraw/zinc/06/66/24/338066624.db2.gz PFHYKGGUUPGUGI-UHFFFAOYSA-N 0 1 316.832 4.488 20 0 DIADMN C[C@H]1CN(Cc2ccc(F)c3cccnc23)Cc2ccccc2O1 ZINC000429162472 338072315 /nfs/dbraw/zinc/07/23/15/338072315.db2.gz SIPOWBKMQZOQGJ-AWEZNQCLSA-N 0 1 322.383 4.157 20 0 DIADMN CCCC(C)(C)CC(=O)Nc1[nH]nc(-c2ccc(C)o2)c1C ZINC000429218432 338073676 /nfs/dbraw/zinc/07/36/76/338073676.db2.gz VFUWWPWYEPUDER-UHFFFAOYSA-N 0 1 303.406 4.441 20 0 DIADMN CC(C)(NCCCCC(F)(F)F)c1cc(C(F)(F)F)on1 ZINC000429258415 338075116 /nfs/dbraw/zinc/07/51/16/338075116.db2.gz VCQAMRMIFGVIAI-UHFFFAOYSA-N 0 1 318.261 4.251 20 0 DIADMN CSC[C@@H]1CCCN(Cc2sc(C)nc2C(F)(F)F)C1 ZINC000429283640 338075997 /nfs/dbraw/zinc/07/59/97/338075997.db2.gz HQXOWVCZLZJSEK-SNVBAGLBSA-N 0 1 324.437 4.045 20 0 DIADMN CSC[C@H]1CCCN(Cc2csc(-c3ccccc3)n2)C1 ZINC000429294576 338076811 /nfs/dbraw/zinc/07/68/11/338076811.db2.gz NFJXEENLMLBIDU-AWEZNQCLSA-N 0 1 318.511 4.385 20 0 DIADMN Cc1cc(C)n(-c2ccc(CN(C)Cc3occc3C)cc2)n1 ZINC000429390882 338079416 /nfs/dbraw/zinc/07/94/16/338079416.db2.gz AUYYTEKQRBEZSH-UHFFFAOYSA-N 0 1 309.413 4.023 20 0 DIADMN Fc1ccc([C@H](N[C@@H]2CC23CCCC3)c2cccnc2)c(F)c1 ZINC000429420296 338080396 /nfs/dbraw/zinc/08/03/96/338080396.db2.gz CQGXCFDRQZWJNM-QZTJIDSGSA-N 0 1 314.379 4.372 20 0 DIADMN C[C@H]1CC[C@H](N(C)Cc2nnc(-c3ccccc3Cl)o2)C1 ZINC000429570015 338084451 /nfs/dbraw/zinc/08/44/51/338084451.db2.gz NVESOAXAWUYTIU-RYUDHWBXSA-N 0 1 305.809 4.010 20 0 DIADMN C[C@H]1CC[C@@H](N(C)Cc2nnc(-c3ccc(Cl)cc3)o2)C1 ZINC000429587312 338085370 /nfs/dbraw/zinc/08/53/70/338085370.db2.gz FKIJKSZESFNBDB-SMDDNHRTSA-N 0 1 305.809 4.010 20 0 DIADMN Fc1ccc(Cl)c(CN2CCC(c3ccncc3)CC2)c1 ZINC000429593973 338085588 /nfs/dbraw/zinc/08/55/88/338085588.db2.gz UDWFDDWGOAWIRH-UHFFFAOYSA-N 0 1 304.796 4.254 20 0 DIADMN O=C1C[C@H]2CC[C@@H](C1)N2Cc1sc2ccccc2c1Cl ZINC000429685507 338087234 /nfs/dbraw/zinc/08/72/34/338087234.db2.gz WSYBDFBVOQDYPP-PHIMTYICSA-N 0 1 305.830 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/nfs/dbraw/zinc/39/96/58/339399658.db2.gz JGOLTMOBCYLPQL-INIZCTEOSA-N 0 1 323.392 4.227 20 0 DIADMN COc1ccc2nc(CNCc3cc4ccccc4[nH]3)sc2c1 ZINC000474355292 339410659 /nfs/dbraw/zinc/41/06/59/339410659.db2.gz LQHFSNPZBDJYKZ-UHFFFAOYSA-N 0 1 323.421 4.076 20 0 DIADMN CCCCSCCC(=O)Nc1cc(F)cc(Cl)c1O ZINC000474447870 339414041 /nfs/dbraw/zinc/41/40/41/339414041.db2.gz RCMIZQBBHXVKBH-UHFFFAOYSA-N 0 1 305.802 4.047 20 0 DIADMN O=C(C/C=C\c1ccc(F)cc1)Nc1cc(F)cc(Cl)c1O ZINC000474436807 339414538 /nfs/dbraw/zinc/41/45/38/339414538.db2.gz NZKMXEWNROYULN-UPHRSURJSA-N 0 1 323.726 4.366 20 0 DIADMN CCc1cccc(F)c1CNCc1ccc(OC)c(Cl)c1 ZINC000474822971 339428380 /nfs/dbraw/zinc/42/83/80/339428380.db2.gz RDXOGKJWNCONOS-UHFFFAOYSA-N 0 1 307.796 4.340 20 0 DIADMN CC(C)[C@@H]1C[C@@H](NCc2c(F)cccc2OC(F)F)CS1 ZINC000475425776 339451173 /nfs/dbraw/zinc/45/11/73/339451173.db2.gz VBWWYZWORAHNFX-YGRLFVJLSA-N 0 1 319.392 4.047 20 0 DIADMN COCC1=CCN(c2cc(C)nc3c(C)cc(Cl)cc23)CC1 ZINC000475720370 339460271 /nfs/dbraw/zinc/46/02/71/339460271.db2.gz CNEOMNCWHXYXTI-UHFFFAOYSA-N 0 1 316.832 4.288 20 0 DIADMN CC(C)COc1ccccc1CNCc1ccc2c(c1)COC2 ZINC000477298835 339491834 /nfs/dbraw/zinc/49/18/34/339491834.db2.gz DHMQTLVIPXLTAF-UHFFFAOYSA-N 0 1 311.425 4.041 20 0 DIADMN CCOC[C@H](C)NC1(c2cc(C(F)(F)F)ccc2Cl)CC1 ZINC000477849104 339502479 /nfs/dbraw/zinc/50/24/79/339502479.db2.gz AWKDCXYMSBWYNH-JTQLQIEISA-N 0 1 321.770 4.363 20 0 DIADMN CC(C)=CCCN[C@@H](c1cccnc1)c1ccc(F)cc1F ZINC000479269032 339530127 /nfs/dbraw/zinc/53/01/27/339530127.db2.gz JOOCIBCKQQHDEW-SFHVURJKSA-N 0 1 302.368 4.395 20 0 DIADMN OC[C@H](N[C@H]1CCC12CCCC2)c1c(Cl)cccc1Cl ZINC000479510470 339538631 /nfs/dbraw/zinc/53/86/31/339538631.db2.gz IWIJRSLKUBCKQG-KBPBESRZSA-N 0 1 314.256 4.339 20 0 DIADMN CCCc1cccc(CNCC(=O)Nc2c(C)cc(C)cc2C)c1 ZINC000479522809 339539214 /nfs/dbraw/zinc/53/92/14/339539214.db2.gz CEZXJZOIJKCBLJ-UHFFFAOYSA-N 0 1 324.468 4.293 20 0 DIADMN CCc1noc(CC)c1CN[C@@H]1CCc2ccc(Cl)cc21 ZINC000479554954 339540950 /nfs/dbraw/zinc/54/09/50/339540950.db2.gz GWOXIWUYLMUWQE-MRXNPFEDSA-N 0 1 304.821 4.230 20 0 DIADMN COc1cc(C)ccc1CN[C@H]1CCc2ccc(Cl)cc21 ZINC000479560104 339541325 /nfs/dbraw/zinc/54/13/25/339541325.db2.gz XHXAPNJLWVTZQY-KRWDZBQOSA-N 0 1 301.817 4.434 20 0 DIADMN Cc1coc2ccc(NS(=O)(=O)c3ccccc3Cl)cc12 ZINC000479570138 339541629 /nfs/dbraw/zinc/54/16/29/339541629.db2.gz ORYBBMIBTDWYGG-UHFFFAOYSA-N 0 1 321.785 4.195 20 0 DIADMN C[C@@H](CNCc1csc(-c2ccsc2)n1)C(F)(F)F ZINC000479583452 339542402 /nfs/dbraw/zinc/54/24/02/339542402.db2.gz XMPURNMVDQTECV-QMMMGPOBSA-N 0 1 306.378 4.160 20 0 DIADMN C[C@@H](CNCc1csc(-c2ccccc2)n1)C(F)(F)F ZINC000479592176 339542737 /nfs/dbraw/zinc/54/27/37/339542737.db2.gz QHYRKCQFCFRXAS-JTQLQIEISA-N 0 1 300.349 4.098 20 0 DIADMN COC[C@@H](Cc1ccccc1)N[C@H](c1ccco1)c1ccccc1 ZINC000480158920 339561053 /nfs/dbraw/zinc/56/10/53/339561053.db2.gz AHZQWFPEIVXCKZ-CTNGQTDRSA-N 0 1 321.420 4.216 20 0 DIADMN C[C@H](CCCC(F)(F)F)NCc1nnc(C(C)(C)C)s1 ZINC000480171870 339561909 /nfs/dbraw/zinc/56/19/09/339561909.db2.gz RJAATAUXWDEOCL-SECBINFHSA-N 0 1 309.401 4.046 20 0 DIADMN C[C@@H](CCCC(F)(F)F)NCc1nnc(C(C)(C)C)s1 ZINC000480171877 339561962 /nfs/dbraw/zinc/56/19/62/339561962.db2.gz RJAATAUXWDEOCL-VIFPVBQESA-N 0 1 309.401 4.046 20 0 DIADMN C[C@H]1CCc2ccccc2[C@@H]1NCc1nccn1-c1ccccc1 ZINC000480245382 339564914 /nfs/dbraw/zinc/56/49/14/339564914.db2.gz ILMUJWQJODPXRQ-HRAATJIYSA-N 0 1 317.436 4.286 20 0 DIADMN CCCCc1ccc([C@H](C)NCc2cccnc2N(C)C)cc1 ZINC000480775768 339586830 /nfs/dbraw/zinc/58/68/30/339586830.db2.gz QFGVOKKROMHFOA-INIZCTEOSA-N 0 1 311.473 4.341 20 0 DIADMN Cc1ccc(C(=O)CCN[C@H](C)c2c(F)cccc2F)cc1 ZINC000480883356 339589558 /nfs/dbraw/zinc/58/95/58/339589558.db2.gz URGZWYGZLBMFOW-CYBMUJFWSA-N 0 1 303.352 4.197 20 0 DIADMN Cc1ccn2cc(CN[C@H]3c4cccc(F)c4CC[C@H]3C)nc2c1 ZINC000482495821 339633432 /nfs/dbraw/zinc/63/34/32/339633432.db2.gz PPAIBQGIGXJJSC-JLTOFOAXSA-N 0 1 323.415 4.195 20 0 DIADMN CCc1ccc([C@@H](CC)NCc2cn3ccc(C)cc3n2)cc1 ZINC000482514516 339634292 /nfs/dbraw/zinc/63/42/92/339634292.db2.gz VSXBUXVYJPAREW-LJQANCHMSA-N 0 1 307.441 4.446 20 0 DIADMN COc1ccc2oc(CNC3(c4ccc(F)cc4)CC3)cc2c1 ZINC000482542984 339635241 /nfs/dbraw/zinc/63/52/41/339635241.db2.gz HRLWYWCUTVIMNS-UHFFFAOYSA-N 0 1 311.356 4.359 20 0 DIADMN COc1cccc(CNCc2ccc(-c3cccc(C)c3)cc2)n1 ZINC000483322610 339661640 /nfs/dbraw/zinc/66/16/40/339661640.db2.gz TXIJDIIBORFHIB-UHFFFAOYSA-N 0 1 318.420 4.355 20 0 DIADMN C[C@H](CC1CCCC1)N[C@@H](C)c1nc(Cc2ccccc2)no1 ZINC000483659158 339671172 /nfs/dbraw/zinc/67/11/72/339671172.db2.gz KIHFUAKFELNETP-CABCVRRESA-N 0 1 313.445 4.280 20 0 DIADMN CCc1cnccc1[C@H](C)NCc1cc(OC)ccc1Cl ZINC000483724026 339672857 /nfs/dbraw/zinc/67/28/57/339672857.db2.gz FQDKUPNZMPXKMI-LBPRGKRZSA-N 0 1 304.821 4.157 20 0 DIADMN CO[C@@H]1CCCC[C@H]1NCc1coc(-c2ccc(Cl)cc2)n1 ZINC000483725569 339672975 /nfs/dbraw/zinc/67/29/75/339672975.db2.gz MWSHTJBLJCULJK-HZPDHXFCSA-N 0 1 320.820 4.042 20 0 DIADMN CCCC[C@@H](CC)C(=O)NC[C@@H](c1ccco1)N1CCCCC1 ZINC000483733608 339673233 /nfs/dbraw/zinc/67/32/33/339673233.db2.gz PPHWVKKEBJVCAX-SJORKVTESA-N 0 1 320.477 4.139 20 0 DIADMN COc1cccc([C@@H](C)NCc2cc(F)ccc2SC)c1 ZINC000483842904 339675988 /nfs/dbraw/zinc/67/59/88/339675988.db2.gz RPTBOVMVZJWGFS-GFCCVEGCSA-N 0 1 305.418 4.407 20 0 DIADMN COc1ccc([C@@H](C)NCc2ccc(F)cn2)c2ccccc12 ZINC000484807803 339693578 /nfs/dbraw/zinc/69/35/78/339693578.db2.gz DDFUDTWCNZYOGU-CYBMUJFWSA-N 0 1 310.372 4.233 20 0 DIADMN CCSc1cccc(F)c1NC(=O)c1ccc(C(C)=O)s1 ZINC000484938007 339696178 /nfs/dbraw/zinc/69/61/78/339696178.db2.gz PNNUROGAUQASPI-UHFFFAOYSA-N 0 1 323.414 4.454 20 0 DIADMN FC(F)(F)c1ccc(Cl)c(C2(NC[C@H]3CCCO3)CC2)c1 ZINC000485009597 339697363 /nfs/dbraw/zinc/69/73/63/339697363.db2.gz CSEZJVHBTPMAKU-LLVKDONJSA-N 0 1 319.754 4.117 20 0 DIADMN CC[C@H]1CCCCN1C(=O)[C@@H](C)N[C@H](C)c1cccc(Cl)c1 ZINC000485895758 339715710 /nfs/dbraw/zinc/71/57/10/339715710.db2.gz DYOLSFHIBNTGOT-CPUCHLNUSA-N 0 1 322.880 4.170 20 0 DIADMN COc1cccc([C@@H](C)NCc2cnc(-c3ccco3)s2)c1 ZINC000486950778 339739514 /nfs/dbraw/zinc/73/95/14/339739514.db2.gz NAEAINIEQUAEIR-GFCCVEGCSA-N 0 1 314.410 4.263 20 0 DIADMN CCc1ccc(CN[C@@H](COC)c2ccc(Cl)cc2)s1 ZINC000487170053 339745110 /nfs/dbraw/zinc/74/51/10/339745110.db2.gz WANGTRYVKWDOFX-INIZCTEOSA-N 0 1 309.862 4.441 20 0 DIADMN CCOc1c(Cl)cccc1CNCc1ccnc(SC)c1 ZINC000487576083 339758281 /nfs/dbraw/zinc/75/82/81/339758281.db2.gz PDJSYEAEFCCFCW-UHFFFAOYSA-N 0 1 322.861 4.145 20 0 DIADMN Cc1ccc(C[C@@H](C)C(=O)Nc2cccc(Cl)c2O)cc1 ZINC000489125560 339802137 /nfs/dbraw/zinc/80/21/37/339802137.db2.gz IEGYWRVAYVPLIK-GFCCVEGCSA-N 0 1 303.789 4.171 20 0 DIADMN COc1ccc(CNC2(c3ccc(F)cc3)CC2)cc1Cl ZINC000489638409 339814759 /nfs/dbraw/zinc/81/47/59/339814759.db2.gz ZXRYVTRLKNMMFA-UHFFFAOYSA-N 0 1 305.780 4.267 20 0 DIADMN CC[C@@H](NCc1ccc(OC(C)C)cc1)c1ccc(F)cn1 ZINC000490184614 339828186 /nfs/dbraw/zinc/82/81/86/339828186.db2.gz MIFBWSGZEGWURA-QGZVFWFLSA-N 0 1 302.393 4.249 20 0 DIADMN Fc1ccc([C@H](NC[C@@H]2CCCO2)c2ccccc2Cl)cc1 ZINC000491260643 339855454 /nfs/dbraw/zinc/85/54/54/339855454.db2.gz QGJJHMASMHMBRM-YJBOKZPZSA-N 0 1 319.807 4.337 20 0 DIADMN CCCC[C@H]1CCC[C@@H]1NCc1noc(-c2ccsc2)n1 ZINC000492874949 339911261 /nfs/dbraw/zinc/91/12/61/339911261.db2.gz QTBUIIIGYGFMEF-JSGCOSHPSA-N 0 1 305.447 4.247 20 0 DIADMN FC(F)(F)c1cnc(SCCN2CCCCC2)c(Cl)c1 ZINC000494022069 339939123 /nfs/dbraw/zinc/93/91/23/339939123.db2.gz DQONHXYRVKOYER-UHFFFAOYSA-N 0 1 324.799 4.332 20 0 DIADMN Cc1ccc(O)c(CN[C@@H](C)c2cc(Cl)ccc2Cl)n1 ZINC000494228804 339944210 /nfs/dbraw/zinc/94/42/10/339944210.db2.gz YBHFXFDWCPLOTI-JTQLQIEISA-N 0 1 311.212 4.253 20 0 DIADMN CCCc1csc(CN[C@H]2CCCc3cc(OC)ccc32)n1 ZINC000494344024 339947033 /nfs/dbraw/zinc/94/70/33/339947033.db2.gz BBKWHYDGEWNZIY-KRWDZBQOSA-N 0 1 316.470 4.271 20 0 DIADMN COc1cccc(-c2ccc(CNCc3cncc(F)c3)cc2)c1 ZINC000494573771 339953789 /nfs/dbraw/zinc/95/37/89/339953789.db2.gz HRUJEUBSJPVPDV-UHFFFAOYSA-N 0 1 322.383 4.186 20 0 DIADMN CO[C@H](c1ccccc1)[C@H](C)N[C@@H]1COc2ccc(Cl)cc21 ZINC000494590132 339954288 /nfs/dbraw/zinc/95/42/88/339954288.db2.gz CWUWZXSPVAAULP-XZOAIXRZSA-N 0 1 317.816 4.139 20 0 DIADMN Fc1cncc(CNCc2ccc(OC3CCCCC3)cc2)c1 ZINC000494599973 339954700 /nfs/dbraw/zinc/95/47/00/339954700.db2.gz HJPZTJXXOYGFDT-UHFFFAOYSA-N 0 1 314.404 4.222 20 0 DIADMN Cc1ccsc1[C@@H](CO)NC1c2ccccc2-c2ccccc21 ZINC000494635160 339956091 /nfs/dbraw/zinc/95/60/91/339956091.db2.gz IUMXMAYAHTVUNZ-GOSISDBHSA-N 0 1 321.445 4.450 20 0 DIADMN O=C(Nc1ccccc1)C1(NCc2csc3ccccc23)CC1 ZINC000495146559 339976283 /nfs/dbraw/zinc/97/62/83/339976283.db2.gz KTJYAWKVVLJUFA-UHFFFAOYSA-N 0 1 322.433 4.162 20 0 DIADMN CC[C@@H](CC1CCCC1)C(=O)NCc1nc2cccc(C)c2[nH]1 ZINC000498630407 340021195 /nfs/dbraw/zinc/02/11/95/340021195.db2.gz MKHPSLPQVREVIK-HNNXBMFYSA-N 0 1 313.445 4.094 20 0 DIADMN FC(F)[C@H](CCc1ccccc1)NC1CCC(F)(F)CC1 ZINC000498771510 340023098 /nfs/dbraw/zinc/02/30/98/340023098.db2.gz TXXGEXKAQKJGNH-AWEZNQCLSA-N 0 1 303.343 4.420 20 0 DIADMN CCOc1cc(C)ccc1CN[C@@H](c1ccc(F)cn1)C(C)C ZINC000498925563 340026072 /nfs/dbraw/zinc/02/60/72/340026072.db2.gz RSIFQTWGHBRDLL-LJQANCHMSA-N 0 1 316.420 4.415 20 0 DIADMN COC1CCC(CN[C@H](CCc2ccccc2)C(F)F)CC1 ZINC000498926245 340026095 /nfs/dbraw/zinc/02/60/95/340026095.db2.gz DMLCZOHXRRGXQQ-OFLPRAFFSA-N 0 1 311.416 4.048 20 0 DIADMN C[C@H](CC(=O)OC(C)(C)C)NCc1cc(Cl)sc1Cl ZINC000498925758 340026156 /nfs/dbraw/zinc/02/61/56/340026156.db2.gz CIBVOZBLPKZBTI-MRVPVSSYSA-N 0 1 324.273 4.265 20 0 DIADMN CCc1ccccc1NC(=O)[C@H](C)[N@H+]1CCCc2ccccc2C1 ZINC000498924354 340026179 /nfs/dbraw/zinc/02/61/79/340026179.db2.gz VFDJCIQWMIVQMB-INIZCTEOSA-N 0 1 322.452 4.024 20 0 DIADMN CCc1ccccc1NC(=O)[C@H](C)N1CCCc2ccccc2C1 ZINC000498924354 340026180 /nfs/dbraw/zinc/02/61/80/340026180.db2.gz VFDJCIQWMIVQMB-INIZCTEOSA-N 0 1 322.452 4.024 20 0 DIADMN c1c2ccccc2oc1[C@H](N[C@@H]1CCCSC1)c1cccnc1 ZINC000498930363 340026287 /nfs/dbraw/zinc/02/62/87/340026287.db2.gz QLCZTGVWUAPLSM-VQIMIIECSA-N 0 1 324.449 4.402 20 0 DIADMN Cc1ccc(NC(=O)[C@@H](C)N2CCCc3ccccc3C2)c(C)c1 ZINC000498943583 340026853 /nfs/dbraw/zinc/02/68/53/340026853.db2.gz XTDBNUYYVYQBHR-QGZVFWFLSA-N 0 1 322.452 4.079 20 0 DIADMN c1c2ccccc2oc1[C@H](NC[C@H]1CCCS1)c1cccnc1 ZINC000498951414 340026898 /nfs/dbraw/zinc/02/68/98/340026898.db2.gz MCEJYGTTWYTGID-VQIMIIECSA-N 0 1 324.449 4.402 20 0 DIADMN Cc1nccc(N2C[C@@H](c3ccccc3)OC[C@@H]2C)c1Cl ZINC000499110954 340030084 /nfs/dbraw/zinc/03/00/84/340030084.db2.gz MCQXBSPZSWEDFK-LRDDRELGSA-N 0 1 302.805 4.010 20 0 DIADMN C[C@@H](O)CN[C@@H](c1ccccc1)c1cc(Cl)ccc1Cl ZINC000499617590 340041207 /nfs/dbraw/zinc/04/12/07/340041207.db2.gz GAIIRKBSLVLCSE-BZNIZROVSA-N 0 1 310.224 4.053 20 0 DIADMN C[C@@H](NC[C@](C)(O)C(F)(F)F)c1cc2cc(Cl)ccc2o1 ZINC000499624733 340041360 /nfs/dbraw/zinc/04/13/60/340041360.db2.gz JIDACOIZUFSKQO-OQPBUACISA-N 0 1 321.726 4.050 20 0 DIADMN CCC[C@H](CC1CCCCC1)C(=O)N1CCN(C2CCC2)CC1 ZINC000499623055 340041422 /nfs/dbraw/zinc/04/14/22/340041422.db2.gz UJQDBERSEQJGAL-GOSISDBHSA-N 0 1 320.521 4.070 20 0 DIADMN CC(C)n1nccc1CN[C@@H](C)c1cc2cccc(F)c2o1 ZINC000499707895 340042989 /nfs/dbraw/zinc/04/29/89/340042989.db2.gz KABODURKWFJDBR-LBPRGKRZSA-N 0 1 301.365 4.200 20 0 DIADMN COC(=O)c1nc([C@@H]2CCCN2C[C@@H](C)CC(C)C)sc1C ZINC000499770945 340044584 /nfs/dbraw/zinc/04/45/84/340044584.db2.gz GYUSNEZATRUNSE-JSGCOSHPSA-N 0 1 324.490 4.057 20 0 DIADMN CCC[C@H](C)CC(=O)Nc1ccccc1-c1nnc(C(C)C)[nH]1 ZINC000500006258 340048567 /nfs/dbraw/zinc/04/85/67/340048567.db2.gz NMTQGESTVLTLBG-ZDUSSCGKSA-N 0 1 314.433 4.360 20 0 DIADMN Cn1nccc1[C@@H]1CCCCN1Cc1ccc2ccccc2c1 ZINC000500382490 340056178 /nfs/dbraw/zinc/05/61/78/340056178.db2.gz HGRNSLLLPWEZMF-FQEVSTJZSA-N 0 1 305.425 4.301 20 0 DIADMN Cn1nccc1[C@H]1CCCCN1Cc1ccc2ccccc2c1 ZINC000500382492 340056189 /nfs/dbraw/zinc/05/61/89/340056189.db2.gz HGRNSLLLPWEZMF-HXUWFJFHSA-N 0 1 305.425 4.301 20 0 DIADMN Cc1nn(C(C)C)cc1CN[C@]1(c2ccc(Cl)cc2)C[C@H]1C ZINC000500402938 340057068 /nfs/dbraw/zinc/05/70/68/340057068.db2.gz LGFRSSAFUXYKQU-FZKQIMNGSA-N 0 1 317.864 4.451 20 0 DIADMN CCOc1cccc(CN[C@]2(c3ccc(Cl)cc3)C[C@@H]2C)n1 ZINC000500417799 340057797 /nfs/dbraw/zinc/05/77/97/340057797.db2.gz VMGGUBFIHPMNMU-SCLBCKFNSA-N 0 1 316.832 4.159 20 0 DIADMN Cn1nccc1[C@@H]1CCCCN1C/C=C/c1ccc(Cl)cc1 ZINC000500446007 340058928 /nfs/dbraw/zinc/05/89/28/340058928.db2.gz JOLBFSXLUSKYAJ-WRFKIARRSA-N 0 1 315.848 4.314 20 0 DIADMN CC[C@H]1C[C@@]1(NCc1cnn(CC(C)C)c1)c1cccc(C)c1 ZINC000500482169 340060215 /nfs/dbraw/zinc/06/02/15/340060215.db2.gz BPJKRKSBAHIZPE-ICSRJNTNSA-N 0 1 311.473 4.263 20 0 DIADMN CCOc1cccc(CN[C@]2(c3cccc(C)c3)C[C@H]2CC)n1 ZINC000500514709 340061276 /nfs/dbraw/zinc/06/12/76/340061276.db2.gz PVPIJUCBEBOKPJ-OXQOHEQNSA-N 0 1 310.441 4.204 20 0 DIADMN CC[C@@H]1C[C@]1(NCc1nc2ccccc2[nH]1)c1cccc(C)c1 ZINC000500529026 340061386 /nfs/dbraw/zinc/06/13/86/340061386.db2.gz GTCQMEIENSKUTR-FOIQADDNSA-N 0 1 305.425 4.286 20 0 DIADMN CC[C@H]1C[C@@]1(NCc1cc(C(F)(F)F)n[nH]1)c1cccc(C)c1 ZINC000500537604 340061855 /nfs/dbraw/zinc/06/18/55/340061855.db2.gz UGLKQSLUZZBWFY-LRDDRELGSA-N 0 1 323.362 4.152 20 0 DIADMN CCN(C(=O)c1cc(-c2ccccc2)n[nH]1)c1cccc(C)c1 ZINC000500929003 340070356 /nfs/dbraw/zinc/07/03/56/340070356.db2.gz IHHFQCOFMFQLHH-UHFFFAOYSA-N 0 1 305.381 4.052 20 0 DIADMN CCC[C@H](NC/C(C)=C\c1ccccc1)c1nnc2ccccn21 ZINC000501468781 340081846 /nfs/dbraw/zinc/08/18/46/340081846.db2.gz SPSICAVMRNTDAN-BROZXCPCSA-N 0 1 320.440 4.264 20 0 DIADMN C[C@H]1CCN(Cc2ccnn2C)[C@H]1c1ccc(C(F)(F)F)cc1 ZINC000501532004 340082844 /nfs/dbraw/zinc/08/28/44/340082844.db2.gz LMMGTGVEGVPLLX-BLLLJJGKSA-N 0 1 323.362 4.022 20 0 DIADMN CCCn1nccc1C1CCN(Cc2ccc(Cl)s2)CC1 ZINC000501562712 340083664 /nfs/dbraw/zinc/08/36/64/340083664.db2.gz ZKMMGINHJLQPIK-UHFFFAOYSA-N 0 1 323.893 4.388 20 0 DIADMN COc1c(C)cnc(CN[C@H](C)c2ccccc2SC)c1C ZINC000501559973 340083702 /nfs/dbraw/zinc/08/37/02/340083702.db2.gz HEGPGUPCBNSXJO-CQSZACIVSA-N 0 1 316.470 4.280 20 0 DIADMN Cc1ccc(OCCCN2CCc3sccc3C2)cc1C ZINC000501756855 340087989 /nfs/dbraw/zinc/08/79/89/340087989.db2.gz AHDACSYYZBEVDW-UHFFFAOYSA-N 0 1 301.455 4.192 20 0 DIADMN Cc1cccc(C(C)C)c1NC(=O)[C@H](C)N1CC[C@@H](C)[C@H](C)C1 ZINC000501788100 340088814 /nfs/dbraw/zinc/08/88/14/340088814.db2.gz DEDFBTGXIKZFBA-OIISXLGYSA-N 0 1 316.489 4.423 20 0 DIADMN CCc1sc(-c2nnc(CN3CC[C@H](C)[C@H](C)C3)o2)cc1C ZINC000501807754 340089227 /nfs/dbraw/zinc/08/92/27/340089227.db2.gz YSCPRVOLXJLCFH-WCQYABFASA-N 0 1 319.474 4.147 20 0 DIADMN Cc1cccc([C@@H](Nc2ccnc(C)c2Cl)c2ccccn2)c1 ZINC000501991419 340092236 /nfs/dbraw/zinc/09/22/36/340092236.db2.gz UBXWHPDIUFZHJG-LJQANCHMSA-N 0 1 323.827 4.370 20 0 DIADMN Cc1cc([C@H](C)N[C@@H](c2cccc(F)c2)C2CCCC2)nn1C ZINC000502408702 340102139 /nfs/dbraw/zinc/10/21/39/340102139.db2.gz PTVUFRKVIOFMKZ-IFXJQAMLSA-N 0 1 315.436 4.450 20 0 DIADMN Cc1cc([C@@H](C)N[C@H](c2cccc(F)c2)C2CCCC2)nn1C ZINC000502408704 340102191 /nfs/dbraw/zinc/10/21/91/340102191.db2.gz PTVUFRKVIOFMKZ-KUHUBIRLSA-N 0 1 315.436 4.450 20 0 DIADMN Cc1cc([C@@H](C)NCc2cc(Cl)c3c(c2)OCCO3)oc1C ZINC000502431491 340103271 /nfs/dbraw/zinc/10/32/71/340103271.db2.gz ZKJNNGSENGLLDO-LLVKDONJSA-N 0 1 321.804 4.172 20 0 DIADMN CCOc1ccccc1CN[C@@H](C)c1cnn(C2CCCC2)c1 ZINC000502441978 340103674 /nfs/dbraw/zinc/10/36/74/340103674.db2.gz HOQQTSUBAXLKEI-HNNXBMFYSA-N 0 1 313.445 4.248 20 0 DIADMN CN(CCOc1c(Cl)cccc1Cl)Cc1ccoc1 ZINC000502658646 340109752 /nfs/dbraw/zinc/10/97/52/340109752.db2.gz NDSZLDZSTPHZKM-UHFFFAOYSA-N 0 1 300.185 4.097 20 0 DIADMN Cc1cc([C@H](C)NCCCOc2ccc3ccccc3c2)nn1C ZINC000502472972 340105122 /nfs/dbraw/zinc/10/51/22/340105122.db2.gz BBWHNLZPDUDWIT-INIZCTEOSA-N 0 1 323.440 4.001 20 0 DIADMN CC[C@H]1C[C@@]1(NCc1cn2c(cccc2C)n1)c1cccc(C)c1 ZINC000502480145 340105496 /nfs/dbraw/zinc/10/54/96/340105496.db2.gz GOMQPUYPAAIKDP-UWJYYQICSA-N 0 1 319.452 4.366 20 0 DIADMN Cc1cc([C@@H](C)N[C@H](Cc2ccccc2)c2ccccc2)nn1C ZINC000502484854 340105678 /nfs/dbraw/zinc/10/56/78/340105678.db2.gz ZVWFHYSJMGGGMY-DYESRHJHSA-N 0 1 319.452 4.363 20 0 DIADMN CC[C@@H]1C[C@@]1(NCC(=O)Nc1ccccc1C)c1cccc(C)c1 ZINC000502508924 340106436 /nfs/dbraw/zinc/10/64/36/340106436.db2.gz JUPSZSGPVWWCKG-UTKZUKDTSA-N 0 1 322.452 4.157 20 0 DIADMN COC(=O)c1ccc([C@@H](C)N[C@@H](c2ccc(F)cc2)C(C)C)o1 ZINC000502580768 340108445 /nfs/dbraw/zinc/10/84/45/340108445.db2.gz JEOHHBVYGJUCRK-SJKOYZFVSA-N 0 1 319.376 4.253 20 0 DIADMN C[C@H](N[C@H]1CSc2ccccc21)c1cnn(C2CCCC2)c1 ZINC000502687579 340110600 /nfs/dbraw/zinc/11/06/00/340110600.db2.gz PSTGROKZIFYUOV-GUYCJALGSA-N 0 1 313.470 4.496 20 0 DIADMN Cc1cc2cn[nH]c2c(C(=O)N2CCCSc3ccccc32)c1 ZINC000502717071 340112070 /nfs/dbraw/zinc/11/20/70/340112070.db2.gz VVNRLCQNUKRQAO-UHFFFAOYSA-N 0 1 323.421 4.014 20 0 DIADMN CCN(CC)CC(=O)Nc1cccc(Cl)c1SC(C)C ZINC000502972614 340117841 /nfs/dbraw/zinc/11/78/41/340117841.db2.gz WZXRJKIXGSOBJO-UHFFFAOYSA-N 0 1 314.882 4.121 20 0 DIADMN CC[C@H](CNCc1nnc(C(C)(C)C)s1)c1ccccc1 ZINC000503049043 340119661 /nfs/dbraw/zinc/11/96/61/340119661.db2.gz YKAGSMGBIPUKBR-CYBMUJFWSA-N 0 1 303.475 4.119 20 0 DIADMN Cc1cc([C@@H](C)NCCCOc2ccc3ccccc3c2)no1 ZINC000503211592 340123247 /nfs/dbraw/zinc/12/32/47/340123247.db2.gz RESNVZJCNDZRKU-OAHLLOKOSA-N 0 1 310.397 4.256 20 0 DIADMN CC(C)(C)Oc1cccc(CNCc2cccc(Cl)c2)n1 ZINC000503281080 340124608 /nfs/dbraw/zinc/12/46/08/340124608.db2.gz CWXCIVAUDCBLOT-UHFFFAOYSA-N 0 1 304.821 4.202 20 0 DIADMN CCCC[C@H](C)C(=O)Nc1cccc(CN2CCSCC2)c1 ZINC000503466008 340128807 /nfs/dbraw/zinc/12/88/07/340128807.db2.gz MJNUGXCKRWWLGE-HNNXBMFYSA-N 0 1 320.502 4.000 20 0 DIADMN COc1ccc([C@H]2C[C@H](N[C@@H](C)c3csc(C)n3)C2)cc1F ZINC000503869395 340135499 /nfs/dbraw/zinc/13/54/99/340135499.db2.gz FLXDBUWZZHKRED-BPNCWPANSA-N 0 1 320.433 4.196 20 0 DIADMN CCN(Cc1cn2c(cccc2C)n1)[C@@H](C)c1cccc(OC)c1 ZINC000504004341 340139533 /nfs/dbraw/zinc/13/95/33/340139533.db2.gz IPPIQINRHDPOGS-INIZCTEOSA-N 0 1 323.440 4.234 20 0 DIADMN COc1ccc(CN(Cc2occc2C)CC2CC2)c(OC)c1 ZINC000504588337 340149716 /nfs/dbraw/zinc/14/97/16/340149716.db2.gz ASIRVZDPRXGLJJ-UHFFFAOYSA-N 0 1 315.413 4.017 20 0 DIADMN CC[C@@H](CC(=O)Nc1ccc2nc(C)[nH]c2c1)c1ccccc1 ZINC000504918000 340156072 /nfs/dbraw/zinc/15/60/72/340156072.db2.gz FSGKCOMGLJPWAG-AWEZNQCLSA-N 0 1 307.397 4.394 20 0 DIADMN Cc1ccc(-c2cc(-c3nc(Cc4cccs4)no3)[nH]n2)cc1 ZINC000505049904 340160047 /nfs/dbraw/zinc/16/00/47/340160047.db2.gz FMMMRRWDPAUKEI-UHFFFAOYSA-N 0 1 322.393 4.087 20 0 DIADMN CC(C)c1cc(C(=O)N(Cc2ccccc2)CC(C)(C)C)n[nH]1 ZINC000505413021 340167873 /nfs/dbraw/zinc/16/78/73/340167873.db2.gz FBLSRLVUXSLNPK-UHFFFAOYSA-N 0 1 313.445 4.222 20 0 DIADMN CCc1nc(SCc2nc(-c3ccc(C)cc3)cs2)n[nH]1 ZINC000505431802 340168288 /nfs/dbraw/zinc/16/82/88/340168288.db2.gz AVPDPXPGHVOHHY-UHFFFAOYSA-N 0 1 316.455 4.091 20 0 DIADMN CCc1n[nH]c(SCc2nc(-c3ccc(C)cc3)cs2)n1 ZINC000505431802 340168289 /nfs/dbraw/zinc/16/82/89/340168289.db2.gz AVPDPXPGHVOHHY-UHFFFAOYSA-N 0 1 316.455 4.091 20 0 DIADMN COc1cc(C[N@@H+](C)Cc2ccccc2C)ccc1OC(F)F ZINC000505580783 340171534 /nfs/dbraw/zinc/17/15/34/340171534.db2.gz ASVCBANPSMOXTB-UHFFFAOYSA-N 0 1 321.367 4.237 20 0 DIADMN CCCN(Cc1ccccc1)Cc1ccc(F)cc1C(=O)OC ZINC000505597707 340172205 /nfs/dbraw/zinc/17/22/05/340172205.db2.gz SSJZTWDYPHFADJ-UHFFFAOYSA-N 0 1 315.388 4.025 20 0 DIADMN C[C@@H](Cc1ccccc1)C(=O)Nc1cc(F)cc(Cl)c1O ZINC000505605888 340172504 /nfs/dbraw/zinc/17/25/04/340172504.db2.gz FQOPFMIUMNZXKV-JTQLQIEISA-N 0 1 307.752 4.002 20 0 DIADMN CCOc1ccc(CN(C)Cc2cc(F)c(F)c(F)c2)cc1 ZINC000505639343 340173882 /nfs/dbraw/zinc/17/38/82/340173882.db2.gz UKSVLFFIABXGPU-UHFFFAOYSA-N 0 1 309.331 4.135 20 0 DIADMN C[C@@H](c1nc2ccccc2o1)N1CC[C@H](COc2ccccc2)C1 ZINC000505840750 340179226 /nfs/dbraw/zinc/17/92/26/340179226.db2.gz QWICIOHLQXBHKE-HOTGVXAUSA-N 0 1 322.408 4.290 20 0 DIADMN C(=C\[C@H]1CCCN1Cc1cn2ccccc2n1)\c1ccccc1 ZINC000505840437 340179268 /nfs/dbraw/zinc/17/92/68/340179268.db2.gz PYZBMAMZABWOCS-YAINUAMHSA-N 0 1 303.409 4.012 20 0 DIADMN C[C@@H](c1ccc(F)c(F)c1)N1CC[C@H](COc2ccccc2)C1 ZINC000505850094 340179787 /nfs/dbraw/zinc/17/97/87/340179787.db2.gz DXKYDJBZXYIJQV-GJZGRUSLSA-N 0 1 317.379 4.427 20 0 DIADMN COCCN(C/C=C\c1ccc(F)cc1)Cc1cccs1 ZINC000506041768 340184098 /nfs/dbraw/zinc/18/40/98/340184098.db2.gz XCOXCVCUPNJDDP-RQOWECAXSA-N 0 1 305.418 4.049 20 0 DIADMN Cc1ccc(-c2ccc(CN(C)Cc3cnn(C)c3)s2)cc1 ZINC000506050467 340184416 /nfs/dbraw/zinc/18/44/16/340184416.db2.gz BEGJFYMEJBNMDC-UHFFFAOYSA-N 0 1 311.454 4.089 20 0 DIADMN CN(Cc1ccc(Cl)s1)Cc1cccc(-n2cccn2)c1 ZINC000506084801 340185113 /nfs/dbraw/zinc/18/51/13/340185113.db2.gz GBCMYBVQFCZLFX-UHFFFAOYSA-N 0 1 317.845 4.219 20 0 DIADMN CN(Cc1cc(F)cc(F)c1)Cc1ccccc1N1CCCC1 ZINC000506138003 340186575 /nfs/dbraw/zinc/18/65/75/340186575.db2.gz QLGFRRBSCUHTRR-UHFFFAOYSA-N 0 1 316.395 4.197 20 0 DIADMN Cc1nc2ccccn2c1CN1CC=C(c2ccc(F)cc2)CC1 ZINC000506160536 340187134 /nfs/dbraw/zinc/18/71/34/340187134.db2.gz QPZZIWSZAHKGFR-UHFFFAOYSA-N 0 1 321.399 4.071 20 0 DIADMN C[C@@H](c1cccc(Cl)c1)N(C)Cc1cnc(N(C)C)s1 ZINC000506201045 340188526 /nfs/dbraw/zinc/18/85/26/340188526.db2.gz ADLHVWASWXJWQX-NSHDSACASA-N 0 1 309.866 4.056 20 0 DIADMN COc1ccc(CN[C@H]2CCc3cc(Cl)ccc32)c(F)c1 ZINC000506237428 340189578 /nfs/dbraw/zinc/18/95/78/340189578.db2.gz WVTMLOVKITZSAY-KRWDZBQOSA-N 0 1 305.780 4.265 20 0 DIADMN CN(Cc1cc(C(F)(F)F)ccc1Cl)[C@@H]1CCSC1 ZINC000506236202 340189598 /nfs/dbraw/zinc/18/95/98/340189598.db2.gz YIQXWFMGQHQNCG-LLVKDONJSA-N 0 1 309.784 4.296 20 0 DIADMN COc1ccc([C@@H](C)N(C)Cc2cc(-c3ccccc3)n[nH]2)cc1 ZINC000506372442 340193493 /nfs/dbraw/zinc/19/34/93/340193493.db2.gz ZIBVRZOQLRGCIY-OAHLLOKOSA-N 0 1 321.424 4.278 20 0 DIADMN CCc1nc(CN(CC)[C@@H](C)Cc2ccc(OC)cc2)cs1 ZINC000506406496 340194206 /nfs/dbraw/zinc/19/42/06/340194206.db2.gz WYWBJJWUKZLKIG-AWEZNQCLSA-N 0 1 318.486 4.167 20 0 DIADMN CC(C)N(Cc1ccco1)Cc1ccc(OC(F)F)c(F)c1 ZINC000506417423 340194235 /nfs/dbraw/zinc/19/42/35/340194235.db2.gz RUGGGDQWSSQTRY-UHFFFAOYSA-N 0 1 313.319 4.431 20 0 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/nfs/dbraw/zinc/16/39/00/1042163900.db2.gz BTSHPYATXQKZSG-UHFFFAOYSA-N 0 1 319.788 4.111 20 0 DIADMN COc1cc2[nH]cnc2cc1-c1c(F)ccc(OC(C)C)c1F ZINC001204663103 1042170811 /nfs/dbraw/zinc/17/08/11/1042170811.db2.gz WIMXKOAEJQDCJC-UHFFFAOYSA-N 0 1 318.323 4.304 20 0 DIADMN CCOc1cccc(NC(=O)c2[nH]c(-c3ccccc3)nc2C)c1 ZINC000617126209 1042174842 /nfs/dbraw/zinc/17/48/42/1042174842.db2.gz VWBBBHHCKFBZKS-UHFFFAOYSA-N 0 1 321.380 4.036 20 0 DIADMN CC(C)CCC[C@H](C)NC(=O)CN(C)[C@@H](C)c1ccccc1 ZINC000302742657 1042179111 /nfs/dbraw/zinc/17/91/11/1042179111.db2.gz RRCGAZDRDXRDHB-IRXDYDNUSA-N 0 1 304.478 4.010 20 0 DIADMN C[C@H](N[C@H]1CCCc2cccnc21)c1ccccc1OC(F)F ZINC000321494258 1042180260 /nfs/dbraw/zinc/18/02/60/1042180260.db2.gz ZAZHCVHYBJHRCA-WFASDCNBSA-N 0 1 318.367 4.411 20 0 DIADMN C[C@H](N[C@H]1CCc2ccccc2-n2ccnc21)c1ccc(F)cc1 ZINC000663470341 1042180348 /nfs/dbraw/zinc/18/03/48/1042180348.db2.gz GRWVZCAGDCPBOP-KSSFIOAISA-N 0 1 321.399 4.350 20 0 DIADMN CC[C@@H](NCc1ccnn1CC)c1ccc(Cl)c(Cl)c1 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CCCCCC[C@H](CC)CN(C)C(=O)c1cc(C(F)F)[nH]n1 ZINC001167821799 1042193627 /nfs/dbraw/zinc/19/36/27/1042193627.db2.gz CVYPFCDTVGEWHW-LBPRGKRZSA-N 0 1 315.408 4.416 20 0 DIADMN Cc1cc(C)c(NC(=O)C[N@H+](C)[C@@H]2CCC[C@H](C)C2)c(Cl)c1 ZINC000026470214 1042195837 /nfs/dbraw/zinc/19/58/37/1042195837.db2.gz UYUMZRKNZJDWKJ-SWLSCSKDSA-N 0 1 322.880 4.406 20 0 DIADMN CCCCCC[C@@H](CC)CN(C)C(=O)[C@H]1CCN1C(C)(C)C ZINC001167821919 1042198107 /nfs/dbraw/zinc/19/81/07/1042198107.db2.gz FJBAMKBWFDALGX-IAGOWNOFSA-N 0 1 310.526 4.314 20 0 DIADMN CCCCCN(CCCCC)C(=O)c1cc(C(F)F)[nH]n1 ZINC001136274966 1042198157 /nfs/dbraw/zinc/19/81/57/1042198157.db2.gz PVWGLGFBGCYQNC-UHFFFAOYSA-N 0 1 301.381 4.170 20 0 DIADMN C[C@@H]1C[C@@H](C)CN(Cc2csc(-c3ccccc3F)n2)C1 ZINC000303232776 1042199533 /nfs/dbraw/zinc/19/95/33/1042199533.db2.gz YHSQLVYGWNHFJZ-CHWSQXEVSA-N 0 1 304.434 4.427 20 0 DIADMN CC[C@H](N[C@H](c1ccccc1)[C@H](C)O)c1cc(F)ccc1F ZINC000658359505 1042221745 /nfs/dbraw/zinc/22/17/45/1042221745.db2.gz 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/nfs/dbraw/zinc/67/72/87/1043677287.db2.gz QGTLXLXAQTVICJ-KSSFIOAISA-N 0 1 303.409 4.358 20 0 DIADMN Clc1ccc([C@@H]2CCCN2C[C@H]2CCCO2)cc1Cl ZINC000559049781 1043677520 /nfs/dbraw/zinc/67/75/20/1043677520.db2.gz XNGWCLRSMOGIHY-DOMZBBRYSA-N 0 1 300.229 4.309 20 0 DIADMN Cc1ccc(-c2n[nH]cc2CN2C[C@H](C)[C@@H]2c2ccccc2)o1 ZINC000354045579 1043677651 /nfs/dbraw/zinc/67/76/51/1043677651.db2.gz WIBCZSQQMINVNS-ORAYPTAESA-N 0 1 307.397 4.171 20 0 DIADMN Cc1ccc2c(c1)OCCC[C@@H]2N[C@H]1CCCc2cccnc21 ZINC000927062983 1043677707 /nfs/dbraw/zinc/67/77/07/1043677707.db2.gz QQUVSNMXWSEQRY-ROUUACIJSA-N 0 1 308.425 4.271 20 0 DIADMN CCc1ccc(CN2CCC(Oc3ccc(C)c(C)c3)CC2)nc1 ZINC000559049627 1043677790 /nfs/dbraw/zinc/67/77/90/1043677790.db2.gz PUZKYNLFYZQSAE-UHFFFAOYSA-N 0 1 324.468 4.304 20 0 DIADMN CC(C)[C@H](N[C@@H](C)c1ccccc1OC(F)F)c1cnn(C)c1 ZINC000927065499 1043679875 /nfs/dbraw/zinc/67/98/75/1043679875.db2.gz HYYXYXUDUFIVDJ-LRDDRELGSA-N 0 1 323.387 4.069 20 0 DIADMN C[C@@]1(CN[C@H](c2cc3ccccc3o2)c2cccnc2)CCCO1 ZINC000354086946 1043679975 /nfs/dbraw/zinc/67/99/75/1043679975.db2.gz VNHZUJNOGNAHBG-PMACEKPBSA-N 0 1 322.408 4.076 20 0 DIADMN Cc1occc1-c1noc(-c2cc(-c3ccc(C)cc3)n[nH]2)n1 ZINC000354070001 1043680308 /nfs/dbraw/zinc/68/03/08/1043680308.db2.gz QUGXHOJZSZOHEW-UHFFFAOYSA-N 0 1 306.325 4.004 20 0 DIADMN Cc1nc(C)c(CN2CCc3c(cccc3C(C)C)C2)s1 ZINC001307740741 1043681388 /nfs/dbraw/zinc/68/13/88/1043681388.db2.gz BJRJQAZXVZKTFJ-UHFFFAOYSA-N 0 1 300.471 4.442 20 0 DIADMN COc1ccc([C@H](N[C@@H]2C[C@@H](C)n3ccnc32)C2CCC2)cc1 ZINC000927069690 1043682541 /nfs/dbraw/zinc/68/25/41/1043682541.db2.gz ZTUNMCUWRZODBQ-FSPWUOQZSA-N 0 1 311.429 4.029 20 0 DIADMN Cc1nc(C(C)C)sc1[C@@H](C)NCc1cc(C2CC2)nn1C ZINC000927098110 1043684169 /nfs/dbraw/zinc/68/41/69/1043684169.db2.gz BTUVOOSFNBWFDW-LLVKDONJSA-N 0 1 318.490 4.037 20 0 DIADMN C[C@H](NCc1cc(C2CC2)nn1C)c1ccc(C2CCC2)cc1 ZINC000927102013 1043686409 /nfs/dbraw/zinc/68/64/09/1043686409.db2.gz VKMAXVLMWSMYAI-AWEZNQCLSA-N 0 1 309.457 4.416 20 0 DIADMN Cc1ccc2cc([C@@H](C)NCc3cc(C4CC4)nn3C)oc2c1 ZINC000927102540 1043686644 /nfs/dbraw/zinc/68/66/44/1043686644.db2.gz SNMFVNSVXQWTCO-CYBMUJFWSA-N 0 1 309.413 4.203 20 0 DIADMN Cc1ccc2cc([C@H](C)NCc3cc(C4CC4)nn3C)oc2c1 ZINC000927102543 1043686863 /nfs/dbraw/zinc/68/68/63/1043686863.db2.gz SNMFVNSVXQWTCO-ZDUSSCGKSA-N 0 1 309.413 4.203 20 0 DIADMN Cc1nccc(N2CCC(OCC3CCCC3)CC2)c1Cl ZINC000354163542 1043687084 /nfs/dbraw/zinc/68/70/84/1043687084.db2.gz NAJUAICYZBYWTF-UHFFFAOYSA-N 0 1 308.853 4.219 20 0 DIADMN CC(C)C[C@@H](NCc1nc2c(s1)COCC2)c1ccccc1 ZINC000927118641 1043692462 /nfs/dbraw/zinc/69/24/62/1043692462.db2.gz SYOSKZWCCYDNSJ-MRXNPFEDSA-N 0 1 316.470 4.093 20 0 DIADMN CC(C)C[C@H](NCc1nc2c(s1)COCC2)c1ccccc1 ZINC000927118638 1043692827 /nfs/dbraw/zinc/69/28/27/1043692827.db2.gz SYOSKZWCCYDNSJ-INIZCTEOSA-N 0 1 316.470 4.093 20 0 DIADMN C[C@@H]1CC[C@H](NCc2nc3c(s2)COCC3)c2sccc21 ZINC000927117168 1043693257 /nfs/dbraw/zinc/69/32/57/1043693257.db2.gz KFWWTUMYINLGGW-MFKMUULPSA-N 0 1 320.483 4.006 20 0 DIADMN CC[C@H](CC1CCCC1)C(=O)Nc1cccc(-c2nnc[nH]2)c1 ZINC000114393513 1043693553 /nfs/dbraw/zinc/69/35/53/1043693553.db2.gz OTGFDOAVNRPSLG-CQSZACIVSA-N 0 1 312.417 4.017 20 0 DIADMN CC[C@@H](CC1CCCC1)C(=O)Nc1cccc(-c2nnc[nH]2)c1 ZINC000114393510 1043693696 /nfs/dbraw/zinc/69/36/96/1043693696.db2.gz OTGFDOAVNRPSLG-AWEZNQCLSA-N 0 1 312.417 4.017 20 0 DIADMN Fc1cccc2cc(CN3CCC[C@H](C(F)(F)F)C3)cnc12 ZINC000876535185 1043693639 /nfs/dbraw/zinc/69/36/39/1043693639.db2.gz KWQCZMIGWPDPQJ-ZDUSSCGKSA-N 0 1 312.310 4.148 20 0 DIADMN CCc1onc(C)c1CN[C@H]1C[C@H](C)Sc2sccc21 ZINC000927138272 1043696840 /nfs/dbraw/zinc/69/68/40/1043696840.db2.gz DOGWBSTZXXMUQY-ZANVPECISA-N 0 1 308.472 4.322 20 0 DIADMN CCC[C@@H](NCc1c(C)noc1CC)c1ccc(OC)cc1 ZINC000927136574 1043697084 /nfs/dbraw/zinc/69/70/84/1043697084.db2.gz COHPIANXFOIEIC-QGZVFWFLSA-N 0 1 302.418 4.185 20 0 DIADMN CCc1onc(C)c1CN[C@@H](C)c1ccc(SC)c(F)c1 ZINC000927138871 1043697266 /nfs/dbraw/zinc/69/72/66/1043697266.db2.gz HUOZEAWAHHKZCV-JTQLQIEISA-N 0 1 308.422 4.257 20 0 DIADMN CCc1onc(C)c1CN[C@@H](C)c1ccc(OC)c(Cl)c1 ZINC000927139842 1043697295 /nfs/dbraw/zinc/69/72/95/1043697295.db2.gz LYZCRRJSFYXYRG-JTQLQIEISA-N 0 1 308.809 4.058 20 0 DIADMN CCc1onc(C)c1CN[C@H](c1ccc(C)o1)C1CCCC1 ZINC000927138548 1043697919 /nfs/dbraw/zinc/69/79/19/1043697919.db2.gz FWXVEEPBMIENRA-SFHVURJKSA-N 0 1 302.418 4.468 20 0 DIADMN Cc1cncc([C@H](C)N[C@H](C)c2cc(Cl)cc3c2OCC3)c1 ZINC000927140765 1043698119 /nfs/dbraw/zinc/69/81/19/1043698119.db2.gz OWXCWAMNFUFCEV-QWHCGFSZSA-N 0 1 316.832 4.390 20 0 DIADMN CCc1onc(C)c1CN[C@@H](C)c1ccccc1C(F)(F)F ZINC000927141469 1043698897 /nfs/dbraw/zinc/69/88/97/1043698897.db2.gz SHJVFZDVDBPZKU-JTQLQIEISA-N 0 1 312.335 4.415 20 0 DIADMN Cc1csc(C2(NCc3ccc(CF)cc3)CCCC2)n1 ZINC000777615477 1043699316 /nfs/dbraw/zinc/69/93/16/1043699316.db2.gz BBUVLNZBUPKLQT-UHFFFAOYSA-N 0 1 304.434 4.480 20 0 DIADMN C[C@H](NC1([C@@H]2CCCCO2)CC1)c1cc(-c2ccccc2)no1 ZINC000927162043 1043701485 /nfs/dbraw/zinc/70/14/85/1043701485.db2.gz ZPRZRUYHZZKMCL-KSSFIOAISA-N 0 1 312.413 4.094 20 0 DIADMN Cn1c2ccccc2nc1[C@H]1CCCN1Cc1ccc(CF)cc1 ZINC000777617135 1043704350 /nfs/dbraw/zinc/70/43/50/1043704350.db2.gz GKLQKJBQNODWJR-LJQANCHMSA-N 0 1 323.415 4.380 20 0 DIADMN COC(=O)c1ccoc1CN1CCC[C@H]1c1cc(C)ccc1C ZINC000474226781 1043706176 /nfs/dbraw/zinc/70/61/76/1043706176.db2.gz CPSQMGJMFSGCCY-KRWDZBQOSA-N 0 1 313.397 4.020 20 0 DIADMN CCCCOCC[N@H+]1CCCC[C@@H]1c1nc2ccccc2o1 ZINC000474237262 1043707992 /nfs/dbraw/zinc/70/79/92/1043707992.db2.gz VPZHDLDFUVLNHH-MRXNPFEDSA-N 0 1 302.418 4.172 20 0 DIADMN CCCCOCCN1CCCC[C@@H]1c1nc2ccccc2o1 ZINC000474237262 1043708000 /nfs/dbraw/zinc/70/80/00/1043708000.db2.gz VPZHDLDFUVLNHH-MRXNPFEDSA-N 0 1 302.418 4.172 20 0 DIADMN FC(F)(F)c1sccc1C[N@H+]1CC[C@@H](c2nccs2)C1 ZINC000895585465 1043709975 /nfs/dbraw/zinc/70/99/75/1043709975.db2.gz YBUNTVPGGAPPHJ-SNVBAGLBSA-N 0 1 318.389 4.213 20 0 DIADMN FC(F)(F)c1sccc1CN1CC[C@@H](c2nccs2)C1 ZINC000895585465 1043709981 /nfs/dbraw/zinc/70/99/81/1043709981.db2.gz YBUNTVPGGAPPHJ-SNVBAGLBSA-N 0 1 318.389 4.213 20 0 DIADMN C[C@@H](N[C@@H](C)c1ccccc1OC(F)F)c1ccc(F)nc1 ZINC000930191230 1043710906 /nfs/dbraw/zinc/71/09/06/1043710906.db2.gz AABNJENPCYCRLL-MNOVXSKESA-N 0 1 310.319 4.234 20 0 DIADMN FC(F)(F)c1cc(C[N@H+]2CC[C@@H](c3nccs3)C2)cs1 ZINC000895580606 1043711154 /nfs/dbraw/zinc/71/11/54/1043711154.db2.gz BXULGXNXKSNKPY-SNVBAGLBSA-N 0 1 318.389 4.213 20 0 DIADMN FC(F)(F)c1cc(CN2CC[C@@H](c3nccs3)C2)cs1 ZINC000895580606 1043711165 /nfs/dbraw/zinc/71/11/65/1043711165.db2.gz BXULGXNXKSNKPY-SNVBAGLBSA-N 0 1 318.389 4.213 20 0 DIADMN CC(C)Cc1ccc(CN[C@@H](c2ccccn2)C2CCC2)cn1 ZINC000895582692 1043712062 /nfs/dbraw/zinc/71/20/62/1043712062.db2.gz WJCSZTHZEQGPJJ-HXUWFJFHSA-N 0 1 309.457 4.306 20 0 DIADMN Cc1ccc(CCCN2C[C@H](c3ccccc3C)OC[C@H]2C)cn1 ZINC000474260111 1043715120 /nfs/dbraw/zinc/71/51/20/1043715120.db2.gz XYWQCPZLPCJWOB-WIYYLYMNSA-N 0 1 324.468 4.093 20 0 DIADMN CC(C)Sc1cccc(Cl)c1CN1CCC[C@@H](O)CC1 ZINC000354735053 1043716114 /nfs/dbraw/zinc/71/61/14/1043716114.db2.gz RARHVMACQGPGDB-CYBMUJFWSA-N 0 1 313.894 4.187 20 0 DIADMN Cc1ccc(CCC[N@H+]2CCc3ccc(Cl)cc3C2)cn1 ZINC000474280881 1043723592 /nfs/dbraw/zinc/72/35/92/1043723592.db2.gz PQMWPEKWCATAFP-UHFFFAOYSA-N 0 1 300.833 4.034 20 0 DIADMN CC(C)(C)c1csc(CNC(C)(C)[C@H](O)c2ccccc2)n1 ZINC000895661411 1043728305 /nfs/dbraw/zinc/72/83/05/1043728305.db2.gz HINNGWYBZJAXON-MRXNPFEDSA-N 0 1 318.486 4.042 20 0 DIADMN CC(C)(C)c1csc(CNC(C)(C)[C@@H](O)c2ccccc2)n1 ZINC000895661409 1043729050 /nfs/dbraw/zinc/72/90/50/1043729050.db2.gz HINNGWYBZJAXON-INIZCTEOSA-N 0 1 318.486 4.042 20 0 DIADMN CC(C)c1ccc2c(c1)[C@@H](NCc1nnc3ccccn31)CCC2 ZINC000354963613 1043730394 /nfs/dbraw/zinc/73/03/94/1043730394.db2.gz HDBYGOCGHKKCLW-SFHVURJKSA-N 0 1 320.440 4.020 20 0 DIADMN CO[C@H](c1ccccc1Cl)[C@H](C)N[C@@H](C)c1nccs1 ZINC000354956826 1043732345 /nfs/dbraw/zinc/73/23/45/1043732345.db2.gz BFWPPIJUCQDIRR-MJVIPROJSA-N 0 1 310.850 4.223 20 0 DIADMN Cc1ccccc1[C@@H](CC(C)C)NCc1ccc(Cl)nn1 ZINC000877029221 1043734249 /nfs/dbraw/zinc/73/42/49/1043734249.db2.gz VXWKQVIVIYWTBR-MRXNPFEDSA-N 0 1 303.837 4.315 20 0 DIADMN CC(C)(NCc1cc2nc(Cl)ccc2s1)c1nccs1 ZINC000877035216 1043734626 /nfs/dbraw/zinc/73/46/26/1043734626.db2.gz FBYWRRGSYOCDFW-UHFFFAOYSA-N 0 1 323.874 4.431 20 0 DIADMN Cc1[nH]nc2cc(NC(=O)c3cccc4c(C)c(C)[nH]c43)ccc12 ZINC000355001504 1043735631 /nfs/dbraw/zinc/73/56/31/1043735631.db2.gz OLKBBCFLINLWTR-UHFFFAOYSA-N 0 1 318.380 4.222 20 0 DIADMN Fc1ccc([C@H](Nc2ccc(C3CCC3)cc2)c2c[nH]nn2)cc1 ZINC000559905207 1043740990 /nfs/dbraw/zinc/74/09/90/1043740990.db2.gz YQFKGSSHCJWADN-IBGZPJMESA-N 0 1 322.387 4.413 20 0 DIADMN CCC(C)(C)C1CCC(NCc2nc(C(F)F)no2)CC1 ZINC000895727414 1043741061 /nfs/dbraw/zinc/74/10/61/1043741061.db2.gz RLNVCNWHPNOCRO-UHFFFAOYSA-N 0 1 301.381 4.092 20 0 DIADMN CSc1cc(C)ccc1CNCc1cccc(Cl)c1N ZINC000877087228 1043742549 /nfs/dbraw/zinc/74/25/49/1043742549.db2.gz IUFLDMAKNBKECD-UHFFFAOYSA-N 0 1 306.862 4.242 20 0 DIADMN CC[C@@H](NCc1nccn1Cc1ccccc1)c1ccccc1 ZINC000114765652 1043743800 /nfs/dbraw/zinc/74/38/00/1043743800.db2.gz PJHJNXHNIKBWHY-LJQANCHMSA-N 0 1 305.425 4.172 20 0 DIADMN CC(C)(C)OCc1ccccc1NC(=O)c1c(O)cccc1F ZINC000928388744 1043746196 /nfs/dbraw/zinc/74/61/96/1043746196.db2.gz PGLOLLIDVWEBOG-UHFFFAOYSA-N 0 1 317.360 4.099 20 0 DIADMN Fc1ccccc1CO[C@@H]1CCCN(Cc2ccsc2)C1 ZINC000355225426 1043751335 /nfs/dbraw/zinc/75/13/35/1043751335.db2.gz SLAGYQBQRQJQPA-MRXNPFEDSA-N 0 1 305.418 4.068 20 0 DIADMN COCc1nc(CN2CCC[C@@H]2CCC2CCCC2)cs1 ZINC000355216349 1043751836 /nfs/dbraw/zinc/75/18/36/1043751836.db2.gz DYVJQRQLRCUETO-MRXNPFEDSA-N 0 1 308.491 4.224 20 0 DIADMN C[C@@H]1[C@@H](C(F)(F)F)CCN1Cc1cc2cc(F)ccc2o1 ZINC000355226717 1043752642 /nfs/dbraw/zinc/75/26/42/1043752642.db2.gz SFXYRUPSCGGTKQ-RNCFNFMXSA-N 0 1 301.283 4.345 20 0 DIADMN Fc1cccc(F)c1-c1n[nH]cc1CN1CCCC2(CCC2)C1 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C[C@@H]1CCC[C@H](CC[N@H+]2[C@@H](C(=O)[O-])CC[C@H]2c2ccccc2)C1 ZINC000563455512 1044264851 /nfs/dbraw/zinc/26/48/51/1044264851.db2.gz OLIXRQGXDFNZMK-ZAWLATJESA-N 0 1 315.457 4.493 20 0 DIADMN COc1cncc(CN[C@@H](C)c2cc3ccccc3c(OC)c2)c1 ZINC000934636068 1044265885 /nfs/dbraw/zinc/26/58/85/1044265885.db2.gz QOMBCMHIXHMLFT-AWEZNQCLSA-N 0 1 322.408 4.103 20 0 DIADMN Cc1noc([C@H]2CCCC[N@H+]2CCCc2ccc(Cl)cc2)n1 ZINC000563465028 1044266435 /nfs/dbraw/zinc/26/64/35/1044266435.db2.gz KQECXIJVSVLMEN-MRXNPFEDSA-N 0 1 319.836 4.191 20 0 DIADMN Cc1noc([C@H]2CCCCN2CCCc2ccc(Cl)cc2)n1 ZINC000563465028 1044266452 /nfs/dbraw/zinc/26/64/52/1044266452.db2.gz KQECXIJVSVLMEN-MRXNPFEDSA-N 0 1 319.836 4.191 20 0 DIADMN COc1cc([C@H](C)N[C@@H](C)c2cnc(C)cn2)cc2ccccc21 ZINC000934635589 1044266945 /nfs/dbraw/zinc/26/69/45/1044266945.db2.gz NGCWVRVKXIUMAU-GJZGRUSLSA-N 0 1 321.424 4.359 20 0 DIADMN Cc1ccc(-c2cc(CN[C@H](c3ccncc3)C3CC3)on2)cc1 ZINC000934689348 1044271944 /nfs/dbraw/zinc/27/19/44/1044271944.db2.gz NPHOLPYNOMEQIE-FQEVSTJZSA-N 0 1 319.408 4.286 20 0 DIADMN CCN(Cc1ccccc1F)Cc1cc2ccccc2[nH]c1=O ZINC001137187441 1044277921 /nfs/dbraw/zinc/27/79/21/1044277921.db2.gz XYODFRHXAWXUFU-UHFFFAOYSA-N 0 1 310.372 4.102 20 0 DIADMN C[C@H](c1ccccc1F)N(C)C(=O)c1cnc(-c2ccccc2)[nH]1 ZINC000563566796 1044283286 /nfs/dbraw/zinc/28/32/86/1044283286.db2.gz DOVNNPALCOQNHF-CYBMUJFWSA-N 0 1 323.371 4.049 20 0 DIADMN c1cc(-c2nc(CNC[C@H]3CCC4(CCC4)O3)cs2)cs1 ZINC000883364694 1044285574 /nfs/dbraw/zinc/28/55/74/1044285574.db2.gz MOXNBZWCKYNDMJ-CQSZACIVSA-N 0 1 320.483 4.063 20 0 DIADMN Cc1sccc1CNCc1ccccc1OCC(F)(F)F ZINC000293441080 1044286145 /nfs/dbraw/zinc/28/61/45/1044286145.db2.gz BXVIOCPLLSAZOP-UHFFFAOYSA-N 0 1 315.360 4.287 20 0 DIADMN F[C@H]1CCc2ccccc2[C@H]1NCc1cc2ccncc2s1 ZINC000883381315 1044294518 /nfs/dbraw/zinc/29/45/18/1044294518.db2.gz KQBLZJZILVKCOT-FUHWJXTLSA-N 0 1 312.413 4.412 20 0 DIADMN CC(C)[C@@]1(C)C[C@H]1c1nc(-c2ccc(F)c(CN(C)C)c2)no1 ZINC000563648040 1044296222 /nfs/dbraw/zinc/29/62/22/1044296222.db2.gz CQKZXSBWOOHSGE-KBXCAEBGSA-N 0 1 317.408 4.087 20 0 DIADMN Cc1cc(N2CCC[C@@H]2c2cccnc2)c2cc(F)ccc2n1 ZINC000360662965 1044297448 /nfs/dbraw/zinc/29/74/48/1044297448.db2.gz ILASOOJYGVYKJK-GOSISDBHSA-N 0 1 307.372 4.419 20 0 DIADMN CC(C)CCN(CCC(C)C)C(=O)c1cccc2c[nH]nc21 ZINC000030469223 1044302149 /nfs/dbraw/zinc/30/21/49/1044302149.db2.gz HUQJQTSOLCYMKJ-UHFFFAOYSA-N 0 1 301.434 4.097 20 0 DIADMN COc1ccc([C@H](C)N[C@H](C)c2cc(OC)ccc2OC)cc1 ZINC000192790015 1044308810 /nfs/dbraw/zinc/30/88/10/1044308810.db2.gz IBGCDBZLHWVRDU-UONOGXRCSA-N 0 1 315.413 4.124 20 0 DIADMN CC[C@@H](C)Oc1cccc(NC(=O)[C@H]2CCCC[N@H+]2C(C)C)c1 ZINC000563756539 1044310927 /nfs/dbraw/zinc/31/09/27/1044310927.db2.gz VTVRWJFGFFFRAG-CRAIPNDOSA-N 0 1 318.461 4.065 20 0 DIADMN CC[C@@H](C)Oc1cccc(NC(=O)[C@H]2CCCCN2C(C)C)c1 ZINC000563756539 1044310932 /nfs/dbraw/zinc/31/09/32/1044310932.db2.gz VTVRWJFGFFFRAG-CRAIPNDOSA-N 0 1 318.461 4.065 20 0 DIADMN CCCc1nc(C)c(CN[C@H](c2ccc(OC)cc2)C2CC2)o1 ZINC000293694320 1044315257 /nfs/dbraw/zinc/31/52/57/1044315257.db2.gz NYKYEVQRVBUXJY-IBGZPJMESA-N 0 1 314.429 4.185 20 0 DIADMN COc1ccc([C@@H](C)N[C@H](C)c2cc(F)ccc2OC)cc1F ZINC000192808790 1044317753 /nfs/dbraw/zinc/31/77/53/1044317753.db2.gz UWSCBEJYFBTNCW-VXGBXAGGSA-N 0 1 321.367 4.394 20 0 DIADMN Cc1[nH]nc2cc(NC(=O)c3cc(C4CC4)oc3C3CC3)ccc12 ZINC000935197987 1044317999 /nfs/dbraw/zinc/31/79/99/1044317999.db2.gz HTLSSMYVUAPMEQ-UHFFFAOYSA-N 0 1 321.380 4.471 20 0 DIADMN COc1ccc(CNCc2cnc(C(C)(C)C)s2)cc1Cl ZINC000132306405 1044319276 /nfs/dbraw/zinc/31/92/76/1044319276.db2.gz QNPAFHAMSZLBES-UHFFFAOYSA-N 0 1 324.877 4.392 20 0 DIADMN CCC[C@@H]1[C@@H](C)CCC[N@H+]1CC[C@@H](C(=O)[O-])c1ccccc1 ZINC000563892066 1044319932 /nfs/dbraw/zinc/31/99/32/1044319932.db2.gz CIXCCIDXXNAKDM-CGTJXYLNSA-N 0 1 303.446 4.146 20 0 DIADMN CO[C@H](CN[C@@H](C)c1csc(-c2ccccc2F)n1)C1CC1 ZINC000293720856 1044319990 /nfs/dbraw/zinc/31/99/90/1044319990.db2.gz NRLWFLYWJZANEC-MEDUHNTESA-N 0 1 320.433 4.025 20 0 DIADMN CC(C)CCN(Cc1nnc(C2CC2)n1C1CC1)C1CCCC1 ZINC000360896265 1044324267 /nfs/dbraw/zinc/32/42/67/1044324267.db2.gz FRMCNOQUFHYOLV-UHFFFAOYSA-N 0 1 316.493 4.281 20 0 DIADMN CC[C@H](NCc1cc(Br)ccc1F)c1ccncc1 ZINC000360893139 1044324813 /nfs/dbraw/zinc/32/48/13/1044324813.db2.gz IHKOLYGCJGZOBY-HNNXBMFYSA-N 0 1 323.209 4.224 20 0 DIADMN C[C@@H](N[C@@H](C)c1nc(C(C)(C)C)no1)C1CCC(F)(F)CC1 ZINC000475226451 1044328233 /nfs/dbraw/zinc/32/82/33/1044328233.db2.gz YRGJZVIOIXWICF-MNOVXSKESA-N 0 1 315.408 4.232 20 0 DIADMN C[C@@H](NCc1ccc(Oc2ccccc2)nc1)c1cncs1 ZINC000360948461 1044334175 /nfs/dbraw/zinc/33/41/75/1044334175.db2.gz SUVRVTGCDYBIHW-CYBMUJFWSA-N 0 1 311.410 4.181 20 0 DIADMN COc1ccc2cc(CN(C)Cc3ccc(C)nc3)ccc2c1 ZINC000360964799 1044336477 /nfs/dbraw/zinc/33/64/77/1044336477.db2.gz AGYXKJHDSXDTFE-UHFFFAOYSA-N 0 1 306.409 4.184 20 0 DIADMN CSc1ccccc1CN(C)CC1=Cc2ccccc2OC1 ZINC000475275668 1044337411 /nfs/dbraw/zinc/33/74/11/1044337411.db2.gz CHZOQOKIMDGVCL-UHFFFAOYSA-N 0 1 311.450 4.316 20 0 DIADMN Cc1ccc(OC(F)F)c(CN2CC[C@H](C(F)(F)F)[C@H]2C)c1 ZINC000475273081 1044340974 /nfs/dbraw/zinc/34/09/74/1044340974.db2.gz BKQHKJILUZTYNK-PWSUYJOCSA-N 0 1 323.305 4.369 20 0 DIADMN COc1ccc(Cl)cc1CN[C@H]1CCCc2ccc(O)cc21 ZINC000361003517 1044343030 /nfs/dbraw/zinc/34/30/30/1044343030.db2.gz OVUDXYLHSDMSTC-KRWDZBQOSA-N 0 1 317.816 4.221 20 0 DIADMN Cc1nc([C@H](C)NC[C@H]2SCCc3ccccc32)cs1 ZINC000360999931 1044345376 /nfs/dbraw/zinc/34/53/76/1044345376.db2.gz XEHZNLSIALEACH-MEDUHNTESA-N 0 1 304.484 4.133 20 0 DIADMN CCCCc1ccc(-c2noc([C@@H](C)CC(F)(F)CN)n2)cc1 ZINC001211895498 1044345727 /nfs/dbraw/zinc/34/57/27/1044345727.db2.gz DWMBORMDPRPIJU-LBPRGKRZSA-N 0 1 323.387 4.167 20 0 DIADMN CCSc1cccc(CN[C@H](C)c2cnc(C)nc2C)c1 ZINC000293890682 1044345671 /nfs/dbraw/zinc/34/56/71/1044345671.db2.gz ZBYFBOKZCKZECG-GFCCVEGCSA-N 0 1 301.459 4.056 20 0 DIADMN COc1ccc([C@@H](Cc2ccncc2)NCc2occc2C)cc1 ZINC000293900911 1044349155 /nfs/dbraw/zinc/34/91/55/1044349155.db2.gz ZNPOFMTZCJBAJI-LJQANCHMSA-N 0 1 322.408 4.065 20 0 DIADMN CCC1(c2ccc(Cl)cc2)CCN(Cc2c[nH]cn2)CC1 ZINC000475290052 1044349622 /nfs/dbraw/zinc/34/96/22/1044349622.db2.gz FAGNGGIERZNRDF-UHFFFAOYSA-N 0 1 303.837 4.007 20 0 DIADMN c1c2ccccc2sc1CCNCc1nc2ccccc2o1 ZINC001202561028 1044352717 /nfs/dbraw/zinc/35/27/17/1044352717.db2.gz PIQRDTHIQXCWIU-UHFFFAOYSA-N 0 1 308.406 4.375 20 0 DIADMN Cc1ccc(C2CCN(Cc3ccc(F)cc3F)CC2)cn1 ZINC000361072968 1044357024 /nfs/dbraw/zinc/35/70/24/1044357024.db2.gz KUUKUHRGXXVXAK-UHFFFAOYSA-N 0 1 302.368 4.048 20 0 DIADMN CC[N@@H+](Cc1cc(C)c(C(=O)[O-])o1)[C@H](C)c1ccc(F)cc1 ZINC000564218168 1044357956 /nfs/dbraw/zinc/35/79/56/1044357956.db2.gz SDYLQVWWRNLARN-GFCCVEGCSA-N 0 1 305.349 4.008 20 0 DIADMN CCSc1ccccc1[C@@H](C)N[C@@H](C)c1cn(C)nc1C ZINC000361139421 1044366434 /nfs/dbraw/zinc/36/64/34/1044366434.db2.gz GTGFJNZPMAQIQH-OLZOCXBDSA-N 0 1 303.475 4.252 20 0 DIADMN Cc1ccc([C@@H](NC2CC(OC(C)(C)C)C2)c2ccccn2)cc1 ZINC000475340510 1044369644 /nfs/dbraw/zinc/36/96/44/1044369644.db2.gz WDORIQXKWHJSRJ-AFMYVXGZSA-N 0 1 324.468 4.415 20 0 DIADMN Cc1ccc(CN(Cc2cn(C)nc2C(F)F)C(C)C)s1 ZINC000361182268 1044369458 /nfs/dbraw/zinc/36/94/58/1044369458.db2.gz XWJWCMOLVUYZMN-UHFFFAOYSA-N 0 1 313.417 4.138 20 0 DIADMN Cc1[nH]ncc1C1CCN(C(=O)c2ccccc2C2CCC2)CC1 ZINC000935877982 1044369784 /nfs/dbraw/zinc/36/97/84/1044369784.db2.gz ATLMOBBWVVVICT-UHFFFAOYSA-N 0 1 323.440 4.005 20 0 DIADMN CC1(C2CC2)CCN(Cc2coc(-c3ccc(F)cc3)n2)CC1 ZINC000564397704 1044374507 /nfs/dbraw/zinc/37/45/07/1044374507.db2.gz QFZAPUBDNRMPNN-UHFFFAOYSA-N 0 1 314.404 4.493 20 0 DIADMN CO[C@@H](C)c1nc(C[N@H+]2CCC[C@H](C(C)(C)C)CC2)cs1 ZINC000475353503 1044374844 /nfs/dbraw/zinc/37/48/44/1044374844.db2.gz QMFPCYASSWGLAV-KBPBESRZSA-N 0 1 310.507 4.499 20 0 DIADMN CO[C@@H](C)c1nc(CN2CCC[C@H](C(C)(C)C)CC2)cs1 ZINC000475353503 1044374858 /nfs/dbraw/zinc/37/48/58/1044374858.db2.gz QMFPCYASSWGLAV-KBPBESRZSA-N 0 1 310.507 4.499 20 0 DIADMN Cc1cc([C@H](C)N[C@@H]2CCCC[C@@H]2Oc2ccccc2C)no1 ZINC000564420315 1044376377 /nfs/dbraw/zinc/37/63/77/1044376377.db2.gz XVLMAPVWQUUXQF-FCEWJHQRSA-N 0 1 314.429 4.332 20 0 DIADMN CCCN[C@H](C)c1nc(-c2ccc(Cl)c(Cl)c2)no1 ZINC000133350962 1044378936 /nfs/dbraw/zinc/37/89/36/1044378936.db2.gz ISLKYLMLMNBDFI-MRVPVSSYSA-N 0 1 300.189 4.104 20 0 DIADMN CC[C@H](N[C@@H]1CCOc2ccc(OC)cc21)c1ccccc1F ZINC000348262479 1044379928 /nfs/dbraw/zinc/37/99/28/1044379928.db2.gz OHSHGUHHCAEEIK-ZWKOTPCHSA-N 0 1 315.388 4.399 20 0 DIADMN Fc1ccc([C@H](N[C@@H]2CCC[C@@H](F)C2)c2cccnc2)c(F)c1 ZINC000564451607 1044382129 /nfs/dbraw/zinc/38/21/29/1044382129.db2.gz UFKDNMHXRCQRAD-DDUZABMNSA-N 0 1 320.358 4.320 20 0 DIADMN COc1cc(Cl)ccc1CN1CCC[C@H](c2nccs2)C1 ZINC000361261701 1044382235 /nfs/dbraw/zinc/38/22/35/1044382235.db2.gz QRTKCFPPVCOSOL-ZDUSSCGKSA-N 0 1 322.861 4.185 20 0 DIADMN CCN(Cc1ccc(OC)c(Cl)c1)[C@H](C)c1cccnc1 ZINC000564500946 1044385543 /nfs/dbraw/zinc/38/55/43/1044385543.db2.gz XNWLNNRLXARNGB-CYBMUJFWSA-N 0 1 304.821 4.327 20 0 DIADMN COc1ccc(F)cc1[C@@H](C)NCc1c(C)cc(C)nc1C ZINC000639561811 1044391588 /nfs/dbraw/zinc/39/15/88/1044391588.db2.gz ONKNTALZSNSBFO-CYBMUJFWSA-N 0 1 302.393 4.005 20 0 DIADMN COc1cccc(CN[C@H]2CCCc3cc(F)ccc32)c1F ZINC000192706592 1044392637 /nfs/dbraw/zinc/39/26/37/1044392637.db2.gz PCDXNWDYXLGRBT-INIZCTEOSA-N 0 1 303.352 4.141 20 0 DIADMN CC[C@H](c1ccncc1)N(C)Cc1cncc(C(F)(F)F)c1 ZINC000361349373 1044393826 /nfs/dbraw/zinc/39/38/26/1044393826.db2.gz UUWHNOJQBPDFBF-OAHLLOKOSA-N 0 1 309.335 4.079 20 0 DIADMN CC(C)[C@H]1C[C@H](NCc2c(F)cccc2OC(F)F)CS1 ZINC000475425774 1044395931 /nfs/dbraw/zinc/39/59/31/1044395931.db2.gz VBWWYZWORAHNFX-IINYFYTJSA-N 0 1 319.392 4.047 20 0 DIADMN CC=C(C)c1nc(-c2ccc3[nH]c(-c4cscn4)nc3c2)no1 ZINC000361353760 1044397849 /nfs/dbraw/zinc/39/78/49/1044397849.db2.gz IOCCCNPWULOVOX-YCRREMRBSA-N 0 1 323.381 4.160 20 0 DIADMN COc1cccc(Cl)c1CNCc1ccc(N(C)C)cc1C ZINC000237276617 1044398803 /nfs/dbraw/zinc/39/88/03/1044398803.db2.gz HOJNBNLLGFEUHH-UHFFFAOYSA-N 0 1 318.848 4.013 20 0 DIADMN c1coc(-c2ncc(CN3CCCc4ccccc4C3)s2)c1 ZINC000475430149 1044399070 /nfs/dbraw/zinc/39/90/70/1044399070.db2.gz QDCIGORGXKWAKU-UHFFFAOYSA-N 0 1 310.422 4.352 20 0 DIADMN COc1ccc(C(=O)Nc2ccc3c(C)[nH]nc3c2)cc1C1CC1 ZINC000444353374 1044400571 /nfs/dbraw/zinc/40/05/71/1044400571.db2.gz SIBDAKRCPNJOPK-UHFFFAOYSA-N 0 1 321.380 4.010 20 0 DIADMN Cc1ccncc1CN(C)[C@H](C)c1ccc(OC(F)F)cc1 ZINC000361413898 1044401882 /nfs/dbraw/zinc/40/18/82/1044401882.db2.gz SNZKVMSAUOBGGT-CYBMUJFWSA-N 0 1 306.356 4.184 20 0 DIADMN COc1ccc([C@@H](C)N[C@H](C)c2ccccc2OC)cc1OC ZINC000192910082 1044402473 /nfs/dbraw/zinc/40/24/73/1044402473.db2.gz SEGMCDKDNODUNV-ZIAGYGMSSA-N 0 1 315.413 4.124 20 0 DIADMN CO[C@]1(C)CCCN(Cc2csc(-c3ccc(C)o3)n2)CC1 ZINC000361435951 1044403432 /nfs/dbraw/zinc/40/34/32/1044403432.db2.gz XSNIUVNPWVEANT-QGZVFWFLSA-N 0 1 320.458 4.103 20 0 DIADMN C[C@H](c1ccc(Cl)cc1)N1CC2(CCC2)[C@H]1[C@@H]1CCCO1 ZINC000564790088 1044403882 /nfs/dbraw/zinc/40/38/82/1044403882.db2.gz QLPMNMTYBFCSFP-XOKHGSTOSA-N 0 1 305.849 4.435 20 0 DIADMN COc1ccc2c(c1)OCC[C@@H]2N[C@@H](C)c1ccc(F)c(F)c1 ZINC000361439506 1044404113 /nfs/dbraw/zinc/40/41/13/1044404113.db2.gz JNVDZMGCMULVRO-GTNSWQLSSA-N 0 1 319.351 4.148 20 0 DIADMN Cc1sc2[nH]c(CN(C)[C@@H]3CCC(C)(C)C3)nc(=O)c2c1C ZINC000361469645 1044405963 /nfs/dbraw/zinc/40/59/63/1044405963.db2.gz NNHPWUUNRUIVFU-GFCCVEGCSA-N 0 1 319.474 4.024 20 0 DIADMN C[C@H](CO)N(Cc1csc(C2CCCCC2)n1)CC1CCC1 ZINC000361501025 1044409683 /nfs/dbraw/zinc/40/96/83/1044409683.db2.gz LUXAGGANPZHKBN-CQSZACIVSA-N 0 1 322.518 4.174 20 0 DIADMN CCN(C)c1ccc(CN2CCC[C@H]2c2ccc(F)cc2)cn1 ZINC000361498035 1044410380 /nfs/dbraw/zinc/41/03/80/1044410380.db2.gz RNKCEMHCSJMKGH-SFHVURJKSA-N 0 1 313.420 4.014 20 0 DIADMN Cc1ccccc1[C@@H]1C[C@@H](C)[N@@H+]([C@H](C)c2ccc(C(=O)[O-])o2)C1 ZINC000565105302 1044414897 /nfs/dbraw/zinc/41/48/97/1044414897.db2.gz LJUYEQLAYBCSDV-RBSFLKMASA-N 0 1 313.397 4.225 20 0 DIADMN C[C@H](c1ccc(F)c(Cl)c1)N1CCC(n2cccn2)CC1 ZINC000361526114 1044415474 /nfs/dbraw/zinc/41/54/74/1044415474.db2.gz OICSQLWXOYSBFE-GFCCVEGCSA-N 0 1 307.800 4.074 20 0 DIADMN C[C@@H](N[C@@H]1CCCOc2ccccc21)c1ccnc(Cl)c1 ZINC000133593289 1044420021 /nfs/dbraw/zinc/42/00/21/1044420021.db2.gz LMSUCGPHJDWDEG-IUODEOHRSA-N 0 1 302.805 4.300 20 0 DIADMN Cc1ccc(C[N@H+]2C[C@@H](C3CCCCC3)C[C@H]2C(=O)[O-])c(C)c1 ZINC000565312669 1044424382 /nfs/dbraw/zinc/42/43/82/1044424382.db2.gz BTEPIEIDCGPVHL-OALUTQOASA-N 0 1 315.457 4.159 20 0 DIADMN COCC[N@@H+](Cc1cnc(C2CCC2)s1)[C@@H]1CC[C@@H](C)C1 ZINC000361641317 1044426759 /nfs/dbraw/zinc/42/67/59/1044426759.db2.gz YSBCGUHQYDNXIR-UKRRQHHQSA-N 0 1 308.491 4.048 20 0 DIADMN COCC[N@@H+](Cc1cnc(C2CCC2)s1)[C@H]1CC[C@@H](C)C1 ZINC000361641316 1044426836 /nfs/dbraw/zinc/42/68/36/1044426836.db2.gz YSBCGUHQYDNXIR-HIFRSBDPSA-N 0 1 308.491 4.048 20 0 DIADMN Cc1nc(CN2CC[C@](C)(c3ccc(F)cc3)C2)c(C)s1 ZINC000361645336 1044427108 /nfs/dbraw/zinc/42/71/08/1044427108.db2.gz RIHDETSVEBZCJK-KRWDZBQOSA-N 0 1 304.434 4.063 20 0 DIADMN C[C@@H]1CN(Cc2cccc3cnccc32)C[C@@H](c2ccccc2)O1 ZINC000248393597 1044427896 /nfs/dbraw/zinc/42/78/96/1044427896.db2.gz XHDHZLTUCUVDDG-IERDGZPVSA-N 0 1 318.420 4.197 20 0 DIADMN O=c1ccc(CN[C@H](c2c(Cl)cccc2Cl)C2CC2)c[nH]1 ZINC001202638687 1044428608 /nfs/dbraw/zinc/42/86/08/1044428608.db2.gz PQDBGISPQPMKMN-INIZCTEOSA-N 0 1 323.223 4.335 20 0 DIADMN CC(C)c1nc(CN[C@@H]2CCc3c2cccc3F)c2ccccn21 ZINC000565367036 1044429373 /nfs/dbraw/zinc/42/93/73/1044429373.db2.gz AABYLPFKGSMQDM-QGZVFWFLSA-N 0 1 323.415 4.374 20 0 DIADMN CCn1ccnc1[C@@H]1CCCCN1[C@@H](C)Cc1ccsc1 ZINC000565399322 1044432490 /nfs/dbraw/zinc/43/24/90/1044432490.db2.gz FSCFYHJHJDQSFI-HOCLYGCPSA-N 0 1 303.475 4.123 20 0 DIADMN C[C@H](NCc1ccc(N2CCCC2)nc1)c1ccccc1Cl ZINC000112522136 1044440255 /nfs/dbraw/zinc/44/02/55/1044440255.db2.gz YANMQMIBBAYYAU-AWEZNQCLSA-N 0 1 315.848 4.186 20 0 DIADMN CCOCc1ccc(CN[C@H](C)c2ccc(F)cc2F)cc1 ZINC000112523335 1044440391 /nfs/dbraw/zinc/44/03/91/1044440391.db2.gz OLOCYPRXIXRVLA-CYBMUJFWSA-N 0 1 305.368 4.352 20 0 DIADMN Cc1nc2cc(Nc3cccc(C(=O)OC(C)C)c3)ccc2[nH]1 ZINC001213075196 1044443256 /nfs/dbraw/zinc/44/32/56/1044443256.db2.gz IMMVWLCCWIMRJP-UHFFFAOYSA-N 0 1 309.369 4.180 20 0 DIADMN Cc1nnc([C@@H](C)NCC2(c3cccc(F)c3)CCCCC2)o1 ZINC000112536032 1044443821 /nfs/dbraw/zinc/44/38/21/1044443821.db2.gz PVOACXRGBNESAN-CYBMUJFWSA-N 0 1 317.408 4.070 20 0 DIADMN CSc1ccc(F)cc1CN[C@H](C)c1cnn(C(C)C)c1 ZINC000361803956 1044445038 /nfs/dbraw/zinc/44/50/38/1044445038.db2.gz JMYSLNIABTWTNJ-GFCCVEGCSA-N 0 1 307.438 4.176 20 0 DIADMN C[C@@H](N[C@H]1CCCc2c[nH]nc21)c1ccc(F)c2ccccc21 ZINC000294681434 1044447506 /nfs/dbraw/zinc/44/75/06/1044447506.db2.gz IECYLCHHNXKDOO-XIKOKIGWSA-N 0 1 309.388 4.430 20 0 DIADMN C[C@H](N[C@H]1CCCc2c[nH]nc21)c1ccc(F)c2ccccc21 ZINC000294681422 1044448169 /nfs/dbraw/zinc/44/81/69/1044448169.db2.gz IECYLCHHNXKDOO-SGTLLEGYSA-N 0 1 309.388 4.430 20 0 DIADMN O=C([O-])[C@@H]1C[C@H](C2CCCCC2)C[N@H+]1C/C=C\c1ccccc1 ZINC000565727481 1044452405 /nfs/dbraw/zinc/45/24/05/1044452405.db2.gz MAUJJNCVBOFXGJ-DBRSDMAZSA-N 0 1 313.441 4.055 20 0 DIADMN COc1cc(F)c([C@H](C)NCc2ccc(C)cc2)cc1OC ZINC000114504579 1044456245 /nfs/dbraw/zinc/45/62/45/1044456245.db2.gz SVWHAJPDBGKWEE-ZDUSSCGKSA-N 0 1 303.377 4.002 20 0 DIADMN CC[C@H](c1cccc(OC)c1)N(C)Cc1sccc1OC ZINC000565918937 1044463130 /nfs/dbraw/zinc/46/31/30/1044463130.db2.gz DPKQJNJTLCIIHG-OAHLLOKOSA-N 0 1 305.443 4.348 20 0 DIADMN COc1cc(C)ccc1CN[C@H]1CCCOc2cc(C)ccc21 ZINC000361981793 1044467477 /nfs/dbraw/zinc/46/74/77/1044467477.db2.gz OYYAPUZBIQWMOF-SFHVURJKSA-N 0 1 311.425 4.316 20 0 DIADMN O=C([O-])c1ccc(C[N@H+]2CCCC[C@@H]2c2cc3ccccc3[nH]2)o1 ZINC000565956607 1044467721 /nfs/dbraw/zinc/46/77/21/1044467721.db2.gz IJKZHDYETKYOLC-QGZVFWFLSA-N 0 1 324.380 4.186 20 0 DIADMN Cc1ccc([C@@H](C)[N@@H+](C)CC[C@H](C(=O)[O-])c2ccccc2)cc1 ZINC000566015436 1044469039 /nfs/dbraw/zinc/46/90/39/1044469039.db2.gz WPZIWDKBAULCNP-APWZRJJASA-N 0 1 311.425 4.246 20 0 DIADMN Cc1ccccc1C1CC([N@@H+](CCCCCC(=O)[O-])C2CC2)C1 ZINC000566015214 1044469298 /nfs/dbraw/zinc/46/92/98/1044469298.db2.gz NNIABOUICZJPPN-UHFFFAOYSA-N 0 1 315.457 4.350 20 0 DIADMN CCn1cc([C@H](C)N[C@@H](C)c2ccc(SC)c(F)c2)cn1 ZINC000294892202 1044469948 /nfs/dbraw/zinc/46/99/48/1044469948.db2.gz QYWURQYEVBOPEB-RYUDHWBXSA-N 0 1 307.438 4.176 20 0 DIADMN FC(F)Oc1cccc(Cl)c1CNc1nccn1C1CC1 ZINC000840887670 1044471030 /nfs/dbraw/zinc/47/10/30/1044471030.db2.gz SNQOXRAEBVHOCP-UHFFFAOYSA-N 0 1 313.735 4.085 20 0 DIADMN Cc1nnsc1CN[C@@H](c1oc2ccccc2c1C)C(C)C ZINC000566072123 1044472325 /nfs/dbraw/zinc/47/23/25/1044472325.db2.gz VEYIIMNGHDLMEU-MRXNPFEDSA-N 0 1 315.442 4.388 20 0 DIADMN Cc1ccc2nc(C)c(-c3nc(C4(N)CCCCC4)no3)cc2c1 ZINC000566096676 1044474979 /nfs/dbraw/zinc/47/49/79/1044474979.db2.gz ONHCRJPMFYVSIR-UHFFFAOYSA-N 0 1 322.412 4.020 20 0 DIADMN Fc1ccc([C@H](NCc2cc(F)ncc2F)C2CCC2)cc1 ZINC000294974028 1044477125 /nfs/dbraw/zinc/47/71/25/1044477125.db2.gz GNXAKOPNKJDKLG-QGZVFWFLSA-N 0 1 306.331 4.130 20 0 DIADMN C[C@@H](NC/C=C\c1ccccc1)c1ccc(Br)cn1 ZINC000475512632 1044478105 /nfs/dbraw/zinc/47/81/05/1044478105.db2.gz ZGSIZOJYMDYULY-DMTLFAOVSA-N 0 1 317.230 4.208 20 0 DIADMN C[C@H](NC/C=C\c1ccccc1)c1ccc(Br)cn1 ZINC000475512635 1044479037 /nfs/dbraw/zinc/47/90/37/1044479037.db2.gz ZGSIZOJYMDYULY-UJZCVKTISA-N 0 1 317.230 4.208 20 0 DIADMN CCCOc1c(Cl)cc(CNC2(CF)CCC2)cc1OC ZINC000566217141 1044479170 /nfs/dbraw/zinc/47/91/70/1044479170.db2.gz MEBRJLPPOVZKSG-UHFFFAOYSA-N 0 1 315.816 4.119 20 0 DIADMN COCCCC[C@@H](NCc1nc(C)c(C)s1)c1ccccc1 ZINC000348308491 1044479905 /nfs/dbraw/zinc/47/99/05/1044479905.db2.gz SBPBEHSUINODCF-QGZVFWFLSA-N 0 1 318.486 4.408 20 0 DIADMN Cc1ccc(Cl)c2ccc(NCc3n[nH]c(C(C)C)n3)nc12 ZINC000295019185 1044480743 /nfs/dbraw/zinc/48/07/43/1044480743.db2.gz UHQOMFNWYRLCMY-UHFFFAOYSA-N 0 1 315.808 4.050 20 0 DIADMN CC[C@@H](NCc1ccnc(C(F)(F)F)c1)c1ccccc1F ZINC000295021064 1044481602 /nfs/dbraw/zinc/48/16/02/1044481602.db2.gz KPXMDVYQGNAQPY-CQSZACIVSA-N 0 1 312.310 4.480 20 0 DIADMN CCC[C@H](N[C@@H](c1ccccc1F)[C@H](C)O)c1ccsc1 ZINC000566345206 1044483124 /nfs/dbraw/zinc/48/31/24/1044483124.db2.gz NLOVWTRCPAGADI-AFAVFJNCSA-N 0 1 307.434 4.440 20 0 DIADMN COCCN(Cc1coc(-c2cccs2)n1)[C@@H]1CC[C@H](C)C1 ZINC000362152486 1044484143 /nfs/dbraw/zinc/48/41/43/1044484143.db2.gz BXLZCLNAXYIZCN-DZGCQCFKSA-N 0 1 320.458 4.040 20 0 DIADMN O=C([O-])CCCC[N@H+]1CCCCC[C@H]1/C=C/c1cccs1 ZINC000566362597 1044484879 /nfs/dbraw/zinc/48/48/79/1044484879.db2.gz VAUQRFINCGZNCQ-NKSUMMKUSA-N 0 1 307.459 4.261 20 0 DIADMN O=C([O-])CC1(C[N@H+]2CCCC[C@H]2CCCc2ccccc2)CC1 ZINC000566362630 1044485029 /nfs/dbraw/zinc/48/50/29/1044485029.db2.gz VIBXPSYOHHADHI-SFHVURJKSA-N 0 1 315.457 4.119 20 0 DIADMN O=C([O-])c1ccc(C[N@H+]2CCC3(C2)CCCCC3)cc1Cl ZINC000566362756 1044485638 /nfs/dbraw/zinc/48/56/38/1044485638.db2.gz WECJRURTTPOTOX-UHFFFAOYSA-N 0 1 307.821 4.194 20 0 DIADMN Cc1cc(C[N@H+](C)[C@@H](C)c2cc3ccccc3o2)oc1C(=O)[O-] ZINC000566358570 1044485746 /nfs/dbraw/zinc/48/57/46/1044485746.db2.gz XPEUMEDUWIUTRK-LBPRGKRZSA-N 0 1 313.353 4.225 20 0 DIADMN CC(C)(C)OC1CCN(C/C=C\c2ccc(F)c(F)c2)CC1 ZINC000566366098 1044485831 /nfs/dbraw/zinc/48/58/31/1044485831.db2.gz JTCISRMCVGCKDM-PLNGDYQASA-N 0 1 309.400 4.258 20 0 DIADMN CCc1noc(C)c1CN1CCC(OC2CCC(C)CC2)CC1 ZINC000362241193 1044491888 /nfs/dbraw/zinc/49/18/88/1044491888.db2.gz UZRPOROFCMBCRS-UHFFFAOYSA-N 0 1 320.477 4.105 20 0 DIADMN Cc1ccncc1CN(C)Cc1ccc(C(F)(F)F)cc1C ZINC000475549307 1044492619 /nfs/dbraw/zinc/49/26/19/1044492619.db2.gz LFQHIHBPBCCYHF-UHFFFAOYSA-N 0 1 308.347 4.349 20 0 DIADMN CO[C@]1(C)CCCN(Cc2cccc(Cl)c2Cl)CC1 ZINC000475545023 1044493105 /nfs/dbraw/zinc/49/31/05/1044493105.db2.gz CIORYMXXKQSBDO-OAHLLOKOSA-N 0 1 302.245 4.384 20 0 DIADMN C[C@@H](N[C@@H](C)c1ccc(OCC2CC2)c(F)c1)c1cccnc1 ZINC000119448504 1044495508 /nfs/dbraw/zinc/49/55/08/1044495508.db2.gz SZKMOMWNBAKIPF-UONOGXRCSA-N 0 1 314.404 4.421 20 0 DIADMN CCN1CC[C@H](Oc2c(Br)ccc3ccccc32)C1 ZINC001227831381 1044495863 /nfs/dbraw/zinc/49/58/63/1044495863.db2.gz HDKPWBULWDOLKP-ZDUSSCGKSA-N 0 1 320.230 4.075 20 0 DIADMN C[C@H](c1ncc(C(C)(C)C)o1)N1CCC[C@H](C[C@@H]2CCOC2)C1 ZINC000362289746 1044496261 /nfs/dbraw/zinc/49/62/61/1044496261.db2.gz YZGNTESLGIUIDW-OAGGEKHMSA-N 0 1 320.477 4.172 20 0 DIADMN C[C@H]1CC[C@@H](CNCc2csc(-c3ccc(Cl)cc3)n2)O1 ZINC000566544595 1044498087 /nfs/dbraw/zinc/49/80/87/1044498087.db2.gz CLLLUMXMQJWJRP-NHYWBVRUSA-N 0 1 322.861 4.121 20 0 DIADMN c1ccc(OCc2cccnc2)c(CN2CC3(C2)CCCC3)c1 ZINC000362312664 1044499210 /nfs/dbraw/zinc/49/92/10/1044499210.db2.gz MOAJBFRGFIFWRX-UHFFFAOYSA-N 0 1 308.425 4.037 20 0 DIADMN Fc1ccc([C@H]2CC[N@@H+](Cc3ccc(Br)o3)C2)cc1 ZINC000475558396 1044499353 /nfs/dbraw/zinc/49/93/53/1044499353.db2.gz FUYUHVCQZNRLLS-LBPRGKRZSA-N 0 1 324.193 4.171 20 0 DIADMN Fc1ccc([C@H]2CCN(Cc3ccc(Br)o3)C2)cc1 ZINC000475558396 1044499359 /nfs/dbraw/zinc/49/93/59/1044499359.db2.gz FUYUHVCQZNRLLS-LBPRGKRZSA-N 0 1 324.193 4.171 20 0 DIADMN CC[C@H](C(=O)C(C#N)c1nc2ccccc2o1)c1ccccc1 ZINC000041541393 1044500972 /nfs/dbraw/zinc/50/09/72/1044500972.db2.gz QKKQKPVIBUJBID-GJZGRUSLSA-N 0 1 304.349 4.198 20 0 DIADMN CC[C@@H](C(=O)C(C#N)c1nc2ccccc2o1)c1ccccc1 ZINC000041541402 1044501188 /nfs/dbraw/zinc/50/11/88/1044501188.db2.gz QKKQKPVIBUJBID-CABCVRRESA-N 0 1 304.349 4.198 20 0 DIADMN CC(C)CN(Cc1nnc(-c2ccccc2Cl)o1)C1CC1 ZINC000120195393 1044502834 /nfs/dbraw/zinc/50/28/34/1044502834.db2.gz XLXHRPQWRXYJDJ-UHFFFAOYSA-N 0 1 305.809 4.010 20 0 DIADMN Cc1ccc2nc([C@H]3CCCN(C(=O)CC(C)(C)C)C3)[nH]c2c1 ZINC000120190792 1044502959 /nfs/dbraw/zinc/50/29/59/1044502959.db2.gz IOCWJUZUEBIVFL-AWEZNQCLSA-N 0 1 313.445 4.014 20 0 DIADMN Cc1nc([C@H](C)N2CCC(Cc3ccccc3)CC2)cs1 ZINC000566637606 1044504338 /nfs/dbraw/zinc/50/43/38/1044504338.db2.gz LRJAGHPNEWTALC-AWEZNQCLSA-N 0 1 300.471 4.467 20 0 DIADMN COc1ccc([C@H](CCO)N[C@@H](C)c2ccccc2Cl)cc1 ZINC000120354360 1044505448 /nfs/dbraw/zinc/50/54/48/1044505448.db2.gz XGBJPPYGOKXVKJ-UGSOOPFHSA-N 0 1 319.832 4.123 20 0 DIADMN CN(CCC1CCOCC1)Cc1csc(-c2ccsc2)n1 ZINC000120451764 1044508700 /nfs/dbraw/zinc/50/87/00/1044508700.db2.gz QYPPXTLHLQEKPI-UHFFFAOYSA-N 0 1 322.499 4.120 20 0 DIADMN Cc1ccc([C@H]2C[C@@H](C)CCN2CC(=O)N(C(C)C)C(C)C)o1 ZINC000362429023 1044510552 /nfs/dbraw/zinc/51/05/52/1044510552.db2.gz FBVFTGLUQGJXDT-DOTOQJQBSA-N 0 1 320.477 4.006 20 0 DIADMN Cc1cccnc1[C@@H](N[C@@H](C)c1cnn(C(C)C)c1)C(C)C ZINC000120640765 1044512755 /nfs/dbraw/zinc/51/27/55/1044512755.db2.gz CNJVABSMBKNDKY-RDJZCZTQSA-N 0 1 300.450 4.215 20 0 DIADMN C[C@@H]1CC[C@H](C(=O)[O-])[C@H](C)[N@H+]1Cc1ccc(-c2ccccc2)cc1 ZINC000566748533 1044513594 /nfs/dbraw/zinc/51/35/94/1044513594.db2.gz LYHHFSLPTSZGRF-GUXCAODWSA-N 0 1 323.436 4.427 20 0 DIADMN Cc1nn(C)c(Cl)c1CN1CCCC[C@H]1c1ccc(C)cc1 ZINC000303845278 1044514368 /nfs/dbraw/zinc/51/43/68/1044514368.db2.gz CLBZEQLMDJJNSL-KRWDZBQOSA-N 0 1 317.864 4.418 20 0 DIADMN CCC[C@H](N[C@H]1CCCc2c1cnn2C)c1ccc(F)cc1F ZINC000120897666 1044516034 /nfs/dbraw/zinc/51/60/34/1044516034.db2.gz MHBLTWZKQADMCK-IRXDYDNUSA-N 0 1 319.399 4.207 20 0 DIADMN CCOCCN(CC)Cc1cnc(-c2ccc(Cl)cc2)s1 ZINC000566812083 1044519501 /nfs/dbraw/zinc/51/95/01/1044519501.db2.gz XKGOAAXWLFZHHF-UHFFFAOYSA-N 0 1 324.877 4.322 20 0 DIADMN COc1ccc2c(c1)[C@H](NCc1cc(F)cc(Cl)c1)CCO2 ZINC000362524497 1044524093 /nfs/dbraw/zinc/52/40/93/1044524093.db2.gz IKJUKZFPPYZLCV-MRXNPFEDSA-N 0 1 321.779 4.101 20 0 DIADMN C[C@@H](NCc1cnn(C(C)(C)C)c1)c1ccc2ncsc2c1 ZINC000362526209 1044525191 /nfs/dbraw/zinc/52/51/91/1044525191.db2.gz QPRDGWQWMZVATE-GFCCVEGCSA-N 0 1 314.458 4.099 20 0 DIADMN Clc1ccc([C@@H](NCc2ccc3c(n2)CCC3)C2CC2)cc1 ZINC000566900480 1044526050 /nfs/dbraw/zinc/52/60/50/1044526050.db2.gz OSLNNEBVUMGIMX-IBGZPJMESA-N 0 1 312.844 4.465 20 0 DIADMN COc1ccc2c(c1)CN(Cc1ccc3cc(C)ccc3n1)CC2 ZINC001137209776 1044529228 /nfs/dbraw/zinc/52/92/28/1044529228.db2.gz SBLBPSOXOASENG-UHFFFAOYSA-N 0 1 318.420 4.110 20 0 DIADMN Cc1nc(CCN2CCC(c3c(F)cccc3F)CC2)cs1 ZINC000362574832 1044531763 /nfs/dbraw/zinc/53/17/63/1044531763.db2.gz HYAAPNNAEIZWTF-UHFFFAOYSA-N 0 1 322.424 4.152 20 0 DIADMN CC[C@](C)(NCc1ccc(C(C)(C)O)cc1)c1nc(C)cs1 ZINC000295532584 1044540487 /nfs/dbraw/zinc/54/04/87/1044540487.db2.gz VNHAFRIGTHPMPI-SFHVURJKSA-N 0 1 318.486 4.094 20 0 DIADMN Cc1cnn(C)c1CN1Cc2ccccc2C[C@@H]1c1ccccc1 ZINC000567085173 1044542285 /nfs/dbraw/zinc/54/22/85/1044542285.db2.gz SROGWZZEUFWSMG-HXUWFJFHSA-N 0 1 317.436 4.028 20 0 DIADMN Cc1cnn(C)c1CN1Cc2ccccc2C[C@H]1c1ccccc1 ZINC000567085172 1044542422 /nfs/dbraw/zinc/54/24/22/1044542422.db2.gz SROGWZZEUFWSMG-FQEVSTJZSA-N 0 1 317.436 4.028 20 0 DIADMN CCC1(CC)[C@H](N[C@@H](C)c2nc3ccccc3o2)C[C@@H]1OC ZINC000567189523 1044547924 /nfs/dbraw/zinc/54/79/24/1044547924.db2.gz CZHVUGRSFDUEFR-MAZHCROVSA-N 0 1 302.418 4.072 20 0 DIADMN Cc1cc([C@@H](NCc2cc(F)ncc2F)C2CC2)ccc1F ZINC000295653355 1044548267 /nfs/dbraw/zinc/54/82/67/1044548267.db2.gz IWYINZIXDYDROC-KRWDZBQOSA-N 0 1 306.331 4.048 20 0 DIADMN Cc1nc(C2CCN(c3nccc4cc(F)ccc43)CC2)[nH]c1C ZINC000884705694 1044552457 /nfs/dbraw/zinc/55/24/57/1044552457.db2.gz DWUXINHWWAMBEA-UHFFFAOYSA-N 0 1 324.403 4.098 20 0 DIADMN COc1cccc(C[N@@H+](C)Cc2ccc3cc(C)ccc3n2)c1 ZINC001137214492 1044552806 /nfs/dbraw/zinc/55/28/06/1044552806.db2.gz RLLGHDLUJYIYFD-UHFFFAOYSA-N 0 1 306.409 4.184 20 0 DIADMN COc1cccc(CN(C)Cc2ccc3cc(C)ccc3n2)c1 ZINC001137214492 1044552821 /nfs/dbraw/zinc/55/28/21/1044552821.db2.gz RLLGHDLUJYIYFD-UHFFFAOYSA-N 0 1 306.409 4.184 20 0 DIADMN COc1ccc(-c2n[nH]c(S[C@H](C)c3ccccc3)n2)cc1 ZINC000006141511 1044555467 /nfs/dbraw/zinc/55/54/67/1044555467.db2.gz RJPVGBSYKDORNI-GFCCVEGCSA-N 0 1 311.410 4.334 20 0 DIADMN Cc1cc([C@@H](C)NCc2ccc(N3CCCCC3)nc2)oc1C ZINC000282017391 1044557903 /nfs/dbraw/zinc/55/79/03/1044557903.db2.gz DVUNSJGZJIXVBZ-OAHLLOKOSA-N 0 1 313.445 4.133 20 0 DIADMN CC(C)CN(C(=O)c1cc(F)cc2[nH]cnc21)c1ccccc1 ZINC000567362783 1044561607 /nfs/dbraw/zinc/56/16/07/1044561607.db2.gz BZLBESQAAFZWPG-UHFFFAOYSA-N 0 1 311.360 4.005 20 0 DIADMN Cc1cc2cc(CNCc3cnc(C4CCC4)s3)ccc2[nH]1 ZINC000353131333 1044562424 /nfs/dbraw/zinc/56/24/24/1044562424.db2.gz YUGFTVDGJIULPW-UHFFFAOYSA-N 0 1 311.454 4.490 20 0 DIADMN O=C(Nc1nc(C2CCC2)cs1)c1cc(-c2ccccc2)n[nH]1 ZINC000444531038 1044564647 /nfs/dbraw/zinc/56/46/47/1044564647.db2.gz HVOPBESCCMCVGT-UHFFFAOYSA-N 0 1 324.409 4.053 20 0 DIADMN C[C@H](Cc1ccc(Cl)cc1)NCc1ncc(Cl)s1 ZINC000719411629 1044565967 /nfs/dbraw/zinc/56/59/67/1044565967.db2.gz HPNGAQIWBZCERV-SECBINFHSA-N 0 1 301.242 4.171 20 0 DIADMN c1cn2c(n1)[C@@H](N[C@@H](CCc1ccccc1)c1ccccc1)CC2 ZINC000295847938 1044566322 /nfs/dbraw/zinc/56/63/22/1044566322.db2.gz FYYYOFJUMLCHFT-PMACEKPBSA-N 0 1 317.436 4.292 20 0 DIADMN Cc1nnc([C@H](C)NCCc2c(Cl)cccc2Cl)s1 ZINC000295862492 1044568673 /nfs/dbraw/zinc/56/86/73/1044568673.db2.gz YIVFAJVRLVEHCZ-QMMMGPOBSA-N 0 1 316.257 4.047 20 0 DIADMN CC(C)C[C@@H]1CCCN1Cc1noc(-c2ccc(F)cc2F)n1 ZINC000444571814 1044568737 /nfs/dbraw/zinc/56/87/37/1044568737.db2.gz KEDFLTWRZHGGTJ-ZDUSSCGKSA-N 0 1 321.371 4.025 20 0 DIADMN Cc1nc(CN(CCc2cccc(F)c2)C2CC2)sc1C ZINC000348346141 1044569823 /nfs/dbraw/zinc/56/98/23/1044569823.db2.gz FVFGDOHZCFEZAN-UHFFFAOYSA-N 0 1 304.434 4.106 20 0 DIADMN c1nc(C2CCCC2)sc1CN1CCC[C@H](OCC2CC2)C1 ZINC000428371613 1044570387 /nfs/dbraw/zinc/57/03/87/1044570387.db2.gz GEARPRFSDFIDDJ-INIZCTEOSA-N 0 1 320.502 4.192 20 0 DIADMN Clc1cccc(CN2C[C@@H]3CCC[C@H]3C2)c1Br ZINC000719413574 1044571421 /nfs/dbraw/zinc/57/14/21/1044571421.db2.gz HTTJGMDVPXDQSR-QWRGUYRKSA-N 0 1 314.654 4.334 20 0 DIADMN Clc1cccc(CNC/C=C\C2CC2)c1Br ZINC000719416879 1044572758 /nfs/dbraw/zinc/57/27/58/1044572758.db2.gz SRDMMQBIPPHHMW-IHWYPQMZSA-N 0 1 300.627 4.158 20 0 DIADMN Fc1ccccc1-c1noc(CN2CCC3(C2)CCCCC3)n1 ZINC000444600158 1044573201 /nfs/dbraw/zinc/57/32/01/1044573201.db2.gz SPGLXJLJIUIOFP-UHFFFAOYSA-N 0 1 315.392 4.032 20 0 DIADMN CCOc1ccccc1[C@H](CC)NCc1ccc2c(n1)CCC2 ZINC000567566049 1044573947 /nfs/dbraw/zinc/57/39/47/1044573947.db2.gz OQVIUWYAPHYBBI-SFHVURJKSA-N 0 1 310.441 4.210 20 0 DIADMN CCn1cc([C@@H](C)N[C@H]2C[C@H](C)Sc3sccc32)cn1 ZINC000295898796 1044574092 /nfs/dbraw/zinc/57/40/92/1044574092.db2.gz IILBNXGFBKIEII-WDMOLILDSA-N 0 1 307.488 4.241 20 0 DIADMN CN(Cc1noc(-c2ccc(F)cc2F)n1)C1CCCCCC1 ZINC000444584485 1044575635 /nfs/dbraw/zinc/57/56/35/1044575635.db2.gz UHPNBMBBEBPFAT-UHFFFAOYSA-N 0 1 321.371 4.169 20 0 DIADMN Oc1cc(CNCc2cc3ccccc3o2)cc(C(F)(F)F)c1 ZINC000567653415 1044578472 /nfs/dbraw/zinc/57/84/72/1044578472.db2.gz XFXZGSWEHZKKMX-UHFFFAOYSA-N 0 1 321.298 4.447 20 0 DIADMN CC[C@H](O)[C@@H]1CCCCN1Cc1nc(C2CCCCC2)cs1 ZINC000444634362 1044581124 /nfs/dbraw/zinc/58/11/24/1044581124.db2.gz ABJIDEDEOZSIGM-IRXDYDNUSA-N 0 1 322.518 4.316 20 0 DIADMN C[C@@H](NCc1nc2ccccc2n1C)c1cccc(C2CC2)c1 ZINC000296000553 1044581425 /nfs/dbraw/zinc/58/14/25/1044581425.db2.gz KVJPZZDUJKGOIZ-CQSZACIVSA-N 0 1 305.425 4.302 20 0 DIADMN C[C@H](c1nc(C2CC2)no1)N1CC[C@H](c2ccccc2)[C@H](C)C1 ZINC000363169038 1044589022 /nfs/dbraw/zinc/58/90/22/1044589022.db2.gz JIWLBEBVWZYBBN-CPUCHLNUSA-N 0 1 311.429 4.134 20 0 DIADMN CC[C@@H](c1ccccc1)N(CC)C(=O)c1cc(C)cc2c[nH]nc21 ZINC000523285658 1044589677 /nfs/dbraw/zinc/58/96/77/1044589677.db2.gz BSZJBZURCKCMNX-SFHVURJKSA-N 0 1 321.424 4.485 20 0 DIADMN C[C@H](Cc1ccc(Cl)cc1)[N@@H+](C)Cc1ccc(C(=O)[O-])s1 ZINC000567905482 1044590266 /nfs/dbraw/zinc/59/02/66/1044590266.db2.gz BGWDIBAGFKVFQB-LLVKDONJSA-N 0 1 323.845 4.163 20 0 DIADMN CCOc1cccc2cc([C@H](C)NCc3[nH]nc(C)c3C)oc21 ZINC000885903779 1044591426 /nfs/dbraw/zinc/59/14/26/1044591426.db2.gz YAJXKKSEJQWHCH-ZDUSSCGKSA-N 0 1 313.401 4.022 20 0 DIADMN COc1ccc(CN[C@@H](c2cccs2)C2CC2)c(F)c1OC ZINC000885911292 1044592017 /nfs/dbraw/zinc/59/20/17/1044592017.db2.gz VBHAAISPHGQFQX-MRXNPFEDSA-N 0 1 321.417 4.145 20 0 DIADMN C[C@@H](O)[C@H]1C[C@H](C)CCN1Cc1nc(C2CCCCC2)cs1 ZINC000444685870 1044592296 /nfs/dbraw/zinc/59/22/96/1044592296.db2.gz QEMRKEGJSGOROW-CKEIUWERSA-N 0 1 322.518 4.172 20 0 DIADMN Cc1[nH]nc(CN[C@H](C)c2nc(-c3ccccc3)cs2)c1C ZINC000885974760 1044596363 /nfs/dbraw/zinc/59/63/63/1044596363.db2.gz BHOJCELGLBEBRZ-CYBMUJFWSA-N 0 1 312.442 4.001 20 0 DIADMN CCn1ccnc1[C@@H](C)N[C@@H](C)CSc1ccc(C)cc1 ZINC000296228420 1044598348 /nfs/dbraw/zinc/59/83/48/1044598348.db2.gz AHRUWIHCRYGODY-LSDHHAIUSA-N 0 1 303.475 4.043 20 0 DIADMN Cc1[nH]nc(CNC2(c3c(Cl)cccc3Cl)CC2)c1C ZINC000886018637 1044598605 /nfs/dbraw/zinc/59/86/05/1044598605.db2.gz FNHQEIYUKJWXAT-UHFFFAOYSA-N 0 1 310.228 4.112 20 0 DIADMN CCc1ccccc1CCN[C@@H](c1nc(C2CC2)no1)C(C)C ZINC000444683432 1044600468 /nfs/dbraw/zinc/60/04/68/1044600468.db2.gz GOEKFJCFEVPANV-QGZVFWFLSA-N 0 1 313.445 4.039 20 0 DIADMN CCN(Cc1noc(-c2ccsc2)n1)[C@H]1CCCC[C@H]1C ZINC000444677079 1044600480 /nfs/dbraw/zinc/60/04/80/1044600480.db2.gz PGBMKAPJATVLFR-OCCSQVGLSA-N 0 1 305.447 4.199 20 0 DIADMN Cc1cccc([C@H]2CCCC[N@H+]2CCCCCC(=O)[O-])c1C ZINC000568098439 1044601080 /nfs/dbraw/zinc/60/10/80/1044601080.db2.gz DOOIRJPOVCBQNZ-GOSISDBHSA-N 0 1 303.446 4.475 20 0 DIADMN CC[C@@]1(C)CC[N@H+]([C@@H](C(=O)[O-])c2ccc(Cl)c(Cl)c2)C1 ZINC000568066042 1044601872 /nfs/dbraw/zinc/60/18/72/1044601872.db2.gz OABBMKWUYJGMOK-HIFRSBDPSA-N 0 1 316.228 4.241 20 0 DIADMN Cc1cc(C[N@H+]2CCCC3(CCCCC3)CC2)oc1C(=O)[O-] ZINC000568066788 1044601995 /nfs/dbraw/zinc/60/19/95/1044601995.db2.gz CEDFLWSUBVVVIE-UHFFFAOYSA-N 0 1 305.418 4.223 20 0 DIADMN C[C@H](NC(=O)CN1CCCC[C@H]1c1ccccc1)c1ccccc1 ZINC000568069309 1044602063 /nfs/dbraw/zinc/60/20/63/1044602063.db2.gz QCRYAOUSDGXQQW-PXNSSMCTSA-N 0 1 322.452 4.091 20 0 DIADMN CCCCn1ccnc1-c1cccc(NCc2n[nH]c(C)c2C)c1 ZINC000886039694 1044602270 /nfs/dbraw/zinc/60/22/70/1044602270.db2.gz OKVFZYABOLZSST-UHFFFAOYSA-N 0 1 323.444 4.302 20 0 DIADMN FC(F)(F)C[C@H]1CCN(Cc2cccc(C(F)(F)F)c2)C1 ZINC000444705196 1044607760 /nfs/dbraw/zinc/60/77/60/1044607760.db2.gz MHRRIECFLLVDLP-LLVKDONJSA-N 0 1 311.269 4.480 20 0 DIADMN FC(F)(F)C[C@H]1CCN(Cc2ccc(Br)cc2)C1 ZINC000444704009 1044608416 /nfs/dbraw/zinc/60/84/16/1044608416.db2.gz TVADZFKCTIILEN-LLVKDONJSA-N 0 1 322.168 4.223 20 0 DIADMN FC(F)(F)C[C@@H]1CCN(Cc2cccc(C(F)(F)F)c2)C1 ZINC000444705197 1044608681 /nfs/dbraw/zinc/60/86/81/1044608681.db2.gz MHRRIECFLLVDLP-NSHDSACASA-N 0 1 311.269 4.480 20 0 DIADMN C[C@@H]1CSCCN(Cc2nc(C3CCCCC3)cs2)C1 ZINC000444701440 1044608940 /nfs/dbraw/zinc/60/89/40/1044608940.db2.gz WSLYWFJZRGHDAY-ZDUSSCGKSA-N 0 1 310.532 4.376 20 0 DIADMN C[C@H](N[C@H]1CCn2ccnc21)c1ccc(Cl)c2ccccc21 ZINC000296335802 1044609286 /nfs/dbraw/zinc/60/92/86/1044609286.db2.gz GPYVLDGJBSJONP-SJCJKPOMSA-N 0 1 311.816 4.485 20 0 DIADMN Cc1cc(C)cc(CN(C)[C@H](C)C(=O)Nc2c(C)cccc2C)c1 ZINC000444708134 1044609392 /nfs/dbraw/zinc/60/93/92/1044609392.db2.gz YZSHOAUPXAGAJQ-GOSISDBHSA-N 0 1 324.468 4.379 20 0 DIADMN COc1cc([C@@H](C)N[C@@H](c2ccc(F)cc2F)C(C)C)ccn1 ZINC000568238315 1044611734 /nfs/dbraw/zinc/61/17/34/1044611734.db2.gz RZWBEKNTVOBXFM-KZULUSFZSA-N 0 1 320.383 4.416 20 0 DIADMN CN(Cc1cc(F)cc(F)c1)Cc1ccc(F)c2cccnc12 ZINC000444712908 1044611654 /nfs/dbraw/zinc/61/16/54/1044611654.db2.gz ZVOCDUBEYSHVBF-UHFFFAOYSA-N 0 1 316.326 4.284 20 0 DIADMN CC(C)[C@@H]1CCc2ccccc2[C@@H]1N[C@H]1C[C@@H](C)n2ccnc21 ZINC000296379224 1044613447 /nfs/dbraw/zinc/61/34/47/1044613447.db2.gz JEFJYLFXRKKPND-TWKWOARYSA-N 0 1 309.457 4.438 20 0 DIADMN CCc1ccccc1C[N@H+]1C[C@@H](C2CCCCC2)C[C@@H]1C(=O)[O-] ZINC000568290930 1044614798 /nfs/dbraw/zinc/61/47/98/1044614798.db2.gz VSVBXQHTNWSQRQ-RBUKOAKNSA-N 0 1 315.457 4.104 20 0 DIADMN Fc1ccccc1[C@H]1CCN(Cc2cc(-c3ccccc3)on2)C1 ZINC000568301151 1044615068 /nfs/dbraw/zinc/61/50/68/1044615068.db2.gz ZCDUKTYXUPXPOO-INIZCTEOSA-N 0 1 322.383 4.470 20 0 DIADMN C[C@@H](c1nc2ccccc2s1)N(C)C[C@H](O)c1ccccc1 ZINC000052662242 1044615249 /nfs/dbraw/zinc/61/52/49/1044615249.db2.gz SKTLHSMTSDFRAZ-BBRMVZONSA-N 0 1 312.438 4.023 20 0 DIADMN C[C@H](c1cccc(Cl)c1)N1CCC[C@@H]([C@@H](O)C(F)(F)F)C1 ZINC000444722644 1044616307 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/nfs/dbraw/zinc/04/63/57/1045046357.db2.gz ARHBSAHMTLSYNQ-LBPRGKRZSA-N 0 1 320.820 4.042 20 0 DIADMN CN(Cc1nc(C2CC2)no1)[C@@H]1CCCC[C@@H]1c1ccccc1 ZINC000412001358 1045046830 /nfs/dbraw/zinc/04/68/30/1045046830.db2.gz YPYDGNCXOCYSJN-IAGOWNOFSA-N 0 1 311.429 4.105 20 0 DIADMN Cc1ccc(CN2CC3(CCOCC3)[C@H]2c2ccccc2)c(C)n1 ZINC000412015965 1045046889 /nfs/dbraw/zinc/04/68/89/1045046889.db2.gz UNLKKKNKQVAHAW-HXUWFJFHSA-N 0 1 322.452 4.052 20 0 DIADMN COc1sc(CN2CCCC23CCC3)cc1Br ZINC000446837340 1045047346 /nfs/dbraw/zinc/04/73/46/1045047346.db2.gz ZBKGJODJORHNKK-UHFFFAOYSA-N 0 1 316.264 4.038 20 0 DIADMN CCN(Cc1nc(=O)c2c(C)c(C)sc2[nH]1)C1CC(C)(C)C1 ZINC000412031124 1045047717 /nfs/dbraw/zinc/04/77/17/1045047717.db2.gz FTHYDAZNMGNCIP-UHFFFAOYSA-N 0 1 319.474 4.024 20 0 DIADMN Cc1nn(-c2ccccc2)cc1CNC1(c2cccc(F)c2)CC1 ZINC000152859903 1045048574 /nfs/dbraw/zinc/04/85/74/1045048574.db2.gz JUIMMOGILAHVAT-UHFFFAOYSA-N 0 1 321.399 4.099 20 0 DIADMN CCOc1ccc(CN[C@@H](C)c2sc(CC)nc2C)cc1F ZINC000152753313 1045048980 /nfs/dbraw/zinc/04/89/80/1045048980.db2.gz DSFYTCQGZSRSDR-NSHDSACASA-N 0 1 322.449 4.403 20 0 DIADMN C[C@@H](NCc1cccc2nccn21)c1ccc(Cl)cc1Cl ZINC000446852131 1045053932 /nfs/dbraw/zinc/05/39/32/1045053932.db2.gz MHKRATNHQMRZJY-LLVKDONJSA-N 0 1 320.223 4.492 20 0 DIADMN Cc1cc(CN2CCC[C@@H]2c2ccc(C(C)(C)C)cc2)ncn1 ZINC000428455226 1045056350 /nfs/dbraw/zinc/05/63/50/1045056350.db2.gz FPDQLFMFHQDOJH-LJQANCHMSA-N 0 1 309.457 4.420 20 0 DIADMN Fc1cccc2c1OCCC[C@H]2N[C@@H]1CCCc2occc21 ZINC000193273227 1045056889 /nfs/dbraw/zinc/05/68/89/1045056889.db2.gz AFASVSSNHSDCLL-HZPDHXFCSA-N 0 1 301.361 4.300 20 0 DIADMN Cc1ccccc1[C@@H](C(=O)[O-])[N@H+]1CCC[C@](C)(c2ccccc2)C1 ZINC000576472738 1045058648 /nfs/dbraw/zinc/05/86/48/1045058648.db2.gz JEXKGGWTXBTWNA-FPOVZHCZSA-N 0 1 323.436 4.174 20 0 DIADMN C[C@@H](N[C@@H](C)c1ccc(F)cc1F)c1ccc([S@@](C)=O)cc1 ZINC000153567984 1045058816 /nfs/dbraw/zinc/05/88/16/1045058816.db2.gz YHMVOSXMSUUDDI-DMDKVIGKSA-N 0 1 323.408 4.114 20 0 DIADMN Fc1ccc(CN2CC[C@H](c3cccnc3)C2)c(C(F)(F)F)c1 ZINC000576519365 1045061230 /nfs/dbraw/zinc/06/12/30/1045061230.db2.gz HTGLADHFIFYRQC-ZDUSSCGKSA-N 0 1 324.321 4.229 20 0 DIADMN CCC[C@@H]1[C@@H](C)CCC[N@H+]1Cc1cccc(C(=O)[O-])c1Cl ZINC000576522524 1045062224 /nfs/dbraw/zinc/06/22/24/1045062224.db2.gz FELRQHPVULALIU-SWLSCSKDSA-N 0 1 309.837 4.439 20 0 DIADMN CO[C@@H](C)CN(Cc1csc(-c2ccc(F)cc2)n1)C(C)C ZINC000525407753 1045062576 /nfs/dbraw/zinc/06/25/76/1045062576.db2.gz HZCWEDLIGFJDRN-ZDUSSCGKSA-N 0 1 322.449 4.195 20 0 DIADMN COC[C@@H](NCc1ccc(C(F)(F)F)cc1C)c1ccccc1 ZINC000576539221 1045063710 /nfs/dbraw/zinc/06/37/10/1045063710.db2.gz QIODWBWZBFMACK-QGZVFWFLSA-N 0 1 323.358 4.491 20 0 DIADMN Cc1ncc(CN2CC[C@@H](C(F)(F)F)C3(CCC3)C2)s1 ZINC000374508892 1045066113 /nfs/dbraw/zinc/06/61/13/1045066113.db2.gz VFOWRRORHMMQRW-GFCCVEGCSA-N 0 1 304.381 4.006 20 0 DIADMN CCc1noc(C)c1C[N@H+](C)[C@@H](CC)c1cccc(OC)c1 ZINC000576573333 1045066446 /nfs/dbraw/zinc/06/64/46/1045066446.db2.gz WKETUMJXTGFCEX-SFHVURJKSA-N 0 1 302.418 4.137 20 0 DIADMN CCc1noc(C)c1CN(C)[C@@H](CC)c1cccc(OC)c1 ZINC000576573333 1045066459 /nfs/dbraw/zinc/06/64/59/1045066459.db2.gz WKETUMJXTGFCEX-SFHVURJKSA-N 0 1 302.418 4.137 20 0 DIADMN O=C([O-])CCCCC[N@@H+](CCc1cccc(F)c1)C1CCCC1 ZINC000576591158 1045067175 /nfs/dbraw/zinc/06/71/75/1045067175.db2.gz IGUNZBSYOGYBMH-UHFFFAOYSA-N 0 1 321.436 4.258 20 0 DIADMN Cc1nccnc1[C@H](C)N[C@H]1CCc2c1ccc(Cl)c2Cl ZINC000446924506 1045071530 /nfs/dbraw/zinc/07/15/30/1045071530.db2.gz GZOJZBVLDUWQTJ-HZMBPMFUSA-N 0 1 322.239 4.430 20 0 DIADMN CCCCN(C(=O)c1cc(C2CC2)[nH]n1)[C@@H]1CCC[C@@H](C)C1 ZINC000576661683 1045071868 /nfs/dbraw/zinc/07/18/68/1045071868.db2.gz VUHNGPWTQKYCCI-UKRRQHHQSA-N 0 1 303.450 4.108 20 0 DIADMN C[C@H](N[C@@H](c1nccn1C)C1CC1)c1ccc(C(F)(F)F)cc1 ZINC000576724968 1045076764 /nfs/dbraw/zinc/07/67/64/1045076764.db2.gz SHTGBCLEVFWFRV-XHDPSFHLSA-N 0 1 323.362 4.241 20 0 DIADMN FC(F)(F)C[C@H]1CCN(Cc2cnc(C3CCC3)s2)C1 ZINC000446975786 1045078714 /nfs/dbraw/zinc/07/87/14/1045078714.db2.gz SLYFYPYDZULBHH-SNVBAGLBSA-N 0 1 304.381 4.185 20 0 DIADMN Cc1nc2c(s1)[C@@H](N[C@H](C)c1ccc(Cl)nc1)CCC2 ZINC000374739238 1045086664 /nfs/dbraw/zinc/08/66/64/1045086664.db2.gz XJRBDYXGENSJTC-SKDRFNHKSA-N 0 1 307.850 4.228 20 0 DIADMN CC[C@H](C(=O)Nc1cccc2c1CN(C1CC1)C2)c1ccccc1 ZINC000374836259 1045090496 /nfs/dbraw/zinc/09/04/96/1045090496.db2.gz GEKZCSAAKVVKAI-SFHVURJKSA-N 0 1 320.436 4.297 20 0 DIADMN CC[C@H](C[N@@H+](CC)[C@H](C(=O)[O-])c1ccsc1)c1ccccc1 ZINC000576950100 1045090612 /nfs/dbraw/zinc/09/06/12/1045090612.db2.gz DBQVMDYTPBXGQF-PBHICJAKSA-N 0 1 317.454 4.390 20 0 DIADMN COc1ccc(Cl)cc1CN(C)Cc1cc(C(C)(C)C)[nH]n1 ZINC000447084675 1045090942 /nfs/dbraw/zinc/09/09/42/1045090942.db2.gz FFMDNIXGSUUVFY-UHFFFAOYSA-N 0 1 321.852 4.001 20 0 DIADMN CCC[C@@]1(COC)CCCN1Cc1csc(-c2ccco2)n1 ZINC000447080243 1045091420 /nfs/dbraw/zinc/09/14/20/1045091420.db2.gz SURMAJIQABDNRZ-KRWDZBQOSA-N 0 1 320.458 4.184 20 0 DIADMN CCN(Cc1n[nH]c(C(C)C)n1)Cc1ccc2ccccc2c1 ZINC000428467306 1045091943 /nfs/dbraw/zinc/09/19/43/1045091943.db2.gz XXRPMJPBFAUALW-UHFFFAOYSA-N 0 1 308.429 4.103 20 0 DIADMN CCC[C@]1(COC)CCCN1Cc1csc(C(C)(C)C)n1 ZINC000447079068 1045092351 /nfs/dbraw/zinc/09/23/51/1045092351.db2.gz WXHNWELKWBTOKO-QGZVFWFLSA-N 0 1 310.507 4.222 20 0 DIADMN CCC[C@@]1(COC)CCCN1Cc1csc(C(C)(C)C)n1 ZINC000447079067 1045093030 /nfs/dbraw/zinc/09/30/30/1045093030.db2.gz WXHNWELKWBTOKO-KRWDZBQOSA-N 0 1 310.507 4.222 20 0 DIADMN Cc1ccccc1C[C@H](C)N(C)Cc1csc(C2CC2)n1 ZINC000447095450 1045096919 /nfs/dbraw/zinc/09/69/19/1045096919.db2.gz CWKYMSLCWNXTMA-AWEZNQCLSA-N 0 1 300.471 4.392 20 0 DIADMN C[C@@H](NC[C@@H](Cc1ccccc1)C(F)(F)F)c1nccs1 ZINC000577151596 1045105747 /nfs/dbraw/zinc/10/57/47/1045105747.db2.gz ICJQXYXSQQVKKU-DGCLKSJQSA-N 0 1 314.376 4.215 20 0 DIADMN Fc1cccc(F)c1CN(CCc1cscn1)C1CCCC1 ZINC000577235169 1045108479 /nfs/dbraw/zinc/10/84/79/1045108479.db2.gz NRXMNJFDQCAKAP-UHFFFAOYSA-N 0 1 322.424 4.409 20 0 DIADMN NC1(c2noc(CCc3ccc4ccccc4c3)n2)CCCCC1 ZINC000577215498 1045109533 /nfs/dbraw/zinc/10/95/33/1045109533.db2.gz OQDHZYLKUDJTFL-UHFFFAOYSA-N 0 1 321.424 4.126 20 0 DIADMN COc1cc([C@@H](C)NCc2ccc3sccc3c2)c(F)cn1 ZINC000577249939 1045111201 /nfs/dbraw/zinc/11/12/01/1045111201.db2.gz GXDBOBJJIURCIR-LLVKDONJSA-N 0 1 316.401 4.295 20 0 DIADMN COCCSc1ccc([C@H](C)NCc2occc2C)cc1 ZINC000525708849 1045112202 /nfs/dbraw/zinc/11/22/02/1045112202.db2.gz KINDPZOJQSWKCQ-AWEZNQCLSA-N 0 1 305.443 4.177 20 0 DIADMN Fc1ccc(C(N[C@H]2C[C@@H]2C(F)F)c2ccc(F)cc2)cc1 ZINC000577283873 1045112474 /nfs/dbraw/zinc/11/24/74/1045112474.db2.gz KWVMEHPYKBPWDE-GJZGRUSLSA-N 0 1 309.306 4.297 20 0 DIADMN Cc1ccn2cc(CN[C@H]3CC[C@H](C)c4ccccc43)nc2c1 ZINC000361151003 1045115945 /nfs/dbraw/zinc/11/59/45/1045115945.db2.gz DGRRCZXZRKUIDV-KXBFYZLASA-N 0 1 305.425 4.371 20 0 DIADMN C[C@H](CN[C@@H](c1nccn1C)c1ccccc1)c1ccc(F)cc1 ZINC000577336019 1045117928 /nfs/dbraw/zinc/11/79/28/1045117928.db2.gz DROUKLQTTOTYOO-DNVCBOLYSA-N 0 1 323.415 4.042 20 0 DIADMN CC(C)c1nc(CNCc2ccc(F)c(F)c2)c2ccccn21 ZINC000577406334 1045121038 /nfs/dbraw/zinc/12/10/38/1045121038.db2.gz RJKFSMVHHFDQNZ-UHFFFAOYSA-N 0 1 315.367 4.026 20 0 DIADMN Fc1cccc(Cl)c1CN1CCC[C@@H](c2ccncc2)C1 ZINC000577382932 1045122096 /nfs/dbraw/zinc/12/20/96/1045122096.db2.gz UEAOJOVLRRRKGI-CQSZACIVSA-N 0 1 304.796 4.254 20 0 DIADMN CCc1ccc(-c2ccc(CN[C@H](C)c3cnn(C)c3)o2)cc1 ZINC000525802764 1045122259 /nfs/dbraw/zinc/12/22/59/1045122259.db2.gz MYZCPISMLGZRCT-CQSZACIVSA-N 0 1 309.413 4.093 20 0 DIADMN Clc1cc(Cl)cc(CCN2CCC[C@@H](n3cccn3)C2)c1 ZINC000447342398 1045124359 /nfs/dbraw/zinc/12/43/59/1045124359.db2.gz JLXOYRQSUVRBKM-MRXNPFEDSA-N 0 1 324.255 4.070 20 0 DIADMN CC[C@@H](C(=O)Nc1ccccc1SC1CCCC1)N(C)C ZINC000413147135 1045125733 /nfs/dbraw/zinc/12/57/33/1045125733.db2.gz YVZRVCYJMIXAOC-HNNXBMFYSA-N 0 1 306.475 4.000 20 0 DIADMN c1cn(Cc2ccccc2)c(CN2CCCC3(CCCCC3)C2)n1 ZINC000600745000 1045135024 /nfs/dbraw/zinc/13/50/24/1045135024.db2.gz LYNXZDMOUPXXCP-UHFFFAOYSA-N 0 1 323.484 4.478 20 0 DIADMN COC(=O)c1coc([C@H](C)N[C@@H](c2ccccc2)C2CCC2)c1 ZINC000447525956 1045135249 /nfs/dbraw/zinc/13/52/49/1045135249.db2.gz AITBJPUYUKJMLM-UGSOOPFHSA-N 0 1 313.397 4.258 20 0 DIADMN Cc1ccc([C@H](N[C@@H](C)c2ccnn2C)c2ccccc2)cc1 ZINC000447516458 1045135469 /nfs/dbraw/zinc/13/54/69/1045135469.db2.gz OIQPZNMLHYLYQH-OXJNMPFZSA-N 0 1 305.425 4.169 20 0 DIADMN CCS[C@@H]1CC[C@H](N(C)Cc2cnc(C(F)(F)F)s2)C1 ZINC000447732227 1045169727 /nfs/dbraw/zinc/16/97/27/1045169727.db2.gz PERHYLXEWWUXPQ-VHSXEESVSA-N 0 1 324.437 4.268 20 0 DIADMN CCS[C@H]1CC[C@@H](N(C)Cc2cnc(C(F)(F)F)s2)C1 ZINC000447732395 1045170415 /nfs/dbraw/zinc/17/04/15/1045170415.db2.gz PERHYLXEWWUXPQ-ZJUUUORDSA-N 0 1 324.437 4.268 20 0 DIADMN CCOc1ncccc1CN[C@@H]1C[C@H](C(C)C)c2ccccc21 ZINC000447544346 1045142620 /nfs/dbraw/zinc/14/26/20/1045142620.db2.gz ULJZVYQFNIJRFF-RTBURBONSA-N 0 1 310.441 4.455 20 0 DIADMN COC(=O)c1coc([C@H](C)N[C@H](c2ccccc2C)C(C)C)c1 ZINC000447544250 1045143338 /nfs/dbraw/zinc/14/33/38/1045143338.db2.gz VHDKONDWYRPURM-KSSFIOAISA-N 0 1 315.413 4.423 20 0 DIADMN Fc1ccc2c(c1)[C@H](NCc1ccc3c(n1)CCCC3)CCC2 ZINC000447571004 1045145050 /nfs/dbraw/zinc/14/50/50/1045145050.db2.gz IKDLTESUSMQHKY-HXUWFJFHSA-N 0 1 310.416 4.267 20 0 DIADMN Cc1ccc2c(c1)[C@@H](NCc1ccc3c(n1)CCCC3)CCCO2 ZINC000447570293 1045147262 /nfs/dbraw/zinc/14/72/62/1045147262.db2.gz SLVRZTUTNAKNKE-FQEVSTJZSA-N 0 1 322.452 4.272 20 0 DIADMN Fc1ccc([C@H](NCc2ccc3c(n2)CCCC3)C2CC2)cc1 ZINC000447557827 1045148941 /nfs/dbraw/zinc/14/89/41/1045148941.db2.gz NIZRYXMUYSKRCX-HXUWFJFHSA-N 0 1 310.416 4.340 20 0 DIADMN CCc1ccc([C@@H](C)NCc2ccc3c(n2)CCCC3)s1 ZINC000447556240 1045149463 /nfs/dbraw/zinc/14/94/63/1045149463.db2.gz HBIXGBXSESFSNE-CYBMUJFWSA-N 0 1 300.471 4.435 20 0 DIADMN COC(=O)c1coc([C@@H](C)NCc2csc3ccccc23)c1 ZINC000447564224 1045150872 /nfs/dbraw/zinc/15/08/72/1045150872.db2.gz VYDIPZWAPXCVSI-LLVKDONJSA-N 0 1 315.394 4.132 20 0 DIADMN 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ZINC001137686161 1045933089 /nfs/dbraw/zinc/93/30/89/1045933089.db2.gz CREWKHHPSMPOFI-UHFFFAOYSA-N 0 1 311.422 4.228 20 0 DIADMN Cc1cc(O)c(C(C)C)cc1NC(=O)c1[nH]cnc1C(C)(C)C ZINC000632030441 1045933538 /nfs/dbraw/zinc/93/35/38/1045933538.db2.gz WIAHSNLCEQJUDI-UHFFFAOYSA-N 0 1 315.417 4.097 20 0 DIADMN CC[C@H](NCc1ccc(-c2csc(C)n2)o1)c1ccncc1 ZINC000453100368 1045934173 /nfs/dbraw/zinc/93/41/73/1045934173.db2.gz WSOWQPUGAJXPOT-HNNXBMFYSA-N 0 1 313.426 4.347 20 0 DIADMN Cc1ccccc1CN[C@H](C)c1ncc(-c2ccccc2)n1C ZINC000453096601 1045936128 /nfs/dbraw/zinc/93/61/28/1045936128.db2.gz UENSBWQDZKEOLA-MRXNPFEDSA-N 0 1 305.425 4.246 20 0 DIADMN CCCN(CCc1cccs1)Cc1csc(Cl)n1 ZINC000828897090 1045940884 /nfs/dbraw/zinc/94/08/84/1045940884.db2.gz RUVCNPJRBGEPSL-UHFFFAOYSA-N 0 1 300.880 4.313 20 0 DIADMN Cc1ccsc1[C@H](Cc1ccccc1)N[C@@H](C)c1ccncn1 ZINC000453112627 1045941122 /nfs/dbraw/zinc/94/11/22/1045941122.db2.gz RCTGJMOBBOGDCK-YJBOKZPZSA-N 0 1 323.465 4.481 20 0 DIADMN Fc1ccc(CN2CCC(CCCc3ccccc3)CC2)cn1 ZINC001137735595 1045952983 /nfs/dbraw/zinc/95/29/83/1045952983.db2.gz ZLRLUAYEWPFLOZ-UHFFFAOYSA-N 0 1 312.432 4.456 20 0 DIADMN Cc1cc(-c2noc([C@H]3CCCCC3(F)F)n2)cc2nc[nH]c21 ZINC000453131339 1045953506 /nfs/dbraw/zinc/95/35/06/1045953506.db2.gz ZQBBCFLRQGDBNX-LLVKDONJSA-N 0 1 318.327 4.214 20 0 DIADMN C[C@@H](N[C@@H](C)c1ccc(F)cc1F)c1ccc2c(c1)CCO2 ZINC000192977673 1045957944 /nfs/dbraw/zinc/95/79/44/1045957944.db2.gz UUBUXDWFTBSHTN-NEPJUHHUSA-N 0 1 303.352 4.312 20 0 DIADMN COc1cccc2cc([C@H](C)NCc3ccc(C#N)cc3)oc21 ZINC000079720624 1045961043 /nfs/dbraw/zinc/96/10/43/1045961043.db2.gz HAUDJHZPEOLXML-ZDUSSCGKSA-N 0 1 306.365 4.164 20 0 DIADMN CCc1nc(CNc2ccnc3cc(C(F)(F)F)ccc32)co1 ZINC000829183957 1045961183 /nfs/dbraw/zinc/96/11/83/1045961183.db2.gz UTFWCXIHCAEION-UHFFFAOYSA-N 0 1 321.302 4.416 20 0 DIADMN CC[C@@H](NC1(c2ccc3c(c2)OCO3)CC1)c1ccsc1 ZINC000453166566 1045962930 /nfs/dbraw/zinc/96/29/30/1045962930.db2.gz BDUYHUCRITYXLF-CQSZACIVSA-N 0 1 301.411 4.207 20 0 DIADMN C[C@H](NC1(c2ccccc2)CC1)c1cc(-c2ccccc2)nn1C ZINC000453170214 1045964918 /nfs/dbraw/zinc/96/49/18/1045964918.db2.gz GBJGFTZKCOPKBG-INIZCTEOSA-N 0 1 317.436 4.427 20 0 DIADMN COC(=O)c1ccccc1C[N@H+]1CCC[C@H]1c1cccc(C)c1 ZINC001137784294 1045965585 /nfs/dbraw/zinc/96/55/85/1045965585.db2.gz GXTXHLTYMOQHIO-IBGZPJMESA-N 0 1 309.409 4.119 20 0 DIADMN COC(=O)c1ccccc1CN1CCC[C@H]1c1cccc(C)c1 ZINC001137784294 1045965592 /nfs/dbraw/zinc/96/55/92/1045965592.db2.gz GXTXHLTYMOQHIO-IBGZPJMESA-N 0 1 309.409 4.119 20 0 DIADMN COC(=O)c1ccccc1C[N@H+]1CCC[C@H]1c1ccccc1C ZINC001137785556 1045966337 /nfs/dbraw/zinc/96/63/37/1045966337.db2.gz LMNAXOQVMAKHHM-IBGZPJMESA-N 0 1 309.409 4.119 20 0 DIADMN CN(C)c1ccnc(NC(=O)CC2CCC(C(C)(C)C)CC2)c1 ZINC001137800132 1045967437 /nfs/dbraw/zinc/96/74/37/1045967437.db2.gz VZYZDPDGOIKGFG-UHFFFAOYSA-N 0 1 317.477 4.329 20 0 DIADMN CCN(Cc1cccc(Cl)c1)Cc1ccccc1C(=O)OC ZINC001137791522 1045967709 /nfs/dbraw/zinc/96/77/09/1045967709.db2.gz IUPJEIQOUXJESO-UHFFFAOYSA-N 0 1 317.816 4.149 20 0 DIADMN CC[C@@H](N[C@H]1CCCOc2cc(F)ccc21)c1ccncc1 ZINC000453183805 1045970298 /nfs/dbraw/zinc/97/02/98/1045970298.db2.gz OKEVBJOSKABPRW-SJORKVTESA-N 0 1 300.377 4.175 20 0 DIADMN CCCCC[C@@H](C(=O)Nc1cnn(-c2ccncc2)c1)C(C)C ZINC000755281713 1045970347 /nfs/dbraw/zinc/97/03/47/1045970347.db2.gz UDLVDRUERAZQAN-QGZVFWFLSA-N 0 1 314.433 4.058 20 0 DIADMN Cc1ccc(CN2CCCC(F)(F)CC2)c(Br)c1 ZINC001137802630 1045971280 /nfs/dbraw/zinc/97/12/80/1045971280.db2.gz DKSWPMKBKCIWAI-UHFFFAOYSA-N 0 1 318.205 4.379 20 0 DIADMN CCCCC[C@@H](C(=O)Nc1cccc(-c2nnc[nH]2)c1)C(C)C ZINC000755315665 1045974238 /nfs/dbraw/zinc/97/42/38/1045974238.db2.gz MTFJVNWNUCVGFF-MRXNPFEDSA-N 0 1 314.433 4.263 20 0 DIADMN COc1cccc([C@@H]2CCCN(Cc3scnc3Cl)C2)c1 ZINC001137824922 1045974252 /nfs/dbraw/zinc/97/42/52/1045974252.db2.gz PNBLDAMLAJFLIB-CYBMUJFWSA-N 0 1 322.861 4.185 20 0 DIADMN CCc1nc[nH]c1C(=O)Nc1ccccc1Nc1ccc(F)cc1 ZINC001137834168 1045977571 /nfs/dbraw/zinc/97/75/71/1045977571.db2.gz YBAUWBZKTSHQOW-UHFFFAOYSA-N 0 1 324.359 4.107 20 0 DIADMN CC[C@@H](N[C@@H]1CCCOc2c(F)cccc21)c1ccncc1 ZINC000453199501 1045979934 /nfs/dbraw/zinc/97/99/34/1045979934.db2.gz SFBSRXYKADBVEL-IAGOWNOFSA-N 0 1 300.377 4.175 20 0 DIADMN Cc1ccccc1C1(NCc2cc(Cl)nc(Cl)c2)CC1 ZINC000829495839 1045980396 /nfs/dbraw/zinc/98/03/96/1045980396.db2.gz XANSTAJQYZZIGZ-UHFFFAOYSA-N 0 1 307.224 4.476 20 0 DIADMN COCCCC[C@H](N[C@@H]1C[C@H](C)n2ccnc21)c1ccccc1 ZINC000453201110 1045982113 /nfs/dbraw/zinc/98/21/13/1045982113.db2.gz ABOFGAGLVADPHA-RYQLBKOJSA-N 0 1 313.445 4.037 20 0 DIADMN CC(C)=CCCN[C@H](c1nccn1C)c1ccc(Cl)cc1 ZINC000453209519 1045984759 /nfs/dbraw/zinc/98/47/59/1045984759.db2.gz LNOURFKUONOVRS-INIZCTEOSA-N 0 1 303.837 4.109 20 0 DIADMN CC(C)(CC[N@H+]1CCC[C@@H](CCCc2ccccc2)C1)C(=O)[O-] ZINC000902359784 1045984981 /nfs/dbraw/zinc/98/49/81/1045984981.db2.gz QOUVWEKGHUIUIG-GOSISDBHSA-N 0 1 317.473 4.222 20 0 DIADMN CCn1ccnc1[C@H](C)NC[C@H](C)Oc1ccc(C(C)C)cc1 ZINC000453221852 1045990566 /nfs/dbraw/zinc/99/05/66/1045990566.db2.gz KOWTWTGBWPCYOM-HOTGVXAUSA-N 0 1 315.461 4.145 20 0 DIADMN Cc1c2cc(Cl)ccc2sc1CN[C@H]1CCn2ccnc21 ZINC000453226521 1045992519 /nfs/dbraw/zinc/99/25/19/1045992519.db2.gz VKZQZUQLYBBOOC-ZDUSSCGKSA-N 0 1 317.845 4.294 20 0 DIADMN C[C@@H]1CCCC[N@@H+](Cc2ccc(C(=O)[O-])cc2C(F)(F)F)C1 ZINC000902418711 1045993808 /nfs/dbraw/zinc/99/38/08/1045993808.db2.gz QVVBAIKNWDVZKY-LLVKDONJSA-N 0 1 315.335 4.026 20 0 DIADMN CCC(C)(C)CN[C@@H](c1nccn1C)c1ccc(Cl)cc1 ZINC000453226941 1045994509 /nfs/dbraw/zinc/99/45/09/1045994509.db2.gz YFELQENJDFMCFP-OAHLLOKOSA-N 0 1 305.853 4.189 20 0 DIADMN COc1cccc(CCCN(C)Cc2cc(F)cc(F)c2F)c1 ZINC001137873571 1045995257 /nfs/dbraw/zinc/99/52/57/1045995257.db2.gz KQTKIIFOGGKWBC-UHFFFAOYSA-N 0 1 323.358 4.177 20 0 DIADMN CNc1ccccc1CNC1(c2ccc(F)cc2F)CCC1 ZINC000902430728 1045995797 /nfs/dbraw/zinc/99/57/97/1045995797.db2.gz QXOONOIYYJCMIU-UHFFFAOYSA-N 0 1 302.368 4.176 20 0 DIADMN Fc1cc(F)c(C[N@H+]2CC[C@@H](Cc3ccccc3)C2)cc1F ZINC001137891414 1045999725 /nfs/dbraw/zinc/99/97/25/1045999725.db2.gz OTCUVYRFMCKKDI-AWEZNQCLSA-N 0 1 305.343 4.169 20 0 DIADMN Fc1cc(F)c(CN2CC[C@@H](Cc3ccccc3)C2)cc1F ZINC001137891414 1045999736 /nfs/dbraw/zinc/99/97/36/1045999736.db2.gz OTCUVYRFMCKKDI-AWEZNQCLSA-N 0 1 305.343 4.169 20 0 DIADMN C[N@H+](Cc1ccc(-c2ccccc2C(=O)[O-])o1)C[C@H]1CC1(C)C ZINC000902452047 1045999876 /nfs/dbraw/zinc/99/98/76/1045999876.db2.gz HFODRKBHXJRCFC-CYBMUJFWSA-N 0 1 313.397 4.123 20 0 DIADMN C[N@H+](Cc1ccc(-c2ccccc2C(=O)[O-])o1)C[C@@H]1CC1(C)C ZINC000902452048 1046000461 /nfs/dbraw/zinc/00/04/61/1046000461.db2.gz HFODRKBHXJRCFC-ZDUSSCGKSA-N 0 1 313.397 4.123 20 0 DIADMN CCc1oc(C[N@H+]2CC[C@H]([C@H]3CCCC3(C)C)C2)cc1C(=O)[O-] ZINC000902470147 1046002672 /nfs/dbraw/zinc/00/26/72/1046002672.db2.gz ZRAMVLSWWNZMNA-XJKSGUPXSA-N 0 1 319.445 4.188 20 0 DIADMN CCc1oc(C[N@H+]2CCC(C)(C)CC(C)(C)C2)cc1C(=O)[O-] ZINC000902473576 1046002982 /nfs/dbraw/zinc/00/29/82/1046002982.db2.gz CBLRYBCQACNXLK-UHFFFAOYSA-N 0 1 307.434 4.188 20 0 DIADMN CNc1ccc(C)cc1CN[C@@H](C)c1cn(C(C)(C)C)nc1C ZINC000902488930 1046004571 /nfs/dbraw/zinc/00/45/71/1046004571.db2.gz OQMOOGBFKHPBPD-AWEZNQCLSA-N 0 1 314.477 4.147 20 0 DIADMN C[C@H](NC(=O)c1ccc(Cl)c(O)c1)c1ccc(Cl)s1 ZINC001137908707 1046007860 /nfs/dbraw/zinc/00/78/60/1046007860.db2.gz KHXBHSNJDVKZBN-ZETCQYMHSA-N 0 1 316.209 4.252 20 0 DIADMN CC[C@H](N[C@H](C)c1cc(Cl)sc1Cl)[C@H](O)C(F)F ZINC000453268334 1046008987 /nfs/dbraw/zinc/00/89/87/1046008987.db2.gz JPIWYADGBQEGNA-SHRPOTNHSA-N 0 1 318.216 4.110 20 0 DIADMN C[C@@H](c1ccc(Cl)cc1Cl)[N@@H+](C)CCC(C)(C)C(=O)[O-] ZINC000902509888 1046009149 /nfs/dbraw/zinc/00/91/49/1046009149.db2.gz KTEBBKWFSUXPKF-JTQLQIEISA-N 0 1 318.244 4.487 20 0 DIADMN Nc1nc(CN[C@@H](c2ccccc2)C2CCCCC2)cs1 ZINC000902500876 1046009347 /nfs/dbraw/zinc/00/93/47/1046009347.db2.gz YLFLDVSLYHKNMC-INIZCTEOSA-N 0 1 301.459 4.137 20 0 DIADMN CC[C@H]1C[C@@H](C)C[N@H+]1Cc1ccc(-c2ccc(C(=O)[O-])cc2)o1 ZINC000902517193 1046009796 /nfs/dbraw/zinc/00/97/96/1046009796.db2.gz BSSAUACZUQUQFY-CJNGLKHVSA-N 0 1 313.397 4.265 20 0 DIADMN Fc1ccc2c(c1)[C@@H](NCc1cccc(C(F)(F)F)n1)CCC2 ZINC000453267449 1046010545 /nfs/dbraw/zinc/01/05/45/1046010545.db2.gz MFTZAXJWNAJSKV-HNNXBMFYSA-N 0 1 324.321 4.407 20 0 DIADMN CC[C@H]1C[C@@H](C)C[N@H+]1Cc1ccc(C(=O)[O-])cc1C(F)(F)F ZINC000902520492 1046011241 /nfs/dbraw/zinc/01/12/41/1046011241.db2.gz JEHWXDXEORVYSM-MFKMUULPSA-N 0 1 315.335 4.024 20 0 DIADMN COc1cc([C@H](C)N[C@H]2CCCc3c(F)cccc32)c(F)cn1 ZINC000453242384 1046010935 /nfs/dbraw/zinc/01/09/35/1046010935.db2.gz XFCBPXHSZARFIT-GTNSWQLSSA-N 0 1 318.367 4.097 20 0 DIADMN C[C@@H]1C[C@@H]2CCCC[C@H]2[N@H+]1Cc1ccnc2c(C(=O)[O-])cccc12 ZINC000902519299 1046011461 /nfs/dbraw/zinc/01/14/61/1046011461.db2.gz URFWSIXIZBGGTJ-QWQRMKEZSA-N 0 1 324.424 4.086 20 0 DIADMN CC(C)[N@H+](Cc1ccc(-c2ccc(C(=O)[O-])cc2)o1)CC1CC1 ZINC000902524540 1046011674 /nfs/dbraw/zinc/01/16/74/1046011674.db2.gz UZUHKMRAKCJAGI-UHFFFAOYSA-N 0 1 313.397 4.265 20 0 DIADMN CC(C)(CC[N@H+]1CCCCC[C@H]1/C=C/c1ccccc1)C(=O)[O-] ZINC000902524771 1046012813 /nfs/dbraw/zinc/01/28/13/1046012813.db2.gz AKXXKSAYQSPYQJ-HHNLSAEISA-N 0 1 315.457 4.445 20 0 DIADMN C[C@H]1CC(C)(C)C[N@H+]1Cc1ccc(-c2ccccc2C(=O)[O-])o1 ZINC000902532757 1046014365 /nfs/dbraw/zinc/01/43/65/1046014365.db2.gz SKZZYUYFNNDKDN-ZDUSSCGKSA-N 0 1 313.397 4.265 20 0 DIADMN C[C@H]1CCCCC[N@H+]1Cc1ccc(-c2ccc(C(=O)[O-])cc2)o1 ZINC000902531863 1046014634 /nfs/dbraw/zinc/01/46/34/1046014634.db2.gz INAJIBSYOUKCRU-AWEZNQCLSA-N 0 1 313.397 4.409 20 0 DIADMN CSc1ccc(Cl)c(NC(=O)c2cn[nH]c2C(C)C)c1 ZINC000633609386 1046015023 /nfs/dbraw/zinc/01/50/23/1046015023.db2.gz SJIPYGGGYKRZER-UHFFFAOYSA-N 0 1 309.822 4.161 20 0 DIADMN C[C@H](c1ccc(Cl)cc1)[C@H](C)[N@@H+](C)CCC(C)(C)C(=O)[O-] ZINC000902526129 1046014776 /nfs/dbraw/zinc/01/47/76/1046014776.db2.gz WCNUYXCVXJYVOK-STQMWFEESA-N 0 1 311.853 4.265 20 0 DIADMN C[C@H](c1ccc(Cl)c(Cl)c1)[N@@H+](C)CCC(C)(C)C(=O)[O-] ZINC000902530832 1046014841 /nfs/dbraw/zinc/01/48/41/1046014841.db2.gz RCJIDHFPOWKQOC-SNVBAGLBSA-N 0 1 318.244 4.487 20 0 DIADMN CC[C@H](NCc1ccnc(C)c1)c1ccccc1Br ZINC000453289724 1046015418 /nfs/dbraw/zinc/01/54/18/1046015418.db2.gz MLQAELTXTKQCPR-INIZCTEOSA-N 0 1 319.246 4.393 20 0 DIADMN C[C@H]1CC(C)(C)C[N@H+]1Cc1ccc(-c2ccc(C(=O)[O-])cc2)o1 ZINC000902531012 1046015565 /nfs/dbraw/zinc/01/55/65/1046015565.db2.gz COHZKRSLOKMEDW-ZDUSSCGKSA-N 0 1 313.397 4.265 20 0 DIADMN CC(C)(CC[N@H+]1CCCC[C@@H]1CCCc1ccccc1)C(=O)[O-] ZINC000902532003 1046016110 /nfs/dbraw/zinc/01/61/10/1046016110.db2.gz YCWSIVOWXCFWPK-GOSISDBHSA-N 0 1 317.473 4.365 20 0 DIADMN Cc1ccc([C@@H]2CCC[C@H]2[N@@H+](C)CCC(C)(C)C(=O)[O-])cc1 ZINC000902530730 1046016138 /nfs/dbraw/zinc/01/61/38/1046016138.db2.gz BKUSKULJIYDPHE-DLBZAZTESA-N 0 1 303.446 4.064 20 0 DIADMN CCO[C@H]1CCCN(Cc2cc3cc(C)ccc3nc2Cl)C1 ZINC001137922705 1046016299 /nfs/dbraw/zinc/01/62/99/1046016299.db2.gz IISBIFCJJATUAM-INIZCTEOSA-N 0 1 318.848 4.198 20 0 DIADMN CC[C@@H]1CC[C@H](C)[N@H+]1Cc1ccc(-c2ccc(C(=O)[O-])cc2)o1 ZINC000902527839 1046016468 /nfs/dbraw/zinc/01/64/68/1046016468.db2.gz MGVHLIOXFBUDAQ-XJKSGUPXSA-N 0 1 313.397 4.408 20 0 DIADMN CC(C)(CC[N@H+]1CCC[C@]1(C)Cc1ccccc1Cl)C(=O)[O-] ZINC000902536805 1046017018 /nfs/dbraw/zinc/01/70/18/1046017018.db2.gz PKCXMTITCTUSBX-GOSISDBHSA-N 0 1 323.864 4.238 20 0 DIADMN O=C([O-])c1cccc2c(C[N@H+]3CCCC[C@H]3C3CCC3)ccnc12 ZINC000902534848 1046017295 /nfs/dbraw/zinc/01/72/95/1046017295.db2.gz UPBTZOFEKHDEGQ-SFHVURJKSA-N 0 1 324.424 4.088 20 0 DIADMN Cc1oc(C(=O)[O-])cc1C[N@H+]1[C@H](C)C[C@H](c2ccccc2)[C@@H]1C ZINC000902543249 1046017495 /nfs/dbraw/zinc/01/74/95/1046017495.db2.gz RBRGKJCUUIFRQP-IGCXYCKISA-N 0 1 313.397 4.053 20 0 DIADMN C[C@@H](C1CCCCC1)[N@@H+](C)Cc1ccc(C(=O)[O-])c(Cl)c1 ZINC000902545621 1046017684 /nfs/dbraw/zinc/01/76/84/1046017684.db2.gz JECJMTUPKTYZOW-LBPRGKRZSA-N 0 1 309.837 4.439 20 0 DIADMN 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/nfs/dbraw/zinc/24/86/26/1046248626.db2.gz CJXAMYMTFZNSSH-QGHHPUGFSA-N 0 1 306.331 4.301 20 0 DIADMN C[C@@H](N[C@@H](c1ccccn1)C1CC1)c1ccc(C(F)F)nc1 ZINC000903336465 1046248781 /nfs/dbraw/zinc/24/87/81/1046248781.db2.gz YWNQXJGZROSEDM-BDJLRTHQSA-N 0 1 303.356 4.216 20 0 DIADMN C[C@@H](N[C@@H](c1ccccn1)C1CC1)c1ccc2ccccc2n1 ZINC000903336962 1046248977 /nfs/dbraw/zinc/24/89/77/1046248977.db2.gz AEZBFMGIJXVWTF-JLTOFOAXSA-N 0 1 303.409 4.432 20 0 DIADMN C[C@@H](N[C@@H](c1ccccn1)C1CC1)c1nccc2ccccc21 ZINC000903336257 1046249297 /nfs/dbraw/zinc/24/92/97/1046249297.db2.gz XAUMYIAOCXLWKT-JLTOFOAXSA-N 0 1 303.409 4.432 20 0 DIADMN C[C@@H](N[C@H](c1ccccn1)C1CC1)c1cccc(OC(F)F)c1 ZINC000903339095 1046251017 /nfs/dbraw/zinc/25/10/17/1046251017.db2.gz KOPLVVDLTQGIEU-PXAZEXFGSA-N 0 1 318.367 4.485 20 0 DIADMN C[C@H](N[C@@H](c1ccccn1)C1CC1)c1cccc(OC(F)F)c1 ZINC000903339098 1046251926 /nfs/dbraw/zinc/25/19/26/1046251926.db2.gz KOPLVVDLTQGIEU-YVEFUNNKSA-N 0 1 318.367 4.485 20 0 DIADMN CCc1nc2c(s1)[C@H](N[C@H](c1ccccn1)C1CC1)CCC2 ZINC000903341224 1046252285 /nfs/dbraw/zinc/25/22/85/1046252285.db2.gz WLEALIIEBXYCCE-WBVHZDCISA-N 0 1 313.470 4.219 20 0 DIADMN CO[C@H]1CC=C(Nc2ncccc2OCc2ccccc2)CC1 ZINC001212871824 1046252492 /nfs/dbraw/zinc/25/24/92/1046252492.db2.gz CPCUOSMVXGERKR-KRWDZBQOSA-N 0 1 310.397 4.155 20 0 DIADMN C[C@@H](N[C@H](c1ccccn1)C1CC1)c1ccccc1OC(F)F ZINC000903341488 1046252728 /nfs/dbraw/zinc/25/27/28/1046252728.db2.gz YTZIBHDHUHTKSQ-PXAZEXFGSA-N 0 1 318.367 4.485 20 0 DIADMN COc1ccc(CN2CC[C@@H](C)C[C@@H]2C)cc1Br ZINC000225754437 1046252799 /nfs/dbraw/zinc/25/27/99/1046252799.db2.gz ARAIYWXADJTEIH-NEPJUHHUSA-N 0 1 312.251 4.078 20 0 DIADMN CCCn1ncc(CN(C)Cc2ccc3ccccc3c2)c1C ZINC001138642220 1046254917 /nfs/dbraw/zinc/25/49/17/1046254917.db2.gz PIHUISOZBRFPOD-UHFFFAOYSA-N 0 1 307.441 4.387 20 0 DIADMN Cc1ccc(C[C@@H](NCc2cn(C)cn2)c2ccc(C)cc2)cc1 ZINC000903351288 1046254878 /nfs/dbraw/zinc/25/48/78/1046254878.db2.gz JRIRIUUQWNXWBV-OAQYLSRUSA-N 0 1 319.452 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C[C@H]1CC[C@@H](C(=O)[O-])C[N@H+]1Cc1cc(Cl)cc2ccccc21 ZINC000903407317 1046268056 /nfs/dbraw/zinc/26/80/56/1046268056.db2.gz GDUADZOQTOYCAX-GXTWGEPZSA-N 0 1 317.816 4.178 20 0 DIADMN F[C@H]1CCN(Cc2c(Cl)[nH]c3ccccc32)CCC1(F)F ZINC001138684634 1046268034 /nfs/dbraw/zinc/26/80/34/1046268034.db2.gz LZQNMNMZNJMAJH-ZDUSSCGKSA-N 0 1 316.754 4.391 20 0 DIADMN CCc1ccc2ccccc2c1C[N@H+]1CCCC[C@H]1CC(=O)[O-] ZINC000903409617 1046269947 /nfs/dbraw/zinc/26/99/47/1046269947.db2.gz WLRBOIPAICXDNK-KRWDZBQOSA-N 0 1 311.425 4.231 20 0 DIADMN CCc1ccc2ccccc2c1C[N@H+]1CCC[C@H](C)[C@H]1C(=O)[O-] ZINC000903409376 1046270191 /nfs/dbraw/zinc/27/01/91/1046270191.db2.gz YDSVOFAXPBISAJ-LIRRHRJNSA-N 0 1 311.425 4.087 20 0 DIADMN Cc1cc(-c2nc3ccc(Br)cc3[nH]2)cnc1Cl ZINC000758457202 1046271838 /nfs/dbraw/zinc/27/18/38/1046271838.db2.gz BOZCFMGSEKJKMF-UHFFFAOYSA-N 0 1 322.593 4.349 20 0 DIADMN CC(C)N(C)CC(=O)Nc1c2ccccc2[nH]c1-c1ccccc1 ZINC000888120772 1046273770 /nfs/dbraw/zinc/27/37/70/1046273770.db2.gz YESHFQYATBOBHU-UHFFFAOYSA-N 0 1 321.424 4.114 20 0 DIADMN CCCCN(Cc1ccccc1)Cc1cnc(SC)nc1 ZINC001138705365 1046274589 /nfs/dbraw/zinc/27/45/89/1046274589.db2.gz NHAKQWDRWWHOOF-UHFFFAOYSA-N 0 1 301.459 4.001 20 0 DIADMN Cc1nc2ccccn2c1CN[C@H](C)c1csc(Cl)c1 ZINC000903422694 1046275817 /nfs/dbraw/zinc/27/58/17/1046275817.db2.gz PQEWGMUHQDWSAT-SNVBAGLBSA-N 0 1 305.834 4.208 20 0 DIADMN Fc1ccccc1[C@@H]1CCCN1Cc1ccc2c(c1)CCCO2 ZINC001138716802 1046276847 /nfs/dbraw/zinc/27/68/47/1046276847.db2.gz YNWLPEXDPZGGQZ-IBGZPJMESA-N 0 1 311.400 4.488 20 0 DIADMN Cc1cccc(Cl)c1CN1CC[C@](CF)(C(F)(F)F)C1 ZINC001138717994 1046277312 /nfs/dbraw/zinc/27/73/12/1046277312.db2.gz IQAHSWNFKBQKHJ-CYBMUJFWSA-N 0 1 309.734 4.372 20 0 DIADMN Fc1ccc(F)c2c1CC[C@@H]2N[C@@H](c1ccncc1)C1CC1 ZINC000903430081 1046279813 /nfs/dbraw/zinc/27/98/13/1046279813.db2.gz XTHPLOWMYQXLPA-FUHWJXTLSA-N 0 1 300.352 4.088 20 0 DIADMN CCc1cccc2cc(C[N@H+]3CCC4(CC4)C3)c(Cl)nc21 ZINC001138727098 1046280077 /nfs/dbraw/zinc/28/00/77/1046280077.db2.gz YBOSCIANEKIDGP-UHFFFAOYSA-N 0 1 300.833 4.437 20 0 DIADMN CCc1cccc2cc(CN3CCC4(CC4)C3)c(Cl)nc21 ZINC001138727098 1046280084 /nfs/dbraw/zinc/28/00/84/1046280084.db2.gz YBOSCIANEKIDGP-UHFFFAOYSA-N 0 1 300.833 4.437 20 0 DIADMN CC(C)(C)c1n[nH]c(SCc2cc(Cl)nc(Cl)c2)n1 ZINC000138209715 1046280380 /nfs/dbraw/zinc/28/03/80/1046280380.db2.gz MCGHNBKSLYVXEN-UHFFFAOYSA-N 0 1 317.245 4.096 20 0 DIADMN CC(C)(C)c1nc(SCc2cc(Cl)nc(Cl)c2)n[nH]1 ZINC000138209715 1046280396 /nfs/dbraw/zinc/28/03/96/1046280396.db2.gz MCGHNBKSLYVXEN-UHFFFAOYSA-N 0 1 317.245 4.096 20 0 DIADMN COCCc1ncc(CN(C)[C@@H](C)c2ccc(C)cc2C)s1 ZINC000637902972 1046283236 /nfs/dbraw/zinc/28/32/36/1046283236.db2.gz NHZIOUSDPNQBMI-HNNXBMFYSA-N 0 1 318.486 4.142 20 0 DIADMN C[C@H](Cc1ccc(Cl)cc1)[N@H+]1CCc2nc(Cl)ccc2C1 ZINC001168179885 1046284938 /nfs/dbraw/zinc/28/49/38/1046284938.db2.gz NSLIDBQFTNIEDL-GFCCVEGCSA-N 0 1 321.251 4.378 20 0 DIADMN C[C@H](Cc1ccc(Cl)cc1)N1CCc2nc(Cl)ccc2C1 ZINC001168179885 1046284952 /nfs/dbraw/zinc/28/49/52/1046284952.db2.gz NSLIDBQFTNIEDL-GFCCVEGCSA-N 0 1 321.251 4.378 20 0 DIADMN Fc1cccc([C@@H]2CCCN2Cc2ccc(C(F)F)nc2)c1 ZINC000637910361 1046287068 /nfs/dbraw/zinc/28/70/68/1046287068.db2.gz ZZPOVWFRSDVJCN-INIZCTEOSA-N 0 1 306.331 4.495 20 0 DIADMN COc1cc(Cl)cc(CN2CCC[C@](C)(F)CC2)c1OC ZINC001138741990 1046287140 /nfs/dbraw/zinc/28/71/40/1046287140.db2.gz FMWUGJQTONGECL-INIZCTEOSA-N 0 1 315.816 4.071 20 0 DIADMN C[C@@H](c1cccs1)N(C)Cc1ccccc1OCCCCO ZINC000637919995 1046287925 /nfs/dbraw/zinc/28/79/25/1046287925.db2.gz PNQDITMEBRRQDA-HNNXBMFYSA-N 0 1 319.470 4.092 20 0 DIADMN Cc1[nH]ncc1C1CCN(C(=O)C(C)(C)C2CCCCC2)CC1 ZINC000803639616 1046287876 /nfs/dbraw/zinc/28/78/76/1046287876.db2.gz HTCJVMJSKZIYSE-UHFFFAOYSA-N 0 1 317.477 4.031 20 0 DIADMN C[C@@H]1CN(Cc2cnn(Cc3ccccc3)c2)Cc2ccccc21 ZINC001138763150 1046288824 /nfs/dbraw/zinc/28/88/24/1046288824.db2.gz APTAIBSATXGOSW-QGZVFWFLSA-N 0 1 317.436 4.051 20 0 DIADMN C[C@@H](c1ccco1)N([C@H](c1nnc[nH]1)C1CCCCC1)C1CC1 ZINC000637971187 1046289183 /nfs/dbraw/zinc/28/91/83/1046289183.db2.gz KOZSFOZMYFPRGR-GUYCJALGSA-N 0 1 314.433 4.245 20 0 DIADMN O=C([O-])[C@@H]1CC[C@@H](c2ccccc2)[N@H+]1CC[C@H]1CCCC1(F)F ZINC000903609094 1046289750 /nfs/dbraw/zinc/28/97/50/1046289750.db2.gz SXFUJCBAEZRLLE-PMPSAXMXSA-N 0 1 323.383 4.102 20 0 DIADMN COc1c(C)cc(CN(C)Cc2ccc(C(F)F)nc2)cc1C ZINC000637995400 1046289751 /nfs/dbraw/zinc/28/97/51/1046289751.db2.gz CKJKDKNGMOFTEA-UHFFFAOYSA-N 0 1 320.383 4.277 20 0 DIADMN Cc1ccc([C@H]2CC[N@@H+](Cc3cc(C(=O)[O-])co3)C2(C)C)cc1 ZINC000903612190 1046289828 /nfs/dbraw/zinc/28/98/28/1046289828.db2.gz WLPRMWUNERESEY-QGZVFWFLSA-N 0 1 313.397 4.054 20 0 DIADMN CCc1ccc2ccccc2c1C[N@H+]1CC[C@H](C)C[C@H]1C(=O)[O-] ZINC000903603917 1046290715 /nfs/dbraw/zinc/29/07/15/1046290715.db2.gz PJHNVNCQEHLWKB-LIRRHRJNSA-N 0 1 311.425 4.087 20 0 DIADMN CC1(C)[C@@H](c2ccccc2Cl)CC[N@H+]1CCCCC(=O)[O-] ZINC000903611055 1046291187 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CC1(C)[C@H](c2ccc(Cl)cc2)CC[N@H+]1CC1(CC(=O)[O-])CC1 ZINC000903632206 1046292869 /nfs/dbraw/zinc/29/28/69/1046292869.db2.gz VRINXVHLVCAOIV-HNNXBMFYSA-N 0 1 321.848 4.163 20 0 DIADMN C[C@@H](c1ccccc1)[C@@H]1CCC[N@H+]1Cc1ccsc1C(=O)[O-] ZINC000903630572 1046293263 /nfs/dbraw/zinc/29/32/63/1046293263.db2.gz FFIOFILJTSWPQM-BBRMVZONSA-N 0 1 315.438 4.214 20 0 DIADMN CC(C)C[N@@H+](CC[C@@H]1CCc2ccccc21)CC(C)(C)C(=O)[O-] ZINC000903622354 1046294291 /nfs/dbraw/zinc/29/42/91/1046294291.db2.gz IDNQAXHTEFQIKK-KRWDZBQOSA-N 0 1 317.473 4.175 20 0 DIADMN CC1(C)[C@@H](c2ccc(Cl)cc2)CC[N@H+]1CC1(CC(=O)[O-])CC1 ZINC000903632207 1046294959 /nfs/dbraw/zinc/29/49/59/1046294959.db2.gz VRINXVHLVCAOIV-OAHLLOKOSA-N 0 1 321.848 4.163 20 0 DIADMN C[C@H]1CN(Cc2cccc3ncccc23)C[C@H](c2ccsc2)O1 ZINC000638133579 1046296003 /nfs/dbraw/zinc/29/60/03/1046296003.db2.gz RMSHQXUNLLSXLQ-IFXJQAMLSA-N 0 1 324.449 4.258 20 0 DIADMN c1cc2cccc(CN(Cc3ccccn3)C3CCCCC3)n2n1 ZINC001138808142 1046299091 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CC(C)(N[C@@H](c1nnc[nH]1)C1CCCCC1)c1ccccc1F ZINC000639225683 1046371418 /nfs/dbraw/zinc/37/14/18/1046371418.db2.gz ZXZONXJZRXZREQ-MRXNPFEDSA-N 0 1 316.424 4.090 20 0 DIADMN O=C(/C=C/c1ccc(Cl)s1)Nc1cccc(Cl)c1O ZINC000759708109 1046374738 /nfs/dbraw/zinc/37/47/38/1046374738.db2.gz GHIFFLGUBMMHLM-FNORWQNLSA-N 0 1 314.193 4.412 20 0 DIADMN O=C(/C=C\c1ccc(Cl)s1)Nc1cccc(Cl)c1O ZINC000759708108 1046374924 /nfs/dbraw/zinc/37/49/24/1046374924.db2.gz GHIFFLGUBMMHLM-ALCCZGGFSA-N 0 1 314.193 4.412 20 0 DIADMN CC(C)N([C@@H](c1nccn1C)C1CC1)[C@@H](C)c1ccsc1 ZINC000639277152 1046376438 /nfs/dbraw/zinc/37/64/38/1046376438.db2.gz SPCOCYOHQGAGAF-XJKSGUPXSA-N 0 1 303.475 4.404 20 0 DIADMN CC1(C)CN[C@H]1c1nc(-c2ccc(-c3ccccc3)cc2)no1 ZINC000666572120 1046376830 /nfs/dbraw/zinc/37/68/30/1046376830.db2.gz MITBXLRGSCPUHS-INIZCTEOSA-N 0 1 305.381 4.074 20 0 DIADMN CC(C)N([C@@H](C)c1ccsc1)[C@H](c1nccn1C)C1CC1 ZINC000639277147 1046377752 /nfs/dbraw/zinc/37/77/52/1046377752.db2.gz SPCOCYOHQGAGAF-BBRMVZONSA-N 0 1 303.475 4.404 20 0 DIADMN Cc1scc(CN2CC3(CCOCC3)[C@@H]2c2ccco2)c1C ZINC000639324120 1046379488 /nfs/dbraw/zinc/37/94/88/1046379488.db2.gz JVLDUHNYTQWVIM-KRWDZBQOSA-N 0 1 317.454 4.312 20 0 DIADMN COc1ccc(-c2ccccc2)cc1CN1[C@@H]2CC[C@H]1CC(=O)C2 ZINC001139068601 1046380661 /nfs/dbraw/zinc/38/06/61/1046380661.db2.gz WLOYBPMJNOQUSU-KDURUIRLSA-N 0 1 321.420 4.058 20 0 DIADMN CC[C@](C)(NCc1cnc2ccccc2n1)c1ccc(F)cc1 ZINC000639360556 1046381494 /nfs/dbraw/zinc/38/14/94/1046381494.db2.gz XSXQTOOSLHBQTL-IBGZPJMESA-N 0 1 309.388 4.184 20 0 DIADMN Fc1ccc2ccc(CN3CCCC(F)(F)CC3)nc2c1F ZINC000639349235 1046383556 /nfs/dbraw/zinc/38/35/56/1046383556.db2.gz NBHVVGKJSJXUAY-UHFFFAOYSA-N 0 1 312.310 4.134 20 0 DIADMN Cc1n[nH]c(C)c1CN1CC[C@H](c2cccc(Cl)c2Cl)C1 ZINC001139101265 1046386373 /nfs/dbraw/zinc/38/63/73/1046386373.db2.gz PKADOGAUSGRKIC-LBPRGKRZSA-N 0 1 324.255 4.323 20 0 DIADMN CCN(Cc1c(C)n[nH]c1C)Cc1cccc(C(F)(F)F)c1 ZINC001139102143 1046386438 /nfs/dbraw/zinc/38/64/38/1046386438.db2.gz JNWKZOOUEOHXAU-UHFFFAOYSA-N 0 1 311.351 4.067 20 0 DIADMN Cc1n[nH]c(C)c1CN1CCC(c2ccccc2Cl)CC1 ZINC001139100015 1046387568 /nfs/dbraw/zinc/38/75/68/1046387568.db2.gz CFOZJDODTRBHPR-UHFFFAOYSA-N 0 1 303.837 4.060 20 0 DIADMN CC[C@H](N[C@@H](C)c1cc(C(=O)OC)c(C)o1)c1ccccc1 ZINC000292389521 1046388000 /nfs/dbraw/zinc/38/80/00/1046388000.db2.gz ICZJQOUQMBAYKC-LRDDRELGSA-N 0 1 301.386 4.177 20 0 DIADMN CCC(CC)N(C)Cc1ccc(Br)nc1Cl ZINC001139114411 1046388779 /nfs/dbraw/zinc/38/87/79/1046388779.db2.gz NMXWQGGBJCPUNP-UHFFFAOYSA-N 0 1 305.647 4.118 20 0 DIADMN CCn1ccc2ccc(CN3CCc4c(cccc4OC)C3)cc21 ZINC001139120588 1046389307 /nfs/dbraw/zinc/38/93/07/1046389307.db2.gz WPRFWMHWLYWGGV-UHFFFAOYSA-N 0 1 320.436 4.228 20 0 DIADMN CC(C)c1nnc(CN[C@H]2CC[C@@H](c3ccc(F)cc3)C2)s1 ZINC000780535465 1046392296 /nfs/dbraw/zinc/39/22/96/1046392296.db2.gz FORUCCNSXYFXSZ-HIFRSBDPSA-N 0 1 319.449 4.227 20 0 DIADMN CCn1ccc2ccc(CN(C)Cc3ccc(Cl)nc3)cc21 ZINC001139125015 1046393229 /nfs/dbraw/zinc/39/32/29/1046393229.db2.gz ZPKWZYJIBDMQND-UHFFFAOYSA-N 0 1 313.832 4.342 20 0 DIADMN COc1cc(O)ccc1CN1CCC[C@@H]1c1ccccc1Cl ZINC001139141483 1046393774 /nfs/dbraw/zinc/39/37/74/1046393774.db2.gz AHEALEFYPILWJQ-QGZVFWFLSA-N 0 1 317.816 4.391 20 0 DIADMN CCn1ccc2c1cccc2CN1CCO[C@@H](c2ccccc2)C1 ZINC001139153293 1046394342 /nfs/dbraw/zinc/39/43/42/1046394342.db2.gz IODYPDIGKPLPOT-OAQYLSRUSA-N 0 1 320.436 4.235 20 0 DIADMN CCN(Cc1csc(-c2ccc(OC)c(OC)c2)n1)C(C)C ZINC000104680812 1046395604 /nfs/dbraw/zinc/39/56/04/1046395604.db2.gz YIPGGJKEAAXMAD-UHFFFAOYSA-N 0 1 320.458 4.058 20 0 DIADMN CCn1ccc2c1cccc2CN1Cc2ccc(OC)cc2C1 ZINC001139158206 1046397828 /nfs/dbraw/zinc/39/78/28/1046397828.db2.gz GUSHXAQBOAIGIT-UHFFFAOYSA-N 0 1 306.409 4.186 20 0 DIADMN Cc1nc(-c2ccccc2)oc1CN1CCC[C@@H](C(F)(F)F)C1 ZINC000639435692 1046399528 /nfs/dbraw/zinc/39/95/28/1046399528.db2.gz LWSILRRTDJESGV-CQSZACIVSA-N 0 1 324.346 4.424 20 0 DIADMN CCCCCC[C@@H](C)CC(=O)Nc1cc(CN(C)C)ccn1 ZINC000748744686 1046401625 /nfs/dbraw/zinc/40/16/25/1046401625.db2.gz RNRMTDLNQRCZIJ-OAHLLOKOSA-N 0 1 305.466 4.078 20 0 DIADMN O=c1cc(C[N@@H+]2CCC[C@@H]2c2ccc(Cl)c(Cl)c2)cc[nH]1 ZINC000639455533 1046403451 /nfs/dbraw/zinc/40/34/51/1046403451.db2.gz QVXYIVYVUMERSZ-OAHLLOKOSA-N 0 1 323.223 4.431 20 0 DIADMN O=c1cc(CN2CCC[C@@H]2c2ccc(Cl)c(Cl)c2)cc[nH]1 ZINC000639455533 1046403454 /nfs/dbraw/zinc/40/34/54/1046403454.db2.gz QVXYIVYVUMERSZ-OAHLLOKOSA-N 0 1 323.223 4.431 20 0 DIADMN C(=C\c1ccccc1)\CCN1CCO[C@]2(CCc3ccccc32)C1 ZINC001168202364 1046404523 /nfs/dbraw/zinc/40/45/23/1046404523.db2.gz SZKYCMVPJQACPV-RWKBYAJOSA-N 0 1 319.448 4.264 20 0 DIADMN O=c1cc(CN(Cc2c(F)cccc2F)C2CCCC2)cc[nH]1 ZINC000639474564 1046404550 /nfs/dbraw/zinc/40/45/50/1046404550.db2.gz FKSJETJSVUTNQJ-UHFFFAOYSA-N 0 1 318.367 4.010 20 0 DIADMN Cc1ccc([C@@H](O)CN2CC[C@H]2c2ccc(Cl)cc2)cc1 ZINC000748824011 1046406381 /nfs/dbraw/zinc/40/63/81/1046406381.db2.gz DMVGURJWJPTEAM-ROUUACIJSA-N 0 1 301.817 4.129 20 0 DIADMN Cc1cccc2[nH]cc(CN3CCO[C@@H](c4ccccc4)C3)c21 ZINC001139197770 1046409499 /nfs/dbraw/zinc/40/94/99/1046409499.db2.gz ZHBPWHXIXCLMNQ-LJQANCHMSA-N 0 1 306.409 4.050 20 0 DIADMN CC(C)N(CC(=O)c1ccccc1)Cc1ccc2ccn(C)c2c1 ZINC001139207100 1046412469 /nfs/dbraw/zinc/41/24/69/1046412469.db2.gz SMOWZKOVIXIACG-UHFFFAOYSA-N 0 1 320.436 4.272 20 0 DIADMN Fc1ccc([C@@H]2CCCN2Cc2ccc3nsnc3c2)cc1 ZINC001139210725 1046412678 /nfs/dbraw/zinc/41/26/78/1046412678.db2.gz SCEHUCKDOBBRAM-KRWDZBQOSA-N 0 1 313.401 4.168 20 0 DIADMN C[C@@H](c1cccc(Br)c1)N(C)Cc1cccnc1 ZINC000171146411 1046414694 /nfs/dbraw/zinc/41/46/94/1046414694.db2.gz LAAAUCYAALDWOM-LBPRGKRZSA-N 0 1 305.219 4.037 20 0 DIADMN CCCCC[C@@H](CC)C(=O)Nc1ccc2nc(N(C)C)[nH]c2c1 ZINC001139218552 1046414925 /nfs/dbraw/zinc/41/49/25/1046414925.db2.gz VMJKWKAXHIXCQF-CYBMUJFWSA-N 0 1 316.449 4.174 20 0 DIADMN CC[C@@H](NC[C@@H]1CC(C)(C)CO1)c1nc(C(F)(F)F)cs1 ZINC000639579498 1046415282 /nfs/dbraw/zinc/41/52/82/1046415282.db2.gz HWHYBTZFOZLYMJ-VHSXEESVSA-N 0 1 322.396 4.018 20 0 DIADMN CC/C(C)=C(/C)C(=O)Nc1cccc2c1CN(CC(C)C)C2 ZINC000780987012 1046416433 /nfs/dbraw/zinc/41/64/33/1046416433.db2.gz SRRNKHUHHADJNF-PFONDFGASA-N 0 1 300.446 4.343 20 0 DIADMN COC[C@@H](NCc1c(C)cc(C)nc1C)c1ccc(Cl)cc1 ZINC000639616638 1046416458 /nfs/dbraw/zinc/41/64/58/1046416458.db2.gz JXNPZIVTQBBMAM-GOSISDBHSA-N 0 1 318.848 4.138 20 0 DIADMN FC[C@@H]1CCC[N@@H+](Cc2ccc(Oc3ccccc3)nc2)C1 ZINC001139246989 1046419312 /nfs/dbraw/zinc/41/93/12/1046419312.db2.gz QJKFEFRDFBXOFQ-HNNXBMFYSA-N 0 1 300.377 4.055 20 0 DIADMN FC[C@@H]1CCCN(Cc2ccc(Oc3ccccc3)nc2)C1 ZINC001139246989 1046419318 /nfs/dbraw/zinc/41/93/18/1046419318.db2.gz QJKFEFRDFBXOFQ-HNNXBMFYSA-N 0 1 300.377 4.055 20 0 DIADMN COCC1CN(Cc2ccccc2Oc2ccc(Cl)cc2)C1 ZINC001139262641 1046420618 /nfs/dbraw/zinc/42/06/18/1046420618.db2.gz URHMNDRMVSCBOS-UHFFFAOYSA-N 0 1 317.816 4.211 20 0 DIADMN C[C@@H]1CCCC[N@@H+](Cc2[nH]c(-c3ccccc3)nc2Cl)C1 ZINC001139277273 1046421780 /nfs/dbraw/zinc/42/17/80/1046421780.db2.gz QUUHPOQISYCSOL-CYBMUJFWSA-N 0 1 303.837 4.352 20 0 DIADMN C[C@@H]1CCCCN(Cc2[nH]c(-c3ccccc3)nc2Cl)C1 ZINC001139277273 1046421795 /nfs/dbraw/zinc/42/17/95/1046421795.db2.gz QUUHPOQISYCSOL-CYBMUJFWSA-N 0 1 303.837 4.352 20 0 DIADMN C[C@@H]1CCN(Cc2[nH]c(-c3ccccc3)nc2Cl)[C@H](C)C1 ZINC001139281991 1046423508 /nfs/dbraw/zinc/42/35/08/1046423508.db2.gz SMZDOMJIGVQMHY-CHWSQXEVSA-N 0 1 303.837 4.351 20 0 DIADMN Cc1csc(CN2CCC3(CC2)c2ccccc2N=C3C)n1 ZINC000639715913 1046424378 /nfs/dbraw/zinc/42/43/78/1046424378.db2.gz UICODEJDCLYFFP-UHFFFAOYSA-N 0 1 311.454 4.091 20 0 DIADMN COc1ccc(-c2ccc(CN3C[C@@H](C)OC[C@@H]3C)s2)cc1 ZINC001139289280 1046425525 /nfs/dbraw/zinc/42/55/25/1046425525.db2.gz IRSGUJVAMSBTLA-UONOGXRCSA-N 0 1 317.454 4.033 20 0 DIADMN COc1ccc(-c2ccc(CN3CCC[C@@H](F)C3)s2)cc1 ZINC001139285949 1046425588 /nfs/dbraw/zinc/42/55/88/1046425588.db2.gz CDSUDDPACJVLDM-CQSZACIVSA-N 0 1 305.418 4.358 20 0 DIADMN COc1ccc(-c2ccc(CN3CCOCC3(C)C)s2)cc1 ZINC001139288545 1046425742 /nfs/dbraw/zinc/42/57/42/1046425742.db2.gz ZODBZPKJNASZMO-UHFFFAOYSA-N 0 1 317.454 4.035 20 0 DIADMN Brc1cscc1CN1CCC[C@H]2CCC[C@@H]21 ZINC001139349606 1046425952 /nfs/dbraw/zinc/42/59/52/1046425952.db2.gz AIJMKBRMDBBAJM-MFKMUULPSA-N 0 1 300.265 4.275 20 0 DIADMN C[C@@H]1CCN(Cc2sccc2Br)CCC1(F)F ZINC001139309113 1046427420 /nfs/dbraw/zinc/42/74/20/1046427420.db2.gz HVVFRPOCEJAYGU-SECBINFHSA-N 0 1 324.234 4.378 20 0 DIADMN COc1ccc2cc(CN3CCC[C@@H](F)CC3)c(Cl)nc2c1 ZINC001139310394 1046429687 /nfs/dbraw/zinc/42/96/87/1046429687.db2.gz GINBLOHZQBZYSY-CQSZACIVSA-N 0 1 322.811 4.221 20 0 DIADMN COc1cccc2c1CN(Cc1ccc3cc(O)ccc3c1)CC2 ZINC001139336833 1046430908 /nfs/dbraw/zinc/43/09/08/1046430908.db2.gz BQPAWWPIYDCFLX-UHFFFAOYSA-N 0 1 319.404 4.112 20 0 DIADMN Oc1ccc2cc(CN3CCc4ccc(F)cc4C3)ccc2c1 ZINC001139338868 1046431325 /nfs/dbraw/zinc/43/13/25/1046431325.db2.gz KKSFRHSRZKQHQY-UHFFFAOYSA-N 0 1 307.368 4.243 20 0 DIADMN CCC[N@@H+](Cc1ccccc1)Cc1ccc(N2CCCCC2)nc1 ZINC001139343837 1046432544 /nfs/dbraw/zinc/43/25/44/1046432544.db2.gz FNSQLHGNURGTCA-UHFFFAOYSA-N 0 1 323.484 4.484 20 0 DIADMN c1ccc(CN(Cc2ccc(N3CCCCC3)nc2)C2CC2)cc1 ZINC001139345489 1046434554 /nfs/dbraw/zinc/43/45/54/1046434554.db2.gz NYBPNMCQWVMVTN-UHFFFAOYSA-N 0 1 321.468 4.237 20 0 DIADMN CCc1ccc(CN(C)Cc2ccc(N3CCCCC3)nc2)cc1 ZINC001139345459 1046435125 /nfs/dbraw/zinc/43/51/25/1046435125.db2.gz LZVGOCWYIAGSLR-UHFFFAOYSA-N 0 1 323.484 4.266 20 0 DIADMN C[C@@H]1c2ccc(F)cc2C[C@H](C)N1Cc1ccc2c[nH]nc2c1 ZINC001168232569 1046435604 /nfs/dbraw/zinc/43/56/04/1046435604.db2.gz CBVMKMDHFKUANQ-QWHCGFSZSA-N 0 1 309.388 4.210 20 0 DIADMN Clc1ccc([C@@H]2OCC[C@H]2NCc2ncccc2Cl)cc1 ZINC000639907895 1046436158 /nfs/dbraw/zinc/43/61/58/1046436158.db2.gz VNGKEWFNGKUPED-ZBFHGGJFSA-N 0 1 323.223 4.008 20 0 DIADMN CC(C)(C)OCc1ccc(NC(=O)c2ccc(F)cc2O)cc1 ZINC000676763230 1046436355 /nfs/dbraw/zinc/43/63/55/1046436355.db2.gz JMCPJCGLQGCOSK-UHFFFAOYSA-N 0 1 317.360 4.099 20 0 DIADMN CN(Cc1ccc(C(C)(C)C)cc1)C(=O)c1cccc2c[nH]nc21 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CC[C@H](C)CN(C)c1ccc(F)cc1CNCc1ccoc1C ZINC001648986980 1046443645 /nfs/dbraw/zinc/44/36/45/1046443645.db2.gz ZBOOOWHXZMPNFH-AWEZNQCLSA-N 0 1 318.436 4.499 20 0 DIADMN CCOc1ccc(C2=CCN(Cc3cc(C)ns3)CC2)cc1 ZINC001168243087 1046444526 /nfs/dbraw/zinc/44/45/26/1046444526.db2.gz BFTJOSATWZIYAY-UHFFFAOYSA-N 0 1 314.454 4.140 20 0 DIADMN C[C@H]1CC[C@H](NCc2nn(C)c3ccccc23)c2ccccc21 ZINC000676907354 1046446141 /nfs/dbraw/zinc/44/61/41/1046446141.db2.gz FIFZUBRCCDDBES-KSSFIOAISA-N 0 1 305.425 4.302 20 0 DIADMN CCc1nnc(CN[C@H]2CCC(C)(C)C[C@@H]2c2ccccc2)o1 ZINC000640107445 1046448294 /nfs/dbraw/zinc/44/82/94/1046448294.db2.gz QBTRMRYTKOIHCU-CVEARBPZSA-N 0 1 313.445 4.084 20 0 DIADMN CCC[C@@H](C)CC(=O)N1CCC[C@@H]1c1nc2ccc(C)cc2[nH]1 ZINC000123679134 1046449314 /nfs/dbraw/zinc/44/93/14/1046449314.db2.gz XNKDECAGKPUPRD-CXAGYDPISA-N 0 1 313.445 4.361 20 0 DIADMN CCC[C@H](C)CC(=O)N1CCC[C@@H]1c1nc2ccc(C)cc2[nH]1 ZINC000123679358 1046449601 /nfs/dbraw/zinc/44/96/01/1046449601.db2.gz 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CCCC[C@@H](CC)CC(=O)Nc1c(=O)[nH][nH]c1-c1ccccc1 ZINC000646463401 1046905415 /nfs/dbraw/zinc/90/54/15/1046905415.db2.gz QJMJLQWATCSEMH-CYBMUJFWSA-N 0 1 315.417 4.327 20 0 DIADMN Cc1ccc(CN2CC[C@H](Oc3ccncc3C)C2)c(Cl)c1 ZINC001140800157 1046905577 /nfs/dbraw/zinc/90/55/77/1046905577.db2.gz XGCGCLDCFTYJCB-INIZCTEOSA-N 0 1 316.832 4.005 20 0 DIADMN O=C(CCCC1CCCC1)Nc1c(=O)[nH][nH]c1-c1ccccc1 ZINC000646463574 1046906368 /nfs/dbraw/zinc/90/63/68/1046906368.db2.gz SEGKMUUFQZJKOT-UHFFFAOYSA-N 0 1 313.401 4.081 20 0 DIADMN C[C@@H]1Cc2cn[nH]c2[C@@H](C(=O)Nc2ccc(C(C)(C)C)cc2)C1 ZINC000646571175 1046913064 /nfs/dbraw/zinc/91/30/64/1046913064.db2.gz MCYWBMPMEJJCHO-WBMJQRKESA-N 0 1 311.429 4.012 20 0 DIADMN COc1ccc([C@@H](C)NCc2ccc(C)c(OC)c2)c(F)c1 ZINC000161774054 1046913761 /nfs/dbraw/zinc/91/37/61/1046913761.db2.gz BYNDUOYLAWBQLQ-CYBMUJFWSA-N 0 1 303.377 4.002 20 0 DIADMN C[N@H+](Cc1cc(Cl)c([O-])c(Cl)c1)CC1CC(F)(F)C1 ZINC001140833759 1046922768 /nfs/dbraw/zinc/92/27/68/1046922768.db2.gz 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O=C([O-])[C@@H]1CCCCC[N@H+]1Cc1ccc(-c2ccccc2)cc1 ZINC000321940001 1046925194 /nfs/dbraw/zinc/92/51/94/1046925194.db2.gz ZXJXKEQCRCLZOG-IBGZPJMESA-N 0 1 309.409 4.183 20 0 DIADMN C[C@@H](CO)CN[C@H](c1ccccc1)c1cc(Cl)ccc1Cl ZINC000680023687 1046931940 /nfs/dbraw/zinc/93/19/40/1046931940.db2.gz LYLBSECPBMIETK-SJKOYZFVSA-N 0 1 324.251 4.301 20 0 DIADMN CCOCCCN1CCC[C@H]1c1ccc(Br)s1 ZINC000680117436 1046949783 /nfs/dbraw/zinc/94/97/83/1046949783.db2.gz PWGGTMVVCIXKIE-NSHDSACASA-N 0 1 318.280 4.074 20 0 DIADMN C[C@@H](CO)CN[C@@H](c1ccccc1)c1cc(Cl)ccc1Cl ZINC000680023682 1046932294 /nfs/dbraw/zinc/93/22/94/1046932294.db2.gz LYLBSECPBMIETK-PXAZEXFGSA-N 0 1 324.251 4.301 20 0 DIADMN Cc1ccc2oc(CNCc3ccc(C(F)F)nc3)cc2c1 ZINC001203144671 1046933285 /nfs/dbraw/zinc/93/32/85/1046933285.db2.gz RRLKSJVBYKCIIC-UHFFFAOYSA-N 0 1 302.324 4.364 20 0 DIADMN Cc1cnc2c(c1)CN(Cc1cccc(-c3ccncc3)c1)CC2 ZINC001137395115 1046934310 /nfs/dbraw/zinc/93/43/10/1046934310.db2.gz NYXKXEPLYDMMQZ-UHFFFAOYSA-N 0 1 315.420 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323.770 4.313 20 0 DIADMN [O-]c1ccc(C[N@@H+]2CC[C@H](c3ccc(Cl)cc3)C2)c(F)c1F ZINC001140893205 1046943150 /nfs/dbraw/zinc/94/31/50/1046943150.db2.gz KNXWYJXPAKECMX-LBPRGKRZSA-N 0 1 323.770 4.313 20 0 DIADMN [O-]c1ccc(C[N@H+]2CC[C@H](c3ccc(Cl)cc3)C2)c(F)c1F ZINC001140893205 1046943165 /nfs/dbraw/zinc/94/31/65/1046943165.db2.gz KNXWYJXPAKECMX-LBPRGKRZSA-N 0 1 323.770 4.313 20 0 DIADMN CN(Cc1ccsc1)Cc1ccc(OC(F)(F)F)c(F)c1 ZINC001140887232 1046943962 /nfs/dbraw/zinc/94/39/62/1046943962.db2.gz VVRRVJMYDPHGAL-UHFFFAOYSA-N 0 1 319.323 4.418 20 0 DIADMN CC(C)C[C@@H](N)c1noc(-c2ccc(OC3CCCC3)cc2)n1 ZINC000647131564 1046944186 /nfs/dbraw/zinc/94/41/86/1046944186.db2.gz GSVPNZVLDMLCJH-MRXNPFEDSA-N 0 1 315.417 4.104 20 0 DIADMN C[C@H]1CC[C@@H](C(F)(F)F)CN1CCc1cccc(F)c1F ZINC000680077348 1046945796 /nfs/dbraw/zinc/94/57/96/1046945796.db2.gz HDUDVKWUBREOQN-CMPLNLGQSA-N 0 1 307.306 4.170 20 0 DIADMN COc1ccc(CN2CCC[C@@H]2c2ccc(Cl)s2)cc1N ZINC001140899474 1046945828 /nfs/dbraw/zinc/94/58/28/1046945828.db2.gz SIUFGDDUOITLPI-CYBMUJFWSA-N 0 1 322.861 4.329 20 0 DIADMN Cc1ccc(C(C)C)c(O[C@@H](C)c2nc([C@H]3CCCN3)no2)c1 ZINC000647153060 1046946160 /nfs/dbraw/zinc/94/61/60/1046946160.db2.gz SFZATWYMTUYFOY-DZGCQCFKSA-N 0 1 315.417 4.066 20 0 DIADMN Cc1ccc(C(C)C)cc1O[C@@H](C)c1nc([C@H]2CCCN2)no1 ZINC000647153203 1046946307 /nfs/dbraw/zinc/94/63/07/1046946307.db2.gz WCRIBVJLWBNVQM-DZGCQCFKSA-N 0 1 315.417 4.066 20 0 DIADMN Clc1cc(Cl)cc([C@@H]2C[C@H]2c2nc([C@H]3CCCN3)no2)c1 ZINC000647149529 1046946787 /nfs/dbraw/zinc/94/67/87/1046946787.db2.gz NRUVORNTGFRYMR-YNEHKIRRSA-N 0 1 324.211 4.072 20 0 DIADMN C[C@H](c1cccc2ccccc21)[N@H+]1CCC[C@@H](CCC(=O)[O-])C1 ZINC000321038901 1046948419 /nfs/dbraw/zinc/94/84/19/1046948419.db2.gz VVQNGORRAYERFG-CVEARBPZSA-N 0 1 311.425 4.478 20 0 DIADMN CC(C)Cn1nccc1CN[C@H](C)c1cccc(OC(C)C)c1 ZINC000647171313 1046949567 /nfs/dbraw/zinc/94/95/67/1046949567.db2.gz FMMGPYMJZIMHTA-MRXNPFEDSA-N 0 1 315.461 4.177 20 0 DIADMN FC(F)(F)c1ccncc1CN1C[C@@H]2C[C@H](C1)c1ccccc12 ZINC001140920171 1046950048 /nfs/dbraw/zinc/95/00/48/1046950048.db2.gz MKJIQERVFYMTHM-BETUJISGSA-N 0 1 318.342 4.187 20 0 DIADMN Cc1c(-c2nc(C3(N)CCCC3)no2)oc2c1c(C)ccc2C ZINC000261773209 1046950113 /nfs/dbraw/zinc/95/01/13/1046950113.db2.gz NINQMXJKNPMGIY-UHFFFAOYSA-N 0 1 311.385 4.136 20 0 DIADMN FC1(F)CCC(N[C@@H](c2nccs2)c2ccccc2)CC1 ZINC000647177331 1046951565 /nfs/dbraw/zinc/95/15/65/1046951565.db2.gz VTDASYKDSXANQT-CQSZACIVSA-N 0 1 308.397 4.400 20 0 DIADMN CSc1c(F)cc(NCc2[nH]nc3ccccc32)cc1F ZINC000680136858 1046952033 /nfs/dbraw/zinc/95/20/33/1046952033.db2.gz FXJRXJMEGAJCNW-UHFFFAOYSA-N 0 1 305.353 4.175 20 0 DIADMN C[C@H]1C[C@H](NC2(c3cc(C(F)(F)F)ccc3Cl)CC2)CO1 ZINC000647206148 1046953140 /nfs/dbraw/zinc/95/31/40/1046953140.db2.gz JFTPKPFZCOAFCQ-ONGXEEELSA-N 0 1 319.754 4.115 20 0 DIADMN CC(C)c1cc(-c2nc(C3(N)CCCC3)no2)c2ccccc2n1 ZINC000261852593 1046954002 /nfs/dbraw/zinc/95/40/02/1046954002.db2.gz SYVNRUBIMSGNIN-UHFFFAOYSA-N 0 1 322.412 4.136 20 0 DIADMN CC[C@H](Sc1ccccc1)c1nc(C2(N)CCCC2)no1 ZINC000261908554 1046954027 /nfs/dbraw/zinc/95/40/27/1046954027.db2.gz ZLUPLQZHTSVPIK-ZDUSSCGKSA-N 0 1 303.431 4.041 20 0 DIADMN CC(C)[C@@H](c1ccccc1Cl)N(C)Cc1cnc(N)s1 ZINC000261991719 1046956962 /nfs/dbraw/zinc/95/69/62/1046956962.db2.gz KJFWAXLGRUOIEN-AWEZNQCLSA-N 0 1 309.866 4.208 20 0 DIADMN CC[C@@H](C)CCCCC(=O)N1CCC(c2cc(C)[nH]n2)CC1 ZINC000680221669 1046958341 /nfs/dbraw/zinc/95/83/41/1046958341.db2.gz YTVPKLORIDCUAV-CQSZACIVSA-N 0 1 305.466 4.031 20 0 DIADMN CC(C)Cn1nccc1CNC1(c2cccc(Cl)c2)CCC1 ZINC000647252153 1046961066 /nfs/dbraw/zinc/96/10/66/1046961066.db2.gz VPKSZKWTUZBODE-UHFFFAOYSA-N 0 1 317.864 4.362 20 0 DIADMN CC(C)n1cc(CNC2(c3cccc(Cl)c3)CCC2)cn1 ZINC000647251891 1046961084 /nfs/dbraw/zinc/96/10/84/1046961084.db2.gz NUCFEOUYQZFAJU-UHFFFAOYSA-N 0 1 303.837 4.286 20 0 DIADMN Fc1cccc(F)c1[C@@H]1CCCN1Cc1c[nH]c2ncccc12 ZINC001137406064 1046963345 /nfs/dbraw/zinc/96/33/45/1046963345.db2.gz 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FC[C@@]1(C(F)(F)F)CCN(Cc2coc3ccc(F)cc23)C1 ZINC001141847171 1047298440 /nfs/dbraw/zinc/29/84/40/1047298440.db2.gz ZPFBFRJFMCOPAI-AWEZNQCLSA-N 0 1 319.273 4.296 20 0 DIADMN CCCOc1ccc(CN[C@H](C)c2cncs2)cc1OCC ZINC000897934394 1047299568 /nfs/dbraw/zinc/29/95/68/1047299568.db2.gz ISBXFRWPSFCXOH-CYBMUJFWSA-N 0 1 320.458 4.181 20 0 DIADMN COc1cc2c(cc1F)nccc2N[C@@H]1CC[C@H]2[C@@H](C1)C2(F)F ZINC001118535398 1047299925 /nfs/dbraw/zinc/29/99/25/1047299925.db2.gz DEAMETIOLKKOHT-ADEWGFFLSA-N 0 1 322.330 4.228 20 0 DIADMN CC[C@@H](C)Oc1cc(CN[C@H](C)c2cncs2)ccc1OC ZINC000897934109 1047300608 /nfs/dbraw/zinc/30/06/08/1047300608.db2.gz DTYOJUHIIWVCQP-CHWSQXEVSA-N 0 1 320.458 4.180 20 0 DIADMN Cc1ncsc1-c1ccc(CN[C@H](C)c2cncs2)cc1 ZINC000897930259 1047301543 /nfs/dbraw/zinc/30/15/43/1047301543.db2.gz LSQWEBALFUPVTO-LLVKDONJSA-N 0 1 315.467 4.426 20 0 DIADMN Cc1cc(CN[C@H](C)c2cncs2)ccc1C(F)(F)F ZINC000897930289 1047301634 /nfs/dbraw/zinc/30/16/34/1047301634.db2.gz MJUUKSXZBBKXNC-SNVBAGLBSA-N 0 1 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0 1 319.206 4.078 20 0 DIADMN CC(C)c1cc([C@H]2CCCN(Cc3c(F)cccc3F)C2)[nH]n1 ZINC001197543658 1047843906 /nfs/dbraw/zinc/84/39/06/1047843906.db2.gz SOAJYQXYODZOLP-ZDUSSCGKSA-N 0 1 319.399 4.191 20 0 DIADMN CC(C)c1cc([C@H]2CCCN(Cc3c(F)cccc3F)C2)n[nH]1 ZINC001197543658 1047843915 /nfs/dbraw/zinc/84/39/15/1047843915.db2.gz SOAJYQXYODZOLP-ZDUSSCGKSA-N 0 1 319.399 4.191 20 0 DIADMN Fc1ccc(Nc2ccc3c[nH]nc3c2)c(Br)c1 ZINC001174499862 1047845167 /nfs/dbraw/zinc/84/51/67/1047845167.db2.gz CYQGKQZSFCHYEF-UHFFFAOYSA-N 0 1 306.138 4.208 20 0 DIADMN Cc1ccc(CSc2nc(C=Cc3ccccc3)n[nH]2)c(C)n1 ZINC000479202154 1047845777 /nfs/dbraw/zinc/84/57/77/1047845777.db2.gz OXHVDOBXXVVHOV-LUAWRHEFSA-N 0 1 322.437 4.279 20 0 DIADMN COc1ccc(Nc2ccc3c[nH]nc3c2)cc1C(F)(F)F ZINC001174499909 1047845949 /nfs/dbraw/zinc/84/59/49/1047845949.db2.gz FVPMKEKKAASBAZ-UHFFFAOYSA-N 0 1 307.275 4.334 20 0 DIADMN COc1ccc(Br)c(Nc2ccc3c[nH]nc3c2)c1 ZINC001174500000 1047851462 /nfs/dbraw/zinc/85/14/62/1047851462.db2.gz HKHATBWEUNODGE-UHFFFAOYSA-N 0 1 318.174 4.078 20 0 DIADMN C[C@@H](c1ccccc1)N(C(=O)c1cc2[nH]cnc2cc1F)C1CC1 ZINC000667453685 1047852319 /nfs/dbraw/zinc/85/23/19/1047852319.db2.gz RGOCVZQESTXZOH-LBPRGKRZSA-N 0 1 323.371 4.068 20 0 DIADMN CCC(=O)c1ccc(O)c(NC(=O)/C=C/CCc2ccccc2)c1 ZINC001159473971 1047852169 /nfs/dbraw/zinc/85/21/69/1047852169.db2.gz SBGVFPSUFBOCKE-YRNVUSSQSA-N 0 1 323.392 4.112 20 0 DIADMN Fc1ccc(OC(F)(F)F)cc1Nc1ccc2c[nH]nc2c1 ZINC001174500041 1047852912 /nfs/dbraw/zinc/85/29/12/1047852912.db2.gz IJIMRNWJDNEBRW-UHFFFAOYSA-N 0 1 311.238 4.344 20 0 DIADMN Cc1sc2[nH]c(CN(C)C[C@@H](C)C(C)(C)C)nc(=O)c2c1C ZINC001197600814 1047853681 /nfs/dbraw/zinc/85/36/81/1047853681.db2.gz FAIOWZQKEBVIMS-SNVBAGLBSA-N 0 1 321.490 4.128 20 0 DIADMN Clc1ccc2sc(CN3CC(Cc4ccco4)C3)cc2n1 ZINC001182880765 1047856310 /nfs/dbraw/zinc/85/63/10/1047856310.db2.gz KKYLRYIDVCVFLL-UHFFFAOYSA-N 0 1 318.829 4.217 20 0 DIADMN CO[C@@H]1[C@H](C)[C@@H](N[C@@H](C)c2ncc(-c3ccccc3)o2)C1(C)C ZINC000553478173 1047857765 /nfs/dbraw/zinc/85/77/65/1047857765.db2.gz QJRZSFRDXXEIGZ-DLTLXFJOSA-N 0 1 314.429 4.052 20 0 DIADMN CC[C@H](C(=O)Nc1nc2ccc(C)cc2[nH]1)c1ccc(OC)cc1 ZINC000553474547 1047859072 /nfs/dbraw/zinc/85/90/72/1047859072.db2.gz RLHNKNVUYVTKPP-HNNXBMFYSA-N 0 1 323.396 4.012 20 0 DIADMN [O-]c1cc(Nc2ccc([C@@H]3CCC[NH2+]3)cc2)c(F)cc1Cl ZINC001159529541 1047862626 /nfs/dbraw/zinc/86/26/26/1047862626.db2.gz MSQXWPBQFRCFLB-AWEZNQCLSA-N 0 1 306.768 4.353 20 0 DIADMN COc1cc(F)c(C)cc1CN1CC[C@@H](C)C(F)(F)CC1 ZINC001250093132 1047865960 /nfs/dbraw/zinc/86/59/60/1047865960.db2.gz GDYBUGQOEZFDPQ-GFCCVEGCSA-N 0 1 301.352 4.010 20 0 DIADMN CCCOc1ccc(Nc2cccc3[nH]ncc32)c(F)c1F ZINC001159574909 1047869885 /nfs/dbraw/zinc/86/98/85/1047869885.db2.gz PYPBJYQEMNIYAX-UHFFFAOYSA-N 0 1 303.312 4.374 20 0 DIADMN Fc1cc(Nc2cccc3[nH]ncc32)cc(N2CCCCC2)c1 ZINC001159574307 1047870167 /nfs/dbraw/zinc/87/01/67/1047870167.db2.gz AVHNMONTXGNBGI-UHFFFAOYSA-N 0 1 310.376 4.436 20 0 DIADMN Fc1ccc(Br)c(Nc2ccc3c[nH]nc3c2)c1F ZINC001174502744 1047870165 /nfs/dbraw/zinc/87/01/65/1047870165.db2.gz ZZRKNIKNZWSMSA-UHFFFAOYSA-N 0 1 324.128 4.347 20 0 DIADMN COc1cccc(C(F)(F)F)c1Nc1cccc2[nH]ncc21 ZINC001159574777 1047870476 /nfs/dbraw/zinc/87/04/76/1047870476.db2.gz LXCOHKDCITXIPE-UHFFFAOYSA-N 0 1 307.275 4.334 20 0 DIADMN Fc1ccc(Br)c(F)c1Nc1ccc2c[nH]nc2c1 ZINC001174501263 1047871326 /nfs/dbraw/zinc/87/13/26/1047871326.db2.gz ZZOAQEIJJZRUBS-UHFFFAOYSA-N 0 1 324.128 4.347 20 0 DIADMN CC(C)(C)c1nc2ccc(NC(=O)[C@@H]3CCC(F)(F)C3)cc2[nH]1 ZINC000479368660 1047872752 /nfs/dbraw/zinc/87/27/52/1047872752.db2.gz SCPMJMHJCLVOTL-SNVBAGLBSA-N 0 1 321.371 4.234 20 0 DIADMN C[C@H](CCN1C[C@@H](C)O[C@H](CC(F)(F)F)C1)c1ccccc1 ZINC001182999743 1047874328 /nfs/dbraw/zinc/87/43/28/1047874328.db2.gz JALRXZMPNZQLLO-IIAWOOMASA-N 0 1 315.379 4.222 20 0 DIADMN CC(C)(C[NH3+])c1ccc(Nc2cc(Cl)c([O-])cc2F)cc1 ZINC001159585161 1047874477 /nfs/dbraw/zinc/87/44/77/1047874477.db2.gz RLBSPJWOGFFOHR-UHFFFAOYSA-N 0 1 308.784 4.165 20 0 DIADMN CC(C)c1cccc(CNCc2c[nH]c(-c3ccccc3)n2)c1 ZINC000479405665 1047885328 /nfs/dbraw/zinc/88/53/28/1047885328.db2.gz HTNXUXXMIJYJKO-UHFFFAOYSA-N 0 1 305.425 4.490 20 0 DIADMN Cc1cnn(C)c1CN(Cc1cccc(Cl)c1)CC(C)C ZINC001183060290 1047887389 /nfs/dbraw/zinc/88/73/89/1047887389.db2.gz UKHADGCDEJIKKZ-UHFFFAOYSA-N 0 1 305.853 4.040 20 0 DIADMN COC1(CNCc2csc(-c3ccccc3)n2)CCCCC1 ZINC000479425882 1047893615 /nfs/dbraw/zinc/89/36/15/1047893615.db2.gz VCAFKEFSHFLROC-UHFFFAOYSA-N 0 1 316.470 4.249 20 0 DIADMN Cc1ncc(C[N@@H+](Cc2ccccc2)[C@@H](C)c2ccccc2)n1C ZINC000667495348 1047894323 /nfs/dbraw/zinc/89/43/23/1047894323.db2.gz FOVDIMGQZTXSJW-KRWDZBQOSA-N 0 1 319.452 4.492 20 0 DIADMN C[C@@H]1CC[C@@H](NC(=O)c2c(O)cc(Cl)cc2Cl)C[C@H]1C ZINC001183154437 1047894828 /nfs/dbraw/zinc/89/48/28/1047894828.db2.gz UXUAJFUZYXVZLP-FXPVBKGRSA-N 0 1 316.228 4.254 20 0 DIADMN COc1cc(OC(F)(F)F)ccc1Nc1ccc2c[nH]nc2c1 ZINC001159662220 1047895164 /nfs/dbraw/zinc/89/51/64/1047895164.db2.gz SKBIPHACCSIMKR-UHFFFAOYSA-N 0 1 323.274 4.214 20 0 DIADMN CC(C)OC(=O)C1CCN([C@@H](C)c2ccc(Cl)cc2)CC1 ZINC001197912030 1047905416 /nfs/dbraw/zinc/90/54/16/1047905416.db2.gz TWLHIOUVMFDCIY-ZDUSSCGKSA-N 0 1 309.837 4.065 20 0 DIADMN Cc1ccc2nc(NC(=O)c3cc4c(ccc(C)c4C)[nH]3)[nH]c2c1 ZINC001159705087 1047905545 /nfs/dbraw/zinc/90/55/45/1047905545.db2.gz QTEDHGNJSNEREG-UHFFFAOYSA-N 0 1 318.380 4.222 20 0 DIADMN C[C@H](c1ccc(Cl)cc1)N(Cc1cnc2n1CCC2)C1CC1 ZINC000667497847 1047908033 /nfs/dbraw/zinc/90/80/33/1047908033.db2.gz QBWODQCPYNLQOF-CYBMUJFWSA-N 0 1 315.848 4.208 20 0 DIADMN Cc1ncc(CN([C@H](C)c2ccc(Cl)cc2)C2CC2)n1C ZINC000667497712 1047908238 /nfs/dbraw/zinc/90/82/38/1047908238.db2.gz LZKCZSBSFLZFOZ-GFCCVEGCSA-N 0 1 303.837 4.108 20 0 DIADMN CCc1cc(CN2CCC[C@H]2c2ccccc2SC)on1 ZINC001203229416 1047908497 /nfs/dbraw/zinc/90/84/97/1047908497.db2.gz VJWUBTFUJFPGCE-INIZCTEOSA-N 0 1 302.443 4.296 20 0 DIADMN Fc1cc(CN2CC(c3ccccc3)C2)ccc1OC(F)F ZINC001183291063 1047915108 /nfs/dbraw/zinc/91/51/08/1047915108.db2.gz AZGQTEQYACWXAC-UHFFFAOYSA-N 0 1 307.315 4.027 20 0 DIADMN CN(Cc1ccccc1OCc1ccccc1)C[C@H]1CCC=CO1 ZINC001183313208 1047917666 /nfs/dbraw/zinc/91/76/66/1047917666.db2.gz OTOJMSGKNGHPLT-HXUWFJFHSA-N 0 1 323.436 4.390 20 0 DIADMN [O-]c1c(Cl)c(Cl)ccc1Nc1cccc2c1CC[NH2+]C2 ZINC001159766419 1047918691 /nfs/dbraw/zinc/91/86/91/1047918691.db2.gz LPWJRBZMQDCSEL-UHFFFAOYSA-N 0 1 309.196 4.088 20 0 DIADMN Cc1ccc2[nH]c(CN[C@@H]3CCc4ccc(Cl)cc43)nc2c1 ZINC000479518872 1047919303 /nfs/dbraw/zinc/91/93/03/1047919303.db2.gz RQOMYDIZVILYPP-OAHLLOKOSA-N 0 1 311.816 4.302 20 0 DIADMN Cc1ccc2nc(CN[C@@H]3CCc4ccc(Cl)cc43)[nH]c2c1 ZINC000479518872 1047919313 /nfs/dbraw/zinc/91/93/13/1047919313.db2.gz RQOMYDIZVILYPP-OAHLLOKOSA-N 0 1 311.816 4.302 20 0 DIADMN CCN1CCCC[C@H]1C(=O)N1C[C@@H](C(C)(C)C)c2ccccc21 ZINC001183325381 1047920963 /nfs/dbraw/zinc/92/09/63/1047920963.db2.gz UFCVTZFDMMNYKU-AEFFLSMTSA-N 0 1 314.473 4.037 20 0 DIADMN CCN1CCCC[C@@H]1C(=O)N1C[C@@H](C(C)(C)C)c2ccccc21 ZINC001183325383 1047921037 /nfs/dbraw/zinc/92/10/37/1047921037.db2.gz UFCVTZFDMMNYKU-SJLPKXTDSA-N 0 1 314.473 4.037 20 0 DIADMN [O-]c1ccc(F)c(Nc2ccc([C@@H]3CC[NH2+]C3)cc2)c1Cl ZINC001159777470 1047923300 /nfs/dbraw/zinc/92/33/00/1047923300.db2.gz LKPINRINDROJMM-LLVKDONJSA-N 0 1 306.768 4.005 20 0 DIADMN [O-]c1c(F)cc(Nc2ccc([C@@H]3CC[NH2+]C3)cc2)cc1Cl ZINC001159779515 1047923382 /nfs/dbraw/zinc/92/33/82/1047923382.db2.gz XXGBOMXIOSPHAW-LLVKDONJSA-N 0 1 306.768 4.005 20 0 DIADMN CN(Cc1ccc(-c2cccs2)cc1)Cc1cccc(=O)[nH]1 ZINC001198093515 1047926161 /nfs/dbraw/zinc/92/61/61/1047926161.db2.gz FMGUEEDQPCSJHL-UHFFFAOYSA-N 0 1 310.422 4.148 20 0 DIADMN CCC1(Cc2ccccc2)CCN([C@@H](C)c2nccn2C)CC1 ZINC000479551071 1047928705 /nfs/dbraw/zinc/92/87/05/1047928705.db2.gz KVKPUQJYJPRMCW-KRWDZBQOSA-N 0 1 311.473 4.216 20 0 DIADMN CC(C)(C)C1CC(NC(=O)c2cccc3nc(C(F)F)[nH]c32)C1 ZINC001159825134 1047931424 /nfs/dbraw/zinc/93/14/24/1047931424.db2.gz GSKUNJACJNMCLI-UHFFFAOYSA-N 0 1 321.371 4.055 20 0 DIADMN FC[C@H]1CCCN(Cc2csc(-c3ccc(F)cc3)n2)C1 ZINC001183520268 1047932982 /nfs/dbraw/zinc/93/29/82/1047932982.db2.gz JNSMMZCBGPQYGF-GFCCVEGCSA-N 0 1 308.397 4.131 20 0 DIADMN Fc1cc(Br)cc([C@@H](NCc2ccco2)C2CC2)c1 ZINC000479591783 1047934466 /nfs/dbraw/zinc/93/44/66/1047934466.db2.gz YCTDADDYYKOHES-HNNXBMFYSA-N 0 1 324.193 4.422 20 0 DIADMN CC(C)CCc1nc(CN[C@]2(CO)CCCC(C)(C)C2)cs1 ZINC001174660186 1047939211 /nfs/dbraw/zinc/93/92/11/1047939211.db2.gz FZNWFDSZPOCBET-GOSISDBHSA-N 0 1 324.534 4.153 20 0 DIADMN C[C@H](c1ncc(C(C)(C)C)o1)[N@H+]1C[C@H]2[C@H]3C=C[C@H](C3)[C@@]2(C)C1 ZINC001198252430 1047939859 /nfs/dbraw/zinc/93/98/59/1047939859.db2.gz UUEBRTOVLMWVNN-JCJIIYQNSA-N 0 1 300.446 4.177 20 0 DIADMN CCc1ccc(C(C)(C)C(=O)Nc2ccc3c(C)[nH]nc3c2)cc1 ZINC001183511260 1047940459 /nfs/dbraw/zinc/94/04/59/1047940459.db2.gz XUGZKOYVNBAFRL-UHFFFAOYSA-N 0 1 321.424 4.350 20 0 DIADMN C[C@@]1(Cc2cccs2)CCCN1CC(=O)c1ccccc1F ZINC001198299087 1047941947 /nfs/dbraw/zinc/94/19/47/1047941947.db2.gz DGDRNVIJHORFLU-SFHVURJKSA-N 0 1 317.429 4.167 20 0 DIADMN Cc1cccc2nc(CN3CCC[C@H]3/C=C/c3ccccc3)cn21 ZINC001198270262 1047944043 /nfs/dbraw/zinc/94/40/43/1047944043.db2.gz JGPKXFQVRSUHBZ-SJFMBGHLSA-N 0 1 317.436 4.321 20 0 DIADMN C[C@@H]1CN(C[C@@H](O)c2ccc(F)cc2Cl)[C@@H]1c1ccccc1 ZINC000774650925 1047946030 /nfs/dbraw/zinc/94/60/30/1047946030.db2.gz ROJUFNFOQVMQHI-PJSAGSTRSA-N 0 1 319.807 4.206 20 0 DIADMN Cc1cc(CN2CCC[C@@H](C3CCC3)C2)cnc1Br ZINC001174705045 1047946775 /nfs/dbraw/zinc/94/67/75/1047946775.db2.gz OJYAWYBVYNJKIA-OAHLLOKOSA-N 0 1 323.278 4.165 20 0 DIADMN Cc1ccc2nc(NC(=O)CC=Cc3ccccc3F)[nH]c2c1 ZINC000553814601 1047948173 /nfs/dbraw/zinc/94/81/73/1047948173.db2.gz WXBRTBSKODLFTE-GQCTYLIASA-N 0 1 309.344 4.052 20 0 DIADMN Cc1cccc(C)c1NC(=S)Nc1cc(O)c(F)c(F)c1 ZINC001198357706 1047951451 /nfs/dbraw/zinc/95/14/51/1047951451.db2.gz RSPYNPQDLUABCH-UHFFFAOYSA-N 0 1 308.353 4.096 20 0 DIADMN CCN(Cc1c(C2CC2)cnn1C)[C@@H](C)c1ccc(F)cc1 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313.832 4.489 20 0 DIADMN C[C@H](CN(C)Cc1nc(-c2cccs2)no1)CC(C)(C)C ZINC001194240958 1049347324 /nfs/dbraw/zinc/34/73/24/1049347324.db2.gz MLJRSDWAVRKTDN-LBPRGKRZSA-N 0 1 307.463 4.302 20 0 DIADMN C[C@H](c1cccc(Cl)c1)N(C)Cc1ccc2c(n1)CCC2 ZINC001180379024 1049349574 /nfs/dbraw/zinc/34/95/74/1049349574.db2.gz QGNPTJARMFMJSB-CYBMUJFWSA-N 0 1 300.833 4.417 20 0 DIADMN Clc1cnn(CCN(Cc2ccccc2Cl)CC2CC2)c1 ZINC001194262167 1049351632 /nfs/dbraw/zinc/35/16/32/1049351632.db2.gz KOXMBGHLSXNBCZ-UHFFFAOYSA-N 0 1 324.255 4.102 20 0 DIADMN Cn1c2ccc(Cl)cc2nc1CN1CC[C@@H]2CCCC[C@H]2C1 ZINC001180403414 1049352003 /nfs/dbraw/zinc/35/20/03/1049352003.db2.gz KMGHYDNEEDHEPK-KBPBESRZSA-N 0 1 317.864 4.239 20 0 DIADMN C[C@H](NCc1ccc(-c2cnco2)cc1)c1ccnn1C1CCC1 ZINC000906526414 1049352983 /nfs/dbraw/zinc/35/29/83/1049352983.db2.gz HTMXWKXWIGNAFP-AWEZNQCLSA-N 0 1 322.412 4.114 20 0 DIADMN CCc1cccc(Cl)c1C[N@H+]1CCC[C@@H](C(C)(C)C(=O)[O-])C1 ZINC000859811947 1049352947 /nfs/dbraw/zinc/35/29/47/1049352947.db2.gz GQWBBUUSUACFBZ-CQSZACIVSA-N 0 1 323.864 4.225 20 0 DIADMN Cc1cc(C)cc([C@@H](O)CN2CC[C@H]2c2ccc(Cl)cc2)c1 ZINC001194267772 1049353612 /nfs/dbraw/zinc/35/36/12/1049353612.db2.gz BEXSBTVNNRHPDI-OALUTQOASA-N 0 1 315.844 4.437 20 0 DIADMN Cc1cc(C)cc([C@H](O)CN2CC[C@@H]2c2ccc(Cl)cc2)c1 ZINC001194267774 1049354798 /nfs/dbraw/zinc/35/47/98/1049354798.db2.gz BEXSBTVNNRHPDI-RTBURBONSA-N 0 1 315.844 4.437 20 0 DIADMN COCOc1ccc(-c2ccc(F)c(CN(C)C)c2)cc1Cl ZINC001205054559 1049356457 /nfs/dbraw/zinc/35/64/57/1049356457.db2.gz GEPQATFXTWGLSB-UHFFFAOYSA-N 0 1 323.795 4.190 20 0 DIADMN Cc1nn(C)c(Cl)c1CN[C@@H](c1cccc(C)c1)C(C)C ZINC000859849530 1049357020 /nfs/dbraw/zinc/35/70/20/1049357020.db2.gz MLYHQXZGOFFJCD-MRXNPFEDSA-N 0 1 305.853 4.177 20 0 DIADMN Oc1ccc(-c2cc(N3CCCC3)ccn2)c(C(F)(F)F)c1 ZINC001205073270 1049361598 /nfs/dbraw/zinc/36/15/98/1049361598.db2.gz IFVJXHINKSZGNM-UHFFFAOYSA-N 0 1 308.303 4.073 20 0 DIADMN CO[C@@H](CN1CCOCC12CCCCC2)c1ccc(Cl)cc1 ZINC001194368773 1049362221 /nfs/dbraw/zinc/36/22/21/1049362221.db2.gz FVZFDZBCIVJBRH-KRWDZBQOSA-N 0 1 323.864 4.063 20 0 DIADMN COc1cccc2c1CN(Cc1ccccc1CC(C)C)CC2 ZINC001194400044 1049369621 /nfs/dbraw/zinc/36/96/21/1049369621.db2.gz CSMBYHFSYFFGFX-UHFFFAOYSA-N 0 1 309.453 4.452 20 0 DIADMN Cc1cccc(CN2CCc3nn(-c4ccccc4)cc3C2)c1C ZINC001205095306 1049373291 /nfs/dbraw/zinc/37/32/91/1049373291.db2.gz BRDJUAANBMRQBC-UHFFFAOYSA-N 0 1 317.436 4.047 20 0 DIADMN CN(Cc1cnc(Cl)c(F)c1)[C@H]1CCCc2ccccc21 ZINC001205094741 1049373452 /nfs/dbraw/zinc/37/34/52/1049373452.db2.gz YSMLHFBWIQQQJH-INIZCTEOSA-N 0 1 304.796 4.384 20 0 DIADMN CN(Cc1cnc(Cl)c(F)c1)[C@@H]1CCCc2ccccc21 ZINC001205094742 1049373533 /nfs/dbraw/zinc/37/35/33/1049373533.db2.gz YSMLHFBWIQQQJH-MRXNPFEDSA-N 0 1 304.796 4.384 20 0 DIADMN CC(C)O[C@@H]1C[C@@H](NCc2nccc(Cl)c2Cl)C1(C)C ZINC001194456375 1049373776 /nfs/dbraw/zinc/37/37/76/1049373776.db2.gz DYYMOELMFGUHCX-CHWSQXEVSA-N 0 1 317.260 4.070 20 0 DIADMN CCCCCN(Cc1cncn1CC)Cc1ccc(F)cc1 ZINC001205094385 1049374562 /nfs/dbraw/zinc/37/45/62/1049374562.db2.gz UEKBDGNCQQHVKP-UHFFFAOYSA-N 0 1 303.425 4.235 20 0 DIADMN FC(F)(F)C1(C(F)(F)F)CCN(CCc2cccs2)C1 ZINC000117351531 1049378539 /nfs/dbraw/zinc/37/85/39/1049378539.db2.gz KACIOFZWKOJNES-UHFFFAOYSA-N 0 1 317.298 4.107 20 0 DIADMN CO[C@@H](CN[C@H]1CCCc2cn(C(C)C)nc21)C1CCCCC1 ZINC001180613438 1049383135 /nfs/dbraw/zinc/38/31/35/1049383135.db2.gz PNXFOJDWGYINDG-ROUUACIJSA-N 0 1 319.493 4.026 20 0 DIADMN C[C@H](c1ccc(F)cc1)N(C)Cc1ccc(Br)nc1 ZINC001205129880 1049389249 /nfs/dbraw/zinc/38/92/49/1049389249.db2.gz CIKIOVNTDHIIKQ-LLVKDONJSA-N 0 1 323.209 4.176 20 0 DIADMN COc1ccccc1CN(C)[C@@H](C)c1nccc2ccccc21 ZINC001205149284 1049393415 /nfs/dbraw/zinc/39/34/15/1049393415.db2.gz TZGHNFZTRLOHAC-HNNXBMFYSA-N 0 1 306.409 4.436 20 0 DIADMN CCC[C@H](OCC)C(=O)O[C@@H](C)c1nc2ccc(Cl)cc2[nH]1 ZINC000860538882 1049393702 /nfs/dbraw/zinc/39/37/02/1049393702.db2.gz AGJYXJIJIVNJQX-HZMBPMFUSA-N 0 1 324.808 4.026 20 0 DIADMN COc1ccccc1CN(C)[C@H](C)c1nccc2ccccc21 ZINC001205149286 1049394648 /nfs/dbraw/zinc/39/46/48/1049394648.db2.gz TZGHNFZTRLOHAC-OAHLLOKOSA-N 0 1 306.409 4.436 20 0 DIADMN C[C@@H]1C[C@@H](c2cccnc2)N(C/C=C\c2ccc(F)cc2F)C1 ZINC001180665791 1049396195 /nfs/dbraw/zinc/39/61/95/1049396195.db2.gz ORTRKMALBOJDER-XRXMKMCKSA-N 0 1 314.379 4.456 20 0 DIADMN COc1cc(Cl)c(CN2CC[C@@H](C)C(C)(C)C2)cc1OC ZINC001180673799 1049396341 /nfs/dbraw/zinc/39/63/41/1049396341.db2.gz QUQDQHSMJFXLBX-GFCCVEGCSA-N 0 1 311.853 4.225 20 0 DIADMN CCOc1cc(CN(C)[C@@H](C)c2ccccc2)c(F)cc1OC ZINC001205157245 1049396897 /nfs/dbraw/zinc/39/68/97/1049396897.db2.gz XTRMTNXHTQIQHY-AWEZNQCLSA-N 0 1 317.404 4.426 20 0 DIADMN O=C(Nc1cc(O)c(F)c(F)c1)Oc1ccc2ccccc2c1 ZINC001194656796 1049405214 /nfs/dbraw/zinc/40/52/14/1049405214.db2.gz AIKADSGABHDPKR-UHFFFAOYSA-N 0 1 315.275 4.435 20 0 DIADMN CN(Cc1nnn(-c2ccccc2)c1C1CC1)CC1CCCCC1 ZINC001205192765 1049406936 /nfs/dbraw/zinc/40/69/36/1049406936.db2.gz AVHKZQVVAFNNEH-UHFFFAOYSA-N 0 1 324.472 4.157 20 0 DIADMN C/C(=C/c1ccccc1)CN(C)Cc1nccc2c1CCCC2 ZINC001180865828 1049413845 /nfs/dbraw/zinc/41/38/45/1049413845.db2.gz UNIWOZGAGSEVDI-VKAVYKQESA-N 0 1 306.453 4.496 20 0 DIADMN CC[C@@H]1Cc2ccccc2CN1Cc1ccc(C(F)F)nc1 ZINC001205253993 1049418208 /nfs/dbraw/zinc/41/82/08/1049418208.db2.gz PQWBVQQERSMXFQ-MRXNPFEDSA-N 0 1 302.368 4.356 20 0 DIADMN CC[C@]1(C)CN(Cc2ccc(C(F)(F)F)c(C)c2)CCO1 ZINC001180933903 1049419964 /nfs/dbraw/zinc/41/99/64/1049419964.db2.gz DKHZVPRZZYOZJU-OAHLLOKOSA-N 0 1 301.352 4.015 20 0 DIADMN CCCCN(Cc1ncnn1CC(C)C)[C@@H]1CCC[C@@H](C)C1 ZINC001194715509 1049420228 /nfs/dbraw/zinc/42/02/28/1049420228.db2.gz QDXSFOHSHJBWDI-IAGOWNOFSA-N 0 1 306.498 4.115 20 0 DIADMN Cc1nc(-c2ccccc2)[nH]c1C(=O)OC1CCC(F)(F)CC1 ZINC000860969317 1049425157 /nfs/dbraw/zinc/42/51/57/1049425157.db2.gz SNJBZVPJKLWWLW-UHFFFAOYSA-N 0 1 320.339 4.120 20 0 DIADMN CC[C@H]1CCC[C@H](C[N@H+]2CCN(C(=O)OC(C)(C)C)[C@@H](C)C2)C1 ZINC001180995165 1049429613 /nfs/dbraw/zinc/42/96/13/1049429613.db2.gz JISHUHQZTMXPBB-ULQDDVLXSA-N 0 1 324.509 4.144 20 0 DIADMN CC[C@H]1CC[N@@H+](Cc2cnn(Cc3ccccc3)c2Cl)[C@H]1C ZINC001181043217 1049429634 /nfs/dbraw/zinc/42/96/34/1049429634.db2.gz KZBWUIAYCXGSLW-HOCLYGCPSA-N 0 1 317.864 4.205 20 0 DIADMN CC[C@H]1CCN(Cc2cnn(Cc3ccccc3)c2Cl)[C@H]1C ZINC001181043217 1049429640 /nfs/dbraw/zinc/42/96/40/1049429640.db2.gz KZBWUIAYCXGSLW-HOCLYGCPSA-N 0 1 317.864 4.205 20 0 DIADMN Fc1ccc(/C=C/CN2CCC[C@@]3(C2)OCc2ccccc23)cc1 ZINC001181056589 1049431616 /nfs/dbraw/zinc/43/16/16/1049431616.db2.gz UORFXZKIGJHZDM-GUWAZMKPSA-N 0 1 323.411 4.360 20 0 DIADMN Cc1cc(Cl)cc(C)c1C[N@H+]1CCC[C@H](OCC2CC2)C1 ZINC001181085880 1049435283 /nfs/dbraw/zinc/43/52/83/1049435283.db2.gz HIFZTFDLFYXTPD-KRWDZBQOSA-N 0 1 307.865 4.348 20 0 DIADMN CC(C)c1cnc(CN2CCC[C@@H]([C@@H]3CCCCO3)C2)s1 ZINC000668632165 1049436378 /nfs/dbraw/zinc/43/63/78/1049436378.db2.gz UZHSMSFWYRSMPE-CABCVRRESA-N 0 1 308.491 4.048 20 0 DIADMN CSCCCCCCC(=O)Nc1cc2cn[nH]c2cc1C ZINC000861286662 1049439363 /nfs/dbraw/zinc/43/93/63/1049439363.db2.gz FGFRYYUDMMKZTH-UHFFFAOYSA-N 0 1 305.447 4.123 20 0 DIADMN Clc1ccsc1CN1CC[C@@H](OCc2ccccc2)C1 ZINC001205339254 1049442974 /nfs/dbraw/zinc/44/29/74/1049442974.db2.gz DCXLQHMRPMZTCY-CQSZACIVSA-N 0 1 307.846 4.193 20 0 DIADMN C[C@H](NCC(=O)N(C)[C@H]1CCCC[C@@H]1C)c1ccc(Cl)cc1 ZINC001194931222 1049451122 /nfs/dbraw/zinc/45/11/22/1049451122.db2.gz JGDLISIKCFNUGI-ZQIUZPCESA-N 0 1 322.880 4.028 20 0 DIADMN CC(C)(C)[C@H]1CCCN(Cc2cccnc2Br)C1 ZINC001181204727 1049451338 /nfs/dbraw/zinc/45/13/38/1049451338.db2.gz HTIONLKVBSMMRD-ZDUSSCGKSA-N 0 1 311.267 4.102 20 0 DIADMN CC(C)C1CCC(CN2CCOc3cccc(F)c3C2)CC1 ZINC001181196229 1049451989 /nfs/dbraw/zinc/45/19/89/1049451989.db2.gz JFNCVOYGBSIPJT-UHFFFAOYSA-N 0 1 305.437 4.483 20 0 DIADMN Fc1ccc(-c2cccc3nc(C(F)(F)F)[nH]c32)c2c[nH]nc21 ZINC001205371775 1049454197 /nfs/dbraw/zinc/45/41/97/1049454197.db2.gz WWOGVSRDDHEJDB-UHFFFAOYSA-N 0 1 320.249 4.264 20 0 DIADMN c1coc([C@H]2N(Cc3cccc4c3CCC4)CC23CCOCC3)c1 ZINC000668672293 1049454853 /nfs/dbraw/zinc/45/48/53/1049454853.db2.gz MNUBVEHICVXWGC-HXUWFJFHSA-N 0 1 323.436 4.122 20 0 DIADMN COc1ccc(OC)c(CN[C@@H](C)c2cc3ccccc3[nH]2)c1 ZINC000775622910 1049455349 /nfs/dbraw/zinc/45/53/49/1049455349.db2.gz KHSCGITVQNEXQS-ZDUSSCGKSA-N 0 1 310.397 4.036 20 0 DIADMN C[C@@H]1C[C@@H]1CN1CCC[C@@H]1c1ccc(Br)c(F)c1 ZINC001181264889 1049456745 /nfs/dbraw/zinc/45/67/45/1049456745.db2.gz BWCSPEGWRJZCJW-IXPVHAAZSA-N 0 1 312.226 4.381 20 0 DIADMN Clc1cccc2c1CN(CCCOCc1ccccc1)CC2 ZINC001195015993 1049459613 /nfs/dbraw/zinc/45/96/13/1049459613.db2.gz YIAPVTCPBCJBIG-UHFFFAOYSA-N 0 1 315.844 4.305 20 0 DIADMN CCc1ccc(CN2CC3(CCOCC3)[C@H]2c2ccco2)s1 ZINC000668673499 1049459852 /nfs/dbraw/zinc/45/98/52/1049459852.db2.gz RLCIUEWVVXNLQA-QGZVFWFLSA-N 0 1 317.454 4.257 20 0 DIADMN Cc1cccc2c1CN(Cc1cnc3c(F)cccc3c1)CC2 ZINC001205399375 1049460762 /nfs/dbraw/zinc/46/07/62/1049460762.db2.gz FSAHTOJIFKRWGP-UHFFFAOYSA-N 0 1 306.384 4.241 20 0 DIADMN CN(CC(=O)Nc1ccc(-c2ccccc2)cc1)C1CC(C)(C)C1 ZINC001195002761 1049460997 /nfs/dbraw/zinc/46/09/97/1049460997.db2.gz RIXUGIAZLKTOOE-UHFFFAOYSA-N 0 1 322.452 4.413 20 0 DIADMN Clc1ccnc(Cl)c1CN[C@H]1C[C@H](c2ccccc2)C1 ZINC001181305668 1049462563 /nfs/dbraw/zinc/46/25/63/1049462563.db2.gz RPQFDTXPLQMPRY-JOCQHMNTSA-N 0 1 307.224 4.424 20 0 DIADMN CCc1nn(C)c(Cl)c1CN1CCC(c2ccsc2)CC1 ZINC000777220504 1049462649 /nfs/dbraw/zinc/46/26/49/1049462649.db2.gz IRRXFCCWGCFINE-UHFFFAOYSA-N 0 1 323.893 4.077 20 0 DIADMN CCCc1ccc(CN2CCCC[C@H]2c2ccnn2C)s1 ZINC001181316202 1049464514 /nfs/dbraw/zinc/46/45/14/1049464514.db2.gz WQJYCBUVJLSVEH-KRWDZBQOSA-N 0 1 303.475 4.161 20 0 DIADMN CCC(C)(C)[C@@H]1CCCN1C(=O)c1cnc(-c2ccccc2)[nH]1 ZINC000486749700 1049465251 /nfs/dbraw/zinc/46/52/51/1049465251.db2.gz DLBMKFBHNNYTSR-INIZCTEOSA-N 0 1 311.429 4.118 20 0 DIADMN C[C@H](C(=O)OC(C)(C)C)N(CC1CCC(F)(F)CC1)C1CC1 ZINC001195048300 1049468069 /nfs/dbraw/zinc/46/80/69/1049468069.db2.gz YEXKBDWNQHGKHC-GFCCVEGCSA-N 0 1 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CN[C@H](CC(C)C)c1nnc([C@H]2C[C@@H]2c2ccc(Cl)cc2)o1 ZINC001217715516 1052124734 /nfs/dbraw/zinc/12/47/34/1052124734.db2.gz VAGWEHFWSPBPKK-QLFBSQMISA-N 0 1 319.836 4.301 20 0 DIADMN CCc1noc(C)c1[C@H](C)NCc1cccc(OCC(C)C)c1 ZINC000769874363 1052124735 /nfs/dbraw/zinc/12/47/35/1052124735.db2.gz JYGPSZWVZPOAKB-AWEZNQCLSA-N 0 1 316.445 4.431 20 0 DIADMN CN[C@H](c1nnc(-c2cccc(Oc3ccccc3)c2)o1)C(C)C ZINC001217727084 1052125963 /nfs/dbraw/zinc/12/59/63/1052125963.db2.gz LXBOFDVPQNTQQV-KRWDZBQOSA-N 0 1 323.396 4.445 20 0 DIADMN Cc1ccc(-c2nnc([C@@H]3NCCC[C@H]3c3ccccc3)o2)cc1 ZINC001217748081 1052129878 /nfs/dbraw/zinc/12/98/78/1052129878.db2.gz GSUYRMFOOAVIMR-ZWKOTPCHSA-N 0 1 319.408 4.253 20 0 DIADMN Cc1cccc(-c2nnc([C@H]3C[C@H](c4ccccc4)CCN3)o2)c1 ZINC001217742382 1052130612 /nfs/dbraw/zinc/13/06/12/1052130612.db2.gz JXYQSQXELDYMAH-SJLPKXTDSA-N 0 1 319.408 4.253 20 0 DIADMN CC(C)N(Cc1c(Cl)n(C)nc1C(F)(F)F)CC1CCC1 ZINC000769925740 1052132261 /nfs/dbraw/zinc/13/22/61/1052132261.db2.gz 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CCOc1cc(F)cc(CN2CCC(F)(F)C(C)(C)C2)c1 ZINC001237913911 1055558545 /nfs/dbraw/zinc/55/85/45/1055558545.db2.gz RQTGMMRLAJFWHJ-UHFFFAOYSA-N 0 1 301.352 4.092 20 0 DIADMN CCCc1[nH]ncc1C(=O)Nc1ccc(C(C)(C)C)c(F)c1 ZINC001593662359 1055559047 /nfs/dbraw/zinc/55/90/47/1055559047.db2.gz MXFKZHKDXLYMPK-UHFFFAOYSA-N 0 1 303.381 4.051 20 0 DIADMN Fc1cc2[nH]cc(CN3CCC[C@@H]4C[C@@H]43)c2cc1Br ZINC001237937990 1055560434 /nfs/dbraw/zinc/56/04/34/1055560434.db2.gz LDFSCGLWXCCFJL-PSLIRLAXSA-N 0 1 323.209 4.054 20 0 DIADMN CC[C@@]12C[C@@H](CO1)N(Cc1ccc(COc3ccccc3)cc1)C2 ZINC001237921842 1055560461 /nfs/dbraw/zinc/56/04/61/1055560461.db2.gz WKZZYEWSVFGGAB-FPOVZHCZSA-N 0 1 323.436 4.019 20 0 DIADMN C[C@@H]1CCN(Cc2ccc(COc3ccccc3)cc2)CCC1=O ZINC001237928516 1055560672 /nfs/dbraw/zinc/56/06/72/1055560672.db2.gz VUBGTLURLFXHCG-QGZVFWFLSA-N 0 1 323.436 4.067 20 0 DIADMN Fc1cc2[nH]cc(CN3C4CCC3CC4)c2cc1Br ZINC001237930489 1055560844 /nfs/dbraw/zinc/56/08/44/1055560844.db2.gz SXJSLYCXDCRZDN-UHFFFAOYSA-N 0 1 323.209 4.196 20 0 DIADMN C[C@@H]1CCCN1Cc1c[nH]c2cc(F)c(Br)cc12 ZINC001237926292 1055561169 /nfs/dbraw/zinc/56/11/69/1055561169.db2.gz KGHQEDODVCLQOM-SECBINFHSA-N 0 1 311.198 4.054 20 0 DIADMN F[C@H]1CN(Cc2ccc(COc3ccccc3)cc2)C[C@@H]2C[C@@H]21 ZINC001237927954 1055561470 /nfs/dbraw/zinc/56/14/70/1055561470.db2.gz SRRGUKXAZOCCCP-IHPCNDPISA-N 0 1 311.400 4.055 20 0 DIADMN Fc1cc2[nH]cc(CN3CCC4(CC4)C3)c2cc1Br ZINC001237926794 1055561697 /nfs/dbraw/zinc/56/16/97/1055561697.db2.gz ORFOCKYFKVFEDL-UHFFFAOYSA-N 0 1 323.209 4.055 20 0 DIADMN Fc1cc(OC(F)F)ccc1CNCc1coc2ccccc12 ZINC001620948130 1055563779 /nfs/dbraw/zinc/56/37/79/1055563779.db2.gz VRSFWYGELRDOPN-UHFFFAOYSA-N 0 1 321.298 4.463 20 0 DIADMN Cc1sccc1CN1CCO[C@](C)(c2ccc(C)cc2)C1 ZINC001237968073 1055567703 /nfs/dbraw/zinc/56/77/03/1055567703.db2.gz HJAHLYJYBIBSEC-SFHVURJKSA-N 0 1 301.455 4.113 20 0 DIADMN Cc1sccc1CN1C[C@@H]2C[C@H](C1)c1cc3nccnc3cc12 ZINC001237968732 1055568922 /nfs/dbraw/zinc/56/89/22/1055568922.db2.gz 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/nfs/dbraw/zinc/57/91/65/1055579165.db2.gz NRJJPZODAFZYPF-GFCCVEGCSA-N 0 1 323.362 4.478 20 0 DIADMN COc1cc(CN[C@@H]2c3ccccc3O[C@H]2C)cc2ccccc21 ZINC001620957879 1055580669 /nfs/dbraw/zinc/58/06/69/1055580669.db2.gz UNVYZTCPJDVLAR-QKKBWIMNSA-N 0 1 319.404 4.460 20 0 DIADMN Clc1ccc2c(c1)n[nH]c2CN(Cc1ccccc1)C1CC1 ZINC001238002825 1055581041 /nfs/dbraw/zinc/58/10/41/1055581041.db2.gz FEHCAPKDMYABCL-UHFFFAOYSA-N 0 1 311.816 4.381 20 0 DIADMN C[Si](C)(C)c1ccc(CNCc2ccc(F)cc2Cl)cc1 ZINC001620957028 1055580954 /nfs/dbraw/zinc/58/09/54/1055580954.db2.gz RSCSWXMKLYICFI-UHFFFAOYSA-N 0 1 321.899 4.314 20 0 DIADMN [O-]c1c(F)cc(C[N@H+]2CC[C@H](c3cccc(F)c3)C2)cc1Cl ZINC001237998806 1055581267 /nfs/dbraw/zinc/58/12/67/1055581267.db2.gz XIHCYJOMNKAJDY-ZDUSSCGKSA-N 0 1 323.770 4.313 20 0 DIADMN Cc1cccc(C[N@H+](C)Cc2ccccc2Oc2cnccn2)c1 ZINC001238016707 1055584131 /nfs/dbraw/zinc/58/41/31/1055584131.db2.gz LCRSSHPXTJVVDY-UHFFFAOYSA-N 0 1 319.408 4.209 20 0 DIADMN Cc1cccc(CN(C)Cc2ccccc2Oc2cnccn2)c1 ZINC001238016707 1055584142 /nfs/dbraw/zinc/58/41/42/1055584142.db2.gz LCRSSHPXTJVVDY-UHFFFAOYSA-N 0 1 319.408 4.209 20 0 DIADMN COc1ncc(C2CC2)cc1C[N@@H+](Cc1ccccc1)C(C)C ZINC001238032306 1055587812 /nfs/dbraw/zinc/58/78/12/1055587812.db2.gz IEUCHYBXVDZTIY-UHFFFAOYSA-N 0 1 310.441 4.378 20 0 DIADMN COc1ncc(C2CC2)cc1CN(Cc1ccccc1)C(C)C ZINC001238032306 1055587822 /nfs/dbraw/zinc/58/78/22/1055587822.db2.gz IEUCHYBXVDZTIY-UHFFFAOYSA-N 0 1 310.441 4.378 20 0 DIADMN CC(C)CN(Cc1scnc1Br)CC(C)C ZINC001238035550 1055591804 /nfs/dbraw/zinc/59/18/04/1055591804.db2.gz IPVXXNUQTQHLHQ-UHFFFAOYSA-N 0 1 305.285 4.020 20 0 DIADMN COc1ccc(C(F)(F)F)c(CN2CCCC(F)(F)CC2)c1 ZINC001238050345 1055592910 /nfs/dbraw/zinc/59/29/10/1055592910.db2.gz DSJRNHQFVRHGHH-UHFFFAOYSA-N 0 1 323.305 4.335 20 0 DIADMN COc1ccc(C(F)(F)F)c(CN2CCC(SC)CC2)c1 ZINC001238054889 1055593267 /nfs/dbraw/zinc/59/32/67/1055593267.db2.gz CTLPSYOYDMFUEJ-UHFFFAOYSA-N 0 1 319.392 4.041 20 0 DIADMN CCCN(Cc1ccc(F)cc1)C(=O)c1ccc(Cl)c(O)c1 ZINC001595390077 1055593521 /nfs/dbraw/zinc/59/35/21/1055593521.db2.gz RHZWTFBHEZUTNU-UHFFFAOYSA-N 0 1 321.779 4.237 20 0 DIADMN CCOC(=O)c1c(Cl)cccc1CN1CC[C@@H]2CCC[C@@H]2C1 ZINC001238047187 1055594978 /nfs/dbraw/zinc/59/49/78/1055594978.db2.gz WQTZDZKQPHJFPD-UONOGXRCSA-N 0 1 321.848 4.139 20 0 DIADMN CC(C)C[C@@H]1CN(C)CCN1C(=O)C1CC(C)(C)CC(C)(C)C1 ZINC001538309505 1055596768 /nfs/dbraw/zinc/59/67/68/1055596768.db2.gz AKMCBELKSSFUCL-QGZVFWFLSA-N 0 1 322.537 4.028 20 0 DIADMN COc1ccc(C(F)(F)F)c(CN(C)Cc2ccsc2)c1 ZINC001238058678 1055599078 /nfs/dbraw/zinc/59/90/78/1055599078.db2.gz MILBCPWLGFWBFY-UHFFFAOYSA-N 0 1 315.360 4.408 20 0 DIADMN CCOc1cc(CN2CC[C@](CF)(C(F)(F)F)C2)ccc1C ZINC001238069991 1055601024 /nfs/dbraw/zinc/60/10/24/1055601024.db2.gz ZSPMZKXYVGGFKK-OAHLLOKOSA-N 0 1 319.342 4.118 20 0 DIADMN Cc1ccc(O)cc1CN(C)Cc1ccccc1C(F)(F)F ZINC001238094757 1055606212 /nfs/dbraw/zinc/60/62/12/1055606212.db2.gz AOULLUPRGWDQFY-UHFFFAOYSA-N 0 1 309.331 4.351 20 0 DIADMN CC(C)(C)c1nc(CSc2nc3ccc(Cl)cc3[nH]2)no1 ZINC000028007394 1055607469 /nfs/dbraw/zinc/60/74/69/1055607469.db2.gz YOUUCXRCUAACSW-UHFFFAOYSA-N 0 1 322.821 4.189 20 0 DIADMN CC[N@H+](Cc1cccc(OC)c1)Cc1cc(Cl)c([O-])cc1F ZINC001238148859 1055611151 /nfs/dbraw/zinc/61/11/51/1055611151.db2.gz CNYAGVTZZRLQQZ-UHFFFAOYSA-N 0 1 323.795 4.215 20 0 DIADMN CC[N@@H+](Cc1cccc(OC)c1)Cc1cc(Cl)c([O-])cc1F ZINC001238148859 1055611157 /nfs/dbraw/zinc/61/11/57/1055611157.db2.gz CNYAGVTZZRLQQZ-UHFFFAOYSA-N 0 1 323.795 4.215 20 0 DIADMN Cc1ccc([C@H]2CCCN2Cc2cc(Cl)c(O)cc2F)cn1 ZINC001238149677 1055611766 /nfs/dbraw/zinc/61/17/66/1055611766.db2.gz MCCZANXGWPYXBH-MRXNPFEDSA-N 0 1 320.795 4.225 20 0 DIADMN Cc1cc(C(=O)[O-])ccc1C[N@H+](C)C12CC3CC(CC(C3)C1)C2 ZINC001238139458 1055612188 /nfs/dbraw/zinc/61/21/88/1055612188.db2.gz MDDDBEDODULUPF-UHFFFAOYSA-N 0 1 313.441 4.094 20 0 DIADMN Cc1ccc(O[C@@H]2CCCN(Cc3cncc(C4CC4)c3)C2)cc1 ZINC001238185136 1055613866 /nfs/dbraw/zinc/61/38/66/1055613866.db2.gz POSKWFPXZNZARQ-OAQYLSRUSA-N 0 1 322.452 4.311 20 0 DIADMN [O-]c1cc(F)c(C[N@@H+]2CC[C@H](c3cccc(F)c3)C2)cc1Cl ZINC001238150708 1055614500 /nfs/dbraw/zinc/61/45/00/1055614500.db2.gz XTEVSPOEQRWZHE-LBPRGKRZSA-N 0 1 323.770 4.313 20 0 DIADMN [O-]c1cc(F)c(C[N@H+]2CC[C@H](c3cccc(F)c3)C2)cc1Cl ZINC001238150708 1055614507 /nfs/dbraw/zinc/61/45/07/1055614507.db2.gz XTEVSPOEQRWZHE-LBPRGKRZSA-N 0 1 323.770 4.313 20 0 DIADMN Cc1cccc(OC2CCN(Cc3cncc(C4CC4)c3)CC2)c1 ZINC001238187595 1055614987 /nfs/dbraw/zinc/61/49/87/1055614987.db2.gz CZBRAJSDEIYQJZ-UHFFFAOYSA-N 0 1 322.452 4.311 20 0 DIADMN Cc1ccc(C[N@@H+](C)Cc2cc(Cl)c([O-])cc2F)cc1C ZINC001238157437 1055615551 /nfs/dbraw/zinc/61/55/51/1055615551.db2.gz WZZXDROADZRHCD-UHFFFAOYSA-N 0 1 307.796 4.434 20 0 DIADMN Cc1ccc(C[N@H+](C)Cc2cc(Cl)c([O-])cc2F)cc1C ZINC001238157437 1055615556 /nfs/dbraw/zinc/61/55/56/1055615556.db2.gz WZZXDROADZRHCD-UHFFFAOYSA-N 0 1 307.796 4.434 20 0 DIADMN CC[N@H+](Cc1ccc(OC)cc1)Cc1cc(Cl)c([O-])cc1F ZINC001238150455 1055615840 /nfs/dbraw/zinc/61/58/40/1055615840.db2.gz VDAPHXRMMFYOQS-UHFFFAOYSA-N 0 1 323.795 4.215 20 0 DIADMN CC[N@@H+](Cc1ccc(OC)cc1)Cc1cc(Cl)c([O-])cc1F ZINC001238150455 1055615846 /nfs/dbraw/zinc/61/58/46/1055615846.db2.gz VDAPHXRMMFYOQS-UHFFFAOYSA-N 0 1 323.795 4.215 20 0 DIADMN c1ccc(CO[C@@H]2CCCN(Cc3cncc(C4CC4)c3)C2)cc1 ZINC001238192518 1055617712 /nfs/dbraw/zinc/61/77/12/1055617712.db2.gz FZCLMXDAGXUVFY-OAQYLSRUSA-N 0 1 322.452 4.140 20 0 DIADMN Cc1nc2c(cccc2C(=O)N2CCC[C@@H]2c2ccccc2C)[nH]1 ZINC000338552377 1055617938 /nfs/dbraw/zinc/61/79/38/1055617938.db2.gz QISDMZMTULKXFF-GOSISDBHSA-N 0 1 319.408 4.157 20 0 DIADMN Cc1ccc(NC(=O)CN(C)CC2CCCCC2)c(Cl)c1 ZINC000029455025 1055618726 /nfs/dbraw/zinc/61/87/26/1055618726.db2.gz UEPFZWIBHXFESA-UHFFFAOYSA-N 0 1 308.853 4.099 20 0 DIADMN Cc1c(C)c(CN2CCc3cc(CO)ccc3C2)ccc1Cl ZINC001238212525 1055620578 /nfs/dbraw/zinc/62/05/78/1055620578.db2.gz AWWYQMYBQJBZJB-UHFFFAOYSA-N 0 1 315.844 4.007 20 0 DIADMN Cc1c(C)c(CN(CCO)Cc2cccs2)ccc1Cl ZINC001238213420 1055620789 /nfs/dbraw/zinc/62/07/89/1055620789.db2.gz JPKXLTXZGKJAGD-UHFFFAOYSA-N 0 1 309.862 4.013 20 0 DIADMN CC(C)c1cc(CN2CCC[C@]3(CCC(=O)O3)C2)ccc1Cl ZINC001238225098 1055624265 /nfs/dbraw/zinc/62/42/65/1055624265.db2.gz JAIBJPHEXNMDAN-SFHVURJKSA-N 0 1 321.848 4.135 20 0 DIADMN CCOC(=O)C1(C)CCN(Cc2ccc(Cl)c(C)c2C)CC1 ZINC001238220982 1055624289 /nfs/dbraw/zinc/62/42/89/1055624289.db2.gz ZZHPRNVYSZFXFS-UHFFFAOYSA-N 0 1 323.864 4.122 20 0 DIADMN CC(C)C[C@@H](C)C(=O)Nc1nc2cc(Cl)cc(Cl)c2[nH]1 ZINC001595733439 1055625406 /nfs/dbraw/zinc/62/54/06/1055625406.db2.gz BLYUYIUQEYHRQL-MRVPVSSYSA-N 0 1 314.216 4.490 20 0 DIADMN CC[C@H]1CCCN(CC(=O)Nc2ccccc2-c2ccccc2)C1 ZINC000030142225 1055626506 /nfs/dbraw/zinc/62/65/06/1055626506.db2.gz OCKVVYPMDVFPFE-KRWDZBQOSA-N 0 1 322.452 4.414 20 0 DIADMN C[N@@H+](Cc1ccc2ccccc2c1)Cc1ccc(F)cc1C(=O)[O-] ZINC001238241900 1055626679 /nfs/dbraw/zinc/62/66/79/1055626679.db2.gz MKYWXJPFRHKULQ-UHFFFAOYSA-N 0 1 323.367 4.309 20 0 DIADMN 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CN(C)Cc1cc(N[C@H]2CCOC3(CCCC3)C2)ccc1Cl ZINC001474479782 1062157923 /nfs/dbraw/zinc/15/79/23/1062157923.db2.gz RDYZLTYIKUHMPH-INIZCTEOSA-N 0 1 322.880 4.305 20 0 DIADMN O=C(OCc1ccccc1)[C@@H]1CCCN1CCCC1CCCC1 ZINC001459473155 1062159020 /nfs/dbraw/zinc/15/90/20/1062159020.db2.gz FHRYKVLOVQWAEG-IBGZPJMESA-N 0 1 315.457 4.165 20 0 DIADMN CCOC(=O)[C@@H](c1ccccc1)N1CCC[C@@]2(CC=CCC2)C1 ZINC001459473891 1062159415 /nfs/dbraw/zinc/15/94/15/1062159415.db2.gz HBDQNFMXXKFWJE-QUCCMNQESA-N 0 1 313.441 4.113 20 0 DIADMN Cc1ccc2nc(-c3nnc([C@H]4C[C@@H]4c4ccccc4)o3)[nH]c2c1 ZINC001254529938 1062159355 /nfs/dbraw/zinc/15/93/55/1062159355.db2.gz UPHRTBLRPNMPEX-KGLIPLIRSA-N 0 1 316.364 4.192 20 0 DIADMN CC[C@H](C)CN(C)Cc1nnc(-c2cccc3ccccc32)o1 ZINC001459488195 1062165701 /nfs/dbraw/zinc/16/57/01/1062165701.db2.gz LUQYOPGNTYYQNM-AWEZNQCLSA-N 0 1 309.413 4.368 20 0 DIADMN Cc1cc(C(F)(F)F)ccc1CN1CCO[C@H](C(C)(C)C)C1 ZINC001474492530 1062169907 /nfs/dbraw/zinc/16/99/07/1062169907.db2.gz 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CCOC1CC(N(C)Cc2ccc(Oc3ccccc3)o2)C1 ZINC001474553817 1062252912 /nfs/dbraw/zinc/25/29/12/1062252912.db2.gz XWOSJNNUUNYHPN-UHFFFAOYSA-N 0 1 301.386 4.071 20 0 DIADMN CC(C)c1ccc(-c2nnc(-c3ccc4cncn4c3)o2)cc1 ZINC001254829852 1062256111 /nfs/dbraw/zinc/25/61/11/1062256111.db2.gz DWLGOTKNWKXCCY-UHFFFAOYSA-N 0 1 304.353 4.175 20 0 DIADMN CC(C)c1ccc(-c2nnc(Cc3ccc4nc[nH]c4c3)o2)cc1 ZINC001254858547 1062266088 /nfs/dbraw/zinc/26/60/88/1062266088.db2.gz VIUNBMWAXKNSSV-UHFFFAOYSA-N 0 1 318.380 4.327 20 0 DIADMN CCSCc1ccc(NC(=O)c2cccc3nc[nH]c32)cc1 ZINC001468138432 1062268087 /nfs/dbraw/zinc/26/80/87/1062268087.db2.gz SHAFTZYQVFOIAL-UHFFFAOYSA-N 0 1 311.410 4.068 20 0 DIADMN FC(F)n1cccc1CN1CCC(OC2CCCCC2)CC1 ZINC001474564466 1062268529 /nfs/dbraw/zinc/26/85/29/1062268529.db2.gz JCWAJOWXBIATPQ-UHFFFAOYSA-N 0 1 312.404 4.197 20 0 DIADMN CC[C@@H]1CN(Cc2cccc(C)c2Br)CCS1 ZINC001459639537 1062271019 /nfs/dbraw/zinc/27/10/19/1062271019.db2.gz HLWKXISDPFKNIR-CYBMUJFWSA-N 0 1 314.292 4.085 20 0 DIADMN COc1ccc(C[C@@H]2CCN2[C@@H](C)c2c(F)cccc2F)cc1 ZINC001459650402 1062273709 /nfs/dbraw/zinc/27/37/09/1062273709.db2.gz HARGLECAQZPURW-ZFWWWQNUSA-N 0 1 317.379 4.351 20 0 DIADMN COc1ccc(C[C@@H]2CCN2[C@H](C)c2c(F)cccc2F)cc1 ZINC001459650389 1062273761 /nfs/dbraw/zinc/27/37/61/1062273761.db2.gz HARGLECAQZPURW-HIFRSBDPSA-N 0 1 317.379 4.351 20 0 DIADMN C[C@@H]1N(CCCOc2ccc3ccccc3c2)CCOC1(C)C ZINC001459644442 1062274070 /nfs/dbraw/zinc/27/40/70/1062274070.db2.gz BSJCZGBEYMSJIT-INIZCTEOSA-N 0 1 313.441 4.108 20 0 DIADMN Fc1cccc(/C=C\CN2CC(Cc3ccc(F)c(F)c3)C2)c1 ZINC001474569525 1062274549 /nfs/dbraw/zinc/27/45/49/1062274549.db2.gz CMJAVYODEFCHNY-RQOWECAXSA-N 0 1 317.354 4.292 20 0 DIADMN COc1ccc(C[C@H]2CCN2[C@H](C)c2cc(F)ccc2F)cc1 ZINC001459649851 1062275448 /nfs/dbraw/zinc/27/54/48/1062275448.db2.gz GCBHFFVOIORSPT-CZUORRHYSA-N 0 1 317.379 4.351 20 0 DIADMN CC(C)c1nnc(CNC[C@H]2[C@H](c3ccccc3)C2(C)C)s1 ZINC001474571220 1062279027 /nfs/dbraw/zinc/27/90/27/1062279027.db2.gz 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CC1(C)CCC[C@@H]1[C@@H]1CCN(Cc2c(F)ccc(O)c2F)C1 ZINC001474593930 1062309794 /nfs/dbraw/zinc/30/97/94/1062309794.db2.gz BPIVHTITDJOECB-TZMCWYRMSA-N 0 1 309.400 4.319 20 0 DIADMN COC(=O)c1cnc([C@H](C)N2CCC[C@H]2CC2CCCC2)s1 ZINC001474605185 1062320028 /nfs/dbraw/zinc/32/00/28/1062320028.db2.gz IWFIJGUETPIDCL-JSGCOSHPSA-N 0 1 322.474 4.035 20 0 DIADMN C[C@H]1CCCC[C@@H]1C[NH+]1CCC(C(=O)c2ccc([O-])cc2)CC1 ZINC001459706578 1062324106 /nfs/dbraw/zinc/32/41/06/1062324106.db2.gz AMDXLIPOUASXAP-MAUKXSAKSA-N 0 1 315.457 4.113 20 0 DIADMN Oc1ccc2c(c1)CN(CCSc1cccc(Cl)c1)CC2 ZINC001459712209 1062327785 /nfs/dbraw/zinc/32/77/85/1062327785.db2.gz ZXONBPOLICHXOV-UHFFFAOYSA-N 0 1 319.857 4.196 20 0 DIADMN C[C@@H]1c2ccccc2OCCN1C[C@@H]1CC[C@H](c2ccccc2)O1 ZINC001459720507 1062332474 /nfs/dbraw/zinc/33/24/74/1062332474.db2.gz RNZRVNIZMVTQHF-IMFGXOCKSA-N 0 1 323.436 4.362 20 0 DIADMN CCc1ccc(C)nc1N[C@H](C)Cc1ccc(OC)c(OC)c1 ZINC001474626210 1062346554 /nfs/dbraw/zinc/34/65/54/1062346554.db2.gz 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ZINC001474669329 1062398756 /nfs/dbraw/zinc/39/87/56/1062398756.db2.gz ZKLLNIYMRREYBK-UHFFFAOYSA-N 0 1 311.425 4.116 20 0 DIADMN C[C@H](CSc1ccccc1)C(=O)Nc1ccc(F)c(F)c1O ZINC001468787991 1062400180 /nfs/dbraw/zinc/40/01/80/1062400180.db2.gz BJAPAAZLGZGGKV-SNVBAGLBSA-N 0 1 323.364 4.037 20 0 DIADMN C[C@H](CCCc1ccccc1)C(=O)Nc1ccc(F)c(F)c1O ZINC001468789983 1062401594 /nfs/dbraw/zinc/40/15/94/1062401594.db2.gz SDYCKFSHAOXDGL-GFCCVEGCSA-N 0 1 319.351 4.268 20 0 DIADMN O=C(Nc1ccc(F)c(F)c1O)[C@@H]1CCC[C@H]1c1ccccc1 ZINC001468789559 1062402516 /nfs/dbraw/zinc/40/25/16/1062402516.db2.gz QCPYVOWUIJKWLE-QWHCGFSZSA-N 0 1 317.335 4.193 20 0 DIADMN COCC[C@H](c1ccccc1)N1CCc2c(F)cc(F)cc2C1 ZINC001459796458 1062405574 /nfs/dbraw/zinc/40/55/74/1062405574.db2.gz KLQNGIDTCOWVHG-LJQANCHMSA-N 0 1 317.379 4.101 20 0 DIADMN FC(F)c1cccc(CNCc2cnc([C@H]3CCCO3)s2)c1 ZINC001255361899 1062414430 /nfs/dbraw/zinc/41/44/30/1062414430.db2.gz YZDLUFOWQXFBRI-CQSZACIVSA-N 0 1 324.396 4.222 20 0 DIADMN COC1(CN2CCc3cc(F)c(F)cc3C2)CCCCCC1 ZINC001474685646 1062416206 /nfs/dbraw/zinc/41/62/06/1062416206.db2.gz XCEMHOGDMQEMRG-UHFFFAOYSA-N 0 1 309.400 4.062 20 0 DIADMN CCCCCc1cc(C(=O)N(CC2CCCCC2)OCC)[nH]n1 ZINC001468873431 1062423839 /nfs/dbraw/zinc/42/38/39/1062423839.db2.gz PLUFNLZFTHJWJI-UHFFFAOYSA-N 0 1 321.465 4.116 20 0 DIADMN C[C@@H](NCc1ccccc1N(C)C)c1cc(Cl)ccc1F ZINC001459819723 1062425838 /nfs/dbraw/zinc/42/58/38/1062425838.db2.gz ZJHTWKKAPFSRIR-GFCCVEGCSA-N 0 1 306.812 4.396 20 0 DIADMN COC[C@H](CC(C)(C)C)NCc1coc(-c2ccc(C)cc2)n1 ZINC001474700852 1062430013 /nfs/dbraw/zinc/43/00/13/1062430013.db2.gz AIJKJGBWTNZPLO-INIZCTEOSA-N 0 1 316.445 4.191 20 0 DIADMN CCC[C@H](C)CCCN1CCN(CC(F)(F)F)CC1(C)C ZINC001459833988 1062436202 /nfs/dbraw/zinc/43/62/02/1062436202.db2.gz JKMAMBLOOPAONM-AWEZNQCLSA-N 0 1 308.432 4.161 20 0 DIADMN Oc1cccc(CN2C[C@@H]3CCC[C@]3(C(F)(F)F)C2)c1Cl ZINC001474710069 1062436433 /nfs/dbraw/zinc/43/64/33/1062436433.db2.gz IETUZUIHLVIXBD-FZMZJTMJSA-N 0 1 319.754 4.210 20 0 DIADMN [O-]c1ccc(C[NH+]2CCC(CCc3ccccc3)CC2)cc1F ZINC001474710742 1062437111 /nfs/dbraw/zinc/43/71/11/1062437111.db2.gz OZDZKMBEHPNWIF-UHFFFAOYSA-N 0 1 313.416 4.376 20 0 DIADMN C[C@H](N[C@@H](c1ccc(F)cc1F)C1CC1)c1ccc(F)nc1 ZINC001459838574 1062438594 /nfs/dbraw/zinc/43/85/94/1062438594.db2.gz RDXDAUYHUFYBPX-DYZYQPBXSA-N 0 1 306.331 4.301 20 0 DIADMN C[C@@H](N[C@H](c1ccc(F)cc1F)C1CC1)c1ccc(F)nc1 ZINC001459838575 1062438611 /nfs/dbraw/zinc/43/86/11/1062438611.db2.gz RDXDAUYHUFYBPX-QGHHPUGFSA-N 0 1 306.331 4.301 20 0 DIADMN COc1nscc1CN[C@H](c1ccc(Cl)cc1)C1CCC1 ZINC001459847857 1062446422 /nfs/dbraw/zinc/44/64/22/1062446422.db2.gz DKIDYVFKPWTGBT-HNNXBMFYSA-N 0 1 322.861 4.436 20 0 DIADMN [O-]c1cc(F)c(CC[NH2+][C@@H]2CCC[C@@H]2c2ccccc2)c(F)c1 ZINC001474722586 1062447924 /nfs/dbraw/zinc/44/79/24/1062447924.db2.gz ZZWRFDSKJJJYIY-DNVCBOLYSA-N 0 1 317.379 4.139 20 0 DIADMN COc1cc(CN2CCc3ccsc3C2)cc2ccccc21 ZINC001474735743 1062454044 /nfs/dbraw/zinc/45/40/44/1062454044.db2.gz 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