smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name CC(C)c1cccc(C(C)C)c1NC(=O)NCCc1ccccc1 ZINC000000011347 340332093 /nfs/dbraw/zinc/33/20/93/340332093.db2.gz DOJADQQAERAIIA-UHFFFAOYSA-N 0 0 324.468 5.298 20 0 DKADRN CCc1cccc(C)c1NC(=O)c1cccc(Cl)c1Cl ZINC000000513686 340618395 /nfs/dbraw/zinc/61/83/95/340618395.db2.gz YOGNIPHDRKFYCJ-UHFFFAOYSA-N 0 0 308.208 5.117 20 0 DKADRN CCCC(=O)Nc1ccc(-c2csc(-c3ccccc3)n2)cc1 ZINC000000577313 180825106 /nfs/dbraw/zinc/82/51/06/180825106.db2.gz KGLQJAQDVRCGOS-UHFFFAOYSA-N 0 0 322.433 5.216 20 0 DKADRN Cc1c(Cl)cccc1NC(=O)c1cc(Cl)ccc1Cl ZINC000000577908 180825630 /nfs/dbraw/zinc/82/56/30/180825630.db2.gz OHGCVAJMNKUKKX-UHFFFAOYSA-N 0 0 314.599 5.208 20 0 DKADRN Cc1cc(C)c(NC(=O)c2cc(Cl)ccc2Cl)c(C)c1 ZINC000000577960 180825817 /nfs/dbraw/zinc/82/58/17/180825817.db2.gz OZFBQGVVRMCBPB-UHFFFAOYSA-N 0 0 308.208 5.171 20 0 DKADRN CCc1cccc(CC)c1NC(=O)CCc1cccc(Cl)c1 ZINC000001285048 180853360 /nfs/dbraw/zinc/85/33/60/180853360.db2.gz XYSIBRGGJYPHRM-UHFFFAOYSA-N 0 0 315.844 5.036 20 0 DKADRN Cc1ccccc1NC(=O)c1ccc(Oc2ccccc2)cc1 ZINC000003481527 181025264 /nfs/dbraw/zinc/02/52/64/181025264.db2.gz XDODUMVJJPLFAG-UHFFFAOYSA-N 0 0 303.361 5.040 20 0 DKADRN CCc1cccc(C)c1NC(=O)c1cc(Cl)cc(Cl)c1 ZINC000003548642 181033181 /nfs/dbraw/zinc/03/31/81/181033181.db2.gz OIFKMUCNGBYYCI-UHFFFAOYSA-N 0 0 308.208 5.117 20 0 DKADRN CC(C)c1ccccc1NC(=O)c1cccc(C(F)(F)F)c1 ZINC000003561205 181034730 /nfs/dbraw/zinc/03/47/30/181034730.db2.gz YPCPOUTWCPALCJ-UHFFFAOYSA-N 0 0 307.315 5.081 20 0 DKADRN Cc1cccc(C(C)C)c1NC(=O)c1ccc(F)cc1Cl ZINC000003592103 181037771 /nfs/dbraw/zinc/03/77/71/181037771.db2.gz JGIURLZUUKFMQB-UHFFFAOYSA-N 0 0 305.780 5.163 20 0 DKADRN Cc1cc(C(=O)Nc2c(C)cccc2C(C)C)c2ccccc2n1 ZINC000003592117 340628164 /nfs/dbraw/zinc/62/81/64/340628164.db2.gz JXRQQTPMBSGCRK-UHFFFAOYSA-N 0 0 318.420 5.227 20 0 DKADRN O=C(Nc1cccs1)Nc1cc(C(F)(F)F)ccc1Cl ZINC000005135551 181208185 /nfs/dbraw/zinc/20/81/85/181208185.db2.gz UFNVREMXCZESMY-UHFFFAOYSA-N 0 0 320.723 5.064 20 0 DKADRN O=C(Nc1ccc(Cl)cc1Cl)C12CC3CC(CC(C3)C1)C2 ZINC000005170603 181213335 /nfs/dbraw/zinc/21/33/35/181213335.db2.gz SOJGZPSDQIWXIB-UHFFFAOYSA-N 0 0 324.251 5.148 20 0 DKADRN C[C@H](Sc1ccccc1Cl)c1nnc(-c2ccccc2)o1 ZINC000005281252 181225658 /nfs/dbraw/zinc/22/56/58/181225658.db2.gz QLAXEMGEZRMXLK-NSHDSACASA-N 0 0 316.813 5.243 20 0 DKADRN C[C@@H](Sc1ccccc1Cl)c1nnc(-c2ccccc2)o1 ZINC000005281253 181225706 /nfs/dbraw/zinc/22/57/06/181225706.db2.gz QLAXEMGEZRMXLK-LLVKDONJSA-N 0 0 316.813 5.243 20 0 DKADRN Cc1ccc(NC(=S)Nc2cccc3ccccc32)cc1C ZINC000005337662 181231060 /nfs/dbraw/zinc/23/10/60/181231060.db2.gz ONNHYWMDVMTQGP-UHFFFAOYSA-N 0 0 306.434 5.266 20 0 DKADRN S=C(Nc1cccc(Cl)c1)Nc1cccc2ccccc21 ZINC000005338629 181231849 /nfs/dbraw/zinc/23/18/49/181231849.db2.gz YBBRGDZGMZHYCL-UHFFFAOYSA-N 0 0 312.825 5.302 20 0 DKADRN S=C(Nc1ccccc1Cl)Nc1cccc2ccccc21 ZINC000005338631 181231519 /nfs/dbraw/zinc/23/15/19/181231519.db2.gz SSIYJFHYLVUCKJ-UHFFFAOYSA-N 0 0 312.825 5.302 20 0 DKADRN Cc1cccc(C(C)C)c1NC(=O)c1ccc2ccccc2c1 ZINC000005443044 181244217 /nfs/dbraw/zinc/24/42/17/181244217.db2.gz ISTANONCICPFBX-UHFFFAOYSA-N 0 0 303.405 5.524 20 0 DKADRN Cc1cccc(C(C)C)c1NC(=O)c1cnc(Cl)c(Cl)c1 ZINC000005443057 181244277 /nfs/dbraw/zinc/24/42/77/181244277.db2.gz BFUXWZFEJYYSFW-UHFFFAOYSA-N 0 0 323.223 5.073 20 0 DKADRN Cc1cc(C)cc(C(=O)Nc2ccccc2-c2ccccc2)c1 ZINC000005456074 181245602 /nfs/dbraw/zinc/24/56/02/181245602.db2.gz IJVTXSCZFSOSRQ-UHFFFAOYSA-N 0 0 301.389 5.223 20 0 DKADRN Cc1ccc(NC(=O)c2c(Cl)cccc2Cl)cc1Cl ZINC000005547233 181255581 /nfs/dbraw/zinc/25/55/81/181255581.db2.gz DEKDDCREMQQIIH-UHFFFAOYSA-N 0 0 314.599 5.208 20 0 DKADRN Cc1c2cccc(Cl)c2oc1C(=O)Nc1cccc(C)c1C ZINC000005558478 181257015 /nfs/dbraw/zinc/25/70/15/181257015.db2.gz OHCLVXHZLCARDY-UHFFFAOYSA-N 0 0 313.784 5.264 20 0 DKADRN Cc1cccc(NC(=O)c2ccccc2Oc2ccccc2)c1C ZINC000005558541 181256943 /nfs/dbraw/zinc/25/69/43/181256943.db2.gz SXHZKAZXZARDQM-UHFFFAOYSA-N 0 0 317.388 5.348 20 0 DKADRN CCc1ccc(Cl)c(CC)c1NC(=O)c1ccccc1Cl ZINC000005610705 181263408 /nfs/dbraw/zinc/26/34/08/181263408.db2.gz ONALAHGMTHWZPU-UHFFFAOYSA-N 0 0 322.235 5.371 20 0 DKADRN CCc1ccc(Cl)c(CC)c1NC(=O)c1ccc(Cl)cc1 ZINC000005610750 181263529 /nfs/dbraw/zinc/26/35/29/181263529.db2.gz DVPYQKDUOITNJN-UHFFFAOYSA-N 0 0 322.235 5.371 20 0 DKADRN CCc1ccc(Cl)c(CC)c1NC(=O)CCc1ccccc1 ZINC000005610853 181263514 /nfs/dbraw/zinc/26/35/14/181263514.db2.gz DAQHMOZUZKABCA-UHFFFAOYSA-N 0 0 315.844 5.036 20 0 DKADRN CCc1ccc(Cl)c(CC)c1NC(=O)c1ccc(C)cc1 ZINC000005610863 181263286 /nfs/dbraw/zinc/26/32/86/181263286.db2.gz QUSNOKVQNDWWAM-UHFFFAOYSA-N 0 0 301.817 5.026 20 0 DKADRN CCc1ccc(C(=O)Nc2c(CC)ccc(Cl)c2CC)cc1 ZINC000005610904 181263427 /nfs/dbraw/zinc/26/34/27/181263427.db2.gz IAVHXKUWLWXGMB-UHFFFAOYSA-N 0 0 315.844 5.280 20 0 DKADRN Cc1cc(F)ccc1NC(=O)c1cccc(Oc2ccccc2)c1 ZINC000005617676 181264633 /nfs/dbraw/zinc/26/46/33/181264633.db2.gz JTFFPVZXRMDXQC-UHFFFAOYSA-N 0 0 321.351 5.179 20 0 DKADRN Cc1ccc2c(c1)sc(C(=O)N(C(C)C)C(C)C)c2Cl ZINC000005619069 181264378 /nfs/dbraw/zinc/26/43/78/181264378.db2.gz ZGLVOPYRKGTYNT-UHFFFAOYSA-N 0 0 309.862 5.122 20 0 DKADRN Cc1ccc2c(Cl)c(C(=O)Nc3ccccc3F)sc2c1 ZINC000005619211 181264316 /nfs/dbraw/zinc/26/43/16/181264316.db2.gz NXUWVUNJIUWIHZ-UHFFFAOYSA-N 0 0 319.788 5.255 20 0 DKADRN c1ccc2sc(CSc3ccc4ccccc4n3)nc2c1 ZINC000005626749 181265561 /nfs/dbraw/zinc/26/55/61/181265561.db2.gz CKPXXDQWPRYGOL-UHFFFAOYSA-N 0 0 308.431 5.137 20 0 DKADRN COc1ccc2oc(C(=O)Nc3ccc(C(C)C)cc3)c(C)c2c1 ZINC000005638312 181267385 /nfs/dbraw/zinc/26/73/85/181267385.db2.gz MPPJJOLBMPLWAN-UHFFFAOYSA-N 0 0 323.392 5.126 20 0 DKADRN CCCOc1cccc(C(=O)Nc2ccc(Cl)cc2Cl)c1 ZINC000005671991 181270131 /nfs/dbraw/zinc/27/01/31/181270131.db2.gz PFBKYGVTFYCJKH-UHFFFAOYSA-N 0 0 324.207 5.035 20 0 DKADRN COc1ccc2oc(C(=O)Nc3ccccc3C(C)C)c(C)c2c1 ZINC000005672809 181270105 /nfs/dbraw/zinc/27/01/05/181270105.db2.gz JGXSWWUCTSPWNQ-UHFFFAOYSA-N 0 0 323.392 5.126 20 0 DKADRN CC(C)c1ccccc1NC(=O)Cc1cccc2ccccc21 ZINC000005673023 181270258 /nfs/dbraw/zinc/27/02/58/181270258.db2.gz QZKCUOUNMQVQHL-UHFFFAOYSA-N 0 0 303.405 5.144 20 0 DKADRN CC(C)c1ccccc1NC(=O)Cc1ccc(Cl)cc1Cl ZINC000005673161 181270019 /nfs/dbraw/zinc/27/00/19/181270019.db2.gz DXABRAFBJOVTIK-UHFFFAOYSA-N 0 0 322.235 5.298 20 0 DKADRN CCC[C@H](C(=O)Nc1ccc(Cl)cc1F)c1ccccc1 ZINC000005688052 181272833 /nfs/dbraw/zinc/27/28/33/181272833.db2.gz ZCKOJIVRUPKLGG-AWEZNQCLSA-N 0 0 305.780 5.002 20 0 DKADRN CCC[C@@H](C(=O)Nc1ccc(Cl)cc1F)c1ccccc1 ZINC000005688054 181272783 /nfs/dbraw/zinc/27/27/83/181272783.db2.gz ZCKOJIVRUPKLGG-CQSZACIVSA-N 0 0 305.780 5.002 20 0 DKADRN Cc1ccc(F)cc1NC(=O)c1ccc(Oc2ccccc2)cc1 ZINC000005698854 181274069 /nfs/dbraw/zinc/27/40/69/181274069.db2.gz QOVHUCDKPIVORY-UHFFFAOYSA-N 0 0 321.351 5.179 20 0 DKADRN Cc1ccc(NC(=O)c2c(Cl)ccc(Cl)c2Cl)cc1 ZINC000005746005 181279854 /nfs/dbraw/zinc/27/98/54/181279854.db2.gz PNYCPSQIKHGJTO-UHFFFAOYSA-N 0 0 314.599 5.208 20 0 DKADRN Cc1cccc(NC(=O)c2c(Cl)ccc(Cl)c2Cl)c1 ZINC000005747930 181280007 /nfs/dbraw/zinc/28/00/07/181280007.db2.gz YDZQJZZAPGKECL-UHFFFAOYSA-N 0 0 314.599 5.208 20 0 DKADRN Cc1cccc(C(C)C)c1NC(=O)c1ccc(Cl)c(Cl)c1 ZINC000005756061 181281077 /nfs/dbraw/zinc/28/10/77/181281077.db2.gz RTJKCOFRZZBRCJ-UHFFFAOYSA-N 0 0 322.235 5.678 20 0 DKADRN O=C(Nc1ccccc1F)c1c(Cl)ccc(Cl)c1Cl ZINC000005772012 181281995 /nfs/dbraw/zinc/28/19/95/181281995.db2.gz SJXKMBGDHROCEZ-UHFFFAOYSA-N 0 0 318.562 5.038 20 0 DKADRN c1ccc(-c2nnc(CSc3ccc4ccccc4c3)o2)cc1 ZINC000005775908 181282812 /nfs/dbraw/zinc/28/28/12/181282812.db2.gz QEUKFQJEBDQDFA-UHFFFAOYSA-N 0 0 318.401 5.182 20 0 DKADRN Cc1ccc(C(=O)Nc2ccccc2-c2ccccc2)cc1Cl ZINC000005795320 181284978 /nfs/dbraw/zinc/28/49/78/181284978.db2.gz REWGNHYSRKFKKM-UHFFFAOYSA-N 0 0 321.807 5.568 20 0 DKADRN Cc1ccc(NC(=S)Nc2ccc3ccccc3c2)cc1C ZINC000005896926 181293684 /nfs/dbraw/zinc/29/36/84/181293684.db2.gz SCASEOMFHISHAI-UHFFFAOYSA-N 0 0 306.434 5.266 20 0 DKADRN C/C(=C\C(=O)Nc1ccccc1-c1ccccc1)c1ccccc1 ZINC000005909177 181295104 /nfs/dbraw/zinc/29/51/04/181295104.db2.gz LRGLCDBYTSJOPS-WUKNDPDISA-N 0 0 313.400 5.396 20 0 DKADRN C[C@H](Sc1ncnc2sc3c(c21)CCC3)c1ccccc1 ZINC000006112367 181313319 /nfs/dbraw/zinc/31/33/19/181313319.db2.gz TUGLKFBDFBCQCE-NSHDSACASA-N 0 0 312.463 5.033 20 0 DKADRN C[C@@H](Sc1ncnc2sc3c(c21)CCC3)c1ccccc1 ZINC000006112370 181313402 /nfs/dbraw/zinc/31/34/02/181313402.db2.gz TUGLKFBDFBCQCE-LLVKDONJSA-N 0 0 312.463 5.033 20 0 DKADRN C[C@H](Sc1ncnc2sccc21)c1ccccc1Cl ZINC000006115683 181313458 /nfs/dbraw/zinc/31/34/58/181313458.db2.gz HTFXLUANUCQZPS-VIFPVBQESA-N 0 0 306.843 5.198 20 0 DKADRN C[C@@H](Sc1ncnc2sccc21)c1ccccc1Cl ZINC000006115684 181313222 /nfs/dbraw/zinc/31/32/22/181313222.db2.gz HTFXLUANUCQZPS-SECBINFHSA-N 0 0 306.843 5.198 20 0 DKADRN Cc1ccc(-c2nnc(S[C@@H](C)c3ccc(F)cc3)o2)cc1 ZINC000006148357 181316942 /nfs/dbraw/zinc/31/69/42/181316942.db2.gz ZYCYGAIKNZLIHY-LBPRGKRZSA-N 0 0 314.385 5.037 20 0 DKADRN Cc1ccc(-c2nnc(S[C@H](C)c3ccc(F)cc3)o2)cc1 ZINC000006148358 181316940 /nfs/dbraw/zinc/31/69/40/181316940.db2.gz ZYCYGAIKNZLIHY-GFCCVEGCSA-N 0 0 314.385 5.037 20 0 DKADRN CC(C)(C)c1ccc(NC(=O)c2ccc(F)cc2Cl)cc1 ZINC000006214649 181320016 /nfs/dbraw/zinc/32/00/16/181320016.db2.gz NIZYWVHHKJMJNB-UHFFFAOYSA-N 0 0 305.780 5.029 20 0 DKADRN Cc1ccccc1NC(=O)c1c(Cl)ccc(Cl)c1Cl ZINC000006218350 181320183 /nfs/dbraw/zinc/32/01/83/181320183.db2.gz CSMCNWGCBUARRT-UHFFFAOYSA-N 0 0 314.599 5.208 20 0 DKADRN O=C(Nc1ccc(F)cc1)c1c(Cl)ccc(Cl)c1Cl ZINC000006221771 181320911 /nfs/dbraw/zinc/32/09/11/181320911.db2.gz VELLWDDVPFBMHX-UHFFFAOYSA-N 0 0 318.562 5.038 20 0 DKADRN CCc1ccc(Cl)c(CC)c1NC(=O)c1cccc(Cl)c1 ZINC000006236030 181321705 /nfs/dbraw/zinc/32/17/05/181321705.db2.gz IATDKROIYKMPFT-UHFFFAOYSA-N 0 0 322.235 5.371 20 0 DKADRN CCc1ccc(Cl)c(CC)c1NC(=O)c1cccc(C)c1 ZINC000006236080 181322098 /nfs/dbraw/zinc/32/20/98/181322098.db2.gz WJAWKBOCUMFQKX-UHFFFAOYSA-N 0 0 301.817 5.026 20 0 DKADRN CCc1ccc(Cl)c(CC)c1NC(=O)c1ccc(C)c(C)c1 ZINC000006236081 181321986 /nfs/dbraw/zinc/32/19/86/181321986.db2.gz CBZJXOSLDUCUMB-UHFFFAOYSA-N 0 0 315.844 5.334 20 0 DKADRN O=C(Nc1cccc2ccccc21)c1c(Cl)cccc1Cl ZINC000006238018 181322002 /nfs/dbraw/zinc/32/20/02/181322002.db2.gz LQAGQEDKLIMSSL-UHFFFAOYSA-N 0 0 316.187 5.399 20 0 DKADRN CCc1ccccc1NC(=O)c1ccc(Oc2ccccc2)cc1 ZINC000006258795 181323669 /nfs/dbraw/zinc/32/36/69/181323669.db2.gz MTBKMAVUOHHZSB-UHFFFAOYSA-N 0 0 317.388 5.294 20 0 DKADRN CCc1ccccc1NC(=O)c1ccccc1Cc1ccccc1 ZINC000006258819 181323602 /nfs/dbraw/zinc/32/36/02/181323602.db2.gz LZGLDLNNRRVQSU-UHFFFAOYSA-N 0 0 315.416 5.092 20 0 DKADRN Cc1c2cccc(Cl)c2oc1C(=O)Nc1ccc(F)cc1C ZINC000006260199 181323325 /nfs/dbraw/zinc/32/33/25/181323325.db2.gz QJTWGTBDXZDOEN-UHFFFAOYSA-N 0 0 317.747 5.094 20 0 DKADRN Cc1cc(F)ccc1NC(=O)c1ccc(Oc2ccccc2)cc1 ZINC000006260273 181323228 /nfs/dbraw/zinc/32/32/28/181323228.db2.gz REVXZFIZTPZIQG-UHFFFAOYSA-N 0 0 321.351 5.179 20 0 DKADRN Cc1ccc(Oc2ccc(NC(=O)Cc3cccs3)cc2)cc1 ZINC000006261334 181324485 /nfs/dbraw/zinc/32/44/85/181324485.db2.gz SMPHPAANYLOMPZ-UHFFFAOYSA-N 0 0 323.417 5.030 20 0 DKADRN Cc1ccc(Oc2ccccc2NC(=O)c2ccccc2F)cc1 ZINC000006267014 181324474 /nfs/dbraw/zinc/32/44/74/181324474.db2.gz NIGJZIQNJXRPEV-UHFFFAOYSA-N 0 0 321.351 5.179 20 0 DKADRN Cc1ccc(NC(=O)c2ccc(Cl)c(Cl)c2)c(Cl)c1 ZINC000006272344 181325306 /nfs/dbraw/zinc/32/53/06/181325306.db2.gz QJRRGGIVAGEZRD-UHFFFAOYSA-N 0 0 314.599 5.208 20 0 DKADRN Cc1ccc(NC(=O)c2cccc(Cl)c2Cl)c(Cl)c1 ZINC000006272377 181324995 /nfs/dbraw/zinc/32/49/95/181324995.db2.gz XSVKUBQMSYXDHA-UHFFFAOYSA-N 0 0 314.599 5.208 20 0 DKADRN CCCCOc1ccc(C(=O)Nc2ccc(C)cc2Cl)cc1 ZINC000006272447 181325004 /nfs/dbraw/zinc/32/50/04/181325004.db2.gz BGCOTUXCKCNYNS-UHFFFAOYSA-N 0 0 317.816 5.080 20 0 DKADRN CCc1cccc(CC)c1NC(=O)c1ccc2ccccc2c1 ZINC000006305673 181327600 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ZINC000022396393 182320662 /nfs/dbraw/zinc/32/06/62/182320662.db2.gz PIDFEAJNKWNYJP-UHFFFAOYSA-N 0 0 324.591 5.100 20 0 DKADRN Clc1ccc(-c2nc(CSCc3ccco3)cs2)cc1 ZINC000022640214 335091928 /nfs/dbraw/zinc/09/19/28/335091928.db2.gz AWFCDJIIUNWIBQ-UHFFFAOYSA-N 0 0 321.854 5.490 20 0 DKADRN Clc1ccc(-c2nc(CSc3ccncc3)cs2)cc1 ZINC000022649406 182329986 /nfs/dbraw/zinc/32/99/86/182329986.db2.gz RTAHBDDHNLYPOQ-UHFFFAOYSA-N 0 0 318.854 5.151 20 0 DKADRN Cc1cc(C(=O)Nc2ccccc2Sc2ccccc2)c(C)o1 ZINC000022839847 182336959 /nfs/dbraw/zinc/33/69/59/182336959.db2.gz LDRCMIIQTLGJNJ-UHFFFAOYSA-N 0 0 323.417 5.300 20 0 DKADRN CC(C)Sc1ccc(C(=O)Nc2nc(C(C)C)cs2)cc1 ZINC000022905733 335131359 /nfs/dbraw/zinc/13/13/59/335131359.db2.gz UQNPINNTNCNSNF-UHFFFAOYSA-N 0 0 320.483 5.019 20 0 DKADRN CSCc1ccc(C(=O)Nc2c(C)cccc2C(C)C)cc1 ZINC000022914417 182341306 /nfs/dbraw/zinc/34/13/06/182341306.db2.gz BKJNXNZUJORVAQ-UHFFFAOYSA-N 0 0 313.466 5.234 20 0 DKADRN Cc1ccccc1CC(=O)Nc1c(C(C)C)cccc1C(C)C ZINC000023120480 182348860 /nfs/dbraw/zinc/34/88/60/182348860.db2.gz NKWOXJRGJSUHMK-UHFFFAOYSA-N 0 0 309.453 5.423 20 0 DKADRN c1oc(-c2ccccc2)nc1COc1ccc2ccccc2c1 ZINC000023598251 182363680 /nfs/dbraw/zinc/36/36/80/182363680.db2.gz TXALZRZGSKZSSR-UHFFFAOYSA-N 0 0 301.345 5.074 20 0 DKADRN CCCCC(=O)Nc1ccccc1Oc1ccc(OCC)cc1 ZINC000023683661 182365768 /nfs/dbraw/zinc/36/57/68/182365768.db2.gz UYVYZUROKXFSEO-UHFFFAOYSA-N 0 0 313.397 5.006 20 0 DKADRN Cc1cccc(Oc2ccccc2NC(=O)c2ccccc2C)c1 ZINC000023723365 182367668 /nfs/dbraw/zinc/36/76/68/182367668.db2.gz QMYGPLKRTCIGGF-UHFFFAOYSA-N 0 0 317.388 5.348 20 0 DKADRN Cc1ccccc1-c1nnc(S[C@H](C)c2ccc(F)cc2)o1 ZINC000023930074 337252458 /nfs/dbraw/zinc/25/24/58/337252458.db2.gz KRUTYPRMSYCMEW-GFCCVEGCSA-N 0 0 314.385 5.037 20 0 DKADRN Cc1ccccc1-c1nnc(S[C@@H](C)c2ccc(F)cc2)o1 ZINC000023930078 337252503 /nfs/dbraw/zinc/25/25/03/337252503.db2.gz KRUTYPRMSYCMEW-LBPRGKRZSA-N 0 0 314.385 5.037 20 0 DKADRN FC(F)(F)c1ccnc(Oc2ccc(Cl)c3ccccc23)n1 ZINC000024052798 182373801 /nfs/dbraw/zinc/37/38/01/182373801.db2.gz DLMFYWLKXVACSY-UHFFFAOYSA-N 0 0 324.689 5.094 20 0 DKADRN Fc1ccc(-c2nc(COc3ccc4ccccc4c3)co2)cc1 ZINC000024228057 182377464 /nfs/dbraw/zinc/37/74/64/182377464.db2.gz FJRPMSJLBNBSNZ-UHFFFAOYSA-N 0 0 319.335 5.213 20 0 DKADRN CCCc1ccccc1NC(=O)c1ccc(Cl)c(Cl)c1 ZINC000024501227 337275252 /nfs/dbraw/zinc/27/52/52/337275252.db2.gz BKSCSRRFRNZBKK-UHFFFAOYSA-N 0 0 308.208 5.198 20 0 DKADRN CCCc1ccccc1NC(=O)c1ccc(Cl)cc1Cl ZINC000024501231 337275201 /nfs/dbraw/zinc/27/52/01/337275201.db2.gz CAKKTZZPQDOOIZ-UHFFFAOYSA-N 0 0 308.208 5.198 20 0 DKADRN CCCc1ccccc1NC(=O)c1cc(Cl)ccc1Cl ZINC000024501266 337275170 /nfs/dbraw/zinc/27/51/70/337275170.db2.gz GOVAYBHBDOJRGS-UHFFFAOYSA-N 0 0 308.208 5.198 20 0 DKADRN C[C@@H]1CCCCN1C(=O)c1cc2sc3ccccc3c2s1 ZINC000024579506 337277597 /nfs/dbraw/zinc/27/75/97/337277597.db2.gz JRRVLGINLDWMBB-LLVKDONJSA-N 0 0 315.463 5.131 20 0 DKADRN C[C@H]1CCCCN1C(=O)c1cc2sc3ccccc3c2s1 ZINC000024579510 337277686 /nfs/dbraw/zinc/27/76/86/337277686.db2.gz JRRVLGINLDWMBB-NSHDSACASA-N 0 0 315.463 5.131 20 0 DKADRN Cc1ccccc1C(=O)Nc1ccccc1SC1CCCC1 ZINC000024580018 182384296 /nfs/dbraw/zinc/38/42/96/182384296.db2.gz OPFMOOLKRFOJSR-UHFFFAOYSA-N 0 0 311.450 5.282 20 0 DKADRN O=C(Nc1cccc(Cl)c1Cl)c1ccc(F)cc1Cl ZINC000024598509 182384859 /nfs/dbraw/zinc/38/48/59/182384859.db2.gz GIWBUYNTBXDWKL-UHFFFAOYSA-N 0 0 318.562 5.038 20 0 DKADRN CC[C@@H](NC(=O)C[C@@H](C)c1ccccc1)c1ccc(Cl)cc1 ZINC000025067356 337296672 /nfs/dbraw/zinc/29/66/72/337296672.db2.gz WBVDZTSZAACASI-RDTXWAMCSA-N 0 0 315.844 5.101 20 0 DKADRN CC[C@H](NC(=O)C[C@@H](C)c1ccccc1)c1ccc(Cl)cc1 ZINC000025067362 337296718 /nfs/dbraw/zinc/29/67/18/337296718.db2.gz WBVDZTSZAACASI-KDOFPFPSSA-N 0 0 315.844 5.101 20 0 DKADRN CC[C@@H](NC(=O)C[C@H](C)c1ccccc1)c1ccc(Cl)cc1 ZINC000025067368 337296615 /nfs/dbraw/zinc/29/66/15/337296615.db2.gz WBVDZTSZAACASI-KBXCAEBGSA-N 0 0 315.844 5.101 20 0 DKADRN CC[C@H](NC(=O)C[C@H](C)c1ccccc1)c1ccc(Cl)cc1 ZINC000025067375 337296648 /nfs/dbraw/zinc/29/66/48/337296648.db2.gz WBVDZTSZAACASI-KSSFIOAISA-N 0 0 315.844 5.101 20 0 DKADRN CC(=O)Nc1ccc(/C=C/c2ccc3ccc(Cl)cc3n2)cc1 ZINC000025150399 337301084 /nfs/dbraw/zinc/30/10/84/337301084.db2.gz BUDQIMFFYVPIHB-ONNFQVAWSA-N 0 0 322.795 5.017 20 0 DKADRN O=C(Nc1ccccc1SC1CCCC1)c1ccc(Cl)o1 ZINC000025267055 337305476 /nfs/dbraw/zinc/30/54/76/337305476.db2.gz LSYWLCZWFHSPCU-UHFFFAOYSA-N 0 0 321.829 5.220 20 0 DKADRN O=C(Nc1ccccc1SC1CCCC1)c1cccs1 ZINC000025268315 337305497 /nfs/dbraw/zinc/30/54/97/337305497.db2.gz CRXYOXXBLXWPRW-UHFFFAOYSA-N 0 0 303.452 5.035 20 0 DKADRN O=C(Nc1ccccc1SC1CCCC1)c1cccc(F)c1 ZINC000025268322 182406758 /nfs/dbraw/zinc/40/67/58/182406758.db2.gz YPIRLZPEBQTXEE-UHFFFAOYSA-N 0 0 315.413 5.113 20 0 DKADRN Cc1ccsc1C(=O)Nc1ccccc1SC1CCCC1 ZINC000025268405 182406636 /nfs/dbraw/zinc/40/66/36/182406636.db2.gz JACUUOHCJOIMKW-UHFFFAOYSA-N 0 0 317.479 5.344 20 0 DKADRN Cc1ccc(F)cc1C(=O)Nc1ccccc1-c1cccs1 ZINC000025876859 331638853 /nfs/dbraw/zinc/63/88/53/331638853.db2.gz AAMQELWWNXHNNJ-UHFFFAOYSA-N 0 0 311.381 5.115 20 0 DKADRN C[C@@H](NCc1cccc(Cl)c1Cl)c1cc2ccccc2o1 ZINC000026313199 333223696 /nfs/dbraw/zinc/22/36/96/333223696.db2.gz UEZVFCKQMHHYIR-LLVKDONJSA-N 0 0 320.219 5.590 20 0 DKADRN C[C@H](NCc1cccc(Cl)c1Cl)c1cc2ccccc2o1 ZINC000026313203 333223707 /nfs/dbraw/zinc/22/37/07/333223707.db2.gz UEZVFCKQMHHYIR-NSHDSACASA-N 0 0 320.219 5.590 20 0 DKADRN Cc1ccccc1NC(=O)[C@@H](C)Sc1ccc(C(C)C)cc1 ZINC000027682987 332693269 /nfs/dbraw/zinc/69/32/69/332693269.db2.gz CSFFSZCYRPUBJV-OAHLLOKOSA-N 0 0 313.466 5.238 20 0 DKADRN Cc1c2cc(Cl)ccc2oc1C(=O)N(C)[C@H]1CCCC[C@@H]1C ZINC000031381799 182612639 /nfs/dbraw/zinc/61/26/39/182612639.db2.gz ZHWZEIPYZVKIJT-NHYWBVRUSA-N 0 0 319.832 5.045 20 0 DKADRN Clc1cccc(Cl)c1CSc1nncc2ccccc21 ZINC000032331895 182640156 /nfs/dbraw/zinc/64/01/56/182640156.db2.gz CNNWMTNMPKXLIU-UHFFFAOYSA-N 0 0 321.232 5.229 20 0 DKADRN Clc1cccc(Cl)c1CN[C@@H]1CCSc2ccccc21 ZINC000034992439 336385080 /nfs/dbraw/zinc/38/50/80/336385080.db2.gz FJMLXLRSPJGYLN-OAHLLOKOSA-N 0 0 324.276 5.320 20 0 DKADRN Clc1cccc(Cl)c1CN[C@H]1CCSc2ccccc21 ZINC000034992440 336385094 /nfs/dbraw/zinc/38/50/94/336385094.db2.gz FJMLXLRSPJGYLN-HNNXBMFYSA-N 0 0 324.276 5.320 20 0 DKADRN C[C@H](NCc1ccc(F)cc1)c1cc(F)c(Cl)cc1Cl ZINC000034992900 336385063 /nfs/dbraw/zinc/38/50/63/336385063.db2.gz TZNBBGATALJZNT-VIFPVBQESA-N 0 0 316.178 5.122 20 0 DKADRN C[C@@H](NCc1ccc(F)cc1)c1cc(F)c(Cl)cc1Cl ZINC000034992901 336385111 /nfs/dbraw/zinc/38/51/11/336385111.db2.gz TZNBBGATALJZNT-SECBINFHSA-N 0 0 316.178 5.122 20 0 DKADRN C[C@H](NCc1ccccc1F)c1cc(F)c(Cl)cc1Cl ZINC000034992904 336385150 /nfs/dbraw/zinc/38/51/50/336385150.db2.gz RYYAYOYDWHQBBT-VIFPVBQESA-N 0 0 316.178 5.122 20 0 DKADRN C[C@@H](NCc1ccccc1F)c1cc(F)c(Cl)cc1Cl ZINC000034992905 336385116 /nfs/dbraw/zinc/38/51/16/336385116.db2.gz RYYAYOYDWHQBBT-SECBINFHSA-N 0 0 316.178 5.122 20 0 DKADRN C[C@H](NCc1cccc(F)c1)c1cc(F)c(Cl)cc1Cl ZINC000034992906 336385152 /nfs/dbraw/zinc/38/51/52/336385152.db2.gz RKWKOPBLHFPSAE-VIFPVBQESA-N 0 0 316.178 5.122 20 0 DKADRN C[C@@H](NCc1cccc(F)c1)c1cc(F)c(Cl)cc1Cl ZINC000034992907 336385029 /nfs/dbraw/zinc/38/50/29/336385029.db2.gz RKWKOPBLHFPSAE-SECBINFHSA-N 0 0 316.178 5.122 20 0 DKADRN C[C@H](NCc1c(F)cccc1Cl)c1cc2ccccc2o1 ZINC000035011364 336390692 /nfs/dbraw/zinc/39/06/92/336390692.db2.gz SDESRYSAVRJBSX-NSHDSACASA-N 0 0 303.764 5.076 20 0 DKADRN C[C@@H](NCc1c(F)cccc1Cl)c1cc2ccccc2o1 ZINC000035011366 336390590 /nfs/dbraw/zinc/39/05/90/336390590.db2.gz SDESRYSAVRJBSX-LLVKDONJSA-N 0 0 303.764 5.076 20 0 DKADRN C[C@H](NCc1c(Cl)cccc1Cl)c1cc2ccccc2o1 ZINC000035011408 337339190 /nfs/dbraw/zinc/33/91/90/337339190.db2.gz WJOLGWBURPVFQL-NSHDSACASA-N 0 0 320.219 5.590 20 0 DKADRN C[C@@H](NCc1c(Cl)cccc1Cl)c1cc2ccccc2o1 ZINC000035011410 337339140 /nfs/dbraw/zinc/33/91/40/337339140.db2.gz WJOLGWBURPVFQL-LLVKDONJSA-N 0 0 320.219 5.590 20 0 DKADRN C[C@H](NCc1c(F)cccc1Cl)c1ccc(Cl)s1 ZINC000035253481 337741976 /nfs/dbraw/zinc/74/19/76/337741976.db2.gz USFNAWUEUUQIHC-QMMMGPOBSA-N 0 0 304.217 5.045 20 0 DKADRN CSc1ccc([C@@H](C)NCc2c(F)cccc2Cl)cc1 ZINC000035256470 331491068 /nfs/dbraw/zinc/49/10/68/331491068.db2.gz CZRXLGHBQYENRA-LLVKDONJSA-N 0 0 309.837 5.052 20 0 DKADRN CC[C@@H](N[C@@H](C)c1ccccn1)c1ccc(Cl)cc1Cl ZINC000035625214 331506578 /nfs/dbraw/zinc/50/65/78/331506578.db2.gz OFQOMRLRUDAWMP-XHDPSFHLSA-N 0 0 309.240 5.190 20 0 DKADRN CC[C@H](N[C@H](C)c1ccccn1)c1ccc(Cl)cc1Cl ZINC000035625216 331506631 /nfs/dbraw/zinc/50/66/31/331506631.db2.gz OFQOMRLRUDAWMP-ABAIWWIYSA-N 0 0 309.240 5.190 20 0 DKADRN CC[C@@H](N[C@H](C)c1ccccn1)c1ccc(Cl)cc1Cl ZINC000035625218 337744381 /nfs/dbraw/zinc/74/43/81/337744381.db2.gz OFQOMRLRUDAWMP-IAQYHMDHSA-N 0 0 309.240 5.190 20 0 DKADRN CC(C)(CC(=O)Nc1ccccc1C(F)(F)F)c1ccccc1 ZINC000036140069 337745043 /nfs/dbraw/zinc/74/50/43/337745043.db2.gz HQQCFJFGXYTJQW-UHFFFAOYSA-N 0 0 321.342 5.012 20 0 DKADRN CSc1ccc(Cl)c(C(=O)Nc2ccccc2SC)c1 ZINC000036739887 182839410 /nfs/dbraw/zinc/83/94/10/182839410.db2.gz XQSVHWCBFFTAGI-UHFFFAOYSA-N 0 0 323.870 5.036 20 0 DKADRN Brc1cc(CNc2cccc3ccccc32)cs1 ZINC000036867719 337785893 /nfs/dbraw/zinc/78/58/93/337785893.db2.gz KIAYHUGEWZIYLK-UHFFFAOYSA-N 0 0 318.239 5.276 20 0 DKADRN Cc1nc([C@H](C)N[C@H](C)c2ccc(Cl)cc2Cl)cs1 ZINC000036914532 337793968 /nfs/dbraw/zinc/79/39/68/337793968.db2.gz OMEPHBBTTGNVTO-BDAKNGLRSA-N 0 0 315.269 5.170 20 0 DKADRN COCc1cccc(N[C@H](C)c2ccc(Cl)c(Cl)c2)c1 ZINC000036918119 337794203 /nfs/dbraw/zinc/79/42/03/337794203.db2.gz MEUFEJMQLKGMBG-LLVKDONJSA-N 0 0 310.224 5.313 20 0 DKADRN COCc1cccc(N[C@@H](C)c2ccc(Cl)cc2Cl)c1 ZINC000036918235 337794088 /nfs/dbraw/zinc/79/40/88/337794088.db2.gz SCZKOPXFLSHZRK-NSHDSACASA-N 0 0 310.224 5.313 20 0 DKADRN COCc1cccc(N[C@H](C)c2ccc(Cl)cc2Cl)c1 ZINC000036918236 337794168 /nfs/dbraw/zinc/79/41/68/337794168.db2.gz SCZKOPXFLSHZRK-LLVKDONJSA-N 0 0 310.224 5.313 20 0 DKADRN CCC(=O)Nc1ccc(C)c(N[C@@H](C)c2ccc(Cl)s2)c1 ZINC000036935632 337794935 /nfs/dbraw/zinc/79/49/35/337794935.db2.gz MZOLDLQCMRDRTR-NSHDSACASA-N 0 0 322.861 5.232 20 0 DKADRN CCC(=O)Nc1ccc(C)c(N[C@H](C)c2ccc(Cl)s2)c1 ZINC000036935634 337794963 /nfs/dbraw/zinc/79/49/63/337794963.db2.gz MZOLDLQCMRDRTR-LLVKDONJSA-N 0 0 322.861 5.232 20 0 DKADRN COCc1ccccc1N[C@H](C)c1ccc(Cl)cc1Cl ZINC000036938997 337795172 /nfs/dbraw/zinc/79/51/72/337795172.db2.gz PDQHUWDTTNOREW-LLVKDONJSA-N 0 0 310.224 5.313 20 0 DKADRN Cc1cc([C@H](C)N[C@@H](C)c2ccccc2Br)c(C)o1 ZINC000036945707 337800568 /nfs/dbraw/zinc/80/05/68/337800568.db2.gz WWTBPYGPGLSWLV-RYUDHWBXSA-N 0 0 322.246 5.071 20 0 DKADRN CC[C@H](Nc1ccc(N2CCCC2)cc1C)c1cccs1 ZINC000036955664 332412851 /nfs/dbraw/zinc/41/28/51/332412851.db2.gz SLJMIAVBXVWMGU-INIZCTEOSA-N 0 0 300.471 5.220 20 0 DKADRN CC[C@@H](Nc1ccc(N2CCCC2)cc1C)c1cccs1 ZINC000036955665 332415714 /nfs/dbraw/zinc/41/57/14/332415714.db2.gz SLJMIAVBXVWMGU-MRXNPFEDSA-N 0 0 300.471 5.220 20 0 DKADRN Cc1nc2ccc(N[C@@H](C)c3c(F)cccc3F)cc2s1 ZINC000036956066 333175305 /nfs/dbraw/zinc/17/53/05/333175305.db2.gz ZBGXWQZWFODPPH-VIFPVBQESA-N 0 0 304.365 5.056 20 0 DKADRN Cc1nc2ccc(N[C@H](C)c3c(F)cccc3F)cc2s1 ZINC000036956067 333175394 /nfs/dbraw/zinc/17/53/94/333175394.db2.gz ZBGXWQZWFODPPH-SECBINFHSA-N 0 0 304.365 5.056 20 0 DKADRN Cc1nc2ccc(N[C@@H](C)c3ccc(F)c(F)c3)cc2s1 ZINC000036956076 333178120 /nfs/dbraw/zinc/17/81/20/333178120.db2.gz IAPVXNJQVYSYPW-VIFPVBQESA-N 0 0 304.365 5.056 20 0 DKADRN Cc1nc2ccc(N[C@H](C)c3ccc(F)c(F)c3)cc2s1 ZINC000036956077 333177732 /nfs/dbraw/zinc/17/77/32/333177732.db2.gz IAPVXNJQVYSYPW-SECBINFHSA-N 0 0 304.365 5.056 20 0 DKADRN Cc1nc2ccc(N[C@@H](C)c3ccc(F)cc3F)cc2s1 ZINC000036956078 333177576 /nfs/dbraw/zinc/17/75/76/333177576.db2.gz GJXVZBUTRRKZEI-VIFPVBQESA-N 0 0 304.365 5.056 20 0 DKADRN Cc1nc2ccc(N[C@H](C)c3ccc(F)cc3F)cc2s1 ZINC000036956079 333177907 /nfs/dbraw/zinc/17/79/07/333177907.db2.gz GJXVZBUTRRKZEI-SECBINFHSA-N 0 0 304.365 5.056 20 0 DKADRN Cc1nc2ccc(N[C@@H](C)c3cc(F)ccc3F)cc2s1 ZINC000036956130 333371317 /nfs/dbraw/zinc/37/13/17/333371317.db2.gz UXJGECUNTNYKFK-VIFPVBQESA-N 0 0 304.365 5.056 20 0 DKADRN Cc1nc2ccc(N[C@H](C)c3cc(F)ccc3F)cc2s1 ZINC000036956131 333372777 /nfs/dbraw/zinc/37/27/77/333372777.db2.gz UXJGECUNTNYKFK-SECBINFHSA-N 0 0 304.365 5.056 20 0 DKADRN CC(C)C(=O)Nc1ccc(N[C@@H](C)c2ccc(Cl)s2)cc1 ZINC000036957892 331601551 /nfs/dbraw/zinc/60/15/51/331601551.db2.gz SFJLXHFMYDKYJW-NSHDSACASA-N 0 0 322.861 5.169 20 0 DKADRN CC(C)C(=O)Nc1ccc(N[C@H](C)c2ccc(Cl)s2)cc1 ZINC000036957893 331601469 /nfs/dbraw/zinc/60/14/69/331601469.db2.gz SFJLXHFMYDKYJW-LLVKDONJSA-N 0 0 322.861 5.169 20 0 DKADRN Clc1ccc(CNc2ccc3oc(C4CC4)nc3c2)s1 ZINC000036971697 340723789 /nfs/dbraw/zinc/72/37/89/340723789.db2.gz UESDTOFJWGOFSP-UHFFFAOYSA-N 0 0 304.802 5.032 20 0 DKADRN Cc1nc([C@@H](C)N[C@@H](c2ccc(Cl)cc2)C(C)C)cs1 ZINC000036975553 332179182 /nfs/dbraw/zinc/17/91/82/332179182.db2.gz QDTJMLPYTIKWMO-BDJLRTHQSA-N 0 0 308.878 5.153 20 0 DKADRN Cc1nc([C@H](C)N[C@@H](c2ccc(Cl)cc2)C(C)C)cs1 ZINC000036975555 332179212 /nfs/dbraw/zinc/17/92/12/332179212.db2.gz QDTJMLPYTIKWMO-MEDUHNTESA-N 0 0 308.878 5.153 20 0 DKADRN Cc1nc([C@@H](C)N[C@H](c2ccc(Cl)cc2)C(C)C)cs1 ZINC000036975556 332179185 /nfs/dbraw/zinc/17/91/85/332179185.db2.gz QDTJMLPYTIKWMO-BZNIZROVSA-N 0 0 308.878 5.153 20 0 DKADRN Cc1nc([C@H](C)N[C@H](c2ccc(Cl)cc2)C(C)C)cs1 ZINC000036975558 332179171 /nfs/dbraw/zinc/17/91/71/332179171.db2.gz QDTJMLPYTIKWMO-ZBEGNZNMSA-N 0 0 308.878 5.153 20 0 DKADRN CC(=O)Nc1ccc(N[C@@H](C)c2cc(C)sc2C)cc1Cl ZINC000036983048 340726338 /nfs/dbraw/zinc/72/63/38/340726338.db2.gz XDVVVROOYHYARR-JTQLQIEISA-N 0 0 322.861 5.150 20 0 DKADRN CC(=O)Nc1ccc(N[C@@H](C)c2ccc(Cl)cc2)cc1Cl ZINC000036983138 340726384 /nfs/dbraw/zinc/72/63/84/340726384.db2.gz SQUQFALXFQJEMC-JTQLQIEISA-N 0 0 323.223 5.125 20 0 DKADRN CC(=O)Nc1ccc(N[C@H](C)c2ccc(Cl)cc2)cc1Cl ZINC000036983139 340726359 /nfs/dbraw/zinc/72/63/59/340726359.db2.gz SQUQFALXFQJEMC-SNVBAGLBSA-N 0 0 323.223 5.125 20 0 DKADRN CC(=O)Nc1ccc(N[C@@H](C)c2cccc(Cl)c2)cc1Cl ZINC000036983143 340726322 /nfs/dbraw/zinc/72/63/22/340726322.db2.gz FCUXTHMXRYEKTE-JTQLQIEISA-N 0 0 323.223 5.125 20 0 DKADRN CC(=O)Nc1ccc(N[C@H](C)c2cccc(Cl)c2)cc1Cl ZINC000036983144 340726382 /nfs/dbraw/zinc/72/63/82/340726382.db2.gz FCUXTHMXRYEKTE-SNVBAGLBSA-N 0 0 323.223 5.125 20 0 DKADRN CC(=O)Nc1ccc(N[C@@H](C)c2ccccc2Cl)cc1Cl ZINC000036983146 340726356 /nfs/dbraw/zinc/72/63/56/340726356.db2.gz YYIZYXNBHQZLNK-JTQLQIEISA-N 0 0 323.223 5.125 20 0 DKADRN CC(=O)Nc1ccc(N[C@H](C)c2ccccc2Cl)cc1Cl ZINC000036983147 340726362 /nfs/dbraw/zinc/72/63/62/340726362.db2.gz YYIZYXNBHQZLNK-SNVBAGLBSA-N 0 0 323.223 5.125 20 0 DKADRN FC(F)(F)CSc1ccccc1NCc1ccsc1 ZINC000036990161 182859349 /nfs/dbraw/zinc/85/93/49/182859349.db2.gz CZURETGUJZWVAD-UHFFFAOYSA-N 0 0 303.374 5.015 20 0 DKADRN C[C@@H](N[C@H](c1ccco1)c1ccccc1)c1ccc(Cl)s1 ZINC000036992294 340729623 /nfs/dbraw/zinc/72/96/23/340729623.db2.gz VXVGGVXPHLEZGP-PXAZEXFGSA-N 0 0 317.841 5.435 20 0 DKADRN C[C@H](N[C@@H](c1ccco1)c1ccccc1)c1ccc(Cl)s1 ZINC000036992295 340729627 /nfs/dbraw/zinc/72/96/27/340729627.db2.gz VXVGGVXPHLEZGP-YVEFUNNKSA-N 0 0 317.841 5.435 20 0 DKADRN C[C@@H](N[C@@H](c1ccco1)c1ccccc1)c1ccc(Cl)s1 ZINC000036992296 340729588 /nfs/dbraw/zinc/72/95/88/340729588.db2.gz VXVGGVXPHLEZGP-SJKOYZFVSA-N 0 0 317.841 5.435 20 0 DKADRN C[C@@H](Nc1cccc(OC(F)F)c1)c1ccc(Cl)s1 ZINC000037006271 340735382 /nfs/dbraw/zinc/73/53/82/340735382.db2.gz MBQUIPXSDGMRFY-MRVPVSSYSA-N 0 0 303.761 5.176 20 0 DKADRN Cc1ccc(CNc2cccc(-c3csc(C)n3)c2)s1 ZINC000037047175 340741453 /nfs/dbraw/zinc/74/14/53/340741453.db2.gz JBNBNPOBWINQIV-UHFFFAOYSA-N 0 0 300.452 5.101 20 0 DKADRN Cc1ccsc1CNc1cccc(-c2csc(C)n2)c1 ZINC000037047209 340741458 /nfs/dbraw/zinc/74/14/58/340741458.db2.gz HPRDLLUOUPGJFD-UHFFFAOYSA-N 0 0 300.452 5.101 20 0 DKADRN Cc1nc(-c2cccc(N[C@@H](C)c3cccs3)c2)cs1 ZINC000037047247 340741462 /nfs/dbraw/zinc/74/14/62/340741462.db2.gz DRGNTYWHTKVXNA-NSHDSACASA-N 0 0 300.452 5.353 20 0 DKADRN Cc1nc(-c2cccc(N[C@H](C)c3cccs3)c2)cs1 ZINC000037047248 340741475 /nfs/dbraw/zinc/74/14/75/340741475.db2.gz DRGNTYWHTKVXNA-LLVKDONJSA-N 0 0 300.452 5.353 20 0 DKADRN CC(C)C(=O)Nc1cccc(N[C@@H](C)c2ccc(Cl)s2)c1 ZINC000037084997 340748482 /nfs/dbraw/zinc/74/84/82/340748482.db2.gz LGMSRNRQZGAVOI-NSHDSACASA-N 0 0 322.861 5.169 20 0 DKADRN Cc1nc(CNc2ccccc2SC2CCCC2)cs1 ZINC000037123511 340755879 /nfs/dbraw/zinc/75/58/79/340755879.db2.gz KUDAGRHZSJBQKD-UHFFFAOYSA-N 0 0 304.484 5.098 20 0 DKADRN C[C@H](N[C@@H](C)c1cc(Cl)ccc1Cl)c1cccc(O)c1 ZINC000037151112 340765224 /nfs/dbraw/zinc/76/52/24/340765224.db2.gz LHZTVAKGBVJFRQ-QWRGUYRKSA-N 0 0 310.224 5.111 20 0 DKADRN C[C@H](NCc1ccco1)c1ccc(Cl)c(Cl)c1Cl ZINC000037184245 340770309 /nfs/dbraw/zinc/77/03/09/340770309.db2.gz HUIVDDSLKAXTSP-QMMMGPOBSA-N 0 0 304.604 5.091 20 0 DKADRN C[C@@H](NCc1ccco1)c1ccc(Cl)c(Cl)c1Cl ZINC000037184246 340770260 /nfs/dbraw/zinc/77/02/60/340770260.db2.gz HUIVDDSLKAXTSP-MRVPVSSYSA-N 0 0 304.604 5.091 20 0 DKADRN CSc1cccc(N[C@@H]2CCSc3c(F)cccc32)c1 ZINC000037188363 340770762 /nfs/dbraw/zinc/77/07/62/340770762.db2.gz ANFCTRCTEWXURN-OAHLLOKOSA-N 0 0 305.443 5.197 20 0 DKADRN CSc1cccc(N[C@H]2CCSc3c(F)cccc32)c1 ZINC000037188364 340770754 /nfs/dbraw/zinc/77/07/54/340770754.db2.gz ANFCTRCTEWXURN-HNNXBMFYSA-N 0 0 305.443 5.197 20 0 DKADRN CSc1ccc(N[C@@H]2CCSc3c(F)cccc32)cc1 ZINC000037197661 340772576 /nfs/dbraw/zinc/77/25/76/340772576.db2.gz DTSRPZZRGQQVNK-OAHLLOKOSA-N 0 0 305.443 5.197 20 0 DKADRN CSc1ccc(N[C@H]2CCSc3c(F)cccc32)cc1 ZINC000037197663 340772560 /nfs/dbraw/zinc/77/25/60/340772560.db2.gz DTSRPZZRGQQVNK-HNNXBMFYSA-N 0 0 305.443 5.197 20 0 DKADRN COCc1cccc(N[C@@H](c2ccc(Cl)cc2)C2CC2)c1 ZINC000037270664 340782500 /nfs/dbraw/zinc/78/25/00/340782500.db2.gz GUMHOYKEPHFNSJ-GOSISDBHSA-N 0 0 301.817 5.050 20 0 DKADRN COCc1cccc(N[C@H](c2ccc(Cl)cc2)C2CC2)c1 ZINC000037270666 518097463 /nfs/dbraw/zinc/09/74/63/518097463.db2.gz GUMHOYKEPHFNSJ-SFHVURJKSA-N 0 0 301.817 5.050 20 0 DKADRN COCc1cccc(N[C@@H]2CCSc3ccc(Cl)cc32)c1 ZINC000037270695 340782493 /nfs/dbraw/zinc/78/24/93/340782493.db2.gz HJMPXZPNFGNXTM-MRXNPFEDSA-N 0 0 319.857 5.135 20 0 DKADRN COCc1cccc(N[C@H]2CCSc3ccc(Cl)cc32)c1 ZINC000037270696 340782426 /nfs/dbraw/zinc/78/24/26/340782426.db2.gz HJMPXZPNFGNXTM-INIZCTEOSA-N 0 0 319.857 5.135 20 0 DKADRN COCc1cccc(N[C@@H](c2cccs2)C2CCCC2)c1 ZINC000037270770 340782436 /nfs/dbraw/zinc/78/24/36/340782436.db2.gz YILPGAHQQVIVPS-GOSISDBHSA-N 0 0 301.455 5.238 20 0 DKADRN COCc1cccc(N[C@H](c2cccs2)C2CCCC2)c1 ZINC000037270772 340782430 /nfs/dbraw/zinc/78/24/30/340782430.db2.gz YILPGAHQQVIVPS-SFHVURJKSA-N 0 0 301.455 5.238 20 0 DKADRN C[C@H](N[C@@H](C)c1ccc(F)cc1Cl)c1ccc(F)cc1F ZINC000037277307 340783698 /nfs/dbraw/zinc/78/36/98/340783698.db2.gz QDLUPCQQGPIFDD-UWVGGRQHSA-N 0 0 313.750 5.169 20 0 DKADRN C[C@@H](N[C@@H](C)c1ccc(F)cc1Cl)c1ccc(F)cc1F ZINC000037277308 340783757 /nfs/dbraw/zinc/78/37/57/340783757.db2.gz QDLUPCQQGPIFDD-VHSXEESVSA-N 0 0 313.750 5.169 20 0 DKADRN C[C@@H](N[C@@H](C)c1ccc(F)cc1F)c1ccc(F)cc1Cl ZINC000037277310 340783686 /nfs/dbraw/zinc/78/36/86/340783686.db2.gz QDLUPCQQGPIFDD-ZJUUUORDSA-N 0 0 313.750 5.169 20 0 DKADRN O=C(Nc1c(Cl)cc(Cl)cc1Cl)c1ccccc1F ZINC000037486515 336121286 /nfs/dbraw/zinc/12/12/86/336121286.db2.gz NWMZSIVOOSGBKP-UHFFFAOYSA-N 0 0 318.562 5.038 20 0 DKADRN C[C@@H](NCc1ccc(Cl)o1)c1ccc(Cl)cc1Cl ZINC000037487115 518178149 /nfs/dbraw/zinc/17/81/49/518178149.db2.gz DVCDENYXBCFKBB-MRVPVSSYSA-N 0 0 304.604 5.091 20 0 DKADRN C[C@H](NCc1ccc(Cl)o1)c1ccc(Cl)c(Cl)c1 ZINC000037487204 340785461 /nfs/dbraw/zinc/78/54/61/340785461.db2.gz LWWNXWIYTNTEQZ-QMMMGPOBSA-N 0 0 304.604 5.091 20 0 DKADRN C[C@@H](NCc1ccc(Cl)o1)c1ccc(Cl)c(Cl)c1 ZINC000037487205 340785464 /nfs/dbraw/zinc/78/54/64/340785464.db2.gz LWWNXWIYTNTEQZ-MRVPVSSYSA-N 0 0 304.604 5.091 20 0 DKADRN C[C@H](N[C@@H](C)c1ccccc1Br)c1ccccc1F ZINC000037507893 336267326 /nfs/dbraw/zinc/26/73/26/336267326.db2.gz WJWOUTKBKWGTCT-RYUDHWBXSA-N 0 0 322.221 5.000 20 0 DKADRN C[C@@H](N[C@@H](C)c1ccccc1Br)c1ccccc1F ZINC000037507894 336267354 /nfs/dbraw/zinc/26/73/54/336267354.db2.gz WJWOUTKBKWGTCT-NWDGAFQWSA-N 0 0 322.221 5.000 20 0 DKADRN C[C@@H](N[C@@H](C)c1ccccc1F)c1ccccc1Br ZINC000037507895 336267283 /nfs/dbraw/zinc/26/72/83/336267283.db2.gz WJWOUTKBKWGTCT-NEPJUHHUSA-N 0 0 322.221 5.000 20 0 DKADRN CC[C@H](N[C@@H](C)c1c(F)cccc1F)c1ccc(Cl)cc1 ZINC000037508241 340785560 /nfs/dbraw/zinc/78/55/60/340785560.db2.gz PJUZLSHGBLBEIP-ZBEGNZNMSA-N 0 0 309.787 5.420 20 0 DKADRN C[C@@H](N[C@H](C)c1c(F)cccc1F)c1ccc(Cl)s1 ZINC000037508489 340785542 /nfs/dbraw/zinc/78/55/42/340785542.db2.gz REGIIMSFLUMVJK-RKDXNWHRSA-N 0 0 301.789 5.092 20 0 DKADRN C[C@@H](NC(c1cccs1)c1cccs1)c1ccccc1F ZINC000037764430 340786624 /nfs/dbraw/zinc/78/66/24/340786624.db2.gz CGFLCBJPHXTTFS-GFCCVEGCSA-N 0 0 317.454 5.389 20 0 DKADRN C[C@H](NCc1ccc(Cl)c(Cl)c1)c1c(F)cccc1F ZINC000037771772 340786756 /nfs/dbraw/zinc/78/67/56/340786756.db2.gz FSHOMHWFGWDENW-VIFPVBQESA-N 0 0 316.178 5.122 20 0 DKADRN C[C@H](N[C@@H](C)c1c(F)cccc1F)c1ccc(F)cc1Cl ZINC000037771834 340786840 /nfs/dbraw/zinc/78/68/40/340786840.db2.gz XSZCCRKCWOVVDM-UWVGGRQHSA-N 0 0 313.750 5.169 20 0 DKADRN C[C@@H](N[C@@H](C)c1c(F)cccc1F)c1ccc(F)cc1Cl ZINC000037771835 340786768 /nfs/dbraw/zinc/78/67/68/340786768.db2.gz XSZCCRKCWOVVDM-ZJUUUORDSA-N 0 0 313.750 5.169 20 0 DKADRN C[C@@H](N[C@H](C)c1c(F)cccc1F)c1ccc(F)c(Cl)c1 ZINC000037771931 340786762 /nfs/dbraw/zinc/78/67/62/340786762.db2.gz QVWKFGMXMHOHAA-NXEZZACHSA-N 0 0 313.750 5.169 20 0 DKADRN CCCOc1ccc(Cl)cc1N[C@H](C)c1csc(C)n1 ZINC000037777882 340786915 /nfs/dbraw/zinc/78/69/15/340786915.db2.gz BCNRCXJKLTUEGE-SNVBAGLBSA-N 0 0 310.850 5.067 20 0 DKADRN Clc1cccc(CNc2cccc(-c3nccs3)c2)c1 ZINC000037778289 340786985 /nfs/dbraw/zinc/78/69/85/340786985.db2.gz VUDGBHQGJUZHEZ-UHFFFAOYSA-N 0 0 300.814 5.076 20 0 DKADRN Cc1ccc([C@H](C)Nc2cccc(-c3nccs3)c2)s1 ZINC000037778373 340786897 /nfs/dbraw/zinc/78/68/97/340786897.db2.gz PZWVVMCTRXDDBM-LBPRGKRZSA-N 0 0 300.452 5.353 20 0 DKADRN CSc1ccc(CNc2cccc(-c3nccs3)c2)cc1 ZINC000037778433 340786913 /nfs/dbraw/zinc/78/69/13/340786913.db2.gz XKFLLVWJFMGOJD-UHFFFAOYSA-N 0 0 312.463 5.144 20 0 DKADRN CC[C@H](Nc1cccc(-c2nccs2)c1)c1cccs1 ZINC000037778471 340786894 /nfs/dbraw/zinc/78/68/94/340786894.db2.gz LWDMFBVQVZDSBA-AWEZNQCLSA-N 0 0 300.452 5.435 20 0 DKADRN Clc1cccc(CNc2cccc(-c3cnco3)c2)c1Cl ZINC000037779566 340786986 /nfs/dbraw/zinc/78/69/86/340786986.db2.gz PVBGTJSKOAGKIC-UHFFFAOYSA-N 0 0 319.191 5.261 20 0 DKADRN Clc1cc(Cl)cc(CNc2cccc(-c3cnco3)c2)c1 ZINC000037779624 340786899 /nfs/dbraw/zinc/78/68/99/340786899.db2.gz NSZFTEJHUCLBGL-UHFFFAOYSA-N 0 0 319.191 5.261 20 0 DKADRN CCc1nc2cc(N[C@@H](C)c3cccc(Cl)c3)ccc2o1 ZINC000037786002 340787052 /nfs/dbraw/zinc/78/70/52/340787052.db2.gz BVOQJRVIOWOFSH-NSHDSACASA-N 0 0 300.789 5.217 20 0 DKADRN CCc1nc2cc(N[C@H](C)c3cccc(Cl)c3)ccc2o1 ZINC000037786003 340787041 /nfs/dbraw/zinc/78/70/41/340787041.db2.gz BVOQJRVIOWOFSH-LLVKDONJSA-N 0 0 300.789 5.217 20 0 DKADRN CCc1nc2cc(N[C@@H](C)c3ccc(Cl)cc3)ccc2o1 ZINC000037786064 517866567 /nfs/dbraw/zinc/86/65/67/517866567.db2.gz LNNXXKKYZHZDCS-NSHDSACASA-N 0 0 300.789 5.217 20 0 DKADRN CCc1nc2cc(N[C@H](C)c3ccc(Cl)cc3)ccc2o1 ZINC000037786065 340787067 /nfs/dbraw/zinc/78/70/67/340787067.db2.gz LNNXXKKYZHZDCS-LLVKDONJSA-N 0 0 300.789 5.217 20 0 DKADRN CCc1nc2cc(N[C@H](C)c3ccccc3Cl)ccc2o1 ZINC000037786074 340787061 /nfs/dbraw/zinc/78/70/61/340787061.db2.gz IFZKCGRXXVJTHO-LLVKDONJSA-N 0 0 300.789 5.217 20 0 DKADRN Cc1ncc(CNc2ccc(SC3CCCC3)cc2)s1 ZINC000037797440 340787031 /nfs/dbraw/zinc/78/70/31/340787031.db2.gz WYUBRZLBUYKVPF-UHFFFAOYSA-N 0 0 304.484 5.098 20 0 DKADRN CCc1ncc(CNc2ccc(SC3CCCC3)cc2)s1 ZINC000037924430 340788458 /nfs/dbraw/zinc/78/84/58/340788458.db2.gz AZOZMNCRLNNDBS-UHFFFAOYSA-N 0 0 318.511 5.352 20 0 DKADRN CCc1ncc(CNc2ccccc2SC2CCCC2)s1 ZINC000037924527 340788480 /nfs/dbraw/zinc/78/84/80/340788480.db2.gz KTZFDYQHYPTSKR-UHFFFAOYSA-N 0 0 318.511 5.352 20 0 DKADRN Clc1ccc(Cl)c(NCc2nc3ccccc3s2)c1 ZINC000037977636 182948650 /nfs/dbraw/zinc/94/86/50/182948650.db2.gz VMLJHJINBVOJSA-UHFFFAOYSA-N 0 0 309.221 5.215 20 0 DKADRN CC[C@H](Sc1ccccc1)C(=O)Nc1cccc(Cl)c1C ZINC000039426239 334286576 /nfs/dbraw/zinc/28/65/76/334286576.db2.gz PHAIIORUQSGUHO-INIZCTEOSA-N 0 0 319.857 5.158 20 0 DKADRN CC[C@@H](Sc1ccccc1)C(=O)Nc1cccc(Cl)c1C ZINC000039426241 334286644 /nfs/dbraw/zinc/28/66/44/334286644.db2.gz PHAIIORUQSGUHO-MRXNPFEDSA-N 0 0 319.857 5.158 20 0 DKADRN Cc1ccccc1-c1nnc(SCc2ccc(Cl)s2)o1 ZINC000039574654 331686809 /nfs/dbraw/zinc/68/68/09/331686809.db2.gz QAVRYAXWGXIRCO-UHFFFAOYSA-N 0 0 322.842 5.052 20 0 DKADRN O=C(Nc1ccc(Cl)cc1Cl)c1cc(Cl)ccc1F ZINC000040419442 333353005 /nfs/dbraw/zinc/35/30/05/333353005.db2.gz YUSPCLSFQXXKBF-UHFFFAOYSA-N 0 0 318.562 5.038 20 0 DKADRN CC[C@H](Nc1ccc(CCO)cc1)c1ccc(Cl)c(Cl)c1 ZINC000040738747 333535086 /nfs/dbraw/zinc/53/50/86/333535086.db2.gz QFCWKCLBBVXOOO-KRWDZBQOSA-N 0 0 324.251 5.091 20 0 DKADRN CC[C@@H](Nc1ccc(CCO)cc1)c1ccc(Cl)c(Cl)c1 ZINC000040738749 333535012 /nfs/dbraw/zinc/53/50/12/333535012.db2.gz QFCWKCLBBVXOOO-QGZVFWFLSA-N 0 0 324.251 5.091 20 0 DKADRN Cc1cc(C)c(C(=O)Nc2ccc(Cl)cc2Cl)c(C)c1 ZINC000040866889 183144647 /nfs/dbraw/zinc/14/46/47/183144647.db2.gz AKRHYKGDZMXMTI-UHFFFAOYSA-N 0 0 308.208 5.171 20 0 DKADRN Clc1ccc(CSc2nnc(-c3ccccc3)s2)cc1 ZINC000040947888 183150409 /nfs/dbraw/zinc/15/04/09/183150409.db2.gz BBTHCPVVBBGKBQ-UHFFFAOYSA-N 0 0 318.854 5.151 20 0 DKADRN Clc1ccccc1CSc1nnc(-c2ccccc2)s1 ZINC000040947889 183150823 /nfs/dbraw/zinc/15/08/23/183150823.db2.gz JIEXIFOKWYRFOE-UHFFFAOYSA-N 0 0 318.854 5.151 20 0 DKADRN Clc1cccc(CSc2nnc(-c3ccccc3)s2)c1 ZINC000040947890 183150948 /nfs/dbraw/zinc/15/09/48/183150948.db2.gz IZGKMMGXGWRODK-UHFFFAOYSA-N 0 0 318.854 5.151 20 0 DKADRN Cc1ccc(CCC(=O)Nc2c(C(C)C)cccc2C(C)C)cc1 ZINC000040994525 183155347 /nfs/dbraw/zinc/15/53/47/183155347.db2.gz UYHATIXKXROPHB-UHFFFAOYSA-N 0 0 323.480 5.813 20 0 DKADRN Cc1cc(C)nc(C(=O)Nc2c(C(C)C)cccc2C(C)C)c1 ZINC000041005473 183155925 /nfs/dbraw/zinc/15/59/25/183155925.db2.gz JHYICURFVURENX-UHFFFAOYSA-N 0 0 310.441 5.198 20 0 DKADRN COc1ccccc1SCc1cc2ccccc2nc1Cl ZINC000041030442 183157572 /nfs/dbraw/zinc/15/75/72/183157572.db2.gz ZTXNAIAJEKGJNF-UHFFFAOYSA-N 0 0 315.825 5.189 20 0 DKADRN CCc1ccc([C@@H](C)Nc2ccc(NC(C)=O)c(Cl)c2)s1 ZINC000041203925 333552911 /nfs/dbraw/zinc/55/29/11/333552911.db2.gz PIWOLFBNTYHOJO-SNVBAGLBSA-N 0 0 322.861 5.095 20 0 DKADRN CC(C)c1cccc(C(C)C)c1NC(=O)N(C)Cc1ccco1 ZINC000043170799 337410012 /nfs/dbraw/zinc/41/00/12/337410012.db2.gz BIVOEKMLOASLNN-UHFFFAOYSA-N 0 0 314.429 5.190 20 0 DKADRN CC(C)CN(C(=O)Nc1c(C(C)C)cccc1C(C)C)C1CC1 ZINC000043170917 336246604 /nfs/dbraw/zinc/24/66/04/336246604.db2.gz GMBOAQATRHFOQP-UHFFFAOYSA-N 0 0 316.489 5.586 20 0 DKADRN CC(C)c1cccc(C(C)C)c1NC(=O)N1CCCCCC1 ZINC000043171610 340709830 /nfs/dbraw/zinc/70/98/30/340709830.db2.gz OBBXDZCWBGELJU-UHFFFAOYSA-N 0 0 302.462 5.341 20 0 DKADRN Cc1cc(Cl)ccc1NC(=O)N(C)[C@@H](C)c1ccc(F)cc1 ZINC000043172489 336246555 /nfs/dbraw/zinc/24/65/55/336246555.db2.gz VGRLWVHIZKEWRW-LBPRGKRZSA-N 0 0 320.795 5.012 20 0 DKADRN Cc1cc(Cl)ccc1NC(=O)N(C)[C@H](C)c1ccc(F)cc1 ZINC000043172491 336246563 /nfs/dbraw/zinc/24/65/63/336246563.db2.gz VGRLWVHIZKEWRW-GFCCVEGCSA-N 0 0 320.795 5.012 20 0 DKADRN Cc1cc(Cl)ccc1NC(=O)N1CCC[C@@H]1c1cccs1 ZINC000043173209 337409984 /nfs/dbraw/zinc/40/99/84/337409984.db2.gz LHAYVDBRGYNYQA-CQSZACIVSA-N 0 0 320.845 5.079 20 0 DKADRN Cc1cc(Cl)ccc1NC(=O)N1CCC[C@H]1c1cccs1 ZINC000043173211 337410006 /nfs/dbraw/zinc/41/00/06/337410006.db2.gz LHAYVDBRGYNYQA-AWEZNQCLSA-N 0 0 320.845 5.079 20 0 DKADRN Cc1c(Cl)cccc1NC(=O)N(C)[C@@H](C)c1ccc(F)cc1 ZINC000043173991 336246647 /nfs/dbraw/zinc/24/66/47/336246647.db2.gz ISGFOJZQPJNDFE-LBPRGKRZSA-N 0 0 320.795 5.012 20 0 DKADRN Cc1c(Cl)cccc1NC(=O)N(C)[C@H](C)c1ccc(F)cc1 ZINC000043173993 336246676 /nfs/dbraw/zinc/24/66/76/336246676.db2.gz ISGFOJZQPJNDFE-GFCCVEGCSA-N 0 0 320.795 5.012 20 0 DKADRN CC(C)c1ccc(NC(=O)N2CCC[C@@H]2c2cccs2)cc1 ZINC000043192375 336246170 /nfs/dbraw/zinc/24/61/70/336246170.db2.gz PWBAAMORKJNVBG-MRXNPFEDSA-N 0 0 314.454 5.241 20 0 DKADRN CC(C)c1ccc(NC(=O)N2CCC[C@H]2c2cccs2)cc1 ZINC000043192376 336246126 /nfs/dbraw/zinc/24/61/26/336246126.db2.gz PWBAAMORKJNVBG-INIZCTEOSA-N 0 0 314.454 5.241 20 0 DKADRN CC(C)c1ccc(NC(=O)N(C)[C@@H](C)c2cccs2)cc1 ZINC000043192428 336246190 /nfs/dbraw/zinc/24/61/90/336246190.db2.gz MBSZNIONRTWVKT-ZDUSSCGKSA-N 0 0 302.443 5.096 20 0 DKADRN CC(C)c1ccc(NC(=O)N(C)[C@H](C)c2cccs2)cc1 ZINC000043192429 336246216 /nfs/dbraw/zinc/24/62/16/336246216.db2.gz MBSZNIONRTWVKT-CYBMUJFWSA-N 0 0 302.443 5.096 20 0 DKADRN CC(C)c1ccccc1NC(=O)N(C)[C@@H](C)c1cccs1 ZINC000043231715 336246714 /nfs/dbraw/zinc/24/67/14/336246714.db2.gz ALJCJNSJNFMOPN-ZDUSSCGKSA-N 0 0 302.443 5.096 20 0 DKADRN CC(C)c1ccccc1NC(=O)N(C)[C@H](C)c1cccs1 ZINC000043231718 336246736 /nfs/dbraw/zinc/24/67/36/336246736.db2.gz ALJCJNSJNFMOPN-CYBMUJFWSA-N 0 0 302.443 5.096 20 0 DKADRN Cc1cccc(C(C)C)c1NC(=O)NCc1ccc(Cl)s1 ZINC000043281455 336252851 /nfs/dbraw/zinc/25/28/51/336252851.db2.gz XZBZAMPOGCVGOY-UHFFFAOYSA-N 0 0 322.861 5.155 20 0 DKADRN Cc1cccc(C(C)C)c1NC(=O)N(C)[C@@H](C)c1cccs1 ZINC000043313483 336254268 /nfs/dbraw/zinc/25/42/68/336254268.db2.gz LUHCRNQXHZOBBI-AWEZNQCLSA-N 0 0 316.470 5.405 20 0 DKADRN Cc1cccc(C(C)C)c1NC(=O)N(C)[C@H](C)c1cccs1 ZINC000043313484 336254264 /nfs/dbraw/zinc/25/42/64/336254264.db2.gz LUHCRNQXHZOBBI-CQSZACIVSA-N 0 0 316.470 5.405 20 0 DKADRN Cc1ccccc1CN(C)C(=O)Nc1c(C)cccc1C(C)C ZINC000043313591 183354724 /nfs/dbraw/zinc/35/47/24/183354724.db2.gz KSAJKKHBQRTIRV-UHFFFAOYSA-N 0 0 310.441 5.091 20 0 DKADRN CC(C)(C)c1ccccc1NC(=O)NCc1ccc(Cl)s1 ZINC000043314282 331694746 /nfs/dbraw/zinc/69/47/46/331694746.db2.gz PPKXQIPWQSLDLL-UHFFFAOYSA-N 0 0 322.861 5.021 20 0 DKADRN C[C@@H](c1cccs1)N(C)C(=O)Nc1ccccc1C(C)(C)C ZINC000043316058 336253553 /nfs/dbraw/zinc/25/35/53/336253553.db2.gz XQGGHSAPVTUZCV-ZDUSSCGKSA-N 0 0 316.470 5.271 20 0 DKADRN C[C@H](c1cccs1)N(C)C(=O)Nc1ccccc1C(C)(C)C ZINC000043316060 336253583 /nfs/dbraw/zinc/25/35/83/336253583.db2.gz XQGGHSAPVTUZCV-CYBMUJFWSA-N 0 0 316.470 5.271 20 0 DKADRN CCc1cccc(CC)c1NC(=O)N(C)[C@@H](C)c1cccs1 ZINC000043341049 336253844 /nfs/dbraw/zinc/25/38/44/336253844.db2.gz VXTAUZBTFKLRTB-ZDUSSCGKSA-N 0 0 316.470 5.098 20 0 DKADRN CCc1cccc(CC)c1NC(=O)N(C)[C@H](C)c1cccs1 ZINC000043341051 336253871 /nfs/dbraw/zinc/25/38/71/336253871.db2.gz VXTAUZBTFKLRTB-CYBMUJFWSA-N 0 0 316.470 5.098 20 0 DKADRN CCc1ccc(CN(C(=O)Nc2c(C)cccc2C)C2CC2)cc1 ZINC000043357946 336253960 /nfs/dbraw/zinc/25/39/60/336253960.db2.gz GIWLCKKARBDUEO-UHFFFAOYSA-N 0 0 322.452 5.062 20 0 DKADRN CC(C)c1cccc(NC(=O)N(C)[C@@H](C)c2cccs2)c1 ZINC000043551795 336265115 /nfs/dbraw/zinc/26/51/15/336265115.db2.gz GQERCWLDONMDFM-ZDUSSCGKSA-N 0 0 302.443 5.096 20 0 DKADRN CC(C)c1cccc(NC(=O)N(C)[C@H](C)c2cccs2)c1 ZINC000043551796 336265025 /nfs/dbraw/zinc/26/50/25/336265025.db2.gz GQERCWLDONMDFM-CYBMUJFWSA-N 0 0 302.443 5.096 20 0 DKADRN Cc1ccc(-c2nnc(S[C@@H](C)c3ccccc3F)o2)cc1 ZINC000044030108 337805619 /nfs/dbraw/zinc/80/56/19/337805619.db2.gz XZEOSTZASNPCKG-LBPRGKRZSA-N 0 0 314.385 5.037 20 0 DKADRN c1ccc2c(c1)cccc2CSc1nncc2ccccc21 ZINC000044156512 183396649 /nfs/dbraw/zinc/39/66/49/183396649.db2.gz QWQCPZKESSUSNV-UHFFFAOYSA-N 0 0 302.402 5.075 20 0 DKADRN C[C@H](Sc1ccc(Cl)cc1)c1nnc(-c2ccccc2)o1 ZINC000045411390 183504623 /nfs/dbraw/zinc/50/46/23/183504623.db2.gz MNRXTSBWLKLXDY-NSHDSACASA-N 0 0 316.813 5.243 20 0 DKADRN CCCc1ccccc1NC(=O)c1cc(Cl)sc1Cl ZINC000046302631 337832937 /nfs/dbraw/zinc/83/29/37/337832937.db2.gz PEHVWPCAMRWSGF-UHFFFAOYSA-N 0 0 314.237 5.260 20 0 DKADRN Cc1cccc(C(C)C)c1NC(=O)[C@@H]1CCCc2ccccc21 ZINC000046544464 183564573 /nfs/dbraw/zinc/56/45/73/183564573.db2.gz YWURXDHGOPRZFP-LJQANCHMSA-N 0 0 307.437 5.177 20 0 DKADRN CCN(C(=O)Nc1cccc(C)c1C)[C@H](C)c1ccc(F)cc1 ZINC000047322190 331536652 /nfs/dbraw/zinc/53/66/52/331536652.db2.gz ILMWREBCAJLXDE-OAHLLOKOSA-N 0 0 314.404 5.058 20 0 DKADRN Cc1ccc(NC(=O)N(C)[C@H](C)c2ccccc2F)c(Cl)c1 ZINC000047326834 183587053 /nfs/dbraw/zinc/58/70/53/183587053.db2.gz LHBLGIDXYQXYPB-GFCCVEGCSA-N 0 0 320.795 5.012 20 0 DKADRN CC(C)c1ccccc1NC(=O)N(C)[C@@H](C)c1ccccc1F ZINC000047333925 331537856 /nfs/dbraw/zinc/53/78/56/331537856.db2.gz NRYKGLXHWVQGKW-AWEZNQCLSA-N 0 0 314.404 5.174 20 0 DKADRN CC(C)c1ccccc1NC(=O)N(C)[C@H](C)c1ccccc1F ZINC000047333926 331538031 /nfs/dbraw/zinc/53/80/31/331538031.db2.gz NRYKGLXHWVQGKW-CQSZACIVSA-N 0 0 314.404 5.174 20 0 DKADRN Cc1ccc(Cl)cc1NC(=O)N(C)[C@@H](C)c1ccccc1F ZINC000047346847 331543290 /nfs/dbraw/zinc/54/32/90/331543290.db2.gz FHULNLKLWWBMAZ-LBPRGKRZSA-N 0 0 320.795 5.012 20 0 DKADRN CCSc1nnc(SCc2ccc(C(C)(C)C)cc2)s1 ZINC000047819828 331662875 /nfs/dbraw/zinc/66/28/75/331662875.db2.gz YJIFIOKLYQDDKF-UHFFFAOYSA-N 0 0 324.540 5.240 20 0 DKADRN O=C(CC1CCCC1)Nc1cc(Cl)c(Cl)cc1Cl ZINC000047831789 331678818 /nfs/dbraw/zinc/67/88/18/331678818.db2.gz VSCOJPOHWBWYMF-UHFFFAOYSA-N 0 0 306.620 5.166 20 0 DKADRN CCc1cccc(C)c1NC(=O)N1CCC[C@@H]1c1ccccc1C ZINC000048051044 333564965 /nfs/dbraw/zinc/56/49/65/333564965.db2.gz SSANZLKJMDWKAY-LJQANCHMSA-N 0 0 322.452 5.235 20 0 DKADRN C[C@@H](NCc1csc2ccccc12)c1c(F)cccc1F ZINC000048327240 333585548 /nfs/dbraw/zinc/58/55/48/333585548.db2.gz DRDYFDYKOBHATJ-LLVKDONJSA-N 0 0 303.377 5.030 20 0 DKADRN Cc1c(Cl)cccc1NC(=O)[C@@H](C)SC1CCCCC1 ZINC000048379986 334279223 /nfs/dbraw/zinc/27/92/23/334279223.db2.gz HKCGPNPUTDQLSO-GFCCVEGCSA-N 0 0 311.878 5.041 20 0 DKADRN Cc1c(Cl)cccc1NC(=O)[C@H](C)SC1CCCCC1 ZINC000048379988 334279159 /nfs/dbraw/zinc/27/91/59/334279159.db2.gz HKCGPNPUTDQLSO-LBPRGKRZSA-N 0 0 311.878 5.041 20 0 DKADRN Cc1ccc(Cl)cc1NC(=O)[C@@H](C)SC1CCCCC1 ZINC000048380016 334279176 /nfs/dbraw/zinc/27/91/76/334279176.db2.gz ZKWYTGJOXMFVPQ-GFCCVEGCSA-N 0 0 311.878 5.041 20 0 DKADRN Cc1ccc(Cl)cc1NC(=O)[C@H](C)SC1CCCCC1 ZINC000048380018 334279147 /nfs/dbraw/zinc/27/91/47/334279147.db2.gz ZKWYTGJOXMFVPQ-LBPRGKRZSA-N 0 0 311.878 5.041 20 0 DKADRN CCCCSc1nnc(SCc2ccc(C)cc2)s1 ZINC000048395903 334283064 /nfs/dbraw/zinc/28/30/64/334283064.db2.gz BVELBWRMXIDUSD-UHFFFAOYSA-N 0 0 310.513 5.031 20 0 DKADRN CCCCSc1nnc(SCc2cccc(C)c2)s1 ZINC000048395924 334282976 /nfs/dbraw/zinc/28/29/76/334282976.db2.gz BQLZSBOJIWZORX-UHFFFAOYSA-N 0 0 310.513 5.031 20 0 DKADRN CCCCSc1nnc(SCc2ccccc2C)s1 ZINC000048395956 334283124 /nfs/dbraw/zinc/28/31/24/334283124.db2.gz BCMSOJVWHUJQJO-UHFFFAOYSA-N 0 0 310.513 5.031 20 0 DKADRN C[C@H](Sc1nccc(C(F)(F)F)n1)c1ccccc1Cl ZINC000048412968 334286590 /nfs/dbraw/zinc/28/65/90/334286590.db2.gz SKICLNQETKRUDN-QMMMGPOBSA-N 0 0 318.751 5.002 20 0 DKADRN C[C@@H](Sc1nccc(C(F)(F)F)n1)c1ccccc1Cl ZINC000048412970 334286616 /nfs/dbraw/zinc/28/66/16/334286616.db2.gz SKICLNQETKRUDN-MRVPVSSYSA-N 0 0 318.751 5.002 20 0 DKADRN Clc1ccc(CSc2nncc3ccccc32)c(Cl)c1 ZINC000048429162 183658162 /nfs/dbraw/zinc/65/81/62/183658162.db2.gz VUISRKLGHOZXSI-UHFFFAOYSA-N 0 0 321.232 5.229 20 0 DKADRN CCCc1nc(CSc2nc3cc(Cl)ccc3o2)cs1 ZINC000048434093 334286117 /nfs/dbraw/zinc/28/61/17/334286117.db2.gz CBRIHVLQSYBAKL-UHFFFAOYSA-N 0 0 324.858 5.183 20 0 DKADRN Clc1cc2cccnc2c(CSc2ncccc2Cl)c1 ZINC000048443746 334290250 /nfs/dbraw/zinc/29/02/50/334290250.db2.gz JQKVKRIMNMTLGH-UHFFFAOYSA-N 0 0 321.232 5.229 20 0 DKADRN Cc1nc(Cc2nc(-c3cccc(Cl)c3)c(C)s2)cs1 ZINC000048447809 334290299 /nfs/dbraw/zinc/29/02/99/334290299.db2.gz HEPSVOFFSHELRD-UHFFFAOYSA-N 0 0 320.870 5.128 20 0 DKADRN Clc1ccc(CSc2ncccc2Cl)c2ncccc12 ZINC000048464902 334290514 /nfs/dbraw/zinc/29/05/14/334290514.db2.gz VPJWVTXNFXUXCB-UHFFFAOYSA-N 0 0 321.232 5.229 20 0 DKADRN CN(C(=O)Nc1cc(Cl)ccc1Cl)C1CCCCCC1 ZINC000048468916 334290436 /nfs/dbraw/zinc/29/04/36/334290436.db2.gz BRHKCJZUEPQKOU-UHFFFAOYSA-N 0 0 315.244 5.180 20 0 DKADRN CC1CCC(N(C)C(=O)Nc2cc(Cl)ccc2Cl)CC1 ZINC000048468927 334290561 /nfs/dbraw/zinc/29/05/61/334290561.db2.gz URRNDCNYCMKRGC-UHFFFAOYSA-N 0 0 315.244 5.036 20 0 DKADRN CC1CCC(N(C)C(=O)Nc2cccc(Cl)c2Cl)CC1 ZINC000048469884 334290515 /nfs/dbraw/zinc/29/05/15/334290515.db2.gz YYXMFNFWIUDZCZ-UHFFFAOYSA-N 0 0 315.244 5.036 20 0 DKADRN Clc1ccc2cccnc2c1CSc1ncccc1Cl ZINC000048499262 334287007 /nfs/dbraw/zinc/28/70/07/334287007.db2.gz NZXMSUQZVWNJKQ-UHFFFAOYSA-N 0 0 321.232 5.229 20 0 DKADRN Cc1sc(-c2ccccc2O)nc1-c1ccc(Cl)cc1 ZINC000048785607 334299272 /nfs/dbraw/zinc/29/92/72/334299272.db2.gz NRSIKFFUOVZJPA-UHFFFAOYSA-N 0 0 301.798 5.145 20 0 DKADRN Cc1sc(-c2ccccc2O)nc1-c1cccc(Cl)c1 ZINC000048785624 334299233 /nfs/dbraw/zinc/29/92/33/334299233.db2.gz ARKQCXIUQISISD-UHFFFAOYSA-N 0 0 301.798 5.145 20 0 DKADRN O=C(Nc1ccc(Cl)c(F)c1)c1ccc(Cl)cc1Cl ZINC000048791472 334299527 /nfs/dbraw/zinc/29/95/27/334299527.db2.gz MYKCEQKBLZEUNE-UHFFFAOYSA-N 0 0 318.562 5.038 20 0 DKADRN O=C(Nc1ccc(Cl)c(F)c1)c1cccc(Cl)c1Cl ZINC000048824981 334301511 /nfs/dbraw/zinc/30/15/11/334301511.db2.gz GOLXAXPDFCACJJ-UHFFFAOYSA-N 0 0 318.562 5.038 20 0 DKADRN O=C(Nc1ccc(Cl)c(F)c1)c1cc(Cl)ccc1Cl ZINC000048824983 334301589 /nfs/dbraw/zinc/30/15/89/334301589.db2.gz AFVPQJGARLBWIF-UHFFFAOYSA-N 0 0 318.562 5.038 20 0 DKADRN C[C@H](Sc1nnc(-c2cccs2)o1)c1ccc(Cl)cc1 ZINC000048833875 334301484 /nfs/dbraw/zinc/30/14/84/334301484.db2.gz YIGUHDKZLOKDMS-VIFPVBQESA-N 0 0 322.842 5.305 20 0 DKADRN C[C@@H](Sc1nnc(-c2cccs2)o1)c1ccc(Cl)cc1 ZINC000048833877 334301469 /nfs/dbraw/zinc/30/14/69/334301469.db2.gz YIGUHDKZLOKDMS-SECBINFHSA-N 0 0 322.842 5.305 20 0 DKADRN C[C@H](Sc1nnc(-c2cccs2)o1)c1cccc(Cl)c1 ZINC000048833879 334301562 /nfs/dbraw/zinc/30/15/62/334301562.db2.gz CHPQLMVKDAZUIT-VIFPVBQESA-N 0 0 322.842 5.305 20 0 DKADRN C[C@@H](Sc1nnc(-c2cccs2)o1)c1cccc(Cl)c1 ZINC000048833881 334301617 /nfs/dbraw/zinc/30/16/17/334301617.db2.gz CHPQLMVKDAZUIT-SECBINFHSA-N 0 0 322.842 5.305 20 0 DKADRN CC(=O)Nc1ccc(S[C@@H](C)c2ccc(Cl)cc2)cc1 ZINC000048833885 334301512 /nfs/dbraw/zinc/30/15/12/334301512.db2.gz DTTJMKWTSDEHLZ-NSHDSACASA-N 0 0 305.830 5.152 20 0 DKADRN CC(=O)Nc1ccc(S[C@H](C)c2ccc(Cl)cc2)cc1 ZINC000048833887 334301474 /nfs/dbraw/zinc/30/14/74/334301474.db2.gz DTTJMKWTSDEHLZ-LLVKDONJSA-N 0 0 305.830 5.152 20 0 DKADRN CC(=O)Nc1ccc(S[C@@H](C)c2cccc(Cl)c2)cc1 ZINC000048833889 334301534 /nfs/dbraw/zinc/30/15/34/334301534.db2.gz BUJOPJMHOBRCDX-NSHDSACASA-N 0 0 305.830 5.152 20 0 DKADRN CC(=O)Nc1ccc(S[C@H](C)c2cccc(Cl)c2)cc1 ZINC000048833891 334301580 /nfs/dbraw/zinc/30/15/80/334301580.db2.gz BUJOPJMHOBRCDX-LLVKDONJSA-N 0 0 305.830 5.152 20 0 DKADRN C[C@H](Sc1ncnc2ccsc21)c1cccc(Cl)c1 ZINC000048834315 334301708 /nfs/dbraw/zinc/30/17/08/334301708.db2.gz MYGMXSFLIIMXPA-VIFPVBQESA-N 0 0 306.843 5.198 20 0 DKADRN C[C@@H](Sc1ncnc2ccsc21)c1cccc(Cl)c1 ZINC000048834317 334301712 /nfs/dbraw/zinc/30/17/12/334301712.db2.gz MYGMXSFLIIMXPA-SECBINFHSA-N 0 0 306.843 5.198 20 0 DKADRN CC(C)c1ccsc1C(=O)Nc1cc(Cl)ccc1Cl ZINC000048876825 334300441 /nfs/dbraw/zinc/30/04/41/334300441.db2.gz TXCXJJIJKKEFSW-UHFFFAOYSA-N 0 0 314.237 5.431 20 0 DKADRN CC(C)c1ccsc1C(=O)Nc1ccc(Cl)cc1Cl ZINC000048876979 334300912 /nfs/dbraw/zinc/30/09/12/334300912.db2.gz VMAHGPITNDJVRO-UHFFFAOYSA-N 0 0 314.237 5.431 20 0 DKADRN CC(C)c1ccsc1C(=O)Nc1cc(Cl)cc(Cl)c1 ZINC000048876984 334300874 /nfs/dbraw/zinc/30/08/74/334300874.db2.gz PUUYDUYXPGZTQW-UHFFFAOYSA-N 0 0 314.237 5.431 20 0 DKADRN CC(C)c1ccsc1C(=O)Nc1ccc(Cl)c(Cl)c1 ZINC000048888899 334300808 /nfs/dbraw/zinc/30/08/08/334300808.db2.gz PUYUVABIZONHOY-UHFFFAOYSA-N 0 0 314.237 5.431 20 0 DKADRN CC(C)c1ccsc1C(=O)N[C@@H](C)c1ccccc1Cl ZINC000048889527 334300881 /nfs/dbraw/zinc/30/08/81/334300881.db2.gz NDNCOWJKYYJRMB-NSHDSACASA-N 0 0 307.846 5.016 20 0 DKADRN CC(C)c1ccsc1C(=O)N[C@H](C)c1ccccc1Cl ZINC000048889528 334300834 /nfs/dbraw/zinc/30/08/34/334300834.db2.gz NDNCOWJKYYJRMB-LLVKDONJSA-N 0 0 307.846 5.016 20 0 DKADRN Cc1cc([C@@H](C)NC(=O)c2sccc2C(C)C)c(C)s1 ZINC000048891543 334300951 /nfs/dbraw/zinc/30/09/51/334300951.db2.gz NQJKPMRRFLFJGG-LLVKDONJSA-N 0 0 307.484 5.041 20 0 DKADRN Cc1cc([C@H](C)NC(=O)c2sccc2C(C)C)c(C)s1 ZINC000048891545 334300949 /nfs/dbraw/zinc/30/09/49/334300949.db2.gz NQJKPMRRFLFJGG-NSHDSACASA-N 0 0 307.484 5.041 20 0 DKADRN CC(C)c1ccsc1C(=O)N[C@H](C)c1cccc(Cl)c1 ZINC000048910080 334301329 /nfs/dbraw/zinc/30/13/29/334301329.db2.gz VYWJMAJQYCQFAW-LLVKDONJSA-N 0 0 307.846 5.016 20 0 DKADRN O=C(Nc1ccc(Cl)c(Cl)c1)c1sccc1C1CC1 ZINC000049375593 334327222 /nfs/dbraw/zinc/32/72/22/334327222.db2.gz SOOXLNDMWPJRIL-UHFFFAOYSA-N 0 0 312.221 5.185 20 0 DKADRN C[C@H](Sc1ncnc2ccsc21)c1ccc(Cl)cc1 ZINC000049469585 334338614 /nfs/dbraw/zinc/33/86/14/334338614.db2.gz HSVDLHTYGXUHHC-VIFPVBQESA-N 0 0 306.843 5.198 20 0 DKADRN C[C@@H](Sc1ncnc2ccsc21)c1ccc(Cl)cc1 ZINC000049469586 334338599 /nfs/dbraw/zinc/33/85/99/334338599.db2.gz HSVDLHTYGXUHHC-SECBINFHSA-N 0 0 306.843 5.198 20 0 DKADRN C[C@H](Sc1ncnc2sccc21)c1ccc(Cl)cc1 ZINC000049469621 334338638 /nfs/dbraw/zinc/33/86/38/334338638.db2.gz KGPNYXWOQUKSCC-VIFPVBQESA-N 0 0 306.843 5.198 20 0 DKADRN C[C@@H](Sc1ncnc2sccc21)c1ccc(Cl)cc1 ZINC000049469624 334338596 /nfs/dbraw/zinc/33/85/96/334338596.db2.gz KGPNYXWOQUKSCC-SECBINFHSA-N 0 0 306.843 5.198 20 0 DKADRN Cc1cc(CNc2cccc(-c3nccs3)c2)c(C)s1 ZINC000049686826 334357639 /nfs/dbraw/zinc/35/76/39/334357639.db2.gz JIZSNLOZQKXLGV-UHFFFAOYSA-N 0 0 300.452 5.101 20 0 DKADRN Cc1nc(CNc2ccc(Oc3ccccc3)cc2)sc1C ZINC000049922570 334360795 /nfs/dbraw/zinc/36/07/95/334360795.db2.gz KMGFPWDVRFCXOT-UHFFFAOYSA-N 0 0 310.422 5.164 20 0 DKADRN Cc1c(Cl)c(CSc2ccccc2O)nc2ccccc12 ZINC000050046671 334363544 /nfs/dbraw/zinc/36/35/44/334363544.db2.gz CVZRJWBNWIPZBT-UHFFFAOYSA-N 0 0 315.825 5.195 20 0 DKADRN C[C@H]([NH2+][C@@H](C)c1ccc(Cl)c(Cl)c1)c1ccsc1 ZINC000050338751 334382152 /nfs/dbraw/zinc/38/21/52/334382152.db2.gz IUSDOINRSUUHLG-UWVGGRQHSA-N 0 0 300.254 5.467 20 0 DKADRN C[C@@H]([NH2+][C@@H](C)c1ccsc1)c1ccc(Cl)c(Cl)c1 ZINC000050338754 334382190 /nfs/dbraw/zinc/38/21/90/334382190.db2.gz IUSDOINRSUUHLG-ZJUUUORDSA-N 0 0 300.254 5.467 20 0 DKADRN C[C@@H]([NH2+][C@@H](C)c1ccc(Cl)c(Cl)c1)c1ccsc1 ZINC000050338758 334382143 /nfs/dbraw/zinc/38/21/43/334382143.db2.gz IUSDOINRSUUHLG-VHSXEESVSA-N 0 0 300.254 5.467 20 0 DKADRN C[C@@H]([NH2+][C@H](C)c1ccc(Cl)c(Cl)c1)c1ccsc1 ZINC000050338761 334382093 /nfs/dbraw/zinc/38/20/93/334382093.db2.gz IUSDOINRSUUHLG-NXEZZACHSA-N 0 0 300.254 5.467 20 0 DKADRN Cc1nc(-c2cccc(N[C@@H](C)c3ccsc3)c2)cs1 ZINC000050341888 334382116 /nfs/dbraw/zinc/38/21/16/334382116.db2.gz UCVPTLKIVVKZKB-NSHDSACASA-N 0 0 300.452 5.353 20 0 DKADRN Cc1nc(-c2cccc(N[C@H](C)c3ccsc3)c2)cs1 ZINC000050341890 334381995 /nfs/dbraw/zinc/38/19/95/334381995.db2.gz UCVPTLKIVVKZKB-LLVKDONJSA-N 0 0 300.452 5.353 20 0 DKADRN C[C@H]([NH2+][C@@H]1CCSc2ccc(Cl)cc21)c1ccsc1 ZINC000050342261 332351145 /nfs/dbraw/zinc/35/11/45/332351145.db2.gz LWBMQXIPWSANPS-IINYFYTJSA-N 0 0 309.887 5.289 20 0 DKADRN C[C@@H]([NH2+][C@@H]1CCSc2ccc(Cl)cc21)c1ccsc1 ZINC000050342262 332350989 /nfs/dbraw/zinc/35/09/89/332350989.db2.gz LWBMQXIPWSANPS-QMTHXVAHSA-N 0 0 309.887 5.289 20 0 DKADRN C[C@H]([NH2+][C@H]1CCSc2ccc(Cl)cc21)c1ccsc1 ZINC000050342265 332351162 /nfs/dbraw/zinc/35/11/62/332351162.db2.gz LWBMQXIPWSANPS-HZMBPMFUSA-N 0 0 309.887 5.289 20 0 DKADRN C[C@@H]([NH2+][C@H]1CCSc2ccc(Cl)cc21)c1ccsc1 ZINC000050342267 332351034 /nfs/dbraw/zinc/35/10/34/332351034.db2.gz LWBMQXIPWSANPS-YGRLFVJLSA-N 0 0 309.887 5.289 20 0 DKADRN CCc1ccc(CNc2cccc(-c3nccs3)c2)s1 ZINC000051718540 335762053 /nfs/dbraw/zinc/76/20/53/335762053.db2.gz JXFBCWXMSJBNST-UHFFFAOYSA-N 0 0 300.452 5.046 20 0 DKADRN CC(C)Oc1ccc(NC(=O)c2sccc2C(C)C)c(F)c1 ZINC000052020033 335783836 /nfs/dbraw/zinc/78/38/36/335783836.db2.gz JRAGVRDBDBSJRR-UHFFFAOYSA-N 0 0 321.417 5.050 20 0 DKADRN Fc1ccc(CNCc2c(Cl)cccc2Cl)cc1Cl ZINC000053149413 183890145 /nfs/dbraw/zinc/89/01/45/183890145.db2.gz GLVGEMCIJATOTK-UHFFFAOYSA-N 0 0 318.606 5.076 20 0 DKADRN Fc1ccc(CNCc2ccc(Cl)cc2Cl)cc1Cl ZINC000053155417 335835434 /nfs/dbraw/zinc/83/54/34/335835434.db2.gz BBPQLORPTQGIMD-UHFFFAOYSA-N 0 0 318.606 5.076 20 0 DKADRN O=C(CSc1cccc(Cl)c1)c1ccc(Cl)s1 ZINC000054185814 335876003 /nfs/dbraw/zinc/87/60/03/335876003.db2.gz RHODODJIXJQEBM-UHFFFAOYSA-N 0 0 303.235 5.030 20 0 DKADRN CCN(C(=O)Nc1ccccc1)[C@H](C)c1cc2ccccc2o1 ZINC000055085963 337845262 /nfs/dbraw/zinc/84/52/62/337845262.db2.gz TZZLZPHYHWUUKM-CQSZACIVSA-N 0 0 308.381 5.048 20 0 DKADRN CC[C@@H](C)C(=O)N(c1nc2ccccc2s1)c1ccccc1C ZINC000055292008 337846834 /nfs/dbraw/zinc/84/68/34/337846834.db2.gz JUXXLJIAQTUXSV-CYBMUJFWSA-N 0 0 324.449 5.316 20 0 DKADRN CC[C@H](C)C(=O)N(c1nc2ccccc2s1)c1ccccc1C ZINC000055292010 337846824 /nfs/dbraw/zinc/84/68/24/337846824.db2.gz JUXXLJIAQTUXSV-ZDUSSCGKSA-N 0 0 324.449 5.316 20 0 DKADRN CCN(C(=O)Nc1ccccc1C)[C@@H](C)c1cc2ccccc2o1 ZINC000056519810 337852370 /nfs/dbraw/zinc/85/23/70/337852370.db2.gz ZKCYAXONWAIHKY-HNNXBMFYSA-N 0 0 322.408 5.356 20 0 DKADRN Cc1cccc(C(C)C)c1NC(=O)N1CCC[C@@H]1C1CCCC1 ZINC000056542996 337851736 /nfs/dbraw/zinc/85/17/36/337851736.db2.gz VINDFDGXFBDHTI-GOSISDBHSA-N 0 0 314.473 5.305 20 0 DKADRN Cc1cccc(C(C)C)c1NC(=O)N1CCC[C@H]1C1CCCC1 ZINC000056542998 337851786 /nfs/dbraw/zinc/85/17/86/337851786.db2.gz VINDFDGXFBDHTI-SFHVURJKSA-N 0 0 314.473 5.305 20 0 DKADRN Cc1ccccc1C(=O)Nc1cccc(Oc2ccccc2)c1 ZINC000057355937 184035608 /nfs/dbraw/zinc/03/56/08/184035608.db2.gz OMJGEBAOYIXIOB-UHFFFAOYSA-N 0 0 303.361 5.040 20 0 DKADRN Cc1cccc(C(C)C)c1NC(=O)C[C@@H](C)c1ccc(F)cc1 ZINC000057400411 184037464 /nfs/dbraw/zinc/03/74/64/184037464.db2.gz RDWOTHRMOXYEPJ-OAHLLOKOSA-N 0 0 313.416 5.390 20 0 DKADRN Cc1cccc(C(C)C)c1NC(=O)C[C@H](C)c1ccc(F)cc1 ZINC000057400412 184037636 /nfs/dbraw/zinc/03/76/36/184037636.db2.gz RDWOTHRMOXYEPJ-HNNXBMFYSA-N 0 0 313.416 5.390 20 0 DKADRN COc1ccccc1-c1nc(-c2ccc(SC)cc2)cs1 ZINC000057460961 184038964 /nfs/dbraw/zinc/03/89/64/184038964.db2.gz OVUPEAJBKCDBEG-UHFFFAOYSA-N 0 0 313.447 5.208 20 0 DKADRN CCCSc1nnc(-c2ccccc2Cl)n1C1CCCC1 ZINC000058044376 337868823 /nfs/dbraw/zinc/86/88/23/337868823.db2.gz IEUSASUBTYWJGP-UHFFFAOYSA-N 0 0 321.877 5.216 20 0 DKADRN C[C@H](NCc1ccsc1)c1cc(F)c(Cl)cc1Cl ZINC000058153513 337870173 /nfs/dbraw/zinc/87/01/73/337870173.db2.gz LZOBDSZGQZJEKO-QMMMGPOBSA-N 0 0 304.217 5.045 20 0 DKADRN C[C@H](Sc1ccc(Cl)cc1)c1nc(-c2ccccc2)no1 ZINC000058271406 184098352 /nfs/dbraw/zinc/09/83/52/184098352.db2.gz IMQSYPAHVJNWRI-NSHDSACASA-N 0 0 316.813 5.243 20 0 DKADRN C[C@@H](Sc1ccc(Cl)cc1)c1nc(-c2ccccc2)no1 ZINC000058271408 184098531 /nfs/dbraw/zinc/09/85/31/184098531.db2.gz IMQSYPAHVJNWRI-LLVKDONJSA-N 0 0 316.813 5.243 20 0 DKADRN CC(C)c1ccc(N[C@@H](C)C(=O)Nc2ccccc2C(C)C)cc1 ZINC000058271718 184098231 /nfs/dbraw/zinc/09/82/31/184098231.db2.gz FACQICMDXCOMMP-INIZCTEOSA-N 0 0 324.468 5.373 20 0 DKADRN CC(C)c1ccc(N[C@H](C)C(=O)Nc2ccccc2C(C)C)cc1 ZINC000058271720 184098208 /nfs/dbraw/zinc/09/82/08/184098208.db2.gz FACQICMDXCOMMP-MRXNPFEDSA-N 0 0 324.468 5.373 20 0 DKADRN C[C@H](Sc1ccccc1Cl)c1nc(-c2ccccc2)no1 ZINC000058271730 184098378 /nfs/dbraw/zinc/09/83/78/184098378.db2.gz NRFHJLUPRZEIKP-NSHDSACASA-N 0 0 316.813 5.243 20 0 DKADRN C[C@@H](Sc1ccccc1Cl)c1nc(-c2ccccc2)no1 ZINC000058271732 184098301 /nfs/dbraw/zinc/09/83/01/184098301.db2.gz NRFHJLUPRZEIKP-LLVKDONJSA-N 0 0 316.813 5.243 20 0 DKADRN Cc1ccc(S[C@@H](C)c2nc(-c3ccccc3)no2)cc1C ZINC000058288499 184100333 /nfs/dbraw/zinc/10/03/33/184100333.db2.gz HKUKFDWOTCZKEI-AWEZNQCLSA-N 0 0 310.422 5.207 20 0 DKADRN Cc1ccc(S[C@H](C)c2nc(-c3ccccc3)no2)cc1C ZINC000058288501 184100142 /nfs/dbraw/zinc/10/01/42/184100142.db2.gz HKUKFDWOTCZKEI-CQSZACIVSA-N 0 0 310.422 5.207 20 0 DKADRN CCN(C(=O)c1cccc(Cl)c1Cl)c1cc(C)ccc1C ZINC000058713938 184126689 /nfs/dbraw/zinc/12/66/89/184126689.db2.gz IQZZGPAITXNAQA-UHFFFAOYSA-N 0 0 322.235 5.277 20 0 DKADRN Cc1nc(Cc2nc(-c3ccc(Cl)cc3)c(C)s2)cs1 ZINC000058755052 184127962 /nfs/dbraw/zinc/12/79/62/184127962.db2.gz WDYCMQLJVFONNI-UHFFFAOYSA-N 0 0 320.870 5.128 20 0 DKADRN Cc1nc(Cc2nc(-c3cc(C)ccc3C)c(C)s2)cs1 ZINC000058755069 184127866 /nfs/dbraw/zinc/12/78/66/184127866.db2.gz DWLCMTWAKYPWNW-UHFFFAOYSA-N 0 0 314.479 5.091 20 0 DKADRN CC(C)c1cccc(C(C)C)c1NC(=O)N[C@H]1CCCC[C@@H]1C ZINC000058829154 337881444 /nfs/dbraw/zinc/88/14/44/337881444.db2.gz BEWPBSXCSLRTQM-YJBOKZPZSA-N 0 0 316.489 5.634 20 0 DKADRN CC(C)c1cccc(C(C)C)c1NC(=O)N[C@@H]1CCCC[C@H]1C ZINC000058829157 337881443 /nfs/dbraw/zinc/88/14/43/337881443.db2.gz BEWPBSXCSLRTQM-CRAIPNDOSA-N 0 0 316.489 5.634 20 0 DKADRN CC(C)c1cccc(C(C)C)c1NC(=O)N[C@@H]1CCCC[C@@H]1C ZINC000058829161 337881487 /nfs/dbraw/zinc/88/14/87/337881487.db2.gz BEWPBSXCSLRTQM-MAUKXSAKSA-N 0 0 316.489 5.634 20 0 DKADRN CC(C)c1cccc(C(C)C)c1NC(=O)N[C@@H](C)c1ccccc1 ZINC000058829232 337881494 /nfs/dbraw/zinc/88/14/94/337881494.db2.gz RBRYBAVUMOTXGU-INIZCTEOSA-N 0 0 324.468 5.816 20 0 DKADRN Clc1cccc(Cl)c1OCc1ncc(-c2ccccc2)o1 ZINC000058830202 184129366 /nfs/dbraw/zinc/12/93/66/184129366.db2.gz MODWJKYWCIIMIX-UHFFFAOYSA-N 0 0 320.175 5.227 20 0 DKADRN CN(Cc1ccccc1)C(=O)Nc1ccc(-c2ccccc2)cc1 ZINC000058843121 340710287 /nfs/dbraw/zinc/71/02/87/340710287.db2.gz IBYIAVZZUUPNNQ-UHFFFAOYSA-N 0 0 316.404 5.018 20 0 DKADRN Cc1cccc(C(C)C)c1NC(=O)NCCC1CCCCC1 ZINC000058849155 340710353 /nfs/dbraw/zinc/71/03/53/340710353.db2.gz UOFJBMYLLXDNNH-UHFFFAOYSA-N 0 0 302.462 5.210 20 0 DKADRN CCCCC1CCC(C(=O)N2CCC[C@@H]2c2ccsc2)CC1 ZINC000058953996 337882608 /nfs/dbraw/zinc/88/26/08/337882608.db2.gz JAVUFJUHUGLOMF-LEOMRAHMSA-N 0 0 319.514 5.408 20 0 DKADRN CCCCC1CCC(C(=O)N2CCC[C@H]2c2ccsc2)CC1 ZINC000058953997 337882538 /nfs/dbraw/zinc/88/25/38/337882538.db2.gz JAVUFJUHUGLOMF-HTWSVDAQSA-N 0 0 319.514 5.408 20 0 DKADRN CN(Cc1ccccc1)C(=O)N[C@@H](CC(C)(C)C)c1ccccc1 ZINC000059320604 337890109 /nfs/dbraw/zinc/89/01/09/337890109.db2.gz HTWOPRWHHZYDQM-IBGZPJMESA-N 0 0 324.468 5.006 20 0 DKADRN CN(Cc1ccccc1)C(=O)N[C@H](CC(C)(C)C)c1ccccc1 ZINC000059320606 337890100 /nfs/dbraw/zinc/89/01/00/337890100.db2.gz HTWOPRWHHZYDQM-LJQANCHMSA-N 0 0 324.468 5.006 20 0 DKADRN Cc1ccc(CNC(=O)Nc2c(C)cccc2C(C)C)c(C)c1 ZINC000059337491 184137141 /nfs/dbraw/zinc/13/71/41/184137141.db2.gz JUBRMQMKJAOWOS-UHFFFAOYSA-N 0 0 310.441 5.057 20 0 DKADRN CC[C@@H](C)C(=O)N(Cc1ccc(C)cc1)[C@@H]1CCc2ccccc21 ZINC000059352286 184137584 /nfs/dbraw/zinc/13/75/84/184137584.db2.gz PGBGOTVEAZRVJS-DYESRHJHSA-N 0 0 321.464 5.057 20 0 DKADRN CC[C@H](C)C(=O)N(Cc1ccc(C)cc1)[C@@H]1CCc2ccccc21 ZINC000059352287 184137562 /nfs/dbraw/zinc/13/75/62/184137562.db2.gz PGBGOTVEAZRVJS-LAUBAEHRSA-N 0 0 321.464 5.057 20 0 DKADRN CC[C@@H](C)C(=O)N(Cc1ccc(C)cc1)[C@H]1CCc2ccccc21 ZINC000059352288 184137515 /nfs/dbraw/zinc/13/75/15/184137515.db2.gz PGBGOTVEAZRVJS-UTKZUKDTSA-N 0 0 321.464 5.057 20 0 DKADRN CC[C@H](C)C(=O)N(Cc1ccc(C)cc1)[C@H]1CCc2ccccc21 ZINC000059352289 184137167 /nfs/dbraw/zinc/13/71/67/184137167.db2.gz PGBGOTVEAZRVJS-UWJYYQICSA-N 0 0 321.464 5.057 20 0 DKADRN CC(C)N(Cc1ccccc1)C(=O)Nc1cccc2ccccc21 ZINC000059373376 184138167 /nfs/dbraw/zinc/13/81/67/184138167.db2.gz SHKCKRWGKUTLBT-UHFFFAOYSA-N 0 0 318.420 5.282 20 0 DKADRN Cc1ccccc1-c1nnc(S[C@H](C)CCc2ccccc2)o1 ZINC000059738846 337896017 /nfs/dbraw/zinc/89/60/17/337896017.db2.gz JMKOQOHGGGXWQZ-OAHLLOKOSA-N 0 0 324.449 5.158 20 0 DKADRN CC(=O)Nc1ccc(S[C@@H](C)c2ccc(F)c(Cl)c2)cc1 ZINC000059928473 184142659 /nfs/dbraw/zinc/14/26/59/184142659.db2.gz WNXFWWJAHFKWNR-JTQLQIEISA-N 0 0 323.820 5.291 20 0 DKADRN CC(=O)Nc1ccc(S[C@H](C)c2ccc(F)c(Cl)c2)cc1 ZINC000059928477 184142834 /nfs/dbraw/zinc/14/28/34/184142834.db2.gz WNXFWWJAHFKWNR-SNVBAGLBSA-N 0 0 323.820 5.291 20 0 DKADRN Cc1ccccc1S[C@@H](C)C(=O)Nc1ccccc1C(C)C ZINC000059929251 184142666 /nfs/dbraw/zinc/14/26/66/184142666.db2.gz COGVVZJQGSIFQX-HNNXBMFYSA-N 0 0 313.466 5.238 20 0 DKADRN Cc1ccccc1S[C@H](C)C(=O)Nc1ccccc1C(C)C ZINC000059929255 184142730 /nfs/dbraw/zinc/14/27/30/184142730.db2.gz COGVVZJQGSIFQX-OAHLLOKOSA-N 0 0 313.466 5.238 20 0 DKADRN Cc1ccc(-c2nnc([C@@H](C)Sc3ccccc3C)o2)cc1 ZINC000059929391 184142853 /nfs/dbraw/zinc/14/28/53/184142853.db2.gz MXWSTAYRIWPFNY-CQSZACIVSA-N 0 0 310.422 5.207 20 0 DKADRN Cc1ccc(-c2nnc([C@H](C)Sc3ccccc3C)o2)cc1 ZINC000059929393 184142637 /nfs/dbraw/zinc/14/26/37/184142637.db2.gz MXWSTAYRIWPFNY-AWEZNQCLSA-N 0 0 310.422 5.207 20 0 DKADRN Cc1cc(C)c(NC(=O)[C@H](C)Sc2ccccc2C)c(C)c1 ZINC000059929922 184142788 /nfs/dbraw/zinc/14/27/88/184142788.db2.gz RUERDBJGYKUJDB-INIZCTEOSA-N 0 0 313.466 5.040 20 0 DKADRN Cc1cc(C)c(NC(=O)[C@@H](C)Sc2ccccc2C)c(C)c1 ZINC000059929927 184142997 /nfs/dbraw/zinc/14/29/97/184142997.db2.gz RUERDBJGYKUJDB-MRXNPFEDSA-N 0 0 313.466 5.040 20 0 DKADRN Cc1c(C(=O)Nc2cc(C)ccc2C)oc2c1c(C)ccc2C ZINC000060019475 337899724 /nfs/dbraw/zinc/89/97/24/337899724.db2.gz JZSITSUQPVOCJZ-UHFFFAOYSA-N 0 0 307.393 5.227 20 0 DKADRN C[C@H](Sc1nc2ccccc2[nH]1)c1ccc(OC(F)F)cc1 ZINC000060037474 184143356 /nfs/dbraw/zinc/14/33/56/184143356.db2.gz YVFVWIQNHXPRIC-JTQLQIEISA-N 0 0 320.364 5.018 20 0 DKADRN C[C@@H](Sc1nc2ccccc2[nH]1)c1ccc(OC(F)F)cc1 ZINC000060037476 184143396 /nfs/dbraw/zinc/14/33/96/184143396.db2.gz YVFVWIQNHXPRIC-SNVBAGLBSA-N 0 0 320.364 5.018 20 0 DKADRN CC(C)c1cccc(N(C)C(=O)c2cccc3ccccc32)c1 ZINC000060064162 337902773 /nfs/dbraw/zinc/90/27/73/337902773.db2.gz ULDHGJFJJIWSPP-UHFFFAOYSA-N 0 0 303.405 5.240 20 0 DKADRN COc1ccccc1SCc1csc(CCC(C)C)n1 ZINC000060133222 334969872 /nfs/dbraw/zinc/96/98/72/334969872.db2.gz URROCZAUKWDDHR-UHFFFAOYSA-N 0 0 307.484 5.033 20 0 DKADRN Cc1cccc(S[C@H](C)C(=O)Nc2cccc(Cl)c2C)c1 ZINC000060134298 337902536 /nfs/dbraw/zinc/90/25/36/337902536.db2.gz GEDNMZCODVGWBM-CYBMUJFWSA-N 0 0 319.857 5.076 20 0 DKADRN Cc1cccc(S[C@@H](C)C(=O)Nc2ccccc2C(C)C)c1 ZINC000060134299 184144540 /nfs/dbraw/zinc/14/45/40/184144540.db2.gz SBIOABNIVAKHFG-HNNXBMFYSA-N 0 0 313.466 5.238 20 0 DKADRN Cc1cccc(S[C@H](C)C(=O)Nc2ccccc2C(C)C)c1 ZINC000060134301 337902573 /nfs/dbraw/zinc/90/25/73/337902573.db2.gz SBIOABNIVAKHFG-OAHLLOKOSA-N 0 0 313.466 5.238 20 0 DKADRN Cc1cccc(S[C@@H](C)C(=O)Nc2cc(Cl)ccc2C)c1 ZINC000060134338 337902624 /nfs/dbraw/zinc/90/26/24/337902624.db2.gz FAWUKANKQCDFIO-ZDUSSCGKSA-N 0 0 319.857 5.076 20 0 DKADRN Cc1cccc(S[C@H](C)C(=O)Nc2cc(Cl)ccc2C)c1 ZINC000060134340 337902593 /nfs/dbraw/zinc/90/25/93/337902593.db2.gz FAWUKANKQCDFIO-CYBMUJFWSA-N 0 0 319.857 5.076 20 0 DKADRN Cc1cccc(SCc2ccc(OCc3ccccn3)cc2)c1 ZINC000060166373 337904123 /nfs/dbraw/zinc/90/41/23/337904123.db2.gz YPHCHRKKJRMXFW-UHFFFAOYSA-N 0 0 321.445 5.261 20 0 DKADRN Cc1ccc(CSc2nnc(C[C@H](C)c3ccccc3)o2)cc1 ZINC000060385717 337910814 /nfs/dbraw/zinc/91/08/14/337910814.db2.gz WRXSHBFCPOTARA-HNNXBMFYSA-N 0 0 324.449 5.017 20 0 DKADRN Cc1ccc(NC(=O)c2sccc2-c2ccccc2)c(C)c1 ZINC000060389721 184147883 /nfs/dbraw/zinc/14/78/83/184147883.db2.gz RWZSVWCMSQPIJR-UHFFFAOYSA-N 0 0 307.418 5.284 20 0 DKADRN CC(C)c1cccc(C(C)C)c1NC(=O)CC1CCCCC1 ZINC000060390500 337911065 /nfs/dbraw/zinc/91/10/65/337911065.db2.gz QYSMUYNXLDYNHN-UHFFFAOYSA-N 0 0 301.474 5.842 20 0 DKADRN Cc1occc1-c1nnc(S[C@H](C)c2cccc(Cl)c2)o1 ZINC000060424040 337909893 /nfs/dbraw/zinc/90/98/93/337909893.db2.gz TXUVBOXHHMLVGW-SNVBAGLBSA-N 0 0 320.801 5.145 20 0 DKADRN Cc1ccccc1SCc1csc(-c2ccsc2)n1 ZINC000060430373 184149161 /nfs/dbraw/zinc/14/91/61/184149161.db2.gz BVXXQRDSZDZMQQ-UHFFFAOYSA-N 0 0 303.477 5.472 20 0 DKADRN O=C(Nc1ccccc1Cl)c1cc(C2CC2)nc2ccccc21 ZINC000060520053 184151502 /nfs/dbraw/zinc/15/15/02/184151502.db2.gz QKPCVSITRSKVIJ-UHFFFAOYSA-N 0 0 322.795 5.018 20 0 DKADRN Clc1ccccc1SCc1ncc(-c2ccccc2)o1 ZINC000060650012 184153307 /nfs/dbraw/zinc/15/33/07/184153307.db2.gz TUYBBLJMKXVJRB-UHFFFAOYSA-N 0 0 301.798 5.287 20 0 DKADRN CCCCc1ccc(CC(=O)Nc2c(C)cccc2CC)cc1 ZINC000060740146 337920165 /nfs/dbraw/zinc/92/01/65/337920165.db2.gz SESDIGHCNYRLOL-UHFFFAOYSA-N 0 0 309.453 5.081 20 0 DKADRN CC(C)c1cccc(C(C)C)c1NC(=O)c1ccc2cc[nH]c2c1 ZINC000060830436 337922603 /nfs/dbraw/zinc/92/26/03/337922603.db2.gz JMTLRZNMDPBIHP-UHFFFAOYSA-N 0 0 320.436 5.667 20 0 DKADRN O=C(Nc1ccccc1C(F)(F)F)c1cc2ccccc2s1 ZINC000060912771 337923357 /nfs/dbraw/zinc/92/33/57/337923357.db2.gz SELYLMJWLKSFJW-UHFFFAOYSA-N 0 0 321.323 5.172 20 0 DKADRN Cc1ccc(C)c(S[C@H](C)c2nnc(-c3ccccc3)o2)c1 ZINC000060979491 184159496 /nfs/dbraw/zinc/15/94/96/184159496.db2.gz NMMNGWYOJYXGCS-CQSZACIVSA-N 0 0 310.422 5.207 20 0 DKADRN Cc1ccc(S[C@H](C)c2nnc(-c3ccccc3)o2)cc1C ZINC000060979579 184159690 /nfs/dbraw/zinc/15/96/90/184159690.db2.gz GUTDAVURNGSPEO-CQSZACIVSA-N 0 0 310.422 5.207 20 0 DKADRN c1csc(-c2nnc(SCC3CCCCC3)n2C2CC2)c1 ZINC000060990693 337924101 /nfs/dbraw/zinc/92/41/01/337924101.db2.gz FDADGWRVBUVRKX-UHFFFAOYSA-N 0 0 319.499 5.014 20 0 DKADRN Cc1ccc(CN[C@@H](c2ccccc2)c2ccc(Cl)cc2)o1 ZINC000061030144 337924380 /nfs/dbraw/zinc/92/43/80/337924380.db2.gz KLPBHUMXKUXTJB-IBGZPJMESA-N 0 0 311.812 5.121 20 0 DKADRN CC(C)c1ccc([C@@H](NCc2ccco2)c2cccs2)cc1 ZINC000061557320 337945149 /nfs/dbraw/zinc/94/51/49/337945149.db2.gz KJUYBUNILIVLRZ-LJQANCHMSA-N 0 0 311.450 5.344 20 0 DKADRN CSc1cccc(NCc2nc(-c3ccccc3)cs2)c1 ZINC000061680715 337958743 /nfs/dbraw/zinc/95/87/43/337958743.db2.gz VXTIKPBUZZRXCM-UHFFFAOYSA-N 0 0 312.463 5.144 20 0 DKADRN CC(C)(Cc1ccccc1)C(=O)Nc1ccc(Cl)cc1Cl ZINC000062040386 340710411 /nfs/dbraw/zinc/71/04/11/340710411.db2.gz LBGVBRODBYGTNC-UHFFFAOYSA-N 0 0 322.235 5.201 20 0 DKADRN Cc1cccc(C)c1NC(=O)N(Cc1ccccc1)CC1CCC1 ZINC000062247320 340792222 /nfs/dbraw/zinc/79/22/22/340792222.db2.gz KOGKGGLTHAZYFH-UHFFFAOYSA-N 0 0 322.452 5.138 20 0 DKADRN Cc1nc(CSc2ccc(Cl)c(C(F)(F)F)c2)oc1C ZINC000063414384 331615184 /nfs/dbraw/zinc/61/51/84/331615184.db2.gz OAZHCSPDAMACSJ-UHFFFAOYSA-N 0 0 321.751 5.256 20 0 DKADRN C[C@H](Sc1nc2ccccc2o1)c1ccc(OC(F)F)cc1 ZINC000063414740 331615833 /nfs/dbraw/zinc/61/58/33/331615833.db2.gz ZGNVPWQHVQJUPG-JTQLQIEISA-N 0 0 321.348 5.283 20 0 DKADRN Cc1cncc(-c2cc(C(F)(F)F)cc(C(F)(F)F)c2)c1 ZINC000063772324 184288637 /nfs/dbraw/zinc/28/86/37/184288637.db2.gz XOTVSYTZPBQSHW-UHFFFAOYSA-N 0 0 305.221 5.095 20 0 DKADRN Cc1ccc([C@@H]2CCCN2C(=O)Nc2c(C)cccc2C)cc1C ZINC000064519797 340803877 /nfs/dbraw/zinc/80/38/77/340803877.db2.gz ZMTSZJWAWZFFKE-IBGZPJMESA-N 0 0 322.452 5.289 20 0 DKADRN Cc1ccc2nc(NC(=O)c3sccc3C(C)C)sc2c1 ZINC000064677692 184302720 /nfs/dbraw/zinc/30/27/20/184302720.db2.gz BXIKWQGYPGFYAO-UHFFFAOYSA-N 0 0 316.451 5.042 20 0 DKADRN CCc1ccsc1C(=O)Nc1ccccc1Oc1ccccc1 ZINC000064678988 340804877 /nfs/dbraw/zinc/80/48/77/340804877.db2.gz QISNRYSMYGHJLK-UHFFFAOYSA-N 0 0 323.417 5.355 20 0 DKADRN CCCN(C(=O)CC1CCCC1)[C@@H](C)c1cc2ccccc2o1 ZINC000064819885 333587514 /nfs/dbraw/zinc/58/75/14/333587514.db2.gz LXWCJEKYVDGWNE-HNNXBMFYSA-N 0 0 313.441 5.313 20 0 DKADRN Cc1cc(C)c(CSc2nnc(-c3cccs3)o2)c(C)c1 ZINC000064926865 184306318 /nfs/dbraw/zinc/30/63/18/184306318.db2.gz XPRRMFPQYWDEAK-UHFFFAOYSA-N 0 0 316.451 5.016 20 0 DKADRN O=C(CC1CCCC1)N1CCC[C@H]1c1cccc2ccccc21 ZINC000065884407 184381787 /nfs/dbraw/zinc/38/17/87/184381787.db2.gz HEGDQBWMPVNNDQ-FQEVSTJZSA-N 0 0 307.437 5.084 20 0 DKADRN Cc1ccc(C[S@](=O)C(c2ccccc2)c2ccccc2)cc1 ZINC000066298054 184401930 /nfs/dbraw/zinc/40/19/30/184401930.db2.gz OTWJVBODEIXVKU-HSZRJFAPSA-N 0 0 320.457 5.033 20 0 DKADRN Cc1ccc(CN(C(=O)Nc2ccccc2Cl)C(C)C)s1 ZINC000066349691 340845364 /nfs/dbraw/zinc/84/53/64/340845364.db2.gz XTYAYFYRAFBBBC-UHFFFAOYSA-N 0 0 322.861 5.152 20 0 DKADRN C[C@H](NCc1csc(C(C)(C)C)n1)c1cc2ccccc2o1 ZINC000067184565 340855477 /nfs/dbraw/zinc/85/54/77/340855477.db2.gz ZDQRBGITNLRELP-LBPRGKRZSA-N 0 0 314.454 5.038 20 0 DKADRN C[C@H](NCc1csc(C(C)(C)C)n1)c1ccc(Cl)s1 ZINC000067185905 340855567 /nfs/dbraw/zinc/85/55/67/340855567.db2.gz ULZDLTYMGRKHGW-VIFPVBQESA-N 0 0 314.907 5.006 20 0 DKADRN CSc1ccc([C@H](C)NCc2csc(C(C)(C)C)n2)cc1 ZINC000067186205 340855468 /nfs/dbraw/zinc/85/54/68/340855468.db2.gz UAERIMKSTQUPHZ-LBPRGKRZSA-N 0 0 320.527 5.013 20 0 DKADRN c1csc(-c2cnc(CSc3cccc4cccnc43)o2)c1 ZINC000067428982 340857596 /nfs/dbraw/zinc/85/75/96/340857596.db2.gz YNSLKMZQRVRIMI-UHFFFAOYSA-N 0 0 324.430 5.244 20 0 DKADRN CC(C)c1cccc(C(C)C)c1NC(=O)c1cc(Cl)c[nH]1 ZINC000067977652 340875472 /nfs/dbraw/zinc/87/54/72/340875472.db2.gz LTNWQAOKZVHFNT-UHFFFAOYSA-N 0 0 304.821 5.167 20 0 DKADRN CSc1cccc(N[C@@H](C)c2cnc3ccsc3c2)c1 ZINC000068690322 340924740 /nfs/dbraw/zinc/92/47/40/340924740.db2.gz NSWHWHYSIPVHEX-NSHDSACASA-N 0 0 300.452 5.191 20 0 DKADRN CSc1ccc(N[C@@H](C)c2cnc3ccsc3c2)cc1 ZINC000068690362 340924700 /nfs/dbraw/zinc/92/47/00/340924700.db2.gz HCTZDCDTATUUEU-NSHDSACASA-N 0 0 300.452 5.191 20 0 DKADRN CSc1ccc(N[C@H](C)c2cnc3ccsc3c2)cc1 ZINC000068690363 340924755 /nfs/dbraw/zinc/92/47/55/340924755.db2.gz HCTZDCDTATUUEU-LLVKDONJSA-N 0 0 300.452 5.191 20 0 DKADRN COc1ccc(Cl)cc1N[C@@H](C)c1cnc2ccsc2c1 ZINC000068690409 340924753 /nfs/dbraw/zinc/92/47/53/340924753.db2.gz CGPCGSYVZCDPEI-JTQLQIEISA-N 0 0 318.829 5.131 20 0 DKADRN COc1ccc(Cl)c(N[C@@H](C)c2cnc3ccsc3c2)c1 ZINC000068691768 340924839 /nfs/dbraw/zinc/92/48/39/340924839.db2.gz TTXCNQWBTVHCSK-JTQLQIEISA-N 0 0 318.829 5.131 20 0 DKADRN Cc1ccc(Oc2ccccc2NC(=O)c2ccccc2)cc1 ZINC000068728571 184497283 /nfs/dbraw/zinc/49/72/83/184497283.db2.gz OPQNFKHQXIBFGV-UHFFFAOYSA-N 0 0 303.361 5.040 20 0 DKADRN CC(C)Sc1ccccc1C(=O)Nc1cccc(C(C)C)c1 ZINC000069267867 184506115 /nfs/dbraw/zinc/50/61/15/184506115.db2.gz HWDYSZBRMOZYER-UHFFFAOYSA-N 0 0 313.466 5.563 20 0 DKADRN Cc1cccc(C[S@](=O)C(c2ccccc2)c2ccccc2)c1 ZINC000069812051 340984523 /nfs/dbraw/zinc/98/45/23/340984523.db2.gz RTKLYVOLUBOKIS-HSZRJFAPSA-N 0 0 320.457 5.033 20 0 DKADRN Cc1ccsc1[C@@H](C)Nc1ccc(N2CCCC2)cc1C ZINC000070090530 340988678 /nfs/dbraw/zinc/98/86/78/340988678.db2.gz PJEIQBLHJOFNKM-OAHLLOKOSA-N 0 0 300.471 5.138 20 0 DKADRN Cc1ccsc1[C@@H](C)Nc1cccc(-c2nccs2)c1 ZINC000070091683 340988600 /nfs/dbraw/zinc/98/86/00/340988600.db2.gz QWSHTPUCHMOYTD-GFCCVEGCSA-N 0 0 300.452 5.353 20 0 DKADRN Cc1ccsc1[C@H](C)Nc1cccc(-c2nccs2)c1 ZINC000070091684 340988715 /nfs/dbraw/zinc/98/87/15/340988715.db2.gz QWSHTPUCHMOYTD-LBPRGKRZSA-N 0 0 300.452 5.353 20 0 DKADRN Clc1cccnc1SCc1cc2ccccc2nc1Cl ZINC000070210546 190872240 /nfs/dbraw/zinc/87/22/40/190872240.db2.gz GYJFZUAUZRHBOR-UHFFFAOYSA-N 0 0 321.232 5.229 20 0 DKADRN FC(F)(F)[C@@H](N[C@@H]1CCCc2sccc21)c1ccccc1 ZINC000070397476 340994910 /nfs/dbraw/zinc/99/49/10/340994910.db2.gz IXSUXDQPRRXHLL-HIFRSBDPSA-N 0 0 311.372 5.019 20 0 DKADRN CCOc1ccccc1NC(=O)c1sccc1-c1ccccc1 ZINC000070666992 341005336 /nfs/dbraw/zinc/00/53/36/341005336.db2.gz YNCTYBWRRVKUJH-UHFFFAOYSA-N 0 0 323.417 5.066 20 0 DKADRN CCCC(=O)N[C@H](c1cccs1)c1ccc([C@@H](C)CC)cc1 ZINC000071806151 341048608 /nfs/dbraw/zinc/04/86/08/341048608.db2.gz QBMLIBUFHKSYDH-LIRRHRJNSA-N 0 0 315.482 5.267 20 0 DKADRN CCCC(=O)N[C@@H](c1cccs1)c1ccc([C@@H](C)CC)cc1 ZINC000071806152 341048532 /nfs/dbraw/zinc/04/85/32/341048532.db2.gz QBMLIBUFHKSYDH-IFXJQAMLSA-N 0 0 315.482 5.267 20 0 DKADRN CCCC(=O)N[C@H](c1cccs1)c1ccc([C@H](C)CC)cc1 ZINC000071806153 341048649 /nfs/dbraw/zinc/04/86/49/341048649.db2.gz QBMLIBUFHKSYDH-KUHUBIRLSA-N 0 0 315.482 5.267 20 0 DKADRN CCCC(=O)N[C@@H](c1cccs1)c1ccc([C@H](C)CC)cc1 ZINC000071806154 341048536 /nfs/dbraw/zinc/04/85/36/341048536.db2.gz QBMLIBUFHKSYDH-AUUYWEPGSA-N 0 0 315.482 5.267 20 0 DKADRN Clc1ccc(-c2csc(COc3ccccc3)n2)s1 ZINC000071807246 184847905 /nfs/dbraw/zinc/84/79/05/184847905.db2.gz OUELJRWTPFAXRO-UHFFFAOYSA-N 0 0 307.827 5.104 20 0 DKADRN C[C@H](Sc1ccc(C(F)(F)F)cn1)c1ccc(F)cc1 ZINC000071816620 341049022 /nfs/dbraw/zinc/04/90/22/341049022.db2.gz WXEDIGGKPDMGSY-VIFPVBQESA-N 0 0 301.308 5.093 20 0 DKADRN C[C@@H](Sc1ccc(C(F)(F)F)cn1)c1ccc(F)cc1 ZINC000071816621 341048972 /nfs/dbraw/zinc/04/89/72/341048972.db2.gz WXEDIGGKPDMGSY-SECBINFHSA-N 0 0 301.308 5.093 20 0 DKADRN Nc1ccccc1-c1nc(-c2cccc(C(F)(F)F)c2)cs1 ZINC000071817784 341049179 /nfs/dbraw/zinc/04/91/79/341049179.db2.gz RCIMZYZHRPRRFI-UHFFFAOYSA-N 0 0 320.339 5.078 20 0 DKADRN C[C@@H](Sc1nc2ccccc2n1C(F)F)c1ccccc1 ZINC000071840156 184864774 /nfs/dbraw/zinc/86/47/74/184864774.db2.gz UATKQTHKRSSGAO-LLVKDONJSA-N 0 0 304.365 5.285 20 0 DKADRN Cc1oc(-c2cccs2)nc1CSCc1cccc(F)c1 ZINC000071840202 341051252 /nfs/dbraw/zinc/05/12/52/341051252.db2.gz HFACBAGGQAMEKW-UHFFFAOYSA-N 0 0 319.426 5.284 20 0 DKADRN CC(C)c1ccc(S[C@@H](C)c2nnc(-c3ccccc3)o2)cc1 ZINC000071843234 341051414 /nfs/dbraw/zinc/05/14/14/341051414.db2.gz NMNHHENXRDDCHR-AWEZNQCLSA-N 0 0 324.449 5.713 20 0 DKADRN CC(C)c1ccc(S[C@H](C)c2nnc(-c3ccccc3)o2)cc1 ZINC000071843235 341051347 /nfs/dbraw/zinc/05/13/47/341051347.db2.gz NMNHHENXRDDCHR-CQSZACIVSA-N 0 0 324.449 5.713 20 0 DKADRN CC(C)c1ccc(SCc2cc(F)cc3c2OCOC3)cc1 ZINC000071843252 341051381 /nfs/dbraw/zinc/05/13/81/341051381.db2.gz PYVDPASOPRWHRW-UHFFFAOYSA-N 0 0 318.413 5.108 20 0 DKADRN O=C(Nc1ccc(Cl)cc1Cl)[C@@H]1CCCc2ccccc21 ZINC000071848913 184868262 /nfs/dbraw/zinc/86/82/62/184868262.db2.gz ALABCNREZKXFFJ-CQSZACIVSA-N 0 0 320.219 5.052 20 0 DKADRN Cc1cccc(CSCc2csc(-c3ccco3)n2)c1 ZINC000071855536 341052906 /nfs/dbraw/zinc/05/29/06/341052906.db2.gz VBZLPQJBONINER-UHFFFAOYSA-N 0 0 301.436 5.145 20 0 DKADRN C[C@H](SCCC(=O)Nc1ccccc1Cl)c1ccccc1 ZINC000071856303 341053081 /nfs/dbraw/zinc/05/30/81/341053081.db2.gz PMVKSAMOAXEWJH-ZDUSSCGKSA-N 0 0 319.857 5.163 20 0 DKADRN C[C@@H](SCCC(=O)Nc1ccccc1Cl)c1ccccc1 ZINC000071856304 341053012 /nfs/dbraw/zinc/05/30/12/341053012.db2.gz PMVKSAMOAXEWJH-CYBMUJFWSA-N 0 0 319.857 5.163 20 0 DKADRN CC1CCC(N(C(=O)c2cc3ccccc3s2)C2CC2)CC1 ZINC000071865640 341053386 /nfs/dbraw/zinc/05/33/86/341053386.db2.gz NOLXKZGPBVRNFB-UHFFFAOYSA-N 0 0 313.466 5.085 20 0 DKADRN CC(C)c1cccc(C(C)C)c1NC(=O)NCC1CCCCC1 ZINC000071899225 341054474 /nfs/dbraw/zinc/05/44/74/341054474.db2.gz YVOKDIRPNHKYPW-UHFFFAOYSA-N 0 0 316.489 5.635 20 0 DKADRN Cc1cccc(CNC(=O)Nc2c(C(C)C)cccc2C(C)C)c1 ZINC000071899226 341054423 /nfs/dbraw/zinc/05/44/23/341054423.db2.gz DLAMCCUWSINVNT-UHFFFAOYSA-N 0 0 324.468 5.564 20 0 DKADRN COCc1cccc(NCc2cccc(Oc3ccccc3)c2)c1 ZINC000071919640 341054899 /nfs/dbraw/zinc/05/48/99/341054899.db2.gz VVYSEADCHSCLHT-UHFFFAOYSA-N 0 0 319.404 5.237 20 0 DKADRN CC(C)Sc1ccccc1C(=O)Nc1ccc(Cl)c(F)c1 ZINC000071930698 184909210 /nfs/dbraw/zinc/90/92/10/184909210.db2.gz DVPWCXVFCHLDDE-UHFFFAOYSA-N 0 0 323.820 5.232 20 0 DKADRN CCc1cccc(C)c1NC(=O)N1CCC[C@@H]1C1CCCCC1 ZINC000071939757 184910569 /nfs/dbraw/zinc/91/05/69/184910569.db2.gz GBIHPBFPWNNFJJ-GOSISDBHSA-N 0 0 314.473 5.134 20 0 DKADRN O=C(Nc1ccc(F)cc1Cl)N1CCC[C@@H]1C1CCCCC1 ZINC000071939807 184910116 /nfs/dbraw/zinc/91/01/16/184910116.db2.gz DOVJMAXDWKMAGZ-MRXNPFEDSA-N 0 0 324.827 5.056 20 0 DKADRN Cc1cccc(C(C)C)c1NC(=O)c1ccc(-c2cnco2)cc1 ZINC000071940555 184910310 /nfs/dbraw/zinc/91/03/10/184910310.db2.gz JUCJPMICAZMCFK-UHFFFAOYSA-N 0 0 320.392 5.026 20 0 DKADRN CC(C)c1noc([C@@H](C)SCc2cccc3ccccc32)n1 ZINC000071992904 341056291 /nfs/dbraw/zinc/05/62/91/341056291.db2.gz ZELVRADJMHBFCR-CYBMUJFWSA-N 0 0 312.438 5.341 20 0 DKADRN CC(C)c1noc([C@H](C)SCc2cccc3ccccc32)n1 ZINC000071992907 341056406 /nfs/dbraw/zinc/05/64/06/341056406.db2.gz ZELVRADJMHBFCR-ZDUSSCGKSA-N 0 0 312.438 5.341 20 0 DKADRN CCCN(C(=O)CC1CCCC1)[C@H](C)c1cc2ccccc2o1 ZINC000072018014 341056971 /nfs/dbraw/zinc/05/69/71/341056971.db2.gz LXWCJEKYVDGWNE-OAHLLOKOSA-N 0 0 313.441 5.313 20 0 DKADRN C[C@@H](Sc1nc2ccccc2o1)c1ccc(OC(F)F)cc1 ZINC000072031299 341057472 /nfs/dbraw/zinc/05/74/72/341057472.db2.gz ZGNVPWQHVQJUPG-SNVBAGLBSA-N 0 0 321.348 5.283 20 0 DKADRN CCCCC(=O)Nc1ccc(NCc2ccccc2)c(Cl)c1 ZINC000072047137 341057749 /nfs/dbraw/zinc/05/77/49/341057749.db2.gz KQPYULGQGIDWSF-UHFFFAOYSA-N 0 0 316.832 5.081 20 0 DKADRN CC[C@@H](C)Sc1ccc(NC(=O)N2CCCCCC2)c(C)c1 ZINC000072052051 341057930 /nfs/dbraw/zinc/05/79/30/341057930.db2.gz QSMHLSRVYVRTCP-OAHLLOKOSA-N 0 0 320.502 5.294 20 0 DKADRN CC[C@H](C)Sc1ccc(NC(=O)N2CCCCCC2)c(C)c1 ZINC000072052052 341057880 /nfs/dbraw/zinc/05/78/80/341057880.db2.gz QSMHLSRVYVRTCP-HNNXBMFYSA-N 0 0 320.502 5.294 20 0 DKADRN CC(C)(C)c1ccc(-c2nnc(SC3CCCC3)o2)cc1 ZINC000072066554 184928429 /nfs/dbraw/zinc/92/84/29/184928429.db2.gz NCDOKCKIMGZDHF-UHFFFAOYSA-N 0 0 302.443 5.069 20 0 DKADRN Fc1ccc(-c2cnc(CSc3cccc(Cl)c3)o2)cc1 ZINC000072076778 341061307 /nfs/dbraw/zinc/06/13/07/341061307.db2.gz ULMDWEVHSZVGMX-UHFFFAOYSA-N 0 0 319.788 5.426 20 0 DKADRN C[C@H](Sc1cccc(Cl)c1)c1nnc(-c2ccccc2)o1 ZINC000072076819 191033639 /nfs/dbraw/zinc/03/36/39/191033639.db2.gz NLTUSDZBFUPKCO-NSHDSACASA-N 0 0 316.813 5.243 20 0 DKADRN C[C@@H](Sc1cccc(Cl)c1)c1nnc(-c2ccccc2)o1 ZINC000072076820 191033816 /nfs/dbraw/zinc/03/38/16/191033816.db2.gz NLTUSDZBFUPKCO-LLVKDONJSA-N 0 0 316.813 5.243 20 0 DKADRN C[C@H](Sc1cccc(Cl)c1)c1nc(-c2ccccc2)no1 ZINC000072076860 191034259 /nfs/dbraw/zinc/03/42/59/191034259.db2.gz NINCRDVLMQAVLX-NSHDSACASA-N 0 0 316.813 5.243 20 0 DKADRN C[C@@H](Sc1cccc(Cl)c1)c1nc(-c2ccccc2)no1 ZINC000072076861 191033301 /nfs/dbraw/zinc/03/33/01/191033301.db2.gz NINCRDVLMQAVLX-LLVKDONJSA-N 0 0 316.813 5.243 20 0 DKADRN Cc1cccc(C)c1NC(=O)[C@@H](C)Sc1cccc(Cl)c1 ZINC000072076887 191033596 /nfs/dbraw/zinc/03/35/96/191033596.db2.gz NCWYKRCWJXSTAA-CYBMUJFWSA-N 0 0 319.857 5.076 20 0 DKADRN Cc1cccc(C)c1NC(=O)[C@H](C)Sc1cccc(Cl)c1 ZINC000072076888 191033879 /nfs/dbraw/zinc/03/38/79/191033879.db2.gz NCWYKRCWJXSTAA-ZDUSSCGKSA-N 0 0 319.857 5.076 20 0 DKADRN C[C@H](Sc1cccc(Cl)c1)c1nnc(-c2cccs2)o1 ZINC000072076963 341061286 /nfs/dbraw/zinc/06/12/86/341061286.db2.gz YIVSRROBNLFGDN-VIFPVBQESA-N 0 0 322.842 5.305 20 0 DKADRN C[C@@H](Sc1cccc(Cl)c1)c1nnc(-c2cccs2)o1 ZINC000072076964 341061230 /nfs/dbraw/zinc/06/12/30/341061230.db2.gz YIVSRROBNLFGDN-SECBINFHSA-N 0 0 322.842 5.305 20 0 DKADRN CCCC[C@@H](CC)C(=O)N1Cc2ccccc2-c2ccccc2C1 ZINC000072078344 341061580 /nfs/dbraw/zinc/06/15/80/341061580.db2.gz QLJBVPVDHBPGCH-QGZVFWFLSA-N 0 0 321.464 5.412 20 0 DKADRN CCCC[C@H](CC)C(=O)N1Cc2ccccc2-c2ccccc2C1 ZINC000072078345 341061574 /nfs/dbraw/zinc/06/15/74/341061574.db2.gz QLJBVPVDHBPGCH-KRWDZBQOSA-N 0 0 321.464 5.412 20 0 DKADRN CCC(CC)(C(=O)Nc1ccccc1F)c1ccc(Cl)cc1 ZINC000072084448 191035954 /nfs/dbraw/zinc/03/59/54/191035954.db2.gz UBVYEJBNCNCVPI-UHFFFAOYSA-N 0 0 319.807 5.176 20 0 DKADRN Cc1ccc(C(C)(C)C)cc1SCc1nnc(C(C)C)o1 ZINC000072086650 341061655 /nfs/dbraw/zinc/06/16/55/341061655.db2.gz KHVXNONTSZMBLK-UHFFFAOYSA-N 0 0 304.459 5.091 20 0 DKADRN Cc1cccc(N(C)C(=O)c2ccc(Oc3ccccc3)cc2)c1 ZINC000072088442 341061838 /nfs/dbraw/zinc/06/18/38/341061838.db2.gz WOLGGFGLQNDBGW-UHFFFAOYSA-N 0 0 317.388 5.064 20 0 DKADRN Clc1ccc(OCc2ncc(-c3ccccc3)o2)c(Cl)c1 ZINC000072100039 191036520 /nfs/dbraw/zinc/03/65/20/191036520.db2.gz ZYJCTZMAENPKKI-UHFFFAOYSA-N 0 0 320.175 5.227 20 0 DKADRN Cc1cccc(C(C)C)c1NC(=O)N1CC[C@H](CC(C)C)C1 ZINC000072499503 341087415 /nfs/dbraw/zinc/08/74/15/341087415.db2.gz NLUALCVUYBRBKB-MRXNPFEDSA-N 0 0 302.462 5.018 20 0 DKADRN Cc1cccc(C(C)C)c1NC(=O)N1CC[C@@H](CC(C)C)C1 ZINC000072499507 341087393 /nfs/dbraw/zinc/08/73/93/341087393.db2.gz NLUALCVUYBRBKB-INIZCTEOSA-N 0 0 302.462 5.018 20 0 DKADRN Cc1cccc(NC(=O)N2CCC[C@@H]2c2ccccc2)c1Cl ZINC000072569641 341091643 /nfs/dbraw/zinc/09/16/43/341091643.db2.gz GBHZLAZNOVQXAS-MRXNPFEDSA-N 0 0 314.816 5.017 20 0 DKADRN Cc1cccc(NC(=O)N2CCC[C@H]2c2ccccc2)c1Cl ZINC000072569645 341091689 /nfs/dbraw/zinc/09/16/89/341091689.db2.gz GBHZLAZNOVQXAS-INIZCTEOSA-N 0 0 314.816 5.017 20 0 DKADRN Cc1cccc(NC(=O)N(C)[C@@H](C)c2ccc(F)cc2)c1Cl ZINC000072580744 341092195 /nfs/dbraw/zinc/09/21/95/341092195.db2.gz KGSBVBODCIYZSZ-LBPRGKRZSA-N 0 0 320.795 5.012 20 0 DKADRN Cc1cccc(NC(=O)N(C)[C@H](C)c2ccc(F)cc2)c1Cl ZINC000072580745 341092262 /nfs/dbraw/zinc/09/22/62/341092262.db2.gz KGSBVBODCIYZSZ-GFCCVEGCSA-N 0 0 320.795 5.012 20 0 DKADRN Cc1cccc(NC(=O)N2CCC[C@@H]2c2cccs2)c1Cl ZINC000072581553 191198440 /nfs/dbraw/zinc/19/84/40/191198440.db2.gz CDGGUHWRCXEMSQ-CYBMUJFWSA-N 0 0 320.845 5.079 20 0 DKADRN Cc1cccc(NC(=O)N2CCC[C@H]2c2cccs2)c1Cl ZINC000072581555 191197620 /nfs/dbraw/zinc/19/76/20/191197620.db2.gz CDGGUHWRCXEMSQ-ZDUSSCGKSA-N 0 0 320.845 5.079 20 0 DKADRN Cc1cccc(NC(=O)N(C)[C@@H](C)c2ccccc2F)c1Cl ZINC000072581981 341092245 /nfs/dbraw/zinc/09/22/45/341092245.db2.gz ZZEKRCHMRCHIDY-LBPRGKRZSA-N 0 0 320.795 5.012 20 0 DKADRN Cc1cccc(NC(=O)N(C)[C@H](C)c2ccccc2F)c1Cl ZINC000072581982 341092188 /nfs/dbraw/zinc/09/21/88/341092188.db2.gz ZZEKRCHMRCHIDY-GFCCVEGCSA-N 0 0 320.795 5.012 20 0 DKADRN Cc1c(F)cccc1NC(=O)N(C)[C@@H](C)c1ccc(Cl)cc1 ZINC000072600311 341093179 /nfs/dbraw/zinc/09/31/79/341093179.db2.gz NUYHBAXJVUNGNU-LBPRGKRZSA-N 0 0 320.795 5.012 20 0 DKADRN Cc1c(F)cccc1NC(=O)N(C)[C@H](C)c1ccc(Cl)cc1 ZINC000072600312 341093105 /nfs/dbraw/zinc/09/31/05/341093105.db2.gz NUYHBAXJVUNGNU-GFCCVEGCSA-N 0 0 320.795 5.012 20 0 DKADRN Cc1c(F)cccc1NC(=O)N(C)[C@@H](C)c1cccc(Cl)c1 ZINC000072604889 341093371 /nfs/dbraw/zinc/09/33/71/341093371.db2.gz GZZBGGDEWVJTHJ-LBPRGKRZSA-N 0 0 320.795 5.012 20 0 DKADRN Cc1c(F)cccc1NC(=O)N(C)[C@H](C)c1cccc(Cl)c1 ZINC000072604890 341093280 /nfs/dbraw/zinc/09/32/80/341093280.db2.gz GZZBGGDEWVJTHJ-GFCCVEGCSA-N 0 0 320.795 5.012 20 0 DKADRN Cc1ccc(S[C@@H](C)c2nnc(-c3ccccc3)o2)cc1C ZINC000072707335 191217377 /nfs/dbraw/zinc/21/73/77/191217377.db2.gz GUTDAVURNGSPEO-AWEZNQCLSA-N 0 0 310.422 5.207 20 0 DKADRN Cc1ccc(S[C@@H](C)c2nnc(-c3cccs3)o2)cc1C ZINC000072710988 341100531 /nfs/dbraw/zinc/10/05/31/341100531.db2.gz WXRJUXYVYDZPTQ-LBPRGKRZSA-N 0 0 316.451 5.268 20 0 DKADRN c1csc(-c2cnc(CNc3cccc4ccccc43)o2)c1 ZINC000072910850 341110549 /nfs/dbraw/zinc/11/05/49/341110549.db2.gz XWIVQECNTJEADC-UHFFFAOYSA-N 0 0 306.390 5.168 20 0 DKADRN CCSc1cccc(NC(=O)Nc2c(C)cccc2C)c1 ZINC000073175787 341113836 /nfs/dbraw/zinc/11/38/36/341113836.db2.gz SOSKTVCJAMEIFA-UHFFFAOYSA-N 0 0 300.427 5.059 20 0 DKADRN CC(C)c1ccc(-c2nnc(SCc3ccccc3)o2)cc1 ZINC000073200165 191291287 /nfs/dbraw/zinc/29/12/87/191291287.db2.gz DIOPZPNAUDLRCJ-UHFFFAOYSA-N 0 0 310.422 5.152 20 0 DKADRN Cc1cccc(NC(=O)c2ccc(Cl)cc2Cl)c1Cl ZINC000073345153 341115594 /nfs/dbraw/zinc/11/55/94/341115594.db2.gz UDSQQIYIOIRSBE-UHFFFAOYSA-N 0 0 314.599 5.208 20 0 DKADRN Cc1cccc(NC(=O)c2cc(Cl)sc2Cl)c1Cl ZINC000073345657 341115604 /nfs/dbraw/zinc/11/56/04/341115604.db2.gz RFSWCTGSKDFKFD-UHFFFAOYSA-N 0 0 320.628 5.269 20 0 DKADRN O=C(Nc1cc(Cl)ccc1Cl)c1cccc(F)c1Cl ZINC000073848897 341121941 /nfs/dbraw/zinc/12/19/41/341121941.db2.gz YAURWNMKVAJLGA-UHFFFAOYSA-N 0 0 318.562 5.038 20 0 DKADRN Cc1cccc(C(C)C)c1NC(=O)c1cccc(F)c1Cl ZINC000073850157 341121935 /nfs/dbraw/zinc/12/19/35/341121935.db2.gz CFWUYFKIEYQCQE-UHFFFAOYSA-N 0 0 305.780 5.163 20 0 DKADRN CCSc1cccc(NC(=O)N(C)[C@@H](C)c2ccccc2)c1 ZINC000073989986 341124776 /nfs/dbraw/zinc/12/47/76/341124776.db2.gz HTFCVJVMMRFWPE-AWEZNQCLSA-N 0 0 314.454 5.024 20 0 DKADRN CCSc1cccc(NC(=O)N(C)[C@H](C)c2ccccc2)c1 ZINC000073989991 341124813 /nfs/dbraw/zinc/12/48/13/341124813.db2.gz HTFCVJVMMRFWPE-CQSZACIVSA-N 0 0 314.454 5.024 20 0 DKADRN C[C@@H](c1ccccc1)[S@@](=O)Cc1ccc(Cl)cc1Cl ZINC000074111351 341127959 /nfs/dbraw/zinc/12/79/59/341127959.db2.gz CCCLTIOGMLWYTJ-JEOXALJRSA-N 0 0 313.249 5.003 20 0 DKADRN C[C@H](c1ccccc1)[S@@](=O)Cc1ccc(Cl)cc1Cl ZINC000074111354 341127900 /nfs/dbraw/zinc/12/79/00/341127900.db2.gz CCCLTIOGMLWYTJ-NSPYISDASA-N 0 0 313.249 5.003 20 0 DKADRN C[C@@H](c1ccccc1)[S@](=O)Cc1ccc(Cl)cc1Cl ZINC000074111355 341127987 /nfs/dbraw/zinc/12/79/87/341127987.db2.gz CCCLTIOGMLWYTJ-WLRWDXFRSA-N 0 0 313.249 5.003 20 0 DKADRN C[C@H](c1ccccc1)[S@](=O)Cc1ccc(Cl)cc1Cl ZINC000074111358 341127978 /nfs/dbraw/zinc/12/79/78/341127978.db2.gz CCCLTIOGMLWYTJ-WYRIXSBYSA-N 0 0 313.249 5.003 20 0 DKADRN C[C@@H](c1ccccc1)[S@@](=O)Cc1c(Cl)cccc1Cl ZINC000074111367 341127985 /nfs/dbraw/zinc/12/79/85/341127985.db2.gz LPFBTTJSVBUPJW-JEOXALJRSA-N 0 0 313.249 5.003 20 0 DKADRN C[C@H](c1ccccc1)[S@@](=O)Cc1c(Cl)cccc1Cl ZINC000074111369 341127917 /nfs/dbraw/zinc/12/79/17/341127917.db2.gz LPFBTTJSVBUPJW-NSPYISDASA-N 0 0 313.249 5.003 20 0 DKADRN C[C@@H](c1ccccc1)[S@](=O)Cc1c(Cl)cccc1Cl ZINC000074111372 341127982 /nfs/dbraw/zinc/12/79/82/341127982.db2.gz LPFBTTJSVBUPJW-WLRWDXFRSA-N 0 0 313.249 5.003 20 0 DKADRN C[C@H](c1ccccc1)[S@](=O)Cc1c(Cl)cccc1Cl ZINC000074111373 341128040 /nfs/dbraw/zinc/12/80/40/341128040.db2.gz LPFBTTJSVBUPJW-WYRIXSBYSA-N 0 0 313.249 5.003 20 0 DKADRN CC(C)c1cccc(C(C)C)c1NC(=O)c1cc(C2CC2)on1 ZINC000074192333 341134014 /nfs/dbraw/zinc/13/40/14/341134014.db2.gz GITYZGBUFDKZAU-UHFFFAOYSA-N 0 0 312.413 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/nfs/dbraw/zinc/21/54/10/341215410.db2.gz WFGRRGHVLWYKAT-GFCCVEGCSA-N 0 0 316.495 5.332 20 0 DKADRN CC(C)c1nc([C@H](C)NCc2csc3ccccc23)cs1 ZINC000076900284 341215436 /nfs/dbraw/zinc/21/54/36/341215436.db2.gz WFGRRGHVLWYKAT-LBPRGKRZSA-N 0 0 316.495 5.332 20 0 DKADRN O=C(Nc1ccccc1Cl)N1CCCCC[C@@H]1c1ccco1 ZINC000076937703 341215969 /nfs/dbraw/zinc/21/59/69/341215969.db2.gz IMZDFCQGVGKAQY-OAHLLOKOSA-N 0 0 318.804 5.082 20 0 DKADRN O=C(Nc1ccccc1Cl)N1CCCCC[C@H]1c1ccco1 ZINC000076937704 341215909 /nfs/dbraw/zinc/21/59/09/341215909.db2.gz IMZDFCQGVGKAQY-HNNXBMFYSA-N 0 0 318.804 5.082 20 0 DKADRN Cc1ccc(C)c(NC(=O)N2CCCCC[C@@H]2c2ccco2)c1 ZINC000077177901 341220112 /nfs/dbraw/zinc/22/01/12/341220112.db2.gz DKAQVKHWVPATIE-QGZVFWFLSA-N 0 0 312.413 5.046 20 0 DKADRN Cc1ccc(C)c(NC(=O)N2CCCCC[C@H]2c2ccco2)c1 ZINC000077177902 341220133 /nfs/dbraw/zinc/22/01/33/341220133.db2.gz DKAQVKHWVPATIE-KRWDZBQOSA-N 0 0 312.413 5.046 20 0 DKADRN CSCCCCNC(=O)Nc1c(C(C)C)cccc1C(C)C ZINC000077178852 341220143 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ZINC000078602283 341244812 /nfs/dbraw/zinc/24/48/12/341244812.db2.gz NOLWBWBIEIRCLE-UHFFFAOYSA-N 0 0 323.436 5.028 20 0 DKADRN C[C@H](Nc1cccc(COCC2CC2)c1)c1ccc(Cl)cc1 ZINC000078671776 341245898 /nfs/dbraw/zinc/24/58/98/341245898.db2.gz DALMCUXUKNAJQM-AWEZNQCLSA-N 0 0 315.844 5.440 20 0 DKADRN C[C@@H](Nc1cccc(COCC2CC2)c1)c1ccc(Cl)cc1 ZINC000078671779 341245963 /nfs/dbraw/zinc/24/59/63/341245963.db2.gz DALMCUXUKNAJQM-CQSZACIVSA-N 0 0 315.844 5.440 20 0 DKADRN C[C@H](Nc1cccc(COCC2CC2)c1)c1ccccc1Cl ZINC000078671782 341245911 /nfs/dbraw/zinc/24/59/11/341245911.db2.gz KDPLKJUYHWUCCR-AWEZNQCLSA-N 0 0 315.844 5.440 20 0 DKADRN C[C@@H](Nc1cccc(COCC2CC2)c1)c1ccccc1Cl ZINC000078671785 341245944 /nfs/dbraw/zinc/24/59/44/341245944.db2.gz KDPLKJUYHWUCCR-CQSZACIVSA-N 0 0 315.844 5.440 20 0 DKADRN Cc1cc(C(=O)N(C)[C@@H](c2ccccc2Cl)C(C)C)c(C)o1 ZINC000078681500 341246225 /nfs/dbraw/zinc/24/62/25/341246225.db2.gz AERBGJPLNKPNSR-QGZVFWFLSA-N 0 0 319.832 5.019 20 0 DKADRN Cc1cc(C(=O)N(C)[C@H](c2ccccc2Cl)C(C)C)c(C)o1 ZINC000078681503 341246129 /nfs/dbraw/zinc/24/61/29/341246129.db2.gz AERBGJPLNKPNSR-KRWDZBQOSA-N 0 0 319.832 5.019 20 0 DKADRN CSc1ccc(C)c(C(=O)Nc2c(C)cccc2C(C)C)c1 ZINC000078722821 341246625 /nfs/dbraw/zinc/24/66/25/341246625.db2.gz VBHQTFTUVWITAL-UHFFFAOYSA-N 0 0 313.466 5.401 20 0 DKADRN Cc1ccc(S[C@H](C)c2nnc(-c3ccc(C)cc3)o2)cc1 ZINC000078967845 185137569 /nfs/dbraw/zinc/13/75/69/185137569.db2.gz UOBPHRCRKKMJKU-CQSZACIVSA-N 0 0 310.422 5.207 20 0 DKADRN Cc1ccc(S[C@@H](C)c2nnc(-c3ccc(C)cc3)o2)cc1 ZINC000078967849 185137230 /nfs/dbraw/zinc/13/72/30/185137230.db2.gz UOBPHRCRKKMJKU-AWEZNQCLSA-N 0 0 310.422 5.207 20 0 DKADRN Cc1ccc(-c2nnc([C@@H](C)SCc3ccccc3)o2)cc1 ZINC000078967927 185137303 /nfs/dbraw/zinc/13/73/03/185137303.db2.gz ATIKTHZCOXPRBQ-CQSZACIVSA-N 0 0 310.422 5.039 20 0 DKADRN Cc1ccc(-c2nnc([C@H](C)SCc3ccccc3)o2)cc1 ZINC000078967936 341250676 /nfs/dbraw/zinc/25/06/76/341250676.db2.gz ATIKTHZCOXPRBQ-AWEZNQCLSA-N 0 0 310.422 5.039 20 0 DKADRN Cc1ccc(S[C@@H](C)c2nnc(-c3cccs3)o2)c(C)c1 ZINC000078967983 341250740 /nfs/dbraw/zinc/25/07/40/341250740.db2.gz DSKYXKUYFYFFKG-LBPRGKRZSA-N 0 0 316.451 5.268 20 0 DKADRN Cc1ccc(S[C@H](C)c2nnc(-c3cccs3)o2)c(C)c1 ZINC000078967990 341250709 /nfs/dbraw/zinc/25/07/09/341250709.db2.gz DSKYXKUYFYFFKG-GFCCVEGCSA-N 0 0 316.451 5.268 20 0 DKADRN Cc1ccc(-c2nnc([C@@H](C)Sc3ccccc3F)o2)cc1 ZINC000078968090 185137183 /nfs/dbraw/zinc/13/71/83/185137183.db2.gz CWXISSKGHNUMAS-GFCCVEGCSA-N 0 0 314.385 5.037 20 0 DKADRN Cc1ccc(-c2nnc([C@H](C)Sc3ccccc3F)o2)cc1 ZINC000078968097 185137205 /nfs/dbraw/zinc/13/72/05/185137205.db2.gz CWXISSKGHNUMAS-LBPRGKRZSA-N 0 0 314.385 5.037 20 0 DKADRN CCC(=O)Nc1ccc(N[C@@H](C)c2ccc(F)c(Cl)c2)cc1 ZINC000078989853 341251464 /nfs/dbraw/zinc/25/14/64/341251464.db2.gz XQXNDYJPMIBPTO-NSHDSACASA-N 0 0 320.795 5.001 20 0 DKADRN CCC(=O)Nc1ccc(N[C@H](C)c2ccc(F)c(Cl)c2)cc1 ZINC000078989860 341251459 /nfs/dbraw/zinc/25/14/59/341251459.db2.gz XQXNDYJPMIBPTO-LLVKDONJSA-N 0 0 320.795 5.001 20 0 DKADRN Cc1nnc([C@@H](C)S[C@@H](C)c2ccc(Cl)c(Cl)c2)o1 ZINC000079011319 185146063 /nfs/dbraw/zinc/14/60/63/185146063.db2.gz VJFZKZUZUGMSRM-JGVFFNPUSA-N 0 0 317.241 5.240 20 0 DKADRN Cc1nnc([C@H](C)S[C@@H](C)c2ccc(Cl)c(Cl)c2)o1 ZINC000079011322 185145923 /nfs/dbraw/zinc/14/59/23/185145923.db2.gz VJFZKZUZUGMSRM-YUMQZZPRSA-N 0 0 317.241 5.240 20 0 DKADRN Cc1nnc([C@@H](C)S[C@H](C)c2ccc(Cl)c(Cl)c2)o1 ZINC000079011326 185146009 /nfs/dbraw/zinc/14/60/09/185146009.db2.gz VJFZKZUZUGMSRM-HTQZYQBOSA-N 0 0 317.241 5.240 20 0 DKADRN Cc1nnc([C@H](C)S[C@H](C)c2ccc(Cl)c(Cl)c2)o1 ZINC000079011327 185145918 /nfs/dbraw/zinc/14/59/18/185145918.db2.gz VJFZKZUZUGMSRM-SFYZADRCSA-N 0 0 317.241 5.240 20 0 DKADRN CC(C)[C@@H](C)SCCC(=O)Nc1c(Cl)cccc1Cl ZINC000079077100 341253069 /nfs/dbraw/zinc/25/30/69/341253069.db2.gz ZBMIUMWWSYZGNB-SNVBAGLBSA-N 0 0 320.285 5.100 20 0 DKADRN CC(C)[C@H](C)SCCC(=O)Nc1c(Cl)cccc1Cl ZINC000079077104 341253120 /nfs/dbraw/zinc/25/31/20/341253120.db2.gz ZBMIUMWWSYZGNB-JTQLQIEISA-N 0 0 320.285 5.100 20 0 DKADRN Cc1cccc(C(C)C)c1NC(=O)[C@@H](C)S[C@@H](C)C(C)C ZINC000079077365 341253056 /nfs/dbraw/zinc/25/30/56/341253056.db2.gz HDXSLRIACYRFRP-LSDHHAIUSA-N 0 0 307.503 5.223 20 0 DKADRN Cc1cccc(C(C)C)c1NC(=O)[C@H](C)S[C@@H](C)C(C)C ZINC000079077373 341253112 /nfs/dbraw/zinc/25/31/12/341253112.db2.gz HDXSLRIACYRFRP-GJZGRUSLSA-N 0 0 307.503 5.223 20 0 DKADRN Cc1cccc(C(C)C)c1NC(=O)[C@@H](C)S[C@H](C)C(C)C ZINC000079077375 341253149 /nfs/dbraw/zinc/25/31/49/341253149.db2.gz HDXSLRIACYRFRP-HUUCEWRRSA-N 0 0 307.503 5.223 20 0 DKADRN Cc1cccc(C(C)C)c1NC(=O)[C@H](C)S[C@H](C)C(C)C ZINC000079077381 341253065 /nfs/dbraw/zinc/25/30/65/341253065.db2.gz HDXSLRIACYRFRP-CABCVRRESA-N 0 0 307.503 5.223 20 0 DKADRN Cc1nnc(S[C@@H](C)c2ccc(Cl)c(Cl)c2)s1 ZINC000079389596 341257945 /nfs/dbraw/zinc/25/79/45/341257945.db2.gz XHRKMICJLTYDBM-LURJTMIESA-N 0 0 305.255 5.007 20 0 DKADRN Cc1nnc(S[C@H](C)c2ccc(Cl)c(Cl)c2)s1 ZINC000079389597 341257996 /nfs/dbraw/zinc/25/79/96/341257996.db2.gz XHRKMICJLTYDBM-ZCFIWIBFSA-N 0 0 305.255 5.007 20 0 DKADRN O=C(CCC(F)(F)F)Nc1ccccc1SC1CCCC1 ZINC000079509512 341260520 /nfs/dbraw/zinc/26/05/20/341260520.db2.gz FBYXEXSWZHTHBL-UHFFFAOYSA-N 0 0 317.376 5.002 20 0 DKADRN Cc1ccccc1NC(=O)N1CCCCC[C@@H]1c1ccccc1 ZINC000079624465 341262261 /nfs/dbraw/zinc/26/22/61/341262261.db2.gz IJMOIMNPAMHKFV-LJQANCHMSA-N 0 0 308.425 5.144 20 0 DKADRN Cc1ccccc1NC(=O)N1CCCCC[C@H]1c1ccccc1 ZINC000079624468 341262244 /nfs/dbraw/zinc/26/22/44/341262244.db2.gz IJMOIMNPAMHKFV-IBGZPJMESA-N 0 0 308.425 5.144 20 0 DKADRN CC(C)c1cccc(C(C)C)c1NC(=O)c1cccc2cc[nH]c21 ZINC000079684795 341263430 /nfs/dbraw/zinc/26/34/30/341263430.db2.gz OEMUEWOKEGVXCM-UHFFFAOYSA-N 0 0 320.436 5.667 20 0 DKADRN CC[C@H](N[C@@H](C)c1cc(Cl)ccc1Cl)c1nccs1 ZINC000080260312 341271687 /nfs/dbraw/zinc/27/16/87/341271687.db2.gz JVOIMKPFYGVBCM-ZANVPECISA-N 0 0 315.269 5.252 20 0 DKADRN CC[C@@H](N[C@@H](C)c1cc(Cl)ccc1Cl)c1nccs1 ZINC000080260317 341271728 /nfs/dbraw/zinc/27/17/28/341271728.db2.gz JVOIMKPFYGVBCM-TVQRCGJNSA-N 0 0 315.269 5.252 20 0 DKADRN CC[C@H](N[C@H](C)c1cc(Cl)ccc1Cl)c1nccs1 ZINC000080260322 341271721 /nfs/dbraw/zinc/27/17/21/341271721.db2.gz JVOIMKPFYGVBCM-RNCFNFMXSA-N 0 0 315.269 5.252 20 0 DKADRN CC[C@@H](N[C@H](C)c1cc(Cl)ccc1Cl)c1nccs1 ZINC000080260327 341271653 /nfs/dbraw/zinc/27/16/53/341271653.db2.gz JVOIMKPFYGVBCM-NOZJJQNGSA-N 0 0 315.269 5.252 20 0 DKADRN CC[C@H](N[C@@H](C)c1ccc(Cl)cc1Cl)c1nccs1 ZINC000080260330 341271785 /nfs/dbraw/zinc/27/17/85/341271785.db2.gz OIBRHLPZNRFGQE-ZANVPECISA-N 0 0 315.269 5.252 20 0 DKADRN CC[C@@H](N[C@@H](C)c1ccc(Cl)cc1Cl)c1nccs1 ZINC000080260333 341271770 /nfs/dbraw/zinc/27/17/70/341271770.db2.gz OIBRHLPZNRFGQE-TVQRCGJNSA-N 0 0 315.269 5.252 20 0 DKADRN CC[C@H](N[C@H](C)c1ccc(Cl)cc1Cl)c1nccs1 ZINC000080260337 341271643 /nfs/dbraw/zinc/27/16/43/341271643.db2.gz OIBRHLPZNRFGQE-RNCFNFMXSA-N 0 0 315.269 5.252 20 0 DKADRN CC[C@H](N[C@@H](C)c1ccc(Cl)c(Cl)c1)c1nccs1 ZINC000080262516 341271640 /nfs/dbraw/zinc/27/16/40/341271640.db2.gz YNKZUHCMXPNKNA-ZANVPECISA-N 0 0 315.269 5.252 20 0 DKADRN CC[C@@H](N[C@@H](C)c1ccc(Cl)c(Cl)c1)c1nccs1 ZINC000080262520 341271668 /nfs/dbraw/zinc/27/16/68/341271668.db2.gz YNKZUHCMXPNKNA-TVQRCGJNSA-N 0 0 315.269 5.252 20 0 DKADRN CC[C@H](N[C@H](C)c1ccc(Cl)c(Cl)c1)c1nccs1 ZINC000080262524 341271703 /nfs/dbraw/zinc/27/17/03/341271703.db2.gz YNKZUHCMXPNKNA-RNCFNFMXSA-N 0 0 315.269 5.252 20 0 DKADRN CC[C@@H](N[C@H](C)c1ccc(Cl)c(Cl)c1)c1nccs1 ZINC000080262526 341271767 /nfs/dbraw/zinc/27/17/67/341271767.db2.gz YNKZUHCMXPNKNA-NOZJJQNGSA-N 0 0 315.269 5.252 20 0 DKADRN C[C@H](N[C@@H](C)c1cc(F)c(Cl)cc1Cl)c1nccs1 ZINC000080265157 331683809 /nfs/dbraw/zinc/68/38/09/331683809.db2.gz PSLWKJBRCUYPTF-YUMQZZPRSA-N 0 0 319.232 5.001 20 0 DKADRN C[C@@H](N[C@H](C)c1cc(F)c(Cl)cc1Cl)c1nccs1 ZINC000080265162 331683851 /nfs/dbraw/zinc/68/38/51/331683851.db2.gz PSLWKJBRCUYPTF-HTQZYQBOSA-N 0 0 319.232 5.001 20 0 DKADRN CC[C@H](N[C@@H](C)c1nccs1)c1ccc(Cl)cc1Cl ZINC000080266650 341271747 /nfs/dbraw/zinc/27/17/47/341271747.db2.gz HUHNDZFTZXNUMT-ZANVPECISA-N 0 0 315.269 5.252 20 0 DKADRN CC[C@@H](N[C@@H](C)c1nccs1)c1ccc(Cl)cc1Cl ZINC000080266653 341271637 /nfs/dbraw/zinc/27/16/37/341271637.db2.gz HUHNDZFTZXNUMT-TVQRCGJNSA-N 0 0 315.269 5.252 20 0 DKADRN CC[C@H](N[C@@H](C)c1nccs1)c1ccc(Cl)c(Cl)c1 ZINC000080267109 341271909 /nfs/dbraw/zinc/27/19/09/341271909.db2.gz YPBVGWFNIMMKEQ-ZANVPECISA-N 0 0 315.269 5.252 20 0 DKADRN CC[C@@H](N[C@@H](C)c1nccs1)c1ccc(Cl)c(Cl)c1 ZINC000080267113 341271803 /nfs/dbraw/zinc/27/18/03/341271803.db2.gz YPBVGWFNIMMKEQ-TVQRCGJNSA-N 0 0 315.269 5.252 20 0 DKADRN Cc1csc([C@@H](C)N[C@@H](C)c2cc(Cl)ccc2Cl)n1 ZINC000080272166 341272041 /nfs/dbraw/zinc/27/20/41/341272041.db2.gz DTGRFYKKZNATGY-VHSXEESVSA-N 0 0 315.269 5.170 20 0 DKADRN Cc1csc([C@H](C)N[C@@H](C)c2cc(Cl)ccc2Cl)n1 ZINC000080272170 341271990 /nfs/dbraw/zinc/27/19/90/341271990.db2.gz DTGRFYKKZNATGY-UWVGGRQHSA-N 0 0 315.269 5.170 20 0 DKADRN Cc1csc([C@@H](C)N[C@H](C)c2cc(Cl)ccc2Cl)n1 ZINC000080272172 341272111 /nfs/dbraw/zinc/27/21/11/341272111.db2.gz DTGRFYKKZNATGY-NXEZZACHSA-N 0 0 315.269 5.170 20 0 DKADRN Cc1csc([C@H](C)N[C@H](C)c2cc(Cl)ccc2Cl)n1 ZINC000080272175 341272093 /nfs/dbraw/zinc/27/20/93/341272093.db2.gz DTGRFYKKZNATGY-ZJUUUORDSA-N 0 0 315.269 5.170 20 0 DKADRN Cc1csc([C@@H](C)N[C@@H](C)c2ccc(Cl)cc2Cl)n1 ZINC000080272187 341271948 /nfs/dbraw/zinc/27/19/48/341271948.db2.gz MHLWXUYFLHLWTQ-VHSXEESVSA-N 0 0 315.269 5.170 20 0 DKADRN Cc1csc([C@H](C)N[C@@H](C)c2ccc(Cl)cc2Cl)n1 ZINC000080272191 341272105 /nfs/dbraw/zinc/27/21/05/341272105.db2.gz MHLWXUYFLHLWTQ-UWVGGRQHSA-N 0 0 315.269 5.170 20 0 DKADRN Cc1csc([C@@H](C)N[C@H](C)c2ccc(Cl)cc2Cl)n1 ZINC000080272194 341272120 /nfs/dbraw/zinc/27/21/20/341272120.db2.gz MHLWXUYFLHLWTQ-NXEZZACHSA-N 0 0 315.269 5.170 20 0 DKADRN Cc1csc([C@H](C)N[C@H](C)c2ccc(Cl)cc2Cl)n1 ZINC000080272198 341272081 /nfs/dbraw/zinc/27/20/81/341272081.db2.gz MHLWXUYFLHLWTQ-ZJUUUORDSA-N 0 0 315.269 5.170 20 0 DKADRN Cc1csc([C@@H](C)N[C@@H](C)c2ccc(Cl)c(Cl)c2)n1 ZINC000080273955 341272107 /nfs/dbraw/zinc/27/21/07/341272107.db2.gz NEWFYMIGARTFTA-VHSXEESVSA-N 0 0 315.269 5.170 20 0 DKADRN Cc1csc([C@H](C)N[C@@H](C)c2ccc(Cl)c(Cl)c2)n1 ZINC000080273958 341272038 /nfs/dbraw/zinc/27/20/38/341272038.db2.gz NEWFYMIGARTFTA-UWVGGRQHSA-N 0 0 315.269 5.170 20 0 DKADRN Cc1csc([C@@H](C)N[C@H](C)c2ccc(Cl)c(Cl)c2)n1 ZINC000080273959 341271981 /nfs/dbraw/zinc/27/19/81/341271981.db2.gz NEWFYMIGARTFTA-NXEZZACHSA-N 0 0 315.269 5.170 20 0 DKADRN Cc1csc([C@H](C)N[C@H](C)c2ccc(Cl)c(Cl)c2)n1 ZINC000080273961 341272017 /nfs/dbraw/zinc/27/20/17/341272017.db2.gz NEWFYMIGARTFTA-ZJUUUORDSA-N 0 0 315.269 5.170 20 0 DKADRN CC[C@@H](N[C@H](C)c1ccc(Cl)cc1Cl)c1nccs1 ZINC000080285537 341272549 /nfs/dbraw/zinc/27/25/49/341272549.db2.gz OIBRHLPZNRFGQE-NOZJJQNGSA-N 0 0 315.269 5.252 20 0 DKADRN CC(C)Oc1ccc(NC(=O)c2c(Cl)cccc2Cl)cc1 ZINC000080570128 341274022 /nfs/dbraw/zinc/27/40/22/341274022.db2.gz ZPNZDPACKOOJQH-UHFFFAOYSA-N 0 0 324.207 5.033 20 0 DKADRN O=C(Nc1ccc(Cl)c(F)c1)c1c(Cl)cccc1Cl ZINC000080570212 341274062 /nfs/dbraw/zinc/27/40/62/341274062.db2.gz YEYGTWPQQGNBIN-UHFFFAOYSA-N 0 0 318.562 5.038 20 0 DKADRN C[C@H](Sc1nnc(C2CC2)s1)c1ccc(F)c(Cl)c1 ZINC000080617544 341274223 /nfs/dbraw/zinc/27/42/23/341274223.db2.gz SUQFLKNNWHAGGF-ZETCQYMHSA-N 0 0 314.838 5.061 20 0 DKADRN C[C@@H](Sc1nnc(C2CC2)s1)c1ccc(F)c(Cl)c1 ZINC000080617549 341274171 /nfs/dbraw/zinc/27/41/71/341274171.db2.gz SUQFLKNNWHAGGF-SSDOTTSWSA-N 0 0 314.838 5.061 20 0 DKADRN Cc1cccc(Cl)c1NC(=O)c1cccc(Cl)c1Cl ZINC000080821681 341275328 /nfs/dbraw/zinc/27/53/28/341275328.db2.gz PWSXTHJIJOHXJC-UHFFFAOYSA-N 0 0 314.599 5.208 20 0 DKADRN Cc1c2cccc(C)c2oc1C(=O)Nc1c(C)cccc1Cl ZINC000080822062 341275259 /nfs/dbraw/zinc/27/52/59/341275259.db2.gz DVBPMUGZMHEWRE-UHFFFAOYSA-N 0 0 313.784 5.264 20 0 DKADRN Cc1cccc(Cl)c1NC(=O)c1cc(Cl)sc1Cl ZINC000080823251 341275369 /nfs/dbraw/zinc/27/53/69/341275369.db2.gz STCNIJBQOIXLEY-UHFFFAOYSA-N 0 0 320.628 5.269 20 0 DKADRN Cc1c(F)cccc1NC(=O)N(C)[C@@H](C)c1ccccc1Cl ZINC000081158753 341280429 /nfs/dbraw/zinc/28/04/29/341280429.db2.gz VORGVTSRZDSEEW-LBPRGKRZSA-N 0 0 320.795 5.012 20 0 DKADRN Cc1c(F)cccc1NC(=O)N(C)[C@H](C)c1ccccc1Cl ZINC000081158758 341280471 /nfs/dbraw/zinc/28/04/71/341280471.db2.gz VORGVTSRZDSEEW-GFCCVEGCSA-N 0 0 320.795 5.012 20 0 DKADRN CCCOc1cccc(NC(=O)c2c(Cl)cccc2Cl)c1 ZINC000081537986 341295458 /nfs/dbraw/zinc/29/54/58/341295458.db2.gz YWMXHFANYCHQJH-UHFFFAOYSA-N 0 0 324.207 5.035 20 0 DKADRN O=C(Nc1cccc(C(F)F)c1)c1c(Cl)cccc1Cl ZINC000081649930 341300981 /nfs/dbraw/zinc/30/09/81/341300981.db2.gz AWQQPASYRUKWLY-UHFFFAOYSA-N 0 0 316.134 5.183 20 0 DKADRN C[C@@H]1C[C@H]2CCCC[C@@H]2N1C(=O)Nc1ccccc1C(C)(C)C ZINC000083541063 337996077 /nfs/dbraw/zinc/99/60/77/337996077.db2.gz WZNFDAWZTGCOFT-RKVPGOIHSA-N 0 0 314.473 5.169 20 0 DKADRN C[C@H](SCc1nccn1C(F)F)c1ccc(F)c(Cl)c1 ZINC000083632973 337995796 /nfs/dbraw/zinc/99/57/96/337995796.db2.gz NMUJUNQPVZJCPL-QMMMGPOBSA-N 0 0 320.767 5.065 20 0 DKADRN CCSc1ccc(Cl)cc1C(=O)Nc1ccccc1C ZINC000084057681 337999148 /nfs/dbraw/zinc/99/91/48/337999148.db2.gz UZNNRWVYDMHMAF-UHFFFAOYSA-N 0 0 305.830 5.013 20 0 DKADRN Cc1ccsc1C[NH2+]C(c1cccs1)c1cccs1 ZINC000084225131 338000911 /nfs/dbraw/zinc/00/09/11/338000911.db2.gz VRHXBUSWLFSLAF-UHFFFAOYSA-N 0 0 305.493 5.059 20 0 DKADRN CC[C@@H](C)Sc1ccc(NCc2nc(C)c(C)o2)c(C)c1 ZINC000084492174 332002782 /nfs/dbraw/zinc/00/27/82/332002782.db2.gz UMXWMORWHGMYIE-GFCCVEGCSA-N 0 0 304.459 5.103 20 0 DKADRN CC[C@H](C)Sc1ccc(NCc2nc(C)c(C)o2)c(C)c1 ZINC000084492175 332002942 /nfs/dbraw/zinc/00/29/42/332002942.db2.gz UMXWMORWHGMYIE-LBPRGKRZSA-N 0 0 304.459 5.103 20 0 DKADRN Cc1nc(CNc2cc(Cl)ccc2SC(C)C)oc1C ZINC000084492638 338002838 /nfs/dbraw/zinc/00/28/38/338002838.db2.gz SXUWAGBRYYECPW-UHFFFAOYSA-N 0 0 310.850 5.057 20 0 DKADRN Cc1nc(CNc2ccccc2O[C@H](C)c2ccccc2)oc1C ZINC000084492981 192432909 /nfs/dbraw/zinc/43/29/09/192432909.db2.gz HNZIUOSDRFPLCK-MRXNPFEDSA-N 0 0 322.408 5.044 20 0 DKADRN Cc1nc(CNc2cccc(Cl)c2SC(C)C)oc1C ZINC000084493280 332003255 /nfs/dbraw/zinc/00/32/55/332003255.db2.gz KDOODPYDVVGODV-UHFFFAOYSA-N 0 0 310.850 5.057 20 0 DKADRN Cc1ccc(/C=C/CC(=O)Nc2ccccc2C(F)(F)F)cc1 ZINC000084769632 332005900 /nfs/dbraw/zinc/00/59/00/332005900.db2.gz YVZOUGAJIHMRAL-SNAWJCMRSA-N 0 0 319.326 5.056 20 0 DKADRN Cc1ccc(-c2nnc([C@@H](C)Sc3cccc(F)c3)o2)cc1 ZINC000084841990 338005274 /nfs/dbraw/zinc/00/52/74/338005274.db2.gz XFRGONLJTNKZEK-GFCCVEGCSA-N 0 0 314.385 5.037 20 0 DKADRN Cc1ccc(-c2nnc([C@H](C)Sc3cccc(F)c3)o2)cc1 ZINC000084841991 338005269 /nfs/dbraw/zinc/00/52/69/338005269.db2.gz XFRGONLJTNKZEK-LBPRGKRZSA-N 0 0 314.385 5.037 20 0 DKADRN Cc1cccc(Cl)c1NC(=O)c1ccc(OC(C)(C)C)cc1 ZINC000085296415 338008168 /nfs/dbraw/zinc/00/81/68/338008168.db2.gz RQUDAYCMBFPLOM-UHFFFAOYSA-N 0 0 317.816 5.078 20 0 DKADRN Cc1cccc(Cl)c1NC(=O)[C@@H](C)CSc1ccccc1 ZINC000085296508 338008206 /nfs/dbraw/zinc/00/82/06/338008206.db2.gz RLJNWKPAPSDCNV-ZDUSSCGKSA-N 0 0 319.857 5.015 20 0 DKADRN Cc1cccc(Cl)c1NC(=O)[C@H](C)CSc1ccccc1 ZINC000085296509 338008139 /nfs/dbraw/zinc/00/81/39/338008139.db2.gz RLJNWKPAPSDCNV-CYBMUJFWSA-N 0 0 319.857 5.015 20 0 DKADRN Cc1cccc(Cl)c1NC(=O)c1cc(Cl)ccc1Cl ZINC000085296553 338008188 /nfs/dbraw/zinc/00/81/88/338008188.db2.gz QISYUMUXWZIANW-UHFFFAOYSA-N 0 0 314.599 5.208 20 0 DKADRN Cc1cccc(Cl)c1NC(=O)[C@@H](C)c1ccc(Cl)s1 ZINC000085297512 338008304 /nfs/dbraw/zinc/00/83/04/338008304.db2.gz KUENADCKNLMVMZ-VIFPVBQESA-N 0 0 314.237 5.106 20 0 DKADRN Cc1cccc(Cl)c1NC(=O)[C@H](C)c1ccc(Cl)s1 ZINC000085297514 338008303 /nfs/dbraw/zinc/00/83/03/338008303.db2.gz KUENADCKNLMVMZ-SECBINFHSA-N 0 0 314.237 5.106 20 0 DKADRN C[C@@H](c1ccco1)N(C(=O)Nc1cccc2ccccc21)C1CC1 ZINC000086164806 338014555 /nfs/dbraw/zinc/01/45/55/338014555.db2.gz QJQOZGSIGZOSHU-AWEZNQCLSA-N 0 0 320.392 5.190 20 0 DKADRN C[C@H](c1ccco1)N(C(=O)Nc1cccc2ccccc21)C1CC1 ZINC000086164808 338014474 /nfs/dbraw/zinc/01/44/74/338014474.db2.gz QJQOZGSIGZOSHU-CQSZACIVSA-N 0 0 320.392 5.190 20 0 DKADRN FC(F)c1cccc(NCc2csc(C3CCCC3)n2)c1 ZINC000086205152 332019173 /nfs/dbraw/zinc/01/91/73/332019173.db2.gz OTXVDKVSSGVYMX-UHFFFAOYSA-N 0 0 308.397 5.350 20 0 DKADRN CO[C@@H](C)c1cccc(NCc2csc(C3CCCC3)n2)c1 ZINC000086205407 338013577 /nfs/dbraw/zinc/01/35/77/338013577.db2.gz MILBDHDHDLPOGR-ZDUSSCGKSA-N 0 0 316.470 5.120 20 0 DKADRN CO[C@H](C)c1cccc(NCc2csc(C3CCCC3)n2)c1 ZINC000086205408 338013556 /nfs/dbraw/zinc/01/35/56/338013556.db2.gz MILBDHDHDLPOGR-CYBMUJFWSA-N 0 0 316.470 5.120 20 0 DKADRN C[C@H](Nc1ccc(SC2CCCC2)cc1)c1nccs1 ZINC000086509317 340147746 /nfs/dbraw/zinc/14/77/46/340147746.db2.gz OHPGANNVPQLRLM-LBPRGKRZSA-N 0 0 304.484 5.351 20 0 DKADRN C[C@@H](Nc1ccc(SC2CCCC2)cc1)c1nccs1 ZINC000086509319 340147810 /nfs/dbraw/zinc/14/78/10/340147810.db2.gz OHPGANNVPQLRLM-GFCCVEGCSA-N 0 0 304.484 5.351 20 0 DKADRN Cc1csc(CSCc2csc(-c3ccsc3)n2)n1 ZINC000088306607 341398902 /nfs/dbraw/zinc/39/89/02/341398902.db2.gz CEIGKXOYALYAHA-UHFFFAOYSA-N 0 0 324.521 5.070 20 0 DKADRN Cc1nc(CS[C@@H](C)c2ncc(C(C)(C)C)o2)sc1C ZINC000088309413 341399005 /nfs/dbraw/zinc/39/90/05/341399005.db2.gz UBKRWYPMIKENDY-NSHDSACASA-N 0 0 310.488 5.040 20 0 DKADRN Cc1nc(CS[C@H](C)c2ncc(C(C)(C)C)o2)sc1C ZINC000088309414 341399029 /nfs/dbraw/zinc/39/90/29/341399029.db2.gz UBKRWYPMIKENDY-LLVKDONJSA-N 0 0 310.488 5.040 20 0 DKADRN Cc1nc(C)c(CNc2ccccc2SC2CCCC2)s1 ZINC000088867979 331490951 /nfs/dbraw/zinc/49/09/51/331490951.db2.gz WWJWYDJYDMAFGS-UHFFFAOYSA-N 0 0 318.511 5.407 20 0 DKADRN Cc1ncsc1CNc1ccc(SC2CCCC2)cc1 ZINC000088869409 331490994 /nfs/dbraw/zinc/49/09/94/331490994.db2.gz LBBAUHLKTUSEDR-UHFFFAOYSA-N 0 0 304.484 5.098 20 0 DKADRN C[C@H](N[C@@H](C)c1nc(-c2ccccc2)cs1)c1ccsc1 ZINC000089553691 340470031 /nfs/dbraw/zinc/47/00/31/340470031.db2.gz SSJXWYBKWHIELD-STQMWFEESA-N 0 0 314.479 5.283 20 0 DKADRN COc1ccccc1[C@@H](N[C@H](C)c1ccc(C)o1)c1ccccc1 ZINC000089554847 518170075 /nfs/dbraw/zinc/17/00/75/518170075.db2.gz IYJWNYITLTVRGT-IERDGZPVSA-N 0 0 321.420 5.037 20 0 DKADRN COc1ccccc1[C@H](N[C@H](C)c1ccc(C)o1)c1ccccc1 ZINC000089554849 341405484 /nfs/dbraw/zinc/40/54/84/341405484.db2.gz IYJWNYITLTVRGT-IIBYNOLFSA-N 0 0 321.420 5.037 20 0 DKADRN Cc1cc(C)c(NC(=O)c2cccc(-c3ccoc3)c2)c(C)c1 ZINC000089708296 341407551 /nfs/dbraw/zinc/40/75/51/341407551.db2.gz RDWDICZKUCLTJT-UHFFFAOYSA-N 0 0 305.377 5.124 20 0 DKADRN CC(C)c1nc([C@@H](C)N[C@@H]2CCSc3ccccc32)cs1 ZINC000090048373 185279703 /nfs/dbraw/zinc/27/97/03/185279703.db2.gz KHSZQUZMEKLNNE-TZMCWYRMSA-N 0 0 318.511 5.154 20 0 DKADRN CC(C)c1nc([C@H](C)N[C@@H]2CCSc3ccccc32)cs1 ZINC000090048374 185279952 /nfs/dbraw/zinc/27/99/52/185279952.db2.gz KHSZQUZMEKLNNE-GXTWGEPZSA-N 0 0 318.511 5.154 20 0 DKADRN CC(C)c1nc([C@@H](C)N[C@H]2CCSc3ccccc32)cs1 ZINC000090048375 185279838 /nfs/dbraw/zinc/27/98/38/185279838.db2.gz KHSZQUZMEKLNNE-OCCSQVGLSA-N 0 0 318.511 5.154 20 0 DKADRN CC(C)c1nc([C@H](C)N[C@H]2CCSc3ccccc32)cs1 ZINC000090048376 185279932 /nfs/dbraw/zinc/27/99/32/185279932.db2.gz KHSZQUZMEKLNNE-JSGCOSHPSA-N 0 0 318.511 5.154 20 0 DKADRN Cc1cc([C@@H](C)N[C@@H](C)c2csc(C(C)C)n2)c(C)s1 ZINC000090048411 518187906 /nfs/dbraw/zinc/18/79/06/518187906.db2.gz ZYEBLAFDDUKPQP-NEPJUHHUSA-N 0 0 308.516 5.357 20 0 DKADRN Cc1cc([C@@H](C)N[C@H](C)c2csc(C(C)C)n2)c(C)s1 ZINC000090048413 341412877 /nfs/dbraw/zinc/41/28/77/341412877.db2.gz ZYEBLAFDDUKPQP-VXGBXAGGSA-N 0 0 308.516 5.357 20 0 DKADRN CC(C)c1nc([C@@H](C)N[C@@H](C)c2ccc(Cl)cc2)cs1 ZINC000090048471 332082388 /nfs/dbraw/zinc/08/23/88/332082388.db2.gz POFGNBYNFPRUJZ-NWDGAFQWSA-N 0 0 308.878 5.332 20 0 DKADRN CC(C)c1nc([C@H](C)N[C@@H](C)c2ccc(Cl)cc2)cs1 ZINC000090048472 331976490 /nfs/dbraw/zinc/97/64/90/331976490.db2.gz POFGNBYNFPRUJZ-RYUDHWBXSA-N 0 0 308.878 5.332 20 0 DKADRN CC(C)c1nc([C@@H](C)N[C@H](C)c2ccc(Cl)cc2)cs1 ZINC000090048473 331976564 /nfs/dbraw/zinc/97/65/64/331976564.db2.gz POFGNBYNFPRUJZ-VXGBXAGGSA-N 0 0 308.878 5.332 20 0 DKADRN CC(C)c1nc([C@H](C)N[C@H](C)c2ccc(Cl)cc2)cs1 ZINC000090048474 331976579 /nfs/dbraw/zinc/97/65/79/331976579.db2.gz POFGNBYNFPRUJZ-NEPJUHHUSA-N 0 0 308.878 5.332 20 0 DKADRN CC[C@H](N[C@@H](C)c1csc(C(C)C)n1)c1ccc(OC)cc1 ZINC000090048509 341412949 /nfs/dbraw/zinc/41/29/49/341412949.db2.gz MDKIJIJYHQCIOG-BBRMVZONSA-N 0 0 318.486 5.077 20 0 DKADRN CC[C@@H](N[C@H](C)c1csc(C(C)C)n1)c1ccc(OC)cc1 ZINC000090048512 341412944 /nfs/dbraw/zinc/41/29/44/341412944.db2.gz MDKIJIJYHQCIOG-CZUORRHYSA-N 0 0 318.486 5.077 20 0 DKADRN CC(C)c1nc([C@@H](C)N[C@@H]2CCCc3sccc32)cs1 ZINC000090048521 185279738 /nfs/dbraw/zinc/27/97/38/185279738.db2.gz JOAKMUOLGAFCOW-DGCLKSJQSA-N 0 0 306.500 5.056 20 0 DKADRN CC(C)c1nc([C@H](C)N[C@@H]2CCCc3sccc32)cs1 ZINC000090048522 185279708 /nfs/dbraw/zinc/27/97/08/185279708.db2.gz JOAKMUOLGAFCOW-WCQYABFASA-N 0 0 306.500 5.056 20 0 DKADRN CC(C)c1nc([C@@H](C)N[C@H]2CCCc3sccc32)cs1 ZINC000090048523 185279788 /nfs/dbraw/zinc/27/97/88/185279788.db2.gz JOAKMUOLGAFCOW-YPMHNXCESA-N 0 0 306.500 5.056 20 0 DKADRN CC(C)c1nc([C@H](C)N[C@H]2CCCc3sccc32)cs1 ZINC000090048524 185279910 /nfs/dbraw/zinc/27/99/10/185279910.db2.gz JOAKMUOLGAFCOW-AAEUAGOBSA-N 0 0 306.500 5.056 20 0 DKADRN CC(C)c1nc([C@@H](C)N[C@@H]2CCc3cc(Cl)ccc32)cs1 ZINC000090048533 331976416 /nfs/dbraw/zinc/97/64/16/331976416.db2.gz IYKRSKKYDJXUBP-IAQYHMDHSA-N 0 0 320.889 5.258 20 0 DKADRN CC(C)c1nc([C@@H](C)N[C@H]2CCc3cc(Cl)ccc32)cs1 ZINC000090048535 331976464 /nfs/dbraw/zinc/97/64/64/331976464.db2.gz IYKRSKKYDJXUBP-ABAIWWIYSA-N 0 0 320.889 5.258 20 0 DKADRN CC[C@H](N[C@@H](C)c1csc(C(C)C)n1)c1cc(F)ccc1F ZINC000090048641 341412842 /nfs/dbraw/zinc/41/28/42/341412842.db2.gz HIPPMEOYKOZVBY-NHYWBVRUSA-N 0 0 324.440 5.347 20 0 DKADRN Cc1ccc([C@@H](C)N[C@@H](C)c2csc(C(C)C)n2)cc1F ZINC000090048908 331976585 /nfs/dbraw/zinc/97/65/85/331976585.db2.gz MMNNZDAEFJSFPL-OLZOCXBDSA-N 0 0 306.450 5.126 20 0 DKADRN CC(C)c1nc([C@@H](C)N[C@H](C)c2cccc(Cl)c2)cs1 ZINC000090049002 331976588 /nfs/dbraw/zinc/97/65/88/331976588.db2.gz CPRSCSWYEPJQQV-VXGBXAGGSA-N 0 0 308.878 5.332 20 0 DKADRN CC(C)c1nc([C@H](C)N[C@H](C)c2cccc(Cl)c2)cs1 ZINC000090049004 331976552 /nfs/dbraw/zinc/97/65/52/331976552.db2.gz CPRSCSWYEPJQQV-NEPJUHHUSA-N 0 0 308.878 5.332 20 0 DKADRN CC(C)c1nc([C@@H](C)N[C@@H](C)c2cc3ccccc3o2)cs1 ZINC000090049074 332082355 /nfs/dbraw/zinc/08/23/55/332082355.db2.gz SYRXBRQQKUOYTQ-OLZOCXBDSA-N 0 0 314.454 5.425 20 0 DKADRN CC(C)c1nc([C@H](C)N[C@@H](C)c2cc3ccccc3o2)cs1 ZINC000090049076 332082343 /nfs/dbraw/zinc/08/23/43/332082343.db2.gz SYRXBRQQKUOYTQ-STQMWFEESA-N 0 0 314.454 5.425 20 0 DKADRN CC(C)c1nc([C@@H](C)N[C@H](C)c2cc3ccccc3o2)cs1 ZINC000090049080 332082320 /nfs/dbraw/zinc/08/23/20/332082320.db2.gz SYRXBRQQKUOYTQ-CHWSQXEVSA-N 0 0 314.454 5.425 20 0 DKADRN CCOc1cccc([C@@H](C)N[C@@H](C)c2csc(C(C)C)n2)c1 ZINC000090049543 341412986 /nfs/dbraw/zinc/41/29/86/341412986.db2.gz KYABQMDGWUFSBV-KGLIPLIRSA-N 0 0 318.486 5.077 20 0 DKADRN CCOc1cccc([C@H](C)N[C@@H](C)c2csc(C(C)C)n2)c1 ZINC000090049546 341412847 /nfs/dbraw/zinc/41/28/47/341412847.db2.gz KYABQMDGWUFSBV-KBPBESRZSA-N 0 0 318.486 5.077 20 0 DKADRN CCOc1cccc([C@H](C)N[C@H](C)c2csc(C(C)C)n2)c1 ZINC000090049550 341412839 /nfs/dbraw/zinc/41/28/39/341412839.db2.gz KYABQMDGWUFSBV-UONOGXRCSA-N 0 0 318.486 5.077 20 0 DKADRN CC[C@H](N[C@@H](C)c1csc(C(C)C)n1)c1ccc(F)cc1F ZINC000090049717 341412961 /nfs/dbraw/zinc/41/29/61/341412961.db2.gz QCSHLDGQNONJCE-NHYWBVRUSA-N 0 0 324.440 5.347 20 0 DKADRN Cc1cccc([C@@H](C)N[C@@H](C)c2csc(C(C)C)n2)c1C ZINC000090049960 341412983 /nfs/dbraw/zinc/41/29/83/341412983.db2.gz VBDVBECSPATZKO-CABCVRRESA-N 0 0 302.487 5.295 20 0 DKADRN Cc1cccc([C@H](C)N[C@H](C)c2csc(C(C)C)n2)c1C ZINC000090049966 341412844 /nfs/dbraw/zinc/41/28/44/341412844.db2.gz VBDVBECSPATZKO-LSDHHAIUSA-N 0 0 302.487 5.295 20 0 DKADRN COc1ccccc1[C@H](N[C@H](C)c1ccc(C)cc1)c1ccco1 ZINC000090534601 341416728 /nfs/dbraw/zinc/41/67/28/341416728.db2.gz VVPMWRVYHKBOJA-IERDGZPVSA-N 0 0 321.420 5.037 20 0 DKADRN COc1ccccc1[C@@H](N[C@@H](C)c1ccc(C)cc1)c1ccco1 ZINC000090534608 341416845 /nfs/dbraw/zinc/41/68/45/341416845.db2.gz VVPMWRVYHKBOJA-HRAATJIYSA-N 0 0 321.420 5.037 20 0 DKADRN CC[C@H](N[C@@H](C)c1ccc(-c2ccccc2)o1)c1c(C)noc1C ZINC000090886123 341420064 /nfs/dbraw/zinc/42/00/64/341420064.db2.gz RFGONLIQRNECCX-GUYCJALGSA-N 0 0 324.424 5.353 20 0 DKADRN CC[C@@H](N[C@@H](C)c1ccc(-c2ccccc2)o1)c1c(C)noc1C ZINC000090886124 341420071 /nfs/dbraw/zinc/42/00/71/341420071.db2.gz RFGONLIQRNECCX-SUMWQHHRSA-N 0 0 324.424 5.353 20 0 DKADRN CC[C@H](N[C@H](C)c1ccc(-c2ccccc2)o1)c1c(C)noc1C ZINC000090886125 341420108 /nfs/dbraw/zinc/42/01/08/341420108.db2.gz RFGONLIQRNECCX-DYVFJYSZSA-N 0 0 324.424 5.353 20 0 DKADRN Cc1ccc([C@H](C)N[C@H](c2cccc(C)c2)c2ccccn2)cc1 ZINC000090946194 341420591 /nfs/dbraw/zinc/42/05/91/341420591.db2.gz KIJNYLYZSCRFNV-PGRDOPGGSA-N 0 0 316.448 5.139 20 0 DKADRN Cc1cccc([C@H](N[C@@H](C)c2ccccc2C)c2ccccn2)c1 ZINC000090946699 341420578 /nfs/dbraw/zinc/42/05/78/341420578.db2.gz HSJYSDMRYAXHKN-AVRDEDQJSA-N 0 0 316.448 5.139 20 0 DKADRN Cc1cccc([C@H](N[C@H](C)c2ccccc2C)c2ccccn2)c1 ZINC000090946704 341420643 /nfs/dbraw/zinc/42/06/43/341420643.db2.gz HSJYSDMRYAXHKN-GCJKJVERSA-N 0 0 316.448 5.139 20 0 DKADRN Cc1cccc([C@@H](N[C@H](C)c2ccccc2C)c2ccccn2)c1 ZINC000090946706 341420640 /nfs/dbraw/zinc/42/06/40/341420640.db2.gz HSJYSDMRYAXHKN-XMSQKQJNSA-N 0 0 316.448 5.139 20 0 DKADRN CC[C@H](N[C@H](c1cccc(F)c1)c1ccccn1)c1ccccc1 ZINC000090955981 337887505 /nfs/dbraw/zinc/88/75/05/337887505.db2.gz ACJZNPNFNOLLQQ-PZJWPPBQSA-N 0 0 320.411 5.051 20 0 DKADRN CC[C@@H](N[C@H](c1cccc(F)c1)c1ccccn1)c1ccccc1 ZINC000090955982 337887494 /nfs/dbraw/zinc/88/74/94/337887494.db2.gz ACJZNPNFNOLLQQ-TZIWHRDSSA-N 0 0 320.411 5.051 20 0 DKADRN Cc1ccc([C@H](C)N[C@@H](CC(F)(F)F)c2ccc(F)cc2)o1 ZINC000090968852 341420936 /nfs/dbraw/zinc/42/09/36/341420936.db2.gz GHFUUYKKZFQURA-FZMZJTMJSA-N 0 0 315.310 5.071 20 0 DKADRN Cc1ccc([C@@H](C)N[C@H](CC(F)(F)F)c2ccc(F)cc2)o1 ZINC000090968853 341420985 /nfs/dbraw/zinc/42/09/85/341420985.db2.gz GHFUUYKKZFQURA-BXUZGUMPSA-N 0 0 315.310 5.071 20 0 DKADRN Cc1ccc([C@H](C)N[C@H](CC(F)(F)F)c2ccc(F)cc2)o1 ZINC000090968854 341420943 /nfs/dbraw/zinc/42/09/43/341420943.db2.gz GHFUUYKKZFQURA-SMDDNHRTSA-N 0 0 315.310 5.071 20 0 DKADRN CCc1ccc(N[C@H](C)c2nnc(-c3ccccc3)o2)cc1CC ZINC000091553505 341426784 /nfs/dbraw/zinc/42/67/84/341426784.db2.gz DYFQLTXXCKKVNV-CQSZACIVSA-N 0 0 321.424 5.035 20 0 DKADRN Cc1c2ccccc2oc1[C@@H](N[C@@H](C)c1nccs1)C(C)C ZINC000091723742 341427840 /nfs/dbraw/zinc/42/78/40/341427840.db2.gz OORIVQVVSFXKPA-BBRMVZONSA-N 0 0 314.454 5.246 20 0 DKADRN CC(C)C[C@H](N[C@H](C)c1nccs1)c1ccc(Cl)cc1 ZINC000091727929 341428044 /nfs/dbraw/zinc/42/80/44/341428044.db2.gz WBEZADMKGBMVMZ-DOMZBBRYSA-N 0 0 308.878 5.235 20 0 DKADRN CC(C)C[C@@H](N[C@H](C)c1nccs1)c1ccc(Cl)cc1 ZINC000091727931 341427963 /nfs/dbraw/zinc/42/79/63/341427963.db2.gz WBEZADMKGBMVMZ-IUODEOHRSA-N 0 0 308.878 5.235 20 0 DKADRN Cc1cccc(C(N[C@H](C)c2nccs2)c2cccc(C)c2)c1 ZINC000091734552 341427952 /nfs/dbraw/zinc/42/79/52/341427952.db2.gz SAXNXIUOWTZEFY-MRXNPFEDSA-N 0 0 322.477 5.200 20 0 DKADRN Cc1ccc(CN[C@@H](C)c2nccs2)c(Oc2ccccc2)c1 ZINC000091735375 341428018 /nfs/dbraw/zinc/42/80/18/341428018.db2.gz ZEPRVDCAGHHUEZ-HNNXBMFYSA-N 0 0 324.449 5.095 20 0 DKADRN Clc1ccc(-c2nc(C3CCOCC3)cs2)c(Cl)c1 ZINC000092196921 332116375 /nfs/dbraw/zinc/11/63/75/332116375.db2.gz WSMSYTISMNPIPP-UHFFFAOYSA-N 0 0 314.237 5.011 20 0 DKADRN Cc1cc(CSc2ccc(N)cc2Cl)c2ccccc2n1 ZINC000092348234 332126951 /nfs/dbraw/zinc/12/69/51/332126951.db2.gz SJVZFFNIPGURHR-UHFFFAOYSA-N 0 0 314.841 5.071 20 0 DKADRN CCC[C@H]([NH2+][C@@H](C)c1cccnc1)c1cccc(C(F)(F)F)c1 ZINC000092744804 332130200 /nfs/dbraw/zinc/13/02/00/332130200.db2.gz TZHOLPXEULHDHL-GUYCJALGSA-N 0 0 322.374 5.292 20 0 DKADRN CCC[C@@H]([NH2+][C@H](C)c1cccnc1)c1cccc(C(F)(F)F)c1 ZINC000092744809 332130060 /nfs/dbraw/zinc/13/00/60/332130060.db2.gz TZHOLPXEULHDHL-CXAGYDPISA-N 0 0 322.374 5.292 20 0 DKADRN Clc1csc(CNc2ccccc2N2CCCCC2)c1 ZINC000093093255 333498143 /nfs/dbraw/zinc/49/81/43/333498143.db2.gz ZLKWMMQRFGGLNE-UHFFFAOYSA-N 0 0 306.862 5.004 20 0 DKADRN Clc1csc(CNc2cccc(-c3nccs3)c2)c1 ZINC000093094729 333503181 /nfs/dbraw/zinc/50/31/81/333503181.db2.gz FDRWXJPNCDDASC-UHFFFAOYSA-N 0 0 306.843 5.137 20 0 DKADRN CN(C(=O)c1coc2ccccc12)c1c(Cl)cccc1Cl ZINC000093262383 341463701 /nfs/dbraw/zinc/46/37/01/341463701.db2.gz RVAGYAIPZQRANV-UHFFFAOYSA-N 0 0 320.175 5.016 20 0 DKADRN C[C@@H](N[C@@H](C)c1nc2c(s1)CCCC2)c1cccc(Cl)c1 ZINC000093368837 335278072 /nfs/dbraw/zinc/27/80/72/335278072.db2.gz ZTXBBQIGARPLJU-NEPJUHHUSA-N 0 0 320.889 5.087 20 0 DKADRN C[C@@H](N[C@H](C)c1cccc(Cl)c1)c1nc2c(s1)CCCC2 ZINC000093368839 335278234 /nfs/dbraw/zinc/27/82/34/335278234.db2.gz ZTXBBQIGARPLJU-VXGBXAGGSA-N 0 0 320.889 5.087 20 0 DKADRN C[C@H](N[C@@H](C)c1ccc(Cl)cc1)c1nc2c(s1)CCCC2 ZINC000093368864 335278052 /nfs/dbraw/zinc/27/80/52/335278052.db2.gz HSRGHHCWSSWTIW-RYUDHWBXSA-N 0 0 320.889 5.087 20 0 DKADRN C[C@@H](N[C@@H](C)c1nc2c(s1)CCCC2)c1ccc(Cl)cc1 ZINC000093368865 335278065 /nfs/dbraw/zinc/27/80/65/335278065.db2.gz HSRGHHCWSSWTIW-NEPJUHHUSA-N 0 0 320.889 5.087 20 0 DKADRN C[C@@H](N[C@@H](C)c1ccc(Cl)cc1)c1nc2c(s1)CCCC2 ZINC000093368866 335278455 /nfs/dbraw/zinc/27/84/55/335278455.db2.gz HSRGHHCWSSWTIW-NWDGAFQWSA-N 0 0 320.889 5.087 20 0 DKADRN C[C@@H](N[C@H](C)c1ccc(Cl)cc1)c1nc2c(s1)CCCC2 ZINC000093368867 335278423 /nfs/dbraw/zinc/27/84/23/335278423.db2.gz HSRGHHCWSSWTIW-VXGBXAGGSA-N 0 0 320.889 5.087 20 0 DKADRN Cc1ccc(Oc2ccccc2CN[C@@H](C)c2nccs2)cc1 ZINC000093405929 341471872 /nfs/dbraw/zinc/47/18/72/341471872.db2.gz PSDVTSRXXCYEHE-HNNXBMFYSA-N 0 0 324.449 5.095 20 0 DKADRN Cc1ccccc1Oc1ccccc1CN[C@H](C)c1nccs1 ZINC000093405946 341471758 /nfs/dbraw/zinc/47/17/58/341471758.db2.gz DZDQMOJMBVXDGV-OAHLLOKOSA-N 0 0 324.449 5.095 20 0 DKADRN Cc1cccc(Oc2ccccc2CN[C@@H](C)c2nccs2)c1 ZINC000093405947 341471881 /nfs/dbraw/zinc/47/18/81/341471881.db2.gz KORMVAXDALJEMX-HNNXBMFYSA-N 0 0 324.449 5.095 20 0 DKADRN CC(C)c1ccc(NC(=O)C2C[C@@H](C)O[C@H](C)C2)c(C(C)C)c1 ZINC000093947899 341487242 /nfs/dbraw/zinc/48/72/42/341487242.db2.gz LNIDCIXVQABIIG-HUUCEWRRSA-N 0 0 317.473 5.076 20 0 DKADRN CC(C)c1cccc(C(C)C)c1NC(=O)C1C[C@H](C)O[C@@H](C)C1 ZINC000094034288 341488212 /nfs/dbraw/zinc/48/82/12/341488212.db2.gz BWFSLVKIUFGMKI-GJZGRUSLSA-N 0 0 317.473 5.076 20 0 DKADRN CC(C)c1cccc(C(C)C)c1NC(=O)C1C[C@@H](C)O[C@H](C)C1 ZINC000094034289 341488106 /nfs/dbraw/zinc/48/81/06/341488106.db2.gz BWFSLVKIUFGMKI-HUUCEWRRSA-N 0 0 317.473 5.076 20 0 DKADRN Clc1cccc(-c2nc3ccccn3c2-c2ccccc2)c1 ZINC000095579986 185380948 /nfs/dbraw/zinc/38/09/48/185380948.db2.gz NCPHZDRCKJPNJB-UHFFFAOYSA-N 0 0 304.780 5.322 20 0 DKADRN Cc1cccc(C(C)C)c1NC(=O)CC(C)(C)c1ccccc1 ZINC000096652222 332138925 /nfs/dbraw/zinc/13/89/25/332138925.db2.gz HGCLYMFRHKGFFR-UHFFFAOYSA-N 0 0 309.453 5.425 20 0 DKADRN CC(=O)c1ccc(C(=O)Nc2c(C(C)C)cccc2C(C)C)cc1 ZINC000096656186 332138741 /nfs/dbraw/zinc/13/87/41/332138741.db2.gz LPILVBXIRALANX-UHFFFAOYSA-N 0 0 323.436 5.388 20 0 DKADRN Cc1ccccc1CS[C@@H](C)c1nnc(-c2cccs2)o1 ZINC000096946760 335832432 /nfs/dbraw/zinc/83/24/32/335832432.db2.gz LXOZZQAJTFUUOS-LBPRGKRZSA-N 0 0 316.451 5.101 20 0 DKADRN Clc1ccc(NCc2csc(-c3ccsc3)n2)cc1 ZINC000096954534 185393813 /nfs/dbraw/zinc/39/38/13/185393813.db2.gz KBMIKIFNKNYHID-UHFFFAOYSA-N 0 0 306.843 5.137 20 0 DKADRN Fc1cc(Cl)ccc1NCc1csc(-c2ccsc2)n1 ZINC000096954596 185393898 /nfs/dbraw/zinc/39/38/98/185393898.db2.gz WZQMKGGXZLEHKE-UHFFFAOYSA-N 0 0 324.833 5.276 20 0 DKADRN Fc1ccc(NCc2csc(-c3ccsc3)n2)c(Cl)c1 ZINC000096954621 185393941 /nfs/dbraw/zinc/39/39/41/185393941.db2.gz DKNKBCIKVHWTSH-UHFFFAOYSA-N 0 0 324.833 5.276 20 0 DKADRN Cc1cccc(C)c1NCc1csc(-c2ccsc2)n1 ZINC000096970208 185394528 /nfs/dbraw/zinc/39/45/28/185394528.db2.gz KOIDAPSGTOFFDA-UHFFFAOYSA-N 0 0 300.452 5.101 20 0 DKADRN Cc1oc(-c2cccs2)nc1CNc1ccc(F)c(Cl)c1 ZINC000097027508 185398962 /nfs/dbraw/zinc/39/89/62/185398962.db2.gz KKGBFJCKJMIPHP-UHFFFAOYSA-N 0 0 322.792 5.116 20 0 DKADRN Cc1oc(-c2cccs2)nc1CNc1cccc2ccccc21 ZINC000097027520 185399000 /nfs/dbraw/zinc/39/90/00/185399000.db2.gz QCHPFPGXGKVTRN-UHFFFAOYSA-N 0 0 320.417 5.477 20 0 DKADRN Cc1oc(-c2cccs2)nc1CNc1ccc(F)cc1Cl ZINC000097027523 185399147 /nfs/dbraw/zinc/39/91/47/185399147.db2.gz UIJGIVULOBEONW-UHFFFAOYSA-N 0 0 322.792 5.116 20 0 DKADRN Cc1oc(-c2cccs2)nc1CNc1ccc(Cl)cc1F ZINC000097027524 185399176 /nfs/dbraw/zinc/39/91/76/185399176.db2.gz NOEABJZLGHYDFM-UHFFFAOYSA-N 0 0 322.792 5.116 20 0 DKADRN Cc1ccccc1C[S@@](=O)Cc1ccc(-c2ccccc2)cc1 ZINC000097175195 185418994 /nfs/dbraw/zinc/41/89/94/185418994.db2.gz ZKZQMVQKFCQTLM-HSZRJFAPSA-N 0 0 320.457 5.111 20 0 DKADRN C[C@@H](c1ccccc1)[S@@](=O)Cc1ccc(-c2ccccc2)cc1 ZINC000097175213 185418934 /nfs/dbraw/zinc/41/89/34/185418934.db2.gz NWAYGBDGYOLJHZ-GAJHUEQPSA-N 0 0 320.457 5.364 20 0 DKADRN C[C@H](c1ccccc1)[S@@](=O)Cc1ccc(-c2ccccc2)cc1 ZINC000097175214 185418939 /nfs/dbraw/zinc/41/89/39/185418939.db2.gz NWAYGBDGYOLJHZ-UZUQRXQVSA-N 0 0 320.457 5.364 20 0 DKADRN C[C@@H](c1ccccc1)[S@](=O)Cc1ccc(-c2ccccc2)cc1 ZINC000097175215 185418988 /nfs/dbraw/zinc/41/89/88/185418988.db2.gz NWAYGBDGYOLJHZ-SBUREZEXSA-N 0 0 320.457 5.364 20 0 DKADRN C[C@H](c1ccccc1)[S@](=O)Cc1ccc(-c2ccccc2)cc1 ZINC000097175216 185418824 /nfs/dbraw/zinc/41/88/24/185418824.db2.gz NWAYGBDGYOLJHZ-HXOBKFHXSA-N 0 0 320.457 5.364 20 0 DKADRN CC[C@H](SCC(=O)Nc1c(C)cccc1C)c1ccccc1 ZINC000101585681 334332508 /nfs/dbraw/zinc/33/25/08/334332508.db2.gz SXTOKMNCISNEJS-KRWDZBQOSA-N 0 0 313.466 5.126 20 0 DKADRN CC[C@@H](SCC(=O)Nc1c(C)cccc1C)c1ccccc1 ZINC000101585684 334332507 /nfs/dbraw/zinc/33/25/07/334332507.db2.gz SXTOKMNCISNEJS-QGZVFWFLSA-N 0 0 313.466 5.126 20 0 DKADRN Cc1ccccc1NC(=O)N(Cc1cccc(Cl)c1)C(C)C ZINC000101735074 334351846 /nfs/dbraw/zinc/35/18/46/334351846.db2.gz ZLEYUGAPGAMBLA-UHFFFAOYSA-N 0 0 316.832 5.091 20 0 DKADRN Cc1csc(N(C(=O)C2CCCCCC2)c2ccccc2)n1 ZINC000101807863 193842962 /nfs/dbraw/zinc/84/29/62/193842962.db2.gz SNZMRHPRSQBCPJ-UHFFFAOYSA-N 0 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337895382 /nfs/dbraw/zinc/89/53/82/337895382.db2.gz SYGHMBXJMVRVTH-LLVKDONJSA-N 0 0 322.499 5.083 20 0 DKADRN Cc1cccc(C(C)C)c1NC(=O)c1cc(Cl)ncc1Cl ZINC000121615932 132156864 /nfs/dbraw/zinc/15/68/64/132156864.db2.gz DHVIWOOUPMWBRC-UHFFFAOYSA-N 0 0 323.223 5.073 20 0 DKADRN COc1ccc(C)cc1[C@@H](C)N[C@@H](c1ccco1)c1ccccc1 ZINC000121627271 337896799 /nfs/dbraw/zinc/89/67/99/337896799.db2.gz WMGMKYBJRMIXLB-IIBYNOLFSA-N 0 0 321.420 5.037 20 0 DKADRN COc1ccc(C)cc1[C@H](C)N[C@@H](c1ccco1)c1ccccc1 ZINC000121627452 337896804 /nfs/dbraw/zinc/89/68/04/337896804.db2.gz WMGMKYBJRMIXLB-HRAATJIYSA-N 0 0 321.420 5.037 20 0 DKADRN CC(=O)Nc1cccc([C@H](C)[NH2+][C@@H](c2ccccc2)C(C)(C)C)c1 ZINC000121857379 195362580 /nfs/dbraw/zinc/36/25/80/195362580.db2.gz FFWJDYMHLIKKMT-YWZLYKJASA-N 0 0 324.468 5.083 20 0 DKADRN CC(=O)Nc1cccc([C@@H](C)[NH2+][C@@H](c2ccccc2)C(C)(C)C)c1 ZINC000121857531 195362308 /nfs/dbraw/zinc/36/23/08/195362308.db2.gz FFWJDYMHLIKKMT-QRWLVFNGSA-N 0 0 324.468 5.083 20 0 DKADRN CC(=O)Nc1cccc([C@H](C)[NH2+][C@H](c2ccccc2)C(C)(C)C)c1 ZINC000121857641 195362318 /nfs/dbraw/zinc/36/23/18/195362318.db2.gz FFWJDYMHLIKKMT-MGPUTAFESA-N 0 0 324.468 5.083 20 0 DKADRN CC(=O)Nc1cccc([C@@H](C)[NH2+][C@H](c2ccccc2)C(C)(C)C)c1 ZINC000121857714 195362345 /nfs/dbraw/zinc/36/23/45/195362345.db2.gz FFWJDYMHLIKKMT-FOIQADDNSA-N 0 0 324.468 5.083 20 0 DKADRN CC[C@@H](N[C@H](c1ccco1)c1ccccc1)c1ccc(OC)cc1 ZINC000122043547 337906555 /nfs/dbraw/zinc/90/65/55/337906555.db2.gz ZEOWFGXHMFDZLP-CTNGQTDRSA-N 0 0 321.420 5.119 20 0 DKADRN CC(C)Sc1ccccc1NC(=O)c1ccccc1Cl ZINC000122072429 337906083 /nfs/dbraw/zinc/90/60/83/337906083.db2.gz QNLIVDZJBIBBKF-UHFFFAOYSA-N 0 0 305.830 5.093 20 0 DKADRN CCOc1ccc([C@H](C)N[C@H](c2ccco2)c2ccccc2)cc1 ZINC000122125256 337908181 /nfs/dbraw/zinc/90/81/81/337908181.db2.gz DNXPKZHDLFIPAD-KKSFZXQISA-N 0 0 321.420 5.119 20 0 DKADRN CCOc1ccc([C@@H](C)N[C@@H](c2ccco2)c2ccccc2)cc1 ZINC000122125461 337908220 /nfs/dbraw/zinc/90/82/20/337908220.db2.gz DNXPKZHDLFIPAD-IIBYNOLFSA-N 0 0 321.420 5.119 20 0 DKADRN c1coc([C@@H](N[C@@H]2CCSc3ccccc32)c2ccccc2)c1 ZINC000122125890 337908337 /nfs/dbraw/zinc/90/83/37/337908337.db2.gz ZXCMGDKLENHJSD-XLIONFOSSA-N 0 0 321.445 5.196 20 0 DKADRN CCOc1ccccc1[C@H](C)N[C@H](c1ccco1)c1ccccc1 ZINC000122127068 337908218 /nfs/dbraw/zinc/90/82/18/337908218.db2.gz DTVYWVKFOXXWOD-KKSFZXQISA-N 0 0 321.420 5.119 20 0 DKADRN CCOc1ccccc1[C@@H](C)N[C@@H](c1ccco1)c1ccccc1 ZINC000122127230 337908366 /nfs/dbraw/zinc/90/83/66/337908366.db2.gz DTVYWVKFOXXWOD-IIBYNOLFSA-N 0 0 321.420 5.119 20 0 DKADRN CCCc1nnc(S[C@H](C)c2ccc(Cl)c(Cl)c2)o1 ZINC000122303146 337914551 /nfs/dbraw/zinc/91/45/51/337914551.db2.gz JEHMUROONPGTKH-MRVPVSSYSA-N 0 0 317.241 5.182 20 0 DKADRN Cc1ccccc1NC(=O)Nc1cccc(CCC(F)(F)F)c1 ZINC000122315401 337915987 /nfs/dbraw/zinc/91/59/87/337915987.db2.gz PAVYNRORSUUMDK-UHFFFAOYSA-N 0 0 322.330 5.134 20 0 DKADRN C[C@H](C(=O)Nc1ccccc1-c1cccs1)c1ccccc1 ZINC000122494894 337920022 /nfs/dbraw/zinc/92/00/22/337920022.db2.gz PVDFJPIGBIOVHM-AWEZNQCLSA-N 0 0 307.418 5.157 20 0 DKADRN C[C@@H](C(=O)Nc1ccccc1-c1cccs1)c1ccccc1 ZINC000122495110 337920060 /nfs/dbraw/zinc/92/00/60/337920060.db2.gz PVDFJPIGBIOVHM-CQSZACIVSA-N 0 0 307.418 5.157 20 0 DKADRN CCCOc1ccc(NC(=O)c2c(Cl)cccc2Cl)cc1 ZINC000122609326 337922931 /nfs/dbraw/zinc/92/29/31/337922931.db2.gz LPFYNWXJWRIGDS-UHFFFAOYSA-N 0 0 324.207 5.035 20 0 DKADRN CCO[C@@H](C)c1nc(CS[C@H](C)c2ccccc2)cs1 ZINC000122793566 337925420 /nfs/dbraw/zinc/92/54/20/337925420.db2.gz OOWCCYGWCNLCDC-QWHCGFSZSA-N 0 0 307.484 5.235 20 0 DKADRN Cc1cnc(CN[C@H](C)c2ccc(-c3cccs3)cc2)s1 ZINC000122870676 337924766 /nfs/dbraw/zinc/92/47/66/337924766.db2.gz RVZSTCQQMLJFJM-CYBMUJFWSA-N 0 0 314.479 5.031 20 0 DKADRN CCC[C@@H](N[C@H](c1nccs1)c1ccccc1)c1ccccc1 ZINC000123065989 337943100 /nfs/dbraw/zinc/94/31/00/337943100.db2.gz YWVYBLLTXYMKRS-MOPGFXCFSA-N 0 0 322.477 5.364 20 0 DKADRN CCC[C@H](N[C@@H](c1nccs1)c1ccccc1)c1ccccc1 ZINC000123066201 337943161 /nfs/dbraw/zinc/94/31/61/337943161.db2.gz YWVYBLLTXYMKRS-RBUKOAKNSA-N 0 0 322.477 5.364 20 0 DKADRN CCC[C@@H](N[C@@H](c1nccs1)c1ccccc1)c1ccccc1 ZINC000123066428 337943103 /nfs/dbraw/zinc/94/31/03/337943103.db2.gz YWVYBLLTXYMKRS-RTBURBONSA-N 0 0 322.477 5.364 20 0 DKADRN Cc1cc(C)cc([C@H](C)N[C@@H](c2nccs2)c2ccccc2)c1 ZINC000123071764 337943221 /nfs/dbraw/zinc/94/32/21/337943221.db2.gz HITGUYUIUFKUDS-QFBILLFUSA-N 0 0 322.477 5.200 20 0 DKADRN CCc1ccc([C@@H](C)N[C@H](c2nccs2)c2ccccc2)cc1 ZINC000123099349 337943889 /nfs/dbraw/zinc/94/38/89/337943889.db2.gz WDBIVDGSEUXFID-BEFAXECRSA-N 0 0 322.477 5.146 20 0 DKADRN CCc1ccc([C@@H](C)N[C@@H](c2nccs2)c2ccccc2)cc1 ZINC000123099792 337943860 /nfs/dbraw/zinc/94/38/60/337943860.db2.gz WDBIVDGSEUXFID-DNVCBOLYSA-N 0 0 322.477 5.146 20 0 DKADRN CCc1ccc([C@H](C)N[C@@H](c2nccs2)c2ccccc2)cc1 ZINC000123099981 337943849 /nfs/dbraw/zinc/94/38/49/337943849.db2.gz WDBIVDGSEUXFID-HNAYVOBHSA-N 0 0 322.477 5.146 20 0 DKADRN CC[C@H](N[C@H](c1nccs1)c1ccccc1)c1ccc(C)cc1 ZINC000123101947 337945710 /nfs/dbraw/zinc/94/57/10/337945710.db2.gz XUKQHVDIYCEHJE-OALUTQOASA-N 0 0 322.477 5.282 20 0 DKADRN CC[C@@H](N[C@H](c1nccs1)c1ccccc1)c1ccc(C)cc1 ZINC000123102132 337945751 /nfs/dbraw/zinc/94/57/51/337945751.db2.gz XUKQHVDIYCEHJE-MOPGFXCFSA-N 0 0 322.477 5.282 20 0 DKADRN CC[C@@H](N[C@@H](c1nccs1)c1ccccc1)c1ccc(C)cc1 ZINC000123102507 337946073 /nfs/dbraw/zinc/94/60/73/337946073.db2.gz XUKQHVDIYCEHJE-RTBURBONSA-N 0 0 322.477 5.282 20 0 DKADRN Cc1cccc([C@H](C)N[C@@H](c2nccs2)c2ccccc2)c1C ZINC000123124920 337947073 /nfs/dbraw/zinc/94/70/73/337947073.db2.gz GLYYWRGZNSVLAQ-QFBILLFUSA-N 0 0 322.477 5.200 20 0 DKADRN Cc1ccc([C@@H](C)N[C@@H](c2nccs2)c2ccccc2)cc1C ZINC000123181686 337953947 /nfs/dbraw/zinc/95/39/47/337953947.db2.gz LCPVDDSGFCNEQO-VQIMIIECSA-N 0 0 322.477 5.200 20 0 DKADRN CC[C@H](N[C@H](c1nccs1)c1ccccc1)c1cccs1 ZINC000123190174 337039074 /nfs/dbraw/zinc/03/90/74/337039074.db2.gz SCMABOLNISVUFT-HOCLYGCPSA-N 0 0 314.479 5.035 20 0 DKADRN CC[C@@H](N[C@H](c1nccs1)c1ccccc1)c1cccs1 ZINC000123190347 337039052 /nfs/dbraw/zinc/03/90/52/337039052.db2.gz SCMABOLNISVUFT-ZBFHGGJFSA-N 0 0 314.479 5.035 20 0 DKADRN CC[C@H](N[C@@H](c1nccs1)c1ccccc1)c1cccs1 ZINC000123190561 337039025 /nfs/dbraw/zinc/03/90/25/337039025.db2.gz SCMABOLNISVUFT-GOEBONIOSA-N 0 0 314.479 5.035 20 0 DKADRN CC[C@@H](N[C@@H](c1nccs1)c1ccccc1)c1cccs1 ZINC000123190788 337039081 /nfs/dbraw/zinc/03/90/81/337039081.db2.gz SCMABOLNISVUFT-GDBMZVCRSA-N 0 0 314.479 5.035 20 0 DKADRN C[C@H](N[C@@H]1CCc2sc(Cl)cc21)c1ccc(F)cc1F ZINC000123251921 337962405 /nfs/dbraw/zinc/96/24/05/337962405.db2.gz KFVLZHWCVIFNAD-ISVAXAHUSA-N 0 0 313.800 5.018 20 0 DKADRN C[C@@H](N[C@@H]1CCc2sc(Cl)cc21)c1ccc(F)cc1F ZINC000123252176 337962445 /nfs/dbraw/zinc/96/24/45/337962445.db2.gz KFVLZHWCVIFNAD-AMIZOPFISA-N 0 0 313.800 5.018 20 0 DKADRN C[C@@H](N[C@H]1CCc2sc(Cl)cc21)c1ccc(F)cc1F ZINC000123252670 337962526 /nfs/dbraw/zinc/96/25/26/337962526.db2.gz KFVLZHWCVIFNAD-OQPBUACISA-N 0 0 313.800 5.018 20 0 DKADRN Cc1ccc([C@@H](C)N[C@H](c2nccs2)c2ccccc2)c(C)c1 ZINC000123264208 337962911 /nfs/dbraw/zinc/96/29/11/337962911.db2.gz FFAYJYGJNMAPEZ-APWZRJJASA-N 0 0 322.477 5.200 20 0 DKADRN Cc1cscc1NC(=O)N1CCCC[C@H]1c1ccc(C)cc1 ZINC000123433323 340778848 /nfs/dbraw/zinc/77/88/48/340778848.db2.gz LUBCTNQVFSTATR-KRWDZBQOSA-N 0 0 314.454 5.124 20 0 DKADRN Cc1cscc1NC(=O)N1CCCC[C@@H]1c1ccc(C)cc1 ZINC000123433582 340777155 /nfs/dbraw/zinc/77/71/55/340777155.db2.gz LUBCTNQVFSTATR-QGZVFWFLSA-N 0 0 314.454 5.124 20 0 DKADRN Cc1ccc(C)c(N[C@H](C)c2nnc(-c3ccc(C)c(C)c3)o2)c1 ZINC000123508650 331548362 /nfs/dbraw/zinc/54/83/62/331548362.db2.gz XQFYPOYOTYCGGE-MRXNPFEDSA-N 0 0 321.424 5.143 20 0 DKADRN Cc1ccc(N[C@@H](C)c2nnc(-c3ccc(C)c(C)c3)o2)c(C)c1 ZINC000123510498 331556222 /nfs/dbraw/zinc/55/62/22/331556222.db2.gz GGYLCVXJMGCTOA-INIZCTEOSA-N 0 0 321.424 5.143 20 0 DKADRN Cc1cscc1NC(=O)N1CCC[C@@H]1c1ccc(C)c(C)c1 ZINC000123525544 332254935 /nfs/dbraw/zinc/25/49/35/332254935.db2.gz JDXLDUGHXQZQFU-QGZVFWFLSA-N 0 0 314.454 5.042 20 0 DKADRN Cc1cscc1NC(=O)N(Cc1cccc(Cl)c1)C(C)C ZINC000123774781 340794804 /nfs/dbraw/zinc/79/48/04/340794804.db2.gz UISTYIMSCNIAPP-UHFFFAOYSA-N 0 0 322.861 5.152 20 0 DKADRN Cc1cscc1NC(=O)N1CCC[C@H]1c1cccc(C)c1C ZINC000123825491 340795556 /nfs/dbraw/zinc/79/55/56/340795556.db2.gz GJKFKBODUVGLGV-KRWDZBQOSA-N 0 0 314.454 5.042 20 0 DKADRN Cc1cscc1NC(=O)N1CCC[C@@H]1c1cccc(C)c1C ZINC000123825733 340795438 /nfs/dbraw/zinc/79/54/38/340795438.db2.gz GJKFKBODUVGLGV-QGZVFWFLSA-N 0 0 314.454 5.042 20 0 DKADRN CC(C)CC[C@@H]1CCCN1C(=O)Nc1cccc(C(F)F)c1 ZINC000123905691 340796025 /nfs/dbraw/zinc/79/60/25/340796025.db2.gz DXEAYBMAOXKNIY-HNNXBMFYSA-N 0 0 310.388 5.057 20 0 DKADRN Cc1ccc([C@@H]2CCCCCN2C(=O)Nc2cscc2C)o1 ZINC000124125086 525795113 /nfs/dbraw/zinc/79/51/13/525795113.db2.gz DBHVNINNXDZOMZ-HNNXBMFYSA-N 0 0 318.442 5.107 20 0 DKADRN Cc1ccc([C@H]2CCCCCN2C(=O)Nc2cscc2C)o1 ZINC000124125263 525988790 /nfs/dbraw/zinc/98/87/90/525988790.db2.gz DBHVNINNXDZOMZ-OAHLLOKOSA-N 0 0 318.442 5.107 20 0 DKADRN CC[C@H](C)Sc1ccc(NC(=O)C(C)C)c(C(F)(F)F)c1 ZINC000124548064 340799795 /nfs/dbraw/zinc/79/97/95/340799795.db2.gz YLCOCCQTDLBCEU-JTQLQIEISA-N 0 0 319.392 5.191 20 0 DKADRN Cc1cscc1NC(=O)N1CCC[C@@H]1c1ccccc1Cl ZINC000124548989 526471704 /nfs/dbraw/zinc/47/17/04/526471704.db2.gz MVBJUTKAEWHEMK-OAHLLOKOSA-N 0 0 320.845 5.079 20 0 DKADRN Cc1cscc1NC(=O)N1CCC[C@H]1c1ccccc1Cl ZINC000124549176 526471032 /nfs/dbraw/zinc/47/10/32/526471032.db2.gz MVBJUTKAEWHEMK-HNNXBMFYSA-N 0 0 320.845 5.079 20 0 DKADRN C[C@H](N[C@H](c1cccc(Cl)c1)c1ccccn1)c1ccccc1 ZINC000124550288 340799715 /nfs/dbraw/zinc/79/97/15/340799715.db2.gz KDEOZIDRJUEJPP-MGPUTAFESA-N 0 0 322.839 5.175 20 0 DKADRN C[C@@H](N[C@H](c1cccc(Cl)c1)c1ccccn1)c1ccccc1 ZINC000124550476 340799806 /nfs/dbraw/zinc/79/98/06/340799806.db2.gz KDEOZIDRJUEJPP-FOIQADDNSA-N 0 0 322.839 5.175 20 0 DKADRN Cc1ccc(Cl)c(NC(=O)c2cccc(Cl)c2Cl)c1 ZINC000124640151 340800231 /nfs/dbraw/zinc/80/02/31/340800231.db2.gz YHZOUJWYUGEGDB-UHFFFAOYSA-N 0 0 314.599 5.208 20 0 DKADRN Cc1ccc(Cl)c(NC(=O)c2cc(Cl)ccc2Cl)c1 ZINC000124800832 340800951 /nfs/dbraw/zinc/80/09/51/340800951.db2.gz SHLYAZOIOIHWHK-UHFFFAOYSA-N 0 0 314.599 5.208 20 0 DKADRN Cc1occc1-c1nnc(S[C@@H](C)c2cccc(Cl)c2)o1 ZINC000124915011 340801527 /nfs/dbraw/zinc/80/15/27/340801527.db2.gz TXUVBOXHHMLVGW-JTQLQIEISA-N 0 0 320.801 5.145 20 0 DKADRN Cc1ccc(Cl)c(NC(=O)c2cc(C)c(F)cc2Cl)c1 ZINC000124961181 340801795 /nfs/dbraw/zinc/80/17/95/340801795.db2.gz GSSFEVQUXCBDID-UHFFFAOYSA-N 0 0 312.171 5.002 20 0 DKADRN C[C@H](NCc1cccc(Cl)c1F)c1cc2ccccc2o1 ZINC000125074680 340802218 /nfs/dbraw/zinc/80/22/18/340802218.db2.gz GPTMLVHSSSRUQP-NSHDSACASA-N 0 0 303.764 5.076 20 0 DKADRN C[C@@H](NCc1cccc(Cl)c1F)c1cc2ccccc2o1 ZINC000125074916 340802111 /nfs/dbraw/zinc/80/21/11/340802111.db2.gz GPTMLVHSSSRUQP-LLVKDONJSA-N 0 0 303.764 5.076 20 0 DKADRN Cc1nnc([C@@H](C)SCc2sc3ccccc3c2Cl)o1 ZINC000125257437 337410171 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LPOMGNZIWGYVCV-HNNXBMFYSA-N 0 0 322.905 5.335 20 0 DKADRN CC[C@@H](NCc1csc(C(C)(C)C)n1)c1ccc(Cl)cc1 ZINC000131653770 341106281 /nfs/dbraw/zinc/10/62/81/341106281.db2.gz LPOMGNZIWGYVCV-OAHLLOKOSA-N 0 0 322.905 5.335 20 0 DKADRN Cc1cccc(Cl)c1NC(=O)N(C)[C@@H](C)c1ccc(F)cc1 ZINC000132220932 341118635 /nfs/dbraw/zinc/11/86/35/341118635.db2.gz FYPVZRFLEWSUNC-LBPRGKRZSA-N 0 0 320.795 5.012 20 0 DKADRN Cc1cccc(Cl)c1NC(=O)N(C)[C@H](C)c1ccc(F)cc1 ZINC000132221116 341118661 /nfs/dbraw/zinc/11/86/61/341118661.db2.gz FYPVZRFLEWSUNC-GFCCVEGCSA-N 0 0 320.795 5.012 20 0 DKADRN CC[C@H](NCc1csc(C(C)(C)C)n1)c1cccc(Cl)c1 ZINC000132336121 332128735 /nfs/dbraw/zinc/12/87/35/332128735.db2.gz FSJMBOUOCAYBAB-HNNXBMFYSA-N 0 0 322.905 5.335 20 0 DKADRN CC[C@@H](NCc1csc(C(C)(C)C)n1)c1cccc(Cl)c1 ZINC000132336324 332128730 /nfs/dbraw/zinc/12/87/30/332128730.db2.gz FSJMBOUOCAYBAB-OAHLLOKOSA-N 0 0 322.905 5.335 20 0 DKADRN CCN(Cc1ccccc1C)C(=O)Nc1c(C)cccc1Cl ZINC000132426674 341122819 /nfs/dbraw/zinc/12/28/19/341122819.db2.gz ANEUXOGVBMRUJI-UHFFFAOYSA-N 0 0 316.832 5.011 20 0 DKADRN Cc1cccc(Cl)c1NC(=O)N(Cc1ccccc1)C(C)C ZINC000132461894 341123745 /nfs/dbraw/zinc/12/37/45/341123745.db2.gz FSAOCKSUQAZHLR-UHFFFAOYSA-N 0 0 316.832 5.091 20 0 DKADRN CC(C)c1nc([C@@H](C)NCc2cccc3ccccc32)cs1 ZINC000132481818 341124187 /nfs/dbraw/zinc/12/41/87/341124187.db2.gz GGZRCEIWTNDYNB-CQSZACIVSA-N 0 0 310.466 5.271 20 0 DKADRN CC(C)c1nc([C@H](C)NCc2cccc3ccccc32)cs1 ZINC000132482010 341124289 /nfs/dbraw/zinc/12/42/89/341124289.db2.gz GGZRCEIWTNDYNB-AWEZNQCLSA-N 0 0 310.466 5.271 20 0 DKADRN C[C@@H](c1cccc(Cl)c1)[S@@](=O)Cc1cccc(Cl)c1 ZINC000132514864 341125347 /nfs/dbraw/zinc/12/53/47/341125347.db2.gz PFPOFJVWBUSFOA-JEOXALJRSA-N 0 0 313.249 5.003 20 0 DKADRN C[C@H](c1cccc(Cl)c1)[S@@](=O)Cc1cccc(Cl)c1 ZINC000132515087 341125345 /nfs/dbraw/zinc/12/53/45/341125345.db2.gz PFPOFJVWBUSFOA-NSPYISDASA-N 0 0 313.249 5.003 20 0 DKADRN C[C@@H](c1cccc(Cl)c1)[S@](=O)Cc1cccc(Cl)c1 ZINC000132515278 341125364 /nfs/dbraw/zinc/12/53/64/341125364.db2.gz PFPOFJVWBUSFOA-WLRWDXFRSA-N 0 0 313.249 5.003 20 0 DKADRN C[C@H](c1cccc(Cl)c1)[S@](=O)Cc1cccc(Cl)c1 ZINC000132515473 341125365 /nfs/dbraw/zinc/12/53/65/341125365.db2.gz PFPOFJVWBUSFOA-WYRIXSBYSA-N 0 0 313.249 5.003 20 0 DKADRN C[C@@H](c1cccc(Cl)c1)[S@@](=O)Cc1ccccc1Cl ZINC000132522118 341125742 /nfs/dbraw/zinc/12/57/42/341125742.db2.gz YYSBBRIARXSHBX-JEOXALJRSA-N 0 0 313.249 5.003 20 0 DKADRN C[C@H](c1cccc(Cl)c1)[S@@](=O)Cc1ccccc1Cl ZINC000132522305 341125688 /nfs/dbraw/zinc/12/56/88/341125688.db2.gz YYSBBRIARXSHBX-NSPYISDASA-N 0 0 313.249 5.003 20 0 DKADRN C[C@@H](c1cccc(Cl)c1)[S@](=O)Cc1ccccc1Cl ZINC000132522509 341125738 /nfs/dbraw/zinc/12/57/38/341125738.db2.gz YYSBBRIARXSHBX-WLRWDXFRSA-N 0 0 313.249 5.003 20 0 DKADRN C[C@H](c1cccc(Cl)c1)[S@](=O)Cc1ccccc1Cl ZINC000132522713 341125687 /nfs/dbraw/zinc/12/56/87/341125687.db2.gz YYSBBRIARXSHBX-WYRIXSBYSA-N 0 0 313.249 5.003 20 0 DKADRN CSc1cccc(NC(=O)Nc2c(C)cccc2Cl)c1 ZINC000132634620 341134218 /nfs/dbraw/zinc/13/42/18/341134218.db2.gz WITMZXFQMZGKPS-UHFFFAOYSA-N 0 0 306.818 5.014 20 0 DKADRN CC(C)c1cccc(C(C)C)c1NC(=O)c1ccc2c(c1)CCN2 ZINC000132707152 341142835 /nfs/dbraw/zinc/14/28/35/341142835.db2.gz RWIQCVDDEMBGRE-UHFFFAOYSA-N 0 0 322.452 5.154 20 0 DKADRN Cc1ccc([C@@H](C)N(C)C(=O)Nc2c(C)cccc2Cl)cc1 ZINC000132735996 341144213 /nfs/dbraw/zinc/14/42/13/341144213.db2.gz FPBNAWGLAXFVKY-CQSZACIVSA-N 0 0 316.832 5.182 20 0 DKADRN Cc1ccc([C@H](C)N(C)C(=O)Nc2c(C)cccc2Cl)cc1 ZINC000132736212 341144190 /nfs/dbraw/zinc/14/41/90/341144190.db2.gz FPBNAWGLAXFVKY-AWEZNQCLSA-N 0 0 316.832 5.182 20 0 DKADRN C[C@@H](c1cccc(Cl)c1)[S@@](=O)Cc1ccc(Cl)cc1 ZINC000132774283 341145294 /nfs/dbraw/zinc/14/52/94/341145294.db2.gz RZKBSLFJGWSQQC-JEOXALJRSA-N 0 0 313.249 5.003 20 0 DKADRN C[C@H](c1cccc(Cl)c1)[S@@](=O)Cc1ccc(Cl)cc1 ZINC000132774482 341145289 /nfs/dbraw/zinc/14/52/89/341145289.db2.gz RZKBSLFJGWSQQC-NSPYISDASA-N 0 0 313.249 5.003 20 0 DKADRN C[C@@H](c1cccc(Cl)c1)[S@](=O)Cc1ccc(Cl)cc1 ZINC000132774662 341145250 /nfs/dbraw/zinc/14/52/50/341145250.db2.gz RZKBSLFJGWSQQC-WLRWDXFRSA-N 0 0 313.249 5.003 20 0 DKADRN C[C@H](c1cccc(Cl)c1)[S@](=O)Cc1ccc(Cl)cc1 ZINC000132774873 341145332 /nfs/dbraw/zinc/14/53/32/341145332.db2.gz RZKBSLFJGWSQQC-WYRIXSBYSA-N 0 0 313.249 5.003 20 0 DKADRN Cc1noc(-c2ccccc2)c1NC(=O)c1ccc(C(C)C)cc1 ZINC000132823392 341146434 /nfs/dbraw/zinc/14/64/34/341146434.db2.gz BIXLPYNVAREDHC-UHFFFAOYSA-N 0 0 320.392 5.026 20 0 DKADRN Cc1cccc(Cl)c1NC(=O)N(C)[C@@H](C)c1ccccc1F ZINC000132893652 341148681 /nfs/dbraw/zinc/14/86/81/341148681.db2.gz KQIKRBVGYYEUKT-LBPRGKRZSA-N 0 0 320.795 5.012 20 0 DKADRN Cc1cccc(Cl)c1NC(=O)N(C)[C@H](C)c1ccccc1F ZINC000132893854 341148627 /nfs/dbraw/zinc/14/86/27/341148627.db2.gz KQIKRBVGYYEUKT-GFCCVEGCSA-N 0 0 320.795 5.012 20 0 DKADRN CCC[C@H](NCc1csc(C(C)(C)C)n1)c1ccccc1 ZINC000132947431 332136046 /nfs/dbraw/zinc/13/60/46/332136046.db2.gz IAOBAGIWNKCCSM-INIZCTEOSA-N 0 0 302.487 5.072 20 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20 0 DKADRN Cc1cc(C(=O)Nc2cccc(C)c2Cl)c(Cl)cc1F ZINC000133256858 341167045 /nfs/dbraw/zinc/16/70/45/341167045.db2.gz RANQAONHLMMGNM-UHFFFAOYSA-N 0 0 312.171 5.002 20 0 DKADRN Cc1cccc(Cl)c1NC(=O)N1CCC[C@@H]1c1cccs1 ZINC000133291350 341170500 /nfs/dbraw/zinc/17/05/00/341170500.db2.gz JRUQTEZUFUWIFC-CYBMUJFWSA-N 0 0 320.845 5.079 20 0 DKADRN Cc1cccc(Cl)c1NC(=O)N1CCC[C@H]1c1cccs1 ZINC000133291562 341170489 /nfs/dbraw/zinc/17/04/89/341170489.db2.gz JRUQTEZUFUWIFC-ZDUSSCGKSA-N 0 0 320.845 5.079 20 0 DKADRN CCO[C@@H](C)c1nc(CSc2cccc(Cl)c2)cs1 ZINC000133467773 341176082 /nfs/dbraw/zinc/17/60/82/341176082.db2.gz UHRMHKOSIWFSTF-JTQLQIEISA-N 0 0 313.875 5.186 20 0 DKADRN CCO[C@H](C)c1nc(CSc2cccc(Cl)c2)cs1 ZINC000133467993 341176053 /nfs/dbraw/zinc/17/60/53/341176053.db2.gz UHRMHKOSIWFSTF-SNVBAGLBSA-N 0 0 313.875 5.186 20 0 DKADRN CC(=O)[C@@H](C)CCCCC(=O)Nc1ccccc1-c1ccccc1 ZINC000133684333 519760473 /nfs/dbraw/zinc/76/04/73/519760473.db2.gz FUJBHYVZKBQJKI-INIZCTEOSA-N 0 0 323.436 5.078 20 0 DKADRN CC(C)c1cc(C(=O)Nc2c(C(C)C)cccc2C(C)C)no1 ZINC000133699403 341182334 /nfs/dbraw/zinc/18/23/34/341182334.db2.gz OIYUTHUYTZHYHL-UHFFFAOYSA-N 0 0 314.429 5.297 20 0 DKADRN Cc1cc(C(=O)Nc2c(C)cccc2C(C)C)c(Cl)cc1F ZINC000133719613 341183036 /nfs/dbraw/zinc/18/30/36/341183036.db2.gz UZCHCUSCTFWIPE-UHFFFAOYSA-N 0 0 319.807 5.472 20 0 DKADRN Cc1cccc(C(C)C)c1NC(=O)c1cc(F)c(Cl)cc1F ZINC000133803156 341189205 /nfs/dbraw/zinc/18/92/05/341189205.db2.gz XSRQKLKHUCVRBD-UHFFFAOYSA-N 0 0 323.770 5.302 20 0 DKADRN Cc1cccc(C(C)C)c1NC(=O)[C@@H](C)c1c(F)cccc1F ZINC000133803397 341189202 /nfs/dbraw/zinc/18/92/02/341189202.db2.gz MYLDUSHKQTWQPG-ZDUSSCGKSA-N 0 0 317.379 5.139 20 0 DKADRN Cc1cccc(C(C)C)c1NC(=O)[C@H](C)c1c(F)cccc1F ZINC000133803572 341189211 /nfs/dbraw/zinc/18/92/11/341189211.db2.gz MYLDUSHKQTWQPG-CYBMUJFWSA-N 0 0 317.379 5.139 20 0 DKADRN Cc1cc(SC2CCCCC2)ccc1NC(=O)N1CCCC1 ZINC000133813913 341189905 /nfs/dbraw/zinc/18/99/05/341189905.db2.gz VSGRBTWBVQUSEV-UHFFFAOYSA-N 0 0 318.486 5.048 20 0 DKADRN CCC[C@H](C(=O)N(c1nc(C)cs1)c1ccccc1)C(C)C ZINC000134046407 341205342 /nfs/dbraw/zinc/20/53/42/341205342.db2.gz KOGZNDVJXBIONL-INIZCTEOSA-N 0 0 316.470 5.189 20 0 DKADRN CCC[C@@H](C(=O)N(c1nc(C)cs1)c1ccccc1)C(C)C ZINC000134046591 341205344 /nfs/dbraw/zinc/20/53/44/341205344.db2.gz KOGZNDVJXBIONL-MRXNPFEDSA-N 0 0 316.470 5.189 20 0 DKADRN Cc1cccc(F)c1NC(=O)N(C)[C@@H](C)c1cccc(Cl)c1 ZINC000134166462 341208216 /nfs/dbraw/zinc/20/82/16/341208216.db2.gz XNPBTMUETCUQAG-LBPRGKRZSA-N 0 0 320.795 5.012 20 0 DKADRN Cc1cccc(F)c1NC(=O)N(C)[C@H](C)c1cccc(Cl)c1 ZINC000134166655 341208153 /nfs/dbraw/zinc/20/81/53/341208153.db2.gz XNPBTMUETCUQAG-GFCCVEGCSA-N 0 0 320.795 5.012 20 0 DKADRN CCc1c2ccccc2oc1[C@@H](C)N[C@@H](C)c1nc(C)cs1 ZINC000134225430 341210041 /nfs/dbraw/zinc/21/00/41/341210041.db2.gz KLJIZDWYAWZUIF-OLZOCXBDSA-N 0 0 314.454 5.172 20 0 DKADRN CCc1c2ccccc2oc1[C@H](C)N[C@@H](C)c1nc(C)cs1 ZINC000134225453 341209935 /nfs/dbraw/zinc/20/99/35/341209935.db2.gz KLJIZDWYAWZUIF-STQMWFEESA-N 0 0 314.454 5.172 20 0 DKADRN CCc1c2ccccc2oc1[C@@H](C)N[C@H](C)c1nc(C)cs1 ZINC000134225469 341210012 /nfs/dbraw/zinc/21/00/12/341210012.db2.gz KLJIZDWYAWZUIF-CHWSQXEVSA-N 0 0 314.454 5.172 20 0 DKADRN CCc1c2ccccc2oc1[C@H](C)N[C@H](C)c1nc(C)cs1 ZINC000134225491 341209922 /nfs/dbraw/zinc/20/99/22/341209922.db2.gz KLJIZDWYAWZUIF-QWHCGFSZSA-N 0 0 314.454 5.172 20 0 DKADRN Cc1cscc1N[C@@H](C)c1ccc(Br)s1 ZINC000134327881 341213041 /nfs/dbraw/zinc/21/30/41/341213041.db2.gz MFEXEQQMYXZTJN-QMMMGPOBSA-N 0 0 302.262 5.054 20 0 DKADRN Cc1cscc1N[C@H](C)c1ccc(Br)s1 ZINC000134327903 341213093 /nfs/dbraw/zinc/21/30/93/341213093.db2.gz MFEXEQQMYXZTJN-MRVPVSSYSA-N 0 0 302.262 5.054 20 0 DKADRN Cc1cscc1N[C@@H](C)c1sccc1Br ZINC000134328155 341213092 /nfs/dbraw/zinc/21/30/92/341213092.db2.gz AWOJJKFLNWYFCP-QMMMGPOBSA-N 0 0 302.262 5.054 20 0 DKADRN Cc1cscc1N[C@H](C)c1sccc1Br ZINC000134328176 341213088 /nfs/dbraw/zinc/21/30/88/341213088.db2.gz AWOJJKFLNWYFCP-MRVPVSSYSA-N 0 0 302.262 5.054 20 0 DKADRN 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332646132 /nfs/dbraw/zinc/64/61/32/332646132.db2.gz GHAUDJRBGUDSPJ-UHFFFAOYSA-N 0 0 303.352 5.308 20 0 DKADRN CC(C)c1cccc(N(C)C(=O)c2cccc(C(F)F)c2)c1 ZINC000171552812 332669689 /nfs/dbraw/zinc/66/96/89/332669689.db2.gz ZXZVUNRVDSMLQV-UHFFFAOYSA-N 0 0 303.352 5.024 20 0 DKADRN CSc1ccsc1C(=O)Nc1cc(Cl)ccc1Cl ZINC000171679581 341782431 /nfs/dbraw/zinc/78/24/31/341782431.db2.gz MAPHKDNZLYLCQX-UHFFFAOYSA-N 0 0 318.250 5.029 20 0 DKADRN CCSc1cccc(NC(=O)N(C)[C@@H](C)c2cccs2)c1 ZINC000172215491 341794849 /nfs/dbraw/zinc/79/48/49/341794849.db2.gz LNXBDYJWGVUTPK-LBPRGKRZSA-N 0 0 320.483 5.085 20 0 DKADRN CCSc1cccc(NC(=O)N(C)[C@H](C)c2cccs2)c1 ZINC000172215497 341794914 /nfs/dbraw/zinc/79/49/14/341794914.db2.gz LNXBDYJWGVUTPK-GFCCVEGCSA-N 0 0 320.483 5.085 20 0 DKADRN C[C@@H](c1ccccc1)[S@@](=O)Cc1cc(Cl)ccc1Cl ZINC000172840625 340343810 /nfs/dbraw/zinc/34/38/10/340343810.db2.gz DSWJYJRDXSLTGR-WLRWDXFRSA-N 0 0 313.249 5.003 20 0 DKADRN C[C@H](c1ccccc1)[S@@](=O)Cc1cc(Cl)ccc1Cl ZINC000172840628 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ZINC000172976698 332820797 /nfs/dbraw/zinc/82/07/97/332820797.db2.gz GIDLUTMTCZGAPV-UHFFFAOYSA-N 0 0 312.372 5.087 20 0 DKADRN Cc1nc(C2CCCC2)sc1C(=O)Nc1ccccc1Cl ZINC000173018469 340354089 /nfs/dbraw/zinc/35/40/89/340354089.db2.gz MQJQCAPWGYVCBR-UHFFFAOYSA-N 0 0 320.845 5.015 20 0 DKADRN O=C(Nc1ccc(Cl)cc1Cl)c1cccc(F)c1Cl ZINC000173025271 333068372 /nfs/dbraw/zinc/06/83/72/333068372.db2.gz YWEUMYOENLLADF-UHFFFAOYSA-N 0 0 318.562 5.038 20 0 DKADRN Cc1ccc(Oc2ccccc2NC(=O)CCC(F)(F)F)cc1 ZINC000173068695 340357234 /nfs/dbraw/zinc/35/72/34/340357234.db2.gz BVFPWNAHMSVJKC-UHFFFAOYSA-N 0 0 323.314 5.068 20 0 DKADRN CC[C@H](c1ccccc1)[S@@](=O)[C@@H](C)c1ccc(Cl)cc1 ZINC000173159314 340359281 /nfs/dbraw/zinc/35/92/81/340359281.db2.gz CGQITQQLSFILTM-ZLXGRDSLSA-N 0 0 306.858 5.301 20 0 DKADRN CC[C@H](c1ccccc1)[S@](=O)[C@@H](C)c1ccc(Cl)cc1 ZINC000173159331 340359278 /nfs/dbraw/zinc/35/92/78/340359278.db2.gz CGQITQQLSFILTM-WSXQUGQNSA-N 0 0 306.858 5.301 20 0 DKADRN Cc1cccc([C@H](C)[S@@](=O)[C@@H](C)c2ccc(Cl)cc2)c1 ZINC000173159574 340359257 /nfs/dbraw/zinc/35/92/57/340359257.db2.gz ZHMHZAHQGTXXEW-YRVVQQKDSA-N 0 0 306.858 5.219 20 0 DKADRN Cc1cccc([C@H](C)[S@](=O)[C@@H](C)c2ccc(Cl)cc2)c1 ZINC000173159594 340359279 /nfs/dbraw/zinc/35/92/79/340359279.db2.gz ZHMHZAHQGTXXEW-PJSUUKDQSA-N 0 0 306.858 5.219 20 0 DKADRN C[C@@H](c1ccc(Cl)c(Cl)c1)[S@@](=O)Cc1ccccc1 ZINC000173176591 340359529 /nfs/dbraw/zinc/35/95/29/340359529.db2.gz SDACKBQZWMQMQL-WLRWDXFRSA-N 0 0 313.249 5.003 20 0 DKADRN C[C@H](c1ccc(Cl)c(Cl)c1)[S@@](=O)Cc1ccccc1 ZINC000173176606 340359546 /nfs/dbraw/zinc/35/95/46/340359546.db2.gz SDACKBQZWMQMQL-WYRIXSBYSA-N 0 0 313.249 5.003 20 0 DKADRN C[C@@H](c1ccc(Cl)c(Cl)c1)[S@](=O)Cc1ccccc1 ZINC000173176615 340359468 /nfs/dbraw/zinc/35/94/68/340359468.db2.gz SDACKBQZWMQMQL-JEOXALJRSA-N 0 0 313.249 5.003 20 0 DKADRN C[C@H](c1ccc(Cl)c(Cl)c1)[S@](=O)Cc1ccccc1 ZINC000173176627 340359516 /nfs/dbraw/zinc/35/95/16/340359516.db2.gz 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/nfs/dbraw/zinc/36/33/31/340363331.db2.gz HLXRJZFFGMGAFZ-UHFFFAOYSA-N 0 0 317.454 5.099 20 0 DKADRN Cc1c(CSC(C)C)cccc1NC(=O)c1ccccc1F ZINC000173368237 340363577 /nfs/dbraw/zinc/36/35/77/340363577.db2.gz NEFODIGWYYUBGC-UHFFFAOYSA-N 0 0 317.429 5.028 20 0 DKADRN CSc1ccc([C@H](C)NCc2nc(C(C)(C)C)cs2)cc1 ZINC000173394429 340364103 /nfs/dbraw/zinc/36/41/03/340364103.db2.gz QKDUHPMDWWYTSH-LBPRGKRZSA-N 0 0 320.527 5.013 20 0 DKADRN CCc1nc([C@@H](C)N[C@@H](CC)c2cccc(Cl)c2)cs1 ZINC000173408846 340364348 /nfs/dbraw/zinc/36/43/48/340364348.db2.gz BIYKBGNLHOODQZ-RISCZKNCSA-N 0 0 308.878 5.161 20 0 DKADRN CCc1nc([C@H](C)N[C@@H](CC)c2cccc(Cl)c2)cs1 ZINC000173408858 340364447 /nfs/dbraw/zinc/36/44/47/340364447.db2.gz BIYKBGNLHOODQZ-FZMZJTMJSA-N 0 0 308.878 5.161 20 0 DKADRN CCc1nc([C@@H](C)N[C@H](CC)c2cccc(Cl)c2)cs1 ZINC000173408871 340364353 /nfs/dbraw/zinc/36/43/53/340364353.db2.gz BIYKBGNLHOODQZ-BXUZGUMPSA-N 0 0 308.878 5.161 20 0 DKADRN CCc1nc([C@H](C)N[C@H](CC)c2cccc(Cl)c2)cs1 ZINC000173408882 340364417 /nfs/dbraw/zinc/36/44/17/340364417.db2.gz BIYKBGNLHOODQZ-SMDDNHRTSA-N 0 0 308.878 5.161 20 0 DKADRN CC(C)c1ccc(NC(=O)CCC2CCOCC2)c(C(C)C)c1 ZINC000173446205 340365286 /nfs/dbraw/zinc/36/52/86/340365286.db2.gz YBYLRNYEMQUMFY-UHFFFAOYSA-N 0 0 317.473 5.079 20 0 DKADRN CC(C)c1ccc(NC(=O)CCC(F)(F)F)c(C(C)C)c1 ZINC000173446355 340365303 /nfs/dbraw/zinc/36/53/03/340365303.db2.gz LPPMKCWCAZYSFV-UHFFFAOYSA-N 0 0 301.352 5.214 20 0 DKADRN CCC(CC)c1cc(CN[C@@H](C)c2ccc(SC)cc2)on1 ZINC000173446691 340365312 /nfs/dbraw/zinc/36/53/12/340365312.db2.gz MIUMNTFAQKLIRJ-ZDUSSCGKSA-N 0 0 318.486 5.151 20 0 DKADRN CCC(CC)c1cc(CN[C@H](C)c2ccc(SC)cc2)on1 ZINC000173446705 340365325 /nfs/dbraw/zinc/36/53/25/340365325.db2.gz MIUMNTFAQKLIRJ-CYBMUJFWSA-N 0 0 318.486 5.151 20 0 DKADRN CC(C)c1cccc(C(C)C)c1NC(=O)CCC1CCOCC1 ZINC000173713467 340372649 /nfs/dbraw/zinc/37/26/49/340372649.db2.gz YUILDWGEVQVZDQ-UHFFFAOYSA-N 0 0 317.473 5.079 20 0 DKADRN CCCN(C(=O)Nc1cccc(CSC(C)C)c1C)C1CC1 ZINC000173872493 341820697 /nfs/dbraw/zinc/82/06/97/341820697.db2.gz DXEJAMQUAXCGKQ-UHFFFAOYSA-N 0 0 320.502 5.043 20 0 DKADRN Cc1c(CSC(C)C)cccc1NC(=O)N1CCCC[C@H]1C ZINC000173878139 332839370 /nfs/dbraw/zinc/83/93/70/332839370.db2.gz HTBKMBZYDRWRHL-CQSZACIVSA-N 0 0 320.502 5.043 20 0 DKADRN C[C@@H](Nc1ccc2ncsc2c1)c1ncc(-c2ccccc2)o1 ZINC000173920606 332841021 /nfs/dbraw/zinc/84/10/21/332841021.db2.gz IOAGWSBYHHOFPL-GFCCVEGCSA-N 0 0 321.405 5.124 20 0 DKADRN CC(C)c1ccc(NC(=O)[C@@H](C)c2cccnc2)c(C(C)C)c1 ZINC000173926424 340377996 /nfs/dbraw/zinc/37/79/96/340377996.db2.gz YXQMBZLLHSSCSK-HNNXBMFYSA-N 0 0 310.441 5.071 20 0 DKADRN CC(C)c1ccc(NC(=O)[C@H](C)c2cccnc2)c(C(C)C)c1 ZINC000173926439 340377972 /nfs/dbraw/zinc/37/79/72/340377972.db2.gz YXQMBZLLHSSCSK-OAHLLOKOSA-N 0 0 310.441 5.071 20 0 DKADRN Cc1ccc([C@@H](C)N[C@@H](C)c2ncc(-c3ccccc3)o2)cc1 ZINC000173971687 341822281 /nfs/dbraw/zinc/82/22/81/341822281.db2.gz MYXQRZBWZHIKTO-CVEARBPZSA-N 0 0 306.409 5.062 20 0 DKADRN CC[C@H](N[C@@H](C)c1ncc(-c2ccccc2)o1)c1ccccc1 ZINC000174013971 332843068 /nfs/dbraw/zinc/84/30/68/332843068.db2.gz RLAMMCVFHIUECI-YJBOKZPZSA-N 0 0 306.409 5.144 20 0 DKADRN CC[C@H](N[C@@H](C)c1ncc(-c2ccccc2)o1)c1ccc(F)cc1 ZINC000174015422 341823029 /nfs/dbraw/zinc/82/30/29/341823029.db2.gz XFLOHQAAJNGSGE-KSSFIOAISA-N 0 0 324.399 5.283 20 0 DKADRN CC[C@@H](N[C@@H](C)c1ncc(-c2ccccc2)o1)c1ccc(F)cc1 ZINC000174015436 341823016 /nfs/dbraw/zinc/82/30/16/341823016.db2.gz XFLOHQAAJNGSGE-KBXCAEBGSA-N 0 0 324.399 5.283 20 0 DKADRN CC[C@H](N[C@H](C)c1ncc(-c2ccccc2)o1)c1ccc(F)cc1 ZINC000174015444 341823002 /nfs/dbraw/zinc/82/30/02/341823002.db2.gz XFLOHQAAJNGSGE-KDOFPFPSSA-N 0 0 324.399 5.283 20 0 DKADRN C[C@H]([NH2+]Cc1ccccc1-c1ccc(Cl)cc1)c1ccncc1 ZINC000174042140 340380773 /nfs/dbraw/zinc/38/07/73/340380773.db2.gz WYSYXOQDUZMIAX-HNNXBMFYSA-N 0 0 322.839 5.253 20 0 DKADRN C[C@@H]([NH2+]Cc1ccccc1-c1ccc(Cl)cc1)c1ccncc1 ZINC000174042151 340380800 /nfs/dbraw/zinc/38/08/00/340380800.db2.gz 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/nfs/dbraw/zinc/38/29/47/340382947.db2.gz KMPKDAIFEUXKGB-IBGZPJMESA-N 0 0 308.425 5.063 20 0 DKADRN Cc1ccc([C@H]2CCCCN2C(=O)Nc2ccccc2C)cc1 ZINC000174145391 340382958 /nfs/dbraw/zinc/38/29/58/340382958.db2.gz KMPKDAIFEUXKGB-LJQANCHMSA-N 0 0 308.425 5.063 20 0 DKADRN CC(C)c1cccc(C(C)C)c1NC(=O)N1C[C@@H]2[C@H](C1)C2(C)C ZINC000174255815 332848677 /nfs/dbraw/zinc/84/86/77/332848677.db2.gz MAMUGBDYPUYNMU-CALCHBBNSA-N 0 0 314.473 5.053 20 0 DKADRN Fc1ccccc1-c1cnc(CNc2cccc(C(F)F)c2)o1 ZINC000174306981 337142446 /nfs/dbraw/zinc/14/24/46/337142446.db2.gz MELDVACLAGEAPP-UHFFFAOYSA-N 0 0 318.298 5.030 20 0 DKADRN CCSCC[C@@H](C)N(C)C(=O)Nc1c(C)cccc1C(C)C ZINC000174420444 332853807 /nfs/dbraw/zinc/85/38/07/332853807.db2.gz LSRBRDRWBUDPDJ-OAHLLOKOSA-N 0 0 322.518 5.114 20 0 DKADRN CCSCC[C@H](C)N(C)C(=O)Nc1c(C)cccc1C(C)C ZINC000174420458 332853775 /nfs/dbraw/zinc/85/37/75/332853775.db2.gz LSRBRDRWBUDPDJ-HNNXBMFYSA-N 0 0 322.518 5.114 20 0 DKADRN CC[C@]1(C)CCCN(C(=O)Nc2c(C)cccc2C(C)C)C1 ZINC000174420522 332853798 /nfs/dbraw/zinc/85/37/98/332853798.db2.gz MUCDQPKLTVTZGM-LJQANCHMSA-N 0 0 302.462 5.162 20 0 DKADRN CC[C@@]1(C)CCCN(C(=O)Nc2c(C)cccc2C(C)C)C1 ZINC000174420539 332853766 /nfs/dbraw/zinc/85/37/66/332853766.db2.gz MUCDQPKLTVTZGM-IBGZPJMESA-N 0 0 302.462 5.162 20 0 DKADRN Cc1cccc(C(C)C)c1NC(=O)N1CCC(C(C)C)CC1 ZINC000174421845 332853799 /nfs/dbraw/zinc/85/37/99/332853799.db2.gz ISUUZISMFFQWBR-UHFFFAOYSA-N 0 0 302.462 5.018 20 0 DKADRN Cc1cccc(C(C)C)c1NC(=O)N1Cc2ccccc2C[C@@H]1C ZINC000174421877 332853767 /nfs/dbraw/zinc/85/37/67/332853767.db2.gz ZVWYXBCWTSKTCH-INIZCTEOSA-N 0 0 322.452 5.097 20 0 DKADRN Cc1cccc(C(C)C)c1NC(=O)N1Cc2ccccc2C[C@H]1C ZINC000174421891 332853833 /nfs/dbraw/zinc/85/38/33/332853833.db2.gz ZVWYXBCWTSKTCH-MRXNPFEDSA-N 0 0 322.452 5.097 20 0 DKADRN CCSCc1ccc(C(=O)Nc2c(C)cccc2Cl)cc1 ZINC000174422386 340387984 /nfs/dbraw/zinc/38/79/84/340387984.db2.gz RXFIFDAMVMTQOC-UHFFFAOYSA-N 0 0 319.857 5.154 20 0 DKADRN Cc1cccc(Cl)c1NC(=O)[C@@H]1C[C@@H]1c1ccccc1Cl ZINC000174423533 340388166 /nfs/dbraw/zinc/38/81/66/340388166.db2.gz LAMRUMOHIMXERW-CHWSQXEVSA-N 0 0 320.219 5.044 20 0 DKADRN Cc1cccc(Cl)c1NC(=O)[C@H]1C[C@@H]1c1ccccc1Cl ZINC000174423548 340388190 /nfs/dbraw/zinc/38/81/90/340388190.db2.gz LAMRUMOHIMXERW-OLZOCXBDSA-N 0 0 320.219 5.044 20 0 DKADRN Cc1cccc(Cl)c1NC(=O)[C@@H]1C[C@H]1c1ccccc1Cl ZINC000174423563 340388172 /nfs/dbraw/zinc/38/81/72/340388172.db2.gz LAMRUMOHIMXERW-QWHCGFSZSA-N 0 0 320.219 5.044 20 0 DKADRN Cc1cccc(Cl)c1NC(=O)[C@H]1C[C@H]1c1ccccc1Cl ZINC000174423576 340388174 /nfs/dbraw/zinc/38/81/74/340388174.db2.gz LAMRUMOHIMXERW-STQMWFEESA-N 0 0 320.219 5.044 20 0 DKADRN CC(C)(C)c1ccccc1NC(=O)N1CCC2(C1)CCCCC2 ZINC000174424602 332854012 /nfs/dbraw/zinc/85/40/12/332854012.db2.gz FCJPWZADHYKVFD-UHFFFAOYSA-N 0 0 314.473 5.172 20 0 DKADRN Cc1cccc(Cl)c1NC(=O)c1cc2cc(Cl)ccc2o1 ZINC000174426239 340388199 /nfs/dbraw/zinc/38/81/99/340388199.db2.gz XQWVCPWKQRYPBO-UHFFFAOYSA-N 0 0 320.175 5.300 20 0 DKADRN Cc1ccc([C@H]2CCCCN2C(=O)Nc2c(C)cccc2C)cc1 ZINC000174487564 332856526 /nfs/dbraw/zinc/85/65/26/332856526.db2.gz KWRSAEYRLHMPKN-LJQANCHMSA-N 0 0 322.452 5.371 20 0 DKADRN Cc1cccc([C@H]2CCCN2C(=O)Nc2c(C)cccc2C)c1C ZINC000174489704 332856488 /nfs/dbraw/zinc/85/64/88/332856488.db2.gz YWNNECQHOMMWQY-LJQANCHMSA-N 0 0 322.452 5.289 20 0 DKADRN C[C@H](N[C@@H](C)c1c(F)cccc1Cl)c1ncc(C(C)(C)C)o1 ZINC000175019927 525528530 /nfs/dbraw/zinc/52/85/30/525528530.db2.gz VBTXWRBCAZJKOY-QWRGUYRKSA-N 0 0 324.827 5.176 20 0 DKADRN C[C@@H](N[C@@H](C)c1ncc(C(C)(C)C)o1)c1c(F)cccc1Cl ZINC000175019938 525621770 /nfs/dbraw/zinc/62/17/70/525621770.db2.gz VBTXWRBCAZJKOY-MNOVXSKESA-N 0 0 324.827 5.176 20 0 DKADRN C[C@@H](N[C@H](C)c1c(F)cccc1Cl)c1ncc(C(C)(C)C)o1 ZINC000175019970 525658511 /nfs/dbraw/zinc/65/85/11/525658511.db2.gz VBTXWRBCAZJKOY-GHMZBOCLSA-N 0 0 324.827 5.176 20 0 DKADRN CC(C)c1cccc(C(C)C)c1NC(=O)N1CC[C@@H](C)[C@H]1C ZINC000175063668 340402229 /nfs/dbraw/zinc/40/22/29/340402229.db2.gz GLAWOZFKEFGSDB-HUUCEWRRSA-N 0 0 302.462 5.196 20 0 DKADRN CC(C)c1cccc(C(C)C)c1NC(=O)N1CC[C@H](C)[C@H]1C ZINC000175063686 340402181 /nfs/dbraw/zinc/40/21/81/340402181.db2.gz GLAWOZFKEFGSDB-LSDHHAIUSA-N 0 0 302.462 5.196 20 0 DKADRN CC(C)c1cccc(C(C)C)c1NC(=O)N1CC[C@@H](C)[C@@H]1C ZINC000175063706 340402231 /nfs/dbraw/zinc/40/22/31/340402231.db2.gz GLAWOZFKEFGSDB-CABCVRRESA-N 0 0 302.462 5.196 20 0 DKADRN CC(C)c1cccc(C(C)C)c1NC(=O)N1CC[C@H](C)[C@@H]1C ZINC000175063725 340402237 /nfs/dbraw/zinc/40/22/37/340402237.db2.gz GLAWOZFKEFGSDB-GJZGRUSLSA-N 0 0 302.462 5.196 20 0 DKADRN CC(C)c1ccccc1NC(=O)[C@@H](C)c1ccc(Cl)s1 ZINC000175304814 340408638 /nfs/dbraw/zinc/40/86/38/340408638.db2.gz MFUCLAACVUGOCQ-NSHDSACASA-N 0 0 307.846 5.267 20 0 DKADRN CCCCCN(C(=O)Nc1ccccc1COC)[C@@H](C)CCC ZINC000175618267 340415648 /nfs/dbraw/zinc/41/56/48/340415648.db2.gz WJBDIKMVKCZBGC-INIZCTEOSA-N 0 0 320.477 5.046 20 0 DKADRN CCCCCN(C(=O)Nc1ccccc1COC)[C@H](C)CCC ZINC000175618281 340415651 /nfs/dbraw/zinc/41/56/51/340415651.db2.gz WJBDIKMVKCZBGC-MRXNPFEDSA-N 0 0 320.477 5.046 20 0 DKADRN Cc1cccc(C(C)C)c1NC(=O)N(C1CC1)C1CCCC1 ZINC000175635953 341840429 /nfs/dbraw/zinc/84/04/29/341840429.db2.gz QJKFMFRNJNVZAL-UHFFFAOYSA-N 0 0 300.446 5.057 20 0 DKADRN Cc1cc(C)c(NC(=O)[C@H](C)c2ccc(Cl)s2)c(C)c1 ZINC000175728565 340418352 /nfs/dbraw/zinc/41/83/52/340418352.db2.gz LKRBTAWRRYZJLE-GFCCVEGCSA-N 0 0 307.846 5.069 20 0 DKADRN CC(C)c1cccc(C(C)C)c1NC(=O)N(C)[C@H](C)C1(C)CC1 ZINC000175863283 332911299 /nfs/dbraw/zinc/91/12/99/332911299.db2.gz GRAFEYSUGBFUQC-OAHLLOKOSA-N 0 0 316.489 5.586 20 0 DKADRN C[C@@H](C(=O)Nc1cccc(C(F)F)c1)c1ccc(Cl)s1 ZINC000176027729 340424687 /nfs/dbraw/zinc/42/46/87/340424687.db2.gz XVDZFTOYZADVJJ-MRVPVSSYSA-N 0 0 315.772 5.081 20 0 DKADRN Cc1cc(C)c(NC(=O)[C@@H](C)c2cc3ccccc3o2)c(C)c1 ZINC000176140579 340425432 /nfs/dbraw/zinc/42/54/32/340425432.db2.gz UYJXRBXADSCSPK-HNNXBMFYSA-N 0 0 307.393 5.100 20 0 DKADRN CCc1cccc(C)c1NC(=O)[C@H](C)c1cc2ccccc2o1 ZINC000176140728 340425459 /nfs/dbraw/zinc/42/54/59/340425459.db2.gz IKRMEHKACPVTOY-CQSZACIVSA-N 0 0 307.393 5.046 20 0 DKADRN CCc1cccc(C)c1NC(=O)c1ccc(Oc2ccccc2)o1 ZINC000176140747 340425419 /nfs/dbraw/zinc/42/54/19/340425419.db2.gz PLSWLTXOIMHAGY-UHFFFAOYSA-N 0 0 321.376 5.195 20 0 DKADRN CCc1cccc(CC)c1NC(=O)[C@@H](C)c1cc2ccccc2o1 ZINC000176142149 340425443 /nfs/dbraw/zinc/42/54/43/340425443.db2.gz NTMSERZFXWGQRK-AWEZNQCLSA-N 0 0 321.420 5.300 20 0 DKADRN CCc1cccc(CC)c1NC(=O)[C@H](C)c1cc2ccccc2o1 ZINC000176142165 340425439 /nfs/dbraw/zinc/42/54/39/340425439.db2.gz NTMSERZFXWGQRK-CQSZACIVSA-N 0 0 321.420 5.300 20 0 DKADRN C[C@@H](C(=O)Nc1cccc(C(F)F)c1)c1cc2ccccc2o1 ZINC000176246953 340425983 /nfs/dbraw/zinc/42/59/83/340425983.db2.gz JRVXDMKQRYXWNT-LLVKDONJSA-N 0 0 315.319 5.113 20 0 DKADRN Cc1cccc(NC(=O)c2c(Cl)cccc2Cl)c1Cl ZINC000176530057 341884206 /nfs/dbraw/zinc/88/42/06/341884206.db2.gz HMCCVMVXZQOSBY-UHFFFAOYSA-N 0 0 314.599 5.208 20 0 DKADRN Cc1cccc(C(C)C)c1NC(=O)[C@H](C)c1cc2ccccc2o1 ZINC000176564433 340428508 /nfs/dbraw/zinc/42/85/08/340428508.db2.gz CJQVXOSKXFXXDR-OAHLLOKOSA-N 0 0 321.420 5.607 20 0 DKADRN Cc1cccc(C(C)C)c1NC(=O)C1(Cc2ccccc2)CC1 ZINC000176818039 332956579 /nfs/dbraw/zinc/95/65/79/332956579.db2.gz OYDBCHSYZAGHRR-UHFFFAOYSA-N 0 0 307.437 5.080 20 0 DKADRN CO[C@@H](C)c1nc(CSc2ccc3ccccc3c2)cs1 ZINC000177156473 340436820 /nfs/dbraw/zinc/43/68/20/340436820.db2.gz KOYRIQLAFNAHFP-LBPRGKRZSA-N 0 0 315.463 5.296 20 0 DKADRN CO[C@H](C)c1nc(CSc2ccc3ccccc3c2)cs1 ZINC000177156488 340436829 /nfs/dbraw/zinc/43/68/29/340436829.db2.gz KOYRIQLAFNAHFP-GFCCVEGCSA-N 0 0 315.463 5.296 20 0 DKADRN C[C@@H](Sc1ccnc2ccccc21)c1ncc(C(C)(C)C)o1 ZINC000177288704 340438812 /nfs/dbraw/zinc/43/88/12/340438812.db2.gz IBEPWIRVVLXRJT-GFCCVEGCSA-N 0 0 312.438 5.374 20 0 DKADRN C[C@H](N[C@@H](C)c1ccccc1Cl)c1nc2c(s1)CCCC2 ZINC000177351350 341918985 /nfs/dbraw/zinc/91/89/85/341918985.db2.gz DKTOMUIBQDNWLR-RYUDHWBXSA-N 0 0 320.889 5.087 20 0 DKADRN C[C@@H](N[C@@H](C)c1ccccc1Cl)c1nc2c(s1)CCCC2 ZINC000177351375 341919032 /nfs/dbraw/zinc/91/90/32/341919032.db2.gz DKTOMUIBQDNWLR-NWDGAFQWSA-N 0 0 320.889 5.087 20 0 DKADRN CC(C)c1nc([C@@H](C)N[C@H](C)c2ccccc2Cl)cs1 ZINC000177354772 340439642 /nfs/dbraw/zinc/43/96/42/340439642.db2.gz XULNSZRWMZPUMT-VXGBXAGGSA-N 0 0 308.878 5.332 20 0 DKADRN CC(C)c1nc([C@H](C)N[C@H](C)c2ccccc2Cl)cs1 ZINC000177354785 340439625 /nfs/dbraw/zinc/43/96/25/340439625.db2.gz XULNSZRWMZPUMT-NEPJUHHUSA-N 0 0 308.878 5.332 20 0 DKADRN C[C@@H](N[C@@H](C)c1ncc(C(C)(C)C)o1)c1cccc2ccccc21 ZINC000177412505 341919731 /nfs/dbraw/zinc/91/97/31/341919731.db2.gz XMCMRBJHTHASSR-CABCVRRESA-N 0 0 322.452 5.537 20 0 DKADRN C[C@@H](N[C@@H](C)c1cccc2ccccc21)c1ncc(C(C)(C)C)o1 ZINC000177412523 341919815 /nfs/dbraw/zinc/91/98/15/341919815.db2.gz XMCMRBJHTHASSR-LSDHHAIUSA-N 0 0 322.452 5.537 20 0 DKADRN C[C@H](N[C@H](c1ccco1)c1ccccc1)c1ncc(C(C)(C)C)o1 ZINC000177416526 337155868 /nfs/dbraw/zinc/15/58/68/337155868.db2.gz PLIMEWYSRLUICK-KSSFIOAISA-N 0 0 324.424 5.005 20 0 DKADRN C[C@@H](N[C@H](c1ccco1)c1ccccc1)c1ncc(C(C)(C)C)o1 ZINC000177416542 337155918 /nfs/dbraw/zinc/15/59/18/337155918.db2.gz PLIMEWYSRLUICK-KDOFPFPSSA-N 0 0 324.424 5.005 20 0 DKADRN C[C@H](N[C@@H](c1ccco1)c1ccccc1)c1ncc(C(C)(C)C)o1 ZINC000177416556 337155896 /nfs/dbraw/zinc/15/58/96/337155896.db2.gz PLIMEWYSRLUICK-KBXCAEBGSA-N 0 0 324.424 5.005 20 0 DKADRN C[C@@H](N[C@@H](c1ccco1)c1ccccc1)c1ncc(C(C)(C)C)o1 ZINC000177416573 337155799 /nfs/dbraw/zinc/15/57/99/337155799.db2.gz PLIMEWYSRLUICK-RDTXWAMCSA-N 0 0 324.424 5.005 20 0 DKADRN CC(C)OCc1ccc(N[C@@H](C)c2ncc(C(C)(C)C)o2)cc1 ZINC000177437878 519775861 /nfs/dbraw/zinc/77/58/61/519775861.db2.gz RYZKPBOQOJOETQ-AWEZNQCLSA-N 0 0 316.445 5.070 20 0 DKADRN CC(C)OCc1ccc(N[C@H](C)c2ncc(C(C)(C)C)o2)cc1 ZINC000177437891 519775656 /nfs/dbraw/zinc/77/56/56/519775656.db2.gz RYZKPBOQOJOETQ-CQSZACIVSA-N 0 0 316.445 5.070 20 0 DKADRN CC(C)OCc1cccc(N[C@@H](C)c2ncc(C(C)(C)C)o2)c1 ZINC000177438464 340440281 /nfs/dbraw/zinc/44/02/81/340440281.db2.gz NJRAVMCOCHZCRD-AWEZNQCLSA-N 0 0 316.445 5.070 20 0 DKADRN Cc1cc(C)cc([C@@H](C)N[C@@H](C)c2ncc(C(C)(C)C)o2)c1 ZINC000177448119 341920019 /nfs/dbraw/zinc/92/00/19/341920019.db2.gz NXAMMSWDKAWDSU-CABCVRRESA-N 0 0 300.446 5.001 20 0 DKADRN Cc1cc(C)cc([C@H](C)N[C@@H](C)c2ncc(C(C)(C)C)o2)c1 ZINC000177448134 341920033 /nfs/dbraw/zinc/92/00/33/341920033.db2.gz NXAMMSWDKAWDSU-GJZGRUSLSA-N 0 0 300.446 5.001 20 0 DKADRN Cc1ccc(N[C@@H](C)c2ncc(C(C)(C)C)o2)cc1OC(F)F ZINC000177453081 340440593 /nfs/dbraw/zinc/44/05/93/340440593.db2.gz VYTVGRHRYFJJAR-NSHDSACASA-N 0 0 324.371 5.055 20 0 DKADRN Cc1ccc(N[C@H](C)c2ncc(C(C)(C)C)o2)cc1OC(F)F ZINC000177453102 340440592 /nfs/dbraw/zinc/44/05/92/340440592.db2.gz VYTVGRHRYFJJAR-LLVKDONJSA-N 0 0 324.371 5.055 20 0 DKADRN CO[C@@H](C)c1nc(CNc2ccccc2-c2ccccc2)cs1 ZINC000177493744 340441147 /nfs/dbraw/zinc/44/11/47/340441147.db2.gz PEPPSNPMAUQWHN-AWEZNQCLSA-N 0 0 324.449 5.130 20 0 DKADRN CO[C@@H](C)c1nc(CNc2ccc(-c3ccccc3)cc2)cs1 ZINC000177495527 340441034 /nfs/dbraw/zinc/44/10/34/340441034.db2.gz ZNQYMKPJTFFXER-AWEZNQCLSA-N 0 0 324.449 5.130 20 0 DKADRN CO[C@H](C)c1nc(CNc2ccc(-c3ccccc3)cc2)cs1 ZINC000177495540 340441033 /nfs/dbraw/zinc/44/10/33/340441033.db2.gz ZNQYMKPJTFFXER-CQSZACIVSA-N 0 0 324.449 5.130 20 0 DKADRN Cc1cc(C)c(NC(=O)N2CC[C@H](c3ccccc3)[C@@H]2C)c(C)c1 ZINC000177683904 332995593 /nfs/dbraw/zinc/99/55/93/332995593.db2.gz UADAZGKOJDSAFL-HKUYNNGSSA-N 0 0 322.452 5.022 20 0 DKADRN Cc1cc(C)c(NC(=O)N2CC[C@H](c3ccccc3)[C@H]2C)c(C)c1 ZINC000177683927 518186790 /nfs/dbraw/zinc/18/67/90/518186790.db2.gz UADAZGKOJDSAFL-MJGOQNOKSA-N 0 0 322.452 5.022 20 0 DKADRN Cc1cc(C)c(NC(=O)N2CC[C@@H](c3ccccc3)[C@H]2C)c(C)c1 ZINC000177683941 332995560 /nfs/dbraw/zinc/99/55/60/332995560.db2.gz UADAZGKOJDSAFL-IEBWSBKVSA-N 0 0 322.452 5.022 20 0 DKADRN CC(C)c1ccccc1NC(=O)N1CC[C@@H](c2ccccc2)[C@H]1C ZINC000177690325 340442772 /nfs/dbraw/zinc/44/27/72/340442772.db2.gz 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/nfs/dbraw/zinc/93/92/03/341939203.db2.gz IRRKKBPYGMXUDT-IERDGZPVSA-N 0 0 321.420 5.119 20 0 DKADRN C[C@@H](N[C@H](c1ccsc1)c1ccc(Cl)cc1)c1ccco1 ZINC000177917056 341939626 /nfs/dbraw/zinc/93/96/26/341939626.db2.gz LXMWHOYQSOCEPV-PXAZEXFGSA-N 0 0 317.841 5.435 20 0 DKADRN C[C@H](N[C@@H](c1ccsc1)c1ccc(Cl)cc1)c1ccco1 ZINC000177917072 341939725 /nfs/dbraw/zinc/93/97/25/341939725.db2.gz LXMWHOYQSOCEPV-YVEFUNNKSA-N 0 0 317.841 5.435 20 0 DKADRN C[C@@H](N[C@@H](c1ccsc1)c1ccc(Cl)cc1)c1ccco1 ZINC000177917085 341939589 /nfs/dbraw/zinc/93/95/89/341939589.db2.gz LXMWHOYQSOCEPV-SJKOYZFVSA-N 0 0 317.841 5.435 20 0 DKADRN C[C@H](N[C@H](c1ccsc1)c1ccc(Cl)cc1)c1ccoc1 ZINC000177917548 341939574 /nfs/dbraw/zinc/93/95/74/341939574.db2.gz ASRKUOHTOQIKFL-SJCJKPOMSA-N 0 0 317.841 5.435 20 0 DKADRN C[C@H](N[C@@H](c1ccsc1)c1ccc(Cl)cc1)c1ccoc1 ZINC000177917569 341939629 /nfs/dbraw/zinc/93/96/29/341939629.db2.gz ASRKUOHTOQIKFL-YVEFUNNKSA-N 0 0 317.841 5.435 20 0 DKADRN C[C@@H](N[C@@H](c1ccsc1)c1ccc(Cl)cc1)c1ccoc1 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312.438 5.034 20 0 DKADRN CC[C@@H]1C[C@H](C(=O)Nc2c(C(C)C)cccc2C(C)C)CCO1 ZINC000182230410 523561703 /nfs/dbraw/zinc/56/17/03/523561703.db2.gz YGIUCRHWDPYKJE-HZPDHXFCSA-N 0 0 317.473 5.077 20 0 DKADRN CC[C@H]1C[C@H](C(=O)Nc2c(C(C)C)cccc2C(C)C)CCO1 ZINC000182230428 523392524 /nfs/dbraw/zinc/39/25/24/523392524.db2.gz YGIUCRHWDPYKJE-CVEARBPZSA-N 0 0 317.473 5.077 20 0 DKADRN CC[C@@H]1C[C@@H](C(=O)Nc2c(C(C)C)cccc2C(C)C)CCO1 ZINC000182230449 523530780 /nfs/dbraw/zinc/53/07/80/523530780.db2.gz YGIUCRHWDPYKJE-JKSUJKDBSA-N 0 0 317.473 5.077 20 0 DKADRN CC[C@H]1C[C@@H](C(=O)Nc2c(C(C)C)cccc2C(C)C)CCO1 ZINC000182230468 523365760 /nfs/dbraw/zinc/36/57/60/523365760.db2.gz YGIUCRHWDPYKJE-HOTGVXAUSA-N 0 0 317.473 5.077 20 0 DKADRN C[C@H](Nc1ccc2oc(C3CC3)nc2c1)c1nc2ccccc2o1 ZINC000182427332 525664766 /nfs/dbraw/zinc/66/47/66/525664766.db2.gz NQFFOKFRXZGZDD-NSHDSACASA-N 0 0 319.364 5.020 20 0 DKADRN C[C@@H](Nc1ccc2oc(C3CC3)nc2c1)c1nc2ccccc2o1 ZINC000182427348 525715759 /nfs/dbraw/zinc/71/57/59/525715759.db2.gz NQFFOKFRXZGZDD-LLVKDONJSA-N 0 0 319.364 5.020 20 0 DKADRN CC(C)Oc1cccc([C@@H](C)N[C@@H](C)c2nc3ccccc3o2)c1 ZINC000182429539 519783521 /nfs/dbraw/zinc/78/35/21/519783521.db2.gz VJKRPASAOTZLPV-CABCVRRESA-N 0 0 324.424 5.027 20 0 DKADRN CC(C)Oc1cccc([C@H](C)N[C@@H](C)c2nc3ccccc3o2)c1 ZINC000182429559 519783633 /nfs/dbraw/zinc/78/36/33/519783633.db2.gz VJKRPASAOTZLPV-GJZGRUSLSA-N 0 0 324.424 5.027 20 0 DKADRN CC(C)Oc1cccc([C@@H](C)N[C@H](C)c2nc3ccccc3o2)c1 ZINC000182429574 519783574 /nfs/dbraw/zinc/78/35/74/519783574.db2.gz VJKRPASAOTZLPV-HUUCEWRRSA-N 0 0 324.424 5.027 20 0 DKADRN CC(C)Oc1cccc([C@H](C)N[C@H](C)c2nc3ccccc3o2)c1 ZINC000182429593 519783703 /nfs/dbraw/zinc/78/37/03/519783703.db2.gz VJKRPASAOTZLPV-LSDHHAIUSA-N 0 0 324.424 5.027 20 0 DKADRN CC(C)Oc1ccc([C@@H](C)N[C@@H](C)c2nc3ccccc3o2)cc1 ZINC000182430592 519781638 /nfs/dbraw/zinc/78/16/38/519781638.db2.gz DRKRFGQKSWNCJP-CABCVRRESA-N 0 0 324.424 5.027 20 0 DKADRN CC(C)Oc1ccc([C@H](C)N[C@@H](C)c2nc3ccccc3o2)cc1 ZINC000182430611 519781891 /nfs/dbraw/zinc/78/18/91/519781891.db2.gz DRKRFGQKSWNCJP-GJZGRUSLSA-N 0 0 324.424 5.027 20 0 DKADRN CC(C)Oc1ccc([C@@H](C)N[C@H](C)c2nc3ccccc3o2)cc1 ZINC000182430630 519781636 /nfs/dbraw/zinc/78/16/36/519781636.db2.gz DRKRFGQKSWNCJP-HUUCEWRRSA-N 0 0 324.424 5.027 20 0 DKADRN CC(C)Oc1ccc([C@H](C)N[C@H](C)c2nc3ccccc3o2)cc1 ZINC000182430650 519781982 /nfs/dbraw/zinc/78/19/82/519781982.db2.gz DRKRFGQKSWNCJP-LSDHHAIUSA-N 0 0 324.424 5.027 20 0 DKADRN CCc1cc(N[C@@H](C)c2nnc(-c3ccc(C)cc3)o2)ccc1C ZINC000182479638 335067671 /nfs/dbraw/zinc/06/76/71/335067671.db2.gz RLIODVVQPPKYIO-HNNXBMFYSA-N 0 0 321.424 5.089 20 0 DKADRN CCc1cc(N[C@H](C)c2nnc(-c3ccc(C)cc3)o2)ccc1C ZINC000182479656 335067832 /nfs/dbraw/zinc/06/78/32/335067832.db2.gz RLIODVVQPPKYIO-OAHLLOKOSA-N 0 0 321.424 5.089 20 0 DKADRN CCCCc1nc(CN[C@@H](C)c2cc3ccccc3o2)cs1 ZINC000182625074 336276574 /nfs/dbraw/zinc/27/65/74/336276574.db2.gz QEXDSXOEXLWWPU-ZDUSSCGKSA-N 0 0 314.454 5.083 20 0 DKADRN CCCCc1nc(CN[C@H](C)c2cc3ccccc3o2)cs1 ZINC000182625094 333043602 /nfs/dbraw/zinc/04/36/02/333043602.db2.gz QEXDSXOEXLWWPU-CYBMUJFWSA-N 0 0 314.454 5.083 20 0 DKADRN C[C@H](NCc1ncc(-c2cccs2)o1)c1cc2ccccc2o1 ZINC000182638777 336277590 /nfs/dbraw/zinc/27/75/90/336277590.db2.gz HBHJICCVHMMLFC-LBPRGKRZSA-N 0 0 324.405 5.000 20 0 DKADRN C[C@@H](NCc1ncc(-c2cccs2)o1)c1cc2ccccc2o1 ZINC000182638801 333043607 /nfs/dbraw/zinc/04/36/07/333043607.db2.gz HBHJICCVHMMLFC-GFCCVEGCSA-N 0 0 324.405 5.000 20 0 DKADRN CC[C@H](NC1c2ccccc2-c2ccccc21)c1nc(C)cs1 ZINC000182639076 336277583 /nfs/dbraw/zinc/27/75/83/336277583.db2.gz KJVQQZKLVXCMCN-SFHVURJKSA-N 0 0 320.461 5.262 20 0 DKADRN C[C@H](N[C@@H](C)c1ncc(C(C)(C)C)o1)c1cc2ccccc2o1 ZINC000182639079 525537052 /nfs/dbraw/zinc/53/70/52/525537052.db2.gz PARWNQWCRVWWSI-STQMWFEESA-N 0 0 312.413 5.130 20 0 DKADRN CC[C@@H](NC1c2ccccc2-c2ccccc21)c1nc(C)cs1 ZINC000182639093 336277611 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CC(=O)Nc1cccc(N[C@@H](C)c2cccc(Cl)c2Cl)c1 ZINC000182717570 333045467 /nfs/dbraw/zinc/04/54/67/333045467.db2.gz ZFZKRKPNUFPXLQ-JTQLQIEISA-N 0 0 323.223 5.125 20 0 DKADRN CC(=O)Nc1cccc(N[C@H](C)c2cccc(Cl)c2Cl)c1 ZINC000182717590 333045613 /nfs/dbraw/zinc/04/56/13/333045613.db2.gz ZFZKRKPNUFPXLQ-SNVBAGLBSA-N 0 0 323.223 5.125 20 0 DKADRN C[C@H](Nc1cccc(COC2CCCCC2)c1)c1nccs1 ZINC000182777134 525668706 /nfs/dbraw/zinc/66/87/06/525668706.db2.gz BIPCRAHNWLCDSI-AWEZNQCLSA-N 0 0 316.470 5.166 20 0 DKADRN C[C@@H](Nc1cccc(COC2CCCCC2)c1)c1nccs1 ZINC000182777158 525717715 /nfs/dbraw/zinc/71/77/15/525717715.db2.gz BIPCRAHNWLCDSI-CQSZACIVSA-N 0 0 316.470 5.166 20 0 DKADRN Cc1cccc(F)c1NC(=O)N(C)[C@H](C)c1ccccc1Cl ZINC000182785283 331575821 /nfs/dbraw/zinc/57/58/21/331575821.db2.gz OLSTUCFPWBQCAW-GFCCVEGCSA-N 0 0 320.795 5.012 20 0 DKADRN Cc1cccc(C)c1NC(=O)CC1CCC(C(F)(F)F)CC1 ZINC000182926568 333181360 /nfs/dbraw/zinc/18/13/60/333181360.db2.gz MRBUUXJSDOPNDK-UHFFFAOYSA-N 0 0 313.363 5.001 20 0 DKADRN 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316.495 5.332 20 0 DKADRN CCc1nc([C@@H](C)N[C@H](C)c2cc3ccccc3s2)cs1 ZINC000188000275 334607484 /nfs/dbraw/zinc/60/74/84/334607484.db2.gz COQKSWHXZQCUQY-VXGBXAGGSA-N 0 0 316.495 5.332 20 0 DKADRN C[C@H](Sc1nnc(C(F)(F)F)s1)c1cccc(Cl)c1 ZINC000188151325 334662035 /nfs/dbraw/zinc/66/20/35/334662035.db2.gz LXIKOVWUNZYCNO-LURJTMIESA-N 0 0 324.780 5.064 20 0 DKADRN CC(C)Oc1ccc(NC(=O)c2ccccc2Cl)c(Cl)c1 ZINC000188292704 333362647 /nfs/dbraw/zinc/36/26/47/333362647.db2.gz WOWOFQFMOQCKCJ-UHFFFAOYSA-N 0 0 324.207 5.033 20 0 DKADRN Cc1coc(S[C@@H](C)c2ncc(-c3ccc(Cl)cc3)o2)n1 ZINC000188383726 333364921 /nfs/dbraw/zinc/36/49/21/333364921.db2.gz PWZBLDINDDLVGY-JTQLQIEISA-N 0 0 320.801 5.145 20 0 DKADRN Cc1coc(S[C@H](C)c2ncc(-c3ccc(Cl)cc3)o2)n1 ZINC000188383747 333364999 /nfs/dbraw/zinc/36/49/99/333364999.db2.gz PWZBLDINDDLVGY-SNVBAGLBSA-N 0 0 320.801 5.145 20 0 DKADRN Cc1ncc(-c2ccc(N[C@@H]3CCC[C@H](C(F)(F)F)C3)cc2)o1 ZINC000188394799 334704534 /nfs/dbraw/zinc/70/45/34/334704534.db2.gz RVVAWFAZTOQHPK-DZGCQCFKSA-N 0 0 324.346 5.183 20 0 DKADRN Cc1ncc(-c2ccc(N[C@H]3CCC[C@H](C(F)(F)F)C3)cc2)o1 ZINC000188394821 334704528 /nfs/dbraw/zinc/70/45/28/334704528.db2.gz RVVAWFAZTOQHPK-ZFWWWQNUSA-N 0 0 324.346 5.183 20 0 DKADRN Cc1ncc(-c2ccc(N[C@@H]3CCC[C@@H](C(F)(F)F)C3)cc2)o1 ZINC000188394845 334704542 /nfs/dbraw/zinc/70/45/42/334704542.db2.gz RVVAWFAZTOQHPK-UKRRQHHQSA-N 0 0 324.346 5.183 20 0 DKADRN CC[C@@H](C)Sc1ccc(N[C@@H](C)c2nccnc2C)c(C)c1 ZINC000188408396 334707718 /nfs/dbraw/zinc/70/77/18/334707718.db2.gz MQYUEPOLQOLAJS-HIFRSBDPSA-N 0 0 315.486 5.157 20 0 DKADRN CC[C@H](C)Sc1ccc(N[C@@H](C)c2nccnc2C)c(C)c1 ZINC000188408421 334707769 /nfs/dbraw/zinc/70/77/69/334707769.db2.gz MQYUEPOLQOLAJS-ZFWWWQNUSA-N 0 0 315.486 5.157 20 0 DKADRN CC[C@@H](C)Sc1ccc(N[C@H](C)c2nccnc2C)c(C)c1 ZINC000188408440 334707794 /nfs/dbraw/zinc/70/77/94/334707794.db2.gz MQYUEPOLQOLAJS-UKRRQHHQSA-N 0 0 315.486 5.157 20 0 DKADRN Cc1ccc2cc(CNc3ccc(COC(C)C)cc3)ccc2n1 ZINC000189280828 334889622 /nfs/dbraw/zinc/88/96/22/334889622.db2.gz FQPQQBZRQCHBDU-UHFFFAOYSA-N 0 0 320.436 5.080 20 0 DKADRN Cc1ccccc1[C@@H]1CCCN1C(=O)Nc1ccsc1Cl ZINC000189301397 525380357 /nfs/dbraw/zinc/38/03/57/525380357.db2.gz MKEIDVPQESEXKF-AWEZNQCLSA-N 0 0 320.845 5.079 20 0 DKADRN Cc1ccccc1[C@H]1CCCN1C(=O)Nc1ccsc1Cl ZINC000189301415 525435049 /nfs/dbraw/zinc/43/50/49/525435049.db2.gz MKEIDVPQESEXKF-CQSZACIVSA-N 0 0 320.845 5.079 20 0 DKADRN Cc1ccc([C@@H]2CCCCN2C(=O)Nc2ccsc2Cl)o1 ZINC000189316768 525800953 /nfs/dbraw/zinc/80/09/53/525800953.db2.gz KHLVXGBYKPZBAP-LBPRGKRZSA-N 0 0 324.833 5.062 20 0 DKADRN Cc1ccc([C@H]2CCCCN2C(=O)Nc2ccsc2Cl)o1 ZINC000189316788 525994035 /nfs/dbraw/zinc/99/40/35/525994035.db2.gz KHLVXGBYKPZBAP-GFCCVEGCSA-N 0 0 324.833 5.062 20 0 DKADRN O=C(Nc1ccsc1Cl)N1CCCCC[C@H]1c1ccco1 ZINC000189361918 527471681 /nfs/dbraw/zinc/47/16/81/527471681.db2.gz LQFWIVUJBFIBJC-LBPRGKRZSA-N 0 0 324.833 5.144 20 0 DKADRN O=C(Nc1ccsc1Cl)N1CCCCC[C@@H]1c1ccco1 ZINC000189361942 527470727 /nfs/dbraw/zinc/47/07/27/527470727.db2.gz LQFWIVUJBFIBJC-GFCCVEGCSA-N 0 0 324.833 5.144 20 0 DKADRN CC(C)[C@@H](c1ccccc1)N(C)C(=O)Nc1ccsc1Cl ZINC000189364437 334893152 /nfs/dbraw/zinc/89/31/52/334893152.db2.gz PFTHGGNBPRMKHJ-AWEZNQCLSA-N 0 0 322.861 5.263 20 0 DKADRN CC(C)[C@H](c1ccccc1)N(C)C(=O)Nc1ccsc1Cl ZINC000189364461 334893179 /nfs/dbraw/zinc/89/31/79/334893179.db2.gz PFTHGGNBPRMKHJ-CQSZACIVSA-N 0 0 322.861 5.263 20 0 DKADRN Cc1ccc(-c2c[nH]cc2C(=O)Nc2ccsc2Cl)s1 ZINC000189502833 334898089 /nfs/dbraw/zinc/89/80/89/334898089.db2.gz PPHNVYICFPSDME-UHFFFAOYSA-N 0 0 322.842 5.019 20 0 DKADRN Cc1ccc(C)c(NC(=O)Nc2cc(C(C)C)c(O)cc2C)c1 ZINC000189639354 337280986 /nfs/dbraw/zinc/28/09/86/337280986.db2.gz OZDVCOAAFICFRB-UHFFFAOYSA-N 0 0 312.413 5.085 20 0 DKADRN Cc1cccc(C)c1NC(=O)Nc1cc(C(C)C)c(O)cc1C ZINC000189668550 524292804 /nfs/dbraw/zinc/29/28/04/524292804.db2.gz ISSFRFNHQXUOKL-UHFFFAOYSA-N 0 0 312.413 5.085 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)N1CCC(C)CC1 ZINC000189957520 340541347 /nfs/dbraw/zinc/54/13/47/340541347.db2.gz SUEJNJGDRFUTNZ-UHFFFAOYSA-N 0 0 302.462 5.026 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)N(CC)CC1CC1 ZINC000189971075 340541573 /nfs/dbraw/zinc/54/15/73/340541573.db2.gz YJVYCXXINFKEOQ-UHFFFAOYSA-N 0 0 302.462 5.026 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)N1CCCC1(C)C ZINC000189971622 340541517 /nfs/dbraw/zinc/54/15/17/340541517.db2.gz OVQXMNQTPGTYNQ-UHFFFAOYSA-N 0 0 302.462 5.169 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)N1CCCC[C@H]1C ZINC000189973441 340541497 /nfs/dbraw/zinc/54/14/97/340541497.db2.gz ASJSTHOJPHVLRO-OAHLLOKOSA-N 0 0 302.462 5.169 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)N1CCCC2(CC2)C1 ZINC000189980148 340541624 /nfs/dbraw/zinc/54/16/24/340541624.db2.gz WPUVBWLKHGJYKL-UHFFFAOYSA-N 0 0 314.473 5.170 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)N1[C@H](C)CC[C@H]1C ZINC000189981734 340541620 /nfs/dbraw/zinc/54/16/20/340541620.db2.gz UNXHTBALTUROAU-HUUCEWRRSA-N 0 0 302.462 5.167 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)N1CCC2(CCC2)C1 ZINC000189981761 340541632 /nfs/dbraw/zinc/54/16/32/340541632.db2.gz YIFFGJLOIUUMJE-UHFFFAOYSA-N 0 0 314.473 5.170 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)N1CCC[C@@H](C)C1 ZINC000189983428 340541625 /nfs/dbraw/zinc/54/16/25/340541625.db2.gz DJQBEFMZQNJTCQ-OAHLLOKOSA-N 0 0 302.462 5.026 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)N(C)C1CCCC1 ZINC000189986381 340541685 /nfs/dbraw/zinc/54/16/85/340541685.db2.gz QVFLSEDRTZODNR-UHFFFAOYSA-N 0 0 302.462 5.169 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)N1CC[C@@H](C)[C@@H]1C ZINC000189988390 340541614 /nfs/dbraw/zinc/54/16/14/340541614.db2.gz AVRFHSUMCSNZAY-CABCVRRESA-N 0 0 302.462 5.025 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)N1C[C@@H]2CCC[C@@H]2C1 ZINC000189988649 340541623 /nfs/dbraw/zinc/54/16/23/340541623.db2.gz KKEDXQYHJKMAAL-CALCHBBNSA-N 0 0 314.473 5.026 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)N1C[C@H]2CCC[C@@H]2C1 ZINC000189988671 340541784 /nfs/dbraw/zinc/54/17/84/340541784.db2.gz KKEDXQYHJKMAAL-IAGOWNOFSA-N 0 0 314.473 5.026 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)N1C[C@@H]2CCC[C@H]2C1 ZINC000189988691 340541780 /nfs/dbraw/zinc/54/17/80/340541780.db2.gz KKEDXQYHJKMAAL-IRXDYDNUSA-N 0 0 314.473 5.026 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)Nc1ccc(O)cc1 ZINC000189990435 340541791 /nfs/dbraw/zinc/54/17/91/340541791.db2.gz HLRRKKXPYMWZQH-UHFFFAOYSA-N 0 0 312.413 5.112 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)N(C)Cc1ccco1 ZINC000189997649 521422168 /nfs/dbraw/zinc/42/21/68/521422168.db2.gz KZTDRXYNRDUHSI-UHFFFAOYSA-N 0 0 314.429 5.019 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)N1Cc2ccccc2C1 ZINC000189999726 521422651 /nfs/dbraw/zinc/42/26/51/521422651.db2.gz LWRPGZHMZQHOEI-UHFFFAOYSA-N 0 0 322.452 5.310 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)N(C)[C@@H](C)C1(C)CC1 ZINC000190001293 340541800 /nfs/dbraw/zinc/54/18/00/340541800.db2.gz XQPGPHOIKPUJQL-HNNXBMFYSA-N 0 0 316.489 5.415 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)N(C)[C@H](C)C1(C)CC1 ZINC000190001312 340541833 /nfs/dbraw/zinc/54/18/33/340541833.db2.gz XQPGPHOIKPUJQL-OAHLLOKOSA-N 0 0 316.489 5.415 20 0 DKADRN Cc1cc(O)c(C(C)C)cc1NC(=O)Nc1ccsc1Cl ZINC000190347613 334928526 /nfs/dbraw/zinc/92/85/26/334928526.db2.gz UOFAPGQPKOEWRL-UHFFFAOYSA-N 0 0 324.833 5.183 20 0 DKADRN CCC(CC)(CC)[S@@](=O)Cc1csc(C2CCCC2)n1 ZINC000190568929 334949905 /nfs/dbraw/zinc/94/99/05/334949905.db2.gz VXKMVBIDCAOJDS-FQEVSTJZSA-N 0 0 313.532 5.018 20 0 DKADRN CC(C)c1nnc(CNc2c(C(C)C)cccc2C(C)C)o1 ZINC000190838573 337290239 /nfs/dbraw/zinc/29/02/39/337290239.db2.gz FOWOYPTTYKKZGM-UHFFFAOYSA-N 0 0 301.434 5.052 20 0 DKADRN Cc1cc(O)c(C(C)C)cc1NC(=O)Nc1ccccc1Cl ZINC000191008849 335409769 /nfs/dbraw/zinc/40/97/69/335409769.db2.gz IWDHFFDUKMTVTA-UHFFFAOYSA-N 0 0 318.804 5.121 20 0 DKADRN Cc1ccc(NC(=O)Nc2cc(C(C)C)c(O)cc2C)c(C)c1 ZINC000191009496 334968643 /nfs/dbraw/zinc/96/86/43/334968643.db2.gz JCMJWKMHGLGDJT-UHFFFAOYSA-N 0 0 312.413 5.085 20 0 DKADRN Cc1cc(NC(=O)Nc2ccccc2C(C)C)c(C)c(C)c1O ZINC000191015989 335420118 /nfs/dbraw/zinc/42/01/18/335420118.db2.gz VZVMCCZZQOJTHS-UHFFFAOYSA-N 0 0 312.413 5.085 20 0 DKADRN C[C@H](N[C@@H](C)c1ccc(F)cc1F)c1csc(Cl)c1 ZINC000191113825 335597131 /nfs/dbraw/zinc/59/71/31/335597131.db2.gz DAGCHNYWRGJBTL-IUCAKERBSA-N 0 0 301.789 5.092 20 0 DKADRN C[C@@H](N[C@@H](C)c1ccc(F)cc1F)c1csc(Cl)c1 ZINC000191113854 335597154 /nfs/dbraw/zinc/59/71/54/335597154.db2.gz DAGCHNYWRGJBTL-BDAKNGLRSA-N 0 0 301.789 5.092 20 0 DKADRN CCC[C@H](NCc1coc(-c2cccs2)n1)c1ccsc1 ZINC000191222283 521165756 /nfs/dbraw/zinc/16/57/56/521165756.db2.gz KNWPGNPOSYDTQV-AWEZNQCLSA-N 0 0 318.467 5.096 20 0 DKADRN CCC[C@@H](NCc1coc(-c2cccs2)n1)c1ccsc1 ZINC000191222306 520782200 /nfs/dbraw/zinc/78/22/00/520782200.db2.gz KNWPGNPOSYDTQV-CQSZACIVSA-N 0 0 318.467 5.096 20 0 DKADRN C[C@@H](NCc1nc(C(C)(C)C)cs1)c1csc(Cl)c1 ZINC000191270415 340551988 /nfs/dbraw/zinc/55/19/88/340551988.db2.gz APFDILSLBUUJBJ-SECBINFHSA-N 0 0 314.907 5.006 20 0 DKADRN CCC(CC)c1cc(CN[C@@H](C)c2csc(Cl)c2)on1 ZINC000191311262 340552710 /nfs/dbraw/zinc/55/27/10/340552710.db2.gz FDRWATJRFQSZLT-JTQLQIEISA-N 0 0 312.866 5.144 20 0 DKADRN CCC(CC)c1cc(CN[C@H](C)c2csc(Cl)c2)on1 ZINC000191311275 340552583 /nfs/dbraw/zinc/55/25/83/340552583.db2.gz FDRWATJRFQSZLT-SNVBAGLBSA-N 0 0 312.866 5.144 20 0 DKADRN C[C@@H](N[C@@H](C)c1csc(Cl)c1)c1cccc(F)c1F ZINC000191404226 340553922 /nfs/dbraw/zinc/55/39/22/340553922.db2.gz XKVUCMYRBDIVII-DTWKUNHWSA-N 0 0 301.789 5.092 20 0 DKADRN C[C@@H](N[C@@H](C)c1cccc(F)c1F)c1csc(Cl)c1 ZINC000191404239 340553844 /nfs/dbraw/zinc/55/38/44/340553844.db2.gz XKVUCMYRBDIVII-BDAKNGLRSA-N 0 0 301.789 5.092 20 0 DKADRN C[C@@H](N[C@H](C)c1cccc(F)c1F)c1csc(Cl)c1 ZINC000191404253 340553854 /nfs/dbraw/zinc/55/38/54/340553854.db2.gz XKVUCMYRBDIVII-RKDXNWHRSA-N 0 0 301.789 5.092 20 0 DKADRN CC(C)C(=O)Nc1cccc(N[C@@H](C)c2csc(Cl)c2)c1 ZINC000191422407 335743229 /nfs/dbraw/zinc/74/32/29/335743229.db2.gz XRLMXKIEMUMZCZ-NSHDSACASA-N 0 0 322.861 5.169 20 0 DKADRN CC(C)C(=O)Nc1cccc(N[C@H](C)c2csc(Cl)c2)c1 ZINC000191422420 335743280 /nfs/dbraw/zinc/74/32/80/335743280.db2.gz XRLMXKIEMUMZCZ-LLVKDONJSA-N 0 0 322.861 5.169 20 0 DKADRN CCSc1cccc(N[C@@H](C)c2cnn(C(C)C)c2C)c1 ZINC000191478939 340554586 /nfs/dbraw/zinc/55/45/86/340554586.db2.gz HFXUIYVLQQKMPR-ZDUSSCGKSA-N 0 0 303.475 5.058 20 0 DKADRN Cc1ccc(N[C@@H](C)c2csc(Cl)c2)cc1-c1ncco1 ZINC000191480581 340554595 /nfs/dbraw/zinc/55/45/95/340554595.db2.gz DEQFUYXXQRSHRJ-NSHDSACASA-N 0 0 318.829 5.538 20 0 DKADRN Cc1ccc(N[C@H](C)c2csc(Cl)c2)cc1-c1ncco1 ZINC000191480594 340554498 /nfs/dbraw/zinc/55/44/98/340554498.db2.gz DEQFUYXXQRSHRJ-LLVKDONJSA-N 0 0 318.829 5.538 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)CSC(C)(C)C ZINC000191525926 521421993 /nfs/dbraw/zinc/42/19/93/521421993.db2.gz CDOFHLDIPZTQJL-UHFFFAOYSA-N 0 0 307.503 5.233 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)c1ccc(C)nc1C ZINC000191527576 337298790 /nfs/dbraw/zinc/29/87/90/337298790.db2.gz CCNZLGPZMMGOPY-UHFFFAOYSA-N 0 0 310.441 5.027 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)Cc1ccc(C)s1 ZINC000191527719 340555287 /nfs/dbraw/zinc/55/52/87/340555287.db2.gz QVVVDPTTXHSLQY-UHFFFAOYSA-N 0 0 315.482 5.314 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)[C@@H](C)OCCC(C)C ZINC000191527960 340555272 /nfs/dbraw/zinc/55/52/72/340555272.db2.gz VVJQVSZTZGBJJY-MRXNPFEDSA-N 0 0 319.489 5.152 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)[C@H](C)OCCC(C)C ZINC000191527973 340555257 /nfs/dbraw/zinc/55/52/57/340555257.db2.gz VVJQVSZTZGBJJY-INIZCTEOSA-N 0 0 319.489 5.152 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)c1ccc(SC)o1 ZINC000191528533 521425433 /nfs/dbraw/zinc/42/54/33/521425433.db2.gz GPEOHTUQPAHTHH-UHFFFAOYSA-N 0 0 317.454 5.330 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)c1ccc(F)cc1C ZINC000191530063 340555234 /nfs/dbraw/zinc/55/52/34/340555234.db2.gz DSGNWZQVOAEBPE-UHFFFAOYSA-N 0 0 313.416 5.462 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)C1CCC(F)(F)CC1 ZINC000191530377 521420581 /nfs/dbraw/zinc/42/05/81/521420581.db2.gz ONQGVBGWWOUGEQ-UHFFFAOYSA-N 0 0 323.427 5.527 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)c1ccc(Cl)nc1 ZINC000191531427 521424490 /nfs/dbraw/zinc/42/44/90/521424490.db2.gz XBFNSCQGMRHJIY-UHFFFAOYSA-N 0 0 316.832 5.063 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)c1cc(C)ccc1F ZINC000191534154 340555336 /nfs/dbraw/zinc/55/53/36/340555336.db2.gz RVVUYVVMKSWSBN-UHFFFAOYSA-N 0 0 313.416 5.462 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)c1ccc(Cl)o1 ZINC000191537027 521425184 /nfs/dbraw/zinc/42/51/84/521425184.db2.gz YWRGFHNSXOQZGT-UHFFFAOYSA-N 0 0 305.805 5.261 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)c1ccc(CC)nc1C ZINC000191540712 340555273 /nfs/dbraw/zinc/55/52/73/340555273.db2.gz IPVHPUOPSHWXRF-UHFFFAOYSA-N 0 0 324.468 5.281 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)c1cccc(OC)c1 ZINC000191541397 340555406 /nfs/dbraw/zinc/55/54/06/340555406.db2.gz IRVVPVXZHHDWMQ-UHFFFAOYSA-N 0 0 311.425 5.023 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)c1coc2ccccc12 ZINC000191543826 340555481 /nfs/dbraw/zinc/55/54/81/340555481.db2.gz DVSRJDDHXZVVCR-UHFFFAOYSA-N 0 0 321.420 5.761 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)CC[C@@H]1CC[C@H](C)O1 ZINC000191544130 521421750 /nfs/dbraw/zinc/42/17/50/521421750.db2.gz SROVVISGOCNZHO-RDJZCZTQSA-N 0 0 317.473 5.049 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)CC[C@H]1CC[C@H](C)O1 ZINC000191544148 521421844 /nfs/dbraw/zinc/42/18/44/521421844.db2.gz SROVVISGOCNZHO-DOTOQJQBSA-N 0 0 317.473 5.049 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)CC[C@@H]1CC[C@@H](C)O1 ZINC000191544161 521421105 /nfs/dbraw/zinc/42/11/05/521421105.db2.gz SROVVISGOCNZHO-WBVHZDCISA-N 0 0 317.473 5.049 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)CC[C@H]1CC[C@@H](C)O1 ZINC000191544175 521420560 /nfs/dbraw/zinc/42/05/60/521420560.db2.gz SROVVISGOCNZHO-NVXWUHKLSA-N 0 0 317.473 5.049 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)c1sc(C)nc1C ZINC000191545525 337298926 /nfs/dbraw/zinc/29/89/26/337298926.db2.gz IZZBEWUNUVLUJZ-UHFFFAOYSA-N 0 0 316.470 5.088 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)Cc1ccc(F)cc1 ZINC000191545916 340555473 /nfs/dbraw/zinc/55/54/73/340555473.db2.gz PUZNAVOJPKLVMH-UHFFFAOYSA-N 0 0 313.416 5.083 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)Cc1ccccc1F ZINC000191546001 340555394 /nfs/dbraw/zinc/55/53/94/340555394.db2.gz SZCPMWPPCFSNEO-UHFFFAOYSA-N 0 0 313.416 5.083 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)c1cc(Cl)ccn1 ZINC000191546628 340555413 /nfs/dbraw/zinc/55/54/13/340555413.db2.gz XSQQBXQRDIJTSC-UHFFFAOYSA-N 0 0 316.832 5.063 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)CCCCSC ZINC000191548520 521422141 /nfs/dbraw/zinc/42/21/41/521422141.db2.gz PEUJLRCHCSTWRV-UHFFFAOYSA-N 0 0 307.503 5.234 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)c1cscc1C ZINC000191548965 521426725 /nfs/dbraw/zinc/42/67/25/521426725.db2.gz CCHZXSCSBVMJPA-UHFFFAOYSA-N 0 0 301.455 5.385 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)/C=C/c1cncc(C)c1 ZINC000191549383 521420167 /nfs/dbraw/zinc/42/01/67/521420167.db2.gz QIGOOYZXPDYIKT-ZHACJKMWSA-N 0 0 322.452 5.118 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)c1ccc(OC)cc1 ZINC000191551493 340555415 /nfs/dbraw/zinc/55/54/15/340555415.db2.gz CMRDPFKQFWGBDR-UHFFFAOYSA-N 0 0 311.425 5.023 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)Cc1ccccc1C ZINC000191551580 340555420 /nfs/dbraw/zinc/55/54/20/340555420.db2.gz GZGKLXXEOMFWSJ-UHFFFAOYSA-N 0 0 309.453 5.252 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)c1cc(F)ccc1F ZINC000191551877 340555432 /nfs/dbraw/zinc/55/54/32/340555432.db2.gz GQMAKMXZQXQZRC-UHFFFAOYSA-N 0 0 317.379 5.293 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)CC[C@@H]1CCCCO1 ZINC000191554022 521421024 /nfs/dbraw/zinc/42/10/24/521421024.db2.gz WZLZNZXEZQKDNT-KRWDZBQOSA-N 0 0 317.473 5.050 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)CC[C@H]1CCCCO1 ZINC000191554032 521421444 /nfs/dbraw/zinc/42/14/44/521421444.db2.gz WZLZNZXEZQKDNT-QGZVFWFLSA-N 0 0 317.473 5.050 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)c1scnc1CC ZINC000191554629 521427804 /nfs/dbraw/zinc/42/78/04/521427804.db2.gz MGQRGGUBOCQZQN-UHFFFAOYSA-N 0 0 316.470 5.034 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)/C=C/c1ncccc1C ZINC000191555178 521422075 /nfs/dbraw/zinc/42/20/75/521422075.db2.gz HVPKLULONOQDSU-OUKQBFOZSA-N 0 0 322.452 5.118 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)c1sccc1C ZINC000191555806 521427222 /nfs/dbraw/zinc/42/72/22/521427222.db2.gz FJKCJMHHASLTRI-UHFFFAOYSA-N 0 0 301.455 5.385 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)c1ccnc(Cl)c1 ZINC000191556671 521425208 /nfs/dbraw/zinc/42/52/08/521425208.db2.gz RKMRRVMCOSSEDI-UHFFFAOYSA-N 0 0 316.832 5.063 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)c1ccc(C(C)=O)cc1 ZINC000191557438 521425673 /nfs/dbraw/zinc/42/56/73/521425673.db2.gz WKHVHCSUKGHAEX-UHFFFAOYSA-N 0 0 323.436 5.217 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)Cc1cccs1 ZINC000191559633 521420352 /nfs/dbraw/zinc/42/03/52/521420352.db2.gz FMHCBQMOMCNIAG-UHFFFAOYSA-N 0 0 301.455 5.005 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)c1ccc(C)s1 ZINC000191559672 340555493 /nfs/dbraw/zinc/55/54/93/340555493.db2.gz CZPMGJCQNAREGU-UHFFFAOYSA-N 0 0 301.455 5.385 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)c1cccnc1Cl ZINC000191559775 521424736 /nfs/dbraw/zinc/42/47/36/521424736.db2.gz ZOUIQLJIKWZQLG-UHFFFAOYSA-N 0 0 316.832 5.063 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)Cc1ccsc1 ZINC000191560149 521421356 /nfs/dbraw/zinc/42/13/56/521421356.db2.gz NUDWUMHIKPOBSC-UHFFFAOYSA-N 0 0 301.455 5.005 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)c1cccc(F)c1F ZINC000191561643 521425885 /nfs/dbraw/zinc/42/58/85/521425885.db2.gz BPYJMFRDIQWIIB-UHFFFAOYSA-N 0 0 317.379 5.293 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)Cc1cccc(C)c1 ZINC000191561679 337681682 /nfs/dbraw/zinc/68/16/82/337681682.db2.gz CAQUCIYTSSVYFG-UHFFFAOYSA-N 0 0 309.453 5.252 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)[C@@H](C)c1cccs1 ZINC000191561972 521425978 /nfs/dbraw/zinc/42/59/78/521425978.db2.gz NCMWTWBUBJCIDW-AWEZNQCLSA-N 0 0 315.482 5.566 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)[C@H](C)c1cccs1 ZINC000191561983 521425804 /nfs/dbraw/zinc/42/58/04/521425804.db2.gz NCMWTWBUBJCIDW-CQSZACIVSA-N 0 0 315.482 5.566 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)c1cc(C(C)C)on1 ZINC000191563702 521424988 /nfs/dbraw/zinc/42/49/88/521424988.db2.gz NNSBAVQGDYCBEG-UHFFFAOYSA-N 0 0 314.429 5.126 20 0 DKADRN Cc1c2ccccc2oc1[C@@H](C)NCc1ncc(C(C)C)s1 ZINC000191676532 340557414 /nfs/dbraw/zinc/55/74/14/340557414.db2.gz DSRVKYCBCLJFDZ-CYBMUJFWSA-N 0 0 314.454 5.172 20 0 DKADRN CC(=O)CC(C)(C)CC(=O)Nc1c(C(C)C)cccc1C(C)C ZINC000191775159 519383731 /nfs/dbraw/zinc/38/37/31/519383731.db2.gz SAAHZPWEXJRHNO-UHFFFAOYSA-N 0 0 317.473 5.267 20 0 DKADRN CC(C)c1cccc(C(C)C)c1NC(=O)c1ccoc1Cl ZINC000192254318 519841266 /nfs/dbraw/zinc/84/12/66/519841266.db2.gz OTUZSJOJEVCWFE-UHFFFAOYSA-N 0 0 305.805 5.432 20 0 DKADRN Cc1cc(SC2CCCCC2)ccc1NCc1cocn1 ZINC000192330425 336031341 /nfs/dbraw/zinc/03/13/41/336031341.db2.gz HUMDRQKAJIWBEL-UHFFFAOYSA-N 0 0 302.443 5.020 20 0 DKADRN O=C(Nc1ccccc1SC1CCCC1)c1ccoc1Cl ZINC000192394801 336030592 /nfs/dbraw/zinc/03/05/92/336030592.db2.gz XRCMNSBBPKHEMG-UHFFFAOYSA-N 0 0 321.829 5.220 20 0 DKADRN CC(C)c1ccc(NC(=O)c2ccoc2Cl)c(C(C)C)c1 ZINC000192395115 336030561 /nfs/dbraw/zinc/03/05/61/336030561.db2.gz KTBGMFXAWYMCMP-UHFFFAOYSA-N 0 0 305.805 5.432 20 0 DKADRN O=C(Nc1ccc(SC2CCCC2)cc1)c1ccoc1Cl ZINC000192395327 336030574 /nfs/dbraw/zinc/03/05/74/336030574.db2.gz GVUDKEMDKXTBPV-UHFFFAOYSA-N 0 0 321.829 5.220 20 0 DKADRN CC[C@H](N[C@H](c1ccco1)c1ccccc1)c1ccccc1OC ZINC000192758301 336260780 /nfs/dbraw/zinc/26/07/80/336260780.db2.gz SNUHJPAGXGLCNI-RXVVDRJESA-N 0 0 321.420 5.119 20 0 DKADRN CC[C@@H](N[C@H](c1ccco1)c1ccccc1)c1ccccc1OC ZINC000192758320 336260685 /nfs/dbraw/zinc/26/06/85/336260685.db2.gz SNUHJPAGXGLCNI-NQIIRXRSSA-N 0 0 321.420 5.119 20 0 DKADRN CC[C@H](N[C@@H](c1ccco1)c1ccccc1)c1ccccc1OC ZINC000192758336 336260773 /nfs/dbraw/zinc/26/07/73/336260773.db2.gz SNUHJPAGXGLCNI-GHTZIAJQSA-N 0 0 321.420 5.119 20 0 DKADRN CC[C@@H](N[C@@H](c1ccco1)c1ccccc1)c1ccccc1OC ZINC000192758350 336260766 /nfs/dbraw/zinc/26/07/66/336260766.db2.gz SNUHJPAGXGLCNI-WIYYLYMNSA-N 0 0 321.420 5.119 20 0 DKADRN Cc1cc([C@@H](C)Nc2cccc(NC(=O)C(C)C)c2)c(C)s1 ZINC000192800751 336264599 /nfs/dbraw/zinc/26/45/99/336264599.db2.gz FUMSUKFVFGLZIL-CYBMUJFWSA-N 0 0 316.470 5.133 20 0 DKADRN Cc1cc([C@H](C)Nc2cccc(NC(=O)C(C)C)c2)c(C)s1 ZINC000192800765 336264628 /nfs/dbraw/zinc/26/46/28/336264628.db2.gz FUMSUKFVFGLZIL-ZDUSSCGKSA-N 0 0 316.470 5.133 20 0 DKADRN CC(C)C(=O)Nc1cccc(N[C@@H](C)c2ccc(Cl)cc2)c1 ZINC000192801056 336264564 /nfs/dbraw/zinc/26/45/64/336264564.db2.gz PGWXWCRXPYLJFO-ZDUSSCGKSA-N 0 0 316.832 5.108 20 0 DKADRN CC(C)C(=O)Nc1cccc(N[C@H](C)c2ccc(Cl)cc2)c1 ZINC000192801071 336264554 /nfs/dbraw/zinc/26/45/54/336264554.db2.gz PGWXWCRXPYLJFO-CYBMUJFWSA-N 0 0 316.832 5.108 20 0 DKADRN CC(C)C(=O)Nc1cccc(N[C@@H](C)c2cccc(Cl)c2)c1 ZINC000192801379 336264586 /nfs/dbraw/zinc/26/45/86/336264586.db2.gz NOZDWWRDSUPNOE-ZDUSSCGKSA-N 0 0 316.832 5.108 20 0 DKADRN CC(C)C(=O)Nc1cccc(N[C@H](C)c2cccc(Cl)c2)c1 ZINC000192801388 336264594 /nfs/dbraw/zinc/26/45/94/336264594.db2.gz NOZDWWRDSUPNOE-CYBMUJFWSA-N 0 0 316.832 5.108 20 0 DKADRN CC(C)C(=O)Nc1cccc(N[C@@H](C)c2ccccc2Cl)c1 ZINC000192801436 336264581 /nfs/dbraw/zinc/26/45/81/336264581.db2.gz BRRBPRRNKSCTPS-ZDUSSCGKSA-N 0 0 316.832 5.108 20 0 DKADRN CC(C)C(=O)Nc1cccc(N[C@H](C)c2ccccc2Cl)c1 ZINC000192801450 336264544 /nfs/dbraw/zinc/26/45/44/336264544.db2.gz BRRBPRRNKSCTPS-CYBMUJFWSA-N 0 0 316.832 5.108 20 0 DKADRN CC(C)C(=O)Nc1cccc(N[C@@H](C)c2cc3ccccc3o2)c1 ZINC000192801497 336264613 /nfs/dbraw/zinc/26/46/13/336264613.db2.gz UMLZVAQAQGWUFT-AWEZNQCLSA-N 0 0 322.408 5.200 20 0 DKADRN CC(C)C(=O)Nc1cccc(N[C@H](C)c2cc3ccccc3o2)c1 ZINC000192801506 336264530 /nfs/dbraw/zinc/26/45/30/336264530.db2.gz UMLZVAQAQGWUFT-CQSZACIVSA-N 0 0 322.408 5.200 20 0 DKADRN CC(=O)Nc1cc(N[C@@H](C)c2cc(C)c(C)cc2C)ccc1C ZINC000192827833 336265723 /nfs/dbraw/zinc/26/57/23/336265723.db2.gz MYYSXLSGPIECCQ-INIZCTEOSA-N 0 0 310.441 5.052 20 0 DKADRN CC(=O)Nc1cc(N[C@H](C)c2cc(C)c(C)cc2C)ccc1C ZINC000192827850 336265702 /nfs/dbraw/zinc/26/57/02/336265702.db2.gz MYYSXLSGPIECCQ-MRXNPFEDSA-N 0 0 310.441 5.052 20 0 DKADRN CC(=O)Nc1cc(N[C@@H](C)c2ccc3c(c2)CCCC3)ccc1C ZINC000192827867 336265835 /nfs/dbraw/zinc/26/58/35/336265835.db2.gz SXTAYNICFAVCIJ-HNNXBMFYSA-N 0 0 322.452 5.005 20 0 DKADRN CC(=O)Nc1cc(N[C@H](C)c2ccc3c(c2)CCCC3)ccc1C ZINC000192827882 336265804 /nfs/dbraw/zinc/26/58/04/336265804.db2.gz SXTAYNICFAVCIJ-OAHLLOKOSA-N 0 0 322.452 5.005 20 0 DKADRN CCc1ccc([C@@H](CC)Nc2ccc(C)c(NC(C)=O)c2)cc1 ZINC000192828385 336265952 /nfs/dbraw/zinc/26/59/52/336265952.db2.gz XPSDIHOYVQXSNX-LJQANCHMSA-N 0 0 310.441 5.079 20 0 DKADRN CCc1ccc([C@H](CC)Nc2ccc(C)c(NC(C)=O)c2)cc1 ZINC000192828397 336265948 /nfs/dbraw/zinc/26/59/48/336265948.db2.gz XPSDIHOYVQXSNX-IBGZPJMESA-N 0 0 310.441 5.079 20 0 DKADRN CC(=O)Nc1cc(N[C@@H](C)c2cccc3ccccc32)ccc1C ZINC000192829048 336265955 /nfs/dbraw/zinc/26/59/55/336265955.db2.gz XBLVNUDWOBVCRO-HNNXBMFYSA-N 0 0 318.420 5.280 20 0 DKADRN CC(=O)Nc1cc(N[C@H](C)c2cccc3ccccc32)ccc1C ZINC000192829061 336265951 /nfs/dbraw/zinc/26/59/51/336265951.db2.gz XBLVNUDWOBVCRO-OAHLLOKOSA-N 0 0 318.420 5.280 20 0 DKADRN CC(=O)Nc1cc(N[C@@H](C)c2ccc(C(C)C)cc2)ccc1C ZINC000192830110 336265008 /nfs/dbraw/zinc/26/50/08/336265008.db2.gz NCNGULULUBQJCK-HNNXBMFYSA-N 0 0 310.441 5.250 20 0 DKADRN CC(=O)Nc1cc(N[C@H](C)c2ccc(C(C)C)cc2)ccc1C ZINC000192830126 336265000 /nfs/dbraw/zinc/26/50/00/336265000.db2.gz NCNGULULUBQJCK-OAHLLOKOSA-N 0 0 310.441 5.250 20 0 DKADRN CCCc1ccc([C@@H](C)Nc2ccc(C)c(NC(C)=O)c2)cc1 ZINC000192830272 336264985 /nfs/dbraw/zinc/26/49/85/336264985.db2.gz LXRXHWZLDXSVGY-OAHLLOKOSA-N 0 0 310.441 5.079 20 0 DKADRN CCCc1ccc([C@H](C)Nc2ccc(C)c(NC(C)=O)c2)cc1 ZINC000192830288 336264994 /nfs/dbraw/zinc/26/49/94/336264994.db2.gz LXRXHWZLDXSVGY-HNNXBMFYSA-N 0 0 310.441 5.079 20 0 DKADRN CC(=O)Nc1cc(N[C@@H](C)c2ccc3ccccc3c2)ccc1C ZINC000192830699 336264933 /nfs/dbraw/zinc/26/49/33/336264933.db2.gz NFZMXYALIOWMES-HNNXBMFYSA-N 0 0 318.420 5.280 20 0 DKADRN CC(=O)Nc1cc(N[C@H](C)c2ccc3ccccc3c2)ccc1C ZINC000192830711 336264946 /nfs/dbraw/zinc/26/49/46/336264946.db2.gz NFZMXYALIOWMES-OAHLLOKOSA-N 0 0 318.420 5.280 20 0 DKADRN CC[C@H](Nc1ccc(C)c(NC(C)=O)c1)c1cccc(Cl)c1 ZINC000192830747 336264921 /nfs/dbraw/zinc/26/49/21/336264921.db2.gz PATRHCMLFKPUFD-KRWDZBQOSA-N 0 0 316.832 5.170 20 0 DKADRN CC[C@@H](Nc1ccc(C)c(NC(C)=O)c1)c1cccc(Cl)c1 ZINC000192830761 336264940 /nfs/dbraw/zinc/26/49/40/336264940.db2.gz PATRHCMLFKPUFD-QGZVFWFLSA-N 0 0 316.832 5.170 20 0 DKADRN CC[C@H](Nc1ccc(C)c(NC(C)=O)c1)c1ccc(Cl)cc1 ZINC000192830952 336264914 /nfs/dbraw/zinc/26/49/14/336264914.db2.gz NQRPTGMIWXFKOT-KRWDZBQOSA-N 0 0 316.832 5.170 20 0 DKADRN CC[C@@H](Nc1ccc(C)c(NC(C)=O)c1)c1ccc(Cl)cc1 ZINC000192830968 336264964 /nfs/dbraw/zinc/26/49/64/336264964.db2.gz NQRPTGMIWXFKOT-QGZVFWFLSA-N 0 0 316.832 5.170 20 0 DKADRN CCc1c2ccccc2oc1[C@@H](C)Nc1ccc(NC(C)=O)cc1 ZINC000192862417 336274690 /nfs/dbraw/zinc/27/46/90/336274690.db2.gz ZSCWIPFBMGXZQC-CYBMUJFWSA-N 0 0 322.408 5.127 20 0 DKADRN CCc1c2ccccc2oc1[C@H](C)Nc1ccc(NC(C)=O)cc1 ZINC000192862430 336274770 /nfs/dbraw/zinc/27/47/70/336274770.db2.gz ZSCWIPFBMGXZQC-ZDUSSCGKSA-N 0 0 322.408 5.127 20 0 DKADRN CSc1cccc(N[C@@H](c2ccccc2)c2ccccn2)c1 ZINC000192862936 336275025 /nfs/dbraw/zinc/27/50/25/336275025.db2.gz YXVDGHPSLCVINQ-IBGZPJMESA-N 0 0 306.434 5.005 20 0 DKADRN CSc1cccc(N[C@H](c2ccccc2)c2ccccn2)c1 ZINC000192862953 336275085 /nfs/dbraw/zinc/27/50/85/336275085.db2.gz YXVDGHPSLCVINQ-LJQANCHMSA-N 0 0 306.434 5.005 20 0 DKADRN CSc1ccc(N[C@@H](c2ccccc2)c2ccccn2)cc1 ZINC000192868489 336275772 /nfs/dbraw/zinc/27/57/72/336275772.db2.gz BCOWUUVMMSSZJW-IBGZPJMESA-N 0 0 306.434 5.005 20 0 DKADRN CSc1ccc(N[C@H](c2ccccc2)c2ccccn2)cc1 ZINC000192868502 336275672 /nfs/dbraw/zinc/27/56/72/336275672.db2.gz BCOWUUVMMSSZJW-LJQANCHMSA-N 0 0 306.434 5.005 20 0 DKADRN CCc1c2ccccc2oc1[C@@H](C)Nc1cccc(NC(C)=O)c1 ZINC000192875766 336278913 /nfs/dbraw/zinc/27/89/13/336278913.db2.gz ALGDRTJYISTYDH-CYBMUJFWSA-N 0 0 322.408 5.127 20 0 DKADRN CCc1c2ccccc2oc1[C@H](C)Nc1cccc(NC(C)=O)c1 ZINC000192875776 336278991 /nfs/dbraw/zinc/27/89/91/336278991.db2.gz ALGDRTJYISTYDH-ZDUSSCGKSA-N 0 0 322.408 5.127 20 0 DKADRN CC(=O)Nc1ccc(N[C@@H](c2cccs2)C2CCCC2)cc1 ZINC000192907894 336283690 /nfs/dbraw/zinc/28/36/90/336283690.db2.gz GIFMOFWSEDODNG-GOSISDBHSA-N 0 0 314.454 5.050 20 0 DKADRN CC(=O)Nc1ccc(N[C@H](c2cccs2)C2CCCC2)cc1 ZINC000192907911 336283619 /nfs/dbraw/zinc/28/36/19/336283619.db2.gz GIFMOFWSEDODNG-SFHVURJKSA-N 0 0 314.454 5.050 20 0 DKADRN CC(=O)Nc1cccc(N[C@@H](c2cccs2)C2CCCC2)c1 ZINC000192922775 336284356 /nfs/dbraw/zinc/28/43/56/336284356.db2.gz VYEAXPXUCOXMGX-GOSISDBHSA-N 0 0 314.454 5.050 20 0 DKADRN CC(=O)Nc1cccc(N[C@H](c2cccs2)C2CCCC2)c1 ZINC000192922790 336284322 /nfs/dbraw/zinc/28/43/22/336284322.db2.gz VYEAXPXUCOXMGX-SFHVURJKSA-N 0 0 314.454 5.050 20 0 DKADRN COCc1cccc(N[C@H](C)c2sc(C(C)(C)C)nc2C)c1 ZINC000192964963 336286038 /nfs/dbraw/zinc/28/60/38/336286038.db2.gz UOJKVYICEOUZGZ-GFCCVEGCSA-N 0 0 318.486 5.069 20 0 DKADRN COCc1cccc(N[C@@H](C)c2sc(C(C)(C)C)nc2C)c1 ZINC000192964977 336286123 /nfs/dbraw/zinc/28/61/23/336286123.db2.gz UOJKVYICEOUZGZ-LBPRGKRZSA-N 0 0 318.486 5.069 20 0 DKADRN CCC(=O)Nc1ccc(N[C@@H](C)c2oc3ccccc3c2C)cc1 ZINC000192999810 336286803 /nfs/dbraw/zinc/28/68/03/336286803.db2.gz SDXTWMWAKXCRFT-AWEZNQCLSA-N 0 0 322.408 5.263 20 0 DKADRN CCC(=O)Nc1ccc(N[C@H](C)c2oc3ccccc3c2C)cc1 ZINC000192999823 336286805 /nfs/dbraw/zinc/28/68/05/336286805.db2.gz SDXTWMWAKXCRFT-CQSZACIVSA-N 0 0 322.408 5.263 20 0 DKADRN CCC(=O)Nc1ccc(N[C@@H](C)c2ccc(F)cc2Cl)cc1 ZINC000193000010 336286812 /nfs/dbraw/zinc/28/68/12/336286812.db2.gz ZPCJACJPEVOASD-NSHDSACASA-N 0 0 320.795 5.001 20 0 DKADRN CCC(=O)Nc1ccc(N[C@H](C)c2ccc(F)cc2Cl)cc1 ZINC000193000027 336286723 /nfs/dbraw/zinc/28/67/23/336286723.db2.gz ZPCJACJPEVOASD-LLVKDONJSA-N 0 0 320.795 5.001 20 0 DKADRN CC(=O)Nc1cc(N[C@@H](C)c2oc3ccccc3c2C)ccc1C ZINC000193014708 336287002 /nfs/dbraw/zinc/28/70/02/336287002.db2.gz OVXPTKJQAPGSMR-AWEZNQCLSA-N 0 0 322.408 5.181 20 0 DKADRN CC(=O)Nc1cc(N[C@H](C)c2oc3ccccc3c2C)ccc1C ZINC000193014720 336287026 /nfs/dbraw/zinc/28/70/26/336287026.db2.gz OVXPTKJQAPGSMR-CQSZACIVSA-N 0 0 322.408 5.181 20 0 DKADRN c1coc(COCc2cccc(N[C@@H]3CCCc4occc43)c2)c1 ZINC000193081922 332973882 /nfs/dbraw/zinc/97/38/82/332973882.db2.gz IWDAWVHHIWHDDN-LJQANCHMSA-N 0 0 323.392 5.079 20 0 DKADRN C[C@H](NCc1sccc1Cl)c1nc(C(C)(C)C)cs1 ZINC000193093534 334917874 /nfs/dbraw/zinc/91/78/74/334917874.db2.gz XWDDRQLZDIHXDX-VIFPVBQESA-N 0 0 314.907 5.006 20 0 DKADRN C[C@@H](NCc1cc(Cl)cs1)c1nc(C(C)(C)C)cs1 ZINC000193093570 333360904 /nfs/dbraw/zinc/36/09/04/333360904.db2.gz LWDBWFPCAQNNOW-SECBINFHSA-N 0 0 314.907 5.006 20 0 DKADRN Cc1nc(-c2cccc(N[C@@H]3CCCc4occc43)c2)oc1C ZINC000193101329 335042549 /nfs/dbraw/zinc/04/25/49/335042549.db2.gz PXVXIYVQIAIECH-QGZVFWFLSA-N 0 0 308.381 5.041 20 0 DKADRN Cc1nc(-c2cccc(N[C@H]3CCCc4occc43)c2)oc1C ZINC000193101345 335042574 /nfs/dbraw/zinc/04/25/74/335042574.db2.gz PXVXIYVQIAIECH-KRWDZBQOSA-N 0 0 308.381 5.041 20 0 DKADRN FC(F)(F)Cc1cccc(N[C@H]2CCCNc3ccccc32)c1 ZINC000193267134 333301149 /nfs/dbraw/zinc/30/11/49/333301149.db2.gz NDNBHSUZLXNVDL-KRWDZBQOSA-N 0 0 320.358 5.150 20 0 DKADRN COc1cc(SC)ccc1N[C@@H](C)c1ccc2ccccc2n1 ZINC000193438231 336927719 /nfs/dbraw/zinc/92/77/19/336927719.db2.gz DGUYFXHCDOKRBS-ZDUSSCGKSA-N 0 0 324.449 5.138 20 0 DKADRN COc1cc(SC)ccc1N[C@H](C)c1ccc2ccccc2n1 ZINC000193438248 336927813 /nfs/dbraw/zinc/92/78/13/336927813.db2.gz DGUYFXHCDOKRBS-CYBMUJFWSA-N 0 0 324.449 5.138 20 0 DKADRN COc1cc(SC)ccc1N[C@H](C)c1csc(C(C)C)n1 ZINC000193440796 336928704 /nfs/dbraw/zinc/92/87/04/336928704.db2.gz VVKITXDDWCBFSJ-LLVKDONJSA-N 0 0 322.499 5.170 20 0 DKADRN COc1cc(SC)ccc1N[C@@H](C)c1csc(C(C)C)n1 ZINC000193440811 336928717 /nfs/dbraw/zinc/92/87/17/336928717.db2.gz VVKITXDDWCBFSJ-NSHDSACASA-N 0 0 322.499 5.170 20 0 DKADRN Cc1cccc(C)c1NC(=O)N1CCCCC[C@@H]1c1ccccc1 ZINC000193493400 337018665 /nfs/dbraw/zinc/01/86/65/337018665.db2.gz JTHHCYIRFAKKEN-LJQANCHMSA-N 0 0 322.452 5.453 20 0 DKADRN Cc1cccc(C)c1NC(=O)N1CCCCC[C@H]1c1ccccc1 ZINC000193493416 337018770 /nfs/dbraw/zinc/01/87/70/337018770.db2.gz JTHHCYIRFAKKEN-IBGZPJMESA-N 0 0 322.452 5.453 20 0 DKADRN COc1cc(N[C@H](C)c2csc(C(C)C)n2)ccc1Cl ZINC000193850282 337079617 /nfs/dbraw/zinc/07/96/17/337079617.db2.gz DLVCBRWQYBMXBR-SNVBAGLBSA-N 0 0 310.850 5.102 20 0 DKADRN COc1cc(N[C@@H](C)c2csc(C(C)C)n2)ccc1Cl ZINC000193850302 337079544 /nfs/dbraw/zinc/07/95/44/337079544.db2.gz DLVCBRWQYBMXBR-JTQLQIEISA-N 0 0 310.850 5.102 20 0 DKADRN C[C@H](Nc1cccc(-c2cnco2)c1)c1cc2ccccc2o1 ZINC000193909786 337080485 /nfs/dbraw/zinc/08/04/85/337080485.db2.gz QVFJPVOQSGWZRI-ZDUSSCGKSA-N 0 0 304.349 5.261 20 0 DKADRN C[C@@H](Nc1cccc(-c2cnco2)c1)c1cc2ccccc2o1 ZINC000193909800 337080549 /nfs/dbraw/zinc/08/05/49/337080549.db2.gz QVFJPVOQSGWZRI-CYBMUJFWSA-N 0 0 304.349 5.261 20 0 DKADRN c1csc(-c2nc(CSc3cccc4cccnc43)co2)c1 ZINC000194108655 340589108 /nfs/dbraw/zinc/58/91/08/340589108.db2.gz VSKVTDWDDWDOBD-UHFFFAOYSA-N 0 0 324.430 5.244 20 0 DKADRN CC(C)[C@@H](c1ccccc1)N(C)C(=O)Nc1ccc2cc[nH]c2c1 ZINC000194335098 338515159 /nfs/dbraw/zinc/51/51/59/338515159.db2.gz URANWCOADKRIQM-IBGZPJMESA-N 0 0 321.424 5.029 20 0 DKADRN CC(C)[C@H](c1ccccc1)N(C)C(=O)Nc1ccc2cc[nH]c2c1 ZINC000194335114 338515094 /nfs/dbraw/zinc/51/50/94/338515094.db2.gz URANWCOADKRIQM-LJQANCHMSA-N 0 0 321.424 5.029 20 0 DKADRN CCc1ccc([C@@H](C)Nc2cccc(NC(=O)C(C)C)c2)s1 ZINC000194339076 338515230 /nfs/dbraw/zinc/51/52/30/338515230.db2.gz IHJVGCTZIPBTJX-CYBMUJFWSA-N 0 0 316.470 5.078 20 0 DKADRN CCc1ccc([C@H](C)Nc2cccc(NC(=O)C(C)C)c2)s1 ZINC000194339092 338515207 /nfs/dbraw/zinc/51/52/07/338515207.db2.gz IHJVGCTZIPBTJX-ZDUSSCGKSA-N 0 0 316.470 5.078 20 0 DKADRN O=C(Nc1ccccc1-c1ccccc1)c1ccc2ncccc2c1 ZINC000194681649 340594883 /nfs/dbraw/zinc/59/48/83/340594883.db2.gz QHMLARQYUASHSA-UHFFFAOYSA-N 0 0 324.383 5.154 20 0 DKADRN O=C(Nc1ccc2cc[nH]c2c1)c1sccc1-c1ccccc1 ZINC000194861002 338768791 /nfs/dbraw/zinc/76/87/91/338768791.db2.gz LTRCBFNSOMKTFX-UHFFFAOYSA-N 0 0 318.401 5.149 20 0 DKADRN CSc1ccccc1[C@H](C)NCc1nc(C(C)(C)C)cs1 ZINC000194885314 338773213 /nfs/dbraw/zinc/77/32/13/338773213.db2.gz VDYUYWCETHPGDD-LBPRGKRZSA-N 0 0 320.527 5.013 20 0 DKADRN CCC(CC)c1cc(CN[C@@H](C)c2ccccc2SC)on1 ZINC000194902172 338776154 /nfs/dbraw/zinc/77/61/54/338776154.db2.gz HMVGXLAUPAFZIM-ZDUSSCGKSA-N 0 0 318.486 5.151 20 0 DKADRN CCC(CC)c1cc(CN[C@H](C)c2ccccc2SC)on1 ZINC000194902186 338776124 /nfs/dbraw/zinc/77/61/24/338776124.db2.gz HMVGXLAUPAFZIM-CYBMUJFWSA-N 0 0 318.486 5.151 20 0 DKADRN CC[C@@H](C)N(C)C(=O)Nc1ccc(S[C@@H](C)CC)cc1C ZINC000194975985 340597941 /nfs/dbraw/zinc/59/79/41/340597941.db2.gz COKBQBYXEWHPND-KGLIPLIRSA-N 0 0 308.491 5.148 20 0 DKADRN CC[C@@H](C)Sc1ccc(NC(=O)N(C)[C@H](C)CC)c(C)c1 ZINC000194976011 340597892 /nfs/dbraw/zinc/59/78/92/340597892.db2.gz COKBQBYXEWHPND-ZIAGYGMSSA-N 0 0 308.491 5.148 20 0 DKADRN CC[C@@H](C)Sc1ccc(NC(=O)N(C)[C@@H](C)CC)c(C)c1 ZINC000194976028 340597894 /nfs/dbraw/zinc/59/78/94/340597894.db2.gz COKBQBYXEWHPND-UONOGXRCSA-N 0 0 308.491 5.148 20 0 DKADRN O=C(Nc1cccc(C(F)F)c1)c1cc(Cl)sc1Cl ZINC000195425936 340579530 /nfs/dbraw/zinc/57/95/30/340579530.db2.gz UXFYHFOJPVQJRX-UHFFFAOYSA-N 0 0 322.163 5.245 20 0 DKADRN O=C(Nc1cccc(C(F)F)c1)c1ccc(Cl)cc1Cl ZINC000195429345 336821130 /nfs/dbraw/zinc/82/11/30/336821130.db2.gz JVTKYDRNOUBGKF-UHFFFAOYSA-N 0 0 316.134 5.183 20 0 DKADRN Cc1cc(C)c(NC(=O)CCCSCCC(C)C)c(C)c1 ZINC000195539740 340581108 /nfs/dbraw/zinc/58/11/08/340581108.db2.gz DULJQLNSJGRLCE-UHFFFAOYSA-N 0 0 307.503 5.110 20 0 DKADRN C[C@H](SCc1ccc2ccccc2c1)c1nc(C2CC2)no1 ZINC000195541164 340581215 /nfs/dbraw/zinc/58/12/15/340581215.db2.gz SRAYIHFWQSOCNP-LBPRGKRZSA-N 0 0 310.422 5.095 20 0 DKADRN C[C@H]1CCN(C(=O)c2csc3ccccc23)c2ccccc21 ZINC000195564005 340581664 /nfs/dbraw/zinc/58/16/64/340581664.db2.gz QWTVFYNXIVTOSP-ZDUSSCGKSA-N 0 0 307.418 5.055 20 0 DKADRN Clc1ccc(SCc2ccc(Cl)c3cccnc23)nc1 ZINC000195571984 340581821 /nfs/dbraw/zinc/58/18/21/340581821.db2.gz ISMSSDMTABERGQ-UHFFFAOYSA-N 0 0 321.232 5.229 20 0 DKADRN CCCCN(CC)C(=O)Nc1ccc(C(C)C)cc1C(C)C ZINC000195584767 340582058 /nfs/dbraw/zinc/58/20/58/340582058.db2.gz UNGGVLCEFFFHMC-UHFFFAOYSA-N 0 0 304.478 5.587 20 0 DKADRN Cc1nc2ccccc2c(S[C@@H](C)c2ccc(F)c(F)c2)n1 ZINC000195593538 340582349 /nfs/dbraw/zinc/58/23/49/340582349.db2.gz OGPNAJDSKLTOES-JTQLQIEISA-N 0 0 316.376 5.070 20 0 DKADRN Cc1nc2ccccc2c(S[C@H](C)c2ccc(F)c(F)c2)n1 ZINC000195593540 340582345 /nfs/dbraw/zinc/58/23/45/340582345.db2.gz OGPNAJDSKLTOES-SNVBAGLBSA-N 0 0 316.376 5.070 20 0 DKADRN C[C@@H](SCc1nc(C(C)(C)C)no1)c1cccc(Cl)c1 ZINC000195594734 340582277 /nfs/dbraw/zinc/58/22/77/340582277.db2.gz FJVUJFPYQOKDHC-SNVBAGLBSA-N 0 0 310.850 5.015 20 0 DKADRN CC(C)c1nc(CS[C@@H](C)c2ccc(F)c(F)c2)cs1 ZINC000195594743 340582255 /nfs/dbraw/zinc/58/22/55/340582255.db2.gz GCONQLZTZLNGAZ-JTQLQIEISA-N 0 0 313.438 5.539 20 0 DKADRN C[C@@H](N[C@H](C)c1cc(F)ccc1F)c1cc2ccccc2o1 ZINC000195613485 338910024 /nfs/dbraw/zinc/91/00/24/338910024.db2.gz AHDSKMKCJDCNLF-VXGBXAGGSA-N 0 0 301.336 5.123 20 0 DKADRN C[C@@H](N[C@@H](C)c1cc2ccccc2o1)c1ccc(F)cc1F ZINC000195613646 338910055 /nfs/dbraw/zinc/91/00/55/338910055.db2.gz XBQPGELJRFCOIP-NEPJUHHUSA-N 0 0 301.336 5.123 20 0 DKADRN C[C@@H](Nc1ccc2oc(C3CC3)nc2c1)c1ccccc1Cl ZINC000195613797 338910062 /nfs/dbraw/zinc/91/00/62/338910062.db2.gz FQDPCCWCLRNZRK-LLVKDONJSA-N 0 0 312.800 5.532 20 0 DKADRN C[C@H](Nc1ccc2oc(C3CC3)nc2c1)c1ccccc1Cl ZINC000195613798 338910101 /nfs/dbraw/zinc/91/01/01/338910101.db2.gz FQDPCCWCLRNZRK-NSHDSACASA-N 0 0 312.800 5.532 20 0 DKADRN CC(C)Oc1cccc([C@@H](C)N[C@@H](C)c2c(F)cccc2F)c1 ZINC000195613896 338910124 /nfs/dbraw/zinc/91/01/24/338910124.db2.gz ZCSCJTIWBKGVCC-KGLIPLIRSA-N 0 0 319.395 5.164 20 0 DKADRN CC(C)Oc1cccc([C@H](C)N[C@H](C)c2c(F)cccc2F)c1 ZINC000195613902 338910117 /nfs/dbraw/zinc/91/01/17/338910117.db2.gz ZCSCJTIWBKGVCC-UONOGXRCSA-N 0 0 319.395 5.164 20 0 DKADRN CCC(=O)Nc1ccc(N[C@H](C)c2cc(C)c(C)cc2C)cc1 ZINC000195614077 338910265 /nfs/dbraw/zinc/91/02/65/338910265.db2.gz RWWOFSFFVOWPFU-MRXNPFEDSA-N 0 0 310.441 5.133 20 0 DKADRN CCC(=O)Nc1ccc(N[C@@H](C)c2cccc3ccccc32)cc1 ZINC000195614090 338910256 /nfs/dbraw/zinc/91/02/56/338910256.db2.gz KASSNCJNJIHTMZ-HNNXBMFYSA-N 0 0 318.420 5.361 20 0 DKADRN C[C@@H](N[C@@H](C)c1c(F)cccc1F)c1cc2ccccc2o1 ZINC000195614114 338910277 /nfs/dbraw/zinc/91/02/77/338910277.db2.gz AAGWOHXUICCUKP-NEPJUHHUSA-N 0 0 301.336 5.123 20 0 DKADRN C[C@H](N[C@@H](C)c1c(F)cccc1F)c1cc2ccccc2o1 ZINC000195614115 338910268 /nfs/dbraw/zinc/91/02/68/338910268.db2.gz AAGWOHXUICCUKP-RYUDHWBXSA-N 0 0 301.336 5.123 20 0 DKADRN CC(=O)Nc1ccc(N[C@@H](CC(C)(C)C)c2ccccc2)cc1 ZINC000195615277 338910478 /nfs/dbraw/zinc/91/04/78/338910478.db2.gz ORPUSFIVZNIDEA-IBGZPJMESA-N 0 0 310.441 5.234 20 0 DKADRN CC(=O)Nc1cccc(N[C@@H](CC(C)(C)C)c2ccccc2)c1 ZINC000195615428 338910402 /nfs/dbraw/zinc/91/04/02/338910402.db2.gz NBCPGBHOUAOHFV-IBGZPJMESA-N 0 0 310.441 5.234 20 0 DKADRN CC(=O)Nc1cc(N[C@@H](CC(C)(C)C)c2ccccc2)ccc1C ZINC000195616632 338910596 /nfs/dbraw/zinc/91/05/96/338910596.db2.gz NNFALAQHNSXVRZ-FQEVSTJZSA-N 0 0 324.468 5.543 20 0 DKADRN CC(C)OCc1ccc(NC(=O)c2ccc3ccccc3c2)cc1 ZINC000195639161 340583838 /nfs/dbraw/zinc/58/38/38/340583838.db2.gz ADBVQAGXHQCIKM-UHFFFAOYSA-N 0 0 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Cc1cc(-c2csc(C(C)C)n2)c(C)n1Cc1cccs1 ZINC000195692414 340585741 /nfs/dbraw/zinc/58/57/41/340585741.db2.gz PMYWTUFDZDYZSR-UHFFFAOYSA-N 0 0 316.495 5.462 20 0 DKADRN Cc1cc(C)c(CNCc2csc(-c3ccccc3)n2)cc1C ZINC000195719184 340586353 /nfs/dbraw/zinc/58/63/53/340586353.db2.gz PVFJWUDSICHTHG-UHFFFAOYSA-N 0 0 322.477 5.025 20 0 DKADRN CCC[C@@H](CC)NC(=O)N(CC)[C@H](C)c1cc2ccccc2o1 ZINC000195725570 340586710 /nfs/dbraw/zinc/58/67/10/340586710.db2.gz WRJIPKZREVBLFZ-GDBMZVCRSA-N 0 0 316.445 5.104 20 0 DKADRN CCC[C@H](CC)NC(=O)N(CC)[C@H](C)c1cc2ccccc2o1 ZINC000195725571 340586716 /nfs/dbraw/zinc/58/67/16/340586716.db2.gz WRJIPKZREVBLFZ-ZBFHGGJFSA-N 0 0 316.445 5.104 20 0 DKADRN Cc1ccc(C)c(C(=O)Nc2ccc3nc(C4CC4)sc3c2)c1 ZINC000195733922 340587359 /nfs/dbraw/zinc/58/73/59/340587359.db2.gz UUMSJYNRYOIDNC-UHFFFAOYSA-N 0 0 322.433 5.043 20 0 DKADRN CC(C)c1ccccc1NC(=O)CSCC1CCCCC1 ZINC000195737118 340587373 /nfs/dbraw/zinc/58/73/73/340587373.db2.gz BWLUMXPXVRLBEU-UHFFFAOYSA-N 0 0 305.487 5.062 20 0 DKADRN CCCCCOCC(=O)Nc1ccc(C(C)C)cc1C(C)C ZINC000195738236 340587455 /nfs/dbraw/zinc/58/74/55/340587455.db2.gz PWNFBZMBXUERJI-UHFFFAOYSA-N 0 0 305.462 5.079 20 0 DKADRN Cc1ncc(CSCc2c(Cl)cccc2Cl)s1 ZINC000195741379 340587796 /nfs/dbraw/zinc/58/77/96/340587796.db2.gz MJOQNWMJDGGMAS-UHFFFAOYSA-N 0 0 304.267 5.192 20 0 DKADRN C[C@@H](N[C@@H](C)c1ccc(Cl)c(F)c1)c1c(F)cccc1F ZINC000213656018 337854632 /nfs/dbraw/zinc/85/46/32/337854632.db2.gz RDUKHHULLVPUFN-VHSXEESVSA-N 0 0 313.750 5.169 20 0 DKADRN C[C@@H](N[C@H](C)c1c(F)cccc1F)c1ccc(Cl)c(F)c1 ZINC000213656078 337854541 /nfs/dbraw/zinc/85/45/41/337854541.db2.gz RDUKHHULLVPUFN-NXEZZACHSA-N 0 0 313.750 5.169 20 0 DKADRN CCN(C(=O)c1cc(C(C)C)nc2ccccc21)c1ccccc1 ZINC000215650535 332194888 /nfs/dbraw/zinc/19/48/88/332194888.db2.gz WLFUQVQLZIAMBB-UHFFFAOYSA-N 0 0 318.420 5.025 20 0 DKADRN Cc1cccc(C)c1NC(=O)c1cc(C(C)C)nc2ccccc21 ZINC000215661265 332195278 /nfs/dbraw/zinc/19/52/78/332195278.db2.gz YYQSGKDJAWHBMV-UHFFFAOYSA-N 0 0 318.420 5.227 20 0 DKADRN 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5.467 20 0 DKADRN C[C@@H](N[C@H](C)c1ccccc1)c1cc(Cl)sc1Cl ZINC000221726304 333364617 /nfs/dbraw/zinc/36/46/17/333364617.db2.gz QOSWIIKACYYRHA-NXEZZACHSA-N 0 0 300.254 5.467 20 0 DKADRN C[C@@H](N[C@@H](C)c1cc(Cl)sc1Cl)c1ccccc1 ZINC000221726358 333364705 /nfs/dbraw/zinc/36/47/05/333364705.db2.gz QOSWIIKACYYRHA-ZJUUUORDSA-N 0 0 300.254 5.467 20 0 DKADRN C[C@@H](NCc1ccccc1F)c1cc(Cl)sc1Cl ZINC000221738325 333365055 /nfs/dbraw/zinc/36/50/55/333365055.db2.gz QCCMQFBXWSFMFB-MRVPVSSYSA-N 0 0 304.217 5.045 20 0 DKADRN C[C@H](NCc1ccccc1F)c1cc(Cl)sc1Cl ZINC000221738373 333365137 /nfs/dbraw/zinc/36/51/37/333365137.db2.gz QCCMQFBXWSFMFB-QMMMGPOBSA-N 0 0 304.217 5.045 20 0 DKADRN C[C@@H](NCc1cccc(F)c1)c1cc(Cl)sc1Cl ZINC000221889749 333375175 /nfs/dbraw/zinc/37/51/75/333375175.db2.gz RENJJSRDQDPLLN-MRVPVSSYSA-N 0 0 304.217 5.045 20 0 DKADRN C[C@H](NCc1cccc(F)c1)c1cc(Cl)sc1Cl ZINC000221889811 333375047 /nfs/dbraw/zinc/37/50/47/333375047.db2.gz RENJJSRDQDPLLN-QMMMGPOBSA-N 0 0 304.217 5.045 20 0 DKADRN 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20 0 DKADRN C[C@@H](N[C@H]1CCCc2occc21)c1cc(Cl)sc1Cl ZINC000221987414 337011146 /nfs/dbraw/zinc/01/11/46/337011146.db2.gz BVIVSKRPRLCFIZ-KCJUWKMLSA-N 0 0 316.253 5.376 20 0 DKADRN C[C@H](N[C@H]1CCCc2occc21)c1cc(Cl)sc1Cl ZINC000221987477 337011027 /nfs/dbraw/zinc/01/10/27/337011027.db2.gz BVIVSKRPRLCFIZ-KWQFWETISA-N 0 0 316.253 5.376 20 0 DKADRN COC[C@@H](N[C@@H](C)c1ccc(Cl)cc1Cl)c1ccccc1 ZINC000222066528 333374864 /nfs/dbraw/zinc/37/48/64/333374864.db2.gz BAQSTJBDURTJML-YVEFUNNKSA-N 0 0 324.251 5.032 20 0 DKADRN COC[C@H](N[C@@H](C)c1ccc(Cl)cc1Cl)c1ccccc1 ZINC000222066592 333374831 /nfs/dbraw/zinc/37/48/31/333374831.db2.gz BAQSTJBDURTJML-SJCJKPOMSA-N 0 0 324.251 5.032 20 0 DKADRN COC[C@@H](N[C@H](C)c1ccc(Cl)cc1Cl)c1ccccc1 ZINC000222066641 333374825 /nfs/dbraw/zinc/37/48/25/333374825.db2.gz BAQSTJBDURTJML-SJKOYZFVSA-N 0 0 324.251 5.032 20 0 DKADRN COC[C@H](N[C@H](C)c1ccc(Cl)cc1Cl)c1ccccc1 ZINC000222066697 333374884 /nfs/dbraw/zinc/37/48/84/333374884.db2.gz BAQSTJBDURTJML-PXAZEXFGSA-N 0 0 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/nfs/dbraw/zinc/21/76/65/131217665.db2.gz KPQSQURAOKUZLR-CYBMUJFWSA-N 0 0 316.495 5.042 20 0 DKADRN Cc1ccnc([C@H](C)Nc2cccc(C3SCCS3)c2)c1 ZINC000286061311 131218108 /nfs/dbraw/zinc/21/81/08/131218108.db2.gz KPQSQURAOKUZLR-ZDUSSCGKSA-N 0 0 316.495 5.042 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)c1sccc1Cl ZINC000286572815 535431382 /nfs/dbraw/zinc/43/13/82/535431382.db2.gz UEOOAWRYRJHXIJ-UHFFFAOYSA-N 0 0 321.873 5.730 20 0 DKADRN Cc1cccc(C)c1NC(=O)N([C@@H](C)c1ccccc1)C1CC1 ZINC000286834414 131251885 /nfs/dbraw/zinc/25/18/85/131251885.db2.gz DMOLYPBGFCWKJE-INIZCTEOSA-N 0 0 308.425 5.061 20 0 DKADRN Cc1cccc(C)c1NC(=O)N([C@H](C)c1ccccc1)C1CC1 ZINC000286834415 131251903 /nfs/dbraw/zinc/25/19/03/131251903.db2.gz DMOLYPBGFCWKJE-MRXNPFEDSA-N 0 0 308.425 5.061 20 0 DKADRN CN(C(=O)Nc1ccccc1C(C)(C)C)C1CCC(F)(F)CC1 ZINC000286861022 131252888 /nfs/dbraw/zinc/25/28/88/131252888.db2.gz GOEAQNRUQDYTIP-UHFFFAOYSA-N 0 0 324.415 5.026 20 0 DKADRN Cc1cccc(C(C)C)c1NC(=O)N(C)C1CCC(F)(F)CC1 ZINC000286864201 131252502 /nfs/dbraw/zinc/25/25/02/131252502.db2.gz GRUUWPMHDCMGGT-UHFFFAOYSA-N 0 0 324.415 5.160 20 0 DKADRN CC1(C)CN(C(=O)Nc2ccccc2Cl)[C@H]1c1cccs1 ZINC000286912313 131254800 /nfs/dbraw/zinc/25/48/00/131254800.db2.gz KGYBZOMBMNIPRZ-AWEZNQCLSA-N 0 0 320.845 5.017 20 0 DKADRN CC1(C)CN(C(=O)Nc2ccccc2Cl)[C@@H]1c1cccs1 ZINC000286912319 131255277 /nfs/dbraw/zinc/25/52/77/131255277.db2.gz KGYBZOMBMNIPRZ-CQSZACIVSA-N 0 0 320.845 5.017 20 0 DKADRN Cc1cccc(C(C)C)c1NC(=O)N1CCC=C(c2ccco2)C1 ZINC000286979719 131258551 /nfs/dbraw/zinc/25/85/51/131258551.db2.gz OJCONXAIMOAOIU-UHFFFAOYSA-N 0 0 324.424 5.033 20 0 DKADRN CC(C)c1ccccc1NC(=O)N1Cc2cccc(Cl)c2C1 ZINC000286997627 131259395 /nfs/dbraw/zinc/25/93/95/131259395.db2.gz PMHYYIQJDSGYTQ-UHFFFAOYSA-N 0 0 314.816 5.011 20 0 DKADRN O=C(Nc1cccc(NC2CCCC2)c1)c1sccc1Cl ZINC000287498733 131282979 /nfs/dbraw/zinc/28/29/79/131282979.db2.gz HJPXHPIVIJTDMO-UHFFFAOYSA-N 0 0 320.845 5.008 20 0 DKADRN Cc1csc(N(C(=O)CC2(C)CCCC2)c2ccccc2)n1 ZINC000288062840 131311660 /nfs/dbraw/zinc/31/16/60/131311660.db2.gz GDWSQEPFPVRKKV-UHFFFAOYSA-N 0 0 314.454 5.087 20 0 DKADRN CC(C)c1cccc(C(C)C)c1NC(=O)c1ocnc1C1CC1 ZINC000288224240 535375325 /nfs/dbraw/zinc/37/53/25/535375325.db2.gz VUZLBDNVGVBRIZ-UHFFFAOYSA-N 0 0 312.413 5.051 20 0 DKADRN CC(C)c1ccc(NC(=O)c2ocnc2C2CC2)c(C(C)C)c1 ZINC000288674904 131334905 /nfs/dbraw/zinc/33/49/05/131334905.db2.gz SGIZIWYEGIIRNV-UHFFFAOYSA-N 0 0 312.413 5.051 20 0 DKADRN CCc1cc(C)cc(CC)c1NC(=O)c1sccc1Cl ZINC000288874204 131342820 /nfs/dbraw/zinc/34/28/20/131342820.db2.gz QQGVFQDAJAAKHW-UHFFFAOYSA-N 0 0 307.846 5.087 20 0 DKADRN CC(C)c1cccc(C(C)C)c1NC(=O)N[C@H](C)C(F)(F)F ZINC000288885433 535375110 /nfs/dbraw/zinc/37/51/10/535375110.db2.gz RJUBFTVFVGPKGU-LLVKDONJSA-N 0 0 316.367 5.006 20 0 DKADRN CC(C)c1cccc(C(C)C)c1NC(=O)N[C@@H](C)C(F)(F)F ZINC000288885436 535375011 /nfs/dbraw/zinc/37/50/11/535375011.db2.gz RJUBFTVFVGPKGU-NSHDSACASA-N 0 0 316.367 5.006 20 0 DKADRN C[C@@H]1C[C@H](N[C@H](c2nccs2)c2ccccc2)c2ccccc21 ZINC000289151390 131362217 /nfs/dbraw/zinc/36/22/17/131362217.db2.gz GIJLQXKYPKDYLW-CCKFTAQKSA-N 0 0 320.461 5.071 20 0 DKADRN C[C@@H]1C[C@H](N[C@@H](c2nccs2)c2ccccc2)c2ccccc21 ZINC000289151396 131362414 /nfs/dbraw/zinc/36/24/14/131362414.db2.gz GIJLQXKYPKDYLW-MDASCCDHSA-N 0 0 320.461 5.071 20 0 DKADRN C[C@@H]1C[C@@H](N[C@@H](c2nccs2)c2ccccc2)c2ccccc21 ZINC000289151403 131362076 /nfs/dbraw/zinc/36/20/76/131362076.db2.gz GIJLQXKYPKDYLW-NIKGAXFTSA-N 0 0 320.461 5.071 20 0 DKADRN C[C@@H]1C[C@@H](N[C@H](c2nccs2)c2ccccc2)c2ccccc21 ZINC000289151410 131362618 /nfs/dbraw/zinc/36/26/18/131362618.db2.gz GIJLQXKYPKDYLW-ZMYBRWDISA-N 0 0 320.461 5.071 20 0 DKADRN C[C@H](Nc1ccc(-c2ccccn2)cc1)c1ncc(C(C)(C)C)o1 ZINC000290669133 334173888 /nfs/dbraw/zinc/17/38/88/334173888.db2.gz QZYBZOIQXSSDDU-AWEZNQCLSA-N 0 0 321.424 5.207 20 0 DKADRN C[C@@H](Nc1ccc(-c2ccccn2)cc1)c1ncc(C(C)(C)C)o1 ZINC000290669138 334173870 /nfs/dbraw/zinc/17/38/70/334173870.db2.gz QZYBZOIQXSSDDU-CQSZACIVSA-N 0 0 321.424 5.207 20 0 DKADRN Cc1cc(NCc2csc(C3CC3)n2)ccc1-c1ccncc1 ZINC000292110119 131624783 /nfs/dbraw/zinc/62/47/83/131624783.db2.gz QDQZXQDVHDPGCO-UHFFFAOYSA-N 0 0 321.449 5.003 20 0 DKADRN CC(C)c1nc([C@@H](C)NCc2ccc(C(C)(F)F)cc2)cs1 ZINC000293735120 131763806 /nfs/dbraw/zinc/76/38/06/131763806.db2.gz OTIOQMAWMQOBGZ-GFCCVEGCSA-N 0 0 324.440 5.229 20 0 DKADRN CCCc1nc(C)c(CN[C@@H](C)c2ccc(-c3ccccc3)o2)o1 ZINC000293906252 535510523 /nfs/dbraw/zinc/51/05/23/535510523.db2.gz ZWZYLVKGSXHLPS-AWEZNQCLSA-N 0 0 324.424 5.046 20 0 DKADRN Cc1cc([C@@H](C)N[C@H](c2cccc(C)c2)c2ccccn2)cs1 ZINC000296746360 131984574 /nfs/dbraw/zinc/98/45/74/131984574.db2.gz JOCLZMVNZCTQNC-OXQOHEQNSA-N 0 0 322.477 5.200 20 0 DKADRN Cc1cccc(C(C)C)c1NC(=O)N(C)c1ccc2cc[nH]c2c1 ZINC000297773593 132033111 /nfs/dbraw/zinc/03/31/11/132033111.db2.gz MGRBXIRULUUNJC-UHFFFAOYSA-N 0 0 321.424 5.268 20 0 DKADRN CN(C(=O)Nc1ccccc1C(C)(C)C)c1ccc2cc[nH]c2c1 ZINC000297874117 132038041 /nfs/dbraw/zinc/03/80/41/132038041.db2.gz PYRSLXNAIONGQN-UHFFFAOYSA-N 0 0 321.424 5.134 20 0 DKADRN Cc1csc(N(C(=O)C=C2CCCCC2)c2ccccc2)n1 ZINC000299174763 132093157 /nfs/dbraw/zinc/09/31/57/132093157.db2.gz WIGCDSNDDMACFT-UHFFFAOYSA-N 0 0 312.438 5.007 20 0 DKADRN C[C@H](Sc1nccc(C(F)(F)F)n1)c1ccc(Cl)cc1 ZINC000301115481 336290711 /nfs/dbraw/zinc/29/07/11/336290711.db2.gz YIKGZMZGVLQYLU-QMMMGPOBSA-N 0 0 318.751 5.002 20 0 DKADRN Clc1nc(NCc2cccc3cccnc32)cc2ccccc21 ZINC000301120422 336290986 /nfs/dbraw/zinc/29/09/86/336290986.db2.gz WEHPIOMYHBNVPS-UHFFFAOYSA-N 0 0 319.795 5.049 20 0 DKADRN Cc1cccc(Oc2ccccc2NC(=O)Cc2cccs2)c1 ZINC000301142868 340625351 /nfs/dbraw/zinc/62/53/51/340625351.db2.gz GPPZUNHLNMJCQO-UHFFFAOYSA-N 0 0 323.417 5.030 20 0 DKADRN Cc1cccc(Oc2ccccc2NC(=O)c2cccs2)c1 ZINC000301143251 340246741 /nfs/dbraw/zinc/24/67/41/340246741.db2.gz HMCRZMPQNCJRIN-UHFFFAOYSA-N 0 0 309.390 5.101 20 0 DKADRN FC(F)c1nc2ccccc2c(Oc2ccc(Cl)cc2)n1 ZINC000301178812 336293534 /nfs/dbraw/zinc/29/35/34/336293534.db2.gz AGVHOTAPFJLDKX-UHFFFAOYSA-N 0 0 306.699 5.013 20 0 DKADRN Cc1ccc(Cl)c(Oc2nc(C(F)F)nc3ccccc32)c1 ZINC000301187079 336293929 /nfs/dbraw/zinc/29/39/29/336293929.db2.gz FHDKRJDXZMBXMH-UHFFFAOYSA-N 0 0 320.726 5.322 20 0 DKADRN Fc1ccc(Oc2nc(C(F)F)nc3ccccc32)c(Cl)c1 ZINC000301190092 336294200 /nfs/dbraw/zinc/29/42/00/336294200.db2.gz VRMMKAOHWILBON-UHFFFAOYSA-N 0 0 324.689 5.152 20 0 DKADRN C[C@@H](Nc1ccc2ccccc2n1)c1nc(C(C)(C)C)cs1 ZINC000301202709 336294647 /nfs/dbraw/zinc/29/46/47/336294647.db2.gz QZYAGGMZOHQLJT-GFCCVEGCSA-N 0 0 311.454 5.162 20 0 DKADRN C[C@H](Nc1ccc2ccccc2n1)c1nc(C(C)(C)C)cs1 ZINC000301202712 336294636 /nfs/dbraw/zinc/29/46/36/336294636.db2.gz QZYAGGMZOHQLJT-LBPRGKRZSA-N 0 0 311.454 5.162 20 0 DKADRN Cc1ccc([C@@H](C)Nc2nc(C(F)F)nc3ccccc32)cc1 ZINC000301205854 336294846 /nfs/dbraw/zinc/29/48/46/336294846.db2.gz PEANOCFGVSFERV-GFCCVEGCSA-N 0 0 313.351 5.049 20 0 DKADRN Cc1ccc([C@H](C)Nc2nc(C(F)F)nc3ccccc32)cc1 ZINC000301205855 336294750 /nfs/dbraw/zinc/29/47/50/336294750.db2.gz PEANOCFGVSFERV-LBPRGKRZSA-N 0 0 313.351 5.049 20 0 DKADRN C[C@@H](Nc1nc2ccccc2o1)c1nc(-c2ccccc2)cs1 ZINC000301206682 336294924 /nfs/dbraw/zinc/29/49/24/336294924.db2.gz TVHKMURVYUFXAW-GFCCVEGCSA-N 0 0 321.405 5.124 20 0 DKADRN C[C@H](Nc1nc2ccccc2o1)c1nc(-c2ccccc2)cs1 ZINC000301206683 336294971 /nfs/dbraw/zinc/29/49/71/336294971.db2.gz TVHKMURVYUFXAW-LBPRGKRZSA-N 0 0 321.405 5.124 20 0 DKADRN Cc1ccccc1CSc1nc(C(F)F)nc2ccccc21 ZINC000301214018 336295296 /nfs/dbraw/zinc/29/52/96/336295296.db2.gz WWYRZIBDUUCTBD-UHFFFAOYSA-N 0 0 316.376 5.168 20 0 DKADRN CSc1ccc(Oc2nc(C(F)F)nc3ccccc32)cc1 ZINC000301216630 336295423 /nfs/dbraw/zinc/29/54/23/336295423.db2.gz ZXZULBRWVKPCGE-UHFFFAOYSA-N 0 0 318.348 5.082 20 0 DKADRN CCc1nc([C@H](C)Nc2cc3ccccc3c(Cl)n2)cs1 ZINC000301229749 336295835 /nfs/dbraw/zinc/29/58/35/336295835.db2.gz DWIQLCQBRSIFDN-JTQLQIEISA-N 0 0 317.845 5.080 20 0 DKADRN CCc1nc([C@@H](C)Nc2cc3ccccc3c(Cl)n2)cs1 ZINC000301229750 336295851 /nfs/dbraw/zinc/29/58/51/336295851.db2.gz DWIQLCQBRSIFDN-SNVBAGLBSA-N 0 0 317.845 5.080 20 0 DKADRN CCc1nc([C@H](C)Nc2ccnc3cc(Cl)ccc32)cs1 ZINC000301231984 336295878 /nfs/dbraw/zinc/29/58/78/336295878.db2.gz FYQVDVKKYPHKPX-JTQLQIEISA-N 0 0 317.845 5.080 20 0 DKADRN CCc1nc([C@@H](C)Nc2ccnc3cc(Cl)ccc32)cs1 ZINC000301231985 336295999 /nfs/dbraw/zinc/29/59/99/336295999.db2.gz FYQVDVKKYPHKPX-SNVBAGLBSA-N 0 0 317.845 5.080 20 0 DKADRN CCc1nc([C@H](C)Nc2ccnc3ccc(Cl)cc32)cs1 ZINC000301265720 336297639 /nfs/dbraw/zinc/29/76/39/336297639.db2.gz IEHDAAHAAXHHIQ-JTQLQIEISA-N 0 0 317.845 5.080 20 0 DKADRN CCc1nc([C@@H](C)Nc2ccnc3ccc(Cl)cc32)cs1 ZINC000301265721 336297570 /nfs/dbraw/zinc/29/75/70/336297570.db2.gz IEHDAAHAAXHHIQ-SNVBAGLBSA-N 0 0 317.845 5.080 20 0 DKADRN Fc1ccc(C(Sc2ccccn2)c2ccc(F)cc2)cc1 ZINC000301315330 340626019 /nfs/dbraw/zinc/62/60/19/340626019.db2.gz OWZFCABMAZXZPW-UHFFFAOYSA-N 0 0 313.372 5.242 20 0 DKADRN C[C@@H](Nc1nc2ccccc2s1)c1ncc(-c2ccccc2)o1 ZINC000301329423 336300972 /nfs/dbraw/zinc/30/09/72/336300972.db2.gz AIATZZCIVWCHFI-GFCCVEGCSA-N 0 0 321.405 5.124 20 0 DKADRN C[C@H](Nc1nc2ccccc2s1)c1ncc(-c2ccccc2)o1 ZINC000301329424 336300937 /nfs/dbraw/zinc/30/09/37/336300937.db2.gz AIATZZCIVWCHFI-LBPRGKRZSA-N 0 0 321.405 5.124 20 0 DKADRN c1csc(C(Nc2nc3ccccc3o2)c2cccs2)c1 ZINC000301358161 336302435 /nfs/dbraw/zinc/30/24/35/336302435.db2.gz LIWZXZDBMCHRLI-UHFFFAOYSA-N 0 0 312.419 5.152 20 0 DKADRN Cc1ccc(Oc2nc(C(F)F)nc3ccccc32)c(Cl)c1 ZINC000301370912 336303083 /nfs/dbraw/zinc/30/30/83/336303083.db2.gz SVLCKUWRDCLZDH-UHFFFAOYSA-N 0 0 320.726 5.322 20 0 DKADRN C[C@H](Nc1ccnc2ccsc21)c1nc(C(C)(C)C)cs1 ZINC000301392936 336304177 /nfs/dbraw/zinc/30/41/77/336304177.db2.gz ISTAYVJQZLZUTH-JTQLQIEISA-N 0 0 317.483 5.223 20 0 DKADRN C[C@@H](Nc1ccnc2ccsc21)c1nc(C(C)(C)C)cs1 ZINC000301392938 336304161 /nfs/dbraw/zinc/30/41/61/336304161.db2.gz ISTAYVJQZLZUTH-SNVBAGLBSA-N 0 0 317.483 5.223 20 0 DKADRN C[C@@H](NC(c1ccccc1)c1ccccc1)c1ccccc1F ZINC000301397781 340253053 /nfs/dbraw/zinc/25/30/53/340253053.db2.gz CERKIESIROOQAL-MRXNPFEDSA-N 0 0 305.396 5.266 20 0 DKADRN Cc1cc(F)ccc1NC(=O)Nc1ccc(Cl)cc1Cl ZINC000301398548 332565483 /nfs/dbraw/zinc/56/54/83/332565483.db2.gz IUJVZTWFKWLUEN-UHFFFAOYSA-N 0 0 313.159 5.085 20 0 DKADRN C[C@H](Nc1nc2ccccc2o1)c1ccc(-c2ccncc2)cc1 ZINC000301462845 336308320 /nfs/dbraw/zinc/30/83/20/336308320.db2.gz ZYFYMKDRDWOFAB-AWEZNQCLSA-N 0 0 315.376 5.063 20 0 DKADRN C[C@@H](Nc1nc2ccccc2o1)c1ccc(-c2ccncc2)cc1 ZINC000301462846 336308339 /nfs/dbraw/zinc/30/83/39/336308339.db2.gz ZYFYMKDRDWOFAB-CQSZACIVSA-N 0 0 315.376 5.063 20 0 DKADRN C[C@H](Nc1nc2ccccc2o1)c1ccc(-c2cccnc2)cc1 ZINC000301488413 336309922 /nfs/dbraw/zinc/30/99/22/336309922.db2.gz ZZIPZRXFLIIDHL-AWEZNQCLSA-N 0 0 315.376 5.063 20 0 DKADRN C[C@@H](Nc1nc2ccccc2o1)c1ccc(-c2cccnc2)cc1 ZINC000301488414 336309895 /nfs/dbraw/zinc/30/98/95/336309895.db2.gz ZZIPZRXFLIIDHL-CQSZACIVSA-N 0 0 315.376 5.063 20 0 DKADRN C[C@@H](Nc1ccc(Nc2ncc(Cl)cn2)cc1)c1ccccc1 ZINC000301489352 336310007 /nfs/dbraw/zinc/31/00/07/336310007.db2.gz LAPQTIBMSFRWOM-CYBMUJFWSA-N 0 0 324.815 5.047 20 0 DKADRN C[C@H](Nc1ccc(Nc2ncc(Cl)cn2)cc1)c1ccccc1 ZINC000301489429 336310021 /nfs/dbraw/zinc/31/00/21/336310021.db2.gz LAPQTIBMSFRWOM-ZDUSSCGKSA-N 0 0 324.815 5.047 20 0 DKADRN CC(C)Sc1ccc([C@@H](C)Nc2nc(C3CC3)ns2)cc1 ZINC000301501907 336310880 /nfs/dbraw/zinc/31/08/80/336310880.db2.gz GRCSBBLMZYKFCN-LLVKDONJSA-N 0 0 319.499 5.089 20 0 DKADRN CC(C)Sc1ccc([C@H](C)Nc2nc(C3CC3)ns2)cc1 ZINC000301501909 336310876 /nfs/dbraw/zinc/31/08/76/336310876.db2.gz GRCSBBLMZYKFCN-NSHDSACASA-N 0 0 319.499 5.089 20 0 DKADRN c1cc2nccc(NCc3csc(-c4ccccc4)n3)c2s1 ZINC000301514937 336311738 /nfs/dbraw/zinc/31/17/38/336311738.db2.gz JLXAJDSOXHQDIQ-UHFFFAOYSA-N 0 0 323.446 5.032 20 0 DKADRN CCc1nc([C@@H](C)Nc2ncc(-c3ccccc3)s2)cs1 ZINC000301547267 336313992 /nfs/dbraw/zinc/31/39/92/336313992.db2.gz XCWZBPZQOTVYRY-LLVKDONJSA-N 0 0 315.467 5.002 20 0 DKADRN CCc1nc([C@H](C)Nc2ncc(-c3ccccc3)s2)cs1 ZINC000301547268 336313979 /nfs/dbraw/zinc/31/39/79/336313979.db2.gz XCWZBPZQOTVYRY-NSHDSACASA-N 0 0 315.467 5.002 20 0 DKADRN CC[C@@H](Nc1nc(C(F)F)nc2ccccc21)c1cccs1 ZINC000301575206 336315984 /nfs/dbraw/zinc/31/59/84/336315984.db2.gz SJZGKNGLMBVDLH-LLVKDONJSA-N 0 0 319.380 5.192 20 0 DKADRN CC[C@H](Nc1nc(C(F)F)nc2ccccc21)c1cccs1 ZINC000301575208 336316012 /nfs/dbraw/zinc/31/60/12/336316012.db2.gz SJZGKNGLMBVDLH-NSHDSACASA-N 0 0 319.380 5.192 20 0 DKADRN CC(C)Sc1ccc([C@@H](C)Nc2nnc(C3CC3)s2)cc1 ZINC000301704166 336324582 /nfs/dbraw/zinc/32/45/82/336324582.db2.gz ASWKDFFSCDJNKE-LLVKDONJSA-N 0 0 319.499 5.089 20 0 DKADRN CC(C)Sc1ccc([C@H](C)Nc2nnc(C3CC3)s2)cc1 ZINC000301704167 336324490 /nfs/dbraw/zinc/32/44/90/336324490.db2.gz ASWKDFFSCDJNKE-NSHDSACASA-N 0 0 319.499 5.089 20 0 DKADRN Cc1cc([C@@H](C)Nc2nc(C(F)(F)F)cs2)c(C)s1 ZINC000301726722 336325941 /nfs/dbraw/zinc/32/59/41/336325941.db2.gz NDRATRUYLZHWGF-SSDOTTSWSA-N 0 0 306.378 5.013 20 0 DKADRN Cc1cc([C@H](C)Nc2nc(C(F)(F)F)cs2)c(C)s1 ZINC000301726723 336326009 /nfs/dbraw/zinc/32/60/09/336326009.db2.gz NDRATRUYLZHWGF-ZETCQYMHSA-N 0 0 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307.865 5.220 20 0 DKADRN CC(C)(C)CCCC(=O)N1CCC[C@@H]1c1ccccc1Cl ZINC000303144180 340305293 /nfs/dbraw/zinc/30/52/93/340305293.db2.gz BRIVFNSKVHIICU-MRXNPFEDSA-N 0 0 307.865 5.220 20 0 DKADRN Cc1ccc(C(=O)Nc2c(C)cccc2C(C)C)cc1Cl ZINC000303144200 340305261 /nfs/dbraw/zinc/30/52/61/340305261.db2.gz DJRFWRDNCURNRU-UHFFFAOYSA-N 0 0 301.817 5.333 20 0 DKADRN CC[C@@H](SCC(=O)Nc1cccc(C)c1C)c1ccccc1 ZINC000303146791 340305246 /nfs/dbraw/zinc/30/52/46/340305246.db2.gz QWEWXTVIZCPZLE-GOSISDBHSA-N 0 0 313.466 5.126 20 0 DKADRN CC[C@H](SCC(=O)Nc1cccc(C)c1C)c1ccccc1 ZINC000303146794 340305305 /nfs/dbraw/zinc/30/53/05/340305305.db2.gz QWEWXTVIZCPZLE-SFHVURJKSA-N 0 0 313.466 5.126 20 0 DKADRN Cc1cccc(C2(C(=O)Nc3cccc(C)c3C)CCCC2)c1 ZINC000303147460 334302610 /nfs/dbraw/zinc/30/26/10/334302610.db2.gz NDEMHAIBAWNVCQ-UHFFFAOYSA-N 0 0 307.437 5.062 20 0 DKADRN Cc1cc(NC(=O)N(C)[C@H](C)c2ccc(Cl)cc2)ccc1F ZINC000303153186 340306443 /nfs/dbraw/zinc/30/64/43/340306443.db2.gz FTWAXUKBDOKETE-GFCCVEGCSA-N 0 0 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0 0 301.455 5.037 20 0 DKADRN CC[C@@H](CC(=O)N1CCC[C@@H]1C1CCCCC1)c1ccccc1 ZINC000303199310 340311718 /nfs/dbraw/zinc/31/17/18/340311718.db2.gz LMUWFOXSEXFPNI-FXAWDEMLSA-N 0 0 313.485 5.142 20 0 DKADRN CC[C@@H](CC(=O)N1CCC[C@H]1C1CCCCC1)c1ccccc1 ZINC000303199313 340311748 /nfs/dbraw/zinc/31/17/48/340311748.db2.gz LMUWFOXSEXFPNI-PXNSSMCTSA-N 0 0 313.485 5.142 20 0 DKADRN CC[C@H](CC(=O)N1CCC[C@H]1C1CCCCC1)c1ccccc1 ZINC000303199316 340311613 /nfs/dbraw/zinc/31/16/13/340311613.db2.gz LMUWFOXSEXFPNI-XLIONFOSSA-N 0 0 313.485 5.142 20 0 DKADRN CC[C@H](CC(=O)N1CCC[C@@H]1C1CCCCC1)c1ccccc1 ZINC000303199319 340311720 /nfs/dbraw/zinc/31/17/20/340311720.db2.gz LMUWFOXSEXFPNI-YLJYHZDGSA-N 0 0 313.485 5.142 20 0 DKADRN CC[C@@H](C)[C@H](C)N(C(=O)c1cc(Cl)sc1Cl)C1CC1 ZINC000303199887 334304132 /nfs/dbraw/zinc/30/41/32/334304132.db2.gz HFFJXVYBLBQEDX-BDAKNGLRSA-N 0 0 320.285 5.094 20 0 DKADRN CC[C@H](C)[C@@H](C)N(C(=O)c1cc(Cl)sc1Cl)C1CC1 ZINC000303199888 334304234 /nfs/dbraw/zinc/30/42/34/334304234.db2.gz HFFJXVYBLBQEDX-DTWKUNHWSA-N 0 0 320.285 5.094 20 0 DKADRN CC[C@H](C)[C@H](C)N(C(=O)c1cc(Cl)sc1Cl)C1CC1 ZINC000303199889 334304135 /nfs/dbraw/zinc/30/41/35/334304135.db2.gz HFFJXVYBLBQEDX-IUCAKERBSA-N 0 0 320.285 5.094 20 0 DKADRN CC[C@@H](C)[C@@H](C)N(C(=O)c1cc(Cl)sc1Cl)C1CC1 ZINC000303199890 334304200 /nfs/dbraw/zinc/30/42/00/334304200.db2.gz HFFJXVYBLBQEDX-RKDXNWHRSA-N 0 0 320.285 5.094 20 0 DKADRN Cc1ccc(SCc2coc(-c3ccc(F)c(F)c3)n2)cc1 ZINC000303203013 340312292 /nfs/dbraw/zinc/31/22/92/340312292.db2.gz OSLJUIGQVWYEHN-UHFFFAOYSA-N 0 0 317.360 5.221 20 0 DKADRN O=C(Nc1ccc(F)cc1Cl)N(CC1CC1)C1CCCCC1 ZINC000303207741 334304317 /nfs/dbraw/zinc/30/43/17/334304317.db2.gz QBLZAOOCFWQVIN-UHFFFAOYSA-N 0 0 324.827 5.056 20 0 DKADRN Cc1cc(NC(=O)c2sccc2-c2ccccc2)ccc1F ZINC000303210716 340313175 /nfs/dbraw/zinc/31/31/75/340313175.db2.gz REGKOXQPYVQEGR-UHFFFAOYSA-N 0 0 311.381 5.115 20 0 DKADRN CC[C@@H](CC(=O)Nc1ccc(C)cc1Cl)c1ccccc1 ZINC000303216491 340313247 /nfs/dbraw/zinc/31/32/47/340313247.db2.gz QMXHFOAUGJKQRC-AWEZNQCLSA-N 0 0 301.817 5.171 20 0 DKADRN CC[C@H](CC(=O)Nc1ccc(C)cc1Cl)c1ccccc1 ZINC000303216492 340313223 /nfs/dbraw/zinc/31/32/23/340313223.db2.gz QMXHFOAUGJKQRC-CQSZACIVSA-N 0 0 301.817 5.171 20 0 DKADRN Cc1cccc(SCc2coc(-c3ccc(F)c(F)c3)n2)c1 ZINC000303225817 340314033 /nfs/dbraw/zinc/31/40/33/340314033.db2.gz WUQMQMFYXUXJDL-UHFFFAOYSA-N 0 0 317.360 5.221 20 0 DKADRN CCCCC(=O)Nc1ccc(O[C@@H](C)c2ccccc2)cc1C ZINC000303225928 334304778 /nfs/dbraw/zinc/30/47/78/334304778.db2.gz WFHMYDNVSYAYFB-INIZCTEOSA-N 0 0 311.425 5.264 20 0 DKADRN CCCCC(=O)Nc1ccc(O[C@H](C)c2ccccc2)cc1C ZINC000303225931 334304810 /nfs/dbraw/zinc/30/48/10/334304810.db2.gz WFHMYDNVSYAYFB-MRXNPFEDSA-N 0 0 311.425 5.264 20 0 DKADRN Cc1c2cc(F)ccc2sc1C(=O)N(C(C)C)C1CCCC1 ZINC000303231688 340314542 /nfs/dbraw/zinc/31/45/42/340314542.db2.gz VSICJRFFSZAVCH-UHFFFAOYSA-N 0 0 319.445 5.142 20 0 DKADRN CSc1ccccc1NC(=O)C[C@H](c1ccccc1)C(C)C ZINC000303233881 340314642 /nfs/dbraw/zinc/31/46/42/340314642.db2.gz ZLKZTRLGQJGWRA-INIZCTEOSA-N 0 0 313.466 5.177 20 0 DKADRN CSc1ccccc1NC(=O)C[C@@H](c1ccccc1)C(C)C ZINC000303233882 340314555 /nfs/dbraw/zinc/31/45/55/340314555.db2.gz ZLKZTRLGQJGWRA-MRXNPFEDSA-N 0 0 313.466 5.177 20 0 DKADRN Cc1cc(NC(=O)N(C)[C@H](C)c2cccc(Cl)c2)ccc1F ZINC000303233936 340314534 /nfs/dbraw/zinc/31/45/34/340314534.db2.gz ZNUUYGAWEKCVNW-GFCCVEGCSA-N 0 0 320.795 5.012 20 0 DKADRN Cc1cc(NC(=O)N(C)[C@@H](C)c2cccc(Cl)c2)ccc1F ZINC000303233937 340314552 /nfs/dbraw/zinc/31/45/52/340314552.db2.gz ZNUUYGAWEKCVNW-LBPRGKRZSA-N 0 0 320.795 5.012 20 0 DKADRN C[C@@H](c1cc2ccccc2o1)N(C)C(=O)CCCC(C)(C)C ZINC000303237379 340314854 /nfs/dbraw/zinc/31/48/54/340314854.db2.gz YMYZKHAOIGTETE-AWEZNQCLSA-N 0 0 301.430 5.169 20 0 DKADRN C[C@H](c1cc2ccccc2o1)N(C)C(=O)CCCC(C)(C)C ZINC000303237380 340314813 /nfs/dbraw/zinc/31/48/13/340314813.db2.gz YMYZKHAOIGTETE-CQSZACIVSA-N 0 0 301.430 5.169 20 0 DKADRN CC(C)Sc1ccc(Cl)cc1NC(=O)c1ccccc1F ZINC000303238594 340633905 /nfs/dbraw/zinc/63/39/05/340633905.db2.gz HWBFGWQUPQHWPI-UHFFFAOYSA-N 0 0 323.820 5.232 20 0 DKADRN Cc1cccc(NC(=O)N(C2CC2)[C@H]2CCCc3ccccc32)c1 ZINC000303242659 340633889 /nfs/dbraw/zinc/63/38/89/340633889.db2.gz KNPNHQMYFAARNG-FQEVSTJZSA-N 0 0 320.436 5.069 20 0 DKADRN CC(=O)c1c(C)cc(C)c(CSCc2csc(C)n2)c1C ZINC000303244221 340315784 /nfs/dbraw/zinc/31/57/84/340315784.db2.gz CYKGCTCICFIXRH-UHFFFAOYSA-N 0 0 319.495 5.013 20 0 DKADRN Cc1ccc(C)c(SCc2csc(-c3ccoc3)n2)c1 ZINC000303252262 340634015 /nfs/dbraw/zinc/63/40/15/340634015.db2.gz CHFPJQJQSUOIBL-UHFFFAOYSA-N 0 0 301.436 5.312 20 0 DKADRN Cc1ccc(NC(=O)N(C2CC2)[C@H]2CCCc3ccccc32)cc1 ZINC000303252978 334309242 /nfs/dbraw/zinc/30/92/42/334309242.db2.gz NPVBKXHKATYWEG-FQEVSTJZSA-N 0 0 320.436 5.069 20 0 DKADRN Cc1ccc(NC(=O)N(C2CC2)[C@@H]2CCCc3ccccc32)cc1 ZINC000303252979 334309254 /nfs/dbraw/zinc/30/92/54/334309254.db2.gz NPVBKXHKATYWEG-HXUWFJFHSA-N 0 0 320.436 5.069 20 0 DKADRN 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C[C@@H](N[C@@H](c1ccco1)c1ccccc1)c1cccc(Cl)c1 ZINC000314104042 333086799 /nfs/dbraw/zinc/08/67/99/333086799.db2.gz MEKGRLKNTQWWHX-AUUYWEPGSA-N 0 0 311.812 5.373 20 0 DKADRN C[C@H](N[C@@H](c1ccco1)c1ccccc1)c1cccc(Cl)c1 ZINC000314104053 333087171 /nfs/dbraw/zinc/08/71/71/333087171.db2.gz MEKGRLKNTQWWHX-IFXJQAMLSA-N 0 0 311.812 5.373 20 0 DKADRN C[C@@H](N[C@H](c1ccco1)c1ccccc1)c1cccc(Cl)c1 ZINC000314104063 333087024 /nfs/dbraw/zinc/08/70/24/333087024.db2.gz MEKGRLKNTQWWHX-KUHUBIRLSA-N 0 0 311.812 5.373 20 0 DKADRN C[C@H](N[C@H](c1ccco1)c1ccccc1)c1cccc(Cl)c1 ZINC000314104072 333087032 /nfs/dbraw/zinc/08/70/32/333087032.db2.gz MEKGRLKNTQWWHX-LIRRHRJNSA-N 0 0 311.812 5.373 20 0 DKADRN Fc1ccc(N[C@H](c2ccccc2)c2ccccn2)cc1Cl ZINC000314128946 333088982 /nfs/dbraw/zinc/08/89/82/333088982.db2.gz QNSVHYZOHGIINS-GOSISDBHSA-N 0 0 312.775 5.076 20 0 DKADRN Fc1ccc(N[C@@H](c2ccccc2)c2ccccn2)cc1Cl ZINC000314128950 333088963 /nfs/dbraw/zinc/08/89/63/333088963.db2.gz QNSVHYZOHGIINS-SFHVURJKSA-N 0 0 312.775 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ZINC000321008327 337164335 /nfs/dbraw/zinc/16/43/35/337164335.db2.gz OZFNZRQCLCYZJU-ZIAGYGMSSA-N 0 0 311.375 5.530 20 0 DKADRN CC[C@H](Nc1cccc(-c2nccs2)c1)c1ccccc1OC ZINC000321081981 337196274 /nfs/dbraw/zinc/19/62/74/337196274.db2.gz RYONTHIXVLNLTK-KRWDZBQOSA-N 0 0 324.449 5.382 20 0 DKADRN CC[C@@H](Nc1cccc(-c2nccs2)c1)c1ccccc1OC ZINC000321081984 337196286 /nfs/dbraw/zinc/19/62/86/337196286.db2.gz RYONTHIXVLNLTK-QGZVFWFLSA-N 0 0 324.449 5.382 20 0 DKADRN COc1cc(C)ccc1[C@H](C)Nc1cccc(-c2nccs2)c1 ZINC000321126576 337611232 /nfs/dbraw/zinc/61/12/32/337611232.db2.gz DXBXTNBWMUNBCD-AWEZNQCLSA-N 0 0 324.449 5.300 20 0 DKADRN COc1cc(C)ccc1[C@@H](C)Nc1cccc(-c2nccs2)c1 ZINC000321126577 337611312 /nfs/dbraw/zinc/61/13/12/337611312.db2.gz DXBXTNBWMUNBCD-CQSZACIVSA-N 0 0 324.449 5.300 20 0 DKADRN FC(F)(F)[C@@H]1CCC[C@H](Nc2ccc3oc(C4CC4)nc3c2)C1 ZINC000321160663 337202942 /nfs/dbraw/zinc/20/29/42/337202942.db2.gz HEUNGZJIAHOKIH-NEPJUHHUSA-N 0 0 324.346 5.238 20 0 DKADRN FC(F)(F)[C@H]1CCC[C@@H](Nc2ccc3oc(C4CC4)nc3c2)C1 ZINC000321160667 337202984 /nfs/dbraw/zinc/20/29/84/337202984.db2.gz HEUNGZJIAHOKIH-NWDGAFQWSA-N 0 0 324.346 5.238 20 0 DKADRN FC(F)(F)[C@H]1CCC[C@H](Nc2ccc3oc(C4CC4)nc3c2)C1 ZINC000321160670 337202972 /nfs/dbraw/zinc/20/29/72/337202972.db2.gz HEUNGZJIAHOKIH-RYUDHWBXSA-N 0 0 324.346 5.238 20 0 DKADRN FC(F)(F)[C@@H]1CCC[C@@H](Nc2ccc3oc(C4CC4)nc3c2)C1 ZINC000321160673 337202938 /nfs/dbraw/zinc/20/29/38/337202938.db2.gz HEUNGZJIAHOKIH-VXGBXAGGSA-N 0 0 324.346 5.238 20 0 DKADRN C[C@H](Nc1ccc2oc(C3CC3)nc2c1)c1cc(F)cc(F)c1 ZINC000321182525 337204670 /nfs/dbraw/zinc/20/46/70/337204670.db2.gz QXFOPDWBBJYFET-JTQLQIEISA-N 0 0 314.335 5.157 20 0 DKADRN C[C@@H](Nc1ccc2oc(C3CC3)nc2c1)c1cc(F)cc(F)c1 ZINC000321182527 337204766 /nfs/dbraw/zinc/20/47/66/337204766.db2.gz QXFOPDWBBJYFET-SNVBAGLBSA-N 0 0 314.335 5.157 20 0 DKADRN CCOc1cc(C)ccc1N[C@H](C)c1ccc(OC(F)F)cc1 ZINC000321246177 337251926 /nfs/dbraw/zinc/25/19/26/337251926.db2.gz VBDWFLOTIQKOTJ-CYBMUJFWSA-N 0 0 321.367 5.168 20 0 DKADRN CCOc1cc(C)ccc1N[C@@H](C)c1ccc(OC(F)F)cc1 ZINC000321246181 337251881 /nfs/dbraw/zinc/25/18/81/337251881.db2.gz VBDWFLOTIQKOTJ-ZDUSSCGKSA-N 0 0 321.367 5.168 20 0 DKADRN Cc1ccc([C@H](C)[NH2+][C@@H]2CCCc3c4ccccc4[nH]c32)cc1 ZINC000321265550 337254542 /nfs/dbraw/zinc/25/45/42/337254542.db2.gz AGZVDUYVFKBPNB-MGPUTAFESA-N 0 0 304.437 5.205 20 0 DKADRN Cc1ccc([C@H](C)[NH2+][C@H]2CCCc3c4ccccc4[nH]c32)cc1 ZINC000321265562 337254508 /nfs/dbraw/zinc/25/45/08/337254508.db2.gz AGZVDUYVFKBPNB-YWZLYKJASA-N 0 0 304.437 5.205 20 0 DKADRN COc1ccc(C[NH2+][C@@H]2CCCc3sccc32)c2ccccc12 ZINC000321273839 337253717 /nfs/dbraw/zinc/25/37/17/337253717.db2.gz AUUDTDKZVLOXCA-GOSISDBHSA-N 0 0 323.461 5.077 20 0 DKADRN COc1ccc(C[NH2+][C@H]2CCCc3sccc32)c2ccccc12 ZINC000321273841 337253640 /nfs/dbraw/zinc/25/36/40/337253640.db2.gz AUUDTDKZVLOXCA-SFHVURJKSA-N 0 0 323.461 5.077 20 0 DKADRN c1coc([C@@H](NCc2ccc(C3CC3)cc2)c2ccccc2)c1 ZINC000321322658 337257879 /nfs/dbraw/zinc/25/78/79/337257879.db2.gz BHQHHCKPZJYNNP-NRFANRHFSA-N 0 0 303.405 5.036 20 0 DKADRN c1coc([C@H](NCc2ccc(C3CC3)cc2)c2ccccc2)c1 ZINC000321322660 337257810 /nfs/dbraw/zinc/25/78/10/337257810.db2.gz BHQHHCKPZJYNNP-OAQYLSRUSA-N 0 0 303.405 5.036 20 0 DKADRN Cc1ccc([C@@H](C)[NH2+][C@H](C)c2ccc(OC(F)F)cc2)cc1F ZINC000321390180 337262280 /nfs/dbraw/zinc/26/22/80/337262280.db2.gz CTKMCVYIKJDLEM-CHWSQXEVSA-N 0 0 323.358 5.147 20 0 DKADRN Cc1ccc([C@H](C)[NH2+][C@H](C)c2ccc(OC(F)F)cc2)cc1F ZINC000321390181 337262295 /nfs/dbraw/zinc/26/22/95/337262295.db2.gz CTKMCVYIKJDLEM-OLZOCXBDSA-N 0 0 323.358 5.147 20 0 DKADRN Cc1ccc([C@@H](C)[NH2+][C@@H](C)c2ccc(OC(F)F)cc2)cc1F ZINC000321390182 337262216 /nfs/dbraw/zinc/26/22/16/337262216.db2.gz CTKMCVYIKJDLEM-QWHCGFSZSA-N 0 0 323.358 5.147 20 0 DKADRN Cc1ccc([C@H](C)[NH2+][C@@H](C)c2ccc(OC(F)F)cc2)cc1F ZINC000321390183 337262201 /nfs/dbraw/zinc/26/22/01/337262201.db2.gz CTKMCVYIKJDLEM-STQMWFEESA-N 0 0 323.358 5.147 20 0 DKADRN C[C@@H](Nc1cccc2ccncc21)c1cccc(OC(F)F)c1 ZINC000321490328 337629874 /nfs/dbraw/zinc/62/98/74/337629874.db2.gz XDLIKHAKFGGGCA-GFCCVEGCSA-N 0 0 314.335 5.009 20 0 DKADRN COc1ccc([C@H](C)[NH2+][C@@H](CC(F)(F)F)c2ccccc2)cc1 ZINC000321526267 337274323 /nfs/dbraw/zinc/27/43/23/337274323.db2.gz OWRNVLZKEUIIDO-GUYCJALGSA-N 0 0 323.358 5.040 20 0 DKADRN COc1ccc([C@H](C)[NH2+][C@H](CC(F)(F)F)c2ccccc2)cc1 ZINC000321526285 337274393 /nfs/dbraw/zinc/27/43/93/337274393.db2.gz OWRNVLZKEUIIDO-SUMWQHHRSA-N 0 0 323.358 5.040 20 0 DKADRN Cc1cc(N2CCCC2)ccc1N[C@@H](C)c1cc(F)cc(F)c1 ZINC000321551871 337276221 /nfs/dbraw/zinc/27/62/21/337276221.db2.gz WFZRKCLBFJOTEQ-AWEZNQCLSA-N 0 0 316.395 5.047 20 0 DKADRN Cc1cc(N2CCCC2)ccc1N[C@H](C)c1cc(F)cc(F)c1 ZINC000321551872 337276142 /nfs/dbraw/zinc/27/61/42/337276142.db2.gz WFZRKCLBFJOTEQ-CQSZACIVSA-N 0 0 316.395 5.047 20 0 DKADRN Cc1ccc2cccc(N[C@H](C)c3cnc4ccsc4c3)c2n1 ZINC000321583103 337277939 /nfs/dbraw/zinc/27/79/39/337277939.db2.gz DCTMUYIHYUBNGB-CYBMUJFWSA-N 0 0 319.433 5.326 20 0 DKADRN Cc1ccc2cccc(N[C@@H](C)c3cnc4ccsc4c3)c2n1 ZINC000321583105 337277959 /nfs/dbraw/zinc/27/79/59/337277959.db2.gz DCTMUYIHYUBNGB-ZDUSSCGKSA-N 0 0 319.433 5.326 20 0 DKADRN COc1ccc([C@H](C)[NH2+][C@H](C)c2ccccc2C(F)(F)F)cc1 ZINC000321599861 337278402 /nfs/dbraw/zinc/27/84/02/337278402.db2.gz PXMBZIIRMGEIPR-QWHCGFSZSA-N 0 0 323.358 5.126 20 0 DKADRN COc1ccc([C@H](C)[NH2+][C@@H](C)c2ccccc2C(F)(F)F)cc1 ZINC000321599867 337278378 /nfs/dbraw/zinc/27/83/78/337278378.db2.gz PXMBZIIRMGEIPR-STQMWFEESA-N 0 0 323.358 5.126 20 0 DKADRN C[C@@H](Nc1ccc(-c2cnco2)cc1)c1cc2ccccc2o1 ZINC000321611241 337279645 /nfs/dbraw/zinc/27/96/45/337279645.db2.gz LVPSNBLNOVDAAX-CYBMUJFWSA-N 0 0 304.349 5.261 20 0 DKADRN C[C@H](Nc1ccc(-c2cnco2)cc1)c1cc2ccccc2o1 ZINC000321611243 337279594 /nfs/dbraw/zinc/27/95/94/337279594.db2.gz LVPSNBLNOVDAAX-ZDUSSCGKSA-N 0 0 304.349 5.261 20 0 DKADRN Cc1csc([C@H](C)N[C@H](C)c2ccc(-c3ccccc3)cc2)n1 ZINC000321636397 337281290 /nfs/dbraw/zinc/28/12/90/337281290.db2.gz PXGKFVNHCCVGND-CVEARBPZSA-N 0 0 322.477 5.530 20 0 DKADRN Cc1csc([C@H](C)N[C@@H](C)c2ccc(-c3ccccc3)cc2)n1 ZINC000321636399 337281262 /nfs/dbraw/zinc/28/12/62/337281262.db2.gz PXGKFVNHCCVGND-HOTGVXAUSA-N 0 0 322.477 5.530 20 0 DKADRN Cc1csc([C@@H](C)N[C@H](C)c2ccc(-c3ccccc3)cc2)n1 ZINC000321636402 337281226 /nfs/dbraw/zinc/28/12/26/337281226.db2.gz PXGKFVNHCCVGND-HZPDHXFCSA-N 0 0 322.477 5.530 20 0 DKADRN Cc1csc([C@@H](C)N[C@@H](C)c2ccc(-c3ccccc3)cc2)n1 ZINC000321636404 337281245 /nfs/dbraw/zinc/28/12/45/337281245.db2.gz PXGKFVNHCCVGND-JKSUJKDBSA-N 0 0 322.477 5.530 20 0 DKADRN FC(F)c1cccc(CNc2ccccc2N2CCCCC2)c1 ZINC000321701079 337284747 /nfs/dbraw/zinc/28/47/47/337284747.db2.gz BGFIHNCGTHWOBD-UHFFFAOYSA-N 0 0 316.395 5.227 20 0 DKADRN FC(F)c1ccc(CNc2ccccc2N2CCCCC2)cc1 ZINC000321733122 337287261 /nfs/dbraw/zinc/28/72/61/337287261.db2.gz ILJAJHXNZFBCCF-UHFFFAOYSA-N 0 0 316.395 5.227 20 0 DKADRN COc1cccc([C@@H](C)[NH2+][C@H](C)c2ccc(C(F)(F)F)cc2)c1 ZINC000321817308 337294617 /nfs/dbraw/zinc/29/46/17/337294617.db2.gz NHDVOIBUCVACMP-CHWSQXEVSA-N 0 0 323.358 5.126 20 0 DKADRN COc1cccc([C@@H](C)[NH2+][C@@H](C)c2ccc(C(F)(F)F)cc2)c1 ZINC000321817314 337294621 /nfs/dbraw/zinc/29/46/21/337294621.db2.gz NHDVOIBUCVACMP-QWHCGFSZSA-N 0 0 323.358 5.126 20 0 DKADRN CC[C@H](Nc1ccc2oc(C(C)C)nc2c1)c1ccc(F)cn1 ZINC000321979382 338151620 /nfs/dbraw/zinc/15/16/20/338151620.db2.gz IZIAXFPYGKXWOU-AWEZNQCLSA-N 0 0 313.376 5.049 20 0 DKADRN CC[C@@H](Nc1ccc2oc(C(C)C)nc2c1)c1ccc(F)cn1 ZINC000321979383 338152360 /nfs/dbraw/zinc/15/23/60/338152360.db2.gz IZIAXFPYGKXWOU-CQSZACIVSA-N 0 0 313.376 5.049 20 0 DKADRN CC[C@H](N[C@@H](c1ccco1)c1ccccc1)c1ccccc1F ZINC000321997889 337309293 /nfs/dbraw/zinc/30/92/93/337309293.db2.gz LUKQXKHTYFQYNF-AZUAARDMSA-N 0 0 309.384 5.249 20 0 DKADRN CC[C@H](N[C@H](c1ccco1)c1ccccc1)c1ccccc1F ZINC000321997890 337309285 /nfs/dbraw/zinc/30/92/85/337309285.db2.gz LUKQXKHTYFQYNF-ICSRJNTNSA-N 0 0 309.384 5.249 20 0 DKADRN CC[C@@H](N[C@H](c1ccco1)c1ccccc1)c1ccccc1F ZINC000321997891 337309288 /nfs/dbraw/zinc/30/92/88/337309288.db2.gz LUKQXKHTYFQYNF-QUCCMNQESA-N 0 0 309.384 5.249 20 0 DKADRN CC[C@@H](N[C@@H](c1ccco1)c1ccccc1)c1ccccc1F ZINC000321997892 337309301 /nfs/dbraw/zinc/30/93/01/337309301.db2.gz LUKQXKHTYFQYNF-UYAOXDASSA-N 0 0 309.384 5.249 20 0 DKADRN Cc1cc(N2CCCC2)ccc1NCc1ccc(C(F)F)cc1 ZINC000322000063 338305816 /nfs/dbraw/zinc/30/58/16/338305816.db2.gz XPDHSNXKHQODAG-UHFFFAOYSA-N 0 0 316.395 5.145 20 0 DKADRN CCC(=O)Nc1ccc(C)c(N[C@@H](CC)c2ccccc2F)c1 ZINC000322019570 337390566 /nfs/dbraw/zinc/39/05/66/337390566.db2.gz CIIYDZQFNQRKLS-KRWDZBQOSA-N 0 0 314.404 5.046 20 0 DKADRN CCC(=O)Nc1ccc(C)c(N[C@H](CC)c2ccccc2F)c1 ZINC000322019571 337390590 /nfs/dbraw/zinc/39/05/90/337390590.db2.gz CIIYDZQFNQRKLS-QGZVFWFLSA-N 0 0 314.404 5.046 20 0 DKADRN COc1ccc(C)cc1[C@H](C)Nc1cccc(-c2nccs2)c1 ZINC000322021446 337393933 /nfs/dbraw/zinc/39/39/33/337393933.db2.gz VFOYXTISEHHMDD-AWEZNQCLSA-N 0 0 324.449 5.300 20 0 DKADRN COc1ccc(C)cc1[C@@H](C)Nc1cccc(-c2nccs2)c1 ZINC000322021449 337394060 /nfs/dbraw/zinc/39/40/60/337394060.db2.gz VFOYXTISEHHMDD-CQSZACIVSA-N 0 0 324.449 5.300 20 0 DKADRN CCC(=O)Nc1ccc(N[C@@H]2CC[C@@H](C)c3ccccc32)cc1 ZINC000322025200 337460348 /nfs/dbraw/zinc/46/03/48/337460348.db2.gz DGIJCQQBAROYLC-AUUYWEPGSA-N 0 0 308.425 5.086 20 0 DKADRN CCC(=O)Nc1ccc(N[C@@H]2CC[C@H](C)c3ccccc32)cc1 ZINC000322025207 337460335 /nfs/dbraw/zinc/46/03/35/337460335.db2.gz DGIJCQQBAROYLC-IFXJQAMLSA-N 0 0 308.425 5.086 20 0 DKADRN CCC(=O)Nc1ccc(N[C@H]2CC[C@H](C)c3ccccc32)cc1 ZINC000322025216 337460363 /nfs/dbraw/zinc/46/03/63/337460363.db2.gz DGIJCQQBAROYLC-LIRRHRJNSA-N 0 0 308.425 5.086 20 0 DKADRN CCc1nc2cc(N[C@H](C)c3cnc4ccsc4c3)ccc2o1 ZINC000322052545 337461548 /nfs/dbraw/zinc/46/15/48/337461548.db2.gz XIGVFJJFWNBVFD-LLVKDONJSA-N 0 0 323.421 5.173 20 0 DKADRN Cc1cc(C)cc([C@H](C)Nc2cccc(NC(=O)C(C)C)c2)c1 ZINC000322053214 337461560 /nfs/dbraw/zinc/46/15/60/337461560.db2.gz KTJBPEXLXXGBKY-INIZCTEOSA-N 0 0 310.441 5.071 20 0 DKADRN Cc1cc(C)cc([C@@H](C)Nc2cccc(NC(=O)C(C)C)c2)c1 ZINC000322053217 337461552 /nfs/dbraw/zinc/46/15/52/337461552.db2.gz KTJBPEXLXXGBKY-MRXNPFEDSA-N 0 0 310.441 5.071 20 0 DKADRN CCOc1ccc(OCC)c(NCc2cccc(C(F)F)c2)c1 ZINC000322094660 337462935 /nfs/dbraw/zinc/46/29/35/337462935.db2.gz RGGUYMFXRIKLAA-UHFFFAOYSA-N 0 0 321.367 5.034 20 0 DKADRN Cc1cc(C)cc([C@@H](C)N[C@@H](c2ccco2)c2ccccc2)c1 ZINC000322111451 337463658 /nfs/dbraw/zinc/46/36/58/337463658.db2.gz UYIVVHUGSKZHJE-DYESRHJHSA-N 0 0 305.421 5.337 20 0 DKADRN Cc1cc(C)cc([C@H](C)N[C@@H](c2ccco2)c2ccccc2)c1 ZINC000322111454 337463733 /nfs/dbraw/zinc/46/37/33/337463733.db2.gz UYIVVHUGSKZHJE-LAUBAEHRSA-N 0 0 305.421 5.337 20 0 DKADRN Cc1cc(C)cc([C@H](C)Nc2ccc(NC(=O)C(C)C)cc2)c1 ZINC000322115636 337465644 /nfs/dbraw/zinc/46/56/44/337465644.db2.gz VTVKVDKFMZJWCY-INIZCTEOSA-N 0 0 310.441 5.071 20 0 DKADRN CCOc1ccc([C@H](C)Nc2cccc(-c3nccs3)c2)cc1 ZINC000322116451 337465643 /nfs/dbraw/zinc/46/56/43/337465643.db2.gz QFFPUSXDQTZYDI-AWEZNQCLSA-N 0 0 324.449 5.382 20 0 DKADRN Cc1nc(-c2cccc(NCc3cccc4cc[nH]c43)c2)cs1 ZINC000322524099 340705020 /nfs/dbraw/zinc/70/50/20/340705020.db2.gz NAVAORZMSZZCPD-UHFFFAOYSA-N 0 0 319.433 5.212 20 0 DKADRN Cc1cc(F)ccc1C(=O)Nc1ccccc1-c1ccccc1 ZINC000322578718 340705283 /nfs/dbraw/zinc/70/52/83/340705283.db2.gz UGUZJBUDCKCSCL-UHFFFAOYSA-N 0 0 305.352 5.053 20 0 DKADRN Cc1cc(C)c(NC(=O)c2ccc(F)c3ccccc23)c(C)c1 ZINC000322626656 340705537 /nfs/dbraw/zinc/70/55/37/340705537.db2.gz PMDKDHCIDXYHHA-UHFFFAOYSA-N 0 0 307.368 5.156 20 0 DKADRN CCc1cccc(C)c1NC(=O)c1ccc(F)c2ccccc12 ZINC000322630606 340705544 /nfs/dbraw/zinc/70/55/44/340705544.db2.gz QUHUJSMHTAXGSZ-UHFFFAOYSA-N 0 0 307.368 5.102 20 0 DKADRN Cc1cc(N2CCCC2)ccc1N[C@@H](C)c1cccc(F)c1F ZINC000322813483 340706295 /nfs/dbraw/zinc/70/62/95/340706295.db2.gz UXFTYJSKMNDZDC-AWEZNQCLSA-N 0 0 316.395 5.047 20 0 DKADRN Cc1cc(N2CCCC2)ccc1N[C@H](C)c1cccc(F)c1F ZINC000322813484 340706353 /nfs/dbraw/zinc/70/63/53/340706353.db2.gz UXFTYJSKMNDZDC-CQSZACIVSA-N 0 0 316.395 5.047 20 0 DKADRN Oc1ccc2c(c1)[C@H](Nc1cccc(-c3nccs3)c1)CCC2 ZINC000322816702 340706365 /nfs/dbraw/zinc/70/63/65/340706365.db2.gz VPQXURUQRWXMRW-GOSISDBHSA-N 0 0 322.433 5.005 20 0 DKADRN Oc1ccc2c(c1)[C@@H](Nc1cccc(-c3nccs3)c1)CCC2 ZINC000322816703 340706321 /nfs/dbraw/zinc/70/63/21/340706321.db2.gz VPQXURUQRWXMRW-SFHVURJKSA-N 0 0 322.433 5.005 20 0 DKADRN CCC(=O)Nc1ccc(C)c(N[C@@H](CC)c2cccc(F)c2)c1 ZINC000323355574 333024315 /nfs/dbraw/zinc/02/43/15/333024315.db2.gz AREMEMLSIDLSBO-KRWDZBQOSA-N 0 0 314.404 5.046 20 0 DKADRN CCC(=O)Nc1ccc(C)c(N[C@H](CC)c2cccc(F)c2)c1 ZINC000323355583 333024332 /nfs/dbraw/zinc/02/43/32/333024332.db2.gz AREMEMLSIDLSBO-QGZVFWFLSA-N 0 0 314.404 5.046 20 0 DKADRN CCC(=O)Nc1ccc(C)c(N[C@H](CC)c2cccc(C)c2)c1 ZINC000323510000 333360010 /nfs/dbraw/zinc/36/00/10/333360010.db2.gz BBFGQDRNTKEHOO-GOSISDBHSA-N 0 0 310.441 5.215 20 0 DKADRN CCC(=O)Nc1ccc(C)c(N[C@@H](CC)c2cccc(C)c2)c1 ZINC000323510002 333360024 /nfs/dbraw/zinc/36/00/24/333360024.db2.gz BBFGQDRNTKEHOO-SFHVURJKSA-N 0 0 310.441 5.215 20 0 DKADRN c1cc2c(ccnc2NC(c2ccccc2)c2ccccc2)o1 ZINC000323737785 334268806 /nfs/dbraw/zinc/26/88/06/334268806.db2.gz RTGNGKTZQIEMHB-UHFFFAOYSA-N 0 0 300.361 5.029 20 0 DKADRN CC[C@H](Nc1ccc(NC(=O)C(C)C)cc1)c1cccc(C)c1 ZINC000323758643 334351253 /nfs/dbraw/zinc/35/12/53/334351253.db2.gz UWEMYRXOWYGWFR-IBGZPJMESA-N 0 0 310.441 5.153 20 0 DKADRN CC[C@@H](Nc1ccc(NC(=O)C(C)C)cc1)c1cccc(C)c1 ZINC000323758645 334351213 /nfs/dbraw/zinc/35/12/13/334351213.db2.gz UWEMYRXOWYGWFR-LJQANCHMSA-N 0 0 310.441 5.153 20 0 DKADRN CC[C@H](Nc1cccc(NC(=O)C(C)C)c1)c1cccc(C)c1 ZINC000323792096 335585326 /nfs/dbraw/zinc/58/53/26/335585326.db2.gz GWPSELRLKOQKAY-IBGZPJMESA-N 0 0 310.441 5.153 20 0 DKADRN CC[C@@H](Nc1cccc(NC(=O)C(C)C)c1)c1cccc(C)c1 ZINC000323792097 335585460 /nfs/dbraw/zinc/58/54/60/335585460.db2.gz GWPSELRLKOQKAY-LJQANCHMSA-N 0 0 310.441 5.153 20 0 DKADRN COc1ccc2cc([C@H](C)Nc3ccc4[nH]ccc4c3)ccc2c1 ZINC000323858596 335644458 /nfs/dbraw/zinc/64/44/58/335644458.db2.gz OFWCZHRCLSJAEL-AWEZNQCLSA-N 0 0 316.404 5.503 20 0 DKADRN CC(C)C[C@H](Nc1cccc(NC(=O)C2CC2)c1)c1ccccc1 ZINC000323869327 335645888 /nfs/dbraw/zinc/64/58/88/335645888.db2.gz RDOPHYRZRBYKCX-FQEVSTJZSA-N 0 0 322.452 5.234 20 0 DKADRN CC(C)C[C@@H](Nc1cccc(NC(=O)C2CC2)c1)c1ccccc1 ZINC000323869330 335646076 /nfs/dbraw/zinc/64/60/76/335646076.db2.gz RDOPHYRZRBYKCX-HXUWFJFHSA-N 0 0 322.452 5.234 20 0 DKADRN CCc1ccc(N[C@@H](c2ccccc2)c2ccccn2)cc1C ZINC000324224703 336112817 /nfs/dbraw/zinc/11/28/17/336112817.db2.gz ZLXQBTSQFLVDLB-NRFANRHFSA-N 0 0 302.421 5.154 20 0 DKADRN CCc1ccc(N[C@H](c2ccccc2)c2ccccn2)cc1C ZINC000324224704 336112672 /nfs/dbraw/zinc/11/26/72/336112672.db2.gz ZLXQBTSQFLVDLB-OAQYLSRUSA-N 0 0 302.421 5.154 20 0 DKADRN CC(=O)Nc1ccc(C)c(N[C@@H](C)c2ccc(C(C)(C)C)cc2)c1 ZINC000324240502 336116643 /nfs/dbraw/zinc/11/66/43/336116643.db2.gz XTYARASWTYLFKI-HNNXBMFYSA-N 0 0 324.468 5.424 20 0 DKADRN CC(=O)Nc1ccc(C)c(N[C@H](C)c2ccc(C(C)(C)C)cc2)c1 ZINC000324240504 336116619 /nfs/dbraw/zinc/11/66/19/336116619.db2.gz XTYARASWTYLFKI-OAHLLOKOSA-N 0 0 324.468 5.424 20 0 DKADRN CC(=O)Nc1cc(N[C@@H](C)c2ccc(CC(C)C)cc2)ccc1C ZINC000324294172 336131893 /nfs/dbraw/zinc/13/18/93/336131893.db2.gz NTXGZZAXMLIWPJ-INIZCTEOSA-N 0 0 324.468 5.325 20 0 DKADRN CC(=O)Nc1cc(N[C@H](C)c2ccc(CC(C)C)cc2)ccc1C ZINC000324294173 336132016 /nfs/dbraw/zinc/13/20/16/336132016.db2.gz NTXGZZAXMLIWPJ-MRXNPFEDSA-N 0 0 324.468 5.325 20 0 DKADRN COc1cc(C)ccc1[C@H](C)N[C@@H](c1ccco1)c1ccccc1 ZINC000324346619 341706859 /nfs/dbraw/zinc/70/68/59/341706859.db2.gz DLKQKVKAGAQCPB-HRAATJIYSA-N 0 0 321.420 5.037 20 0 DKADRN CCCc1ccccc1NC(=O)CCCc1c[nH]c2ccccc12 ZINC000324452733 336221136 /nfs/dbraw/zinc/22/11/36/336221136.db2.gz DYICBFBYOSSFNK-UHFFFAOYSA-N 0 0 320.436 5.082 20 0 DKADRN Cc1ccc([C@H](Nc2ccc(NC(=O)C(C)C)cc2)C2CC2)cc1 ZINC000324499454 336223123 /nfs/dbraw/zinc/22/31/23/336223123.db2.gz QOUMQMJLRKHQKU-FQEVSTJZSA-N 0 0 322.452 5.153 20 0 DKADRN Cc1ccc([C@@H](Nc2ccc(NC(=O)C(C)C)cc2)C2CC2)cc1 ZINC000324499455 336222977 /nfs/dbraw/zinc/22/29/77/336222977.db2.gz QOUMQMJLRKHQKU-HXUWFJFHSA-N 0 0 322.452 5.153 20 0 DKADRN COCCOc1cccc(N[C@H](C)c2cccc3ccccc32)c1 ZINC000324519930 341707540 /nfs/dbraw/zinc/70/75/40/341707540.db2.gz WQFPZSNBIPINRN-MRXNPFEDSA-N 0 0 321.420 5.038 20 0 DKADRN Cc1ccc([C@H](C)N[C@@H](c2ccccc2)c2ccccn2)c(C)c1 ZINC000324526624 336225435 /nfs/dbraw/zinc/22/54/35/336225435.db2.gz YJLJLLDQZYSELI-AVRDEDQJSA-N 0 0 316.448 5.139 20 0 DKADRN Cc1ccc([C@@H](C)N[C@@H](c2ccccc2)c2ccccn2)c(C)c1 ZINC000324526625 336225438 /nfs/dbraw/zinc/22/54/38/336225438.db2.gz YJLJLLDQZYSELI-GCJKJVERSA-N 0 0 316.448 5.139 20 0 DKADRN Cc1ccc([C@H](C)N[C@H](c2ccccc2)c2ccccn2)c(C)c1 ZINC000324526626 336225418 /nfs/dbraw/zinc/22/54/18/336225418.db2.gz YJLJLLDQZYSELI-PGRDOPGGSA-N 0 0 316.448 5.139 20 0 DKADRN Cc1ccc([C@@H](C)N[C@H](c2ccccc2)c2ccccn2)c(C)c1 ZINC000324526627 336225408 /nfs/dbraw/zinc/22/54/08/336225408.db2.gz YJLJLLDQZYSELI-XMSQKQJNSA-N 0 0 316.448 5.139 20 0 DKADRN CCC(=O)Nc1ccc(C)c(N[C@@H]2C[C@@H](C)c3ccccc32)c1 ZINC000324569485 336229517 /nfs/dbraw/zinc/22/95/17/336229517.db2.gz UXBWTXJYEDEWSJ-AUUYWEPGSA-N 0 0 308.425 5.004 20 0 DKADRN CCC(=O)Nc1ccc(C)c(N[C@@H]2C[C@H](C)c3ccccc32)c1 ZINC000324569486 336229500 /nfs/dbraw/zinc/22/95/00/336229500.db2.gz UXBWTXJYEDEWSJ-IFXJQAMLSA-N 0 0 308.425 5.004 20 0 DKADRN CCC(=O)Nc1ccc(C)c(N[C@H]2C[C@@H](C)c3ccccc32)c1 ZINC000324569487 336229479 /nfs/dbraw/zinc/22/94/79/336229479.db2.gz UXBWTXJYEDEWSJ-KUHUBIRLSA-N 0 0 308.425 5.004 20 0 DKADRN CCC(=O)Nc1ccc(C)c(N[C@H]2C[C@H](C)c3ccccc32)c1 ZINC000324569488 336229444 /nfs/dbraw/zinc/22/94/44/336229444.db2.gz UXBWTXJYEDEWSJ-LIRRHRJNSA-N 0 0 308.425 5.004 20 0 DKADRN CC(=O)Nc1ccc(C)c(N[C@@H](C)c2ccc3ccccc3c2)c1 ZINC000324607593 336231910 /nfs/dbraw/zinc/23/19/10/336231910.db2.gz JKDZFZJWOBOBLH-HNNXBMFYSA-N 0 0 318.420 5.280 20 0 DKADRN CC(=O)Nc1ccc(C)c(N[C@H](C)c2ccc3ccccc3c2)c1 ZINC000324607594 336231951 /nfs/dbraw/zinc/23/19/51/336231951.db2.gz JKDZFZJWOBOBLH-OAHLLOKOSA-N 0 0 318.420 5.280 20 0 DKADRN Cc1ccc([C@H](Nc2cccc(NC(=O)C(C)C)c2)C2CC2)cc1 ZINC000324641822 336238174 /nfs/dbraw/zinc/23/81/74/336238174.db2.gz UTUVIGKXQKLCSG-FQEVSTJZSA-N 0 0 322.452 5.153 20 0 DKADRN Cc1ccc([C@@H](Nc2cccc(NC(=O)C(C)C)c2)C2CC2)cc1 ZINC000324641823 336238261 /nfs/dbraw/zinc/23/82/61/336238261.db2.gz UTUVIGKXQKLCSG-HXUWFJFHSA-N 0 0 322.452 5.153 20 0 DKADRN CCC(=O)Nc1ccc(C)c(NCc2ccc(C(C)(C)C)cc2)c1 ZINC000324764586 336257897 /nfs/dbraw/zinc/25/78/97/336257897.db2.gz AQWXHNAQKGVJGD-UHFFFAOYSA-N 0 0 324.468 5.253 20 0 DKADRN CCc1ccc([C@H]([NH2+]Cc2ccc3ncccc3c2)C(C)C)cc1 ZINC000324816675 336260140 /nfs/dbraw/zinc/26/01/40/336260140.db2.gz QXWDAPIUVUKSOP-JOCHJYFZSA-N 0 0 318.464 5.284 20 0 DKADRN CCc1ccc([C@@H]([NH2+]Cc2ccc3ncccc3c2)C(C)C)cc1 ZINC000324816676 336260112 /nfs/dbraw/zinc/26/01/12/336260112.db2.gz QXWDAPIUVUKSOP-QFIPXVFZSA-N 0 0 318.464 5.284 20 0 DKADRN CCCOc1cccc(N[C@@H](c2ccccc2)c2ccccn2)c1 ZINC000324839575 336262975 /nfs/dbraw/zinc/26/29/75/336262975.db2.gz DSLBRLQNQFHCFR-NRFANRHFSA-N 0 0 318.420 5.072 20 0 DKADRN CCCOc1cccc(N[C@H](c2ccccc2)c2ccccn2)c1 ZINC000324839577 336263021 /nfs/dbraw/zinc/26/30/21/336263021.db2.gz DSLBRLQNQFHCFR-OAQYLSRUSA-N 0 0 318.420 5.072 20 0 DKADRN CC(C)C(=O)Nc1cccc(N[C@H]2CCCCc3ccccc32)c1 ZINC000324858736 336266392 /nfs/dbraw/zinc/26/63/92/336266392.db2.gz MBCUZAZEJUQLCC-FQEVSTJZSA-N 0 0 322.452 5.161 20 0 DKADRN CC(C)C(=O)Nc1cccc(N[C@@H]2CCCCc3ccccc32)c1 ZINC000324858738 336266650 /nfs/dbraw/zinc/26/66/50/336266650.db2.gz MBCUZAZEJUQLCC-HXUWFJFHSA-N 0 0 322.452 5.161 20 0 DKADRN C[C@H](N[C@H](c1ccco1)c1ccccc1)c1cc2ccccc2o1 ZINC000324863074 336267131 /nfs/dbraw/zinc/26/71/31/336267131.db2.gz OHFRFESSUGCKRL-BTYIYWSLSA-N 0 0 317.388 5.466 20 0 DKADRN C[C@@H](N[C@@H](c1ccco1)c1ccccc1)c1cc2ccccc2o1 ZINC000324863077 336267105 /nfs/dbraw/zinc/26/71/05/336267105.db2.gz OHFRFESSUGCKRL-QVKFZJNVSA-N 0 0 317.388 5.466 20 0 DKADRN C[C@@H](N[C@H](c1ccco1)c1ccccc1)c1cc2ccccc2o1 ZINC000324863080 336267030 /nfs/dbraw/zinc/26/70/30/336267030.db2.gz OHFRFESSUGCKRL-VFNWGFHPSA-N 0 0 317.388 5.466 20 0 DKADRN C[C@H](N[C@@H](c1ccco1)c1ccccc1)c1cc2ccccc2o1 ZINC000324863084 336267096 /nfs/dbraw/zinc/26/70/96/336267096.db2.gz OHFRFESSUGCKRL-YCRPNKLZSA-N 0 0 317.388 5.466 20 0 DKADRN CCC(=O)Nc1ccc(N[C@@H](C)c2ccc(C(C)(C)C)cc2)cc1 ZINC000324900067 336272269 /nfs/dbraw/zinc/27/22/69/336272269.db2.gz PSUBNGWAHYFFEW-HNNXBMFYSA-N 0 0 324.468 5.506 20 0 DKADRN CCC(=O)Nc1ccc(N[C@H](C)c2ccc(C(C)(C)C)cc2)cc1 ZINC000324900068 336272262 /nfs/dbraw/zinc/27/22/62/336272262.db2.gz PSUBNGWAHYFFEW-OAHLLOKOSA-N 0 0 324.468 5.506 20 0 DKADRN CC(C)c1ccc(NC(=O)c2ccc3[nH]ccc3c2)c(C(C)C)c1 ZINC000324907918 336272885 /nfs/dbraw/zinc/27/28/85/336272885.db2.gz IRVSKCJPBORQNV-UHFFFAOYSA-N 0 0 320.436 5.667 20 0 DKADRN CCc1ccc([C@H](C)N[C@H](c2ccccc2)c2ccccn2)cc1 ZINC000324912546 336274276 /nfs/dbraw/zinc/27/42/76/336274276.db2.gz XPVFKENLLBHDOH-HTAPYJJXSA-N 0 0 316.448 5.084 20 0 DKADRN CCc1ccc([C@H](C)N[C@@H](c2ccccc2)c2ccccn2)cc1 ZINC000324912547 336274359 /nfs/dbraw/zinc/27/43/59/336274359.db2.gz XPVFKENLLBHDOH-JTSKRJEESA-N 0 0 316.448 5.084 20 0 DKADRN CCc1ccc([C@@H](C)N[C@H](c2ccccc2)c2ccccn2)cc1 ZINC000324912548 336274308 /nfs/dbraw/zinc/27/43/08/336274308.db2.gz XPVFKENLLBHDOH-VGOFRKELSA-N 0 0 316.448 5.084 20 0 DKADRN CCc1ccc([C@@H](C)N[C@@H](c2ccccc2)c2ccccn2)cc1 ZINC000324912549 336274356 /nfs/dbraw/zinc/27/43/56/336274356.db2.gz XPVFKENLLBHDOH-VGSWGCGISA-N 0 0 316.448 5.084 20 0 DKADRN CC(C)C(=O)Nc1cccc(NCc2ccc(C(C)(C)C)cc2)c1 ZINC000324912591 336274299 /nfs/dbraw/zinc/27/42/99/336274299.db2.gz XRWGMZIKVNVWSB-UHFFFAOYSA-N 0 0 324.468 5.191 20 0 DKADRN CCC(=O)Nc1ccc(C)c(N[C@@H](C)c2ccc3c(c2)CCC3)c1 ZINC000324916335 336273625 /nfs/dbraw/zinc/27/36/25/336273625.db2.gz YNQSCCVYNKSTJO-HNNXBMFYSA-N 0 0 322.452 5.005 20 0 DKADRN CCC(=O)Nc1ccc(C)c(N[C@H](C)c2ccc3c(c2)CCC3)c1 ZINC000324916337 336273659 /nfs/dbraw/zinc/27/36/59/336273659.db2.gz YNQSCCVYNKSTJO-OAHLLOKOSA-N 0 0 322.452 5.005 20 0 DKADRN Fc1ccc(-c2ccc(C[NH2+][C@@H](c3ccccc3)C3CC3)o2)cc1 ZINC000324917456 336273724 /nfs/dbraw/zinc/27/37/24/336273724.db2.gz TXCYFCUXXIJEHR-NRFANRHFSA-N 0 0 321.395 5.327 20 0 DKADRN Fc1ccc(-c2ccc(C[NH2+][C@H](c3ccccc3)C3CC3)o2)cc1 ZINC000324917457 336273793 /nfs/dbraw/zinc/27/37/93/336273793.db2.gz TXCYFCUXXIJEHR-OAQYLSRUSA-N 0 0 321.395 5.327 20 0 DKADRN CC(C)C(=O)Nc1ccc(N[C@@H](C)c2cc3ccccc3o2)cc1 ZINC000324919060 336273835 /nfs/dbraw/zinc/27/38/35/336273835.db2.gz ZARQDKSEYIRPJQ-AWEZNQCLSA-N 0 0 322.408 5.200 20 0 DKADRN CC(C)C(=O)Nc1ccc(N[C@H](C)c2cc3ccccc3o2)cc1 ZINC000324919061 336273736 /nfs/dbraw/zinc/27/37/36/336273736.db2.gz ZARQDKSEYIRPJQ-CQSZACIVSA-N 0 0 322.408 5.200 20 0 DKADRN CC(=O)Nc1cc(N[C@H]2CCC(C)(C)c3ccccc32)ccc1C ZINC000324934134 336275158 /nfs/dbraw/zinc/27/51/58/336275158.db2.gz YHMYNXDYXCLXLJ-IBGZPJMESA-N 0 0 322.452 5.178 20 0 DKADRN CC(=O)Nc1cc(N[C@@H]2CCC(C)(C)c3ccccc32)ccc1C ZINC000324934138 336275169 /nfs/dbraw/zinc/27/51/69/336275169.db2.gz YHMYNXDYXCLXLJ-LJQANCHMSA-N 0 0 322.452 5.178 20 0 DKADRN CCC(=O)Nc1ccc(C)c(N[C@@H](C)c2cc3ccccc3o2)c1 ZINC000325047425 336277684 /nfs/dbraw/zinc/27/76/84/336277684.db2.gz OONUYPMBSTVTET-AWEZNQCLSA-N 0 0 322.408 5.263 20 0 DKADRN CCC(=O)Nc1ccc(C)c(N[C@H](C)c2cc3ccccc3o2)c1 ZINC000325047426 336277675 /nfs/dbraw/zinc/27/76/75/336277675.db2.gz OONUYPMBSTVTET-CQSZACIVSA-N 0 0 322.408 5.263 20 0 DKADRN CC(C)C(=O)Nc1ccc(N[C@H]2CCCCc3ccccc32)cc1 ZINC000325113467 336279313 /nfs/dbraw/zinc/27/93/13/336279313.db2.gz JBGCDAWWWUHBQU-FQEVSTJZSA-N 0 0 322.452 5.161 20 0 DKADRN CC(C)C(=O)Nc1ccc(N[C@@H]2CCCCc3ccccc32)cc1 ZINC000325113468 336279310 /nfs/dbraw/zinc/27/93/10/336279310.db2.gz JBGCDAWWWUHBQU-HXUWFJFHSA-N 0 0 322.452 5.161 20 0 DKADRN CC(C)c1ccc(NC(=O)c2cccc3cc[nH]c32)c(C(C)C)c1 ZINC000325164322 336280234 /nfs/dbraw/zinc/28/02/34/336280234.db2.gz JKYBUKPWJOTKMT-UHFFFAOYSA-N 0 0 320.436 5.667 20 0 DKADRN Cc1oc2ccccc2c1CN[C@H](c1ccco1)c1ccccc1 ZINC000325225106 336281618 /nfs/dbraw/zinc/28/16/18/336281618.db2.gz CQTSCKIAJCOYQR-NRFANRHFSA-N 0 0 317.388 5.213 20 0 DKADRN Cc1oc2ccccc2c1CN[C@@H](c1ccco1)c1ccccc1 ZINC000325225107 336281603 /nfs/dbraw/zinc/28/16/03/336281603.db2.gz CQTSCKIAJCOYQR-OAQYLSRUSA-N 0 0 317.388 5.213 20 0 DKADRN CC(C)C(=O)Nc1ccc(N[C@H]2CC[C@H](C)c3ccccc32)cc1 ZINC000325556492 337733674 /nfs/dbraw/zinc/73/36/74/337733674.db2.gz WCVAHAMZFBEZIJ-YWZLYKJASA-N 0 0 322.452 5.332 20 0 DKADRN CCc1cccc(CC)c1NC(=O)c1ccc(F)c2ccccc12 ZINC000326259189 340713755 /nfs/dbraw/zinc/71/37/55/340713755.db2.gz FBIAHHJNXAVNQP-UHFFFAOYSA-N 0 0 321.395 5.356 20 0 DKADRN c1ccc(C[C@@H](Nc2ccc3c(c2)COC3)c2ccccc2)cc1 ZINC000326503303 340715130 /nfs/dbraw/zinc/71/51/30/340715130.db2.gz LICVSEUFPRIUPA-JOCHJYFZSA-N 0 0 315.416 5.113 20 0 DKADRN CC[C@@H](Nc1cccc(C(=O)N(CC)CC)c1)c1cccc(C)c1 ZINC000326715577 331601803 /nfs/dbraw/zinc/60/18/03/331601803.db2.gz XXYYORRPWDVUCC-HXUWFJFHSA-N 0 0 324.468 5.040 20 0 DKADRN Cc1cc(-c2csc(-c3c(Cl)cccc3Cl)n2)on1 ZINC000328591260 231234844 /nfs/dbraw/zinc/23/48/44/231234844.db2.gz OIDLLAKPZFTLIE-UHFFFAOYSA-N 0 0 311.193 5.080 20 0 DKADRN Cc1oc(C(C)C)cc1C(=O)Nc1cc(C(C)C)c(O)cc1C ZINC000330597124 334793869 /nfs/dbraw/zinc/79/38/69/334793869.db2.gz ADVAZLSMNLBAEX-UHFFFAOYSA-N 0 0 315.413 5.101 20 0 DKADRN Cc1cccc(C(C)C)c1NC(=O)c1coc(C2CCCC2)n1 ZINC000331969569 336154729 /nfs/dbraw/zinc/15/47/29/336154729.db2.gz UJVOXRMOVMUMML-UHFFFAOYSA-N 0 0 312.413 5.016 20 0 DKADRN CC(C)(C)C[C@H](NC(=O)c1ccoc1C1CC1)c1ccccc1 ZINC000336882777 518690126 /nfs/dbraw/zinc/69/01/26/518690126.db2.gz FTURIGUNSBFKSU-KRWDZBQOSA-N 0 0 311.425 5.064 20 0 DKADRN CC(C)(C)C[C@@H](NC(=O)c1ccoc1C1CC1)c1ccccc1 ZINC000336882778 518678579 /nfs/dbraw/zinc/67/85/79/518678579.db2.gz FTURIGUNSBFKSU-QGZVFWFLSA-N 0 0 311.425 5.064 20 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/nfs/dbraw/zinc/09/96/32/332099632.db2.gz HPCWANVKRUFBQW-GOSISDBHSA-N 0 0 314.473 5.340 20 0 DKADRN CC(C)c1cccc(C(C)C)c1NC(=O)N1CCC[C@H]1C1CC1 ZINC000363474286 332099528 /nfs/dbraw/zinc/09/95/28/332099528.db2.gz HPCWANVKRUFBQW-SFHVURJKSA-N 0 0 314.473 5.340 20 0 DKADRN CC(C)c1cccc(C(C)C)c1NC(=O)N1CC2(C1)CCCC2 ZINC000363754791 332240005 /nfs/dbraw/zinc/24/00/05/332240005.db2.gz ZONIEKYHVJRUGI-UHFFFAOYSA-N 0 0 314.473 5.341 20 0 DKADRN CC(C)c1cccc(C(C)C)c1NC(=O)[C@@H]1C[C@H]1c1cccnc1 ZINC000364457755 519841250 /nfs/dbraw/zinc/84/12/50/519841250.db2.gz QYJLMTACCBRQGT-RBUKOAKNSA-N 0 0 322.452 5.071 20 0 DKADRN CCC[C@H](NCc1ncoc1-c1ccccc1)c1ccsc1 ZINC000364786716 521166089 /nfs/dbraw/zinc/16/60/89/521166089.db2.gz FXOCLFMRDNNYLB-INIZCTEOSA-N 0 0 312.438 5.034 20 0 DKADRN CCC[C@@H](NCc1ncoc1-c1ccccc1)c1ccsc1 ZINC000364786721 520785200 /nfs/dbraw/zinc/78/52/00/520785200.db2.gz FXOCLFMRDNNYLB-MRXNPFEDSA-N 0 0 312.438 5.034 20 0 DKADRN Cc1cccc(C(C)C)c1NC(=O)N1CC=C(c2ccccc2)C1 ZINC000364975267 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303.396 5.500 20 0 DKADRN CCc1ccc(Cl)c(CC)c1NC(=O)c1ccc(C)cc1F ZINC000387873813 333181945 /nfs/dbraw/zinc/18/19/45/333181945.db2.gz KNJQZKYFYIIRBR-UHFFFAOYSA-N 0 0 319.807 5.165 20 0 DKADRN Cc1nc(CNc2cccc(Oc3ccccc3)c2)sc1C ZINC000387936614 333185717 /nfs/dbraw/zinc/18/57/17/333185717.db2.gz CNQGPKWCITVXLN-UHFFFAOYSA-N 0 0 310.422 5.164 20 0 DKADRN Cc1ccsc1C[NH2+][C@@H](Cc1ccccc1)c1ccccc1 ZINC000388034874 333196409 /nfs/dbraw/zinc/19/64/09/333196409.db2.gz LOVRWFPESBDPEN-IBGZPJMESA-N 0 0 307.462 5.130 20 0 DKADRN Cc1ccsc1C[NH2+][C@H](Cc1ccccc1)c1ccccc1 ZINC000388034893 333196394 /nfs/dbraw/zinc/19/63/94/333196394.db2.gz LOVRWFPESBDPEN-LJQANCHMSA-N 0 0 307.462 5.130 20 0 DKADRN C[C@@H](Nc1cccc2ccncc21)c1cnc2ccsc2c1 ZINC000388094608 333203466 /nfs/dbraw/zinc/20/34/66/333203466.db2.gz UKDWYVSHEGCNOP-GFCCVEGCSA-N 0 0 305.406 5.018 20 0 DKADRN C[C@H](Nc1cccc2ccncc21)c1cnc2ccsc2c1 ZINC000388094609 333203380 /nfs/dbraw/zinc/20/33/80/333203380.db2.gz UKDWYVSHEGCNOP-LBPRGKRZSA-N 0 0 305.406 5.018 20 0 DKADRN Fc1cccc2c1SCC[C@@H]2Nc1cccc2ccncc21 ZINC000388102871 333204138 /nfs/dbraw/zinc/20/41/38/333204138.db2.gz VRCRVIACGWPJCB-KRWDZBQOSA-N 0 0 310.397 5.023 20 0 DKADRN Fc1cccc2c1SCC[C@H]2Nc1cccc2ccncc21 ZINC000388102881 333204129 /nfs/dbraw/zinc/20/41/29/333204129.db2.gz VRCRVIACGWPJCB-QGZVFWFLSA-N 0 0 310.397 5.023 20 0 DKADRN FC(F)c1cccc(CNc2ccccc2OC(F)(F)F)c1 ZINC000388179497 333217029 /nfs/dbraw/zinc/21/70/29/333217029.db2.gz MKIVDDUTAQAHMF-UHFFFAOYSA-N 0 0 317.257 5.135 20 0 DKADRN C[C@@H](Nc1cccc(-c2nccs2)c1)c1cc(F)cc(F)c1 ZINC000388224498 333227925 /nfs/dbraw/zinc/22/79/25/333227925.db2.gz XJRDBGSNVXMKOZ-LLVKDONJSA-N 0 0 316.376 5.261 20 0 DKADRN C[C@H](Nc1cccc(-c2nccs2)c1)c1cc(F)cc(F)c1 ZINC000388224504 333227914 /nfs/dbraw/zinc/22/79/14/333227914.db2.gz XJRDBGSNVXMKOZ-NSHDSACASA-N 0 0 316.376 5.261 20 0 DKADRN Cc1cc(N2CCCC2)ccc1N[C@@H](C)CCCC(F)(F)F ZINC000388295825 333256023 /nfs/dbraw/zinc/25/60/23/333256023.db2.gz AKDMXPNMNYWYGR-AWEZNQCLSA-N 0 0 314.395 5.128 20 0 DKADRN Cc1cc(N2CCCC2)ccc1N[C@H](C)CCCC(F)(F)F ZINC000388295826 333256014 /nfs/dbraw/zinc/25/60/14/333256014.db2.gz AKDMXPNMNYWYGR-CQSZACIVSA-N 0 0 314.395 5.128 20 0 DKADRN Cc1nc(C)c(CNc2ccc(Oc3ccccc3)cc2)s1 ZINC000388388674 333290651 /nfs/dbraw/zinc/29/06/51/333290651.db2.gz RNUWRDGUXGAGMS-UHFFFAOYSA-N 0 0 310.422 5.164 20 0 DKADRN FC(F)c1ccc(CNc2cccc(OC(F)(F)F)c2)cc1 ZINC000388409484 333299107 /nfs/dbraw/zinc/29/91/07/333299107.db2.gz OKTRQNPRMWCQNX-UHFFFAOYSA-N 0 0 317.257 5.135 20 0 DKADRN Fc1ccc2c(c1)CC[C@@H]2Nc1cccc(-c2nccs2)c1 ZINC000388563869 333358142 /nfs/dbraw/zinc/35/81/42/333358142.db2.gz LYTKKUUXKUTGME-KRWDZBQOSA-N 0 0 310.397 5.049 20 0 DKADRN Fc1ccc2c(c1)CC[C@H]2Nc1cccc(-c2nccs2)c1 ZINC000388563872 333358123 /nfs/dbraw/zinc/35/81/23/333358123.db2.gz LYTKKUUXKUTGME-QGZVFWFLSA-N 0 0 310.397 5.049 20 0 DKADRN Cc1cc(Cl)ccc1CN[C@H](c1ccco1)c1ccccc1 ZINC000389495544 336396719 /nfs/dbraw/zinc/39/67/19/336396719.db2.gz UDDZELNSHINFOH-IBGZPJMESA-N 0 0 311.812 5.121 20 0 DKADRN Cc1cc(Cl)ccc1CN[C@@H](c1ccco1)c1ccccc1 ZINC000389495548 336396744 /nfs/dbraw/zinc/39/67/44/336396744.db2.gz UDDZELNSHINFOH-LJQANCHMSA-N 0 0 311.812 5.121 20 0 DKADRN C[C@@H](N[C@@H](C)c1cccc(F)c1F)c1cc2ccccc2o1 ZINC000389616015 336876760 /nfs/dbraw/zinc/87/67/60/336876760.db2.gz ZJCJQKVJEGXPID-NWDGAFQWSA-N 0 0 301.336 5.123 20 0 DKADRN O=C(Nc1ccc2oc3ccccc3c2c1)c1ccoc1Cl ZINC000389743033 336889512 /nfs/dbraw/zinc/88/95/12/336889512.db2.gz MGUDMPAIACQISF-UHFFFAOYSA-N 0 0 311.724 5.085 20 0 DKADRN Cc1ccc(CN[C@@H](c2ccco2)c2ccccc2)cc1Cl ZINC000389788830 336895489 /nfs/dbraw/zinc/89/54/89/336895489.db2.gz HAAZDJUPEAMNAR-LJQANCHMSA-N 0 0 311.812 5.121 20 0 DKADRN O=C(Nc1ccccc1-c1cccs1)c1ccc2[nH]ccc2c1 ZINC000389924100 336924856 /nfs/dbraw/zinc/92/48/56/336924856.db2.gz GXROINMNVNGBLK-UHFFFAOYSA-N 0 0 318.401 5.149 20 0 DKADRN Cc1c2ccccc2oc1[C@@H](C)[NH2+][C@H]1CCSc2ccccc21 ZINC000390264654 333255599 /nfs/dbraw/zinc/25/55/99/333255599.db2.gz IRMKRLJLVAXONO-PBHICJAKSA-N 0 0 323.461 5.629 20 0 DKADRN Cc1c2ccccc2oc1[C@@H](C)[NH2+][C@@H]1CCSc2ccccc21 ZINC000390264655 333255511 /nfs/dbraw/zinc/25/55/11/333255511.db2.gz IRMKRLJLVAXONO-RHSMWYFYSA-N 0 0 323.461 5.629 20 0 DKADRN Cc1c2ccccc2oc1[C@H](C)[NH2+][C@@H]1CCSc2ccccc21 ZINC000390264656 333255582 /nfs/dbraw/zinc/25/55/82/333255582.db2.gz IRMKRLJLVAXONO-WMLDXEAASA-N 0 0 323.461 5.629 20 0 DKADRN Cc1c2ccccc2oc1[C@H](C)[NH2+][C@H]1CCSc2ccccc21 ZINC000390264657 333255604 /nfs/dbraw/zinc/25/56/04/333255604.db2.gz IRMKRLJLVAXONO-YOEHRIQHSA-N 0 0 323.461 5.629 20 0 DKADRN Cc1nc2cc(N[C@@H](C)c3ccc(C(F)(F)F)cc3)ccc2o1 ZINC000390283534 333257816 /nfs/dbraw/zinc/25/78/16/333257816.db2.gz MPHWOWUTTNCCGW-JTQLQIEISA-N 0 0 320.314 5.328 20 0 DKADRN Cc1nc2cc(N[C@H](C)c3ccc(C(F)(F)F)cc3)ccc2o1 ZINC000390283537 333257750 /nfs/dbraw/zinc/25/77/50/333257750.db2.gz MPHWOWUTTNCCGW-SNVBAGLBSA-N 0 0 320.314 5.328 20 0 DKADRN Cc1ccc(C)c([C@@H](C)N[C@@H](c2ccco2)c2ccccc2)c1 ZINC000390285673 333258837 /nfs/dbraw/zinc/25/88/37/333258837.db2.gz NDXBCEXNQQZBGT-DYESRHJHSA-N 0 0 305.421 5.337 20 0 DKADRN Cc1ccc(C)c([C@H](C)N[C@@H](c2ccco2)c2ccccc2)c1 ZINC000390285675 333258758 /nfs/dbraw/zinc/25/87/58/333258758.db2.gz NDXBCEXNQQZBGT-LAUBAEHRSA-N 0 0 305.421 5.337 20 0 DKADRN Cc1ccc(C)c([C@@H](C)N[C@H](c2ccco2)c2ccccc2)c1 ZINC000390285677 333258841 /nfs/dbraw/zinc/25/88/41/333258841.db2.gz NDXBCEXNQQZBGT-UTKZUKDTSA-N 0 0 305.421 5.337 20 0 DKADRN Cc1ccc(C)c([C@H](C)N[C@H](c2ccco2)c2ccccc2)c1 ZINC000390285679 333258727 /nfs/dbraw/zinc/25/87/27/333258727.db2.gz NDXBCEXNQQZBGT-UWJYYQICSA-N 0 0 305.421 5.337 20 0 DKADRN CCc1ccc([C@H](C)Nc2ccc(NC(=O)C(C)C)cc2)cc1 ZINC000390298903 333261712 /nfs/dbraw/zinc/26/17/12/333261712.db2.gz KKGKDNXXRAFGBP-HNNXBMFYSA-N 0 0 310.441 5.017 20 0 DKADRN CCc1ccc([C@@H](C)Nc2ccc(NC(=O)C(C)C)cc2)cc1 ZINC000390298905 333261670 /nfs/dbraw/zinc/26/16/70/333261670.db2.gz KKGKDNXXRAFGBP-OAHLLOKOSA-N 0 0 310.441 5.017 20 0 DKADRN CSc1ccc([C@@H](C)N[C@@H](c2ccco2)c2ccccc2)cc1 ZINC000390320087 333266568 /nfs/dbraw/zinc/26/65/68/333266568.db2.gz QEVVXZOHGSUWJC-FOIQADDNSA-N 0 0 323.461 5.442 20 0 DKADRN CSc1ccc([C@H](C)N[C@@H](c2ccco2)c2ccccc2)cc1 ZINC000390320088 333266503 /nfs/dbraw/zinc/26/65/03/333266503.db2.gz QEVVXZOHGSUWJC-MGPUTAFESA-N 0 0 323.461 5.442 20 0 DKADRN CSc1ccc([C@@H](C)N[C@H](c2ccco2)c2ccccc2)cc1 ZINC000390320089 333266641 /nfs/dbraw/zinc/26/66/41/333266641.db2.gz QEVVXZOHGSUWJC-QRWLVFNGSA-N 0 0 323.461 5.442 20 0 DKADRN CSc1ccc([C@H](C)N[C@H](c2ccco2)c2ccccc2)cc1 ZINC000390320090 333266478 /nfs/dbraw/zinc/26/64/78/333266478.db2.gz QEVVXZOHGSUWJC-YWZLYKJASA-N 0 0 323.461 5.442 20 0 DKADRN Cc1ccc([C@H](C)Nc2cccc(NC(=O)C(C)C)c2)cc1C ZINC000390337055 333268465 /nfs/dbraw/zinc/26/84/65/333268465.db2.gz UMEGRIHQMTXMHN-INIZCTEOSA-N 0 0 310.441 5.071 20 0 DKADRN Cc1ccc([C@@H](C)Nc2cccc(NC(=O)C(C)C)c2)cc1C ZINC000390337074 334265294 /nfs/dbraw/zinc/26/52/94/334265294.db2.gz UMEGRIHQMTXMHN-MRXNPFEDSA-N 0 0 310.441 5.071 20 0 DKADRN C[C@H](Nc1ccc2oc(C3CC3)nc2c1)c1ccc(F)cc1F ZINC000390344072 333270506 /nfs/dbraw/zinc/27/05/06/333270506.db2.gz WFNGWOBIXWDNGV-JTQLQIEISA-N 0 0 314.335 5.157 20 0 DKADRN C[C@@H](Nc1ccc2oc(C3CC3)nc2c1)c1ccc(F)cc1F ZINC000390344074 333270516 /nfs/dbraw/zinc/27/05/16/333270516.db2.gz WFNGWOBIXWDNGV-SNVBAGLBSA-N 0 0 314.335 5.157 20 0 DKADRN COc1c(C)ccc(N[C@H](C)c2ccc(OC(F)F)cc2)c1C ZINC000390348330 333270162 /nfs/dbraw/zinc/27/01/62/333270162.db2.gz XZHLDHOBNLZPBV-CYBMUJFWSA-N 0 0 321.367 5.087 20 0 DKADRN COc1c(C)ccc(N[C@@H](C)c2ccc(OC(F)F)cc2)c1C ZINC000390348331 333270241 /nfs/dbraw/zinc/27/02/41/333270241.db2.gz XZHLDHOBNLZPBV-ZDUSSCGKSA-N 0 0 321.367 5.087 20 0 DKADRN COc1ccc([C@@H](C)Nc2cccc(-c3csc(C)n3)c2)cc1 ZINC000390352232 333271136 /nfs/dbraw/zinc/27/11/36/333271136.db2.gz PBGRPCMWESGEMQ-CYBMUJFWSA-N 0 0 324.449 5.300 20 0 DKADRN COc1ccc([C@H](C)Nc2cccc(-c3csc(C)n3)c2)cc1 ZINC000390352233 333271023 /nfs/dbraw/zinc/27/10/23/333271023.db2.gz PBGRPCMWESGEMQ-ZDUSSCGKSA-N 0 0 324.449 5.300 20 0 DKADRN Cc1ccc([C@H](C)Nc2ccc(NC(=O)C(C)C)cc2)cc1C ZINC000390359236 333271676 /nfs/dbraw/zinc/27/16/76/333271676.db2.gz QQJVVCBBHZFEKE-INIZCTEOSA-N 0 0 310.441 5.071 20 0 DKADRN Cc1ccc([C@@H](C)Nc2ccc(NC(=O)C(C)C)cc2)cc1C ZINC000390359238 333271670 /nfs/dbraw/zinc/27/16/70/333271670.db2.gz QQJVVCBBHZFEKE-MRXNPFEDSA-N 0 0 310.441 5.071 20 0 DKADRN CCC(=O)Nc1ccc(C)c(N[C@H](CC)c2ccc(C)cc2)c1 ZINC000390401696 333277619 /nfs/dbraw/zinc/27/76/19/333277619.db2.gz IFSVAZSJRQSIHO-GOSISDBHSA-N 0 0 310.441 5.215 20 0 DKADRN CCC(=O)Nc1ccc(C)c(N[C@@H](CC)c2ccc(C)cc2)c1 ZINC000390401737 333277588 /nfs/dbraw/zinc/27/75/88/333277588.db2.gz IFSVAZSJRQSIHO-SFHVURJKSA-N 0 0 310.441 5.215 20 0 DKADRN CCC(=O)Nc1ccc(C)c(NCc2ccc(C(C)C)cc2)c1 ZINC000390407115 333278189 /nfs/dbraw/zinc/27/81/89/333278189.db2.gz JVUAROQRIQKXEQ-UHFFFAOYSA-N 0 0 310.441 5.079 20 0 DKADRN CC(C)Oc1ccccc1N[C@H](C)c1ccc(OC(F)F)cc1 ZINC000390443543 333280731 /nfs/dbraw/zinc/28/07/31/333280731.db2.gz XMSOLGOKWBGWGU-CYBMUJFWSA-N 0 0 321.367 5.248 20 0 DKADRN CC(C)Oc1ccccc1N[C@@H](C)c1ccc(OC(F)F)cc1 ZINC000390443546 333280706 /nfs/dbraw/zinc/28/07/06/333280706.db2.gz XMSOLGOKWBGWGU-ZDUSSCGKSA-N 0 0 321.367 5.248 20 0 DKADRN O=C(Nc1ccccc1-c1cccs1)c1cc2ccccc2[nH]1 ZINC000390695343 333315779 /nfs/dbraw/zinc/31/57/79/333315779.db2.gz CVWUGNWZYURNKL-UHFFFAOYSA-N 0 0 318.401 5.149 20 0 DKADRN C[C@H](Nc1ccc2oc(C3CC3)nc2c1)c1cccc(F)c1F ZINC000390941726 333409381 /nfs/dbraw/zinc/40/93/81/333409381.db2.gz BVBAYMIXPOPVQG-JTQLQIEISA-N 0 0 314.335 5.157 20 0 DKADRN CC(C)c1nc2cc(NCc3cccc4cc[nH]c43)ccc2o1 ZINC000391022117 336952804 /nfs/dbraw/zinc/95/28/04/336952804.db2.gz GDWRCZYEJWVZTJ-UHFFFAOYSA-N 0 0 305.381 5.045 20 0 DKADRN CC[C@@H](Nc1cccc(-c2nccs2)c1)c1ccc(OC)cc1 ZINC000391052750 333417774 /nfs/dbraw/zinc/41/77/74/333417774.db2.gz YBOOHQXRBVSFLR-GOSISDBHSA-N 0 0 324.449 5.382 20 0 DKADRN Cc1ccc(F)c(CNC(c2ccccc2)c2ccccc2)c1 ZINC000391164417 333421906 /nfs/dbraw/zinc/42/19/06/333421906.db2.gz WTQZGJDMPVSTHZ-UHFFFAOYSA-N 0 0 305.396 5.013 20 0 DKADRN Clc1ccc2c(c1)CC[C@H]2N[C@H](c1ccco1)c1ccccc1 ZINC000391368529 333458649 /nfs/dbraw/zinc/45/86/49/333458649.db2.gz SBPPRJIIHLHGKF-QUCCMNQESA-N 0 0 323.823 5.300 20 0 DKADRN Cc1ccc(N[C@H](C)c2cnc3ccsc3c2)c2cccnc12 ZINC000391371031 333459925 /nfs/dbraw/zinc/45/99/25/333459925.db2.gz QPDZOYLRRSTBCX-CYBMUJFWSA-N 0 0 319.433 5.326 20 0 DKADRN CC[C@H](N[C@H](c1ccco1)c1ccccc1)c1cccc(F)c1 ZINC000391406239 333487668 /nfs/dbraw/zinc/48/76/68/333487668.db2.gz GUGMNGQJHGHWKQ-ICSRJNTNSA-N 0 0 309.384 5.249 20 0 DKADRN CC[C@@H](N[C@@H](c1ccco1)c1ccccc1)c1cccc(F)c1 ZINC000391406241 333487686 /nfs/dbraw/zinc/48/76/86/333487686.db2.gz GUGMNGQJHGHWKQ-UYAOXDASSA-N 0 0 309.384 5.249 20 0 DKADRN CC(C)c1ccc(NC(=O)c2ccc3cc[nH]c3c2)c(C(C)C)c1 ZINC000391612914 335030249 /nfs/dbraw/zinc/03/02/49/335030249.db2.gz WCUIVAUAIVOANX-UHFFFAOYSA-N 0 0 320.436 5.667 20 0 DKADRN C[C@H](Nc1ccc(CCO)cc1)c1ccc(-c2ccccc2)cc1 ZINC000391677044 335073015 /nfs/dbraw/zinc/07/30/15/335073015.db2.gz ZQJTWAMFKVBFQL-KRWDZBQOSA-N 0 0 317.432 5.062 20 0 DKADRN C[C@@H](Nc1ccc(CCO)cc1)c1ccc(-c2ccccc2)cc1 ZINC000391677045 335073020 /nfs/dbraw/zinc/07/30/20/335073020.db2.gz ZQJTWAMFKVBFQL-QGZVFWFLSA-N 0 0 317.432 5.062 20 0 DKADRN C[C@@H]1C[C@H](N[C@H](c2ccco2)c2ccccc2)c2ccccc21 ZINC000391707594 335080132 /nfs/dbraw/zinc/08/01/32/335080132.db2.gz HWEJEISLLKTDEA-JJXUHFIVSA-N 0 0 303.405 5.207 20 0 DKADRN C[C@@H]1C[C@H](N[C@@H](c2ccco2)c2ccccc2)c2ccccc21 ZINC000391707595 335080219 /nfs/dbraw/zinc/08/02/19/335080219.db2.gz HWEJEISLLKTDEA-MFMILTCTSA-N 0 0 303.405 5.207 20 0 DKADRN C[C@@H]1C[C@@H](N[C@@H](c2ccco2)c2ccccc2)c2ccccc21 ZINC000391707596 335080296 /nfs/dbraw/zinc/08/02/96/335080296.db2.gz HWEJEISLLKTDEA-QFIXIFRTSA-N 0 0 303.405 5.207 20 0 DKADRN C[C@@H]1C[C@@H](N[C@H](c2ccco2)c2ccccc2)c2ccccc21 ZINC000391707598 335080102 /nfs/dbraw/zinc/08/01/02/335080102.db2.gz HWEJEISLLKTDEA-VMRPVKRXSA-N 0 0 303.405 5.207 20 0 DKADRN Fc1ccc([C@@H](N[C@@H]2CCCc3occc32)c2ccccc2)cc1 ZINC000391744740 335087957 /nfs/dbraw/zinc/08/79/57/335087957.db2.gz MHSKRSXAIAVJOY-CTNGQTDRSA-N 0 0 321.395 5.175 20 0 DKADRN Fc1ccc([C@@H](N[C@H]2CCCc3occc32)c2ccccc2)cc1 ZINC000391744742 335088145 /nfs/dbraw/zinc/08/81/45/335088145.db2.gz MHSKRSXAIAVJOY-FPOVZHCZSA-N 0 0 321.395 5.175 20 0 DKADRN Fc1ccc([C@H](N[C@H]2CCCc3occc32)c2ccccc2)cc1 ZINC000391744746 335087988 /nfs/dbraw/zinc/08/79/88/335087988.db2.gz MHSKRSXAIAVJOY-PZJWPPBQSA-N 0 0 321.395 5.175 20 0 DKADRN Fc1ccc([C@H](N[C@@H]2CCCc3occc32)c2ccccc2)cc1 ZINC000391744749 335088149 /nfs/dbraw/zinc/08/81/49/335088149.db2.gz MHSKRSXAIAVJOY-TZIWHRDSSA-N 0 0 321.395 5.175 20 0 DKADRN c1cc2cc(N[C@H](Cc3ccccc3)c3ccccc3)ccc2[nH]1 ZINC000391776158 335095495 /nfs/dbraw/zinc/09/54/95/335095495.db2.gz ULDBXKOMSQSCNQ-JOCHJYFZSA-N 0 0 312.416 5.564 20 0 DKADRN c1cc2cc(N[C@@H](Cc3ccccc3)c3ccccc3)ccc2[nH]1 ZINC000391776164 335095458 /nfs/dbraw/zinc/09/54/58/335095458.db2.gz ULDBXKOMSQSCNQ-QFIPXVFZSA-N 0 0 312.416 5.564 20 0 DKADRN Cc1nc2cc(NCc3ccc(-c4ccc(F)cc4)o3)ccc2o1 ZINC000391781859 335101161 /nfs/dbraw/zinc/10/11/61/335101161.db2.gz ZAYBDFRRGGOOQV-UHFFFAOYSA-N 0 0 322.339 5.147 20 0 DKADRN COc1cccc2cc([C@H](C)Nc3cccc4ccncc43)oc21 ZINC000391790666 336961741 /nfs/dbraw/zinc/96/17/41/336961741.db2.gz JLTWJOKVIAQNOA-ZDUSSCGKSA-N 0 0 318.376 5.163 20 0 DKADRN COCCOc1cccc(N[C@@H](C)c2ccc3ccccc3c2)c1 ZINC000391882390 335130788 /nfs/dbraw/zinc/13/07/88/335130788.db2.gz ZENSJXXVEFSFEY-INIZCTEOSA-N 0 0 321.420 5.038 20 0 DKADRN COCCOc1cccc(N[C@H](C)c2ccc3ccccc3c2)c1 ZINC000391882391 335130616 /nfs/dbraw/zinc/13/06/16/335130616.db2.gz ZENSJXXVEFSFEY-MRXNPFEDSA-N 0 0 321.420 5.038 20 0 DKADRN CC(C)(C)n1cc(CNc2ccc(Oc3ccccc3)cc2)cn1 ZINC000391884881 335130639 /nfs/dbraw/zinc/13/06/39/335130639.db2.gz YLDFHRPPFACHRC-UHFFFAOYSA-N 0 0 321.424 5.043 20 0 DKADRN CC[C@H](Nc1cccc(C(=O)N(CC)CC)c1)c1ccc(C)cc1 ZINC000391885831 335129590 /nfs/dbraw/zinc/12/95/90/335129590.db2.gz RBGPFFDAKXHQBZ-FQEVSTJZSA-N 0 0 324.468 5.040 20 0 DKADRN CC[C@@H](Nc1cccc(C(=O)N(CC)CC)c1)c1ccc(C)cc1 ZINC000391885832 335129577 /nfs/dbraw/zinc/12/95/77/335129577.db2.gz RBGPFFDAKXHQBZ-HXUWFJFHSA-N 0 0 324.468 5.040 20 0 DKADRN COCc1cccc(N[C@@H](C)c2ccc3cc(OC)ccc3c2)c1 ZINC000392088595 336385664 /nfs/dbraw/zinc/38/56/64/336385664.db2.gz IUDNCLHHDRBFAC-HNNXBMFYSA-N 0 0 321.420 5.168 20 0 DKADRN COCc1cccc(N[C@H](C)c2ccc3cc(OC)ccc3c2)c1 ZINC000392088597 336385690 /nfs/dbraw/zinc/38/56/90/336385690.db2.gz IUDNCLHHDRBFAC-OAHLLOKOSA-N 0 0 321.420 5.168 20 0 DKADRN C[C@H](Nc1ccc2c(c1)CCC(=O)N2)c1ccc(C(C)(C)C)cc1 ZINC000392090013 336385818 /nfs/dbraw/zinc/38/58/18/336385818.db2.gz JBRCIBSIKFBNTG-AWEZNQCLSA-N 0 0 322.452 5.042 20 0 DKADRN C[C@@H](Nc1ccc2c(c1)CCC(=O)N2)c1ccc(C(C)(C)C)cc1 ZINC000392090016 336385752 /nfs/dbraw/zinc/38/57/52/336385752.db2.gz JBRCIBSIKFBNTG-CQSZACIVSA-N 0 0 322.452 5.042 20 0 DKADRN O=C(Nc1ccc2oc3ccccc3c2c1)c1cccc(F)c1F ZINC000392109467 336387365 /nfs/dbraw/zinc/38/73/65/336387365.db2.gz MKPCAARWHCLKKS-UHFFFAOYSA-N 0 0 323.298 5.117 20 0 DKADRN COCc1cccc(N[C@H](Cc2ccccc2)c2ccccc2)c1 ZINC000392110035 336387421 /nfs/dbraw/zinc/38/74/21/336387421.db2.gz MQNATFCNFSWSGY-JOCHJYFZSA-N 0 0 317.432 5.229 20 0 DKADRN COCc1cccc(N[C@@H](Cc2ccccc2)c2ccccc2)c1 ZINC000392110038 336387341 /nfs/dbraw/zinc/38/73/41/336387341.db2.gz MQNATFCNFSWSGY-QFIPXVFZSA-N 0 0 317.432 5.229 20 0 DKADRN Cc1ccc(C)c([C@H](C)N[C@@H](c2ccccc2)c2ccccn2)c1 ZINC000392150892 337135737 /nfs/dbraw/zinc/13/57/37/337135737.db2.gz ZOOBJPNHMCJLCE-AVRDEDQJSA-N 0 0 316.448 5.139 20 0 DKADRN Cc1ccc(C)c([C@@H](C)N[C@@H](c2ccccc2)c2ccccn2)c1 ZINC000392150897 337135710 /nfs/dbraw/zinc/13/57/10/337135710.db2.gz ZOOBJPNHMCJLCE-GCJKJVERSA-N 0 0 316.448 5.139 20 0 DKADRN Cc1ccc(C)c([C@H](C)N[C@H](c2ccccc2)c2ccccn2)c1 ZINC000392150898 337135674 /nfs/dbraw/zinc/13/56/74/337135674.db2.gz ZOOBJPNHMCJLCE-PGRDOPGGSA-N 0 0 316.448 5.139 20 0 DKADRN Cc1ccc(C)c([C@@H](C)N[C@H](c2ccccc2)c2ccccn2)c1 ZINC000392150899 337135721 /nfs/dbraw/zinc/13/57/21/337135721.db2.gz ZOOBJPNHMCJLCE-XMSQKQJNSA-N 0 0 316.448 5.139 20 0 DKADRN CCCCc1ccc([C@H](C)Nc2ccc(C)c(NC(C)=O)c2)cc1 ZINC000392190020 337174152 /nfs/dbraw/zinc/17/41/52/337174152.db2.gz RUCIOTIPKXPAAE-INIZCTEOSA-N 0 0 324.468 5.469 20 0 DKADRN CCCCc1ccc([C@@H](C)Nc2ccc(C)c(NC(C)=O)c2)cc1 ZINC000392190022 337174224 /nfs/dbraw/zinc/17/42/24/337174224.db2.gz RUCIOTIPKXPAAE-MRXNPFEDSA-N 0 0 324.468 5.469 20 0 DKADRN CC(C)C(=O)Nc1cccc(N[C@@H]2CC[C@@H](C)c3ccccc32)c1 ZINC000392491326 337258661 /nfs/dbraw/zinc/25/86/61/337258661.db2.gz FZJGYOIOTVWNTA-FOIQADDNSA-N 0 0 322.452 5.332 20 0 DKADRN CC(C)C(=O)Nc1cccc(N[C@@H]2CC[C@H](C)c3ccccc32)c1 ZINC000392491329 337258686 /nfs/dbraw/zinc/25/86/86/337258686.db2.gz FZJGYOIOTVWNTA-MGPUTAFESA-N 0 0 322.452 5.332 20 0 DKADRN CC(C)C(=O)Nc1cccc(N[C@H]2CC[C@@H](C)c3ccccc32)c1 ZINC000392491331 337258670 /nfs/dbraw/zinc/25/86/70/337258670.db2.gz FZJGYOIOTVWNTA-QRWLVFNGSA-N 0 0 322.452 5.332 20 0 DKADRN CC(C)C(=O)Nc1cccc(N[C@H]2CC[C@H](C)c3ccccc32)c1 ZINC000392491333 337258638 /nfs/dbraw/zinc/25/86/38/337258638.db2.gz FZJGYOIOTVWNTA-YWZLYKJASA-N 0 0 322.452 5.332 20 0 DKADRN C[C@@H]1CC[C@@H](Nc2cccc(NC(=O)C3CC3)c2)c2ccccc21 ZINC000392542683 337260140 /nfs/dbraw/zinc/26/01/40/337260140.db2.gz ZJRRCGWHPLHACM-JLTOFOAXSA-N 0 0 320.436 5.086 20 0 DKADRN C[C@H]1CC[C@@H](Nc2cccc(NC(=O)C3CC3)c2)c2ccccc21 ZINC000392542693 337260104 /nfs/dbraw/zinc/26/01/04/337260104.db2.gz ZJRRCGWHPLHACM-VBKZILBWSA-N 0 0 320.436 5.086 20 0 DKADRN C[C@@H]1CC[C@H](Nc2cccc(NC(=O)C3CC3)c2)c2ccccc21 ZINC000392542694 337260133 /nfs/dbraw/zinc/26/01/33/337260133.db2.gz ZJRRCGWHPLHACM-VLIAUNLRSA-N 0 0 320.436 5.086 20 0 DKADRN C[C@H]1CC[C@H](Nc2cccc(NC(=O)C3CC3)c2)c2ccccc21 ZINC000392542695 337260057 /nfs/dbraw/zinc/26/00/57/337260057.db2.gz ZJRRCGWHPLHACM-XOBRGWDASA-N 0 0 320.436 5.086 20 0 DKADRN FC(F)c1cccc(C[NH2+]C(c2ccccc2)c2ccccc2)c1 ZINC000392595312 337265140 /nfs/dbraw/zinc/26/51/40/337265140.db2.gz NLQDKXJIELCKKD-UHFFFAOYSA-N 0 0 323.386 5.503 20 0 DKADRN Cc1csc(C(=O)Nc2ccccc2Oc2ccc(C)cc2)c1 ZINC000393281658 337091850 /nfs/dbraw/zinc/09/18/50/337091850.db2.gz HBFDNBWXUFTRGN-UHFFFAOYSA-N 0 0 323.417 5.410 20 0 DKADRN CC(C)[C@H](NCc1csc(C(C)(C)C)n1)c1ccc(F)cc1 ZINC000393366347 340630706 /nfs/dbraw/zinc/63/07/06/340630706.db2.gz CLUACZJWFFAMBZ-INIZCTEOSA-N 0 0 320.477 5.067 20 0 DKADRN Cc1csc(C(=O)Nc2ccc3oc4ccccc4c3c2)c1 ZINC000393509846 337092835 /nfs/dbraw/zinc/09/28/35/337092835.db2.gz NZBDIHJPWWLFQM-UHFFFAOYSA-N 0 0 307.374 5.208 20 0 DKADRN Clc1ccsc1CNc1ccc2oc(C3CC3)nc2c1 ZINC000394043839 331698191 /nfs/dbraw/zinc/69/81/91/331698191.db2.gz HGCMDVFUTNHBKD-UHFFFAOYSA-N 0 0 304.802 5.032 20 0 DKADRN CC(C)Oc1ccccc1[C@@H](C)NCc1sccc1Cl ZINC000394071453 337099069 /nfs/dbraw/zinc/09/90/69/337099069.db2.gz SFBQYZGKVIOZMS-GFCCVEGCSA-N 0 0 309.862 5.040 20 0 DKADRN CC(C)Oc1ccccc1[C@H](C)NCc1sccc1Cl ZINC000394071456 337098986 /nfs/dbraw/zinc/09/89/86/337098986.db2.gz SFBQYZGKVIOZMS-LBPRGKRZSA-N 0 0 309.862 5.040 20 0 DKADRN Cc1csc(C(=O)Nc2c(Cl)cc(Cl)cc2Cl)c1 ZINC000394083512 337099299 /nfs/dbraw/zinc/09/92/99/337099299.db2.gz KQEOJVVCCJUSNN-UHFFFAOYSA-N 0 0 320.628 5.269 20 0 DKADRN Clc1ccsc1CNc1ccccc1N1CCCCC1 ZINC000394086558 331978069 /nfs/dbraw/zinc/97/80/69/331978069.db2.gz WWFWUSJYEOYVAC-UHFFFAOYSA-N 0 0 306.862 5.004 20 0 DKADRN Clc1ccsc1CNc1cccc(-c2nccs2)c1 ZINC000394113193 331526083 /nfs/dbraw/zinc/52/60/83/331526083.db2.gz SGLLQSCSUHGJPM-UHFFFAOYSA-N 0 0 306.843 5.137 20 0 DKADRN Cc1cc([C@@H](C)Nc2ccc(F)c(Br)c2)cs1 ZINC000394541356 333055239 /nfs/dbraw/zinc/05/52/39/333055239.db2.gz YEDDBSARONHXPR-SECBINFHSA-N 0 0 314.223 5.131 20 0 DKADRN Cc1cc([C@H](C)Nc2ccc(F)c(Br)c2)cs1 ZINC000394541357 333055367 /nfs/dbraw/zinc/05/53/67/333055367.db2.gz YEDDBSARONHXPR-VIFPVBQESA-N 0 0 314.223 5.131 20 0 DKADRN COCc1ccc(CNc2ccc(C(C)C)cc2C(C)C)o1 ZINC000394562755 333116568 /nfs/dbraw/zinc/11/65/68/333116568.db2.gz IWGCHLOXQVDWAW-UHFFFAOYSA-N 0 0 301.430 5.285 20 0 DKADRN CC(C)n1nccc1CNc1ccc(SC2CCCC2)cc1 ZINC000394637392 333341695 /nfs/dbraw/zinc/34/16/95/333341695.db2.gz LSOJVIWVQFFHIM-UHFFFAOYSA-N 0 0 315.486 5.111 20 0 DKADRN Cc1cnc(CNc2ccc(SC3CCCC3)cc2)s1 ZINC000394698906 333365551 /nfs/dbraw/zinc/36/55/51/333365551.db2.gz AILIKHUBFLBMOO-UHFFFAOYSA-N 0 0 304.484 5.098 20 0 DKADRN CCc1cnc(CNc2ccccc2SC2CCCC2)s1 ZINC000394921374 337170913 /nfs/dbraw/zinc/17/09/13/337170913.db2.gz WXTIGVIBRAMWCO-UHFFFAOYSA-N 0 0 318.511 5.352 20 0 DKADRN Cc1cc(Cl)cc(CN[C@@H](c2ccco2)c2ccccc2)c1 ZINC000395088967 337206830 /nfs/dbraw/zinc/20/68/30/337206830.db2.gz SYLAOAALGANAAS-LJQANCHMSA-N 0 0 311.812 5.121 20 0 DKADRN c1cc2cccc(N[C@@H](c3ccccc3)c3ccccn3)c2s1 ZINC000395290166 336085925 /nfs/dbraw/zinc/08/59/25/336085925.db2.gz FUCDJQPJMHIKNW-IBGZPJMESA-N 0 0 316.429 5.498 20 0 DKADRN c1cc2cccc(N[C@H](c3ccccc3)c3ccccn3)c2s1 ZINC000395290167 336086058 /nfs/dbraw/zinc/08/60/58/336086058.db2.gz FUCDJQPJMHIKNW-LJQANCHMSA-N 0 0 316.429 5.498 20 0 DKADRN FC(F)c1cccc(NCc2cc(Cl)ccc2Cl)c1 ZINC000395409401 336112735 /nfs/dbraw/zinc/11/27/35/336112735.db2.gz FXTPIJGUZYCCCK-UHFFFAOYSA-N 0 0 302.151 5.543 20 0 DKADRN Cc1c2ccccc2oc1[C@H](C)NC(=O)Nc1cc(C)ccc1C ZINC000409482271 332034826 /nfs/dbraw/zinc/03/48/26/332034826.db2.gz DGYVQJQNDBLQIQ-HNNXBMFYSA-N 0 0 322.408 5.241 20 0 DKADRN Cc1c2ccccc2oc1[C@@H](C)NC(=O)Nc1cc(C)ccc1C ZINC000409482274 332034849 /nfs/dbraw/zinc/03/48/49/332034849.db2.gz DGYVQJQNDBLQIQ-OAHLLOKOSA-N 0 0 322.408 5.241 20 0 DKADRN Cc1ccc(C)c(NC(=O)N2CCCCC[C@H]2c2ccccc2)c1 ZINC000409482428 332034832 /nfs/dbraw/zinc/03/48/32/332034832.db2.gz FFHKYQQNVRAAKJ-FQEVSTJZSA-N 0 0 322.452 5.453 20 0 DKADRN Cc1ccc(C)c(NC(=O)N2CCCCC[C@@H]2c2ccccc2)c1 ZINC000409482432 332034952 /nfs/dbraw/zinc/03/49/52/332034952.db2.gz FFHKYQQNVRAAKJ-HXUWFJFHSA-N 0 0 322.452 5.453 20 0 DKADRN Cc1ccc(C)c(NC(=O)N[C@H](c2ccccc2)C(C)(C)C)c1 ZINC000409484561 332035166 /nfs/dbraw/zinc/03/51/66/332035166.db2.gz LSERWSYPWIIJFS-GOSISDBHSA-N 0 0 310.441 5.212 20 0 DKADRN Cc1ccc(C)c(NC(=O)N[C@@H](c2ccccc2)C(C)(C)C)c1 ZINC000409484566 332035140 /nfs/dbraw/zinc/03/51/40/332035140.db2.gz LSERWSYPWIIJFS-SFHVURJKSA-N 0 0 310.441 5.212 20 0 DKADRN CC[C@H](C(=O)Nc1cccc(NC2CCCC2)c1)c1ccccc1 ZINC000409554025 332038589 /nfs/dbraw/zinc/03/85/89/332038589.db2.gz PETHEPAASKPISL-FQEVSTJZSA-N 0 0 322.452 5.173 20 0 DKADRN CC[C@@H](C(=O)Nc1cccc(NC2CCCC2)c1)c1ccccc1 ZINC000409554026 332038349 /nfs/dbraw/zinc/03/83/49/332038349.db2.gz PETHEPAASKPISL-HXUWFJFHSA-N 0 0 322.452 5.173 20 0 DKADRN O=C(Nc1cccc(NC2CCCC2)c1)c1ccc(Cl)s1 ZINC000409556804 332038535 /nfs/dbraw/zinc/03/85/35/332038535.db2.gz YJANGXJNMJIGAC-UHFFFAOYSA-N 0 0 320.845 5.008 20 0 DKADRN CC(C)Cn1ccc2cc(NC(=O)c3ccoc3C3CC3)ccc21 ZINC000409577171 332039043 /nfs/dbraw/zinc/03/90/43/332039043.db2.gz YXVGXITXXRHGJJ-UHFFFAOYSA-N 0 0 322.408 5.020 20 0 DKADRN O=C(Nc1ccc(Cl)c(Cl)c1)c1cccc(C(F)F)c1 ZINC000409591275 332039485 /nfs/dbraw/zinc/03/94/85/332039485.db2.gz MBQNNRAFCFPEGR-UHFFFAOYSA-N 0 0 316.134 5.183 20 0 DKADRN Cc1cccc(C(C)C)c1NC(=O)NC[C@H]1CCCC[C@H]1C ZINC000409595679 332041163 /nfs/dbraw/zinc/04/11/63/332041163.db2.gz GEEDUCAYKJKIFE-GDBMZVCRSA-N 0 0 302.462 5.066 20 0 DKADRN Cc1cccc(C(C)C)c1NC(=O)NC[C@H]1CCCC[C@@H]1C ZINC000409595680 332041054 /nfs/dbraw/zinc/04/10/54/332041054.db2.gz GEEDUCAYKJKIFE-GOEBONIOSA-N 0 0 302.462 5.066 20 0 DKADRN Cc1cccc(C(C)C)c1NC(=O)NC[C@@H]1CCCC[C@@H]1C ZINC000409595681 332041088 /nfs/dbraw/zinc/04/10/88/332041088.db2.gz GEEDUCAYKJKIFE-HOCLYGCPSA-N 0 0 302.462 5.066 20 0 DKADRN Cc1cccc(C(C)C)c1NC(=O)NC[C@@H]1CCCC[C@H]1C ZINC000409595682 332041139 /nfs/dbraw/zinc/04/11/39/332041139.db2.gz GEEDUCAYKJKIFE-ZBFHGGJFSA-N 0 0 302.462 5.066 20 0 DKADRN CC(C)(C)c1ccc(NC(=O)c2cccc(C(F)F)c2)cc1 ZINC000409606946 332040289 /nfs/dbraw/zinc/04/02/89/332040289.db2.gz MAYPFXNRYDKEQL-UHFFFAOYSA-N 0 0 303.352 5.174 20 0 DKADRN CCCCCC(=O)Nc1ccc(C)cc1-c1nc2ccccc2[nH]1 ZINC000409611179 332040395 /nfs/dbraw/zinc/04/03/95/332040395.db2.gz CXHRUWYSJGVFJX-UHFFFAOYSA-N 0 0 321.424 5.057 20 0 DKADRN CCCCc1ccc(NC(=O)c2cccc(C(F)F)c2)cc1 ZINC000409619631 332041948 /nfs/dbraw/zinc/04/19/48/332041948.db2.gz BBSOMMXSDILKLD-UHFFFAOYSA-N 0 0 303.352 5.219 20 0 DKADRN O=C(Nc1cc(Cl)cc(Cl)c1)c1cccc(C(F)F)c1 ZINC000409621486 332042298 /nfs/dbraw/zinc/04/22/98/332042298.db2.gz MFJTXWPFEYXSDD-UHFFFAOYSA-N 0 0 316.134 5.183 20 0 DKADRN Fc1cccc(Cl)c1CNCc1ccc(Cl)cc1Cl ZINC000409622023 332042143 /nfs/dbraw/zinc/04/21/43/332042143.db2.gz BIVXIKHZBPEQEH-UHFFFAOYSA-N 0 0 318.606 5.076 20 0 DKADRN CC(C)Oc1ccc(C[NH2+]Cc2ccc(Cl)cc2Cl)cc1 ZINC000409627167 332042390 /nfs/dbraw/zinc/04/23/90/332042390.db2.gz ZSPMCTQDDXLZRC-UHFFFAOYSA-N 0 0 324.251 5.070 20 0 DKADRN O=C(Nc1cccc(-c2cccs2)c1)c1ccoc1C1CC1 ZINC000409630794 332042763 /nfs/dbraw/zinc/04/27/63/332042763.db2.gz LPMZKMBLOAPSPQ-UHFFFAOYSA-N 0 0 309.390 5.138 20 0 DKADRN CSc1ccccc1[C@@H](C)Nc1ncc(C(F)(F)F)s1 ZINC000409653226 332043801 /nfs/dbraw/zinc/04/38/01/332043801.db2.gz SLRDZDSDWNPHHS-MRVPVSSYSA-N 0 0 318.389 5.057 20 0 DKADRN CC(C)(C)c1ccccc1NC(=O)c1cccc(C(F)F)c1 ZINC000409663638 332044783 /nfs/dbraw/zinc/04/47/83/332044783.db2.gz KDOJQSIUEOGTBC-UHFFFAOYSA-N 0 0 303.352 5.174 20 0 DKADRN CCN(C(=O)Nc1ccc(C)c(C)c1)[C@@H](C)c1ccc(F)cc1 ZINC000409670018 332046272 /nfs/dbraw/zinc/04/62/72/332046272.db2.gz DKGBXZJDDWJKEM-HNNXBMFYSA-N 0 0 314.404 5.058 20 0 DKADRN CCN(C(=O)Nc1ccc(C)c(C)c1)[C@H](C)c1ccc(F)cc1 ZINC000409670020 332046240 /nfs/dbraw/zinc/04/62/40/332046240.db2.gz DKGBXZJDDWJKEM-OAHLLOKOSA-N 0 0 314.404 5.058 20 0 DKADRN Cc1ccc(NC(=O)N2CCCCC[C@H]2c2ccccc2)cc1C ZINC000409671086 332046306 /nfs/dbraw/zinc/04/63/06/332046306.db2.gz JLXCAKHVUPLLCE-FQEVSTJZSA-N 0 0 322.452 5.453 20 0 DKADRN Cc1ccc(NC(=O)N2CCCCC[C@@H]2c2ccccc2)cc1C ZINC000409671087 332046256 /nfs/dbraw/zinc/04/62/56/332046256.db2.gz JLXCAKHVUPLLCE-HXUWFJFHSA-N 0 0 322.452 5.453 20 0 DKADRN Cc1ccccc1NC(=O)N(C)C1CCC(C(C)(C)C)CC1 ZINC000409671863 332046287 /nfs/dbraw/zinc/04/62/87/332046287.db2.gz FALQKWULBNHTMK-UHFFFAOYSA-N 0 0 302.462 5.064 20 0 DKADRN Cc1ccccc1NC(=O)N[C@@H](c1ccc(F)cc1)C(C)(C)C ZINC000409672356 332046452 /nfs/dbraw/zinc/04/64/52/332046452.db2.gz HGHCBNMUMTWWPN-KRWDZBQOSA-N 0 0 314.404 5.043 20 0 DKADRN Cc1ccccc1NC(=O)N[C@H](c1ccc(F)cc1)C(C)(C)C ZINC000409672357 332046519 /nfs/dbraw/zinc/04/65/19/332046519.db2.gz HGHCBNMUMTWWPN-QGZVFWFLSA-N 0 0 314.404 5.043 20 0 DKADRN Cc1cccc(NC(=O)N2CCCCC[C@H]2c2ccccc2)c1 ZINC000409673631 332046493 /nfs/dbraw/zinc/04/64/93/332046493.db2.gz RRMKWTSIRQPESO-IBGZPJMESA-N 0 0 308.425 5.144 20 0 DKADRN Cc1cccc(NC(=O)N2CCCCC[C@@H]2c2ccccc2)c1 ZINC000409673632 332046492 /nfs/dbraw/zinc/04/64/92/332046492.db2.gz RRMKWTSIRQPESO-LJQANCHMSA-N 0 0 308.425 5.144 20 0 DKADRN Cc1cccc(NC(=O)N(C)Cc2cccc3ccccc32)c1C ZINC000409673831 332046513 /nfs/dbraw/zinc/04/65/13/332046513.db2.gz WKJBRTWUJQVNSA-UHFFFAOYSA-N 0 0 318.420 5.121 20 0 DKADRN Cc1c2ccccc2oc1[C@H](C)NC(=O)Nc1ccc(C)cc1C ZINC000409674941 332046786 /nfs/dbraw/zinc/04/67/86/332046786.db2.gz GVYFZDJJQHCLAR-HNNXBMFYSA-N 0 0 322.408 5.241 20 0 DKADRN Cc1c2ccccc2oc1[C@@H](C)NC(=O)Nc1ccc(C)cc1C ZINC000409674942 332046694 /nfs/dbraw/zinc/04/66/94/332046694.db2.gz GVYFZDJJQHCLAR-OAHLLOKOSA-N 0 0 322.408 5.241 20 0 DKADRN Cc1ccc([C@@H](C)NC(=O)Nc2cc(Cl)ccc2Cl)cc1 ZINC000409674956 332046724 /nfs/dbraw/zinc/04/67/24/332046724.db2.gz IVHQALCXYIWXCA-LLVKDONJSA-N 0 0 323.223 5.185 20 0 DKADRN Cc1ccc([C@H](C)NC(=O)Nc2cc(Cl)ccc2Cl)cc1 ZINC000409674958 332046710 /nfs/dbraw/zinc/04/67/10/332046710.db2.gz IVHQALCXYIWXCA-NSHDSACASA-N 0 0 323.223 5.185 20 0 DKADRN Cc1ccccc1NC(=O)N[C@@H](c1ccccc1)C1CCCC1 ZINC000409675038 332046738 /nfs/dbraw/zinc/04/67/38/332046738.db2.gz HNFSDTGBWNCZSC-IBGZPJMESA-N 0 0 308.425 5.048 20 0 DKADRN Cc1ccccc1NC(=O)N[C@H](c1ccccc1)C1CCCC1 ZINC000409675041 332046782 /nfs/dbraw/zinc/04/67/82/332046782.db2.gz HNFSDTGBWNCZSC-LJQANCHMSA-N 0 0 308.425 5.048 20 0 DKADRN Cc1cc(C)c(NC(=O)N2CCC[C@@H]2C2CCCCC2)c(C)c1 ZINC000409675327 332046730 /nfs/dbraw/zinc/04/67/30/332046730.db2.gz MCNCDRNDSMYXQA-GOSISDBHSA-N 0 0 314.473 5.188 20 0 DKADRN Cc1cc(C)c(NC(=O)N2CCC[C@H]2C2CCCCC2)c(C)c1 ZINC000409675328 332046749 /nfs/dbraw/zinc/04/67/49/332046749.db2.gz MCNCDRNDSMYXQA-SFHVURJKSA-N 0 0 314.473 5.188 20 0 DKADRN Cc1ccc(NC(=O)N(C)Cc2cccc3ccccc32)cc1C ZINC000409675440 332046745 /nfs/dbraw/zinc/04/67/45/332046745.db2.gz KNSMIHHMMCDIPR-UHFFFAOYSA-N 0 0 318.420 5.121 20 0 DKADRN Cc1cccc(NC(=O)N2CCCCC[C@H]2c2ccccc2)c1C ZINC000409675451 332046670 /nfs/dbraw/zinc/04/66/70/332046670.db2.gz KPVCJQRDEPFTTI-FQEVSTJZSA-N 0 0 322.452 5.453 20 0 DKADRN Cc1cccc(NC(=O)N2CCCCC[C@@H]2c2ccccc2)c1C ZINC000409675452 332046695 /nfs/dbraw/zinc/04/66/95/332046695.db2.gz KPVCJQRDEPFTTI-HXUWFJFHSA-N 0 0 322.452 5.453 20 0 DKADRN Cc1ccc(NC(=O)N(C)[C@@H](C)c2cccc(Cl)c2)cc1C ZINC000409675851 332046674 /nfs/dbraw/zinc/04/66/74/332046674.db2.gz NAKGFQJSXFUEBH-AWEZNQCLSA-N 0 0 316.832 5.182 20 0 DKADRN Cc1ccc(NC(=O)N(C)[C@H](C)c2cccc(Cl)c2)cc1C ZINC000409675852 332046716 /nfs/dbraw/zinc/04/67/16/332046716.db2.gz NAKGFQJSXFUEBH-CQSZACIVSA-N 0 0 316.832 5.182 20 0 DKADRN Cc1ccc(NC(=O)N2CCCCC[C@H]2c2ccccc2)cc1 ZINC000409676007 332047016 /nfs/dbraw/zinc/04/70/16/332047016.db2.gz QQNRFPOPOINHQL-IBGZPJMESA-N 0 0 308.425 5.144 20 0 DKADRN Cc1ccc(NC(=O)N2CCCCC[C@@H]2c2ccccc2)cc1 ZINC000409676009 332046893 /nfs/dbraw/zinc/04/68/93/332046893.db2.gz QQNRFPOPOINHQL-LJQANCHMSA-N 0 0 308.425 5.144 20 0 DKADRN Cc1cccc(NC(=O)N[C@H](c2ccccc2)C(C)(C)C)c1C ZINC000409676416 332044869 /nfs/dbraw/zinc/04/48/69/332044869.db2.gz RQANFQWYIOFCON-GOSISDBHSA-N 0 0 310.441 5.212 20 0 DKADRN Cc1cccc(NC(=O)N[C@@H](c2ccccc2)C(C)(C)C)c1C ZINC000409676417 332044928 /nfs/dbraw/zinc/04/49/28/332044928.db2.gz RQANFQWYIOFCON-SFHVURJKSA-N 0 0 310.441 5.212 20 0 DKADRN Cc1ccc(NC(=O)N[C@H](c2ccccc2)C(C)(C)C)c(C)c1 ZINC000409676666 332044921 /nfs/dbraw/zinc/04/49/21/332044921.db2.gz TYYMWGGVZMQLCP-GOSISDBHSA-N 0 0 310.441 5.212 20 0 DKADRN Cc1ccc(NC(=O)N[C@@H](c2ccccc2)C(C)(C)C)c(C)c1 ZINC000409676667 332045002 /nfs/dbraw/zinc/04/50/02/332045002.db2.gz TYYMWGGVZMQLCP-SFHVURJKSA-N 0 0 310.441 5.212 20 0 DKADRN Cc1c2ccccc2oc1[C@H](C)NC(=O)Nc1cccc(C)c1C ZINC000409677282 332045133 /nfs/dbraw/zinc/04/51/33/332045133.db2.gz XSMZKCVGUDZRTF-HNNXBMFYSA-N 0 0 322.408 5.241 20 0 DKADRN Cc1c2ccccc2oc1[C@@H](C)NC(=O)Nc1cccc(C)c1C ZINC000409677284 332045246 /nfs/dbraw/zinc/04/52/46/332045246.db2.gz XSMZKCVGUDZRTF-OAHLLOKOSA-N 0 0 322.408 5.241 20 0 DKADRN Cc1ccc(NC(=O)N2CCCCC[C@H]2c2ccccc2)c(C)c1 ZINC000409677495 332045071 /nfs/dbraw/zinc/04/50/71/332045071.db2.gz YMXYCZVBLJEXQB-FQEVSTJZSA-N 0 0 322.452 5.453 20 0 DKADRN Cc1ccc(NC(=O)N2CCCCC[C@@H]2c2ccccc2)c(C)c1 ZINC000409677496 332045176 /nfs/dbraw/zinc/04/51/76/332045176.db2.gz YMXYCZVBLJEXQB-HXUWFJFHSA-N 0 0 322.452 5.453 20 0 DKADRN Cc1ccc(NC(=O)N(C)[C@@H](C)c2ccccc2Cl)cc1C ZINC000409677499 332045232 /nfs/dbraw/zinc/04/52/32/332045232.db2.gz YOERJIKDAUBRBO-AWEZNQCLSA-N 0 0 316.832 5.182 20 0 DKADRN Cc1ccc(NC(=O)N(C)[C@H](C)c2ccccc2Cl)cc1C ZINC000409677500 332045212 /nfs/dbraw/zinc/04/52/12/332045212.db2.gz YOERJIKDAUBRBO-CQSZACIVSA-N 0 0 316.832 5.182 20 0 DKADRN CN(Cc1cccc2ccccc21)C(=O)Nc1ccccc1Cl ZINC000409678034 332045220 /nfs/dbraw/zinc/04/52/20/332045220.db2.gz KIKFUAGFWKJDRZ-UHFFFAOYSA-N 0 0 324.811 5.157 20 0 DKADRN C[C@H](c1ccccc1Cl)N(C)C(=O)Nc1cccc(Cl)c1 ZINC000409678173 332045093 /nfs/dbraw/zinc/04/50/93/332045093.db2.gz FLTORUGHNKCNGY-LLVKDONJSA-N 0 0 323.223 5.218 20 0 DKADRN C[C@@H](c1ccccc1Cl)N(C)C(=O)Nc1cccc(Cl)c1 ZINC000409678174 332045172 /nfs/dbraw/zinc/04/51/72/332045172.db2.gz FLTORUGHNKCNGY-NSHDSACASA-N 0 0 323.223 5.218 20 0 DKADRN Cc1ccc([C@@H](C)NC(=O)Nc2ccc(Cl)cc2Cl)cc1 ZINC000409678326 332045145 /nfs/dbraw/zinc/04/51/45/332045145.db2.gz BIFGCJQSWNLUCK-LLVKDONJSA-N 0 0 323.223 5.185 20 0 DKADRN Cc1ccc([C@H](C)NC(=O)Nc2ccc(Cl)cc2Cl)cc1 ZINC000409678327 332045112 /nfs/dbraw/zinc/04/51/12/332045112.db2.gz BIFGCJQSWNLUCK-NSHDSACASA-N 0 0 323.223 5.185 20 0 DKADRN Cc1cc(C)c(NC(=O)N[C@@H](c2ccccc2)C(C)(C)C)c(C)c1 ZINC000409678780 332045087 /nfs/dbraw/zinc/04/50/87/332045087.db2.gz NEIMMYIFKHDCTQ-IBGZPJMESA-N 0 0 324.468 5.521 20 0 DKADRN Cc1cc(C)c(NC(=O)N[C@H](c2ccccc2)C(C)(C)C)c(C)c1 ZINC000409678782 332045178 /nfs/dbraw/zinc/04/51/78/332045178.db2.gz NEIMMYIFKHDCTQ-LJQANCHMSA-N 0 0 324.468 5.521 20 0 DKADRN CC(C)(C)[C@@H](NC(=O)Nc1ccccc1Cl)c1ccccc1 ZINC000409680145 332045383 /nfs/dbraw/zinc/04/53/83/332045383.db2.gz URRWXJQLTMGAMO-INIZCTEOSA-N 0 0 316.832 5.249 20 0 DKADRN CC(C)(C)[C@H](NC(=O)Nc1ccccc1Cl)c1ccccc1 ZINC000409680149 332045336 /nfs/dbraw/zinc/04/53/36/332045336.db2.gz URRWXJQLTMGAMO-MRXNPFEDSA-N 0 0 316.832 5.249 20 0 DKADRN Cc1cc(Cl)ccc1NC(=O)N1CCC[C@H]1C1CCCCC1 ZINC000409680615 332045413 /nfs/dbraw/zinc/04/54/13/332045413.db2.gz NVFBTQBQVOQCOC-KRWDZBQOSA-N 0 0 320.864 5.225 20 0 DKADRN Cc1cc(Cl)ccc1NC(=O)N1CCC[C@@H]1C1CCCCC1 ZINC000409680618 332045295 /nfs/dbraw/zinc/04/52/95/332045295.db2.gz NVFBTQBQVOQCOC-QGZVFWFLSA-N 0 0 320.864 5.225 20 0 DKADRN CCN(C(=O)Nc1cccc(Cl)c1)[C@H](C)c1ccc(F)cc1 ZINC000409680830 332045435 /nfs/dbraw/zinc/04/54/35/332045435.db2.gz RPMFAOVYRWIFAK-GFCCVEGCSA-N 0 0 320.795 5.094 20 0 DKADRN CCN(C(=O)Nc1cccc(Cl)c1)[C@@H](C)c1ccc(F)cc1 ZINC000409680831 332045343 /nfs/dbraw/zinc/04/53/43/332045343.db2.gz RPMFAOVYRWIFAK-LBPRGKRZSA-N 0 0 320.795 5.094 20 0 DKADRN C[C@H](c1cccc(Cl)c1)N(C)C(=O)Nc1cccc(Cl)c1 ZINC000409682058 332045342 /nfs/dbraw/zinc/04/53/42/332045342.db2.gz XFBQMOPLCRJRSH-LLVKDONJSA-N 0 0 323.223 5.218 20 0 DKADRN C[C@@H](c1cccc(Cl)c1)N(C)C(=O)Nc1cccc(Cl)c1 ZINC000409682059 332045377 /nfs/dbraw/zinc/04/53/77/332045377.db2.gz XFBQMOPLCRJRSH-NSHDSACASA-N 0 0 323.223 5.218 20 0 DKADRN Cc1ccc(NC(=O)N(C)[C@H](C)c2ccccc2F)cc1Cl ZINC000409682104 332045305 /nfs/dbraw/zinc/04/53/05/332045305.db2.gz XSIBWGPEKRHCGV-GFCCVEGCSA-N 0 0 320.795 5.012 20 0 DKADRN Cc1ccc(NC(=O)N(C)[C@@H](C)c2ccccc2F)cc1Cl ZINC000409682105 332045298 /nfs/dbraw/zinc/04/52/98/332045298.db2.gz XSIBWGPEKRHCGV-LBPRGKRZSA-N 0 0 320.795 5.012 20 0 DKADRN Cc1ccc([C@H](C)NC(=O)Nc2cccc3ccccc32)cc1 ZINC000409684032 332045631 /nfs/dbraw/zinc/04/56/31/332045631.db2.gz HHVZWLNGOHTIJY-HNNXBMFYSA-N 0 0 304.393 5.031 20 0 DKADRN Cc1ccc([C@@H](C)NC(=O)Nc2cccc3ccccc32)cc1 ZINC000409684034 332045548 /nfs/dbraw/zinc/04/55/48/332045548.db2.gz HHVZWLNGOHTIJY-OAHLLOKOSA-N 0 0 304.393 5.031 20 0 DKADRN C[C@H](c1cccc(Cl)c1)N(C)C(=O)Nc1ccc(Cl)cc1 ZINC000409686168 332045812 /nfs/dbraw/zinc/04/58/12/332045812.db2.gz JAWYJRDDWRNMNM-LLVKDONJSA-N 0 0 323.223 5.218 20 0 DKADRN C[C@@H](c1cccc(Cl)c1)N(C)C(=O)Nc1ccc(Cl)cc1 ZINC000409686169 332045758 /nfs/dbraw/zinc/04/57/58/332045758.db2.gz JAWYJRDDWRNMNM-NSHDSACASA-N 0 0 323.223 5.218 20 0 DKADRN C[C@H](c1ccccc1Cl)N(C)C(=O)Nc1ccc(Cl)cc1 ZINC000409686270 332045880 /nfs/dbraw/zinc/04/58/80/332045880.db2.gz JUQUFDHYUQYLBW-LLVKDONJSA-N 0 0 323.223 5.218 20 0 DKADRN C[C@@H](c1ccccc1Cl)N(C)C(=O)Nc1ccc(Cl)cc1 ZINC000409686272 332045751 /nfs/dbraw/zinc/04/57/51/332045751.db2.gz JUQUFDHYUQYLBW-NSHDSACASA-N 0 0 323.223 5.218 20 0 DKADRN C[C@H](c1cccs1)N(C)C(=O)Nc1ccc(C(C)(C)C)cc1 ZINC000409686659 332045790 /nfs/dbraw/zinc/04/57/90/332045790.db2.gz PNJWDERICXAMSB-CYBMUJFWSA-N 0 0 316.470 5.271 20 0 DKADRN C[C@@H](c1cccs1)N(C)C(=O)Nc1ccc(C(C)(C)C)cc1 ZINC000409686660 332045853 /nfs/dbraw/zinc/04/58/53/332045853.db2.gz PNJWDERICXAMSB-ZDUSSCGKSA-N 0 0 316.470 5.271 20 0 DKADRN Cc1c(Cl)cccc1NC(=O)N1CCC[C@H]1C1CCCCC1 ZINC000409686667 332045782 /nfs/dbraw/zinc/04/57/82/332045782.db2.gz PRIYNPFHXJWVHW-KRWDZBQOSA-N 0 0 320.864 5.225 20 0 DKADRN Cc1c(Cl)cccc1NC(=O)N1CCC[C@@H]1C1CCCCC1 ZINC000409686668 332045783 /nfs/dbraw/zinc/04/57/83/332045783.db2.gz PRIYNPFHXJWVHW-QGZVFWFLSA-N 0 0 320.864 5.225 20 0 DKADRN CC(C)c1ccc(NC(=O)N(C)[C@@H](C)c2ccccc2F)cc1 ZINC000409687948 332045866 /nfs/dbraw/zinc/04/58/66/332045866.db2.gz UQKSQFJZTTVDSE-AWEZNQCLSA-N 0 0 314.404 5.174 20 0 DKADRN CC(C)c1ccc(NC(=O)N(C)[C@H](C)c2ccccc2F)cc1 ZINC000409687950 332045766 /nfs/dbraw/zinc/04/57/66/332045766.db2.gz UQKSQFJZTTVDSE-CQSZACIVSA-N 0 0 314.404 5.174 20 0 DKADRN CCc1cccc(C)c1NC(=O)N[C@@H](c1ccccc1)C(C)(C)C ZINC000409688789 332046063 /nfs/dbraw/zinc/04/60/63/332046063.db2.gz RAGFBISHOFSJME-IBGZPJMESA-N 0 0 324.468 5.466 20 0 DKADRN CCc1cccc(C)c1NC(=O)N[C@H](c1ccccc1)C(C)(C)C ZINC000409688807 332045997 /nfs/dbraw/zinc/04/59/97/332045997.db2.gz RAGFBISHOFSJME-LJQANCHMSA-N 0 0 324.468 5.466 20 0 DKADRN CCN(C(=O)Nc1ccc(Cl)cc1)[C@H](C)c1ccc(F)cc1 ZINC000409689554 332046083 /nfs/dbraw/zinc/04/60/83/332046083.db2.gz RTONTBIOMSLBTJ-GFCCVEGCSA-N 0 0 320.795 5.094 20 0 DKADRN CCN(C(=O)Nc1ccc(Cl)cc1)[C@@H](C)c1ccc(F)cc1 ZINC000409689556 332046107 /nfs/dbraw/zinc/04/61/07/332046107.db2.gz RTONTBIOMSLBTJ-LBPRGKRZSA-N 0 0 320.795 5.094 20 0 DKADRN C[C@@H](c1ccccc1F)N(C)C(=O)Nc1cccc2ccccc21 ZINC000409690266 332046120 /nfs/dbraw/zinc/04/61/20/332046120.db2.gz UYNUOMGWIXJTEW-AWEZNQCLSA-N 0 0 322.383 5.204 20 0 DKADRN C[C@H](c1ccccc1F)N(C)C(=O)Nc1cccc2ccccc21 ZINC000409690268 332045989 /nfs/dbraw/zinc/04/59/89/332045989.db2.gz UYNUOMGWIXJTEW-CQSZACIVSA-N 0 0 322.383 5.204 20 0 DKADRN CN(Cc1cccc2ccccc21)C(=O)Nc1ccc(Cl)cc1 ZINC000409690285 332046015 /nfs/dbraw/zinc/04/60/15/332046015.db2.gz VDVYOJMOKRCVBP-UHFFFAOYSA-N 0 0 324.811 5.157 20 0 DKADRN CC(C)c1ccccc1NC(=O)N(C)CCCCc1ccccc1 ZINC000409692649 332048015 /nfs/dbraw/zinc/04/80/15/332048015.db2.gz QKLBCQSZJDOIBA-UHFFFAOYSA-N 0 0 324.468 5.297 20 0 DKADRN CCCCc1ccc(NC(=O)N(C)[C@@H](C)c2cccs2)cc1 ZINC000409694208 332047160 /nfs/dbraw/zinc/04/71/60/332047160.db2.gz AYXVRJUDOOVIGE-AWEZNQCLSA-N 0 0 316.470 5.316 20 0 DKADRN CCCCc1ccc(NC(=O)N(C)[C@H](C)c2cccs2)cc1 ZINC000409694209 332047120 /nfs/dbraw/zinc/04/71/20/332047120.db2.gz AYXVRJUDOOVIGE-CQSZACIVSA-N 0 0 316.470 5.316 20 0 DKADRN CC(C)c1ccccc1NC(=O)N1CCC[C@H]1C1CCCCC1 ZINC000409697820 332048668 /nfs/dbraw/zinc/04/86/68/332048668.db2.gz NRRWJODRKDEGJW-IBGZPJMESA-N 0 0 314.473 5.387 20 0 DKADRN CC(C)c1ccccc1NC(=O)N1CCC[C@@H]1C1CCCCC1 ZINC000409697828 332048641 /nfs/dbraw/zinc/04/86/41/332048641.db2.gz NRRWJODRKDEGJW-LJQANCHMSA-N 0 0 314.473 5.387 20 0 DKADRN Cc1cc(C)cc(NC(=O)N(C)[C@@H](C)c2ccccc2Cl)c1 ZINC000409700571 332048767 /nfs/dbraw/zinc/04/87/67/332048767.db2.gz NDORHUSHJUTKLZ-AWEZNQCLSA-N 0 0 316.832 5.182 20 0 DKADRN Cc1cc(C)cc(NC(=O)N(C)[C@H](C)c2ccccc2Cl)c1 ZINC000409700572 332048921 /nfs/dbraw/zinc/04/89/21/332048921.db2.gz NDORHUSHJUTKLZ-CQSZACIVSA-N 0 0 316.832 5.182 20 0 DKADRN Cc1ccc(NC(=O)N(C)[C@H](C)c2cccc(Cl)c2)cc1F ZINC000409701788 332048964 /nfs/dbraw/zinc/04/89/64/332048964.db2.gz BHOYHYTUENQSPE-GFCCVEGCSA-N 0 0 320.795 5.012 20 0 DKADRN Cc1ccc(NC(=O)N(C)[C@@H](C)c2cccc(Cl)c2)cc1F ZINC000409701790 332049070 /nfs/dbraw/zinc/04/90/70/332049070.db2.gz BHOYHYTUENQSPE-LBPRGKRZSA-N 0 0 320.795 5.012 20 0 DKADRN Cc1cc(C)cc(NC(=O)N(C)[C@@H](C)c2cccc(Cl)c2)c1 ZINC000409702170 332049118 /nfs/dbraw/zinc/04/91/18/332049118.db2.gz SYKFZIOBKFKMKK-AWEZNQCLSA-N 0 0 316.832 5.182 20 0 DKADRN Cc1cc(C)cc(NC(=O)N(C)[C@H](C)c2cccc(Cl)c2)c1 ZINC000409702171 332049120 /nfs/dbraw/zinc/04/91/20/332049120.db2.gz SYKFZIOBKFKMKK-CQSZACIVSA-N 0 0 316.832 5.182 20 0 DKADRN CCN(C(=O)Nc1cc(C)cc(C)c1)[C@@H](C)c1ccc(F)cc1 ZINC000409703565 332048939 /nfs/dbraw/zinc/04/89/39/332048939.db2.gz AWLORDXMHHGREP-HNNXBMFYSA-N 0 0 314.404 5.058 20 0 DKADRN CCN(C(=O)Nc1cc(C)cc(C)c1)[C@H](C)c1ccc(F)cc1 ZINC000409703567 332048957 /nfs/dbraw/zinc/04/89/57/332048957.db2.gz AWLORDXMHHGREP-OAHLLOKOSA-N 0 0 314.404 5.058 20 0 DKADRN CN(C(=O)Nc1c(F)cccc1F)C1CCC(C(C)(C)C)CC1 ZINC000409704205 332048042 /nfs/dbraw/zinc/04/80/42/332048042.db2.gz DFJKCWNNSSYVAW-UHFFFAOYSA-N 0 0 324.415 5.033 20 0 DKADRN Cc1ccccc1C[C@H](C)NC(=O)Nc1ccccc1C(C)(C)C ZINC000409705722 332048082 /nfs/dbraw/zinc/04/80/82/332048082.db2.gz NUEPJAMBTLBAPZ-INIZCTEOSA-N 0 0 324.468 5.045 20 0 DKADRN Cc1ccccc1C[C@@H](C)NC(=O)Nc1ccccc1C(C)(C)C ZINC000409705723 332048214 /nfs/dbraw/zinc/04/82/14/332048214.db2.gz NUEPJAMBTLBAPZ-MRXNPFEDSA-N 0 0 324.468 5.045 20 0 DKADRN Cc1ccc(F)cc1NC(=O)N[C@@H](c1ccccc1)C(C)(C)C ZINC000409707941 332048648 /nfs/dbraw/zinc/04/86/48/332048648.db2.gz VANZAPYNVVEIFB-KRWDZBQOSA-N 0 0 314.404 5.043 20 0 DKADRN Cc1ccc(F)cc1NC(=O)N[C@H](c1ccccc1)C(C)(C)C ZINC000409707942 332048645 /nfs/dbraw/zinc/04/86/45/332048645.db2.gz VANZAPYNVVEIFB-QGZVFWFLSA-N 0 0 314.404 5.043 20 0 DKADRN O=C(Nc1ccc(Cl)cc1F)N1CCC[C@H]1C1CCCCC1 ZINC000409708027 332048549 /nfs/dbraw/zinc/04/85/49/332048549.db2.gz WKGJRDWDTRCGAU-INIZCTEOSA-N 0 0 324.827 5.056 20 0 DKADRN O=C(Nc1ccc(Cl)cc1F)N1CCC[C@@H]1C1CCCCC1 ZINC000409708028 332048653 /nfs/dbraw/zinc/04/86/53/332048653.db2.gz WKGJRDWDTRCGAU-MRXNPFEDSA-N 0 0 324.827 5.056 20 0 DKADRN CCc1ccc(NC(=O)N(C)[C@H](C)c2cccc(Cl)c2)cc1 ZINC000409708769 332048289 /nfs/dbraw/zinc/04/82/89/332048289.db2.gz KYUVRKYZOZGWOM-CYBMUJFWSA-N 0 0 316.832 5.127 20 0 DKADRN CCc1ccc(NC(=O)N(C)[C@@H](C)c2cccc(Cl)c2)cc1 ZINC000409708770 332048264 /nfs/dbraw/zinc/04/82/64/332048264.db2.gz KYUVRKYZOZGWOM-ZDUSSCGKSA-N 0 0 316.832 5.127 20 0 DKADRN Cc1ccc([C@H](C)NC(=O)Nc2ccccc2C(C)(C)C)cc1 ZINC000409708836 332049994 /nfs/dbraw/zinc/04/99/94/332049994.db2.gz LOMFKKHVPIHEPA-HNNXBMFYSA-N 0 0 310.441 5.175 20 0 DKADRN Cc1ccc([C@@H](C)NC(=O)Nc2ccccc2C(C)(C)C)cc1 ZINC000409708838 332049888 /nfs/dbraw/zinc/04/98/88/332049888.db2.gz LOMFKKHVPIHEPA-OAHLLOKOSA-N 0 0 310.441 5.175 20 0 DKADRN Cc1ccc([C@H](C)NC(=O)Nc2c(C)cccc2C(C)C)cc1 ZINC000409709768 332050105 /nfs/dbraw/zinc/05/01/05/332050105.db2.gz PDBNXHWGRQJFMK-INIZCTEOSA-N 0 0 310.441 5.310 20 0 DKADRN Cc1ccc([C@@H](C)NC(=O)Nc2c(C)cccc2C(C)C)cc1 ZINC000409709773 332050102 /nfs/dbraw/zinc/05/01/02/332050102.db2.gz PDBNXHWGRQJFMK-MRXNPFEDSA-N 0 0 310.441 5.310 20 0 DKADRN CCc1ccc(NC(=O)N(C)[C@H](C)c2ccccc2Cl)cc1 ZINC000409712050 332050087 /nfs/dbraw/zinc/05/00/87/332050087.db2.gz WSNJRORYPPTVPV-CYBMUJFWSA-N 0 0 316.832 5.127 20 0 DKADRN CCc1ccc(NC(=O)N(C)[C@@H](C)c2ccccc2Cl)cc1 ZINC000409712051 332050238 /nfs/dbraw/zinc/05/02/38/332050238.db2.gz WSNJRORYPPTVPV-ZDUSSCGKSA-N 0 0 316.832 5.127 20 0 DKADRN C(=C\c1nc2ccccc2o1)\c1cnc(-c2ccccc2)s1 ZINC000409712144 332050066 /nfs/dbraw/zinc/05/00/66/332050066.db2.gz XNXIJUQWJLMRJA-KHPPLWFESA-N 0 0 304.374 5.122 20 0 DKADRN C(=C/c1nc2ccccc2o1)\c1cnc(-c2ccccc2)s1 ZINC000409712145 332050198 /nfs/dbraw/zinc/05/01/98/332050198.db2.gz XNXIJUQWJLMRJA-ZHACJKMWSA-N 0 0 304.374 5.122 20 0 DKADRN CCC1CCC(NC(=O)Nc2ccccc2C(C)(C)C)CC1 ZINC000409712408 332050184 /nfs/dbraw/zinc/05/01/84/332050184.db2.gz YCUGBLGGDICBMO-UHFFFAOYSA-N 0 0 302.462 5.074 20 0 DKADRN CCc1ccc(NC(=O)N2CCCCC[C@H]2c2ccccc2)cc1 ZINC000409713410 332049258 /nfs/dbraw/zinc/04/92/58/332049258.db2.gz HCEGLDOAQLUNIK-FQEVSTJZSA-N 0 0 322.452 5.398 20 0 DKADRN CCc1ccc(NC(=O)N2CCCCC[C@@H]2c2ccccc2)cc1 ZINC000409713415 332049328 /nfs/dbraw/zinc/04/93/28/332049328.db2.gz HCEGLDOAQLUNIK-HXUWFJFHSA-N 0 0 322.452 5.398 20 0 DKADRN Cc1ccccc1C[C@H](C)NC(=O)Nc1c(C)cccc1C(C)C ZINC000409715525 332049512 /nfs/dbraw/zinc/04/95/12/332049512.db2.gz RPAFPELIJGPOPI-KRWDZBQOSA-N 0 0 324.468 5.180 20 0 DKADRN Cc1ccccc1C[C@@H](C)NC(=O)Nc1c(C)cccc1C(C)C ZINC000409715526 332049516 /nfs/dbraw/zinc/04/95/16/332049516.db2.gz RPAFPELIJGPOPI-QGZVFWFLSA-N 0 0 324.468 5.180 20 0 DKADRN Cc1cc(C)cc(NC(=O)N2CCCCC[C@H]2c2ccccc2)c1 ZINC000409715657 332049485 /nfs/dbraw/zinc/04/94/85/332049485.db2.gz SSTRHDPPENDABX-FQEVSTJZSA-N 0 0 322.452 5.453 20 0 DKADRN Cc1cc(C)cc(NC(=O)N2CCCCC[C@@H]2c2ccccc2)c1 ZINC000409715658 332049424 /nfs/dbraw/zinc/04/94/24/332049424.db2.gz SSTRHDPPENDABX-HXUWFJFHSA-N 0 0 322.452 5.453 20 0 DKADRN Cc1ccc(NC(=O)N(C)[C@H](C)c2ccccc2Cl)cc1F ZINC000409716056 332049426 /nfs/dbraw/zinc/04/94/26/332049426.db2.gz VUBNJDOJVQSHRD-GFCCVEGCSA-N 0 0 320.795 5.012 20 0 DKADRN Cc1ccc(NC(=O)N(C)[C@@H](C)c2ccccc2Cl)cc1F ZINC000409716057 332049470 /nfs/dbraw/zinc/04/94/70/332049470.db2.gz VUBNJDOJVQSHRD-LBPRGKRZSA-N 0 0 320.795 5.012 20 0 DKADRN Cc1ccc(NC(=O)N[C@@H](c2ccccc2)C(C)(C)C)c(F)c1 ZINC000409722297 332051132 /nfs/dbraw/zinc/05/11/32/332051132.db2.gz OAPMVZBCMWFSFU-KRWDZBQOSA-N 0 0 314.404 5.043 20 0 DKADRN Cc1ccc(NC(=O)N[C@H](c2ccccc2)C(C)(C)C)c(F)c1 ZINC000409722298 332051248 /nfs/dbraw/zinc/05/12/48/332051248.db2.gz OAPMVZBCMWFSFU-QGZVFWFLSA-N 0 0 314.404 5.043 20 0 DKADRN CCc1cccc(NC(=O)N2CCCCC[C@H]2c2ccccc2)c1 ZINC000409741442 332051924 /nfs/dbraw/zinc/05/19/24/332051924.db2.gz AWHJIQGHJLJREW-FQEVSTJZSA-N 0 0 322.452 5.398 20 0 DKADRN CCc1cccc(NC(=O)N2CCCCC[C@@H]2c2ccccc2)c1 ZINC000409741443 332052110 /nfs/dbraw/zinc/05/21/10/332052110.db2.gz AWHJIQGHJLJREW-HXUWFJFHSA-N 0 0 322.452 5.398 20 0 DKADRN CCc1cccc(NC(=O)N(C)[C@H](C)c2cccc(Cl)c2)c1 ZINC000409742372 332052326 /nfs/dbraw/zinc/05/23/26/332052326.db2.gz DBSPRFXFOUYGKZ-CYBMUJFWSA-N 0 0 316.832 5.127 20 0 DKADRN CCc1cccc(NC(=O)N(C)[C@@H](C)c2cccc(Cl)c2)c1 ZINC000409742374 332052367 /nfs/dbraw/zinc/05/23/67/332052367.db2.gz DBSPRFXFOUYGKZ-ZDUSSCGKSA-N 0 0 316.832 5.127 20 0 DKADRN CCc1cccc(CC)c1NC(=O)N[C@@H](C)c1ccc(C)cc1 ZINC000409743360 332052159 /nfs/dbraw/zinc/05/21/59/332052159.db2.gz HADGJLDUFIZLTG-HNNXBMFYSA-N 0 0 310.441 5.003 20 0 DKADRN CCc1cccc(CC)c1NC(=O)N[C@H](C)c1ccc(C)cc1 ZINC000409743365 332052154 /nfs/dbraw/zinc/05/21/54/332052154.db2.gz HADGJLDUFIZLTG-OAHLLOKOSA-N 0 0 310.441 5.003 20 0 DKADRN CCc1cccc(NC(=O)N(C)[C@H](C)c2ccccc2Cl)c1 ZINC000409747025 332052228 /nfs/dbraw/zinc/05/22/28/332052228.db2.gz SJSQHWWZUATMSO-CYBMUJFWSA-N 0 0 316.832 5.127 20 0 DKADRN CCc1cccc(NC(=O)N(C)[C@@H](C)c2ccccc2Cl)c1 ZINC000409747027 332052289 /nfs/dbraw/zinc/05/22/89/332052289.db2.gz SJSQHWWZUATMSO-ZDUSSCGKSA-N 0 0 316.832 5.127 20 0 DKADRN Cc1ccc(F)c(NC(=O)N[C@@H](c2ccccc2)C(C)(C)C)c1 ZINC000409747518 332054283 /nfs/dbraw/zinc/05/42/83/332054283.db2.gz DRDWXESLLXORBQ-KRWDZBQOSA-N 0 0 314.404 5.043 20 0 DKADRN Cc1ccc(F)c(NC(=O)N[C@H](c2ccccc2)C(C)(C)C)c1 ZINC000409747520 332054237 /nfs/dbraw/zinc/05/42/37/332054237.db2.gz DRDWXESLLXORBQ-QGZVFWFLSA-N 0 0 314.404 5.043 20 0 DKADRN Cc1cccc(C)c1NC(=O)N[C@H](c1ccccc1)C(C)(C)C ZINC000409758307 332054181 /nfs/dbraw/zinc/05/41/81/332054181.db2.gz NTGAEHOGSVYJTQ-GOSISDBHSA-N 0 0 310.441 5.212 20 0 DKADRN Cc1cccc(C)c1NC(=O)N[C@@H](c1ccccc1)C(C)(C)C ZINC000409758309 332054193 /nfs/dbraw/zinc/05/41/93/332054193.db2.gz NTGAEHOGSVYJTQ-SFHVURJKSA-N 0 0 310.441 5.212 20 0 DKADRN Cc1ccc(Cl)cc1NC(=O)N1CCC[C@H]1C1CCCCC1 ZINC000409759853 332054240 /nfs/dbraw/zinc/05/42/40/332054240.db2.gz TYVVREDXTMNPFY-KRWDZBQOSA-N 0 0 320.864 5.225 20 0 DKADRN Cc1ccc(Cl)cc1NC(=O)N1CCC[C@@H]1C1CCCCC1 ZINC000409759855 332054162 /nfs/dbraw/zinc/05/41/62/332054162.db2.gz TYVVREDXTMNPFY-QGZVFWFLSA-N 0 0 320.864 5.225 20 0 DKADRN Cc1cccc(C)c1NC(=O)N[C@@H](c1ccccc1)C1CCCC1 ZINC000409760227 332054149 /nfs/dbraw/zinc/05/41/49/332054149.db2.gz UVZJOYLGCZEGAT-FQEVSTJZSA-N 0 0 322.452 5.356 20 0 DKADRN Cc1cccc(C)c1NC(=O)N[C@H](c1ccccc1)C1CCCC1 ZINC000409760229 332054235 /nfs/dbraw/zinc/05/42/35/332054235.db2.gz UVZJOYLGCZEGAT-HXUWFJFHSA-N 0 0 322.452 5.356 20 0 DKADRN Cc1cccc(C)c1NC(=O)N(C)C1CCC(C(C)(C)C)CC1 ZINC000409761374 332054471 /nfs/dbraw/zinc/05/44/71/332054471.db2.gz XXJPMOMYQXTWER-UHFFFAOYSA-N 0 0 316.489 5.372 20 0 DKADRN CCC1CCC(N(C(=O)c2sccc2SC)C2CC2)CC1 ZINC000409792846 332056389 /nfs/dbraw/zinc/05/63/89/332056389.db2.gz SQEABJOVMFGFAT-UHFFFAOYSA-N 0 0 323.527 5.043 20 0 DKADRN CCN(CC)C(=O)Nc1ccccc1Oc1ccc(Cl)cc1 ZINC000409821992 332058343 /nfs/dbraw/zinc/05/83/43/332058343.db2.gz NTCLOQGOYZLYOD-UHFFFAOYSA-N 0 0 318.804 5.006 20 0 DKADRN CSc1ccccc1[C@@H](C)[NH2+][C@@H](C)c1cc(F)ccc1F ZINC000409834488 332059076 /nfs/dbraw/zinc/05/90/76/332059076.db2.gz DVVCVVJURGZKSP-NEPJUHHUSA-N 0 0 307.409 5.099 20 0 DKADRN CSc1ccccc1[C@@H](C)[NH2+][C@H](C)c1cc(F)ccc1F ZINC000409834489 332058944 /nfs/dbraw/zinc/05/89/44/332058944.db2.gz DVVCVVJURGZKSP-VXGBXAGGSA-N 0 0 307.409 5.099 20 0 DKADRN CSc1ccccc1[C@@H](C)[NH2+][C@@H](C)c1ccc(F)c(F)c1 ZINC000409844240 332059676 /nfs/dbraw/zinc/05/96/76/332059676.db2.gz LDAZGQAERRBILA-NWDGAFQWSA-N 0 0 307.409 5.099 20 0 DKADRN CSc1ccccc1[C@@H](C)[NH2+][C@H](C)c1ccc(F)c(F)c1 ZINC000409844241 332059654 /nfs/dbraw/zinc/05/96/54/332059654.db2.gz LDAZGQAERRBILA-VXGBXAGGSA-N 0 0 307.409 5.099 20 0 DKADRN CSc1cccc(F)c1C(=O)Nc1cccc2ccsc21 ZINC000409847445 332058701 /nfs/dbraw/zinc/05/87/01/332058701.db2.gz FCYPSRZCSLEUPK-UHFFFAOYSA-N 0 0 317.410 5.015 20 0 DKADRN CCCCOc1ccccc1NC(=O)c1oc2ccccc2c1C ZINC000409852627 332060758 /nfs/dbraw/zinc/06/07/58/332060758.db2.gz IUUXNGBKHMEHHJ-UHFFFAOYSA-N 0 0 323.392 5.172 20 0 DKADRN CCCCOc1ccccc1NC(=O)c1cc(C)c(CC)s1 ZINC000409856451 332061082 /nfs/dbraw/zinc/06/10/82/332061082.db2.gz HCHINVGSVCKWRT-UHFFFAOYSA-N 0 0 317.454 5.050 20 0 DKADRN CCCCOc1ccccc1NC(=O)c1ccc2ccccc2c1 ZINC000409857841 332061089 /nfs/dbraw/zinc/06/10/89/332061089.db2.gz LUNNJGNVQBLMPJ-UHFFFAOYSA-N 0 0 319.404 5.271 20 0 DKADRN CCCCOc1ccccc1NC(=O)c1cc(CC)c(C)s1 ZINC000409861916 332060100 /nfs/dbraw/zinc/06/01/00/332060100.db2.gz WSILXVDSQLDISN-UHFFFAOYSA-N 0 0 317.454 5.050 20 0 DKADRN CSc1ccccc1[C@@H](C)N[C@H](C)c1ncc(C(C)(C)C)o1 ZINC000409870052 332061873 /nfs/dbraw/zinc/06/18/73/332061873.db2.gz LZWUNFKUHUMVLV-CHWSQXEVSA-N 0 0 318.486 5.106 20 0 DKADRN CSc1ccccc1[C@@H](C)N[C@@H](C)c1ncc(C(C)(C)C)o1 ZINC000409870053 332061940 /nfs/dbraw/zinc/06/19/40/332061940.db2.gz LZWUNFKUHUMVLV-OLZOCXBDSA-N 0 0 318.486 5.106 20 0 DKADRN CSc1cccc(F)c1C(=O)Nc1csc2ccccc12 ZINC000409908936 332064112 /nfs/dbraw/zinc/06/41/12/332064112.db2.gz JMTDPSCNVFZKER-UHFFFAOYSA-N 0 0 317.410 5.015 20 0 DKADRN CSc1ccsc1C(=O)N(c1cc(C)ccc1C)C(C)C ZINC000409911608 332064149 /nfs/dbraw/zinc/06/41/49/332064149.db2.gz NGAMDDUIVNSVER-UHFFFAOYSA-N 0 0 319.495 5.142 20 0 DKADRN O=C(Nc1cccc(C(F)F)c1Cl)[C@@H]1CCCC(F)(F)C1 ZINC000409953153 332067536 /nfs/dbraw/zinc/06/75/36/332067536.db2.gz SGAMOEGMSAPHSV-MRVPVSSYSA-N 0 0 323.717 5.042 20 0 DKADRN O=C(Nc1cccc(C(F)F)c1Cl)[C@H]1CCCC(F)(F)C1 ZINC000409953156 332067593 /nfs/dbraw/zinc/06/75/93/332067593.db2.gz SGAMOEGMSAPHSV-QMMMGPOBSA-N 0 0 323.717 5.042 20 0 DKADRN CCCC[C@H](C)C(=O)Nc1ccccc1COC(C)(C)CC ZINC000409968499 332069479 /nfs/dbraw/zinc/06/94/79/332069479.db2.gz YHISDXHTBCOOJM-HNNXBMFYSA-N 0 0 305.462 5.157 20 0 DKADRN CCCC[C@@H](C)C(=O)Nc1ccccc1COC(C)(C)CC ZINC000409968501 332069670 /nfs/dbraw/zinc/06/96/70/332069670.db2.gz YHISDXHTBCOOJM-OAHLLOKOSA-N 0 0 305.462 5.157 20 0 DKADRN Cc1cc(Cl)c(NC(=O)[C@@H]2CCCC(F)(F)C2)cc1Cl ZINC000409981124 332070881 /nfs/dbraw/zinc/07/08/81/332070881.db2.gz QVIZQBAYQBTLHQ-SECBINFHSA-N 0 0 322.182 5.066 20 0 DKADRN Cc1cc(Cl)c(NC(=O)[C@H]2CCCC(F)(F)C2)cc1Cl ZINC000409981125 332070854 /nfs/dbraw/zinc/07/08/54/332070854.db2.gz QVIZQBAYQBTLHQ-VIFPVBQESA-N 0 0 322.182 5.066 20 0 DKADRN O=C(C[C@@H]1CCCc2ccccc21)Nc1cccc(C(F)F)c1 ZINC000409989368 332072349 /nfs/dbraw/zinc/07/23/49/332072349.db2.gz TXGPKQCIOVJJHJ-AWEZNQCLSA-N 0 0 315.363 5.073 20 0 DKADRN O=C(C[C@H]1CCCc2ccccc21)Nc1cccc(C(F)F)c1 ZINC000409989370 332072199 /nfs/dbraw/zinc/07/21/99/332072199.db2.gz TXGPKQCIOVJJHJ-CQSZACIVSA-N 0 0 315.363 5.073 20 0 DKADRN O=C(Nc1cccc2[nH]ccc21)c1sccc1-c1ccccc1 ZINC000409989410 332072293 /nfs/dbraw/zinc/07/22/93/332072293.db2.gz UOQXBXUYKBNMDC-UHFFFAOYSA-N 0 0 318.401 5.149 20 0 DKADRN CCCC[C@H](C)C(=O)Nc1cccc(COC(C)(C)C)c1C ZINC000409994503 332074175 /nfs/dbraw/zinc/07/41/75/332074175.db2.gz SZAORFXTSKVHTO-AWEZNQCLSA-N 0 0 305.462 5.075 20 0 DKADRN CCCC[C@@H](C)C(=O)Nc1cccc(COC(C)(C)C)c1C ZINC000409994504 332074118 /nfs/dbraw/zinc/07/41/18/332074118.db2.gz SZAORFXTSKVHTO-CQSZACIVSA-N 0 0 305.462 5.075 20 0 DKADRN CSc1cccc(F)c1C(=O)Nc1ccc(C2CCC2)cc1 ZINC000410005923 332074647 /nfs/dbraw/zinc/07/46/47/332074647.db2.gz WWSIEXFJGAFQQN-UHFFFAOYSA-N 0 0 315.413 5.067 20 0 DKADRN CCc1ccccc1NC(=O)N[C@H](c1ccccc1)C(C)(C)C ZINC000410020058 332082074 /nfs/dbraw/zinc/08/20/74/332082074.db2.gz HLOHKHRKLGSNKP-GOSISDBHSA-N 0 0 310.441 5.158 20 0 DKADRN CCc1ccccc1NC(=O)N[C@@H](c1ccccc1)C(C)(C)C ZINC000410020059 332082169 /nfs/dbraw/zinc/08/21/69/332082169.db2.gz HLOHKHRKLGSNKP-SFHVURJKSA-N 0 0 310.441 5.158 20 0 DKADRN Cc1cc(F)ccc1NC(=O)N[C@@H](c1ccccc1)C(C)(C)C ZINC000410020777 332082089 /nfs/dbraw/zinc/08/20/89/332082089.db2.gz RCOHGMWONFMLGP-KRWDZBQOSA-N 0 0 314.404 5.043 20 0 DKADRN Cc1cc(F)ccc1NC(=O)N[C@H](c1ccccc1)C(C)(C)C ZINC000410020779 332082118 /nfs/dbraw/zinc/08/21/18/332082118.db2.gz RCOHGMWONFMLGP-QGZVFWFLSA-N 0 0 314.404 5.043 20 0 DKADRN CCc1ccccc1NC(=O)N1CCCCC[C@H]1c1ccccc1 ZINC000410023965 332083086 /nfs/dbraw/zinc/08/30/86/332083086.db2.gz ZNELILPGAJTAMX-FQEVSTJZSA-N 0 0 322.452 5.398 20 0 DKADRN CCc1ccccc1NC(=O)N1CCCCC[C@@H]1c1ccccc1 ZINC000410023966 332083101 /nfs/dbraw/zinc/08/31/01/332083101.db2.gz ZNELILPGAJTAMX-HXUWFJFHSA-N 0 0 322.452 5.398 20 0 DKADRN CC[C@H](C)N(C)C(=O)Nc1ccc(Oc2ccc(C)cc2)cc1 ZINC000410025508 332083325 /nfs/dbraw/zinc/08/33/25/332083325.db2.gz JKZBJOVEZRQHBO-HNNXBMFYSA-N 0 0 312.413 5.050 20 0 DKADRN CC[C@@H](C)N(C)C(=O)Nc1ccc(Oc2ccc(C)cc2)cc1 ZINC000410025511 332083360 /nfs/dbraw/zinc/08/33/60/332083360.db2.gz JKZBJOVEZRQHBO-OAHLLOKOSA-N 0 0 312.413 5.050 20 0 DKADRN CC[C@H](C)N(C)C(=O)Nc1ccc(Oc2cccc(C)c2)cc1 ZINC000410026059 332083377 /nfs/dbraw/zinc/08/33/77/332083377.db2.gz MZJTZBWKURNCIU-HNNXBMFYSA-N 0 0 312.413 5.050 20 0 DKADRN CC[C@@H](C)N(C)C(=O)Nc1ccc(Oc2cccc(C)c2)cc1 ZINC000410026060 332083424 /nfs/dbraw/zinc/08/34/24/332083424.db2.gz MZJTZBWKURNCIU-OAHLLOKOSA-N 0 0 312.413 5.050 20 0 DKADRN CCc1ccccc1NC(=O)N[C@@H](C)c1oc2ccccc2c1C ZINC000410026209 332083288 /nfs/dbraw/zinc/08/32/88/332083288.db2.gz LXKXSZZDBOGYLB-AWEZNQCLSA-N 0 0 322.408 5.186 20 0 DKADRN CCc1ccccc1NC(=O)N[C@H](C)c1oc2ccccc2c1C ZINC000410026210 332083428 /nfs/dbraw/zinc/08/34/28/332083428.db2.gz LXKXSZZDBOGYLB-CQSZACIVSA-N 0 0 322.408 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CC[C@@H](N[C@@H](C)c1csc(-c2ccccc2)n1)c1ccncc1 ZINC000414068130 333890803 /nfs/dbraw/zinc/89/08/03/333890803.db2.gz AVWIGQUMDJMSIR-WMLDXEAASA-N 0 0 323.465 5.007 20 0 DKADRN C[C@H](NC1(c2ccccc2)CC1)c1csc(-c2ccccc2)n1 ZINC000414090225 333894397 /nfs/dbraw/zinc/89/43/97/333894397.db2.gz BSYQDQMWSNETQU-HNNXBMFYSA-N 0 0 320.461 5.150 20 0 DKADRN C[C@@H](NC1(c2ccccc2)CC1)c1csc(-c2ccccc2)n1 ZINC000414090231 333894368 /nfs/dbraw/zinc/89/43/68/333894368.db2.gz BSYQDQMWSNETQU-OAHLLOKOSA-N 0 0 320.461 5.150 20 0 DKADRN COc1ccc([C@@H](C)Nc2ccc(C)c(-c3ncco3)c2)c(C)c1 ZINC000414109829 333897849 /nfs/dbraw/zinc/89/78/49/333897849.db2.gz NNTCSVPNAYXFQP-OAHLLOKOSA-N 0 0 322.408 5.140 20 0 DKADRN C[C@@H](N[C@@H](C)c1cncc(F)c1)c1cc(Cl)sc1Cl ZINC000414154311 333904072 /nfs/dbraw/zinc/90/40/72/333904072.db2.gz KYEGVIXCEITIFM-JGVFFNPUSA-N 0 0 319.232 5.001 20 0 DKADRN CSc1cc(N[C@@H](C)c2cnn(C(C)C)c2)ccc1Cl ZINC000414229892 333926160 /nfs/dbraw/zinc/92/61/60/333926160.db2.gz FSWIRVQBDWKCPA-NSHDSACASA-N 0 0 309.866 5.012 20 0 DKADRN CC[C@H](c1ccccc1)[S@@](=O)C1CCC(C(F)(F)F)CC1 ZINC000414260656 333929142 /nfs/dbraw/zinc/92/91/42/333929142.db2.gz HMPCVYVBHPHTPD-BWTQKZCBSA-N 0 0 318.404 5.008 20 0 DKADRN CC[C@@H](c1ccccc1)[S@@](=O)C1CCC(C(F)(F)F)CC1 ZINC000414260666 333929164 /nfs/dbraw/zinc/92/91/64/333929164.db2.gz HMPCVYVBHPHTPD-NUYFAKNASA-N 0 0 318.404 5.008 20 0 DKADRN CC[C@@H](c1ccccc1)[S@](=O)C1CCC(C(F)(F)F)CC1 ZINC000414260670 333929244 /nfs/dbraw/zinc/92/92/44/333929244.db2.gz HMPCVYVBHPHTPD-XSSWVLNGSA-N 0 0 318.404 5.008 20 0 DKADRN CSc1cc(C)ccc1NCc1cnc(C2CCC2)s1 ZINC000414495703 333997191 /nfs/dbraw/zinc/99/71/91/333997191.db2.gz OHUZXPKOLRTIOU-UHFFFAOYSA-N 0 0 304.484 5.053 20 0 DKADRN CS[C@@H](C(=O)Nc1c(C)cccc1C(C)C)c1ccccc1 ZINC000414656018 334058395 /nfs/dbraw/zinc/05/83/95/334058395.db2.gz FBRAKMBDPYMCRV-GOSISDBHSA-N 0 0 313.466 5.161 20 0 DKADRN CS[C@H](C(=O)Nc1c(C)cccc1C(C)C)c1ccccc1 ZINC000414656019 334058394 /nfs/dbraw/zinc/05/83/94/334058394.db2.gz 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C[C@@H](NCc1csc(-c2ccoc2)n1)c1ccc(C2CC2)cc1 ZINC000419366993 337481130 /nfs/dbraw/zinc/48/11/30/337481130.db2.gz ZTYDTWIFZBYPAI-CYBMUJFWSA-N 0 0 324.449 5.131 20 0 DKADRN Cc1nc(C(C)C)ccc1CS[C@@H](C)c1nc(C(C)C)no1 ZINC000419388538 337481616 /nfs/dbraw/zinc/48/16/16/337481616.db2.gz SAXQLFVITFBOHF-ZDUSSCGKSA-N 0 0 319.474 5.014 20 0 DKADRN C[C@@H](SCc1nnc(C2CC2)s1)c1cccc(Cl)c1 ZINC000419399112 337482114 /nfs/dbraw/zinc/48/21/14/337482114.db2.gz IZAPPNXCOIBXQT-SECBINFHSA-N 0 0 310.875 5.063 20 0 DKADRN CC(C)c1nnc(CSCc2ccc(C(F)F)cc2)s1 ZINC000419455107 337485124 /nfs/dbraw/zinc/48/51/24/337485124.db2.gz VWCSTUPWYFGKOH-UHFFFAOYSA-N 0 0 314.426 5.033 20 0 DKADRN c1sc(CSCc2cnc3ccccc3c2)nc1C1CC1 ZINC000419464390 337485652 /nfs/dbraw/zinc/48/56/52/337485652.db2.gz QZEVDWPSFMGXPW-UHFFFAOYSA-N 0 0 312.463 5.002 20 0 DKADRN CC(=O)c1cccc(CS[C@H](C)c2ncc(C(C)(C)C)o2)c1 ZINC000419501072 337485883 /nfs/dbraw/zinc/48/58/83/337485883.db2.gz DAAVPHFKUXWCFH-CYBMUJFWSA-N 0 0 317.454 5.169 20 0 DKADRN CC(=O)c1ccc(CS[C@@H](C)c2ncc(C(C)(C)C)o2)cc1 ZINC000419504220 337485930 /nfs/dbraw/zinc/48/59/30/337485930.db2.gz JESCSUBSSOLJEM-ZDUSSCGKSA-N 0 0 317.454 5.169 20 0 DKADRN C[C@@H](SCc1cc(C(C)(C)C)on1)c1ncc(C(C)(C)C)o1 ZINC000419588860 337490010 /nfs/dbraw/zinc/49/00/10/337490010.db2.gz IUZPTGRMFPOFPW-LLVKDONJSA-N 0 0 322.474 5.252 20 0 DKADRN C[C@H](SCc1cc(C(C)(C)C)on1)c1ncc(C(C)(C)C)o1 ZINC000419588865 337490006 /nfs/dbraw/zinc/49/00/06/337490006.db2.gz IUZPTGRMFPOFPW-NSHDSACASA-N 0 0 322.474 5.252 20 0 DKADRN CC[C@H](Sc1ccccc1)c1nc([C@@H]2CCCCS2)no1 ZINC000420489111 337502924 /nfs/dbraw/zinc/50/29/24/337502924.db2.gz DGSBSUHTSZNURR-KBPBESRZSA-N 0 0 320.483 5.271 20 0 DKADRN CC[C@H](Sc1ccccc1)c1nc([C@H]2CCCCS2)no1 ZINC000420489113 337502897 /nfs/dbraw/zinc/50/28/97/337502897.db2.gz DGSBSUHTSZNURR-UONOGXRCSA-N 0 0 320.483 5.271 20 0 DKADRN C[C@H](CC(F)(F)F)c1nc(-c2ccc3sccc3c2)no1 ZINC000420499194 337504214 /nfs/dbraw/zinc/50/42/14/337504214.db2.gz FQNIHMWKECCTDO-MRVPVSSYSA-N 0 0 312.316 5.007 20 0 DKADRN CC[C@@H](Sc1ccccc1)c1nc([C@@H]2CCC(F)(F)C2)no1 ZINC000420507339 337505475 /nfs/dbraw/zinc/50/54/75/337505475.db2.gz WOPUVFAUCSKGBW-DGCLKSJQSA-N 0 0 324.396 5.216 20 0 DKADRN CC[C@H](Sc1ccccc1)c1nc([C@@H]2CCC(F)(F)C2)no1 ZINC000420507341 337505442 /nfs/dbraw/zinc/50/54/42/337505442.db2.gz WOPUVFAUCSKGBW-YPMHNXCESA-N 0 0 324.396 5.216 20 0 DKADRN Cc1cccc(C(C)C)c1NC(=O)N1CC[C@H](C2CCCC2)C1 ZINC000421037262 337521029 /nfs/dbraw/zinc/52/10/29/337521029.db2.gz PAFMDYSWCYSQKD-KRWDZBQOSA-N 0 0 314.473 5.162 20 0 DKADRN Cc1cccc(C(C)C)c1NC(=O)N1CC[C@@H](C2CCCC2)C1 ZINC000421037264 337521006 /nfs/dbraw/zinc/52/10/06/337521006.db2.gz PAFMDYSWCYSQKD-QGZVFWFLSA-N 0 0 314.473 5.162 20 0 DKADRN CC(C)(C)c1ccccc1NC(=O)N1CC[C@@H](C2CCCC2)C1 ZINC000421037409 337520967 /nfs/dbraw/zinc/52/09/67/337520967.db2.gz PKPHDVOKDCMLKV-MRXNPFEDSA-N 0 0 314.473 5.028 20 0 DKADRN Cc1cccc(C)c1NC(=O)N1CC[C@@H](c2ccccc2)C1(C)C ZINC000421043066 337521317 /nfs/dbraw/zinc/52/13/17/337521317.db2.gz PSDGIWPFWWASIN-SFHVURJKSA-N 0 0 322.452 5.103 20 0 DKADRN CCCC(=O)Nc1cccc(NCc2cccc(C3CC3)c2)c1C ZINC000421342578 337527569 /nfs/dbraw/zinc/52/75/69/337527569.db2.gz YFPMVZYVXWVLPH-UHFFFAOYSA-N 0 0 322.452 5.223 20 0 DKADRN O=C(Nc1c(Cl)cc(Cl)cc1Cl)[C@@H]1CC[C@@H]2C[C@@H]2C1 ZINC000421456477 337535429 /nfs/dbraw/zinc/53/54/29/337535429.db2.gz YQEVKHDUWMTPIO-IWSPIJDZSA-N 0 0 318.631 5.022 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)c1cccc(F)c1C ZINC000421501193 337537297 /nfs/dbraw/zinc/53/72/97/337537297.db2.gz FLKLKRYXQBRGAT-UHFFFAOYSA-N 0 0 313.416 5.462 20 0 DKADRN CC(C)N(C(=O)CC(C)(C)C(F)(F)F)[C@@H](C)c1ccsc1 ZINC000421688217 337637833 /nfs/dbraw/zinc/63/78/33/337637833.db2.gz HHXQMEJUMAKASX-NSHDSACASA-N 0 0 321.408 5.025 20 0 DKADRN CC[C@@H](CC(F)(F)F)C(=O)N(C(C)C)[C@@H](C)c1ccsc1 ZINC000421689839 337638007 /nfs/dbraw/zinc/63/80/07/337638007.db2.gz LCUONGDBAUCLOZ-RYUDHWBXSA-N 0 0 321.408 5.025 20 0 DKADRN CC(C)N(C(=O)c1ccc(C(F)F)cc1)[C@@H](C)c1ccsc1 ZINC000421690297 337638038 /nfs/dbraw/zinc/63/80/38/337638038.db2.gz LYJNBOLDWCHKJS-LBPRGKRZSA-N 0 0 323.408 5.298 20 0 DKADRN CC(C)N(C(=O)c1cccc(C(F)F)c1)[C@H](C)c1ccsc1 ZINC000421696145 337636383 /nfs/dbraw/zinc/63/63/83/337636383.db2.gz ZIHXAGHHNXDWLP-GFCCVEGCSA-N 0 0 323.408 5.298 20 0 DKADRN Cc1cc2c(o1)CC(C)(C)C[C@@H]2N[C@@H](C)c1ccncc1Cl ZINC000421822040 337645690 /nfs/dbraw/zinc/64/56/90/337645690.db2.gz VLSKHOYHISALMK-LRDDRELGSA-N 0 0 318.848 5.001 20 0 DKADRN Cc1c2ccccc2oc1[C@@H](C)N[C@H](C)c1ccncc1Cl ZINC000421824634 337646218 /nfs/dbraw/zinc/64/62/18/337646218.db2.gz JQGXQCDHIYQGDB-CHWSQXEVSA-N 0 0 314.816 5.201 20 0 DKADRN Cc1c2ccccc2oc1[C@@H](C)N[C@@H](C)c1ccncc1Cl ZINC000421824636 337646199 /nfs/dbraw/zinc/64/61/99/337646199.db2.gz JQGXQCDHIYQGDB-QWHCGFSZSA-N 0 0 314.816 5.201 20 0 DKADRN CC(C)[C@@H](N[C@@H](C)c1ccncc1Cl)c1ccc(F)cc1F ZINC000421830371 337647326 /nfs/dbraw/zinc/64/73/26/337647326.db2.gz BKYPNTUVPIOUTL-APPDUMDISA-N 0 0 324.802 5.061 20 0 DKADRN 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DKADRN CC(C)N(Cc1cccs1)C(=O)Nc1ccccc1C(F)F ZINC000425691643 337435220 /nfs/dbraw/zinc/43/52/20/337435220.db2.gz JSPQGGWUKDQLSI-UHFFFAOYSA-N 0 0 324.396 5.128 20 0 DKADRN O=C(Nc1ccccc1C(F)F)N1CCC2(CCCCC2)CC1 ZINC000425691665 337435232 /nfs/dbraw/zinc/43/52/32/337435232.db2.gz JXEYLBHVIBJRFW-UHFFFAOYSA-N 0 0 322.399 5.202 20 0 DKADRN CCC[C@H]1[C@H](C)CCCN1C(=O)Nc1ccccc1C(F)F ZINC000425691905 337435176 /nfs/dbraw/zinc/43/51/76/337435176.db2.gz KRQCJESXDGDLDW-DOMZBBRYSA-N 0 0 310.388 5.057 20 0 DKADRN CCC[C@@H]1[C@H](C)CCCN1C(=O)Nc1ccccc1C(F)F ZINC000425691906 337435187 /nfs/dbraw/zinc/43/51/87/337435187.db2.gz KRQCJESXDGDLDW-IUODEOHRSA-N 0 0 310.388 5.057 20 0 DKADRN CCC[C@H]1[C@@H](C)CCCN1C(=O)Nc1ccccc1C(F)F ZINC000425691908 337435177 /nfs/dbraw/zinc/43/51/77/337435177.db2.gz KRQCJESXDGDLDW-WFASDCNBSA-N 0 0 310.388 5.057 20 0 DKADRN CCC(CC)N(CC(C)C)C(=O)Nc1ccccc1C(F)F ZINC000425692048 337435178 /nfs/dbraw/zinc/43/51/78/337435178.db2.gz KYPVQTIMWSEDFZ-UHFFFAOYSA-N 0 0 312.404 5.303 20 0 DKADRN CC(C)(C)C[C@H]1CCCN1C(=O)Nc1ccccc1C(F)F ZINC000425692530 337435289 /nfs/dbraw/zinc/43/52/89/337435289.db2.gz NIBVGXXJYHBSRD-GFCCVEGCSA-N 0 0 310.388 5.057 20 0 DKADRN CC(C)(C)C[C@@H]1CCCN1C(=O)Nc1ccccc1C(F)F ZINC000425692531 337435375 /nfs/dbraw/zinc/43/53/75/337435375.db2.gz NIBVGXXJYHBSRD-LBPRGKRZSA-N 0 0 310.388 5.057 20 0 DKADRN CC(C)(C)[C@@H]1CCCN(C(=O)Nc2ccccc2C(F)F)CC1 ZINC000425692991 337435411 /nfs/dbraw/zinc/43/54/11/337435411.db2.gz PLQCFOMMCHLYDL-CYBMUJFWSA-N 0 0 324.415 5.304 20 0 DKADRN CN(CCC1CCCCC1)C(=O)Nc1ccccc1C(F)F ZINC000425693610 337435603 /nfs/dbraw/zinc/43/56/03/337435603.db2.gz RQBKUJMUDOSILJ-UHFFFAOYSA-N 0 0 310.388 5.058 20 0 DKADRN CC[C@@H]1CCCC[C@@H]1N(C)C(=O)Nc1ccccc1C(F)F ZINC000425694239 337435674 /nfs/dbraw/zinc/43/56/74/337435674.db2.gz UGEFGYKFWBDCNK-DOMZBBRYSA-N 0 0 310.388 5.057 20 0 DKADRN CC[C@@H]1CCCC[C@H]1N(C)C(=O)Nc1ccccc1C(F)F ZINC000425694240 337435782 /nfs/dbraw/zinc/43/57/82/337435782.db2.gz UGEFGYKFWBDCNK-IUODEOHRSA-N 0 0 310.388 5.057 20 0 DKADRN CC[C@H]1CCCC[C@H]1N(C)C(=O)Nc1ccccc1C(F)F ZINC000425694242 337435675 /nfs/dbraw/zinc/43/56/75/337435675.db2.gz UGEFGYKFWBDCNK-SWLSCSKDSA-N 0 0 310.388 5.057 20 0 DKADRN CC(C)CC[C@H]1CCCN1C(=O)Nc1ccccc1C(F)F ZINC000425694596 337435728 /nfs/dbraw/zinc/43/57/28/337435728.db2.gz UZYKKJQLUGXYDR-CYBMUJFWSA-N 0 0 310.388 5.057 20 0 DKADRN CC(C)CC[C@@H]1CCCN1C(=O)Nc1ccccc1C(F)F ZINC000425694597 337435672 /nfs/dbraw/zinc/43/56/72/337435672.db2.gz UZYKKJQLUGXYDR-ZDUSSCGKSA-N 0 0 310.388 5.057 20 0 DKADRN CC(C)CC[C@@H]1CCCCN1C(=O)Nc1ccccc1C(F)F ZINC000425695639 337439485 /nfs/dbraw/zinc/43/94/85/337439485.db2.gz XKGNJQGKWLHKLT-AWEZNQCLSA-N 0 0 324.415 5.447 20 0 DKADRN CC(C)C[C@H]1CCCCN1C(=O)Nc1ccccc1C(F)F ZINC000425696601 337439552 /nfs/dbraw/zinc/43/95/52/337439552.db2.gz ZGUPRKNFWVAGBU-CYBMUJFWSA-N 0 0 310.388 5.057 20 0 DKADRN C[C@@H](C1CCCCC1)N(C)C(=O)Nc1ccccc1C(F)F ZINC000425698411 337442715 /nfs/dbraw/zinc/44/27/15/337442715.db2.gz FZBRTFLGTRWVDO-LBPRGKRZSA-N 0 0 310.388 5.057 20 0 DKADRN Cc1cccc(C)c1[C@@H](C)NC(=O)Nc1ccccc1C(F)F ZINC000425698733 337442720 /nfs/dbraw/zinc/44/27/20/337442720.db2.gz GSQYAZVKULNADY-CYBMUJFWSA-N 0 0 318.367 5.124 20 0 DKADRN Cc1cccc(C)c1[C@H](C)NC(=O)Nc1ccccc1C(F)F ZINC000425698734 337442773 /nfs/dbraw/zinc/44/27/73/337442773.db2.gz GSQYAZVKULNADY-ZDUSSCGKSA-N 0 0 318.367 5.124 20 0 DKADRN CCC1(CC)CCN(C(=O)Nc2ccccc2C(F)F)CC1 ZINC000425699994 337442893 /nfs/dbraw/zinc/44/28/93/337442893.db2.gz JJWXKCWRRFTCGG-UHFFFAOYSA-N 0 0 310.388 5.058 20 0 DKADRN C[C@@H]1C[C@H](C(C)(C)C)CCN1C(=O)Nc1ccccc1C(F)F ZINC000425707453 337446507 /nfs/dbraw/zinc/44/65/07/337446507.db2.gz XHDNKERLSVCYLR-CHWSQXEVSA-N 0 0 324.415 5.303 20 0 DKADRN C[C@@H]1C[C@@H](C(C)(C)C)CCN1C(=O)Nc1ccccc1C(F)F ZINC000425707454 337446558 /nfs/dbraw/zinc/44/65/58/337446558.db2.gz XHDNKERLSVCYLR-OLZOCXBDSA-N 0 0 324.415 5.303 20 0 DKADRN C[C@H]1C[C@@H](C(C)(C)C)CCN1C(=O)Nc1ccccc1C(F)F ZINC000425707456 337446502 /nfs/dbraw/zinc/44/65/02/337446502.db2.gz XHDNKERLSVCYLR-STQMWFEESA-N 0 0 324.415 5.303 20 0 DKADRN CCC[C@H](NC(=O)Nc1ccccc1C(F)F)c1ccccc1 ZINC000425709756 338016141 /nfs/dbraw/zinc/01/61/41/338016141.db2.gz HMUDFZKLRHPJRO-HNNXBMFYSA-N 0 0 318.367 5.287 20 0 DKADRN CCC[C@@H](NC(=O)Nc1ccccc1C(F)F)c1ccccc1 ZINC000425709757 338016166 /nfs/dbraw/zinc/01/61/66/338016166.db2.gz HMUDFZKLRHPJRO-OAHLLOKOSA-N 0 0 318.367 5.287 20 0 DKADRN O=C(Nc1ccccc1C(F)F)N1CCC[C@H]1c1ccsc1 ZINC000425709873 338016199 /nfs/dbraw/zinc/01/61/99/338016199.db2.gz HWGDYNSCKWPMHN-AWEZNQCLSA-N 0 0 322.380 5.055 20 0 DKADRN O=C(Nc1ccccc1C(F)F)N1CCC[C@@H]1c1ccsc1 ZINC000425709881 338016164 /nfs/dbraw/zinc/01/61/64/338016164.db2.gz HWGDYNSCKWPMHN-CQSZACIVSA-N 0 0 322.380 5.055 20 0 DKADRN CC[C@H](NC(=O)Nc1ccccc1C(F)F)c1ccc(C)cc1 ZINC000425711563 338016134 /nfs/dbraw/zinc/01/61/34/338016134.db2.gz KJXFXUBSPAKKME-HNNXBMFYSA-N 0 0 318.367 5.205 20 0 DKADRN CC[C@@H](NC(=O)Nc1ccccc1C(F)F)c1ccc(C)cc1 ZINC000425711564 338016189 /nfs/dbraw/zinc/01/61/89/338016189.db2.gz KJXFXUBSPAKKME-OAHLLOKOSA-N 0 0 318.367 5.205 20 0 DKADRN O=C(Nc1ccccc1C(F)F)N1CCC[C@H]1C1CCCCC1 ZINC000425713374 337482002 /nfs/dbraw/zinc/48/20/02/337482002.db2.gz NKIYIRMCQDHYIK-INIZCTEOSA-N 0 0 322.399 5.201 20 0 DKADRN O=C(Nc1ccccc1C(F)F)N1CCC[C@@H]1c1cccs1 ZINC000425714291 337488164 /nfs/dbraw/zinc/48/81/64/337488164.db2.gz OSUFLPKSFZILLX-CYBMUJFWSA-N 0 0 322.380 5.055 20 0 DKADRN Cc1ccc([C@@H](C)N(C)C(=O)Nc2ccccc2C(F)F)cc1 ZINC000425718011 338016335 /nfs/dbraw/zinc/01/63/35/338016335.db2.gz UDSRIQFKJYJGBQ-CYBMUJFWSA-N 0 0 318.367 5.158 20 0 DKADRN Cc1ccc([C@H](C)N(C)C(=O)Nc2ccccc2C(F)F)cc1 ZINC000425718012 338016396 /nfs/dbraw/zinc/01/63/96/338016396.db2.gz UDSRIQFKJYJGBQ-ZDUSSCGKSA-N 0 0 318.367 5.158 20 0 DKADRN Cc1cc([C@H](C)NC(=O)Nc2ccccc2C(F)F)c(C)s1 ZINC000425718537 338016359 /nfs/dbraw/zinc/01/63/59/338016359.db2.gz UUHFCZGPILXMBO-JTQLQIEISA-N 0 0 324.396 5.185 20 0 DKADRN Cc1cc([C@@H](C)NC(=O)Nc2ccccc2C(F)F)c(C)s1 ZINC000425718539 338016417 /nfs/dbraw/zinc/01/64/17/338016417.db2.gz UUHFCZGPILXMBO-SNVBAGLBSA-N 0 0 324.396 5.185 20 0 DKADRN CC(C)[C@H](NC(=O)Nc1ccccc1C(F)F)c1ccccc1 ZINC000425719774 338016330 /nfs/dbraw/zinc/01/63/30/338016330.db2.gz WNTVIFYCLUMCDB-INIZCTEOSA-N 0 0 318.367 5.143 20 0 DKADRN CC(C)[C@@H](NC(=O)Nc1ccccc1C(F)F)c1ccccc1 ZINC000425719779 338016403 /nfs/dbraw/zinc/01/64/03/338016403.db2.gz WNTVIFYCLUMCDB-MRXNPFEDSA-N 0 0 318.367 5.143 20 0 DKADRN CC(C)c1ccc(CNC(=O)Nc2ccccc2C(F)F)cc1 ZINC000425721022 337522331 /nfs/dbraw/zinc/52/23/31/337522331.db2.gz XTALVZXPNKTRLX-UHFFFAOYSA-N 0 0 318.367 5.069 20 0 DKADRN CN(C(=O)Nc1ccccc1C(F)F)[C@@H]1CCC[C@@H]1C(C)(C)C ZINC000425754729 338017036 /nfs/dbraw/zinc/01/70/36/338017036.db2.gz DRQKYNAEAJNAOP-DZGCQCFKSA-N 0 0 324.415 5.303 20 0 DKADRN CN(C(=O)Nc1ccccc1C(F)F)[C@H]1CCC[C@H]1C(C)(C)C ZINC000425754730 337682338 /nfs/dbraw/zinc/68/23/38/337682338.db2.gz DRQKYNAEAJNAOP-HIFRSBDPSA-N 0 0 324.415 5.303 20 0 DKADRN O=C(Nc1ccc(Cl)cc1Cl)c1ccc(F)c(Cl)c1 ZINC000425931464 334772678 /nfs/dbraw/zinc/77/26/78/334772678.db2.gz LXUFKCAOJVCNPB-UHFFFAOYSA-N 0 0 318.562 5.038 20 0 DKADRN C[C@H](NCc1ccc(C2CC2)cc1F)c1csc(Cl)c1 ZINC000425938664 338019113 /nfs/dbraw/zinc/01/91/13/338019113.db2.gz QWXYZSNOUNCTSM-JTQLQIEISA-N 0 0 309.837 5.269 20 0 DKADRN C[C@@H](NCc1ccc(C2CC2)cc1F)c1csc(Cl)c1 ZINC000425938668 338019123 /nfs/dbraw/zinc/01/91/23/338019123.db2.gz QWXYZSNOUNCTSM-SNVBAGLBSA-N 0 0 309.837 5.269 20 0 DKADRN CC(C)c1nc([C@@H](C)NCc2ccc(C3CC3)cc2F)cs1 ZINC000425957295 334864744 /nfs/dbraw/zinc/86/47/44/334864744.db2.gz HXMHNBMTQQZRQF-GFCCVEGCSA-N 0 0 318.461 5.134 20 0 DKADRN CC(C)c1nc([C@H](C)NCc2ccc(C3CC3)cc2F)cs1 ZINC000425957296 334864758 /nfs/dbraw/zinc/86/47/58/334864758.db2.gz HXMHNBMTQQZRQF-LBPRGKRZSA-N 0 0 318.461 5.134 20 0 DKADRN Cc1cccc(NC(=O)N2CCC[C@H]2c2cccc(C)c2C)c1C ZINC000426013236 334901352 /nfs/dbraw/zinc/90/13/52/334901352.db2.gz MKEGTOPEMDZDJV-FQEVSTJZSA-N 0 0 322.452 5.289 20 0 DKADRN Cc1cccc(NC(=O)N2CCC[C@@H]2c2cccc(C)c2C)c1C ZINC000426013237 334901371 /nfs/dbraw/zinc/90/13/71/334901371.db2.gz MKEGTOPEMDZDJV-HXUWFJFHSA-N 0 0 322.452 5.289 20 0 DKADRN Cc1cccc(NC(=O)Nc2cccc(CC(F)(F)F)c2)c1C ZINC000426020928 338019535 /nfs/dbraw/zinc/01/95/35/338019535.db2.gz MNGGIVWHRIPCII-UHFFFAOYSA-N 0 0 322.330 5.052 20 0 DKADRN Cc1cccc(NC(=O)Nc2ccc(CC(F)(F)F)cc2)c1C ZINC000426027975 338019733 /nfs/dbraw/zinc/01/97/33/338019733.db2.gz JZNYZSUBWSICCT-UHFFFAOYSA-N 0 0 322.330 5.052 20 0 DKADRN Cc1ccc([C@@H]2CCCCN2C(=O)Nc2cccc(C)c2C)cc1 ZINC000426031106 338019815 /nfs/dbraw/zinc/01/98/15/338019815.db2.gz WPJFXROYUIAZFG-FQEVSTJZSA-N 0 0 322.452 5.371 20 0 DKADRN Cc1ccc([C@H]2CCCCN2C(=O)Nc2cccc(C)c2C)cc1 ZINC000426031107 338019798 /nfs/dbraw/zinc/01/97/98/338019798.db2.gz WPJFXROYUIAZFG-HXUWFJFHSA-N 0 0 322.452 5.371 20 0 DKADRN Cc1ccc2cc([C@@H](C)NCc3nc(C(C)C)cs3)oc2c1 ZINC000426034818 338019942 /nfs/dbraw/zinc/01/99/42/338019942.db2.gz GVFILWAYTWIGFN-CYBMUJFWSA-N 0 0 314.454 5.172 20 0 DKADRN Cc1ccc2cc([C@H](C)NCc3nc(C(C)C)cs3)oc2c1 ZINC000426034819 338019990 /nfs/dbraw/zinc/01/99/90/338019990.db2.gz GVFILWAYTWIGFN-ZDUSSCGKSA-N 0 0 314.454 5.172 20 0 DKADRN CCC(=O)Nc1ccc(N[C@@H](C)c2cc3ccc(C)cc3o2)cc1 ZINC000426044419 335077678 /nfs/dbraw/zinc/07/76/78/335077678.db2.gz SHQPJVKIKDGIDC-AWEZNQCLSA-N 0 0 322.408 5.263 20 0 DKADRN CCC(=O)Nc1ccc(N[C@H](C)c2cc3ccc(C)cc3o2)cc1 ZINC000426044420 335077702 /nfs/dbraw/zinc/07/77/02/335077702.db2.gz SHQPJVKIKDGIDC-CQSZACIVSA-N 0 0 322.408 5.263 20 0 DKADRN Cc1ccc2cc([C@H](C)Nc3cnn([C@@H](C)C4CC4)c3)oc2c1 ZINC000426047633 335084938 /nfs/dbraw/zinc/08/49/38/335084938.db2.gz RRPGVTPLSCASIE-KBPBESRZSA-N 0 0 309.413 5.082 20 0 DKADRN Cc1ccc2cc([C@@H](C)Nc3cnn([C@@H](C)C4CC4)c3)oc2c1 ZINC000426047634 335084873 /nfs/dbraw/zinc/08/48/73/335084873.db2.gz RRPGVTPLSCASIE-KGLIPLIRSA-N 0 0 309.413 5.082 20 0 DKADRN Cc1ccc2cc([C@H](C)Nc3cnn([C@H](C)C4CC4)c3)oc2c1 ZINC000426047635 335084920 /nfs/dbraw/zinc/08/49/20/335084920.db2.gz RRPGVTPLSCASIE-UONOGXRCSA-N 0 0 309.413 5.082 20 0 DKADRN Cc1ccc2cc([C@@H](C)Nc3cnn([C@H](C)C4CC4)c3)oc2c1 ZINC000426047636 335084954 /nfs/dbraw/zinc/08/49/54/335084954.db2.gz RRPGVTPLSCASIE-ZIAGYGMSSA-N 0 0 309.413 5.082 20 0 DKADRN CC(=O)Nc1cc(N[C@@H](C)c2cc3ccc(C)cc3o2)ccc1C ZINC000426048884 335095507 /nfs/dbraw/zinc/09/55/07/335095507.db2.gz VTWZLHIISSFMRB-AWEZNQCLSA-N 0 0 322.408 5.181 20 0 DKADRN CC(=O)Nc1cc(N[C@H](C)c2cc3ccc(C)cc3o2)ccc1C ZINC000426048891 335095441 /nfs/dbraw/zinc/09/54/41/335095441.db2.gz VTWZLHIISSFMRB-CQSZACIVSA-N 0 0 322.408 5.181 20 0 DKADRN Cc1cc(Cl)ccc1NC(=O)[C@H](C)c1ccc(Cl)s1 ZINC000426051918 335095644 /nfs/dbraw/zinc/09/56/44/335095644.db2.gz VTLPTBLIQAETDA-SECBINFHSA-N 0 0 314.237 5.106 20 0 DKADRN Cc1cc(Cl)ccc1NC(=O)[C@@H](C)c1ccc(Cl)s1 ZINC000426051919 335095725 /nfs/dbraw/zinc/09/57/25/335095725.db2.gz VTLPTBLIQAETDA-VIFPVBQESA-N 0 0 314.237 5.106 20 0 DKADRN CCc1nc([C@@H](C)N[C@H](C)c2cc3ccc(C)cc3o2)cs1 ZINC000426056963 335093871 /nfs/dbraw/zinc/09/38/71/335093871.db2.gz DUHJUHIJSSVVPX-CHWSQXEVSA-N 0 0 314.454 5.172 20 0 DKADRN CCc1nc([C@@H](C)N[C@@H](C)c2cc3ccc(C)cc3o2)cs1 ZINC000426056964 335093858 /nfs/dbraw/zinc/09/38/58/335093858.db2.gz DUHJUHIJSSVVPX-OLZOCXBDSA-N 0 0 314.454 5.172 20 0 DKADRN CCc1nc([C@H](C)N[C@H](C)c2cc3ccc(C)cc3o2)cs1 ZINC000426056965 335093949 /nfs/dbraw/zinc/09/39/49/335093949.db2.gz DUHJUHIJSSVVPX-QWHCGFSZSA-N 0 0 314.454 5.172 20 0 DKADRN CCc1nc([C@H](C)N[C@@H](C)c2cc3ccc(C)cc3o2)cs1 ZINC000426056966 335094099 /nfs/dbraw/zinc/09/40/99/335094099.db2.gz DUHJUHIJSSVVPX-STQMWFEESA-N 0 0 314.454 5.172 20 0 DKADRN Cc1c(Cl)cccc1NC(=O)[C@H](C)c1ccc(Cl)s1 ZINC000426056967 335094124 /nfs/dbraw/zinc/09/41/24/335094124.db2.gz DVJDEECIBZADBA-SECBINFHSA-N 0 0 314.237 5.106 20 0 DKADRN Cc1c(Cl)cccc1NC(=O)[C@@H](C)c1ccc(Cl)s1 ZINC000426056968 335094139 /nfs/dbraw/zinc/09/41/39/335094139.db2.gz DVJDEECIBZADBA-VIFPVBQESA-N 0 0 314.237 5.106 20 0 DKADRN CC(C)c1ccccc1NC(=O)N1CCC(C)(C(C)C)CC1 ZINC000426069484 335098166 /nfs/dbraw/zinc/09/81/66/335098166.db2.gz JZGAQUOVIMKTDG-UHFFFAOYSA-N 0 0 302.462 5.100 20 0 DKADRN CCCCC[C@H]1CCCN1C(=O)Nc1cccc(C(F)F)c1 ZINC000426072417 335098661 /nfs/dbraw/zinc/09/86/61/335098661.db2.gz XJHVJZFKZRQTBH-HNNXBMFYSA-N 0 0 310.388 5.201 20 0 DKADRN CCCCC[C@@H]1CCCN1C(=O)Nc1cccc(C(F)F)c1 ZINC000426072418 335098650 /nfs/dbraw/zinc/09/86/50/335098650.db2.gz XJHVJZFKZRQTBH-OAHLLOKOSA-N 0 0 310.388 5.201 20 0 DKADRN Cc1ccc(Cl)cc1NC(=O)[C@H](C)c1ccc(Cl)s1 ZINC000426079228 335101365 /nfs/dbraw/zinc/10/13/65/335101365.db2.gz MJZGYICUOOIHKL-SECBINFHSA-N 0 0 314.237 5.106 20 0 DKADRN Cc1ccc(Cl)cc1NC(=O)[C@@H](C)c1ccc(Cl)s1 ZINC000426079229 335101471 /nfs/dbraw/zinc/10/14/71/335101471.db2.gz MJZGYICUOOIHKL-VIFPVBQESA-N 0 0 314.237 5.106 20 0 DKADRN Cc1ccc(NC(=O)[C@H](C)c2ccc(Cl)s2)c(Cl)c1 ZINC000426080313 335101508 /nfs/dbraw/zinc/10/15/08/335101508.db2.gz QEUZEBOUZPRINL-SECBINFHSA-N 0 0 314.237 5.106 20 0 DKADRN Cc1ccc(NC(=O)[C@@H](C)c2ccc(Cl)s2)c(Cl)c1 ZINC000426080315 335101676 /nfs/dbraw/zinc/10/16/76/335101676.db2.gz QEUZEBOUZPRINL-VIFPVBQESA-N 0 0 314.237 5.106 20 0 DKADRN CCCCC[C@H]1CCCN1C(=O)Nc1ccc2[nH]c(C)cc2c1 ZINC000426094297 335112311 /nfs/dbraw/zinc/11/23/11/335112311.db2.gz QQKIJMLMWRKRMM-KRWDZBQOSA-N 0 0 313.445 5.053 20 0 DKADRN CCCCC[C@@H]1CCCN1C(=O)Nc1ccc2[nH]c(C)cc2c1 ZINC000426094298 335112296 /nfs/dbraw/zinc/11/22/96/335112296.db2.gz QQKIJMLMWRKRMM-QGZVFWFLSA-N 0 0 313.445 5.053 20 0 DKADRN Clc1ccsc1CNc1cccc(Oc2ccccn2)c1 ZINC000426154623 338021449 /nfs/dbraw/zinc/02/14/49/338021449.db2.gz SCCIODYARGLGRZ-UHFFFAOYSA-N 0 0 316.813 5.201 20 0 DKADRN Clc1csc(CNc2cccc(Oc3ccccn3)c2)c1 ZINC000426154795 338021525 /nfs/dbraw/zinc/02/15/25/338021525.db2.gz TTYSUCUSTXLQPM-UHFFFAOYSA-N 0 0 316.813 5.201 20 0 DKADRN CC(C)c1ccccc1N(C)C(=O)c1cccn1C1CCCC1 ZINC000426175247 338022240 /nfs/dbraw/zinc/02/22/40/338022240.db2.gz FZUQKCDRJWIFFA-UHFFFAOYSA-N 0 0 310.441 5.003 20 0 DKADRN Cc1cc(C(=O)N(C)c2ccccc2C(C)C)c(C)n1C(C)C ZINC000426180646 338022424 /nfs/dbraw/zinc/02/24/24/338022424.db2.gz QDIJTCCVTBNQDZ-UHFFFAOYSA-N 0 0 312.457 5.086 20 0 DKADRN CC(C)c1ccoc1-c1noc(-c2cccc(C(F)F)c2)n1 ZINC000426195550 338022589 /nfs/dbraw/zinc/02/25/89/338022589.db2.gz UNBVOUYUAOCTDU-UHFFFAOYSA-N 0 0 304.296 5.058 20 0 DKADRN CC(C)c1ccoc1-c1noc(-c2ccc(C(F)F)cc2)n1 ZINC000426231608 338023417 /nfs/dbraw/zinc/02/34/17/338023417.db2.gz ROSIGLFSNWXOPV-UHFFFAOYSA-N 0 0 304.296 5.058 20 0 DKADRN CC(C)c1ccoc1-c1noc([C@H]2CC[C@@H](c3ccccc3)O2)n1 ZINC000426232183 338023380 /nfs/dbraw/zinc/02/33/80/338023380.db2.gz UZXOLAWCVZQUGP-JKSUJKDBSA-N 0 0 324.380 5.046 20 0 DKADRN CCN(C(=O)c1ccc(C(C)C)s1)[C@H](C)Cc1ccsc1 ZINC000426285243 338024477 /nfs/dbraw/zinc/02/44/77/338024477.db2.gz AJGPYKZTBRVGKX-CYBMUJFWSA-N 0 0 321.511 5.026 20 0 DKADRN CCN(C(=O)c1ccc(C(C)C)s1)[C@@H](C)Cc1ccsc1 ZINC000426285244 338024485 /nfs/dbraw/zinc/02/44/85/338024485.db2.gz AJGPYKZTBRVGKX-ZDUSSCGKSA-N 0 0 321.511 5.026 20 0 DKADRN Cc1ccnc([C@H](C)NCc2ccc(-c3ccccc3)cc2F)c1 ZINC000426287379 338024652 /nfs/dbraw/zinc/02/46/52/338024652.db2.gz YKASNTGDBDAZLP-INIZCTEOSA-N 0 0 320.411 5.047 20 0 DKADRN Cc1ccnc([C@@H](C)NCc2ccc(-c3ccccc3)cc2F)c1 ZINC000426287380 338024582 /nfs/dbraw/zinc/02/45/82/338024582.db2.gz YKASNTGDBDAZLP-MRXNPFEDSA-N 0 0 320.411 5.047 20 0 DKADRN Cc1ccc2c(c1)[C@H](N[C@H](C)c1csc(C(C)C)n1)CCC2 ZINC000426288325 338024660 /nfs/dbraw/zinc/02/46/60/338024660.db2.gz IQVMNROYQQVYFT-RHSMWYFYSA-N 0 0 314.498 5.303 20 0 DKADRN Cc1ccc2c(c1)[C@H](N[C@@H](C)c1csc(C(C)C)n1)CCC2 ZINC000426288331 338024639 /nfs/dbraw/zinc/02/46/39/338024639.db2.gz IQVMNROYQQVYFT-WMLDXEAASA-N 0 0 314.498 5.303 20 0 DKADRN CC(C)N(C(=O)C[C@H](C)c1c[nH]c2ccccc21)c1ccccc1 ZINC000426289115 338024684 /nfs/dbraw/zinc/02/46/84/338024684.db2.gz DOWRCUXXCGGXEO-INIZCTEOSA-N 0 0 320.436 5.103 20 0 DKADRN CC(C)N(C(=O)C[C@@H](C)c1c[nH]c2ccccc21)c1ccccc1 ZINC000426289118 338024591 /nfs/dbraw/zinc/02/45/91/338024591.db2.gz DOWRCUXXCGGXEO-MRXNPFEDSA-N 0 0 320.436 5.103 20 0 DKADRN C[C@H](NCc1ccc(-c2ccccc2)cc1F)c1cccc(O)c1 ZINC000426296580 338025340 /nfs/dbraw/zinc/02/53/40/338025340.db2.gz SQGONBZIGANOLX-HNNXBMFYSA-N 0 0 321.395 5.049 20 0 DKADRN C[C@@H](NCc1ccc(-c2ccccc2)cc1F)c1cccc(O)c1 ZINC000426296581 338025301 /nfs/dbraw/zinc/02/53/01/338025301.db2.gz SQGONBZIGANOLX-OAHLLOKOSA-N 0 0 321.395 5.049 20 0 DKADRN Cc1ccoc1CN[C@@H](C)c1cc2c(ccc3ccccc23)o1 ZINC000426296893 338025202 /nfs/dbraw/zinc/02/52/02/338025202.db2.gz VBXXJLWEQMAZGI-AWEZNQCLSA-N 0 0 305.377 5.338 20 0 DKADRN Cc1ccoc1CN[C@H](C)c1cc2c(ccc3ccccc23)o1 ZINC000426296894 338025187 /nfs/dbraw/zinc/02/51/87/338025187.db2.gz VBXXJLWEQMAZGI-CQSZACIVSA-N 0 0 305.377 5.338 20 0 DKADRN CCCc1nc(C)c(CN[C@@H](c2ccccc2Cl)C(C)C)o1 ZINC000426301576 338025603 /nfs/dbraw/zinc/02/56/03/338025603.db2.gz NOSLLFOZEVQCDE-GOSISDBHSA-N 0 0 320.864 5.076 20 0 DKADRN CCCc1nc(C)c(CN[C@H](c2ccccc2Cl)C(C)C)o1 ZINC000426301578 338025554 /nfs/dbraw/zinc/02/55/54/338025554.db2.gz NOSLLFOZEVQCDE-SFHVURJKSA-N 0 0 320.864 5.076 20 0 DKADRN Cc1ccoc1CN[C@H]1CCCc2c(Cl)sc(Cl)c21 ZINC000426303357 338025729 /nfs/dbraw/zinc/02/57/29/338025729.db2.gz XHUMBSBLGZBZQQ-JTQLQIEISA-N 0 0 316.253 5.124 20 0 DKADRN Cc1ccoc1CN[C@@H]1CCCc2c(Cl)sc(Cl)c21 ZINC000426303358 338025707 /nfs/dbraw/zinc/02/57/07/338025707.db2.gz XHUMBSBLGZBZQQ-SNVBAGLBSA-N 0 0 316.253 5.124 20 0 DKADRN O=C(CC1CCCCCC1)N1CCCCC[C@H]1c1ccco1 ZINC000426305810 338025926 /nfs/dbraw/zinc/02/59/26/338025926.db2.gz DOADVHDXZMERGD-KRWDZBQOSA-N 0 0 303.446 5.084 20 0 DKADRN O=C(CC1CCCCCC1)N1CCCCC[C@@H]1c1ccco1 ZINC000426305811 338025891 /nfs/dbraw/zinc/02/58/91/338025891.db2.gz DOADVHDXZMERGD-QGZVFWFLSA-N 0 0 303.446 5.084 20 0 DKADRN Cc1ccoc1CN[C@@H](C)c1ccccc1OCc1ccccc1 ZINC000426323924 338027134 /nfs/dbraw/zinc/02/71/34/338027134.db2.gz OMOHKNDXSXKMIV-KRWDZBQOSA-N 0 0 321.420 5.018 20 0 DKADRN Cc1ccoc1CN[C@H](C)c1ccccc1OCc1ccccc1 ZINC000426323925 338027080 /nfs/dbraw/zinc/02/70/80/338027080.db2.gz OMOHKNDXSXKMIV-QGZVFWFLSA-N 0 0 321.420 5.018 20 0 DKADRN CCCc1nc(C)c(C[NH2+][C@H](c2ccc(Cl)cc2)C(C)C)o1 ZINC000426340450 332063224 /nfs/dbraw/zinc/06/32/24/332063224.db2.gz QZKGIUWSGCYVTO-SFHVURJKSA-N 0 0 320.864 5.076 20 0 DKADRN CCCc1nc(C)c(C[NH2+][C@H](CC(C)C)c2ccccc2C)o1 ZINC000426343119 332064394 /nfs/dbraw/zinc/06/43/94/332064394.db2.gz OPSFVASQWDPYCC-GOSISDBHSA-N 0 0 314.473 5.121 20 0 DKADRN CCCc1nc(C)c(C[NH2+][C@@H](CC(C)C)c2ccccc2C)o1 ZINC000426343120 332064308 /nfs/dbraw/zinc/06/43/08/332064308.db2.gz OPSFVASQWDPYCC-SFHVURJKSA-N 0 0 314.473 5.121 20 0 DKADRN Cc1ccc([C@@H]2CCCN2C(=O)CC2CCCCCC2)s1 ZINC000426348042 338028261 /nfs/dbraw/zinc/02/82/61/338028261.db2.gz XKEDEKSVSCXOQB-INIZCTEOSA-N 0 0 305.487 5.081 20 0 DKADRN Cc1ccc([C@H]2CCCN2C(=O)CC2CCCCCC2)s1 ZINC000426348043 338028245 /nfs/dbraw/zinc/02/82/45/338028245.db2.gz XKEDEKSVSCXOQB-MRXNPFEDSA-N 0 0 305.487 5.081 20 0 DKADRN CCCc1nc(C)c(C[NH2+][C@H](c2cccs2)C2CCCC2)o1 ZINC000426354456 332074892 /nfs/dbraw/zinc/07/48/92/332074892.db2.gz ZNVSZPCWZICGBC-SFHVURJKSA-N 0 0 318.486 5.018 20 0 DKADRN C[C@@H](c1cccs1)c1noc(-c2ccc(C(C)(F)F)cc2)n1 ZINC000426400803 338030666 /nfs/dbraw/zinc/03/06/66/338030666.db2.gz KZNLACDFTILDKB-JTQLQIEISA-N 0 0 320.364 5.062 20 0 DKADRN C[C@H](c1cccs1)c1noc(-c2ccc(C(C)(F)F)cc2)n1 ZINC000426400804 338030715 /nfs/dbraw/zinc/03/07/15/338030715.db2.gz KZNLACDFTILDKB-SNVBAGLBSA-N 0 0 320.364 5.062 20 0 DKADRN O=C(C[C@@H]1C=CCCC1)N1CCC[C@@H]1c1cccc2ccccc21 ZINC000426651217 338037039 /nfs/dbraw/zinc/03/70/39/338037039.db2.gz KTQJCWRURVNFKY-DYESRHJHSA-N 0 0 319.448 5.250 20 0 DKADRN O=C(C[C@H]1C=CCCC1)N1CCC[C@@H]1c1cccc2ccccc21 ZINC000426651219 338036981 /nfs/dbraw/zinc/03/69/81/338036981.db2.gz KTQJCWRURVNFKY-LAUBAEHRSA-N 0 0 319.448 5.250 20 0 DKADRN O=C(C[C@@H]1C=CCCC1)N1CCC[C@H]1c1cccc2ccccc21 ZINC000426651221 338037028 /nfs/dbraw/zinc/03/70/28/338037028.db2.gz KTQJCWRURVNFKY-UTKZUKDTSA-N 0 0 319.448 5.250 20 0 DKADRN O=C(C[C@H]1C=CCCC1)N1CCC[C@H]1c1cccc2ccccc21 ZINC000426651223 338037030 /nfs/dbraw/zinc/03/70/30/338037030.db2.gz KTQJCWRURVNFKY-UWJYYQICSA-N 0 0 319.448 5.250 20 0 DKADRN Cc1ccc(NC(=O)Nc2cccc(NC3CCCC3)c2)s1 ZINC000426664052 338037433 /nfs/dbraw/zinc/03/74/33/338037433.db2.gz CMMRPCKVODHMBY-UHFFFAOYSA-N 0 0 315.442 5.055 20 0 DKADRN Cc1cccc(C(C)C)c1NC(=O)c1cccc(Cl)c1C ZINC000426697190 338038381 /nfs/dbraw/zinc/03/83/81/338038381.db2.gz SJHHKNDBIFFICT-UHFFFAOYSA-N 0 0 301.817 5.333 20 0 DKADRN Cc1cccc(C)c1NC(=O)c1cc(-c2ccc(Cl)cc2)c[nH]1 ZINC000426713068 338038928 /nfs/dbraw/zinc/03/89/28/338038928.db2.gz AYBZBWGNZHBRHJ-UHFFFAOYSA-N 0 0 324.811 5.204 20 0 DKADRN Cc1cccc(C(C)C)c1NC(=O)c1ccc(F)c(Cl)c1 ZINC000426883392 332159563 /nfs/dbraw/zinc/15/95/63/332159563.db2.gz SHQQUOOEKHFVES-UHFFFAOYSA-N 0 0 305.780 5.163 20 0 DKADRN O=C(CC1CCCCCC1)Nc1ccccc1CC(F)(F)F ZINC000426916789 332161709 /nfs/dbraw/zinc/16/17/09/332161709.db2.gz QJYKMSRTAAOJRZ-UHFFFAOYSA-N 0 0 313.363 5.090 20 0 DKADRN Cc1cccc(C(C)C)c1NC(=O)C/C=C/c1ccccc1F ZINC000426965190 332163196 /nfs/dbraw/zinc/16/31/96/332163196.db2.gz OMMDHOKQZZVSMV-JXMROGBWSA-N 0 0 311.400 5.300 20 0 DKADRN Cc1cccc(C(C)C)c1NC(=O)C/C=C\c1ccccc1F ZINC000426965191 332163122 /nfs/dbraw/zinc/16/31/22/332163122.db2.gz OMMDHOKQZZVSMV-YFHOEESVSA-N 0 0 311.400 5.300 20 0 DKADRN C[C@@H](Nc1cc(Cl)ccc1OC1CCCC1)c1ccccn1 ZINC000426990695 332164208 /nfs/dbraw/zinc/16/42/08/332164208.db2.gz NGADUFUUMYDUCX-CYBMUJFWSA-N 0 0 316.832 5.230 20 0 DKADRN C[C@H](Nc1cc(Cl)ccc1OC1CCCC1)c1ccccn1 ZINC000426990698 332164085 /nfs/dbraw/zinc/16/40/85/332164085.db2.gz NGADUFUUMYDUCX-ZDUSSCGKSA-N 0 0 316.832 5.230 20 0 DKADRN Cc1ccc(C(=O)Nc2ccccc2SC(C)C)c(Cl)c1 ZINC000427088493 332167012 /nfs/dbraw/zinc/16/70/12/332167012.db2.gz SZRXBBTXEYTGMH-UHFFFAOYSA-N 0 0 319.857 5.401 20 0 DKADRN CCc1ccc(CC)c(NC(=O)c2ccc(C)cc2Cl)c1 ZINC000427379877 332410429 /nfs/dbraw/zinc/41/04/29/332410429.db2.gz OPUBPUGDBRLLIJ-UHFFFAOYSA-N 0 0 301.817 5.026 20 0 DKADRN Cc1c(NCc2cccc3ccccc32)cccc1-c1ncco1 ZINC000427397247 332415955 /nfs/dbraw/zinc/41/59/55/332415955.db2.gz GPKAJJWVZOTPLW-UHFFFAOYSA-N 0 0 314.388 5.415 20 0 DKADRN Cc1cc(CNc2ccc(-c3cccc(Cl)c3)cc2C)ncn1 ZINC000427400955 332416889 /nfs/dbraw/zinc/41/68/89/332416889.db2.gz SXUVRZDRIXGUFO-UHFFFAOYSA-N 0 0 323.827 5.026 20 0 DKADRN Cc1c(NCc2cccc(F)c2Cl)cccc1-c1ncco1 ZINC000427402026 332417729 /nfs/dbraw/zinc/41/77/29/332417729.db2.gz AFZWIOFAGKPHSN-UHFFFAOYSA-N 0 0 316.763 5.055 20 0 DKADRN Cc1cc(NCc2ccc(C(F)F)cc2)ccc1-c1ccncc1 ZINC000427403249 332417289 /nfs/dbraw/zinc/41/72/89/332417289.db2.gz FYDKSFZXFFPHNF-UHFFFAOYSA-N 0 0 324.374 5.607 20 0 DKADRN Cc1cc(NCc2ccc(Cl)s2)ccc1-c1ccncc1 ZINC000427404646 332417698 /nfs/dbraw/zinc/41/76/98/332417698.db2.gz KRKKBZKUHMYXCU-UHFFFAOYSA-N 0 0 314.841 5.384 20 0 DKADRN Cc1cc(NCc2cccc(C(F)F)c2)ccc1-c1ccncc1 ZINC000427408481 332418767 /nfs/dbraw/zinc/41/87/67/332418767.db2.gz VSZGBWHVQIKRRR-UHFFFAOYSA-N 0 0 324.374 5.607 20 0 DKADRN Cc1cc(NCCCCC2CCOCC2)ccc1-c1ccncc1 ZINC000427427668 332424555 /nfs/dbraw/zinc/42/45/55/332424555.db2.gz KOHLZEDLSCZDCV-UHFFFAOYSA-N 0 0 324.468 5.066 20 0 DKADRN Cc1cc(NCc2nc(C3CC3)cs2)ccc1-c1ccncc1 ZINC000427428628 332424767 /nfs/dbraw/zinc/42/47/67/332424767.db2.gz OSWCZVRANXCJRO-UHFFFAOYSA-N 0 0 321.449 5.003 20 0 DKADRN CC(=O)c1ccsc1NCc1nc(C2CCCCC2)cs1 ZINC000427429490 332424851 /nfs/dbraw/zinc/42/48/51/332424851.db2.gz UYTRNMKRIYHHJM-UHFFFAOYSA-N 0 0 320.483 5.067 20 0 DKADRN Cc1ccc(OC(F)F)c(CNc2cccc(C(F)F)c2)c1 ZINC000427431532 332425552 /nfs/dbraw/zinc/42/55/52/332425552.db2.gz KMGLESFUYOIXLS-UHFFFAOYSA-N 0 0 313.294 5.146 20 0 DKADRN Cc1ccc(F)cc1CNc1ccc(-c2ccncc2)c(C)c1 ZINC000427434255 332425690 /nfs/dbraw/zinc/42/56/90/332425690.db2.gz ISUBEZGOCNHACJ-UHFFFAOYSA-N 0 0 306.384 5.117 20 0 DKADRN Cc1cc(NCCCCC(F)(F)F)ccc1-c1ccncc1 ZINC000427434915 332425794 /nfs/dbraw/zinc/42/57/94/332425794.db2.gz LTDRTQGDPMBJOG-UHFFFAOYSA-N 0 0 308.347 5.202 20 0 DKADRN CC[C@H](C)Sc1ccc(N[C@H](C)c2cnc(C)cn2)c(C)c1 ZINC000427441712 332427093 /nfs/dbraw/zinc/42/70/93/332427093.db2.gz MNKVARMFTXZIFP-LSDHHAIUSA-N 0 0 315.486 5.157 20 0 DKADRN Cc1cnc([C@@H](C)Nc2cc(Cl)ccc2SC(C)C)cn1 ZINC000427444865 332427729 /nfs/dbraw/zinc/42/77/29/332427729.db2.gz VIPWWQMTKSMZNC-GFCCVEGCSA-N 0 0 321.877 5.112 20 0 DKADRN Cc1cnc([C@H](C)Nc2cc(Cl)ccc2SC(C)C)cn1 ZINC000427444866 332427588 /nfs/dbraw/zinc/42/75/88/332427588.db2.gz VIPWWQMTKSMZNC-LBPRGKRZSA-N 0 0 321.877 5.112 20 0 DKADRN Cc1c(N[C@H](C)c2c(F)cccc2F)cccc1-c1ncco1 ZINC000427453122 332429197 /nfs/dbraw/zinc/42/91/97/332429197.db2.gz XIZUAPXXYAVOPP-GFCCVEGCSA-N 0 0 314.335 5.101 20 0 DKADRN Cc1c(N[C@@H](C)c2c(F)cccc2F)cccc1-c1ncco1 ZINC000427453123 332429191 /nfs/dbraw/zinc/42/91/91/332429191.db2.gz XIZUAPXXYAVOPP-LBPRGKRZSA-N 0 0 314.335 5.101 20 0 DKADRN Cc1c(N[C@H](C)c2ccc(F)cc2F)cccc1-c1ncco1 ZINC000427453486 332429181 /nfs/dbraw/zinc/42/91/81/332429181.db2.gz ZLEMNEQYBCEQAV-GFCCVEGCSA-N 0 0 314.335 5.101 20 0 DKADRN Cc1c(N[C@@H](C)c2ccc(F)cc2F)cccc1-c1ncco1 ZINC000427453487 332429251 /nfs/dbraw/zinc/42/92/51/332429251.db2.gz ZLEMNEQYBCEQAV-LBPRGKRZSA-N 0 0 314.335 5.101 20 0 DKADRN Cc1c(N[C@@H]2CCc3ccc(Cl)cc32)cccc1-c1ncco1 ZINC000427454070 332429379 /nfs/dbraw/zinc/42/93/79/332429379.db2.gz VYFPSEJUTYEGQW-GOSISDBHSA-N 0 0 324.811 5.403 20 0 DKADRN Cc1c(N[C@H](C)c2cccc(Cl)c2)cccc1-c1ncco1 ZINC000427454416 332429369 /nfs/dbraw/zinc/42/93/69/332429369.db2.gz ZQYFMIALNKZMRP-CYBMUJFWSA-N 0 0 312.800 5.477 20 0 DKADRN Cc1c(N[C@@H](C)c2cccc(Cl)c2)cccc1-c1ncco1 ZINC000427454417 332429495 /nfs/dbraw/zinc/42/94/95/332429495.db2.gz ZQYFMIALNKZMRP-ZDUSSCGKSA-N 0 0 312.800 5.477 20 0 DKADRN Cc1c(N[C@H](C)c2cc(F)ccc2F)cccc1-c1ncco1 ZINC000427456366 332430253 /nfs/dbraw/zinc/43/02/53/332430253.db2.gz OWUAVQAEGFBDIP-GFCCVEGCSA-N 0 0 314.335 5.101 20 0 DKADRN Cc1c(N[C@@H](C)c2cc(F)ccc2F)cccc1-c1ncco1 ZINC000427456368 332430221 /nfs/dbraw/zinc/43/02/21/332430221.db2.gz OWUAVQAEGFBDIP-LBPRGKRZSA-N 0 0 314.335 5.101 20 0 DKADRN Cc1c(N[C@H](C)c2ccccc2Cl)cccc1-c1ncco1 ZINC000427456929 332430222 /nfs/dbraw/zinc/43/02/22/332430222.db2.gz RPGOXOGYXFRBGU-CYBMUJFWSA-N 0 0 312.800 5.477 20 0 DKADRN CC(C)c1ccc(/C=C/CC(=O)N2CC3(CCC3)[C@H]2C2CC2)cc1 ZINC000427585459 332456214 /nfs/dbraw/zinc/45/62/14/332456214.db2.gz GDNFPPWGBRLRCI-LAEWNIMASA-N 0 0 323.480 5.004 20 0 DKADRN CC(C)c1ccc(/C=C\CC(=O)N2CC3(CCC3)[C@H]2C2CC2)cc1 ZINC000427585461 332456244 /nfs/dbraw/zinc/45/62/44/332456244.db2.gz GDNFPPWGBRLRCI-VEBBDIFPSA-N 0 0 323.480 5.004 20 0 DKADRN CCCCOc1ccccc1NC(=O)c1ccc(C)cc1Cl ZINC000427602324 332460532 /nfs/dbraw/zinc/46/05/32/332460532.db2.gz FLXBZFIKMGLHQD-UHFFFAOYSA-N 0 0 317.816 5.080 20 0 DKADRN Cc1cnc([C@H](C)S[C@@H](C)CCSc2ccccc2)cn1 ZINC000427663635 332479466 /nfs/dbraw/zinc/47/94/66/332479466.db2.gz PASWIFAQJIHZSG-GJZGRUSLSA-N 0 0 318.511 5.150 20 0 DKADRN CC(C)O[C@@H](CSCCCC1CCOCC1)c1ccccc1 ZINC000427664895 332481323 /nfs/dbraw/zinc/48/13/23/332481323.db2.gz UMJMJIWAPOBPOL-IBGZPJMESA-N 0 0 322.514 5.093 20 0 DKADRN Cc1cnc([C@@H](C)SCc2cccc(Cl)c2Cl)cn1 ZINC000427667534 332480827 /nfs/dbraw/zinc/48/08/27/332480827.db2.gz CMDVCPNWLGTWKO-SNVBAGLBSA-N 0 0 313.253 5.086 20 0 DKADRN Cc1cc(CS[C@@H](C)c2cc(Cl)ccc2Cl)ncn1 ZINC000427671327 332481740 /nfs/dbraw/zinc/48/17/40/332481740.db2.gz ILGPGAWSFKLRFR-JTQLQIEISA-N 0 0 313.253 5.086 20 0 DKADRN Cc1cc(CS[C@H](C)c2ccc(Cl)cc2Cl)ncn1 ZINC000427675676 332485361 /nfs/dbraw/zinc/48/53/61/332485361.db2.gz ZWWLUWXSFOTXII-SNVBAGLBSA-N 0 0 313.253 5.086 20 0 DKADRN Cc1nc(CSC[C@@H](OC(C)C)c2ccccc2)c(C)s1 ZINC000427676699 332484552 /nfs/dbraw/zinc/48/45/52/332484552.db2.gz HKBZRQOQPAYUCO-QGZVFWFLSA-N 0 0 321.511 5.159 20 0 DKADRN Cc1cnc([C@@H](C)S[C@H](C)c2cccc(Cl)c2F)cn1 ZINC000427676763 332484771 /nfs/dbraw/zinc/48/47/71/332484771.db2.gz HWWKFGCBBNJYKP-GHMZBOCLSA-N 0 0 310.825 5.133 20 0 DKADRN Cc1cnc([C@H](C)S[C@H](C)c2cccc(Cl)c2F)cn1 ZINC000427676771 332484698 /nfs/dbraw/zinc/48/46/98/332484698.db2.gz HWWKFGCBBNJYKP-MNOVXSKESA-N 0 0 310.825 5.133 20 0 DKADRN Cc1cnc([C@H](C)S[C@@H](C)c2cccc(Cl)c2F)cn1 ZINC000427676772 332484722 /nfs/dbraw/zinc/48/47/22/332484722.db2.gz HWWKFGCBBNJYKP-QWRGUYRKSA-N 0 0 310.825 5.133 20 0 DKADRN Cc1cnc([C@@H](C)S[C@H](C)c2ccc(F)c(Cl)c2)cn1 ZINC000427678120 332484920 /nfs/dbraw/zinc/48/49/20/332484920.db2.gz KBBFRFMIILOQFS-GHMZBOCLSA-N 0 0 310.825 5.133 20 0 DKADRN Cc1cnc([C@H](C)S[C@@H](C)c2ccc(F)c(Cl)c2)cn1 ZINC000427678122 332484909 /nfs/dbraw/zinc/48/49/09/332484909.db2.gz KBBFRFMIILOQFS-QWRGUYRKSA-N 0 0 310.825 5.133 20 0 DKADRN Cc1cnc([C@@H](C)S[C@@H](C)c2ccc(F)c(Cl)c2)cn1 ZINC000427678123 332484927 /nfs/dbraw/zinc/48/49/27/332484927.db2.gz KBBFRFMIILOQFS-WDEREUQCSA-N 0 0 310.825 5.133 20 0 DKADRN Cc1cnc([C@H](C)SCc2ccc(Cl)c(Cl)c2)cn1 ZINC000427678551 332485134 /nfs/dbraw/zinc/48/51/34/332485134.db2.gz NFJOSYBHALFFRB-JTQLQIEISA-N 0 0 313.253 5.086 20 0 DKADRN Cc1cnc([C@@H](C)SCc2ccc(Cl)c(Cl)c2)cn1 ZINC000427678552 332485127 /nfs/dbraw/zinc/48/51/27/332485127.db2.gz NFJOSYBHALFFRB-SNVBAGLBSA-N 0 0 313.253 5.086 20 0 DKADRN CC(C)O[C@H](CSC[C@H](C)C(F)(F)F)c1ccccc1 ZINC000427678822 332485132 /nfs/dbraw/zinc/48/51/32/332485132.db2.gz NYAQIDLDDNPPKP-GXTWGEPZSA-N 0 0 306.393 5.084 20 0 DKADRN CCc1nc(CSC[C@@H](OC(C)C)c2ccccc2)cs1 ZINC000427679421 332485371 /nfs/dbraw/zinc/48/53/71/332485371.db2.gz RHNJIIJPNVKGNG-MRXNPFEDSA-N 0 0 321.511 5.105 20 0 DKADRN CC[C@@H](S[C@@H](C)c1cnc(C)cn1)c1ccc(F)cc1F ZINC000427681316 332486342 /nfs/dbraw/zinc/48/63/42/332486342.db2.gz WXPXVCRNOJUYIM-MEDUHNTESA-N 0 0 308.397 5.009 20 0 DKADRN Cc1cnc([C@@H](C)SCc2cc(Cl)cc(Cl)c2)cn1 ZINC000427683738 332486774 /nfs/dbraw/zinc/48/67/74/332486774.db2.gz YDHTWSNJRQBGIQ-SNVBAGLBSA-N 0 0 313.253 5.086 20 0 DKADRN Cc1cnc([C@@H](C)S[C@@H](C)c2ccc3ccccc3c2)cn1 ZINC000427694053 332489596 /nfs/dbraw/zinc/48/95/96/332489596.db2.gz IEXRARCEELLBSD-LSDHHAIUSA-N 0 0 308.450 5.494 20 0 DKADRN Cc1cc(CS[C@H](c2ccccc2)c2ccccc2C)ncn1 ZINC000427698513 332492031 /nfs/dbraw/zinc/49/20/31/332492031.db2.gz UINQGFDBZJFBPJ-HXUWFJFHSA-N 0 0 320.461 5.116 20 0 DKADRN Cc1cc(CSCc2sc3ccccc3c2Cl)ncn1 ZINC000427700537 332491407 /nfs/dbraw/zinc/49/14/07/332491407.db2.gz BONHINXUBKFOHB-UHFFFAOYSA-N 0 0 320.870 5.087 20 0 DKADRN Cc1cnc([C@@H](C)SCc2ccc(Cl)cc2Cl)cn1 ZINC000427700965 332491644 /nfs/dbraw/zinc/49/16/44/332491644.db2.gz GFCKGHWMHAOCFI-SNVBAGLBSA-N 0 0 313.253 5.086 20 0 DKADRN CC(C)n1cc(CS[C@H](C)c2ccc3ccccc3c2)nn1 ZINC000427716142 332497829 /nfs/dbraw/zinc/49/78/29/332497829.db2.gz VPQSXAVOOKPQGH-CQSZACIVSA-N 0 0 311.454 5.007 20 0 DKADRN Cc1cc(N[C@H]2CCc3ccc(F)cc32)ccc1-c1ccncc1 ZINC000427815002 332525099 /nfs/dbraw/zinc/52/50/99/332525099.db2.gz DDHUHGYVKOPUTR-NRFANRHFSA-N 0 0 318.395 5.296 20 0 DKADRN Cc1cc(N[C@@H]2CCc3ccc(F)cc32)ccc1-c1ccncc1 ZINC000427815003 332525139 /nfs/dbraw/zinc/52/51/39/332525139.db2.gz DDHUHGYVKOPUTR-OAQYLSRUSA-N 0 0 318.395 5.296 20 0 DKADRN Cc1cc(N[C@@H](C)c2ccccc2F)ccc1-c1ccncc1 ZINC000427825978 332529815 /nfs/dbraw/zinc/52/98/15/332529815.db2.gz IXUYVBPGHXBWCQ-HNNXBMFYSA-N 0 0 306.384 5.369 20 0 DKADRN Cc1cc(N[C@@H](C)c2cccc(F)c2)ccc1-c1ccncc1 ZINC000427829564 332530627 /nfs/dbraw/zinc/53/06/27/332530627.db2.gz SCCXPVLIRPOIBA-HNNXBMFYSA-N 0 0 306.384 5.369 20 0 DKADRN Cc1cc(N[C@H](C)c2cccc(F)c2)ccc1-c1ccncc1 ZINC000427829565 332530640 /nfs/dbraw/zinc/53/06/40/332530640.db2.gz SCCXPVLIRPOIBA-OAHLLOKOSA-N 0 0 306.384 5.369 20 0 DKADRN Cc1cc(N[C@@H](C)c2ccc(F)cc2)ccc1-c1ccncc1 ZINC000427837473 332535439 /nfs/dbraw/zinc/53/54/39/332535439.db2.gz GGKACLQEIAGPMM-HNNXBMFYSA-N 0 0 306.384 5.369 20 0 DKADRN Cc1cc(N[C@H](C)c2ccc(F)cc2)ccc1-c1ccncc1 ZINC000427837475 332535494 /nfs/dbraw/zinc/53/54/94/332535494.db2.gz GGKACLQEIAGPMM-OAHLLOKOSA-N 0 0 306.384 5.369 20 0 DKADRN CCSc1ccccc1[C@H](C)Nc1cnn([C@@H](C)C2CC2)c1 ZINC000427843573 332536884 /nfs/dbraw/zinc/53/68/84/332536884.db2.gz AOCSKXNDIDFBQQ-KBPBESRZSA-N 0 0 315.486 5.139 20 0 DKADRN CCSc1ccccc1[C@H](C)Nc1cnn([C@H](C)C2CC2)c1 ZINC000427843575 332537006 /nfs/dbraw/zinc/53/70/06/332537006.db2.gz AOCSKXNDIDFBQQ-UONOGXRCSA-N 0 0 315.486 5.139 20 0 DKADRN Cc1cc(N[C@@H](C)c2ccc(F)c(F)c2)ccc1-c1ccncc1 ZINC000427855035 332541374 /nfs/dbraw/zinc/54/13/74/332541374.db2.gz RXJLUPMBINXBJJ-AWEZNQCLSA-N 0 0 324.374 5.508 20 0 DKADRN C[C@@H](C1CC1)n1cc(N[C@@H](c2ccc(Cl)cc2)C2CC2)cn1 ZINC000427860002 332544947 /nfs/dbraw/zinc/54/49/47/332544947.db2.gz YTMJRAQZJGZKBN-KPZWWZAWSA-N 0 0 315.848 5.071 20 0 DKADRN CC(C)C[C@@H](Nc1cnn([C@@H](C)C2CC2)c1)c1cccs1 ZINC000427866007 332550508 /nfs/dbraw/zinc/55/05/08/332550508.db2.gz JOPJGBPVIWUJLP-XJKSGUPXSA-N 0 0 303.475 5.115 20 0 DKADRN Cc1cc(N[C@@H](C)c2ccc(F)cc2F)ccc1-c1ccncc1 ZINC000427866750 332550708 /nfs/dbraw/zinc/55/07/08/332550708.db2.gz SPGWZJUGMMXYQQ-AWEZNQCLSA-N 0 0 324.374 5.508 20 0 DKADRN Cc1cc(N[C@H](C)c2ccc(F)cc2F)ccc1-c1ccncc1 ZINC000427866751 332550680 /nfs/dbraw/zinc/55/06/80/332550680.db2.gz SPGWZJUGMMXYQQ-CQSZACIVSA-N 0 0 324.374 5.508 20 0 DKADRN C[C@H](C1CC1)n1cc(N[C@H](c2cccs2)C2CCCC2)cn1 ZINC000427873783 332551937 /nfs/dbraw/zinc/55/19/37/332551937.db2.gz PIDJBIXJMFHJJH-ACJLOTCBSA-N 0 0 315.486 5.259 20 0 DKADRN CCC(=O)Nc1ccc(N[C@H](c2ccc(C)cc2)C2CCC2)cc1 ZINC000427877507 332553012 /nfs/dbraw/zinc/55/30/12/332553012.db2.gz OQDFZQZNOFFVQC-NRFANRHFSA-N 0 0 322.452 5.297 20 0 DKADRN CCC(=O)Nc1ccc(N[C@@H](c2ccc(C)cc2)C2CCC2)cc1 ZINC000427877508 332553014 /nfs/dbraw/zinc/55/30/14/332553014.db2.gz OQDFZQZNOFFVQC-OAQYLSRUSA-N 0 0 322.452 5.297 20 0 DKADRN C[C@@H](C1CC1)n1cc(NC(c2ccccc2)c2ccccc2)cn1 ZINC000427880370 332553216 /nfs/dbraw/zinc/55/32/16/332553216.db2.gz FINJYYAPCLTTNL-INIZCTEOSA-N 0 0 317.436 5.056 20 0 DKADRN CCSc1ccc([C@H](C)Nc2cnn([C@@H](C)C3CC3)c2)cc1 ZINC000427885894 332554580 /nfs/dbraw/zinc/55/45/80/332554580.db2.gz KLFZIBQGSAQJBV-KBPBESRZSA-N 0 0 315.486 5.139 20 0 DKADRN Cc1c2ccccc2oc1[C@@H](C)Nc1cnn([C@@H](C)C2CC2)c1 ZINC000427886975 332556027 /nfs/dbraw/zinc/55/60/27/332556027.db2.gz RNTGXSRUOUMUGM-KGLIPLIRSA-N 0 0 309.413 5.082 20 0 DKADRN Cc1c2ccccc2oc1[C@H](C)Nc1cnn([C@H](C)C2CC2)c1 ZINC000427886977 332556012 /nfs/dbraw/zinc/55/60/12/332556012.db2.gz RNTGXSRUOUMUGM-UONOGXRCSA-N 0 0 309.413 5.082 20 0 DKADRN Cc1c2ccccc2oc1[C@@H](C)Nc1cnn([C@H](C)C2CC2)c1 ZINC000427886978 332555951 /nfs/dbraw/zinc/55/59/51/332555951.db2.gz RNTGXSRUOUMUGM-ZIAGYGMSSA-N 0 0 309.413 5.082 20 0 DKADRN C[C@H](C1CC1)n1cc(N[C@@H](C)c2cccc(C(F)(F)F)c2)cn1 ZINC000427887230 332555344 /nfs/dbraw/zinc/55/53/44/332555344.db2.gz OYYKEKYZBXUSTR-NWDGAFQWSA-N 0 0 323.362 5.046 20 0 DKADRN C[C@H](Nc1cnn([C@@H](C)C2CC2)c1)c1cccc(C(F)(F)F)c1 ZINC000427887232 332555391 /nfs/dbraw/zinc/55/53/91/332555391.db2.gz OYYKEKYZBXUSTR-RYUDHWBXSA-N 0 0 323.362 5.046 20 0 DKADRN C[C@@H](Nc1cnn([C@H](C)C2CC2)c1)c1cccc(C(F)(F)F)c1 ZINC000427887234 332555417 /nfs/dbraw/zinc/55/54/17/332555417.db2.gz OYYKEKYZBXUSTR-VXGBXAGGSA-N 0 0 323.362 5.046 20 0 DKADRN Cc1ccc(Cl)cc1NC(=O)c1ccc(C(C)(F)F)cc1 ZINC000427986338 332581776 /nfs/dbraw/zinc/58/17/76/332581776.db2.gz WVPUGOFANWFGQD-UHFFFAOYSA-N 0 0 309.743 5.012 20 0 DKADRN Cc1c(Cl)cccc1NC(=O)c1ccc(C(C)(F)F)cc1 ZINC000427997490 332584856 /nfs/dbraw/zinc/58/48/56/332584856.db2.gz SNPSSRZYNQLMNN-UHFFFAOYSA-N 0 0 309.743 5.012 20 0 DKADRN Cc1cc(Cl)ccc1NC(=O)c1ccc(C(C)(F)F)cc1 ZINC000428003414 332587759 /nfs/dbraw/zinc/58/77/59/332587759.db2.gz CMDHKVFNCBVZFK-UHFFFAOYSA-N 0 0 309.743 5.012 20 0 DKADRN O=C(Nc1ccc(C2CCC2)cc1)c1c[nH]cc1-c1ccccc1 ZINC000428039452 333509828 /nfs/dbraw/zinc/50/98/28/333509828.db2.gz DYUJWMAEKGLKNA-UHFFFAOYSA-N 0 0 316.404 5.202 20 0 DKADRN Cc1cc(Cl)ccc1C(=O)Nc1cc(Cl)ccc1Cl ZINC000428168934 338041682 /nfs/dbraw/zinc/04/16/82/338041682.db2.gz XAZAGHVKRQCAIB-UHFFFAOYSA-N 0 0 314.599 5.208 20 0 DKADRN CCc1nc(C)c(CN(C)[C@@H](c2ccccc2Cl)C(C)C)o1 ZINC000428211602 338042527 /nfs/dbraw/zinc/04/25/27/338042527.db2.gz LSUXCJYNTULYHP-GOSISDBHSA-N 0 0 320.864 5.028 20 0 DKADRN CCc1nc(C)c(CN(C)[C@H](c2ccccc2Cl)C(C)C)o1 ZINC000428211605 338042575 /nfs/dbraw/zinc/04/25/75/338042575.db2.gz LSUXCJYNTULYHP-SFHVURJKSA-N 0 0 320.864 5.028 20 0 DKADRN Cc1nc(C(C)C)oc1CN1CCC[C@H]1c1ccc(Cl)cc1 ZINC000428250557 338044416 /nfs/dbraw/zinc/04/44/16/338044416.db2.gz WMESQVHWGOSSTB-INIZCTEOSA-N 0 0 318.848 5.097 20 0 DKADRN Cc1nc(C(C)C)oc1CN1CCC[C@@H]1c1ccc(Cl)cc1 ZINC000428250558 338044330 /nfs/dbraw/zinc/04/43/30/338044330.db2.gz WMESQVHWGOSSTB-MRXNPFEDSA-N 0 0 318.848 5.097 20 0 DKADRN CC[C@H]([NH2+]Cc1oc(C(C)C)nc1C)c1ccc(Cl)cc1 ZINC000428286204 338045550 /nfs/dbraw/zinc/04/55/50/338045550.db2.gz AMCDMLRGDWEQCZ-HNNXBMFYSA-N 0 0 306.837 5.001 20 0 DKADRN CC[C@@H]([NH2+]Cc1oc(C(C)C)nc1C)c1ccc(Cl)cc1 ZINC000428286207 338045609 /nfs/dbraw/zinc/04/56/09/338045609.db2.gz AMCDMLRGDWEQCZ-OAHLLOKOSA-N 0 0 306.837 5.001 20 0 DKADRN Cc1nc(C(C)C)oc1C[NH2+][C@@H](CC(C)(C)C)c1ccccc1 ZINC000428313036 338046796 /nfs/dbraw/zinc/04/67/96/338046796.db2.gz HEEPYPGIHBRLRD-KRWDZBQOSA-N 0 0 314.473 5.374 20 0 DKADRN Cc1nc(C(C)C)oc1C[NH2+][C@H](CC(C)(C)C)c1ccccc1 ZINC000428313042 338046822 /nfs/dbraw/zinc/04/68/22/338046822.db2.gz HEEPYPGIHBRLRD-QGZVFWFLSA-N 0 0 314.473 5.374 20 0 DKADRN Cc1nc(C(C)C)oc1CN[C@@H](C)c1oc2ccccc2c1C ZINC000428328466 338047503 /nfs/dbraw/zinc/04/75/03/338047503.db2.gz YWJAKIMPDZZEGX-AWEZNQCLSA-N 0 0 312.413 5.012 20 0 DKADRN Cc1nc(C(C)C)oc1CN[C@H](C)c1oc2ccccc2c1C ZINC000428328467 338047532 /nfs/dbraw/zinc/04/75/32/338047532.db2.gz YWJAKIMPDZZEGX-CQSZACIVSA-N 0 0 312.413 5.012 20 0 DKADRN CC1(CC(=O)Nc2ccccc2-c2nc3ccccc3s2)CC1 ZINC000428329700 332482605 /nfs/dbraw/zinc/48/26/05/332482605.db2.gz ITEYKFPLPJDBLH-UHFFFAOYSA-N 0 0 322.433 5.092 20 0 DKADRN Cc1nc(C(C)C)oc1C[NH2+][C@H](C)c1cc2ccccc2s1 ZINC000428355029 338048557 /nfs/dbraw/zinc/04/85/57/338048557.db2.gz NDPCYQFUFXFUSU-CYBMUJFWSA-N 0 0 314.454 5.172 20 0 DKADRN Cc1nc(C(C)C)oc1C[NH2+][C@@H](C)c1cc2ccccc2s1 ZINC000428355030 338048490 /nfs/dbraw/zinc/04/84/90/338048490.db2.gz NDPCYQFUFXFUSU-ZDUSSCGKSA-N 0 0 314.454 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CCC(=O)c1cccc(N[C@H](C)c2ccc(OC)c(Cl)c2)c1 ZINC000433388640 338194495 /nfs/dbraw/zinc/19/44/95/338194495.db2.gz VJQBOBYTBSUCBE-GFCCVEGCSA-N 0 0 317.816 5.114 20 0 DKADRN CCC(=O)c1cccc(N[C@@H](C)c2ccc(OC)c(Cl)c2)c1 ZINC000433388642 338194519 /nfs/dbraw/zinc/19/45/19/338194519.db2.gz VJQBOBYTBSUCBE-LBPRGKRZSA-N 0 0 317.816 5.114 20 0 DKADRN CCC(CC)[S@](=O)Cc1ccc(Oc2ccccc2)c(F)c1 ZINC000433400943 338194680 /nfs/dbraw/zinc/19/46/80/338194680.db2.gz VSVFMSKBGCRSLK-JOCHJYFZSA-N 0 0 320.429 5.055 20 0 DKADRN CCC(CC)[S@@](=O)Cc1ccc(Oc2ccccc2)c(F)c1 ZINC000433400944 338194614 /nfs/dbraw/zinc/19/46/14/338194614.db2.gz VSVFMSKBGCRSLK-QFIPXVFZSA-N 0 0 320.429 5.055 20 0 DKADRN CCC(=O)c1cccc(N[C@H](C)c2ccc(OC(F)F)cc2)c1 ZINC000433403599 338194697 /nfs/dbraw/zinc/19/46/97/338194697.db2.gz PKHXELRMFJQBKW-GFCCVEGCSA-N 0 0 319.351 5.054 20 0 DKADRN CCC(=O)c1cccc(N[C@@H](C)c2ccc(OC(F)F)cc2)c1 ZINC000433403600 338194726 /nfs/dbraw/zinc/19/47/26/338194726.db2.gz PKHXELRMFJQBKW-LBPRGKRZSA-N 0 0 319.351 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Cc1nnc([C@H](C)SCc2ccc(-c3cccs3)cc2)o1 ZINC000434630957 338221922 /nfs/dbraw/zinc/22/19/22/338221922.db2.gz NNMIADMXYKMSFG-NSHDSACASA-N 0 0 316.451 5.101 20 0 DKADRN CCCc1nnc(SCc2ccc(-c3cccs3)cc2)o1 ZINC000434650176 338222400 /nfs/dbraw/zinc/22/24/00/338222400.db2.gz JOFDMCHWRUWCEM-UHFFFAOYSA-N 0 0 316.451 5.043 20 0 DKADRN Cc1ccc(Cl)c(NCc2nc(C(F)(F)F)cs2)c1C ZINC000434738950 338224400 /nfs/dbraw/zinc/22/44/00/338224400.db2.gz PUNXQLZZAZPCAE-UHFFFAOYSA-N 0 0 320.767 5.044 20 0 DKADRN Cc1oc(-c2cccs2)nc1CNc1c(F)cccc1Cl ZINC000434740718 338224381 /nfs/dbraw/zinc/22/43/81/338224381.db2.gz XSJNKBHMAUARQU-UHFFFAOYSA-N 0 0 322.792 5.116 20 0 DKADRN Fc1cccc(Cl)c1NCc1csc(-c2ccsc2)n1 ZINC000434740865 338224407 /nfs/dbraw/zinc/22/44/07/338224407.db2.gz ZBNRQXMPTALLPD-UHFFFAOYSA-N 0 0 324.833 5.276 20 0 DKADRN CC(C)(C)c1csc(COc2cnccc2-c2ccccc2)n1 ZINC000434747056 338224640 /nfs/dbraw/zinc/22/46/40/338224640.db2.gz KTZQYUMXDCTBGK-UHFFFAOYSA-N 0 0 324.449 5.082 20 0 DKADRN FC(F)c1ccc(COc2cnccc2-c2ccccc2)cc1 ZINC000434750369 338224810 /nfs/dbraw/zinc/22/48/10/338224810.db2.gz ZOZLPYDJBAVUCW-UHFFFAOYSA-N 0 0 311.331 5.265 20 0 DKADRN c1csc(-c2ccc(CNc3ccc4c(c3)COC4)cc2)c1 ZINC000434752903 338224992 /nfs/dbraw/zinc/22/49/92/338224992.db2.gz DDZLACCJGJQWOU-UHFFFAOYSA-N 0 0 307.418 5.057 20 0 DKADRN CC(C)(C)c1nc(COc2cnccc2-c2ccccc2)cs1 ZINC000434754561 338224927 /nfs/dbraw/zinc/22/49/27/338224927.db2.gz USBKJGMLCQQASB-UHFFFAOYSA-N 0 0 324.449 5.082 20 0 DKADRN O=C(NC1CCC2(CC2)CC1)N(c1ccccc1)c1ccccc1 ZINC000434784908 338225473 /nfs/dbraw/zinc/22/54/73/338225473.db2.gz OCLBUMDIXIBOMC-UHFFFAOYSA-N 0 0 320.436 5.257 20 0 DKADRN CC(C)c1ccc(C(=O)Nc2ccccc2-c2ccccc2)cn1 ZINC000435032886 338230097 /nfs/dbraw/zinc/23/00/97/338230097.db2.gz IPKGGWTZFAMFBE-UHFFFAOYSA-N 0 0 316.404 5.124 20 0 DKADRN CCN(C(=O)c1ccc(C(C)C)nc1)c1cccc2ccccc21 ZINC000435049454 338231020 /nfs/dbraw/zinc/23/10/20/338231020.db2.gz NONWLVDINAAVGT-UHFFFAOYSA-N 0 0 318.420 5.025 20 0 DKADRN CC(C)c1ccc(C(=O)Nc2ccccc2-c2cccs2)cn1 ZINC000435060621 338231509 /nfs/dbraw/zinc/23/15/09/338231509.db2.gz ZTMLNHHHGIJOHJ-UHFFFAOYSA-N 0 0 322.433 5.186 20 0 DKADRN Cc1cccc(C(C)C)c1NC(=O)N1[C@H](C)C[C@H]2CCCC[C@H]21 ZINC000435092534 338231990 /nfs/dbraw/zinc/23/19/90/338231990.db2.gz WKEARTBTCQHYDC-JFIYKMOQSA-N 0 0 314.473 5.303 20 0 DKADRN Cc1cccc(C(C)C)c1NC(=O)N1[C@H](C)C[C@@H]2CCCC[C@H]21 ZINC000435092535 338231946 /nfs/dbraw/zinc/23/19/46/338231946.db2.gz WKEARTBTCQHYDC-SOLBZPMBSA-N 0 0 314.473 5.303 20 0 DKADRN CCCc1ccccc1NC(=O)N1CC[C@H](c2ccccc2)[C@H]1C ZINC000435138375 338233160 /nfs/dbraw/zinc/23/31/60/338233160.db2.gz JLWQNCPWIPSJJO-APWZRJJASA-N 0 0 322.452 5.049 20 0 DKADRN CCCc1ccccc1NC(=O)N1CC[C@H](c2ccccc2)[C@@H]1C ZINC000435138376 338233045 /nfs/dbraw/zinc/23/30/45/338233045.db2.gz JLWQNCPWIPSJJO-LPHOPBHVSA-N 0 0 322.452 5.049 20 0 DKADRN CCCc1ccccc1NC(=O)N1CC[C@@H](c2ccccc2)[C@@H]1C ZINC000435138377 338233071 /nfs/dbraw/zinc/23/30/71/338233071.db2.gz JLWQNCPWIPSJJO-QFBILLFUSA-N 0 0 322.452 5.049 20 0 DKADRN CCCc1ccccc1NC(=O)N1CC[C@@H](c2ccccc2)[C@H]1C ZINC000435138378 338233148 /nfs/dbraw/zinc/23/31/48/338233148.db2.gz JLWQNCPWIPSJJO-VQIMIIECSA-N 0 0 322.452 5.049 20 0 DKADRN CCc1cc(C)cc(CC)c1NC(=O)N(C)[C@@H](C)c1ccccc1 ZINC000435170494 338233699 /nfs/dbraw/zinc/23/36/99/338233699.db2.gz GYPCPERFIXNTRE-INIZCTEOSA-N 0 0 324.468 5.345 20 0 DKADRN CCc1cc(C)cc(CC)c1NC(=O)N(C)[C@H](C)c1ccccc1 ZINC000435170495 338233645 /nfs/dbraw/zinc/23/36/45/338233645.db2.gz GYPCPERFIXNTRE-MRXNPFEDSA-N 0 0 324.468 5.345 20 0 DKADRN CC(C)c1ccc(C(=O)Nc2c(C(C)C)cccc2C(C)C)cn1 ZINC000435171817 338233703 /nfs/dbraw/zinc/23/37/03/338233703.db2.gz SXSFDLWVPPUPLI-UHFFFAOYSA-N 0 0 324.468 5.704 20 0 DKADRN C(=C/c1nc2ccccc2o1)\c1cnc(-c2cccs2)s1 ZINC000435173406 338233789 /nfs/dbraw/zinc/23/37/89/338233789.db2.gz LIBGEWTWKUSMKB-BQYQJAHWSA-N 0 0 310.403 5.183 20 0 DKADRN C(=C\c1nc2ccccc2o1)\c1cnc(-c2cccs2)s1 ZINC000435173407 338233812 /nfs/dbraw/zinc/23/38/12/338233812.db2.gz LIBGEWTWKUSMKB-FPLPWBNLSA-N 0 0 310.403 5.183 20 0 DKADRN CCc1cc(C)cc(CC)c1NC(=O)N1Cc2ccccc2[C@@H]1C ZINC000435182322 338233943 /nfs/dbraw/zinc/23/39/43/338233943.db2.gz QVVHJBYYWXCHDU-HNNXBMFYSA-N 0 0 322.452 5.229 20 0 DKADRN CCc1cc(C)cc(CC)c1NC(=O)N1Cc2ccccc2[C@H]1C ZINC000435182323 338233957 /nfs/dbraw/zinc/23/39/57/338233957.db2.gz QVVHJBYYWXCHDU-OAHLLOKOSA-N 0 0 322.452 5.229 20 0 DKADRN CCc1cc(C)cc(CC)c1NC(=O)N(CC)[C@@H](C)C(C)C ZINC000435189990 338234401 /nfs/dbraw/zinc/23/44/01/338234401.db2.gz XEAZCOJGCMYLFO-HNNXBMFYSA-N 0 0 304.478 5.018 20 0 DKADRN CCc1cc(C)cc(CC)c1NC(=O)N(CC)[C@H](C)C(C)C ZINC000435189991 338234348 /nfs/dbraw/zinc/23/43/48/338234348.db2.gz XEAZCOJGCMYLFO-OAHLLOKOSA-N 0 0 304.478 5.018 20 0 DKADRN CCc1cc(C)cc(CC)c1NC(=O)Nc1cccc2[nH]ccc21 ZINC000435195234 338234538 /nfs/dbraw/zinc/23/45/38/338234538.db2.gz XPXDEUXCKHLNDR-UHFFFAOYSA-N 0 0 321.424 5.245 20 0 DKADRN CCc1cc(C)cc(CC)c1NC(=O)Nc1cscc1C ZINC000435195392 338234536 /nfs/dbraw/zinc/23/45/36/338234536.db2.gz YOWOLSFFLPLBHW-UHFFFAOYSA-N 0 0 302.443 5.134 20 0 DKADRN CCCc1cc(=O)[nH]c(C(=CC(C)=Cc2ccccc2)CC)n1 ZINC000435338942 338237494 /nfs/dbraw/zinc/23/74/94/338237494.db2.gz LWCYXMLHUWANIS-AYCYWLMJSA-N 0 0 308.425 5.032 20 0 DKADRN CCCc1cc(=O)[nH]c(C(=CC(C)=Cc2ccccc2)CC)n1 ZINC000435338943 338237507 /nfs/dbraw/zinc/23/75/07/338237507.db2.gz LWCYXMLHUWANIS-KDOCSACZSA-N 0 0 308.425 5.032 20 0 DKADRN FC(F)n1ccnc1CSCc1ccc(Cl)cc1Cl ZINC000435377885 338238267 /nfs/dbraw/zinc/23/82/67/338238267.db2.gz GGBFYPRBNRVTGM-UHFFFAOYSA-N 0 0 323.195 5.018 20 0 DKADRN CC[C@@H](SCc1nccn1C(F)F)c1ccc(Cl)cc1 ZINC000435378056 338238265 /nfs/dbraw/zinc/23/82/65/338238265.db2.gz GWMYVIHBPIUDPM-GFCCVEGCSA-N 0 0 316.804 5.316 20 0 DKADRN CC[C@H](SCc1nccn1C(F)F)c1ccc(Cl)cc1 ZINC000435378057 338238262 /nfs/dbraw/zinc/23/82/62/338238262.db2.gz GWMYVIHBPIUDPM-LBPRGKRZSA-N 0 0 316.804 5.316 20 0 DKADRN FC(F)n1ccnc1CSCc1ccc(Cl)c(Cl)c1 ZINC000435378930 338238348 /nfs/dbraw/zinc/23/83/48/338238348.db2.gz KRLUWLXDGTVZCK-UHFFFAOYSA-N 0 0 323.195 5.018 20 0 DKADRN C[C@@H](SCc1nccn1C(F)F)c1ccc2ccccc2c1 ZINC000435391022 338238752 /nfs/dbraw/zinc/23/87/52/338238752.db2.gz CXULKXYRAKIESH-GFCCVEGCSA-N 0 0 318.392 5.426 20 0 DKADRN C[C@H](SCc1nccn1C(F)F)c1ccc2ccccc2c1 ZINC000435391026 338238784 /nfs/dbraw/zinc/23/87/84/338238784.db2.gz CXULKXYRAKIESH-LBPRGKRZSA-N 0 0 318.392 5.426 20 0 DKADRN CCCC(CCC)[S@@](=O)Cc1nc(-c2ccccc2)cs1 ZINC000435415386 338239554 /nfs/dbraw/zinc/23/95/54/338239554.db2.gz BFHPMXOSSJSYMX-NRFANRHFSA-N 0 0 321.511 5.028 20 0 DKADRN CCCC(CCC)[S@](=O)Cc1nc(-c2ccccc2)cs1 ZINC000435415387 338239487 /nfs/dbraw/zinc/23/94/87/338239487.db2.gz BFHPMXOSSJSYMX-OAQYLSRUSA-N 0 0 321.511 5.028 20 0 DKADRN CCC(CC)(CC)[S@@](=O)Cc1nc(-c2ccccc2)cs1 ZINC000435430765 338240020 /nfs/dbraw/zinc/24/00/20/338240020.db2.gz FMQJOSFPTSFVBY-NRFANRHFSA-N 0 0 321.511 5.028 20 0 DKADRN CCC(CC)(CC)[S@](=O)Cc1nc(-c2ccccc2)cs1 ZINC000435430766 338240011 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/nfs/dbraw/zinc/24/57/29/338245729.db2.gz XJBDJLYATPAJDZ-UHFFFAOYSA-N 0 0 320.748 5.092 20 0 DKADRN O=C(Nc1ccccc1)N1CCCC[C@H]1c1cccc(Cl)c1 ZINC000435703891 338245780 /nfs/dbraw/zinc/24/57/80/338245780.db2.gz HZIRJDHWPURDMY-KRWDZBQOSA-N 0 0 314.816 5.099 20 0 DKADRN O=C(Nc1ccccc1)N1CCCC[C@@H]1c1cccc(Cl)c1 ZINC000435703892 338245848 /nfs/dbraw/zinc/24/58/48/338245848.db2.gz HZIRJDHWPURDMY-QGZVFWFLSA-N 0 0 314.816 5.099 20 0 DKADRN CC(C)c1occc1C(=O)Nc1cccc(Nc2ccccc2)c1 ZINC000435706798 338245917 /nfs/dbraw/zinc/24/59/17/338245917.db2.gz UENPIRRLFNXXJA-UHFFFAOYSA-N 0 0 320.392 5.399 20 0 DKADRN Cc1cccc(C(C)C)c1NC(=O)c1cn(C)c2ccc(F)cc12 ZINC000435751993 338247973 /nfs/dbraw/zinc/24/79/73/338247973.db2.gz IRNVCNDWTSJBDP-UHFFFAOYSA-N 0 0 324.399 5.002 20 0 DKADRN Cc1cc(COc2ccccc2-c2nccs2)c(C)s1 ZINC000435786597 338249244 /nfs/dbraw/zinc/24/92/44/338249244.db2.gz IUJRWNMGNBAWRJ-UHFFFAOYSA-N 0 0 301.436 5.067 20 0 DKADRN Cc1oc(-c2ccccc2)c(C(=O)Nc2cccc(C)c2C)c1C ZINC000435813379 338250176 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338251517 /nfs/dbraw/zinc/25/15/17/338251517.db2.gz PGWXMZNFKHPZPW-LBPRGKRZSA-N 0 0 303.837 5.133 20 0 DKADRN Cc1csc(CSCc2nc(C3CCCCC3)cs2)n1 ZINC000435881784 338251591 /nfs/dbraw/zinc/25/15/91/338251591.db2.gz COIQXWMWPCGIRN-UHFFFAOYSA-N 0 0 324.540 5.389 20 0 DKADRN Cc1nnc(CSCc2ccc(-c3ccsc3)cc2)s1 ZINC000435881877 338251655 /nfs/dbraw/zinc/25/16/55/338251655.db2.gz QVBXFKMGBWBBPM-UHFFFAOYSA-N 0 0 318.492 5.008 20 0 DKADRN Cc1nc(CSCc2nc(C3CCCCC3)cs2)cs1 ZINC000435882802 338251579 /nfs/dbraw/zinc/25/15/79/338251579.db2.gz GOHPOTIZWBWLHI-UHFFFAOYSA-N 0 0 324.540 5.389 20 0 DKADRN CCCCc1nc(CNc2cccc(C(C)(F)F)c2)cs1 ZINC000435883243 338251642 /nfs/dbraw/zinc/25/16/42/338251642.db2.gz JQRILACHZDCUMG-UHFFFAOYSA-N 0 0 310.413 5.210 20 0 DKADRN Cc1cnc([C@@H](C)SCc2nc(C3CCCCC3)cs2)o1 ZINC000435883264 338251619 /nfs/dbraw/zinc/25/16/19/338251619.db2.gz JYWQLOBSIQULMY-GFCCVEGCSA-N 0 0 322.499 5.482 20 0 DKADRN Cc1cnc([C@H](C)SCc2nc(C3CCCCC3)cs2)o1 ZINC000435883265 338251626 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338271467 /nfs/dbraw/zinc/27/14/67/338271467.db2.gz OFODRTQUBQKYPK-UHFFFAOYSA-N 0 0 304.315 5.031 20 0 DKADRN CC(F)(F)c1cccc(NCc2cccc(OC(F)F)c2)c1 ZINC000436412097 338271621 /nfs/dbraw/zinc/27/16/21/338271621.db2.gz MRNTVLZTSJAFJK-UHFFFAOYSA-N 0 0 313.294 5.012 20 0 DKADRN CC(F)(F)c1cccc(NCc2cccc(-c3ccncc3)c2)c1 ZINC000436413265 338271734 /nfs/dbraw/zinc/27/17/34/338271734.db2.gz SYMPDQYIXNZQHN-UHFFFAOYSA-N 0 0 324.374 5.472 20 0 DKADRN Cc1cc(CNc2cccc(C(C)(F)F)c2)cc2cccnc12 ZINC000436415187 338271829 /nfs/dbraw/zinc/27/18/29/338271829.db2.gz WVGDATZWWKTPNK-UHFFFAOYSA-N 0 0 312.363 5.267 20 0 DKADRN CC(F)(F)c1cccc(NCc2cnc(C3CCC3)s2)c1 ZINC000436415298 338271880 /nfs/dbraw/zinc/27/18/80/338271880.db2.gz XEOXKGLGHHEPOY-UHFFFAOYSA-N 0 0 308.397 5.134 20 0 DKADRN CC(F)(F)c1cccc(NCc2cccc(-c3cccnc3)c2)c1 ZINC000436417592 338271951 /nfs/dbraw/zinc/27/19/51/338271951.db2.gz WNVVPOCMAQKXHY-UHFFFAOYSA-N 0 0 324.374 5.472 20 0 DKADRN CC(F)(F)c1cccc(NCc2cnc(C3CCCC3)s2)c1 ZINC000436419072 338271894 /nfs/dbraw/zinc/27/18/94/338271894.db2.gz XLRAQGCSVYSZKU-UHFFFAOYSA-N 0 0 322.424 5.525 20 0 DKADRN CC(F)(F)c1cccc(NCc2ccc(F)c3cccnc23)c1 ZINC000436419570 338272094 /nfs/dbraw/zinc/27/20/94/338272094.db2.gz ZRYLBTKJKQOGER-UHFFFAOYSA-N 0 0 316.326 5.098 20 0 DKADRN CCc1cncc(C(=O)Nc2c(C(C)C)cccc2C(C)C)c1 ZINC000436421751 338272052 /nfs/dbraw/zinc/27/20/52/338272052.db2.gz REEYPBAIEPYMDB-UHFFFAOYSA-N 0 0 310.441 5.143 20 0 DKADRN Cc1cc(C)c(NC(=O)Cc2cccc(Cl)c2Cl)c(C)c1 ZINC000436423876 338272141 /nfs/dbraw/zinc/27/21/41/338272141.db2.gz BIVASYPDOAMISA-UHFFFAOYSA-N 0 0 322.235 5.100 20 0 DKADRN CCc1cccc(CC)c1NC(=O)c1ccc(C)c(Cl)c1F ZINC000436425235 338272185 /nfs/dbraw/zinc/27/21/85/338272185.db2.gz OJJHXVZWICUMPA-UHFFFAOYSA-N 0 0 319.807 5.165 20 0 DKADRN CCc1cccc(C)c1NC(=O)Cc1cccc(Cl)c1Cl ZINC000436435715 338272464 /nfs/dbraw/zinc/27/24/64/338272464.db2.gz YISIDNIFLCRIFA-UHFFFAOYSA-N 0 0 322.235 5.045 20 0 DKADRN CC(C)c1ccc(C(=O)N(C)c2c(Cl)cccc2Cl)cc1 ZINC000436440337 338272393 /nfs/dbraw/zinc/27/23/93/338272393.db2.gz ASDFHQHELYDJEL-UHFFFAOYSA-N 0 0 322.235 5.393 20 0 DKADRN C[C@H](CC(=O)N(C)c1c(Cl)cccc1Cl)c1ccccc1 ZINC000436444528 338272578 /nfs/dbraw/zinc/27/25/78/338272578.db2.gz PBWNEUBBYDSNQJ-GFCCVEGCSA-N 0 0 322.235 5.150 20 0 DKADRN C[C@@H](CC(=O)N(C)c1c(Cl)cccc1Cl)c1ccccc1 ZINC000436444529 338272509 /nfs/dbraw/zinc/27/25/09/338272509.db2.gz PBWNEUBBYDSNQJ-LBPRGKRZSA-N 0 0 322.235 5.150 20 0 DKADRN O=C(C[C@@H]1C=CCCC1)N1CCCC[C@@H]1c1cccc(Cl)c1 ZINC000436472686 338273360 /nfs/dbraw/zinc/27/33/60/338273360.db2.gz ZSWSLUNVYKEFQD-CRAIPNDOSA-N 0 0 317.860 5.140 20 0 DKADRN O=C(C[C@H]1C=CCCC1)N1CCCC[C@@H]1c1cccc(Cl)c1 ZINC000436472687 338273395 /nfs/dbraw/zinc/27/33/95/338273395.db2.gz ZSWSLUNVYKEFQD-MAUKXSAKSA-N 0 0 317.860 5.140 20 0 DKADRN O=C(C[C@@H]1C=CCCC1)N1CCCC[C@H]1c1cccc(Cl)c1 ZINC000436472688 338273370 /nfs/dbraw/zinc/27/33/70/338273370.db2.gz ZSWSLUNVYKEFQD-QAPCUYQASA-N 0 0 317.860 5.140 20 0 DKADRN O=C(C[C@H]1C=CCCC1)N1CCCC[C@H]1c1cccc(Cl)c1 ZINC000436472689 338273422 /nfs/dbraw/zinc/27/34/22/338273422.db2.gz ZSWSLUNVYKEFQD-YJBOKZPZSA-N 0 0 317.860 5.140 20 0 DKADRN CCCCn1c(C)c(C)nc1SCc1oc(C(C)C)nc1C ZINC000436477710 338273670 /nfs/dbraw/zinc/27/36/70/338273670.db2.gz ZDKREIVBYQLYRU-UHFFFAOYSA-N 0 0 321.490 5.012 20 0 DKADRN Cc1nc(C(C)C)oc1CSc1cc(C)c2ccccc2n1 ZINC000436477778 338273736 /nfs/dbraw/zinc/27/37/36/338273736.db2.gz ZPMGOUFJEIKYFI-UHFFFAOYSA-N 0 0 312.438 5.255 20 0 DKADRN Cc1ccc(Cl)c(NC(=O)c2cc(C(C)C)c(O)cc2C)c1 ZINC000436627793 338280565 /nfs/dbraw/zinc/28/05/65/338280565.db2.gz YFYHDJYUUOGQCZ-UHFFFAOYSA-N 0 0 317.816 5.038 20 0 DKADRN CC(C)c1ccc(C(=O)Nc2csnc2-c2ccccc2)cc1 ZINC000436722901 338284114 /nfs/dbraw/zinc/28/41/14/338284114.db2.gz MXDCXCIUWKUASP-UHFFFAOYSA-N 0 0 322.433 5.186 20 0 DKADRN CCCn1c(C)cc(-c2csc(-c3ccccc3O)n2)c1C ZINC000436749792 338285344 /nfs/dbraw/zinc/28/53/44/338285344.db2.gz UHMNKOSZDUHWHT-UHFFFAOYSA-N 0 0 312.438 5.011 20 0 DKADRN CCOc1cc(/C=C\c2nc(-c3ccccc3)cs2)ccc1O ZINC000436795963 338287713 /nfs/dbraw/zinc/28/77/13/338287713.db2.gz HIHZERKGKPPMMB-LUAWRHEFSA-N 0 0 323.417 5.085 20 0 DKADRN COc1cc(/C=C\c2nc(-c3ccc(C)cc3)cs2)ccc1O ZINC000436799177 338287945 /nfs/dbraw/zinc/28/79/45/338287945.db2.gz XLQKQGQVRVKONQ-POHAHGRESA-N 0 0 323.417 5.003 20 0 DKADRN Cc1ccc(NC(=O)c2cc(C(C)C)c(O)cc2C)c(Cl)c1 ZINC000436812673 338288278 /nfs/dbraw/zinc/28/82/78/338288278.db2.gz FXFDZMAIMSLUAC-UHFFFAOYSA-N 0 0 317.816 5.038 20 0 DKADRN CCCc1ccccc1NC(=O)c1cc(C(C)C)c(O)cc1C ZINC000436842663 338289725 /nfs/dbraw/zinc/28/97/25/338289725.db2.gz DWABTKXDRYDOQU-UHFFFAOYSA-N 0 0 311.425 5.029 20 0 DKADRN Cc1cc(O)c(C(C)C)cc1C(=O)Nc1ccccc1C(C)C ZINC000436842732 338289729 /nfs/dbraw/zinc/28/97/29/338289729.db2.gz WQFFVLMNGRJYNE-UHFFFAOYSA-N 0 0 311.425 5.200 20 0 DKADRN Cc1cc(C)c(NC(=O)c2cc(C(C)C)c(O)cc2C)c(C)c1 ZINC000436852362 338289860 /nfs/dbraw/zinc/28/98/60/338289860.db2.gz IFPLJGFPNKHAIU-UHFFFAOYSA-N 0 0 311.425 5.002 20 0 DKADRN Cc1cc(O)c(C(C)C)cc1C(=O)Nc1cccc(C(F)F)c1 ZINC000436865175 338290495 /nfs/dbraw/zinc/29/04/95/338290495.db2.gz QOUCOSQLXDVQAE-UHFFFAOYSA-N 0 0 319.351 5.014 20 0 DKADRN Cc1cc(C(=O)Nc2c(C(C)C)cccc2C(C)C)ccc1O ZINC000436927521 338293902 /nfs/dbraw/zinc/29/39/02/338293902.db2.gz RSTKJSYVRWFVAC-UHFFFAOYSA-N 0 0 311.425 5.200 20 0 DKADRN CCC(C)(C)OCc1cccc(NC(=O)C2=C(C)CCC2)c1C ZINC000437022953 338298047 /nfs/dbraw/zinc/29/80/47/338298047.db2.gz VDIGJYXTCZBLJB-UHFFFAOYSA-N 0 0 315.457 5.139 20 0 DKADRN C[C@@H](Nc1cnn([C@H](C)C2CC2)c1)c1cc2ccccc2s1 ZINC000437023808 338298045 /nfs/dbraw/zinc/29/80/45/338298045.db2.gz UMXCWCNZURHZRR-CHWSQXEVSA-N 0 0 311.454 5.242 20 0 DKADRN C[C@@H](Nc1cnn([C@@H](C)C2CC2)c1)c1cc2ccccc2s1 ZINC000437023817 338298059 /nfs/dbraw/zinc/29/80/59/338298059.db2.gz UMXCWCNZURHZRR-OLZOCXBDSA-N 0 0 311.454 5.242 20 0 DKADRN C[C@H](C1CC1)n1cc(N[C@@H](C)c2cc3ccccc3s2)cn1 ZINC000437023821 338298125 /nfs/dbraw/zinc/29/81/25/338298125.db2.gz UMXCWCNZURHZRR-QWHCGFSZSA-N 0 0 311.454 5.242 20 0 DKADRN C[C@H](Nc1cnn([C@@H](C)C2CC2)c1)c1cc2ccccc2s1 ZINC000437023823 338298091 /nfs/dbraw/zinc/29/80/91/338298091.db2.gz UMXCWCNZURHZRR-STQMWFEESA-N 0 0 311.454 5.242 20 0 DKADRN CCCN(C(=O)c1ccc(Cl)c(C(F)(F)F)c1)C(C)(C)C ZINC000437024858 338298181 /nfs/dbraw/zinc/29/81/81/338298181.db2.gz ZWJBXYSIJRKPOG-UHFFFAOYSA-N 0 0 321.770 5.010 20 0 DKADRN CC1=C(C(=O)Nc2cccc(COc3ccccc3)c2C)CCC1 ZINC000437030299 338298440 /nfs/dbraw/zinc/29/84/40/338298440.db2.gz DLAGNCNYMZAILR-UHFFFAOYSA-N 0 0 321.420 5.013 20 0 DKADRN COc1cc(N[C@@H](C)c2ccc(-c3ccncc3)cc2)ccc1F ZINC000437031216 338298494 /nfs/dbraw/zinc/29/84/94/338298494.db2.gz HSMANELAYRWCPD-AWEZNQCLSA-N 0 0 322.383 5.069 20 0 DKADRN COc1cc(N[C@H](C)c2ccc(-c3ccncc3)cc2)ccc1F ZINC000437031217 338298498 /nfs/dbraw/zinc/29/84/98/338298498.db2.gz HSMANELAYRWCPD-CQSZACIVSA-N 0 0 322.383 5.069 20 0 DKADRN CC(F)(F)c1cccc(NC2CCC(C(F)(F)F)CC2)c1 ZINC000437031910 338298598 /nfs/dbraw/zinc/29/85/98/338298598.db2.gz JQSXNFGZHUHBAB-UHFFFAOYSA-N 0 0 307.306 5.331 20 0 DKADRN COc1cc(N[C@@H](C)c2cccc(-c3ccncc3)c2)ccc1F ZINC000437049497 338298902 /nfs/dbraw/zinc/29/89/02/338298902.db2.gz CMVPUGGWMKGMTK-AWEZNQCLSA-N 0 0 322.383 5.069 20 0 DKADRN COc1cc(N[C@H](C)c2cccc(-c3ccncc3)c2)ccc1F ZINC000437049499 338298942 /nfs/dbraw/zinc/29/89/42/338298942.db2.gz CMVPUGGWMKGMTK-CQSZACIVSA-N 0 0 322.383 5.069 20 0 DKADRN CC(F)(F)c1cccc(N[C@H]2CCC[C@H](C(F)(F)F)C2)c1 ZINC000437059001 338299061 /nfs/dbraw/zinc/29/90/61/338299061.db2.gz PVSBSOICQOSEFJ-AAEUAGOBSA-N 0 0 307.306 5.331 20 0 DKADRN CC(F)(F)c1cccc(N[C@@H]2CCC[C@@H](C(F)(F)F)C2)c1 ZINC000437059002 338298995 /nfs/dbraw/zinc/29/89/95/338298995.db2.gz PVSBSOICQOSEFJ-DGCLKSJQSA-N 0 0 307.306 5.331 20 0 DKADRN CC(F)(F)c1cccc(N[C@@H]2CCC[C@H](C(F)(F)F)C2)c1 ZINC000437059003 338299049 /nfs/dbraw/zinc/29/90/49/338299049.db2.gz PVSBSOICQOSEFJ-WCQYABFASA-N 0 0 307.306 5.331 20 0 DKADRN CC(F)(F)c1cccc(N[C@H]2CCC[C@@H](C(F)(F)F)C2)c1 ZINC000437059004 338299046 /nfs/dbraw/zinc/29/90/46/338299046.db2.gz PVSBSOICQOSEFJ-YPMHNXCESA-N 0 0 307.306 5.331 20 0 DKADRN CC[C@H](C(=O)Nc1ccccc1C)c1cccc(C(F)(F)F)c1 ZINC000437151545 338302762 /nfs/dbraw/zinc/30/27/62/338302762.db2.gz QQOLIOJQLXQVRC-HNNXBMFYSA-N 0 0 321.342 5.146 20 0 DKADRN CC[C@@H](C(=O)Nc1ccccc1C)c1cccc(C(F)(F)F)c1 ZINC000437151546 338302719 /nfs/dbraw/zinc/30/27/19/338302719.db2.gz QQOLIOJQLXQVRC-OAHLLOKOSA-N 0 0 321.342 5.146 20 0 DKADRN CCSc1ccc(Cl)cc1C(=O)Nc1ccc(C)cc1C ZINC000437152218 338302810 /nfs/dbraw/zinc/30/28/10/338302810.db2.gz SMCHYIGWSJIVNZ-UHFFFAOYSA-N 0 0 319.857 5.321 20 0 DKADRN CSc1c(F)cccc1C(=O)Nc1ccc(C2CCC2)cc1 ZINC000437162207 338302934 /nfs/dbraw/zinc/30/29/34/338302934.db2.gz WYYLZYMOYSVGDY-UHFFFAOYSA-N 0 0 315.413 5.067 20 0 DKADRN CCCN(C(=O)C1=C(C)CCC1)[C@@H](C)c1cc2ccccc2o1 ZINC000437251097 338304764 /nfs/dbraw/zinc/30/47/64/338304764.db2.gz MBWVPEOQGYNZPN-HNNXBMFYSA-N 0 0 311.425 5.233 20 0 DKADRN CCCN(C(=O)C1=C(C)CCC1)[C@H](C)c1cc2ccccc2o1 ZINC000437251098 338304769 /nfs/dbraw/zinc/30/47/69/338304769.db2.gz MBWVPEOQGYNZPN-OAHLLOKOSA-N 0 0 311.425 5.233 20 0 DKADRN CC[C@@H](SCCOCC(F)(F)F)c1ccc(Cl)cc1 ZINC000437251393 338304796 /nfs/dbraw/zinc/30/47/96/338304796.db2.gz BCQAQYWLTVWPEY-GFCCVEGCSA-N 0 0 312.784 5.103 20 0 DKADRN CC[C@H](SCCOCC(F)(F)F)c1ccc(Cl)cc1 ZINC000437251394 338304750 /nfs/dbraw/zinc/30/47/50/338304750.db2.gz BCQAQYWLTVWPEY-LBPRGKRZSA-N 0 0 312.784 5.103 20 0 DKADRN CC[C@@H](SCCC(=O)Nc1ccccc1C)c1ccccc1 ZINC000437253681 338304755 /nfs/dbraw/zinc/30/47/55/338304755.db2.gz IXVBQTXZBVHJPX-GOSISDBHSA-N 0 0 313.466 5.208 20 0 DKADRN CC[C@H](SCCC(=O)Nc1ccccc1C)c1ccccc1 ZINC000437253683 338304836 /nfs/dbraw/zinc/30/48/36/338304836.db2.gz IXVBQTXZBVHJPX-SFHVURJKSA-N 0 0 313.466 5.208 20 0 DKADRN CC[C@@H](S[C@@H](C)c1nc(C(C)(C)C)no1)c1ccccc1 ZINC000437254311 338304840 /nfs/dbraw/zinc/30/48/40/338304840.db2.gz CEWWIRPPEXAFDN-GXTWGEPZSA-N 0 0 304.459 5.313 20 0 DKADRN CC[C@H](S[C@@H](C)c1nc(C(C)(C)C)no1)c1ccccc1 ZINC000437254314 338304846 /nfs/dbraw/zinc/30/48/46/338304846.db2.gz CEWWIRPPEXAFDN-JSGCOSHPSA-N 0 0 304.459 5.313 20 0 DKADRN CC[C@H](S[C@H](C)c1nc(C(C)(C)C)no1)c1ccccc1 ZINC000437254317 338304806 /nfs/dbraw/zinc/30/48/06/338304806.db2.gz CEWWIRPPEXAFDN-OCCSQVGLSA-N 0 0 304.459 5.313 20 0 DKADRN CC[C@H](SCc1nnc(-c2ccc(C)cc2)o1)c1ccccc1 ZINC000437254319 338304752 /nfs/dbraw/zinc/30/47/52/338304752.db2.gz JYRYEJKGEZCQFS-KRWDZBQOSA-N 0 0 324.449 5.430 20 0 DKADRN CC[C@@H](S[C@H](C)c1nc(C(C)(C)C)no1)c1ccccc1 ZINC000437254321 338304812 /nfs/dbraw/zinc/30/48/12/338304812.db2.gz CEWWIRPPEXAFDN-TZMCWYRMSA-N 0 0 304.459 5.313 20 0 DKADRN CC[C@@H](SCc1nnc(-c2ccc(C)cc2)o1)c1ccccc1 ZINC000437254325 338304832 /nfs/dbraw/zinc/30/48/32/338304832.db2.gz JYRYEJKGEZCQFS-QGZVFWFLSA-N 0 0 324.449 5.430 20 0 DKADRN Cc1ccc(-c2nnc(CSCc3cc(C)cc(C)c3)o2)cc1 ZINC000437257248 338304922 /nfs/dbraw/zinc/30/49/22/338304922.db2.gz KFQFTAJKXCACLX-UHFFFAOYSA-N 0 0 324.449 5.095 20 0 DKADRN Cc1nc(C)c(CSCc2ccc(C(F)(F)F)cc2)s1 ZINC000437258955 338305035 /nfs/dbraw/zinc/30/50/35/338305035.db2.gz MPKUEWGZMNBTFS-UHFFFAOYSA-N 0 0 317.401 5.212 20 0 DKADRN C[C@@H](SCCc1ccc2ccccc2c1)c1nc(C2CC2)no1 ZINC000437260814 338304987 /nfs/dbraw/zinc/30/49/87/338304987.db2.gz RVBBZLIUGJOPLN-CYBMUJFWSA-N 0 0 324.449 5.137 20 0 DKADRN C[C@H](SCCc1ccc2ccccc2c1)c1nc(C2CC2)no1 ZINC000437260823 338305016 /nfs/dbraw/zinc/30/50/16/338305016.db2.gz RVBBZLIUGJOPLN-ZDUSSCGKSA-N 0 0 324.449 5.137 20 0 DKADRN Cc1nc(C)c(CSCc2cccc(C(F)(F)F)c2)s1 ZINC000437261675 338305063 /nfs/dbraw/zinc/30/50/63/338305063.db2.gz HRBYFNBZJXSTKN-UHFFFAOYSA-N 0 0 317.401 5.212 20 0 DKADRN COCc1nc(CSCc2ccc(C(C)(C)C)cc2)cs1 ZINC000437262558 338305154 /nfs/dbraw/zinc/30/51/54/338305154.db2.gz KVAJVPMFBRBTDZ-UHFFFAOYSA-N 0 0 321.511 5.020 20 0 DKADRN Cc1cccc([C@@H](C)SCc2nc(-c3cccs3)no2)c1 ZINC000437263016 338305140 /nfs/dbraw/zinc/30/51/40/338305140.db2.gz POPRGHIVKIYIPZ-GFCCVEGCSA-N 0 0 316.451 5.101 20 0 DKADRN Cc1cccc([C@H](C)SCc2nc(-c3cccs3)no2)c1 ZINC000437263017 338305091 /nfs/dbraw/zinc/30/50/91/338305091.db2.gz POPRGHIVKIYIPZ-LBPRGKRZSA-N 0 0 316.451 5.101 20 0 DKADRN Cc1cccc([C@@H](C)S[C@H](C)c2nc(C(C)(C)C)no2)c1 ZINC000437264560 338305254 /nfs/dbraw/zinc/30/52/54/338305254.db2.gz YVFQMKHWWFSIFD-CHWSQXEVSA-N 0 0 304.459 5.231 20 0 DKADRN Cc1cccc([C@@H](C)S[C@@H](C)c2nc(C(C)(C)C)no2)c1 ZINC000437264561 338305259 /nfs/dbraw/zinc/30/52/59/338305259.db2.gz YVFQMKHWWFSIFD-OLZOCXBDSA-N 0 0 304.459 5.231 20 0 DKADRN Cc1cccc([C@H](C)S[C@H](C)c2nc(C(C)(C)C)no2)c1 ZINC000437264562 338305268 /nfs/dbraw/zinc/30/52/68/338305268.db2.gz YVFQMKHWWFSIFD-QWHCGFSZSA-N 0 0 304.459 5.231 20 0 DKADRN Cc1cccc([C@H](C)S[C@@H](C)c2nc(C(C)(C)C)no2)c1 ZINC000437264563 334039735 /nfs/dbraw/zinc/03/97/35/334039735.db2.gz YVFQMKHWWFSIFD-STQMWFEESA-N 0 0 304.459 5.231 20 0 DKADRN C[C@@H](SCCOCC(F)(F)F)c1ccc2ccccc2c1 ZINC000437265931 334039592 /nfs/dbraw/zinc/03/95/92/334039592.db2.gz DDOKFHXWPRWYJY-GFCCVEGCSA-N 0 0 314.372 5.213 20 0 DKADRN C[C@H](SCCOCC(F)(F)F)c1ccc2ccccc2c1 ZINC000437265939 334039605 /nfs/dbraw/zinc/03/96/05/334039605.db2.gz DDOKFHXWPRWYJY-LBPRGKRZSA-N 0 0 314.372 5.213 20 0 DKADRN Cc1cccc(C)c1NC(=O)CCCSCCC1CCCC1 ZINC000437267134 338305281 /nfs/dbraw/zinc/30/52/81/338305281.db2.gz IYJMMDUUTPYYLS-UHFFFAOYSA-N 0 0 319.514 5.336 20 0 DKADRN Cc1sc(NC(=O)CS[C@@H](C)c2ccccc2)c(C)c1C ZINC000437268306 338305432 /nfs/dbraw/zinc/30/54/32/338305432.db2.gz MXNVCHKVWFUVFA-AWEZNQCLSA-N 0 0 319.495 5.106 20 0 DKADRN Cc1sc(NC(=O)CS[C@H](C)c2ccccc2)c(C)c1C ZINC000437268309 338305444 /nfs/dbraw/zinc/30/54/44/338305444.db2.gz MXNVCHKVWFUVFA-CQSZACIVSA-N 0 0 319.495 5.106 20 0 DKADRN C[C@@H](SCc1ncc(-c2ccccc2F)o1)c1ccccc1 ZINC000437268422 338305441 /nfs/dbraw/zinc/30/54/41/338305441.db2.gz NKIIZGXTYFMCCM-CYBMUJFWSA-N 0 0 313.397 5.475 20 0 DKADRN C[C@H](SCc1ncc(-c2ccccc2F)o1)c1ccccc1 ZINC000437268423 338305445 /nfs/dbraw/zinc/30/54/45/338305445.db2.gz NKIIZGXTYFMCCM-ZDUSSCGKSA-N 0 0 313.397 5.475 20 0 DKADRN Cc1cccc([C@H](C)SCc2cc3ccccc3[nH]c2=O)c1 ZINC000437269325 338305457 /nfs/dbraw/zinc/30/54/57/338305457.db2.gz ASAHCEZSJGMCAH-AWEZNQCLSA-N 0 0 309.434 5.243 20 0 DKADRN Cc1cccc([C@@H](C)SCc2cc3ccccc3[nH]c2=O)c1 ZINC000437269326 338305382 /nfs/dbraw/zinc/30/53/82/338305382.db2.gz ASAHCEZSJGMCAH-CQSZACIVSA-N 0 0 309.434 5.243 20 0 DKADRN CC1=C(C(=O)N(C)[C@H](C)c2ccc(Cl)c(Cl)c2)CCC1 ZINC000437269943 338305388 /nfs/dbraw/zinc/30/53/88/338305388.db2.gz WGEHVQRKQFANCS-LLVKDONJSA-N 0 0 312.240 5.013 20 0 DKADRN CC1=C(C(=O)N(C)[C@@H](C)c2ccc(Cl)c(Cl)c2)CCC1 ZINC000437269945 338305458 /nfs/dbraw/zinc/30/54/58/338305458.db2.gz WGEHVQRKQFANCS-NSHDSACASA-N 0 0 312.240 5.013 20 0 DKADRN C[C@@H](S[C@@H](C)c1nc(Cc2ccccc2)no1)c1ccccc1 ZINC000437270342 338305475 /nfs/dbraw/zinc/30/54/75/338305475.db2.gz DLEXNCSYOHFQRD-CABCVRRESA-N 0 0 324.449 5.216 20 0 DKADRN C[C@H](S[C@@H](C)c1ccccc1)c1nc(Cc2ccccc2)no1 ZINC000437270343 338305484 /nfs/dbraw/zinc/30/54/84/338305484.db2.gz DLEXNCSYOHFQRD-GJZGRUSLSA-N 0 0 324.449 5.216 20 0 DKADRN C[C@@H](S[C@H](C)c1ccccc1)c1nc(Cc2ccccc2)no1 ZINC000437270344 338305567 /nfs/dbraw/zinc/30/55/67/338305567.db2.gz DLEXNCSYOHFQRD-HUUCEWRRSA-N 0 0 324.449 5.216 20 0 DKADRN C[C@@H](S[C@@H](C)c1ccccc1)c1nc(Cc2ccccc2)no1 ZINC000437270345 338305546 /nfs/dbraw/zinc/30/55/46/338305546.db2.gz DLEXNCSYOHFQRD-LSDHHAIUSA-N 0 0 324.449 5.216 20 0 DKADRN Cc1ccc(-c2nnc(CS[C@@H](C)c3ccccc3)o2)cc1 ZINC000437270416 338305545 /nfs/dbraw/zinc/30/55/45/338305545.db2.gz TXTNEUGDBPRSLT-AWEZNQCLSA-N 0 0 310.422 5.039 20 0 DKADRN Cc1ccc(-c2nnc(CS[C@H](C)c3ccccc3)o2)cc1 ZINC000437270417 338305477 /nfs/dbraw/zinc/30/54/77/338305477.db2.gz TXTNEUGDBPRSLT-CQSZACIVSA-N 0 0 310.422 5.039 20 0 DKADRN CCN(C(=O)C1=C(C)CCC1)C(c1ccccc1)c1ccccc1 ZINC000437270917 334040287 /nfs/dbraw/zinc/04/02/87/334040287.db2.gz UZXSDHIYZDGYHH-UHFFFAOYSA-N 0 0 319.448 5.125 20 0 DKADRN CCC(C)(C)CCSCCCC(=O)Nc1c(C)cccc1C ZINC000437271047 338305544 /nfs/dbraw/zinc/30/55/44/338305544.db2.gz YGUBPBASFISRNX-UHFFFAOYSA-N 0 0 321.530 5.582 20 0 DKADRN CCOCCCSCc1csc(-c2ccc(CC)cc2)n1 ZINC000437271887 338305518 /nfs/dbraw/zinc/30/55/18/338305518.db2.gz VPCONRKKDVNDJK-UHFFFAOYSA-N 0 0 321.511 5.032 20 0 DKADRN Fc1cccc(CSCc2ncc(-c3ccccc3F)o2)c1 ZINC000437272650 338305635 /nfs/dbraw/zinc/30/56/35/338305635.db2.gz YJSHTJOTZCQVTN-UHFFFAOYSA-N 0 0 317.360 5.053 20 0 DKADRN c1sc(-c2ccccn2)nc1CSCCC1CCCC1 ZINC000437272797 338305611 /nfs/dbraw/zinc/30/56/11/338305611.db2.gz JTEDDGPCYFMUQB-UHFFFAOYSA-N 0 0 304.484 5.019 20 0 DKADRN Fc1ccccc1CSCc1ncc(-c2ccccc2F)o1 ZINC000437272812 338305676 /nfs/dbraw/zinc/30/56/76/338305676.db2.gz FAMYVGMPALXGDY-UHFFFAOYSA-N 0 0 317.360 5.053 20 0 DKADRN COC[C@@H](C)SCc1csc(-c2ccc(C(C)C)cc2)n1 ZINC000437274063 338305639 /nfs/dbraw/zinc/30/56/39/338305639.db2.gz MKQATNZVVAQDER-CYBMUJFWSA-N 0 0 321.511 5.202 20 0 DKADRN COC[C@H](C)SCc1csc(-c2ccc(C(C)C)cc2)n1 ZINC000437274065 338305588 /nfs/dbraw/zinc/30/55/88/338305588.db2.gz MKQATNZVVAQDER-ZDUSSCGKSA-N 0 0 321.511 5.202 20 0 DKADRN CCCCc1noc([C@H](C)S[C@@H](C)c2cccc(C)c2)n1 ZINC000437274187 338305674 /nfs/dbraw/zinc/30/56/74/338305674.db2.gz GADANEYYJFSZAR-KBPBESRZSA-N 0 0 304.459 5.276 20 0 DKADRN CCCCc1noc([C@H](C)S[C@H](C)c2cccc(C)c2)n1 ZINC000437274188 338305663 /nfs/dbraw/zinc/30/56/63/338305663.db2.gz GADANEYYJFSZAR-KGLIPLIRSA-N 0 0 304.459 5.276 20 0 DKADRN CCCCc1noc([C@@H](C)S[C@@H](C)c2cccc(C)c2)n1 ZINC000437274189 338305597 /nfs/dbraw/zinc/30/55/97/338305597.db2.gz GADANEYYJFSZAR-UONOGXRCSA-N 0 0 304.459 5.276 20 0 DKADRN CCCCc1noc([C@@H](C)S[C@H](C)c2cccc(C)c2)n1 ZINC000437274190 338305612 /nfs/dbraw/zinc/30/56/12/338305612.db2.gz GADANEYYJFSZAR-ZIAGYGMSSA-N 0 0 304.459 5.276 20 0 DKADRN Cc1nc(C)c(CSCc2ccccc2C(F)(F)F)s1 ZINC000437274916 338305724 /nfs/dbraw/zinc/30/57/24/338305724.db2.gz OOOPNFKXLWIGEO-UHFFFAOYSA-N 0 0 317.401 5.212 20 0 DKADRN COC[C@@H](C)SCc1ccc(Oc2ccccc2F)c(F)c1 ZINC000437275141 338305677 /nfs/dbraw/zinc/30/56/77/338305677.db2.gz IUPLDWONZBKJDP-GFCCVEGCSA-N 0 0 324.392 5.025 20 0 DKADRN COC[C@H](C)SCc1ccc(Oc2ccccc2F)c(F)c1 ZINC000437275143 338305691 /nfs/dbraw/zinc/30/56/91/338305691.db2.gz IUPLDWONZBKJDP-LBPRGKRZSA-N 0 0 324.392 5.025 20 0 DKADRN Fc1ccc(CSCc2ncc(-c3ccccc3F)o2)cc1 ZINC000437276983 338305806 /nfs/dbraw/zinc/30/58/06/338305806.db2.gz OXERXUXJUQWLLK-UHFFFAOYSA-N 0 0 317.360 5.053 20 0 DKADRN Cc1cccc([C@@H](C)SCc2noc(-c3cccs3)n2)c1 ZINC000437278882 338305869 /nfs/dbraw/zinc/30/58/69/338305869.db2.gz VNDKPKGDSYLBNE-GFCCVEGCSA-N 0 0 316.451 5.101 20 0 DKADRN Cc1cccc([C@H](C)SCc2noc(-c3cccs3)n2)c1 ZINC000437278883 338305842 /nfs/dbraw/zinc/30/58/42/338305842.db2.gz VNDKPKGDSYLBNE-LBPRGKRZSA-N 0 0 316.451 5.101 20 0 DKADRN CCO[C@@H](C)c1nc(CS[C@@H](C)c2cccc(C)c2)cs1 ZINC000437280203 338305911 /nfs/dbraw/zinc/30/59/11/338305911.db2.gz GHOOMQLMMHUCJP-KBPBESRZSA-N 0 0 321.511 5.543 20 0 DKADRN CCO[C@H](C)c1nc(CS[C@@H](C)c2cccc(C)c2)cs1 ZINC000437280205 338305960 /nfs/dbraw/zinc/30/59/60/338305960.db2.gz GHOOMQLMMHUCJP-KGLIPLIRSA-N 0 0 321.511 5.543 20 0 DKADRN CCO[C@@H](C)c1nc(CS[C@H](C)c2cccc(C)c2)cs1 ZINC000437280207 338305895 /nfs/dbraw/zinc/30/58/95/338305895.db2.gz GHOOMQLMMHUCJP-UONOGXRCSA-N 0 0 321.511 5.543 20 0 DKADRN CCO[C@H](C)c1nc(CS[C@H](C)c2cccc(C)c2)cs1 ZINC000437280209 338305976 /nfs/dbraw/zinc/30/59/76/338305976.db2.gz GHOOMQLMMHUCJP-ZIAGYGMSSA-N 0 0 321.511 5.543 20 0 DKADRN Cc1nc(CSCc2cc(Cl)ccc2Cl)cs1 ZINC000437280711 338305898 /nfs/dbraw/zinc/30/58/98/338305898.db2.gz LEYDEIRUNDXMBN-UHFFFAOYSA-N 0 0 304.267 5.192 20 0 DKADRN CC1=C(C(=O)Nc2c(F)cc(F)cc2-c2ccccc2)CCC1 ZINC000437280853 338305941 /nfs/dbraw/zinc/30/59/41/338305941.db2.gz NCZDPOSCVBGPAG-UHFFFAOYSA-N 0 0 313.347 5.071 20 0 DKADRN CCO[C@H](C)c1nc(CSCCC(C)(C)CC)cs1 ZINC000437281099 338306056 /nfs/dbraw/zinc/30/60/56/338306056.db2.gz PUUXZZGMEXUUTI-GFCCVEGCSA-N 0 0 301.521 5.300 20 0 DKADRN CCO[C@@H](C)c1nc(CSCCC(C)(C)CC)cs1 ZINC000437281100 338306027 /nfs/dbraw/zinc/30/60/27/338306027.db2.gz PUUXZZGMEXUUTI-LBPRGKRZSA-N 0 0 301.521 5.300 20 0 DKADRN CCSc1ccc(Cl)cc1C(=O)Nc1cc(C)ccc1F ZINC000437282983 338306019 /nfs/dbraw/zinc/30/60/19/338306019.db2.gz FGDBWKOTHMZOEQ-UHFFFAOYSA-N 0 0 323.820 5.152 20 0 DKADRN Cc1ncc(CSCc2cc(Cl)ccc2Cl)s1 ZINC000437283099 338306039 /nfs/dbraw/zinc/30/60/39/338306039.db2.gz GSSFAENVVFABBD-UHFFFAOYSA-N 0 0 304.267 5.192 20 0 DKADRN CCSc1ccc(Cl)cc1C(=O)Nc1ccc(C)cc1F ZINC000437284600 338306114 /nfs/dbraw/zinc/30/61/14/338306114.db2.gz LBCXNPKRFYAJDM-UHFFFAOYSA-N 0 0 323.820 5.152 20 0 DKADRN CCSc1ccc(Cl)cc1C(=O)Nc1cc(F)ccc1C ZINC000437284646 338306102 /nfs/dbraw/zinc/30/61/02/338306102.db2.gz JONRCHJQEORMQG-UHFFFAOYSA-N 0 0 323.820 5.152 20 0 DKADRN Cc1ccc(OCc2nc(CSCC3CCC3)cs2)cc1 ZINC000437285005 338306143 /nfs/dbraw/zinc/30/61/43/338306143.db2.gz CQKZPJIMYNUKOI-UHFFFAOYSA-N 0 0 319.495 5.064 20 0 DKADRN Cc1nc(C)c(CSCc2csc(C3CCCC3)n2)s1 ZINC000437286039 338306124 /nfs/dbraw/zinc/30/61/24/338306124.db2.gz NKTNNQIWGVWYLO-UHFFFAOYSA-N 0 0 324.540 5.307 20 0 DKADRN Cc1cccc([C@H](C)SCc2nc(-c3ccccc3)no2)c1 ZINC000437289352 338306268 /nfs/dbraw/zinc/30/62/68/338306268.db2.gz HSDWSMRALMVUDS-AWEZNQCLSA-N 0 0 310.422 5.039 20 0 DKADRN Cc1cccc([C@@H](C)SCc2nc(-c3ccccc3)no2)c1 ZINC000437289357 338306262 /nfs/dbraw/zinc/30/62/62/338306262.db2.gz HSDWSMRALMVUDS-CQSZACIVSA-N 0 0 310.422 5.039 20 0 DKADRN CC(C)OCCS[C@H](c1ccccc1)c1ccc(F)c(F)c1 ZINC000437290173 338306250 /nfs/dbraw/zinc/30/62/50/338306250.db2.gz JENUABSYPPRJBB-GOSISDBHSA-N 0 0 322.420 5.212 20 0 DKADRN CC(C)OCCS[C@@H](c1ccccc1)c1ccc(F)c(F)c1 ZINC000437290179 338306223 /nfs/dbraw/zinc/30/62/23/338306223.db2.gz JENUABSYPPRJBB-SFHVURJKSA-N 0 0 322.420 5.212 20 0 DKADRN CC(C)OCCS[C@H](c1ccccc1)c1ccc(F)cc1 ZINC000437291244 338306312 /nfs/dbraw/zinc/30/63/12/338306312.db2.gz KYQJHQUXOJYURZ-GOSISDBHSA-N 0 0 304.430 5.073 20 0 DKADRN CC(C)OCCS[C@@H](c1ccccc1)c1ccc(F)cc1 ZINC000437291256 338306308 /nfs/dbraw/zinc/30/63/08/338306308.db2.gz KYQJHQUXOJYURZ-SFHVURJKSA-N 0 0 304.430 5.073 20 0 DKADRN Cc1ccc(-c2nnc(CSCc3c(C)cccc3C)o2)cc1 ZINC000437292406 338306298 /nfs/dbraw/zinc/30/62/98/338306298.db2.gz VWCMITJCACNCSN-UHFFFAOYSA-N 0 0 324.449 5.095 20 0 DKADRN Cc1cc(C)c(CSCc2nnc(-c3ccccc3)o2)c(C)c1 ZINC000437292946 338306293 /nfs/dbraw/zinc/30/62/93/338306293.db2.gz YMHKXFLYMOHCHD-UHFFFAOYSA-N 0 0 324.449 5.095 20 0 DKADRN CCSc1ccc(Cl)cc1C(=O)Nc1ccc(F)cc1C ZINC000437294779 338306450 /nfs/dbraw/zinc/30/64/50/338306450.db2.gz ZEJZICOEONPDFL-UHFFFAOYSA-N 0 0 323.820 5.152 20 0 DKADRN CCc1ccc(CSCc2nnc(-c3ccc(C)cc3)o2)cc1 ZINC000437296515 338306477 /nfs/dbraw/zinc/30/64/77/338306477.db2.gz YGACWIFJCDAESB-UHFFFAOYSA-N 0 0 324.449 5.041 20 0 DKADRN Cc1cccc([C@@H](C)SCc2noc(-c3ccsc3)n2)c1 ZINC000437297427 338306559 /nfs/dbraw/zinc/30/65/59/338306559.db2.gz ZPACSSIEWIKBGR-GFCCVEGCSA-N 0 0 316.451 5.101 20 0 DKADRN Cc1cccc([C@H](C)SCc2noc(-c3ccsc3)n2)c1 ZINC000437297428 338306570 /nfs/dbraw/zinc/30/65/70/338306570.db2.gz ZPACSSIEWIKBGR-LBPRGKRZSA-N 0 0 316.451 5.101 20 0 DKADRN CCSc1ccc(Cl)cc1C(=O)Nc1ccccc1CC ZINC000437298688 338306505 /nfs/dbraw/zinc/30/65/05/338306505.db2.gz LSVOFZYHWACPSP-UHFFFAOYSA-N 0 0 319.857 5.267 20 0 DKADRN CCSc1ccc(Cl)cc1C(=O)Nc1cccc(C)c1C ZINC000437306037 338306718 /nfs/dbraw/zinc/30/67/18/338306718.db2.gz NIJJBINIOXTYED-UHFFFAOYSA-N 0 0 319.857 5.321 20 0 DKADRN CCSc1ccc(Cl)cc1C(=O)Nc1cc(C)ccc1C ZINC000437321391 338307060 /nfs/dbraw/zinc/30/70/60/338307060.db2.gz IMWULWWEODCVKF-UHFFFAOYSA-N 0 0 319.857 5.321 20 0 DKADRN CCc1cccc(C)c1NC(=O)c1ccc2ccc(Cl)cc2n1 ZINC000437330392 338307113 /nfs/dbraw/zinc/30/71/13/338307113.db2.gz DIUDPFBHDWSWRB-UHFFFAOYSA-N 0 0 324.811 5.011 20 0 DKADRN CC1=C(C(=O)Nc2cccc(CSC(C)C)c2C)CCC1 ZINC000437331233 338307183 /nfs/dbraw/zinc/30/71/83/338307183.db2.gz HRYGGTPANZSWRB-UHFFFAOYSA-N 0 0 303.471 5.076 20 0 DKADRN CC1=C(C(=O)Nc2ccc(F)cc2-c2ccc(F)cc2)CCC1 ZINC000437351478 338307617 /nfs/dbraw/zinc/30/76/17/338307617.db2.gz FZKOFVMXPDECCM-UHFFFAOYSA-N 0 0 313.347 5.071 20 0 DKADRN CC1=C(C(=O)Nc2c(F)cccc2Oc2ccccc2)CCC1 ZINC000437359867 338307883 /nfs/dbraw/zinc/30/78/83/338307883.db2.gz QLOQCOHTIBVGOE-UHFFFAOYSA-N 0 0 311.356 5.057 20 0 DKADRN CC1=C(C(=O)Nc2cc(Cl)c(Cl)cc2Cl)CCC1 ZINC000437363504 338307986 /nfs/dbraw/zinc/30/79/86/338307986.db2.gz GDNDRPGCZGTGGP-UHFFFAOYSA-N 0 0 304.604 5.086 20 0 DKADRN CC1=C(C(=O)Nc2ccccc2O[C@@H](C)c2ccccc2)CCC1 ZINC000437364713 338308036 /nfs/dbraw/zinc/30/80/36/338308036.db2.gz QCFYORSZQMLJMM-INIZCTEOSA-N 0 0 321.420 5.266 20 0 DKADRN CC1=C(C(=O)Nc2ccccc2O[C@H](C)c2ccccc2)CCC1 ZINC000437364716 338308028 /nfs/dbraw/zinc/30/80/28/338308028.db2.gz QCFYORSZQMLJMM-MRXNPFEDSA-N 0 0 321.420 5.266 20 0 DKADRN CC(C)c1ccc(NC(=O)N(C)CCC2CC2)c(C(C)C)c1 ZINC000437368600 338308178 /nfs/dbraw/zinc/30/81/78/338308178.db2.gz BIMGCBIJORPTGG-UHFFFAOYSA-N 0 0 302.462 5.197 20 0 DKADRN CC1=C(C(=O)N(C)[C@H](C)c2ccc(Cl)cc2Cl)CCC1 ZINC000437370619 338308190 /nfs/dbraw/zinc/30/81/90/338308190.db2.gz HOSBXWVFBGVIFF-LLVKDONJSA-N 0 0 312.240 5.013 20 0 DKADRN CC1=C(C(=O)N(C)[C@@H](C)c2ccc(Cl)cc2Cl)CCC1 ZINC000437370620 338308156 /nfs/dbraw/zinc/30/81/56/338308156.db2.gz HOSBXWVFBGVIFF-NSHDSACASA-N 0 0 312.240 5.013 20 0 DKADRN Cc1nc(C)c(CSCc2cc(C)nc3ccccc23)s1 ZINC000437412389 338309299 /nfs/dbraw/zinc/30/92/99/338309299.db2.gz MFMJWVMWNWSCJT-UHFFFAOYSA-N 0 0 314.479 5.050 20 0 DKADRN Cc1cccc([C@H](C)SCC(=O)Nc2c(C)cccc2C)c1 ZINC000437427882 338309822 /nfs/dbraw/zinc/30/98/22/338309822.db2.gz FQRCEUOGRFPTBJ-INIZCTEOSA-N 0 0 313.466 5.045 20 0 DKADRN Cc1cccc([C@@H](C)SCC(=O)Nc2c(C)cccc2C)c1 ZINC000437427884 338309779 /nfs/dbraw/zinc/30/97/79/338309779.db2.gz FQRCEUOGRFPTBJ-MRXNPFEDSA-N 0 0 313.466 5.045 20 0 DKADRN CCC(C)(C)CCSCc1nnc(-c2ccccc2Cl)o1 ZINC000437430920 338309933 /nfs/dbraw/zinc/30/99/33/338309933.db2.gz RKDLDLPXDBMYST-UHFFFAOYSA-N 0 0 324.877 5.450 20 0 DKADRN CCC(C)(C)CCS[C@@H](C)C(=O)Nc1c(C)cc(C)cc1C ZINC000437431590 338309915 /nfs/dbraw/zinc/30/99/15/338309915.db2.gz VPNVTGJJRLQIRU-INIZCTEOSA-N 0 0 321.530 5.498 20 0 DKADRN CCC(C)(C)CCS[C@H](C)C(=O)Nc1c(C)cc(C)cc1C ZINC000437431591 338309960 /nfs/dbraw/zinc/30/99/60/338309960.db2.gz VPNVTGJJRLQIRU-MRXNPFEDSA-N 0 0 321.530 5.498 20 0 DKADRN CCc1cccc(CC)c1NC(=O)CSCCC(C)(C)CC ZINC000437432289 338309934 /nfs/dbraw/zinc/30/99/34/338309934.db2.gz URRYYSYSSQWDOD-UHFFFAOYSA-N 0 0 321.530 5.309 20 0 DKADRN Cc1cccc([C@H](C)SCC(=O)Nc2ccc(C)cc2C)c1 ZINC000437432432 338309971 /nfs/dbraw/zinc/30/99/71/338309971.db2.gz HCGHNLNOOFADMX-INIZCTEOSA-N 0 0 313.466 5.045 20 0 DKADRN Cc1cccc([C@@H](C)SCC(=O)Nc2ccc(C)cc2C)c1 ZINC000437432434 338309889 /nfs/dbraw/zinc/30/98/89/338309889.db2.gz HCGHNLNOOFADMX-MRXNPFEDSA-N 0 0 313.466 5.045 20 0 DKADRN CCC(C)(C)CCSCC(=O)Nc1c(C)cc(C)cc1C ZINC000437434127 338310021 /nfs/dbraw/zinc/31/00/21/338310021.db2.gz YVMBUFFZWODHKW-UHFFFAOYSA-N 0 0 307.503 5.110 20 0 DKADRN CCc1ccccc1NC(=O)[C@H](C)SCCC(C)(C)CC ZINC000437435411 338310019 /nfs/dbraw/zinc/31/00/19/338310019.db2.gz ACWMGGOSMALFTD-AWEZNQCLSA-N 0 0 307.503 5.136 20 0 DKADRN CCc1ccccc1NC(=O)[C@@H](C)SCCC(C)(C)CC ZINC000437435415 338310037 /nfs/dbraw/zinc/31/00/37/338310037.db2.gz ACWMGGOSMALFTD-CQSZACIVSA-N 0 0 307.503 5.136 20 0 DKADRN CCC(C)(C)CCSCc1nnc(-c2ccc(C)cc2)o1 ZINC000437435665 338309997 /nfs/dbraw/zinc/30/99/97/338309997.db2.gz AYYUYYADCOCRDS-UHFFFAOYSA-N 0 0 304.459 5.105 20 0 DKADRN Cc1ccc(-c2nnc(CS[C@@H](C)c3cccc(C)c3)o2)cc1 ZINC000437436128 338310065 /nfs/dbraw/zinc/31/00/65/338310065.db2.gz AGINKMCQRPUUOU-HNNXBMFYSA-N 0 0 324.449 5.348 20 0 DKADRN Cc1ccc(-c2nnc(CS[C@H](C)c3cccc(C)c3)o2)cc1 ZINC000437436132 338309975 /nfs/dbraw/zinc/30/99/75/338309975.db2.gz AGINKMCQRPUUOU-OAHLLOKOSA-N 0 0 324.449 5.348 20 0 DKADRN CCC(C)(C)CCSCCC(=O)Nc1ccccc1Cl ZINC000437436483 338309994 /nfs/dbraw/zinc/30/99/94/338309994.db2.gz CRCLDENFKCVNIF-UHFFFAOYSA-N 0 0 313.894 5.228 20 0 DKADRN Cc1cccc([C@@H](C)S[C@@H](C)C(=O)Nc2ccccc2C)c1 ZINC000437437045 338310114 /nfs/dbraw/zinc/31/01/14/338310114.db2.gz CXPJVIPJLCBBBT-CVEARBPZSA-N 0 0 313.466 5.125 20 0 DKADRN Cc1cccc([C@H](C)S[C@@H](C)C(=O)Nc2ccccc2C)c1 ZINC000437437046 338310165 /nfs/dbraw/zinc/31/01/65/338310165.db2.gz CXPJVIPJLCBBBT-HOTGVXAUSA-N 0 0 313.466 5.125 20 0 DKADRN Cc1cccc([C@@H](C)S[C@H](C)C(=O)Nc2ccccc2C)c1 ZINC000437437047 338310156 /nfs/dbraw/zinc/31/01/56/338310156.db2.gz CXPJVIPJLCBBBT-HZPDHXFCSA-N 0 0 313.466 5.125 20 0 DKADRN Cc1cccc([C@H](C)S[C@H](C)C(=O)Nc2ccccc2C)c1 ZINC000437437048 338310141 /nfs/dbraw/zinc/31/01/41/338310141.db2.gz CXPJVIPJLCBBBT-JKSUJKDBSA-N 0 0 313.466 5.125 20 0 DKADRN FC(F)(F)CCSCCOc1cc(Cl)cc(Cl)c1 ZINC000437438504 338310147 /nfs/dbraw/zinc/31/01/47/338310147.db2.gz JVVDQWFYYJAJRN-UHFFFAOYSA-N 0 0 319.175 5.058 20 0 DKADRN CCC(C)(C)CCSCC(=O)Nc1c(C)cccc1C(C)C ZINC000437439070 338310111 /nfs/dbraw/zinc/31/01/11/338310111.db2.gz MZLVFJZWQYUZOK-UHFFFAOYSA-N 0 0 321.530 5.616 20 0 DKADRN CCC(C)(C)CCS[C@@H](C)C(=O)Nc1c(C)cccc1C ZINC000437440102 338310200 /nfs/dbraw/zinc/31/02/00/338310200.db2.gz RMRGEBQNDHIGFO-HNNXBMFYSA-N 0 0 307.503 5.190 20 0 DKADRN CCC(C)(C)CCS[C@H](C)C(=O)Nc1c(C)cccc1C ZINC000437440107 338310249 /nfs/dbraw/zinc/31/02/49/338310249.db2.gz RMRGEBQNDHIGFO-OAHLLOKOSA-N 0 0 307.503 5.190 20 0 DKADRN CCC(C)(C)CCS[C@H](C)C(=O)Nc1cc(F)ccc1C ZINC000437443124 338310314 /nfs/dbraw/zinc/31/03/14/338310314.db2.gz AWKTYQBCSUMYPN-CYBMUJFWSA-N 0 0 311.466 5.021 20 0 DKADRN CCC(C)(C)CCS[C@@H](C)C(=O)Nc1cc(F)ccc1C ZINC000437443125 338310365 /nfs/dbraw/zinc/31/03/65/338310365.db2.gz AWKTYQBCSUMYPN-ZDUSSCGKSA-N 0 0 311.466 5.021 20 0 DKADRN Cc1cccc([C@H](C)SCc2nnc(-c3ccccc3)o2)c1 ZINC000437443327 338310332 /nfs/dbraw/zinc/31/03/32/338310332.db2.gz BVENAIKZDNUJNK-AWEZNQCLSA-N 0 0 310.422 5.039 20 0 DKADRN Cc1cccc([C@@H](C)SCc2nnc(-c3ccccc3)o2)c1 ZINC000437443328 338310303 /nfs/dbraw/zinc/31/03/03/338310303.db2.gz BVENAIKZDNUJNK-CQSZACIVSA-N 0 0 310.422 5.039 20 0 DKADRN Cc1cccc([C@H](C)SCC(=O)Nc2cccc(C)c2C)c1 ZINC000437443992 338310434 /nfs/dbraw/zinc/31/04/34/338310434.db2.gz ASNXXCIIORCYEL-INIZCTEOSA-N 0 0 313.466 5.045 20 0 DKADRN Cc1cccc([C@@H](C)SCC(=O)Nc2cccc(C)c2C)c1 ZINC000437443993 338310447 /nfs/dbraw/zinc/31/04/47/338310447.db2.gz ASNXXCIIORCYEL-MRXNPFEDSA-N 0 0 313.466 5.045 20 0 DKADRN CCOCCCS[C@H](c1ccccc1)c1ccc(F)cc1 ZINC000437444636 338310452 /nfs/dbraw/zinc/31/04/52/338310452.db2.gz ZCOASAFLSPJLLT-GOSISDBHSA-N 0 0 304.430 5.075 20 0 DKADRN CCOCCCS[C@@H](c1ccccc1)c1ccc(F)cc1 ZINC000437444639 338310453 /nfs/dbraw/zinc/31/04/53/338310453.db2.gz ZCOASAFLSPJLLT-SFHVURJKSA-N 0 0 304.430 5.075 20 0 DKADRN Cc1cccc([C@@H](C)SCC(=O)Nc2ccccc2Cl)c1 ZINC000437444711 338310397 /nfs/dbraw/zinc/31/03/97/338310397.db2.gz GQWMJYMSLGBFCT-CYBMUJFWSA-N 0 0 319.857 5.081 20 0 DKADRN Cc1cccc([C@H](C)SCC(=O)Nc2ccccc2Cl)c1 ZINC000437444714 338310392 /nfs/dbraw/zinc/31/03/92/338310392.db2.gz GQWMJYMSLGBFCT-ZDUSSCGKSA-N 0 0 319.857 5.081 20 0 DKADRN CCc1cccc(C)c1NC(=O)CSCCC(C)(C)CC ZINC000437446538 338310533 /nfs/dbraw/zinc/31/05/33/338310533.db2.gz LMMTUAPVYORGPA-UHFFFAOYSA-N 0 0 307.503 5.055 20 0 DKADRN Cc1cccc([C@H](C)SCC(=O)Nc2cc(C)ccc2C)c1 ZINC000437446794 338310511 /nfs/dbraw/zinc/31/05/11/338310511.db2.gz LQDDQLAFSPJYPI-INIZCTEOSA-N 0 0 313.466 5.045 20 0 DKADRN Cc1cccc([C@@H](C)SCC(=O)Nc2cc(C)ccc2C)c1 ZINC000437446797 338310518 /nfs/dbraw/zinc/31/05/18/338310518.db2.gz LQDDQLAFSPJYPI-MRXNPFEDSA-N 0 0 313.466 5.045 20 0 DKADRN CCC(C)(C)CCS[C@H](C)C(=O)Nc1ccccc1Cl ZINC000437449775 338310589 /nfs/dbraw/zinc/31/05/89/338310589.db2.gz PGLGUFUGGAWXPO-GFCCVEGCSA-N 0 0 313.894 5.227 20 0 DKADRN CCC(C)(C)CCS[C@@H](C)C(=O)Nc1ccccc1Cl ZINC000437450182 338310599 /nfs/dbraw/zinc/31/05/99/338310599.db2.gz PGLGUFUGGAWXPO-LBPRGKRZSA-N 0 0 313.894 5.227 20 0 DKADRN Fc1ccc([C@@H](SCCc2ccccn2)c2ccccc2)cc1 ZINC000437453779 338310659 /nfs/dbraw/zinc/31/06/59/338310659.db2.gz XASNCLMRSLCYQU-FQEVSTJZSA-N 0 0 323.436 5.286 20 0 DKADRN Fc1ccc([C@H](SCCc2ccccn2)c2ccccc2)cc1 ZINC000437453780 338310646 /nfs/dbraw/zinc/31/06/46/338310646.db2.gz XASNCLMRSLCYQU-HXUWFJFHSA-N 0 0 323.436 5.286 20 0 DKADRN CCC(C)(C)CCSCC(=O)Nc1ccccc1C(C)C ZINC000437454200 338310683 /nfs/dbraw/zinc/31/06/83/338310683.db2.gz YURWJVRCWDDHPQ-UHFFFAOYSA-N 0 0 307.503 5.308 20 0 DKADRN CC(C)c1cccc(C(C)C)c1NC(=O)CSCC1CCC1 ZINC000437456794 338310813 /nfs/dbraw/zinc/31/08/13/338310813.db2.gz ZDDHYIVFAFLFPD-UHFFFAOYSA-N 0 0 319.514 5.405 20 0 DKADRN Cc1cccc([C@H](C)SCCC(=O)Nc2ccccc2C)c1 ZINC000437459431 338310830 /nfs/dbraw/zinc/31/08/30/338310830.db2.gz JAZQDYKCPJBEKM-INIZCTEOSA-N 0 0 313.466 5.126 20 0 DKADRN Cc1cccc([C@@H](C)SCCC(=O)Nc2ccccc2C)c1 ZINC000437459433 338310855 /nfs/dbraw/zinc/31/08/55/338310855.db2.gz JAZQDYKCPJBEKM-MRXNPFEDSA-N 0 0 313.466 5.126 20 0 DKADRN CCOCc1ccc(NCc2c(Cl)cccc2Cl)cc1 ZINC000437504789 338311894 /nfs/dbraw/zinc/31/18/94/338311894.db2.gz CMOCKEJHXUFCRK-UHFFFAOYSA-N 0 0 310.224 5.142 20 0 DKADRN Cc1cccc(Oc2ccccc2NC(=O)N2CCC(C)(C)C2)c1 ZINC000437548822 338313256 /nfs/dbraw/zinc/31/32/56/338313256.db2.gz QVUMRISKNXUAKZ-UHFFFAOYSA-N 0 0 324.424 5.051 20 0 DKADRN Cc1cccc(Oc2ccc(NC(=O)N3CCC(C)(C)C3)cc2)c1 ZINC000437549941 338313231 /nfs/dbraw/zinc/31/32/31/338313231.db2.gz WPLHGYWHBSBLIY-UHFFFAOYSA-N 0 0 324.424 5.051 20 0 DKADRN Cc1ccc(Oc2ccc(NC(=O)N3CCC(C)(C)C3)cc2)cc1 ZINC000437558409 338313396 /nfs/dbraw/zinc/31/33/96/338313396.db2.gz ORBVEZRQTWFCTD-UHFFFAOYSA-N 0 0 324.424 5.051 20 0 DKADRN Cc1cc(F)ccc1NC(=O)N1CCCC2(C1)CCCCCC2 ZINC000437570794 338313747 /nfs/dbraw/zinc/31/37/47/338313747.db2.gz SROXUIXWMPMPTJ-UHFFFAOYSA-N 0 0 318.436 5.102 20 0 DKADRN Cc1ccc(Oc2ccccc2NC(=O)N2CCC(C)(C)C2)cc1 ZINC000437571510 338313742 /nfs/dbraw/zinc/31/37/42/338313742.db2.gz XUTHWYVWIXPPRG-UHFFFAOYSA-N 0 0 324.424 5.051 20 0 DKADRN c1ncc(-c2ccc(N[C@H]3CC[C@H](c4ccccc4)C3)cc2)o1 ZINC000437574370 338313991 /nfs/dbraw/zinc/31/39/91/338313991.db2.gz FEMDJTTWQFYVSH-HKUYNNGSSA-N 0 0 304.393 5.090 20 0 DKADRN c1ncc(-c2ccc(N[C@@H]3CC[C@@H](c4ccccc4)C3)cc2)o1 ZINC000437574372 338313852 /nfs/dbraw/zinc/31/38/52/338313852.db2.gz FEMDJTTWQFYVSH-IEBWSBKVSA-N 0 0 304.393 5.090 20 0 DKADRN c1ncc(-c2ccc(N[C@H]3CC[C@@H](c4ccccc4)C3)cc2)o1 ZINC000437574375 338313901 /nfs/dbraw/zinc/31/39/01/338313901.db2.gz FEMDJTTWQFYVSH-MJGOQNOKSA-N 0 0 304.393 5.090 20 0 DKADRN c1ncc(-c2ccc(N[C@@H]3CC[C@H](c4ccccc4)C3)cc2)o1 ZINC000437574377 338314047 /nfs/dbraw/zinc/31/40/47/338314047.db2.gz FEMDJTTWQFYVSH-PKOBYXMFSA-N 0 0 304.393 5.090 20 0 DKADRN C[C@H](Sc1ccccc1)c1ccc(NC(=O)c2ccc[nH]2)cc1 ZINC000437576158 338313949 /nfs/dbraw/zinc/31/39/49/338313949.db2.gz JHNZNTLWOADTER-AWEZNQCLSA-N 0 0 322.433 5.120 20 0 DKADRN C[C@@H](Sc1ccccc1)c1ccc(NC(=O)c2ccc[nH]2)cc1 ZINC000437576159 338313902 /nfs/dbraw/zinc/31/39/02/338313902.db2.gz JHNZNTLWOADTER-CQSZACIVSA-N 0 0 322.433 5.120 20 0 DKADRN c1ncc(-c2cccc(N[C@H]3CC[C@@H](c4ccccc4)C3)c2)o1 ZINC000437576661 338314058 /nfs/dbraw/zinc/31/40/58/338314058.db2.gz KNVCOPPAGKWTIS-APWZRJJASA-N 0 0 304.393 5.090 20 0 DKADRN c1ncc(-c2cccc(N[C@H]3CC[C@H](c4ccccc4)C3)c2)o1 ZINC000437576662 338314082 /nfs/dbraw/zinc/31/40/82/338314082.db2.gz KNVCOPPAGKWTIS-LPHOPBHVSA-N 0 0 304.393 5.090 20 0 DKADRN c1ncc(-c2cccc(N[C@@H]3CC[C@H](c4ccccc4)C3)c2)o1 ZINC000437576663 338314067 /nfs/dbraw/zinc/31/40/67/338314067.db2.gz KNVCOPPAGKWTIS-QFBILLFUSA-N 0 0 304.393 5.090 20 0 DKADRN c1ncc(-c2cccc(N[C@@H]3CC[C@@H](c4ccccc4)C3)c2)o1 ZINC000437576664 338314153 /nfs/dbraw/zinc/31/41/53/338314153.db2.gz KNVCOPPAGKWTIS-VQIMIIECSA-N 0 0 304.393 5.090 20 0 DKADRN Fc1cccc2[nH]c(CNc3ccc(-c4nccs4)cc3)cc21 ZINC000437577154 338314098 /nfs/dbraw/zinc/31/40/98/338314098.db2.gz HGCFYGIKUOMJBR-UHFFFAOYSA-N 0 0 323.396 5.043 20 0 DKADRN CCC[C@@]1(C)CCCN(C(=O)Nc2c(CC)cccc2CC)C1 ZINC000437577679 338314190 /nfs/dbraw/zinc/31/41/90/338314190.db2.gz IBZNNPQGWQWRFS-FQEVSTJZSA-N 0 0 316.489 5.246 20 0 DKADRN CCC[C@]1(C)CCCN(C(=O)Nc2c(CC)cccc2CC)C1 ZINC000437577684 338314164 /nfs/dbraw/zinc/31/41/64/338314164.db2.gz IBZNNPQGWQWRFS-HXUWFJFHSA-N 0 0 316.489 5.246 20 0 DKADRN CCC[C@H]1[C@@H](C)CCCN1C(=O)Nc1cc(Cl)ccc1C ZINC000437578789 338314326 /nfs/dbraw/zinc/31/43/26/338314326.db2.gz MUFNDZKRTGYDJY-BBRMVZONSA-N 0 0 308.853 5.081 20 0 DKADRN CCC[C@H]1[C@H](C)CCCN1C(=O)Nc1cc(Cl)ccc1C ZINC000437578792 338314272 /nfs/dbraw/zinc/31/42/72/338314272.db2.gz MUFNDZKRTGYDJY-CJNGLKHVSA-N 0 0 308.853 5.081 20 0 DKADRN CCC[C@@H]1[C@H](C)CCCN1C(=O)Nc1cc(Cl)ccc1C ZINC000437578794 338314407 /nfs/dbraw/zinc/31/44/07/338314407.db2.gz MUFNDZKRTGYDJY-CZUORRHYSA-N 0 0 308.853 5.081 20 0 DKADRN CCC[C@@H]1[C@@H](C)CCCN1C(=O)Nc1cc(Cl)ccc1C ZINC000437578797 338314257 /nfs/dbraw/zinc/31/42/57/338314257.db2.gz MUFNDZKRTGYDJY-XJKSGUPXSA-N 0 0 308.853 5.081 20 0 DKADRN CCc1cccc(NC(=O)N2CCC[C@H]2c2cccc(C)c2C)c1 ZINC000437579240 338314340 /nfs/dbraw/zinc/31/43/40/338314340.db2.gz NXTJSFWUKBYETE-FQEVSTJZSA-N 0 0 322.452 5.235 20 0 DKADRN CCc1cccc(NC(=O)N2CCC[C@@H]2c2cccc(C)c2C)c1 ZINC000437579245 338314400 /nfs/dbraw/zinc/31/44/00/338314400.db2.gz NXTJSFWUKBYETE-HXUWFJFHSA-N 0 0 322.452 5.235 20 0 DKADRN Cc1cccc(C)c1NC(=O)Nc1ccc(OC(C)(C)C)cc1 ZINC000437581058 338314430 /nfs/dbraw/zinc/31/44/30/338314430.db2.gz KZHYFHLSWSTTSX-UHFFFAOYSA-N 0 0 312.413 5.125 20 0 DKADRN Cc1ccc(F)c(NC(=O)N2CCCC3(C2)CCCCCC3)c1 ZINC000437585686 338314990 /nfs/dbraw/zinc/31/49/90/338314990.db2.gz BSUZSPQWBVPQGU-UHFFFAOYSA-N 0 0 318.436 5.102 20 0 DKADRN CCc1ccccc1NC(=O)Nc1ccc(OC(C)(C)C)cc1 ZINC000437587493 338315127 /nfs/dbraw/zinc/31/51/27/338315127.db2.gz GRNMWRNZNPJIBN-UHFFFAOYSA-N 0 0 312.413 5.070 20 0 DKADRN Cc1ccc(C(C)(C)CN(C)C(=O)Nc2c(C)cccc2C)cc1 ZINC000437587787 338315019 /nfs/dbraw/zinc/31/50/19/338315019.db2.gz HSZBPQNFCDSVAC-UHFFFAOYSA-N 0 0 324.468 5.053 20 0 DKADRN CCCCCN(C(=O)Nc1ccc2nc(C)sc2c1)C(C)C ZINC000437588511 338315301 /nfs/dbraw/zinc/31/53/01/338315301.db2.gz IMOVYIDNAQPSQA-UHFFFAOYSA-N 0 0 319.474 5.037 20 0 DKADRN CCc1ccccc1NC(=O)N1CCCC[C@H]1c1ccc(C)cc1 ZINC000437589742 338315251 /nfs/dbraw/zinc/31/52/51/338315251.db2.gz LQAPBOJVCPPNOR-FQEVSTJZSA-N 0 0 322.452 5.317 20 0 DKADRN CCc1ccccc1NC(=O)N1CCCC[C@@H]1c1ccc(C)cc1 ZINC000437589743 338315286 /nfs/dbraw/zinc/31/52/86/338315286.db2.gz LQAPBOJVCPPNOR-HXUWFJFHSA-N 0 0 322.452 5.317 20 0 DKADRN CC[C@@H](Cc1ccc(C)cc1)N(C)C(=O)Nc1c(C)cccc1C ZINC000437589766 338315214 /nfs/dbraw/zinc/31/52/14/338315214.db2.gz LVGOJZHTPJBCRH-IBGZPJMESA-N 0 0 324.468 5.097 20 0 DKADRN CC[C@H](Cc1ccc(C)cc1)N(C)C(=O)Nc1c(C)cccc1C ZINC000437589767 338315219 /nfs/dbraw/zinc/31/52/19/338315219.db2.gz LVGOJZHTPJBCRH-LJQANCHMSA-N 0 0 324.468 5.097 20 0 DKADRN CCc1ccccc1NC(=O)N(C)[C@@H](CC)Cc1ccc(C)cc1 ZINC000437590277 338315278 /nfs/dbraw/zinc/31/52/78/338315278.db2.gz MEIGPGGQXVSSHB-IBGZPJMESA-N 0 0 324.468 5.042 20 0 DKADRN CCc1ccccc1NC(=O)N(C)[C@H](CC)Cc1ccc(C)cc1 ZINC000437590279 338315165 /nfs/dbraw/zinc/31/51/65/338315165.db2.gz MEIGPGGQXVSSHB-LJQANCHMSA-N 0 0 324.468 5.042 20 0 DKADRN CCc1cccc(NC(=O)N2CCCC[C@H]2c2ccc(C)cc2)c1 ZINC000437593395 338315560 /nfs/dbraw/zinc/31/55/60/338315560.db2.gz NUEDSCXLXNFYKR-FQEVSTJZSA-N 0 0 322.452 5.317 20 0 DKADRN CCc1cccc(NC(=O)N2CCCC[C@@H]2c2ccc(C)cc2)c1 ZINC000437593399 338315555 /nfs/dbraw/zinc/31/55/55/338315555.db2.gz NUEDSCXLXNFYKR-HXUWFJFHSA-N 0 0 322.452 5.317 20 0 DKADRN CCC[C@@H]1[C@H](C)CCCN1C(=O)Nc1c(CC)cccc1CC ZINC000437593717 338315587 /nfs/dbraw/zinc/31/55/87/338315587.db2.gz UVRIJLJUWLTJLM-CRAIPNDOSA-N 0 0 316.489 5.244 20 0 DKADRN CCC[C@@H]1[C@@H](C)CCCN1C(=O)Nc1c(CC)cccc1CC ZINC000437593718 338315549 /nfs/dbraw/zinc/31/55/49/338315549.db2.gz UVRIJLJUWLTJLM-MAUKXSAKSA-N 0 0 316.489 5.244 20 0 DKADRN CCC[C@H]1[C@H](C)CCCN1C(=O)Nc1c(CC)cccc1CC ZINC000437593719 338315471 /nfs/dbraw/zinc/31/54/71/338315471.db2.gz UVRIJLJUWLTJLM-QAPCUYQASA-N 0 0 316.489 5.244 20 0 DKADRN CCC[C@H]1[C@@H](C)CCCN1C(=O)Nc1c(CC)cccc1CC ZINC000437593720 338315463 /nfs/dbraw/zinc/31/54/63/338315463.db2.gz UVRIJLJUWLTJLM-YJBOKZPZSA-N 0 0 316.489 5.244 20 0 DKADRN CCc1ccccc1NC(=O)N1CCC[C@H]1c1cccc(C)c1C ZINC000437594441 338315505 /nfs/dbraw/zinc/31/55/05/338315505.db2.gz WHPITINJMNAPGS-FQEVSTJZSA-N 0 0 322.452 5.235 20 0 DKADRN CCc1ccccc1NC(=O)N1CCC[C@@H]1c1cccc(C)c1C ZINC000437594445 338315595 /nfs/dbraw/zinc/31/55/95/338315595.db2.gz WHPITINJMNAPGS-HXUWFJFHSA-N 0 0 322.452 5.235 20 0 DKADRN CCc1ccccc1NC(=O)N1CCCC2(C1)CCCCCC2 ZINC000437595404 338315653 /nfs/dbraw/zinc/31/56/53/338315653.db2.gz YNYMAVKDUNSJHI-UHFFFAOYSA-N 0 0 314.473 5.217 20 0 DKADRN Cc1cccc(C)c1NC(=O)N1CCCC2(C1)CCCCCC2 ZINC000437595495 338315626 /nfs/dbraw/zinc/31/56/26/338315626.db2.gz YVMSKYLMJFZRHI-UHFFFAOYSA-N 0 0 314.473 5.272 20 0 DKADRN CCC[C@@]1(C)CCCN(C(=O)Nc2cc(Cl)ccc2C)C1 ZINC000437595905 338315633 /nfs/dbraw/zinc/31/56/33/338315633.db2.gz UAMSUSQFBUDVQL-KRWDZBQOSA-N 0 0 308.853 5.083 20 0 DKADRN CCC[C@]1(C)CCCN(C(=O)Nc2cc(Cl)ccc2C)C1 ZINC000437595907 338315619 /nfs/dbraw/zinc/31/56/19/338315619.db2.gz UAMSUSQFBUDVQL-QGZVFWFLSA-N 0 0 308.853 5.083 20 0 DKADRN CCC[C@@H]1[C@H](C)CCCN1C(=O)Nc1ccccc1C(C)(C)C ZINC000437643489 338317035 /nfs/dbraw/zinc/31/70/35/338317035.db2.gz BTUYAWNFSXTIBO-CRAIPNDOSA-N 0 0 316.489 5.417 20 0 DKADRN CCC[C@@H]1[C@@H](C)CCCN1C(=O)Nc1ccccc1C(C)(C)C ZINC000437643492 338317032 /nfs/dbraw/zinc/31/70/32/338317032.db2.gz BTUYAWNFSXTIBO-MAUKXSAKSA-N 0 0 316.489 5.417 20 0 DKADRN CCC[C@H]1[C@H](C)CCCN1C(=O)Nc1ccccc1C(C)(C)C ZINC000437643493 338317044 /nfs/dbraw/zinc/31/70/44/338317044.db2.gz BTUYAWNFSXTIBO-QAPCUYQASA-N 0 0 316.489 5.417 20 0 DKADRN CCC[C@H]1[C@@H](C)CCCN1C(=O)Nc1ccccc1C(C)(C)C ZINC000437643495 338317082 /nfs/dbraw/zinc/31/70/82/338317082.db2.gz BTUYAWNFSXTIBO-YJBOKZPZSA-N 0 0 316.489 5.417 20 0 DKADRN CCC[C@@]1(C)CCCN(C(=O)Nc2cccc(Cl)c2C)C1 ZINC000437646037 338317057 /nfs/dbraw/zinc/31/70/57/338317057.db2.gz MMSWBLSMUTXPIO-KRWDZBQOSA-N 0 0 308.853 5.083 20 0 DKADRN CCC[C@]1(C)CCCN(C(=O)Nc2cccc(Cl)c2C)C1 ZINC000437646039 338317036 /nfs/dbraw/zinc/31/70/36/338317036.db2.gz MMSWBLSMUTXPIO-QGZVFWFLSA-N 0 0 308.853 5.083 20 0 DKADRN c1sc(Cc2nc3ccccc3s2)nc1C1CCCC1 ZINC000437646634 338317004 /nfs/dbraw/zinc/31/70/04/338317004.db2.gz AIKRZNHCNHORKH-UHFFFAOYSA-N 0 0 300.452 5.001 20 0 DKADRN CCO[C@H](C)c1nc(-c2cc(Cl)ccc2Cl)cs1 ZINC000437650048 338317190 /nfs/dbraw/zinc/31/71/90/338317190.db2.gz KTBCLXJTVVJORG-MRVPVSSYSA-N 0 0 302.226 5.214 20 0 DKADRN CCO[C@@H](C)c1nc(-c2cc(Cl)ccc2Cl)cs1 ZINC000437650049 338317142 /nfs/dbraw/zinc/31/71/42/338317142.db2.gz KTBCLXJTVVJORG-QMMMGPOBSA-N 0 0 302.226 5.214 20 0 DKADRN Cc1ccc(NC(=O)N2CCCC3(C2)CCCCCC3)c(F)c1 ZINC000437650192 338317293 /nfs/dbraw/zinc/31/72/93/338317293.db2.gz ZWVQQZNADAFULY-UHFFFAOYSA-N 0 0 318.436 5.102 20 0 DKADRN CCCCc1ccc(NC(=O)N(C)[C@@H](C)CCSCC)cc1 ZINC000437650236 338317286 /nfs/dbraw/zinc/31/72/86/338317286.db2.gz KMPSFWBGWCPKEI-HNNXBMFYSA-N 0 0 322.518 5.025 20 0 DKADRN CCCCc1ccc(NC(=O)N(C)[C@H](C)CCSCC)cc1 ZINC000437650238 338317285 /nfs/dbraw/zinc/31/72/85/338317285.db2.gz KMPSFWBGWCPKEI-OAHLLOKOSA-N 0 0 322.518 5.025 20 0 DKADRN CCc1ccc(NC(=O)N2CCC[C@H]2c2cccc(C)c2C)cc1 ZINC000437650537 338317277 /nfs/dbraw/zinc/31/72/77/338317277.db2.gz BERVLKSODNGACA-FQEVSTJZSA-N 0 0 322.452 5.235 20 0 DKADRN CCc1ccc(NC(=O)N2CCC[C@@H]2c2cccc(C)c2C)cc1 ZINC000437650539 338317315 /nfs/dbraw/zinc/31/73/15/338317315.db2.gz BERVLKSODNGACA-HXUWFJFHSA-N 0 0 322.452 5.235 20 0 DKADRN CCO[C@H](C)c1nc(-c2ccc(Cl)cc2Cl)cs1 ZINC000437651078 338317223 /nfs/dbraw/zinc/31/72/23/338317223.db2.gz OARZFDYZHSFPDB-MRVPVSSYSA-N 0 0 302.226 5.214 20 0 DKADRN CCO[C@@H](C)c1nc(-c2ccc(Cl)cc2Cl)cs1 ZINC000437651080 338317272 /nfs/dbraw/zinc/31/72/72/338317272.db2.gz OARZFDYZHSFPDB-QMMMGPOBSA-N 0 0 302.226 5.214 20 0 DKADRN CCO[C@@H](C)c1nc(-c2cc(C)n(CCC(C)C)c2C)cs1 ZINC000437651099 338317259 /nfs/dbraw/zinc/31/72/59/338317259.db2.gz MZTKAKDBEGPAGM-HNNXBMFYSA-N 0 0 320.502 5.372 20 0 DKADRN CCO[C@H](C)c1nc(-c2cc(C)n(CCC(C)C)c2C)cs1 ZINC000437651101 338317235 /nfs/dbraw/zinc/31/72/35/338317235.db2.gz MZTKAKDBEGPAGM-OAHLLOKOSA-N 0 0 320.502 5.372 20 0 DKADRN Cc1ccc(F)cc1NC(=O)N1CCCC2(C1)CCCCCC2 ZINC000437651370 338317239 /nfs/dbraw/zinc/31/72/39/338317239.db2.gz NHPMUJXJLXKOFN-UHFFFAOYSA-N 0 0 318.436 5.102 20 0 DKADRN Cc1nc(N[C@H]2CCOc3ccccc32)sc1-c1ccccc1 ZINC000437651703 338317268 /nfs/dbraw/zinc/31/72/68/338317268.db2.gz DGYKVHRVIPKEED-INIZCTEOSA-N 0 0 322.433 5.054 20 0 DKADRN Cc1nc(N[C@@H]2CCOc3ccccc32)sc1-c1ccccc1 ZINC000437651706 338317304 /nfs/dbraw/zinc/31/73/04/338317304.db2.gz DGYKVHRVIPKEED-MRXNPFEDSA-N 0 0 322.433 5.054 20 0 DKADRN CCC[C@@]1(C)CCCN(C(=O)Nc2ccc(Cl)cc2C)C1 ZINC000437652203 338317222 /nfs/dbraw/zinc/31/72/22/338317222.db2.gz RENCJAXWYQDUTG-KRWDZBQOSA-N 0 0 308.853 5.083 20 0 DKADRN CCC[C@]1(C)CCCN(C(=O)Nc2ccc(Cl)cc2C)C1 ZINC000437652204 338317252 /nfs/dbraw/zinc/31/72/52/338317252.db2.gz RENCJAXWYQDUTG-QGZVFWFLSA-N 0 0 308.853 5.083 20 0 DKADRN CCc1ccc(NC(=O)N2CCCC[C@H]2c2ccc(C)cc2)cc1 ZINC000437652869 338317260 /nfs/dbraw/zinc/31/72/60/338317260.db2.gz RVWGUSHXXUWNIO-FQEVSTJZSA-N 0 0 322.452 5.317 20 0 DKADRN CCc1ccc(NC(=O)N2CCCC[C@@H]2c2ccc(C)cc2)cc1 ZINC000437652870 338317296 /nfs/dbraw/zinc/31/72/96/338317296.db2.gz RVWGUSHXXUWNIO-HXUWFJFHSA-N 0 0 322.452 5.317 20 0 DKADRN CCO[C@H](C)c1nc(-c2cc3cc(Cl)ccc3o2)cs1 ZINC000437653019 338317224 /nfs/dbraw/zinc/31/72/24/338317224.db2.gz JFMFBNLTYKMERL-SECBINFHSA-N 0 0 307.802 5.307 20 0 DKADRN CCO[C@@H](C)c1nc(-c2cc3cc(Cl)ccc3o2)cs1 ZINC000437653021 338317364 /nfs/dbraw/zinc/31/73/64/338317364.db2.gz JFMFBNLTYKMERL-VIFPVBQESA-N 0 0 307.802 5.307 20 0 DKADRN CCC[C@@]1(C)CCCN(C(=O)Nc2ccccc2C(C)C)C1 ZINC000437653779 338317399 /nfs/dbraw/zinc/31/73/99/338317399.db2.gz UIQWOFPLTYIAEH-IBGZPJMESA-N 0 0 302.462 5.244 20 0 DKADRN CCC[C@]1(C)CCCN(C(=O)Nc2ccccc2C(C)C)C1 ZINC000437653782 338317347 /nfs/dbraw/zinc/31/73/47/338317347.db2.gz UIQWOFPLTYIAEH-LJQANCHMSA-N 0 0 302.462 5.244 20 0 DKADRN CCO[C@@H](C)c1nc(-c2ccccc2)c(-c2ccccc2)s1 ZINC000437653853 338317406 /nfs/dbraw/zinc/31/74/06/338317406.db2.gz UWAMRMVRJQZUNF-AWEZNQCLSA-N 0 0 309.434 5.575 20 0 DKADRN CCO[C@H](C)c1nc(-c2ccccc2)c(-c2ccccc2)s1 ZINC000437653856 338317375 /nfs/dbraw/zinc/31/73/75/338317375.db2.gz UWAMRMVRJQZUNF-CQSZACIVSA-N 0 0 309.434 5.575 20 0 DKADRN CCC[C@@]1(C)CCCN(C(=O)Nc2ccc(C)cc2Cl)C1 ZINC000437653987 338317387 /nfs/dbraw/zinc/31/73/87/338317387.db2.gz KXQNZTGEFQVBSY-KRWDZBQOSA-N 0 0 308.853 5.083 20 0 DKADRN CCC[C@]1(C)CCCN(C(=O)Nc2ccc(C)cc2Cl)C1 ZINC000437653989 338317366 /nfs/dbraw/zinc/31/73/66/338317366.db2.gz KXQNZTGEFQVBSY-QGZVFWFLSA-N 0 0 308.853 5.083 20 0 DKADRN CC(C)c1cccc(C(C)C)c1NC(=O)N1C[C@H](C)[C@H](C)C1 ZINC000437654997 338317397 /nfs/dbraw/zinc/31/73/97/338317397.db2.gz YLXFQUUABFNYBU-GASCZTMLSA-N 0 0 302.462 5.053 20 0 DKADRN CC(C)c1cccc(C(C)C)c1NC(=O)N1C[C@H](C)[C@@H](C)C1 ZINC000437654998 338317368 /nfs/dbraw/zinc/31/73/68/338317368.db2.gz YLXFQUUABFNYBU-GJZGRUSLSA-N 0 0 302.462 5.053 20 0 DKADRN CC(C)c1cccc(C(C)C)c1NC(=O)N1C[C@@H](C)[C@H](C)C1 ZINC000437654999 338317349 /nfs/dbraw/zinc/31/73/49/338317349.db2.gz YLXFQUUABFNYBU-HUUCEWRRSA-N 0 0 302.462 5.053 20 0 DKADRN C[C@@H]1CCC[C@@H](C)N(C(=O)Nc2ccc(Cl)cc2Cl)C1 ZINC000437655315 338317361 /nfs/dbraw/zinc/31/73/61/338317361.db2.gz FYGGAGOAULDUCP-GHMZBOCLSA-N 0 0 315.244 5.036 20 0 DKADRN C[C@@H]1CCC[C@H](C)N(C(=O)Nc2ccc(Cl)cc2Cl)C1 ZINC000437655317 338317360 /nfs/dbraw/zinc/31/73/60/338317360.db2.gz FYGGAGOAULDUCP-MNOVXSKESA-N 0 0 315.244 5.036 20 0 DKADRN C[C@H]1CCC[C@H](C)N(C(=O)Nc2ccc(Cl)cc2Cl)C1 ZINC000437655319 338317376 /nfs/dbraw/zinc/31/73/76/338317376.db2.gz FYGGAGOAULDUCP-QWRGUYRKSA-N 0 0 315.244 5.036 20 0 DKADRN C[C@@H]1CCC[C@H](C)CN1C(=O)Nc1ccc(Cl)cc1Cl ZINC000437655321 338317357 /nfs/dbraw/zinc/31/73/57/338317357.db2.gz FYGGAGOAULDUCP-WDEREUQCSA-N 0 0 315.244 5.036 20 0 DKADRN C[C@@H](C1CC1)N(C(=O)Nc1ccccc1-c1ccccc1)C1CC1 ZINC000437656820 338317423 /nfs/dbraw/zinc/31/74/23/338317423.db2.gz JUPSQPHWFYONKK-HNNXBMFYSA-N 0 0 320.436 5.148 20 0 DKADRN C[C@H](C1CC1)N(C(=O)Nc1ccccc1-c1ccccc1)C1CC1 ZINC000437656830 338317415 /nfs/dbraw/zinc/31/74/15/338317415.db2.gz JUPSQPHWFYONKK-OAHLLOKOSA-N 0 0 320.436 5.148 20 0 DKADRN Cc1cccc(C(C)C)c1NC(=O)N1CCCC(C)(C)CC1 ZINC000437657029 338317473 /nfs/dbraw/zinc/31/74/73/338317473.db2.gz ANCRPFMQKANJPY-UHFFFAOYSA-N 0 0 302.462 5.162 20 0 DKADRN CCC[C@@H]1[C@@H](C)CCCN1C(=O)Nc1ccc(Cl)cc1C ZINC000437657543 338317475 /nfs/dbraw/zinc/31/74/75/338317475.db2.gz CQOZGNYJLXHURP-BLLLJJGKSA-N 0 0 308.853 5.081 20 0 DKADRN CCC[C@H]1[C@@H](C)CCCN1C(=O)Nc1ccc(Cl)cc1C ZINC000437657837 338317510 /nfs/dbraw/zinc/31/75/10/338317510.db2.gz CQOZGNYJLXHURP-LRDDRELGSA-N 0 0 308.853 5.081 20 0 DKADRN CCC[C@@H]1[C@H](C)CCCN1C(=O)Nc1ccc(Cl)cc1C ZINC000437657839 338317505 /nfs/dbraw/zinc/31/75/05/338317505.db2.gz CQOZGNYJLXHURP-MLGOLLRUSA-N 0 0 308.853 5.081 20 0 DKADRN CCC[C@H]1[C@H](C)CCCN1C(=O)Nc1ccc(Cl)cc1C ZINC000437657841 338317484 /nfs/dbraw/zinc/31/74/84/338317484.db2.gz CQOZGNYJLXHURP-WBMJQRKESA-N 0 0 308.853 5.081 20 0 DKADRN CCO[C@H](C)c1nc(-c2ccc(Cl)c(Cl)c2)cs1 ZINC000437658370 338317612 /nfs/dbraw/zinc/31/76/12/338317612.db2.gz XNOHPCFIGPEJJH-MRVPVSSYSA-N 0 0 302.226 5.214 20 0 DKADRN CCO[C@@H](C)c1nc(-c2ccc(Cl)c(Cl)c2)cs1 ZINC000437658371 338317603 /nfs/dbraw/zinc/31/76/03/338317603.db2.gz XNOHPCFIGPEJJH-QMMMGPOBSA-N 0 0 302.226 5.214 20 0 DKADRN CCO[C@H](C)c1nc(-c2sc3ccccc3c2C)cs1 ZINC000437658711 338317575 /nfs/dbraw/zinc/31/75/75/338317575.db2.gz YJHXVXUHCDUWDX-LLVKDONJSA-N 0 0 303.452 5.431 20 0 DKADRN CCO[C@@H](C)c1nc(-c2sc3ccccc3c2C)cs1 ZINC000437658720 338317530 /nfs/dbraw/zinc/31/75/30/338317530.db2.gz YJHXVXUHCDUWDX-NSHDSACASA-N 0 0 303.452 5.431 20 0 DKADRN CCC[C@@H]1[C@H](C)CCCN1C(=O)Nc1ccccc1C(C)C ZINC000437658779 338317602 /nfs/dbraw/zinc/31/76/02/338317602.db2.gz OXMKWOLYEBUSMN-CRAIPNDOSA-N 0 0 302.462 5.243 20 0 DKADRN CCC[C@@H]1[C@@H](C)CCCN1C(=O)Nc1ccccc1C(C)C ZINC000437658781 338317567 /nfs/dbraw/zinc/31/75/67/338317567.db2.gz OXMKWOLYEBUSMN-MAUKXSAKSA-N 0 0 302.462 5.243 20 0 DKADRN CCC[C@@]1(C)CCCN(C(=O)Nc2c(C)cccc2C(C)C)C1 ZINC000437658782 338317522 /nfs/dbraw/zinc/31/75/22/338317522.db2.gz AFIUWDMRDPDLBF-FQEVSTJZSA-N 0 0 316.489 5.553 20 0 DKADRN CCC[C@H]1[C@H](C)CCCN1C(=O)Nc1ccccc1C(C)C ZINC000437658784 338317570 /nfs/dbraw/zinc/31/75/70/338317570.db2.gz OXMKWOLYEBUSMN-QAPCUYQASA-N 0 0 302.462 5.243 20 0 DKADRN CCC[C@]1(C)CCCN(C(=O)Nc2c(C)cccc2C(C)C)C1 ZINC000437658785 338317609 /nfs/dbraw/zinc/31/76/09/338317609.db2.gz AFIUWDMRDPDLBF-HXUWFJFHSA-N 0 0 316.489 5.553 20 0 DKADRN CCC[C@H]1[C@@H](C)CCCN1C(=O)Nc1ccccc1C(C)C ZINC000437658787 338317597 /nfs/dbraw/zinc/31/75/97/338317597.db2.gz OXMKWOLYEBUSMN-YJBOKZPZSA-N 0 0 302.462 5.243 20 0 DKADRN CCC[C@@H]1[C@@H](C)CCCN1C(=O)Nc1cccc(Cl)c1C ZINC000437658843 338317557 /nfs/dbraw/zinc/31/75/57/338317557.db2.gz YYDRXZJOSYHSMR-BLLLJJGKSA-N 0 0 308.853 5.081 20 0 DKADRN CCC[C@H]1[C@@H](C)CCCN1C(=O)Nc1cccc(Cl)c1C ZINC000437658844 338317545 /nfs/dbraw/zinc/31/75/45/338317545.db2.gz YYDRXZJOSYHSMR-LRDDRELGSA-N 0 0 308.853 5.081 20 0 DKADRN CCC[C@@H]1[C@H](C)CCCN1C(=O)Nc1cccc(Cl)c1C ZINC000437658845 338317561 /nfs/dbraw/zinc/31/75/61/338317561.db2.gz YYDRXZJOSYHSMR-MLGOLLRUSA-N 0 0 308.853 5.081 20 0 DKADRN CCC[C@H]1[C@H](C)CCCN1C(=O)Nc1cccc(Cl)c1C ZINC000437658846 338317551 /nfs/dbraw/zinc/31/75/51/338317551.db2.gz YYDRXZJOSYHSMR-WBMJQRKESA-N 0 0 308.853 5.081 20 0 DKADRN CCC[C@H]1[C@@H](C)CCCN1C(=O)Nc1ccc(C)cc1Cl ZINC000437659261 338317579 /nfs/dbraw/zinc/31/75/79/338317579.db2.gz HVAHVXDTSNEPPR-BBRMVZONSA-N 0 0 308.853 5.081 20 0 DKADRN CCC[C@H]1[C@H](C)CCCN1C(=O)Nc1ccc(C)cc1Cl ZINC000437659263 338317616 /nfs/dbraw/zinc/31/76/16/338317616.db2.gz HVAHVXDTSNEPPR-CJNGLKHVSA-N 0 0 308.853 5.081 20 0 DKADRN CCC[C@@H]1[C@H](C)CCCN1C(=O)Nc1ccc(C)cc1Cl ZINC000437659264 338317571 /nfs/dbraw/zinc/31/75/71/338317571.db2.gz HVAHVXDTSNEPPR-CZUORRHYSA-N 0 0 308.853 5.081 20 0 DKADRN CCC[C@@H]1[C@@H](C)CCCN1C(=O)Nc1ccc(C)cc1Cl ZINC000437659266 338317600 /nfs/dbraw/zinc/31/76/00/338317600.db2.gz HVAHVXDTSNEPPR-XJKSGUPXSA-N 0 0 308.853 5.081 20 0 DKADRN Cc1ccc([C@@H]2CCCCN2C(=O)Nc2cc(C)cc(C)c2)cc1 ZINC000437660417 338317672 /nfs/dbraw/zinc/31/76/72/338317672.db2.gz JYUKAMTXNBLRPP-FQEVSTJZSA-N 0 0 322.452 5.371 20 0 DKADRN Cc1ccc([C@H]2CCCCN2C(=O)Nc2cc(C)cc(C)c2)cc1 ZINC000437660418 338317628 /nfs/dbraw/zinc/31/76/28/338317628.db2.gz JYUKAMTXNBLRPP-HXUWFJFHSA-N 0 0 322.452 5.371 20 0 DKADRN CC1(C)CCCN(C(=O)Nc2ccc(Cl)cc2Cl)CC1 ZINC000437660492 338317663 /nfs/dbraw/zinc/31/76/63/338317663.db2.gz KLPQBZIIDSXOHK-UHFFFAOYSA-N 0 0 315.244 5.037 20 0 DKADRN Cc1cccc(C(C)C)c1NC(=O)N1C[C@H](C)CCC[C@H]1C ZINC000437660635 338317624 /nfs/dbraw/zinc/31/76/24/338317624.db2.gz UIGRXLCBJJQNHN-GDBMZVCRSA-N 0 0 302.462 5.161 20 0 DKADRN Cc1cccc(C(C)C)c1NC(=O)N1C[C@@H](C)CCC[C@H]1C ZINC000437660636 338317653 /nfs/dbraw/zinc/31/76/53/338317653.db2.gz UIGRXLCBJJQNHN-GOEBONIOSA-N 0 0 302.462 5.161 20 0 DKADRN Cc1cccc(C(C)C)c1NC(=O)N1C[C@@H](C)CCC[C@@H]1C ZINC000437660637 338317621 /nfs/dbraw/zinc/31/76/21/338317621.db2.gz UIGRXLCBJJQNHN-HOCLYGCPSA-N 0 0 302.462 5.161 20 0 DKADRN Cc1cccc(C(C)C)c1NC(=O)N1C[C@H](C)CCC[C@@H]1C ZINC000437660638 338317667 /nfs/dbraw/zinc/31/76/67/338317667.db2.gz UIGRXLCBJJQNHN-ZBFHGGJFSA-N 0 0 302.462 5.161 20 0 DKADRN CC[C@@]1(C)CCCN(C(=O)Nc2ccc(Cl)cc2Cl)C1 ZINC000437662293 338317662 /nfs/dbraw/zinc/31/76/62/338317662.db2.gz MATISTBZHJWVFK-HNNXBMFYSA-N 0 0 315.244 5.037 20 0 DKADRN CC[C@]1(C)CCCN(C(=O)Nc2ccc(Cl)cc2Cl)C1 ZINC000437662294 338317709 /nfs/dbraw/zinc/31/77/09/338317709.db2.gz MATISTBZHJWVFK-OAHLLOKOSA-N 0 0 315.244 5.037 20 0 DKADRN C[C@@H]1CCC[C@H](C)N(C(=O)Nc2ccccc2C(C)(C)C)C1 ZINC000437662371 338317665 /nfs/dbraw/zinc/31/76/65/338317665.db2.gz RFYHFDISSAFAGX-CABCVRRESA-N 0 0 302.462 5.027 20 0 DKADRN C[C@H]1CCC[C@H](C)N(C(=O)Nc2ccccc2C(C)(C)C)C1 ZINC000437662372 338317649 /nfs/dbraw/zinc/31/76/49/338317649.db2.gz RFYHFDISSAFAGX-GJZGRUSLSA-N 0 0 302.462 5.027 20 0 DKADRN C[C@@H]1CCC[C@@H](C)N(C(=O)Nc2ccccc2C(C)(C)C)C1 ZINC000437662373 338317680 /nfs/dbraw/zinc/31/76/80/338317680.db2.gz RFYHFDISSAFAGX-HUUCEWRRSA-N 0 0 302.462 5.027 20 0 DKADRN C[C@@H]1CCC[C@H](C)CN1C(=O)Nc1ccccc1C(C)(C)C ZINC000437662374 338317677 /nfs/dbraw/zinc/31/76/77/338317677.db2.gz RFYHFDISSAFAGX-LSDHHAIUSA-N 0 0 302.462 5.027 20 0 DKADRN CC(C)(C)c1ccccc1NC(=O)N1CCCC(C)(C)CC1 ZINC000437662642 338317681 /nfs/dbraw/zinc/31/76/81/338317681.db2.gz NRACVNFNHZAROW-UHFFFAOYSA-N 0 0 302.462 5.028 20 0 DKADRN Cc1cc(C)cc(NC(=O)N2CCC[C@H]2c2cccc(C)c2C)c1 ZINC000437664173 338317770 /nfs/dbraw/zinc/31/77/70/338317770.db2.gz CROQSUGACKOPJP-FQEVSTJZSA-N 0 0 322.452 5.289 20 0 DKADRN Cc1cc(C)cc(NC(=O)N2CCC[C@@H]2c2cccc(C)c2C)c1 ZINC000437664175 338317746 /nfs/dbraw/zinc/31/77/46/338317746.db2.gz CROQSUGACKOPJP-HXUWFJFHSA-N 0 0 322.452 5.289 20 0 DKADRN CCCCCN(C(=O)Nc1ccccc1C(C)(C)C)C(C)C ZINC000437664884 338317747 /nfs/dbraw/zinc/31/77/47/338317747.db2.gz FSIHENMEMUOXNS-UHFFFAOYSA-N 0 0 304.478 5.417 20 0 DKADRN COCc1nc(-c2ccc(Oc3ccccc3)cc2)c(C)s1 ZINC000437664958 338317759 /nfs/dbraw/zinc/31/77/59/338317759.db2.gz FZAOZNSPIFECTN-UHFFFAOYSA-N 0 0 311.406 5.057 20 0 DKADRN Cc1cc(C)cc(NC(=O)Nc2cccc(CC(F)(F)F)c2)c1 ZINC000437666272 338317818 /nfs/dbraw/zinc/31/78/18/338317818.db2.gz JMEWLLVQOOLZKY-UHFFFAOYSA-N 0 0 322.330 5.052 20 0 DKADRN Cc1cc(C)cc(NC(=O)Nc2ccc(CC(F)(F)F)cc2)c1 ZINC000437667426 338317868 /nfs/dbraw/zinc/31/78/68/338317868.db2.gz NMPKDGFYRRKAJW-UHFFFAOYSA-N 0 0 322.330 5.052 20 0 DKADRN CC[C@@]1(C)CCCN(C(=O)Nc2ccccc2C(C)(C)C)C1 ZINC000437667484 338317837 /nfs/dbraw/zinc/31/78/37/338317837.db2.gz PHSUMBCRCJZVQO-IBGZPJMESA-N 0 0 302.462 5.028 20 0 DKADRN CC[C@]1(C)CCCN(C(=O)Nc2ccccc2C(C)(C)C)C1 ZINC000437667486 338317898 /nfs/dbraw/zinc/31/78/98/338317898.db2.gz PHSUMBCRCJZVQO-LJQANCHMSA-N 0 0 302.462 5.028 20 0 DKADRN CCC[C@@]1(C)CCCN(C(=O)Nc2ccccc2C(C)(C)C)C1 ZINC000437669616 338317857 /nfs/dbraw/zinc/31/78/57/338317857.db2.gz SLSIVTUCFDNBIP-FQEVSTJZSA-N 0 0 316.489 5.418 20 0 DKADRN CCC[C@]1(C)CCCN(C(=O)Nc2ccccc2C(C)(C)C)C1 ZINC000437669618 338317849 /nfs/dbraw/zinc/31/78/49/338317849.db2.gz SLSIVTUCFDNBIP-HXUWFJFHSA-N 0 0 316.489 5.418 20 0 DKADRN CCCc1ccccc1NC(=O)N1CCC[C@@H](C)[C@H]1CCC ZINC000437676506 338318071 /nfs/dbraw/zinc/31/80/71/338318071.db2.gz RRIOVYBJIZKWGH-CRAIPNDOSA-N 0 0 302.462 5.072 20 0 DKADRN CCCc1ccccc1NC(=O)N1CCC[C@H](C)[C@H]1CCC ZINC000437676509 338318094 /nfs/dbraw/zinc/31/80/94/338318094.db2.gz RRIOVYBJIZKWGH-MAUKXSAKSA-N 0 0 302.462 5.072 20 0 DKADRN CCCc1ccccc1NC(=O)N1CCC[C@@H](C)[C@@H]1CCC ZINC000437676512 338318072 /nfs/dbraw/zinc/31/80/72/338318072.db2.gz RRIOVYBJIZKWGH-QAPCUYQASA-N 0 0 302.462 5.072 20 0 DKADRN CCCc1ccccc1NC(=O)N1CCC[C@H](C)[C@@H]1CCC ZINC000437676515 338318087 /nfs/dbraw/zinc/31/80/87/338318087.db2.gz RRIOVYBJIZKWGH-YJBOKZPZSA-N 0 0 302.462 5.072 20 0 DKADRN CCC[C@@H]1[C@H](C)CCCN1C(=O)Nc1c(C)cccc1C(C)C ZINC000437678991 338318059 /nfs/dbraw/zinc/31/80/59/338318059.db2.gz XGKJWAYAAMUHAN-CRAIPNDOSA-N 0 0 316.489 5.551 20 0 DKADRN CCC[C@@H]1[C@@H](C)CCCN1C(=O)Nc1c(C)cccc1C(C)C ZINC000437678993 338318036 /nfs/dbraw/zinc/31/80/36/338318036.db2.gz XGKJWAYAAMUHAN-MAUKXSAKSA-N 0 0 316.489 5.551 20 0 DKADRN CCC[C@H]1[C@H](C)CCCN1C(=O)Nc1c(C)cccc1C(C)C ZINC000437678995 338318076 /nfs/dbraw/zinc/31/80/76/338318076.db2.gz XGKJWAYAAMUHAN-QAPCUYQASA-N 0 0 316.489 5.551 20 0 DKADRN CCC[C@H]1[C@@H](C)CCCN1C(=O)Nc1c(C)cccc1C(C)C ZINC000437678996 338318134 /nfs/dbraw/zinc/31/81/34/338318134.db2.gz XGKJWAYAAMUHAN-YJBOKZPZSA-N 0 0 316.489 5.551 20 0 DKADRN CCCc1ccccc1NC(=O)N(C)[C@@H](CC)Cc1ccccc1 ZINC000437689010 338318327 /nfs/dbraw/zinc/31/83/27/338318327.db2.gz BUCYKVIRPQNGJU-IBGZPJMESA-N 0 0 324.468 5.124 20 0 DKADRN CCCc1ccccc1NC(=O)N(C)[C@H](CC)Cc1ccccc1 ZINC000437689011 338318274 /nfs/dbraw/zinc/31/82/74/338318274.db2.gz BUCYKVIRPQNGJU-LJQANCHMSA-N 0 0 324.468 5.124 20 0 DKADRN Cc1ccc(NC(=O)Nc2cccc(CC(F)(F)F)c2)c(C)c1 ZINC000437689248 338318283 /nfs/dbraw/zinc/31/82/83/338318283.db2.gz ANIYIXYGFFHMTE-UHFFFAOYSA-N 0 0 322.330 5.052 20 0 DKADRN Cc1ccc(NC(=O)N2CCCC3(C2)CCCCCC3)c(C)c1 ZINC000437693209 338318508 /nfs/dbraw/zinc/31/85/08/338318508.db2.gz KPIFHOGHXSCNNX-UHFFFAOYSA-N 0 0 314.473 5.272 20 0 DKADRN Cc1ccc(C(C)(C)CN(C)C(=O)Nc2ccc(C)cc2C)cc1 ZINC000437694576 338318531 /nfs/dbraw/zinc/31/85/31/338318531.db2.gz NKLFFVQWVZZELH-UHFFFAOYSA-N 0 0 324.468 5.053 20 0 DKADRN Cc1ccc(NC(=O)N2CCC[C@H]2c2cccc(C)c2C)c(C)c1 ZINC000437694672 338318546 /nfs/dbraw/zinc/31/85/46/338318546.db2.gz HKQPVSGGOCYLBZ-FQEVSTJZSA-N 0 0 322.452 5.289 20 0 DKADRN Cc1ccc(NC(=O)N2CCC[C@@H]2c2cccc(C)c2C)c(C)c1 ZINC000437694677 338318567 /nfs/dbraw/zinc/31/85/67/338318567.db2.gz HKQPVSGGOCYLBZ-HXUWFJFHSA-N 0 0 322.452 5.289 20 0 DKADRN Cc1ccc(C)c(NC(=O)N2CCCC3(C2)CCCCCC3)c1 ZINC000437697590 338318596 /nfs/dbraw/zinc/31/85/96/338318596.db2.gz HBWXYNMVXRXDCW-UHFFFAOYSA-N 0 0 314.473 5.272 20 0 DKADRN CCOCc1ccc(NC(=O)Nc2cccc3ccccc32)cc1 ZINC000437698499 338318688 /nfs/dbraw/zinc/31/86/88/338318688.db2.gz ONVPCZSFTOQURH-UHFFFAOYSA-N 0 0 320.392 5.020 20 0 DKADRN CCCc1ccccc1NC(=O)N1CCC[C@](C)(CCC)C1 ZINC000437699831 338318703 /nfs/dbraw/zinc/31/87/03/338318703.db2.gz JFKWWWHUTYVYSS-IBGZPJMESA-N 0 0 302.462 5.073 20 0 DKADRN CCCc1ccccc1NC(=O)N1CCC[C@@](C)(CCC)C1 ZINC000437699836 338318758 /nfs/dbraw/zinc/31/87/58/338318758.db2.gz JFKWWWHUTYVYSS-LJQANCHMSA-N 0 0 302.462 5.073 20 0 DKADRN CC[C@@H](Cc1ccccc1)N(C)C(=O)Nc1c(C)cc(C)cc1C ZINC000437699877 338318676 /nfs/dbraw/zinc/31/86/76/338318676.db2.gz RQSMPYQUQHGPDO-IBGZPJMESA-N 0 0 324.468 5.097 20 0 DKADRN CC[C@H](Cc1ccccc1)N(C)C(=O)Nc1c(C)cc(C)cc1C ZINC000437699883 338318693 /nfs/dbraw/zinc/31/86/93/338318693.db2.gz RQSMPYQUQHGPDO-LJQANCHMSA-N 0 0 324.468 5.097 20 0 DKADRN Cc1ccc(C)c(NC(=O)Nc2ccc(OC(C)(C)C)cc2)c1 ZINC000437699985 338318745 /nfs/dbraw/zinc/31/87/45/338318745.db2.gz ZVFVPCRYTGVLAV-UHFFFAOYSA-N 0 0 312.413 5.125 20 0 DKADRN CC[C@@H](Cc1ccc(C)cc1)N(C)C(=O)Nc1cc(C)ccc1C ZINC000437700153 338318650 /nfs/dbraw/zinc/31/86/50/338318650.db2.gz SCCMPXSALJGOJM-IBGZPJMESA-N 0 0 324.468 5.097 20 0 DKADRN CC[C@H](Cc1ccc(C)cc1)N(C)C(=O)Nc1cc(C)ccc1C ZINC000437700155 338318686 /nfs/dbraw/zinc/31/86/86/338318686.db2.gz SCCMPXSALJGOJM-LJQANCHMSA-N 0 0 324.468 5.097 20 0 DKADRN Cc1ccc([C@@H]2CCCCN2C(=O)Nc2cccc(C)c2)cc1 ZINC000437700993 338318793 /nfs/dbraw/zinc/31/87/93/338318793.db2.gz UXBHFACUFHQWFU-IBGZPJMESA-N 0 0 308.425 5.063 20 0 DKADRN Cc1ccc([C@H]2CCCCN2C(=O)Nc2cccc(C)c2)cc1 ZINC000437700997 338318761 /nfs/dbraw/zinc/31/87/61/338318761.db2.gz UXBHFACUFHQWFU-LJQANCHMSA-N 0 0 308.425 5.063 20 0 DKADRN Cc1cccc(NC(=O)Nc2ccc(OC(C)(C)C)cc2)c1C ZINC000437701279 338318789 /nfs/dbraw/zinc/31/87/89/338318789.db2.gz VYMOUJJUFQPGOX-UHFFFAOYSA-N 0 0 312.413 5.125 20 0 DKADRN Cc1ccc(C(C)(C)CN(C)C(=O)Nc2cc(C)ccc2C)cc1 ZINC000437703026 338318775 /nfs/dbraw/zinc/31/87/75/338318775.db2.gz OCNAARQDTVGDQP-UHFFFAOYSA-N 0 0 324.468 5.053 20 0 DKADRN CCC[C@@]1(C)CCCN(C(=O)Nc2c(C)cc(C)cc2C)C1 ZINC000437703426 338318773 /nfs/dbraw/zinc/31/87/73/338318773.db2.gz PLYDMMCZKCZVRM-IBGZPJMESA-N 0 0 302.462 5.046 20 0 DKADRN CCC[C@]1(C)CCCN(C(=O)Nc2c(C)cc(C)cc2C)C1 ZINC000437703428 338318769 /nfs/dbraw/zinc/31/87/69/338318769.db2.gz PLYDMMCZKCZVRM-LJQANCHMSA-N 0 0 302.462 5.046 20 0 DKADRN CC[C@@H](Cc1ccc(C)cc1)N(C)C(=O)Nc1cccc(C)c1C ZINC000437703760 338318806 /nfs/dbraw/zinc/31/88/06/338318806.db2.gz LZIQZJGISZGFNZ-IBGZPJMESA-N 0 0 324.468 5.097 20 0 DKADRN CC[C@H](Cc1ccc(C)cc1)N(C)C(=O)Nc1cccc(C)c1C ZINC000437703761 338318795 /nfs/dbraw/zinc/31/87/95/338318795.db2.gz LZIQZJGISZGFNZ-LJQANCHMSA-N 0 0 324.468 5.097 20 0 DKADRN CC1(C)CCCN(C(=O)Nc2cc(Cl)ccc2Cl)CC1 ZINC000437705905 338318978 /nfs/dbraw/zinc/31/89/78/338318978.db2.gz QSNQSBLABIHKDJ-UHFFFAOYSA-N 0 0 315.244 5.037 20 0 DKADRN O=C(Nc1cccc2ccccc21)N1CCC2(C1)CCCCC2 ZINC000437706437 338318891 /nfs/dbraw/zinc/31/88/91/338318891.db2.gz WWNLBNQDIWEHOQ-UHFFFAOYSA-N 0 0 308.425 5.028 20 0 DKADRN C[C@@H]1CCC[C@@H](C)N(C(=O)Nc2cc(Cl)ccc2Cl)C1 ZINC000437706923 334070442 /nfs/dbraw/zinc/07/04/42/334070442.db2.gz YGEJPKMEIQQJTN-GHMZBOCLSA-N 0 0 315.244 5.036 20 0 DKADRN C[C@@H]1CCC[C@H](C)N(C(=O)Nc2cc(Cl)ccc2Cl)C1 ZINC000437707125 334070446 /nfs/dbraw/zinc/07/04/46/334070446.db2.gz YGEJPKMEIQQJTN-MNOVXSKESA-N 0 0 315.244 5.036 20 0 DKADRN C[C@H]1CCC[C@H](C)N(C(=O)Nc2cc(Cl)ccc2Cl)C1 ZINC000437707126 334070505 /nfs/dbraw/zinc/07/05/05/334070505.db2.gz YGEJPKMEIQQJTN-QWRGUYRKSA-N 0 0 315.244 5.036 20 0 DKADRN C[C@@H]1CCC[C@H](C)CN1C(=O)Nc1cc(Cl)ccc1Cl ZINC000437707127 334070234 /nfs/dbraw/zinc/07/02/34/334070234.db2.gz YGEJPKMEIQQJTN-WDEREUQCSA-N 0 0 315.244 5.036 20 0 DKADRN CCC[C@H]1[C@H](C)CCCN1C(=O)Nc1c(C)cc(C)cc1C ZINC000437707218 338319026 /nfs/dbraw/zinc/31/90/26/338319026.db2.gz FIMUJAYCRQWTHA-PBHICJAKSA-N 0 0 302.462 5.044 20 0 DKADRN CCC[C@@H]1[C@H](C)CCCN1C(=O)Nc1c(C)cc(C)cc1C ZINC000437707220 338319065 /nfs/dbraw/zinc/31/90/65/338319065.db2.gz FIMUJAYCRQWTHA-RHSMWYFYSA-N 0 0 302.462 5.044 20 0 DKADRN CCC[C@@H]1[C@@H](C)CCCN1C(=O)Nc1c(C)cc(C)cc1C ZINC000437707222 338319030 /nfs/dbraw/zinc/31/90/30/338319030.db2.gz FIMUJAYCRQWTHA-WMLDXEAASA-N 0 0 302.462 5.044 20 0 DKADRN CCC[C@H]1[C@@H](C)CCCN1C(=O)Nc1c(C)cc(C)cc1C ZINC000437707224 338319021 /nfs/dbraw/zinc/31/90/21/338319021.db2.gz FIMUJAYCRQWTHA-YOEHRIQHSA-N 0 0 302.462 5.044 20 0 DKADRN Cc1ccc(C)c(NC(=O)N2CCC[C@H]2c2cccc(C)c2C)c1 ZINC000437707272 338318995 /nfs/dbraw/zinc/31/89/95/338318995.db2.gz ZACVHYCRXVAIGW-FQEVSTJZSA-N 0 0 322.452 5.289 20 0 DKADRN Cc1ccc(C)c(NC(=O)N2CCC[C@@H]2c2cccc(C)c2C)c1 ZINC000437707274 338319086 /nfs/dbraw/zinc/31/90/86/338319086.db2.gz ZACVHYCRXVAIGW-HXUWFJFHSA-N 0 0 322.452 5.289 20 0 DKADRN Cc1ccc(C(C)(C)CN(C)C(=O)Nc2cccc(C)c2C)cc1 ZINC000437707786 338319060 /nfs/dbraw/zinc/31/90/60/338319060.db2.gz VWMQAUKOEQRRNL-UHFFFAOYSA-N 0 0 324.468 5.053 20 0 DKADRN CC(C)(C)Oc1ccc(NC(=O)Nc2ccccc2Cl)cc1 ZINC000437707875 338319025 /nfs/dbraw/zinc/31/90/25/338319025.db2.gz KPBRNVJQQMSFFA-UHFFFAOYSA-N 0 0 318.804 5.161 20 0 DKADRN Cc1cccc(NC(=O)N2CCCC3(C2)CCCCCC3)c1C ZINC000437708563 338319013 /nfs/dbraw/zinc/31/90/13/338319013.db2.gz YAJZYFJGHSBSIL-UHFFFAOYSA-N 0 0 314.473 5.272 20 0 DKADRN Cc1ccc(NC(=O)N2CCCC[C@H]2c2ccc(C)cc2)cc1 ZINC000437709512 338319073 /nfs/dbraw/zinc/31/90/73/338319073.db2.gz PWPSFJGKOKWGAA-IBGZPJMESA-N 0 0 308.425 5.063 20 0 DKADRN Cc1ccc(NC(=O)N2CCCC[C@@H]2c2ccc(C)cc2)cc1 ZINC000437709514 338319062 /nfs/dbraw/zinc/31/90/62/338319062.db2.gz PWPSFJGKOKWGAA-LJQANCHMSA-N 0 0 308.425 5.063 20 0 DKADRN Cc1c(CSC(C)C)cccc1NC(=O)Nc1ccccc1 ZINC000437710330 338319070 /nfs/dbraw/zinc/31/90/70/338319070.db2.gz PFDKPQPRXXEOMT-UHFFFAOYSA-N 0 0 314.454 5.281 20 0 DKADRN Cc1ccc([C@@H]2CCCCN2C(=O)Nc2ccc(C)c(C)c2)cc1 ZINC000437710594 338319042 /nfs/dbraw/zinc/31/90/42/338319042.db2.gz PUTBPXQOPUJRHU-FQEVSTJZSA-N 0 0 322.452 5.371 20 0 DKADRN Cc1ccc([C@H]2CCCCN2C(=O)Nc2ccc(C)c(C)c2)cc1 ZINC000437710596 338319069 /nfs/dbraw/zinc/31/90/69/338319069.db2.gz PUTBPXQOPUJRHU-HXUWFJFHSA-N 0 0 322.452 5.371 20 0 DKADRN CC[C@@]1(C)CCCN(C(=O)Nc2cc(Cl)ccc2Cl)C1 ZINC000437711162 338319135 /nfs/dbraw/zinc/31/91/35/338319135.db2.gz XNFJTRJRQILNDE-HNNXBMFYSA-N 0 0 315.244 5.037 20 0 DKADRN CC[C@]1(C)CCCN(C(=O)Nc2cc(Cl)ccc2Cl)C1 ZINC000437711163 338319186 /nfs/dbraw/zinc/31/91/86/338319186.db2.gz XNFJTRJRQILNDE-OAHLLOKOSA-N 0 0 315.244 5.037 20 0 DKADRN Cc1ccc(NC(=O)N2CCC[C@H]2c2cccc(C)c2C)cc1C ZINC000437717982 338319237 /nfs/dbraw/zinc/31/92/37/338319237.db2.gz LKAUFIFGHAGYBB-FQEVSTJZSA-N 0 0 322.452 5.289 20 0 DKADRN Cc1ccc(NC(=O)N2CCC[C@@H]2c2cccc(C)c2C)cc1C ZINC000437717985 338319316 /nfs/dbraw/zinc/31/93/16/338319316.db2.gz LKAUFIFGHAGYBB-HXUWFJFHSA-N 0 0 322.452 5.289 20 0 DKADRN Cc1ccc(NC(=O)Nc2ccc(OC(C)(C)C)cc2)c(C)c1 ZINC000437718030 338319273 /nfs/dbraw/zinc/31/92/73/338319273.db2.gz LMLZZDSFOAJOSJ-UHFFFAOYSA-N 0 0 312.413 5.125 20 0 DKADRN CC[C@@H](Cc1ccc(C)cc1)N(CC)C(=O)Nc1ccccc1C ZINC000437718368 338319239 /nfs/dbraw/zinc/31/92/39/338319239.db2.gz CGUOXOZICHVLPA-IBGZPJMESA-N 0 0 324.468 5.179 20 0 DKADRN CC[C@H](Cc1ccc(C)cc1)N(CC)C(=O)Nc1ccccc1C ZINC000437718370 338319314 /nfs/dbraw/zinc/31/93/14/338319314.db2.gz CGUOXOZICHVLPA-LJQANCHMSA-N 0 0 324.468 5.179 20 0 DKADRN Cc1cccc(NC(=O)N2CCCC[C@H]2c2cccc(C)c2C)c1 ZINC000437721890 338319330 /nfs/dbraw/zinc/31/93/30/338319330.db2.gz UPEBCRAXQXZKFD-FQEVSTJZSA-N 0 0 322.452 5.371 20 0 DKADRN CCc1cccc(C)c1NC(=O)N(C)[C@@H](CC)Cc1ccccc1 ZINC000437721891 338319404 /nfs/dbraw/zinc/31/94/04/338319404.db2.gz IHQKMTOBVAIPAH-IBGZPJMESA-N 0 0 324.468 5.042 20 0 DKADRN Cc1cccc(NC(=O)N2CCCC[C@@H]2c2cccc(C)c2C)c1 ZINC000437721892 338319411 /nfs/dbraw/zinc/31/94/11/338319411.db2.gz UPEBCRAXQXZKFD-HXUWFJFHSA-N 0 0 322.452 5.371 20 0 DKADRN CCc1cccc(C)c1NC(=O)N(C)[C@H](CC)Cc1ccccc1 ZINC000437721893 338319400 /nfs/dbraw/zinc/31/94/00/338319400.db2.gz IHQKMTOBVAIPAH-LJQANCHMSA-N 0 0 324.468 5.042 20 0 DKADRN O=C(Nc1ccccc1Cl)N1CCCC2(C1)CCCCCC2 ZINC000437724264 338319508 /nfs/dbraw/zinc/31/95/08/338319508.db2.gz SSCFEZAIBPTMEJ-UHFFFAOYSA-N 0 0 320.864 5.308 20 0 DKADRN Cc1ccc([C@@H]2CCCCN2C(=O)Nc2ccc(C)cc2C)cc1 ZINC000437724665 338319432 /nfs/dbraw/zinc/31/94/32/338319432.db2.gz WUHVFKJGSLRIMC-FQEVSTJZSA-N 0 0 322.452 5.371 20 0 DKADRN Cc1ccc([C@H]2CCCCN2C(=O)Nc2ccc(C)cc2C)cc1 ZINC000437724666 338319465 /nfs/dbraw/zinc/31/94/65/338319465.db2.gz WUHVFKJGSLRIMC-HXUWFJFHSA-N 0 0 322.452 5.371 20 0 DKADRN Cc1ccc(NC(=O)Nc2cccc(CC(F)(F)F)c2)cc1C ZINC000437726731 338319476 /nfs/dbraw/zinc/31/94/76/338319476.db2.gz WXSXPBWRYWCALB-UHFFFAOYSA-N 0 0 322.330 5.052 20 0 DKADRN CC[C@@H](Cc1ccc(C)cc1)N(C)C(=O)Nc1ccc(C)cc1C ZINC000437728342 338319602 /nfs/dbraw/zinc/31/96/02/338319602.db2.gz NNDZXPCNSLPYCW-IBGZPJMESA-N 0 0 324.468 5.097 20 0 DKADRN CC[C@H](Cc1ccc(C)cc1)N(C)C(=O)Nc1ccc(C)cc1C ZINC000437728344 338319535 /nfs/dbraw/zinc/31/95/35/338319535.db2.gz NNDZXPCNSLPYCW-LJQANCHMSA-N 0 0 324.468 5.097 20 0 DKADRN Cc1ccc(NC(=O)N2CCCC[C@H]2c2cccc(C)c2C)cc1 ZINC000437729137 338319604 /nfs/dbraw/zinc/31/96/04/338319604.db2.gz PUKCXZDGAIPSBE-FQEVSTJZSA-N 0 0 322.452 5.371 20 0 DKADRN Cc1ccc(NC(=O)N2CCCC[C@@H]2c2cccc(C)c2C)cc1 ZINC000437729138 338319567 /nfs/dbraw/zinc/31/95/67/338319567.db2.gz PUKCXZDGAIPSBE-HXUWFJFHSA-N 0 0 322.452 5.371 20 0 DKADRN Cc1ccc([C@@H]2CCCCN2C(=O)Nc2cc(C)ccc2C)cc1 ZINC000437729494 338319552 /nfs/dbraw/zinc/31/95/52/338319552.db2.gz QCIAVEOAJAMJKM-FQEVSTJZSA-N 0 0 322.452 5.371 20 0 DKADRN Cc1ccc([C@H]2CCCCN2C(=O)Nc2cc(C)ccc2C)cc1 ZINC000437729495 338319615 /nfs/dbraw/zinc/31/96/15/338319615.db2.gz QCIAVEOAJAMJKM-HXUWFJFHSA-N 0 0 322.452 5.371 20 0 DKADRN CCc1ccc(CC)c(NC(=O)c2sccc2C(C)C)c1 ZINC000437752818 338320079 /nfs/dbraw/zinc/32/00/79/338320079.db2.gz NFMQEYRVONLWBE-UHFFFAOYSA-N 0 0 301.455 5.249 20 0 DKADRN CC[C@H](C)Sc1ccc(NC(=O)N(C)CCC2CC2)c(C)c1 ZINC000437772133 338320714 /nfs/dbraw/zinc/32/07/14/338320714.db2.gz JBMFZUNCVSAFTO-AWEZNQCLSA-N 0 0 320.502 5.149 20 0 DKADRN CC[C@@H](C)Sc1ccc(NC(=O)N(C)CCC2CC2)c(C)c1 ZINC000437772135 338320739 /nfs/dbraw/zinc/32/07/39/338320739.db2.gz JBMFZUNCVSAFTO-CQSZACIVSA-N 0 0 320.502 5.149 20 0 DKADRN CC(C)(C)C[C@H](N[C@@H]1CCC[C@H](C(F)(F)F)C1)C(F)(F)F ZINC000437788702 338321547 /nfs/dbraw/zinc/32/15/47/338321547.db2.gz UMLASTQEONSOTC-AXFHLTTASA-N 0 0 319.333 5.064 20 0 DKADRN CC(C)(C)C[C@H](N[C@H]1CCC[C@H](C(F)(F)F)C1)C(F)(F)F ZINC000437788703 338321598 /nfs/dbraw/zinc/32/15/98/338321598.db2.gz UMLASTQEONSOTC-DCAQKATOSA-N 0 0 319.333 5.064 20 0 DKADRN CC(C)(C)C[C@H](N[C@@H]1CCC[C@@H](C(F)(F)F)C1)C(F)(F)F ZINC000437788704 338321583 /nfs/dbraw/zinc/32/15/83/338321583.db2.gz UMLASTQEONSOTC-MXWKQRLJSA-N 0 0 319.333 5.064 20 0 DKADRN CC(C)(C)C[C@H](N[C@H]1CCC[C@@H](C(F)(F)F)C1)C(F)(F)F ZINC000437788705 334074591 /nfs/dbraw/zinc/07/45/91/334074591.db2.gz UMLASTQEONSOTC-VWYCJHECSA-N 0 0 319.333 5.064 20 0 DKADRN Cc1cccc(C)c1Oc1ccccc1NC(=O)N(C)C1CCC1 ZINC000437829113 338322689 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338325303 /nfs/dbraw/zinc/32/53/03/338325303.db2.gz SOPOICMSVLWQAM-OAHLLOKOSA-N 0 0 307.503 5.108 20 0 DKADRN Cc1cccc(C)c1NC(=O)CCCSCCC(C)(C)C ZINC000437926569 338325400 /nfs/dbraw/zinc/32/54/00/338325400.db2.gz LMZMYDCHZROJFF-UHFFFAOYSA-N 0 0 307.503 5.192 20 0 DKADRN CC(C)(C)CCSCc1nnc(-c2ccccc2Cl)o1 ZINC000437927683 338325434 /nfs/dbraw/zinc/32/54/34/338325434.db2.gz ODXCJFGWUNNBCP-UHFFFAOYSA-N 0 0 310.850 5.059 20 0 DKADRN Cc1cc(C)c(NC(=O)CSCCC(C)(C)C)c(Cl)c1 ZINC000437928192 338325485 /nfs/dbraw/zinc/32/54/85/338325485.db2.gz RMBXCGHYAOYORY-UHFFFAOYSA-N 0 0 313.894 5.065 20 0 DKADRN CC(C)c1ccc(NC(=O)N2C[C@@H]3[C@H](C2)C3(C)C)c(C(C)C)c1 ZINC000437929381 338325423 /nfs/dbraw/zinc/32/54/23/338325423.db2.gz BTHNBGFBOWOSQS-CALCHBBNSA-N 0 0 314.473 5.053 20 0 DKADRN CC(C)c1ccc(NC(=O)N2CCC(C)(C)C2)c(C(C)C)c1 ZINC000437932382 338325578 /nfs/dbraw/zinc/32/55/78/338325578.db2.gz ZJSDJIGNZWNWIU-UHFFFAOYSA-N 0 0 302.462 5.197 20 0 DKADRN CC(C)c1ccc(NC(=O)N2C[C@H](C)[C@H](C)C2)c(C(C)C)c1 ZINC000437936784 338325679 /nfs/dbraw/zinc/32/56/79/338325679.db2.gz UVNHRFOGHQIMGO-GASCZTMLSA-N 0 0 302.462 5.053 20 0 DKADRN CC(C)c1ccc(NC(=O)N2C[C@H](C)[C@@H](C)C2)c(C(C)C)c1 ZINC000437936789 338325669 /nfs/dbraw/zinc/32/56/69/338325669.db2.gz UVNHRFOGHQIMGO-GJZGRUSLSA-N 0 0 302.462 5.053 20 0 DKADRN CC(C)c1ccc(NC(=O)N2C[C@@H](C)[C@H](C)C2)c(C(C)C)c1 ZINC000437936794 338325716 /nfs/dbraw/zinc/32/57/16/338325716.db2.gz UVNHRFOGHQIMGO-HUUCEWRRSA-N 0 0 302.462 5.053 20 0 DKADRN CC(C)c1cccc(C(C)C)c1NC(=O)CSCCC1CC1 ZINC000437942324 338325803 /nfs/dbraw/zinc/32/58/03/338325803.db2.gz PLYXNBVTEUOJMN-UHFFFAOYSA-N 0 0 319.514 5.405 20 0 DKADRN C[C@H](Sc1ccccc1)c1ccc(NC(=O)c2ccco2)cc1 ZINC000437963069 338326634 /nfs/dbraw/zinc/32/66/34/338326634.db2.gz NJICRALYBGCJIC-AWEZNQCLSA-N 0 0 323.417 5.385 20 0 DKADRN C[C@@H](Sc1ccccc1)c1ccc(NC(=O)c2ccco2)cc1 ZINC000437963071 338326641 /nfs/dbraw/zinc/32/66/41/338326641.db2.gz NJICRALYBGCJIC-CQSZACIVSA-N 0 0 323.417 5.385 20 0 DKADRN C[C@H](Sc1ccccc1)c1ccc(NC(=O)c2ccoc2)cc1 ZINC000437976273 338327027 /nfs/dbraw/zinc/32/70/27/338327027.db2.gz JLVDUIKCGDUUCL-AWEZNQCLSA-N 0 0 323.417 5.385 20 0 DKADRN C[C@@H](Sc1ccccc1)c1ccc(NC(=O)c2ccoc2)cc1 ZINC000437976274 338327009 /nfs/dbraw/zinc/32/70/09/338327009.db2.gz JLVDUIKCGDUUCL-CQSZACIVSA-N 0 0 323.417 5.385 20 0 DKADRN CCCCCN(C(=O)Nc1ccc(CCSC)cc1)C(C)C ZINC000437977445 338327153 /nfs/dbraw/zinc/32/71/53/338327153.db2.gz RVKSOEJZVLOWSU-UHFFFAOYSA-N 0 0 322.518 5.025 20 0 DKADRN C[C@H](Oc1ccccc1NC(=O)C1=CCCCC1)c1ccccc1 ZINC000438014490 338328161 /nfs/dbraw/zinc/32/81/61/338328161.db2.gz UZFROLLTRJNZRP-INIZCTEOSA-N 0 0 321.420 5.266 20 0 DKADRN C[C@@H](Oc1ccccc1NC(=O)C1=CCCCC1)c1ccccc1 ZINC000438014493 338328184 /nfs/dbraw/zinc/32/81/84/338328184.db2.gz UZFROLLTRJNZRP-MRXNPFEDSA-N 0 0 321.420 5.266 20 0 DKADRN O=C(c1cccc(C(F)F)c1)N(CC1CCC1)c1ccccc1 ZINC000438036752 338328724 /nfs/dbraw/zinc/32/87/24/338328724.db2.gz PBQXNBKDLGTANU-UHFFFAOYSA-N 0 0 315.363 5.071 20 0 DKADRN 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5.004 20 0 DKADRN CC1=C(C(=O)N2CCC[C@@H]2c2cccc3ccccc32)CCC1 ZINC000438056924 338329288 /nfs/dbraw/zinc/32/92/88/338329288.db2.gz NURUUCQHEDGNNX-HXUWFJFHSA-N 0 0 305.421 5.004 20 0 DKADRN CSCCc1ccc(NCc2ccc3nc(C)ccc3c2)cc1 ZINC000438075252 338329976 /nfs/dbraw/zinc/32/99/76/338329976.db2.gz ATXZQOIMKWVCDB-UHFFFAOYSA-N 0 0 322.477 5.061 20 0 DKADRN CSCCc1ccc(N[C@@H]2CCC[C@H](C(F)(F)F)C2)cc1 ZINC000438075825 338330031 /nfs/dbraw/zinc/33/00/31/338330031.db2.gz GRZSDZTZHPEOIV-DZGCQCFKSA-N 0 0 317.420 5.125 20 0 DKADRN CSCCc1ccc(N[C@H]2CCC[C@@H](C(F)(F)F)C2)cc1 ZINC000438075828 338330055 /nfs/dbraw/zinc/33/00/55/338330055.db2.gz GRZSDZTZHPEOIV-HIFRSBDPSA-N 0 0 317.420 5.125 20 0 DKADRN CSCCc1ccc(N[C@@H]2CCC[C@@H](C(F)(F)F)C2)cc1 ZINC000438075829 338330058 /nfs/dbraw/zinc/33/00/58/338330058.db2.gz GRZSDZTZHPEOIV-UKRRQHHQSA-N 0 0 317.420 5.125 20 0 DKADRN CSCCc1ccc(N[C@H]2CCC[C@H](C(F)(F)F)C2)cc1 ZINC000438075831 338330072 /nfs/dbraw/zinc/33/00/72/338330072.db2.gz GRZSDZTZHPEOIV-ZFWWWQNUSA-N 0 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NKUUEVYFDCVZPQ-QFIPXVFZSA-N 0 0 321.530 5.116 20 0 DKADRN Cc1ncc(-c2ccc(NCc3ccc(Cl)cc3F)cc2)o1 ZINC000438081148 338330256 /nfs/dbraw/zinc/33/02/56/338330256.db2.gz NSPHYOXLQZABPO-UHFFFAOYSA-N 0 0 316.763 5.055 20 0 DKADRN Cc1coc(-c2cccc(NCc3ccc(Cl)cc3F)c2)n1 ZINC000438081854 338330302 /nfs/dbraw/zinc/33/03/02/338330302.db2.gz PRHZZBSVIBZSGZ-UHFFFAOYSA-N 0 0 316.763 5.055 20 0 DKADRN CSCc1ccc(NCc2ccc3nc(C)ccc3c2)cc1 ZINC000438084578 338330477 /nfs/dbraw/zinc/33/04/77/338330477.db2.gz YTKYVTGLBGSDGM-UHFFFAOYSA-N 0 0 308.450 5.018 20 0 DKADRN CC(C)C(=O)Nc1ccc(N[C@@H]2CC[C@H](c3ccccc3)C2)cc1 ZINC000438084924 338330593 /nfs/dbraw/zinc/33/05/93/338330593.db2.gz LCPXCLKHWOPBNF-FXAWDEMLSA-N 0 0 322.452 5.029 20 0 DKADRN CC(C)C(=O)Nc1ccc(N[C@H]2CC[C@H](c3ccccc3)C2)cc1 ZINC000438084925 338330536 /nfs/dbraw/zinc/33/05/36/338330536.db2.gz LCPXCLKHWOPBNF-PXNSSMCTSA-N 0 0 322.452 5.029 20 0 DKADRN CC(C)C(=O)Nc1ccc(N[C@H]2CC[C@@H](c3ccccc3)C2)cc1 ZINC000438084926 338330486 /nfs/dbraw/zinc/33/04/86/338330486.db2.gz LCPXCLKHWOPBNF-XLIONFOSSA-N 0 0 322.452 5.029 20 0 DKADRN CC(C)C(=O)Nc1ccc(N[C@@H]2CC[C@@H](c3ccccc3)C2)cc1 ZINC000438084927 338330509 /nfs/dbraw/zinc/33/05/09/338330509.db2.gz LCPXCLKHWOPBNF-YLJYHZDGSA-N 0 0 322.452 5.029 20 0 DKADRN Cc1ccc(NCc2ccc(Cl)cc2F)cc1-c1ncco1 ZINC000438085394 338330572 /nfs/dbraw/zinc/33/05/72/338330572.db2.gz NPYRSTOGYYCNAB-UHFFFAOYSA-N 0 0 316.763 5.055 20 0 DKADRN Cc1cnc(-c2cccc(NCc3ccc(Cl)cc3F)c2)o1 ZINC000438088672 338330756 /nfs/dbraw/zinc/33/07/56/338330756.db2.gz LCMQVHORNVAGHD-UHFFFAOYSA-N 0 0 316.763 5.055 20 0 DKADRN Cc1ccc(-c2ncco2)cc1N[C@H]1CCC[C@H](C(F)(F)F)C1 ZINC000438089303 338330755 /nfs/dbraw/zinc/33/07/55/338330755.db2.gz PDUGYIFZYOUYHA-KBPBESRZSA-N 0 0 324.346 5.183 20 0 DKADRN Cc1ccc(-c2ncco2)cc1N[C@H]1CCC[C@@H](C(F)(F)F)C1 ZINC000438089304 338330826 /nfs/dbraw/zinc/33/08/26/338330826.db2.gz PDUGYIFZYOUYHA-KGLIPLIRSA-N 0 0 324.346 5.183 20 0 DKADRN Cc1ccc(-c2ncco2)cc1N[C@@H]1CCC[C@H](C(F)(F)F)C1 ZINC000438089305 338330796 /nfs/dbraw/zinc/33/07/96/338330796.db2.gz PDUGYIFZYOUYHA-UONOGXRCSA-N 0 0 324.346 5.183 20 0 DKADRN Cc1ccc(-c2ncco2)cc1N[C@@H]1CCC[C@@H](C(F)(F)F)C1 ZINC000438089306 338330830 /nfs/dbraw/zinc/33/08/30/338330830.db2.gz PDUGYIFZYOUYHA-ZIAGYGMSSA-N 0 0 324.346 5.183 20 0 DKADRN CC(C)C(=O)Nc1cccc(N[C@@H]2CC[C@H](c3ccccc3)C2)c1 ZINC000438108945 338332319 /nfs/dbraw/zinc/33/23/19/338332319.db2.gz ZESLWWBIJOEYFI-FXAWDEMLSA-N 0 0 322.452 5.029 20 0 DKADRN CC(C)C(=O)Nc1cccc(N[C@H]2CC[C@H](c3ccccc3)C2)c1 ZINC000438108946 338332289 /nfs/dbraw/zinc/33/22/89/338332289.db2.gz ZESLWWBIJOEYFI-PXNSSMCTSA-N 0 0 322.452 5.029 20 0 DKADRN CC(C)C(=O)Nc1cccc(N[C@H]2CC[C@@H](c3ccccc3)C2)c1 ZINC000438108947 338332283 /nfs/dbraw/zinc/33/22/83/338332283.db2.gz ZESLWWBIJOEYFI-XLIONFOSSA-N 0 0 322.452 5.029 20 0 DKADRN CC(C)C(=O)Nc1cccc(N[C@@H]2CC[C@@H](c3ccccc3)C2)c1 ZINC000438108948 338332228 /nfs/dbraw/zinc/33/22/28/338332228.db2.gz ZESLWWBIJOEYFI-YLJYHZDGSA-N 0 0 322.452 5.029 20 0 DKADRN CC(C)OCc1cccc(NCc2ccc(Cl)cc2F)c1 ZINC000438113348 338332673 /nfs/dbraw/zinc/33/26/73/338332673.db2.gz BAASYPKFPHFCOB-UHFFFAOYSA-N 0 0 307.796 5.016 20 0 DKADRN CC(C)OCc1ccc(NCc2ccc(Cl)cc2F)cc1 ZINC000438113577 338332634 /nfs/dbraw/zinc/33/26/34/338332634.db2.gz BOPJISIHCLQJCM-UHFFFAOYSA-N 0 0 307.796 5.016 20 0 DKADRN CC(C)OCc1ccc(N[C@@H]2CCC[C@@H](C(F)(F)F)C2)cc1 ZINC000438114248 338332635 /nfs/dbraw/zinc/33/26/35/338332635.db2.gz DPLYJHYHXIHVKK-GDBMZVCRSA-N 0 0 315.379 5.145 20 0 DKADRN CC(C)OCc1ccc(N[C@@H]2CCC[C@H](C(F)(F)F)C2)cc1 ZINC000438114249 338332627 /nfs/dbraw/zinc/33/26/27/338332627.db2.gz DPLYJHYHXIHVKK-GOEBONIOSA-N 0 0 315.379 5.145 20 0 DKADRN CC(C)OCc1ccc(N[C@H]2CCC[C@H](C(F)(F)F)C2)cc1 ZINC000438114250 338332538 /nfs/dbraw/zinc/33/25/38/338332538.db2.gz DPLYJHYHXIHVKK-HOCLYGCPSA-N 0 0 315.379 5.145 20 0 DKADRN CC(C)OCc1ccc(N[C@H]2CCC[C@@H](C(F)(F)F)C2)cc1 ZINC000438114251 338332557 /nfs/dbraw/zinc/33/25/57/338332557.db2.gz DPLYJHYHXIHVKK-ZBFHGGJFSA-N 0 0 315.379 5.145 20 0 DKADRN CC(C)OCc1cccc(N[C@@H]2CCC[C@@H](C(F)(F)F)C2)c1 ZINC000438120162 338333331 /nfs/dbraw/zinc/33/33/31/338333331.db2.gz QZIXKJREVWLCBH-GDBMZVCRSA-N 0 0 315.379 5.145 20 0 DKADRN CC(C)OCc1cccc(N[C@@H]2CCC[C@H](C(F)(F)F)C2)c1 ZINC000438120164 338333219 /nfs/dbraw/zinc/33/32/19/338333219.db2.gz QZIXKJREVWLCBH-GOEBONIOSA-N 0 0 315.379 5.145 20 0 DKADRN CC(C)OCc1cccc(N[C@H]2CCC[C@H](C(F)(F)F)C2)c1 ZINC000438120166 338333127 /nfs/dbraw/zinc/33/31/27/338333127.db2.gz QZIXKJREVWLCBH-HOCLYGCPSA-N 0 0 315.379 5.145 20 0 DKADRN CC(C)OCc1cccc(N[C@H]2CCC[C@@H](C(F)(F)F)C2)c1 ZINC000438120168 338333154 /nfs/dbraw/zinc/33/31/54/338333154.db2.gz QZIXKJREVWLCBH-ZBFHGGJFSA-N 0 0 315.379 5.145 20 0 DKADRN CCCCCN(C(=O)Nc1cc(F)ccc1OC(C)C)C(C)C ZINC000438122914 338333379 /nfs/dbraw/zinc/33/33/79/338333379.db2.gz CHTQVDVNQBVYHR-UHFFFAOYSA-N 0 0 324.440 5.045 20 0 DKADRN O=C(NCCCCC1CCCC1)Nc1cccc(C(F)F)c1 ZINC000438125420 338333691 /nfs/dbraw/zinc/33/36/91/338333691.db2.gz IFKIHHCFZZZSFZ-UHFFFAOYSA-N 0 0 310.388 5.106 20 0 DKADRN CCC[C@@]1(C)CCCN(C(=O)Nc2cccc(C(F)F)c2)C1 ZINC000438132331 338333910 /nfs/dbraw/zinc/33/39/10/338333910.db2.gz YZJYGIKFPMNYBW-KRWDZBQOSA-N 0 0 310.388 5.058 20 0 DKADRN CCC[C@]1(C)CCCN(C(=O)Nc2cccc(C(F)F)c2)C1 ZINC000438132332 338334014 /nfs/dbraw/zinc/33/40/14/338334014.db2.gz YZJYGIKFPMNYBW-QGZVFWFLSA-N 0 0 310.388 5.058 20 0 DKADRN CCC[C@H]1[C@H](C)CCCN1C(=O)Nc1cccc(C(F)F)c1 ZINC000438141426 338334052 /nfs/dbraw/zinc/33/40/52/338334052.db2.gz JYQPESSIROJJBR-DOMZBBRYSA-N 0 0 310.388 5.057 20 0 DKADRN CCC[C@@H]1[C@H](C)CCCN1C(=O)Nc1cccc(C(F)F)c1 ZINC000438141428 338334111 /nfs/dbraw/zinc/33/41/11/338334111.db2.gz JYQPESSIROJJBR-IUODEOHRSA-N 0 0 310.388 5.057 20 0 DKADRN CCC[C@@H]1[C@@H](C)CCCN1C(=O)Nc1cccc(C(F)F)c1 ZINC000438141429 338334065 /nfs/dbraw/zinc/33/40/65/338334065.db2.gz JYQPESSIROJJBR-SWLSCSKDSA-N 0 0 310.388 5.057 20 0 DKADRN CCC[C@H]1[C@@H](C)CCCN1C(=O)Nc1cccc(C(F)F)c1 ZINC000438141431 338334096 /nfs/dbraw/zinc/33/40/96/338334096.db2.gz JYQPESSIROJJBR-WFASDCNBSA-N 0 0 310.388 5.057 20 0 DKADRN CCCCCN(C(=O)Nc1cccc(SCC)c1)C(C)C ZINC000438153588 338334382 /nfs/dbraw/zinc/33/43/82/338334382.db2.gz BWKKWPWRDFHFRO-UHFFFAOYSA-N 0 0 308.491 5.231 20 0 DKADRN CC[C@H](C)Sc1ccc(NC(=O)N2CCC(C)(C)C2)c(C)c1 ZINC000438178175 338335127 /nfs/dbraw/zinc/33/51/27/338335127.db2.gz LZEHJXYGKWQQAC-AWEZNQCLSA-N 0 0 320.502 5.149 20 0 DKADRN CC[C@@H](C)Sc1ccc(NC(=O)N2CCC(C)(C)C2)c(C)c1 ZINC000438178176 338335105 /nfs/dbraw/zinc/33/51/05/338335105.db2.gz LZEHJXYGKWQQAC-CQSZACIVSA-N 0 0 320.502 5.149 20 0 DKADRN CCCCCN(C(=O)Nc1ccc(OC(C)C)cc1F)C(C)C ZINC000438183864 338335459 /nfs/dbraw/zinc/33/54/59/338335459.db2.gz WQXVUJOYLCQREL-UHFFFAOYSA-N 0 0 324.440 5.045 20 0 DKADRN FC(F)(F)[C@@H]1CCC[C@H](Nc2ccc3nc(C4CC4)oc3c2)C1 ZINC000438204165 338336432 /nfs/dbraw/zinc/33/64/32/338336432.db2.gz XVZPXTDXIPLFBB-NEPJUHHUSA-N 0 0 324.346 5.238 20 0 DKADRN FC(F)(F)[C@H]1CCC[C@@H](Nc2ccc3nc(C4CC4)oc3c2)C1 ZINC000438204167 338336442 /nfs/dbraw/zinc/33/64/42/338336442.db2.gz XVZPXTDXIPLFBB-NWDGAFQWSA-N 0 0 324.346 5.238 20 0 DKADRN FC(F)(F)[C@H]1CCC[C@H](Nc2ccc3nc(C4CC4)oc3c2)C1 ZINC000438204169 338336419 /nfs/dbraw/zinc/33/64/19/338336419.db2.gz XVZPXTDXIPLFBB-RYUDHWBXSA-N 0 0 324.346 5.238 20 0 DKADRN FC(F)(F)[C@@H]1CCC[C@@H](Nc2ccc3nc(C4CC4)oc3c2)C1 ZINC000438204170 338336382 /nfs/dbraw/zinc/33/63/82/338336382.db2.gz XVZPXTDXIPLFBB-VXGBXAGGSA-N 0 0 324.346 5.238 20 0 DKADRN CC[C@H](C)Sc1ccc(NC(=O)N2C[C@@H](C)[C@H](C)C2)c(C)c1 ZINC000438217915 338337129 /nfs/dbraw/zinc/33/71/29/338337129.db2.gz UAWGZARKUXEEBE-KFWWJZLASA-N 0 0 320.502 5.005 20 0 DKADRN CC[C@H](C)Sc1ccc(NC(=O)N2C[C@H](C)[C@@H](C)C2)c(C)c1 ZINC000438217917 338337134 /nfs/dbraw/zinc/33/71/34/338337134.db2.gz UAWGZARKUXEEBE-KKUMJFAQSA-N 0 0 320.502 5.005 20 0 DKADRN CC[C@@H](C)Sc1ccc(NC(=O)N2C[C@H](C)[C@H](C)C2)c(C)c1 ZINC000438217919 338337037 /nfs/dbraw/zinc/33/70/37/338337037.db2.gz UAWGZARKUXEEBE-QLFBSQMISA-N 0 0 320.502 5.005 20 0 DKADRN CC[C@H](C)Sc1ccc(NC(=O)N2C[C@H](C)[C@H](C)C2)c(C)c1 ZINC000438217921 338337081 /nfs/dbraw/zinc/33/70/81/338337081.db2.gz UAWGZARKUXEEBE-ZNMIVQPWSA-N 0 0 320.502 5.005 20 0 DKADRN CCCCCN(C(=O)Nc1ccc(COC(C)C)cc1)C(C)C ZINC000438224329 338337189 /nfs/dbraw/zinc/33/71/89/338337189.db2.gz JYOYISGLEQRXAZ-UHFFFAOYSA-N 0 0 320.477 5.044 20 0 DKADRN CCCCCN(C(=O)Nc1cccc(COC(C)C)c1)C(C)C ZINC000438228274 338337422 /nfs/dbraw/zinc/33/74/22/338337422.db2.gz GHYPOCPKYCSODB-UHFFFAOYSA-N 0 0 320.477 5.044 20 0 DKADRN CCCN(CC)C(=O)Nc1cccc(Cl)c1SC(C)C ZINC000438236681 338337559 /nfs/dbraw/zinc/33/75/59/338337559.db2.gz HSYOMYCQPMIGEX-UHFFFAOYSA-N 0 0 314.882 5.104 20 0 DKADRN Cc1ccccc1CNc1ccccc1NC(=O)C1=CCCCC1 ZINC000438253347 338338013 /nfs/dbraw/zinc/33/80/13/338338013.db2.gz AKOPNKNZZZNGIN-UHFFFAOYSA-N 0 0 320.436 5.046 20 0 DKADRN CCN(C(=O)Nc1cccc(Cl)c1SC(C)C)C(C)C ZINC000438255507 338337933 /nfs/dbraw/zinc/33/79/33/338337933.db2.gz ICQDSTFLDSFZPV-UHFFFAOYSA-N 0 0 314.882 5.103 20 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CCc1ccccc1CNc1ccc(C)c(NC(=O)C(C)(C)C)c1 ZINC000438301974 338338982 /nfs/dbraw/zinc/33/89/82/338338982.db2.gz KXFBFHZPFSGTIG-UHFFFAOYSA-N 0 0 324.468 5.154 20 0 DKADRN c1csc(-c2ccccc2OCc2cc3ccccc3o2)n1 ZINC000438307545 338339080 /nfs/dbraw/zinc/33/90/80/338339080.db2.gz SFKCKCOJFHVFGK-UHFFFAOYSA-N 0 0 307.374 5.135 20 0 DKADRN CCO[C@H](C)c1nc(CSCc2ccccc2CC)cs1 ZINC000438307875 338339121 /nfs/dbraw/zinc/33/91/21/338339121.db2.gz ULLQEEMFODYOJT-CYBMUJFWSA-N 0 0 321.511 5.236 20 0 DKADRN CCO[C@@H](C)c1nc(CSCc2ccccc2CC)cs1 ZINC000438307876 338339067 /nfs/dbraw/zinc/33/90/67/338339067.db2.gz ULLQEEMFODYOJT-ZDUSSCGKSA-N 0 0 321.511 5.236 20 0 DKADRN Clc1sccc1NCc1ncc(-c2ccccc2)s1 ZINC000438308294 338339248 /nfs/dbraw/zinc/33/92/48/338339248.db2.gz VQSXSYGCGYYUNS-UHFFFAOYSA-N 0 0 306.843 5.137 20 0 DKADRN Clc1sccc1NCc1cnc(-c2ccccc2)s1 ZINC000438315317 338339365 /nfs/dbraw/zinc/33/93/65/338339365.db2.gz BMBZWMMEQFYCQU-UHFFFAOYSA-N 0 0 306.843 5.137 20 0 DKADRN FC(F)c1ccc(COc2ccccc2-c2nccs2)cc1 ZINC000438322586 338339618 /nfs/dbraw/zinc/33/96/18/338339618.db2.gz BKZCFEWVFQWKOW-UHFFFAOYSA-N 0 0 317.360 5.327 20 0 DKADRN C[C@@H](N(C)C(=O)Nc1ccccc1-c1cccs1)C1(C)CC1 ZINC000438344897 338340592 /nfs/dbraw/zinc/34/05/92/338340592.db2.gz JSDSYQLVLXINPZ-CYBMUJFWSA-N 0 0 314.454 5.067 20 0 DKADRN C[C@H](N(C)C(=O)Nc1ccccc1-c1cccs1)C1(C)CC1 ZINC000438344898 338340536 /nfs/dbraw/zinc/34/05/36/338340536.db2.gz JSDSYQLVLXINPZ-ZDUSSCGKSA-N 0 0 314.454 5.067 20 0 DKADRN CCSCc1cccc(NC(=O)N(C)C2CCCCCC2)c1 ZINC000438361412 338341382 /nfs/dbraw/zinc/34/13/82/338341382.db2.gz FNVWBYUZCOYWCP-UHFFFAOYSA-N 0 0 320.502 5.126 20 0 DKADRN CCN(C(=O)Nc1ccc(OC(C)(C)C)cc1)C1CCCCC1 ZINC000438369254 338341654 /nfs/dbraw/zinc/34/16/54/338341654.db2.gz FYWMUEOCIYYFGP-UHFFFAOYSA-N 0 0 318.461 5.050 20 0 DKADRN Clc1sccc1NCc1cccc(-c2cccnc2)c1 ZINC000438370706 338341875 /nfs/dbraw/zinc/34/18/75/338341875.db2.gz HXTRSFLETCEKMN-UHFFFAOYSA-N 0 0 300.814 5.076 20 0 DKADRN Clc1sccc1NCc1c[nH]nc1-c1ccc(Cl)cc1 ZINC000438370771 338341823 /nfs/dbraw/zinc/34/18/23/338341823.db2.gz IDGNTYSEYBMGOG-UHFFFAOYSA-N 0 0 324.236 5.057 20 0 DKADRN Clc1sccc1NCc1cnc(-c2ccsc2)s1 ZINC000438370960 338341887 /nfs/dbraw/zinc/34/18/87/338341887.db2.gz KZCOFYRZOFACND-UHFFFAOYSA-N 0 0 312.872 5.199 20 0 DKADRN Clc1sccc1NCc1cnc(-c2cccs2)s1 ZINC000438371982 338341791 /nfs/dbraw/zinc/34/17/91/338341791.db2.gz NNICXVMZCMVYJH-UHFFFAOYSA-N 0 0 312.872 5.199 20 0 DKADRN Fc1cc(-c2ccncc2)ccc1CNc1ccsc1Cl ZINC000438372590 338341838 /nfs/dbraw/zinc/34/18/38/338341838.db2.gz MGOQASJMUFIJJT-UHFFFAOYSA-N 0 0 318.804 5.215 20 0 DKADRN CN(C(=O)Nc1ccc(OC(C)(C)C)cc1)C1CCCCCC1 ZINC000438372786 338342003 /nfs/dbraw/zinc/34/20/03/338342003.db2.gz DQIUSVVWUAJLDR-UHFFFAOYSA-N 0 0 318.461 5.050 20 0 DKADRN CC[C@H]1CCCCCN1C(=O)Nc1ccc(OC(C)(C)C)cc1 ZINC000438373681 338342022 /nfs/dbraw/zinc/34/20/22/338342022.db2.gz PVMPWFLGTMKTED-INIZCTEOSA-N 0 0 318.461 5.050 20 0 DKADRN CC[C@@H]1CCCCCN1C(=O)Nc1ccc(OC(C)(C)C)cc1 ZINC000438373682 338341941 /nfs/dbraw/zinc/34/19/41/338341941.db2.gz PVMPWFLGTMKTED-MRXNPFEDSA-N 0 0 318.461 5.050 20 0 DKADRN Clc1sccc1NCc1csc(-c2cccs2)n1 ZINC000438375060 338341924 /nfs/dbraw/zinc/34/19/24/338341924.db2.gz SPMJDFQIISVVSS-UHFFFAOYSA-N 0 0 312.872 5.199 20 0 DKADRN CC(C)CN(CC(C)C)C(=O)Nc1ccc(OC(C)(C)C)cc1 ZINC000438375648 334108820 /nfs/dbraw/zinc/10/88/20/334108820.db2.gz NJSDMQIUMGTEKS-UHFFFAOYSA-N 0 0 320.477 5.010 20 0 DKADRN Cc1ccc(-c2ncc(CNc3ccsc3Cl)s2)o1 ZINC000438376961 338342102 /nfs/dbraw/zinc/34/21/02/338342102.db2.gz TWVXPXHYQJAMIE-UHFFFAOYSA-N 0 0 310.831 5.039 20 0 DKADRN Clc1sccc1NCc1cccc(-c2ccncc2)c1 ZINC000438377084 338342075 /nfs/dbraw/zinc/34/20/75/338342075.db2.gz UFDUXLBGAOEGMJ-UHFFFAOYSA-N 0 0 300.814 5.076 20 0 DKADRN CCSCc1cccc(NC(=O)N(CC)C2CCCCC2)c1 ZINC000438377810 338342059 /nfs/dbraw/zinc/34/20/59/338342059.db2.gz MOPBIPAIZIDTCZ-UHFFFAOYSA-N 0 0 320.502 5.126 20 0 DKADRN Clc1sccc1NCc1cccc(-c2ccccn2)c1 ZINC000438377949 338342135 /nfs/dbraw/zinc/34/21/35/338342135.db2.gz VPCZMLYTSZJSSL-UHFFFAOYSA-N 0 0 300.814 5.076 20 0 DKADRN CCSCc1cccc(NC(=O)N2CCCCC[C@@H]2CC)c1 ZINC000438383426 338342396 /nfs/dbraw/zinc/34/23/96/338342396.db2.gz FBJKWLVQSMWKHH-KRWDZBQOSA-N 0 0 320.502 5.126 20 0 DKADRN CCSCc1cccc(NC(=O)N2CCCCC[C@H]2CC)c1 ZINC000438383428 338342300 /nfs/dbraw/zinc/34/23/00/338342300.db2.gz FBJKWLVQSMWKHH-QGZVFWFLSA-N 0 0 320.502 5.126 20 0 DKADRN CCSCc1cccc(NC(=O)Nc2cccc(C)c2C)c1 ZINC000438386281 338342407 /nfs/dbraw/zinc/34/24/07/338342407.db2.gz HEBGUCMIWKXYCI-UHFFFAOYSA-N 0 0 314.454 5.201 20 0 DKADRN CCCCCN(C(=O)Nc1cccc(CSCC)c1)C(C)C ZINC000438388949 338342480 /nfs/dbraw/zinc/34/24/80/338342480.db2.gz CVBULRDUHWAFNB-UHFFFAOYSA-N 0 0 322.518 5.372 20 0 DKADRN CCSCc1cccc(NC(=O)N(CC(C)C)CC(C)C)c1 ZINC000438396741 338342681 /nfs/dbraw/zinc/34/26/81/338342681.db2.gz LKTRISNWEKDJOB-UHFFFAOYSA-N 0 0 322.518 5.086 20 0 DKADRN Cc1cccc(NC(=O)Nc2ccc(OC(C)C)c(C)c2)c1C ZINC000438429606 338343391 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ZINC000438440378 338343541 /nfs/dbraw/zinc/34/35/41/338343541.db2.gz DCVWXROLPYNREL-UHFFFAOYSA-N 0 0 320.502 5.043 20 0 DKADRN CCN(CC(C)C)C(=O)Nc1cccc(CSC(C)C)c1C ZINC000438445074 338343788 /nfs/dbraw/zinc/34/37/88/338343788.db2.gz BIFGISMMKKAMNN-UHFFFAOYSA-N 0 0 322.518 5.146 20 0 DKADRN CCCC(C)(C)NC(=O)Nc1cccc(CSC(C)C)c1C ZINC000438445441 338343799 /nfs/dbraw/zinc/34/37/99/338343799.db2.gz CDORTEDRAKEXQY-UHFFFAOYSA-N 0 0 322.518 5.337 20 0 DKADRN CC[C@H]1CCCN1C(=O)Nc1cccc(CSC(C)C)c1C ZINC000438445530 338343832 /nfs/dbraw/zinc/34/38/32/338343832.db2.gz QATITYIXELINIR-INIZCTEOSA-N 0 0 320.502 5.043 20 0 DKADRN CC[C@@H]1CCCN1C(=O)Nc1cccc(CSC(C)C)c1C ZINC000438445532 338343747 /nfs/dbraw/zinc/34/37/47/338343747.db2.gz QATITYIXELINIR-MRXNPFEDSA-N 0 0 320.502 5.043 20 0 DKADRN Cc1c(CSC(C)C)cccc1NC(=O)NC1CCCCC1 ZINC000438449799 338343915 /nfs/dbraw/zinc/34/39/15/338343915.db2.gz DCGVVSAZPOKPFL-UHFFFAOYSA-N 0 0 320.502 5.091 20 0 DKADRN Cc1c(CSC(C)C)cccc1NC(=O)N(C)[C@@H](C)C(C)C ZINC000438458493 338344311 /nfs/dbraw/zinc/34/43/11/338344311.db2.gz HYXNDLAZVZMJFO-HNNXBMFYSA-N 0 0 322.518 5.145 20 0 DKADRN Cc1c(CSC(C)C)cccc1NC(=O)N(C)[C@H](C)C(C)C ZINC000438458494 338344284 /nfs/dbraw/zinc/34/42/84/338344284.db2.gz HYXNDLAZVZMJFO-OAHLLOKOSA-N 0 0 322.518 5.145 20 0 DKADRN CCCCN(CC)C(=O)Nc1cccc(CSC(C)C)c1C ZINC000438458597 338344263 /nfs/dbraw/zinc/34/42/63/338344263.db2.gz WIOSPMXAMIUCIQ-UHFFFAOYSA-N 0 0 322.518 5.291 20 0 DKADRN CCCN(CCC)C(=O)Nc1cccc(CSC(C)C)c1C ZINC000438458675 338344313 /nfs/dbraw/zinc/34/43/13/338344313.db2.gz WPYQZTZKFRWXIJ-UHFFFAOYSA-N 0 0 322.518 5.291 20 0 DKADRN CCC[C@H](C)N(C)C(=O)Nc1cccc(CSC(C)C)c1C ZINC000438461955 338344355 /nfs/dbraw/zinc/34/43/55/338344355.db2.gz RNPYVXRLCMOTCY-AWEZNQCLSA-N 0 0 322.518 5.289 20 0 DKADRN CCC[C@@H](C)N(C)C(=O)Nc1cccc(CSC(C)C)c1C ZINC000438461956 338344362 /nfs/dbraw/zinc/34/43/62/338344362.db2.gz RNPYVXRLCMOTCY-CQSZACIVSA-N 0 0 322.518 5.289 20 0 DKADRN Cc1c(CSC(C)C)cccc1NC(=O)NCCC(C)(C)C ZINC000438464331 338344553 /nfs/dbraw/zinc/34/45/53/338344553.db2.gz GXQMJPZSOXWWFF-UHFFFAOYSA-N 0 0 322.518 5.194 20 0 DKADRN Cc1c(CSC(C)C)cccc1NC(=O)NC1(C)CCCC1 ZINC000438465312 338344688 /nfs/dbraw/zinc/34/46/88/338344688.db2.gz JWKSABDFFRZSRC-UHFFFAOYSA-N 0 0 320.502 5.091 20 0 DKADRN Cc1c(CSC(C)C)cccc1NC(=O)N(C)CC(C)(C)C ZINC000438470032 338344944 /nfs/dbraw/zinc/34/49/44/338344944.db2.gz YDRNULTWALGSPM-UHFFFAOYSA-N 0 0 322.518 5.146 20 0 DKADRN Cc1c(CSC(C)C)cccc1NC(=O)NC[C@H](C)C(C)C ZINC000438479585 338345547 /nfs/dbraw/zinc/34/55/47/338345547.db2.gz SNFJWDKOCKQPPQ-AWEZNQCLSA-N 0 0 322.518 5.050 20 0 DKADRN Cc1c(CSC(C)C)cccc1NC(=O)NC[C@@H](C)C(C)C ZINC000438479588 334118094 /nfs/dbraw/zinc/11/80/94/334118094.db2.gz SNFJWDKOCKQPPQ-CQSZACIVSA-N 0 0 322.518 5.050 20 0 DKADRN Cc1ccc2cc(CNc3cccc(C(C)(F)F)c3)ccc2n1 ZINC000438539321 338347381 /nfs/dbraw/zinc/34/73/81/338347381.db2.gz HMMGYKFLZOXTOV-UHFFFAOYSA-N 0 0 312.363 5.267 20 0 DKADRN CC(C)(CCC(=O)Nc1ccsc1Cl)c1ccccc1 ZINC000438552195 338347824 /nfs/dbraw/zinc/34/78/24/338347824.db2.gz KBRWYMOPDAECCS-UHFFFAOYSA-N 0 0 307.846 5.098 20 0 DKADRN Cc1ccc(C(C)(C)CC(=O)Nc2ccsc2Cl)cc1 ZINC000438557322 338348031 /nfs/dbraw/zinc/34/80/31/338348031.db2.gz KIYZZWIOVBTDRP-UHFFFAOYSA-N 0 0 307.846 5.016 20 0 DKADRN CC(C)C[C@@H](C(=O)Nc1ccsc1Cl)c1ccccc1 ZINC000438557845 338348056 /nfs/dbraw/zinc/34/80/56/338348056.db2.gz MZDLBJQFIKNJOV-CYBMUJFWSA-N 0 0 307.846 5.170 20 0 DKADRN CC(C)C[C@H](C(=O)Nc1ccsc1Cl)c1ccccc1 ZINC000438557848 338348074 /nfs/dbraw/zinc/34/80/74/338348074.db2.gz MZDLBJQFIKNJOV-ZDUSSCGKSA-N 0 0 307.846 5.170 20 0 DKADRN Cc1cc2occ(C(=O)Nc3ccsc3Cl)c2cc1C ZINC000438559642 338348141 /nfs/dbraw/zinc/34/81/41/338348141.db2.gz RVCLPSDTYOTOOO-UHFFFAOYSA-N 0 0 305.786 5.017 20 0 DKADRN O=C(Nc1ccsc1Cl)C1CCC(c2ccccc2)CC1 ZINC000438560303 338348148 /nfs/dbraw/zinc/34/81/48/338348148.db2.gz WGNANUVOISELPG-UHFFFAOYSA-N 0 0 319.857 5.314 20 0 DKADRN O=C(CCCCCc1cccs1)Nc1ccsc1Cl ZINC000438560987 338348229 /nfs/dbraw/zinc/34/82/29/338348229.db2.gz IUPWKMOIZMYZCW-UHFFFAOYSA-N 0 0 313.875 5.205 20 0 DKADRN O=C(CCc1ccc2ccccc2c1)Nc1ccsc1Cl ZINC000438561151 334128437 /nfs/dbraw/zinc/12/84/37/334128437.db2.gz JVSFZOXTOMJHIR-UHFFFAOYSA-N 0 0 315.825 5.126 20 0 DKADRN Cc1ccc(-c2ccc(C(=O)Nc3ccsc3Cl)s2)o1 ZINC000438566823 338348461 /nfs/dbraw/zinc/34/84/61/338348461.db2.gz KZCWUAJUGSHFEX-UHFFFAOYSA-N 0 0 323.826 5.284 20 0 DKADRN Cc1cc(CCCC(=O)Nc2ccsc2Cl)c(C)s1 ZINC000438567891 338348449 /nfs/dbraw/zinc/34/84/49/338348449.db2.gz ONMABGNTGYHNMU-UHFFFAOYSA-N 0 0 313.875 5.041 20 0 DKADRN CC(C)[C@@H](CC(=O)Nc1ccsc1Cl)c1ccccc1 ZINC000438568753 338348515 /nfs/dbraw/zinc/34/85/15/338348515.db2.gz KRNAKCZPMQLGDC-CYBMUJFWSA-N 0 0 307.846 5.170 20 0 DKADRN CC(C)[C@H](CC(=O)Nc1ccsc1Cl)c1ccccc1 ZINC000438568755 338348514 /nfs/dbraw/zinc/34/85/14/338348514.db2.gz KRNAKCZPMQLGDC-ZDUSSCGKSA-N 0 0 307.846 5.170 20 0 DKADRN Cc1cc2cc(C(=O)Nc3ccsc3Cl)oc2cc1C ZINC000438569403 338348525 /nfs/dbraw/zinc/34/85/25/338348525.db2.gz SEBYUDUDHVQVOF-UHFFFAOYSA-N 0 0 305.786 5.017 20 0 DKADRN CCC(CC)(C(=O)Nc1ccsc1Cl)c1ccccc1 ZINC000438569496 338348580 /nfs/dbraw/zinc/34/85/80/338348580.db2.gz SPPOCOWVDLYZCG-UHFFFAOYSA-N 0 0 307.846 5.098 20 0 DKADRN CC[C@@H](C)[C@@H](C(=O)Nc1ccsc1Cl)c1ccccc1 ZINC000438571105 338348624 /nfs/dbraw/zinc/34/86/24/338348624.db2.gz UOTRTYVHUZMHKO-BXUZGUMPSA-N 0 0 307.846 5.170 20 0 DKADRN CC[C@H](C)[C@H](C(=O)Nc1ccsc1Cl)c1ccccc1 ZINC000438571106 338348690 /nfs/dbraw/zinc/34/86/90/338348690.db2.gz UOTRTYVHUZMHKO-FZMZJTMJSA-N 0 0 307.846 5.170 20 0 DKADRN CC[C@@H](C)[C@H](C(=O)Nc1ccsc1Cl)c1ccccc1 ZINC000438571107 338348629 /nfs/dbraw/zinc/34/86/29/338348629.db2.gz UOTRTYVHUZMHKO-RISCZKNCSA-N 0 0 307.846 5.170 20 0 DKADRN CC[C@H](C)[C@@H](C(=O)Nc1ccsc1Cl)c1ccccc1 ZINC000438571108 338348645 /nfs/dbraw/zinc/34/86/45/338348645.db2.gz UOTRTYVHUZMHKO-SMDDNHRTSA-N 0 0 307.846 5.170 20 0 DKADRN Cc1c(C(=O)Nc2ccsc2Cl)oc2c1c(C)ccc2C ZINC000438571864 338348650 /nfs/dbraw/zinc/34/86/50/338348650.db2.gz WWCGVPMLOSZWKF-UHFFFAOYSA-N 0 0 319.813 5.325 20 0 DKADRN O=C(CCCc1ccc(Cl)cc1)Nc1ccsc1Cl ZINC000438574319 338348320 /nfs/dbraw/zinc/34/83/20/338348320.db2.gz CUQBHTFHRRNDDO-UHFFFAOYSA-N 0 0 314.237 5.016 20 0 DKADRN C[C@@H](C(=O)Nc1ccsc1Cl)c1ccc2ccccc2c1 ZINC000438574537 338348800 /nfs/dbraw/zinc/34/88/00/338348800.db2.gz VNFUVKMDTXIWMW-LLVKDONJSA-N 0 0 315.825 5.297 20 0 DKADRN C[C@H](C(=O)Nc1ccsc1Cl)c1ccc2ccccc2c1 ZINC000438574539 338348733 /nfs/dbraw/zinc/34/87/33/338348733.db2.gz VNFUVKMDTXIWMW-NSHDSACASA-N 0 0 315.825 5.297 20 0 DKADRN C[C@@H](N(C)C(=O)Nc1cccc(-c2cccs2)c1)C1(C)CC1 ZINC000438574870 338348761 /nfs/dbraw/zinc/34/87/61/338348761.db2.gz HBCWJPNUNDKTOU-CYBMUJFWSA-N 0 0 314.454 5.067 20 0 DKADRN C[C@H](N(C)C(=O)Nc1cccc(-c2cccs2)c1)C1(C)CC1 ZINC000438574871 338348758 /nfs/dbraw/zinc/34/87/58/338348758.db2.gz HBCWJPNUNDKTOU-ZDUSSCGKSA-N 0 0 314.454 5.067 20 0 DKADRN Cc1cc(C)cc(NC(=O)Nc2ccccc2CC(F)(F)F)c1 ZINC000438632104 338350388 /nfs/dbraw/zinc/35/03/88/338350388.db2.gz SRRVXVBDZGHZJO-UHFFFAOYSA-N 0 0 322.330 5.052 20 0 DKADRN CC(C)(C)c1ncc(/C=C\c2nc(C3CCCCC3)no2)s1 ZINC000438731352 338351329 /nfs/dbraw/zinc/35/13/29/338351329.db2.gz BPPMXGCHHGIAPZ-KTKRTIGZSA-N 0 0 317.458 5.042 20 0 DKADRN CC(C)(C)c1ncc(/C=C/c2nc(C3CCCCC3)no2)s1 ZINC000438731356 338351351 /nfs/dbraw/zinc/35/13/51/338351351.db2.gz BPPMXGCHHGIAPZ-MDZDMXLPSA-N 0 0 317.458 5.042 20 0 DKADRN CC[C@@H](C)c1cc(-c2nc(-c3cccc4ccccc43)no2)on1 ZINC000438742747 338351431 /nfs/dbraw/zinc/35/14/31/338351431.db2.gz FAXLYBHPFZVAPQ-GFCCVEGCSA-N 0 0 319.364 5.058 20 0 DKADRN CC[C@H](C)c1cc(-c2nc(-c3cccc4ccccc43)no2)on1 ZINC000438742748 338351477 /nfs/dbraw/zinc/35/14/77/338351477.db2.gz FAXLYBHPFZVAPQ-LBPRGKRZSA-N 0 0 319.364 5.058 20 0 DKADRN C[C@H](Cc1nc(C2CCCC2)no1)c1ccccc1C(F)(F)F ZINC000438743876 338351544 /nfs/dbraw/zinc/35/15/44/338351544.db2.gz KEDPDAQJZYJANU-LLVKDONJSA-N 0 0 324.346 5.092 20 0 DKADRN C[C@@H](Cc1nc(C2CCCC2)no1)c1ccccc1C(F)(F)F ZINC000438743877 338351535 /nfs/dbraw/zinc/35/15/35/338351535.db2.gz KEDPDAQJZYJANU-NSHDSACASA-N 0 0 324.346 5.092 20 0 DKADRN C/C(=C/c1nc(C2CCCC2)no1)c1cccc(C(F)(F)F)c1 ZINC000438745757 338351571 /nfs/dbraw/zinc/35/15/71/338351571.db2.gz NNIDLYVSJHAWRI-LUAWRHEFSA-N 0 0 322.330 5.307 20 0 DKADRN C/C(=C\c1nc(C2CCCC2)no1)c1cccc(C(F)(F)F)c1 ZINC000438745758 338351605 /nfs/dbraw/zinc/35/16/05/338351605.db2.gz NNIDLYVSJHAWRI-PKNBQFBNSA-N 0 0 322.330 5.307 20 0 DKADRN c1cc2cccc(-c3nc(-c4cccc5ccccc54)no3)c2[nH]1 ZINC000438746493 338351606 /nfs/dbraw/zinc/35/16/06/338351606.db2.gz UYWWLNAIQLTPBQ-UHFFFAOYSA-N 0 0 311.344 5.038 20 0 DKADRN Clc1cc(Cl)cc([C@@H]2C[C@@H]2c2nc(C3CCCC3)no2)c1 ZINC000438747480 334140826 /nfs/dbraw/zinc/14/08/26/334140826.db2.gz NFTYEXFEYNUBNS-KBPBESRZSA-N 0 0 323.223 5.305 20 0 DKADRN Clc1cc(Cl)cc([C@H]2C[C@@H]2c2nc(C3CCCC3)no2)c1 ZINC000438747483 334140817 /nfs/dbraw/zinc/14/08/17/334140817.db2.gz NFTYEXFEYNUBNS-KGLIPLIRSA-N 0 0 323.223 5.305 20 0 DKADRN Clc1cc(Cl)cc([C@@H]2C[C@H]2c2nc(C3CCCC3)no2)c1 ZINC000438747490 334140813 /nfs/dbraw/zinc/14/08/13/334140813.db2.gz NFTYEXFEYNUBNS-UONOGXRCSA-N 0 0 323.223 5.305 20 0 DKADRN Clc1cc(Cl)cc([C@H]2C[C@H]2c2nc(C3CCCC3)no2)c1 ZINC000438747492 334140816 /nfs/dbraw/zinc/14/08/16/334140816.db2.gz NFTYEXFEYNUBNS-ZIAGYGMSSA-N 0 0 323.223 5.305 20 0 DKADRN C[C@H](c1nc(-c2ccc(-c3ccccc3)cc2)no1)C(F)(F)F ZINC000438748778 338351680 /nfs/dbraw/zinc/35/16/80/338351680.db2.gz SKGSBJDSQAMMEC-LLVKDONJSA-N 0 0 318.298 5.069 20 0 DKADRN C[C@@H](c1nc(-c2ccc(-c3ccccc3)cc2)no1)C(F)(F)F ZINC000438748785 338351726 /nfs/dbraw/zinc/35/17/26/338351726.db2.gz SKGSBJDSQAMMEC-NSHDSACASA-N 0 0 318.298 5.069 20 0 DKADRN CC/C(=C\c1nc(-c2ccccc2OC)no1)c1ccc(C)cc1 ZINC000438751194 338351704 /nfs/dbraw/zinc/35/17/04/338351704.db2.gz HZIOMXBDYJSGSQ-FYWRMAATSA-N 0 0 320.392 5.004 20 0 DKADRN CC/C(=C/c1nc(-c2ccccc2OC)no1)c1ccc(C)cc1 ZINC000438751195 338351653 /nfs/dbraw/zinc/35/16/53/338351653.db2.gz HZIOMXBDYJSGSQ-SQFISAMPSA-N 0 0 320.392 5.004 20 0 DKADRN CCC(C)(CC)NC(=O)Nc1cccc(COC(C)(C)C)c1C ZINC000438751835 338351687 /nfs/dbraw/zinc/35/16/87/338351687.db2.gz DWLUJMIGARNHMX-UHFFFAOYSA-N 0 0 320.477 5.010 20 0 DKADRN C/C(=C/c1nc(C2CCCC2)no1)c1ccccc1C(F)(F)F ZINC000438752753 338351719 /nfs/dbraw/zinc/35/17/19/338351719.db2.gz LVXFLPFKEKRSTB-KHPPLWFESA-N 0 0 322.330 5.307 20 0 DKADRN C/C(=C\c1nc(C2CCCC2)no1)c1ccccc1C(F)(F)F ZINC000438752754 338351686 /nfs/dbraw/zinc/35/16/86/338351686.db2.gz LVXFLPFKEKRSTB-ZHACJKMWSA-N 0 0 322.330 5.307 20 0 DKADRN CCc1ccc(CC)c(NC(=O)N(C)[C@@H](C)c2ccccc2)c1 ZINC000438759138 338351844 /nfs/dbraw/zinc/35/18/44/338351844.db2.gz RACZJXKZKSATBE-HNNXBMFYSA-N 0 0 310.441 5.036 20 0 DKADRN CCc1ccc(CC)c(NC(=O)N(C)[C@H](C)c2ccccc2)c1 ZINC000438759139 338351760 /nfs/dbraw/zinc/35/17/60/338351760.db2.gz RACZJXKZKSATBE-OAHLLOKOSA-N 0 0 310.441 5.036 20 0 DKADRN CCc1ccc(CC)c(NC(=O)N(C)[C@H](C)c2cccs2)c1 ZINC000438760554 338351816 /nfs/dbraw/zinc/35/18/16/338351816.db2.gz XDYRMFFQYOVJEV-CYBMUJFWSA-N 0 0 316.470 5.098 20 0 DKADRN CCc1ccc(CC)c(NC(=O)N(C)[C@@H](C)c2cccs2)c1 ZINC000438760555 338351825 /nfs/dbraw/zinc/35/18/25/338351825.db2.gz XDYRMFFQYOVJEV-ZDUSSCGKSA-N 0 0 316.470 5.098 20 0 DKADRN CCOCCCS[C@@H](C)c1ccc2cc(OC)ccc2c1 ZINC000438783730 338352096 /nfs/dbraw/zinc/35/20/96/338352096.db2.gz DVPDXMQILKQZPZ-AWEZNQCLSA-N 0 0 304.455 5.069 20 0 DKADRN CCOCCCS[C@H](C)c1ccc2cc(OC)ccc2c1 ZINC000438783731 338352046 /nfs/dbraw/zinc/35/20/46/338352046.db2.gz DVPDXMQILKQZPZ-CQSZACIVSA-N 0 0 304.455 5.069 20 0 DKADRN COc1ccc2cc([C@H](C)SCCc3ccccn3)ccc2c1 ZINC000438791577 338352168 /nfs/dbraw/zinc/35/21/68/338352168.db2.gz KNUUFQRCFGBYQW-HNNXBMFYSA-N 0 0 323.461 5.280 20 0 DKADRN COc1ccc2cc([C@@H](C)SCCc3ccccn3)ccc2c1 ZINC000438791578 338352199 /nfs/dbraw/zinc/35/21/99/338352199.db2.gz KNUUFQRCFGBYQW-OAHLLOKOSA-N 0 0 323.461 5.280 20 0 DKADRN COc1ccc2cc([C@H](C)SCCOCC3CC3)ccc2c1 ZINC000438796114 338352147 /nfs/dbraw/zinc/35/21/47/338352147.db2.gz WYYYZFJGGTYDNI-AWEZNQCLSA-N 0 0 316.466 5.069 20 0 DKADRN COc1ccc2cc([C@@H](C)SCCOCC3CC3)ccc2c1 ZINC000438796115 338352129 /nfs/dbraw/zinc/35/21/29/338352129.db2.gz WYYYZFJGGTYDNI-CQSZACIVSA-N 0 0 316.466 5.069 20 0 DKADRN COc1ccc2cc([C@H](C)SCCOC(C)C)ccc2c1 ZINC000438798206 338352212 /nfs/dbraw/zinc/35/22/12/338352212.db2.gz CJOCLYVVAILQBE-AWEZNQCLSA-N 0 0 304.455 5.068 20 0 DKADRN COc1ccc2cc([C@@H](C)SCCOC(C)C)ccc2c1 ZINC000438798207 338352246 /nfs/dbraw/zinc/35/22/46/338352246.db2.gz CJOCLYVVAILQBE-CQSZACIVSA-N 0 0 304.455 5.068 20 0 DKADRN COc1ccc2cc([C@@H](C)SCc3cc(C)on3)ccc2c1 ZINC000438799616 338352362 /nfs/dbraw/zinc/35/23/62/338352362.db2.gz IQSAAPJBOWNPMO-CYBMUJFWSA-N 0 0 313.422 5.139 20 0 DKADRN COc1ccc2cc([C@H](C)SCc3cc(C)on3)ccc2c1 ZINC000438799617 338352354 /nfs/dbraw/zinc/35/23/54/338352354.db2.gz IQSAAPJBOWNPMO-ZDUSSCGKSA-N 0 0 313.422 5.139 20 0 DKADRN c1ccc(Oc2cccc(-c3noc([C@@H]4CCCS4)n3)c2)cc1 ZINC000438823052 338352583 /nfs/dbraw/zinc/35/25/83/338352583.db2.gz XQHAOXHONNUMJN-INIZCTEOSA-N 0 0 324.405 5.097 20 0 DKADRN c1ccc(Oc2cccc(-c3noc([C@H]4CCCS4)n3)c2)cc1 ZINC000438823054 338352525 /nfs/dbraw/zinc/35/25/25/338352525.db2.gz XQHAOXHONNUMJN-MRXNPFEDSA-N 0 0 324.405 5.097 20 0 DKADRN Fc1ccc2sc(-c3cccc(-c4ccncc4)c3)nc2c1 ZINC000438826607 338352721 /nfs/dbraw/zinc/35/27/21/338352721.db2.gz NVSGSGAVIBBYOZ-UHFFFAOYSA-N 0 0 306.365 5.164 20 0 DKADRN CC(C)NC(=O)Nc1ccc([C@H](C)Sc2ccccc2)cc1 ZINC000438854555 338354085 /nfs/dbraw/zinc/35/40/85/338354085.db2.gz RYDUQDPHKZFAMG-AWEZNQCLSA-N 0 0 314.454 5.070 20 0 DKADRN CC(C)NC(=O)Nc1ccc([C@@H](C)Sc2ccccc2)cc1 ZINC000438854556 338354026 /nfs/dbraw/zinc/35/40/26/338354026.db2.gz RYDUQDPHKZFAMG-CQSZACIVSA-N 0 0 314.454 5.070 20 0 DKADRN CCc1ccc(CC)c(NC(=O)N2CCC[C@H]2c2ccccc2)c1 ZINC000438865588 338354266 /nfs/dbraw/zinc/35/42/66/338354266.db2.gz RMSVHNLEMKOMBG-FQEVSTJZSA-N 0 0 322.452 5.180 20 0 DKADRN CCc1ccc(CC)c(NC(=O)N2CCC[C@@H]2c2ccccc2)c1 ZINC000438865589 338354308 /nfs/dbraw/zinc/35/43/08/338354308.db2.gz RMSVHNLEMKOMBG-HXUWFJFHSA-N 0 0 322.452 5.180 20 0 DKADRN CCC(C)(C)NC(=O)Nc1cccc(COC(C)(C)CC)c1C ZINC000438866000 338354322 /nfs/dbraw/zinc/35/43/22/338354322.db2.gz ICOQQSLXEIVDQM-UHFFFAOYSA-N 0 0 320.477 5.010 20 0 DKADRN Cc1ccsc1CCCC(=O)Nc1c(C)cccc1C(C)C ZINC000438928026 338356216 /nfs/dbraw/zinc/35/62/16/338356216.db2.gz RSNQBABLUIQMND-UHFFFAOYSA-N 0 0 315.482 5.450 20 0 DKADRN CCC(C)(C)OCc1ccccc1NC(=O)C(C)(C)C(C)C ZINC000438944408 338356801 /nfs/dbraw/zinc/35/68/01/338356801.db2.gz BRLZVVLOOVAWLO-UHFFFAOYSA-N 0 0 305.462 5.013 20 0 DKADRN CSc1c(F)cccc1C(=O)Nc1ccccc1C(C)(C)C ZINC000438993978 338357888 /nfs/dbraw/zinc/35/78/88/338357888.db2.gz YCAPGEFJFGJNSJ-UHFFFAOYSA-N 0 0 317.429 5.097 20 0 DKADRN C[C@H](Sc1ccccc1)c1ccc(NC(=O)c2cc[nH]c2)cc1 ZINC000439014007 338358452 /nfs/dbraw/zinc/35/84/52/338358452.db2.gz FYCHXLNVRDSQCK-AWEZNQCLSA-N 0 0 322.433 5.120 20 0 DKADRN C[C@@H](Sc1ccccc1)c1ccc(NC(=O)c2cc[nH]c2)cc1 ZINC000439014009 338358507 /nfs/dbraw/zinc/35/85/07/338358507.db2.gz FYCHXLNVRDSQCK-CQSZACIVSA-N 0 0 322.433 5.120 20 0 DKADRN Cc1oc(-c2cccs2)nc1CSC[C@@H](C)C(F)(F)F ZINC000439021061 338358650 /nfs/dbraw/zinc/35/86/50/338358650.db2.gz BHWPFTAGAIVHQI-MRVPVSSYSA-N 0 0 321.389 5.143 20 0 DKADRN Cc1oc(-c2cccs2)nc1CSC[C@H](C)C(F)(F)F ZINC000439021062 338358620 /nfs/dbraw/zinc/35/86/20/338358620.db2.gz BHWPFTAGAIVHQI-QMMMGPOBSA-N 0 0 321.389 5.143 20 0 DKADRN Cc1ccc(-c2nc(CSC[C@@H](C)C(F)(F)F)cs2)o1 ZINC000439023271 338358694 /nfs/dbraw/zinc/35/86/94/338358694.db2.gz WCQFRHKKSJTPSK-MRVPVSSYSA-N 0 0 321.389 5.143 20 0 DKADRN Cc1ccc(-c2nc(CSC[C@H](C)C(F)(F)F)cs2)o1 ZINC000439023272 338358727 /nfs/dbraw/zinc/35/87/27/338358727.db2.gz WCQFRHKKSJTPSK-QMMMGPOBSA-N 0 0 321.389 5.143 20 0 DKADRN Cc1oc(-c2ccsc2)nc1CSC[C@@H](C)C(F)(F)F ZINC000439023430 338358662 /nfs/dbraw/zinc/35/86/62/338358662.db2.gz QLODMINZSYOPJS-MRVPVSSYSA-N 0 0 321.389 5.143 20 0 DKADRN Cc1oc(-c2ccsc2)nc1CSC[C@H](C)C(F)(F)F ZINC000439023431 338358664 /nfs/dbraw/zinc/35/86/64/338358664.db2.gz QLODMINZSYOPJS-QMMMGPOBSA-N 0 0 321.389 5.143 20 0 DKADRN Cc1ccc(-c2nc(CSC[C@@H](C)C(F)(F)F)co2)cc1 ZINC000439025136 338358775 /nfs/dbraw/zinc/35/87/75/338358775.db2.gz HOSFEBXGVSSGNK-LLVKDONJSA-N 0 0 315.360 5.082 20 0 DKADRN Cc1ccc(-c2nc(CSC[C@H](C)C(F)(F)F)co2)cc1 ZINC000439025138 338358816 /nfs/dbraw/zinc/35/88/16/338358816.db2.gz HOSFEBXGVSSGNK-NSHDSACASA-N 0 0 315.360 5.082 20 0 DKADRN C[C@H](CSCc1csc(-c2cccs2)n1)C(F)(F)F ZINC000439028864 338358929 /nfs/dbraw/zinc/35/89/29/338358929.db2.gz SUAKVURHDRDUQG-MRVPVSSYSA-N 0 0 323.430 5.303 20 0 DKADRN C[C@@H](CSCc1csc(-c2cccs2)n1)C(F)(F)F ZINC000439028865 338358901 /nfs/dbraw/zinc/35/89/01/338358901.db2.gz SUAKVURHDRDUQG-QMMMGPOBSA-N 0 0 323.430 5.303 20 0 DKADRN C[C@H](CSCc1csc(C2CCCC2)n1)C(F)(F)F ZINC000439029174 338358898 /nfs/dbraw/zinc/35/88/98/338358898.db2.gz VEGYRNYGKSAJEV-SECBINFHSA-N 0 0 309.422 5.232 20 0 DKADRN C[C@@H](CSCc1csc(C2CCCC2)n1)C(F)(F)F ZINC000439029185 338358974 /nfs/dbraw/zinc/35/89/74/338358974.db2.gz VEGYRNYGKSAJEV-VIFPVBQESA-N 0 0 309.422 5.232 20 0 DKADRN C[C@H](CSCc1csc(-c2ccsc2)n1)C(F)(F)F ZINC000439030350 338359044 /nfs/dbraw/zinc/35/90/44/338359044.db2.gz ZOKVPXVSJRJICV-MRVPVSSYSA-N 0 0 323.430 5.303 20 0 DKADRN C[C@@H](CSCc1csc(-c2ccsc2)n1)C(F)(F)F ZINC000439030351 338359040 /nfs/dbraw/zinc/35/90/40/338359040.db2.gz ZOKVPXVSJRJICV-QMMMGPOBSA-N 0 0 323.430 5.303 20 0 DKADRN Cc1ccc(-c2cnc(CSC[C@@H](C)C(F)(F)F)o2)cc1 ZINC000439032785 338359180 /nfs/dbraw/zinc/35/91/80/338359180.db2.gz HXEALAFFALCCAN-LLVKDONJSA-N 0 0 315.360 5.082 20 0 DKADRN Cc1ccc(-c2cnc(CSC[C@H](C)C(F)(F)F)o2)cc1 ZINC000439032786 338359150 /nfs/dbraw/zinc/35/91/50/338359150.db2.gz HXEALAFFALCCAN-NSHDSACASA-N 0 0 315.360 5.082 20 0 DKADRN C[C@@H](SC[C@@H](C)C(F)(F)F)c1ncc(-c2ccccc2)o1 ZINC000439034058 338359149 /nfs/dbraw/zinc/35/91/49/338359149.db2.gz PIFRGSKQQBAKSQ-GHMZBOCLSA-N 0 0 315.360 5.334 20 0 DKADRN C[C@H](CS[C@@H](C)c1ncc(-c2ccccc2)o1)C(F)(F)F ZINC000439034059 338359114 /nfs/dbraw/zinc/35/91/14/338359114.db2.gz PIFRGSKQQBAKSQ-MNOVXSKESA-N 0 0 315.360 5.334 20 0 DKADRN C[C@@H](CS[C@@H](C)c1ncc(-c2ccccc2)o1)C(F)(F)F ZINC000439034060 338359184 /nfs/dbraw/zinc/35/91/84/338359184.db2.gz PIFRGSKQQBAKSQ-QWRGUYRKSA-N 0 0 315.360 5.334 20 0 DKADRN C[C@@H](CS[C@H](C)c1ncc(-c2ccccc2)o1)C(F)(F)F ZINC000439034061 338359131 /nfs/dbraw/zinc/35/91/31/338359131.db2.gz PIFRGSKQQBAKSQ-WDEREUQCSA-N 0 0 315.360 5.334 20 0 DKADRN Cc1oc(-c2ccccc2)nc1CSC[C@H](C)C(F)(F)F ZINC000439053721 338359673 /nfs/dbraw/zinc/35/96/73/338359673.db2.gz HJVLONOYCDISQN-JTQLQIEISA-N 0 0 315.360 5.082 20 0 DKADRN Cc1oc(-c2ccccc2)nc1CSC[C@@H](C)C(F)(F)F ZINC000439053722 338359686 /nfs/dbraw/zinc/35/96/86/338359686.db2.gz HJVLONOYCDISQN-SNVBAGLBSA-N 0 0 315.360 5.082 20 0 DKADRN Cc1ccsc1CCCC(=O)Nc1ccccc1C(C)C ZINC000439070637 338360234 /nfs/dbraw/zinc/36/02/34/338360234.db2.gz WNOYQFUARXAOTN-UHFFFAOYSA-N 0 0 301.455 5.141 20 0 DKADRN Cc1cscc1NC(=O)Nc1ccc(Cl)c(Cl)c1 ZINC000439120709 338361642 /nfs/dbraw/zinc/36/16/42/338361642.db2.gz SIRJYHDIRXCNPG-UHFFFAOYSA-N 0 0 301.198 5.007 20 0 DKADRN CCc1cccc(CC)c1NC(=O)CCCc1sccc1C ZINC000439122480 338361666 /nfs/dbraw/zinc/36/16/66/338361666.db2.gz YPDJDCQAAUXKSR-UHFFFAOYSA-N 0 0 315.482 5.143 20 0 DKADRN CC(C)c1cnc(-c2ccc(NC(=O)C(C)(C)C(C)C)cc2)o1 ZINC000439123387 338361608 /nfs/dbraw/zinc/36/16/08/338361608.db2.gz KQGHEIVEAGCUIT-UHFFFAOYSA-N 0 0 314.429 5.086 20 0 DKADRN CSc1c(F)cccc1C(=O)Nc1c(C)c(C)ccc1Cl ZINC000439138539 338362188 /nfs/dbraw/zinc/36/21/88/338362188.db2.gz KDPALHARSXADIQ-UHFFFAOYSA-N 0 0 323.820 5.070 20 0 DKADRN Cc1cscc1NC(=O)c1cccc(Oc2ccccc2)c1 ZINC000439164919 338363050 /nfs/dbraw/zinc/36/30/50/338363050.db2.gz DBBUBJBMYOVJFM-UHFFFAOYSA-N 0 0 309.390 5.101 20 0 DKADRN Cc1cscc1NC(=O)CCCc1csc2ccccc12 ZINC000439167762 338363092 /nfs/dbraw/zinc/36/30/92/338363092.db2.gz JPUADHPUQPNYEE-UHFFFAOYSA-N 0 0 315.463 5.233 20 0 DKADRN Cc1cscc1NC(=O)c1ccc(OC2CCCCC2)cc1 ZINC000439172992 338363248 /nfs/dbraw/zinc/36/32/48/338363248.db2.gz WNMUCYZLEQDLTE-UHFFFAOYSA-N 0 0 315.438 5.020 20 0 DKADRN Cc1cscc1NC(=O)CC(c1ccccc1)c1ccccc1 ZINC000439175894 338363348 /nfs/dbraw/zinc/36/33/48/338363348.db2.gz JAKBGPGXXXQPSV-UHFFFAOYSA-N 0 0 321.445 5.217 20 0 DKADRN Cc1cscc1NC(=O)c1cccc(OC2CCCCC2)c1 ZINC000439176537 338363347 /nfs/dbraw/zinc/36/33/47/338363347.db2.gz ARNJJTWXWJVGJE-UHFFFAOYSA-N 0 0 315.438 5.020 20 0 DKADRN Cc1cscc1NC(=O)c1ccc(Oc2ccccc2)cc1 ZINC000439178514 338363339 /nfs/dbraw/zinc/36/33/39/338363339.db2.gz HYVQNXLGBVPIRQ-UHFFFAOYSA-N 0 0 309.390 5.101 20 0 DKADRN Cc1cscc1NC(=O)c1ccc(-c2ccc(F)cc2)s1 ZINC000439180167 334159728 /nfs/dbraw/zinc/15/97/28/334159728.db2.gz RHJGFELNBNATRF-UHFFFAOYSA-N 0 0 317.410 5.176 20 0 DKADRN Cc1cscc1NC(=O)c1ccc(-c2ccccc2Cl)o1 ZINC000439182963 338363614 /nfs/dbraw/zinc/36/36/14/338363614.db2.gz LTBKZAKFQDGBFF-UHFFFAOYSA-N 0 0 317.797 5.222 20 0 DKADRN Cc1cc(O)c(C(C)C)cc1NC(=O)c1sccc1C1CC1 ZINC000439220376 338364159 /nfs/dbraw/zinc/36/41/59/338364159.db2.gz DIWZXGQTYFDNJL-UHFFFAOYSA-N 0 0 315.438 5.015 20 0 DKADRN Cc1ccc(/C=C/CC(=O)Nc2cc(C(C)C)c(O)cc2C)cc1 ZINC000439223605 338364155 /nfs/dbraw/zinc/36/41/55/338364155.db2.gz NZPFHBNYNGYXPZ-AATRIKPKSA-N 0 0 323.436 5.174 20 0 DKADRN Cc1ccc(/C=C\CC(=O)Nc2cc(C(C)C)c(O)cc2C)cc1 ZINC000439223611 338364145 /nfs/dbraw/zinc/36/41/45/338364145.db2.gz NZPFHBNYNGYXPZ-WAYWQWQTSA-N 0 0 323.436 5.174 20 0 DKADRN CCc1sc(C(=O)Nc2cc(C(C)C)c(O)cc2C)cc1C ZINC000439224430 338364208 /nfs/dbraw/zinc/36/42/08/338364208.db2.gz PGKOBQVDHRBPEI-UHFFFAOYSA-N 0 0 317.454 5.009 20 0 DKADRN Cc1ccc2oc(C(=O)Nc3cc(C(C)C)c(O)cc3C)cc2c1 ZINC000439224983 338364276 /nfs/dbraw/zinc/36/42/76/338364276.db2.gz RJNPXAWIKKRUNJ-UHFFFAOYSA-N 0 0 323.392 5.131 20 0 DKADRN Cc1cccc2cc(C(=O)Nc3cc(C(C)C)c(O)cc3C)oc21 ZINC000439225774 338364309 /nfs/dbraw/zinc/36/43/09/338364309.db2.gz UNZYCRMQJIYKKY-UHFFFAOYSA-N 0 0 323.392 5.131 20 0 DKADRN Cc1cc(O)c(C(C)C)cc1NC(=O)CC/C=C\c1ccccc1 ZINC000439225874 338364257 /nfs/dbraw/zinc/36/42/57/338364257.db2.gz UNTFAMNQQNDUMQ-XFFZJAGNSA-N 0 0 323.436 5.256 20 0 DKADRN Cc1cc(O)c(C(C)C)cc1NC(=O)CC/C=C/c1ccccc1 ZINC000439225875 338364293 /nfs/dbraw/zinc/36/42/93/338364293.db2.gz UNTFAMNQQNDUMQ-YRNVUSSQSA-N 0 0 323.436 5.256 20 0 DKADRN Cc1cc(O)c(C(C)C)cc1NC(=O)c1sccc1C(C)C ZINC000439226349 338364305 /nfs/dbraw/zinc/36/43/05/338364305.db2.gz WEUGQZOXTRQDLW-UHFFFAOYSA-N 0 0 317.454 5.261 20 0 DKADRN CCc1cc(C(=O)Nc2cc(C(C)C)c(O)cc2C)sc1C ZINC000439226960 338364269 /nfs/dbraw/zinc/36/42/69/338364269.db2.gz BXFXLCLFXMLVDW-UHFFFAOYSA-N 0 0 317.454 5.009 20 0 DKADRN CCN(C(=O)c1ccc(C2CCCCC2)cc1)c1cccnc1C ZINC000439235750 338364570 /nfs/dbraw/zinc/36/45/70/338364570.db2.gz QIZAYLPRKIYQKN-UHFFFAOYSA-N 0 0 322.452 5.104 20 0 DKADRN CCN(C(=O)C[C@H](C)c1ccc(C(C)C)cc1)c1cccnc1C ZINC000439239363 338364723 /nfs/dbraw/zinc/36/47/23/338364723.db2.gz RDJASLKHUJVMSV-INIZCTEOSA-N 0 0 324.468 5.060 20 0 DKADRN CCN(C(=O)C[C@@H](C)c1ccc(C(C)C)cc1)c1cccnc1C ZINC000439239364 338364717 /nfs/dbraw/zinc/36/47/17/338364717.db2.gz RDJASLKHUJVMSV-MRXNPFEDSA-N 0 0 324.468 5.060 20 0 DKADRN Cc1cc(O)ccc1NC(=O)CC1CCC(c2ccccc2)CC1 ZINC000439254372 338365096 /nfs/dbraw/zinc/36/50/96/338365096.db2.gz DAAPKPXFJQNOAC-UHFFFAOYSA-N 0 0 323.436 5.003 20 0 DKADRN O=C(CC1=CCCCC1)Nc1c(Cl)cc(Cl)cc1Cl ZINC000439265954 338365412 /nfs/dbraw/zinc/36/54/12/338365412.db2.gz ACNFWNKZLHJPMA-UHFFFAOYSA-N 0 0 318.631 5.476 20 0 DKADRN O=C(Nc1c(Cl)cc(Cl)cc1Cl)[C@H]1[C@@H]2CCCC[C@@H]21 ZINC000439277635 338365886 /nfs/dbraw/zinc/36/58/86/338365886.db2.gz OJRALMDBBORKME-GDGBQDQQSA-N 0 0 318.631 5.022 20 0 DKADRN Cc1cscc1NC(=O)Nc1c(C(C)C)cccc1C(C)C ZINC000439296212 338366321 /nfs/dbraw/zinc/36/63/21/338366321.db2.gz NEZCBJCILHMFQP-UHFFFAOYSA-N 0 0 316.470 5.947 20 0 DKADRN Cc1cscc1NC(=O)Nc1ccccc1Cc1ccccc1 ZINC000439298292 338366380 /nfs/dbraw/zinc/36/63/80/338366380.db2.gz AHVFLPLXNRDZQX-UHFFFAOYSA-N 0 0 322.433 5.291 20 0 DKADRN Cc1cscc1NC(=O)Nc1ccccc1OC1CCCC1 ZINC000439298888 338366309 /nfs/dbraw/zinc/36/63/09/338366309.db2.gz TVSNAXBVFSZKOW-UHFFFAOYSA-N 0 0 316.426 5.022 20 0 DKADRN CCCOc1ccc(NC(=O)Nc2cscc2C)cc1Cl ZINC000439303293 338366495 /nfs/dbraw/zinc/36/64/95/338366495.db2.gz KVNFZNZTDUIVBP-UHFFFAOYSA-N 0 0 324.833 5.143 20 0 DKADRN Cc1cscc1NC(=O)Nc1cccc(OC2CCCC2)c1 ZINC000439303954 338366630 /nfs/dbraw/zinc/36/66/30/338366630.db2.gz MYNMWBRSJKUXAP-UHFFFAOYSA-N 0 0 316.426 5.022 20 0 DKADRN Cc1cscc1NC(=O)Nc1ccc(OC2CCCC2)cc1 ZINC000439306032 338366647 /nfs/dbraw/zinc/36/66/47/338366647.db2.gz SEFYQFUIIWJCLF-UHFFFAOYSA-N 0 0 316.426 5.022 20 0 DKADRN Cc1cscc1NC(=O)Nc1ccc(OC(C)C)c(Cl)c1 ZINC000439307555 338366569 /nfs/dbraw/zinc/36/65/69/338366569.db2.gz PXGPMOXSIVKIQT-UHFFFAOYSA-N 0 0 324.833 5.141 20 0 DKADRN CCCCOc1ccc(NC(=O)Nc2cscc2C)c(C)c1 ZINC000439308921 338366589 /nfs/dbraw/zinc/36/65/89/338366589.db2.gz AZYMRYCSRLWJGF-UHFFFAOYSA-N 0 0 318.442 5.188 20 0 DKADRN CCc1ccccc1NC(=O)N1CC[C@H](c2ccccc2)C[C@H]1C ZINC000439312479 338366700 /nfs/dbraw/zinc/36/67/00/338366700.db2.gz FHJLELRYJVFMQU-APWZRJJASA-N 0 0 322.452 5.049 20 0 DKADRN CCc1ccccc1NC(=O)N1CC[C@H](c2ccccc2)C[C@@H]1C ZINC000439312489 338366657 /nfs/dbraw/zinc/36/66/57/338366657.db2.gz FHJLELRYJVFMQU-LPHOPBHVSA-N 0 0 322.452 5.049 20 0 DKADRN CCc1ccccc1NC(=O)N1CC[C@@H](c2ccccc2)C[C@@H]1C ZINC000439312491 338366668 /nfs/dbraw/zinc/36/66/68/338366668.db2.gz FHJLELRYJVFMQU-QFBILLFUSA-N 0 0 322.452 5.049 20 0 DKADRN CCc1ccccc1NC(=O)N1CC[C@@H](c2ccccc2)C[C@H]1C ZINC000439312493 338366753 /nfs/dbraw/zinc/36/67/53/338366753.db2.gz FHJLELRYJVFMQU-VQIMIIECSA-N 0 0 322.452 5.049 20 0 DKADRN Cc1ccc(C)c(NC(=O)N2CC[C@H](c3ccccc3)C[C@@H]2C)c1 ZINC000439324424 338367105 /nfs/dbraw/zinc/36/71/05/338367105.db2.gz SKLMAXJOKKTRDJ-HKUYNNGSSA-N 0 0 322.452 5.103 20 0 DKADRN Cc1ccc(C)c(NC(=O)N2CC[C@@H](c3ccccc3)C[C@H]2C)c1 ZINC000439324429 338367390 /nfs/dbraw/zinc/36/73/90/338367390.db2.gz SKLMAXJOKKTRDJ-IEBWSBKVSA-N 0 0 322.452 5.103 20 0 DKADRN Cc1ccc(C)c(NC(=O)N2CC[C@H](c3ccccc3)C[C@H]2C)c1 ZINC000439324981 338367400 /nfs/dbraw/zinc/36/74/00/338367400.db2.gz SKLMAXJOKKTRDJ-MJGOQNOKSA-N 0 0 322.452 5.103 20 0 DKADRN Cc1ccc(C)c(NC(=O)N2CC[C@@H](c3ccccc3)C[C@@H]2C)c1 ZINC000439324982 338367222 /nfs/dbraw/zinc/36/72/22/338367222.db2.gz SKLMAXJOKKTRDJ-PKOBYXMFSA-N 0 0 322.452 5.103 20 0 DKADRN CSCCCN(C)C(=O)Nc1ccc(C(C)C)cc1C(C)C ZINC000439329577 338367500 /nfs/dbraw/zinc/36/75/00/338367500.db2.gz PTAOVJFWPKNJIU-UHFFFAOYSA-N 0 0 322.518 5.150 20 0 DKADRN Cc1cccc(C)c1NC(=O)N1CC[C@H](c2ccccc2)C[C@@H]1C ZINC000439329644 338367485 /nfs/dbraw/zinc/36/74/85/338367485.db2.gz YSYIKCNTZZZJEL-HKUYNNGSSA-N 0 0 322.452 5.103 20 0 DKADRN Cc1cccc(C)c1NC(=O)N1CC[C@@H](c2ccccc2)C[C@H]1C ZINC000439329646 338367475 /nfs/dbraw/zinc/36/74/75/338367475.db2.gz YSYIKCNTZZZJEL-IEBWSBKVSA-N 0 0 322.452 5.103 20 0 DKADRN Cc1cccc(C)c1NC(=O)N1CC[C@H](c2ccccc2)C[C@H]1C ZINC000439329648 338367426 /nfs/dbraw/zinc/36/74/26/338367426.db2.gz YSYIKCNTZZZJEL-MJGOQNOKSA-N 0 0 322.452 5.103 20 0 DKADRN Cc1cccc(C)c1NC(=O)N1CC[C@@H](c2ccccc2)C[C@@H]1C ZINC000439329650 338367570 /nfs/dbraw/zinc/36/75/70/338367570.db2.gz YSYIKCNTZZZJEL-PKOBYXMFSA-N 0 0 322.452 5.103 20 0 DKADRN CSc1ccc(Cl)cc1NC(=O)Nc1cscc1C ZINC000439352915 338367871 /nfs/dbraw/zinc/36/78/71/338367871.db2.gz GKMFUOIHNLCDFX-UHFFFAOYSA-N 0 0 312.847 5.076 20 0 DKADRN CCCn1ccc2cc(NC(=O)Nc3cscc3C)ccc21 ZINC000439389786 338368356 /nfs/dbraw/zinc/36/83/56/338368356.db2.gz WWRIKVYAYKHIHU-UHFFFAOYSA-N 0 0 313.426 5.065 20 0 DKADRN CCCn1ccc2ccc(NC(=O)Nc3cscc3C)cc21 ZINC000439391171 338368361 /nfs/dbraw/zinc/36/83/61/338368361.db2.gz ZPPYEJUASYSZTH-UHFFFAOYSA-N 0 0 313.426 5.065 20 0 DKADRN Cc1cscc1NC(=O)Nc1cccc(Cl)c1OC(C)C ZINC000439399300 338368390 /nfs/dbraw/zinc/36/83/90/338368390.db2.gz XGSMMNQTKQVAIR-UHFFFAOYSA-N 0 0 324.833 5.141 20 0 DKADRN COc1ccc2cc([C@@H](C)[S@](=O)c3ccc(C)cc3)ccc2c1 ZINC000439417262 338368699 /nfs/dbraw/zinc/36/86/99/338368699.db2.gz HIPITCDLLWHDHU-CMJOXMDJSA-N 0 0 324.445 5.026 20 0 DKADRN COc1ccc2cc([C@@H](C)[S@@](=O)c3ccc(C)cc3)ccc2c1 ZINC000439417263 338368712 /nfs/dbraw/zinc/36/87/12/338368712.db2.gz HIPITCDLLWHDHU-IQMFZBJNSA-N 0 0 324.445 5.026 20 0 DKADRN COc1ccc2cc([C@H](C)[S@@](=O)c3ccc(C)cc3)ccc2c1 ZINC000439417264 338368748 /nfs/dbraw/zinc/36/87/48/338368748.db2.gz HIPITCDLLWHDHU-NPMXOYFQSA-N 0 0 324.445 5.026 20 0 DKADRN COc1ccc2cc([C@H](C)[S@](=O)c3ccc(C)cc3)ccc2c1 ZINC000439417265 338368790 /nfs/dbraw/zinc/36/87/90/338368790.db2.gz HIPITCDLLWHDHU-WNSKOXEYSA-N 0 0 324.445 5.026 20 0 DKADRN COc1ccc2cc([C@@H](C)[S@](=O)c3cccc(C)c3)ccc2c1 ZINC000439428363 338369162 /nfs/dbraw/zinc/36/91/62/338369162.db2.gz FQNJMMPQPCDCIG-CMJOXMDJSA-N 0 0 324.445 5.026 20 0 DKADRN COc1ccc2cc([C@@H](C)[S@@](=O)c3cccc(C)c3)ccc2c1 ZINC000439428366 338369038 /nfs/dbraw/zinc/36/90/38/338369038.db2.gz FQNJMMPQPCDCIG-IQMFZBJNSA-N 0 0 324.445 5.026 20 0 DKADRN COc1ccc2cc([C@H](C)[S@@](=O)c3cccc(C)c3)ccc2c1 ZINC000439428369 338369103 /nfs/dbraw/zinc/36/91/03/338369103.db2.gz FQNJMMPQPCDCIG-NPMXOYFQSA-N 0 0 324.445 5.026 20 0 DKADRN COc1ccc2cc([C@H](C)[S@](=O)c3cccc(C)c3)ccc2c1 ZINC000439428372 338369071 /nfs/dbraw/zinc/36/90/71/338369071.db2.gz FQNJMMPQPCDCIG-WNSKOXEYSA-N 0 0 324.445 5.026 20 0 DKADRN COc1ccc2cc([C@@H](C)[S@](=O)c3ccccc3C)ccc2c1 ZINC000439432395 338369334 /nfs/dbraw/zinc/36/93/34/338369334.db2.gz TVJRGQBEDIHKRF-CMJOXMDJSA-N 0 0 324.445 5.026 20 0 DKADRN COc1ccc2cc([C@@H](C)[S@@](=O)c3ccccc3C)ccc2c1 ZINC000439432396 338369270 /nfs/dbraw/zinc/36/92/70/338369270.db2.gz TVJRGQBEDIHKRF-IQMFZBJNSA-N 0 0 324.445 5.026 20 0 DKADRN COc1ccc2cc([C@H](C)[S@@](=O)c3ccccc3C)ccc2c1 ZINC000439432397 338369257 /nfs/dbraw/zinc/36/92/57/338369257.db2.gz TVJRGQBEDIHKRF-NPMXOYFQSA-N 0 0 324.445 5.026 20 0 DKADRN COc1ccc2cc([C@H](C)[S@](=O)c3ccccc3C)ccc2c1 ZINC000439432398 338369274 /nfs/dbraw/zinc/36/92/74/338369274.db2.gz TVJRGQBEDIHKRF-WNSKOXEYSA-N 0 0 324.445 5.026 20 0 DKADRN CCOCc1ccc(NCc2ccc(Cl)cc2Cl)cc1 ZINC000439471249 334181749 /nfs/dbraw/zinc/18/17/49/334181749.db2.gz FQUFYZVKIWCBGO-UHFFFAOYSA-N 0 0 310.224 5.142 20 0 DKADRN CCCCc1nc(CN[C@H](C)c2ccc(SC)cc2)cs1 ZINC000439471836 338370813 /nfs/dbraw/zinc/37/08/13/338370813.db2.gz RQDAVJNGDVTINK-CYBMUJFWSA-N 0 0 320.527 5.058 20 0 DKADRN CCCCOc1ccc(CNc2ccc(COCC)cc2)cc1 ZINC000439473450 338370712 /nfs/dbraw/zinc/37/07/12/338370712.db2.gz AFJTYUKLDXTLGB-UHFFFAOYSA-N 0 0 313.441 5.014 20 0 DKADRN CC(C)(C)c1ccc(-c2ccc(CNCc3ccoc3)o2)cc1 ZINC000439474336 338370684 /nfs/dbraw/zinc/37/06/84/338370684.db2.gz BPQMXAVAMGFFAN-UHFFFAOYSA-N 0 0 309.409 5.127 20 0 DKADRN CCOCc1ccc(NCc2cc(Cl)cc(Cl)c2)cc1 ZINC000439475150 338370949 /nfs/dbraw/zinc/37/09/49/338370949.db2.gz YGXGNMMIHJUSCY-UHFFFAOYSA-N 0 0 310.224 5.142 20 0 DKADRN CCN(Cc1ccc2ccccc2c1)C(=O)Nc1cscc1C ZINC000439475786 338370892 /nfs/dbraw/zinc/37/08/92/338370892.db2.gz FVSDJCLGMHOIMK-UHFFFAOYSA-N 0 0 324.449 5.264 20 0 DKADRN Cc1cscc1NC(=O)N1CCC[C@H]1CC1CCCCC1 ZINC000439476335 338370973 /nfs/dbraw/zinc/37/09/73/338370973.db2.gz FRNFITVMEJOLCD-HNNXBMFYSA-N 0 0 306.475 5.023 20 0 DKADRN Cc1cscc1NC(=O)N1CCC[C@@H]1CC1CCCCC1 ZINC000439476337 338370842 /nfs/dbraw/zinc/37/08/42/338370842.db2.gz FRNFITVMEJOLCD-OAHLLOKOSA-N 0 0 306.475 5.023 20 0 DKADRN CC(C)(C)c1ccc(-c2ccc(CNCc3ccco3)o2)cc1 ZINC000439476772 338370852 /nfs/dbraw/zinc/37/08/52/338370852.db2.gz IKWRPQLFDCRLRD-UHFFFAOYSA-N 0 0 309.409 5.127 20 0 DKADRN Cc1cscc1NC(=O)N(Cc1cccc(C)c1)CC(C)C ZINC000439477118 338370869 /nfs/dbraw/zinc/37/08/69/338370869.db2.gz TUPKSOVFILAWFP-UHFFFAOYSA-N 0 0 316.470 5.055 20 0 DKADRN CCOCc1ccc(NCc2ccc(-c3ccccc3)o2)cc1 ZINC000439477554 338371057 /nfs/dbraw/zinc/37/10/57/338371057.db2.gz JZFNBNUZTLXIIY-UHFFFAOYSA-N 0 0 307.393 5.095 20 0 DKADRN CCCN(C(=O)Nc1cscc1C)[C@@H](CC)c1ccccc1 ZINC000439477746 338371073 /nfs/dbraw/zinc/37/10/73/338371073.db2.gz LUSJGEZCPAICQP-KRWDZBQOSA-N 0 0 316.470 5.452 20 0 DKADRN CCCN(C(=O)Nc1cscc1C)[C@H](CC)c1ccccc1 ZINC000439477747 338371117 /nfs/dbraw/zinc/37/11/17/338371117.db2.gz LUSJGEZCPAICQP-QGZVFWFLSA-N 0 0 316.470 5.452 20 0 DKADRN CCOCc1ccc(NCc2cc(-c3ccccc3)cs2)cc1 ZINC000439478385 338371006 /nfs/dbraw/zinc/37/10/06/338371006.db2.gz OIDAAKBOABXXMW-UHFFFAOYSA-N 0 0 323.461 5.564 20 0 DKADRN CCCOc1ccccc1NCc1cccc(-c2ccncc2)c1 ZINC000439478897 338370989 /nfs/dbraw/zinc/37/09/89/338370989.db2.gz QETWXCIPQXYAEQ-UHFFFAOYSA-N 0 0 318.420 5.150 20 0 DKADRN CCOCc1ccc(NCc2ccc(Cl)c(Cl)c2)cc1 ZINC000439479132 338371109 /nfs/dbraw/zinc/37/11/09/338371109.db2.gz RYHSLRCIHWOOJL-UHFFFAOYSA-N 0 0 310.224 5.142 20 0 DKADRN CCOCc1ccc(NCc2cccc(Cl)c2Cl)cc1 ZINC000439479401 338371056 /nfs/dbraw/zinc/37/10/56/338371056.db2.gz RUKDVALTBNHBGH-UHFFFAOYSA-N 0 0 310.224 5.142 20 0 DKADRN CCCCN(Cc1ccccc1F)C(=O)Nc1cscc1C ZINC000439479556 338371038 /nfs/dbraw/zinc/37/10/38/338371038.db2.gz VHCCSRSBPSGAEL-UHFFFAOYSA-N 0 0 320.433 5.030 20 0 DKADRN Cc1cscc1NC(=O)N[C@H](CC(C)C)c1cccs1 ZINC000439480176 338371234 /nfs/dbraw/zinc/37/12/34/338371234.db2.gz XCWVXYGBRHDCSE-GFCCVEGCSA-N 0 0 308.472 5.027 20 0 DKADRN Cc1cscc1NC(=O)N[C@@H](CC(C)C)c1cccs1 ZINC000439480178 338371271 /nfs/dbraw/zinc/37/12/71/338371271.db2.gz XCWVXYGBRHDCSE-LBPRGKRZSA-N 0 0 308.472 5.027 20 0 DKADRN CCOCc1ccc(NCc2c3ccccc3oc2CC)cc1 ZINC000439480656 338371260 /nfs/dbraw/zinc/37/12/60/338371260.db2.gz WBSYZPWEFZYVMH-UHFFFAOYSA-N 0 0 309.409 5.144 20 0 DKADRN Cc1cscc1NC(=O)Nc1cccc(C(F)(F)F)c1C ZINC000439482571 334182093 /nfs/dbraw/zinc/18/20/93/334182093.db2.gz WSWCMAXFAXLQKI-UHFFFAOYSA-N 0 0 314.332 5.028 20 0 DKADRN Cc1cscc1NC(=O)N1CCC[C@H]1CCC1CCCC1 ZINC000439483006 338371206 /nfs/dbraw/zinc/37/12/06/338371206.db2.gz CVIJQEWILBUZCU-HNNXBMFYSA-N 0 0 306.475 5.023 20 0 DKADRN Cc1cscc1NC(=O)N1CCC[C@@H]1CCC1CCCC1 ZINC000439483007 338371238 /nfs/dbraw/zinc/37/12/38/338371238.db2.gz CVIJQEWILBUZCU-OAHLLOKOSA-N 0 0 306.475 5.023 20 0 DKADRN Cc1cscc1NC(=O)Nc1ccccc1SC(C)C ZINC000439483155 338371349 /nfs/dbraw/zinc/37/13/49/338371349.db2.gz FUQRKCCKRWPSPI-UHFFFAOYSA-N 0 0 306.456 5.201 20 0 DKADRN Cc1cscc1NC(=O)N[C@H](C)c1cc2ccccc2s1 ZINC000439485238 338371454 /nfs/dbraw/zinc/37/14/54/338371454.db2.gz INRJQPYEGOPDIN-LLVKDONJSA-N 0 0 316.451 5.154 20 0 DKADRN Cc1cscc1NC(=O)N[C@@H](C)c1cc2ccccc2s1 ZINC000439485240 338371466 /nfs/dbraw/zinc/37/14/66/338371466.db2.gz INRJQPYEGOPDIN-NSHDSACASA-N 0 0 316.451 5.154 20 0 DKADRN CC[C@@H](NC(=O)Nc1cscc1C)c1ccc(Cl)s1 ZINC000439485247 338371330 /nfs/dbraw/zinc/37/13/30/338371330.db2.gz IPILNICNZLNUNO-SECBINFHSA-N 0 0 314.863 5.044 20 0 DKADRN CC[C@H](NC(=O)Nc1cscc1C)c1ccc(Cl)s1 ZINC000439485248 338371353 /nfs/dbraw/zinc/37/13/53/338371353.db2.gz IPILNICNZLNUNO-VIFPVBQESA-N 0 0 314.863 5.044 20 0 DKADRN Cc1cscc1NC(=O)N(Cc1ccccc1)CC(C)(C)C ZINC000439487282 338371648 /nfs/dbraw/zinc/37/16/48/338371648.db2.gz QDSDCQQUXUPHEY-UHFFFAOYSA-N 0 0 316.470 5.137 20 0 DKADRN Cc1cscc1NC(=O)N1CCCCC[C@H]1c1ccccc1 ZINC000439487527 338371550 /nfs/dbraw/zinc/37/15/50/338371550.db2.gz SYFFQIWNNPTHHK-KRWDZBQOSA-N 0 0 314.454 5.206 20 0 DKADRN Cc1cscc1NC(=O)N1CCCCC[C@@H]1c1ccccc1 ZINC000439487528 338371569 /nfs/dbraw/zinc/37/15/69/338371569.db2.gz SYFFQIWNNPTHHK-QGZVFWFLSA-N 0 0 314.454 5.206 20 0 DKADRN Cc1cscc1NC(=O)N[C@@H](c1ccc(F)cc1)C(C)(C)C ZINC000439488896 338371682 /nfs/dbraw/zinc/37/16/82/338371682.db2.gz ADZONKCGEXQDHS-HNNXBMFYSA-N 0 0 320.433 5.105 20 0 DKADRN Cc1cscc1NC(=O)N[C@H](c1ccc(F)cc1)C(C)(C)C ZINC000439488897 338371681 /nfs/dbraw/zinc/37/16/81/338371681.db2.gz ADZONKCGEXQDHS-OAHLLOKOSA-N 0 0 320.433 5.105 20 0 DKADRN Cc1cscc1NC(=O)N[C@H](C)c1cccc2ccccc21 ZINC000439489453 338371677 /nfs/dbraw/zinc/37/16/77/338371677.db2.gz FIUGBPWPZJTSKU-CYBMUJFWSA-N 0 0 310.422 5.092 20 0 DKADRN Cc1cscc1NC(=O)N[C@@H](C)c1cccc2ccccc21 ZINC000439489454 338371724 /nfs/dbraw/zinc/37/17/24/338371724.db2.gz FIUGBPWPZJTSKU-ZDUSSCGKSA-N 0 0 310.422 5.092 20 0 DKADRN CSc1ccc(NC(=O)Nc2cscc2C)cc1Cl ZINC000439489897 338371675 /nfs/dbraw/zinc/37/16/75/338371675.db2.gz HFACESQSYWKYCS-UHFFFAOYSA-N 0 0 312.847 5.076 20 0 DKADRN CC[C@@H](c1ccccc1)N(CC)C(=O)Nc1cscc1C ZINC000439491670 338371707 /nfs/dbraw/zinc/37/17/07/338371707.db2.gz COEUKPMXTCMUCB-INIZCTEOSA-N 0 0 302.443 5.062 20 0 DKADRN CC[C@H](c1ccccc1)N(CC)C(=O)Nc1cscc1C ZINC000439491671 338371708 /nfs/dbraw/zinc/37/17/08/338371708.db2.gz COEUKPMXTCMUCB-MRXNPFEDSA-N 0 0 302.443 5.062 20 0 DKADRN Cc1cscc1NC(=O)N1CCCC2(C1)CCCCCC2 ZINC000439495598 338371810 /nfs/dbraw/zinc/37/18/10/338371810.db2.gz SLAXBWXTPAZORJ-UHFFFAOYSA-N 0 0 306.475 5.025 20 0 DKADRN CCC1CCC(N(C(=O)Nc2cscc2C)C2CC2)CC1 ZINC000439496516 338371812 /nfs/dbraw/zinc/37/18/12/338371812.db2.gz VKQROLTUIAFAPE-UHFFFAOYSA-N 0 0 306.475 5.022 20 0 DKADRN CCSc1ccc([C@@H](C)NC(=O)Nc2cscc2C)cc1 ZINC000439497021 338371972 /nfs/dbraw/zinc/37/19/72/338371972.db2.gz OYTCQARFXVVXPN-GFCCVEGCSA-N 0 0 320.483 5.051 20 0 DKADRN CCSc1ccc([C@H](C)NC(=O)Nc2cscc2C)cc1 ZINC000439497035 338371898 /nfs/dbraw/zinc/37/18/98/338371898.db2.gz OYTCQARFXVVXPN-LBPRGKRZSA-N 0 0 320.483 5.051 20 0 DKADRN Cc1cscc1NC(=O)Nc1cc(C(F)(F)F)ccc1C ZINC000439498516 338371910 /nfs/dbraw/zinc/37/19/10/338371910.db2.gz YQPKDRMTYFZCLS-UHFFFAOYSA-N 0 0 314.332 5.028 20 0 DKADRN C(=C/c1nc2ccccc2o1)\c1cnc(-c2ccsc2)s1 ZINC000439509288 338372158 /nfs/dbraw/zinc/37/21/58/338372158.db2.gz DSEOCGVZOQJENJ-AATRIKPKSA-N 0 0 310.403 5.183 20 0 DKADRN C(=C\c1nc2ccccc2o1)\c1cnc(-c2ccsc2)s1 ZINC000439509314 338372157 /nfs/dbraw/zinc/37/21/57/338372157.db2.gz DSEOCGVZOQJENJ-WAYWQWQTSA-N 0 0 310.403 5.183 20 0 DKADRN CCCC(=O)Nc1cccc(NCCCc2ccccc2C)c1C ZINC000439517288 338372312 /nfs/dbraw/zinc/37/23/12/338372312.db2.gz GRAKQQWRBYNOBZ-UHFFFAOYSA-N 0 0 324.468 5.087 20 0 DKADRN CC(C)c1ccc(N[C@@H](C)c2ncc(-c3ccccc3)o2)cc1 ZINC000439543304 338372735 /nfs/dbraw/zinc/37/27/35/338372735.db2.gz DNYBYPAEGUDZMM-HNNXBMFYSA-N 0 0 306.409 5.638 20 0 DKADRN CC(C)c1ccc(N[C@H](C)c2ncc(-c3ccccc3)o2)cc1 ZINC000439543306 338372816 /nfs/dbraw/zinc/37/28/16/338372816.db2.gz DNYBYPAEGUDZMM-OAHLLOKOSA-N 0 0 306.409 5.638 20 0 DKADRN C[C@H](Nc1ccc2c(c1)CCC2)c1ncc(-c2ccccc2)o1 ZINC000439546675 338372871 /nfs/dbraw/zinc/37/28/71/338372871.db2.gz FVNWWNVKTCJTEC-AWEZNQCLSA-N 0 0 304.393 5.003 20 0 DKADRN C[C@@H](Nc1ccc2c(c1)CCC2)c1ncc(-c2ccccc2)o1 ZINC000439546676 338372866 /nfs/dbraw/zinc/37/28/66/338372866.db2.gz FVNWWNVKTCJTEC-CQSZACIVSA-N 0 0 304.393 5.003 20 0 DKADRN Cc1cc(CNc2ccc([C@H](C)Sc3ccccc3)cc2)no1 ZINC000439552068 338372957 /nfs/dbraw/zinc/37/29/57/338372957.db2.gz QFKBKGJKTIJZLT-HNNXBMFYSA-N 0 0 324.449 5.448 20 0 DKADRN Cc1cc(CNc2ccc([C@@H](C)Sc3ccccc3)cc2)no1 ZINC000439552069 338372986 /nfs/dbraw/zinc/37/29/86/338372986.db2.gz QFKBKGJKTIJZLT-OAHLLOKOSA-N 0 0 324.449 5.448 20 0 DKADRN Cc1nc(CNc2ccc(CCCc3ccccc3)cc2)oc1C ZINC000439552871 338372896 /nfs/dbraw/zinc/37/28/96/338372896.db2.gz RNLAKRKMJLNQLG-UHFFFAOYSA-N 0 0 320.436 5.079 20 0 DKADRN Cc1nc(CNc2cccc(CCCc3ccccc3)c2)oc1C ZINC000439552975 338372936 /nfs/dbraw/zinc/37/29/36/338372936.db2.gz UPEIXLCBWQHMOR-UHFFFAOYSA-N 0 0 320.436 5.079 20 0 DKADRN Cc1cccc([C@@H](C)Nc2cccc(OCC(F)(F)F)c2)c1 ZINC000439553467 338372980 /nfs/dbraw/zinc/37/29/80/338372980.db2.gz VTNVNIFIUZJAFU-CYBMUJFWSA-N 0 0 309.331 5.109 20 0 DKADRN Cc1cccc([C@H](C)Nc2cccc(OCC(F)(F)F)c2)c1 ZINC000439553470 338373000 /nfs/dbraw/zinc/37/30/00/338373000.db2.gz VTNVNIFIUZJAFU-ZDUSSCGKSA-N 0 0 309.331 5.109 20 0 DKADRN CCCOc1cccc(N[C@@H](C)c2ncc(-c3ccccc3)o2)c1 ZINC000439555490 338372963 /nfs/dbraw/zinc/37/29/63/338372963.db2.gz CNFQKXMTUUKWHU-HNNXBMFYSA-N 0 0 322.408 5.304 20 0 DKADRN CCCOc1cccc(N[C@H](C)c2ncc(-c3ccccc3)o2)c1 ZINC000439555491 338372934 /nfs/dbraw/zinc/37/29/34/338372934.db2.gz CNFQKXMTUUKWHU-OAHLLOKOSA-N 0 0 322.408 5.304 20 0 DKADRN CCOCc1cccc(N[C@H](C)c2ccc(Cl)c(Cl)c2)c1 ZINC000439559607 338373111 /nfs/dbraw/zinc/37/31/11/338373111.db2.gz AUFHVNYEGMWNAE-GFCCVEGCSA-N 0 0 324.251 5.703 20 0 DKADRN CCOCc1cccc(N[C@@H](C)c2ccc(Cl)c(Cl)c2)c1 ZINC000439559617 338373014 /nfs/dbraw/zinc/37/30/14/338373014.db2.gz AUFHVNYEGMWNAE-LBPRGKRZSA-N 0 0 324.251 5.703 20 0 DKADRN Cc1nc(CNc2ccccc2Oc2c(C)cccc2C)oc1C ZINC000439560074 338373027 /nfs/dbraw/zinc/37/30/27/338373027.db2.gz GTPPNAMMZUOSMN-UHFFFAOYSA-N 0 0 322.408 5.313 20 0 DKADRN Cc1nc(CNc2ccc(Sc3ccccc3)cc2C)oc1C ZINC000439563896 338373194 /nfs/dbraw/zinc/37/31/94/338373194.db2.gz WILAVDBKNJPXDL-UHFFFAOYSA-N 0 0 324.449 5.363 20 0 DKADRN CC[C@@H](Cc1nc([C@@H]2CCC(F)(F)C2)no1)c1ccc(C)cc1 ZINC000439564059 338373158 /nfs/dbraw/zinc/37/31/58/338373158.db2.gz BIHDFESPVDMRNN-DZGCQCFKSA-N 0 0 320.383 5.017 20 0 DKADRN CC[C@H](Cc1nc([C@H]2CCC(F)(F)C2)no1)c1ccc(C)cc1 ZINC000439564060 338373234 /nfs/dbraw/zinc/37/32/34/338373234.db2.gz BIHDFESPVDMRNN-HIFRSBDPSA-N 0 0 320.383 5.017 20 0 DKADRN CC[C@H](Cc1nc([C@@H]2CCC(F)(F)C2)no1)c1ccc(C)cc1 ZINC000439564061 338373140 /nfs/dbraw/zinc/37/31/40/338373140.db2.gz BIHDFESPVDMRNN-UKRRQHHQSA-N 0 0 320.383 5.017 20 0 DKADRN CC[C@@H](Cc1nc([C@H]2CCC(F)(F)C2)no1)c1ccc(C)cc1 ZINC000439564062 338373223 /nfs/dbraw/zinc/37/32/23/338373223.db2.gz BIHDFESPVDMRNN-ZFWWWQNUSA-N 0 0 320.383 5.017 20 0 DKADRN CCOCc1ccc(N[C@H](CC)c2ccc(Cl)cc2)cc1 ZINC000439564322 338373239 /nfs/dbraw/zinc/37/32/39/338373239.db2.gz CJSCNPOBMPFVJR-GOSISDBHSA-N 0 0 303.833 5.440 20 0 DKADRN CCOCc1ccc(N[C@@H](CC)c2ccc(Cl)cc2)cc1 ZINC000439564325 334188122 /nfs/dbraw/zinc/18/81/22/334188122.db2.gz CJSCNPOBMPFVJR-SFHVURJKSA-N 0 0 303.833 5.440 20 0 DKADRN CCOCc1cccc(N[C@H](CC)c2ccc(Cl)cc2)c1 ZINC000439564344 338373212 /nfs/dbraw/zinc/37/32/12/338373212.db2.gz PUOBXROFWFNMJO-GOSISDBHSA-N 0 0 303.833 5.440 20 0 DKADRN CCOCc1cccc(N[C@@H](CC)c2ccc(Cl)cc2)c1 ZINC000439564345 338373166 /nfs/dbraw/zinc/37/31/66/338373166.db2.gz PUOBXROFWFNMJO-SFHVURJKSA-N 0 0 303.833 5.440 20 0 DKADRN C/C(=C/c1ccccc1Cl)c1nc([C@H]2CCC(F)(F)C2)no1 ZINC000439565596 338373211 /nfs/dbraw/zinc/37/32/11/338373211.db2.gz BJUUPUVVRRXUEG-CUZBXDDWSA-N 0 0 324.758 5.186 20 0 DKADRN C/C(=C\c1ccccc1Cl)c1nc([C@H]2CCC(F)(F)C2)no1 ZINC000439565597 338373230 /nfs/dbraw/zinc/37/32/30/338373230.db2.gz BJUUPUVVRRXUEG-OANVXVOSSA-N 0 0 324.758 5.186 20 0 DKADRN C/C(=C/c1ccccc1Cl)c1nc([C@@H]2CCC(F)(F)C2)no1 ZINC000439565598 338373152 /nfs/dbraw/zinc/37/31/52/338373152.db2.gz BJUUPUVVRRXUEG-VPUINMBXSA-N 0 0 324.758 5.186 20 0 DKADRN C/C(=C\c1ccccc1Cl)c1nc([C@@H]2CCC(F)(F)C2)no1 ZINC000439565599 338373155 /nfs/dbraw/zinc/37/31/55/338373155.db2.gz BJUUPUVVRRXUEG-ZJNQMXKESA-N 0 0 324.758 5.186 20 0 DKADRN C/C(=C/c1nc([C@@H]2CCC(F)(F)C2)no1)c1ccccc1Cl ZINC000439566717 338373258 /nfs/dbraw/zinc/37/32/58/338373258.db2.gz FTSYMZUSHBHEJU-HIJJYWJESA-N 0 0 324.758 5.186 20 0 DKADRN C/C(=C/c1nc([C@H]2CCC(F)(F)C2)no1)c1ccccc1Cl ZINC000439566718 338373257 /nfs/dbraw/zinc/37/32/57/338373257.db2.gz FTSYMZUSHBHEJU-IEHMKBBKSA-N 0 0 324.758 5.186 20 0 DKADRN C/C(=C\c1nc([C@@H]2CCC(F)(F)C2)no1)c1ccccc1Cl ZINC000439566719 338373221 /nfs/dbraw/zinc/37/32/21/338373221.db2.gz FTSYMZUSHBHEJU-RJCSOLBVSA-N 0 0 324.758 5.186 20 0 DKADRN C/C(=C\c1nc([C@H]2CCC(F)(F)C2)no1)c1ccccc1Cl ZINC000439566720 338373256 /nfs/dbraw/zinc/37/32/56/338373256.db2.gz FTSYMZUSHBHEJU-UQSGXBNBSA-N 0 0 324.758 5.186 20 0 DKADRN CCOCc1ccc(N[C@@H](C)c2ccc3ccccc3c2)cc1 ZINC000439568472 338373340 /nfs/dbraw/zinc/37/33/40/338373340.db2.gz JSCWKEFMCOHMKJ-INIZCTEOSA-N 0 0 305.421 5.549 20 0 DKADRN CCOCc1ccc(N[C@H](C)c2ccc3ccccc3c2)cc1 ZINC000439568473 338373279 /nfs/dbraw/zinc/37/32/79/338373279.db2.gz JSCWKEFMCOHMKJ-MRXNPFEDSA-N 0 0 305.421 5.549 20 0 DKADRN CCOCc1ccc(N[C@H](C)c2ccc(Cl)c(Cl)c2)cc1 ZINC000439570759 338373416 /nfs/dbraw/zinc/37/34/16/338373416.db2.gz NFXDJULWCQNVRK-GFCCVEGCSA-N 0 0 324.251 5.703 20 0 DKADRN CCOCc1ccc(N[C@@H](C)c2ccc(Cl)c(Cl)c2)cc1 ZINC000439570760 338373391 /nfs/dbraw/zinc/37/33/91/338373391.db2.gz NFXDJULWCQNVRK-LBPRGKRZSA-N 0 0 324.251 5.703 20 0 DKADRN CCOCc1ccc(N[C@@H](C)c2ncc(-c3ccccc3)o2)cc1 ZINC000439570784 338373432 /nfs/dbraw/zinc/37/34/32/338373432.db2.gz NODFVVARVVLDIN-HNNXBMFYSA-N 0 0 322.408 5.051 20 0 DKADRN CCOCc1ccc(N[C@H](C)c2ncc(-c3ccccc3)o2)cc1 ZINC000439570785 338373446 /nfs/dbraw/zinc/37/34/46/338373446.db2.gz NODFVVARVVLDIN-OAHLLOKOSA-N 0 0 322.408 5.051 20 0 DKADRN Cc1ccc(S[C@H](C)c2nc([C@H]3CCC(F)(F)C3)no2)cc1 ZINC000439571142 338373443 /nfs/dbraw/zinc/37/34/43/338373443.db2.gz KVWYFBNIBNHQMT-NEPJUHHUSA-N 0 0 324.396 5.134 20 0 DKADRN Cc1ccc(S[C@@H](C)c2nc([C@@H]3CCC(F)(F)C3)no2)cc1 ZINC000439571144 338373398 /nfs/dbraw/zinc/37/33/98/338373398.db2.gz KVWYFBNIBNHQMT-NWDGAFQWSA-N 0 0 324.396 5.134 20 0 DKADRN Cc1ccc(S[C@@H](C)c2nc([C@H]3CCC(F)(F)C3)no2)cc1 ZINC000439571146 338373436 /nfs/dbraw/zinc/37/34/36/338373436.db2.gz KVWYFBNIBNHQMT-RYUDHWBXSA-N 0 0 324.396 5.134 20 0 DKADRN Cc1ccc(S[C@H](C)c2nc([C@@H]3CCC(F)(F)C3)no2)cc1 ZINC000439571148 338373356 /nfs/dbraw/zinc/37/33/56/338373356.db2.gz KVWYFBNIBNHQMT-VXGBXAGGSA-N 0 0 324.396 5.134 20 0 DKADRN FC1(F)CC[C@@H](c2noc(-c3cc4cc(Cl)ccc4o3)n2)C1 ZINC000439572890 338373506 /nfs/dbraw/zinc/37/35/06/338373506.db2.gz NTNXHKAHKQNXBW-MRVPVSSYSA-N 0 0 324.714 5.039 20 0 DKADRN FC1(F)CC[C@H](c2noc(-c3cc4cc(Cl)ccc4o3)n2)C1 ZINC000439572891 338373510 /nfs/dbraw/zinc/37/35/10/338373510.db2.gz NTNXHKAHKQNXBW-QMMMGPOBSA-N 0 0 324.714 5.039 20 0 DKADRN CC(C)Sc1ccc(-c2nc([C@@H]3CCC(F)(F)C3)no2)cc1 ZINC000439573812 338373458 /nfs/dbraw/zinc/37/34/58/338373458.db2.gz SMEXGGLFFFEYTH-GFCCVEGCSA-N 0 0 324.396 5.140 20 0 DKADRN CC(C)Sc1ccc(-c2nc([C@H]3CCC(F)(F)C3)no2)cc1 ZINC000439573813 338373456 /nfs/dbraw/zinc/37/34/56/338373456.db2.gz SMEXGGLFFFEYTH-LBPRGKRZSA-N 0 0 324.396 5.140 20 0 DKADRN C[C@@H](Nc1ccc(Cl)c(F)c1)c1ncc(-c2ccccc2)o1 ZINC000439577272 338373676 /nfs/dbraw/zinc/37/36/76/338373676.db2.gz VWWNWQVVUYGZHI-LLVKDONJSA-N 0 0 316.763 5.307 20 0 DKADRN C[C@H](Nc1ccc(Cl)c(F)c1)c1ncc(-c2ccccc2)o1 ZINC000439577273 338373716 /nfs/dbraw/zinc/37/37/16/338373716.db2.gz VWWNWQVVUYGZHI-NSHDSACASA-N 0 0 316.763 5.307 20 0 DKADRN C/C(=C/c1ccc(Cl)cc1)c1nc([C@H]2CCC(F)(F)C2)no1 ZINC000439577687 338373678 /nfs/dbraw/zinc/37/36/78/338373678.db2.gz XIQNVLYXHKDOMG-CUZBXDDWSA-N 0 0 324.758 5.186 20 0 DKADRN C/C(=C\c1ccc(Cl)cc1)c1nc([C@H]2CCC(F)(F)C2)no1 ZINC000439577689 338373747 /nfs/dbraw/zinc/37/37/47/338373747.db2.gz XIQNVLYXHKDOMG-OANVXVOSSA-N 0 0 324.758 5.186 20 0 DKADRN C/C(=C/c1ccc(Cl)cc1)c1nc([C@@H]2CCC(F)(F)C2)no1 ZINC000439577691 338373679 /nfs/dbraw/zinc/37/36/79/338373679.db2.gz XIQNVLYXHKDOMG-VPUINMBXSA-N 0 0 324.758 5.186 20 0 DKADRN C/C(=C\c1ccc(Cl)cc1)c1nc([C@@H]2CCC(F)(F)C2)no1 ZINC000439577692 338373737 /nfs/dbraw/zinc/37/37/37/338373737.db2.gz XIQNVLYXHKDOMG-ZJNQMXKESA-N 0 0 324.758 5.186 20 0 DKADRN CC[C@H](Nc1cccc([C@@H](C)OC)c1)c1ccc(Cl)cc1 ZINC000439587038 338373960 /nfs/dbraw/zinc/37/39/60/338373960.db2.gz NDRQMALHXMDXMH-ACJLOTCBSA-N 0 0 303.833 5.611 20 0 DKADRN CC[C@@H](Nc1cccc([C@@H](C)OC)c1)c1ccc(Cl)cc1 ZINC000439587044 338373903 /nfs/dbraw/zinc/37/39/03/338373903.db2.gz NDRQMALHXMDXMH-FZKQIMNGSA-N 0 0 303.833 5.611 20 0 DKADRN CC[C@@H](Nc1cccc([C@H](C)OC)c1)c1ccc(Cl)cc1 ZINC000439587046 338373867 /nfs/dbraw/zinc/37/38/67/338373867.db2.gz NDRQMALHXMDXMH-SCLBCKFNSA-N 0 0 303.833 5.611 20 0 DKADRN CC[C@H](Nc1cccc([C@H](C)OC)c1)c1ccc(Cl)cc1 ZINC000439587048 338373876 /nfs/dbraw/zinc/37/38/76/338373876.db2.gz NDRQMALHXMDXMH-UGSOOPFHSA-N 0 0 303.833 5.611 20 0 DKADRN CC[C@H](Nc1ccc(-c2cncnc2)cc1)c1ccc(Cl)cc1 ZINC000439588441 338374019 /nfs/dbraw/zinc/37/40/19/338374019.db2.gz OCOZBOIBNDXRCI-IBGZPJMESA-N 0 0 323.827 5.360 20 0 DKADRN CC[C@@H](Nc1ccc(-c2cncnc2)cc1)c1ccc(Cl)cc1 ZINC000439588443 338374027 /nfs/dbraw/zinc/37/40/27/338374027.db2.gz OCOZBOIBNDXRCI-LJQANCHMSA-N 0 0 323.827 5.360 20 0 DKADRN CO[C@@H](C)c1cccc(N[C@H](C)c2ccc(Cl)c(Cl)c2)c1 ZINC000439589538 338373983 /nfs/dbraw/zinc/37/39/83/338373983.db2.gz IDVPSTHFWLAQLA-NEPJUHHUSA-N 0 0 324.251 5.874 20 0 DKADRN CO[C@H](C)c1cccc(N[C@@H](C)c2ccc(Cl)c(Cl)c2)c1 ZINC000439589539 338374043 /nfs/dbraw/zinc/37/40/43/338374043.db2.gz IDVPSTHFWLAQLA-NWDGAFQWSA-N 0 0 324.251 5.874 20 0 DKADRN CO[C@@H](C)c1cccc(N[C@@H](C)c2ccc(Cl)c(Cl)c2)c1 ZINC000439589540 338374016 /nfs/dbraw/zinc/37/40/16/338374016.db2.gz IDVPSTHFWLAQLA-RYUDHWBXSA-N 0 0 324.251 5.874 20 0 DKADRN CO[C@H](C)c1cccc(N[C@H](C)c2ccc(Cl)c(Cl)c2)c1 ZINC000439589542 338373987 /nfs/dbraw/zinc/37/39/87/338373987.db2.gz IDVPSTHFWLAQLA-VXGBXAGGSA-N 0 0 324.251 5.874 20 0 DKADRN CCSCc1cccc(N[C@H](C)c2c(F)cccc2F)c1 ZINC000439589725 338374039 /nfs/dbraw/zinc/37/40/39/338374039.db2.gz APGZNMSUCUXGAM-GFCCVEGCSA-N 0 0 307.409 5.391 20 0 DKADRN CCSCc1cccc(N[C@@H](C)c2c(F)cccc2F)c1 ZINC000439589727 338373973 /nfs/dbraw/zinc/37/39/73/338373973.db2.gz APGZNMSUCUXGAM-LBPRGKRZSA-N 0 0 307.409 5.391 20 0 DKADRN C[C@@H](Nc1ccc(CC(F)(F)F)cc1)c1ccccc1Cl ZINC000439590152 338374008 /nfs/dbraw/zinc/37/40/08/338374008.db2.gz BETBFYADJPGAGL-LLVKDONJSA-N 0 0 313.750 5.618 20 0 DKADRN C[C@H](Nc1ccc(CC(F)(F)F)cc1)c1ccccc1Cl ZINC000439590153 338374003 /nfs/dbraw/zinc/37/40/03/338374003.db2.gz BETBFYADJPGAGL-NSHDSACASA-N 0 0 313.750 5.618 20 0 DKADRN CC[C@H](Nc1ccc(CC(F)(F)F)cc1)c1ccc(F)cc1 ZINC000439590218 338373997 /nfs/dbraw/zinc/37/39/97/338373997.db2.gz BRUKDPUTTKPVAO-INIZCTEOSA-N 0 0 311.322 5.494 20 0 DKADRN CC[C@@H](Nc1ccc(CC(F)(F)F)cc1)c1ccc(F)cc1 ZINC000439590222 338373980 /nfs/dbraw/zinc/37/39/80/338373980.db2.gz BRUKDPUTTKPVAO-MRXNPFEDSA-N 0 0 311.322 5.494 20 0 DKADRN CCSCc1cccc(N[C@H](C)c2ccc(F)c(F)c2)c1 ZINC000439590231 338374050 /nfs/dbraw/zinc/37/40/50/338374050.db2.gz BSTTWWKTQBBCQI-GFCCVEGCSA-N 0 0 307.409 5.391 20 0 DKADRN CCSCc1cccc(N[C@@H](C)c2ccc(F)c(F)c2)c1 ZINC000439590232 338374052 /nfs/dbraw/zinc/37/40/52/338374052.db2.gz BSTTWWKTQBBCQI-LBPRGKRZSA-N 0 0 307.409 5.391 20 0 DKADRN CCSCc1cccc(N[C@H](C)c2cc(F)ccc2F)c1 ZINC000439590858 338374005 /nfs/dbraw/zinc/37/40/05/338374005.db2.gz BFJOQKCGRVBFSN-GFCCVEGCSA-N 0 0 307.409 5.391 20 0 DKADRN CCSCc1cccc(N[C@@H](C)c2cc(F)ccc2F)c1 ZINC000439590859 338374082 /nfs/dbraw/zinc/37/40/82/338374082.db2.gz BFJOQKCGRVBFSN-LBPRGKRZSA-N 0 0 307.409 5.391 20 0 DKADRN Cc1cccc([C@H](C)Nc2ccc(Oc3ccccn3)cc2)c1 ZINC000439591084 338374130 /nfs/dbraw/zinc/37/41/30/338374130.db2.gz FZLCURBHJDHEKY-INIZCTEOSA-N 0 0 304.393 5.355 20 0 DKADRN Cc1cccc([C@@H](C)Nc2ccc(Oc3ccccn3)cc2)c1 ZINC000439591085 338374071 /nfs/dbraw/zinc/37/40/71/338374071.db2.gz FZLCURBHJDHEKY-MRXNPFEDSA-N 0 0 304.393 5.355 20 0 DKADRN CCSCc1cccc(N[C@H](C)c2ccc(F)cc2F)c1 ZINC000439591592 338374126 /nfs/dbraw/zinc/37/41/26/338374126.db2.gz BPPUZJACSGAYDP-GFCCVEGCSA-N 0 0 307.409 5.391 20 0 DKADRN CCSCc1cccc(N[C@@H](C)c2ccc(F)cc2F)c1 ZINC000439591593 334192205 /nfs/dbraw/zinc/19/22/05/334192205.db2.gz BPPUZJACSGAYDP-LBPRGKRZSA-N 0 0 307.409 5.391 20 0 DKADRN C[C@H](Nc1ccc(Oc2ccccn2)cc1)c1cccc(F)c1 ZINC000439593786 338374104 /nfs/dbraw/zinc/37/41/04/338374104.db2.gz JMRCACDKUFLWGF-AWEZNQCLSA-N 0 0 308.356 5.186 20 0 DKADRN C[C@@H](Nc1ccc(Oc2ccccn2)cc1)c1cccc(F)c1 ZINC000439593787 338374111 /nfs/dbraw/zinc/37/41/11/338374111.db2.gz JMRCACDKUFLWGF-CQSZACIVSA-N 0 0 308.356 5.186 20 0 DKADRN COc1ccccc1-c1ccc([C@H](C)Nc2ncccc2F)cc1 ZINC000439600179 338374250 /nfs/dbraw/zinc/37/42/50/338374250.db2.gz ZAFQEFPRHSYJIT-AWEZNQCLSA-N 0 0 322.383 5.069 20 0 DKADRN COc1ccccc1-c1ccc([C@@H](C)Nc2ncccc2F)cc1 ZINC000439600182 338374239 /nfs/dbraw/zinc/37/42/39/338374239.db2.gz ZAFQEFPRHSYJIT-CQSZACIVSA-N 0 0 322.383 5.069 20 0 DKADRN C[C@@H](Nc1ccc(CC(F)(F)F)cc1)c1cccc(Cl)c1 ZINC000439600609 338374260 /nfs/dbraw/zinc/37/42/60/338374260.db2.gz WOLXDFZHEIISDT-LLVKDONJSA-N 0 0 313.750 5.618 20 0 DKADRN C[C@H](Nc1ccc(CC(F)(F)F)cc1)c1cccc(Cl)c1 ZINC000439600610 338374237 /nfs/dbraw/zinc/37/42/37/338374237.db2.gz WOLXDFZHEIISDT-NSHDSACASA-N 0 0 313.750 5.618 20 0 DKADRN CO[C@@H](C)c1cccc(N[C@H](C)c2ccc(Cl)cc2Cl)c1 ZINC000439601133 338374256 /nfs/dbraw/zinc/37/42/56/338374256.db2.gz ZPSMMVLWIVEHGP-NEPJUHHUSA-N 0 0 324.251 5.874 20 0 DKADRN CO[C@H](C)c1cccc(N[C@@H](C)c2ccc(Cl)cc2Cl)c1 ZINC000439601134 338374180 /nfs/dbraw/zinc/37/41/80/338374180.db2.gz ZPSMMVLWIVEHGP-NWDGAFQWSA-N 0 0 324.251 5.874 20 0 DKADRN CO[C@@H](C)c1cccc(N[C@@H](C)c2ccc(Cl)cc2Cl)c1 ZINC000439601135 338374187 /nfs/dbraw/zinc/37/41/87/338374187.db2.gz ZPSMMVLWIVEHGP-RYUDHWBXSA-N 0 0 324.251 5.874 20 0 DKADRN CO[C@H](C)c1cccc(N[C@H](C)c2ccc(Cl)cc2Cl)c1 ZINC000439601136 338374178 /nfs/dbraw/zinc/37/41/78/338374178.db2.gz ZPSMMVLWIVEHGP-VXGBXAGGSA-N 0 0 324.251 5.874 20 0 DKADRN Cc1cc2cc(N[C@H](C)c3ccc(OC(F)F)cc3)ccc2[nH]1 ZINC000439601682 338374301 /nfs/dbraw/zinc/37/43/01/338374301.db2.gz BTSJPCFZRMCLPS-GFCCVEGCSA-N 0 0 316.351 5.251 20 0 DKADRN Cc1cc2cc(N[C@@H](C)c3ccc(OC(F)F)cc3)ccc2[nH]1 ZINC000439601684 338374374 /nfs/dbraw/zinc/37/43/74/338374374.db2.gz BTSJPCFZRMCLPS-LBPRGKRZSA-N 0 0 316.351 5.251 20 0 DKADRN Cc1cscc1NC(=O)c1cccc(Nc2ccccc2)c1 ZINC000439601935 338374305 /nfs/dbraw/zinc/37/43/05/338374305.db2.gz CKKPBMACVMMHMV-UHFFFAOYSA-N 0 0 308.406 5.052 20 0 DKADRN Cc1cscc1NC(=O)c1ccccc1Oc1ccccc1 ZINC000439603208 338374382 /nfs/dbraw/zinc/37/43/82/338374382.db2.gz JWHJGDNWBQXIIT-UHFFFAOYSA-N 0 0 309.390 5.101 20 0 DKADRN Cc1cscc1NC(=O)[C@H](c1cccc(Cl)c1)C(C)C ZINC000439604389 338374340 /nfs/dbraw/zinc/37/43/40/338374340.db2.gz PVGBZEVRCYABBH-HNNXBMFYSA-N 0 0 307.846 5.088 20 0 DKADRN Cc1cscc1NC(=O)[C@@H](c1cccc(Cl)c1)C(C)C ZINC000439604390 338374373 /nfs/dbraw/zinc/37/43/73/338374373.db2.gz PVGBZEVRCYABBH-OAHLLOKOSA-N 0 0 307.846 5.088 20 0 DKADRN Cc1cscc1NC(=O)c1cc(C)n(C2CCCCC2)c1C ZINC000439604801 338374295 /nfs/dbraw/zinc/37/42/95/338374295.db2.gz SWKNIDPDTSBNOH-UHFFFAOYSA-N 0 0 316.470 5.232 20 0 DKADRN Cc1cscc1NC(=O)c1ccccc1N(C)c1ccccc1 ZINC000439605159 338374372 /nfs/dbraw/zinc/37/43/72/338374372.db2.gz XZUJYDPBLCLJAH-UHFFFAOYSA-N 0 0 322.433 5.077 20 0 DKADRN Cc1cscc1NC(=O)c1c[nH]cc1-c1ccc(Cl)s1 ZINC000439605356 338374461 /nfs/dbraw/zinc/37/44/61/338374461.db2.gz ZXXRNOKDTSOLFE-UHFFFAOYSA-N 0 0 322.842 5.019 20 0 DKADRN Cc1cscc1NC(=O)c1ccccc1CCc1ccccc1 ZINC000439605836 338374413 /nfs/dbraw/zinc/37/44/13/338374413.db2.gz CFYQGWXBVLEDGZ-UHFFFAOYSA-N 0 0 321.445 5.094 20 0 DKADRN C[C@@H](Nc1ccc(CC(F)(F)F)cc1)c1ccc(Cl)cc1 ZINC000439611740 338374517 /nfs/dbraw/zinc/37/45/17/338374517.db2.gz PTHLKPAJMWXBHW-LLVKDONJSA-N 0 0 313.750 5.618 20 0 DKADRN C[C@H](Nc1ccc(CC(F)(F)F)cc1)c1ccc(Cl)cc1 ZINC000439611742 338374505 /nfs/dbraw/zinc/37/45/05/338374505.db2.gz PTHLKPAJMWXBHW-NSHDSACASA-N 0 0 313.750 5.618 20 0 DKADRN C[C@@H](Nc1ccc(COCc2ccccc2)cc1)c1ccccc1 ZINC000439611888 338374514 /nfs/dbraw/zinc/37/45/14/338374514.db2.gz IJRDSWQJOZJHEE-GOSISDBHSA-N 0 0 317.432 5.577 20 0 DKADRN C[C@H](Nc1ccc(COCc2ccccc2)cc1)c1ccccc1 ZINC000439611889 338374552 /nfs/dbraw/zinc/37/45/52/338374552.db2.gz IJRDSWQJOZJHEE-SFHVURJKSA-N 0 0 317.432 5.577 20 0 DKADRN Cc1cscc1NC(=O)C(C)(c1ccccc1)c1ccccc1 ZINC000439614859 338374654 /nfs/dbraw/zinc/37/46/54/338374654.db2.gz DXKMFVHMGWWOOS-UHFFFAOYSA-N 0 0 321.445 5.001 20 0 DKADRN Cc1ccnc(Oc2cc(N[C@@H](C)c3ccccc3)ccc2C)c1 ZINC000439616451 338374601 /nfs/dbraw/zinc/37/46/01/338374601.db2.gz RJRNPEKGVSWLDH-KRWDZBQOSA-N 0 0 318.420 5.664 20 0 DKADRN Cc1ccnc(Oc2cc(N[C@H](C)c3ccccc3)ccc2C)c1 ZINC000439616452 338374628 /nfs/dbraw/zinc/37/46/28/338374628.db2.gz RJRNPEKGVSWLDH-QGZVFWFLSA-N 0 0 318.420 5.664 20 0 DKADRN C[C@H](Nc1ccc(Oc2ccc(Cl)cn2)cc1)c1ccccc1 ZINC000439617396 338374798 /nfs/dbraw/zinc/37/47/98/338374798.db2.gz JTGQHLYGZCJGFH-AWEZNQCLSA-N 0 0 324.811 5.700 20 0 DKADRN C[C@@H](Nc1ccc(Oc2ccc(Cl)cn2)cc1)c1ccccc1 ZINC000439617397 338374722 /nfs/dbraw/zinc/37/47/22/338374722.db2.gz JTGQHLYGZCJGFH-CQSZACIVSA-N 0 0 324.811 5.700 20 0 DKADRN Cc1cscc1NC(=O)c1cccc(N[C@@H](C)C(C)C)c1C ZINC000439620157 338374752 /nfs/dbraw/zinc/37/47/52/338374752.db2.gz SIHHWYLQOWRKKP-AWEZNQCLSA-N 0 0 316.470 5.074 20 0 DKADRN Cc1cscc1NC(=O)c1cccc(N[C@H](C)C(C)C)c1C ZINC000439620158 338374744 /nfs/dbraw/zinc/37/47/44/338374744.db2.gz SIHHWYLQOWRKKP-CQSZACIVSA-N 0 0 316.470 5.074 20 0 DKADRN Cc1cscc1NC(=O)c1cc(C2CC2)nc2ccc(C)cc21 ZINC000439624204 338374965 /nfs/dbraw/zinc/37/49/65/338374965.db2.gz LZSHJMWAJKBVTJ-UHFFFAOYSA-N 0 0 322.433 5.043 20 0 DKADRN Cc1cscc1NC(=O)c1ccccc1OC1CCCCC1 ZINC000439634080 338375194 /nfs/dbraw/zinc/37/51/94/338375194.db2.gz NAZLXCBHWHMKNA-UHFFFAOYSA-N 0 0 315.438 5.020 20 0 DKADRN Cc1cscc1NC(=O)[C@H](C)c1ccc(Cl)c(Cl)c1 ZINC000439634638 338375190 /nfs/dbraw/zinc/37/51/90/338375190.db2.gz OLEXYMJGOZBVTO-SECBINFHSA-N 0 0 314.237 5.106 20 0 DKADRN Cc1cscc1NC(=O)[C@@H](C)c1ccc(Cl)c(Cl)c1 ZINC000439634640 338375133 /nfs/dbraw/zinc/37/51/33/338375133.db2.gz OLEXYMJGOZBVTO-VIFPVBQESA-N 0 0 314.237 5.106 20 0 DKADRN Cc1cscc1NC(=O)c1oc2c(ccc3ccccc23)c1C ZINC000439638258 338375289 /nfs/dbraw/zinc/37/52/89/338375289.db2.gz IPLVFENCAYIDOK-UHFFFAOYSA-N 0 0 321.401 5.517 20 0 DKADRN CC[C@H](Nc1cccc(Oc2ccccn2)c1)c1ccc(F)cc1 ZINC000439639835 338375242 /nfs/dbraw/zinc/37/52/42/338375242.db2.gz AKKYPMBNYFJZRU-IBGZPJMESA-N 0 0 322.383 5.576 20 0 DKADRN CC[C@@H](Nc1cccc(Oc2ccccn2)c1)c1ccc(F)cc1 ZINC000439639839 338375278 /nfs/dbraw/zinc/37/52/78/338375278.db2.gz AKKYPMBNYFJZRU-LJQANCHMSA-N 0 0 322.383 5.576 20 0 DKADRN Cc1cccc(C(=O)Nc2ccc(CCC(F)(F)F)cc2)c1C ZINC000439645310 338375254 /nfs/dbraw/zinc/37/52/54/338375254.db2.gz IYDXTTIALWNQQS-UHFFFAOYSA-N 0 0 321.342 5.051 20 0 DKADRN CC[C@H](Nc1cccc(Oc2ccccn2)c1)c1ccccc1 ZINC000439647915 338375429 /nfs/dbraw/zinc/37/54/29/338375429.db2.gz MZKKOCRYBINZHX-IBGZPJMESA-N 0 0 304.393 5.437 20 0 DKADRN CC[C@@H](Nc1cccc(Oc2ccccn2)c1)c1ccccc1 ZINC000439647916 338375393 /nfs/dbraw/zinc/37/53/93/338375393.db2.gz MZKKOCRYBINZHX-LJQANCHMSA-N 0 0 304.393 5.437 20 0 DKADRN O=C(CC1=CCCCC1)Nc1ccc(CCC(F)(F)F)cc1 ZINC000439649189 338375398 /nfs/dbraw/zinc/37/53/98/338375398.db2.gz BLCJMWBCYWFTCG-UHFFFAOYSA-N 0 0 311.347 5.011 20 0 DKADRN C[C@H](Nc1cccc(Oc2ccccn2)c1)c1ccccc1Cl ZINC000439649328 338375365 /nfs/dbraw/zinc/37/53/65/338375365.db2.gz PGODMWOXXRUEQB-AWEZNQCLSA-N 0 0 324.811 5.700 20 0 DKADRN C[C@@H](Nc1cccc(Oc2ccccn2)c1)c1ccccc1Cl ZINC000439649330 338375336 /nfs/dbraw/zinc/37/53/36/338375336.db2.gz PGODMWOXXRUEQB-CQSZACIVSA-N 0 0 324.811 5.700 20 0 DKADRN C[C@H](Nc1cccc(Oc2ccccn2)c1)c1ccc(Cl)cc1 ZINC000439650122 338375360 /nfs/dbraw/zinc/37/53/60/338375360.db2.gz PWBQAHIWBBDTAX-AWEZNQCLSA-N 0 0 324.811 5.700 20 0 DKADRN C[C@@H](Nc1cccc(Oc2ccccn2)c1)c1ccc(Cl)cc1 ZINC000439650125 338375366 /nfs/dbraw/zinc/37/53/66/338375366.db2.gz PWBQAHIWBBDTAX-CQSZACIVSA-N 0 0 324.811 5.700 20 0 DKADRN Cc1cscc1NC(=O)C1(Sc2ccccc2)CCCC1 ZINC000439652158 338375392 /nfs/dbraw/zinc/37/53/92/338375392.db2.gz VIJNCTWDMDWTCK-UHFFFAOYSA-N 0 0 317.479 5.100 20 0 DKADRN C[C@H](Nc1cccc(Oc2ccccn2)c1)c1ccccc1F ZINC000439652237 338375384 /nfs/dbraw/zinc/37/53/84/338375384.db2.gz SXXGPQRDHQWJDX-AWEZNQCLSA-N 0 0 308.356 5.186 20 0 DKADRN C[C@@H](Nc1cccc(Oc2ccccn2)c1)c1ccccc1F ZINC000439652239 338375404 /nfs/dbraw/zinc/37/54/04/338375404.db2.gz SXXGPQRDHQWJDX-CQSZACIVSA-N 0 0 308.356 5.186 20 0 DKADRN Cc1ccc(C(=O)Nc2ccc(CCC(F)(F)F)cc2)c(C)c1 ZINC000439652594 338375495 /nfs/dbraw/zinc/37/54/95/338375495.db2.gz UJCYABNCLDAIFL-UHFFFAOYSA-N 0 0 321.342 5.051 20 0 DKADRN C[C@H](Nc1cccc(Oc2ccccn2)c1)c1cccc(F)c1 ZINC000439653213 338375483 /nfs/dbraw/zinc/37/54/83/338375483.db2.gz UTUNLAFXHBKKEJ-AWEZNQCLSA-N 0 0 308.356 5.186 20 0 DKADRN C[C@@H](Nc1cccc(Oc2ccccn2)c1)c1cccc(F)c1 ZINC000439653214 338375473 /nfs/dbraw/zinc/37/54/73/338375473.db2.gz UTUNLAFXHBKKEJ-CQSZACIVSA-N 0 0 308.356 5.186 20 0 DKADRN Cc1ccc(C)c(C(=O)Nc2ccc(CCC(F)(F)F)cc2)c1 ZINC000439654593 338375492 /nfs/dbraw/zinc/37/54/92/338375492.db2.gz WRSXTVYGTUAOQM-UHFFFAOYSA-N 0 0 321.342 5.051 20 0 DKADRN C[C@H](Nc1cccc(Oc2ccccn2)c1)c1ccc(F)cc1 ZINC000439659894 338375581 /nfs/dbraw/zinc/37/55/81/338375581.db2.gz HURRSIGTAPTGOO-AWEZNQCLSA-N 0 0 308.356 5.186 20 0 DKADRN C[C@@H](Nc1cccc(Oc2ccccn2)c1)c1ccc(F)cc1 ZINC000439659895 338375556 /nfs/dbraw/zinc/37/55/56/338375556.db2.gz HURRSIGTAPTGOO-CQSZACIVSA-N 0 0 308.356 5.186 20 0 DKADRN CC(C)(C)CCCC(=O)Nc1cnccc1-c1cccc(F)c1 ZINC000439668139 338375725 /nfs/dbraw/zinc/37/57/25/338375725.db2.gz USPCEMDMWLCXBV-UHFFFAOYSA-N 0 0 314.404 5.043 20 0 DKADRN Cc1ccc(F)cc1NC(=O)[C@@H](C)c1ccc2ccccc2c1 ZINC000439669306 338375741 /nfs/dbraw/zinc/37/57/41/338375741.db2.gz DJCVYCMSCISVIB-AWEZNQCLSA-N 0 0 307.368 5.030 20 0 DKADRN Cc1ccc(F)cc1NC(=O)[C@H](C)c1ccc2ccccc2c1 ZINC000439669311 338375709 /nfs/dbraw/zinc/37/57/09/338375709.db2.gz DJCVYCMSCISVIB-CQSZACIVSA-N 0 0 307.368 5.030 20 0 DKADRN C[C@H](Nc1cccc(Oc2ccccn2)c1)c1cccc(Cl)c1 ZINC000439672762 338375686 /nfs/dbraw/zinc/37/56/86/338375686.db2.gz MARLFWUCLRXTCI-AWEZNQCLSA-N 0 0 324.811 5.700 20 0 DKADRN C[C@@H](Nc1cccc(Oc2ccccn2)c1)c1cccc(Cl)c1 ZINC000439672764 338375668 /nfs/dbraw/zinc/37/56/68/338375668.db2.gz MARLFWUCLRXTCI-CQSZACIVSA-N 0 0 324.811 5.700 20 0 DKADRN C[C@@H](C(=O)Nc1ccccc1Cl)c1ccc2ccccc2c1 ZINC000439683820 338375867 /nfs/dbraw/zinc/37/58/67/338375867.db2.gz IZSCEFGGVSQKHZ-CYBMUJFWSA-N 0 0 309.796 5.235 20 0 DKADRN C[C@H](C(=O)Nc1ccccc1Cl)c1ccc2ccccc2c1 ZINC000439683821 338375925 /nfs/dbraw/zinc/37/59/25/338375925.db2.gz IZSCEFGGVSQKHZ-ZDUSSCGKSA-N 0 0 309.796 5.235 20 0 DKADRN Cc1cccc(NC(=O)[C@@H](C)c2ccc3ccccc3c2)c1C ZINC000439687745 338375964 /nfs/dbraw/zinc/37/59/64/338375964.db2.gz NRUVVULSMMMVML-INIZCTEOSA-N 0 0 303.405 5.199 20 0 DKADRN Cc1cccc(NC(=O)[C@H](C)c2ccc3ccccc3c2)c1C ZINC000439687747 338375962 /nfs/dbraw/zinc/37/59/62/338375962.db2.gz NRUVVULSMMMVML-MRXNPFEDSA-N 0 0 303.405 5.199 20 0 DKADRN Cc1cc(F)ccc1NC(=O)[C@@H](C)c1ccc2ccccc2c1 ZINC000439702225 338376123 /nfs/dbraw/zinc/37/61/23/338376123.db2.gz NAWRYYINKISOKE-AWEZNQCLSA-N 0 0 307.368 5.030 20 0 DKADRN Cc1cc(F)ccc1NC(=O)[C@H](C)c1ccc2ccccc2c1 ZINC000439702226 338376154 /nfs/dbraw/zinc/37/61/54/338376154.db2.gz NAWRYYINKISOKE-CQSZACIVSA-N 0 0 307.368 5.030 20 0 DKADRN CCOCCSCc1cnc(-c2ccc(C(C)C)cc2)s1 ZINC000439710377 338376393 /nfs/dbraw/zinc/37/63/93/338376393.db2.gz OOAFGTBBJBXRLS-UHFFFAOYSA-N 0 0 321.511 5.203 20 0 DKADRN C[C@H](c1ccccc1)N(C)C(=O)[C@@H](C)c1ccc2ccccc2c1 ZINC000439711594 338376378 /nfs/dbraw/zinc/37/63/78/338376378.db2.gz UYBUMCCWFBIJDK-DLBZAZTESA-N 0 0 317.432 5.163 20 0 DKADRN C[C@@H](C(=O)N(C)[C@H](C)c1ccccc1)c1ccc2ccccc2c1 ZINC000439711595 338376326 /nfs/dbraw/zinc/37/63/26/338376326.db2.gz UYBUMCCWFBIJDK-IAGOWNOFSA-N 0 0 317.432 5.163 20 0 DKADRN C[C@H](C(=O)N(C)[C@@H](C)c1ccccc1)c1ccc2ccccc2c1 ZINC000439711596 338376308 /nfs/dbraw/zinc/37/63/08/338376308.db2.gz UYBUMCCWFBIJDK-IRXDYDNUSA-N 0 0 317.432 5.163 20 0 DKADRN C[C@@H](C(=O)N(C)[C@@H](C)c1ccccc1)c1ccc2ccccc2c1 ZINC000439711597 338376349 /nfs/dbraw/zinc/37/63/49/338376349.db2.gz UYBUMCCWFBIJDK-SJORKVTESA-N 0 0 317.432 5.163 20 0 DKADRN Cc1ccc(F)c(NC(=O)[C@@H](C)c2ccc3ccccc3c2)c1 ZINC000439715971 338376453 /nfs/dbraw/zinc/37/64/53/338376453.db2.gz AMKXXYSJGLJDEH-AWEZNQCLSA-N 0 0 307.368 5.030 20 0 DKADRN Cc1ccc(F)c(NC(=O)[C@H](C)c2ccc3ccccc3c2)c1 ZINC000439715973 338376424 /nfs/dbraw/zinc/37/64/24/338376424.db2.gz AMKXXYSJGLJDEH-CQSZACIVSA-N 0 0 307.368 5.030 20 0 DKADRN CCN(Cc1cccs1)C(=O)[C@@H](C)c1ccc2ccccc2c1 ZINC000439724752 338376533 /nfs/dbraw/zinc/37/65/33/338376533.db2.gz UANMPNBRBZUTTA-HNNXBMFYSA-N 0 0 323.461 5.054 20 0 DKADRN CCN(Cc1cccs1)C(=O)[C@H](C)c1ccc2ccccc2c1 ZINC000439724753 338376584 /nfs/dbraw/zinc/37/65/84/338376584.db2.gz UANMPNBRBZUTTA-OAHLLOKOSA-N 0 0 323.461 5.054 20 0 DKADRN Cc1c(F)cccc1NC(=O)[C@H](C)c1ccc2ccccc2c1 ZINC000439752911 338377165 /nfs/dbraw/zinc/37/71/65/338377165.db2.gz ZGEVDNROKVZXSJ-CYBMUJFWSA-N 0 0 307.368 5.030 20 0 DKADRN Cc1c(F)cccc1NC(=O)[C@@H](C)c1ccc2ccccc2c1 ZINC000439752912 338377158 /nfs/dbraw/zinc/37/71/58/338377158.db2.gz ZGEVDNROKVZXSJ-ZDUSSCGKSA-N 0 0 307.368 5.030 20 0 DKADRN O=C(Nc1ccc(F)c(C2CC2)c1)N1CCC[C@H]1c1ccccc1 ZINC000439778115 338377725 /nfs/dbraw/zinc/37/77/25/338377725.db2.gz BFTSNEXZLNSQJS-IBGZPJMESA-N 0 0 324.399 5.072 20 0 DKADRN O=C(Nc1ccc(F)c(C2CC2)c1)N1CCC[C@@H]1c1ccccc1 ZINC000439778116 338377766 /nfs/dbraw/zinc/37/77/66/338377766.db2.gz BFTSNEXZLNSQJS-LJQANCHMSA-N 0 0 324.399 5.072 20 0 DKADRN Cc1cc(C)c(NC(=O)[C@@H](C)c2ccc3ccccc3c2)c(C)c1 ZINC000439779319 338377644 /nfs/dbraw/zinc/37/76/44/338377644.db2.gz HNNMRXKQDNKXBC-KRWDZBQOSA-N 0 0 317.432 5.507 20 0 DKADRN Cc1cc(C)c(NC(=O)[C@H](C)c2ccc3ccccc3c2)c(C)c1 ZINC000439779320 338377752 /nfs/dbraw/zinc/37/77/52/338377752.db2.gz HNNMRXKQDNKXBC-QGZVFWFLSA-N 0 0 317.432 5.507 20 0 DKADRN Cc1cc(CCCC(=O)Nc2c(C)cc(C)cc2C)c(C)s1 ZINC000439780911 338377877 /nfs/dbraw/zinc/37/78/77/338377877.db2.gz MFBVRBCQXFXBDN-UHFFFAOYSA-N 0 0 315.482 5.252 20 0 DKADRN CCc1cccc(C)c1NC(=O)CCCc1cc(C)sc1C ZINC000439789237 338378141 /nfs/dbraw/zinc/37/81/41/338378141.db2.gz KBVTYFFYFNZACV-UHFFFAOYSA-N 0 0 315.482 5.197 20 0 DKADRN CCc1ccccc1NC(=O)[C@@H](C)c1ccc2ccccc2c1 ZINC000439791752 338378218 /nfs/dbraw/zinc/37/82/18/338378218.db2.gz XRLGKVIRZXYUPB-HNNXBMFYSA-N 0 0 303.405 5.144 20 0 DKADRN CCc1ccccc1NC(=O)[C@H](C)c1ccc2ccccc2c1 ZINC000439791753 338378245 /nfs/dbraw/zinc/37/82/45/338378245.db2.gz XRLGKVIRZXYUPB-OAHLLOKOSA-N 0 0 303.405 5.144 20 0 DKADRN CCc1cccc(C)c1NC(=O)[C@@H](C)c1ccc2ccccc2c1 ZINC000439793702 338378346 /nfs/dbraw/zinc/37/83/46/338378346.db2.gz OEOHREMMJUHJIM-INIZCTEOSA-N 0 0 317.432 5.453 20 0 DKADRN CCc1cccc(C)c1NC(=O)[C@H](C)c1ccc2ccccc2c1 ZINC000439793705 338378345 /nfs/dbraw/zinc/37/83/45/338378345.db2.gz OEOHREMMJUHJIM-MRXNPFEDSA-N 0 0 317.432 5.453 20 0 DKADRN CC[C@H](C)Sc1ccc(NC(=O)CCc2ccoc2)c(C)c1 ZINC000439809063 338378867 /nfs/dbraw/zinc/37/88/67/338378867.db2.gz QRZAIBLLKXRDJT-AWEZNQCLSA-N 0 0 317.454 5.050 20 0 DKADRN CC[C@@H](C)Sc1ccc(NC(=O)CCc2ccoc2)c(C)c1 ZINC000439809075 338378860 /nfs/dbraw/zinc/37/88/60/338378860.db2.gz QRZAIBLLKXRDJT-CQSZACIVSA-N 0 0 317.454 5.050 20 0 DKADRN C[C@@H](c1ccccc1)N(C(=O)CCc1ccoc1)c1ccccc1 ZINC000439810484 338378927 /nfs/dbraw/zinc/37/89/27/338378927.db2.gz BNORIGQJPYAHQG-KRWDZBQOSA-N 0 0 319.404 5.007 20 0 DKADRN C[C@H](c1ccccc1)N(C(=O)CCc1ccoc1)c1ccccc1 ZINC000439810487 338378976 /nfs/dbraw/zinc/37/89/76/338378976.db2.gz BNORIGQJPYAHQG-QGZVFWFLSA-N 0 0 319.404 5.007 20 0 DKADRN Cc1ccc(-c2ccncc2)cc1NC(=O)C(C)(C)CC(C)C ZINC000439811923 338379011 /nfs/dbraw/zinc/37/90/11/338379011.db2.gz ZPOCSOBHEBWRGQ-UHFFFAOYSA-N 0 0 310.441 5.068 20 0 DKADRN C[C@H](C(=O)Nc1cccc2[nH]ccc21)c1ccc2ccccc2c1 ZINC000439812573 338379017 /nfs/dbraw/zinc/37/90/17/338379017.db2.gz TUTRDZLAJPDUDK-AWEZNQCLSA-N 0 0 314.388 5.063 20 0 DKADRN C[C@@H](C(=O)Nc1cccc2[nH]ccc21)c1ccc2ccccc2c1 ZINC000439812574 338378901 /nfs/dbraw/zinc/37/89/01/338378901.db2.gz TUTRDZLAJPDUDK-CQSZACIVSA-N 0 0 314.388 5.063 20 0 DKADRN Cc1cc(CCCC(=O)Nc2cccc(C(F)F)c2)c(C)s1 ZINC000439816293 338379082 /nfs/dbraw/zinc/37/90/82/338379082.db2.gz GTFFCVFFYVHRJI-UHFFFAOYSA-N 0 0 323.408 5.264 20 0 DKADRN Cc1ccccc1CCCSCc1cc2ccccc2[nH]c1=O ZINC000439874031 338379958 /nfs/dbraw/zinc/37/99/58/338379958.db2.gz VWQINCKTPGBJNL-UHFFFAOYSA-N 0 0 323.461 5.115 20 0 DKADRN CO[C@@H](C)c1nc(CSCCCc2ccccc2C)cs1 ZINC000439907900 338380683 /nfs/dbraw/zinc/38/06/83/338380683.db2.gz BQEQKIMQBLIRJI-AWEZNQCLSA-N 0 0 321.511 5.025 20 0 DKADRN CO[C@H](C)c1nc(CSCCCc2ccccc2C)cs1 ZINC000439907902 338380685 /nfs/dbraw/zinc/38/06/85/338380685.db2.gz BQEQKIMQBLIRJI-CQSZACIVSA-N 0 0 321.511 5.025 20 0 DKADRN C[C@H](C(=O)Nc1ccc2[nH]ccc2c1)c1ccc2ccccc2c1 ZINC000439912174 338380621 /nfs/dbraw/zinc/38/06/21/338380621.db2.gz JSJCSOAASSVFMD-AWEZNQCLSA-N 0 0 314.388 5.063 20 0 DKADRN C[C@@H](C(=O)Nc1ccc2[nH]ccc2c1)c1ccc2ccccc2c1 ZINC000439912176 338380705 /nfs/dbraw/zinc/38/07/05/338380705.db2.gz JSJCSOAASSVFMD-CQSZACIVSA-N 0 0 314.388 5.063 20 0 DKADRN Cc1ccccc1NC(=O)Nc1cc(Cl)c(Cl)cc1F ZINC000439958548 338381658 /nfs/dbraw/zinc/38/16/58/338381658.db2.gz RTZKLBMABPDNMR-UHFFFAOYSA-N 0 0 313.159 5.085 20 0 DKADRN C[C@@H](C(=O)N(C)[C@@H](C)c1cccs1)c1ccc2ccccc2c1 ZINC000439962860 338381851 /nfs/dbraw/zinc/38/18/51/338381851.db2.gz QYLXQFKEZVPVQE-CABCVRRESA-N 0 0 323.461 5.224 20 0 DKADRN C[C@H](C(=O)N(C)[C@@H](C)c1cccs1)c1ccc2ccccc2c1 ZINC000439962861 338381916 /nfs/dbraw/zinc/38/19/16/338381916.db2.gz QYLXQFKEZVPVQE-GJZGRUSLSA-N 0 0 323.461 5.224 20 0 DKADRN C[C@@H](C(=O)N(C)[C@H](C)c1cccs1)c1ccc2ccccc2c1 ZINC000439962862 338381849 /nfs/dbraw/zinc/38/18/49/338381849.db2.gz QYLXQFKEZVPVQE-HUUCEWRRSA-N 0 0 323.461 5.224 20 0 DKADRN C[C@H](c1cccs1)N(C)C(=O)[C@@H](C)c1ccc2ccccc2c1 ZINC000439962863 338381901 /nfs/dbraw/zinc/38/19/01/338381901.db2.gz QYLXQFKEZVPVQE-LSDHHAIUSA-N 0 0 323.461 5.224 20 0 DKADRN Cc1cscc1NC(=O)Nc1cc(Cl)c(Cl)cc1F ZINC000439964698 338381913 /nfs/dbraw/zinc/38/19/13/338381913.db2.gz YXBOMSUHWWZMSG-UHFFFAOYSA-N 0 0 319.188 5.146 20 0 DKADRN CCN(C(=O)Nc1cc(Cl)c(Cl)cc1F)[C@H](C)C(C)C ZINC000439967261 338382024 /nfs/dbraw/zinc/38/20/24/338382024.db2.gz WQMIZFQUFMIIIX-SECBINFHSA-N 0 0 321.223 5.031 20 0 DKADRN CCN(C(=O)Nc1cc(Cl)c(Cl)cc1F)[C@@H](C)C(C)C ZINC000439967262 338381948 /nfs/dbraw/zinc/38/19/48/338381948.db2.gz WQMIZFQUFMIIIX-VIFPVBQESA-N 0 0 321.223 5.031 20 0 DKADRN Cc1cccc(NC(=O)Nc2ccc(CCC(F)(F)F)cc2)c1 ZINC000440253028 338384646 /nfs/dbraw/zinc/38/46/46/338384646.db2.gz GLYNRSADHLOCTD-UHFFFAOYSA-N 0 0 322.330 5.134 20 0 DKADRN Cc1ccc(NC(=O)Nc2ccc(CCC(F)(F)F)cc2)cc1 ZINC000440261101 338384889 /nfs/dbraw/zinc/38/48/89/338384889.db2.gz QJGKGFBGNBBHIS-UHFFFAOYSA-N 0 0 322.330 5.134 20 0 DKADRN Cc1cscc1NC(=O)c1cccc(NCC(C)(C)C)c1C ZINC000440289617 338385168 /nfs/dbraw/zinc/38/51/68/338385168.db2.gz IVTLGRKWVBPOJQ-UHFFFAOYSA-N 0 0 316.470 5.075 20 0 DKADRN CCC(CC)(C(=O)Nc1ccccc1Cl)c1ccccc1 ZINC000440355998 338386061 /nfs/dbraw/zinc/38/60/61/338386061.db2.gz NZDCRFKQNJLFHI-UHFFFAOYSA-N 0 0 301.817 5.037 20 0 DKADRN CC(C)c1ccccc1NC(=O)[C@H]1C[C@@]12CCCc1ccccc12 ZINC000440364758 338386281 /nfs/dbraw/zinc/38/62/81/338386281.db2.gz LVRNYOWNUHTITD-DENIHFKCSA-N 0 0 319.448 5.043 20 0 DKADRN CC(C)c1ccccc1NC(=O)[C@H]1C[C@]12CCCc1ccccc12 ZINC000440364761 338386263 /nfs/dbraw/zinc/38/62/63/338386263.db2.gz LVRNYOWNUHTITD-KNQAVFIVSA-N 0 0 319.448 5.043 20 0 DKADRN CC(C)c1ccccc1NC(=O)[C@@H]1C[C@@]12CCCc1ccccc12 ZINC000440364763 338386251 /nfs/dbraw/zinc/38/62/51/338386251.db2.gz LVRNYOWNUHTITD-SIKLNZKXSA-N 0 0 319.448 5.043 20 0 DKADRN CC(C)c1ccccc1NC(=O)[C@@H]1C[C@]12CCCc1ccccc12 ZINC000440364764 338386295 /nfs/dbraw/zinc/38/62/95/338386295.db2.gz LVRNYOWNUHTITD-UGKGYDQZSA-N 0 0 319.448 5.043 20 0 DKADRN CC(C)c1ccc(NC(=O)CC[C@H]2CC[C@H](C)O2)c(C(C)C)c1 ZINC000440366071 338386196 /nfs/dbraw/zinc/38/61/96/338386196.db2.gz JORXMHIBNIYYIV-DOTOQJQBSA-N 0 0 317.473 5.220 20 0 DKADRN CC(C)c1ccc(NC(=O)CC[C@H]2CC[C@@H](C)O2)c(C(C)C)c1 ZINC000440366072 338386266 /nfs/dbraw/zinc/38/62/66/338386266.db2.gz JORXMHIBNIYYIV-NVXWUHKLSA-N 0 0 317.473 5.220 20 0 DKADRN CC(C)c1ccc(NC(=O)CC[C@@H]2CC[C@H](C)O2)c(C(C)C)c1 ZINC000440366073 338386296 /nfs/dbraw/zinc/38/62/96/338386296.db2.gz JORXMHIBNIYYIV-RDJZCZTQSA-N 0 0 317.473 5.220 20 0 DKADRN CC(C)c1ccc(NC(=O)CC[C@@H]2CC[C@@H](C)O2)c(C(C)C)c1 ZINC000440366074 338386234 /nfs/dbraw/zinc/38/62/34/338386234.db2.gz JORXMHIBNIYYIV-WBVHZDCISA-N 0 0 317.473 5.220 20 0 DKADRN CCC(CC)(C(=O)Nc1ccc2[nH]c(C)cc2c1)c1ccccc1 ZINC000440370276 338386354 /nfs/dbraw/zinc/38/63/54/338386354.db2.gz YDXPKWQXSPBEBX-UHFFFAOYSA-N 0 0 320.436 5.173 20 0 DKADRN CCC(CC)(C(=O)Nc1cccc(C(F)F)c1)c1ccccc1 ZINC000440389410 338386629 /nfs/dbraw/zinc/38/66/29/338386629.db2.gz UTUZQGKASNFUKO-UHFFFAOYSA-N 0 0 317.379 5.321 20 0 DKADRN COc1ccc2occ(C(=O)Nc3c(C)cccc3C(C)C)c2c1 ZINC000440443352 338387433 /nfs/dbraw/zinc/38/74/33/338387433.db2.gz MUYLJFBYFSYSFS-UHFFFAOYSA-N 0 0 323.392 5.126 20 0 DKADRN Cc1cc(C(C)(C)C)cc(C)c1C[NH2+]C(C)(C)c1nccs1 ZINC000440476184 338388043 /nfs/dbraw/zinc/38/80/43/338388043.db2.gz GSVWXAJDACQJAN-UHFFFAOYSA-N 0 0 316.514 5.082 20 0 DKADRN CC[C@@H](C)c1ccc([C@H](NC(=O)C2CC(F)(F)C2)C(C)C)cc1 ZINC000440535500 338389575 /nfs/dbraw/zinc/38/95/75/338389575.db2.gz LUKUASKNHYSRCG-CXAGYDPISA-N 0 0 323.427 5.059 20 0 DKADRN CC[C@@H](C)c1ccc([C@@H](NC(=O)C2CC(F)(F)C2)C(C)C)cc1 ZINC000440535502 338389534 /nfs/dbraw/zinc/38/95/34/338389534.db2.gz LUKUASKNHYSRCG-DYVFJYSZSA-N 0 0 323.427 5.059 20 0 DKADRN CC[C@H](C)c1ccc([C@@H](NC(=O)C2CC(F)(F)C2)C(C)C)cc1 ZINC000440535503 338389567 /nfs/dbraw/zinc/38/95/67/338389567.db2.gz LUKUASKNHYSRCG-GUYCJALGSA-N 0 0 323.427 5.059 20 0 DKADRN CC[C@H](C)c1ccc([C@H](NC(=O)C2CC(F)(F)C2)C(C)C)cc1 ZINC000440535505 338389622 /nfs/dbraw/zinc/38/96/22/338389622.db2.gz LUKUASKNHYSRCG-SUMWQHHRSA-N 0 0 323.427 5.059 20 0 DKADRN Cc1ccc(/C=C/CC(=O)N2CCC[C@H]2c2ccc(C)cc2)cc1 ZINC000440537026 338389590 /nfs/dbraw/zinc/38/95/90/338389590.db2.gz PCFYHXPQGBTPRY-GUWAZMKPSA-N 0 0 319.448 5.070 20 0 DKADRN Cc1ccc(/C=C/CC(=O)N2CCC[C@@H]2c2ccc(C)cc2)cc1 ZINC000440537027 338389554 /nfs/dbraw/zinc/38/95/54/338389554.db2.gz PCFYHXPQGBTPRY-LAEWNIMASA-N 0 0 319.448 5.070 20 0 DKADRN Cc1ccc(/C=C\CC(=O)N2CCC[C@H]2c2ccc(C)cc2)cc1 ZINC000440537028 338389577 /nfs/dbraw/zinc/38/95/77/338389577.db2.gz PCFYHXPQGBTPRY-OMUFJYGLSA-N 0 0 319.448 5.070 20 0 DKADRN Cc1ccc(/C=C\CC(=O)N2CCC[C@@H]2c2ccc(C)cc2)cc1 ZINC000440537029 338389611 /nfs/dbraw/zinc/38/96/11/338389611.db2.gz PCFYHXPQGBTPRY-VEBBDIFPSA-N 0 0 319.448 5.070 20 0 DKADRN CCc1cccc(CC)c1NC(=O)C/C=C/c1ccc(C)cc1 ZINC000440551935 338390079 /nfs/dbraw/zinc/39/00/79/338390079.db2.gz VSFWFIDSIDZVOW-SOFGYWHQSA-N 0 0 307.437 5.162 20 0 DKADRN CCc1cccc(CC)c1NC(=O)C/C=C\c1ccc(C)cc1 ZINC000440551938 338390051 /nfs/dbraw/zinc/39/00/51/338390051.db2.gz VSFWFIDSIDZVOW-VURMDHGXSA-N 0 0 307.437 5.162 20 0 DKADRN Cc1ccc(/C=C\CC(=O)N2CCCCC[C@@H]2c2ccco2)cc1 ZINC000440557311 338390253 /nfs/dbraw/zinc/39/02/53/338390253.db2.gz NGGAXLVFAIQEEQ-SUOMESGTSA-N 0 0 323.436 5.135 20 0 DKADRN Cc1ccc(/C=C\CC(=O)N2CCCCC[C@H]2c2ccco2)cc1 ZINC000440557312 338390250 /nfs/dbraw/zinc/39/02/50/338390250.db2.gz NGGAXLVFAIQEEQ-WPGJWXSHSA-N 0 0 323.436 5.135 20 0 DKADRN Cc1ccc(/C=C/CC(=O)N2CCCCC[C@@H]2c2ccco2)cc1 ZINC000440557313 338390240 /nfs/dbraw/zinc/39/02/40/338390240.db2.gz NGGAXLVFAIQEEQ-WSSFADSRSA-N 0 0 323.436 5.135 20 0 DKADRN Cc1ccc(/C=C/CC(=O)N2CCCCC[C@H]2c2ccco2)cc1 ZINC000440557314 338390258 /nfs/dbraw/zinc/39/02/58/338390258.db2.gz NGGAXLVFAIQEEQ-XZXOBPBMSA-N 0 0 323.436 5.135 20 0 DKADRN Cc1ccc(/C=C/CC(=O)Nc2c(C)cccc2C(C)C)cc1 ZINC000440569935 338390559 /nfs/dbraw/zinc/39/05/59/338390559.db2.gz TYAFYUJRNASSLE-SOFGYWHQSA-N 0 0 307.437 5.469 20 0 DKADRN Cc1ccc(/C=C\CC(=O)Nc2c(C)cccc2C(C)C)cc1 ZINC000440569938 338390590 /nfs/dbraw/zinc/39/05/90/338390590.db2.gz TYAFYUJRNASSLE-VURMDHGXSA-N 0 0 307.437 5.469 20 0 DKADRN Cc1ccc(/C=C\CC(=O)N2CCC[C@@H]2c2cccc(C)c2)cc1 ZINC000440573786 338390670 /nfs/dbraw/zinc/39/06/70/338390670.db2.gz IJIATOFRIYKUMF-ANIGNSTFSA-N 0 0 319.448 5.070 20 0 DKADRN Cc1ccc(/C=C/CC(=O)N2CCC[C@@H]2c2cccc(C)c2)cc1 ZINC000440573787 338390649 /nfs/dbraw/zinc/39/06/49/338390649.db2.gz IJIATOFRIYKUMF-HXRGIAOBSA-N 0 0 319.448 5.070 20 0 DKADRN Cc1ccc(/C=C\CC(=O)N2CCC[C@H]2c2cccc(C)c2)cc1 ZINC000440573788 338390646 /nfs/dbraw/zinc/39/06/46/338390646.db2.gz IJIATOFRIYKUMF-PAKAJVGYSA-N 0 0 319.448 5.070 20 0 DKADRN Cc1ccc(/C=C/CC(=O)N2CCC[C@H]2c2cccc(C)c2)cc1 ZINC000440573789 338390729 /nfs/dbraw/zinc/39/07/29/338390729.db2.gz IJIATOFRIYKUMF-XBGMYJNYSA-N 0 0 319.448 5.070 20 0 DKADRN Cc1cc(C)c(NC(=O)[C@@H](C)SCC(C)(C)C)c(Cl)c1 ZINC000440577971 338390832 /nfs/dbraw/zinc/39/08/32/338390832.db2.gz DCRWXBHNUQSQNW-GFCCVEGCSA-N 0 0 313.894 5.063 20 0 DKADRN Cc1cc(C)c(NC(=O)[C@H](C)SCC(C)(C)C)c(Cl)c1 ZINC000440577974 338390859 /nfs/dbraw/zinc/39/08/59/338390859.db2.gz DCRWXBHNUQSQNW-LBPRGKRZSA-N 0 0 313.894 5.063 20 0 DKADRN CC(C)(C)CSCC(=O)Nc1ccccc1-c1ccccc1 ZINC000440579076 338390927 /nfs/dbraw/zinc/39/09/27/338390927.db2.gz HIEIAATUZJBVLL-UHFFFAOYSA-N 0 0 313.466 5.071 20 0 DKADRN Cc1ccc(NC(=O)N(C)[C@H](c2ccccc2C)C(C)C)s1 ZINC000440579570 338391005 /nfs/dbraw/zinc/39/10/05/338391005.db2.gz IUULKGFGTLURGG-KRWDZBQOSA-N 0 0 316.470 5.226 20 0 DKADRN Cc1ccc(NC(=O)N(C)[C@@H](c2ccccc2C)C(C)C)s1 ZINC000440579573 338391003 /nfs/dbraw/zinc/39/10/03/338391003.db2.gz IUULKGFGTLURGG-QGZVFWFLSA-N 0 0 316.470 5.226 20 0 DKADRN CC[C@@H](NC(=O)Nc1ccc(C)s1)c1ccc(Cl)s1 ZINC000440582255 338391086 /nfs/dbraw/zinc/39/10/86/338391086.db2.gz GXAVFPMJCMIWAP-SECBINFHSA-N 0 0 314.863 5.044 20 0 DKADRN CC[C@H](NC(=O)Nc1ccc(C)s1)c1ccc(Cl)s1 ZINC000440582260 338391068 /nfs/dbraw/zinc/39/10/68/338391068.db2.gz GXAVFPMJCMIWAP-VIFPVBQESA-N 0 0 314.863 5.044 20 0 DKADRN CC(C)[C@@H]1CCCCN1C(=O)Nc1ccc(Cl)cc1Cl ZINC000440583389 338391008 /nfs/dbraw/zinc/39/10/08/338391008.db2.gz RWSDKDASMGZXHW-AWEZNQCLSA-N 0 0 315.244 5.036 20 0 DKADRN CC(C)[C@H]1CCCCN1C(=O)Nc1ccc(Cl)cc1Cl ZINC000440583390 338391048 /nfs/dbraw/zinc/39/10/48/338391048.db2.gz RWSDKDASMGZXHW-CQSZACIVSA-N 0 0 315.244 5.036 20 0 DKADRN Cc1ccc(NC(=O)Nc2cccc(Cl)c2OC(C)C)s1 ZINC000440584695 338391181 /nfs/dbraw/zinc/39/11/81/338391181.db2.gz OUCNOYJQNWAPAT-UHFFFAOYSA-N 0 0 324.833 5.141 20 0 DKADRN Cc1ccc(NC(=O)N(Cc2ccoc2)C2CCCCC2)s1 ZINC000440586383 338391233 /nfs/dbraw/zinc/39/12/33/338391233.db2.gz WGBGIAKNDADLJK-UHFFFAOYSA-N 0 0 318.442 5.016 20 0 DKADRN Cc1ccc(NC(=O)N2CCCC[C@H]2c2ccc(C)cc2)s1 ZINC000440586959 338391288 /nfs/dbraw/zinc/39/12/88/338391288.db2.gz FFMASFCGYNVXHY-INIZCTEOSA-N 0 0 314.454 5.124 20 0 DKADRN Cc1ccc(NC(=O)N2CCCC[C@@H]2c2ccc(C)cc2)s1 ZINC000440586962 338391273 /nfs/dbraw/zinc/39/12/73/338391273.db2.gz FFMASFCGYNVXHY-MRXNPFEDSA-N 0 0 314.454 5.124 20 0 DKADRN C[C@@H]1CCCN(C(=O)Nc2ccc(-c3ccccc3)cc2)[C@H]1C ZINC000440587290 338391247 /nfs/dbraw/zinc/39/12/47/338391247.db2.gz ZUOQFZIBRDNGKM-CVEARBPZSA-N 0 0 308.425 5.006 20 0 DKADRN C[C@H]1CCCN(C(=O)Nc2ccc(-c3ccccc3)cc2)[C@H]1C ZINC000440587297 338391296 /nfs/dbraw/zinc/39/12/96/338391296.db2.gz ZUOQFZIBRDNGKM-HOTGVXAUSA-N 0 0 308.425 5.006 20 0 DKADRN C[C@@H]1CCCN(C(=O)Nc2ccc(-c3ccccc3)cc2)[C@@H]1C ZINC000440587298 338391269 /nfs/dbraw/zinc/39/12/69/338391269.db2.gz ZUOQFZIBRDNGKM-HZPDHXFCSA-N 0 0 308.425 5.006 20 0 DKADRN C[C@@H]1[C@@H](C)CCCN1C(=O)Nc1ccc(-c2ccccc2)cc1 ZINC000440587299 338391253 /nfs/dbraw/zinc/39/12/53/338391253.db2.gz ZUOQFZIBRDNGKM-JKSUJKDBSA-N 0 0 308.425 5.006 20 0 DKADRN Cc1ccc(NC(=O)N2CCC[C@H]2c2cccc(C)c2C)s1 ZINC000440587474 338391265 /nfs/dbraw/zinc/39/12/65/338391265.db2.gz HLXUQCHTWXUCOO-INIZCTEOSA-N 0 0 314.454 5.042 20 0 DKADRN Cc1ccc(NC(=O)N2CCC[C@@H]2c2cccc(C)c2C)s1 ZINC000440587477 338391266 /nfs/dbraw/zinc/39/12/66/338391266.db2.gz HLXUQCHTWXUCOO-MRXNPFEDSA-N 0 0 314.454 5.042 20 0 DKADRN O=C(Nc1ccc(-c2ccccc2)cc1)N(CC1CC1)CC1CC1 ZINC000440588137 338391347 /nfs/dbraw/zinc/39/13/47/338391347.db2.gz JJNUTCHUICWVKX-UHFFFAOYSA-N 0 0 320.436 5.008 20 0 DKADRN Cc1ccc(NC(=O)N(Cc2ccccc2)CC(C)(C)C)s1 ZINC000440588247 338391394 /nfs/dbraw/zinc/39/13/94/338391394.db2.gz MKJMWYAKADUDPH-UHFFFAOYSA-N 0 0 316.470 5.137 20 0 DKADRN CCSc1ccc([C@@H](C)NC(=O)Nc2ccc(C)s2)cc1 ZINC000440589790 338391490 /nfs/dbraw/zinc/39/14/90/338391490.db2.gz REKGVBOAKMHWFK-GFCCVEGCSA-N 0 0 320.483 5.051 20 0 DKADRN CCSc1ccc([C@H](C)NC(=O)Nc2ccc(C)s2)cc1 ZINC000440589791 338391465 /nfs/dbraw/zinc/39/14/65/338391465.db2.gz REKGVBOAKMHWFK-LBPRGKRZSA-N 0 0 320.483 5.051 20 0 DKADRN CCCCN(C(=O)Nc1ccc(C)s1)[C@@H](C)c1ccccc1 ZINC000440590334 338391483 /nfs/dbraw/zinc/39/14/83/338391483.db2.gz SXVPINKVXKBMKE-HNNXBMFYSA-N 0 0 316.470 5.452 20 0 DKADRN CCCCN(C(=O)Nc1ccc(C)s1)[C@H](C)c1ccccc1 ZINC000440590335 338391463 /nfs/dbraw/zinc/39/14/63/338391463.db2.gz SXVPINKVXKBMKE-OAHLLOKOSA-N 0 0 316.470 5.452 20 0 DKADRN CCSCc1cccc(NC(=O)Nc2ccccc2Cl)c1 ZINC000440590358 338391513 /nfs/dbraw/zinc/39/15/13/338391513.db2.gz TWOGRUFKOPRUFY-UHFFFAOYSA-N 0 0 320.845 5.237 20 0 DKADRN Cc1cccc(C(C)C)c1NC(=O)[C@H](C)SCC(C)(C)C ZINC000440591689 338391556 /nfs/dbraw/zinc/39/15/56/338391556.db2.gz RXQKPRCAZXRMBB-AWEZNQCLSA-N 0 0 307.503 5.225 20 0 DKADRN Cc1cccc(C(C)C)c1NC(=O)[C@@H](C)SCC(C)(C)C ZINC000440591691 338391587 /nfs/dbraw/zinc/39/15/87/338391587.db2.gz RXQKPRCAZXRMBB-CQSZACIVSA-N 0 0 307.503 5.225 20 0 DKADRN Cc1ccc([C@@H]2CCCCCN2C(=O)Nc2ccc(C)s2)o1 ZINC000440591920 338391566 /nfs/dbraw/zinc/39/15/66/338391566.db2.gz CVTOHFGRJISWBO-AWEZNQCLSA-N 0 0 318.442 5.107 20 0 DKADRN Cc1ccc([C@H]2CCCCCN2C(=O)Nc2ccc(C)s2)o1 ZINC000440591921 338391580 /nfs/dbraw/zinc/39/15/80/338391580.db2.gz CVTOHFGRJISWBO-CQSZACIVSA-N 0 0 318.442 5.107 20 0 DKADRN C[C@H](SCC(C)(C)C)c1nnc(-c2cccc(Cl)c2)o1 ZINC000440592549 338391572 /nfs/dbraw/zinc/39/15/72/338391572.db2.gz BYOKBUSGACVDLY-JTQLQIEISA-N 0 0 310.850 5.230 20 0 DKADRN C[C@@H](SCC(C)(C)C)c1nnc(-c2cccc(Cl)c2)o1 ZINC000440592550 338391558 /nfs/dbraw/zinc/39/15/58/338391558.db2.gz BYOKBUSGACVDLY-SNVBAGLBSA-N 0 0 310.850 5.230 20 0 DKADRN CC(C)c1cccc(C(C)C)c1NC(=O)CSCC(C)(C)C ZINC000440595191 338391665 /nfs/dbraw/zinc/39/16/65/338391665.db2.gz NNRTZTPVWBBVRD-UHFFFAOYSA-N 0 0 321.530 5.651 20 0 DKADRN C[C@@H](SCC(C)(C)C)C(=O)Nc1cccc(Cl)c1Cl ZINC000440605781 338392096 /nfs/dbraw/zinc/39/20/96/338392096.db2.gz OFKIGZIEAHLFJE-SECBINFHSA-N 0 0 320.285 5.100 20 0 DKADRN C[C@H](SCC(C)(C)C)C(=O)Nc1cccc(Cl)c1Cl ZINC000440605782 338392170 /nfs/dbraw/zinc/39/21/70/338392170.db2.gz OFKIGZIEAHLFJE-VIFPVBQESA-N 0 0 320.285 5.100 20 0 DKADRN CSc1ccccc1[C@H](C)NCc1c(F)cccc1Cl ZINC000440607663 338392298 /nfs/dbraw/zinc/39/22/98/338392298.db2.gz BDMLWFPSNZPWCY-NSHDSACASA-N 0 0 309.837 5.052 20 0 DKADRN Cc1ccc(Oc2ccccc2)c(NC(=O)Cc2ccsc2)c1 ZINC000440611282 338392452 /nfs/dbraw/zinc/39/24/52/338392452.db2.gz GFURELFSVQFBDB-UHFFFAOYSA-N 0 0 323.417 5.030 20 0 DKADRN Cc1cc(C(=O)Nc2cc(C)ccc2Oc2ccccc2)c(C)o1 ZINC000440619255 338392678 /nfs/dbraw/zinc/39/26/78/338392678.db2.gz BURBCEHAVGHMTM-UHFFFAOYSA-N 0 0 321.376 5.249 20 0 DKADRN CCCCc1nc(CN[C@@H](C)c2ccccc2SC)cs1 ZINC000440620829 338392787 /nfs/dbraw/zinc/39/27/87/338392787.db2.gz HGQYFARCXNKPFY-ZDUSSCGKSA-N 0 0 320.527 5.058 20 0 DKADRN CSc1ccccc1[C@H](C)N[C@H](C)c1c(F)cccc1F ZINC000440621495 338392809 /nfs/dbraw/zinc/39/28/09/338392809.db2.gz CWSZSROBDHZEMB-NWDGAFQWSA-N 0 0 307.409 5.099 20 0 DKADRN CSc1ccccc1[C@H](C)N[C@@H](C)c1c(F)cccc1F ZINC000440621498 338392806 /nfs/dbraw/zinc/39/28/06/338392806.db2.gz CWSZSROBDHZEMB-RYUDHWBXSA-N 0 0 307.409 5.099 20 0 DKADRN Cc1ccc(Oc2ccccc2)c(NC(=O)Cc2cccs2)c1 ZINC000440623570 338392885 /nfs/dbraw/zinc/39/28/85/338392885.db2.gz HEORHCPAWJAVNG-UHFFFAOYSA-N 0 0 323.417 5.030 20 0 DKADRN CSc1ccccc1[C@H](C)N[C@H](C)c1ncc(C(C)(C)C)o1 ZINC000440624543 338392942 /nfs/dbraw/zinc/39/29/42/338392942.db2.gz LZWUNFKUHUMVLV-QWHCGFSZSA-N 0 0 318.486 5.106 20 0 DKADRN CSc1ccccc1[C@H](C)N[C@@H](C)c1ncc(C(C)(C)C)o1 ZINC000440624545 338392911 /nfs/dbraw/zinc/39/29/11/338392911.db2.gz LZWUNFKUHUMVLV-STQMWFEESA-N 0 0 318.486 5.106 20 0 DKADRN Cc1ccc(Oc2ccccc2)c(NC(=O)c2cccs2)c1 ZINC000440626433 338392984 /nfs/dbraw/zinc/39/29/84/338392984.db2.gz NTJBDWHRWDUFCH-UHFFFAOYSA-N 0 0 309.390 5.101 20 0 DKADRN Cc1cc(C)c(C(=O)Nc2cc(C)ccc2Oc2ccccc2)o1 ZINC000440627090 338392987 /nfs/dbraw/zinc/39/29/87/338392987.db2.gz HVEKUIBSOHYMSL-UHFFFAOYSA-N 0 0 321.376 5.249 20 0 DKADRN Cc1ccc(Oc2ccccc2)c(NC(=O)c2ccsc2)c1 ZINC000440628917 338393193 /nfs/dbraw/zinc/39/31/93/338393193.db2.gz ZCEDFVGOUISXOE-UHFFFAOYSA-N 0 0 309.390 5.101 20 0 DKADRN CSc1ccccc1[C@H](C)[NH2+]Cc1ccc(Cl)cc1F ZINC000440630185 338393158 /nfs/dbraw/zinc/39/31/58/338393158.db2.gz WJTCJVQUKUKOBZ-NSHDSACASA-N 0 0 309.837 5.052 20 0 DKADRN CC(C)c1ccsc1C(=O)Nc1cccc(C(C)(F)F)c1 ZINC000440631607 338393225 /nfs/dbraw/zinc/39/32/25/338393225.db2.gz AHZMPEPQKSFRHP-UHFFFAOYSA-N 0 0 309.381 5.236 20 0 DKADRN C[C@@H](C(=O)Nc1cccc(C(C)(F)F)c1)c1cccc(Cl)c1 ZINC000440634637 338393463 /nfs/dbraw/zinc/39/34/63/338393463.db2.gz IYRKDCGFYUKHIJ-LLVKDONJSA-N 0 0 323.770 5.194 20 0 DKADRN C[C@H](C(=O)Nc1cccc(C(C)(F)F)c1)c1cccc(Cl)c1 ZINC000440634642 338393543 /nfs/dbraw/zinc/39/35/43/338393543.db2.gz IYRKDCGFYUKHIJ-NSHDSACASA-N 0 0 323.770 5.194 20 0 DKADRN Cc1oc2ccccc2c1C(=O)Nc1cccc(C(C)(F)F)c1 ZINC000440639347 338393800 /nfs/dbraw/zinc/39/38/00/338393800.db2.gz SBCBICRITHSUDS-UHFFFAOYSA-N 0 0 315.319 5.105 20 0 DKADRN Cc1cc(C(=O)Nc2cccc(C(C)(F)F)c2)c(C)n1C(C)C ZINC000440640085 334609051 /nfs/dbraw/zinc/60/90/51/334609051.db2.gz REOCLSGBBOXVJV-UHFFFAOYSA-N 0 0 320.383 5.050 20 0 DKADRN CC[C@H](C(=O)Nc1cccc(C(C)(F)F)c1)c1ccc(F)cc1 ZINC000440641476 338393806 /nfs/dbraw/zinc/39/38/06/338393806.db2.gz ZWSMCFSKWURQDR-INIZCTEOSA-N 0 0 321.342 5.070 20 0 DKADRN CC[C@@H](C(=O)Nc1cccc(C(C)(F)F)c1)c1ccc(F)cc1 ZINC000440641477 338393844 /nfs/dbraw/zinc/39/38/44/338393844.db2.gz ZWSMCFSKWURQDR-MRXNPFEDSA-N 0 0 321.342 5.070 20 0 DKADRN Cc1c2ccccc2oc1C(=O)Nc1cccc(C(C)(F)F)c1 ZINC000440641785 338393796 /nfs/dbraw/zinc/39/37/96/338393796.db2.gz BEYAAOBDCBSWLC-UHFFFAOYSA-N 0 0 315.319 5.105 20 0 DKADRN Cc1ccsc1CCCC(=O)Nc1cccc(C(C)(F)F)c1 ZINC000440642285 338393910 /nfs/dbraw/zinc/39/39/10/338393910.db2.gz YOGBZYVPKZSUBR-UHFFFAOYSA-N 0 0 323.408 5.130 20 0 DKADRN CSc1ccc(C)c(C(=O)Nc2cccc(C(C)(F)F)c2)c1 ZINC000440642779 338393793 /nfs/dbraw/zinc/39/37/93/338393793.db2.gz AAOQMYYGMXRMCA-UHFFFAOYSA-N 0 0 321.392 5.081 20 0 DKADRN Cc1cccc2cc(C(=O)Nc3cccc(C(C)(F)F)c3)oc21 ZINC000440644278 338393983 /nfs/dbraw/zinc/39/39/83/338393983.db2.gz DDMZSIXMIBPRRH-UHFFFAOYSA-N 0 0 315.319 5.105 20 0 DKADRN Cc1cc(Cl)c(C(=O)Nc2cccc(C(C)(F)F)c2)cc1C ZINC000440649534 338394223 /nfs/dbraw/zinc/39/42/23/338394223.db2.gz QSYMAZLXPCCDLB-UHFFFAOYSA-N 0 0 323.770 5.321 20 0 DKADRN Cc1cc(Cl)ccc1C(=O)Nc1cccc(C(C)(F)F)c1 ZINC000440653805 334609579 /nfs/dbraw/zinc/60/95/79/334609579.db2.gz KEOKRJHGXIPYAQ-UHFFFAOYSA-N 0 0 309.743 5.012 20 0 DKADRN Cc1ccc2oc(C(=O)Nc3cccc(C(C)(F)F)c3)cc2c1 ZINC000440656945 338394535 /nfs/dbraw/zinc/39/45/35/338394535.db2.gz UXYIQVUCIDIVCL-UHFFFAOYSA-N 0 0 315.319 5.105 20 0 DKADRN Cc1ccc(Cl)cc1C(=O)Nc1cccc(C(C)(F)F)c1 ZINC000440657794 338394539 /nfs/dbraw/zinc/39/45/39/338394539.db2.gz XZYBGEYQMSYAFE-UHFFFAOYSA-N 0 0 309.743 5.012 20 0 DKADRN CSc1ccccc1[C@H](C)Nc1ncc(C(F)(F)F)s1 ZINC000440675604 338395052 /nfs/dbraw/zinc/39/50/52/338395052.db2.gz SLRDZDSDWNPHHS-QMMMGPOBSA-N 0 0 318.389 5.057 20 0 DKADRN Cc1ccc(C)c(C(=O)Nc2cccc(CCC(F)(F)F)c2)c1 ZINC000440696158 338395336 /nfs/dbraw/zinc/39/53/36/338395336.db2.gz IEALHEBEIJWTJH-UHFFFAOYSA-N 0 0 321.342 5.051 20 0 DKADRN Cc1ccc(C(=O)Nc2cccc(CCC(F)(F)F)c2)c(C)c1 ZINC000440703859 338395536 /nfs/dbraw/zinc/39/55/36/338395536.db2.gz JPNBSAKTJDKCBH-UHFFFAOYSA-N 0 0 321.342 5.051 20 0 DKADRN Cc1cccc(C(=O)Nc2cccc(CCC(F)(F)F)c2)c1C ZINC000440704743 338395491 /nfs/dbraw/zinc/39/54/91/338395491.db2.gz MJRLDERJTUMYKO-UHFFFAOYSA-N 0 0 321.342 5.051 20 0 DKADRN O=C(CC1=CCCCC1)Nc1cccc(CCC(F)(F)F)c1 ZINC000440705088 338395554 /nfs/dbraw/zinc/39/55/54/338395554.db2.gz NSLCSUCLPXSITM-UHFFFAOYSA-N 0 0 311.347 5.011 20 0 DKADRN O=C(Nc1ccc(-c2ccccc2)cc1)N1CCC[C@@H]2CCC[C@H]21 ZINC000440708598 338395715 /nfs/dbraw/zinc/39/57/15/338395715.db2.gz FXECZHOAVSMKIT-AZUAARDMSA-N 0 0 320.436 5.150 20 0 DKADRN O=C(Nc1ccc(-c2ccccc2)cc1)N1CCC[C@@H]2CCC[C@@H]21 ZINC000440708599 338395697 /nfs/dbraw/zinc/39/56/97/338395697.db2.gz FXECZHOAVSMKIT-ICSRJNTNSA-N 0 0 320.436 5.150 20 0 DKADRN O=C(Nc1ccc(-c2ccccc2)cc1)N1CCC[C@H]2CCC[C@@H]21 ZINC000440708600 338395671 /nfs/dbraw/zinc/39/56/71/338395671.db2.gz FXECZHOAVSMKIT-QUCCMNQESA-N 0 0 320.436 5.150 20 0 DKADRN O=C(Nc1ccc(-c2ccccc2)cc1)N1CCC[C@H]2CCC[C@H]21 ZINC000440708602 338395635 /nfs/dbraw/zinc/39/56/35/338395635.db2.gz FXECZHOAVSMKIT-UYAOXDASSA-N 0 0 320.436 5.150 20 0 DKADRN Cc1ccc(NC(=O)N2CCCC3(C2)CCCCCC3)s1 ZINC000440716067 338395808 /nfs/dbraw/zinc/39/58/08/338395808.db2.gz PDXGCYQCYUCRIG-UHFFFAOYSA-N 0 0 306.475 5.025 20 0 DKADRN C[C@@H]1CC[C@H](C)N(C(=O)Nc2ccc(-c3ccccc3)cc2)C1 ZINC000440727579 338396218 /nfs/dbraw/zinc/39/62/18/338396218.db2.gz CQSRBLMRHIVPFE-CVEARBPZSA-N 0 0 308.425 5.006 20 0 DKADRN C[C@H]1CC[C@H](C)N(C(=O)Nc2ccc(-c3ccccc3)cc2)C1 ZINC000440727580 338396142 /nfs/dbraw/zinc/39/61/42/338396142.db2.gz CQSRBLMRHIVPFE-HOTGVXAUSA-N 0 0 308.425 5.006 20 0 DKADRN C[C@@H]1CC[C@@H](C)N(C(=O)Nc2ccc(-c3ccccc3)cc2)C1 ZINC000440727581 338396200 /nfs/dbraw/zinc/39/62/00/338396200.db2.gz CQSRBLMRHIVPFE-HZPDHXFCSA-N 0 0 308.425 5.006 20 0 DKADRN C[C@@H]1CC[C@H](C)CN1C(=O)Nc1ccc(-c2ccccc2)cc1 ZINC000440727582 338396165 /nfs/dbraw/zinc/39/61/65/338396165.db2.gz CQSRBLMRHIVPFE-JKSUJKDBSA-N 0 0 308.425 5.006 20 0 DKADRN CC(C)c1ccc(NC(=O)c2cc(C3CC3)no2)c(C(C)C)c1 ZINC000440762764 338396633 /nfs/dbraw/zinc/39/66/33/338396633.db2.gz QIWFSBJSOFHDSY-UHFFFAOYSA-N 0 0 312.413 5.051 20 0 DKADRN Cc1ccc(NC(=O)N2CCC[C@H]2CC2CCCCC2)s1 ZINC000440768057 338396762 /nfs/dbraw/zinc/39/67/62/338396762.db2.gz AVVHKOCRWXVZMR-HNNXBMFYSA-N 0 0 306.475 5.023 20 0 DKADRN Cc1ccc(NC(=O)N2CCC[C@@H]2CC2CCCCC2)s1 ZINC000440768060 338396886 /nfs/dbraw/zinc/39/68/86/338396886.db2.gz AVVHKOCRWXVZMR-OAHLLOKOSA-N 0 0 306.475 5.023 20 0 DKADRN CCCCN(Cc1ccccc1F)C(=O)Nc1ccc(C)s1 ZINC000440770218 338396916 /nfs/dbraw/zinc/39/69/16/338396916.db2.gz HWQCZBHSPVXPMB-UHFFFAOYSA-N 0 0 320.433 5.030 20 0 DKADRN Cc1ccc(NC(=O)N2CCCCC[C@H]2c2ccccc2)s1 ZINC000440770762 338396909 /nfs/dbraw/zinc/39/69/09/338396909.db2.gz OGLKFOCCFXZJFD-INIZCTEOSA-N 0 0 314.454 5.206 20 0 DKADRN Cc1ccc(NC(=O)N2CCCCC[C@@H]2c2ccccc2)s1 ZINC000440770763 338396946 /nfs/dbraw/zinc/39/69/46/338396946.db2.gz OGLKFOCCFXZJFD-MRXNPFEDSA-N 0 0 314.454 5.206 20 0 DKADRN CCCn1ccc2cc(NC(=O)Nc3ccc(C)s3)ccc21 ZINC000440770774 338396985 /nfs/dbraw/zinc/39/69/85/338396985.db2.gz OJGFBBHAUZZMHI-UHFFFAOYSA-N 0 0 313.426 5.065 20 0 DKADRN Cc1ccc(NC(=O)Nc2cccc(OC3CCCC3)c2)s1 ZINC000440771142 338396901 /nfs/dbraw/zinc/39/69/01/338396901.db2.gz MOQAOLRFFOLTML-UHFFFAOYSA-N 0 0 316.426 5.022 20 0 DKADRN Cc1ccc(NC(=O)Nc2ccc(OC3CCCC3)cc2)s1 ZINC000440771283 338396906 /nfs/dbraw/zinc/39/69/06/338396906.db2.gz QHEGWYCDRXPGCK-UHFFFAOYSA-N 0 0 316.426 5.022 20 0 DKADRN CCCN(C(=O)Nc1ccc(C)s1)[C@@H](CC)c1ccccc1 ZINC000440771534 338396925 /nfs/dbraw/zinc/39/69/25/338396925.db2.gz OOEDXUHNOLKOKL-INIZCTEOSA-N 0 0 316.470 5.452 20 0 DKADRN CCCN(C(=O)Nc1ccc(C)s1)[C@H](CC)c1ccccc1 ZINC000440771536 338396996 /nfs/dbraw/zinc/39/69/96/338396996.db2.gz OOEDXUHNOLKOKL-MRXNPFEDSA-N 0 0 316.470 5.452 20 0 DKADRN CCN(Cc1ccc2ccccc2c1)C(=O)Nc1ccc(C)s1 ZINC000440772279 338396922 /nfs/dbraw/zinc/39/69/22/338396922.db2.gz UGXPXJREDNSLGI-UHFFFAOYSA-N 0 0 324.449 5.264 20 0 DKADRN Cc1ccc(NC(=O)N[C@H](CC(C)C)c2cccs2)s1 ZINC000440772789 338396936 /nfs/dbraw/zinc/39/69/36/338396936.db2.gz HUJHOSAGSJIGRQ-GFCCVEGCSA-N 0 0 308.472 5.027 20 0 DKADRN Cc1ccc(NC(=O)N[C@@H](CC(C)C)c2cccs2)s1 ZINC000440772928 338396896 /nfs/dbraw/zinc/39/68/96/338396896.db2.gz HUJHOSAGSJIGRQ-LBPRGKRZSA-N 0 0 308.472 5.027 20 0 DKADRN Cc1ccc(NC(=O)N(Cc2cccc(C)c2)CC(C)C)s1 ZINC000440773829 338396955 /nfs/dbraw/zinc/39/69/55/338396955.db2.gz JXEISXRWBVYOJW-UHFFFAOYSA-N 0 0 316.470 5.055 20 0 DKADRN Cc1ccc(NC(=O)N2CCC[C@H]2c2ccc(C)c(C)c2)s1 ZINC000440774117 338397007 /nfs/dbraw/zinc/39/70/07/338397007.db2.gz WETQHAFIOQMCRO-INIZCTEOSA-N 0 0 314.454 5.042 20 0 DKADRN Cc1ccc(NC(=O)N2CCC[C@@H]2c2ccc(C)c(C)c2)s1 ZINC000440774118 338397038 /nfs/dbraw/zinc/39/70/38/338397038.db2.gz WETQHAFIOQMCRO-MRXNPFEDSA-N 0 0 314.454 5.042 20 0 DKADRN CCc1ccc(-c2nc(CSc3ccncc3)cs2)cc1 ZINC000440779032 338397226 /nfs/dbraw/zinc/39/72/26/338397226.db2.gz FPZJATQKXMNBFM-UHFFFAOYSA-N 0 0 312.463 5.060 20 0 DKADRN CCCCOc1ccc(NC(=O)Nc2ccc(C)s2)c(C)c1 ZINC000440779774 338397276 /nfs/dbraw/zinc/39/72/76/338397276.db2.gz HJMZAWFQKYAUBW-UHFFFAOYSA-N 0 0 318.442 5.188 20 0 DKADRN Cc1ccc(NC(=O)Nc2ccc(OC(C)C)c(Cl)c2)s1 ZINC000440784628 338397371 /nfs/dbraw/zinc/39/73/71/338397371.db2.gz TVKHVWDXNAIBES-UHFFFAOYSA-N 0 0 324.833 5.141 20 0 DKADRN C[C@H](CCC(=O)Nc1cccc(C(F)F)c1)c1ccccc1 ZINC000440793792 338397757 /nfs/dbraw/zinc/39/77/57/338397757.db2.gz AMGPQBLYITWYMC-CYBMUJFWSA-N 0 0 303.352 5.147 20 0 DKADRN C[C@@H](CCC(=O)Nc1cccc(C(F)F)c1)c1ccccc1 ZINC000440793793 338397732 /nfs/dbraw/zinc/39/77/32/338397732.db2.gz AMGPQBLYITWYMC-ZDUSSCGKSA-N 0 0 303.352 5.147 20 0 DKADRN Fc1cccc(SCc2coc(-c3ccc(F)c(F)c3)n2)c1 ZINC000440833972 338398387 /nfs/dbraw/zinc/39/83/87/338398387.db2.gz NLELASAQMVQHSM-UHFFFAOYSA-N 0 0 321.323 5.051 20 0 DKADRN CC(C)c1ccccc1NC(=O)[C@@H](C)Sc1cccc(F)c1 ZINC000440846690 338398584 /nfs/dbraw/zinc/39/85/84/338398584.db2.gz LZYHCEQYJCLVDX-CYBMUJFWSA-N 0 0 317.429 5.068 20 0 DKADRN CC(C)c1ccccc1NC(=O)[C@H](C)Sc1cccc(F)c1 ZINC000440846692 338398643 /nfs/dbraw/zinc/39/86/43/338398643.db2.gz LZYHCEQYJCLVDX-ZDUSSCGKSA-N 0 0 317.429 5.068 20 0 DKADRN Cc1ccc(NC(=O)N[C@H](C)c2cccc3ccccc32)s1 ZINC000440848037 338398645 /nfs/dbraw/zinc/39/86/45/338398645.db2.gz OECWXYVDWJQEJQ-CYBMUJFWSA-N 0 0 310.422 5.092 20 0 DKADRN Cc1ccc(NC(=O)N[C@@H](C)c2cccc3ccccc32)s1 ZINC000440848040 338398620 /nfs/dbraw/zinc/39/86/20/338398620.db2.gz OECWXYVDWJQEJQ-ZDUSSCGKSA-N 0 0 310.422 5.092 20 0 DKADRN COc1cc(C(C)=O)ccc1S[C@H](C)c1ccc(F)cc1F ZINC000440850455 338398621 /nfs/dbraw/zinc/39/86/21/338398621.db2.gz CPSWGSGYDOUGEC-LLVKDONJSA-N 0 0 322.376 5.029 20 0 DKADRN COc1cc(C(C)=O)ccc1S[C@@H](C)c1ccc(F)cc1F ZINC000440850456 338398639 /nfs/dbraw/zinc/39/86/39/338398639.db2.gz CPSWGSGYDOUGEC-NSHDSACASA-N 0 0 322.376 5.029 20 0 DKADRN COc1cc(C(C)=O)ccc1S[C@@H](C)c1ccccc1C ZINC000440853904 338398657 /nfs/dbraw/zinc/39/86/57/338398657.db2.gz ZDENAXILJBUFLP-AWEZNQCLSA-N 0 0 300.423 5.060 20 0 DKADRN COc1cc(C(C)=O)ccc1S[C@H](C)c1ccccc1C ZINC000440853905 338398658 /nfs/dbraw/zinc/39/86/58/338398658.db2.gz ZDENAXILJBUFLP-CQSZACIVSA-N 0 0 300.423 5.060 20 0 DKADRN CCc1cccc(CC)c1NC(=O)CC[C@H](C)c1ccccc1 ZINC000440874765 338398944 /nfs/dbraw/zinc/39/89/44/338398944.db2.gz LJJGRZOOXJDAMT-INIZCTEOSA-N 0 0 309.453 5.334 20 0 DKADRN CCc1cccc(CC)c1NC(=O)CC[C@@H](C)c1ccccc1 ZINC000440874766 338398973 /nfs/dbraw/zinc/39/89/73/338398973.db2.gz LJJGRZOOXJDAMT-MRXNPFEDSA-N 0 0 309.453 5.334 20 0 DKADRN Cc1nc2cc(Cl)c(NC(=O)C3(CC(C)C)CC3)cc2s1 ZINC000440875436 338398986 /nfs/dbraw/zinc/39/89/86/338398986.db2.gz ODEHPCKQYWANAJ-UHFFFAOYSA-N 0 0 322.861 5.023 20 0 DKADRN CC[C@H](Sc1ccc(C(C)=O)cc1OC)c1ccccc1 ZINC000440877610 338399116 /nfs/dbraw/zinc/39/91/16/338399116.db2.gz FFBNGRHXKUDSDG-KRWDZBQOSA-N 0 0 300.423 5.141 20 0 DKADRN COc1cc(C(C)=O)ccc1S[C@H](C)c1ccc(F)c(F)c1 ZINC000440881841 338399216 /nfs/dbraw/zinc/39/92/16/338399216.db2.gz PUFWYDZDBCKREK-LLVKDONJSA-N 0 0 322.376 5.029 20 0 DKADRN COc1cc(C(C)=O)ccc1S[C@@H](C)c1ccc(F)c(F)c1 ZINC000440881842 338399199 /nfs/dbraw/zinc/39/91/99/338399199.db2.gz PUFWYDZDBCKREK-NSHDSACASA-N 0 0 322.376 5.029 20 0 DKADRN C[C@H](c1ccco1)N(Cc1csc(C2CCCC2)n1)C1CC1 ZINC000440906141 338399539 /nfs/dbraw/zinc/39/95/39/338399539.db2.gz GMYUXQDXEBHSOH-CYBMUJFWSA-N 0 0 316.470 5.119 20 0 DKADRN C[C@@H](c1ccco1)N(Cc1csc(C2CCCC2)n1)C1CC1 ZINC000440906142 338399663 /nfs/dbraw/zinc/39/96/63/338399663.db2.gz GMYUXQDXEBHSOH-ZDUSSCGKSA-N 0 0 316.470 5.119 20 0 DKADRN Cc1cccc(NC(=O)Nc2cccc(CCC(F)(F)F)c2)c1 ZINC000440907515 338399713 /nfs/dbraw/zinc/39/97/13/338399713.db2.gz WZPGCUPKXODBBU-UHFFFAOYSA-N 0 0 322.330 5.134 20 0 DKADRN Cc1ccc(NC(=O)Nc2cccc(CCC(F)(F)F)c2)cc1 ZINC000440916812 338399858 /nfs/dbraw/zinc/39/98/58/338399858.db2.gz KPTMPCSOHFPOEB-UHFFFAOYSA-N 0 0 322.330 5.134 20 0 DKADRN Cc1c(COC(C)(C)C)cccc1NC(=O)C1(CC(C)C)CC1 ZINC000441049070 338401482 /nfs/dbraw/zinc/40/14/82/338401482.db2.gz HVPSBBAVLFCLPS-UHFFFAOYSA-N 0 0 317.473 5.075 20 0 DKADRN Cc1cc(NCc2cnc(C(F)(F)F)s2)cc(C)c1Cl ZINC000441204413 338405292 /nfs/dbraw/zinc/40/52/92/338405292.db2.gz IJFYQISUWQJGQN-UHFFFAOYSA-N 0 0 320.767 5.044 20 0 DKADRN C[C@H](CCC(=O)Nc1ccc(F)cc1Cl)c1ccccc1 ZINC000441278859 338407558 /nfs/dbraw/zinc/40/75/58/338407558.db2.gz QQWDOLXDCWHDHP-GFCCVEGCSA-N 0 0 305.780 5.002 20 0 DKADRN Cc1cccc(C(C)C)c1NC(=O)CC[C@H](C)c1ccccc1 ZINC000441287331 334696875 /nfs/dbraw/zinc/69/68/75/334696875.db2.gz OYOHVBLCFDZLLI-INIZCTEOSA-N 0 0 309.453 5.641 20 0 DKADRN Cc1cccc(C(C)C)c1NC(=O)CC[C@@H](C)c1ccccc1 ZINC000441287332 334696968 /nfs/dbraw/zinc/69/69/68/334696968.db2.gz OYOHVBLCFDZLLI-MRXNPFEDSA-N 0 0 309.453 5.641 20 0 DKADRN CC(C)CC1(C(=O)Nc2cccc(C(F)F)c2Cl)CC1 ZINC000441299497 338408095 /nfs/dbraw/zinc/40/80/95/338408095.db2.gz CXPJKKFTEXBRSP-UHFFFAOYSA-N 0 0 301.764 5.042 20 0 DKADRN CSc1ccccc1[C@H](C)NCc1ncc(C(C)(C)C)s1 ZINC000441352625 334702417 /nfs/dbraw/zinc/70/24/17/334702417.db2.gz UNHJXOHQJZIZKZ-LBPRGKRZSA-N 0 0 320.527 5.013 20 0 DKADRN Clc1ccc2oc(-c3csc([C@@H]4CCCO4)n3)cc2c1 ZINC000441369926 338410973 /nfs/dbraw/zinc/41/09/73/338410973.db2.gz GGHGUZDROMKRIV-ZDUSSCGKSA-N 0 0 305.786 5.061 20 0 DKADRN Cc1cc(-c2csc([C@H]3CCCO3)n2)c(C)n1CCC(C)C ZINC000441372717 338410954 /nfs/dbraw/zinc/41/09/54/338410954.db2.gz QCMCLEHSQKXMDL-QGZVFWFLSA-N 0 0 318.486 5.126 20 0 DKADRN CCN(C(=O)c1sccc1C1CC1)c1ccc(Cl)c(F)c1 ZINC000441408828 338412135 /nfs/dbraw/zinc/41/21/35/338412135.db2.gz XUNUAVLUPCBIPU-UHFFFAOYSA-N 0 0 323.820 5.085 20 0 DKADRN CCN(C(=O)c1sccc1C1CC1)c1ccc(Cl)cc1F ZINC000441428741 338412929 /nfs/dbraw/zinc/41/29/29/338412929.db2.gz KFWRPDYSJVBEQY-UHFFFAOYSA-N 0 0 323.820 5.085 20 0 DKADRN CCN(C(=O)c1cccc2ccccc21)c1ccccc1Cl ZINC000441436708 338413345 /nfs/dbraw/zinc/41/33/45/338413345.db2.gz ONNXCRHBACCGPN-UHFFFAOYSA-N 0 0 309.796 5.160 20 0 DKADRN Cc1cccc(Cl)c1NC(=O)CC[C@H](C)c1ccccc1 ZINC000441445683 338413540 /nfs/dbraw/zinc/41/35/40/338413540.db2.gz GYCHQLMVVMNQDQ-ZDUSSCGKSA-N 0 0 301.817 5.171 20 0 DKADRN Cc1ccccc1[C@H]1CCCN1C(=O)CC[C@H](C)c1ccccc1 ZINC000441459159 338414324 /nfs/dbraw/zinc/41/43/24/338414324.db2.gz AWRAQQIKBXJQOV-LAUBAEHRSA-N 0 0 321.464 5.242 20 0 DKADRN Cc1ccc([C@H]2CCCN2C(=O)CC[C@H](C)c2ccccc2)cc1 ZINC000441494046 338415689 /nfs/dbraw/zinc/41/56/89/338415689.db2.gz UZHVTQRVAAEOTL-GHTZIAJQSA-N 0 0 321.464 5.242 20 0 DKADRN Cc1ccc([C@@H]2CCCN2C(=O)CC[C@H](C)c2ccccc2)cc1 ZINC000441494052 338415596 /nfs/dbraw/zinc/41/55/96/338415596.db2.gz UZHVTQRVAAEOTL-RXVVDRJESA-N 0 0 321.464 5.242 20 0 DKADRN Cc1ccc([C@H]2CCCN2C(=O)CC[C@@H](C)c2ccccc2)cc1 ZINC000441494055 338415679 /nfs/dbraw/zinc/41/56/79/338415679.db2.gz UZHVTQRVAAEOTL-WIYYLYMNSA-N 0 0 321.464 5.242 20 0 DKADRN O=C(Nc1cc(Cl)cc(F)c1F)c1ccc2sccc2c1 ZINC000441568651 338416849 /nfs/dbraw/zinc/41/68/49/338416849.db2.gz GUMGFRXTQDDNBU-UHFFFAOYSA-N 0 0 323.751 5.085 20 0 DKADRN CC(C)c1ccc(C(=O)Nc2cc(Cl)cc(F)c2F)s1 ZINC000441570614 338416984 /nfs/dbraw/zinc/41/69/84/338416984.db2.gz CGPFGULCNITMBY-UHFFFAOYSA-N 0 0 315.772 5.055 20 0 DKADRN CC(C)c1ccsc1C(=O)Nc1cc(Cl)cc(F)c1F ZINC000441615605 338417651 /nfs/dbraw/zinc/41/76/51/338417651.db2.gz ZNKQVLRBQMGGIB-UHFFFAOYSA-N 0 0 315.772 5.055 20 0 DKADRN Cc1cccc([C@H]2CCCN2C(=O)CC[C@H](C)c2ccccc2)c1 ZINC000441616658 338417698 /nfs/dbraw/zinc/41/76/98/338417698.db2.gz BRJVQECQJXSHJB-GHTZIAJQSA-N 0 0 321.464 5.242 20 0 DKADRN COc1cc(C(C)=O)ccc1S[C@H](C)c1cccc(C)c1 ZINC000441937026 338420123 /nfs/dbraw/zinc/42/01/23/338420123.db2.gz SVCJROSIMUGGRS-CQSZACIVSA-N 0 0 300.423 5.060 20 0 DKADRN COc1cc(C(C)=O)ccc1S[C@H](C)c1cc(F)ccc1F ZINC000441964510 338420337 /nfs/dbraw/zinc/42/03/37/338420337.db2.gz IFMXGKOSCVATJM-LLVKDONJSA-N 0 0 322.376 5.029 20 0 DKADRN COc1cc(C(C)=O)ccc1S[C@@H](C)c1cc(F)ccc1F ZINC000441964512 338420310 /nfs/dbraw/zinc/42/03/10/338420310.db2.gz IFMXGKOSCVATJM-NSHDSACASA-N 0 0 322.376 5.029 20 0 DKADRN CC(C)CC1(C(=O)N2Cc3ccccc3-c3ccccc3C2)CC1 ZINC000442017458 338420511 /nfs/dbraw/zinc/42/05/11/338420511.db2.gz JQBRYOYPZRJFMJ-UHFFFAOYSA-N 0 0 319.448 5.022 20 0 DKADRN Cc1cc(NCc2nc(C(F)(F)F)cs2)cc(C)c1Cl ZINC000442122997 338421551 /nfs/dbraw/zinc/42/15/51/338421551.db2.gz XVYYEWQFHNLBHX-UHFFFAOYSA-N 0 0 320.767 5.044 20 0 DKADRN C[C@@H](C(=O)Nc1ccccc1Nc1ccccc1)c1ccsc1 ZINC000442585513 338425372 /nfs/dbraw/zinc/42/53/72/338425372.db2.gz YZVCMXOVWXOGCX-CQSZACIVSA-N 0 0 322.433 5.234 20 0 DKADRN CSc1ccccc1[C@@H](C)N[C@@H](c1ccco1)c1ccccc1 ZINC000442657306 338426839 /nfs/dbraw/zinc/42/68/39/338426839.db2.gz VVLJQACDAGITRH-FOIQADDNSA-N 0 0 323.461 5.442 20 0 DKADRN CSc1ccccc1[C@H](C)N[C@@H](c1ccco1)c1ccccc1 ZINC000442657309 338426835 /nfs/dbraw/zinc/42/68/35/338426835.db2.gz VVLJQACDAGITRH-MGPUTAFESA-N 0 0 323.461 5.442 20 0 DKADRN CSc1ccccc1[C@@H](C)N[C@H](c1ccco1)c1ccccc1 ZINC000442657311 338426827 /nfs/dbraw/zinc/42/68/27/338426827.db2.gz VVLJQACDAGITRH-QRWLVFNGSA-N 0 0 323.461 5.442 20 0 DKADRN CSc1ccccc1[C@H](C)N[C@H](c1ccco1)c1ccccc1 ZINC000442657313 338426846 /nfs/dbraw/zinc/42/68/46/338426846.db2.gz VVLJQACDAGITRH-YWZLYKJASA-N 0 0 323.461 5.442 20 0 DKADRN CSc1ccccc1[C@@H](C)NCc1nc(C(C)C)c(C)s1 ZINC000442779244 335106231 /nfs/dbraw/zinc/10/62/31/335106231.db2.gz CSOYCKWLUIYVBE-GFCCVEGCSA-N 0 0 320.527 5.148 20 0 DKADRN CSc1ccccc1[C@H](C)NCc1nc(C(C)C)c(C)s1 ZINC000442779248 335106559 /nfs/dbraw/zinc/10/65/59/335106559.db2.gz CSOYCKWLUIYVBE-LBPRGKRZSA-N 0 0 320.527 5.148 20 0 DKADRN CC(=O)Nc1ccc([C@H](C)Nc2cc(C)c(Cl)c(C)c2)cc1 ZINC000442807587 338432978 /nfs/dbraw/zinc/43/29/78/338432978.db2.gz DZRJZHFXKATGEG-ZDUSSCGKSA-N 0 0 316.832 5.088 20 0 DKADRN CC(=O)Nc1cccc([C@H](C)Nc2cc(C)c(Cl)c(C)c2)c1 ZINC000442809673 338433055 /nfs/dbraw/zinc/43/30/55/338433055.db2.gz LCXYGGWMNKGDPS-ZDUSSCGKSA-N 0 0 316.832 5.088 20 0 DKADRN FC(F)C1CCC(Nc2cccc(-c3nccs3)c2)CC1 ZINC000442812023 338433253 /nfs/dbraw/zinc/43/32/53/338433253.db2.gz QCCNDFUZVSIOIQ-UHFFFAOYSA-N 0 0 308.397 5.046 20 0 DKADRN Cc1ccc(-c2cnc(CNc3ccc4ccoc4c3)o2)cc1 ZINC000442851242 338434622 /nfs/dbraw/zinc/43/46/22/338434622.db2.gz FLYGORFHJWWXNM-UHFFFAOYSA-N 0 0 304.349 5.008 20 0 DKADRN CSc1ccccc1[C@H](C)Nc1cccc(-c2ncc(C)o2)c1 ZINC000442852893 338434815 /nfs/dbraw/zinc/43/48/15/338434815.db2.gz GTJLFQMRGHFBCE-AWEZNQCLSA-N 0 0 324.449 5.545 20 0 DKADRN Clc1ccc(NCc2nccs2)c(-c2ccccc2)c1 ZINC000442855583 338435110 /nfs/dbraw/zinc/43/51/10/338435110.db2.gz MZWUJMXZMOQZJY-UHFFFAOYSA-N 0 0 300.814 5.076 20 0 DKADRN COCCC[C@H](Nc1cccc(Cl)c1)c1ccc(F)cc1 ZINC000442858905 338435341 /nfs/dbraw/zinc/43/53/41/338435341.db2.gz TYSLGQIXNCAQBF-KRWDZBQOSA-N 0 0 307.796 5.059 20 0 DKADRN COCCC[C@@H](Nc1cccc(Cl)c1)c1ccc(F)cc1 ZINC000442858908 338435357 /nfs/dbraw/zinc/43/53/57/338435357.db2.gz TYSLGQIXNCAQBF-QGZVFWFLSA-N 0 0 307.796 5.059 20 0 DKADRN Cc1csc(-c2ccc(NC3CCC(C(F)F)CC3)cc2)n1 ZINC000442860740 335642066 /nfs/dbraw/zinc/64/20/66/335642066.db2.gz SKFIQLMKKWFGLB-UHFFFAOYSA-N 0 0 322.424 5.354 20 0 DKADRN Cc1nc(CNc2ccc(Cl)cc2-c2ccccc2)oc1C ZINC000442860974 338435664 /nfs/dbraw/zinc/43/56/64/338435664.db2.gz CQKVCDHFZQULEH-UHFFFAOYSA-N 0 0 312.800 5.224 20 0 DKADRN FC(F)C1CCC(Nc2ccccc2CC(F)(F)F)CC1 ZINC000442862372 338435720 /nfs/dbraw/zinc/43/57/20/338435720.db2.gz ZUYHJLHORLBVMC-UHFFFAOYSA-N 0 0 307.306 5.027 20 0 DKADRN CO[C@@H](C)c1cccc(N[C@@H](C)c2ccccc2SC)c1 ZINC000442863363 338435826 /nfs/dbraw/zinc/43/58/26/338435826.db2.gz CNSJREFRZZPQOK-KBPBESRZSA-N 0 0 301.455 5.289 20 0 DKADRN CO[C@H](C)c1cccc(N[C@@H](C)c2ccccc2SC)c1 ZINC000442863365 338435883 /nfs/dbraw/zinc/43/58/83/338435883.db2.gz CNSJREFRZZPQOK-UONOGXRCSA-N 0 0 301.455 5.289 20 0 DKADRN CO[C@H](C)c1cccc(N[C@H](C)c2ccccc2SC)c1 ZINC000442863366 338435897 /nfs/dbraw/zinc/43/58/97/338435897.db2.gz CNSJREFRZZPQOK-ZIAGYGMSSA-N 0 0 301.455 5.289 20 0 DKADRN CSc1ccccc1[C@H](C)Nc1ccc(C)c(-c2ncco2)c1 ZINC000442863521 338435867 /nfs/dbraw/zinc/43/58/67/338435867.db2.gz RNYKFAKOXRHBLM-AWEZNQCLSA-N 0 0 324.449 5.545 20 0 DKADRN CSc1ccccc1[C@@H](C)Nc1ccc(C)c(-c2ncco2)c1 ZINC000442863523 338435861 /nfs/dbraw/zinc/43/58/61/338435861.db2.gz RNYKFAKOXRHBLM-CQSZACIVSA-N 0 0 324.449 5.545 20 0 DKADRN c1cc2ccc(NCc3csc(-c4ccsc4)n3)cc2o1 ZINC000442863541 338435908 /nfs/dbraw/zinc/43/59/08/338435908.db2.gz XPZBMJXNLZDAKX-UHFFFAOYSA-N 0 0 312.419 5.230 20 0 DKADRN CC(=O)c1c(C)cc(C)c(CNc2ccc3ccoc3c2)c1C ZINC000442864242 338436018 /nfs/dbraw/zinc/43/60/18/338436018.db2.gz FTKMBZLPIKTSFD-UHFFFAOYSA-N 0 0 307.393 5.173 20 0 DKADRN CC[C@H](C)n1ncc(N[C@@H](C)c2ccccc2SC)c1C ZINC000442866104 338436085 /nfs/dbraw/zinc/43/60/85/338436085.db2.gz VLUGOQAHUCKIRQ-STQMWFEESA-N 0 0 303.475 5.058 20 0 DKADRN FC(F)C1CCC(Nc2ccc(CC(F)(F)F)cc2)CC1 ZINC000442866562 338436095 /nfs/dbraw/zinc/43/60/95/338436095.db2.gz WRQVWRNXADPKEX-UHFFFAOYSA-N 0 0 307.306 5.027 20 0 DKADRN FC(F)C1CCC(Nc2ccc(CCC(F)(F)F)cc2)CC1 ZINC000442867523 338436218 /nfs/dbraw/zinc/43/62/18/338436218.db2.gz YRIXAZRICOGQJX-UHFFFAOYSA-N 0 0 321.333 5.417 20 0 DKADRN CSc1ccccc1[C@H](C)N[C@@H](C)c1csc(C(C)C)n1 ZINC000442868068 338436312 /nfs/dbraw/zinc/43/63/12/338436312.db2.gz MSYGHNWHKFMZNL-STQMWFEESA-N 0 0 320.527 5.400 20 0 DKADRN CCOCc1ccc(N[C@H](C)c2ccccc2SC)cc1 ZINC000442870290 335647717 /nfs/dbraw/zinc/64/77/17/335647717.db2.gz JTQDWMIVEVQASH-CQSZACIVSA-N 0 0 301.455 5.118 20 0 DKADRN CSc1ccccc1[C@@H](C)Nc1ccc(COC(C)C)cc1 ZINC000442873052 338436969 /nfs/dbraw/zinc/43/69/69/338436969.db2.gz JQAMFEPGYSKHGE-OAHLLOKOSA-N 0 0 315.482 5.507 20 0 DKADRN COCCC[C@@H](Nc1cccc(SC)c1)c1ccc(F)cc1 ZINC000442873267 338436941 /nfs/dbraw/zinc/43/69/41/338436941.db2.gz KEAXGWPBLYDFRY-GOSISDBHSA-N 0 0 319.445 5.127 20 0 DKADRN c1cc2ccc(NCc3ncc(-c4ccccc4)s3)cc2o1 ZINC000442874518 338437193 /nfs/dbraw/zinc/43/71/93/338437193.db2.gz MITHSUSIMXIVOA-UHFFFAOYSA-N 0 0 306.390 5.168 20 0 DKADRN CSc1ccccc1[C@@H](C)Nc1cnn(C2CCCC2)c1C ZINC000442874837 338437175 /nfs/dbraw/zinc/43/71/75/338437175.db2.gz MRVNERQHXMRWQL-CYBMUJFWSA-N 0 0 315.486 5.202 20 0 DKADRN Clc1ccc(NCc2ncc(C3CC3)o2)c(-c2ccccc2)c1 ZINC000442874987 338437180 /nfs/dbraw/zinc/43/71/80/338437180.db2.gz SAOKSLUZRZQUIL-UHFFFAOYSA-N 0 0 324.811 5.485 20 0 DKADRN CC(C)CCc1nc(CNc2ccc3ccoc3c2)cs1 ZINC000442878439 338437639 /nfs/dbraw/zinc/43/76/39/338437639.db2.gz YXCTZDBTNDSJGE-UHFFFAOYSA-N 0 0 300.427 5.090 20 0 DKADRN COCCC[C@H](Nc1ccc(Cl)cc1)c1ccc(F)cc1 ZINC000442879481 338437651 /nfs/dbraw/zinc/43/76/51/338437651.db2.gz WJFNIKXMJFOKJE-KRWDZBQOSA-N 0 0 307.796 5.059 20 0 DKADRN COCCC[C@@H](Nc1ccc(Cl)cc1)c1ccc(F)cc1 ZINC000442879483 338437669 /nfs/dbraw/zinc/43/76/69/338437669.db2.gz WJFNIKXMJFOKJE-QGZVFWFLSA-N 0 0 307.796 5.059 20 0 DKADRN C[C@@H](N[C@@H]1CCc2c1c(F)ccc2F)c1cc2ccccc2o1 ZINC000442885448 338438188 /nfs/dbraw/zinc/43/81/88/338438188.db2.gz XICXMEJRPBZZAT-BDJLRTHQSA-N 0 0 313.347 5.049 20 0 DKADRN C[C@@H](N[C@H]1CCc2c1c(F)ccc2F)c1cc2ccccc2o1 ZINC000442885561 338438175 /nfs/dbraw/zinc/43/81/75/338438175.db2.gz XICXMEJRPBZZAT-BZNIZROVSA-N 0 0 313.347 5.049 20 0 DKADRN C[C@@H](NCc1cc(F)ccc1Cl)c1cc2ccccc2o1 ZINC000442895350 338438948 /nfs/dbraw/zinc/43/89/48/338438948.db2.gz UOTYLIZMDDXCFZ-LLVKDONJSA-N 0 0 303.764 5.076 20 0 DKADRN C[C@H](c1ccccc1)N(Cc1ncc(C2CC2)o1)c1ccccc1 ZINC000442904730 338439243 /nfs/dbraw/zinc/43/92/43/338439243.db2.gz RICAIXTUYDOEBH-MRXNPFEDSA-N 0 0 318.420 5.320 20 0 DKADRN Clc1cc2cccnc2c(CNc2ccc3ccoc3c2)c1 ZINC000442987263 338440923 /nfs/dbraw/zinc/44/09/23/338440923.db2.gz CHXAUAAZGCCHEQ-UHFFFAOYSA-N 0 0 308.768 5.247 20 0 DKADRN c1csc(-c2ncc(CNc3ccc4ccoc4c3)s2)c1 ZINC000442991047 338440975 /nfs/dbraw/zinc/44/09/75/338440975.db2.gz JTNNDFWIIBXVEP-UHFFFAOYSA-N 0 0 312.419 5.230 20 0 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c1cc2ccc(NCc3cccc(-c4ccccn4)c3)cc2o1 ZINC000443013612 338442127 /nfs/dbraw/zinc/44/21/27/338442127.db2.gz WVXUNPCDDVZFSD-UHFFFAOYSA-N 0 0 300.361 5.107 20 0 DKADRN Fc1cc(-c2ccncc2)ccc1CNc1ccc2ccoc2c1 ZINC000443019122 338442191 /nfs/dbraw/zinc/44/21/91/338442191.db2.gz KJNYLEQQPCWJRF-UHFFFAOYSA-N 0 0 318.351 5.246 20 0 DKADRN CCC[C@H](N[C@H](c1ccco1)c1ccccc1)c1ccsc1 ZINC000443079791 338443567 /nfs/dbraw/zinc/44/35/67/338443567.db2.gz OZKNAPWAVJPQRR-HKUYNNGSSA-N 0 0 311.450 5.562 20 0 DKADRN CCC[C@@H](N[C@@H](c1ccco1)c1ccccc1)c1ccsc1 ZINC000443079798 338443569 /nfs/dbraw/zinc/44/35/69/338443569.db2.gz OZKNAPWAVJPQRR-IEBWSBKVSA-N 0 0 311.450 5.562 20 0 DKADRN CCC[C@H](N[C@@H](c1ccco1)c1ccccc1)c1ccsc1 ZINC000443079802 338443736 /nfs/dbraw/zinc/44/37/36/338443736.db2.gz OZKNAPWAVJPQRR-PKOBYXMFSA-N 0 0 311.450 5.562 20 0 DKADRN CCC[C@@H](N[C@@H](C)c1nc(C(C)(C)C)cs1)c1ccsc1 ZINC000443084205 336399212 /nfs/dbraw/zinc/39/92/12/336399212.db2.gz GEDCOKAEJFYLAH-GXTWGEPZSA-N 0 0 322.543 5.694 20 0 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/nfs/dbraw/zinc/49/05/52/338490552.db2.gz POPMJWCJWYFXLV-KRWDZBQOSA-N 0 0 324.468 5.213 20 0 DKADRN Cc1ccccc1C[C@@H](C)N(C)C(=O)Nc1ccccc1C(C)C ZINC000444838291 338490554 /nfs/dbraw/zinc/49/05/54/338490554.db2.gz POPMJWCJWYFXLV-QGZVFWFLSA-N 0 0 324.468 5.213 20 0 DKADRN Cc1cc(C)c(NC(=O)N(C)[C@H](C)Cc2ccccc2C)c(C)c1 ZINC000444839819 338490630 /nfs/dbraw/zinc/49/06/30/338490630.db2.gz RCMRNACHRVPYML-GOSISDBHSA-N 0 0 324.468 5.015 20 0 DKADRN Cc1cc(C)c(NC(=O)N(C)[C@@H](C)Cc2ccccc2C)c(C)c1 ZINC000444839822 338490555 /nfs/dbraw/zinc/49/05/55/338490555.db2.gz RCMRNACHRVPYML-SFHVURJKSA-N 0 0 324.468 5.015 20 0 DKADRN O=C(Nc1ccc2c(c1)oc1ccccc12)N1CCCC12CCC2 ZINC000444855014 338490755 /nfs/dbraw/zinc/49/07/55/338490755.db2.gz XHVUGGKNHGYCDC-UHFFFAOYSA-N 0 0 320.392 5.136 20 0 DKADRN O=C(Nc1ccsc1)N1CCCC[C@@H]1c1cccc(Cl)c1 ZINC000444910216 338491797 /nfs/dbraw/zinc/49/17/97/338491797.db2.gz JEPHCNSNEXKKIT-OAHLLOKOSA-N 0 0 320.845 5.161 20 0 DKADRN CC(C)(C)C[C@@H]1CCCN1C(=O)Nc1cccc(C(C)(F)F)c1 ZINC000444931590 338492055 /nfs/dbraw/zinc/49/20/55/338492055.db2.gz HYKGTWSJPOGZQR-HNNXBMFYSA-N 0 0 324.415 5.231 20 0 DKADRN CC(C)(C)C[C@H]1CCCN1C(=O)Nc1cccc(C(C)(F)F)c1 ZINC000444931591 338492079 /nfs/dbraw/zinc/49/20/79/338492079.db2.gz HYKGTWSJPOGZQR-OAHLLOKOSA-N 0 0 324.415 5.231 20 0 DKADRN CC(C)(C)C1=CCN(C(=O)Nc2cccc(C(C)(F)F)c2)CC1 ZINC000444938921 338492237 /nfs/dbraw/zinc/49/22/37/338492237.db2.gz ANPPWFTWNPXGOB-UHFFFAOYSA-N 0 0 322.399 5.008 20 0 DKADRN CSc1cccc(NC(=O)Nc2cccc(C(C)(F)F)c2)c1 ZINC000444939443 338492273 /nfs/dbraw/zinc/49/22/73/338492273.db2.gz DENGKIJNSVQWOR-UHFFFAOYSA-N 0 0 322.380 5.164 20 0 DKADRN Cc1cc2cc[nH]c2cc1NC(=O)Nc1cccc2ccsc21 ZINC000444974994 338492983 /nfs/dbraw/zinc/49/29/83/338492983.db2.gz KCFDKQGVTWGHPA-UHFFFAOYSA-N 0 0 321.405 5.335 20 0 DKADRN Cc1ccccc1[C@H](C)N(C)C(=O)Nc1cc2[nH]ccc2cc1C ZINC000444975163 338492960 /nfs/dbraw/zinc/49/29/60/338492960.db2.gz KUTWRNVECQXUTF-HNNXBMFYSA-N 0 0 321.424 5.010 20 0 DKADRN CCC(CC)N(CC(C)C)C(=O)Nc1cc2[nH]ccc2cc1C ZINC000444986248 338493211 /nfs/dbraw/zinc/49/32/11/338493211.db2.gz MLMPLHGGPVXASQ-UHFFFAOYSA-N 0 0 315.461 5.155 20 0 DKADRN Cc1cc2cc[nH]c2cc1NC(=O)N(CC(C)C)CC(C)(C)C ZINC000444989299 338493338 /nfs/dbraw/zinc/49/33/38/338493338.db2.gz RJHSCDISVHGIMB-UHFFFAOYSA-N 0 0 315.461 5.012 20 0 DKADRN Cc1cc2cc[nH]c2cc1NC(=O)Nc1csc2ccccc12 ZINC000444992545 338493402 /nfs/dbraw/zinc/49/34/02/338493402.db2.gz YHKMERFADRPMDS-UHFFFAOYSA-N 0 0 321.405 5.335 20 0 DKADRN Cc1cscc1NC(=O)Nc1ccc(OC(C)C)cc1Cl ZINC000445007473 338493759 /nfs/dbraw/zinc/49/37/59/338493759.db2.gz YRXYNQGPPUOFEJ-UHFFFAOYSA-N 0 0 324.833 5.141 20 0 DKADRN Cc1cc(NC(=O)N2CCCC23CCC3)ccc1-c1ccccc1 ZINC000445115707 338494681 /nfs/dbraw/zinc/49/46/81/338494681.db2.gz PYTCXCVACSMOLV-UHFFFAOYSA-N 0 0 320.436 5.212 20 0 DKADRN Cc1oc2ccc(NC(=O)Nc3cc(C)c(O)cc3C)cc2c1C ZINC000445156524 338495228 /nfs/dbraw/zinc/49/52/28/338495228.db2.gz HXYXREGNFBQLSR-UHFFFAOYSA-N 0 0 324.380 5.016 20 0 DKADRN CC[C@@H](c1ccc(Cl)cc1Cl)N(C)Cc1cscn1 ZINC000445221705 332356538 /nfs/dbraw/zinc/35/65/38/332356538.db2.gz PPWXMJNLNXQDDL-AWEZNQCLSA-N 0 0 315.269 5.033 20 0 DKADRN CC[C@H](c1ccc(Cl)cc1Cl)N(C)Cc1cscn1 ZINC000445221715 332356557 /nfs/dbraw/zinc/35/65/57/332356557.db2.gz PPWXMJNLNXQDDL-CQSZACIVSA-N 0 0 315.269 5.033 20 0 DKADRN Cc1c2cc(C)ccc2sc1C(=O)Nc1ccc(F)cc1F ZINC000445251668 333763101 /nfs/dbraw/zinc/76/31/01/333763101.db2.gz SZNULLXAFJTPQN-UHFFFAOYSA-N 0 0 317.360 5.049 20 0 DKADRN Clc1ccc(-c2noc([C@H]3CCCCS3)n2)c(Cl)c1 ZINC000445465163 331662321 /nfs/dbraw/zinc/66/23/21/331662321.db2.gz RHWRJYMCOIKPOG-LLVKDONJSA-N 0 0 315.225 5.002 20 0 DKADRN Cc1c2ccccc2oc1-c1noc(C2CCC(F)(F)CC2)n1 ZINC000445487160 338496796 /nfs/dbraw/zinc/49/67/96/338496796.db2.gz DOCOMZVGCHYYKG-UHFFFAOYSA-N 0 0 318.323 5.084 20 0 DKADRN C(=C/c1cccc2ccccc12)\c1nc(C2CCSCC2)no1 ZINC000445537960 338499186 /nfs/dbraw/zinc/49/91/86/338499186.db2.gz IVVFCTUBRSSAEI-CMDGGOBGSA-N 0 0 322.433 5.004 20 0 DKADRN C(=C\c1cccc2ccccc12)\c1nc(C2CCSCC2)no1 ZINC000445537963 338499116 /nfs/dbraw/zinc/49/91/16/338499116.db2.gz IVVFCTUBRSSAEI-HJWRWDBZSA-N 0 0 322.433 5.004 20 0 DKADRN FC(F)c1cccc(-c2nc(-c3coc4ccccc34)no2)c1 ZINC000445577022 338500753 /nfs/dbraw/zinc/50/07/53/338500753.db2.gz YROHBUHBZUCDGH-UHFFFAOYSA-N 0 0 312.275 5.087 20 0 DKADRN Cc1cc(C(=O)N(c2ccc3[nH]ccc3c2)[C@H](C)CC(C)C)co1 ZINC000445620303 338502712 /nfs/dbraw/zinc/50/27/12/338502712.db2.gz XUPFWADTLAUIKN-CQSZACIVSA-N 0 0 324.424 5.151 20 0 DKADRN Cc1cscc1-c1noc(CSc2ccccc2Cl)n1 ZINC000445623256 338502921 /nfs/dbraw/zinc/50/29/21/338502921.db2.gz FTJMUQUUWRJUTQ-UHFFFAOYSA-N 0 0 322.842 5.052 20 0 DKADRN Cc1cscc1-c1noc([C@H](C)SCc2ccccc2)n1 ZINC000445626379 338503131 /nfs/dbraw/zinc/50/31/31/338503131.db2.gz IESFQTUGWUTDDF-LBPRGKRZSA-N 0 0 316.451 5.101 20 0 DKADRN CC(C)c1ccccc1NC(=O)CCCc1ccc(F)c(F)c1 ZINC000445633925 338503684 /nfs/dbraw/zinc/50/36/84/338503684.db2.gz XIVZDOSIJYWZSY-UHFFFAOYSA-N 0 0 317.379 5.050 20 0 DKADRN Cc1cscc1-c1nc(=O)c2cc(-c3ccccc3)sc2[nH]1 ZINC000445646058 338504510 /nfs/dbraw/zinc/50/45/10/338504510.db2.gz AUDMNUYXOFWCNY-UHFFFAOYSA-N 0 0 324.430 5.101 20 0 DKADRN Cc1cscc1-c1nc2ccc(-c3ccccc3)cc2c(=O)[nH]1 ZINC000445653842 338504729 /nfs/dbraw/zinc/50/47/29/338504729.db2.gz HKNITISOXQBLOA-UHFFFAOYSA-N 0 0 318.401 5.039 20 0 DKADRN CC(C)(c1noc([C@H]2CCCCS2)n1)c1ccccc1Cl ZINC000445695601 338506052 /nfs/dbraw/zinc/50/60/52/338506052.db2.gz WJOHLYBAKZOIPD-CYBMUJFWSA-N 0 0 322.861 5.007 20 0 DKADRN Cc1cc(Cl)cc2cc(-c3noc([C@H]4CCCS4)n3)oc21 ZINC000445711111 338506214 /nfs/dbraw/zinc/50/62/14/338506214.db2.gz DABALIQLHDTHPA-GFCCVEGCSA-N 0 0 320.801 5.013 20 0 DKADRN Cc1cc(-c2noc([C@@H](C)Sc3ccc(C)cc3)n2)c(C)o1 ZINC000445861141 338513328 /nfs/dbraw/zinc/51/33/28/338513328.db2.gz JSALDHSFCOAQPP-CYBMUJFWSA-N 0 0 314.410 5.108 20 0 DKADRN CCOc1cccc(NC(=O)Nc2c(C)cccc2C(C)C)c1 ZINC000446021066 338518076 /nfs/dbraw/zinc/51/80/76/338518076.db2.gz OUROOGWFRZRTID-UHFFFAOYSA-N 0 0 312.413 5.161 20 0 DKADRN CCOc1cccc(NC(=O)Nc2ccccc2C(C)(C)C)c1 ZINC000446023669 338518030 /nfs/dbraw/zinc/51/80/30/338518030.db2.gz HQTFWMIEICVGGR-UHFFFAOYSA-N 0 0 312.413 5.027 20 0 DKADRN CC(C)(C)c1ccccc1NC(=O)N1CCCCC(C)(C)C1 ZINC000446023838 338518080 /nfs/dbraw/zinc/51/80/80/338518080.db2.gz JWOFMJSOVYEOER-UHFFFAOYSA-N 0 0 302.462 5.028 20 0 DKADRN Cc1cccc(C(C)C)c1NC(=O)N1CCCC2(CCCC2)C1 ZINC000446034768 338518496 /nfs/dbraw/zinc/51/84/96/338518496.db2.gz FRAYMTYRTHSDQM-UHFFFAOYSA-N 0 0 314.473 5.307 20 0 DKADRN CC(C)N(C(=O)CCCc1csc2ccccc12)C1CCC1 ZINC000446047358 338518941 /nfs/dbraw/zinc/51/89/41/338518941.db2.gz PASSNDCDOAQJBZ-UHFFFAOYSA-N 0 0 315.482 5.014 20 0 DKADRN Clc1cccc(CSc2nncc3ccccc32)c1Cl ZINC000446060735 338519359 /nfs/dbraw/zinc/51/93/59/338519359.db2.gz JMEPHLGRSPKNNF-UHFFFAOYSA-N 0 0 321.232 5.229 20 0 DKADRN Clc1cccc(CSc2nnc(C3CC3)s2)c1Cl ZINC000446070408 338519958 /nfs/dbraw/zinc/51/99/58/338519958.db2.gz NCKWKELAZJUZDZ-UHFFFAOYSA-N 0 0 317.266 5.015 20 0 DKADRN C[C@@H](C1CCCCC1)N(C)C(=O)Nc1cccc(C(F)F)c1 ZINC000446112620 338520970 /nfs/dbraw/zinc/52/09/70/338520970.db2.gz QHLXFNHIEXQYDR-LBPRGKRZSA-N 0 0 310.388 5.057 20 0 DKADRN CC(C)=CCS[C@H](C)c1nnc(-c2cccc(Cl)c2)o1 ZINC000446117522 338521014 /nfs/dbraw/zinc/52/10/14/338521014.db2.gz HTOWNSNFXDMFTN-LLVKDONJSA-N 0 0 308.834 5.150 20 0 DKADRN CC(C)=CCS[C@H](C)C(=O)Nc1ccc(Cl)cc1Cl ZINC000446121230 338521129 /nfs/dbraw/zinc/52/11/29/338521129.db2.gz FTIZEAOFDYIOQR-SNVBAGLBSA-N 0 0 318.269 5.020 20 0 DKADRN CC(C)=CCS[C@@H](C)c1nnc(-c2ccc(C)c(C)c2)o1 ZINC000446128749 333355154 /nfs/dbraw/zinc/35/51/54/333355154.db2.gz DCLDSORGGXUPSW-AWEZNQCLSA-N 0 0 302.443 5.114 20 0 DKADRN CC(C)=CCS[C@@H](C)C(=O)Nc1cccc(Cl)c1Cl ZINC000446129462 338521245 /nfs/dbraw/zinc/52/12/45/338521245.db2.gz FRINESCWWSAIAA-JTQLQIEISA-N 0 0 318.269 5.020 20 0 DKADRN C[C@@H](C1CCCCC1)N(C)C(=O)Nc1ccccc1C(C)(C)C ZINC000446131988 338521240 /nfs/dbraw/zinc/52/12/40/338521240.db2.gz SGKIRDPBDNQWGL-HNNXBMFYSA-N 0 0 316.489 5.417 20 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Cc1cccc(C)c1NC(=O)c1cccc2c1ccn2CC(C)C ZINC000446308373 338525078 /nfs/dbraw/zinc/52/50/78/338525078.db2.gz UYYREVCZONLILZ-UHFFFAOYSA-N 0 0 320.436 5.166 20 0 DKADRN CC(C)(C)Oc1ccc(NC(=O)Nc2ccsc2Cl)cc1 ZINC000446322881 338525533 /nfs/dbraw/zinc/52/55/33/338525533.db2.gz PRFOHCKRHMKBAZ-UHFFFAOYSA-N 0 0 324.833 5.223 20 0 DKADRN O=C(Nc1cccc2ccsc21)N1CCCC2(CCCC2)C1 ZINC000446339656 338526070 /nfs/dbraw/zinc/52/60/70/338526070.db2.gz GAHVGJMBJKLKDE-UHFFFAOYSA-N 0 0 314.454 5.089 20 0 DKADRN CC(C)CN(Cc1ccccc1)C(=O)Nc1ccsc1Cl ZINC000446461752 338528522 /nfs/dbraw/zinc/52/85/22/338528522.db2.gz FUOSMXADFQLMLM-UHFFFAOYSA-N 0 0 322.861 5.092 20 0 DKADRN O=C(Nc1ccsc1Cl)N[C@@H](c1ccccc1)C1CCC1 ZINC000446465509 338528543 /nfs/dbraw/zinc/52/85/43/338528543.db2.gz VFAYMOACQIHGQM-AWEZNQCLSA-N 0 0 320.845 5.064 20 0 DKADRN C[C@H](NC(=O)Nc1ccsc1Cl)c1cc2ccccc2o1 ZINC000446467218 338528562 /nfs/dbraw/zinc/52/85/62/338528562.db2.gz RSVDMLPDYHIOOD-VIFPVBQESA-N 0 0 320.801 5.030 20 0 DKADRN CCC[C@@H](NC(=O)Nc1ccsc1Cl)c1ccccc1 ZINC000446468422 338528571 /nfs/dbraw/zinc/52/85/71/338528571.db2.gz KUNQBZLNQZJNHO-GFCCVEGCSA-N 0 0 308.834 5.064 20 0 DKADRN CCC[C@H](NC(=O)Nc1ccsc1Cl)c1ccccc1 ZINC000446468423 338528598 /nfs/dbraw/zinc/52/85/98/338528598.db2.gz KUNQBZLNQZJNHO-LBPRGKRZSA-N 0 0 308.834 5.064 20 0 DKADRN CC(C)(C)[C@@H]1CCCN(C(=O)Nc2ccsc2Cl)CC1 ZINC000446469039 338528592 /nfs/dbraw/zinc/52/85/92/338528592.db2.gz RKOKOGMBHRPBFT-LLVKDONJSA-N 0 0 314.882 5.082 20 0 DKADRN CC(C)(C)[C@H]1CCCN(C(=O)Nc2ccsc2Cl)CC1 ZINC000446469040 338528620 /nfs/dbraw/zinc/52/86/20/338528620.db2.gz RKOKOGMBHRPBFT-NSHDSACASA-N 0 0 314.882 5.082 20 0 DKADRN Cc1ccc(C)c([C@H](C)N(C)C(=O)Nc2ccsc2Cl)c1 ZINC000446471470 338528703 /nfs/dbraw/zinc/52/87/03/338528703.db2.gz LRFNUTXDDCTLSI-LBPRGKRZSA-N 0 0 322.861 5.243 20 0 DKADRN CC(C)c1ccc(CN(C)C(=O)Nc2ccsc2Cl)cc1 ZINC000446474012 333404371 /nfs/dbraw/zinc/40/43/71/333404371.db2.gz FXQWWTWHOBGXHB-UHFFFAOYSA-N 0 0 322.861 5.189 20 0 DKADRN Cc1ccc([C@@H]2CCCN2C(=O)Nc2ccsc2Cl)cc1 ZINC000446476231 338528738 /nfs/dbraw/zinc/52/87/38/338528738.db2.gz HJXFIPFNSGWDFE-AWEZNQCLSA-N 0 0 320.845 5.079 20 0 DKADRN Cc1ccc([C@H]2CCCN2C(=O)Nc2ccsc2Cl)cc1 ZINC000446476233 338528768 /nfs/dbraw/zinc/52/87/68/338528768.db2.gz HJXFIPFNSGWDFE-CQSZACIVSA-N 0 0 320.845 5.079 20 0 DKADRN CC[C@@H](c1ccccc1)N(CC)C(=O)Nc1ccsc1Cl ZINC000446569713 338530524 /nfs/dbraw/zinc/53/05/24/338530524.db2.gz RGCUTUDNJXXOSE-AWEZNQCLSA-N 0 0 322.861 5.407 20 0 DKADRN Cc1ccc([C@@H](C)N(C)C(=O)Nc2ccsc2Cl)c(C)c1 ZINC000446591524 338531166 /nfs/dbraw/zinc/53/11/66/338531166.db2.gz SWJDAOFIXWIUJW-GFCCVEGCSA-N 0 0 322.861 5.243 20 0 DKADRN Cc1ccc([C@H](C)N(C)C(=O)Nc2ccsc2Cl)c(C)c1 ZINC000446591525 338531163 /nfs/dbraw/zinc/53/11/63/338531163.db2.gz SWJDAOFIXWIUJW-LBPRGKRZSA-N 0 0 322.861 5.243 20 0 DKADRN FC(F)n1ccnc1CSCc1cccc(Cl)c1Cl ZINC000446703803 338532872 /nfs/dbraw/zinc/53/28/72/338532872.db2.gz AHCYYOACYRHUGZ-UHFFFAOYSA-N 0 0 323.195 5.018 20 0 DKADRN CC(C)c1cccc(C(C)C)c1NC(=O)N1CC[C@H](C(C)C)C1 ZINC000446714479 338533397 /nfs/dbraw/zinc/53/33/97/338533397.db2.gz JHMVSKMNXYMSDN-INIZCTEOSA-N 0 0 316.489 5.443 20 0 DKADRN CC(C)c1cccc(C(C)C)c1NC(=O)N1CC[C@@H](C(C)C)C1 ZINC000446714480 338533363 /nfs/dbraw/zinc/53/33/63/338533363.db2.gz JHMVSKMNXYMSDN-MRXNPFEDSA-N 0 0 316.489 5.443 20 0 DKADRN Cc1nc(CSCc2csc(C3CCCC3)n2)sc1C ZINC000446797827 338536277 /nfs/dbraw/zinc/53/62/77/338536277.db2.gz SUERWVSCXLQHQN-UHFFFAOYSA-N 0 0 324.540 5.307 20 0 DKADRN Cc1nc(CSCc2cc(C)nc3ccccc23)sc1C ZINC000446798852 338536198 /nfs/dbraw/zinc/53/61/98/338536198.db2.gz GTGBQNLDPLQORS-UHFFFAOYSA-N 0 0 314.479 5.050 20 0 DKADRN CC[C@H](Nc1ccc(C)c(-c2ncco2)c1)c1cccc(F)c1 ZINC000446883956 338539332 /nfs/dbraw/zinc/53/93/32/338539332.db2.gz MYSPFKMXHCFKBZ-SFHVURJKSA-N 0 0 310.372 5.352 20 0 DKADRN CC(=O)Nc1ccc(N[C@H](c2ccc(C)cc2)C2CCCC2)cc1 ZINC000446912853 338540256 /nfs/dbraw/zinc/54/02/56/338540256.db2.gz BAJBHYVLWARFSI-NRFANRHFSA-N 0 0 322.452 5.297 20 0 DKADRN CC[C@@H](C)Sc1ccc(NC(=O)N2CC[C@H](CC)C2)c(C)c1 ZINC000446918649 338540379 /nfs/dbraw/zinc/54/03/79/338540379.db2.gz BCKYACZTJODXQE-CABCVRRESA-N 0 0 320.502 5.149 20 0 DKADRN CC(=O)Nc1cccc(N[C@@H](c2ccc(C)cc2)C2CCCC2)c1 ZINC000446921477 338540495 /nfs/dbraw/zinc/54/04/95/338540495.db2.gz HBDHGWBYAVKHMS-OAQYLSRUSA-N 0 0 322.452 5.297 20 0 DKADRN CC[C@@H]1CCN(C(=O)Nc2ccc(C(C)C)cc2C(C)C)C1 ZINC000446949804 338541804 /nfs/dbraw/zinc/54/18/04/338541804.db2.gz JPOUVONJQVBWEQ-OAHLLOKOSA-N 0 0 302.462 5.197 20 0 DKADRN FC(F)(F)c1cc(SCc2nccs2)ccc1Cl ZINC000446972619 338542126 /nfs/dbraw/zinc/54/21/26/338542126.db2.gz AHKOKCHFKZMCMB-UHFFFAOYSA-N 0 0 309.765 5.108 20 0 DKADRN Clc1ccccc1Oc1ccccc1NCc1nccs1 ZINC000447001965 338543033 /nfs/dbraw/zinc/54/30/33/338543033.db2.gz XNYAXUNYSRPQGQ-UHFFFAOYSA-N 0 0 316.813 5.201 20 0 DKADRN CC[C@@H](c1ccccc1)[S@](=O)Cc1ccc(C)cc1Cl ZINC000447083198 338544819 /nfs/dbraw/zinc/54/48/19/338544819.db2.gz AYCYFDQOVLWEDI-FXAWDEMLSA-N 0 0 306.858 5.048 20 0 DKADRN CC[C@H](c1ccccc1)[S@@](=O)Cc1ccc(C)cc1Cl ZINC000447083209 338544813 /nfs/dbraw/zinc/54/48/13/338544813.db2.gz AYCYFDQOVLWEDI-XLIONFOSSA-N 0 0 306.858 5.048 20 0 DKADRN CC[C@H](c1ccc(F)cc1)[S@](=O)Cc1ccc(C)cc1Cl ZINC000447093346 338545137 /nfs/dbraw/zinc/54/51/37/338545137.db2.gz IXWFYHUIYGJARX-DYESRHJHSA-N 0 0 324.848 5.188 20 0 DKADRN CC[C@@H](c1ccc(F)cc1)[S@](=O)Cc1ccc(C)cc1Cl ZINC000447093347 338545158 /nfs/dbraw/zinc/54/51/58/338545158.db2.gz IXWFYHUIYGJARX-LAUBAEHRSA-N 0 0 324.848 5.188 20 0 DKADRN CC[C@H](c1ccc(F)cc1)[S@@](=O)Cc1ccc(C)cc1Cl ZINC000447093348 338545227 /nfs/dbraw/zinc/54/52/27/338545227.db2.gz IXWFYHUIYGJARX-UTKZUKDTSA-N 0 0 324.848 5.188 20 0 DKADRN Cc1c2cc(C)ccc2sc1C(=O)Nc1cc(F)ccc1F ZINC000447101538 338545429 /nfs/dbraw/zinc/54/54/29/338545429.db2.gz NLZKVEKOIJPDAK-UHFFFAOYSA-N 0 0 317.360 5.049 20 0 DKADRN C[C@@H](c1ccc(F)cc1)[S@@](=O)Cc1ccc(C2CCC2)cc1 ZINC000447105672 338545606 /nfs/dbraw/zinc/54/56/06/338545606.db2.gz ITHDWLKCHXCEEY-FPTDNZKUSA-N 0 0 316.441 5.103 20 0 DKADRN C[C@H](c1ccc(F)cc1)[S@](=O)Cc1ccc(C2CCC2)cc1 ZINC000447105673 338545633 /nfs/dbraw/zinc/54/56/33/338545633.db2.gz ITHDWLKCHXCEEY-JLCFBVMHSA-N 0 0 316.441 5.103 20 0 DKADRN C[C@H](c1ccc(F)cc1)[S@@](=O)Cc1ccc(C2CCC2)cc1 ZINC000447105674 338545613 /nfs/dbraw/zinc/54/56/13/338545613.db2.gz ITHDWLKCHXCEEY-PEBXRYMYSA-N 0 0 316.441 5.103 20 0 DKADRN O=[S@](Cc1cc2ccccc2o1)Cc1ccc(C2CCC2)cc1 ZINC000447105987 338545622 /nfs/dbraw/zinc/54/56/22/338545622.db2.gz LAPTZXLLAFUUNF-QHCPKHFHSA-N 0 0 324.445 5.149 20 0 DKADRN O=[S@](Cc1ccc(C2CCC2)cc1)Cc1ccccc1Cl ZINC000447108274 338545725 /nfs/dbraw/zinc/54/57/25/338545725.db2.gz JCVBVOIRXWTLTI-OAQYLSRUSA-N 0 0 318.869 5.056 20 0 DKADRN Cc1cc(C[S@@](=O)Cc2ccc(C3CCC3)cc2)c(C)s1 ZINC000447108807 338545664 /nfs/dbraw/zinc/54/56/64/338545664.db2.gz VFEFIILQKNHPIN-NRFANRHFSA-N 0 0 318.507 5.081 20 0 DKADRN Cc1cc(C[S@](=O)Cc2ccc(C3CCC3)cc2)c(C)s1 ZINC000447108812 333497825 /nfs/dbraw/zinc/49/78/25/333497825.db2.gz VFEFIILQKNHPIN-OAQYLSRUSA-N 0 0 318.507 5.081 20 0 DKADRN Cc1cccc([C@H](C)[S@](=O)Cc2ccc(C3CCC3)cc2)c1 ZINC000447109433 338545656 /nfs/dbraw/zinc/54/56/56/338545656.db2.gz NPYMFKWWWNOAOF-KSFYIVLOSA-N 0 0 312.478 5.272 20 0 DKADRN Cc1cccc([C@@H](C)[S@@](=O)Cc2ccc(C3CCC3)cc2)c1 ZINC000447109435 338545666 /nfs/dbraw/zinc/54/56/66/338545666.db2.gz NPYMFKWWWNOAOF-ZHRRBRCNSA-N 0 0 312.478 5.272 20 0 DKADRN O=[S@@](Cc1ccc(C2CCC2)cc1)Cc1cccc(Cl)c1 ZINC000447112761 338545801 /nfs/dbraw/zinc/54/58/01/338545801.db2.gz WSJUUQRHZXTFLP-NRFANRHFSA-N 0 0 318.869 5.056 20 0 DKADRN O=[S@](Cc1ccc(Cl)cc1)Cc1ccc(C2CCC2)cc1 ZINC000447116912 338545925 /nfs/dbraw/zinc/54/59/25/338545925.db2.gz QDEWHOHNPCEKEU-NRFANRHFSA-N 0 0 318.869 5.056 20 0 DKADRN O=[S@@](Cc1ccc(Cl)cc1)Cc1ccc(C2CCC2)cc1 ZINC000447116913 338545882 /nfs/dbraw/zinc/54/58/82/338545882.db2.gz QDEWHOHNPCEKEU-OAQYLSRUSA-N 0 0 318.869 5.056 20 0 DKADRN CC[C@H](c1ccccc1)[S@](=O)Cc1ccc(C2CCC2)cc1 ZINC000447117213 338545861 /nfs/dbraw/zinc/54/58/61/338545861.db2.gz RVNUANWYCQZDDF-IFMALSPDSA-N 0 0 312.478 5.354 20 0 DKADRN CC[C@H](c1ccccc1)[S@@](=O)Cc1ccc(C2CCC2)cc1 ZINC000447117214 338545862 /nfs/dbraw/zinc/54/58/62/338545862.db2.gz RVNUANWYCQZDDF-IRLDBZIGSA-N 0 0 312.478 5.354 20 0 DKADRN CC[C@@H](c1ccccc1)[S@](=O)Cc1ccc(C2CCC2)cc1 ZINC000447117215 338545864 /nfs/dbraw/zinc/54/58/64/338545864.db2.gz RVNUANWYCQZDDF-RBBKRZOGSA-N 0 0 312.478 5.354 20 0 DKADRN C[C@@H](c1cccc(Cl)c1)[S@](=O)C(C)(C)c1ccccc1 ZINC000447146447 338546408 /nfs/dbraw/zinc/54/64/08/338546408.db2.gz LXMULVNYYOGXJU-RBZFPXEDSA-N 0 0 306.858 5.085 20 0 DKADRN C[C@@H](c1cccc(Cl)c1)[S@@](=O)C(C)(C)c1ccccc1 ZINC000447146448 338546451 /nfs/dbraw/zinc/54/64/51/338546451.db2.gz LXMULVNYYOGXJU-RNODOKPDSA-N 0 0 306.858 5.085 20 0 DKADRN C[C@H](c1cccc(Cl)c1)[S@@](=O)C(C)(C)c1ccccc1 ZINC000447146450 338546478 /nfs/dbraw/zinc/54/64/78/338546478.db2.gz LXMULVNYYOGXJU-ZUOKHONESA-N 0 0 306.858 5.085 20 0 DKADRN CC(C)(c1ccccc1)[S@](=O)[C@@H]1CCc2c1cccc2Cl ZINC000447146736 338546391 /nfs/dbraw/zinc/54/63/91/338546391.db2.gz MVWDBQUQHBSUAM-DYESRHJHSA-N 0 0 318.869 5.011 20 0 DKADRN CC(C)(c1ccccc1)[S@](=O)[C@H]1CCc2c1cccc2Cl ZINC000447146737 338546481 /nfs/dbraw/zinc/54/64/81/338546481.db2.gz MVWDBQUQHBSUAM-LAUBAEHRSA-N 0 0 318.869 5.011 20 0 DKADRN CC(C)(c1ccccc1)[S@@](=O)[C@@H]1CCc2c1cccc2Cl ZINC000447146738 517403904 /nfs/dbraw/zinc/40/39/04/517403904.db2.gz MVWDBQUQHBSUAM-UTKZUKDTSA-N 0 0 318.869 5.011 20 0 DKADRN CC(C)(c1ccccc1)[S@@](=O)Cc1cccc2ccccc21 ZINC000447156939 338546579 /nfs/dbraw/zinc/54/65/79/338546579.db2.gz LRIAWALFVKNOOG-QFIPXVFZSA-N 0 0 308.446 5.024 20 0 DKADRN Cc1ccc2ccccc2c1C[S@](=O)C(C)(C)c1ccccc1 ZINC000447158305 338546650 /nfs/dbraw/zinc/54/66/50/338546650.db2.gz QAZKNHMNQWQVNK-QHCPKHFHSA-N 0 0 322.473 5.332 20 0 DKADRN CC(C)(c1ccccc1)[S@](=O)Cc1ccc(C2CCC2)cc1 ZINC000447159898 338546627 /nfs/dbraw/zinc/54/66/27/338546627.db2.gz WMAFCGBIUQFNON-JOCHJYFZSA-N 0 0 312.478 5.138 20 0 DKADRN Clc1ccc(-c2nc(-c3nccs3)cs2)c(Cl)c1 ZINC000447162342 338546676 /nfs/dbraw/zinc/54/66/76/338546676.db2.gz HOUDDCGUSMIWMO-UHFFFAOYSA-N 0 0 313.234 5.240 20 0 DKADRN CCCC(C)(C)CC(=O)N(c1nc(C)cs1)c1ccccc1 ZINC000447200693 338547334 /nfs/dbraw/zinc/54/73/34/338547334.db2.gz QHUMRFKTGJDTFF-UHFFFAOYSA-N 0 0 316.470 5.333 20 0 DKADRN CC(C)c1nc2ccccc2c(S[C@@H](C)c2cccnc2)n1 ZINC000447336970 338550010 /nfs/dbraw/zinc/55/00/10/338550010.db2.gz ZYGNDDSUXJDLIK-ZDUSSCGKSA-N 0 0 309.438 5.002 20 0 DKADRN Cc1nc(CNc2cccc(-c3cccs3)c2)sc1C ZINC000447338978 338550064 /nfs/dbraw/zinc/55/00/64/338550064.db2.gz DFJNTOJBQGHJAC-UHFFFAOYSA-N 0 0 300.452 5.101 20 0 DKADRN Cc1csc(CNc2ccccc2O[C@@H](C)c2ccccc2)n1 ZINC000447339558 338550057 /nfs/dbraw/zinc/55/00/57/338550057.db2.gz GUYVVYQYQNZHIN-HNNXBMFYSA-N 0 0 324.449 5.204 20 0 DKADRN Cc1csc(CNc2ccc(F)cc2-c2ccc(F)cc2)n1 ZINC000447339826 338550009 /nfs/dbraw/zinc/55/00/09/338550009.db2.gz HZIXLMVUCPUNAB-UHFFFAOYSA-N 0 0 316.376 5.009 20 0 DKADRN Cc1nc(CNc2cccc(CSC(C)C)c2C)sc1C ZINC000447340494 338550061 /nfs/dbraw/zinc/55/00/61/338550061.db2.gz KOJWSKYQLFWYET-UHFFFAOYSA-N 0 0 320.527 5.322 20 0 DKADRN CC[C@H](C)Sc1ccc(NC(=O)C2(SC)CCC2)c(C)c1 ZINC000447348758 338550339 /nfs/dbraw/zinc/55/03/39/338550339.db2.gz STKLFRZKDNKEAR-ZDUSSCGKSA-N 0 0 323.527 5.110 20 0 DKADRN Fc1ccc(-c2csc(/C=C/C=C\c3ccncc3)n2)cc1 ZINC000447352995 338550430 /nfs/dbraw/zinc/55/04/30/338550430.db2.gz CVCZRNLJUBCWIW-HSFFGMMNSA-N 0 0 308.381 5.071 20 0 DKADRN Fc1ccc(-c2csc(/C=C/C=C/c3ccncc3)n2)cc1 ZINC000447352998 338550438 /nfs/dbraw/zinc/55/04/38/338550438.db2.gz CVCZRNLJUBCWIW-ZPUQHVIOSA-N 0 0 308.381 5.071 20 0 DKADRN COc1ccc2nc(/C=C/C=C\c3ccncc3)ccc2c1Cl ZINC000447358730 338550620 /nfs/dbraw/zinc/55/06/20/338550620.db2.gz JBRDHQSISLRECF-VOERYJCWSA-N 0 0 322.795 5.018 20 0 DKADRN Cc1csc(CNc2ccccc2Sc2ccccc2)n1 ZINC000447365743 338550698 /nfs/dbraw/zinc/55/06/98/338550698.db2.gz PTUXZHQMXWPUPX-UHFFFAOYSA-N 0 0 312.463 5.215 20 0 DKADRN COc1ccc2nc(/C=C/C=C\c3ccncc3)cc(Cl)c2c1 ZINC000447366059 338550718 /nfs/dbraw/zinc/55/07/18/338550718.db2.gz RKWJTLAQSLKIOC-VOERYJCWSA-N 0 0 322.795 5.018 20 0 DKADRN COc1ccc2nc(/C=C/C=C/c3ccncc3)cc(Cl)c2c1 ZINC000447366060 338550662 /nfs/dbraw/zinc/55/06/62/338550662.db2.gz RKWJTLAQSLKIOC-ZUVMSYQZSA-N 0 0 322.795 5.018 20 0 DKADRN Cc1ccc(-c2csc(/C=C/C=C\c3ccncc3)n2)cc1 ZINC000447367903 338550730 /nfs/dbraw/zinc/55/07/30/338550730.db2.gz WNAMNBIKEVYPJM-VOERYJCWSA-N 0 0 304.418 5.240 20 0 DKADRN Cc1ccc(-c2csc(/C=C/C=C/c3ccncc3)n2)cc1 ZINC000447367910 338550690 /nfs/dbraw/zinc/55/06/90/338550690.db2.gz WNAMNBIKEVYPJM-ZUVMSYQZSA-N 0 0 304.418 5.240 20 0 DKADRN c1cc(C2CCC2)ccc1CNc1ccc(-c2cncnc2)cc1 ZINC000447405008 338551790 /nfs/dbraw/zinc/55/17/90/338551790.db2.gz MZFCPOVZZNNVHW-UHFFFAOYSA-N 0 0 315.420 5.023 20 0 DKADRN c1ccc(-c2nnc(CNc3ccc(C4CCC4)cc3)s2)cc1 ZINC000447405981 338551749 /nfs/dbraw/zinc/55/17/49/338551749.db2.gz AZZMMPCEVVHPLS-UHFFFAOYSA-N 0 0 321.449 5.085 20 0 DKADRN CC(C)c1ccccc1NC(=O)CNc1ccc(C2CCC2)cc1 ZINC000447409819 338551878 /nfs/dbraw/zinc/55/18/78/338551878.db2.gz XXEXYWHSFXUVRR-UHFFFAOYSA-N 0 0 322.452 5.128 20 0 DKADRN Cc1ccc(C(=O)Nc2c(C)cccc2Cl)c(F)c1Cl ZINC000447518407 338553512 /nfs/dbraw/zinc/55/35/12/338553512.db2.gz CJYAUAFPNVLYEA-UHFFFAOYSA-N 0 0 312.171 5.002 20 0 DKADRN Cc1ccc([C@H](C)N[C@H](CC(F)(F)F)c2ccccc2C)o1 ZINC000447564334 338557175 /nfs/dbraw/zinc/55/71/75/338557175.db2.gz GPDLMFIXZWKJBU-DZGCQCFKSA-N 0 0 311.347 5.241 20 0 DKADRN Cc1ccc([C@@H](C)N[C@@H](CC(F)(F)F)c2ccccc2C)o1 ZINC000447564336 338557104 /nfs/dbraw/zinc/55/71/04/338557104.db2.gz GPDLMFIXZWKJBU-HIFRSBDPSA-N 0 0 311.347 5.241 20 0 DKADRN Cc1c(N[C@H](c2ccc(F)cc2)C2CC2)cnn1C1CCCC1 ZINC000447567007 338557406 /nfs/dbraw/zinc/55/74/06/338557406.db2.gz YJFXYBQVTGACFY-IBGZPJMESA-N 0 0 313.420 5.009 20 0 DKADRN Cc1c(N[C@@H](c2ccc(F)cc2)C2CC2)cnn1C1CCCC1 ZINC000447567008 338557470 /nfs/dbraw/zinc/55/74/70/338557470.db2.gz YJFXYBQVTGACFY-LJQANCHMSA-N 0 0 313.420 5.009 20 0 DKADRN COc1cc(SC)ccc1N[C@H](C)c1csc(Cl)c1 ZINC000447567404 338557460 /nfs/dbraw/zinc/55/74/60/338557460.db2.gz BGHUPQGRBWGSLQ-SECBINFHSA-N 0 0 313.875 5.305 20 0 DKADRN COc1cc(SC)ccc1N[C@@H]1CCSc2ccccc21 ZINC000447568578 338557545 /nfs/dbraw/zinc/55/75/45/338557545.db2.gz KPSXWAIAGKXITN-CQSZACIVSA-N 0 0 317.479 5.066 20 0 DKADRN Cc1c(N[C@@H](C)c2csc(Cl)c2)cnn1C1CCCC1 ZINC000447569501 338557665 /nfs/dbraw/zinc/55/76/65/338557665.db2.gz POOFGZIGLWOVOV-JTQLQIEISA-N 0 0 309.866 5.195 20 0 DKADRN COc1cc(SC)ccc1N[C@H](C)c1ccc(Cl)s1 ZINC000447571924 338557861 /nfs/dbraw/zinc/55/78/61/338557861.db2.gz LSJGKOIYKRYSRM-SECBINFHSA-N 0 0 313.875 5.305 20 0 DKADRN COc1cc(SC)ccc1N[C@@H](C)c1ccc(Cl)s1 ZINC000447571925 338557851 /nfs/dbraw/zinc/55/78/51/338557851.db2.gz LSJGKOIYKRYSRM-VIFPVBQESA-N 0 0 313.875 5.305 20 0 DKADRN Fc1cccc([C@@H](N[C@@H]2CCCc3occc32)c2ccccc2)c1 ZINC000447576415 338558309 /nfs/dbraw/zinc/55/83/09/338558309.db2.gz YIZOQTPWIWTVTH-CTNGQTDRSA-N 0 0 321.395 5.175 20 0 DKADRN Fc1cccc([C@@H](N[C@H]2CCCc3occc32)c2ccccc2)c1 ZINC000447576417 338558291 /nfs/dbraw/zinc/55/82/91/338558291.db2.gz YIZOQTPWIWTVTH-FPOVZHCZSA-N 0 0 321.395 5.175 20 0 DKADRN Fc1cccc([C@H](N[C@H]2CCCc3occc32)c2ccccc2)c1 ZINC000447576418 338558242 /nfs/dbraw/zinc/55/82/42/338558242.db2.gz YIZOQTPWIWTVTH-PZJWPPBQSA-N 0 0 321.395 5.175 20 0 DKADRN Fc1cccc([C@H](N[C@@H]2CCCc3occc32)c2ccccc2)c1 ZINC000447576420 338558297 /nfs/dbraw/zinc/55/82/97/338558297.db2.gz YIZOQTPWIWTVTH-TZIWHRDSSA-N 0 0 321.395 5.175 20 0 DKADRN C[C@@H](NC1(c2c(Cl)cccc2Cl)CCC1)c1cccnc1 ZINC000447576618 338558251 /nfs/dbraw/zinc/55/82/51/338558251.db2.gz BSXCAVGJQQHETJ-GFCCVEGCSA-N 0 0 321.251 5.118 20 0 DKADRN C[C@H](NC1(c2c(Cl)cccc2Cl)CCC1)c1cccnc1 ZINC000447576619 338558311 /nfs/dbraw/zinc/55/83/11/338558311.db2.gz BSXCAVGJQQHETJ-LBPRGKRZSA-N 0 0 321.251 5.118 20 0 DKADRN C[C@@H](NC1(c2c(Cl)cccc2Cl)CCC1)c1ccncc1 ZINC000447579198 338558660 /nfs/dbraw/zinc/55/86/60/338558660.db2.gz MLNATNMFURUNJH-GFCCVEGCSA-N 0 0 321.251 5.118 20 0 DKADRN C[C@@H](NC1(c2c(Cl)cccc2Cl)CCC1)c1ccco1 ZINC000447582498 338559112 /nfs/dbraw/zinc/55/91/12/338559112.db2.gz WQZLGJFTSAJSFX-LLVKDONJSA-N 0 0 310.224 5.316 20 0 DKADRN c1cc2c(o1)CCC[C@@H]2Nc1ccc(COC2CCCC2)cc1 ZINC000447587944 338559679 /nfs/dbraw/zinc/55/96/79/338559679.db2.gz STSLSJHDMHNOOO-IBGZPJMESA-N 0 0 311.425 5.228 20 0 DKADRN c1cc2c(o1)CCC[C@H]2Nc1ccc(COC2CCCC2)cc1 ZINC000447587945 338559929 /nfs/dbraw/zinc/55/99/29/338559929.db2.gz STSLSJHDMHNOOO-LJQANCHMSA-N 0 0 311.425 5.228 20 0 DKADRN CC(C)c1csc(CN[C@@H]2C[C@@H](C(C)C)c3ccccc32)n1 ZINC000447589993 338560133 /nfs/dbraw/zinc/56/01/33/338560133.db2.gz ZNRGTIBQYDVZKK-DLBZAZTESA-N 0 0 314.498 5.241 20 0 DKADRN CC(C)c1csc(CN[C@@H]2C[C@H](C(C)C)c3ccccc32)n1 ZINC000447589994 338560115 /nfs/dbraw/zinc/56/01/15/338560115.db2.gz ZNRGTIBQYDVZKK-IAGOWNOFSA-N 0 0 314.498 5.241 20 0 DKADRN CC[C@H](C)n1ncc(N[C@@H](C)c2cc(C)oc2C)c1C1CC1 ZINC000447597993 338561034 /nfs/dbraw/zinc/56/10/34/338561034.db2.gz UJFJJTGMFBOMLR-AAEUAGOBSA-N 0 0 301.434 5.114 20 0 DKADRN CC[C@@H](C)n1ncc(N[C@H](C)c2cc(C)oc2C)c1C1CC1 ZINC000447597998 338561047 /nfs/dbraw/zinc/56/10/47/338561047.db2.gz UJFJJTGMFBOMLR-DGCLKSJQSA-N 0 0 301.434 5.114 20 0 DKADRN CC[C@H](C)n1ncc(N[C@H](C)c2cc(C)oc2C)c1C1CC1 ZINC000447598000 338561031 /nfs/dbraw/zinc/56/10/31/338561031.db2.gz UJFJJTGMFBOMLR-WCQYABFASA-N 0 0 301.434 5.114 20 0 DKADRN CC[C@@H](C)n1ncc(N[C@@H](C)c2cc(C)oc2C)c1C1CC1 ZINC000447598003 338561063 /nfs/dbraw/zinc/56/10/63/338561063.db2.gz UJFJJTGMFBOMLR-YPMHNXCESA-N 0 0 301.434 5.114 20 0 DKADRN Cc1csc(-c2ccc(N[C@H]3CCCc4occc43)cc2)n1 ZINC000447601502 338561536 /nfs/dbraw/zinc/56/15/36/338561536.db2.gz PLOHZBRIKKNKAN-INIZCTEOSA-N 0 0 310.422 5.201 20 0 DKADRN Cc1csc(-c2ccc(N[C@@H]3CCCc4occc43)cc2)n1 ZINC000447601503 338561498 /nfs/dbraw/zinc/56/14/98/338561498.db2.gz PLOHZBRIKKNKAN-MRXNPFEDSA-N 0 0 310.422 5.201 20 0 DKADRN FC(F)(F)CCc1ccc(N[C@@H]2CCCc3occc32)cc1 ZINC000447602325 338561563 /nfs/dbraw/zinc/56/15/63/338561563.db2.gz UFXQDWRIOZLOIB-OAHLLOKOSA-N 0 0 309.331 5.264 20 0 DKADRN Cc1c(C(=O)Nc2ccc3cc[nH]c3c2)sc2cccc(F)c12 ZINC000447642668 338562492 /nfs/dbraw/zinc/56/24/92/338562492.db2.gz BIRIPTRYBLJIJL-UHFFFAOYSA-N 0 0 324.380 5.082 20 0 DKADRN COc1cc(CNc2cccc(CCC(F)(F)F)c2)ccc1C ZINC000447732876 338564936 /nfs/dbraw/zinc/56/49/36/338564936.db2.gz YNZGGJNUWVATLI-UHFFFAOYSA-N 0 0 323.358 5.111 20 0 DKADRN COc1cc(CNc2ccc(CCC(F)(F)F)cc2)ccc1C ZINC000447759445 338565980 /nfs/dbraw/zinc/56/59/80/338565980.db2.gz SFSJOJDOGDNUGS-UHFFFAOYSA-N 0 0 323.358 5.111 20 0 DKADRN CCO[C@@H](C)c1nc(COc2ccccc2C(C)(C)C)cs1 ZINC000447788416 338566343 /nfs/dbraw/zinc/56/63/43/338566343.db2.gz VARWSHFTFIGDJJ-ZDUSSCGKSA-N 0 0 319.470 5.117 20 0 DKADRN CCC(C)(C)c1ccc(N[C@H](C)c2nc(C(C)C)no2)cc1 ZINC000447870836 338569863 /nfs/dbraw/zinc/56/98/63/338569863.db2.gz FTYPMAWADGRMIZ-CYBMUJFWSA-N 0 0 301.434 5.054 20 0 DKADRN CCSc1cccc(NCc2ncc(C(C)(C)C)s2)c1 ZINC000447893864 338570527 /nfs/dbraw/zinc/57/05/27/338570527.db2.gz ALYVJNDQCKLNDG-UHFFFAOYSA-N 0 0 306.500 5.165 20 0 DKADRN CSc1cccc(NCc2ncc(C(C)(C)C)s2)c1C ZINC000447896813 338570770 /nfs/dbraw/zinc/57/07/70/338570770.db2.gz JVLCMRLHVXVAQH-UHFFFAOYSA-N 0 0 306.500 5.083 20 0 DKADRN CCc1cccnc1[C@@H](C)[NH2+][C@@H]1C[C@H](C(C)C)c2ccccc21 ZINC000448020824 332178964 /nfs/dbraw/zinc/17/89/64/332178964.db2.gz FDWABZNAOYWCOT-CDHQVMDDSA-N 0 0 308.469 5.179 20 0 DKADRN CCc1cccnc1[C@H](C)[NH2+][C@@H]1C[C@H](C(C)C)c2ccccc21 ZINC000448020825 332178903 /nfs/dbraw/zinc/17/89/03/332178903.db2.gz FDWABZNAOYWCOT-CWFSZBLJSA-N 0 0 308.469 5.179 20 0 DKADRN CO[C@H]1CCOc2c(N[C@@H](C)c3csc(Cl)c3)cccc21 ZINC000448021577 332185868 /nfs/dbraw/zinc/18/58/68/332185868.db2.gz JLRHTNOMRSHEBT-HZMBPMFUSA-N 0 0 323.845 5.045 20 0 DKADRN CO[C@@H]1CCOc2c(N[C@@H](C)c3csc(Cl)c3)cccc21 ZINC000448021578 332185735 /nfs/dbraw/zinc/18/57/35/332185735.db2.gz JLRHTNOMRSHEBT-IINYFYTJSA-N 0 0 323.845 5.045 20 0 DKADRN CO[C@@H]1CCOc2c(N[C@H](C)c3csc(Cl)c3)cccc21 ZINC000448021579 332185746 /nfs/dbraw/zinc/18/57/46/332185746.db2.gz JLRHTNOMRSHEBT-QMTHXVAHSA-N 0 0 323.845 5.045 20 0 DKADRN CO[C@H]1CCOc2c(N[C@H](C)c3csc(Cl)c3)cccc21 ZINC000448021580 332185883 /nfs/dbraw/zinc/18/58/83/332185883.db2.gz JLRHTNOMRSHEBT-YGRLFVJLSA-N 0 0 323.845 5.045 20 0 DKADRN CCC[C@H](Nc1cccc2c1OCC[C@@H]2OC)c1ccccc1 ZINC000448022767 332188770 /nfs/dbraw/zinc/18/87/70/332188770.db2.gz PRIBBCGGNMSHCV-HKUYNNGSSA-N 0 0 311.425 5.110 20 0 DKADRN CCC[C@@H](Nc1cccc2c1OCC[C@H]2OC)c1ccccc1 ZINC000448022768 332188844 /nfs/dbraw/zinc/18/88/44/332188844.db2.gz PRIBBCGGNMSHCV-IEBWSBKVSA-N 0 0 311.425 5.110 20 0 DKADRN CCC[C@@H](Nc1cccc2c1OCC[C@@H]2OC)c1ccccc1 ZINC000448022769 332188730 /nfs/dbraw/zinc/18/87/30/332188730.db2.gz PRIBBCGGNMSHCV-MJGOQNOKSA-N 0 0 311.425 5.110 20 0 DKADRN CCC[C@H](Nc1cccc2c1OCC[C@H]2OC)c1ccccc1 ZINC000448022770 332188812 /nfs/dbraw/zinc/18/88/12/332188812.db2.gz PRIBBCGGNMSHCV-PKOBYXMFSA-N 0 0 311.425 5.110 20 0 DKADRN CO[C@@H]1CCOc2c(N[C@@H]3C[C@H](C)c4c3cccc4C)cccc21 ZINC000448023658 332189546 /nfs/dbraw/zinc/18/95/46/332189546.db2.gz UPJCRZQVQJYNEU-GDIGMMSISA-N 0 0 323.436 5.125 20 0 DKADRN CO[C@@H]1CCOc2c(N[C@H]3C[C@@H](C)c4c3cccc4C)cccc21 ZINC000448023659 332189399 /nfs/dbraw/zinc/18/93/99/332189399.db2.gz UPJCRZQVQJYNEU-MDASCCDHSA-N 0 0 323.436 5.125 20 0 DKADRN CO[C@@H]1CCOc2c(N[C@@H]3C[C@@H](C)c4c3cccc4C)cccc21 ZINC000448023660 332189542 /nfs/dbraw/zinc/18/95/42/332189542.db2.gz UPJCRZQVQJYNEU-NIKGAXFTSA-N 0 0 323.436 5.125 20 0 DKADRN CO[C@@H]1CCOc2c(N[C@H]3C[C@H](C)c4c3cccc4C)cccc21 ZINC000448023661 332189490 /nfs/dbraw/zinc/18/94/90/332189490.db2.gz UPJCRZQVQJYNEU-ZOCIIQOWSA-N 0 0 323.436 5.125 20 0 DKADRN CO[C@H]1CCOc2c(N[C@@H](C)c3ccc(Cl)s3)cccc21 ZINC000448024983 332191725 /nfs/dbraw/zinc/19/17/25/332191725.db2.gz BIQFIMOXAGJEPH-GWCFXTLKSA-N 0 0 323.845 5.045 20 0 DKADRN CO[C@@H]1CCOc2c(N[C@@H](C)c3ccc(Cl)s3)cccc21 ZINC000448024984 332191895 /nfs/dbraw/zinc/19/18/95/332191895.db2.gz BIQFIMOXAGJEPH-GXFFZTMASA-N 0 0 323.845 5.045 20 0 DKADRN CO[C@H]1CCOc2c(N[C@H](C)c3ccc(Cl)s3)cccc21 ZINC000448024985 332191888 /nfs/dbraw/zinc/19/18/88/332191888.db2.gz BIQFIMOXAGJEPH-MFKMUULPSA-N 0 0 323.845 5.045 20 0 DKADRN CO[C@@H]1CCOc2c(N[C@H](C)c3ccc(Cl)s3)cccc21 ZINC000448024986 332191778 /nfs/dbraw/zinc/19/17/78/332191778.db2.gz BIQFIMOXAGJEPH-ZWNOBZJWSA-N 0 0 323.845 5.045 20 0 DKADRN CC[C@H](Nc1cccc2c1OCC[C@@H]2OC)c1ccc(C)cc1 ZINC000448025439 332192154 /nfs/dbraw/zinc/19/21/54/332192154.db2.gz DFGQYOWDPFJURC-HKUYNNGSSA-N 0 0 311.425 5.028 20 0 DKADRN CC[C@@H](Nc1cccc2c1OCC[C@H]2OC)c1ccc(C)cc1 ZINC000448025440 332192029 /nfs/dbraw/zinc/19/20/29/332192029.db2.gz DFGQYOWDPFJURC-IEBWSBKVSA-N 0 0 311.425 5.028 20 0 DKADRN CC[C@@H](Nc1cccc2c1OCC[C@@H]2OC)c1ccc(C)cc1 ZINC000448025441 332192104 /nfs/dbraw/zinc/19/21/04/332192104.db2.gz DFGQYOWDPFJURC-MJGOQNOKSA-N 0 0 311.425 5.028 20 0 DKADRN CC[C@H](Nc1cccc2c1OCC[C@H]2OC)c1ccc(C)cc1 ZINC000448025442 332192036 /nfs/dbraw/zinc/19/20/36/332192036.db2.gz DFGQYOWDPFJURC-PKOBYXMFSA-N 0 0 311.425 5.028 20 0 DKADRN CO[C@H]1CCOc2c(N[C@H](C)c3cc(C)sc3C)cccc21 ZINC000448025482 332192108 /nfs/dbraw/zinc/19/21/08/332192108.db2.gz DJLPAYPZLKOLFD-PXAZEXFGSA-N 0 0 317.454 5.008 20 0 DKADRN CO[C@H]1CCOc2c(N[C@@H](C)c3cc(C)sc3C)cccc21 ZINC000448025483 332192051 /nfs/dbraw/zinc/19/20/51/332192051.db2.gz DJLPAYPZLKOLFD-SJCJKPOMSA-N 0 0 317.454 5.008 20 0 DKADRN CO[C@@H]1CCOc2c(N[C@H](C)c3cc(C)sc3C)cccc21 ZINC000448025484 332192023 /nfs/dbraw/zinc/19/20/23/332192023.db2.gz DJLPAYPZLKOLFD-SJKOYZFVSA-N 0 0 317.454 5.008 20 0 DKADRN CO[C@@H]1CCOc2c(N[C@@H](C)c3cc(C)sc3C)cccc21 ZINC000448025485 332192152 /nfs/dbraw/zinc/19/21/52/332192152.db2.gz DJLPAYPZLKOLFD-YVEFUNNKSA-N 0 0 317.454 5.008 20 0 DKADRN CCC[C@H](Nc1cccc2c1OCC[C@H]2OC)c1ccsc1 ZINC000448026750 332195341 /nfs/dbraw/zinc/19/53/41/332195341.db2.gz JQQCDXLZINKNAN-DOTOQJQBSA-N 0 0 317.454 5.171 20 0 DKADRN CCC[C@@H](Nc1cccc2c1OCC[C@H]2OC)c1ccsc1 ZINC000448026751 332195265 /nfs/dbraw/zinc/19/52/65/332195265.db2.gz JQQCDXLZINKNAN-NVXWUHKLSA-N 0 0 317.454 5.171 20 0 DKADRN CCC[C@H](Nc1cccc2c1OCC[C@@H]2OC)c1ccsc1 ZINC000448026752 332195458 /nfs/dbraw/zinc/19/54/58/332195458.db2.gz JQQCDXLZINKNAN-RDJZCZTQSA-N 0 0 317.454 5.171 20 0 DKADRN CCC[C@@H](Nc1cccc2c1OCC[C@@H]2OC)c1ccsc1 ZINC000448026753 332195327 /nfs/dbraw/zinc/19/53/27/332195327.db2.gz JQQCDXLZINKNAN-WBVHZDCISA-N 0 0 317.454 5.171 20 0 DKADRN CO[C@H]1CCOc2c(N[C@H](C)c3cc4ccccc4o3)cccc21 ZINC000448027093 332196635 /nfs/dbraw/zinc/19/66/35/332196635.db2.gz LJHGWWWYUWZWNV-ACJLOTCBSA-N 0 0 323.392 5.076 20 0 DKADRN CO[C@@H]1CCOc2c(N[C@H](C)c3cc4ccccc4o3)cccc21 ZINC000448027094 332196626 /nfs/dbraw/zinc/19/66/26/332196626.db2.gz LJHGWWWYUWZWNV-FZKQIMNGSA-N 0 0 323.392 5.076 20 0 DKADRN CO[C@@H]1CCOc2c(N[C@@H](C)c3cc4ccccc4o3)cccc21 ZINC000448027095 332196805 /nfs/dbraw/zinc/19/68/05/332196805.db2.gz LJHGWWWYUWZWNV-SCLBCKFNSA-N 0 0 323.392 5.076 20 0 DKADRN CO[C@H]1CCOc2c(N[C@@H](C)c3cc4ccccc4o3)cccc21 ZINC000448027096 332196660 /nfs/dbraw/zinc/19/66/60/332196660.db2.gz LJHGWWWYUWZWNV-UGSOOPFHSA-N 0 0 323.392 5.076 20 0 DKADRN CCC[C@@H](NCc1ccc(-c2ccco2)cc1F)c1ccccn1 ZINC000448027146 332197331 /nfs/dbraw/zinc/19/73/31/332197331.db2.gz LOPWLMUGRGFQJT-GOSISDBHSA-N 0 0 324.399 5.112 20 0 DKADRN CCC[C@H](NCc1ccc(-c2ccco2)cc1F)c1ccccn1 ZINC000448027147 332197292 /nfs/dbraw/zinc/19/72/92/332197292.db2.gz LOPWLMUGRGFQJT-SFHVURJKSA-N 0 0 324.399 5.112 20 0 DKADRN CO[C@@H]1CCOc2c(N[C@H]3CCCCc4ccccc43)cccc21 ZINC000448029776 332202312 /nfs/dbraw/zinc/20/23/12/332202312.db2.gz QXFBNXZJFFPXAN-AZUAARDMSA-N 0 0 323.436 5.036 20 0 DKADRN CO[C@H]1CCOc2c(N[C@H]3CCCCc4ccccc43)cccc21 ZINC000448029777 332202335 /nfs/dbraw/zinc/20/23/35/332202335.db2.gz QXFBNXZJFFPXAN-ICSRJNTNSA-N 0 0 323.436 5.036 20 0 DKADRN CO[C@H]1CCOc2c(N[C@@H]3CCCCc4ccccc43)cccc21 ZINC000448029778 332202357 /nfs/dbraw/zinc/20/23/57/332202357.db2.gz QXFBNXZJFFPXAN-QUCCMNQESA-N 0 0 323.436 5.036 20 0 DKADRN CO[C@@H]1CCOc2c(N[C@@H]3CCCCc4ccccc43)cccc21 ZINC000448029779 332202369 /nfs/dbraw/zinc/20/23/69/332202369.db2.gz QXFBNXZJFFPXAN-UYAOXDASSA-N 0 0 323.436 5.036 20 0 DKADRN CCC[C@H](Nc1ccc(C(F)(F)F)c(OC)c1)c1cccnc1 ZINC000448033686 332296993 /nfs/dbraw/zinc/29/69/93/332296993.db2.gz YZLVNARLIUTMRP-HNNXBMFYSA-N 0 0 324.346 5.062 20 0 DKADRN CCC[C@@H](Nc1ccc(C(F)(F)F)c(OC)c1)c1cccnc1 ZINC000448033687 332297004 /nfs/dbraw/zinc/29/70/04/332297004.db2.gz YZLVNARLIUTMRP-OAHLLOKOSA-N 0 0 324.346 5.062 20 0 DKADRN CCSCc1ccccc1C(=O)Nc1c(C)cccc1CC ZINC000448096934 332511394 /nfs/dbraw/zinc/51/13/94/332511394.db2.gz GYTOPIOZUFOPAN-UHFFFAOYSA-N 0 0 313.466 5.063 20 0 DKADRN CCSCc1ccccc1C(=O)Nc1ccccc1C(C)C ZINC000448098029 332511952 /nfs/dbraw/zinc/51/19/52/332511952.db2.gz LLXQRTVAUKAYPR-UHFFFAOYSA-N 0 0 313.466 5.315 20 0 DKADRN CCSCc1ccccc1C(=O)Nc1c(C)cc(C)cc1C ZINC000448099615 332513033 /nfs/dbraw/zinc/51/30/33/332513033.db2.gz TZYRJQNDVVLQBF-UHFFFAOYSA-N 0 0 313.466 5.117 20 0 DKADRN CCOc1ccc(-c2nc(CSc3cccs3)co2)cc1 ZINC000448104819 332516478 /nfs/dbraw/zinc/51/64/78/332516478.db2.gz KRTGCRKXVLPTBX-UHFFFAOYSA-N 0 0 317.435 5.094 20 0 DKADRN CCC(C)(C)c1ccc(NC(=O)N(C)[C@@H](C)c2ccco2)cc1 ZINC000448118314 332527305 /nfs/dbraw/zinc/52/73/05/332527305.db2.gz FHZHJTKFAVIODS-AWEZNQCLSA-N 0 0 314.429 5.192 20 0 DKADRN CCC(C)(C)c1ccc(NC(=O)N(C)[C@H](C)c2ccco2)cc1 ZINC000448118316 332527293 /nfs/dbraw/zinc/52/72/93/332527293.db2.gz FHZHJTKFAVIODS-CQSZACIVSA-N 0 0 314.429 5.192 20 0 DKADRN CCSCc1ccccc1C(=O)Nc1c(C)cccc1Cl ZINC000448312451 332777730 /nfs/dbraw/zinc/77/77/30/332777730.db2.gz MATDCXLBGXOFSW-UHFFFAOYSA-N 0 0 319.857 5.154 20 0 DKADRN Cc1cccc(F)c1NC(=O)c1cc(C(C)C)nc2ccccc21 ZINC000448346194 332788694 /nfs/dbraw/zinc/78/86/94/332788694.db2.gz OCHFDAUYNTYJLH-UHFFFAOYSA-N 0 0 322.383 5.058 20 0 DKADRN O=C(Nc1ccc(Cl)cc1-c1cccc(Cl)c1)C1=CCC1 ZINC000448401443 332809310 /nfs/dbraw/zinc/80/93/10/332809310.db2.gz HWDZHDFFBMLKPH-UHFFFAOYSA-N 0 0 318.203 5.319 20 0 DKADRN Cc1c(F)ccc(Cl)c1NC(=O)c1ccc(C(C)C)cc1 ZINC000448509375 338134083 /nfs/dbraw/zinc/13/40/83/338134083.db2.gz CVPZBDAQWZQZIY-UHFFFAOYSA-N 0 0 305.780 5.163 20 0 DKADRN Cc1ccccc1[C@H](C)CC(=O)Nc1c(C)c(F)ccc1Cl ZINC000448510756 338137241 /nfs/dbraw/zinc/13/72/41/338137241.db2.gz QEQSPKPRISLWMH-GFCCVEGCSA-N 0 0 319.807 5.228 20 0 DKADRN Cc1ccccc1[C@@H](C)CC(=O)Nc1c(C)c(F)ccc1Cl ZINC000448510757 338137266 /nfs/dbraw/zinc/13/72/66/338137266.db2.gz QEQSPKPRISLWMH-LBPRGKRZSA-N 0 0 319.807 5.228 20 0 DKADRN Cc1c(F)ccc(Cl)c1NC(=O)c1ccc2ccccc2c1 ZINC000448511096 338137561 /nfs/dbraw/zinc/13/75/61/338137561.db2.gz RMRFVYXBITWCHC-UHFFFAOYSA-N 0 0 313.759 5.193 20 0 DKADRN Cc1ccc(Cl)cc1C(=O)Nc1c(C)c(F)ccc1Cl ZINC000448511340 338137648 /nfs/dbraw/zinc/13/76/48/338137648.db2.gz SWPFVMCBTKNNLY-UHFFFAOYSA-N 0 0 312.171 5.002 20 0 DKADRN Cc1c(F)ccc(Cl)c1NC(=O)C[C@H](C)c1cccc(F)c1 ZINC000448512279 338137865 /nfs/dbraw/zinc/13/78/65/338137865.db2.gz YVRUAXLMRNQHIR-JTQLQIEISA-N 0 0 323.770 5.059 20 0 DKADRN Cc1c(F)ccc(Cl)c1NC(=O)C[C@@H](C)c1cccc(F)c1 ZINC000448512280 338137859 /nfs/dbraw/zinc/13/78/59/338137859.db2.gz YVRUAXLMRNQHIR-SNVBAGLBSA-N 0 0 323.770 5.059 20 0 DKADRN Cc1c(F)ccc(Cl)c1NC(=O)c1ccc2sccc2c1 ZINC000448512908 338138245 /nfs/dbraw/zinc/13/82/45/338138245.db2.gz CLSLPRJZZCSERU-UHFFFAOYSA-N 0 0 319.788 5.255 20 0 DKADRN CCSc1ccc(C(=O)Nc2c(C)c(F)ccc2Cl)cc1 ZINC000448513107 338138267 /nfs/dbraw/zinc/13/82/67/338138267.db2.gz DLPRVNYNBQYZDK-UHFFFAOYSA-N 0 0 323.820 5.152 20 0 DKADRN Cc1c(Cl)cccc1C(=O)Nc1c(C)c(F)ccc1Cl ZINC000448513495 338139181 /nfs/dbraw/zinc/13/91/81/338139181.db2.gz GSILTSCYBKLKGG-UHFFFAOYSA-N 0 0 312.171 5.002 20 0 DKADRN Cc1cc(C(=O)Nc2c(C)c(F)ccc2Cl)ccc1Cl ZINC000448513795 338141949 /nfs/dbraw/zinc/14/19/49/338141949.db2.gz SRMRPAIKRFIHNJ-UHFFFAOYSA-N 0 0 312.171 5.002 20 0 DKADRN Cc1oc2ccccc2c1C(=O)Nc1c(C)c(F)ccc1Cl ZINC000448514534 338142878 /nfs/dbraw/zinc/14/28/78/338142878.db2.gz BABMVDBKMRIROU-UHFFFAOYSA-N 0 0 317.747 5.094 20 0 DKADRN Cc1c(F)ccc(Cl)c1NC(=O)c1csc2ccccc21 ZINC000448514782 338143297 /nfs/dbraw/zinc/14/32/97/338143297.db2.gz BJRAWFGJKRJTHV-UHFFFAOYSA-N 0 0 319.788 5.255 20 0 DKADRN Cc1c(F)ccc(Cl)c1NC(=O)C[C@H](C)c1ccc(F)cc1 ZINC000448515648 338143826 /nfs/dbraw/zinc/14/38/26/338143826.db2.gz RNKWDQMWMQVROK-JTQLQIEISA-N 0 0 323.770 5.059 20 0 DKADRN Cc1c(F)ccc(Cl)c1NC(=O)C[C@@H](C)c1ccc(F)cc1 ZINC000448515649 338143896 /nfs/dbraw/zinc/14/38/96/338143896.db2.gz RNKWDQMWMQVROK-SNVBAGLBSA-N 0 0 323.770 5.059 20 0 DKADRN Cc1c(F)ccc(Cl)c1NC(=O)c1ccc(C2CCC2)cc1 ZINC000448516047 338143916 /nfs/dbraw/zinc/14/39/16/338143916.db2.gz HMAWGFVOJMPALB-UHFFFAOYSA-N 0 0 317.791 5.307 20 0 DKADRN Cc1c(F)ccc(Cl)c1NC(=O)CC(C)(C)c1ccccc1 ZINC000448516108 338144012 /nfs/dbraw/zinc/14/40/12/338144012.db2.gz HXLQGBLBJOFGNZ-UHFFFAOYSA-N 0 0 319.807 5.094 20 0 DKADRN Cc1ccc(C(=O)Nc2c(C)c(F)ccc2Cl)cc1Cl ZINC000448516284 338144064 /nfs/dbraw/zinc/14/40/64/338144064.db2.gz IOFPDNGLEQUIET-UHFFFAOYSA-N 0 0 312.171 5.002 20 0 DKADRN CCSc1cccc(C(=O)Nc2c(C)c(F)ccc2Cl)c1 ZINC000448516886 338144323 /nfs/dbraw/zinc/14/43/23/338144323.db2.gz LSBFPNRGAACFHZ-UHFFFAOYSA-N 0 0 323.820 5.152 20 0 DKADRN Cc1cccc(C(=O)Nc2c(C)c(F)ccc2Cl)c1Cl ZINC000448517148 338145137 /nfs/dbraw/zinc/14/51/37/338145137.db2.gz NHQCNWMVPGXJNP-UHFFFAOYSA-N 0 0 312.171 5.002 20 0 DKADRN Cc1c(F)ccc(Cl)c1NC(=O)C[C@H](C)c1ccccc1F ZINC000448517191 338145126 /nfs/dbraw/zinc/14/51/26/338145126.db2.gz NSRKJMJMENUDCP-JTQLQIEISA-N 0 0 323.770 5.059 20 0 DKADRN Cc1c(F)ccc(Cl)c1NC(=O)C[C@@H](C)c1ccccc1F ZINC000448517192 338145107 /nfs/dbraw/zinc/14/51/07/338145107.db2.gz NSRKJMJMENUDCP-SNVBAGLBSA-N 0 0 323.770 5.059 20 0 DKADRN CSc1ccc(C)c(C(=O)Nc2c(C)c(F)ccc2Cl)c1 ZINC000448517246 338145186 /nfs/dbraw/zinc/14/51/86/338145186.db2.gz OHAOXKHYIAAHFB-UHFFFAOYSA-N 0 0 323.820 5.070 20 0 DKADRN Cc1c2ccccc2oc1C(=O)Nc1c(C)c(F)ccc1Cl ZINC000448517259 338145210 /nfs/dbraw/zinc/14/52/10/338145210.db2.gz OLPQQAVMOHFRII-UHFFFAOYSA-N 0 0 317.747 5.094 20 0 DKADRN Cc1c(F)ccc(Cl)c1NC(=O)c1ccc(C(C)C)s1 ZINC000448517339 338145345 /nfs/dbraw/zinc/14/53/45/338145345.db2.gz PRGHMAMQXGSISI-UHFFFAOYSA-N 0 0 311.809 5.225 20 0 DKADRN Cc1csc(C(=O)Nc2c(C)c(F)ccc2Cl)c1Cl ZINC000448517451 338145827 /nfs/dbraw/zinc/14/58/27/338145827.db2.gz QXZSHZKHKIQPJO-UHFFFAOYSA-N 0 0 318.200 5.063 20 0 DKADRN CC[C@H](CC(=O)Nc1c(C)c(F)ccc1Cl)c1ccccc1 ZINC000448517472 338145826 /nfs/dbraw/zinc/14/58/26/338145826.db2.gz RFFQGPQMLRNKAU-CYBMUJFWSA-N 0 0 319.807 5.310 20 0 DKADRN CC[C@@H](CC(=O)Nc1c(C)c(F)ccc1Cl)c1ccccc1 ZINC000448517473 338145845 /nfs/dbraw/zinc/14/58/45/338145845.db2.gz RFFQGPQMLRNKAU-ZDUSSCGKSA-N 0 0 319.807 5.310 20 0 DKADRN Cc1c(F)ccc(Cl)c1NC(=O)CC/C=C\c1ccccc1 ZINC000448517532 338145783 /nfs/dbraw/zinc/14/57/83/338145783.db2.gz RUNGKBAGCOWOHR-UITAMQMPSA-N 0 0 317.791 5.220 20 0 DKADRN Cc1c(F)ccc(Cl)c1NC(=O)CC/C=C/c1ccccc1 ZINC000448517533 338145841 /nfs/dbraw/zinc/14/58/41/338145841.db2.gz RUNGKBAGCOWOHR-WEVVVXLNSA-N 0 0 317.791 5.220 20 0 DKADRN Cc1c(F)ccc(Cl)c1NC(=O)c1cccc2ccccc21 ZINC000448517558 338145758 /nfs/dbraw/zinc/14/57/58/338145758.db2.gz SDFVYLNJZFGADM-UHFFFAOYSA-N 0 0 313.759 5.193 20 0 DKADRN Cc1c(F)ccc(Cl)c1NC(=O)CC[C@@H](C)c1ccccc1 ZINC000448518091 338146933 /nfs/dbraw/zinc/14/69/33/338146933.db2.gz YYKKIKLKGFRMHR-GFCCVEGCSA-N 0 0 319.807 5.310 20 0 DKADRN Cc1c(F)ccc(Cl)c1NC(=O)CC[C@H](C)c1ccccc1 ZINC000448518092 338146869 /nfs/dbraw/zinc/14/68/69/338146869.db2.gz YYKKIKLKGFRMHR-LBPRGKRZSA-N 0 0 319.807 5.310 20 0 DKADRN Cc1ccc2oc(C(=O)Nc3c(C)c(F)ccc3Cl)cc2c1 ZINC000448518259 338148186 /nfs/dbraw/zinc/14/81/86/338148186.db2.gz AVRPSHWFFHLSBJ-UHFFFAOYSA-N 0 0 317.747 5.094 20 0 DKADRN Cc1cc(Cl)ccc1C(=O)Nc1c(C)c(F)ccc1Cl ZINC000448518312 338148239 /nfs/dbraw/zinc/14/82/39/338148239.db2.gz BLWYXASVFANOSC-UHFFFAOYSA-N 0 0 312.171 5.002 20 0 DKADRN Cc1cc(Cl)cc(C(=O)Nc2c(C)c(F)ccc2Cl)c1 ZINC000448518951 338148274 /nfs/dbraw/zinc/14/82/74/338148274.db2.gz HSRXDSHPRMZJKI-UHFFFAOYSA-N 0 0 312.171 5.002 20 0 DKADRN Cc1ccc(/C=C\CC(=O)Nc2c(C)c(F)ccc2Cl)cc1 ZINC000448519413 338148318 /nfs/dbraw/zinc/14/83/18/338148318.db2.gz JFEGXDAIVRCCJM-ARJAWSKDSA-N 0 0 317.791 5.138 20 0 DKADRN Cc1ccc(/C=C/CC(=O)Nc2c(C)c(F)ccc2Cl)cc1 ZINC000448519414 338148317 /nfs/dbraw/zinc/14/83/17/338148317.db2.gz JFEGXDAIVRCCJM-ONEGZZNKSA-N 0 0 317.791 5.138 20 0 DKADRN CCc1ccc([C@@H](C)C(=O)Nc2c(C)c(F)ccc2Cl)cc1 ZINC000448519604 338148356 /nfs/dbraw/zinc/14/83/56/338148356.db2.gz KCCMIZXCMANSAQ-LLVKDONJSA-N 0 0 319.807 5.092 20 0 DKADRN CCc1ccc([C@H](C)C(=O)Nc2c(C)c(F)ccc2Cl)cc1 ZINC000448519605 338148424 /nfs/dbraw/zinc/14/84/24/338148424.db2.gz KCCMIZXCMANSAQ-NSHDSACASA-N 0 0 319.807 5.092 20 0 DKADRN Cc1c(F)ccc(Cl)c1NC(=O)c1cccc2ccsc21 ZINC000448519821 338148451 /nfs/dbraw/zinc/14/84/51/338148451.db2.gz LGDNIRBNNSQKDZ-UHFFFAOYSA-N 0 0 319.788 5.255 20 0 DKADRN Cc1c(F)ccc(Cl)c1NC(=O)c1cc2ccccc2s1 ZINC000448520679 338148671 /nfs/dbraw/zinc/14/86/71/338148671.db2.gz OIJIHXKBSSLJCT-UHFFFAOYSA-N 0 0 319.788 5.255 20 0 DKADRN Cc1ccc(CCCC(=O)Nc2c(C)c(F)ccc2Cl)cc1 ZINC000448520927 338148939 /nfs/dbraw/zinc/14/89/39/338148939.db2.gz PEKGGJQGCLCXAB-UHFFFAOYSA-N 0 0 319.807 5.057 20 0 DKADRN Cc1cccc2cc(C(=O)Nc3c(C)c(F)ccc3Cl)oc21 ZINC000448522178 338149863 /nfs/dbraw/zinc/14/98/63/338149863.db2.gz UKMCBAWNNHEHSO-UHFFFAOYSA-N 0 0 317.747 5.094 20 0 DKADRN Cc1ccc(C(=O)Nc2c(C)c(F)ccc2Cl)c(Cl)c1 ZINC000448523423 338152314 /nfs/dbraw/zinc/15/23/14/338152314.db2.gz ZBIMJQJIEMSGMU-UHFFFAOYSA-N 0 0 312.171 5.002 20 0 DKADRN CC[C@H](CC(F)(F)F)C(=O)Nc1ccccc1-c1ccccc1 ZINC000448605910 338349391 /nfs/dbraw/zinc/34/93/91/338349391.db2.gz JHNWQSYQMNEUJJ-CYBMUJFWSA-N 0 0 321.342 5.271 20 0 DKADRN CC[C@@H](CC(F)(F)F)C(=O)Nc1ccccc1-c1ccccc1 ZINC000448605916 338349414 /nfs/dbraw/zinc/34/94/14/338349414.db2.gz JHNWQSYQMNEUJJ-ZDUSSCGKSA-N 0 0 321.342 5.271 20 0 DKADRN CC(C)(C)C(=O)CCCC(=O)Nc1ccccc1-c1ccccc1 ZINC000448608255 338351143 /nfs/dbraw/zinc/35/11/43/338351143.db2.gz RKJLKAHKROJNAP-UHFFFAOYSA-N 0 0 323.436 5.078 20 0 DKADRN CCc1c2ccccc2oc1C(=O)Nc1c(C)cccc1CC ZINC000448762660 338574353 /nfs/dbraw/zinc/57/43/53/338574353.db2.gz YXTOEKDZXGYRDU-UHFFFAOYSA-N 0 0 307.393 5.118 20 0 DKADRN CC(C)c1cccc(C(C)C)c1NC(=O)CCCC(=O)C1CC1 ZINC000448764832 338574377 /nfs/dbraw/zinc/57/43/77/338574377.db2.gz VEVKWZVEBFCGKY-UHFFFAOYSA-N 0 0 315.457 5.021 20 0 DKADRN Cc1sccc1C(=O)Nc1c(C(C)C)cccc1C(C)C ZINC000448765019 332813747 /nfs/dbraw/zinc/81/37/47/332813747.db2.gz WBFNRBMMMXJVFG-UHFFFAOYSA-N 0 0 301.455 5.556 20 0 DKADRN CC(C)c1cccc(C(C)C)c1NC(=O)[C@@H]1C[C@H]1C(F)(F)F ZINC000448765254 338574364 /nfs/dbraw/zinc/57/43/64/338574364.db2.gz XGFMMHWZOSSVMW-ZIAGYGMSSA-N 0 0 313.363 5.070 20 0 DKADRN CCCC(=O)Nc1cccc(NCc2cccc3ccoc32)c1C ZINC000449040626 338586942 /nfs/dbraw/zinc/58/69/42/338586942.db2.gz ISWXYWJXRKAXAB-UHFFFAOYSA-N 0 0 322.408 5.092 20 0 DKADRN CO[C@@H](C)c1cccc(NC2CCC(OC3CCCC3)CC2)c1 ZINC000449055077 338588727 /nfs/dbraw/zinc/58/87/27/338588727.db2.gz SRNQIJUNLCEVML-FVWXCPNNSA-N 0 0 317.473 5.076 20 0 DKADRN C[C@@H](NCc1cccc2ccoc21)c1nc(C(C)(C)C)cs1 ZINC000449126798 338595538 /nfs/dbraw/zinc/59/55/38/338595538.db2.gz NEJHUVPJEWHWBZ-GFCCVEGCSA-N 0 0 314.454 5.038 20 0 DKADRN C[C@H](NCc1cccc2ccoc21)c1nc(C(C)(C)C)cs1 ZINC000449126802 338595594 /nfs/dbraw/zinc/59/55/94/338595594.db2.gz NEJHUVPJEWHWBZ-LBPRGKRZSA-N 0 0 314.454 5.038 20 0 DKADRN CCC(C)(C)OCc1ccccc1NCc1cc2cccnc2o1 ZINC000449237649 338605322 /nfs/dbraw/zinc/60/53/22/338605322.db2.gz ONSASGITBCMLAH-UHFFFAOYSA-N 0 0 324.424 5.145 20 0 DKADRN CC(C)(C)c1ncc(CNc2ccccc2C(C)(F)F)s1 ZINC000449477294 338628830 /nfs/dbraw/zinc/62/88/30/338628830.db2.gz WHHKNJALVAUTKX-UHFFFAOYSA-N 0 0 310.413 5.164 20 0 DKADRN CC(C)c1cccc(C(C)C)c1NC(=O)CC1CC(F)(F)C1 ZINC000449797945 338653783 /nfs/dbraw/zinc/65/37/83/338653783.db2.gz NORXYNHDXNAJBL-UHFFFAOYSA-N 0 0 309.400 5.307 20 0 DKADRN CC[C@H](CC(F)(F)F)C(=O)Nc1c(C)cccc1C(C)C ZINC000450091784 338666727 /nfs/dbraw/zinc/66/67/27/338666727.db2.gz PGDCXWCWJIYPIR-GFCCVEGCSA-N 0 0 301.352 5.036 20 0 DKADRN CC[C@@H](CC(F)(F)F)C(=O)Nc1c(C)cccc1C(C)C ZINC000450091789 338064307 /nfs/dbraw/zinc/06/43/07/338064307.db2.gz PGDCXWCWJIYPIR-LBPRGKRZSA-N 0 0 301.352 5.036 20 0 DKADRN CC[C@H](CC(F)(F)F)C(=O)Nc1ccccc1SC(C)C ZINC000450168567 338669771 /nfs/dbraw/zinc/66/97/71/338669771.db2.gz MNTGJZILNLHRKI-LLVKDONJSA-N 0 0 319.392 5.104 20 0 DKADRN Cc1ccc(C(=O)Nc2ncccc2C(C)C)c(Cl)c1Cl ZINC000450205175 338670972 /nfs/dbraw/zinc/67/09/72/338670972.db2.gz MRYNHPDPSSGAGD-UHFFFAOYSA-N 0 0 323.223 5.073 20 0 DKADRN CC[C@@H]1CCC[C@H]1C(=O)Nc1cc(C(F)F)ccc1Cl ZINC000450211721 338671350 /nfs/dbraw/zinc/67/13/50/338671350.db2.gz QFHFXKBHOQAKMA-MWLCHTKSSA-N 0 0 301.764 5.042 20 0 DKADRN C[C@H](Sc1ccc(Cl)c(C(F)(F)F)c1)c1csnn1 ZINC000450602996 338494364 /nfs/dbraw/zinc/49/43/64/338494364.db2.gz SBOPXNVMICHXSL-LURJTMIESA-N 0 0 324.780 5.064 20 0 DKADRN C[C@@H](Sc1ccc(Cl)c(C(F)(F)F)c1)c1csnn1 ZINC000450602997 338494363 /nfs/dbraw/zinc/49/43/63/338494363.db2.gz SBOPXNVMICHXSL-ZCFIWIBFSA-N 0 0 324.780 5.064 20 0 DKADRN C[C@@H](SCc1nnc(C2CC2)s1)c1ccccc1Cl ZINC000450820822 338706960 /nfs/dbraw/zinc/70/69/60/338706960.db2.gz PBVRZPQADCFSJI-SECBINFHSA-N 0 0 310.875 5.063 20 0 DKADRN C[C@H](SCc1nnc(C2CC2)s1)c1ccccc1Cl ZINC000450820829 338706943 /nfs/dbraw/zinc/70/69/43/338706943.db2.gz PBVRZPQADCFSJI-VIFPVBQESA-N 0 0 310.875 5.063 20 0 DKADRN C[C@@H](SCc1nnc(C2CC2)s1)c1ccc(Cl)cc1 ZINC000450832781 338707600 /nfs/dbraw/zinc/70/76/00/338707600.db2.gz WTLKTLDJKVGXPZ-SECBINFHSA-N 0 0 310.875 5.063 20 0 DKADRN C[C@H](SCc1nnc(C2CC2)s1)c1ccc(Cl)cc1 ZINC000450832782 338707555 /nfs/dbraw/zinc/70/75/55/338707555.db2.gz WTLKTLDJKVGXPZ-VIFPVBQESA-N 0 0 310.875 5.063 20 0 DKADRN CC[C@@H]1CCC[C@@H]1C(=O)Nc1cccc(C(F)F)c1Cl ZINC000450838975 338707945 /nfs/dbraw/zinc/70/79/45/338707945.db2.gz GBFUNGUEMPLASA-ZJUUUORDSA-N 0 0 301.764 5.042 20 0 DKADRN C[C@H]1CCC[C@@]1(C)C(=O)Nc1cccc(C(F)F)c1Cl ZINC000450844753 338708139 /nfs/dbraw/zinc/70/81/39/338708139.db2.gz QDYKUXVJCMXDSU-BJOHPYRUSA-N 0 0 301.764 5.042 20 0 DKADRN C[C@@H]1CCC[C@]1(C)C(=O)Nc1cccc(C(F)F)c1Cl ZINC000450844754 338708134 /nfs/dbraw/zinc/70/81/34/338708134.db2.gz QDYKUXVJCMXDSU-PSLIRLAXSA-N 0 0 301.764 5.042 20 0 DKADRN C[C@H]1CCC[C@]1(C)C(=O)Nc1cccc(C(F)F)c1Cl ZINC000450844758 338708142 /nfs/dbraw/zinc/70/81/42/338708142.db2.gz QDYKUXVJCMXDSU-VFZGTOFNSA-N 0 0 301.764 5.042 20 0 DKADRN CCCc1nc(C)c(CSc2ncc(C(C)C)n2C(C)C)o1 ZINC000450845977 338708238 /nfs/dbraw/zinc/70/82/38/338708238.db2.gz LMTUMPCWWVSFMX-UHFFFAOYSA-N 0 0 321.490 5.129 20 0 DKADRN Clc1cc(CSc2nnc(C3CC3)s2)c(Cl)s1 ZINC000450856192 338708716 /nfs/dbraw/zinc/70/87/16/338708716.db2.gz HHLVEKMMEVHFRY-UHFFFAOYSA-N 0 0 323.295 5.076 20 0 DKADRN Clc1ccc(SCc2nnc(C3CC3)s2)cc1Cl ZINC000450857622 338708852 /nfs/dbraw/zinc/70/88/52/338708852.db2.gz RACGLWANNRPKPF-UHFFFAOYSA-N 0 0 317.266 5.015 20 0 DKADRN CC(C)c1cccc(C(C)C)c1NC(=O)CSC1CCC1 ZINC000450990199 338715927 /nfs/dbraw/zinc/71/59/27/338715927.db2.gz IHIVCSTZHAMCQW-UHFFFAOYSA-N 0 0 305.487 5.158 20 0 DKADRN Cc1cccc(CS[C@H](C)c2nnc(-c3cccs3)o2)c1 ZINC000451026412 338718323 /nfs/dbraw/zinc/71/83/23/338718323.db2.gz FAIBUIQADPSVKX-GFCCVEGCSA-N 0 0 316.451 5.101 20 0 DKADRN Cc1cccc(CS[C@@H](C)c2nnc(-c3cccs3)o2)c1 ZINC000451026413 338718390 /nfs/dbraw/zinc/71/83/90/338718390.db2.gz FAIBUIQADPSVKX-LBPRGKRZSA-N 0 0 316.451 5.101 20 0 DKADRN FC(F)(F)C1CCC(SCc2nc3ccccc3o2)CC1 ZINC000451034305 338718598 /nfs/dbraw/zinc/71/85/98/338718598.db2.gz CFNSZINFLOIFAL-UHFFFAOYSA-N 0 0 315.360 5.182 20 0 DKADRN CC(C)c1noc([C@@H](C)SC2CCC(C(F)(F)F)CC2)n1 ZINC000451035687 338718602 /nfs/dbraw/zinc/71/86/02/338718602.db2.gz IGCDMMCRUDRJQZ-KPPDAEKUSA-N 0 0 322.396 5.108 20 0 DKADRN FC(F)(F)C1CCC(SCCCC2CCOCC2)CC1 ZINC000451040217 338719048 /nfs/dbraw/zinc/71/90/48/338719048.db2.gz JXKCNXSARLLXJD-UHFFFAOYSA-N 0 0 310.425 5.048 20 0 DKADRN Cc1nnc([C@H](C)Sc2ccc(Cl)cc2Cl)s1 ZINC000451041130 338719034 /nfs/dbraw/zinc/71/90/34/338719034.db2.gz MPQQGFAXYWCXHV-LURJTMIESA-N 0 0 305.255 5.007 20 0 DKADRN Clc1ccc(SCc2nnc(C3CC3)s2)c(Cl)c1 ZINC000451041907 338719051 /nfs/dbraw/zinc/71/90/51/338719051.db2.gz OVRUYYIQZPMRQH-UHFFFAOYSA-N 0 0 317.266 5.015 20 0 DKADRN CC(C)c1nnc(CSC2CCC(C(F)(F)F)CC2)s1 ZINC000451044039 338719207 /nfs/dbraw/zinc/71/92/07/338719207.db2.gz UNYUJWAEGIRAHS-UHFFFAOYSA-N 0 0 324.437 5.016 20 0 DKADRN Cc1nc(C(C)C)oc1CSC1CCC(C(F)(F)F)CC1 ZINC000451045413 338719243 /nfs/dbraw/zinc/71/92/43/338719243.db2.gz XQSFUEXSTPVVJU-UHFFFAOYSA-N 0 0 321.408 5.461 20 0 DKADRN C[C@H](N[C@@H](C)c1cccc(C2CC2)c1)c1ncc(C(C)(C)C)o1 ZINC000451110736 338721568 /nfs/dbraw/zinc/72/15/68/338721568.db2.gz GBMLDURCNYAFFB-KBPBESRZSA-N 0 0 312.457 5.261 20 0 DKADRN C[C@@H](N[C@@H](C)c1cccc(C2CC2)c1)c1ncc(C(C)(C)C)o1 ZINC000451110750 338721560 /nfs/dbraw/zinc/72/15/60/338721560.db2.gz GBMLDURCNYAFFB-UONOGXRCSA-N 0 0 312.457 5.261 20 0 DKADRN C[C@@H](NCc1cc(-c2cccs2)on1)c1cccc(C2CC2)c1 ZINC000451110825 338721458 /nfs/dbraw/zinc/72/14/58/338721458.db2.gz GFMVKHKWTWPVQQ-CYBMUJFWSA-N 0 0 324.449 5.131 20 0 DKADRN C[C@H](NCc1cc(-c2cccs2)on1)c1cccc(C2CC2)c1 ZINC000451110827 338721460 /nfs/dbraw/zinc/72/14/60/338721460.db2.gz GFMVKHKWTWPVQQ-ZDUSSCGKSA-N 0 0 324.449 5.131 20 0 DKADRN C[C@@H](NCc1ncc(-c2cccs2)o1)c1cccc(C2CC2)c1 ZINC000451112807 338721475 /nfs/dbraw/zinc/72/14/75/338721475.db2.gz JNTDVIXMZUXDPS-CYBMUJFWSA-N 0 0 324.449 5.131 20 0 DKADRN C[C@H](NCc1ncc(-c2cccs2)o1)c1cccc(C2CC2)c1 ZINC000451112808 338721547 /nfs/dbraw/zinc/72/15/47/338721547.db2.gz JNTDVIXMZUXDPS-ZDUSSCGKSA-N 0 0 324.449 5.131 20 0 DKADRN C[C@H](NCc1csc(-c2ccoc2)n1)c1cccc(C2CC2)c1 ZINC000451116506 338721821 /nfs/dbraw/zinc/72/18/21/338721821.db2.gz RCOPGAYLOZXRDQ-ZDUSSCGKSA-N 0 0 324.449 5.131 20 0 DKADRN C[C@H](NCc1ncc(Cl)cc1Cl)c1cccc(C2CC2)c1 ZINC000451118359 338721912 /nfs/dbraw/zinc/72/19/12/338721912.db2.gz XQAQWFQTQKRLIV-NSHDSACASA-N 0 0 321.251 5.117 20 0 DKADRN Cc1cc([C@@H](C)N[C@H](C)c2ncc(-c3ccccc3)o2)ccc1F ZINC000451161979 338723760 /nfs/dbraw/zinc/72/37/60/338723760.db2.gz MSSFINQOCZTQHM-HUUCEWRRSA-N 0 0 324.399 5.201 20 0 DKADRN C[C@@H](CC(=O)Nc1ccccc1C(C)(F)F)c1cccc(F)c1 ZINC000452668102 338774962 /nfs/dbraw/zinc/77/49/62/338774962.db2.gz IEJDHJDQGUEPJJ-LBPRGKRZSA-N 0 0 321.342 5.070 20 0 DKADRN Cc1oc(C(C)C)cc1C(=O)Nc1ccccc1C(C)(F)F ZINC000452673975 338775243 /nfs/dbraw/zinc/77/52/43/338775243.db2.gz PXDJBOZCLYZUFX-UHFFFAOYSA-N 0 0 307.340 5.075 20 0 DKADRN Cc1cc(Cl)c(NC(=O)c2sccc2C2CC2)cc1C ZINC000452878893 338782990 /nfs/dbraw/zinc/78/29/90/338782990.db2.gz MTPBMJIGPOEMJN-UHFFFAOYSA-N 0 0 305.830 5.148 20 0 DKADRN FC(F)(F)CCc1noc([C@@H]2CCCC[C@@H]2c2ccccc2)n1 ZINC000453062981 338789244 /nfs/dbraw/zinc/78/92/44/338789244.db2.gz GGUIZJJRTFZYDS-ZIAGYGMSSA-N 0 0 324.346 5.006 20 0 DKADRN Cc1cc([C@H](C)NCc2nc3cc(Cl)ccc3s2)cs1 ZINC000453070171 338790047 /nfs/dbraw/zinc/79/00/47/338790047.db2.gz MTHXUEBMYXNAKX-JTQLQIEISA-N 0 0 322.886 5.170 20 0 DKADRN Cc1cc([C@@H](C)NCc2nc3cc(Cl)ccc3s2)cs1 ZINC000453070172 338790041 /nfs/dbraw/zinc/79/00/41/338790041.db2.gz MTHXUEBMYXNAKX-SNVBAGLBSA-N 0 0 322.886 5.170 20 0 DKADRN COCc1ccccc1NCc1ccc([C@H](C)C(F)(F)F)cc1 ZINC000453071571 338790341 /nfs/dbraw/zinc/79/03/41/338790341.db2.gz ORPAEDLXRWRSFI-ZDUSSCGKSA-N 0 0 323.358 5.111 20 0 DKADRN C[C@@H]1CC[C@@H](NCc2cc(-c3ccccc3)on2)c2sccc21 ZINC000453079464 338791143 /nfs/dbraw/zinc/79/11/43/338791143.db2.gz ALHFAZGBSPODQC-CXAGYDPISA-N 0 0 324.449 5.131 20 0 DKADRN C[C@H]1CC[C@H](NCc2cc(-c3ccccc3)on2)c2sccc21 ZINC000453079469 338791216 /nfs/dbraw/zinc/79/12/16/338791216.db2.gz ALHFAZGBSPODQC-GUYCJALGSA-N 0 0 324.449 5.131 20 0 DKADRN CCC(C)(C)OCc1cccc(NCc2cccc(C)n2)c1C ZINC000453087180 338792227 /nfs/dbraw/zinc/79/22/27/338792227.db2.gz HZGZDXMDUBDPTO-UHFFFAOYSA-N 0 0 312.457 5.016 20 0 DKADRN CC(C)c1nnc(CNc2cccc(-c3cccs3)c2)s1 ZINC000453090803 338792601 /nfs/dbraw/zinc/79/26/01/338792601.db2.gz TXWHKBISXJEFRI-UHFFFAOYSA-N 0 0 315.467 5.002 20 0 DKADRN CC[C@@H](N[C@@H](C)c1nc(C(C)(C)C)cs1)c1ccsc1 ZINC000453103288 338794159 /nfs/dbraw/zinc/79/41/59/338794159.db2.gz RHBBTQITWUTAML-WCQYABFASA-N 0 0 308.516 5.304 20 0 DKADRN CC[C@H](N[C@H](C)c1nc(C(C)(C)C)cs1)c1ccsc1 ZINC000453103290 334231552 /nfs/dbraw/zinc/23/15/52/334231552.db2.gz RHBBTQITWUTAML-YPMHNXCESA-N 0 0 308.516 5.304 20 0 DKADRN Cc1cc([C@H](C)N[C@H](C)c2nc(C(C)(C)C)cs2)cs1 ZINC000453105224 338794332 /nfs/dbraw/zinc/79/43/32/338794332.db2.gz WFORWFPESDJWRR-NWDGAFQWSA-N 0 0 308.516 5.222 20 0 DKADRN CC(C)(C)c1cc(CNc2cccc(C(F)F)c2Cl)no1 ZINC000453107332 334231569 /nfs/dbraw/zinc/23/15/69/334231569.db2.gz IPPBMKANQOJGKZ-UHFFFAOYSA-N 0 0 314.763 5.175 20 0 DKADRN C[C@H]1CC[C@H](NCc2coc(-c3ccccc3)n2)c2sccc21 ZINC000453114152 338795438 /nfs/dbraw/zinc/79/54/38/338795438.db2.gz GIFNRUXZOFPSOR-GUYCJALGSA-N 0 0 324.449 5.131 20 0 DKADRN Cc1cc(NCc2nnc(C(C)C)s2)ccc1-c1ccccc1 ZINC000453124657 338796756 /nfs/dbraw/zinc/79/67/56/338796756.db2.gz ZZHDZTKSRFDXRO-UHFFFAOYSA-N 0 0 323.465 5.249 20 0 DKADRN CC(C)(C)c1csc(CNc2ccccc2C(C)(F)F)n1 ZINC000453157920 334236573 /nfs/dbraw/zinc/23/65/73/334236573.db2.gz JRIVYCUJJAKXBF-UHFFFAOYSA-N 0 0 310.413 5.164 20 0 DKADRN CCn1ccnc1[C@H](C)Nc1ccc(SC2CCCC2)cc1 ZINC000453159875 338801044 /nfs/dbraw/zinc/80/10/44/338801044.db2.gz CUTNKCXGFXOORP-AWEZNQCLSA-N 0 0 315.486 5.111 20 0 DKADRN CCn1ccnc1[C@@H](C)Nc1ccc(SC2CCCC2)cc1 ZINC000453159876 338801041 /nfs/dbraw/zinc/80/10/41/338801041.db2.gz CUTNKCXGFXOORP-CQSZACIVSA-N 0 0 315.486 5.111 20 0 DKADRN CCn1ccnc1[C@H](C)Nc1cccc(CSC(C)C)c1C ZINC000453160174 338801031 /nfs/dbraw/zinc/80/10/31/338801031.db2.gz AGCKLSBNHSHXRL-HNNXBMFYSA-N 0 0 317.502 5.026 20 0 DKADRN CC[C@H](N[C@H](c1cccc(C)c1)c1ccccn1)c1ccsc1 ZINC000453162464 338801445 /nfs/dbraw/zinc/80/14/45/338801445.db2.gz KOUMTUIAWPMQBX-AZUAARDMSA-N 0 0 322.477 5.282 20 0 DKADRN FC1(F)CC[C@H](c2noc([C@@H]3CCC[C@H]3c3ccccc3)n2)C1 ZINC000453169897 338802069 /nfs/dbraw/zinc/80/20/69/338802069.db2.gz GXCFYKXZPTWHLE-SOUVJXGZSA-N 0 0 318.367 5.024 20 0 DKADRN CC[C@H](NC1(c2c(Cl)cccc2Cl)CC1)c1ccncc1 ZINC000453172191 338802520 /nfs/dbraw/zinc/80/25/20/338802520.db2.gz JRXOYPSNGVVMOS-HNNXBMFYSA-N 0 0 321.251 5.118 20 0 DKADRN CC[C@@H](NC1(c2c(Cl)cccc2Cl)CC1)c1ccncc1 ZINC000453172193 338802554 /nfs/dbraw/zinc/80/25/54/338802554.db2.gz JRXOYPSNGVVMOS-OAHLLOKOSA-N 0 0 321.251 5.118 20 0 DKADRN CC[C@H](Nc1cc(NC(=O)C(C)C)ccc1C)c1ccsc1 ZINC000453176364 338802966 /nfs/dbraw/zinc/80/29/66/338802966.db2.gz MNMHFWSFPFNJLE-INIZCTEOSA-N 0 0 316.470 5.214 20 0 DKADRN CC(=O)Nc1cc(N[C@H]2CC[C@@H](C)c3ccsc32)ccc1C ZINC000453182983 338804036 /nfs/dbraw/zinc/80/40/36/338804036.db2.gz UKRKPUUDSPESDZ-BZNIZROVSA-N 0 0 314.454 5.065 20 0 DKADRN CC(=O)Nc1cc(N[C@@H]2CC[C@H](C)c3ccsc32)ccc1C ZINC000453182984 338803943 /nfs/dbraw/zinc/80/39/43/338803943.db2.gz UKRKPUUDSPESDZ-MEDUHNTESA-N 0 0 314.454 5.065 20 0 DKADRN FC1(F)CC(c2noc([C@@H]3CCCC[C@@H]3c3ccccc3)n2)C1 ZINC000453183243 338803940 /nfs/dbraw/zinc/80/39/40/338803940.db2.gz HBQRBEYTUGTTSX-HUUCEWRRSA-N 0 0 318.367 5.024 20 0 DKADRN CCC(=O)Nc1ccc(N[C@@H]2CC[C@H](C)c3ccsc32)cc1 ZINC000453183968 338804074 /nfs/dbraw/zinc/80/40/74/338804074.db2.gz QHZUATNICXLLMD-BLLLJJGKSA-N 0 0 314.454 5.147 20 0 DKADRN CCC(=O)Nc1ccc(N[C@H]2CC[C@H](C)c3ccsc32)cc1 ZINC000453183969 338804133 /nfs/dbraw/zinc/80/41/33/338804133.db2.gz QHZUATNICXLLMD-LRDDRELGSA-N 0 0 314.454 5.147 20 0 DKADRN CCC(=O)Nc1ccc(N[C@H]2CC[C@@H](C)c3ccsc32)cc1 ZINC000453183972 338804172 /nfs/dbraw/zinc/80/41/72/338804172.db2.gz QHZUATNICXLLMD-WBMJQRKESA-N 0 0 314.454 5.147 20 0 DKADRN CC[C@H](C)Sc1ccc(N[C@@H]2C[C@H](C)n3ccnc32)c(C)c1 ZINC000453189631 338804974 /nfs/dbraw/zinc/80/49/74/338804974.db2.gz RSYFQXAZOHGCNI-GRDNDAEWSA-N 0 0 315.486 5.200 20 0 DKADRN CC[C@H](C)Sc1ccc(N[C@H]2C[C@@H](C)n3ccnc32)c(C)c1 ZINC000453189633 338804965 /nfs/dbraw/zinc/80/49/65/338804965.db2.gz RSYFQXAZOHGCNI-KEYYUXOJSA-N 0 0 315.486 5.200 20 0 DKADRN CC[C@H](C)Sc1ccc(N[C@H]2C[C@H](C)n3ccnc32)c(C)c1 ZINC000453189634 338804958 /nfs/dbraw/zinc/80/49/58/338804958.db2.gz RSYFQXAZOHGCNI-ZQIUZPCESA-N 0 0 315.486 5.200 20 0 DKADRN CC[C@@H](Nc1cccc(N2CCCCCC2)c1)c1ccncc1 ZINC000453192706 338805469 /nfs/dbraw/zinc/80/54/69/338805469.db2.gz KBMVNBQROPRNNW-HXUWFJFHSA-N 0 0 309.457 5.025 20 0 DKADRN Cc1cc([C@H](C)Nc2cnn(CC(C)C)c2C(F)F)cs1 ZINC000453197088 338806411 /nfs/dbraw/zinc/80/64/11/338806411.db2.gz WVDBLJMYFNKTKQ-NSHDSACASA-N 0 0 313.417 5.020 20 0 DKADRN CC[C@@H](Nc1cnn(CC(C)C)c1C(F)F)c1ccsc1 ZINC000453197214 338806423 /nfs/dbraw/zinc/80/64/23/338806423.db2.gz XGZXFILWCHPPQI-GFCCVEGCSA-N 0 0 313.417 5.101 20 0 DKADRN CC[C@H](Nc1ccc(C(C)(C)C(F)(F)F)cc1)c1ccncc1 ZINC000453206636 338807751 /nfs/dbraw/zinc/80/77/51/338807751.db2.gz IHPHHSKTFBSEFB-INIZCTEOSA-N 0 0 322.374 5.485 20 0 DKADRN CC[C@@H](Nc1ccc(C(C)(C)C(F)(F)F)cc1)c1ccncc1 ZINC000453206637 338807891 /nfs/dbraw/zinc/80/78/91/338807891.db2.gz IHPHHSKTFBSEFB-MRXNPFEDSA-N 0 0 322.374 5.485 20 0 DKADRN CC[C@H](N[C@H](c1ccc(C)cc1)c1ccccn1)c1ccsc1 ZINC000453231583 338811372 /nfs/dbraw/zinc/81/13/72/338811372.db2.gz WOMQHTDMDKWYSD-AZUAARDMSA-N 0 0 322.477 5.282 20 0 DKADRN CC[C@H](N[C@@H](c1ccc(C)cc1)c1ccccn1)c1ccsc1 ZINC000453231585 338811488 /nfs/dbraw/zinc/81/14/88/338811488.db2.gz WOMQHTDMDKWYSD-ICSRJNTNSA-N 0 0 322.477 5.282 20 0 DKADRN CC[C@@H](N[C@@H](c1ccc(C)cc1)c1ccccn1)c1ccsc1 ZINC000453231587 338811370 /nfs/dbraw/zinc/81/13/70/338811370.db2.gz WOMQHTDMDKWYSD-QUCCMNQESA-N 0 0 322.477 5.282 20 0 DKADRN CC(C)c1nc([C@H](C)N[C@@H]2CCCc3c(F)cccc32)cs1 ZINC000453240479 338812820 /nfs/dbraw/zinc/81/28/20/338812820.db2.gz UKWZEAOLKWBDEW-BLLLJJGKSA-N 0 0 318.461 5.134 20 0 DKADRN CC(C)c1nc([C@@H](C)N[C@@H]2CCCc3c(F)cccc32)cs1 ZINC000453240497 338812814 /nfs/dbraw/zinc/81/28/14/338812814.db2.gz UKWZEAOLKWBDEW-MLGOLLRUSA-N 0 0 318.461 5.134 20 0 DKADRN Cc1nc(C(C)C)sc1[C@@H](C)Nc1ccccc1OCCF ZINC000453248848 338814063 /nfs/dbraw/zinc/81/40/63/338814063.db2.gz FXQPLLRLCHBQEG-GFCCVEGCSA-N 0 0 322.449 5.096 20 0 DKADRN Cc1cc([C@@H](C)N[C@H](C)c2csc(C(C)C)n2)ccc1F ZINC000453260666 338815446 /nfs/dbraw/zinc/81/54/46/338815446.db2.gz QQZIKQTWCMTEFZ-CHWSQXEVSA-N 0 0 306.450 5.126 20 0 DKADRN Cc1cc([C@@H](C)N[C@@H](C)c2csc(C(C)C)n2)ccc1F ZINC000453260667 338815540 /nfs/dbraw/zinc/81/55/40/338815540.db2.gz QQZIKQTWCMTEFZ-OLZOCXBDSA-N 0 0 306.450 5.126 20 0 DKADRN CC(C)c1nc([C@@H](C)Nc2ccccc2C(C)(F)F)cs1 ZINC000453284962 338818547 /nfs/dbraw/zinc/81/85/47/338818547.db2.gz GVMFICLWNUILII-LLVKDONJSA-N 0 0 310.413 5.551 20 0 DKADRN CC(C)c1nc([C@H](C)Nc2ccccc2C(C)(F)F)cs1 ZINC000453284963 338818608 /nfs/dbraw/zinc/81/86/08/338818608.db2.gz GVMFICLWNUILII-NSHDSACASA-N 0 0 310.413 5.551 20 0 DKADRN Cc1c([C@@H](C)Nc2ccccc2C(C)(F)F)cnn1C(C)C ZINC000453296829 338820399 /nfs/dbraw/zinc/82/03/99/338820399.db2.gz RBJGEBIGXDMZRV-GFCCVEGCSA-N 0 0 307.388 5.057 20 0 DKADRN C[C@@H](Nc1ccccc1C(C)(F)F)c1cnn(C2CCCC2)c1 ZINC000453300150 338820841 /nfs/dbraw/zinc/82/08/41/338820841.db2.gz VKYMOVJUTTUMAC-CYBMUJFWSA-N 0 0 319.399 5.283 20 0 DKADRN C[C@H](Nc1ccccc1C(C)(F)F)c1cnn(C2CCCC2)c1 ZINC000453300152 338820755 /nfs/dbraw/zinc/82/07/55/338820755.db2.gz VKYMOVJUTTUMAC-ZDUSSCGKSA-N 0 0 319.399 5.283 20 0 DKADRN CCc1nc(C)c([C@H](C)Nc2ccccc2C(C)(F)F)s1 ZINC000453301785 338821097 /nfs/dbraw/zinc/82/10/97/338821097.db2.gz XTSOUVQSTFCBEB-JTQLQIEISA-N 0 0 310.413 5.299 20 0 DKADRN CCc1nc(C)c([C@@H](C)Nc2ccccc2C(C)(F)F)s1 ZINC000453301788 338821082 /nfs/dbraw/zinc/82/10/82/338821082.db2.gz XTSOUVQSTFCBEB-SNVBAGLBSA-N 0 0 310.413 5.299 20 0 DKADRN Cc1nc([C@@H](C)N[C@H](c2ccc(F)c(Cl)c2)C2CC2)cs1 ZINC000453316312 338823483 /nfs/dbraw/zinc/82/34/83/338823483.db2.gz JXHHJEOPFRJKGQ-ABKXIKBNSA-N 0 0 324.852 5.046 20 0 DKADRN Cc1nc([C@H](C)N[C@H](c2ccc(F)c(Cl)c2)C2CC2)cs1 ZINC000453316321 338823444 /nfs/dbraw/zinc/82/34/44/338823444.db2.gz JXHHJEOPFRJKGQ-FVMDXXJSSA-N 0 0 324.852 5.046 20 0 DKADRN Cc1nc([C@@H](C)N[C@@H](c2ccc(F)c(Cl)c2)C2CC2)cs1 ZINC000453316323 338823477 /nfs/dbraw/zinc/82/34/77/338823477.db2.gz JXHHJEOPFRJKGQ-JDNHERCYSA-N 0 0 324.852 5.046 20 0 DKADRN Cc1nc([C@H](C)N[C@@H](c2ccc(F)c(Cl)c2)C2CC2)cs1 ZINC000453316325 338823510 /nfs/dbraw/zinc/82/35/10/338823510.db2.gz JXHHJEOPFRJKGQ-XXFAHNHDSA-N 0 0 324.852 5.046 20 0 DKADRN C[C@H](N[C@H]1C[C@@H](C)n2ccnc21)c1ccc(C2CCCCC2)cc1 ZINC000453336013 338826812 /nfs/dbraw/zinc/82/68/12/338826812.db2.gz FGZXZIMIXLSJOZ-GUXCAODWSA-N 0 0 323.484 5.287 20 0 DKADRN CCSCc1ccc(N[C@H](c2cncc(F)c2)C2CC2)cc1 ZINC000453336528 338826963 /nfs/dbraw/zinc/82/69/63/338826963.db2.gz AEYPCLIDLAVYPR-SFHVURJKSA-N 0 0 316.445 5.037 20 0 DKADRN CCSCc1ccc(N[C@H](C)c2cnn(C(C)C)c2C)cc1 ZINC000453351679 338829687 /nfs/dbraw/zinc/82/96/87/338829687.db2.gz GVMORMMGWUAVJU-CQSZACIVSA-N 0 0 317.502 5.199 20 0 DKADRN C[C@@H]1C[C@@H](N[C@H](c2cc3ccccc3o2)C(C)(C)C)c2nccn21 ZINC000453357342 338830864 /nfs/dbraw/zinc/83/08/64/338830864.db2.gz PUGKRNAJYNNMQE-DDUZABMNSA-N 0 0 323.440 5.012 20 0 DKADRN C[C@@H]1C[C@H](N[C@H](c2cc3ccccc3o2)C(C)(C)C)c2nccn21 ZINC000453357367 338830809 /nfs/dbraw/zinc/83/08/09/338830809.db2.gz PUGKRNAJYNNMQE-QIIPPGSGSA-N 0 0 323.440 5.012 20 0 DKADRN C[C@@H]1C[C@H](N[C@@H](c2cc3ccccc3o2)C(C)(C)C)c2nccn21 ZINC000453357385 338830760 /nfs/dbraw/zinc/83/07/60/338830760.db2.gz PUGKRNAJYNNMQE-XUWXXGDYSA-N 0 0 323.440 5.012 20 0 DKADRN CCSCc1ccc(N[C@@H](CC)c2ccc(F)cn2)cc1 ZINC000453392169 338837056 /nfs/dbraw/zinc/83/70/56/338837056.db2.gz ZJAFOBGYWVDCDI-INIZCTEOSA-N 0 0 304.434 5.037 20 0 DKADRN CCSCc1ccc(N[C@H](CC)c2ccc(F)cn2)cc1 ZINC000453392170 338837051 /nfs/dbraw/zinc/83/70/51/338837051.db2.gz ZJAFOBGYWVDCDI-MRXNPFEDSA-N 0 0 304.434 5.037 20 0 DKADRN CC(C)c1cccc(C(C)C)c1NC(=O)N1CC[C@H]1C(C)C ZINC000454172022 338855883 /nfs/dbraw/zinc/85/58/83/338855883.db2.gz TUCBUEKPWIBLFE-KRWDZBQOSA-N 0 0 302.462 5.196 20 0 DKADRN CC(C)c1cccc(C(C)C)c1NC(=O)N1CC[C@@H]1C(C)C ZINC000454172025 338855801 /nfs/dbraw/zinc/85/58/01/338855801.db2.gz TUCBUEKPWIBLFE-QGZVFWFLSA-N 0 0 302.462 5.196 20 0 DKADRN CC(C)c1ccc(NC(=O)N2CC3(CCC3)[C@H]2c2ccco2)cc1 ZINC000454178211 338856096 /nfs/dbraw/zinc/85/60/96/338856096.db2.gz UIDWXDPBZIXFEZ-GOSISDBHSA-N 0 0 324.424 5.162 20 0 DKADRN CC(C)(C)c1ccccc1NC(=O)N1CC(C2CCCCC2)C1 ZINC000454193275 338856551 /nfs/dbraw/zinc/85/65/51/338856551.db2.gz BIKRAOYQMXWJRG-UHFFFAOYSA-N 0 0 314.473 5.028 20 0 DKADRN Cc1cccc(C)c1NC(=O)N1[C@H](C)C[C@H](c2ccccc2)[C@H]1C ZINC000454198399 338856950 /nfs/dbraw/zinc/85/69/50/338856950.db2.gz GBONVOAGEFEXMW-LMMKCTJWSA-N 0 0 322.452 5.102 20 0 DKADRN Cc1cccc(C)c1NC(=O)N1[C@H](C)C[C@@H](c2ccccc2)[C@@H]1C ZINC000454198406 338856926 /nfs/dbraw/zinc/85/69/26/338856926.db2.gz GBONVOAGEFEXMW-ZIFCJYIRSA-N 0 0 322.452 5.102 20 0 DKADRN CC(C)(C)c1ccccc1NC(=O)N1CC(C)(C)[C@H]2CCC[C@H]21 ZINC000454210140 338857524 /nfs/dbraw/zinc/85/75/24/338857524.db2.gz SVHVJXKUCZZOLP-DOTOQJQBSA-N 0 0 314.473 5.027 20 0 DKADRN CC(C)(C)c1ccccc1NC(=O)N1CC(C)(C)[C@@H]2CCC[C@H]21 ZINC000454210166 338857479 /nfs/dbraw/zinc/85/74/79/338857479.db2.gz SVHVJXKUCZZOLP-NVXWUHKLSA-N 0 0 314.473 5.027 20 0 DKADRN CC(C)(C)c1ccccc1NC(=O)N1CC(C)(C)[C@H]2CCC[C@@H]21 ZINC000454210170 338857564 /nfs/dbraw/zinc/85/75/64/338857564.db2.gz SVHVJXKUCZZOLP-RDJZCZTQSA-N 0 0 314.473 5.027 20 0 DKADRN CC(C)(C)c1ccccc1NC(=O)N1CC(C)(C)[C@@H]2CCC[C@@H]21 ZINC000454210175 338857531 /nfs/dbraw/zinc/85/75/31/338857531.db2.gz SVHVJXKUCZZOLP-WBVHZDCISA-N 0 0 314.473 5.027 20 0 DKADRN Cc1cccc(C(C)C)c1NC(=O)NC[C@@H]1CCCCC1(F)F ZINC000454220316 338858017 /nfs/dbraw/zinc/85/80/17/338858017.db2.gz KTKMYLNIDYKKKV-AWEZNQCLSA-N 0 0 324.415 5.065 20 0 DKADRN Cc1cccc(C(C)C)c1NC(=O)N1CC(C)(C)[C@H]2CCC[C@H]21 ZINC000454224538 338858182 /nfs/dbraw/zinc/85/81/82/338858182.db2.gz PAYNJAHNLKAUQD-DLBZAZTESA-N 0 0 314.473 5.161 20 0 DKADRN Cc1cccc(C(C)C)c1NC(=O)N1CC(C)(C)[C@@H]2CCC[C@@H]21 ZINC000454224541 338858160 /nfs/dbraw/zinc/85/81/60/338858160.db2.gz PAYNJAHNLKAUQD-SJORKVTESA-N 0 0 314.473 5.161 20 0 DKADRN CCCC[C@H](C)N(CCCC)C(=O)Nc1ccccc1COC ZINC000454425924 338863307 /nfs/dbraw/zinc/86/33/07/338863307.db2.gz HHSZTVMAJMGBCW-INIZCTEOSA-N 0 0 320.477 5.046 20 0 DKADRN CCc1ccccc1NC(=O)c1ccc([C@@H](C)C(F)(F)F)cc1 ZINC000454455132 338864111 /nfs/dbraw/zinc/86/41/11/338864111.db2.gz SZPSEJXJRZVDTE-GFCCVEGCSA-N 0 0 321.342 5.167 20 0 DKADRN CCN(C(=O)c1ccc([C@H](C)C(F)(F)F)cc1)c1ccccc1 ZINC000454668033 338868993 /nfs/dbraw/zinc/86/89/93/338868993.db2.gz XYDXKRJLFSOWAU-ZDUSSCGKSA-N 0 0 321.342 5.019 20 0 DKADRN CC(C)[C@@H]1N(C(=O)Nc2cccc(C(F)F)c2)CC12CCCC2 ZINC000454697968 338870022 /nfs/dbraw/zinc/87/00/22/338870022.db2.gz XSZPCRFLAUBSMP-HNNXBMFYSA-N 0 0 322.399 5.057 20 0 DKADRN CC(C)[C@H]1N(C(=O)Nc2cccc(C(F)F)c2)CC12CCCC2 ZINC000454697972 338870008 /nfs/dbraw/zinc/87/00/08/338870008.db2.gz XSZPCRFLAUBSMP-OAHLLOKOSA-N 0 0 322.399 5.057 20 0 DKADRN CCCC[C@@H](C)N(CCCC)C(=O)Nc1c(C)noc1C1CC1 ZINC000455131834 338883005 /nfs/dbraw/zinc/88/30/05/338883005.db2.gz DAKLZNPJCKGRMB-CYBMUJFWSA-N 0 0 321.465 5.073 20 0 DKADRN CCCC[C@H](C)N(CCCC)C(=O)Nc1c(C)noc1C1CC1 ZINC000455131835 338883011 /nfs/dbraw/zinc/88/30/11/338883011.db2.gz DAKLZNPJCKGRMB-ZDUSSCGKSA-N 0 0 321.465 5.073 20 0 DKADRN Cc1cc(Cl)c(NC(=O)N(C)[C@H](C)c2cccs2)cc1C ZINC000455733908 338905859 /nfs/dbraw/zinc/90/58/59/338905859.db2.gz PQCAKJRIAOYDBR-GFCCVEGCSA-N 0 0 322.861 5.243 20 0 DKADRN Cc1cc(Cl)c(NC(=O)N2Cc3ccccc3[C@H]2C)cc1C ZINC000455755117 338907292 /nfs/dbraw/zinc/90/72/92/338907292.db2.gz WUOLONSJSDXPNP-CYBMUJFWSA-N 0 0 314.816 5.066 20 0 DKADRN CC(C)(C)C1CCN(C(=O)Nc2ccccc2C(C)(F)F)CC1 ZINC000455767030 338907729 /nfs/dbraw/zinc/90/77/29/338907729.db2.gz GUYFCASAMDKISZ-UHFFFAOYSA-N 0 0 324.415 5.088 20 0 DKADRN CCC[C@@H](C)[C@@H]1CCCN1C(=O)Nc1ccccc1C(C)(F)F ZINC000455769248 338907782 /nfs/dbraw/zinc/90/77/82/338907782.db2.gz JNQHFQIEHRCIDU-CJNGLKHVSA-N 0 0 324.415 5.231 20 0 DKADRN CCC[C@@H](C)[C@H]1CCCN1C(=O)Nc1ccccc1C(C)(F)F ZINC000455769249 338907761 /nfs/dbraw/zinc/90/77/61/338907761.db2.gz JNQHFQIEHRCIDU-CZUORRHYSA-N 0 0 324.415 5.231 20 0 DKADRN 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C[C@H]1C[C@H](c2cccc(F)c2)N(C(=O)CCC2CCCCC2)C1 ZINC000461332226 339061972 /nfs/dbraw/zinc/06/19/72/339061972.db2.gz LSEKQTVHWWFJJO-HNAYVOBHSA-N 0 0 317.448 5.096 20 0 DKADRN C[C@H]1C[C@@H](c2cccc(F)c2)N(C(=O)CCC2CCCCC2)C1 ZINC000461332227 339061913 /nfs/dbraw/zinc/06/19/13/339061913.db2.gz LSEKQTVHWWFJJO-KXBFYZLASA-N 0 0 317.448 5.096 20 0 DKADRN C[C@@H](NCc1ccc(C(F)F)cc1)c1c(F)cccc1Cl ZINC000461388532 339062960 /nfs/dbraw/zinc/06/29/60/339062960.db2.gz ZZTBDDZDPHPAAQ-SNVBAGLBSA-N 0 0 313.750 5.268 20 0 DKADRN C[C@@H](Sc1nncc2ccccc21)c1ccc(Cl)cc1 ZINC000461397170 339063083 /nfs/dbraw/zinc/06/30/83/339063083.db2.gz FGMZITXBKAHBLX-LLVKDONJSA-N 0 0 300.814 5.137 20 0 DKADRN C[C@H](Sc1nncc2ccccc21)c1ccc(Cl)cc1 ZINC000461397171 339062996 /nfs/dbraw/zinc/06/29/96/339062996.db2.gz FGMZITXBKAHBLX-NSHDSACASA-N 0 0 300.814 5.137 20 0 DKADRN Clc1cccc2c1CC[C@@H]2Sc1nncc2ccccc21 ZINC000461398072 339063036 /nfs/dbraw/zinc/06/30/36/339063036.db2.gz JUILJNIPHCDGGP-INIZCTEOSA-N 0 0 312.825 5.063 20 0 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CC[C@H](Sc1nncc2ccccc21)c1ccc(F)cc1F ZINC000461421364 339063622 /nfs/dbraw/zinc/06/36/22/339063622.db2.gz HQEGIWUUYKXYCX-INIZCTEOSA-N 0 0 316.376 5.151 20 0 DKADRN CC[C@@H](Sc1nncc2ccccc21)c1ccc(F)cc1F ZINC000461421374 339063555 /nfs/dbraw/zinc/06/35/55/339063555.db2.gz HQEGIWUUYKXYCX-MRXNPFEDSA-N 0 0 316.376 5.151 20 0 DKADRN C[C@@H](Sc1nncc2ccccc21)c1cccc(Cl)c1 ZINC000461432955 339063810 /nfs/dbraw/zinc/06/38/10/339063810.db2.gz VFOFKAKPRLTQCB-LLVKDONJSA-N 0 0 300.814 5.137 20 0 DKADRN C[C@H](Sc1nncc2ccccc21)c1cccc(Cl)c1 ZINC000461432956 339063845 /nfs/dbraw/zinc/06/38/45/339063845.db2.gz VFOFKAKPRLTQCB-NSHDSACASA-N 0 0 300.814 5.137 20 0 DKADRN C[C@H](Sc1nncc2ccccc21)c1ccc(F)c(Cl)c1 ZINC000461435586 339063834 /nfs/dbraw/zinc/06/38/34/339063834.db2.gz YMHOIWWSNOVOBA-JTQLQIEISA-N 0 0 318.804 5.276 20 0 DKADRN C[C@@H](Sc1nncc2ccccc21)c1ccc(F)c(Cl)c1 ZINC000461435587 339063802 /nfs/dbraw/zinc/06/38/02/339063802.db2.gz YMHOIWWSNOVOBA-SNVBAGLBSA-N 0 0 318.804 5.276 20 0 DKADRN CC(C)Nc1cc(F)ccc1NC(=O)c1cccc2ccccc21 ZINC000461461378 337190344 /nfs/dbraw/zinc/19/03/44/337190344.db2.gz CMAKBEXPCQUURZ-UHFFFAOYSA-N 0 0 322.383 5.052 20 0 DKADRN CC(C)Nc1cc(F)ccc1NC(=O)c1ccc2ccccc2c1 ZINC000461464351 339064220 /nfs/dbraw/zinc/06/42/20/339064220.db2.gz PXYNKFVRIRULTF-UHFFFAOYSA-N 0 0 322.383 5.052 20 0 DKADRN O=C(c1ccc(Cl)cc1)N(c1ccccc1F)C1CCCC1 ZINC000461520312 339064707 /nfs/dbraw/zinc/06/47/07/339064707.db2.gz GMVYWSYJUZZYIA-UHFFFAOYSA-N 0 0 317.791 5.069 20 0 DKADRN O=C(c1cc2ccccc2o1)N(c1ccccc1F)C1CCCC1 ZINC000461520907 339064751 /nfs/dbraw/zinc/06/47/51/339064751.db2.gz HMKUKLHUUQAEPV-UHFFFAOYSA-N 0 0 323.367 5.161 20 0 DKADRN O=C(c1ccccc1Cl)N(c1ccccc1F)C1CCCC1 ZINC000461535017 339064802 /nfs/dbraw/zinc/06/48/02/339064802.db2.gz PEIHJPKQYRLXLG-UHFFFAOYSA-N 0 0 317.791 5.069 20 0 DKADRN O=C(c1cccc(Cl)c1)N(c1ccccc1F)C1CCCC1 ZINC000461537728 339064805 /nfs/dbraw/zinc/06/48/05/339064805.db2.gz ZQRLYVHIEUNYSL-UHFFFAOYSA-N 0 0 317.791 5.069 20 0 DKADRN Cc1cc(C)cc(C(=O)N(c2ccccc2F)C2CCCC2)c1 ZINC000461540964 339064807 /nfs/dbraw/zinc/06/48/07/339064807.db2.gz MWVOFYCRKOSNKO-UHFFFAOYSA-N 0 0 311.400 5.032 20 0 DKADRN Cc1csc(CSc2nc(C)c(C)n2C2CCCCC2)n1 ZINC000461542511 339034786 /nfs/dbraw/zinc/03/47/86/339034786.db2.gz KEWQPYDPETUNCB-UHFFFAOYSA-N 0 0 321.515 5.062 20 0 DKADRN Cc1ccc(C(=O)N(c2ccccc2F)C2CCCC2)c(C)c1 ZINC000461542685 339064904 /nfs/dbraw/zinc/06/49/04/339064904.db2.gz VEPSPJXZMYVKBN-UHFFFAOYSA-N 0 0 311.400 5.032 20 0 DKADRN Cc1ccc(C(=O)N(c2ccccc2F)C2CCCC2)cc1C ZINC000461545086 339064901 /nfs/dbraw/zinc/06/49/01/339064901.db2.gz NOBLNSMVFPEJIB-UHFFFAOYSA-N 0 0 311.400 5.032 20 0 DKADRN O=C(c1ccc(Cl)s1)N(c1ccccc1F)C1CCCC1 ZINC000461545592 339064955 /nfs/dbraw/zinc/06/49/55/339064955.db2.gz NTSGZIRQAFKVRL-UHFFFAOYSA-N 0 0 323.820 5.130 20 0 DKADRN Cc1c(NC(=O)C[C@@H](C)c2ccccc2)sc2c1CCCC2 ZINC000461665717 339065442 /nfs/dbraw/zinc/06/54/42/339065442.db2.gz ZAPCMHCHYWLJMB-CYBMUJFWSA-N 0 0 313.466 5.068 20 0 DKADRN Cc1c(NC(=O)C[C@H](C)c2ccccc2)sc2c1CCCC2 ZINC000461666033 339065441 /nfs/dbraw/zinc/06/54/41/339065441.db2.gz ZAPCMHCHYWLJMB-ZDUSSCGKSA-N 0 0 313.466 5.068 20 0 DKADRN CC[C@H](C(=O)Nc1sc2c(c1C)CCCC2)c1ccccc1 ZINC000461693697 339065712 /nfs/dbraw/zinc/06/57/12/339065712.db2.gz PPRVGAHWJNXXFN-HNNXBMFYSA-N 0 0 313.466 5.068 20 0 DKADRN CC[C@@H](C(=O)Nc1sc2c(c1C)CCCC2)c1ccccc1 ZINC000461693698 339065700 /nfs/dbraw/zinc/06/57/00/339065700.db2.gz PPRVGAHWJNXXFN-OAHLLOKOSA-N 0 0 313.466 5.068 20 0 DKADRN Cc1c2c(sc1NC(=O)c1sccc1C(C)C)CCCC2 ZINC000461703126 339065842 /nfs/dbraw/zinc/06/58/42/339065842.db2.gz DORBJYJFHKZNSZ-UHFFFAOYSA-N 0 0 319.495 5.373 20 0 DKADRN Cc1c2ccccc2sc1-c1csc([C@@H]2CCCOC2)n1 ZINC000461720651 339065911 /nfs/dbraw/zinc/06/59/11/339065911.db2.gz CPGULJQBCMLEKS-GFCCVEGCSA-N 0 0 315.463 5.227 20 0 DKADRN Cc1c2ccccc2sc1-c1csc([C@H]2CCCOC2)n1 ZINC000461720652 339065946 /nfs/dbraw/zinc/06/59/46/339065946.db2.gz CPGULJQBCMLEKS-LBPRGKRZSA-N 0 0 315.463 5.227 20 0 DKADRN Clc1ccc(-c2csc([C@@H]3CCCOC3)n2)c(Cl)c1 ZINC000461723486 339066009 /nfs/dbraw/zinc/06/60/09/339066009.db2.gz IFTOTQKNDPVSTL-SECBINFHSA-N 0 0 314.237 5.011 20 0 DKADRN Clc1ccc(-c2csc([C@H]3CCCOC3)n2)c(Cl)c1 ZINC000461723501 339065994 /nfs/dbraw/zinc/06/59/94/339065994.db2.gz IFTOTQKNDPVSTL-VIFPVBQESA-N 0 0 314.237 5.011 20 0 DKADRN FC(F)(F)c1csc(CNc2cccc(C3CCC3)c2)n1 ZINC000461725174 339065961 /nfs/dbraw/zinc/06/59/61/339065961.db2.gz JDJLDIGQGRIAIT-UHFFFAOYSA-N 0 0 312.360 5.042 20 0 DKADRN c1oc(-c2ccccc2)nc1CNc1cccc(C2CCC2)c1 ZINC000461731058 339066134 /nfs/dbraw/zinc/06/61/34/339066134.db2.gz UOHRXEXLBHGGMF-UHFFFAOYSA-N 0 0 304.393 5.221 20 0 DKADRN Clc1cccc(-c2csc([C@@H]3CCCOC3)n2)c1Cl ZINC000461732504 339066117 /nfs/dbraw/zinc/06/61/17/339066117.db2.gz ZKKICZNDYOZCLG-SECBINFHSA-N 0 0 314.237 5.011 20 0 DKADRN Clc1cccc(-c2csc([C@H]3CCCOC3)n2)c1Cl ZINC000461732505 339066121 /nfs/dbraw/zinc/06/61/21/339066121.db2.gz ZKKICZNDYOZCLG-VIFPVBQESA-N 0 0 314.237 5.011 20 0 DKADRN c1csc(-c2cnc(CNc3cccc(C4CCC4)c3)o2)c1 ZINC000461734495 339066253 /nfs/dbraw/zinc/06/62/53/339066253.db2.gz DTHUSNHGTQWEDH-UHFFFAOYSA-N 0 0 310.422 5.283 20 0 DKADRN Clc1cc(-c2csc([C@@H]3CCCOC3)n2)c(Cl)s1 ZINC000461735637 339066218 /nfs/dbraw/zinc/06/62/18/339066218.db2.gz ILLQLNAUVDUIGB-SSDOTTSWSA-N 0 0 320.266 5.072 20 0 DKADRN Clc1cc(-c2csc([C@H]3CCCOC3)n2)c(Cl)s1 ZINC000461735647 339066264 /nfs/dbraw/zinc/06/62/64/339066264.db2.gz ILLQLNAUVDUIGB-ZETCQYMHSA-N 0 0 320.266 5.072 20 0 DKADRN CC(C)c1ccccc1NC(=O)CNc1cccc(C2CCC2)c1 ZINC000461737842 339066262 /nfs/dbraw/zinc/06/62/62/339066262.db2.gz LYQFYBNWMSHEOQ-UHFFFAOYSA-N 0 0 322.452 5.128 20 0 DKADRN Clc1ccc2oc(-c3csc([C@H]4CCCOC4)n3)cc2c1 ZINC000461738736 339066299 /nfs/dbraw/zinc/06/62/99/339066299.db2.gz UBPPGYOERBIAEQ-JTQLQIEISA-N 0 0 319.813 5.104 20 0 DKADRN Clc1ccc2oc(-c3csc([C@@H]4CCCOC4)n3)cc2c1 ZINC000461738737 339066368 /nfs/dbraw/zinc/06/63/68/339066368.db2.gz UBPPGYOERBIAEQ-SNVBAGLBSA-N 0 0 319.813 5.104 20 0 DKADRN c1ccc(-c2nc([C@H]3CCCOC3)sc2-c2ccccc2)cc1 ZINC000461739395 339066314 /nfs/dbraw/zinc/06/63/14/339066314.db2.gz XKEBACYOUKOWTE-KRWDZBQOSA-N 0 0 321.445 5.371 20 0 DKADRN c1ccc(-c2nc([C@@H]3CCCOC3)sc2-c2ccccc2)cc1 ZINC000461739396 339066341 /nfs/dbraw/zinc/06/63/41/339066341.db2.gz XKEBACYOUKOWTE-QGZVFWFLSA-N 0 0 321.445 5.371 20 0 DKADRN Clc1ccc(Cl)c(-c2csc([C@@H]3CCCOC3)n2)c1 ZINC000461740964 339066317 /nfs/dbraw/zinc/06/63/17/339066317.db2.gz CJBZEJOANWPCHW-SECBINFHSA-N 0 0 314.237 5.011 20 0 DKADRN Clc1ccc(Cl)c(-c2csc([C@H]3CCCOC3)n2)c1 ZINC000461740965 339066347 /nfs/dbraw/zinc/06/63/47/339066347.db2.gz CJBZEJOANWPCHW-VIFPVBQESA-N 0 0 314.237 5.011 20 0 DKADRN Cc1cccc(F)c1NC(=O)N[C@@H](C)c1cccc2ccccc21 ZINC000461912415 339068398 /nfs/dbraw/zinc/06/83/98/339068398.db2.gz JCRYMCHMMMUZLZ-AWEZNQCLSA-N 0 0 322.383 5.170 20 0 DKADRN Cc1cccc(F)c1NC(=O)N[C@H](C)c1cccc2ccccc21 ZINC000461912416 339068391 /nfs/dbraw/zinc/06/83/91/339068391.db2.gz JCRYMCHMMMUZLZ-CQSZACIVSA-N 0 0 322.383 5.170 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Fc1cccc(Cl)c1CNc1ccc(CC(F)(F)F)cc1 ZINC000462242036 339074991 /nfs/dbraw/zinc/07/49/91/339074991.db2.gz DPJBYPQSPYTQMM-UHFFFAOYSA-N 0 0 317.713 5.196 20 0 DKADRN CC(C)c1cccc(NC(=O)NCc2ccc(C(F)F)cc2)c1 ZINC000462242331 339074914 /nfs/dbraw/zinc/07/49/14/339074914.db2.gz AMRPYTJMMPKDSO-UHFFFAOYSA-N 0 0 318.367 5.069 20 0 DKADRN Cc1ncc(CNc2cccc(CCCc3ccccc3)c2)s1 ZINC000462250514 339075024 /nfs/dbraw/zinc/07/50/24/339075024.db2.gz ZYALIWHNMBZQTC-UHFFFAOYSA-N 0 0 322.477 5.239 20 0 DKADRN Cc1cnc([C@@H](C)N[C@H](C)c2ccc(Cl)c3ccccc32)o1 ZINC000462359289 339076533 /nfs/dbraw/zinc/07/65/33/339076533.db2.gz IJEPYZDRNDDIAW-CHWSQXEVSA-N 0 0 314.816 5.201 20 0 DKADRN Cc1cnc([C@H](C)N[C@H](C)c2ccc(Cl)c3ccccc32)o1 ZINC000462359290 339076501 /nfs/dbraw/zinc/07/65/01/339076501.db2.gz IJEPYZDRNDDIAW-OLZOCXBDSA-N 0 0 314.816 5.201 20 0 DKADRN Cc1cnc([C@@H](C)N[C@@H](C)c2ccc(Cl)c3ccccc32)o1 ZINC000462359291 339076492 /nfs/dbraw/zinc/07/64/92/339076492.db2.gz IJEPYZDRNDDIAW-QWHCGFSZSA-N 0 0 314.816 5.201 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5.007 20 0 DKADRN CSc1c(F)cccc1C(=O)Nc1cccc(C2CCC2)c1 ZINC000462382537 339077565 /nfs/dbraw/zinc/07/75/65/339077565.db2.gz ANSKQKBNVHIROW-UHFFFAOYSA-N 0 0 315.413 5.067 20 0 DKADRN O=C(Nc1cccc(C2CCC2)c1)c1cccc(C(F)F)c1 ZINC000462408641 339078299 /nfs/dbraw/zinc/07/82/99/339078299.db2.gz HYGUHTDWKRLTIV-UHFFFAOYSA-N 0 0 301.336 5.144 20 0 DKADRN Cc1csc(C(=O)Nc2cccc(C3CCC3)c2)c1Cl ZINC000462408812 339078273 /nfs/dbraw/zinc/07/82/73/339078273.db2.gz JEKRPYDTXCOUKD-UHFFFAOYSA-N 0 0 305.830 5.230 20 0 DKADRN CC(C)C[C@H](C)C(=O)N(Cc1cccs1)Cc1cccs1 ZINC000462417618 339078445 /nfs/dbraw/zinc/07/84/45/339078445.db2.gz NNLRVWPOKRHXBC-AWEZNQCLSA-N 0 0 321.511 5.021 20 0 DKADRN CC(C)C[C@@H](C)C(=O)N(Cc1cccs1)Cc1cccs1 ZINC000462417623 339078490 /nfs/dbraw/zinc/07/84/90/339078490.db2.gz NNLRVWPOKRHXBC-CQSZACIVSA-N 0 0 321.511 5.021 20 0 DKADRN CC(C)C[C@@H](C)C(=O)Nc1c(F)cc(F)cc1-c1ccccc1 ZINC000462430028 339078765 /nfs/dbraw/zinc/07/87/65/339078765.db2.gz FYURYLBMQQEUHG-CYBMUJFWSA-N 0 0 317.379 5.253 20 0 DKADRN CC(C)C[C@H](C)C(=O)Nc1c(F)cc(F)cc1-c1ccccc1 ZINC000462430029 339078711 /nfs/dbraw/zinc/07/87/11/339078711.db2.gz FYURYLBMQQEUHG-ZDUSSCGKSA-N 0 0 317.379 5.253 20 0 DKADRN CC(C)C[C@H](C)c1nc(-c2cccnc2Oc2ccccc2)no1 ZINC000462513957 339080308 /nfs/dbraw/zinc/08/03/08/339080308.db2.gz AMIKEOKXZYKXCQ-AWEZNQCLSA-N 0 0 323.396 5.074 20 0 DKADRN CC(C)C[C@@H](C)c1nc(-c2cccnc2Oc2ccccc2)no1 ZINC000462513958 339080473 /nfs/dbraw/zinc/08/04/73/339080473.db2.gz AMIKEOKXZYKXCQ-CQSZACIVSA-N 0 0 323.396 5.074 20 0 DKADRN Cc1ccc(CNc2cccc(CSC3CCCC3)c2)cn1 ZINC000462524915 339080532 /nfs/dbraw/zinc/08/05/32/339080532.db2.gz JDYBGFWZTUHOBU-UHFFFAOYSA-N 0 0 312.482 5.178 20 0 DKADRN Cc1cc(Cl)c2ccccc2c1NCc1nccn1C(F)F ZINC000462536968 332973980 /nfs/dbraw/zinc/97/39/80/332973980.db2.gz HCCMDWFUHSDKNX-UHFFFAOYSA-N 0 0 321.758 5.005 20 0 DKADRN Cc1noc(C)c1CNc1c(C)cc(Cl)c2ccccc21 ZINC000462543279 339081032 /nfs/dbraw/zinc/08/10/32/339081032.db2.gz JITQIBMDUKDTHX-UHFFFAOYSA-N 0 0 300.789 5.019 20 0 DKADRN Cc1nc(CNc2c(C)cc(Cl)c3ccccc32)oc1C ZINC000462544047 339080975 /nfs/dbraw/zinc/08/09/75/339080975.db2.gz AUNRYZLOENBPTL-UHFFFAOYSA-N 0 0 300.789 5.019 20 0 DKADRN Cc1cc(Cl)c2ccccc2c1NCc1ncc(C2CC2)o1 ZINC000462558133 339081417 /nfs/dbraw/zinc/08/14/17/339081417.db2.gz WKWXEZLNTQGKIN-UHFFFAOYSA-N 0 0 312.800 5.279 20 0 DKADRN Cc1cnc(COc2ccc(Cl)cc2C2CCCCC2)o1 ZINC000462569005 339081729 /nfs/dbraw/zinc/08/17/29/339081729.db2.gz UTNMIDDLUQFTKK-UHFFFAOYSA-N 0 0 305.805 5.263 20 0 DKADRN C[C@@H](c1ccccc1)N(Cc1ccccc1)C(=O)[C@@H]1CC=CCC1 ZINC000462581835 339081901 /nfs/dbraw/zinc/08/19/01/339081901.db2.gz SLESTJQXYUHGNW-GHTZIAJQSA-N 0 0 319.448 5.133 20 0 DKADRN CCc1oc2ccccc2c1C[NH2+]Cc1ccc(C(F)F)cc1 ZINC000462636870 339082965 /nfs/dbraw/zinc/08/29/65/339082965.db2.gz HAAAPMRESYXQBK-UHFFFAOYSA-N 0 0 315.363 5.223 20 0 DKADRN CCCCOc1ccc(C[NH2+]Cc2ccc(C(F)F)cc2)cc1 ZINC000462638692 339082988 /nfs/dbraw/zinc/08/29/88/339082988.db2.gz IRCHQDTUJIEZPH-UHFFFAOYSA-N 0 0 319.395 5.093 20 0 DKADRN FC(F)c1ccc(C[NH2+]Cc2ccc(-c3ccccc3)o2)cc1 ZINC000462640709 339083137 /nfs/dbraw/zinc/08/31/37/339083137.db2.gz MVIKPHNBLZJIQA-UHFFFAOYSA-N 0 0 313.347 5.174 20 0 DKADRN CCC(C)(C)OCc1ccccc1NC(=O)[C@@H](C)CC(C)C ZINC000462644986 333022376 /nfs/dbraw/zinc/02/23/76/333022376.db2.gz YLVMTXRTOLIBLI-HNNXBMFYSA-N 0 0 305.462 5.013 20 0 DKADRN CCC(C)(C)OCc1ccccc1NC(=O)[C@H](C)CC(C)C ZINC000462644987 333022381 /nfs/dbraw/zinc/02/23/81/333022381.db2.gz YLVMTXRTOLIBLI-OAHLLOKOSA-N 0 0 305.462 5.013 20 0 DKADRN C[C@H](c1ccccc1)N(Cc1ccccc1)C(=O)[C@H]1CC=CCC1 ZINC000462650778 333023237 /nfs/dbraw/zinc/02/32/37/333023237.db2.gz SLESTJQXYUHGNW-NQIIRXRSSA-N 0 0 319.448 5.133 20 0 DKADRN C[C@H](c1ccccc1)N(Cc1ccccc1)C(=O)[C@@H]1CC=CCC1 ZINC000462650779 333023338 /nfs/dbraw/zinc/02/33/38/333023338.db2.gz SLESTJQXYUHGNW-WIYYLYMNSA-N 0 0 319.448 5.133 20 0 DKADRN FC(F)c1ccc(CNCc2c(Cl)cccc2Cl)cc1 ZINC000462654091 339083432 /nfs/dbraw/zinc/08/34/32/339083432.db2.gz HAJFQYKNNLALSQ-UHFFFAOYSA-N 0 0 316.178 5.221 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CSc1cccc(F)c1C(=O)Nc1cccc(C2CCC2)c1 ZINC000462715240 339084643 /nfs/dbraw/zinc/08/46/43/339084643.db2.gz LVEDRQXQJRDUIB-UHFFFAOYSA-N 0 0 315.413 5.067 20 0 DKADRN Fc1ccc2oc(CNc3ccc(CC(F)(F)F)cc3)cc2c1 ZINC000462717176 339084768 /nfs/dbraw/zinc/08/47/68/339084768.db2.gz HSHFFBKBMWMRFY-UHFFFAOYSA-N 0 0 323.289 5.289 20 0 DKADRN Fc1cc(CNc2ccc(CC(F)(F)F)cc2)ccc1Cl ZINC000462718449 339084769 /nfs/dbraw/zinc/08/47/69/339084769.db2.gz MSQCNJJNHOYHNJ-UHFFFAOYSA-N 0 0 317.713 5.196 20 0 DKADRN CC(C)Oc1cccc(CNc2ccc(CC(F)(F)F)cc2)c1 ZINC000462718572 339084745 /nfs/dbraw/zinc/08/47/45/339084745.db2.gz NKOHBECTBSQIDA-UHFFFAOYSA-N 0 0 323.358 5.191 20 0 DKADRN COc1c(C)cc(CNc2ccc(CC(F)(F)F)cc2)cc1C ZINC000462722376 339084866 /nfs/dbraw/zinc/08/48/66/339084866.db2.gz BRLQKUAOEYWUHR-UHFFFAOYSA-N 0 0 323.358 5.029 20 0 DKADRN CC(C)Oc1ccccc1CNc1ccc(CC(F)(F)F)cc1 ZINC000462723548 339084827 /nfs/dbraw/zinc/08/48/27/339084827.db2.gz FKNUMCDXCMZKRS-UHFFFAOYSA-N 0 0 323.358 5.191 20 0 DKADRN O=C(Nc1cccc(C2CCC2)c1)c1c[nH]cc1-c1ccccc1 ZINC000462725882 339085010 /nfs/dbraw/zinc/08/50/10/339085010.db2.gz OMVBFTLWEWGVAM-UHFFFAOYSA-N 0 0 316.404 5.202 20 0 DKADRN CCc1nc(CN[C@@H](CC(C)C)c2ccc(Cl)cc2)cs1 ZINC000462726019 339084946 /nfs/dbraw/zinc/08/49/46/339084946.db2.gz FSPMHMLYUAQWDX-INIZCTEOSA-N 0 0 322.905 5.236 20 0 DKADRN CCc1nc(CN[C@H](CC(C)C)c2ccc(Cl)cc2)cs1 ZINC000462726020 339084929 /nfs/dbraw/zinc/08/49/29/339084929.db2.gz FSPMHMLYUAQWDX-MRXNPFEDSA-N 0 0 322.905 5.236 20 0 DKADRN O=C(Nc1cccc(C2CCC2)c1)c1ccccc1C(F)(F)F ZINC000462726534 339084934 /nfs/dbraw/zinc/08/49/34/339084934.db2.gz RBQYACWCGPWOQD-UHFFFAOYSA-N 0 0 319.326 5.225 20 0 DKADRN CCCOc1cccc(CNc2ccc(CC(F)(F)F)cc2)c1 ZINC000462727624 333096532 /nfs/dbraw/zinc/09/65/32/333096532.db2.gz FXCPTNRXRJCLNK-UHFFFAOYSA-N 0 0 323.358 5.192 20 0 DKADRN Cc1cc(C(=O)Nc2cccc(C3CCC3)c2)c(C(F)(F)F)o1 ZINC000462728356 333097217 /nfs/dbraw/zinc/09/72/17/333097217.db2.gz STNQZDLLXMDJNW-UHFFFAOYSA-N 0 0 323.314 5.127 20 0 DKADRN FC(F)(F)Cc1ccc(NCc2csc3ccccc23)cc1 ZINC000462728482 339085129 /nfs/dbraw/zinc/08/51/29/339085129.db2.gz JTQFDIORODQUPD-UHFFFAOYSA-N 0 0 321.367 5.618 20 0 DKADRN CC(C)CCn1cccc1CNc1ccc(CC(F)(F)F)cc1 ZINC000462730431 333097238 /nfs/dbraw/zinc/09/72/38/333097238.db2.gz WCQSCVMBSPLMSR-UHFFFAOYSA-N 0 0 324.390 5.251 20 0 DKADRN CC(C)Oc1ccc(CNc2ccc(CC(F)(F)F)cc2)cc1 ZINC000462731469 339085226 /nfs/dbraw/zinc/08/52/26/339085226.db2.gz NXTRVEBELAWIEA-UHFFFAOYSA-N 0 0 323.358 5.191 20 0 DKADRN Cc1ccc(C[NH2+][C@H](c2ccc(Cl)cc2)[C@H]2C[C@@H]2C)s1 ZINC000462737675 333102771 /nfs/dbraw/zinc/10/27/71/333102771.db2.gz JWWMEYKPLHCRHM-MZPVMMEZSA-N 0 0 305.874 5.197 20 0 DKADRN Cc1ccc(C[NH2+][C@H](c2ccc(Cl)cc2)[C@@H]2C[C@H]2C)s1 ZINC000462737676 333102641 /nfs/dbraw/zinc/10/26/41/333102641.db2.gz JWWMEYKPLHCRHM-SSKCKEOISA-N 0 0 305.874 5.197 20 0 DKADRN Cc1ccc(C[NH2+][C@H](c2ccc(Cl)cc2)[C@@H]2C[C@@H]2C)s1 ZINC000462737677 333102791 /nfs/dbraw/zinc/10/27/91/333102791.db2.gz JWWMEYKPLHCRHM-YMRXKLBXSA-N 0 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20 0 DKADRN Cc1nc([C@H](C)N[C@H](c2ccccc2F)C2CCCC2)cs1 ZINC000462818517 339091634 /nfs/dbraw/zinc/09/16/34/339091634.db2.gz RBNXQRDZJUWXRG-SGTLLEGYSA-N 0 0 318.461 5.173 20 0 DKADRN Cc1nc([C@@H](C)N[C@H](c2ccccc2F)C2CCCC2)cs1 ZINC000462818518 339091698 /nfs/dbraw/zinc/09/16/98/339091698.db2.gz RBNXQRDZJUWXRG-XIKOKIGWSA-N 0 0 318.461 5.173 20 0 DKADRN FC(F)(F)[C@@H](NCc1ccc2sccc2c1)c1ccccc1 ZINC000462819505 339091758 /nfs/dbraw/zinc/09/17/58/339091758.db2.gz TXCFMCHCCSZVDH-INIZCTEOSA-N 0 0 321.367 5.295 20 0 DKADRN FC(F)(F)[C@H](NCc1ccc2sccc2c1)c1ccccc1 ZINC000462819506 339091812 /nfs/dbraw/zinc/09/18/12/339091812.db2.gz TXCFMCHCCSZVDH-MRXNPFEDSA-N 0 0 321.367 5.295 20 0 DKADRN Cc1nc([C@H](C)N[C@@H](c2cccc(F)c2)C2CCCC2)cs1 ZINC000462819523 339091871 /nfs/dbraw/zinc/09/18/71/339091871.db2.gz UELXJABSRYJXLC-KPZWWZAWSA-N 0 0 318.461 5.173 20 0 DKADRN Cc1nc([C@@H](C)N[C@@H](c2cccc(F)c2)C2CCCC2)cs1 ZINC000462819524 339091877 /nfs/dbraw/zinc/09/18/77/339091877.db2.gz 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Cc1ccccc1NC(=O)C[C@@H](C)Nc1cccc(C2CCC2)c1 ZINC000462877993 339095952 /nfs/dbraw/zinc/09/59/52/339095952.db2.gz KBBJXROLGGIHGD-MRXNPFEDSA-N 0 0 322.452 5.092 20 0 DKADRN CCCCN(C)C(=O)Nc1c(C)cc(Cl)c2ccccc21 ZINC000462879002 339095998 /nfs/dbraw/zinc/09/59/98/339095998.db2.gz VYCWMMVADOTJLA-UHFFFAOYSA-N 0 0 304.821 5.065 20 0 DKADRN c1csc(-c2n[nH]cc2CNc2cccc(C3CCC3)c2)c1 ZINC000462880049 339096003 /nfs/dbraw/zinc/09/60/03/339096003.db2.gz VBEBGSIIBFQLQT-UHFFFAOYSA-N 0 0 309.438 5.018 20 0 DKADRN C[C@H](Nc1nccc2occc21)c1ccccc1C(F)(F)F ZINC000462890053 339096365 /nfs/dbraw/zinc/09/63/65/339096365.db2.gz AMFIGDKLLNBWDF-JTQLQIEISA-N 0 0 306.287 5.020 20 0 DKADRN C[C@@H](Nc1nccc2occc21)c1ccccc1C(F)(F)F ZINC000462890055 339096327 /nfs/dbraw/zinc/09/63/27/339096327.db2.gz AMFIGDKLLNBWDF-SNVBAGLBSA-N 0 0 306.287 5.020 20 0 DKADRN Cc1nccc(N[C@H](c2cccs2)c2ccc(C(C)C)cc2)n1 ZINC000462921670 339098090 /nfs/dbraw/zinc/09/80/90/339098090.db2.gz CSDUXEWXCPIJRN-IBGZPJMESA-N 0 0 323.465 5.171 20 0 DKADRN Cc1nccc(N[C@@H](c2cccs2)c2ccc(C(C)C)cc2)n1 ZINC000462921671 339098136 /nfs/dbraw/zinc/09/81/36/339098136.db2.gz CSDUXEWXCPIJRN-LJQANCHMSA-N 0 0 323.465 5.171 20 0 DKADRN CCCc1ccc([C@H](Nc2ccnc(C)n2)c2cccs2)cc1 ZINC000462923365 339098154 /nfs/dbraw/zinc/09/81/54/339098154.db2.gz BILCFQKAXBCPNG-IBGZPJMESA-N 0 0 323.465 5.001 20 0 DKADRN CCCc1ccc([C@@H](Nc2ccnc(C)n2)c2cccs2)cc1 ZINC000462923366 339098157 /nfs/dbraw/zinc/09/81/57/339098157.db2.gz BILCFQKAXBCPNG-LJQANCHMSA-N 0 0 323.465 5.001 20 0 DKADRN C[C@H](Nc1nccc2occc21)c1cccc(C(F)(F)F)c1 ZINC000462928323 339098245 /nfs/dbraw/zinc/09/82/45/339098245.db2.gz JDQYVEYEBKWDEP-JTQLQIEISA-N 0 0 306.287 5.020 20 0 DKADRN C[C@@H](Nc1nccc2occc21)c1cccc(C(F)(F)F)c1 ZINC000462928326 339098227 /nfs/dbraw/zinc/09/82/27/339098227.db2.gz JDQYVEYEBKWDEP-SNVBAGLBSA-N 0 0 306.287 5.020 20 0 DKADRN C[C@@H](Nc1nccc2occc21)c1ccc(C(F)(F)F)cc1 ZINC000462932371 339098366 /nfs/dbraw/zinc/09/83/66/339098366.db2.gz RWGLUTKAAFUXHQ-SNVBAGLBSA-N 0 0 306.287 5.020 20 0 DKADRN CC(C)C[C@H](C)C(=O)N1CCC[C@H]1c1cccc2ccccc21 ZINC000462936519 339098385 /nfs/dbraw/zinc/09/83/85/339098385.db2.gz RAQNBPODXQEYLI-JXFKEZNVSA-N 0 0 309.453 5.186 20 0 DKADRN CC(C)C[C@H](C)C(=O)N1CCC[C@@H]1c1cccc2ccccc21 ZINC000462936520 339098435 /nfs/dbraw/zinc/09/84/35/339098435.db2.gz RAQNBPODXQEYLI-OXJNMPFZSA-N 0 0 309.453 5.186 20 0 DKADRN CC(C)C[C@@H](C)C(=O)N1CCC[C@@H]1c1cccc2ccccc21 ZINC000462936521 339098315 /nfs/dbraw/zinc/09/83/15/339098315.db2.gz RAQNBPODXQEYLI-OXQOHEQNSA-N 0 0 309.453 5.186 20 0 DKADRN CC(C)C[C@@H](C)C(=O)N1CCC[C@H]1c1cccc2ccccc21 ZINC000462936522 339098404 /nfs/dbraw/zinc/09/84/04/339098404.db2.gz RAQNBPODXQEYLI-UZLBHIALSA-N 0 0 309.453 5.186 20 0 DKADRN Cc1c([C@H](C)Nc2cccc(C3CCC3)c2)cnn1C(C)(C)C ZINC000462938339 339098467 /nfs/dbraw/zinc/09/84/67/339098467.db2.gz CCLVLZUSSUQRGY-AWEZNQCLSA-N 0 0 311.473 5.387 20 0 DKADRN Cc1c([C@@H](C)Nc2cccc(C3CCC3)c2)cnn1C(C)(C)C ZINC000462938340 339098449 /nfs/dbraw/zinc/09/84/49/339098449.db2.gz CCLVLZUSSUQRGY-CQSZACIVSA-N 0 0 311.473 5.387 20 0 DKADRN C[C@H](Nc1cccc(C2CCC2)c1)c1cnn(C2CCCC2)c1 ZINC000462941486 339098443 /nfs/dbraw/zinc/09/84/43/339098443.db2.gz RBHZVEUJBMMECY-HNNXBMFYSA-N 0 0 309.457 5.439 20 0 DKADRN C[C@@H](Nc1cccc(C2CCC2)c1)c1cnn(C2CCCC2)c1 ZINC000462941493 339098564 /nfs/dbraw/zinc/09/85/64/339098564.db2.gz RBHZVEUJBMMECY-OAHLLOKOSA-N 0 0 309.457 5.439 20 0 DKADRN CC(=O)Nc1ccc([C@H](C)Nc2cccc(C3CCC3)c2)cc1 ZINC000462942952 339098588 /nfs/dbraw/zinc/09/85/88/339098588.db2.gz KWCMBJIOOCDIJY-AWEZNQCLSA-N 0 0 308.425 5.086 20 0 DKADRN CC(=O)Nc1ccc([C@@H](C)Nc2cccc(C3CCC3)c2)cc1 ZINC000462942954 339098587 /nfs/dbraw/zinc/09/85/87/339098587.db2.gz KWCMBJIOOCDIJY-CQSZACIVSA-N 0 0 308.425 5.086 20 0 DKADRN Cc1ccc(Cl)cc1Oc1nc(C(F)F)nc2ccccc21 ZINC000462943099 339098710 /nfs/dbraw/zinc/09/87/10/339098710.db2.gz MPVMKYHENBKIGW-UHFFFAOYSA-N 0 0 320.726 5.322 20 0 DKADRN c1ccc([C@@H](Nc2cccc(C3CCC3)c2)c2ccccn2)cc1 ZINC000462949083 339098847 /nfs/dbraw/zinc/09/88/47/339098847.db2.gz PBWHNHJJCJDWPR-JOCHJYFZSA-N 0 0 314.432 5.551 20 0 DKADRN c1ccc([C@H](Nc2cccc(C3CCC3)c2)c2ccccn2)cc1 ZINC000462949084 339098732 /nfs/dbraw/zinc/09/87/32/339098732.db2.gz PBWHNHJJCJDWPR-QFIPXVFZSA-N 0 0 314.432 5.551 20 0 DKADRN C[C@H](Nc1cccc(C2CCC2)c1)c1nc2ccccc2n1C ZINC000462950500 339098878 /nfs/dbraw/zinc/09/88/78/339098878.db2.gz XXRZCVHPUJXDLS-AWEZNQCLSA-N 0 0 305.425 5.014 20 0 DKADRN C[C@@H](Nc1cccc(C2CCC2)c1)c1nc2ccccc2n1C ZINC000462950501 339098871 /nfs/dbraw/zinc/09/88/71/339098871.db2.gz XXRZCVHPUJXDLS-CQSZACIVSA-N 0 0 305.425 5.014 20 0 DKADRN Fc1ccc([C@H](Nc2cccc(C3CCC3)c2)c2ncc[nH]2)cc1 ZINC000462953310 339098995 /nfs/dbraw/zinc/09/89/95/339098995.db2.gz WSSJFNNAQKXMQP-IBGZPJMESA-N 0 0 321.399 5.018 20 0 DKADRN Fc1ccc([C@@H](Nc2cccc(C3CCC3)c2)c2ncc[nH]2)cc1 ZINC000462953312 339099002 /nfs/dbraw/zinc/09/90/02/339099002.db2.gz WSSJFNNAQKXMQP-LJQANCHMSA-N 0 0 321.399 5.018 20 0 DKADRN CC(C)c1ccc(NCc2cn(C)nc2C(F)F)c(C(C)C)c1 ZINC000462961069 339099209 /nfs/dbraw/zinc/09/92/09/339099209.db2.gz CSIYVPVTERUSLJ-UHFFFAOYSA-N 0 0 321.415 5.217 20 0 DKADRN CCC(C)(C)CC[S@@](=O)Cc1cc(Cl)ccc1Cl ZINC000462983593 339099581 /nfs/dbraw/zinc/09/95/81/339099581.db2.gz AMVWQHSUZFLXJA-GOSISDBHSA-N 0 0 307.286 5.068 20 0 DKADRN CCC(C)(C)CC[S@](=O)Cc1cc(Cl)ccc1Cl ZINC000462983594 339099643 /nfs/dbraw/zinc/09/96/43/339099643.db2.gz AMVWQHSUZFLXJA-SFHVURJKSA-N 0 0 307.286 5.068 20 0 DKADRN Cc1cccc([C@H](C)[S@@](=O)Cc2ccc(C(C)(C)C)cc2)c1 ZINC000462985943 339099697 /nfs/dbraw/zinc/09/96/97/339099697.db2.gz FFHOIVSWSDCWTO-AOMKIAJQSA-N 0 0 314.494 5.302 20 0 DKADRN Cc1cccc([C@H](C)[S@](=O)Cc2ccc(C(C)(C)C)cc2)c1 ZINC000462985962 339099729 /nfs/dbraw/zinc/09/97/29/339099729.db2.gz FFHOIVSWSDCWTO-KSFYIVLOSA-N 0 0 314.494 5.302 20 0 DKADRN Cc1cccc([C@@H](C)[S@](=O)Cc2ccc(C(C)(C)C)cc2)c1 ZINC000462985965 339099683 /nfs/dbraw/zinc/09/96/83/339099683.db2.gz FFHOIVSWSDCWTO-OPAMFIHVSA-N 0 0 314.494 5.302 20 0 DKADRN Cc1cccc([C@@H](C)[S@@](=O)Cc2ccc(C(C)(C)C)cc2)c1 ZINC000462985967 339099733 /nfs/dbraw/zinc/09/97/33/339099733.db2.gz FFHOIVSWSDCWTO-ZHRRBRCNSA-N 0 0 314.494 5.302 20 0 DKADRN CC[C@@H](c1ccccc1)[S@](=O)CCCc1ccc(Cl)cc1 ZINC000462986497 339099708 /nfs/dbraw/zinc/09/97/08/339099708.db2.gz GRXPFZYHPREXDY-GHTZIAJQSA-N 0 0 320.885 5.173 20 0 DKADRN CC[C@H](c1ccccc1)[S@@](=O)CCCc1ccc(Cl)cc1 ZINC000462986498 333136170 /nfs/dbraw/zinc/13/61/70/333136170.db2.gz GRXPFZYHPREXDY-NQIIRXRSSA-N 0 0 320.885 5.173 20 0 DKADRN CC[C@@H](c1ccccc1)[S@@](=O)CCCc1ccc(Cl)cc1 ZINC000462986499 333136194 /nfs/dbraw/zinc/13/61/94/333136194.db2.gz GRXPFZYHPREXDY-RXVVDRJESA-N 0 0 320.885 5.173 20 0 DKADRN CC[C@H](c1ccccc1)[S@](=O)CCCc1ccc(Cl)cc1 ZINC000462986500 333136183 /nfs/dbraw/zinc/13/61/83/333136183.db2.gz GRXPFZYHPREXDY-WIYYLYMNSA-N 0 0 320.885 5.173 20 0 DKADRN Cc1cccc([C@H](C)[S@@](=O)Cc2cccc3ccccc32)c1 ZINC000462987826 339099667 /nfs/dbraw/zinc/09/96/67/339099667.db2.gz IPGUNLCIPDJMEO-AOMKIAJQSA-N 0 0 308.446 5.158 20 0 DKADRN Cc1cccc([C@H](C)[S@](=O)Cc2cccc3ccccc32)c1 ZINC000462987827 339099724 /nfs/dbraw/zinc/09/97/24/339099724.db2.gz IPGUNLCIPDJMEO-KSFYIVLOSA-N 0 0 308.446 5.158 20 0 DKADRN Cc1cccc([C@@H](C)[S@](=O)Cc2cccc3ccccc32)c1 ZINC000462987828 339099688 /nfs/dbraw/zinc/09/96/88/339099688.db2.gz IPGUNLCIPDJMEO-OPAMFIHVSA-N 0 0 308.446 5.158 20 0 DKADRN Cc1cccc([C@@H](C)[S@@](=O)Cc2cccc3ccccc32)c1 ZINC000462987829 339099657 /nfs/dbraw/zinc/09/96/57/339099657.db2.gz IPGUNLCIPDJMEO-ZHRRBRCNSA-N 0 0 308.446 5.158 20 0 DKADRN CC[C@H](c1ccccc1)[S@](=O)Cc1ccc(C(C)(C)C)cc1 ZINC000462987878 339099661 /nfs/dbraw/zinc/09/96/61/339099661.db2.gz MXNDLJHXUHPWRE-DENIHFKCSA-N 0 0 314.494 5.384 20 0 DKADRN CC[C@H](c1ccccc1)[S@@](=O)Cc1ccc(C(C)(C)C)cc1 ZINC000462987879 339099774 /nfs/dbraw/zinc/09/97/74/339099774.db2.gz MXNDLJHXUHPWRE-KNQAVFIVSA-N 0 0 314.494 5.384 20 0 DKADRN CC[C@@H](c1ccccc1)[S@](=O)Cc1ccc(C(C)(C)C)cc1 ZINC000462987880 339099796 /nfs/dbraw/zinc/09/97/96/339099796.db2.gz MXNDLJHXUHPWRE-SIKLNZKXSA-N 0 0 314.494 5.384 20 0 DKADRN CC[C@@H](c1ccccc1)[S@@](=O)Cc1ccc(C(C)(C)C)cc1 ZINC000462987881 339099776 /nfs/dbraw/zinc/09/97/76/339099776.db2.gz MXNDLJHXUHPWRE-UGKGYDQZSA-N 0 0 314.494 5.384 20 0 DKADRN CC[C@H](c1ccccc1)[S@](=O)Cc1cccc2ccccc21 ZINC000462989427 339099793 /nfs/dbraw/zinc/09/97/93/339099793.db2.gz KUCQWLRZXRVFBA-IFMALSPDSA-N 0 0 308.446 5.240 20 0 DKADRN CC[C@H](c1ccccc1)[S@@](=O)Cc1cccc2ccccc21 ZINC000462989440 339099855 /nfs/dbraw/zinc/09/98/55/339099855.db2.gz KUCQWLRZXRVFBA-IRLDBZIGSA-N 0 0 308.446 5.240 20 0 DKADRN CC[C@@H](c1ccccc1)[S@](=O)Cc1cccc2ccccc21 ZINC000462989442 339099771 /nfs/dbraw/zinc/09/97/71/339099771.db2.gz KUCQWLRZXRVFBA-RBBKRZOGSA-N 0 0 308.446 5.240 20 0 DKADRN CC[C@@H](c1ccccc1)[S@@](=O)Cc1cccc2ccccc21 ZINC000462989443 339099759 /nfs/dbraw/zinc/09/97/59/339099759.db2.gz KUCQWLRZXRVFBA-UNMCSNQZSA-N 0 0 308.446 5.240 20 0 DKADRN Cc1cccc([C@H](C)[S@](=O)Cc2ccc(C(C)C)cc2)c1 ZINC000462993051 339099845 /nfs/dbraw/zinc/09/98/45/339099845.db2.gz XJENBCNVOJMASZ-HRAATJIYSA-N 0 0 300.467 5.128 20 0 DKADRN Cc1cccc([C@@H](C)[S@@](=O)Cc2ccc(C(C)C)cc2)c1 ZINC000462993052 339099789 /nfs/dbraw/zinc/09/97/89/339099789.db2.gz XJENBCNVOJMASZ-IERDGZPVSA-N 0 0 300.467 5.128 20 0 DKADRN Cc1cccc([C@@H](C)[S@](=O)Cc2ccc(C(C)C)cc2)c1 ZINC000462993053 339099756 /nfs/dbraw/zinc/09/97/56/339099756.db2.gz XJENBCNVOJMASZ-IIBYNOLFSA-N 0 0 300.467 5.128 20 0 DKADRN Cc1cccc([C@H](C)[S@@](=O)Cc2ccc(C(C)C)cc2)c1 ZINC000462993054 339099828 /nfs/dbraw/zinc/09/98/28/339099828.db2.gz XJENBCNVOJMASZ-KKSFZXQISA-N 0 0 300.467 5.128 20 0 DKADRN CC[C@H](c1ccccc1)[S@@](=O)Cc1c(C)cc(C)cc1C ZINC000462994314 339099902 /nfs/dbraw/zinc/09/99/02/339099902.db2.gz RANHIKJRCXRVRC-CTNGQTDRSA-N 0 0 300.467 5.012 20 0 DKADRN CC[C@@H](c1ccccc1)[S@@](=O)Cc1c(C)cc(C)cc1C ZINC000462994318 339099934 /nfs/dbraw/zinc/09/99/34/339099934.db2.gz RANHIKJRCXRVRC-FPOVZHCZSA-N 0 0 300.467 5.012 20 0 DKADRN CC[C@@H](c1ccccc1)[S@](=O)Cc1c(C)cc(C)cc1C ZINC000462994320 339099946 /nfs/dbraw/zinc/09/99/46/339099946.db2.gz RANHIKJRCXRVRC-PZJWPPBQSA-N 0 0 300.467 5.012 20 0 DKADRN CC[C@H](c1ccccc1)[S@](=O)Cc1c(C)cc(C)cc1C ZINC000462994324 339099874 /nfs/dbraw/zinc/09/98/74/339099874.db2.gz RANHIKJRCXRVRC-TZIWHRDSSA-N 0 0 300.467 5.012 20 0 DKADRN CC[C@H](c1ccccc1)[S@@](=O)Cc1ccc(C(C)C)cc1 ZINC000462994748 339099896 /nfs/dbraw/zinc/09/98/96/339099896.db2.gz ZWNHOIXRALEDGQ-CTNGQTDRSA-N 0 0 300.467 5.210 20 0 DKADRN CC[C@@H](c1ccccc1)[S@@](=O)Cc1ccc(C(C)C)cc1 ZINC000462994749 339099864 /nfs/dbraw/zinc/09/98/64/339099864.db2.gz ZWNHOIXRALEDGQ-FPOVZHCZSA-N 0 0 300.467 5.210 20 0 DKADRN CC[C@@H](c1ccccc1)[S@](=O)Cc1ccc(C(C)C)cc1 ZINC000462994750 339099878 /nfs/dbraw/zinc/09/98/78/339099878.db2.gz ZWNHOIXRALEDGQ-PZJWPPBQSA-N 0 0 300.467 5.210 20 0 DKADRN CC[C@H](c1ccccc1)[S@](=O)Cc1ccc(C(C)C)cc1 ZINC000462994751 339099954 /nfs/dbraw/zinc/09/99/54/339099954.db2.gz ZWNHOIXRALEDGQ-TZIWHRDSSA-N 0 0 300.467 5.210 20 0 DKADRN CCC(C)(C)CC[S@@](=O)Cc1ccc(Cl)cc1Cl ZINC000463001607 339099994 /nfs/dbraw/zinc/09/99/94/339099994.db2.gz ISYJTQQSYSDTNI-GOSISDBHSA-N 0 0 307.286 5.068 20 0 DKADRN CCC(C)(C)CC[S@](=O)Cc1ccc(Cl)cc1Cl ZINC000463001608 339099961 /nfs/dbraw/zinc/09/99/61/339099961.db2.gz ISYJTQQSYSDTNI-SFHVURJKSA-N 0 0 307.286 5.068 20 0 DKADRN Cc1cccc([C@H](C)[S@@](=O)CCCc2ccc(Cl)cc2)c1 ZINC000463003769 339100091 /nfs/dbraw/zinc/10/00/91/339100091.db2.gz ZIALKXFBAIETSD-BTYIYWSLSA-N 0 0 320.885 5.091 20 0 DKADRN Cc1cccc([C@@H](C)[S@](=O)CCCc2ccc(Cl)cc2)c1 ZINC000463003770 339100099 /nfs/dbraw/zinc/10/00/99/339100099.db2.gz ZIALKXFBAIETSD-QVKFZJNVSA-N 0 0 320.885 5.091 20 0 DKADRN Cc1cccc([C@@H](C)[S@@](=O)CCCc2ccc(Cl)cc2)c1 ZINC000463003771 339100097 /nfs/dbraw/zinc/10/00/97/339100097.db2.gz ZIALKXFBAIETSD-VFNWGFHPSA-N 0 0 320.885 5.091 20 0 DKADRN Cc1cccc([C@H](C)[S@](=O)CCCc2ccc(Cl)cc2)c1 ZINC000463003772 339100151 /nfs/dbraw/zinc/10/01/51/339100151.db2.gz ZIALKXFBAIETSD-YCRPNKLZSA-N 0 0 320.885 5.091 20 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Cc1ccc(-c2cnc(CSc3nc4ccccc4o3)o2)cc1 ZINC000463030525 339101603 /nfs/dbraw/zinc/10/16/03/339101603.db2.gz WDQMYXAIKJWYMN-UHFFFAOYSA-N 0 0 322.389 5.084 20 0 DKADRN Cc1ccc(-c2nnc(S[C@@H](C)c3cccc(C)c3)o2)cc1 ZINC000463031879 339101909 /nfs/dbraw/zinc/10/19/09/339101909.db2.gz HTDDLBRMAYFWDT-AWEZNQCLSA-N 0 0 310.422 5.207 20 0 DKADRN Cc1ccc(-c2nnc(S[C@H](C)c3cccc(C)c3)o2)cc1 ZINC000463031883 339101792 /nfs/dbraw/zinc/10/17/92/339101792.db2.gz HTDDLBRMAYFWDT-CQSZACIVSA-N 0 0 310.422 5.207 20 0 DKADRN COCc1nc(CSc2cc(C(C)(C)C)ccc2C)cs1 ZINC000463033154 339101928 /nfs/dbraw/zinc/10/19/28/339101928.db2.gz IZMZYDJYFKGQBJ-UHFFFAOYSA-N 0 0 321.511 5.188 20 0 DKADRN CCC(C)(C)CCSc1nnc(-c2c[nH]c3ccccc32)o1 ZINC000463033990 339102179 /nfs/dbraw/zinc/10/21/79/339102179.db2.gz DPGROHLZQYCIQY-UHFFFAOYSA-N 0 0 315.442 5.136 20 0 DKADRN CCC(C)(C)CCSc1nnc(C[C@H](C)c2ccccc2)o1 ZINC000463035612 339102067 /nfs/dbraw/zinc/10/20/67/339102067.db2.gz HJLBZTIWEZXBNV-AWEZNQCLSA-N 0 0 318.486 5.334 20 0 DKADRN 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Cc1cccc([C@@H](C)[S@](=O)c2ccc(Cl)c(Cl)c2)c1 ZINC000463700729 339124125 /nfs/dbraw/zinc/12/41/25/339124125.db2.gz JFXZNCDATCSCGB-WYRIXSBYSA-N 0 0 313.249 5.171 20 0 DKADRN CCCCN(C(=O)CCC(F)(F)F)[C@@H](CC)c1ccccc1 ZINC000463716075 339124467 /nfs/dbraw/zinc/12/44/67/339124467.db2.gz JVMFCEBJFWIPOX-HNNXBMFYSA-N 0 0 315.379 5.109 20 0 DKADRN CCCCN(C(=O)CCC(F)(F)F)[C@H](CC)c1ccccc1 ZINC000463716076 339124411 /nfs/dbraw/zinc/12/44/11/339124411.db2.gz JVMFCEBJFWIPOX-OAHLLOKOSA-N 0 0 315.379 5.109 20 0 DKADRN O=C(Nc1cccc2[nH]ccc21)c1cscc1-c1ccccc1 ZINC000463716472 339124475 /nfs/dbraw/zinc/12/44/75/339124475.db2.gz CVLAYGKXCPLZKH-UHFFFAOYSA-N 0 0 318.401 5.149 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)N1CC(C)(CC)C1 ZINC000463725778 339124788 /nfs/dbraw/zinc/12/47/88/339124788.db2.gz FBIOXFGCJGXULU-UHFFFAOYSA-N 0 0 302.462 5.026 20 0 DKADRN Cc1ccc([C@@H]2CCCN2C(=O)CCCC2CCCC2)s1 ZINC000463726636 339124780 /nfs/dbraw/zinc/12/47/80/339124780.db2.gz MEGDBMOSWIUDPX-INIZCTEOSA-N 0 0 305.487 5.081 20 0 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/nfs/dbraw/zinc/12/74/60/339127460.db2.gz GMCMOODMGIPHPS-FQEVSTJZSA-N 0 0 320.436 5.323 20 0 DKADRN O=C(Nc1cccc(C2CCC2)c1)N1CCC[C@@H]1c1ccccc1 ZINC000463853214 339127503 /nfs/dbraw/zinc/12/75/03/339127503.db2.gz GMCMOODMGIPHPS-HXUWFJFHSA-N 0 0 320.436 5.323 20 0 DKADRN O=C(CCCC1CCCC1)N1CC[C@H](c2ccc(Cl)cc2)C1 ZINC000463854166 339127511 /nfs/dbraw/zinc/12/75/11/339127511.db2.gz HTHADADDXUCSCP-KRWDZBQOSA-N 0 0 319.876 5.016 20 0 DKADRN O=C(CCCC1CCCC1)N1CC[C@@H](c2ccc(Cl)cc2)C1 ZINC000463854167 339127467 /nfs/dbraw/zinc/12/74/67/339127467.db2.gz HTHADADDXUCSCP-QGZVFWFLSA-N 0 0 319.876 5.016 20 0 DKADRN Cc1cccc(COc2ccc(NC(=O)CC3CCC3)c(C)c2)c1 ZINC000463874462 339127704 /nfs/dbraw/zinc/12/77/04/339127704.db2.gz VDDXPQIDWBYFOQ-UHFFFAOYSA-N 0 0 323.436 5.011 20 0 DKADRN CC(C)N(C(=O)C1CCC(c2ccccc2)CC1)C1CCCC1 ZINC000463881156 339127947 /nfs/dbraw/zinc/12/79/47/339127947.db2.gz TXJBJSMWOJGRSM-UHFFFAOYSA-N 0 0 313.485 5.140 20 0 DKADRN CC[C@@H](C)[C@H](C)N(C(=O)c1cc2cc(C)c(C)cc2o1)C1CC1 ZINC000463889764 339128022 /nfs/dbraw/zinc/12/80/22/339128022.db2.gz PPHMUUXCGLAXRF-DOMZBBRYSA-N 0 0 313.441 5.089 20 0 DKADRN CC[C@@H](C)[C@@H](C)N(C(=O)c1cc2cc(C)c(C)cc2o1)C1CC1 ZINC000463889765 339128035 /nfs/dbraw/zinc/12/80/35/339128035.db2.gz PPHMUUXCGLAXRF-IUODEOHRSA-N 0 0 313.441 5.089 20 0 DKADRN CC[C@H](C)[C@@H](C)N(C(=O)c1cc2cc(C)c(C)cc2o1)C1CC1 ZINC000463889766 339128011 /nfs/dbraw/zinc/12/80/11/339128011.db2.gz PPHMUUXCGLAXRF-SWLSCSKDSA-N 0 0 313.441 5.089 20 0 DKADRN CC[C@H](C)[C@H](C)N(C(=O)c1cc2cc(C)c(C)cc2o1)C1CC1 ZINC000463889767 339127996 /nfs/dbraw/zinc/12/79/96/339127996.db2.gz PPHMUUXCGLAXRF-WFASDCNBSA-N 0 0 313.441 5.089 20 0 DKADRN COc1ccccc1-c1ccc(-c2nc3cnccc3s2)cc1 ZINC000463923264 339129133 /nfs/dbraw/zinc/12/91/33/339129133.db2.gz XPIVLOPHLKINFG-UHFFFAOYSA-N 0 0 318.401 5.034 20 0 DKADRN CCC(CC)C(=O)Nc1ccc(F)cc1-c1ccc(F)cc1 ZINC000463941896 339129528 /nfs/dbraw/zinc/12/95/28/339129528.db2.gz BRDKWJOJQBGBGZ-UHFFFAOYSA-N 0 0 303.352 5.007 20 0 DKADRN O=C(Nc1c(F)cc(F)cc1F)c1ccc(C2CCCC2)cc1 ZINC000463953784 339129953 /nfs/dbraw/zinc/12/99/53/339129953.db2.gz ITDNRSLTGRDIBP-UHFFFAOYSA-N 0 0 319.326 5.014 20 0 DKADRN Cc1cccc(Cl)c1NC(=O)CCCc1ccccc1Cl ZINC000463956951 339130041 /nfs/dbraw/zinc/13/00/41/339130041.db2.gz DOKQMONIUMCWAP-UHFFFAOYSA-N 0 0 322.235 5.263 20 0 DKADRN Cc1cccc(Cl)c1NC(=O)c1ccc(C2=CCCC2)cc1 ZINC000463957352 339130018 /nfs/dbraw/zinc/13/00/18/339130018.db2.gz HFGZCKGUDXIGPB-UHFFFAOYSA-N 0 0 311.812 5.468 20 0 DKADRN Cc1ccc2sc(C(=O)Nc3c(C)cccc3Cl)cc2c1 ZINC000463957897 339130062 /nfs/dbraw/zinc/13/00/62/339130062.db2.gz KRMIMWUMBRZKEZ-UHFFFAOYSA-N 0 0 315.825 5.424 20 0 DKADRN Cc1cccc([C@@H]2CCCCN2C(=O)Nc2ccccc2)c1C ZINC000463960797 339130263 /nfs/dbraw/zinc/13/02/63/339130263.db2.gz KRHSBSMRQCXDKK-IBGZPJMESA-N 0 0 308.425 5.063 20 0 DKADRN Cc1cccc([C@H]2CCCCN2C(=O)Nc2ccccc2)c1C ZINC000463960798 339130264 /nfs/dbraw/zinc/13/02/64/339130264.db2.gz KRHSBSMRQCXDKK-LJQANCHMSA-N 0 0 308.425 5.063 20 0 DKADRN O=C(CCCC1CCCC1)Nc1ccccc1CC(F)(F)F ZINC000463995793 339130836 /nfs/dbraw/zinc/13/08/36/339130836.db2.gz LKCCYKPBMRFZAC-UHFFFAOYSA-N 0 0 313.363 5.090 20 0 DKADRN C[C@@H]1C[C@@H](c2cccc(F)c2)N(C(=O)CCCC2CCCC2)C1 ZINC000464007888 339131042 /nfs/dbraw/zinc/13/10/42/339131042.db2.gz RDDFSKMKYQIOPP-BEFAXECRSA-N 0 0 317.448 5.096 20 0 DKADRN C[C@@H]1C[C@H](c2cccc(F)c2)N(C(=O)CCCC2CCCC2)C1 ZINC000464007889 339131109 /nfs/dbraw/zinc/13/11/09/339131109.db2.gz RDDFSKMKYQIOPP-DNVCBOLYSA-N 0 0 317.448 5.096 20 0 DKADRN C[C@H]1C[C@H](c2cccc(F)c2)N(C(=O)CCCC2CCCC2)C1 ZINC000464007890 339131066 /nfs/dbraw/zinc/13/10/66/339131066.db2.gz RDDFSKMKYQIOPP-HNAYVOBHSA-N 0 0 317.448 5.096 20 0 DKADRN C[C@H]1C[C@@H](c2cccc(F)c2)N(C(=O)CCCC2CCCC2)C1 ZINC000464007891 339131071 /nfs/dbraw/zinc/13/10/71/339131071.db2.gz RDDFSKMKYQIOPP-KXBFYZLASA-N 0 0 317.448 5.096 20 0 DKADRN Cc1ccc([C@H]2CCCCCN2C(=O)CCCC2CCCC2)o1 ZINC000464084535 339133665 /nfs/dbraw/zinc/13/36/65/339133665.db2.gz ZNFGAUYMUUYWOF-GOSISDBHSA-N 0 0 317.473 5.392 20 0 DKADRN Cc1ccc([C@@H]2CCCCCN2C(=O)CCCC2CCCC2)o1 ZINC000464084536 339133748 /nfs/dbraw/zinc/13/37/48/339133748.db2.gz ZNFGAUYMUUYWOF-SFHVURJKSA-N 0 0 317.473 5.392 20 0 DKADRN Cc1c(F)cccc1NC(=O)c1cscc1-c1ccccc1 ZINC000464096802 339134393 /nfs/dbraw/zinc/13/43/93/339134393.db2.gz BUYCJXURDOGALA-UHFFFAOYSA-N 0 0 311.381 5.115 20 0 DKADRN CCC(CC)C(=O)Nc1ccccc1-c1cc(F)c(F)c(F)c1 ZINC000464100259 339134508 /nfs/dbraw/zinc/13/45/08/339134508.db2.gz HTONYIRZRGTOOK-UHFFFAOYSA-N 0 0 321.342 5.146 20 0 DKADRN CCc1ccsc1C(=O)Nc1ccccc1SC(C)C ZINC000464132712 339134794 /nfs/dbraw/zinc/13/47/94/339134794.db2.gz CPNPUQWSOPBUJH-UHFFFAOYSA-N 0 0 305.468 5.063 20 0 DKADRN CC(C)c1ccc(C(=O)Nc2cc(C(F)F)ccc2Cl)nc1 ZINC000464133757 339134920 /nfs/dbraw/zinc/13/49/20/339134920.db2.gz TWTNCKSOHAISRA-UHFFFAOYSA-N 0 0 324.758 5.048 20 0 DKADRN CCCCCC(=O)Nc1ccc(Oc2ccc(Cl)cn2)cc1 ZINC000464169272 339135800 /nfs/dbraw/zinc/13/58/00/339135800.db2.gz KFOQUDSZNKRJEB-UHFFFAOYSA-N 0 0 318.804 5.046 20 0 DKADRN CC[C@@H](C(=O)N(C)c1c(Cl)cccc1Cl)c1ccccc1 ZINC000464201545 339136747 /nfs/dbraw/zinc/13/67/47/339136747.db2.gz XMWSIUQGLLKIAS-CYBMUJFWSA-N 0 0 322.235 5.150 20 0 DKADRN CC[C@H](C(=O)N(C)c1c(Cl)cccc1Cl)c1ccccc1 ZINC000464201546 339136729 /nfs/dbraw/zinc/13/67/29/339136729.db2.gz XMWSIUQGLLKIAS-ZDUSSCGKSA-N 0 0 322.235 5.150 20 0 DKADRN C[C@@H]1C[C@@H](c2ccccc2F)N(C(=O)CCC2CCCCC2)C1 ZINC000464235753 339137449 /nfs/dbraw/zinc/13/74/49/339137449.db2.gz MJHXNRYHKRUCAX-BEFAXECRSA-N 0 0 317.448 5.096 20 0 DKADRN C[C@@H]1C[C@H](c2ccccc2F)N(C(=O)CCC2CCCCC2)C1 ZINC000464235754 339137387 /nfs/dbraw/zinc/13/73/87/339137387.db2.gz MJHXNRYHKRUCAX-DNVCBOLYSA-N 0 0 317.448 5.096 20 0 DKADRN C[C@H]1C[C@H](c2ccccc2F)N(C(=O)CCC2CCCCC2)C1 ZINC000464235755 339137390 /nfs/dbraw/zinc/13/73/90/339137390.db2.gz MJHXNRYHKRUCAX-HNAYVOBHSA-N 0 0 317.448 5.096 20 0 DKADRN C[C@H]1C[C@@H](c2ccccc2F)N(C(=O)CCC2CCCCC2)C1 ZINC000464235756 339137379 /nfs/dbraw/zinc/13/73/79/339137379.db2.gz MJHXNRYHKRUCAX-KXBFYZLASA-N 0 0 317.448 5.096 20 0 DKADRN CCCC[C@H](CC)C(=O)Nc1cnccc1-c1cccc(F)c1 ZINC000464269915 339138541 /nfs/dbraw/zinc/13/85/41/339138541.db2.gz XLQDZOVPMUEBCJ-AWEZNQCLSA-N 0 0 314.404 5.043 20 0 DKADRN CCCC[C@@H](CC)C(=O)Nc1cnccc1-c1cccc(F)c1 ZINC000464269916 339138485 /nfs/dbraw/zinc/13/84/85/339138485.db2.gz XLQDZOVPMUEBCJ-CQSZACIVSA-N 0 0 314.404 5.043 20 0 DKADRN C[C@@H]1C[C@@H](c2ccccc2F)N(C(=O)CCCC2CCCC2)C1 ZINC000464293291 339139140 /nfs/dbraw/zinc/13/91/40/339139140.db2.gz IIRNZELZCSNJOA-BEFAXECRSA-N 0 0 317.448 5.096 20 0 DKADRN C[C@@H]1C[C@H](c2ccccc2F)N(C(=O)CCCC2CCCC2)C1 ZINC000464293293 339139104 /nfs/dbraw/zinc/13/91/04/339139104.db2.gz IIRNZELZCSNJOA-DNVCBOLYSA-N 0 0 317.448 5.096 20 0 DKADRN C[C@H]1C[C@H](c2ccccc2F)N(C(=O)CCCC2CCCC2)C1 ZINC000464293296 339139192 /nfs/dbraw/zinc/13/91/92/339139192.db2.gz IIRNZELZCSNJOA-HNAYVOBHSA-N 0 0 317.448 5.096 20 0 DKADRN C[C@H]1C[C@@H](c2ccccc2F)N(C(=O)CCCC2CCCC2)C1 ZINC000464293298 339139118 /nfs/dbraw/zinc/13/91/18/339139118.db2.gz IIRNZELZCSNJOA-KXBFYZLASA-N 0 0 317.448 5.096 20 0 DKADRN Cc1cccc(NC(=O)c2cscc2-c2ccccc2)c1F ZINC000464304617 339139322 /nfs/dbraw/zinc/13/93/22/339139322.db2.gz RYPFUSHOLHMTPG-UHFFFAOYSA-N 0 0 311.381 5.115 20 0 DKADRN CC(C)c1ccc(C(=O)Nc2cccc(C(F)F)c2Cl)nc1 ZINC000464354161 339140367 /nfs/dbraw/zinc/14/03/67/339140367.db2.gz OWHTWILPMFHCCF-UHFFFAOYSA-N 0 0 324.758 5.048 20 0 DKADRN CC(C)[C@H](C)C(=O)N(C)[C@H](C)c1ccc(-c2ccccc2)cc1 ZINC000464358586 339140474 /nfs/dbraw/zinc/14/04/74/339140474.db2.gz ATUAKPSOVXGVSR-DLBZAZTESA-N 0 0 309.453 5.165 20 0 DKADRN CC(C)[C@@H](C)C(=O)N(C)[C@H](C)c1ccc(-c2ccccc2)cc1 ZINC000464358587 339140464 /nfs/dbraw/zinc/14/04/64/339140464.db2.gz ATUAKPSOVXGVSR-IAGOWNOFSA-N 0 0 309.453 5.165 20 0 DKADRN CC(C)[C@H](C)C(=O)N(C)[C@@H](C)c1ccc(-c2ccccc2)cc1 ZINC000464358588 339140452 /nfs/dbraw/zinc/14/04/52/339140452.db2.gz ATUAKPSOVXGVSR-IRXDYDNUSA-N 0 0 309.453 5.165 20 0 DKADRN CC(C)[C@@H](C)C(=O)N(C)[C@@H](C)c1ccc(-c2ccccc2)cc1 ZINC000464358589 339140385 /nfs/dbraw/zinc/14/03/85/339140385.db2.gz ATUAKPSOVXGVSR-SJORKVTESA-N 0 0 309.453 5.165 20 0 DKADRN C[C@H](c1ccc(-c2ccccc2)cc1)N(C)C(=O)[C@@H]1CC=CCC1 ZINC000464360394 339140411 /nfs/dbraw/zinc/14/04/11/339140411.db2.gz FBGIMXKMJKPUHJ-DYESRHJHSA-N 0 0 319.448 5.229 20 0 DKADRN C[C@@H](c1ccc(-c2ccccc2)cc1)N(C)C(=O)[C@@H]1CC=CCC1 ZINC000464360395 339140382 /nfs/dbraw/zinc/14/03/82/339140382.db2.gz FBGIMXKMJKPUHJ-LAUBAEHRSA-N 0 0 319.448 5.229 20 0 DKADRN C[C@H](c1ccc(-c2ccccc2)cc1)N(C)C(=O)[C@H]1CC=CCC1 ZINC000464360396 339140440 /nfs/dbraw/zinc/14/04/40/339140440.db2.gz FBGIMXKMJKPUHJ-UTKZUKDTSA-N 0 0 319.448 5.229 20 0 DKADRN C[C@@H](c1ccc(-c2ccccc2)cc1)N(C)C(=O)[C@H]1CC=CCC1 ZINC000464360397 339140384 /nfs/dbraw/zinc/14/03/84/339140384.db2.gz FBGIMXKMJKPUHJ-UWJYYQICSA-N 0 0 319.448 5.229 20 0 DKADRN C[C@@H](c1ccc(-c2ccccc2)cc1)N(C)C(=O)c1ccsc1 ZINC000464360679 339140511 /nfs/dbraw/zinc/14/05/11/339140511.db2.gz FUIVPMNOVKOTNL-HNNXBMFYSA-N 0 0 321.445 5.248 20 0 DKADRN C[C@H](c1ccc(-c2ccccc2)cc1)N(C)C(=O)c1ccsc1 ZINC000464360681 339140551 /nfs/dbraw/zinc/14/05/51/339140551.db2.gz FUIVPMNOVKOTNL-OAHLLOKOSA-N 0 0 321.445 5.248 20 0 DKADRN C[C@H](c1ccc(-c2ccccc2)cc1)N(C)C(=O)C[C@H]1C=CCC1 ZINC000464361000 339140559 /nfs/dbraw/zinc/14/05/59/339140559.db2.gz DKBDFKXUOHRBIN-MSOLQXFVSA-N 0 0 319.448 5.229 20 0 DKADRN C[C@H](c1ccc(-c2ccccc2)cc1)N(C)C(=O)C[C@@H]1C=CCC1 ZINC000464361001 339140570 /nfs/dbraw/zinc/14/05/70/339140570.db2.gz DKBDFKXUOHRBIN-QZTJIDSGSA-N 0 0 319.448 5.229 20 0 DKADRN C[C@@H](c1ccc(-c2ccccc2)cc1)N(C)C(=O)C[C@H]1C=CCC1 ZINC000464361002 339140477 /nfs/dbraw/zinc/14/04/77/339140477.db2.gz DKBDFKXUOHRBIN-ROUUACIJSA-N 0 0 319.448 5.229 20 0 DKADRN C[C@@H](c1ccc(-c2ccccc2)cc1)N(C)C(=O)C[C@@H]1C=CCC1 ZINC000464361003 339140556 /nfs/dbraw/zinc/14/05/56/339140556.db2.gz DKBDFKXUOHRBIN-ZWKOTPCHSA-N 0 0 319.448 5.229 20 0 DKADRN Cc1ccoc1C(=O)N(C)[C@@H](C)c1ccc(-c2ccccc2)cc1 ZINC000464362142 339140555 /nfs/dbraw/zinc/14/05/55/339140555.db2.gz ITGWCPBXVJJGDE-INIZCTEOSA-N 0 0 319.404 5.088 20 0 DKADRN Cc1ccoc1C(=O)N(C)[C@H](C)c1ccc(-c2ccccc2)cc1 ZINC000464362144 339140523 /nfs/dbraw/zinc/14/05/23/339140523.db2.gz ITGWCPBXVJJGDE-MRXNPFEDSA-N 0 0 319.404 5.088 20 0 DKADRN C[C@@H](c1ccc(-c2ccccc2)cc1)N(C)C(=O)c1cccs1 ZINC000464381799 339140867 /nfs/dbraw/zinc/14/08/67/339140867.db2.gz BJYZPTITCHIMFN-HNNXBMFYSA-N 0 0 321.445 5.248 20 0 DKADRN C[C@H](c1ccc(-c2ccccc2)cc1)N(C)C(=O)c1cccs1 ZINC000464381800 339140814 /nfs/dbraw/zinc/14/08/14/339140814.db2.gz BJYZPTITCHIMFN-OAHLLOKOSA-N 0 0 321.445 5.248 20 0 DKADRN C[C@@H](c1ccc(-c2ccccc2)cc1)N(C)C(=O)CCC1CC1 ZINC000464382132 339140887 /nfs/dbraw/zinc/14/08/87/339140887.db2.gz CBGOKLLPTURLGC-INIZCTEOSA-N 0 0 307.437 5.063 20 0 DKADRN C[C@H](c1ccc(-c2ccccc2)cc1)N(C)C(=O)CCC1CC1 ZINC000464382133 339140860 /nfs/dbraw/zinc/14/08/60/339140860.db2.gz CBGOKLLPTURLGC-MRXNPFEDSA-N 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Cc1cccc(C(C)C)c1NC(=O)c1cccc2ccsc21 ZINC000464565393 339145409 /nfs/dbraw/zinc/14/54/09/339145409.db2.gz AYSNHXXTSDYMJS-UHFFFAOYSA-N 0 0 309.434 5.585 20 0 DKADRN Cc1oc2ccccc2c1C(=O)Nc1ccc(Cl)cc1Cl ZINC000464566795 339145554 /nfs/dbraw/zinc/14/55/54/339145554.db2.gz CFJAXJBKZNNDPR-UHFFFAOYSA-N 0 0 320.175 5.300 20 0 DKADRN CCN(C(=O)c1c(C)oc2ccccc21)c1ccccc1Cl ZINC000464567749 339145493 /nfs/dbraw/zinc/14/54/93/339145493.db2.gz RGIRFQSWAWNISG-UHFFFAOYSA-N 0 0 313.784 5.061 20 0 DKADRN CCN(C(=O)c1cccc2ccsc21)c1ccccc1Cl ZINC000464569482 339145678 /nfs/dbraw/zinc/14/56/78/339145678.db2.gz XEXWQCKKWWLGHJ-UHFFFAOYSA-N 0 0 315.825 5.221 20 0 DKADRN CC(C)c1scnc1NC(=O)c1ccc(C2CCCC2)cc1 ZINC000464571344 339145712 /nfs/dbraw/zinc/14/57/12/339145712.db2.gz ORKMZTHLGQDWAP-UHFFFAOYSA-N 0 0 314.454 5.176 20 0 DKADRN Cc1oc2ccccc2c1CC(=O)Nc1c(C)cccc1C(C)C ZINC000464572511 339145657 /nfs/dbraw/zinc/14/56/57/339145657.db2.gz VHSABQXTCCUYPD-UHFFFAOYSA-N 0 0 321.420 5.354 20 0 DKADRN 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YUMTWIDURFUPHI-ZTNFWEORSA-N 0 0 313.485 5.183 20 0 DKADRN Cc1cccc([C@@H]2CCCCN2C(=O)C[C@@H](C)C(C)C)c1C ZINC000464592307 339146681 /nfs/dbraw/zinc/14/66/81/339146681.db2.gz MSHADDVDYWTWGS-APWZRJJASA-N 0 0 301.474 5.039 20 0 DKADRN Cc1cccc([C@@H]2CCCCN2C(=O)C[C@H](C)C(C)C)c1C ZINC000464592308 339146694 /nfs/dbraw/zinc/14/66/94/339146694.db2.gz MSHADDVDYWTWGS-LPHOPBHVSA-N 0 0 301.474 5.039 20 0 DKADRN Cc1cccc([C@H]2CCCCN2C(=O)C[C@H](C)C(C)C)c1C ZINC000464592309 339146650 /nfs/dbraw/zinc/14/66/50/339146650.db2.gz MSHADDVDYWTWGS-QFBILLFUSA-N 0 0 301.474 5.039 20 0 DKADRN Cc1cccc([C@H]2CCCCN2C(=O)C[C@@H](C)C(C)C)c1C ZINC000464592310 339146649 /nfs/dbraw/zinc/14/66/49/339146649.db2.gz MSHADDVDYWTWGS-VQIMIIECSA-N 0 0 301.474 5.039 20 0 DKADRN Cc1cccc([C@@H]2CCCCN2C(=O)CC2=CCCCC2)c1C ZINC000464594794 339146813 /nfs/dbraw/zinc/14/68/13/339146813.db2.gz VGIHTRFABGDSKQ-FQEVSTJZSA-N 0 0 311.469 5.248 20 0 DKADRN Cc1cccc([C@H]2CCCCN2C(=O)CC2=CCCCC2)c1C ZINC000464594795 339146777 /nfs/dbraw/zinc/14/67/77/339146777.db2.gz VGIHTRFABGDSKQ-HXUWFJFHSA-N 0 0 311.469 5.248 20 0 DKADRN CC(C)Oc1ccc(Cl)cc1NC(=O)c1occc1C(C)C ZINC000464663212 339148179 /nfs/dbraw/zinc/14/81/79/339148179.db2.gz KJIMNUAWRZNQPW-UHFFFAOYSA-N 0 0 321.804 5.096 20 0 DKADRN O=C(CCCc1cccs1)N1CCCC2(C1)CCCCCC2 ZINC000464666035 339148189 /nfs/dbraw/zinc/14/81/89/339148189.db2.gz GDWAEAWJCCMECD-UHFFFAOYSA-N 0 0 319.514 5.034 20 0 DKADRN O=C(c1cccc(C(F)F)c1)N1CCCC2(C1)CCCCCC2 ZINC000464667329 339148254 /nfs/dbraw/zinc/14/82/54/339148254.db2.gz VKUUILAZXPUHBT-UHFFFAOYSA-N 0 0 321.411 5.201 20 0 DKADRN O=C(c1cc2ccccc2o1)N1CCCC2(C1)CCCCCC2 ZINC000464669080 339148369 /nfs/dbraw/zinc/14/83/69/339148369.db2.gz IZDZRMOVNGHLAG-UHFFFAOYSA-N 0 0 311.425 5.009 20 0 DKADRN CC(C)Oc1ccc(Cl)cc1NC(=O)c1ccoc1C(C)C ZINC000464671684 339148358 /nfs/dbraw/zinc/14/83/58/339148358.db2.gz QENTYWNWXZKDFN-UHFFFAOYSA-N 0 0 321.804 5.096 20 0 DKADRN O=C(c1coc2ccccc12)N1CCCC2(C1)CCCCCC2 ZINC000464676664 339148478 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Cc1nc(CN(C)[C@H](C)c2ccc(-c3ccccc3)cc2)oc1C ZINC000464777347 339152747 /nfs/dbraw/zinc/15/27/47/339152747.db2.gz STQPLRKWVNNZFA-MRXNPFEDSA-N 0 0 320.436 5.151 20 0 DKADRN CC[C@H](C)CS[C@@H](C)C(=O)Nc1c(C)cc(C)cc1Cl ZINC000464800357 339154419 /nfs/dbraw/zinc/15/44/19/339154419.db2.gz VZAZEJGJKUNRJP-GWCFXTLKSA-N 0 0 313.894 5.063 20 0 DKADRN CC[C@H](C)CS[C@H](C)C(=O)Nc1c(C)cc(C)cc1Cl ZINC000464800358 339154337 /nfs/dbraw/zinc/15/43/37/339154337.db2.gz VZAZEJGJKUNRJP-GXFFZTMASA-N 0 0 313.894 5.063 20 0 DKADRN CC[C@@H](C)CS[C@@H](C)C(=O)Nc1c(C)cc(C)cc1Cl ZINC000464800359 339154345 /nfs/dbraw/zinc/15/43/45/339154345.db2.gz VZAZEJGJKUNRJP-MFKMUULPSA-N 0 0 313.894 5.063 20 0 DKADRN CC[C@@H](C)CS[C@H](C)C(=O)Nc1c(C)cc(C)cc1Cl ZINC000464800360 339154379 /nfs/dbraw/zinc/15/43/79/339154379.db2.gz VZAZEJGJKUNRJP-ZWNOBZJWSA-N 0 0 313.894 5.063 20 0 DKADRN CC[C@@H](C)CS[C@H](C)c1nnc(-c2cccc(Cl)c2)o1 ZINC000464801007 339154498 /nfs/dbraw/zinc/15/44/98/339154498.db2.gz CCVOMHIQEMKCCA-GHMZBOCLSA-N 0 0 310.850 5.230 20 0 DKADRN CC[C@@H](C)CS[C@@H](C)c1nnc(-c2cccc(Cl)c2)o1 ZINC000464801008 339154595 /nfs/dbraw/zinc/15/45/95/339154595.db2.gz CCVOMHIQEMKCCA-MNOVXSKESA-N 0 0 310.850 5.230 20 0 DKADRN CC[C@H](C)CS[C@@H](C)c1nnc(-c2cccc(Cl)c2)o1 ZINC000464801009 339154552 /nfs/dbraw/zinc/15/45/52/339154552.db2.gz CCVOMHIQEMKCCA-QWRGUYRKSA-N 0 0 310.850 5.230 20 0 DKADRN CC[C@H](C)CS[C@H](C)c1nnc(-c2cccc(Cl)c2)o1 ZINC000464801010 339154580 /nfs/dbraw/zinc/15/45/80/339154580.db2.gz CCVOMHIQEMKCCA-WDEREUQCSA-N 0 0 310.850 5.230 20 0 DKADRN CC[C@H](C)CS[C@H](C)C(=O)Nc1c(C)cccc1C(C)C ZINC000464802794 339154563 /nfs/dbraw/zinc/15/45/63/339154563.db2.gz TXBWKGKTOAXJPF-DZGCQCFKSA-N 0 0 307.503 5.225 20 0 DKADRN CC[C@@H](C)CS[C@@H](C)C(=O)Nc1c(C)cccc1C(C)C ZINC000464802795 339154537 /nfs/dbraw/zinc/15/45/37/339154537.db2.gz TXBWKGKTOAXJPF-HIFRSBDPSA-N 0 0 307.503 5.225 20 0 DKADRN CC[C@@H](C)CS[C@H](C)C(=O)Nc1c(C)cccc1C(C)C ZINC000464802796 339154587 /nfs/dbraw/zinc/15/45/87/339154587.db2.gz 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ZINC000464883689 339160154 /nfs/dbraw/zinc/16/01/54/339160154.db2.gz DPXVPELEGUVTNO-UHFFFAOYSA-N 0 0 324.424 5.173 20 0 DKADRN Cc1ccc([C@@H]2C[C@H](C)CCN2C(=O)C[C@@H]2CCC[C@@H](C)C2)o1 ZINC000464886480 339160263 /nfs/dbraw/zinc/16/02/63/339160263.db2.gz BQBGYNBBFVZXIV-AHCXZYCDSA-N 0 0 317.473 5.104 20 0 DKADRN Cc1ccc([C@@H]2C[C@H](C)CCN2C(=O)C[C@@H]2CCC[C@H](C)C2)o1 ZINC000464886481 339160271 /nfs/dbraw/zinc/16/02/71/339160271.db2.gz BQBGYNBBFVZXIV-IDCNUPLLSA-N 0 0 317.473 5.104 20 0 DKADRN Cc1ccc([C@@H]2C[C@H](C)CCN2C(=O)C[C@H]2CCC[C@@H](C)C2)o1 ZINC000464886482 339160252 /nfs/dbraw/zinc/16/02/52/339160252.db2.gz BQBGYNBBFVZXIV-LMSBXDPUSA-N 0 0 317.473 5.104 20 0 DKADRN Cc1ccc([C@@H]2C[C@H](C)CCN2C(=O)C[C@H]2CCC[C@H](C)C2)o1 ZINC000464886483 339160240 /nfs/dbraw/zinc/16/02/40/339160240.db2.gz BQBGYNBBFVZXIV-MVJTYMMSSA-N 0 0 317.473 5.104 20 0 DKADRN CCc1ccc([C@H]2C[C@H](C)CCN2C(=O)C2CCCCCC2)o1 ZINC000464886551 339160276 /nfs/dbraw/zinc/16/02/76/339160276.db2.gz 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CCc1ccc([C@H]2C[C@H](C)CCN2C(=O)CC2=CCCCC2)o1 ZINC000464889959 339160541 /nfs/dbraw/zinc/16/05/41/339160541.db2.gz GNVOVAYRVWIBMJ-CRAIPNDOSA-N 0 0 315.457 5.032 20 0 DKADRN CCc1ccc([C@H]2C[C@@H](C)CCN2C(=O)CC2=CCCCC2)o1 ZINC000464889961 339160589 /nfs/dbraw/zinc/16/05/89/339160589.db2.gz GNVOVAYRVWIBMJ-MAUKXSAKSA-N 0 0 315.457 5.032 20 0 DKADRN CCc1ccc([C@@H]2C[C@H](C)CCN2C(=O)CC2=CCCCC2)o1 ZINC000464889962 339160513 /nfs/dbraw/zinc/16/05/13/339160513.db2.gz GNVOVAYRVWIBMJ-QAPCUYQASA-N 0 0 315.457 5.032 20 0 DKADRN CCc1ccc([C@@H]2C[C@@H](C)CCN2C(=O)CC2=CCCCC2)o1 ZINC000464889964 339160587 /nfs/dbraw/zinc/16/05/87/339160587.db2.gz GNVOVAYRVWIBMJ-YJBOKZPZSA-N 0 0 315.457 5.032 20 0 DKADRN Cc1ccc([C@H]2C[C@H](C)CCN2C(=O)CCCC(C)(C)C)o1 ZINC000464890603 339160598 /nfs/dbraw/zinc/16/05/98/339160598.db2.gz HUKWHVVURABDAI-GDBMZVCRSA-N 0 0 305.462 5.104 20 0 DKADRN Cc1ccc([C@H]2C[C@@H](C)CCN2C(=O)CCCC(C)(C)C)o1 ZINC000464890604 339160599 /nfs/dbraw/zinc/16/05/99/339160599.db2.gz HUKWHVVURABDAI-GOEBONIOSA-N 0 0 305.462 5.104 20 0 DKADRN Cc1ccc([C@@H]2C[C@@H](C)CCN2C(=O)CCCC(C)(C)C)o1 ZINC000464890605 339160533 /nfs/dbraw/zinc/16/05/33/339160533.db2.gz HUKWHVVURABDAI-HOCLYGCPSA-N 0 0 305.462 5.104 20 0 DKADRN Cc1ccc([C@@H]2C[C@H](C)CCN2C(=O)CCCC(C)(C)C)o1 ZINC000464890606 339160537 /nfs/dbraw/zinc/16/05/37/339160537.db2.gz HUKWHVVURABDAI-ZBFHGGJFSA-N 0 0 305.462 5.104 20 0 DKADRN CCc1ccc([C@H]2C[C@H](C)CCN2C(=O)CCC2CCCC2)o1 ZINC000464891057 339160596 /nfs/dbraw/zinc/16/05/96/339160596.db2.gz IUWIJPTYUSCPDZ-CRAIPNDOSA-N 0 0 317.473 5.112 20 0 DKADRN CCc1ccc([C@H]2C[C@@H](C)CCN2C(=O)CCC2CCCC2)o1 ZINC000464891058 339160527 /nfs/dbraw/zinc/16/05/27/339160527.db2.gz IUWIJPTYUSCPDZ-MAUKXSAKSA-N 0 0 317.473 5.112 20 0 DKADRN CCc1ccc([C@@H]2C[C@H](C)CCN2C(=O)CCC2CCCC2)o1 ZINC000464891059 339160571 /nfs/dbraw/zinc/16/05/71/339160571.db2.gz IUWIJPTYUSCPDZ-QAPCUYQASA-N 0 0 317.473 5.112 20 0 DKADRN CCc1ccc([C@@H]2C[C@@H](C)CCN2C(=O)CCC2CCCC2)o1 ZINC000464891060 339160501 /nfs/dbraw/zinc/16/05/01/339160501.db2.gz IUWIJPTYUSCPDZ-YJBOKZPZSA-N 0 0 317.473 5.112 20 0 DKADRN Cc1ccc([C@@H]2C[C@@H](C)CCN2C(=O)[C@H](C)CC2CCCC2)o1 ZINC000464893078 339160628 /nfs/dbraw/zinc/16/06/28/339160628.db2.gz MESPIZAQRXOPAF-DAYGRLMNSA-N 0 0 317.473 5.104 20 0 DKADRN Cc1ccc([C@@H]2C[C@@H](C)CCN2C(=O)[C@@H](C)CC2CCCC2)o1 ZINC000464893079 339160635 /nfs/dbraw/zinc/16/06/35/339160635.db2.gz MESPIZAQRXOPAF-MPGHIAIKSA-N 0 0 317.473 5.104 20 0 DKADRN Cc1ccc([C@@H]2C[C@H](C)CCN2C(=O)[C@H](C)CC2CCCC2)o1 ZINC000464893080 339160651 /nfs/dbraw/zinc/16/06/51/339160651.db2.gz MESPIZAQRXOPAF-RKVPGOIHSA-N 0 0 317.473 5.104 20 0 DKADRN Cc1ccc([C@@H]2C[C@H](C)CCN2C(=O)[C@@H](C)CC2CCCC2)o1 ZINC000464893081 339160606 /nfs/dbraw/zinc/16/06/06/339160606.db2.gz MESPIZAQRXOPAF-VKJFTORMSA-N 0 0 317.473 5.104 20 0 DKADRN CCc1ccc([C@H]2C[C@H](C)CCN2C(=O)CC2CCCCC2)o1 ZINC000464893681 339160613 /nfs/dbraw/zinc/16/06/13/339160613.db2.gz MPHPECHSHFHNHQ-CRAIPNDOSA-N 0 0 317.473 5.112 20 0 DKADRN CCc1ccc([C@H]2C[C@@H](C)CCN2C(=O)CC2CCCCC2)o1 ZINC000464893682 339160639 /nfs/dbraw/zinc/16/06/39/339160639.db2.gz MPHPECHSHFHNHQ-MAUKXSAKSA-N 0 0 317.473 5.112 20 0 DKADRN CCc1ccc([C@@H]2C[C@H](C)CCN2C(=O)CC2CCCCC2)o1 ZINC000464893683 339160699 /nfs/dbraw/zinc/16/06/99/339160699.db2.gz MPHPECHSHFHNHQ-QAPCUYQASA-N 0 0 317.473 5.112 20 0 DKADRN CCc1ccc([C@@H]2C[C@@H](C)CCN2C(=O)CC2CCCCC2)o1 ZINC000464893684 339160677 /nfs/dbraw/zinc/16/06/77/339160677.db2.gz MPHPECHSHFHNHQ-YJBOKZPZSA-N 0 0 317.473 5.112 20 0 DKADRN CC(C)(C)CCCC(=O)Nc1cccc(Oc2ccccn2)c1 ZINC000464895243 339160826 /nfs/dbraw/zinc/16/08/26/339160826.db2.gz AUUKIHYMLDLPPG-UHFFFAOYSA-N 0 0 312.413 5.029 20 0 DKADRN CC1CCC(CC(=O)Nc2cccc(Oc3ccccn3)c2)CC1 ZINC000464900143 339161068 /nfs/dbraw/zinc/16/10/68/339161068.db2.gz BZHHXMLIHPMUNA-UHFFFAOYSA-N 0 0 324.424 5.029 20 0 DKADRN CCCC[C@H](CC)C(=O)Nc1cccc(Oc2ccccn2)c1 ZINC000464900318 339161077 /nfs/dbraw/zinc/16/10/77/339161077.db2.gz LSKBXZROXQWFNS-HNNXBMFYSA-N 0 0 312.413 5.029 20 0 DKADRN CCCC[C@@H](CC)C(=O)Nc1cccc(Oc2ccccn2)c1 ZINC000464900320 339161024 /nfs/dbraw/zinc/16/10/24/339161024.db2.gz LSKBXZROXQWFNS-OAHLLOKOSA-N 0 0 312.413 5.029 20 0 DKADRN C[C@@H](CC1CCCC1)C(=O)Nc1cccc(Oc2ccccn2)c1 ZINC000464900468 339160996 /nfs/dbraw/zinc/16/09/96/339160996.db2.gz CXUSZZRCHJVXPW-HNNXBMFYSA-N 0 0 324.424 5.029 20 0 DKADRN C[C@H](CC1CCCC1)C(=O)Nc1cccc(Oc2ccccn2)c1 ZINC000464900469 339161078 /nfs/dbraw/zinc/16/10/78/339161078.db2.gz CXUSZZRCHJVXPW-OAHLLOKOSA-N 0 0 324.424 5.029 20 0 DKADRN Cc1ccc([C@H]2C[C@H](C)CCN2C(=O)CCCC2CCCC2)o1 ZINC000464903211 339161126 /nfs/dbraw/zinc/16/11/26/339161126.db2.gz VBFGESFZGVTJFV-CRAIPNDOSA-N 0 0 317.473 5.248 20 0 DKADRN Cc1ccc([C@H]2C[C@@H](C)CCN2C(=O)CCCC2CCCC2)o1 ZINC000464903214 339161145 /nfs/dbraw/zinc/16/11/45/339161145.db2.gz VBFGESFZGVTJFV-MAUKXSAKSA-N 0 0 317.473 5.248 20 0 DKADRN Cc1ccc([C@@H]2C[C@H](C)CCN2C(=O)CCCC2CCCC2)o1 ZINC000464903215 339161188 /nfs/dbraw/zinc/16/11/88/339161188.db2.gz VBFGESFZGVTJFV-QAPCUYQASA-N 0 0 317.473 5.248 20 0 DKADRN Cc1ccc([C@@H]2C[C@@H](C)CCN2C(=O)CCCC2CCCC2)o1 ZINC000464903217 339161180 /nfs/dbraw/zinc/16/11/80/339161180.db2.gz VBFGESFZGVTJFV-YJBOKZPZSA-N 0 0 317.473 5.248 20 0 DKADRN C[C@@H]1CCC[C@H](CC(=O)Nc2cccc(Oc3ccccn3)c2)C1 ZINC000464903267 339161160 /nfs/dbraw/zinc/16/11/60/339161160.db2.gz VMMCVLBNNXZNGZ-CVEARBPZSA-N 0 0 324.424 5.029 20 0 DKADRN C[C@H]1CCC[C@H](CC(=O)Nc2cccc(Oc3ccccn3)c2)C1 ZINC000464903268 339161136 /nfs/dbraw/zinc/16/11/36/339161136.db2.gz VMMCVLBNNXZNGZ-HOTGVXAUSA-N 0 0 324.424 5.029 20 0 DKADRN C[C@@H]1CCC[C@@H](CC(=O)Nc2cccc(Oc3ccccn3)c2)C1 ZINC000464903269 339161122 /nfs/dbraw/zinc/16/11/22/339161122.db2.gz VMMCVLBNNXZNGZ-HZPDHXFCSA-N 0 0 324.424 5.029 20 0 DKADRN C[C@H]1CCC[C@@H](CC(=O)Nc2cccc(Oc3ccccn3)c2)C1 ZINC000464903270 339161118 /nfs/dbraw/zinc/16/11/18/339161118.db2.gz VMMCVLBNNXZNGZ-JKSUJKDBSA-N 0 0 324.424 5.029 20 0 DKADRN O=C(CCCC1CCCC1)Nc1cccc(Oc2ccccn2)c1 ZINC000464905492 339161194 /nfs/dbraw/zinc/16/11/94/339161194.db2.gz JVYWFGRGSNXTSF-UHFFFAOYSA-N 0 0 324.424 5.173 20 0 DKADRN Cc1nc(CSCc2ccco2)oc1-c1ccc(Cl)cc1 ZINC000464914633 339161635 /nfs/dbraw/zinc/16/16/35/339161635.db2.gz VUQHANPUNJNOKI-UHFFFAOYSA-N 0 0 319.813 5.330 20 0 DKADRN CCC1(C(=O)N2Cc3ccccc3-c3ccccc3C2)CCCC1 ZINC000464930607 339162204 /nfs/dbraw/zinc/16/22/04/339162204.db2.gz HOIQSZGPGUOUGK-UHFFFAOYSA-N 0 0 319.448 5.166 20 0 DKADRN CCc1ccc(CC)c(NC(=O)c2ccc(C(F)F)cc2)c1 ZINC000464993140 339164834 /nfs/dbraw/zinc/16/48/34/339164834.db2.gz DDPVTWVMOFQRIA-UHFFFAOYSA-N 0 0 303.352 5.001 20 0 DKADRN CCc1ccc(CC)c(NC(=O)c2cccc(C(F)F)c2)c1 ZINC000464995419 339164928 /nfs/dbraw/zinc/16/49/28/339164928.db2.gz MKBYVIZCSDZKQU-UHFFFAOYSA-N 0 0 303.352 5.001 20 0 DKADRN CCc1ccc(-c2ccc(CN[C@@H](C)c3ccc(C)o3)o2)cc1 ZINC000465010892 339165376 /nfs/dbraw/zinc/16/53/76/339165376.db2.gz JVHGMOLVFRROLZ-HNNXBMFYSA-N 0 0 309.409 5.261 20 0 DKADRN CCc1ccc(-c2ccc(CN[C@H](C)c3ccc(C)o3)o2)cc1 ZINC000465010894 339165289 /nfs/dbraw/zinc/16/52/89/339165289.db2.gz JVHGMOLVFRROLZ-OAHLLOKOSA-N 0 0 309.409 5.261 20 0 DKADRN CC(C)c1ccc(O[C@H](C)c2nc(-c3cccs3)no2)cc1 ZINC000465016067 339165609 /nfs/dbraw/zinc/16/56/09/339165609.db2.gz IAIGOEODEGHYDJ-GFCCVEGCSA-N 0 0 314.410 5.062 20 0 DKADRN CC(C)c1ccc(O[C@@H](C)c2nc(-c3cccs3)no2)cc1 ZINC000465016068 339165642 /nfs/dbraw/zinc/16/56/42/339165642.db2.gz IAIGOEODEGHYDJ-LBPRGKRZSA-N 0 0 314.410 5.062 20 0 DKADRN CCC(C)(C)CC(=O)N(C)[C@H](C)c1cccc(C(F)(F)F)c1 ZINC000465030021 339166063 /nfs/dbraw/zinc/16/60/63/339166063.db2.gz JODVHSIHEMYZII-GFCCVEGCSA-N 0 0 315.379 5.051 20 0 DKADRN CCC(C)(C)CC(=O)N(C)[C@@H](C)c1cccc(C(F)(F)F)c1 ZINC000465030022 339166071 /nfs/dbraw/zinc/16/60/71/339166071.db2.gz JODVHSIHEMYZII-LBPRGKRZSA-N 0 0 315.379 5.051 20 0 DKADRN Cc1ccc2c(CCC(=O)Nc3ccccc3C(C)C)c[nH]c2c1 ZINC000465030213 339166088 /nfs/dbraw/zinc/16/60/88/339166088.db2.gz DQMABCWNODKGJH-UHFFFAOYSA-N 0 0 320.436 5.171 20 0 DKADRN CCC(C)(C)CC(=O)N(C)[C@H](C)c1ccc(Cl)c(Cl)c1 ZINC000465030395 339166023 /nfs/dbraw/zinc/16/60/23/339166023.db2.gz CEYJGEBGWZFQIT-LLVKDONJSA-N 0 0 316.272 5.339 20 0 DKADRN CCC(C)(C)CC(=O)N(C)[C@@H](C)c1ccc(Cl)c(Cl)c1 ZINC000465030396 339166075 /nfs/dbraw/zinc/16/60/75/339166075.db2.gz CEYJGEBGWZFQIT-NSHDSACASA-N 0 0 316.272 5.339 20 0 DKADRN CCCCCN(CCCCC)C(=O)c1cccc2cnccc21 ZINC000465033801 339166186 /nfs/dbraw/zinc/16/61/86/339166186.db2.gz RVQCQNKFHKSAKE-UHFFFAOYSA-N 0 0 312.457 5.057 20 0 DKADRN CCC(C)(C)CC(=O)N(Cc1cccs1)Cc1cccs1 ZINC000465033878 339166106 /nfs/dbraw/zinc/16/61/06/339166106.db2.gz SFCHMJUUUMMXLZ-UHFFFAOYSA-N 0 0 321.511 5.165 20 0 DKADRN CCC(C)(C)CC(=O)N(C)[C@H](C)c1ccc(C(F)(F)F)cc1 ZINC000465038384 339166363 /nfs/dbraw/zinc/16/63/63/339166363.db2.gz QVWYWMYFRCIJGI-GFCCVEGCSA-N 0 0 315.379 5.051 20 0 DKADRN CCC(C)(C)CC(=O)N(C)[C@@H](C)c1ccc(C(F)(F)F)cc1 ZINC000465038385 339166330 /nfs/dbraw/zinc/16/63/30/339166330.db2.gz QVWYWMYFRCIJGI-LBPRGKRZSA-N 0 0 315.379 5.051 20 0 DKADRN CCCc1ccccc1NC(=O)CCc1c[nH]c2cc(C)ccc12 ZINC000465039903 339166475 /nfs/dbraw/zinc/16/64/75/339166475.db2.gz ZTZXFOZPPBBVMB-UHFFFAOYSA-N 0 0 320.436 5.000 20 0 DKADRN O=C(Nc1cc(Cl)ccc1Cl)c1cc(F)cc(Cl)c1 ZINC000465060239 339167307 /nfs/dbraw/zinc/16/73/07/339167307.db2.gz QPMIEZQIGVFDCU-UHFFFAOYSA-N 0 0 318.562 5.038 20 0 DKADRN CC[C@H]1C[C@@H](C)CN1C(=O)Nc1ccc(-c2ccccc2)cc1 ZINC000465064559 339167420 /nfs/dbraw/zinc/16/74/20/339167420.db2.gz KLOCHSNLMIGJAH-BEFAXECRSA-N 0 0 308.425 5.006 20 0 DKADRN CC[C@@H]1C[C@@H](C)CN1C(=O)Nc1ccc(-c2ccccc2)cc1 ZINC000465064561 339167481 /nfs/dbraw/zinc/16/74/81/339167481.db2.gz KLOCHSNLMIGJAH-DNVCBOLYSA-N 0 0 308.425 5.006 20 0 DKADRN CC[C@@H]1C[C@H](C)CN1C(=O)Nc1ccc(-c2ccccc2)cc1 ZINC000465064563 339167466 /nfs/dbraw/zinc/16/74/66/339167466.db2.gz KLOCHSNLMIGJAH-HNAYVOBHSA-N 0 0 308.425 5.006 20 0 DKADRN CC[C@H]1C[C@H](C)CN1C(=O)Nc1ccc(-c2ccccc2)cc1 ZINC000465064564 339167480 /nfs/dbraw/zinc/16/74/80/339167480.db2.gz KLOCHSNLMIGJAH-KXBFYZLASA-N 0 0 308.425 5.006 20 0 DKADRN CCC(C)(C)CC(=O)Nc1ccccc1COc1ccccc1 ZINC000465069818 339167558 /nfs/dbraw/zinc/16/75/58/339167558.db2.gz INQHZETZKJQDGM-UHFFFAOYSA-N 0 0 311.425 5.030 20 0 DKADRN CCC(C)(C)CC(=O)N([C@H](C)c1ccccc1Cl)C1CC1 ZINC000465073620 339167564 /nfs/dbraw/zinc/16/75/64/339167564.db2.gz INQHRRCYIPTDDB-CYBMUJFWSA-N 0 0 307.865 5.218 20 0 DKADRN CCC(C)(C)CC(=O)N([C@@H](C)c1ccccc1Cl)C1CC1 ZINC000465073621 339167632 /nfs/dbraw/zinc/16/76/32/339167632.db2.gz INQHRRCYIPTDDB-ZDUSSCGKSA-N 0 0 307.865 5.218 20 0 DKADRN CCC(C)(C)CC(=O)N([C@H](C)c1ccc(Cl)cc1)C1CC1 ZINC000465077565 339167670 /nfs/dbraw/zinc/16/76/70/339167670.db2.gz ZVYAJVVCXNJJCW-CYBMUJFWSA-N 0 0 307.865 5.218 20 0 DKADRN CCC(C)(C)CC(=O)N([C@@H](C)c1ccc(Cl)cc1)C1CC1 ZINC000465077566 339167678 /nfs/dbraw/zinc/16/76/78/339167678.db2.gz ZVYAJVVCXNJJCW-ZDUSSCGKSA-N 0 0 307.865 5.218 20 0 DKADRN CCCC[C@H](CC)CC(=O)N1CC[C@@H](C)C[C@H]1c1ccco1 ZINC000465081900 339167767 /nfs/dbraw/zinc/16/77/67/339167767.db2.gz 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C[C@@H]1CCN(C(=O)c2ccc3ccccc3c2)[C@H](c2ccco2)C1 ZINC000465084342 339167939 /nfs/dbraw/zinc/16/79/39/339167939.db2.gz NUCXDSKLJBFXJK-BEFAXECRSA-N 0 0 319.404 5.046 20 0 DKADRN C[C@@H]1CCN(C(=O)c2ccc3ccccc3c2)[C@@H](c2ccco2)C1 ZINC000465084343 339167875 /nfs/dbraw/zinc/16/78/75/339167875.db2.gz NUCXDSKLJBFXJK-DNVCBOLYSA-N 0 0 319.404 5.046 20 0 DKADRN C[C@H]1CCN(C(=O)c2ccc3ccccc3c2)[C@@H](c2ccco2)C1 ZINC000465084344 339167928 /nfs/dbraw/zinc/16/79/28/339167928.db2.gz NUCXDSKLJBFXJK-HNAYVOBHSA-N 0 0 319.404 5.046 20 0 DKADRN C[C@H]1CCN(C(=O)c2ccc3ccccc3c2)[C@H](c2ccco2)C1 ZINC000465084345 339167882 /nfs/dbraw/zinc/16/78/82/339167882.db2.gz NUCXDSKLJBFXJK-KXBFYZLASA-N 0 0 319.404 5.046 20 0 DKADRN C[C@H](CC(=O)N1CC[C@@H](C)C[C@@H]1c1ccco1)C1CCCCC1 ZINC000465093932 339168360 /nfs/dbraw/zinc/16/83/60/339168360.db2.gz ZUPAGMOIBGESLO-JFIYKMOQSA-N 0 0 317.473 5.186 20 0 DKADRN C[C@H](CC(=O)N1CC[C@@H](C)C[C@H]1c1ccco1)C1CCCCC1 ZINC000465093934 339168381 /nfs/dbraw/zinc/16/83/81/339168381.db2.gz 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DKADRN CCC(C)(C)CC(=O)Nc1ccc(N[C@@H](C)c2ccccc2)cc1 ZINC000465175322 339170817 /nfs/dbraw/zinc/17/08/17/339170817.db2.gz LSZRLJPCZWQZDJ-INIZCTEOSA-N 0 0 324.468 5.625 20 0 DKADRN CCC(C)(C)CC(=O)Nc1ccc(N[C@H](C)c2ccccc2)cc1 ZINC000465175323 339170765 /nfs/dbraw/zinc/17/07/65/339170765.db2.gz LSZRLJPCZWQZDJ-MRXNPFEDSA-N 0 0 324.468 5.625 20 0 DKADRN CC(C)c1ccc(NC(=O)N2C[C@@H]3CCC[C@@H]3C2)c(C(C)C)c1 ZINC000465175426 339170722 /nfs/dbraw/zinc/17/07/22/339170722.db2.gz IEVGTFUFBVFUAK-CALCHBBNSA-N 0 0 314.473 5.197 20 0 DKADRN CC(C)c1ccc(NC(=O)N2C[C@H]3CCC[C@@H]3C2)c(C(C)C)c1 ZINC000465175427 339170784 /nfs/dbraw/zinc/17/07/84/339170784.db2.gz IEVGTFUFBVFUAK-IAGOWNOFSA-N 0 0 314.473 5.197 20 0 DKADRN CC(C)c1ccc(NC(=O)N2C[C@@H]3CCC[C@H]3C2)c(C(C)C)c1 ZINC000465175428 339170767 /nfs/dbraw/zinc/17/07/67/339170767.db2.gz IEVGTFUFBVFUAK-IRXDYDNUSA-N 0 0 314.473 5.197 20 0 DKADRN CCC(C)(C)CC(=O)N1CCC(c2cccc3ccccc32)CC1 ZINC000465175688 339170745 /nfs/dbraw/zinc/17/07/45/339170745.db2.gz 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CCN(C(=O)N[C@@H](CC(C)C)c1ccc(Cl)cc1)C1CCC1 ZINC000465967818 339189121 /nfs/dbraw/zinc/18/91/21/339189121.db2.gz RWXFFAMUEOCGRC-KRWDZBQOSA-N 0 0 322.880 5.011 20 0 DKADRN CCN(C(=O)N[C@H](CC(C)C)c1ccc(Cl)cc1)C1CCC1 ZINC000465967819 339189135 /nfs/dbraw/zinc/18/91/35/339189135.db2.gz RWXFFAMUEOCGRC-QGZVFWFLSA-N 0 0 322.880 5.011 20 0 DKADRN CC(C)C[C@H](NC(=O)N(C)C1CCCC1)c1ccc(Cl)cc1 ZINC000465969598 339189173 /nfs/dbraw/zinc/18/91/73/339189173.db2.gz BGXZLNKVWXVHQQ-KRWDZBQOSA-N 0 0 322.880 5.011 20 0 DKADRN CC(C)C[C@@H](NC(=O)N(C)C1CCCC1)c1ccc(Cl)cc1 ZINC000465969599 339189185 /nfs/dbraw/zinc/18/91/85/339189185.db2.gz BGXZLNKVWXVHQQ-QGZVFWFLSA-N 0 0 322.880 5.011 20 0 DKADRN CC[C@@H](NC(=O)Nc1c(C)cccc1C)C(C)(C)c1ccccc1 ZINC000465971125 339189177 /nfs/dbraw/zinc/18/91/77/339189177.db2.gz GAPSQKFJHSQIOB-GOSISDBHSA-N 0 0 324.468 5.181 20 0 DKADRN CC[C@H](NC(=O)Nc1c(C)cccc1C)C(C)(C)c1ccccc1 ZINC000465971126 339189214 /nfs/dbraw/zinc/18/92/14/339189214.db2.gz GAPSQKFJHSQIOB-SFHVURJKSA-N 0 0 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C[C@@H](NC(=O)N(C)[C@@H](C)c1ccc(Cl)cc1)C1CCCCC1 ZINC000466005149 339190565 /nfs/dbraw/zinc/19/05/65/339190565.db2.gz UDGXVFLDMQTYBR-KGLIPLIRSA-N 0 0 322.880 5.011 20 0 DKADRN C[C@H](c1ccc(Cl)cc1)N(C)C(=O)N[C@@H](C)C1CCCCC1 ZINC000466005151 339190553 /nfs/dbraw/zinc/19/05/53/339190553.db2.gz UDGXVFLDMQTYBR-UONOGXRCSA-N 0 0 322.880 5.011 20 0 DKADRN C[C@@H](NC(=O)N(C)[C@H](C)c1ccc(Cl)cc1)C1CCCCC1 ZINC000466005153 339190547 /nfs/dbraw/zinc/19/05/47/339190547.db2.gz UDGXVFLDMQTYBR-ZIAGYGMSSA-N 0 0 322.880 5.011 20 0 DKADRN CC(C)(C)c1ccccc1NC(=O)NC1CCC(C)(C)CC1 ZINC000466005248 339190382 /nfs/dbraw/zinc/19/03/82/339190382.db2.gz BPLHZIDUBPRRSN-UHFFFAOYSA-N 0 0 302.462 5.074 20 0 DKADRN C[C@H](NC(=O)Nc1ccccc1C(C)(C)C)C1CCCCC1 ZINC000466007152 339190653 /nfs/dbraw/zinc/19/06/53/339190653.db2.gz YBQVOMZECJCMGF-AWEZNQCLSA-N 0 0 302.462 5.074 20 0 DKADRN C[C@@H](NC(=O)Nc1ccccc1C(C)(C)C)C1CCCCC1 ZINC000466007153 339190644 /nfs/dbraw/zinc/19/06/44/339190644.db2.gz YBQVOMZECJCMGF-CQSZACIVSA-N 0 0 302.462 5.074 20 0 DKADRN Cc1cccc(C(C)C)c1NC(=O)NC1CCC(C)(C)CC1 ZINC000466009334 339190684 /nfs/dbraw/zinc/19/06/84/339190684.db2.gz ITYORKQQIJAWHG-UHFFFAOYSA-N 0 0 302.462 5.209 20 0 DKADRN CCC[C@@H](CCc1ccccc1)NC(=O)Nc1c(C)cccc1C ZINC000466056113 339191847 /nfs/dbraw/zinc/19/18/47/339191847.db2.gz HXDUGCPCKLOVNG-IBGZPJMESA-N 0 0 324.468 5.226 20 0 DKADRN CCC[C@H](CCc1ccccc1)NC(=O)Nc1c(C)cccc1C ZINC000466056114 339191874 /nfs/dbraw/zinc/19/18/74/339191874.db2.gz HXDUGCPCKLOVNG-LJQANCHMSA-N 0 0 324.468 5.226 20 0 DKADRN CC[C@@H](C)[C@@H](NC(=O)N(CC)C1CCC1)c1ccc(Cl)cc1 ZINC000466076607 339192189 /nfs/dbraw/zinc/19/21/89/339192189.db2.gz OIEHXFHIPVAVCP-CXAGYDPISA-N 0 0 322.880 5.011 20 0 DKADRN CC[C@@H](C)[C@H](NC(=O)N(CC)C1CCC1)c1ccc(Cl)cc1 ZINC000466076608 339192182 /nfs/dbraw/zinc/19/21/82/339192182.db2.gz OIEHXFHIPVAVCP-DYVFJYSZSA-N 0 0 322.880 5.011 20 0 DKADRN CC[C@H](C)[C@H](NC(=O)N(CC)C1CCC1)c1ccc(Cl)cc1 ZINC000466076609 339192125 /nfs/dbraw/zinc/19/21/25/339192125.db2.gz 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339217553 /nfs/dbraw/zinc/21/75/53/339217553.db2.gz UVWFGGABVJEUFK-NRFANRHFSA-N 0 0 320.436 5.036 20 0 DKADRN CCc1noc(C)c1C[N@@H+]1CCC[C@@H]1c1cccc2ccccc21 ZINC000466807706 339217567 /nfs/dbraw/zinc/21/75/67/339217567.db2.gz UVWFGGABVJEUFK-OAQYLSRUSA-N 0 0 320.436 5.036 20 0 DKADRN Cc1cccc(Cl)c1NC(=O)c1cccc2ccsc21 ZINC000466859205 339219199 /nfs/dbraw/zinc/21/91/99/339219199.db2.gz NGBWCCSFJGGNQR-UHFFFAOYSA-N 0 0 301.798 5.115 20 0 DKADRN Cc1oc2ccccc2c1C(=O)Nc1ccccc1OC(C)(C)C ZINC000466861869 339219377 /nfs/dbraw/zinc/21/93/77/339219377.db2.gz QSEADSGYZYUJHT-UHFFFAOYSA-N 0 0 323.392 5.171 20 0 DKADRN Cc1ccccc1N(C(=O)c1cccc2ccsc21)C(C)C ZINC000466862149 339219334 /nfs/dbraw/zinc/21/93/34/339219334.db2.gz ISUUGFLLRBMHCJ-UHFFFAOYSA-N 0 0 309.434 5.265 20 0 DKADRN O=C(Nc1c(F)cc(Cl)cc1F)c1cccc2ccsc21 ZINC000466862898 339219368 /nfs/dbraw/zinc/21/93/68/339219368.db2.gz LTSHEXOWXBFMKN-UHFFFAOYSA-N 0 0 323.751 5.085 20 0 DKADRN Cc1oc2ccccc2c1C(=O)N(c1ccccc1C)C(C)C ZINC000466864523 339219409 /nfs/dbraw/zinc/21/94/09/339219409.db2.gz VKALUPGUCXOJMV-UHFFFAOYSA-N 0 0 307.393 5.105 20 0 DKADRN O=C(Nc1ccccc1-c1ccccc1)c1csc(Cl)c1 ZINC000466900352 339220537 /nfs/dbraw/zinc/22/05/37/339220537.db2.gz IYANESGSTKVTFH-UHFFFAOYSA-N 0 0 313.809 5.321 20 0 DKADRN CC[C@H](S[C@H](C)c1nnc(-c2ccccc2)o1)c1ccccc1 ZINC000466975287 339223243 /nfs/dbraw/zinc/22/32/43/339223243.db2.gz CMGZFAPETXAHHB-PBHICJAKSA-N 0 0 324.449 5.682 20 0 DKADRN CC[C@@H](S[C@H](C)c1nnc(-c2ccccc2)o1)c1ccccc1 ZINC000466975288 339223287 /nfs/dbraw/zinc/22/32/87/339223287.db2.gz CMGZFAPETXAHHB-RHSMWYFYSA-N 0 0 324.449 5.682 20 0 DKADRN CC[C@@H](S[C@@H](C)c1nnc(-c2ccccc2)o1)c1ccccc1 ZINC000466975289 339223272 /nfs/dbraw/zinc/22/32/72/339223272.db2.gz CMGZFAPETXAHHB-WMLDXEAASA-N 0 0 324.449 5.682 20 0 DKADRN CC[C@H](S[C@@H](C)c1nnc(-c2ccccc2)o1)c1ccccc1 ZINC000466975290 339223217 /nfs/dbraw/zinc/22/32/17/339223217.db2.gz CMGZFAPETXAHHB-YOEHRIQHSA-N 0 0 324.449 5.682 20 0 DKADRN CC[C@@H](S[C@H](C)C(=O)Nc1ccccc1C)c1ccccc1 ZINC000466979416 339223276 /nfs/dbraw/zinc/22/32/76/339223276.db2.gz QNEGGXFLQDDGRE-CRAIPNDOSA-N 0 0 313.466 5.207 20 0 DKADRN CC[C@@H](S[C@@H](C)C(=O)Nc1ccccc1C)c1ccccc1 ZINC000466979417 339223253 /nfs/dbraw/zinc/22/32/53/339223253.db2.gz QNEGGXFLQDDGRE-MAUKXSAKSA-N 0 0 313.466 5.207 20 0 DKADRN CC[C@H](S[C@H](C)C(=O)Nc1ccccc1C)c1ccccc1 ZINC000466979418 339223192 /nfs/dbraw/zinc/22/31/92/339223192.db2.gz QNEGGXFLQDDGRE-QAPCUYQASA-N 0 0 313.466 5.207 20 0 DKADRN CC[C@H](S[C@@H](C)C(=O)Nc1ccccc1C)c1ccccc1 ZINC000466979419 339223219 /nfs/dbraw/zinc/22/32/19/339223219.db2.gz QNEGGXFLQDDGRE-YJBOKZPZSA-N 0 0 313.466 5.207 20 0 DKADRN CC[C@H](SCc1nc2c(C)cccc2c(=O)[nH]1)c1ccccc1 ZINC000466980186 339223304 /nfs/dbraw/zinc/22/33/04/339223304.db2.gz XBVQMSXQNBASSK-INIZCTEOSA-N 0 0 324.449 5.028 20 0 DKADRN CC[C@@H](SCc1nc2c(C)cccc2c(=O)[nH]1)c1ccccc1 ZINC000466980187 339223333 /nfs/dbraw/zinc/22/33/33/339223333.db2.gz XBVQMSXQNBASSK-MRXNPFEDSA-N 0 0 324.449 5.028 20 0 DKADRN CC[C@H](SCc1nnc(-c2ccccc2)o1)c1ccccc1 ZINC000466981421 339223292 /nfs/dbraw/zinc/22/32/92/339223292.db2.gz RRIDEILTRTXSPF-INIZCTEOSA-N 0 0 310.422 5.121 20 0 DKADRN CC[C@@H](SCc1nnc(-c2ccccc2)o1)c1ccccc1 ZINC000466981422 339223355 /nfs/dbraw/zinc/22/33/55/339223355.db2.gz RRIDEILTRTXSPF-MRXNPFEDSA-N 0 0 310.422 5.121 20 0 DKADRN CCCc1ccc(-c2ccc(N[C@@H](C)c3cnccn3)cc2)cc1 ZINC000466988702 339223582 /nfs/dbraw/zinc/22/35/82/339223582.db2.gz RSUKZTGAKAETQO-INIZCTEOSA-N 0 0 317.436 5.269 20 0 DKADRN CCCc1ccc(-c2ccc(N[C@H](C)c3cnccn3)cc2)cc1 ZINC000466988703 339223561 /nfs/dbraw/zinc/22/35/61/339223561.db2.gz RSUKZTGAKAETQO-MRXNPFEDSA-N 0 0 317.436 5.269 20 0 DKADRN O=C(Nc1cccc(C(F)F)c1Cl)c1csc(Cl)c1 ZINC000466991864 339223735 /nfs/dbraw/zinc/22/37/35/339223735.db2.gz LJSVLTCUDHWFNX-UHFFFAOYSA-N 0 0 322.163 5.245 20 0 DKADRN CSc1ccc(Cl)cc1NC(=O)c1csc(Cl)c1 ZINC000466994449 339223896 /nfs/dbraw/zinc/22/38/96/339223896.db2.gz FOJCIEPLOTZPOT-UHFFFAOYSA-N 0 0 318.250 5.029 20 0 DKADRN CCC(C)(C)CC(=O)N(Cc1ccco1)c1ccc(F)cc1C ZINC000466994685 339223887 /nfs/dbraw/zinc/22/38/87/339223887.db2.gz KCIGZMXQWFITNZ-UHFFFAOYSA-N 0 0 317.404 5.087 20 0 DKADRN Cc1cc(C)cc(Oc2ccc(N[C@@H](C)c3cnccn3)cc2)c1 ZINC000466995570 339223836 /nfs/dbraw/zinc/22/38/36/339223836.db2.gz ZNVHJCMIWNCISH-INIZCTEOSA-N 0 0 319.408 5.059 20 0 DKADRN Cc1cc(C)cc(Oc2ccc(N[C@H](C)c3cnccn3)cc2)c1 ZINC000466995571 339223852 /nfs/dbraw/zinc/22/38/52/339223852.db2.gz ZNVHJCMIWNCISH-MRXNPFEDSA-N 0 0 319.408 5.059 20 0 DKADRN CCC(C)(C)CC(=O)Nc1c(F)cc(F)cc1-c1ccccc1 ZINC000466998205 339223976 /nfs/dbraw/zinc/22/39/76/339223976.db2.gz LOYRZSZPPZOVGO-UHFFFAOYSA-N 0 0 317.379 5.397 20 0 DKADRN Cc1oc2ccccc2c1CNC(=O)Nc1ccccc1C(C)C ZINC000467087913 339225936 /nfs/dbraw/zinc/22/59/36/339225936.db2.gz BUYPGMKTZWGPDN-UHFFFAOYSA-N 0 0 322.408 5.186 20 0 DKADRN CC(C)c1ccccc1NC(=O)N[C@H]1CCCc2sccc21 ZINC000467093780 339226110 /nfs/dbraw/zinc/22/61/10/339226110.db2.gz WLQKUBCKONHUEL-INIZCTEOSA-N 0 0 314.454 5.071 20 0 DKADRN CC(C)c1ccccc1NC(=O)N[C@@H]1CCCc2sccc21 ZINC000467093781 339226071 /nfs/dbraw/zinc/22/60/71/339226071.db2.gz WLQKUBCKONHUEL-MRXNPFEDSA-N 0 0 314.454 5.071 20 0 DKADRN Cc1cccc(C(C)C)c1NC(=O)N1CC(C)(C)CC(C)(C)C1 ZINC000467097280 339226192 /nfs/dbraw/zinc/22/61/92/339226192.db2.gz WZNVJGVNKLTDLL-UHFFFAOYSA-N 0 0 316.489 5.408 20 0 DKADRN CCC(C)(C)CC(=O)Nc1cc(C(F)(F)F)ccc1Cl ZINC000467103091 339226396 /nfs/dbraw/zinc/22/63/96/339226396.db2.gz OYKLTPXRZRYHIY-UHFFFAOYSA-N 0 0 307.743 5.124 20 0 DKADRN CC[C@H](C)Sc1ccc(NC(=O)N2[C@H](C)CC[C@H]2C)c(C)c1 ZINC000467106190 339226419 /nfs/dbraw/zinc/22/64/19/339226419.db2.gz INXJMFJHPXSFGM-KFWWJZLASA-N 0 0 320.502 5.290 20 0 DKADRN CC[C@H](C)Sc1ccc(NC(=O)N2[C@@H](C)CC[C@@H]2C)c(C)c1 ZINC000467106191 339226354 /nfs/dbraw/zinc/22/63/54/339226354.db2.gz INXJMFJHPXSFGM-KKUMJFAQSA-N 0 0 320.502 5.290 20 0 DKADRN CC[C@@H](C)Sc1ccc(NC(=O)N2[C@H](C)CC[C@@H]2C)c(C)c1 ZINC000467106192 339226415 /nfs/dbraw/zinc/22/64/15/339226415.db2.gz INXJMFJHPXSFGM-QLFBSQMISA-N 0 0 320.502 5.290 20 0 DKADRN CC[C@H](C)Sc1ccc(NC(=O)N2[C@H](C)CC[C@@H]2C)c(C)c1 ZINC000467106193 339226374 /nfs/dbraw/zinc/22/63/74/339226374.db2.gz INXJMFJHPXSFGM-ZNMIVQPWSA-N 0 0 320.502 5.290 20 0 DKADRN CC[C@@H]1Cc2ccccc2CN1C(=O)Nc1ccccc1C(C)C ZINC000467107708 339226536 /nfs/dbraw/zinc/22/65/36/339226536.db2.gz UBDVIVYTINFQAX-GOSISDBHSA-N 0 0 322.452 5.179 20 0 DKADRN CC[C@H]1Cc2ccccc2CN1C(=O)Nc1ccccc1C(C)C ZINC000467107709 339226457 /nfs/dbraw/zinc/22/64/57/339226457.db2.gz UBDVIVYTINFQAX-SFHVURJKSA-N 0 0 322.452 5.179 20 0 DKADRN CC[C@@H]1CCCC[C@@H]1N(C)C(=O)Nc1cccc(C(F)F)c1 ZINC000467114022 339226592 /nfs/dbraw/zinc/22/65/92/339226592.db2.gz KFZTZFYVKZLMTN-DOMZBBRYSA-N 0 0 310.388 5.057 20 0 DKADRN CC[C@@H]1CCCC[C@H]1N(C)C(=O)Nc1cccc(C(F)F)c1 ZINC000467114023 339226557 /nfs/dbraw/zinc/22/65/57/339226557.db2.gz KFZTZFYVKZLMTN-IUODEOHRSA-N 0 0 310.388 5.057 20 0 DKADRN CC[C@H]1CCCC[C@H]1N(C)C(=O)Nc1cccc(C(F)F)c1 ZINC000467114024 339226642 /nfs/dbraw/zinc/22/66/42/339226642.db2.gz KFZTZFYVKZLMTN-SWLSCSKDSA-N 0 0 310.388 5.057 20 0 DKADRN CC[C@H]1CCCC[C@@H]1N(C)C(=O)Nc1cccc(C(F)F)c1 ZINC000467114025 339226615 /nfs/dbraw/zinc/22/66/15/339226615.db2.gz KFZTZFYVKZLMTN-WFASDCNBSA-N 0 0 310.388 5.057 20 0 DKADRN CC(C)C[C@@H]1CCCCN1C(=O)Nc1cccc(C(F)F)c1 ZINC000467114332 339226570 /nfs/dbraw/zinc/22/65/70/339226570.db2.gz RKZHYUWOWFRNLK-HNNXBMFYSA-N 0 0 310.388 5.057 20 0 DKADRN CC(C)C[C@H]1CCCCN1C(=O)Nc1cccc(C(F)F)c1 ZINC000467114333 339226576 /nfs/dbraw/zinc/22/65/76/339226576.db2.gz RKZHYUWOWFRNLK-OAHLLOKOSA-N 0 0 310.388 5.057 20 0 DKADRN Cc1cccc(C[N@@H+](C)[C@H](C)c2ccc(-c3ccccc3)cc2)n1 ZINC000467135455 339226898 /nfs/dbraw/zinc/22/68/98/339226898.db2.gz AYCMPQPHPIJUPG-GOSISDBHSA-N 0 0 316.448 5.250 20 0 DKADRN Cc1cccc(C[N@@H+](C)[C@@H](C)c2ccc(-c3ccccc3)cc2)n1 ZINC000467135461 339226904 /nfs/dbraw/zinc/22/69/04/339226904.db2.gz AYCMPQPHPIJUPG-SFHVURJKSA-N 0 0 316.448 5.250 20 0 DKADRN C[C@H]1CC[C@H](C)N1C(=O)Nc1ccccc1SC1CCCC1 ZINC000467191317 339227552 /nfs/dbraw/zinc/22/75/52/339227552.db2.gz NYTHMJHSAFSLJM-KBPBESRZSA-N 0 0 318.486 5.126 20 0 DKADRN C[C@@H]1CC[C@H](C)N1C(=O)Nc1ccccc1SC1CCCC1 ZINC000467191318 339227594 /nfs/dbraw/zinc/22/75/94/339227594.db2.gz NYTHMJHSAFSLJM-OKILXGFUSA-N 0 0 318.486 5.126 20 0 DKADRN C[C@@H]1CC[C@@H](C)N1C(=O)Nc1ccccc1SC1CCCC1 ZINC000467191319 339227482 /nfs/dbraw/zinc/22/74/82/339227482.db2.gz NYTHMJHSAFSLJM-ZIAGYGMSSA-N 0 0 318.486 5.126 20 0 DKADRN C[C@H]1CC[C@H](C)N1C(=O)Nc1ccc(SC2CCCC2)cc1 ZINC000467191489 339227599 /nfs/dbraw/zinc/22/75/99/339227599.db2.gz NFUUSARNNABFIU-KBPBESRZSA-N 0 0 318.486 5.126 20 0 DKADRN C[C@@H]1CC[C@H](C)N1C(=O)Nc1ccc(SC2CCCC2)cc1 ZINC000467191490 339227486 /nfs/dbraw/zinc/22/74/86/339227486.db2.gz NFUUSARNNABFIU-OKILXGFUSA-N 0 0 318.486 5.126 20 0 DKADRN C[C@@H]1CC[C@@H](C)N1C(=O)Nc1ccc(SC2CCCC2)cc1 ZINC000467191491 339227638 /nfs/dbraw/zinc/22/76/38/339227638.db2.gz NFUUSARNNABFIU-ZIAGYGMSSA-N 0 0 318.486 5.126 20 0 DKADRN CC(C)c1ccc(NC(=O)N2[C@H](C)CC[C@@H]2C)c(C(C)C)c1 ZINC000467195587 339227862 /nfs/dbraw/zinc/22/78/62/339227862.db2.gz MKGXOYPOOWTQTO-GASCZTMLSA-N 0 0 302.462 5.338 20 0 DKADRN CC(C)c1ccc(NC(=O)N2[C@@H](C)CC[C@@H]2C)c(C(C)C)c1 ZINC000467195588 339227905 /nfs/dbraw/zinc/22/79/05/339227905.db2.gz MKGXOYPOOWTQTO-GJZGRUSLSA-N 0 0 302.462 5.338 20 0 DKADRN CC(C)c1ccc(NC(=O)N2[C@H](C)CC[C@H]2C)c(C(C)C)c1 ZINC000467195589 339227967 /nfs/dbraw/zinc/22/79/67/339227967.db2.gz MKGXOYPOOWTQTO-HUUCEWRRSA-N 0 0 302.462 5.338 20 0 DKADRN CC[C@@H](C)N(C(=O)c1ccc(-c2cccs2)o1)[C@@H](C)CC ZINC000467207089 339228257 /nfs/dbraw/zinc/22/82/57/339228257.db2.gz PIYCSIUXBRHBBN-BETUJISGSA-N 0 0 305.443 5.047 20 0 DKADRN CC[C@@H](C)N(C(=O)c1ccc(-c2cccs2)o1)[C@H](C)CC ZINC000467207090 339228151 /nfs/dbraw/zinc/22/81/51/339228151.db2.gz PIYCSIUXBRHBBN-CHWSQXEVSA-N 0 0 305.443 5.047 20 0 DKADRN CC[C@H](C)N(C(=O)c1ccc(-c2cccs2)o1)[C@@H](C)CC ZINC000467207091 339228180 /nfs/dbraw/zinc/22/81/80/339228180.db2.gz PIYCSIUXBRHBBN-STQMWFEESA-N 0 0 305.443 5.047 20 0 DKADRN CC(C)C[C@@H]1CCCCN1C(=O)Nc1ccccc1C(C)(C)C ZINC000467207392 339228297 /nfs/dbraw/zinc/22/82/97/339228297.db2.gz QOCGFQYERUQTMR-INIZCTEOSA-N 0 0 316.489 5.417 20 0 DKADRN CC(C)C[C@H]1CCCCN1C(=O)Nc1ccccc1C(C)(C)C ZINC000467207393 339228326 /nfs/dbraw/zinc/22/83/26/339228326.db2.gz QOCGFQYERUQTMR-MRXNPFEDSA-N 0 0 316.489 5.417 20 0 DKADRN CCC[C@H]1CCCN(C(=O)Nc2ccccc2C(C)(C)C)C1 ZINC000467208374 339228303 /nfs/dbraw/zinc/22/83/03/339228303.db2.gz VGTITYYGTSITTE-HNNXBMFYSA-N 0 0 302.462 5.028 20 0 DKADRN CCC[C@@H]1CCCN(C(=O)Nc2ccccc2C(C)(C)C)C1 ZINC000467208375 337190810 /nfs/dbraw/zinc/19/08/10/337190810.db2.gz VGTITYYGTSITTE-OAHLLOKOSA-N 0 0 302.462 5.028 20 0 DKADRN CC[C@@H](C)N(C(=O)CC1CCC(C(F)(F)F)CC1)[C@@H](C)CC ZINC000467209079 339228342 /nfs/dbraw/zinc/22/83/42/339228342.db2.gz VWKCEKFQVCXBRD-DGKWVBSXSA-N 0 0 321.427 5.171 20 0 DKADRN CC[C@H](C)N(C(=O)CC1CCC(C(F)(F)F)CC1)[C@@H](C)CC ZINC000467209080 339228319 /nfs/dbraw/zinc/22/83/19/339228319.db2.gz VWKCEKFQVCXBRD-HESLUPGFSA-N 0 0 321.427 5.171 20 0 DKADRN CC[C@@H](C)N(C(=O)CC1CCC(C(F)(F)F)CC1)[C@H](C)CC ZINC000467209081 339228327 /nfs/dbraw/zinc/22/83/27/339228327.db2.gz VWKCEKFQVCXBRD-LMRVLLHPSA-N 0 0 321.427 5.171 20 0 DKADRN Cc1cccc(C(C)C)c1NC(=O)N1CCCC[C@H]1CC(C)C ZINC000467211385 339228518 /nfs/dbraw/zinc/22/85/18/339228518.db2.gz INYLJGXVEMVZRC-KRWDZBQOSA-N 0 0 316.489 5.551 20 0 DKADRN Cc1cccc(C(C)C)c1NC(=O)N1CCCC[C@@H]1CC(C)C ZINC000467211386 339228474 /nfs/dbraw/zinc/22/84/74/339228474.db2.gz INYLJGXVEMVZRC-QGZVFWFLSA-N 0 0 316.489 5.551 20 0 DKADRN CC(C)C[C@@H]1CCCCN1C(=O)Nc1ccccc1C(C)C ZINC000467211518 339228424 /nfs/dbraw/zinc/22/84/24/339228424.db2.gz MMJGKLLTSAYOQG-INIZCTEOSA-N 0 0 302.462 5.243 20 0 DKADRN CC(C)C[C@H]1CCCCN1C(=O)Nc1ccccc1C(C)C ZINC000467211519 339228455 /nfs/dbraw/zinc/22/84/55/339228455.db2.gz MMJGKLLTSAYOQG-MRXNPFEDSA-N 0 0 302.462 5.243 20 0 DKADRN CC[C@H](C)N(C(=O)c1cccc(-c2ccccn2)c1C)[C@@H](C)CC ZINC000467211844 339228403 /nfs/dbraw/zinc/22/84/03/339228403.db2.gz PJGGYHYXWGPLNE-HOTGVXAUSA-N 0 0 324.468 5.096 20 0 DKADRN CC[C@@H](C)N(C(=O)c1cccc(-c2ccccn2)c1C)[C@H](C)CC ZINC000467211845 339228475 /nfs/dbraw/zinc/22/84/75/339228475.db2.gz PJGGYHYXWGPLNE-HZPDHXFCSA-N 0 0 324.468 5.096 20 0 DKADRN CC[C@@H](C)N(C(=O)c1cccc(-c2ccccn2)c1C)[C@@H](C)CC ZINC000467211846 339228476 /nfs/dbraw/zinc/22/84/76/339228476.db2.gz PJGGYHYXWGPLNE-IYBDPMFKSA-N 0 0 324.468 5.096 20 0 DKADRN CC[C@H]1CCCC[C@H]1N(C)C(=O)Nc1c(C)cc(C)cc1C ZINC000467213482 339228599 /nfs/dbraw/zinc/22/85/99/339228599.db2.gz NGIISNHTODTSMC-DLBZAZTESA-N 0 0 302.462 5.044 20 0 DKADRN CC[C@@H]1CCCC[C@H]1N(C)C(=O)Nc1c(C)cc(C)cc1C ZINC000467213483 339228635 /nfs/dbraw/zinc/22/86/35/339228635.db2.gz NGIISNHTODTSMC-IAGOWNOFSA-N 0 0 302.462 5.044 20 0 DKADRN CC[C@H]1CCCC[C@@H]1N(C)C(=O)Nc1c(C)cc(C)cc1C ZINC000467213484 339228614 /nfs/dbraw/zinc/22/86/14/339228614.db2.gz NGIISNHTODTSMC-IRXDYDNUSA-N 0 0 302.462 5.044 20 0 DKADRN CC[C@@H]1CCCC[C@@H]1N(C)C(=O)Nc1c(C)cc(C)cc1C ZINC000467213485 339228624 /nfs/dbraw/zinc/22/86/24/339228624.db2.gz NGIISNHTODTSMC-SJORKVTESA-N 0 0 302.462 5.044 20 0 DKADRN Cc1cc(C)c(NC(=O)N2CCCC[C@H]2CC(C)C)c(C)c1 ZINC000467219514 339228748 /nfs/dbraw/zinc/22/87/48/339228748.db2.gz UDKQXMMHNCWEJX-KRWDZBQOSA-N 0 0 302.462 5.044 20 0 DKADRN Cc1cc(C)c(NC(=O)N2CCCC[C@@H]2CC(C)C)c(C)c1 ZINC000467219515 339228728 /nfs/dbraw/zinc/22/87/28/339228728.db2.gz UDKQXMMHNCWEJX-QGZVFWFLSA-N 0 0 302.462 5.044 20 0 DKADRN c1ccc2c(c1)cccc2-c1noc(-c2cccc3cnccc32)n1 ZINC000467254295 339229055 /nfs/dbraw/zinc/22/90/55/339229055.db2.gz PDHHUMJBMZKXTD-UHFFFAOYSA-N 0 0 323.355 5.105 20 0 DKADRN CC(C)(C)c1ccccc1NCc1nnc(-c2ccccc2)s1 ZINC000467254435 339229050 /nfs/dbraw/zinc/22/90/50/339229050.db2.gz PRVHUUMEJHARIT-UHFFFAOYSA-N 0 0 323.465 5.115 20 0 DKADRN CC/C=C\CCNc1cccc(NC(=O)c2ccccc2)c1C ZINC000467254671 339229008 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/nfs/dbraw/zinc/22/91/88/339229188.db2.gz DBNONRWWEQJXDY-UHFFFAOYSA-N 0 0 306.409 5.133 20 0 DKADRN Cc1ccc(-c2cnc(CNc3ccccc3C(C)C)o2)cc1 ZINC000467259911 339229146 /nfs/dbraw/zinc/22/91/46/339229146.db2.gz HBFHCTVHNZZNSE-UHFFFAOYSA-N 0 0 306.409 5.386 20 0 DKADRN CC(C)(C)c1ccc(NCc2ncc(-c3cccs3)o2)cc1 ZINC000467259998 339229134 /nfs/dbraw/zinc/22/91/34/339229134.db2.gz HZCGAVOZSAHZKJ-UHFFFAOYSA-N 0 0 312.438 5.313 20 0 DKADRN COc1ccc(-c2cnc(CNc3ccccc3C(C)C)o2)cc1 ZINC000467260670 339229140 /nfs/dbraw/zinc/22/91/40/339229140.db2.gz OAUIWQLHFGCCFT-UHFFFAOYSA-N 0 0 322.408 5.086 20 0 DKADRN CC(C)c1ccccc1NCc1ncc(-c2ccccc2F)o1 ZINC000467261480 339229122 /nfs/dbraw/zinc/22/91/22/339229122.db2.gz VQQWXNHEHJQPNJ-UHFFFAOYSA-N 0 0 310.372 5.216 20 0 DKADRN CC(C)c1ccc(NCc2ncc(-c3ccccc3F)o2)cc1 ZINC000467262448 339229237 /nfs/dbraw/zinc/22/92/37/339229237.db2.gz BKTDVUHINHYQMU-UHFFFAOYSA-N 0 0 310.372 5.216 20 0 DKADRN Cc1ccc(Cl)cc1NCc1ncc(-c2ccccc2F)o1 ZINC000467262839 339229213 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/nfs/dbraw/zinc/22/93/95/339229395.db2.gz DYZVJSJAEUMLSM-UHFFFAOYSA-N 0 0 316.763 5.055 20 0 DKADRN Cc1ccc(-c2cnc(CNc3ccc(Cl)c(F)c3)o2)cc1 ZINC000467267630 339229400 /nfs/dbraw/zinc/22/94/00/339229400.db2.gz ZEQXTYQLQFYNTN-UHFFFAOYSA-N 0 0 316.763 5.055 20 0 DKADRN Cc1ccc(-c2cnc(CNc3ccc(C)cc3Cl)o2)cc1 ZINC000467267898 339229434 /nfs/dbraw/zinc/22/94/34/339229434.db2.gz HKGMQWOUVMYFMI-UHFFFAOYSA-N 0 0 312.800 5.224 20 0 DKADRN Cc1ccc(-c2cnc(CNc3ccc(F)c(Cl)c3)o2)cc1 ZINC000467268196 339229398 /nfs/dbraw/zinc/22/93/98/339229398.db2.gz JCKNMAAGMMTISX-UHFFFAOYSA-N 0 0 316.763 5.055 20 0 DKADRN Cc1c(F)cccc1NCc1ncc(-c2cccc(Cl)c2)o1 ZINC000467268251 339229324 /nfs/dbraw/zinc/22/93/24/339229324.db2.gz JUAUBAGJNIAESA-UHFFFAOYSA-N 0 0 316.763 5.055 20 0 DKADRN Cc1ccc(-c2cnc(CNc3c(C)cc(C)cc3C)o2)cc1 ZINC000467268711 339229379 /nfs/dbraw/zinc/22/93/79/339229379.db2.gz MXCDGNOCDZQHCI-UHFFFAOYSA-N 0 0 306.409 5.187 20 0 DKADRN Cc1ccc(NCc2ncc(-c3ccccc3F)o2)c(Cl)c1 ZINC000467269165 339229427 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339229390 /nfs/dbraw/zinc/22/93/90/339229390.db2.gz XPQMQHYRMJBUSY-UHFFFAOYSA-N 0 0 312.800 5.224 20 0 DKADRN Cc1ccc(-c2cnc(CNc3cccc4c3CCCC4)o2)cc1 ZINC000467270530 339229570 /nfs/dbraw/zinc/22/95/70/339229570.db2.gz ABARAFBDCWYQLJ-UHFFFAOYSA-N 0 0 318.420 5.141 20 0 DKADRN CCCOc1ccccc1NCc1ncc(-c2ccc(C)cc2)o1 ZINC000467271048 339229507 /nfs/dbraw/zinc/22/95/07/339229507.db2.gz IAVURIXUZDRWPH-UHFFFAOYSA-N 0 0 322.408 5.051 20 0 DKADRN Cc1ccc(-c2cnc(CNc3ccc(C)c(Cl)c3)o2)cc1 ZINC000467271480 339229444 /nfs/dbraw/zinc/22/94/44/339229444.db2.gz OJVRFSRSKYKSOM-UHFFFAOYSA-N 0 0 312.800 5.224 20 0 DKADRN FC(F)(F)c1ccc(NCc2ncc(-c3cccs3)o2)cc1 ZINC000467271828 339229562 /nfs/dbraw/zinc/22/95/62/339229562.db2.gz UCZGMYUFFCBLMS-UHFFFAOYSA-N 0 0 324.327 5.034 20 0 DKADRN Cc1ccc(NCc2ncc(-c3ccccc3F)o2)cc1Cl ZINC000467271978 339229586 /nfs/dbraw/zinc/22/95/86/339229586.db2.gz WIDQRGJSKUJTGP-UHFFFAOYSA-N 0 0 316.763 5.055 20 0 DKADRN O=C(Nc1cccc(Nc2ccccc2)c1)c1ccoc1C1CC1 ZINC000467289867 339229980 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324.424 5.512 20 0 DKADRN Cc1c(F)cccc1NC(=O)N[C@@H](C)c1ccc2ccccc2c1 ZINC000467340008 339232526 /nfs/dbraw/zinc/23/25/26/339232526.db2.gz BDUCISRLLXBKAB-AWEZNQCLSA-N 0 0 322.383 5.170 20 0 DKADRN Cc1c(F)cccc1NC(=O)N[C@H](C)c1ccc2ccccc2c1 ZINC000467340009 339232544 /nfs/dbraw/zinc/23/25/44/339232544.db2.gz BDUCISRLLXBKAB-CQSZACIVSA-N 0 0 322.383 5.170 20 0 DKADRN CC[C@H](c1ccccc1)N(CC)C(=O)Nc1cccc(F)c1C ZINC000467340377 338843662 /nfs/dbraw/zinc/84/36/62/338843662.db2.gz GMOURGAATZHNKW-GOSISDBHSA-N 0 0 314.404 5.139 20 0 DKADRN Cc1c(F)cccc1NC(=O)N1CCC[C@H]1CC1CCCCC1 ZINC000467341387 339232657 /nfs/dbraw/zinc/23/26/57/339232657.db2.gz NUJRTOWKQBJFKN-INIZCTEOSA-N 0 0 318.436 5.101 20 0 DKADRN Cc1c(F)cccc1NC(=O)N1CCC[C@@H]1CC1CCCCC1 ZINC000467341388 339232615 /nfs/dbraw/zinc/23/26/15/339232615.db2.gz NUJRTOWKQBJFKN-MRXNPFEDSA-N 0 0 318.436 5.101 20 0 DKADRN CCSCc1cccc(N[C@@H](c2cncc(F)c2)C2CC2)c1 ZINC000467347837 339233017 /nfs/dbraw/zinc/23/30/17/339233017.db2.gz 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ZINC000467380460 339235494 /nfs/dbraw/zinc/23/54/94/339235494.db2.gz GNVHBPITWDLNQQ-GDBMZVCRSA-N 0 0 316.395 5.466 20 0 DKADRN Cc1cccnc1[C@H]1CCC[C@@H](Nc2cccc(C(F)F)c2)C1 ZINC000467380461 339235542 /nfs/dbraw/zinc/23/55/42/339235542.db2.gz GNVHBPITWDLNQQ-GOEBONIOSA-N 0 0 316.395 5.466 20 0 DKADRN Cc1cccnc1[C@H]1CCC[C@H](Nc2cccc(C(F)F)c2)C1 ZINC000467380462 339235500 /nfs/dbraw/zinc/23/55/00/339235500.db2.gz GNVHBPITWDLNQQ-HOCLYGCPSA-N 0 0 316.395 5.466 20 0 DKADRN Cc1cccnc1[C@@H]1CCC[C@H](Nc2cccc(C(F)F)c2)C1 ZINC000467380463 339235518 /nfs/dbraw/zinc/23/55/18/339235518.db2.gz GNVHBPITWDLNQQ-ZBFHGGJFSA-N 0 0 316.395 5.466 20 0 DKADRN CO[C@H](C)c1cccc(N[C@@H]2CCC[C@H](c3ncccc3C)C2)c1 ZINC000467382838 339235767 /nfs/dbraw/zinc/23/57/67/339235767.db2.gz RHLHXZMVZOOKCV-IMFGXOCKSA-N 0 0 324.468 5.236 20 0 DKADRN CO[C@H](C)c1cccc(N[C@H]2CCC[C@H](c3ncccc3C)C2)c1 ZINC000467382841 339235787 /nfs/dbraw/zinc/23/57/87/339235787.db2.gz RHLHXZMVZOOKCV-KPFFTGBYSA-N 0 0 324.468 5.236 20 0 DKADRN CO[C@H](C)c1cccc(N[C@H]2CCC[C@@H](c3ncccc3C)C2)c1 ZINC000467382842 339235780 /nfs/dbraw/zinc/23/57/80/339235780.db2.gz RHLHXZMVZOOKCV-POAQFYNOSA-N 0 0 324.468 5.236 20 0 DKADRN CO[C@H](C)c1cccc(N[C@@H]2CCC[C@@H](c3ncccc3C)C2)c1 ZINC000467382845 339235841 /nfs/dbraw/zinc/23/58/41/339235841.db2.gz RHLHXZMVZOOKCV-YVWKXTFCSA-N 0 0 324.468 5.236 20 0 DKADRN Cc1ccc(N[C@H](c2cncc(F)c2)C2CC2)cc1C(F)(F)F ZINC000467383669 339235858 /nfs/dbraw/zinc/23/58/58/339235858.db2.gz UGHXKQALENGHPY-INIZCTEOSA-N 0 0 324.321 5.111 20 0 DKADRN Cc1ccc(N[C@@H](c2cncc(F)c2)C2CC2)cc1C(F)(F)F ZINC000467383670 339235792 /nfs/dbraw/zinc/23/57/92/339235792.db2.gz UGHXKQALENGHPY-MRXNPFEDSA-N 0 0 324.321 5.111 20 0 DKADRN CSc1ccc(N[C@H](c2cncc(F)c2)C2CC2)cc1Cl ZINC000467384360 339235766 /nfs/dbraw/zinc/23/57/66/339235766.db2.gz WZGYFKGGOWZVCU-INIZCTEOSA-N 0 0 322.836 5.159 20 0 DKADRN CSc1ccc(N[C@@H](c2cncc(F)c2)C2CC2)cc1Cl ZINC000467384361 339235814 /nfs/dbraw/zinc/23/58/14/339235814.db2.gz WZGYFKGGOWZVCU-MRXNPFEDSA-N 0 0 322.836 5.159 20 0 DKADRN CCOCc1ccc(N[C@@H]2CCC[C@H](c3ncccc3C)C2)cc1 ZINC000467384872 339235980 /nfs/dbraw/zinc/23/59/80/339235980.db2.gz YLXSIQBOHVPCLJ-AZUAARDMSA-N 0 0 324.468 5.065 20 0 DKADRN CCOCc1ccc(N[C@H]2CCC[C@H](c3ncccc3C)C2)cc1 ZINC000467384873 339235924 /nfs/dbraw/zinc/23/59/24/339235924.db2.gz YLXSIQBOHVPCLJ-ICSRJNTNSA-N 0 0 324.468 5.065 20 0 DKADRN CCOCc1ccc(N[C@H]2CCC[C@@H](c3ncccc3C)C2)cc1 ZINC000467384874 339235988 /nfs/dbraw/zinc/23/59/88/339235988.db2.gz YLXSIQBOHVPCLJ-QUCCMNQESA-N 0 0 324.468 5.065 20 0 DKADRN CCOCc1ccc(N[C@@H]2CCC[C@@H](c3ncccc3C)C2)cc1 ZINC000467384875 339236001 /nfs/dbraw/zinc/23/60/01/339236001.db2.gz YLXSIQBOHVPCLJ-UYAOXDASSA-N 0 0 324.468 5.065 20 0 DKADRN COc1ccc2c(c1)[C@@H](Nc1ccc(SC)cc1)CCS2 ZINC000467388440 339236107 /nfs/dbraw/zinc/23/61/07/339236107.db2.gz GWHOIJKEWVWPQN-INIZCTEOSA-N 0 0 317.479 5.066 20 0 DKADRN COc1ccc2c(c1)[C@H](Nc1ccc(SC)cc1)CCS2 ZINC000467388441 339236149 /nfs/dbraw/zinc/23/61/49/339236149.db2.gz GWHOIJKEWVWPQN-MRXNPFEDSA-N 0 0 317.479 5.066 20 0 DKADRN Fc1cncc([C@@H](Nc2cc(Cl)cc(Cl)c2)C2CC2)c1 ZINC000467388658 339236174 /nfs/dbraw/zinc/23/61/74/339236174.db2.gz HWTUOSPFENGWIU-HNNXBMFYSA-N 0 0 311.187 5.091 20 0 DKADRN Fc1cncc([C@H](Nc2cc(Cl)cc(Cl)c2)C2CC2)c1 ZINC000467388659 339236073 /nfs/dbraw/zinc/23/60/73/339236073.db2.gz HWTUOSPFENGWIU-OAHLLOKOSA-N 0 0 311.187 5.091 20 0 DKADRN C[C@@H](Nc1cc(Cl)ccc1OCC1CCC1)c1ccccn1 ZINC000467398107 339236510 /nfs/dbraw/zinc/23/65/10/339236510.db2.gz FJOBFOCWUCDFGT-CYBMUJFWSA-N 0 0 316.832 5.087 20 0 DKADRN C[C@H](Nc1cc(Cl)ccc1OCC1CCC1)c1ccccn1 ZINC000467398108 339236540 /nfs/dbraw/zinc/23/65/40/339236540.db2.gz FJOBFOCWUCDFGT-ZDUSSCGKSA-N 0 0 316.832 5.087 20 0 DKADRN C[C@@H](Nc1cc(Cl)ccc1OCC1CCC1)c1cccnc1 ZINC000467398276 339236604 /nfs/dbraw/zinc/23/66/04/339236604.db2.gz GZLBPBLLBNYOPI-CYBMUJFWSA-N 0 0 316.832 5.087 20 0 DKADRN C[C@H](Nc1cc(Cl)ccc1OCC1CCC1)c1cccnc1 ZINC000467398277 339236585 /nfs/dbraw/zinc/23/65/85/339236585.db2.gz GZLBPBLLBNYOPI-ZDUSSCGKSA-N 0 0 316.832 5.087 20 0 DKADRN C[C@@H](Nc1cc(Cl)ccc1OCC1CCC1)c1cncs1 ZINC000467399799 339236669 /nfs/dbraw/zinc/23/66/69/339236669.db2.gz QTNGOHWJPOFFFR-LLVKDONJSA-N 0 0 322.861 5.149 20 0 DKADRN C[C@H](Nc1cc(Cl)ccc1OCC1CCC1)c1cncs1 ZINC000467399800 339236693 /nfs/dbraw/zinc/23/66/93/339236693.db2.gz QTNGOHWJPOFFFR-NSHDSACASA-N 0 0 322.861 5.149 20 0 DKADRN C[C@@H](Nc1cc(Cl)ccc1OCC1CCC1)c1nccs1 ZINC000467400182 339236720 /nfs/dbraw/zinc/23/67/20/339236720.db2.gz TVEJRBXGRBNUIR-LLVKDONJSA-N 0 0 322.861 5.149 20 0 DKADRN C[C@H](Nc1cc(Cl)ccc1OCC1CCC1)c1nccs1 ZINC000467400183 339236649 /nfs/dbraw/zinc/23/66/49/339236649.db2.gz TVEJRBXGRBNUIR-NSHDSACASA-N 0 0 322.861 5.149 20 0 DKADRN C[C@@H](Nc1cc(Cl)ccc1OCC1CCC1)c1ccncc1 ZINC000467401059 339236635 /nfs/dbraw/zinc/23/66/35/339236635.db2.gz XXIGOUMZDHBDKE-CYBMUJFWSA-N 0 0 316.832 5.087 20 0 DKADRN C[C@H](Nc1cc(Cl)ccc1OCC1CCC1)c1ccncc1 ZINC000467401060 339236655 /nfs/dbraw/zinc/23/66/55/339236655.db2.gz XXIGOUMZDHBDKE-ZDUSSCGKSA-N 0 0 316.832 5.087 20 0 DKADRN Cc1cc(N2CCCC[C@@H]2C)ccc1NC(=O)Nc1ccccc1 ZINC000467407782 339236937 /nfs/dbraw/zinc/23/69/37/339236937.db2.gz YARVWGQKWRCRCW-INIZCTEOSA-N 0 0 323.440 5.018 20 0 DKADRN Cc1cc(N2CCCC[C@H]2C)ccc1NC(=O)Nc1ccccc1 ZINC000467407783 339236879 /nfs/dbraw/zinc/23/68/79/339236879.db2.gz YARVWGQKWRCRCW-MRXNPFEDSA-N 0 0 323.440 5.018 20 0 DKADRN CSc1ccc([C@H](C)N[C@H](C)c2csc(C(C)C)n2)cc1 ZINC000467408225 339236980 /nfs/dbraw/zinc/23/69/80/339236980.db2.gz VXLZIDOSMGKLFL-QWHCGFSZSA-N 0 0 320.527 5.400 20 0 DKADRN CSc1ccc([C@H](C)N[C@@H](C)c2csc(C(C)C)n2)cc1 ZINC000467408226 339236894 /nfs/dbraw/zinc/23/68/94/339236894.db2.gz VXLZIDOSMGKLFL-STQMWFEESA-N 0 0 320.527 5.400 20 0 DKADRN COc1ccc2c(c1)[C@@H](Nc1cccc(SC)c1)CCS2 ZINC000467425257 339237774 /nfs/dbraw/zinc/23/77/74/339237774.db2.gz NKKQNXMKRSBFJB-INIZCTEOSA-N 0 0 317.479 5.066 20 0 DKADRN COc1ccc2c(c1)[C@H](Nc1cccc(SC)c1)CCS2 ZINC000467425258 339237803 /nfs/dbraw/zinc/23/78/03/339237803.db2.gz NKKQNXMKRSBFJB-MRXNPFEDSA-N 0 0 317.479 5.066 20 0 DKADRN CC(C)[C@@H](Nc1ccc(F)c(C2CC2)c1)c1ccc(F)cn1 ZINC000467435804 339238492 /nfs/dbraw/zinc/23/84/92/339238492.db2.gz URPLQMSDWFIBIP-GOSISDBHSA-N 0 0 302.368 5.046 20 0 DKADRN CC(C)[C@H](Nc1ccc(F)c(C2CC2)c1)c1ccc(F)cn1 ZINC000467435807 339238452 /nfs/dbraw/zinc/23/84/52/339238452.db2.gz URPLQMSDWFIBIP-SFHVURJKSA-N 0 0 302.368 5.046 20 0 DKADRN Fc1ccc(N[C@@H](c2ccccc2)c2ccccn2)cc1C1CC1 ZINC000467439061 339238704 /nfs/dbraw/zinc/23/87/04/339238704.db2.gz RWHSACFLTVOANT-NRFANRHFSA-N 0 0 318.395 5.300 20 0 DKADRN Fc1ccc(N[C@H](c2ccccc2)c2ccccn2)cc1C1CC1 ZINC000467439062 339238705 /nfs/dbraw/zinc/23/87/05/339238705.db2.gz RWHSACFLTVOANT-OAQYLSRUSA-N 0 0 318.395 5.300 20 0 DKADRN CC(C)c1ccc(NC(=O)N2CCC3(CCC3)C2)c(C(C)C)c1 ZINC000467440789 339238779 /nfs/dbraw/zinc/23/87/79/339238779.db2.gz XOCMDLXCFRTNEN-UHFFFAOYSA-N 0 0 314.473 5.341 20 0 DKADRN CSc1cccc(NC(=O)N2CC(C)(C)CC(C)(C)C2)c1C ZINC000467441381 339238770 /nfs/dbraw/zinc/23/87/70/339238770.db2.gz FJGGQRHUXSKIFR-UHFFFAOYSA-N 0 0 320.502 5.007 20 0 DKADRN CC[C@@]1(C)CCN(C(=O)Nc2c(C(C)C)cccc2C(C)C)C1 ZINC000467444595 339238997 /nfs/dbraw/zinc/23/89/97/339238997.db2.gz IDXGZXNEGOATNW-FQEVSTJZSA-N 0 0 316.489 5.587 20 0 DKADRN CC[C@]1(C)CCN(C(=O)Nc2c(C(C)C)cccc2C(C)C)C1 ZINC000467444596 339239034 /nfs/dbraw/zinc/23/90/34/339239034.db2.gz IDXGZXNEGOATNW-HXUWFJFHSA-N 0 0 316.489 5.587 20 0 DKADRN CSc1ccc([C@@H](C)N[C@H](C)c2csc(C(C)C)n2)cc1 ZINC000467450519 339239468 /nfs/dbraw/zinc/23/94/68/339239468.db2.gz VXLZIDOSMGKLFL-CHWSQXEVSA-N 0 0 320.527 5.400 20 0 DKADRN CSc1ccc([C@@H](C)N[C@@H](C)c2csc(C(C)C)n2)cc1 ZINC000467450520 339239484 /nfs/dbraw/zinc/23/94/84/339239484.db2.gz VXLZIDOSMGKLFL-OLZOCXBDSA-N 0 0 320.527 5.400 20 0 DKADRN CSc1ccc(C)c(NC(=O)N2CC(C)(C)CC(C)(C)C2)c1 ZINC000467468807 339240018 /nfs/dbraw/zinc/24/00/18/339240018.db2.gz TWFFTWZSHXBJBL-UHFFFAOYSA-N 0 0 320.502 5.007 20 0 DKADRN O=C(Nc1ccccc1Nc1ccccc1)c1ccoc1C1CC1 ZINC000467471220 339240159 /nfs/dbraw/zinc/24/01/59/339240159.db2.gz FUCNUHKVGUCKEM-UHFFFAOYSA-N 0 0 318.376 5.153 20 0 DKADRN CC[C@H](SCc1nccn1Cc1ccccc1)c1ccccc1 ZINC000467540196 339241439 /nfs/dbraw/zinc/24/14/39/339241439.db2.gz BLYKKADXWIMDHD-IBGZPJMESA-N 0 0 322.477 5.316 20 0 DKADRN CC[C@@H](SCc1nccn1Cc1ccccc1)c1ccccc1 ZINC000467540197 339241330 /nfs/dbraw/zinc/24/13/30/339241330.db2.gz BLYKKADXWIMDHD-LJQANCHMSA-N 0 0 322.477 5.316 20 0 DKADRN Cc1cccc([C@H](C)SCc2nccn2Cc2ccccc2)c1 ZINC000467544850 339241691 /nfs/dbraw/zinc/24/16/91/339241691.db2.gz XXZNPRYKLUXQGD-KRWDZBQOSA-N 0 0 322.477 5.234 20 0 DKADRN Cc1cccc([C@@H](C)SCc2nccn2Cc2ccccc2)c1 ZINC000467544851 339241634 /nfs/dbraw/zinc/24/16/34/339241634.db2.gz XXZNPRYKLUXQGD-QGZVFWFLSA-N 0 0 322.477 5.234 20 0 DKADRN CC[C@@H]1C[C@H](C)CN1C(=O)Nc1ccc(Oc2ccccc2)cc1 ZINC000467573037 339243032 /nfs/dbraw/zinc/24/30/32/339243032.db2.gz SZOQURXGQZJMEI-DOTOQJQBSA-N 0 0 324.424 5.131 20 0 DKADRN CC[C@@H]1C[C@@H](C)CN1C(=O)Nc1ccc(Oc2ccccc2)cc1 ZINC000467573038 339243105 /nfs/dbraw/zinc/24/31/05/339243105.db2.gz SZOQURXGQZJMEI-NVXWUHKLSA-N 0 0 324.424 5.131 20 0 DKADRN CC[C@H]1C[C@H](C)CN1C(=O)Nc1ccc(Oc2ccccc2)cc1 ZINC000467573039 339243024 /nfs/dbraw/zinc/24/30/24/339243024.db2.gz SZOQURXGQZJMEI-RDJZCZTQSA-N 0 0 324.424 5.131 20 0 DKADRN CC[C@H]1C[C@@H](C)CN1C(=O)Nc1ccc(Oc2ccccc2)cc1 ZINC000467573040 339243085 /nfs/dbraw/zinc/24/30/85/339243085.db2.gz SZOQURXGQZJMEI-WBVHZDCISA-N 0 0 324.424 5.131 20 0 DKADRN CC[C@H]1C[C@@H](C)CN1C(=O)Nc1c(C(C)C)cccc1C(C)C ZINC000467574780 339243220 /nfs/dbraw/zinc/24/32/20/339243220.db2.gz COPXDRFODDSCKF-CVEARBPZSA-N 0 0 316.489 5.586 20 0 DKADRN CC[C@H]1C[C@H](C)CN1C(=O)Nc1c(C(C)C)cccc1C(C)C ZINC000467574782 339243212 /nfs/dbraw/zinc/24/32/12/339243212.db2.gz COPXDRFODDSCKF-HOTGVXAUSA-N 0 0 316.489 5.586 20 0 DKADRN CC[C@@H]1C[C@@H](C)CN1C(=O)Nc1c(C(C)C)cccc1C(C)C ZINC000467574784 339243177 /nfs/dbraw/zinc/24/31/77/339243177.db2.gz COPXDRFODDSCKF-HZPDHXFCSA-N 0 0 316.489 5.586 20 0 DKADRN CC[C@@H]1C[C@H](C)CN1C(=O)Nc1c(C(C)C)cccc1C(C)C ZINC000467574792 339243174 /nfs/dbraw/zinc/24/31/74/339243174.db2.gz COPXDRFODDSCKF-JKSUJKDBSA-N 0 0 316.489 5.586 20 0 DKADRN CC[C@H]1C[C@H](C)CN1C(=O)Nc1ccccc1-c1cccs1 ZINC000467574819 339243214 /nfs/dbraw/zinc/24/32/14/339243214.db2.gz CZYFSPSZDMVWJW-KBPBESRZSA-N 0 0 314.454 5.067 20 0 DKADRN CC[C@H]1C[C@@H](C)CN1C(=O)Nc1ccccc1-c1cccs1 ZINC000467574820 339243158 /nfs/dbraw/zinc/24/31/58/339243158.db2.gz CZYFSPSZDMVWJW-KGLIPLIRSA-N 0 0 314.454 5.067 20 0 DKADRN CC[C@@H]1C[C@H](C)CN1C(=O)Nc1ccccc1-c1cccs1 ZINC000467574821 339243187 /nfs/dbraw/zinc/24/31/87/339243187.db2.gz CZYFSPSZDMVWJW-UONOGXRCSA-N 0 0 314.454 5.067 20 0 DKADRN CC[C@@H]1C[C@@H](C)CN1C(=O)Nc1ccccc1-c1cccs1 ZINC000467574822 339243197 /nfs/dbraw/zinc/24/31/97/339243197.db2.gz CZYFSPSZDMVWJW-ZIAGYGMSSA-N 0 0 314.454 5.067 20 0 DKADRN CCc1ccc(Cl)c(CC)c1NC(=O)N1C[C@@H](C)C[C@H]1CC ZINC000467575228 339243173 /nfs/dbraw/zinc/24/31/73/339243173.db2.gz FCUFMDLDYMYTFX-GXTWGEPZSA-N 0 0 322.880 5.117 20 0 DKADRN CCc1ccc(Cl)c(CC)c1NC(=O)N1C[C@@H](C)C[C@@H]1CC ZINC000467575230 339243147 /nfs/dbraw/zinc/24/31/47/339243147.db2.gz FCUFMDLDYMYTFX-JSGCOSHPSA-N 0 0 322.880 5.117 20 0 DKADRN CCc1ccc(Cl)c(CC)c1NC(=O)N1C[C@H](C)C[C@@H]1CC ZINC000467575232 339243206 /nfs/dbraw/zinc/24/32/06/339243206.db2.gz FCUFMDLDYMYTFX-OCCSQVGLSA-N 0 0 322.880 5.117 20 0 DKADRN CCc1ccc(Cl)c(CC)c1NC(=O)N1C[C@H](C)C[C@H]1CC ZINC000467575233 339243184 /nfs/dbraw/zinc/24/31/84/339243184.db2.gz FCUFMDLDYMYTFX-TZMCWYRMSA-N 0 0 322.880 5.117 20 0 DKADRN CC[C@@H]1C[C@H](C)CN1C(=O)Nc1ccccc1-c1ccccc1 ZINC000467575567 339243225 /nfs/dbraw/zinc/24/32/25/339243225.db2.gz JWIWUGVHVMWYJC-DOTOQJQBSA-N 0 0 308.425 5.006 20 0 DKADRN CC[C@@H]1C[C@@H](C)CN1C(=O)Nc1ccccc1-c1ccccc1 ZINC000467575568 339243155 /nfs/dbraw/zinc/24/31/55/339243155.db2.gz JWIWUGVHVMWYJC-NVXWUHKLSA-N 0 0 308.425 5.006 20 0 DKADRN CC[C@H]1C[C@H](C)CN1C(=O)Nc1ccccc1-c1ccccc1 ZINC000467575569 339243227 /nfs/dbraw/zinc/24/32/27/339243227.db2.gz JWIWUGVHVMWYJC-RDJZCZTQSA-N 0 0 308.425 5.006 20 0 DKADRN CC[C@H]1C[C@@H](C)CN1C(=O)Nc1ccccc1-c1ccccc1 ZINC000467575570 339243132 /nfs/dbraw/zinc/24/31/32/339243132.db2.gz JWIWUGVHVMWYJC-WBVHZDCISA-N 0 0 308.425 5.006 20 0 DKADRN CC[C@@H]1C[C@H](C)CN1C(=O)Nc1ccc2c(c1)oc1ccccc12 ZINC000467578337 339243228 /nfs/dbraw/zinc/24/32/28/339243228.db2.gz PBBSSKBELDRGFN-DZGCQCFKSA-N 0 0 322.408 5.238 20 0 DKADRN CC[C@H]1C[C@@H](C)CN1C(=O)Nc1ccc2c(c1)oc1ccccc12 ZINC000467578338 339243203 /nfs/dbraw/zinc/24/32/03/339243203.db2.gz PBBSSKBELDRGFN-HIFRSBDPSA-N 0 0 322.408 5.238 20 0 DKADRN CC[C@@H]1C[C@@H](C)CN1C(=O)Nc1ccc2c(c1)oc1ccccc12 ZINC000467578339 339243156 /nfs/dbraw/zinc/24/31/56/339243156.db2.gz PBBSSKBELDRGFN-UKRRQHHQSA-N 0 0 322.408 5.238 20 0 DKADRN CC[C@H]1C[C@H](C)CN1C(=O)Nc1ccc2c(c1)oc1ccccc12 ZINC000467578340 339243152 /nfs/dbraw/zinc/24/31/52/339243152.db2.gz PBBSSKBELDRGFN-ZFWWWQNUSA-N 0 0 322.408 5.238 20 0 DKADRN CC[C@H]1C[C@@H](C)CN1C(=O)Nc1ccccc1Oc1ccccc1 ZINC000467578749 339243198 /nfs/dbraw/zinc/24/31/98/339243198.db2.gz KJPVRYZSVAHPLJ-CVEARBPZSA-N 0 0 324.424 5.131 20 0 DKADRN CC[C@H]1C[C@H](C)CN1C(=O)Nc1ccccc1Oc1ccccc1 ZINC000467578750 339243149 /nfs/dbraw/zinc/24/31/49/339243149.db2.gz KJPVRYZSVAHPLJ-HOTGVXAUSA-N 0 0 324.424 5.131 20 0 DKADRN CC[C@@H]1C[C@@H](C)CN1C(=O)Nc1ccccc1Oc1ccccc1 ZINC000467578751 339243176 /nfs/dbraw/zinc/24/31/76/339243176.db2.gz KJPVRYZSVAHPLJ-HZPDHXFCSA-N 0 0 324.424 5.131 20 0 DKADRN CC[C@@H]1C[C@H](C)CN1C(=O)Nc1ccccc1Oc1ccccc1 ZINC000467578752 339243201 /nfs/dbraw/zinc/24/32/01/339243201.db2.gz KJPVRYZSVAHPLJ-JKSUJKDBSA-N 0 0 324.424 5.131 20 0 DKADRN CC[C@@H]1C[C@H](C)CN1C(=O)Nc1ccc(C(C)C)cc1C(C)C ZINC000467585368 339243236 /nfs/dbraw/zinc/24/32/36/339243236.db2.gz BJSDUGAMCMWIIR-DOTOQJQBSA-N 0 0 316.489 5.586 20 0 DKADRN CC[C@@H]1C[C@@H](C)CN1C(=O)Nc1ccc(C(C)C)cc1C(C)C ZINC000467585369 339243308 /nfs/dbraw/zinc/24/33/08/339243308.db2.gz BJSDUGAMCMWIIR-NVXWUHKLSA-N 0 0 316.489 5.586 20 0 DKADRN CC[C@H]1C[C@H](C)CN1C(=O)Nc1ccc(C(C)C)cc1C(C)C ZINC000467585370 339243268 /nfs/dbraw/zinc/24/32/68/339243268.db2.gz BJSDUGAMCMWIIR-RDJZCZTQSA-N 0 0 316.489 5.586 20 0 DKADRN CC[C@H]1C[C@@H](C)CN1C(=O)Nc1ccc(C(C)C)cc1C(C)C ZINC000467585371 339243293 /nfs/dbraw/zinc/24/32/93/339243293.db2.gz BJSDUGAMCMWIIR-WBVHZDCISA-N 0 0 316.489 5.586 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)c1cccc2c1CCC2 ZINC000467599646 339243415 /nfs/dbraw/zinc/24/34/15/339243415.db2.gz GDMBLYIQCVDXJY-UHFFFAOYSA-N 0 0 321.464 5.504 20 0 DKADRN CC[C@H]1C[C@H](C)CN1C(=O)Nc1cccc(-c2cccs2)c1 ZINC000467609100 339243535 /nfs/dbraw/zinc/24/35/35/339243535.db2.gz VAFSEEVXHNZDRV-BBRMVZONSA-N 0 0 314.454 5.067 20 0 DKADRN CC[C@H]1C[C@@H](C)CN1C(=O)Nc1cccc(-c2cccs2)c1 ZINC000467609101 339243459 /nfs/dbraw/zinc/24/34/59/339243459.db2.gz VAFSEEVXHNZDRV-CJNGLKHVSA-N 0 0 314.454 5.067 20 0 DKADRN CC[C@@H]1C[C@@H](C)CN1C(=O)Nc1cccc(-c2cccs2)c1 ZINC000467609102 339243504 /nfs/dbraw/zinc/24/35/04/339243504.db2.gz VAFSEEVXHNZDRV-CZUORRHYSA-N 0 0 314.454 5.067 20 0 DKADRN CC[C@@H]1C[C@H](C)CN1C(=O)Nc1cccc(-c2cccs2)c1 ZINC000467609103 339243521 /nfs/dbraw/zinc/24/35/21/339243521.db2.gz VAFSEEVXHNZDRV-XJKSGUPXSA-N 0 0 314.454 5.067 20 0 DKADRN CC[C@@H]1C[C@H](C)CN1C(=O)Nc1cccc(Oc2ccccc2)c1 ZINC000467611766 339243435 /nfs/dbraw/zinc/24/34/35/339243435.db2.gz VXPSLMKPKYFODL-DOTOQJQBSA-N 0 0 324.424 5.131 20 0 DKADRN CC[C@@H]1C[C@@H](C)CN1C(=O)Nc1cccc(Oc2ccccc2)c1 ZINC000467611767 339243524 /nfs/dbraw/zinc/24/35/24/339243524.db2.gz VXPSLMKPKYFODL-NVXWUHKLSA-N 0 0 324.424 5.131 20 0 DKADRN CC[C@H]1C[C@H](C)CN1C(=O)Nc1cccc(Oc2ccccc2)c1 ZINC000467611768 339243463 /nfs/dbraw/zinc/24/34/63/339243463.db2.gz VXPSLMKPKYFODL-RDJZCZTQSA-N 0 0 324.424 5.131 20 0 DKADRN CC[C@H]1C[C@@H](C)CN1C(=O)Nc1cccc(Oc2ccccc2)c1 ZINC000467611769 339243492 /nfs/dbraw/zinc/24/34/92/339243492.db2.gz VXPSLMKPKYFODL-WBVHZDCISA-N 0 0 324.424 5.131 20 0 DKADRN Cc1ccc(Cl)c(N[C@H](C)c2nc(C(F)(F)F)cs2)c1 ZINC000467628573 339243666 /nfs/dbraw/zinc/24/36/66/339243666.db2.gz HCUJSAINUZPZLH-MRVPVSSYSA-N 0 0 320.767 5.297 20 0 DKADRN Cc1ccc(Cl)c(N[C@@H](C)c2nc(C(F)(F)F)cs2)c1 ZINC000467628577 339243676 /nfs/dbraw/zinc/24/36/76/339243676.db2.gz HCUJSAINUZPZLH-QMMMGPOBSA-N 0 0 320.767 5.297 20 0 DKADRN Cc1cncc([C@H](C)Nc2ccc(N3CCCC[C@H]3C)cc2C)c1 ZINC000467629914 339243710 /nfs/dbraw/zinc/24/37/10/339243710.db2.gz NJHRXKCUMROYGJ-MSOLQXFVSA-N 0 0 323.484 5.250 20 0 DKADRN Cc1cncc([C@@H](C)Nc2ccc(N3CCCC[C@H]3C)cc2C)c1 ZINC000467629915 339243774 /nfs/dbraw/zinc/24/37/74/339243774.db2.gz NJHRXKCUMROYGJ-QZTJIDSGSA-N 0 0 323.484 5.250 20 0 DKADRN Cc1cncc([C@H](C)Nc2ccc(N3CCCC[C@@H]3C)cc2C)c1 ZINC000467629916 339243726 /nfs/dbraw/zinc/24/37/26/339243726.db2.gz NJHRXKCUMROYGJ-ROUUACIJSA-N 0 0 323.484 5.250 20 0 DKADRN Cc1cncc([C@@H](C)Nc2ccc(N3CCCC[C@@H]3C)cc2C)c1 ZINC000467629917 339243659 /nfs/dbraw/zinc/24/36/59/339243659.db2.gz NJHRXKCUMROYGJ-ZWKOTPCHSA-N 0 0 323.484 5.250 20 0 DKADRN Cc1ccc(N[C@H](C)c2nc(C(F)(F)F)cs2)c(Cl)c1 ZINC000467630736 339243548 /nfs/dbraw/zinc/24/35/48/339243548.db2.gz SAAHXGJEQCHPMD-MRVPVSSYSA-N 0 0 320.767 5.297 20 0 DKADRN Cc1ccc(N[C@@H](C)c2nc(C(F)(F)F)cs2)c(Cl)c1 ZINC000467630737 339243559 /nfs/dbraw/zinc/24/35/59/339243559.db2.gz SAAHXGJEQCHPMD-QMMMGPOBSA-N 0 0 320.767 5.297 20 0 DKADRN Cc1cncc([C@H](C)Nc2cccc(Oc3ccccc3)c2)c1 ZINC000467634670 339243690 /nfs/dbraw/zinc/24/36/90/339243690.db2.gz JPWABIPRCUCMFC-INIZCTEOSA-N 0 0 304.393 5.355 20 0 DKADRN Cc1cncc([C@@H](C)Nc2cccc(Oc3ccccc3)c2)c1 ZINC000467634671 339243732 /nfs/dbraw/zinc/24/37/32/339243732.db2.gz JPWABIPRCUCMFC-MRXNPFEDSA-N 0 0 304.393 5.355 20 0 DKADRN Cc1cccc(Cl)c1NC(=O)N1CCC2(CCCCC2)CC1 ZINC000467654325 339244015 /nfs/dbraw/zinc/24/40/15/339244015.db2.gz BVVOQLGFMQDEKQ-UHFFFAOYSA-N 0 0 320.864 5.227 20 0 DKADRN Cc1cc([C@@H](C)NC(=O)Nc2c(C)cccc2Cl)c(C)s1 ZINC000467655041 339243936 /nfs/dbraw/zinc/24/39/36/339243936.db2.gz JTMZYIXMAFXQIZ-LLVKDONJSA-N 0 0 322.861 5.209 20 0 DKADRN Cc1cc([C@H](C)NC(=O)Nc2c(C)cccc2Cl)c(C)s1 ZINC000467655042 339243975 /nfs/dbraw/zinc/24/39/75/339243975.db2.gz JTMZYIXMAFXQIZ-NSHDSACASA-N 0 0 322.861 5.209 20 0 DKADRN Cc1cccc(Cl)c1NC(=O)N(CC1CC1)C1CCCCC1 ZINC000467655133 339243952 /nfs/dbraw/zinc/24/39/52/339243952.db2.gz DNMZHOQNDLDHEY-UHFFFAOYSA-N 0 0 320.864 5.225 20 0 DKADRN Cc1cccc(Cl)c1NC(=O)N1CCC[C@H]1CCC(C)C ZINC000467655313 339243971 /nfs/dbraw/zinc/24/39/71/339243971.db2.gz FSOIHPRNXZCAOG-AWEZNQCLSA-N 0 0 308.853 5.081 20 0 DKADRN Cc1cccc(Cl)c1NC(=O)N1CCC[C@@H]1CCC(C)C ZINC000467655314 339243934 /nfs/dbraw/zinc/24/39/34/339243934.db2.gz FSOIHPRNXZCAOG-CQSZACIVSA-N 0 0 308.853 5.081 20 0 DKADRN Cc1cccc(Cl)c1NC(=O)N[C@H](C)c1ccc(Cl)cc1 ZINC000467655432 339243839 /nfs/dbraw/zinc/24/38/39/339243839.db2.gz MIVAGOMVTDTAEN-LLVKDONJSA-N 0 0 323.223 5.185 20 0 DKADRN Cc1cccc(Cl)c1NC(=O)N[C@@H](C)c1ccc(Cl)cc1 ZINC000467655433 339243795 /nfs/dbraw/zinc/24/37/95/339243795.db2.gz MIVAGOMVTDTAEN-NSHDSACASA-N 0 0 323.223 5.185 20 0 DKADRN Cc1cccc(Cl)c1NC(=O)N(CC(C)C)C1CCCC1 ZINC000467655588 339243987 /nfs/dbraw/zinc/24/39/87/339243987.db2.gz IMJCNXHQTUPIFG-UHFFFAOYSA-N 0 0 308.853 5.081 20 0 DKADRN Cc1cccc(Cl)c1NC(=O)N1CCCC2(CCCCC2)C1 ZINC000467656322 339243981 /nfs/dbraw/zinc/24/39/81/339243981.db2.gz MRZWQSFJEZEPEJ-UHFFFAOYSA-N 0 0 320.864 5.227 20 0 DKADRN Cc1cccc(Cl)c1NC(=O)NCc1cccc2ccccc21 ZINC000467657007 339243974 /nfs/dbraw/zinc/24/39/74/339243974.db2.gz BMPQMKALZLJUIH-UHFFFAOYSA-N 0 0 324.811 5.123 20 0 DKADRN CCC[C@@]1(C)CCCN(C(=O)Nc2c(C)cccc2Cl)C1 ZINC000467660883 339244060 /nfs/dbraw/zinc/24/40/60/339244060.db2.gz WQKIBUMNXFJXHE-KRWDZBQOSA-N 0 0 308.853 5.083 20 0 DKADRN CCC[C@]1(C)CCCN(C(=O)Nc2c(C)cccc2Cl)C1 ZINC000467660884 339244044 /nfs/dbraw/zinc/24/40/44/339244044.db2.gz WQKIBUMNXFJXHE-QGZVFWFLSA-N 0 0 308.853 5.083 20 0 DKADRN Cc1cccc(C(C)(C)NC(=O)Nc2c(C)cccc2Cl)c1 ZINC000467661921 339244026 /nfs/dbraw/zinc/24/40/26/339244026.db2.gz KYPNPCGYYOBZNF-UHFFFAOYSA-N 0 0 316.832 5.014 20 0 DKADRN CCCCC[C@H]1CCCN1C(=O)Nc1c(C)cccc1Cl ZINC000467661979 339244086 /nfs/dbraw/zinc/24/40/86/339244086.db2.gz LZPCFBURUGDICL-AWEZNQCLSA-N 0 0 308.853 5.225 20 0 DKADRN CCCCC[C@@H]1CCCN1C(=O)Nc1c(C)cccc1Cl ZINC000467661980 339244110 /nfs/dbraw/zinc/24/41/10/339244110.db2.gz LZPCFBURUGDICL-CQSZACIVSA-N 0 0 308.853 5.225 20 0 DKADRN CCC(CC)N(CC(C)C)C(=O)Nc1c(C)cccc1Cl ZINC000467662870 339244079 /nfs/dbraw/zinc/24/40/79/339244079.db2.gz ZRUYBKDVGCYXNA-UHFFFAOYSA-N 0 0 310.869 5.327 20 0 DKADRN CCC[C@H]1[C@H](C)CCCN1C(=O)Nc1c(C)cccc1Cl ZINC000467663148 339244150 /nfs/dbraw/zinc/24/41/50/339244150.db2.gz DASHOOOLUCUPLD-DOMZBBRYSA-N 0 0 308.853 5.081 20 0 DKADRN CCC[C@@H]1[C@H](C)CCCN1C(=O)Nc1c(C)cccc1Cl ZINC000467663149 339244183 /nfs/dbraw/zinc/24/41/83/339244183.db2.gz DASHOOOLUCUPLD-IUODEOHRSA-N 0 0 308.853 5.081 20 0 DKADRN CCC[C@@H]1[C@@H](C)CCCN1C(=O)Nc1c(C)cccc1Cl ZINC000467663150 339244215 /nfs/dbraw/zinc/24/42/15/339244215.db2.gz DASHOOOLUCUPLD-SWLSCSKDSA-N 0 0 308.853 5.081 20 0 DKADRN CCC[C@H]1[C@@H](C)CCCN1C(=O)Nc1c(C)cccc1Cl ZINC000467663151 339244218 /nfs/dbraw/zinc/24/42/18/339244218.db2.gz DASHOOOLUCUPLD-WFASDCNBSA-N 0 0 308.853 5.081 20 0 DKADRN Cc1cccc(Cl)c1NC(=O)Nc1ccccc1OC(C)C ZINC000467663236 339243861 /nfs/dbraw/zinc/24/38/61/339243861.db2.gz FATUQEYLLXMUQB-UHFFFAOYSA-N 0 0 318.804 5.080 20 0 DKADRN Cc1cccc(Cl)c1NC(=O)Nc1cccc2ccsc21 ZINC000467663884 339244208 /nfs/dbraw/zinc/24/42/08/339244208.db2.gz MXJCISJRIUVWRH-UHFFFAOYSA-N 0 0 316.813 5.507 20 0 DKADRN Cc1cccc(Cl)c1NC(=O)N[C@@H](C)c1c(C)cccc1C ZINC000467665614 339244134 /nfs/dbraw/zinc/24/41/34/339244134.db2.gz BSVVTCRWBJQEOW-AWEZNQCLSA-N 0 0 316.832 5.148 20 0 DKADRN Cc1cccc(Cl)c1NC(=O)N[C@H](C)c1c(C)cccc1C ZINC000467665615 339244212 /nfs/dbraw/zinc/24/42/12/339244212.db2.gz BSVVTCRWBJQEOW-CQSZACIVSA-N 0 0 316.832 5.148 20 0 DKADRN Cc1cccc(Cl)c1NC(=O)N1CCC[C@@H]1CC(C)(C)C ZINC000467666803 339244169 /nfs/dbraw/zinc/24/41/69/339244169.db2.gz PRAQTIXEQKDMDN-CYBMUJFWSA-N 0 0 308.853 5.081 20 0 DKADRN Cc1cccc(Cl)c1NC(=O)N1CCC[C@H]1CC(C)(C)C ZINC000467666804 339244143 /nfs/dbraw/zinc/24/41/43/339244143.db2.gz PRAQTIXEQKDMDN-ZDUSSCGKSA-N 0 0 308.853 5.081 20 0 DKADRN CCCOc1ccc(NC(=O)Nc2c(C)cccc2Cl)cc1 ZINC000467667804 339244219 /nfs/dbraw/zinc/24/42/19/339244219.db2.gz URLCQQPYPXPXSS-UHFFFAOYSA-N 0 0 318.804 5.081 20 0 DKADRN CCCOc1ccccc1NC(=O)Nc1c(C)cccc1Cl ZINC000467668583 339244173 /nfs/dbraw/zinc/24/41/73/339244173.db2.gz QTLOZPAQLUOUAZ-UHFFFAOYSA-N 0 0 318.804 5.081 20 0 DKADRN Cc1cccc(Cl)c1NC(=O)N[C@H](C)c1ccccc1Cl ZINC000467669269 339244138 /nfs/dbraw/zinc/24/41/38/339244138.db2.gz NOZDTHZIBDVJLC-LLVKDONJSA-N 0 0 323.223 5.185 20 0 DKADRN Cc1cccc(Cl)c1NC(=O)N[C@@H](C)c1ccccc1Cl ZINC000467669270 339244168 /nfs/dbraw/zinc/24/41/68/339244168.db2.gz NOZDTHZIBDVJLC-NSHDSACASA-N 0 0 323.223 5.185 20 0 DKADRN CC[C@@H](C)[C@@H]1CCCCN1C(=O)Nc1c(C)cccc1Cl ZINC000467671256 339244244 /nfs/dbraw/zinc/24/42/44/339244244.db2.gz INZZJMNTFWJJMJ-DOMZBBRYSA-N 0 0 308.853 5.081 20 0 DKADRN CC[C@@H](C)[C@H]1CCCCN1C(=O)Nc1c(C)cccc1Cl ZINC000467671257 339244285 /nfs/dbraw/zinc/24/42/85/339244285.db2.gz INZZJMNTFWJJMJ-IUODEOHRSA-N 0 0 308.853 5.081 20 0 DKADRN CC[C@H](C)[C@H]1CCCCN1C(=O)Nc1c(C)cccc1Cl ZINC000467671258 339244324 /nfs/dbraw/zinc/24/43/24/339244324.db2.gz INZZJMNTFWJJMJ-SWLSCSKDSA-N 0 0 308.853 5.081 20 0 DKADRN CC[C@H](C)[C@@H]1CCCCN1C(=O)Nc1c(C)cccc1Cl ZINC000467671259 339244243 /nfs/dbraw/zinc/24/42/43/339244243.db2.gz INZZJMNTFWJJMJ-WFASDCNBSA-N 0 0 308.853 5.081 20 0 DKADRN Cc1cccc(Cl)c1NC(=O)NCc1ccc2ccccc2c1 ZINC000467671361 339244323 /nfs/dbraw/zinc/24/43/23/339244323.db2.gz JUUHLENMXCLQBV-UHFFFAOYSA-N 0 0 324.811 5.123 20 0 DKADRN Cc1cccc(Cl)c1NC(=O)N(CC(C)C)CC(C)(C)C ZINC000467671944 339244295 /nfs/dbraw/zinc/24/42/95/339244295.db2.gz PYIRSBFAPJJZKQ-UHFFFAOYSA-N 0 0 310.869 5.184 20 0 DKADRN Cc1cccc(Cl)c1NC(=O)N[C@H](c1ccccc1)C(C)C ZINC000467672233 339244266 /nfs/dbraw/zinc/24/42/66/339244266.db2.gz TYAYARVAUXSODB-INIZCTEOSA-N 0 0 316.832 5.167 20 0 DKADRN Cc1cccc(Cl)c1NC(=O)N[C@@H](c1ccccc1)C(C)C ZINC000467672234 339244241 /nfs/dbraw/zinc/24/42/41/339244241.db2.gz TYAYARVAUXSODB-MRXNPFEDSA-N 0 0 316.832 5.167 20 0 DKADRN CCSc1cccc(NC(=O)Nc2c(C)cccc2Cl)c1 ZINC000467673913 339244251 /nfs/dbraw/zinc/24/42/51/339244251.db2.gz AOXDYDKCKKEIQG-UHFFFAOYSA-N 0 0 320.845 5.404 20 0 DKADRN Cc1cccc(Cl)c1NC(=O)N(C)CCC1CCCCC1 ZINC000467677419 339244292 /nfs/dbraw/zinc/24/42/92/339244292.db2.gz RGEHFQVPYWLFGJ-UHFFFAOYSA-N 0 0 308.853 5.083 20 0 DKADRN Cc1cccc(Cl)c1NC(=O)N1CCC[C@H]1C1CCCCC1 ZINC000467677774 339244254 /nfs/dbraw/zinc/24/42/54/339244254.db2.gz SJFDHFLRZGYOJI-INIZCTEOSA-N 0 0 320.864 5.225 20 0 DKADRN Cc1cccc(Cl)c1NC(=O)N1CCC[C@@H]1C1CCCCC1 ZINC000467677776 339244291 /nfs/dbraw/zinc/24/42/91/339244291.db2.gz SJFDHFLRZGYOJI-MRXNPFEDSA-N 0 0 320.864 5.225 20 0 DKADRN CCC1CCC(N(C)C(=O)Nc2c(C)cccc2Cl)CC1 ZINC000467682192 339244343 /nfs/dbraw/zinc/24/43/43/339244343.db2.gz MVOULJDRQREBGZ-UHFFFAOYSA-N 0 0 308.853 5.081 20 0 DKADRN CSc1cccc(NC(=O)Nc2c(C)cccc2Cl)c1C ZINC000467682433 339244348 /nfs/dbraw/zinc/24/43/48/339244348.db2.gz XUGMEBZYTUXEBL-UHFFFAOYSA-N 0 0 320.845 5.323 20 0 DKADRN Cc1cccc(Cl)c1NC(=O)N[C@H](C)c1cccc(Cl)c1 ZINC000467683298 339244375 /nfs/dbraw/zinc/24/43/75/339244375.db2.gz XYDPCSOJQUTAJD-LLVKDONJSA-N 0 0 323.223 5.185 20 0 DKADRN CCC[C@@H](C)[C@@H]1CCCN1C(=O)Nc1c(C)cccc1Cl ZINC000467683458 339244430 /nfs/dbraw/zinc/24/44/30/339244430.db2.gz ZVTUWDRJZRZVAI-DOMZBBRYSA-N 0 0 308.853 5.081 20 0 DKADRN CCC[C@@H](C)[C@H]1CCCN1C(=O)Nc1c(C)cccc1Cl ZINC000467683459 339244352 /nfs/dbraw/zinc/24/43/52/339244352.db2.gz ZVTUWDRJZRZVAI-IUODEOHRSA-N 0 0 308.853 5.081 20 0 DKADRN CCC[C@H](C)[C@H]1CCCN1C(=O)Nc1c(C)cccc1Cl ZINC000467683460 339244429 /nfs/dbraw/zinc/24/44/29/339244429.db2.gz ZVTUWDRJZRZVAI-SWLSCSKDSA-N 0 0 308.853 5.081 20 0 DKADRN CCC[C@H](C)[C@@H]1CCCN1C(=O)Nc1c(C)cccc1Cl ZINC000467683461 339244358 /nfs/dbraw/zinc/24/43/58/339244358.db2.gz ZVTUWDRJZRZVAI-WFASDCNBSA-N 0 0 308.853 5.081 20 0 DKADRN CC[C@H]1CCCC[C@H]1N(C)C(=O)Nc1c(C)cccc1Cl ZINC000467683527 339244369 /nfs/dbraw/zinc/24/43/69/339244369.db2.gz AVRBGWXLRHIZSQ-DZGCQCFKSA-N 0 0 308.853 5.081 20 0 DKADRN CC[C@@H]1CCCC[C@@H]1N(C)C(=O)Nc1c(C)cccc1Cl ZINC000467683528 339244419 /nfs/dbraw/zinc/24/44/19/339244419.db2.gz AVRBGWXLRHIZSQ-HIFRSBDPSA-N 0 0 308.853 5.081 20 0 DKADRN CC[C@@H]1CCCC[C@H]1N(C)C(=O)Nc1c(C)cccc1Cl ZINC000467683529 339244418 /nfs/dbraw/zinc/24/44/18/339244418.db2.gz AVRBGWXLRHIZSQ-UKRRQHHQSA-N 0 0 308.853 5.081 20 0 DKADRN CC[C@H]1CCCC[C@@H]1N(C)C(=O)Nc1c(C)cccc1Cl ZINC000467683530 339244389 /nfs/dbraw/zinc/24/43/89/339244389.db2.gz AVRBGWXLRHIZSQ-ZFWWWQNUSA-N 0 0 308.853 5.081 20 0 DKADRN Cc1cccc(Cl)c1NC(=O)N(C)C1CCC(C)(C)CC1 ZINC000467685639 339244425 /nfs/dbraw/zinc/24/44/25/339244425.db2.gz LJSMKEGBNBCFPJ-UHFFFAOYSA-N 0 0 308.853 5.081 20 0 DKADRN Cc1cccc([C@H](C)NC(=O)Nc2c(C)cccc2Cl)c1C ZINC000467686316 339244330 /nfs/dbraw/zinc/24/43/30/339244330.db2.gz QIDKCOLUHCAKPZ-AWEZNQCLSA-N 0 0 316.832 5.148 20 0 DKADRN Cc1cccc([C@@H](C)NC(=O)Nc2c(C)cccc2Cl)c1C ZINC000467686317 339244426 /nfs/dbraw/zinc/24/44/26/339244426.db2.gz QIDKCOLUHCAKPZ-CQSZACIVSA-N 0 0 316.832 5.148 20 0 DKADRN Cc1cccc(Cl)c1NC(=O)N1CCCC[C@H]1CC(C)C ZINC000467686456 339244373 /nfs/dbraw/zinc/24/43/73/339244373.db2.gz QWWBQKQAKYUQDX-AWEZNQCLSA-N 0 0 308.853 5.081 20 0 DKADRN Cc1cccc(Cl)c1NC(=O)N1CCCC[C@@H]1CC(C)C ZINC000467686457 339244347 /nfs/dbraw/zinc/24/43/47/339244347.db2.gz QWWBQKQAKYUQDX-CQSZACIVSA-N 0 0 308.853 5.081 20 0 DKADRN CSc1ccc(C)c(NC(=O)Nc2c(C)cccc2Cl)c1 ZINC000467686571 339244427 /nfs/dbraw/zinc/24/44/27/339244427.db2.gz MZPDXSUHNYFXOX-UHFFFAOYSA-N 0 0 320.845 5.323 20 0 DKADRN CC[C@H]1CN(C(=O)Nc2ccc(C)cc2)CC[C@H]1c1ccccc1 ZINC000467730761 339244960 /nfs/dbraw/zinc/24/49/60/339244960.db2.gz HGUPZSZFQACVBJ-FXAWDEMLSA-N 0 0 322.452 5.043 20 0 DKADRN CC[C@H]1CN(C(=O)Nc2ccc(C)cc2)CC[C@@H]1c1ccccc1 ZINC000467730762 339244902 /nfs/dbraw/zinc/24/49/02/339244902.db2.gz HGUPZSZFQACVBJ-PXNSSMCTSA-N 0 0 322.452 5.043 20 0 DKADRN CC[C@@H]1CN(C(=O)Nc2ccc(C)cc2)CC[C@@H]1c1ccccc1 ZINC000467730763 339244906 /nfs/dbraw/zinc/24/49/06/339244906.db2.gz HGUPZSZFQACVBJ-XLIONFOSSA-N 0 0 322.452 5.043 20 0 DKADRN CC[C@@H]1CN(C(=O)Nc2ccc(C)cc2)CC[C@H]1c1ccccc1 ZINC000467730764 339244949 /nfs/dbraw/zinc/24/49/49/339244949.db2.gz HGUPZSZFQACVBJ-YLJYHZDGSA-N 0 0 322.452 5.043 20 0 DKADRN Cc1cc(Cl)ccc1N[C@H](C)c1nc(C(F)(F)F)cs1 ZINC000467731520 339244848 /nfs/dbraw/zinc/24/48/48/339244848.db2.gz CKDYBQBVEUPVTJ-MRVPVSSYSA-N 0 0 320.767 5.297 20 0 DKADRN Cc1cc(Cl)ccc1N[C@@H](C)c1nc(C(F)(F)F)cs1 ZINC000467731521 339244808 /nfs/dbraw/zinc/24/48/08/339244808.db2.gz CKDYBQBVEUPVTJ-QMMMGPOBSA-N 0 0 320.767 5.297 20 0 DKADRN CSc1cccc(N[C@H](C)c2nc(C(F)(F)F)cs2)c1 ZINC000467732049 339244872 /nfs/dbraw/zinc/24/48/72/339244872.db2.gz FHQWYXKCMRGERS-MRVPVSSYSA-N 0 0 318.389 5.057 20 0 DKADRN CSc1cccc(N[C@@H](C)c2nc(C(F)(F)F)cs2)c1 ZINC000467732050 339244805 /nfs/dbraw/zinc/24/48/05/339244805.db2.gz FHQWYXKCMRGERS-QMMMGPOBSA-N 0 0 318.389 5.057 20 0 DKADRN Cc1ccc(N[C@H](C)c2nc(C(F)(F)F)cs2)cc1Cl ZINC000467733298 339245020 /nfs/dbraw/zinc/24/50/20/339245020.db2.gz KUDPECQUGDWLKV-MRVPVSSYSA-N 0 0 320.767 5.297 20 0 DKADRN Cc1ccc(N[C@@H](C)c2nc(C(F)(F)F)cs2)cc1Cl ZINC000467733299 339244952 /nfs/dbraw/zinc/24/49/52/339244952.db2.gz KUDPECQUGDWLKV-QMMMGPOBSA-N 0 0 320.767 5.297 20 0 DKADRN CC[C@H](N[C@H](C)c1nc(C(F)(F)F)cs1)c1cccs1 ZINC000467735221 339244493 /nfs/dbraw/zinc/24/44/93/339244493.db2.gz XGCLSQQAUDLJST-BDAKNGLRSA-N 0 0 320.405 5.025 20 0 DKADRN CC[C@@H](N[C@@H](C)c1nc(C(F)(F)F)cs1)c1cccs1 ZINC000467735222 339244503 /nfs/dbraw/zinc/24/45/03/339244503.db2.gz XGCLSQQAUDLJST-DTWKUNHWSA-N 0 0 320.405 5.025 20 0 DKADRN CC[C@H](N[C@@H](C)c1nc(C(F)(F)F)cs1)c1cccs1 ZINC000467735223 339244532 /nfs/dbraw/zinc/24/45/32/339244532.db2.gz XGCLSQQAUDLJST-IUCAKERBSA-N 0 0 320.405 5.025 20 0 DKADRN CC[C@@H](N[C@H](C)c1nc(C(F)(F)F)cs1)c1cccs1 ZINC000467735224 339244488 /nfs/dbraw/zinc/24/44/88/339244488.db2.gz XGCLSQQAUDLJST-RKDXNWHRSA-N 0 0 320.405 5.025 20 0 DKADRN CCC(CC)[C@@H]([NH2+][C@@H](C)c1cncc(C)c1)c1cccs1 ZINC000467735754 339245106 /nfs/dbraw/zinc/24/51/06/339245106.db2.gz PRDRROGQJLJCHO-KBXCAEBGSA-N 0 0 302.487 5.280 20 0 DKADRN CCC(CC)[C@H]([NH2+][C@H](C)c1cncc(C)c1)c1cccs1 ZINC000467735755 339245032 /nfs/dbraw/zinc/24/50/32/339245032.db2.gz PRDRROGQJLJCHO-KDOFPFPSSA-N 0 0 302.487 5.280 20 0 DKADRN CCC(CC)[C@H]([NH2+][C@@H](C)c1cncc(C)c1)c1cccs1 ZINC000467735756 339245054 /nfs/dbraw/zinc/24/50/54/339245054.db2.gz PRDRROGQJLJCHO-KSSFIOAISA-N 0 0 302.487 5.280 20 0 DKADRN CCC(CC)[C@@H]([NH2+][C@H](C)c1cncc(C)c1)c1cccs1 ZINC000467735757 339245154 /nfs/dbraw/zinc/24/51/54/339245154.db2.gz PRDRROGQJLJCHO-RDTXWAMCSA-N 0 0 302.487 5.280 20 0 DKADRN Cc1ccc([C@@H]([NH2+][C@@H](C)c2cncc(C)c2)c2ccccc2)cc1 ZINC000467735768 339245037 /nfs/dbraw/zinc/24/50/37/339245037.db2.gz PVIBBECRLSQWRU-AVRDEDQJSA-N 0 0 316.448 5.139 20 0 DKADRN Cc1ccc([C@@H]([NH2+][C@H](C)c2cncc(C)c2)c2ccccc2)cc1 ZINC000467735769 339245093 /nfs/dbraw/zinc/24/50/93/339245093.db2.gz PVIBBECRLSQWRU-GCJKJVERSA-N 0 0 316.448 5.139 20 0 DKADRN Cc1ccc([C@H]([NH2+][C@@H](C)c2cncc(C)c2)c2ccccc2)cc1 ZINC000467735770 339245034 /nfs/dbraw/zinc/24/50/34/339245034.db2.gz PVIBBECRLSQWRU-PGRDOPGGSA-N 0 0 316.448 5.139 20 0 DKADRN Cc1ccc([C@H]([NH2+][C@H](C)c2cncc(C)c2)c2ccccc2)cc1 ZINC000467735771 339245112 /nfs/dbraw/zinc/24/51/12/339245112.db2.gz PVIBBECRLSQWRU-XMSQKQJNSA-N 0 0 316.448 5.139 20 0 DKADRN C[C@H](Nc1cc(F)cc(Cl)c1)c1nc(C(F)(F)F)cs1 ZINC000467738129 339245243 /nfs/dbraw/zinc/24/52/43/339245243.db2.gz RUGXMNHFQVLGPS-LURJTMIESA-N 0 0 324.730 5.128 20 0 DKADRN C[C@@H](Nc1cc(F)cc(Cl)c1)c1nc(C(F)(F)F)cs1 ZINC000467738130 339245272 /nfs/dbraw/zinc/24/52/72/339245272.db2.gz RUGXMNHFQVLGPS-ZCFIWIBFSA-N 0 0 324.730 5.128 20 0 DKADRN CC(C)c1ccc(N[C@@H](C)c2nc(C(F)(F)F)cs2)cc1 ZINC000467738786 339245188 /nfs/dbraw/zinc/24/51/88/339245188.db2.gz ZASNITYTRORAEX-JTQLQIEISA-N 0 0 314.376 5.458 20 0 DKADRN CC(C)c1ccc(N[C@H](C)c2nc(C(F)(F)F)cs2)cc1 ZINC000467738787 339245184 /nfs/dbraw/zinc/24/51/84/339245184.db2.gz ZASNITYTRORAEX-SNVBAGLBSA-N 0 0 314.376 5.458 20 0 DKADRN CSc1ccc(N[C@H](C)c2nc(C(F)(F)F)cs2)cc1 ZINC000467739509 339245203 /nfs/dbraw/zinc/24/52/03/339245203.db2.gz BCKIYZQRWOLPNY-MRVPVSSYSA-N 0 0 318.389 5.057 20 0 DKADRN CSc1ccc(N[C@@H](C)c2nc(C(F)(F)F)cs2)cc1 ZINC000467739510 339245295 /nfs/dbraw/zinc/24/52/95/339245295.db2.gz BCKIYZQRWOLPNY-QMMMGPOBSA-N 0 0 318.389 5.057 20 0 DKADRN CC(C)c1cccc(N[C@@H](C)c2nc(C(F)(F)F)cs2)c1 ZINC000467740215 339245452 /nfs/dbraw/zinc/24/54/52/339245452.db2.gz LEIGEUMRKXZJOH-JTQLQIEISA-N 0 0 314.376 5.458 20 0 DKADRN CC(C)c1cccc(N[C@H](C)c2nc(C(F)(F)F)cs2)c1 ZINC000467740216 339245368 /nfs/dbraw/zinc/24/53/68/339245368.db2.gz LEIGEUMRKXZJOH-SNVBAGLBSA-N 0 0 314.376 5.458 20 0 DKADRN Cc1cncc([C@H](C)Nc2ccc(SC3CCCC3)cc2)c1 ZINC000467740476 334274307 /nfs/dbraw/zinc/27/43/07/334274307.db2.gz NJHPCRIOSGZOJW-HNNXBMFYSA-N 0 0 312.482 5.598 20 0 DKADRN Cc1cncc([C@@H](C)Nc2ccc(SC3CCCC3)cc2)c1 ZINC000467740483 334274118 /nfs/dbraw/zinc/27/41/18/334274118.db2.gz NJHPCRIOSGZOJW-OAHLLOKOSA-N 0 0 312.482 5.598 20 0 DKADRN Cc1ccc(Cl)cc1N[C@H](C)c1nc(C(F)(F)F)cs1 ZINC000467740624 339245420 /nfs/dbraw/zinc/24/54/20/339245420.db2.gz NYZXPKZBJNNRBY-MRVPVSSYSA-N 0 0 320.767 5.297 20 0 DKADRN Cc1ccc(Cl)cc1N[C@@H](C)c1nc(C(F)(F)F)cs1 ZINC000467740625 339245362 /nfs/dbraw/zinc/24/53/62/339245362.db2.gz NYZXPKZBJNNRBY-QMMMGPOBSA-N 0 0 320.767 5.297 20 0 DKADRN CCc1cnccc1[C@H](C)[C@@H](C)c1nc(C(F)(F)F)cs1 ZINC000467741807 339245425 /nfs/dbraw/zinc/24/54/25/339245425.db2.gz SSVKOJIMGBTBLB-NXEZZACHSA-N 0 0 314.376 5.027 20 0 DKADRN CCc1cnccc1[C@@H](C)[C@H](C)c1nc(C(F)(F)F)cs1 ZINC000467741808 339245353 /nfs/dbraw/zinc/24/53/53/339245353.db2.gz SSVKOJIMGBTBLB-UWVGGRQHSA-N 0 0 314.376 5.027 20 0 DKADRN CCc1cnccc1[C@@H](C)[C@@H](C)c1nc(C(F)(F)F)cs1 ZINC000467741809 339245318 /nfs/dbraw/zinc/24/53/18/339245318.db2.gz SSVKOJIMGBTBLB-VHSXEESVSA-N 0 0 314.376 5.027 20 0 DKADRN CCc1cnccc1[C@H](C)[C@H](C)c1nc(C(F)(F)F)cs1 ZINC000467741810 339245332 /nfs/dbraw/zinc/24/53/32/339245332.db2.gz SSVKOJIMGBTBLB-ZJUUUORDSA-N 0 0 314.376 5.027 20 0 DKADRN Cc1cncc([C@H](C)Nc2cccc(CSC(C)C)c2C)c1 ZINC000467744030 339245466 /nfs/dbraw/zinc/24/54/66/339245466.db2.gz FQCBBYRUDKMFFL-INIZCTEOSA-N 0 0 314.498 5.513 20 0 DKADRN Cc1cncc([C@@H](C)Nc2cccc(CSC(C)C)c2C)c1 ZINC000467744031 339245475 /nfs/dbraw/zinc/24/54/75/339245475.db2.gz FQCBBYRUDKMFFL-MRXNPFEDSA-N 0 0 314.498 5.513 20 0 DKADRN C[C@H](Nc1cccc2ccccc21)c1nc(C(F)(F)F)cs1 ZINC000467744461 339245524 /nfs/dbraw/zinc/24/55/24/339245524.db2.gz ALGGXJDCOBTVDK-JTQLQIEISA-N 0 0 322.355 5.488 20 0 DKADRN C[C@@H](Nc1cccc2ccccc21)c1nc(C(F)(F)F)cs1 ZINC000467744462 339245594 /nfs/dbraw/zinc/24/55/94/339245594.db2.gz ALGGXJDCOBTVDK-SNVBAGLBSA-N 0 0 322.355 5.488 20 0 DKADRN Cc1cncc([C@H](C)Nc2cccc(COC3CCCCC3)c2)c1 ZINC000467745554 339245509 /nfs/dbraw/zinc/24/55/09/339245509.db2.gz FPIKFAHRXKDXSL-KRWDZBQOSA-N 0 0 324.468 5.412 20 0 DKADRN Cc1cncc([C@@H](C)Nc2cccc(COC3CCCCC3)c2)c1 ZINC000467745555 339245670 /nfs/dbraw/zinc/24/56/70/339245670.db2.gz FPIKFAHRXKDXSL-QGZVFWFLSA-N 0 0 324.468 5.412 20 0 DKADRN Cc1cncc([C@@H](C)NC2(c3c(Cl)cccc3Cl)CC2)c1 ZINC000467747063 339245745 /nfs/dbraw/zinc/24/57/45/339245745.db2.gz QMCDPWZVVKHMIN-GFCCVEGCSA-N 0 0 321.251 5.037 20 0 DKADRN Cc1cncc([C@H](C)NC2(c3c(Cl)cccc3Cl)CC2)c1 ZINC000467747064 339245712 /nfs/dbraw/zinc/24/57/12/339245712.db2.gz QMCDPWZVVKHMIN-LBPRGKRZSA-N 0 0 321.251 5.037 20 0 DKADRN Cc1cncc([C@H](C)Nc2cccc(COC(C)(C)C)c2C)c1 ZINC000467747104 339245706 /nfs/dbraw/zinc/24/57/06/339245706.db2.gz QWGXDLNLKMFVQO-INIZCTEOSA-N 0 0 312.457 5.187 20 0 DKADRN Cc1cncc([C@@H](C)Nc2cccc(COC(C)(C)C)c2C)c1 ZINC000467747105 339245701 /nfs/dbraw/zinc/24/57/01/339245701.db2.gz QWGXDLNLKMFVQO-MRXNPFEDSA-N 0 0 312.457 5.187 20 0 DKADRN Cc1cncc([C@H](C)Nc2ccc(-c3cnc(C4CC4)o3)cc2)c1 ZINC000467747447 339245734 /nfs/dbraw/zinc/24/57/34/339245734.db2.gz SQOOEFNWFGBMBO-AWEZNQCLSA-N 0 0 319.408 5.096 20 0 DKADRN Cc1cncc([C@@H](C)Nc2ccc(-c3cnc(C4CC4)o3)cc2)c1 ZINC000467747448 339245664 /nfs/dbraw/zinc/24/56/64/339245664.db2.gz SQOOEFNWFGBMBO-CQSZACIVSA-N 0 0 319.408 5.096 20 0 DKADRN CCc1ccc(N[C@H](C)c2nc(C(F)(F)F)cs2)cc1F ZINC000467749870 339245858 /nfs/dbraw/zinc/24/58/58/339245858.db2.gz SIDNRWATUPFZOZ-MRVPVSSYSA-N 0 0 318.339 5.037 20 0 DKADRN CCc1ccc(N[C@@H](C)c2nc(C(F)(F)F)cs2)cc1F ZINC000467749871 339245807 /nfs/dbraw/zinc/24/58/07/339245807.db2.gz SIDNRWATUPFZOZ-QMMMGPOBSA-N 0 0 318.339 5.037 20 0 DKADRN C[C@H](Nc1ccc(F)c(Cl)c1)c1nc(C(F)(F)F)cs1 ZINC000467750407 339245840 /nfs/dbraw/zinc/24/58/40/339245840.db2.gz YNWMNKGOUMSNKY-LURJTMIESA-N 0 0 324.730 5.128 20 0 DKADRN C[C@@H](Nc1ccc(F)c(Cl)c1)c1nc(C(F)(F)F)cs1 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ZINC000467754656 339245838 /nfs/dbraw/zinc/24/58/38/339245838.db2.gz VYHDXHWQGKKOBT-ZDUSSCGKSA-N 0 0 304.821 5.005 20 0 DKADRN CC[C@H](C)Sc1ccc(NCc2nccn2C(C)C)c(C)c1 ZINC000467756627 339245852 /nfs/dbraw/zinc/24/58/52/339245852.db2.gz APLWCOPQKXBJCI-HNNXBMFYSA-N 0 0 317.502 5.275 20 0 DKADRN CC[C@@H](C)Sc1ccc(NCc2nccn2C(C)C)c(C)c1 ZINC000467756628 339245797 /nfs/dbraw/zinc/24/57/97/339245797.db2.gz APLWCOPQKXBJCI-OAHLLOKOSA-N 0 0 317.502 5.275 20 0 DKADRN CC(C)Sc1ccc(Cl)cc1NCc1nccn1C(C)C ZINC000467759144 339245948 /nfs/dbraw/zinc/24/59/48/339245948.db2.gz RHSOTZUQXTWPKV-UHFFFAOYSA-N 0 0 323.893 5.230 20 0 DKADRN CCOc1ccccc1[C@H](CC(C)C)NCc1ccc(Cl)o1 ZINC000467762368 339245924 /nfs/dbraw/zinc/24/59/24/339245924.db2.gz AQZKLBIQUVVQMU-INIZCTEOSA-N 0 0 321.848 5.209 20 0 DKADRN CCOc1ccccc1[C@@H](CC(C)C)NCc1ccc(Cl)o1 ZINC000467762369 339246001 /nfs/dbraw/zinc/24/60/01/339246001.db2.gz AQZKLBIQUVVQMU-MRXNPFEDSA-N 0 0 321.848 5.209 20 0 DKADRN CC(C)Sc1c(Cl)cccc1NCc1nccn1C(C)C ZINC000467763937 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CC(C)c1ccccc1NC(=O)C[C@H](C)Cc1cccc(F)c1 ZINC000468172548 339255858 /nfs/dbraw/zinc/25/58/58/339255858.db2.gz ABCFGUTXHOGJBX-OAHLLOKOSA-N 0 0 313.416 5.157 20 0 DKADRN Cc1ccc2[nH]cc(CCC(=O)Nc3ccccc3C(C)C)c2c1 ZINC000468174370 339255960 /nfs/dbraw/zinc/25/59/60/339255960.db2.gz QKSGXNMORZZPFN-UHFFFAOYSA-N 0 0 320.436 5.171 20 0 DKADRN Cc1ccc(C(=O)Nc2ccccc2C(C)C)c(F)c1Cl ZINC000468254731 339257620 /nfs/dbraw/zinc/25/76/20/339257620.db2.gz UZKYOFWCFSYFNM-UHFFFAOYSA-N 0 0 305.780 5.163 20 0 DKADRN CCC(CC)C(=O)N1CCC[C@H]1c1ccc(Cl)c(Cl)c1 ZINC000468273518 339258349 /nfs/dbraw/zinc/25/83/49/339258349.db2.gz YYMWCOAYCLTVPN-HNNXBMFYSA-N 0 0 314.256 5.093 20 0 DKADRN CCC(CC)C(=O)N1CCC[C@@H]1c1ccc(Cl)c(Cl)c1 ZINC000468273519 339258477 /nfs/dbraw/zinc/25/84/77/339258477.db2.gz YYMWCOAYCLTVPN-OAHLLOKOSA-N 0 0 314.256 5.093 20 0 DKADRN CCCSCC(=O)Nc1ccc(Cl)cc1-c1ccccc1 ZINC000468277417 339258746 /nfs/dbraw/zinc/25/87/46/339258746.db2.gz MUJLDQVXDBEOBB-UHFFFAOYSA-N 0 0 319.857 5.089 20 0 DKADRN 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CSCCCC(=O)Nc1ccc(Cl)cc1-c1ccccc1 ZINC000468292440 339259080 /nfs/dbraw/zinc/25/90/80/339259080.db2.gz RKSAPQKIYFURDG-UHFFFAOYSA-N 0 0 319.857 5.089 20 0 DKADRN CS[C@H](C)CC(=O)Nc1ccc(Cl)cc1-c1ccccc1 ZINC000468298980 339259297 /nfs/dbraw/zinc/25/92/97/339259297.db2.gz XQQIAUDYRWCJOR-GFCCVEGCSA-N 0 0 319.857 5.087 20 0 DKADRN CS[C@@H](C)CC(=O)Nc1ccc(Cl)cc1-c1ccccc1 ZINC000468298981 339259278 /nfs/dbraw/zinc/25/92/78/339259278.db2.gz XQQIAUDYRWCJOR-LBPRGKRZSA-N 0 0 319.857 5.087 20 0 DKADRN Cc1cccc(C)c1C(=O)N[C@@H](C)c1cc2ccccc2s1 ZINC000468301424 339259342 /nfs/dbraw/zinc/25/93/42/339259342.db2.gz BPAAQVDSZVVAFH-AWEZNQCLSA-N 0 0 309.434 5.009 20 0 DKADRN Cc1cccc(C)c1C(=O)N[C@H](C)c1cc2ccccc2s1 ZINC000468301425 339259338 /nfs/dbraw/zinc/25/93/38/339259338.db2.gz BPAAQVDSZVVAFH-CQSZACIVSA-N 0 0 309.434 5.009 20 0 DKADRN CC(C)c1ccsc1C(=O)N[C@H](C)c1cc2ccccc2o1 ZINC000468304968 339259350 /nfs/dbraw/zinc/25/93/50/339259350.db2.gz IFNUHPLHHBQSGD-GFCCVEGCSA-N 0 0 313.422 5.109 20 0 DKADRN Cc1cccc(C(C)C)c1NC(=O)Cc1cccc(C(F)F)c1 ZINC000468346004 339260301 /nfs/dbraw/zinc/26/03/01/339260301.db2.gz AZIBYWYQITYTSU-UHFFFAOYSA-N 0 0 317.379 5.237 20 0 DKADRN Cc1cccc(C(C)C)c1NC(=O)Cc1ccc(Cl)c(F)c1 ZINC000468350352 339260373 /nfs/dbraw/zinc/26/03/73/339260373.db2.gz PWFOXYAMTHDMLS-UHFFFAOYSA-N 0 0 319.807 5.092 20 0 DKADRN O=C(Cc1cccc(C(F)F)c1)Nc1ccc(C2CCC2)cc1 ZINC000468401351 339261928 /nfs/dbraw/zinc/26/19/28/339261928.db2.gz JRMFODPWEDWVIJ-UHFFFAOYSA-N 0 0 315.363 5.073 20 0 DKADRN O=C(Cc1cccc(C(F)F)c1)Nc1cccc2ccsc21 ZINC000468414581 339262537 /nfs/dbraw/zinc/26/25/37/339262537.db2.gz LGOYOKNWYVGBSC-UHFFFAOYSA-N 0 0 317.360 5.020 20 0 DKADRN C[C@@H](SC1CCC(C)(C)CC1)c1nc2ccccc2c(=O)[nH]1 ZINC000468421953 339262600 /nfs/dbraw/zinc/26/26/00/339262600.db2.gz VSWJQPYXDRTWPE-GFCCVEGCSA-N 0 0 316.470 5.098 20 0 DKADRN C[C@H](SC1CCC(C)(C)CC1)c1nc2ccccc2c(=O)[nH]1 ZINC000468421954 339262599 /nfs/dbraw/zinc/26/25/99/339262599.db2.gz VSWJQPYXDRTWPE-LBPRGKRZSA-N 0 0 316.470 5.098 20 0 DKADRN CCCC[C@H](CC)C(=O)N(C)[C@H](C)c1sc(C(C)C)nc1C ZINC000468434138 339262794 /nfs/dbraw/zinc/26/27/94/339262794.db2.gz DUOJEQOBNVDUHN-CABCVRRESA-N 0 0 324.534 5.311 20 0 DKADRN CCCC[C@H](CC)C(=O)N(C)[C@@H](C)c1sc(C(C)C)nc1C ZINC000468434139 339262850 /nfs/dbraw/zinc/26/28/50/339262850.db2.gz DUOJEQOBNVDUHN-GJZGRUSLSA-N 0 0 324.534 5.311 20 0 DKADRN CCCC[C@@H](CC)C(=O)N(C)[C@H](C)c1sc(C(C)C)nc1C ZINC000468434140 339262809 /nfs/dbraw/zinc/26/28/09/339262809.db2.gz DUOJEQOBNVDUHN-HUUCEWRRSA-N 0 0 324.534 5.311 20 0 DKADRN CCCC[C@@H](CC)C(=O)N(C)[C@@H](C)c1sc(C(C)C)nc1C ZINC000468434141 339262837 /nfs/dbraw/zinc/26/28/37/339262837.db2.gz DUOJEQOBNVDUHN-LSDHHAIUSA-N 0 0 324.534 5.311 20 0 DKADRN O=C(Cc1cccc(C(F)F)c1)Nc1csc2ccccc12 ZINC000468436710 339262839 /nfs/dbraw/zinc/26/28/39/339262839.db2.gz QAKUEPDRJNHNQI-UHFFFAOYSA-N 0 0 317.360 5.020 20 0 DKADRN CCCc1ccccc1NC(=O)CCc1c[nH]c2ccc(C)cc12 ZINC000468482626 339263838 /nfs/dbraw/zinc/26/38/38/339263838.db2.gz COZJVWCAXOTXAU-UHFFFAOYSA-N 0 0 320.436 5.000 20 0 DKADRN CCCc1ccccc1NC(=O)c1cc(-c2ccccc2)ns1 ZINC000468483730 339263865 /nfs/dbraw/zinc/26/38/65/339263865.db2.gz NBPUHBJMPFZJPE-UHFFFAOYSA-N 0 0 322.433 5.015 20 0 DKADRN Cc1nc(CN(c2ccccc2)[C@@H](C)c2ccccc2)oc1C ZINC000468504114 339264621 /nfs/dbraw/zinc/26/46/21/339264621.db2.gz DQXQVVRWOAENAG-INIZCTEOSA-N 0 0 306.409 5.059 20 0 DKADRN Cc1nc(CN(c2ccccc2)[C@H](C)c2ccccc2)oc1C ZINC000468504115 339264623 /nfs/dbraw/zinc/26/46/23/339264623.db2.gz DQXQVVRWOAENAG-MRXNPFEDSA-N 0 0 306.409 5.059 20 0 DKADRN Cc1sccc1CC(=O)Nc1ccccc1Oc1ccccc1 ZINC000468527874 339265501 /nfs/dbraw/zinc/26/55/01/339265501.db2.gz JAKINLHZXNUUDV-UHFFFAOYSA-N 0 0 323.417 5.030 20 0 DKADRN Cc1ccc(-c2nnc([C@H](C)Sc3ccccc3)o2)cc1C ZINC000468628239 339267339 /nfs/dbraw/zinc/26/73/39/339267339.db2.gz JBJKWOFPTIBPSP-AWEZNQCLSA-N 0 0 310.422 5.207 20 0 DKADRN Cc1ccc(-c2nnc([C@@H](C)Sc3ccccc3)o2)cc1C ZINC000468628240 339267352 /nfs/dbraw/zinc/26/73/52/339267352.db2.gz JBJKWOFPTIBPSP-CQSZACIVSA-N 0 0 310.422 5.207 20 0 DKADRN Cc1ccc(CS[C@@H](C)c2nnc(-c3ccccc3)o2)cc1C ZINC000468631417 339267491 /nfs/dbraw/zinc/26/74/91/339267491.db2.gz RJIXNVGMGACMCK-HNNXBMFYSA-N 0 0 324.449 5.348 20 0 DKADRN Cc1ccc(CS[C@H](C)c2nnc(-c3ccccc3)o2)cc1C ZINC000468631418 339267447 /nfs/dbraw/zinc/26/74/47/339267447.db2.gz RJIXNVGMGACMCK-OAHLLOKOSA-N 0 0 324.449 5.348 20 0 DKADRN Cc1ccc(-c2nnc([C@@H](C)SC3CCCC3)o2)cc1C ZINC000468636739 339267644 /nfs/dbraw/zinc/26/76/44/339267644.db2.gz DNKUKUCDFPXDIC-CYBMUJFWSA-N 0 0 302.443 5.090 20 0 DKADRN Cc1ccc(-c2nnc([C@H](C)SC3CCCC3)o2)cc1C ZINC000468636740 339267728 /nfs/dbraw/zinc/26/77/28/339267728.db2.gz DNKUKUCDFPXDIC-ZDUSSCGKSA-N 0 0 302.443 5.090 20 0 DKADRN Cc1ccc(-c2nnc([C@H](C)SCc3ccccc3)o2)cc1C ZINC000468637157 339267739 /nfs/dbraw/zinc/26/77/39/339267739.db2.gz HHGHDGSMNMEHEN-HNNXBMFYSA-N 0 0 324.449 5.348 20 0 DKADRN Cc1ccc(-c2nnc([C@@H](C)SCc3ccccc3)o2)cc1C ZINC000468637158 339267721 /nfs/dbraw/zinc/26/77/21/339267721.db2.gz HHGHDGSMNMEHEN-OAHLLOKOSA-N 0 0 324.449 5.348 20 0 DKADRN Fc1ccc(CSCc2csc(C3CCCCC3)n2)nc1 ZINC000468637991 339267727 /nfs/dbraw/zinc/26/77/27/339267727.db2.gz KJMBUYOVTKUICN-UHFFFAOYSA-N 0 0 322.474 5.158 20 0 DKADRN Cc1sccc1CC(=O)Nc1c(C(C)C)cccc1C(C)C ZINC000468639269 339267675 /nfs/dbraw/zinc/26/76/75/339267675.db2.gz FLDSPCHTQXPGHH-UHFFFAOYSA-N 0 0 315.482 5.485 20 0 DKADRN CCO[C@@H](C)c1nc(CSCc2ccc(C)c(C)c2)cs1 ZINC000468648027 339267995 /nfs/dbraw/zinc/26/79/95/339267995.db2.gz MXLLMEAKPMJUPZ-AWEZNQCLSA-N 0 0 321.511 5.291 20 0 DKADRN CCO[C@H](C)c1nc(CSCc2ccc(C)c(C)c2)cs1 ZINC000468648028 339267997 /nfs/dbraw/zinc/26/79/97/339267997.db2.gz MXLLMEAKPMJUPZ-CQSZACIVSA-N 0 0 321.511 5.291 20 0 DKADRN Cc1ccc(-c2nnc([C@H](C)S[C@@H](C)C(C)C)o2)cc1C ZINC000468651497 339268111 /nfs/dbraw/zinc/26/81/11/339268111.db2.gz CBIYZYWKOOQNAG-KBPBESRZSA-N 0 0 304.459 5.192 20 0 DKADRN Cc1ccc(-c2nnc([C@H](C)S[C@H](C)C(C)C)o2)cc1C ZINC000468651498 339268101 /nfs/dbraw/zinc/26/81/01/339268101.db2.gz CBIYZYWKOOQNAG-KGLIPLIRSA-N 0 0 304.459 5.192 20 0 DKADRN Cc1ccc(-c2nnc([C@@H](C)S[C@@H](C)C(C)C)o2)cc1C ZINC000468651499 339268149 /nfs/dbraw/zinc/26/81/49/339268149.db2.gz CBIYZYWKOOQNAG-UONOGXRCSA-N 0 0 304.459 5.192 20 0 DKADRN Cc1ccc(-c2nnc([C@@H](C)S[C@H](C)C(C)C)o2)cc1C ZINC000468651500 339268141 /nfs/dbraw/zinc/26/81/41/339268141.db2.gz CBIYZYWKOOQNAG-ZIAGYGMSSA-N 0 0 304.459 5.192 20 0 DKADRN C[C@@H](SC/C=C/c1ccc(Cl)cc1)c1nc(C2CC2)no1 ZINC000468654871 339268136 /nfs/dbraw/zinc/26/81/36/339268136.db2.gz CWMRXAAYNQVUPR-KXMPLOMGSA-N 0 0 320.845 5.108 20 0 DKADRN C[C@@H](SC/C=C\c1ccc(Cl)cc1)c1nc(C2CC2)no1 ZINC000468654872 339268089 /nfs/dbraw/zinc/26/80/89/339268089.db2.gz CWMRXAAYNQVUPR-OTDNITJGSA-N 0 0 320.845 5.108 20 0 DKADRN C[C@H](SC/C=C\c1ccc(Cl)cc1)c1nc(C2CC2)no1 ZINC000468654873 339268163 /nfs/dbraw/zinc/26/81/63/339268163.db2.gz CWMRXAAYNQVUPR-QUCGXOGASA-N 0 0 320.845 5.108 20 0 DKADRN C[C@H](SC/C=C/c1ccc(Cl)cc1)c1nc(C2CC2)no1 ZINC000468654874 339268174 /nfs/dbraw/zinc/26/81/74/339268174.db2.gz CWMRXAAYNQVUPR-VUDBWIFFSA-N 0 0 320.845 5.108 20 0 DKADRN CCC(C)(C)c1ccc(NC(=O)c2c(C)noc2C(C)C)cc1 ZINC000468744941 339269677 /nfs/dbraw/zinc/26/96/77/339269677.db2.gz UCCXSMQQMGUSAL-UHFFFAOYSA-N 0 0 314.429 5.046 20 0 DKADRN CSc1ccc(N[C@H](C)c2cnn(C(C)C)c2C)cc1Cl ZINC000468765979 339270094 /nfs/dbraw/zinc/27/00/94/339270094.db2.gz BLKFQBMIAQDAPZ-LLVKDONJSA-N 0 0 323.893 5.321 20 0 DKADRN CSc1ccc(N[C@@H](C)c2cnn(C(C)C)c2C)cc1Cl ZINC000468766184 339270160 /nfs/dbraw/zinc/27/01/60/339270160.db2.gz BLKFQBMIAQDAPZ-NSHDSACASA-N 0 0 323.893 5.321 20 0 DKADRN O=C(CC1CC1)Nc1ccc(Cl)cc1-c1ccccc1Cl ZINC000468770024 339270357 /nfs/dbraw/zinc/27/03/57/339270357.db2.gz APXPUTJOYCAQNB-UHFFFAOYSA-N 0 0 320.219 5.399 20 0 DKADRN CCc1cccc(CNc2ccc(C)c(NC(=O)C(C)(C)C)c2)c1 ZINC000468792840 339270968 /nfs/dbraw/zinc/27/09/68/339270968.db2.gz BVENQRVAGPGGSS-UHFFFAOYSA-N 0 0 324.468 5.154 20 0 DKADRN O=C(Nc1ccc(Cl)cc1-c1ccccc1Cl)C1CCC1 ZINC000468810491 339271460 /nfs/dbraw/zinc/27/14/60/339271460.db2.gz CXTQLRGIVQCHOO-UHFFFAOYSA-N 0 0 320.219 5.399 20 0 DKADRN CCCC1(C(=O)Nc2cccc(COC(C)(C)C)c2C)CCC1 ZINC000468810780 339271364 /nfs/dbraw/zinc/27/13/64/339271364.db2.gz CRMSGXUNYITHPU-UHFFFAOYSA-N 0 0 317.473 5.219 20 0 DKADRN CC[C@@H](C)Sc1ccc(NC(=O)[C@H]2[C@@H]3CCCC[C@@H]32)c(C)c1 ZINC000468815024 339271589 /nfs/dbraw/zinc/27/15/89/339271589.db2.gz CSVQJGWYUZYUOS-KBEGMRNHSA-N 0 0 317.498 5.260 20 0 DKADRN CC[C@H](C)Sc1ccc(NC(=O)[C@H]2[C@@H]3CCCC[C@@H]32)c(C)c1 ZINC000468815102 339271623 /nfs/dbraw/zinc/27/16/23/339271623.db2.gz CSVQJGWYUZYUOS-KMANFZQXSA-N 0 0 317.498 5.260 20 0 DKADRN CCCCOc1cccc(N[C@@H](C)c2cnn(C(C)C)c2C)c1 ZINC000468841047 339272345 /nfs/dbraw/zinc/27/23/45/339272345.db2.gz GAQIFLOEVTUSTM-HNNXBMFYSA-N 0 0 315.461 5.124 20 0 DKADRN CCc1cccc(CC)c1NC(=O)c1ccc(Cl)c(C)c1 ZINC000468841138 339272418 /nfs/dbraw/zinc/27/24/18/339272418.db2.gz FAIMNVCQRIOLPK-UHFFFAOYSA-N 0 0 301.817 5.026 20 0 DKADRN CCCCOc1cccc(N[C@H](C)c2cnn(C(C)C)c2C)c1 ZINC000468841399 339272289 /nfs/dbraw/zinc/27/22/89/339272289.db2.gz GAQIFLOEVTUSTM-OAHLLOKOSA-N 0 0 315.461 5.124 20 0 DKADRN CCC(CC)CC(=O)N1CCCC[C@H]1c1cc2ccccc2[nH]1 ZINC000468855908 339272975 /nfs/dbraw/zinc/27/29/75/339272975.db2.gz GESYXXBAFJQTRF-IBGZPJMESA-N 0 0 312.457 5.048 20 0 DKADRN CCC(CC)CC(=O)N1CCCC[C@@H]1c1cc2ccccc2[nH]1 ZINC000468858284 339272981 /nfs/dbraw/zinc/27/29/81/339272981.db2.gz GESYXXBAFJQTRF-LJQANCHMSA-N 0 0 312.457 5.048 20 0 DKADRN CCCC1(C(=O)N2Cc3ccccc3-c3ccccc3C2)CCC1 ZINC000468863681 339273066 /nfs/dbraw/zinc/27/30/66/339273066.db2.gz GWCPSCCYPDOYPP-UHFFFAOYSA-N 0 0 319.448 5.166 20 0 DKADRN O=C(Nc1ccc(Cl)cc1-c1ccccc1Cl)C1CC1 ZINC000468864071 339273081 /nfs/dbraw/zinc/27/30/81/339273081.db2.gz HGCRQDIVMNJTGV-UHFFFAOYSA-N 0 0 306.192 5.009 20 0 DKADRN Cc1c2cc(C)ccc2sc1C(=O)Nc1cccc(F)c1F ZINC000468883261 339273573 /nfs/dbraw/zinc/27/35/73/339273573.db2.gz HHNYUTBJYDSTJK-UHFFFAOYSA-N 0 0 317.360 5.049 20 0 DKADRN CC(C)OCc1ccc(N[C@H](C)c2csc(Cl)c2)cc1 ZINC000468893339 339273854 /nfs/dbraw/zinc/27/38/54/339273854.db2.gz JCXCINHJXKMBOL-GFCCVEGCSA-N 0 0 309.862 5.500 20 0 DKADRN CC(C)OCc1ccc(N[C@@H](C)c2csc(Cl)c2)cc1 ZINC000468893487 339273852 /nfs/dbraw/zinc/27/38/52/339273852.db2.gz JCXCINHJXKMBOL-LBPRGKRZSA-N 0 0 309.862 5.500 20 0 DKADRN Cc1sc(CN[C@H](C)c2csc(Cl)c2)nc1C(C)C ZINC000468893896 339273802 /nfs/dbraw/zinc/27/38/02/339273802.db2.gz JEUWZQKHFLBKRK-SECBINFHSA-N 0 0 314.907 5.141 20 0 DKADRN Cc1sc(CN[C@@H](C)c2csc(Cl)c2)nc1C(C)C ZINC000468894247 339273820 /nfs/dbraw/zinc/27/38/20/339273820.db2.gz JEUWZQKHFLBKRK-VIFPVBQESA-N 0 0 314.907 5.141 20 0 DKADRN CCCCOc1ccccc1N[C@@H](C)c1cnn(C(C)C)c1C ZINC000468904908 339274366 /nfs/dbraw/zinc/27/43/66/339274366.db2.gz KKDDEHRXGFEXHJ-HNNXBMFYSA-N 0 0 315.461 5.124 20 0 DKADRN CCCCOc1ccccc1N[C@H](C)c1cnn(C(C)C)c1C ZINC000468905018 339274327 /nfs/dbraw/zinc/27/43/27/339274327.db2.gz KKDDEHRXGFEXHJ-OAHLLOKOSA-N 0 0 315.461 5.124 20 0 DKADRN CSc1ccc(C)c(NC(=O)c2ccc(C)c(Cl)c2F)c1 ZINC000468943616 339275427 /nfs/dbraw/zinc/27/54/27/339275427.db2.gz KUQOJKUEPJLTNS-UHFFFAOYSA-N 0 0 323.820 5.070 20 0 DKADRN Cc1nc(COc2ccccc2F)oc1-c1ccc(Cl)cc1 ZINC000468953388 339275805 /nfs/dbraw/zinc/27/58/05/339275805.db2.gz LRRASZFYRKGWRI-UHFFFAOYSA-N 0 0 317.747 5.022 20 0 DKADRN CCC(CC)CC(=O)Nc1cccc(COC(C)(C)C)c1C ZINC000468954925 339275804 /nfs/dbraw/zinc/27/58/04/339275804.db2.gz NGJKDBWJRVWJPQ-UHFFFAOYSA-N 0 0 305.462 5.075 20 0 DKADRN Cc1c([C@@H](C)Nc2csc3ccccc23)cnn1C(C)(C)C ZINC000468970622 339276314 /nfs/dbraw/zinc/27/63/14/339276314.db2.gz NUYGYJAILMNFKF-GFCCVEGCSA-N 0 0 313.470 5.334 20 0 DKADRN Cc1c([C@H](C)Nc2csc3ccccc23)cnn1C(C)(C)C ZINC000468970738 339276288 /nfs/dbraw/zinc/27/62/88/339276288.db2.gz NUYGYJAILMNFKF-LBPRGKRZSA-N 0 0 313.470 5.334 20 0 DKADRN CSc1ccc(Cl)cc1N[C@H](C)c1cnn(C(C)C)c1C ZINC000468976414 339276639 /nfs/dbraw/zinc/27/66/39/339276639.db2.gz OFJADMJKZBFVEX-LLVKDONJSA-N 0 0 323.893 5.321 20 0 DKADRN CSc1ccc(Cl)cc1N[C@@H](C)c1cnn(C(C)C)c1C ZINC000468976529 339276579 /nfs/dbraw/zinc/27/65/79/339276579.db2.gz OFJADMJKZBFVEX-NSHDSACASA-N 0 0 323.893 5.321 20 0 DKADRN Cc1c(COC(C)(C)C)cccc1NC(=O)C[C@@H]1CC[C@@H](C)C1 ZINC000468990407 339277006 /nfs/dbraw/zinc/27/70/06/339277006.db2.gz PUSXHJYDXMPBLO-GDBMZVCRSA-N 0 0 317.473 5.075 20 0 DKADRN Cc1c(COC(C)(C)C)cccc1NC(=O)C[C@@H]1CC[C@H](C)C1 ZINC000468990570 339277026 /nfs/dbraw/zinc/27/70/26/339277026.db2.gz PUSXHJYDXMPBLO-GOEBONIOSA-N 0 0 317.473 5.075 20 0 DKADRN Cc1c(COC(C)(C)C)cccc1NC(=O)C[C@H]1CC[C@H](C)C1 ZINC000468990653 339277027 /nfs/dbraw/zinc/27/70/27/339277027.db2.gz PUSXHJYDXMPBLO-HOCLYGCPSA-N 0 0 317.473 5.075 20 0 DKADRN Cc1c(COC(C)(C)C)cccc1NC(=O)C[C@H]1CC[C@@H](C)C1 ZINC000468990739 339277009 /nfs/dbraw/zinc/27/70/09/339277009.db2.gz PUSXHJYDXMPBLO-ZBFHGGJFSA-N 0 0 317.473 5.075 20 0 DKADRN CCCOc1cc(C)ccc1N[C@@H](C)c1cnn(C(C)C)c1C ZINC000469004740 339277293 /nfs/dbraw/zinc/27/72/93/339277293.db2.gz QTZFQPCQPJJKLA-HNNXBMFYSA-N 0 0 315.461 5.043 20 0 DKADRN CCCOc1cc(C)ccc1N[C@H](C)c1cnn(C(C)C)c1C ZINC000469004977 339277391 /nfs/dbraw/zinc/27/73/91/339277391.db2.gz QTZFQPCQPJJKLA-OAHLLOKOSA-N 0 0 315.461 5.043 20 0 DKADRN CCC(=Cc1nc(-c2cccnc2Oc2ccccc2)no1)CC ZINC000469006339 339277374 /nfs/dbraw/zinc/27/73/74/339277374.db2.gz PVBJTBVMABJEGQ-UHFFFAOYSA-N 0 0 321.380 5.127 20 0 DKADRN CC(=O)c1ccc(OCc2ccc(C(F)F)cc2)c(Cl)c1 ZINC000469019167 339277709 /nfs/dbraw/zinc/27/77/09/339277709.db2.gz RBCRSEVTSFZOSN-UHFFFAOYSA-N 0 0 310.727 5.059 20 0 DKADRN CCC(CC)CC(=O)N1Cc2ccccc2-c2ccccc2C1 ZINC000469038397 339278329 /nfs/dbraw/zinc/27/83/29/339278329.db2.gz SWGULHZFTPWDTI-UHFFFAOYSA-N 0 0 307.437 5.022 20 0 DKADRN C[C@@H](NCc1c(F)cccc1Cl)c1csc(Cl)c1 ZINC000469041185 339278291 /nfs/dbraw/zinc/27/82/91/339278291.db2.gz UOXGSBZJXOJMAT-MRVPVSSYSA-N 0 0 304.217 5.045 20 0 DKADRN C[C@H](NCc1c(F)cccc1Cl)c1csc(Cl)c1 ZINC000469041394 339278342 /nfs/dbraw/zinc/27/83/42/339278342.db2.gz 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/nfs/dbraw/zinc/28/08/15/339280815.db2.gz XVFCEHQPGLFCAR-ZDUSSCGKSA-N 0 0 323.154 5.102 20 0 DKADRN CCCC(C)(C)CC(=O)N[C@@H](CC(F)(F)F)c1ccccc1 ZINC000469125602 337152910 /nfs/dbraw/zinc/15/29/10/337152910.db2.gz YBDRMTKXJAWKDY-AWEZNQCLSA-N 0 0 315.379 5.013 20 0 DKADRN CCCC(C)(C)CC(=O)N[C@H](CC(F)(F)F)c1ccccc1 ZINC000469125665 337152930 /nfs/dbraw/zinc/15/29/30/337152930.db2.gz YBDRMTKXJAWKDY-CQSZACIVSA-N 0 0 315.379 5.013 20 0 DKADRN C[C@@H](Nc1ccccc1OCC(F)F)c1csc(Cl)c1 ZINC000469140620 339281283 /nfs/dbraw/zinc/28/12/83/339281283.db2.gz LKRLICIBKVTONE-SECBINFHSA-N 0 0 317.788 5.219 20 0 DKADRN C[C@H](Nc1ccccc1OCC(F)F)c1csc(Cl)c1 ZINC000469141142 339281264 /nfs/dbraw/zinc/28/12/64/339281264.db2.gz LKRLICIBKVTONE-VIFPVBQESA-N 0 0 317.788 5.219 20 0 DKADRN Clc1ccc(-c2nc([C@@H]3CCCOC3)cs2)c(Cl)c1 ZINC000469158019 339281646 /nfs/dbraw/zinc/28/16/46/339281646.db2.gz HAFXFLIQRBFYHA-SECBINFHSA-N 0 0 314.237 5.011 20 0 DKADRN Clc1ccc(-c2nc([C@H]3CCCOC3)cs2)c(Cl)c1 ZINC000469158253 339281606 /nfs/dbraw/zinc/28/16/06/339281606.db2.gz HAFXFLIQRBFYHA-VIFPVBQESA-N 0 0 314.237 5.011 20 0 DKADRN Clc1ccc(-c2nc([C@H]3CCCOC3)cs2)cc1Cl ZINC000469185516 339282481 /nfs/dbraw/zinc/28/24/81/339282481.db2.gz KYFJLZUEFRIRBK-JTQLQIEISA-N 0 0 314.237 5.011 20 0 DKADRN Clc1ccc(-c2nc([C@@H]3CCCOC3)cs2)cc1Cl ZINC000469185558 339282486 /nfs/dbraw/zinc/28/24/86/339282486.db2.gz KYFJLZUEFRIRBK-SNVBAGLBSA-N 0 0 314.237 5.011 20 0 DKADRN Cc1c([C@H](C)Nc2cc(Cl)cc(Cl)c2)cnn1C(C)C ZINC000469194932 339282673 /nfs/dbraw/zinc/28/26/73/339282673.db2.gz NIEBFEUIGVORGL-JTQLQIEISA-N 0 0 312.244 5.252 20 0 DKADRN Cc1c([C@@H](C)Nc2cc(Cl)cc(Cl)c2)cnn1C(C)C ZINC000469195041 339282686 /nfs/dbraw/zinc/28/26/86/339282686.db2.gz NIEBFEUIGVORGL-SNVBAGLBSA-N 0 0 312.244 5.252 20 0 DKADRN C[C@@H]1CC[C@H](CC(=O)N2CCCC[C@@H]2c2cc3ccccc3[nH]2)C1 ZINC000469203492 339282969 /nfs/dbraw/zinc/28/29/69/339282969.db2.gz RGFOZUPUXBLEHS-GQIGUUNPSA-N 0 0 324.468 5.048 20 0 DKADRN C[C@@H]1CC[C@H](CC(=O)N2CCCC[C@H]2c2cc3ccccc3[nH]2)C1 ZINC000469203574 339283051 /nfs/dbraw/zinc/28/30/51/339283051.db2.gz RGFOZUPUXBLEHS-GUXCAODWSA-N 0 0 324.468 5.048 20 0 DKADRN C[C@@H]1CC[C@@H](CC(=O)N2CCCC[C@@H]2c2cc3ccccc3[nH]2)C1 ZINC000469203581 339282979 /nfs/dbraw/zinc/28/29/79/339282979.db2.gz RGFOZUPUXBLEHS-JXXFODFXSA-N 0 0 324.468 5.048 20 0 DKADRN C[C@@H]1CC[C@@H](CC(=O)N2CCCC[C@H]2c2cc3ccccc3[nH]2)C1 ZINC000469203656 339282986 /nfs/dbraw/zinc/28/29/86/339282986.db2.gz RGFOZUPUXBLEHS-QINHECLXSA-N 0 0 324.468 5.048 20 0 DKADRN CCC(CC)CC(=O)N(Cc1cccs1)Cc1cccs1 ZINC000469224749 339283562 /nfs/dbraw/zinc/28/35/62/339283562.db2.gz HCYHNGFPNMVZCN-UHFFFAOYSA-N 0 0 321.511 5.165 20 0 DKADRN Cc1nc(CNc2cccc(F)c2)oc1-c1ccc(Cl)cc1 ZINC000469235718 339283728 /nfs/dbraw/zinc/28/37/28/339283728.db2.gz GKFQPSLPACEBTE-UHFFFAOYSA-N 0 0 316.763 5.055 20 0 DKADRN O=C(Nc1ccc(Cl)cc1-c1cccc(Cl)c1)C1CC1 ZINC000469240603 339284013 /nfs/dbraw/zinc/28/40/13/339284013.db2.gz RBLLLBQORYQUPQ-UHFFFAOYSA-N 0 0 306.192 5.009 20 0 DKADRN CCSCc1cccc(N[C@@H](C)c2cnn(C(C)C)c2C)c1 ZINC000469258456 339284471 /nfs/dbraw/zinc/28/44/71/339284471.db2.gz YOKAXHMSBZRNJR-AWEZNQCLSA-N 0 0 317.502 5.199 20 0 DKADRN CCSCc1cccc(N[C@H](C)c2cnn(C(C)C)c2C)c1 ZINC000469258488 339284370 /nfs/dbraw/zinc/28/43/70/339284370.db2.gz YOKAXHMSBZRNJR-CQSZACIVSA-N 0 0 317.502 5.199 20 0 DKADRN Cc1ccc(Cl)c(NC(=O)c2ccc(C)c(Cl)c2F)c1 ZINC000469262295 339284562 /nfs/dbraw/zinc/28/45/62/339284562.db2.gz KFIXUMHTAZZZTE-UHFFFAOYSA-N 0 0 312.171 5.002 20 0 DKADRN CCc1nnc([C@H](C)SCc2ccc(-c3ccccc3)cc2)o1 ZINC000469281078 339284934 /nfs/dbraw/zinc/28/49/34/339284934.db2.gz UALFPSBVANVBRT-AWEZNQCLSA-N 0 0 324.449 5.293 20 0 DKADRN CCc1nnc([C@@H](C)SCc2ccc(-c3ccccc3)cc2)o1 ZINC000469281087 339284969 /nfs/dbraw/zinc/28/49/69/339284969.db2.gz UALFPSBVANVBRT-CQSZACIVSA-N 0 0 324.449 5.293 20 0 DKADRN CCSCc1ccccc1C(=O)Nc1cc(C)ccc1Cl ZINC000469284380 339285040 /nfs/dbraw/zinc/28/50/40/339285040.db2.gz ODTNQDLZOMTBEU-UHFFFAOYSA-N 0 0 319.857 5.154 20 0 DKADRN C[C@@H](c1cccs1)N(Cc1ccccc1)C(=O)CC1(C)CC1 ZINC000469284479 339285072 /nfs/dbraw/zinc/28/50/72/339285072.db2.gz ZAVCKROMHWTDHH-HNNXBMFYSA-N 0 0 313.466 5.028 20 0 DKADRN C[C@H](c1cccs1)N(Cc1ccccc1)C(=O)CC1(C)CC1 ZINC000469284520 339285062 /nfs/dbraw/zinc/28/50/62/339285062.db2.gz ZAVCKROMHWTDHH-OAHLLOKOSA-N 0 0 313.466 5.028 20 0 DKADRN Cc1cc(C(=O)Nc2c(C)cccc2C(C)C)ccc1Cl ZINC000469287764 339285251 /nfs/dbraw/zinc/28/52/51/339285251.db2.gz SPZSGTIFWJGCLD-UHFFFAOYSA-N 0 0 301.817 5.333 20 0 DKADRN CC(C)C(=O)Nc1ccc(Cl)cc1-c1ccccc1Cl ZINC000469299454 339285563 /nfs/dbraw/zinc/28/55/63/339285563.db2.gz UEJSPFLNUTVEIY-UHFFFAOYSA-N 0 0 308.208 5.255 20 0 DKADRN CC(C)c1nnc(CSCc2ccc(-c3ccccc3)cc2)o1 ZINC000469306520 339285707 /nfs/dbraw/zinc/28/57/07/339285707.db2.gz ZKGCDKBNFCYCAE-UHFFFAOYSA-N 0 0 324.449 5.293 20 0 DKADRN Cc1nc(CNc2ccccc2F)oc1-c1ccc(Cl)cc1 ZINC000469324181 339286073 /nfs/dbraw/zinc/28/60/73/339286073.db2.gz MXPYLLNJCRWZGD-UHFFFAOYSA-N 0 0 316.763 5.055 20 0 DKADRN Cc1nc(CNc2ccc(F)cc2)oc1-c1ccc(Cl)cc1 ZINC000469331093 339286179 /nfs/dbraw/zinc/28/61/79/339286179.db2.gz PNJQDVHDCOBXOD-UHFFFAOYSA-N 0 0 316.763 5.055 20 0 DKADRN Cc1nc(CNc2cccc(C)c2)oc1-c1ccc(Cl)cc1 ZINC000469341890 339286549 /nfs/dbraw/zinc/28/65/49/339286549.db2.gz UKGGUWFZMCCIID-UHFFFAOYSA-N 0 0 312.800 5.224 20 0 DKADRN Cc1nc(CNc2ccccc2C)oc1-c1ccc(Cl)cc1 ZINC000469343935 339286518 /nfs/dbraw/zinc/28/65/18/339286518.db2.gz VRMABPOZMUUCLN-UHFFFAOYSA-N 0 0 312.800 5.224 20 0 DKADRN CSc1cccc(NC(=O)c2ccc(C)c(Cl)c2F)c1C ZINC000469349927 339286620 /nfs/dbraw/zinc/28/66/20/339286620.db2.gz WHPMMLONDPCQSY-UHFFFAOYSA-N 0 0 323.820 5.070 20 0 DKADRN Cc1nnc([C@@H](C)SCc2c(C)cc(C(C)(C)C)cc2C)o1 ZINC000469354324 339286719 /nfs/dbraw/zinc/28/67/19/339286719.db2.gz PCEIYMDSZQFJRF-CYBMUJFWSA-N 0 0 318.486 5.287 20 0 DKADRN Cc1nnc([C@H](C)SCc2c(C)cc(C(C)(C)C)cc2C)o1 ZINC000469354330 339286740 /nfs/dbraw/zinc/28/67/40/339286740.db2.gz PCEIYMDSZQFJRF-ZDUSSCGKSA-N 0 0 318.486 5.287 20 0 DKADRN C[C@@H](CCC1CC1)NC(=O)N(c1ccccc1)c1ccccc1 ZINC000469385333 339287465 /nfs/dbraw/zinc/28/74/65/339287465.db2.gz CJQPLHKNMUSNRS-INIZCTEOSA-N 0 0 308.425 5.113 20 0 DKADRN C[C@H](CCC1CC1)NC(=O)N(c1ccccc1)c1ccccc1 ZINC000469385334 339287473 /nfs/dbraw/zinc/28/74/73/339287473.db2.gz CJQPLHKNMUSNRS-MRXNPFEDSA-N 0 0 308.425 5.113 20 0 DKADRN Cc1c(COC(C)(C)C)cccc1NC(=O)C[C@H]1CCC[C@H]1C ZINC000469490697 339291432 /nfs/dbraw/zinc/29/14/32/339291432.db2.gz WNWLCYMZGKSHDL-GDBMZVCRSA-N 0 0 317.473 5.075 20 0 DKADRN Cc1c(COC(C)(C)C)cccc1NC(=O)C[C@H]1CCC[C@@H]1C ZINC000469490698 339291433 /nfs/dbraw/zinc/29/14/33/339291433.db2.gz WNWLCYMZGKSHDL-GOEBONIOSA-N 0 0 317.473 5.075 20 0 DKADRN Cc1c(COC(C)(C)C)cccc1NC(=O)C[C@@H]1CCC[C@@H]1C ZINC000469490699 339291376 /nfs/dbraw/zinc/29/13/76/339291376.db2.gz WNWLCYMZGKSHDL-HOCLYGCPSA-N 0 0 317.473 5.075 20 0 DKADRN Cc1c(COC(C)(C)C)cccc1NC(=O)C[C@@H]1CCC[C@H]1C ZINC000469490700 339291363 /nfs/dbraw/zinc/29/13/63/339291363.db2.gz WNWLCYMZGKSHDL-ZBFHGGJFSA-N 0 0 317.473 5.075 20 0 DKADRN CCOc1cc(Cl)ccc1NC(=O)c1sccc1C(C)C ZINC000469493803 339291533 /nfs/dbraw/zinc/29/15/33/339291533.db2.gz KTJFEIJKHRQQCX-UHFFFAOYSA-N 0 0 323.845 5.176 20 0 DKADRN CCCC1(C(=O)Nc2ccccc2CCC(F)(F)F)CCC1 ZINC000469529533 339292690 /nfs/dbraw/zinc/29/26/90/339292690.db2.gz QYOZWTCEEFNZTP-UHFFFAOYSA-N 0 0 313.363 5.090 20 0 DKADRN CCC(CC)N(CC(C)C)C(=O)C1CCC(C(F)(F)F)CC1 ZINC000469534880 339292866 /nfs/dbraw/zinc/29/28/66/339292866.db2.gz FTYZVVPGWLNHMA-UHFFFAOYSA-N 0 0 321.427 5.028 20 0 DKADRN CCCC(C)(C)CC(=O)Nc1cnccc1-c1cccc(F)c1 ZINC000469541287 339292903 /nfs/dbraw/zinc/29/29/03/339292903.db2.gz AYSQKEGLPCECOL-UHFFFAOYSA-N 0 0 314.404 5.043 20 0 DKADRN CCCC(C)(C)CC(=O)Nc1ccccc1CCC(F)(F)F ZINC000469592948 339293674 /nfs/dbraw/zinc/29/36/74/339293674.db2.gz MQVUZQXSLBPXNS-UHFFFAOYSA-N 0 0 315.379 5.336 20 0 DKADRN CCCC(C)(C)CC(=O)Nc1cc(-c2nc(C)co2)ccc1C ZINC000469606509 339294221 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339295926 /nfs/dbraw/zinc/29/59/26/339295926.db2.gz JMARYSWUHVZJBS-UHFFFAOYSA-N 0 0 314.473 5.272 20 0 DKADRN CCC1(CC)CCCN(C(=O)Nc2c(C)cccc2C)CC1 ZINC000469709794 339295911 /nfs/dbraw/zinc/29/59/11/339295911.db2.gz ZRUUZAVHWJLNRA-UHFFFAOYSA-N 0 0 302.462 5.128 20 0 DKADRN CC[C@@H](Cc1ccccc1)N(CC)C(=O)Nc1c(C)cccc1C ZINC000469716794 339296255 /nfs/dbraw/zinc/29/62/55/339296255.db2.gz VUTZGDKQXARPFW-IBGZPJMESA-N 0 0 324.468 5.179 20 0 DKADRN CC[C@H](Cc1ccccc1)N(CC)C(=O)Nc1c(C)cccc1C ZINC000469716796 339296295 /nfs/dbraw/zinc/29/62/95/339296295.db2.gz VUTZGDKQXARPFW-LJQANCHMSA-N 0 0 324.468 5.179 20 0 DKADRN Cc1cccc(C(C)C)c1NC(=O)N1CCC[C@@H](CC(C)C)C1 ZINC000469722396 339296617 /nfs/dbraw/zinc/29/66/17/339296617.db2.gz ZJJSZTZAPWHTCL-KRWDZBQOSA-N 0 0 316.489 5.408 20 0 DKADRN Cc1cccc(C(C)C)c1NC(=O)N1CCC[C@H](CC(C)C)C1 ZINC000469722397 339296593 /nfs/dbraw/zinc/29/65/93/339296593.db2.gz ZJJSZTZAPWHTCL-QGZVFWFLSA-N 0 0 316.489 5.408 20 0 DKADRN CC(C)C[C@@H]1CCCN(C(=O)Nc2ccccc2C(C)C)C1 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C[C@H]1CCC[C@@H]1CC(=O)Nc1cccc(C(F)F)c1Cl ZINC000469757593 339297890 /nfs/dbraw/zinc/29/78/90/339297890.db2.gz SJQPFWMCHXDGIS-VHSXEESVSA-N 0 0 301.764 5.042 20 0 DKADRN C[C@@H]1CCC[C@H]1CC(=O)Nc1cccc(C(F)F)c1Cl ZINC000469757594 339297875 /nfs/dbraw/zinc/29/78/75/339297875.db2.gz SJQPFWMCHXDGIS-ZJUUUORDSA-N 0 0 301.764 5.042 20 0 DKADRN Cc1cc2cccnc2c(N[C@H](C)c2csc(C(C)C)n2)c1 ZINC000469768077 339298401 /nfs/dbraw/zinc/29/84/01/339298401.db2.gz HQTDDZYAYMFLDQ-CYBMUJFWSA-N 0 0 311.454 5.296 20 0 DKADRN Cc1cc2cccnc2c(N[C@@H](C)c2csc(C(C)C)n2)c1 ZINC000469768085 339298311 /nfs/dbraw/zinc/29/83/11/339298311.db2.gz HQTDDZYAYMFLDQ-ZDUSSCGKSA-N 0 0 311.454 5.296 20 0 DKADRN CC(C)c1nc([C@@H](C)Nc2cccc3ccsc32)cs1 ZINC000469768337 339298334 /nfs/dbraw/zinc/29/83/34/339298334.db2.gz IZHYZYTYBVQCRA-LLVKDONJSA-N 0 0 302.468 5.654 20 0 DKADRN CC(C)c1nc([C@H](C)Nc2cccc3ccsc32)cs1 ZINC000469768338 339298286 /nfs/dbraw/zinc/29/82/86/339298286.db2.gz IZHYZYTYBVQCRA-NSHDSACASA-N 0 0 302.468 5.654 20 0 DKADRN COc1ccc(Cl)cc1N[C@@H](C)c1csc(C(C)C)n1 ZINC000469771028 339298515 /nfs/dbraw/zinc/29/85/15/339298515.db2.gz ZGYVBIKGULGUGF-JTQLQIEISA-N 0 0 310.850 5.102 20 0 DKADRN COc1ccc(Cl)cc1N[C@H](C)c1csc(C(C)C)n1 ZINC000469771029 339298533 /nfs/dbraw/zinc/29/85/33/339298533.db2.gz ZGYVBIKGULGUGF-SNVBAGLBSA-N 0 0 310.850 5.102 20 0 DKADRN CCc1nc2cc(N[C@H](C)c3csc(C(C)C)n3)ccc2o1 ZINC000469771850 339298542 /nfs/dbraw/zinc/29/85/42/339298542.db2.gz GNVSRVWGKCGBOE-LLVKDONJSA-N 0 0 315.442 5.143 20 0 DKADRN CCc1nc2cc(N[C@@H](C)c3csc(C(C)C)n3)ccc2o1 ZINC000469771851 339298519 /nfs/dbraw/zinc/29/85/19/339298519.db2.gz GNVSRVWGKCGBOE-NSHDSACASA-N 0 0 315.442 5.143 20 0 DKADRN COc1ccc(Cl)c(N[C@@H](C)c2csc(C(C)C)n2)c1 ZINC000469776744 339299031 /nfs/dbraw/zinc/29/90/31/339299031.db2.gz SHNGWANIVUDFJU-JTQLQIEISA-N 0 0 310.850 5.102 20 0 DKADRN COc1ccc(Cl)c(N[C@H](C)c2csc(C(C)C)n2)c1 ZINC000469776745 339299111 /nfs/dbraw/zinc/29/91/11/339299111.db2.gz SHNGWANIVUDFJU-SNVBAGLBSA-N 0 0 310.850 5.102 20 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ZINC000469788480 339300013 /nfs/dbraw/zinc/30/00/13/339300013.db2.gz AYKTULBADSXUFO-CYBMUJFWSA-N 0 0 304.459 5.147 20 0 DKADRN CCOc1cc(C)ccc1N[C@@H](C)c1csc(C(C)C)n1 ZINC000469788481 339299985 /nfs/dbraw/zinc/29/99/85/339299985.db2.gz AYKTULBADSXUFO-ZDUSSCGKSA-N 0 0 304.459 5.147 20 0 DKADRN CCSc1cccc(N[C@H](C)c2csc(C(C)C)n2)c1 ZINC000469788770 339299986 /nfs/dbraw/zinc/29/99/86/339299986.db2.gz BUNYVLQVOAFWHJ-GFCCVEGCSA-N 0 0 306.500 5.552 20 0 DKADRN CCSc1cccc(N[C@@H](C)c2csc(C(C)C)n2)c1 ZINC000469788773 339300073 /nfs/dbraw/zinc/30/00/73/339300073.db2.gz BUNYVLQVOAFWHJ-LBPRGKRZSA-N 0 0 306.500 5.552 20 0 DKADRN CC(C)c1nc([C@@H](C)NC2(c3ccc(Cl)cc3)CC2)cs1 ZINC000469789302 339300222 /nfs/dbraw/zinc/30/02/22/339300222.db2.gz XWKYNDGRUGZDOR-GFCCVEGCSA-N 0 0 320.889 5.260 20 0 DKADRN CC(C)c1nc([C@H](C)NC2(c3ccc(Cl)cc3)CC2)cs1 ZINC000469789309 339300134 /nfs/dbraw/zinc/30/01/34/339300134.db2.gz XWKYNDGRUGZDOR-LBPRGKRZSA-N 0 0 320.889 5.260 20 0 DKADRN COc1c(C)ccc(N[C@H](C)c2csc(C(C)C)n2)c1C ZINC000469789465 339300170 /nfs/dbraw/zinc/30/01/70/339300170.db2.gz FHQRXPJMTKHACV-CYBMUJFWSA-N 0 0 304.459 5.065 20 0 DKADRN COc1c(C)ccc(N[C@@H](C)c2csc(C(C)C)n2)c1C ZINC000469789466 339300171 /nfs/dbraw/zinc/30/01/71/339300171.db2.gz FHQRXPJMTKHACV-ZDUSSCGKSA-N 0 0 304.459 5.065 20 0 DKADRN CCCOc1ccccc1N[C@H](C)c1csc(C(C)C)n1 ZINC000469795057 339300567 /nfs/dbraw/zinc/30/05/67/339300567.db2.gz YPZVNTSSUYRUKL-CYBMUJFWSA-N 0 0 304.459 5.228 20 0 DKADRN CCCOc1ccccc1N[C@@H](C)c1csc(C(C)C)n1 ZINC000469795058 339300675 /nfs/dbraw/zinc/30/06/75/339300675.db2.gz YPZVNTSSUYRUKL-ZDUSSCGKSA-N 0 0 304.459 5.228 20 0 DKADRN CCCC(C)(C)CC(=O)Nc1cccc(C(F)F)c1Cl ZINC000469796549 339300803 /nfs/dbraw/zinc/30/08/03/339300803.db2.gz GVRMVPFSDZIYOI-UHFFFAOYSA-N 0 0 303.780 5.433 20 0 DKADRN CCSCc1cccc(N[C@H](C)c2csc(C(C)C)n2)c1 ZINC000469797811 339300742 /nfs/dbraw/zinc/30/07/42/339300742.db2.gz KQIUXOXWVLVTTH-CYBMUJFWSA-N 0 0 320.527 5.693 20 0 DKADRN 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5.006 20 0 DKADRN Cc1sc(CN[C@@H](C)c2csc(C(C)C)n2)nc1C(C)C ZINC000469803382 339301210 /nfs/dbraw/zinc/30/12/10/339301210.db2.gz ZRCXCEWUDCGIMZ-NSHDSACASA-N 0 0 323.531 5.006 20 0 DKADRN Cc1ccccc1[C@@H]([NH2+][C@@H](C)c1csc(C(C)C)n1)C(C)C ZINC000469803659 339301147 /nfs/dbraw/zinc/30/11/47/339301147.db2.gz CYJSQTULMWIMCA-YJBOKZPZSA-N 0 0 316.514 5.623 20 0 DKADRN CSc1cc(C)ccc1CN[C@H](C)c1csc(C(C)C)n1 ZINC000469804542 339301326 /nfs/dbraw/zinc/30/13/26/339301326.db2.gz PGRIMLZQFVUCRS-CYBMUJFWSA-N 0 0 320.527 5.148 20 0 DKADRN CSc1cc(C)ccc1CN[C@@H](C)c1csc(C(C)C)n1 ZINC000469804543 339301228 /nfs/dbraw/zinc/30/12/28/339301228.db2.gz PGRIMLZQFVUCRS-ZDUSSCGKSA-N 0 0 320.527 5.148 20 0 DKADRN CCCOc1cccc(N[C@H](C)c2csc(C(C)C)n2)c1 ZINC000469804725 339301222 /nfs/dbraw/zinc/30/12/22/339301222.db2.gz RPFSOCQBZJSMFP-CYBMUJFWSA-N 0 0 304.459 5.228 20 0 DKADRN CCCOc1cccc(N[C@@H](C)c2csc(C(C)C)n2)c1 ZINC000469804726 339301340 /nfs/dbraw/zinc/30/13/40/339301340.db2.gz RPFSOCQBZJSMFP-ZDUSSCGKSA-N 0 0 304.459 5.228 20 0 DKADRN C[C@H](CC(=O)Nc1ccc2ccoc2c1)c1c[nH]c2ccccc21 ZINC000469812726 339301758 /nfs/dbraw/zinc/30/17/58/339301758.db2.gz VOOYXEJBZSRUJV-CYBMUJFWSA-N 0 0 318.376 5.046 20 0 DKADRN C[C@@H](CC(=O)Nc1ccc2ccoc2c1)c1c[nH]c2ccccc21 ZINC000469812727 339301806 /nfs/dbraw/zinc/30/18/06/339301806.db2.gz VOOYXEJBZSRUJV-ZDUSSCGKSA-N 0 0 318.376 5.046 20 0 DKADRN C[C@H](NC(=O)CCCC(C)(C)C)c1ccc(-c2ccncc2)cc1 ZINC000470006196 339308112 /nfs/dbraw/zinc/30/81/12/339308112.db2.gz NQXGBCAFFPNMHX-INIZCTEOSA-N 0 0 324.468 5.142 20 0 DKADRN C[C@@H](NC(=O)CCCC(C)(C)C)c1ccc(-c2ccncc2)cc1 ZINC000470006197 339308099 /nfs/dbraw/zinc/30/80/99/339308099.db2.gz NQXGBCAFFPNMHX-MRXNPFEDSA-N 0 0 324.468 5.142 20 0 DKADRN Cc1ccc(C(F)(F)F)cc1NC(=O)c1cc2ccccc2o1 ZINC000470009228 339308365 /nfs/dbraw/zinc/30/83/65/339308365.db2.gz NVLKNMFTQWDPIM-UHFFFAOYSA-N 0 0 319.282 5.012 20 0 DKADRN Cc1ccc(C(F)(F)F)cc1NC(=O)C[C@@H](C)c1ccccc1 ZINC000470011883 339308319 /nfs/dbraw/zinc/30/83/19/339308319.db2.gz CZANPZBUFHSWPJ-CYBMUJFWSA-N 0 0 321.342 5.146 20 0 DKADRN Cc1ccc(C(F)(F)F)cc1NC(=O)C[C@H](C)c1ccccc1 ZINC000470011884 339308468 /nfs/dbraw/zinc/30/84/68/339308468.db2.gz CZANPZBUFHSWPJ-ZDUSSCGKSA-N 0 0 321.342 5.146 20 0 DKADRN CC(C)Nc1ccc(F)cc1NC(=O)c1ccc2ccccc2c1 ZINC000470072861 339310033 /nfs/dbraw/zinc/31/00/33/339310033.db2.gz FGPFNQLKYYJEBD-UHFFFAOYSA-N 0 0 322.383 5.052 20 0 DKADRN CC(C)Nc1ccc(F)cc1NC(=O)c1cccc2ccccc21 ZINC000470073660 339310080 /nfs/dbraw/zinc/31/00/80/339310080.db2.gz HLWOCHWOPMIIPK-UHFFFAOYSA-N 0 0 322.383 5.052 20 0 DKADRN C[C@@H](CCC1CC1)Nc1cccc(CSC2CCOCC2)c1 ZINC000470093969 339310588 /nfs/dbraw/zinc/31/05/88/339310588.db2.gz RITXUHXFJCZTPK-HNNXBMFYSA-N 0 0 319.514 5.089 20 0 DKADRN C[C@H](CCC1CC1)Nc1cccc(CSC2CCOCC2)c1 ZINC000470093976 339310574 /nfs/dbraw/zinc/31/05/74/339310574.db2.gz RITXUHXFJCZTPK-OAHLLOKOSA-N 0 0 319.514 5.089 20 0 DKADRN CC(C)Nc1ccc(F)cc1NC(=O)c1ccc(C(C)C)cc1 ZINC000470096791 339310632 /nfs/dbraw/zinc/31/06/32/339310632.db2.gz 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/nfs/dbraw/zinc/31/33/53/339313353.db2.gz HGCRFBJVUNJFIF-IRXDYDNUSA-N 0 0 324.468 5.142 20 0 DKADRN CCCC[C@H](CC)C(=O)N[C@H](C)c1ccc(-c2ccncc2)cc1 ZINC000470187520 339313422 /nfs/dbraw/zinc/31/34/22/339313422.db2.gz HGCRFBJVUNJFIF-SJORKVTESA-N 0 0 324.468 5.142 20 0 DKADRN CC[C@H](C(=O)Nc1cc(C(F)(F)F)ccc1C)c1ccccc1 ZINC000470213132 339314455 /nfs/dbraw/zinc/31/44/55/339314455.db2.gz ZYCUDEJHTQUGDW-HNNXBMFYSA-N 0 0 321.342 5.146 20 0 DKADRN CC[C@@H](C(=O)Nc1cc(C(F)(F)F)ccc1C)c1ccccc1 ZINC000470213133 339314433 /nfs/dbraw/zinc/31/44/33/339314433.db2.gz ZYCUDEJHTQUGDW-OAHLLOKOSA-N 0 0 321.342 5.146 20 0 DKADRN Cc1ccc(C(F)(F)F)cc1NC(=O)c1coc2ccccc12 ZINC000470217777 339314587 /nfs/dbraw/zinc/31/45/87/339314587.db2.gz KHUQQPBNBXDYDM-UHFFFAOYSA-N 0 0 319.282 5.012 20 0 DKADRN Cc1cccc([C@@H](C)C(=O)Nc2cc(C(F)(F)F)ccc2C)c1 ZINC000470236720 339314894 /nfs/dbraw/zinc/31/48/94/339314894.db2.gz KPYWIRUFPYNPIB-CYBMUJFWSA-N 0 0 321.342 5.064 20 0 DKADRN Cc1cccc([C@H](C)C(=O)Nc2cc(C(F)(F)F)ccc2C)c1 ZINC000470236721 339314925 /nfs/dbraw/zinc/31/49/25/339314925.db2.gz KPYWIRUFPYNPIB-ZDUSSCGKSA-N 0 0 321.342 5.064 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)NCCC1(C)CC1 ZINC000470253840 339315399 /nfs/dbraw/zinc/31/53/99/339315399.db2.gz GKUHWNZAXWOFQR-UHFFFAOYSA-N 0 0 302.462 5.074 20 0 DKADRN CC1(C)OCc2cc(CNc3cccc4ccccc43)ccc2O1 ZINC000470303833 339316760 /nfs/dbraw/zinc/31/67/60/339316760.db2.gz RZWOWBAOAXUEFF-UHFFFAOYSA-N 0 0 319.404 5.097 20 0 DKADRN CCC(C)(C)OCc1ccccc1NCCCC1CCOCC1 ZINC000470316101 339317198 /nfs/dbraw/zinc/31/71/98/339317198.db2.gz BUXCPOBAGPIHPC-UHFFFAOYSA-N 0 0 319.489 5.011 20 0 DKADRN Cc1cscc1NC(=O)N1CCCC2(CCCCC2)CC1 ZINC000470391799 339318874 /nfs/dbraw/zinc/31/88/74/339318874.db2.gz ANRWLPFGZROISV-UHFFFAOYSA-N 0 0 306.475 5.025 20 0 DKADRN CC(C)[C@@H]1CN(C(=O)c2ccc(C(F)F)cc2)c2ccccc21 ZINC000470395449 339318947 /nfs/dbraw/zinc/31/89/47/339318947.db2.gz YGVWRIYFLCXHQY-INIZCTEOSA-N 0 0 315.363 5.024 20 0 DKADRN CC(C)[C@H]1CN(C(=O)c2ccc(C(F)F)cc2)c2ccccc21 ZINC000470395450 339318964 /nfs/dbraw/zinc/31/89/64/339318964.db2.gz YGVWRIYFLCXHQY-MRXNPFEDSA-N 0 0 315.363 5.024 20 0 DKADRN CC(C)[C@@H]1CN(C(=O)c2cccc(C(F)F)c2)c2ccccc21 ZINC000470401446 339319022 /nfs/dbraw/zinc/31/90/22/339319022.db2.gz SBBGLFMQDJCDIH-INIZCTEOSA-N 0 0 315.363 5.024 20 0 DKADRN CC(C)[C@H]1CN(C(=O)c2cccc(C(F)F)c2)c2ccccc21 ZINC000470401447 339319045 /nfs/dbraw/zinc/31/90/45/339319045.db2.gz SBBGLFMQDJCDIH-MRXNPFEDSA-N 0 0 315.363 5.024 20 0 DKADRN Cc1c(COC(C)(C)C)cccc1NC(=O)Nc1ccsc1 ZINC000470404261 339319084 /nfs/dbraw/zinc/31/90/84/339319084.db2.gz ORQPVFDBDDNNPL-UHFFFAOYSA-N 0 0 318.442 5.016 20 0 DKADRN Cc1cccc(F)c1NC(=O)N1CCCC2(CCCCC2)CC1 ZINC000470417487 339319238 /nfs/dbraw/zinc/31/92/38/339319238.db2.gz GOWNWJOTBBZGCA-UHFFFAOYSA-N 0 0 318.436 5.102 20 0 DKADRN Cc1csc(C(=O)Nc2ccc(C3CCC3)cc2)c1Cl ZINC000470467538 339320403 /nfs/dbraw/zinc/32/04/03/339320403.db2.gz UYTQQIPQKWRYNO-UHFFFAOYSA-N 0 0 305.830 5.230 20 0 DKADRN O=C(Nc1ccc(C2CCC2)cc1)c1ccc(C(F)F)cc1 ZINC000470487696 339320791 /nfs/dbraw/zinc/32/07/91/339320791.db2.gz QRZGPLYMWNTETA-UHFFFAOYSA-N 0 0 301.336 5.144 20 0 DKADRN O=C(Nc1ccc(C2CCC2)cc1)c1cccc(C(F)F)c1 ZINC000470492310 339320911 /nfs/dbraw/zinc/32/09/11/339320911.db2.gz DTONEPAPKGPAIT-UHFFFAOYSA-N 0 0 301.336 5.144 20 0 DKADRN C[C@@H]1CCC[C@H]1CC(=O)N1CCCC[C@@H]1c1cc2ccccc2[nH]1 ZINC000470495909 339321028 /nfs/dbraw/zinc/32/10/28/339321028.db2.gz DVPNUVBLLCKMLK-GQIGUUNPSA-N 0 0 324.468 5.048 20 0 DKADRN C[C@@H]1CCC[C@H]1CC(=O)N1CCCC[C@H]1c1cc2ccccc2[nH]1 ZINC000470495911 339321038 /nfs/dbraw/zinc/32/10/38/339321038.db2.gz DVPNUVBLLCKMLK-GUXCAODWSA-N 0 0 324.468 5.048 20 0 DKADRN C[C@@H]1CCC[C@@H]1CC(=O)N1CCCC[C@@H]1c1cc2ccccc2[nH]1 ZINC000470495913 339320973 /nfs/dbraw/zinc/32/09/73/339320973.db2.gz DVPNUVBLLCKMLK-JXXFODFXSA-N 0 0 324.468 5.048 20 0 DKADRN C[C@@H]1CCC[C@@H]1CC(=O)N1CCCC[C@H]1c1cc2ccccc2[nH]1 ZINC000470495915 339320965 /nfs/dbraw/zinc/32/09/65/339320965.db2.gz DVPNUVBLLCKMLK-QINHECLXSA-N 0 0 324.468 5.048 20 0 DKADRN O=C(Nc1ccc(C2CCC2)cc1)c1ccccc1C(F)(F)F ZINC000470500428 339321131 /nfs/dbraw/zinc/32/11/31/339321131.db2.gz LFKSBCRNICYHGO-UHFFFAOYSA-N 0 0 319.326 5.225 20 0 DKADRN Cc1cc(C(=O)Nc2ccc(C3CCC3)cc2)c(C(F)(F)F)o1 ZINC000470501115 339321077 /nfs/dbraw/zinc/32/10/77/339321077.db2.gz SZUHJKDDBNCOLH-UHFFFAOYSA-N 0 0 323.314 5.127 20 0 DKADRN Cc1cc(C(=O)Nc2cccc(Cl)c2C)c(Cl)cc1F ZINC000470507989 339321235 /nfs/dbraw/zinc/32/12/35/339321235.db2.gz SIFGQKVJKJXHPF-UHFFFAOYSA-N 0 0 312.171 5.002 20 0 DKADRN Cc1cc(C(=O)Nc2cc(Cl)ccc2C)c(Cl)cc1F ZINC000470515458 339321328 /nfs/dbraw/zinc/32/13/28/339321328.db2.gz BCGUQGNSHJHRQA-UHFFFAOYSA-N 0 0 312.171 5.002 20 0 DKADRN Cc1cc(C(=O)Nc2ccc(-c3ccco3)cc2F)sc1C ZINC000470515895 339321331 /nfs/dbraw/zinc/32/13/31/339321331.db2.gz IPTORFSZUYODDR-UHFFFAOYSA-N 0 0 315.369 5.016 20 0 DKADRN Cc1cc(C(=O)Nc2ccc(Cl)cc2C)c(Cl)cc1F ZINC000470515993 339321327 /nfs/dbraw/zinc/32/13/27/339321327.db2.gz KJZKWCPZMHGMEM-UHFFFAOYSA-N 0 0 312.171 5.002 20 0 DKADRN O=C(Nc1ccc(-c2ccco2)cc1F)c1cc2ccccc2o1 ZINC000470528890 339321521 /nfs/dbraw/zinc/32/15/21/339321521.db2.gz CGDRBNVQLQYRNY-UHFFFAOYSA-N 0 0 321.307 5.084 20 0 DKADRN O=C(Nc1ccc(-c2ccco2)cc1F)c1csc(Cl)c1 ZINC000470532280 339321551 /nfs/dbraw/zinc/32/15/51/339321551.db2.gz OCEQIBCWXPQHOZ-UHFFFAOYSA-N 0 0 321.760 5.053 20 0 DKADRN O=C(Nc1ccc(-c2ccco2)cc1F)c1coc2ccccc12 ZINC000470540608 339321793 /nfs/dbraw/zinc/32/17/93/339321793.db2.gz AATHMNWYCCNFAA-UHFFFAOYSA-N 0 0 321.307 5.084 20 0 DKADRN O=C(Nc1ccc(-c2ccco2)cc1F)c1ccc(Cl)s1 ZINC000470540841 339321676 /nfs/dbraw/zinc/32/16/76/339321676.db2.gz ZKIWRGWWYHLTPK-UHFFFAOYSA-N 0 0 321.760 5.053 20 0 DKADRN CC(C)(C(=O)Nc1ccc(-c2ccco2)cc1F)c1ccccc1 ZINC000470540951 339321767 /nfs/dbraw/zinc/32/17/67/339321767.db2.gz CGSUAGLKPWJEGY-UHFFFAOYSA-N 0 0 323.367 5.002 20 0 DKADRN c1nc2cc(NCc3cnc(-c4ccccc4)s3)ccc2s1 ZINC000470545966 339321955 /nfs/dbraw/zinc/32/19/55/339321955.db2.gz IGHNXHYVGKZALN-UHFFFAOYSA-N 0 0 323.446 5.032 20 0 DKADRN Cc1scc(C(=O)Nc2ccc(-c3ccco3)cc2F)c1C ZINC000470551024 339322049 /nfs/dbraw/zinc/32/20/49/339322049.db2.gz HIXZQSPZVWWPKG-UHFFFAOYSA-N 0 0 315.369 5.016 20 0 DKADRN CC(=O)Nc1ccc(Cl)cc1-c1cccc(Cl)c1Cl ZINC000470568772 339322474 /nfs/dbraw/zinc/32/24/74/339322474.db2.gz IZJDQXGNRHUHLS-UHFFFAOYSA-N 0 0 314.599 5.272 20 0 DKADRN Cc1cc(C(=O)Nc2c(C)cccc2Cl)c(Cl)cc1F ZINC000470619254 339323170 /nfs/dbraw/zinc/32/31/70/339323170.db2.gz NFBZDIRKEVTDFU-UHFFFAOYSA-N 0 0 312.171 5.002 20 0 DKADRN FC(F)c1cccc(CN(Cc2ccco2)Cc2ccco2)c1 ZINC000470724804 339326256 /nfs/dbraw/zinc/32/62/56/339326256.db2.gz ZBGMYMFIWQEIAP-UHFFFAOYSA-N 0 0 317.335 5.013 20 0 DKADRN C[C@H](NCc1cccc(C(F)F)c1)c1c(F)cccc1Cl ZINC000470762073 339327097 /nfs/dbraw/zinc/32/70/97/339327097.db2.gz OMIWBWZAICAOIR-JTQLQIEISA-N 0 0 313.750 5.268 20 0 DKADRN C[C@@H](NCc1cccc(C(F)F)c1)c1c(F)cccc1Cl ZINC000470762074 339327127 /nfs/dbraw/zinc/32/71/27/339327127.db2.gz OMIWBWZAICAOIR-SNVBAGLBSA-N 0 0 313.750 5.268 20 0 DKADRN 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339344400 /nfs/dbraw/zinc/34/44/00/339344400.db2.gz ZNWPBBARCSDIEX-UHFFFAOYSA-N 0 0 323.367 5.161 20 0 DKADRN CS[C@H](C)CC(=O)Nc1cc(-c2ccccc2)ccc1Cl ZINC000471423248 339344608 /nfs/dbraw/zinc/34/46/08/339344608.db2.gz GBOHCCCGCKVYBC-GFCCVEGCSA-N 0 0 319.857 5.087 20 0 DKADRN CS[C@@H](C)CC(=O)Nc1cc(-c2ccccc2)ccc1Cl ZINC000471423249 339344549 /nfs/dbraw/zinc/34/45/49/339344549.db2.gz GBOHCCCGCKVYBC-LBPRGKRZSA-N 0 0 319.857 5.087 20 0 DKADRN CCC(=O)c1ccc(Cl)c(NC(=O)C2(CC(C)C)CCC2)c1 ZINC000471423749 339344533 /nfs/dbraw/zinc/34/45/33/339344533.db2.gz YEISDEVBQODMBK-UHFFFAOYSA-N 0 0 321.848 5.088 20 0 DKADRN C[C@H](SCCC(F)(F)F)c1ncc(-c2ccccc2)o1 ZINC000471426979 339344606 /nfs/dbraw/zinc/34/46/06/339344606.db2.gz LDGLLOCYWRKKKS-JTQLQIEISA-N 0 0 301.333 5.088 20 0 DKADRN C[C@@H](SCCC(F)(F)F)c1ncc(-c2ccccc2)o1 ZINC000471426981 339344565 /nfs/dbraw/zinc/34/45/65/339344565.db2.gz LDGLLOCYWRKKKS-SNVBAGLBSA-N 0 0 301.333 5.088 20 0 DKADRN CCC(=O)c1ccc(Cl)c(NC(=O)C(C)(C)C2CCCC2)c1 ZINC000471431400 339344667 /nfs/dbraw/zinc/34/46/67/339344667.db2.gz BUNGEMBHAQQHPC-UHFFFAOYSA-N 0 0 321.848 5.088 20 0 DKADRN O=C(Nc1cc(-c2ccccc2)ccc1Cl)c1ccsc1 ZINC000471431950 339344751 /nfs/dbraw/zinc/34/47/51/339344751.db2.gz GQLXUWODISYACK-UHFFFAOYSA-N 0 0 313.809 5.321 20 0 DKADRN CC[C@H](SC)C(=O)Nc1cc(-c2ccccc2)ccc1Cl ZINC000471433656 339344736 /nfs/dbraw/zinc/34/47/36/339344736.db2.gz ROFSJQOQQQTBMV-INIZCTEOSA-N 0 0 319.857 5.087 20 0 DKADRN CC[C@@H](SC)C(=O)Nc1cc(-c2ccccc2)ccc1Cl ZINC000471433657 339344731 /nfs/dbraw/zinc/34/47/31/339344731.db2.gz ROFSJQOQQQTBMV-MRXNPFEDSA-N 0 0 319.857 5.087 20 0 DKADRN CC(C)(C(=O)Nc1cc(-c2ccccc2)ccc1Cl)C(F)F ZINC000471435481 339344819 /nfs/dbraw/zinc/34/48/19/339344819.db2.gz HAAUHJPZWOXZAY-UHFFFAOYSA-N 0 0 323.770 5.237 20 0 DKADRN Cc1cc(C(=O)Nc2cc(-c3ccccc3)ccc2Cl)co1 ZINC000471438208 339344817 /nfs/dbraw/zinc/34/48/17/339344817.db2.gz WFQQAEKHVHNNMF-UHFFFAOYSA-N 0 0 311.768 5.161 20 0 DKADRN Cc1ccoc1C(=O)Nc1cc(-c2ccccc2)ccc1Cl ZINC000471439952 339344994 /nfs/dbraw/zinc/34/49/94/339344994.db2.gz KIVJIGVUOKWFND-UHFFFAOYSA-N 0 0 311.768 5.161 20 0 DKADRN CSCCCC(=O)Nc1cc(-c2ccccc2)ccc1Cl ZINC000471440137 339345007 /nfs/dbraw/zinc/34/50/07/339345007.db2.gz LIDKFDSXJWZRCB-UHFFFAOYSA-N 0 0 319.857 5.089 20 0 DKADRN O=C(Nc1cc(-c2ccccc2)ccc1Cl)c1cccs1 ZINC000471441168 339344965 /nfs/dbraw/zinc/34/49/65/339344965.db2.gz IQZKCVSDAVDGII-UHFFFAOYSA-N 0 0 313.809 5.321 20 0 DKADRN CCC(CC)N(C(=O)c1cccc(C(C)=O)c1)c1cccc(C)c1 ZINC000471446014 339345069 /nfs/dbraw/zinc/34/50/69/339345069.db2.gz YWKXKJZFNPNMLV-UHFFFAOYSA-N 0 0 323.436 5.033 20 0 DKADRN Cc1occc1C(=O)Nc1cc(-c2ccccc2)ccc1Cl ZINC000471450055 339345212 /nfs/dbraw/zinc/34/52/12/339345212.db2.gz NRXMWNBVGHDHCP-UHFFFAOYSA-N 0 0 311.768 5.161 20 0 DKADRN CCCC(C)(C)CC(=O)Nc1cc(C(=O)CC)ccc1Cl ZINC000471451713 339345282 /nfs/dbraw/zinc/34/52/82/339345282.db2.gz OGCXPWTVSXDPTI-UHFFFAOYSA-N 0 0 309.837 5.088 20 0 DKADRN CCC(CC)N(C(=O)c1ccc(C(C)=O)cc1)c1cccc(C)c1 ZINC000471452267 339345333 /nfs/dbraw/zinc/34/53/33/339345333.db2.gz NFXPIKAZDAEXAB-UHFFFAOYSA-N 0 0 323.436 5.033 20 0 DKADRN Cc1ccc(C(=O)Nc2cc(-c3ccccc3)ccc2Cl)o1 ZINC000471460482 339345398 /nfs/dbraw/zinc/34/53/98/339345398.db2.gz RWJYKWJOVNPHTN-UHFFFAOYSA-N 0 0 311.768 5.161 20 0 DKADRN COc1ccsc1[C@@H](C)Nc1cccc(-c2nccs2)c1 ZINC000471596073 339348707 /nfs/dbraw/zinc/34/87/07/339348707.db2.gz WUFQOHVOGHHSLN-LLVKDONJSA-N 0 0 316.451 5.053 20 0 DKADRN COc1ccsc1[C@H](C)Nc1cccc(-c2nccs2)c1 ZINC000471596074 339348629 /nfs/dbraw/zinc/34/86/29/339348629.db2.gz WUFQOHVOGHHSLN-NSHDSACASA-N 0 0 316.451 5.053 20 0 DKADRN COc1ccsc1[C@@H](C)Nc1cccc(C(F)F)c1Cl ZINC000471603277 339349039 /nfs/dbraw/zinc/34/90/39/339349039.db2.gz SAKKDZGOMRTJLT-MRVPVSSYSA-N 0 0 317.788 5.521 20 0 DKADRN COc1ccsc1[C@H](C)Nc1cccc(C(F)F)c1Cl ZINC000471603278 339349033 /nfs/dbraw/zinc/34/90/33/339349033.db2.gz SAKKDZGOMRTJLT-QMMMGPOBSA-N 0 0 317.788 5.521 20 0 DKADRN CCSCc1cccc(N[C@H](C)c2sccc2OC)c1 ZINC000471615006 339349630 /nfs/dbraw/zinc/34/96/30/339349630.db2.gz OVAXHSAPPFEBHM-GFCCVEGCSA-N 0 0 307.484 5.183 20 0 DKADRN CCSCc1cccc(N[C@@H](C)c2sccc2OC)c1 ZINC000471615007 339349664 /nfs/dbraw/zinc/34/96/64/339349664.db2.gz OVAXHSAPPFEBHM-LBPRGKRZSA-N 0 0 307.484 5.183 20 0 DKADRN Cc1cc(C)c(NC(=O)c2coc3cc(C)c(C)cc23)c(C)c1 ZINC000471650594 339350299 /nfs/dbraw/zinc/35/02/99/339350299.db2.gz YFKOXFZIIXBECQ-UHFFFAOYSA-N 0 0 307.393 5.227 20 0 DKADRN Cc1nc2ccccc2nc1CNc1ccccc1SC(C)C ZINC000471659257 339350419 /nfs/dbraw/zinc/35/04/19/339350419.db2.gz PXHSQOWTNDJECC-UHFFFAOYSA-N 0 0 323.465 5.051 20 0 DKADRN CCCc1nc(CNc2ccccc2SC(C)C)cs1 ZINC000471674837 339350695 /nfs/dbraw/zinc/35/06/95/339350695.db2.gz XKQQPRATAJFQKR-UHFFFAOYSA-N 0 0 306.500 5.208 20 0 DKADRN CSCc1cc(C(=O)Nc2ccccc2C(C)C)ccc1F ZINC000471682877 339350906 /nfs/dbraw/zinc/35/09/06/339350906.db2.gz NJHFLKLCBYRTSM-UHFFFAOYSA-N 0 0 317.429 5.064 20 0 DKADRN Cc1cc(O[C@@H](C)c2ccccc2)ccc1NC(=O)C1=CCCC1 ZINC000471686931 339350941 /nfs/dbraw/zinc/35/09/41/339350941.db2.gz HJDKMLBVCDPRSA-INIZCTEOSA-N 0 0 321.420 5.184 20 0 DKADRN Cc1cc(O[C@H](C)c2ccccc2)ccc1NC(=O)C1=CCCC1 ZINC000471686936 339351007 /nfs/dbraw/zinc/35/10/07/339351007.db2.gz HJDKMLBVCDPRSA-MRXNPFEDSA-N 0 0 321.420 5.184 20 0 DKADRN O=C(Nc1ccc(F)cc1-c1ccc(Cl)cc1)C1=CCCC1 ZINC000471693245 339351138 /nfs/dbraw/zinc/35/11/38/339351138.db2.gz MVCNUFBGFSPKPC-UHFFFAOYSA-N 0 0 315.775 5.195 20 0 DKADRN Cc1ccccc1N(C(=O)c1ccc2sccc2c1)C(C)C ZINC000471706249 339351733 /nfs/dbraw/zinc/35/17/33/339351733.db2.gz OCBUNWXZKCCGND-UHFFFAOYSA-N 0 0 309.434 5.265 20 0 DKADRN Cc1cc2occ(C(=O)Nc3ccccc3OC(C)C)c2cc1C ZINC000471729109 339352577 /nfs/dbraw/zinc/35/25/77/339352577.db2.gz WFCFOMXYPPVIRH-UHFFFAOYSA-N 0 0 323.392 5.089 20 0 DKADRN Cc1cc2occ(C(=O)N([C@@H](C)c3ccco3)C3CC3)c2cc1C ZINC000471740582 339352931 /nfs/dbraw/zinc/35/29/31/339352931.db2.gz IXMWELDGVOZKGG-AWEZNQCLSA-N 0 0 323.392 5.008 20 0 DKADRN Cc1cc2occ(C(=O)N([C@H](C)c3ccco3)C3CC3)c2cc1C ZINC000471740585 339352859 /nfs/dbraw/zinc/35/28/59/339352859.db2.gz IXMWELDGVOZKGG-CQSZACIVSA-N 0 0 323.392 5.008 20 0 DKADRN CCCC1(C(=O)N2CC=C(c3cccc4ccccc43)CC2)CC1 ZINC000471771162 339353570 /nfs/dbraw/zinc/35/35/70/339353570.db2.gz NGIZELPMHONCIB-UHFFFAOYSA-N 0 0 319.448 5.036 20 0 DKADRN Cc1cc2occ(C(=O)Nc3cccc(C(F)F)c3)c2cc1C ZINC000471782409 339353800 /nfs/dbraw/zinc/35/38/00/339353800.db2.gz UCCSSRIMKKMGDQ-UHFFFAOYSA-N 0 0 315.319 5.240 20 0 DKADRN CO[C@@H](C)c1cccc(NC(=O)c2coc3cc(C)c(C)cc23)c1 ZINC000471788390 339354026 /nfs/dbraw/zinc/35/40/26/339354026.db2.gz PYRUXBZSKHCAKF-AWEZNQCLSA-N 0 0 323.392 5.009 20 0 DKADRN CO[C@H](C)c1cccc(NC(=O)c2coc3cc(C)c(C)cc23)c1 ZINC000471788391 339354058 /nfs/dbraw/zinc/35/40/58/339354058.db2.gz PYRUXBZSKHCAKF-CQSZACIVSA-N 0 0 323.392 5.009 20 0 DKADRN Cc1c(NC(=O)c2coc3ccccc23)cccc1C(F)(F)F ZINC000471823982 339355386 /nfs/dbraw/zinc/35/53/86/339355386.db2.gz RTOZDIDKJVXQPZ-UHFFFAOYSA-N 0 0 319.282 5.012 20 0 DKADRN Cc1c(NC(=O)c2cc3ccccc3o2)cccc1C(F)(F)F ZINC000471859118 339356229 /nfs/dbraw/zinc/35/62/29/339356229.db2.gz USQCBOMFJURJHE-UHFFFAOYSA-N 0 0 319.282 5.012 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)N1CCCCC[C@@H]1C ZINC000471868263 339356410 /nfs/dbraw/zinc/35/64/10/339356410.db2.gz BDXYMUCRYGRNEG-INIZCTEOSA-N 0 0 316.489 5.559 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)N1CCCCC[C@H]1C ZINC000471868264 339356386 /nfs/dbraw/zinc/35/63/86/339356386.db2.gz BDXYMUCRYGRNEG-MRXNPFEDSA-N 0 0 316.489 5.559 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)NC1(CC)CCC1 ZINC000471868568 339356463 /nfs/dbraw/zinc/35/64/63/339356463.db2.gz CGKADAMUYMILLG-UHFFFAOYSA-N 0 0 302.462 5.217 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)N(C)C1CCCCC1 ZINC000471868719 339356446 /nfs/dbraw/zinc/35/64/46/339356446.db2.gz GIAWRPFGIIQZHZ-UHFFFAOYSA-N 0 0 316.489 5.559 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)NC(C1CC1)C1CC1 ZINC000471868791 339356455 /nfs/dbraw/zinc/35/64/55/339356455.db2.gz DIYKWXPTOHTRGC-UHFFFAOYSA-N 0 0 314.473 5.073 20 0 DKADRN Cc1csc(CSCC2CCC(C(F)(F)F)CC2)n1 ZINC000471870568 339356497 /nfs/dbraw/zinc/35/64/97/339356497.db2.gz MYXBXQVRLNRAEX-UHFFFAOYSA-N 0 0 309.422 5.053 20 0 DKADRN CCCCN(CC)C(=O)Nc1c(CCC)cccc1C(C)C ZINC000471870716 339356487 /nfs/dbraw/zinc/35/64/87/339356487.db2.gz JZNQFCAQSPAGOG-UHFFFAOYSA-N 0 0 304.478 5.416 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)NC1CCCCC1 ZINC000471872554 339356516 /nfs/dbraw/zinc/35/65/16/339356516.db2.gz QIPFNMQIADXDAX-UHFFFAOYSA-N 0 0 302.462 5.217 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)N1CC[C@@H](C)[C@@H](C)C1 ZINC000471872881 339356547 /nfs/dbraw/zinc/35/65/47/339356547.db2.gz RKOWFFPGRMGCKC-CVEARBPZSA-N 0 0 316.489 5.272 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)N1CC[C@H](C)[C@@H](C)C1 ZINC000471872882 339356502 /nfs/dbraw/zinc/35/65/02/339356502.db2.gz RKOWFFPGRMGCKC-HOTGVXAUSA-N 0 0 316.489 5.272 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)N1CC[C@@H](C)[C@H](C)C1 ZINC000471872883 339356561 /nfs/dbraw/zinc/35/65/61/339356561.db2.gz RKOWFFPGRMGCKC-HZPDHXFCSA-N 0 0 316.489 5.272 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)N1CC[C@H](C)[C@H](C)C1 ZINC000471872884 339356477 /nfs/dbraw/zinc/35/64/77/339356477.db2.gz RKOWFFPGRMGCKC-JKSUJKDBSA-N 0 0 316.489 5.272 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)N(CC)CC(C)C ZINC000471873187 339356525 /nfs/dbraw/zinc/35/65/25/339356525.db2.gz BSEGOXYMZRZMDG-UHFFFAOYSA-N 0 0 304.478 5.272 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)N1CCC(CC)CC1 ZINC000471874702 339356535 /nfs/dbraw/zinc/35/65/35/339356535.db2.gz HGDUGETZXBIGLM-UHFFFAOYSA-N 0 0 316.489 5.416 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)N1CC2(C1)CCCC2 ZINC000471876113 339356608 /nfs/dbraw/zinc/35/66/08/339356608.db2.gz LYDIPOYQUZKGNO-UHFFFAOYSA-N 0 0 314.473 5.170 20 0 DKADRN CCc1noc(C)c1CSCC1CCC(C(F)(F)F)CC1 ZINC000471876408 339356648 /nfs/dbraw/zinc/35/66/48/339356648.db2.gz MAVYPUFXNLXGNS-UHFFFAOYSA-N 0 0 321.408 5.147 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)N(C)C[C@@H](C)CC ZINC000471876905 339356659 /nfs/dbraw/zinc/35/66/59/339356659.db2.gz ZPDHOMCQTXRQHX-HNNXBMFYSA-N 0 0 304.478 5.272 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)N(C)C[C@H](C)CC ZINC000471876906 339356661 /nfs/dbraw/zinc/35/66/61/339356661.db2.gz ZPDHOMCQTXRQHX-OAHLLOKOSA-N 0 0 304.478 5.272 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)N[C@@H](C)CC1CC1 ZINC000471877877 339356581 /nfs/dbraw/zinc/35/65/81/339356581.db2.gz VCXSZDCRFWXJRM-AWEZNQCLSA-N 0 0 302.462 5.073 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)N[C@H](C)CC1CC1 ZINC000471877878 339356577 /nfs/dbraw/zinc/35/65/77/339356577.db2.gz VCXSZDCRFWXJRM-CQSZACIVSA-N 0 0 302.462 5.073 20 0 DKADRN Cc1nc(CSCC2CCC(C(F)(F)F)CC2)cs1 ZINC000471877993 339356630 /nfs/dbraw/zinc/35/66/30/339356630.db2.gz QGVICYJLRGFMDZ-UHFFFAOYSA-N 0 0 309.422 5.053 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)N1CCC[C@@H]1C(C)C ZINC000471878079 339356642 /nfs/dbraw/zinc/35/66/42/339356642.db2.gz WHHMTRLOJIUZPQ-GOSISDBHSA-N 0 0 316.489 5.415 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)N1CCC[C@H]1C(C)C ZINC000471878080 339356658 /nfs/dbraw/zinc/35/66/58/339356658.db2.gz WHHMTRLOJIUZPQ-SFHVURJKSA-N 0 0 316.489 5.415 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)NC1(C)CCCC1 ZINC000471879025 339356627 /nfs/dbraw/zinc/35/66/27/339356627.db2.gz XYAWXMXHGQHYJU-UHFFFAOYSA-N 0 0 302.462 5.217 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)N(C)[C@@H](C)CCC ZINC000471879393 339356621 /nfs/dbraw/zinc/35/66/21/339356621.db2.gz BRHVWCNNTRTASX-HNNXBMFYSA-N 0 0 304.478 5.415 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)N(C)[C@H](C)CCC ZINC000471879394 339356656 /nfs/dbraw/zinc/35/66/56/339356656.db2.gz BRHVWCNNTRTASX-OAHLLOKOSA-N 0 0 304.478 5.415 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)N(C)CC1CCCC1 ZINC000471879547 339356672 /nfs/dbraw/zinc/35/66/72/339356672.db2.gz DEWJFMCGWBMNPZ-UHFFFAOYSA-N 0 0 316.489 5.416 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)N1C[C@H](C)CC[C@@H]1C ZINC000471879915 339356580 /nfs/dbraw/zinc/35/65/80/339356580.db2.gz IGTHTBWPESJCFZ-CVEARBPZSA-N 0 0 316.489 5.415 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)N1C[C@@H](C)CC[C@@H]1C ZINC000471879916 339356586 /nfs/dbraw/zinc/35/65/86/339356586.db2.gz IGTHTBWPESJCFZ-HOTGVXAUSA-N 0 0 316.489 5.415 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)N1C[C@H](C)CC[C@H]1C ZINC000471879917 339356585 /nfs/dbraw/zinc/35/65/85/339356585.db2.gz IGTHTBWPESJCFZ-HZPDHXFCSA-N 0 0 316.489 5.415 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)N1C[C@@H](C)CC[C@H]1C ZINC000471879918 339356575 /nfs/dbraw/zinc/35/65/75/339356575.db2.gz IGTHTBWPESJCFZ-JKSUJKDBSA-N 0 0 316.489 5.415 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)N(CC(C)C)C1CC1 ZINC000471880298 339356602 /nfs/dbraw/zinc/35/66/02/339356602.db2.gz MZLHUXVXWDSUBS-UHFFFAOYSA-N 0 0 316.489 5.415 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)N(C)[C@@H](C)C(C)C ZINC000471880782 339356652 /nfs/dbraw/zinc/35/66/52/339356652.db2.gz QNORONGWIBFNSH-HNNXBMFYSA-N 0 0 304.478 5.271 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)N(C)[C@H](C)C(C)C ZINC000471880783 339356600 /nfs/dbraw/zinc/35/66/00/339356600.db2.gz QNORONGWIBFNSH-OAHLLOKOSA-N 0 0 304.478 5.271 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)N1[C@H](CC)CC[C@@H]1C ZINC000471881168 339356579 /nfs/dbraw/zinc/35/65/79/339356579.db2.gz CTMOELDNJGGUTQ-DOTOQJQBSA-N 0 0 316.489 5.557 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)N1[C@H](C)CC[C@H]1CC ZINC000471881169 339356744 /nfs/dbraw/zinc/35/67/44/339356744.db2.gz CTMOELDNJGGUTQ-NVXWUHKLSA-N 0 0 316.489 5.557 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)N1[C@@H](C)CC[C@@H]1CC ZINC000471881170 339356692 /nfs/dbraw/zinc/35/66/92/339356692.db2.gz CTMOELDNJGGUTQ-RDJZCZTQSA-N 0 0 316.489 5.557 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)N1[C@H](C)CC[C@@H]1CC ZINC000471881171 339356696 /nfs/dbraw/zinc/35/66/96/339356696.db2.gz CTMOELDNJGGUTQ-WBVHZDCISA-N 0 0 316.489 5.557 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)N1C[C@@H](C)C[C@H]1CC ZINC000471881745 339356700 /nfs/dbraw/zinc/35/67/00/339356700.db2.gz UJJFAQCAFXLZKS-DOTOQJQBSA-N 0 0 316.489 5.415 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)N1C[C@H](C)C[C@H]1CC ZINC000471881746 339356686 /nfs/dbraw/zinc/35/66/86/339356686.db2.gz UJJFAQCAFXLZKS-NVXWUHKLSA-N 0 0 316.489 5.415 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)N1C[C@@H](C)C[C@@H]1CC ZINC000471881747 339356683 /nfs/dbraw/zinc/35/66/83/339356683.db2.gz UJJFAQCAFXLZKS-RDJZCZTQSA-N 0 0 316.489 5.415 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)N1C[C@H](C)C[C@@H]1CC ZINC000471881748 339356681 /nfs/dbraw/zinc/35/66/81/339356681.db2.gz UJJFAQCAFXLZKS-WBVHZDCISA-N 0 0 316.489 5.415 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)N(C)CC(C)(C)C ZINC000471882165 339356763 /nfs/dbraw/zinc/35/67/63/339356763.db2.gz BCAHIMQGINHIPI-UHFFFAOYSA-N 0 0 304.478 5.272 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)N1CC[C@H](C2CC2)C1 ZINC000471882717 339356718 /nfs/dbraw/zinc/35/67/18/339356718.db2.gz IMKYGCHJQZRRFQ-KRWDZBQOSA-N 0 0 314.473 5.026 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)N1CC[C@@H](C2CC2)C1 ZINC000471882719 339356742 /nfs/dbraw/zinc/35/67/42/339356742.db2.gz IMKYGCHJQZRRFQ-QGZVFWFLSA-N 0 0 314.473 5.026 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)N(CC)C1CCC1 ZINC000471883161 339356731 /nfs/dbraw/zinc/35/67/31/339356731.db2.gz YKMZILKAVZWPMP-UHFFFAOYSA-N 0 0 302.462 5.169 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)N[C@@H]1CC[C@@H](C)C1 ZINC000471883567 339356741 /nfs/dbraw/zinc/35/67/41/339356741.db2.gz KGEVEXHXGCKSGP-GDBMZVCRSA-N 0 0 302.462 5.073 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)N[C@@H]1CC[C@H](C)C1 ZINC000471883568 339356695 /nfs/dbraw/zinc/35/66/95/339356695.db2.gz KGEVEXHXGCKSGP-GOEBONIOSA-N 0 0 302.462 5.073 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)N[C@H]1CC[C@H](C)C1 ZINC000471883569 339356697 /nfs/dbraw/zinc/35/66/97/339356697.db2.gz KGEVEXHXGCKSGP-HOCLYGCPSA-N 0 0 302.462 5.073 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)N[C@H]1CC[C@@H](C)C1 ZINC000471883570 339356759 /nfs/dbraw/zinc/35/67/59/339356759.db2.gz KGEVEXHXGCKSGP-ZBFHGGJFSA-N 0 0 302.462 5.073 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)N(C)[C@@H](C)C1CCC1 ZINC000471883580 339356719 /nfs/dbraw/zinc/35/67/19/339356719.db2.gz KJNWKWQLYCCHTQ-HNNXBMFYSA-N 0 0 316.489 5.415 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)N(C)[C@H](C)C1CCC1 ZINC000471883581 339356754 /nfs/dbraw/zinc/35/67/54/339356754.db2.gz KJNWKWQLYCCHTQ-OAHLLOKOSA-N 0 0 316.489 5.415 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)N(C)Cc1ccccc1 ZINC000471884652 339356748 /nfs/dbraw/zinc/35/67/48/339356748.db2.gz NLXWTOPBSGXVRQ-UHFFFAOYSA-N 0 0 324.468 5.426 20 0 DKADRN C[C@@H](CSCC1CCC(C(F)(F)F)CC1)C(F)(F)F ZINC000471885776 339356755 /nfs/dbraw/zinc/35/67/55/339356755.db2.gz PEXDEZVKCDNBSY-IDKOKCKLSA-N 0 0 308.331 5.287 20 0 DKADRN C[C@H](CSCC1CCC(C(F)(F)F)CC1)C(F)(F)F ZINC000471885777 339356727 /nfs/dbraw/zinc/35/67/27/339356727.db2.gz PEXDEZVKCDNBSY-XNWIYYODSA-N 0 0 308.331 5.287 20 0 DKADRN CC(C)n1ccc(CSCC2CCC(C(F)(F)F)CC2)n1 ZINC000471886161 339356715 /nfs/dbraw/zinc/35/67/15/339356715.db2.gz FTEDVRULMOLONG-UHFFFAOYSA-N 0 0 320.424 5.066 20 0 DKADRN Cc1ncc(CSCC2CCC(C(F)(F)F)CC2)s1 ZINC000471886212 339356704 /nfs/dbraw/zinc/35/67/04/339356704.db2.gz RXABRIYJGCJYSO-UHFFFAOYSA-N 0 0 309.422 5.053 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)N1CCCC(C)(C)C1 ZINC000471886225 339356724 /nfs/dbraw/zinc/35/67/24/339356724.db2.gz RYBZAMMGYRACHM-UHFFFAOYSA-N 0 0 316.489 5.416 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)N1CCC[C@@H](C)[C@@H]1C ZINC000471887110 339356720 /nfs/dbraw/zinc/35/67/20/339356720.db2.gz VHBJEIKBRBXGPS-CVEARBPZSA-N 0 0 316.489 5.415 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)N1CCC[C@H](C)[C@@H]1C ZINC000471887111 339356703 /nfs/dbraw/zinc/35/67/03/339356703.db2.gz VHBJEIKBRBXGPS-HOTGVXAUSA-N 0 0 316.489 5.415 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)N1CCC[C@@H](C)[C@H]1C ZINC000471887112 339356882 /nfs/dbraw/zinc/35/68/82/339356882.db2.gz VHBJEIKBRBXGPS-HZPDHXFCSA-N 0 0 316.489 5.415 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)N1CCC[C@H](C)[C@H]1C ZINC000471887113 339356847 /nfs/dbraw/zinc/35/68/47/339356847.db2.gz VHBJEIKBRBXGPS-JKSUJKDBSA-N 0 0 316.489 5.415 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)NCC1(CC)CC1 ZINC000471887551 339356822 /nfs/dbraw/zinc/35/68/22/339356822.db2.gz JXGNWAQAWQYLML-UHFFFAOYSA-N 0 0 302.462 5.074 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)N(C)Cc1ccoc1 ZINC000471888526 339356858 /nfs/dbraw/zinc/35/68/58/339356858.db2.gz UALMJAZLYKXLEC-UHFFFAOYSA-N 0 0 314.429 5.019 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)N1CC[C@H](C(C)C)C1 ZINC000471889149 339356843 /nfs/dbraw/zinc/35/68/43/339356843.db2.gz NMGNPHGAEKXCOF-KRWDZBQOSA-N 0 0 316.489 5.272 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)N1CC[C@@H](C(C)C)C1 ZINC000471889150 339356854 /nfs/dbraw/zinc/35/68/54/339356854.db2.gz NMGNPHGAEKXCOF-QGZVFWFLSA-N 0 0 316.489 5.272 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)Nc1ccccc1C ZINC000471890162 339356798 /nfs/dbraw/zinc/35/67/98/339356798.db2.gz ZNXHSAWUTXBFMC-UHFFFAOYSA-N 0 0 310.441 5.715 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)N1CCC[C@@H]1CC ZINC000471891656 339356918 /nfs/dbraw/zinc/35/69/18/339356918.db2.gz ANAWWKSOGWIASH-INIZCTEOSA-N 0 0 302.462 5.169 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)N1CCC[C@H]1CC ZINC000471891657 339356957 /nfs/dbraw/zinc/35/69/57/339356957.db2.gz ANAWWKSOGWIASH-MRXNPFEDSA-N 0 0 302.462 5.169 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)N1CC[C@](C)(CC)C1 ZINC000471891738 339356956 /nfs/dbraw/zinc/35/69/56/339356956.db2.gz BJRLQDGHALTYFF-FQEVSTJZSA-N 0 0 316.489 5.416 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)N1CC[C@@](C)(CC)C1 ZINC000471891739 339356930 /nfs/dbraw/zinc/35/69/30/339356930.db2.gz BJRLQDGHALTYFF-HXUWFJFHSA-N 0 0 316.489 5.416 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)N1CCC[C@H](C)CC1 ZINC000471892013 339356899 /nfs/dbraw/zinc/35/68/99/339356899.db2.gz FDVWNNSTUJGLAP-INIZCTEOSA-N 0 0 316.489 5.416 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)N1CCC[C@@H](C)CC1 ZINC000471892014 339356965 /nfs/dbraw/zinc/35/69/65/339356965.db2.gz FDVWNNSTUJGLAP-MRXNPFEDSA-N 0 0 316.489 5.416 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)N1C[C@@H](C)CC1(C)C ZINC000471892718 339356915 /nfs/dbraw/zinc/35/69/15/339356915.db2.gz LNOSTCQHLJXCQJ-HNNXBMFYSA-N 0 0 316.489 5.415 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)N1C[C@H](C)CC1(C)C ZINC000471892719 339356923 /nfs/dbraw/zinc/35/69/23/339356923.db2.gz LNOSTCQHLJXCQJ-OAHLLOKOSA-N 0 0 316.489 5.415 20 0 DKADRN CCCCN(C(=O)Nc1c(CCC)cccc1C(C)C)C1CC1 ZINC000471893677 339356963 /nfs/dbraw/zinc/35/69/63/339356963.db2.gz UAVQBKYBAWFLJQ-UHFFFAOYSA-N 0 0 316.489 5.559 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)N(CC)[C@@H](C)C(C)C ZINC000471894929 339356917 /nfs/dbraw/zinc/35/69/17/339356917.db2.gz HCRVSEOQAJCFFI-INIZCTEOSA-N 0 0 318.505 5.661 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)N(CC)[C@H](C)C(C)C ZINC000471894930 339356937 /nfs/dbraw/zinc/35/69/37/339356937.db2.gz HCRVSEOQAJCFFI-MRXNPFEDSA-N 0 0 318.505 5.661 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)N1CCC(C)(C)CC1 ZINC000471895631 339356985 /nfs/dbraw/zinc/35/69/85/339356985.db2.gz BBDCYHWAWQGBAB-UHFFFAOYSA-N 0 0 316.489 5.416 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)N(CCC)CCC ZINC000471896255 339357044 /nfs/dbraw/zinc/35/70/44/339357044.db2.gz DAQJRXMZFMPMBB-UHFFFAOYSA-N 0 0 304.478 5.416 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)Nc1cscc1C ZINC000471898958 339357084 /nfs/dbraw/zinc/35/70/84/339357084.db2.gz WZGWEHUGFXEXMT-UHFFFAOYSA-N 0 0 316.470 5.776 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)N(CCC)CC1CC1 ZINC000471900622 339357141 /nfs/dbraw/zinc/35/71/41/339357141.db2.gz GEIQOJICUVUWPG-UHFFFAOYSA-N 0 0 316.489 5.416 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)N1C[C@@H](C)C[C@H](C)C1 ZINC000471902411 339357108 /nfs/dbraw/zinc/35/71/08/339357108.db2.gz MDJJTZOJFTWQAJ-HOTGVXAUSA-N 0 0 316.489 5.272 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)N1C[C@H](C)C[C@@H](C)C1 ZINC000471902412 339357184 /nfs/dbraw/zinc/35/71/84/339357184.db2.gz MDJJTZOJFTWQAJ-HZPDHXFCSA-N 0 0 316.489 5.272 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)N1C[C@H](C)C[C@H](C)C1 ZINC000471902413 339357115 /nfs/dbraw/zinc/35/71/15/339357115.db2.gz MDJJTZOJFTWQAJ-IYBDPMFKSA-N 0 0 316.489 5.272 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)N1C[C@H](C)C[C@@H]1C ZINC000471903619 339357200 /nfs/dbraw/zinc/35/72/00/339357200.db2.gz UXDICXYTNJPVGU-CABCVRRESA-N 0 0 302.462 5.025 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)N1C[C@@H](C)C[C@@H]1C ZINC000471903620 339357294 /nfs/dbraw/zinc/35/72/94/339357294.db2.gz UXDICXYTNJPVGU-GJZGRUSLSA-N 0 0 302.462 5.025 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)N1C[C@H](C)C[C@H]1C ZINC000471903621 339357221 /nfs/dbraw/zinc/35/72/21/339357221.db2.gz UXDICXYTNJPVGU-HUUCEWRRSA-N 0 0 302.462 5.025 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)N1C[C@@H](C)C[C@H]1C ZINC000471903622 339357302 /nfs/dbraw/zinc/35/73/02/339357302.db2.gz UXDICXYTNJPVGU-LSDHHAIUSA-N 0 0 302.462 5.025 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)NCC1(C2CC2)CC1 ZINC000471904239 339357241 /nfs/dbraw/zinc/35/72/41/339357241.db2.gz BCOCORADHWOUBQ-UHFFFAOYSA-N 0 0 314.473 5.074 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)N1CCCC[C@H](C)C1 ZINC000471908315 339357345 /nfs/dbraw/zinc/35/73/45/339357345.db2.gz DQXXZCORKLZGSK-INIZCTEOSA-N 0 0 316.489 5.416 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)N1CCCC[C@@H](C)C1 ZINC000471908316 339357373 /nfs/dbraw/zinc/35/73/73/339357373.db2.gz DQXXZCORKLZGSK-MRXNPFEDSA-N 0 0 316.489 5.416 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)N1CC[C@H]2CCC[C@H]21 ZINC000471909052 339357398 /nfs/dbraw/zinc/35/73/98/339357398.db2.gz HMKSZARGFVFGOG-CRAIPNDOSA-N 0 0 314.473 5.169 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)N1CC[C@@H]2CCC[C@H]21 ZINC000471909054 339357314 /nfs/dbraw/zinc/35/73/14/339357314.db2.gz HMKSZARGFVFGOG-MAUKXSAKSA-N 0 0 314.473 5.169 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)N1CC[C@H]2CCC[C@@H]21 ZINC000471909057 339357310 /nfs/dbraw/zinc/35/73/10/339357310.db2.gz HMKSZARGFVFGOG-QAPCUYQASA-N 0 0 314.473 5.169 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)N1CC[C@@H]2CCC[C@@H]21 ZINC000471909060 339357352 /nfs/dbraw/zinc/35/73/52/339357352.db2.gz HMKSZARGFVFGOG-YJBOKZPZSA-N 0 0 314.473 5.169 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)N(CC)CCC1CC1 ZINC000471909267 339357380 /nfs/dbraw/zinc/35/73/80/339357380.db2.gz YTVAAIWUXDBDFH-UHFFFAOYSA-N 0 0 316.489 5.416 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)N1CC[C@@H](C)[C@H]1CC ZINC000471909307 339357381 /nfs/dbraw/zinc/35/73/81/339357381.db2.gz HMYDVBUVYOESKZ-CRAIPNDOSA-N 0 0 316.489 5.415 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)N1CC[C@H](C)[C@H]1CC ZINC000471909308 339357341 /nfs/dbraw/zinc/35/73/41/339357341.db2.gz HMYDVBUVYOESKZ-MAUKXSAKSA-N 0 0 316.489 5.415 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)N1CC[C@@H](C)[C@@H]1CC ZINC000471909309 339357360 /nfs/dbraw/zinc/35/73/60/339357360.db2.gz HMYDVBUVYOESKZ-QAPCUYQASA-N 0 0 316.489 5.415 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)N1CC[C@H](C)[C@@H]1CC ZINC000471909310 339357407 /nfs/dbraw/zinc/35/74/07/339357407.db2.gz HMYDVBUVYOESKZ-YJBOKZPZSA-N 0 0 316.489 5.415 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)N1CCC[C@H](CC)C1 ZINC000471913046 339357415 /nfs/dbraw/zinc/35/74/15/339357415.db2.gz YDTDHCVQKSUJGK-INIZCTEOSA-N 0 0 316.489 5.416 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)N1CCC[C@@H](CC)C1 ZINC000471913047 339357436 /nfs/dbraw/zinc/35/74/36/339357436.db2.gz YDTDHCVQKSUJGK-MRXNPFEDSA-N 0 0 316.489 5.416 20 0 DKADRN C[C@H](Sc1ccccc1)c1ccc(NC(=O)C2(C)CC2)cc1 ZINC000471915695 339357601 /nfs/dbraw/zinc/35/76/01/339357601.db2.gz SNDCHBADDGIUGA-AWEZNQCLSA-N 0 0 311.450 5.279 20 0 DKADRN C[C@@H](Sc1ccccc1)c1ccc(NC(=O)C2(C)CC2)cc1 ZINC000471915696 339357595 /nfs/dbraw/zinc/35/75/95/339357595.db2.gz SNDCHBADDGIUGA-CQSZACIVSA-N 0 0 311.450 5.279 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)N[C@@H](CC)CSC ZINC000471916436 339357582 /nfs/dbraw/zinc/35/75/82/339357582.db2.gz BEPHMOQBSMQEHU-HNNXBMFYSA-N 0 0 322.518 5.026 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)N[C@H](CC)CSC ZINC000471916437 339357577 /nfs/dbraw/zinc/35/75/77/339357577.db2.gz BEPHMOQBSMQEHU-OAHLLOKOSA-N 0 0 322.518 5.026 20 0 DKADRN Cc1cnc([C@H](C)SCC2CCC(C(F)(F)F)CC2)o1 ZINC000471923170 339357693 /nfs/dbraw/zinc/35/76/93/339357693.db2.gz XBRXJJUQSSDEJL-UNXYVOJBSA-N 0 0 307.381 5.146 20 0 DKADRN Cc1cnc([C@@H](C)SCC2CCC(C(F)(F)F)CC2)o1 ZINC000471923177 339357675 /nfs/dbraw/zinc/35/76/75/339357675.db2.gz XBRXJJUQSSDEJL-VOMCLLRMSA-N 0 0 307.381 5.146 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)N1CCCC[C@@H]1CC ZINC000471923792 339357624 /nfs/dbraw/zinc/35/76/24/339357624.db2.gz YYKNCEDXHLFVAG-KRWDZBQOSA-N 0 0 316.489 5.559 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)N1CCCC[C@H]1CC ZINC000471923793 339357613 /nfs/dbraw/zinc/35/76/13/339357613.db2.gz YYKNCEDXHLFVAG-QGZVFWFLSA-N 0 0 316.489 5.559 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)NCc1ccccc1 ZINC000471924099 339357687 /nfs/dbraw/zinc/35/76/87/339357687.db2.gz ZWDNLPMXFKWTAO-UHFFFAOYSA-N 0 0 310.441 5.084 20 0 DKADRN CCCC1(C(=O)Nc2cccc(COC(C)(C)CC)c2C)CC1 ZINC000471925436 339357694 /nfs/dbraw/zinc/35/76/94/339357694.db2.gz SFQNHCNPHISILK-UHFFFAOYSA-N 0 0 317.473 5.219 20 0 DKADRN Cc1nc(CCSCC2CCC(C(F)(F)F)CC2)cs1 ZINC000471928990 339357750 /nfs/dbraw/zinc/35/77/50/339357750.db2.gz KFBNHNCERWFAHV-UHFFFAOYSA-N 0 0 323.449 5.096 20 0 DKADRN CSc1cccc(C)c1NCc1csc(C(C)(C)C)n1 ZINC000471961533 339358311 /nfs/dbraw/zinc/35/83/11/339358311.db2.gz TUSZYLKJFBYFEB-UHFFFAOYSA-N 0 0 306.500 5.083 20 0 DKADRN CC(C)(C)C1CCN(C(=O)Nc2cccc(C(C)(F)F)c2)CC1 ZINC000471961541 339358309 /nfs/dbraw/zinc/35/83/09/339358309.db2.gz TXRHDQWETGYLCM-UHFFFAOYSA-N 0 0 324.415 5.088 20 0 DKADRN CSc1cccc(C)c1NC(=O)N1CCC(C(C)(C)C)CC1 ZINC000471961781 339358323 /nfs/dbraw/zinc/35/83/23/339358323.db2.gz WLNPQMWXUMEGGH-UHFFFAOYSA-N 0 0 320.502 5.007 20 0 DKADRN CSc1cccc(C)c1NCc1ncc(-c2ccc(C)cc2)o1 ZINC000471968903 339358365 /nfs/dbraw/zinc/35/83/65/339358365.db2.gz HFBUQJRHYBZUSF-UHFFFAOYSA-N 0 0 324.449 5.292 20 0 DKADRN CSc1cccc(C)c1NCc1nc(C(C)(C)C)cs1 ZINC000471983063 339358753 /nfs/dbraw/zinc/35/87/53/339358753.db2.gz GATMXBIYEWRALG-UHFFFAOYSA-N 0 0 306.500 5.083 20 0 DKADRN Cc1noc(-c2ccccc2)c1NC(=O)[C@H](C)CCC(C)(C)C ZINC000472018941 339359435 /nfs/dbraw/zinc/35/94/35/339359435.db2.gz UCRWMXAQNSVADD-CYBMUJFWSA-N 0 0 314.429 5.051 20 0 DKADRN Cc1noc(-c2ccccc2)c1NC(=O)[C@@H](C)CCC(C)(C)C ZINC000472018942 339359478 /nfs/dbraw/zinc/35/94/78/339359478.db2.gz UCRWMXAQNSVADD-ZDUSSCGKSA-N 0 0 314.429 5.051 20 0 DKADRN CCCC[C@H](CC)CC(=O)Nc1c(C)noc1-c1ccccc1 ZINC000472020897 339359493 /nfs/dbraw/zinc/35/94/93/339359493.db2.gz IAASMCZQBDNVTM-HNNXBMFYSA-N 0 0 314.429 5.195 20 0 DKADRN CCCC[C@@H](CC)CC(=O)Nc1c(C)noc1-c1ccccc1 ZINC000472020902 339359452 /nfs/dbraw/zinc/35/94/52/339359452.db2.gz IAASMCZQBDNVTM-OAHLLOKOSA-N 0 0 314.429 5.195 20 0 DKADRN Cc1cccc(Cl)c1NC(=O)c1ccc2sccc2c1 ZINC000472032450 339359624 /nfs/dbraw/zinc/35/96/24/339359624.db2.gz FPWSPBLSOUVAOL-UHFFFAOYSA-N 0 0 301.798 5.115 20 0 DKADRN CCSc1cccc(CN[C@H](c2ccco2)c2ccccc2)c1 ZINC000472035102 339359780 /nfs/dbraw/zinc/35/97/80/339359780.db2.gz MMRPBQICTNSPNM-FQEVSTJZSA-N 0 0 323.461 5.271 20 0 DKADRN CCSc1cccc(CN[C@@H](c2ccco2)c2ccccc2)c1 ZINC000472035103 339359868 /nfs/dbraw/zinc/35/98/68/339359868.db2.gz MMRPBQICTNSPNM-HXUWFJFHSA-N 0 0 323.461 5.271 20 0 DKADRN CCSc1cccc(CNc2cccc(-c3ncc(C)o3)c2)c1 ZINC000472038564 339360066 /nfs/dbraw/zinc/36/00/66/339360066.db2.gz OYOKQHQUVNOONP-UHFFFAOYSA-N 0 0 324.449 5.374 20 0 DKADRN CCSc1ccc(Cl)cc1NCc1ncc(Cl)s1 ZINC000472038623 339360095 /nfs/dbraw/zinc/36/00/95/339360095.db2.gz QSHULJUAFBHNLF-UHFFFAOYSA-N 0 0 319.282 5.174 20 0 DKADRN CCSc1cccc(CNc2ccccc2N2CCCC2)c1 ZINC000472039705 339360137 /nfs/dbraw/zinc/36/01/37/339360137.db2.gz YTFGUZJEXFLXNL-UHFFFAOYSA-N 0 0 312.482 5.011 20 0 DKADRN CC(C)c1nc2ccc(NCc3ncc(Cl)s3)cc2s1 ZINC000472040053 339360148 /nfs/dbraw/zinc/36/01/48/339360148.db2.gz YJVAMHOSRSDXII-UHFFFAOYSA-N 0 0 323.874 5.142 20 0 DKADRN CCSc1cccc(CNc2cccc(-c3ncco3)c2)c1 ZINC000472046247 339360593 /nfs/dbraw/zinc/36/05/93/339360593.db2.gz BDZSPCSNHRZVGE-UHFFFAOYSA-N 0 0 310.422 5.066 20 0 DKADRN Cc1ccc2[nH]c(CNc3cccc(-c4cnco4)c3)cc2c1C ZINC000472046510 339360588 /nfs/dbraw/zinc/36/05/88/339360588.db2.gz FHMBEKQIXHSGAT-UHFFFAOYSA-N 0 0 317.392 5.052 20 0 DKADRN CCSc1cccc(CNc2ccc(-c3cnco3)cc2)c1 ZINC000472048602 339360823 /nfs/dbraw/zinc/36/08/23/339360823.db2.gz RGSOTUBVDAHXCY-UHFFFAOYSA-N 0 0 310.422 5.066 20 0 DKADRN CCSc1cccc(C[NH2+][C@H](c2cccs2)C2CC2)c1 ZINC000472048791 339360773 /nfs/dbraw/zinc/36/07/73/339360773.db2.gz NFRUCZYZFPNNEK-KRWDZBQOSA-N 0 0 303.496 5.101 20 0 DKADRN CCSc1cccc(C[NH2+][C@@H](c2cccs2)C2CC2)c1 ZINC000472048792 339360869 /nfs/dbraw/zinc/36/08/69/339360869.db2.gz NFRUCZYZFPNNEK-QGZVFWFLSA-N 0 0 303.496 5.101 20 0 DKADRN Cc1ccc2[nH]c(C[NH2+]Cc3ccc(C(F)F)cc3)cc2c1C ZINC000472048858 339360840 /nfs/dbraw/zinc/36/08/40/339360840.db2.gz SMGOSEQBJMYJLW-UHFFFAOYSA-N 0 0 314.379 5.012 20 0 DKADRN Cc1ccc2[nH]c(CNc3ccc(-c4cnco4)cc3)cc2c1C ZINC000472049245 339360819 /nfs/dbraw/zinc/36/08/19/339360819.db2.gz VGZZEWDTBYENGQ-UHFFFAOYSA-N 0 0 317.392 5.052 20 0 DKADRN Cc1ccc2[nH]c(CNc3cccc(-c4ncco4)c3)cc2c1C ZINC000472049509 339360814 /nfs/dbraw/zinc/36/08/14/339360814.db2.gz WTJOXAVGXSVZDR-UHFFFAOYSA-N 0 0 317.392 5.052 20 0 DKADRN Cc1ccc2[nH]c(C[NH2+][C@@H]3CCSc4ccccc43)cc2c1C ZINC000472049696 339360852 /nfs/dbraw/zinc/36/08/52/339360852.db2.gz SOZMCTMNYOEGQT-GOSISDBHSA-N 0 0 322.477 5.111 20 0 DKADRN CCSc1cccc(CNc2cccc(-c3cnco3)c2)c1 ZINC000472049710 339360930 /nfs/dbraw/zinc/36/09/30/339360930.db2.gz XQHRVVKTWUUOEN-UHFFFAOYSA-N 0 0 310.422 5.066 20 0 DKADRN Cc1ccc2[nH]c(C[NH2+][C@H]3CCSc4ccccc43)cc2c1C ZINC000472049842 339360782 /nfs/dbraw/zinc/36/07/82/339360782.db2.gz SOZMCTMNYOEGQT-SFHVURJKSA-N 0 0 322.477 5.111 20 0 DKADRN Cc1ccc2[nH]c(C[NH2+][C@@H](c3ccccc3)C3CC3)cc2c1C ZINC000472050319 339360799 /nfs/dbraw/zinc/36/07/99/339360799.db2.gz XIYXFOHNYXRFDP-NRFANRHFSA-N 0 0 304.437 5.026 20 0 DKADRN Cc1ccc2[nH]c(C[NH2+][C@H](c3ccccc3)C3CC3)cc2c1C ZINC000472050320 339360888 /nfs/dbraw/zinc/36/08/88/339360888.db2.gz XIYXFOHNYXRFDP-OAQYLSRUSA-N 0 0 304.437 5.026 20 0 DKADRN CC(C)c1ccc2c(c1)[C@@H](NCc1ncc(Cl)s1)CCC2 ZINC000472055153 339361255 /nfs/dbraw/zinc/36/12/55/339361255.db2.gz VAQZATIWZWVLMN-HNNXBMFYSA-N 0 0 320.889 5.087 20 0 DKADRN CC(C)c1ccc2c(c1)[C@H](NCc1ncc(Cl)s1)CCC2 ZINC000472055154 339361351 /nfs/dbraw/zinc/36/13/51/339361351.db2.gz VAQZATIWZWVLMN-OAHLLOKOSA-N 0 0 320.889 5.087 20 0 DKADRN Cc1c(COC(C)(C)C)cccc1NCc1ncc(Cl)s1 ZINC000472062711 339361825 /nfs/dbraw/zinc/36/18/25/339361825.db2.gz KOSQWEVELASFSD-UHFFFAOYSA-N 0 0 324.877 5.032 20 0 DKADRN CC(C)c1ccc([C@@H](NCc2ncc(Cl)s2)C(C)C)cc1 ZINC000472066451 339361916 /nfs/dbraw/zinc/36/19/16/339361916.db2.gz UKJGPEWJYTZAHZ-KRWDZBQOSA-N 0 0 322.905 5.407 20 0 DKADRN CC(C)c1ccc([C@H](NCc2ncc(Cl)s2)C(C)C)cc1 ZINC000472066452 339361976 /nfs/dbraw/zinc/36/19/76/339361976.db2.gz UKJGPEWJYTZAHZ-QGZVFWFLSA-N 0 0 322.905 5.407 20 0 DKADRN Cc1ccc2[nH]c(CNc3cccc(C(F)F)c3)cc2c1C ZINC000472067133 339362071 /nfs/dbraw/zinc/36/20/71/339362071.db2.gz CQUPPNDBQNEJCA-UHFFFAOYSA-N 0 0 300.352 5.334 20 0 DKADRN Clc1cnc(CNc2cccc(-c3cccs3)c2)s1 ZINC000472071386 339362408 /nfs/dbraw/zinc/36/24/08/339362408.db2.gz CFAPFUGUSRMYIY-UHFFFAOYSA-N 0 0 306.843 5.137 20 0 DKADRN CCSc1cccc(CNc2ccc(C)c(-c3ncco3)c2)c1 ZINC000472073837 339362452 /nfs/dbraw/zinc/36/24/52/339362452.db2.gz LIVGNQTXBRPULQ-UHFFFAOYSA-N 0 0 324.449 5.374 20 0 DKADRN Clc1cnc(CN[C@@H](CC2CCCC2)c2ccccc2)s1 ZINC000472074738 339362632 /nfs/dbraw/zinc/36/26/32/339362632.db2.gz NGOPDMUGLKEDLV-HNNXBMFYSA-N 0 0 320.889 5.208 20 0 DKADRN Clc1cnc(CN[C@H](CC2CCCC2)c2ccccc2)s1 ZINC000472074739 339362630 /nfs/dbraw/zinc/36/26/30/339362630.db2.gz NGOPDMUGLKEDLV-OAHLLOKOSA-N 0 0 320.889 5.208 20 0 DKADRN CCSc1cccc(CNc2cccc(-c3nc(C)co3)c2)c1 ZINC000472074749 339362628 /nfs/dbraw/zinc/36/26/28/339362628.db2.gz OVWRMEPZXIRCCJ-UHFFFAOYSA-N 0 0 324.449 5.374 20 0 DKADRN CCC(C)(C)OCc1ccccc1NCc1ncc(Cl)s1 ZINC000472074777 339362595 /nfs/dbraw/zinc/36/25/95/339362595.db2.gz OZRLKWJLFKYLDN-UHFFFAOYSA-N 0 0 324.877 5.114 20 0 DKADRN CCSc1cccc(CN[C@H](C)c2csc(C(C)C)n2)c1 ZINC000472075417 339362705 /nfs/dbraw/zinc/36/27/05/339362705.db2.gz PDRMLHBLNGYPNM-CYBMUJFWSA-N 0 0 320.527 5.229 20 0 DKADRN CCSc1cccc(CN[C@@H](C)c2csc(C(C)C)n2)c1 ZINC000472075423 339362663 /nfs/dbraw/zinc/36/26/63/339362663.db2.gz PDRMLHBLNGYPNM-ZDUSSCGKSA-N 0 0 320.527 5.229 20 0 DKADRN CCSc1cccc(CNc2cccc([C@H](C)OC)c2)c1 ZINC000472076211 339362678 /nfs/dbraw/zinc/36/26/78/339362678.db2.gz UOPCOCOYKFKLQZ-AWEZNQCLSA-N 0 0 301.455 5.118 20 0 DKADRN CCSc1cccc(CNc2cccc([C@@H](C)OC)c2)c1 ZINC000472076212 339362606 /nfs/dbraw/zinc/36/26/06/339362606.db2.gz UOPCOCOYKFKLQZ-CQSZACIVSA-N 0 0 301.455 5.118 20 0 DKADRN CO[C@@H](C)c1cccc(NCc2cc3c(ccc(C)c3C)[nH]2)c1 ZINC000472076224 339362749 /nfs/dbraw/zinc/36/27/49/339362749.db2.gz UTIRSAXPUWDVHP-HNNXBMFYSA-N 0 0 308.425 5.104 20 0 DKADRN CO[C@H](C)c1cccc(NCc2cc3c(ccc(C)c3C)[nH]2)c1 ZINC000472076234 339362732 /nfs/dbraw/zinc/36/27/32/339362732.db2.gz UTIRSAXPUWDVHP-OAHLLOKOSA-N 0 0 308.425 5.104 20 0 DKADRN CCSc1cccc(CNc2ccc(-c3cnc(C)o3)cc2)c1 ZINC000472077753 339362847 /nfs/dbraw/zinc/36/28/47/339362847.db2.gz XSMPOMFISSWPDP-UHFFFAOYSA-N 0 0 324.449 5.374 20 0 DKADRN Cc1ccc2[nH]c(CNc3ccc(-c4ncco4)cc3)cc2c1C ZINC000472078623 339362873 /nfs/dbraw/zinc/36/28/73/339362873.db2.gz PHBCLXCZKSFHSY-UHFFFAOYSA-N 0 0 317.392 5.052 20 0 DKADRN CCSc1cccc(CNc2ccc(-c3ncco3)cc2)c1 ZINC000472079391 339363015 /nfs/dbraw/zinc/36/30/15/339363015.db2.gz UDEOGYWUQNCZID-UHFFFAOYSA-N 0 0 310.422 5.066 20 0 DKADRN COc1ccsc1[C@H](C)[NH2+][C@H](C)c1cc2ccccc2s1 ZINC000472133059 339363916 /nfs/dbraw/zinc/36/39/16/339363916.db2.gz SPVXRSXKFQBRBJ-NEPJUHHUSA-N 0 0 317.479 5.383 20 0 DKADRN COc1ccsc1[C@@H](C)[NH2+][C@@H](C)c1cc2ccccc2s1 ZINC000472133060 339363920 /nfs/dbraw/zinc/36/39/20/339363920.db2.gz SPVXRSXKFQBRBJ-NWDGAFQWSA-N 0 0 317.479 5.383 20 0 DKADRN COc1ccsc1[C@H](C)[NH2+][C@@H](C)c1cc2ccccc2s1 ZINC000472133061 339363962 /nfs/dbraw/zinc/36/39/62/339363962.db2.gz SPVXRSXKFQBRBJ-RYUDHWBXSA-N 0 0 317.479 5.383 20 0 DKADRN COc1ccsc1[C@@H](C)[NH2+][C@H](c1ccccc1C)C(C)C ZINC000472161439 339364936 /nfs/dbraw/zinc/36/49/36/339364936.db2.gz VWZMNNRZGGUSEN-PBHICJAKSA-N 0 0 303.471 5.113 20 0 DKADRN COc1ccsc1[C@@H](C)[NH2+][C@@H](c1ccccc1C)C(C)C ZINC000472161444 339364994 /nfs/dbraw/zinc/36/49/94/339364994.db2.gz VWZMNNRZGGUSEN-RHSMWYFYSA-N 0 0 303.471 5.113 20 0 DKADRN COc1ccsc1[C@H](C)[NH2+][C@@H](c1ccccc1C)C(C)C ZINC000472161445 339364911 /nfs/dbraw/zinc/36/49/11/339364911.db2.gz VWZMNNRZGGUSEN-WMLDXEAASA-N 0 0 303.471 5.113 20 0 DKADRN COc1ccsc1[C@H](C)[NH2+][C@H](c1ccccc1C)C(C)C ZINC000472161446 339364957 /nfs/dbraw/zinc/36/49/57/339364957.db2.gz VWZMNNRZGGUSEN-YOEHRIQHSA-N 0 0 303.471 5.113 20 0 DKADRN Cc1cccc(C(C)C)c1NC(=O)Nc1cccc2ccn(C)c21 ZINC000472182292 339365541 /nfs/dbraw/zinc/36/55/41/339365541.db2.gz UWOLIQGEDFBNES-UHFFFAOYSA-N 0 0 321.424 5.254 20 0 DKADRN Cn1ccc2cccc(NC(=O)Nc3ccccc3C(C)(C)C)c21 ZINC000472183872 339365487 /nfs/dbraw/zinc/36/54/87/339365487.db2.gz WHNCYNFBGNMLGJ-UHFFFAOYSA-N 0 0 321.424 5.120 20 0 DKADRN CSc1cccc(C)c1NC(=O)C/C=C\c1ccc(C)cc1 ZINC000472218376 339366155 /nfs/dbraw/zinc/36/61/55/339366155.db2.gz BLAZUAZXNYUIDP-ALCCZGGFSA-N 0 0 311.450 5.067 20 0 DKADRN CSc1cccc(C)c1NC(=O)C/C=C/c1ccc(C)cc1 ZINC000472218377 339366128 /nfs/dbraw/zinc/36/61/28/339366128.db2.gz BLAZUAZXNYUIDP-FNORWQNLSA-N 0 0 311.450 5.067 20 0 DKADRN CSc1cccc(C)c1NC(=O)C[C@H](C)c1ccccc1C ZINC000472218777 339366178 /nfs/dbraw/zinc/36/61/78/339366178.db2.gz DWZOAZWVLFSPJU-HNNXBMFYSA-N 0 0 313.466 5.158 20 0 DKADRN CSc1cccc(C)c1NC(=O)C[C@@H](C)c1ccccc1C ZINC000472218779 339366112 /nfs/dbraw/zinc/36/61/12/339366112.db2.gz DWZOAZWVLFSPJU-OAHLLOKOSA-N 0 0 313.466 5.158 20 0 DKADRN CSc1cccc(C)c1NC(=O)c1ccc(C)c(C)c1Cl ZINC000472221160 339366228 /nfs/dbraw/zinc/36/62/28/339366228.db2.gz IKBRZQNBAYDLBE-UHFFFAOYSA-N 0 0 319.857 5.239 20 0 DKADRN CSc1cccc(C)c1NC(=O)Cc1cccc2ccccc21 ZINC000472221705 339366289 /nfs/dbraw/zinc/36/62/89/339366289.db2.gz KAGNJTWJQLQJMB-UHFFFAOYSA-N 0 0 321.445 5.051 20 0 DKADRN CSc1cccc(C)c1NC(=O)CC/C=C\c1ccccc1 ZINC000472222267 339366415 /nfs/dbraw/zinc/36/64/15/339366415.db2.gz LHYBEVDMMILHAB-SDQBBNPISA-N 0 0 311.450 5.149 20 0 DKADRN CSc1cccc(C)c1NC(=O)CC/C=C/c1ccccc1 ZINC000472222276 339366413 /nfs/dbraw/zinc/36/64/13/339366413.db2.gz LHYBEVDMMILHAB-WUXMJOGZSA-N 0 0 311.450 5.149 20 0 DKADRN CSc1cccc(C)c1NC(=O)CC[C@H](C)c1ccccc1 ZINC000472222926 339366321 /nfs/dbraw/zinc/36/63/21/339366321.db2.gz RNJXDINOXBHCSX-AWEZNQCLSA-N 0 0 313.466 5.239 20 0 DKADRN CSc1cccc(C)c1NC(=O)CC[C@@H](C)c1ccccc1 ZINC000472222934 339366421 /nfs/dbraw/zinc/36/64/21/339366421.db2.gz RNJXDINOXBHCSX-CQSZACIVSA-N 0 0 313.466 5.239 20 0 DKADRN CSc1cccc(C)c1NC(=O)c1ccc(-c2ccccc2)o1 ZINC000472224577 339366409 /nfs/dbraw/zinc/36/64/09/339366409.db2.gz RKHHISILQHCBKM-UHFFFAOYSA-N 0 0 323.417 5.229 20 0 DKADRN CSc1cccc(C)c1NC(=O)c1ccc2ccccc2c1 ZINC000472226299 339366439 /nfs/dbraw/zinc/36/64/39/339366439.db2.gz WDQDIECLVGISAT-UHFFFAOYSA-N 0 0 307.418 5.122 20 0 DKADRN CSc1cccc(C)c1NC(=O)c1cccc2ccccc21 ZINC000472227877 339366468 /nfs/dbraw/zinc/36/64/68/339366468.db2.gz XRUPQTIKJXHCCS-UHFFFAOYSA-N 0 0 307.418 5.122 20 0 DKADRN CSc1cccc(C)c1NC(=O)Cc1ccc2ccccc2c1 ZINC000472234733 339366828 /nfs/dbraw/zinc/36/68/28/339366828.db2.gz SNLODCAZVYUBDV-UHFFFAOYSA-N 0 0 321.445 5.051 20 0 DKADRN CC[C@@H](CC(=O)Nc1c(C)cccc1SC)c1ccccc1 ZINC000472237215 339366979 /nfs/dbraw/zinc/36/69/79/339366979.db2.gz BIJKPAMPXCBMOK-HNNXBMFYSA-N 0 0 313.466 5.239 20 0 DKADRN CC[C@H](CC(=O)Nc1c(C)cccc1SC)c1ccccc1 ZINC000472237216 339366959 /nfs/dbraw/zinc/36/69/59/339366959.db2.gz BIJKPAMPXCBMOK-OAHLLOKOSA-N 0 0 313.466 5.239 20 0 DKADRN CSc1cccc(C)c1NC(=O)c1cc2cc(C)ccc2o1 ZINC000472239575 339367275 /nfs/dbraw/zinc/36/72/75/339367275.db2.gz HTDOCTKWJDXGKV-UHFFFAOYSA-N 0 0 311.406 5.024 20 0 DKADRN CSc1cccc(C)c1NC(=O)c1cc2ccccc2s1 ZINC000472239683 339367207 /nfs/dbraw/zinc/36/72/07/339367207.db2.gz INXYNHBYHLRJSS-UHFFFAOYSA-N 0 0 313.447 5.184 20 0 DKADRN CSc1cccc(C)c1NC(=O)[C@H](C)c1cccc(Cl)c1 ZINC000472240251 339367269 /nfs/dbraw/zinc/36/72/69/339367269.db2.gz MXIQIMWMNNOMST-GFCCVEGCSA-N 0 0 319.857 5.113 20 0 DKADRN CSc1cccc(C)c1NC(=O)[C@@H](C)c1cccc(Cl)c1 ZINC000472240252 339367257 /nfs/dbraw/zinc/36/72/57/339367257.db2.gz MXIQIMWMNNOMST-LBPRGKRZSA-N 0 0 319.857 5.113 20 0 DKADRN CSc1cccc(C)c1NC(=O)c1cccc2ccsc21 ZINC000472240990 339367271 /nfs/dbraw/zinc/36/72/71/339367271.db2.gz OGMORNYIKPORCV-UHFFFAOYSA-N 0 0 313.447 5.184 20 0 DKADRN CSc1cccc(C)c1NC(=O)c1csc2ccccc12 ZINC000472241157 339367220 /nfs/dbraw/zinc/36/72/20/339367220.db2.gz MCZJJHQGTHKYIE-UHFFFAOYSA-N 0 0 313.447 5.184 20 0 DKADRN CSc1cccc(C)c1NC(=O)c1cc2cccc(C)c2o1 ZINC000472243212 339367343 /nfs/dbraw/zinc/36/73/43/339367343.db2.gz WFEWDVCPZMIPLL-UHFFFAOYSA-N 0 0 311.406 5.024 20 0 DKADRN CCSc1ccc(C(=O)Nc2c(C)cccc2SC)cc1 ZINC000472245056 339367512 /nfs/dbraw/zinc/36/75/12/339367512.db2.gz BCXSBHOZPMCIIN-UHFFFAOYSA-N 0 0 317.479 5.081 20 0 DKADRN CSc1cccc(C)c1NC(=O)CCCc1sccc1C ZINC000472245812 339367504 /nfs/dbraw/zinc/36/75/04/339367504.db2.gz DDVOOEHRKIZVMG-UHFFFAOYSA-N 0 0 319.495 5.048 20 0 DKADRN CSc1cccc(C)c1NC(=O)c1ccc2sccc2c1 ZINC000472246127 339367447 /nfs/dbraw/zinc/36/74/47/339367447.db2.gz YYEDAPYENSQDOF-UHFFFAOYSA-N 0 0 313.447 5.184 20 0 DKADRN CSc1cccc(C)c1NC(=O)CC(C)(C)c1ccccc1 ZINC000472246701 339367499 /nfs/dbraw/zinc/36/74/99/339367499.db2.gz JPSBKDITOOWMLN-UHFFFAOYSA-N 0 0 313.466 5.023 20 0 DKADRN CCc1ccc([C@H](C)C(=O)Nc2c(C)cccc2SC)cc1 ZINC000472246918 339367534 /nfs/dbraw/zinc/36/75/34/339367534.db2.gz MVZOHHONAAAWOH-AWEZNQCLSA-N 0 0 313.466 5.022 20 0 DKADRN CCc1ccc([C@@H](C)C(=O)Nc2c(C)cccc2SC)cc1 ZINC000472246919 339367529 /nfs/dbraw/zinc/36/75/29/339367529.db2.gz MVZOHHONAAAWOH-CQSZACIVSA-N 0 0 313.466 5.022 20 0 DKADRN CCSc1cccc(C(=O)Nc2c(C)cccc2SC)c1 ZINC000472248122 339367614 /nfs/dbraw/zinc/36/76/14/339367614.db2.gz VFFVCXUOUYWCQO-UHFFFAOYSA-N 0 0 317.479 5.081 20 0 DKADRN CSc1cccc(C)c1NC(=O)c1ccc(C(C)C)s1 ZINC000472251224 339367718 /nfs/dbraw/zinc/36/77/18/339367718.db2.gz XIIQRMFNCADLCZ-UHFFFAOYSA-N 0 0 305.468 5.154 20 0 DKADRN CCCC1(C(=O)Nc2cccc(CSC(C)C)c2C)CC1 ZINC000472261384 339368109 /nfs/dbraw/zinc/36/81/09/339368109.db2.gz RZOWEZBUCRGPJJ-UHFFFAOYSA-N 0 0 305.487 5.155 20 0 DKADRN CCN(C(=O)c1csc2ccccc12)c1ccc2[nH]ccc2c1 ZINC000472274386 339368446 /nfs/dbraw/zinc/36/84/46/339368446.db2.gz DEURVCHTUKEEBE-UHFFFAOYSA-N 0 0 320.417 5.049 20 0 DKADRN CCN(C(=O)c1cccc2ccsc21)c1ccc2[nH]ccc2c1 ZINC000472277567 339368580 /nfs/dbraw/zinc/36/85/80/339368580.db2.gz LVJGCQGBFNRAKN-UHFFFAOYSA-N 0 0 320.417 5.049 20 0 DKADRN CCN(C(=O)CC/C=C\c1ccccc1)c1ccc2[nH]ccc2c1 ZINC000472278573 339368675 /nfs/dbraw/zinc/36/86/75/339368675.db2.gz RAMPABQIFOMINL-POHAHGRESA-N 0 0 318.420 5.014 20 0 DKADRN CCN(C(=O)CC/C=C/c1ccccc1)c1ccc2[nH]ccc2c1 ZINC000472278574 339368710 /nfs/dbraw/zinc/36/87/10/339368710.db2.gz RAMPABQIFOMINL-UXBLZVDNSA-N 0 0 318.420 5.014 20 0 DKADRN CCN(C(=O)c1cc2ccccc2s1)c1ccc2[nH]ccc2c1 ZINC000472279246 339368662 /nfs/dbraw/zinc/36/86/62/339368662.db2.gz UJCCKSJVIDINKT-UHFFFAOYSA-N 0 0 320.417 5.049 20 0 DKADRN CCN(C(=O)c1ccc2sccc2c1)c1ccc2[nH]ccc2c1 ZINC000472279469 339368635 /nfs/dbraw/zinc/36/86/35/339368635.db2.gz QOSCFJARCPUPQG-UHFFFAOYSA-N 0 0 320.417 5.049 20 0 DKADRN CCN(C(=O)c1ccc(C(C)C)s1)c1ccc2[nH]ccc2c1 ZINC000472291461 339369165 /nfs/dbraw/zinc/36/91/65/339369165.db2.gz AJRGWOABYYXGHK-UHFFFAOYSA-N 0 0 312.438 5.020 20 0 DKADRN CCC(CC)(CC)NC(=O)c1ccc(Cl)cc1C(F)(F)F ZINC000472317415 339369701 /nfs/dbraw/zinc/36/97/01/339369701.db2.gz GJTANLNNHKQQER-UHFFFAOYSA-N 0 0 321.770 5.057 20 0 DKADRN Cc1cccc(Cl)c1NC(=O)c1coc2cc(C)c(C)cc12 ZINC000472341799 339370257 /nfs/dbraw/zinc/37/02/57/339370257.db2.gz AIIIWPWTUPFEMG-UHFFFAOYSA-N 0 0 313.784 5.264 20 0 DKADRN CCCCOc1ccc(C(=O)Nc2cscc2C)c(Cl)c1 ZINC000472359864 339370982 /nfs/dbraw/zinc/37/09/82/339370982.db2.gz HSVPWVNQSPJPGK-UHFFFAOYSA-N 0 0 323.845 5.141 20 0 DKADRN CCN(Cc1ccncc1Cl)[C@H](C)c1cc2ccccc2o1 ZINC000472438156 339371769 /nfs/dbraw/zinc/37/17/69/339371769.db2.gz OSMYXNNVMMSQQS-CYBMUJFWSA-N 0 0 314.816 5.064 20 0 DKADRN CCN(Cc1ccncc1Cl)[C@@H](C)c1cc2ccccc2o1 ZINC000472438157 339371808 /nfs/dbraw/zinc/37/18/08/339371808.db2.gz OSMYXNNVMMSQQS-ZDUSSCGKSA-N 0 0 314.816 5.064 20 0 DKADRN Cc1cc(C(=O)Nc2ccccc2SC(C)C)c(F)cc1F ZINC000472526933 339373340 /nfs/dbraw/zinc/37/33/40/339373340.db2.gz GCBQNRCUPLTGEJ-UHFFFAOYSA-N 0 0 321.392 5.026 20 0 DKADRN CC(C)Sc1ccccc1NC(=O)[C@H](C)c1ccccc1F ZINC000472527236 339373276 /nfs/dbraw/zinc/37/32/76/339373276.db2.gz HGMJJEQQYYSZLZ-CYBMUJFWSA-N 0 0 317.429 5.068 20 0 DKADRN CC(C)Sc1ccccc1NC(=O)[C@@H](C)c1ccccc1F ZINC000472527237 339373338 /nfs/dbraw/zinc/37/33/38/339373338.db2.gz HGMJJEQQYYSZLZ-ZDUSSCGKSA-N 0 0 317.429 5.068 20 0 DKADRN CC(C)Sc1ccccc1NC(=O)[C@H](C)c1cccc(F)c1 ZINC000472528584 339373335 /nfs/dbraw/zinc/37/33/35/339373335.db2.gz MCLRQQZYZVQRIG-CYBMUJFWSA-N 0 0 317.429 5.068 20 0 DKADRN CC(C)Sc1ccccc1NC(=O)[C@@H](C)c1cccc(F)c1 ZINC000472528587 339373261 /nfs/dbraw/zinc/37/32/61/339373261.db2.gz MCLRQQZYZVQRIG-ZDUSSCGKSA-N 0 0 317.429 5.068 20 0 DKADRN CC(C)Sc1ccccc1NC(=O)c1ccc(C(F)F)cc1 ZINC000472550373 339373701 /nfs/dbraw/zinc/37/37/01/339373701.db2.gz KNIPCQFVUFGAJF-UHFFFAOYSA-N 0 0 321.392 5.377 20 0 DKADRN CC(C)Sc1ccccc1NC(=O)c1coc2ccccc21 ZINC000472557536 339373779 /nfs/dbraw/zinc/37/37/79/339373779.db2.gz BPSLUUFYMYZQTQ-UHFFFAOYSA-N 0 0 311.406 5.186 20 0 DKADRN CC(C)Sc1ccccc1NC(=O)c1cccc(C(F)F)c1 ZINC000472558303 339373773 /nfs/dbraw/zinc/37/37/73/339373773.db2.gz HGCVZHBJRACXHE-UHFFFAOYSA-N 0 0 321.392 5.377 20 0 DKADRN CC(C)Sc1ccccc1NC(=O)CCCc1cccs1 ZINC000472565223 339374010 /nfs/dbraw/zinc/37/40/10/339374010.db2.gz SIVIBTYRFLUKTI-UHFFFAOYSA-N 0 0 319.495 5.210 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)c1ccc(CC)cc1 ZINC000472665387 339376011 /nfs/dbraw/zinc/37/60/11/339376011.db2.gz CJCJRRMSCWRQAQ-UHFFFAOYSA-N 0 0 309.453 5.577 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)c1cccc(C)c1F ZINC000472668435 339375984 /nfs/dbraw/zinc/37/59/84/339375984.db2.gz MRCCYFCRGIXTDK-UHFFFAOYSA-N 0 0 313.416 5.462 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)Cc1cc(C)ccc1C ZINC000472668992 339375989 /nfs/dbraw/zinc/37/59/89/339375989.db2.gz JWJJJRZZKSKTKG-UHFFFAOYSA-N 0 0 323.480 5.561 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)[C@@H](C)c1cccc(C)c1 ZINC000472669664 339376050 /nfs/dbraw/zinc/37/60/50/339376050.db2.gz JQGWSQTXEJPAJT-KRWDZBQOSA-N 0 0 323.480 5.813 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)[C@H](C)c1cccc(C)c1 ZINC000472669665 339376045 /nfs/dbraw/zinc/37/60/45/339376045.db2.gz JQGWSQTXEJPAJT-QGZVFWFLSA-N 0 0 323.480 5.813 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)c1ccc2c(c1)COC2 ZINC000472670086 339375997 /nfs/dbraw/zinc/37/59/97/339375997.db2.gz QAOLCVGCWMBDCM-UHFFFAOYSA-N 0 0 323.436 5.045 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)[C@H](C)c1ccccc1 ZINC000472670239 339376080 /nfs/dbraw/zinc/37/60/80/339376080.db2.gz KQQIMZDHCHGACT-MRXNPFEDSA-N 0 0 309.453 5.505 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)C[C@H](C)c1cccnc1 ZINC000472670248 339376057 /nfs/dbraw/zinc/37/60/57/339376057.db2.gz MQTGNMJXRYWUQN-INIZCTEOSA-N 0 0 324.468 5.290 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)C[C@@H](C)c1cccnc1 ZINC000472670267 339376058 /nfs/dbraw/zinc/37/60/58/339376058.db2.gz MQTGNMJXRYWUQN-MRXNPFEDSA-N 0 0 324.468 5.290 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)CCc1ccc(C)o1 ZINC000472670780 339376065 /nfs/dbraw/zinc/37/60/65/339376065.db2.gz SKKQFDYWDNIVDM-UHFFFAOYSA-N 0 0 313.441 5.235 20 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CCCc1cccc(C(C)C)c1NC(=O)[C@@H]1C[C@@]1(C)C(C)C ZINC000472671719 339376139 /nfs/dbraw/zinc/37/61/39/339376139.db2.gz JDUAOWHTUGNXDL-PXNSSMCTSA-N 0 0 301.474 5.383 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)[C@H]1C[C@@]1(C)C(C)C ZINC000472671721 339376113 /nfs/dbraw/zinc/37/61/13/339376113.db2.gz JDUAOWHTUGNXDL-XLIONFOSSA-N 0 0 301.474 5.383 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)[C@H]1C[C@]1(C)C(C)C ZINC000472671722 339376051 /nfs/dbraw/zinc/37/60/51/339376051.db2.gz JDUAOWHTUGNXDL-YLJYHZDGSA-N 0 0 301.474 5.383 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)[C@H]1CC12CCCCC2 ZINC000472671752 339376172 /nfs/dbraw/zinc/37/61/72/339376172.db2.gz VSEGIMQEDDRGCX-GOSISDBHSA-N 0 0 313.485 5.671 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)[C@@H](C)c1ccsc1 ZINC000472671784 339376157 /nfs/dbraw/zinc/37/61/57/339376157.db2.gz QPNIHYUMHDWVNF-AWEZNQCLSA-N 0 0 315.482 5.566 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)[C@H](C)c1ccsc1 ZINC000472671785 339376076 /nfs/dbraw/zinc/37/60/76/339376076.db2.gz QPNIHYUMHDWVNF-CQSZACIVSA-N 0 0 315.482 5.566 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)[C@@H]1CC12CCCCC2 ZINC000472671921 339376161 /nfs/dbraw/zinc/37/61/61/339376161.db2.gz VSEGIMQEDDRGCX-SFHVURJKSA-N 0 0 313.485 5.671 20 0 DKADRN CC(C)Sc1ccccc1NC(=O)c1cc2ccccc2o1 ZINC000472672511 339376155 /nfs/dbraw/zinc/37/61/55/339376155.db2.gz ZSBUTXZXLCDELE-UHFFFAOYSA-N 0 0 311.406 5.186 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)c1ccc(C)c(C)c1 ZINC000472672558 339376102 /nfs/dbraw/zinc/37/61/02/339376102.db2.gz RCJANEJFKSJBHD-UHFFFAOYSA-N 0 0 309.453 5.632 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)CCCC(F)(F)F ZINC000472674078 339376160 /nfs/dbraw/zinc/37/61/60/339376160.db2.gz MWLSXSHTEZCNEQ-UHFFFAOYSA-N 0 0 315.379 5.434 20 0 DKADRN CC(C)Sc1ccccc1NC(=O)c1cccc(F)c1Cl ZINC000472675722 339376103 /nfs/dbraw/zinc/37/61/03/339376103.db2.gz GOMSUTVGOXFRJZ-UHFFFAOYSA-N 0 0 323.820 5.232 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)c1ccc(C)c(F)c1 ZINC000472677014 339376109 /nfs/dbraw/zinc/37/61/09/339376109.db2.gz KHYPGLLUQQSOES-UHFFFAOYSA-N 0 0 313.416 5.462 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)c1ccc(C(C)C)nc1 ZINC000472677415 339376099 /nfs/dbraw/zinc/37/60/99/339376099.db2.gz ZVSUKHDYURSMOG-UHFFFAOYSA-N 0 0 324.468 5.533 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)[C@@H](C)c1ccccc1 ZINC000472677900 339376098 /nfs/dbraw/zinc/37/60/98/339376098.db2.gz KQQIMZDHCHGACT-INIZCTEOSA-N 0 0 309.453 5.505 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)c1ccnc(C2CC2)c1 ZINC000472678267 339376145 /nfs/dbraw/zinc/37/61/45/339376145.db2.gz MMVHMUMQAKJWQK-UHFFFAOYSA-N 0 0 322.452 5.287 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)C1CCCCCC1 ZINC000472678946 339376126 /nfs/dbraw/zinc/37/61/26/339376126.db2.gz OPKNFORKSWGWMO-UHFFFAOYSA-N 0 0 301.474 5.671 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)c1cccc(C)c1C ZINC000472679433 339376114 /nfs/dbraw/zinc/37/61/14/339376114.db2.gz REYVMDCFEVUWBU-UHFFFAOYSA-N 0 0 309.453 5.632 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)c1ccc(N(C)C)cc1 ZINC000472679624 339376169 /nfs/dbraw/zinc/37/61/69/339376169.db2.gz VKWWKQANJVOLPU-UHFFFAOYSA-N 0 0 324.468 5.081 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)c1ccc(C)cc1C ZINC000472679661 339376117 /nfs/dbraw/zinc/37/61/17/339376117.db2.gz SNMCIWGMWFZXCK-UHFFFAOYSA-N 0 0 309.453 5.632 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)[C@@H]1CCC[C@H](C)C1 ZINC000472680252 339376147 /nfs/dbraw/zinc/37/61/47/339376147.db2.gz YJBULMZIFQJPCD-DOTOQJQBSA-N 0 0 301.474 5.527 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)[C@@H]1CCC[C@@H](C)C1 ZINC000472680254 339376152 /nfs/dbraw/zinc/37/61/52/339376152.db2.gz YJBULMZIFQJPCD-NVXWUHKLSA-N 0 0 301.474 5.527 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)[C@H]1CCC[C@H](C)C1 ZINC000472680255 339376108 /nfs/dbraw/zinc/37/61/08/339376108.db2.gz YJBULMZIFQJPCD-RDJZCZTQSA-N 0 0 301.474 5.527 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)[C@H]1CCC[C@@H](C)C1 ZINC000472680256 339376131 /nfs/dbraw/zinc/37/61/31/339376131.db2.gz YJBULMZIFQJPCD-WBVHZDCISA-N 0 0 301.474 5.527 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)c1ccc(Cl)cc1 ZINC000472680391 339376148 /nfs/dbraw/zinc/37/61/48/339376148.db2.gz VXEPUYUMLPVGOP-UHFFFAOYSA-N 0 0 315.844 5.668 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)c1csc(Cl)c1 ZINC000472681258 339376179 /nfs/dbraw/zinc/37/61/79/339376179.db2.gz BVLJDPXGTMBUPC-UHFFFAOYSA-N 0 0 321.873 5.730 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)c1cc(C)c(C)s1 ZINC000472681293 339376186 /nfs/dbraw/zinc/37/61/86/339376186.db2.gz CFJZYLNDMCCTHM-UHFFFAOYSA-N 0 0 315.482 5.693 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)c1ccc2c(c1)CCC2 ZINC000472681713 339376276 /nfs/dbraw/zinc/37/62/76/339376276.db2.gz FTBFPXNKMRVBHB-UHFFFAOYSA-N 0 0 321.464 5.504 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)c1ccc(Cl)s1 ZINC000472681899 339376216 /nfs/dbraw/zinc/37/62/16/339376216.db2.gz APLGNLPUVSYUOP-UHFFFAOYSA-N 0 0 321.873 5.730 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)CCCc1ccccc1 ZINC000472682096 339376308 /nfs/dbraw/zinc/37/63/08/339376308.db2.gz HKHIYWILHJZAAE-UHFFFAOYSA-N 0 0 323.480 5.724 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)CCc1ccccc1 ZINC000472682214 339376247 /nfs/dbraw/zinc/37/62/47/339376247.db2.gz CCGTXJZJKRTDPN-UHFFFAOYSA-N 0 0 309.453 5.334 20 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CCCc1cccc(C(C)C)c1NC(=O)[C@@H]1CCCC1(C)C ZINC000472684267 339376238 /nfs/dbraw/zinc/37/62/38/339376238.db2.gz PERNTSDOOWRYCG-KRWDZBQOSA-N 0 0 301.474 5.527 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)[C@H]1CCCC1(C)C ZINC000472684270 339376275 /nfs/dbraw/zinc/37/62/75/339376275.db2.gz PERNTSDOOWRYCG-QGZVFWFLSA-N 0 0 301.474 5.527 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)c1cccc(Cl)c1 ZINC000472684444 339376255 /nfs/dbraw/zinc/37/62/55/339376255.db2.gz PHGBXNZLQSRFTR-UHFFFAOYSA-N 0 0 315.844 5.668 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)c1cc(C)cc(C)c1 ZINC000472685581 339376286 /nfs/dbraw/zinc/37/62/86/339376286.db2.gz LVIMOPFEQDWRGT-UHFFFAOYSA-N 0 0 309.453 5.632 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)CCc1ccccc1C ZINC000472685933 339376283 /nfs/dbraw/zinc/37/62/83/339376283.db2.gz KTKQBCZDERAVMR-UHFFFAOYSA-N 0 0 323.480 5.642 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)c1cc(C)cc(F)c1 ZINC000472689735 339376231 /nfs/dbraw/zinc/37/62/31/339376231.db2.gz IPBGQHINVNHBOT-UHFFFAOYSA-N 0 0 313.416 5.462 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)C[C@@H](OCC)C(C)C ZINC000472690051 339376298 /nfs/dbraw/zinc/37/62/98/339376298.db2.gz ITBCMWNYSCCWQB-GOSISDBHSA-N 0 0 319.489 5.152 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)C[C@H](OCC)C(C)C ZINC000472690054 339376303 /nfs/dbraw/zinc/37/63/03/339376303.db2.gz ITBCMWNYSCCWQB-SFHVURJKSA-N 0 0 319.489 5.152 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)CSCCC(C)C ZINC000472690334 339376226 /nfs/dbraw/zinc/37/62/26/339376226.db2.gz VSBMRGGQHUNXIW-UHFFFAOYSA-N 0 0 321.530 5.480 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)[C@H]1CCC(C)(C)C1 ZINC000472691101 339376274 /nfs/dbraw/zinc/37/62/74/339376274.db2.gz NIFUTTNGCSWSQT-INIZCTEOSA-N 0 0 301.474 5.527 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)[C@@H]1CCC(C)(C)C1 ZINC000472691102 339376285 /nfs/dbraw/zinc/37/62/85/339376285.db2.gz NIFUTTNGCSWSQT-MRXNPFEDSA-N 0 0 301.474 5.527 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)Cc1cccc(CC)c1 ZINC000472692230 339376305 /nfs/dbraw/zinc/37/63/05/339376305.db2.gz SGIDKDHNDFIJAM-UHFFFAOYSA-N 0 0 323.480 5.506 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)[C@H]1Cc2ccccc21 ZINC000472692861 339376249 /nfs/dbraw/zinc/37/62/49/339376249.db2.gz VNGWJEUENYZNSF-IBGZPJMESA-N 0 0 307.437 5.041 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)[C@@H]1Cc2ccccc21 ZINC000472692863 339376251 /nfs/dbraw/zinc/37/62/51/339376251.db2.gz VNGWJEUENYZNSF-LJQANCHMSA-N 0 0 307.437 5.041 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)Cc1c(C)cccc1C ZINC000472693572 339376236 /nfs/dbraw/zinc/37/62/36/339376236.db2.gz QNDDWPWCDDWMQG-UHFFFAOYSA-N 0 0 323.480 5.561 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)c1ccc(C)cc1F ZINC000472693705 339376253 /nfs/dbraw/zinc/37/62/53/339376253.db2.gz YGPJYGAYYFGMOF-UHFFFAOYSA-N 0 0 313.416 5.462 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)C[C@H](C)c1ccccc1 ZINC000472694799 339376391 /nfs/dbraw/zinc/37/63/91/339376391.db2.gz WKRXHWYMFJCQMD-KRWDZBQOSA-N 0 0 323.480 5.895 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)C[C@@H](C)c1ccccc1 ZINC000472694801 339376346 /nfs/dbraw/zinc/37/63/46/339376346.db2.gz WKRXHWYMFJCQMD-QGZVFWFLSA-N 0 0 323.480 5.895 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)c1cc(C)c(CC)o1 ZINC000472695233 339376407 /nfs/dbraw/zinc/37/64/07/339376407.db2.gz XZYTYLWLKIJXPC-UHFFFAOYSA-N 0 0 313.441 5.479 20 0 DKADRN CC(C)CC[C@@H]1CCCCN1C(=O)c1ccc(C(F)F)cc1 ZINC000472696808 339376335 /nfs/dbraw/zinc/37/63/35/339376335.db2.gz FNWDFBCUMDJISM-INIZCTEOSA-N 0 0 309.400 5.055 20 0 DKADRN CC(C)CC[C@H]1CCCCN1C(=O)c1ccc(C(F)F)cc1 ZINC000472696817 339376340 /nfs/dbraw/zinc/37/63/40/339376340.db2.gz FNWDFBCUMDJISM-MRXNPFEDSA-N 0 0 309.400 5.055 20 0 DKADRN CC(C)CC[C@@H]1CCCCN1C(=O)c1cccc(C(F)F)c1 ZINC000472703300 339376496 /nfs/dbraw/zinc/37/64/96/339376496.db2.gz XJNMCTBHLHBEEH-INIZCTEOSA-N 0 0 309.400 5.055 20 0 DKADRN CC(C)CC[C@H]1CCCCN1C(=O)c1cccc(C(F)F)c1 ZINC000472703301 339376425 /nfs/dbraw/zinc/37/64/25/339376425.db2.gz XJNMCTBHLHBEEH-MRXNPFEDSA-N 0 0 309.400 5.055 20 0 DKADRN CCCc1ccccc1NC(=O)N(C)Cc1cc2ccccc2o1 ZINC000472752011 339376967 /nfs/dbraw/zinc/37/69/67/339376967.db2.gz QFDRUENWDNMDDV-UHFFFAOYSA-N 0 0 322.408 5.049 20 0 DKADRN CC[C@H]1CN(C(=O)Nc2ccccc2C)CC[C@@H]1c1ccccc1 ZINC000472761695 339377010 /nfs/dbraw/zinc/37/70/10/339377010.db2.gz GXFXXZXABXOJOS-HKUYNNGSSA-N 0 0 322.452 5.043 20 0 DKADRN CC[C@@H]1CN(C(=O)Nc2ccccc2C)CC[C@H]1c1ccccc1 ZINC000472761696 339376970 /nfs/dbraw/zinc/37/69/70/339376970.db2.gz GXFXXZXABXOJOS-IEBWSBKVSA-N 0 0 322.452 5.043 20 0 DKADRN CC[C@@H]1CN(C(=O)Nc2ccccc2C)CC[C@@H]1c1ccccc1 ZINC000472761697 339377075 /nfs/dbraw/zinc/37/70/75/339377075.db2.gz GXFXXZXABXOJOS-MJGOQNOKSA-N 0 0 322.452 5.043 20 0 DKADRN CC[C@H]1CN(C(=O)Nc2ccccc2C)CC[C@H]1c1ccccc1 ZINC000472761698 339377084 /nfs/dbraw/zinc/37/70/84/339377084.db2.gz GXFXXZXABXOJOS-PKOBYXMFSA-N 0 0 322.452 5.043 20 0 DKADRN CC(C)c1cccc(C(C)C)c1NC(=O)N1C[C@@H](C)CC1(C)C ZINC000472775319 339377352 /nfs/dbraw/zinc/37/73/52/339377352.db2.gz ZBMXUSXULRHDRA-HNNXBMFYSA-N 0 0 316.489 5.586 20 0 DKADRN CC(C)c1cccc(C(C)C)c1NC(=O)N1C[C@H](C)CC1(C)C ZINC000472775334 339377330 /nfs/dbraw/zinc/37/73/30/339377330.db2.gz 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OIMSBTWLGODLQL-LLVKDONJSA-N 0 0 320.845 5.126 20 0 DKADRN CCN(Cc1ncc(Cl)s1)[C@@H](C)c1cc2ccccc2o1 ZINC000473144627 339382560 /nfs/dbraw/zinc/38/25/60/339382560.db2.gz OIMSBTWLGODLQL-NSHDSACASA-N 0 0 320.845 5.126 20 0 DKADRN CC[C@@H](C)Sc1ccc(NC(=O)c2coc(C)c2)c(C)c1 ZINC000473187610 339383669 /nfs/dbraw/zinc/38/36/69/339383669.db2.gz XSZKZPXDTWWJEL-CYBMUJFWSA-N 0 0 303.427 5.039 20 0 DKADRN CC[C@H](C)Sc1ccc(NC(=O)c2coc(C)c2)c(C)c1 ZINC000473187625 339383646 /nfs/dbraw/zinc/38/36/46/339383646.db2.gz XSZKZPXDTWWJEL-ZDUSSCGKSA-N 0 0 303.427 5.039 20 0 DKADRN Cc1cccc(C(C)C)c1NC(=O)N[C@H](C)[C@H](C)c1ccccc1 ZINC000473430025 339385277 /nfs/dbraw/zinc/38/52/77/339385277.db2.gz AOHRTAGKDUXLOG-DLBZAZTESA-N 0 0 324.468 5.432 20 0 DKADRN Cc1cccc(C(C)C)c1NC(=O)N[C@H](C)[C@@H](C)c1ccccc1 ZINC000473430027 339385314 /nfs/dbraw/zinc/38/53/14/339385314.db2.gz AOHRTAGKDUXLOG-IAGOWNOFSA-N 0 0 324.468 5.432 20 0 DKADRN Cc1cccc(C(C)C)c1NC(=O)N[C@@H](C)[C@H](C)c1ccccc1 ZINC000473430029 339385252 /nfs/dbraw/zinc/38/52/52/339385252.db2.gz AOHRTAGKDUXLOG-IRXDYDNUSA-N 0 0 324.468 5.432 20 0 DKADRN Cc1cccc(C(C)C)c1NC(=O)N[C@@H](C)[C@@H](C)c1ccccc1 ZINC000473430031 339385311 /nfs/dbraw/zinc/38/53/11/339385311.db2.gz AOHRTAGKDUXLOG-SJORKVTESA-N 0 0 324.468 5.432 20 0 DKADRN Cc1oncc1-c1csc(-c2ccc(Cl)c(Cl)c2)n1 ZINC000473446756 339385534 /nfs/dbraw/zinc/38/55/34/339385534.db2.gz DSDPGUYRXCCEIU-UHFFFAOYSA-N 0 0 311.193 5.080 20 0 DKADRN CCO[C@H](C)c1nc(-c2ccccc2C(F)(F)F)c(C)s1 ZINC000473447242 339385436 /nfs/dbraw/zinc/38/54/36/339385436.db2.gz HLLNCFADADMWQM-SECBINFHSA-N 0 0 315.360 5.235 20 0 DKADRN CCO[C@@H](C)c1nc(-c2ccccc2C(F)(F)F)c(C)s1 ZINC000473447243 339385503 /nfs/dbraw/zinc/38/55/03/339385503.db2.gz HLLNCFADADMWQM-VIFPVBQESA-N 0 0 315.360 5.235 20 0 DKADRN Cc1sc(-c2ccncc2)nc1-c1ccccc1C(F)(F)F ZINC000473453816 339385746 /nfs/dbraw/zinc/38/57/46/339385746.db2.gz JMOOSEVUANPMTL-UHFFFAOYSA-N 0 0 320.339 5.199 20 0 DKADRN CC(C)c1ccc(NC(=O)N2CCCC3(CC3)C2)c(C(C)C)c1 ZINC000473594801 339388636 /nfs/dbraw/zinc/38/86/36/339388636.db2.gz TXPRHLGDKLWCTA-UHFFFAOYSA-N 0 0 314.473 5.341 20 0 DKADRN CC(C)(C)OCCCCNc1ccccc1CCC(F)(F)F ZINC000473659166 339389602 /nfs/dbraw/zinc/38/96/02/339389602.db2.gz JYJURSAFCVOOMI-UHFFFAOYSA-N 0 0 317.395 5.189 20 0 DKADRN Cc1csc(-c2cccc(NCCCCOC(C)(C)C)c2)n1 ZINC000473660971 339389749 /nfs/dbraw/zinc/38/97/49/339389749.db2.gz ASGFIGZCPWNURD-UHFFFAOYSA-N 0 0 318.486 5.126 20 0 DKADRN CC(C)(C)OCCCCNc1ccccc1N1CCCCCC1 ZINC000473669881 339389975 /nfs/dbraw/zinc/38/99/75/339389975.db2.gz HEJCSHXSUGCJJO-UHFFFAOYSA-N 0 0 318.505 5.074 20 0 DKADRN CC(=O)c1ccc2cc(OCCCCOC(C)(C)C)ccc2c1 ZINC000473670010 339389994 /nfs/dbraw/zinc/38/99/94/339389994.db2.gz ICNDFORZPOYUNA-UHFFFAOYSA-N 0 0 314.425 5.017 20 0 DKADRN Cc1c(COC(C)(C)C)cccc1NCCCCOC(C)(C)C ZINC000473670537 339389907 /nfs/dbraw/zinc/38/99/07/339389907.db2.gz LWCPVROQJRUPDB-UHFFFAOYSA-N 0 0 321.505 5.317 20 0 DKADRN CC(C)(C)OCCCCNc1cccc(C(F)F)c1Cl ZINC000473670733 339389996 /nfs/dbraw/zinc/38/99/96/339389996.db2.gz NJNWHHIPNYTEMZ-UHFFFAOYSA-N 0 0 305.796 5.285 20 0 DKADRN CC(C)(C)OCCCCNc1ccc(CCC(F)(F)F)cc1 ZINC000473679387 339390179 /nfs/dbraw/zinc/39/01/79/339390179.db2.gz TVAPAYQSQVNGIA-UHFFFAOYSA-N 0 0 317.395 5.189 20 0 DKADRN Cc1cccc(C)c1NC(=O)N1CCCC[C@H]1CCC(C)C ZINC000473684150 339390308 /nfs/dbraw/zinc/39/03/08/339390308.db2.gz WWIYSODCIBWJSQ-KRWDZBQOSA-N 0 0 302.462 5.126 20 0 DKADRN Cc1cccc(C)c1NC(=O)N1CCCC[C@@H]1CCC(C)C ZINC000473684151 339390331 /nfs/dbraw/zinc/39/03/31/339390331.db2.gz WWIYSODCIBWJSQ-QGZVFWFLSA-N 0 0 302.462 5.126 20 0 DKADRN CC(C)N(C)C(=O)Nc1ccc(Oc2ccccc2Cl)cc1 ZINC000473754753 339391350 /nfs/dbraw/zinc/39/13/50/339391350.db2.gz OGYUNGZCAUZVKD-UHFFFAOYSA-N 0 0 318.804 5.004 20 0 DKADRN Cc1cccc(NC(=O)N2CCc3c(cccc3C(C)C)C2)c1C ZINC000473762149 339391470 /nfs/dbraw/zinc/39/14/70/339391470.db2.gz LEHVTELANCLZJU-UHFFFAOYSA-N 0 0 322.452 5.017 20 0 DKADRN CC(C)N(C)C(=O)Nc1ccccc1Oc1ccccc1Cl ZINC000473762424 339391461 /nfs/dbraw/zinc/39/14/61/339391461.db2.gz PRIYOHGFOXATCS-UHFFFAOYSA-N 0 0 318.804 5.004 20 0 DKADRN Cc1ccc(NC(=O)N2CCc3c(cccc3C(C)C)C2)c(C)c1 ZINC000473763503 339391484 /nfs/dbraw/zinc/39/14/84/339391484.db2.gz NYSFFKNTJGQVKN-UHFFFAOYSA-N 0 0 322.452 5.017 20 0 DKADRN Cc1cc(NC(=O)N2CCCC3(CC3)C2)ccc1-c1ccccc1 ZINC000473778605 339391875 /nfs/dbraw/zinc/39/18/75/339391875.db2.gz MBAYDDFTOACMAG-UHFFFAOYSA-N 0 0 320.436 5.070 20 0 DKADRN CC(C)(C)OCCCCSCc1cccc2cccnc21 ZINC000473780278 339391821 /nfs/dbraw/zinc/39/18/21/339391821.db2.gz AQYKLVHOHJVVDY-UHFFFAOYSA-N 0 0 303.471 5.063 20 0 DKADRN CC(C)(C)OCCCCSCc1nc(C(C)(C)C)cs1 ZINC000473780701 339391811 /nfs/dbraw/zinc/39/18/11/339391811.db2.gz VYLITYDZRUJORH-UHFFFAOYSA-N 0 0 315.548 5.269 20 0 DKADRN CC(C)(C)OCCCCSCc1coc(-c2ccccc2)n1 ZINC000473782729 339391967 /nfs/dbraw/zinc/39/19/67/339391967.db2.gz IFAUDYYXZOLUBR-UHFFFAOYSA-N 0 0 319.470 5.170 20 0 DKADRN C[C@@H](SCCCCOC(C)(C)C)c1nc2ccccc2o1 ZINC000473782835 339391941 /nfs/dbraw/zinc/39/19/41/339391941.db2.gz GBISBNSGNATCAK-CYBMUJFWSA-N 0 0 307.459 5.217 20 0 DKADRN C[C@H](SCCCCOC(C)(C)C)c1nc2ccccc2o1 ZINC000473782836 339391917 /nfs/dbraw/zinc/39/19/17/339391917.db2.gz GBISBNSGNATCAK-ZDUSSCGKSA-N 0 0 307.459 5.217 20 0 DKADRN CC(C)(C)OCCCCSCc1cc(-c2ccccc2)on1 ZINC000473783012 339391971 /nfs/dbraw/zinc/39/19/71/339391971.db2.gz QZCBPRSJZCSYSR-UHFFFAOYSA-N 0 0 319.470 5.170 20 0 DKADRN CC(C)(C)OCCCCSCc1ncc(Cl)cc1Cl ZINC000473783843 339391983 /nfs/dbraw/zinc/39/19/83/339391983.db2.gz IPCBBBNITREIQY-UHFFFAOYSA-N 0 0 322.301 5.217 20 0 DKADRN CC(C)c1nc(CSCCCCOC(C)(C)C)cs1 ZINC000473784759 339391943 /nfs/dbraw/zinc/39/19/43/339391943.db2.gz OOISBPHPEIVJHN-UHFFFAOYSA-N 0 0 301.521 5.095 20 0 DKADRN CC(C)N(C)C(=O)Nc1ccc(Oc2cccc(Cl)c2)cc1 ZINC000473785177 339391899 /nfs/dbraw/zinc/39/18/99/339391899.db2.gz AOMAGLIYNGKJLS-UHFFFAOYSA-N 0 0 318.804 5.004 20 0 DKADRN CC(C)(C)OCCCCSCc1ccc2ccccc2n1 ZINC000473786249 339392112 /nfs/dbraw/zinc/39/21/12/339392112.db2.gz OPITULIRNRFFKH-UHFFFAOYSA-N 0 0 303.471 5.063 20 0 DKADRN Cc1cc(SC2CCCCC2)ccc1NC(=O)N(C)C(C)C ZINC000473786343 339392077 /nfs/dbraw/zinc/39/20/77/339392077.db2.gz DXQDLDBCAIVGBD-UHFFFAOYSA-N 0 0 320.502 5.292 20 0 DKADRN CC(C)(C)OCCCCSCc1cc(-c2ccccc2)no1 ZINC000473786423 339392086 /nfs/dbraw/zinc/39/20/86/339392086.db2.gz SFSMFIZPNWDYQR-UHFFFAOYSA-N 0 0 319.470 5.170 20 0 DKADRN CC(C)(C)OCCCCSCc1nc2ccccc2s1 ZINC000473786618 339392029 /nfs/dbraw/zinc/39/20/29/339392029.db2.gz LGXZWUQVGSSIGL-UHFFFAOYSA-N 0 0 309.500 5.125 20 0 DKADRN CC(C)(C)OCCCCSCc1ncc(-c2ccccc2)o1 ZINC000473788035 339392075 /nfs/dbraw/zinc/39/20/75/339392075.db2.gz UKYAEBOJQRTINK-UHFFFAOYSA-N 0 0 319.470 5.170 20 0 DKADRN CC(C)(C)OCCCCSCc1csc(C(C)(C)C)n1 ZINC000473791255 339392226 /nfs/dbraw/zinc/39/22/26/339392226.db2.gz XPJMDZKSNSCKPN-UHFFFAOYSA-N 0 0 315.548 5.269 20 0 DKADRN C[C@@H](SCCCCOC(C)(C)C)c1ncc(C(C)(C)C)o1 ZINC000473791766 339392167 /nfs/dbraw/zinc/39/21/67/339392167.db2.gz VJDQSKHTCADBGO-CYBMUJFWSA-N 0 0 313.507 5.362 20 0 DKADRN C[C@H](SCCCCOC(C)(C)C)c1ncc(C(C)(C)C)o1 ZINC000473791767 339392214 /nfs/dbraw/zinc/39/22/14/339392214.db2.gz VJDQSKHTCADBGO-ZDUSSCGKSA-N 0 0 313.507 5.362 20 0 DKADRN CC(C)N(C)C(=O)Nc1ccccc1Oc1ccc(Cl)cc1 ZINC000473792025 339392228 /nfs/dbraw/zinc/39/22/28/339392228.db2.gz LEDSVYXMWHCBEW-UHFFFAOYSA-N 0 0 318.804 5.004 20 0 DKADRN CC(C)(C)OCCCCSCc1ccc(C(F)F)cc1 ZINC000473793017 339392242 /nfs/dbraw/zinc/39/22/42/339392242.db2.gz RAWULGVEZBXCAL-UHFFFAOYSA-N 0 0 302.430 5.453 20 0 DKADRN Cc1cc(-c2cccc(Cl)c2)ccc1NC(=O)N(C)C(C)C ZINC000473793811 339392341 /nfs/dbraw/zinc/39/23/41/339392341.db2.gz HMFFFCJCWWBDPW-UHFFFAOYSA-N 0 0 316.832 5.188 20 0 DKADRN COc1c2ccccc2oc1CN[C@@H](C)c1ccc(Cl)s1 ZINC000473794662 339392297 /nfs/dbraw/zinc/39/22/97/339392297.db2.gz FDMVYBHGCIAPIN-JTQLQIEISA-N 0 0 321.829 5.007 20 0 DKADRN COc1c2ccccc2oc1CN[C@H](C)c1ccc(Cl)s1 ZINC000473794663 339392248 /nfs/dbraw/zinc/39/22/48/339392248.db2.gz FDMVYBHGCIAPIN-SNVBAGLBSA-N 0 0 321.829 5.007 20 0 DKADRN CC(C)N(C)C(=O)Nc1cccc(CSC2CCCCC2)c1 ZINC000473816495 339392728 /nfs/dbraw/zinc/39/27/28/339392728.db2.gz HJBGSVUCQQMAAT-UHFFFAOYSA-N 0 0 320.502 5.125 20 0 DKADRN CCN(C(=O)Nc1ccccc1SC(C)C)[C@@H](C)C(C)C ZINC000473835776 339392985 /nfs/dbraw/zinc/39/29/85/339392985.db2.gz DMNNMAMAFBABJE-AWEZNQCLSA-N 0 0 308.491 5.085 20 0 DKADRN CCN(C(=O)Nc1ccccc1SC(C)C)[C@H](C)C(C)C ZINC000473835777 339392984 /nfs/dbraw/zinc/39/29/84/339392984.db2.gz DMNNMAMAFBABJE-CQSZACIVSA-N 0 0 308.491 5.085 20 0 DKADRN Cc1ccccc1NC(=O)Nc1ccccc1SC(C)C ZINC000473848576 339393337 /nfs/dbraw/zinc/39/33/37/339393337.db2.gz SJVAGGIXZJYRBX-UHFFFAOYSA-N 0 0 300.427 5.140 20 0 DKADRN CSc1cccc(C)c1NC(=O)N(C)CCC1CCCCC1 ZINC000473956060 339395450 /nfs/dbraw/zinc/39/54/50/339395450.db2.gz AHNJDIBACJEXAG-UHFFFAOYSA-N 0 0 320.502 5.151 20 0 DKADRN CCCCCN(C(=O)Nc1c(C)cccc1SC)C(C)C ZINC000473960166 339395364 /nfs/dbraw/zinc/39/53/64/339395364.db2.gz RFVCIQROAKAUTL-UHFFFAOYSA-N 0 0 308.491 5.149 20 0 DKADRN CCCCN(CCCC)C(=O)Nc1c(C)cccc1SC ZINC000473965564 339395580 /nfs/dbraw/zinc/39/55/80/339395580.db2.gz GAATTXBNCLZYMJ-UHFFFAOYSA-N 0 0 308.491 5.151 20 0 DKADRN CCC(CC)CN(CC)C(=O)Nc1c(C)cccc1SC ZINC000473968144 339395598 /nfs/dbraw/zinc/39/55/98/339395598.db2.gz IHIJFEJMUSXKGH-UHFFFAOYSA-N 0 0 308.491 5.007 20 0 DKADRN CCC[C@]1(C)CCCN(C(=O)Nc2c(C)cccc2SC)C1 ZINC000473975032 339395791 /nfs/dbraw/zinc/39/57/91/339395791.db2.gz FCEPUQACTWNQLH-GOSISDBHSA-N 0 0 320.502 5.151 20 0 DKADRN CCC[C@@]1(C)CCCN(C(=O)Nc2c(C)cccc2SC)C1 ZINC000473975033 339395803 /nfs/dbraw/zinc/39/58/03/339395803.db2.gz FCEPUQACTWNQLH-SFHVURJKSA-N 0 0 320.502 5.151 20 0 DKADRN CSc1cccc(C)c1NC(=O)N1CCCC[C@H]1CC(C)C ZINC000473975138 339395826 /nfs/dbraw/zinc/39/58/26/339395826.db2.gz HHXBLBPIUPGOQM-HNNXBMFYSA-N 0 0 320.502 5.149 20 0 DKADRN CSc1cccc(C)c1NC(=O)N1CCCC[C@@H]1CC(C)C ZINC000473975139 339395797 /nfs/dbraw/zinc/39/57/97/339395797.db2.gz HHXBLBPIUPGOQM-OAHLLOKOSA-N 0 0 320.502 5.149 20 0 DKADRN CSc1cccc(NC(=O)Nc2c(C)cccc2SC)c1 ZINC000473975621 339395925 /nfs/dbraw/zinc/39/59/25/339395925.db2.gz OFFAUZFMNQHZHG-UHFFFAOYSA-N 0 0 318.467 5.083 20 0 DKADRN CSc1cccc(C)c1NC(=O)N1CCC[C@@H](CC(C)C)C1 ZINC000473978646 339395927 /nfs/dbraw/zinc/39/59/27/339395927.db2.gz QWWGVWIJLGUDOA-HNNXBMFYSA-N 0 0 320.502 5.007 20 0 DKADRN CSc1cccc(C)c1NC(=O)N1CCC[C@H](CC(C)C)C1 ZINC000473978647 339395940 /nfs/dbraw/zinc/39/59/40/339395940.db2.gz QWWGVWIJLGUDOA-OAHLLOKOSA-N 0 0 320.502 5.007 20 0 DKADRN CSc1cccc(C)c1NC(=O)N1CCC[C@H]1CC(C)(C)C ZINC000473979240 339396004 /nfs/dbraw/zinc/39/60/04/339396004.db2.gz TZAWOUXXQOGSOT-AWEZNQCLSA-N 0 0 320.502 5.149 20 0 DKADRN CSc1cccc(C)c1NC(=O)N1CCC[C@@H]1CC(C)(C)C ZINC000473979241 339395995 /nfs/dbraw/zinc/39/59/95/339395995.db2.gz TZAWOUXXQOGSOT-CQSZACIVSA-N 0 0 320.502 5.149 20 0 DKADRN CSc1cccc(C)c1NC(=O)N1CC(C)(C)CC(C)(C)C1 ZINC000473981207 339395961 /nfs/dbraw/zinc/39/59/61/339395961.db2.gz IHBNTYGLYKFJRJ-UHFFFAOYSA-N 0 0 320.502 5.007 20 0 DKADRN CC(C)c1cnc(CN[C@H](C)c2cc3cccc(F)c3o2)s1 ZINC000473982402 339396161 /nfs/dbraw/zinc/39/61/61/339396161.db2.gz IWFLAJNJXDNFBL-LLVKDONJSA-N 0 0 318.417 5.003 20 0 DKADRN CC(C)c1cnc(CN[C@@H](C)c2cc3cccc(F)c3o2)s1 ZINC000473982404 339396131 /nfs/dbraw/zinc/39/61/31/339396131.db2.gz IWFLAJNJXDNFBL-NSHDSACASA-N 0 0 318.417 5.003 20 0 DKADRN CCC[C@@H]1[C@@H](C)CCCN1C(=O)Nc1c(C)cccc1SC ZINC000473985532 339396115 /nfs/dbraw/zinc/39/61/15/339396115.db2.gz WDQTYQDYVURLGT-DZGCQCFKSA-N 0 0 320.502 5.149 20 0 DKADRN CCC[C@H]1[C@H](C)CCCN1C(=O)Nc1c(C)cccc1SC ZINC000473985533 339396184 /nfs/dbraw/zinc/39/61/84/339396184.db2.gz WDQTYQDYVURLGT-HIFRSBDPSA-N 0 0 320.502 5.149 20 0 DKADRN CCC[C@@H]1[C@H](C)CCCN1C(=O)Nc1c(C)cccc1SC ZINC000473985534 339396142 /nfs/dbraw/zinc/39/61/42/339396142.db2.gz WDQTYQDYVURLGT-UKRRQHHQSA-N 0 0 320.502 5.149 20 0 DKADRN CCC[C@H]1[C@@H](C)CCCN1C(=O)Nc1c(C)cccc1SC ZINC000473985535 339396076 /nfs/dbraw/zinc/39/60/76/339396076.db2.gz WDQTYQDYVURLGT-ZFWWWQNUSA-N 0 0 320.502 5.149 20 0 DKADRN C[C@H](NCc1ccc([C@H]2C[C@@H]2C)o1)c1cc2cccc(F)c2o1 ZINC000473988267 339396282 /nfs/dbraw/zinc/39/62/82/339396282.db2.gz GWSJLCKUJGCFSI-HUBLWGQQSA-N 0 0 313.372 5.139 20 0 DKADRN C[C@H](NCc1ccc([C@@H]2C[C@@H]2C)o1)c1cc2cccc(F)c2o1 ZINC000473988268 339396209 /nfs/dbraw/zinc/39/62/09/339396209.db2.gz GWSJLCKUJGCFSI-SLEUVZQESA-N 0 0 313.372 5.139 20 0 DKADRN C[C@H](NCc1ccc([C@@H]2C[C@H]2C)o1)c1cc2cccc(F)c2o1 ZINC000473988269 339396299 /nfs/dbraw/zinc/39/62/99/339396299.db2.gz GWSJLCKUJGCFSI-TYNCELHUSA-N 0 0 313.372 5.139 20 0 DKADRN C[C@H](NCc1ccc([C@H]2C[C@H]2C)o1)c1cc2cccc(F)c2o1 ZINC000473988270 339396258 /nfs/dbraw/zinc/39/62/58/339396258.db2.gz GWSJLCKUJGCFSI-XUJVJEKNSA-N 0 0 313.372 5.139 20 0 DKADRN CC(C)c1nc(CN[C@H](C)c2cc3cccc(F)c3o2)cs1 ZINC000473988702 339396422 /nfs/dbraw/zinc/39/64/22/339396422.db2.gz VTJQAWUUKBXRBE-LLVKDONJSA-N 0 0 318.417 5.003 20 0 DKADRN CC(C)c1nc(CN[C@@H](C)c2cc3cccc(F)c3o2)cs1 ZINC000473988703 339396369 /nfs/dbraw/zinc/39/63/69/339396369.db2.gz VTJQAWUUKBXRBE-NSHDSACASA-N 0 0 318.417 5.003 20 0 DKADRN CSc1cccc(C)c1NC(=O)N1CCCC12CCCCC2 ZINC000473988711 339396445 /nfs/dbraw/zinc/39/64/45/339396445.db2.gz VWPDKSHADYMZTC-UHFFFAOYSA-N 0 0 318.486 5.048 20 0 DKADRN CSc1cccc(C)c1NC(=O)N1CCC[C@H]1CCC(C)C ZINC000473989655 339396477 /nfs/dbraw/zinc/39/64/77/339396477.db2.gz CVDYJCPCEQWGNK-HNNXBMFYSA-N 0 0 320.502 5.149 20 0 DKADRN CSc1cccc(C)c1NC(=O)N1CCC[C@@H]1CCC(C)C ZINC000473989656 339396420 /nfs/dbraw/zinc/39/64/20/339396420.db2.gz CVDYJCPCEQWGNK-OAHLLOKOSA-N 0 0 320.502 5.149 20 0 DKADRN CSc1cccc(C)c1NC(=O)N(CC(C)C)C1CCCC1 ZINC000473989661 339396428 /nfs/dbraw/zinc/39/64/28/339396428.db2.gz CXKKYCOCQHRCSD-UHFFFAOYSA-N 0 0 320.502 5.149 20 0 DKADRN CSc1cccc(C)c1NC(=O)N1CCC[C@H](C(C)C)CC1 ZINC000473990417 339396363 /nfs/dbraw/zinc/39/63/63/339396363.db2.gz IOSWOIUMXJKTGO-HNNXBMFYSA-N 0 0 320.502 5.007 20 0 DKADRN CSc1cccc(C)c1NC(=O)N1CCC[C@@H](C(C)C)CC1 ZINC000473990419 339396453 /nfs/dbraw/zinc/39/64/53/339396453.db2.gz IOSWOIUMXJKTGO-OAHLLOKOSA-N 0 0 320.502 5.007 20 0 DKADRN CC[C@H](C)[C@H]1CCCCN1C(=O)Nc1c(C)cccc1SC ZINC000473992510 339396507 /nfs/dbraw/zinc/39/65/07/339396507.db2.gz FCEBMNXFOOMJCL-DZGCQCFKSA-N 0 0 320.502 5.149 20 0 DKADRN CC[C@@H](C)[C@@H]1CCCCN1C(=O)Nc1c(C)cccc1SC ZINC000473992512 339396587 /nfs/dbraw/zinc/39/65/87/339396587.db2.gz FCEBMNXFOOMJCL-HIFRSBDPSA-N 0 0 320.502 5.149 20 0 DKADRN CC[C@@H](C)[C@H]1CCCCN1C(=O)Nc1c(C)cccc1SC ZINC000473992514 339396623 /nfs/dbraw/zinc/39/66/23/339396623.db2.gz FCEBMNXFOOMJCL-UKRRQHHQSA-N 0 0 320.502 5.149 20 0 DKADRN CC[C@H](C)[C@@H]1CCCCN1C(=O)Nc1c(C)cccc1SC ZINC000473992515 339396563 /nfs/dbraw/zinc/39/65/63/339396563.db2.gz FCEBMNXFOOMJCL-ZFWWWQNUSA-N 0 0 320.502 5.149 20 0 DKADRN CCC[C@H](C)[C@H]1CCCN1C(=O)Nc1c(C)cccc1SC ZINC000473994998 339396491 /nfs/dbraw/zinc/39/64/91/339396491.db2.gz YFWCHROHFDSTGO-DZGCQCFKSA-N 0 0 320.502 5.149 20 0 DKADRN CCC[C@@H](C)[C@@H]1CCCN1C(=O)Nc1c(C)cccc1SC ZINC000473994999 339396571 /nfs/dbraw/zinc/39/65/71/339396571.db2.gz YFWCHROHFDSTGO-HIFRSBDPSA-N 0 0 320.502 5.149 20 0 DKADRN CCC[C@@H](C)[C@H]1CCCN1C(=O)Nc1c(C)cccc1SC ZINC000473995000 339396610 /nfs/dbraw/zinc/39/66/10/339396610.db2.gz YFWCHROHFDSTGO-UKRRQHHQSA-N 0 0 320.502 5.149 20 0 DKADRN CCC[C@H](C)[C@@H]1CCCN1C(=O)Nc1c(C)cccc1SC ZINC000473995001 339396613 /nfs/dbraw/zinc/39/66/13/339396613.db2.gz YFWCHROHFDSTGO-ZFWWWQNUSA-N 0 0 320.502 5.149 20 0 DKADRN CCCCC[C@H]1CCCN1C(=O)Nc1c(C)cccc1SC ZINC000473997530 339396638 /nfs/dbraw/zinc/39/66/38/339396638.db2.gz XAARGSXNXHWRAE-HNNXBMFYSA-N 0 0 320.502 5.294 20 0 DKADRN CCCCC[C@@H]1CCCN1C(=O)Nc1c(C)cccc1SC ZINC000473997531 339396738 /nfs/dbraw/zinc/39/67/38/339396738.db2.gz XAARGSXNXHWRAE-OAHLLOKOSA-N 0 0 320.502 5.294 20 0 DKADRN C[C@@H](NCc1ccccc1Cl)c1cc2cccc(F)c2o1 ZINC000474000010 339396825 /nfs/dbraw/zinc/39/68/25/339396825.db2.gz LDHFCUREOSWELK-LLVKDONJSA-N 0 0 303.764 5.076 20 0 DKADRN C[C@H](NCc1ccccc1Cl)c1cc2cccc(F)c2o1 ZINC000474000011 339396852 /nfs/dbraw/zinc/39/68/52/339396852.db2.gz LDHFCUREOSWELK-NSHDSACASA-N 0 0 303.764 5.076 20 0 DKADRN Cc1coc(-c2cccc(N[C@H](C)C3CCC(F)(F)CC3)c2)n1 ZINC000474028977 339397667 /nfs/dbraw/zinc/39/76/67/339397667.db2.gz KSVDDWDPKGIKGB-CYBMUJFWSA-N 0 0 320.383 5.276 20 0 DKADRN Cc1coc(-c2cccc(N[C@@H](C)C3CCC(F)(F)CC3)c2)n1 ZINC000474028997 339397628 /nfs/dbraw/zinc/39/76/28/339397628.db2.gz KSVDDWDPKGIKGB-ZDUSSCGKSA-N 0 0 320.383 5.276 20 0 DKADRN COc1c2ccccc2oc1CN[C@@H](C)c1csc(Cl)c1 ZINC000474029399 339397765 /nfs/dbraw/zinc/39/77/65/339397765.db2.gz HVLAUWJJERPQRT-JTQLQIEISA-N 0 0 321.829 5.007 20 0 DKADRN COc1c2ccccc2oc1CN[C@H](C)c1csc(Cl)c1 ZINC000474029401 339397726 /nfs/dbraw/zinc/39/77/26/339397726.db2.gz HVLAUWJJERPQRT-SNVBAGLBSA-N 0 0 321.829 5.007 20 0 DKADRN Cc1ncc(-c2ccc(N[C@H](C)C3CCC(F)(F)CC3)cc2)o1 ZINC000474029404 339397789 /nfs/dbraw/zinc/39/77/89/339397789.db2.gz DIQQVOSVVXNENH-GFCCVEGCSA-N 0 0 320.383 5.276 20 0 DKADRN Cc1ncc(-c2ccc(N[C@@H](C)C3CCC(F)(F)CC3)cc2)o1 ZINC000474029407 339397688 /nfs/dbraw/zinc/39/76/88/339397688.db2.gz DIQQVOSVVXNENH-LBPRGKRZSA-N 0 0 320.383 5.276 20 0 DKADRN Cc1ccc(N[C@H](C)C2CCC(F)(F)CC2)cc1-c1ncco1 ZINC000474030149 339397696 /nfs/dbraw/zinc/39/76/96/339397696.db2.gz HEJBCYVZCPFEPH-CYBMUJFWSA-N 0 0 320.383 5.276 20 0 DKADRN Cc1ccc(N[C@@H](C)C2CCC(F)(F)CC2)cc1-c1ncco1 ZINC000474030151 339397719 /nfs/dbraw/zinc/39/77/19/339397719.db2.gz HEJBCYVZCPFEPH-ZDUSSCGKSA-N 0 0 320.383 5.276 20 0 DKADRN c1coc(COCc2cccc(N[C@H]3CCC34CCCC4)c2)c1 ZINC000474048140 339399087 /nfs/dbraw/zinc/39/90/87/339399087.db2.gz WKPCOWZBSKEKAT-IBGZPJMESA-N 0 0 311.425 5.131 20 0 DKADRN c1coc(COCc2cccc(N[C@@H]3CCC34CCCC4)c2)c1 ZINC000474048429 339399070 /nfs/dbraw/zinc/39/90/70/339399070.db2.gz WKPCOWZBSKEKAT-LJQANCHMSA-N 0 0 311.425 5.131 20 0 DKADRN Cc1cnc(-c2cccc(N[C@H](C)C3CCC(F)(F)CC3)c2)o1 ZINC000474054890 339399463 /nfs/dbraw/zinc/39/94/63/339399463.db2.gz ISXDGSZPGSEXKI-CYBMUJFWSA-N 0 0 320.383 5.276 20 0 DKADRN Cc1cnc(-c2cccc(N[C@@H](C)C3CCC(F)(F)CC3)c2)o1 ZINC000474054892 339399510 /nfs/dbraw/zinc/39/95/10/339399510.db2.gz ISXDGSZPGSEXKI-ZDUSSCGKSA-N 0 0 320.383 5.276 20 0 DKADRN Cc1ccc(N[C@H]2CCC23CCCC3)cc1NC(=O)C(C)(C)C ZINC000474056337 339399684 /nfs/dbraw/zinc/39/96/84/339399684.db2.gz IWRZCWRKYBDWOC-KRWDZBQOSA-N 0 0 314.473 5.114 20 0 DKADRN Cc1ccc(N[C@@H]2CCC23CCCC3)cc1NC(=O)C(C)(C)C ZINC000474056342 339399648 /nfs/dbraw/zinc/39/96/48/339399648.db2.gz IWRZCWRKYBDWOC-QGZVFWFLSA-N 0 0 314.473 5.114 20 0 DKADRN COc1c2ccccc2oc1CN[C@H](C)c1cc2ccccc2o1 ZINC000474058565 339399912 /nfs/dbraw/zinc/39/99/12/339399912.db2.gz NSUCKOCECUKPLW-CYBMUJFWSA-N 0 0 321.376 5.038 20 0 DKADRN CCCC(=O)Nc1cccc(N[C@H](C)C2CCC(F)(F)CC2)c1 ZINC000474059500 339399989 /nfs/dbraw/zinc/39/99/89/339399989.db2.gz XLUUNDNMGYBXTP-CYBMUJFWSA-N 0 0 324.415 5.051 20 0 DKADRN CCCC(=O)Nc1cccc(N[C@@H](C)C2CCC(F)(F)CC2)c1 ZINC000474059501 339399929 /nfs/dbraw/zinc/39/99/29/339399929.db2.gz XLUUNDNMGYBXTP-ZDUSSCGKSA-N 0 0 324.415 5.051 20 0 DKADRN Cc1cc(C(=O)Nc2ccc(F)cc2Cl)c(C)cc1Cl ZINC000474072171 339400865 /nfs/dbraw/zinc/40/08/65/339400865.db2.gz BWNHABNMMGIXFD-UHFFFAOYSA-N 0 0 312.171 5.002 20 0 DKADRN Cc1ccc(NC(=O)c2c(C)c(F)ccc2Cl)c(Cl)c1 ZINC000474072395 339400769 /nfs/dbraw/zinc/40/07/69/339400769.db2.gz CPNWFXZYGAQUJW-UHFFFAOYSA-N 0 0 312.171 5.002 20 0 DKADRN Cc1ccc(NC(=O)c2c(C)c(F)ccc2Cl)cc1Cl ZINC000474078274 339401143 /nfs/dbraw/zinc/40/11/43/339401143.db2.gz ALNRVIXJEIMLSZ-UHFFFAOYSA-N 0 0 312.171 5.002 20 0 DKADRN Cc1c(Cl)cccc1NC(=O)c1c(C)c(F)ccc1Cl ZINC000474080172 339401265 /nfs/dbraw/zinc/40/12/65/339401265.db2.gz GDUJMNVBIVQPHM-UHFFFAOYSA-N 0 0 312.171 5.002 20 0 DKADRN Cc1cccc(C)c1C(=O)Nc1ccc(COC2CCCC2)cc1 ZINC000474095903 339402263 /nfs/dbraw/zinc/40/22/63/339402263.db2.gz LWRQGPZZEWFGIQ-UHFFFAOYSA-N 0 0 323.436 5.015 20 0 DKADRN CCc1ccc([C@@H](C)N[C@@H](C)c2cc3cccc(F)c3o2)o1 ZINC000474096706 339402160 /nfs/dbraw/zinc/40/21/60/339402160.db2.gz LIFUGBJVJJIBDR-NEPJUHHUSA-N 0 0 301.361 5.139 20 0 DKADRN CCc1ccc([C@H](C)N[C@@H](C)c2cc3cccc(F)c3o2)o1 ZINC000474096710 339402181 /nfs/dbraw/zinc/40/21/81/339402181.db2.gz LIFUGBJVJJIBDR-RYUDHWBXSA-N 0 0 301.361 5.139 20 0 DKADRN CCc1ccc([C@@H](C)N[C@H](C)c2cc3cccc(F)c3o2)o1 ZINC000474096711 339402191 /nfs/dbraw/zinc/40/21/91/339402191.db2.gz LIFUGBJVJJIBDR-VXGBXAGGSA-N 0 0 301.361 5.139 20 0 DKADRN C[C@@H](N[C@@H](C)c1cc2cccc(F)c2o1)c1ccc(F)cc1F ZINC000474102516 339402687 /nfs/dbraw/zinc/40/26/87/339402687.db2.gz ADFVRUWDYZTSKC-MNOVXSKESA-N 0 0 319.326 5.262 20 0 DKADRN C[C@H](N[C@@H](C)c1ccc(F)cc1F)c1cc2cccc(F)c2o1 ZINC000474102517 339402634 /nfs/dbraw/zinc/40/26/34/339402634.db2.gz ADFVRUWDYZTSKC-QWRGUYRKSA-N 0 0 319.326 5.262 20 0 DKADRN C[C@@H](N[C@H](C)c1cccc(F)c1F)c1cc2cccc(F)c2o1 ZINC000474103338 339402886 /nfs/dbraw/zinc/40/28/86/339402886.db2.gz DHLOAMKOGFRPRT-GHMZBOCLSA-N 0 0 319.326 5.262 20 0 DKADRN C[C@H](N[C@@H](C)c1cccc(F)c1F)c1cc2cccc(F)c2o1 ZINC000474103340 339402896 /nfs/dbraw/zinc/40/28/96/339402896.db2.gz DHLOAMKOGFRPRT-QWRGUYRKSA-N 0 0 319.326 5.262 20 0 DKADRN C[C@@H](N[C@@H](C)c1cccc(F)c1F)c1cc2cccc(F)c2o1 ZINC000474103341 339402893 /nfs/dbraw/zinc/40/28/93/339402893.db2.gz DHLOAMKOGFRPRT-WDEREUQCSA-N 0 0 319.326 5.262 20 0 DKADRN C[C@@H](N[C@H](C)c1ccc(Cl)cn1)c1cc2cccc(F)c2o1 ZINC000474107636 339403079 /nfs/dbraw/zinc/40/30/79/339403079.db2.gz RXSPJXJECXTGLA-GHMZBOCLSA-N 0 0 318.779 5.032 20 0 DKADRN C[C@@H](N[C@@H](C)c1cc2cccc(F)c2o1)c1ccc(Cl)cn1 ZINC000474107638 339403119 /nfs/dbraw/zinc/40/31/19/339403119.db2.gz RXSPJXJECXTGLA-MNOVXSKESA-N 0 0 318.779 5.032 20 0 DKADRN C[C@H](N[C@@H](C)c1ccc(Cl)cn1)c1cc2cccc(F)c2o1 ZINC000474107640 339403167 /nfs/dbraw/zinc/40/31/67/339403167.db2.gz RXSPJXJECXTGLA-QWRGUYRKSA-N 0 0 318.779 5.032 20 0 DKADRN Cc1nc(-c2cccc(N[C@H](C)C3CCSCC3)c2)cs1 ZINC000474109373 339403314 /nfs/dbraw/zinc/40/33/14/339403314.db2.gz BFPSJOCGAAZSHH-GFCCVEGCSA-N 0 0 318.511 5.062 20 0 DKADRN CC(C)Oc1ccc(NC(=O)c2cccc(Cl)c2)c(Cl)c1 ZINC000474137144 339403993 /nfs/dbraw/zinc/40/39/93/339403993.db2.gz IKUZEGXEDGSFNO-UHFFFAOYSA-N 0 0 324.207 5.033 20 0 DKADRN Cc1cc(-c2ncccc2NC(=O)[C@@H](C)CC(C)(C)C)cs1 ZINC000474319546 339409256 /nfs/dbraw/zinc/40/92/56/339409256.db2.gz MUGRCNHNNVARCY-LBPRGKRZSA-N 0 0 316.470 5.129 20 0 DKADRN Cc1cc(-c2ncccc2NC(=O)C2CCCCCC2)cs1 ZINC000474322761 339409444 /nfs/dbraw/zinc/40/94/44/339409444.db2.gz GVIQIPSJNQHYBV-UHFFFAOYSA-N 0 0 314.454 5.027 20 0 DKADRN Cc1ccccc1NC(=O)c1cccc(N[C@@H](C)C(C)C)c1C ZINC000474332090 339409760 /nfs/dbraw/zinc/40/97/60/339409760.db2.gz PBMMVRNERLGKIP-INIZCTEOSA-N 0 0 310.441 5.012 20 0 DKADRN Cc1ccccc1NC(=O)c1cccc(N[C@H](C)C(C)C)c1C ZINC000474332092 339409797 /nfs/dbraw/zinc/40/97/97/339409797.db2.gz PBMMVRNERLGKIP-MRXNPFEDSA-N 0 0 310.441 5.012 20 0 DKADRN Cc1cccc(C(C)C)c1NC(=O)N1C[C@H](C)C[C@@H](C)[C@H]1C ZINC000474342025 339410165 /nfs/dbraw/zinc/41/01/65/339410165.db2.gz MSWYLQKIBPHPBH-FVQBIDKESA-N 0 0 302.462 5.017 20 0 DKADRN Cc1cccc(C(C)C)c1NC(=O)N1C[C@H](C)C[C@H](C)[C@@H]1C ZINC000474342026 339410074 /nfs/dbraw/zinc/41/00/74/339410074.db2.gz MSWYLQKIBPHPBH-KBMXLJTQSA-N 0 0 302.462 5.017 20 0 DKADRN COc1ccc2nc(CNc3cccc4ccccc43)sc2c1 ZINC000474361053 339410903 /nfs/dbraw/zinc/41/09/03/339410903.db2.gz ZTYPNPBXLWBMRP-UHFFFAOYSA-N 0 0 320.417 5.070 20 0 DKADRN Cc1csc(-c2ccc(N[C@H](C)C3CCSCC3)cc2)n1 ZINC000474378571 339411601 /nfs/dbraw/zinc/41/16/01/339411601.db2.gz QEFXHKAISVNFRA-CYBMUJFWSA-N 0 0 318.511 5.062 20 0 DKADRN Cc1csc(-c2ccc(N[C@@H](C)C3CCSCC3)cc2)n1 ZINC000474378572 339411582 /nfs/dbraw/zinc/41/15/82/339411582.db2.gz QEFXHKAISVNFRA-ZDUSSCGKSA-N 0 0 318.511 5.062 20 0 DKADRN C[C@H](Nc1ccc(COC2CCCC2)cc1)C1CCSCC1 ZINC000474379001 339411589 /nfs/dbraw/zinc/41/15/89/339411589.db2.gz VOOKVNWQNUYPPS-HNNXBMFYSA-N 0 0 319.514 5.089 20 0 DKADRN C[C@@H](Nc1ccc(COC2CCCC2)cc1)C1CCSCC1 ZINC000474379002 339411560 /nfs/dbraw/zinc/41/15/60/339411560.db2.gz VOOKVNWQNUYPPS-OAHLLOKOSA-N 0 0 319.514 5.089 20 0 DKADRN Cc1csc(-c2cccc(N[C@@H](C)C3CCSCC3)c2)n1 ZINC000474380546 339411730 /nfs/dbraw/zinc/41/17/30/339411730.db2.gz XTNZJQMVFPWWQR-ZDUSSCGKSA-N 0 0 318.511 5.062 20 0 DKADRN Cc1ccncc1CNc1cccc(CO[C@H]2CCC[C@@H](C)C2)c1 ZINC000474383759 339411792 /nfs/dbraw/zinc/41/17/92/339411792.db2.gz FKDSJFPRSKSJAU-IERDGZPVSA-N 0 0 324.468 5.097 20 0 DKADRN CC(=O)Nc1cc(NC[C@H](CC(C)C)c2ccccc2)ccc1C ZINC000474385515 339411830 /nfs/dbraw/zinc/41/18/30/339411830.db2.gz SSJBCYXYEGOKAD-IBGZPJMESA-N 0 0 324.468 5.195 20 0 DKADRN CC[C@H](C)Sc1ccc(NCc2cnccc2C)c(C)c1 ZINC000474386592 339411963 /nfs/dbraw/zinc/41/19/63/339411963.db2.gz XJLOHIYDYKQFEM-HNNXBMFYSA-N 0 0 300.471 5.201 20 0 DKADRN CC[C@@H](C)Sc1ccc(NCc2cnccc2C)c(C)c1 ZINC000474386593 339411961 /nfs/dbraw/zinc/41/19/61/339411961.db2.gz XJLOHIYDYKQFEM-OAHLLOKOSA-N 0 0 300.471 5.201 20 0 DKADRN Cc1ccncc1CNc1cccc(Cl)c1SC(C)C ZINC000474390072 339412021 /nfs/dbraw/zinc/41/20/21/339412021.db2.gz JYVOVADTFBDGRG-UHFFFAOYSA-N 0 0 306.862 5.156 20 0 DKADRN C[C@H](Nc1ccc(CCC(F)(F)F)cc1)C1CCSCC1 ZINC000474400334 339412725 /nfs/dbraw/zinc/41/27/25/339412725.db2.gz TYRJFEJDTWPUDO-LBPRGKRZSA-N 0 0 317.420 5.125 20 0 DKADRN Cc1cc(C(=O)Nc2ccc(OC(C)C)cc2Cl)sc1C ZINC000474406575 339413064 /nfs/dbraw/zinc/41/30/64/339413064.db2.gz HMQQKOITQAHISG-UHFFFAOYSA-N 0 0 323.845 5.058 20 0 DKADRN C[C@@H](Nc1cccc(CSC2CCOCC2)c1)C1CCCC1 ZINC000474473915 339416434 /nfs/dbraw/zinc/41/64/34/339416434.db2.gz UYDQSNMVPYQAAP-OAHLLOKOSA-N 0 0 319.514 5.089 20 0 DKADRN CC[C@@H](C)[C@@H](C)C(=O)Nc1cccnc1-c1ccc(Cl)s1 ZINC000474533920 339418248 /nfs/dbraw/zinc/41/82/48/339418248.db2.gz CKVGLULRHQQEFW-GHMZBOCLSA-N 0 0 322.861 5.084 20 0 DKADRN CC[C@@H](C)[C@H](C)C(=O)Nc1cccnc1-c1ccc(Cl)s1 ZINC000474533921 339418265 /nfs/dbraw/zinc/41/82/65/339418265.db2.gz CKVGLULRHQQEFW-MNOVXSKESA-N 0 0 322.861 5.084 20 0 DKADRN CC[C@H](C)[C@H](C)C(=O)Nc1cccnc1-c1ccc(Cl)s1 ZINC000474533922 339418273 /nfs/dbraw/zinc/41/82/73/339418273.db2.gz CKVGLULRHQQEFW-QWRGUYRKSA-N 0 0 322.861 5.084 20 0 DKADRN CC[C@H](C)[C@@H](C)C(=O)Nc1cccnc1-c1ccc(Cl)s1 ZINC000474533923 339418257 /nfs/dbraw/zinc/41/82/57/339418257.db2.gz CKVGLULRHQQEFW-WDEREUQCSA-N 0 0 322.861 5.084 20 0 DKADRN CC(C)C[C@H](C)C(=O)Nc1cccnc1-c1ccc(Cl)s1 ZINC000474535561 339418256 /nfs/dbraw/zinc/41/82/56/339418256.db2.gz JAKAJQZCLARWFA-NSHDSACASA-N 0 0 322.861 5.084 20 0 DKADRN Cc1ccc(C)c(NC(=O)N2CCC[C@@H]2c2cc(C)ccc2C)c1 ZINC000474538289 339418244 /nfs/dbraw/zinc/41/82/44/339418244.db2.gz HCVPKQZKYVZRMV-HXUWFJFHSA-N 0 0 322.452 5.289 20 0 DKADRN Cc1cc(C)c(NC(=O)N(CC(C)C)CC(C)(C)C)c(C)c1 ZINC000474541128 339418375 /nfs/dbraw/zinc/41/83/75/339418375.db2.gz OGIKZNKVMFKXOZ-UHFFFAOYSA-N 0 0 304.478 5.148 20 0 DKADRN Cc1ccc(NC(=O)N2CCC[C@H]2c2cc(C)ccc2C)c(C)c1 ZINC000474554299 339418578 /nfs/dbraw/zinc/41/85/78/339418578.db2.gz GAZPDBCEZBGEOG-FQEVSTJZSA-N 0 0 322.452 5.289 20 0 DKADRN Cc1ccc(NC(=O)N2CCC[C@@H]2c2cc(C)ccc2C)c(C)c1 ZINC000474554300 339418637 /nfs/dbraw/zinc/41/86/37/339418637.db2.gz GAZPDBCEZBGEOG-HXUWFJFHSA-N 0 0 322.452 5.289 20 0 DKADRN CCc1ccccc1NC(=O)N1CCC[C@H]1c1cc(C)ccc1C ZINC000474555624 339418570 /nfs/dbraw/zinc/41/85/70/339418570.db2.gz DLWGFLJHLZISEB-FQEVSTJZSA-N 0 0 322.452 5.235 20 0 DKADRN CCc1cccc(C)c1NC(=O)N(CC(C)C)CC(C)(C)C ZINC000474565815 339418803 /nfs/dbraw/zinc/41/88/03/339418803.db2.gz OBHZGJJJQFPIPO-UHFFFAOYSA-N 0 0 304.478 5.093 20 0 DKADRN CC(=O)c1sccc1OCc1csc(C2CCCCC2)n1 ZINC000474603844 339419544 /nfs/dbraw/zinc/41/95/44/339419544.db2.gz GOJKURVXLDAONO-UHFFFAOYSA-N 0 0 321.467 5.034 20 0 DKADRN CCC[C@@H](C)C(=O)Nc1ccccc1-c1cc(F)c(F)c(F)c1 ZINC000474731124 339424564 /nfs/dbraw/zinc/42/45/64/339424564.db2.gz QUEUGTFKZKUAMP-LLVKDONJSA-N 0 0 321.342 5.146 20 0 DKADRN CC(C)CCC(=O)Nc1ccccc1-c1cc(F)c(F)c(F)c1 ZINC000474739503 339424671 /nfs/dbraw/zinc/42/46/71/339424671.db2.gz WBIHAPWOSUAGMM-UHFFFAOYSA-N 0 0 321.342 5.146 20 0 DKADRN CC(C)[C@H](C)C(=O)Nc1ccccc1-c1cc(F)c(F)c(F)c1 ZINC000474750007 339424896 /nfs/dbraw/zinc/42/48/96/339424896.db2.gz NGHCRBNXJJDOAZ-NSHDSACASA-N 0 0 321.342 5.002 20 0 DKADRN Cc1c(COC(C)(C)C)cccc1NC(=O)[C@@H]1CCC[C@@H](C)C1 ZINC000474762825 339425272 /nfs/dbraw/zinc/42/52/72/339425272.db2.gz MPFZRLGEOBSEIS-GDBMZVCRSA-N 0 0 317.473 5.075 20 0 DKADRN Cc1c(COC(C)(C)C)cccc1NC(=O)[C@@H]1CCC[C@H](C)C1 ZINC000474762826 339425290 /nfs/dbraw/zinc/42/52/90/339425290.db2.gz MPFZRLGEOBSEIS-GOEBONIOSA-N 0 0 317.473 5.075 20 0 DKADRN CSc1ccc(NC(=O)c2ccccc2SC)cc1Cl ZINC000474774576 339425599 /nfs/dbraw/zinc/42/55/99/339425599.db2.gz KCGKWCWUYJQZKJ-UHFFFAOYSA-N 0 0 323.870 5.036 20 0 DKADRN CCC(C)(C)CC(=O)Nc1cccc(COC(C)(C)C)c1C ZINC000474774782 339425583 /nfs/dbraw/zinc/42/55/83/339425583.db2.gz QGZDJMMAWBIALJ-UHFFFAOYSA-N 0 0 305.462 5.075 20 0 DKADRN CCC[C@H](C)CC(=O)Nc1cccc(COC(C)(C)C)c1C ZINC000474775787 339425534 /nfs/dbraw/zinc/42/55/34/339425534.db2.gz UMRPKBFISPQZKG-AWEZNQCLSA-N 0 0 305.462 5.075 20 0 DKADRN O=C([C@H]1CC12CCCC2)N1CCC[C@H]1c1cccc2ccccc21 ZINC000474841852 339428698 /nfs/dbraw/zinc/42/86/98/339428698.db2.gz LEZUOZAUBYAFCG-UXHICEINSA-N 0 0 319.448 5.084 20 0 DKADRN Cc1cccc(C)c1C(=O)Nc1cccc(CCC(F)(F)F)c1 ZINC000474963170 339433567 /nfs/dbraw/zinc/43/35/67/339433567.db2.gz WKHSEMULRWMLET-UHFFFAOYSA-N 0 0 321.342 5.051 20 0 DKADRN Cc1ccc(C)c([C@H]2CCCN2C(=O)C[C@H](C)c2ccccc2)c1 ZINC000474980412 339434280 /nfs/dbraw/zinc/43/42/80/339434280.db2.gz DXVZYRVUTAPIIT-GHTZIAJQSA-N 0 0 321.464 5.161 20 0 DKADRN Cc1ccc(C)c([C@@H]2CCCN2C(=O)C[C@H](C)c2ccccc2)c1 ZINC000474980414 339434220 /nfs/dbraw/zinc/43/42/20/339434220.db2.gz DXVZYRVUTAPIIT-RXVVDRJESA-N 0 0 321.464 5.161 20 0 DKADRN Cc1ccc(Cl)c(NC(=O)[C@H](C)c2ccc(Cl)s2)c1 ZINC000475003674 339435001 /nfs/dbraw/zinc/43/50/01/339435001.db2.gz XGUDXQSWIHSVOO-SECBINFHSA-N 0 0 314.237 5.106 20 0 DKADRN Cc1ccc(Cl)c(NC(=O)c2ccc3sccc3c2)c1 ZINC000475003876 339434999 /nfs/dbraw/zinc/43/49/99/339434999.db2.gz PWOQMYDDDPKVJY-UHFFFAOYSA-N 0 0 301.798 5.115 20 0 DKADRN Cc1ccc(Cl)c(NC(=O)N(Cc2cccs2)C(C)C)c1 ZINC000475033665 339436064 /nfs/dbraw/zinc/43/60/64/339436064.db2.gz SZPBNWWHQAROBT-UHFFFAOYSA-N 0 0 322.861 5.152 20 0 DKADRN Cc1cc(C)c(NC(=O)c2cc(C)c(Cl)cc2C)c(C)c1 ZINC000475034680 339436237 /nfs/dbraw/zinc/43/62/37/339436237.db2.gz WLRWITILBPGFLQ-UHFFFAOYSA-N 0 0 301.817 5.134 20 0 DKADRN Cc1ccc([C@H](C)N(C)C(=O)Nc2cc(C)ccc2Cl)cc1 ZINC000475037267 339436247 /nfs/dbraw/zinc/43/62/47/339436247.db2.gz CCGZPHUVBLJAGF-AWEZNQCLSA-N 0 0 316.832 5.182 20 0 DKADRN Cc1ccc([C@@H](C)N(C)C(=O)Nc2cc(C)ccc2Cl)cc1 ZINC000475037269 339436294 /nfs/dbraw/zinc/43/62/94/339436294.db2.gz CCGZPHUVBLJAGF-CQSZACIVSA-N 0 0 316.832 5.182 20 0 DKADRN CC[C@H](c1ccc(F)cc1)[S@](=O)c1ccc2ccccc2c1 ZINC000475045862 339436677 /nfs/dbraw/zinc/43/66/77/339436677.db2.gz CLLHJSCXCLDLFK-DENIHFKCSA-N 0 0 312.409 5.238 20 0 DKADRN CC[C@H](c1ccc(F)cc1)[S@@](=O)c1ccc2ccccc2c1 ZINC000475045868 339436742 /nfs/dbraw/zinc/43/67/42/339436742.db2.gz CLLHJSCXCLDLFK-KNQAVFIVSA-N 0 0 312.409 5.238 20 0 DKADRN CC[C@@H](c1ccc(F)cc1)[S@](=O)c1ccc2ccccc2c1 ZINC000475045870 339436908 /nfs/dbraw/zinc/43/69/08/339436908.db2.gz CLLHJSCXCLDLFK-SIKLNZKXSA-N 0 0 312.409 5.238 20 0 DKADRN CC[C@@H](c1ccc(F)cc1)[S@@](=O)c1ccc2ccccc2c1 ZINC000475045871 339436883 /nfs/dbraw/zinc/43/68/83/339436883.db2.gz CLLHJSCXCLDLFK-UGKGYDQZSA-N 0 0 312.409 5.238 20 0 DKADRN Cc1cccc(C(C)C)c1NC(=O)C/C=C\c1ccc(F)cc1 ZINC000475118570 339439242 /nfs/dbraw/zinc/43/92/42/339439242.db2.gz AMNGDNSLZOLMON-ALCCZGGFSA-N 0 0 311.400 5.300 20 0 DKADRN CN(C(=O)c1coc2cc(F)ccc12)c1cccc2ccccc21 ZINC000475125062 339439286 /nfs/dbraw/zinc/43/92/86/339439286.db2.gz NHXXDEXUWPUOIS-UHFFFAOYSA-N 0 0 319.335 5.002 20 0 DKADRN CO[C@@H](C)c1cccc(NCc2csc(CCC(C)C)n2)c1 ZINC000475150578 339440061 /nfs/dbraw/zinc/44/00/61/339440061.db2.gz JUVIWAHXLJWVGP-AWEZNQCLSA-N 0 0 318.486 5.051 20 0 DKADRN CO[C@H](C)c1cccc(NCc2csc(CCC(C)C)n2)c1 ZINC000475150579 339440027 /nfs/dbraw/zinc/44/00/27/339440027.db2.gz JUVIWAHXLJWVGP-CQSZACIVSA-N 0 0 318.486 5.051 20 0 DKADRN CC(C)c1ccccc1NCc1ncc(-c2cccc(F)c2)o1 ZINC000475179732 339440678 /nfs/dbraw/zinc/44/06/78/339440678.db2.gz BQHFRLFPXJIOOF-UHFFFAOYSA-N 0 0 310.372 5.216 20 0 DKADRN C[C@H](C(=O)Nc1ccccc1Cc1ccccc1)c1ccccc1 ZINC000475279527 339443550 /nfs/dbraw/zinc/44/35/50/339443550.db2.gz KBBBZOWRFJLBFY-KRWDZBQOSA-N 0 0 315.416 5.020 20 0 DKADRN CCN(C(=O)[C@H](C)c1ccccc1)[C@@H](C)c1cc2ccccc2o1 ZINC000475326923 339446464 /nfs/dbraw/zinc/44/64/64/339446464.db2.gz GBBAGGMNJSJZEX-CVEARBPZSA-N 0 0 321.420 5.146 20 0 DKADRN CCN(C(=O)[C@@H](C)c1ccccc1)[C@@H](C)c1cc2ccccc2o1 ZINC000475326924 339446492 /nfs/dbraw/zinc/44/64/92/339446492.db2.gz GBBAGGMNJSJZEX-HOTGVXAUSA-N 0 0 321.420 5.146 20 0 DKADRN CCN(C(=O)[C@H](C)c1ccccc1)[C@H](C)c1cc2ccccc2o1 ZINC000475326925 339446472 /nfs/dbraw/zinc/44/64/72/339446472.db2.gz GBBAGGMNJSJZEX-HZPDHXFCSA-N 0 0 321.420 5.146 20 0 DKADRN Cc1noc(C)c1CNc1cc(-c2ccccc2)ccc1Cl ZINC000475349994 339448591 /nfs/dbraw/zinc/44/85/91/339448591.db2.gz IEBLKIKAXCVBGB-UHFFFAOYSA-N 0 0 312.800 5.224 20 0 DKADRN Clc1ccc(-c2ccccc2)cc1NCc1cncs1 ZINC000475352762 339448697 /nfs/dbraw/zinc/44/86/97/339448697.db2.gz IYIJZTFOGXAYKC-UHFFFAOYSA-N 0 0 300.814 5.076 20 0 DKADRN C[C@@H](CC(C)(C)C)C(=O)N1CCC[C@@H]1c1cccc(Cl)c1 ZINC000475364690 339449219 /nfs/dbraw/zinc/44/92/19/339449219.db2.gz AGTBWYSWTAZTAJ-XJKSGUPXSA-N 0 0 307.865 5.076 20 0 DKADRN Cc1ccc2nc(C)c(C(=O)Nc3cc(C)ccc3Cl)cc2c1 ZINC000475365857 339449456 /nfs/dbraw/zinc/44/94/56/339449456.db2.gz BVEVPJATNGHEBK-UHFFFAOYSA-N 0 0 324.811 5.066 20 0 DKADRN C[C@@H](CC(C)(C)C)C(=O)N1CCC[C@H]1c1ccc(Cl)cc1 ZINC000475391354 339450271 /nfs/dbraw/zinc/45/02/71/339450271.db2.gz XYMDFSWAJDMIPM-BBRMVZONSA-N 0 0 307.865 5.076 20 0 DKADRN C[C@H](CC(C)(C)C)C(=O)N1CCC[C@H]1c1ccc(Cl)cc1 ZINC000475391355 339450252 /nfs/dbraw/zinc/45/02/52/339450252.db2.gz XYMDFSWAJDMIPM-CJNGLKHVSA-N 0 0 307.865 5.076 20 0 DKADRN Cc1ccc(Cl)c(NC(=O)c2[nH]c3ccccc3c2Cl)c1 ZINC000475475358 339451845 /nfs/dbraw/zinc/45/18/45/339451845.db2.gz WVVGQSJGGJLDHP-UHFFFAOYSA-N 0 0 319.191 5.035 20 0 DKADRN Cc1cc(C(=O)Nc2cccc(C(F)F)c2)c(C)cc1Cl ZINC000475523476 339454075 /nfs/dbraw/zinc/45/40/75/339454075.db2.gz DDUPPTFOWRVJCP-UHFFFAOYSA-N 0 0 309.743 5.147 20 0 DKADRN C[C@@H](N[C@@H](C)c1c(F)cccc1F)c1cc2cccc(F)c2o1 ZINC000475721035 339460338 /nfs/dbraw/zinc/46/03/38/339460338.db2.gz FHPGEIHBASPBBK-MNOVXSKESA-N 0 0 319.326 5.262 20 0 DKADRN C[C@H](N[C@@H](C)c1c(F)cccc1F)c1cc2cccc(F)c2o1 ZINC000475721038 339460323 /nfs/dbraw/zinc/46/03/23/339460323.db2.gz FHPGEIHBASPBBK-QWRGUYRKSA-N 0 0 319.326 5.262 20 0 DKADRN C[C@@H](N[C@@H](C)c1cc2cccc(F)c2o1)c1c(F)cccc1F ZINC000475721041 339460334 /nfs/dbraw/zinc/46/03/34/339460334.db2.gz FHPGEIHBASPBBK-WDEREUQCSA-N 0 0 319.326 5.262 20 0 DKADRN Cc1cc(NC(=O)c2cccc(C(F)F)c2)ccc1C1CC1 ZINC000475860962 339463067 /nfs/dbraw/zinc/46/30/67/339463067.db2.gz GEONRNNQLKMCGC-UHFFFAOYSA-N 0 0 301.336 5.062 20 0 DKADRN Cc1cc(C(=O)Nc2ccc(C3CC3)c(C)c2)c(C(F)(F)F)o1 ZINC000475867967 339463256 /nfs/dbraw/zinc/46/32/56/339463256.db2.gz RVJPFQVTEUUQPA-UHFFFAOYSA-N 0 0 323.314 5.045 20 0 DKADRN Cc1cc(NC(=O)c2cc(F)c(F)cc2Cl)ccc1C1CC1 ZINC000475868408 339463201 /nfs/dbraw/zinc/46/32/01/339463201.db2.gz VYRXYXJVOGQMAI-UHFFFAOYSA-N 0 0 321.754 5.056 20 0 DKADRN C[C@@H](SCCCCS[C@H](C)C(F)(F)F)C(F)(F)F ZINC000475874370 339463477 /nfs/dbraw/zinc/46/34/77/339463477.db2.gz NMGILEAXZARVTR-HTQZYQBOSA-N 0 0 314.360 5.135 20 0 DKADRN C[C@@H](SCCCCS[C@@H](C)C(F)(F)F)C(F)(F)F ZINC000475874371 339463499 /nfs/dbraw/zinc/46/34/99/339463499.db2.gz NMGILEAXZARVTR-OCAPTIKFSA-N 0 0 314.360 5.135 20 0 DKADRN C[C@H](SCCCCS[C@@H](C)C(F)(F)F)C(F)(F)F ZINC000475874372 339463489 /nfs/dbraw/zinc/46/34/89/339463489.db2.gz NMGILEAXZARVTR-YUMQZZPRSA-N 0 0 314.360 5.135 20 0 DKADRN Cc1cc2c(ncnc2SCc2cccc(C(F)F)c2)s1 ZINC000475885808 339463937 /nfs/dbraw/zinc/46/39/37/339463937.db2.gz ZDLJMZDLRWLGEG-UHFFFAOYSA-N 0 0 322.405 5.230 20 0 DKADRN C[C@H](CS[C@@H](C)c1nnc(-c2ccccc2)o1)c1ccccc1 ZINC000475893329 339464274 /nfs/dbraw/zinc/46/42/74/339464274.db2.gz VVYTWSBEQGFEMA-CABCVRRESA-N 0 0 324.449 5.335 20 0 DKADRN C[C@@H](CS[C@H](C)c1nnc(-c2ccccc2)o1)c1ccccc1 ZINC000475893332 339464270 /nfs/dbraw/zinc/46/42/70/339464270.db2.gz VVYTWSBEQGFEMA-LSDHHAIUSA-N 0 0 324.449 5.335 20 0 DKADRN CC(C)[C@H]1C[C@@H]1C(=O)Nc1ccc(N[C@@H](C)c2ccccc2)cc1 ZINC000475908916 339464705 /nfs/dbraw/zinc/46/47/05/339464705.db2.gz XJUFFXNIVFABMF-BEVDRBHNSA-N 0 0 322.452 5.090 20 0 DKADRN Cc1nc(C(C)C)sc1[C@@H](C)N(C)C(=O)C(C)(C)CC(C)C ZINC000475913980 339464862 /nfs/dbraw/zinc/46/48/62/339464862.db2.gz CGBSSJXMTOBKBN-CQSZACIVSA-N 0 0 324.534 5.167 20 0 DKADRN CCCC(CCC)C(=O)N(C)[C@@H](C)c1sc(C(C)C)nc1C ZINC000475918311 339464928 /nfs/dbraw/zinc/46/49/28/339464928.db2.gz LKNARJZASYEPES-AWEZNQCLSA-N 0 0 324.534 5.311 20 0 DKADRN CCC1(C(=O)N(C)[C@H](C)c2sc(C(C)C)nc2C)CCCC1 ZINC000475924591 339465033 /nfs/dbraw/zinc/46/50/33/339465033.db2.gz DTUMYVVVJMHPKU-CQSZACIVSA-N 0 0 322.518 5.065 20 0 DKADRN CCCC1(C(=O)N(C)[C@@H](C)c2sc(C(C)C)nc2C)CCC1 ZINC000475927742 339465083 /nfs/dbraw/zinc/46/50/83/339465083.db2.gz RSSBUQMMPGKUPR-AWEZNQCLSA-N 0 0 322.518 5.065 20 0 DKADRN CCCC1(C(=O)N(C)[C@H](C)c2sc(C(C)C)nc2C)CCC1 ZINC000475927743 339465091 /nfs/dbraw/zinc/46/50/91/339465091.db2.gz RSSBUQMMPGKUPR-CQSZACIVSA-N 0 0 322.518 5.065 20 0 DKADRN FC(F)c1cccc(CSc2nnc(-c3cccs3)o2)c1 ZINC000475941032 339465526 /nfs/dbraw/zinc/46/55/26/339465526.db2.gz SARHCNCVRJCEEB-UHFFFAOYSA-N 0 0 324.377 5.028 20 0 DKADRN CCC[C@H](CC)NC(=O)Nc1cccc(COC(C)(C)C)c1C ZINC000475969792 339466624 /nfs/dbraw/zinc/46/66/24/339466624.db2.gz BMQYZMSTVVMAQC-INIZCTEOSA-N 0 0 320.477 5.010 20 0 DKADRN Cc1nccc(CS[C@H](C)c2ccc(Cl)c(Cl)c2)n1 ZINC000475981716 339466948 /nfs/dbraw/zinc/46/69/48/339466948.db2.gz FFNCXIOJJSCHKA-SECBINFHSA-N 0 0 313.253 5.086 20 0 DKADRN CCCC(C)(C)NC(=O)Nc1cccc(COC(C)(C)C)c1C ZINC000475991621 339467042 /nfs/dbraw/zinc/46/70/42/339467042.db2.gz RPFLKBLKSMZLEL-UHFFFAOYSA-N 0 0 320.477 5.010 20 0 DKADRN FC(F)c1cccc(CSc2cccc3cccnc32)c1 ZINC000475999891 339467177 /nfs/dbraw/zinc/46/71/77/339467177.db2.gz SSONMRDSIOCZTC-UHFFFAOYSA-N 0 0 301.361 5.465 20 0 DKADRN C[C@H](C(=O)Nc1cccc(Nc2ccccc2)c1)c1ccccc1 ZINC000476027862 339467552 /nfs/dbraw/zinc/46/75/52/339467552.db2.gz XPNRAGKDHPMNHH-INIZCTEOSA-N 0 0 316.404 5.172 20 0 DKADRN C[C@@H](C(=O)Nc1cccc(Nc2ccccc2)c1)c1ccccc1 ZINC000476027863 339467540 /nfs/dbraw/zinc/46/75/40/339467540.db2.gz XPNRAGKDHPMNHH-MRXNPFEDSA-N 0 0 316.404 5.172 20 0 DKADRN CCSc1cccc(NC(=O)c2c(C)c(F)ccc2Cl)c1 ZINC000476061904 339468205 /nfs/dbraw/zinc/46/82/05/339468205.db2.gz PJMZLVZNZSSZKN-UHFFFAOYSA-N 0 0 323.820 5.152 20 0 DKADRN C[C@H](Nc1nccc2occc21)c1ccc(-c2cccnc2)cc1 ZINC000476188354 339470942 /nfs/dbraw/zinc/47/09/42/339470942.db2.gz IKCUIGCMYLPTQI-AWEZNQCLSA-N 0 0 315.376 5.063 20 0 DKADRN C[C@@H](Nc1nccc2occc21)c1ccc(-c2cccnc2)cc1 ZINC000476188356 339470935 /nfs/dbraw/zinc/47/09/35/339470935.db2.gz IKCUIGCMYLPTQI-CQSZACIVSA-N 0 0 315.376 5.063 20 0 DKADRN Cc1cc(C(=O)Nc2c(C)cccc2Cl)c(C)cc1Cl ZINC000476216548 339471454 /nfs/dbraw/zinc/47/14/54/339471454.db2.gz HHNRRNPGZQPESV-UHFFFAOYSA-N 0 0 308.208 5.171 20 0 DKADRN CCC[C@@](C)(CC)C(=O)N[C@@H](C)c1ccc(-c2ccncc2)cc1 ZINC000476217394 339471431 /nfs/dbraw/zinc/47/14/31/339471431.db2.gz LARNGMRJYKRCHG-HRAATJIYSA-N 0 0 324.468 5.142 20 0 DKADRN CCC[C@](C)(CC)C(=O)N[C@H](C)c1ccc(-c2ccncc2)cc1 ZINC000476217397 339471410 /nfs/dbraw/zinc/47/14/10/339471410.db2.gz LARNGMRJYKRCHG-IERDGZPVSA-N 0 0 324.468 5.142 20 0 DKADRN CCC[C@@](C)(CC)C(=O)N[C@H](C)c1ccc(-c2ccncc2)cc1 ZINC000476217400 339471438 /nfs/dbraw/zinc/47/14/38/339471438.db2.gz LARNGMRJYKRCHG-IIBYNOLFSA-N 0 0 324.468 5.142 20 0 DKADRN CCC[C@](C)(CC)C(=O)N[C@@H](C)c1ccc(-c2ccncc2)cc1 ZINC000476217403 339471479 /nfs/dbraw/zinc/47/14/79/339471479.db2.gz LARNGMRJYKRCHG-KKSFZXQISA-N 0 0 324.468 5.142 20 0 DKADRN CCC[C@](C)(CC)C(=O)N[C@H](C)c1ccc(-c2cccnc2)cc1 ZINC000476234107 339471833 /nfs/dbraw/zinc/47/18/33/339471833.db2.gz IKVSOMUKBLXZRN-IERDGZPVSA-N 0 0 324.468 5.142 20 0 DKADRN CCC[C@@](C)(CC)C(=O)N[C@H](C)c1ccc(-c2cccnc2)cc1 ZINC000476234109 339471819 /nfs/dbraw/zinc/47/18/19/339471819.db2.gz IKVSOMUKBLXZRN-IIBYNOLFSA-N 0 0 324.468 5.142 20 0 DKADRN CCC[C@](C)(CC)C(=O)N[C@@H](C)c1ccc(-c2cccnc2)cc1 ZINC000476234110 339471791 /nfs/dbraw/zinc/47/17/91/339471791.db2.gz IKVSOMUKBLXZRN-KKSFZXQISA-N 0 0 324.468 5.142 20 0 DKADRN Cc1cccc(C(C)C)c1NC(=O)c1coc2cc(F)ccc12 ZINC000476237235 339471986 /nfs/dbraw/zinc/47/19/86/339471986.db2.gz WNEVNGWVMOJGSA-UHFFFAOYSA-N 0 0 311.356 5.256 20 0 DKADRN C[C@H](CC(C)(C)C)C(=O)Nc1cccc(C(F)F)c1Cl ZINC000476247853 339472226 /nfs/dbraw/zinc/47/22/26/339472226.db2.gz FWKPNEDVBZIHJV-SECBINFHSA-N 0 0 303.780 5.288 20 0 DKADRN C[C@@H](CC(C)(C)C)C(=O)Nc1cccc(C(F)F)c1Cl ZINC000476247867 339472232 /nfs/dbraw/zinc/47/22/32/339472232.db2.gz FWKPNEDVBZIHJV-VIFPVBQESA-N 0 0 303.780 5.288 20 0 DKADRN C[C@@H](C(=O)Nc1cccc(C(F)F)c1Cl)c1ccccc1 ZINC000476254264 339472417 /nfs/dbraw/zinc/47/24/17/339472417.db2.gz NLSRFEZUTYRONO-SNVBAGLBSA-N 0 0 309.743 5.020 20 0 DKADRN CC1(C)CCC[C@H]1C(=O)Nc1cccc(C(F)F)c1Cl ZINC000476254491 339472404 /nfs/dbraw/zinc/47/24/04/339472404.db2.gz OWDLECASRVWKPF-JTQLQIEISA-N 0 0 301.764 5.042 20 0 DKADRN CCC(C)(C)OCc1ccccc1NC(=O)[C@@H]1CCCC1(C)C ZINC000476274107 339473100 /nfs/dbraw/zinc/47/31/00/339473100.db2.gz DCQQQKUUEYJDKQ-INIZCTEOSA-N 0 0 317.473 5.157 20 0 DKADRN CCC(C)(C)OCc1ccccc1NC(=O)[C@H]1CCCC1(C)C ZINC000476274109 339473081 /nfs/dbraw/zinc/47/30/81/339473081.db2.gz DCQQQKUUEYJDKQ-MRXNPFEDSA-N 0 0 317.473 5.157 20 0 DKADRN Cc1nc(C(C)C)sc1[C@@H](C)N(C)C(=O)[C@@H](C)CC(C)(C)C ZINC000476274609 339473070 /nfs/dbraw/zinc/47/30/70/339473070.db2.gz HTTCMPANVBVBPO-GXTWGEPZSA-N 0 0 324.534 5.167 20 0 DKADRN Cc1nc(C(C)C)sc1[C@H](C)N(C)C(=O)[C@H](C)CC(C)(C)C ZINC000476274615 339473068 /nfs/dbraw/zinc/47/30/68/339473068.db2.gz HTTCMPANVBVBPO-OCCSQVGLSA-N 0 0 324.534 5.167 20 0 DKADRN Cc1nc(C(C)C)sc1[C@@H](C)N(C)C(=O)[C@H](C)CC(C)(C)C ZINC000476274618 339473093 /nfs/dbraw/zinc/47/30/93/339473093.db2.gz HTTCMPANVBVBPO-TZMCWYRMSA-N 0 0 324.534 5.167 20 0 DKADRN CCC[C@](C)(CC)C(=O)Nc1ccc(C)c(-c2nc(C)co2)c1 ZINC000476339482 339474717 /nfs/dbraw/zinc/47/47/17/339474717.db2.gz DVMMOYWZUSSWSF-IBGZPJMESA-N 0 0 314.429 5.113 20 0 DKADRN COc1ccccc1[C@@H](C)S[C@H](C)c1ncc(C(C)(C)C)o1 ZINC000476457079 339476691 /nfs/dbraw/zinc/47/66/91/339476691.db2.gz HJICQJRNBSYHQN-CHWSQXEVSA-N 0 0 319.470 5.536 20 0 DKADRN COc1ccccc1[C@H](C)S[C@@H](C)c1ncc(C(C)(C)C)o1 ZINC000476457082 334935761 /nfs/dbraw/zinc/93/57/61/334935761.db2.gz HJICQJRNBSYHQN-STQMWFEESA-N 0 0 319.470 5.536 20 0 DKADRN CC(C)(C)c1ccccc1NC(=O)N1CC[C@H](c2ccccc2)C1 ZINC000476457264 339476743 /nfs/dbraw/zinc/47/67/43/339476743.db2.gz GENPBKQDPZQWQU-KRWDZBQOSA-N 0 0 322.452 5.006 20 0 DKADRN CC1(C)CCCN1C(=O)c1ccc(-c2ccc(Cl)cc2)s1 ZINC000476462095 339476853 /nfs/dbraw/zinc/47/68/53/339476853.db2.gz PEZABHHRLHUSRE-UHFFFAOYSA-N 0 0 319.857 5.083 20 0 DKADRN CO[C@@H](C)c1nc(CS[C@@H]2CCCc3ccccc32)cs1 ZINC000476470864 339477073 /nfs/dbraw/zinc/47/70/73/339477073.db2.gz KDGKZPGFSFMEMQ-BLLLJJGKSA-N 0 0 319.495 5.161 20 0 DKADRN Fc1cccc(-c2cnc(CSc3ccc(F)c(F)c3)o2)c1 ZINC000476474511 339476989 /nfs/dbraw/zinc/47/69/89/339476989.db2.gz YTDUOJQNYMQKAM-UHFFFAOYSA-N 0 0 321.323 5.051 20 0 DKADRN O=C(Nc1ccsc1)N(Cc1ccc2ccccc2c1)C1CC1 ZINC000476475657 339477124 /nfs/dbraw/zinc/47/71/24/339477124.db2.gz IGFGCIMSTZYTJZ-UHFFFAOYSA-N 0 0 322.433 5.098 20 0 DKADRN C[C@H](c1ccc(Cl)cc1)N(C(=O)Nc1ccsc1)C1CC1 ZINC000476476512 339477122 /nfs/dbraw/zinc/47/71/22/339477122.db2.gz ORVDMJSBVIPIRV-LLVKDONJSA-N 0 0 320.845 5.159 20 0 DKADRN C[C@@H](c1ccc(Cl)cc1)[C@H](C)N(C)C(=O)Nc1ccsc1 ZINC000476479819 339477223 /nfs/dbraw/zinc/47/72/23/339477223.db2.gz GKIOPCQPGYYIBU-NEPJUHHUSA-N 0 0 322.861 5.057 20 0 DKADRN C[C@H](c1ccc(Cl)cc1)[C@H](C)N(C)C(=O)Nc1ccsc1 ZINC000476479825 339477275 /nfs/dbraw/zinc/47/72/75/339477275.db2.gz GKIOPCQPGYYIBU-RYUDHWBXSA-N 0 0 322.861 5.057 20 0 DKADRN Cc1cccc([C@@H]2CCCCN2C(=O)Nc2ccsc2)c1C ZINC000476480673 339477202 /nfs/dbraw/zinc/47/72/02/339477202.db2.gz DSYNHJXTYCNJGB-KRWDZBQOSA-N 0 0 314.454 5.124 20 0 DKADRN C[C@@H](c1ccccc1)N(CC1CCC1)C(=O)Nc1ccsc1 ZINC000476484529 339477371 /nfs/dbraw/zinc/47/73/71/339477371.db2.gz SNBKOJMZHRBKCW-AWEZNQCLSA-N 0 0 314.454 5.143 20 0 DKADRN C[C@H](c1ccccc1)N(CC1CCC1)C(=O)Nc1ccsc1 ZINC000476484531 339477372 /nfs/dbraw/zinc/47/73/72/339477372.db2.gz SNBKOJMZHRBKCW-CQSZACIVSA-N 0 0 314.454 5.143 20 0 DKADRN Cc1c(CSC(C)C)cccc1NC(=O)Nc1ccsc1 ZINC000476485517 339477476 /nfs/dbraw/zinc/47/74/76/339477476.db2.gz PIJGLQBKLRXPMH-UHFFFAOYSA-N 0 0 320.483 5.342 20 0 DKADRN C[C@H](Sc1cccc2cccnc21)c1ncc(C(C)(C)C)o1 ZINC000476489147 339477413 /nfs/dbraw/zinc/47/74/13/339477413.db2.gz VUKJIZZZCAHNMI-LBPRGKRZSA-N 0 0 312.438 5.374 20 0 DKADRN CC1(C)CCCN1C(=O)c1cc2sc3ccccc3c2s1 ZINC000476490225 339477414 /nfs/dbraw/zinc/47/74/14/339477414.db2.gz HGCAKKLSEUQPBX-UHFFFAOYSA-N 0 0 315.463 5.131 20 0 DKADRN Cc1ccc2oc(S[C@H](C)c3ncc(C(C)(C)C)o3)nc2c1 ZINC000476492669 339477568 /nfs/dbraw/zinc/47/75/68/339477568.db2.gz VIFHMSSGNGRTEV-LLVKDONJSA-N 0 0 316.426 5.275 20 0 DKADRN Cc1ccc2oc(S[C@@H](C)c3ncc(C(C)(C)C)o3)nc2c1 ZINC000476492672 339477541 /nfs/dbraw/zinc/47/75/41/339477541.db2.gz VIFHMSSGNGRTEV-NSHDSACASA-N 0 0 316.426 5.275 20 0 DKADRN C[C@H](Sc1ccc2ccccc2n1)c1ncc(C(C)(C)C)o1 ZINC000476494720 339477493 /nfs/dbraw/zinc/47/74/93/339477493.db2.gz NYUPOLJYIHXBBY-LBPRGKRZSA-N 0 0 312.438 5.374 20 0 DKADRN Cc1c(F)ccc(Cl)c1C(=O)Nc1cccc2ccsc21 ZINC000476495197 339477573 /nfs/dbraw/zinc/47/75/73/339477573.db2.gz UJGMAJTZIYNBBN-UHFFFAOYSA-N 0 0 319.788 5.255 20 0 DKADRN CCCN(C(=O)Nc1ccsc1)[C@H](CC)c1ccccc1 ZINC000476500451 339477681 /nfs/dbraw/zinc/47/76/81/339477681.db2.gz PAYXRIWORGLEBM-MRXNPFEDSA-N 0 0 302.443 5.143 20 0 DKADRN CO[C@H](C)c1nc(CSc2ccc(C(C)C)cc2)cs1 ZINC000476505252 339477760 /nfs/dbraw/zinc/47/77/60/339477760.db2.gz MAAMXUOKHONZAD-GFCCVEGCSA-N 0 0 307.484 5.266 20 0 DKADRN CO[C@@H](C)c1nc(CSc2ccc(C(C)C)cc2)cs1 ZINC000476505254 339477708 /nfs/dbraw/zinc/47/77/08/339477708.db2.gz MAAMXUOKHONZAD-LBPRGKRZSA-N 0 0 307.484 5.266 20 0 DKADRN CCSCc1cccc(N[C@H](C)c2ncc(C(C)(C)C)o2)c1 ZINC000476507256 339477704 /nfs/dbraw/zinc/47/77/04/339477704.db2.gz AOEZQQFCXFBRRL-CYBMUJFWSA-N 0 0 318.486 5.398 20 0 DKADRN Cc1nc2ccc(N[C@@H](C)c3ncc(C(C)(C)C)o3)cc2s1 ZINC000476507545 339477690 /nfs/dbraw/zinc/47/76/90/339477690.db2.gz KCMQJHSHGJPAHV-JTQLQIEISA-N 0 0 315.442 5.063 20 0 DKADRN CC1(C)CCC[C@H]1C(=O)N1CCCC[C@H]1c1cc2ccccc2[nH]1 ZINC000476537868 339478257 /nfs/dbraw/zinc/47/82/57/339478257.db2.gz PXMYANGYKYCPNO-LPHOPBHVSA-N 0 0 324.468 5.048 20 0 DKADRN CC1(C)CCC[C@H]1C(=O)N1CCCC[C@@H]1c1cc2ccccc2[nH]1 ZINC000476537870 339478269 /nfs/dbraw/zinc/47/82/69/339478269.db2.gz PXMYANGYKYCPNO-QFBILLFUSA-N 0 0 324.468 5.048 20 0 DKADRN c1ccc2c(c1)CCCC[C@@H]2Nc1ccc(-c2cncnc2)cc1 ZINC000476551764 339478542 /nfs/dbraw/zinc/47/85/42/339478542.db2.gz YRDFXHIBIQLHCW-NRFANRHFSA-N 0 0 315.420 5.023 20 0 DKADRN C[C@H](Nc1ccc(C(C)(C)C)cc1)c1ncc(C(C)(C)C)o1 ZINC000476554977 339478535 /nfs/dbraw/zinc/47/85/35/339478535.db2.gz ZFASXZFFEZLLNP-ZDUSSCGKSA-N 0 0 300.446 5.443 20 0 DKADRN CSc1cccc(NC(=O)c2c(C)c(F)ccc2Cl)c1C ZINC000476563034 339478778 /nfs/dbraw/zinc/47/87/78/339478778.db2.gz QLPHZSCCIJSWQP-UHFFFAOYSA-N 0 0 323.820 5.070 20 0 DKADRN Cc1ccc(S[C@H](C)C(=O)c2c(F)cc(F)cc2F)c(C)c1 ZINC000476572904 339478816 /nfs/dbraw/zinc/47/88/16/339478816.db2.gz DDMGDUZREUZBNG-LLVKDONJSA-N 0 0 324.367 5.084 20 0 DKADRN Cc1ccc(C)c(S[C@@H](C)C(=O)c2c(F)cc(F)cc2F)c1 ZINC000476582925 339479054 /nfs/dbraw/zinc/47/90/54/339479054.db2.gz UEHMICHWGXBZSA-NSHDSACASA-N 0 0 324.367 5.084 20 0 DKADRN CSc1ccc(C)c(NC(=O)c2c(C)c(F)ccc2Cl)c1 ZINC000476594047 339479193 /nfs/dbraw/zinc/47/91/93/339479193.db2.gz BROIPJWLQQCGLI-UHFFFAOYSA-N 0 0 323.820 5.070 20 0 DKADRN CCC(C)(C)OCc1ccccc1NC(=O)[C@@H]1C[C@@]1(C)C(C)C ZINC000476662465 339480030 /nfs/dbraw/zinc/48/00/30/339480030.db2.gz OLSAEIYBYKJWOR-JXFKEZNVSA-N 0 0 317.473 5.013 20 0 DKADRN CCC(C)(C)OCc1ccccc1NC(=O)[C@H]1C[C@]1(C)C(C)C ZINC000476662519 339480013 /nfs/dbraw/zinc/48/00/13/339480013.db2.gz OLSAEIYBYKJWOR-OXQOHEQNSA-N 0 0 317.473 5.013 20 0 DKADRN CCC(C)(C)OCc1ccccc1NC(=O)C1=CCCCCC1 ZINC000476663255 339480193 /nfs/dbraw/zinc/48/01/93/339480193.db2.gz PSIUNHRZDFVJTF-UHFFFAOYSA-N 0 0 315.457 5.221 20 0 DKADRN Cc1ccc([C@@H]2[C@H](C)CCCN2C(=O)Nc2ccsc2)cc1 ZINC000476668784 339480315 /nfs/dbraw/zinc/48/03/15/339480315.db2.gz XKNVWADKNFQJGM-PBHICJAKSA-N 0 0 314.454 5.062 20 0 DKADRN Cc1ccc([C@H]2[C@H](C)CCCN2C(=O)Nc2ccsc2)cc1 ZINC000476668797 339480293 /nfs/dbraw/zinc/48/02/93/339480293.db2.gz XKNVWADKNFQJGM-RHSMWYFYSA-N 0 0 314.454 5.062 20 0 DKADRN Cc1ccc([C@H]2[C@@H](C)CCCN2C(=O)Nc2ccsc2)cc1 ZINC000476668800 339480319 /nfs/dbraw/zinc/48/03/19/339480319.db2.gz XKNVWADKNFQJGM-WMLDXEAASA-N 0 0 314.454 5.062 20 0 DKADRN Cc1ccc([C@@H]2[C@@H](C)CCCN2C(=O)Nc2ccsc2)cc1 ZINC000476668802 339480267 /nfs/dbraw/zinc/48/02/67/339480267.db2.gz XKNVWADKNFQJGM-YOEHRIQHSA-N 0 0 314.454 5.062 20 0 DKADRN Cc1cccc([C@H]2CCCCCN2C(=O)Nc2ccsc2)c1 ZINC000476674934 339480403 /nfs/dbraw/zinc/48/04/03/339480403.db2.gz OVDFZHCWKNMRLC-QGZVFWFLSA-N 0 0 314.454 5.206 20 0 DKADRN CCC[C@@](C)(CC)C(=O)Nc1cccc(C(F)F)c1Cl ZINC000476686104 339480655 /nfs/dbraw/zinc/48/06/55/339480655.db2.gz DWDAERDQHVENIR-OAHLLOKOSA-N 0 0 303.780 5.433 20 0 DKADRN CSCc1ccccc1NC(=O)c1cc(C)c(Cl)cc1C ZINC000476720352 339481151 /nfs/dbraw/zinc/48/11/51/339481151.db2.gz SWCIJXLTNQSXNH-UHFFFAOYSA-N 0 0 319.857 5.072 20 0 DKADRN Cc1ccc(S[C@H](C)C(=O)c2c(F)cc(F)cc2F)cc1C ZINC000476727223 339481303 /nfs/dbraw/zinc/48/13/03/339481303.db2.gz GYYOUBUULAVHQD-LLVKDONJSA-N 0 0 324.367 5.084 20 0 DKADRN Cc1ccc([C@H]2CCCCCN2C(=O)[C@H](C)CC(C)(C)C)o1 ZINC000476761826 339481433 /nfs/dbraw/zinc/48/14/33/339481433.db2.gz MEXULYVHDPONME-GDBMZVCRSA-N 0 0 305.462 5.104 20 0 DKADRN Cc1coc2ccc(NC(=O)c3c(C)c(F)ccc3Cl)cc12 ZINC000476828843 339482152 /nfs/dbraw/zinc/48/21/52/339482152.db2.gz XUKQAGNWOIEZHE-UHFFFAOYSA-N 0 0 317.747 5.094 20 0 DKADRN Cc1ccc(C)c([C@@H](C)N(C)C(=O)N[C@H](C)c2ccccc2C)c1 ZINC000476873615 339482544 /nfs/dbraw/zinc/48/25/44/339482544.db2.gz NZRLTAJSQCRKQT-QZTJIDSGSA-N 0 0 324.468 5.075 20 0 DKADRN Cc1ccc(C)c([C@H](C)N(C)C(=O)N[C@@H](C)c2ccccc2C)c1 ZINC000476873616 339482581 /nfs/dbraw/zinc/48/25/81/339482581.db2.gz NZRLTAJSQCRKQT-ROUUACIJSA-N 0 0 324.468 5.075 20 0 DKADRN CO[C@@H](C)c1nc(CS[C@H](C)CCc2ccccc2)cs1 ZINC000476939255 339483066 /nfs/dbraw/zinc/48/30/66/339483066.db2.gz DZLUEVGVQJEQGT-KGLIPLIRSA-N 0 0 321.511 5.105 20 0 DKADRN CO[C@H](C)c1nc(CS[C@H](C)CCc2ccccc2)cs1 ZINC000476939257 339483095 /nfs/dbraw/zinc/48/30/95/339483095.db2.gz DZLUEVGVQJEQGT-ZIAGYGMSSA-N 0 0 321.511 5.105 20 0 DKADRN Cc1sc(-c2ccsc2)nc1-c1c(F)cc(F)cc1F ZINC000476951172 339483404 /nfs/dbraw/zinc/48/34/04/339483404.db2.gz LLLFUYAKCRKPOV-UHFFFAOYSA-N 0 0 311.353 5.264 20 0 DKADRN C[C@@H](SCc1noc(C2CC2)n1)c1ccc2ccccc2c1 ZINC000476953577 339483363 /nfs/dbraw/zinc/48/33/63/339483363.db2.gz SPSWPINQZKAJAA-GFCCVEGCSA-N 0 0 310.422 5.095 20 0 DKADRN Cc1cccc(Cl)c1NC(=O)c1ccc(C(C)(C)C)s1 ZINC000476998166 339484272 /nfs/dbraw/zinc/48/42/72/339484272.db2.gz WKIIOJOULIAQMX-UHFFFAOYSA-N 0 0 307.846 5.260 20 0 DKADRN CCC[C@H](CC)S[C@H](C)C(=O)Nc1c(C)cc(C)cc1C ZINC000477035573 339485052 /nfs/dbraw/zinc/48/50/52/339485052.db2.gz QDOKNVRYNFHBGD-CVEARBPZSA-N 0 0 307.503 5.251 20 0 DKADRN CCC[C@H](CC)S[C@@H](C)C(=O)Nc1c(C)cc(C)cc1C ZINC000477035574 339485046 /nfs/dbraw/zinc/48/50/46/339485046.db2.gz QDOKNVRYNFHBGD-HOTGVXAUSA-N 0 0 307.503 5.251 20 0 DKADRN CCC[C@@H](CC)S[C@H](C)C(=O)Nc1c(C)cc(C)cc1C ZINC000477035575 339485039 /nfs/dbraw/zinc/48/50/39/339485039.db2.gz QDOKNVRYNFHBGD-HZPDHXFCSA-N 0 0 307.503 5.251 20 0 DKADRN CCC[C@@H](CC)S[C@@H](C)C(=O)Nc1c(C)cc(C)cc1C ZINC000477035576 339485038 /nfs/dbraw/zinc/48/50/38/339485038.db2.gz QDOKNVRYNFHBGD-JKSUJKDBSA-N 0 0 307.503 5.251 20 0 DKADRN CCC[C@H](CC)SCC(=O)Nc1c(CC)cccc1CC ZINC000477051806 339485526 /nfs/dbraw/zinc/48/55/26/339485526.db2.gz QUDDOPGHRGUZTK-INIZCTEOSA-N 0 0 307.503 5.062 20 0 DKADRN CCC[C@@H](CC)SCC(=O)Nc1c(CC)cccc1CC ZINC000477051808 334947141 /nfs/dbraw/zinc/94/71/41/334947141.db2.gz QUDDOPGHRGUZTK-MRXNPFEDSA-N 0 0 307.503 5.062 20 0 DKADRN CCC[C@@H](CC)SCc1nnc(-c2ccccc2Cl)o1 ZINC000477052028 339485489 /nfs/dbraw/zinc/48/54/89/339485489.db2.gz XLSILSGVZQKMQW-LLVKDONJSA-N 0 0 310.850 5.202 20 0 DKADRN O=C(Nc1ccccc1-c1cccs1)[C@H]1CC12CCCCC2 ZINC000477063563 339485813 /nfs/dbraw/zinc/48/58/13/339485813.db2.gz JPQZLYFQCDWQPC-OAHLLOKOSA-N 0 0 311.450 5.324 20 0 DKADRN CCC[C@H](CC)SCC(=O)Nc1c(C)cc(C)cc1Cl ZINC000477066761 339485820 /nfs/dbraw/zinc/48/58/20/339485820.db2.gz GIQGEJWVGVOSEN-ZDUSSCGKSA-N 0 0 313.894 5.207 20 0 DKADRN C[C@H](c1ccco1)N(C(=O)c1ccc(C(C)(C)C)s1)C1CC1 ZINC000477071613 339486064 /nfs/dbraw/zinc/48/60/64/339486064.db2.gz VAIUHAGXCTVGEB-GFCCVEGCSA-N 0 0 317.454 5.004 20 0 DKADRN C[C@@H](c1ccco1)N(C(=O)c1ccc(C(C)(C)C)s1)C1CC1 ZINC000477071618 339486087 /nfs/dbraw/zinc/48/60/87/339486087.db2.gz VAIUHAGXCTVGEB-LBPRGKRZSA-N 0 0 317.454 5.004 20 0 DKADRN CO[C@@H](C)c1cccc(NC(=O)c2ccc(C(C)(C)C)s2)c1 ZINC000477078774 339486295 /nfs/dbraw/zinc/48/62/95/339486295.db2.gz XSRFAHBWCGMUAH-LBPRGKRZSA-N 0 0 317.454 5.005 20 0 DKADRN CCC[C@H](CC)SCC(=O)Nc1c(Cl)cccc1Cl ZINC000477090563 339486549 /nfs/dbraw/zinc/48/65/49/339486549.db2.gz RYZORHFNQTZJTD-JTQLQIEISA-N 0 0 320.285 5.244 20 0 DKADRN Cc1cc(O[C@@H](C)c2ccccc2)ccc1NC(=O)[C@H](C)C1CC1 ZINC000477098637 339486860 /nfs/dbraw/zinc/48/68/60/339486860.db2.gz IROQILPIKCAQIP-CVEARBPZSA-N 0 0 323.436 5.120 20 0 DKADRN Cc1cc(O[C@@H](C)c2ccccc2)ccc1NC(=O)[C@@H](C)C1CC1 ZINC000477098641 339486930 /nfs/dbraw/zinc/48/69/30/339486930.db2.gz IROQILPIKCAQIP-HOTGVXAUSA-N 0 0 323.436 5.120 20 0 DKADRN Cc1cc(O[C@H](C)c2ccccc2)ccc1NC(=O)[C@H](C)C1CC1 ZINC000477098647 339486895 /nfs/dbraw/zinc/48/68/95/339486895.db2.gz IROQILPIKCAQIP-HZPDHXFCSA-N 0 0 323.436 5.120 20 0 DKADRN Cc1cc(O[C@H](C)c2ccccc2)ccc1NC(=O)[C@@H](C)C1CC1 ZINC000477098649 339486835 /nfs/dbraw/zinc/48/68/35/339486835.db2.gz IROQILPIKCAQIP-JKSUJKDBSA-N 0 0 323.436 5.120 20 0 DKADRN CC(C)[C@@H](C)N(C(=O)Nc1cc(Cl)ccc1Cl)C1CC1 ZINC000477118619 339487402 /nfs/dbraw/zinc/48/74/02/339487402.db2.gz SATDSCSZGYYMEW-SNVBAGLBSA-N 0 0 315.244 5.034 20 0 DKADRN C[C@@H](C(=O)Nc1ccccc1Oc1ccccc1Cl)C1CC1 ZINC000477152294 339488046 /nfs/dbraw/zinc/48/80/46/339488046.db2.gz QPTDIOCGDVTJFT-GFCCVEGCSA-N 0 0 315.800 5.117 20 0 DKADRN C[C@H](C(=O)Nc1ccccc1Oc1ccccc1Cl)C1CC1 ZINC000477152295 339488028 /nfs/dbraw/zinc/48/80/28/339488028.db2.gz QPTDIOCGDVTJFT-LBPRGKRZSA-N 0 0 315.800 5.117 20 0 DKADRN CC(C)c1ccc(O[C@@H](C)c2nnc(-c3cccs3)o2)cc1 ZINC000477161750 339488348 /nfs/dbraw/zinc/48/83/48/339488348.db2.gz IPBNDHKLSGXMDX-LBPRGKRZSA-N 0 0 314.410 5.062 20 0 DKADRN CC(C)c1ccc(O[C@@H](C)c2nnc(-c3ccccc3)o2)cc1 ZINC000477170079 339488475 /nfs/dbraw/zinc/48/84/75/339488475.db2.gz WRQYMPNNZLXHCX-AWEZNQCLSA-N 0 0 308.381 5.000 20 0 DKADRN Cc1ccc([C@@H]2CCCCCN2C(=O)[C@@H]2CC23CCCCC3)o1 ZINC000477235496 339489918 /nfs/dbraw/zinc/48/99/18/339489918.db2.gz WTCJQTRGNOYPGT-IRXDYDNUSA-N 0 0 315.457 5.002 20 0 DKADRN O=C(Nc1ccccc1-c1ccccc1)c1cc2sccc2[nH]1 ZINC000477307487 339492103 /nfs/dbraw/zinc/49/21/03/339492103.db2.gz KWAIWGJOYGMECB-UHFFFAOYSA-N 0 0 318.401 5.149 20 0 DKADRN Cc1oc(-c2ccccc2)nc1COc1ccc(Cl)cc1F ZINC000477479101 339495426 /nfs/dbraw/zinc/49/54/26/339495426.db2.gz HDVFJUSHKIQFBJ-UHFFFAOYSA-N 0 0 317.747 5.022 20 0 DKADRN Cc1oncc1-c1csc(-c2ccc(Cl)cc2Cl)n1 ZINC000477482824 339495502 /nfs/dbraw/zinc/49/55/02/339495502.db2.gz UFSFJJFQPHRBSV-UHFFFAOYSA-N 0 0 311.193 5.080 20 0 DKADRN O=C(Nc1ccc(Cl)cc1Cl)c1cccc(Cl)c1F ZINC000477495497 339496025 /nfs/dbraw/zinc/49/60/25/339496025.db2.gz RPHYMOHYUDNJOI-UHFFFAOYSA-N 0 0 318.562 5.038 20 0 DKADRN Cc1ccc(-c2cccnc2)cc1NC(=O)C(C)(C)C1CCCC1 ZINC000477512450 339496444 /nfs/dbraw/zinc/49/64/44/339496444.db2.gz CYGYIVHQUCLAII-UHFFFAOYSA-N 0 0 322.452 5.212 20 0 DKADRN Cc1ccc(-c2cccnc2)cc1NC(=O)[C@@H](C)CC(C)(C)C ZINC000477516654 339496531 /nfs/dbraw/zinc/49/65/31/339496531.db2.gz SGAOGVUKRKIQMF-HNNXBMFYSA-N 0 0 310.441 5.068 20 0 DKADRN Cc1ccc(-c2cccnc2)cc1NC(=O)[C@H](C)CC(C)(C)C ZINC000477516655 339496575 /nfs/dbraw/zinc/49/65/75/339496575.db2.gz SGAOGVUKRKIQMF-OAHLLOKOSA-N 0 0 310.441 5.068 20 0 DKADRN Cc1ccc(-c2cccnc2)cc1NC(=O)C(C)(C)CC(C)C ZINC000477516867 339496470 /nfs/dbraw/zinc/49/64/70/339496470.db2.gz UQQAECDIKDHUID-UHFFFAOYSA-N 0 0 310.441 5.068 20 0 DKADRN CC(C)Sc1ccccc1NCc1ccn(C2CCCC2)n1 ZINC000477528849 339496853 /nfs/dbraw/zinc/49/68/53/339496853.db2.gz RZFVWFRLNQAUMX-UHFFFAOYSA-N 0 0 315.486 5.111 20 0 DKADRN Cc1ccc(-c2cccnc2)cc1NC(=O)CCCC(C)(C)C ZINC000477529095 339496859 /nfs/dbraw/zinc/49/68/59/339496859.db2.gz YNYNAIJGFFJEEL-UHFFFAOYSA-N 0 0 310.441 5.212 20 0 DKADRN Cc1csc(CSc2ncc(-c3ccc(Cl)cc3)o2)n1 ZINC000477532992 339496937 /nfs/dbraw/zinc/49/69/37/339496937.db2.gz FDKNRZMOZUSQMB-UHFFFAOYSA-N 0 0 322.842 5.052 20 0 DKADRN CCC[C@@](C)(CC)C(=O)Nc1cc(-c2cccnc2)ccc1C ZINC000477535799 339496942 /nfs/dbraw/zinc/49/69/42/339496942.db2.gz MBKCPRLZQLXPIX-HXUWFJFHSA-N 0 0 310.441 5.212 20 0 DKADRN Cc1ccc(-c2cccnc2)cc1NC(=O)C[C@H](C)C(C)(C)C ZINC000477537223 339497024 /nfs/dbraw/zinc/49/70/24/339497024.db2.gz QKKSDLQFHANDTM-HNNXBMFYSA-N 0 0 310.441 5.068 20 0 DKADRN C/C=C/c1ccc(NC(=O)Nc2cccc(-c3ncco3)c2)cc1 ZINC000477541227 339497044 /nfs/dbraw/zinc/49/70/44/339497044.db2.gz JYGSAEFETRMUOC-DUXPYHPUSA-N 0 0 319.364 5.019 20 0 DKADRN COc1ccccc1[C@H](C)SCc1ccn(C2CCCC2)n1 ZINC000477542175 339497052 /nfs/dbraw/zinc/49/70/52/339497052.db2.gz IKCQXDPPWSWDER-AWEZNQCLSA-N 0 0 316.470 5.001 20 0 DKADRN COc1ccccc1[C@@H](C)SCc1ccn(C2CCCC2)n1 ZINC000477542176 339497053 /nfs/dbraw/zinc/49/70/53/339497053.db2.gz IKCQXDPPWSWDER-CQSZACIVSA-N 0 0 316.470 5.001 20 0 DKADRN CSCCCCC(=O)Nc1cc(-c2ccc(C)o2)ccc1C ZINC000477543159 518173949 /nfs/dbraw/zinc/17/39/49/518173949.db2.gz GIRSPRMRAXXJQH-UHFFFAOYSA-N 0 0 317.454 5.035 20 0 DKADRN Cc1ccc(-c2ccc(C)c(NC(=O)c3sccc3C)c2)o1 ZINC000477543687 339497176 /nfs/dbraw/zinc/49/71/76/339497176.db2.gz NAXWKYWCNRZTDN-UHFFFAOYSA-N 0 0 311.406 5.186 20 0 DKADRN CS[C@H](C)CCC(=O)Nc1cc(-c2ccc(C)o2)ccc1C ZINC000477557092 339497215 /nfs/dbraw/zinc/49/72/15/339497215.db2.gz YUZAMMYMRBSTSA-CQSZACIVSA-N 0 0 317.454 5.034 20 0 DKADRN Cc1ccc(-c2cccnc2)cc1NC(=O)[C@@H](C)CC1CCCC1 ZINC000477561460 339497386 /nfs/dbraw/zinc/49/73/86/339497386.db2.gz SRZHHGCJWCZIGR-INIZCTEOSA-N 0 0 322.452 5.212 20 0 DKADRN CCN(C(=O)c1cc2cc(C)ccc2o1)c1cccc(Cl)c1 ZINC000477562598 339497364 /nfs/dbraw/zinc/49/73/64/339497364.db2.gz JYIBCRZKZCFHFW-UHFFFAOYSA-N 0 0 313.784 5.061 20 0 DKADRN CC[C@@H](CC(=O)Nc1cc(-c2cccnc2)ccc1C)C(C)C 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CC[C@@H](C)n1ncc(N[C@H](CC)c2cc(F)ccc2F)c1C ZINC000477926973 339504839 /nfs/dbraw/zinc/50/48/39/339504839.db2.gz JOOQSGJSHKCWHD-BDJLRTHQSA-N 0 0 307.388 5.004 20 0 DKADRN CC[C@@H](C)n1ncc(N[C@@H](CC)c2cc(F)ccc2F)c1C ZINC000477926974 339504841 /nfs/dbraw/zinc/50/48/41/339504841.db2.gz JOOQSGJSHKCWHD-BZNIZROVSA-N 0 0 307.388 5.004 20 0 DKADRN CC[C@@H](Nc1cnn([C@@H](C)CC)c1C)c1cc(F)ccc1F ZINC000477926975 339504930 /nfs/dbraw/zinc/50/49/30/339504930.db2.gz JOOQSGJSHKCWHD-MEDUHNTESA-N 0 0 307.388 5.004 20 0 DKADRN CCc1c(N[C@H](C)c2ccc(Cl)cn2)cnn1C(CC)CC ZINC000477927183 339504999 /nfs/dbraw/zinc/50/49/99/339504999.db2.gz YYRYGWNJLKMPDL-GFCCVEGCSA-N 0 0 320.868 5.028 20 0 DKADRN CCc1c(N[C@@H](C)c2ccc(Cl)cn2)cnn1C(CC)CC ZINC000477927185 339504944 /nfs/dbraw/zinc/50/49/44/339504944.db2.gz YYRYGWNJLKMPDL-LBPRGKRZSA-N 0 0 320.868 5.028 20 0 DKADRN CCCCn1ncc(N[C@H](C)c2sc(C)nc2C)c1C(C)C ZINC000477930494 339505066 /nfs/dbraw/zinc/50/50/66/339505066.db2.gz AUHUGEVJJFKKJD-CYBMUJFWSA-N 0 0 320.506 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/nfs/dbraw/zinc/51/40/59/339514059.db2.gz YYCXQIPVFIYNPS-UHFFFAOYSA-N 0 0 307.827 5.177 20 0 DKADRN O=C(Nc1cc(F)cc(Cl)c1)c1ccc(Cl)cc1Cl ZINC000478367809 339513646 /nfs/dbraw/zinc/51/36/46/339513646.db2.gz HQFZYCROBXIWPZ-UHFFFAOYSA-N 0 0 318.562 5.038 20 0 DKADRN O=C(Nc1cc(F)cc(Cl)c1)c1cc(Cl)ccc1Cl ZINC000478372185 339514329 /nfs/dbraw/zinc/51/43/29/339514329.db2.gz CEOFSEFNXYANKK-UHFFFAOYSA-N 0 0 318.562 5.038 20 0 DKADRN Clc1ccccc1-c1csc(CNc2ccccc2)n1 ZINC000478385973 339514646 /nfs/dbraw/zinc/51/46/46/339514646.db2.gz IFCXAWJIMRIUKD-UHFFFAOYSA-N 0 0 300.814 5.076 20 0 DKADRN Cc1cc(N[C@@H](C)c2nc(-c3ccccc3)no2)ccc1C1CC1 ZINC000478413133 339514923 /nfs/dbraw/zinc/51/49/23/339514923.db2.gz CPJVKPCPAHWCGN-AWEZNQCLSA-N 0 0 319.408 5.096 20 0 DKADRN Cc1cc(N[C@H](C)c2nc(-c3ccccc3)no2)ccc1C1CC1 ZINC000478413135 339514911 /nfs/dbraw/zinc/51/49/11/339514911.db2.gz CPJVKPCPAHWCGN-CQSZACIVSA-N 0 0 319.408 5.096 20 0 DKADRN C[C@@H](N[C@H](C)c1cccc(Cl)c1F)c1ccc(F)cc1F ZINC000478414060 339515021 /nfs/dbraw/zinc/51/50/21/339515021.db2.gz DJLUONZJVFLIAB-NXEZZACHSA-N 0 0 313.750 5.169 20 0 DKADRN C[C@H](N[C@@H](C)c1cccc(Cl)c1F)c1ccc(F)cc1F ZINC000478414063 339515051 /nfs/dbraw/zinc/51/50/51/339515051.db2.gz DJLUONZJVFLIAB-UWVGGRQHSA-N 0 0 313.750 5.169 20 0 DKADRN C[C@@H](N[C@@H](C)c1cccc(Cl)c1F)c1ccc(F)cc1F ZINC000478414071 339515077 /nfs/dbraw/zinc/51/50/77/339515077.db2.gz DJLUONZJVFLIAB-ZJUUUORDSA-N 0 0 313.750 5.169 20 0 DKADRN CCOCc1cccc(N[C@H](C)c2cccc(Cl)c2F)c1 ZINC000478416789 339515008 /nfs/dbraw/zinc/51/50/08/339515008.db2.gz ZMVCDAUHLXGKCA-GFCCVEGCSA-N 0 0 307.796 5.189 20 0 DKADRN CCOCc1cccc(N[C@@H](C)c2cccc(Cl)c2F)c1 ZINC000478416790 339515056 /nfs/dbraw/zinc/51/50/56/339515056.db2.gz ZMVCDAUHLXGKCA-LBPRGKRZSA-N 0 0 307.796 5.189 20 0 DKADRN CO[C@H](C)c1cccc(N[C@@H](C)c2cccc(Cl)c2F)c1 ZINC000478421875 339515157 /nfs/dbraw/zinc/51/51/57/339515157.db2.gz PTWBEYNJUVPTHU-NWDGAFQWSA-N 0 0 307.796 5.360 20 0 DKADRN CO[C@@H](C)c1cccc(N[C@@H](C)c2cccc(Cl)c2F)c1 ZINC000478421876 339515112 /nfs/dbraw/zinc/51/51/12/339515112.db2.gz PTWBEYNJUVPTHU-RYUDHWBXSA-N 0 0 307.796 5.360 20 0 DKADRN CO[C@H](C)c1cccc(N[C@H](C)c2cccc(Cl)c2F)c1 ZINC000478421877 339515129 /nfs/dbraw/zinc/51/51/29/339515129.db2.gz PTWBEYNJUVPTHU-VXGBXAGGSA-N 0 0 307.796 5.360 20 0 DKADRN C[C@@H](N[C@H](C)c1cccc(Cl)c1F)c1cccc(F)c1F ZINC000478422276 339515184 /nfs/dbraw/zinc/51/51/84/339515184.db2.gz QYSGUKXBWAOPKV-NXEZZACHSA-N 0 0 313.750 5.169 20 0 DKADRN C[C@H](N[C@@H](C)c1cccc(Cl)c1F)c1cccc(F)c1F ZINC000478422277 339515123 /nfs/dbraw/zinc/51/51/23/339515123.db2.gz QYSGUKXBWAOPKV-UWVGGRQHSA-N 0 0 313.750 5.169 20 0 DKADRN C[C@@H](N[C@@H](C)c1cccc(Cl)c1F)c1cccc(F)c1F ZINC000478422278 339515110 /nfs/dbraw/zinc/51/51/10/339515110.db2.gz QYSGUKXBWAOPKV-VHSXEESVSA-N 0 0 313.750 5.169 20 0 DKADRN C[C@@H](N[C@@H](C)c1cccc(F)c1F)c1cccc(Cl)c1F ZINC000478422279 339515200 /nfs/dbraw/zinc/51/52/00/339515200.db2.gz QYSGUKXBWAOPKV-ZJUUUORDSA-N 0 0 313.750 5.169 20 0 DKADRN CC[C@H](C)CC(=O)Nc1cccc(COC(C)(C)CC)c1C ZINC000478496136 339516574 /nfs/dbraw/zinc/51/65/74/339516574.db2.gz JKDVHMQNCCMBGC-AWEZNQCLSA-N 0 0 305.462 5.075 20 0 DKADRN CC[C@@H](C)CC(=O)Nc1cccc(COC(C)(C)CC)c1C ZINC000478496137 339516590 /nfs/dbraw/zinc/51/65/90/339516590.db2.gz JKDVHMQNCCMBGC-CQSZACIVSA-N 0 0 305.462 5.075 20 0 DKADRN CC[C@@H](C)CC(=O)Nc1ccccc1-c1nc2ccccc2s1 ZINC000478560140 339517885 /nfs/dbraw/zinc/51/78/85/339517885.db2.gz NNWRCLQJXOJREY-CYBMUJFWSA-N 0 0 324.449 5.338 20 0 DKADRN Cc1ccc(C(=O)CCCC(=O)Nc2ccccc2C(C)C)cc1 ZINC000478665711 339520300 /nfs/dbraw/zinc/52/03/00/339520300.db2.gz VSGMVHBVMWGMRW-UHFFFAOYSA-N 0 0 323.436 5.110 20 0 DKADRN FCCCSCc1nc(-c2ccccc2Cl)cs1 ZINC000478670430 339520205 /nfs/dbraw/zinc/52/02/05/339520205.db2.gz FGPIJAICARIREW-UHFFFAOYSA-N 0 0 301.839 5.056 20 0 DKADRN Cc1noc(C)c1CCS[C@H](C)c1cccc(Cl)c1F ZINC000478679517 339520452 /nfs/dbraw/zinc/52/04/52/339520452.db2.gz YBVUTSGBFJZXHW-LLVKDONJSA-N 0 0 313.825 5.121 20 0 DKADRN Cc1noc(C)c1CCS[C@@H](C)c1cccc(Cl)c1F ZINC000478679520 339520444 /nfs/dbraw/zinc/52/04/44/339520444.db2.gz YBVUTSGBFJZXHW-NSHDSACASA-N 0 0 313.825 5.121 20 0 DKADRN Cc1coc(S[C@@H](c2ccccc2)c2ccc(F)c(F)c2)n1 ZINC000478708711 339520969 /nfs/dbraw/zinc/52/09/69/339520969.db2.gz BVUALUBFLGWACE-INIZCTEOSA-N 0 0 317.360 5.143 20 0 DKADRN Cc1coc(S[C@H](c2ccccc2)c2ccc(F)c(F)c2)n1 ZINC000478708713 339520967 /nfs/dbraw/zinc/52/09/67/339520967.db2.gz BVUALUBFLGWACE-MRXNPFEDSA-N 0 0 317.360 5.143 20 0 DKADRN Cc1csc(C(=O)Nc2cccc3ccccc32)c1Cl ZINC000478741557 339521653 /nfs/dbraw/zinc/52/16/53/339521653.db2.gz CJZANRPVJRRLEI-UHFFFAOYSA-N 0 0 301.798 5.115 20 0 DKADRN FC(F)c1cccc(COc2cnccc2-c2ccccc2)c1 ZINC000478822229 339523201 /nfs/dbraw/zinc/52/32/01/339523201.db2.gz JJEHPRXRSSIMPQ-UHFFFAOYSA-N 0 0 311.331 5.265 20 0 DKADRN CCCOc1cc(C)ccc1NC(=O)c1scc(C)c1Cl ZINC000478853286 339523721 /nfs/dbraw/zinc/52/37/21/339523721.db2.gz WWHLMNMQNBTAJM-UHFFFAOYSA-N 0 0 323.845 5.059 20 0 DKADRN CC[C@@H](C)CC(=O)N1CCC[C@H]1c1ccc(Cl)c(Cl)c1 ZINC000478870100 339523815 /nfs/dbraw/zinc/52/38/15/339523815.db2.gz RRPXYXTUVNFPHX-ABAIWWIYSA-N 0 0 314.256 5.093 20 0 DKADRN CC[C@@H](C)CC(=O)N1CCC[C@@H]1c1ccc(Cl)c(Cl)c1 ZINC000478870107 339523828 /nfs/dbraw/zinc/52/38/28/339523828.db2.gz RRPXYXTUVNFPHX-IAQYHMDHSA-N 0 0 314.256 5.093 20 0 DKADRN CC[C@H](C)CC(=O)N1CCC[C@H]1c1ccc(Cl)c(Cl)c1 ZINC000478870109 339523824 /nfs/dbraw/zinc/52/38/24/339523824.db2.gz RRPXYXTUVNFPHX-NHYWBVRUSA-N 0 0 314.256 5.093 20 0 DKADRN Cc1ccc(NC(=O)Nc2cc(-c3cccnc3)ccc2C)cc1 ZINC000478901810 339524266 /nfs/dbraw/zinc/52/42/66/339524266.db2.gz NESBUOWCVCYFSX-UHFFFAOYSA-N 0 0 317.392 5.009 20 0 DKADRN Cc1ccccc1NC(=O)Nc1cc(-c2cccnc2)ccc1C ZINC000478902587 339524221 /nfs/dbraw/zinc/52/42/21/339524221.db2.gz PKKDBQOJPVTZGF-UHFFFAOYSA-N 0 0 317.392 5.009 20 0 DKADRN C[C@@H](SCc1ncc(Cl)s1)c1ccc(F)c(F)c1 ZINC000478906692 339524316 /nfs/dbraw/zinc/52/43/16/339524316.db2.gz BHXJXLVUDNLFHZ-SSDOTTSWSA-N 0 0 305.802 5.069 20 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C[C@H](SCc1ncc(Cl)s1)c1cc(F)ccc1F ZINC000478911962 339524445 /nfs/dbraw/zinc/52/44/45/339524445.db2.gz PKYNBNZXSQSDHM-ZETCQYMHSA-N 0 0 305.802 5.069 20 0 DKADRN Clc1cnc(COc2ccccc2-c2ccccc2)s1 ZINC000478936725 339524991 /nfs/dbraw/zinc/52/49/91/339524991.db2.gz LLPCUYRGZCBPTD-UHFFFAOYSA-N 0 0 301.798 5.043 20 0 DKADRN C/C=C\c1ccc(NC(=O)Nc2ccc(-c3ncco3)cc2)cc1 ZINC000478963548 339525311 /nfs/dbraw/zinc/52/53/11/339525311.db2.gz WHGQXPZECXDKOE-IHWYPQMZSA-N 0 0 319.364 5.019 20 0 DKADRN C/C=C/c1ccc(NC(=O)Nc2ccc(-c3ncco3)cc2)cc1 ZINC000478963551 339525303 /nfs/dbraw/zinc/52/53/03/339525303.db2.gz WHGQXPZECXDKOE-NSCUHMNNSA-N 0 0 319.364 5.019 20 0 DKADRN Cc1oc2ccc(NC(=O)c3sccc3C3CC3)cc2c1C ZINC000478981006 339525708 /nfs/dbraw/zinc/52/57/08/339525708.db2.gz VKHYYBQQNRXREL-UHFFFAOYSA-N 0 0 311.406 5.241 20 0 DKADRN Cc1coc2ccc(NC(=O)[C@@H](C)c3ccc(Cl)s3)cc12 ZINC000479035458 339526311 /nfs/dbraw/zinc/52/63/11/339526311.db2.gz RRMLXBJRGUTSMY-JTQLQIEISA-N 0 0 319.813 5.198 20 0 DKADRN Cc1cc(C(=O)Nc2ccc3c(c2)oc2ccccc23)c(C)o1 ZINC000479044346 339526470 /nfs/dbraw/zinc/52/64/70/339526470.db2.gz CFTQLKSLFDAWMP-UHFFFAOYSA-N 0 0 305.333 5.048 20 0 DKADRN O=C(Nc1ccc2c(c1)oc1ccccc12)c1ccc(F)cc1F ZINC000479075479 339527066 /nfs/dbraw/zinc/52/70/66/339527066.db2.gz BUPFTGOGZIUGFM-UHFFFAOYSA-N 0 0 323.298 5.117 20 0 DKADRN CCSc1cccc(NC(=O)c2scc(C)c2Cl)c1 ZINC000479077609 339527129 /nfs/dbraw/zinc/52/71/29/339527129.db2.gz HUYVPUPTKHKGMA-UHFFFAOYSA-N 0 0 311.859 5.074 20 0 DKADRN Cc1csc(C(=O)Nc2ccccc2OC(C)(C)C)c1Cl ZINC000479091568 339527326 /nfs/dbraw/zinc/52/73/26/339527326.db2.gz BZSHPOHAQXNDDR-UHFFFAOYSA-N 0 0 323.845 5.140 20 0 DKADRN Cc1occc1S[C@@H](C)c1nnc(-c2cccc(Cl)c2)o1 ZINC000479104230 339527580 /nfs/dbraw/zinc/52/75/80/339527580.db2.gz LGGQMVKHANCGIL-JTQLQIEISA-N 0 0 320.801 5.145 20 0 DKADRN Cc1occc1S[C@H](C)c1nnc(-c2cccc(Cl)c2)o1 ZINC000479104232 339527565 /nfs/dbraw/zinc/52/75/65/339527565.db2.gz LGGQMVKHANCGIL-SNVBAGLBSA-N 0 0 320.801 5.145 20 0 DKADRN Cc1occc1SCc1coc(-c2ccc(Cl)cc2)n1 ZINC000479105371 339527587 /nfs/dbraw/zinc/52/75/87/339527587.db2.gz SPBGBRODNAJXSP-UHFFFAOYSA-N 0 0 305.786 5.189 20 0 DKADRN Cc1occc1SCc1ccc(C(=O)Nc2ccccc2)cc1 ZINC000479120985 339527840 /nfs/dbraw/zinc/52/78/40/339527840.db2.gz NNAHQPKRONEZNT-UHFFFAOYSA-N 0 0 323.417 5.133 20 0 DKADRN Cc1c(COC(C)(C)C)cccc1NC(=O)[C@H]1CCCC1(C)C ZINC000479123139 339527928 /nfs/dbraw/zinc/52/79/28/339527928.db2.gz ZCSILZALUQRGRQ-MRXNPFEDSA-N 0 0 317.473 5.075 20 0 DKADRN Clc1ccc2c(c1)[C@@H](N[C@@H](c1ccco1)c1ccccc1)CC2 ZINC000479142647 339528128 /nfs/dbraw/zinc/52/81/28/339528128.db2.gz BQQLGWJYSJWORL-AZUAARDMSA-N 0 0 323.823 5.300 20 0 DKADRN Clc1ccc2c(c1)[C@@H](N[C@H](c1ccco1)c1ccccc1)CC2 ZINC000479142648 339528159 /nfs/dbraw/zinc/52/81/59/339528159.db2.gz BQQLGWJYSJWORL-ICSRJNTNSA-N 0 0 323.823 5.300 20 0 DKADRN Clc1ccc2c(c1)[C@H](N[C@H](c1ccco1)c1ccccc1)CC2 ZINC000479142649 339528083 /nfs/dbraw/zinc/52/80/83/339528083.db2.gz BQQLGWJYSJWORL-QUCCMNQESA-N 0 0 323.823 5.300 20 0 DKADRN C/C(=C/c1cccc(Cl)c1)c1nc([C@@H]2CCC(F)(F)C2)no1 ZINC000479143812 339528126 /nfs/dbraw/zinc/52/81/26/339528126.db2.gz IALQMEWRPRVQCQ-MQGYJPLLSA-N 0 0 324.758 5.186 20 0 DKADRN C/C(=C/c1cccc(Cl)c1)c1nc([C@H]2CCC(F)(F)C2)no1 ZINC000479143815 339528099 /nfs/dbraw/zinc/52/80/99/339528099.db2.gz IALQMEWRPRVQCQ-UMAGTOLTSA-N 0 0 324.758 5.186 20 0 DKADRN CC(C)c1cccc(CNC(=O)c2c(Cl)cccc2Cl)c1 ZINC000479179678 339528694 /nfs/dbraw/zinc/52/86/94/339528694.db2.gz IPGVBMBUXKFHSM-UHFFFAOYSA-N 0 0 322.235 5.047 20 0 DKADRN C[C@@H]1CC(C)(C)N(C(=O)CCCC(F)(F)F)c2ccccc21 ZINC000479212110 339529164 /nfs/dbraw/zinc/52/91/64/339529164.db2.gz GJSVNRFCBOBNKU-GFCCVEGCSA-N 0 0 313.363 5.038 20 0 DKADRN CC(=O)Nc1ccc(S[C@@H](C)c2cccc(Cl)c2F)cc1 ZINC000479226775 339529524 /nfs/dbraw/zinc/52/95/24/339529524.db2.gz SCHDKQKHQYARMY-JTQLQIEISA-N 0 0 323.820 5.291 20 0 DKADRN CC(=O)Nc1ccc(S[C@H](C)c2cccc(Cl)c2F)cc1 ZINC000479226776 339529442 /nfs/dbraw/zinc/52/94/42/339529442.db2.gz SCHDKQKHQYARMY-SNVBAGLBSA-N 0 0 323.820 5.291 20 0 DKADRN CCC[C@H](NCc1c(Cl)cccc1OC)c1ccsc1 ZINC000479296970 339530762 /nfs/dbraw/zinc/53/07/62/339530762.db2.gz PUQSGCROHOFNRW-HNNXBMFYSA-N 0 0 309.862 5.041 20 0 DKADRN CCC[C@@H](NCc1c(Cl)cccc1OC)c1ccsc1 ZINC000479296972 339530707 /nfs/dbraw/zinc/53/07/07/339530707.db2.gz PUQSGCROHOFNRW-OAHLLOKOSA-N 0 0 309.862 5.041 20 0 DKADRN Fc1ccc2c(c1)[C@@H](Nc1cccc(Oc3ccccn3)c1)CC2 ZINC000479392742 339532737 /nfs/dbraw/zinc/53/27/37/339532737.db2.gz OXKADLNHXVJFGL-IBGZPJMESA-N 0 0 320.367 5.112 20 0 DKADRN Fc1ccc2c(c1)[C@H](Nc1cccc(Oc3ccccn3)c1)CC2 ZINC000479392744 339532779 /nfs/dbraw/zinc/53/27/79/339532779.db2.gz OXKADLNHXVJFGL-LJQANCHMSA-N 0 0 320.367 5.112 20 0 DKADRN CC(C)c1csc(CN[C@H](c2cc(F)ccc2F)C(C)C)n1 ZINC000479394567 339532901 /nfs/dbraw/zinc/53/29/01/339532901.db2.gz RTASEUCCORAYEW-KRWDZBQOSA-N 0 0 324.440 5.032 20 0 DKADRN Fc1ccc2c(c1)[C@H](Nc1ccc(Oc3ccccn3)cc1)CC2 ZINC000479408262 339533604 /nfs/dbraw/zinc/53/36/04/339533604.db2.gz HKTXMMMACIOUEZ-LJQANCHMSA-N 0 0 320.367 5.112 20 0 DKADRN Cc1nn(C(C)(C)C)c(C)c1CNc1ccc(C2CC2)c(C)c1 ZINC000479412896 339533704 /nfs/dbraw/zinc/53/37/04/339533704.db2.gz VUBXGWRLOYNVRE-UHFFFAOYSA-N 0 0 311.473 5.053 20 0 DKADRN Cc1cc(NCc2csc(-c3ccccn3)n2)ccc1C1CC1 ZINC000479421921 339534218 /nfs/dbraw/zinc/53/42/18/339534218.db2.gz NTXBQBKSBARGPC-UHFFFAOYSA-N 0 0 321.449 5.003 20 0 DKADRN Cc1cc2[nH]c(CNc3cccc(-c4ncco4)c3)cc2c(C)c1 ZINC000479436433 339535051 /nfs/dbraw/zinc/53/50/51/339535051.db2.gz KCAKKMOCVOCHKD-UHFFFAOYSA-N 0 0 317.392 5.052 20 0 DKADRN Cc1c2ccc(F)cc2sc1C(=O)Nc1ccc2[nH]ccc2c1 ZINC000479445199 339535383 /nfs/dbraw/zinc/53/53/83/339535383.db2.gz VCKWMAFSFRPIFN-UHFFFAOYSA-N 0 0 324.380 5.082 20 0 DKADRN Cc1nccnc1[C@H](C)Nc1cc(-c2ccccc2)ccc1Cl ZINC000479462849 339536440 /nfs/dbraw/zinc/53/64/40/339536440.db2.gz CUDXDWJLAZPUEX-AWEZNQCLSA-N 0 0 323.827 5.279 20 0 DKADRN Cc1ccc([C@H](N[C@@H](C)c2ccccc2C)c2ccccn2)cc1 ZINC000479466640 339536667 /nfs/dbraw/zinc/53/66/67/339536667.db2.gz NQHYNTAZFBQWGF-AVRDEDQJSA-N 0 0 316.448 5.139 20 0 DKADRN Cc1ccc([C@H](N[C@H](C)c2ccccc2C)c2ccccn2)cc1 ZINC000479466641 339536700 /nfs/dbraw/zinc/53/67/00/339536700.db2.gz NQHYNTAZFBQWGF-GCJKJVERSA-N 0 0 316.448 5.139 20 0 DKADRN Cc1ccc([C@@H](N[C@@H](C)c2ccccc2C)c2ccccn2)cc1 ZINC000479466642 339536605 /nfs/dbraw/zinc/53/66/05/339536605.db2.gz NQHYNTAZFBQWGF-PGRDOPGGSA-N 0 0 316.448 5.139 20 0 DKADRN Cc1ccc([C@@H](N[C@H](C)c2ccccc2C)c2ccccn2)cc1 ZINC000479466643 339536710 /nfs/dbraw/zinc/53/67/10/339536710.db2.gz NQHYNTAZFBQWGF-XMSQKQJNSA-N 0 0 316.448 5.139 20 0 DKADRN CO[C@H](C)c1cccc(NCc2cc3c(cc(C)cc3C)[nH]2)c1 ZINC000479474628 339537053 /nfs/dbraw/zinc/53/70/53/339537053.db2.gz JVLBMYDIFLHZOO-OAHLLOKOSA-N 0 0 308.425 5.104 20 0 DKADRN Cc1cc2[nH]c(CNc3cccc(-c4cnco4)c3)cc2c(C)c1 ZINC000479476173 339537108 /nfs/dbraw/zinc/53/71/08/339537108.db2.gz IJYXPYCMJLYUJQ-UHFFFAOYSA-N 0 0 317.392 5.052 20 0 DKADRN Cc1ccc([C@H](C)N[C@@H](c2ccc(C)cc2)c2ccccn2)cc1 ZINC000479476505 339537109 /nfs/dbraw/zinc/53/71/09/339537109.db2.gz CHNURDPEKAGCDT-AVRDEDQJSA-N 0 0 316.448 5.139 20 0 DKADRN Cc1ccc([C@@H](C)N[C@@H](c2ccc(C)cc2)c2ccccn2)cc1 ZINC000479476506 339537049 /nfs/dbraw/zinc/53/70/49/339537049.db2.gz CHNURDPEKAGCDT-GCJKJVERSA-N 0 0 316.448 5.139 20 0 DKADRN Cc1ccc([C@@H](N[C@@H](C)c2ccc(C)cc2)c2ccccn2)cc1 ZINC000479476507 339537281 /nfs/dbraw/zinc/53/72/81/339537281.db2.gz CHNURDPEKAGCDT-PGRDOPGGSA-N 0 0 316.448 5.139 20 0 DKADRN Cc1ccc([C@@H](N[C@@H](C)c2cccc(C)c2)c2ccccn2)cc1 ZINC000479488250 339537761 /nfs/dbraw/zinc/53/77/61/339537761.db2.gz KDQUNERMJANCKL-PGRDOPGGSA-N 0 0 316.448 5.139 20 0 DKADRN CC[C@@H](C)n1ncc(N[C@H](C)c2cccc(Cl)c2F)c1C ZINC000479518884 339538991 /nfs/dbraw/zinc/53/89/91/339538991.db2.gz SAHVQGGGKSPFME-GHMZBOCLSA-N 0 0 309.816 5.128 20 0 DKADRN CC[C@@H](C)n1ncc(N[C@@H](C)c2cccc(Cl)c2F)c1C ZINC000479518886 339539010 /nfs/dbraw/zinc/53/90/10/339539010.db2.gz SAHVQGGGKSPFME-MNOVXSKESA-N 0 0 309.816 5.128 20 0 DKADRN CC[C@H](C)n1ncc(N[C@@H](C)c2cccc(Cl)c2F)c1C ZINC000479518887 339538935 /nfs/dbraw/zinc/53/89/35/339538935.db2.gz SAHVQGGGKSPFME-QWRGUYRKSA-N 0 0 309.816 5.128 20 0 DKADRN CC(C)c1ccccc1NC(=O)NCc1ccc(C2CC2)cc1 ZINC000479555963 339541038 /nfs/dbraw/zinc/54/10/38/339541038.db2.gz GSYSMWUXIRKNRZ-UHFFFAOYSA-N 0 0 308.425 5.009 20 0 DKADRN CC(C)c1noc([C@@H](C)SCc2cccc(C(F)F)c2)n1 ZINC000479581942 339542189 /nfs/dbraw/zinc/54/21/89/339542189.db2.gz BQLPAWHCMDLWHK-SNVBAGLBSA-N 0 0 312.385 5.125 20 0 DKADRN Cc1noc(C)c1CSCc1nc(C2CCCCC2)cs1 ZINC000479587952 339542681 /nfs/dbraw/zinc/54/26/81/339542681.db2.gz JFQWJDMATMEDJW-UHFFFAOYSA-N 0 0 322.499 5.229 20 0 DKADRN Cc1noc(C)c1CSCc1cccc(Cl)c1Cl ZINC000479591323 339542731 /nfs/dbraw/zinc/54/27/31/339542731.db2.gz LEJZDCUDXZKECM-UHFFFAOYSA-N 0 0 302.226 5.032 20 0 DKADRN FC(F)c1cccc(CSCc2nc(C3CCCC3)no2)c1 ZINC000479594863 339542856 /nfs/dbraw/zinc/54/28/56/339542856.db2.gz XAPIXWPAIKCESU-UHFFFAOYSA-N 0 0 324.396 5.098 20 0 DKADRN Cc1nccc(CS[C@@H](C)c2ccc(Cl)cc2Cl)n1 ZINC000479598175 339542976 /nfs/dbraw/zinc/54/29/76/339542976.db2.gz DGFJSUVGCYRJKR-VIFPVBQESA-N 0 0 313.253 5.086 20 0 DKADRN Cc1ccccc1[C@@H](SCc1ccnc(C)n1)c1ccccc1 ZINC000479599327 339543110 /nfs/dbraw/zinc/54/31/10/339543110.db2.gz ACMZLFKIIGYBBA-FQEVSTJZSA-N 0 0 320.461 5.116 20 0 DKADRN FC(F)c1cccc(CSCc2ncc(Cl)s2)c1 ZINC000479605853 339543557 /nfs/dbraw/zinc/54/35/57/339543557.db2.gz QBLGMCOCQBYDNB-UHFFFAOYSA-N 0 0 305.802 5.168 20 0 DKADRN Cc1noc(C)c1CS[C@H](C)CCSc1ccccc1 ZINC000479609015 339543598 /nfs/dbraw/zinc/54/35/98/339543598.db2.gz YTJIJTIWYIWGPW-GFCCVEGCSA-N 0 0 307.484 5.096 20 0 DKADRN Cc1noc(C)c1CS[C@@H](C)CCSc1ccccc1 ZINC000479609017 339543711 /nfs/dbraw/zinc/54/37/11/339543711.db2.gz YTJIJTIWYIWGPW-LBPRGKRZSA-N 0 0 307.484 5.096 20 0 DKADRN CCc1cccc(CC)c1NC(=O)c1ccc(C2CCC2)cc1 ZINC000479633348 339544379 /nfs/dbraw/zinc/54/43/79/339544379.db2.gz DZWKUPJUSZHPAZ-UHFFFAOYSA-N 0 0 307.437 5.331 20 0 DKADRN CCC[C@H](CC)S(=O)(=O)[C@H](C)c1ccc(Cl)cc1Cl ZINC000479636329 339544380 /nfs/dbraw/zinc/54/43/80/339544380.db2.gz MUZFAIPLHGVNIW-PWSUYJOCSA-N 0 0 323.285 5.048 20 0 DKADRN CCC[C@@H](CC)S(=O)(=O)[C@H](C)c1ccc(Cl)cc1Cl ZINC000479636330 339544353 /nfs/dbraw/zinc/54/43/53/339544353.db2.gz MUZFAIPLHGVNIW-ZYHUDNBSSA-N 0 0 323.285 5.048 20 0 DKADRN CC(C)c1ccccc1NC(=O)N1CC[C@](C)(c2ccccc2)C1 ZINC000479659905 339545082 /nfs/dbraw/zinc/54/50/82/339545082.db2.gz CCODNUHOWHEERO-NRFANRHFSA-N 0 0 322.452 5.006 20 0 DKADRN CC[C@@H](C)Oc1ccc(NC(=O)c2scc(C)c2Cl)cc1 ZINC000479663665 339545170 /nfs/dbraw/zinc/54/51/70/339545170.db2.gz XSFNHQXOISLAKP-LLVKDONJSA-N 0 0 323.845 5.140 20 0 DKADRN CC[C@H](C)Oc1ccc(NC(=O)c2scc(C)c2Cl)cc1 ZINC000479663666 339545205 /nfs/dbraw/zinc/54/52/05/339545205.db2.gz XSFNHQXOISLAKP-NSHDSACASA-N 0 0 323.845 5.140 20 0 DKADRN Cc1ccc([C@@H]2CCC[C@H]2N(C)C(=O)Nc2ccccc2C)cc1 ZINC000479664045 339545121 /nfs/dbraw/zinc/54/51/21/339545121.db2.gz HYIRDFPYCMWFEQ-AZUAARDMSA-N 0 0 322.452 5.103 20 0 DKADRN Cc1ccc([C@@H]2CCC[C@@H]2N(C)C(=O)Nc2ccccc2C)cc1 ZINC000479664046 339545140 /nfs/dbraw/zinc/54/51/40/339545140.db2.gz HYIRDFPYCMWFEQ-ICSRJNTNSA-N 0 0 322.452 5.103 20 0 DKADRN Cc1ccc([C@H]2CCC[C@@H]2N(C)C(=O)Nc2ccccc2C)cc1 ZINC000479664047 339545111 /nfs/dbraw/zinc/54/51/11/339545111.db2.gz HYIRDFPYCMWFEQ-QUCCMNQESA-N 0 0 322.452 5.103 20 0 DKADRN Cc1cc([C@@H](C)NC(=O)Nc2ccccc2C(C)C)ccc1F ZINC000479667711 339545237 /nfs/dbraw/zinc/54/52/37/339545237.db2.gz ROVFGMAYNBTXQN-CQSZACIVSA-N 0 0 314.404 5.140 20 0 DKADRN CCC[C@@H](C)[C@H]1CCCN1C(=O)Nc1ccccc1C(C)C ZINC000479670599 339545264 /nfs/dbraw/zinc/54/52/64/339545264.db2.gz CJBQXQLGYSYYDI-CRAIPNDOSA-N 0 0 302.462 5.243 20 0 DKADRN CCC[C@@H](C)[C@@H]1CCCN1C(=O)Nc1ccccc1C(C)C ZINC000479670601 339545229 /nfs/dbraw/zinc/54/52/29/339545229.db2.gz CJBQXQLGYSYYDI-QAPCUYQASA-N 0 0 302.462 5.243 20 0 DKADRN Cc1ccccc1NC(=O)N1CCC[C@@H]1CCCc1ccccc1 ZINC000479674015 339545428 /nfs/dbraw/zinc/54/54/28/339545428.db2.gz MTLJJBFWBVHWHB-IBGZPJMESA-N 0 0 322.452 5.014 20 0 DKADRN Cc1ccccc1NC(=O)N1CCC[C@H]1CCCc1ccccc1 ZINC000479674017 339545421 /nfs/dbraw/zinc/54/54/21/339545421.db2.gz MTLJJBFWBVHWHB-LJQANCHMSA-N 0 0 322.452 5.014 20 0 DKADRN CCCNc1ccc(Cl)cc1NC(=O)c1ccccc1Cl ZINC000479710802 339546691 /nfs/dbraw/zinc/54/66/91/339546691.db2.gz HZCVTWXRSUTAEN-UHFFFAOYSA-N 0 0 323.223 5.068 20 0 DKADRN Cc1cccc(C(C)C)c1NC(=O)NC1(Cc2ccccc2)CC1 ZINC000479712457 339546774 /nfs/dbraw/zinc/54/67/74/339546774.db2.gz LEWPSNITXCTIDM-UHFFFAOYSA-N 0 0 322.452 5.015 20 0 DKADRN CC[C@H]1[C@H](C)CCN1C(=O)Nc1c(C(C)C)cccc1C(C)C ZINC000479718983 339546934 /nfs/dbraw/zinc/54/69/34/339546934.db2.gz SNDQNRQBIVKZNM-QAPCUYQASA-N 0 0 316.489 5.586 20 0 DKADRN CC[C@H]1[C@@H](C)CCN1C(=O)Nc1c(C(C)C)cccc1C(C)C ZINC000479718988 339546921 /nfs/dbraw/zinc/54/69/21/339546921.db2.gz SNDQNRQBIVKZNM-YJBOKZPZSA-N 0 0 316.489 5.586 20 0 DKADRN CC(C)c1ccccc1NC(=O)Nc1ccc2scnc2c1 ZINC000479733156 339547287 /nfs/dbraw/zinc/54/72/87/339547287.db2.gz CIGMXKREZBFWOV-UHFFFAOYSA-N 0 0 311.410 5.064 20 0 DKADRN Cc1ccccc1NC(=O)N(C1CC1)[C@@H]1CCCc2ccccc21 ZINC000479744660 339547486 /nfs/dbraw/zinc/54/74/86/339547486.db2.gz NVSFCTLWJUFRQK-HXUWFJFHSA-N 0 0 320.436 5.069 20 0 DKADRN CCCOc1ccc(NC(=O)c2ccoc2C(C)C)cc1Cl ZINC000479748747 339547638 /nfs/dbraw/zinc/54/76/38/339547638.db2.gz DYSLUQRNGDZJBE-UHFFFAOYSA-N 0 0 321.804 5.098 20 0 DKADRN Cc1ccc(-c2ncc(/C=C\c3nc4ccccc4o3)s2)o1 ZINC000479767248 339548106 /nfs/dbraw/zinc/54/81/06/339548106.db2.gz ANHSRWXHKAUSQJ-CLFYSBASSA-N 0 0 308.362 5.023 20 0 DKADRN Cc1ccc(-c2ncc(/C=C/c3nc4ccccc4o3)s2)o1 ZINC000479767249 339548094 /nfs/dbraw/zinc/54/80/94/339548094.db2.gz ANHSRWXHKAUSQJ-VQHVLOKHSA-N 0 0 308.362 5.023 20 0 DKADRN Cc1nc(C)c(-c2csc(-c3cccc(C(F)(F)F)c3)n2)o1 ZINC000479802310 339549115 /nfs/dbraw/zinc/54/91/15/339549115.db2.gz IUAQRPREAOGKIZ-UHFFFAOYSA-N 0 0 324.327 5.101 20 0 DKADRN CC(C)c1ccc(C[S@@](=O)Cc2cccc(C(F)F)c2)cc1 ZINC000479822627 339549419 /nfs/dbraw/zinc/54/94/19/339549419.db2.gz LDSAHFQDNVLTOY-JOCHJYFZSA-N 0 0 322.420 5.197 20 0 DKADRN CC(C)c1ccc(C[S@](=O)Cc2cccc(C(F)F)c2)cc1 ZINC000479822628 339549413 /nfs/dbraw/zinc/54/94/13/339549413.db2.gz LDSAHFQDNVLTOY-QFIPXVFZSA-N 0 0 322.420 5.197 20 0 DKADRN CC(C)=CCCNC(=O)Nc1c(C(C)C)cccc1C(C)C ZINC000479836363 339549816 /nfs/dbraw/zinc/54/98/16/339549816.db2.gz JETAMCTVMUQUFV-UHFFFAOYSA-N 0 0 302.462 5.411 20 0 DKADRN CC[C@H](CN(CC)C(=O)Nc1c(C)cccc1C)c1ccccc1 ZINC000479838139 339549858 /nfs/dbraw/zinc/54/98/58/339549858.db2.gz RHRUKSFRMDYQNI-GOSISDBHSA-N 0 0 324.468 5.351 20 0 DKADRN Cc1ccc(Oc2ccccc2NC(=O)N2CCCC2(C)C)cc1 ZINC000479860959 339551185 /nfs/dbraw/zinc/55/11/85/339551185.db2.gz GTCUQZGZOQNTKV-UHFFFAOYSA-N 0 0 324.424 5.194 20 0 DKADRN CCOc1ccc(NC(=O)Nc2ccccc2C(C)C)c(C)c1 ZINC000479868571 339551646 /nfs/dbraw/zinc/55/16/46/339551646.db2.gz YZTGCOXNQYIKBW-UHFFFAOYSA-N 0 0 312.413 5.161 20 0 DKADRN C[C@@H](C[S@](=O)Cc1ccc(C2CCC2)cc1)c1ccccc1 ZINC000479870238 339551795 /nfs/dbraw/zinc/55/17/95/339551795.db2.gz CDJPRTLNXANUPR-AOMKIAJQSA-N 0 0 312.478 5.007 20 0 DKADRN C[C@H](C[S@@](=O)Cc1ccc(C2CCC2)cc1)c1ccccc1 ZINC000479870249 339551733 /nfs/dbraw/zinc/55/17/33/339551733.db2.gz CDJPRTLNXANUPR-OPAMFIHVSA-N 0 0 312.478 5.007 20 0 DKADRN C[C@H](C[S@](=O)Cc1ccc(C2CCC2)cc1)c1ccccc1 ZINC000479870250 339551758 /nfs/dbraw/zinc/55/17/58/339551758.db2.gz CDJPRTLNXANUPR-ZHRRBRCNSA-N 0 0 312.478 5.007 20 0 DKADRN CC(C)c1ccc([S@@](=O)Cc2cccc(C(F)F)c2)cc1 ZINC000479871121 339551777 /nfs/dbraw/zinc/55/17/77/339551777.db2.gz FXOAMTKTWPVVMI-NRFANRHFSA-N 0 0 308.393 5.055 20 0 DKADRN CC(C)c1ccc([S@](=O)Cc2cccc(C(F)F)c2)cc1 ZINC000479871123 541310099 /nfs/dbraw/zinc/31/00/99/541310099.db2.gz FXOAMTKTWPVVMI-OAQYLSRUSA-N 0 0 308.393 5.055 20 0 DKADRN COc1c(Cl)cccc1NC(=O)Nc1ccccc1C(C)C ZINC000479873946 335775495 /nfs/dbraw/zinc/77/54/95/335775495.db2.gz QPLUDPKWKZPXOF-UHFFFAOYSA-N 0 0 318.804 5.116 20 0 DKADRN 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5.087 20 0 DKADRN CC[C@H](C)CC(=O)Nc1ccccc1-c1cc(F)c(F)c(F)c1 ZINC000479897979 339553013 /nfs/dbraw/zinc/55/30/13/339553013.db2.gz NKYSTFOCUBTNQG-NSHDSACASA-N 0 0 321.342 5.146 20 0 DKADRN O=[S@](Cc1cccc(C(F)F)c1)c1ccc2ccccc2c1 ZINC000479903541 339553149 /nfs/dbraw/zinc/55/31/49/339553149.db2.gz RNAQLBIYPIDAGZ-JOCHJYFZSA-N 0 0 316.372 5.085 20 0 DKADRN CCC[C@@H](CC)[S@](=O)Cc1csc(C2CCCCC2)n1 ZINC000479909492 339553265 /nfs/dbraw/zinc/55/32/65/339553265.db2.gz JLRIMATUYSZBPR-FOIQADDNSA-N 0 0 313.532 5.018 20 0 DKADRN CCC[C@H](CC)[S@](=O)Cc1nc(C2CCCCC2)cs1 ZINC000479918338 339553353 /nfs/dbraw/zinc/55/33/53/339553353.db2.gz VTYCFYFPHHOFNG-VBKZILBWSA-N 0 0 313.532 5.018 20 0 DKADRN CCC[C@@H](CC)[S@@](=O)Cc1nc(C2CCCCC2)cs1 ZINC000479918339 339553363 /nfs/dbraw/zinc/55/33/63/339553363.db2.gz VTYCFYFPHHOFNG-VLIAUNLRSA-N 0 0 313.532 5.018 20 0 DKADRN CCC[C@H](CC)[S@@](=O)Cc1nc(C2CCCCC2)cs1 ZINC000479918340 339553414 /nfs/dbraw/zinc/55/34/14/339553414.db2.gz VTYCFYFPHHOFNG-XOBRGWDASA-N 0 0 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323.412 5.088 20 0 DKADRN Cc1ccc2ccccc2c1C[S@](=O)[C@@H](C)c1ccccc1 ZINC000479988048 339554827 /nfs/dbraw/zinc/55/48/27/339554827.db2.gz KEXQSLWSTBKYBA-AOMKIAJQSA-N 0 0 308.446 5.158 20 0 DKADRN Cc1ccc2ccccc2c1C[S@@](=O)C/C=C\c1ccccc1 ZINC000479988969 339554752 /nfs/dbraw/zinc/55/47/52/339554752.db2.gz MBRRTXQYGJROFJ-GNQFWKNRSA-N 0 0 320.457 5.110 20 0 DKADRN Cc1ccc2ccccc2c1C[S@@](=O)C/C=C/c1ccccc1 ZINC000479988973 339554826 /nfs/dbraw/zinc/55/48/26/339554826.db2.gz MBRRTXQYGJROFJ-KXOMFBTKSA-N 0 0 320.457 5.110 20 0 DKADRN C[C@H](c1cccc(Cl)c1)[S@@](=O)c1ccc(F)c(Cl)c1 ZINC000479995256 339554968 /nfs/dbraw/zinc/55/49/68/339554968.db2.gz ZGOQIBOYYHLTIS-AYLIAGHASA-N 0 0 317.212 5.001 20 0 DKADRN C[C@H](c1cccc(Cl)c1)[S@](=O)c1ccc(F)c(Cl)c1 ZINC000479995257 339555050 /nfs/dbraw/zinc/55/50/50/339555050.db2.gz ZGOQIBOYYHLTIS-HOGDKLEQSA-N 0 0 317.212 5.001 20 0 DKADRN C[C@@H](c1cccc(Cl)c1)[S@](=O)c1ccc(F)c(Cl)c1 ZINC000479995258 339555052 /nfs/dbraw/zinc/55/50/52/339555052.db2.gz 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/nfs/dbraw/zinc/55/51/80/339555180.db2.gz LDUXDZDGJUWDIP-UHFFFAOYSA-N 0 0 324.424 5.194 20 0 DKADRN Cc1cccc([C@H](C)[S@](=O)Cc2c(C)ccc3ccccc32)c1 ZINC000480010001 339555296 /nfs/dbraw/zinc/55/52/96/339555296.db2.gz ZMFPGNIZCBKDMO-GAJHUEQPSA-N 0 0 322.473 5.467 20 0 DKADRN Cc1cccc([C@@H](C)[S@](=O)Cc2c(C)ccc3ccccc32)c1 ZINC000480010009 339555286 /nfs/dbraw/zinc/55/52/86/339555286.db2.gz ZMFPGNIZCBKDMO-UZUQRXQVSA-N 0 0 322.473 5.467 20 0 DKADRN C[C@H](c1ccc(F)cc1)[S@@](=O)[C@H](C)c1cccc(Cl)c1 ZINC000480019589 339555659 /nfs/dbraw/zinc/55/56/59/339555659.db2.gz WOPVBASNTPTZDE-FKANQGBASA-N 0 0 310.821 5.050 20 0 DKADRN C[C@H](c1ccc(F)cc1)[S@](=O)[C@H](C)c1cccc(Cl)c1 ZINC000480019591 339555703 /nfs/dbraw/zinc/55/57/03/339555703.db2.gz WOPVBASNTPTZDE-HTGLOVNISA-N 0 0 310.821 5.050 20 0 DKADRN C[C@H](c1ccc(F)cc1)[S@](=O)[C@@H](C)c1cccc(Cl)c1 ZINC000480019592 339555727 /nfs/dbraw/zinc/55/57/27/339555727.db2.gz WOPVBASNTPTZDE-JGRMJRGVSA-N 0 0 310.821 5.050 20 0 DKADRN C[C@H](c1ccc(F)cc1)[S@@](=O)[C@@H](C)c1cccc(Cl)c1 ZINC000480019593 339555620 /nfs/dbraw/zinc/55/56/20/339555620.db2.gz WOPVBASNTPTZDE-XAAFQQQXSA-N 0 0 310.821 5.050 20 0 DKADRN Cc1ccccc1[C@H](C)Nc1cccc(Oc2ccccn2)c1 ZINC000480019799 339555544 /nfs/dbraw/zinc/55/55/44/339555544.db2.gz QPHGJEAPWMXXNI-INIZCTEOSA-N 0 0 304.393 5.355 20 0 DKADRN Cc1ccccc1[C@@H](C)Nc1cccc(Oc2ccccn2)c1 ZINC000480019810 339555692 /nfs/dbraw/zinc/55/56/92/339555692.db2.gz QPHGJEAPWMXXNI-MRXNPFEDSA-N 0 0 304.393 5.355 20 0 DKADRN O=C(CC1=CCCCC1)Nc1ccc(CNc2ccccc2)cc1 ZINC000480033392 339556162 /nfs/dbraw/zinc/55/61/62/339556162.db2.gz COAUEPUFQFQZER-UHFFFAOYSA-N 0 0 320.436 5.128 20 0 DKADRN CCC(C)(C)CC(=O)Nc1ccc(CNc2ccccc2)cc1 ZINC000480035625 339556127 /nfs/dbraw/zinc/55/61/27/339556127.db2.gz NJCHCRBGDPDXEK-UHFFFAOYSA-N 0 0 310.441 5.064 20 0 DKADRN O=C(Nc1cccc(C(F)F)c1)c1ccc(C2CCC2)cc1 ZINC000480035888 339556174 /nfs/dbraw/zinc/55/61/74/339556174.db2.gz FLAKLDUDSHTCBA-UHFFFAOYSA-N 0 0 301.336 5.144 20 0 DKADRN Cc1ccccc1[C@H](C)Nc1ccc(Oc2ccccn2)cc1 ZINC000480049396 339556608 /nfs/dbraw/zinc/55/66/08/339556608.db2.gz QKAPEIIQOPBKEF-INIZCTEOSA-N 0 0 304.393 5.355 20 0 DKADRN CCCCN(C(=O)[C@H]1CCC(F)(F)C1)[C@H](CC)c1ccccc1 ZINC000480055180 339556867 /nfs/dbraw/zinc/55/68/67/339556867.db2.gz BHYMKMDSYDZVIE-DLBZAZTESA-N 0 0 323.427 5.202 20 0 DKADRN CCCCN(C(=O)[C@@H]1CCC(F)(F)C1)[C@H](CC)c1ccccc1 ZINC000480055181 339556870 /nfs/dbraw/zinc/55/68/70/339556870.db2.gz BHYMKMDSYDZVIE-IAGOWNOFSA-N 0 0 323.427 5.202 20 0 DKADRN CCCCN(C(=O)[C@H]1CCC(F)(F)C1)[C@@H](CC)c1ccccc1 ZINC000480055182 339556863 /nfs/dbraw/zinc/55/68/63/339556863.db2.gz BHYMKMDSYDZVIE-IRXDYDNUSA-N 0 0 323.427 5.202 20 0 DKADRN CCCCN(C(=O)[C@@H]1CCC(F)(F)C1)[C@@H](CC)c1ccccc1 ZINC000480055183 339556866 /nfs/dbraw/zinc/55/68/66/339556866.db2.gz BHYMKMDSYDZVIE-SJORKVTESA-N 0 0 323.427 5.202 20 0 DKADRN Cc1coc2ccc(NC(=O)c3occc3-c3ccccc3)cc12 ZINC000480055478 339556887 /nfs/dbraw/zinc/55/68/87/339556887.db2.gz CSNNZPOCSZWNDZ-UHFFFAOYSA-N 0 0 317.344 5.254 20 0 DKADRN CC(C)(C)c1ccccc1NC(=O)NCc1ccc(C2CC2)cc1 ZINC000480086214 339558600 /nfs/dbraw/zinc/55/86/00/339558600.db2.gz AEVVLJRMNVCDAD-UHFFFAOYSA-N 0 0 322.452 5.183 20 0 DKADRN CC(C)c1ccc([C@H](NC(=O)[C@H]2CCC(F)(F)C2)C(C)C)cc1 ZINC000480093498 339558918 /nfs/dbraw/zinc/55/89/18/339558918.db2.gz JNGFAQSWNWWXBA-DLBZAZTESA-N 0 0 323.427 5.059 20 0 DKADRN CC(C)c1ccc([C@H](NC(=O)[C@@H]2CCC(F)(F)C2)C(C)C)cc1 ZINC000480093500 339558888 /nfs/dbraw/zinc/55/88/88/339558888.db2.gz JNGFAQSWNWWXBA-IAGOWNOFSA-N 0 0 323.427 5.059 20 0 DKADRN CCSc1cccc(C(=O)Nc2ccc(C)cc2Cl)c1 ZINC000480100428 339559201 /nfs/dbraw/zinc/55/92/01/339559201.db2.gz WMCGTGIZHCVWIQ-UHFFFAOYSA-N 0 0 305.830 5.013 20 0 DKADRN Cc1cc(-c2cccc(Cl)c2)ccc1NCc1ccnc(C)n1 ZINC000480120599 339559766 /nfs/dbraw/zinc/55/97/66/339559766.db2.gz OUWYZMFADOOLTN-UHFFFAOYSA-N 0 0 323.827 5.026 20 0 DKADRN CCCN(CC)C(=O)Nc1ccccc1Oc1ccc(C)cc1 ZINC000480123487 339559856 /nfs/dbraw/zinc/55/98/56/339559856.db2.gz 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/nfs/dbraw/zinc/56/10/59/339561059.db2.gz FKFGTTDIFMSLIB-VBKZILBWSA-N 0 0 323.461 5.270 20 0 DKADRN C[C@H](N[C@H](c1ccco1)c1ccccc1)c1cc2c(s1)CCC2 ZINC000480159921 339560995 /nfs/dbraw/zinc/56/09/95/339560995.db2.gz FKFGTTDIFMSLIB-XOBRGWDASA-N 0 0 323.461 5.270 20 0 DKADRN Cc1cccc([C@@H](C)N[C@@H](c2ccco2)c2ccccc2)c1C ZINC000480161825 339561154 /nfs/dbraw/zinc/56/11/54/339561154.db2.gz APJTYTZBTNBZBM-DYESRHJHSA-N 0 0 305.421 5.337 20 0 DKADRN Cc1cccc([C@@H](C)N[C@H](c2ccco2)c2ccccc2)c1C ZINC000480161827 339561190 /nfs/dbraw/zinc/56/11/90/339561190.db2.gz APJTYTZBTNBZBM-UTKZUKDTSA-N 0 0 305.421 5.337 20 0 DKADRN Cc1nc(-c2ccccc2NCCCCC(F)(F)F)cs1 ZINC000480161979 339561231 /nfs/dbraw/zinc/56/12/31/339561231.db2.gz SQANJAAEPNUODY-UHFFFAOYSA-N 0 0 314.376 5.263 20 0 DKADRN CC1(C)Cc2occc2[C@@H](N[C@H](c2ccco2)c2ccccc2)C1 ZINC000480167935 339561619 /nfs/dbraw/zinc/56/16/19/339561619.db2.gz JKJVLSXKLUUFRA-PXNSSMCTSA-N 0 0 321.420 5.265 20 0 DKADRN Cc1ccc(NCc2cccc(C(F)F)c2)cc1OC(F)F ZINC000480170264 339561858 /nfs/dbraw/zinc/56/18/58/339561858.db2.gz YTPOKYMIWCFZSA-UHFFFAOYSA-N 0 0 313.294 5.146 20 0 DKADRN C[C@H](NC(c1ccccc1)c1ccccc1)c1ccc(Cl)cn1 ZINC000480171967 339561915 /nfs/dbraw/zinc/56/19/15/339561915.db2.gz RYDMUORAOZXUPH-HNNXBMFYSA-N 0 0 322.839 5.175 20 0 DKADRN C[C@@H](NC(c1ccccc1)c1ccccc1)c1ccc(Cl)cn1 ZINC000480171968 339561896 /nfs/dbraw/zinc/56/18/96/339561896.db2.gz RYDMUORAOZXUPH-OAHLLOKOSA-N 0 0 322.839 5.175 20 0 DKADRN CCC[C@H](N[C@H](C)c1ccc(Cl)cn1)c1ccc(F)cc1F ZINC000480180208 339562348 /nfs/dbraw/zinc/56/23/48/339562348.db2.gz LEEBSXAUJQONCP-DIFFPNOSSA-N 0 0 324.802 5.205 20 0 DKADRN CCC[C@@H](N[C@H](C)c1ccc(Cl)cn1)c1ccc(F)cc1F ZINC000480180210 339562307 /nfs/dbraw/zinc/56/23/07/339562307.db2.gz LEEBSXAUJQONCP-PIGZYNQJSA-N 0 0 324.802 5.205 20 0 DKADRN CC(C)OCc1cccc(N[C@@H](C)CCCC(F)(F)F)c1 ZINC000480187704 339562629 /nfs/dbraw/zinc/56/26/29/339562629.db2.gz ZHJOFNPZINIOAK-ZDUSSCGKSA-N 0 0 303.368 5.145 20 0 DKADRN CC(C)[C@H](N[C@@H](C)c1ccc(Cl)cn1)c1ccc(F)cc1F ZINC000480188369 339562824 /nfs/dbraw/zinc/56/28/24/339562824.db2.gz ZOUATPXMSFBUSY-GTNSWQLSSA-N 0 0 324.802 5.061 20 0 DKADRN Cc1cccc(C(C)C)c1NC(=O)C[C@H]1CCc2ccccc2C1 ZINC000480196286 339563096 /nfs/dbraw/zinc/56/30/96/339563096.db2.gz IEIVHFXCQNGLFE-KRWDZBQOSA-N 0 0 321.464 5.252 20 0 DKADRN CC(C)OCc1ccc(N[C@H](C)CCCC(F)(F)F)cc1 ZINC000480196671 339563121 /nfs/dbraw/zinc/56/31/21/339563121.db2.gz YDYZYUFFXHJBEO-CYBMUJFWSA-N 0 0 303.368 5.145 20 0 DKADRN CC(C)OCc1ccc(N[C@@H](C)CCCC(F)(F)F)cc1 ZINC000480196672 339562461 /nfs/dbraw/zinc/56/24/61/339562461.db2.gz YDYZYUFFXHJBEO-ZDUSSCGKSA-N 0 0 303.368 5.145 20 0 DKADRN C[C@H](NCc1cc(F)cc(F)c1)c1cc(Cl)sc1Cl ZINC000480228424 339564212 /nfs/dbraw/zinc/56/42/12/339564212.db2.gz KAEJYOBBJCTIBD-ZETCQYMHSA-N 0 0 322.207 5.184 20 0 DKADRN Clc1sccc1CNc1ccc2nc(C3CC3)oc2c1 ZINC000480252839 339565393 /nfs/dbraw/zinc/56/53/93/339565393.db2.gz FSIYZEUJGSUVSA-UHFFFAOYSA-N 0 0 304.802 5.032 20 0 DKADRN Cc1cnc(CNc2ccc(Cl)cc2-c2cccc(C)c2)o1 ZINC000480256216 339565592 /nfs/dbraw/zinc/56/55/92/339565592.db2.gz ODTFEWVPYMPQQI-UHFFFAOYSA-N 0 0 312.800 5.224 20 0 DKADRN Cc1ccc(-c2ccc(Cl)cc2NCc2nc(C)c(C)o2)o1 ZINC000480266949 339566108 /nfs/dbraw/zinc/56/61/08/339566108.db2.gz QYHOALFVFHJSTN-UHFFFAOYSA-N 0 0 316.788 5.125 20 0 DKADRN FC(F)c1cccc(NCc2ccc(OCC3CC3)cc2)c1 ZINC000480275484 339566779 /nfs/dbraw/zinc/56/67/79/339566779.db2.gz QXPHYCZNSCIZDI-UHFFFAOYSA-N 0 0 303.352 5.025 20 0 DKADRN Cc1ncc(-c2ccc(N[C@H](C)CCCC(F)(F)F)cc2)o1 ZINC000480277215 339566915 /nfs/dbraw/zinc/56/69/15/339566915.db2.gz JTUIZCNKJZMLEQ-LLVKDONJSA-N 0 0 312.335 5.183 20 0 DKADRN Cc1ncc(-c2ccc(N[C@@H](C)CCCC(F)(F)F)cc2)o1 ZINC000480277220 339566838 /nfs/dbraw/zinc/56/68/38/339566838.db2.gz JTUIZCNKJZMLEQ-NSHDSACASA-N 0 0 312.335 5.183 20 0 DKADRN C[C@@H](Nc1cccc(-c2nccs2)c1)c1ccc(Cl)cn1 ZINC000480286083 339567343 /nfs/dbraw/zinc/56/73/43/339567343.db2.gz AHOJQPCQMONAAN-LLVKDONJSA-N 0 0 315.829 5.032 20 0 DKADRN C[C@H](Nc1cccc(-c2nccs2)c1)c1ccc(Cl)cn1 ZINC000480286084 339567345 /nfs/dbraw/zinc/56/73/45/339567345.db2.gz AHOJQPCQMONAAN-NSHDSACASA-N 0 0 315.829 5.032 20 0 DKADRN Cc1ccc(N[C@H](C)CCCC(F)(F)F)cc1OC(F)F ZINC000480286567 339567302 /nfs/dbraw/zinc/56/73/02/339567302.db2.gz VHPKZMBEQVCGRN-SNVBAGLBSA-N 0 0 311.294 5.129 20 0 DKADRN FC(F)(F)Cc1ccccc1NCc1ccsc1Cl ZINC000480290972 339567437 /nfs/dbraw/zinc/56/74/37/339567437.db2.gz XUPLIQAYPPCYKL-UHFFFAOYSA-N 0 0 305.752 5.118 20 0 DKADRN CC[C@H](C)n1ncc(NCc2ccsc2Cl)c1C1CC1 ZINC000480296331 339567679 /nfs/dbraw/zinc/56/76/79/339567679.db2.gz UDXVUYCYXBTCGJ-JTQLQIEISA-N 0 0 309.866 5.059 20 0 DKADRN CC[C@@H](C)n1ncc(NCc2ccsc2Cl)c1C1CC1 ZINC000480296332 339567667 /nfs/dbraw/zinc/56/76/67/339567667.db2.gz UDXVUYCYXBTCGJ-SNVBAGLBSA-N 0 0 309.866 5.059 20 0 DKADRN C[C@@H](CCCC(F)(F)F)Nc1ccc2nc(C3CC3)oc2c1 ZINC000480300252 339567773 /nfs/dbraw/zinc/56/77/73/339567773.db2.gz IHNSJBOXCBSSES-JTQLQIEISA-N 0 0 312.335 5.238 20 0 DKADRN C[C@H](CCCC(F)(F)F)Nc1ccc2nc(C3CC3)oc2c1 ZINC000480300253 339567769 /nfs/dbraw/zinc/56/77/69/339567769.db2.gz IHNSJBOXCBSSES-SNVBAGLBSA-N 0 0 312.335 5.238 20 0 DKADRN Cc1ccc(-c2ccc(Cl)cc2NCc2c(C)noc2C)o1 ZINC000480305238 339568089 /nfs/dbraw/zinc/56/80/89/339568089.db2.gz NDNNZMQAMGGGCU-UHFFFAOYSA-N 0 0 316.788 5.125 20 0 DKADRN CCCOc1cc(C)ccc1N[C@H](C)c1ccc(Cl)cn1 ZINC000480306295 339568332 /nfs/dbraw/zinc/56/83/32/339568332.db2.gz RRIOBYHWIWVLEC-CYBMUJFWSA-N 0 0 304.821 5.005 20 0 DKADRN Cc1cnc(-c2cccc(N[C@H](C)CCCC(F)(F)F)c2)o1 ZINC000480309487 339568551 /nfs/dbraw/zinc/56/85/51/339568551.db2.gz PRXWAHCLDYISND-LLVKDONJSA-N 0 0 312.335 5.183 20 0 DKADRN CSc1ccc(N[C@H](C)c2ccc(Cl)cn2)cc1Cl ZINC000480309853 339568473 /nfs/dbraw/zinc/56/84/73/339568473.db2.gz LTSFPWDZZJNYRN-SECBINFHSA-N 0 0 313.253 5.283 20 0 DKADRN CSc1ccc(N[C@@H](C)c2ccc(Cl)cn2)cc1Cl ZINC000480309854 339568510 /nfs/dbraw/zinc/56/85/10/339568510.db2.gz LTSFPWDZZJNYRN-VIFPVBQESA-N 0 0 313.253 5.283 20 0 DKADRN CSc1ccc(Cl)cc1N[C@H](C)c1ccc(Cl)cn1 ZINC000480310703 339568530 /nfs/dbraw/zinc/56/85/30/339568530.db2.gz NWDWKLCNTYBCPU-SECBINFHSA-N 0 0 313.253 5.283 20 0 DKADRN CSc1ccc(Cl)cc1N[C@@H](C)c1ccc(Cl)cn1 ZINC000480310704 339568542 /nfs/dbraw/zinc/56/85/42/339568542.db2.gz NWDWKLCNTYBCPU-VIFPVBQESA-N 0 0 313.253 5.283 20 0 DKADRN CC(C)n1ncc2ccc(N[C@H](C)CCCC(F)(F)F)cc21 ZINC000480312903 339568614 /nfs/dbraw/zinc/56/86/14/339568614.db2.gz YOIQTJXDEWZWOV-GFCCVEGCSA-N 0 0 313.367 5.150 20 0 DKADRN COc1ccc(OC(C)C)c(N[C@@H](C)CCCC(F)(F)F)c1 ZINC000480314588 339568740 /nfs/dbraw/zinc/56/87/40/339568740.db2.gz MPYFSCCYYSVTTK-LBPRGKRZSA-N 0 0 319.367 5.015 20 0 DKADRN C[C@@H](Nc1ccc(CC(F)(F)F)cc1)c1ccc(Cl)cn1 ZINC000480315136 339568804 /nfs/dbraw/zinc/56/88/04/339568804.db2.gz PWKYGICSODSSFX-SNVBAGLBSA-N 0 0 314.738 5.013 20 0 DKADRN CC(=O)c1cccc(C(=O)Nc2ccc(C(C)C)cc2C(C)C)c1 ZINC000480336058 339569596 /nfs/dbraw/zinc/56/95/96/339569596.db2.gz YRRFYVLFRZFXEX-UHFFFAOYSA-N 0 0 323.436 5.388 20 0 DKADRN C[C@@H](NCc1ccsc1Cl)c1nc(C(C)(C)C)cs1 ZINC000480343226 339569869 /nfs/dbraw/zinc/56/98/69/339569869.db2.gz LZJFVMJAAYKSIZ-SECBINFHSA-N 0 0 314.907 5.006 20 0 DKADRN C[C@H](NCc1ccsc1Cl)c1nc(C(C)(C)C)cs1 ZINC000480343227 339569871 /nfs/dbraw/zinc/56/98/71/339569871.db2.gz LZJFVMJAAYKSIZ-VIFPVBQESA-N 0 0 314.907 5.006 20 0 DKADRN Cc1ccc(C(C)(C)C)cc1SCc1nccn1C(F)F ZINC000480346852 339570062 /nfs/dbraw/zinc/57/00/62/339570062.db2.gz HYBVZQJRZAVKHS-UHFFFAOYSA-N 0 0 310.413 5.176 20 0 DKADRN Cc1ccc(-c2nnc(CS[C@@H](C)c3ccccc3C)o2)cc1 ZINC000480359566 339570533 /nfs/dbraw/zinc/57/05/33/339570533.db2.gz IUKRGKOTYUWFLC-HNNXBMFYSA-N 0 0 324.449 5.348 20 0 DKADRN Cc1ccc(-c2nnc(CS[C@H](C)c3ccccc3C)o2)cc1 ZINC000480359567 339570507 /nfs/dbraw/zinc/57/05/07/339570507.db2.gz IUKRGKOTYUWFLC-OAHLLOKOSA-N 0 0 324.449 5.348 20 0 DKADRN CCS[C@@H](C)c1noc(CS[C@H](C)c2ccccc2C)n1 ZINC000480359651 339570469 /nfs/dbraw/zinc/57/04/69/339570469.db2.gz CWIYUJSDFBPGOO-OLZOCXBDSA-N 0 0 322.499 5.187 20 0 DKADRN CCS[C@@H](C)c1noc(CS[C@@H](C)c2ccccc2C)n1 ZINC000480359656 339570462 /nfs/dbraw/zinc/57/04/62/339570462.db2.gz CWIYUJSDFBPGOO-STQMWFEESA-N 0 0 322.499 5.187 20 0 DKADRN Cc1nc([C@@H](C)SCCCF)oc1-c1ccc(Cl)cc1 ZINC000480363072 339570609 /nfs/dbraw/zinc/57/06/09/339570609.db2.gz LAHSVJIPWJWOHQ-LLVKDONJSA-N 0 0 313.825 5.457 20 0 DKADRN Cc1nc([C@H](C)SCCCF)oc1-c1ccc(Cl)cc1 ZINC000480363075 339570576 /nfs/dbraw/zinc/57/05/76/339570576.db2.gz LAHSVJIPWJWOHQ-NSHDSACASA-N 0 0 313.825 5.457 20 0 DKADRN CCc1nnc([C@@H](C)SCc2c(C)ccc3ccccc32)o1 ZINC000480365445 339570753 /nfs/dbraw/zinc/57/07/53/339570753.db2.gz UXRBAXMIQRNPBM-CYBMUJFWSA-N 0 0 312.438 5.088 20 0 DKADRN Cc1ccc2ccccc2c1CSCc1nccn1C(F)F ZINC000480370412 339571042 /nfs/dbraw/zinc/57/10/42/339571042.db2.gz LEEZOJDATHZRRH-UHFFFAOYSA-N 0 0 318.392 5.173 20 0 DKADRN CC[C@@H](C)CSCCCC(=O)Nc1c(C)cc(C)cc1C ZINC000480370443 339571038 /nfs/dbraw/zinc/57/10/38/339571038.db2.gz LLWSHCGBMRBTOL-CYBMUJFWSA-N 0 0 307.503 5.110 20 0 DKADRN Cc1ccccc1NC(=O)CCS[C@@H](C)c1ccccc1C ZINC000480370982 339571008 /nfs/dbraw/zinc/57/10/08/339571008.db2.gz OCDXFWLPGIDKPX-INIZCTEOSA-N 0 0 313.466 5.126 20 0 DKADRN Cc1ccccc1NC(=O)CCS[C@H](C)c1ccccc1C ZINC000480370988 339571006 /nfs/dbraw/zinc/57/10/06/339571006.db2.gz OCDXFWLPGIDKPX-MRXNPFEDSA-N 0 0 313.466 5.126 20 0 DKADRN Cc1ccc2ccccc2c1CSCc1nnc(C(C)C)o1 ZINC000480371015 339571035 /nfs/dbraw/zinc/57/10/35/339571035.db2.gz OFWNGQZOSBZHFM-UHFFFAOYSA-N 0 0 312.438 5.088 20 0 DKADRN CCS[C@@H](C)c1noc(CS[C@H](CC)c2ccccc2)n1 ZINC000480376668 339571257 /nfs/dbraw/zinc/57/12/57/339571257.db2.gz LRMOMFUATYELLQ-GXTWGEPZSA-N 0 0 322.499 5.268 20 0 DKADRN CCS[C@@H](C)c1noc(CS[C@@H](CC)c2ccccc2)n1 ZINC000480376669 339571217 /nfs/dbraw/zinc/57/12/17/339571217.db2.gz LRMOMFUATYELLQ-JSGCOSHPSA-N 0 0 322.499 5.268 20 0 DKADRN CCS[C@H](C)c1noc(CS[C@@H](CC)c2ccccc2)n1 ZINC000480376670 339571242 /nfs/dbraw/zinc/57/12/42/339571242.db2.gz LRMOMFUATYELLQ-OCCSQVGLSA-N 0 0 322.499 5.268 20 0 DKADRN CC[C@H](C)Sc1ccc(NC(=O)N2CCCC2(C)C)c(C)c1 ZINC000480378059 339571370 /nfs/dbraw/zinc/57/13/70/339571370.db2.gz NHTYJSVTQXJOKY-AWEZNQCLSA-N 0 0 320.502 5.292 20 0 DKADRN CC[C@@H](C)Sc1ccc(NC(=O)N2CCCC2(C)C)c(C)c1 ZINC000480378060 339571354 /nfs/dbraw/zinc/57/13/54/339571354.db2.gz NHTYJSVTQXJOKY-CQSZACIVSA-N 0 0 320.502 5.292 20 0 DKADRN CC[C@H](C)Sc1ccc(NC(=O)N(C)[C@@H](C)C(C)C)c(C)c1 ZINC000480382036 339571497 /nfs/dbraw/zinc/57/14/97/339571497.db2.gz ULTCZXNNMSXVRV-GJZGRUSLSA-N 0 0 322.518 5.394 20 0 DKADRN CC[C@@H](C)Sc1ccc(NC(=O)N(C)[C@H](C)C(C)C)c(C)c1 ZINC000480382037 339571472 /nfs/dbraw/zinc/57/14/72/339571472.db2.gz ULTCZXNNMSXVRV-HUUCEWRRSA-N 0 0 322.518 5.394 20 0 DKADRN CC[C@H](C)Sc1ccc(NC(=O)N(C)[C@H](C)C(C)C)c(C)c1 ZINC000480382038 339571490 /nfs/dbraw/zinc/57/14/90/339571490.db2.gz ULTCZXNNMSXVRV-LSDHHAIUSA-N 0 0 322.518 5.394 20 0 DKADRN Cc1cccc(NC(=O)CS[C@H](C)c2ccccc2C)c1C ZINC000480385042 339571645 /nfs/dbraw/zinc/57/16/45/339571645.db2.gz OAIZSEFLNHGZEF-MRXNPFEDSA-N 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Cc1cc(NC(=O)N(C)[C@H](C)c2ccccc2)ccc1C1CC1 ZINC000481888889 339615886 /nfs/dbraw/zinc/61/58/86/339615886.db2.gz CXWYFCPCIQIRPV-OAHLLOKOSA-N 0 0 308.425 5.097 20 0 DKADRN Cc1ccc(NC(=O)c2ccc(C(C)C)cc2)cc1-c1ncco1 ZINC000481895201 339615978 /nfs/dbraw/zinc/61/59/78/339615978.db2.gz WKJCXERFEPMFNW-UHFFFAOYSA-N 0 0 320.392 5.026 20 0 DKADRN Cc1cc(NC(=O)N([C@@H](C)c2ccco2)C2CC2)ccc1C1CC1 ZINC000481906509 339616231 /nfs/dbraw/zinc/61/62/31/339616231.db2.gz DXWVZSMKQHSFBJ-AWEZNQCLSA-N 0 0 324.424 5.223 20 0 DKADRN CC(C)[C@@H](CC(=O)N(C)[C@@H](C)c1ccccc1)c1ccccc1 ZINC000481906552 339616243 /nfs/dbraw/zinc/61/62/43/339616243.db2.gz KTMMSLVMNKSMSH-FXAWDEMLSA-N 0 0 309.453 5.036 20 0 DKADRN CC(C)[C@H](CC(=O)N(C)[C@H](C)c1ccccc1)c1ccccc1 ZINC000481906554 339616226 /nfs/dbraw/zinc/61/62/26/339616226.db2.gz KTMMSLVMNKSMSH-XLIONFOSSA-N 0 0 309.453 5.036 20 0 DKADRN Cc1cc(NC(=O)N2C[C@@H](C)[C@@H]2c2ccccc2)ccc1C1CC1 ZINC000481910317 339616392 /nfs/dbraw/zinc/61/63/92/339616392.db2.gz MAPFFILYSXOOKC-FOIQADDNSA-N 0 0 320.436 5.097 20 0 DKADRN Cc1cc(NC(=O)N2C[C@H](C)[C@H]2c2ccccc2)ccc1C1CC1 ZINC000481910322 339616347 /nfs/dbraw/zinc/61/63/47/339616347.db2.gz MAPFFILYSXOOKC-YWZLYKJASA-N 0 0 320.436 5.097 20 0 DKADRN Cc1cc(NC(=O)N2CCc3ccccc3[C@H]2C)ccc1C1CC1 ZINC000481916216 339616554 /nfs/dbraw/zinc/61/65/54/339616554.db2.gz MYLBAVABTPVCEP-OAHLLOKOSA-N 0 0 320.436 5.024 20 0 DKADRN Cc1cc(S[C@H](C)c2nc3ccccc3o2)c2ccccc2n1 ZINC000481917575 339616678 /nfs/dbraw/zinc/61/66/78/339616678.db2.gz DNSPPBXPDIFGMR-CYBMUJFWSA-N 0 0 320.417 5.538 20 0 DKADRN Cc1cc(S[C@@H](C)c2nc3ccccc3o2)c2ccccc2n1 ZINC000481917580 339616690 /nfs/dbraw/zinc/61/66/90/339616690.db2.gz DNSPPBXPDIFGMR-ZDUSSCGKSA-N 0 0 320.417 5.538 20 0 DKADRN Cc1ccc([C@@H]2CCCN2C(=O)Nc2ccc(C3CC3)c(C)c2)o1 ZINC000481928608 339617156 /nfs/dbraw/zinc/61/71/56/339617156.db2.gz AENFLQDCDGJTRS-SFHVURJKSA-N 0 0 324.424 5.143 20 0 DKADRN Cc1cc(Cl)ccc1NC(=O)c1cc2ccc(Cl)cc2[nH]1 ZINC000481945383 339617561 /nfs/dbraw/zinc/61/75/61/339617561.db2.gz UCNQFGQSYHGPJY-UHFFFAOYSA-N 0 0 319.191 5.035 20 0 DKADRN CC(C)COc1cccc(N[C@@H](c2cccnc2)C2CCC2)c1 ZINC000481990294 339618845 /nfs/dbraw/zinc/61/88/45/339618845.db2.gz DELSJAINCBJNAR-HXUWFJFHSA-N 0 0 310.441 5.070 20 0 DKADRN c1csc(-c2cccc(N[C@@H](c3cccnc3)C3CCC3)c2)n1 ZINC000481995287 339619136 /nfs/dbraw/zinc/61/91/36/339619136.db2.gz XBRORAARCZWYKG-GOSISDBHSA-N 0 0 321.449 5.158 20 0 DKADRN c1csc(-c2cccc(N[C@H](c3cccnc3)C3CCC3)c2)n1 ZINC000481995291 339619135 /nfs/dbraw/zinc/61/91/35/339619135.db2.gz XBRORAARCZWYKG-SFHVURJKSA-N 0 0 321.449 5.158 20 0 DKADRN Cc1ccc(N[C@H](c2cccnc2)C2CCC2)cc1OC(C)C ZINC000481996310 339619142 /nfs/dbraw/zinc/61/91/42/339619142.db2.gz BWXMDZPCMDNVGI-FQEVSTJZSA-N 0 0 310.441 5.131 20 0 DKADRN FC(F)(F)c1cccc(N[C@@H](c2cccnc2)C2CCC2)c1 ZINC000482000779 339619169 /nfs/dbraw/zinc/61/91/69/339619169.db2.gz LJKDWUGQPDJJJK-MRXNPFEDSA-N 0 0 306.331 5.054 20 0 DKADRN FC(F)c1cccc(N[C@@H](c2cccnc2)C2CCC2)c1Cl ZINC000482001595 339619156 /nfs/dbraw/zinc/61/91/56/339619156.db2.gz URSUIFXOJFFOQO-MRXNPFEDSA-N 0 0 322.786 5.626 20 0 DKADRN CSc1ccc(N[C@H](c2cccnc2)C2CCC2)cc1Cl ZINC000482003142 339619433 /nfs/dbraw/zinc/61/94/33/339619433.db2.gz DDTJNHANICWTBE-KRWDZBQOSA-N 0 0 318.873 5.410 20 0 DKADRN CSc1ccc(N[C@@H](c2cccnc2)C2CCC2)cc1Cl ZINC000482003143 339619425 /nfs/dbraw/zinc/61/94/25/339619425.db2.gz DDTJNHANICWTBE-QGZVFWFLSA-N 0 0 318.873 5.410 20 0 DKADRN CC(C)N(C)c1cccc(N[C@@H](C)CCCC(F)(F)F)c1 ZINC000482023157 339620075 /nfs/dbraw/zinc/62/00/75/339620075.db2.gz YLTLQIZPWXYBDU-ZDUSSCGKSA-N 0 0 302.384 5.064 20 0 DKADRN C[C@@H]1CC[C@@H](NCc2cc(-c3ccccc3)on2)c2ccccc21 ZINC000482029719 339620435 /nfs/dbraw/zinc/62/04/35/339620435.db2.gz IWHJDXNYNBXDGM-FOIQADDNSA-N 0 0 318.420 5.070 20 0 DKADRN C[C@H]1CC[C@@H](NCc2cc(-c3ccccc3)on2)c2ccccc21 ZINC000482029720 339620410 /nfs/dbraw/zinc/62/04/10/339620410.db2.gz IWHJDXNYNBXDGM-MGPUTAFESA-N 0 0 318.420 5.070 20 0 DKADRN C[C@@H]1CC[C@H](NCc2cc(-c3ccccc3)on2)c2ccccc21 ZINC000482029721 339620408 /nfs/dbraw/zinc/62/04/08/339620408.db2.gz IWHJDXNYNBXDGM-QRWLVFNGSA-N 0 0 318.420 5.070 20 0 DKADRN Cc1cc(C)c([C@H](C)NCc2cc(-c3ccccc3)on2)cc1C ZINC000482041781 339620826 /nfs/dbraw/zinc/62/08/26/339620826.db2.gz MLVFCTFPINTZLN-KRWDZBQOSA-N 0 0 320.436 5.118 20 0 DKADRN Cc1cc(C)c([C@@H](C)NCc2cc(-c3ccccc3)on2)cc1C ZINC000482041784 339620870 /nfs/dbraw/zinc/62/08/70/339620870.db2.gz MLVFCTFPINTZLN-QGZVFWFLSA-N 0 0 320.436 5.118 20 0 DKADRN CCCCCC(=O)N(Cc1ccco1)c1cccc(Cl)c1 ZINC000482053150 339621156 /nfs/dbraw/zinc/62/11/56/339621156.db2.gz MCBLWSINPWXHHF-UHFFFAOYSA-N 0 0 305.805 5.047 20 0 DKADRN Cc1ccc(NC(=O)[C@H](C)c2cc3ccccc3o2)c(Cl)c1 ZINC000482080043 339622189 /nfs/dbraw/zinc/62/21/89/339622189.db2.gz UGRRDCDSOZRJOI-GFCCVEGCSA-N 0 0 313.784 5.137 20 0 DKADRN Cc1ccc(NC(=O)[C@@H](C)c2cc3ccccc3o2)c(Cl)c1 ZINC000482080044 339622200 /nfs/dbraw/zinc/62/22/00/339622200.db2.gz UGRRDCDSOZRJOI-LBPRGKRZSA-N 0 0 313.784 5.137 20 0 DKADRN Cc1ccc(Cl)cc1NC(=O)[C@@H](C)c1cc2ccccc2o1 ZINC000482086822 339622462 /nfs/dbraw/zinc/62/24/62/339622462.db2.gz FWOYBVPVOBBZBK-LBPRGKRZSA-N 0 0 313.784 5.137 20 0 DKADRN Cc1ccccc1[C@H](C)N(C)C(=O)[C@H](C)c1cc2ccccc2o1 ZINC000482105729 339623269 /nfs/dbraw/zinc/62/32/69/339623269.db2.gz IDOPXZQNNALWOS-CVEARBPZSA-N 0 0 321.420 5.064 20 0 DKADRN CCCc1ccccc1NC(=O)[C@H](C)c1cc2ccccc2o1 ZINC000482107703 339623409 /nfs/dbraw/zinc/62/34/09/339623409.db2.gz XCUWKVCVJHRAQW-CQSZACIVSA-N 0 0 307.393 5.128 20 0 DKADRN Cc1cc(C)c(NC(=O)c2ccc(Oc3ccccc3)o2)c(C)c1 ZINC000482117259 339623675 /nfs/dbraw/zinc/62/36/75/339623675.db2.gz CGRZYNVEKRMSTC-UHFFFAOYSA-N 0 0 321.376 5.249 20 0 DKADRN Cc1ccc([C@H](C)N(C)C(=O)[C@@H](C)c2cc3ccccc3o2)cc1 ZINC000482132485 339624293 /nfs/dbraw/zinc/62/42/93/339624293.db2.gz YHGFQKNPPIOSFM-HOTGVXAUSA-N 0 0 321.420 5.064 20 0 DKADRN Cc1ccc([C@@H](C)N(C)C(=O)[C@H](C)c2cc3ccccc3o2)cc1 ZINC000482132486 339624231 /nfs/dbraw/zinc/62/42/31/339624231.db2.gz YHGFQKNPPIOSFM-HZPDHXFCSA-N 0 0 321.420 5.064 20 0 DKADRN CC(C)c1ccccc1NC(=O)[C@@H](C)c1cc2ccccc2o1 ZINC000482143587 339624508 /nfs/dbraw/zinc/62/45/08/339624508.db2.gz KWCCKCBGNHKEKX-AWEZNQCLSA-N 0 0 307.393 5.298 20 0 DKADRN CC(C)c1ccccc1NC(=O)[C@H](C)c1cc2ccccc2o1 ZINC000482143590 339624564 /nfs/dbraw/zinc/62/45/64/339624564.db2.gz KWCCKCBGNHKEKX-CQSZACIVSA-N 0 0 307.393 5.298 20 0 DKADRN Cc1cc(Cl)ccc1NC(=O)[C@@H](C)c1cc2ccccc2o1 ZINC000482144085 339624526 /nfs/dbraw/zinc/62/45/26/339624526.db2.gz QMGSFROLVZIUHR-LBPRGKRZSA-N 0 0 313.784 5.137 20 0 DKADRN CC(C)c1ccccc1NC(=O)c1ccc(Oc2ccccc2)o1 ZINC000482146917 339624727 /nfs/dbraw/zinc/62/47/27/339624727.db2.gz QAZBAJHBMHITMB-UHFFFAOYSA-N 0 0 321.376 5.448 20 0 DKADRN CC(C)[C@H](CC(=O)Nc1ccc(F)cc1Cl)c1ccccc1 ZINC000482165643 339625446 /nfs/dbraw/zinc/62/54/46/339625446.db2.gz SHBZUKPZBBMCAZ-HNNXBMFYSA-N 0 0 319.807 5.248 20 0 DKADRN CC(C)[C@@H](CC(=O)Nc1ccc(F)cc1Cl)c1ccccc1 ZINC000482165645 339625433 /nfs/dbraw/zinc/62/54/33/339625433.db2.gz SHBZUKPZBBMCAZ-OAHLLOKOSA-N 0 0 319.807 5.248 20 0 DKADRN CC[C@H](NC(=O)N(CCC(C)C)C1CCCC1)c1cccs1 ZINC000482166746 339625365 /nfs/dbraw/zinc/62/53/65/339625365.db2.gz FUDUEFVGFNRDAF-INIZCTEOSA-N 0 0 322.518 5.200 20 0 DKADRN CC[C@@H](NC(=O)N(CCC(C)C)C1CCCC1)c1cccs1 ZINC000482166750 339625381 /nfs/dbraw/zinc/62/53/81/339625381.db2.gz FUDUEFVGFNRDAF-MRXNPFEDSA-N 0 0 322.518 5.200 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)N1CCC[C@@H]1C(F)F ZINC000482171094 339625555 /nfs/dbraw/zinc/62/55/55/339625555.db2.gz UIOGJRSKAUYDAD-OAHLLOKOSA-N 0 0 324.415 5.024 20 0 DKADRN Cc1cc(Cl)ccc1C(=O)Nc1ccccc1OC(C)(C)C ZINC000482184043 339625792 /nfs/dbraw/zinc/62/57/92/339625792.db2.gz RUAJNNUEVYNCIN-UHFFFAOYSA-N 0 0 317.816 5.078 20 0 DKADRN Cc1ccc(C(C)(C)C(=O)Nc2ccc(Cl)cc2Cl)cc1 ZINC000482212821 339626305 /nfs/dbraw/zinc/62/63/05/339626305.db2.gz NKJSLDYXZUMMLF-UHFFFAOYSA-N 0 0 322.235 5.218 20 0 DKADRN C[C@H](c1ccccc1)N(C(=O)Nc1ccc2ccoc2c1)C1CC1 ZINC000482271643 339628307 /nfs/dbraw/zinc/62/83/07/339628307.db2.gz RBUSGFYSAKIUMG-CQSZACIVSA-N 0 0 320.392 5.190 20 0 DKADRN Cc1cc(NCc2ccc3c(c2)COC(C)(C)O3)ccc1C1CC1 ZINC000482276414 339628422 /nfs/dbraw/zinc/62/84/22/339628422.db2.gz MWRBBYCHCAUIJJ-UHFFFAOYSA-N 0 0 323.436 5.130 20 0 DKADRN CCc1cccc(CC)c1NC(=O)c1ccc(C)c(Cl)c1 ZINC000482300943 339628829 /nfs/dbraw/zinc/62/88/29/339628829.db2.gz IQIUUHFHYQKTQZ-UHFFFAOYSA-N 0 0 301.817 5.026 20 0 DKADRN CCc1cccc(CC)c1NC(=O)C[C@@H](c1ccccc1)C(C)C ZINC000482300984 339628811 /nfs/dbraw/zinc/62/88/11/339628811.db2.gz JHTYNSBSIKYHCO-HXUWFJFHSA-N 0 0 323.480 5.580 20 0 DKADRN CN(C(=O)c1ccc(-c2ccc(Cl)cc2)s1)C1CCCC1 ZINC000482332262 339629521 /nfs/dbraw/zinc/62/95/21/339629521.db2.gz ITPWMIXVHWUNMU-UHFFFAOYSA-N 0 0 319.857 5.083 20 0 DKADRN Cc1cccc(Cl)c1NC(=O)Cc1ccc(C(C)(C)C)cc1 ZINC000482394152 339630622 /nfs/dbraw/zinc/63/06/22/339630622.db2.gz XKDPLOKSJTZGJZ-UHFFFAOYSA-N 0 0 315.844 5.127 20 0 DKADRN CC(C)[C@H](CC(=O)N(Cc1ccccc1)C1CC1)c1ccccc1 ZINC000482405634 339630713 /nfs/dbraw/zinc/63/07/13/339630713.db2.gz COPLOTCKMHJRKZ-NRFANRHFSA-N 0 0 321.464 5.008 20 0 DKADRN C[C@@H]1C[C@@H](C(C)(C)C)CCN1C(=O)Nc1ccsc1Cl ZINC000482482803 339632992 /nfs/dbraw/zinc/63/29/92/339632992.db2.gz UNIFEUUOYCJLHI-MNOVXSKESA-N 0 0 314.882 5.080 20 0 DKADRN C[C@H]1C[C@H](C(C)(C)C)CCN1C(=O)Nc1ccsc1Cl ZINC000482482805 339632983 /nfs/dbraw/zinc/63/29/83/339632983.db2.gz UNIFEUUOYCJLHI-WDEREUQCSA-N 0 0 314.882 5.080 20 0 DKADRN Cc1cccc(C(C)C)c1NC(=O)c1cnc2ccccc2c1C ZINC000482492010 339633080 /nfs/dbraw/zinc/63/30/80/339633080.db2.gz BEIXRHJABXGAFS-UHFFFAOYSA-N 0 0 318.420 5.227 20 0 DKADRN Cc1cccc(C(C)C)c1NC(=O)c1ccc(Cl)cc1C ZINC000482506399 339633892 /nfs/dbraw/zinc/63/38/92/339633892.db2.gz ZEUYDDDOVFECGM-UHFFFAOYSA-N 0 0 301.817 5.333 20 0 DKADRN C[C@H](CC(=O)N(C)Cc1csc2ccccc12)c1ccccc1 ZINC000482519288 339634529 /nfs/dbraw/zinc/63/45/29/339634529.db2.gz NVSFGTHVPABKMT-OAHLLOKOSA-N 0 0 323.461 5.054 20 0 DKADRN Cc1coc2ccc(NC(=O)N3CCC[C@@]4(CC=CCC4)C3)cc12 ZINC000482538625 339635094 /nfs/dbraw/zinc/63/50/94/339635094.db2.gz VRXWSZLSRMONNK-FQEVSTJZSA-N 0 0 324.424 5.095 20 0 DKADRN Cc1coc2ccc(NC(=O)N3CCC[C@]4(CC=CCC4)C3)cc12 ZINC000482538628 339635179 /nfs/dbraw/zinc/63/51/79/339635179.db2.gz VRXWSZLSRMONNK-HXUWFJFHSA-N 0 0 324.424 5.095 20 0 DKADRN CC[C@H](NC(=O)Nc1ccc2occ(C)c2c1)c1cccs1 ZINC000482552506 339635643 /nfs/dbraw/zinc/63/56/43/339635643.db2.gz JEXLNBJWXXUIMT-AWEZNQCLSA-N 0 0 314.410 5.076 20 0 DKADRN Cc1coc2ccc(NC(=O)N3CCCC34CCCCC4)cc12 ZINC000482554482 339635807 /nfs/dbraw/zinc/63/58/07/339635807.db2.gz KMDDYHFGLNXSSQ-UHFFFAOYSA-N 0 0 312.413 5.072 20 0 DKADRN Cc1coc2ccc(NC(=O)N(C)[C@@H](C)c3ccc(C)cc3)cc12 ZINC000482567300 339636457 /nfs/dbraw/zinc/63/64/57/339636457.db2.gz POEYONMEWDGXKZ-HNNXBMFYSA-N 0 0 322.408 5.275 20 0 DKADRN Cc1cc([C@H](C)N[C@H](C)c2nc(C(C)(C)C)cs2)c(C)s1 ZINC000482636924 339638531 /nfs/dbraw/zinc/63/85/31/339638531.db2.gz BAKSAYKMVNTOLW-NWDGAFQWSA-N 0 0 322.543 5.531 20 0 DKADRN Cc1cc([C@H](C)N[C@@H](C)c2nc(C(C)(C)C)cs2)c(C)s1 ZINC000482636925 339638477 /nfs/dbraw/zinc/63/84/77/339638477.db2.gz BAKSAYKMVNTOLW-RYUDHWBXSA-N 0 0 322.543 5.531 20 0 DKADRN CCc1ccc([C@H](C)N[C@H](C)c2nc(C(C)(C)C)cs2)cc1 ZINC000482644781 339638782 /nfs/dbraw/zinc/63/87/82/339638782.db2.gz WQGQZEABGLVXJH-UONOGXRCSA-N 0 0 316.514 5.415 20 0 DKADRN CCc1ccc([C@@H](C)N[C@H](C)c2nc(C(C)(C)C)cs2)cc1 ZINC000482644783 339638769 /nfs/dbraw/zinc/63/87/69/339638769.db2.gz WQGQZEABGLVXJH-ZIAGYGMSSA-N 0 0 316.514 5.415 20 0 DKADRN CCc1nc(C)c([C@@H](C)[NH2+][C@H](C)c2cc(C)cc(C)c2)s1 ZINC000482648033 336393438 /nfs/dbraw/zinc/39/34/38/336393438.db2.gz PVHHTPBCEKJNDU-ZIAGYGMSSA-N 0 0 302.487 5.043 20 0 DKADRN Cc1c2cccc(Cl)c2oc1C(=O)N(C)[C@@H]1CCC[C@@H](C)C1 ZINC000482692568 339640170 /nfs/dbraw/zinc/64/01/70/339640170.db2.gz LIGQGCKRXYTAAK-DGCLKSJQSA-N 0 0 319.832 5.045 20 0 DKADRN c1cc2cccc(CNc3ccccc3N3CCCCCC3)c2[nH]1 ZINC000482749088 339641580 /nfs/dbraw/zinc/64/15/80/339641580.db2.gz DRCXALKNXFRJIR-UHFFFAOYSA-N 0 0 319.452 5.160 20 0 DKADRN Cc1c2cccc(C)c2oc1-c1nc([C@@H]2CCC(F)(F)C2)no1 ZINC000482818794 339643371 /nfs/dbraw/zinc/64/33/71/339643371.db2.gz PZLJMJDJGNCWLC-LLVKDONJSA-N 0 0 318.323 5.002 20 0 DKADRN Cc1c2cccc(C)c2oc1-c1nc([C@H]2CCC(F)(F)C2)no1 ZINC000482818795 339643380 /nfs/dbraw/zinc/64/33/80/339643380.db2.gz PZLJMJDJGNCWLC-NSHDSACASA-N 0 0 318.323 5.002 20 0 DKADRN Cc1noc(C)c1CN(c1ccccc1)[C@@H](C)c1ccccc1 ZINC000482833506 339643886 /nfs/dbraw/zinc/64/38/86/339643886.db2.gz FYZREZYLWNPYLB-INIZCTEOSA-N 0 0 306.409 5.059 20 0 DKADRN CCCC[C@H](CC)C(=O)Nc1cccc(Oc2ccncc2)c1 ZINC000482849868 339644454 /nfs/dbraw/zinc/64/44/54/339644454.db2.gz LQIUKFMTJGRGBQ-HNNXBMFYSA-N 0 0 312.413 5.029 20 0 DKADRN CCc1nc([C@H](C)N[C@@H](CC)c2ccc(CC)cc2)cs1 ZINC000482864395 339644947 /nfs/dbraw/zinc/64/49/47/339644947.db2.gz BAAVYLHLYPDDQC-BBRMVZONSA-N 0 0 302.487 5.070 20 0 DKADRN CCc1nc([C@@H](C)N[C@@H](CC)c2ccc(CC)cc2)cs1 ZINC000482864396 339645002 /nfs/dbraw/zinc/64/50/02/339645002.db2.gz BAAVYLHLYPDDQC-CJNGLKHVSA-N 0 0 302.487 5.070 20 0 DKADRN CCc1nc([C@@H](C)N[C@H](CC)c2ccc(CC)cc2)cs1 ZINC000482864398 339644959 /nfs/dbraw/zinc/64/49/59/339644959.db2.gz BAAVYLHLYPDDQC-CZUORRHYSA-N 0 0 302.487 5.070 20 0 DKADRN CCc1nc([C@H](C)N[C@H](CC)c2ccc(CC)cc2)cs1 ZINC000482864400 339644972 /nfs/dbraw/zinc/64/49/72/339644972.db2.gz BAAVYLHLYPDDQC-XJKSGUPXSA-N 0 0 302.487 5.070 20 0 DKADRN Cc1cc([C@@H](C)NCc2nc(C(C)C)c(C)s2)c(C)s1 ZINC000482869837 339645165 /nfs/dbraw/zinc/64/51/65/339645165.db2.gz NSLNUQCOQPGHOS-LLVKDONJSA-N 0 0 308.516 5.104 20 0 DKADRN Cc1cc([C@H](C)NCc2nc(C(C)C)c(C)s2)c(C)s1 ZINC000482869838 339644233 /nfs/dbraw/zinc/64/42/33/339644233.db2.gz NSLNUQCOQPGHOS-NSHDSACASA-N 0 0 308.516 5.104 20 0 DKADRN CCCc1ccc([C@@H](C)N[C@@H](C)c2csc(CC)n2)cc1 ZINC000482874150 339645411 /nfs/dbraw/zinc/64/54/11/339645411.db2.gz XTDQWEMLBVQDIH-KGLIPLIRSA-N 0 0 302.487 5.070 20 0 DKADRN CCCc1ccc([C@@H](C)N[C@H](C)c2csc(CC)n2)cc1 ZINC000482874152 339645417 /nfs/dbraw/zinc/64/54/17/339645417.db2.gz XTDQWEMLBVQDIH-ZIAGYGMSSA-N 0 0 302.487 5.070 20 0 DKADRN CCC[C@H](N[C@H](C)c1csc(CC)n1)c1ccc(Cl)cc1 ZINC000482874190 339645420 /nfs/dbraw/zinc/64/54/20/339645420.db2.gz YEBKUGKOGSZXNI-DOMZBBRYSA-N 0 0 322.905 5.551 20 0 DKADRN CCc1nc([C@H](C)N[C@@H](C)c2cc(C)c(C)cc2C)cs1 ZINC000482890795 339646189 /nfs/dbraw/zinc/64/61/89/339646189.db2.gz NXBJGWKZHVECTO-GJZGRUSLSA-N 0 0 302.487 5.043 20 0 DKADRN CCc1nc([C@@H](C)N[C@H](C)c2cc(C)c(C)cc2C)cs1 ZINC000482890797 336398861 /nfs/dbraw/zinc/39/88/61/336398861.db2.gz NXBJGWKZHVECTO-HUUCEWRRSA-N 0 0 302.487 5.043 20 0 DKADRN CCc1nc([C@@H](C)N[C@@H](C)c2cc(C)c(C)cc2C)cs1 ZINC000482890837 336398859 /nfs/dbraw/zinc/39/88/59/336398859.db2.gz NXBJGWKZHVECTO-LSDHHAIUSA-N 0 0 302.487 5.043 20 0 DKADRN Cc1sc(CN[C@@H](C)c2cc3ccccc3o2)nc1C(C)C ZINC000482901619 339646627 /nfs/dbraw/zinc/64/66/27/339646627.db2.gz NDLBHTHTMXQWQQ-LBPRGKRZSA-N 0 0 314.454 5.172 20 0 DKADRN Cc1sc(CN[C@@H](C)c2cc(C)c(F)c(C)c2)nc1C(C)C ZINC000482903087 339646690 /nfs/dbraw/zinc/64/66/90/339646690.db2.gz PEUMAPHCQAWVJJ-ZDUSSCGKSA-N 0 0 320.477 5.182 20 0 DKADRN C[C@@H]1CCC[C@H](CC(=O)Nc2cccc(Oc3ccncc3)c2)C1 ZINC000482911849 339646777 /nfs/dbraw/zinc/64/67/77/339646777.db2.gz PFJGUXXHKOGTME-CVEARBPZSA-N 0 0 324.424 5.029 20 0 DKADRN C[C@H]1CCC[C@H](CC(=O)Nc2cccc(Oc3ccncc3)c2)C1 ZINC000482911851 339646819 /nfs/dbraw/zinc/64/68/19/339646819.db2.gz PFJGUXXHKOGTME-HOTGVXAUSA-N 0 0 324.424 5.029 20 0 DKADRN Cc1ccccc1[C@H](NC(=O)c1cccc(C(F)F)c1)C(C)C ZINC000482998785 339649423 /nfs/dbraw/zinc/64/94/23/339649423.db2.gz JYJRMMJHHUYISC-QGZVFWFLSA-N 0 0 317.379 5.060 20 0 DKADRN CCc1cccc(C)c1NC(=O)c1csc2cc(C)ccc12 ZINC000483043515 339650371 /nfs/dbraw/zinc/65/03/71/339650371.db2.gz AXCANWAGLJMXMJ-UHFFFAOYSA-N 0 0 309.434 5.333 20 0 DKADRN O=C(Nc1cc(Cl)ccc1Cl)c1coc2cc(F)ccc12 ZINC000483045295 339650313 /nfs/dbraw/zinc/65/03/13/339650313.db2.gz 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/nfs/dbraw/zinc/66/87/29/339668729.db2.gz SVZSQJBGYQXCIO-GOSISDBHSA-N 0 0 310.441 5.131 20 0 DKADRN Cc1cccc(C)c1NC(=O)N[C@H](c1ccccc1C)C(C)C ZINC000483551705 339668737 /nfs/dbraw/zinc/66/87/37/339668737.db2.gz SVZSQJBGYQXCIO-SFHVURJKSA-N 0 0 310.441 5.131 20 0 DKADRN Cc1ccc2c(c1)CCN(C(=O)Nc1c(C)cccc1C(C)C)C2 ZINC000483618213 339669745 /nfs/dbraw/zinc/66/97/45/339669745.db2.gz TZSKXHNVTCYKSE-UHFFFAOYSA-N 0 0 322.452 5.017 20 0 DKADRN CCc1cccc(C)c1NC(=O)N[C@H](c1ccccc1C)C(C)C ZINC000483626606 339669837 /nfs/dbraw/zinc/66/98/37/339669837.db2.gz XIEVGSPBLJLNOG-IBGZPJMESA-N 0 0 324.468 5.385 20 0 DKADRN CCc1cccc(C)c1NC(=O)N[C@@H](c1ccccc1C)C(C)C ZINC000483626607 339669831 /nfs/dbraw/zinc/66/98/31/339669831.db2.gz XIEVGSPBLJLNOG-LJQANCHMSA-N 0 0 324.468 5.385 20 0 DKADRN CCC(CC)N(CC(C)C)C(=O)Nc1cccc(C(F)F)c1 ZINC000483626713 339669836 /nfs/dbraw/zinc/66/98/36/339669836.db2.gz QDIAROZQCMVLQY-UHFFFAOYSA-N 0 0 312.404 5.303 20 0 DKADRN CCC(CC)N(CC(C)C)C(=O)Nc1cccc([C@@H](C)OC)c1 ZINC000483632163 339670117 /nfs/dbraw/zinc/67/01/17/339670117.db2.gz CQSMFQNVLFGSLG-OAHLLOKOSA-N 0 0 320.477 5.073 20 0 DKADRN CC[C@H](C)Sc1ccc(NC(=O)N2CC[C@H](C)[C@H]2C)c(C)c1 ZINC000483658985 339671162 /nfs/dbraw/zinc/67/11/62/339671162.db2.gz WPGVRAFHGZEESV-AEGPPILISA-N 0 0 320.502 5.148 20 0 DKADRN CC[C@H](C)Sc1ccc(NC(=O)N2CC[C@H](C)[C@@H]2C)c(C)c1 ZINC000483658986 339671163 /nfs/dbraw/zinc/67/11/63/339671163.db2.gz WPGVRAFHGZEESV-QEJZJMRPSA-N 0 0 320.502 5.148 20 0 DKADRN CC[C@H](C)Sc1ccc(NC(=O)N2CC[C@@H](C)[C@@H]2C)c(C)c1 ZINC000483658987 339671127 /nfs/dbraw/zinc/67/11/27/339671127.db2.gz WPGVRAFHGZEESV-SNPRPXQTSA-N 0 0 320.502 5.148 20 0 DKADRN CC(C)[C@H](CC(=O)Nc1cccc(C(F)F)c1)c1ccccc1 ZINC000483667321 339671439 /nfs/dbraw/zinc/67/14/39/339671439.db2.gz LHPIQXKEXZXYLU-KRWDZBQOSA-N 0 0 317.379 5.393 20 0 DKADRN CC(C)[C@@H](CC(=O)Nc1cccc(C(F)F)c1)c1ccccc1 ZINC000483667322 339671377 /nfs/dbraw/zinc/67/13/77/339671377.db2.gz LHPIQXKEXZXYLU-QGZVFWFLSA-N 0 0 317.379 5.393 20 0 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/nfs/dbraw/zinc/67/61/06/339676106.db2.gz DOVKNDUOHMGOEH-IBGZPJMESA-N 0 0 314.429 5.113 20 0 DKADRN CCC[C@@](C)(CC)C(=O)Nc1cc(-c2nc(C)co2)ccc1C ZINC000483845660 339676024 /nfs/dbraw/zinc/67/60/24/339676024.db2.gz DOVKNDUOHMGOEH-LJQANCHMSA-N 0 0 314.429 5.113 20 0 DKADRN CCC(CC)N(CC(C)C)C(=O)Nc1c(C)cc(C)cc1C ZINC000483848084 339676148 /nfs/dbraw/zinc/67/61/48/339676148.db2.gz KTRUHYSQMANDGW-UHFFFAOYSA-N 0 0 304.478 5.290 20 0 DKADRN CC(C)Sc1ccccc1NC(=O)CC(C)(C)C(F)(F)F ZINC000483848293 339676213 /nfs/dbraw/zinc/67/62/13/339676213.db2.gz GCKVKSMQTKYEAO-UHFFFAOYSA-N 0 0 319.392 5.104 20 0 DKADRN CC[C@H](C)CN(CC)C(=O)Nc1c(C(C)C)cccc1C(C)C ZINC000483851890 339676430 /nfs/dbraw/zinc/67/64/30/339676430.db2.gz LRFNBTLPLWYQTB-INIZCTEOSA-N 0 0 318.505 5.833 20 0 DKADRN CC[C@@H](C)CN(CC)C(=O)Nc1c(C(C)C)cccc1C(C)C ZINC000483851891 339676432 /nfs/dbraw/zinc/67/64/32/339676432.db2.gz LRFNBTLPLWYQTB-MRXNPFEDSA-N 0 0 318.505 5.833 20 0 DKADRN Cc1ccc(C)c(NC(=O)Nc2ccc(CC(F)(F)F)cc2)c1 ZINC000483925036 339678185 /nfs/dbraw/zinc/67/81/85/339678185.db2.gz AMOAYWSUIGAVTN-UHFFFAOYSA-N 0 0 322.330 5.052 20 0 DKADRN CCc1ccc(Cl)c(CC)c1NC(=O)[C@H](C)c1ccccc1 ZINC000483928359 339678285 /nfs/dbraw/zinc/67/82/85/339678285.db2.gz UAABWLQIAAPRQP-CYBMUJFWSA-N 0 0 315.844 5.207 20 0 DKADRN CCc1ccc(Cl)c(CC)c1NC(=O)[C@@H](C)c1ccccc1 ZINC000483928360 339678169 /nfs/dbraw/zinc/67/81/69/339678169.db2.gz UAABWLQIAAPRQP-ZDUSSCGKSA-N 0 0 315.844 5.207 20 0 DKADRN Cc1ccc(C)c(NC(=O)Nc2cccc(CC(F)(F)F)c2)c1 ZINC000483935015 339678189 /nfs/dbraw/zinc/67/81/89/339678189.db2.gz QXQASLZTFZLTQS-UHFFFAOYSA-N 0 0 322.330 5.052 20 0 DKADRN Cc1csc(N(C(=O)[C@H](C)CC(C)(C)C)c2ccccc2)n1 ZINC000483945754 339678330 /nfs/dbraw/zinc/67/83/30/339678330.db2.gz OAVMXNSFMBUSAK-CYBMUJFWSA-N 0 0 316.470 5.189 20 0 DKADRN Cc1csc(N(C(=O)[C@@H](C)CC(C)(C)C)c2ccccc2)n1 ZINC000483945755 339678317 /nfs/dbraw/zinc/67/83/17/339678317.db2.gz OAVMXNSFMBUSAK-ZDUSSCGKSA-N 0 0 316.470 5.189 20 0 DKADRN Cc1ncc(-c2ccccc2)cc1NC(=O)c1ccoc1C(C)C ZINC000483956412 339678590 /nfs/dbraw/zinc/67/85/90/339678590.db2.gz FLQGFBYKRGKTCM-UHFFFAOYSA-N 0 0 320.392 5.026 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)[C@H]1CCC(F)(F)C1 ZINC000483957844 339678638 /nfs/dbraw/zinc/67/86/38/339678638.db2.gz JKDYBVAWXJZERA-AWEZNQCLSA-N 0 0 309.400 5.136 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)[C@@H]1CCC(F)(F)C1 ZINC000483957845 339678677 /nfs/dbraw/zinc/67/86/77/339678677.db2.gz JKDYBVAWXJZERA-CQSZACIVSA-N 0 0 309.400 5.136 20 0 DKADRN CCN(C(=O)c1cc(C)n(C2CCCCC2)c1C)C1CCCC1 ZINC000483968054 339678862 /nfs/dbraw/zinc/67/88/62/339678862.db2.gz ACZFUFFVCLPFJP-UHFFFAOYSA-N 0 0 316.489 5.015 20 0 DKADRN CC(C)N(C(=O)[C@H](C)c1ccccc1)c1ccc(F)cc1Cl ZINC000483969991 339678911 /nfs/dbraw/zinc/67/89/11/339678911.db2.gz BHNWAZUROLRVCO-CYBMUJFWSA-N 0 0 319.807 5.024 20 0 DKADRN CC(C)N(C(=O)[C@@H](C)c1ccccc1)c1ccc(F)cc1Cl ZINC000483969992 339678867 /nfs/dbraw/zinc/67/88/67/339678867.db2.gz BHNWAZUROLRVCO-ZDUSSCGKSA-N 0 0 319.807 5.024 20 0 DKADRN CCN(C(=O)c1ccc(-c2ccccc2F)o1)c1ccccc1C ZINC000484050447 339680175 /nfs/dbraw/zinc/68/01/75/339680175.db2.gz YDQMXNYQMMYRBX-UHFFFAOYSA-N 0 0 323.367 5.061 20 0 DKADRN CC(C)c1occc1C(=O)Nc1cccc(C(F)F)c1Cl ZINC000484054923 339680108 /nfs/dbraw/zinc/68/01/08/339680108.db2.gz GNWMEUGNMRKYHI-UHFFFAOYSA-N 0 0 313.731 5.246 20 0 DKADRN C[C@@H](CC(C)(C)C)C(=O)N(C)c1c(Cl)cccc1Cl ZINC000484101997 339680974 /nfs/dbraw/zinc/68/09/74/339680974.db2.gz ABULRSUKNOACJN-JTQLQIEISA-N 0 0 302.245 5.029 20 0 DKADRN Cc1cc(Cl)c2ccccc2c1NC(=O)[C@@H]1CCC(F)(F)C1 ZINC000484104513 339681143 /nfs/dbraw/zinc/68/11/43/339681143.db2.gz FGPHTZMNLKGCTD-LLVKDONJSA-N 0 0 323.770 5.176 20 0 DKADRN Cc1cc(Cl)c2ccccc2c1NC(=O)[C@H]1CCC(F)(F)C1 ZINC000484104519 339681150 /nfs/dbraw/zinc/68/11/50/339681150.db2.gz FGPHTZMNLKGCTD-NSHDSACASA-N 0 0 323.770 5.176 20 0 DKADRN Cc1cc(Cl)c(NC(=O)[C@H](C)c2ccccc2)cc1Cl ZINC000484118320 339681230 /nfs/dbraw/zinc/68/12/30/339681230.db2.gz SKWAJPJIBIMQQB-LLVKDONJSA-N 0 0 308.208 5.044 20 0 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5.337 20 0 DKADRN CCC[C@@H](N[C@@H](COC)c1ccc(C)o1)c1ccc(Cl)cc1 ZINC000484468377 339686611 /nfs/dbraw/zinc/68/66/11/339686611.db2.gz BMYQTHCVZUVRRK-SJORKVTESA-N 0 0 321.848 5.060 20 0 DKADRN CC(C)c1ccc(/C=C\CC(=O)Nc2c(F)cccc2F)cc1 ZINC000484567541 339689527 /nfs/dbraw/zinc/68/95/27/339689527.db2.gz RLIWAJOTSAIUAL-HYXAFXHYSA-N 0 0 315.363 5.130 20 0 DKADRN Cc1ccc([C@@H](C)N[C@H](c2ccccc2)c2cccc(F)c2)o1 ZINC000484620122 339690802 /nfs/dbraw/zinc/69/08/02/339690802.db2.gz NEULLBYLIMJSBO-FOIQADDNSA-N 0 0 309.384 5.167 20 0 DKADRN Cc1ccc([C@H](C)N[C@H](c2ccccc2)c2cccc(F)c2)o1 ZINC000484620123 339690754 /nfs/dbraw/zinc/69/07/54/339690754.db2.gz NEULLBYLIMJSBO-MGPUTAFESA-N 0 0 309.384 5.167 20 0 DKADRN Cc1ccc([C@@H](C)N[C@@H](c2ccccc2)c2cccc(F)c2)o1 ZINC000484620124 339690771 /nfs/dbraw/zinc/69/07/71/339690771.db2.gz NEULLBYLIMJSBO-QRWLVFNGSA-N 0 0 309.384 5.167 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)NCCC=C(C)C ZINC000484652600 339691647 /nfs/dbraw/zinc/69/16/47/339691647.db2.gz 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C/C(=C\C(C)=C/c1cccc(C(F)(F)F)c1)c1cnccn1 ZINC000486147291 339722052 /nfs/dbraw/zinc/72/20/52/339722052.db2.gz PQIYFWPASOXHDV-SIMOKGRJSA-N 0 0 304.315 5.002 20 0 DKADRN Cc1cccc(C)c1NC(=O)N[C@H]1CCC[C@H](c2ccccc2)C1 ZINC000486174016 339722730 /nfs/dbraw/zinc/72/27/30/339722730.db2.gz CTSRRSVKNIHOKA-OALUTQOASA-N 0 0 322.452 5.151 20 0 DKADRN CCc1cccc(C)c1NC(=O)N[C@H](C)c1ccccc1Cl ZINC000486183511 339722901 /nfs/dbraw/zinc/72/29/01/339722901.db2.gz KPGDESQDZDEIML-CYBMUJFWSA-N 0 0 316.832 5.094 20 0 DKADRN CC(C)c1ccccc1NC(=O)CNc1csc2ccccc12 ZINC000486193731 339723078 /nfs/dbraw/zinc/72/30/78/339723078.db2.gz CBQIKFXNJJAEQM-UHFFFAOYSA-N 0 0 324.449 5.075 20 0 DKADRN O=C(c1ccc(NCc2ccc(C(F)F)cc2)cc1)C1CCC1 ZINC000486206332 339723373 /nfs/dbraw/zinc/72/33/73/339723373.db2.gz VTEALBVGNYCECW-UHFFFAOYSA-N 0 0 315.363 5.219 20 0 DKADRN CC(C)N(C(=O)c1cc2c(ccc3ccccc23)[nH]1)C1CCCC1 ZINC000486218175 339723455 /nfs/dbraw/zinc/72/34/55/339723455.db2.gz HHZAHQVCDCVCCZ-UHFFFAOYSA-N 0 0 320.436 5.114 20 0 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/nfs/dbraw/zinc/75/82/44/339758244.db2.gz QTQCXBVGKITSFF-JTQLQIEISA-N 0 0 309.866 5.059 20 0 DKADRN CC[C@@H](C)n1ncc(NCc2sccc2Cl)c1C1CC1 ZINC000487575198 339758183 /nfs/dbraw/zinc/75/81/83/339758183.db2.gz QTQCXBVGKITSFF-SNVBAGLBSA-N 0 0 309.866 5.059 20 0 DKADRN FC(F)(F)Cc1ccccc1NCc1cc(Cl)cs1 ZINC000487578975 339758433 /nfs/dbraw/zinc/75/84/33/339758433.db2.gz ZFZGQPURRCRWEA-UHFFFAOYSA-N 0 0 305.752 5.118 20 0 DKADRN CC[C@@H](C)Sc1ccc(NC(=O)c2cscc2C)c(C)c1 ZINC000487733912 339762233 /nfs/dbraw/zinc/76/22/33/339762233.db2.gz BLKOUOUSVLWVHI-CYBMUJFWSA-N 0 0 319.495 5.508 20 0 DKADRN CC[C@H](C)Sc1ccc(NC(=O)c2cscc2C)c(C)c1 ZINC000487733914 333172339 /nfs/dbraw/zinc/17/23/39/333172339.db2.gz BLKOUOUSVLWVHI-ZDUSSCGKSA-N 0 0 319.495 5.508 20 0 DKADRN Cc1cccc(C(C)C)c1NC(=O)C/C=C/c1cccc(F)c1 ZINC000487770829 339762927 /nfs/dbraw/zinc/76/29/27/339762927.db2.gz WLKWZRHPTUBECU-RMKNXTFCSA-N 0 0 311.400 5.300 20 0 DKADRN Cc1cccc(C(C)C)c1NC(=O)C/C=C\c1cccc(F)c1 ZINC000487770830 339762930 /nfs/dbraw/zinc/76/29/30/339762930.db2.gz WLKWZRHPTUBECU-TWGQIWQCSA-N 0 0 311.400 5.300 20 0 DKADRN C/C=C\c1ccc(N[C@@H](C)c2nc(-c3cccs3)no2)cc1 ZINC000487889836 339765111 /nfs/dbraw/zinc/76/51/11/339765111.db2.gz ABXGTDQKGXVUGK-FHMRSRPSSA-N 0 0 311.410 5.004 20 0 DKADRN C/C=C\c1ccc(N[C@H](C)c2nc(-c3cccs3)no2)cc1 ZINC000487889837 339765143 /nfs/dbraw/zinc/76/51/43/339765143.db2.gz ABXGTDQKGXVUGK-KTLBGCOUSA-N 0 0 311.410 5.004 20 0 DKADRN C/C=C/c1ccc(N[C@H](C)c2nc(-c3cccs3)no2)cc1 ZINC000487889838 339765046 /nfs/dbraw/zinc/76/50/46/339765046.db2.gz ABXGTDQKGXVUGK-OGOUPESXSA-N 0 0 311.410 5.004 20 0 DKADRN C/C=C/c1ccc(N[C@@H](C)c2nc(-c3cccs3)no2)cc1 ZINC000487889839 339765129 /nfs/dbraw/zinc/76/51/29/339765129.db2.gz ABXGTDQKGXVUGK-PYEVWLCESA-N 0 0 311.410 5.004 20 0 DKADRN C/C=C/c1ccc(N[C@@H](C)C(=O)Nc2ccccc2C(C)C)cc1 ZINC000487895735 339765242 /nfs/dbraw/zinc/76/52/42/339765242.db2.gz KIXQFRPQWWJFSX-WHWKNOJMSA-N 0 0 322.452 5.282 20 0 DKADRN C/C=C\c1ccc(N[C@H](C)c2nnc(-c3ccc(C)cc3)o2)cc1 ZINC000487934190 339766287 /nfs/dbraw/zinc/76/62/87/339766287.db2.gz KCFWTAKDMSYCQJ-FOSCPCJNSA-N 0 0 319.408 5.251 20 0 DKADRN C/C=C/c1ccc(N[C@H](C)c2nnc(-c3ccc(C)cc3)o2)cc1 ZINC000487934191 339766245 /nfs/dbraw/zinc/76/62/45/339766245.db2.gz KCFWTAKDMSYCQJ-MBVDDHJVSA-N 0 0 319.408 5.251 20 0 DKADRN C[C@@H](NCc1csc(C2CCCC2)n1)c1cccc(Cl)c1 ZINC000487951083 339766573 /nfs/dbraw/zinc/76/65/73/339766573.db2.gz RIABKNKGOQAOHY-GFCCVEGCSA-N 0 0 320.889 5.305 20 0 DKADRN C/C=C/c1ccc(N[C@@H](C)c2ncc(-c3ccccc3)o2)cc1 ZINC000487969439 339767148 /nfs/dbraw/zinc/76/71/48/339767148.db2.gz POOLMTCQIAKLJO-MIOHMZDASA-N 0 0 304.393 5.548 20 0 DKADRN C[C@@H](Sc1ccccc1)c1ccc(NCCC(C)(C)O)cc1 ZINC000488108135 339770657 /nfs/dbraw/zinc/77/06/57/339770657.db2.gz IASSOUHHBNAENW-OAHLLOKOSA-N 0 0 315.482 5.113 20 0 DKADRN Cc1nc(CNc2cc(Cl)ccc2OC2CCCC2)cs1 ZINC000488124082 339771057 /nfs/dbraw/zinc/77/10/57/339771057.db2.gz JXVVKHJQCGMQIO-UHFFFAOYSA-N 0 0 322.861 5.038 20 0 DKADRN C[C@H](CC1CCCCC1)NC(=O)c1c(Cl)cccc1Cl ZINC000488132935 339771441 /nfs/dbraw/zinc/77/14/41/339771441.db2.gz WKCBBXFFUHMOOJ-LLVKDONJSA-N 0 0 314.256 5.082 20 0 DKADRN C[C@@H](Nc1cnn([C@@H](C)C2CC2)c1)c1cccc2ccccc21 ZINC000488141034 339771637 /nfs/dbraw/zinc/77/16/37/339771637.db2.gz BDZAAHUFYBELQT-CABCVRRESA-N 0 0 305.425 5.180 20 0 DKADRN C[C@H](Nc1cnn([C@@H](C)C2CC2)c1)c1cccc2ccccc21 ZINC000488141036 339771587 /nfs/dbraw/zinc/77/15/87/339771587.db2.gz BDZAAHUFYBELQT-GJZGRUSLSA-N 0 0 305.425 5.180 20 0 DKADRN Cc1ncc(CNc2ccccc2-c2c(F)cccc2F)s1 ZINC000488159579 339772153 /nfs/dbraw/zinc/77/21/53/339772153.db2.gz QRTRGHZCIPMDIF-UHFFFAOYSA-N 0 0 316.376 5.009 20 0 DKADRN C[C@H](Nc1cnn([C@@H](C)C2CC2)c1)c1ccc2ccccc2c1 ZINC000488160401 339772167 /nfs/dbraw/zinc/77/21/67/339772167.db2.gz STDNDOJRWTXLLM-GJZGRUSLSA-N 0 0 305.425 5.180 20 0 DKADRN Cc1csc(CNc2ccccc2-c2c(F)cccc2F)n1 ZINC000488171670 333365554 /nfs/dbraw/zinc/36/55/54/333365554.db2.gz ZGHUPISOUSUDGN-UHFFFAOYSA-N 0 0 316.376 5.009 20 0 DKADRN C[C@H](C1CC1)n1cc(N[C@@H](C)c2ccc(C(F)(F)F)cc2)cn1 ZINC000488206624 339773267 /nfs/dbraw/zinc/77/32/67/339773267.db2.gz WMUVLLWGOZXVFJ-NWDGAFQWSA-N 0 0 323.362 5.046 20 0 DKADRN Cc1nnc(S[C@H](C)c2ccc3ccccc3c2)n1C(C)C ZINC000488225890 339773857 /nfs/dbraw/zinc/77/38/57/339773857.db2.gz BOPVXTZYCLHBEH-CYBMUJFWSA-N 0 0 311.454 5.174 20 0 DKADRN Cc1cnc([C@H](C)SCc2c(Cl)cccc2Cl)cn1 ZINC000488232289 339773956 /nfs/dbraw/zinc/77/39/56/339773956.db2.gz OKNFSDCUDNOENR-JTQLQIEISA-N 0 0 313.253 5.086 20 0 DKADRN Cc1cnc([C@@H](C)SCc2c(Cl)cccc2Cl)cn1 ZINC000488232298 339774029 /nfs/dbraw/zinc/77/40/29/339774029.db2.gz OKNFSDCUDNOENR-SNVBAGLBSA-N 0 0 313.253 5.086 20 0 DKADRN CC[C@H](Sc1nnc(C)n1C(C)C)c1ccc(Cl)cc1 ZINC000488249797 339774480 /nfs/dbraw/zinc/77/44/80/339774480.db2.gz KBVGRQUSHRXUHA-AWEZNQCLSA-N 0 0 309.866 5.064 20 0 DKADRN Cc1cc(CS[C@H](C)c2ccc(Cl)c(Cl)c2)ncn1 ZINC000488254259 339774555 /nfs/dbraw/zinc/77/45/55/339774555.db2.gz RAXBRBJBYKOJFI-SNVBAGLBSA-N 0 0 313.253 5.086 20 0 DKADRN CC(C)c1noc([C@@H](C)Nc2cccc(-c3ccccc3)c2)n1 ZINC000488275303 339775244 /nfs/dbraw/zinc/77/52/44/339775244.db2.gz YFSJBGCTSHKLNR-CQSZACIVSA-N 0 0 307.397 5.033 20 0 DKADRN CCCOc1cc(C)ccc1NC(=O)c1ccc2ccccc2c1 ZINC000488285237 339775582 /nfs/dbraw/zinc/77/55/82/339775582.db2.gz YXCINOYUWMYJBC-UHFFFAOYSA-N 0 0 319.404 5.189 20 0 DKADRN Cc1cc(C)c(NC(=O)C/C=C/c2ccc(C(C)C)cc2)c(C)n1 ZINC000488295978 339775903 /nfs/dbraw/zinc/77/59/03/339775903.db2.gz QCJOPHBZCITZRD-VOTSOKGWSA-N 0 0 322.452 5.172 20 0 DKADRN c1coc(COCc2cccc(NC3CCC4(CC4)CC3)c2)c1 ZINC000488337173 339777527 /nfs/dbraw/zinc/77/75/27/339777527.db2.gz VSKYPNNBPFPSFH-UHFFFAOYSA-N 0 0 311.425 5.131 20 0 DKADRN Fc1ccc2cc(CNc3ccc(-c4nccs4)cc3)[nH]c2c1 ZINC000488342759 339777814 /nfs/dbraw/zinc/77/78/14/339777814.db2.gz BZQHQEISZXRNMC-UHFFFAOYSA-N 0 0 323.396 5.043 20 0 DKADRN CC(C)c1ccc(/C=C\CC(=O)N(C)[C@@H](C)c2ccco2)cc1 ZINC000488408194 339780042 /nfs/dbraw/zinc/78/00/42/339780042.db2.gz SOACCSUFWIZKJE-WRLNGNIRSA-N 0 0 311.425 5.026 20 0 DKADRN CC(C)c1ccc(/C=C/CC(=O)N(C)[C@@H](C)c2ccco2)cc1 ZINC000488408195 339780145 /nfs/dbraw/zinc/78/01/45/339780145.db2.gz SOACCSUFWIZKJE-YERXGYGTSA-N 0 0 311.425 5.026 20 0 DKADRN CCSc1cccc(C(=O)N(CC)c2ccccc2Cl)c1 ZINC000488431454 339781784 /nfs/dbraw/zinc/78/17/84/339781784.db2.gz AZQXEGIEUPDAKQ-UHFFFAOYSA-N 0 0 319.857 5.119 20 0 DKADRN CCCCc1noc([C@H](C)Nc2cccc(-c3ccccc3)c2)n1 ZINC000488432357 339781914 /nfs/dbraw/zinc/78/19/14/339781914.db2.gz UAQZZJYGCOKCSK-HNNXBMFYSA-N 0 0 321.424 5.252 20 0 DKADRN C[C@@H](Nc1cccc(-c2ccccc2)c1)c1nc(C(C)(C)C)no1 ZINC000488432961 339781913 /nfs/dbraw/zinc/78/19/13/339781913.db2.gz UUDZOBQUPLEPGS-CQSZACIVSA-N 0 0 321.424 5.207 20 0 DKADRN C[C@@H](Nc1ccc2scnc2c1)c1ccccc1OC(F)F ZINC000488486753 339785181 /nfs/dbraw/zinc/78/51/81/339785181.db2.gz YBVQEKQFBSCJNP-SNVBAGLBSA-N 0 0 320.364 5.071 20 0 DKADRN Fc1ccc2sc(-c3csc(-c4cccs4)n3)nc2c1 ZINC000488493573 339785394 /nfs/dbraw/zinc/78/53/94/339785394.db2.gz NBLXMRJPWQAQNA-UHFFFAOYSA-N 0 0 318.423 5.287 20 0 DKADRN C[C@@H](N[C@@H](C)c1cc(F)c(F)c(F)c1)c1ccccc1Cl ZINC000488500156 339785609 /nfs/dbraw/zinc/78/56/09/339785609.db2.gz CNVSHACXNGNINE-VHSXEESVSA-N 0 0 313.750 5.169 20 0 DKADRN C[C@H](Nc1ccc2scnc2c1)c1cccc(OC(F)F)c1 ZINC000488501365 339785611 /nfs/dbraw/zinc/78/56/11/339785611.db2.gz KNSBJAMCXBDQIC-JTQLQIEISA-N 0 0 320.364 5.071 20 0 DKADRN C[C@@H](Nc1ccc2scnc2c1)c1cccc(OC(F)F)c1 ZINC000488501367 339785667 /nfs/dbraw/zinc/78/56/67/339785667.db2.gz KNSBJAMCXBDQIC-SNVBAGLBSA-N 0 0 320.364 5.071 20 0 DKADRN Cc1ccc(-c2nnc(SCc3cc4ccccc4o3)o2)cc1 ZINC000488505166 339785783 /nfs/dbraw/zinc/78/57/83/339785783.db2.gz RBTSRVAALFJBBD-UHFFFAOYSA-N 0 0 322.389 5.084 20 0 DKADRN Cc1nc(C(C)C)sc1[C@@H](C)Nc1ccc2scnc2c1 ZINC000488505468 339785846 /nfs/dbraw/zinc/78/58/46/339785846.db2.gz MPHJYTHNBXDTFV-SNVBAGLBSA-N 0 0 317.483 5.358 20 0 DKADRN CCN(C(=O)c1cc2cccc(C)c2o1)c1cc(C)ccc1C ZINC000488612517 339789325 /nfs/dbraw/zinc/78/93/25/339789325.db2.gz OIULVNHWSMKEPA-UHFFFAOYSA-N 0 0 307.393 5.025 20 0 DKADRN CCCCOc1ccccc1NC(=O)c1cc2cccc(C)c2o1 ZINC000488654223 339789956 /nfs/dbraw/zinc/78/99/56/339789956.db2.gz JKQGCVLHFWNNOO-UHFFFAOYSA-N 0 0 323.392 5.172 20 0 DKADRN Cc1ccc(NC(=O)Nc2ccsc2Cl)cc1OC(C)C ZINC000488704529 339790867 /nfs/dbraw/zinc/79/08/67/339790867.db2.gz RBJQXOYBUVWRAI-UHFFFAOYSA-N 0 0 324.833 5.141 20 0 DKADRN FC(F)(F)c1ccc2oc(CSc3cccs3)nc2c1 ZINC000488710886 339790572 /nfs/dbraw/zinc/79/05/72/339790572.db2.gz GCRQHKYXGRXLLW-UHFFFAOYSA-N 0 0 315.341 5.200 20 0 DKADRN CCCN(C(=O)c1cc(C(C)C)on1)c1cccc2ccccc21 ZINC000488726094 339791527 /nfs/dbraw/zinc/79/15/27/339791527.db2.gz NEMASMCJPMSGEK-UHFFFAOYSA-N 0 0 322.408 5.008 20 0 DKADRN C[C@@H](c1ccc(C(C)(C)C)cc1)[S@@](=O)Cc1cccc(F)c1 ZINC000488731655 339791636 /nfs/dbraw/zinc/79/16/36/339791636.db2.gz UTTZHLAUWKZZPL-FPTDNZKUSA-N 0 0 318.457 5.133 20 0 DKADRN C[C@H](c1ccc(C(C)(C)C)cc1)[S@](=O)Cc1cccc(F)c1 ZINC000488731661 339791638 /nfs/dbraw/zinc/79/16/38/339791638.db2.gz UTTZHLAUWKZZPL-JLCFBVMHSA-N 0 0 318.457 5.133 20 0 DKADRN C[C@H](c1ccc(C(C)(C)C)cc1)[S@@](=O)Cc1cccc(F)c1 ZINC000488731663 339791591 /nfs/dbraw/zinc/79/15/91/339791591.db2.gz UTTZHLAUWKZZPL-PEBXRYMYSA-N 0 0 318.457 5.133 20 0 DKADRN C[C@@H](c1ccc(C(C)(C)C)cc1)[S@](=O)Cc1cccc(F)c1 ZINC000488731664 339791568 /nfs/dbraw/zinc/79/15/68/339791568.db2.gz UTTZHLAUWKZZPL-RCDICMHDSA-N 0 0 318.457 5.133 20 0 DKADRN C[C@H](c1ccc(C(C)(C)C)cc1)[S@@](=O)Cc1ccc(F)cc1 ZINC000488738080 333421566 /nfs/dbraw/zinc/42/15/66/333421566.db2.gz IGCCTPUMLOOFQK-PEBXRYMYSA-N 0 0 318.457 5.133 20 0 DKADRN C[C@H](c1ccc(C(C)(C)C)cc1)[S@](=O)Cc1ccccc1F ZINC000488767725 339792973 /nfs/dbraw/zinc/79/29/73/339792973.db2.gz FYGCACVJDCWGNX-JLCFBVMHSA-N 0 0 318.457 5.133 20 0 DKADRN C[C@@H](c1ccc(C(C)(C)C)cc1)[S@](=O)Cc1ccccc1F ZINC000488767730 339792971 /nfs/dbraw/zinc/79/29/71/339792971.db2.gz FYGCACVJDCWGNX-RCDICMHDSA-N 0 0 318.457 5.133 20 0 DKADRN CCC(C)(C)OCc1cccc(NC(=O)CC(C)(C)C)c1C ZINC000488775953 339793250 /nfs/dbraw/zinc/79/32/50/339793250.db2.gz MRSWASASQXIFBQ-UHFFFAOYSA-N 0 0 305.462 5.075 20 0 DKADRN CCCCCC(=O)Nc1cccc(COC(C)(C)CC)c1C ZINC000488816687 339794280 /nfs/dbraw/zinc/79/42/80/339794280.db2.gz LSYBFVMWDOJNOR-UHFFFAOYSA-N 0 0 305.462 5.219 20 0 DKADRN CCC[C@H](C)C(=O)Nc1cccc(COC(C)(C)CC)c1C ZINC000488825227 339794548 /nfs/dbraw/zinc/79/45/48/339794548.db2.gz NXGDUHJEJIPGHB-AWEZNQCLSA-N 0 0 305.462 5.075 20 0 DKADRN CCC[C@@H](C)C(=O)Nc1cccc(COC(C)(C)CC)c1C ZINC000488825229 339794495 /nfs/dbraw/zinc/79/44/95/339794495.db2.gz NXGDUHJEJIPGHB-CQSZACIVSA-N 0 0 305.462 5.075 20 0 DKADRN CCC(C)(C)OCc1cccc(NC(=O)C2CCCCC2)c1C ZINC000488836154 339794732 /nfs/dbraw/zinc/79/47/32/339794732.db2.gz AUAYIBWCMQWRAV-UHFFFAOYSA-N 0 0 317.473 5.219 20 0 DKADRN CCc1ccc([C@@H]2CCCCCN2C(=O)C[C@@H]2C=CCCC2)o1 ZINC000488996406 339799561 /nfs/dbraw/zinc/79/95/61/339799561.db2.gz LXLZABZRAUXLHC-AEFFLSMTSA-N 0 0 315.457 5.032 20 0 DKADRN CCc1ccc([C@@H]2CCCCCN2C(=O)C[C@H]2C=CCCC2)o1 ZINC000488996409 339799485 /nfs/dbraw/zinc/79/94/85/339799485.db2.gz LXLZABZRAUXLHC-WMZOPIPTSA-N 0 0 315.457 5.032 20 0 DKADRN C[C@@H](SCCOC(C)(C)C)c1ccc(Br)cc1 ZINC000489029623 339800287 /nfs/dbraw/zinc/80/02/87/339800287.db2.gz ZXQUSONPAFXUBU-LLVKDONJSA-N 0 0 317.292 5.058 20 0 DKADRN CC(C)[C@H](Sc1cccc2cccnc21)C(=O)c1ccccc1 ZINC000489063371 339801160 /nfs/dbraw/zinc/80/11/60/339801160.db2.gz IHZSWQXNOQJBRL-FQEVSTJZSA-N 0 0 321.445 5.234 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)N(C)[C@@H]1CC1(C)C ZINC000489089716 339801695 /nfs/dbraw/zinc/80/16/95/339801695.db2.gz HEGFZGZBDKLBRQ-MRXNPFEDSA-N 0 0 302.462 5.025 20 0 DKADRN Cc1cccc(Cl)c1CC(=O)Nc1c(C)cccc1C(C)C ZINC000489493158 339810762 /nfs/dbraw/zinc/81/07/62/339810762.db2.gz RNDLBMLCRVMYQP-UHFFFAOYSA-N 0 0 315.844 5.261 20 0 DKADRN Cc1cccc2c1[C@@H](C)C[C@H]2CC(=O)Nc1c(C)cccc1C ZINC000489499069 339810864 /nfs/dbraw/zinc/81/08/64/339810864.db2.gz NPFSRLDQQQJQNL-IRXDYDNUSA-N 0 0 307.437 5.231 20 0 DKADRN Cc1ccc(C[C@@H](C)C(=O)Nc2c(C)cccc2C(C)C)cc1 ZINC000489594460 339813772 /nfs/dbraw/zinc/81/37/72/339813772.db2.gz FRSUAWUHBVUBLS-QGZVFWFLSA-N 0 0 309.453 5.244 20 0 DKADRN Cc1ccc(NC(=O)N(C)[C@@H](c2ccccc2C)C(C)C)cc1 ZINC000489619357 339814376 /nfs/dbraw/zinc/81/43/76/339814376.db2.gz HJVYVRFXTFRHOR-LJQANCHMSA-N 0 0 310.441 5.164 20 0 DKADRN CCCc1nnc(S[C@@H](Cc2ccccc2)c2ccccc2)o1 ZINC000489620845 339814346 /nfs/dbraw/zinc/81/43/46/339814346.db2.gz RPBCSBYLBGTGGY-KRWDZBQOSA-N 0 0 324.449 5.098 20 0 DKADRN CCCc1nnc(S[C@H](Cc2ccccc2)c2ccccc2)o1 ZINC000489620846 339814448 /nfs/dbraw/zinc/81/44/48/339814448.db2.gz RPBCSBYLBGTGGY-QGZVFWFLSA-N 0 0 324.449 5.098 20 0 DKADRN CC(C)c1ccc(C(=O)Nc2cccc(-c3nccs3)c2)cc1 ZINC000489653837 339815197 /nfs/dbraw/zinc/81/51/97/339815197.db2.gz ZVZBRAOADDFQSC-UHFFFAOYSA-N 0 0 322.433 5.186 20 0 DKADRN CCCc1nnc(S[C@@H](c2ccccc2)c2ccccc2C)o1 ZINC000489663844 339815602 /nfs/dbraw/zinc/81/56/02/339815602.db2.gz IRZTXTVYJNRGNK-SFHVURJKSA-N 0 0 324.449 5.212 20 0 DKADRN CCCc1nnc(S[C@H](C)c2ccc(Cl)cc2Cl)o1 ZINC000489687283 339816164 /nfs/dbraw/zinc/81/61/64/339816164.db2.gz OVNAUNWBGSEUMC-MRVPVSSYSA-N 0 0 317.241 5.182 20 0 DKADRN CCCN(CCC)C(=O)Nc1cc(Cl)ccc1C(F)(F)F ZINC000489705801 339816519 /nfs/dbraw/zinc/81/65/19/339816519.db2.gz SNBBDNUXEKRXMI-UHFFFAOYSA-N 0 0 322.758 5.013 20 0 DKADRN CCC[C@@H](C)N(C)C(=O)Nc1cc(Cl)ccc1C(F)(F)F ZINC000489730114 339817041 /nfs/dbraw/zinc/81/70/41/339817041.db2.gz BIRXXMFGGKPGNI-SECBINFHSA-N 0 0 322.758 5.011 20 0 DKADRN CCC[C@H](C)N(C)C(=O)Nc1cc(Cl)ccc1C(F)(F)F ZINC000489730116 339817025 /nfs/dbraw/zinc/81/70/25/339817025.db2.gz BIRXXMFGGKPGNI-VIFPVBQESA-N 0 0 322.758 5.011 20 0 DKADRN Cc1cccc2c1[C@H](C)C[C@H]2CC(=O)Nc1c(C)cccc1F ZINC000489733050 339817109 /nfs/dbraw/zinc/81/71/09/339817109.db2.gz FVWMEHJGIXQDJG-CABCVRRESA-N 0 0 311.400 5.062 20 0 DKADRN Cc1cccc2c1[C@@H](C)C[C@H]2CC(=O)Nc1c(C)cccc1F ZINC000489733051 339817166 /nfs/dbraw/zinc/81/71/66/339817166.db2.gz FVWMEHJGIXQDJG-GJZGRUSLSA-N 0 0 311.400 5.062 20 0 DKADRN Cc1cccc2c1[C@H](C)C[C@@H]2CC(=O)Nc1c(C)cccc1F ZINC000489733052 339817089 /nfs/dbraw/zinc/81/70/89/339817089.db2.gz FVWMEHJGIXQDJG-HUUCEWRRSA-N 0 0 311.400 5.062 20 0 DKADRN Cc1cccc2c1[C@@H](C)C[C@@H]2CC(=O)Nc1c(C)cccc1F ZINC000489733053 339817156 /nfs/dbraw/zinc/81/71/56/339817156.db2.gz FVWMEHJGIXQDJG-LSDHHAIUSA-N 0 0 311.400 5.062 20 0 DKADRN C[C@@H](c1ccco1)N(C(=O)Nc1ccc(C2CCC2)cc1)C1CC1 ZINC000489750045 339817507 /nfs/dbraw/zinc/81/75/07/339817507.db2.gz YXGFSDFDQGIOHN-AWEZNQCLSA-N 0 0 324.424 5.305 20 0 DKADRN C[C@@H](c1ccccc1)N(C)C(=O)Nc1ccc(C2CCC2)cc1 ZINC000489769754 339818088 /nfs/dbraw/zinc/81/80/88/339818088.db2.gz DTFZNNPZOTWLQJ-HNNXBMFYSA-N 0 0 308.425 5.179 20 0 DKADRN C[C@H](c1ccccc1)N(C)C(=O)Nc1ccc(C2CCC2)cc1 ZINC000489769756 339818061 /nfs/dbraw/zinc/81/80/61/339818061.db2.gz DTFZNNPZOTWLQJ-OAHLLOKOSA-N 0 0 308.425 5.179 20 0 DKADRN C[C@H]1c2ccccc2CN1C(=O)Nc1ccc(C2CCC2)cc1 ZINC000489776780 339818207 /nfs/dbraw/zinc/81/82/07/339818207.db2.gz FBKDOXLABKFRAE-AWEZNQCLSA-N 0 0 306.409 5.063 20 0 DKADRN C[C@@H]1c2ccccc2CN1C(=O)Nc1ccc(C2CCC2)cc1 ZINC000489776781 339818206 /nfs/dbraw/zinc/81/82/06/339818206.db2.gz FBKDOXLABKFRAE-CQSZACIVSA-N 0 0 306.409 5.063 20 0 DKADRN O=C(Nc1ccc(C2CCC2)cc1)N1CCC[C@H]1c1ccccc1 ZINC000489788986 339818611 /nfs/dbraw/zinc/81/86/11/339818611.db2.gz JCNMOQCGDHUFJX-FQEVSTJZSA-N 0 0 320.436 5.323 20 0 DKADRN C[C@@H](c1cccs1)N(C)C(=O)Nc1ccc(C2CCC2)cc1 ZINC000489808593 339819069 /nfs/dbraw/zinc/81/90/69/339819069.db2.gz UTKCHLJXWMOPCF-ZDUSSCGKSA-N 0 0 314.454 5.241 20 0 DKADRN C[C@@H]1CN(C(=O)Nc2ccc(C3CCC3)cc2)[C@H]1c1ccccc1 ZINC000489817506 339819324 /nfs/dbraw/zinc/81/93/24/339819324.db2.gz MAUQICSRSMTRRV-FOIQADDNSA-N 0 0 320.436 5.179 20 0 DKADRN C[C@@H](N[C@@H](C1CC1)C(F)(F)F)c1cc(Cl)sc1Cl ZINC000489907859 339821019 /nfs/dbraw/zinc/82/10/19/339821019.db2.gz MRUSJKOYQWMLJT-ANLVUFKYSA-N 0 0 318.191 5.046 20 0 DKADRN C[C@H](N[C@@H](C1CC1)C(F)(F)F)c1cc(Cl)sc1Cl ZINC000489907863 339821012 /nfs/dbraw/zinc/82/10/12/339821012.db2.gz MRUSJKOYQWMLJT-CDUCUWFYSA-N 0 0 318.191 5.046 20 0 DKADRN CCSc1cccc(C(=O)Nc2c(C)cccc2Cl)c1 ZINC000489937276 339821763 /nfs/dbraw/zinc/82/17/63/339821763.db2.gz UAVUOGXNKGENLC-UHFFFAOYSA-N 0 0 305.830 5.013 20 0 DKADRN CCN(C(=O)c1ccc2ccccc2c1)c1cc(C)ccc1C ZINC000489953832 339822195 /nfs/dbraw/zinc/82/21/95/339822195.db2.gz DHMOOFMUSYVORX-UHFFFAOYSA-N 0 0 303.405 5.123 20 0 DKADRN CCN(C(=O)c1oc2ccccc2c1C)c1cc(C)ccc1C ZINC000489961728 339822358 /nfs/dbraw/zinc/82/23/58/339822358.db2.gz ZALXCOCQDIWBQU-UHFFFAOYSA-N 0 0 307.393 5.025 20 0 DKADRN CCN(C(=O)c1oc2ccccc2c1C)c1cc(C)cc(C)c1 ZINC000490188518 339828325 /nfs/dbraw/zinc/82/83/25/339828325.db2.gz UTTCLZVYSXMZON-UHFFFAOYSA-N 0 0 307.393 5.025 20 0 DKADRN Cc1occc1CN[C@H](c1ccccc1)c1ccc(Cl)cc1 ZINC000490191175 339828410 /nfs/dbraw/zinc/82/84/10/339828410.db2.gz QGYFRKRXWXSWQN-LJQANCHMSA-N 0 0 311.812 5.121 20 0 DKADRN CCC(C)(C)OCc1ccccc1NC(=O)C[C@H]1C=CCCC1 ZINC000490202175 339828696 /nfs/dbraw/zinc/82/86/96/339828696.db2.gz KMTSZLPHFIFTQA-INIZCTEOSA-N 0 0 315.457 5.077 20 0 DKADRN CCCCc1noc([C@@H](C)SCc2ccc(Cl)cc2)n1 ZINC000490241077 339829334 /nfs/dbraw/zinc/82/93/34/339829334.db2.gz GKBYSVGCHBOURR-LLVKDONJSA-N 0 0 310.850 5.060 20 0 DKADRN CCCCc1noc([C@H](C)SCc2ccc(Cl)cc2)n1 ZINC000490241086 339829363 /nfs/dbraw/zinc/82/93/63/339829363.db2.gz GKBYSVGCHBOURR-NSHDSACASA-N 0 0 310.850 5.060 20 0 DKADRN O=C(Nc1csc2ccccc12)c1occc1-c1ccccc1 ZINC000490253129 339829564 /nfs/dbraw/zinc/82/95/64/339829564.db2.gz SCKIOICZXTWZIH-UHFFFAOYSA-N 0 0 319.385 5.414 20 0 DKADRN CCC(C)(C)c1ccc(OCc2nnc(C(C)C)o2)c(Cl)c1 ZINC000490334000 339830747 /nfs/dbraw/zinc/83/07/47/339830747.db2.gz CNJWVEFXOHBYFT-UHFFFAOYSA-N 0 0 322.836 5.113 20 0 DKADRN Cc1ccccc1[C@@H](C(C)C)N(C)C(=O)N[C@@H](C)c1ccccc1 ZINC000490339617 339830697 /nfs/dbraw/zinc/83/06/97/339830697.db2.gz JUFSARVTKZBUFV-FXAWDEMLSA-N 0 0 324.468 5.095 20 0 DKADRN Cc1ccccc1[C@H](C(C)C)N(C)C(=O)N[C@@H](C)c1ccccc1 ZINC000490339626 339830739 /nfs/dbraw/zinc/83/07/39/339830739.db2.gz JUFSARVTKZBUFV-PXNSSMCTSA-N 0 0 324.468 5.095 20 0 DKADRN Cc1ccccc1[C@H](C(C)C)N(C)C(=O)N[C@H](C)c1ccccc1 ZINC000490339627 339830731 /nfs/dbraw/zinc/83/07/31/339830731.db2.gz JUFSARVTKZBUFV-XLIONFOSSA-N 0 0 324.468 5.095 20 0 DKADRN Cc1ccccc1[C@@H](C(C)C)N(C)C(=O)N[C@H](C)c1ccccc1 ZINC000490339630 339830734 /nfs/dbraw/zinc/83/07/34/339830734.db2.gz JUFSARVTKZBUFV-YLJYHZDGSA-N 0 0 324.468 5.095 20 0 DKADRN Cc1cccc(NC(=O)N(C)[C@H](c2ccccc2C)C(C)C)c1C ZINC000490396732 339831685 /nfs/dbraw/zinc/83/16/85/339831685.db2.gz HCYCSFXUNUUQLV-FQEVSTJZSA-N 0 0 324.468 5.473 20 0 DKADRN Fc1ccc(NCc2ncc(-c3cccs3)o2)cc1C1CC1 ZINC000490396877 339831652 /nfs/dbraw/zinc/83/16/52/339831652.db2.gz FUTCSQQOEPKOTO-UHFFFAOYSA-N 0 0 314.385 5.032 20 0 DKADRN CCc1ccccc1NC(=O)N(C)[C@H](c1ccccc1C)C(C)C ZINC000490397678 339831654 /nfs/dbraw/zinc/83/16/54/339831654.db2.gz JDTOUWPYMDYAOZ-FQEVSTJZSA-N 0 0 324.468 5.418 20 0 DKADRN CCc1ccccc1NC(=O)N(C)[C@@H](c1ccccc1C)C(C)C ZINC000490397679 339831721 /nfs/dbraw/zinc/83/17/21/339831721.db2.gz JDTOUWPYMDYAOZ-HXUWFJFHSA-N 0 0 324.468 5.418 20 0 DKADRN Cc1ccc2c(c1)[C@@H](N[C@H](C)c1csc(C(C)C)n1)CCC2 ZINC000490399771 339831832 /nfs/dbraw/zinc/83/18/32/339831832.db2.gz IQVMNROYQQVYFT-PBHICJAKSA-N 0 0 314.498 5.303 20 0 DKADRN Cc1c(Cl)cccc1C(=O)Nc1ccc(Cl)cc1Cl ZINC000490412143 339832173 /nfs/dbraw/zinc/83/21/73/339832173.db2.gz DOTOOZOVDMHBTL-UHFFFAOYSA-N 0 0 314.599 5.208 20 0 DKADRN Cc1cccc(C)c1NC(=O)N(C)[C@@H](c1ccccc1C)C(C)C ZINC000490433784 339832520 /nfs/dbraw/zinc/83/25/20/339832520.db2.gz OKPWDLMKEASSAR-HXUWFJFHSA-N 0 0 324.468 5.473 20 0 DKADRN Cc1ccccc1[C@H](CC(C)C)NC(=O)Nc1c(C)cccc1C ZINC000490435738 339832492 /nfs/dbraw/zinc/83/24/92/339832492.db2.gz QNRWPHVLQHFKOB-IBGZPJMESA-N 0 0 324.468 5.521 20 0 DKADRN O=C(Nc1cccc2ccccc21)C1(c2cccc(Cl)c2)CC1 ZINC000490550647 339834091 /nfs/dbraw/zinc/83/40/91/339834091.db2.gz XCARTHGQZWRILT-UHFFFAOYSA-N 0 0 321.807 5.164 20 0 DKADRN Cc1ccccc1NC(=O)N(C)[C@H](c1ccccc1C)C(C)C ZINC000490569065 339834509 /nfs/dbraw/zinc/83/45/09/339834509.db2.gz OIHXPVAKOVMQQI-IBGZPJMESA-N 0 0 310.441 5.164 20 0 DKADRN Cc1ccccc1NC(=O)N(C)[C@@H](c1ccccc1C)C(C)C ZINC000490569070 339834525 /nfs/dbraw/zinc/83/45/25/339834525.db2.gz OIHXPVAKOVMQQI-LJQANCHMSA-N 0 0 310.441 5.164 20 0 DKADRN Cc1cc(C)c(NC(=O)N[C@H](c2ccccc2C)C2CC2)c(C)c1 ZINC000490570663 339834556 /nfs/dbraw/zinc/83/45/56/339834556.db2.gz SPXDFOMAWPADOU-FQEVSTJZSA-N 0 0 322.452 5.193 20 0 DKADRN Cc1cccc(C(C)C)c1NC(=O)N1CCC[C@@H]1CC(C)(C)C ZINC000490746266 339839395 /nfs/dbraw/zinc/83/93/95/339839395.db2.gz OWFDRGVGXCGTJA-MRXNPFEDSA-N 0 0 316.489 5.551 20 0 DKADRN CC(C)(C)C[C@H]1CCCN1C(=O)Nc1ccccc1C(C)(C)C ZINC000490786009 339840406 /nfs/dbraw/zinc/84/04/06/339840406.db2.gz WBVZWQWQLPTPIT-OAHLLOKOSA-N 0 0 316.489 5.417 20 0 DKADRN Cc1ccc(Cl)cc1NC(=O)N1CCC[C@@H]1CC(C)(C)C ZINC000490790145 339840471 /nfs/dbraw/zinc/84/04/71/339840471.db2.gz FBTWFMIVUDRRMT-CQSZACIVSA-N 0 0 308.853 5.081 20 0 DKADRN Cc1cccc(C)c1NC(=O)N1CCC[C@@H]1CC1CCCCC1 ZINC000490801860 339840668 /nfs/dbraw/zinc/84/06/68/339840668.db2.gz XQNJCXCWCVEMHR-GOSISDBHSA-N 0 0 314.473 5.270 20 0 DKADRN Cc1c(Cl)cccc1NC(=O)N1CCC[C@@H]1CC(C)(C)C ZINC000490818368 339840966 /nfs/dbraw/zinc/84/09/66/339840966.db2.gz AYIKZHGFJJXZPB-CYBMUJFWSA-N 0 0 308.853 5.081 20 0 DKADRN CC(C)c1cccc(NC(=O)[C@H]2CCC[C@@H](C(F)(F)F)C2)c1 ZINC000490821730 339841167 /nfs/dbraw/zinc/84/11/67/339841167.db2.gz PKOLZIDPUKWDKY-UONOGXRCSA-N 0 0 313.363 5.117 20 0 DKADRN Cc1ccc(NC(=O)N2CCC[C@H]2CC(C)(C)C)c(Cl)c1 ZINC000490823875 339841151 /nfs/dbraw/zinc/84/11/51/339841151.db2.gz ISQRUTCHYGZKIF-ZDUSSCGKSA-N 0 0 308.853 5.081 20 0 DKADRN Cc1ccc(Cl)cc1NC(=O)Cc1csc2ccccc12 ZINC000490842671 339841703 /nfs/dbraw/zinc/84/17/03/339841703.db2.gz KYYUYBAZHXFVJS-UHFFFAOYSA-N 0 0 315.825 5.044 20 0 DKADRN CCN(CC)C(=O)Nc1ccc(Oc2cccc(Cl)c2)cc1 ZINC000490930566 339844019 /nfs/dbraw/zinc/84/40/19/339844019.db2.gz ANPOGRJPVPBJQA-UHFFFAOYSA-N 0 0 318.804 5.006 20 0 DKADRN CCCc1ccccc1NC(=O)N1CCC[C@@H]1CC(C)(C)C ZINC000490957065 339844799 /nfs/dbraw/zinc/84/47/99/339844799.db2.gz XNVQVWVEDVPEMI-MRXNPFEDSA-N 0 0 302.462 5.072 20 0 DKADRN CC[C@H](N[C@H](C)c1nc(C(C)(C)C)cs1)c1ccccc1F ZINC000491007476 339845892 /nfs/dbraw/zinc/84/58/92/339845892.db2.gz OGILFGPGOSLIOT-DOMZBBRYSA-N 0 0 320.477 5.382 20 0 DKADRN CC[C@@H](N[C@H](C)c1nc(C(C)(C)C)cs1)c1ccccc1F ZINC000491007484 339845890 /nfs/dbraw/zinc/84/58/90/339845890.db2.gz OGILFGPGOSLIOT-IUODEOHRSA-N 0 0 320.477 5.382 20 0 DKADRN CC(C)Sc1ccccc1C(=O)N(C)[C@@H](C)c1ccccc1 ZINC000491173103 339851990 /nfs/dbraw/zinc/85/19/90/339851990.db2.gz LAFBVNLXICTDOB-HNNXBMFYSA-N 0 0 313.466 5.020 20 0 DKADRN CC(C)Sc1ccccc1C(=O)N(C)[C@H](C)c1ccccc1 ZINC000491173106 339852002 /nfs/dbraw/zinc/85/20/02/339852002.db2.gz LAFBVNLXICTDOB-OAHLLOKOSA-N 0 0 313.466 5.020 20 0 DKADRN CC(C)c1cccc(C(C)C)c1NC(=O)/C=C\c1cscn1 ZINC000491383310 339860158 /nfs/dbraw/zinc/86/01/58/339860158.db2.gz KTGFKUXDPKMIRY-HJWRWDBZSA-N 0 0 314.454 5.042 20 0 DKADRN CCCN(C)C(=O)Nc1ccc(F)cc1-c1ccc(Cl)cc1 ZINC000491435742 339862053 /nfs/dbraw/zinc/86/20/53/339862053.db2.gz VUWLAPGRJRZTET-UHFFFAOYSA-N 0 0 320.795 5.020 20 0 DKADRN Cc1cc(Cl)ccc1CNc1cccc(-c2ncco2)c1C ZINC000491528737 339865568 /nfs/dbraw/zinc/86/55/68/339865568.db2.gz FHENEABRLRWPMR-UHFFFAOYSA-N 0 0 312.800 5.224 20 0 DKADRN Cc1cc(CNc2cccc(-c3ncco3)c2C)ccc1Cl ZINC000491534678 339865683 /nfs/dbraw/zinc/86/56/83/339865683.db2.gz WEPKRRKUAUXEPL-UHFFFAOYSA-N 0 0 312.800 5.224 20 0 DKADRN Cc1c(NCc2ccc(OC(C)C)cc2)cccc1-c1ncco1 ZINC000491572307 339867461 /nfs/dbraw/zinc/86/74/61/339867461.db2.gz LZGNKFOUAQSPDJ-UHFFFAOYSA-N 0 0 322.408 5.049 20 0 DKADRN CCCOc1cccc(CNc2cccc(-c3ncco3)c2C)c1 ZINC000491580443 339867754 /nfs/dbraw/zinc/86/77/54/339867754.db2.gz BKPOUMWVQVLZAL-UHFFFAOYSA-N 0 0 322.408 5.051 20 0 DKADRN Cc1c(NCc2ccc3occc3c2)cccc1-c1ncco1 ZINC000491582057 339867897 /nfs/dbraw/zinc/86/78/97/339867897.db2.gz SYYXVOLZSIPRLH-UHFFFAOYSA-N 0 0 304.349 5.008 20 0 DKADRN Cc1c(NCc2cccc(OC(C)C)c2)cccc1-c1ncco1 ZINC000491585350 339867932 /nfs/dbraw/zinc/86/79/32/339867932.db2.gz CDMSSABFVNNKIZ-UHFFFAOYSA-N 0 0 322.408 5.049 20 0 DKADRN Cc1c(NCc2coc3ccccc23)cccc1-c1ncco1 ZINC000491594280 339868224 /nfs/dbraw/zinc/86/82/24/339868224.db2.gz OPJRXKBUAKLBOH-UHFFFAOYSA-N 0 0 304.349 5.008 20 0 DKADRN Cc1c(NCc2ccc(F)c(Cl)c2)cccc1-c1ncco1 ZINC000491595696 339868360 /nfs/dbraw/zinc/86/83/60/339868360.db2.gz COZSMHBBWUVBHL-UHFFFAOYSA-N 0 0 316.763 5.055 20 0 DKADRN Cc1c(NCc2cc3ccccc3s2)cccc1-c1ncco1 ZINC000491596010 339868348 /nfs/dbraw/zinc/86/83/48/339868348.db2.gz GQPYQWGKSVPOOZ-UHFFFAOYSA-N 0 0 320.417 5.477 20 0 DKADRN CC(C)c1ccccc1NC(=O)C[C@H](C)c1c[nH]c2ccccc21 ZINC000491871183 339885615 /nfs/dbraw/zinc/88/56/15/339885615.db2.gz NQVCMWQKGIDREZ-HNNXBMFYSA-N 0 0 320.436 5.424 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)/C=C/c1ccc(C)cn1 ZINC000492032609 339889643 /nfs/dbraw/zinc/88/96/43/339889643.db2.gz PEGTUPADNORTGX-OUKQBFOZSA-N 0 0 322.452 5.118 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)/C=C\c1ccc(C)cn1 ZINC000492032611 339889671 /nfs/dbraw/zinc/88/96/71/339889671.db2.gz PEGTUPADNORTGX-SEYXRHQNSA-N 0 0 322.452 5.118 20 0 DKADRN CCCc1ccccc1NC(=O)[C@@H]1C[C@@H]1c1cccc(Cl)c1 ZINC000492037182 339889742 /nfs/dbraw/zinc/88/97/42/339889742.db2.gz AARGNSLNFNJGDB-IAGOWNOFSA-N 0 0 313.828 5.035 20 0 DKADRN CCCc1ccccc1NC(=O)[C@H]1C[C@H]1c1cccc(Cl)c1 ZINC000492037183 339889760 /nfs/dbraw/zinc/88/97/60/339889760.db2.gz AARGNSLNFNJGDB-IRXDYDNUSA-N 0 0 313.828 5.035 20 0 DKADRN CCCc1ccccc1NC(=O)[C@H]1C[C@@H]1c1cccc(Cl)c1 ZINC000492037184 339889702 /nfs/dbraw/zinc/88/97/02/339889702.db2.gz AARGNSLNFNJGDB-SJORKVTESA-N 0 0 313.828 5.035 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)/C=C\c1ncccc1C ZINC000492039164 339889877 /nfs/dbraw/zinc/88/98/77/339889877.db2.gz HVPKLULONOQDSU-SEYXRHQNSA-N 0 0 322.452 5.118 20 0 DKADRN O=C(Nc1csc2ccccc12)Nc1ccc2[nH]ccc2c1 ZINC000492122470 339892070 /nfs/dbraw/zinc/89/20/70/339892070.db2.gz NLWCZRLOYWIEEO-UHFFFAOYSA-N 0 0 307.378 5.027 20 0 DKADRN CC(C)c1cccc(NC(=O)[C@@H]2CCCC[C@@H]2C(F)(F)F)c1 ZINC000492266196 339895846 /nfs/dbraw/zinc/89/58/46/339895846.db2.gz SMUAJJMPGJPTMJ-CABCVRRESA-N 0 0 313.363 5.117 20 0 DKADRN CC(C)c1cccc(NC(=O)[C@@H]2CCCC[C@H]2C(F)(F)F)c1 ZINC000492266198 339895847 /nfs/dbraw/zinc/89/58/47/339895847.db2.gz SMUAJJMPGJPTMJ-HUUCEWRRSA-N 0 0 313.363 5.117 20 0 DKADRN Cc1c(Cl)cccc1NC(=O)Cc1csc2ccccc12 ZINC000492669367 339906500 /nfs/dbraw/zinc/90/65/00/339906500.db2.gz OEPUHZQJXVSLGW-UHFFFAOYSA-N 0 0 315.825 5.044 20 0 DKADRN Cc1c(Cl)cccc1NC(=O)[C@H]1C[C@H]1c1cccc(Cl)c1 ZINC000492776787 339908536 /nfs/dbraw/zinc/90/85/36/339908536.db2.gz FOTRLBNBHZWRDY-KBPBESRZSA-N 0 0 320.219 5.044 20 0 DKADRN Cc1ccc(NC(=O)Cc2csc3ccccc23)c(Cl)c1 ZINC000492852478 339910677 /nfs/dbraw/zinc/91/06/77/339910677.db2.gz YUMRUVJBQGUADI-UHFFFAOYSA-N 0 0 315.825 5.044 20 0 DKADRN CC(C)c1ccc(/C=C/CC(=O)N2CC[C@H]2c2ccccc2)cc1 ZINC000493110856 339917480 /nfs/dbraw/zinc/91/74/80/339917480.db2.gz BKJXYQQVYASZQT-BXKJMJEDSA-N 0 0 319.448 5.187 20 0 DKADRN CC(C)c1ccc(/C=C/CC(=O)N2CC[C@@H]2c2ccccc2)cc1 ZINC000493110857 339917475 /nfs/dbraw/zinc/91/74/75/339917475.db2.gz BKJXYQQVYASZQT-IRUYWQDXSA-N 0 0 319.448 5.187 20 0 DKADRN C[C@H](CCCC(F)(F)F)NC(=O)Nc1cccc2ccccc21 ZINC000493211181 339919891 /nfs/dbraw/zinc/91/98/91/339919891.db2.gz OXAOFQMRDDDWPC-GFCCVEGCSA-N 0 0 324.346 5.082 20 0 DKADRN C[C@@H](CCCC(F)(F)F)NC(=O)Nc1cccc2ccccc21 ZINC000493211182 339919877 /nfs/dbraw/zinc/91/98/77/339919877.db2.gz OXAOFQMRDDDWPC-LBPRGKRZSA-N 0 0 324.346 5.082 20 0 DKADRN CSc1ccccc1NC(=O)C[C@@H](C)c1c[nH]c2ccccc21 ZINC000493250649 339921062 /nfs/dbraw/zinc/92/10/62/339921062.db2.gz DPIANDVVYRGFTA-CYBMUJFWSA-N 0 0 324.449 5.022 20 0 DKADRN CC(C)c1ccccc1NC(=O)N[C@H](C)CCCC(F)(F)F ZINC000493309914 339922751 /nfs/dbraw/zinc/92/27/51/339922751.db2.gz HEGQIPLDDPTTLF-GFCCVEGCSA-N 0 0 316.367 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/nfs/dbraw/zinc/93/76/08/339937608.db2.gz SQHCGEIBFSAVJS-WWGRRREGSA-N 0 0 314.454 5.086 20 0 DKADRN C[C@@H]1C[C@H]2CCCC[C@H]2N1C(=O)Nc1csc2ccccc12 ZINC000493965573 339937622 /nfs/dbraw/zinc/93/76/22/339937622.db2.gz SQHCGEIBFSAVJS-XJKCOSOUSA-N 0 0 314.454 5.086 20 0 DKADRN Cc1nc2ccc(CNc3ccccc3OC(C)C)cc2s1 ZINC000494025674 339939318 /nfs/dbraw/zinc/93/93/18/339939318.db2.gz DEWXDPHMNNUVRC-UHFFFAOYSA-N 0 0 312.438 5.004 20 0 DKADRN CC[C@@H](Sc1nnc(-c2ccc(C)c(C)c2)o1)c1ccccc1 ZINC000494051449 339939858 /nfs/dbraw/zinc/93/98/58/339939858.db2.gz XQEOZLALACWLDP-QGZVFWFLSA-N 0 0 324.449 5.597 20 0 DKADRN CCCCc1noc([C@H](C)S[C@H](C)c2ccccc2F)n1 ZINC000494073699 339940429 /nfs/dbraw/zinc/94/04/29/339940429.db2.gz AOOKLGRPPZQITO-NEPJUHHUSA-N 0 0 308.422 5.107 20 0 DKADRN CC[C@H](Sc1nnc(-c2ccccc2C)n1C)c1ccccc1 ZINC000494073860 339940430 /nfs/dbraw/zinc/94/04/30/339940430.db2.gz BSPQHPMCLKTJDB-KRWDZBQOSA-N 0 0 323.465 5.034 20 0 DKADRN c1ccc2cc(-c3nnc(SC4CCCCC4)o3)ccc2c1 ZINC000494091767 339940820 /nfs/dbraw/zinc/94/08/20/339940820.db2.gz GCCIHCYPSGHOHS-UHFFFAOYSA-N 0 0 310.422 5.315 20 0 DKADRN Cc1ccc(NC(=O)[C@H]2C[C@H]2c2cccc(Cl)c2)c(Cl)c1 ZINC000494106007 339941133 /nfs/dbraw/zinc/94/11/33/339941133.db2.gz MPGJILJZYKDAQU-KBPBESRZSA-N 0 0 320.219 5.044 20 0 DKADRN Cc1cc(C)c(NC(=O)[C@@H]2C[C@@H]2c2cccc(Cl)c2)c(C)c1 ZINC000494124912 339941537 /nfs/dbraw/zinc/94/15/37/339941537.db2.gz BRFHPTRSGFAEPG-IAGOWNOFSA-N 0 0 313.828 5.007 20 0 DKADRN CC(C)c1ccc(NC(=O)N[C@H](C)CCCC(F)(F)F)cc1 ZINC000494159564 339942365 /nfs/dbraw/zinc/94/23/65/339942365.db2.gz CLKJDNSEGBEXFV-GFCCVEGCSA-N 0 0 316.367 5.053 20 0 DKADRN CC(C)c1ccc(NC(=O)N[C@@H](C)CCCC(F)(F)F)cc1 ZINC000494159566 339942462 /nfs/dbraw/zinc/94/24/62/339942462.db2.gz CLKJDNSEGBEXFV-LBPRGKRZSA-N 0 0 316.367 5.053 20 0 DKADRN CCCc1csc(CNc2ccccc2SC(C)C)n1 ZINC000494172939 339942718 /nfs/dbraw/zinc/94/27/18/339942718.db2.gz NZUDOCYWTSZHHW-UHFFFAOYSA-N 0 0 306.500 5.208 20 0 DKADRN CCCc1csc(CN[C@H](CCC)c2ccc(F)cc2F)n1 ZINC000494197772 339943403 /nfs/dbraw/zinc/94/34/03/339943403.db2.gz IHEAZXXLOCZFHU-MRXNPFEDSA-N 0 0 324.440 5.005 20 0 DKADRN CCCC(C)(C)CC(=O)N(Cc1ccco1)Cc1cccs1 ZINC000494257327 339944966 /nfs/dbraw/zinc/94/49/66/339944966.db2.gz QGTMLQMMVUYTFV-UHFFFAOYSA-N 0 0 319.470 5.086 20 0 DKADRN CCCc1csc(CN[C@@H](C)c2ccc(C(C)C)cc2)n1 ZINC000494344702 339947086 /nfs/dbraw/zinc/94/70/86/339947086.db2.gz DSZNRWITKFVJNX-AWEZNQCLSA-N 0 0 302.487 5.070 20 0 DKADRN CCCc1csc(CN[C@@H](C)c2ccc(SCC)cc2)n1 ZINC000494349501 339947078 /nfs/dbraw/zinc/94/70/78/339947078.db2.gz MNRDIODNODJLKK-ZDUSSCGKSA-N 0 0 320.527 5.058 20 0 DKADRN C[C@@H](C1CC1)n1cc(NCc2cc(-c3ccccc3)cs2)cn1 ZINC000494450196 339949538 /nfs/dbraw/zinc/94/95/38/339949538.db2.gz CMSMDHMKVIDUGH-AWEZNQCLSA-N 0 0 323.465 5.195 20 0 DKADRN C[C@H](C1CC1)n1cc(NCc2cc(-c3ccccc3)cs2)cn1 ZINC000494450200 339949612 /nfs/dbraw/zinc/94/96/12/339949612.db2.gz CMSMDHMKVIDUGH-CQSZACIVSA-N 0 0 323.465 5.195 20 0 DKADRN COc1cc(C)cc(N[C@@H](C)c2csc(C(C)C)n2)c1C ZINC000494451497 339949710 /nfs/dbraw/zinc/94/97/10/339949710.db2.gz HHJBPTXPWPVVGJ-ZDUSSCGKSA-N 0 0 304.459 5.065 20 0 DKADRN Cc1c([C@H](C)Nc2ccc(C)c(OC(C)C)c2)cnn1C(C)C ZINC000494468223 339950374 /nfs/dbraw/zinc/95/03/74/339950374.db2.gz ILJPGIFUAQWBCT-HNNXBMFYSA-N 0 0 315.461 5.041 20 0 DKADRN Cc1c([C@@H](C)Nc2ccc(C)c(OC(C)C)c2)cnn1C(C)C ZINC000494468230 339950315 /nfs/dbraw/zinc/95/03/15/339950315.db2.gz ILJPGIFUAQWBCT-OAHLLOKOSA-N 0 0 315.461 5.041 20 0 DKADRN Cc1nc(C)c([C@@H](C)Nc2ccc(C)c(OC(C)C)c2)s1 ZINC000494475600 339950545 /nfs/dbraw/zinc/95/05/45/339950545.db2.gz MQTLXQDEDHCPJA-CYBMUJFWSA-N 0 0 304.459 5.029 20 0 DKADRN Cc1cscc1CN[C@@H](C)c1nc(-c2ccccc2)cs1 ZINC000494480150 339950836 /nfs/dbraw/zinc/95/08/36/339950836.db2.gz YIUGXBPMSSDZAH-ZDUSSCGKSA-N 0 0 314.479 5.031 20 0 DKADRN Cc1ccc(N[C@@H](C)c2ccc(Cl)cn2)cc1OC(C)C ZINC000494482105 339950923 /nfs/dbraw/zinc/95/09/23/339950923.db2.gz DMUJGAUJGYWRIK-ZDUSSCGKSA-N 0 0 304.821 5.004 20 0 DKADRN Cc1ccccc1NC(=O)C[C@@H](C)Nc1ccc(C2CCC2)cc1 ZINC000494489956 339951129 /nfs/dbraw/zinc/95/11/29/339951129.db2.gz BRUKXUIERBKZHR-MRXNPFEDSA-N 0 0 322.452 5.092 20 0 DKADRN Cc1nc2c(s1)[C@@H](Nc1ccc(C)c(OC(C)C)c1)CCC2 ZINC000494498221 339951614 /nfs/dbraw/zinc/95/16/14/339951614.db2.gz ZGKJSYNDJVTJEQ-INIZCTEOSA-N 0 0 316.470 5.037 20 0 DKADRN Cc1nc2c(s1)[C@H](Nc1ccc(C)c(OC(C)C)c1)CCC2 ZINC000494498222 339951670 /nfs/dbraw/zinc/95/16/70/339951670.db2.gz ZGKJSYNDJVTJEQ-MRXNPFEDSA-N 0 0 316.470 5.037 20 0 DKADRN C[C@@H]1CC[C@H](C(=O)Nc2ccccc2-c2c(F)cccc2F)C1 ZINC000494500751 339951666 /nfs/dbraw/zinc/95/16/66/339951666.db2.gz FYEMSFMOQKAWEJ-OLZOCXBDSA-N 0 0 315.363 5.007 20 0 DKADRN Fc1ccc([C@@H](Nc2ccc(C3CCC3)cc2)c2ncc[nH]2)cc1 ZINC000494502791 339951733 /nfs/dbraw/zinc/95/17/33/339951733.db2.gz KOWWTQHXICQZKK-LJQANCHMSA-N 0 0 321.399 5.018 20 0 DKADRN CC(=O)Nc1ccc([C@@H](C)Nc2ccc(C3CCC3)cc2)cc1 ZINC000494508389 339952037 /nfs/dbraw/zinc/95/20/37/339952037.db2.gz SOBIKWBXFKLMOY-CQSZACIVSA-N 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KPLKBCHRBHDPLX-NSHDSACASA-N 0 0 316.763 5.307 20 0 DKADRN CCCCCC(=O)Nc1ccccc1-c1c(F)cccc1F ZINC000494528267 339952724 /nfs/dbraw/zinc/95/27/24/339952724.db2.gz DHGRUSYCNYTLNS-UHFFFAOYSA-N 0 0 303.352 5.151 20 0 DKADRN Cc1ccoc1CNC(=O)Nc1c(C(C)C)cccc1C(C)C ZINC000494590202 339954369 /nfs/dbraw/zinc/95/43/69/339954369.db2.gz DDNPSECVWRMOKP-UHFFFAOYSA-N 0 0 314.429 5.157 20 0 DKADRN Cc1ccc(C(=O)Nc2ccc(OC(C)(C)C)cc2)c(Cl)c1 ZINC000494671456 339957355 /nfs/dbraw/zinc/95/73/55/339957355.db2.gz CZMARXMANVQYHK-UHFFFAOYSA-N 0 0 317.816 5.078 20 0 DKADRN CCSc1cccc(NC(=O)c2ccc(C)cc2Cl)c1 ZINC000494684955 339957599 /nfs/dbraw/zinc/95/75/99/339957599.db2.gz LFUNHXBVDFWLIH-UHFFFAOYSA-N 0 0 305.830 5.013 20 0 DKADRN Cc1cc(C)c(NC(=O)C[C@H](C)c2c[nH]c3ccccc32)c(C)c1 ZINC000494812164 339961144 /nfs/dbraw/zinc/96/11/44/339961144.db2.gz SVQJFHXBUSHAJG-AWEZNQCLSA-N 0 0 320.436 5.225 20 0 DKADRN Cc1cc(C)c(NC(=O)C[C@@H](C)c2c[nH]c3ccccc32)c(C)c1 ZINC000494812168 339961149 /nfs/dbraw/zinc/96/11/49/339961149.db2.gz SVQJFHXBUSHAJG-CQSZACIVSA-N 0 0 320.436 5.225 20 0 DKADRN Cc1nc2ccc(CNc3cccc(C(C)(F)F)c3)cc2s1 ZINC000494844742 339962133 /nfs/dbraw/zinc/96/21/33/339962133.db2.gz JPEVADFRVCTPCN-UHFFFAOYSA-N 0 0 318.392 5.329 20 0 DKADRN CCc1cc(C)c(C(=O)Nc2cccc(Nc3ccccc3)c2)o1 ZINC000494956252 339967126 /nfs/dbraw/zinc/96/71/26/339967126.db2.gz UASGJNBSPQSCLR-UHFFFAOYSA-N 0 0 320.392 5.146 20 0 DKADRN CC[C@@H](Nc1cccc(OC2CCCC2)c1)c1ccc(F)cn1 ZINC000494957736 339967110 /nfs/dbraw/zinc/96/71/10/339967110.db2.gz VSRJMYWYUNALNV-GOSISDBHSA-N 0 0 314.404 5.105 20 0 DKADRN CC[C@H](Nc1cccc(OC2CCCC2)c1)c1ccc(F)cn1 ZINC000494957738 339967018 /nfs/dbraw/zinc/96/70/18/339967018.db2.gz VSRJMYWYUNALNV-SFHVURJKSA-N 0 0 314.404 5.105 20 0 DKADRN CC(=O)Nc1cccc(N[C@H](c2ccccc2C)C2CCCC2)c1 ZINC000495076039 339972802 /nfs/dbraw/zinc/97/28/02/339972802.db2.gz XBQNNVJMJGNWAU-NRFANRHFSA-N 0 0 322.452 5.297 20 0 DKADRN CC[C@@H](Nc1cccc(-c2cccs2)c1)c1ccc(F)cn1 ZINC000495090487 339973698 /nfs/dbraw/zinc/97/36/98/339973698.db2.gz PUBYMWSVCJWXPS-MRXNPFEDSA-N 0 0 312.413 5.512 20 0 DKADRN Cc1ccc([C@H](C)Nc2cnn(CC(C)C)c2C(F)F)s1 ZINC000495107286 339974671 /nfs/dbraw/zinc/97/46/71/339974671.db2.gz IKOHFZWWSVWHSY-NSHDSACASA-N 0 0 313.417 5.020 20 0 DKADRN CC[C@H](Nc1cnn(CC(C)C)c1C(F)F)c1cccs1 ZINC000495126378 339975448 /nfs/dbraw/zinc/97/54/48/339975448.db2.gz GSQZPCOMCKKLKT-NSHDSACASA-N 0 0 313.417 5.101 20 0 DKADRN CCCc1cc(C(=O)N(C)c2ccc(SC)cc2)sc1C ZINC000495129875 339975677 /nfs/dbraw/zinc/97/56/77/339975677.db2.gz UWOYTSDAGXFXDO-UHFFFAOYSA-N 0 0 319.495 5.008 20 0 DKADRN CC[C@@H](C)Oc1ccc(C(=O)Nc2cccc(C(F)F)c2)cc1 ZINC000495134289 339975894 /nfs/dbraw/zinc/97/58/94/339975894.db2.gz BSVOGIUHRCIXET-GFCCVEGCSA-N 0 0 319.351 5.054 20 0 DKADRN CC[C@H](C)Oc1ccc(C(=O)Nc2cccc(C(F)F)c2)cc1 ZINC000495134290 339975895 /nfs/dbraw/zinc/97/58/95/339975895.db2.gz BSVOGIUHRCIXET-LBPRGKRZSA-N 0 0 319.351 5.054 20 0 DKADRN Cc1cc(C)c(NC(=O)N2CCC[C@H]2CCC(C)C)c(C)c1 ZINC000495135464 339975952 /nfs/dbraw/zinc/97/59/52/339975952.db2.gz GLOPJPGFYJLRRL-KRWDZBQOSA-N 0 0 302.462 5.044 20 0 DKADRN Cc1cc(C)c(NC(=O)N2CCC[C@@H]2CCC(C)C)c(C)c1 ZINC000495135466 339975892 /nfs/dbraw/zinc/97/58/92/339975892.db2.gz GLOPJPGFYJLRRL-QGZVFWFLSA-N 0 0 302.462 5.044 20 0 DKADRN CCC[C@@H](C)[C@@H]1CCCN1C(=O)Nc1c(C)cccc1C(C)C ZINC000495136022 339975956 /nfs/dbraw/zinc/97/59/56/339975956.db2.gz HJXPEWQCSSPNOK-QAPCUYQASA-N 0 0 316.489 5.551 20 0 DKADRN CCC[C@H](C)[C@@H]1CCCN1C(=O)Nc1c(C)cc(C)cc1C ZINC000495137264 339976008 /nfs/dbraw/zinc/97/60/08/339976008.db2.gz LDYRIHNFDBIBEU-YOEHRIQHSA-N 0 0 302.462 5.044 20 0 DKADRN CCCCC[C@H]1CCCN1C(=O)Nc1c(C)cc(C)cc1C ZINC000495142074 339976084 /nfs/dbraw/zinc/97/60/84/339976084.db2.gz WNBPHTFYLVYYIE-KRWDZBQOSA-N 0 0 302.462 5.188 20 0 DKADRN CCCCC[C@@H]1CCCN1C(=O)Nc1c(C)cc(C)cc1C ZINC000495142075 339976065 /nfs/dbraw/zinc/97/60/65/339976065.db2.gz WNBPHTFYLVYYIE-QGZVFWFLSA-N 0 0 302.462 5.188 20 0 DKADRN CC(C)[C@H](c1ccccc1)N(C)C(=O)c1cccc(C(F)F)c1 ZINC000495148636 339976373 /nfs/dbraw/zinc/97/63/73/339976373.db2.gz ORDVHUJCWKCLIT-QGZVFWFLSA-N 0 0 317.379 5.094 20 0 DKADRN Cc1ccc([C@H](C)N(C)C(=O)Nc2cc(Cl)ccc2C)cc1 ZINC000495150734 339976518 /nfs/dbraw/zinc/97/65/18/339976518.db2.gz LDMPLZVLCHRHQV-AWEZNQCLSA-N 0 0 316.832 5.182 20 0 DKADRN CCC[C@H](C)[C@H]1CCCN1C(=O)Nc1ccccc1C(C)(C)C ZINC000495161242 339977093 /nfs/dbraw/zinc/97/70/93/339977093.db2.gz YNDBKQQYDCBSSQ-MAUKXSAKSA-N 0 0 316.489 5.417 20 0 DKADRN CCSCc1cccc(N[C@H](CC)c2ccc(F)cn2)c1 ZINC000495171219 339977670 /nfs/dbraw/zinc/97/76/70/339977670.db2.gz ZGIZMIXQGFVASF-MRXNPFEDSA-N 0 0 304.434 5.037 20 0 DKADRN CC[C@@H](Nc1ccc(SC)c(Cl)c1)c1ccc(F)cn1 ZINC000495184052 339978148 /nfs/dbraw/zinc/97/81/48/339978148.db2.gz NGKIOAKGTQUMRN-CYBMUJFWSA-N 0 0 310.825 5.159 20 0 DKADRN Cc1ccc([C@@H](C)N(C)C(=O)[C@H](C)c2ccc(Cl)s2)cc1 ZINC000495193008 339978404 /nfs/dbraw/zinc/97/84/04/339978404.db2.gz PKPDAQIMSXBMKS-CHWSQXEVSA-N 0 0 321.873 5.033 20 0 DKADRN Cc1ccc([C@H](C)N(C)C(=O)[C@H](C)c2ccc(Cl)s2)cc1 ZINC000495193009 339978395 /nfs/dbraw/zinc/97/83/95/339978395.db2.gz PKPDAQIMSXBMKS-OLZOCXBDSA-N 0 0 321.873 5.033 20 0 DKADRN COc1cc(N[C@H](C)c2sccc2C)cc(OC)c1C(C)C ZINC000495368864 339981643 /nfs/dbraw/zinc/98/16/43/339981643.db2.gz LJVCKWGBUJPBMC-CYBMUJFWSA-N 0 0 319.470 5.370 20 0 DKADRN COc1cc(N[C@@H](C)c2sccc2C)cc(OC)c1C(C)C ZINC000495368865 339981646 /nfs/dbraw/zinc/98/16/46/339981646.db2.gz LJVCKWGBUJPBMC-ZDUSSCGKSA-N 0 0 319.470 5.370 20 0 DKADRN CSc1cccc(NC(=O)Nc2cccc(F)c2Cl)c1C ZINC000495380700 339982224 /nfs/dbraw/zinc/98/22/24/339982224.db2.gz RIPKXTNITWEAON-UHFFFAOYSA-N 0 0 324.808 5.153 20 0 DKADRN COc1cc(N[C@H](C)c2cccc(F)c2)cc(OC)c1C(C)C ZINC000495386325 339982325 /nfs/dbraw/zinc/98/23/25/339982325.db2.gz UVYMFQMJWGARDS-CYBMUJFWSA-N 0 0 317.404 5.139 20 0 DKADRN CCc1nc(C)c([C@@H](C)Nc2csc3ccccc23)s1 ZINC000495391800 339982431 /nfs/dbraw/zinc/98/24/31/339982431.db2.gz SKKAOYGLUHFGEH-SNVBAGLBSA-N 0 0 302.468 5.402 20 0 DKADRN O=C(CCCC1CCCC1)N1CC2(CCC2)[C@H]1c1ccccc1 ZINC000495395203 339982566 /nfs/dbraw/zinc/98/25/66/339982566.db2.gz BMSOCENXSVTZPX-HXUWFJFHSA-N 0 0 311.469 5.101 20 0 DKADRN COc1cc(N[C@H](C)c2ccsc2)cc(OC)c1C(C)C ZINC000495405939 339983292 /nfs/dbraw/zinc/98/32/92/339983292.db2.gz DBFZFMJFWYMKIL-GFCCVEGCSA-N 0 0 305.443 5.062 20 0 DKADRN COc1cc(N[C@@H](C)c2ccsc2)cc(OC)c1C(C)C ZINC000495405940 339983280 /nfs/dbraw/zinc/98/32/80/339983280.db2.gz DBFZFMJFWYMKIL-LBPRGKRZSA-N 0 0 305.443 5.062 20 0 DKADRN COc1ccc([C@@H](C)Nc2csc3ccccc23)cc1OC ZINC000495420424 339983902 /nfs/dbraw/zinc/98/39/02/339983902.db2.gz HWDNWPFWEMNRGK-GFCCVEGCSA-N 0 0 313.422 5.092 20 0 DKADRN CC1(CC(=O)N2CC3(CCC3)[C@H]2c2ccccc2)CCCCC1 ZINC000495440720 339984714 /nfs/dbraw/zinc/98/47/14/339984714.db2.gz WDGXMFALHYENKM-LJQANCHMSA-N 0 0 311.469 5.101 20 0 DKADRN CCC[C@@H](C)C(=O)N1CCC[C@@H]1c1ccc(C(C)(C)C)cc1 ZINC000495441931 339984786 /nfs/dbraw/zinc/98/47/86/339984786.db2.gz XYGWPRLUVTXVIZ-CRAIPNDOSA-N 0 0 301.474 5.084 20 0 DKADRN CCC[C@@H](C)C(=O)N1CCC[C@H]1c1ccc(C(C)(C)C)cc1 ZINC000495441933 339984687 /nfs/dbraw/zinc/98/46/87/339984687.db2.gz XYGWPRLUVTXVIZ-QAPCUYQASA-N 0 0 301.474 5.084 20 0 DKADRN CCC[C@H](C)C(=O)N1CCC[C@H]1c1ccc(C(C)(C)C)cc1 ZINC000495441934 339984724 /nfs/dbraw/zinc/98/47/24/339984724.db2.gz XYGWPRLUVTXVIZ-YJBOKZPZSA-N 0 0 301.474 5.084 20 0 DKADRN O=C(CCC1CCCCC1)N1CC2(CCC2)[C@H]1c1ccccc1 ZINC000495450801 339985068 /nfs/dbraw/zinc/98/50/68/339985068.db2.gz WJMPDWJIJZYRMV-HXUWFJFHSA-N 0 0 311.469 5.101 20 0 DKADRN Cc1sc(CN[C@H](C)c2ccccc2Cl)nc1C(C)C ZINC000495471210 339985516 /nfs/dbraw/zinc/98/55/16/339985516.db2.gz UHQJVXYSWAHVFG-LLVKDONJSA-N 0 0 308.878 5.079 20 0 DKADRN Cc1cc(O)ccc1NC(=O)Nc1cccc(-c2ccccc2)c1 ZINC000495476764 339985555 /nfs/dbraw/zinc/98/55/55/339985555.db2.gz XQMYUMLMYQNATK-UHFFFAOYSA-N 0 0 318.376 5.012 20 0 DKADRN CC(C)CC(=O)Nc1ccc(N[C@@H](C)CCc2ccccc2)cc1 ZINC000495504320 339986086 /nfs/dbraw/zinc/98/60/86/339986086.db2.gz SUYFCYZELSCEKJ-KRWDZBQOSA-N 0 0 324.468 5.104 20 0 DKADRN CC(C)CC(=O)Nc1ccc(N[C@H](C)CCc2ccccc2)cc1 ZINC000495504323 339986185 /nfs/dbraw/zinc/98/61/85/339986185.db2.gz SUYFCYZELSCEKJ-QGZVFWFLSA-N 0 0 324.468 5.104 20 0 DKADRN CC(C)OCc1cccc(N[C@H](C)c2ccccc2Cl)c1 ZINC000495511027 339986224 /nfs/dbraw/zinc/98/62/24/339986224.db2.gz CPHXRRCLFVENJJ-CQSZACIVSA-N 0 0 303.833 5.438 20 0 DKADRN CN(C(=O)Nc1cccc(-c2ccccc2)c1)C(C1CC1)C1CC1 ZINC000495606585 339988270 /nfs/dbraw/zinc/98/82/70/339988270.db2.gz DHLRDZIRMQYLKK-UHFFFAOYSA-N 0 0 320.436 5.006 20 0 DKADRN CC(C)OCc1ccc(N[C@H](C)c2ccc(F)c(Cl)c2)cc1 ZINC000495642887 339989076 /nfs/dbraw/zinc/98/90/76/339989076.db2.gz ZRIPKQIINBKOEN-CYBMUJFWSA-N 0 0 321.823 5.577 20 0 DKADRN CC(C)OCc1ccc(N[C@@H](C)c2ccc(F)c(Cl)c2)cc1 ZINC000495642888 339989073 /nfs/dbraw/zinc/98/90/73/339989073.db2.gz ZRIPKQIINBKOEN-ZDUSSCGKSA-N 0 0 321.823 5.577 20 0 DKADRN CC(C)OCc1ccc(N[C@H](C)c2ccc(Cl)cc2)cc1 ZINC000495656669 339989374 /nfs/dbraw/zinc/98/93/74/339989374.db2.gz LPKYODAAAASYRK-CQSZACIVSA-N 0 0 303.833 5.438 20 0 DKADRN CC(C)OCc1ccc(N[C@@H](C)c2cccc(Cl)c2)cc1 ZINC000495659194 339989454 /nfs/dbraw/zinc/98/94/54/339989454.db2.gz UYULTOWLMNLIKD-AWEZNQCLSA-N 0 0 303.833 5.438 20 0 DKADRN CC(C)OCc1ccc(N[C@H](C)c2cccc(Cl)c2)cc1 ZINC000495659195 339989600 /nfs/dbraw/zinc/98/96/00/339989600.db2.gz UYULTOWLMNLIKD-CQSZACIVSA-N 0 0 303.833 5.438 20 0 DKADRN CCOCc1cccc(N[C@@H](C)c2ccc3ccccc3c2)c1 ZINC000495685788 339990182 /nfs/dbraw/zinc/99/01/82/339990182.db2.gz UIAVAGFWHIMPAI-INIZCTEOSA-N 0 0 305.421 5.549 20 0 DKADRN C[C@H](Nc1ccc2scnc2c1)c1ccc(F)c(Cl)c1 ZINC000495723303 339991015 /nfs/dbraw/zinc/99/10/15/339991015.db2.gz FIZGAWORAVLNSW-VIFPVBQESA-N 0 0 306.793 5.262 20 0 DKADRN Cc1ccc(C[S@@](=O)Cc2ccc(-c3ccccc3)cc2)cc1 ZINC000495724047 339990913 /nfs/dbraw/zinc/99/09/13/339990913.db2.gz MMNSRWRNRGTQLD-HSZRJFAPSA-N 0 0 320.457 5.111 20 0 DKADRN C[C@H](CC(=O)N(C)[C@@H](C)c1ccccc1Cl)c1ccccc1 ZINC000496292598 340002344 /nfs/dbraw/zinc/00/23/44/340002344.db2.gz SXDUZTBWMVUIFB-CABCVRRESA-N 0 0 315.844 5.053 20 0 DKADRN C[C@@H](CC(=O)N(C)[C@@H](C)c1ccccc1Cl)c1ccccc1 ZINC000496292609 340002313 /nfs/dbraw/zinc/00/23/13/340002313.db2.gz SXDUZTBWMVUIFB-GJZGRUSLSA-N 0 0 315.844 5.053 20 0 DKADRN C[C@H](CC(=O)N(C)[C@H](C)c1ccccc1Cl)c1ccccc1 ZINC000496292610 340002297 /nfs/dbraw/zinc/00/22/97/340002297.db2.gz SXDUZTBWMVUIFB-HUUCEWRRSA-N 0 0 315.844 5.053 20 0 DKADRN C[C@H](c1ccccc1Cl)N(C)C(=O)C[C@H](C)c1ccccc1 ZINC000496292611 340002303 /nfs/dbraw/zinc/00/23/03/340002303.db2.gz SXDUZTBWMVUIFB-LSDHHAIUSA-N 0 0 315.844 5.053 20 0 DKADRN C[C@H](CC(=O)N(C)[C@@H](C)c1cccc(Cl)c1)c1ccccc1 ZINC000496303902 340002652 /nfs/dbraw/zinc/00/26/52/340002652.db2.gz NPZVAUTUMRANJV-CABCVRRESA-N 0 0 315.844 5.053 20 0 DKADRN C[C@@H](CC(=O)N(C)[C@@H](C)c1cccc(Cl)c1)c1ccccc1 ZINC000496303904 340002619 /nfs/dbraw/zinc/00/26/19/340002619.db2.gz NPZVAUTUMRANJV-GJZGRUSLSA-N 0 0 315.844 5.053 20 0 DKADRN C[C@H](CC(=O)N(C)[C@H](C)c1cccc(Cl)c1)c1ccccc1 ZINC000496303905 340002608 /nfs/dbraw/zinc/00/26/08/340002608.db2.gz NPZVAUTUMRANJV-HUUCEWRRSA-N 0 0 315.844 5.053 20 0 DKADRN C[C@H](c1cccc(Cl)c1)N(C)C(=O)C[C@H](C)c1ccccc1 ZINC000496303906 340002597 /nfs/dbraw/zinc/00/25/97/340002597.db2.gz NPZVAUTUMRANJV-LSDHHAIUSA-N 0 0 315.844 5.053 20 0 DKADRN C[C@@H](c1ccccc1Cl)N(C)C(=O)c1ccc2ccccc2c1 ZINC000496305577 340002707 /nfs/dbraw/zinc/00/27/07/340002707.db2.gz QDXGUAQZKAZNHX-AWEZNQCLSA-N 0 0 323.823 5.326 20 0 DKADRN C[C@H](c1ccccc1Cl)N(C)C(=O)c1ccc2ccccc2c1 ZINC000496305583 340002663 /nfs/dbraw/zinc/00/26/63/340002663.db2.gz QDXGUAQZKAZNHX-CQSZACIVSA-N 0 0 323.823 5.326 20 0 DKADRN C[C@@H](c1cccc(Cl)c1)N(C)C(=O)c1ccc2ccccc2c1 ZINC000496344794 340003553 /nfs/dbraw/zinc/00/35/53/340003553.db2.gz VPJUFKFQPFWOGB-AWEZNQCLSA-N 0 0 323.823 5.326 20 0 DKADRN C[C@H](c1cccc(Cl)c1)N(C)C(=O)c1ccc2ccccc2c1 ZINC000496344797 340003534 /nfs/dbraw/zinc/00/35/34/340003534.db2.gz VPJUFKFQPFWOGB-CQSZACIVSA-N 0 0 323.823 5.326 20 0 DKADRN CC(C)(CCCc1ccccc1)C(=O)Nc1cccc2[nH]ccc21 ZINC000496358213 340003809 /nfs/dbraw/zinc/00/38/09/340003809.db2.gz IXKVUIZXSPBIBQ-UHFFFAOYSA-N 0 0 320.436 5.156 20 0 DKADRN Cc1ccc([C@H](C)NC(=O)c2sccc2-c2ccccc2)cc1 ZINC000496406969 340004766 /nfs/dbraw/zinc/00/47/66/340004766.db2.gz KUQSHAWIVYZBNB-HNNXBMFYSA-N 0 0 321.445 5.215 20 0 DKADRN Cc1ccc([C@@H](C)NC(=O)c2sccc2-c2ccccc2)cc1 ZINC000496406970 340004798 /nfs/dbraw/zinc/00/47/98/340004798.db2.gz KUQSHAWIVYZBNB-OAHLLOKOSA-N 0 0 321.445 5.215 20 0 DKADRN C[C@@H](NC(=O)c1csc2ccccc12)c1cc2ccccc2o1 ZINC000497005020 340018078 /nfs/dbraw/zinc/01/80/78/340018078.db2.gz PXRFNVSKNHBPBM-GFCCVEGCSA-N 0 0 321.401 5.139 20 0 DKADRN C[C@H](NC(=O)c1csc2ccccc12)c1cc2ccccc2o1 ZINC000497005021 340018042 /nfs/dbraw/zinc/01/80/42/340018042.db2.gz PXRFNVSKNHBPBM-LBPRGKRZSA-N 0 0 321.401 5.139 20 0 DKADRN Cc1ccc([C@@H]2CCCN2Cc2csc(-c3ccco3)n2)cc1 ZINC000497046568 340019021 /nfs/dbraw/zinc/01/90/21/340019021.db2.gz IBMBZWAFUHFYSI-KRWDZBQOSA-N 0 0 324.449 5.049 20 0 DKADRN Cc1ccc([C@H]2CCCN2Cc2csc(-c3ccco3)n2)cc1 ZINC000497046584 340019009 /nfs/dbraw/zinc/01/90/09/340019009.db2.gz IBMBZWAFUHFYSI-QGZVFWFLSA-N 0 0 324.449 5.049 20 0 DKADRN CC[C@H](C)CN(CC)C(=O)Nc1cc(C(F)F)ccc1Cl ZINC000497150561 333093243 /nfs/dbraw/zinc/09/32/43/333093243.db2.gz UOPHSBFEXVDZCL-JTQLQIEISA-N 0 0 318.795 5.178 20 0 DKADRN CC[C@@H](C)CN(CC)C(=O)Nc1cc(C(F)F)ccc1Cl ZINC000497150564 333093276 /nfs/dbraw/zinc/09/32/76/333093276.db2.gz UOPHSBFEXVDZCL-SNVBAGLBSA-N 0 0 318.795 5.178 20 0 DKADRN CCCN(CC(C)C)C(=O)Nc1cc(C(F)F)ccc1Cl ZINC000497184151 333218010 /nfs/dbraw/zinc/21/80/10/333218010.db2.gz VRVGDYLSBZDHAV-UHFFFAOYSA-N 0 0 318.795 5.178 20 0 DKADRN CC[C@@H]1CCCCN1C(=O)Nc1cc(C(F)F)ccc1Cl ZINC000497216550 333223072 /nfs/dbraw/zinc/22/30/72/333223072.db2.gz XFQVBKQDWWWRHR-LLVKDONJSA-N 0 0 316.779 5.074 20 0 DKADRN CC[C@H]1CCCCN1C(=O)Nc1cc(C(F)F)ccc1Cl ZINC000497216551 333222956 /nfs/dbraw/zinc/22/29/56/333222956.db2.gz XFQVBKQDWWWRHR-NSHDSACASA-N 0 0 316.779 5.074 20 0 DKADRN C[C@H]1CCCCCN1C(=O)Nc1cc(C(F)F)ccc1Cl ZINC000497225272 333223920 /nfs/dbraw/zinc/22/39/20/333223920.db2.gz ARYSQZXZWONMNG-JTQLQIEISA-N 0 0 316.779 5.074 20 0 DKADRN C[C@@H]1CCCCCN1C(=O)Nc1cc(C(F)F)ccc1Cl ZINC000497225273 333223916 /nfs/dbraw/zinc/22/39/16/333223916.db2.gz ARYSQZXZWONMNG-SNVBAGLBSA-N 0 0 316.779 5.074 20 0 DKADRN CC(C)[C@@H](c1ccccc1)N(C)C(=O)Nc1cccc(Cl)c1 ZINC000497246277 333227033 /nfs/dbraw/zinc/22/70/33/333227033.db2.gz IOXMGNCOBRGNKQ-KRWDZBQOSA-N 0 0 316.832 5.201 20 0 DKADRN CC(C)[C@H](c1ccccc1)N(C)C(=O)Nc1cccc(Cl)c1 ZINC000497246278 333226929 /nfs/dbraw/zinc/22/69/29/333226929.db2.gz IOXMGNCOBRGNKQ-QGZVFWFLSA-N 0 0 316.832 5.201 20 0 DKADRN C[C@@H](NC(=O)Nc1cc(C(F)F)ccc1Cl)c1ccccc1 ZINC000497246556 333227065 /nfs/dbraw/zinc/22/70/65/333227065.db2.gz JJVXGLVXMBLGGT-SNVBAGLBSA-N 0 0 324.758 5.160 20 0 DKADRN Cc1cccc(NC(=O)Nc2cc(C(F)F)ccc2Cl)c1C ZINC000497248393 333227795 /nfs/dbraw/zinc/22/77/95/333227795.db2.gz PRIPMWBLCDPKGO-UHFFFAOYSA-N 0 0 324.758 5.538 20 0 DKADRN O=C(Nc1cc(C(F)F)ccc1Cl)NC1CCCCCC1 ZINC000497274435 333230963 /nfs/dbraw/zinc/23/09/63/333230963.db2.gz DONVTKXXZZBNSE-UHFFFAOYSA-N 0 0 316.779 5.122 20 0 DKADRN CN(C(=O)Nc1cc(C(F)F)ccc1Cl)C1CCCCC1 ZINC000497274929 333230501 /nfs/dbraw/zinc/23/05/01/333230501.db2.gz IIIXWUMVHNRLHH-UHFFFAOYSA-N 0 0 316.779 5.074 20 0 DKADRN CC(C)[C@@H](c1ccccc1)N(C)C(=O)Nc1ccc(Cl)cc1 ZINC000497295778 333232240 /nfs/dbraw/zinc/23/22/40/333232240.db2.gz RFEIIECPTAYQCV-KRWDZBQOSA-N 0 0 316.832 5.201 20 0 DKADRN CC(C)[C@H](c1ccccc1)N(C)C(=O)Nc1ccc(Cl)cc1 ZINC000497295786 333232414 /nfs/dbraw/zinc/23/24/14/333232414.db2.gz RFEIIECPTAYQCV-QGZVFWFLSA-N 0 0 316.832 5.201 20 0 DKADRN CCCCN(C(=O)Nc1cc(C(F)F)ccc1Cl)C1CC1 ZINC000497308882 333233912 /nfs/dbraw/zinc/23/39/12/333233912.db2.gz ARDUFQWFSVRCCB-UHFFFAOYSA-N 0 0 316.779 5.074 20 0 DKADRN CCN(C(=O)Nc1cc(C(F)F)ccc1Cl)C1CCCC1 ZINC000497310959 333234906 /nfs/dbraw/zinc/23/49/06/333234906.db2.gz LFDPDZSLSCKPEG-UHFFFAOYSA-N 0 0 316.779 5.074 20 0 DKADRN CCCC[C@@H](CC)C(=O)Nc1ccc(Oc2ccncc2)cc1 ZINC000497312594 333235072 /nfs/dbraw/zinc/23/50/72/333235072.db2.gz QZLNZQFMTJTAOW-OAHLLOKOSA-N 0 0 312.413 5.029 20 0 DKADRN CC1(NC(=O)Nc2cc(C(F)F)ccc2Cl)CCCCC1 ZINC000497313065 333235152 /nfs/dbraw/zinc/23/51/52/333235152.db2.gz SOZSJXPHNRWMFH-UHFFFAOYSA-N 0 0 316.779 5.122 20 0 DKADRN C/C=C\c1ccc(NC(=O)N(C)Cc2cc3ccccc3o2)cc1 ZINC000497319608 333235793 /nfs/dbraw/zinc/23/57/93/333235793.db2.gz JUTOTRCKBZKWGS-UTCJRWHESA-N 0 0 320.392 5.130 20 0 DKADRN C/C=C/c1ccc(NC(=O)N(C)Cc2cc3ccccc3o2)cc1 ZINC000497319609 333235892 /nfs/dbraw/zinc/23/58/92/333235892.db2.gz JUTOTRCKBZKWGS-ZZXKWVIFSA-N 0 0 320.392 5.130 20 0 DKADRN C/C=C\c1ccc(NC(=O)N(CC)[C@H](C)c2cccc(O)c2)cc1 ZINC000497322473 333236125 /nfs/dbraw/zinc/23/61/25/333236125.db2.gz LICFLFCFUBODEN-IJVDHGTGSA-N 0 0 324.424 5.040 20 0 DKADRN C/C=C/c1ccc(NC(=O)N(CC)[C@H](C)c2cccc(O)c2)cc1 ZINC000497322475 333235971 /nfs/dbraw/zinc/23/59/71/333235971.db2.gz LICFLFCFUBODEN-NFBGWVBBSA-N 0 0 324.424 5.040 20 0 DKADRN C/C=C\c1ccc(NC(=O)N(CC)[C@@H](C)c2cccc(O)c2)cc1 ZINC000497322476 333235995 /nfs/dbraw/zinc/23/59/95/333235995.db2.gz LICFLFCFUBODEN-QZDDGCDVSA-N 0 0 324.424 5.040 20 0 DKADRN C/C=C/c1ccc(NC(=O)N(CC)[C@@H](C)c2cccc(O)c2)cc1 ZINC000497322477 333236115 /nfs/dbraw/zinc/23/61/15/333236115.db2.gz LICFLFCFUBODEN-SZTZYQKNSA-N 0 0 324.424 5.040 20 0 DKADRN O=C(N[C@@H]1CC[C@H]2CCCC[C@H]2C1)c1occc1-c1ccccc1 ZINC000497324896 333236416 /nfs/dbraw/zinc/23/64/16/333236416.db2.gz SRYOLGVVUWWFDU-BPQIPLTHSA-N 0 0 323.436 5.035 20 0 DKADRN O=C(N[C@@H]1CC[C@@H]2CCCC[C@@H]2C1)c1occc1-c1ccccc1 ZINC000497324897 333236528 /nfs/dbraw/zinc/23/65/28/333236528.db2.gz SRYOLGVVUWWFDU-CGTJXYLNSA-N 0 0 323.436 5.035 20 0 DKADRN O=C(N[C@@H]1CC[C@H]2CCCC[C@@H]2C1)c1occc1-c1ccccc1 ZINC000497324898 333236505 /nfs/dbraw/zinc/23/65/05/333236505.db2.gz SRYOLGVVUWWFDU-KBAYOESNSA-N 0 0 323.436 5.035 20 0 DKADRN O=C(N[C@@H]1CC[C@@H]2CCCC[C@H]2C1)c1occc1-c1ccccc1 ZINC000497324899 333236471 /nfs/dbraw/zinc/23/64/71/333236471.db2.gz SRYOLGVVUWWFDU-RYQLBKOJSA-N 0 0 323.436 5.035 20 0 DKADRN Cc1cc(SCc2nc3ccccc3s2)c2ccccc2n1 ZINC000497331118 333236727 /nfs/dbraw/zinc/23/67/27/333236727.db2.gz HOMFVWQTLOOKGM-UHFFFAOYSA-N 0 0 322.458 5.445 20 0 DKADRN C/C=C/c1ccc(NC(=O)N2CCC[C@@H]2c2cccc(F)c2)cc1 ZINC000497332292 333236616 /nfs/dbraw/zinc/23/66/16/333236616.db2.gz UOVOTRHIKDMALS-KPUAHBEZSA-N 0 0 324.399 5.228 20 0 DKADRN C/C=C\c1ccc(NC(=O)N2CCC[C@H]2c2cccc(F)c2)cc1 ZINC000497332294 333236599 /nfs/dbraw/zinc/23/65/99/333236599.db2.gz UOVOTRHIKDMALS-LVXZVAJSSA-N 0 0 324.399 5.228 20 0 DKADRN C/C=C\c1ccc(NC(=O)N2CCC[C@@H]2c2cccc(F)c2)cc1 ZINC000497332295 333236604 /nfs/dbraw/zinc/23/66/04/333236604.db2.gz UOVOTRHIKDMALS-QDVBSOPMSA-N 0 0 324.399 5.228 20 0 DKADRN C/C=C/c1ccc(NC(=O)N2CCC[C@H]2c2cccc(F)c2)cc1 ZINC000497332296 333236737 /nfs/dbraw/zinc/23/67/37/333236737.db2.gz UOVOTRHIKDMALS-XUYKHGSPSA-N 0 0 324.399 5.228 20 0 DKADRN C/C=C/c1ccc(NC(=O)N(Cc2cccs2)C(C)C)cc1 ZINC000497334851 333237546 /nfs/dbraw/zinc/23/75/46/333237546.db2.gz WOFOGWMOYFARQU-GQCTYLIASA-N 0 0 314.454 5.224 20 0 DKADRN C/C=C\c1ccc(NC(=O)N(Cc2cccs2)C(C)C)cc1 ZINC000497334852 333237539 /nfs/dbraw/zinc/23/75/39/333237539.db2.gz WOFOGWMOYFARQU-XQRVVYSFSA-N 0 0 314.454 5.224 20 0 DKADRN C/C=C\c1ccc(NC(=O)N2CCC[C@H]2c2ccsc2)cc1 ZINC000497334975 333237537 /nfs/dbraw/zinc/23/75/37/333237537.db2.gz YSXWJUQZMZLFFJ-MMTGSJLXSA-N 0 0 312.438 5.150 20 0 DKADRN C/C=C/c1ccc(NC(=O)N2CCC[C@@H]2c2ccsc2)cc1 ZINC000497334976 333237580 /nfs/dbraw/zinc/23/75/80/333237580.db2.gz YSXWJUQZMZLFFJ-NKEDHYFDSA-N 0 0 312.438 5.150 20 0 DKADRN C/C=C\c1ccc(NC(=O)N2CCC[C@@H]2c2ccsc2)cc1 ZINC000497334977 333237517 /nfs/dbraw/zinc/23/75/17/333237517.db2.gz YSXWJUQZMZLFFJ-POKLJVKSSA-N 0 0 312.438 5.150 20 0 DKADRN C/C=C/c1ccc(NC(=O)N2CCC[C@H]2c2ccsc2)cc1 ZINC000497334978 333237529 /nfs/dbraw/zinc/23/75/29/333237529.db2.gz YSXWJUQZMZLFFJ-WVMJFEGXSA-N 0 0 312.438 5.150 20 0 DKADRN C/C=C\c1ccc(NC(=O)N2CCC[C@H]2c2ccc(CC)o2)cc1 ZINC000497336756 333237757 /nfs/dbraw/zinc/23/77/57/333237757.db2.gz PGFXAQRRTMVONC-CJISVDGZSA-N 0 0 324.424 5.244 20 0 DKADRN C/C=C/c1ccc(NC(=O)N2CCC[C@@H]2c2ccc(CC)o2)cc1 ZINC000497336757 333237741 /nfs/dbraw/zinc/23/77/41/333237741.db2.gz PGFXAQRRTMVONC-HNSSHINMSA-N 0 0 324.424 5.244 20 0 DKADRN C/C=C/c1ccc(NC(=O)N2CCC[C@H]2c2ccc(CC)o2)cc1 ZINC000497336758 333237801 /nfs/dbraw/zinc/23/78/01/333237801.db2.gz PGFXAQRRTMVONC-PXPSOEEZSA-N 0 0 324.424 5.244 20 0 DKADRN C/C=C\c1ccc(NC(=O)N2CCC[C@@H]2c2ccc(CC)o2)cc1 ZINC000497336759 333237811 /nfs/dbraw/zinc/23/78/11/333237811.db2.gz PGFXAQRRTMVONC-VDNIUXDYSA-N 0 0 324.424 5.244 20 0 DKADRN C/C=C/c1ccc(NC(=O)N2CCC(C)=C(c3ccco3)C2)cc1 ZINC000497344936 333238627 /nfs/dbraw/zinc/23/86/27/333238627.db2.gz QDWNMRNYNOBJRX-HWKANZROSA-N 0 0 322.408 5.024 20 0 DKADRN C/C=C\c1ccc(NC(=O)N2CCC(C)=C(c3ccco3)C2)cc1 ZINC000497344937 333238638 /nfs/dbraw/zinc/23/86/38/333238638.db2.gz QDWNMRNYNOBJRX-HYXAFXHYSA-N 0 0 322.408 5.024 20 0 DKADRN C/C=C\c1ccc(NC(=O)N2CC[C@H](C)C[C@H]2c2ccco2)cc1 ZINC000497372366 333241511 /nfs/dbraw/zinc/24/15/11/333241511.db2.gz SQFPUXQIURXWRD-CXZRTRQKSA-N 0 0 324.424 5.318 20 0 DKADRN C/C=C\c1ccc(NC(=O)N2CC[C@H](C)C[C@@H]2c2ccco2)cc1 ZINC000497372367 333241544 /nfs/dbraw/zinc/24/15/44/333241544.db2.gz SQFPUXQIURXWRD-FXBQYALZSA-N 0 0 324.424 5.318 20 0 DKADRN C/C=C/c1ccc(NC(=O)N2CC[C@H](C)C[C@H]2c2ccco2)cc1 ZINC000497372368 333241548 /nfs/dbraw/zinc/24/15/48/333241548.db2.gz SQFPUXQIURXWRD-RZLVVUEGSA-N 0 0 324.424 5.318 20 0 DKADRN C/C=C/c1ccc(NC(=O)N2CC[C@H](C)C[C@@H]2c2ccco2)cc1 ZINC000497372369 333241550 /nfs/dbraw/zinc/24/15/50/333241550.db2.gz SQFPUXQIURXWRD-YNIBAAPQSA-N 0 0 324.424 5.318 20 0 DKADRN C/C=C/c1ccc(NC(=O)N(C)[C@H](C)c2ccccc2F)cc1 ZINC000497372846 333241745 /nfs/dbraw/zinc/24/17/45/333241745.db2.gz VXWRSHCJFFBBIQ-BTKRWWFXSA-N 0 0 312.388 5.084 20 0 DKADRN C/C=C/c1ccc(NC(=O)N(C)[C@@H](C)c2ccccc2F)cc1 ZINC000497372847 333241692 /nfs/dbraw/zinc/24/16/92/333241692.db2.gz VXWRSHCJFFBBIQ-GBXSZLQWSA-N 0 0 312.388 5.084 20 0 DKADRN C/C=C\c1ccc(NC(=O)N(C)[C@H](C)c2ccccc2F)cc1 ZINC000497372848 333241772 /nfs/dbraw/zinc/24/17/72/333241772.db2.gz VXWRSHCJFFBBIQ-HJHHMULASA-N 0 0 312.388 5.084 20 0 DKADRN C/C=C\c1ccc(NC(=O)N(C)[C@@H](C)c2ccccc2F)cc1 ZINC000497372849 333241762 /nfs/dbraw/zinc/24/17/62/333241762.db2.gz VXWRSHCJFFBBIQ-ZBKLQPJUSA-N 0 0 312.388 5.084 20 0 DKADRN C/C=C\c1ccc(NC(=O)N2CCCC[C@H]2c2ccc(C)o2)cc1 ZINC000497372905 333241761 /nfs/dbraw/zinc/24/17/61/333241761.db2.gz WQWMPRCTDMFXFT-CJISVDGZSA-N 0 0 324.424 5.380 20 0 DKADRN C/C=C/c1ccc(NC(=O)N2CCCC[C@@H]2c2ccc(C)o2)cc1 ZINC000497372906 333241726 /nfs/dbraw/zinc/24/17/26/333241726.db2.gz WQWMPRCTDMFXFT-HNSSHINMSA-N 0 0 324.424 5.380 20 0 DKADRN C/C=C/c1ccc(NC(=O)N2CCCC[C@H]2c2ccc(C)o2)cc1 ZINC000497372907 333241658 /nfs/dbraw/zinc/24/16/58/333241658.db2.gz WQWMPRCTDMFXFT-PXPSOEEZSA-N 0 0 324.424 5.380 20 0 DKADRN C/C=C\c1ccc(NC(=O)N2CCCC[C@@H]2c2ccc(C)o2)cc1 ZINC000497372908 333241723 /nfs/dbraw/zinc/24/17/23/333241723.db2.gz WQWMPRCTDMFXFT-VDNIUXDYSA-N 0 0 324.424 5.380 20 0 DKADRN CC[C@@H](NC(=O)Nc1cc(C(F)F)ccc1Cl)C(C)(C)C ZINC000497373052 333241674 /nfs/dbraw/zinc/24/16/74/333241674.db2.gz XBLOKKRHCGJHOA-GFCCVEGCSA-N 0 0 318.795 5.224 20 0 DKADRN CC[C@H](NC(=O)Nc1cc(C(F)F)ccc1Cl)C(C)(C)C ZINC000497373053 333241746 /nfs/dbraw/zinc/24/17/46/333241746.db2.gz XBLOKKRHCGJHOA-LBPRGKRZSA-N 0 0 318.795 5.224 20 0 DKADRN CCN(C(=O)Nc1cc(C(F)F)ccc1Cl)[C@@H](C)C(C)C ZINC000497373215 333241732 /nfs/dbraw/zinc/24/17/32/333241732.db2.gz XPQKKATZQKFLQL-JTQLQIEISA-N 0 0 318.795 5.176 20 0 DKADRN CCN(C(=O)Nc1cc(C(F)F)ccc1Cl)[C@H](C)C(C)C ZINC000497373216 333241725 /nfs/dbraw/zinc/24/17/25/333241725.db2.gz XPQKKATZQKFLQL-SNVBAGLBSA-N 0 0 318.795 5.176 20 0 DKADRN C/C=C/c1ccc(NC(=O)N2CCCC[C@@H]2c2ccco2)cc1 ZINC000497376248 333241289 /nfs/dbraw/zinc/24/12/89/333241289.db2.gz IFRVGRJISISWFS-DCVFFXCOSA-N 0 0 310.397 5.072 20 0 DKADRN C/C=C/c1ccc(NC(=O)N2CCCC[C@H]2c2ccco2)cc1 ZINC000497376249 333241320 /nfs/dbraw/zinc/24/13/20/333241320.db2.gz IFRVGRJISISWFS-MOESHBJCSA-N 0 0 310.397 5.072 20 0 DKADRN C/C=C\c1ccc(NC(=O)N2CCCC[C@H]2c2ccco2)cc1 ZINC000497376250 333241231 /nfs/dbraw/zinc/24/12/31/333241231.db2.gz IFRVGRJISISWFS-VEJWIWHQSA-N 0 0 310.397 5.072 20 0 DKADRN C/C=C\c1ccc(NC(=O)N2CCCC[C@@H]2c2ccco2)cc1 ZINC000497376251 333241244 /nfs/dbraw/zinc/24/12/44/333241244.db2.gz IFRVGRJISISWFS-YMYNHAKTSA-N 0 0 310.397 5.072 20 0 DKADRN C/C=C/c1ccc(NC(=O)N(C)[C@H](C)c2ccc(F)cc2)cc1 ZINC000497377753 333242391 /nfs/dbraw/zinc/24/23/91/333242391.db2.gz ZDWBOJJHIVYOBK-ISZGNANSSA-N 0 0 312.388 5.084 20 0 DKADRN C/C=C/c1ccc(NC(=O)N(C)[C@@H](C)c2ccc(F)cc2)cc1 ZINC000497377754 333242395 /nfs/dbraw/zinc/24/23/95/333242395.db2.gz ZDWBOJJHIVYOBK-NNTXTVRGSA-N 0 0 312.388 5.084 20 0 DKADRN C/C=C\c1ccc(NC(=O)N(C)[C@@H](C)c2ccc(F)cc2)cc1 ZINC000497377755 333242258 /nfs/dbraw/zinc/24/22/58/333242258.db2.gz ZDWBOJJHIVYOBK-WSNITJDQSA-N 0 0 312.388 5.084 20 0 DKADRN C/C=C\c1ccc(NC(=O)N(C)[C@H](C)c2ccc(F)cc2)cc1 ZINC000497377756 333242372 /nfs/dbraw/zinc/24/23/72/333242372.db2.gz ZDWBOJJHIVYOBK-ZRUQZJFASA-N 0 0 312.388 5.084 20 0 DKADRN C/C=C\c1ccc(NC(=O)N(C)[C@@H](C)c2cccs2)cc1 ZINC000497381092 333242924 /nfs/dbraw/zinc/24/29/24/333242924.db2.gz BYLYQFHZARFKPB-AGLBCWCQSA-N 0 0 300.427 5.006 20 0 DKADRN C/C=C/c1ccc(NC(=O)N(C)[C@@H](C)c2cccs2)cc1 ZINC000497381095 333242887 /nfs/dbraw/zinc/24/28/87/333242887.db2.gz BYLYQFHZARFKPB-BPJJOFIESA-N 0 0 300.427 5.006 20 0 DKADRN C/C=C/c1ccc(NC(=O)N(C)[C@H](C)c2cccs2)cc1 ZINC000497381096 333242868 /nfs/dbraw/zinc/24/28/68/333242868.db2.gz BYLYQFHZARFKPB-DIECRNLCSA-N 0 0 300.427 5.006 20 0 DKADRN C/C=C\c1ccc(NC(=O)N(C)[C@H](C)c2cccs2)cc1 ZINC000497381099 333242944 /nfs/dbraw/zinc/24/29/44/333242944.db2.gz BYLYQFHZARFKPB-RYWCDNDXSA-N 0 0 300.427 5.006 20 0 DKADRN CC(C)c1ccsc1C(=O)N[C@H](C)c1cccc2ccccc21 ZINC000497381471 333243141 /nfs/dbraw/zinc/24/31/41/333243141.db2.gz DCPQIGNSBGYSFP-CQSZACIVSA-N 0 0 323.461 5.516 20 0 DKADRN C/C=C\c1ccc(NC(=O)N(CC)[C@H](CC)c2ccncc2)cc1 ZINC000497382398 333242401 /nfs/dbraw/zinc/24/24/01/333242401.db2.gz DOCUPAGYMVRDLJ-BQHGXPCASA-N 0 0 323.440 5.120 20 0 DKADRN C/C=C\c1ccc(NC(=O)N(CC)[C@@H](CC)c2ccncc2)cc1 ZINC000497382413 333242323 /nfs/dbraw/zinc/24/23/23/333242323.db2.gz DOCUPAGYMVRDLJ-OCTSTCLRSA-N 0 0 323.440 5.120 20 0 DKADRN C/C=C/c1ccc(NC(=O)N(CC)[C@@H](CC)c2ccncc2)cc1 ZINC000497382414 333242388 /nfs/dbraw/zinc/24/23/88/333242388.db2.gz DOCUPAGYMVRDLJ-QTWIXLPOSA-N 0 0 323.440 5.120 20 0 DKADRN C/C=C/c1ccc(NC(=O)N(CC)[C@H](CC)c2ccncc2)cc1 ZINC000497382415 333242291 /nfs/dbraw/zinc/24/22/91/333242291.db2.gz DOCUPAGYMVRDLJ-ZLHKHBAESA-N 0 0 323.440 5.120 20 0 DKADRN Cc1ccc([C@H](C)N(C)C(=O)C[C@@H](C)c2ccccc2)c(C)c1 ZINC000497386493 333243806 /nfs/dbraw/zinc/24/38/06/333243806.db2.gz LVZDZEASEMDFCM-AEFFLSMTSA-N 0 0 309.453 5.017 20 0 DKADRN Cc1ccc([C@@H](C)N(C)C(=O)C[C@H](C)c2ccccc2)c(C)c1 ZINC000497386502 333243820 /nfs/dbraw/zinc/24/38/20/333243820.db2.gz LVZDZEASEMDFCM-FUHWJXTLSA-N 0 0 309.453 5.017 20 0 DKADRN Cc1ccc([C@@H](C)N(C)C(=O)C[C@@H](C)c2ccccc2)c(C)c1 ZINC000497386503 333243718 /nfs/dbraw/zinc/24/37/18/333243718.db2.gz LVZDZEASEMDFCM-SJLPKXTDSA-N 0 0 309.453 5.017 20 0 DKADRN Cc1ccc([C@H](C)N(C)C(=O)C[C@H](C)c2ccccc2)c(C)c1 ZINC000497386505 333243701 /nfs/dbraw/zinc/24/37/01/333243701.db2.gz LVZDZEASEMDFCM-WMZOPIPTSA-N 0 0 309.453 5.017 20 0 DKADRN C[C@H](NC(=O)Nc1cc(C(F)F)ccc1Cl)c1ccccc1 ZINC000497386663 333243734 /nfs/dbraw/zinc/24/37/34/333243734.db2.gz JJVXGLVXMBLGGT-JTQLQIEISA-N 0 0 324.758 5.160 20 0 DKADRN C/C=C\c1ccc(NC(=O)N2CCC[C@H]2c2ccc(F)cc2)cc1 ZINC000497387276 333244213 /nfs/dbraw/zinc/24/42/13/333244213.db2.gz JUQQYSHWMZJXRN-GHMGLMHVSA-N 0 0 324.399 5.228 20 0 DKADRN C/C=C/c1ccc(NC(=O)N2CCC[C@H]2c2ccc(F)cc2)cc1 ZINC000497387299 333244153 /nfs/dbraw/zinc/24/41/53/333244153.db2.gz JUQQYSHWMZJXRN-GVTIMSHASA-N 0 0 324.399 5.228 20 0 DKADRN C/C=C/c1ccc(NC(=O)N2CCC[C@@H]2c2ccc(F)cc2)cc1 ZINC000497387301 333244058 /nfs/dbraw/zinc/24/40/58/333244058.db2.gz JUQQYSHWMZJXRN-NLJSWGTCSA-N 0 0 324.399 5.228 20 0 DKADRN C/C=C\c1ccc(NC(=O)N2CCC[C@@H]2c2ccc(F)cc2)cc1 ZINC000497387303 333244141 /nfs/dbraw/zinc/24/41/41/333244141.db2.gz JUQQYSHWMZJXRN-VSERLBFKSA-N 0 0 324.399 5.228 20 0 DKADRN C/C=C\c1ccc(NC(=O)N2CCC[C@H]2c2cccs2)cc1 ZINC000497398938 333246148 /nfs/dbraw/zinc/24/61/48/333246148.db2.gz BXIUHOZIDOOUBH-ASKPUQFJSA-N 0 0 312.438 5.150 20 0 DKADRN C/C=C/c1ccc(NC(=O)N2CCC[C@H]2c2cccs2)cc1 ZINC000497398939 333246097 /nfs/dbraw/zinc/24/60/97/333246097.db2.gz BXIUHOZIDOOUBH-AUYOJAJCSA-N 0 0 312.438 5.150 20 0 DKADRN C/C=C/c1ccc(NC(=O)N2CCC[C@@H]2c2cccs2)cc1 ZINC000497398940 333246049 /nfs/dbraw/zinc/24/60/49/333246049.db2.gz BXIUHOZIDOOUBH-OUGHUQCRSA-N 0 0 312.438 5.150 20 0 DKADRN C/C=C\c1ccc(NC(=O)N2CCC[C@@H]2c2cccs2)cc1 ZINC000497398941 333246083 /nfs/dbraw/zinc/24/60/83/333246083.db2.gz BXIUHOZIDOOUBH-SVERHTFXSA-N 0 0 312.438 5.150 20 0 DKADRN Cc1ccc(C)c(NC(=O)Nc2cc(C(F)F)ccc2Cl)c1 ZINC000497405600 333247285 /nfs/dbraw/zinc/24/72/85/333247285.db2.gz KAJXXEOGAYBPMQ-UHFFFAOYSA-N 0 0 324.758 5.538 20 0 DKADRN Cc1ccc(NC(=O)Nc2cc(C(F)F)ccc2Cl)cc1 ZINC000497405717 333247325 /nfs/dbraw/zinc/24/73/25/333247325.db2.gz KVNDGBMXWGPOQG-UHFFFAOYSA-N 0 0 310.731 5.230 20 0 DKADRN C/C=C\c1ccc(NC(=O)N(C)Cc2ccc(Cl)s2)cc1 ZINC000497413654 333247623 /nfs/dbraw/zinc/24/76/23/333247623.db2.gz BOBLGZZPXDOLDV-ARJAWSKDSA-N 0 0 320.845 5.099 20 0 DKADRN C/C=C/c1ccc(NC(=O)N(C)Cc2ccc(Cl)s2)cc1 ZINC000497413665 333247642 /nfs/dbraw/zinc/24/76/42/333247642.db2.gz BOBLGZZPXDOLDV-ONEGZZNKSA-N 0 0 320.845 5.099 20 0 DKADRN Cc1cscc1NC(=O)Nc1cc(C(F)F)ccc1Cl ZINC000497415272 333248557 /nfs/dbraw/zinc/24/85/57/333248557.db2.gz GKUWDGLMUAXEEE-UHFFFAOYSA-N 0 0 316.760 5.292 20 0 DKADRN C/C=C/c1ccc(NC(=O)N([C@@H](C)c2ccco2)C2CC2)cc1 ZINC000497415724 333248488 /nfs/dbraw/zinc/24/84/88/333248488.db2.gz HIYGIYKAWFRESH-KQIUPUNMSA-N 0 0 310.397 5.070 20 0 DKADRN C/C=C/c1ccc(NC(=O)N([C@H](C)c2ccco2)C2CC2)cc1 ZINC000497415727 333248610 /nfs/dbraw/zinc/24/86/10/333248610.db2.gz HIYGIYKAWFRESH-LYKUJDHUSA-N 0 0 310.397 5.070 20 0 DKADRN C/C=C\c1ccc(NC(=O)N([C@@H](C)c2ccco2)C2CC2)cc1 ZINC000497415730 333248566 /nfs/dbraw/zinc/24/85/66/333248566.db2.gz HIYGIYKAWFRESH-MFBWXBCUSA-N 0 0 310.397 5.070 20 0 DKADRN C/C=C\c1ccc(NC(=O)N([C@H](C)c2ccco2)C2CC2)cc1 ZINC000497415731 333248539 /nfs/dbraw/zinc/24/85/39/333248539.db2.gz HIYGIYKAWFRESH-PKXJPQMGSA-N 0 0 310.397 5.070 20 0 DKADRN C/C=C/c1ccc(NC(=O)N2CCCCC[C@H]2c2ccco2)cc1 ZINC000497420862 333249260 /nfs/dbraw/zinc/24/92/60/333249260.db2.gz UIGDVRCZJVRSCF-OMIQGHKFSA-N 0 0 324.424 5.462 20 0 DKADRN C/C=C/c1ccc(NC(=O)N2CCCCC[C@@H]2c2ccco2)cc1 ZINC000497420868 333249167 /nfs/dbraw/zinc/24/91/67/333249167.db2.gz UIGDVRCZJVRSCF-QWJDCGKQSA-N 0 0 324.424 5.462 20 0 DKADRN C/C=C\c1ccc(NC(=O)N2CCCCC[C@H]2c2ccco2)cc1 ZINC000497420869 333249135 /nfs/dbraw/zinc/24/91/35/333249135.db2.gz UIGDVRCZJVRSCF-YJZQKKCRSA-N 0 0 324.424 5.462 20 0 DKADRN C/C=C\c1ccc(NC(=O)N2CCCCC[C@@H]2c2ccco2)cc1 ZINC000497420872 333249142 /nfs/dbraw/zinc/24/91/42/333249142.db2.gz UIGDVRCZJVRSCF-YPGWQFMBSA-N 0 0 324.424 5.462 20 0 DKADRN C/C=C/c1ccc(NC(=O)N2CCC[C@@H]2c2ccccc2)cc1 ZINC000497421495 333249275 /nfs/dbraw/zinc/24/92/75/333249275.db2.gz XBSSGZSKGXXERX-DBKQCEECSA-N 0 0 306.409 5.089 20 0 DKADRN C/C=C/c1ccc(NC(=O)N2CCC[C@H]2c2ccccc2)cc1 ZINC000497421496 333249289 /nfs/dbraw/zinc/24/92/89/333249289.db2.gz XBSSGZSKGXXERX-GBVBSETHSA-N 0 0 306.409 5.089 20 0 DKADRN C/C=C\c1ccc(NC(=O)N2CCC[C@H]2c2ccccc2)cc1 ZINC000497421497 333249281 /nfs/dbraw/zinc/24/92/81/333249281.db2.gz XBSSGZSKGXXERX-NRUPQRNLSA-N 0 0 306.409 5.089 20 0 DKADRN C/C=C\c1ccc(NC(=O)N2CCC[C@@H]2c2ccccc2)cc1 ZINC000497421498 333249253 /nfs/dbraw/zinc/24/92/53/333249253.db2.gz XBSSGZSKGXXERX-RQEHUIBCSA-N 0 0 306.409 5.089 20 0 DKADRN CC(C)c1nc(CN(C)[C@H](c2ccccc2)C(C)C)cs1 ZINC000497421980 333249212 /nfs/dbraw/zinc/24/92/12/333249212.db2.gz ILKGQGRENCECQO-KRWDZBQOSA-N 0 0 302.487 5.096 20 0 DKADRN CC(C)c1nc(CN(C)[C@@H](c2ccccc2)C(C)C)cs1 ZINC000497421981 333249230 /nfs/dbraw/zinc/24/92/30/333249230.db2.gz ILKGQGRENCECQO-QGZVFWFLSA-N 0 0 302.487 5.096 20 0 DKADRN Cc1ccc(CCCCC(=O)N2CCC[C@H]2c2ccccc2)cc1 ZINC000497431822 333250002 /nfs/dbraw/zinc/25/00/02/333250002.db2.gz SLJWBXZIMVLRSA-NRFANRHFSA-N 0 0 321.464 5.072 20 0 DKADRN Cc1c2cccc(C)c2oc1C(=O)N1CCC[C@@H]1c1ccccc1 ZINC000497439659 333251391 /nfs/dbraw/zinc/25/13/91/333251391.db2.gz FKFNZVFEMBDEFN-GOSISDBHSA-N 0 0 319.404 5.027 20 0 DKADRN Cc1c2cccc(C)c2oc1C(=O)N1CCC[C@H]1c1ccccc1 ZINC000497439688 333251216 /nfs/dbraw/zinc/25/12/16/333251216.db2.gz FKFNZVFEMBDEFN-SFHVURJKSA-N 0 0 319.404 5.027 20 0 DKADRN CCCc1ccccc1NC(=O)c1ccc(-c2ccccc2F)o1 ZINC000497440759 333251228 /nfs/dbraw/zinc/25/12/28/333251228.db2.gz BYASZOMKWFOQNH-UHFFFAOYSA-N 0 0 323.367 5.291 20 0 DKADRN Cc1ccc(C(C)(C)CC(=O)N2CCC[C@H]2c2ccccc2)cc1 ZINC000497444757 333252250 /nfs/dbraw/zinc/25/22/50/333252250.db2.gz REDBGCODMDVYRJ-FQEVSTJZSA-N 0 0 321.464 5.026 20 0 DKADRN Cc1ccc(C(C)(C)CC(=O)N2CCC[C@@H]2c2ccccc2)cc1 ZINC000497444759 333252118 /nfs/dbraw/zinc/25/21/18/333252118.db2.gz REDBGCODMDVYRJ-HXUWFJFHSA-N 0 0 321.464 5.026 20 0 DKADRN Cc1ccccc1NC(=O)Nc1cc(C(F)F)ccc1Cl ZINC000497448824 333252795 /nfs/dbraw/zinc/25/27/95/333252795.db2.gz ZVJJISAHHUIXAU-UHFFFAOYSA-N 0 0 310.731 5.230 20 0 DKADRN CCCc1ccccc1NC(=O)[C@H](C)Sc1ccc(C)cc1 ZINC000497450786 333252338 /nfs/dbraw/zinc/25/23/38/333252338.db2.gz ZODJYWBTWHCVLP-HNNXBMFYSA-N 0 0 313.466 5.067 20 0 DKADRN CCCc1ccccc1NC(=O)[C@@H](C)Sc1ccc(C)cc1 ZINC000497450789 333252517 /nfs/dbraw/zinc/25/25/17/333252517.db2.gz ZODJYWBTWHCVLP-OAHLLOKOSA-N 0 0 313.466 5.067 20 0 DKADRN CCCc1ccccc1NC(=O)C1(c2ccccc2)CCCC1 ZINC000497452895 333252685 /nfs/dbraw/zinc/25/26/85/333252685.db2.gz CNSJDDVIVFYSBV-UHFFFAOYSA-N 0 0 307.437 5.090 20 0 DKADRN CCCc1ccccc1NC(=O)CCSc1ccc(C)cc1 ZINC000497456463 333252999 /nfs/dbraw/zinc/25/29/99/333252999.db2.gz CJTXSLVANJJWNU-UHFFFAOYSA-N 0 0 313.466 5.068 20 0 DKADRN CC(C)c1cccc(C(C)C)c1NC(=O)N1CCCC(C)(C)C1 ZINC000497460180 333253529 /nfs/dbraw/zinc/25/35/29/333253529.db2.gz ASVSDTBYJVSJJR-UHFFFAOYSA-N 0 0 316.489 5.587 20 0 DKADRN CCc1ccc(NC(=O)N(C)[C@H](c2ccccc2)C(C)C)cc1 ZINC000497461241 333253730 /nfs/dbraw/zinc/25/37/30/333253730.db2.gz CEHDMYIWYYQUPX-IBGZPJMESA-N 0 0 310.441 5.110 20 0 DKADRN CCc1ccc(NC(=O)N(C)[C@@H](c2ccccc2)C(C)C)cc1 ZINC000497461246 333253769 /nfs/dbraw/zinc/25/37/69/333253769.db2.gz CEHDMYIWYYQUPX-LJQANCHMSA-N 0 0 310.441 5.110 20 0 DKADRN Cc1ccccc1NC(=O)C[C@@H](C)c1ccc(C(F)(F)F)cc1 ZINC000497461853 333253709 /nfs/dbraw/zinc/25/37/09/333253709.db2.gz ZDJJVPYIYYWDID-CYBMUJFWSA-N 0 0 321.342 5.146 20 0 DKADRN Cc1ccccc1NC(=O)C[C@H](C)c1ccc(C(F)(F)F)cc1 ZINC000497461859 333253664 /nfs/dbraw/zinc/25/36/64/333253664.db2.gz ZDJJVPYIYYWDID-ZDUSSCGKSA-N 0 0 321.342 5.146 20 0 DKADRN CC(C)c1ccc(NC(=O)N[C@@H](C)CC2CC2)c(C(C)C)c1 ZINC000497473630 333254668 /nfs/dbraw/zinc/25/46/68/333254668.db2.gz UBXWITWDFGZEJD-AWEZNQCLSA-N 0 0 302.462 5.244 20 0 DKADRN CC(C)c1ccc(NC(=O)N[C@H](C)CC2CC2)c(C(C)C)c1 ZINC000497473633 333254649 /nfs/dbraw/zinc/25/46/49/333254649.db2.gz UBXWITWDFGZEJD-CQSZACIVSA-N 0 0 302.462 5.244 20 0 DKADRN Cc1ccc(NC(=O)N(C)[C@H](c2ccccc2)C(C)C)cc1C ZINC000497475604 333254709 /nfs/dbraw/zinc/25/47/09/333254709.db2.gz XAEQAFDMSCHTEN-IBGZPJMESA-N 0 0 310.441 5.164 20 0 DKADRN Cc1ccc(NC(=O)N(C)[C@@H](c2ccccc2)C(C)C)cc1C ZINC000497475605 333254693 /nfs/dbraw/zinc/25/46/93/333254693.db2.gz XAEQAFDMSCHTEN-LJQANCHMSA-N 0 0 310.441 5.164 20 0 DKADRN CC(C)c1cccc(C(C)C)c1NC(=O)N[C@@H](C)CC1CC1 ZINC000497475963 333254971 /nfs/dbraw/zinc/25/49/71/333254971.db2.gz YAEYNWVPIAMLBG-AWEZNQCLSA-N 0 0 302.462 5.244 20 0 DKADRN CC(C)c1cccc(C(C)C)c1NC(=O)N[C@H](C)CC1CC1 ZINC000497475967 333254999 /nfs/dbraw/zinc/25/49/99/333254999.db2.gz YAEYNWVPIAMLBG-CQSZACIVSA-N 0 0 302.462 5.244 20 0 DKADRN CCCc1ccccc1NC(=O)c1csc(-c2ccccc2)n1 ZINC000497476298 333254930 /nfs/dbraw/zinc/25/49/30/333254930.db2.gz JEOBBRDKTMCSLD-UHFFFAOYSA-N 0 0 322.433 5.015 20 0 DKADRN Cc1cc(C)c(NC(=O)N(C)[C@H](c2ccccc2)C(C)C)c(C)c1 ZINC000497476709 333254904 /nfs/dbraw/zinc/25/49/04/333254904.db2.gz AKALOWFJACEAPK-FQEVSTJZSA-N 0 0 324.468 5.473 20 0 DKADRN Cc1cc(C)c(NC(=O)N(C)[C@@H](c2ccccc2)C(C)C)c(C)c1 ZINC000497476712 333254939 /nfs/dbraw/zinc/25/49/39/333254939.db2.gz AKALOWFJACEAPK-HXUWFJFHSA-N 0 0 324.468 5.473 20 0 DKADRN CCCc1ccccc1NC(=O)[C@H]1C[C@@H]1c1ccccc1Cl ZINC000497476784 333255013 /nfs/dbraw/zinc/25/50/13/333255013.db2.gz GSCWAKMHBWQHGL-CVEARBPZSA-N 0 0 313.828 5.035 20 0 DKADRN CCCc1ccccc1NC(=O)[C@H]1C[C@H]1c1ccccc1Cl ZINC000497476788 333254956 /nfs/dbraw/zinc/25/49/56/333254956.db2.gz GSCWAKMHBWQHGL-HOTGVXAUSA-N 0 0 313.828 5.035 20 0 DKADRN CCCc1ccccc1NC(=O)[C@@H]1C[C@@H]1c1ccccc1Cl ZINC000497476791 333254929 /nfs/dbraw/zinc/25/49/29/333254929.db2.gz GSCWAKMHBWQHGL-HZPDHXFCSA-N 0 0 313.828 5.035 20 0 DKADRN CCCc1ccccc1NC(=O)[C@@H]1C[C@H]1c1ccccc1Cl ZINC000497476793 333254903 /nfs/dbraw/zinc/25/49/03/333254903.db2.gz GSCWAKMHBWQHGL-JKSUJKDBSA-N 0 0 313.828 5.035 20 0 DKADRN Cc1ccc(C)c(NC(=O)N(C)[C@H](c2ccccc2)C(C)C)c1 ZINC000497478345 333255200 /nfs/dbraw/zinc/25/52/00/333255200.db2.gz FTYCAMKMUPBGBL-IBGZPJMESA-N 0 0 310.441 5.164 20 0 DKADRN Cc1ccc(C)c(NC(=O)N(C)[C@@H](c2ccccc2)C(C)C)c1 ZINC000497478347 333255120 /nfs/dbraw/zinc/25/51/20/333255120.db2.gz FTYCAMKMUPBGBL-LJQANCHMSA-N 0 0 310.441 5.164 20 0 DKADRN CC(C)c1ccccc1NC(=O)N(C)[C@H](c1ccccc1)C(C)C ZINC000497479401 333255097 /nfs/dbraw/zinc/25/50/97/333255097.db2.gz IAFHWMMHULFHAS-FQEVSTJZSA-N 0 0 324.468 5.671 20 0 DKADRN CC(C)c1ccccc1NC(=O)N(C)[C@@H](c1ccccc1)C(C)C ZINC000497479404 333255127 /nfs/dbraw/zinc/25/51/27/333255127.db2.gz IAFHWMMHULFHAS-HXUWFJFHSA-N 0 0 324.468 5.671 20 0 DKADRN CCc1cccc(NC(=O)N(C)[C@H](c2ccccc2)C(C)C)c1 ZINC000497480318 333255098 /nfs/dbraw/zinc/25/50/98/333255098.db2.gz KJUVJIPNGYQIAW-IBGZPJMESA-N 0 0 310.441 5.110 20 0 DKADRN CCc1cccc(NC(=O)N(C)[C@@H](c2ccccc2)C(C)C)c1 ZINC000497480321 333255220 /nfs/dbraw/zinc/25/52/20/333255220.db2.gz KJUVJIPNGYQIAW-LJQANCHMSA-N 0 0 310.441 5.110 20 0 DKADRN CCCc1ccccc1NC(=O)N(C)[C@H](c1ccccc1)C(C)C ZINC000497480797 333255420 /nfs/dbraw/zinc/25/54/20/333255420.db2.gz FKLLBJSTCWVAJS-FQEVSTJZSA-N 0 0 324.468 5.500 20 0 DKADRN CCCc1ccccc1NC(=O)N(C)[C@@H](c1ccccc1)C(C)C ZINC000497480800 333255360 /nfs/dbraw/zinc/25/53/60/333255360.db2.gz FKLLBJSTCWVAJS-HXUWFJFHSA-N 0 0 324.468 5.500 20 0 DKADRN Cc1cccc(NC(=O)N(C)[C@H](c2ccccc2)C(C)C)c1C ZINC000497480834 333255340 /nfs/dbraw/zinc/25/53/40/333255340.db2.gz PADUQGLOWKKLOX-IBGZPJMESA-N 0 0 310.441 5.164 20 0 DKADRN Cc1cccc(NC(=O)N(C)[C@@H](c2ccccc2)C(C)C)c1C ZINC000497480835 333255357 /nfs/dbraw/zinc/25/53/57/333255357.db2.gz PADUQGLOWKKLOX-LJQANCHMSA-N 0 0 310.441 5.164 20 0 DKADRN CCc1ccccc1NC(=O)N(C)[C@H](c1ccccc1)C(C)C ZINC000497481661 333255331 /nfs/dbraw/zinc/25/53/31/333255331.db2.gz IDVZGAGURFPZCL-IBGZPJMESA-N 0 0 310.441 5.110 20 0 DKADRN CCc1ccccc1NC(=O)N(C)[C@@H](c1ccccc1)C(C)C ZINC000497481663 333255367 /nfs/dbraw/zinc/25/53/67/333255367.db2.gz IDVZGAGURFPZCL-LJQANCHMSA-N 0 0 310.441 5.110 20 0 DKADRN Cc1ccc(Cl)cc1NC(=O)c1cc2ccc(Cl)cc2[nH]1 ZINC000497482828 333255877 /nfs/dbraw/zinc/25/58/77/333255877.db2.gz RGQGCTHKNSJQBH-UHFFFAOYSA-N 0 0 319.191 5.035 20 0 DKADRN CCCc1ccccc1NC(=O)c1ccc(Cl)c2cccnc12 ZINC000497483679 333255803 /nfs/dbraw/zinc/25/58/03/333255803.db2.gz XFDCRUOJJFRBTL-UHFFFAOYSA-N 0 0 324.811 5.093 20 0 DKADRN C[C@H](CC1CC1)NC(=O)Nc1ccccc1SC1CCCC1 ZINC000497484935 333255328 /nfs/dbraw/zinc/25/53/28/333255328.db2.gz YAEJEGHWGKSZAL-CYBMUJFWSA-N 0 0 318.486 5.031 20 0 DKADRN C[C@@H](CC1CC1)NC(=O)Nc1ccccc1SC1CCCC1 ZINC000497484940 333255379 /nfs/dbraw/zinc/25/53/79/333255379.db2.gz YAEJEGHWGKSZAL-ZDUSSCGKSA-N 0 0 318.486 5.031 20 0 DKADRN CC(C)c1cccc(C(C)C)c1NC(=O)c1n[nH]c2ccccc21 ZINC000497499718 333257132 /nfs/dbraw/zinc/25/71/32/333257132.db2.gz URNKUFKEHGVMIK-UHFFFAOYSA-N 0 0 321.424 5.062 20 0 DKADRN Cc1c2cccc(C)c2oc1C(=O)Nc1cc(Cl)ccc1C ZINC000497518646 333258776 /nfs/dbraw/zinc/25/87/76/333258776.db2.gz ILJMNMRHZCGRFP-UHFFFAOYSA-N 0 0 313.784 5.264 20 0 DKADRN CC(C)c1ccccc1NC(=O)CCc1cc2ccccc2o1 ZINC000497519259 333258041 /nfs/dbraw/zinc/25/80/41/333258041.db2.gz AUEMGTHHQSYAIV-UHFFFAOYSA-N 0 0 307.393 5.128 20 0 DKADRN Cc1ccc(Cl)cc1NC(=O)[C@H]1C[C@@H]1c1cccc(Cl)c1 ZINC000497519366 333258246 /nfs/dbraw/zinc/25/82/46/333258246.db2.gz KXWZSKBNWMWIBV-CABCVRRESA-N 0 0 320.219 5.044 20 0 DKADRN Cc1ccc(Cl)cc1NC(=O)[C@H]1C[C@H]1c1cccc(Cl)c1 ZINC000497519367 333258068 /nfs/dbraw/zinc/25/80/68/333258068.db2.gz KXWZSKBNWMWIBV-GJZGRUSLSA-N 0 0 320.219 5.044 20 0 DKADRN Cc1ccc(Cl)cc1NC(=O)[C@@H]1C[C@H]1c1cccc(Cl)c1 ZINC000497519368 333258096 /nfs/dbraw/zinc/25/80/96/333258096.db2.gz KXWZSKBNWMWIBV-LSDHHAIUSA-N 0 0 320.219 5.044 20 0 DKADRN Cc1csc(CN[C@@H](c2cc3ccccc3o2)C(C)(C)C)n1 ZINC000497519698 333258065 /nfs/dbraw/zinc/25/80/65/333258065.db2.gz BUTPDEDGBNBKIF-KRWDZBQOSA-N 0 0 314.454 5.075 20 0 DKADRN Cc1csc(CN[C@H](c2cc3ccccc3o2)C(C)(C)C)n1 ZINC000497519701 333258179 /nfs/dbraw/zinc/25/81/79/333258179.db2.gz BUTPDEDGBNBKIF-QGZVFWFLSA-N 0 0 314.454 5.075 20 0 DKADRN Cc1nc(C(C)(C)C)sc1C(=O)Nc1ccccc1C(C)C ZINC000497520874 333258333 /nfs/dbraw/zinc/25/83/33/333258333.db2.gz DAMOLYFCUQZTCG-UHFFFAOYSA-N 0 0 316.470 5.125 20 0 DKADRN CC(C)c1ccccc1NC(=O)[C@@H]1C[C@H]1c1cccc(Cl)c1 ZINC000497531521 333260269 /nfs/dbraw/zinc/26/02/69/333260269.db2.gz GMNQNKLICZORKY-DLBZAZTESA-N 0 0 313.828 5.206 20 0 DKADRN CC(C)c1ccccc1NC(=O)[C@H]1C[C@H]1c1cccc(Cl)c1 ZINC000497531532 333260165 /nfs/dbraw/zinc/26/01/65/333260165.db2.gz GMNQNKLICZORKY-IRXDYDNUSA-N 0 0 313.828 5.206 20 0 DKADRN CC(C)c1ccccc1NC(=O)[C@H]1C[C@@H]1c1cccc(Cl)c1 ZINC000497531536 333260150 /nfs/dbraw/zinc/26/01/50/333260150.db2.gz GMNQNKLICZORKY-SJORKVTESA-N 0 0 313.828 5.206 20 0 DKADRN CC(C)c1ccccc1NC(=O)Cc1cc(Cl)ccc1Cl ZINC000497534179 333259791 /nfs/dbraw/zinc/25/97/91/333259791.db2.gz PIYCGEMXVPGONO-UHFFFAOYSA-N 0 0 322.235 5.298 20 0 DKADRN Cc1c2cccc(C)c2oc1C(=O)Nc1ccccc1C(C)C ZINC000497535574 333259854 /nfs/dbraw/zinc/25/98/54/333259854.db2.gz WBACWMZZFVVQBS-UHFFFAOYSA-N 0 0 307.393 5.425 20 0 DKADRN Cc1ccccc1S[C@H](C)C(=O)Nc1cccc(Cl)c1C ZINC000497537333 333260609 /nfs/dbraw/zinc/26/06/09/333260609.db2.gz GDGDVXPWBJCNAJ-CYBMUJFWSA-N 0 0 319.857 5.076 20 0 DKADRN Cc1ccc(NC(=O)[C@@H](C)Sc2ccccc2C)c(Cl)c1 ZINC000497537733 333260812 /nfs/dbraw/zinc/26/08/12/333260812.db2.gz IGLOICMBYBEXKR-CYBMUJFWSA-N 0 0 319.857 5.076 20 0 DKADRN Cc1ccccc1S[C@H](C)C(=O)Nc1ccc(Cl)cc1C ZINC000497538975 333260953 /nfs/dbraw/zinc/26/09/53/333260953.db2.gz NATRAVRKKJNEHL-CYBMUJFWSA-N 0 0 319.857 5.076 20 0 DKADRN CC(C)[C@@H](C)C(=O)Nc1ccccc1-c1nc2ccccc2s1 ZINC000497555893 333262395 /nfs/dbraw/zinc/26/23/95/333262395.db2.gz FKJHQWMRKQXXGU-CYBMUJFWSA-N 0 0 324.449 5.194 20 0 DKADRN CC(C)[C@H](C)C(=O)Nc1ccccc1-c1nc2ccccc2s1 ZINC000497555894 333262411 /nfs/dbraw/zinc/26/24/11/333262411.db2.gz FKJHQWMRKQXXGU-ZDUSSCGKSA-N 0 0 324.449 5.194 20 0 DKADRN CC(C)[C@@H](C)C(=O)Nc1ccccc1Oc1ccccc1Cl ZINC000497566829 333263566 /nfs/dbraw/zinc/26/35/66/333263566.db2.gz BTXXHDAJZLBENS-CYBMUJFWSA-N 0 0 317.816 5.363 20 0 DKADRN CC(C)[C@H](C)C(=O)Nc1ccccc1Oc1ccccc1Cl ZINC000497566830 333263577 /nfs/dbraw/zinc/26/35/77/333263577.db2.gz BTXXHDAJZLBENS-ZDUSSCGKSA-N 0 0 317.816 5.363 20 0 DKADRN CC(C)c1ccoc1C(=O)Nc1cccc(NC2CCCC2)c1 ZINC000497579411 333264600 /nfs/dbraw/zinc/26/46/00/333264600.db2.gz QXSVPGDPHBJGPC-UHFFFAOYSA-N 0 0 312.413 5.010 20 0 DKADRN Cc1ccc(Cl)cc1NC(=O)[C@@H](C)Sc1ccccc1C ZINC000497580857 333264846 /nfs/dbraw/zinc/26/48/46/333264846.db2.gz OPVAZRRQDIPQEW-CYBMUJFWSA-N 0 0 319.857 5.076 20 0 DKADRN Cc1ccc([C@@H]2CCCN2C(=O)CC(C)(C)c2ccccc2)cc1 ZINC000497590783 333266460 /nfs/dbraw/zinc/26/64/60/333266460.db2.gz NUBNUJFNWAWPSU-FQEVSTJZSA-N 0 0 321.464 5.026 20 0 DKADRN Cc1ccc([C@H]2CCCN2C(=O)CC(C)(C)c2ccccc2)cc1 ZINC000497590784 333266647 /nfs/dbraw/zinc/26/66/47/333266647.db2.gz NUBNUJFNWAWPSU-HXUWFJFHSA-N 0 0 321.464 5.026 20 0 DKADRN Cc1ccc([C@H]2CCCN2C(=O)c2cc3cccc(C)c3o2)cc1 ZINC000497591019 333266636 /nfs/dbraw/zinc/26/66/36/333266636.db2.gz SHXJMRLGGPQZIS-GOSISDBHSA-N 0 0 319.404 5.027 20 0 DKADRN Cc1ccc([C@@H]2CCCN2C(=O)c2cc3cccc(C)c3o2)cc1 ZINC000497591020 333266530 /nfs/dbraw/zinc/26/65/30/333266530.db2.gz SHXJMRLGGPQZIS-SFHVURJKSA-N 0 0 319.404 5.027 20 0 DKADRN CC[C@@H](C)Oc1cccc(NC(=O)c2scc(C)c2Cl)c1 ZINC000497643125 333273292 /nfs/dbraw/zinc/27/32/92/333273292.db2.gz PORXZCSJPPNHHD-LLVKDONJSA-N 0 0 323.845 5.140 20 0 DKADRN CC[C@H](C)Oc1cccc(NC(=O)c2scc(C)c2Cl)c1 ZINC000497643127 333273342 /nfs/dbraw/zinc/27/33/42/333273342.db2.gz PORXZCSJPPNHHD-NSHDSACASA-N 0 0 323.845 5.140 20 0 DKADRN C[C@@H](Sc1ccc(C(F)(F)F)cn1)c1ccc(F)c(F)c1 ZINC000497655693 333274202 /nfs/dbraw/zinc/27/42/02/333274202.db2.gz GZDTZPWKJMGDAG-MRVPVSSYSA-N 0 0 319.298 5.232 20 0 DKADRN C[C@@H](Sc1ccc(C(F)(F)F)cn1)c1ccc(F)cc1F ZINC000497656287 333274132 /nfs/dbraw/zinc/27/41/32/333274132.db2.gz MTZWFXMDACCJMW-MRVPVSSYSA-N 0 0 319.298 5.232 20 0 DKADRN CC(C)(C)c1cnc(CSc2nc3ccc(Cl)cc3o2)o1 ZINC000497668437 333275904 /nfs/dbraw/zinc/27/59/04/333275904.db2.gz RHXLVXDVRZBYCP-UHFFFAOYSA-N 0 0 322.817 5.059 20 0 DKADRN CC(C)c1ccccc1OCc1coc(-c2cccc(F)c2)n1 ZINC000497670941 333276493 /nfs/dbraw/zinc/27/64/93/333276493.db2.gz OHVUSTNSLZBGDC-UHFFFAOYSA-N 0 0 311.356 5.183 20 0 DKADRN Cc1ccccc1NC(=O)N1CCCC[C@H]1CCc1ccccc1 ZINC000497671271 333276636 /nfs/dbraw/zinc/27/66/36/333276636.db2.gz JMNOLZBDUVSMJH-IBGZPJMESA-N 0 0 322.452 5.014 20 0 DKADRN Cc1ccccc1NC(=O)N1CCCC[C@@H]1CCc1ccccc1 ZINC000497671272 333276477 /nfs/dbraw/zinc/27/64/77/333276477.db2.gz JMNOLZBDUVSMJH-LJQANCHMSA-N 0 0 322.452 5.014 20 0 DKADRN C[C@@H](Sc1ncnc2sccc21)c1cccc(Cl)c1 ZINC000497671813 333276852 /nfs/dbraw/zinc/27/68/52/333276852.db2.gz PRQDBKGFDFRJDS-SECBINFHSA-N 0 0 306.843 5.198 20 0 DKADRN C[C@H](Sc1ncnc2sccc21)c1cccc(Cl)c1 ZINC000497671823 333276781 /nfs/dbraw/zinc/27/67/81/333276781.db2.gz PRQDBKGFDFRJDS-VIFPVBQESA-N 0 0 306.843 5.198 20 0 DKADRN C[C@@H](Sc1ncnc2sccc21)c1ccc(F)c(Cl)c1 ZINC000497671993 333276015 /nfs/dbraw/zinc/27/60/15/333276015.db2.gz RKONCUTYHDZFDE-MRVPVSSYSA-N 0 0 324.833 5.337 20 0 DKADRN C[C@H](Sc1ncnc2sccc21)c1ccc(F)c(Cl)c1 ZINC000497671998 333276096 /nfs/dbraw/zinc/27/60/96/333276096.db2.gz RKONCUTYHDZFDE-QMMMGPOBSA-N 0 0 324.833 5.337 20 0 DKADRN Cc1nc2ccccc2c(S[C@@H](C)c2ccc(F)cc2F)n1 ZINC000497672092 333276025 /nfs/dbraw/zinc/27/60/25/333276025.db2.gz SPLKLTORWAYHPU-JTQLQIEISA-N 0 0 316.376 5.070 20 0 DKADRN Cc1nc2ccccc2c(S[C@H](C)c2ccc(F)cc2F)n1 ZINC000497672098 333276098 /nfs/dbraw/zinc/27/60/98/333276098.db2.gz SPLKLTORWAYHPU-SNVBAGLBSA-N 0 0 316.376 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CCC[C@H](C)C(=O)N([C@H](C)c1ccc2ccccc2c1)C1CC1 ZINC000497836005 333299180 /nfs/dbraw/zinc/29/91/80/333299180.db2.gz LVTMUUFCYONTJF-JKSUJKDBSA-N 0 0 309.453 5.328 20 0 DKADRN CC(C)[C@@H](C)C(=O)N([C@@H](C)c1ccc2ccccc2c1)C1CC1 ZINC000497836909 333299070 /nfs/dbraw/zinc/29/90/70/333299070.db2.gz QRKMVWAWOWQWHB-CVEARBPZSA-N 0 0 309.453 5.184 20 0 DKADRN CC(C)[C@H](C)C(=O)N([C@@H](C)c1ccc2ccccc2c1)C1CC1 ZINC000497836910 333299176 /nfs/dbraw/zinc/29/91/76/333299176.db2.gz QRKMVWAWOWQWHB-HOTGVXAUSA-N 0 0 309.453 5.184 20 0 DKADRN CC(C)[C@@H](C)C(=O)N([C@H](C)c1ccc2ccccc2c1)C1CC1 ZINC000497836911 333299105 /nfs/dbraw/zinc/29/91/05/333299105.db2.gz QRKMVWAWOWQWHB-HZPDHXFCSA-N 0 0 309.453 5.184 20 0 DKADRN CC(C)[C@H](C)C(=O)N([C@H](C)c1ccc2ccccc2c1)C1CC1 ZINC000497836912 333299133 /nfs/dbraw/zinc/29/91/33/333299133.db2.gz QRKMVWAWOWQWHB-JKSUJKDBSA-N 0 0 309.453 5.184 20 0 DKADRN C[C@]12CC3CC(C(=O)Nc4ccc5[nH]ccc5c4)(C1)C[C@@](C)(C3)C2 ZINC000497856843 333302442 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ZINC000498808660 340023710 /nfs/dbraw/zinc/02/37/10/340023710.db2.gz ZRUHJIUICDQVJK-RTWAWAEBSA-N 0 0 321.464 5.106 20 0 DKADRN CC[C@@H](c1ccccc1)N(CC)C(=O)[C@H]1CCCc2ccccc21 ZINC000498808661 340023659 /nfs/dbraw/zinc/02/36/59/340023659.db2.gz ZRUHJIUICDQVJK-SFTDATJTSA-N 0 0 321.464 5.106 20 0 DKADRN CC[C@@H](c1ccccc1)N(CC)C(=O)CCCc1ccccc1 ZINC000498809842 340023693 /nfs/dbraw/zinc/02/36/93/340023693.db2.gz AJWDGAKRPIWFDH-FQEVSTJZSA-N 0 0 309.453 5.009 20 0 DKADRN CC[C@H](c1ccccc1)N(CC)C(=O)CCCc1ccccc1 ZINC000498809843 340023713 /nfs/dbraw/zinc/02/37/13/340023713.db2.gz AJWDGAKRPIWFDH-HXUWFJFHSA-N 0 0 309.453 5.009 20 0 DKADRN CCCCN(C(=O)CCc1cccs1)[C@@H](C)c1ccccc1 ZINC000498811343 333273129 /nfs/dbraw/zinc/27/31/29/333273129.db2.gz JHEJAEVKPPRSMS-INIZCTEOSA-N 0 0 315.482 5.071 20 0 DKADRN CCCCN(C(=O)CCc1cccs1)[C@H](C)c1ccccc1 ZINC000498811344 333273011 /nfs/dbraw/zinc/27/30/11/333273011.db2.gz JHEJAEVKPPRSMS-MRXNPFEDSA-N 0 0 315.482 5.071 20 0 DKADRN CC[C@H](c1ccccc1)N(CC)C(=O)c1ccc(Cl)s1 ZINC000498811547 340023836 /nfs/dbraw/zinc/02/38/36/340023836.db2.gz KYGZZGDQZDNXIM-CYBMUJFWSA-N 0 0 307.846 5.015 20 0 DKADRN CC[C@@H](c1ccccc1)N(CC)C(=O)c1ccc(Cl)s1 ZINC000498811548 340023811 /nfs/dbraw/zinc/02/38/11/340023811.db2.gz KYGZZGDQZDNXIM-ZDUSSCGKSA-N 0 0 307.846 5.015 20 0 DKADRN CCCCN(C(=O)CCc1ccccc1)[C@H](C)c1ccccc1 ZINC000498814784 340023948 /nfs/dbraw/zinc/02/39/48/340023948.db2.gz CNJJFSOYSPZSJH-GOSISDBHSA-N 0 0 309.453 5.009 20 0 DKADRN CCCCN(C(=O)CCc1ccccc1)[C@@H](C)c1ccccc1 ZINC000498814786 340023960 /nfs/dbraw/zinc/02/39/60/340023960.db2.gz CNJJFSOYSPZSJH-SFHVURJKSA-N 0 0 309.453 5.009 20 0 DKADRN CCCCN(C(=O)c1sccc1C)[C@@H](C)c1ccccc1 ZINC000498815198 340023802 /nfs/dbraw/zinc/02/38/02/340023802.db2.gz HTQRHQVMWMOJIY-HNNXBMFYSA-N 0 0 301.455 5.060 20 0 DKADRN CCCCN(C(=O)c1sccc1C)[C@H](C)c1ccccc1 ZINC000498815199 340023915 /nfs/dbraw/zinc/02/39/15/340023915.db2.gz HTQRHQVMWMOJIY-OAHLLOKOSA-N 0 0 301.455 5.060 20 0 DKADRN CCCCN(C(=O)c1ccc(C)s1)[C@@H](C)c1ccccc1 ZINC000498816662 340023871 /nfs/dbraw/zinc/02/38/71/340023871.db2.gz ULAJLTFUHBJKRC-HNNXBMFYSA-N 0 0 301.455 5.060 20 0 DKADRN CCCCN(C(=O)c1ccc(C)s1)[C@H](C)c1ccccc1 ZINC000498816663 340023924 /nfs/dbraw/zinc/02/39/24/340023924.db2.gz ULAJLTFUHBJKRC-OAHLLOKOSA-N 0 0 301.455 5.060 20 0 DKADRN CCCCN(C(=O)CCc1ccsc1)[C@@H](C)c1ccccc1 ZINC000498818453 340023939 /nfs/dbraw/zinc/02/39/39/340023939.db2.gz DLXRHGWRBBKNER-INIZCTEOSA-N 0 0 315.482 5.071 20 0 DKADRN CCCCN(C(=O)CCc1ccsc1)[C@H](C)c1ccccc1 ZINC000498818454 340023941 /nfs/dbraw/zinc/02/39/41/340023941.db2.gz DLXRHGWRBBKNER-MRXNPFEDSA-N 0 0 315.482 5.071 20 0 DKADRN CCCN(C(=O)C[C@@H](C)c1ccccc1)[C@@H]1CCc2ccccc21 ZINC000498828844 333279787 /nfs/dbraw/zinc/27/97/87/333279787.db2.gz WEGJZNZCPLQSEY-DYESRHJHSA-N 0 0 321.464 5.106 20 0 DKADRN CCCN(C(=O)C[C@H](C)c1ccccc1)[C@@H]1CCc2ccccc21 ZINC000498828845 333279834 /nfs/dbraw/zinc/27/98/34/333279834.db2.gz WEGJZNZCPLQSEY-LAUBAEHRSA-N 0 0 321.464 5.106 20 0 DKADRN CCCN(C(=O)C[C@@H](C)c1ccccc1)[C@H]1CCc2ccccc21 ZINC000498828846 333279930 /nfs/dbraw/zinc/27/99/30/333279930.db2.gz WEGJZNZCPLQSEY-UTKZUKDTSA-N 0 0 321.464 5.106 20 0 DKADRN CCCN(C(=O)C[C@H](C)c1ccccc1)[C@H]1CCc2ccccc21 ZINC000498828847 333279814 /nfs/dbraw/zinc/27/98/14/333279814.db2.gz WEGJZNZCPLQSEY-UWJYYQICSA-N 0 0 321.464 5.106 20 0 DKADRN CC[C@H](C)Sc1ccc(NC(=O)N(CC)CC(C)C)c(C)c1 ZINC000498836029 340024118 /nfs/dbraw/zinc/02/41/18/340024118.db2.gz JIVYIQKBKDMEPT-HNNXBMFYSA-N 0 0 322.518 5.395 20 0 DKADRN CC[C@@H](C)Sc1ccc(NC(=O)N(CC)CC(C)C)c(C)c1 ZINC000498836030 340024167 /nfs/dbraw/zinc/02/41/67/340024167.db2.gz JIVYIQKBKDMEPT-OAHLLOKOSA-N 0 0 322.518 5.395 20 0 DKADRN CC[C@H](C)Sc1ccc(NC(=O)N2CCCC[C@H]2C)c(C)c1 ZINC000498836993 340024145 /nfs/dbraw/zinc/02/41/45/340024145.db2.gz JORZOSBROZMERS-CABCVRRESA-N 0 0 320.502 5.292 20 0 DKADRN CC[C@H](C)Sc1ccc(NC(=O)N2CCCC[C@@H]2C)c(C)c1 ZINC000498836994 340024132 /nfs/dbraw/zinc/02/41/32/340024132.db2.gz JORZOSBROZMERS-GJZGRUSLSA-N 0 0 320.502 5.292 20 0 DKADRN CC[C@@H](C)Sc1ccc(NC(=O)N2CCCC[C@H]2C)c(C)c1 ZINC000498836995 340024113 /nfs/dbraw/zinc/02/41/13/340024113.db2.gz JORZOSBROZMERS-HUUCEWRRSA-N 0 0 320.502 5.292 20 0 DKADRN CC[C@@H](C)Sc1ccc(NC(=O)N2CCCC[C@@H]2C)c(C)c1 ZINC000498836996 340024252 /nfs/dbraw/zinc/02/42/52/340024252.db2.gz JORZOSBROZMERS-LSDHHAIUSA-N 0 0 320.502 5.292 20 0 DKADRN CCCc1ccc([C@H](Nc2cc(C)ncn2)c2cccs2)cc1 ZINC000498838465 340024235 /nfs/dbraw/zinc/02/42/35/340024235.db2.gz UXGUOVUIDXJYED-IBGZPJMESA-N 0 0 323.465 5.001 20 0 DKADRN CCCc1ccc([C@@H](Nc2cc(C)ncn2)c2cccs2)cc1 ZINC000498838466 340024246 /nfs/dbraw/zinc/02/42/46/340024246.db2.gz UXGUOVUIDXJYED-LJQANCHMSA-N 0 0 323.465 5.001 20 0 DKADRN CCCCN(CC)C(=O)Nc1ccc(S[C@@H](C)CC)cc1C ZINC000498839257 340024297 /nfs/dbraw/zinc/02/42/97/340024297.db2.gz QWZGYVOUHVHWPY-HNNXBMFYSA-N 0 0 322.518 5.540 20 0 DKADRN CCCCN(CC)C(=O)Nc1ccc(S[C@H](C)CC)cc1C ZINC000498839258 340024253 /nfs/dbraw/zinc/02/42/53/340024253.db2.gz QWZGYVOUHVHWPY-OAHLLOKOSA-N 0 0 322.518 5.540 20 0 DKADRN CC[C@@H](C)Sc1ccc(NC(=O)NCC(C)(C)C)c(C)c1 ZINC000498839366 340024198 /nfs/dbraw/zinc/02/41/98/340024198.db2.gz RAHOWCNHNAWGIB-CYBMUJFWSA-N 0 0 308.491 5.053 20 0 DKADRN CC[C@H](C)Sc1ccc(NC(=O)NCC(C)(C)C)c(C)c1 ZINC000498839367 340024280 /nfs/dbraw/zinc/02/42/80/340024280.db2.gz RAHOWCNHNAWGIB-ZDUSSCGKSA-N 0 0 308.491 5.053 20 0 DKADRN CC[C@H](C)Sc1ccc(NC(=O)N2CCC(C)CC2)c(C)c1 ZINC000498839781 340024193 /nfs/dbraw/zinc/02/41/93/340024193.db2.gz SPFCGXLIJILPPV-HNNXBMFYSA-N 0 0 320.502 5.149 20 0 DKADRN CC[C@@H](C)Sc1ccc(NC(=O)N2CCC(C)CC2)c(C)c1 ZINC000498839784 340024281 /nfs/dbraw/zinc/02/42/81/340024281.db2.gz SPFCGXLIJILPPV-OAHLLOKOSA-N 0 0 320.502 5.149 20 0 DKADRN CCC[C@@H](C)N(C)C(=O)Nc1ccc(S[C@@H](C)CC)cc1C ZINC000498841160 340024295 /nfs/dbraw/zinc/02/42/95/340024295.db2.gz WTRIEOOTUOPFCV-CABCVRRESA-N 0 0 322.518 5.538 20 0 DKADRN CCC[C@H](C)N(C)C(=O)Nc1ccc(S[C@@H](C)CC)cc1C ZINC000498841161 340024199 /nfs/dbraw/zinc/02/41/99/340024199.db2.gz WTRIEOOTUOPFCV-GJZGRUSLSA-N 0 0 322.518 5.538 20 0 DKADRN CCC[C@@H](C)N(C)C(=O)Nc1ccc(S[C@H](C)CC)cc1C ZINC000498841162 340024262 /nfs/dbraw/zinc/02/42/62/340024262.db2.gz WTRIEOOTUOPFCV-HUUCEWRRSA-N 0 0 322.518 5.538 20 0 DKADRN CCC[C@H](C)N(C)C(=O)Nc1ccc(S[C@H](C)CC)cc1C ZINC000498841163 340024302 /nfs/dbraw/zinc/02/43/02/340024302.db2.gz WTRIEOOTUOPFCV-LSDHHAIUSA-N 0 0 322.518 5.538 20 0 DKADRN CCCN(CC)C(=O)Nc1ccc(S[C@@H](C)CC)cc1C ZINC000498850251 340024379 /nfs/dbraw/zinc/02/43/79/340024379.db2.gz ANDCVNUTQIWADQ-AWEZNQCLSA-N 0 0 308.491 5.149 20 0 DKADRN CCCN(CC)C(=O)Nc1ccc(S[C@H](C)CC)cc1C ZINC000498850252 340024327 /nfs/dbraw/zinc/02/43/27/340024327.db2.gz ANDCVNUTQIWADQ-CQSZACIVSA-N 0 0 308.491 5.149 20 0 DKADRN CCCCN(C)C(=O)Nc1ccc(S[C@@H](C)CC)cc1C ZINC000498854585 340024495 /nfs/dbraw/zinc/02/44/95/340024495.db2.gz JZYUMNJJGQLPDM-AWEZNQCLSA-N 0 0 308.491 5.149 20 0 DKADRN CCCCN(C)C(=O)Nc1ccc(S[C@H](C)CC)cc1C ZINC000498854586 340024504 /nfs/dbraw/zinc/02/45/04/340024504.db2.gz JZYUMNJJGQLPDM-CQSZACIVSA-N 0 0 308.491 5.149 20 0 DKADRN CCCN(CCC)C(=O)Nc1ccc(S[C@@H](C)CC)cc1C ZINC000498857609 340024447 /nfs/dbraw/zinc/02/44/47/340024447.db2.gz RLFRMXQYUSPWRO-HNNXBMFYSA-N 0 0 322.518 5.540 20 0 DKADRN CCCN(CCC)C(=O)Nc1ccc(S[C@H](C)CC)cc1C ZINC000498857610 340024471 /nfs/dbraw/zinc/02/44/71/340024471.db2.gz RLFRMXQYUSPWRO-OAHLLOKOSA-N 0 0 322.518 5.540 20 0 DKADRN C[C@@H](c1ccco1)N(C)C(=O)c1ccc(C2CCCCC2)cc1 ZINC000498893787 340025244 /nfs/dbraw/zinc/02/52/44/340025244.db2.gz SYQIPAIVMSYEMG-HNNXBMFYSA-N 0 0 311.425 5.161 20 0 DKADRN C[C@H](c1ccco1)N(C)C(=O)c1ccc(C2CCCCC2)cc1 ZINC000498893790 340025273 /nfs/dbraw/zinc/02/52/73/340025273.db2.gz SYQIPAIVMSYEMG-OAHLLOKOSA-N 0 0 311.425 5.161 20 0 DKADRN CCN(CC)C(=O)Nc1ccc(SC2CCCCC2)cc1C ZINC000498924481 340026201 /nfs/dbraw/zinc/02/62/01/340026201.db2.gz OEKSVEAFIXYTPE-UHFFFAOYSA-N 0 0 320.502 5.294 20 0 DKADRN CCC[C@@H](C)CC(=O)N(C)[C@H](C)c1cccc(C(F)(F)F)c1 ZINC000498925694 337326747 /nfs/dbraw/zinc/32/67/47/337326747.db2.gz ZTZRFEQRLIELMS-CHWSQXEVSA-N 0 0 315.379 5.051 20 0 DKADRN CCC[C@@H](C)CC(=O)N(C)[C@@H](C)c1cccc(C(F)(F)F)c1 ZINC000498925695 337326817 /nfs/dbraw/zinc/32/68/17/337326817.db2.gz ZTZRFEQRLIELMS-OLZOCXBDSA-N 0 0 315.379 5.051 20 0 DKADRN CCC[C@H](C)CC(=O)N(C)[C@H](C)c1cccc(C(F)(F)F)c1 ZINC000498925696 337326768 /nfs/dbraw/zinc/32/67/68/337326768.db2.gz ZTZRFEQRLIELMS-QWHCGFSZSA-N 0 0 315.379 5.051 20 0 DKADRN CCC[C@H](C)CC(=O)N(C)[C@@H](C)c1cccc(C(F)(F)F)c1 ZINC000498925697 337326720 /nfs/dbraw/zinc/32/67/20/337326720.db2.gz ZTZRFEQRLIELMS-STQMWFEESA-N 0 0 315.379 5.051 20 0 DKADRN CCCN(C)C(=O)Nc1ccc(SC2CCCCC2)cc1C ZINC000498926957 340026092 /nfs/dbraw/zinc/02/60/92/340026092.db2.gz XKTNKAPYZQMZIF-UHFFFAOYSA-N 0 0 320.502 5.294 20 0 DKADRN C[C@H](CC(C)(C)C)C(=O)Nc1ccccc1CCC(F)(F)F ZINC000498952949 340026947 /nfs/dbraw/zinc/02/69/47/340026947.db2.gz VSPZQURWGCFIAO-GFCCVEGCSA-N 0 0 315.379 5.192 20 0 DKADRN C[C@@H](CC(C)(C)C)C(=O)Nc1ccccc1CCC(F)(F)F ZINC000498952951 340026948 /nfs/dbraw/zinc/02/69/48/340026948.db2.gz VSPZQURWGCFIAO-LBPRGKRZSA-N 0 0 315.379 5.192 20 0 DKADRN CC(C)N(Cc1ccc(F)cc1)C(=O)c1ccc2ccccc2c1 ZINC000498955688 340027047 /nfs/dbraw/zinc/02/70/47/340027047.db2.gz MBIOPVSJXHQPJQ-UHFFFAOYSA-N 0 0 321.395 5.030 20 0 DKADRN Cc1ccccc1CN(C(=O)c1cc2ccccc2s1)C1CC1 ZINC000499040640 340028210 /nfs/dbraw/zinc/02/82/10/340028210.db2.gz KFZCYSARVQMUOF-UHFFFAOYSA-N 0 0 321.445 5.015 20 0 DKADRN Cc1ccccc1CN(C(=O)c1csc2ccccc12)C1CC1 ZINC000499042373 340028305 /nfs/dbraw/zinc/02/83/05/340028305.db2.gz OYDXMRXOZHHAAJ-UHFFFAOYSA-N 0 0 321.445 5.015 20 0 DKADRN CCCN(CC)C(=O)c1sc2cc(Cl)ccc2c1Cl ZINC000499073003 340029246 /nfs/dbraw/zinc/02/92/46/340029246.db2.gz QKYXJSRPVMPZPV-UHFFFAOYSA-N 0 0 316.253 5.080 20 0 DKADRN CCC1CCC(N(C(=O)c2coc3ccccc23)C2CC2)CC1 ZINC000499088739 340029451 /nfs/dbraw/zinc/02/94/51/340029451.db2.gz XCLYXIUPYSRDKB-UHFFFAOYSA-N 0 0 311.425 5.006 20 0 DKADRN Cc1ccc(C)c([C@H](C)N(C)C(=O)C[C@@H](C)c2ccccc2)c1 ZINC000499091328 340029438 /nfs/dbraw/zinc/02/94/38/340029438.db2.gz PMBOBDQZICRQKW-MSOLQXFVSA-N 0 0 309.453 5.017 20 0 DKADRN Cc1ccc(C)c([C@@H](C)N(C)C(=O)C[C@@H](C)c2ccccc2)c1 ZINC000499091332 340029454 /nfs/dbraw/zinc/02/94/54/340029454.db2.gz PMBOBDQZICRQKW-QZTJIDSGSA-N 0 0 309.453 5.017 20 0 DKADRN Cc1ccc(C)c([C@H](C)N(C)C(=O)C[C@H](C)c2ccccc2)c1 ZINC000499091333 335017336 /nfs/dbraw/zinc/01/73/36/335017336.db2.gz PMBOBDQZICRQKW-ROUUACIJSA-N 0 0 309.453 5.017 20 0 DKADRN Cc1ccc(C)c([C@@H](C)N(C)C(=O)C[C@H](C)c2ccccc2)c1 ZINC000499091334 335017798 /nfs/dbraw/zinc/01/77/98/335017798.db2.gz PMBOBDQZICRQKW-ZWKOTPCHSA-N 0 0 309.453 5.017 20 0 DKADRN CC(C)C[C@H](NC(=O)c1coc2ccccc12)c1cccs1 ZINC000499091484 340029372 /nfs/dbraw/zinc/02/93/72/340029372.db2.gz BEVYSKXILQBEOP-HNNXBMFYSA-N 0 0 313.422 5.012 20 0 DKADRN CC(C)C[C@@H](NC(=O)c1coc2ccccc12)c1cccs1 ZINC000499091485 340029427 /nfs/dbraw/zinc/02/94/27/340029427.db2.gz BEVYSKXILQBEOP-OAHLLOKOSA-N 0 0 313.422 5.012 20 0 DKADRN CCCCOc1ccc(NC(=O)c2coc3ccccc23)c(C)c1 ZINC000499110339 340030014 /nfs/dbraw/zinc/03/00/14/340030014.db2.gz JKRKMEIKIJOCKA-UHFFFAOYSA-N 0 0 323.392 5.172 20 0 DKADRN CCN(C(=O)CCC(C)C)[C@H](C)c1cccc(C(F)(F)F)c1 ZINC000499111805 340030007 /nfs/dbraw/zinc/03/00/07/340030007.db2.gz VPIYXRPQVQFHLK-CYBMUJFWSA-N 0 0 315.379 5.051 20 0 DKADRN CCN(C(=O)CCC(C)C)[C@@H](C)c1cccc(C(F)(F)F)c1 ZINC000499111807 340030010 /nfs/dbraw/zinc/03/00/10/340030010.db2.gz VPIYXRPQVQFHLK-ZDUSSCGKSA-N 0 0 315.379 5.051 20 0 DKADRN CCC[C@@H](C)C(=O)N(CC)[C@H](C)c1cccc(C(F)(F)F)c1 ZINC000499114932 340030176 /nfs/dbraw/zinc/03/01/76/340030176.db2.gz PQEPXOKKACFNAQ-CHWSQXEVSA-N 0 0 315.379 5.051 20 0 DKADRN CCC[C@@H](C)C(=O)N(CC)[C@@H](C)c1cccc(C(F)(F)F)c1 ZINC000499114934 340030181 /nfs/dbraw/zinc/03/01/81/340030181.db2.gz PQEPXOKKACFNAQ-OLZOCXBDSA-N 0 0 315.379 5.051 20 0 DKADRN CCC[C@H](C)C(=O)N(CC)[C@H](C)c1cccc(C(F)(F)F)c1 ZINC000499114936 340030122 /nfs/dbraw/zinc/03/01/22/340030122.db2.gz PQEPXOKKACFNAQ-QWHCGFSZSA-N 0 0 315.379 5.051 20 0 DKADRN CCC[C@H](C)C(=O)N(CC)[C@@H](C)c1cccc(C(F)(F)F)c1 ZINC000499114938 340030191 /nfs/dbraw/zinc/03/01/91/340030191.db2.gz PQEPXOKKACFNAQ-STQMWFEESA-N 0 0 315.379 5.051 20 0 DKADRN CCCN(C(=O)CCc1ccsc1)[C@H](CC)c1ccccc1 ZINC000499116080 340030201 /nfs/dbraw/zinc/03/02/01/340030201.db2.gz LVUORUPCDURNDC-GOSISDBHSA-N 0 0 315.482 5.071 20 0 DKADRN CCCN(C(=O)CCc1ccsc1)[C@@H](CC)c1ccccc1 ZINC000499116082 340030185 /nfs/dbraw/zinc/03/01/85/340030185.db2.gz LVUORUPCDURNDC-SFHVURJKSA-N 0 0 315.482 5.071 20 0 DKADRN CC(C)c1cccc(C(C)C)c1NC(=O)c1coc2ccccc12 ZINC000499117389 340030207 /nfs/dbraw/zinc/03/02/07/340030207.db2.gz XYTHIFXFDSNBLC-UHFFFAOYSA-N 0 0 321.420 5.932 20 0 DKADRN CCCN(C(=O)CCc1ccccc1)[C@@H](CC)c1ccccc1 ZINC000499120381 340030285 /nfs/dbraw/zinc/03/02/85/340030285.db2.gz CCTSENJNFUIVRV-FQEVSTJZSA-N 0 0 309.453 5.009 20 0 DKADRN CCCN(C(=O)CCc1ccccc1)[C@H](CC)c1ccccc1 ZINC000499120382 340030214 /nfs/dbraw/zinc/03/02/14/340030214.db2.gz CCTSENJNFUIVRV-HXUWFJFHSA-N 0 0 309.453 5.009 20 0 DKADRN CCCN(C(=O)CCc1cccs1)[C@H](CC)c1ccccc1 ZINC000499126140 340030461 /nfs/dbraw/zinc/03/04/61/340030461.db2.gz DMMYODNMEJXZDZ-GOSISDBHSA-N 0 0 315.482 5.071 20 0 DKADRN CCCN(C(=O)CCc1cccs1)[C@@H](CC)c1ccccc1 ZINC000499126141 340030456 /nfs/dbraw/zinc/03/04/56/340030456.db2.gz DMMYODNMEJXZDZ-SFHVURJKSA-N 0 0 315.482 5.071 20 0 DKADRN CCCN(C(=O)c1sccc1C)[C@@H](CC)c1ccccc1 ZINC000499126954 340030515 /nfs/dbraw/zinc/03/05/15/340030515.db2.gz JBSSUMBBLAXYTL-INIZCTEOSA-N 0 0 301.455 5.060 20 0 DKADRN CCCN(C(=O)c1sccc1C)[C@H](CC)c1ccccc1 ZINC000499126955 340030457 /nfs/dbraw/zinc/03/04/57/340030457.db2.gz JBSSUMBBLAXYTL-MRXNPFEDSA-N 0 0 301.455 5.060 20 0 DKADRN CCCN(C(=O)c1ccc(C)s1)[C@@H](CC)c1ccccc1 ZINC000499127566 340030513 /nfs/dbraw/zinc/03/05/13/340030513.db2.gz MFJXEGXPKYNFPA-INIZCTEOSA-N 0 0 301.455 5.060 20 0 DKADRN CCCN(C(=O)c1ccc(C)s1)[C@H](CC)c1ccccc1 ZINC000499127567 340030487 /nfs/dbraw/zinc/03/04/87/340030487.db2.gz MFJXEGXPKYNFPA-MRXNPFEDSA-N 0 0 301.455 5.060 20 0 DKADRN O=C(Nc1cc(Cl)ccc1Cl)[C@@H](c1ccccc1)C1CC1 ZINC000499132520 340030521 /nfs/dbraw/zinc/03/05/21/340030521.db2.gz VVRLNPMHDMEBAE-INIZCTEOSA-N 0 0 320.219 5.126 20 0 DKADRN O=C(Nc1cc(Cl)ccc1Cl)[C@H](c1ccccc1)C1CC1 ZINC000499132527 340030553 /nfs/dbraw/zinc/03/05/53/340030553.db2.gz VVRLNPMHDMEBAE-MRXNPFEDSA-N 0 0 320.219 5.126 20 0 DKADRN CCCCCC(=O)N(CC)[C@H](C)c1cccc(C(F)(F)F)c1 ZINC000499135079 340030775 /nfs/dbraw/zinc/03/07/75/340030775.db2.gz QKJMGQBBJUGPPC-CYBMUJFWSA-N 0 0 315.379 5.195 20 0 DKADRN CCCCCC(=O)N(CC)[C@@H](C)c1cccc(C(F)(F)F)c1 ZINC000499135080 340030729 /nfs/dbraw/zinc/03/07/29/340030729.db2.gz QKJMGQBBJUGPPC-ZDUSSCGKSA-N 0 0 315.379 5.195 20 0 DKADRN O=C(Nc1ccc(Cl)cc1Cl)[C@@H](c1ccccc1)C1CC1 ZINC000499136192 337278885 /nfs/dbraw/zinc/27/88/85/337278885.db2.gz VMNOLENPRGGJEH-INIZCTEOSA-N 0 0 320.219 5.126 20 0 DKADRN O=C(Nc1ccc(Cl)cc1Cl)[C@H](c1ccccc1)C1CC1 ZINC000499136193 337278964 /nfs/dbraw/zinc/27/89/64/337278964.db2.gz VMNOLENPRGGJEH-MRXNPFEDSA-N 0 0 320.219 5.126 20 0 DKADRN CCc1cccnc1C(=O)Nc1c(C(C)C)cccc1C(C)C ZINC000499137329 340030782 /nfs/dbraw/zinc/03/07/82/340030782.db2.gz RTKXPSRPAFHKMW-UHFFFAOYSA-N 0 0 310.441 5.143 20 0 DKADRN Cc1ccccc1NC(=O)CCCCCO[C@H]1CCC[C@@H](C)C1 ZINC000499141664 340030864 /nfs/dbraw/zinc/03/08/64/340030864.db2.gz LMBINFZWEBSNMK-AEFFLSMTSA-N 0 0 317.473 5.089 20 0 DKADRN Cc1ccccc1NC(=O)CCCCCO[C@@H]1CCC[C@H](C)C1 ZINC000499141665 340030886 /nfs/dbraw/zinc/03/08/86/340030886.db2.gz LMBINFZWEBSNMK-FUHWJXTLSA-N 0 0 317.473 5.089 20 0 DKADRN Cc1ccccc1NC(=O)CCCCCO[C@@H]1CCC[C@@H](C)C1 ZINC000499141666 340030916 /nfs/dbraw/zinc/03/09/16/340030916.db2.gz LMBINFZWEBSNMK-SJLPKXTDSA-N 0 0 317.473 5.089 20 0 DKADRN Cc1ccccc1NC(=O)CCCCCO[C@H]1CCC[C@H](C)C1 ZINC000499141667 340031054 /nfs/dbraw/zinc/03/10/54/340031054.db2.gz LMBINFZWEBSNMK-WMZOPIPTSA-N 0 0 317.473 5.089 20 0 DKADRN Cc1ccc(F)c(C(=O)Nc2ccccc2-c2ccccc2)c1F ZINC000499151161 340031311 /nfs/dbraw/zinc/03/13/11/340031311.db2.gz QHHMHNMRFPMNMO-UHFFFAOYSA-N 0 0 323.342 5.193 20 0 DKADRN CCCN(CC(C)C)C(=O)c1ccc(-c2ccccc2Cl)o1 ZINC000499177432 340031749 /nfs/dbraw/zinc/03/17/49/340031749.db2.gz RKEBWBGWGKLCFS-UHFFFAOYSA-N 0 0 319.832 5.108 20 0 DKADRN CCCCCC(=O)N(Cc1cccc(C(F)(F)F)c1)C(C)C ZINC000499183603 340031808 /nfs/dbraw/zinc/03/18/08/340031808.db2.gz NDOUARBGYZTRQU-UHFFFAOYSA-N 0 0 315.379 5.023 20 0 DKADRN C[C@H]1CCC[C@H](OCc2cccc(NC(=O)c3ccccc3)c2)C1 ZINC000499184106 340031867 /nfs/dbraw/zinc/03/18/67/340031867.db2.gz QGHMTRIOIPCNAF-JXFKEZNVSA-N 0 0 323.436 5.034 20 0 DKADRN C[C@H]1CCC[C@@H](OCc2cccc(NC(=O)c3ccccc3)c2)C1 ZINC000499184107 340031814 /nfs/dbraw/zinc/03/18/14/340031814.db2.gz QGHMTRIOIPCNAF-OXJNMPFZSA-N 0 0 323.436 5.034 20 0 DKADRN C[C@@H]1CCC[C@@H](OCc2cccc(NC(=O)c3ccccc3)c2)C1 ZINC000499184108 340031818 /nfs/dbraw/zinc/03/18/18/340031818.db2.gz QGHMTRIOIPCNAF-OXQOHEQNSA-N 0 0 323.436 5.034 20 0 DKADRN CCCCC(=O)Nc1ccc(Oc2ccnc3ccccc32)cc1 ZINC000499256254 340033471 /nfs/dbraw/zinc/03/34/71/340033471.db2.gz PAPBAHCUVIQCGP-UHFFFAOYSA-N 0 0 320.392 5.156 20 0 DKADRN CC(C)c1cccc(C(C)C)c1NC(=O)N1CC[C@@H](C)[C@@H](C)C1 ZINC000499257975 340033556 /nfs/dbraw/zinc/03/35/56/340033556.db2.gz XCWQVECNQNUNER-CVEARBPZSA-N 0 0 316.489 5.443 20 0 DKADRN CC(C)c1cccc(C(C)C)c1NC(=O)N1CC[C@H](C)[C@@H](C)C1 ZINC000499257976 340033538 /nfs/dbraw/zinc/03/35/38/340033538.db2.gz XCWQVECNQNUNER-HOTGVXAUSA-N 0 0 316.489 5.443 20 0 DKADRN CC(C)c1cccc(C(C)C)c1NC(=O)N1CC[C@@H](C)[C@H](C)C1 ZINC000499257977 340033557 /nfs/dbraw/zinc/03/35/57/340033557.db2.gz XCWQVECNQNUNER-HZPDHXFCSA-N 0 0 316.489 5.443 20 0 DKADRN CC(C)c1cccc(C(C)C)c1NC(=O)N1CC[C@H](C)[C@H](C)C1 ZINC000499257978 340033479 /nfs/dbraw/zinc/03/34/79/340033479.db2.gz XCWQVECNQNUNER-JKSUJKDBSA-N 0 0 316.489 5.443 20 0 DKADRN CC(C)N(Cc1ccccc1F)C(=O)c1ccc2ccccc2c1 ZINC000499273793 340033904 /nfs/dbraw/zinc/03/39/04/340033904.db2.gz PAHNMRKFIQMJFS-UHFFFAOYSA-N 0 0 321.395 5.030 20 0 DKADRN CCC[C@@H](CC1CCCCC1)C(=O)N1CCc2sccc2C1 ZINC000499292536 333241503 /nfs/dbraw/zinc/24/15/03/333241503.db2.gz AAXKFZZIBVCUKH-INIZCTEOSA-N 0 0 319.514 5.020 20 0 DKADRN CCC[C@H](CC1CCCCC1)C(=O)N1CCc2sccc2C1 ZINC000499292541 333241495 /nfs/dbraw/zinc/24/14/95/333241495.db2.gz AAXKFZZIBVCUKH-MRXNPFEDSA-N 0 0 319.514 5.020 20 0 DKADRN Cc1ncc(CSc2ncc(-c3ccc(Cl)cc3)o2)s1 ZINC000499310987 340034416 /nfs/dbraw/zinc/03/44/16/340034416.db2.gz YQAULDXTAQZTRC-UHFFFAOYSA-N 0 0 322.842 5.052 20 0 DKADRN Cc1cccc(SCc2ccc(OCc3cccnc3)cc2)c1 ZINC000499316331 340034582 /nfs/dbraw/zinc/03/45/82/340034582.db2.gz NMZKAANIPXTPKY-UHFFFAOYSA-N 0 0 321.445 5.261 20 0 DKADRN C[C@@H](Sc1nnc(C(C)(C)C)o1)c1ccc(C(C)(C)C)cc1 ZINC000499321990 340034785 /nfs/dbraw/zinc/03/47/85/340034785.db2.gz SJAMVSVEJZQLKK-GFCCVEGCSA-N 0 0 318.486 5.518 20 0 DKADRN C[C@H](Sc1nnc(C(C)(C)C)o1)c1ccc(C(C)(C)C)cc1 ZINC000499321993 340034769 /nfs/dbraw/zinc/03/47/69/340034769.db2.gz SJAMVSVEJZQLKK-LBPRGKRZSA-N 0 0 318.486 5.518 20 0 DKADRN CCCN(C(=O)c1coc2ccccc12)c1ccc(Cl)cc1 ZINC000499322934 340034734 /nfs/dbraw/zinc/03/47/34/340034734.db2.gz DHTRRRAXFSAIEB-UHFFFAOYSA-N 0 0 313.784 5.143 20 0 DKADRN CCC[C@@H](C)CC(=O)Nc1cc(C(F)(F)F)ccc1Cl ZINC000499330809 340034997 /nfs/dbraw/zinc/03/49/97/340034997.db2.gz ZNFDOMZYUZKUKC-SECBINFHSA-N 0 0 307.743 5.124 20 0 DKADRN CCC[C@H](C)CC(=O)Nc1cc(C(F)(F)F)ccc1Cl ZINC000499330810 340034989 /nfs/dbraw/zinc/03/49/89/340034989.db2.gz ZNFDOMZYUZKUKC-VIFPVBQESA-N 0 0 307.743 5.124 20 0 DKADRN Cc1ccccc1SCc1ccc(OCc2cccnc2)cc1 ZINC000499334239 340034905 /nfs/dbraw/zinc/03/49/05/340034905.db2.gz KEUYWPZFOPCSDR-UHFFFAOYSA-N 0 0 321.445 5.261 20 0 DKADRN CCC1CCC(N(C)C(=O)c2cc(Cl)sc2Cl)CC1 ZINC000499335832 340034941 /nfs/dbraw/zinc/03/49/41/340034941.db2.gz ZLERZSLDLNYYNR-UHFFFAOYSA-N 0 0 320.285 5.096 20 0 DKADRN CCCCCC(=O)N(C)[C@H](C)c1ccc(Cl)c(Cl)c1 ZINC000499346204 333253208 /nfs/dbraw/zinc/25/32/08/333253208.db2.gz PKXVHGJZRZQNKY-LLVKDONJSA-N 0 0 302.245 5.093 20 0 DKADRN CCCCCC(=O)N(C)[C@@H](C)c1ccc(Cl)c(Cl)c1 ZINC000499346207 333253265 /nfs/dbraw/zinc/25/32/65/333253265.db2.gz PKXVHGJZRZQNKY-NSHDSACASA-N 0 0 302.245 5.093 20 0 DKADRN Cc1ccc(C(=O)N(C)[C@H](C)c2ccc(Cl)c(Cl)c2)cc1 ZINC000499360035 340035431 /nfs/dbraw/zinc/03/54/31/340035431.db2.gz GQTIWUUPJAOVIO-GFCCVEGCSA-N 0 0 322.235 5.135 20 0 DKADRN Cc1ccc(C(=O)N(C)[C@@H](C)c2ccc(Cl)c(Cl)c2)cc1 ZINC000499360037 340035477 /nfs/dbraw/zinc/03/54/77/340035477.db2.gz GQTIWUUPJAOVIO-LBPRGKRZSA-N 0 0 322.235 5.135 20 0 DKADRN C[C@H](c1ccc(Cl)c(Cl)c1)N(C)C(=O)C1CCCCC1 ZINC000499361576 340035409 /nfs/dbraw/zinc/03/54/09/340035409.db2.gz JNWKVNPLOGMODM-LLVKDONJSA-N 0 0 314.256 5.093 20 0 DKADRN C[C@@H](c1ccc(Cl)c(Cl)c1)N(C)C(=O)C1CCCCC1 ZINC000499361577 340035466 /nfs/dbraw/zinc/03/54/66/340035466.db2.gz JNWKVNPLOGMODM-NSHDSACASA-N 0 0 314.256 5.093 20 0 DKADRN Cc1ccccc1C(=O)N(C)[C@H](C)c1ccc(Cl)c(Cl)c1 ZINC000499363534 340035444 /nfs/dbraw/zinc/03/54/44/340035444.db2.gz OCKQYEQPWSLMEG-GFCCVEGCSA-N 0 0 322.235 5.135 20 0 DKADRN Cc1ccccc1C(=O)N(C)[C@@H](C)c1ccc(Cl)c(Cl)c1 ZINC000499363535 340035433 /nfs/dbraw/zinc/03/54/33/340035433.db2.gz OCKQYEQPWSLMEG-LBPRGKRZSA-N 0 0 322.235 5.135 20 0 DKADRN C[C@H](c1ccc(Cl)c(Cl)c1)N(C)C(=O)CC1CCCC1 ZINC000499365638 340035574 /nfs/dbraw/zinc/03/55/74/340035574.db2.gz URCPECLPQASJRS-LLVKDONJSA-N 0 0 314.256 5.093 20 0 DKADRN C[C@@H](c1ccc(Cl)c(Cl)c1)N(C)C(=O)CC1CCCC1 ZINC000499365639 340035505 /nfs/dbraw/zinc/03/55/05/340035505.db2.gz URCPECLPQASJRS-NSHDSACASA-N 0 0 314.256 5.093 20 0 DKADRN CC(C)[C@@H](c1ccccc1Cl)N(C)C(=O)C1CCCCC1 ZINC000499368351 340035307 /nfs/dbraw/zinc/03/53/07/340035307.db2.gz FHJBWYLZGYPRJI-KRWDZBQOSA-N 0 0 307.865 5.076 20 0 DKADRN CC(C)[C@H](c1ccccc1Cl)N(C)C(=O)C1CCCCC1 ZINC000499368352 340035314 /nfs/dbraw/zinc/03/53/14/340035314.db2.gz 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ZINC000499733175 340043709 /nfs/dbraw/zinc/04/37/09/340043709.db2.gz RKYGBEOTSXQPHR-HNNXBMFYSA-N 0 0 313.466 5.446 20 0 DKADRN CC[C@@H](C)Sc1ccc(NC(=O)c2ccccc2C)c(C)c1 ZINC000499733176 340043718 /nfs/dbraw/zinc/04/37/18/340043718.db2.gz RKYGBEOTSXQPHR-OAHLLOKOSA-N 0 0 313.466 5.446 20 0 DKADRN CC[C@H](C)Sc1ccc(NC(=O)c2ccc(C)cc2)c(C)c1 ZINC000499734589 340043735 /nfs/dbraw/zinc/04/37/35/340043735.db2.gz YTGIWCPISGRSHM-HNNXBMFYSA-N 0 0 313.466 5.446 20 0 DKADRN CC[C@@H](C)Sc1ccc(NC(=O)c2ccc(C)cc2)c(C)c1 ZINC000499734590 340043686 /nfs/dbraw/zinc/04/36/86/340043686.db2.gz YTGIWCPISGRSHM-OAHLLOKOSA-N 0 0 313.466 5.446 20 0 DKADRN Cc1cc(SC2CCCCC2)ccc1NC(=O)C1CCC1 ZINC000499735221 340043695 /nfs/dbraw/zinc/04/36/95/340043695.db2.gz WFUCXCIYDRPLBV-UHFFFAOYSA-N 0 0 303.471 5.158 20 0 DKADRN C[C@H](c1nc2ccccc2s1)N(C)C/C=C/c1ccccc1 ZINC000499735786 340043760 /nfs/dbraw/zinc/04/37/60/340043760.db2.gz YIYUYZAVBTYNOR-KUCQQTCKSA-N 0 0 308.450 5.003 20 0 DKADRN C[C@H](c1nc2ccccc2s1)N(C)C/C=C\c1ccccc1 ZINC000499735787 333303683 /nfs/dbraw/zinc/30/36/83/333303683.db2.gz YIYUYZAVBTYNOR-MEODZPNASA-N 0 0 308.450 5.003 20 0 DKADRN C[C@@H](c1nc2ccccc2s1)N(C)C/C=C\c1ccccc1 ZINC000499735788 333303559 /nfs/dbraw/zinc/30/35/59/333303559.db2.gz YIYUYZAVBTYNOR-QIENPNARSA-N 0 0 308.450 5.003 20 0 DKADRN C[C@@H](c1nc2ccccc2s1)N(C)C/C=C/c1ccccc1 ZINC000499735789 333303668 /nfs/dbraw/zinc/30/36/68/333303668.db2.gz YIYUYZAVBTYNOR-SHQCLWGWSA-N 0 0 308.450 5.003 20 0 DKADRN CC[C@H](C)Sc1ccc(NC(=O)CCc2ccco2)c(C)c1 ZINC000499740594 340043878 /nfs/dbraw/zinc/04/38/78/340043878.db2.gz DSFKPRSTNIEVEQ-AWEZNQCLSA-N 0 0 317.454 5.050 20 0 DKADRN CC[C@@H](C)Sc1ccc(NC(=O)CCc2ccco2)c(C)c1 ZINC000499740595 340043754 /nfs/dbraw/zinc/04/37/54/340043754.db2.gz DSFKPRSTNIEVEQ-CQSZACIVSA-N 0 0 317.454 5.050 20 0 DKADRN CC[C@@H](C)Sc1ccc(NC(=O)c2ccc(C)o2)c(C)c1 ZINC000499741462 340043804 /nfs/dbraw/zinc/04/38/04/340043804.db2.gz HKXLVWVZEWUIBG-CYBMUJFWSA-N 0 0 303.427 5.039 20 0 DKADRN CC[C@H](C)Sc1ccc(NC(=O)c2ccc(C)o2)c(C)c1 ZINC000499741464 340043819 /nfs/dbraw/zinc/04/38/19/340043819.db2.gz HKXLVWVZEWUIBG-ZDUSSCGKSA-N 0 0 303.427 5.039 20 0 DKADRN CC[C@@H](C)Sc1ccc(NC(=O)c2ccc(F)cc2)c(C)c1 ZINC000499741513 340043867 /nfs/dbraw/zinc/04/38/67/340043867.db2.gz HTMYBBOZMILRCT-CYBMUJFWSA-N 0 0 317.429 5.277 20 0 DKADRN CC[C@H](C)Sc1ccc(NC(=O)c2ccc(F)cc2)c(C)c1 ZINC000499741514 340043842 /nfs/dbraw/zinc/04/38/42/340043842.db2.gz HTMYBBOZMILRCT-ZDUSSCGKSA-N 0 0 317.429 5.277 20 0 DKADRN CC[C@@H](C)Sc1ccc(NC(=O)c2ccc(Cl)o2)c(C)c1 ZINC000499741784 340043844 /nfs/dbraw/zinc/04/38/44/340043844.db2.gz ITUOVQKCYIRSBX-LLVKDONJSA-N 0 0 323.845 5.384 20 0 DKADRN CC[C@H](C)Sc1ccc(NC(=O)c2ccc(Cl)o2)c(C)c1 ZINC000499741789 340043868 /nfs/dbraw/zinc/04/38/68/340043868.db2.gz ITUOVQKCYIRSBX-NSHDSACASA-N 0 0 323.845 5.384 20 0 DKADRN CC[C@@H](C)Sc1ccc(NC(=O)c2ccc(C)s2)c(C)c1 ZINC000499744376 340043916 /nfs/dbraw/zinc/04/39/16/340043916.db2.gz RGBQPJTXVUNCDT-GFCCVEGCSA-N 0 0 319.495 5.508 20 0 DKADRN CC[C@H](C)Sc1ccc(NC(=O)c2ccc(C)s2)c(C)c1 ZINC000499744377 340043887 /nfs/dbraw/zinc/04/38/87/340043887.db2.gz RGBQPJTXVUNCDT-LBPRGKRZSA-N 0 0 319.495 5.508 20 0 DKADRN CC[C@@H](C)Sc1ccc(NC(=O)c2cc(C)oc2C)c(C)c1 ZINC000499744786 333304880 /nfs/dbraw/zinc/30/48/80/333304880.db2.gz SUUQVQMYNQVUSB-CYBMUJFWSA-N 0 0 317.454 5.348 20 0 DKADRN CC[C@H](C)Sc1ccc(NC(=O)c2cc(C)oc2C)c(C)c1 ZINC000499744787 333304812 /nfs/dbraw/zinc/30/48/12/333304812.db2.gz SUUQVQMYNQVUSB-ZDUSSCGKSA-N 0 0 317.454 5.348 20 0 DKADRN CS[C@H](C)C(=O)Nc1ccc(SC2CCCCC2)cc1C ZINC000499746032 340043913 /nfs/dbraw/zinc/04/39/13/340043913.db2.gz XAWWSMLVDBXYLB-CYBMUJFWSA-N 0 0 323.527 5.110 20 0 DKADRN CS[C@@H](C)C(=O)Nc1ccc(SC2CCCCC2)cc1C ZINC000499746034 340043941 /nfs/dbraw/zinc/04/39/41/340043941.db2.gz XAWWSMLVDBXYLB-ZDUSSCGKSA-N 0 0 323.527 5.110 20 0 DKADRN CC[C@H](C)Sc1ccc(NC(=O)c2cccc(C)c2)c(C)c1 ZINC000499746560 340043922 /nfs/dbraw/zinc/04/39/22/340043922.db2.gz YKBAHUNYVYRYDL-HNNXBMFYSA-N 0 0 313.466 5.446 20 0 DKADRN CC[C@@H](C)Sc1ccc(NC(=O)c2cccc(C)c2)c(C)c1 ZINC000499746561 340043963 /nfs/dbraw/zinc/04/39/63/340043963.db2.gz YKBAHUNYVYRYDL-OAHLLOKOSA-N 0 0 313.466 5.446 20 0 DKADRN CC[C@@H](C)Sc1ccc(NC(=O)c2sccc2C)c(C)c1 ZINC000499746646 340043881 /nfs/dbraw/zinc/04/38/81/340043881.db2.gz ZBWBNEGAVXMPSW-CYBMUJFWSA-N 0 0 319.495 5.508 20 0 DKADRN CC[C@H](C)Sc1ccc(NC(=O)c2sccc2C)c(C)c1 ZINC000499746648 340043905 /nfs/dbraw/zinc/04/39/05/340043905.db2.gz ZBWBNEGAVXMPSW-ZDUSSCGKSA-N 0 0 319.495 5.508 20 0 DKADRN CC[C@@H](C)Sc1ccc(NC(=O)C[C@H]2C=CCC2)c(C)c1 ZINC000499753201 340044008 /nfs/dbraw/zinc/04/40/08/340044008.db2.gz QUTWWGSFFDKULV-CABCVRRESA-N 0 0 303.471 5.180 20 0 DKADRN CC[C@H](C)Sc1ccc(NC(=O)C[C@H]2C=CCC2)c(C)c1 ZINC000499753202 340044062 /nfs/dbraw/zinc/04/40/62/340044062.db2.gz QUTWWGSFFDKULV-GJZGRUSLSA-N 0 0 303.471 5.180 20 0 DKADRN CC[C@@H](C)Sc1ccc(NC(=O)C[C@@H]2C=CCC2)c(C)c1 ZINC000499753203 340043990 /nfs/dbraw/zinc/04/39/90/340043990.db2.gz QUTWWGSFFDKULV-HUUCEWRRSA-N 0 0 303.471 5.180 20 0 DKADRN CC[C@H](C)Sc1ccc(NC(=O)C[C@@H]2C=CCC2)c(C)c1 ZINC000499753204 340043976 /nfs/dbraw/zinc/04/39/76/340043976.db2.gz QUTWWGSFFDKULV-LSDHHAIUSA-N 0 0 303.471 5.180 20 0 DKADRN Cc1cc(SC2CCCCC2)ccc1NC(=O)c1ccco1 ZINC000499756796 340044089 /nfs/dbraw/zinc/04/40/89/340044089.db2.gz GWCXWMWREFGPIA-UHFFFAOYSA-N 0 0 315.438 5.265 20 0 DKADRN CC[C@@H](C)Sc1ccc(NC(=O)c2occc2C)c(C)c1 ZINC000499756850 340044181 /nfs/dbraw/zinc/04/41/81/340044181.db2.gz HKJOLRTVRJLNOB-CYBMUJFWSA-N 0 0 303.427 5.039 20 0 DKADRN CC[C@H](C)Sc1ccc(NC(=O)c2occc2C)c(C)c1 ZINC000499756851 340044093 /nfs/dbraw/zinc/04/40/93/340044093.db2.gz HKJOLRTVRJLNOB-ZDUSSCGKSA-N 0 0 303.427 5.039 20 0 DKADRN CC[C@@H](C)Sc1ccc(NC(=O)c2cc(Cl)c[nH]2)c(C)c1 ZINC000499757295 340044176 /nfs/dbraw/zinc/04/41/76/340044176.db2.gz HVKNMJPKWNQDBV-LLVKDONJSA-N 0 0 322.861 5.119 20 0 DKADRN CC[C@H](C)Sc1ccc(NC(=O)c2cc(Cl)c[nH]2)c(C)c1 ZINC000499757298 340044086 /nfs/dbraw/zinc/04/40/86/340044086.db2.gz HVKNMJPKWNQDBV-NSHDSACASA-N 0 0 322.861 5.119 20 0 DKADRN Cc1cc(SC2CCCCC2)ccc1NC(=O)c1ccoc1 ZINC000499758837 340044163 /nfs/dbraw/zinc/04/41/63/340044163.db2.gz HCFUBAHRXLCOLH-UHFFFAOYSA-N 0 0 315.438 5.265 20 0 DKADRN CCC[C@@H](C)CC(=O)Nc1c(F)cc(F)cc1-c1ccccc1 ZINC000499761037 340044219 /nfs/dbraw/zinc/04/42/19/340044219.db2.gz CHICZFCRARJNBQ-CYBMUJFWSA-N 0 0 317.379 5.397 20 0 DKADRN CCC[C@H](C)CC(=O)Nc1c(F)cc(F)cc1-c1ccccc1 ZINC000499761038 340044213 /nfs/dbraw/zinc/04/42/13/340044213.db2.gz CHICZFCRARJNBQ-ZDUSSCGKSA-N 0 0 317.379 5.397 20 0 DKADRN CC[C@@H](C)Sc1ccc(NC(=O)c2ccccc2F)c(C)c1 ZINC000499803036 340044896 /nfs/dbraw/zinc/04/48/96/340044896.db2.gz RVGLLAMRECACEZ-CYBMUJFWSA-N 0 0 317.429 5.277 20 0 DKADRN CC[C@H](C)Sc1ccc(NC(=O)c2ccccc2F)c(C)c1 ZINC000499803037 340044902 /nfs/dbraw/zinc/04/49/02/340044902.db2.gz RVGLLAMRECACEZ-ZDUSSCGKSA-N 0 0 317.429 5.277 20 0 DKADRN CCCCO[C@@H](C)C(=O)Nc1ccc(S[C@H](C)CC)cc1C ZINC000499805762 340045008 /nfs/dbraw/zinc/04/50/08/340045008.db2.gz WYCIEMRZWNIOTQ-CABCVRRESA-N 0 0 323.502 5.029 20 0 DKADRN CCCCO[C@@H](C)C(=O)Nc1ccc(S[C@@H](C)CC)cc1C ZINC000499805764 340045097 /nfs/dbraw/zinc/04/50/97/340045097.db2.gz WYCIEMRZWNIOTQ-GJZGRUSLSA-N 0 0 323.502 5.029 20 0 DKADRN CCCCO[C@H](C)C(=O)Nc1ccc(S[C@H](C)CC)cc1C ZINC000499805765 340045037 /nfs/dbraw/zinc/04/50/37/340045037.db2.gz WYCIEMRZWNIOTQ-HUUCEWRRSA-N 0 0 323.502 5.029 20 0 DKADRN CCCCO[C@H](C)C(=O)Nc1ccc(S[C@@H](C)CC)cc1C ZINC000499805767 340045057 /nfs/dbraw/zinc/04/50/57/340045057.db2.gz WYCIEMRZWNIOTQ-LSDHHAIUSA-N 0 0 323.502 5.029 20 0 DKADRN CC(C)c1ccccc1NC(=O)[C@@H]1C[C@@H]1c1ccc([C@H]2C[C@H]2C)o1 ZINC000499830592 340045432 /nfs/dbraw/zinc/04/54/32/340045432.db2.gz OMXMDXQPYOTVKL-BSWAZPDLSA-N 0 0 323.436 5.269 20 0 DKADRN CC(C)c1ccccc1NC(=O)[C@@H]1C[C@@H]1c1ccc([C@@H]2C[C@H]2C)o1 ZINC000499831044 340045431 /nfs/dbraw/zinc/04/54/31/340045431.db2.gz OMXMDXQPYOTVKL-MXASKKJJSA-N 0 0 323.436 5.269 20 0 DKADRN CC(C)c1ccccc1NC(=O)[C@@H]1C[C@@H]1c1ccc([C@@H]2C[C@@H]2C)o1 ZINC000499831045 340045427 /nfs/dbraw/zinc/04/54/27/340045427.db2.gz OMXMDXQPYOTVKL-PQEBFOHHSA-N 0 0 323.436 5.269 20 0 DKADRN CC(C)c1ccccc1NC(=O)[C@@H]1C[C@@H]1c1ccc([C@H]2C[C@@H]2C)o1 ZINC000499831046 340045476 /nfs/dbraw/zinc/04/54/76/340045476.db2.gz OMXMDXQPYOTVKL-QSPRXWTASA-N 0 0 323.436 5.269 20 0 DKADRN CCCc1ccccc1NC(=O)[C@@H]1C[C@@H]1c1ccc([C@H]2C[C@H]2C)o1 ZINC000499851753 340045848 /nfs/dbraw/zinc/04/58/48/340045848.db2.gz VCDXPUONIRRDDR-BSWAZPDLSA-N 0 0 323.436 5.098 20 0 DKADRN CCCc1ccccc1NC(=O)[C@@H]1C[C@@H]1c1ccc([C@@H]2C[C@H]2C)o1 ZINC000499851757 340045819 /nfs/dbraw/zinc/04/58/19/340045819.db2.gz VCDXPUONIRRDDR-MXASKKJJSA-N 0 0 323.436 5.098 20 0 DKADRN CCCc1ccccc1NC(=O)[C@@H]1C[C@@H]1c1ccc([C@@H]2C[C@@H]2C)o1 ZINC000499851761 340045863 /nfs/dbraw/zinc/04/58/63/340045863.db2.gz VCDXPUONIRRDDR-PQEBFOHHSA-N 0 0 323.436 5.098 20 0 DKADRN CCCc1ccccc1NC(=O)[C@@H]1C[C@@H]1c1ccc([C@H]2C[C@@H]2C)o1 ZINC000499851763 340045830 /nfs/dbraw/zinc/04/58/30/340045830.db2.gz VCDXPUONIRRDDR-QSPRXWTASA-N 0 0 323.436 5.098 20 0 DKADRN CCCCN(C(=O)[C@@H]1CCCC(F)(F)C1)[C@@H](C)c1ccccc1 ZINC000499852830 340045822 /nfs/dbraw/zinc/04/58/22/340045822.db2.gz ZLPPNYCPBKPIFJ-DOTOQJQBSA-N 0 0 323.427 5.202 20 0 DKADRN CCCCN(C(=O)[C@@H]1CCCC(F)(F)C1)[C@H](C)c1ccccc1 ZINC000499852831 340045766 /nfs/dbraw/zinc/04/57/66/340045766.db2.gz ZLPPNYCPBKPIFJ-NVXWUHKLSA-N 0 0 323.427 5.202 20 0 DKADRN CCCCN(C(=O)[C@H]1CCCC(F)(F)C1)[C@@H](C)c1ccccc1 ZINC000499852833 340045824 /nfs/dbraw/zinc/04/58/24/340045824.db2.gz ZLPPNYCPBKPIFJ-RDJZCZTQSA-N 0 0 323.427 5.202 20 0 DKADRN CCCCN(C(=O)[C@H]1CCCC(F)(F)C1)[C@H](C)c1ccccc1 ZINC000499852835 333316645 /nfs/dbraw/zinc/31/66/45/333316645.db2.gz ZLPPNYCPBKPIFJ-WBVHZDCISA-N 0 0 323.427 5.202 20 0 DKADRN CCCn1ccc2cc(NC(=O)c3sccc3C3CC3)ccc21 ZINC000499920525 340047133 /nfs/dbraw/zinc/04/71/33/340047133.db2.gz IVEIIXYBYIDHTH-UHFFFAOYSA-N 0 0 324.449 5.243 20 0 DKADRN 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340081655 /nfs/dbraw/zinc/08/16/55/340081655.db2.gz ANWTVJCOEVQZTG-UHFFFAOYSA-N 0 0 317.747 5.022 20 0 DKADRN CCCCc1nc(CN[C@H](C)c2ccccc2SC)cs1 ZINC000501489680 340082102 /nfs/dbraw/zinc/08/21/02/340082102.db2.gz HGQYFARCXNKPFY-CYBMUJFWSA-N 0 0 320.527 5.058 20 0 DKADRN Fc1cccc(-c2nc(CSc3ccc(Cl)cc3)co2)c1 ZINC000501522011 340082592 /nfs/dbraw/zinc/08/25/92/340082592.db2.gz HOKNODJDYXBTEM-UHFFFAOYSA-N 0 0 319.788 5.426 20 0 DKADRN Fc1cccc(-c2nc(CSc3ccccc3Cl)co2)c1 ZINC000501533444 340082859 /nfs/dbraw/zinc/08/28/59/340082859.db2.gz JBQKOYLHPRSYLP-UHFFFAOYSA-N 0 0 319.788 5.426 20 0 DKADRN Clc1cccc(-c2nc(CSc3ccccc3)co2)c1 ZINC000501544065 340083159 /nfs/dbraw/zinc/08/31/59/340083159.db2.gz XRLWBMHFLMWVIZ-UHFFFAOYSA-N 0 0 301.798 5.287 20 0 DKADRN Cc1c2ccccc2oc1[C@@H](C)Nc1cccc(C(F)(F)F)n1 ZINC000501570449 340084097 /nfs/dbraw/zinc/08/40/97/340084097.db2.gz VJUZRLFOFAMKEJ-LLVKDONJSA-N 0 0 320.314 5.328 20 0 DKADRN Cc1c2ccccc2oc1[C@H](C)Nc1cccc(C(F)(F)F)n1 ZINC000501570451 340084077 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ZINC000501599609 340084679 /nfs/dbraw/zinc/08/46/79/340084679.db2.gz CVRZFZOVXKBPRP-HNNXBMFYSA-N 0 0 301.430 5.169 20 0 DKADRN CCCN(C(=O)c1ccccc1)[C@H](C)c1cc2ccccc2o1 ZINC000501600119 340084712 /nfs/dbraw/zinc/08/47/12/340084712.db2.gz GQTFVTXOJPWMSO-OAHLLOKOSA-N 0 0 307.393 5.046 20 0 DKADRN Cc1ccc(S[C@H](C)c2nc(-c3cccs3)no2)cc1C ZINC000501600194 340084684 /nfs/dbraw/zinc/08/46/84/340084684.db2.gz UKPCDVKPTVBLCZ-GFCCVEGCSA-N 0 0 316.451 5.268 20 0 DKADRN Cc1ccc(S[C@@H](C)c2nc(-c3cccs3)no2)cc1C ZINC000501600195 340084695 /nfs/dbraw/zinc/08/46/95/340084695.db2.gz UKPCDVKPTVBLCZ-LBPRGKRZSA-N 0 0 316.451 5.268 20 0 DKADRN CCCN(C(=O)c1ccsc1)[C@H](C)c1cc2ccccc2o1 ZINC000501603112 340084827 /nfs/dbraw/zinc/08/48/27/340084827.db2.gz OIRKXALAHVWDND-CYBMUJFWSA-N 0 0 313.422 5.108 20 0 DKADRN CCCN(C(=O)CC(C)(C)C)[C@@H](C)c1cc2ccccc2o1 ZINC000501605400 340084933 /nfs/dbraw/zinc/08/49/33/340084933.db2.gz ULIFZTBINWWOPJ-AWEZNQCLSA-N 0 0 301.430 5.169 20 0 DKADRN CC(C)c1ccsc1C(=O)Nc1cccc2ccsc21 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CCC[C@@H](C)C(=O)N(CCC)[C@H](C)c1cc2ccccc2o1 ZINC000501618282 340085192 /nfs/dbraw/zinc/08/51/92/340085192.db2.gz UAQGEMKMUVAHNM-HUUCEWRRSA-N 0 0 301.430 5.169 20 0 DKADRN CCC[C@H](C)C(=O)N(CCC)[C@H](C)c1cc2ccccc2o1 ZINC000501618284 340085108 /nfs/dbraw/zinc/08/51/08/340085108.db2.gz UAQGEMKMUVAHNM-LSDHHAIUSA-N 0 0 301.430 5.169 20 0 DKADRN CCCN(C(=O)c1cccs1)[C@@H](C)c1cc2ccccc2o1 ZINC000501618861 340085278 /nfs/dbraw/zinc/08/52/78/340085278.db2.gz VPQXFZDGJSALPP-ZDUSSCGKSA-N 0 0 313.422 5.108 20 0 DKADRN CCCN(C(=O)C[C@H]1C=CCC1)[C@H](C)c1cc2ccccc2o1 ZINC000501630689 340085464 /nfs/dbraw/zinc/08/54/64/340085464.db2.gz SVIOPCLGRVTJLZ-CVEARBPZSA-N 0 0 311.425 5.089 20 0 DKADRN CCCN(C(=O)C[C@H]1C=CCC1)[C@@H](C)c1cc2ccccc2o1 ZINC000501630690 340085469 /nfs/dbraw/zinc/08/54/69/340085469.db2.gz SVIOPCLGRVTJLZ-HOTGVXAUSA-N 0 0 311.425 5.089 20 0 DKADRN CCCN(C(=O)C[C@@H]1C=CCC1)[C@H](C)c1cc2ccccc2o1 ZINC000501630691 340085418 /nfs/dbraw/zinc/08/54/18/340085418.db2.gz 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20 0 DKADRN CC1(C)CCCC[C@H]1CC(=O)N1CCC[C@@H]1c1ccsc1 ZINC000501779025 340088420 /nfs/dbraw/zinc/08/84/20/340088420.db2.gz HYEMERTXRPJFCM-JKSUJKDBSA-N 0 0 305.487 5.018 20 0 DKADRN CCC[C@H](C)C(=O)N[C@@H](c1cccs1)c1ccc(Cl)cc1 ZINC000501793222 340088899 /nfs/dbraw/zinc/08/88/99/340088899.db2.gz UVGARFZZFNBJPY-BLLLJJGKSA-N 0 0 321.873 5.043 20 0 DKADRN CCC[C@H](C)C(=O)N[C@H](c1cccs1)c1ccc(Cl)cc1 ZINC000501793223 340088859 /nfs/dbraw/zinc/08/88/59/340088859.db2.gz UVGARFZZFNBJPY-LRDDRELGSA-N 0 0 321.873 5.043 20 0 DKADRN CCC[C@@H](C)C(=O)N[C@@H](c1cccs1)c1ccc(Cl)cc1 ZINC000501793224 340088771 /nfs/dbraw/zinc/08/87/71/340088771.db2.gz UVGARFZZFNBJPY-MLGOLLRUSA-N 0 0 321.873 5.043 20 0 DKADRN CCC[C@@H](C)C(=O)N[C@H](c1cccs1)c1ccc(Cl)cc1 ZINC000501793225 340088796 /nfs/dbraw/zinc/08/87/96/340088796.db2.gz UVGARFZZFNBJPY-WBMJQRKESA-N 0 0 321.873 5.043 20 0 DKADRN C[C@@H](Sc1ccc(C(F)(F)F)cn1)c1ccccc1F ZINC000501802731 340089228 /nfs/dbraw/zinc/08/92/28/340089228.db2.gz ICTSUKPKIGYILM-SECBINFHSA-N 0 0 301.308 5.093 20 0 DKADRN C[C@H](Sc1ccc(C(F)(F)F)cn1)c1ccccc1F ZINC000501802732 340089215 /nfs/dbraw/zinc/08/92/15/340089215.db2.gz ICTSUKPKIGYILM-VIFPVBQESA-N 0 0 301.308 5.093 20 0 DKADRN CCOc1ccc([C@@H]2CCCN2c2nc3ccccc3s2)cc1 ZINC000501865387 340089944 /nfs/dbraw/zinc/08/99/44/340089944.db2.gz BFQSRFMBIQSMRQ-KRWDZBQOSA-N 0 0 324.449 5.037 20 0 DKADRN CCOc1ccc([C@H]2CCCN2c2nc3ccccc3s2)cc1 ZINC000501865389 340089982 /nfs/dbraw/zinc/08/99/82/340089982.db2.gz BFQSRFMBIQSMRQ-QGZVFWFLSA-N 0 0 324.449 5.037 20 0 DKADRN C[C@H](Nc1ccc(C(F)(F)F)cn1)c1cc2ccccc2o1 ZINC000501869556 340090090 /nfs/dbraw/zinc/09/00/90/340090090.db2.gz YKMWTEJXYHZCSM-JTQLQIEISA-N 0 0 306.287 5.020 20 0 DKADRN C[C@@H](Nc1ccc(C(F)(F)F)cn1)c1cc2ccccc2o1 ZINC000501869567 340090040 /nfs/dbraw/zinc/09/00/40/340090040.db2.gz YKMWTEJXYHZCSM-SNVBAGLBSA-N 0 0 306.287 5.020 20 0 DKADRN CCc1cccc(CC(=O)Nc2cc(C(F)F)ccc2Cl)c1 ZINC000501967285 340091636 /nfs/dbraw/zinc/09/16/36/340091636.db2.gz PGBYRZYSEJKBHS-UHFFFAOYSA-N 0 0 323.770 5.021 20 0 DKADRN CC(C)c1cccc(N(C)C(=O)c2csc3ccccc23)c1 ZINC000501978433 340091887 /nfs/dbraw/zinc/09/18/87/340091887.db2.gz JUFUXVRKJLCQRQ-UHFFFAOYSA-N 0 0 309.434 5.301 20 0 DKADRN CC(C)c1cccc(N(C)C(=O)c2ccc3ccccc3c2)c1 ZINC000501990954 340092211 /nfs/dbraw/zinc/09/22/11/340092211.db2.gz PVJSMYXFTFHQNP-UHFFFAOYSA-N 0 0 303.405 5.240 20 0 DKADRN Cc1cccc2cc(C(=O)N(C)c3cccc(C(C)C)c3)oc21 ZINC000501995543 340092269 /nfs/dbraw/zinc/09/22/69/340092269.db2.gz DUSBHAIAPLXYDL-UHFFFAOYSA-N 0 0 307.393 5.141 20 0 DKADRN CC(C)c1cccc(N(C)C(=O)c2ccc(C(F)(F)F)cc2)c1 ZINC000501997177 340092482 /nfs/dbraw/zinc/09/24/82/340092482.db2.gz FXIKMLICGFYKNA-UHFFFAOYSA-N 0 0 321.342 5.105 20 0 DKADRN CC(C)c1cccc(N(C)C(=O)c2cc(F)c(F)cc2Cl)c1 ZINC000501997893 340092449 /nfs/dbraw/zinc/09/24/49/340092449.db2.gz HKMVYIPGMHIWSR-UHFFFAOYSA-N 0 0 323.770 5.018 20 0 DKADRN Cc1c2ccccc2oc1C(=O)N(C)c1cccc(C(C)C)c1 ZINC000501997979 340092448 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340095525 /nfs/dbraw/zinc/09/55/25/340095525.db2.gz XEZCTSPBIRRXLU-CXAGYDPISA-N 0 0 324.449 5.019 20 0 DKADRN CC[C@H](S[C@H](C)C(=O)c1c[nH]c2ncccc12)c1ccccc1 ZINC000502112700 340095590 /nfs/dbraw/zinc/09/55/90/340095590.db2.gz XEZCTSPBIRRXLU-DYVFJYSZSA-N 0 0 324.449 5.019 20 0 DKADRN CC[C@H](S[C@@H](C)C(=O)c1c[nH]c2ncccc12)c1ccccc1 ZINC000502112702 340095588 /nfs/dbraw/zinc/09/55/88/340095588.db2.gz XEZCTSPBIRRXLU-GUYCJALGSA-N 0 0 324.449 5.019 20 0 DKADRN CC[C@@H](S[C@@H](C)C(=O)c1c[nH]c2ncccc12)c1ccccc1 ZINC000502112703 340095528 /nfs/dbraw/zinc/09/55/28/340095528.db2.gz XEZCTSPBIRRXLU-SUMWQHHRSA-N 0 0 324.449 5.019 20 0 DKADRN Cc1ccc([C@H]2CCCN2C(=O)C[C@H](C)c2ccccc2)cc1C ZINC000502120479 340095623 /nfs/dbraw/zinc/09/56/23/340095623.db2.gz OFUQYZAZQIIJGN-GHTZIAJQSA-N 0 0 321.464 5.161 20 0 DKADRN Cc1ccc([C@@H]2CCCN2C(=O)C[C@@H](C)c2ccccc2)cc1C ZINC000502120485 340095633 /nfs/dbraw/zinc/09/56/33/340095633.db2.gz OFUQYZAZQIIJGN-NQIIRXRSSA-N 0 0 321.464 5.161 20 0 DKADRN Cc1ccc([C@@H]2CCCN2C(=O)C[C@H](C)c2ccccc2)cc1C ZINC000502120486 340095657 /nfs/dbraw/zinc/09/56/57/340095657.db2.gz OFUQYZAZQIIJGN-RXVVDRJESA-N 0 0 321.464 5.161 20 0 DKADRN Cc1ccc([C@H]2CCCN2C(=O)C[C@@H](C)c2ccccc2)cc1C ZINC000502120487 340095661 /nfs/dbraw/zinc/09/56/61/340095661.db2.gz OFUQYZAZQIIJGN-WIYYLYMNSA-N 0 0 321.464 5.161 20 0 DKADRN Clc1cccc(-c2nc(COc3ccccc3Cl)co2)c1 ZINC000502123270 340095653 /nfs/dbraw/zinc/09/56/53/340095653.db2.gz MTKXIDXXRPUDMZ-UHFFFAOYSA-N 0 0 320.175 5.227 20 0 DKADRN Cc1ccc([C@@H]2CCCN2C(=O)c2cc3ccccc3o2)cc1C ZINC000502133868 340095874 /nfs/dbraw/zinc/09/58/74/340095874.db2.gz QHNPNVUDFXIWMR-SFHVURJKSA-N 0 0 319.404 5.027 20 0 DKADRN CCCCc1nc(CSc2ccc(N)cc2Cl)cs1 ZINC000502133999 340095846 /nfs/dbraw/zinc/09/58/46/340095846.db2.gz UGAMMDHKSUZPKG-UHFFFAOYSA-N 0 0 312.891 5.014 20 0 DKADRN Cc1cc([C@@H](C)NC(=O)Nc2ccc(C)cc2Cl)c(C)s1 ZINC000502152845 340096053 /nfs/dbraw/zinc/09/60/53/340096053.db2.gz PPKHQPNYNDJBNN-LLVKDONJSA-N 0 0 322.861 5.209 20 0 DKADRN Cc1cc([C@H](C)NC(=O)Nc2ccc(C)cc2Cl)c(C)s1 ZINC000502152846 340096007 /nfs/dbraw/zinc/09/60/07/340096007.db2.gz PPKHQPNYNDJBNN-NSHDSACASA-N 0 0 322.861 5.209 20 0 DKADRN Cc1cc([C@@H](C)NC(=O)Nc2ccccc2C(C)C)c(C)s1 ZINC000502164495 340096131 /nfs/dbraw/zinc/09/61/31/340096131.db2.gz BGKWPDNXODLMSQ-CYBMUJFWSA-N 0 0 316.470 5.371 20 0 DKADRN Cc1cc([C@H](C)NC(=O)Nc2ccccc2C(C)C)c(C)s1 ZINC000502164496 333285905 /nfs/dbraw/zinc/28/59/05/333285905.db2.gz BGKWPDNXODLMSQ-ZDUSSCGKSA-N 0 0 316.470 5.371 20 0 DKADRN CCCCN(C(=O)N[C@@H](C)c1ccccc1)[C@@H](C)c1ccccc1 ZINC000502201195 340096841 /nfs/dbraw/zinc/09/68/41/340096841.db2.gz ZRXOKABQYVRLNF-ROUUACIJSA-N 0 0 324.468 5.321 20 0 DKADRN CCCCN(C(=O)N[C@@H](C)c1ccccc1)[C@H](C)c1ccccc1 ZINC000502201196 340096876 /nfs/dbraw/zinc/09/68/76/340096876.db2.gz ZRXOKABQYVRLNF-ZWKOTPCHSA-N 0 0 324.468 5.321 20 0 DKADRN CCCCN(C(=O)N[C@H](C)c1ccccc1)[C@@H](C)c1ccccc1 ZINC000502207940 340097024 /nfs/dbraw/zinc/09/70/24/340097024.db2.gz ZRXOKABQYVRLNF-MSOLQXFVSA-N 0 0 324.468 5.321 20 0 DKADRN CCCCN(C(=O)N[C@H](C)c1ccccc1)[C@H](C)c1ccccc1 ZINC000502207941 340097019 /nfs/dbraw/zinc/09/70/19/340097019.db2.gz ZRXOKABQYVRLNF-QZTJIDSGSA-N 0 0 324.468 5.321 20 0 DKADRN Cc1cc([C@@H](C)NC(=O)Nc2cc(Cl)ccc2C)c(C)s1 ZINC000502218826 340097223 /nfs/dbraw/zinc/09/72/23/340097223.db2.gz IYYRYFYHMPTTIO-LLVKDONJSA-N 0 0 322.861 5.209 20 0 DKADRN Cc1cc([C@H](C)NC(=O)Nc2cc(Cl)ccc2C)c(C)s1 ZINC000502218827 340097214 /nfs/dbraw/zinc/09/72/14/340097214.db2.gz IYYRYFYHMPTTIO-NSHDSACASA-N 0 0 322.861 5.209 20 0 DKADRN CC[C@@H](NC(=O)CCCCc1ccc(C)cc1)c1cccs1 ZINC000502219289 340097260 /nfs/dbraw/zinc/09/72/60/340097260.db2.gz NGZQSWPEZJECCX-QGZVFWFLSA-N 0 0 315.482 5.037 20 0 DKADRN Cc1ccccc1NC(=O)Cc1csc2ccc(Cl)cc12 ZINC000502219532 340097216 /nfs/dbraw/zinc/09/72/16/340097216.db2.gz DUTCCFCSWACOLU-UHFFFAOYSA-N 0 0 315.825 5.044 20 0 DKADRN CC(C)c1ccccc1NC(=O)C[C@@H](C)c1ccc(F)cc1F ZINC000502227609 333287018 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/nfs/dbraw/zinc/09/75/44/340097544.db2.gz GOSNTSNXYIDXAU-NSHDSACASA-N 0 0 322.861 5.209 20 0 DKADRN Cc1cc([C@@H](C)NC(=O)Nc2cccc(Cl)c2C)c(C)s1 ZINC000502241355 340097488 /nfs/dbraw/zinc/09/74/88/340097488.db2.gz IXVLLBQFGDOOBC-LLVKDONJSA-N 0 0 322.861 5.209 20 0 DKADRN Cc1cc([C@H](C)NC(=O)Nc2cccc(Cl)c2C)c(C)s1 ZINC000502241356 340097473 /nfs/dbraw/zinc/09/74/73/340097473.db2.gz IXVLLBQFGDOOBC-NSHDSACASA-N 0 0 322.861 5.209 20 0 DKADRN CC1(C)CCC(CC(=O)N2CCC[C@H]2c2cccs2)CC1 ZINC000502249017 340097694 /nfs/dbraw/zinc/09/76/94/340097694.db2.gz DMFTVKSSZZRVJM-HNNXBMFYSA-N 0 0 305.487 5.018 20 0 DKADRN CC1(C)CCC(CC(=O)N2CCC[C@@H]2c2cccs2)CC1 ZINC000502249018 340097486 /nfs/dbraw/zinc/09/74/86/340097486.db2.gz DMFTVKSSZZRVJM-OAHLLOKOSA-N 0 0 305.487 5.018 20 0 DKADRN CCCN(C(=O)N[C@H](C)c1ccccc1)[C@@H](CC)c1ccccc1 ZINC000502250232 340097691 /nfs/dbraw/zinc/09/76/91/340097691.db2.gz GZCAXDPLSMHGFR-XLIONFOSSA-N 0 0 324.468 5.321 20 0 DKADRN CCCN(C(=O)N[C@H](C)c1ccccc1)[C@H](CC)c1ccccc1 ZINC000502250233 340097755 /nfs/dbraw/zinc/09/77/55/340097755.db2.gz GZCAXDPLSMHGFR-YLJYHZDGSA-N 0 0 324.468 5.321 20 0 DKADRN FC(F)c1cccc(N[C@H]2CCC[C@H](c3cccnc3)C2)c1 ZINC000502250321 340097833 /nfs/dbraw/zinc/09/78/33/340097833.db2.gz HSZFJLCJFKGFIR-BBRMVZONSA-N 0 0 302.368 5.158 20 0 DKADRN FC(F)c1cccc(N[C@H]2CCC[C@@H](c3cccnc3)C2)c1 ZINC000502250622 340097839 /nfs/dbraw/zinc/09/78/39/340097839.db2.gz HSZFJLCJFKGFIR-CJNGLKHVSA-N 0 0 302.368 5.158 20 0 DKADRN FC(F)c1cccc(N[C@@H]2CCC[C@@H](c3cccnc3)C2)c1 ZINC000502250623 340097797 /nfs/dbraw/zinc/09/77/97/340097797.db2.gz HSZFJLCJFKGFIR-CZUORRHYSA-N 0 0 302.368 5.158 20 0 DKADRN FC(F)c1cccc(N[C@@H]2CCC[C@H](c3cccnc3)C2)c1 ZINC000502250624 340097759 /nfs/dbraw/zinc/09/77/59/340097759.db2.gz HSZFJLCJFKGFIR-XJKSGUPXSA-N 0 0 302.368 5.158 20 0 DKADRN CCCN(C(=O)N[C@@H](C)c1ccccc1)[C@H](CC)c1ccccc1 ZINC000502251422 340097818 /nfs/dbraw/zinc/09/78/18/340097818.db2.gz GZCAXDPLSMHGFR-FXAWDEMLSA-N 0 0 324.468 5.321 20 0 DKADRN CCCN(C(=O)N[C@@H](C)c1ccccc1)[C@@H](CC)c1ccccc1 ZINC000502251423 340097832 /nfs/dbraw/zinc/09/78/32/340097832.db2.gz GZCAXDPLSMHGFR-PXNSSMCTSA-N 0 0 324.468 5.321 20 0 DKADRN CC(C)OCc1cccc(N[C@@H]2CCC[C@H](c3cccnc3)C2)c1 ZINC000502251648 340097807 /nfs/dbraw/zinc/09/78/07/340097807.db2.gz RXGQUCKVOFAPNZ-GHTZIAJQSA-N 0 0 324.468 5.145 20 0 DKADRN CC(C)OCc1cccc(N[C@H]2CCC[C@@H](c3cccnc3)C2)c1 ZINC000502251649 340097825 /nfs/dbraw/zinc/09/78/25/340097825.db2.gz RXGQUCKVOFAPNZ-NQIIRXRSSA-N 0 0 324.468 5.145 20 0 DKADRN CC(C)OCc1cccc(N[C@H]2CCC[C@H](c3cccnc3)C2)c1 ZINC000502251650 340097793 /nfs/dbraw/zinc/09/77/93/340097793.db2.gz RXGQUCKVOFAPNZ-RXVVDRJESA-N 0 0 324.468 5.145 20 0 DKADRN CC(C)OCc1cccc(N[C@@H]2CCC[C@@H](c3cccnc3)C2)c1 ZINC000502251651 340097824 /nfs/dbraw/zinc/09/78/24/340097824.db2.gz RXGQUCKVOFAPNZ-WIYYLYMNSA-N 0 0 324.468 5.145 20 0 DKADRN CSCc1ccc(N[C@H]2CCC[C@@H](c3cccnc3)C2)cc1 ZINC000502251821 340097789 /nfs/dbraw/zinc/09/77/89/340097789.db2.gz 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/nfs/dbraw/zinc/09/79/77/340097977.db2.gz RPAYUMGIHBEEFW-HUUCEWRRSA-N 0 0 305.487 5.018 20 0 DKADRN CC1(C)CCCC[C@H]1CC(=O)N1CCC[C@@H]1c1cccs1 ZINC000502257355 340098034 /nfs/dbraw/zinc/09/80/34/340098034.db2.gz RPAYUMGIHBEEFW-LSDHHAIUSA-N 0 0 305.487 5.018 20 0 DKADRN c1csc(-c2cccc(N[C@@H]3CCCC34CCOCC4)c2)c1 ZINC000502269424 340098214 /nfs/dbraw/zinc/09/82/14/340098214.db2.gz OLKPJQOMDAOCEN-GOSISDBHSA-N 0 0 313.466 5.176 20 0 DKADRN c1csc(-c2cccc(N[C@H]3CCCC34CCOCC4)c2)c1 ZINC000502269426 333288060 /nfs/dbraw/zinc/28/80/60/333288060.db2.gz OLKPJQOMDAOCEN-SFHVURJKSA-N 0 0 313.466 5.176 20 0 DKADRN Cc1cccc(NC(=O)Nc2ccccc2OC2CCCC2)c1C ZINC000502276569 340098411 /nfs/dbraw/zinc/09/84/11/340098411.db2.gz LEKAJGMHXRUGRH-UHFFFAOYSA-N 0 0 324.424 5.269 20 0 DKADRN Cc1cccc(NC(=O)Nc2ccc(OC3CCCC3)cc2)c1C ZINC000502286591 340098833 /nfs/dbraw/zinc/09/88/33/340098833.db2.gz FVGXORGTQGWNSV-UHFFFAOYSA-N 0 0 324.424 5.269 20 0 DKADRN Cc1ccccc1NC(=O)Nc1ccc2c(c1)oc1ccccc12 ZINC000502289639 340098992 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340100082 /nfs/dbraw/zinc/10/00/82/340100082.db2.gz QUEOJMAJVLLUAH-UHFFFAOYSA-N 0 0 308.406 5.368 20 0 DKADRN Cc1ccccc1NC(=O)Nc1ccccc1N1CCCCCC1 ZINC000502339349 340100163 /nfs/dbraw/zinc/10/01/63/340100163.db2.gz OEVNIUSQLOWGQY-UHFFFAOYSA-N 0 0 323.440 5.019 20 0 DKADRN CCCCCC(=O)Nc1cccc(COC2CCCCC2)c1 ZINC000502339408 340100233 /nfs/dbraw/zinc/10/02/33/340100233.db2.gz CCZRPIIWBWPAOH-UHFFFAOYSA-N 0 0 303.446 5.055 20 0 DKADRN Cc1nc(-c2ccc(NC(=O)Nc3ccccc3C)cc2)cs1 ZINC000502339921 340100212 /nfs/dbraw/zinc/10/02/12/340100212.db2.gz PJJBRVKXPKIVOY-UHFFFAOYSA-N 0 0 323.421 5.071 20 0 DKADRN CSc1ccc(NC(=O)Nc2ccc(C(C)C)cc2)cc1 ZINC000502354641 340100567 /nfs/dbraw/zinc/10/05/67/340100567.db2.gz PWLHBWVITCGQTO-UHFFFAOYSA-N 0 0 300.427 5.176 20 0 DKADRN CCCc1ccccc1NC(=O)Nc1ccccc1OC(C)C ZINC000502358945 340100681 /nfs/dbraw/zinc/10/06/81/340100681.db2.gz KYBREJGBGSMLSZ-UHFFFAOYSA-N 0 0 312.413 5.070 20 0 DKADRN Cc1ccccc1NC(=O)Nc1ccc(C(C)C)cc1C(C)C ZINC000502360380 340100657 /nfs/dbraw/zinc/10/06/57/340100657.db2.gz LLGGGTYSVWLQNN-UHFFFAOYSA-N 0 0 310.441 5.886 20 0 DKADRN Cc1cc([C@@H](C)NCc2cc(Cl)sc2Cl)oc1C ZINC000502363664 340100634 /nfs/dbraw/zinc/10/06/34/340100634.db2.gz CXUCDLHUJAZOJL-MRVPVSSYSA-N 0 0 304.242 5.116 20 0 DKADRN Cc1cc([C@H](C)NCc2cc(Cl)sc2Cl)oc1C ZINC000502363666 340100582 /nfs/dbraw/zinc/10/05/82/340100582.db2.gz CXUCDLHUJAZOJL-QMMMGPOBSA-N 0 0 304.242 5.116 20 0 DKADRN COc1c(C)ccc(NC(=O)Nc2ccc(C(C)C)cc2)c1C ZINC000502370822 340101032 /nfs/dbraw/zinc/10/10/32/340101032.db2.gz CELSEKKOUZQHFO-UHFFFAOYSA-N 0 0 312.413 5.079 20 0 DKADRN Cc1ccc(Cl)cc1N[C@H](C)c1cnn(C2CCCC2)c1 ZINC000502386586 340101322 /nfs/dbraw/zinc/10/13/22/340101322.db2.gz GTWNNHJXSAJPFT-CYBMUJFWSA-N 0 0 303.837 5.133 20 0 DKADRN Cc1ccc(Cl)cc1N[C@@H](C)c1cnn(C2CCCC2)c1 ZINC000502386587 340101243 /nfs/dbraw/zinc/10/12/43/340101243.db2.gz GTWNNHJXSAJPFT-ZDUSSCGKSA-N 0 0 303.837 5.133 20 0 DKADRN Cc1cc([C@@H](C)NC(c2cccs2)c2cccs2)oc1C ZINC000502389031 340101380 /nfs/dbraw/zinc/10/13/80/340101380.db2.gz GNLAFHFSVKFBLE-GFCCVEGCSA-N 0 0 317.479 5.460 20 0 DKADRN Cc1cc([C@H](C)NC(c2cccs2)c2cccs2)oc1C ZINC000502389032 340101347 /nfs/dbraw/zinc/10/13/47/340101347.db2.gz GNLAFHFSVKFBLE-LBPRGKRZSA-N 0 0 317.479 5.460 20 0 DKADRN Cc1ccccc1NC(=O)Nc1ccc(NCC2CCCC2)cc1 ZINC000502390523 340101476 /nfs/dbraw/zinc/10/14/76/340101476.db2.gz HNAPEMPHBKJUSM-UHFFFAOYSA-N 0 0 323.440 5.241 20 0 DKADRN Cc1cc([C@H](C)N[C@@H]2CCCOc3c(Cl)cccc32)oc1C ZINC000502390749 340101385 /nfs/dbraw/zinc/10/13/85/340101385.db2.gz OOWIGRQGUDBTGH-BLLLJJGKSA-N 0 0 319.832 5.114 20 0 DKADRN Cc1cc([C@H](C)N[C@H]2CCCOc3c(Cl)cccc32)oc1C ZINC000502390750 340101411 /nfs/dbraw/zinc/10/14/11/340101411.db2.gz OOWIGRQGUDBTGH-LRDDRELGSA-N 0 0 319.832 5.114 20 0 DKADRN Cc1cc([C@@H](C)N[C@@H]2CCCOc3c(Cl)cccc32)oc1C ZINC000502390751 340101445 /nfs/dbraw/zinc/10/14/45/340101445.db2.gz OOWIGRQGUDBTGH-MLGOLLRUSA-N 0 0 319.832 5.114 20 0 DKADRN Cc1cc([C@@H](C)N[C@H]2CCCOc3c(Cl)cccc32)oc1C ZINC000502390752 340101472 /nfs/dbraw/zinc/10/14/72/340101472.db2.gz OOWIGRQGUDBTGH-WBMJQRKESA-N 0 0 319.832 5.114 20 0 DKADRN Cc1ccc2cccc(N[C@@H](C)c3cnn(C4CCCC4)c3)c2n1 ZINC000502392268 340101600 /nfs/dbraw/zinc/10/16/00/340101600.db2.gz QWNCEMHPKYULBN-HNNXBMFYSA-N 0 0 320.440 5.028 20 0 DKADRN Cc1ccc2cccc(N[C@H](C)c3cnn(C4CCCC4)c3)c2n1 ZINC000502392269 340101517 /nfs/dbraw/zinc/10/15/17/340101517.db2.gz QWNCEMHPKYULBN-OAHLLOKOSA-N 0 0 320.440 5.028 20 0 DKADRN Cc1ccc(N[C@@H](C)c2cnn(C3CCCC3)c2)c2cccnc12 ZINC000502392296 340101497 /nfs/dbraw/zinc/10/14/97/340101497.db2.gz NNAKEUBROZHAGO-HNNXBMFYSA-N 0 0 320.440 5.028 20 0 DKADRN Cc1ccc(N[C@H](C)c2cnn(C3CCCC3)c2)c2cccnc12 ZINC000502392298 340101503 /nfs/dbraw/zinc/10/15/03/340101503.db2.gz NNAKEUBROZHAGO-OAHLLOKOSA-N 0 0 320.440 5.028 20 0 DKADRN C[C@@H](Sc1ccc(C(F)(F)F)nn1)c1ccccc1Cl ZINC000502399553 340101762 /nfs/dbraw/zinc/10/17/62/340101762.db2.gz QGLCPTKHARUUGP-MRVPVSSYSA-N 0 0 318.751 5.002 20 0 DKADRN C[C@H](Sc1ccc(C(F)(F)F)nn1)c1ccccc1Cl ZINC000502399556 340101776 /nfs/dbraw/zinc/10/17/76/340101776.db2.gz QGLCPTKHARUUGP-QMMMGPOBSA-N 0 0 318.751 5.002 20 0 DKADRN C[C@@H](Nc1ccc(F)c(C2CC2)c1)c1cnn(C2CCCC2)c1 ZINC000502400232 340101837 /nfs/dbraw/zinc/10/18/37/340101837.db2.gz JCGMEFUVRJJODG-CYBMUJFWSA-N 0 0 313.420 5.188 20 0 DKADRN C[C@H](Nc1ccc(F)c(C2CC2)c1)c1cnn(C2CCCC2)c1 ZINC000502400233 340101729 /nfs/dbraw/zinc/10/17/29/340101729.db2.gz JCGMEFUVRJJODG-ZDUSSCGKSA-N 0 0 313.420 5.188 20 0 DKADRN C[C@H](N[C@@H](C)c1ccccc1Cl)c1cnn(C2CCCC2)c1 ZINC000502402676 340101957 /nfs/dbraw/zinc/10/19/57/340101957.db2.gz MODDMNNCGJVVQB-KBPBESRZSA-N 0 0 317.864 5.063 20 0 DKADRN C[C@@H](N[C@@H](C)c1ccccc1Cl)c1cnn(C2CCCC2)c1 ZINC000502402677 340101934 /nfs/dbraw/zinc/10/19/34/340101934.db2.gz MODDMNNCGJVVQB-KGLIPLIRSA-N 0 0 317.864 5.063 20 0 DKADRN CC[C@H]1c2ccsc2CCN1C(=O)C[C@@H](C)C1CCCCC1 ZINC000502403574 340101862 /nfs/dbraw/zinc/10/18/62/340101862.db2.gz UXBFSMFDKONORZ-PBHICJAKSA-N 0 0 319.514 5.190 20 0 DKADRN CC[C@@H]1c2ccsc2CCN1C(=O)C[C@@H](C)C1CCCCC1 ZINC000502403575 340101903 /nfs/dbraw/zinc/10/19/03/340101903.db2.gz UXBFSMFDKONORZ-RHSMWYFYSA-N 0 0 319.514 5.190 20 0 DKADRN CC[C@@H]1c2ccsc2CCN1C(=O)C[C@H](C)C1CCCCC1 ZINC000502403576 340101845 /nfs/dbraw/zinc/10/18/45/340101845.db2.gz UXBFSMFDKONORZ-WMLDXEAASA-N 0 0 319.514 5.190 20 0 DKADRN CC[C@H]1c2ccsc2CCN1C(=O)C[C@H](C)C1CCCCC1 ZINC000502403577 340101847 /nfs/dbraw/zinc/10/18/47/340101847.db2.gz UXBFSMFDKONORZ-YOEHRIQHSA-N 0 0 319.514 5.190 20 0 DKADRN CCSc1cccc(N[C@@H](C)c2cnn(C3CCCC3)c2)c1 ZINC000502404807 340102002 /nfs/dbraw/zinc/10/20/02/340102002.db2.gz KSYSYHHIEWVSCI-AWEZNQCLSA-N 0 0 315.486 5.283 20 0 DKADRN CCSc1cccc(N[C@H](C)c2cnn(C3CCCC3)c2)c1 ZINC000502404808 340102062 /nfs/dbraw/zinc/10/20/62/340102062.db2.gz KSYSYHHIEWVSCI-CQSZACIVSA-N 0 0 315.486 5.283 20 0 DKADRN CCCn1ccc2cc(NC(=O)Nc3ccccc3C)ccc21 ZINC000502404890 340101974 /nfs/dbraw/zinc/10/19/74/340101974.db2.gz NIYSEQJPYPHNEI-UHFFFAOYSA-N 0 0 307.397 5.004 20 0 DKADRN Cc1cc2cccnc2c(N[C@@H](C)c2cnn(C3CCCC3)c2)c1 ZINC000502405057 340102040 /nfs/dbraw/zinc/10/20/40/340102040.db2.gz SHGVFTDMDAKPEX-HNNXBMFYSA-N 0 0 320.440 5.028 20 0 DKADRN Cc1cc2cccnc2c(N[C@H](C)c2cnn(C3CCCC3)c2)c1 ZINC000502405058 340102023 /nfs/dbraw/zinc/10/20/23/340102023.db2.gz SHGVFTDMDAKPEX-OAHLLOKOSA-N 0 0 320.440 5.028 20 0 DKADRN CC(C)c1ccc(NC(=O)Nc2cccc(C(F)F)c2)cc1 ZINC000502410154 340102239 /nfs/dbraw/zinc/10/22/39/340102239.db2.gz LYJRFAPRSAPSFW-UHFFFAOYSA-N 0 0 304.340 5.392 20 0 DKADRN CC(C)Oc1ccccc1NC(=O)Nc1cccc(C(F)F)c1 ZINC000502410156 333292390 /nfs/dbraw/zinc/29/23/90/333292390.db2.gz MACRJZQWRSYVTF-UHFFFAOYSA-N 0 0 320.339 5.055 20 0 DKADRN FC(F)c1cccc(N[C@@H]2CCCC23CCOCC3)c1Cl ZINC000502412332 340102374 /nfs/dbraw/zinc/10/23/74/340102374.db2.gz CQMFNQIIUROMLZ-CYBMUJFWSA-N 0 0 315.791 5.039 20 0 DKADRN FC(F)c1cccc(N[C@H]2CCCC23CCOCC3)c1Cl ZINC000502412334 340102458 /nfs/dbraw/zinc/10/24/58/340102458.db2.gz CQMFNQIIUROMLZ-ZDUSSCGKSA-N 0 0 315.791 5.039 20 0 DKADRN CSc1cccc(N[C@@H](C)c2cnn(C3CCCC3)c2)c1C ZINC000502413571 340102510 /nfs/dbraw/zinc/10/25/10/340102510.db2.gz JRGONVYVVADSRO-AWEZNQCLSA-N 0 0 315.486 5.202 20 0 DKADRN CSc1cccc(N[C@H](C)c2cnn(C3CCCC3)c2)c1C ZINC000502413576 340102574 /nfs/dbraw/zinc/10/25/74/340102574.db2.gz JRGONVYVVADSRO-CQSZACIVSA-N 0 0 315.486 5.202 20 0 DKADRN Cc1ccc(N[C@H](C)c2cnn(C3CCCC3)c2)cc1Cl ZINC000502416706 340102653 /nfs/dbraw/zinc/10/26/53/340102653.db2.gz QZGYWPTYWRXECJ-CYBMUJFWSA-N 0 0 303.837 5.133 20 0 DKADRN Cc1ccc(N[C@@H](C)c2cnn(C3CCCC3)c2)cc1Cl ZINC000502416707 340102631 /nfs/dbraw/zinc/10/26/31/340102631.db2.gz QZGYWPTYWRXECJ-ZDUSSCGKSA-N 0 0 303.837 5.133 20 0 DKADRN Cc1csc(-c2ccc(NC(=O)Nc3ccc(C)cc3)cc2)n1 ZINC000502423488 333294078 /nfs/dbraw/zinc/29/40/78/333294078.db2.gz BRLZOAGUEKYNIB-UHFFFAOYSA-N 0 0 323.421 5.071 20 0 DKADRN CCCOc1ccccc1NC(=O)Nc1cccc(C(F)F)c1 ZINC000502425049 340102885 /nfs/dbraw/zinc/10/28/85/340102885.db2.gz LQUKSPFRZRVRPM-UHFFFAOYSA-N 0 0 320.339 5.057 20 0 DKADRN Cc1csc(-c2ccc(NC(=O)Nc3ccccc3C)cc2)n1 ZINC000502426451 340102925 /nfs/dbraw/zinc/10/29/25/340102925.db2.gz TYAMMNWXVMFFSB-UHFFFAOYSA-N 0 0 323.421 5.071 20 0 DKADRN Cc1cc([C@@H](C)N[C@@H](C)c2cc3cccc(F)c3o2)oc1C ZINC000502427043 340102939 /nfs/dbraw/zinc/10/29/39/340102939.db2.gz IDYFRFVGCKXDJQ-NEPJUHHUSA-N 0 0 301.361 5.194 20 0 DKADRN Cc1cc([C@H](C)N[C@H](C)c2cc3cccc(F)c3o2)oc1C ZINC000502427044 340103019 /nfs/dbraw/zinc/10/30/19/340103019.db2.gz IDYFRFVGCKXDJQ-NWDGAFQWSA-N 0 0 301.361 5.194 20 0 DKADRN Cc1cc([C@H](C)N[C@@H](C)c2cc3cccc(F)c3o2)oc1C ZINC000502427045 340102953 /nfs/dbraw/zinc/10/29/53/340102953.db2.gz IDYFRFVGCKXDJQ-RYUDHWBXSA-N 0 0 301.361 5.194 20 0 DKADRN Cc1cc([C@@H](C)N[C@H](C)c2cc3cccc(F)c3o2)oc1C ZINC000502427046 340103036 /nfs/dbraw/zinc/10/30/36/340103036.db2.gz IDYFRFVGCKXDJQ-VXGBXAGGSA-N 0 0 301.361 5.194 20 0 DKADRN CC(F)(F)c1cccc(N[C@H]2CCC[C@@H](c3cccnc3)C2)c1 ZINC000502428574 340103033 /nfs/dbraw/zinc/10/30/33/340103033.db2.gz DTJOVIVVKKQVBW-PBHICJAKSA-N 0 0 316.395 5.332 20 0 DKADRN CC(F)(F)c1cccc(N[C@@H]2CCC[C@@H](c3cccnc3)C2)c1 ZINC000502428576 340103052 /nfs/dbraw/zinc/10/30/52/340103052.db2.gz DTJOVIVVKKQVBW-RHSMWYFYSA-N 0 0 316.395 5.332 20 0 DKADRN CC(F)(F)c1cccc(N[C@@H]2CCC[C@H](c3cccnc3)C2)c1 ZINC000502428578 340102964 /nfs/dbraw/zinc/10/29/64/340102964.db2.gz DTJOVIVVKKQVBW-WMLDXEAASA-N 0 0 316.395 5.332 20 0 DKADRN CC(F)(F)c1cccc(N[C@H]2CCC[C@H](c3cccnc3)C2)c1 ZINC000502428580 340102933 /nfs/dbraw/zinc/10/29/33/340102933.db2.gz DTJOVIVVKKQVBW-YOEHRIQHSA-N 0 0 316.395 5.332 20 0 DKADRN Cc1cc(Cl)ccc1N[C@H](C)c1cnn(C2CCCC2)c1 ZINC000502430033 340103071 /nfs/dbraw/zinc/10/30/71/340103071.db2.gz JJOVKVHXUCBMKV-CYBMUJFWSA-N 0 0 303.837 5.133 20 0 DKADRN Cc1cc(Cl)ccc1N[C@@H](C)c1cnn(C2CCCC2)c1 ZINC000502430034 340103078 /nfs/dbraw/zinc/10/30/78/340103078.db2.gz JJOVKVHXUCBMKV-ZDUSSCGKSA-N 0 0 303.837 5.133 20 0 DKADRN CC[C@@H](C)n1ncc(N[C@H](C)c2cc(C)c(C)o2)c1C1CC1 ZINC000502431470 340103185 /nfs/dbraw/zinc/10/31/85/340103185.db2.gz OLNPCRCIWOGUPP-CHWSQXEVSA-N 0 0 301.434 5.114 20 0 DKADRN CC[C@@H](C)n1ncc(N[C@@H](C)c2cc(C)c(C)o2)c1C1CC1 ZINC000502431472 340103181 /nfs/dbraw/zinc/10/31/81/340103181.db2.gz OLNPCRCIWOGUPP-OLZOCXBDSA-N 0 0 301.434 5.114 20 0 DKADRN CC[C@H](C)n1ncc(N[C@H](C)c2cc(C)c(C)o2)c1C1CC1 ZINC000502431475 333294858 /nfs/dbraw/zinc/29/48/58/333294858.db2.gz OLNPCRCIWOGUPP-QWHCGFSZSA-N 0 0 301.434 5.114 20 0 DKADRN CC[C@H](C)n1ncc(N[C@@H](C)c2cc(C)c(C)o2)c1C1CC1 ZINC000502431476 333294977 /nfs/dbraw/zinc/29/49/77/333294977.db2.gz OLNPCRCIWOGUPP-STQMWFEESA-N 0 0 301.434 5.114 20 0 DKADRN C[C@@H](Nc1cccc(C(F)(F)F)c1)c1cnn(C2CCCC2)c1 ZINC000502441345 340103592 /nfs/dbraw/zinc/10/35/92/340103592.db2.gz GLGDVBPAKGPFTA-GFCCVEGCSA-N 0 0 323.362 5.190 20 0 DKADRN C[C@H](Nc1cccc(C(F)(F)F)c1)c1cnn(C2CCCC2)c1 ZINC000502441348 340103618 /nfs/dbraw/zinc/10/36/18/340103618.db2.gz GLGDVBPAKGPFTA-LBPRGKRZSA-N 0 0 323.362 5.190 20 0 DKADRN CSc1ccc(C)c(N[C@@H](C)c2cnn(C3CCCC3)c2)c1 ZINC000502441919 340103676 /nfs/dbraw/zinc/10/36/76/340103676.db2.gz HJKOXFAIILVDAV-AWEZNQCLSA-N 0 0 315.486 5.202 20 0 DKADRN CSc1ccc(C)c(N[C@H](C)c2cnn(C3CCCC3)c2)c1 ZINC000502441922 340103714 /nfs/dbraw/zinc/10/37/14/340103714.db2.gz HJKOXFAIILVDAV-CQSZACIVSA-N 0 0 315.486 5.202 20 0 DKADRN C[C@H](Nc1cccc2ccccc21)c1cnn(C2CCCC2)c1 ZINC000502442307 340103727 /nfs/dbraw/zinc/10/37/27/340103727.db2.gz ICDJVRDYPPVDBL-HNNXBMFYSA-N 0 0 305.425 5.325 20 0 DKADRN C[C@@H](Nc1cccc2ccccc21)c1cnn(C2CCCC2)c1 ZINC000502442313 340103687 /nfs/dbraw/zinc/10/36/87/340103687.db2.gz ICDJVRDYPPVDBL-OAHLLOKOSA-N 0 0 305.425 5.325 20 0 DKADRN Cc1c(Cl)cccc1N[C@H](C)c1cnn(C2CCCC2)c1 ZINC000502448810 340104002 /nfs/dbraw/zinc/10/40/02/340104002.db2.gz BMOVXXXADJWEHB-CYBMUJFWSA-N 0 0 303.837 5.133 20 0 DKADRN Cc1c(Cl)cccc1N[C@@H](C)c1cnn(C2CCCC2)c1 ZINC000502448811 340104067 /nfs/dbraw/zinc/10/40/67/340104067.db2.gz BMOVXXXADJWEHB-ZDUSSCGKSA-N 0 0 303.837 5.133 20 0 DKADRN C[C@@H](Nc1ccc(C(F)(F)F)cc1)c1cnn(C2CCCC2)c1 ZINC000502450445 340104058 /nfs/dbraw/zinc/10/40/58/340104058.db2.gz HKHIDHABIPDOPC-GFCCVEGCSA-N 0 0 323.362 5.190 20 0 DKADRN C[C@H](Nc1ccc(C(F)(F)F)cc1)c1cnn(C2CCCC2)c1 ZINC000502450446 340104047 /nfs/dbraw/zinc/10/40/47/340104047.db2.gz HKHIDHABIPDOPC-LBPRGKRZSA-N 0 0 323.362 5.190 20 0 DKADRN Cc1cc([C@H](C)NC(c2ccccc2)c2ccccc2)oc1C ZINC000502451910 340104187 /nfs/dbraw/zinc/10/41/87/340104187.db2.gz LUWLQFWNGRZCHG-INIZCTEOSA-N 0 0 305.421 5.337 20 0 DKADRN Cc1cc([C@@H](C)NC(c2ccccc2)c2ccccc2)oc1C ZINC000502451911 340104083 /nfs/dbraw/zinc/10/40/83/340104083.db2.gz LUWLQFWNGRZCHG-MRXNPFEDSA-N 0 0 305.421 5.337 20 0 DKADRN C[C@@H](N[C@@H](C)c1cnn(C2CCCC2)c1)c1ccccc1Cl ZINC000502454274 340104308 /nfs/dbraw/zinc/10/43/08/340104308.db2.gz MODDMNNCGJVVQB-UONOGXRCSA-N 0 0 317.864 5.063 20 0 DKADRN C[C@@H](N[C@H](C)c1ccccc1Cl)c1cnn(C2CCCC2)c1 ZINC000502454275 340104245 /nfs/dbraw/zinc/10/42/45/340104245.db2.gz MODDMNNCGJVVQB-ZIAGYGMSSA-N 0 0 317.864 5.063 20 0 DKADRN Cc1ccc(Cl)c(N[C@H](C)c2cnn(C3CCCC3)c2)c1 ZINC000502457465 333298415 /nfs/dbraw/zinc/29/84/15/333298415.db2.gz AXEQNPSJPJSAQQ-CYBMUJFWSA-N 0 0 303.837 5.133 20 0 DKADRN Cc1ccc(Cl)c(N[C@@H](C)c2cnn(C3CCCC3)c2)c1 ZINC000502457466 333298405 /nfs/dbraw/zinc/29/84/05/333298405.db2.gz AXEQNPSJPJSAQQ-ZDUSSCGKSA-N 0 0 303.837 5.133 20 0 DKADRN C[C@@H](Nc1cccc2ccsc21)c1cnn(C2CCCC2)c1 ZINC000502459936 340104452 /nfs/dbraw/zinc/10/44/52/340104452.db2.gz GRTPSTGATCVBOV-CYBMUJFWSA-N 0 0 311.454 5.386 20 0 DKADRN C[C@H](Nc1cccc2ccsc21)c1cnn(C2CCCC2)c1 ZINC000502459937 340104513 /nfs/dbraw/zinc/10/45/13/340104513.db2.gz GRTPSTGATCVBOV-ZDUSSCGKSA-N 0 0 311.454 5.386 20 0 DKADRN Cc1ccc(N[C@H](C)c2cnn(C3CCCC3)c2)c(Cl)c1 ZINC000502461143 340104635 /nfs/dbraw/zinc/10/46/35/340104635.db2.gz JAEKMLAUPDSZCU-CYBMUJFWSA-N 0 0 303.837 5.133 20 0 DKADRN Cc1ccc(N[C@@H](C)c2cnn(C3CCCC3)c2)c(Cl)c1 ZINC000502461144 340104644 /nfs/dbraw/zinc/10/46/44/340104644.db2.gz JAEKMLAUPDSZCU-ZDUSSCGKSA-N 0 0 303.837 5.133 20 0 DKADRN C[C@H](Nc1ccc(C2CCC2)cc1)c1cnn(C2CCCC2)c1 ZINC000502463714 340104726 /nfs/dbraw/zinc/10/47/26/340104726.db2.gz QVLSVVUPJMFZLD-HNNXBMFYSA-N 0 0 309.457 5.439 20 0 DKADRN C[C@@H](Nc1ccc(C2CCC2)cc1)c1cnn(C2CCCC2)c1 ZINC000502463715 340104758 /nfs/dbraw/zinc/10/47/58/340104758.db2.gz QVLSVVUPJMFZLD-OAHLLOKOSA-N 0 0 309.457 5.439 20 0 DKADRN Cc1csc(-c2cccc(NC(=O)Nc3ccccc3C)c2)n1 ZINC000502468759 340104893 /nfs/dbraw/zinc/10/48/93/340104893.db2.gz POXZDSDXJAUMEX-UHFFFAOYSA-N 0 0 323.421 5.071 20 0 DKADRN CC[C@@H](C)Sc1ccc(N[C@@H](C)c2cc(C)n(C)n2)c(C)c1 ZINC000502471596 340105050 /nfs/dbraw/zinc/10/50/50/340105050.db2.gz JJTOUJHPXVBXPV-CABCVRRESA-N 0 0 317.502 5.101 20 0 DKADRN CC[C@H](C)Sc1ccc(N[C@@H](C)c2cc(C)n(C)n2)c(C)c1 ZINC000502471597 340105083 /nfs/dbraw/zinc/10/50/83/340105083.db2.gz JJTOUJHPXVBXPV-GJZGRUSLSA-N 0 0 317.502 5.101 20 0 DKADRN CC[C@@H](C)Sc1ccc(N[C@H](C)c2cc(C)n(C)n2)c(C)c1 ZINC000502471598 340105055 /nfs/dbraw/zinc/10/50/55/340105055.db2.gz JJTOUJHPXVBXPV-HUUCEWRRSA-N 0 0 317.502 5.101 20 0 DKADRN CC[C@H](C)Sc1ccc(N[C@H](C)c2cc(C)n(C)n2)c(C)c1 ZINC000502471599 340105049 /nfs/dbraw/zinc/10/50/49/340105049.db2.gz JJTOUJHPXVBXPV-LSDHHAIUSA-N 0 0 317.502 5.101 20 0 DKADRN Cc1cc([C@H](C)NCc2nc3cc(Cl)ccc3s2)oc1C ZINC000502473611 340105226 /nfs/dbraw/zinc/10/52/26/340105226.db2.gz COZWZYQGYMDKPV-JTQLQIEISA-N 0 0 320.845 5.010 20 0 DKADRN Cc1cc([C@@H](C)NCc2nc3cc(Cl)ccc3s2)oc1C ZINC000502473612 340105107 /nfs/dbraw/zinc/10/51/07/340105107.db2.gz COZWZYQGYMDKPV-SNVBAGLBSA-N 0 0 320.845 5.010 20 0 DKADRN Cc1ccsc1C(=O)Nc1ccc2nc(C(C)C)sc2c1 ZINC000502474148 340105115 /nfs/dbraw/zinc/10/51/15/340105115.db2.gz HCBLFUQXGNWNEW-UHFFFAOYSA-N 0 0 316.451 5.042 20 0 DKADRN CCN(C(=O)c1ccc2ccccc2c1)[C@@H](C)c1ccc(F)cc1 ZINC000502475631 340105230 /nfs/dbraw/zinc/10/52/30/340105230.db2.gz KTPRJFDJFGLEGX-HNNXBMFYSA-N 0 0 321.395 5.202 20 0 DKADRN CCN(C(=O)c1ccc2ccccc2c1)[C@H](C)c1ccc(F)cc1 ZINC000502475632 340105321 /nfs/dbraw/zinc/10/53/21/340105321.db2.gz KTPRJFDJFGLEGX-OAHLLOKOSA-N 0 0 321.395 5.202 20 0 DKADRN C[C@@H](Nc1csc2ccccc12)c1cnn(C2CCCC2)c1 ZINC000502475641 340105248 /nfs/dbraw/zinc/10/52/48/340105248.db2.gz KUOGKQWXAWYSOR-CYBMUJFWSA-N 0 0 311.454 5.386 20 0 DKADRN C[C@H](Nc1csc2ccccc12)c1cnn(C2CCCC2)c1 ZINC000502475642 340105290 /nfs/dbraw/zinc/10/52/90/340105290.db2.gz KUOGKQWXAWYSOR-ZDUSSCGKSA-N 0 0 311.454 5.386 20 0 DKADRN Cc1ccc(C(=O)Nc2ccc3nc(C(C)C)sc3c2)s1 ZINC000502476652 340105247 /nfs/dbraw/zinc/10/52/47/340105247.db2.gz UCYBBVFPIZCXOP-UHFFFAOYSA-N 0 0 316.451 5.042 20 0 DKADRN CSCc1ccc(N[C@@H](C)c2cnn(C3CCCC3)c2)cc1 ZINC000502476779 340105235 /nfs/dbraw/zinc/10/52/35/340105235.db2.gz ZANQUCIPKOMPBR-AWEZNQCLSA-N 0 0 315.486 5.034 20 0 DKADRN CSCc1ccc(N[C@H](C)c2cnn(C3CCCC3)c2)cc1 ZINC000502476785 340105294 /nfs/dbraw/zinc/10/52/94/340105294.db2.gz ZANQUCIPKOMPBR-CQSZACIVSA-N 0 0 315.486 5.034 20 0 DKADRN Cc1ccccc1NC(=O)Nc1cccc(-c2cccs2)c1 ZINC000502491593 340105956 /nfs/dbraw/zinc/10/59/56/340105956.db2.gz KBSGEZPCBFAOFD-UHFFFAOYSA-N 0 0 308.406 5.368 20 0 DKADRN CC[C@H](C)[C@H](C)C(=O)N(Cc1cccs1)Cc1cccs1 ZINC000502497252 340106056 /nfs/dbraw/zinc/10/60/56/340106056.db2.gz BCLCDRWIYJRFAG-KBPBESRZSA-N 0 0 321.511 5.021 20 0 DKADRN CC[C@@H](C)[C@H](C)C(=O)N(Cc1cccs1)Cc1cccs1 ZINC000502497259 340106019 /nfs/dbraw/zinc/10/60/19/340106019.db2.gz BCLCDRWIYJRFAG-KGLIPLIRSA-N 0 0 321.511 5.021 20 0 DKADRN CC[C@H](C)[C@@H](C)C(=O)N(Cc1cccs1)Cc1cccs1 ZINC000502497260 340105983 /nfs/dbraw/zinc/10/59/83/340105983.db2.gz BCLCDRWIYJRFAG-UONOGXRCSA-N 0 0 321.511 5.021 20 0 DKADRN CC[C@@H](C)[C@@H](C)C(=O)N(Cc1cccs1)Cc1cccs1 ZINC000502497261 333300783 /nfs/dbraw/zinc/30/07/83/333300783.db2.gz BCLCDRWIYJRFAG-ZIAGYGMSSA-N 0 0 321.511 5.021 20 0 DKADRN CC(C)[C@H](N[C@H](C)c1nc2ccccc2o1)c1ccc(F)cc1 ZINC000502497327 333300730 /nfs/dbraw/zinc/30/07/30/333300730.db2.gz AJVKTSMANASDNA-ACJLOTCBSA-N 0 0 312.388 5.015 20 0 DKADRN CC(C)[C@@H](N[C@H](C)c1nc2ccccc2o1)c1ccc(F)cc1 ZINC000502497328 333300771 /nfs/dbraw/zinc/30/07/71/333300771.db2.gz AJVKTSMANASDNA-FZKQIMNGSA-N 0 0 312.388 5.015 20 0 DKADRN CC(C)[C@@H](N[C@@H](C)c1nc2ccccc2o1)c1ccc(F)cc1 ZINC000502497329 333300710 /nfs/dbraw/zinc/30/07/10/333300710.db2.gz AJVKTSMANASDNA-SCLBCKFNSA-N 0 0 312.388 5.015 20 0 DKADRN CC(C)[C@H](N[C@@H](C)c1nc2ccccc2o1)c1ccc(F)cc1 ZINC000502497330 333300919 /nfs/dbraw/zinc/30/09/19/333300919.db2.gz AJVKTSMANASDNA-UGSOOPFHSA-N 0 0 312.388 5.015 20 0 DKADRN CN(CC1CCCCC1)C(=O)c1sccc1-c1ccccc1 ZINC000502500652 340106202 /nfs/dbraw/zinc/10/62/02/340106202.db2.gz LWTKSBMTKMVYJB-UHFFFAOYSA-N 0 0 313.466 5.067 20 0 DKADRN Cc1ccccc1NC(=O)Nc1ccc2nc(C3CC3)sc2c1 ZINC000502504135 340106203 /nfs/dbraw/zinc/10/62/03/340106203.db2.gz YGTBQMOGAXQPEL-UHFFFAOYSA-N 0 0 323.421 5.126 20 0 DKADRN Cc1cc2cc(NC(=O)Nc3ccc(C(C)C)cc3)ccc2[nH]1 ZINC000502524606 340106987 /nfs/dbraw/zinc/10/69/87/340106987.db2.gz ZFCYQGWGNUZIED-UHFFFAOYSA-N 0 0 307.397 5.244 20 0 DKADRN CO[C@@H](C)c1cccc(NC(=O)Nc2ccc(C(C)C)cc2)c1 ZINC000502538649 340107218 /nfs/dbraw/zinc/10/72/18/340107218.db2.gz QJZDUGAHKNQOHI-AWEZNQCLSA-N 0 0 312.413 5.161 20 0 DKADRN CO[C@H](C)c1cccc(NC(=O)Nc2ccc(C(C)C)cc2)c1 ZINC000502538650 340107189 /nfs/dbraw/zinc/10/71/89/340107189.db2.gz QJZDUGAHKNQOHI-CQSZACIVSA-N 0 0 312.413 5.161 20 0 DKADRN O=C(Nc1cccc2[nH]ccc21)Nc1ccc(Cl)cc1Cl ZINC000502542558 340107266 /nfs/dbraw/zinc/10/72/66/340107266.db2.gz UXXZMBKMUUCGBC-UHFFFAOYSA-N 0 0 320.179 5.119 20 0 DKADRN Cc1cccc(NC(=O)Nc2c(C(C)C)cccc2C(C)C)c1C ZINC000502542645 333302139 /nfs/dbraw/zinc/30/21/39/333302139.db2.gz WEHQNGPLEFPYLA-UHFFFAOYSA-N 0 0 324.468 6.194 20 0 DKADRN CC(C)(C)c1ccc(NC(=O)Nc2cccc3[nH]ccc32)cc1 ZINC000502551315 340107400 /nfs/dbraw/zinc/10/74/00/340107400.db2.gz KBIFSWYKTMXKFU-UHFFFAOYSA-N 0 0 307.397 5.109 20 0 DKADRN CCCOc1ccccc1NC(=O)Nc1c(C)cc(C)cc1C ZINC000502552212 340107485 /nfs/dbraw/zinc/10/74/85/340107485.db2.gz BAZYTATYEDJBQC-UHFFFAOYSA-N 0 0 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CCCC[C@H](C)C(=O)N1CCCC[C@@H]1c1cc2ccccc2[nH]1 ZINC000503322222 340125356 /nfs/dbraw/zinc/12/53/56/340125356.db2.gz MFZNUSCSFQBIGT-HNAYVOBHSA-N 0 0 312.457 5.048 20 0 DKADRN CCCC[C@H](C)C(=O)N1CCCC[C@H]1c1cc2ccccc2[nH]1 ZINC000503322224 340125336 /nfs/dbraw/zinc/12/53/36/340125336.db2.gz MFZNUSCSFQBIGT-KXBFYZLASA-N 0 0 312.457 5.048 20 0 DKADRN Cc1cccc(C(C)C)c1NC(=O)NCC(C)(C)c1ccccc1 ZINC000503322344 340125344 /nfs/dbraw/zinc/12/53/44/340125344.db2.gz NIOLAOMWMRQFCD-UHFFFAOYSA-N 0 0 324.468 5.218 20 0 DKADRN CCC(CC)[C@H](NC(=O)N(C)Cc1ccccc1)c1ccccc1 ZINC000503338002 340125744 /nfs/dbraw/zinc/12/57/44/340125744.db2.gz GTSNDTKIWRQOJT-FQEVSTJZSA-N 0 0 324.468 5.006 20 0 DKADRN CCC(CC)[C@@H](NC(=O)N(C)Cc1ccccc1)c1ccccc1 ZINC000503338004 340125749 /nfs/dbraw/zinc/12/57/49/340125749.db2.gz GTSNDTKIWRQOJT-HXUWFJFHSA-N 0 0 324.468 5.006 20 0 DKADRN C[C@H](c1ccccc1)N(C)C(=O)N[C@@H](c1ccccc1)C(C)(C)C ZINC000503342454 340125881 /nfs/dbraw/zinc/12/58/81/340125881.db2.gz GEXUEAKKLUETAW-APWZRJJASA-N 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C[C@@H](SC1CCCCC1)c1nnc(-c2cccc(Cl)c2)o1 ZINC000503359754 340126309 /nfs/dbraw/zinc/12/63/09/340126309.db2.gz LOMMABFUPDICPN-LLVKDONJSA-N 0 0 322.861 5.517 20 0 DKADRN C[C@H](SC1CCCCC1)c1nnc(-c2cccc(Cl)c2)o1 ZINC000503359755 340126229 /nfs/dbraw/zinc/12/62/29/340126229.db2.gz LOMMABFUPDICPN-NSHDSACASA-N 0 0 322.861 5.517 20 0 DKADRN CCC1CCC(N(C)C(=O)Nc2cccc(C(F)F)c2)CC1 ZINC000503360941 340126236 /nfs/dbraw/zinc/12/62/36/340126236.db2.gz QXCZIJDWMMTINW-UHFFFAOYSA-N 0 0 310.388 5.057 20 0 DKADRN Cc1ccc(-c2nnc([C@H](C)SC3CCCCC3)o2)cc1 ZINC000503362306 340126303 /nfs/dbraw/zinc/12/63/03/340126303.db2.gz DEJCXXGTEUOXAI-ZDUSSCGKSA-N 0 0 302.443 5.172 20 0 DKADRN CCc1sc(-c2nnc(CSC3CCCCC3)o2)cc1C ZINC000503362312 340126235 /nfs/dbraw/zinc/12/62/35/340126235.db2.gz DIGMDTGDDXGLDF-UHFFFAOYSA-N 0 0 322.499 5.235 20 0 DKADRN CC[C@H](C)Sc1ccc(NC(=O)NC2(C)CCCC2)c(C)c1 ZINC000503365449 340126317 /nfs/dbraw/zinc/12/63/17/340126317.db2.gz SHBMYVQLJRHOLS-AWEZNQCLSA-N 0 0 320.502 5.340 20 0 DKADRN 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DKADRN CCCN(C(=O)[C@H]1CCCC(F)(F)C1)[C@H](CC)c1ccccc1 ZINC000503468225 340128896 /nfs/dbraw/zinc/12/88/96/340128896.db2.gz TVVOWZQBONVMEG-DLBZAZTESA-N 0 0 323.427 5.202 20 0 DKADRN CCCN(C(=O)[C@@H]1CCCC(F)(F)C1)[C@H](CC)c1ccccc1 ZINC000503468226 340128845 /nfs/dbraw/zinc/12/88/45/340128845.db2.gz TVVOWZQBONVMEG-IAGOWNOFSA-N 0 0 323.427 5.202 20 0 DKADRN CCCN(C(=O)[C@H]1CCCC(F)(F)C1)[C@@H](CC)c1ccccc1 ZINC000503468227 340128850 /nfs/dbraw/zinc/12/88/50/340128850.db2.gz TVVOWZQBONVMEG-IRXDYDNUSA-N 0 0 323.427 5.202 20 0 DKADRN CCCN(C(=O)[C@@H]1CCCC(F)(F)C1)[C@@H](CC)c1ccccc1 ZINC000503468228 340128821 /nfs/dbraw/zinc/12/88/21/340128821.db2.gz TVVOWZQBONVMEG-SJORKVTESA-N 0 0 323.427 5.202 20 0 DKADRN CC(C)(C)c1ccccc1NC(=O)N[C@@H]1CCCc2ccccc21 ZINC000503512157 340129484 /nfs/dbraw/zinc/12/94/84/340129484.db2.gz PNHGRRWLIVXFQH-GOSISDBHSA-N 0 0 322.452 5.183 20 0 DKADRN CC(C)(C)c1ccccc1NC(=O)N[C@H]1CCCc2ccccc21 ZINC000503512158 340129511 /nfs/dbraw/zinc/12/95/11/340129511.db2.gz 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ZINC000507135613 340209079 /nfs/dbraw/zinc/20/90/79/340209079.db2.gz KGUIVQNBPZJRPI-UHFFFAOYSA-N 0 0 303.352 5.174 20 0 DKADRN CCC[C@H](C(=O)Nc1cccc(C(F)F)c1)c1ccccc1 ZINC000507138504 340209348 /nfs/dbraw/zinc/20/93/48/340209348.db2.gz KGEGKPPJYWFCCN-INIZCTEOSA-N 0 0 303.352 5.147 20 0 DKADRN CCC[C@@H](C(=O)Nc1cccc(C(F)F)c1)c1ccccc1 ZINC000507138505 340209314 /nfs/dbraw/zinc/20/93/14/340209314.db2.gz KGEGKPPJYWFCCN-MRXNPFEDSA-N 0 0 303.352 5.147 20 0 DKADRN O=C(Nc1cccc(C(F)F)c1)c1cc2ccccc2s1 ZINC000507139184 340209271 /nfs/dbraw/zinc/20/92/71/340209271.db2.gz OPVVGLRIVRWAJF-UHFFFAOYSA-N 0 0 303.333 5.091 20 0 DKADRN CCCCc1ccc(CC(=O)Nc2cccc(C(F)F)c2)cc1 ZINC000507147628 340209638 /nfs/dbraw/zinc/20/96/38/340209638.db2.gz CECDFFFOSLTGBX-UHFFFAOYSA-N 0 0 317.379 5.148 20 0 DKADRN Cc1ccc(S[C@H](C)C(=O)Nc2cccc(C(F)F)c2)cc1 ZINC000507148919 340209615 /nfs/dbraw/zinc/20/96/15/340209615.db2.gz JWCAQGYHRWOTJC-GFCCVEGCSA-N 0 0 321.392 5.052 20 0 DKADRN Cc1ccc(S[C@@H](C)C(=O)Nc2cccc(C(F)F)c2)cc1 ZINC000507148923 340209679 /nfs/dbraw/zinc/20/96/79/340209679.db2.gz JWCAQGYHRWOTJC-LBPRGKRZSA-N 0 0 321.392 5.052 20 0 DKADRN O=C(Nc1cccc(C(F)F)c1)c1cc2cc(F)ccc2s1 ZINC000507154611 340209697 /nfs/dbraw/zinc/20/96/97/340209697.db2.gz CXLAAGMLPIPCDV-UHFFFAOYSA-N 0 0 321.323 5.230 20 0 DKADRN CCCCOc1ccc(C(=O)Nc2cccc(C(F)F)c2)cc1 ZINC000507161867 340210149 /nfs/dbraw/zinc/21/01/49/340210149.db2.gz BHCNOZPZQBXHMN-UHFFFAOYSA-N 0 0 319.351 5.055 20 0 DKADRN Cc1ccc(C(C)(C)CC(=O)Nc2cccc(C(F)F)c2)cc1 ZINC000507161958 340210336 /nfs/dbraw/zinc/21/03/36/340210336.db2.gz LKIXCUYILMDSSN-UHFFFAOYSA-N 0 0 317.379 5.239 20 0 DKADRN CCCOc1cc(C)ccc1NC(=O)c1cc(C(C)C)oc1C ZINC000507193932 340212331 /nfs/dbraw/zinc/21/23/31/340212331.db2.gz WCEWVWWGOUSZFI-UHFFFAOYSA-N 0 0 315.413 5.061 20 0 DKADRN C[C@H](Nc1ccc2nc(C(F)F)sc2c1)c1ccccc1 ZINC000507209372 340213618 /nfs/dbraw/zinc/21/36/18/340213618.db2.gz HJXLXVBMMWGHFR-JTQLQIEISA-N 0 0 304.365 5.407 20 0 DKADRN C[C@@H](Nc1ccc2nc(C(F)F)sc2c1)c1ccccc1 ZINC000507209373 340213709 /nfs/dbraw/zinc/21/37/09/340213709.db2.gz HJXLXVBMMWGHFR-SNVBAGLBSA-N 0 0 304.365 5.407 20 0 DKADRN C[C@@H](Nc1ccc2nc(C(F)F)sc2c1)c1cccc(F)c1 ZINC000507210982 340213642 /nfs/dbraw/zinc/21/36/42/340213642.db2.gz LVKDNMYKWKQVND-SECBINFHSA-N 0 0 322.355 5.546 20 0 DKADRN C[C@H](Nc1ccc2nc(C(F)F)sc2c1)c1cccc(F)c1 ZINC000507210983 340213661 /nfs/dbraw/zinc/21/36/61/340213661.db2.gz LVKDNMYKWKQVND-VIFPVBQESA-N 0 0 322.355 5.546 20 0 DKADRN FC(F)c1nc2ccc(N[C@@H]3CCc4ccccc43)cc2s1 ZINC000507227110 340214721 /nfs/dbraw/zinc/21/47/21/340214721.db2.gz CTVNZMGCEIPNQB-CYBMUJFWSA-N 0 0 316.376 5.333 20 0 DKADRN FC(F)c1nc2ccc(N[C@H]3CCc4ccccc43)cc2s1 ZINC000507227118 340214569 /nfs/dbraw/zinc/21/45/69/340214569.db2.gz CTVNZMGCEIPNQB-ZDUSSCGKSA-N 0 0 316.376 5.333 20 0 DKADRN C[C@@H](Nc1ccc2nc(C(F)F)sc2c1)c1ccccc1F ZINC000507231145 340214980 /nfs/dbraw/zinc/21/49/80/340214980.db2.gz PYYDJMNZVWUFQV-SECBINFHSA-N 0 0 322.355 5.546 20 0 DKADRN C[C@H](Nc1ccc2nc(C(F)F)sc2c1)c1ccccc1F ZINC000507231147 340214781 /nfs/dbraw/zinc/21/47/81/340214781.db2.gz PYYDJMNZVWUFQV-VIFPVBQESA-N 0 0 322.355 5.546 20 0 DKADRN C[C@@H](Nc1ccc2nc(C(F)F)sc2c1)c1ccc(F)cc1 ZINC000507250970 340215740 /nfs/dbraw/zinc/21/57/40/340215740.db2.gz DVCQTFQJDILVMB-SECBINFHSA-N 0 0 322.355 5.546 20 0 DKADRN C[C@H](Nc1ccc2nc(C(F)F)sc2c1)c1ccc(F)cc1 ZINC000507250971 340215633 /nfs/dbraw/zinc/21/56/33/340215633.db2.gz DVCQTFQJDILVMB-VIFPVBQESA-N 0 0 322.355 5.546 20 0 DKADRN CC[C@H](C)[C@H](C)C(=O)N1CCC[C@H]1c1cccc2ccccc21 ZINC000507263883 340216128 /nfs/dbraw/zinc/21/61/28/340216128.db2.gz QYDMJAIBRBFKGI-FTRWYGJKSA-N 0 0 309.453 5.186 20 0 DKADRN CC[C@H](C)[C@@H](C)C(=O)N1CCC[C@@H]1c1cccc2ccccc21 ZINC000507264384 340216094 /nfs/dbraw/zinc/21/60/94/340216094.db2.gz QYDMJAIBRBFKGI-RZQQEMMASA-N 0 0 309.453 5.186 20 0 DKADRN CC[C@H](C)[C@H](C)C(=O)N1CCC[C@@H]1c1cccc2ccccc21 ZINC000507264385 340216132 /nfs/dbraw/zinc/21/61/32/340216132.db2.gz QYDMJAIBRBFKGI-TWOQFEAHSA-N 0 0 309.453 5.186 20 0 DKADRN CC[C@H](C)[C@@H](C)C(=O)N1CCC[C@H]1c1cccc2ccccc21 ZINC000507264386 340216061 /nfs/dbraw/zinc/21/60/61/340216061.db2.gz QYDMJAIBRBFKGI-YRNRMSPPSA-N 0 0 309.453 5.186 20 0 DKADRN Cc1cc2cc(C[NH2+][C@H](C)c3ccc(Cl)s3)ccc2[nH]1 ZINC000507273874 340216432 /nfs/dbraw/zinc/21/64/32/340216432.db2.gz VPQCQDWEJJHBKQ-LLVKDONJSA-N 0 0 304.846 5.042 20 0 DKADRN Cc1cc2cc(C[NH2+][C@@H](C)c3ccc(Cl)s3)ccc2[nH]1 ZINC000507273882 340216383 /nfs/dbraw/zinc/21/63/83/340216383.db2.gz VPQCQDWEJJHBKQ-NSHDSACASA-N 0 0 304.846 5.042 20 0 DKADRN Cc1oc(-c2ccsc2)nc1COc1c(F)cccc1Cl ZINC000507350799 340217836 /nfs/dbraw/zinc/21/78/36/340217836.db2.gz ACYZPRPPXONBQU-UHFFFAOYSA-N 0 0 323.776 5.083 20 0 DKADRN CC(C)(NCc1csc(C2CCCCC2)n1)c1ccccc1 ZINC000507354255 340217753 /nfs/dbraw/zinc/21/77/53/340217753.db2.gz AQFFSEMMLRCPET-UHFFFAOYSA-N 0 0 314.498 5.216 20 0 DKADRN Cc1oc(-c2ccccc2)nc1COc1c(F)cccc1Cl ZINC000507367547 340218047 /nfs/dbraw/zinc/21/80/47/340218047.db2.gz LKYSSHPAAPRQSA-UHFFFAOYSA-N 0 0 317.747 5.022 20 0 DKADRN CCc1cccnc1[C@@H](C)Nc1ccc(CCC(F)(F)F)cc1 ZINC000507395873 340218590 /nfs/dbraw/zinc/21/85/90/340218590.db2.gz AKSKJYNACABDKY-CYBMUJFWSA-N 0 0 322.374 5.312 20 0 DKADRN CCc1cccnc1[C@H](C)Nc1ccc(CCC(F)(F)F)cc1 ZINC000507395874 340218524 /nfs/dbraw/zinc/21/85/24/340218524.db2.gz AKSKJYNACABDKY-ZDUSSCGKSA-N 0 0 322.374 5.312 20 0 DKADRN C[C@H](Nc1cccc(CSC2CCCC2)c1)[C@@H]1CCCOC1 ZINC000507396220 340218574 /nfs/dbraw/zinc/21/85/74/340218574.db2.gz BTQOHULZSSCWGP-DOTOQJQBSA-N 0 0 319.514 5.089 20 0 DKADRN C[C@@H](Nc1cccc(CSC2CCCC2)c1)[C@@H]1CCCOC1 ZINC000507396221 340218505 /nfs/dbraw/zinc/21/85/05/340218505.db2.gz BTQOHULZSSCWGP-NVXWUHKLSA-N 0 0 319.514 5.089 20 0 DKADRN C[C@H](Nc1cccc(CSC2CCCC2)c1)[C@H]1CCCOC1 ZINC000507396222 340218580 /nfs/dbraw/zinc/21/85/80/340218580.db2.gz BTQOHULZSSCWGP-RDJZCZTQSA-N 0 0 319.514 5.089 20 0 DKADRN C[C@@H](Nc1cccc(CSC2CCCC2)c1)[C@H]1CCCOC1 ZINC000507396223 340218478 /nfs/dbraw/zinc/21/84/78/340218478.db2.gz BTQOHULZSSCWGP-WBVHZDCISA-N 0 0 319.514 5.089 20 0 DKADRN CCSCc1cccc(N[C@@H](C)c2ncccc2CC)c1 ZINC000507400446 340218556 /nfs/dbraw/zinc/21/85/56/340218556.db2.gz JQXZHABZTAQLFR-AWEZNQCLSA-N 0 0 300.471 5.070 20 0 DKADRN CCSCc1cccc(N[C@H](C)c2ncccc2CC)c1 ZINC000507400447 340218530 /nfs/dbraw/zinc/21/85/30/340218530.db2.gz JQXZHABZTAQLFR-CQSZACIVSA-N 0 0 300.471 5.070 20 0 DKADRN CCc1cccnc1[C@H](C)Nc1cccc(-c2nc(C)cs2)c1 ZINC000507400714 340218592 /nfs/dbraw/zinc/21/85/92/340218592.db2.gz JZXOLIYTEFHZNM-AWEZNQCLSA-N 0 0 323.465 5.249 20 0 DKADRN CCc1cccnc1[C@@H](C)Nc1cccc(-c2nc(C)cs2)c1 ZINC000507400719 340218603 /nfs/dbraw/zinc/21/86/03/340218603.db2.gz JZXOLIYTEFHZNM-CQSZACIVSA-N 0 0 323.465 5.249 20 0 DKADRN CCc1cccnc1[C@H](C)Nc1ccc(-c2nc(C)cs2)cc1 ZINC000507409178 340218606 /nfs/dbraw/zinc/21/86/06/340218606.db2.gz VWGWDJWYPHLZPF-AWEZNQCLSA-N 0 0 323.465 5.249 20 0 DKADRN CCc1cccnc1[C@@H](C)Nc1ccc(-c2nc(C)cs2)cc1 ZINC000507409181 340218673 /nfs/dbraw/zinc/21/86/73/340218673.db2.gz VWGWDJWYPHLZPF-CQSZACIVSA-N 0 0 323.465 5.249 20 0 DKADRN C[C@@H](Nc1ccc(Cl)c(OC(F)F)c1)c1ccsc1 ZINC000507419454 340218827 /nfs/dbraw/zinc/21/88/27/340218827.db2.gz HVCYSNXEWGEWCF-MRVPVSSYSA-N 0 0 303.761 5.176 20 0 DKADRN C[C@H](Nc1ccc(Cl)c(OC(F)F)c1)c1ccsc1 ZINC000507419455 340218840 /nfs/dbraw/zinc/21/88/40/340218840.db2.gz HVCYSNXEWGEWCF-QMMMGPOBSA-N 0 0 303.761 5.176 20 0 DKADRN C[C@H](c1cccs1)N(C)Cc1nc(-c2ccccc2)cs1 ZINC000507431029 340219196 /nfs/dbraw/zinc/21/91/96/340219196.db2.gz CXNKFTHOEFBYLD-CYBMUJFWSA-N 0 0 314.479 5.065 20 0 DKADRN C[C@@H](c1cccs1)N(C)Cc1nc(-c2ccccc2)cs1 ZINC000507431030 340219262 /nfs/dbraw/zinc/21/92/62/340219262.db2.gz CXNKFTHOEFBYLD-ZDUSSCGKSA-N 0 0 314.479 5.065 20 0 DKADRN C[C@@H](c1cccs1)[N@H+](C)Cc1cccc(-c2cccnc2)c1 ZINC000507434403 340219389 /nfs/dbraw/zinc/21/93/89/340219389.db2.gz QWOHJDUZHWOHMJ-HNNXBMFYSA-N 0 0 308.450 5.003 20 0 DKADRN C[C@H](c1cccs1)[N@H+](C)Cc1cccc(-c2cccnc2)c1 ZINC000507434410 340219467 /nfs/dbraw/zinc/21/94/67/340219467.db2.gz QWOHJDUZHWOHMJ-OAHLLOKOSA-N 0 0 308.450 5.003 20 0 DKADRN Clc1ccc(NCc2cc(Cl)cc3cccnc32)cc1 ZINC000507438998 340219589 /nfs/dbraw/zinc/21/95/89/340219589.db2.gz BNYIRIZLACRAEB-UHFFFAOYSA-N 0 0 303.192 5.154 20 0 DKADRN C[C@H](c1cccs1)N(C)Cc1cnc(C2CCCC2)s1 ZINC000507439390 340219549 /nfs/dbraw/zinc/21/95/49/340219549.db2.gz DHQDPCYFPUCCMO-GFCCVEGCSA-N 0 0 306.500 5.055 20 0 DKADRN C[C@@H](c1cccs1)N(C)Cc1cnc(C2CCCC2)s1 ZINC000507439395 340219611 /nfs/dbraw/zinc/21/96/11/340219611.db2.gz DHQDPCYFPUCCMO-LBPRGKRZSA-N 0 0 306.500 5.055 20 0 DKADRN Cc1nc2c(s1)[C@H]([NH2+][C@H](c1ccccc1C)C(C)C)CCC2 ZINC000507440976 340219542 /nfs/dbraw/zinc/21/95/42/340219542.db2.gz JMGNBJVWRKEGRG-MSOLQXFVSA-N 0 0 314.498 5.124 20 0 DKADRN Cc1nc2c(s1)[C@H]([NH2+][C@@H](c1ccccc1C)C(C)C)CCC2 ZINC000507440986 340219568 /nfs/dbraw/zinc/21/95/68/340219568.db2.gz JMGNBJVWRKEGRG-QZTJIDSGSA-N 0 0 314.498 5.124 20 0 DKADRN CCc1cccnc1[C@H](C)[NH2+][C@@H](CC1CCC1)c1ccccc1 ZINC000507447588 340220073 /nfs/dbraw/zinc/22/00/73/340220073.db2.gz XLLTXRCDKXJWCD-JXFKEZNVSA-N 0 0 308.469 5.226 20 0 DKADRN CCc1cccnc1[C@H](C)[NH2+][C@H](CC1CCC1)c1ccccc1 ZINC000507447589 340220119 /nfs/dbraw/zinc/22/01/19/340220119.db2.gz XLLTXRCDKXJWCD-OXJNMPFZSA-N 0 0 308.469 5.226 20 0 DKADRN CCc1cccnc1[C@@H](C)[NH2+][C@H](CC1CCC1)c1ccccc1 ZINC000507447590 340220126 /nfs/dbraw/zinc/22/01/26/340220126.db2.gz XLLTXRCDKXJWCD-OXQOHEQNSA-N 0 0 308.469 5.226 20 0 DKADRN CCc1cccnc1[C@@H](C)[NH2+][C@@H](CC1CCC1)c1ccccc1 ZINC000507447591 340220054 /nfs/dbraw/zinc/22/00/54/340220054.db2.gz XLLTXRCDKXJWCD-UZLBHIALSA-N 0 0 308.469 5.226 20 0 DKADRN CCc1cccnc1[C@@H](C)Nc1cc(Cl)ccc1SC ZINC000507447891 340220171 /nfs/dbraw/zinc/22/01/71/340220171.db2.gz JHCUNKVWCSUYHX-LLVKDONJSA-N 0 0 306.862 5.192 20 0 DKADRN CCc1cccnc1[C@H](C)Nc1cc(Cl)ccc1SC ZINC000507447895 340220135 /nfs/dbraw/zinc/22/01/35/340220135.db2.gz JHCUNKVWCSUYHX-NSHDSACASA-N 0 0 306.862 5.192 20 0 DKADRN Cc1ccc([C@@H](C)Nc2ccc(Cl)c(OC(F)F)c2)o1 ZINC000507451136 340220305 /nfs/dbraw/zinc/22/03/05/340220305.db2.gz SKARKGSDICRLGN-SECBINFHSA-N 0 0 301.720 5.016 20 0 DKADRN Cc1ccc([C@H](C)Nc2ccc(Cl)c(OC(F)F)c2)o1 ZINC000507451139 340220316 /nfs/dbraw/zinc/22/03/16/340220316.db2.gz SKARKGSDICRLGN-VIFPVBQESA-N 0 0 301.720 5.016 20 0 DKADRN CCc1cccnc1[C@H](C)NC(c1ccccc1)c1ccccc1 ZINC000507465030 340220844 /nfs/dbraw/zinc/22/08/44/340220844.db2.gz ZEICTCCIOQKFHN-KRWDZBQOSA-N 0 0 316.448 5.084 20 0 DKADRN CCc1cccnc1[C@@H](C)NC(c1ccccc1)c1ccccc1 ZINC000507465031 340220878 /nfs/dbraw/zinc/22/08/78/340220878.db2.gz ZEICTCCIOQKFHN-QGZVFWFLSA-N 0 0 316.448 5.084 20 0 DKADRN COc1ccc([C@@H](C)Nc2ccccc2OC(C)C)cc1Cl ZINC000507467605 340220993 /nfs/dbraw/zinc/22/09/93/340220993.db2.gz XLMVXBYNPKCOHU-CYBMUJFWSA-N 0 0 319.832 5.309 20 0 DKADRN COc1ccc([C@H](C)Nc2ccccc2OC(C)C)cc1Cl ZINC000507467606 340220963 /nfs/dbraw/zinc/22/09/63/340220963.db2.gz XLMVXBYNPKCOHU-ZDUSSCGKSA-N 0 0 319.832 5.309 20 0 DKADRN COc1ccc([C@H](C)Nc2cccc(C(F)F)c2)cc1Cl ZINC000507468590 340220964 /nfs/dbraw/zinc/22/09/64/340220964.db2.gz OEZXNEWYCFTCKX-JTQLQIEISA-N 0 0 311.759 5.459 20 0 DKADRN COc1ccc([C@@H](C)Nc2cccc(C(F)F)c2)cc1Cl ZINC000507468594 340221087 /nfs/dbraw/zinc/22/10/87/340221087.db2.gz OEZXNEWYCFTCKX-SNVBAGLBSA-N 0 0 311.759 5.459 20 0 DKADRN CCc1cccnc1[C@H](C)[NH2+][C@@H](c1ccc(Cl)cc1)C(C)C ZINC000507469153 340221197 /nfs/dbraw/zinc/22/11/97/340221197.db2.gz JQEGKDJMTPVLML-KBXCAEBGSA-N 0 0 316.876 5.345 20 0 DKADRN CCc1cccnc1[C@@H](C)[NH2+][C@H](c1ccc(Cl)cc1)C(C)C ZINC000507469154 340221217 /nfs/dbraw/zinc/22/12/17/340221217.db2.gz JQEGKDJMTPVLML-KDOFPFPSSA-N 0 0 316.876 5.345 20 0 DKADRN CCc1cccnc1[C@H](C)[NH2+][C@H](c1ccc(Cl)cc1)C(C)C ZINC000507469156 340221250 /nfs/dbraw/zinc/22/12/50/340221250.db2.gz JQEGKDJMTPVLML-KSSFIOAISA-N 0 0 316.876 5.345 20 0 DKADRN CCc1cccnc1[C@@H](C)[NH2+][C@@H](c1ccc(Cl)cc1)C(C)C ZINC000507469157 340221120 /nfs/dbraw/zinc/22/11/20/340221120.db2.gz JQEGKDJMTPVLML-RDTXWAMCSA-N 0 0 316.876 5.345 20 0 DKADRN CCc1cccnc1[C@@H](C)Nc1cccc(-c2csc(C)n2)c1 ZINC000507470061 340221212 /nfs/dbraw/zinc/22/12/12/340221212.db2.gz LTSBEUCHCDQTTB-CYBMUJFWSA-N 0 0 323.465 5.249 20 0 DKADRN CCc1cccnc1[C@H](C)Nc1cccc(-c2csc(C)n2)c1 ZINC000507470062 340221303 /nfs/dbraw/zinc/22/13/03/340221303.db2.gz LTSBEUCHCDQTTB-ZDUSSCGKSA-N 0 0 323.465 5.249 20 0 DKADRN CCOc1cc(F)ccc1N[C@H](C)c1ccc(OC)c(Cl)c1 ZINC000507470684 340221291 /nfs/dbraw/zinc/22/12/91/340221291.db2.gz VMNHLRJZQYAWCE-LLVKDONJSA-N 0 0 323.795 5.060 20 0 DKADRN CCOc1cc(F)ccc1N[C@@H](C)c1ccc(OC)c(Cl)c1 ZINC000507470699 340221313 /nfs/dbraw/zinc/22/13/13/340221313.db2.gz VMNHLRJZQYAWCE-NSHDSACASA-N 0 0 323.795 5.060 20 0 DKADRN CCc1cccnc1[C@H](C)Nc1cccc(N2CCC(C)CC2)c1 ZINC000507471977 340221382 /nfs/dbraw/zinc/22/13/82/340221382.db2.gz CSZFFVFWFNFYOH-KRWDZBQOSA-N 0 0 323.484 5.053 20 0 DKADRN CCc1cccnc1[C@@H](C)Nc1cccc(N2CCC(C)CC2)c1 ZINC000507471979 340221385 /nfs/dbraw/zinc/22/13/85/340221385.db2.gz CSZFFVFWFNFYOH-QGZVFWFLSA-N 0 0 323.484 5.053 20 0 DKADRN CCc1cccnc1[C@H](C)Nc1cccc(N2CCCCCC2)c1 ZINC000507472012 340221413 /nfs/dbraw/zinc/22/14/13/340221413.db2.gz CWOWVKBKEZKZCR-KRWDZBQOSA-N 0 0 323.484 5.198 20 0 DKADRN CCc1cccnc1[C@@H](C)Nc1cccc(N2CCCCCC2)c1 ZINC000507472014 340221505 /nfs/dbraw/zinc/22/15/05/340221505.db2.gz CWOWVKBKEZKZCR-QGZVFWFLSA-N 0 0 323.484 5.198 20 0 DKADRN CCc1cccnc1[C@H](C)Nc1cccc(OC2CCCC2)c1 ZINC000507472101 340221433 /nfs/dbraw/zinc/22/14/33/340221433.db2.gz DICFUNITIHZZDJ-HNNXBMFYSA-N 0 0 310.441 5.139 20 0 DKADRN CCc1cccnc1[C@@H](C)Nc1cccc(OC2CCCC2)c1 ZINC000507472423 340221536 /nfs/dbraw/zinc/22/15/36/340221536.db2.gz DICFUNITIHZZDJ-OAHLLOKOSA-N 0 0 310.441 5.139 20 0 DKADRN CCc1cccnc1[C@@H](C)Nc1ccc(SC)c(Cl)c1 ZINC000507475780 340221593 /nfs/dbraw/zinc/22/15/93/340221593.db2.gz HTUIKUWZIRUPGB-LLVKDONJSA-N 0 0 306.862 5.192 20 0 DKADRN CCc1cccnc1[C@H](C)Nc1ccc(SC)c(Cl)c1 ZINC000507475782 340221258 /nfs/dbraw/zinc/22/12/58/340221258.db2.gz HTUIKUWZIRUPGB-NSHDSACASA-N 0 0 306.862 5.192 20 0 DKADRN C[C@@H](Nc1ccc(Cl)c(OC(F)F)c1)c1cccs1 ZINC000507477113 340221825 /nfs/dbraw/zinc/22/18/25/340221825.db2.gz KYKWPAPPPJWMSB-MRVPVSSYSA-N 0 0 303.761 5.176 20 0 DKADRN C[C@H](Nc1ccc(Cl)c(OC(F)F)c1)c1cccs1 ZINC000507477114 340221802 /nfs/dbraw/zinc/22/18/02/340221802.db2.gz KYKWPAPPPJWMSB-QMMMGPOBSA-N 0 0 303.761 5.176 20 0 DKADRN C[C@@H](Nc1ccc(F)c(C2CC2)c1)c1ncc(C(C)(C)C)o1 ZINC000507480472 340221833 /nfs/dbraw/zinc/22/18/33/340221833.db2.gz AYLCXDWXYUCOFN-LLVKDONJSA-N 0 0 302.393 5.162 20 0 DKADRN C[C@H](Nc1ccc(F)c(C2CC2)c1)c1ncc(C(C)(C)C)o1 ZINC000507480473 340221939 /nfs/dbraw/zinc/22/19/39/340221939.db2.gz AYLCXDWXYUCOFN-NSHDSACASA-N 0 0 302.393 5.162 20 0 DKADRN CCC(CC)[C@H](NC(=O)c1cc[nH]c1C(C)C)c1cccs1 ZINC000507484245 340222038 /nfs/dbraw/zinc/22/20/38/340222038.db2.gz ZKEJSKAMYUGPJY-KRWDZBQOSA-N 0 0 318.486 5.107 20 0 DKADRN CCC(CC)[C@@H](NC(=O)c1cc[nH]c1C(C)C)c1cccs1 ZINC000507484298 340222025 /nfs/dbraw/zinc/22/20/25/340222025.db2.gz ZKEJSKAMYUGPJY-QGZVFWFLSA-N 0 0 318.486 5.107 20 0 DKADRN CCc1cccnc1[C@H](C)N[C@H](C)c1cccc(Cl)c1Cl ZINC000507486474 340222261 /nfs/dbraw/zinc/22/22/61/340222261.db2.gz OQZYFAHREPVGNV-NEPJUHHUSA-N 0 0 323.267 5.363 20 0 DKADRN CCc1cccnc1[C@@H](C)N[C@@H](C)c1cccc(Cl)c1Cl ZINC000507486477 340222381 /nfs/dbraw/zinc/22/23/81/340222381.db2.gz OQZYFAHREPVGNV-NWDGAFQWSA-N 0 0 323.267 5.363 20 0 DKADRN CCc1cccnc1[C@H](C)N[C@@H](C)c1cccc(Cl)c1Cl ZINC000507486479 340222377 /nfs/dbraw/zinc/22/23/77/340222377.db2.gz OQZYFAHREPVGNV-RYUDHWBXSA-N 0 0 323.267 5.363 20 0 DKADRN CCc1cccnc1[C@@H](C)N[C@H](C)c1cccc(Cl)c1Cl ZINC000507486480 340222368 /nfs/dbraw/zinc/22/23/68/340222368.db2.gz OQZYFAHREPVGNV-VXGBXAGGSA-N 0 0 323.267 5.363 20 0 DKADRN CCc1cccnc1[C@@H](C)Nc1ccc2oc(C(C)(C)C)nc2c1 ZINC000507488559 340222358 /nfs/dbraw/zinc/22/23/58/340222358.db2.gz VDNRZBWKLIKFSW-CYBMUJFWSA-N 0 0 323.440 5.256 20 0 DKADRN CCc1cccnc1[C@H](C)Nc1ccc2oc(C(C)(C)C)nc2c1 ZINC000507488560 340222397 /nfs/dbraw/zinc/22/23/97/340222397.db2.gz VDNRZBWKLIKFSW-ZDUSSCGKSA-N 0 0 323.440 5.256 20 0 DKADRN CCc1cccnc1[C@H](C)Nc1ccc(COC2CCCC2)cc1 ZINC000507498734 340222843 /nfs/dbraw/zinc/22/28/43/340222843.db2.gz WSUWLJBLXDPZJJ-INIZCTEOSA-N 0 0 324.468 5.276 20 0 DKADRN CCc1cccnc1[C@@H](C)Nc1ccc(COC2CCCC2)cc1 ZINC000507498735 340222915 /nfs/dbraw/zinc/22/29/15/340222915.db2.gz WSUWLJBLXDPZJJ-MRXNPFEDSA-N 0 0 324.468 5.276 20 0 DKADRN CCc1cccnc1[C@H](C)Nc1cccc(-c2nc(C)c(C)o2)c1 ZINC000507520023 340224129 /nfs/dbraw/zinc/22/41/29/340224129.db2.gz MLXONZWUAUEJPK-AWEZNQCLSA-N 0 0 321.424 5.089 20 0 DKADRN CCc1cccnc1[C@@H](C)Nc1cccc(-c2nc(C)c(C)o2)c1 ZINC000507520024 340224034 /nfs/dbraw/zinc/22/40/34/340224034.db2.gz MLXONZWUAUEJPK-CQSZACIVSA-N 0 0 321.424 5.089 20 0 DKADRN CCCCOc1ccc(NC(=O)c2sccc2Cl)c(C)c1 ZINC000507540623 340224781 /nfs/dbraw/zinc/22/47/81/340224781.db2.gz XMOCXMYXHDKCET-UHFFFAOYSA-N 0 0 323.845 5.141 20 0 DKADRN C[C@@H](SCc1nc(C(F)(F)F)cs1)c1ccccc1F ZINC000507588134 340225657 /nfs/dbraw/zinc/22/56/57/340225657.db2.gz JKXJFVMIYOBGJY-MRVPVSSYSA-N 0 0 321.364 5.295 20 0 DKADRN C[C@H](SCc1nc(C(F)(F)F)cs1)c1ccccc1F ZINC000507588135 340225604 /nfs/dbraw/zinc/22/56/04/340225604.db2.gz JKXJFVMIYOBGJY-QMMMGPOBSA-N 0 0 321.364 5.295 20 0 DKADRN C[C@H](S[C@@H]1CCc2c1cccc2Cl)c1nc(C2CC2)no1 ZINC000507591526 340225786 /nfs/dbraw/zinc/22/57/86/340225786.db2.gz SAEHVUHUYPPIPG-LKFCYVNXSA-N 0 0 320.845 5.082 20 0 DKADRN C[C@@H](S[C@H]1CCc2c1cccc2Cl)c1nc(C2CC2)no1 ZINC000507591529 340225787 /nfs/dbraw/zinc/22/57/87/340225787.db2.gz SAEHVUHUYPPIPG-OTYXRUKQSA-N 0 0 320.845 5.082 20 0 DKADRN C[C@H](S[C@H]1CCc2c1cccc2Cl)c1nc(C2CC2)no1 ZINC000507591530 340225770 /nfs/dbraw/zinc/22/57/70/340225770.db2.gz SAEHVUHUYPPIPG-XPTSAGLGSA-N 0 0 320.845 5.082 20 0 DKADRN C[C@@H](S[C@@H]1CCc2c1cccc2Cl)c1nc(C2CC2)no1 ZINC000507591531 340225697 /nfs/dbraw/zinc/22/56/97/340225697.db2.gz SAEHVUHUYPPIPG-YMTOWFKASA-N 0 0 320.845 5.082 20 0 DKADRN FC(F)(F)CCCCSCc1cc(-c2cccs2)on1 ZINC000507596089 340225846 /nfs/dbraw/zinc/22/58/46/340225846.db2.gz BDLOQHMOSHAYAI-UHFFFAOYSA-N 0 0 321.389 5.369 20 0 DKADRN FC(F)(F)CCCCSCc1ncc(-c2cccs2)o1 ZINC000507597351 340225919 /nfs/dbraw/zinc/22/59/19/340225919.db2.gz MNPXOPVZYJMLOR-UHFFFAOYSA-N 0 0 321.389 5.369 20 0 DKADRN C[C@@H](SCc1nc(C(F)(F)F)cs1)c1ccc(F)cc1 ZINC000507599796 340225899 /nfs/dbraw/zinc/22/58/99/340225899.db2.gz QUBORVVMNPVJDQ-MRVPVSSYSA-N 0 0 321.364 5.295 20 0 DKADRN C[C@H](SCc1nc(C(F)(F)F)cs1)c1ccc(F)cc1 ZINC000507599799 340225886 /nfs/dbraw/zinc/22/58/86/340225886.db2.gz QUBORVVMNPVJDQ-QMMMGPOBSA-N 0 0 321.364 5.295 20 0 DKADRN COc1cc(CSCCCCC(F)(F)F)ccc1SC ZINC000507600391 340225804 /nfs/dbraw/zinc/22/58/04/340225804.db2.gz NYJSZFMRWQUXMI-UHFFFAOYSA-N 0 0 324.433 5.383 20 0 DKADRN C[C@@H](SCc1nc(C(F)(F)F)cs1)c1cccc(F)c1 ZINC000507605940 340225946 /nfs/dbraw/zinc/22/59/46/340225946.db2.gz BXPIWFUPBUHTDA-MRVPVSSYSA-N 0 0 321.364 5.295 20 0 DKADRN C[C@H](SCc1nc(C(F)(F)F)cs1)c1cccc(F)c1 ZINC000507605944 340226048 /nfs/dbraw/zinc/22/60/48/340226048.db2.gz BXPIWFUPBUHTDA-QMMMGPOBSA-N 0 0 321.364 5.295 20 0 DKADRN FC(F)(F)CCCCSCc1nc2ccccc2s1 ZINC000507609936 340226180 /nfs/dbraw/zinc/22/61/80/340226180.db2.gz RJPUIOLOOZYTGN-UHFFFAOYSA-N 0 0 305.390 5.262 20 0 DKADRN C[C@@H](SCc1nc(C(F)(F)F)cs1)c1ccccc1 ZINC000507610751 340226082 /nfs/dbraw/zinc/22/60/82/340226082.db2.gz WWZKLPJROUCVEY-SECBINFHSA-N 0 0 303.374 5.156 20 0 DKADRN C[C@H](SCc1nc(C(F)(F)F)cs1)c1ccccc1 ZINC000507610752 340226230 /nfs/dbraw/zinc/22/62/30/340226230.db2.gz WWZKLPJROUCVEY-VIFPVBQESA-N 0 0 303.374 5.156 20 0 DKADRN FC(F)(F)CCCCSCc1cc(-c2ccccc2)no1 ZINC000507611344 340226344 /nfs/dbraw/zinc/22/63/44/340226344.db2.gz ZPUSDTVZFZHLOO-UHFFFAOYSA-N 0 0 315.360 5.307 20 0 DKADRN FC(F)(F)CCCCSCc1csc(-c2ccco2)n1 ZINC000507613291 340226279 /nfs/dbraw/zinc/22/62/79/340226279.db2.gz AYSDXTZZEARYJB-UHFFFAOYSA-N 0 0 321.389 5.369 20 0 DKADRN FC(F)(F)CCCCSCc1ncc(-c2ccccc2)o1 ZINC000507616349 340226426 /nfs/dbraw/zinc/22/64/26/340226426.db2.gz NLRRSKYDCHUJJN-UHFFFAOYSA-N 0 0 315.360 5.307 20 0 DKADRN FC(F)(F)CCCCSCc1coc(-c2ccccc2)n1 ZINC000507628744 340226942 /nfs/dbraw/zinc/22/69/42/340226942.db2.gz VGMBPPWCIVVMBO-UHFFFAOYSA-N 0 0 315.360 5.307 20 0 DKADRN FC(F)(F)CCCCSCc1cc(-c2ccccc2)on1 ZINC000507629126 340226948 /nfs/dbraw/zinc/22/69/48/340226948.db2.gz WNGZZIMPECDNGZ-UHFFFAOYSA-N 0 0 315.360 5.307 20 0 DKADRN Fc1cc2cccnc2c(CSCCCCC(F)(F)F)c1 ZINC000507631855 340226929 /nfs/dbraw/zinc/22/69/29/340226929.db2.gz ATCOYMQOEUGMKE-UHFFFAOYSA-N 0 0 317.351 5.340 20 0 DKADRN CCC(CC)n1ccc(CSCCCCC(F)(F)F)n1 ZINC000507645399 340227116 /nfs/dbraw/zinc/22/71/16/340227116.db2.gz SQUFUDUBBHTKRJ-UHFFFAOYSA-N 0 0 308.413 5.210 20 0 DKADRN FC(F)(F)CCCCSCc1coc(-c2cccs2)n1 ZINC000507646237 340227115 /nfs/dbraw/zinc/22/71/15/340227115.db2.gz WYRNXPQVUUWKDJ-UHFFFAOYSA-N 0 0 321.389 5.369 20 0 DKADRN FC(F)(F)CCCCSCc1noc(C2CCCCC2)n1 ZINC000507646743 340227121 /nfs/dbraw/zinc/22/71/21/340227121.db2.gz ZQOCTDNYTFKMSM-UHFFFAOYSA-N 0 0 322.396 5.083 20 0 DKADRN FC(F)c1csc(COc2ccccc2-c2ccccc2)n1 ZINC000507690823 340228393 /nfs/dbraw/zinc/22/83/93/340228393.db2.gz AWSTWPZOELBQTE-UHFFFAOYSA-N 0 0 317.360 5.327 20 0 DKADRN Cc1csc(Nc2ccc(-c3nc(C(F)F)cs3)cc2)n1 ZINC000507693630 340228566 /nfs/dbraw/zinc/22/85/66/340228566.db2.gz LOTYEJUMLNEQFW-UHFFFAOYSA-N 0 0 323.393 5.256 20 0 DKADRN CC[C@H](C)N(Cc1csc(C(C)C)n1)Cc1ccccc1 ZINC000507700911 340228739 /nfs/dbraw/zinc/22/87/39/340228739.db2.gz YJDWCOFPSOBJAR-HNNXBMFYSA-N 0 0 302.487 5.067 20 0 DKADRN CC[C@@H](C)N(Cc1csc(C(C)C)n1)Cc1ccccc1 ZINC000507700913 340228807 /nfs/dbraw/zinc/22/88/07/340228807.db2.gz YJDWCOFPSOBJAR-OAHLLOKOSA-N 0 0 302.487 5.067 20 0 DKADRN c1ccc2cc(-c3nc(-c4nccc5ccccc54)no3)ccc2c1 ZINC000507708544 340229141 /nfs/dbraw/zinc/22/91/41/340229141.db2.gz NFNMSWOVLLXISA-UHFFFAOYSA-N 0 0 323.355 5.105 20 0 DKADRN CC(C)c1nc(CSCCCCC2CCOCC2)cs1 ZINC000507711858 340229161 /nfs/dbraw/zinc/22/91/61/340229161.db2.gz ZWTDPXUYVIPRLQ-UHFFFAOYSA-N 0 0 313.532 5.097 20 0 DKADRN CCN(Cc1coc(-c2ccccc2)n1)[C@@H](C)c1ccc(F)cc1 ZINC000507718761 340229437 /nfs/dbraw/zinc/22/94/37/340229437.db2.gz PXWLZBTVXGJQMD-HNNXBMFYSA-N 0 0 324.399 5.064 20 0 DKADRN CC(=O)Nc1cccc(CS[C@H](C)c2ccc(Cl)cc2)c1 ZINC000507722717 340229617 /nfs/dbraw/zinc/22/96/17/340229617.db2.gz DBDLWTBTQYUSIR-GFCCVEGCSA-N 0 0 319.857 5.293 20 0 DKADRN CC(=O)Nc1cccc(CS[C@@H](C)c2ccc(Cl)cc2)c1 ZINC000507722724 340229570 /nfs/dbraw/zinc/22/95/70/340229570.db2.gz DBDLWTBTQYUSIR-LBPRGKRZSA-N 0 0 319.857 5.293 20 0 DKADRN CC(=O)Nc1cccc(CS[C@H](C)c2cccc(Cl)c2)c1 ZINC000507723376 340229686 /nfs/dbraw/zinc/22/96/86/340229686.db2.gz GJNBCEGHNBIZPA-GFCCVEGCSA-N 0 0 319.857 5.293 20 0 DKADRN CC(=O)Nc1cccc(CS[C@@H](C)c2cccc(Cl)c2)c1 ZINC000507723377 340229608 /nfs/dbraw/zinc/22/96/08/340229608.db2.gz GJNBCEGHNBIZPA-LBPRGKRZSA-N 0 0 319.857 5.293 20 0 DKADRN CC(=O)Nc1cccc(CS[C@H](C)c2ccccc2Cl)c1 ZINC000507726206 340229664 /nfs/dbraw/zinc/22/96/64/340229664.db2.gz OLPDEHQIADQLKZ-GFCCVEGCSA-N 0 0 319.857 5.293 20 0 DKADRN CC(=O)Nc1cccc(CS[C@@H](C)c2ccccc2Cl)c1 ZINC000507726209 340229612 /nfs/dbraw/zinc/22/96/12/340229612.db2.gz OLPDEHQIADQLKZ-LBPRGKRZSA-N 0 0 319.857 5.293 20 0 DKADRN CCc1cccc(CC(=O)Nc2ccccc2-c2cccs2)c1 ZINC000507729158 340229773 /nfs/dbraw/zinc/22/97/73/340229773.db2.gz ZLEJHGLSWQSKFP-UHFFFAOYSA-N 0 0 321.445 5.159 20 0 DKADRN C[C@@H](SCCC(=O)Nc1ccccc1)c1ccccc1Cl ZINC000507730760 340229817 /nfs/dbraw/zinc/22/98/17/340229817.db2.gz KDHFIJOJUWBILB-CYBMUJFWSA-N 0 0 319.857 5.163 20 0 DKADRN C[C@H](SCCC(=O)Nc1ccccc1)c1ccccc1Cl ZINC000507730763 340229752 /nfs/dbraw/zinc/22/97/52/340229752.db2.gz KDHFIJOJUWBILB-ZDUSSCGKSA-N 0 0 319.857 5.163 20 0 DKADRN CCCOc1ccc(NC(=O)c2cc(C(C)C)oc2C)c(C)c1 ZINC000507732511 340229951 /nfs/dbraw/zinc/22/99/51/340229951.db2.gz NIQWFCMWGAZPHM-UHFFFAOYSA-N 0 0 315.413 5.061 20 0 DKADRN CCc1ccc2occ(C(=O)Nc3c(C)cc(C)cc3C)c2c1 ZINC000507733836 340229895 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C[C@H](SCc1csc(-c2ccco2)n1)c1ccccc1F ZINC000507868255 340234681 /nfs/dbraw/zinc/23/46/81/340234681.db2.gz XEUKIDQLXBYLIF-NSHDSACASA-N 0 0 319.426 5.537 20 0 DKADRN C[C@@H](SCc1nc(C2CC2)no1)c1ccc(C(C)(C)C)cc1 ZINC000507869737 340234778 /nfs/dbraw/zinc/23/47/78/340234778.db2.gz DHYPETWNLYPZAU-GFCCVEGCSA-N 0 0 316.470 5.239 20 0 DKADRN C[C@H](SCc1nc(C2CC2)no1)c1ccc(C(C)(C)C)cc1 ZINC000507869738 340234723 /nfs/dbraw/zinc/23/47/23/340234723.db2.gz DHYPETWNLYPZAU-LBPRGKRZSA-N 0 0 316.470 5.239 20 0 DKADRN C[C@@H](CCc1ccccc1)S[C@@H](C)c1nc(C(C)(C)C)no1 ZINC000507870473 340234684 /nfs/dbraw/zinc/23/46/84/340234684.db2.gz PSSZUTHFJOTSNK-KBPBESRZSA-N 0 0 318.486 5.183 20 0 DKADRN C[C@H](CCc1ccccc1)S[C@@H](C)c1nc(C(C)(C)C)no1 ZINC000507870474 340234725 /nfs/dbraw/zinc/23/47/25/340234725.db2.gz PSSZUTHFJOTSNK-KGLIPLIRSA-N 0 0 318.486 5.183 20 0 DKADRN C[C@@H](S[C@@H](C)CCc1ccccc1)c1nc(C(C)(C)C)no1 ZINC000507870475 340234675 /nfs/dbraw/zinc/23/46/75/340234675.db2.gz PSSZUTHFJOTSNK-UONOGXRCSA-N 0 0 318.486 5.183 20 0 DKADRN C[C@H](CCc1ccccc1)S[C@H](C)c1nc(C(C)(C)C)no1 ZINC000507870476 340234680 /nfs/dbraw/zinc/23/46/80/340234680.db2.gz PSSZUTHFJOTSNK-ZIAGYGMSSA-N 0 0 318.486 5.183 20 0 DKADRN C[C@H](SCc1cccc(Cl)c1)c1nc(C(C)(C)C)no1 ZINC000507870834 340234707 /nfs/dbraw/zinc/23/47/07/340234707.db2.gz SRWPUSKEJXWLIT-JTQLQIEISA-N 0 0 310.850 5.015 20 0 DKADRN C[C@@H](SCc1cccc(Cl)c1)c1nc(C(C)(C)C)no1 ZINC000507870835 340234769 /nfs/dbraw/zinc/23/47/69/340234769.db2.gz SRWPUSKEJXWLIT-SNVBAGLBSA-N 0 0 310.850 5.015 20 0 DKADRN Cc1cc(CS[C@H](C)c2nc(C(C)(C)C)no2)c(C)s1 ZINC000507871966 340234777 /nfs/dbraw/zinc/23/47/77/340234777.db2.gz XQCCZGBGYSAQSO-LLVKDONJSA-N 0 0 310.488 5.040 20 0 DKADRN Cc1cc(CS[C@@H](C)c2nc(C(C)(C)C)no2)c(C)s1 ZINC000507871969 340234719 /nfs/dbraw/zinc/23/47/19/340234719.db2.gz XQCCZGBGYSAQSO-NSHDSACASA-N 0 0 310.488 5.040 20 0 DKADRN CCCc1nc(CS[C@H](C)c2ccc3ccccc3c2)no1 ZINC000507879930 340235065 /nfs/dbraw/zinc/23/50/65/340235065.db2.gz MLPJDANWUKPMKA-CYBMUJFWSA-N 0 0 312.438 5.170 20 0 DKADRN CCCc1nc(CS[C@@H](C)c2ccc3ccccc3c2)no1 ZINC000507879932 340235064 /nfs/dbraw/zinc/23/50/64/340235064.db2.gz MLPJDANWUKPMKA-ZDUSSCGKSA-N 0 0 312.438 5.170 20 0 DKADRN CC(C)c1noc([C@H](C)S[C@@H](C)CCc2ccccc2)n1 ZINC000507880819 340235128 /nfs/dbraw/zinc/23/51/28/340235128.db2.gz QSMCCPUSBBSBEX-KBPBESRZSA-N 0 0 304.459 5.009 20 0 DKADRN CC(C)c1noc([C@H](C)S[C@H](C)CCc2ccccc2)n1 ZINC000507880820 340235112 /nfs/dbraw/zinc/23/51/12/340235112.db2.gz QSMCCPUSBBSBEX-KGLIPLIRSA-N 0 0 304.459 5.009 20 0 DKADRN CC(C)c1noc([C@@H](C)S[C@@H](C)CCc2ccccc2)n1 ZINC000507880821 340235022 /nfs/dbraw/zinc/23/50/22/340235022.db2.gz QSMCCPUSBBSBEX-UONOGXRCSA-N 0 0 304.459 5.009 20 0 DKADRN CC(C)c1noc([C@@H](C)S[C@H](C)CCc2ccccc2)n1 ZINC000507880822 340234974 /nfs/dbraw/zinc/23/49/74/340234974.db2.gz QSMCCPUSBBSBEX-ZIAGYGMSSA-N 0 0 304.459 5.009 20 0 DKADRN Cc1cc(CSCc2sc3ccccc3c2Cl)no1 ZINC000507881409 340234976 /nfs/dbraw/zinc/23/49/76/340234976.db2.gz RTECAVRULAUNHJ-UHFFFAOYSA-N 0 0 309.843 5.285 20 0 DKADRN CC(C)c1noc([C@@H](C)SCc2ccc(C(C)C)cc2)n1 ZINC000507881746 340235079 /nfs/dbraw/zinc/23/50/79/340235079.db2.gz WQPNMOSOHJUZJN-CYBMUJFWSA-N 0 0 304.459 5.311 20 0 DKADRN CC(C)c1noc([C@H](C)SCc2ccc(C(C)C)cc2)n1 ZINC000507881747 340235071 /nfs/dbraw/zinc/23/50/71/340235071.db2.gz WQPNMOSOHJUZJN-ZDUSSCGKSA-N 0 0 304.459 5.311 20 0 DKADRN C[C@@H](S[C@H](C)c1ccc(Cl)cc1)c1nc(C2CC2)no1 ZINC000507883914 340235270 /nfs/dbraw/zinc/23/52/70/340235270.db2.gz DXUSKIZRSLDRCH-NXEZZACHSA-N 0 0 308.834 5.156 20 0 DKADRN C[C@H](S[C@@H](C)c1ccc(Cl)cc1)c1nc(C2CC2)no1 ZINC000507883915 340235159 /nfs/dbraw/zinc/23/51/59/340235159.db2.gz DXUSKIZRSLDRCH-UWVGGRQHSA-N 0 0 308.834 5.156 20 0 DKADRN C[C@@H](S[C@@H](C)c1nc(C2CC2)no1)c1ccc(Cl)cc1 ZINC000507883916 340235259 /nfs/dbraw/zinc/23/52/59/340235259.db2.gz DXUSKIZRSLDRCH-ZJUUUORDSA-N 0 0 308.834 5.156 20 0 DKADRN Cc1nc2ccccc2nc1CS[C@H](C)c1ccccc1F ZINC000507883964 340235276 /nfs/dbraw/zinc/23/52/76/340235276.db2.gz FKAMHJAMVXFWTD-CYBMUJFWSA-N 0 0 312.413 5.072 20 0 DKADRN Cc1nc2ccccc2nc1CS[C@@H](C)c1ccccc1F ZINC000507883965 340235221 /nfs/dbraw/zinc/23/52/21/340235221.db2.gz FKAMHJAMVXFWTD-ZDUSSCGKSA-N 0 0 312.413 5.072 20 0 DKADRN C[C@H](SCc1cc(-c2ccco2)on1)c1ccc(F)cc1F ZINC000507889243 340235148 /nfs/dbraw/zinc/23/51/48/340235148.db2.gz ALEWQUMTWIMUCI-JTQLQIEISA-N 0 0 321.348 5.207 20 0 DKADRN C[C@@H](SCc1cc(-c2ccco2)on1)c1ccc(F)cc1F ZINC000507889248 340235260 /nfs/dbraw/zinc/23/52/60/340235260.db2.gz ALEWQUMTWIMUCI-SNVBAGLBSA-N 0 0 321.348 5.207 20 0 DKADRN C[C@@H](SCc1cc(-c2ccco2)on1)c1cccc(F)c1 ZINC000507889455 340235187 /nfs/dbraw/zinc/23/51/87/340235187.db2.gz AZAICVVQCJPKQP-LLVKDONJSA-N 0 0 303.358 5.068 20 0 DKADRN C[C@H](SCc1cc(-c2ccco2)on1)c1cccc(F)c1 ZINC000507889457 340235176 /nfs/dbraw/zinc/23/51/76/340235176.db2.gz AZAICVVQCJPKQP-NSHDSACASA-N 0 0 303.358 5.068 20 0 DKADRN C[C@@H](S[C@H](C)c1cccc(Cl)c1)c1nc(C2CC2)no1 ZINC000507890144 340235174 /nfs/dbraw/zinc/23/51/74/340235174.db2.gz CFVKNQMXAFBGLY-NXEZZACHSA-N 0 0 308.834 5.156 20 0 DKADRN C[C@H](S[C@@H](C)c1cccc(Cl)c1)c1nc(C2CC2)no1 ZINC000507890147 340235185 /nfs/dbraw/zinc/23/51/85/340235185.db2.gz CFVKNQMXAFBGLY-UWVGGRQHSA-N 0 0 308.834 5.156 20 0 DKADRN C[C@@H](S[C@@H](C)c1cccc(Cl)c1)c1nc(C2CC2)no1 ZINC000507890151 340235140 /nfs/dbraw/zinc/23/51/40/340235140.db2.gz CFVKNQMXAFBGLY-VHSXEESVSA-N 0 0 308.834 5.156 20 0 DKADRN C[C@@H](S[C@@H](C)c1nc(C2CC2)no1)c1cccc(Cl)c1 ZINC000507890153 340235279 /nfs/dbraw/zinc/23/52/79/340235279.db2.gz CFVKNQMXAFBGLY-ZJUUUORDSA-N 0 0 308.834 5.156 20 0 DKADRN Cc1cc(CSCc2nc3ccccc3nc2C)c(C)s1 ZINC000507892579 340235422 /nfs/dbraw/zinc/23/54/22/340235422.db2.gz HHEMMLAWAYSBKG-UHFFFAOYSA-N 0 0 314.479 5.050 20 0 DKADRN C[C@H](SCc1cc(-c2ccco2)on1)c1ccc(F)c(F)c1 ZINC000507892734 340235406 /nfs/dbraw/zinc/23/54/06/340235406.db2.gz HQOGKKWFOHSTJN-JTQLQIEISA-N 0 0 321.348 5.207 20 0 DKADRN C[C@@H](SCc1cc(-c2ccco2)on1)c1ccc(F)c(F)c1 ZINC000507892737 340235290 /nfs/dbraw/zinc/23/52/90/340235290.db2.gz HQOGKKWFOHSTJN-SNVBAGLBSA-N 0 0 321.348 5.207 20 0 DKADRN C[C@H](SCc1cc(-c2ccco2)on1)c1cc(F)ccc1F ZINC000507894290 340235389 /nfs/dbraw/zinc/23/53/89/340235389.db2.gz KRFLHEPSJOYEFS-JTQLQIEISA-N 0 0 321.348 5.207 20 0 DKADRN C[C@@H](SCc1cc(-c2ccco2)on1)c1cc(F)ccc1F ZINC000507894292 340235286 /nfs/dbraw/zinc/23/52/86/340235286.db2.gz KRFLHEPSJOYEFS-SNVBAGLBSA-N 0 0 321.348 5.207 20 0 DKADRN C[C@H](SCc1cc(-c2ccco2)on1)c1c(F)cccc1F ZINC000507895578 340235415 /nfs/dbraw/zinc/23/54/15/340235415.db2.gz OVDRRZGYHVEUSV-JTQLQIEISA-N 0 0 321.348 5.207 20 0 DKADRN C[C@@H](SCc1cc(-c2ccco2)on1)c1c(F)cccc1F ZINC000507895579 340235305 /nfs/dbraw/zinc/23/53/05/340235305.db2.gz OVDRRZGYHVEUSV-SNVBAGLBSA-N 0 0 321.348 5.207 20 0 DKADRN C[C@@H](SCc1cc(-c2ccco2)on1)c1ccc(F)cc1 ZINC000507897901 340235518 /nfs/dbraw/zinc/23/55/18/340235518.db2.gz XDSOLUXTVOKKIY-LLVKDONJSA-N 0 0 303.358 5.068 20 0 DKADRN C[C@H](SCc1cc(-c2ccco2)on1)c1ccc(F)cc1 ZINC000507897903 340235561 /nfs/dbraw/zinc/23/55/61/340235561.db2.gz XDSOLUXTVOKKIY-NSHDSACASA-N 0 0 303.358 5.068 20 0 DKADRN Cc1cc(SCc2cc(-c3ccco3)on2)c2ccccc2n1 ZINC000507898182 340235556 /nfs/dbraw/zinc/23/55/56/340235556.db2.gz YJHZXWIGVVLSBG-UHFFFAOYSA-N 0 0 322.389 5.084 20 0 DKADRN Cc1ccc2nc(C)c(C(=O)N(C(C)C)C3CCCCC3)cc2c1 ZINC000507899581 340235545 /nfs/dbraw/zinc/23/55/45/340235545.db2.gz XTPLCIXXVDOUGX-UHFFFAOYSA-N 0 0 324.468 5.035 20 0 DKADRN CC(C)N(C(=O)c1cc2ccccc2s1)C1CCCCC1 ZINC000507900059 340235511 /nfs/dbraw/zinc/23/55/11/340235511.db2.gz FDEPYXJFEJLRRO-UHFFFAOYSA-N 0 0 301.455 5.085 20 0 DKADRN CC(C)N(C(=O)c1cc2cc(Cl)ccc2o1)C1CCCCC1 ZINC000507902094 340235543 /nfs/dbraw/zinc/23/55/43/340235543.db2.gz NDCMGCVCPLDMRJ-UHFFFAOYSA-N 0 0 319.832 5.270 20 0 DKADRN CCC(CC)[C@H](NC(=O)c1ccoc1C1CC1)c1cccs1 ZINC000507902787 340235498 /nfs/dbraw/zinc/23/54/98/340235498.db2.gz PTRBANHISJMXPB-INIZCTEOSA-N 0 0 317.454 5.126 20 0 DKADRN CCC(CC)[C@@H](NC(=O)c1ccoc1C1CC1)c1cccs1 ZINC000507902791 340235488 /nfs/dbraw/zinc/23/54/88/340235488.db2.gz PTRBANHISJMXPB-MRXNPFEDSA-N 0 0 317.454 5.126 20 0 DKADRN CC(C)N(C(=O)c1cccc(Cl)c1Cl)C1CCCCC1 ZINC000507909882 340235738 /nfs/dbraw/zinc/23/57/38/340235738.db2.gz GSQHCXJQNFKUEQ-UHFFFAOYSA-N 0 0 314.256 5.177 20 0 DKADRN CC(C)N(C(=O)c1ccc(Cl)c(Cl)c1)C1CCCCC1 ZINC000507923581 340235839 /nfs/dbraw/zinc/23/58/39/340235839.db2.gz YKGZMOONCCQHRS-UHFFFAOYSA-N 0 0 314.256 5.177 20 0 DKADRN Cc1ccsc1C[NH2+]Cc1ccc(Oc2ccccc2)cc1 ZINC000507928622 340236035 /nfs/dbraw/zinc/23/60/35/340236035.db2.gz FASFITVUNONRKA-UHFFFAOYSA-N 0 0 309.434 5.139 20 0 DKADRN Cc1cc(Cl)c(NC(=O)c2cc(F)ccc2C)cc1Cl ZINC000507964454 340236602 /nfs/dbraw/zinc/23/66/02/340236602.db2.gz HVNYLKXYPMHICX-UHFFFAOYSA-N 0 0 312.171 5.002 20 0 DKADRN CCc1cc(C)c(C(=O)Nc2cc(Cl)c(C)cc2Cl)o1 ZINC000507965552 340236663 /nfs/dbraw/zinc/23/66/63/340236663.db2.gz KMFZRIZBVGHJPA-UHFFFAOYSA-N 0 0 312.196 5.018 20 0 DKADRN Cc1cc(Cl)c(NC(=O)[C@H](C)c2cccs2)cc1Cl ZINC000507966220 340236635 /nfs/dbraw/zinc/23/66/35/340236635.db2.gz WTBPDDFWBPMNGN-SECBINFHSA-N 0 0 314.237 5.106 20 0 DKADRN Cc1cc(Cl)c(NC(=O)[C@@H](C)c2cccs2)cc1Cl ZINC000507966222 340236607 /nfs/dbraw/zinc/23/66/07/340236607.db2.gz WTBPDDFWBPMNGN-VIFPVBQESA-N 0 0 314.237 5.106 20 0 DKADRN CCc1ccsc1C(=O)Nc1cc(Cl)c(C)cc1Cl ZINC000507975080 340236792 /nfs/dbraw/zinc/23/67/92/340236792.db2.gz OIYWPQRLZPDFMY-UHFFFAOYSA-N 0 0 314.237 5.178 20 0 DKADRN Cc1cc(Cl)c(NC(=O)[C@H](C)c2ccsc2)cc1Cl ZINC000507982003 340236716 /nfs/dbraw/zinc/23/67/16/340236716.db2.gz OIKRKUUWIJOTOE-SECBINFHSA-N 0 0 314.237 5.106 20 0 DKADRN Cc1cc(Cl)c(NC(=O)[C@@H](C)c2ccsc2)cc1Cl ZINC000507982004 340236804 /nfs/dbraw/zinc/23/68/04/340236804.db2.gz OIKRKUUWIJOTOE-VIFPVBQESA-N 0 0 314.237 5.106 20 0 DKADRN CCc1nc(CNC(CC)(CC)c2ccc(Cl)cc2)cs1 ZINC000507986932 340236918 /nfs/dbraw/zinc/23/69/18/340236918.db2.gz WFFQXGIAGPTZPB-UHFFFAOYSA-N 0 0 322.905 5.164 20 0 DKADRN Cc1cccc(Cl)c1NC(=O)C[C@@H](C)c1ccc(F)cc1F ZINC000508015648 340237395 /nfs/dbraw/zinc/23/73/95/340237395.db2.gz KCSCBOWIRGQTLL-LLVKDONJSA-N 0 0 323.770 5.059 20 0 DKADRN Cc1cccc(Cl)c1NC(=O)C[C@H](C)c1ccc(F)cc1F ZINC000508015651 340237419 /nfs/dbraw/zinc/23/74/19/340237419.db2.gz KCSCBOWIRGQTLL-NSHDSACASA-N 0 0 323.770 5.059 20 0 DKADRN CSc1cccc(F)c1C(=O)Nc1cc(C)c(Cl)c(C)c1 ZINC000508053792 340238423 /nfs/dbraw/zinc/23/84/23/340238423.db2.gz LJKNANDSXSAQDF-UHFFFAOYSA-N 0 0 323.820 5.070 20 0 DKADRN Cc1cc(NC(=O)c2c(F)cccc2Cl)cc(C)c1Cl ZINC000508072238 340238755 /nfs/dbraw/zinc/23/87/55/340238755.db2.gz QFXHCCMQLXZBAS-UHFFFAOYSA-N 0 0 312.171 5.002 20 0 DKADRN Cc1ccc(CN[C@@H](C)c2ccccc2Oc2ccccc2)o1 ZINC000508081309 340238987 /nfs/dbraw/zinc/23/89/87/340238987.db2.gz XTNCCVROSQQSQX-INIZCTEOSA-N 0 0 307.393 5.231 20 0 DKADRN Cc1ccc(CN[C@H](C)c2ccccc2Oc2ccccc2)o1 ZINC000508081312 340238994 /nfs/dbraw/zinc/23/89/94/340238994.db2.gz XTNCCVROSQQSQX-MRXNPFEDSA-N 0 0 307.393 5.231 20 0 DKADRN Cc1ccc(CN(C(=O)Nc2cc(C)cc(C)c2)C(C)C)s1 ZINC000508121433 340239337 /nfs/dbraw/zinc/23/93/37/340239337.db2.gz RFTZIINXNJZSCR-UHFFFAOYSA-N 0 0 316.470 5.116 20 0 DKADRN CCCCCN(C(=O)Nc1c(C)cccc1C(C)C)C(C)C ZINC000508132103 340239577 /nfs/dbraw/zinc/23/95/77/340239577.db2.gz HMENYSTXKXQOFY-UHFFFAOYSA-N 0 0 304.478 5.551 20 0 DKADRN CCc1cccc(NC(=O)N(Cc2ccc(C)s2)C(C)C)c1 ZINC000508138521 340239572 /nfs/dbraw/zinc/23/95/72/340239572.db2.gz VXUPFKXIEWMBHZ-UHFFFAOYSA-N 0 0 316.470 5.061 20 0 DKADRN CCCCCN(C(=O)Nc1c(CC)cccc1CC)C(C)C ZINC000508138627 340239563 /nfs/dbraw/zinc/23/95/63/340239563.db2.gz WEBMWAWFMZEXEA-UHFFFAOYSA-N 0 0 304.478 5.244 20 0 DKADRN Cc1occc1SCc1coc(-c2cccc(Cl)c2)n1 ZINC000508147599 340239715 /nfs/dbraw/zinc/23/97/15/340239715.db2.gz LERKRWRNSDQYEK-UHFFFAOYSA-N 0 0 305.786 5.189 20 0 DKADRN COc1ccc(-c2nc(CSc3ccoc3C)cs2)cc1 ZINC000508148016 340239717 /nfs/dbraw/zinc/23/97/17/340239717.db2.gz GSUBHRVHLSMEIQ-UHFFFAOYSA-N 0 0 317.435 5.012 20 0 DKADRN COc1cccc(-c2nc(CSc3ccoc3C)cs2)c1 ZINC000508148752 340239674 /nfs/dbraw/zinc/23/96/74/340239674.db2.gz HUPHNAOYSYVGFI-UHFFFAOYSA-N 0 0 317.435 5.012 20 0 DKADRN Cc1ccc(CN(C(=O)Nc2ccc(C)c(C)c2)C(C)C)s1 ZINC000508149308 340239709 /nfs/dbraw/zinc/23/97/09/340239709.db2.gz JZMRQYSDPAKLMC-UHFFFAOYSA-N 0 0 316.470 5.116 20 0 DKADRN Cc1occc1SCc1cccc(C(=O)Nc2ccccc2)c1 ZINC000508153211 340239746 /nfs/dbraw/zinc/23/97/46/340239746.db2.gz XZDWSBUWMPMKMC-UHFFFAOYSA-N 0 0 323.417 5.133 20 0 DKADRN CC[C@H](C)CCC(=O)N(Cc1ccco1)Cc1ccc(C)s1 ZINC000508157604 340239830 /nfs/dbraw/zinc/23/98/30/340239830.db2.gz MRZQUKFHBLUVCZ-AWEZNQCLSA-N 0 0 319.470 5.005 20 0 DKADRN CC[C@@H](C)CCC(=O)N(Cc1ccco1)Cc1ccc(C)s1 ZINC000508157612 340239767 /nfs/dbraw/zinc/23/97/67/340239767.db2.gz MRZQUKFHBLUVCZ-CQSZACIVSA-N 0 0 319.470 5.005 20 0 DKADRN Cc1nc(CSc2ccoc2C)oc1-c1ccc(Cl)cc1 ZINC000508167197 340239880 /nfs/dbraw/zinc/23/98/80/340239880.db2.gz WOQBZKBXBZGCIN-UHFFFAOYSA-N 0 0 319.813 5.497 20 0 DKADRN CC(C)Cn1ccc2cc(NC(=O)c3cc[nH]c3C(C)C)ccc21 ZINC000508170976 340239978 /nfs/dbraw/zinc/23/99/78/340239978.db2.gz CAFMTKNFHOTKRG-UHFFFAOYSA-N 0 0 323.440 5.001 20 0 DKADRN Cc1occc1SCc1ncc(-c2cccc(Cl)c2)o1 ZINC000508181127 340240144 /nfs/dbraw/zinc/24/01/44/340240144.db2.gz WHPDVCCQGXYNTO-UHFFFAOYSA-N 0 0 305.786 5.189 20 0 DKADRN CC[C@H](C)c1ccccc1NC(=O)[C@@H](C)Sc1ccoc1C ZINC000508181563 340240169 /nfs/dbraw/zinc/24/01/69/340240169.db2.gz WYEDWPUQWKGCCL-GXTWGEPZSA-N 0 0 317.454 5.221 20 0 DKADRN CC[C@H](C)c1ccccc1NC(=O)[C@H](C)Sc1ccoc1C ZINC000508181564 340240121 /nfs/dbraw/zinc/24/01/21/340240121.db2.gz WYEDWPUQWKGCCL-JSGCOSHPSA-N 0 0 317.454 5.221 20 0 DKADRN CC[C@@H](C)c1ccccc1NC(=O)[C@H](C)Sc1ccoc1C ZINC000508181565 340240158 /nfs/dbraw/zinc/24/01/58/340240158.db2.gz WYEDWPUQWKGCCL-OCCSQVGLSA-N 0 0 317.454 5.221 20 0 DKADRN CC[C@@H](C)c1ccccc1NC(=O)[C@@H](C)Sc1ccoc1C ZINC000508181566 340240209 /nfs/dbraw/zinc/24/02/09/340240209.db2.gz WYEDWPUQWKGCCL-TZMCWYRMSA-N 0 0 317.454 5.221 20 0 DKADRN Cc1ccccc1[C@H]1CCN(C(=O)Nc2ccccc2C(C)C)C1 ZINC000508210005 340240592 /nfs/dbraw/zinc/24/05/92/340240592.db2.gz GRRKSFPEZIQZEX-KRWDZBQOSA-N 0 0 322.452 5.140 20 0 DKADRN Cc1ccccc1[C@@H]1CCN(C(=O)Nc2ccccc2C(C)C)C1 ZINC000508210006 340240661 /nfs/dbraw/zinc/24/06/61/340240661.db2.gz GRRKSFPEZIQZEX-QGZVFWFLSA-N 0 0 322.452 5.140 20 0 DKADRN Cc1ccccc1[C@@H]1CCN(C(=O)Nc2ccc(C(C)C)cc2)C1 ZINC000508219475 340240844 /nfs/dbraw/zinc/24/08/44/340240844.db2.gz RGBUDSVDJIAJHT-GOSISDBHSA-N 0 0 322.452 5.140 20 0 DKADRN Cc1ccccc1[C@H]1CCN(C(=O)Nc2ccc(C(C)C)cc2)C1 ZINC000508219478 340240881 /nfs/dbraw/zinc/24/08/81/340240881.db2.gz RGBUDSVDJIAJHT-SFHVURJKSA-N 0 0 322.452 5.140 20 0 DKADRN Cc1ccccc1[C@@H]1CCN(C(=O)Nc2cccc(C(C)C)c2)C1 ZINC000508235107 340241046 /nfs/dbraw/zinc/24/10/46/340241046.db2.gz NEXLEIKWNMVGIT-GOSISDBHSA-N 0 0 322.452 5.140 20 0 DKADRN Cc1ccccc1[C@H]1CCN(C(=O)Nc2cccc(C(C)C)c2)C1 ZINC000508235110 340241131 /nfs/dbraw/zinc/24/11/31/340241131.db2.gz NEXLEIKWNMVGIT-SFHVURJKSA-N 0 0 322.452 5.140 20 0 DKADRN CC(C)Sc1ccc([C@H](C)NC(=O)Nc2ccccc2)cc1 ZINC000508259541 340241598 /nfs/dbraw/zinc/24/15/98/340241598.db2.gz ZYLXZNULZJVHJW-AWEZNQCLSA-N 0 0 314.454 5.070 20 0 DKADRN CC(C)Sc1ccc([C@@H](C)NC(=O)Nc2ccccc2)cc1 ZINC000508259543 340241504 /nfs/dbraw/zinc/24/15/04/340241504.db2.gz ZYLXZNULZJVHJW-CQSZACIVSA-N 0 0 314.454 5.070 20 0 DKADRN Cc1ccc(NC(=O)N(Cc2ccccc2)CC(C)(C)C)cc1 ZINC000508265370 340241665 /nfs/dbraw/zinc/24/16/65/340241665.db2.gz RVRUVDOTAZXYOT-UHFFFAOYSA-N 0 0 310.441 5.075 20 0 DKADRN CSc1ccccc1[C@H](C)NC(=O)c1sccc1C(C)C ZINC000508288026 340242015 /nfs/dbraw/zinc/24/20/15/340242015.db2.gz WRZDEWAPHDLGBM-LBPRGKRZSA-N 0 0 319.495 5.084 20 0 DKADRN CC(C)CC(CC(C)C)NC(=O)N1CCC[C@H]1c1cccs1 ZINC000508384914 340243136 /nfs/dbraw/zinc/24/31/36/340243136.db2.gz HPYFGGMADLYRMS-INIZCTEOSA-N 0 0 322.518 5.055 20 0 DKADRN CC(C)CC(CC(C)C)NC(=O)N1CCC[C@@H]1c1cccs1 ZINC000508384915 340243137 /nfs/dbraw/zinc/24/31/37/340243137.db2.gz HPYFGGMADLYRMS-MRXNPFEDSA-N 0 0 322.518 5.055 20 0 DKADRN CC(C)CC(CC(C)C)NC(=O)N1CCC[C@H]1c1ccsc1 ZINC000508388618 340243248 /nfs/dbraw/zinc/24/32/48/340243248.db2.gz UIEHKNLMLRLXGW-KRWDZBQOSA-N 0 0 322.518 5.055 20 0 DKADRN CC(C)CC(CC(C)C)NC(=O)N1CCC[C@@H]1c1ccsc1 ZINC000508388620 340243190 /nfs/dbraw/zinc/24/31/90/340243190.db2.gz UIEHKNLMLRLXGW-QGZVFWFLSA-N 0 0 322.518 5.055 20 0 DKADRN Cc1ccc(Cl)cc1C(=O)Nc1ccc(Cl)cc1Cl ZINC000508401198 340243312 /nfs/dbraw/zinc/24/33/12/340243312.db2.gz DKMIOXGIGNGOLC-UHFFFAOYSA-N 0 0 314.599 5.208 20 0 DKADRN Cc1ccccc1NC(=O)Cc1cc2c(ccc3ccccc23)o1 ZINC000508403110 340243304 /nfs/dbraw/zinc/24/33/04/340243304.db2.gz IJYPINFEADWVDX-UHFFFAOYSA-N 0 0 315.372 5.076 20 0 DKADRN CSc1ccc(Cl)cc1NC(=O)c1sccc1Cl ZINC000508426635 340243633 /nfs/dbraw/zinc/24/36/33/340243633.db2.gz PBDQPJQWCJMSOG-UHFFFAOYSA-N 0 0 318.250 5.029 20 0 DKADRN CC(C)CCOc1cccc(NC(=O)c2sccc2Cl)c1 ZINC000508440870 340243851 /nfs/dbraw/zinc/24/38/51/340243851.db2.gz BZERYTIPAKVWHO-UHFFFAOYSA-N 0 0 323.845 5.079 20 0 DKADRN C[C@H](Nc1ccc(NC(=O)CC(C)(C)C)cc1)c1ccccc1 ZINC000508468078 340244243 /nfs/dbraw/zinc/24/42/43/340244243.db2.gz PIXHDYDMQFCCIS-HNNXBMFYSA-N 0 0 310.441 5.234 20 0 DKADRN C[C@@H](Nc1ccc(NC(=O)CC(C)(C)C)cc1)c1ccccc1 ZINC000508468079 340244131 /nfs/dbraw/zinc/24/41/31/340244131.db2.gz PIXHDYDMQFCCIS-OAHLLOKOSA-N 0 0 310.441 5.234 20 0 DKADRN Cc1ccoc1C(=O)Nc1ccc(N[C@@H](C)c2ccccc2)cc1 ZINC000508484281 340244643 /nfs/dbraw/zinc/24/46/43/340244643.db2.gz MEINJRMWEJDDAP-HNNXBMFYSA-N 0 0 320.392 5.013 20 0 DKADRN Cc1ccoc1C(=O)Nc1ccc(N[C@H](C)c2ccccc2)cc1 ZINC000508484283 340244616 /nfs/dbraw/zinc/24/46/16/340244616.db2.gz MEINJRMWEJDDAP-OAHLLOKOSA-N 0 0 320.392 5.013 20 0 DKADRN Cc1c2cc(Cl)ccc2oc1C(=O)Nc1cccc2[nH]ccc21 ZINC000508499322 340244904 /nfs/dbraw/zinc/24/49/04/340244904.db2.gz UHQCVCLMXYDFBR-UHFFFAOYSA-N 0 0 324.767 5.128 20 0 DKADRN CCCOc1ccc(NC(=O)c2cccc(Cl)c2Cl)cc1 ZINC000508502759 340245061 /nfs/dbraw/zinc/24/50/61/340245061.db2.gz LGGIOKKLMAMXHO-UHFFFAOYSA-N 0 0 324.207 5.035 20 0 DKADRN c1coc(-c2nnc(SC3CCCC3)n2C2CCCCC2)c1 ZINC000508508660 340245220 /nfs/dbraw/zinc/24/52/20/340245220.db2.gz HFSPCCVHACORNT-UHFFFAOYSA-N 0 0 317.458 5.078 20 0 DKADRN CCCCC(=O)Nc1ccc(Sc2nc(C)cs2)cc1C ZINC000508508742 340245222 /nfs/dbraw/zinc/24/52/22/340245222.db2.gz HTMIGFLHVBVMPY-UHFFFAOYSA-N 0 0 320.483 5.040 20 0 DKADRN Cc1c(C(=O)Nc2cccc3[nH]ccc32)sc2cccc(F)c12 ZINC000508510070 340245201 /nfs/dbraw/zinc/24/52/01/340245201.db2.gz KLWSWAAMRAFCDJ-UHFFFAOYSA-N 0 0 324.380 5.082 20 0 DKADRN CCCN(CCC)C(=O)N[C@@H](C)c1ccc(SC(C)C)cc1 ZINC000508565674 340246619 /nfs/dbraw/zinc/24/66/19/340246619.db2.gz STUFEQRJTJBJGN-HNNXBMFYSA-N 0 0 322.518 5.080 20 0 DKADRN CCCN(CCC)C(=O)N[C@H](C)c1ccc(SC(C)C)cc1 ZINC000508565677 340246576 /nfs/dbraw/zinc/24/65/76/340246576.db2.gz STUFEQRJTJBJGN-OAHLLOKOSA-N 0 0 322.518 5.080 20 0 DKADRN CCCCN(CC)C(=O)N[C@@H](C)c1ccc(SC(C)C)cc1 ZINC000508566772 340246664 /nfs/dbraw/zinc/24/66/64/340246664.db2.gz WRURHHXSPZYUCL-HNNXBMFYSA-N 0 0 322.518 5.080 20 0 DKADRN CCCCN(CC)C(=O)N[C@H](C)c1ccc(SC(C)C)cc1 ZINC000508566773 340246648 /nfs/dbraw/zinc/24/66/48/340246648.db2.gz WRURHHXSPZYUCL-OAHLLOKOSA-N 0 0 322.518 5.080 20 0 DKADRN CC(C)N(Cc1ccccc1)C(=O)Nc1cccc2c1CCCC2 ZINC000508645562 340249443 /nfs/dbraw/zinc/24/94/43/340249443.db2.gz BJALZDVQSGYROQ-UHFFFAOYSA-N 0 0 322.452 5.008 20 0 DKADRN C[C@@H](c1ccccn1)[N@H+](C)Cc1ccc(-c2ccccc2)s1 ZINC000508649457 340249541 /nfs/dbraw/zinc/24/95/41/340249541.db2.gz QFGHEDSTKRSTBC-HNNXBMFYSA-N 0 0 308.450 5.003 20 0 DKADRN C[C@H](c1ccccn1)[N@H+](C)Cc1ccc(-c2ccccc2)s1 ZINC000508649458 340249554 /nfs/dbraw/zinc/24/95/54/340249554.db2.gz QFGHEDSTKRSTBC-OAHLLOKOSA-N 0 0 308.450 5.003 20 0 DKADRN CC(C)c1cccc(NC(=O)N(Cc2ccccc2)C(C)C)c1 ZINC000508658776 340249802 /nfs/dbraw/zinc/24/98/02/340249802.db2.gz VNEVCFKKAASZJG-UHFFFAOYSA-N 0 0 310.441 5.253 20 0 DKADRN Cc1ccc(NC(=O)N(Cc2ccccc2)C(C)C)c(Cl)c1 ZINC000508677526 340250357 /nfs/dbraw/zinc/25/03/57/340250357.db2.gz ODAZGLPWJNTWTM-UHFFFAOYSA-N 0 0 316.832 5.091 20 0 DKADRN CC1CCC(N(C(=O)c2ccc3ccccc3c2)C2CC2)CC1 ZINC000508702999 340251080 /nfs/dbraw/zinc/25/10/80/340251080.db2.gz GZDVVYUWRSTMGQ-UHFFFAOYSA-N 0 0 307.437 5.023 20 0 DKADRN CCC1CCC(N(C(=O)CCCc2cccs2)C2CC2)CC1 ZINC000508705020 340250978 /nfs/dbraw/zinc/25/09/78/340250978.db2.gz ZUDFQBHZQHUNCL-UHFFFAOYSA-N 0 0 319.514 5.031 20 0 DKADRN CCC1CCC(N(C(=O)c2cc3ccccc3o2)C2CC2)CC1 ZINC000508720149 340251450 /nfs/dbraw/zinc/25/14/50/340251450.db2.gz PQLDTKQEXHZRPD-UHFFFAOYSA-N 0 0 311.425 5.006 20 0 DKADRN CC1CCC(N(C(=O)c2csc3ccccc23)C2CC2)CC1 ZINC000508721126 340251559 /nfs/dbraw/zinc/25/15/59/340251559.db2.gz UZJOXLWJRRLENG-UHFFFAOYSA-N 0 0 313.466 5.085 20 0 DKADRN C(=C\c1ccccc1)\CN(Cc1ccco1)Cc1cccs1 ZINC000508757435 340252548 /nfs/dbraw/zinc/25/25/48/340252548.db2.gz MGLDMUPSCJCZQS-WTKPLQERSA-N 0 0 309.434 5.057 20 0 DKADRN CC(C)c1ccc(CSCc2nnc(-c3ccccc3)o2)cc1 ZINC000508832152 340253886 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317.379 5.141 20 0 DKADRN Cc1ccc(F)c(C(=O)Nc2cccc(Nc3ccccc3)c2)c1 ZINC000511468691 340327800 /nfs/dbraw/zinc/32/78/00/340327800.db2.gz AEXSVCZMJFEUPW-UHFFFAOYSA-N 0 0 320.367 5.130 20 0 DKADRN CCC1CCC(N(C(=O)c2cccc(C(F)F)c2)C2CC2)CC1 ZINC000511478591 340328063 /nfs/dbraw/zinc/32/80/63/340328063.db2.gz OZCHLHDVYNZBLF-UHFFFAOYSA-N 0 0 321.411 5.198 20 0 DKADRN CC[C@@H](c1ccccc1)N(CC)C(=O)c1cccc(C(F)F)c1 ZINC000511487129 340328383 /nfs/dbraw/zinc/32/83/83/340328383.db2.gz JWUVMYNPRVAQFF-KRWDZBQOSA-N 0 0 317.379 5.238 20 0 DKADRN CC[C@H](c1ccccc1)N(CC)C(=O)c1cccc(C(F)F)c1 ZINC000511487130 340328389 /nfs/dbraw/zinc/32/83/89/340328389.db2.gz JWUVMYNPRVAQFF-QGZVFWFLSA-N 0 0 317.379 5.238 20 0 DKADRN C[C@H](c1cccc(Cl)c1)N(C)C(=O)c1cccc(C(F)F)c1 ZINC000511489889 340328409 /nfs/dbraw/zinc/32/84/09/340328409.db2.gz AVTYNEYXQRRVJE-LLVKDONJSA-N 0 0 323.770 5.111 20 0 DKADRN C[C@@H](c1cccc(Cl)c1)N(C)C(=O)c1cccc(C(F)F)c1 ZINC000511489890 340328520 /nfs/dbraw/zinc/32/85/20/340328520.db2.gz AVTYNEYXQRRVJE-NSHDSACASA-N 0 0 323.770 5.111 20 0 DKADRN CCc1ccsc1C(=O)Nc1cccc(Nc2ccccc2)c1 ZINC000511500059 340328570 /nfs/dbraw/zinc/32/85/70/340328570.db2.gz OIHOWJYQFHAKNE-UHFFFAOYSA-N 0 0 322.433 5.306 20 0 DKADRN CCCCN(C(=O)c1cccc(C(F)F)c1)C1CCCCC1 ZINC000511524854 340329414 /nfs/dbraw/zinc/32/94/14/340329414.db2.gz UCUTZOJXFYDBGC-UHFFFAOYSA-N 0 0 309.400 5.199 20 0 DKADRN Cc1cccc([C@H]2CCCN2C(=O)[C@@H](C)CC2CCCCC2)c1 ZINC000511532588 340329699 /nfs/dbraw/zinc/32/96/99/340329699.db2.gz NMKHJSPCAVIMAL-FXAWDEMLSA-N 0 0 313.485 5.265 20 0 DKADRN Cc1cccc([C@@H]2CCCN2C(=O)[C@@H](C)CC2CCCCC2)c1 ZINC000511532592 340329735 /nfs/dbraw/zinc/32/97/35/340329735.db2.gz NMKHJSPCAVIMAL-PXNSSMCTSA-N 0 0 313.485 5.265 20 0 DKADRN Cc1cccc([C@@H]2CCCN2C(=O)[C@H](C)CC2CCCCC2)c1 ZINC000511532593 340329708 /nfs/dbraw/zinc/32/97/08/340329708.db2.gz NMKHJSPCAVIMAL-XLIONFOSSA-N 0 0 313.485 5.265 20 0 DKADRN Cc1cccc([C@H]2CCCN2C(=O)[C@H](C)CC2CCCCC2)c1 ZINC000511532594 340329672 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Cc1ccc(C)c([C@@H](C)N(C)C(=O)c2cccc(C(F)F)c2)c1 ZINC000511545320 340330174 /nfs/dbraw/zinc/33/01/74/340330174.db2.gz KVFCCBNVMKJJRD-CQSZACIVSA-N 0 0 317.379 5.074 20 0 DKADRN c1csc(-c2cc(CSc3cccc4cccnc43)no2)c1 ZINC000511562371 340330696 /nfs/dbraw/zinc/33/06/96/340330696.db2.gz LKFNMCWVIPIBIH-UHFFFAOYSA-N 0 0 324.430 5.244 20 0 DKADRN CC(C)CCN(C(=O)c1cccc(C(F)F)c1)C1CCCC1 ZINC000511569070 340330940 /nfs/dbraw/zinc/33/09/40/340330940.db2.gz ZFAVIBAFUKAUPP-UHFFFAOYSA-N 0 0 309.400 5.055 20 0 DKADRN CC(C)c1ccccc1NC(=O)N(CC1CCCCC1)C1CC1 ZINC000511593116 340331828 /nfs/dbraw/zinc/33/18/28/340331828.db2.gz HVXBCKOXFLLDFK-UHFFFAOYSA-N 0 0 314.473 5.387 20 0 DKADRN CCc1ccccc1NC(=O)N(C)[C@@H](C)c1ccc(C)cc1C ZINC000511595043 340331815 /nfs/dbraw/zinc/33/18/15/340331815.db2.gz DPEIUKIAPNIMLJ-INIZCTEOSA-N 0 0 310.441 5.091 20 0 DKADRN CCc1ccccc1NC(=O)N(C)[C@H](C)c1ccc(C)cc1C ZINC000511595045 340331766 /nfs/dbraw/zinc/33/17/66/340331766.db2.gz DPEIUKIAPNIMLJ-MRXNPFEDSA-N 0 0 310.441 5.091 20 0 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310.441 5.145 20 0 DKADRN Cc1ccc([C@@H](C)N(C)C(=O)Nc2cc(C)ccc2C)c(C)c1 ZINC000511616568 340332661 /nfs/dbraw/zinc/33/26/61/340332661.db2.gz NLNULHQYOSPMKM-QGZVFWFLSA-N 0 0 310.441 5.145 20 0 DKADRN Cc1cc(Cl)c(C(=O)Nc2c(C)cccc2Cl)cc1C ZINC000511617157 340332643 /nfs/dbraw/zinc/33/26/43/340332643.db2.gz QEFZQCKMTIQTJA-UHFFFAOYSA-N 0 0 308.208 5.171 20 0 DKADRN Cc1ccc([C@H](C)N(C)C(=O)Nc2ccc(C)c(C)c2)c(C)c1 ZINC000511618100 340332679 /nfs/dbraw/zinc/33/26/79/340332679.db2.gz WJAFFFNGOYXFPQ-KRWDZBQOSA-N 0 0 310.441 5.145 20 0 DKADRN Cc1ccc([C@@H](C)N(C)C(=O)Nc2ccc(C)c(C)c2)c(C)c1 ZINC000511618101 340332676 /nfs/dbraw/zinc/33/26/76/340332676.db2.gz WJAFFFNGOYXFPQ-QGZVFWFLSA-N 0 0 310.441 5.145 20 0 DKADRN C[C@H](c1ncc(C(C)(C)C)o1)N1CC[C@H]1c1ccc(Cl)cc1 ZINC000511628929 340332941 /nfs/dbraw/zinc/33/29/41/340332941.db2.gz ZKMNEJVAAZRYDR-DOMZBBRYSA-N 0 0 318.848 5.134 20 0 DKADRN C[C@H](c1ncc(C(C)(C)C)o1)N1CC[C@@H]1c1ccc(Cl)cc1 ZINC000511628932 340332890 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C[C@@H](c1ccco1)N(Cc1nc(-c2ccccc2)cs1)C1CC1 ZINC000511748708 340336982 /nfs/dbraw/zinc/33/69/82/340336982.db2.gz SHRHOWCJCFAEIZ-AWEZNQCLSA-N 0 0 324.449 5.129 20 0 DKADRN C[C@H](c1ccco1)N(Cc1nc(-c2ccccc2)cs1)C1CC1 ZINC000511748709 340337015 /nfs/dbraw/zinc/33/70/15/340337015.db2.gz SHRHOWCJCFAEIZ-CQSZACIVSA-N 0 0 324.449 5.129 20 0 DKADRN C[C@@H](c1ccco1)N(Cc1csc(-c2ccccc2)n1)C1CC1 ZINC000511754920 340337309 /nfs/dbraw/zinc/33/73/09/340337309.db2.gz KMHRNSGFQCHDIR-AWEZNQCLSA-N 0 0 324.449 5.129 20 0 DKADRN C[C@H](c1ccco1)N(Cc1csc(-c2ccccc2)n1)C1CC1 ZINC000511754921 340337254 /nfs/dbraw/zinc/33/72/54/340337254.db2.gz KMHRNSGFQCHDIR-CQSZACIVSA-N 0 0 324.449 5.129 20 0 DKADRN C[C@@H](c1ccco1)N(Cc1cnc(-c2ccccc2)s1)C1CC1 ZINC000511763425 340337610 /nfs/dbraw/zinc/33/76/10/340337610.db2.gz SJRWLGPFVIPVBU-AWEZNQCLSA-N 0 0 324.449 5.129 20 0 DKADRN C[C@H](c1ccco1)N(Cc1cnc(-c2ccccc2)s1)C1CC1 ZINC000511763426 340337695 /nfs/dbraw/zinc/33/76/95/340337695.db2.gz SJRWLGPFVIPVBU-CQSZACIVSA-N 0 0 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/nfs/dbraw/zinc/36/05/53/340360553.db2.gz WDQRRWQLMSLLFY-UHFFFAOYSA-N 0 0 315.482 5.566 20 0 DKADRN Cc1cccc(C)c1NC(=O)[C@H](C)SC[C@@H](C)CC(C)C ZINC000512402286 340360585 /nfs/dbraw/zinc/36/05/85/340360585.db2.gz YHULACOHYBDSHF-BBRMVZONSA-N 0 0 307.503 5.046 20 0 DKADRN Cc1cccc(C)c1NC(=O)[C@H](C)SC[C@H](C)CC(C)C ZINC000512402287 340360634 /nfs/dbraw/zinc/36/06/34/340360634.db2.gz YHULACOHYBDSHF-CJNGLKHVSA-N 0 0 307.503 5.046 20 0 DKADRN Cc1cccc(C)c1NC(=O)[C@@H](C)SC[C@H](C)CC(C)C ZINC000512402288 340360604 /nfs/dbraw/zinc/36/06/04/340360604.db2.gz YHULACOHYBDSHF-CZUORRHYSA-N 0 0 307.503 5.046 20 0 DKADRN Cc1cccc(C)c1NC(=O)[C@@H](C)SC[C@@H](C)CC(C)C ZINC000512402289 340360659 /nfs/dbraw/zinc/36/06/59/340360659.db2.gz YHULACOHYBDSHF-XJKSGUPXSA-N 0 0 307.503 5.046 20 0 DKADRN Cc1cccc(Cl)c1NC(=O)CSC[C@H](C)CC(C)C ZINC000512402330 340360660 /nfs/dbraw/zinc/36/06/60/340360660.db2.gz YVZREWGQKMOLBT-GFCCVEGCSA-N 0 0 313.894 5.002 20 0 DKADRN Cc1cccc(Cl)c1NC(=O)CSC[C@@H](C)CC(C)C ZINC000512402331 340360620 /nfs/dbraw/zinc/36/06/20/340360620.db2.gz YVZREWGQKMOLBT-LBPRGKRZSA-N 0 0 313.894 5.002 20 0 DKADRN CC(C)Sc1ccc(C(=O)N(C)[C@H](C)c2cccs2)cc1 ZINC000512413068 340361089 /nfs/dbraw/zinc/36/10/89/340361089.db2.gz SJCAJWZPGMMBRL-CYBMUJFWSA-N 0 0 319.495 5.082 20 0 DKADRN CC(C)Sc1ccc(C(=O)N(C)[C@@H](C)c2cccs2)cc1 ZINC000512413074 340361098 /nfs/dbraw/zinc/36/10/98/340361098.db2.gz SJCAJWZPGMMBRL-ZDUSSCGKSA-N 0 0 319.495 5.082 20 0 DKADRN CCCCCN(C(=O)c1cc(Cl)sc1Cl)C(C)C ZINC000512511620 340364934 /nfs/dbraw/zinc/36/49/34/340364934.db2.gz JNHOTAOLNRDPAH-UHFFFAOYSA-N 0 0 308.274 5.096 20 0 DKADRN CCCCCN(C(=O)c1[nH]c2ccc(F)cc2c1Cl)C(C)C ZINC000512526850 340365523 /nfs/dbraw/zinc/36/55/23/340365523.db2.gz KQVOWRMMAYAXRN-UHFFFAOYSA-N 0 0 324.827 5.001 20 0 DKADRN CCCCCN(C(=O)c1cc2cc(Cl)ccc2o1)C(C)C ZINC000512563927 340367191 /nfs/dbraw/zinc/36/71/91/340367191.db2.gz HJIHZQVWQULJNH-UHFFFAOYSA-N 0 0 307.821 5.127 20 0 DKADRN CC(C)c1[nH]ccc1C(=O)Nc1cccc(Nc2ccccc2)c1 ZINC000512692383 340373309 /nfs/dbraw/zinc/37/33/09/340373309.db2.gz DNZBSRRZVHWQLR-UHFFFAOYSA-N 0 0 319.408 5.134 20 0 DKADRN Cc1ccc(Cl)cc1NC(=O)N1CCC[C@]2(CC=CCC2)C1 ZINC000512717408 340374188 /nfs/dbraw/zinc/37/41/88/340374188.db2.gz XKLRJRHXONJISL-GOSISDBHSA-N 0 0 318.848 5.003 20 0 DKADRN Cc1ccc(Cl)cc1NC(=O)N1CCC[C@@]2(CC=CCC2)C1 ZINC000512717409 340374131 /nfs/dbraw/zinc/37/41/31/340374131.db2.gz XKLRJRHXONJISL-SFHVURJKSA-N 0 0 318.848 5.003 20 0 DKADRN CC[C@@H](NC(=O)Nc1c(C)cccc1C)c1ccc(Cl)s1 ZINC000512717449 340374179 /nfs/dbraw/zinc/37/41/79/340374179.db2.gz YCIAOHANWQEVEG-GFCCVEGCSA-N 0 0 322.861 5.291 20 0 DKADRN CC[C@H](NC(=O)Nc1c(C)cccc1C)c1ccc(Cl)s1 ZINC000512717450 340374111 /nfs/dbraw/zinc/37/41/11/340374111.db2.gz YCIAOHANWQEVEG-LBPRGKRZSA-N 0 0 322.861 5.291 20 0 DKADRN Cc1ccc(NC(=O)N2CCC[C@]3(CC=CCC3)C2)c(Cl)c1 ZINC000512721264 340374398 /nfs/dbraw/zinc/37/43/98/340374398.db2.gz SPHFPSADENFQFV-GOSISDBHSA-N 0 0 318.848 5.003 20 0 DKADRN Cc1ccc(NC(=O)N2CCC[C@@]3(CC=CCC3)C2)c(Cl)c1 ZINC000512721265 340374365 /nfs/dbraw/zinc/37/43/65/340374365.db2.gz SPHFPSADENFQFV-SFHVURJKSA-N 0 0 318.848 5.003 20 0 DKADRN Cc1ccc(-c2cncc(F)c2)cc1NC(=O)C1=CCCCCC1 ZINC000512721546 340374423 /nfs/dbraw/zinc/37/44/23/340374423.db2.gz VYFVAASLCIAXSI-UHFFFAOYSA-N 0 0 324.399 5.025 20 0 DKADRN CC[C@@H](NC(=O)Nc1cccc(C)c1C)c1ccc(Cl)s1 ZINC000512724116 340374539 /nfs/dbraw/zinc/37/45/39/340374539.db2.gz CKUUIHWMRYMHIH-GFCCVEGCSA-N 0 0 322.861 5.291 20 0 DKADRN CC[C@H](NC(=O)Nc1cccc(C)c1C)c1ccc(Cl)s1 ZINC000512724117 340374553 /nfs/dbraw/zinc/37/45/53/340374553.db2.gz CKUUIHWMRYMHIH-LBPRGKRZSA-N 0 0 322.861 5.291 20 0 DKADRN Cc1cc(Cl)ccc1NC(=O)N1CCC[C@]2(CC=CCC2)C1 ZINC000512725960 340374541 /nfs/dbraw/zinc/37/45/41/340374541.db2.gz QTFLFUURRAMDPO-GOSISDBHSA-N 0 0 318.848 5.003 20 0 DKADRN Cc1cc(Cl)ccc1NC(=O)N1CCC[C@@]2(CC=CCC2)C1 ZINC000512725961 340374454 /nfs/dbraw/zinc/37/44/54/340374454.db2.gz QTFLFUURRAMDPO-SFHVURJKSA-N 0 0 318.848 5.003 20 0 DKADRN CC[C@@H](NC(=O)Nc1ccc(C)cc1C)c1ccc(Cl)s1 ZINC000512726316 340374502 /nfs/dbraw/zinc/37/45/02/340374502.db2.gz TXYKXKDVZKFOTC-GFCCVEGCSA-N 0 0 322.861 5.291 20 0 DKADRN CC[C@H](NC(=O)Nc1ccc(C)cc1C)c1ccc(Cl)s1 ZINC000512726318 340374461 /nfs/dbraw/zinc/37/44/61/340374461.db2.gz TXYKXKDVZKFOTC-LBPRGKRZSA-N 0 0 322.861 5.291 20 0 DKADRN CC(C)c1cccc(C(C)C)c1NC(=O)N1CCCCC[C@@H]1C ZINC000512726428 340374616 /nfs/dbraw/zinc/37/46/16/340374616.db2.gz USUKLYCIBWMAFU-INIZCTEOSA-N 0 0 316.489 5.730 20 0 DKADRN CC(C)c1cccc(C(C)C)c1NC(=O)N1CCCCC[C@H]1C ZINC000512726429 340374562 /nfs/dbraw/zinc/37/45/62/340374562.db2.gz USUKLYCIBWMAFU-MRXNPFEDSA-N 0 0 316.489 5.730 20 0 DKADRN CC(C)c1ccc(NC(=O)N2CCC[C@@]3(CC=CCC3)C2)cc1 ZINC000512726450 340374658 /nfs/dbraw/zinc/37/46/58/340374658.db2.gz UWUMIVPDOIAXQM-FQEVSTJZSA-N 0 0 312.457 5.164 20 0 DKADRN CC(C)c1ccc(NC(=O)N2CCC[C@]3(CC=CCC3)C2)cc1 ZINC000512726453 340374563 /nfs/dbraw/zinc/37/45/63/340374563.db2.gz UWUMIVPDOIAXQM-HXUWFJFHSA-N 0 0 312.457 5.164 20 0 DKADRN CC[C@@H](NC(=O)Nc1cc(C)ccc1C)c1ccc(Cl)s1 ZINC000512727690 340374646 /nfs/dbraw/zinc/37/46/46/340374646.db2.gz AHTKPVBPCQGTTI-GFCCVEGCSA-N 0 0 322.861 5.291 20 0 DKADRN CC[C@H](NC(=O)Nc1cc(C)ccc1C)c1ccc(Cl)s1 ZINC000512727692 340374769 /nfs/dbraw/zinc/37/47/69/340374769.db2.gz AHTKPVBPCQGTTI-LBPRGKRZSA-N 0 0 322.861 5.291 20 0 DKADRN C[C@H]1CCCCCN1C(=O)Nc1ccccc1Cc1ccccc1 ZINC000512727993 340374667 /nfs/dbraw/zinc/37/46/67/340374667.db2.gz BTIIFIJTEPJZTM-KRWDZBQOSA-N 0 0 322.452 5.074 20 0 DKADRN C[C@@H]1CCCCCN1C(=O)Nc1ccccc1Cc1ccccc1 ZINC000512727997 340374711 /nfs/dbraw/zinc/37/47/11/340374711.db2.gz BTIIFIJTEPJZTM-QGZVFWFLSA-N 0 0 322.452 5.074 20 0 DKADRN CC(C)c1cccc(NC(=O)N2CCC[C@@]3(CC=CCC3)C2)c1 ZINC000512728858 340374718 /nfs/dbraw/zinc/37/47/18/340374718.db2.gz GTRDSBOPSMHZGI-FQEVSTJZSA-N 0 0 312.457 5.164 20 0 DKADRN CC(C)c1cccc(NC(=O)N2CCC[C@]3(CC=CCC3)C2)c1 ZINC000512728860 340374706 /nfs/dbraw/zinc/37/47/06/340374706.db2.gz GTRDSBOPSMHZGI-HXUWFJFHSA-N 0 0 312.457 5.164 20 0 DKADRN CCN(C(=O)c1cc2c(ccc3ccccc23)[nH]1)C1CCCCC1 ZINC000512731111 340374855 /nfs/dbraw/zinc/37/48/55/340374855.db2.gz QXYFIFKGBQXCPL-UHFFFAOYSA-N 0 0 320.436 5.116 20 0 DKADRN Cc1c(Cl)cccc1NC(=O)N1CCC[C@]2(CC=CCC2)C1 ZINC000512731426 340374803 /nfs/dbraw/zinc/37/48/03/340374803.db2.gz SOHXKTOVUNJTKW-GOSISDBHSA-N 0 0 318.848 5.003 20 0 DKADRN Cc1c(Cl)cccc1NC(=O)N1CCC[C@@]2(CC=CCC2)C1 ZINC000512731427 340374884 /nfs/dbraw/zinc/37/48/84/340374884.db2.gz SOHXKTOVUNJTKW-SFHVURJKSA-N 0 0 318.848 5.003 20 0 DKADRN Cc1cccc(C(C)C)c1NC(=O)NCc1coc2ccccc12 ZINC000512732001 340374860 /nfs/dbraw/zinc/37/48/60/340374860.db2.gz YPYXATXFNJHJSO-UHFFFAOYSA-N 0 0 322.408 5.186 20 0 DKADRN CC(C)(C)c1ccccc1NC(=O)NCc1coc2ccccc12 ZINC000512732963 340374987 /nfs/dbraw/zinc/37/49/87/340374987.db2.gz CQGSIAVGSRAAHE-UHFFFAOYSA-N 0 0 322.408 5.052 20 0 DKADRN Cc1cccc(C)c1NC(=O)N[C@H]1CCCC[C@@H]1c1ccccc1 ZINC000512733205 340374965 /nfs/dbraw/zinc/37/49/65/340374965.db2.gz FDKWAYOHHDYGII-MOPGFXCFSA-N 0 0 322.452 5.151 20 0 DKADRN Cc1cccc(C)c1NC(=O)N[C@H]1CCCC[C@H]1c1ccccc1 ZINC000512733206 340374953 /nfs/dbraw/zinc/37/49/53/340374953.db2.gz FDKWAYOHHDYGII-OALUTQOASA-N 0 0 322.452 5.151 20 0 DKADRN Cc1cccc(C)c1NC(=O)N[C@@H]1CCCC[C@H]1c1ccccc1 ZINC000512733208 340374921 /nfs/dbraw/zinc/37/49/21/340374921.db2.gz FDKWAYOHHDYGII-RBUKOAKNSA-N 0 0 322.452 5.151 20 0 DKADRN Cc1cccc(C)c1NC(=O)N[C@@H]1CCCC[C@@H]1c1ccccc1 ZINC000512733209 340374967 /nfs/dbraw/zinc/37/49/67/340374967.db2.gz FDKWAYOHHDYGII-RTBURBONSA-N 0 0 322.452 5.151 20 0 DKADRN CCc1ccccc1NC(=O)N[C@H](CC)c1ccc(Cl)s1 ZINC000512736141 340375055 /nfs/dbraw/zinc/37/50/55/340375055.db2.gz SQAZEKNWAAKMDC-GFCCVEGCSA-N 0 0 322.861 5.237 20 0 DKADRN CCc1ccccc1NC(=O)N[C@@H](CC)c1ccc(Cl)s1 ZINC000512736143 340374998 /nfs/dbraw/zinc/37/49/98/340374998.db2.gz SQAZEKNWAAKMDC-LBPRGKRZSA-N 0 0 322.861 5.237 20 0 DKADRN CCCC(C)(C)CC(=O)Nc1cc(Cc2ccccn2)ccc1C ZINC000512780494 340377332 /nfs/dbraw/zinc/37/73/32/340377332.db2.gz BGRPFTUVVAEYIZ-UHFFFAOYSA-N 0 0 324.468 5.136 20 0 DKADRN Cc1ccc([C@@H](NCc2cc(F)ccc2F)c2ccccc2)cc1 ZINC000512808260 340378574 /nfs/dbraw/zinc/37/85/74/340378574.db2.gz AFBRGXPPXNWTIQ-NRFANRHFSA-N 0 0 323.386 5.152 20 0 DKADRN Cc1ccc([C@H](NCc2cc(F)ccc2F)c2ccccc2)cc1 ZINC000512808261 340378547 /nfs/dbraw/zinc/37/85/47/340378547.db2.gz AFBRGXPPXNWTIQ-OAQYLSRUSA-N 0 0 323.386 5.152 20 0 DKADRN CCC[C@](C)(CC)C(=O)Nc1cc(Cc2ccccn2)ccc1C ZINC000512827096 340379609 /nfs/dbraw/zinc/37/96/09/340379609.db2.gz JXYFYOINCIBURZ-NRFANRHFSA-N 0 0 324.468 5.136 20 0 DKADRN CCC[C@@](C)(CC)C(=O)Nc1cc(Cc2ccccn2)ccc1C ZINC000512827097 340379521 /nfs/dbraw/zinc/37/95/21/340379521.db2.gz JXYFYOINCIBURZ-OAQYLSRUSA-N 0 0 324.468 5.136 20 0 DKADRN Cc1ccc(Cc2ccccn2)cc1NC(=O)CCCC(C)(C)C ZINC000512844655 340380522 /nfs/dbraw/zinc/38/05/22/340380522.db2.gz IOJWPMKIKUSFBC-UHFFFAOYSA-N 0 0 324.468 5.136 20 0 DKADRN Cc1ccc([C@H]([NH2+]Cc2ccc(OC(C)C)cc2)C2CC2)cc1 ZINC000512849704 340380736 /nfs/dbraw/zinc/38/07/36/340380736.db2.gz PPLCFZYTLOCGGK-NRFANRHFSA-N 0 0 309.453 5.023 20 0 DKADRN Cc1ccc([C@@H]([NH2+]Cc2ccc(OC(C)C)cc2)C2CC2)cc1 ZINC000512849705 340380738 /nfs/dbraw/zinc/38/07/38/340380738.db2.gz PPLCFZYTLOCGGK-OAQYLSRUSA-N 0 0 309.453 5.023 20 0 DKADRN CCCOc1cccc(C[NH2+][C@@H](c2ccc(C)cc2)C2CC2)c1 ZINC000512851631 340380749 /nfs/dbraw/zinc/38/07/49/340380749.db2.gz YUONBWOLINRZPE-NRFANRHFSA-N 0 0 309.453 5.025 20 0 DKADRN CCCOc1cccc(C[NH2+][C@H](c2ccc(C)cc2)C2CC2)c1 ZINC000512851634 340380717 /nfs/dbraw/zinc/38/07/17/340380717.db2.gz YUONBWOLINRZPE-OAQYLSRUSA-N 0 0 309.453 5.025 20 0 DKADRN Cc1cc(C(=O)Nc2ccc(C(C)C)cc2C(C)C)c(C)n1C ZINC000512882597 340382380 /nfs/dbraw/zinc/38/23/80/340382380.db2.gz CKGIOKDWLUBPTR-UHFFFAOYSA-N 0 0 312.457 5.141 20 0 DKADRN CC(C)c1ccc(NC(=O)c2cccc3[nH]ncc32)c(C(C)C)c1 ZINC000512883394 340382349 /nfs/dbraw/zinc/38/23/49/340382349.db2.gz MZQLBRZKNKFSIP-UHFFFAOYSA-N 0 0 321.424 5.062 20 0 DKADRN Cc1oc(C(C)C)cc1C(=O)Nc1ccccc1OC(C)(C)C ZINC000512912926 340383822 /nfs/dbraw/zinc/38/38/22/340383822.db2.gz JRZRAAKTWIFLOV-UHFFFAOYSA-N 0 0 315.413 5.141 20 0 DKADRN COc1cc(CNc2ccc(C(C)C)cc2)ccc1OC(F)F ZINC000512924901 340384229 /nfs/dbraw/zinc/38/42/29/340384229.db2.gz WBKGPWBZFGPCAA-UHFFFAOYSA-N 0 0 321.367 5.032 20 0 DKADRN Cc1nc2cc(NCc3ccc(-c4ccccc4)o3)ccc2o1 ZINC000512928401 340384395 /nfs/dbraw/zinc/38/43/95/340384395.db2.gz HLXAYABGRXWPNQ-UHFFFAOYSA-N 0 0 304.349 5.008 20 0 DKADRN Cc1nc2cc(NCc3ccc(-c4ccccc4F)o3)ccc2o1 ZINC000512929121 340384412 /nfs/dbraw/zinc/38/44/12/340384412.db2.gz SZFQJZOSRRQEQO-UHFFFAOYSA-N 0 0 322.339 5.147 20 0 DKADRN CCOc1cc(CNc2cccc(C(C)C)c2)cc(Cl)c1O ZINC000512938947 340384808 /nfs/dbraw/zinc/38/48/08/340384808.db2.gz GTGCXJLPQNVTAV-UHFFFAOYSA-N 0 0 319.832 5.180 20 0 DKADRN CCSc1cccc(NC(=O)c2cc(C(C)C)oc2C)c1 ZINC000512951442 340385412 /nfs/dbraw/zinc/38/54/12/340385412.db2.gz QMJOLGSWZZRAPF-UHFFFAOYSA-N 0 0 303.427 5.076 20 0 DKADRN CC(C)CC(=O)Nc1ccc(NCc2ccc(C(C)C)cc2)cc1 ZINC000512960663 340385693 /nfs/dbraw/zinc/38/56/93/340385693.db2.gz MMBGHNINZIWSSI-UHFFFAOYSA-N 0 0 324.468 5.407 20 0 DKADRN Cc1cc(C)c(CNc2ccc(NC(=O)CC(C)C)cc2)c(C)c1 ZINC000512962278 340385790 /nfs/dbraw/zinc/38/57/90/340385790.db2.gz XKFSJKBNAAKVJS-UHFFFAOYSA-N 0 0 324.468 5.209 20 0 DKADRN FC(F)Oc1cccc(NCc2ccc(-c3ccccc3)o2)c1 ZINC000512974461 340386402 /nfs/dbraw/zinc/38/64/02/340386402.db2.gz VNDOXVNCGJLNQH-UHFFFAOYSA-N 0 0 315.319 5.160 20 0 DKADRN Clc1sccc1NCc1ccc(Sc2ccccn2)o1 ZINC000513015845 340388652 /nfs/dbraw/zinc/38/86/52/340388652.db2.gz BFRNRCZTMVCXLU-UHFFFAOYSA-N 0 0 322.842 5.153 20 0 DKADRN CCc1ccc(CNc2ccc3nc(C(F)F)sc3c2)o1 ZINC000513021709 340388869 /nfs/dbraw/zinc/38/88/69/340388869.db2.gz INTVTZCXQSYECK-UHFFFAOYSA-N 0 0 308.353 5.001 20 0 DKADRN Cc1ccsc1CNc1ccc2nc(C(F)F)sc2c1 ZINC000513021928 340389100 /nfs/dbraw/zinc/38/91/00/340389100.db2.gz 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ZINC000514034699 340442061 /nfs/dbraw/zinc/44/20/61/340442061.db2.gz NGIJTURNTBCBLK-HXUWFJFHSA-N 0 0 324.468 5.004 20 0 DKADRN CCCCSCC(=O)Nc1c(C(C)C)cccc1C(C)C ZINC000514058083 340443288 /nfs/dbraw/zinc/44/32/88/340443288.db2.gz NMVLDANNOPXHIZ-UHFFFAOYSA-N 0 0 307.503 5.405 20 0 DKADRN c1coc(-c2cccc(NCc3ccc(-c4ccccc4)o3)c2)n1 ZINC000514075466 340444749 /nfs/dbraw/zinc/44/47/49/340444749.db2.gz GMLZFFPXIKEMSO-UHFFFAOYSA-N 0 0 316.360 5.214 20 0 DKADRN Clc1ccc(Cl)c(CNc2cccc(-c3ncco3)c2)c1 ZINC000514076931 340444923 /nfs/dbraw/zinc/44/49/23/340444923.db2.gz HRSINFYPSYDQAD-UHFFFAOYSA-N 0 0 319.191 5.261 20 0 DKADRN C[C@@H](Sc1nnc(C2CCC2)n1C)c1ccc2ccccc2c1 ZINC000514121412 336371611 /nfs/dbraw/zinc/37/16/11/336371611.db2.gz VYQUTNOMHNQXQT-CYBMUJFWSA-N 0 0 323.465 5.089 20 0 DKADRN C[C@H](Sc1nnc(C2CCC2)n1C)c1ccc2ccccc2c1 ZINC000514121413 336371644 /nfs/dbraw/zinc/37/16/44/336371644.db2.gz VYQUTNOMHNQXQT-ZDUSSCGKSA-N 0 0 323.465 5.089 20 0 DKADRN Cc1ccc(-c2ccc(C(=O)Nc3ccccc3Cl)s2)o1 ZINC000514151782 337571918 /nfs/dbraw/zinc/57/19/18/337571918.db2.gz OIHJQFQYUHWMGT-UHFFFAOYSA-N 0 0 317.797 5.222 20 0 DKADRN Cc1ccc([C@@H]2CCCN2C(=O)c2cccc3ccccc32)s1 ZINC000514165449 337965859 /nfs/dbraw/zinc/96/58/59/337965859.db2.gz SNNFZMBJVZITEM-SFHVURJKSA-N 0 0 321.445 5.187 20 0 DKADRN Cc1ccc(-c2ccc(C(=O)Nc3c(C)cccc3C)s2)o1 ZINC000514168889 337965967 /nfs/dbraw/zinc/96/59/67/337965967.db2.gz CDDQCOWWMRGMKP-UHFFFAOYSA-N 0 0 311.406 5.186 20 0 DKADRN C[C@H](Cc1ccccc1)C(=O)Nc1cc(C(F)F)ccc1Cl ZINC000514185600 337965516 /nfs/dbraw/zinc/96/55/16/337965516.db2.gz IVNKKMBOFYSINR-LLVKDONJSA-N 0 0 323.770 5.095 20 0 DKADRN C[C@@H](Cc1ccccc1)C(=O)Nc1cc(C(F)F)ccc1Cl ZINC000514185601 337965535 /nfs/dbraw/zinc/96/55/35/337965535.db2.gz IVNKKMBOFYSINR-NSHDSACASA-N 0 0 323.770 5.095 20 0 DKADRN CC[C@@H](NC(c1ccccc1)c1ccccc1)c1nc(C)cs1 ZINC000514232993 337966837 /nfs/dbraw/zinc/96/68/37/337966837.db2.gz TWKUWMHKWILILK-GOSISDBHSA-N 0 0 322.477 5.282 20 0 DKADRN C[C@H](Cc1ccccc1)C(=O)Nc1cccc(C(F)F)c1Cl ZINC000514237245 337968621 /nfs/dbraw/zinc/96/86/21/337968621.db2.gz FZMANNIGZOXKMO-LLVKDONJSA-N 0 0 323.770 5.095 20 0 DKADRN CCc1nc([C@H](C)NC(c2ccccc2)c2ccccc2)cs1 ZINC000514238580 337968756 /nfs/dbraw/zinc/96/87/56/337968756.db2.gz GFKYIDIGPRHPLC-HNNXBMFYSA-N 0 0 322.477 5.146 20 0 DKADRN CCc1nc([C@@H](C)NC(c2ccccc2)c2ccccc2)cs1 ZINC000514238581 337968769 /nfs/dbraw/zinc/96/87/69/337968769.db2.gz GFKYIDIGPRHPLC-OAHLLOKOSA-N 0 0 322.477 5.146 20 0 DKADRN CC[C@@H](NC(c1ccccc1)c1ccccc1)c1c(C)noc1C ZINC000514244489 337967774 /nfs/dbraw/zinc/96/77/74/337967774.db2.gz JBRDWNLSFUQRCP-LJQANCHMSA-N 0 0 320.436 5.122 20 0 DKADRN Cc1cccc(C)c1NC(=O)N[C@H](CC(C)(C)C)c1ccccc1 ZINC000514246636 337967862 /nfs/dbraw/zinc/96/78/62/337967862.db2.gz NYTCCQAVNBARRM-GOSISDBHSA-N 0 0 324.468 5.602 20 0 DKADRN Cc1cccc(C)c1NC(=O)N[C@@H](CC(C)(C)C)c1ccccc1 ZINC000514246637 337967896 /nfs/dbraw/zinc/96/78/96/337967896.db2.gz NYTCCQAVNBARRM-SFHVURJKSA-N 0 0 324.468 5.602 20 0 DKADRN Fc1ccc(-c2nc(CSc3ccccc3Cl)co2)cc1 ZINC000514314973 333111666 /nfs/dbraw/zinc/11/16/66/333111666.db2.gz HVPGDVARHZCXIV-UHFFFAOYSA-N 0 0 319.788 5.426 20 0 DKADRN Fc1ccccc1CN(Cc1cccs1)Cc1cccs1 ZINC000514318992 333113105 /nfs/dbraw/zinc/11/31/05/333113105.db2.gz LFOVTBWMCBDBQD-UHFFFAOYSA-N 0 0 317.454 5.151 20 0 DKADRN CCN(C(=O)c1sc2cccc(F)c2c1C)C1CCCCC1 ZINC000514343944 333117530 /nfs/dbraw/zinc/11/75/30/333117530.db2.gz WISVSXUAQQBEMD-UHFFFAOYSA-N 0 0 319.445 5.144 20 0 DKADRN FC(F)n1c(CSc2ccccc2Cl)nc2ccccc21 ZINC000514348979 333118596 /nfs/dbraw/zinc/11/85/96/333118596.db2.gz QUDCIFUVOSHVSI-UHFFFAOYSA-N 0 0 324.783 5.377 20 0 DKADRN CC(C)c1nc(CSc2ccc3ccccc3n2)cs1 ZINC000514405888 333129427 /nfs/dbraw/zinc/12/94/27/333129427.db2.gz COKISSVMDNQOEX-UHFFFAOYSA-N 0 0 300.452 5.107 20 0 DKADRN Cc1nc(C(C)C)sc1C(=O)Nc1c(C)cccc1C(C)C ZINC000514405975 333129528 /nfs/dbraw/zinc/12/95/28/333129528.db2.gz UUCWBNAZFJYTBI-UHFFFAOYSA-N 0 0 316.470 5.259 20 0 DKADRN Cc1nc(SCc2csc(C3CCCCC3)n2)oc1C ZINC000514433970 333131885 /nfs/dbraw/zinc/13/18/85/333131885.db2.gz DEBKXPVTBFESPN-UHFFFAOYSA-N 0 0 308.472 5.088 20 0 DKADRN Cc1cc(C)c(NC(=O)Cc2csc3ccccc23)c(C)c1 ZINC000514442827 333133084 /nfs/dbraw/zinc/13/30/84/333133084.db2.gz QRAGLJCADCBIKM-UHFFFAOYSA-N 0 0 309.434 5.008 20 0 DKADRN CCCc1ccccc1NC(=O)Cc1csc2ccccc12 ZINC000514452181 333133503 /nfs/dbraw/zinc/13/35/03/333133503.db2.gz YMKJLKUESRBZIR-UHFFFAOYSA-N 0 0 309.434 5.035 20 0 DKADRN CC(C)c1ccc(CCC(=O)N2CCC[C@H]2c2ccccc2)cc1 ZINC000514452236 333133416 /nfs/dbraw/zinc/13/34/16/333133416.db2.gz OJIHLWWOGNNVFV-NRFANRHFSA-N 0 0 321.464 5.106 20 0 DKADRN CC(C)c1ccc(CCC(=O)N2CCC[C@@H]2c2ccccc2)cc1 ZINC000514452237 333133506 /nfs/dbraw/zinc/13/35/06/333133506.db2.gz OJIHLWWOGNNVFV-OAQYLSRUSA-N 0 0 321.464 5.106 20 0 DKADRN Cc1ccc(NC(=O)c2[nH]c3ccccc3c2Cl)c(Cl)c1 ZINC000514463557 333135008 /nfs/dbraw/zinc/13/50/08/333135008.db2.gz BUNBGOUNTMVRPB-UHFFFAOYSA-N 0 0 319.191 5.035 20 0 DKADRN Clc1ccc(OCc2cccc3cccnc32)c2ncccc12 ZINC000514486586 333137952 /nfs/dbraw/zinc/13/79/52/333137952.db2.gz UVILSXLUEARROX-UHFFFAOYSA-N 0 0 320.779 5.015 20 0 DKADRN Cc1ccc(-c2noc(CS[C@@H](C)c3ccccc3)n2)cc1 ZINC000514491654 333141430 /nfs/dbraw/zinc/14/14/30/333141430.db2.gz GEHDDVUNYVFLKZ-AWEZNQCLSA-N 0 0 310.422 5.039 20 0 DKADRN Cc1ccc(-c2noc(CS[C@H](C)c3ccccc3)n2)cc1 ZINC000514491657 333141503 /nfs/dbraw/zinc/14/15/03/333141503.db2.gz GEHDDVUNYVFLKZ-CQSZACIVSA-N 0 0 310.422 5.039 20 0 DKADRN Cc1ccc(C)c(C[S@](=O)Cc2ccc(C(C)(C)C)cc2)c1 ZINC000514493543 333142411 /nfs/dbraw/zinc/14/24/11/333142411.db2.gz XYDMTEKMYRTSQB-JOCHJYFZSA-N 0 0 314.494 5.050 20 0 DKADRN Cc1ccc(C)c(C[S@@](=O)Cc2ccc(C(C)(C)C)cc2)c1 ZINC000514493544 333142336 /nfs/dbraw/zinc/14/23/36/333142336.db2.gz XYDMTEKMYRTSQB-QFIPXVFZSA-N 0 0 314.494 5.050 20 0 DKADRN C[C@H](c1ccc(Cl)cc1Cl)N(C)C(=O)Nc1ccccc1 ZINC000514494469 333142149 /nfs/dbraw/zinc/14/21/49/333142149.db2.gz IPQIZCOVKVOSJA-LLVKDONJSA-N 0 0 323.223 5.218 20 0 DKADRN C[C@@H](c1ccc(Cl)cc1Cl)N(C)C(=O)Nc1ccccc1 ZINC000514494470 333142140 /nfs/dbraw/zinc/14/21/40/333142140.db2.gz IPQIZCOVKVOSJA-NSHDSACASA-N 0 0 323.223 5.218 20 0 DKADRN CCCCN(C(=O)c1ccc(-c2ccc(F)cc2)o1)[C@@H](C)CC ZINC000514496715 333143811 /nfs/dbraw/zinc/14/38/11/333143811.db2.gz SBBWGJFRUOYPSV-AWEZNQCLSA-N 0 0 317.404 5.127 20 0 DKADRN CCCCN(C(=O)c1ccc(-c2ccc(F)cc2)o1)[C@H](C)CC ZINC000514496716 333143879 /nfs/dbraw/zinc/14/38/79/333143879.db2.gz SBBWGJFRUOYPSV-CQSZACIVSA-N 0 0 317.404 5.127 20 0 DKADRN CCCN(CCC)C(=O)Nc1ccccc1-c1cccs1 ZINC000514504191 333201750 /nfs/dbraw/zinc/20/17/50/333201750.db2.gz SUGHTHLAPANKSF-UHFFFAOYSA-N 0 0 302.443 5.069 20 0 DKADRN CN(C(=O)Nc1ccccc1-c1cccs1)C1CCCCC1 ZINC000514504311 333202847 /nfs/dbraw/zinc/20/28/47/333202847.db2.gz FBGUYEHIKWVWTG-UHFFFAOYSA-N 0 0 314.454 5.212 20 0 DKADRN CCc1cccc(NC(=O)N(C)[C@H](C)c2ccc(Cl)cc2)c1 ZINC000514506251 333215561 /nfs/dbraw/zinc/21/55/61/333215561.db2.gz RFFGHSPPRKFUFR-CYBMUJFWSA-N 0 0 316.832 5.127 20 0 DKADRN CCc1cccc(NC(=O)N(C)[C@@H](C)c2ccc(Cl)cc2)c1 ZINC000514506252 333215533 /nfs/dbraw/zinc/21/55/33/333215533.db2.gz RFFGHSPPRKFUFR-ZDUSSCGKSA-N 0 0 316.832 5.127 20 0 DKADRN CC[C@H](NC(=O)Nc1c(C)cccc1C)c1ccc(Cl)cc1 ZINC000514506281 333215445 /nfs/dbraw/zinc/21/54/45/333215445.db2.gz TYIZGUBHWVBPGB-INIZCTEOSA-N 0 0 316.832 5.230 20 0 DKADRN CC[C@@H](NC(=O)Nc1c(C)cccc1C)c1ccc(Cl)cc1 ZINC000514506282 333215767 /nfs/dbraw/zinc/21/57/67/333215767.db2.gz TYIZGUBHWVBPGB-MRXNPFEDSA-N 0 0 316.832 5.230 20 0 DKADRN CCC[C@@H](NC(=O)Nc1ccccc1C(C)(C)C)c1ccccc1 ZINC000514507352 333217268 /nfs/dbraw/zinc/21/72/68/333217268.db2.gz BTIVRLNWWINEBR-GOSISDBHSA-N 0 0 324.468 5.647 20 0 DKADRN CCC[C@H](NC(=O)Nc1ccccc1C(C)(C)C)c1ccccc1 ZINC000514507353 333217274 /nfs/dbraw/zinc/21/72/74/333217274.db2.gz BTIVRLNWWINEBR-SFHVURJKSA-N 0 0 324.468 5.647 20 0 DKADRN CCCN(CC1CC1)C(=O)Nc1ccc2oc3ccccc3c2c1 ZINC000514507356 333217249 /nfs/dbraw/zinc/21/72/49/333217249.db2.gz CCCUCVZFTFZUGI-UHFFFAOYSA-N 0 0 322.408 5.240 20 0 DKADRN CCN(Cc1ccccc1C)C(=O)Nc1ccc(C(C)C)cc1 ZINC000514507569 333219142 /nfs/dbraw/zinc/21/91/42/333219142.db2.gz QAGQABAPHHOPMK-UHFFFAOYSA-N 0 0 310.441 5.172 20 0 DKADRN CCCCN(C(=O)Nc1ccccc1-c1ccccc1)C1CC1 ZINC000514507719 333220299 /nfs/dbraw/zinc/22/02/99/333220299.db2.gz HEYARJGEDDVEDW-UHFFFAOYSA-N 0 0 308.425 5.150 20 0 DKADRN CCCCN(C(=O)Nc1ccc(-c2ccccc2)cc1)C1CC1 ZINC000514507734 333220853 /nfs/dbraw/zinc/22/08/53/333220853.db2.gz IEDHXPKNNMHZEM-UHFFFAOYSA-N 0 0 308.425 5.150 20 0 DKADRN Cc1cccc(Oc2ccccc2NC(=O)N2CCCC[C@@H]2C)c1 ZINC000514508205 333255335 /nfs/dbraw/zinc/25/53/35/333255335.db2.gz ZVMSKZDZFKLSDR-INIZCTEOSA-N 0 0 324.424 5.194 20 0 DKADRN Cc1cccc(Oc2ccccc2NC(=O)N2CCCC[C@H]2C)c1 ZINC000514508206 333255359 /nfs/dbraw/zinc/25/53/59/333255359.db2.gz ZVMSKZDZFKLSDR-MRXNPFEDSA-N 0 0 324.424 5.194 20 0 DKADRN CN(C(=O)Nc1ccc2c(c1)Cc1ccccc1-2)C1CCCCC1 ZINC000514508255 333257122 /nfs/dbraw/zinc/25/71/22/333257122.db2.gz CLOVQFINRRUSJR-UHFFFAOYSA-N 0 0 320.436 5.054 20 0 DKADRN CC[C@H](NC(=O)Nc1ccc(F)cc1C)c1ccc(Cl)cc1 ZINC000514508375 333258376 /nfs/dbraw/zinc/25/83/76/333258376.db2.gz IIIUHDAVPZSKEM-HNNXBMFYSA-N 0 0 320.795 5.060 20 0 DKADRN CC[C@@H](NC(=O)Nc1ccc(F)cc1C)c1ccc(Cl)cc1 ZINC000514508377 333258269 /nfs/dbraw/zinc/25/82/69/333258269.db2.gz IIIUHDAVPZSKEM-OAHLLOKOSA-N 0 0 320.795 5.060 20 0 DKADRN CCc1ccccc1NC(=O)N(C)Cc1ccc(C(C)C)cc1 ZINC000514508891 333274266 /nfs/dbraw/zinc/27/42/66/333274266.db2.gz OYYPXJNHBHCRBB-UHFFFAOYSA-N 0 0 310.441 5.036 20 0 DKADRN Cc1cccc(Oc2ccc(NC(=O)N3CCCC[C@@H]3C)cc2)c1 ZINC000514509345 333311558 /nfs/dbraw/zinc/31/15/58/333311558.db2.gz ZRLJCNVIEZMVTC-INIZCTEOSA-N 0 0 324.424 5.194 20 0 DKADRN Cc1cccc(Oc2ccc(NC(=O)N3CCCC[C@H]3C)cc2)c1 ZINC000514509346 333311608 /nfs/dbraw/zinc/31/16/08/333311608.db2.gz ZRLJCNVIEZMVTC-MRXNPFEDSA-N 0 0 324.424 5.194 20 0 DKADRN CCN(Cc1ccccc1C)C(=O)Nc1cccc(C(C)C)c1 ZINC000514509506 333338083 /nfs/dbraw/zinc/33/80/83/333338083.db2.gz DRVHOEFEGKXLAI-UHFFFAOYSA-N 0 0 310.441 5.172 20 0 DKADRN Cc1cc(C)c(NC(=O)N[C@@H]2CC[C@H]3CCCC[C@H]3C2)c(C)c1 ZINC000514511029 333349695 /nfs/dbraw/zinc/34/96/95/333349695.db2.gz LVLKRKDAPWYBMD-FGTMMUONSA-N 0 0 314.473 5.092 20 0 DKADRN Cc1cc(C)c(NC(=O)N[C@@H]2CC[C@H]3CCCC[C@@H]3C2)c(C)c1 ZINC000514511031 333349725 /nfs/dbraw/zinc/34/97/25/333349725.db2.gz LVLKRKDAPWYBMD-KZNAEPCWSA-N 0 0 314.473 5.092 20 0 DKADRN Cc1cc(C)c(NC(=O)N[C@@H]2CC[C@@H]3CCCC[C@H]3C2)c(C)c1 ZINC000514511032 333349683 /nfs/dbraw/zinc/34/96/83/333349683.db2.gz LVLKRKDAPWYBMD-OKZBNKHCSA-N 0 0 314.473 5.092 20 0 DKADRN Cc1cc(C)c(NC(=O)N[C@@H]2CC[C@@H]3CCCC[C@@H]3C2)c(C)c1 ZINC000514511033 333349673 /nfs/dbraw/zinc/34/96/73/333349673.db2.gz LVLKRKDAPWYBMD-RCCFBDPRSA-N 0 0 314.473 5.092 20 0 DKADRN Cc1ccccc1NC(=O)N[C@H](c1ccc(Cl)cc1)C(C)C ZINC000514511043 333349694 /nfs/dbraw/zinc/34/96/94/333349694.db2.gz RLGWZCFVDXOWTP-KRWDZBQOSA-N 0 0 316.832 5.167 20 0 DKADRN Cc1ccccc1NC(=O)N[C@@H](c1ccc(Cl)cc1)C(C)C ZINC000514511044 333349697 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ZINC000514511439 333349993 /nfs/dbraw/zinc/34/99/93/333349993.db2.gz LRTZSLYMIQFUPY-YGRLFVJLSA-N 0 0 315.244 5.036 20 0 DKADRN CC(C)c1cccc(C(C)C)c1NC(=O)N1C2CCC1CC2 ZINC000514511598 333349944 /nfs/dbraw/zinc/34/99/44/333349944.db2.gz JHTQISGFWSORSJ-UHFFFAOYSA-N 0 0 300.446 5.092 20 0 DKADRN CCCN(CCC)C(=O)Nc1ccc(-c2ccccc2)cc1C ZINC000514514484 333393546 /nfs/dbraw/zinc/39/35/46/333393546.db2.gz TXJSRJRTLCWNMT-UHFFFAOYSA-N 0 0 310.441 5.316 20 0 DKADRN Cc1cc(-c2ccccc2)ccc1NC(=O)N(C)C1CCCCC1 ZINC000514514574 333393790 /nfs/dbraw/zinc/39/37/90/333393790.db2.gz DQDGDFSZMOWSAN-UHFFFAOYSA-N 0 0 322.452 5.458 20 0 DKADRN CC[C@@H](C(=O)Nc1ccc(Cl)c2cccnc12)c1ccccc1 ZINC000514519109 335646048 /nfs/dbraw/zinc/64/60/48/335646048.db2.gz UEIUYSHVRIUDQY-CQSZACIVSA-N 0 0 324.811 5.021 20 0 DKADRN Fc1ccc(CSCc2coc(-c3ccc(F)cc3)n2)cc1 ZINC000514519835 335645869 /nfs/dbraw/zinc/64/58/69/335645869.db2.gz NAWNIKROSWMCGI-UHFFFAOYSA-N 0 0 317.360 5.053 20 0 DKADRN Fc1ccc(-c2nc(CSCc3ccccc3F)co2)cc1 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5.063 20 0 DKADRN O=C(c1cc(Cl)ccc1F)N(c1ccccc1)C1CCCC1 ZINC000518700590 332130088 /nfs/dbraw/zinc/13/00/88/332130088.db2.gz STAYJDKJDZGYBD-UHFFFAOYSA-N 0 0 317.791 5.069 20 0 DKADRN Cc1cccc(Sc2nc(C(F)F)nc3ccccc32)c1 ZINC000518704579 332131734 /nfs/dbraw/zinc/13/17/34/332131734.db2.gz SPDLYXSPHFGSLU-UHFFFAOYSA-N 0 0 302.349 5.027 20 0 DKADRN Fc1cc(Cl)ccc1Oc1nc(C(F)F)nc2ccccc21 ZINC000518714707 332133257 /nfs/dbraw/zinc/13/32/57/332133257.db2.gz BPEJJXOALKGAEW-UHFFFAOYSA-N 0 0 324.689 5.152 20 0 DKADRN Cc1ncsc1-c1cc(C2CC2)c2c(C)c(C)sc2n1 ZINC000518737096 332139553 /nfs/dbraw/zinc/13/95/53/332139553.db2.gz GHENETWCRKGWGD-UHFFFAOYSA-N 0 0 300.452 5.222 20 0 DKADRN CC(C)N(C(=O)[C@H](C)c1ccccc1F)c1ccc(Cl)cc1 ZINC000518739081 332139789 /nfs/dbraw/zinc/13/97/89/332139789.db2.gz MTNPWNQITZBZEA-CYBMUJFWSA-N 0 0 319.807 5.024 20 0 DKADRN CC(C)N(C(=O)[C@@H](C)c1ccccc1F)c1ccc(Cl)cc1 ZINC000518739082 332139806 /nfs/dbraw/zinc/13/98/06/332139806.db2.gz MTNPWNQITZBZEA-ZDUSSCGKSA-N 0 0 319.807 5.024 20 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340533242 /nfs/dbraw/zinc/53/32/42/340533242.db2.gz QFDZWZDXFAAAOC-UHFFFAOYSA-N 0 0 316.832 5.011 20 0 DKADRN CC[C@@H](c1ccccc1)N(CC)C(=O)Nc1ccc(F)cc1C ZINC000521817175 340533193 /nfs/dbraw/zinc/53/31/93/340533193.db2.gz SNRQEXVOXCNHTP-SFHVURJKSA-N 0 0 314.404 5.139 20 0 DKADRN CCCN(C(=O)Nc1ccccc1CC)[C@@H]1CCc2ccccc21 ZINC000521817198 340533238 /nfs/dbraw/zinc/53/32/38/340533238.db2.gz UPLMWVSIRQZYAJ-HXUWFJFHSA-N 0 0 322.452 5.180 20 0 DKADRN Cc1cccc(CN(CC(C)C)C(=O)Nc2ccc(C)cc2C)c1 ZINC000521817673 340533486 /nfs/dbraw/zinc/53/34/86/340533486.db2.gz UEMIAJJEUPYWGY-UHFFFAOYSA-N 0 0 324.468 5.302 20 0 DKADRN CC[C@@H](c1ccccc1)N(CC)C(=O)Nc1ccc(Cl)cc1 ZINC000521817678 340533465 /nfs/dbraw/zinc/53/34/65/340533465.db2.gz UGXGGJBETAHZDW-KRWDZBQOSA-N 0 0 316.832 5.345 20 0 DKADRN Clc1ccccc1SCc1ncc(-c2cccs2)o1 ZINC000521840233 340535922 /nfs/dbraw/zinc/53/59/22/340535922.db2.gz HROCTSRSNURSKF-UHFFFAOYSA-N 0 0 307.827 5.349 20 0 DKADRN C[C@@H](c1ccccc1)N(C)C(=O)CCCCCc1cccs1 ZINC000521841315 340535877 /nfs/dbraw/zinc/53/58/77/340535877.db2.gz BUNLJTOTCMAAIE-INIZCTEOSA-N 0 0 315.482 5.071 20 0 DKADRN C[C@H](c1ccccc1)N(C)C(=O)CCCCCc1cccs1 ZINC000521841316 340535885 /nfs/dbraw/zinc/53/58/85/340535885.db2.gz BUNLJTOTCMAAIE-MRXNPFEDSA-N 0 0 315.482 5.071 20 0 DKADRN Cc1nc2ccc(C(=O)N(C)c3ccccc3C(C)C)cc2s1 ZINC000521852002 340536522 /nfs/dbraw/zinc/53/65/22/340536522.db2.gz VMIYKPCHRNMJRC-UHFFFAOYSA-N 0 0 324.449 5.005 20 0 DKADRN CC(C)CCc1ccccc1NC(=O)N(C)C1CCCCC1 ZINC000521853569 340536578 /nfs/dbraw/zinc/53/65/78/340536578.db2.gz SGNHRJKWLVDQNS-UHFFFAOYSA-N 0 0 302.462 5.072 20 0 DKADRN CC(C)CCc1ccccc1NC(=O)N(C)[C@@H](C)c1ccco1 ZINC000521858623 340536888 /nfs/dbraw/zinc/53/68/88/340536888.db2.gz BYGJBNXISCOPSU-HNNXBMFYSA-N 0 0 314.429 5.093 20 0 DKADRN CC(C)CCc1ccccc1NC(=O)N(C)[C@H](C)c1ccco1 ZINC000521858624 340536793 /nfs/dbraw/zinc/53/67/93/340536793.db2.gz BYGJBNXISCOPSU-OAHLLOKOSA-N 0 0 314.429 5.093 20 0 DKADRN Cc1ncc(CSCc2ccc(Cl)c(Cl)c2)s1 ZINC000521861385 340537096 /nfs/dbraw/zinc/53/70/96/340537096.db2.gz OVHYKLUVPNYIEG-UHFFFAOYSA-N 0 0 304.267 5.192 20 0 DKADRN Clc1cccc(-c2cnc(CSc3cccs3)o2)c1 ZINC000521906114 340539302 /nfs/dbraw/zinc/53/93/02/340539302.db2.gz UEFANQWRROBPQQ-UHFFFAOYSA-N 0 0 307.827 5.349 20 0 DKADRN Cc1ncsc1CNc1ccccc1O[C@@H](C)c1ccccc1 ZINC000521947187 340558742 /nfs/dbraw/zinc/55/87/42/340558742.db2.gz AHJPWKZRVICVOR-HNNXBMFYSA-N 0 0 324.449 5.204 20 0 DKADRN Cc1ccccc1NC(=O)[C@@H]1C[C@@H]1c1cccc(Cl)c1Cl ZINC000521955250 340559888 /nfs/dbraw/zinc/55/98/88/340559888.db2.gz ZEQPHHGXKMSQML-CHWSQXEVSA-N 0 0 320.219 5.044 20 0 DKADRN CCc1cccc(C)c1NC(=O)N(Cc1ccccc1)[C@H](C)CC ZINC000521958463 340560854 /nfs/dbraw/zinc/56/08/54/340560854.db2.gz GVIGAZLXQKACSA-QGZVFWFLSA-N 0 0 324.468 5.390 20 0 DKADRN CC[C@H](C)C(=O)N[C@H](c1ccccc1)c1cccc2ccccc21 ZINC000521966263 340561048 /nfs/dbraw/zinc/56/10/48/340561048.db2.gz XJDGZITZOUIGGF-HRAATJIYSA-N 0 0 317.432 5.092 20 0 DKADRN CC[C@@H](C)C(=O)N[C@H](c1ccccc1)c1cccc2ccccc21 ZINC000521966265 340561009 /nfs/dbraw/zinc/56/10/09/340561009.db2.gz XJDGZITZOUIGGF-IIBYNOLFSA-N 0 0 317.432 5.092 20 0 DKADRN O=C(c1cc2sccc2s1)N1CCCC2(CCCCC2)C1 ZINC000522024106 340562798 /nfs/dbraw/zinc/56/27/98/340562798.db2.gz QALIZHLTXVJAFT-UHFFFAOYSA-N 0 0 319.495 5.149 20 0 DKADRN CC[C@@H](Sc1nnc(-c2ccc(F)cc2)o1)c1ccccc1 ZINC000522065439 340567683 /nfs/dbraw/zinc/56/76/83/340567683.db2.gz PORSXJUETDYPCX-OAHLLOKOSA-N 0 0 314.385 5.119 20 0 DKADRN CCCC(=O)Nc1ccc(N[C@H](C)c2ccccc2)c(Cl)c1 ZINC000522068108 340568852 /nfs/dbraw/zinc/56/88/52/340568852.db2.gz QSOYLSJNYKKKJL-CYBMUJFWSA-N 0 0 316.832 5.252 20 0 DKADRN CC(C)c1ccccc1NC(=O)N1CCCC2(CCCCC2)C1 ZINC000522072046 340569132 /nfs/dbraw/zinc/56/91/32/340569132.db2.gz ULJWXWGMXVVXBT-UHFFFAOYSA-N 0 0 314.473 5.388 20 0 DKADRN CC[C@@H]1CCCN1C(=O)Nc1ccc(Oc2cccc(C)c2)cc1 ZINC000522072422 340569160 /nfs/dbraw/zinc/56/91/60/340569160.db2.gz MJFCVCPALYQAQD-QGZVFWFLSA-N 0 0 324.424 5.194 20 0 DKADRN CCc1ccc(Cl)c(CC)c1NC(=O)N1CCC(CC)CC1 ZINC000522072796 340569210 /nfs/dbraw/zinc/56/92/10/340569210.db2.gz BZUQXVZOLFYTMW-UHFFFAOYSA-N 0 0 322.880 5.119 20 0 DKADRN CC[C@H]1CCCN1C(=O)Nc1ccccc1Oc1cccc(C)c1 ZINC000522073532 340569295 /nfs/dbraw/zinc/56/92/95/340569295.db2.gz OGPAYKYOIVKCJW-INIZCTEOSA-N 0 0 324.424 5.194 20 0 DKADRN CCC1CCN(C(=O)Nc2ccccc2Oc2ccccc2)CC1 ZINC000522073722 340569311 /nfs/dbraw/zinc/56/93/11/340569311.db2.gz ZOJQIKRLXWNJRK-UHFFFAOYSA-N 0 0 324.424 5.133 20 0 DKADRN Cc1cc(C)c(NC(=O)N[C@H]2CCC[C@@H]2c2ccccc2)c(C)c1 ZINC000522074318 340569273 /nfs/dbraw/zinc/56/92/73/340569273.db2.gz BFRJWAZFGWOCOR-MOPGFXCFSA-N 0 0 322.452 5.070 20 0 DKADRN Cc1cc(C)c(NC(=O)N[C@H]2CCC[C@H]2c2ccccc2)c(C)c1 ZINC000522074319 340569269 /nfs/dbraw/zinc/56/92/69/340569269.db2.gz BFRJWAZFGWOCOR-OALUTQOASA-N 0 0 322.452 5.070 20 0 DKADRN Cc1cc(C)c(NC(=O)N[C@@H]2CCC[C@H]2c2ccccc2)c(C)c1 ZINC000522074320 340569320 /nfs/dbraw/zinc/56/93/20/340569320.db2.gz BFRJWAZFGWOCOR-RBUKOAKNSA-N 0 0 322.452 5.070 20 0 DKADRN Cc1cc(C)c(NC(=O)N[C@@H]2CCC[C@@H]2c2ccccc2)c(C)c1 ZINC000522074321 340569326 /nfs/dbraw/zinc/56/93/26/340569326.db2.gz BFRJWAZFGWOCOR-RTBURBONSA-N 0 0 322.452 5.070 20 0 DKADRN CCC1CCN(C(=O)Nc2ccc3oc4ccccc4c3c2)CC1 ZINC000522074367 340569284 /nfs/dbraw/zinc/56/92/84/340569284.db2.gz DZXNTNKUIWJXDG-UHFFFAOYSA-N 0 0 322.408 5.240 20 0 DKADRN Cc1c(Cl)cccc1NC(=O)N1CCCC2(CCCCC2)C1 ZINC000522074387 340569312 /nfs/dbraw/zinc/56/93/12/340569312.db2.gz GCRKZSRJLBTYLV-UHFFFAOYSA-N 0 0 320.864 5.227 20 0 DKADRN Cc1cc(C)c(NC(=O)N2CCCC3(CCCCC3)C2)c(C)c1 ZINC000522075152 340569294 /nfs/dbraw/zinc/56/92/94/340569294.db2.gz SLNBFVCOULZWEV-UHFFFAOYSA-N 0 0 314.473 5.190 20 0 DKADRN CC[C@@H](C)Sc1ccc(NC(=O)N(C)CC2CCC2)c(C)c1 ZINC000522087061 340569961 /nfs/dbraw/zinc/56/99/61/340569961.db2.gz IUYLGUOTYPIIND-CQSZACIVSA-N 0 0 320.502 5.149 20 0 DKADRN Cc1ccccc1SCc1ccc(OCc2ccncc2)cc1 ZINC000522090360 340570099 /nfs/dbraw/zinc/57/00/99/340570099.db2.gz XKCRPVOMFGOWHJ-UHFFFAOYSA-N 0 0 321.445 5.261 20 0 DKADRN CC[C@H](Cc1ccccc1)C(=O)Nc1c(C)cccc1C(C)C ZINC000522125584 340574651 /nfs/dbraw/zinc/57/46/51/340574651.db2.gz LCWLJBCXDXWDSP-GOSISDBHSA-N 0 0 309.453 5.326 20 0 DKADRN CC(C)OCc1cccc(N[C@@H](C)c2c(F)cccc2F)c1 ZINC000522155809 340579394 /nfs/dbraw/zinc/57/93/94/340579394.db2.gz LYIOSCRAGIXFTB-ZDUSSCGKSA-N 0 0 305.368 5.063 20 0 DKADRN CC[C@H](Nc1cc(NC(=O)C(C)C)ccc1C)c1ccccc1 ZINC000522156480 340579757 /nfs/dbraw/zinc/57/97/57/340579757.db2.gz KXZVYUZBVSXRJI-SFHVURJKSA-N 0 0 310.441 5.153 20 0 DKADRN CC(C)C[C@H]1CCCN1C(=O)Nc1ccc(Cl)c(Cl)c1 ZINC000522162385 340580186 /nfs/dbraw/zinc/58/01/86/340580186.db2.gz MXTDNTBOARRXKF-GFCCVEGCSA-N 0 0 315.244 5.036 20 0 DKADRN CC(C)C[C@@H]1CCCN1C(=O)Nc1cccc(Cl)c1Cl ZINC000522162671 337462998 /nfs/dbraw/zinc/46/29/98/337462998.db2.gz AFLWPWQEFNKNDO-NSHDSACASA-N 0 0 315.244 5.036 20 0 DKADRN Cc1nc(-c2ccccc2)c(NC(=O)CC2CCCCC2)s1 ZINC000522192665 340585346 /nfs/dbraw/zinc/58/53/46/340585346.db2.gz FVLXQMUIZUXNCL-UHFFFAOYSA-N 0 0 314.454 5.027 20 0 DKADRN CC(C)c1ccc(NC(=O)[C@@H]2COc3ccccc32)c(C(C)C)c1 ZINC000522201535 340586639 /nfs/dbraw/zinc/58/66/39/340586639.db2.gz JKQJNRZCRUUPCR-GOSISDBHSA-N 0 0 323.436 5.048 20 0 DKADRN CC(C)c1ccc(NC(=O)[C@H]2COc3ccccc32)c(C(C)C)c1 ZINC000522201536 340586623 /nfs/dbraw/zinc/58/66/23/340586623.db2.gz JKQJNRZCRUUPCR-SFHVURJKSA-N 0 0 323.436 5.048 20 0 DKADRN O=C(Nc1cccc2[nH]ccc21)Nc1cccc(Cl)c1Cl ZINC000522217507 340589141 /nfs/dbraw/zinc/58/91/41/340589141.db2.gz MHVCLDNIFIPEDM-UHFFFAOYSA-N 0 0 320.179 5.119 20 0 DKADRN CCSc1cccc(NC(=O)c2cc3sccc3s2)c1 ZINC000522231309 340590618 /nfs/dbraw/zinc/59/06/18/340590618.db2.gz UVHZLRFYMLCIFM-UHFFFAOYSA-N 0 0 319.476 5.327 20 0 DKADRN CCc1cccc(C)c1NC(=O)N[C@H]1CCCCc2ccccc21 ZINC000522232331 340590734 /nfs/dbraw/zinc/59/07/34/340590734.db2.gz BCBCQCJXRHTZIT-IBGZPJMESA-N 0 0 322.452 5.147 20 0 DKADRN Clc1cc(Cl)cc(NCc2cc(-c3ccccc3)no2)c1 ZINC000522263848 340595089 /nfs/dbraw/zinc/59/50/89/340595089.db2.gz RGMPRRGXGKYFBW-UHFFFAOYSA-N 0 0 319.191 5.261 20 0 DKADRN C[C@@H](S[C@H](C)c1cccc2ccccc21)c1nc(C2CC2)no1 ZINC000522299950 340598037 /nfs/dbraw/zinc/59/80/37/340598037.db2.gz WYLLMILKRSXLQT-CHWSQXEVSA-N 0 0 324.449 5.656 20 0 DKADRN C[C@@H](S[C@@H](C)c1nc(C2CC2)no1)c1cccc2ccccc21 ZINC000522299951 340597948 /nfs/dbraw/zinc/59/79/48/340597948.db2.gz WYLLMILKRSXLQT-OLZOCXBDSA-N 0 0 324.449 5.656 20 0 DKADRN C[C@H](S[C@@H](C)c1cccc2ccccc21)c1nc(C2CC2)no1 ZINC000522299953 340598048 /nfs/dbraw/zinc/59/80/48/340598048.db2.gz WYLLMILKRSXLQT-STQMWFEESA-N 0 0 324.449 5.656 20 0 DKADRN CC(C)[C@@H](NC(=O)c1ccccc1Cl)c1ccccc1Cl ZINC000522303673 340598335 /nfs/dbraw/zinc/59/83/35/340598335.db2.gz QOFHIDSMDRJMFW-MRXNPFEDSA-N 0 0 322.235 5.121 20 0 DKADRN CC1CCC(CC(=O)N2CCC[C@H]2c2ccc(Cl)cc2)CC1 ZINC000522319948 340598842 /nfs/dbraw/zinc/59/88/42/340598842.db2.gz YOMTXZVDJYZKAK-JMLCCBQJSA-N 0 0 319.876 5.220 20 0 DKADRN CC1CCC(CC(=O)N2CCC[C@H]2c2cccc(Cl)c2)CC1 ZINC000522322210 340598881 /nfs/dbraw/zinc/59/88/81/340598881.db2.gz CDAXPBCTLDQFEG-JMLCCBQJSA-N 0 0 319.876 5.220 20 0 DKADRN C[C@H](Oc1ccccc1NC(=O)CC(C)(C)C)c1ccccc1 ZINC000522328237 340599118 /nfs/dbraw/zinc/59/91/18/340599118.db2.gz VRWVVDFAXSWVRR-HNNXBMFYSA-N 0 0 311.425 5.201 20 0 DKADRN C[C@H](C(=O)Nc1ccc(-c2nc3ccccc3o2)cc1)C(C)(C)C ZINC000522334438 340599160 /nfs/dbraw/zinc/59/91/60/340599160.db2.gz BTZLJKXRRCHZJV-CYBMUJFWSA-N 0 0 322.408 5.116 20 0 DKADRN CC(C)(C)C(=O)Nc1cccc(Oc2ccnc3ccccc32)c1 ZINC000522337448 340599384 /nfs/dbraw/zinc/59/93/84/340599384.db2.gz HKSSISGORDRXFO-UHFFFAOYSA-N 0 0 320.392 5.012 20 0 DKADRN CCN(C(=O)C1CCCCCC1)[C@@H](C)c1cc2ccccc2o1 ZINC000522350731 340599482 /nfs/dbraw/zinc/59/94/82/340599482.db2.gz AJUOJNHHRNPGHK-HNNXBMFYSA-N 0 0 313.441 5.313 20 0 DKADRN CCN(C(=O)C1CCCCCC1)[C@H](C)c1cc2ccccc2o1 ZINC000522350732 340599594 /nfs/dbraw/zinc/59/95/94/340599594.db2.gz AJUOJNHHRNPGHK-OAHLLOKOSA-N 0 0 313.441 5.313 20 0 DKADRN C[C@H](CC1CCCC1)C(=O)Nc1ccccc1OC(C)(C)C ZINC000522360837 340599792 /nfs/dbraw/zinc/59/97/92/340599792.db2.gz VXBSFJXJBJGBDX-CQSZACIVSA-N 0 0 303.446 5.019 20 0 DKADRN O=C(Nc1ccc(-c2cnc(C3CC3)o2)cc1)C1CCCCCC1 ZINC000522361086 340599768 /nfs/dbraw/zinc/59/97/68/340599768.db2.gz GVBANTCLDNYQEU-UHFFFAOYSA-N 0 0 324.424 5.128 20 0 DKADRN C[C@@H](c1ccc2ccccc2c1)N(C(=O)CCC1CC1)C1CC1 ZINC000522364206 340599862 /nfs/dbraw/zinc/59/98/62/340599862.db2.gz PGMKCQXKFSIBSK-HNNXBMFYSA-N 0 0 307.437 5.082 20 0 DKADRN Cc1ccnc(-c2cccc(N[C@@H](C)c3ccccc3Cl)c2)n1 ZINC000522375269 340600124 /nfs/dbraw/zinc/60/01/24/340600124.db2.gz LSDYQNFVSLRUJO-AWEZNQCLSA-N 0 0 323.827 5.279 20 0 DKADRN CCc1ccccc1NC(=O)[C@@H](C)Sc1cccc(Cl)c1 ZINC000522393983 340600663 /nfs/dbraw/zinc/60/06/63/340600663.db2.gz MEEIQCNBBASGAT-GFCCVEGCSA-N 0 0 319.857 5.022 20 0 DKADRN Cc1ccc(-c2ccncc2)cc1N[C@@H](C)c1c(F)cccc1F ZINC000522438752 340601570 /nfs/dbraw/zinc/60/15/70/340601570.db2.gz MIKIHJAGXLZMLE-AWEZNQCLSA-N 0 0 324.374 5.508 20 0 DKADRN CC(C)[C@H](NC(=O)N(C)C1CCCCC1)c1ccccc1Cl ZINC000522450211 340601721 /nfs/dbraw/zinc/60/17/21/340601721.db2.gz IKGAYDRBUKALIG-KRWDZBQOSA-N 0 0 322.880 5.011 20 0 DKADRN CC(C)[C@@H](NC(=O)N(C)C1CCCCC1)c1ccccc1Cl ZINC000522450212 340601714 /nfs/dbraw/zinc/60/17/14/340601714.db2.gz IKGAYDRBUKALIG-QGZVFWFLSA-N 0 0 322.880 5.011 20 0 DKADRN CC[C@H](NC(=O)N(C)[C@@H](C)c1ccc(C)cc1)c1ccc(C)cc1 ZINC000522467865 340602115 /nfs/dbraw/zinc/60/21/15/340602115.db2.gz GDYOGSDHUUDFAI-PXNSSMCTSA-N 0 0 324.468 5.157 20 0 DKADRN CC[C@H](NC(=O)N(C)[C@H](C)c1ccc(C)cc1)c1ccc(C)cc1 ZINC000522467866 340602131 /nfs/dbraw/zinc/60/21/31/340602131.db2.gz GDYOGSDHUUDFAI-XLIONFOSSA-N 0 0 324.468 5.157 20 0 DKADRN Cc1ccsc1C(=O)Nc1ccc(OC2CCCCC2)cc1 ZINC000522500619 340602705 /nfs/dbraw/zinc/60/27/05/340602705.db2.gz ULCVZJHRMWWNLS-UHFFFAOYSA-N 0 0 315.438 5.020 20 0 DKADRN Cc1ccc(Cl)cc1NC(=O)C[C@@H](C)c1ccccc1C ZINC000522506879 340602962 /nfs/dbraw/zinc/60/29/62/340602962.db2.gz QSFWQVTUUMNJPA-CQSZACIVSA-N 0 0 301.817 5.089 20 0 DKADRN Cc1cccc([C@H]2CCCN2C(=O)C[C@H](C)c2ccccc2C)c1 ZINC000522507097 340602950 /nfs/dbraw/zinc/60/29/50/340602950.db2.gz YCFKQVZNRXHCFK-GHTZIAJQSA-N 0 0 321.464 5.161 20 0 DKADRN Cc1cccc([C@@H]2CCCN2C(=O)C[C@@H](C)c2ccccc2C)c1 ZINC000522507098 340602917 /nfs/dbraw/zinc/60/29/17/340602917.db2.gz YCFKQVZNRXHCFK-NQIIRXRSSA-N 0 0 321.464 5.161 20 0 DKADRN Cc1cccc([C@@H]2CCCN2C(=O)C[C@H](C)c2ccccc2C)c1 ZINC000522507099 340602922 /nfs/dbraw/zinc/60/29/22/340602922.db2.gz YCFKQVZNRXHCFK-RXVVDRJESA-N 0 0 321.464 5.161 20 0 DKADRN Cc1cccc([C@H]2CCCN2C(=O)C[C@@H](C)c2ccccc2C)c1 ZINC000522507100 340602846 /nfs/dbraw/zinc/60/28/46/340602846.db2.gz YCFKQVZNRXHCFK-WIYYLYMNSA-N 0 0 321.464 5.161 20 0 DKADRN Cc1ccc(C(=O)N(c2ccc(F)cc2Cl)C(C)C)c(C)c1 ZINC000522512589 340603015 /nfs/dbraw/zinc/60/30/15/340603015.db2.gz KCIBDVHUARVSBU-UHFFFAOYSA-N 0 0 319.807 5.151 20 0 DKADRN Clc1ccc2nc(-c3cnccn3)cc(-c3ccccc3)c2c1 ZINC000522549054 340604002 /nfs/dbraw/zinc/60/40/02/340604002.db2.gz XHOYEUPHZCBMRF-UHFFFAOYSA-N 0 0 317.779 5.012 20 0 DKADRN Cc1ccoc1C(=O)Nc1ccc(CCCc2ccccc2)cc1 ZINC000522552858 340604122 /nfs/dbraw/zinc/60/41/22/340604122.db2.gz KRSBFVQCLUTUPG-UHFFFAOYSA-N 0 0 319.404 5.016 20 0 DKADRN CCCCCN(CCCCC)C(=O)c1csc(C(C)C)n1 ZINC000522570343 340604658 /nfs/dbraw/zinc/60/46/58/340604658.db2.gz MGJYYWYZYQCMBR-UHFFFAOYSA-N 0 0 310.507 5.089 20 0 DKADRN Cc1cccc(N(C(=O)CCc2ccc(Cl)s2)C(C)C)c1 ZINC000522571223 340604725 /nfs/dbraw/zinc/60/47/25/340604725.db2.gz MTOTZPCDXGUHBP-UHFFFAOYSA-N 0 0 321.873 5.084 20 0 DKADRN Cc1ccc(-c2nnc(SC[C@H](C)c3ccccc3)o2)cc1C ZINC000522573756 340604746 /nfs/dbraw/zinc/60/47/46/340604746.db2.gz BMKCJHASJNIJGJ-HNNXBMFYSA-N 0 0 324.449 5.249 20 0 DKADRN Cc1cccc(N(C(=O)c2ccc(C(F)(F)F)cc2)C(C)C)c1 ZINC000522582179 340604915 /nfs/dbraw/zinc/60/49/15/340604915.db2.gz GJTXVKBCXHTOKS-UHFFFAOYSA-N 0 0 321.342 5.069 20 0 DKADRN Cc1ccc2oc(C(=O)N(c3cccc(C)c3)C(C)C)cc2c1 ZINC000522583386 340605018 /nfs/dbraw/zinc/60/50/18/340605018.db2.gz WQLCVOOBKVNCEI-UHFFFAOYSA-N 0 0 307.393 5.105 20 0 DKADRN Cc1csc(-c2cccc(NCc3ccccc3Cl)c2)n1 ZINC000522617676 340605802 /nfs/dbraw/zinc/60/58/02/340605802.db2.gz PKSBYWGVIFGQMI-UHFFFAOYSA-N 0 0 314.841 5.384 20 0 DKADRN CC(C)(C)[C@H]1CCCN(C(=O)Nc2cccc(C(F)F)c2)CC1 ZINC000522617877 340605751 /nfs/dbraw/zinc/60/57/51/340605751.db2.gz AVCIKUHQFSKHHC-AWEZNQCLSA-N 0 0 324.415 5.304 20 0 DKADRN CC(C)(C)[C@@H]1CCCN(C(=O)Nc2cccc(C(F)F)c2)CC1 ZINC000522617878 340605718 /nfs/dbraw/zinc/60/57/18/340605718.db2.gz AVCIKUHQFSKHHC-CQSZACIVSA-N 0 0 324.415 5.304 20 0 DKADRN CSc1cccc(NC(=O)N2CCC[C@H](C(C)(C)C)CC2)c1 ZINC000522626704 340605954 /nfs/dbraw/zinc/60/59/54/340605954.db2.gz RCAOOBYRJKICLV-AWEZNQCLSA-N 0 0 320.502 5.089 20 0 DKADRN COCCCCCS[C@H](C)c1ccccc1Br ZINC000522628652 340605979 /nfs/dbraw/zinc/60/59/79/340605979.db2.gz WTMWYONVJIAWPO-GFCCVEGCSA-N 0 0 317.292 5.060 20 0 DKADRN COCCCCCS[C@@H](C)c1ccccc1Br ZINC000522628653 340606005 /nfs/dbraw/zinc/60/60/05/340606005.db2.gz WTMWYONVJIAWPO-LBPRGKRZSA-N 0 0 317.292 5.060 20 0 DKADRN CC(C)n1ccc(CSCc2ccc(Cl)c(Cl)c2)n1 ZINC000522629739 340606162 /nfs/dbraw/zinc/60/61/62/340606162.db2.gz CXIVLZBJJORSRX-UHFFFAOYSA-N 0 0 315.269 5.204 20 0 DKADRN Cc1nc(S[C@H](Cc2ccccc2)c2ccccc2)oc1C ZINC000522635860 340606271 /nfs/dbraw/zinc/60/62/71/340606271.db2.gz RICVZXIWESUNRG-GOSISDBHSA-N 0 0 309.434 5.368 20 0 DKADRN c1csc([C@@H](Cc2ccccc2)Nc2nc3ccccc3o2)c1 ZINC000522648894 340606780 /nfs/dbraw/zinc/60/67/80/340606780.db2.gz IGYGUIRFYRBODU-MRXNPFEDSA-N 0 0 320.417 5.285 20 0 DKADRN Fc1ccccc1Cc1nc(-c2c[nH]c3ccccc23)cs1 ZINC000522649814 340606740 /nfs/dbraw/zinc/60/67/40/340606740.db2.gz BINPNXSUZCORJG-UHFFFAOYSA-N 0 0 308.381 5.021 20 0 DKADRN CCCN(C)C(=O)Nc1cccc(CSC2CCCCC2)c1 ZINC000522652753 340606872 /nfs/dbraw/zinc/60/68/72/340606872.db2.gz BDJXIVOJULSERH-UHFFFAOYSA-N 0 0 320.502 5.126 20 0 DKADRN CCCc1ccccc1NC(=O)N(Cc1ccccc1)[C@H](C)CC ZINC000522662374 340607028 /nfs/dbraw/zinc/60/70/28/340607028.db2.gz NRJXWFGRAUOKCM-QGZVFWFLSA-N 0 0 324.468 5.472 20 0 DKADRN O=C(CC1CCCC1)N1CCCCC[C@@H]1c1ccc(Cl)cc1 ZINC000522680780 333163786 /nfs/dbraw/zinc/16/37/86/333163786.db2.gz XJYNXUSTIMKXKO-GOSISDBHSA-N 0 0 319.876 5.364 20 0 DKADRN O=C(CC1CCCC1)N1CCCCC[C@H]1c1ccc(Cl)cc1 ZINC000522680781 333163761 /nfs/dbraw/zinc/16/37/61/333163761.db2.gz XJYNXUSTIMKXKO-SFHVURJKSA-N 0 0 319.876 5.364 20 0 DKADRN CC(C)(C)CC(=O)N1CCCCC[C@H]1c1ccc(Cl)cc1 ZINC000522681852 333164072 /nfs/dbraw/zinc/16/40/72/333164072.db2.gz PMAMJBPGBLOXMV-INIZCTEOSA-N 0 0 307.865 5.220 20 0 DKADRN CC(C)(C)CC(=O)N1CCCCC[C@@H]1c1ccc(Cl)cc1 ZINC000522681853 333164133 /nfs/dbraw/zinc/16/41/33/333164133.db2.gz PMAMJBPGBLOXMV-MRXNPFEDSA-N 0 0 307.865 5.220 20 0 DKADRN Cc1cc(Cl)cc2nc(S[C@@H](C)c3cccnc3)oc21 ZINC000522685119 333165273 /nfs/dbraw/zinc/16/52/73/333165273.db2.gz OLFSVSBOVOMVDT-JTQLQIEISA-N 0 0 304.802 5.038 20 0 DKADRN Cc1cc(Cl)cc2nc(S[C@H](C)c3cccnc3)oc21 ZINC000522685120 333165214 /nfs/dbraw/zinc/16/52/14/333165214.db2.gz OLFSVSBOVOMVDT-SNVBAGLBSA-N 0 0 304.802 5.038 20 0 DKADRN Clc1ccc(-c2nc(CSc3cccs3)co2)cc1 ZINC000522686221 333165602 /nfs/dbraw/zinc/16/56/02/333165602.db2.gz PUPVGRRXWURPNL-UHFFFAOYSA-N 0 0 307.827 5.349 20 0 DKADRN Fc1ccccc1-c1nc(CSc2cccs2)cs1 ZINC000522687314 333165977 /nfs/dbraw/zinc/16/59/77/333165977.db2.gz FHBIVEWZEUZJMW-UHFFFAOYSA-N 0 0 307.440 5.303 20 0 DKADRN CCc1nc(CSc2nc3cc(Cl)cc(C)c3o2)cs1 ZINC000522688352 333166428 /nfs/dbraw/zinc/16/64/28/333166428.db2.gz PPAHUJAMBYDRIJ-UHFFFAOYSA-N 0 0 324.858 5.101 20 0 DKADRN Cc1oc(-c2ccccc2)nc1COc1ccc(OC(C)C)cc1 ZINC000522692342 333167391 /nfs/dbraw/zinc/16/73/91/333167391.db2.gz DHPDDQMWAZYDID-UHFFFAOYSA-N 0 0 323.392 5.016 20 0 DKADRN CC[C@@H]1CCCN(C(=O)Nc2cc(Cl)ccc2Cl)CC1 ZINC000522711476 333172590 /nfs/dbraw/zinc/17/25/90/333172590.db2.gz AUGJWKUQIYVXRZ-LLVKDONJSA-N 0 0 315.244 5.037 20 0 DKADRN CC[C@H]1CCCN(C(=O)Nc2cc(Cl)ccc2Cl)CC1 ZINC000522711477 333172567 /nfs/dbraw/zinc/17/25/67/333172567.db2.gz AUGJWKUQIYVXRZ-NSHDSACASA-N 0 0 315.244 5.037 20 0 DKADRN Cc1cc(C)c(NC(=O)NCC(C)(C)Cc2ccccc2)c(C)c1 ZINC000522713258 333172821 /nfs/dbraw/zinc/17/28/21/333172821.db2.gz YEEVROOLEDHIGH-UHFFFAOYSA-N 0 0 324.468 5.002 20 0 DKADRN CC(C)c1ccccc1NC(=O)NCC(C)(C)Cc1ccccc1 ZINC000522713519 333173415 /nfs/dbraw/zinc/17/34/15/333173415.db2.gz FTURRWOWAWVHDO-UHFFFAOYSA-N 0 0 324.468 5.200 20 0 DKADRN CC(C)[C@@H]1CCCCN1C(=O)Nc1cc(Cl)ccc1Cl ZINC000522716472 333175101 /nfs/dbraw/zinc/17/51/01/333175101.db2.gz FPKGXTLKDSVGBK-AWEZNQCLSA-N 0 0 315.244 5.036 20 0 DKADRN CC(C)[C@H]1CCCCN1C(=O)Nc1cc(Cl)ccc1Cl ZINC000522716473 333175022 /nfs/dbraw/zinc/17/50/22/333175022.db2.gz FPKGXTLKDSVGBK-CQSZACIVSA-N 0 0 315.244 5.036 20 0 DKADRN CCC(CC)N(C(=O)[C@@H]1C[C@H]1c1cccc2ccccc21)C1CC1 ZINC000522718116 333176099 /nfs/dbraw/zinc/17/60/99/333176099.db2.gz NIFAKMUUKMBPQW-LEWJYISDSA-N 0 0 321.464 5.123 20 0 DKADRN CCC(CC)N(C(=O)[C@@H]1C[C@@H]1c1cccc2ccccc21)C1CC1 ZINC000522718117 333176097 /nfs/dbraw/zinc/17/60/97/333176097.db2.gz NIFAKMUUKMBPQW-NHCUHLMSSA-N 0 0 321.464 5.123 20 0 DKADRN CCC(CC)N(C(=O)[C@H]1C[C@@H]1c1cccc2ccccc21)C1CC1 ZINC000522718118 333176251 /nfs/dbraw/zinc/17/62/51/333176251.db2.gz NIFAKMUUKMBPQW-RTWAWAEBSA-N 0 0 321.464 5.123 20 0 DKADRN CCC(CC)N(C(=O)[C@H]1C[C@H]1c1cccc2ccccc21)C1CC1 ZINC000522718119 333176144 /nfs/dbraw/zinc/17/61/44/333176144.db2.gz NIFAKMUUKMBPQW-SFTDATJTSA-N 0 0 321.464 5.123 20 0 DKADRN O=C(c1cc2cc(F)ccc2o1)N(c1ccccc1)C1CCCC1 ZINC000522721505 333177126 /nfs/dbraw/zinc/17/71/26/333177126.db2.gz NMDUMBVLHKZJHO-UHFFFAOYSA-N 0 0 323.367 5.161 20 0 DKADRN Cc1cccc([C@@H]2CCCCCN2C(=O)CC2=CCCCC2)c1 ZINC000522730899 333180069 /nfs/dbraw/zinc/18/00/69/333180069.db2.gz OXSXDNVKUUPYOA-FQEVSTJZSA-N 0 0 311.469 5.329 20 0 DKADRN Cc1cccc([C@H]2CCCCCN2C(=O)CC2=CCCCC2)c1 ZINC000522730900 333180233 /nfs/dbraw/zinc/18/02/33/333180233.db2.gz OXSXDNVKUUPYOA-HXUWFJFHSA-N 0 0 311.469 5.329 20 0 DKADRN Cc1cccc([C@@H]2CCCCCN2C(=O)CCc2ccccc2)c1 ZINC000522731475 333179947 /nfs/dbraw/zinc/17/99/47/333179947.db2.gz RIAVAGHLTWSUAH-NRFANRHFSA-N 0 0 321.464 5.072 20 0 DKADRN Cc1cccc([C@H]2CCCCCN2C(=O)CCc2ccccc2)c1 ZINC000522731476 333179894 /nfs/dbraw/zinc/17/98/94/333179894.db2.gz RIAVAGHLTWSUAH-OAQYLSRUSA-N 0 0 321.464 5.072 20 0 DKADRN CC[C@H](C)Sc1ccc(NC(=O)N2C3CCC2CC3)c(C)c1 ZINC000522731807 333180005 /nfs/dbraw/zinc/18/00/05/333180005.db2.gz ZYUPNVYUUHFESJ-NFOMZHRRSA-N 0 0 318.486 5.044 20 0 DKADRN CC[C@@H](C)Sc1ccc(NC(=O)N2C3CCC2CC3)c(C)c1 ZINC000522731808 333180004 /nfs/dbraw/zinc/18/00/04/333180004.db2.gz ZYUPNVYUUHFESJ-WLYUNCDWSA-N 0 0 318.486 5.044 20 0 DKADRN Cc1cccc(C)c1NC(=O)c1ccc(OC2CCCCC2)cc1 ZINC000522739070 333183555 /nfs/dbraw/zinc/18/35/55/333183555.db2.gz DGONDYVIQSIGRC-UHFFFAOYSA-N 0 0 323.436 5.267 20 0 DKADRN C[C@@H](NCc1cc2ccccc2o1)c1cccc(Cl)c1Cl ZINC000522756881 333385639 /nfs/dbraw/zinc/38/56/39/333385639.db2.gz LPFDYLTUPVUYNJ-LLVKDONJSA-N 0 0 320.219 5.590 20 0 DKADRN C[C@H](NCc1cc2ccccc2o1)c1cccc(Cl)c1Cl ZINC000522756882 333385446 /nfs/dbraw/zinc/38/54/46/333385446.db2.gz LPFDYLTUPVUYNJ-NSHDSACASA-N 0 0 320.219 5.590 20 0 DKADRN Cc1cccc(NC(=O)N[C@H](C)c2cccc(Cl)c2Cl)c1 ZINC000522757474 333385608 /nfs/dbraw/zinc/38/56/08/333385608.db2.gz IYZDBJJCAPSNEL-LLVKDONJSA-N 0 0 323.223 5.185 20 0 DKADRN Cc1cccc(NC(=O)N[C@@H](C)c2cccc(Cl)c2Cl)c1 ZINC000522757475 333385867 /nfs/dbraw/zinc/38/58/67/333385867.db2.gz IYZDBJJCAPSNEL-NSHDSACASA-N 0 0 323.223 5.185 20 0 DKADRN CCCCCSCCCC(=O)Nc1c(C)cc(C)cc1C ZINC000522758259 333385761 /nfs/dbraw/zinc/38/57/61/333385761.db2.gz ORUWFHDXDUBZSX-UHFFFAOYSA-N 0 0 307.503 5.254 20 0 DKADRN C[C@@H](Nc1ncnc2ccsc21)c1cccc(Cl)c1Cl ZINC000522759491 333386132 /nfs/dbraw/zinc/38/61/32/333386132.db2.gz CHQOXPGBZJOYTG-MRVPVSSYSA-N 0 0 324.236 5.171 20 0 DKADRN C[C@H](Nc1ncnc2ccsc21)c1cccc(Cl)c1Cl ZINC000522759492 333386101 /nfs/dbraw/zinc/38/61/01/333386101.db2.gz CHQOXPGBZJOYTG-QMMMGPOBSA-N 0 0 324.236 5.171 20 0 DKADRN CC(C)c1cc(N[C@@H](C)c2cccc(Cl)c2Cl)ncn1 ZINC000522760254 333386009 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/nfs/dbraw/zinc/38/84/25/333388425.db2.gz ZYQYKWXFQASTIC-GFCCVEGCSA-N 0 0 315.244 5.036 20 0 DKADRN CC(C)C[C@@H]1CCCN1C(=O)Nc1cc(Cl)ccc1Cl ZINC000522774077 333388419 /nfs/dbraw/zinc/38/84/19/333388419.db2.gz ZYQYKWXFQASTIC-LBPRGKRZSA-N 0 0 315.244 5.036 20 0 DKADRN Cc1cccc(NC(=O)Nc2ccc3oc(C(C)C)nc3c2)c1C ZINC000522785645 333391219 /nfs/dbraw/zinc/39/12/19/333391219.db2.gz AFKGPNOCJGMAPG-UHFFFAOYSA-N 0 0 323.396 5.212 20 0 DKADRN Cc1ccc(C)c(NC(=O)c2cccc(Nc3ccccc3)c2)c1 ZINC000522809193 336387092 /nfs/dbraw/zinc/38/70/92/336387092.db2.gz ZWCWBACQBPDRQN-UHFFFAOYSA-N 0 0 316.404 5.299 20 0 DKADRN Cc1ccccc1NC(=O)Nc1cccc(Cl)c1OC(C)C ZINC000522833058 340607632 /nfs/dbraw/zinc/60/76/32/340607632.db2.gz HIQVSRRRZORYAR-UHFFFAOYSA-N 0 0 318.804 5.080 20 0 DKADRN CC(C)Oc1c(Cl)cccc1NCc1cccc2cc[nH]c21 ZINC000522839723 340607754 /nfs/dbraw/zinc/60/77/54/340607754.db2.gz FSMUFMWNZLPREP-UHFFFAOYSA-N 0 0 314.816 5.221 20 0 DKADRN CCCCCN(C(=O)N[C@@H](C)c1cc(C)sc1C)C(C)C ZINC000522845132 340607940 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340611807 /nfs/dbraw/zinc/61/18/07/340611807.db2.gz ZUBNHBAHVTZVRE-LBPRGKRZSA-N 0 0 301.436 5.398 20 0 DKADRN CCc1noc([C@@H](C)S[C@H](C)c2ccc3ccccc3c2)n1 ZINC000522972045 340611983 /nfs/dbraw/zinc/61/19/83/340611983.db2.gz MVDPZDOJRCJJRM-CHWSQXEVSA-N 0 0 312.438 5.341 20 0 DKADRN CCc1noc([C@@H](C)S[C@H](C)c2cccc3ccccc32)n1 ZINC000522972277 340611947 /nfs/dbraw/zinc/61/19/47/340611947.db2.gz YZSXIMMPVXEQGG-CHWSQXEVSA-N 0 0 312.438 5.341 20 0 DKADRN C[C@@H](Nc1cccc(COCC2CC2)c1)c1ccc(F)c(F)c1 ZINC000522972955 340611981 /nfs/dbraw/zinc/61/19/81/340611981.db2.gz ASOVCSRBLHJPSK-CYBMUJFWSA-N 0 0 317.379 5.065 20 0 DKADRN CC(C)c1nc(CSCc2ccc3ccccc3n2)cs1 ZINC000522973275 340611930 /nfs/dbraw/zinc/61/19/30/340611930.db2.gz QAYPGPXYLHESFR-UHFFFAOYSA-N 0 0 314.479 5.248 20 0 DKADRN CCCCCc1ccc(NC(=O)N(C)[C@@H](C)CCSC)cc1 ZINC000523022838 340613946 /nfs/dbraw/zinc/61/39/46/340613946.db2.gz OERFRWCUXLIRBU-HNNXBMFYSA-N 0 0 322.518 5.025 20 0 DKADRN CCCCCc1ccc(NC(=O)N(C)[C@H](C)CCSC)cc1 ZINC000523022839 340613956 /nfs/dbraw/zinc/61/39/56/340613956.db2.gz OERFRWCUXLIRBU-OAHLLOKOSA-N 0 0 322.518 5.025 20 0 DKADRN CC(C)[C@@H](NC(=O)[C@H](C)c1ccsc1)c1ccc(Cl)cc1 ZINC000523085156 340614569 /nfs/dbraw/zinc/61/45/69/340614569.db2.gz LGDCOVHNWZKFHZ-MLGOLLRUSA-N 0 0 321.873 5.019 20 0 DKADRN CC(C)[C@H](NC(=O)[C@H](C)c1ccsc1)c1ccc(Cl)cc1 ZINC000523085157 340614529 /nfs/dbraw/zinc/61/45/29/340614529.db2.gz LGDCOVHNWZKFHZ-WBMJQRKESA-N 0 0 321.873 5.019 20 0 DKADRN CC(C)[C@@H](NC(=O)[C@@H](C)c1cccs1)c1ccc(Cl)cc1 ZINC000523085366 340614561 /nfs/dbraw/zinc/61/45/61/340614561.db2.gz VLNHVIZBBMEAFG-BLLLJJGKSA-N 0 0 321.873 5.019 20 0 DKADRN CC(C)[C@@H](NC(=O)[C@H](C)c1cccs1)c1ccc(Cl)cc1 ZINC000523085368 340614544 /nfs/dbraw/zinc/61/45/44/340614544.db2.gz VLNHVIZBBMEAFG-MLGOLLRUSA-N 0 0 321.873 5.019 20 0 DKADRN CC[C@H](CC(=O)Nc1cccc(C(F)F)c1)c1ccc(C)cc1 ZINC000523091352 340614697 /nfs/dbraw/zinc/61/46/97/340614697.db2.gz WTMRDVTYADZESL-CQSZACIVSA-N 0 0 317.379 5.455 20 0 DKADRN 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Cc1ccc([C@@H]2CCCCCN2C(=O)CC2CCC(C)CC2)o1 ZINC000523132542 340616210 /nfs/dbraw/zinc/61/62/10/340616210.db2.gz HFLCUWRMSKLORW-VJFUWPCTSA-N 0 0 317.473 5.248 20 0 DKADRN CC[C@@H](CC(=O)N1CCC[C@@H]1c1ccccc1)c1ccc(C)cc1 ZINC000523135527 340616285 /nfs/dbraw/zinc/61/62/85/340616285.db2.gz OKCKHQKBGLRGHX-GHTZIAJQSA-N 0 0 321.464 5.242 20 0 DKADRN CC[C@@H](CC(=O)N1CCC[C@H]1c1ccccc1)c1ccc(C)cc1 ZINC000523135529 340616308 /nfs/dbraw/zinc/61/63/08/340616308.db2.gz OKCKHQKBGLRGHX-RXVVDRJESA-N 0 0 321.464 5.242 20 0 DKADRN Cc1ccccc1[C@@H](C(C)C)N(C)C(=O)[C@H](C)c1ccsc1 ZINC000523137405 340616454 /nfs/dbraw/zinc/61/64/54/340616454.db2.gz WULFZGOALISQFX-CRAIPNDOSA-N 0 0 315.482 5.016 20 0 DKADRN Cc1ccccc1[C@@H](C(C)C)N(C)C(=O)[C@@H](C)c1ccsc1 ZINC000523137406 340616439 /nfs/dbraw/zinc/61/64/39/340616439.db2.gz WULFZGOALISQFX-MAUKXSAKSA-N 0 0 315.482 5.016 20 0 DKADRN Cc1ccccc1[C@H](C(C)C)N(C)C(=O)[C@H](C)c1ccsc1 ZINC000523137407 340616437 /nfs/dbraw/zinc/61/64/37/340616437.db2.gz WULFZGOALISQFX-QAPCUYQASA-N 0 0 315.482 5.016 20 0 DKADRN Cc1ccccc1[C@H](CC(C)C)NC(=O)[C@H](C)c1ccsc1 ZINC000523138209 340616432 /nfs/dbraw/zinc/61/64/32/340616432.db2.gz IVXZPTFJIDSVSR-QAPCUYQASA-N 0 0 315.482 5.064 20 0 DKADRN Cc1nc(-c2cccc(NC(=O)C3CCCCCC3)c2)cs1 ZINC000523153356 340617026 /nfs/dbraw/zinc/61/70/26/340617026.db2.gz FEYHRPGGKJQXDL-UHFFFAOYSA-N 0 0 314.454 5.027 20 0 DKADRN CC(C)[C@H](NC(=O)[C@@H](C)c1ccsc1)c1ccccc1Cl ZINC000523157175 340617137 /nfs/dbraw/zinc/61/71/37/340617137.db2.gz LOVXUHHAXBEUPH-LRDDRELGSA-N 0 0 321.873 5.019 20 0 DKADRN CC(C)[C@@H](NC(=O)[C@H](C)c1ccsc1)c1ccccc1Cl ZINC000523157176 340617045 /nfs/dbraw/zinc/61/70/45/340617045.db2.gz LOVXUHHAXBEUPH-MLGOLLRUSA-N 0 0 321.873 5.019 20 0 DKADRN Cc1nc(-c2ccc(NC(=O)C3CCCCCC3)cc2)cs1 ZINC000523165727 340617306 /nfs/dbraw/zinc/61/73/06/340617306.db2.gz WQJNQLXRKBIRHS-UHFFFAOYSA-N 0 0 314.454 5.027 20 0 DKADRN CCCC[C@H](CC)C(=O)Nc1cc(-c2ccncc2)ccc1C ZINC000523185320 340617464 /nfs/dbraw/zinc/61/74/64/340617464.db2.gz CHNARIFXOPNACR-INIZCTEOSA-N 0 0 310.441 5.212 20 0 DKADRN O=C(CCC1CCCC1)N1Cc2ccccc2-c2ccccc2C1 ZINC000523201228 340617759 /nfs/dbraw/zinc/61/77/59/340617759.db2.gz MEAJHPSPCQQBCD-UHFFFAOYSA-N 0 0 319.448 5.166 20 0 DKADRN O=C(CC1CCCCC1)N1Cc2ccccc2-c2ccccc2C1 ZINC000523201666 340617701 /nfs/dbraw/zinc/61/77/01/340617701.db2.gz KEBXMMMODGGLFQ-UHFFFAOYSA-N 0 0 319.448 5.166 20 0 DKADRN CCC[C@H](C)CC(=O)N1Cc2ccccc2-c2ccccc2C1 ZINC000523201900 340617749 /nfs/dbraw/zinc/61/77/49/340617749.db2.gz WOYKNGYPBIAWCF-INIZCTEOSA-N 0 0 307.437 5.022 20 0 DKADRN CCC[C@@H](C)CC(=O)N1Cc2ccccc2-c2ccccc2C1 ZINC000523201901 340617741 /nfs/dbraw/zinc/61/77/41/340617741.db2.gz WOYKNGYPBIAWCF-MRXNPFEDSA-N 0 0 307.437 5.022 20 0 DKADRN Cc1ccc(-c2ccncc2)cc1N[C@H](C)c1ccc(F)cc1 ZINC000523205648 340617858 /nfs/dbraw/zinc/61/78/58/340617858.db2.gz LWAGSTXVHMBMTK-OAHLLOKOSA-N 0 0 306.384 5.369 20 0 DKADRN C[C@H](SCc1cn2ccsc2n1)c1ccc(Cl)cc1 ZINC000523226647 340618222 /nfs/dbraw/zinc/61/82/22/340618222.db2.gz VFJFDFWDNNMDOI-JTQLQIEISA-N 0 0 308.859 5.044 20 0 DKADRN C[C@@H](SCc1cn2ccsc2n1)c1ccc(Cl)cc1 ZINC000523226648 340618170 /nfs/dbraw/zinc/61/81/70/340618170.db2.gz VFJFDFWDNNMDOI-SNVBAGLBSA-N 0 0 308.859 5.044 20 0 DKADRN CCCN(CCC)C(=O)c1cc(C)c(-c2ccc(F)cc2)s1 ZINC000523228080 340618180 /nfs/dbraw/zinc/61/81/80/340618180.db2.gz FZZCXEUAJKOQPI-UHFFFAOYSA-N 0 0 319.445 5.125 20 0 DKADRN CCCCCN(C(=O)c1csc(C(C)C)n1)[C@@H](C)CCC ZINC000523273743 340618469 /nfs/dbraw/zinc/61/84/69/340618469.db2.gz YSCWHRKAEDATGB-AWEZNQCLSA-N 0 0 310.507 5.088 20 0 DKADRN CCCCCN(C(=O)c1csc(C(C)C)n1)[C@H](C)CCC ZINC000523273744 340618467 /nfs/dbraw/zinc/61/84/67/340618467.db2.gz YSCWHRKAEDATGB-CQSZACIVSA-N 0 0 310.507 5.088 20 0 DKADRN Cc1cccc(N(C(=O)c2csc3ccccc23)C(C)C)c1 ZINC000523278053 340618579 /nfs/dbraw/zinc/61/85/79/340618579.db2.gz FPONUIQPAPOVEY-UHFFFAOYSA-N 0 0 309.434 5.265 20 0 DKADRN Cc1csc(-c2cccc(NC(=O)CC3CCCCC3)c2)n1 ZINC000523278660 340618554 /nfs/dbraw/zinc/61/85/54/340618554.db2.gz QXGJGRYJPIQAQA-UHFFFAOYSA-N 0 0 314.454 5.027 20 0 DKADRN Cc1cccc(N(C(=O)c2cc3sccc3s2)C(C)C)c1 ZINC000523280197 340618649 /nfs/dbraw/zinc/61/86/49/340618649.db2.gz LABYUSBQCQTZKW-UHFFFAOYSA-N 0 0 315.463 5.326 20 0 DKADRN Cc1cc(C(=O)N2CCCCC2)sc1-c1cccc(Cl)c1 ZINC000523287518 340618939 /nfs/dbraw/zinc/61/89/39/340618939.db2.gz LRCDCIGAVVZJIU-UHFFFAOYSA-N 0 0 319.857 5.003 20 0 DKADRN CC[C@@H](C)Sc1ccc(NC(=O)Nc2ccccc2)c(C)c1 ZINC000523310356 340619617 /nfs/dbraw/zinc/61/96/17/340619617.db2.gz HNOSNPHGKVSPDX-CQSZACIVSA-N 0 0 314.454 5.530 20 0 DKADRN CCCCCN(CCCCC)C(=O)c1nccc2ccccc21 ZINC000523319751 340620313 /nfs/dbraw/zinc/62/03/13/340620313.db2.gz AFSUSWPOKLICPA-UHFFFAOYSA-N 0 0 312.457 5.057 20 0 DKADRN CC(C)C[C@H](NC(=O)N1CCC[C@H]1CC(C)C)c1cccs1 ZINC000523331877 340620839 /nfs/dbraw/zinc/62/08/39/340620839.db2.gz USJMCRIGXCREDK-HOTGVXAUSA-N 0 0 322.518 5.055 20 0 DKADRN CC(C)Oc1ccccc1[C@H](C)Nc1cccc(C(F)(F)F)n1 ZINC000523341468 340620995 /nfs/dbraw/zinc/62/09/95/340620995.db2.gz GBFGEWROZHMFJR-LBPRGKRZSA-N 0 0 324.346 5.061 20 0 DKADRN Cc1cc(C)c(NC(=O)N[C@H]2CCCCc3ccccc32)c(C)c1 ZINC000523372403 340622054 /nfs/dbraw/zinc/62/20/54/340622054.db2.gz IITDDXPAJNPTCK-IBGZPJMESA-N 0 0 322.452 5.201 20 0 DKADRN Cc1cc(C)c(NC(=O)N[C@@H]2CCCCc3ccccc32)c(C)c1 ZINC000523372404 340622093 /nfs/dbraw/zinc/62/20/93/340622093.db2.gz IITDDXPAJNPTCK-LJQANCHMSA-N 0 0 322.452 5.201 20 0 DKADRN CCCCN(C(=O)Nc1ccccc1F)[C@@H](C)c1ccccc1 ZINC000523389573 340622691 /nfs/dbraw/zinc/62/26/91/340622691.db2.gz ZBEXLBQEHMSBBW-HNNXBMFYSA-N 0 0 314.404 5.221 20 0 DKADRN CC[C@@H](Nc1cccc([C@@H](C)OC)c1)c1ccc(F)cc1F ZINC000523389763 340622747 /nfs/dbraw/zinc/62/27/47/340622747.db2.gz DUZKDNFHGLAWJB-KZULUSFZSA-N 0 0 305.368 5.235 20 0 DKADRN CC[C@H](Nc1cccc([C@@H](C)OC)c1)c1ccc(F)cc1F ZINC000523389765 340622795 /nfs/dbraw/zinc/62/27/95/340622795.db2.gz DUZKDNFHGLAWJB-XIKOKIGWSA-N 0 0 305.368 5.235 20 0 DKADRN Cc1ccc([C@H]2CCCCCN2C(=O)Nc2cccc(C)c2)o1 ZINC000523389794 340622799 /nfs/dbraw/zinc/62/27/99/340622799.db2.gz GNFORRMXJWDGKD-QGZVFWFLSA-N 0 0 312.413 5.046 20 0 DKADRN CCCCN(C(=O)Nc1cccc(F)c1)[C@@H](C)c1ccccc1 ZINC000523390008 340622848 /nfs/dbraw/zinc/62/28/48/340622848.db2.gz QSDLCFCECNKGDD-HNNXBMFYSA-N 0 0 314.404 5.221 20 0 DKADRN CCCCN(C(=O)Nc1cccc(F)c1)[C@H](C)c1ccccc1 ZINC000523390009 340622838 /nfs/dbraw/zinc/62/28/38/340622838.db2.gz QSDLCFCECNKGDD-OAHLLOKOSA-N 0 0 314.404 5.221 20 0 DKADRN CC[C@H](S[C@H](C)c1nc(C(C)(C)C)no1)c1ccc(F)cc1 ZINC000523390562 340622921 /nfs/dbraw/zinc/62/29/21/340622921.db2.gz RMRSDUXANJSPDY-RISCZKNCSA-N 0 0 322.449 5.452 20 0 DKADRN Cc1ccc([C@@H]2CCCCCN2C(=O)Nc2ccc(C)cc2)o1 ZINC000523390653 340622837 /nfs/dbraw/zinc/62/28/37/340622837.db2.gz WNBSVUUUKDGMKC-KRWDZBQOSA-N 0 0 312.413 5.046 20 0 DKADRN Cc1ccc(C)c([C@H](C)N(C)C(=O)Nc2ccc(Cl)cc2)c1 ZINC000523390951 340622836 /nfs/dbraw/zinc/62/28/36/340622836.db2.gz NAAWIYPRGINIRT-AWEZNQCLSA-N 0 0 316.832 5.182 20 0 DKADRN Cc1ccc(C)c([C@H](C)N(C)C(=O)Nc2ccccc2Cl)c1 ZINC000523391660 340623021 /nfs/dbraw/zinc/62/30/21/340623021.db2.gz CWSHWEJYVSKREX-AWEZNQCLSA-N 0 0 316.832 5.182 20 0 DKADRN Cc1ccc(C)c([C@@H](C)N(C)C(=O)Nc2ccccc2Cl)c1 ZINC000523391661 340623041 /nfs/dbraw/zinc/62/30/41/340623041.db2.gz CWSHWEJYVSKREX-CQSZACIVSA-N 0 0 316.832 5.182 20 0 DKADRN Cc1cccc(C)c1NC(=O)NC(C)(C)c1cccc(Cl)c1 ZINC000523437255 340624156 /nfs/dbraw/zinc/62/41/56/340624156.db2.gz CALMINXRSAGBMS-UHFFFAOYSA-N 0 0 316.832 5.014 20 0 DKADRN CCc1ccc(NC(=O)N(C)[C@H](C)c2cc(C)ccc2C)cc1 ZINC000523442287 340624507 /nfs/dbraw/zinc/62/45/07/340624507.db2.gz VDTQUIQIHQANQO-MRXNPFEDSA-N 0 0 310.441 5.091 20 0 DKADRN CCc1ccccc1NC(=O)N(C)[C@H](C)c1cc(C)ccc1C ZINC000523443274 340624467 /nfs/dbraw/zinc/62/44/67/340624467.db2.gz JXYFMWZOMQKGJT-MRXNPFEDSA-N 0 0 310.441 5.091 20 0 DKADRN Cc1ccc(C)c([C@@H](C)N(C)C(=O)Nc2c(C)cc(C)cc2C)c1 ZINC000523447625 340624848 /nfs/dbraw/zinc/62/48/48/340624848.db2.gz VKPREBOPRYKHQT-GOSISDBHSA-N 0 0 324.468 5.454 20 0 DKADRN CCN(C(=O)Nc1ccccc1SC1CCCC1)C1CCC1 ZINC000523455945 340625260 /nfs/dbraw/zinc/62/52/60/340625260.db2.gz JDUSEBJKGAAQGV-UHFFFAOYSA-N 0 0 318.486 5.128 20 0 DKADRN Cc1cccc([C@H](C)C(=O)Nc2ccccc2-c2ccccc2)c1 ZINC000523486557 340626181 /nfs/dbraw/zinc/62/61/81/340626181.db2.gz YHVCFLUGCRBUBR-KRWDZBQOSA-N 0 0 315.416 5.404 20 0 DKADRN Cc1cccc([C@@H](C)C(=O)Nc2ccccc2-c2ccccc2)c1 ZINC000523486558 340626130 /nfs/dbraw/zinc/62/61/30/340626130.db2.gz YHVCFLUGCRBUBR-QGZVFWFLSA-N 0 0 315.416 5.404 20 0 DKADRN CSCCCCC(=O)N[C@H](CC1CCCCC1)C(C)(C)C ZINC000523492568 331802281 /nfs/dbraw/zinc/80/22/81/331802281.db2.gz AAHPFYFODKHTTM-MRXNPFEDSA-N 0 0 313.551 5.021 20 0 DKADRN CCCc1nc(CS[C@@H](C)c2cccc3ccccc32)no1 ZINC000523493064 340626415 /nfs/dbraw/zinc/62/64/15/340626415.db2.gz XUEWQPLVZCODQB-ZDUSSCGKSA-N 0 0 312.438 5.170 20 0 DKADRN CC[C@@H](c1ccccc1)N(CC)C(=O)[C@H](C)c1cccc(C)c1 ZINC000523497228 340626435 /nfs/dbraw/zinc/62/64/35/340626435.db2.gz UABWSLVLBIUGRM-XLIONFOSSA-N 0 0 309.453 5.098 20 0 DKADRN CC[C@H](c1ccccc1)N(CC)C(=O)[C@H](C)c1cccc(C)c1 ZINC000523497229 340626467 /nfs/dbraw/zinc/62/64/67/340626467.db2.gz UABWSLVLBIUGRM-YLJYHZDGSA-N 0 0 309.453 5.098 20 0 DKADRN CCCN(C(=O)[C@H](C)c1cccc(C)c1)[C@H]1CCc2ccccc21 ZINC000523497410 340626629 /nfs/dbraw/zinc/62/66/29/340626629.db2.gz CCNXJNUKJAQHMR-UTKZUKDTSA-N 0 0 321.464 5.025 20 0 DKADRN CC(C)[C@H](Cc1ccccc1)C(=O)Nc1cccc(C(F)F)c1 ZINC000523500613 340626698 /nfs/dbraw/zinc/62/66/98/340626698.db2.gz KJJGOHCCULENOX-KRWDZBQOSA-N 0 0 317.379 5.078 20 0 DKADRN CC(C)[C@@H](Cc1ccccc1)C(=O)Nc1cccc(C(F)F)c1 ZINC000523500614 340626715 /nfs/dbraw/zinc/62/67/15/340626715.db2.gz KJJGOHCCULENOX-QGZVFWFLSA-N 0 0 317.379 5.078 20 0 DKADRN CCCC1CCC(N(C(=O)CCCCSC)C(C)C)CC1 ZINC000523501380 340626823 /nfs/dbraw/zinc/62/68/23/340626823.db2.gz XZLBMHAUBGFVBT-UHFFFAOYSA-N 0 0 313.551 5.116 20 0 DKADRN CC(C)C(=O)Nc1ccc(Oc2cccc(C(F)(F)F)c2)cc1 ZINC000523504684 340626999 /nfs/dbraw/zinc/62/69/99/340626999.db2.gz LFEXECIDZSKQGP-UHFFFAOYSA-N 0 0 323.314 5.092 20 0 DKADRN Clc1ccc(CNc2ccc(COC3CCCC3)cc2)s1 ZINC000523521792 340627712 /nfs/dbraw/zinc/62/77/12/340627712.db2.gz CZFFQKFEZJXVMK-UHFFFAOYSA-N 0 0 321.873 5.473 20 0 DKADRN Cc1cc(F)ccc1CNc1ccc(COC2CCCC2)cc1 ZINC000523527712 340627962 /nfs/dbraw/zinc/62/79/62/340627962.db2.gz IMMFUOXNDXMPNE-UHFFFAOYSA-N 0 0 313.416 5.205 20 0 DKADRN Cc1ccc(C(=O)Nc2ccc(COC3CCCC3)cc2)cc1C ZINC000523530737 340628051 /nfs/dbraw/zinc/62/80/51/340628051.db2.gz IFPZVJSSYKNJHP-UHFFFAOYSA-N 0 0 323.436 5.015 20 0 DKADRN CC(=O)Nc1ccc(Cl)cc1NCc1ccc2ccccc2c1 ZINC000523534060 340628141 /nfs/dbraw/zinc/62/81/41/340628141.db2.gz LJTTUQBMDNREDS-UHFFFAOYSA-N 0 0 324.811 5.064 20 0 DKADRN Cc1ccc(-c2ccncc2)cc1NC(=O)CCC1CCCCC1 ZINC000523580127 340628979 /nfs/dbraw/zinc/62/89/79/340628979.db2.gz RRWLEVHODSUZLR-UHFFFAOYSA-N 0 0 322.452 5.356 20 0 DKADRN Cc1nc(-c2ccco2)ccc1C(=O)Nc1ccccc1C(C)C ZINC000523582193 340629125 /nfs/dbraw/zinc/62/91/25/340629125.db2.gz ZBSHXANCTZBTHM-UHFFFAOYSA-N 0 0 320.392 5.026 20 0 DKADRN CC(C)c1nnc(S[C@@H](C)c2ccc(C(C)(C)C)cc2)n1C ZINC000523582758 340629113 /nfs/dbraw/zinc/62/91/13/340629113.db2.gz YRSFKUWSFCLEDW-ZDUSSCGKSA-N 0 0 317.502 5.089 20 0 DKADRN Cc1cccc(NC(=O)[C@H](C)Sc2cccc(Cl)c2)c1C ZINC000523583312 340629121 /nfs/dbraw/zinc/62/91/21/340629121.db2.gz GYSFIFAZNCWFQT-ZDUSSCGKSA-N 0 0 319.857 5.076 20 0 DKADRN Cc1cccc(C(C)C)c1NC(=O)N[C@H]1c2ccccc2C[C@H]1C ZINC000523585495 340629237 /nfs/dbraw/zinc/62/92/37/340629237.db2.gz LPDNGINISRFPJU-FOIQADDNSA-N 0 0 322.452 5.173 20 0 DKADRN Cc1cccc(C(C)C)c1NC(=O)N[C@H]1c2ccccc2C[C@@H]1C ZINC000523585496 340629233 /nfs/dbraw/zinc/62/92/33/340629233.db2.gz LPDNGINISRFPJU-MGPUTAFESA-N 0 0 322.452 5.173 20 0 DKADRN Cc1cccc(C(C)C)c1NC(=O)N[C@@H]1c2ccccc2C[C@@H]1C ZINC000523585498 340629191 /nfs/dbraw/zinc/62/91/91/340629191.db2.gz LPDNGINISRFPJU-YWZLYKJASA-N 0 0 322.452 5.173 20 0 DKADRN CCC[C@@H](C)N(C)C(=O)Nc1ccc(C(F)(F)F)cc1Cl ZINC000523585667 340629212 /nfs/dbraw/zinc/62/92/12/340629212.db2.gz UZIIVTPSZWWZQR-SECBINFHSA-N 0 0 322.758 5.011 20 0 DKADRN CCC[C@H](C)N(C)C(=O)Nc1ccc(C(F)(F)F)cc1Cl ZINC000523585668 340629263 /nfs/dbraw/zinc/62/92/63/340629263.db2.gz UZIIVTPSZWWZQR-VIFPVBQESA-N 0 0 322.758 5.011 20 0 DKADRN CCN(C(=O)Nc1ccccc1C(C)(C)C)C1CCCCC1 ZINC000523593338 340629309 /nfs/dbraw/zinc/62/93/09/340629309.db2.gz SQLZWHLSYOITOQ-UHFFFAOYSA-N 0 0 302.462 5.171 20 0 DKADRN CCC1CCN(C(=O)Nc2ccc(-c3ccccc3)cc2C)CC1 ZINC000523612568 340629993 /nfs/dbraw/zinc/62/99/93/340629993.db2.gz HGOCWXSHBSVSAH-UHFFFAOYSA-N 0 0 322.452 5.316 20 0 DKADRN CC[C@H]1CCCN1C(=O)Nc1ccc(C(C)C)cc1C(C)C ZINC000523616594 340629924 /nfs/dbraw/zinc/62/99/24/340629924.db2.gz AMZTWEDETOKRQM-INIZCTEOSA-N 0 0 302.462 5.340 20 0 DKADRN CC[C@@H]1CCCN1C(=O)Nc1ccc(C(C)C)cc1C(C)C ZINC000523616595 340629969 /nfs/dbraw/zinc/62/99/69/340629969.db2.gz AMZTWEDETOKRQM-MRXNPFEDSA-N 0 0 302.462 5.340 20 0 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340650738 /nfs/dbraw/zinc/65/07/38/340650738.db2.gz BCLQJFWHHSQEQM-QFBILLFUSA-N 0 0 301.474 5.095 20 0 DKADRN CC[C@@H]1CCCCN1C(=O)C[C@@H](C)c1ccc(C(C)C)cc1 ZINC000524248673 340650735 /nfs/dbraw/zinc/65/07/35/340650735.db2.gz BCLQJFWHHSQEQM-VQIMIIECSA-N 0 0 301.474 5.095 20 0 DKADRN Cc1cccc(C(C)C)c1NC(=O)CC/C=C\c1ccccc1 ZINC000524249282 340650761 /nfs/dbraw/zinc/65/07/61/340650761.db2.gz WGNXFDGSSPOCPS-QPEQYQDCSA-N 0 0 307.437 5.551 20 0 DKADRN CC(C)c1ccc([C@@H](C)CC(=O)Nc2c(F)cccc2F)cc1 ZINC000524249498 340650840 /nfs/dbraw/zinc/65/08/40/340650840.db2.gz LRRYXZXLASDOAQ-ZDUSSCGKSA-N 0 0 317.379 5.221 20 0 DKADRN CC[C@@H](CC(=O)Nc1c(C)cc(C)cc1C)c1ccc(C)cc1 ZINC000524250117 340650836 /nfs/dbraw/zinc/65/08/36/340650836.db2.gz DGRVCNRKNNUOMZ-SFHVURJKSA-N 0 0 309.453 5.443 20 0 DKADRN CC[C@@H](CC(=O)N(C)[C@H](C)c1ccccc1)c1ccc(C)cc1 ZINC000524250300 340650848 /nfs/dbraw/zinc/65/08/48/340650848.db2.gz QECXFPYBNNEZFW-MSOLQXFVSA-N 0 0 309.453 5.098 20 0 DKADRN 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DKADRN CSc1ccsc1C(=O)N[C@H](CCC(C)C)C(C)(C)C ZINC000524529240 340656347 /nfs/dbraw/zinc/65/63/47/340656347.db2.gz ARVGXWRMCLIWME-CYBMUJFWSA-N 0 0 313.532 5.051 20 0 DKADRN CSc1ccsc1C(=O)N[C@@H](CCC(C)C)C(C)(C)C ZINC000524529241 340656385 /nfs/dbraw/zinc/65/63/85/340656385.db2.gz ARVGXWRMCLIWME-ZDUSSCGKSA-N 0 0 313.532 5.051 20 0 DKADRN CCC[C@@H](NC(=O)N(C)[C@H](C)c1cccs1)C1CCCCC1 ZINC000524529786 340656439 /nfs/dbraw/zinc/65/64/39/340656439.db2.gz FNGZBDTYVZKFTF-GDBMZVCRSA-N 0 0 322.518 5.200 20 0 DKADRN CCC[C@H](NC(=O)N(C)[C@H](C)c1cccs1)C1CCCCC1 ZINC000524529789 340656413 /nfs/dbraw/zinc/65/64/13/340656413.db2.gz FNGZBDTYVZKFTF-ZBFHGGJFSA-N 0 0 322.518 5.200 20 0 DKADRN CCC[C@@H](C)C(=O)Nc1ccccc1O[C@@H](C)c1ccccc1 ZINC000524535376 340656678 /nfs/dbraw/zinc/65/66/78/340656678.db2.gz CDXWLTJZTZDMTR-CVEARBPZSA-N 0 0 311.425 5.201 20 0 DKADRN CCC[C@H](C)C(=O)Nc1ccccc1O[C@@H](C)c1ccccc1 ZINC000524535379 340656635 /nfs/dbraw/zinc/65/66/35/340656635.db2.gz CDXWLTJZTZDMTR-HOTGVXAUSA-N 0 0 311.425 5.201 20 0 DKADRN CCC[C@@H](C)C(=O)Nc1ccccc1O[C@H](C)c1ccccc1 ZINC000524535380 340656691 /nfs/dbraw/zinc/65/66/91/340656691.db2.gz CDXWLTJZTZDMTR-HZPDHXFCSA-N 0 0 311.425 5.201 20 0 DKADRN CCC[C@H](C)C(=O)Nc1ccccc1O[C@H](C)c1ccccc1 ZINC000524535382 340656620 /nfs/dbraw/zinc/65/66/20/340656620.db2.gz CDXWLTJZTZDMTR-JKSUJKDBSA-N 0 0 311.425 5.201 20 0 DKADRN C[C@@H](C(=O)Nc1cc(Cl)c(Cl)cc1Cl)C(C)(C)C ZINC000524537587 340656717 /nfs/dbraw/zinc/65/67/17/340656717.db2.gz WYJVSXGSHICFLN-ZETCQYMHSA-N 0 0 308.636 5.268 20 0 DKADRN CCC[C@@H]1CCCC[C@H]1NC(=O)Nc1cccc(C(F)F)c1 ZINC000524542017 340657012 /nfs/dbraw/zinc/65/70/12/340657012.db2.gz CFKHNLOENDQKFL-IUODEOHRSA-N 0 0 310.388 5.105 20 0 DKADRN CC(C)(C)c1ccccc1NC(=O)c1cc2cc(F)ccc2o1 ZINC000524553649 340657379 /nfs/dbraw/zinc/65/73/79/340657379.db2.gz UHJVWQGUXIAJIG-UHFFFAOYSA-N 0 0 311.356 5.122 20 0 DKADRN O=C(c1ccc(Cl)cc1F)N(c1ccccc1)C1CCCC1 ZINC000524569345 340657749 /nfs/dbraw/zinc/65/77/49/340657749.db2.gz 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340680610 /nfs/dbraw/zinc/68/06/10/340680610.db2.gz CAMSEYZNIMBSOK-KGLIPLIRSA-N 0 0 320.219 5.044 20 0 DKADRN Cc1cccc(NC(=O)[C@@H]2C[C@H]2c2cccc(Cl)c2)c1Cl ZINC000524793794 340680606 /nfs/dbraw/zinc/68/06/06/340680606.db2.gz CAMSEYZNIMBSOK-UONOGXRCSA-N 0 0 320.219 5.044 20 0 DKADRN CC[C@@H]1C[C@H](C)CN1C(=O)Nc1ccc2oc3ccccc3c2c1 ZINC000524794472 340680716 /nfs/dbraw/zinc/68/07/16/340680716.db2.gz QUCHJTHFYJFDCC-DZGCQCFKSA-N 0 0 322.408 5.238 20 0 DKADRN CC[C@H]1C[C@@H](C)CN1C(=O)Nc1ccc2oc3ccccc3c2c1 ZINC000524794473 340680657 /nfs/dbraw/zinc/68/06/57/340680657.db2.gz QUCHJTHFYJFDCC-HIFRSBDPSA-N 0 0 322.408 5.238 20 0 DKADRN CC[C@@H]1C[C@@H](C)CN1C(=O)Nc1ccc2oc3ccccc3c2c1 ZINC000524794474 340680643 /nfs/dbraw/zinc/68/06/43/340680643.db2.gz QUCHJTHFYJFDCC-UKRRQHHQSA-N 0 0 322.408 5.238 20 0 DKADRN CC[C@H]1C[C@H](C)CN1C(=O)Nc1ccc2oc3ccccc3c2c1 ZINC000524794475 340680713 /nfs/dbraw/zinc/68/07/13/340680713.db2.gz QUCHJTHFYJFDCC-ZFWWWQNUSA-N 0 0 322.408 5.238 20 0 DKADRN Cc1cccc(C)c1NC(=O)CCSc1ccccc1Cl ZINC000524794989 340680655 /nfs/dbraw/zinc/68/06/55/340680655.db2.gz OORSIWWRABZEHD-UHFFFAOYSA-N 0 0 319.857 5.078 20 0 DKADRN Cc1cc([C@H](C)NC(=O)Nc2cccc(C)c2Cl)c(C)s1 ZINC000524795671 340680717 /nfs/dbraw/zinc/68/07/17/340680717.db2.gz DWBUNGWJOXUTQK-NSHDSACASA-N 0 0 322.861 5.209 20 0 DKADRN Cc1cccc(NC(=O)N(CC2CC2)C2CCCCC2)c1Cl ZINC000524795878 340680659 /nfs/dbraw/zinc/68/06/59/340680659.db2.gz DSVSWAYNWBYZQO-UHFFFAOYSA-N 0 0 320.864 5.225 20 0 DKADRN CCN(Cc1ccc(C)cc1)C(=O)Nc1cccc(C)c1Cl ZINC000524796165 340680635 /nfs/dbraw/zinc/68/06/35/340680635.db2.gz VAJPGTOVLCVFRV-UHFFFAOYSA-N 0 0 316.832 5.011 20 0 DKADRN Cc1cccc(NCc2ncc(-c3ccc(F)cc3)o2)c1Cl ZINC000524796423 340680764 /nfs/dbraw/zinc/68/07/64/340680764.db2.gz DYWUWKOEEQQAGP-UHFFFAOYSA-N 0 0 316.763 5.055 20 0 DKADRN CSc1ccccc1NC(=O)[C@H](CC(C)C)c1ccccc1 ZINC000524814763 340681528 /nfs/dbraw/zinc/68/15/28/340681528.db2.gz SWRBALTWVWSSTL-MRXNPFEDSA-N 0 0 313.466 5.177 20 0 DKADRN 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CC[C@@H]1CCCCCN1C(=O)Nc1ccccc1OC(C)(C)C ZINC000524827609 340681776 /nfs/dbraw/zinc/68/17/76/340681776.db2.gz YOHZWPRFPIPVMJ-OAHLLOKOSA-N 0 0 318.461 5.050 20 0 DKADRN CCO[C@@H](C)c1nc(CSc2ccc(C)cc2C)cs1 ZINC000524834496 340681912 /nfs/dbraw/zinc/68/19/12/340681912.db2.gz XBGFIXUSWVVWBN-ZDUSSCGKSA-N 0 0 307.484 5.150 20 0 DKADRN CC(C)C[C@@H]1CCCCCN1C(=O)c1cccc(C(F)F)c1 ZINC000524844212 340682215 /nfs/dbraw/zinc/68/22/15/340682215.db2.gz DKWDASIZQJMLNY-INIZCTEOSA-N 0 0 309.400 5.055 20 0 DKADRN CCc1cc2c(ncnc2Oc2ccc(C)cc2Cl)s1 ZINC000524845207 340682338 /nfs/dbraw/zinc/68/23/38/340682338.db2.gz SCUGMVIVMLIWMY-UHFFFAOYSA-N 0 0 304.802 5.008 20 0 DKADRN Cc1cc2cc(NC(=O)[C@H](CC(C)C)c3ccccc3)ccc2[nH]1 ZINC000524855897 340682808 /nfs/dbraw/zinc/68/28/08/340682808.db2.gz ZOPWTWGFWNKJNF-LJQANCHMSA-N 0 0 320.436 5.245 20 0 DKADRN Cc1c2ccc3ccccc3c2oc1C(=O)N(C(C)C)C1CCC1 ZINC000524863973 340682944 /nfs/dbraw/zinc/68/29/44/340682944.db2.gz SFNZYNHPDOWGDQ-UHFFFAOYSA-N 0 0 321.420 5.298 20 0 DKADRN FC(F)(F)CCSCc1coc(-c2cccc(Cl)c2)n1 ZINC000524881539 340683358 /nfs/dbraw/zinc/68/33/58/340683358.db2.gz LESVHUWCUOQLPA-UHFFFAOYSA-N 0 0 321.751 5.181 20 0 DKADRN FC(F)(F)CCSCc1csc(-c2ccsc2)n1 ZINC000524885108 340683481 /nfs/dbraw/zinc/68/34/81/340683481.db2.gz JPAUJOYMHXNZOR-UHFFFAOYSA-N 0 0 309.403 5.057 20 0 DKADRN CC(C)C[C@@H]1CCCCCN1C(=O)Nc1ccccc1Cl ZINC000524885390 340683498 /nfs/dbraw/zinc/68/34/98/340683498.db2.gz VAMYQCQDKKGBAB-AWEZNQCLSA-N 0 0 308.853 5.163 20 0 DKADRN C[C@@H](SCCC(F)(F)F)c1ccc(OC(F)F)cc1 ZINC000524886506 340683657 /nfs/dbraw/zinc/68/36/57/340683657.db2.gz ZOFJCTIEIFSJAE-MRVPVSSYSA-N 0 0 300.292 5.035 20 0 DKADRN FC(F)(F)CCSCc1csc(C2CCCCC2)n1 ZINC000524888433 340683732 /nfs/dbraw/zinc/68/37/32/340683732.db2.gz SQNISCHZFQRLCY-UHFFFAOYSA-N 0 0 309.422 5.376 20 0 DKADRN C[C@H](SCCC(F)(F)F)c1ccccc1Br ZINC000524889862 340683673 /nfs/dbraw/zinc/68/36/73/340683673.db2.gz YYYAGYSPWMTJLF-QMMMGPOBSA-N 0 0 313.182 5.196 20 0 DKADRN CC(C)C[C@@H]1CCCCCN1C(=O)Nc1cccc(C(F)F)c1 ZINC000524897926 340684293 /nfs/dbraw/zinc/68/42/93/340684293.db2.gz ZMJLHFRDCTUWRH-INIZCTEOSA-N 0 0 324.415 5.447 20 0 DKADRN CC[C@H](C)Sc1ccc(NC(=O)N2C[C@@H](C)C[C@H]2C)c(C)c1 ZINC000524899192 340684308 /nfs/dbraw/zinc/68/43/08/340684308.db2.gz YINVZHVQIHXPHW-CFVMTHIKSA-N 0 0 320.502 5.148 20 0 DKADRN CC[C@H](C)Sc1ccc(NC(=O)N2C[C@@H](C)C[C@@H]2C)c(C)c1 ZINC000524899193 340684375 /nfs/dbraw/zinc/68/43/75/340684375.db2.gz YINVZHVQIHXPHW-QEJZJMRPSA-N 0 0 320.502 5.148 20 0 DKADRN CC[C@H](C)Sc1ccc(NC(=O)N2C[C@H](C)C[C@H]2C)c(C)c1 ZINC000524899195 340684342 /nfs/dbraw/zinc/68/43/42/340684342.db2.gz YINVZHVQIHXPHW-YUELXQCFSA-N 0 0 320.502 5.148 20 0 DKADRN C[C@H](Oc1ccc(Cl)cc1F)c1ncc(-c2ccccc2)o1 ZINC000524915947 340684731 /nfs/dbraw/zinc/68/47/31/340684731.db2.gz XUMKIRFKXLWMPA-NSHDSACASA-N 0 0 317.747 5.274 20 0 DKADRN CC(C)=CCSc1ccccc1C(=O)N(C)c1ccccc1 ZINC000524918569 340684733 /nfs/dbraw/zinc/68/47/33/340684733.db2.gz AHOGUZRQQDEJSF-UHFFFAOYSA-N 0 0 311.450 5.022 20 0 DKADRN CC[C@@H]1CCC[C@H](NC(=O)Nc2ccccc2C(C)(C)C)C1 ZINC000524923272 340684765 /nfs/dbraw/zinc/68/47/65/340684765.db2.gz JOHDYPQOMYYGEY-CABCVRRESA-N 0 0 302.462 5.074 20 0 DKADRN CC[C@@H]1CCC[C@@H](NC(=O)Nc2ccccc2C(C)(C)C)C1 ZINC000524923274 340684784 /nfs/dbraw/zinc/68/47/84/340684784.db2.gz JOHDYPQOMYYGEY-HUUCEWRRSA-N 0 0 302.462 5.074 20 0 DKADRN CC[C@H]1CCC[C@@H](NC(=O)Nc2ccccc2C(C)(C)C)C1 ZINC000524923275 340684807 /nfs/dbraw/zinc/68/48/07/340684807.db2.gz JOHDYPQOMYYGEY-LSDHHAIUSA-N 0 0 302.462 5.074 20 0 DKADRN CSc1ccc(NC(=O)N2CCCCC[C@H]2CC(C)C)cc1 ZINC000524927232 340684949 /nfs/dbraw/zinc/68/49/49/340684949.db2.gz OBCBACHDPWDVJO-INIZCTEOSA-N 0 0 320.502 5.231 20 0 DKADRN CC[C@H](C)N(C)C(=O)Nc1cccc(CSC2CCCC2)c1 ZINC000524933293 340685130 /nfs/dbraw/zinc/68/51/30/340685130.db2.gz PTFMEAJIUXYHIF-AWEZNQCLSA-N 0 0 320.502 5.125 20 0 DKADRN CSc1ccccc1NC(=O)N1CCCCC[C@H]1CC(C)C ZINC000524938561 340685138 /nfs/dbraw/zinc/68/51/38/340685138.db2.gz KYRQAWUSSIXHGT-HNNXBMFYSA-N 0 0 320.502 5.231 20 0 DKADRN CSc1ccccc1NC(=O)N1CCCCC[C@@H]1CC(C)C ZINC000524938562 340685152 /nfs/dbraw/zinc/68/51/52/340685152.db2.gz KYRQAWUSSIXHGT-OAHLLOKOSA-N 0 0 320.502 5.231 20 0 DKADRN CC(C)Sc1c(Cl)cccc1NC(=O)[C@H]1CC=CCC1 ZINC000524985367 340686332 /nfs/dbraw/zinc/68/63/32/340686332.db2.gz YLQGDGGQMYPOFS-LBPRGKRZSA-N 0 0 309.862 5.135 20 0 DKADRN Cc1cccc([C@@H](C)CNC(=O)Nc2ccccc2C(C)(C)C)c1 ZINC000524993516 340686579 /nfs/dbraw/zinc/68/65/79/340686579.db2.gz SGLHUDDYLKLVBM-INIZCTEOSA-N 0 0 324.468 5.218 20 0 DKADRN CCC(CC)S[C@H](C)c1nc(Cc2ccc(Cl)cc2)no1 ZINC000525004287 340686771 /nfs/dbraw/zinc/68/67/71/340686771.db2.gz JNIOEXJSFXXUFZ-LLVKDONJSA-N 0 0 324.877 5.297 20 0 DKADRN Cc1ccccc1CSc1nnc(-c2ccc(Cl)s2)o1 ZINC000525005119 340686793 /nfs/dbraw/zinc/68/67/93/340686793.db2.gz ZJNIVIZHZKOENI-UHFFFAOYSA-N 0 0 322.842 5.052 20 0 DKADRN CC(C)c1ccc(C(=O)Nc2ccc(CC(F)(F)F)cc2)cc1 ZINC000525025570 340687389 /nfs/dbraw/zinc/68/73/89/340687389.db2.gz MCRXZUFPGAILQU-UHFFFAOYSA-N 0 0 321.342 5.167 20 0 DKADRN Cc1ccc([C@@H]2CCCCN2C(=O)CCCC(C)(C)C)cc1 ZINC000525028335 340687541 /nfs/dbraw/zinc/68/75/41/340687541.db2.gz TYAHPPKVGWKNCB-SFHVURJKSA-N 0 0 301.474 5.265 20 0 DKADRN CC[C@H](NC(=O)c1ccc(C2CCCCC2)cc1)c1ccncc1 ZINC000525048863 340688203 /nfs/dbraw/zinc/68/82/03/340688203.db2.gz BCQRZTNOPDZYHE-FQEVSTJZSA-N 0 0 322.452 5.010 20 0 DKADRN CC[C@@H](NC(=O)c1ccc(C2CCCCC2)cc1)c1ccncc1 ZINC000525048864 340688222 /nfs/dbraw/zinc/68/82/22/340688222.db2.gz BCQRZTNOPDZYHE-HXUWFJFHSA-N 0 0 322.452 5.010 20 0 DKADRN CC(C)(C)Oc1ccc(NC(=O)c2cccc(C(F)F)c2)cc1 ZINC000525049758 340688338 /nfs/dbraw/zinc/68/83/38/340688338.db2.gz AVWXDVTXWRHCID-UHFFFAOYSA-N 0 0 319.351 5.054 20 0 DKADRN Cc1nc(S[C@@H](c2ccccc2)c2ccc(F)cc2)oc1C ZINC000525110235 340689943 /nfs/dbraw/zinc/68/99/43/340689943.db2.gz YSLIQZJTEXTAPL-KRWDZBQOSA-N 0 0 313.397 5.312 20 0 DKADRN Cc1nc(S[C@H](c2ccccc2)c2ccc(F)cc2)oc1C ZINC000525110236 340689917 /nfs/dbraw/zinc/68/99/17/340689917.db2.gz YSLIQZJTEXTAPL-QGZVFWFLSA-N 0 0 313.397 5.312 20 0 DKADRN Fc1ccc(SCc2ncc(-c3ccccc3F)o2)c(F)c1 ZINC000525111848 340689867 /nfs/dbraw/zinc/68/98/67/340689867.db2.gz DPYTWJFYXYQTET-UHFFFAOYSA-N 0 0 321.323 5.051 20 0 DKADRN Cc1ccc(NC(=O)c2ccccc2Sc2ccccc2)cc1 ZINC000525116926 340690090 /nfs/dbraw/zinc/69/00/90/340690090.db2.gz XDUKBAXWQHEDET-UHFFFAOYSA-N 0 0 319.429 5.399 20 0 DKADRN C[C@@H](C(=O)Nc1ccccc1C(C)(C)C)c1ccc(F)c(F)c1 ZINC000525117042 340690172 /nfs/dbraw/zinc/69/01/72/340690172.db2.gz CTWGRMXMLFIVFZ-GFCCVEGCSA-N 0 0 317.379 5.005 20 0 DKADRN Cc1cccc(NC(=O)c2ccccc2Sc2ccccc2)c1 ZINC000525117483 340690255 /nfs/dbraw/zinc/69/02/55/340690255.db2.gz TWSKWLMHBIEJIB-UHFFFAOYSA-N 0 0 319.429 5.399 20 0 DKADRN CC(C)c1ccccc1NC(=O)[C@H](C)c1cccc(Cl)c1 ZINC000525117899 340690265 /nfs/dbraw/zinc/69/02/65/340690265.db2.gz INGQPFRRDJNZKT-CYBMUJFWSA-N 0 0 301.817 5.206 20 0 DKADRN CCN(C(=O)c1cccc(OCC=C(C)C)c1)c1ccccc1C ZINC000525133079 340692049 /nfs/dbraw/zinc/69/20/49/340692049.db2.gz FDMZLTMXGLKYSX-UHFFFAOYSA-N 0 0 323.436 5.007 20 0 DKADRN C[C@@H](C(=O)N(CC1CC1)C1CCCCC1)c1cccc(Cl)c1 ZINC000525140079 340692332 /nfs/dbraw/zinc/69/23/32/340692332.db2.gz HYZFGCWXSWRVLF-CQSZACIVSA-N 0 0 319.876 5.015 20 0 DKADRN CCCc1ccccc1NC(=O)[C@H](C)c1cccc(Cl)c1 ZINC000525153111 340692852 /nfs/dbraw/zinc/69/28/52/340692852.db2.gz KYKOHXIJDQZWDN-CYBMUJFWSA-N 0 0 301.817 5.035 20 0 DKADRN CCCc1ccccc1NC(=O)[C@@H](C)c1cccc(Cl)c1 ZINC000525153112 340692833 /nfs/dbraw/zinc/69/28/33/340692833.db2.gz KYKOHXIJDQZWDN-ZDUSSCGKSA-N 0 0 301.817 5.035 20 0 DKADRN CCCc1ccccc1NCc1csc(-c2ccsc2)n1 ZINC000525174582 340693536 /nfs/dbraw/zinc/69/35/36/340693536.db2.gz MNPKPTQNWPOLMG-UHFFFAOYSA-N 0 0 314.479 5.436 20 0 DKADRN CC(C)CCc1ccccc1NC(=O)c1cccc2cc[nH]c21 ZINC000525196735 340694658 /nfs/dbraw/zinc/69/46/58/340694658.db2.gz BPEZBEIDQBQRLY-UHFFFAOYSA-N 0 0 306.409 5.009 20 0 DKADRN CCc1cnc(CS[C@@H](C)c2ccc(Cl)c(Cl)c2)o1 ZINC000525200378 340694875 /nfs/dbraw/zinc/69/48/75/340694875.db2.gz CNDMIWBVXOBABJ-VIFPVBQESA-N 0 0 316.253 5.538 20 0 DKADRN Cc1ccc(F)c(C(=O)N(C)c2ccc(-c3ccccc3)cc2)c1 ZINC000525200837 340694864 /nfs/dbraw/zinc/69/48/64/340694864.db2.gz ZAGQAKJQJYSPDA-UHFFFAOYSA-N 0 0 319.379 5.078 20 0 DKADRN Cc1ccsc1C(=O)N(C)c1ccc(-c2ccccc2)cc1 ZINC000525201653 340695011 /nfs/dbraw/zinc/69/50/11/340695011.db2.gz JFYLYXLBMVZJDN-UHFFFAOYSA-N 0 0 307.418 5.000 20 0 DKADRN CN(C(=O)CCc1cccs1)c1ccc(-c2ccccc2)cc1 ZINC000525201715 340695041 /nfs/dbraw/zinc/69/50/41/340695041.db2.gz RQWKZMAUTZUQSH-UHFFFAOYSA-N 0 0 321.445 5.011 20 0 DKADRN CCCCCN(C(=O)Nc1ccc(OC(C)C)cc1C)C(C)C ZINC000525219134 340695745 /nfs/dbraw/zinc/69/57/45/340695745.db2.gz KPVIBJHXVLECTG-UHFFFAOYSA-N 0 0 320.477 5.215 20 0 DKADRN C[C@@H]1CCCC[C@H]1CC(=O)Nc1cccc(Oc2ccccn2)c1 ZINC000525224191 340695872 /nfs/dbraw/zinc/69/58/72/340695872.db2.gz LVPDEDANBKFSDO-CVEARBPZSA-N 0 0 324.424 5.029 20 0 DKADRN C[C@H]1CCCC[C@@H]1CC(=O)Nc1cccc(Oc2ccccn2)c1 ZINC000525224194 340695909 /nfs/dbraw/zinc/69/59/09/340695909.db2.gz LVPDEDANBKFSDO-JKSUJKDBSA-N 0 0 324.424 5.029 20 0 DKADRN Cc1cc(CS[C@H](c2ccccc2)c2ccc(F)cc2)no1 ZINC000525224483 340695920 /nfs/dbraw/zinc/69/59/20/340695920.db2.gz QATAIGGLIANVBM-GOSISDBHSA-N 0 0 313.397 5.145 20 0 DKADRN CC1(C)CCCN(C(=O)Nc2cccc(Cl)c2Cl)CC1 ZINC000525224807 340695962 /nfs/dbraw/zinc/69/59/62/340695962.db2.gz SEMLXFPKFHCGCC-UHFFFAOYSA-N 0 0 315.244 5.037 20 0 DKADRN Cc1cc(C)c(NC(=O)NCc2ccc3ccccc3c2)c(C)c1 ZINC000525226115 340695982 /nfs/dbraw/zinc/69/59/82/340695982.db2.gz NMIZOYWXYVINAA-UHFFFAOYSA-N 0 0 318.420 5.087 20 0 DKADRN CCc1cccc(C)c1NC(=O)NCc1ccc2ccccc2c1 ZINC000525226827 340696123 /nfs/dbraw/zinc/69/61/23/340696123.db2.gz WKOOTGBDSAHHOU-UHFFFAOYSA-N 0 0 318.420 5.032 20 0 DKADRN C[C@@H](Nc1ccc(CC(F)(F)F)cc1)c1c(F)cccc1F ZINC000525244516 340696752 /nfs/dbraw/zinc/69/67/52/340696752.db2.gz OJKBHGIUCTWJGL-SNVBAGLBSA-N 0 0 315.285 5.243 20 0 DKADRN Cc1cccc([C@H](C)Nc2cccc(COCc3ccco3)c2)c1 ZINC000525249352 340696880 /nfs/dbraw/zinc/69/68/80/340696880.db2.gz UJCFLRRVHWNXKD-KRWDZBQOSA-N 0 0 321.420 5.478 20 0 DKADRN Cc1ccc(NC(=O)N(Cc2cccc(Cl)c2)C(C)C)s1 ZINC000525266004 340697404 /nfs/dbraw/zinc/69/74/04/340697404.db2.gz SHYASGAAXUDCOO-UHFFFAOYSA-N 0 0 322.861 5.152 20 0 DKADRN Cc1ccc(SCCC(=O)Nc2cccc(C)c2Cl)cc1 ZINC000525310283 340699662 /nfs/dbraw/zinc/69/96/62/340699662.db2.gz ARZCZAUFHHADTQ-UHFFFAOYSA-N 0 0 319.857 5.078 20 0 DKADRN CC[C@H](Sc1ccccc1)C(=O)Nc1cccc(C)c1Cl ZINC000525310392 340699818 /nfs/dbraw/zinc/69/98/18/340699818.db2.gz WVBMVUUGZAUTLB-HNNXBMFYSA-N 0 0 319.857 5.158 20 0 DKADRN CC[C@@H](Sc1ccccc1)C(=O)Nc1cccc(C)c1Cl ZINC000525310393 340699806 /nfs/dbraw/zinc/69/98/06/340699806.db2.gz WVBMVUUGZAUTLB-OAHLLOKOSA-N 0 0 319.857 5.158 20 0 DKADRN Cc1cccc(NC(=O)C[C@@H]2CCCc3ccccc32)c1Cl ZINC000525310481 340699757 /nfs/dbraw/zinc/69/97/57/340699757.db2.gz UCCBBKLJPJEGNT-HNNXBMFYSA-N 0 0 313.828 5.097 20 0 DKADRN Cc1cccc(NC(=O)C[C@H]2CCCc3ccccc32)c1Cl ZINC000525310482 340699844 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315.244 5.036 20 0 DKADRN Cc1c(Cl)cccc1NC(=O)NCc1ccc2ccccc2c1 ZINC000525738778 333208392 /nfs/dbraw/zinc/20/83/92/333208392.db2.gz NSMPIRCSQHQZBJ-UHFFFAOYSA-N 0 0 324.811 5.123 20 0 DKADRN CC(C)CCc1ccccc1NC(=O)N([C@@H](C)C1CC1)C1CC1 ZINC000525747182 333219093 /nfs/dbraw/zinc/21/90/93/333219093.db2.gz HODROZQDSSVCIO-HNNXBMFYSA-N 0 0 314.473 5.070 20 0 DKADRN CC(C)CCc1ccccc1NC(=O)N([C@H](C)C1CC1)C1CC1 ZINC000525747183 333219099 /nfs/dbraw/zinc/21/90/99/333219099.db2.gz HODROZQDSSVCIO-OAHLLOKOSA-N 0 0 314.473 5.070 20 0 DKADRN COc1ccc2cc([C@@H](C)SCc3cc(C)no3)ccc2c1 ZINC000525749780 333221216 /nfs/dbraw/zinc/22/12/16/333221216.db2.gz PUQASDRKEGZLAW-CYBMUJFWSA-N 0 0 313.422 5.139 20 0 DKADRN COc1ccc2cc([C@H](C)SCc3cc(C)no3)ccc2c1 ZINC000525749781 333221282 /nfs/dbraw/zinc/22/12/82/333221282.db2.gz PUQASDRKEGZLAW-ZDUSSCGKSA-N 0 0 313.422 5.139 20 0 DKADRN C[C@H](Nc1ccc(CC(F)(F)F)cc1)c1ccc(F)cc1F ZINC000525756541 333233625 /nfs/dbraw/zinc/23/36/25/333233625.db2.gz YZFPAXRERAZLCA-JTQLQIEISA-N 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CCSc1ccccc1C(=O)Nc1cc(CC)ccc1CC ZINC000530977618 331788086 /nfs/dbraw/zinc/78/80/86/331788086.db2.gz ILIPVHBFGRVLKM-UHFFFAOYSA-N 0 0 313.466 5.176 20 0 DKADRN C[C@@H](Nc1cccc(CCC(F)(F)F)c1)c1ccccc1F ZINC000531008918 332208043 /nfs/dbraw/zinc/20/80/43/332208043.db2.gz QCWNQCWZKHIWSE-GFCCVEGCSA-N 0 0 311.322 5.494 20 0 DKADRN C[C@H](Nc1cccc(CCC(F)(F)F)c1)c1ccccc1F ZINC000531008919 332208047 /nfs/dbraw/zinc/20/80/47/332208047.db2.gz QCWNQCWZKHIWSE-LBPRGKRZSA-N 0 0 311.322 5.494 20 0 DKADRN Cc1cccc(Cl)c1NC(=O)c1cc2sccc2s1 ZINC000531014718 332210680 /nfs/dbraw/zinc/21/06/80/332210680.db2.gz NTNWJSJKCRAEHD-UHFFFAOYSA-N 0 0 307.827 5.177 20 0 DKADRN Cc1csc(CSCc2cc(Cl)cc3cccnc32)n1 ZINC000531036706 332219801 /nfs/dbraw/zinc/21/98/01/332219801.db2.gz GPQOCNQZMDQPFW-UHFFFAOYSA-N 0 0 320.870 5.087 20 0 DKADRN Cc1csc(CS[C@@H](C)c2ccc(OC(F)F)cc2)n1 ZINC000531039018 332224212 /nfs/dbraw/zinc/22/42/12/332224212.db2.gz VYGLFSXTQYMCBS-JTQLQIEISA-N 0 0 315.410 5.047 20 0 DKADRN Cc1csc(CS[C@H](C)c2ccc(OC(F)F)cc2)n1 ZINC000531039020 332224265 /nfs/dbraw/zinc/22/42/65/332224265.db2.gz VYGLFSXTQYMCBS-SNVBAGLBSA-N 0 0 315.410 5.047 20 0 DKADRN Clc1ccc(Cl)c(CSc2nnc(C3CC3)s2)c1 ZINC000531066550 332244211 /nfs/dbraw/zinc/24/42/11/332244211.db2.gz NVKYCTOSOBPMBD-UHFFFAOYSA-N 0 0 317.266 5.015 20 0 DKADRN CC(C)c1ccc(CNC(=O)c2c(Cl)cccc2Cl)cc1 ZINC000531092041 332256433 /nfs/dbraw/zinc/25/64/33/332256433.db2.gz MZRWSBFXTRCCGP-UHFFFAOYSA-N 0 0 322.235 5.047 20 0 DKADRN Cc1cc(C)cc([C@@H](C)NC(=O)c2c(Cl)cccc2Cl)c1 ZINC000531095733 332259487 /nfs/dbraw/zinc/25/94/87/332259487.db2.gz GEIDCVVCSAJQTG-GFCCVEGCSA-N 0 0 322.235 5.101 20 0 DKADRN Cc1cc(C)cc([C@H](C)NC(=O)c2c(Cl)cccc2Cl)c1 ZINC000531095737 332259412 /nfs/dbraw/zinc/25/94/12/332259412.db2.gz GEIDCVVCSAJQTG-LBPRGKRZSA-N 0 0 322.235 5.101 20 0 DKADRN CCC(CC)N(C(=O)Nc1cccc(Cl)c1Cl)C1CC1 ZINC000531181353 333142616 /nfs/dbraw/zinc/14/26/16/333142616.db2.gz OMRULSLOPLZMRO-UHFFFAOYSA-N 0 0 315.244 5.178 20 0 DKADRN CCSCc1cccc(NC(=O)N(C(CC)CC)C2CC2)c1 ZINC000531183890 333194019 /nfs/dbraw/zinc/19/40/19/333194019.db2.gz XGBPDEWOEBUTGL-UHFFFAOYSA-N 0 0 320.502 5.125 20 0 DKADRN C[C@@H](SCc1nccn1C(F)F)c1cccc2ccccc21 ZINC000531201790 333330726 /nfs/dbraw/zinc/33/07/26/333330726.db2.gz ZMKATOQRDWKQCF-GFCCVEGCSA-N 0 0 318.392 5.426 20 0 DKADRN C[C@H](SCc1nccn1C(F)F)c1cccc2ccccc21 ZINC000531201801 333330798 /nfs/dbraw/zinc/33/07/98/333330798.db2.gz ZMKATOQRDWKQCF-LBPRGKRZSA-N 0 0 318.392 5.426 20 0 DKADRN FC(F)(F)CCc1cccc(NCc2ccc(Cl)o2)c1 ZINC000531247905 333337899 /nfs/dbraw/zinc/33/78/99/333337899.db2.gz AZGMBKSBZDMHEX-UHFFFAOYSA-N 0 0 303.711 5.040 20 0 DKADRN C[C@@H](Nc1cccc(CCC(F)(F)F)c1)c1cccc(F)c1 ZINC000531248744 333337908 /nfs/dbraw/zinc/33/79/08/333337908.db2.gz UTGBPTFTPPJNES-GFCCVEGCSA-N 0 0 311.322 5.494 20 0 DKADRN C[C@H](Nc1cccc(CCC(F)(F)F)c1)c1cccc(F)c1 ZINC000531248758 333338086 /nfs/dbraw/zinc/33/80/86/333338086.db2.gz UTGBPTFTPPJNES-LBPRGKRZSA-N 0 0 311.322 5.494 20 0 DKADRN CC(C)(C)c1csc(CSCc2ncc(C(C)(C)C)o2)n1 ZINC000531275506 333339606 /nfs/dbraw/zinc/33/96/06/333339606.db2.gz CJHCVESHOWJXNX-UHFFFAOYSA-N 0 0 324.515 5.160 20 0 DKADRN CC(=O)c1c(C)cc(C)c(CSCc2nc(C)cs2)c1C ZINC000531275839 333339253 /nfs/dbraw/zinc/33/92/53/333339253.db2.gz APRYIQYLXLCUCZ-UHFFFAOYSA-N 0 0 319.495 5.013 20 0 DKADRN CCC1(CC)CCN(C(=O)Nc2c(C)cccc2C(C)C)C1 ZINC000531276259 333339437 /nfs/dbraw/zinc/33/94/37/333339437.db2.gz HANGTFUWKVKHED-UHFFFAOYSA-N 0 0 302.462 5.162 20 0 DKADRN CC(C)CCc1ccccc1NC(=O)c1cccc2[nH]ccc21 ZINC000531338942 333344730 /nfs/dbraw/zinc/34/47/30/333344730.db2.gz QLNPGZOVFZRVJD-UHFFFAOYSA-N 0 0 306.409 5.009 20 0 DKADRN Fc1ccc2c(c1)[C@@H](Nc1ccc(CC(F)(F)F)cc1)CC2 ZINC000531361134 333346181 /nfs/dbraw/zinc/34/61/81/333346181.db2.gz ZKNMLBRRCNUFMK-INIZCTEOSA-N 0 0 309.306 5.030 20 0 DKADRN Fc1ccc2c(c1)[C@H](Nc1ccc(CC(F)(F)F)cc1)CC2 ZINC000531361135 333346225 /nfs/dbraw/zinc/34/62/25/333346225.db2.gz ZKNMLBRRCNUFMK-MRXNPFEDSA-N 0 0 309.306 5.030 20 0 DKADRN Cc1cccc(NC(=O)[C@H](C)c2cc3ccccc3o2)c1Cl ZINC000531369833 333346716 /nfs/dbraw/zinc/34/67/16/333346716.db2.gz GUJMWADHNPXTNQ-GFCCVEGCSA-N 0 0 313.784 5.137 20 0 DKADRN Cc1cccc(NC(=O)[C@@H](C)c2cc3ccccc3o2)c1Cl ZINC000531369836 333346786 /nfs/dbraw/zinc/34/67/86/333346786.db2.gz GUJMWADHNPXTNQ-LBPRGKRZSA-N 0 0 313.784 5.137 20 0 DKADRN O=C(C/C=C\c1cccc(F)c1)Nc1cccc(Cl)c1Cl ZINC000531416059 333350399 /nfs/dbraw/zinc/35/03/99/333350399.db2.gz INZPZXPHQPVRRV-DJWKRKHSSA-N 0 0 324.182 5.175 20 0 DKADRN O=C(C/C=C/c1cccc(F)c1)Nc1cccc(Cl)c1Cl ZINC000531416060 333350499 /nfs/dbraw/zinc/35/04/99/333350499.db2.gz INZPZXPHQPVRRV-GORDUTHDSA-N 0 0 324.182 5.175 20 0 DKADRN CC[C@@H](N[C@H](C)c1ccc(F)cc1F)c1ccc(F)cc1F ZINC000531448632 333354228 /nfs/dbraw/zinc/35/42/28/333354228.db2.gz HRZWLGZQUKORGC-BMLIUANNSA-N 0 0 311.322 5.045 20 0 DKADRN CC[C@H](N[C@H](C)c1ccc(F)cc1F)c1ccc(F)cc1F ZINC000531448633 333354282 /nfs/dbraw/zinc/35/42/82/333354282.db2.gz HRZWLGZQUKORGC-QGHHPUGFSA-N 0 0 311.322 5.045 20 0 DKADRN O=C(c1cc2sccc2s1)N(CC1CC1)c1ccccc1 ZINC000531455706 333397858 /nfs/dbraw/zinc/39/78/58/333397858.db2.gz QEDTYLJAHYBBOE-UHFFFAOYSA-N 0 0 313.447 5.020 20 0 DKADRN CC[C@H]1CC[C@@H](c2nc(-c3ccc(-c4ccccc4)cc3)no2)O1 ZINC000531539965 333534484 /nfs/dbraw/zinc/53/44/84/333534484.db2.gz BVTRJFWHCYBJGU-ROUUACIJSA-N 0 0 320.392 5.034 20 0 DKADRN CC[C@H]1CC[C@H](c2nc(-c3ccc(-c4ccccc4)cc3)no2)O1 ZINC000531539966 333534397 /nfs/dbraw/zinc/53/43/97/333534397.db2.gz BVTRJFWHCYBJGU-ZWKOTPCHSA-N 0 0 320.392 5.034 20 0 DKADRN CC[C@@H](N[C@@H](C)c1c(F)cccc1F)c1cc(F)ccc1F ZINC000531684627 333540740 /nfs/dbraw/zinc/54/07/40/333540740.db2.gz SINRYXRVTLBZFG-MGPLVRAMSA-N 0 0 311.322 5.045 20 0 DKADRN CC[C@H](N[C@@H](C)c1c(F)cccc1F)c1cc(F)ccc1F ZINC000531684628 333540735 /nfs/dbraw/zinc/54/07/35/333540735.db2.gz SINRYXRVTLBZFG-QFYYESIMSA-N 0 0 311.322 5.045 20 0 DKADRN CCc1ccc([C@@H](C)N[C@H](c2ccccc2)c2ccccn2)s1 ZINC000531692509 333545917 /nfs/dbraw/zinc/54/59/17/333545917.db2.gz GNMFMBWHNYGRAC-FOIQADDNSA-N 0 0 322.477 5.146 20 0 DKADRN CCc1ccc([C@H](C)N[C@@H](c2ccccc2)c2ccccn2)s1 ZINC000531692512 333545951 /nfs/dbraw/zinc/54/59/51/333545951.db2.gz GNMFMBWHNYGRAC-YWZLYKJASA-N 0 0 322.477 5.146 20 0 DKADRN Cc1cccc([C@H](C)N[C@@H](c2ccccc2)c2ccccn2)c1C ZINC000531692618 333545958 /nfs/dbraw/zinc/54/59/58/333545958.db2.gz OFWALZXYTIZGDR-AVRDEDQJSA-N 0 0 316.448 5.139 20 0 DKADRN Cc1cccc([C@@H](C)N[C@H](c2ccccc2)c2ccccn2)c1C ZINC000531692624 333545965 /nfs/dbraw/zinc/54/59/65/333545965.db2.gz OFWALZXYTIZGDR-XMSQKQJNSA-N 0 0 316.448 5.139 20 0 DKADRN Cc1cc(C)cc([C@@H](C)N[C@@H](c2ccccc2)c2ccccn2)c1 ZINC000531693143 333546126 /nfs/dbraw/zinc/54/61/26/333546126.db2.gz AOVUCBNRMJLYTN-GCJKJVERSA-N 0 0 316.448 5.139 20 0 DKADRN C[C@H](NCc1ccc([C@H]2C[C@H]2C)o1)c1ccc(F)cc1Cl ZINC000531699630 333547293 /nfs/dbraw/zinc/54/72/93/333547293.db2.gz QKCKLVKZLHBDAY-ZETOZRRWSA-N 0 0 307.796 5.046 20 0 DKADRN CC[C@H](NCc1nc(C(C)(C)C)cs1)c1cccc(Cl)c1 ZINC000531703845 333548191 /nfs/dbraw/zinc/54/81/91/333548191.db2.gz DFKFENCJFJCEBF-AWEZNQCLSA-N 0 0 322.905 5.335 20 0 DKADRN CC[C@@H](NCc1nc(C(C)(C)C)cs1)c1cccc(Cl)c1 ZINC000531703850 333548049 /nfs/dbraw/zinc/54/80/49/333548049.db2.gz DFKFENCJFJCEBF-CQSZACIVSA-N 0 0 322.905 5.335 20 0 DKADRN Cc1cc([C@@H](C)NCc2nc(C(C)(C)C)cs2)cc(C)c1F ZINC000531703851 333548120 /nfs/dbraw/zinc/54/81/20/333548120.db2.gz FJUJWQPHZNLZKS-CYBMUJFWSA-N 0 0 320.477 5.047 20 0 DKADRN Cc1cc([C@H](C)NCc2nc(C(C)(C)C)cs2)cc(C)c1F ZINC000531703856 333548041 /nfs/dbraw/zinc/54/80/41/333548041.db2.gz FJUJWQPHZNLZKS-ZDUSSCGKSA-N 0 0 320.477 5.047 20 0 DKADRN C[C@H](N[C@@H](C)c1ccc(Cl)cc1)c1nc(C(C)(C)C)cs1 ZINC000531719509 333550716 /nfs/dbraw/zinc/55/07/16/333550716.db2.gz XPIRMUYLSSSLNE-RYUDHWBXSA-N 0 0 322.905 5.506 20 0 DKADRN CCc1ccc([C@@H](COC)N[C@H](C)c2ccc3ccccc3c2)o1 ZINC000531725303 333544471 /nfs/dbraw/zinc/54/44/71/333544471.db2.gz BWKQVAHLIWWQKD-FOIQADDNSA-N 0 0 323.436 5.034 20 0 DKADRN C[C@@H](Nc1ccccc1CCC(F)(F)F)c1ccc(F)cc1 ZINC000531791700 333559838 /nfs/dbraw/zinc/55/98/38/333559838.db2.gz ADMOQOYNOKOXHV-GFCCVEGCSA-N 0 0 311.322 5.494 20 0 DKADRN C[C@H](Nc1ccccc1CCC(F)(F)F)c1ccc(F)cc1 ZINC000531791701 333559924 /nfs/dbraw/zinc/55/99/24/333559924.db2.gz ADMOQOYNOKOXHV-LBPRGKRZSA-N 0 0 311.322 5.494 20 0 DKADRN CCc1nnc([C@H](C)S[C@H](C)c2ccc(C(C)(C)C)cc2)o1 ZINC000531835195 333569991 /nfs/dbraw/zinc/56/99/91/333569991.db2.gz LYLHHBWQSIDUQS-OLZOCXBDSA-N 0 0 318.486 5.485 20 0 DKADRN CCc1nnc([C@@H](C)S[C@@H](C)c2ccc(C(C)(C)C)cc2)o1 ZINC000531835196 333570096 /nfs/dbraw/zinc/57/00/96/333570096.db2.gz LYLHHBWQSIDUQS-QWHCGFSZSA-N 0 0 318.486 5.485 20 0 DKADRN CCc1nnc([C@H](C)S[C@@H](C)c2ccc(C(C)(C)C)cc2)o1 ZINC000531835197 333570045 /nfs/dbraw/zinc/57/00/45/333570045.db2.gz LYLHHBWQSIDUQS-STQMWFEESA-N 0 0 318.486 5.485 20 0 DKADRN CCc1nnc([C@H](C)S[C@H](C)c2cccc3ccccc32)o1 ZINC000531836039 333572618 /nfs/dbraw/zinc/57/26/18/333572618.db2.gz MAXDJDZVNUMBEH-OLZOCXBDSA-N 0 0 312.438 5.341 20 0 DKADRN CCc1nnc([C@@H](C)S[C@@H](C)c2cccc3ccccc32)o1 ZINC000531836040 333572625 /nfs/dbraw/zinc/57/26/25/333572625.db2.gz MAXDJDZVNUMBEH-QWHCGFSZSA-N 0 0 312.438 5.341 20 0 DKADRN Cc1coc(-c2ccc(C)c(N[C@@H](C)c3ccc(F)cc3)c2)n1 ZINC000531838847 333571458 /nfs/dbraw/zinc/57/14/58/333571458.db2.gz PLHMFOHWKKYGQV-AWEZNQCLSA-N 0 0 310.372 5.271 20 0 DKADRN C[C@@H](N[C@@H](C)c1cc(F)c(Cl)cc1Cl)c1ccoc1 ZINC000531932340 334296655 /nfs/dbraw/zinc/29/66/55/334296655.db2.gz NDEVUHRBWZKLCQ-BDAKNGLRSA-N 0 0 302.176 5.137 20 0 DKADRN C[C@@H](N[C@@H](C)c1ccoc1)c1cc(F)c(Cl)cc1Cl ZINC000531932341 334296710 /nfs/dbraw/zinc/29/67/10/334296710.db2.gz NDEVUHRBWZKLCQ-DTWKUNHWSA-N 0 0 302.176 5.137 20 0 DKADRN C[C@H](N[C@@H](C)c1cc(F)c(Cl)cc1Cl)c1ccoc1 ZINC000531932342 334296598 /nfs/dbraw/zinc/29/65/98/334296598.db2.gz NDEVUHRBWZKLCQ-IUCAKERBSA-N 0 0 302.176 5.137 20 0 DKADRN C[C@@H](N[C@H](C)c1cc(F)c(Cl)cc1Cl)c1ccoc1 ZINC000531932343 334296572 /nfs/dbraw/zinc/29/65/72/334296572.db2.gz NDEVUHRBWZKLCQ-RKDXNWHRSA-N 0 0 302.176 5.137 20 0 DKADRN COc1ccc([C@@H](C)[NH2+][C@H](c2ccccc2)C2CC2)cc1Cl ZINC000531942182 334302040 /nfs/dbraw/zinc/30/20/40/334302040.db2.gz IPESUSWHPZDHIM-BFUOFWGJSA-N 0 0 315.844 5.151 20 0 DKADRN COc1ccc([C@H](C)[NH2+][C@@H](c2ccccc2)C2CC2)cc1Cl ZINC000531942183 334301963 /nfs/dbraw/zinc/30/19/63/334301963.db2.gz IPESUSWHPZDHIM-DJJJIMSYSA-N 0 0 315.844 5.151 20 0 DKADRN COc1ccc([C@H](C)[NH2+][C@H](c2ccccc2)C2CC2)cc1Cl ZINC000531942184 334302011 /nfs/dbraw/zinc/30/20/11/334302011.db2.gz IPESUSWHPZDHIM-ORAYPTAESA-N 0 0 315.844 5.151 20 0 DKADRN COc1ccc([C@@H](C)[NH2+][C@@H](c2ccccc2)C2CC2)cc1Cl ZINC000531942185 334302024 /nfs/dbraw/zinc/30/20/24/334302024.db2.gz IPESUSWHPZDHIM-YJYMSZOUSA-N 0 0 315.844 5.151 20 0 DKADRN Cc1ccc(C)c([C@@H](C)N[C@H](c2nccs2)c2ccccc2)c1 ZINC000531966094 334324322 /nfs/dbraw/zinc/32/43/22/334324322.db2.gz WTUKVIFDVKDSTB-APWZRJJASA-N 0 0 322.477 5.200 20 0 DKADRN Cc1ccc(C)c([C@H](C)N[C@H](c2nccs2)c2ccccc2)c1 ZINC000531966095 334324317 /nfs/dbraw/zinc/32/43/17/334324317.db2.gz WTUKVIFDVKDSTB-LPHOPBHVSA-N 0 0 322.477 5.200 20 0 DKADRN Cc1ccc(C)c([C@H](C)N[C@@H](c2nccs2)c2ccccc2)c1 ZINC000531966096 334324309 /nfs/dbraw/zinc/32/43/09/334324309.db2.gz WTUKVIFDVKDSTB-QFBILLFUSA-N 0 0 322.477 5.200 20 0 DKADRN Cc1ccc(C)c([C@@H](C)N[C@@H](c2nccs2)c2ccccc2)c1 ZINC000531966097 334324243 /nfs/dbraw/zinc/32/42/43/334324243.db2.gz WTUKVIFDVKDSTB-VQIMIIECSA-N 0 0 322.477 5.200 20 0 DKADRN CC[C@@H](N[C@H](C)c1cc(F)ccc1F)c1ccc(F)cc1F ZINC000531969521 334327699 /nfs/dbraw/zinc/32/76/99/334327699.db2.gz XPBCHGHUTZSZSZ-BMLIUANNSA-N 0 0 311.322 5.045 20 0 DKADRN CC[C@H](N[C@@H](C)c1cc(F)ccc1F)c1ccc(F)cc1F ZINC000531969522 334327807 /nfs/dbraw/zinc/32/78/07/334327807.db2.gz XPBCHGHUTZSZSZ-BTDLBPIBSA-N 0 0 311.322 5.045 20 0 DKADRN CC[C@@H](N[C@@H](C)c1cc(F)ccc1F)c1ccc(F)cc1F ZINC000531969523 334327749 /nfs/dbraw/zinc/32/77/49/334327749.db2.gz XPBCHGHUTZSZSZ-DYZYQPBXSA-N 0 0 311.322 5.045 20 0 DKADRN CC[C@H](N[C@H](C)c1cc(F)ccc1F)c1ccc(F)cc1F ZINC000531969524 334327684 /nfs/dbraw/zinc/32/76/84/334327684.db2.gz XPBCHGHUTZSZSZ-QGHHPUGFSA-N 0 0 311.322 5.045 20 0 DKADRN CCc1nc([C@H](C)N[C@@H](C)c2ccc(C(C)C)cc2)cs1 ZINC000531971288 334331773 /nfs/dbraw/zinc/33/17/73/334331773.db2.gz VKPLMRVDCUNOJJ-KBPBESRZSA-N 0 0 302.487 5.241 20 0 DKADRN CCc1nc([C@H](C)N[C@H](C)c2ccc(C(C)C)cc2)cs1 ZINC000531971289 334331804 /nfs/dbraw/zinc/33/18/04/334331804.db2.gz VKPLMRVDCUNOJJ-KGLIPLIRSA-N 0 0 302.487 5.241 20 0 DKADRN CCc1nc([C@@H](C)N[C@@H](C)c2ccc(C(C)C)cc2)cs1 ZINC000531971290 334331843 /nfs/dbraw/zinc/33/18/43/334331843.db2.gz VKPLMRVDCUNOJJ-UONOGXRCSA-N 0 0 302.487 5.241 20 0 DKADRN CCc1nc([C@@H](C)N[C@H](C)c2ccc(C(C)C)cc2)cs1 ZINC000531971291 334331735 /nfs/dbraw/zinc/33/17/35/334331735.db2.gz VKPLMRVDCUNOJJ-ZIAGYGMSSA-N 0 0 302.487 5.241 20 0 DKADRN CCc1cc(CN[C@@H](C)c2ccc(C3CCCCC3)cc2)on1 ZINC000531976865 334347835 /nfs/dbraw/zinc/34/78/35/334347835.db2.gz GAPVABSFVQIYJY-HNNXBMFYSA-N 0 0 312.457 5.136 20 0 DKADRN CCc1cc(CN[C@H](C)c2ccc(C3CCCCC3)cc2)on1 ZINC000531976866 334347998 /nfs/dbraw/zinc/34/79/98/334347998.db2.gz GAPVABSFVQIYJY-OAHLLOKOSA-N 0 0 312.457 5.136 20 0 DKADRN Cc1cnc(CN[C@@H](C)c2ccc(C3CCCCC3)cc2)s1 ZINC000531980977 334352941 /nfs/dbraw/zinc/35/29/41/334352941.db2.gz YYIDZKMCWLFNCC-HNNXBMFYSA-N 0 0 314.498 5.350 20 0 DKADRN Cc1cnc(CN[C@H](C)c2ccc(C3CCCCC3)cc2)s1 ZINC000531980978 334352951 /nfs/dbraw/zinc/35/29/51/334352951.db2.gz YYIDZKMCWLFNCC-OAHLLOKOSA-N 0 0 314.498 5.350 20 0 DKADRN CCC(CC)c1cc(CN[C@H]2CCc3c2cccc3Cl)on1 ZINC000531981267 334353084 /nfs/dbraw/zinc/35/30/84/334353084.db2.gz FTDWXHZTHUAODR-KRWDZBQOSA-N 0 0 318.848 5.009 20 0 DKADRN CCC(CC)c1cc(CN[C@@H]2CCc3c2cccc3Cl)on1 ZINC000531981268 334353166 /nfs/dbraw/zinc/35/31/66/334353166.db2.gz FTDWXHZTHUAODR-QGZVFWFLSA-N 0 0 318.848 5.009 20 0 DKADRN Cc1ccccc1[C@@H](C)Sc1nnc(-c2ccc(F)cc2)o1 ZINC000532009461 334370388 /nfs/dbraw/zinc/37/03/88/334370388.db2.gz FROHONIYMHZHGN-GFCCVEGCSA-N 0 0 314.385 5.037 20 0 DKADRN Cc1ccccc1[C@H](C)Sc1nnc(-c2ccc(F)cc2)o1 ZINC000532009462 334370488 /nfs/dbraw/zinc/37/04/88/334370488.db2.gz FROHONIYMHZHGN-LBPRGKRZSA-N 0 0 314.385 5.037 20 0 DKADRN O=C(Nc1cccc(Cl)c1Cl)c1cc(F)cc(Cl)c1 ZINC000532058617 334716231 /nfs/dbraw/zinc/71/62/31/334716231.db2.gz RXPYOLRQKKXLRP-UHFFFAOYSA-N 0 0 318.562 5.038 20 0 DKADRN CCc1noc(C)c1CNc1ccc(-c2ccccc2)cc1C ZINC000532065975 334718640 /nfs/dbraw/zinc/71/86/40/334718640.db2.gz HIBMJCXZVWHPNY-UHFFFAOYSA-N 0 0 306.409 5.133 20 0 DKADRN O=[S@](Cc1cccc2ccccc21)[C@@H]1CCCc2ccccc21 ZINC000532065979 334718491 /nfs/dbraw/zinc/71/84/91/334718491.db2.gz LGEICUKDAZDSQH-FYYLOGMGSA-N 0 0 320.457 5.166 20 0 DKADRN O=[S@@](Cc1cccc2ccccc21)[C@H]1CCCc2ccccc21 ZINC000532065981 334718570 /nfs/dbraw/zinc/71/85/70/334718570.db2.gz LGEICUKDAZDSQH-GMAHTHKFSA-N 0 0 320.457 5.166 20 0 DKADRN O=[S@](Cc1cccc2ccccc21)[C@H]1CCCc2ccccc21 ZINC000532065982 334718673 /nfs/dbraw/zinc/71/86/73/334718673.db2.gz LGEICUKDAZDSQH-JTHBVZDNSA-N 0 0 320.457 5.166 20 0 DKADRN CC(C)(C)[C@@H](NCc1ccc(Cl)o1)c1ccc(F)cc1F ZINC000532077138 334720928 /nfs/dbraw/zinc/72/09/28/334720928.db2.gz CYHHXLKJTQEEDC-HNNXBMFYSA-N 0 0 313.775 5.088 20 0 DKADRN CC(C)(C)[C@H](NCc1ccc(Cl)o1)c1ccc(F)cc1F ZINC000532077139 334720781 /nfs/dbraw/zinc/72/07/81/334720781.db2.gz CYHHXLKJTQEEDC-OAHLLOKOSA-N 0 0 313.775 5.088 20 0 DKADRN CCc1cnc(CS[C@@H](C)c2ccc(C(F)(F)F)cc2)o1 ZINC000532114189 335901114 /nfs/dbraw/zinc/90/11/14/335901114.db2.gz FHAXJHGWIXLZCN-JTQLQIEISA-N 0 0 315.360 5.250 20 0 DKADRN CCc1cnc(CS[C@H](C)c2ccc(C(F)(F)F)cc2)o1 ZINC000532114190 335901047 /nfs/dbraw/zinc/90/10/47/335901047.db2.gz FHAXJHGWIXLZCN-SNVBAGLBSA-N 0 0 315.360 5.250 20 0 DKADRN CCc1cnc(CNc2ccc(Sc3ccccc3)cc2C)o1 ZINC000532115535 335901300 /nfs/dbraw/zinc/90/13/00/335901300.db2.gz OVTQAZMYGDUZOY-UHFFFAOYSA-N 0 0 324.449 5.309 20 0 DKADRN Cc1cc(CN[C@@H](c2cccc(Cl)c2)C2CCCCC2)no1 ZINC000532115808 335901146 /nfs/dbraw/zinc/90/11/46/335901146.db2.gz QUEPVWRLNXQAMI-GOSISDBHSA-N 0 0 318.848 5.048 20 0 DKADRN Cc1ccccc1[C@H](C)Nc1cccc(COCc2ccco2)c1 ZINC000532187544 335912352 /nfs/dbraw/zinc/91/23/52/335912352.db2.gz ICTOIUVPTVOVMB-KRWDZBQOSA-N 0 0 321.420 5.478 20 0 DKADRN Cc1ccccc1[C@@H](C)Nc1cccc(COCc2ccco2)c1 ZINC000532187546 335912345 /nfs/dbraw/zinc/91/23/45/335912345.db2.gz ICTOIUVPTVOVMB-QGZVFWFLSA-N 0 0 321.420 5.478 20 0 DKADRN C[C@@H](N[C@H](c1ccccc1)c1ccc(Cl)cc1)c1ccoc1 ZINC000532187686 335912527 /nfs/dbraw/zinc/91/25/27/335912527.db2.gz WFMMVYMNFNBCKU-AUUYWEPGSA-N 0 0 311.812 5.373 20 0 DKADRN C[C@H](N[C@@H](c1ccccc1)c1ccc(Cl)cc1)c1ccoc1 ZINC000532187689 335912354 /nfs/dbraw/zinc/91/23/54/335912354.db2.gz WFMMVYMNFNBCKU-LIRRHRJNSA-N 0 0 311.812 5.373 20 0 DKADRN Cc1ccccc1[C@H](C)Nc1cccc(OCc2cccnc2)c1 ZINC000532187730 335912312 /nfs/dbraw/zinc/91/23/12/335912312.db2.gz QHSCXHWUSLOLAC-KRWDZBQOSA-N 0 0 318.420 5.142 20 0 DKADRN CC(C)C[C@H](NCc1c(Cl)cccc1Cl)c1ccccn1 ZINC000532205559 335915129 /nfs/dbraw/zinc/91/51/29/335915129.db2.gz KGBNHHIJWJHQMO-KRWDZBQOSA-N 0 0 323.267 5.265 20 0 DKADRN CC[C@H](N[C@@H](C)c1ccc(F)cc1F)c1ccc(F)cc1F ZINC000532225575 335920606 /nfs/dbraw/zinc/92/06/06/335920606.db2.gz HRZWLGZQUKORGC-BTDLBPIBSA-N 0 0 311.322 5.045 20 0 DKADRN C[C@H](NCc1ccccc1Oc1cccc(F)c1)c1ccco1 ZINC000532227568 335920805 /nfs/dbraw/zinc/92/08/05/335920805.db2.gz DBRWHUCLANYNEN-AWEZNQCLSA-N 0 0 311.356 5.062 20 0 DKADRN CC[C@H](N[C@H](C)c1nc(C(C)(C)C)cs1)c1ccc(F)cc1 ZINC000532231224 335922300 /nfs/dbraw/zinc/92/23/00/335922300.db2.gz PQOPNCOUQDZRSD-DOMZBBRYSA-N 0 0 320.477 5.382 20 0 DKADRN CC[C@H](N[C@@H](C)c1nc(C(C)(C)C)cs1)c1ccc(F)cc1 ZINC000532231239 335922168 /nfs/dbraw/zinc/92/21/68/335922168.db2.gz PQOPNCOUQDZRSD-WFASDCNBSA-N 0 0 320.477 5.382 20 0 DKADRN c1cc(-c2nc(CNc3cccc4ccncc43)cs2)cs1 ZINC000532286611 335928582 /nfs/dbraw/zinc/92/85/82/335928582.db2.gz SBGAGKNPGCVLPH-UHFFFAOYSA-N 0 0 323.446 5.032 20 0 DKADRN CCc1noc(C)c1CNc1ccc2oc3ccccc3c2c1 ZINC000532320271 336238076 /nfs/dbraw/zinc/23/80/76/336238076.db2.gz OOSCTXMAWDBMNP-UHFFFAOYSA-N 0 0 306.365 5.057 20 0 DKADRN c1coc([C@@H](NCc2cc3ccccc3s2)c2ccccc2)c1 ZINC000532329021 336240707 /nfs/dbraw/zinc/24/07/07/336240707.db2.gz LTELJWBKKOVSJY-FQEVSTJZSA-N 0 0 319.429 5.374 20 0 DKADRN c1coc([C@H](NCc2cc3ccccc3s2)c2ccccc2)c1 ZINC000532329022 336240790 /nfs/dbraw/zinc/24/07/90/336240790.db2.gz LTELJWBKKOVSJY-HXUWFJFHSA-N 0 0 319.429 5.374 20 0 DKADRN Cc1cccc(NC(=O)c2ccc3sccc3c2)c1Cl ZINC000532365557 336244417 /nfs/dbraw/zinc/24/44/17/336244417.db2.gz LSPCLCSVUBHELX-UHFFFAOYSA-N 0 0 301.798 5.115 20 0 DKADRN CCc1cnc(CNc2ccccc2Sc2ccccc2)o1 ZINC000532368713 336244557 /nfs/dbraw/zinc/24/45/57/336244557.db2.gz VGSBULIONUDVLR-UHFFFAOYSA-N 0 0 310.422 5.000 20 0 DKADRN CCc1cnc(CNc2cccc(Cl)c2SC(C)C)o1 ZINC000532369198 336244542 /nfs/dbraw/zinc/24/45/42/336244542.db2.gz QXRQSXNDGCOEEM-UHFFFAOYSA-N 0 0 310.850 5.003 20 0 DKADRN CCc1cnc(CNc2cc(Cl)ccc2SC(C)C)o1 ZINC000532369521 336244680 /nfs/dbraw/zinc/24/46/80/336244680.db2.gz RALZMGFFZYKBRH-UHFFFAOYSA-N 0 0 310.850 5.003 20 0 DKADRN CC(C)c1ccc(NC(=O)CC2CCSCC2)c(C(C)C)c1 ZINC000532388476 336244964 /nfs/dbraw/zinc/24/49/64/336244964.db2.gz IFADAWKNGBZKGT-UHFFFAOYSA-N 0 0 319.514 5.405 20 0 DKADRN CCC(C)(C)OCc1cccc(NCc2ccc(C)cn2)c1C ZINC000532393728 336245259 /nfs/dbraw/zinc/24/52/59/336245259.db2.gz YNTHCNPCEWRNJU-UHFFFAOYSA-N 0 0 312.457 5.016 20 0 DKADRN Cc1ccc(Cl)c(NC(=O)c2cc3sccc3s2)c1 ZINC000532399937 336246164 /nfs/dbraw/zinc/24/61/64/336246164.db2.gz NRCCQFPGIBVRRE-UHFFFAOYSA-N 0 0 307.827 5.177 20 0 DKADRN Cc1nc2c(s1)[C@H]([NH2+][C@@H](CC(C)C)c1ccccc1)CCC2 ZINC000532459152 336248443 /nfs/dbraw/zinc/24/84/43/336248443.db2.gz KUJBAGXBRRNXTR-MSOLQXFVSA-N 0 0 314.498 5.206 20 0 DKADRN Cc1nc2c(s1)[C@H]([NH2+][C@H](CC(C)C)c1ccccc1)CCC2 ZINC000532459153 336248509 /nfs/dbraw/zinc/24/85/09/336248509.db2.gz KUJBAGXBRRNXTR-QZTJIDSGSA-N 0 0 314.498 5.206 20 0 DKADRN Cc1nc2c(s1)[C@@H]([NH2+][C@@H](CC(C)C)c1ccccc1)CCC2 ZINC000532459154 336248549 /nfs/dbraw/zinc/24/85/49/336248549.db2.gz KUJBAGXBRRNXTR-ROUUACIJSA-N 0 0 314.498 5.206 20 0 DKADRN Cc1nc2c(s1)[C@@H]([NH2+][C@H](CC(C)C)c1ccccc1)CCC2 ZINC000532459155 336248519 /nfs/dbraw/zinc/24/85/19/336248519.db2.gz KUJBAGXBRRNXTR-ZWKOTPCHSA-N 0 0 314.498 5.206 20 0 DKADRN CCc1ccc([C@H](C)[NH2+]Cc2ccccc2COC(C)C)s1 ZINC000532461439 336248769 /nfs/dbraw/zinc/24/87/69/336248769.db2.gz YHQXNXVGYQMMKA-HNNXBMFYSA-N 0 0 317.498 5.086 20 0 DKADRN CCc1ccc([C@@H](C)[NH2+]Cc2ccccc2COC(C)C)s1 ZINC000532461444 336248788 /nfs/dbraw/zinc/24/87/88/336248788.db2.gz YHQXNXVGYQMMKA-OAHLLOKOSA-N 0 0 317.498 5.086 20 0 DKADRN Cc1nc(-c2ccc(C[NH2+][C@@H](C)c3ccc(C)cc3)cc2)cs1 ZINC000532472152 336249842 /nfs/dbraw/zinc/24/98/42/336249842.db2.gz DIUXWBNOOXADHS-HNNXBMFYSA-N 0 0 322.477 5.278 20 0 DKADRN Cc1nc(-c2ccc(C[NH2+][C@H](C)c3ccc(C)cc3)cc2)cs1 ZINC000532472155 336249832 /nfs/dbraw/zinc/24/98/32/336249832.db2.gz DIUXWBNOOXADHS-OAHLLOKOSA-N 0 0 322.477 5.278 20 0 DKADRN C[C@@H]1C[C@H]1c1ccc(CN[C@@H]2C[C@H](C)Sc3sccc32)o1 ZINC000532474937 336249002 /nfs/dbraw/zinc/24/90/02/336249002.db2.gz CZOUOJLKKQLVNQ-BAESOJJISA-N 0 0 319.495 5.180 20 0 DKADRN C[C@@H]1C[C@H]1c1ccc(CN[C@H]2C[C@H](C)Sc3sccc32)o1 ZINC000532474945 336248928 /nfs/dbraw/zinc/24/89/28/336248928.db2.gz CZOUOJLKKQLVNQ-BVIHXZOGSA-N 0 0 319.495 5.180 20 0 DKADRN C[C@@H]1C[C@@H]1c1ccc(CN[C@@H]2C[C@H](C)Sc3sccc32)o1 ZINC000532474946 336248994 /nfs/dbraw/zinc/24/89/94/336248994.db2.gz CZOUOJLKKQLVNQ-FDRIWYBQSA-N 0 0 319.495 5.180 20 0 DKADRN C[C@@H]1C[C@@H]1c1ccc(CN[C@H]2C[C@H](C)Sc3sccc32)o1 ZINC000532474947 336248976 /nfs/dbraw/zinc/24/89/76/336248976.db2.gz CZOUOJLKKQLVNQ-PKIAMQTDSA-N 0 0 319.495 5.180 20 0 DKADRN C[C@H](NCc1nc(C(C)(C)C)cs1)c1ccc2ccccc2c1 ZINC000532485065 336251737 /nfs/dbraw/zinc/25/17/37/336251737.db2.gz NELFEHRVCIHCLV-AWEZNQCLSA-N 0 0 324.493 5.445 20 0 DKADRN C[C@@H](NCc1nc(C(C)(C)C)cs1)c1ccc2ccccc2c1 ZINC000532485066 336251723 /nfs/dbraw/zinc/25/17/23/336251723.db2.gz NELFEHRVCIHCLV-CQSZACIVSA-N 0 0 324.493 5.445 20 0 DKADRN CCC[C@@H]([NH2+][C@@H](C)c1ccoc1)c1cccc(C(F)(F)F)c1 ZINC000532491809 336250440 /nfs/dbraw/zinc/25/04/40/336250440.db2.gz HDQOWOCCIHZELD-BLLLJJGKSA-N 0 0 311.347 5.490 20 0 DKADRN CCC[C@H]([NH2+][C@@H](C)c1ccoc1)c1cccc(C(F)(F)F)c1 ZINC000532491810 336250523 /nfs/dbraw/zinc/25/05/23/336250523.db2.gz HDQOWOCCIHZELD-LRDDRELGSA-N 0 0 311.347 5.490 20 0 DKADRN CCC[C@@H]([NH2+][C@H](C)c1ccoc1)c1cccc(C(F)(F)F)c1 ZINC000532491811 336250468 /nfs/dbraw/zinc/25/04/68/336250468.db2.gz HDQOWOCCIHZELD-MLGOLLRUSA-N 0 0 311.347 5.490 20 0 DKADRN CCC[C@H]([NH2+][C@H](C)c1ccoc1)c1cccc(C(F)(F)F)c1 ZINC000532491812 336250533 /nfs/dbraw/zinc/25/05/33/336250533.db2.gz HDQOWOCCIHZELD-WBMJQRKESA-N 0 0 311.347 5.490 20 0 DKADRN CN(C(=O)Nc1ccc(SC2CCCC2)cc1)C1CCCC1 ZINC000532507483 336252822 /nfs/dbraw/zinc/25/28/22/336252822.db2.gz LBUONVVQAMKGOB-UHFFFAOYSA-N 0 0 318.486 5.128 20 0 DKADRN CC(C)(C)[C@@H](NCc1ncc(-c2ccccc2)o1)c1ccccc1 ZINC000532658546 336265111 /nfs/dbraw/zinc/26/51/11/336265111.db2.gz GVOMXSZMFVQUKD-FQEVSTJZSA-N 0 0 320.436 5.219 20 0 DKADRN CC(C)(C)[C@H](NCc1ncc(-c2ccccc2)o1)c1ccccc1 ZINC000532658547 336265116 /nfs/dbraw/zinc/26/51/16/336265116.db2.gz GVOMXSZMFVQUKD-HXUWFJFHSA-N 0 0 320.436 5.219 20 0 DKADRN O=C(Nc1cccc(Cl)c1Cl)c1ccc(F)c(Cl)c1 ZINC000532691136 336266752 /nfs/dbraw/zinc/26/67/52/336266752.db2.gz AEPFWNIRCLMNJX-UHFFFAOYSA-N 0 0 318.562 5.038 20 0 DKADRN Cc1cc(Cl)ccc1C(=O)Nc1cccc(Cl)c1Cl ZINC000532691175 336266674 /nfs/dbraw/zinc/26/66/74/336266674.db2.gz MEFAOYSCCGWQMF-UHFFFAOYSA-N 0 0 314.599 5.208 20 0 DKADRN Cc1csc(-c2cccc(NCc3cccc4cc[nH]c43)c2)n1 ZINC000532727283 336267658 /nfs/dbraw/zinc/26/76/58/336267658.db2.gz BIFWTPIFXUCISP-UHFFFAOYSA-N 0 0 319.433 5.212 20 0 DKADRN c1nc(C2CCCCC2)sc1CNc1cccc2ccncc21 ZINC000532736252 336268915 /nfs/dbraw/zinc/26/89/15/336268915.db2.gz YCQIIGPCXXAQEU-UHFFFAOYSA-N 0 0 323.465 5.351 20 0 DKADRN Cc1ccc(CNc2cccc(CSC3CCCC3)c2)nc1 ZINC000532742482 336269157 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CCCN(C(=O)C1CCC(F)(F)CC1)[C@H](CC)c1ccccc1 ZINC000534613268 334301602 /nfs/dbraw/zinc/30/16/02/334301602.db2.gz LFVVGKQYFIXXDW-QGZVFWFLSA-N 0 0 323.427 5.202 20 0 DKADRN c1sc(C2CC2)nc1CNc1ccc(Oc2ccccc2)cc1 ZINC000534615379 334301931 /nfs/dbraw/zinc/30/19/31/334301931.db2.gz VDVAXLTVYPOIAU-UHFFFAOYSA-N 0 0 322.433 5.425 20 0 DKADRN c1sc(C2CC2)nc1CNc1ccc2oc3ccccc3c2c1 ZINC000534615403 334301942 /nfs/dbraw/zinc/30/19/42/334301942.db2.gz WUZZSNXAUFIXJL-UHFFFAOYSA-N 0 0 320.417 5.532 20 0 DKADRN Clc1ccc([C@@H]2CCCN2Cc2csc(C3CC3)n2)cc1 ZINC000534618536 334299893 /nfs/dbraw/zinc/29/98/93/334299893.db2.gz PDZCPHNTWIBDBU-INIZCTEOSA-N 0 0 318.873 5.011 20 0 DKADRN Clc1ccc([C@H]2CCCN2Cc2csc(C3CC3)n2)cc1 ZINC000534618537 334299930 /nfs/dbraw/zinc/29/99/30/334299930.db2.gz PDZCPHNTWIBDBU-MRXNPFEDSA-N 0 0 318.873 5.011 20 0 DKADRN CC(C)(C)c1csc(CSCc2csc(C3CC3)n2)n1 ZINC000534681955 334324251 /nfs/dbraw/zinc/32/42/51/334324251.db2.gz YJXMJUOYQWWWRP-UHFFFAOYSA-N 0 0 324.540 5.208 20 0 DKADRN C[C@@H](SCc1csc(C2CC2)n1)c1ccc(F)c(F)c1 ZINC000534684866 334324771 /nfs/dbraw/zinc/32/47/71/334324771.db2.gz OPDHHDSFHZJLAR-SECBINFHSA-N 0 0 311.422 5.293 20 0 DKADRN C[C@H](SCc1csc(C2CC2)n1)c1ccc(F)c(F)c1 ZINC000534684867 334324932 /nfs/dbraw/zinc/32/49/32/334324932.db2.gz OPDHHDSFHZJLAR-VIFPVBQESA-N 0 0 311.422 5.293 20 0 DKADRN Cc1ccc(-c2ncco2)cc1N[C@H](C)c1c(F)cccc1F ZINC000534686377 334324758 /nfs/dbraw/zinc/32/47/58/334324758.db2.gz LAVCPVRNGPSRTR-GFCCVEGCSA-N 0 0 314.335 5.101 20 0 DKADRN Cc1ccc(-c2ncco2)cc1N[C@@H](C)c1c(F)cccc1F ZINC000534686378 334325159 /nfs/dbraw/zinc/32/51/59/334325159.db2.gz LAVCPVRNGPSRTR-LBPRGKRZSA-N 0 0 314.335 5.101 20 0 DKADRN Cc1ccc(-c2ncco2)cc1N[C@H](C)c1ccc(F)cc1F ZINC000534688424 334325511 /nfs/dbraw/zinc/32/55/11/334325511.db2.gz GGWBGLHWIPBNPO-GFCCVEGCSA-N 0 0 314.335 5.101 20 0 DKADRN Cc1ccc(-c2ncco2)cc1N[C@@H](C)c1ccc(F)cc1F ZINC000534688425 334325318 /nfs/dbraw/zinc/32/53/18/334325318.db2.gz GGWBGLHWIPBNPO-LBPRGKRZSA-N 0 0 314.335 5.101 20 0 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DKADRN CC(C)c1ccc([C@@H]2CCCN2C(=O)Nc2ccsc2)cc1 ZINC000534746668 334333824 /nfs/dbraw/zinc/33/38/24/334333824.db2.gz PHFCUMKCKSATDP-KRWDZBQOSA-N 0 0 314.454 5.241 20 0 DKADRN CC(C)c1ccc([C@H]2CCCN2C(=O)Nc2ccsc2)cc1 ZINC000534746670 334333848 /nfs/dbraw/zinc/33/38/48/334333848.db2.gz PHFCUMKCKSATDP-QGZVFWFLSA-N 0 0 314.454 5.241 20 0 DKADRN CCc1cccc(CC)c1NC(=O)c1cccc(-c2ccoc2)c1 ZINC000534767148 334335093 /nfs/dbraw/zinc/33/50/93/334335093.db2.gz LCIUWXPWBOMOCI-UHFFFAOYSA-N 0 0 319.404 5.324 20 0 DKADRN CC(C)Sc1c(Cl)cccc1NCc1ncc(C2CC2)o1 ZINC000534792062 334338923 /nfs/dbraw/zinc/33/89/23/334338923.db2.gz GONRUSSEBCAWMX-UHFFFAOYSA-N 0 0 322.861 5.318 20 0 DKADRN COCCCCNc1ccc([C@H](C)Sc2ccccc2)cc1 ZINC000534792480 334339226 /nfs/dbraw/zinc/33/92/26/334339226.db2.gz COUKFZGSOHZKQY-INIZCTEOSA-N 0 0 315.482 5.378 20 0 DKADRN COCCCCNc1ccc([C@@H](C)Sc2ccccc2)cc1 ZINC000534792482 334339166 /nfs/dbraw/zinc/33/91/66/334339166.db2.gz COUKFZGSOHZKQY-MRXNPFEDSA-N 0 0 315.482 5.378 20 0 DKADRN 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CCCN(Cc1ncc(C2CC2)o1)[C@@H](C)c1cc2ccccc2o1 ZINC000534811110 334338065 /nfs/dbraw/zinc/33/80/65/334338065.db2.gz FHEJYWLDRNAKLH-AWEZNQCLSA-N 0 0 324.424 5.271 20 0 DKADRN CCCN(Cc1ncc(C2CC2)o1)[C@H](C)c1cc2ccccc2o1 ZINC000534811111 334338076 /nfs/dbraw/zinc/33/80/76/334338076.db2.gz FHEJYWLDRNAKLH-CQSZACIVSA-N 0 0 324.424 5.271 20 0 DKADRN Cc1cccc(NC(=O)c2cccc(-c3ccoc3)c2)c1Cl ZINC000534816222 334340023 /nfs/dbraw/zinc/34/00/23/334340023.db2.gz UPSLAUJWYJZYLL-UHFFFAOYSA-N 0 0 311.768 5.161 20 0 DKADRN CCCCN(Cc1ncc(C2CC2)o1)Cc1ccccc1Cl ZINC000534857937 334341705 /nfs/dbraw/zinc/34/17/05/334341705.db2.gz FZYHROYQLGBHFA-UHFFFAOYSA-N 0 0 318.848 5.008 20 0 DKADRN CCC(CC)[C@H](C)C(=O)Nc1cc(-c2ccncc2)ccc1C ZINC000534871073 334342539 /nfs/dbraw/zinc/34/25/39/334342539.db2.gz YNRRYXXWHIAUDD-HNNXBMFYSA-N 0 0 310.441 5.068 20 0 DKADRN CCC(CC)[C@@H](C)C(=O)Nc1cc(-c2ccncc2)ccc1C ZINC000534871074 334342647 /nfs/dbraw/zinc/34/26/47/334342647.db2.gz YNRRYXXWHIAUDD-OAHLLOKOSA-N 0 0 310.441 5.068 20 0 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5.059 20 0 DKADRN Cc1c(Cl)cc(F)c(NC(=O)C[C@@H](C)c2ccccc2)c1F ZINC000534924473 334348875 /nfs/dbraw/zinc/34/88/75/334348875.db2.gz RKBLFUQJWMFPPE-SNVBAGLBSA-N 0 0 323.770 5.059 20 0 DKADRN CCCC[C@H](CC)CC(=O)Nc1cnn([C@H](C)CC)c1C1CC1 ZINC000534999187 334353123 /nfs/dbraw/zinc/35/31/23/334353123.db2.gz IAELBVASOSJBFH-CABCVRRESA-N 0 0 319.493 5.277 20 0 DKADRN CCCC[C@H](CC)CC(=O)Nc1cnn([C@@H](C)CC)c1C1CC1 ZINC000534999194 334353234 /nfs/dbraw/zinc/35/32/34/334353234.db2.gz IAELBVASOSJBFH-GJZGRUSLSA-N 0 0 319.493 5.277 20 0 DKADRN CCCC[C@@H](CC)CC(=O)Nc1cnn([C@H](C)CC)c1C1CC1 ZINC000534999195 334353146 /nfs/dbraw/zinc/35/31/46/334353146.db2.gz IAELBVASOSJBFH-HUUCEWRRSA-N 0 0 319.493 5.277 20 0 DKADRN CCCC[C@@H](CC)CC(=O)Nc1cnn([C@@H](C)CC)c1C1CC1 ZINC000534999196 334353235 /nfs/dbraw/zinc/35/32/35/334353235.db2.gz IAELBVASOSJBFH-LSDHHAIUSA-N 0 0 319.493 5.277 20 0 DKADRN O=C(Nc1cccc(Cl)c1Cl)c1ccc(Cl)c(F)c1 ZINC000535033128 334357314 /nfs/dbraw/zinc/35/73/14/334357314.db2.gz KDCSAYGJIFHTCI-UHFFFAOYSA-N 0 0 318.562 5.038 20 0 DKADRN CC(C)c1cccc(C(C)C)c1NC(=O)NC(C)(C)C1CC1 ZINC000535034024 334356382 /nfs/dbraw/zinc/35/63/82/334356382.db2.gz SUDHZAMKRNORQI-UHFFFAOYSA-N 0 0 302.462 5.244 20 0 DKADRN C[C@@H](N[C@@H](CC(C)(C)C)c1ccc(Cl)cc1)c1cscn1 ZINC000535063910 334362001 /nfs/dbraw/zinc/36/20/01/334362001.db2.gz LMCQQNLNEUTDCF-DOMZBBRYSA-N 0 0 322.905 5.625 20 0 DKADRN C[C@@H](N[C@H](CC(C)(C)C)c1ccc(Cl)cc1)c1cscn1 ZINC000535063942 334362035 /nfs/dbraw/zinc/36/20/35/334362035.db2.gz LMCQQNLNEUTDCF-IUODEOHRSA-N 0 0 322.905 5.625 20 0 DKADRN C[C@H](N[C@H](CC(C)(C)C)c1ccc(Cl)cc1)c1cscn1 ZINC000535063944 334362220 /nfs/dbraw/zinc/36/22/20/334362220.db2.gz LMCQQNLNEUTDCF-SWLSCSKDSA-N 0 0 322.905 5.625 20 0 DKADRN C[C@H](N[C@@H](CC(C)(C)C)c1ccc(Cl)cc1)c1cscn1 ZINC000535063946 334362092 /nfs/dbraw/zinc/36/20/92/334362092.db2.gz LMCQQNLNEUTDCF-WFASDCNBSA-N 0 0 322.905 5.625 20 0 DKADRN Cc1cccc(C(N[C@@H](C)c2cscn2)c2cccc(C)c2)c1 ZINC000535063955 334362118 /nfs/dbraw/zinc/36/21/18/334362118.db2.gz GUYCBEWRLIZDPX-INIZCTEOSA-N 0 0 322.477 5.200 20 0 DKADRN Cc1cccc(C(N[C@H](C)c2cscn2)c2cccc(C)c2)c1 ZINC000535063998 334362157 /nfs/dbraw/zinc/36/21/57/334362157.db2.gz GUYCBEWRLIZDPX-MRXNPFEDSA-N 0 0 322.477 5.200 20 0 DKADRN CC(C)Cc1ccc([C@@H](N[C@H](C)c2cscn2)C2CC2)cc1 ZINC000535064128 334362207 /nfs/dbraw/zinc/36/22/07/334362207.db2.gz LLENADFKLMQSJK-AUUYWEPGSA-N 0 0 314.498 5.144 20 0 DKADRN CC(C)Cc1ccc([C@@H](N[C@@H](C)c2cscn2)C2CC2)cc1 ZINC000535064142 334362132 /nfs/dbraw/zinc/36/21/32/334362132.db2.gz LLENADFKLMQSJK-IFXJQAMLSA-N 0 0 314.498 5.144 20 0 DKADRN CC(C)Cc1ccc([C@H](N[C@H](C)c2cscn2)C2CC2)cc1 ZINC000535064144 334362222 /nfs/dbraw/zinc/36/22/22/334362222.db2.gz LLENADFKLMQSJK-KUHUBIRLSA-N 0 0 314.498 5.144 20 0 DKADRN CC(C)Cc1ccc([C@H](N[C@@H](C)c2cscn2)C2CC2)cc1 ZINC000535064146 334362170 /nfs/dbraw/zinc/36/21/70/334362170.db2.gz LLENADFKLMQSJK-LIRRHRJNSA-N 0 0 314.498 5.144 20 0 DKADRN C[C@@H](N[C@@H](C)c1cscn1)c1ccccc1Oc1ccccc1 ZINC000535065405 334362712 /nfs/dbraw/zinc/36/27/12/334362712.db2.gz PWMUDJOXVOPFMH-CABCVRRESA-N 0 0 324.449 5.347 20 0 DKADRN C[C@H](N[C@@H](C)c1ccccc1Oc1ccccc1)c1cscn1 ZINC000535065406 334362743 /nfs/dbraw/zinc/36/27/43/334362743.db2.gz PWMUDJOXVOPFMH-GJZGRUSLSA-N 0 0 324.449 5.347 20 0 DKADRN C[C@@H](N[C@H](C)c1ccccc1Oc1ccccc1)c1cscn1 ZINC000535065407 334362640 /nfs/dbraw/zinc/36/26/40/334362640.db2.gz PWMUDJOXVOPFMH-HUUCEWRRSA-N 0 0 324.449 5.347 20 0 DKADRN C[C@@H](N[C@@H](C)c1ccccc1Oc1ccccc1)c1cscn1 ZINC000535065408 334362674 /nfs/dbraw/zinc/36/26/74/334362674.db2.gz PWMUDJOXVOPFMH-LSDHHAIUSA-N 0 0 324.449 5.347 20 0 DKADRN CC(C)Sc1ccc([C@@H](C)N[C@H](C)c2cscn2)cc1 ZINC000535066334 334363019 /nfs/dbraw/zinc/36/30/19/334363019.db2.gz JEMBRLWLHVIGLR-CHWSQXEVSA-N 0 0 306.500 5.055 20 0 DKADRN CC(C)Sc1ccc([C@@H](C)N[C@@H](C)c2cscn2)cc1 ZINC000535066351 334363276 /nfs/dbraw/zinc/36/32/76/334363276.db2.gz JEMBRLWLHVIGLR-OLZOCXBDSA-N 0 0 306.500 5.055 20 0 DKADRN CC(C)Sc1ccc([C@H](C)N[C@H](C)c2cscn2)cc1 ZINC000535066353 334363294 /nfs/dbraw/zinc/36/32/94/334363294.db2.gz JEMBRLWLHVIGLR-QWHCGFSZSA-N 0 0 306.500 5.055 20 0 DKADRN CC(C)Sc1ccc([C@H](C)N[C@@H](C)c2cscn2)cc1 ZINC000535066354 334363017 /nfs/dbraw/zinc/36/30/17/334363017.db2.gz JEMBRLWLHVIGLR-STQMWFEESA-N 0 0 306.500 5.055 20 0 DKADRN Cc1ccccc1Oc1ccccc1CN[C@@H](C)c1cscn1 ZINC000535066375 334363064 /nfs/dbraw/zinc/36/30/64/334363064.db2.gz JVMOAZQIOFDBKB-HNNXBMFYSA-N 0 0 324.449 5.095 20 0 DKADRN Cc1ccccc1Oc1ccccc1CN[C@H](C)c1cscn1 ZINC000535066385 334363288 /nfs/dbraw/zinc/36/32/88/334363288.db2.gz JVMOAZQIOFDBKB-OAHLLOKOSA-N 0 0 324.449 5.095 20 0 DKADRN C[C@H](c1ccccc1)N(C)Cc1csc(-c2ccccc2)n1 ZINC000535070093 334364270 /nfs/dbraw/zinc/36/42/70/334364270.db2.gz SAJLVKZROAXKQR-OAHLLOKOSA-N 0 0 308.450 5.003 20 0 DKADRN Cc1cccc(C(=O)Nc2cccc3ccsc32)c1Cl ZINC000535097077 334369947 /nfs/dbraw/zinc/36/99/47/334369947.db2.gz RMDYVHQWZQQPKE-UHFFFAOYSA-N 0 0 301.798 5.115 20 0 DKADRN Cc1cccc(C(=O)Nc2ccc(OC(C)(C)C)cc2)c1Cl ZINC000535098509 334370194 /nfs/dbraw/zinc/37/01/94/334370194.db2.gz DTXNYYUEYZQLPT-UHFFFAOYSA-N 0 0 317.816 5.078 20 0 DKADRN CCCCCN(C(=O)c1cccc(-c2ccccn2)c1C)C(C)C ZINC000535099885 334368027 /nfs/dbraw/zinc/36/80/27/334368027.db2.gz JKKPQDGLNDLRFD-UHFFFAOYSA-N 0 0 324.468 5.098 20 0 DKADRN Cc1cccc(C(=O)Nc2ccccc2-c2ccccc2)c1Cl ZINC000535102896 334368220 /nfs/dbraw/zinc/36/82/20/334368220.db2.gz XMNVFFBUJAQASR-UHFFFAOYSA-N 0 0 321.807 5.568 20 0 DKADRN Cc1cccc(C(=O)Nc2ccccc2C(C)(C)C)c1Cl ZINC000535115692 334370466 /nfs/dbraw/zinc/37/04/66/334370466.db2.gz IGDFCNUIHPGHQO-UHFFFAOYSA-N 0 0 301.817 5.198 20 0 DKADRN Cc1cc(C)c(NC(=O)[C@@H](C)Cc2cccc(Cl)c2)c(C)c1 ZINC000535123130 334370951 /nfs/dbraw/zinc/37/09/51/334370951.db2.gz IUUCLSNBJNYKBL-HNNXBMFYSA-N 0 0 315.844 5.083 20 0 DKADRN Cc1cc(C)c(NC(=O)[C@H](C)Cc2cccc(Cl)c2)c(C)c1 ZINC000535123136 334370850 /nfs/dbraw/zinc/37/08/50/334370850.db2.gz IUUCLSNBJNYKBL-OAHLLOKOSA-N 0 0 315.844 5.083 20 0 DKADRN Cc1noc(C)c1CCSCc1ccc(Cl)c(Cl)c1 ZINC000535137540 334374354 /nfs/dbraw/zinc/37/43/54/334374354.db2.gz INTINJXKAKNPHV-UHFFFAOYSA-N 0 0 316.253 5.074 20 0 DKADRN Cc1ccnc(CNc2ccc(-c3cccc(Cl)c3)cc2C)n1 ZINC000535138444 334374658 /nfs/dbraw/zinc/37/46/58/334374658.db2.gz STDWQFGKUJAGDN-UHFFFAOYSA-N 0 0 323.827 5.026 20 0 DKADRN Cc1ccnc(CS[C@@H](C)c2ccc(Cl)c(Cl)c2)n1 ZINC000535139339 334374740 /nfs/dbraw/zinc/37/47/40/334374740.db2.gz UIIJMQOTIPLJKJ-JTQLQIEISA-N 0 0 313.253 5.086 20 0 DKADRN Cc1ccnc(CS[C@H](C)c2ccc(Cl)c(Cl)c2)n1 ZINC000535139343 334374724 /nfs/dbraw/zinc/37/47/24/334374724.db2.gz UIIJMQOTIPLJKJ-SNVBAGLBSA-N 0 0 313.253 5.086 20 0 DKADRN Cc1nc(C(C)C)sc1[C@H](C)N(C)C(=O)CC1CCCCC1 ZINC000535170337 334375558 /nfs/dbraw/zinc/37/55/58/334375558.db2.gz ABHNCBSOTWCUHL-AWEZNQCLSA-N 0 0 322.518 5.065 20 0 DKADRN Cc1nc(C(C)C)sc1[C@@H](C)N(C)C(=O)CC1CCCCC1 ZINC000535170351 334375670 /nfs/dbraw/zinc/37/56/70/334375670.db2.gz ABHNCBSOTWCUHL-CQSZACIVSA-N 0 0 322.518 5.065 20 0 DKADRN CC[C@@H](CC(=O)N(C)[C@H](C)c1sc(C(C)C)nc1C)C(C)C ZINC000535179281 334375865 /nfs/dbraw/zinc/37/58/65/334375865.db2.gz BCMGNCMHYMFCPW-CABCVRRESA-N 0 0 324.534 5.167 20 0 DKADRN CC[C@@H](CC(=O)N(C)[C@@H](C)c1sc(C(C)C)nc1C)C(C)C ZINC000535179297 334375846 /nfs/dbraw/zinc/37/58/46/334375846.db2.gz BCMGNCMHYMFCPW-GJZGRUSLSA-N 0 0 324.534 5.167 20 0 DKADRN CC[C@H](CC(=O)N(C)[C@H](C)c1sc(C(C)C)nc1C)C(C)C ZINC000535179300 334375773 /nfs/dbraw/zinc/37/57/73/334375773.db2.gz BCMGNCMHYMFCPW-HUUCEWRRSA-N 0 0 324.534 5.167 20 0 DKADRN CC[C@H](CC(=O)N(C)[C@@H](C)c1sc(C(C)C)nc1C)C(C)C ZINC000535179303 334375806 /nfs/dbraw/zinc/37/58/06/334375806.db2.gz BCMGNCMHYMFCPW-LSDHHAIUSA-N 0 0 324.534 5.167 20 0 DKADRN Cc1nc([C@H](C)N2CC=C(C)CC2)oc1-c1ccc(Cl)cc1 ZINC000535209064 334378409 /nfs/dbraw/zinc/37/84/09/334378409.db2.gz AFUNADYORUQSEW-AWEZNQCLSA-N 0 0 316.832 5.016 20 0 DKADRN Cc1nc([C@@H](C)N2CC=C(C)CC2)oc1-c1ccc(Cl)cc1 ZINC000535209081 334378523 /nfs/dbraw/zinc/37/85/23/334378523.db2.gz AFUNADYORUQSEW-CQSZACIVSA-N 0 0 316.832 5.016 20 0 DKADRN CCSc1ccc([C@@H](C)[NH2+][C@@H]2CSc3ccccc32)cc1 ZINC000535234136 334381236 /nfs/dbraw/zinc/38/12/36/334381236.db2.gz OYGSAFCMGUZRMN-CXAGYDPISA-N 0 0 315.507 5.296 20 0 DKADRN CCSc1ccc([C@@H](C)[NH2+][C@H]2CSc3ccccc32)cc1 ZINC000535234149 334381107 /nfs/dbraw/zinc/38/11/07/334381107.db2.gz OYGSAFCMGUZRMN-DYVFJYSZSA-N 0 0 315.507 5.296 20 0 DKADRN CCSc1ccc([C@H](C)[NH2+][C@H]2CSc3ccccc32)cc1 ZINC000535234150 334381196 /nfs/dbraw/zinc/38/11/96/334381196.db2.gz OYGSAFCMGUZRMN-GUYCJALGSA-N 0 0 315.507 5.296 20 0 DKADRN CCSc1ccc([C@H](C)[NH2+][C@@H]2CSc3ccccc32)cc1 ZINC000535234151 334381174 /nfs/dbraw/zinc/38/11/74/334381174.db2.gz OYGSAFCMGUZRMN-SUMWQHHRSA-N 0 0 315.507 5.296 20 0 DKADRN Cc1ccccc1-c1cnc(COc2ccc(F)cc2Cl)o1 ZINC000535259501 334383224 /nfs/dbraw/zinc/38/32/24/334383224.db2.gz CFFMSXYQICACHM-UHFFFAOYSA-N 0 0 317.747 5.022 20 0 DKADRN Cc1ccccc1-c1cnc(CS[C@@H](C)c2ccccc2)o1 ZINC000535261670 334383305 /nfs/dbraw/zinc/38/33/05/334383305.db2.gz WZMPNUBJLRUMGS-HNNXBMFYSA-N 0 0 309.434 5.644 20 0 DKADRN Cc1ccccc1-c1cnc(CS[C@H](C)c2ccccc2)o1 ZINC000535261687 334383453 /nfs/dbraw/zinc/38/34/53/334383453.db2.gz WZMPNUBJLRUMGS-OAHLLOKOSA-N 0 0 309.434 5.644 20 0 DKADRN Cc1ccccc1-c1cnc(CSc2nc3ccccc3o2)o1 ZINC000535261787 334383349 /nfs/dbraw/zinc/38/33/49/334383349.db2.gz OGYHTHACAAPYNA-UHFFFAOYSA-N 0 0 322.389 5.084 20 0 DKADRN Cc1ccccc1-c1cnc(CSc2ccc(F)c(F)c2)o1 ZINC000535263178 334384389 /nfs/dbraw/zinc/38/43/89/334384389.db2.gz XQHUAIQMRGRPRW-UHFFFAOYSA-N 0 0 317.360 5.221 20 0 DKADRN Cc1ccccc1-c1cnc(CNc2ccc(F)c(Cl)c2)o1 ZINC000535264678 334556188 /nfs/dbraw/zinc/55/61/88/334556188.db2.gz JOKVRAUSGMANAH-UHFFFAOYSA-N 0 0 316.763 5.055 20 0 DKADRN CCc1cccc(C)c1NCc1ncc(-c2ccccc2C)o1 ZINC000535264867 334556182 /nfs/dbraw/zinc/55/61/82/334556182.db2.gz LIBOOJFQOQGNSD-UHFFFAOYSA-N 0 0 306.409 5.133 20 0 DKADRN Cc1ccccc1-c1cnc(CNc2cccc(Cl)c2C)o1 ZINC000535265752 334557872 /nfs/dbraw/zinc/55/78/72/334557872.db2.gz ROIBBASQEVPQKH-UHFFFAOYSA-N 0 0 312.800 5.224 20 0 DKADRN Cc1ccccc1-c1cnc(CNc2ccccc2C(C)(C)C)o1 ZINC000535265980 334563183 /nfs/dbraw/zinc/56/31/83/334563183.db2.gz VMEDZTAXETYSOY-UHFFFAOYSA-N 0 0 320.436 5.560 20 0 DKADRN Cc1cccc(NC(=O)c2ccccc2CCC(F)(F)F)c1C ZINC000535329274 334717007 /nfs/dbraw/zinc/71/70/07/334717007.db2.gz HQUDSVQADCNGNR-UHFFFAOYSA-N 0 0 321.342 5.051 20 0 DKADRN Cc1nnc(S[C@H](C)c2ccccc2)n1[C@@H]1CCC[C@@H](C)C1 ZINC000535335984 334715012 /nfs/dbraw/zinc/71/50/12/334715012.db2.gz MRPMOGBXBJTYAT-CKEIUWERSA-N 0 0 315.486 5.191 20 0 DKADRN Cc1nnc(S[C@H](C)c2ccccc2)n1[C@H]1CCC[C@@H](C)C1 ZINC000535335991 334715030 /nfs/dbraw/zinc/71/50/30/334715030.db2.gz MRPMOGBXBJTYAT-CPUCHLNUSA-N 0 0 315.486 5.191 20 0 DKADRN c1sc(C2CC2)nc1CNc1ccc(-c2ccccc2)cc1 ZINC000535343734 334718906 /nfs/dbraw/zinc/71/89/06/334718906.db2.gz GKCPZBLFDUZMID-UHFFFAOYSA-N 0 0 306.434 5.300 20 0 DKADRN c1sc(C2CC2)nc1COc1ccccc1-c1ccccc1 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320.889 5.379 20 0 DKADRN C[C@H](N[C@H](c1ccc(Cl)cc1)C1CCCC1)c1cscn1 ZINC000536625252 335845520 /nfs/dbraw/zinc/84/55/20/335845520.db2.gz GILIDBQLUAZGGU-SJCJKPOMSA-N 0 0 320.889 5.379 20 0 DKADRN C[C@@H](N[C@@H](c1ccc(Cl)cc1)C1CCCC1)c1cscn1 ZINC000536625253 335845617 /nfs/dbraw/zinc/84/56/17/335845617.db2.gz GILIDBQLUAZGGU-SJKOYZFVSA-N 0 0 320.889 5.379 20 0 DKADRN Cc1c2ccccc2oc1[C@@H](N[C@H](C)c1cscn1)C(C)C ZINC000536625640 335845684 /nfs/dbraw/zinc/84/56/84/335845684.db2.gz WTMXHJIUSQCHAU-DYVFJYSZSA-N 0 0 314.454 5.246 20 0 DKADRN CCOc1ccccc1-c1cccc(C(=O)Nc2ccsc2)c1 ZINC000536785421 335894832 /nfs/dbraw/zinc/89/48/32/335894832.db2.gz YEFHAJJIMSYPMB-UHFFFAOYSA-N 0 0 323.417 5.066 20 0 DKADRN C[C@@H](N[C@@H](C)c1cccc(F)c1F)c1ccc(Cl)c(F)c1 ZINC000536829899 337734183 /nfs/dbraw/zinc/73/41/83/337734183.db2.gz AKZOJNMELTYCCH-ZJUUUORDSA-N 0 0 313.750 5.169 20 0 DKADRN C[C@H](N[C@@H](CC1CCCC1)c1ccccc1)c1cscn1 ZINC000536840096 337737440 /nfs/dbraw/zinc/73/74/40/337737440.db2.gz PRBVOZUCFQBOFE-YOEHRIQHSA-N 0 0 300.471 5.115 20 0 DKADRN C[C@@H](N[C@H](c1ccccc1)c1cccc(Cl)c1)c1ccco1 ZINC000536860147 337746654 /nfs/dbraw/zinc/74/66/54/337746654.db2.gz VRPSMJJLVCLWFG-AUUYWEPGSA-N 0 0 311.812 5.373 20 0 DKADRN C[C@H](N[C@H](c1ccccc1)c1cccc(Cl)c1)c1ccco1 ZINC000536860161 337746531 /nfs/dbraw/zinc/74/65/31/337746531.db2.gz VRPSMJJLVCLWFG-IFXJQAMLSA-N 0 0 311.812 5.373 20 0 DKADRN C[C@@H](N[C@@H](c1ccccc1)c1cccc(Cl)c1)c1ccco1 ZINC000536860162 337746525 /nfs/dbraw/zinc/74/65/25/337746525.db2.gz VRPSMJJLVCLWFG-KUHUBIRLSA-N 0 0 311.812 5.373 20 0 DKADRN CCCc1ccc([C@@H](C)NCc2coc(-c3ccccc3)n2)cc1 ZINC000536870327 337752019 /nfs/dbraw/zinc/75/20/19/337752019.db2.gz OWGDOODRXWVIIV-MRXNPFEDSA-N 0 0 320.436 5.145 20 0 DKADRN C[C@H](N[C@@H](CC1CCCCC1)c1ccccc1)c1cscn1 ZINC000536872096 337754361 /nfs/dbraw/zinc/75/43/61/337754361.db2.gz WFFOPAFTBZEOED-YJBOKZPZSA-N 0 0 314.498 5.505 20 0 DKADRN Cc1cc(C)c([C@H](C)NCc2coc(-c3ccccc3)n2)cc1C ZINC000536873271 337759018 /nfs/dbraw/zinc/75/90/18/337759018.db2.gz XQGNZTVZHARQJB-KRWDZBQOSA-N 0 0 320.436 5.118 20 0 DKADRN Cc1cc(C)c([C@@H](C)NCc2coc(-c3ccccc3)n2)cc1C ZINC000536873296 337761017 /nfs/dbraw/zinc/76/10/17/337761017.db2.gz XQGNZTVZHARQJB-QGZVFWFLSA-N 0 0 320.436 5.118 20 0 DKADRN C[C@@H](N[C@@H](C)c1cc(F)cc(F)c1)c1c(F)cccc1Cl ZINC000536877870 337794372 /nfs/dbraw/zinc/79/43/72/337794372.db2.gz PDOPWWGYXJMPBR-VHSXEESVSA-N 0 0 313.750 5.169 20 0 DKADRN C[C@@H](N[C@@H](C)c1c(F)cccc1Cl)c1cc(F)cc(F)c1 ZINC000536877871 337794402 /nfs/dbraw/zinc/79/44/02/337794402.db2.gz PDOPWWGYXJMPBR-ZJUUUORDSA-N 0 0 313.750 5.169 20 0 DKADRN CCCn1c(C)nnc1CS[C@@H](CC)c1ccc(Cl)cc1 ZINC000536882445 337844216 /nfs/dbraw/zinc/84/42/16/337844216.db2.gz VFKPRRNTGUXIJD-HNNXBMFYSA-N 0 0 323.893 5.034 20 0 DKADRN C[C@@H](N[C@@H](C)c1ccco1)c1ccccc1OCc1ccccc1 ZINC000537012963 337863063 /nfs/dbraw/zinc/86/30/63/337863063.db2.gz MNOBFKPLNFRBGO-SJORKVTESA-N 0 0 321.420 5.270 20 0 DKADRN CSc1cccc(NCc2csc(C(C)(C)C)n2)c1C ZINC000537023181 337869017 /nfs/dbraw/zinc/86/90/17/337869017.db2.gz OPSVKPSBQYFWFY-UHFFFAOYSA-N 0 0 306.500 5.083 20 0 DKADRN CSc1cccc(NCc2ncc(-c3cccs3)o2)c1C ZINC000537038394 337882170 /nfs/dbraw/zinc/88/21/70/337882170.db2.gz IYFCQQYGNDCQIT-UHFFFAOYSA-N 0 0 316.451 5.046 20 0 DKADRN CCCCCSCC(=O)Nc1ccccc1-c1ccccc1 ZINC000537047767 337883679 /nfs/dbraw/zinc/88/36/79/337883679.db2.gz LXZYHWCMQSPNLJ-UHFFFAOYSA-N 0 0 313.466 5.216 20 0 DKADRN CCCCCS[C@@H](C)C(=O)Nc1c(C)cc(C)cc1Cl ZINC000537047916 337883696 /nfs/dbraw/zinc/88/36/96/337883696.db2.gz YGOLSRKCZBPEFF-ZDUSSCGKSA-N 0 0 313.894 5.207 20 0 DKADRN CC[C@H](NCc1ncc(-c2ccccc2C)o1)c1ccc(C)cc1 ZINC000537059944 337885468 /nfs/dbraw/zinc/88/54/68/337885468.db2.gz HGSJKTMBOMBEOH-IBGZPJMESA-N 0 0 320.436 5.199 20 0 DKADRN Cc1ccc(Nc2nc(CN[C@H](C)c3ccccc3)cs2)cc1 ZINC000537100709 337890385 /nfs/dbraw/zinc/89/03/85/337890385.db2.gz GZTHWQPUPPAERT-OAHLLOKOSA-N 0 0 323.465 5.046 20 0 DKADRN CC(C)(C)c1ccc(C(C)(C)NCc2nc3ccccc3o2)cc1 ZINC000537103877 337891566 /nfs/dbraw/zinc/89/15/66/337891566.db2.gz VTZXOLKGDBBGGL-UHFFFAOYSA-N 0 0 322.452 5.150 20 0 DKADRN Cc1nc(CNC(C)(C)c2ccc(C(C)(C)C)cc2)c(C)s1 ZINC000537104310 337891704 /nfs/dbraw/zinc/89/17/04/337891704.db2.gz RVOQMSMTNWQGII-UHFFFAOYSA-N 0 0 316.514 5.082 20 0 DKADRN CSc1cccc(NC(=O)N2CCC[C@H]2CCC(C)C)c1C ZINC000537107735 337892202 /nfs/dbraw/zinc/89/22/02/337892202.db2.gz NBQVRMNVDSLLKM-HNNXBMFYSA-N 0 0 320.502 5.149 20 0 DKADRN CCC[C@@]1(C)CCCN(C(=O)Nc2cccc(SC)c2C)C1 ZINC000537107895 337892164 /nfs/dbraw/zinc/89/21/64/337892164.db2.gz UQJYEVUXLXVCQL-SFHVURJKSA-N 0 0 320.502 5.151 20 0 DKADRN CCC(CC)CN(CC)C(=O)Nc1cccc(SC)c1C ZINC000537110641 337892515 /nfs/dbraw/zinc/89/25/15/337892515.db2.gz MNTRPGRQXMZMMN-UHFFFAOYSA-N 0 0 308.491 5.007 20 0 DKADRN CCCCCN(C(=O)Nc1c(F)cc(Cl)cc1F)C(C)C ZINC000537117285 337891513 /nfs/dbraw/zinc/89/15/13/337891513.db2.gz ARWMPDZMAXJBAV-UHFFFAOYSA-N 0 0 318.795 5.051 20 0 DKADRN Cc1cccc([C@H](NCc2ncc(C(C)(C)C)o2)C(C)(C)C)c1 ZINC000537133446 337894537 /nfs/dbraw/zinc/89/45/37/337894537.db2.gz XPGFRJMVWDZHTH-SFHVURJKSA-N 0 0 314.473 5.158 20 0 DKADRN CSc1cccc(NC(=O)c2cccc(-c3ccoc3)c2)c1C ZINC000537134374 337895092 /nfs/dbraw/zinc/89/50/92/337895092.db2.gz GVFLADZEHBAPLQ-UHFFFAOYSA-N 0 0 323.417 5.229 20 0 DKADRN CSc1cccc(NC(=O)[C@H](c2ccccc2)C(C)C)c1C ZINC000537137368 337899427 /nfs/dbraw/zinc/89/94/27/337899427.db2.gz LQQFVAFRBKOGEA-SFHVURJKSA-N 0 0 313.466 5.095 20 0 DKADRN CCC[C@H](C(=O)Nc1cccc(SC)c1C)c1ccccc1 ZINC000537137520 337899328 /nfs/dbraw/zinc/89/93/28/337899328.db2.gz RSPJERWCWXMLGC-INIZCTEOSA-N 0 0 313.466 5.239 20 0 DKADRN CCC[C@@H](C(=O)Nc1cccc(SC)c1C)c1ccccc1 ZINC000537137521 337899347 /nfs/dbraw/zinc/89/93/47/337899347.db2.gz RSPJERWCWXMLGC-MRXNPFEDSA-N 0 0 313.466 5.239 20 0 DKADRN CSc1cccc(NC(=O)c2cc3sccc3s2)c1C ZINC000537141427 337897751 /nfs/dbraw/zinc/89/77/51/337897751.db2.gz VHWQGRFFFYAZMP-UHFFFAOYSA-N 0 0 319.476 5.245 20 0 DKADRN CN(Cc1ccccc1)C(=O)N(c1ccccc1)c1ccccc1 ZINC000537162494 337903509 /nfs/dbraw/zinc/90/35/09/337903509.db2.gz FRNLELSIBHLLKM-UHFFFAOYSA-N 0 0 316.404 5.077 20 0 DKADRN CSc1cccc(NC(=O)c2oc3ccccc3c2C)c1C ZINC000537166966 337904930 /nfs/dbraw/zinc/90/49/30/337904930.db2.gz KZHHIHLTEUAMDH-UHFFFAOYSA-N 0 0 311.406 5.024 20 0 DKADRN CSc1cccc(NC(=O)c2cccc3c(C)c(C)[nH]c32)c1C ZINC000537173656 337906494 /nfs/dbraw/zinc/90/64/94/337906494.db2.gz CKAGDXCUMBALHW-UHFFFAOYSA-N 0 0 324.449 5.067 20 0 DKADRN CSc1cccc(NC(=O)c2occc2-c2ccccc2)c1C ZINC000537173904 337906560 /nfs/dbraw/zinc/90/65/60/337906560.db2.gz NXPWTKDEZFOLJQ-UHFFFAOYSA-N 0 0 323.417 5.229 20 0 DKADRN CSc1ccc(C)c(NC(=O)N2CCC[C@@H]2CCC(C)C)c1 ZINC000537221153 337925105 /nfs/dbraw/zinc/92/51/05/337925105.db2.gz SISFDHSXRZCUGX-OAHLLOKOSA-N 0 0 320.502 5.149 20 0 DKADRN Cc1cccc(NC(=O)N(C)[C@H](C)c2cccc(Cl)c2)c1F ZINC000537222504 337924812 /nfs/dbraw/zinc/92/48/12/337924812.db2.gz ANUJGQMKGANJMS-GFCCVEGCSA-N 0 0 320.795 5.012 20 0 DKADRN CCCN(C(=O)Nc1ccc(-c2ccccc2)cc1C)C1CC1 ZINC000537234112 337926729 /nfs/dbraw/zinc/92/67/29/337926729.db2.gz ADFQTILAFCXABC-UHFFFAOYSA-N 0 0 308.425 5.068 20 0 DKADRN CCC[C@H](C(=O)Nc1cc(SC)ccc1C)c1ccccc1 ZINC000537235602 337926840 /nfs/dbraw/zinc/92/68/40/337926840.db2.gz IOCKYTLJSAUBSK-KRWDZBQOSA-N 0 0 313.466 5.239 20 0 DKADRN CCC[C@@H](C(=O)Nc1cc(SC)ccc1C)c1ccccc1 ZINC000537235618 337926846 /nfs/dbraw/zinc/92/68/46/337926846.db2.gz IOCKYTLJSAUBSK-QGZVFWFLSA-N 0 0 313.466 5.239 20 0 DKADRN CSc1ccc(C)c(NC(=O)Nc2cccc(Cl)c2C)c1 ZINC000537244105 337927238 /nfs/dbraw/zinc/92/72/38/337927238.db2.gz MPOSSBLEJYRCFU-UHFFFAOYSA-N 0 0 320.845 5.323 20 0 DKADRN CSc1ccc(C)c(NC(=O)CC[C@H](C)c2ccccc2)c1 ZINC000537255477 337927691 /nfs/dbraw/zinc/92/76/91/337927691.db2.gz VRKPUXPIFPTERW-AWEZNQCLSA-N 0 0 313.466 5.239 20 0 DKADRN CSc1ccc(C)c(NC(=O)N(CC(C)C)C2CCCC2)c1 ZINC000537256428 337926072 /nfs/dbraw/zinc/92/60/72/337926072.db2.gz BDIYJWUZDSZSCH-UHFFFAOYSA-N 0 0 320.502 5.149 20 0 DKADRN O=C(Nc1cccc(Oc2ccccc2)c1)c1ccoc1C1CC1 ZINC000537300877 337929658 /nfs/dbraw/zinc/92/96/58/337929658.db2.gz OWTVCWDGIDCYNW-UHFFFAOYSA-N 0 0 319.360 5.202 20 0 DKADRN CCc1cccc(CC)c1NC(=O)c1cccc(C2CCC2)c1 ZINC000537301529 337929686 /nfs/dbraw/zinc/92/96/86/337929686.db2.gz JRZXCRVDUUQGFV-UHFFFAOYSA-N 0 0 307.437 5.331 20 0 DKADRN CCc1ccc([C@H](C)N[C@H]2CCCOc3c(Cl)cccc32)o1 ZINC000537305402 337929995 /nfs/dbraw/zinc/92/99/95/337929995.db2.gz RPHMMLSGCYRUFD-LRDDRELGSA-N 0 0 319.832 5.060 20 0 DKADRN CCc1ccc([C@@H](C)N[C@@H]2CCCOc3c(Cl)cccc32)o1 ZINC000537305403 337930009 /nfs/dbraw/zinc/93/00/09/337930009.db2.gz RPHMMLSGCYRUFD-MLGOLLRUSA-N 0 0 319.832 5.060 20 0 DKADRN CCc1ccc([C@@H](C)N[C@H]2CCCOc3c(Cl)cccc32)o1 ZINC000537305404 337930000 /nfs/dbraw/zinc/93/00/00/337930000.db2.gz RPHMMLSGCYRUFD-WBMJQRKESA-N 0 0 319.832 5.060 20 0 DKADRN O=C(Nc1ccccc1-c1cccs1)c1ccoc1C1CC1 ZINC000537305876 337930083 /nfs/dbraw/zinc/93/00/83/337930083.db2.gz AONYWYMINFFSSC-UHFFFAOYSA-N 0 0 309.390 5.138 20 0 DKADRN C[C@H]1C[C@@H]1c1ccc(CNc2ccc3nc(C4CC4)oc3c2)o1 ZINC000537321451 337931000 /nfs/dbraw/zinc/93/10/00/337931000.db2.gz QKSJNYNOELPFSP-NHYWBVRUSA-N 0 0 308.381 5.034 20 0 DKADRN C[C@H]1C[C@H]1c1ccc(CNc2ccc3nc(C4CC4)oc3c2)o1 ZINC000537321457 337930896 /nfs/dbraw/zinc/93/08/96/337930896.db2.gz QKSJNYNOELPFSP-XHDPSFHLSA-N 0 0 308.381 5.034 20 0 DKADRN C[C@H](N[C@@H]1C[C@@H]2CCC(C)(C)c3cccc1c32)c1nccs1 ZINC000537360279 337932546 /nfs/dbraw/zinc/93/25/46/337932546.db2.gz OADMSXSJSHXXJA-HEHGZKQESA-N 0 0 312.482 5.094 20 0 DKADRN C[C@H](N[C@H]1C[C@H]2CCC(C)(C)c3cccc1c32)c1nccs1 ZINC000537360282 337932539 /nfs/dbraw/zinc/93/25/39/337932539.db2.gz OADMSXSJSHXXJA-ZENOOKHLSA-N 0 0 312.482 5.094 20 0 DKADRN Cc1ccc([C@@H](C)Nc2cccc(OCc3cccnc3)c2)cc1 ZINC000537394962 337934866 /nfs/dbraw/zinc/93/48/66/337934866.db2.gz SALNLSNRIFNMDH-QGZVFWFLSA-N 0 0 318.420 5.142 20 0 DKADRN CC(C)CC(=O)Nc1ccc(N[C@H]2c3ccccc3C[C@H]2C)cc1 ZINC000537395664 337935029 /nfs/dbraw/zinc/93/50/29/337935029.db2.gz YECSFSFHJCPVMX-QVKFZJNVSA-N 0 0 322.452 5.017 20 0 DKADRN CC(C)CC(=O)Nc1ccc(N[C@@H]2c3ccccc3C[C@H]2C)cc1 ZINC000537395665 337935117 /nfs/dbraw/zinc/93/51/17/337935117.db2.gz YECSFSFHJCPVMX-VFNWGFHPSA-N 0 0 322.452 5.017 20 0 DKADRN CC(C)CC(=O)Nc1ccc(N[C@H]2c3ccccc3C[C@@H]2C)cc1 ZINC000537395666 337935030 /nfs/dbraw/zinc/93/50/30/337935030.db2.gz YECSFSFHJCPVMX-YCRPNKLZSA-N 0 0 322.452 5.017 20 0 DKADRN CC(C)C(=O)Nc1cccc(N[C@@H]2CC(C)(C)c3ccccc32)c1 ZINC000537395952 337935112 /nfs/dbraw/zinc/93/51/12/337935112.db2.gz NTAKNFPSQMEUTE-LJQANCHMSA-N 0 0 322.452 5.116 20 0 DKADRN COc1cc([C@H](C)Nc2ccc(SC)cc2)ccc1SC ZINC000537397202 337935135 /nfs/dbraw/zinc/93/51/35/337935135.db2.gz SODFNDCJLLEGJI-LBPRGKRZSA-N 0 0 319.495 5.312 20 0 DKADRN CCOc1cccc(N[C@@H](C)c2cccc(-c3ccncc3)c2)c1 ZINC000537398123 337935270 /nfs/dbraw/zinc/93/52/70/337935270.db2.gz HFFVHSMOFFZMAY-INIZCTEOSA-N 0 0 318.420 5.320 20 0 DKADRN CCOc1cccc(N[C@H](C)c2cccc(-c3ccncc3)c2)c1 ZINC000537398124 337935267 /nfs/dbraw/zinc/93/52/67/337935267.db2.gz HFFVHSMOFFZMAY-MRXNPFEDSA-N 0 0 318.420 5.320 20 0 DKADRN CC(=O)Nc1cccc(N[C@@H](C)c2ccccc2C(C)(C)C)c1 ZINC000537405931 337933458 /nfs/dbraw/zinc/93/34/58/337933458.db2.gz CCUXPWFZVDHRHK-AWEZNQCLSA-N 0 0 310.441 5.116 20 0 DKADRN CC(=O)Nc1cccc(N[C@H](C)c2ccccc2C(C)(C)C)c1 ZINC000537405935 337933462 /nfs/dbraw/zinc/93/34/62/337933462.db2.gz CCUXPWFZVDHRHK-CQSZACIVSA-N 0 0 310.441 5.116 20 0 DKADRN CC(C)C(=O)Nc1ccc(N[C@H]2CC(C)(C)c3ccccc32)cc1 ZINC000537406138 337933519 /nfs/dbraw/zinc/93/35/19/337933519.db2.gz DSUNTAYTZJZPFG-IBGZPJMESA-N 0 0 322.452 5.116 20 0 DKADRN CC(C)C(=O)Nc1ccc(N[C@@H]2CC(C)(C)c3ccccc32)cc1 ZINC000537406141 337933499 /nfs/dbraw/zinc/93/34/99/337933499.db2.gz DSUNTAYTZJZPFG-LJQANCHMSA-N 0 0 322.452 5.116 20 0 DKADRN COc1ccc([C@H](C)Nc2cccc(SC)c2)cc1Cl ZINC000537406154 337933459 /nfs/dbraw/zinc/93/34/59/337933459.db2.gz DIHBCBDZIITTCH-NSHDSACASA-N 0 0 307.846 5.244 20 0 DKADRN COc1c(C)ccc(N[C@@H](C)c2ccc3ccccc3n2)c1C ZINC000537406278 337933558 /nfs/dbraw/zinc/93/35/58/337933558.db2.gz FLWHGPFLQDJNCD-HNNXBMFYSA-N 0 0 306.409 5.033 20 0 DKADRN COc1c(C)ccc(N[C@H](C)c2ccc3ccccc3n2)c1C ZINC000537406285 337933475 /nfs/dbraw/zinc/93/34/75/337933475.db2.gz FLWHGPFLQDJNCD-OAHLLOKOSA-N 0 0 306.409 5.033 20 0 DKADRN Cc1ccc([C@@H](C)Nc2cc(NC(=O)C(C)C)ccc2C)cc1 ZINC000537407053 337933703 /nfs/dbraw/zinc/93/37/03/337933703.db2.gz PAXAOUBITUXOOZ-MRXNPFEDSA-N 0 0 310.441 5.071 20 0 DKADRN CC(=O)Nc1cccc(N[C@@H](c2ccc(Cl)cc2)C(C)C)c1 ZINC000537407669 337933757 /nfs/dbraw/zinc/93/37/57/337933757.db2.gz VIYMXJHGWQKTHH-GOSISDBHSA-N 0 0 316.832 5.108 20 0 DKADRN CC(=O)Nc1cccc(N[C@H](c2ccc(Cl)cc2)C(C)C)c1 ZINC000537407670 337933751 /nfs/dbraw/zinc/93/37/51/337933751.db2.gz VIYMXJHGWQKTHH-SFHVURJKSA-N 0 0 316.832 5.108 20 0 DKADRN Cc1ccc([C@H](C)Nc2cc(NC(=O)C3CC3)ccc2C)cc1C ZINC000537407796 337933750 /nfs/dbraw/zinc/93/37/50/337933750.db2.gz ZKKJTSJJZMHKBG-INIZCTEOSA-N 0 0 322.452 5.133 20 0 DKADRN Cc1ccc([C@@H](C)Nc2cc(NC(=O)C3CC3)ccc2C)cc1C ZINC000537407799 337933714 /nfs/dbraw/zinc/93/37/14/337933714.db2.gz ZKKJTSJJZMHKBG-MRXNPFEDSA-N 0 0 322.452 5.133 20 0 DKADRN CCCC(=O)Nc1cccc(N[C@@H](C)CCC=C(C)C)c1C ZINC000537425198 337935779 /nfs/dbraw/zinc/93/57/79/337935779.db2.gz LKCRKDJYBHEBPA-HNNXBMFYSA-N 0 0 302.462 5.280 20 0 DKADRN CCCC(=O)Nc1cccc(N[C@H](C)CCC=C(C)C)c1C ZINC000537425199 337935826 /nfs/dbraw/zinc/93/58/26/337935826.db2.gz LKCRKDJYBHEBPA-OAHLLOKOSA-N 0 0 302.462 5.280 20 0 DKADRN CC(C)OCc1ccc(N[C@@H](C)c2cc3ccccc3o2)cc1 ZINC000537425334 337935871 /nfs/dbraw/zinc/93/58/71/337935871.db2.gz NRMSQHWTPMJSFB-HNNXBMFYSA-N 0 0 309.409 5.531 20 0 DKADRN CC(C)OCc1ccc(N[C@H](C)c2cc3ccccc3o2)cc1 ZINC000537425339 337935891 /nfs/dbraw/zinc/93/58/91/337935891.db2.gz NRMSQHWTPMJSFB-OAHLLOKOSA-N 0 0 309.409 5.531 20 0 DKADRN COc1ccc(C)cc1[C@@H](C)Nc1ccc(COC(C)C)cc1 ZINC000537425377 337935837 /nfs/dbraw/zinc/93/58/37/337935837.db2.gz NGQIZRDYIOZUPV-MRXNPFEDSA-N 0 0 313.441 5.102 20 0 DKADRN Clc1cnc(CSc2cccc3cccnc32)c(Cl)c1 ZINC000537425536 337935803 /nfs/dbraw/zinc/93/58/03/337935803.db2.gz PHVHVHJLDQZMRH-UHFFFAOYSA-N 0 0 321.232 5.229 20 0 DKADRN CC(C)OCc1ccc(N[C@H](C)c2cc(F)cc(F)c2)cc1 ZINC000537425870 337935877 /nfs/dbraw/zinc/93/58/77/337935877.db2.gz UAJVXIZSVSQOFC-CYBMUJFWSA-N 0 0 305.368 5.063 20 0 DKADRN CC(C)OCc1ccc(N[C@@H](C)c2cc(F)cc(F)c2)cc1 ZINC000537425872 337935865 /nfs/dbraw/zinc/93/58/65/337935865.db2.gz UAJVXIZSVSQOFC-ZDUSSCGKSA-N 0 0 305.368 5.063 20 0 DKADRN CCC(C)(C)OCc1cccc(N[C@H](C)c2cscn2)c1C ZINC000537427836 337935921 /nfs/dbraw/zinc/93/59/21/337935921.db2.gz MZGPQTLAJUWMCH-CQSZACIVSA-N 0 0 318.486 5.330 20 0 DKADRN CCOc1ccc(Cl)cc1[C@H](C)Nc1cccc(COC)c1 ZINC000537432842 337936172 /nfs/dbraw/zinc/93/61/72/337936172.db2.gz BBSFHFNMSHSNLC-ZDUSSCGKSA-N 0 0 319.832 5.058 20 0 DKADRN Cc1ccc([C@H](C)Nc2cccc(COCc3ccco3)c2)o1 ZINC000537433586 337936135 /nfs/dbraw/zinc/93/61/35/337936135.db2.gz HMWWRXZWPXHXGZ-HNNXBMFYSA-N 0 0 311.381 5.071 20 0 DKADRN C[C@@H](Nc1ccc(F)c(F)c1)c1nc(-c2ccccc2)cs1 ZINC000537443472 337936231 /nfs/dbraw/zinc/93/62/31/337936231.db2.gz BBENICRKFFZWCH-LLVKDONJSA-N 0 0 316.376 5.261 20 0 DKADRN C[C@H](Nc1ccc(F)c(F)c1)c1nc(-c2ccccc2)cs1 ZINC000537443477 337936270 /nfs/dbraw/zinc/93/62/70/337936270.db2.gz BBENICRKFFZWCH-NSHDSACASA-N 0 0 316.376 5.261 20 0 DKADRN COc1ccc(F)c(N[C@H](C)c2ccc(-c3ccncc3)cc2)c1 ZINC000537444417 337936438 /nfs/dbraw/zinc/93/64/38/337936438.db2.gz HDTUHGYDYVJLOR-CQSZACIVSA-N 0 0 322.383 5.069 20 0 DKADRN CC(C)(C)n1cc(N[C@@H](c2cccs2)C2CCCC2)cn1 ZINC000537444642 337936441 /nfs/dbraw/zinc/93/64/41/337936441.db2.gz HFVRVRAVRLWVAI-MRXNPFEDSA-N 0 0 303.475 5.043 20 0 DKADRN CCCC[C@H](CC)Nc1cccc2c1CN(c1nccs1)C2 ZINC000537445531 337936505 /nfs/dbraw/zinc/93/65/05/337936505.db2.gz RIOQSBAFDRBONI-HNNXBMFYSA-N 0 0 315.486 5.044 20 0 DKADRN C[C@H](Nc1ccc(F)c(F)c1)c1cccc(-c2ccncc2)c1 ZINC000537447540 337936484 /nfs/dbraw/zinc/93/64/84/337936484.db2.gz YUQISLHEYULMJC-ZDUSSCGKSA-N 0 0 310.347 5.200 20 0 DKADRN CCOCc1ccc(N[C@@H](C)c2ccc(Cl)c(F)c2)cc1 ZINC000537448784 337936629 /nfs/dbraw/zinc/93/66/29/337936629.db2.gz CHFQJUVEXGHHIP-LBPRGKRZSA-N 0 0 307.796 5.189 20 0 DKADRN Cc1nc(-c2cccc(N[C@H](C)c3cccc(C)c3)c2)oc1C ZINC000537449270 337936750 /nfs/dbraw/zinc/93/67/50/337936750.db2.gz JZSSRFADYLKHEO-OAHLLOKOSA-N 0 0 306.409 5.440 20 0 DKADRN CCOCc1ccc(N[C@H](C)c2cccc(C(F)(F)F)c2)cc1 ZINC000537449597 337936712 /nfs/dbraw/zinc/93/67/12/337936712.db2.gz JRSNESVXYWXMQI-CYBMUJFWSA-N 0 0 323.358 5.415 20 0 DKADRN C[C@H](Nc1ccc(CC(F)(F)F)cc1)c1cc(F)cc(F)c1 ZINC000537449697 337936747 /nfs/dbraw/zinc/93/67/47/337936747.db2.gz MNLUTEGXULMCOW-JTQLQIEISA-N 0 0 315.285 5.243 20 0 DKADRN CCOCc1cccc(N[C@H](C)c2ccc(OC)c(Cl)c2)c1 ZINC000537449754 337936719 /nfs/dbraw/zinc/93/67/19/337936719.db2.gz KKYOEBYSQPOZJQ-CYBMUJFWSA-N 0 0 319.832 5.058 20 0 DKADRN C[C@@H](Nc1ccc(CC(F)(F)F)cc1)c1ccccc1N(C)C ZINC000537450120 337936923 /nfs/dbraw/zinc/93/69/23/337936923.db2.gz PWJXHCHYSACJKI-CYBMUJFWSA-N 0 0 322.374 5.031 20 0 DKADRN Cc1c(COc2ccccc2)cccc1N[C@H](C)c1cscn1 ZINC000537450881 337936908 /nfs/dbraw/zinc/93/69/08/337936908.db2.gz UPJRGKNIHNCSBZ-OAHLLOKOSA-N 0 0 324.449 5.204 20 0 DKADRN CCOCc1cccc(N[C@H](CC)c2cc(F)ccc2F)c1 ZINC000537451032 337936913 /nfs/dbraw/zinc/93/69/13/337936913.db2.gz COEGFKYGYQYVTO-GOSISDBHSA-N 0 0 305.368 5.065 20 0 DKADRN CCOCc1cccc(N[C@@H](CC)c2cc(F)ccc2F)c1 ZINC000537451034 337936881 /nfs/dbraw/zinc/93/68/81/337936881.db2.gz COEGFKYGYQYVTO-SFHVURJKSA-N 0 0 305.368 5.065 20 0 DKADRN CCOCc1ccc(N[C@H](CC)c2cc(F)ccc2F)cc1 ZINC000537451775 337936971 /nfs/dbraw/zinc/93/69/71/337936971.db2.gz JRKSTGOJHVGDGP-GOSISDBHSA-N 0 0 305.368 5.065 20 0 DKADRN Cc1c(COc2ccccc2)cccc1N[C@H](C)c1ccncc1 ZINC000537451836 337936961 /nfs/dbraw/zinc/93/69/61/337936961.db2.gz ZQGRFXHSKVJOCQ-QGZVFWFLSA-N 0 0 318.420 5.142 20 0 DKADRN CCOc1ccccc1N[C@H](C)c1nc(-c2ccccc2)cs1 ZINC000537452279 337937121 /nfs/dbraw/zinc/93/71/21/337937121.db2.gz RJUVGQUZNVNRRM-CQSZACIVSA-N 0 0 324.449 5.382 20 0 DKADRN CCOCc1ccc(N[C@H](C)c2cc(Cl)ccc2OC)cc1 ZINC000537452409 337937152 /nfs/dbraw/zinc/93/71/52/337937152.db2.gz UAFOQJKGLWFQRG-CYBMUJFWSA-N 0 0 319.832 5.058 20 0 DKADRN CCOCc1ccc(N[C@@H](C)c2cc(Cl)ccc2OC)cc1 ZINC000537452410 337937082 /nfs/dbraw/zinc/93/70/82/337937082.db2.gz UAFOQJKGLWFQRG-ZDUSSCGKSA-N 0 0 319.832 5.058 20 0 DKADRN CCOc1ccccc1N[C@H](C)c1sc(C(C)C)nc1C ZINC000537452458 337937200 /nfs/dbraw/zinc/93/72/00/337937200.db2.gz RWJXKBGLZISQIF-GFCCVEGCSA-N 0 0 304.459 5.147 20 0 DKADRN CCOc1ccccc1N[C@@H](C)c1sc(C(C)C)nc1C ZINC000537452459 337937158 /nfs/dbraw/zinc/93/71/58/337937158.db2.gz RWJXKBGLZISQIF-LBPRGKRZSA-N 0 0 304.459 5.147 20 0 DKADRN CCOCc1cccc(N[C@H]2CC3(CCC3)Oc3ccccc32)c1 ZINC000537452468 337937143 /nfs/dbraw/zinc/93/71/43/337937143.db2.gz SRKAKTZGLBUSHF-IBGZPJMESA-N 0 0 323.436 5.082 20 0 DKADRN CCOCc1cccc(N[C@@H]2CC3(CCC3)Oc3ccccc32)c1 ZINC000537452475 337937150 /nfs/dbraw/zinc/93/71/50/337937150.db2.gz SRKAKTZGLBUSHF-LJQANCHMSA-N 0 0 323.436 5.082 20 0 DKADRN Cc1ccncc1[C@H](C)Nc1ccc(SC2CCCC2)cc1 ZINC000537455104 337937234 /nfs/dbraw/zinc/93/72/34/337937234.db2.gz ADRQHQWCZZAKKJ-HNNXBMFYSA-N 0 0 312.482 5.598 20 0 DKADRN Cc1ccncc1[C@@H](C)Nc1ccc(SC2CCCC2)cc1 ZINC000537455105 337937282 /nfs/dbraw/zinc/93/72/82/337937282.db2.gz ADRQHQWCZZAKKJ-OAHLLOKOSA-N 0 0 312.482 5.598 20 0 DKADRN CCc1nc(C)c([C@@H](C)Nc2cc(SC)ccc2C)s1 ZINC000537476472 337938848 /nfs/dbraw/zinc/93/88/48/337938848.db2.gz AUELXHPTWJIPKD-LLVKDONJSA-N 0 0 306.500 5.217 20 0 DKADRN CSc1cccc(N[C@H](C)c2nc3c(s2)CCCC3)c1C ZINC000537476615 337938838 /nfs/dbraw/zinc/93/88/38/337938838.db2.gz DEMJUKIFKFASBB-GFCCVEGCSA-N 0 0 318.511 5.225 20 0 DKADRN CCc1nc(C)c([C@H](C)Nc2cccc(SC)c2C)s1 ZINC000537478855 337939059 /nfs/dbraw/zinc/93/90/59/337939059.db2.gz YAOHBCPDUDBGTP-NSHDSACASA-N 0 0 306.500 5.217 20 0 DKADRN CSc1cccc(N[C@H](C)c2cnc3ccsc3c2)c1C ZINC000537479736 337937490 /nfs/dbraw/zinc/93/74/90/337937490.db2.gz KUJIAIWATOHKJP-GFCCVEGCSA-N 0 0 314.479 5.500 20 0 DKADRN CC[C@@H](C)n1ncc(N[C@H](C)c2sccc2C)c1C1CC1 ZINC000537479754 337937441 /nfs/dbraw/zinc/93/74/41/337937441.db2.gz LJNHGMYVFFQQIB-CHWSQXEVSA-N 0 0 303.475 5.275 20 0 DKADRN CC[C@@H](C)n1ncc(N[C@@H](C)c2sccc2C)c1C1CC1 ZINC000537479755 337937493 /nfs/dbraw/zinc/93/74/93/337937493.db2.gz LJNHGMYVFFQQIB-OLZOCXBDSA-N 0 0 303.475 5.275 20 0 DKADRN CC[C@H](C)n1ncc(N[C@@H](C)c2sccc2C)c1C1CC1 ZINC000537479757 337937443 /nfs/dbraw/zinc/93/74/43/337937443.db2.gz LJNHGMYVFFQQIB-STQMWFEESA-N 0 0 303.475 5.275 20 0 DKADRN CC[C@@H](Nc1cnn([C@@H](C)CC)c1C1CC1)c1cccs1 ZINC000537480404 337937565 /nfs/dbraw/zinc/93/75/65/337937565.db2.gz ALYPEDUCQGPMCR-GXTWGEPZSA-N 0 0 303.475 5.356 20 0 DKADRN CC[C@H](C)n1ncc(N[C@@H](CC)c2cccs2)c1C1CC1 ZINC000537480417 337937591 /nfs/dbraw/zinc/93/75/91/337937591.db2.gz ALYPEDUCQGPMCR-JSGCOSHPSA-N 0 0 303.475 5.356 20 0 DKADRN CC[C@@H](C)n1ncc(N[C@H](CC)c2cccs2)c1C1CC1 ZINC000537480420 337937572 /nfs/dbraw/zinc/93/75/72/337937572.db2.gz ALYPEDUCQGPMCR-TZMCWYRMSA-N 0 0 303.475 5.356 20 0 DKADRN CSc1ccc(N[C@H](C)c2sc(C(C)(C)C)nc2C)nc1 ZINC000537485618 337937745 /nfs/dbraw/zinc/93/77/45/337937745.db2.gz FLTRVFNUCJWSDX-SNVBAGLBSA-N 0 0 321.515 5.039 20 0 DKADRN Cc1cc2cccnc2c(N[C@@H](C)c2ccc3ccccc3n2)c1 ZINC000537487094 337937876 /nfs/dbraw/zinc/93/78/76/337937876.db2.gz HZIORKMXUXJSGN-HNNXBMFYSA-N 0 0 313.404 5.265 20 0 DKADRN COc1ccc(F)cc1N[C@H](C)c1sc(C(C)(C)C)nc1C ZINC000537487919 337937870 /nfs/dbraw/zinc/93/78/70/337937870.db2.gz WJIXIHFTDFWMII-SNVBAGLBSA-N 0 0 322.449 5.070 20 0 DKADRN Cc1ccncc1[C@H](C)NC1(c2c(Cl)cccc2Cl)CC1 ZINC000537489892 337937996 /nfs/dbraw/zinc/93/79/96/337937996.db2.gz XCXMDUQZUDXNCA-LBPRGKRZSA-N 0 0 321.251 5.037 20 0 DKADRN CC(C)c1ccc(NC(=O)c2ccoc2C2CC2)c(C(C)C)c1 ZINC000537491096 337938127 /nfs/dbraw/zinc/93/81/27/337938127.db2.gz XKUVAYROLZWRGQ-UHFFFAOYSA-N 0 0 311.425 5.656 20 0 DKADRN C[C@@H](Nc1ccc(CCC(F)(F)F)cc1)c1ccc(F)cc1 ZINC000537514513 337939310 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ZINC000537751408 337960623 /nfs/dbraw/zinc/96/06/23/337960623.db2.gz FVRDERCLMKNWGR-GJZGRUSLSA-N 0 0 300.471 5.454 20 0 DKADRN CC[C@@H](C)Sc1ccc(N[C@H](C)c2ccccn2)c(C)c1 ZINC000537751412 337960666 /nfs/dbraw/zinc/96/06/66/337960666.db2.gz FVRDERCLMKNWGR-HUUCEWRRSA-N 0 0 300.471 5.454 20 0 DKADRN CC[C@H](C)Sc1ccc(N[C@H](C)c2ccccn2)c(C)c1 ZINC000537751415 337960669 /nfs/dbraw/zinc/96/06/69/337960669.db2.gz FVRDERCLMKNWGR-LSDHHAIUSA-N 0 0 300.471 5.454 20 0 DKADRN Cc1cnc([C@H](C)S[C@H](C)CCSc2ccccc2)o1 ZINC000537752554 337960625 /nfs/dbraw/zinc/96/06/25/337960625.db2.gz IHXXQQWEINVGTJ-KGLIPLIRSA-N 0 0 307.484 5.348 20 0 DKADRN Cc1cnc([C@@H](C)S[C@@H](C)CCSc2ccccc2)o1 ZINC000537752555 337960685 /nfs/dbraw/zinc/96/06/85/337960685.db2.gz IHXXQQWEINVGTJ-UONOGXRCSA-N 0 0 307.484 5.348 20 0 DKADRN Cc1cnc([C@@H](C)SCc2ccc(Cl)c(Cl)c2)o1 ZINC000537754414 337960610 /nfs/dbraw/zinc/96/06/10/337960610.db2.gz WZPRXHDRDMDELB-SECBINFHSA-N 0 0 302.226 5.284 20 0 DKADRN Cc1cnc([C@H](C)SCc2ccc(Cl)c(Cl)c2)o1 ZINC000537754416 337960800 /nfs/dbraw/zinc/96/08/00/337960800.db2.gz WZPRXHDRDMDELB-VIFPVBQESA-N 0 0 302.226 5.284 20 0 DKADRN CCCOc1ccc(C(F)(F)F)cc1N[C@H](C)c1ccccn1 ZINC000537758360 337961446 /nfs/dbraw/zinc/96/14/46/337961446.db2.gz CDVAFQUOAOMWAL-GFCCVEGCSA-N 0 0 324.346 5.062 20 0 DKADRN CCC[C@H](NCc1cc(Cl)sc1Cl)c1ccccn1 ZINC000537766923 337961696 /nfs/dbraw/zinc/96/16/96/337961696.db2.gz FQIRZBHRLBXJAN-NSHDSACASA-N 0 0 315.269 5.081 20 0 DKADRN Cc1cccc(C(C)C)c1NC(=O)N1CC[C@H](C)C2(CCC2)C1 ZINC000537807110 337963327 /nfs/dbraw/zinc/96/33/27/337963327.db2.gz CGLUUZYQAFHPFV-INIZCTEOSA-N 0 0 314.473 5.162 20 0 DKADRN Cc1cccc(C(C)C)c1NC(=O)N1CC[C@@H](C)C2(CCC2)C1 ZINC000537807120 337963402 /nfs/dbraw/zinc/96/34/02/337963402.db2.gz CGLUUZYQAFHPFV-MRXNPFEDSA-N 0 0 314.473 5.162 20 0 DKADRN C[C@H]1CCN(C(=O)Nc2ccccc2C(C)(C)C)CC12CCC2 ZINC000537810616 337963558 /nfs/dbraw/zinc/96/35/58/337963558.db2.gz VKWYOPNEMUBOAU-HNNXBMFYSA-N 0 0 314.473 5.028 20 0 DKADRN CC[C@@H]1CC[C@@H](C)N1C(=O)CCCc1csc2ccccc12 ZINC000537890547 337965282 /nfs/dbraw/zinc/96/52/82/337965282.db2.gz HDITWTNLIODTFJ-GDBMZVCRSA-N 0 0 315.482 5.014 20 0 DKADRN CC[C@@H]1CC[C@H](C)N1C(=O)CCCc1csc2ccccc12 ZINC000537890548 337965276 /nfs/dbraw/zinc/96/52/76/337965276.db2.gz HDITWTNLIODTFJ-GOEBONIOSA-N 0 0 315.482 5.014 20 0 DKADRN CC[C@H]1CC[C@H](C)N1C(=O)CCCc1csc2ccccc12 ZINC000537890549 337965290 /nfs/dbraw/zinc/96/52/90/337965290.db2.gz HDITWTNLIODTFJ-HOCLYGCPSA-N 0 0 315.482 5.014 20 0 DKADRN CC[C@@H](N[C@H](C)c1cccc(F)c1F)c1cc(C)ccc1OC ZINC000537957958 331882783 /nfs/dbraw/zinc/88/27/83/331882783.db2.gz AVFUQEZSGAWEDT-CXAGYDPISA-N 0 0 319.395 5.084 20 0 DKADRN COC[C@@H](N[C@@H](C)c1cccc(Cl)c1Cl)c1ccccc1 ZINC000537962058 340793617 /nfs/dbraw/zinc/79/36/17/340793617.db2.gz JGNRTRLSGFGWSG-BLLLJJGKSA-N 0 0 324.251 5.032 20 0 DKADRN COC[C@H](N[C@@H](C)c1cccc(Cl)c1Cl)c1ccccc1 ZINC000537962059 340793602 /nfs/dbraw/zinc/79/36/02/340793602.db2.gz JGNRTRLSGFGWSG-LRDDRELGSA-N 0 0 324.251 5.032 20 0 DKADRN COC[C@@H](N[C@H](C)c1cccc(Cl)c1Cl)c1ccccc1 ZINC000537962060 340793614 /nfs/dbraw/zinc/79/36/14/340793614.db2.gz JGNRTRLSGFGWSG-MLGOLLRUSA-N 0 0 324.251 5.032 20 0 DKADRN COC[C@H](N[C@H](C)c1cccc(Cl)c1Cl)c1ccccc1 ZINC000537962061 340793677 /nfs/dbraw/zinc/79/36/77/340793677.db2.gz JGNRTRLSGFGWSG-WBMJQRKESA-N 0 0 324.251 5.032 20 0 DKADRN C[C@@H](N[C@H](c1ccccc1)c1cccc(Cl)c1)c1ccoc1 ZINC000537967017 337882958 /nfs/dbraw/zinc/88/29/58/337882958.db2.gz QJLMKTAZIZOROM-AUUYWEPGSA-N 0 0 311.812 5.373 20 0 DKADRN Cc1c2cc(F)ccc2oc1CN[C@H](C)c1ccc(F)cc1F ZINC000537971557 340794533 /nfs/dbraw/zinc/79/45/33/340794533.db2.gz WFHIPELOXPEHCK-LLVKDONJSA-N 0 0 319.326 5.009 20 0 DKADRN Cc1c2cc(F)ccc2oc1CN[C@@H](C)c1ccc(F)cc1F ZINC000537971558 340794496 /nfs/dbraw/zinc/79/44/96/340794496.db2.gz WFHIPELOXPEHCK-NSHDSACASA-N 0 0 319.326 5.009 20 0 DKADRN C[C@@H](N[C@H](c1cc2ccccc2o1)c1ccccc1)c1ccco1 ZINC000537972605 340794729 /nfs/dbraw/zinc/79/47/29/340794729.db2.gz RYDRSHPPXRRJIH-VFNWGFHPSA-N 0 0 317.388 5.466 20 0 DKADRN C[C@H](N[C@@H](c1cc2ccccc2o1)c1ccccc1)c1ccco1 ZINC000537972606 340794714 /nfs/dbraw/zinc/79/47/14/340794714.db2.gz RYDRSHPPXRRJIH-YCRPNKLZSA-N 0 0 317.388 5.466 20 0 DKADRN C[C@@H](N[C@H]1CCOc2c(-c3ccccc3)cccc21)c1ccco1 ZINC000537984755 333149229 /nfs/dbraw/zinc/14/92/29/333149229.db2.gz HUIRTBHPAVYYKU-BEFAXECRSA-N 0 0 319.404 5.121 20 0 DKADRN Cc1scc(C(=O)Nc2ccccc2Cc2ccccc2)c1C ZINC000538007675 340807039 /nfs/dbraw/zinc/80/70/39/340807039.db2.gz YUSUXAHMPOIJOF-UHFFFAOYSA-N 0 0 321.445 5.208 20 0 DKADRN CS[C@@H](C)CCC(=O)Nc1ccccc1SC1CCCC1 ZINC000538010906 340807302 /nfs/dbraw/zinc/80/73/02/340807302.db2.gz SGGJGSLHRDLMPW-ZDUSSCGKSA-N 0 0 323.527 5.192 20 0 DKADRN Clc1ccc(SCc2cnoc2C2CC2)cc1Cl ZINC000538011208 331538516 /nfs/dbraw/zinc/53/85/16/331538516.db2.gz HMVSXVFWXPQGKC-UHFFFAOYSA-N 0 0 300.210 5.151 20 0 DKADRN Cc1scc(C(=O)Nc2ccccc2SC(C)C)c1C ZINC000538016838 340807293 /nfs/dbraw/zinc/80/72/93/340807293.db2.gz VCVGWIKSAYFDOJ-UHFFFAOYSA-N 0 0 305.468 5.118 20 0 DKADRN CCCCc1nc(CN[C@H](CCC)c2ccccc2)cs1 ZINC000538141642 340811233 /nfs/dbraw/zinc/81/12/33/340811233.db2.gz SDDGPTJQAUBCET-QGZVFWFLSA-N 0 0 302.487 5.117 20 0 DKADRN CC[C@H](NCc1csc(C2CCCC2)n1)c1ccc(C)cc1 ZINC000538153938 340811607 /nfs/dbraw/zinc/81/16/07/340811607.db2.gz AVSVQFNNNXOSMP-SFHVURJKSA-N 0 0 314.498 5.350 20 0 DKADRN CC[C@@H](N[C@@H](C)c1ncc(-c2ccccc2)o1)c1ccc(C)cc1 ZINC000538154157 340811614 /nfs/dbraw/zinc/81/16/14/340811614.db2.gz GAPPBNSQWDHESL-QFBILLFUSA-N 0 0 320.436 5.452 20 0 DKADRN CCc1cnc(CN[C@@H](CCC(C)C)c2ccc(Cl)cc2)o1 ZINC000538166887 340812048 /nfs/dbraw/zinc/81/20/48/340812048.db2.gz DOHURADHUYEODW-KRWDZBQOSA-N 0 0 320.864 5.158 20 0 DKADRN CCC(CC)[C@H](NCc1ncc(C(C)(C)C)o1)c1ccccc1 ZINC000538175556 340812296 /nfs/dbraw/zinc/81/22/96/340812296.db2.gz NRWQPXXMKRQQNJ-IBGZPJMESA-N 0 0 314.473 5.239 20 0 DKADRN CCC(CC)[C@@H](NCc1ncc(C(C)(C)C)o1)c1ccccc1 ZINC000538175557 340812184 /nfs/dbraw/zinc/81/21/84/340812184.db2.gz NRWQPXXMKRQQNJ-LJQANCHMSA-N 0 0 314.473 5.239 20 0 DKADRN Cc1ccc(-c2cnc(CN[C@@H](C)c3cccc(C)c3C)o2)cc1 ZINC000538187484 340812345 /nfs/dbraw/zinc/81/23/45/340812345.db2.gz IBCYNYIVIXZFKJ-KRWDZBQOSA-N 0 0 320.436 5.118 20 0 DKADRN Cc1oc(-c2ccccc2)nc1CN[C@@H](C)c1cccc(C)c1C ZINC000538188178 340812335 /nfs/dbraw/zinc/81/23/35/340812335.db2.gz MMPNAKWQQCHRSJ-INIZCTEOSA-N 0 0 320.436 5.118 20 0 DKADRN Cc1oc(-c2ccccc2)nc1CN[C@H](C)c1cccc(C)c1C ZINC000538188182 340812569 /nfs/dbraw/zinc/81/25/69/340812569.db2.gz MMPNAKWQQCHRSJ-MRXNPFEDSA-N 0 0 320.436 5.118 20 0 DKADRN Cc1nc(CN[C@H](CC(C)C)c2ccc(Cl)cc2)c(C)s1 ZINC000538198145 332220673 /nfs/dbraw/zinc/22/06/73/332220673.db2.gz HHMHLKWSECMZQA-MRXNPFEDSA-N 0 0 322.905 5.290 20 0 DKADRN CSc1cccc(NC(=O)Nc2ccccc2C(C)C)c1C ZINC000538204003 332225707 /nfs/dbraw/zinc/22/57/07/332225707.db2.gz XZYYLGAXVYMMGU-UHFFFAOYSA-N 0 0 314.454 5.484 20 0 DKADRN Cc1ccc(-c2cnc(CN[C@@H](C)c3cc(C)cc(C)c3)o2)cc1 ZINC000538208671 332239597 /nfs/dbraw/zinc/23/95/97/332239597.db2.gz VAEGSYYZCDJEMY-KRWDZBQOSA-N 0 0 320.436 5.118 20 0 DKADRN Cc1ccc(-c2cnc(CN[C@H](C)c3cc(C)cc(C)c3)o2)cc1 ZINC000538208672 332239507 /nfs/dbraw/zinc/23/95/07/332239507.db2.gz VAEGSYYZCDJEMY-QGZVFWFLSA-N 0 0 320.436 5.118 20 0 DKADRN CCCCc1nc(CN[C@@H](CC)c2ccc(F)cc2F)cs1 ZINC000538210268 340813459 /nfs/dbraw/zinc/81/34/59/340813459.db2.gz FGVHOHKBIFDFEK-INIZCTEOSA-N 0 0 324.440 5.005 20 0 DKADRN CC[C@H](C)[C@@H]1CCCCN1C(=O)Nc1cccc(SC)c1C ZINC000538211804 340813437 /nfs/dbraw/zinc/81/34/37/340813437.db2.gz XVBAVGZPSUQSOR-BBRMVZONSA-N 0 0 320.502 5.149 20 0 DKADRN CC[C@@H](C)[C@@H]1CCCCN1C(=O)Nc1cccc(SC)c1C ZINC000538211805 340813458 /nfs/dbraw/zinc/81/34/58/340813458.db2.gz XVBAVGZPSUQSOR-CJNGLKHVSA-N 0 0 320.502 5.149 20 0 DKADRN CC[C@@H](C)[C@H]1CCCCN1C(=O)Nc1cccc(SC)c1C ZINC000538211806 340813491 /nfs/dbraw/zinc/81/34/91/340813491.db2.gz XVBAVGZPSUQSOR-CZUORRHYSA-N 0 0 320.502 5.149 20 0 DKADRN CC[C@H](C)[C@H]1CCCCN1C(=O)Nc1cccc(SC)c1C ZINC000538211807 340813465 /nfs/dbraw/zinc/81/34/65/340813465.db2.gz XVBAVGZPSUQSOR-XJKSGUPXSA-N 0 0 320.502 5.149 20 0 DKADRN CSc1cccc(NC(=O)N2CCCC[C@H]2CC(C)C)c1C ZINC000538212169 340813486 /nfs/dbraw/zinc/81/34/86/340813486.db2.gz UMAJSXBUNIQVNY-HNNXBMFYSA-N 0 0 320.502 5.149 20 0 DKADRN CSc1cccc(NC(=O)N2CCCC[C@@H]2CC(C)C)c1C ZINC000538212170 340813428 /nfs/dbraw/zinc/81/34/28/340813428.db2.gz UMAJSXBUNIQVNY-OAHLLOKOSA-N 0 0 320.502 5.149 20 0 DKADRN CSc1cccc(NC(=O)N2CCC[C@@H](CC(C)C)C2)c1C ZINC000538212672 340813602 /nfs/dbraw/zinc/81/36/02/340813602.db2.gz SAXLSPSTWOKCQC-HNNXBMFYSA-N 0 0 320.502 5.007 20 0 DKADRN CCc1cnc(CN[C@H](CC(C)(C)C)c2ccc(Cl)cc2)o1 ZINC000538215459 340813745 /nfs/dbraw/zinc/81/37/45/340813745.db2.gz FFXKUEAWGDPQIT-MRXNPFEDSA-N 0 0 320.864 5.158 20 0 DKADRN CCCc1nc(CN[C@@H](c2cccc(F)c2)C(C)(C)C)cs1 ZINC000538225032 340814058 /nfs/dbraw/zinc/81/40/58/340814058.db2.gz QGCREAGJOAWKFB-KRWDZBQOSA-N 0 0 320.477 5.112 20 0 DKADRN CCSc1cccc(C(=O)Nc2cccc(SC)c2C)c1 ZINC000538245405 340814750 /nfs/dbraw/zinc/81/47/50/340814750.db2.gz CVGWRSGUOBJTSS-UHFFFAOYSA-N 0 0 317.479 5.081 20 0 DKADRN CSc1cccc(NC(=O)Cc2cccc3ccccc32)c1C ZINC000538247007 340814819 /nfs/dbraw/zinc/81/48/19/340814819.db2.gz VVPRUIPBAKYZHC-UHFFFAOYSA-N 0 0 321.445 5.051 20 0 DKADRN CC[C@H](CC(=O)Nc1c(F)cc(Cl)cc1F)c1ccccc1 ZINC000538250165 340814929 /nfs/dbraw/zinc/81/49/29/340814929.db2.gz ZYHFAGDUGRBCHF-LLVKDONJSA-N 0 0 323.770 5.141 20 0 DKADRN CC[C@@H](CC(=O)Nc1c(F)cc(Cl)cc1F)c1ccccc1 ZINC000538250166 340814910 /nfs/dbraw/zinc/81/49/10/340814910.db2.gz ZYHFAGDUGRBCHF-NSHDSACASA-N 0 0 323.770 5.141 20 0 DKADRN CCCCc1nc(CN[C@@H](CC)c2cc(F)ccc2F)cs1 ZINC000538256504 340815196 /nfs/dbraw/zinc/81/51/96/340815196.db2.gz PSPREYDIKCRUBF-INIZCTEOSA-N 0 0 324.440 5.005 20 0 DKADRN Cc1cscc1NC(=O)CCCc1ccc2ccccc2c1 ZINC000538281477 340816117 /nfs/dbraw/zinc/81/61/17/340816117.db2.gz HEAUDZROCWCMHM-UHFFFAOYSA-N 0 0 309.434 5.171 20 0 DKADRN CC[C@@H](C)[C@H]1CCCCN1C(=O)Nc1cc(SC)ccc1C ZINC000538321754 340818101 /nfs/dbraw/zinc/81/81/01/340818101.db2.gz AGSGEXZSDRGNAL-CXAGYDPISA-N 0 0 320.502 5.149 20 0 DKADRN CC[C@H](C)[C@@H]1CCCCN1C(=O)Nc1cc(SC)ccc1C ZINC000538321756 333408497 /nfs/dbraw/zinc/40/84/97/333408497.db2.gz AGSGEXZSDRGNAL-GUYCJALGSA-N 0 0 320.502 5.149 20 0 DKADRN CC[C@H](C)[C@H]1CCCCN1C(=O)Nc1cc(SC)ccc1C ZINC000538321757 333408528 /nfs/dbraw/zinc/40/85/28/333408528.db2.gz AGSGEXZSDRGNAL-SUMWQHHRSA-N 0 0 320.502 5.149 20 0 DKADRN CCCCC[C@@H]1CCCN1C(=O)Nc1cc(SC)ccc1C ZINC000538324741 340818264 /nfs/dbraw/zinc/81/82/64/340818264.db2.gz DIJXMYJAOYXNJR-OAHLLOKOSA-N 0 0 320.502 5.294 20 0 DKADRN CCCCN(CCCC)C(=O)Nc1cc(SC)ccc1C ZINC000538325234 340818284 /nfs/dbraw/zinc/81/82/84/340818284.db2.gz UDUBVXARXNWXDS-UHFFFAOYSA-N 0 0 308.491 5.151 20 0 DKADRN CSc1ccc(C)c(NC(=O)Nc2cc(Cl)ccc2C)c1 ZINC000538339895 340818841 /nfs/dbraw/zinc/81/88/41/340818841.db2.gz PEMOTJDLDUNKTN-UHFFFAOYSA-N 0 0 320.845 5.323 20 0 DKADRN CSc1ccc(C)c(NC(=O)c2oc3ccccc3c2C)c1 ZINC000538340173 340818833 /nfs/dbraw/zinc/81/88/33/340818833.db2.gz YFQNOJZTUMNMAH-UHFFFAOYSA-N 0 0 311.406 5.024 20 0 DKADRN CSc1ccc(C)c(NC(=O)c2cccc(-c3ccoc3)c2)c1 ZINC000538341212 340818835 /nfs/dbraw/zinc/81/88/35/340818835.db2.gz WFAPKKYGXWDMDH-UHFFFAOYSA-N 0 0 323.417 5.229 20 0 DKADRN CSc1ccc(C)c(NC(=O)c2ccc3ccccc3c2)c1 ZINC000538343253 340818780 /nfs/dbraw/zinc/81/87/80/340818780.db2.gz PMAHKLNTEHZNLM-UHFFFAOYSA-N 0 0 307.418 5.122 20 0 DKADRN CCCc1occc1C(=O)Nc1c(CC)ccc(Cl)c1CC ZINC000538403185 340821330 /nfs/dbraw/zinc/82/13/30/340821330.db2.gz MDKGVJUEVPNQDL-UHFFFAOYSA-N 0 0 319.832 5.263 20 0 DKADRN Cc1cccc(NCc2cnoc2-c2ccc(Cl)s2)c1F ZINC000538418950 340823131 /nfs/dbraw/zinc/82/31/31/340823131.db2.gz YTVJYVYFQFUENU-UHFFFAOYSA-N 0 0 322.792 5.116 20 0 DKADRN Cc1cccc(F)c1NC(=O)[C@@H]1C[C@@H]1c1cccc2ccccc21 ZINC000538439792 340823743 /nfs/dbraw/zinc/82/37/43/340823743.db2.gz CSNSDJGQAWLBIS-QZTJIDSGSA-N 0 0 319.379 5.030 20 0 DKADRN Cc1cccc(F)c1NC(=O)[C@@H]1C[C@H]1c1cccc2ccccc21 ZINC000538439794 340823756 /nfs/dbraw/zinc/82/37/56/340823756.db2.gz CSNSDJGQAWLBIS-ZWKOTPCHSA-N 0 0 319.379 5.030 20 0 DKADRN C[C@@H]1CC[C@H](C(=O)Nc2c(F)cc(F)cc2-c2ccccc2)C1 ZINC000538445169 340824070 /nfs/dbraw/zinc/82/40/70/340824070.db2.gz HPEKMTSOMXFLFB-OCCSQVGLSA-N 0 0 315.363 5.007 20 0 DKADRN C[C@@H]1CC[C@@H](C(=O)Nc2c(F)cc(F)cc2-c2ccccc2)C1 ZINC000538445170 340824177 /nfs/dbraw/zinc/82/41/77/340824177.db2.gz HPEKMTSOMXFLFB-TZMCWYRMSA-N 0 0 315.363 5.007 20 0 DKADRN C[C@@H](N[C@H](C)c1c(F)cccc1Cl)c1cccc(F)c1F ZINC000538463512 340824869 /nfs/dbraw/zinc/82/48/69/340824869.db2.gz WDIPOVJUDNTGCQ-NXEZZACHSA-N 0 0 313.750 5.169 20 0 DKADRN C[C@@H](N[C@@H](C)c1cccc(F)c1F)c1c(F)cccc1Cl ZINC000538463514 340824864 /nfs/dbraw/zinc/82/48/64/340824864.db2.gz WDIPOVJUDNTGCQ-VHSXEESVSA-N 0 0 313.750 5.169 20 0 DKADRN C[C@@H](N[C@@H](C)c1c(F)cccc1Cl)c1cccc(F)c1F ZINC000538463515 340824899 /nfs/dbraw/zinc/82/48/99/340824899.db2.gz WDIPOVJUDNTGCQ-ZJUUUORDSA-N 0 0 313.750 5.169 20 0 DKADRN CCOc1cccc(N[C@H](C)c2sc(C(C)C)nc2C)c1 ZINC000538496427 340828430 /nfs/dbraw/zinc/82/84/30/340828430.db2.gz IJKSEVSEHXIBQA-GFCCVEGCSA-N 0 0 304.459 5.147 20 0 DKADRN CCc1ccc([C@@H](Nc2ccc(C)c(NC(C)=O)c2)C(C)C)cc1 ZINC000538497104 340828416 /nfs/dbraw/zinc/82/84/16/340828416.db2.gz ZZLRCHXIIFKGRC-NRFANRHFSA-N 0 0 324.468 5.325 20 0 DKADRN COc1ccc([C@@H](C)Nc2ccc(SC)cc2)cc1Cl ZINC000538497350 340828581 /nfs/dbraw/zinc/82/85/81/340828581.db2.gz PDSOCUSSRBNQRL-LLVKDONJSA-N 0 0 307.846 5.244 20 0 DKADRN CSc1ccc(N[C@H]2CC3(CCC3)Oc3ccccc32)cc1 ZINC000538499646 340828623 /nfs/dbraw/zinc/82/86/23/340828623.db2.gz DKIYLVYMTWASMC-KRWDZBQOSA-N 0 0 311.450 5.267 20 0 DKADRN CSc1ccc(N[C@@H]2CC3(CCC3)Oc3ccccc32)cc1 ZINC000538499647 340828605 /nfs/dbraw/zinc/82/86/05/340828605.db2.gz DKIYLVYMTWASMC-QGZVFWFLSA-N 0 0 311.450 5.267 20 0 DKADRN CCOc1cccc(N[C@@H](C)c2nc(-c3ccccc3)cs2)c1 ZINC000538501308 340828837 /nfs/dbraw/zinc/82/88/37/340828837.db2.gz DCGVQLSWQYHESF-AWEZNQCLSA-N 0 0 324.449 5.382 20 0 DKADRN Cc1ccc(NC(=O)C(C)C)cc1N[C@@H]1CCCc2ccccc21 ZINC000538509000 340829772 /nfs/dbraw/zinc/82/97/72/340829772.db2.gz SSBDHTIHABLDQV-LJQANCHMSA-N 0 0 322.452 5.079 20 0 DKADRN Cc1ccc(NC(=O)C(C)C)cc1N[C@@H](C)c1ccccc1C ZINC000538509032 337582837 /nfs/dbraw/zinc/58/28/37/337582837.db2.gz UINYRFFDNRNJBZ-INIZCTEOSA-N 0 0 310.441 5.071 20 0 DKADRN C[C@@H](Nc1ccc(C(C)(C)C)cc1)c1ccc2c(c1)CCC(=O)N2 ZINC000538509337 340829737 /nfs/dbraw/zinc/82/97/37/340829737.db2.gz NRZZRINBJWLJMJ-CQSZACIVSA-N 0 0 322.452 5.042 20 0 DKADRN COc1cc([C@@H](C)Nc2cccc(SC)c2)ccc1SC ZINC000538509409 340829759 /nfs/dbraw/zinc/82/97/59/340829759.db2.gz RDDHJUXYFFZVKV-GFCCVEGCSA-N 0 0 319.495 5.312 20 0 DKADRN CSc1cccc(N[C@@H](C)c2cccc(-c3ccncc3)c2)c1 ZINC000538509451 340829767 /nfs/dbraw/zinc/82/97/67/340829767.db2.gz UQVZGRZRZMTCLI-HNNXBMFYSA-N 0 0 320.461 5.644 20 0 DKADRN COc1cccc(N[C@@H](C)c2sc(-c3ccccc3)nc2C)c1 ZINC000538509719 340829760 /nfs/dbraw/zinc/82/97/60/340829760.db2.gz NAHXFOKBQIQOFK-ZDUSSCGKSA-N 0 0 324.449 5.300 20 0 DKADRN CCc1ccc([C@@H](Nc2cccc(NC(C)=O)c2)C(C)C)cc1 ZINC000538509865 340829855 /nfs/dbraw/zinc/82/98/55/340829855.db2.gz XFXZNEURLCGZCI-FQEVSTJZSA-N 0 0 310.441 5.017 20 0 DKADRN C[C@H](Nc1ccccc1COCc1ccccc1)c1ccoc1 ZINC000538509934 340829917 /nfs/dbraw/zinc/82/99/17/340829917.db2.gz BVECAWXGIUNZDN-INIZCTEOSA-N 0 0 307.393 5.170 20 0 DKADRN C[C@@H](Nc1ccccc1COCc1ccccc1)c1ccoc1 ZINC000538509935 340829913 /nfs/dbraw/zinc/82/99/13/340829913.db2.gz BVECAWXGIUNZDN-MRXNPFEDSA-N 0 0 307.393 5.170 20 0 DKADRN CC(C)C(=O)Nc1ccc(N[C@H](CC2CC2)c2ccccc2)cc1 ZINC000538509943 340829929 /nfs/dbraw/zinc/82/99/29/340829929.db2.gz CTPLTSOWANDNAH-HXUWFJFHSA-N 0 0 322.452 5.234 20 0 DKADRN CSc1cccc(N[C@@H](C)c2sc(C(C)C)nc2C)c1 ZINC000538510846 340829939 /nfs/dbraw/zinc/82/99/39/340829939.db2.gz ODDJAAZLWCUGJD-NSHDSACASA-N 0 0 306.500 5.470 20 0 DKADRN C[C@H](Nc1ccccc1COCc1ccccc1)c1ccco1 ZINC000538510884 340829958 /nfs/dbraw/zinc/82/99/58/340829958.db2.gz QJQVOFVQRMHEPT-INIZCTEOSA-N 0 0 307.393 5.170 20 0 DKADRN Cc1ccc([C@H](C)Nc2cc(NC(=O)C3CC3)ccc2C)c(C)c1 ZINC000538510886 340829980 /nfs/dbraw/zinc/82/99/80/340829980.db2.gz QXPDIBQHTFICAF-INIZCTEOSA-N 0 0 322.452 5.133 20 0 DKADRN C[C@@H](NC1(c2ccccc2)CC1)c1cc(Cl)sc1Cl ZINC000538523715 340831074 /nfs/dbraw/zinc/83/10/74/340831074.db2.gz KEPVKMALKDIVOY-SNVBAGLBSA-N 0 0 312.265 5.395 20 0 DKADRN C[C@H](NC1(c2ccccc2)CC1)c1nc(-c2ccccc2)cs1 ZINC000538523937 340831136 /nfs/dbraw/zinc/83/11/36/340831136.db2.gz UEXGCTIJRRQGBB-HNNXBMFYSA-N 0 0 320.461 5.150 20 0 DKADRN FC(F)(F)CCCCSCc1ncc(Cl)cc1Cl ZINC000538524322 340831228 /nfs/dbraw/zinc/83/12/28/340831228.db2.gz NDYSKHQLAJTWGW-UHFFFAOYSA-N 0 0 318.191 5.354 20 0 DKADRN CC[C@@H](Nc1cccc(COCC2CC2)c1)c1cccs1 ZINC000538524580 340831230 /nfs/dbraw/zinc/83/12/30/340831230.db2.gz DBLLHIHNHQRNBV-QGZVFWFLSA-N 0 0 301.455 5.238 20 0 DKADRN Cc1cccnc1CSCc1cc(Cl)cc2cccnc21 ZINC000538524758 340831285 /nfs/dbraw/zinc/83/12/85/340831285.db2.gz TWTQKHCSDHCAGC-UHFFFAOYSA-N 0 0 314.841 5.025 20 0 DKADRN Cc1ccsc1[C@H](C)Nc1cccc(COCC2CC2)c1 ZINC000538524964 340831298 /nfs/dbraw/zinc/83/12/98/340831298.db2.gz JSMOIGHGLPLCOZ-AWEZNQCLSA-N 0 0 301.455 5.156 20 0 DKADRN CCc1nc2cc(N[C@H](C)c3ccc4ccccc4n3)ccc2o1 ZINC000538526858 340831517 /nfs/dbraw/zinc/83/15/17/340831517.db2.gz FESZWJSAUQVXBH-CYBMUJFWSA-N 0 0 317.392 5.112 20 0 DKADRN CC(C)OCc1ccc(N[C@H](c2ccc(F)cc2)C2CC2)cc1 ZINC000538527524 340831600 /nfs/dbraw/zinc/83/16/00/340831600.db2.gz NEQVLSYOGSNAFR-FQEVSTJZSA-N 0 0 313.416 5.314 20 0 DKADRN CCCC(=O)Nc1cccc(N[C@H](C)c2cc(C)cc(C)c2)c1C ZINC000538528516 340831791 /nfs/dbraw/zinc/83/17/91/340831791.db2.gz MCZVHDSCIRYTSR-QGZVFWFLSA-N 0 0 324.468 5.524 20 0 DKADRN CC(C)OCc1ccc(N[C@@H](C)c2cccc(F)c2F)cc1 ZINC000538528764 340831759 /nfs/dbraw/zinc/83/17/59/340831759.db2.gz ZUGCTWMISHEWSA-ZDUSSCGKSA-N 0 0 305.368 5.063 20 0 DKADRN Clc1cnc(CSc2ccnc3ccccc32)c(Cl)c1 ZINC000538530828 340831935 /nfs/dbraw/zinc/83/19/35/340831935.db2.gz GGQXYTTVWCPTTP-UHFFFAOYSA-N 0 0 321.232 5.229 20 0 DKADRN COCc1cccc(N[C@H](C)c2cc3cc(Cl)ccc3o2)c1 ZINC000538535847 340832047 /nfs/dbraw/zinc/83/20/47/340832047.db2.gz WOYFHBRAYJXSJN-GFCCVEGCSA-N 0 0 315.800 5.406 20 0 DKADRN COCc1cccc(N[C@@H](C)c2ccc(OC)c3ccccc32)c1 ZINC000538537036 340832080 /nfs/dbraw/zinc/83/20/80/340832080.db2.gz GXXHJUJTLDMVDG-HNNXBMFYSA-N 0 0 321.420 5.168 20 0 DKADRN CC[C@@H](Nc1cccc(COC)c1)c1cc(Cl)ccc1OC ZINC000538537641 340832070 /nfs/dbraw/zinc/83/20/70/340832070.db2.gz MTZASCGMRQXGAW-QGZVFWFLSA-N 0 0 319.832 5.058 20 0 DKADRN COc1ccc(F)c(N[C@H](C)c2cccc(-c3ccncc3)c2)c1 ZINC000538545131 340832353 /nfs/dbraw/zinc/83/23/53/340832353.db2.gz UDNDOVCVKFNCKC-CQSZACIVSA-N 0 0 322.383 5.069 20 0 DKADRN COc1cc([C@@H](C)Nc2cc(C)ccc2F)ccc1SC ZINC000538545729 340832277 /nfs/dbraw/zinc/83/22/77/340832277.db2.gz ZJXMBMXENRUXKJ-GFCCVEGCSA-N 0 0 305.418 5.038 20 0 DKADRN COc1cc([C@H](C)Nc2cc(C)ccc2F)ccc1SC ZINC000538545731 332255496 /nfs/dbraw/zinc/25/54/96/332255496.db2.gz ZJXMBMXENRUXKJ-LBPRGKRZSA-N 0 0 305.418 5.038 20 0 DKADRN C[C@@H](Nc1cnn(C(C)(C)C)c1)c1cc2cc(Cl)ccc2o1 ZINC000538546010 340832482 /nfs/dbraw/zinc/83/24/82/340832482.db2.gz LEAREAABUXDVQL-LLVKDONJSA-N 0 0 317.820 5.211 20 0 DKADRN Cc1c(N[C@@H](C)c2ccsc2)cccc1OCC(F)(F)F ZINC000538549906 340832534 /nfs/dbraw/zinc/83/25/34/340832534.db2.gz OECIISIWIZVXDQ-NSHDSACASA-N 0 0 315.360 5.171 20 0 DKADRN Fc1ccc2c(c1)CC[C@@H]2Nc1ccc(CC(F)(F)F)cc1 ZINC000538551124 340832609 /nfs/dbraw/zinc/83/26/09/340832609.db2.gz DRNKCWIPNGJSKC-INIZCTEOSA-N 0 0 309.306 5.030 20 0 DKADRN Cc1nc(-c2cccc(N[C@H]3CCc4ccc(C)cc43)c2)oc1C ZINC000538551151 340832654 /nfs/dbraw/zinc/83/26/54/340832654.db2.gz KVDWVPAJKRHMEF-FQEVSTJZSA-N 0 0 318.420 5.366 20 0 DKADRN CC[C@@H](Nc1cc(F)ccc1OC(F)F)c1cccs1 ZINC000538551299 340832612 /nfs/dbraw/zinc/83/26/12/340832612.db2.gz MXWQWAJEAPGBJM-SNVBAGLBSA-N 0 0 301.333 5.052 20 0 DKADRN CCOc1ccccc1N[C@@H](C)c1ccc(-c2ccncc2)cc1 ZINC000538553068 340832758 /nfs/dbraw/zinc/83/27/58/340832758.db2.gz AFPXEWLQHQJOAA-INIZCTEOSA-N 0 0 318.420 5.320 20 0 DKADRN CCOCc1ccc(N[C@@H](C)c2ccc(OC)c(Cl)c2)cc1 ZINC000538553123 340832769 /nfs/dbraw/zinc/83/27/69/340832769.db2.gz AYKPBBOHWDJDJB-ZDUSSCGKSA-N 0 0 319.832 5.058 20 0 DKADRN Cc1ccc([C@H](C)Nc2cccc(COC(C)(C)C)c2C)o1 ZINC000538553181 332257738 /nfs/dbraw/zinc/25/77/38/332257738.db2.gz CKMVNHHPJXBBIX-HNNXBMFYSA-N 0 0 301.430 5.385 20 0 DKADRN Cc1ccc([C@@H](C)Nc2cccc(COC(C)(C)C)c2C)o1 ZINC000538553186 332257818 /nfs/dbraw/zinc/25/78/18/332257818.db2.gz CKMVNHHPJXBBIX-OAHLLOKOSA-N 0 0 301.430 5.385 20 0 DKADRN CCOCc1ccc(N[C@@H]2CCSc3ccc(F)cc32)cc1 ZINC000538553779 340832996 /nfs/dbraw/zinc/83/29/96/340832996.db2.gz LXGNSUUSVGLVKY-QGZVFWFLSA-N 0 0 317.429 5.011 20 0 DKADRN Cc1c(COC(C)(C)C)cccc1N[C@H](C)c1ccsc1 ZINC000538554069 340832983 /nfs/dbraw/zinc/83/29/83/340832983.db2.gz PUYOQRCEVYNMSE-CQSZACIVSA-N 0 0 303.471 5.545 20 0 DKADRN Cc1ccncc1[C@H](C)Nc1cccc(COC(C)(C)C)c1C ZINC000538554364 340832884 /nfs/dbraw/zinc/83/28/84/340832884.db2.gz RWKJKFIYJQSHCL-INIZCTEOSA-N 0 0 312.457 5.187 20 0 DKADRN Cc1c(CSC(C)C)cccc1N[C@H](C)c1cscn1 ZINC000538554626 340833048 /nfs/dbraw/zinc/83/30/48/340833048.db2.gz WUAIKTPAYIUKKM-CYBMUJFWSA-N 0 0 306.500 5.266 20 0 DKADRN CSc1ccc([C@H](C)NC2(c3ccccc3F)CC2)cc1F ZINC000538554848 340833135 /nfs/dbraw/zinc/83/31/35/340833135.db2.gz XZEHTTPIAXFUKT-LBPRGKRZSA-N 0 0 319.420 5.027 20 0 DKADRN CCCOc1ccccc1N[C@@H](C)c1ccc2ccccc2n1 ZINC000538558133 340833213 /nfs/dbraw/zinc/83/32/13/340833213.db2.gz XUCYDJCLSRTNOB-HNNXBMFYSA-N 0 0 306.409 5.197 20 0 DKADRN CC[C@H](C)n1ncc(N[C@H](C)c2cc(F)cc(F)c2)c1C1CC1 ZINC000538578139 340833845 /nfs/dbraw/zinc/83/38/45/340833845.db2.gz GQKKRSSBSCYROP-NWDGAFQWSA-N 0 0 319.399 5.183 20 0 DKADRN CC[C@H](C)n1ncc(N[C@@H](C)c2cc(F)cc(F)c2)c1C1CC1 ZINC000538578140 340833877 /nfs/dbraw/zinc/83/38/77/340833877.db2.gz GQKKRSSBSCYROP-RYUDHWBXSA-N 0 0 319.399 5.183 20 0 DKADRN CC[C@@H](C)n1ncc(N[C@@H](C)c2cccc(F)c2)c1C1CC1 ZINC000538580636 340834080 /nfs/dbraw/zinc/83/40/80/340834080.db2.gz FNLXWJIMXKJNHD-OLZOCXBDSA-N 0 0 301.409 5.044 20 0 DKADRN CC[C@H](C)n1ncc(N[C@@H](C)c2cccc(F)c2)c1C1CC1 ZINC000538580640 340834083 /nfs/dbraw/zinc/83/40/83/340834083.db2.gz FNLXWJIMXKJNHD-STQMWFEESA-N 0 0 301.409 5.044 20 0 DKADRN CC[C@@H](C)n1ncc(N[C@@H](C)c2ccc(F)c(F)c2)c1C1CC1 ZINC000538580900 340834077 /nfs/dbraw/zinc/83/40/77/340834077.db2.gz HECUAQMQUOQBAA-NEPJUHHUSA-N 0 0 319.399 5.183 20 0 DKADRN CC[C@H](C)n1ncc(N[C@@H](C)c2ccc(F)c(F)c2)c1C1CC1 ZINC000538580906 340834085 /nfs/dbraw/zinc/83/40/85/340834085.db2.gz HECUAQMQUOQBAA-RYUDHWBXSA-N 0 0 319.399 5.183 20 0 DKADRN CC[C@@H](C)n1ncc(N[C@H](C)c2ccc(F)c(F)c2)c1C1CC1 ZINC000538580908 340834079 /nfs/dbraw/zinc/83/40/79/340834079.db2.gz HECUAQMQUOQBAA-VXGBXAGGSA-N 0 0 319.399 5.183 20 0 DKADRN CC[C@@H](C)n1ncc(N[C@@H](C)c2ccccc2F)c1C1CC1 ZINC000538581389 340834076 /nfs/dbraw/zinc/83/40/76/340834076.db2.gz OPFDPPPTFHKZMQ-OLZOCXBDSA-N 0 0 301.409 5.044 20 0 DKADRN CC[C@H](C)n1ncc(N[C@H](C)c2ccccc2F)c1C1CC1 ZINC000538581391 340834149 /nfs/dbraw/zinc/83/41/49/340834149.db2.gz OPFDPPPTFHKZMQ-QWHCGFSZSA-N 0 0 301.409 5.044 20 0 DKADRN CC[C@H](C)n1ncc(N[C@@H](C)c2ccccc2F)c1C1CC1 ZINC000538581393 340834075 /nfs/dbraw/zinc/83/40/75/340834075.db2.gz OPFDPPPTFHKZMQ-STQMWFEESA-N 0 0 301.409 5.044 20 0 DKADRN CC[C@@H](C)n1ncc(N[C@H](C)c2cc(F)ccc2F)c1C1CC1 ZINC000538583733 340834192 /nfs/dbraw/zinc/83/41/92/340834192.db2.gz WUUMYWPTERAAGZ-VXGBXAGGSA-N 0 0 319.399 5.183 20 0 DKADRN Cc1ccc([C@@H](C)Nc2ccc(CCC(F)(F)F)cc2)s1 ZINC000538616473 340835363 /nfs/dbraw/zinc/83/53/63/340835363.db2.gz HOMRRDVXZHJAQT-GFCCVEGCSA-N 0 0 313.388 5.725 20 0 DKADRN COc1ccc(Cl)cc1N[C@@H](C)c1ccc2ccccc2n1 ZINC000538619107 340835557 /nfs/dbraw/zinc/83/55/57/340835557.db2.gz NHJIHPCTYFDEQJ-LBPRGKRZSA-N 0 0 312.800 5.070 20 0 DKADRN CC(=O)Nc1ccc(N[C@@H](C)c2cc(Cl)cc(Cl)c2)cc1 ZINC000538622834 332329007 /nfs/dbraw/zinc/32/90/07/332329007.db2.gz ASWBOZMQOZRTKN-JTQLQIEISA-N 0 0 323.223 5.125 20 0 DKADRN CC(=O)Nc1ccc(N[C@H](C)c2cc(Cl)cc(Cl)c2)cc1 ZINC000538622844 332328815 /nfs/dbraw/zinc/32/88/15/332328815.db2.gz ASWBOZMQOZRTKN-SNVBAGLBSA-N 0 0 323.223 5.125 20 0 DKADRN CCc1ccc([C@@H](Nc2ccc(NC(C)=O)cc2)C(C)C)cc1 ZINC000538623268 340835757 /nfs/dbraw/zinc/83/57/57/340835757.db2.gz NLVBRYDDAPBIQM-FQEVSTJZSA-N 0 0 310.441 5.017 20 0 DKADRN CCc1ccc([C@H](Nc2ccc(NC(C)=O)cc2)C(C)C)cc1 ZINC000538623270 340835762 /nfs/dbraw/zinc/83/57/62/340835762.db2.gz NLVBRYDDAPBIQM-HXUWFJFHSA-N 0 0 310.441 5.017 20 0 DKADRN Cc1ccccc1COc1cccc(N[C@H](C)c2cccnc2)c1 ZINC000538627712 340835933 /nfs/dbraw/zinc/83/59/33/340835933.db2.gz HIJWFIPXWONBBJ-QGZVFWFLSA-N 0 0 318.420 5.142 20 0 DKADRN c1cc2cccc(N[C@H](C[C@H]3CCOC3)c3ccccc3)c2s1 ZINC000538627895 340835911 /nfs/dbraw/zinc/83/59/11/340835911.db2.gz KUZZXRXTUAFVRN-DNVCBOLYSA-N 0 0 323.461 5.481 20 0 DKADRN c1cc2cccc(N[C@@H](C[C@@H]3CCOC3)c3ccccc3)c2s1 ZINC000538627899 340835943 /nfs/dbraw/zinc/83/59/43/340835943.db2.gz KUZZXRXTUAFVRN-KXBFYZLASA-N 0 0 323.461 5.481 20 0 DKADRN C[C@@H](Nc1ccc(COCc2ccccc2)cc1)c1cccs1 ZINC000538629057 340835950 /nfs/dbraw/zinc/83/59/50/340835950.db2.gz USOJNQARAJJUIJ-MRXNPFEDSA-N 0 0 323.461 5.638 20 0 DKADRN Cc1ccccc1COc1cccc(N[C@H](C)c2ccncc2)c1 ZINC000538629147 340836027 /nfs/dbraw/zinc/83/60/27/340836027.db2.gz VUURLXUUUZXEAX-QGZVFWFLSA-N 0 0 318.420 5.142 20 0 DKADRN CC(C)n1ncc2ccc(N[C@H](C)c3cccc(F)c3F)cc21 ZINC000538632707 340835977 /nfs/dbraw/zinc/83/59/77/340835977.db2.gz FAZIHWGUENBARO-GFCCVEGCSA-N 0 0 315.367 5.069 20 0 DKADRN C[C@H](Nc1ccc2nc(C(C)(C)C)sc2c1)c1nccs1 ZINC000538632916 340835947 /nfs/dbraw/zinc/83/59/47/340835947.db2.gz IOERHOSQTLNKQH-JTQLQIEISA-N 0 0 317.483 5.223 20 0 DKADRN Cc1cnc(-c2cccc(N[C@H](C)c3cc4ccccc4o3)c2)o1 ZINC000538633139 340835978 /nfs/dbraw/zinc/83/59/78/340835978.db2.gz KGAXEIKLSQDARV-CQSZACIVSA-N 0 0 318.376 5.569 20 0 DKADRN Cc1ccsc1[C@H](C)Nc1cccc(OCC(F)(F)F)c1 ZINC000538633300 340836059 /nfs/dbraw/zinc/83/60/59/340836059.db2.gz LTPMAEUWNRFILM-NSHDSACASA-N 0 0 315.360 5.171 20 0 DKADRN CSCc1ccc(N[C@H](C)c2sc(C(C)C)nc2C)cc1 ZINC000538633375 340836095 /nfs/dbraw/zinc/83/60/95/340836095.db2.gz AFABVKYGBWHGJN-GFCCVEGCSA-N 0 0 320.527 5.611 20 0 DKADRN CC[C@@H](Nc1cccc(OCc2cscn2)c1)c1ccccc1 ZINC000538634261 340836134 /nfs/dbraw/zinc/83/61/34/340836134.db2.gz QGRDEIYFHKRROL-LJQANCHMSA-N 0 0 324.449 5.285 20 0 DKADRN COCCC[C@H](C)Nc1cccc(CO[C@@H]2CCC[C@@H](C)C2)c1 ZINC000538634566 340836245 /nfs/dbraw/zinc/83/62/45/340836245.db2.gz IQJJWTGPHVWMJW-FUHIMQAGSA-N 0 0 319.489 5.009 20 0 DKADRN CCCOc1ccc([C@@H](C)Nc2cccc([C@@H](C)OC)c2)cc1 ZINC000538634752 340836172 /nfs/dbraw/zinc/83/61/72/340836172.db2.gz UWPCDJCLPGVOSG-HZPDHXFCSA-N 0 0 313.441 5.356 20 0 DKADRN COc1ccc([C@H](C)Nc2cccc([C@@H](C)OC)c2)cc1Cl ZINC000538634768 340836127 /nfs/dbraw/zinc/83/61/27/340836127.db2.gz VQKJLYHTSTYXCA-QWHCGFSZSA-N 0 0 319.832 5.229 20 0 DKADRN CC(C)n1ncc2ccc(N[C@H](C)c3cc(F)ccc3F)cc21 ZINC000538635566 340836241 /nfs/dbraw/zinc/83/62/41/340836241.db2.gz BSBNAHQVCWPNLN-GFCCVEGCSA-N 0 0 315.367 5.069 20 0 DKADRN Cc1ccc([C@@H](C)Nc2cccc(OCC(F)(F)F)c2)s1 ZINC000538635862 340836276 /nfs/dbraw/zinc/83/62/76/340836276.db2.gz YGWCSXATITZURH-LLVKDONJSA-N 0 0 315.360 5.171 20 0 DKADRN CCSc1ccc(Cl)cc1N[C@H](C)c1cncc(F)c1 ZINC000538635961 340836355 /nfs/dbraw/zinc/83/63/55/340836355.db2.gz HCAHSYBJUIQJDF-SNVBAGLBSA-N 0 0 310.825 5.159 20 0 DKADRN CC[C@H](Nc1cccc([C@@H](C)OC)c1)c1cc(C)ccc1OC ZINC000538636019 340836357 /nfs/dbraw/zinc/83/63/57/340836357.db2.gz WQRNQJJVXMDYKR-BEFAXECRSA-N 0 0 313.441 5.274 20 0 DKADRN CC[C@H](Nc1cccc([C@H](C)OC)c1)c1cc(C)ccc1OC ZINC000538636025 340836292 /nfs/dbraw/zinc/83/62/92/340836292.db2.gz WQRNQJJVXMDYKR-KXBFYZLASA-N 0 0 313.441 5.274 20 0 DKADRN CC[C@H](Nc1cccc([C@H](C)OC)c1)c1cc(F)ccc1F ZINC000538636203 340836358 /nfs/dbraw/zinc/83/63/58/340836358.db2.gz MLAGLSUBUIBDCS-SGTLLEGYSA-N 0 0 305.368 5.235 20 0 DKADRN CO[C@@H](C)c1cccc(N[C@@H](C)c2ccc(F)c(Cl)c2)c1 ZINC000538636422 340836277 /nfs/dbraw/zinc/83/62/77/340836277.db2.gz VVSYYUXYFCXJQH-RYUDHWBXSA-N 0 0 307.796 5.360 20 0 DKADRN CO[C@@H](C)c1cccc(N[C@@H](C)c2cc3c(s2)CCC3)c1 ZINC000538636479 340836287 /nfs/dbraw/zinc/83/62/87/340836287.db2.gz XVHGJQWDGBERGB-STQMWFEESA-N 0 0 301.455 5.117 20 0 DKADRN CO[C@H](C)c1cccc(N[C@H](C)c2ccc(SC)c(F)c2)c1 ZINC000538636522 340836364 /nfs/dbraw/zinc/83/63/64/340836364.db2.gz ZDOHNNVUFWXKOC-CHWSQXEVSA-N 0 0 319.445 5.428 20 0 DKADRN Cc1coc(-c2ccc(C)c(N[C@H]3CCc4ccc(F)cc43)c2)n1 ZINC000538637731 340836421 /nfs/dbraw/zinc/83/64/21/340836421.db2.gz OCQABZFPLQIAFU-SFHVURJKSA-N 0 0 322.383 5.197 20 0 DKADRN Cc1ccc(N[C@@H](c2ccccc2)C2CC2)cc1-c1ncco1 ZINC000538638624 340836563 /nfs/dbraw/zinc/83/65/63/340836563.db2.gz ISVZDZGHSIUHGB-IBGZPJMESA-N 0 0 304.393 5.213 20 0 DKADRN Cc1ccc(N[C@H](c2ccccc2)C2CC2)cc1-c1ncco1 ZINC000538638625 340836564 /nfs/dbraw/zinc/83/65/64/340836564.db2.gz ISVZDZGHSIUHGB-LJQANCHMSA-N 0 0 304.393 5.213 20 0 DKADRN C[C@H](Nc1cccc(N2CCCCCC2)c1)c1cccs1 ZINC000538639860 340836707 /nfs/dbraw/zinc/83/67/07/340836707.db2.gz JXOQKRYQZUXYMY-HNNXBMFYSA-N 0 0 300.471 5.302 20 0 DKADRN Cc1ccc2cccc(N[C@@H](C)c3nc4c(s3)CCCC4)c2n1 ZINC000538640090 340836704 /nfs/dbraw/zinc/83/67/04/340836704.db2.gz AGQWQOKYUITWFD-ZDUSSCGKSA-N 0 0 323.465 5.052 20 0 DKADRN Cc1ccc(N[C@H]2CCc3c2cccc3Cl)cc1-c1ncco1 ZINC000538641129 340836836 /nfs/dbraw/zinc/83/68/36/340836836.db2.gz WIFGIJRMJVGVCG-SFHVURJKSA-N 0 0 324.811 5.403 20 0 DKADRN C[C@H](Nc1ccc(-c2csnn2)cc1)c1cc2ccccc2o1 ZINC000538641769 340836878 /nfs/dbraw/zinc/83/68/78/340836878.db2.gz MZUHNZFHMMEPAU-LBPRGKRZSA-N 0 0 321.405 5.124 20 0 DKADRN Cc1nc(-c2cccc(NCc3ccc([C@H]4C[C@H]4C)o3)c2)oc1C ZINC000538834011 340856477 /nfs/dbraw/zinc/85/64/77/340856477.db2.gz MFMXYNBQEFHPNL-XIKOKIGWSA-N 0 0 322.408 5.287 20 0 DKADRN O=C(CCCC(F)(F)F)Nc1ccccc1Oc1ccccc1 ZINC000538843617 340857250 /nfs/dbraw/zinc/85/72/50/340857250.db2.gz RRNHIGXQNDBJMB-UHFFFAOYSA-N 0 0 323.314 5.150 20 0 DKADRN CCC(CC)[C@H](NC(=O)CCCC(F)(F)F)c1cccs1 ZINC000538844238 340857458 /nfs/dbraw/zinc/85/74/58/340857458.db2.gz IDWXKIAYGSBXMA-AWEZNQCLSA-N 0 0 321.408 5.074 20 0 DKADRN CCCN(C(=O)CCCC(F)(F)F)[C@@H](CC)c1ccccc1 ZINC000538844284 340857461 /nfs/dbraw/zinc/85/74/61/340857461.db2.gz KWTLFUAQEOEPID-HNNXBMFYSA-N 0 0 315.379 5.109 20 0 DKADRN CCCN(C(=O)CCCC(F)(F)F)[C@H](CC)c1ccccc1 ZINC000538844285 340857459 /nfs/dbraw/zinc/85/74/59/340857459.db2.gz KWTLFUAQEOEPID-OAHLLOKOSA-N 0 0 315.379 5.109 20 0 DKADRN Cc1cnc([C@@H](C)S[C@H](C)c2ccc(OC(F)F)cc2)o1 ZINC000538849445 340857774 /nfs/dbraw/zinc/85/77/74/340857774.db2.gz DBPJSQWMDSDWCC-GHMZBOCLSA-N 0 0 313.369 5.140 20 0 DKADRN Cc1cnc([C@H](C)S[C@@H](C)c2ccc(OC(F)F)cc2)o1 ZINC000538849447 340857785 /nfs/dbraw/zinc/85/77/85/340857785.db2.gz DBPJSQWMDSDWCC-QWRGUYRKSA-N 0 0 313.369 5.140 20 0 DKADRN Cc1cnc([C@@H](C)S[C@@H](C)c2ccc(OC(F)F)cc2)o1 ZINC000538849448 340857786 /nfs/dbraw/zinc/85/77/86/340857786.db2.gz DBPJSQWMDSDWCC-WDEREUQCSA-N 0 0 313.369 5.140 20 0 DKADRN Cc1cnc([C@H](C)SCc2nc(-c3cccs3)oc2C)o1 ZINC000538849778 340857773 /nfs/dbraw/zinc/85/77/73/340857773.db2.gz TWFCSQMHPRMCGG-NSHDSACASA-N 0 0 320.439 5.002 20 0 DKADRN Cc1cnc([C@H](C)SCCOc2cccc3ccccc32)o1 ZINC000538849915 340857746 /nfs/dbraw/zinc/85/77/46/340857746.db2.gz BBRCCCPJLFRFQE-AWEZNQCLSA-N 0 0 313.422 5.009 20 0 DKADRN Cc1cnc([C@@H](C)SCc2c(Cl)cccc2Cl)o1 ZINC000538850598 340857866 /nfs/dbraw/zinc/85/78/66/340857866.db2.gz PBVQEQLMUWYDAI-SECBINFHSA-N 0 0 302.226 5.284 20 0 DKADRN Cc1cnc([C@H](C)SCc2c(Cl)cccc2Cl)o1 ZINC000538850599 340857775 /nfs/dbraw/zinc/85/77/75/340857775.db2.gz PBVQEQLMUWYDAI-VIFPVBQESA-N 0 0 302.226 5.284 20 0 DKADRN Cc1cnc([C@@H](C)SCCOc2ccc3ccccc3c2)o1 ZINC000538853167 340858015 /nfs/dbraw/zinc/85/80/15/340858015.db2.gz UNVGJWUZKKWKJG-CQSZACIVSA-N 0 0 313.422 5.009 20 0 DKADRN CC(C)CN(C(=O)CCCC(F)(F)F)c1ccc(Cl)cc1 ZINC000538862171 340859090 /nfs/dbraw/zinc/85/90/90/340859090.db2.gz WPWOQSQMFCJAPR-UHFFFAOYSA-N 0 0 321.770 5.062 20 0 DKADRN CCOc1ccccc1-c1cccc(C(=O)Nc2ccccc2)c1 ZINC000538964708 340863652 /nfs/dbraw/zinc/86/36/52/340863652.db2.gz VUHCFEAWYQPGNA-UHFFFAOYSA-N 0 0 317.388 5.005 20 0 DKADRN CC[C@H]1CC[C@H](C)N1C(=O)Nc1ccccc1Cc1ccccc1 ZINC000538964849 340863643 /nfs/dbraw/zinc/86/36/43/340863643.db2.gz ZLFPBLZTVRCROO-LPHOPBHVSA-N 0 0 322.452 5.072 20 0 DKADRN CC(C)CC[C@H](N[C@@H](C)c1nccs1)c1ccc(Cl)cc1 ZINC000538985835 340864416 /nfs/dbraw/zinc/86/44/16/340864416.db2.gz LCZDEGXJSJZJPP-BBRMVZONSA-N 0 0 322.905 5.625 20 0 DKADRN CC(C)CC[C@H](N[C@H](C)c1nccs1)c1ccc(Cl)cc1 ZINC000538985836 340864521 /nfs/dbraw/zinc/86/45/21/340864521.db2.gz LCZDEGXJSJZJPP-CJNGLKHVSA-N 0 0 322.905 5.625 20 0 DKADRN Cc1cccc(C)c1NC(=O)C[C@@H](C)Cc1ccc(Cl)cc1 ZINC000539032133 340865742 /nfs/dbraw/zinc/86/57/42/340865742.db2.gz XIWQRHAIRNQPDS-ZDUSSCGKSA-N 0 0 315.844 5.164 20 0 DKADRN COC[C@H](N[C@@H](C)c1cc(Cl)ccc1Cl)c1ccccc1 ZINC000539063711 340869635 /nfs/dbraw/zinc/86/96/35/340869635.db2.gz SNHSDINQHZKQLY-SJCJKPOMSA-N 0 0 324.251 5.032 20 0 DKADRN COC[C@@H](N[C@H](C)c1cc(Cl)ccc1Cl)c1ccccc1 ZINC000539063712 340869617 /nfs/dbraw/zinc/86/96/17/340869617.db2.gz SNHSDINQHZKQLY-SJKOYZFVSA-N 0 0 324.251 5.032 20 0 DKADRN CC[C@H](N[C@H](C)c1cccc(F)c1F)c1cc(F)ccc1F ZINC000539066505 340870013 /nfs/dbraw/zinc/87/00/13/340870013.db2.gz OJWQKVOFPANIHR-HWPZZCPQSA-N 0 0 311.322 5.045 20 0 DKADRN CCCC[C@H](NCc1coc(-c2ccccc2)n1)c1ccccc1 ZINC000539077867 340871059 /nfs/dbraw/zinc/87/10/59/340871059.db2.gz COUOILVNSCOICY-FQEVSTJZSA-N 0 0 320.436 5.363 20 0 DKADRN C[C@@H](N[C@@H]1CCOc2c(Cl)cccc21)c1ccccc1Cl ZINC000539092093 340872619 /nfs/dbraw/zinc/87/26/19/340872619.db2.gz WETQUHPIYTVGRB-BDJLRTHQSA-N 0 0 322.235 5.168 20 0 DKADRN C[C@@H](N[C@H]1CCOc2c(Cl)cccc21)c1ccccc1Cl ZINC000539092094 340872540 /nfs/dbraw/zinc/87/25/40/340872540.db2.gz WETQUHPIYTVGRB-BZNIZROVSA-N 0 0 322.235 5.168 20 0 DKADRN C[C@H](N[C@@H]1CCOc2c(Cl)cccc21)c1ccccc1Cl ZINC000539092095 340872552 /nfs/dbraw/zinc/87/25/52/340872552.db2.gz WETQUHPIYTVGRB-MEDUHNTESA-N 0 0 322.235 5.168 20 0 DKADRN C[C@H](N[C@H]1CCOc2c(Cl)cccc21)c1ccccc1Cl ZINC000539092096 340872601 /nfs/dbraw/zinc/87/26/01/340872601.db2.gz WETQUHPIYTVGRB-ZBEGNZNMSA-N 0 0 322.235 5.168 20 0 DKADRN Cc1nnc(CS[C@@H](C)c2cc(Cl)ccc2Cl)s1 ZINC000539094722 340872968 /nfs/dbraw/zinc/87/29/68/340872968.db2.gz DUPORUJQLWDVOL-ZETCQYMHSA-N 0 0 319.282 5.148 20 0 DKADRN CCc1ccc(Cl)c(CC)c1NC(=O)c1csc(C)c1C ZINC000539155219 340875088 /nfs/dbraw/zinc/87/50/88/340875088.db2.gz WAYOWMNNDPWMPX-UHFFFAOYSA-N 0 0 321.873 5.395 20 0 DKADRN CC[C@H](C)n1ncc(NCc2ccc(Cl)s2)c1C1CC1 ZINC000539226963 340877475 /nfs/dbraw/zinc/87/74/75/340877475.db2.gz XGFFKKTXZRJFRG-JTQLQIEISA-N 0 0 309.866 5.059 20 0 DKADRN CCC(CC)n1ccc(CN[C@H](CC)c2ccc(Cl)cc2)n1 ZINC000539230299 340877538 /nfs/dbraw/zinc/87/75/38/340877538.db2.gz VIKFTCWYXYBXLO-GOSISDBHSA-N 0 0 319.880 5.139 20 0 DKADRN CSc1cccc(NCc2ncc(-c3ccc(C)cc3)o2)c1C ZINC000539237997 340877890 /nfs/dbraw/zinc/87/78/90/340877890.db2.gz AQNLQERDZKQJKP-UHFFFAOYSA-N 0 0 324.449 5.292 20 0 DKADRN CSc1cccc(NC(=O)Nc2ccccc2Cl)c1C ZINC000539238455 340877898 /nfs/dbraw/zinc/87/78/98/340877898.db2.gz KKBFJRZFSFPQQQ-UHFFFAOYSA-N 0 0 306.818 5.014 20 0 DKADRN CSc1cccc(NC(=O)Nc2cccc(C)c2Cl)c1C ZINC000539258336 340878677 /nfs/dbraw/zinc/87/86/77/340878677.db2.gz RKGFJGPRZVDQRX-UHFFFAOYSA-N 0 0 320.845 5.323 20 0 DKADRN CCCCc1nc(CN[C@H](CC)c2ccc(C)cc2)cs1 ZINC000539260012 340878897 /nfs/dbraw/zinc/87/88/97/340878897.db2.gz NLVGHCQAVSNENU-QGZVFWFLSA-N 0 0 302.487 5.035 20 0 DKADRN Cc1ccccc1[C@@H](NCc1ncc(-c2ccccc2)o1)C(C)C ZINC000539261119 340878802 /nfs/dbraw/zinc/87/88/02/340878802.db2.gz ZXGCHGKPBPGIFM-NRFANRHFSA-N 0 0 320.436 5.137 20 0 DKADRN Cc1cnc([C@@H](C)N[C@@H](C)c2ccc(Oc3ccccc3)cc2)o1 ZINC000539261279 340878792 /nfs/dbraw/zinc/87/87/92/340878792.db2.gz NJINZJVGTSZRDK-JKSUJKDBSA-N 0 0 322.408 5.187 20 0 DKADRN CCc1ccnc(C(=O)Nc2c(C(C)C)cccc2C(C)C)c1 ZINC000539299009 340880007 /nfs/dbraw/zinc/88/00/07/340880007.db2.gz FOKSKLFQWVUZCU-UHFFFAOYSA-N 0 0 310.441 5.143 20 0 DKADRN CC(C)C[C@H](NCc1ncc(C2CC2)o1)c1ccc(Cl)cc1 ZINC000539299245 517433503 /nfs/dbraw/zinc/43/35/03/517433503.db2.gz VNLZHZFCLKOWLP-INIZCTEOSA-N 0 0 318.848 5.082 20 0 DKADRN CC(C)C[C@@H](NCc1ncc(C2CC2)o1)c1ccc(Cl)cc1 ZINC000539299249 340879954 /nfs/dbraw/zinc/87/99/54/340879954.db2.gz VNLZHZFCLKOWLP-MRXNPFEDSA-N 0 0 318.848 5.082 20 0 DKADRN Cc1nc(C2CCCCC2)sc1C(=O)Nc1ccccc1C ZINC000539299507 340880033 /nfs/dbraw/zinc/88/00/33/340880033.db2.gz UZWGCNBCHIVBLX-UHFFFAOYSA-N 0 0 314.454 5.060 20 0 DKADRN CSc1cccc(NC(=O)Nc2cccc(Cl)c2C)c1C ZINC000539302062 340880111 /nfs/dbraw/zinc/88/01/11/340880111.db2.gz YOMKTOFHXFENEW-UHFFFAOYSA-N 0 0 320.845 5.323 20 0 DKADRN CCC[C@H](C)[C@H]1CCCN1C(=O)Nc1cccc(SC)c1C ZINC000539309471 340880523 /nfs/dbraw/zinc/88/05/23/340880523.db2.gz NVAYDRNMDJCXNF-XJKSGUPXSA-N 0 0 320.502 5.149 20 0 DKADRN CCC[C@@H]1[C@@H](C)CCCN1C(=O)Nc1cccc(SC)c1C ZINC000539309895 340880524 /nfs/dbraw/zinc/88/05/24/340880524.db2.gz WPYSTIZBDFLZEO-XJKSGUPXSA-N 0 0 320.502 5.149 20 0 DKADRN CC(C)(C)c1csc(CNC(C)(C)c2cccc(Cl)c2)n1 ZINC000539316422 340880643 /nfs/dbraw/zinc/88/06/43/340880643.db2.gz WRTFYSKELVFKSY-UHFFFAOYSA-N 0 0 322.905 5.119 20 0 DKADRN CCSc1ccccc1C(=O)Nc1ccc(-c2ccc[nH]2)cc1 ZINC000539323198 340880967 /nfs/dbraw/zinc/88/09/67/340880967.db2.gz XQVHRRRXHFXSKM-UHFFFAOYSA-N 0 0 322.433 5.046 20 0 DKADRN CSc1cccc(NC(=O)c2cccc3ccccc32)c1C ZINC000539343990 340881964 /nfs/dbraw/zinc/88/19/64/340881964.db2.gz WHFQRQFYGSMOLU-UHFFFAOYSA-N 0 0 307.418 5.122 20 0 DKADRN CSc1cccc(NC(=O)c2ccc3sccc3c2)c1C ZINC000539344272 340881897 /nfs/dbraw/zinc/88/18/97/340881897.db2.gz DIECIPXMYCVBFT-UHFFFAOYSA-N 0 0 313.447 5.184 20 0 DKADRN CSc1ccc(C)c(NCc2ccc(F)c3cccnc23)c1 ZINC000539401367 340884074 /nfs/dbraw/zinc/88/40/74/340884074.db2.gz RZENRENUAFQPAD-UHFFFAOYSA-N 0 0 312.413 5.016 20 0 DKADRN CCC[C@@H](C)[C@@H]1CCCN1C(=O)Nc1cc(SC)ccc1C ZINC000539426695 340885120 /nfs/dbraw/zinc/88/51/20/340885120.db2.gz OBYWVHSZSSCARP-PBHICJAKSA-N 0 0 320.502 5.149 20 0 DKADRN CCC[C@@H](C)[C@H]1CCCN1C(=O)Nc1cc(SC)ccc1C ZINC000539426696 340885078 /nfs/dbraw/zinc/88/50/78/340885078.db2.gz OBYWVHSZSSCARP-RHSMWYFYSA-N 0 0 320.502 5.149 20 0 DKADRN CCC[C@H](C)[C@H]1CCCN1C(=O)Nc1cc(SC)ccc1C ZINC000539426697 340885186 /nfs/dbraw/zinc/88/51/86/340885186.db2.gz OBYWVHSZSSCARP-WMLDXEAASA-N 0 0 320.502 5.149 20 0 DKADRN CCC[C@H](C)[C@@H]1CCCN1C(=O)Nc1cc(SC)ccc1C ZINC000539426698 340885109 /nfs/dbraw/zinc/88/51/09/340885109.db2.gz OBYWVHSZSSCARP-YOEHRIQHSA-N 0 0 320.502 5.149 20 0 DKADRN Cc1cccc(NC(=O)N(C)[C@@H](C)c2ccccc2Cl)c1F ZINC000539427163 340885196 /nfs/dbraw/zinc/88/51/96/340885196.db2.gz MIVXQZUDCWRHCE-LBPRGKRZSA-N 0 0 320.795 5.012 20 0 DKADRN CSc1ccc(C)c(NC(=O)Nc2ccccc2SC)c1 ZINC000539444189 340885701 /nfs/dbraw/zinc/88/57/01/340885701.db2.gz IZKPAVNVBQMAGQ-UHFFFAOYSA-N 0 0 318.467 5.083 20 0 DKADRN CCc1cccc(C)c1NC(=O)Nc1cc(SC)ccc1C ZINC000539444698 340885697 /nfs/dbraw/zinc/88/56/97/340885697.db2.gz KPKNPVMDXMKMQM-UHFFFAOYSA-N 0 0 314.454 5.232 20 0 DKADRN CSc1ccc(C)c(NC(=O)c2cccc3c(C)c(C)[nH]c32)c1 ZINC000539444913 340885692 /nfs/dbraw/zinc/88/56/92/340885692.db2.gz OLXGMEWJSUINHS-UHFFFAOYSA-N 0 0 324.449 5.067 20 0 DKADRN CSc1ccc(C)c(NC(=O)c2occc2-c2ccccc2)c1 ZINC000539446016 340885774 /nfs/dbraw/zinc/88/57/74/340885774.db2.gz JDOAZHOHQQKADQ-UHFFFAOYSA-N 0 0 323.417 5.229 20 0 DKADRN CSc1ccc(C)c(NC(=O)c2cc(C)c(F)cc2Cl)c1 ZINC000539447064 340885795 /nfs/dbraw/zinc/88/57/95/340885795.db2.gz SMVOUKRHXMXQAB-UHFFFAOYSA-N 0 0 323.820 5.070 20 0 DKADRN CSc1ccc(C)c(NC(=O)c2[nH]c3ccc(C)cc3c2C)c1 ZINC000539447066 340885772 /nfs/dbraw/zinc/88/57/72/340885772.db2.gz VKQHHWYOZYUVFZ-UHFFFAOYSA-N 0 0 324.449 5.067 20 0 DKADRN CSc1ccc(C)c(NC(=O)CC(C)(C)c2ccccc2)c1 ZINC000539451333 331715701 /nfs/dbraw/zinc/71/57/01/331715701.db2.gz VUYUOFCKKOYJRO-UHFFFAOYSA-N 0 0 313.466 5.023 20 0 DKADRN CSc1ccc(C)c(NC(=O)CC/C=C\c2ccccc2)c1 ZINC000539451862 340886071 /nfs/dbraw/zinc/88/60/71/340886071.db2.gz BAZWYSTVSPDIST-POHAHGRESA-N 0 0 311.450 5.149 20 0 DKADRN CCSc1ccccc1C(=O)Nc1cc(SC)ccc1C ZINC000539452231 340886072 /nfs/dbraw/zinc/88/60/72/340886072.db2.gz WHHBGRJXVHHFTD-UHFFFAOYSA-N 0 0 317.479 5.081 20 0 DKADRN CSc1ccc(C)c(NC(=O)Nc2cc(C)ccc2Cl)c1 ZINC000539460411 340886268 /nfs/dbraw/zinc/88/62/68/340886268.db2.gz IVCHLICAHAGWBI-UHFFFAOYSA-N 0 0 320.845 5.323 20 0 DKADRN CSc1ccc(C)c(NC(=O)Nc2cccc(C(F)F)c2)c1 ZINC000539461439 340886306 /nfs/dbraw/zinc/88/63/06/340886306.db2.gz SSSDSYFAMRWEPF-UHFFFAOYSA-N 0 0 322.380 5.299 20 0 DKADRN CCCCc1nc(CN[C@@H](c2ccccc2C)C2CC2)cs1 ZINC000539492306 340886919 /nfs/dbraw/zinc/88/69/19/340886919.db2.gz PGNUBLJAOOLTBU-LJQANCHMSA-N 0 0 314.498 5.035 20 0 DKADRN CCCc1occc1C(=O)Nc1c(C(C)C)cccc1C(C)C ZINC000539503354 340888085 /nfs/dbraw/zinc/88/80/85/340888085.db2.gz RLWOTMPBNKAYOJ-UHFFFAOYSA-N 0 0 313.441 5.731 20 0 DKADRN CSc1cccc(F)c1C(=O)Nc1ccc(C(C)(C)C)cc1 ZINC000539503792 340888018 /nfs/dbraw/zinc/88/80/18/340888018.db2.gz ORCDRSFIMXEROM-UHFFFAOYSA-N 0 0 317.429 5.097 20 0 DKADRN CCCc1occc1C(=O)Nc1ccccc1-c1cccs1 ZINC000539510435 340888783 /nfs/dbraw/zinc/88/87/83/340888783.db2.gz AAUZQMRCTRVNCR-UHFFFAOYSA-N 0 0 311.406 5.213 20 0 DKADRN CSc1ccc(C)c(NCc2ncc(-c3ccccc3C)o2)c1 ZINC000539516970 340888980 /nfs/dbraw/zinc/88/89/80/340888980.db2.gz VGUMPGIQTZUVIE-UHFFFAOYSA-N 0 0 324.449 5.292 20 0 DKADRN Cc1cccc(NC(=O)[C@@H](C)c2ccc3ccccc3c2)c1F ZINC000539518297 340889047 /nfs/dbraw/zinc/88/90/47/340889047.db2.gz DGJZRHYOEOSKMO-AWEZNQCLSA-N 0 0 307.368 5.030 20 0 DKADRN Cc1cccc(F)c1NC(=O)[C@@H]1C[C@@H]1c1ccc2ccccc2c1 ZINC000539539232 340889723 /nfs/dbraw/zinc/88/97/23/340889723.db2.gz FVMVRLJEXZQUCB-QZTJIDSGSA-N 0 0 319.379 5.030 20 0 DKADRN Cc1ccc(SC2CCCC2)c(C(=O)Nc2ccsc2)c1 ZINC000539541956 340889829 /nfs/dbraw/zinc/88/98/29/340889829.db2.gz MMPLJACZYPULKL-UHFFFAOYSA-N 0 0 317.479 5.344 20 0 DKADRN Cc1c2cc(F)ccc2oc1CN[C@@H](C)c1cccc(F)c1F ZINC000539557448 340890503 /nfs/dbraw/zinc/89/05/03/340890503.db2.gz KPDDKVUDBDFJCZ-NSHDSACASA-N 0 0 319.326 5.009 20 0 DKADRN C[C@@H](Nc1ccc(NC(=O)[C@@H]2CC[C@@H](C)C2)cc1)c1ccccc1 ZINC000539589651 340891505 /nfs/dbraw/zinc/89/15/05/340891505.db2.gz NNKRQYKZYHYMDY-JFIYKMOQSA-N 0 0 322.452 5.234 20 0 DKADRN C[C@H](Nc1ccc(NC(=O)[C@@H]2CC[C@@H](C)C2)cc1)c1ccccc1 ZINC000539589654 340891531 /nfs/dbraw/zinc/89/15/31/340891531.db2.gz NNKRQYKZYHYMDY-SOLBZPMBSA-N 0 0 322.452 5.234 20 0 DKADRN CSc1ccccc1CC(=O)Nc1c(C)cccc1C(C)C ZINC000539593748 340891610 /nfs/dbraw/zinc/89/16/10/340891610.db2.gz YCRUBPGRYKECCA-UHFFFAOYSA-N 0 0 313.466 5.022 20 0 DKADRN Cc1ccc2c(c1)[C@@H](Nc1cccc(NC(=O)C(C)C)c1)CCC2 ZINC000539595800 340891775 /nfs/dbraw/zinc/89/17/75/340891775.db2.gz MEUQNODMVCIEMK-FQEVSTJZSA-N 0 0 322.452 5.079 20 0 DKADRN CC[C@H](Nc1ccc(NC(C)=O)c(Cl)c1)C1CCCCC1 ZINC000539596917 340891742 /nfs/dbraw/zinc/89/17/42/340891742.db2.gz RXFZAVGZTNCHGA-INIZCTEOSA-N 0 0 308.853 5.069 20 0 DKADRN CCCOc1cccc(N[C@@H](C)c2ccc3ccccc3n2)c1 ZINC000539597295 340891883 /nfs/dbraw/zinc/89/18/83/340891883.db2.gz XIDDIESDDWIBOF-HNNXBMFYSA-N 0 0 306.409 5.197 20 0 DKADRN CCCOc1cccc(N[C@H](C)c2ccc3ccccc3n2)c1 ZINC000539597296 340891805 /nfs/dbraw/zinc/89/18/05/340891805.db2.gz XIDDIESDDWIBOF-OAHLLOKOSA-N 0 0 306.409 5.197 20 0 DKADRN Cc1cccc2c1[C@H](C)C[C@@H]2Nc1cccc(NC(=O)C(C)C)c1 ZINC000539598030 340891898 /nfs/dbraw/zinc/89/18/98/340891898.db2.gz YUWYASBQBGAYLI-BEFAXECRSA-N 0 0 322.452 5.250 20 0 DKADRN Cc1cccc2c1[C@@H](C)C[C@H]2Nc1cccc(NC(=O)C(C)C)c1 ZINC000539598032 340891899 /nfs/dbraw/zinc/89/18/99/340891899.db2.gz YUWYASBQBGAYLI-HNAYVOBHSA-N 0 0 322.452 5.250 20 0 DKADRN Cc1ccc([C@@H](C)Nc2cccc(COCc3ccco3)c2)cc1 ZINC000539598589 340891861 /nfs/dbraw/zinc/89/18/61/340891861.db2.gz MNYJUGDFLYROHI-QGZVFWFLSA-N 0 0 321.420 5.478 20 0 DKADRN Cc1ccc([C@H](C)Nc2ccc(NC(=O)CC(C)C)cc2)s1 ZINC000539599452 340891867 /nfs/dbraw/zinc/89/18/67/340891867.db2.gz OFAIAXDBTWXWDS-AWEZNQCLSA-N 0 0 316.470 5.214 20 0 DKADRN CC(C)C(=O)Nc1cccc(N[C@@H](CC2CC2)c2ccccc2)c1 ZINC000539599700 340891879 /nfs/dbraw/zinc/89/18/79/340891879.db2.gz XPNBQSFBHFFMSV-FQEVSTJZSA-N 0 0 322.452 5.234 20 0 DKADRN CC(=O)Nc1ccc(N[C@H](C)c2cccc(C)c2C)cc1Cl ZINC000539600498 340892012 /nfs/dbraw/zinc/89/20/12/340892012.db2.gz IBQXYSMPIRXURY-CYBMUJFWSA-N 0 0 316.832 5.088 20 0 DKADRN CC(=O)Nc1ccc(N[C@@H](C)c2cccc(C)c2C)cc1Cl ZINC000539600499 340891989 /nfs/dbraw/zinc/89/19/89/340891989.db2.gz IBQXYSMPIRXURY-ZDUSSCGKSA-N 0 0 316.832 5.088 20 0 DKADRN Cc1cccc(C)c1CC(=O)Nc1ccccc1-c1cccs1 ZINC000539600882 340891956 /nfs/dbraw/zinc/89/19/56/340891956.db2.gz DQSYCAQCQIKAME-UHFFFAOYSA-N 0 0 321.445 5.213 20 0 DKADRN CC(=O)Nc1cc(N[C@H](CC2CCC2)c2ccccc2)ccc1C ZINC000539601169 340891971 /nfs/dbraw/zinc/89/19/71/340891971.db2.gz JMLMJESXAUUIRC-OAQYLSRUSA-N 0 0 322.452 5.297 20 0 DKADRN CC(=O)Nc1cc(N[C@H](C)c2ccccc2C(C)(C)C)ccc1C ZINC000539601585 340892003 /nfs/dbraw/zinc/89/20/03/340892003.db2.gz LCFWNCGWEPHSDL-OAHLLOKOSA-N 0 0 324.468 5.424 20 0 DKADRN CC(=O)Nc1cccc(N[C@@H](c2cc3ccccc3o2)C(C)C)c1 ZINC000539608937 340892475 /nfs/dbraw/zinc/89/24/75/340892475.db2.gz CQGGMWUROHRFCW-HXUWFJFHSA-N 0 0 322.408 5.200 20 0 DKADRN CSc1cccc(N[C@H](C)c2ccc(-n3ccnc3C)cc2)c1 ZINC000539609299 340892482 /nfs/dbraw/zinc/89/24/82/340892482.db2.gz RXTFZQRRTGGTMS-CQSZACIVSA-N 0 0 323.465 5.076 20 0 DKADRN COc1cc(F)ccc1N[C@@H](C)c1cccc(-c2ccncc2)c1 ZINC000539609868 340892598 /nfs/dbraw/zinc/89/25/98/340892598.db2.gz PPFVQRIKBPQQNQ-AWEZNQCLSA-N 0 0 322.383 5.069 20 0 DKADRN COc1cc([C@@H](C)Nc2cccc(C)c2C)ccc1SC ZINC000539610553 340892734 /nfs/dbraw/zinc/89/27/34/340892734.db2.gz BRKJRGIONKVMLM-CQSZACIVSA-N 0 0 301.455 5.207 20 0 DKADRN CSc1cccc(N[C@H]2CC3(CCC3)Oc3ccccc32)c1 ZINC000539610690 340892745 /nfs/dbraw/zinc/89/27/45/340892745.db2.gz NRXDAJOTIXUYMU-KRWDZBQOSA-N 0 0 311.450 5.267 20 0 DKADRN CSc1cccc(N[C@@H]2CC3(CCC3)Oc3ccccc32)c1 ZINC000539610691 340892660 /nfs/dbraw/zinc/89/26/60/340892660.db2.gz NRXDAJOTIXUYMU-QGZVFWFLSA-N 0 0 311.450 5.267 20 0 DKADRN COc1cc(F)ccc1N[C@@H](C)c1ccc(-c2ccncc2)cc1 ZINC000539610997 340892679 /nfs/dbraw/zinc/89/26/79/340892679.db2.gz VXVOLFHVXPSHIP-AWEZNQCLSA-N 0 0 322.383 5.069 20 0 DKADRN COc1cc(F)ccc1N[C@H](C)c1ccc(-c2ccncc2)cc1 ZINC000539610998 340892675 /nfs/dbraw/zinc/89/26/75/340892675.db2.gz VXVOLFHVXPSHIP-CQSZACIVSA-N 0 0 322.383 5.069 20 0 DKADRN Cc1cccc([C@H](C)Nc2ccc(NC(=O)C(C)C)cc2)c1C ZINC000539611033 340892671 /nfs/dbraw/zinc/89/26/71/340892671.db2.gz WXZYHENCVBYVJR-INIZCTEOSA-N 0 0 310.441 5.071 20 0 DKADRN Cc1cccc([C@@H](C)Nc2ccc(NC(=O)C(C)C)cc2)c1C ZINC000539611034 340892746 /nfs/dbraw/zinc/89/27/46/340892746.db2.gz WXZYHENCVBYVJR-MRXNPFEDSA-N 0 0 310.441 5.071 20 0 DKADRN C[C@@H](Nc1ccccc1COCc1ccccc1)c1cccs1 ZINC000539611245 340892736 /nfs/dbraw/zinc/89/27/36/340892736.db2.gz MNKJHSWMEDLWAK-MRXNPFEDSA-N 0 0 323.461 5.638 20 0 DKADRN Cc1ccc(C)c([C@H](C)Nc2cc(NC(=O)C3CC3)ccc2C)c1 ZINC000539611277 340892676 /nfs/dbraw/zinc/89/26/76/340892676.db2.gz BEVZOVXQKCXRNV-INIZCTEOSA-N 0 0 322.452 5.133 20 0 DKADRN Cc1ccc(C)c([C@@H](C)Nc2cc(NC(=O)C3CC3)ccc2C)c1 ZINC000539611278 340892695 /nfs/dbraw/zinc/89/26/95/340892695.db2.gz BEVZOVXQKCXRNV-MRXNPFEDSA-N 0 0 322.452 5.133 20 0 DKADRN CC(C)CCCSCC(=O)Nc1c(Cl)cccc1Cl ZINC000539617508 340892966 /nfs/dbraw/zinc/89/29/66/340892966.db2.gz FAJJVUWMHODQLY-UHFFFAOYSA-N 0 0 320.285 5.101 20 0 DKADRN Cc1cccnc1CSCc1c(Cl)ccc2cccnc21 ZINC000539624965 340893345 /nfs/dbraw/zinc/89/33/45/340893345.db2.gz FZAUHIPNEZKMRL-UHFFFAOYSA-N 0 0 314.841 5.025 20 0 DKADRN C[C@@H](Nc1cccc(COCC2CC2)c1)c1cc(F)cc(F)c1 ZINC000539625111 340893295 /nfs/dbraw/zinc/89/32/95/340893295.db2.gz WXFLYLWVJOYVBD-CYBMUJFWSA-N 0 0 317.379 5.065 20 0 DKADRN Cc1cccnc1CSCc1ccc(Cl)c2cccnc12 ZINC000539625247 340893363 /nfs/dbraw/zinc/89/33/63/340893363.db2.gz JVXAASJREZQOPK-UHFFFAOYSA-N 0 0 314.841 5.025 20 0 DKADRN c1ccc([C@H](Nc2cccc(COCC3CC3)c2)C2CC2)cc1 ZINC000539625448 340893389 /nfs/dbraw/zinc/89/33/89/340893389.db2.gz HOOKVUCCOSRXHB-NRFANRHFSA-N 0 0 307.437 5.176 20 0 DKADRN c1ccc([C@@H](Nc2cccc(COCC3CC3)c2)C2CC2)cc1 ZINC000539625450 340893369 /nfs/dbraw/zinc/89/33/69/340893369.db2.gz HOOKVUCCOSRXHB-OAQYLSRUSA-N 0 0 307.437 5.176 20 0 DKADRN CC(C)CCOc1cccc(N[C@@H](C)c2cnn(C(C)C)c2)c1 ZINC000539625653 340893384 /nfs/dbraw/zinc/89/33/84/340893384.db2.gz QWHOXVOITDHZMV-INIZCTEOSA-N 0 0 315.461 5.062 20 0 DKADRN CC(C)c1nc2cc(N[C@@H](c3cccnc3)C(C)C)ccc2o1 ZINC000539626306 340893386 /nfs/dbraw/zinc/89/33/86/340893386.db2.gz CTBKDAXNKWWLPN-GOSISDBHSA-N 0 0 309.413 5.155 20 0 DKADRN CC(C)c1nc2cc(N[C@H](c3cccnc3)C(C)C)ccc2o1 ZINC000539626307 340893277 /nfs/dbraw/zinc/89/32/77/340893277.db2.gz CTBKDAXNKWWLPN-SFHVURJKSA-N 0 0 309.413 5.155 20 0 DKADRN c1ccc2c(c1)OCCC[C@@H]2Nc1ccc2oc(C3CC3)nc2c1 ZINC000539626852 340893428 /nfs/dbraw/zinc/89/34/28/340893428.db2.gz ZQSWRKIUSUZULJ-INIZCTEOSA-N 0 0 320.392 5.031 20 0 DKADRN c1ccc2c(c1)OCCC[C@H]2Nc1ccc2oc(C3CC3)nc2c1 ZINC000539626853 340893437 /nfs/dbraw/zinc/89/34/37/340893437.db2.gz ZQSWRKIUSUZULJ-MRXNPFEDSA-N 0 0 320.392 5.031 20 0 DKADRN CCCC(=O)Nc1cccc(N[C@H](CCC)c2ccccc2)c1C ZINC000539627094 340893429 /nfs/dbraw/zinc/89/34/29/340893429.db2.gz KSSIQVASMRSICM-HXUWFJFHSA-N 0 0 324.468 5.687 20 0 DKADRN CCC(C)(C)OCc1cccc(N[C@@H](C)c2nccs2)c1C ZINC000539627814 340893452 /nfs/dbraw/zinc/89/34/52/340893452.db2.gz MCRMGDOLBVWWMO-AWEZNQCLSA-N 0 0 318.486 5.330 20 0 DKADRN CCC(C)(C)OCc1cccc(N[C@@H](C)c2ccco2)c1C ZINC000539628016 340893438 /nfs/dbraw/zinc/89/34/38/340893438.db2.gz VHNMZGLSFDLBJP-HNNXBMFYSA-N 0 0 301.430 5.466 20 0 DKADRN CCC(C)(C)OCc1cccc(N[C@H](C)c2ccco2)c1C ZINC000539628017 340893469 /nfs/dbraw/zinc/89/34/69/340893469.db2.gz VHNMZGLSFDLBJP-OAHLLOKOSA-N 0 0 301.430 5.466 20 0 DKADRN CCOc1ccccc1[C@@H](C)Nc1ccc(COC(C)C)cc1 ZINC000539630395 340893566 /nfs/dbraw/zinc/89/35/66/340893566.db2.gz PPHZMVPZEQLMKE-MRXNPFEDSA-N 0 0 313.441 5.183 20 0 DKADRN CCOc1ccc([C@H](C)Nc2cscc2C)cc1OCC ZINC000539649685 340894192 /nfs/dbraw/zinc/89/41/92/340894192.db2.gz FGQDBFNVDZMAHN-ZDUSSCGKSA-N 0 0 305.443 5.027 20 0 DKADRN C[C@H](Nc1ccc2nc(C3CC3)oc2c1)c1ccc(F)c(F)c1 ZINC000539649929 340894113 /nfs/dbraw/zinc/89/41/13/340894113.db2.gz CWBSJPOPNDJZED-JTQLQIEISA-N 0 0 314.335 5.157 20 0 DKADRN Cc1nc(-c2cccc(N[C@H](C)c3ccccc3C)c2)oc1C ZINC000539650557 340894246 /nfs/dbraw/zinc/89/42/46/340894246.db2.gz ABHPAFDRKYCNSQ-OAHLLOKOSA-N 0 0 306.409 5.440 20 0 DKADRN CCOCc1cccc(N[C@H](C)c2ccc(SC)c(F)c2)c1 ZINC000539651565 340894309 /nfs/dbraw/zinc/89/43/09/340894309.db2.gz UTSREYGHBNXNBQ-CYBMUJFWSA-N 0 0 319.445 5.257 20 0 DKADRN CCOCc1cccc(N[C@@H](C)c2ccc(SC)c(F)c2)c1 ZINC000539651566 340894274 /nfs/dbraw/zinc/89/42/74/340894274.db2.gz UTSREYGHBNXNBQ-ZDUSSCGKSA-N 0 0 319.445 5.257 20 0 DKADRN Cc1cscc1N[C@H](C)c1ccc(OCC(F)(F)F)cc1 ZINC000539651726 331954687 /nfs/dbraw/zinc/95/46/87/331954687.db2.gz SIHGKGZQZPHDKQ-LLVKDONJSA-N 0 0 315.360 5.171 20 0 DKADRN Cc1ccsc1[C@@H](C)Nc1cccc(-c2nc(C)c(C)o2)c1 ZINC000539651885 340894376 /nfs/dbraw/zinc/89/43/76/340894376.db2.gz XMGXXHRGWZQOCK-CYBMUJFWSA-N 0 0 312.438 5.501 20 0 DKADRN Cc1ccsc1[C@H](C)Nc1cccc(-c2nc(C)c(C)o2)c1 ZINC000539651886 340894375 /nfs/dbraw/zinc/89/43/75/340894375.db2.gz XMGXXHRGWZQOCK-ZDUSSCGKSA-N 0 0 312.438 5.501 20 0 DKADRN CCOCc1cccc(N[C@@H](c2ccc(OC)cc2)C(C)C)c1 ZINC000539652162 340894380 /nfs/dbraw/zinc/89/43/80/340894380.db2.gz LDILEQDFTCQHKO-HXUWFJFHSA-N 0 0 313.441 5.041 20 0 DKADRN CCOCc1cccc(N[C@@H](C)c2ccc(F)cc2Cl)c1 ZINC000539652380 340894383 /nfs/dbraw/zinc/89/43/83/340894383.db2.gz XJSSMAAZGAKFJT-LBPRGKRZSA-N 0 0 307.796 5.189 20 0 DKADRN Cc1nc(-c2cccc(N[C@@H](c3ccccc3)C3CC3)c2)oc1C ZINC000539652449 340894458 /nfs/dbraw/zinc/89/44/58/340894458.db2.gz AVDHSSZBBISUJS-FQEVSTJZSA-N 0 0 318.420 5.522 20 0 DKADRN Cc1nc(-c2cccc(N[C@H](c3ccccc3)C3CC3)c2)oc1C ZINC000539652450 340894332 /nfs/dbraw/zinc/89/43/32/340894332.db2.gz AVDHSSZBBISUJS-HXUWFJFHSA-N 0 0 318.420 5.522 20 0 DKADRN CCOCc1ccc(N[C@@H](CC)c2ccc(F)cc2F)cc1 ZINC000539652660 340894328 /nfs/dbraw/zinc/89/43/28/340894328.db2.gz BCBNCOMOFJHCIR-SFHVURJKSA-N 0 0 305.368 5.065 20 0 DKADRN Cc1ccc(N[C@H](CC(C)C)c2ccccn2)cc1OC(F)F ZINC000539652673 340894365 /nfs/dbraw/zinc/89/43/65/340894365.db2.gz BMNYMCSLGCAQJR-MRXNPFEDSA-N 0 0 320.383 5.191 20 0 DKADRN FC(F)(F)Cc1ccc(N[C@H]2CCCOc3ccccc32)cc1 ZINC000539652713 340894445 /nfs/dbraw/zinc/89/44/45/340894445.db2.gz CSBXAIRPLUJCQQ-INIZCTEOSA-N 0 0 321.342 5.117 20 0 DKADRN FC(F)(F)Cc1ccc(N[C@@H]2CCCOc3ccccc32)cc1 ZINC000539652718 340894391 /nfs/dbraw/zinc/89/43/91/340894391.db2.gz CSBXAIRPLUJCQQ-MRXNPFEDSA-N 0 0 321.342 5.117 20 0 DKADRN CCOCc1ccc(N[C@@H]2CC3(CCC3)Oc3ccccc32)cc1 ZINC000539653273 340894602 /nfs/dbraw/zinc/89/46/02/340894602.db2.gz TVELIDBHDSKTOZ-LJQANCHMSA-N 0 0 323.436 5.082 20 0 DKADRN C[C@@H](Nc1ccc(CC(F)(F)F)cc1)c1cccc(F)c1F ZINC000539653662 340894471 /nfs/dbraw/zinc/89/44/71/340894471.db2.gz VQGKXRNKJKJBCN-SNVBAGLBSA-N 0 0 315.285 5.243 20 0 DKADRN Cc1nc(C(C)C)sc1[C@@H](C)Nc1cccc2c1OCCC2 ZINC000539654297 340894487 /nfs/dbraw/zinc/89/44/87/340894487.db2.gz ZFJIZPJPUPEUCG-GFCCVEGCSA-N 0 0 316.470 5.073 20 0 DKADRN Cc1nc(C(C)C)sc1[C@H](C)Nc1cccc2c1OCCC2 ZINC000539654299 340894473 /nfs/dbraw/zinc/89/44/73/340894473.db2.gz ZFJIZPJPUPEUCG-LBPRGKRZSA-N 0 0 316.470 5.073 20 0 DKADRN CCOCc1ccc(N[C@@H](C)c2ccccc2C(F)(F)F)cc1 ZINC000539655226 340894626 /nfs/dbraw/zinc/89/46/26/340894626.db2.gz NPLTZKVRZJCMPX-ZDUSSCGKSA-N 0 0 323.358 5.415 20 0 DKADRN C[C@@H](Nc1ccccc1OCC(F)F)c1ccc(Cl)s1 ZINC000539655253 340894625 /nfs/dbraw/zinc/89/46/25/340894625.db2.gz NVXGLTJGRRBAHU-SECBINFHSA-N 0 0 317.788 5.219 20 0 DKADRN CCn1cc([C@H](C)Nc2cccc(CSC(C)C)c2C)cn1 ZINC000539655880 340894844 /nfs/dbraw/zinc/89/48/44/340894844.db2.gz RBSXBNOOKWCQAB-HNNXBMFYSA-N 0 0 317.502 5.026 20 0 DKADRN C[C@H](Nc1ccc(CC(F)(F)F)cc1)c1ccc(F)c(F)c1 ZINC000539655976 340894745 /nfs/dbraw/zinc/89/47/45/340894745.db2.gz ZVACXQGHIIOXDC-JTQLQIEISA-N 0 0 315.285 5.243 20 0 DKADRN Cc1c(CSC(C)C)cccc1N[C@H](C)c1cncc(F)c1 ZINC000539656104 340894782 /nfs/dbraw/zinc/89/47/82/340894782.db2.gz SJIIHLIPOQBZRJ-CQSZACIVSA-N 0 0 318.461 5.344 20 0 DKADRN Cc1ccncc1[C@@H](C)Nc1cccc(CSC(C)C)c1C ZINC000539656628 340894751 /nfs/dbraw/zinc/89/47/51/340894751.db2.gz FPDCMNNAMRADST-MRXNPFEDSA-N 0 0 314.498 5.513 20 0 DKADRN Cc1c(COc2ccccc2)cccc1N[C@@H](C)c1cccnc1 ZINC000539656651 340894741 /nfs/dbraw/zinc/89/47/41/340894741.db2.gz GIPSMHMSDFHIOC-KRWDZBQOSA-N 0 0 318.420 5.142 20 0 DKADRN Cc1c(COC(C)(C)C)cccc1N[C@H](C)c1cncc(F)c1 ZINC000539656760 340894916 /nfs/dbraw/zinc/89/49/16/340894916.db2.gz KHKLAFQZNQVTMP-CQSZACIVSA-N 0 0 316.420 5.017 20 0 DKADRN CCc1nc2c(s1)[C@H](Nc1cccc(SC)c1C)CCC2 ZINC000539682404 340895815 /nfs/dbraw/zinc/89/58/15/340895815.db2.gz NMVFTZLKJXHMPX-CYBMUJFWSA-N 0 0 318.511 5.225 20 0 DKADRN CCc1nc2c(s1)[C@@H](Nc1cccc(SC)c1C)CCC2 ZINC000539682406 340895811 /nfs/dbraw/zinc/89/58/11/340895811.db2.gz NMVFTZLKJXHMPX-ZDUSSCGKSA-N 0 0 318.511 5.225 20 0 DKADRN CSc1cccc(N[C@H](C)c2ccc(-n3ccnc3)cc2)c1C ZINC000539682587 340895873 /nfs/dbraw/zinc/89/58/73/340895873.db2.gz SKVRFYFWPZGGOY-OAHLLOKOSA-N 0 0 323.465 5.076 20 0 DKADRN CSc1ccc(C)c(N[C@@H](C)c2ccc(-n3ccnc3)cc2)c1 ZINC000539682611 340895870 /nfs/dbraw/zinc/89/58/70/340895870.db2.gz UBMMXSGHKRVFSF-HNNXBMFYSA-N 0 0 323.465 5.076 20 0 DKADRN COc1cc([C@@H](C)Nc2ccc(F)c(C)c2)ccc1SC ZINC000539688743 340896072 /nfs/dbraw/zinc/89/60/72/340896072.db2.gz UGIYWNVYOSHPOE-GFCCVEGCSA-N 0 0 305.418 5.038 20 0 DKADRN Cc1nn(C)c(C)c1N[C@H](C)c1cc2c(ccc3ccccc23)o1 ZINC000539714852 340896860 /nfs/dbraw/zinc/89/68/60/340896860.db2.gz PMLGFZROAYFFLN-GFCCVEGCSA-N 0 0 319.408 5.109 20 0 DKADRN COc1ccccc1[C@@H](C)Nc1ccc(CCC(F)(F)F)cc1 ZINC000539717155 340896994 /nfs/dbraw/zinc/89/69/94/340896994.db2.gz FNWNDFJIAGOZPC-CYBMUJFWSA-N 0 0 323.358 5.363 20 0 DKADRN COc1ccccc1[C@H](C)Nc1ccc(CCC(F)(F)F)cc1 ZINC000539717160 340896998 /nfs/dbraw/zinc/89/69/98/340896998.db2.gz FNWNDFJIAGOZPC-ZDUSSCGKSA-N 0 0 323.358 5.363 20 0 DKADRN C[C@@H](Nc1ccc(CCC(F)(F)F)cc1)c1ccccc1F ZINC000539718888 340897108 /nfs/dbraw/zinc/89/71/08/340897108.db2.gz UQBPRPVKWRYPNI-GFCCVEGCSA-N 0 0 311.322 5.494 20 0 DKADRN C[C@H](Nc1ccc(CCC(F)(F)F)cc1)c1ccccc1F ZINC000539718889 340897107 /nfs/dbraw/zinc/89/71/07/340897107.db2.gz UQBPRPVKWRYPNI-LBPRGKRZSA-N 0 0 311.322 5.494 20 0 DKADRN CCCOc1ccc(C(F)(F)F)cc1N[C@H](C)c1cccnc1 ZINC000539719524 340897112 /nfs/dbraw/zinc/89/71/12/340897112.db2.gz NGWQNQNPRMNFPE-GFCCVEGCSA-N 0 0 324.346 5.062 20 0 DKADRN CC(=O)Nc1ccc(N[C@@H](c2cc3ccccc3o2)C(C)C)cc1 ZINC000539723970 340897306 /nfs/dbraw/zinc/89/73/06/340897306.db2.gz TVJSRFHRXNLQQR-HXUWFJFHSA-N 0 0 322.408 5.200 20 0 DKADRN COc1cc([C@@H](C)Nc2ccc(C)cc2C)ccc1OC(F)F ZINC000539724255 340897351 /nfs/dbraw/zinc/89/73/51/340897351.db2.gz YNDCJCVLGNWTAY-CYBMUJFWSA-N 0 0 321.367 5.087 20 0 DKADRN Cc1ccc([C@@H](C)Nc2ccc(COCc3ccccc3)cc2)o1 ZINC000539725384 340897466 /nfs/dbraw/zinc/89/74/66/340897466.db2.gz KFJYCBAOYXNWFJ-QGZVFWFLSA-N 0 0 321.420 5.478 20 0 DKADRN Cc1ncc([C@@H](C)Nc2cccc(Oc3ccccc3)c2)c(C)n1 ZINC000539725977 340897413 /nfs/dbraw/zinc/89/74/13/340897413.db2.gz UHXVRNKWCDRXMX-OAHLLOKOSA-N 0 0 319.408 5.059 20 0 DKADRN CC(C)C[C@H](NCc1ncc(Cl)cc1Cl)c1ccccc1 ZINC000539727413 340897381 /nfs/dbraw/zinc/89/73/81/340897381.db2.gz LGAJFCQMWJCFRE-INIZCTEOSA-N 0 0 323.267 5.265 20 0 DKADRN Cc1cccc(COc2cccc(N[C@H](C)c3cscn3)c2)c1 ZINC000539727636 340897629 /nfs/dbraw/zinc/89/76/29/340897629.db2.gz NFBGLLYKPMLUBH-OAHLLOKOSA-N 0 0 324.449 5.204 20 0 DKADRN C[C@H](Nc1ccc(COCc2ccccc2)cc1)c1cscn1 ZINC000539727769 340897569 /nfs/dbraw/zinc/89/75/69/340897569.db2.gz RJIQFDAWJIYWDI-HNNXBMFYSA-N 0 0 324.449 5.033 20 0 DKADRN C[C@@H](Nc1ccc(COCc2ccccc2)cc1)c1cscn1 ZINC000539727770 340897641 /nfs/dbraw/zinc/89/76/41/340897641.db2.gz RJIQFDAWJIYWDI-OAHLLOKOSA-N 0 0 324.449 5.033 20 0 DKADRN Cc1cccc(COc2cccc(N[C@H](C)c3ccncc3)c2)c1 ZINC000539727811 340897540 /nfs/dbraw/zinc/89/75/40/340897540.db2.gz UYSRSPKYXVTFTC-QGZVFWFLSA-N 0 0 318.420 5.142 20 0 DKADRN COc1cc([C@H](C)Nc2cccc3ccncc32)ccc1SC ZINC000539728342 340897587 /nfs/dbraw/zinc/89/75/87/340897587.db2.gz GMFAENSSOFGRQA-ZDUSSCGKSA-N 0 0 324.449 5.138 20 0 DKADRN C[C@@H](Nc1cccc(-c2nccs2)c1)c1ccc2c(c1)COC2 ZINC000539732566 340897640 /nfs/dbraw/zinc/89/76/40/340897640.db2.gz BYYADYQLYCPVQH-CYBMUJFWSA-N 0 0 322.433 5.013 20 0 DKADRN C[C@H](Nc1cccc(-c2nccs2)c1)c1ccc2c(c1)COC2 ZINC000539732572 340897536 /nfs/dbraw/zinc/89/75/36/340897536.db2.gz BYYADYQLYCPVQH-ZDUSSCGKSA-N 0 0 322.433 5.013 20 0 DKADRN CSCc1ccc(N[C@@H](C)c2cc(F)c(F)c(F)c2)cc1 ZINC000539732896 332199352 /nfs/dbraw/zinc/19/93/52/332199352.db2.gz AAYHXQLYRJVFOP-JTQLQIEISA-N 0 0 311.372 5.140 20 0 DKADRN CSCc1ccc(N[C@H](C)c2cc(F)c(F)c(F)c2)cc1 ZINC000539732899 332200103 /nfs/dbraw/zinc/20/01/03/332200103.db2.gz AAYHXQLYRJVFOP-SNVBAGLBSA-N 0 0 311.372 5.140 20 0 DKADRN C[C@H](Nc1ccc2oc(CC(C)(C)C)nc2c1)c1nccs1 ZINC000539733003 340897663 /nfs/dbraw/zinc/89/76/63/340897663.db2.gz BUUBAWDOONAZQF-NSHDSACASA-N 0 0 315.442 5.046 20 0 DKADRN CC[C@@H](C)Sc1ccc(N[C@@H](C)c2nccs2)c(C)c1 ZINC000539733621 340897710 /nfs/dbraw/zinc/89/77/10/340897710.db2.gz JIUPPQSTHBHKEM-OLZOCXBDSA-N 0 0 306.500 5.515 20 0 DKADRN CC[C@H](C)Sc1ccc(N[C@H](C)c2nccs2)c(C)c1 ZINC000539733623 340897600 /nfs/dbraw/zinc/89/76/00/340897600.db2.gz JIUPPQSTHBHKEM-QWHCGFSZSA-N 0 0 306.500 5.515 20 0 DKADRN CC[C@H](C)Sc1ccc(N[C@@H](C)c2nccs2)c(C)c1 ZINC000539733624 340897565 /nfs/dbraw/zinc/89/75/65/340897565.db2.gz JIUPPQSTHBHKEM-STQMWFEESA-N 0 0 306.500 5.515 20 0 DKADRN CSc1ccc(Cl)cc1N[C@H](C)c1sc(C)nc1C ZINC000539733703 340897652 /nfs/dbraw/zinc/89/76/52/340897652.db2.gz NRLIRNMGFGBAAN-SECBINFHSA-N 0 0 312.891 5.308 20 0 DKADRN CSc1ccc(Cl)cc1N[C@@H](C)c1sc(C)nc1C ZINC000539733707 340897745 /nfs/dbraw/zinc/89/77/45/340897745.db2.gz NRLIRNMGFGBAAN-VIFPVBQESA-N 0 0 312.891 5.308 20 0 DKADRN C[C@H](Nc1cccc(CO[C@@H]2CCC[C@@H](C)C2)c1)c1ccncc1 ZINC000539734830 340897763 /nfs/dbraw/zinc/89/77/63/340897763.db2.gz KPBCBTIEXHCMFX-LLGFUMIMSA-N 0 0 324.468 5.350 20 0 DKADRN C[C@H](Nc1cccc(CO[C@H]2CCC[C@@H](C)C2)c1)c1ccncc1 ZINC000539734832 340897871 /nfs/dbraw/zinc/89/78/71/340897871.db2.gz KPBCBTIEXHCMFX-WWMYMODYSA-N 0 0 324.468 5.350 20 0 DKADRN CSCc1ccc(N[C@H]2CCSc3ccccc32)cc1 ZINC000539734939 340897852 /nfs/dbraw/zinc/89/78/52/340897852.db2.gz WHAFPDZUENEPSC-INIZCTEOSA-N 0 0 301.480 5.199 20 0 DKADRN CSCc1ccc(N[C@@H]2CCSc3ccccc32)cc1 ZINC000539734941 340897866 /nfs/dbraw/zinc/89/78/66/340897866.db2.gz WHAFPDZUENEPSC-MRXNPFEDSA-N 0 0 301.480 5.199 20 0 DKADRN CC(C)n1ncc2ccc(N[C@H](C)c3ccc(Cl)s3)cc21 ZINC000539735021 340897847 /nfs/dbraw/zinc/89/78/47/340897847.db2.gz LTDPYIKTIPDKNT-LLVKDONJSA-N 0 0 319.861 5.505 20 0 DKADRN CSc1ccc(N[C@@H]2CCCc3nc(C)sc32)cc1Cl ZINC000539735159 340897872 /nfs/dbraw/zinc/89/78/72/340897872.db2.gz AZMYSXWYPJWNGT-CYBMUJFWSA-N 0 0 324.902 5.316 20 0 DKADRN CSc1ccc(N[C@H]2CCCc3nc(C)sc32)cc1Cl ZINC000539735163 340897761 /nfs/dbraw/zinc/89/77/61/340897761.db2.gz AZMYSXWYPJWNGT-ZDUSSCGKSA-N 0 0 324.902 5.316 20 0 DKADRN CCSc1ccc(Cl)cc1N[C@@H](C)c1ccc(F)cn1 ZINC000539735483 340897859 /nfs/dbraw/zinc/89/78/59/340897859.db2.gz FIWIKWWYASXIEQ-JTQLQIEISA-N 0 0 310.825 5.159 20 0 DKADRN CSCc1ccc(N[C@@H](C)c2nc3c(s2)CCCC3)cc1 ZINC000539735544 340897969 /nfs/dbraw/zinc/89/79/69/340897969.db2.gz GQMPZQGKMRTXGV-LBPRGKRZSA-N 0 0 318.511 5.058 20 0 DKADRN CSCc1cccc(N[C@@H](CC(C)C)c2ccccn2)c1 ZINC000539735584 340897942 /nfs/dbraw/zinc/89/79/42/340897942.db2.gz HCASPOWREGRHET-SFHVURJKSA-N 0 0 300.471 5.144 20 0 DKADRN Cc1cnc(-c2cccc(N[C@@H]3c4cc(F)ccc4C[C@H]3C)c2)o1 ZINC000539735666 340897943 /nfs/dbraw/zinc/89/79/43/340897943.db2.gz IQWUYYQTKHFOBW-BLVKFPJESA-N 0 0 322.383 5.135 20 0 DKADRN COc1ccc([C@H](C)[C@@H](C)Nc2cccc([C@@H](C)OC)c2)cc1 ZINC000539735847 340897920 /nfs/dbraw/zinc/89/79/20/340897920.db2.gz JXOAFIDYKRDBCP-BZUAXINKSA-N 0 0 313.441 5.007 20 0 DKADRN COc1ccc([C@H](C)[C@@H](C)Nc2cccc([C@H](C)OC)c2)cc1 ZINC000539735848 340897874 /nfs/dbraw/zinc/89/78/74/340897874.db2.gz JXOAFIDYKRDBCP-OAGGEKHMSA-N 0 0 313.441 5.007 20 0 DKADRN COc1ccc([C@H](C)[C@H](C)Nc2cccc([C@H](C)OC)c2)cc1 ZINC000539735851 340897948 /nfs/dbraw/zinc/89/79/48/340897948.db2.gz JXOAFIDYKRDBCP-PMPSAXMXSA-N 0 0 313.441 5.007 20 0 DKADRN Fc1ccc2c(c1)[C@@H](Nc1cccc(-c3nccs3)c1)CC2 ZINC000539735876 340897934 /nfs/dbraw/zinc/89/79/34/340897934.db2.gz WXJIJMAFJFXCST-KRWDZBQOSA-N 0 0 310.397 5.049 20 0 DKADRN CCc1nc2c(s1)[C@H](Nc1cccc(CSC)c1)CCC2 ZINC000539735878 340897906 /nfs/dbraw/zinc/89/79/06/340897906.db2.gz KTQFPIFJYUKBFD-CQSZACIVSA-N 0 0 318.511 5.058 20 0 DKADRN Fc1ccc2c(c1)[C@H](Nc1cccc(-c3nccs3)c1)CC2 ZINC000539735880 340897916 /nfs/dbraw/zinc/89/79/16/340897916.db2.gz WXJIJMAFJFXCST-QGZVFWFLSA-N 0 0 310.397 5.049 20 0 DKADRN C[C@@H](Nc1ccc(-c2cn3c(n2)CCCC3)cc1)c1ccccc1 ZINC000539735899 340897975 /nfs/dbraw/zinc/89/79/75/340897975.db2.gz LPHKYDBFGFWARM-MRXNPFEDSA-N 0 0 317.436 5.060 20 0 DKADRN CCSc1ccc(Cl)cc1N[C@H](C)c1cnc(C)nc1C ZINC000539735913 340897959 /nfs/dbraw/zinc/89/79/59/340897959.db2.gz MGFBUWXACXKXBF-LLVKDONJSA-N 0 0 321.877 5.032 20 0 DKADRN CCSc1ccc(Cl)cc1N[C@@H](C)c1cnc(C)nc1C ZINC000539735915 340897909 /nfs/dbraw/zinc/89/79/09/340897909.db2.gz MGFBUWXACXKXBF-NSHDSACASA-N 0 0 321.877 5.032 20 0 DKADRN Cc1ccc([C@@H](C)Nc2cccc(OCc3cscn3)c2)cc1 ZINC000539735944 340897963 /nfs/dbraw/zinc/89/79/63/340897963.db2.gz VXDHPYOPLGCNKP-OAHLLOKOSA-N 0 0 324.449 5.204 20 0 DKADRN CSc1ccc(Cl)cc1N[C@H](C)c1ccc2c(c1)COC2 ZINC000539736083 340897876 /nfs/dbraw/zinc/89/78/76/340897876.db2.gz XWCYFEUBZJECGD-LLVKDONJSA-N 0 0 319.857 5.265 20 0 DKADRN CSc1ccc(Cl)cc1N[C@@H](C)c1ccc2c(c1)COC2 ZINC000539736084 340897970 /nfs/dbraw/zinc/89/79/70/340897970.db2.gz XWCYFEUBZJECGD-NSHDSACASA-N 0 0 319.857 5.265 20 0 DKADRN c1csc(-c2cccc(N[C@H]3CCCOc4ccccc43)c2)n1 ZINC000539736129 340897967 /nfs/dbraw/zinc/89/79/67/340897967.db2.gz ZDJISMKVXZJPHJ-KRWDZBQOSA-N 0 0 322.433 5.136 20 0 DKADRN CSCc1cccc(N[C@H](C)c2ccc3ccccc3n2)c1 ZINC000539736240 340897936 /nfs/dbraw/zinc/89/79/36/340897936.db2.gz PTEDCCGEZWLYMP-CQSZACIVSA-N 0 0 308.450 5.271 20 0 DKADRN CSCc1ccc(N[C@H](CC(C)C)c2ccccn2)cc1 ZINC000539736316 340897915 /nfs/dbraw/zinc/89/79/15/340897915.db2.gz SUWCZKYMSLKXRN-GOSISDBHSA-N 0 0 300.471 5.144 20 0 DKADRN CCSc1ccc(Cl)cc1N[C@H](C)c1cnn(C(C)C)c1 ZINC000539736442 340898090 /nfs/dbraw/zinc/89/80/90/340898090.db2.gz ZAEQGUHULRLCBA-GFCCVEGCSA-N 0 0 323.893 5.403 20 0 DKADRN Cc1ccc(N[C@@H]2CCc3cc(Cl)ccc32)cc1-c1ncco1 ZINC000539737244 340898011 /nfs/dbraw/zinc/89/80/11/340898011.db2.gz MEPULVYTGAPXRH-GOSISDBHSA-N 0 0 324.811 5.403 20 0 DKADRN Cc1ccsc1[C@@H](C)Nc1ccc(-c2cnc(C3CC3)o2)cc1 ZINC000539737829 340898155 /nfs/dbraw/zinc/89/81/55/340898155.db2.gz ACYBCXAVKMAKDX-CYBMUJFWSA-N 0 0 324.449 5.762 20 0 DKADRN C[C@H](Nc1ccc(-c2cnc(C3CC3)o2)cc1)c1ccccc1F ZINC000539738881 340898100 /nfs/dbraw/zinc/89/81/00/340898100.db2.gz NMHSIFGMNDEWNJ-ZDUSSCGKSA-N 0 0 322.383 5.531 20 0 DKADRN C[C@H](Nc1cccc(CC(F)(F)F)c1)c1ccccc1N(C)C ZINC000539738896 340898099 /nfs/dbraw/zinc/89/80/99/340898099.db2.gz LITHIGWHUTZCQX-ZDUSSCGKSA-N 0 0 322.374 5.031 20 0 DKADRN C[C@H](Nc1cccc(CSC2CCCC2)c1)c1cccnc1 ZINC000539739111 340898141 /nfs/dbraw/zinc/89/81/41/340898141.db2.gz AXMSBXXUKBAHGL-HNNXBMFYSA-N 0 0 312.482 5.431 20 0 DKADRN CCCC[C@@H](Nc1ccc(C)c(C(=O)N(C)C)c1)c1ccccc1 ZINC000539739188 340898148 /nfs/dbraw/zinc/89/81/48/340898148.db2.gz PEWIYKYNOLRJFC-HXUWFJFHSA-N 0 0 324.468 5.040 20 0 DKADRN Fc1cc(Cl)cc(N[C@H](C[C@H]2CCOC2)c2ccccc2)c1 ZINC000539740686 340898423 /nfs/dbraw/zinc/89/84/23/340898423.db2.gz KNLHBHJWYIHJSR-FZKQIMNGSA-N 0 0 319.807 5.059 20 0 DKADRN Fc1cc(Cl)cc(N[C@H](C[C@@H]2CCOC2)c2ccccc2)c1 ZINC000539740687 340898411 /nfs/dbraw/zinc/89/84/11/340898411.db2.gz KNLHBHJWYIHJSR-SCLBCKFNSA-N 0 0 319.807 5.059 20 0 DKADRN Fc1cc(Cl)cc(N[C@@H](C[C@@H]2CCOC2)c2ccccc2)c1 ZINC000539740688 340898399 /nfs/dbraw/zinc/89/83/99/340898399.db2.gz KNLHBHJWYIHJSR-UGSOOPFHSA-N 0 0 319.807 5.059 20 0 DKADRN Cc1ccc([C@@H](C)Nc2ccc(-c3cnc(C4CC4)o3)cc2)s1 ZINC000539740740 340898420 /nfs/dbraw/zinc/89/84/20/340898420.db2.gz IHUIHEQMPRUICU-CYBMUJFWSA-N 0 0 324.449 5.762 20 0 DKADRN Cc1ccc([C@H](C)Nc2ccc(-c3cnc(C4CC4)o3)cc2)s1 ZINC000539740742 340898327 /nfs/dbraw/zinc/89/83/27/340898327.db2.gz IHUIHEQMPRUICU-ZDUSSCGKSA-N 0 0 324.449 5.762 20 0 DKADRN C[C@H](Nc1cccc(CC(F)(F)F)c1)c1cccc(F)c1F ZINC000539740904 340898400 /nfs/dbraw/zinc/89/84/00/340898400.db2.gz LUCQKXMDCDUAMT-JTQLQIEISA-N 0 0 315.285 5.243 20 0 DKADRN C[C@@H](Nc1cccc(CC(F)(F)F)c1)c1cccc(F)c1F ZINC000539740906 340898396 /nfs/dbraw/zinc/89/83/96/340898396.db2.gz LUCQKXMDCDUAMT-SNVBAGLBSA-N 0 0 315.285 5.243 20 0 DKADRN FC(F)(F)Cc1cccc(N[C@H]2CCCOc3ccccc32)c1 ZINC000539741446 340898482 /nfs/dbraw/zinc/89/84/82/340898482.db2.gz RNMGLLYGZZTIEB-INIZCTEOSA-N 0 0 321.342 5.117 20 0 DKADRN FC(F)(F)Cc1cccc(N[C@@H]2CCCOc3ccccc32)c1 ZINC000539741449 340898446 /nfs/dbraw/zinc/89/84/46/340898446.db2.gz RNMGLLYGZZTIEB-MRXNPFEDSA-N 0 0 321.342 5.117 20 0 DKADRN Cc1ccc(N[C@@H](C)c2nc3c(s2)CCCC3)c2cccnc12 ZINC000539741924 340898483 /nfs/dbraw/zinc/89/84/83/340898483.db2.gz TUYBRKHWAKBIOG-ZDUSSCGKSA-N 0 0 323.465 5.052 20 0 DKADRN CCCOc1ccc(Cl)cc1N[C@@H](C)c1cnccc1C ZINC000539742427 340898449 /nfs/dbraw/zinc/89/84/49/340898449.db2.gz YWDQCQXZBNNYOE-ZDUSSCGKSA-N 0 0 304.821 5.005 20 0 DKADRN CCCC[C@@H](CCC)NC(=O)c1c(Cl)cccc1Cl ZINC000539757933 340898910 /nfs/dbraw/zinc/89/89/10/340898910.db2.gz IXBLKVIYDIRZQF-LLVKDONJSA-N 0 0 302.245 5.082 20 0 DKADRN CCCC[C@H](CCC)NC(=O)c1c(Cl)cccc1Cl ZINC000539757934 340898962 /nfs/dbraw/zinc/89/89/62/340898962.db2.gz IXBLKVIYDIRZQF-NSHDSACASA-N 0 0 302.245 5.082 20 0 DKADRN CCn1c2ccccc2nc1S[C@H](C)c1nc2ccccc2o1 ZINC000539759719 340898905 /nfs/dbraw/zinc/89/89/05/340898905.db2.gz QFEVXVJJVFMCFK-GFCCVEGCSA-N 0 0 323.421 5.051 20 0 DKADRN CCn1c2ccccc2nc1S[C@@H](C)c1nc2ccccc2o1 ZINC000539759720 340898955 /nfs/dbraw/zinc/89/89/55/340898955.db2.gz QFEVXVJJVFMCFK-LBPRGKRZSA-N 0 0 323.421 5.051 20 0 DKADRN CCOc1cc(Cl)ccc1N[C@@H](C)c1nc2ccccc2o1 ZINC000539772939 340899351 /nfs/dbraw/zinc/89/93/51/340899351.db2.gz JASPNORBCZSNTG-NSHDSACASA-N 0 0 316.788 5.053 20 0 DKADRN O=C(CCCC(F)(F)F)Nc1cccc(-c2cccs2)c1 ZINC000539942092 340910456 /nfs/dbraw/zinc/91/04/56/340910456.db2.gz BTCOHELITSQMIH-UHFFFAOYSA-N 0 0 313.344 5.086 20 0 DKADRN Cc1ccc(-c2nc(CS[C@H](C)c3ncc(C)o3)cs2)o1 ZINC000539949366 340910690 /nfs/dbraw/zinc/91/06/90/340910690.db2.gz BROOSSZQWXBMMU-LLVKDONJSA-N 0 0 320.439 5.002 20 0 DKADRN Cc1cnc([C@H](C)SCc2csc(CCC(C)C)n2)o1 ZINC000539951719 340910803 /nfs/dbraw/zinc/91/08/03/340910803.db2.gz WXYXAYWXLIBVNO-LBPRGKRZSA-N 0 0 310.488 5.023 20 0 DKADRN CC(C)Sc1ccc(Cl)cc1N[C@H](C)c1ccccn1 ZINC000539955812 340910925 /nfs/dbraw/zinc/91/09/25/340910925.db2.gz XDSCYFSUHBMMSR-GFCCVEGCSA-N 0 0 306.862 5.409 20 0 DKADRN Cc1cnc([C@@H](C)Nc2ccc3nc(C(C)(C)C)sc3c2)o1 ZINC000539976757 340911577 /nfs/dbraw/zinc/91/15/77/340911577.db2.gz YUWGBPNRLBLXHH-LLVKDONJSA-N 0 0 315.442 5.063 20 0 DKADRN Cc1cnc([C@H](C)Nc2ccc3nc(C(C)(C)C)sc3c2)o1 ZINC000539976758 340911562 /nfs/dbraw/zinc/91/15/62/340911562.db2.gz YUWGBPNRLBLXHH-NSHDSACASA-N 0 0 315.442 5.063 20 0 DKADRN CC[C@H]1CC[C@@H](C)N1C(=O)Nc1c(C(C)C)cccc1C(C)C ZINC000540065529 340913904 /nfs/dbraw/zinc/91/39/04/340913904.db2.gz PVCHODPQEBNJBH-CVEARBPZSA-N 0 0 316.489 5.728 20 0 DKADRN CC[C@@H]1CC[C@@H](C)N1C(=O)Nc1c(C(C)C)cccc1C(C)C ZINC000540065536 340913922 /nfs/dbraw/zinc/91/39/22/340913922.db2.gz PVCHODPQEBNJBH-HZPDHXFCSA-N 0 0 316.489 5.728 20 0 DKADRN CC[C@@H](N[C@H](C)c1ccc(F)cc1F)c1cc(F)ccc1F ZINC000540155148 340918233 /nfs/dbraw/zinc/91/82/33/340918233.db2.gz BSTBYEMKCYROFJ-BMLIUANNSA-N 0 0 311.322 5.045 20 0 DKADRN CC[C@H](N[C@H](C)c1ccc(F)cc1F)c1cc(F)ccc1F ZINC000540155149 333079136 /nfs/dbraw/zinc/07/91/36/333079136.db2.gz BSTBYEMKCYROFJ-QGHHPUGFSA-N 0 0 311.322 5.045 20 0 DKADRN C[C@@H](NCc1nc(C2CC2)cs1)c1ccccc1C(C)(C)C ZINC000540159127 340918794 /nfs/dbraw/zinc/91/87/94/340918794.db2.gz WUKAESJAFXBGPF-CYBMUJFWSA-N 0 0 314.498 5.169 20 0 DKADRN C[C@H](NCc1nc(C2CC2)cs1)c1ccccc1C(C)(C)C ZINC000540159128 340918833 /nfs/dbraw/zinc/91/88/33/340918833.db2.gz WUKAESJAFXBGPF-ZDUSSCGKSA-N 0 0 314.498 5.169 20 0 DKADRN CC[C@@H](N[C@H](C)c1cc(F)ccc1F)c1cc(F)ccc1F ZINC000540178947 340921033 /nfs/dbraw/zinc/92/10/33/340921033.db2.gz JTHYTJIMQDWGAD-BMLIUANNSA-N 0 0 311.322 5.045 20 0 DKADRN CC[C@H](N[C@@H](C)c1cc(F)ccc1F)c1cc(F)ccc1F ZINC000540178948 340921003 /nfs/dbraw/zinc/92/10/03/340921003.db2.gz JTHYTJIMQDWGAD-BTDLBPIBSA-N 0 0 311.322 5.045 20 0 DKADRN CCc1ccc([C@H](CC)NCc2coc(-c3ccccc3)n2)cc1 ZINC000540178960 340921038 /nfs/dbraw/zinc/92/10/38/340921038.db2.gz KBTNKECNLQQPIN-FQEVSTJZSA-N 0 0 320.436 5.145 20 0 DKADRN CC[C@H](N[C@@H](C)c1ccc(F)cc1F)c1cc(F)ccc1F ZINC000540180056 340921133 /nfs/dbraw/zinc/92/11/33/340921133.db2.gz BSTBYEMKCYROFJ-BTDLBPIBSA-N 0 0 311.322 5.045 20 0 DKADRN CS[C@H](C)CCC(=O)N1CCC[C@@H]1c1ccc(C(C)C)cc1 ZINC000540201787 340923130 /nfs/dbraw/zinc/92/31/30/340923130.db2.gz JDHZGUQGUXNSIO-CRAIPNDOSA-N 0 0 319.514 5.005 20 0 DKADRN CS[C@H](C)CCC(=O)N1CCC[C@H]1c1ccc(C(C)C)cc1 ZINC000540201789 340923075 /nfs/dbraw/zinc/92/30/75/340923075.db2.gz JDHZGUQGUXNSIO-QAPCUYQASA-N 0 0 319.514 5.005 20 0 DKADRN CS[C@@H](C)CCC(=O)N1CCC[C@H]1c1ccc(C(C)C)cc1 ZINC000540201790 340923038 /nfs/dbraw/zinc/92/30/38/340923038.db2.gz JDHZGUQGUXNSIO-YJBOKZPZSA-N 0 0 319.514 5.005 20 0 DKADRN CSc1cccc(NCc2cnc(C3CCC3)s2)c1C ZINC000540325494 340927127 /nfs/dbraw/zinc/92/71/27/340927127.db2.gz LPJDIHJBOGRQAE-UHFFFAOYSA-N 0 0 304.484 5.053 20 0 DKADRN Cc1ccc([C@H](C)NCc2csc(C3CCCCC3)n2)cc1 ZINC000540332825 340927410 /nfs/dbraw/zinc/92/74/10/340927410.db2.gz JKCIHZOQVVXDGN-HNNXBMFYSA-N 0 0 314.498 5.350 20 0 DKADRN CSc1cccc(NCc2nc(C(C)(C)C)cs2)c1C ZINC000540340360 340927659 /nfs/dbraw/zinc/92/76/59/340927659.db2.gz GTORPYIMDWGCGS-UHFFFAOYSA-N 0 0 306.500 5.083 20 0 DKADRN CC(C)c1ccc([C@@H](NCc2ncc(C3CC3)o2)C(C)C)cc1 ZINC000540341972 340927775 /nfs/dbraw/zinc/92/77/75/340927775.db2.gz IASFBXLTIYDRAA-FQEVSTJZSA-N 0 0 312.457 5.162 20 0 DKADRN Cc1ccccc1[C@H](CC(C)C)NCc1ncc(C(C)(C)C)o1 ZINC000540358966 340928465 /nfs/dbraw/zinc/92/84/65/340928465.db2.gz FDTUFPNFJHGFBS-KRWDZBQOSA-N 0 0 314.473 5.158 20 0 DKADRN CCc1cnc(CN[C@H](CC2CCCCC2)c2ccccc2)o1 ZINC000540362131 340928654 /nfs/dbraw/zinc/92/86/54/340928654.db2.gz HJBBOSOBAFPHOU-LJQANCHMSA-N 0 0 312.457 5.038 20 0 DKADRN CCC(CC)[C@@H](NCc1ncc(C(C)(C)C)o1)c1cccs1 ZINC000540380085 340928731 /nfs/dbraw/zinc/92/87/31/340928731.db2.gz NKHISJGMQABMRF-QGZVFWFLSA-N 0 0 320.502 5.301 20 0 DKADRN Cc1cccc([C@H](C)NCc2ncc(-c3ccccc3C)o2)c1C ZINC000540388063 340929087 /nfs/dbraw/zinc/92/90/87/340929087.db2.gz HPJHBIJJJHAGMS-KRWDZBQOSA-N 0 0 320.436 5.118 20 0 DKADRN Cc1cccc([C@@H](C)NCc2ncc(-c3ccccc3C)o2)c1C ZINC000540388064 340929082 /nfs/dbraw/zinc/92/90/82/340929082.db2.gz HPJHBIJJJHAGMS-QGZVFWFLSA-N 0 0 320.436 5.118 20 0 DKADRN CC(C)[C@@H](NCc1ncc(C(C)(C)C)o1)c1ccccc1Cl ZINC000540389767 340929247 /nfs/dbraw/zinc/92/92/47/340929247.db2.gz RYSDKLMMBNJGKB-QGZVFWFLSA-N 0 0 320.864 5.112 20 0 DKADRN Cc1cccc(C)c1NC(=O)N(CC(C)(C)C)CC(C)(C)C ZINC000540401297 340929760 /nfs/dbraw/zinc/92/97/60/340929760.db2.gz UOXLVIXKTZZZMB-UHFFFAOYSA-N 0 0 304.478 5.230 20 0 DKADRN CSc1cccc(NC(=O)Nc2ccc(F)cc2Cl)c1C ZINC000540402164 340929679 /nfs/dbraw/zinc/92/96/79/340929679.db2.gz RBYIEJLMMYLKBT-UHFFFAOYSA-N 0 0 324.808 5.153 20 0 DKADRN Fc1ccc2c(c1)CCC[C@@H]2N[C@H](c1ccco1)c1ccccc1 ZINC000540405925 340929979 /nfs/dbraw/zinc/92/99/79/340929979.db2.gz JNMATZXKCYUMLO-FPOVZHCZSA-N 0 0 321.395 5.175 20 0 DKADRN Fc1ccc2c(c1)CCC[C@@H]2N[C@@H](c1ccco1)c1ccccc1 ZINC000540405926 340929995 /nfs/dbraw/zinc/92/99/95/340929995.db2.gz JNMATZXKCYUMLO-PZJWPPBQSA-N 0 0 321.395 5.175 20 0 DKADRN CCCCN(CCCC)C(=O)Nc1c(F)cc(Cl)cc1F ZINC000540408042 340930048 /nfs/dbraw/zinc/93/00/48/340930048.db2.gz GPXZJDJLLPVOGL-UHFFFAOYSA-N 0 0 318.795 5.052 20 0 DKADRN Cc1cc(C)cc([C@H](C)N[C@H](C)c2ncc(-c3ccccc3)o2)c1 ZINC000540418967 340930507 /nfs/dbraw/zinc/93/05/07/340930507.db2.gz QFGDRZBMBPYBIW-DLBZAZTESA-N 0 0 320.436 5.370 20 0 DKADRN Cc1cc(C)cc([C@H](C)N[C@@H](C)c2ncc(-c3ccccc3)o2)c1 ZINC000540418977 340930520 /nfs/dbraw/zinc/93/05/20/340930520.db2.gz QFGDRZBMBPYBIW-IRXDYDNUSA-N 0 0 320.436 5.370 20 0 DKADRN Cc1ccsc1CCCC(=O)Nc1ccc(-c2ccc[nH]2)cc1 ZINC000540420251 340930678 /nfs/dbraw/zinc/93/06/78/340930678.db2.gz SDJCMSYPDCULOG-UHFFFAOYSA-N 0 0 324.449 5.013 20 0 DKADRN c1ccc([C@@H](CC2CCCC2)NCc2nc3ccccc3o2)cc1 ZINC000540429234 340930939 /nfs/dbraw/zinc/93/09/39/340930939.db2.gz FFSZRRFEHGMELV-LJQANCHMSA-N 0 0 320.436 5.239 20 0 DKADRN CCSc1ccccc1C(=O)Nc1cccc(SC)c1C ZINC000540445408 340931694 /nfs/dbraw/zinc/93/16/94/340931694.db2.gz DZKSZVRIADKRIC-UHFFFAOYSA-N 0 0 317.479 5.081 20 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DKADRN CSc1ccc(C)c(NC(=O)N2CCC[C@H](CC(C)C)C2)c1 ZINC000540523996 340934927 /nfs/dbraw/zinc/93/49/27/340934927.db2.gz BTEVIGGUDSPVPR-OAHLLOKOSA-N 0 0 320.502 5.007 20 0 DKADRN CCC[C@]1(C)CCCN(C(=O)Nc2cc(SC)ccc2C)C1 ZINC000540525249 340934957 /nfs/dbraw/zinc/93/49/57/340934957.db2.gz RLSWCFFMSQIJGM-GOSISDBHSA-N 0 0 320.502 5.151 20 0 DKADRN CSc1cccc(NC(=O)Nc2cc(SC)ccc2C)c1 ZINC000540526403 340934986 /nfs/dbraw/zinc/93/49/86/340934986.db2.gz VITBSCNELQLSHV-UHFFFAOYSA-N 0 0 318.467 5.083 20 0 DKADRN CSc1ccc(C)c(NC(=O)Nc2ccc(Cl)cc2C)c1 ZINC000540538363 333331262 /nfs/dbraw/zinc/33/12/62/333331262.db2.gz WJJBTAKMLFWGOM-UHFFFAOYSA-N 0 0 320.845 5.323 20 0 DKADRN CSc1ccc(C)c(NC(=O)[C@@H](C)c2cccc(Cl)c2)c1 ZINC000540541115 340935490 /nfs/dbraw/zinc/93/54/90/340935490.db2.gz GNCUUBULDCTMFI-LBPRGKRZSA-N 0 0 319.857 5.113 20 0 DKADRN CSc1ccc(C)c(NC(=O)c2cc3sccc3s2)c1 ZINC000540541155 340935506 /nfs/dbraw/zinc/93/55/06/340935506.db2.gz HJTKCZIVRPWRPQ-UHFFFAOYSA-N 0 0 319.476 5.245 20 0 DKADRN CSc1ccc(C)c(NC(=O)c2ccc3[nH]c(C)c(C)c3c2)c1 ZINC000540542127 340935582 /nfs/dbraw/zinc/93/55/82/340935582.db2.gz BLNFHEMTUVEICN-UHFFFAOYSA-N 0 0 324.449 5.067 20 0 DKADRN CCCCCN(C(=O)Nc1cc(SC)ccc1C)C(C)C ZINC000540559497 340936097 /nfs/dbraw/zinc/93/60/97/340936097.db2.gz WQBCEKOQIJIVCQ-UHFFFAOYSA-N 0 0 308.491 5.149 20 0 DKADRN Cc1c(C(=O)Nc2cccc(C)c2F)sc2cccc(F)c12 ZINC000540616828 340939135 /nfs/dbraw/zinc/93/91/35/340939135.db2.gz NRYCPFHLCAEDFU-UHFFFAOYSA-N 0 0 317.360 5.049 20 0 DKADRN CC[C@H](C)n1ncc(NCc2ccc([C@@H]3C[C@@H]3C)o2)c1C1CC1 ZINC000540651228 340940285 /nfs/dbraw/zinc/94/02/85/340940285.db2.gz QDFYDRCADFBHMH-HEHGZKQESA-N 0 0 313.445 5.060 20 0 DKADRN CCOc1cccc(N[C@H](C)c2ccc(-c3ccncc3)cc2)c1 ZINC000540699507 340941954 /nfs/dbraw/zinc/94/19/54/340941954.db2.gz BYCPQKURFWABQM-MRXNPFEDSA-N 0 0 318.420 5.320 20 0 DKADRN CSc1cccc(N[C@H]2CCSc3ccc(F)cc32)c1 ZINC000540709465 340942624 /nfs/dbraw/zinc/94/26/24/340942624.db2.gz FVYHPFUKDFXNHN-HNNXBMFYSA-N 0 0 305.443 5.197 20 0 DKADRN CSc1cccc(N[C@@H]2CCSc3ccc(F)cc32)c1 ZINC000540709466 340942615 /nfs/dbraw/zinc/94/26/15/340942615.db2.gz FVYHPFUKDFXNHN-OAHLLOKOSA-N 0 0 305.443 5.197 20 0 DKADRN CC(=O)Nc1cccc(N[C@@H](C)c2cc(Cl)cc(Cl)c2)c1 ZINC000540709752 340942595 /nfs/dbraw/zinc/94/25/95/340942595.db2.gz STHGRYIVNUIIKT-JTQLQIEISA-N 0 0 323.223 5.125 20 0 DKADRN CC(=O)Nc1cccc(N[C@H](C)c2cc(Cl)cc(Cl)c2)c1 ZINC000540709754 340942632 /nfs/dbraw/zinc/94/26/32/340942632.db2.gz STHGRYIVNUIIKT-SNVBAGLBSA-N 0 0 323.223 5.125 20 0 DKADRN COc1cc([C@@H](C)Nc2ccc(C)c(F)c2)ccc1SC ZINC000540709985 340942742 /nfs/dbraw/zinc/94/27/42/340942742.db2.gz XSRBHDJFOBPFFT-GFCCVEGCSA-N 0 0 305.418 5.038 20 0 DKADRN COc1cc([C@H](C)Nc2ccc(C)c(F)c2)ccc1SC ZINC000540709986 340942751 /nfs/dbraw/zinc/94/27/51/340942751.db2.gz XSRBHDJFOBPFFT-LBPRGKRZSA-N 0 0 305.418 5.038 20 0 DKADRN CSc1cccc(N[C@@H](C)c2ccc(-c3ccncc3)cc2)c1 ZINC000540710082 340942744 /nfs/dbraw/zinc/94/27/44/340942744.db2.gz WWQGEAAFQPODQB-HNNXBMFYSA-N 0 0 320.461 5.644 20 0 DKADRN CSc1cccc(N[C@H](C)c2ccc(-c3ccncc3)cc2)c1 ZINC000540710083 340942720 /nfs/dbraw/zinc/94/27/20/340942720.db2.gz WWQGEAAFQPODQB-OAHLLOKOSA-N 0 0 320.461 5.644 20 0 DKADRN Cc1cccc([C@@H](C)Nc2cc(NC(=O)C3CC3)ccc2C)c1C ZINC000540710260 340942708 /nfs/dbraw/zinc/94/27/08/340942708.db2.gz RRWARHBJXUFCGP-MRXNPFEDSA-N 0 0 322.452 5.133 20 0 DKADRN C[C@@H](Nc1cccc(COCCc2ccccc2)c1)c1ccoc1 ZINC000540724230 340943369 /nfs/dbraw/zinc/94/33/69/340943369.db2.gz BAMQNTDJPHDOPZ-QGZVFWFLSA-N 0 0 321.420 5.212 20 0 DKADRN C[C@@H](Nc1cccc(COCC2CC2)c1)c1cccc(F)c1F ZINC000540724498 340943383 /nfs/dbraw/zinc/94/33/83/340943383.db2.gz QOTYLIZDOQFNRM-CYBMUJFWSA-N 0 0 317.379 5.065 20 0 DKADRN CCCC(=O)Nc1cccc(N[C@H](CC)c2ccc(C)cc2)c1C ZINC000540727085 340943491 /nfs/dbraw/zinc/94/34/91/340943491.db2.gz OKDZWJIXOALBDD-GOSISDBHSA-N 0 0 324.468 5.605 20 0 DKADRN CC(C)C[C@@H](Nc1ccc2oc(C3CC3)nc2c1)c1ccccn1 ZINC000540727366 340943559 /nfs/dbraw/zinc/94/35/59/340943559.db2.gz LJRVVFAZEUGJFB-QGZVFWFLSA-N 0 0 321.424 5.300 20 0 DKADRN CCC(C)(C)OCc1cccc(N[C@@H](C)c2cccnc2)c1C ZINC000540727689 340943653 /nfs/dbraw/zinc/94/36/53/340943653.db2.gz WPLPIXBVWWCSCD-INIZCTEOSA-N 0 0 312.457 5.268 20 0 DKADRN CC[C@H](Nc1ccc(COC(C)C)cc1)c1ccc(OC)cc1 ZINC000540728205 340943654 /nfs/dbraw/zinc/94/36/54/340943654.db2.gz XOOYCFFNUSFKIQ-FQEVSTJZSA-N 0 0 313.441 5.183 20 0 DKADRN CCCC(=O)Nc1cccc(N[C@@H](C)c2cccc(C)c2C)c1C ZINC000540728225 340943657 /nfs/dbraw/zinc/94/36/57/340943657.db2.gz RPJWNJKJBCMGHV-KRWDZBQOSA-N 0 0 324.468 5.524 20 0 DKADRN CCSc1ccccc1[C@H](C)Nc1cccc(COC)c1 ZINC000540734872 333340640 /nfs/dbraw/zinc/34/06/40/333340640.db2.gz ANDSDJFZVFJIGW-AWEZNQCLSA-N 0 0 301.455 5.118 20 0 DKADRN CCSc1ccccc1[C@@H](C)Nc1cccc(COC)c1 ZINC000540734873 333340633 /nfs/dbraw/zinc/34/06/33/333340633.db2.gz ANDSDJFZVFJIGW-CQSZACIVSA-N 0 0 301.455 5.118 20 0 DKADRN COCc1cccc(N[C@H]2CCSc3c(Cl)cccc32)c1 ZINC000540734895 340943853 /nfs/dbraw/zinc/94/38/53/340943853.db2.gz BKDVNKRRNCAIIT-INIZCTEOSA-N 0 0 319.857 5.135 20 0 DKADRN COCc1cccc(N[C@@H]2CCSc3c(Cl)cccc32)c1 ZINC000540734896 340943855 /nfs/dbraw/zinc/94/38/55/340943855.db2.gz BKDVNKRRNCAIIT-MRXNPFEDSA-N 0 0 319.857 5.135 20 0 DKADRN C[C@@H](Nc1ccc(F)c(F)c1)c1ccc(-c2ccncc2)cc1 ZINC000540744894 340944084 /nfs/dbraw/zinc/94/40/84/340944084.db2.gz XBUIAYVWIYZAFN-CYBMUJFWSA-N 0 0 310.347 5.200 20 0 DKADRN CCOCc1cccc(N[C@@H](C)c2ccccc2C(F)(F)F)c1 ZINC000540746247 340944141 /nfs/dbraw/zinc/94/41/41/340944141.db2.gz SZCHFRFNJSKUJH-ZDUSSCGKSA-N 0 0 323.358 5.415 20 0 DKADRN CCCC(CCC)Nc1cccc2c1CN(c1nccs1)C2 ZINC000540747964 340944156 /nfs/dbraw/zinc/94/41/56/340944156.db2.gz LQMMNOHZOLCPPJ-UHFFFAOYSA-N 0 0 315.486 5.044 20 0 DKADRN Cc1ccc([C@@H](C)Nc2cccc(OCC(F)(F)F)c2C)o1 ZINC000540749353 340944330 /nfs/dbraw/zinc/94/43/30/340944330.db2.gz BQFIQVBCCWLBDQ-GFCCVEGCSA-N 0 0 313.319 5.011 20 0 DKADRN C[C@@H](Nc1ccc(CCO)cc1)c1cccc(-c2ccccc2)c1 ZINC000540749840 340944361 /nfs/dbraw/zinc/94/43/61/340944361.db2.gz PPZRWGFNXCSMKF-QGZVFWFLSA-N 0 0 317.432 5.062 20 0 DKADRN CC(C)C[C@@H](Nc1ccc2nc(C3CC3)oc2c1)c1ccccn1 ZINC000540750134 340944356 /nfs/dbraw/zinc/94/43/56/340944356.db2.gz VJPMUOJNHQFLTH-GOSISDBHSA-N 0 0 321.424 5.300 20 0 DKADRN Cc1cscc1N[C@H](C)c1nc(-c2ccccc2)cs1 ZINC000540750211 340944451 /nfs/dbraw/zinc/94/44/51/340944451.db2.gz ZETZOLIUVPMUIO-GFCCVEGCSA-N 0 0 300.452 5.353 20 0 DKADRN Cc1cscc1N[C@@H](C)c1nc(-c2ccccc2)cs1 ZINC000540750212 340944395 /nfs/dbraw/zinc/94/43/95/340944395.db2.gz ZETZOLIUVPMUIO-LBPRGKRZSA-N 0 0 300.452 5.353 20 0 DKADRN CCOCc1cccc(N[C@@H](C)c2ccc(SC)cc2)c1 ZINC000540750817 340944386 /nfs/dbraw/zinc/94/43/86/340944386.db2.gz RCRCQBALCJPDPK-AWEZNQCLSA-N 0 0 301.455 5.118 20 0 DKADRN Cc1ccc([C@H](C)Nc2cccc(-c3nc(C)c(C)o3)c2)s1 ZINC000540751102 340944412 /nfs/dbraw/zinc/94/44/12/340944412.db2.gz XOEYSSFECXTMQO-ZDUSSCGKSA-N 0 0 312.438 5.501 20 0 DKADRN Cc1nc(-c2cccc(N[C@H]3c4ccccc4C[C@@H]3C)c2)oc1C ZINC000540751644 340944420 /nfs/dbraw/zinc/94/44/20/340944420.db2.gz JFUNZDKBFRJYQY-RNODOKPDSA-N 0 0 318.420 5.304 20 0 DKADRN Cc1nc(-c2cccc(N[C@H]3c4ccccc4C[C@H]3C)c2)oc1C ZINC000540751646 340944419 /nfs/dbraw/zinc/94/44/19/340944419.db2.gz JFUNZDKBFRJYQY-ZUOKHONESA-N 0 0 318.420 5.304 20 0 DKADRN c1ccc2c(c1)OCCC[C@H]2Nc1ccc2nc(C3CC3)oc2c1 ZINC000540751990 340944613 /nfs/dbraw/zinc/94/46/13/340944613.db2.gz UZZFFWRYNXHUAE-MRXNPFEDSA-N 0 0 320.392 5.031 20 0 DKADRN CC(C)C[C@H](Nc1ccc(CC(F)(F)F)cc1)c1ccccn1 ZINC000540752889 340944518 /nfs/dbraw/zinc/94/45/18/340944518.db2.gz FWRFNFGPKWNOLD-KRWDZBQOSA-N 0 0 322.374 5.386 20 0 DKADRN CC(C)C[C@@H](Nc1ccc(CC(F)(F)F)cc1)c1ccccn1 ZINC000540752890 340944517 /nfs/dbraw/zinc/94/45/17/340944517.db2.gz FWRFNFGPKWNOLD-QGZVFWFLSA-N 0 0 322.374 5.386 20 0 DKADRN Cc1c(COC(C)(C)C)cccc1N[C@@H](C)c1cccs1 ZINC000540753081 340944526 /nfs/dbraw/zinc/94/45/26/340944526.db2.gz LGTBVXYDZBMQSV-AWEZNQCLSA-N 0 0 303.471 5.545 20 0 DKADRN Cc1c(COC(C)(C)C)cccc1N[C@H](C)c1cccs1 ZINC000540753085 340944519 /nfs/dbraw/zinc/94/45/19/340944519.db2.gz LGTBVXYDZBMQSV-CQSZACIVSA-N 0 0 303.471 5.545 20 0 DKADRN CCOCc1ccc(N[C@@H](c2ccc(OC)cc2)C(C)C)cc1 ZINC000540753165 340944716 /nfs/dbraw/zinc/94/47/16/340944716.db2.gz NQNISLORRNYYAD-HXUWFJFHSA-N 0 0 313.441 5.041 20 0 DKADRN CCOCc1ccc(N[C@@H](C)c2ccc(SC)cc2)cc1 ZINC000540753557 340944753 /nfs/dbraw/zinc/94/47/53/340944753.db2.gz QMXZMUTULITIEI-AWEZNQCLSA-N 0 0 301.455 5.118 20 0 DKADRN CCOc1ccccc1N[C@@H](C)c1cccc(-c2ccncc2)c1 ZINC000540753905 340944633 /nfs/dbraw/zinc/94/46/33/340944633.db2.gz SLFKTLLDZIJFCD-INIZCTEOSA-N 0 0 318.420 5.320 20 0 DKADRN Cc1ccc(N[C@@H](C)c2cscn2)cc1OCCC(C)C ZINC000540754219 340944819 /nfs/dbraw/zinc/94/48/19/340944819.db2.gz SFTBLDSBGVQWPF-AWEZNQCLSA-N 0 0 304.459 5.050 20 0 DKADRN CCCCn1ncc(N[C@@H]2C[C@H](C)Sc3sccc32)c1C ZINC000540777465 340945467 /nfs/dbraw/zinc/94/54/67/340945467.db2.gz SKGDNUXSBPAHPY-SMDDNHRTSA-N 0 0 321.515 5.091 20 0 DKADRN COc1cc([C@H](C)Nc2cc(SC)ccc2C)ccc1F ZINC000540779113 340945565 /nfs/dbraw/zinc/94/55/65/340945565.db2.gz SZLIGKCZUOMWFE-LBPRGKRZSA-N 0 0 305.418 5.038 20 0 DKADRN CC[C@@H](C)n1ncc(N[C@H](C)c2ccc(F)cc2)c1C1CC1 ZINC000540780171 340945708 /nfs/dbraw/zinc/94/57/08/340945708.db2.gz YBDBLUKYTXUKLB-CHWSQXEVSA-N 0 0 301.409 5.044 20 0 DKADRN CC[C@@H](C)n1ncc(N[C@@H](C)c2ccc(F)cc2)c1C1CC1 ZINC000540780172 340945714 /nfs/dbraw/zinc/94/57/14/340945714.db2.gz YBDBLUKYTXUKLB-OLZOCXBDSA-N 0 0 301.409 5.044 20 0 DKADRN CCc1ccc([C@H](C)Nc2cnn([C@@H](C)CC)c2C2CC2)o1 ZINC000540781992 340945739 /nfs/dbraw/zinc/94/57/39/340945739.db2.gz NLVMKBMZACEQFY-STQMWFEESA-N 0 0 301.434 5.060 20 0 DKADRN CSc1cccc(N[C@H](C)c2ccc3ccccc3n2)c1C ZINC000540782163 340945704 /nfs/dbraw/zinc/94/57/04/340945704.db2.gz QAZLAFHPLKTXSJ-CQSZACIVSA-N 0 0 308.450 5.438 20 0 DKADRN CSc1ccc(N[C@@H](C)c2cccc(-c3ccncc3)c2)nc1 ZINC000540788211 340945901 /nfs/dbraw/zinc/94/59/01/340945901.db2.gz BBNVAVHCNPFMIX-AWEZNQCLSA-N 0 0 321.449 5.039 20 0 DKADRN c1cc(-c2ncc(CNc3cccc4ccncc43)s2)cs1 ZINC000540792817 340946106 /nfs/dbraw/zinc/94/61/06/340946106.db2.gz FWCYZFUSVJXTJS-UHFFFAOYSA-N 0 0 323.446 5.032 20 0 DKADRN Cc1cscc1C(=O)Nc1ccccc1Nc1ccccc1 ZINC000540805989 340946566 /nfs/dbraw/zinc/94/65/66/340946566.db2.gz FPSCXQGAQMSUAH-UHFFFAOYSA-N 0 0 308.406 5.052 20 0 DKADRN COc1ccc([C@@H](C)Nc2ccc(CCC(F)(F)F)cc2)cc1 ZINC000540817348 340947020 /nfs/dbraw/zinc/94/70/20/340947020.db2.gz RILOBABZCVHGOA-CYBMUJFWSA-N 0 0 323.358 5.363 20 0 DKADRN COc1ccc([C@H](C)Nc2ccc(CCC(F)(F)F)cc2)cc1 ZINC000540817352 340947029 /nfs/dbraw/zinc/94/70/29/340947029.db2.gz RILOBABZCVHGOA-ZDUSSCGKSA-N 0 0 323.358 5.363 20 0 DKADRN COc1cc([C@@H](C)Nc2cc(C)ccc2C)ccc1OC(F)F ZINC000540818531 340947009 /nfs/dbraw/zinc/94/70/09/340947009.db2.gz OHJRLUDIYLSTBA-CYBMUJFWSA-N 0 0 321.367 5.087 20 0 DKADRN CCSc1cccc(N[C@@H](C)c2ccc3ccccc3n2)c1 ZINC000540825172 340947295 /nfs/dbraw/zinc/94/72/95/340947295.db2.gz ODUZUCZPIGYUTB-AWEZNQCLSA-N 0 0 308.450 5.520 20 0 DKADRN Cc1ccncc1[C@@H](C)Nc1cccc(Oc2ccccc2)c1 ZINC000540825690 340947352 /nfs/dbraw/zinc/94/73/52/340947352.db2.gz STZNXLCTRVIMJN-MRXNPFEDSA-N 0 0 304.393 5.355 20 0 DKADRN Cc1ccccc1COc1cccc(N[C@H](C)c2cncs2)c1 ZINC000540826843 340947446 /nfs/dbraw/zinc/94/74/46/340947446.db2.gz MSMGEGGZTLKBDU-OAHLLOKOSA-N 0 0 324.449 5.204 20 0 DKADRN CO[C@H](C)c1cccc(N[C@@H](C)c2cccc(C(F)(F)F)c2)c1 ZINC000540831152 340947634 /nfs/dbraw/zinc/94/76/34/340947634.db2.gz ANFNZINALBIWDC-QWHCGFSZSA-N 0 0 323.358 5.586 20 0 DKADRN COc1ccc(OC(C)C)c(N[C@@H](C)c2sccc2C)c1 ZINC000540831227 340947608 /nfs/dbraw/zinc/94/76/08/340947608.db2.gz BNIIEQDJHIJYMK-ZDUSSCGKSA-N 0 0 305.443 5.025 20 0 DKADRN C[C@H](Nc1ccc2oc(CC(C)(C)C)nc2c1)c1cscn1 ZINC000540831341 340947570 /nfs/dbraw/zinc/94/75/70/340947570.db2.gz CRRWWGJDTVPLCI-NSHDSACASA-N 0 0 315.442 5.046 20 0 DKADRN COc1ccc([C@H](C)Nc2ccc(-c3nc(C)cs3)cc2)cc1 ZINC000540831663 340947558 /nfs/dbraw/zinc/94/75/58/340947558.db2.gz GZBFFYLDMMGGHC-AWEZNQCLSA-N 0 0 324.449 5.300 20 0 DKADRN CC[C@@H](Nc1cccc(OCC(F)(F)F)c1)c1cccs1 ZINC000540832490 340947550 /nfs/dbraw/zinc/94/75/50/340947550.db2.gz JHYHGEBKEQUFAQ-CYBMUJFWSA-N 0 0 315.360 5.252 20 0 DKADRN C[C@H](Nc1cccc(-c2nccs2)c1)c1ccccc1N(C)C ZINC000540833124 340947651 /nfs/dbraw/zinc/94/76/51/340947651.db2.gz LCDGPKGLZIVMIT-AWEZNQCLSA-N 0 0 323.465 5.049 20 0 DKADRN C[C@@H](Nc1cccc(-c2nccs2)c1)c1ccccc1N(C)C ZINC000540833125 340947731 /nfs/dbraw/zinc/94/77/31/340947731.db2.gz LCDGPKGLZIVMIT-CQSZACIVSA-N 0 0 323.465 5.049 20 0 DKADRN CC(C)n1ncc2ccc(N[C@H](C)c3ccc(F)cc3F)cc21 ZINC000540833747 340947648 /nfs/dbraw/zinc/94/76/48/340947648.db2.gz OQSULYRICXRQAI-GFCCVEGCSA-N 0 0 315.367 5.069 20 0 DKADRN Cc1csc(-c2ccc(N[C@H](C)c3ccsc3)cc2)n1 ZINC000540833768 340947730 /nfs/dbraw/zinc/94/77/30/340947730.db2.gz SAOFFILMESOODE-GFCCVEGCSA-N 0 0 300.452 5.353 20 0 DKADRN CC(C)C[C@H](Nc1cccc(-c2nccs2)c1)c1ccccn1 ZINC000540834062 340947838 /nfs/dbraw/zinc/94/78/38/340947838.db2.gz QYDJIWHTATXTFY-SFHVURJKSA-N 0 0 323.465 5.404 20 0 DKADRN COc1ccc([C@H](Nc2cccc([C@@H](C)OC)c2)C(C)C)cc1 ZINC000540834159 340947723 /nfs/dbraw/zinc/94/77/23/340947723.db2.gz WIUZJFXBSQVVHM-FOIQADDNSA-N 0 0 313.441 5.212 20 0 DKADRN CO[C@H](C)c1cccc(N[C@@H](C)c2ccc(Cl)c(F)c2)c1 ZINC000540834662 340947781 /nfs/dbraw/zinc/94/77/81/340947781.db2.gz XWJUEOCQKJPVEG-NWDGAFQWSA-N 0 0 307.796 5.360 20 0 DKADRN CO[C@H](C)c1cccc(N[C@H](C)c2ccc(Cl)c(F)c2)c1 ZINC000540834665 340947767 /nfs/dbraw/zinc/94/77/67/340947767.db2.gz XWJUEOCQKJPVEG-VXGBXAGGSA-N 0 0 307.796 5.360 20 0 DKADRN CO[C@@H](C)c1cccc(N[C@H](C)c2ccc(SC)cc2)c1 ZINC000540834874 340947907 /nfs/dbraw/zinc/94/79/07/340947907.db2.gz ACRQTJCAXKUENB-KGLIPLIRSA-N 0 0 301.455 5.289 20 0 DKADRN CO[C@@H](C)c1cccc(N[C@H]2CCc3ccc(Cl)cc32)c1 ZINC000540835505 340947889 /nfs/dbraw/zinc/94/78/89/340947889.db2.gz LYNVZAVHKTURMN-SGTLLEGYSA-N 0 0 301.817 5.147 20 0 DKADRN CCC[C@@H](Nc1cccc([C@@H](C)OC)c1)c1ccc(OC)cc1 ZINC000540835716 340947877 /nfs/dbraw/zinc/94/78/77/340947877.db2.gz PRGSQGYHCNHCRW-FOIQADDNSA-N 0 0 313.441 5.356 20 0 DKADRN CCC[C@@H](Nc1cccc([C@H](C)OC)c1)c1ccc(OC)cc1 ZINC000540835718 340947954 /nfs/dbraw/zinc/94/79/54/340947954.db2.gz PRGSQGYHCNHCRW-MGPUTAFESA-N 0 0 313.441 5.356 20 0 DKADRN CCC[C@H](Nc1cccc([C@H](C)OC)c1)c1ccc(OC)cc1 ZINC000540835720 340947929 /nfs/dbraw/zinc/94/79/29/340947929.db2.gz PRGSQGYHCNHCRW-YWZLYKJASA-N 0 0 313.441 5.356 20 0 DKADRN Cc1coc(-c2ccc(C)c(N[C@H]3CCc4c3cccc4F)c2)n1 ZINC000540836935 340948063 /nfs/dbraw/zinc/94/80/63/340948063.db2.gz JZFGGPURNWHWHZ-SFHVURJKSA-N 0 0 322.383 5.197 20 0 DKADRN CCc1ccc([C@H](C)Nc2ccc(C)c(-c3ncco3)c2)s1 ZINC000540837208 340948092 /nfs/dbraw/zinc/94/80/92/340948092.db2.gz IZXGMGFGRLXBIB-ZDUSSCGKSA-N 0 0 312.438 5.447 20 0 DKADRN CCCCn1ccnc1-c1cccc(N[C@@H](C)c2ccco2)c1 ZINC000540837600 340948151 /nfs/dbraw/zinc/94/81/51/340948151.db2.gz NXFBIPGSNGRCQJ-HNNXBMFYSA-N 0 0 309.413 5.116 20 0 DKADRN Cc1ccc(N[C@@H](C)c2ccc3ccccc3n2)c2cccnc12 ZINC000540837626 340948154 /nfs/dbraw/zinc/94/81/54/340948154.db2.gz HSQNOYXWSSKSKG-HNNXBMFYSA-N 0 0 313.404 5.265 20 0 DKADRN Cc1ccc(N[C@H](C)c2ccc3ccccc3n2)c2cccnc12 ZINC000540837628 340948218 /nfs/dbraw/zinc/94/82/18/340948218.db2.gz HSQNOYXWSSKSKG-OAHLLOKOSA-N 0 0 313.404 5.265 20 0 DKADRN Cc1ccc(N[C@@H](C)c2ccccc2Cl)cc1-c1ncco1 ZINC000540837952 340948109 /nfs/dbraw/zinc/94/81/09/340948109.db2.gz PFTMTWAEWLDPBX-ZDUSSCGKSA-N 0 0 312.800 5.477 20 0 DKADRN Cc1ccc(N[C@H](C)c2cc3c(s2)CCC3)cc1-c1ncco1 ZINC000540838146 340948186 /nfs/dbraw/zinc/94/81/86/340948186.db2.gz RDMHJBLRSRBHNG-CYBMUJFWSA-N 0 0 324.449 5.373 20 0 DKADRN C[C@H](Nc1cccc(CC(F)(F)F)c1)c1ccc(F)cc1F ZINC000540838492 333345672 /nfs/dbraw/zinc/34/56/72/333345672.db2.gz SGTHYPNBMGDFOV-JTQLQIEISA-N 0 0 315.285 5.243 20 0 DKADRN C[C@@H](Nc1cccc(CC(F)(F)F)c1)c1ccc(F)cc1F ZINC000540838495 333345633 /nfs/dbraw/zinc/34/56/33/333345633.db2.gz SGTHYPNBMGDFOV-SNVBAGLBSA-N 0 0 315.285 5.243 20 0 DKADRN C[C@H](Nc1cccc(CC(F)(F)F)c1)c1ccc(F)c(F)c1 ZINC000540838754 340948276 /nfs/dbraw/zinc/94/82/76/340948276.db2.gz VIJNNXGUYRXIEU-JTQLQIEISA-N 0 0 315.285 5.243 20 0 DKADRN C[C@@H](Nc1cccc(CC(F)(F)F)c1)c1ccc(F)c(F)c1 ZINC000540838755 340948272 /nfs/dbraw/zinc/94/82/72/340948272.db2.gz VIJNNXGUYRXIEU-SNVBAGLBSA-N 0 0 315.285 5.243 20 0 DKADRN C[C@@H](Nc1ccc(-c2cnc(C3CC3)o2)cc1)c1ccc(F)cc1 ZINC000540838907 340948310 /nfs/dbraw/zinc/94/83/10/340948310.db2.gz AFIHFUZHMBGBJX-CYBMUJFWSA-N 0 0 322.383 5.531 20 0 DKADRN C[C@H](Nc1ccc(-c2cnc(C3CC3)o2)cc1)c1ccc(F)cc1 ZINC000540838908 340948229 /nfs/dbraw/zinc/94/82/29/340948229.db2.gz AFIHFUZHMBGBJX-ZDUSSCGKSA-N 0 0 322.383 5.531 20 0 DKADRN C[C@@H](Nc1cccc(OC2CCCC2)c1)c1ccc2c(c1)COC2 ZINC000540840265 340948370 /nfs/dbraw/zinc/94/83/70/340948370.db2.gz PZSBGEDXJJNMLN-OAHLLOKOSA-N 0 0 323.436 5.211 20 0 DKADRN C[C@@H](Nc1ccc(-c2ncc3n2CCCC3)cc1)c1ccccc1 ZINC000540841926 340948548 /nfs/dbraw/zinc/94/85/48/340948548.db2.gz MMFBZFPDNWMIQJ-MRXNPFEDSA-N 0 0 317.436 5.060 20 0 DKADRN C[C@@H](Sc1cccc2cccnc21)c1nc2ccccc2o1 ZINC000540858177 340948800 /nfs/dbraw/zinc/94/88/00/340948800.db2.gz BOGQPWCYKJRHGD-GFCCVEGCSA-N 0 0 306.390 5.229 20 0 DKADRN C[C@H](Sc1cccc2cccnc21)c1nc2ccccc2o1 ZINC000540858195 340948810 /nfs/dbraw/zinc/94/88/10/340948810.db2.gz BOGQPWCYKJRHGD-LBPRGKRZSA-N 0 0 306.390 5.229 20 0 DKADRN C[C@@H](Sc1c(F)cc(F)cc1F)c1nc2ccccc2o1 ZINC000540859492 340948820 /nfs/dbraw/zinc/94/88/20/340948820.db2.gz UQNWVITXVQTOLJ-MRVPVSSYSA-N 0 0 309.312 5.098 20 0 DKADRN C[C@H](Sc1c(F)cc(F)cc1F)c1nc2ccccc2o1 ZINC000540859493 340948802 /nfs/dbraw/zinc/94/88/02/340948802.db2.gz UQNWVITXVQTOLJ-QMMMGPOBSA-N 0 0 309.312 5.098 20 0 DKADRN CCO[C@@H](C)c1nc(CSC[C@H](C)c2ccccc2)cs1 ZINC000540866176 340949042 /nfs/dbraw/zinc/94/90/42/340949042.db2.gz LAZDZTVYSUNVNZ-KBPBESRZSA-N 0 0 321.511 5.278 20 0 DKADRN CCO[C@@H](C)c1nc(CSC[C@@H](C)c2ccccc2)cs1 ZINC000540866178 340948973 /nfs/dbraw/zinc/94/89/73/340948973.db2.gz LAZDZTVYSUNVNZ-KGLIPLIRSA-N 0 0 321.511 5.278 20 0 DKADRN CCO[C@H](C)c1nc(CSC[C@H](C)c2ccccc2)cs1 ZINC000540866180 517714901 /nfs/dbraw/zinc/71/49/01/517714901.db2.gz LAZDZTVYSUNVNZ-UONOGXRCSA-N 0 0 321.511 5.278 20 0 DKADRN CCO[C@H](C)c1nc(CSC[C@@H](C)c2ccccc2)cs1 ZINC000540866182 340948981 /nfs/dbraw/zinc/94/89/81/340948981.db2.gz LAZDZTVYSUNVNZ-ZIAGYGMSSA-N 0 0 321.511 5.278 20 0 DKADRN C[C@H](SCc1cccc(F)c1F)c1nc2ccccc2o1 ZINC000540867329 340949063 /nfs/dbraw/zinc/94/90/63/340949063.db2.gz DSVTTWMPALTNDD-JTQLQIEISA-N 0 0 305.349 5.100 20 0 DKADRN C[C@@H](SCc1cccc(F)c1F)c1nc2ccccc2o1 ZINC000540867330 333347049 /nfs/dbraw/zinc/34/70/49/333347049.db2.gz DSVTTWMPALTNDD-SNVBAGLBSA-N 0 0 305.349 5.100 20 0 DKADRN C[C@H](Nc1ccc(F)c(C(F)(F)F)c1)c1nc2ccccc2o1 ZINC000540872569 340949187 /nfs/dbraw/zinc/94/91/87/340949187.db2.gz VDFXVVRJHRCZNC-VIFPVBQESA-N 0 0 324.277 5.159 20 0 DKADRN Cc1ccccc1-c1cnc(CNc2csc3ccccc23)o1 ZINC000540903462 340950852 /nfs/dbraw/zinc/95/08/52/340950852.db2.gz VFCBPVUWHHXAIC-UHFFFAOYSA-N 0 0 320.417 5.477 20 0 DKADRN Cc1nc(C(C)C)sc1C(=O)Nc1csc2ccccc12 ZINC000540915330 340951424 /nfs/dbraw/zinc/95/14/24/340951424.db2.gz SUQTTXUYSPYJJQ-UHFFFAOYSA-N 0 0 316.451 5.042 20 0 DKADRN CC1=C(C(=O)Nc2ccccc2NCc2ccccc2C)CCC1 ZINC000541155634 340960203 /nfs/dbraw/zinc/96/02/03/340960203.db2.gz IZPKBIXBSOEECV-UHFFFAOYSA-N 0 0 320.436 5.046 20 0 DKADRN CCc1cccc(CC)c1NC(=O)c1ccc(C)c(C)c1Cl ZINC000541181628 340960795 /nfs/dbraw/zinc/96/07/95/340960795.db2.gz BWBXQYUVKPQWIH-UHFFFAOYSA-N 0 0 315.844 5.334 20 0 DKADRN Cc1ccc(NC(=O)c2ccc(SC3CC3)cc2)c(Cl)c1 ZINC000541181895 340960834 /nfs/dbraw/zinc/96/08/34/340960834.db2.gz BNPIBSBHRVNHCW-UHFFFAOYSA-N 0 0 317.841 5.155 20 0 DKADRN Cc1ccc(C(=O)Nc2ccccc2C(C)C)c(Cl)c1C ZINC000541183613 340960792 /nfs/dbraw/zinc/96/07/92/340960792.db2.gz UFXXRCQRYFJCAO-UHFFFAOYSA-N 0 0 301.817 5.333 20 0 DKADRN CC(C)=CCC[C@H](C)Nc1cccc(NC(=O)c2ccoc2)c1 ZINC000541207047 340961725 /nfs/dbraw/zinc/96/17/25/340961725.db2.gz PFHOWRVVFUOCLG-HNNXBMFYSA-N 0 0 312.413 5.079 20 0 DKADRN CC(C)=CCC[C@@H](C)Nc1cccc(NC(=O)c2ccoc2)c1 ZINC000541207049 340961760 /nfs/dbraw/zinc/96/17/60/340961760.db2.gz PFHOWRVVFUOCLG-OAHLLOKOSA-N 0 0 312.413 5.079 20 0 DKADRN O=C(Nc1cccc(C(F)F)c1)c1cccc(C2CCC2)c1 ZINC000541221248 340962471 /nfs/dbraw/zinc/96/24/71/340962471.db2.gz NUNNWKIQTDLBRU-UHFFFAOYSA-N 0 0 301.336 5.144 20 0 DKADRN Cc1cccc([C@H](C)[S@@](=O)CCCc2ccccc2Cl)c1 ZINC000541259313 340964144 /nfs/dbraw/zinc/96/41/44/340964144.db2.gz OEZNBBFEBLTYBG-BTYIYWSLSA-N 0 0 320.885 5.091 20 0 DKADRN Cc1cccc([C@@H](C)[S@](=O)CCCc2ccccc2Cl)c1 ZINC000541259315 340964118 /nfs/dbraw/zinc/96/41/18/340964118.db2.gz OEZNBBFEBLTYBG-QVKFZJNVSA-N 0 0 320.885 5.091 20 0 DKADRN Cc1cccc([C@H](C)[S@](=O)CCCc2ccccc2Cl)c1 ZINC000541259318 340964096 /nfs/dbraw/zinc/96/40/96/340964096.db2.gz OEZNBBFEBLTYBG-YCRPNKLZSA-N 0 0 320.885 5.091 20 0 DKADRN Cc1cccc(C(C)C)c1NC(=O)c1ccc(-c2ccccc2)o1 ZINC000541268778 340964549 /nfs/dbraw/zinc/96/45/49/340964549.db2.gz BEHCSHXQDVDWGK-UHFFFAOYSA-N 0 0 319.404 5.631 20 0 DKADRN CC(C)(C)[C@@H](NCc1nc(C2CC2)cs1)c1ccc(F)cc1 ZINC000541283018 340965478 /nfs/dbraw/zinc/96/54/78/340965478.db2.gz RVYLGAWKNVJOMM-KRWDZBQOSA-N 0 0 318.461 5.037 20 0 DKADRN O=C(Nc1cccc(C(F)F)c1)c1ccc(-c2ccccc2)o1 ZINC000541291335 340965793 /nfs/dbraw/zinc/96/57/93/340965793.db2.gz XDPSOZJHEMZRSS-UHFFFAOYSA-N 0 0 313.303 5.137 20 0 DKADRN Fc1cc(Cl)cc(Cl)c1NCc1nc(C2CC2)cs1 ZINC000541292386 340965826 /nfs/dbraw/zinc/96/58/26/340965826.db2.gz HQDRUMOQLAJTRQ-UHFFFAOYSA-N 0 0 317.216 5.079 20 0 DKADRN Clc1cnc(SCc2nc(C3CC3)cs2)c(Cl)c1 ZINC000541292949 340965840 /nfs/dbraw/zinc/96/58/40/340965840.db2.gz FTOXYBOKBKGVPA-UHFFFAOYSA-N 0 0 317.266 5.015 20 0 DKADRN CC(=O)Nc1ccc(S[C@H]2CCc3ccc(Cl)cc32)cc1 ZINC000541293352 340965838 /nfs/dbraw/zinc/96/58/38/340965838.db2.gz NIFKNVCNOMBQPR-KRWDZBQOSA-N 0 0 317.841 5.078 20 0 DKADRN CC(C)n1ccnc1CS[C@H]1CCc2ccc(Cl)cc21 ZINC000541293618 337883406 /nfs/dbraw/zinc/88/34/06/337883406.db2.gz SFQYRZUGXUKGOT-HNNXBMFYSA-N 0 0 306.862 5.038 20 0 DKADRN CCCOc1ccc(Cl)cc1NCc1nc(C2CC2)cs1 ZINC000541306398 340966404 /nfs/dbraw/zinc/96/64/04/340966404.db2.gz KRIDCSHVXFSKCT-UHFFFAOYSA-N 0 0 322.861 5.075 20 0 DKADRN Cc1cccc(C(C)C)c1NC(=O)N1CC[C@H](C(C)(C)C)C1 ZINC000541428427 340970567 /nfs/dbraw/zinc/97/05/67/340970567.db2.gz IGUFHQSCKSMEQH-HNNXBMFYSA-N 0 0 302.462 5.018 20 0 DKADRN Cc1cccc(C(C)C)c1NC(=O)N1CC[C@@H](C(C)(C)C)C1 ZINC000541428428 340970533 /nfs/dbraw/zinc/97/05/33/340970533.db2.gz IGUFHQSCKSMEQH-OAHLLOKOSA-N 0 0 302.462 5.018 20 0 DKADRN CC(=O)Nc1ccc(N[C@@H](C)C2CCCCCC2)cc1Cl ZINC000541564193 340974879 /nfs/dbraw/zinc/97/48/79/340974879.db2.gz YKEWSQLWSKMFRP-LBPRGKRZSA-N 0 0 308.853 5.069 20 0 DKADRN Fc1ccc([C@H](Nc2cccc(Cl)c2)c2ccccc2)nc1 ZINC000541564614 340974882 /nfs/dbraw/zinc/97/48/82/340974882.db2.gz XSKIARFZSLKZNX-GOSISDBHSA-N 0 0 312.775 5.076 20 0 DKADRN CCOCc1ccc(N[C@@H](c2ccco2)c2ccccc2)cc1 ZINC000541567930 340975127 /nfs/dbraw/zinc/97/51/27/340975127.db2.gz VORMKYPRPMLSNX-HXUWFJFHSA-N 0 0 307.393 5.018 20 0 DKADRN Fc1ccc([C@@H](Nc2ccc(Cl)cc2)c2ccccn2)cc1 ZINC000541570768 340975249 /nfs/dbraw/zinc/97/52/49/340975249.db2.gz LGBGEISAGVHIFZ-GOSISDBHSA-N 0 0 312.775 5.076 20 0 DKADRN Fc1ccc([C@H](Nc2ccc(Cl)cc2)c2ccccn2)cc1 ZINC000541570769 340975145 /nfs/dbraw/zinc/97/51/45/340975145.db2.gz LGBGEISAGVHIFZ-SFHVURJKSA-N 0 0 312.775 5.076 20 0 DKADRN C[C@H](CCC(C)(C)C)C(=O)Nc1ccccc1C(F)(F)F ZINC000541586202 340976085 /nfs/dbraw/zinc/97/60/85/340976085.db2.gz VFUYQWQBGJHZRO-LLVKDONJSA-N 0 0 301.352 5.106 20 0 DKADRN C[C@@H](CCC(C)(C)C)C(=O)Nc1ccccc1C(F)(F)F ZINC000541586203 340976036 /nfs/dbraw/zinc/97/60/36/340976036.db2.gz VFUYQWQBGJHZRO-NSHDSACASA-N 0 0 301.352 5.106 20 0 DKADRN O=C(Nc1c(F)cccc1Cl)N1CCC[C@H]1C1CCCCC1 ZINC000541586658 340976035 /nfs/dbraw/zinc/97/60/35/340976035.db2.gz MRGYBIITVPICPL-HNNXBMFYSA-N 0 0 324.827 5.056 20 0 DKADRN CC(C)(NCc1c(Cl)cccc1Cl)c1cccs1 ZINC000541641691 340979181 /nfs/dbraw/zinc/97/91/81/340979181.db2.gz WSRWEJFLEVKTAY-UHFFFAOYSA-N 0 0 300.254 5.080 20 0 DKADRN CCC1(C(=O)Nc2cccc(C(F)F)c2Cl)CCCC1 ZINC000541646208 340979389 /nfs/dbraw/zinc/97/93/89/340979389.db2.gz ALYFMDXYCXVLID-UHFFFAOYSA-N 0 0 301.764 5.187 20 0 DKADRN CCC(CC)[C@H](C)C(=O)Nc1cccc(C(F)F)c1Cl ZINC000541646814 340979304 /nfs/dbraw/zinc/97/93/04/340979304.db2.gz VHQSUZOQDUHSSI-VIFPVBQESA-N 0 0 303.780 5.288 20 0 DKADRN CC(C)c1cccc(C(=O)Nc2cccc(C(F)F)c2Cl)n1 ZINC000541646873 340979271 /nfs/dbraw/zinc/97/92/71/340979271.db2.gz XKNBNUBZLAXESZ-UHFFFAOYSA-N 0 0 324.758 5.048 20 0 DKADRN C[C@H](CC(=O)Nc1cccc(C(F)F)c1Cl)c1ccccc1 ZINC000541647456 340979382 /nfs/dbraw/zinc/97/93/82/340979382.db2.gz SIXNWJFFWBVRAC-LLVKDONJSA-N 0 0 323.770 5.410 20 0 DKADRN C[C@@H](CC(=O)Nc1cccc(C(F)F)c1Cl)c1ccccc1 ZINC000541647458 340979282 /nfs/dbraw/zinc/97/92/82/340979282.db2.gz SIXNWJFFWBVRAC-NSHDSACASA-N 0 0 323.770 5.410 20 0 DKADRN C[C@@H](CC1CCCC1)C(=O)Nc1cccc(C(F)F)c1Cl ZINC000541647620 340979384 /nfs/dbraw/zinc/97/93/84/340979384.db2.gz ZRCRIBXRWBXGCS-JTQLQIEISA-N 0 0 315.791 5.433 20 0 DKADRN C[C@H](CC1CCCC1)C(=O)Nc1cccc(C(F)F)c1Cl ZINC000541647621 340979272 /nfs/dbraw/zinc/97/92/72/340979272.db2.gz ZRCRIBXRWBXGCS-SNVBAGLBSA-N 0 0 315.791 5.433 20 0 DKADRN CCCC(CCC)C(=O)Nc1cccc(C(F)F)c1Cl ZINC000541648934 340979443 /nfs/dbraw/zinc/97/94/43/340979443.db2.gz FSXNLVBWITVJCV-UHFFFAOYSA-N 0 0 303.780 5.433 20 0 DKADRN CC[C@@H](C)n1ncc(NC(=O)[C@H](C)CCC(C)(C)C)c1C1CC1 ZINC000541720788 340981027 /nfs/dbraw/zinc/98/10/27/340981027.db2.gz UETSAQIBHGFOBZ-ZIAGYGMSSA-N 0 0 319.493 5.132 20 0 DKADRN CC(C)n1cc([C@H](C)Nc2cccc(C(F)F)c2Cl)cn1 ZINC000541737803 340981566 /nfs/dbraw/zinc/98/15/66/340981566.db2.gz CJZIZOMORGJCRN-JTQLQIEISA-N 0 0 313.779 5.228 20 0 DKADRN CCC(C)(C)OCc1ccccc1NCc1sc(C)nc1C ZINC000541758161 340982820 /nfs/dbraw/zinc/98/28/20/340982820.db2.gz YMITWBXOTVAXAM-UHFFFAOYSA-N 0 0 318.486 5.077 20 0 DKADRN FC(F)c1cccc(NCc2cccc3cc[nH]c32)c1Cl ZINC000541760365 340982834 /nfs/dbraw/zinc/98/28/34/340982834.db2.gz HZEQLQBPJCNIHM-UHFFFAOYSA-N 0 0 306.743 5.371 20 0 DKADRN CCC[C@@H](Nc1cccc(N2CCC(C)CC2)c1)c1cccnc1 ZINC000541766971 340983048 /nfs/dbraw/zinc/98/30/48/340983048.db2.gz PXRMROPZVGBKIO-OAQYLSRUSA-N 0 0 323.484 5.271 20 0 DKADRN CCC[C@@H](Nc1cccc(-c2nccs2)c1)c1cccnc1 ZINC000541767671 340983123 /nfs/dbraw/zinc/98/31/23/340983123.db2.gz HMJMAEQAGZYKRT-QGZVFWFLSA-N 0 0 309.438 5.158 20 0 DKADRN CCCCCc1ccc([C@@H](CC)N[C@@H](C)c2ccon2)cc1 ZINC000541771257 340983532 /nfs/dbraw/zinc/98/35/32/340983532.db2.gz HMAAHGXDMPFQSS-MAUKXSAKSA-N 0 0 300.446 5.209 20 0 DKADRN CC[C@H]1CC[C@H](C)N1C(=O)Nc1cccc(C(F)F)c1Cl ZINC000541793043 340984525 /nfs/dbraw/zinc/98/45/25/340984525.db2.gz NBITXKLCWVSYPX-UWVGGRQHSA-N 0 0 316.779 5.072 20 0 DKADRN CC[C@@H](NC(=O)Nc1cccc(C(F)F)c1Cl)C(C)(C)C ZINC000541796171 340984540 /nfs/dbraw/zinc/98/45/40/340984540.db2.gz SJBKMBYUGXVZJU-LLVKDONJSA-N 0 0 318.795 5.224 20 0 DKADRN CC[C@H](NC(=O)Nc1cccc(C(F)F)c1Cl)C(C)(C)C ZINC000541796177 340984624 /nfs/dbraw/zinc/98/46/24/340984624.db2.gz SJBKMBYUGXVZJU-NSHDSACASA-N 0 0 318.795 5.224 20 0 DKADRN CCC(C)(C)OCc1ccccc1NCc1nc(C)sc1C ZINC000541802242 340984712 /nfs/dbraw/zinc/98/47/12/340984712.db2.gz NCHKGVGEXZCSFO-UHFFFAOYSA-N 0 0 318.486 5.077 20 0 DKADRN CC(C)c1cnc(NCc2nc(-c3ccccc3)cs2)s1 ZINC000541822287 340984979 /nfs/dbraw/zinc/98/49/79/340984979.db2.gz DBHPLYDTJNCSNM-UHFFFAOYSA-N 0 0 315.467 5.002 20 0 DKADRN O=C(Nc1ncccc1-c1ccccc1)c1cccc2ccccc21 ZINC000541877200 340986872 /nfs/dbraw/zinc/98/68/72/340986872.db2.gz HYYMPBPXGWOMND-UHFFFAOYSA-N 0 0 324.383 5.154 20 0 DKADRN Cc1occc1SCc1ncc(-c2ccc(Cl)cc2)o1 ZINC000541885475 340987353 /nfs/dbraw/zinc/98/73/53/340987353.db2.gz FKXLUIPDAJXAIM-UHFFFAOYSA-N 0 0 305.786 5.189 20 0 DKADRN CC(=O)Nc1ccc([C@@H](C)Nc2ccc(C(C)(C)C)cc2)cc1 ZINC000541916633 340989363 /nfs/dbraw/zinc/98/93/63/340989363.db2.gz WXHUULFAMHKAIM-CQSZACIVSA-N 0 0 310.441 5.116 20 0 DKADRN C[C@@H]1CC[C@@]2(CCN(C(=O)Nc3ccccc3C(C)(C)C)C2)C1 ZINC000541918857 340989415 /nfs/dbraw/zinc/98/94/15/340989415.db2.gz CJAAWWIDBRCIRJ-FOIQADDNSA-N 0 0 314.473 5.028 20 0 DKADRN C[C@@H]1CC[C@]2(CCN(C(=O)Nc3ccccc3C(C)(C)C)C2)C1 ZINC000541918859 340989402 /nfs/dbraw/zinc/98/94/02/340989402.db2.gz CJAAWWIDBRCIRJ-QRWLVFNGSA-N 0 0 314.473 5.028 20 0 DKADRN Cc1ccc(CNC(=O)N(c2ccccc2)c2ccccc2)s1 ZINC000542039481 340993944 /nfs/dbraw/zinc/99/39/44/340993944.db2.gz RRGBOXXWFLUIAX-UHFFFAOYSA-N 0 0 322.433 5.104 20 0 DKADRN FC(F)(F)c1csc(CSCCCc2ccsc2)n1 ZINC000542088518 340994913 /nfs/dbraw/zinc/99/49/13/340994913.db2.gz LGCGSCXTKMMQQZ-UHFFFAOYSA-N 0 0 323.430 5.089 20 0 DKADRN Clc1cccc(Cl)c1-c1noc([C@H]2CCCCS2)n1 ZINC000542103947 340995347 /nfs/dbraw/zinc/99/53/47/340995347.db2.gz UVAGRBBRZMBPFC-SNVBAGLBSA-N 0 0 315.225 5.002 20 0 DKADRN CCc1cccc(C)c1NC(=O)c1ccc(-c2cccs2)o1 ZINC000542110941 340995678 /nfs/dbraw/zinc/99/56/78/340995678.db2.gz ARUSDQOBZIRXRD-UHFFFAOYSA-N 0 0 311.406 5.131 20 0 DKADRN CC(C)c1ccccc1NC(=O)c1ccc(-c2cccs2)o1 ZINC000542112446 340995728 /nfs/dbraw/zinc/99/57/28/340995728.db2.gz UXQIORIHLOLQQD-UHFFFAOYSA-N 0 0 311.406 5.384 20 0 DKADRN O=C(Nc1cccc(Cl)c1F)c1ccc(-c2cccs2)o1 ZINC000542112456 340995773 /nfs/dbraw/zinc/99/57/73/340995773.db2.gz VMDJAIMSCKNFHN-UHFFFAOYSA-N 0 0 321.760 5.053 20 0 DKADRN Cc1ccc(C(=O)Nc2ccc(Cl)cc2F)c(Cl)c1C ZINC000542112685 340995731 /nfs/dbraw/zinc/99/57/31/340995731.db2.gz WCDCUOBGDDRVIE-UHFFFAOYSA-N 0 0 312.171 5.002 20 0 DKADRN CC(C)c1cccc(C(C)C)c1NC(=O)[C@@H]1CCCCS1 ZINC000542112776 340995717 /nfs/dbraw/zinc/99/57/17/340995717.db2.gz ZELNHRTXLNYLGM-INIZCTEOSA-N 0 0 305.487 5.158 20 0 DKADRN CC(C)c1cccc(C(C)C)c1NC(=O)[C@H]1CCCCS1 ZINC000542112777 340995735 /nfs/dbraw/zinc/99/57/35/340995735.db2.gz ZELNHRTXLNYLGM-MRXNPFEDSA-N 0 0 305.487 5.158 20 0 DKADRN Cc1ccc(C(=O)Nc2ccc(Cl)cc2C)c(Cl)c1C ZINC000542113099 340995771 /nfs/dbraw/zinc/99/57/71/340995771.db2.gz MFRNNYNNQJHBTK-UHFFFAOYSA-N 0 0 308.208 5.171 20 0 DKADRN Cc1ccc(C(=O)Nc2cc(Cl)ccc2F)c(Cl)c1C ZINC000542114901 340995862 /nfs/dbraw/zinc/99/58/62/340995862.db2.gz VVURAHQRQWOHJV-UHFFFAOYSA-N 0 0 312.171 5.002 20 0 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O=C(Nc1cc(F)ccc1Cl)c1ccc(-c2cccs2)o1 ZINC000542167614 340998272 /nfs/dbraw/zinc/99/82/72/340998272.db2.gz WFFKWJYBYKDSSE-UHFFFAOYSA-N 0 0 321.760 5.053 20 0 DKADRN Cc1cccc(NC(=O)c2ccc(SC3CC3)cc2)c1Cl ZINC000542167630 340998296 /nfs/dbraw/zinc/99/82/96/340998296.db2.gz WZQCOBQCFFTCJQ-UHFFFAOYSA-N 0 0 317.841 5.155 20 0 DKADRN CC[C@@H](c1ccccc1)[S@](=O)CCCc1ccccc1Cl ZINC000542189565 340999054 /nfs/dbraw/zinc/99/90/54/340999054.db2.gz MZUGUILOGSXUKW-GHTZIAJQSA-N 0 0 320.885 5.173 20 0 DKADRN CC[C@@H](c1ccccc1)[S@@](=O)CCCc1ccccc1Cl ZINC000542189567 340999011 /nfs/dbraw/zinc/99/90/11/340999011.db2.gz MZUGUILOGSXUKW-RXVVDRJESA-N 0 0 320.885 5.173 20 0 DKADRN CC[C@H](c1ccccc1)[S@](=O)CCCc1ccccc1Cl ZINC000542189568 340999052 /nfs/dbraw/zinc/99/90/52/340999052.db2.gz MZUGUILOGSXUKW-WIYYLYMNSA-N 0 0 320.885 5.173 20 0 DKADRN CC(C)N(C(=O)c1ccc(-c2ccccc2)o1)c1ccccc1 ZINC000542213728 341000563 /nfs/dbraw/zinc/00/05/63/341000563.db2.gz WVLZHFHRPQQDSY-UHFFFAOYSA-N 0 0 305.377 5.002 20 0 DKADRN 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CCc1ccc(CC(=O)Nc2cccc(C(F)F)c2Cl)cc1 ZINC000542577859 341014414 /nfs/dbraw/zinc/01/44/14/341014414.db2.gz QFVTTYJWLSRFND-UHFFFAOYSA-N 0 0 323.770 5.021 20 0 DKADRN CC1(C)CC[C@@H](C(=O)Nc2cccc(C(F)F)c2Cl)C1 ZINC000542577993 341014358 /nfs/dbraw/zinc/01/43/58/341014358.db2.gz XIWFKCNGCISBFA-SECBINFHSA-N 0 0 301.764 5.042 20 0 DKADRN CC1(C)CC[C@H](C(=O)Nc2cccc(C(F)F)c2Cl)C1 ZINC000542577994 341014419 /nfs/dbraw/zinc/01/44/19/341014419.db2.gz XIWFKCNGCISBFA-VIFPVBQESA-N 0 0 301.764 5.042 20 0 DKADRN Cc1ccc(CCC(=O)Nc2cccc(C(F)F)c2Cl)cc1 ZINC000542578236 341014389 /nfs/dbraw/zinc/01/43/89/341014389.db2.gz VJKGWLCRDNROTL-UHFFFAOYSA-N 0 0 323.770 5.157 20 0 DKADRN CCCCS[C@H](C)C(=O)Nc1cccc(C(F)F)c1Cl ZINC000542578267 341014351 /nfs/dbraw/zinc/01/43/51/341014351.db2.gz WPKJXGVDXBYJTN-SECBINFHSA-N 0 0 321.820 5.138 20 0 DKADRN CCCCS[C@@H](C)C(=O)Nc1cccc(C(F)F)c1Cl ZINC000542578272 341014324 /nfs/dbraw/zinc/01/43/24/341014324.db2.gz WPKJXGVDXBYJTN-VIFPVBQESA-N 0 0 321.820 5.138 20 0 DKADRN CCc1ccc(C(=O)Nc2cccc(C(F)F)c2Cl)cc1 ZINC000542578380 341014312 /nfs/dbraw/zinc/01/43/12/341014312.db2.gz PPWPAWDLMVMEKD-UHFFFAOYSA-N 0 0 309.743 5.092 20 0 DKADRN CCc1ccsc1C(=O)Nc1cccc(C(F)F)c1Cl ZINC000542579032 341014537 /nfs/dbraw/zinc/01/45/37/341014537.db2.gz QJPJVOUJFBFXND-UHFFFAOYSA-N 0 0 315.772 5.154 20 0 DKADRN C[C@@H]1CC[C@@H](CC(=O)Nc2cccc(C(F)F)c2Cl)C1 ZINC000542579424 341014441 /nfs/dbraw/zinc/01/44/41/341014441.db2.gz UYCXEDHCJCLKAZ-NXEZZACHSA-N 0 0 301.764 5.042 20 0 DKADRN C[C@H]1CC[C@H](CC(=O)Nc2cccc(C(F)F)c2Cl)C1 ZINC000542579426 341014555 /nfs/dbraw/zinc/01/45/55/341014555.db2.gz UYCXEDHCJCLKAZ-UWVGGRQHSA-N 0 0 301.764 5.042 20 0 DKADRN C[C@H]1CC[C@@H](CC(=O)Nc2cccc(C(F)F)c2Cl)C1 ZINC000542579427 341014534 /nfs/dbraw/zinc/01/45/34/341014534.db2.gz UYCXEDHCJCLKAZ-VHSXEESVSA-N 0 0 301.764 5.042 20 0 DKADRN C[C@@H]1CC[C@H](CC(=O)Nc2cccc(C(F)F)c2Cl)C1 ZINC000542579428 341014492 /nfs/dbraw/zinc/01/44/92/341014492.db2.gz UYCXEDHCJCLKAZ-ZJUUUORDSA-N 0 0 301.764 5.042 20 0 DKADRN CC(C)(C)CCCC(=O)Nc1cccc(C(F)F)c1Cl ZINC000542579825 341014551 /nfs/dbraw/zinc/01/45/51/341014551.db2.gz VHNQQAWOQUSXRF-UHFFFAOYSA-N 0 0 303.780 5.433 20 0 DKADRN O=C(Nc1cccc(C(F)F)c1Cl)c1coc2ccccc12 ZINC000542579841 341014526 /nfs/dbraw/zinc/01/45/26/341014526.db2.gz WMFCWJSVCGSUDH-UHFFFAOYSA-N 0 0 321.710 5.276 20 0 DKADRN Cc1cnc(C(C)(C)[NH2+][C@@H](C)c2cccc3ccccc32)s1 ZINC000542581062 341014452 /nfs/dbraw/zinc/01/44/52/341014452.db2.gz KDGBMMGHHDTQRC-AWEZNQCLSA-N 0 0 310.466 5.191 20 0 DKADRN Cc1cnc(C(C)(C)[NH2+][C@H](C)c2cccc3ccccc32)s1 ZINC000542581063 341014570 /nfs/dbraw/zinc/01/45/70/341014570.db2.gz KDGBMMGHHDTQRC-CQSZACIVSA-N 0 0 310.466 5.191 20 0 DKADRN CCC(CC)c1cc(CN[C@H](c2ccc(C)o2)C2CCC2)on1 ZINC000542664563 341016102 /nfs/dbraw/zinc/01/61/02/341016102.db2.gz LPWPREKTWJUZEH-IBGZPJMESA-N 0 0 316.445 5.111 20 0 DKADRN CCC(CC)c1cc(CN[C@@H](c2ccc(C)o2)C2CCC2)on1 ZINC000542664564 341016048 /nfs/dbraw/zinc/01/60/48/341016048.db2.gz LPWPREKTWJUZEH-LJQANCHMSA-N 0 0 316.445 5.111 20 0 DKADRN CCc1cccnc1[C@H](C)Nc1cccc(C(F)F)c1Cl ZINC000542683005 341017139 /nfs/dbraw/zinc/01/71/39/341017139.db2.gz ZEXBLWFIYFSGIN-JTQLQIEISA-N 0 0 310.775 5.408 20 0 DKADRN CCc1cccnc1[C@@H](C)Nc1cccc(C(F)F)c1Cl ZINC000542683006 341017184 /nfs/dbraw/zinc/01/71/84/341017184.db2.gz ZEXBLWFIYFSGIN-SNVBAGLBSA-N 0 0 310.775 5.408 20 0 DKADRN CCC(C)(C)OCc1ccccc1NCc1ccc(OC)cc1 ZINC000542687942 341017284 /nfs/dbraw/zinc/01/72/84/341017284.db2.gz HPBYBPJSEZPYDY-UHFFFAOYSA-N 0 0 313.441 5.013 20 0 DKADRN FC(F)c1cccc(NCc2csc(C3CC3)n2)c1Cl ZINC000542690617 341017379 /nfs/dbraw/zinc/01/73/79/341017379.db2.gz GNFFYSCPLQRXNO-UHFFFAOYSA-N 0 0 314.788 5.224 20 0 DKADRN FC(F)c1cccc(NCc2cccc3cccnc32)c1Cl ZINC000542691355 341017335 /nfs/dbraw/zinc/01/73/35/341017335.db2.gz WQFPWXZBZYSXST-UHFFFAOYSA-N 0 0 318.754 5.438 20 0 DKADRN C[C@@H](N[C@H](C)c1ccc(Cl)c(Cl)c1Cl)c1ccon1 ZINC000542697461 341017739 /nfs/dbraw/zinc/01/77/39/341017739.db2.gz MRYPTGLIQLEMNM-HTQZYQBOSA-N 0 0 319.619 5.047 20 0 DKADRN C[C@@H](N[C@@H](C)c1ccc(Cl)c(Cl)c1Cl)c1ccon1 ZINC000542697463 341017653 /nfs/dbraw/zinc/01/76/53/341017653.db2.gz MRYPTGLIQLEMNM-JGVFFNPUSA-N 0 0 319.619 5.047 20 0 DKADRN C[C@@H](N[C@@H](C)c1ccon1)c1ccc(Cl)c(Cl)c1Cl ZINC000542697464 341017679 /nfs/dbraw/zinc/01/76/79/341017679.db2.gz MRYPTGLIQLEMNM-SFYZADRCSA-N 0 0 319.619 5.047 20 0 DKADRN C[C@H](N[C@@H](C)c1ccc(Cl)c(Cl)c1Cl)c1ccon1 ZINC000542697465 341017729 /nfs/dbraw/zinc/01/77/29/341017729.db2.gz MRYPTGLIQLEMNM-YUMQZZPRSA-N 0 0 319.619 5.047 20 0 DKADRN CCC[C@@H](Nc1cccc(-c2csc(C)n2)c1)c1cccnc1 ZINC000542704471 341018193 /nfs/dbraw/zinc/01/81/93/341018193.db2.gz JZHSHPMHYZSPDF-GOSISDBHSA-N 0 0 323.465 5.467 20 0 DKADRN CCC[C@H](Nc1cccc(-c2csc(C)n2)c1)c1cccnc1 ZINC000542704473 341018213 /nfs/dbraw/zinc/01/82/13/341018213.db2.gz JZHSHPMHYZSPDF-SFHVURJKSA-N 0 0 323.465 5.467 20 0 DKADRN CCCCc1ccc(N[C@@H](c2ccccc2)c2cncnc2)cc1 ZINC000542705522 341018306 /nfs/dbraw/zinc/01/83/06/341018306.db2.gz ZOHIDJHBZRYUQE-NRFANRHFSA-N 0 0 317.436 5.021 20 0 DKADRN CCCCc1ccc(N[C@H](c2ccccc2)c2cncnc2)cc1 ZINC000542705526 341018368 /nfs/dbraw/zinc/01/83/68/341018368.db2.gz ZOHIDJHBZRYUQE-OAQYLSRUSA-N 0 0 317.436 5.021 20 0 DKADRN FC(F)c1cccc(NCc2ccc3ncccc3c2)c1Cl ZINC000542710844 341018598 /nfs/dbraw/zinc/01/85/98/341018598.db2.gz LJDPYAQFKAUBNU-UHFFFAOYSA-N 0 0 318.754 5.438 20 0 DKADRN CC[C@H]1C[C@H](CNc2ccccc2COC(C)(C)CC)CCO1 ZINC000542711901 341018622 /nfs/dbraw/zinc/01/86/22/341018622.db2.gz MYVMNMHAESEZOA-AEFFLSMTSA-N 0 0 319.489 5.009 20 0 DKADRN CC[C@@H]1C[C@@H](CNc2ccccc2COC(C)(C)CC)CCO1 ZINC000542711903 341018567 /nfs/dbraw/zinc/01/85/67/341018567.db2.gz MYVMNMHAESEZOA-FUHWJXTLSA-N 0 0 319.489 5.009 20 0 DKADRN CC[C@@H]1C[C@H](CNc2ccccc2COC(C)(C)CC)CCO1 ZINC000542711904 341018631 /nfs/dbraw/zinc/01/86/31/341018631.db2.gz MYVMNMHAESEZOA-SJLPKXTDSA-N 0 0 319.489 5.009 20 0 DKADRN CC[C@H]1C[C@@H](CNc2ccccc2COC(C)(C)CC)CCO1 ZINC000542711905 341018604 /nfs/dbraw/zinc/01/86/04/341018604.db2.gz MYVMNMHAESEZOA-WMZOPIPTSA-N 0 0 319.489 5.009 20 0 DKADRN CCCC(C)(C)NC(=O)Nc1ccccc1COC(C)(C)CC ZINC000542715916 341018670 /nfs/dbraw/zinc/01/86/70/341018670.db2.gz KFRZTMKADFGRLI-UHFFFAOYSA-N 0 0 320.477 5.092 20 0 DKADRN CCCN(CCC)C(=O)Nc1ccccc1COC(C)(C)CC ZINC000542717097 341018704 /nfs/dbraw/zinc/01/87/04/341018704.db2.gz WBAWOBUIHZRHKQ-UHFFFAOYSA-N 0 0 320.477 5.046 20 0 DKADRN CCC[C@H](CC)NC(=O)Nc1ccccc1COC(C)(C)CC ZINC000542717966 341018806 /nfs/dbraw/zinc/01/88/06/341018806.db2.gz NHRGIURYLRFJGS-INIZCTEOSA-N 0 0 320.477 5.092 20 0 DKADRN CCC[C@@H](CC)NC(=O)Nc1ccccc1COC(C)(C)CC ZINC000542717968 341018770 /nfs/dbraw/zinc/01/87/70/341018770.db2.gz NHRGIURYLRFJGS-MRXNPFEDSA-N 0 0 320.477 5.092 20 0 DKADRN C[C@@H](NC(=O)Nc1cccc(C(F)F)c1Cl)c1ccccc1 ZINC000542718298 341018844 /nfs/dbraw/zinc/01/88/44/341018844.db2.gz MOPCRCXBHJPANP-SNVBAGLBSA-N 0 0 324.758 5.160 20 0 DKADRN Cc1ccc(NC(=O)Nc2cccc(C(F)F)c2Cl)cc1 ZINC000542720911 341018932 /nfs/dbraw/zinc/01/89/32/341018932.db2.gz CIJOEMJNBAFVGV-UHFFFAOYSA-N 0 0 310.731 5.230 20 0 DKADRN Cc1cccc(NC(=O)Nc2cccc(C(F)F)c2Cl)c1C ZINC000542721636 341018975 /nfs/dbraw/zinc/01/89/75/341018975.db2.gz JUWORTSVJPOYKS-UHFFFAOYSA-N 0 0 324.758 5.538 20 0 DKADRN C[C@H](NC(=O)Nc1cccc(C(F)F)c1Cl)c1ccccc1 ZINC000542721642 341018951 /nfs/dbraw/zinc/01/89/51/341018951.db2.gz MOPCRCXBHJPANP-JTQLQIEISA-N 0 0 324.758 5.160 20 0 DKADRN CC1(NC(=O)Nc2cccc(C(F)F)c2Cl)CCCCC1 ZINC000542724160 341018925 /nfs/dbraw/zinc/01/89/25/341018925.db2.gz VSDSTDOFCHGWKG-UHFFFAOYSA-N 0 0 316.779 5.122 20 0 DKADRN CCCN(CC(C)C)C(=O)Nc1cccc(C(F)F)c1Cl ZINC000542725647 341018992 /nfs/dbraw/zinc/01/89/92/341018992.db2.gz ZAZAJEPCCBOWAM-UHFFFAOYSA-N 0 0 318.795 5.178 20 0 DKADRN Cc1ccc([C@H](NCc2ccco2)c2ccccc2Cl)cc1 ZINC000542773154 341019751 /nfs/dbraw/zinc/01/97/51/341019751.db2.gz GAWXWVNPWXTMNT-IBGZPJMESA-N 0 0 311.812 5.121 20 0 DKADRN Cc1ccc([C@@H](NCc2ccco2)c2ccccc2Cl)cc1 ZINC000542773158 341019794 /nfs/dbraw/zinc/01/97/94/341019794.db2.gz GAWXWVNPWXTMNT-LJQANCHMSA-N 0 0 311.812 5.121 20 0 DKADRN Cc1cnc(CN[C@@H](c2cc3ccccc3o2)C(C)(C)C)s1 ZINC000542778683 341020220 /nfs/dbraw/zinc/02/02/20/341020220.db2.gz YUWWLSUMEGQEKZ-KRWDZBQOSA-N 0 0 314.454 5.075 20 0 DKADRN Cc1cnc(CN[C@H](c2cc3ccccc3o2)C(C)(C)C)s1 ZINC000542778684 341020184 /nfs/dbraw/zinc/02/01/84/341020184.db2.gz YUWWLSUMEGQEKZ-QGZVFWFLSA-N 0 0 314.454 5.075 20 0 DKADRN CCc1cccnc1[C@@H](C)Nc1ccc2oc(C(C)C)nc2c1 ZINC000542812310 341021694 /nfs/dbraw/zinc/02/16/94/341021694.db2.gz VBWVZOMBJOTVLC-CYBMUJFWSA-N 0 0 309.413 5.082 20 0 DKADRN CCc1cccnc1[C@H](C)Nc1ccc2oc(C(C)C)nc2c1 ZINC000542812311 341021751 /nfs/dbraw/zinc/02/17/51/341021751.db2.gz VBWVZOMBJOTVLC-ZDUSSCGKSA-N 0 0 309.413 5.082 20 0 DKADRN CSCc1cccc(NC(=O)c2cc(C)c(C)cc2Cl)c1 ZINC000542824131 341022169 /nfs/dbraw/zinc/02/21/69/341022169.db2.gz VKRJNUOXJKZDPI-UHFFFAOYSA-N 0 0 319.857 5.072 20 0 DKADRN Clc1ccc([C@@H](Sc2cccnn2)c2ccccc2)cc1 ZINC000542828899 341022475 /nfs/dbraw/zinc/02/24/75/341022475.db2.gz RKYVRFIATKDZCF-KRWDZBQOSA-N 0 0 312.825 5.012 20 0 DKADRN Clc1ccc([C@H](Sc2cccnn2)c2ccccc2)cc1 ZINC000542828900 341022487 /nfs/dbraw/zinc/02/24/87/341022487.db2.gz RKYVRFIATKDZCF-QGZVFWFLSA-N 0 0 312.825 5.012 20 0 DKADRN C[C@@H](Sc1nnc(C2CCC2)n1C)c1cccc2ccccc21 ZINC000542835687 341022750 /nfs/dbraw/zinc/02/27/50/341022750.db2.gz ONOWGQPLXBAOLQ-CYBMUJFWSA-N 0 0 323.465 5.089 20 0 DKADRN C[C@H](Sc1nnc(C2CCC2)n1C)c1cccc2ccccc21 ZINC000542835699 341022726 /nfs/dbraw/zinc/02/27/26/341022726.db2.gz ONOWGQPLXBAOLQ-ZDUSSCGKSA-N 0 0 323.465 5.089 20 0 DKADRN CC(=O)Nc1ccc([C@@H](C)Nc2csc3ccccc23)cc1 ZINC000542849724 341023472 /nfs/dbraw/zinc/02/34/72/341023472.db2.gz QEHULAGXJJJIPQ-GFCCVEGCSA-N 0 0 310.422 5.033 20 0 DKADRN CC(=O)Nc1ccc([C@H](C)Nc2csc3ccccc23)cc1 ZINC000542849725 341023490 /nfs/dbraw/zinc/02/34/90/341023490.db2.gz QEHULAGXJJJIPQ-LBPRGKRZSA-N 0 0 310.422 5.033 20 0 DKADRN CSc1ccc([C@H](C)Nc2ncc(C(F)(F)F)s2)cc1 ZINC000542850452 341023582 /nfs/dbraw/zinc/02/35/82/341023582.db2.gz PIEDESIVXFOEDO-QMMMGPOBSA-N 0 0 318.389 5.057 20 0 DKADRN CC(=O)Nc1ccc([C@H](C)Nc2cc(Cl)cc(Cl)c2)cc1 ZINC000542852215 341023574 /nfs/dbraw/zinc/02/35/74/341023574.db2.gz VRMHRQJIWZJJJH-JTQLQIEISA-N 0 0 323.223 5.125 20 0 DKADRN CC(=O)Nc1ccc([C@@H](C)Nc2cc(Cl)cc(Cl)c2)cc1 ZINC000542852216 341023588 /nfs/dbraw/zinc/02/35/88/341023588.db2.gz VRMHRQJIWZJJJH-SNVBAGLBSA-N 0 0 323.223 5.125 20 0 DKADRN C[C@H](Nc1cccc(CCCO)c1)c1ccc(-c2ccccc2)o1 ZINC000542872076 341024454 /nfs/dbraw/zinc/02/44/54/341024454.db2.gz GXDBFPORBWTANR-INIZCTEOSA-N 0 0 321.420 5.045 20 0 DKADRN C[C@@H](Nc1cccc(CCCO)c1)c1ccc(-c2ccccc2)o1 ZINC000542872077 341024464 /nfs/dbraw/zinc/02/44/64/341024464.db2.gz GXDBFPORBWTANR-MRXNPFEDSA-N 0 0 321.420 5.045 20 0 DKADRN Cc1cccc(C(C)C)c1NC(=O)N1CC[C@@]2(CC[C@@H](C)C2)C1 ZINC000542900374 341025615 /nfs/dbraw/zinc/02/56/15/341025615.db2.gz VMZIIHGKUDGARK-FOIQADDNSA-N 0 0 314.473 5.162 20 0 DKADRN Cc1cccc(C(C)C)c1NC(=O)N1CC[C@@]2(CC[C@H](C)C2)C1 ZINC000542900375 341025629 /nfs/dbraw/zinc/02/56/29/341025629.db2.gz VMZIIHGKUDGARK-MGPUTAFESA-N 0 0 314.473 5.162 20 0 DKADRN Cc1cccc(C(C)C)c1NC(=O)N1CC[C@]2(CC[C@@H](C)C2)C1 ZINC000542900376 341025582 /nfs/dbraw/zinc/02/55/82/341025582.db2.gz VMZIIHGKUDGARK-QRWLVFNGSA-N 0 0 314.473 5.162 20 0 DKADRN Cc1cccc(C(C)C)c1NC(=O)N1CC[C@]2(CC[C@H](C)C2)C1 ZINC000542900377 341025605 /nfs/dbraw/zinc/02/56/05/341025605.db2.gz VMZIIHGKUDGARK-YWZLYKJASA-N 0 0 314.473 5.162 20 0 DKADRN CN(Cc1cccs1)C(=O)N(c1ccccc1)c1ccccc1 ZINC000542967343 341027391 /nfs/dbraw/zinc/02/73/91/341027391.db2.gz KRZOULDSMMHQJF-UHFFFAOYSA-N 0 0 322.433 5.138 20 0 DKADRN Cc1ccccc1C1=CCN(C(=O)Nc2ccccc2C(C)C)C1 ZINC000542989896 341027974 /nfs/dbraw/zinc/02/79/74/341027974.db2.gz DJVVJHQXQFYHJX-UHFFFAOYSA-N 0 0 320.436 5.050 20 0 DKADRN CCCC1(C(=O)Nc2ccccc2NCc2ccccc2C)CC1 ZINC000543013866 341028405 /nfs/dbraw/zinc/02/84/05/341028405.db2.gz XKWHRLNYNHGYJU-UHFFFAOYSA-N 0 0 322.452 5.126 20 0 DKADRN Cc1ccc(C(=O)Nc2ccc(F)cc2Cl)c(Cl)c1C ZINC000543040814 341029085 /nfs/dbraw/zinc/02/90/85/341029085.db2.gz KZQGAEMMLJFBSC-UHFFFAOYSA-N 0 0 312.171 5.002 20 0 DKADRN Cc1cc(C)c(NC(=O)c2ccc(C)c(C)c2Cl)c(C)c1 ZINC000543041062 341029067 /nfs/dbraw/zinc/02/90/67/341029067.db2.gz NUCUQYVLMWAEBC-UHFFFAOYSA-N 0 0 301.817 5.134 20 0 DKADRN Cc1ccc(NC(=O)c2ccc(-c3cccs3)o2)c(Cl)c1 ZINC000543041705 341029123 /nfs/dbraw/zinc/02/91/23/341029123.db2.gz UMIAOJGHMDQFDL-UHFFFAOYSA-N 0 0 317.797 5.222 20 0 DKADRN Cc1ccc(NC(=O)c2ccc(C)c(C)c2Cl)c(Cl)c1 ZINC000543042216 341029127 /nfs/dbraw/zinc/02/91/27/341029127.db2.gz XUNUQNSWZULIQB-UHFFFAOYSA-N 0 0 308.208 5.171 20 0 DKADRN O=C(Nc1ccc(F)cc1Cl)c1ccc(-c2cccs2)o1 ZINC000543044427 341029222 /nfs/dbraw/zinc/02/92/22/341029222.db2.gz LLTUQADAPOGAIR-UHFFFAOYSA-N 0 0 321.760 5.053 20 0 DKADRN Cc1ccc(C(=O)Nc2c(C)cccc2C(C)C)c(Cl)c1C ZINC000543044918 341029241 /nfs/dbraw/zinc/02/92/41/341029241.db2.gz DYMSZKPNOSESMF-UHFFFAOYSA-N 0 0 315.844 5.641 20 0 DKADRN CC[C@H](C)Sc1ccc(NC(=O)[C@@H]2CCCCS2)c(C)c1 ZINC000543071802 341030506 /nfs/dbraw/zinc/03/05/06/341030506.db2.gz ICPFHDLWBGQDDB-BBRMVZONSA-N 0 0 323.527 5.110 20 0 DKADRN CC[C@@H](C)Sc1ccc(NC(=O)[C@@H]2CCCCS2)c(C)c1 ZINC000543071828 341030543 /nfs/dbraw/zinc/03/05/43/341030543.db2.gz ICPFHDLWBGQDDB-CJNGLKHVSA-N 0 0 323.527 5.110 20 0 DKADRN CC[C@@H](C)Sc1ccc(NC(=O)[C@H]2CCCCS2)c(C)c1 ZINC000543071830 341030485 /nfs/dbraw/zinc/03/04/85/341030485.db2.gz ICPFHDLWBGQDDB-CZUORRHYSA-N 0 0 323.527 5.110 20 0 DKADRN CC[C@H](C)Sc1ccc(NC(=O)[C@H]2CCCCS2)c(C)c1 ZINC000543071832 341030479 /nfs/dbraw/zinc/03/04/79/341030479.db2.gz ICPFHDLWBGQDDB-XJKSGUPXSA-N 0 0 323.527 5.110 20 0 DKADRN CSCc1cccc(NC(=O)c2ccc(C)c(C)c2Cl)c1 ZINC000543078652 341030931 /nfs/dbraw/zinc/03/09/31/341030931.db2.gz ODLSJWPAWJCXMZ-UHFFFAOYSA-N 0 0 319.857 5.072 20 0 DKADRN Cc1ccc(Cl)c(NC(=O)c2ccc(SC3CC3)cc2)c1 ZINC000543083130 341031037 /nfs/dbraw/zinc/03/10/37/341031037.db2.gz KVXSBTXTFQVKDW-UHFFFAOYSA-N 0 0 317.841 5.155 20 0 DKADRN Cc1cccc(NC(=O)c2ccc(-c3cccs3)o2)c1Cl ZINC000543096448 341031788 /nfs/dbraw/zinc/03/17/88/341031788.db2.gz ZFMCUPGVQWURDK-UHFFFAOYSA-N 0 0 317.797 5.222 20 0 DKADRN Cc1cnc([C@@H](C)Nc2ccc(-c3cccc(F)c3)c(F)c2)o1 ZINC000543139235 341033636 /nfs/dbraw/zinc/03/36/36/341033636.db2.gz CILHQLQRQYCKDY-GFCCVEGCSA-N 0 0 314.335 5.101 20 0 DKADRN Cc1cnc([C@H](C)Nc2ccc(-c3cccc(F)c3)c(F)c2)o1 ZINC000543139246 341033685 /nfs/dbraw/zinc/03/36/85/341033685.db2.gz CILHQLQRQYCKDY-LBPRGKRZSA-N 0 0 314.335 5.101 20 0 DKADRN Clc1cccc([C@@H]2CCCN2Cc2nc(C3CC3)cs2)c1 ZINC000543139834 341033756 /nfs/dbraw/zinc/03/37/56/341033756.db2.gz HGBZWSXHPKZYMI-INIZCTEOSA-N 0 0 318.873 5.011 20 0 DKADRN Clc1cccc([C@H]2CCCN2Cc2nc(C3CC3)cs2)c1 ZINC000543139836 341033863 /nfs/dbraw/zinc/03/38/63/341033863.db2.gz HGBZWSXHPKZYMI-MRXNPFEDSA-N 0 0 318.873 5.011 20 0 DKADRN C[C@@H]1CCC[C@@H]1C(=O)Nc1c(F)cc(F)cc1-c1ccccc1 ZINC000543141235 341033985 /nfs/dbraw/zinc/03/39/85/341033985.db2.gz RAAFVRDADIVEFM-DOMZBBRYSA-N 0 0 315.363 5.007 20 0 DKADRN C[C@@H]1CCC[C@H]1C(=O)Nc1c(F)cc(F)cc1-c1ccccc1 ZINC000543141236 341033971 /nfs/dbraw/zinc/03/39/71/341033971.db2.gz RAAFVRDADIVEFM-IUODEOHRSA-N 0 0 315.363 5.007 20 0 DKADRN C[C@H]1CCC[C@H]1C(=O)Nc1c(F)cc(F)cc1-c1ccccc1 ZINC000543141237 341034032 /nfs/dbraw/zinc/03/40/32/341034032.db2.gz RAAFVRDADIVEFM-SWLSCSKDSA-N 0 0 315.363 5.007 20 0 DKADRN C[C@H]1CCC[C@@H]1C(=O)Nc1c(F)cc(F)cc1-c1ccccc1 ZINC000543141238 341034037 /nfs/dbraw/zinc/03/40/37/341034037.db2.gz RAAFVRDADIVEFM-WFASDCNBSA-N 0 0 315.363 5.007 20 0 DKADRN CC(C)c1ccc([C@@H](C)Sc2nnc(C3CC3)s2)cc1 ZINC000543142045 341034028 /nfs/dbraw/zinc/03/40/28/341034028.db2.gz ABHRUCSWCBWZNQ-LLVKDONJSA-N 0 0 304.484 5.392 20 0 DKADRN CC(C)c1ccc([C@H](C)Sc2nnc(C3CC3)s2)cc1 ZINC000543142046 341034017 /nfs/dbraw/zinc/03/40/17/341034017.db2.gz ABHRUCSWCBWZNQ-NSHDSACASA-N 0 0 304.484 5.392 20 0 DKADRN CC(C)c1ccc([C@@H](C)Sc2nnc(C3CCC3)n2C)cc1 ZINC000543146790 341034215 /nfs/dbraw/zinc/03/42/15/341034215.db2.gz CLMSLKVANQFRLR-CYBMUJFWSA-N 0 0 315.486 5.059 20 0 DKADRN CC(C)c1ccc([C@H](C)Sc2nnc(C3CCC3)n2C)cc1 ZINC000543146793 341034250 /nfs/dbraw/zinc/03/42/50/341034250.db2.gz CLMSLKVANQFRLR-ZDUSSCGKSA-N 0 0 315.486 5.059 20 0 DKADRN C[C@H](SCc1nc(C2CC2)cs1)c1nc2ccccc2o1 ZINC000543149762 341034384 /nfs/dbraw/zinc/03/43/84/341034384.db2.gz HMGSFFAAHWAYMS-JTQLQIEISA-N 0 0 316.451 5.156 20 0 DKADRN C[C@@H](SCc1nc(C2CC2)cs1)c1nc2ccccc2o1 ZINC000543149763 341034358 /nfs/dbraw/zinc/03/43/58/341034358.db2.gz HMGSFFAAHWAYMS-SNVBAGLBSA-N 0 0 316.451 5.156 20 0 DKADRN CC(C)c1ccc([C@@H](C)SCc2nnc(C3CC3)o2)cc1 ZINC000543150860 341034299 /nfs/dbraw/zinc/03/42/99/341034299.db2.gz ISZUEXKYVZDPTM-GFCCVEGCSA-N 0 0 302.443 5.065 20 0 DKADRN CC(C)c1ccc([C@H](C)SCc2nnc(C3CC3)o2)cc1 ZINC000543150861 341034357 /nfs/dbraw/zinc/03/43/57/341034357.db2.gz ISZUEXKYVZDPTM-LBPRGKRZSA-N 0 0 302.443 5.065 20 0 DKADRN Cc1csc(CNc2ccc(-c3cccc(F)c3)c(F)c2)n1 ZINC000543151276 341034459 /nfs/dbraw/zinc/03/44/59/341034459.db2.gz KJSZLXDSOBBPPH-UHFFFAOYSA-N 0 0 316.376 5.009 20 0 DKADRN CC(C)c1nnc(CS[C@H](C)c2ccc(C(C)C)cc2)o1 ZINC000543151575 341034487 /nfs/dbraw/zinc/03/44/87/341034487.db2.gz WBGDQIUZKCHHNZ-CYBMUJFWSA-N 0 0 304.459 5.311 20 0 DKADRN CC(C)c1nnc(CS[C@@H](C)c2ccc(C(C)C)cc2)o1 ZINC000543151576 341034428 /nfs/dbraw/zinc/03/44/28/341034428.db2.gz WBGDQIUZKCHHNZ-ZDUSSCGKSA-N 0 0 304.459 5.311 20 0 DKADRN Cc1nnc(CS[C@H](C)c2ccc(C(C)C)cc2)n1C1CC1 ZINC000543151769 341034457 /nfs/dbraw/zinc/03/44/57/341034457.db2.gz ZRDKNVYCXZTTDG-CYBMUJFWSA-N 0 0 315.486 5.039 20 0 DKADRN Cc1nnc(CS[C@@H](C)c2ccc(C(C)C)cc2)n1C1CC1 ZINC000543151771 341034427 /nfs/dbraw/zinc/03/44/27/341034427.db2.gz ZRDKNVYCXZTTDG-ZDUSSCGKSA-N 0 0 315.486 5.039 20 0 DKADRN CC(C)(C)c1csc(CSCc2nc(C3CC3)cs2)n1 ZINC000543151774 341034449 /nfs/dbraw/zinc/03/44/49/341034449.db2.gz YPCNSMRTYWZVAT-UHFFFAOYSA-N 0 0 324.540 5.208 20 0 DKADRN CCn1c(S[C@H](C)c2ccc(C(C)C)cc2)nnc1C1CC1 ZINC000543152270 341034458 /nfs/dbraw/zinc/03/44/58/341034458.db2.gz HROLOOYSOYGNHI-CYBMUJFWSA-N 0 0 315.486 5.152 20 0 DKADRN CCn1c(S[C@@H](C)c2ccc(C(C)C)cc2)nnc1C1CC1 ZINC000543152272 341034490 /nfs/dbraw/zinc/03/44/90/341034490.db2.gz HROLOOYSOYGNHI-ZDUSSCGKSA-N 0 0 315.486 5.152 20 0 DKADRN CC[C@H](C)Sc1ccc(NC(=O)CCCOC(C)C)c(C)c1 ZINC000543159410 341034809 /nfs/dbraw/zinc/03/48/09/341034809.db2.gz BQTPIYKDJWBZNK-HNNXBMFYSA-N 0 0 323.502 5.029 20 0 DKADRN CC[C@@H](C)Sc1ccc(NC(=O)CCCOC(C)C)c(C)c1 ZINC000543159411 341034715 /nfs/dbraw/zinc/03/47/15/341034715.db2.gz BQTPIYKDJWBZNK-OAHLLOKOSA-N 0 0 323.502 5.029 20 0 DKADRN c1csc(-c2cccc(NCc3nc(C4CC4)cs3)c2)c1 ZINC000543161805 341034881 /nfs/dbraw/zinc/03/48/81/341034881.db2.gz VJXMHUINYUXRML-UHFFFAOYSA-N 0 0 312.463 5.361 20 0 DKADRN c1sc(CNc2ccc3oc4ccccc4c3c2)nc1C1CC1 ZINC000543163471 341034849 /nfs/dbraw/zinc/03/48/49/341034849.db2.gz JAQGBCZHCGEDDI-UHFFFAOYSA-N 0 0 320.417 5.532 20 0 DKADRN c1sc(CNc2ccc(-c3ccccc3)cc2)nc1C1CC1 ZINC000543165454 341034962 /nfs/dbraw/zinc/03/49/62/341034962.db2.gz DMEDGNBEFIIXGF-UHFFFAOYSA-N 0 0 306.434 5.300 20 0 DKADRN c1sc(CNc2ccccc2-c2ccccc2)nc1C1CC1 ZINC000543165960 341035038 /nfs/dbraw/zinc/03/50/38/341035038.db2.gz LQCAJWMVYQQBDU-UHFFFAOYSA-N 0 0 306.434 5.300 20 0 DKADRN CC(C)c1cnc(CNc2ccccc2OC(C)(C)C)s1 ZINC000543238279 341037573 /nfs/dbraw/zinc/03/75/73/341037573.db2.gz HPYQHIRHYMGREC-UHFFFAOYSA-N 0 0 304.459 5.056 20 0 DKADRN Cc1noc(C2CC2)c1NC(=O)C/C=C\c1ccc(C(C)C)cc1 ZINC000543391282 341041659 /nfs/dbraw/zinc/04/16/59/341041659.db2.gz KJRJARPGLUSLSY-PLNGDYQASA-N 0 0 324.424 5.026 20 0 DKADRN CCN(Cc1ccc(Cl)s1)Cc1ncc(C(C)C)s1 ZINC000543394922 341041687 /nfs/dbraw/zinc/04/16/87/341041687.db2.gz QKBVCJXHHOJGLU-UHFFFAOYSA-N 0 0 314.907 5.004 20 0 DKADRN CCCNc1ccccc1NC(=O)c1oc2c(cccc2C)c1C ZINC000543410205 341042895 /nfs/dbraw/zinc/04/28/95/341042895.db2.gz ZVGGKPYHGTUQFE-UHFFFAOYSA-N 0 0 322.408 5.124 20 0 DKADRN Fc1ccc([C@@H](Nc2cccc(Cl)c2)c2cccnc2)cc1 ZINC000543425441 341043925 /nfs/dbraw/zinc/04/39/25/341043925.db2.gz ZJNXTBPFHMUGHZ-GOSISDBHSA-N 0 0 312.775 5.076 20 0 DKADRN Fc1ccc([C@H](Nc2cccc(Cl)c2)c2cccnc2)cc1 ZINC000543425442 341043916 /nfs/dbraw/zinc/04/39/16/341043916.db2.gz ZJNXTBPFHMUGHZ-SFHVURJKSA-N 0 0 312.775 5.076 20 0 DKADRN Fc1ccc([C@@H](Nc2ccc(Cl)cc2)c2cccnc2)cc1 ZINC000543426650 341044053 /nfs/dbraw/zinc/04/40/53/341044053.db2.gz GUGPAKKOOIUKFW-GOSISDBHSA-N 0 0 312.775 5.076 20 0 DKADRN Fc1ccc([C@H](Nc2ccc(Cl)cc2)c2cccnc2)cc1 ZINC000543426652 341043969 /nfs/dbraw/zinc/04/39/69/341043969.db2.gz GUGPAKKOOIUKFW-SFHVURJKSA-N 0 0 312.775 5.076 20 0 DKADRN Fc1ccc([C@H](Nc2ccc(Cl)cc2)c2ccccc2)nc1 ZINC000543427308 341044032 /nfs/dbraw/zinc/04/40/32/341044032.db2.gz XRCVOITZIVIXOM-GOSISDBHSA-N 0 0 312.775 5.076 20 0 DKADRN Fc1ccc([C@@H](Nc2ccc(Cl)cc2)c2ccccc2)nc1 ZINC000543427309 341044110 /nfs/dbraw/zinc/04/41/10/341044110.db2.gz XRCVOITZIVIXOM-SFHVURJKSA-N 0 0 312.775 5.076 20 0 DKADRN Cc1cccc([C@@H](Nc2ncc(C(C)C)s2)c2ccccn2)c1 ZINC000543437382 341044397 /nfs/dbraw/zinc/04/43/97/341044397.db2.gz UFWQPLFDUPVFSK-GOSISDBHSA-N 0 0 323.465 5.171 20 0 DKADRN Cc1cccc([C@H](Nc2ncc(C(C)C)s2)c2ccccn2)c1 ZINC000543437385 341044459 /nfs/dbraw/zinc/04/44/59/341044459.db2.gz UFWQPLFDUPVFSK-SFHVURJKSA-N 0 0 323.465 5.171 20 0 DKADRN C[C@H](CCC(C)(C)C)C(=O)Nc1ccccc1CC(F)(F)F ZINC000543438491 341044562 /nfs/dbraw/zinc/04/45/62/341044562.db2.gz IFXTXTHQDNQOER-GFCCVEGCSA-N 0 0 315.379 5.192 20 0 DKADRN C[C@@H](CCC(C)(C)C)C(=O)Nc1ccccc1CC(F)(F)F ZINC000543438494 341044620 /nfs/dbraw/zinc/04/46/20/341044620.db2.gz IFXTXTHQDNQOER-LBPRGKRZSA-N 0 0 315.379 5.192 20 0 DKADRN CCCCc1nc(CN[C@H](C)c2cc(C)sc2C)cs1 ZINC000543440362 341044563 /nfs/dbraw/zinc/04/45/63/341044563.db2.gz ZABKUOUSBZZBPI-GFCCVEGCSA-N 0 0 308.516 5.015 20 0 DKADRN CCCCc1nc(CN[C@@H](C)c2cc(C)sc2C)cs1 ZINC000543440364 341044588 /nfs/dbraw/zinc/04/45/88/341044588.db2.gz ZABKUOUSBZZBPI-LBPRGKRZSA-N 0 0 308.516 5.015 20 0 DKADRN CCc1nc2sc3c(c2c(-c2ccc(C)cc2)c1C)CCOC3 ZINC000543446981 341045123 /nfs/dbraw/zinc/04/51/23/341045123.db2.gz GNHOVJHRAXBOIR-UHFFFAOYSA-N 0 0 323.461 5.215 20 0 DKADRN CC(C)(C)N(Cc1ccccc1)C(=O)c1cccc(C(F)F)c1 ZINC000543450607 341045338 /nfs/dbraw/zinc/04/53/38/341045338.db2.gz NSMCVQQFXWHYDL-UHFFFAOYSA-N 0 0 317.379 5.065 20 0 DKADRN C[C@H](CCC(C)(C)C)C(=O)N1CCCCC[C@H]1c1ccco1 ZINC000543480083 341046532 /nfs/dbraw/zinc/04/65/32/341046532.db2.gz GZXXUYBCZXOAKX-CVEARBPZSA-N 0 0 305.462 5.186 20 0 DKADRN C[C@@H](CCC(C)(C)C)C(=O)N1CCCCC[C@H]1c1ccco1 ZINC000543480085 341046688 /nfs/dbraw/zinc/04/66/88/341046688.db2.gz GZXXUYBCZXOAKX-HOTGVXAUSA-N 0 0 305.462 5.186 20 0 DKADRN C[C@H](CCC(C)(C)C)C(=O)N1CCCCC[C@@H]1c1ccco1 ZINC000543480086 341046668 /nfs/dbraw/zinc/04/66/68/341046668.db2.gz GZXXUYBCZXOAKX-HZPDHXFCSA-N 0 0 305.462 5.186 20 0 DKADRN C[C@@H](CCC(C)(C)C)C(=O)N1CCCCC[C@@H]1c1ccco1 ZINC000543480088 341046662 /nfs/dbraw/zinc/04/66/62/341046662.db2.gz GZXXUYBCZXOAKX-JKSUJKDBSA-N 0 0 305.462 5.186 20 0 DKADRN CCCc1nc(CN[C@@H](CC(C)C)c2cccs2)cs1 ZINC000543484338 341046779 /nfs/dbraw/zinc/04/67/79/341046779.db2.gz DFLXEHYLBCIMFC-AWEZNQCLSA-N 0 0 308.516 5.034 20 0 DKADRN CCCc1nc(CN[C@H](CC(C)C)c2cccs2)cs1 ZINC000543484339 341046789 /nfs/dbraw/zinc/04/67/89/341046789.db2.gz DFLXEHYLBCIMFC-CQSZACIVSA-N 0 0 308.516 5.034 20 0 DKADRN CC(C)C[C@H](N[C@@H](C)c1ncc(C(C)(C)C)o1)c1cccs1 ZINC000543485838 341047038 /nfs/dbraw/zinc/04/70/38/341047038.db2.gz DHZLBBBNSDRTSS-KBPBESRZSA-N 0 0 320.502 5.472 20 0 DKADRN CC(C)C[C@H](N[C@H](C)c1ncc(C(C)(C)C)o1)c1cccs1 ZINC000543485839 341047007 /nfs/dbraw/zinc/04/70/07/341047007.db2.gz DHZLBBBNSDRTSS-KGLIPLIRSA-N 0 0 320.502 5.472 20 0 DKADRN CC(C)C[C@@H](N[C@@H](C)c1ncc(C(C)(C)C)o1)c1cccs1 ZINC000543485840 341046966 /nfs/dbraw/zinc/04/69/66/341046966.db2.gz DHZLBBBNSDRTSS-UONOGXRCSA-N 0 0 320.502 5.472 20 0 DKADRN CC(C)C[C@@H](N[C@H](C)c1ncc(C(C)(C)C)o1)c1cccs1 ZINC000543485841 341047030 /nfs/dbraw/zinc/04/70/30/341047030.db2.gz DHZLBBBNSDRTSS-ZIAGYGMSSA-N 0 0 320.502 5.472 20 0 DKADRN CCCc1nc(CN[C@H](CC)c2ccc(Cl)s2)cs1 ZINC000543488333 341047208 /nfs/dbraw/zinc/04/72/08/341047208.db2.gz IWXRBPDPAGZWQT-LLVKDONJSA-N 0 0 314.907 5.051 20 0 DKADRN CCCc1nc(CN[C@@H](CC)c2ccc(Cl)s2)cs1 ZINC000543488334 341047071 /nfs/dbraw/zinc/04/70/71/341047071.db2.gz IWXRBPDPAGZWQT-NSHDSACASA-N 0 0 314.907 5.051 20 0 DKADRN CCC(CC)CC(=O)Nc1ccccc1COC(C)(C)CC ZINC000543493060 341047351 /nfs/dbraw/zinc/04/73/51/341047351.db2.gz YTXPXBQGEHCLDS-UHFFFAOYSA-N 0 0 305.462 5.157 20 0 DKADRN CCC[C@H](C)CC(=O)Nc1ccccc1COC(C)(C)CC ZINC000543494110 341047406 /nfs/dbraw/zinc/04/74/06/341047406.db2.gz WOERUVDDEXSVLE-HNNXBMFYSA-N 0 0 305.462 5.157 20 0 DKADRN CCC[C@@H](C)CC(=O)Nc1ccccc1COC(C)(C)CC ZINC000543494111 341047487 /nfs/dbraw/zinc/04/74/87/341047487.db2.gz WOERUVDDEXSVLE-OAHLLOKOSA-N 0 0 305.462 5.157 20 0 DKADRN CCC(C)(C)OCc1ccccc1NC(=O)C1(CC)CCCC1 ZINC000543495868 341047520 /nfs/dbraw/zinc/04/75/20/341047520.db2.gz FRASHNWETUFGPE-UHFFFAOYSA-N 0 0 317.473 5.301 20 0 DKADRN CCCc1ccc(CN[C@@H](C)c2ncc(-c3ccccc3)o2)cc1 ZINC000543496351 341047564 /nfs/dbraw/zinc/04/75/64/341047564.db2.gz FCLJNHLEPOZSIW-INIZCTEOSA-N 0 0 320.436 5.145 20 0 DKADRN CCCc1ccc(CN[C@H](C)c2ncc(-c3ccccc3)o2)cc1 ZINC000543496356 341047521 /nfs/dbraw/zinc/04/75/21/341047521.db2.gz FCLJNHLEPOZSIW-MRXNPFEDSA-N 0 0 320.436 5.145 20 0 DKADRN Cc1cc(C)c(CN[C@@H](C)c2ncc(-c3ccccc3)o2)c(C)c1 ZINC000543499659 341047616 /nfs/dbraw/zinc/04/76/16/341047616.db2.gz NLBTVHIGZLXIQG-KRWDZBQOSA-N 0 0 320.436 5.118 20 0 DKADRN Cc1cc(C)c(CN[C@H](C)c2ncc(-c3ccccc3)o2)c(C)c1 ZINC000543499661 341047655 /nfs/dbraw/zinc/04/76/55/341047655.db2.gz NLBTVHIGZLXIQG-QGZVFWFLSA-N 0 0 320.436 5.118 20 0 DKADRN C[C@@H](C(=O)Nc1cccc(C(F)F)c1Cl)c1cccs1 ZINC000543504737 341047860 /nfs/dbraw/zinc/04/78/60/341047860.db2.gz IXEBVONSJWGDNN-MRVPVSSYSA-N 0 0 315.772 5.081 20 0 DKADRN C[C@H](C(=O)Nc1cccc(C(F)F)c1Cl)c1cccs1 ZINC000543504743 341047835 /nfs/dbraw/zinc/04/78/35/341047835.db2.gz IXEBVONSJWGDNN-QMMMGPOBSA-N 0 0 315.772 5.081 20 0 DKADRN Cc1cccc(C)c1CC(=O)Nc1cccc(C(F)F)c1Cl ZINC000543505156 341047991 /nfs/dbraw/zinc/04/79/91/341047991.db2.gz PWOWEYDVTPSRKK-UHFFFAOYSA-N 0 0 323.770 5.076 20 0 DKADRN C[C@@H]1CCC[C@@H](C(=O)Nc2cccc(C(F)F)c2Cl)C1 ZINC000543505995 341048017 /nfs/dbraw/zinc/04/80/17/341048017.db2.gz WPUQKDKWCQFVKS-NXEZZACHSA-N 0 0 301.764 5.042 20 0 DKADRN C[C@H]1CCC[C@H](C(=O)Nc2cccc(C(F)F)c2Cl)C1 ZINC000543505998 341047965 /nfs/dbraw/zinc/04/79/65/341047965.db2.gz WPUQKDKWCQFVKS-UWVGGRQHSA-N 0 0 301.764 5.042 20 0 DKADRN C[C@H]1CCC[C@@H](C(=O)Nc2cccc(C(F)F)c2Cl)C1 ZINC000543505999 341047924 /nfs/dbraw/zinc/04/79/24/341047924.db2.gz WPUQKDKWCQFVKS-VHSXEESVSA-N 0 0 301.764 5.042 20 0 DKADRN C[C@@H]1CCC[C@H](C(=O)Nc2cccc(C(F)F)c2Cl)C1 ZINC000543506001 341048026 /nfs/dbraw/zinc/04/80/26/341048026.db2.gz WPUQKDKWCQFVKS-ZJUUUORDSA-N 0 0 301.764 5.042 20 0 DKADRN Cc1ccc(C(=O)Nc2cccc(C(F)F)c2Cl)c(C)c1 ZINC000543506651 341047916 /nfs/dbraw/zinc/04/79/16/341047916.db2.gz BJCOLNYFHVFNDP-UHFFFAOYSA-N 0 0 309.743 5.147 20 0 DKADRN O=C(Nc1cccc(C(F)F)c1Cl)c1ccccc1Cl ZINC000543506679 341047993 /nfs/dbraw/zinc/04/79/93/341047993.db2.gz DLQJIEYNBHKUOO-UHFFFAOYSA-N 0 0 316.134 5.183 20 0 DKADRN Cc1cc(C)cc(C(=O)Nc2cccc(C(F)F)c2Cl)c1 ZINC000543507099 341047970 /nfs/dbraw/zinc/04/79/70/341047970.db2.gz PWLNAWQBBOIDHP-UHFFFAOYSA-N 0 0 309.743 5.147 20 0 DKADRN CC(C)c1ccc(C(=O)Nc2cccc(C(F)F)c2Cl)cc1 ZINC000543507120 341047902 /nfs/dbraw/zinc/04/79/02/341047902.db2.gz RQMYMJLILHMUMZ-UHFFFAOYSA-N 0 0 323.770 5.653 20 0 DKADRN O=C(Nc1cccc(C(F)F)c1Cl)[C@H]1CC12CCCCC2 ZINC000543507272 341047992 /nfs/dbraw/zinc/04/79/92/341047992.db2.gz VZCGRQNKLZGTHD-LLVKDONJSA-N 0 0 313.775 5.187 20 0 DKADRN O=C(Nc1cccc(C(F)F)c1Cl)[C@@H]1CC12CCCCC2 ZINC000543507273 341047936 /nfs/dbraw/zinc/04/79/36/341047936.db2.gz VZCGRQNKLZGTHD-NSHDSACASA-N 0 0 313.775 5.187 20 0 DKADRN CCCC1(C(=O)Nc2cccc(C(F)F)c2Cl)CCC1 ZINC000543507337 341048018 /nfs/dbraw/zinc/04/80/18/341048018.db2.gz YMAYGSVUUYBPOS-UHFFFAOYSA-N 0 0 301.764 5.187 20 0 DKADRN O=C(Nc1cccc(C(F)F)c1Cl)C1CCCCCC1 ZINC000543507795 341048142 /nfs/dbraw/zinc/04/81/42/341048142.db2.gz AGRZNMNWCKWHMG-UHFFFAOYSA-N 0 0 301.764 5.187 20 0 DKADRN CC(C)(C(=O)Nc1cccc(C(F)F)c1Cl)c1ccccc1 ZINC000543507812 341048123 /nfs/dbraw/zinc/04/81/23/341048123.db2.gz BMAFMCCHBBMQLM-UHFFFAOYSA-N 0 0 323.770 5.194 20 0 DKADRN C[C@@H](C(=O)Nc1cccc(C(F)F)c1Cl)c1ccsc1 ZINC000543508232 341048151 /nfs/dbraw/zinc/04/81/51/341048151.db2.gz JRLUWLVKCAEKCL-MRVPVSSYSA-N 0 0 315.772 5.081 20 0 DKADRN C[C@H](C(=O)Nc1cccc(C(F)F)c1Cl)c1ccsc1 ZINC000543508234 341048172 /nfs/dbraw/zinc/04/81/72/341048172.db2.gz JRLUWLVKCAEKCL-QMMMGPOBSA-N 0 0 315.772 5.081 20 0 DKADRN CCc1ccccc1C(=O)Nc1cccc(C(F)F)c1Cl ZINC000543508278 341048133 /nfs/dbraw/zinc/04/81/33/341048133.db2.gz QZVUFQVLJVPAMY-UHFFFAOYSA-N 0 0 309.743 5.092 20 0 DKADRN O=C(Nc1cccc(C(F)F)c1Cl)C1CCC(F)(F)CC1 ZINC000543508697 341048141 /nfs/dbraw/zinc/04/81/41/341048141.db2.gz WDTOWGHVDRMDMS-UHFFFAOYSA-N 0 0 323.717 5.042 20 0 DKADRN CC(C)(C(=O)Nc1cccc(C(F)F)c1Cl)C1CCCC1 ZINC000543508934 341048076 /nfs/dbraw/zinc/04/80/76/341048076.db2.gz UOHVVCDRKFKDIU-UHFFFAOYSA-N 0 0 315.791 5.433 20 0 DKADRN Cc1cc(C)c(C(=O)Nc2cccc(C(F)F)c2Cl)c(C)c1 ZINC000543509952 341048046 /nfs/dbraw/zinc/04/80/46/341048046.db2.gz LKSMGEYEDUJFET-UHFFFAOYSA-N 0 0 323.770 5.455 20 0 DKADRN C[C@@H]1CCCN(C(=O)c2cccc(C(F)F)c2)c2ccccc21 ZINC000543518046 341048364 /nfs/dbraw/zinc/04/83/64/341048364.db2.gz NUBSCNJPTXDRND-CYBMUJFWSA-N 0 0 315.363 5.168 20 0 DKADRN C[C@H]1CCCN(C(=O)c2cccc(C(F)F)c2)c2ccccc21 ZINC000543518047 341048306 /nfs/dbraw/zinc/04/83/06/341048306.db2.gz NUBSCNJPTXDRND-ZDUSSCGKSA-N 0 0 315.363 5.168 20 0 DKADRN Cc1ccc(NC(=O)N2CCC(c3ccccc3C)CC2)c(C)c1 ZINC000543576413 341049386 /nfs/dbraw/zinc/04/93/86/341049386.db2.gz ILKVSDFIPNZJLT-UHFFFAOYSA-N 0 0 322.452 5.023 20 0 DKADRN Cc1cccc(NC(=O)N2CCC(c3ccccc3C)CC2)c1C ZINC000543577476 341049353 /nfs/dbraw/zinc/04/93/53/341049353.db2.gz SUQGSPOHUQRGNK-UHFFFAOYSA-N 0 0 322.452 5.023 20 0 DKADRN C[C@H](CCC(F)(F)F)Nc1cccc(C(F)F)c1Cl ZINC000543595416 341050076 /nfs/dbraw/zinc/05/00/76/341050076.db2.gz TZUSNKVHSDIQGQ-SSDOTTSWSA-N 0 0 301.686 5.421 20 0 DKADRN C[C@@H](CCC(F)(F)F)Nc1cccc(C(F)F)c1Cl ZINC000543595417 341050032 /nfs/dbraw/zinc/05/00/32/341050032.db2.gz TZUSNKVHSDIQGQ-ZETCQYMHSA-N 0 0 301.686 5.421 20 0 DKADRN CC(C)c1csc(CN[C@H]2CCCc3c(Cl)cccc32)n1 ZINC000543595657 341050043 /nfs/dbraw/zinc/05/00/43/341050043.db2.gz RDCBIORLNGGTFI-HNNXBMFYSA-N 0 0 320.889 5.087 20 0 DKADRN CC(C)c1csc(CN[C@@H]2CCCc3c(Cl)cccc32)n1 ZINC000543595660 341049990 /nfs/dbraw/zinc/04/99/90/341049990.db2.gz RDCBIORLNGGTFI-OAHLLOKOSA-N 0 0 320.889 5.087 20 0 DKADRN CC[C@@H](Nc1cccc(C(F)F)c1Cl)c1ccc(F)cn1 ZINC000543596640 341050183 /nfs/dbraw/zinc/05/01/83/341050183.db2.gz WKROXBLJEJIJLT-LLVKDONJSA-N 0 0 314.738 5.375 20 0 DKADRN CC[C@H](Nc1cccc(C(F)F)c1Cl)c1ccc(F)cn1 ZINC000543596641 341050132 /nfs/dbraw/zinc/05/01/32/341050132.db2.gz WKROXBLJEJIJLT-NSHDSACASA-N 0 0 314.738 5.375 20 0 DKADRN C[C@H](Nc1cccc(C(F)F)c1Cl)c1ccc2c(c1)COC2 ZINC000543596918 341050145 /nfs/dbraw/zinc/05/01/45/341050145.db2.gz HZWRWAYNBJBBQS-JTQLQIEISA-N 0 0 323.770 5.481 20 0 DKADRN C[C@@H](Nc1cccc(C(F)F)c1Cl)c1ccc2c(c1)COC2 ZINC000543596921 341050118 /nfs/dbraw/zinc/05/01/18/341050118.db2.gz HZWRWAYNBJBBQS-SNVBAGLBSA-N 0 0 323.770 5.481 20 0 DKADRN CCC[C@@H](Nc1cccc(C(F)F)c1Cl)c1cccnc1 ZINC000543599678 341050367 /nfs/dbraw/zinc/05/03/67/341050367.db2.gz XYVOVPOJZBZMDO-CYBMUJFWSA-N 0 0 310.775 5.626 20 0 DKADRN CCC[C@H](Nc1cccc(C(F)F)c1Cl)c1cccnc1 ZINC000543599680 341050454 /nfs/dbraw/zinc/05/04/54/341050454.db2.gz XYVOVPOJZBZMDO-ZDUSSCGKSA-N 0 0 310.775 5.626 20 0 DKADRN CCC[C@H](NCc1c(Cl)cccc1Cl)c1cccnc1 ZINC000543600554 341050548 /nfs/dbraw/zinc/05/05/48/341050548.db2.gz QJZNTXBKUSCZTE-INIZCTEOSA-N 0 0 309.240 5.019 20 0 DKADRN CCC[C@@H](NCc1c(Cl)cccc1Cl)c1cccnc1 ZINC000543600559 341050550 /nfs/dbraw/zinc/05/05/50/341050550.db2.gz QJZNTXBKUSCZTE-MRXNPFEDSA-N 0 0 309.240 5.019 20 0 DKADRN CCc1nc(CNc2ccccc2COC(C)(C)CC)cs1 ZINC000543613315 341051144 /nfs/dbraw/zinc/05/11/44/341051144.db2.gz ABYLVVDKPPPILK-UHFFFAOYSA-N 0 0 318.486 5.023 20 0 DKADRN CCC(C)(C)OCc1ccccc1NCc1sccc1OC ZINC000543616037 341051180 /nfs/dbraw/zinc/05/11/80/341051180.db2.gz CGKQLSFGSSASLM-UHFFFAOYSA-N 0 0 319.470 5.074 20 0 DKADRN CCc1cnc(CNc2ccccc2COC(C)(C)CC)s1 ZINC000543616642 341051171 /nfs/dbraw/zinc/05/11/71/341051171.db2.gz KCEKJZIQUNSJHV-UHFFFAOYSA-N 0 0 318.486 5.023 20 0 DKADRN CCC(C)(C)OCc1ccccc1NCC1(CC)CCOCC1 ZINC000543616687 341051126 /nfs/dbraw/zinc/05/11/26/341051126.db2.gz KSXDONHHLUMSPA-UHFFFAOYSA-N 0 0 319.489 5.011 20 0 DKADRN CCC(C)(C)OCc1ccccc1NCc1ccc(Cl)o1 ZINC000543617335 341051193 /nfs/dbraw/zinc/05/11/93/341051193.db2.gz WKMPAOPQCBISDE-UHFFFAOYSA-N 0 0 307.821 5.250 20 0 DKADRN CCC(C)(C)OCc1ccccc1NCc1ccccc1OC ZINC000543617357 341051192 /nfs/dbraw/zinc/05/11/92/341051192.db2.gz SVHGECGJNDJUNW-UHFFFAOYSA-N 0 0 313.441 5.013 20 0 DKADRN CCc1ncc(CNc2ccccc2COC(C)(C)CC)s1 ZINC000543617416 341051169 /nfs/dbraw/zinc/05/11/69/341051169.db2.gz VBBITXQESWNBFM-UHFFFAOYSA-N 0 0 318.486 5.023 20 0 DKADRN COc1ccc(CNc2cccc(C(F)F)c2Cl)cc1F ZINC000543619651 341051274 /nfs/dbraw/zinc/05/12/74/341051274.db2.gz HHOROLYATQLFKJ-UHFFFAOYSA-N 0 0 315.722 5.037 20 0 DKADRN COCc1cccc(CNc2cccc(C(F)F)c2Cl)c1 ZINC000543619662 341051314 /nfs/dbraw/zinc/05/13/14/341051314.db2.gz JXRYFNPCDIQKFS-UHFFFAOYSA-N 0 0 311.759 5.036 20 0 DKADRN FC(F)c1cccc(NCc2cnc(C3CC3)s2)c1Cl ZINC000543621690 341051471 /nfs/dbraw/zinc/05/14/71/341051471.db2.gz YPRZCLYPZJJARZ-UHFFFAOYSA-N 0 0 314.788 5.224 20 0 DKADRN CCC[C@@H](Nc1cccc(-c2nc(C)cs2)c1)c1cccnc1 ZINC000543625484 341051583 /nfs/dbraw/zinc/05/15/83/341051583.db2.gz JJPFSBFKUUTTFU-GOSISDBHSA-N 0 0 323.465 5.467 20 0 DKADRN CCC[C@H](Nc1cccc(-c2nc(C)cs2)c1)c1cccnc1 ZINC000543625485 341051609 /nfs/dbraw/zinc/05/16/09/341051609.db2.gz JJPFSBFKUUTTFU-SFHVURJKSA-N 0 0 323.465 5.467 20 0 DKADRN CCC[C@@H](Nc1cccc(CSCC)c1)c1cccnc1 ZINC000543625497 341051542 /nfs/dbraw/zinc/05/15/42/341051542.db2.gz KDKDCPVFFGHELC-GOSISDBHSA-N 0 0 300.471 5.288 20 0 DKADRN CCC[C@H](Nc1cccc(CSCC)c1)c1cccnc1 ZINC000543625498 341051596 /nfs/dbraw/zinc/05/15/96/341051596.db2.gz KDKDCPVFFGHELC-SFHVURJKSA-N 0 0 300.471 5.288 20 0 DKADRN CCC[C@H](N[C@H](C)c1ccon1)c1ccc(Cl)c(Cl)c1 ZINC000543627030 341051769 /nfs/dbraw/zinc/05/17/69/341051769.db2.gz QTPFUDZYNUQASS-BMIGLBTASA-N 0 0 313.228 5.173 20 0 DKADRN CCC[C@H](N[C@@H](C)c1ccon1)c1ccc(Cl)c(Cl)c1 ZINC000543627031 341051795 /nfs/dbraw/zinc/05/17/95/341051795.db2.gz QTPFUDZYNUQASS-BONVTDFDSA-N 0 0 313.228 5.173 20 0 DKADRN CCC[C@@H](N[C@H](C)c1ccon1)c1ccc(Cl)c(Cl)c1 ZINC000543627032 341051832 /nfs/dbraw/zinc/05/18/32/341051832.db2.gz QTPFUDZYNUQASS-MEBBXXQBSA-N 0 0 313.228 5.173 20 0 DKADRN CCC[C@@H](N[C@@H](C)c1ccon1)c1ccc(Cl)c(Cl)c1 ZINC000543627033 341051800 /nfs/dbraw/zinc/05/18/00/341051800.db2.gz QTPFUDZYNUQASS-ZUZCIYMTSA-N 0 0 313.228 5.173 20 0 DKADRN CC[C@H](Nc1ccc(SC2CCCC2)cc1)c1ccn(C)n1 ZINC000543635515 341052494 /nfs/dbraw/zinc/05/24/94/341052494.db2.gz GPXKYAGLAFBZOS-KRWDZBQOSA-N 0 0 315.486 5.018 20 0 DKADRN CC[C@@H](Nc1ccc(SC2CCCC2)cc1)c1ccn(C)n1 ZINC000543635517 341052410 /nfs/dbraw/zinc/05/24/10/341052410.db2.gz GPXKYAGLAFBZOS-QGZVFWFLSA-N 0 0 315.486 5.018 20 0 DKADRN CC(C)(C)C(CSc1ccncc1)CSc1ccncc1 ZINC000543638585 341052641 /nfs/dbraw/zinc/05/26/41/341052641.db2.gz YPVBZFUUSJTWFX-UHFFFAOYSA-N 0 0 318.511 5.023 20 0 DKADRN CN(C(=O)Nc1cccc(C(F)F)c1Cl)C1CCCCC1 ZINC000543650385 341053072 /nfs/dbraw/zinc/05/30/72/341053072.db2.gz DURRJTMOFRLXJG-UHFFFAOYSA-N 0 0 316.779 5.074 20 0 DKADRN O=C(Nc1cccc(C(F)F)c1Cl)NC1CCCCCC1 ZINC000543650671 341053071 /nfs/dbraw/zinc/05/30/71/341053071.db2.gz GSNKXCBQJNJDRZ-UHFFFAOYSA-N 0 0 316.779 5.122 20 0 DKADRN CCCCN(C(=O)Nc1cccc(C(F)F)c1Cl)C1CC1 ZINC000543654142 341053090 /nfs/dbraw/zinc/05/30/90/341053090.db2.gz XRPMFKVIXQWMPL-UHFFFAOYSA-N 0 0 316.779 5.074 20 0 DKADRN Cc1cscc1NC(=O)Nc1cccc(C(F)F)c1Cl ZINC000543654549 341053148 /nfs/dbraw/zinc/05/31/48/341053148.db2.gz ZGSVBYMMJUHLKK-UHFFFAOYSA-N 0 0 316.760 5.292 20 0 DKADRN FC(F)c1cccc(NCc2nc(C3CC3)cs2)c1Cl ZINC000543659169 341053174 /nfs/dbraw/zinc/05/31/74/341053174.db2.gz XKLYKTQPDVLQDQ-UHFFFAOYSA-N 0 0 314.788 5.224 20 0 DKADRN FC(F)c1cccc(NCc2cnoc2-c2ccco2)c1Cl ZINC000543659965 341053163 /nfs/dbraw/zinc/05/31/63/341053163.db2.gz XQIISVNATRPRRB-UHFFFAOYSA-N 0 0 324.714 5.138 20 0 DKADRN CCCc1nc(C(=O)Nc2c(C(C)C)cccc2C(C)C)co1 ZINC000543699950 341053953 /nfs/dbraw/zinc/05/39/53/341053953.db2.gz DZZMBGMRBGVVRO-UHFFFAOYSA-N 0 0 314.429 5.126 20 0 DKADRN CSCc1cccc(N[C@@H](c2ccccc2)c2ccccn2)c1 ZINC000543705551 341054299 /nfs/dbraw/zinc/05/42/99/341054299.db2.gz ANJUYHJTIUIDKZ-FQEVSTJZSA-N 0 0 320.461 5.146 20 0 DKADRN CSCc1cccc(N[C@H](c2ccccc2)c2ccccn2)c1 ZINC000543705552 341054413 /nfs/dbraw/zinc/05/44/13/341054413.db2.gz ANJUYHJTIUIDKZ-HXUWFJFHSA-N 0 0 320.461 5.146 20 0 DKADRN CCc1cccnc1[C@@H](C)Nc1cc(Cl)cc2cccnc21 ZINC000543739733 341056066 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RGHPTOIZBKOKBI-GFCCVEGCSA-N 0 0 317.395 5.453 20 0 DKADRN Cc1c(COC(C)(C)C)cccc1N[C@@H](C)CCC(F)(F)F ZINC000544351419 341077598 /nfs/dbraw/zinc/07/75/98/341077598.db2.gz RGHPTOIZBKOKBI-LBPRGKRZSA-N 0 0 317.395 5.453 20 0 DKADRN CSc1cc(C)ccc1CN[C@H](c1ccco1)c1ccccc1 ZINC000544358986 341077974 /nfs/dbraw/zinc/07/79/74/341077974.db2.gz UBSYKYZWKBMMFF-FQEVSTJZSA-N 0 0 323.461 5.189 20 0 DKADRN CSc1cc(C)ccc1CN[C@@H](c1ccco1)c1ccccc1 ZINC000544358989 341077950 /nfs/dbraw/zinc/07/79/50/341077950.db2.gz UBSYKYZWKBMMFF-HXUWFJFHSA-N 0 0 323.461 5.189 20 0 DKADRN Cc1c2ccccc2oc1CN[C@H](c1ccco1)c1ccccc1 ZINC000544360004 341078110 /nfs/dbraw/zinc/07/81/10/341078110.db2.gz QCFBBGRWIVLXFM-NRFANRHFSA-N 0 0 317.388 5.213 20 0 DKADRN Cc1c2ccccc2oc1CN[C@@H](c1ccco1)c1ccccc1 ZINC000544360008 341078186 /nfs/dbraw/zinc/07/81/86/341078186.db2.gz QCFBBGRWIVLXFM-OAQYLSRUSA-N 0 0 317.388 5.213 20 0 DKADRN CCCNc1ccccc1NC(=O)c1cc(Cl)ccc1Cl ZINC000544361775 341078198 /nfs/dbraw/zinc/07/81/98/341078198.db2.gz BMVNKXNIAPZYHL-UHFFFAOYSA-N 0 0 323.223 5.068 20 0 DKADRN CSc1ccc(N[C@@H](c2ccc(F)cc2)c2cccnc2)cc1 ZINC000544380789 341079291 /nfs/dbraw/zinc/07/92/91/341079291.db2.gz BHCVDZKHXZBKSH-IBGZPJMESA-N 0 0 324.424 5.144 20 0 DKADRN CSc1ccc(N[C@H](c2ccc(F)cc2)c2cccnc2)cc1 ZINC000544380791 341079331 /nfs/dbraw/zinc/07/93/31/341079331.db2.gz BHCVDZKHXZBKSH-LJQANCHMSA-N 0 0 324.424 5.144 20 0 DKADRN c1coc([C@@H](NCc2cc3c(s2)CCCC3)c2ccccc2)c1 ZINC000544381212 341079247 /nfs/dbraw/zinc/07/92/47/341079247.db2.gz JYDJVMWJQGLPPD-FQEVSTJZSA-N 0 0 323.461 5.099 20 0 DKADRN c1coc([C@H](NCc2cc3c(s2)CCCC3)c2ccccc2)c1 ZINC000544381213 341079338 /nfs/dbraw/zinc/07/93/38/341079338.db2.gz JYDJVMWJQGLPPD-HXUWFJFHSA-N 0 0 323.461 5.099 20 0 DKADRN CSc1ccc(N[C@@H](c2ccc(F)cc2)c2ccccn2)cc1 ZINC000544381440 341079452 /nfs/dbraw/zinc/07/94/52/341079452.db2.gz SMUUWNCMIHERRO-IBGZPJMESA-N 0 0 324.424 5.144 20 0 DKADRN CSc1ccc(N[C@H](c2ccc(F)cc2)c2ccccn2)cc1 ZINC000544381441 341079411 /nfs/dbraw/zinc/07/94/11/341079411.db2.gz SMUUWNCMIHERRO-LJQANCHMSA-N 0 0 324.424 5.144 20 0 DKADRN Fc1ccc([C@@H](Nc2cccc(Cl)c2)c2ccccn2)cc1 ZINC000544381871 341079367 /nfs/dbraw/zinc/07/93/67/341079367.db2.gz JRSGNUOELUVRJX-GOSISDBHSA-N 0 0 312.775 5.076 20 0 DKADRN Fc1ccc([C@H](Nc2cccc(Cl)c2)c2ccccn2)cc1 ZINC000544381874 341079410 /nfs/dbraw/zinc/07/94/10/341079410.db2.gz JRSGNUOELUVRJX-SFHVURJKSA-N 0 0 312.775 5.076 20 0 DKADRN COc1cc(C)c([C@@H](C)Nc2cccc([C@H](C)OC)c2)cc1C ZINC000544387267 341079829 /nfs/dbraw/zinc/07/98/29/341079829.db2.gz VERTWDUKDWJYKF-CVEARBPZSA-N 0 0 313.441 5.193 20 0 DKADRN COc1cc(C)c([C@H](C)Nc2cccc([C@H](C)OC)c2)cc1C ZINC000544387268 341079855 /nfs/dbraw/zinc/07/98/55/341079855.db2.gz VERTWDUKDWJYKF-HOTGVXAUSA-N 0 0 313.441 5.193 20 0 DKADRN COc1cc(C)c([C@@H](C)Nc2cccc([C@@H](C)OC)c2)cc1C ZINC000544387269 341079850 /nfs/dbraw/zinc/07/98/50/341079850.db2.gz VERTWDUKDWJYKF-HZPDHXFCSA-N 0 0 313.441 5.193 20 0 DKADRN COc1cc(C)c([C@H](C)Nc2cccc([C@@H](C)OC)c2)cc1C ZINC000544387270 341079730 /nfs/dbraw/zinc/07/97/30/341079730.db2.gz VERTWDUKDWJYKF-JKSUJKDBSA-N 0 0 313.441 5.193 20 0 DKADRN CC[C@@H]([NH2+][C@H](C)c1ccc(F)c(F)c1)c1ccc(Cl)s1 ZINC000544452771 341082846 /nfs/dbraw/zinc/08/28/46/341082846.db2.gz YZHAQUFQGHCYIG-NOZJJQNGSA-N 0 0 315.816 5.482 20 0 DKADRN CC[C@H]([NH2+][C@H](C)c1ccc(F)c(F)c1)c1ccc(Cl)s1 ZINC000544452772 341082736 /nfs/dbraw/zinc/08/27/36/341082736.db2.gz YZHAQUFQGHCYIG-RNCFNFMXSA-N 0 0 315.816 5.482 20 0 DKADRN CC[C@@H]([NH2+][C@@H](C)c1ccc(F)c(F)c1)c1ccc(Cl)s1 ZINC000544452773 341082706 /nfs/dbraw/zinc/08/27/06/341082706.db2.gz YZHAQUFQGHCYIG-TVQRCGJNSA-N 0 0 315.816 5.482 20 0 DKADRN CC[C@H]([NH2+][C@@H](C)c1ccc(F)c(F)c1)c1ccc(Cl)s1 ZINC000544452774 341082800 /nfs/dbraw/zinc/08/28/00/341082800.db2.gz YZHAQUFQGHCYIG-ZANVPECISA-N 0 0 315.816 5.482 20 0 DKADRN CCC(C)(C)OCc1ccccc1NC(=O)[C@H](C)C(C)(C)C ZINC000544456613 341083040 /nfs/dbraw/zinc/08/30/40/341083040.db2.gz LADCCLLDNQTTQX-AWEZNQCLSA-N 0 0 305.462 5.013 20 0 DKADRN CCC(C)(C)OCc1ccccc1NC(=O)[C@@H](C)C(C)(C)C ZINC000544456614 341083039 /nfs/dbraw/zinc/08/30/39/341083039.db2.gz LADCCLLDNQTTQX-CQSZACIVSA-N 0 0 305.462 5.013 20 0 DKADRN CCC(C)(C)OCc1ccccc1NC(=O)c1ccc(C)s1 ZINC000544457651 341083174 /nfs/dbraw/zinc/08/31/74/341083174.db2.gz RVJALCDAALSGBN-UHFFFAOYSA-N 0 0 317.454 5.014 20 0 DKADRN CCC(C)(C)OCc1ccccc1NC(=O)CC1=CCCCC1 ZINC000544459706 341083124 /nfs/dbraw/zinc/08/31/24/341083124.db2.gz RXJVMCZIUQNERG-UHFFFAOYSA-N 0 0 315.457 5.221 20 0 DKADRN CCc1nc([C@H](C)[NH2+]Cc2c(C)ccc3ccccc32)cs1 ZINC000544467738 341083331 /nfs/dbraw/zinc/08/33/31/341083331.db2.gz CJOKPFXSHXPBNS-AWEZNQCLSA-N 0 0 310.466 5.018 20 0 DKADRN CCc1nc([C@@H](C)[NH2+]Cc2c(C)ccc3ccccc32)cs1 ZINC000544467739 341083381 /nfs/dbraw/zinc/08/33/81/341083381.db2.gz CJOKPFXSHXPBNS-CQSZACIVSA-N 0 0 310.466 5.018 20 0 DKADRN CCc1nc([C@@H](C)N[C@@H](C)c2c(C)cc(C)cc2C)cs1 ZINC000544469918 341083445 /nfs/dbraw/zinc/08/34/45/341083445.db2.gz YOCNCJUVHUJRON-CABCVRRESA-N 0 0 302.487 5.043 20 0 DKADRN CCc1nc([C@H](C)N[C@@H](C)c2c(C)cc(C)cc2C)cs1 ZINC000544469919 341083588 /nfs/dbraw/zinc/08/35/88/341083588.db2.gz YOCNCJUVHUJRON-GJZGRUSLSA-N 0 0 302.487 5.043 20 0 DKADRN CCc1nc([C@@H](C)N[C@H](C)c2c(C)cc(C)cc2C)cs1 ZINC000544469920 341083447 /nfs/dbraw/zinc/08/34/47/341083447.db2.gz YOCNCJUVHUJRON-HUUCEWRRSA-N 0 0 302.487 5.043 20 0 DKADRN CCc1nc([C@H](C)N[C@H](C)c2c(C)cc(C)cc2C)cs1 ZINC000544469921 341083545 /nfs/dbraw/zinc/08/35/45/341083545.db2.gz YOCNCJUVHUJRON-LSDHHAIUSA-N 0 0 302.487 5.043 20 0 DKADRN O=C(Nc1cccc(C(F)F)c1Cl)c1cc2ccccc2o1 ZINC000544470223 341083528 /nfs/dbraw/zinc/08/35/28/341083528.db2.gz FDAXDCQSHFNWDD-UHFFFAOYSA-N 0 0 321.710 5.276 20 0 DKADRN O=C(CC1CCCCC1)Nc1cccc(C(F)F)c1Cl ZINC000544470240 341083487 /nfs/dbraw/zinc/08/34/87/341083487.db2.gz GBEGOVQSELMEHH-UHFFFAOYSA-N 0 0 301.764 5.187 20 0 DKADRN CCCCSCCC(=O)Nc1cccc(C(F)F)c1Cl ZINC000544470276 341083455 /nfs/dbraw/zinc/08/34/55/341083455.db2.gz JJAHVGTUEGFVSH-UHFFFAOYSA-N 0 0 321.820 5.140 20 0 DKADRN Cc1ccc(C(=O)Nc2cccc(C(F)F)c2Cl)cc1C ZINC000544470712 341083521 /nfs/dbraw/zinc/08/35/21/341083521.db2.gz LCKIGOGMIXPRDC-UHFFFAOYSA-N 0 0 309.743 5.147 20 0 DKADRN Cc1cccc(C)c1C(=O)Nc1cccc(C(F)F)c1Cl ZINC000544470721 341083587 /nfs/dbraw/zinc/08/35/87/341083587.db2.gz LHOAHACJXUFHEV-UHFFFAOYSA-N 0 0 309.743 5.147 20 0 DKADRN Cc1cccc([C@@H](C)C(=O)Nc2cccc(C(F)F)c2Cl)c1 ZINC000544472454 341083710 /nfs/dbraw/zinc/08/37/10/341083710.db2.gz OSSRTLVWPCJUHQ-LLVKDONJSA-N 0 0 323.770 5.328 20 0 DKADRN Cc1cccc([C@H](C)C(=O)Nc2cccc(C(F)F)c2Cl)c1 ZINC000544472457 341083616 /nfs/dbraw/zinc/08/36/16/341083616.db2.gz OSSRTLVWPCJUHQ-NSHDSACASA-N 0 0 323.770 5.328 20 0 DKADRN CC[C@@H](C(=O)Nc1cccc(C(F)F)c1Cl)c1ccccc1 ZINC000544473065 341083595 /nfs/dbraw/zinc/08/35/95/341083595.db2.gz GOHMQUXUHHKKOC-GFCCVEGCSA-N 0 0 323.770 5.410 20 0 DKADRN CC[C@H](C(=O)Nc1cccc(C(F)F)c1Cl)c1ccccc1 ZINC000544473066 341083725 /nfs/dbraw/zinc/08/37/25/341083725.db2.gz GOHMQUXUHHKKOC-LBPRGKRZSA-N 0 0 323.770 5.410 20 0 DKADRN CCCC[C@H](CC)C(=O)Nc1cccc(C(F)F)c1Cl ZINC000544473108 341083698 /nfs/dbraw/zinc/08/36/98/341083698.db2.gz BBWYHTIACAIOJT-JTQLQIEISA-N 0 0 303.780 5.433 20 0 DKADRN CCCC[C@@H](CC)C(=O)Nc1cccc(C(F)F)c1Cl ZINC000544473109 341083643 /nfs/dbraw/zinc/08/36/43/341083643.db2.gz BBWYHTIACAIOJT-SNVBAGLBSA-N 0 0 303.780 5.433 20 0 DKADRN O=C(Nc1cccc(C(F)F)c1Cl)c1ccc(Cl)s1 ZINC000544473114 341083705 /nfs/dbraw/zinc/08/37/05/341083705.db2.gz GAOAPMZFKULNCJ-UHFFFAOYSA-N 0 0 322.163 5.245 20 0 DKADRN CC(C)C[C@H](C)CC(=O)Nc1cccc(C(F)F)c1Cl ZINC000544473218 341083628 /nfs/dbraw/zinc/08/36/28/341083628.db2.gz HRRJAHIDJSAXKE-JTQLQIEISA-N 0 0 303.780 5.288 20 0 DKADRN CC(C)C[C@@H](C)CC(=O)Nc1cccc(C(F)F)c1Cl ZINC000544473222 341083692 /nfs/dbraw/zinc/08/36/92/341083692.db2.gz HRRJAHIDJSAXKE-SNVBAGLBSA-N 0 0 303.780 5.288 20 0 DKADRN Cc1ccc(CC(=O)Nc2cccc(C(F)F)c2Cl)cc1C ZINC000544473434 341083747 /nfs/dbraw/zinc/08/37/47/341083747.db2.gz LTEYSBMNCGOGRM-UHFFFAOYSA-N 0 0 323.770 5.076 20 0 DKADRN O=C(Nc1cccc(C(F)F)c1Cl)c1cccc2c1CCC2 ZINC000544473799 341083813 /nfs/dbraw/zinc/08/38/13/341083813.db2.gz SMIHVFOBAGFGOG-UHFFFAOYSA-N 0 0 321.754 5.019 20 0 DKADRN O=C(Nc1cccc(C(F)F)c1Cl)c1ccc2c(c1)CCC2 ZINC000544474775 341083766 /nfs/dbraw/zinc/08/37/66/341083766.db2.gz XMSZNHILANIDGZ-UHFFFAOYSA-N 0 0 321.754 5.019 20 0 DKADRN CC(C)CC(C)(C)C(=O)Nc1cccc(C(F)F)c1Cl ZINC000544475514 341083838 /nfs/dbraw/zinc/08/38/38/341083838.db2.gz RWGBTEOUNCADEX-UHFFFAOYSA-N 0 0 303.780 5.288 20 0 DKADRN Cc1ccc(C)c(C(=O)Nc2cccc(C(F)F)c2Cl)c1 ZINC000544475787 341083797 /nfs/dbraw/zinc/08/37/97/341083797.db2.gz OGSLTSPGPPWZST-UHFFFAOYSA-N 0 0 309.743 5.147 20 0 DKADRN Cc1csc([C@H](C)NCc2ccccc2Oc2ccccc2)n1 ZINC000544477939 341083892 /nfs/dbraw/zinc/08/38/92/341083892.db2.gz UKMHDZUHMXNSEI-HNNXBMFYSA-N 0 0 324.449 5.095 20 0 DKADRN Cc1csc([C@@H](C)NCc2ccccc2Oc2ccccc2)n1 ZINC000544477940 341083942 /nfs/dbraw/zinc/08/39/42/341083942.db2.gz UKMHDZUHMXNSEI-OAHLLOKOSA-N 0 0 324.449 5.095 20 0 DKADRN C[C@@H](N[C@@H](C)c1nc(C(C)(C)C)cs1)c1cccc(Cl)c1 ZINC000544484858 341084172 /nfs/dbraw/zinc/08/41/72/341084172.db2.gz ZVZGZDGPFFSDDF-NEPJUHHUSA-N 0 0 322.905 5.506 20 0 DKADRN C[C@@H](N[C@@H](C)c1cccc(Cl)c1)c1nc(C(C)(C)C)cs1 ZINC000544484859 341084127 /nfs/dbraw/zinc/08/41/27/341084127.db2.gz ZVZGZDGPFFSDDF-NWDGAFQWSA-N 0 0 322.905 5.506 20 0 DKADRN C[C@H](N[C@@H](C)c1cccc(Cl)c1)c1nc(C(C)(C)C)cs1 ZINC000544484860 341084107 /nfs/dbraw/zinc/08/41/07/341084107.db2.gz ZVZGZDGPFFSDDF-RYUDHWBXSA-N 0 0 322.905 5.506 20 0 DKADRN C[C@@H](N[C@H](C)c1cccc(Cl)c1)c1nc(C(C)(C)C)cs1 ZINC000544484861 341084199 /nfs/dbraw/zinc/08/41/99/341084199.db2.gz ZVZGZDGPFFSDDF-VXGBXAGGSA-N 0 0 322.905 5.506 20 0 DKADRN Cc1ccc(C)c(NC(=O)N2CCC(c3ccccc3C)CC2)c1 ZINC000544547465 341085482 /nfs/dbraw/zinc/08/54/82/341085482.db2.gz PLFWDWUAUYLKOZ-UHFFFAOYSA-N 0 0 322.452 5.023 20 0 DKADRN C[C@H](CCC(C)(C)C)C(=O)N1CC[C@@H](C)C[C@@H]1c1ccco1 ZINC000544560688 341085765 /nfs/dbraw/zinc/08/57/65/341085765.db2.gz GZXROJAQFBCDJI-BZUAXINKSA-N 0 0 305.462 5.042 20 0 DKADRN C[C@H](CCC(C)(C)C)C(=O)N1CC[C@@H](C)C[C@H]1c1ccco1 ZINC000544560711 341085767 /nfs/dbraw/zinc/08/57/67/341085767.db2.gz GZXROJAQFBCDJI-OAGGEKHMSA-N 0 0 305.462 5.042 20 0 DKADRN C[C@@H](CCC(C)(C)C)C(=O)N1CC[C@@H](C)C[C@@H]1c1ccco1 ZINC000544560713 341085712 /nfs/dbraw/zinc/08/57/12/341085712.db2.gz GZXROJAQFBCDJI-OWCLPIDISA-N 0 0 305.462 5.042 20 0 DKADRN C[C@@H](CCC(C)(C)C)C(=O)N1CC[C@@H](C)C[C@H]1c1ccco1 ZINC000544560716 341085747 /nfs/dbraw/zinc/08/57/47/341085747.db2.gz GZXROJAQFBCDJI-PMPSAXMXSA-N 0 0 305.462 5.042 20 0 DKADRN CCc1nc([C@@H](C)N[C@H]2CCCc3c(Cl)cccc32)cs1 ZINC000544565621 341085792 /nfs/dbraw/zinc/08/57/92/341085792.db2.gz NTRQDSRSXYKJRE-ABAIWWIYSA-N 0 0 320.889 5.087 20 0 DKADRN CCc1nc([C@@H](C)N[C@@H]2CCCc3c(Cl)cccc32)cs1 ZINC000544565622 341085925 /nfs/dbraw/zinc/08/59/25/341085925.db2.gz NTRQDSRSXYKJRE-IAQYHMDHSA-N 0 0 320.889 5.087 20 0 DKADRN CCc1nc([C@H](C)N[C@H]2CCCc3c(Cl)cccc32)cs1 ZINC000544565623 341085938 /nfs/dbraw/zinc/08/59/38/341085938.db2.gz NTRQDSRSXYKJRE-NHYWBVRUSA-N 0 0 320.889 5.087 20 0 DKADRN CCc1nc([C@H](C)N[C@@H]2CCCc3c(Cl)cccc32)cs1 ZINC000544565624 341085843 /nfs/dbraw/zinc/08/58/43/341085843.db2.gz NTRQDSRSXYKJRE-XHDPSFHLSA-N 0 0 320.889 5.087 20 0 DKADRN CCC[C@@H](NCc1cc(Cl)sc1Cl)c1cccnc1 ZINC000544568421 341086192 /nfs/dbraw/zinc/08/61/92/341086192.db2.gz SNXCLKXTYYAHLV-GFCCVEGCSA-N 0 0 315.269 5.081 20 0 DKADRN CCC[C@H](NCc1cc(Cl)sc1Cl)c1cccnc1 ZINC000544568422 341086122 /nfs/dbraw/zinc/08/61/22/341086122.db2.gz SNXCLKXTYYAHLV-LBPRGKRZSA-N 0 0 315.269 5.081 20 0 DKADRN CCC(C)(C)OCc1ccccc1N[C@H]1CCO[C@H](C(C)C)C1 ZINC000544592368 341087659 /nfs/dbraw/zinc/08/76/59/341087659.db2.gz ACAHERRSUCOIGM-HKUYNNGSSA-N 0 0 319.489 5.007 20 0 DKADRN CCC(C)(C)OCc1ccccc1N[C@@H]1CCO[C@@H](C(C)C)C1 ZINC000544592369 341087712 /nfs/dbraw/zinc/08/77/12/341087712.db2.gz ACAHERRSUCOIGM-IEBWSBKVSA-N 0 0 319.489 5.007 20 0 DKADRN CCC(C)(C)OCc1ccccc1N[C@@H]1CCO[C@H](C(C)C)C1 ZINC000544592370 341087612 /nfs/dbraw/zinc/08/76/12/341087612.db2.gz ACAHERRSUCOIGM-MJGOQNOKSA-N 0 0 319.489 5.007 20 0 DKADRN CCC(C)(C)OCc1ccccc1N[C@H]1CCO[C@@H](C(C)C)C1 ZINC000544592371 341087695 /nfs/dbraw/zinc/08/76/95/341087695.db2.gz ACAHERRSUCOIGM-PKOBYXMFSA-N 0 0 319.489 5.007 20 0 DKADRN CCC(C)(C)OCc1ccccc1NCc1cccc(OC)c1 ZINC000544592780 341087616 /nfs/dbraw/zinc/08/76/16/341087616.db2.gz PVUQUAZYLJBTHY-UHFFFAOYSA-N 0 0 313.441 5.013 20 0 DKADRN CCC(C)(C)OCc1ccccc1N[C@H](C)CCC(F)(F)F ZINC000544594429 341087819 /nfs/dbraw/zinc/08/78/19/341087819.db2.gz UGTLEEAMEJDPKL-CYBMUJFWSA-N 0 0 317.395 5.535 20 0 DKADRN CCC(C)(C)OCc1ccccc1N[C@@H](C)CCC(F)(F)F ZINC000544594430 341087831 /nfs/dbraw/zinc/08/78/31/341087831.db2.gz UGTLEEAMEJDPKL-ZDUSSCGKSA-N 0 0 317.395 5.535 20 0 DKADRN FC(F)c1cccc(NCc2ccnc3ccccc23)c1Cl ZINC000544595996 341087748 /nfs/dbraw/zinc/08/77/48/341087748.db2.gz HQUHWQVDIJUTRE-UHFFFAOYSA-N 0 0 318.754 5.438 20 0 DKADRN CC(C)c1cnc(CNc2cccc(C(F)F)c2Cl)s1 ZINC000544596430 341087810 /nfs/dbraw/zinc/08/78/10/341087810.db2.gz YCSZNQLVYNTINS-UHFFFAOYSA-N 0 0 316.804 5.470 20 0 DKADRN CC(C)c1ncc(CNc2cccc(C(F)F)c2Cl)s1 ZINC000544597221 341087821 /nfs/dbraw/zinc/08/78/21/341087821.db2.gz VHSFSWVRJWWAFN-UHFFFAOYSA-N 0 0 316.804 5.470 20 0 DKADRN COCc1ccc(CNc2cccc(C(F)F)c2Cl)cc1 ZINC000544597715 341087752 /nfs/dbraw/zinc/08/77/52/341087752.db2.gz AGTKPGYYMRCVJD-UHFFFAOYSA-N 0 0 311.759 5.036 20 0 DKADRN CCC[C@H](Nc1cccc(N2CCCCCC2)c1)c1cccnc1 ZINC000544603003 341088253 /nfs/dbraw/zinc/08/82/53/341088253.db2.gz NWLYGIDDYGAJEA-NRFANRHFSA-N 0 0 323.484 5.415 20 0 DKADRN CCC[C@@H](Nc1cccc(N2CCCCCC2)c1)c1cccnc1 ZINC000544603017 341088211 /nfs/dbraw/zinc/08/82/11/341088211.db2.gz NWLYGIDDYGAJEA-OAQYLSRUSA-N 0 0 323.484 5.415 20 0 DKADRN CCC[C@H](Nc1ccc(COC2CCCC2)cc1)c1cccnc1 ZINC000544603831 341088237 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/nfs/dbraw/zinc/14/27/06/341142706.db2.gz OMSUXBRPVGVXKR-UHFFFAOYSA-N 0 0 320.436 5.560 20 0 DKADRN Cc1ccccc1[C@@H](C)c1noc(-c2cccc(C(F)F)c2)n1 ZINC000545839354 341143009 /nfs/dbraw/zinc/14/30/09/341143009.db2.gz MXKMONAVPQXAJT-GFCCVEGCSA-N 0 0 314.335 5.134 20 0 DKADRN Cc1ccccc1[C@H](C)c1noc(-c2cccc(C(F)F)c2)n1 ZINC000545839355 341143015 /nfs/dbraw/zinc/14/30/15/341143015.db2.gz MXKMONAVPQXAJT-LBPRGKRZSA-N 0 0 314.335 5.134 20 0 DKADRN C=Cc1ccc(C(=O)Nc2ccc(-c3nc(C)cs3)cc2)cc1 ZINC000545884804 341144052 /nfs/dbraw/zinc/14/40/52/341144052.db2.gz HKNPXABYIRURBN-UHFFFAOYSA-N 0 0 320.417 5.014 20 0 DKADRN O=C(Nc1ccccc1Cc1ccccc1)c1ccoc1C1CC1 ZINC000545965104 341148794 /nfs/dbraw/zinc/14/87/94/341148794.db2.gz RDPIPYYTXAOBJR-UHFFFAOYSA-N 0 0 317.388 5.000 20 0 DKADRN O=C(CC/C=C/c1ccccc1)N1CCCC[C@@H]1c1ccccc1 ZINC000545969414 341148856 /nfs/dbraw/zinc/14/88/56/341148856.db2.gz IULYVOCXHDPARN-FAKWYAOSSA-N 0 0 319.448 5.234 20 0 DKADRN O=C(CC/C=C\c1ccccc1)N1CCCC[C@@H]1c1ccccc1 ZINC000545969415 341148834 /nfs/dbraw/zinc/14/88/34/341148834.db2.gz IULYVOCXHDPARN-MNBXNJIQSA-N 0 0 319.448 5.234 20 0 DKADRN O=C(CC/C=C\c1ccccc1)N1CCCC[C@H]1c1ccccc1 ZINC000545969416 341148903 /nfs/dbraw/zinc/14/89/03/341148903.db2.gz IULYVOCXHDPARN-NIEFLNLKSA-N 0 0 319.448 5.234 20 0 DKADRN O=C(CC/C=C/c1ccccc1)N1CCCC[C@H]1c1ccccc1 ZINC000545969417 341148838 /nfs/dbraw/zinc/14/88/38/341148838.db2.gz IULYVOCXHDPARN-RZBOESAMSA-N 0 0 319.448 5.234 20 0 DKADRN C[C@@H](CCC(=O)N1CCCC[C@@H]1c1ccccc1)c1ccccc1 ZINC000545969790 341148827 /nfs/dbraw/zinc/14/88/27/341148827.db2.gz LNFIBICYHPOPFR-GHTZIAJQSA-N 0 0 321.464 5.324 20 0 DKADRN C[C@H](CCC(=O)N1CCCC[C@H]1c1ccccc1)c1ccccc1 ZINC000545969791 341148892 /nfs/dbraw/zinc/14/88/92/341148892.db2.gz LNFIBICYHPOPFR-NQIIRXRSSA-N 0 0 321.464 5.324 20 0 DKADRN C[C@@H](CCC(=O)N1CCCC[C@H]1c1ccccc1)c1ccccc1 ZINC000545969792 341148819 /nfs/dbraw/zinc/14/88/19/341148819.db2.gz LNFIBICYHPOPFR-RXVVDRJESA-N 0 0 321.464 5.324 20 0 DKADRN C[C@H](CCC(=O)N1CCCC[C@@H]1c1ccccc1)c1ccccc1 ZINC000545969793 341148914 /nfs/dbraw/zinc/14/89/14/341148914.db2.gz LNFIBICYHPOPFR-WIYYLYMNSA-N 0 0 321.464 5.324 20 0 DKADRN Cc1ccc([C@@H](C)NC2(c3ccc(Cl)c(Cl)c3)CC2)o1 ZINC000545981614 341149472 /nfs/dbraw/zinc/14/94/72/341149472.db2.gz RXCKIJKIVLUFAK-LLVKDONJSA-N 0 0 310.224 5.235 20 0 DKADRN Cc1ccc([C@H](C)NC2(c3ccc(Cl)c(Cl)c3)CC2)o1 ZINC000545981615 341149414 /nfs/dbraw/zinc/14/94/14/341149414.db2.gz RXCKIJKIVLUFAK-NSHDSACASA-N 0 0 310.224 5.235 20 0 DKADRN CCC[C@@H](N[C@H](C)c1csc(C(C)C)n1)c1ccccc1 ZINC000545985180 341149694 /nfs/dbraw/zinc/14/96/94/341149694.db2.gz MBTYBELCNQQZEM-GDBMZVCRSA-N 0 0 302.487 5.459 20 0 DKADRN CCC[C@@H](N[C@@H](C)c1csc(C(C)C)n1)c1ccccc1 ZINC000545985181 341149745 /nfs/dbraw/zinc/14/97/45/341149745.db2.gz MBTYBELCNQQZEM-GOEBONIOSA-N 0 0 302.487 5.459 20 0 DKADRN CCC[C@H](N[C@@H](C)c1csc(C(C)C)n1)c1ccccc1 ZINC000545985182 341149627 /nfs/dbraw/zinc/14/96/27/341149627.db2.gz MBTYBELCNQQZEM-HOCLYGCPSA-N 0 0 302.487 5.459 20 0 DKADRN CCC[C@H](N[C@H](C)c1csc(C(C)C)n1)c1ccccc1 ZINC000545985183 341149680 /nfs/dbraw/zinc/14/96/80/341149680.db2.gz MBTYBELCNQQZEM-ZBFHGGJFSA-N 0 0 302.487 5.459 20 0 DKADRN CC(C)c1nc([C@H](C)N[C@H]2CC(C)(C)c3ccccc32)cs1 ZINC000545985761 341149888 /nfs/dbraw/zinc/14/98/88/341149888.db2.gz RYAHTDFRWPFVKG-BBRMVZONSA-N 0 0 314.498 5.340 20 0 DKADRN CC(C)c1nc([C@@H](C)N[C@H]2CC(C)(C)c3ccccc32)cs1 ZINC000545985762 341149847 /nfs/dbraw/zinc/14/98/47/341149847.db2.gz RYAHTDFRWPFVKG-CJNGLKHVSA-N 0 0 314.498 5.340 20 0 DKADRN CC(C)c1nc([C@@H](C)N[C@@H]2CC(C)(C)c3ccccc32)cs1 ZINC000545985763 341149814 /nfs/dbraw/zinc/14/98/14/341149814.db2.gz RYAHTDFRWPFVKG-CZUORRHYSA-N 0 0 314.498 5.340 20 0 DKADRN CC(C)c1nc([C@H](C)N[C@@H]2CC(C)(C)c3ccccc32)cs1 ZINC000545985764 341149850 /nfs/dbraw/zinc/14/98/50/341149850.db2.gz RYAHTDFRWPFVKG-XJKSGUPXSA-N 0 0 314.498 5.340 20 0 DKADRN Cc1ccccc1-c1cnc(COc2ccc(Cl)cc2F)o1 ZINC000545995991 341150178 /nfs/dbraw/zinc/15/01/78/341150178.db2.gz AOPJWIYZYKBGBR-UHFFFAOYSA-N 0 0 317.747 5.022 20 0 DKADRN CSc1cccc(C)c1NC(=O)c1cc2sccc2s1 ZINC000546021595 341151601 /nfs/dbraw/zinc/15/16/01/341151601.db2.gz UBISVVHLHRNBKL-UHFFFAOYSA-N 0 0 319.476 5.245 20 0 DKADRN O=C(Nc1cccc2ccccc21)c1scnc1C1CCCC1 ZINC000546045036 341152705 /nfs/dbraw/zinc/15/27/05/341152705.db2.gz FPCPAQJVHPDHTL-UHFFFAOYSA-N 0 0 322.433 5.206 20 0 DKADRN Cc1nc(C(F)(F)F)c(CNc2ccc(C(C)C)cc2)s1 ZINC000546049825 341152870 /nfs/dbraw/zinc/15/28/70/341152870.db2.gz KNTUKMALWKKWIU-UHFFFAOYSA-N 0 0 314.376 5.206 20 0 DKADRN Cc1nc(C(F)(F)F)c(CNc2ccc(Cl)cc2C)s1 ZINC000546050264 341152833 /nfs/dbraw/zinc/15/28/33/341152833.db2.gz YLXPRLDTDWQSME-UHFFFAOYSA-N 0 0 320.767 5.044 20 0 DKADRN Cc1nc(C(F)(F)F)c(CNc2ccc(C)c(Cl)c2)s1 ZINC000546050585 341152810 /nfs/dbraw/zinc/15/28/10/341152810.db2.gz JHNKPHPSMJYAGP-UHFFFAOYSA-N 0 0 320.767 5.044 20 0 DKADRN CSCc1ccccc1NC(=O)c1ccc(C(C)(C)C)s1 ZINC000546061045 341153041 /nfs/dbraw/zinc/15/30/41/341153041.db2.gz HZLRINRAZUPVQJ-UHFFFAOYSA-N 0 0 319.495 5.161 20 0 DKADRN CSCc1ccccc1NC(=O)c1ccc(C)c(C)c1Cl ZINC000546115571 341154134 /nfs/dbraw/zinc/15/41/34/341154134.db2.gz UKFYQXIKTLBHCR-UHFFFAOYSA-N 0 0 319.857 5.072 20 0 DKADRN Cc1cccc(C(C)C)c1NC(=O)N1CC[C@H](C)C(C)(C)C1 ZINC000546125052 341154290 /nfs/dbraw/zinc/15/42/90/341154290.db2.gz FMPBFSLGYISKRV-HNNXBMFYSA-N 0 0 302.462 5.018 20 0 DKADRN Cc1cccc(C(C)C)c1NC(=O)N1CC[C@@H](C)C(C)(C)C1 ZINC000546125056 341154283 /nfs/dbraw/zinc/15/42/83/341154283.db2.gz FMPBFSLGYISKRV-OAHLLOKOSA-N 0 0 302.462 5.018 20 0 DKADRN CCCCC[C@H]1CCCN1C(=O)Nc1ccccc1CSC ZINC000546137584 341154630 /nfs/dbraw/zinc/15/46/30/341154630.db2.gz OMUSRVTVPYFOGY-INIZCTEOSA-N 0 0 320.502 5.126 20 0 DKADRN CCCCC[C@@H]1CCCN1C(=O)Nc1ccccc1CSC ZINC000546137735 341154644 /nfs/dbraw/zinc/15/46/44/341154644.db2.gz OMUSRVTVPYFOGY-MRXNPFEDSA-N 0 0 320.502 5.126 20 0 DKADRN CSCc1ccccc1NC(=O)N(CC(C)C)CC(C)(C)C ZINC000546139097 341154558 /nfs/dbraw/zinc/15/45/58/341154558.db2.gz CBXCZPHAYZRNQZ-UHFFFAOYSA-N 0 0 322.518 5.086 20 0 DKADRN CC(C)c1ccc(C(=O)N2CCCSc3ccccc32)s1 ZINC000546152544 341154876 /nfs/dbraw/zinc/15/48/76/341154876.db2.gz HMDKIMOLQQCDSF-UHFFFAOYSA-N 0 0 317.479 5.014 20 0 DKADRN CCc1cccc(CC)c1NC(=O)c1ccc(C(C)C)s1 ZINC000546153892 341154952 /nfs/dbraw/zinc/15/49/52/341154952.db2.gz SVMMRDUKXFPREX-UHFFFAOYSA-N 0 0 301.455 5.249 20 0 DKADRN Cc1ccccc1C(N[C@@H](C)c1cscn1)c1ccccc1C ZINC000546166870 341155567 /nfs/dbraw/zinc/15/55/67/341155567.db2.gz SDWWMKWLIHXONU-INIZCTEOSA-N 0 0 322.477 5.200 20 0 DKADRN Cc1ccccc1C(N[C@H](C)c1cscn1)c1ccccc1C ZINC000546166871 341155604 /nfs/dbraw/zinc/15/56/04/341155604.db2.gz SDWWMKWLIHXONU-MRXNPFEDSA-N 0 0 322.477 5.200 20 0 DKADRN CSc1ccc(C)c(NC(=O)c2ccc(C(C)C)s2)c1 ZINC000546182117 341156439 /nfs/dbraw/zinc/15/64/39/341156439.db2.gz RMVKYEQDAFTDSQ-UHFFFAOYSA-N 0 0 305.468 5.154 20 0 DKADRN CSc1cccc(NC(=O)c2ccc(C(C)C)s2)c1C ZINC000546184735 341156605 /nfs/dbraw/zinc/15/66/05/341156605.db2.gz ZRUVVTGHKCYVTE-UHFFFAOYSA-N 0 0 305.468 5.154 20 0 DKADRN CC(C)Oc1ccc(NC(=O)c2ccc(C(C)C)s2)c(F)c1 ZINC000546190020 341156728 /nfs/dbraw/zinc/15/67/28/341156728.db2.gz DWIUMLQRIUSUJH-UHFFFAOYSA-N 0 0 321.417 5.050 20 0 DKADRN Cc1cccc(C)c1[C@@H](C)NC(=O)c1c(Cl)cccc1Cl ZINC000546215836 341157390 /nfs/dbraw/zinc/15/73/90/341157390.db2.gz RCISQWYXFPBGOB-GFCCVEGCSA-N 0 0 322.235 5.101 20 0 DKADRN Cc1cccc(C)c1[C@H](C)NC(=O)c1c(Cl)cccc1Cl ZINC000546215837 341157448 /nfs/dbraw/zinc/15/74/48/341157448.db2.gz RCISQWYXFPBGOB-LBPRGKRZSA-N 0 0 322.235 5.101 20 0 DKADRN Cc1cccc(C)c1[C@@H](C)N[C@@H](C)c1ncc(C(C)(C)C)o1 ZINC000546224347 341157608 /nfs/dbraw/zinc/15/76/08/341157608.db2.gz SUNRGSQMINDROC-CABCVRRESA-N 0 0 300.446 5.001 20 0 DKADRN Cc1cccc(C)c1[C@H](C)N[C@@H](C)c1ncc(C(C)(C)C)o1 ZINC000546224348 341157683 /nfs/dbraw/zinc/15/76/83/341157683.db2.gz SUNRGSQMINDROC-GJZGRUSLSA-N 0 0 300.446 5.001 20 0 DKADRN Cc1cccc(C)c1[C@@H](C)N[C@H](C)c1ncc(C(C)(C)C)o1 ZINC000546224349 341157672 /nfs/dbraw/zinc/15/76/72/341157672.db2.gz SUNRGSQMINDROC-HUUCEWRRSA-N 0 0 300.446 5.001 20 0 DKADRN Cc1cccc(C)c1[C@H](C)N[C@H](C)c1ncc(C(C)(C)C)o1 ZINC000546224350 341157648 /nfs/dbraw/zinc/15/76/48/341157648.db2.gz SUNRGSQMINDROC-LSDHHAIUSA-N 0 0 300.446 5.001 20 0 DKADRN CCCc1occc1C(=O)Nc1cc(Cl)c(C)cc1Cl ZINC000546256028 341159751 /nfs/dbraw/zinc/15/97/51/341159751.db2.gz SSDUUKYXAYFVGP-UHFFFAOYSA-N 0 0 312.196 5.100 20 0 DKADRN Clc1cc(Cl)cc(-c2noc([C@H]3CCCCS3)n2)c1 ZINC000546287334 341161377 /nfs/dbraw/zinc/16/13/77/341161377.db2.gz JISGWMBROMNEHG-LLVKDONJSA-N 0 0 315.225 5.002 20 0 DKADRN Clc1cc(Cl)cc(-c2noc([C@@H]3CCCCS3)n2)c1 ZINC000546287344 341161358 /nfs/dbraw/zinc/16/13/58/341161358.db2.gz JISGWMBROMNEHG-NSHDSACASA-N 0 0 315.225 5.002 20 0 DKADRN CCC(CC)c1noc(/C=C(\c2ccccc2)C(F)(F)F)n1 ZINC000546376143 341165688 /nfs/dbraw/zinc/16/56/88/341165688.db2.gz HGBLKKQUTCVBQS-JLHYYAGUSA-N 0 0 310.319 5.076 20 0 DKADRN CCC(CC)c1noc(/C=C(/c2ccccc2)C(F)(F)F)n1 ZINC000546376145 341165701 /nfs/dbraw/zinc/16/57/01/341165701.db2.gz HGBLKKQUTCVBQS-RAXLEYEMSA-N 0 0 310.319 5.076 20 0 DKADRN CCS[C@H](C)c1noc(/C=C(/C)c2ccccc2Cl)n1 ZINC000546489100 341170783 /nfs/dbraw/zinc/17/07/83/341170783.db2.gz PTRQLSPPHRBLLO-DWOQACPDSA-N 0 0 308.834 5.098 20 0 DKADRN CCS[C@@H](C)c1noc(/C=C(/C)c2ccccc2Cl)n1 ZINC000546489102 341170787 /nfs/dbraw/zinc/17/07/87/341170787.db2.gz PTRQLSPPHRBLLO-JUDLJHIGSA-N 0 0 308.834 5.098 20 0 DKADRN CCS[C@H](C)c1noc(/C=C(\C)c2ccccc2Cl)n1 ZINC000546489104 341170798 /nfs/dbraw/zinc/17/07/98/341170798.db2.gz PTRQLSPPHRBLLO-PBQZMEPESA-N 0 0 308.834 5.098 20 0 DKADRN CCS[C@@H](C)c1noc(/C=C(\C)c2ccccc2Cl)n1 ZINC000546489107 341170753 /nfs/dbraw/zinc/17/07/53/341170753.db2.gz PTRQLSPPHRBLLO-USKTWTLRSA-N 0 0 308.834 5.098 20 0 DKADRN CC(C)Sc1ccc(-c2nc([C@@H]3CCCCS3)no2)cc1 ZINC000546515564 341171802 /nfs/dbraw/zinc/17/18/02/341171802.db2.gz UCUAGXYKUQWPTJ-AWEZNQCLSA-N 0 0 320.483 5.195 20 0 DKADRN CC(C)Sc1ccc(-c2nc([C@H]3CCCCS3)no2)cc1 ZINC000546515565 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317.436 5.077 20 0 DKADRN CC(C)c1nc([C@H](C)N[C@@H]2CC[C@H](C)c3ccccc32)cs1 ZINC000547398779 341211136 /nfs/dbraw/zinc/21/11/36/341211136.db2.gz VYSHZSSYVSSBCU-GRDNDAEWSA-N 0 0 314.498 5.556 20 0 DKADRN CC(C)c1nc([C@H](C)N[C@@H]2CC[C@@H](C)c3ccccc32)cs1 ZINC000547398780 341211077 /nfs/dbraw/zinc/21/10/77/341211077.db2.gz VYSHZSSYVSSBCU-JKIFEVAISA-N 0 0 314.498 5.556 20 0 DKADRN CC(C)c1nc([C@H](C)N[C@H]2CC[C@@H](C)c3ccccc32)cs1 ZINC000547398781 341211037 /nfs/dbraw/zinc/21/10/37/341211037.db2.gz VYSHZSSYVSSBCU-KEYYUXOJSA-N 0 0 314.498 5.556 20 0 DKADRN CC(C)c1nc([C@H](C)N[C@H]2CC[C@H](C)c3ccccc32)cs1 ZINC000547398782 341211118 /nfs/dbraw/zinc/21/11/18/341211118.db2.gz VYSHZSSYVSSBCU-ZQIUZPCESA-N 0 0 314.498 5.556 20 0 DKADRN CC(C)c1nc([C@@H](C)NCc2cc3c(s2)CCCC3)cs1 ZINC000547398958 341211113 /nfs/dbraw/zinc/21/11/13/341211113.db2.gz HVJYNABMZSHKPK-GFCCVEGCSA-N 0 0 320.527 5.058 20 0 DKADRN CC(C)c1nc([C@H](C)NCc2cc3c(s2)CCCC3)cs1 ZINC000547398959 341211132 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ZINC000547500834 341218212 /nfs/dbraw/zinc/21/82/12/341218212.db2.gz JUSLIGXRHJMSHN-UHFFFAOYSA-N 0 0 302.462 5.243 20 0 DKADRN CCCCN(C(=O)Nc1ccccc1C)[C@@H](C)c1ccccc1 ZINC000547500838 341218197 /nfs/dbraw/zinc/21/81/97/341218197.db2.gz MSEBCJYNOWPSJI-KRWDZBQOSA-N 0 0 310.441 5.390 20 0 DKADRN CCCCN(C(=O)Nc1ccccc1C)[C@H](C)c1ccccc1 ZINC000547500839 341218256 /nfs/dbraw/zinc/21/82/56/341218256.db2.gz MSEBCJYNOWPSJI-QGZVFWFLSA-N 0 0 310.441 5.390 20 0 DKADRN O=C(Nc1cccc2cc[nH]c21)Nc1ccc(Cl)cc1Cl ZINC000547501139 341218298 /nfs/dbraw/zinc/21/82/98/341218298.db2.gz RGZFJLNLAWOQSZ-UHFFFAOYSA-N 0 0 320.179 5.119 20 0 DKADRN CC(C)c1ccccc1NC(=O)N1CCC[C@H](C(C)C)CC1 ZINC000547501143 341218198 /nfs/dbraw/zinc/21/81/98/341218198.db2.gz RVTFYLKSZBBRQW-INIZCTEOSA-N 0 0 302.462 5.100 20 0 DKADRN CC(C)c1ccccc1NC(=O)N1CCC[C@@H](C(C)C)CC1 ZINC000547501144 341218257 /nfs/dbraw/zinc/21/82/57/341218257.db2.gz RVTFYLKSZBBRQW-MRXNPFEDSA-N 0 0 302.462 5.100 20 0 DKADRN Cc1cc2cc(NC(=O)Nc3ccccc3C(C)C)ccc2[nH]1 ZINC000547502678 341218426 /nfs/dbraw/zinc/21/84/26/341218426.db2.gz SWJKICVWLXUNQO-UHFFFAOYSA-N 0 0 307.397 5.244 20 0 DKADRN C[C@@H](Sc1ccncc1C#N)c1ccc(Cl)c(Cl)c1 ZINC000547503453 341218439 /nfs/dbraw/zinc/21/84/39/341218439.db2.gz BIDNHUJCIWHFET-SECBINFHSA-N 0 0 309.221 5.113 20 0 DKADRN C[C@H](Sc1ccncc1C#N)c1ccc(Cl)c(Cl)c1 ZINC000547503454 341218528 /nfs/dbraw/zinc/21/85/28/341218528.db2.gz BIDNHUJCIWHFET-VIFPVBQESA-N 0 0 309.221 5.113 20 0 DKADRN C[C@H](Nc1cc(Cl)cc2cccnc21)c1ccc(Cl)cn1 ZINC000547504375 341218523 /nfs/dbraw/zinc/21/85/23/341218523.db2.gz CSSZAJYXPPLSNQ-JTQLQIEISA-N 0 0 318.207 5.110 20 0 DKADRN C[C@@H](Nc1cc(Cl)cc2cccnc21)c1ccc(Cl)cn1 ZINC000547504376 341218513 /nfs/dbraw/zinc/21/85/13/341218513.db2.gz CSSZAJYXPPLSNQ-SNVBAGLBSA-N 0 0 318.207 5.110 20 0 DKADRN C[C@@H](NCc1nc(-c2cc3ccccc3o2)cs1)c1ccoc1 ZINC000547507004 341218849 /nfs/dbraw/zinc/21/88/49/341218849.db2.gz HOHANKHDKHWWKV-GFCCVEGCSA-N 0 0 324.405 5.000 20 0 DKADRN C[C@H](NCc1nc(-c2cc3ccccc3o2)cs1)c1ccoc1 ZINC000547507005 341218931 /nfs/dbraw/zinc/21/89/31/341218931.db2.gz HOHANKHDKHWWKV-LBPRGKRZSA-N 0 0 324.405 5.000 20 0 DKADRN O=C(Nc1cccc2cc[nH]c21)Nc1cccc2ccsc21 ZINC000547507383 341218899 /nfs/dbraw/zinc/21/88/99/341218899.db2.gz KVXFSTZLPRPGGI-UHFFFAOYSA-N 0 0 307.378 5.027 20 0 DKADRN O=C(Nc1csc2ccccc12)Nc1cccc2cc[nH]c21 ZINC000547508659 341218945 /nfs/dbraw/zinc/21/89/45/341218945.db2.gz OVCMQACZCFYQKW-UHFFFAOYSA-N 0 0 307.378 5.027 20 0 DKADRN O=C(Nc1ccc(CCC(F)(F)F)cc1)C1=CCCCCC1 ZINC000547518529 341219760 /nfs/dbraw/zinc/21/97/60/341219760.db2.gz SOJQNRZIKGYVIY-UHFFFAOYSA-N 0 0 311.347 5.011 20 0 DKADRN CC[C@H](c1ccccc1)N(CC)C(=O)Nc1cccc2cc[nH]c21 ZINC000547526431 341220645 /nfs/dbraw/zinc/22/06/45/341220645.db2.gz PDYCUWBZJCJKGE-GOSISDBHSA-N 0 0 321.424 5.173 20 0 DKADRN CC[C@@H](c1ccccc1)N(CC)C(=O)Nc1cccc2cc[nH]c21 ZINC000547526432 341220633 /nfs/dbraw/zinc/22/06/33/341220633.db2.gz PDYCUWBZJCJKGE-SFHVURJKSA-N 0 0 321.424 5.173 20 0 DKADRN Cc1ccc(C)c([C@H](C)N(C)C(=O)Nc2cccc3cc[nH]c32)c1 ZINC000547527182 341220725 /nfs/dbraw/zinc/22/07/25/341220725.db2.gz WSIGMKOXHZASJQ-HNNXBMFYSA-N 0 0 321.424 5.010 20 0 DKADRN Cc1ccc(C)c([C@@H](C)N(C)C(=O)Nc2cccc3cc[nH]c32)c1 ZINC000547527183 341220736 /nfs/dbraw/zinc/22/07/36/341220736.db2.gz WSIGMKOXHZASJQ-OAHLLOKOSA-N 0 0 321.424 5.010 20 0 DKADRN Cc1nc(SCc2ccc(OC(C)C)c(Cl)c2)oc1C ZINC000547631943 341224223 /nfs/dbraw/zinc/22/42/23/341224223.db2.gz SLKFZOMGPKMAOD-UHFFFAOYSA-N 0 0 311.834 5.024 20 0 DKADRN Cc1ncsc1CNc1cc(Cl)ccc1OC1CCCC1 ZINC000547647406 341225069 /nfs/dbraw/zinc/22/50/69/341225069.db2.gz QWFRHKSICSFLRO-UHFFFAOYSA-N 0 0 322.861 5.038 20 0 DKADRN CC1(C(=O)Nc2ccc(-c3cnc(C4CC4)o3)cc2)CCCCC1 ZINC000547705463 341227727 /nfs/dbraw/zinc/22/77/27/341227727.db2.gz FQJSMNCQZOUDLU-UHFFFAOYSA-N 0 0 324.424 5.128 20 0 DKADRN CCSc1ccccc1C(=O)Nc1cccc(C(C)(F)F)c1 ZINC000547725193 341228927 /nfs/dbraw/zinc/22/89/27/341228927.db2.gz GXSFCZHJVVYZLI-UHFFFAOYSA-N 0 0 321.392 5.163 20 0 DKADRN C[C@@H](Nc1cccc2cc[nH]c21)c1ccc(C(F)(F)F)cc1 ZINC000547805997 341233427 /nfs/dbraw/zinc/23/34/27/341233427.db2.gz JLBRQWCCHAICFF-LLVKDONJSA-N 0 0 304.315 5.360 20 0 DKADRN C[C@H](Nc1cccc2cc[nH]c21)c1ccc(C(F)(F)F)cc1 ZINC000547805998 341233466 /nfs/dbraw/zinc/23/34/66/341233466.db2.gz JLBRQWCCHAICFF-NSHDSACASA-N 0 0 304.315 5.360 20 0 DKADRN C[C@@H](Nc1cccc2cc[nH]c21)c1ccc(Br)cc1 ZINC000547806671 341233473 /nfs/dbraw/zinc/23/34/73/341233473.db2.gz QDWQQSNUGPIAQR-LLVKDONJSA-N 0 0 315.214 5.104 20 0 DKADRN C[C@H](Nc1cccc2cc[nH]c21)c1ccc(Br)cc1 ZINC000547806672 341233491 /nfs/dbraw/zinc/23/34/91/341233491.db2.gz QDWQQSNUGPIAQR-NSHDSACASA-N 0 0 315.214 5.104 20 0 DKADRN C[C@@H](Nc1cccc2cc[nH]c21)c1ccccc1Br ZINC000547806830 341233508 /nfs/dbraw/zinc/23/35/08/341233508.db2.gz YCHRPGIUQQUHSD-LLVKDONJSA-N 0 0 315.214 5.104 20 0 DKADRN C[C@H](Nc1cccc2cc[nH]c21)c1ccccc1Br ZINC000547806831 341233495 /nfs/dbraw/zinc/23/34/95/341233495.db2.gz YCHRPGIUQQUHSD-NSHDSACASA-N 0 0 315.214 5.104 20 0 DKADRN Clc1ccc(-c2cc(CNc3cccc4cc[nH]c43)on2)cc1 ZINC000547812046 341233981 /nfs/dbraw/zinc/23/39/81/341233981.db2.gz XJIWWEQUPWXGLU-UHFFFAOYSA-N 0 0 323.783 5.088 20 0 DKADRN c1cc2cccc(NCc3csc(C4CCCCC4)n3)c2[nH]1 ZINC000547812198 341234083 /nfs/dbraw/zinc/23/40/83/341234083.db2.gz OEJOKQNISSDHFQ-UHFFFAOYSA-N 0 0 311.454 5.284 20 0 DKADRN Cc1cc(N[C@@H](C)c2nnc(-c3ccccc3)o2)ccc1C1CC1 ZINC000547812409 341234084 /nfs/dbraw/zinc/23/40/84/341234084.db2.gz PUVMTGBWPXBCCU-AWEZNQCLSA-N 0 0 319.408 5.096 20 0 DKADRN Cc1cc(N[C@H](C)c2nnc(-c3ccccc3)o2)ccc1C1CC1 ZINC000547812410 341234037 /nfs/dbraw/zinc/23/40/37/341234037.db2.gz PUVMTGBWPXBCCU-CQSZACIVSA-N 0 0 319.408 5.096 20 0 DKADRN Cc1c(C(=O)Nc2cccc3cc[nH]c32)sc2cccc(F)c12 ZINC000547818047 341234547 /nfs/dbraw/zinc/23/45/47/341234547.db2.gz OEGJMZGEYODVQK-UHFFFAOYSA-N 0 0 324.380 5.082 20 0 DKADRN Cc1c2cc(Cl)ccc2oc1C(=O)Nc1cccc2cc[nH]c21 ZINC000547818090 341234462 /nfs/dbraw/zinc/23/44/62/341234462.db2.gz RHTIUXOTGMSYKV-UHFFFAOYSA-N 0 0 324.767 5.128 20 0 DKADRN c1cc2cccc(NCc3ccc(Oc4ccccc4)o3)c2[nH]1 ZINC000547819906 341234625 /nfs/dbraw/zinc/23/46/25/341234625.db2.gz RVIRMMBSZYXNMP-UHFFFAOYSA-N 0 0 304.349 5.165 20 0 DKADRN O=C(Nc1cccc2cc[nH]c21)c1sccc1-c1ccccc1 ZINC000547820411 341234703 /nfs/dbraw/zinc/23/47/03/341234703.db2.gz NXAHHMWZXGCIOB-UHFFFAOYSA-N 0 0 318.401 5.149 20 0 DKADRN c1cc2cccc(NCc3cccc(OC4CCCC4)c3)c2[nH]1 ZINC000547821930 341234979 /nfs/dbraw/zinc/23/49/79/341234979.db2.gz NFSGNYZEEQNYDY-UHFFFAOYSA-N 0 0 306.409 5.101 20 0 DKADRN CCSc1ccccc1C(=O)Nc1ccc2occ(C)c2c1 ZINC000547824898 341235310 /nfs/dbraw/zinc/23/53/10/341235310.db2.gz YTWHIIHZIRMQLZ-UHFFFAOYSA-N 0 0 311.406 5.106 20 0 DKADRN CC(C)c1nc2cc(N[C@H](C)c3ccc(Cl)cn3)ccc2o1 ZINC000547826448 341235640 /nfs/dbraw/zinc/23/56/40/341235640.db2.gz DENHWSXMZZHENQ-LLVKDONJSA-N 0 0 315.804 5.173 20 0 DKADRN CC(C)c1nc2cc(N[C@@H](C)c3ccc(Cl)cn3)ccc2o1 ZINC000547826449 341235587 /nfs/dbraw/zinc/23/55/87/341235587.db2.gz DENHWSXMZZHENQ-NSHDSACASA-N 0 0 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ZINC000550940295 341327579 /nfs/dbraw/zinc/32/75/79/341327579.db2.gz MLVYEIADCKSMJI-OXQOHEQNSA-N 0 0 312.457 5.345 20 0 DKADRN Cc1cc([C@@H](C)N[C@@H](CC2CCCCC2)c2ccccc2)no1 ZINC000550940296 341327629 /nfs/dbraw/zinc/32/76/29/341327629.db2.gz MLVYEIADCKSMJI-UZLBHIALSA-N 0 0 312.457 5.345 20 0 DKADRN CC(C)(C)c1ccccc1NCc1ccc(C(F)(F)F)cn1 ZINC000550982971 341328290 /nfs/dbraw/zinc/32/82/90/341328290.db2.gz IHFVOIYEDKHBDR-UHFFFAOYSA-N 0 0 308.347 5.010 20 0 DKADRN Cc1noc(C)c1CNc1cccc(-c2cccc(Cl)c2)c1 ZINC000550983301 341328334 /nfs/dbraw/zinc/32/83/34/341328334.db2.gz PCLVOVZGNOSBHP-UHFFFAOYSA-N 0 0 312.800 5.224 20 0 DKADRN CCO[C@@H](C)c1nc(COc2cc(C)ccc2C(C)C)cs1 ZINC000550989701 341328494 /nfs/dbraw/zinc/32/84/94/341328494.db2.gz YWQGFVYLPNMXCK-AWEZNQCLSA-N 0 0 319.470 5.251 20 0 DKADRN CCO[C@H](C)c1nc(COc2cc(C)ccc2C(C)C)cs1 ZINC000550989702 341328431 /nfs/dbraw/zinc/32/84/31/341328431.db2.gz YWQGFVYLPNMXCK-CQSZACIVSA-N 0 0 319.470 5.251 20 0 DKADRN FC(F)(F)CCCCSCc1ccc(C(F)(F)F)cn1 ZINC000551003434 341328842 /nfs/dbraw/zinc/32/88/42/341328842.db2.gz DOLVFIXRDPBIDY-UHFFFAOYSA-N 0 0 317.298 5.066 20 0 DKADRN CC(C)c1ccccc1NC(=O)[C@H](C)SCCCCCF ZINC000551003959 341328864 /nfs/dbraw/zinc/32/88/64/341328864.db2.gz WDVFZDFUTQLFPA-AWEZNQCLSA-N 0 0 311.466 5.010 20 0 DKADRN CC(C)c1ccccc1NC(=O)[C@@H](C)SCCCCCF ZINC000551003960 341328834 /nfs/dbraw/zinc/32/88/34/341328834.db2.gz WDVFZDFUTQLFPA-CQSZACIVSA-N 0 0 311.466 5.010 20 0 DKADRN C[C@H](NCc1cc(-c2ccccc2)on1)c1cccc(C2CC2)c1 ZINC000551029490 341329520 /nfs/dbraw/zinc/32/95/20/341329520.db2.gz GRLIQUPMTDRILJ-HNNXBMFYSA-N 0 0 318.420 5.070 20 0 DKADRN C[C@@H](NCc1cc(-c2ccccc2)on1)c1cccc(C2CC2)c1 ZINC000551029491 341329582 /nfs/dbraw/zinc/32/95/82/341329582.db2.gz GRLIQUPMTDRILJ-OAHLLOKOSA-N 0 0 318.420 5.070 20 0 DKADRN FCCCCCSc1nnc(-c2ccc3ccccc3c2)o1 ZINC000551061311 341330538 /nfs/dbraw/zinc/33/05/38/341330538.db2.gz ZMIRKOMNPQMWKC-UHFFFAOYSA-N 0 0 316.401 5.122 20 0 DKADRN Cc1cc(C)c(CN[C@@H](c2ccccc2)C(F)(F)F)c(C)c1 ZINC000551062216 341330552 /nfs/dbraw/zinc/33/05/52/341330552.db2.gz JAZVJHMIBMLFDJ-KRWDZBQOSA-N 0 0 307.359 5.005 20 0 DKADRN Cc1cc(C)c(CN[C@H](c2ccccc2)C(F)(F)F)c(C)c1 ZINC000551062221 341330540 /nfs/dbraw/zinc/33/05/40/341330540.db2.gz JAZVJHMIBMLFDJ-QGZVFWFLSA-N 0 0 307.359 5.005 20 0 DKADRN C[C@@H](SCCC(F)(F)F)c1nc2ccccc2n1C(F)F ZINC000551097804 341331615 /nfs/dbraw/zinc/33/16/15/341331615.db2.gz RGCPQNNCTCTRPO-MRVPVSSYSA-N 0 0 324.318 5.178 20 0 DKADRN C[C@H](SCCC(F)(F)F)c1nc2ccccc2n1C(F)F ZINC000551097805 341331639 /nfs/dbraw/zinc/33/16/39/341331639.db2.gz RGCPQNNCTCTRPO-QMMMGPOBSA-N 0 0 324.318 5.178 20 0 DKADRN Cc1occc1S[C@@H](C)c1nc2ccccc2n1C(F)F ZINC000551099286 341331582 /nfs/dbraw/zinc/33/15/82/341331582.db2.gz CGPOJJUODZMLSM-JTQLQIEISA-N 0 0 308.353 5.186 20 0 DKADRN Cc1occc1S[C@H](C)c1nc2ccccc2n1C(F)F ZINC000551099287 341331560 /nfs/dbraw/zinc/33/15/60/341331560.db2.gz CGPOJJUODZMLSM-SNVBAGLBSA-N 0 0 308.353 5.186 20 0 DKADRN CCC(=O)Nc1ccc(C)c(N[C@@H](C)c2cccc(C3CC3)c2)c1 ZINC000551125458 341332180 /nfs/dbraw/zinc/33/21/80/341332180.db2.gz OFLPZCARRGMCQX-HNNXBMFYSA-N 0 0 322.452 5.394 20 0 DKADRN CCC(=O)Nc1ccc(C)c(N[C@H](C)c2cccc(C3CC3)c2)c1 ZINC000551125461 341332057 /nfs/dbraw/zinc/33/20/57/341332057.db2.gz OFLPZCARRGMCQX-OAHLLOKOSA-N 0 0 322.452 5.394 20 0 DKADRN Cc1c(COC(C)(C)C)cccc1N[C@@H](C)c1ccncc1F ZINC000551133151 341332289 /nfs/dbraw/zinc/33/22/89/341332289.db2.gz VGBIGHUWOCAVOS-AWEZNQCLSA-N 0 0 316.420 5.017 20 0 DKADRN Cc1c(COC(C)(C)C)cccc1N[C@H](C)c1ccncc1F ZINC000551133152 341332347 /nfs/dbraw/zinc/33/23/47/341332347.db2.gz VGBIGHUWOCAVOS-CQSZACIVSA-N 0 0 316.420 5.017 20 0 DKADRN CC(=O)Nc1ccc(N[C@H](C)c2ccc(F)c3ccccc32)cc1 ZINC000551149175 341332701 /nfs/dbraw/zinc/33/27/01/341332701.db2.gz XVCJOIABZHORJE-CYBMUJFWSA-N 0 0 322.383 5.110 20 0 DKADRN CC(=O)Nc1ccc(N[C@@H](C)c2ccc(F)c3ccccc32)cc1 ZINC000551149178 341332697 /nfs/dbraw/zinc/33/26/97/341332697.db2.gz XVCJOIABZHORJE-ZDUSSCGKSA-N 0 0 322.383 5.110 20 0 DKADRN C[C@H](Nc1cccc(CCCO)c1)c1ccc(F)c2ccccc21 ZINC000551166554 341332941 /nfs/dbraw/zinc/33/29/41/341332941.db2.gz PHPIUIUXYWWLCU-HNNXBMFYSA-N 0 0 323.411 5.077 20 0 DKADRN C[C@@H](Nc1cccc(CCCO)c1)c1ccc(F)c2ccccc21 ZINC000551166555 341332938 /nfs/dbraw/zinc/33/29/38/341332938.db2.gz PHPIUIUXYWWLCU-OAHLLOKOSA-N 0 0 323.411 5.077 20 0 DKADRN CCCCOc1ccc(NC(=O)c2occc2C(C)C)c(C)c1 ZINC000551173167 341332902 /nfs/dbraw/zinc/33/29/02/341332902.db2.gz QWJMARLHAAOXEG-UHFFFAOYSA-N 0 0 315.413 5.143 20 0 DKADRN C=Cc1ccc(C(=O)Nc2cccc(-c3csc(C)n3)c2)cc1 ZINC000551195495 341333692 /nfs/dbraw/zinc/33/36/92/341333692.db2.gz JBVXHHNAPQALCZ-UHFFFAOYSA-N 0 0 320.417 5.014 20 0 DKADRN Cc1cccc(C)c1NC(=O)c1cc(Cl)c(F)cc1Cl ZINC000551219180 341334149 /nfs/dbraw/zinc/33/41/49/341334149.db2.gz FTIUHNFFKRGQBQ-UHFFFAOYSA-N 0 0 312.171 5.002 20 0 DKADRN C[C@@H]([NH2+]Cc1cc2ccccc2s1)c1cc(F)cc(F)c1 ZINC000551238949 341334900 /nfs/dbraw/zinc/33/49/00/341334900.db2.gz IKRKVNYKUWASSC-LLVKDONJSA-N 0 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/nfs/dbraw/zinc/33/51/64/341335164.db2.gz XPRLPERQJMQRHW-CABCVRRESA-N 0 0 311.425 5.067 20 0 DKADRN CC[C@H](C)Oc1cccc(N[C@@H](C)c2ccc3c(c2)COC3)c1 ZINC000551241965 341335150 /nfs/dbraw/zinc/33/51/50/341335150.db2.gz XPRLPERQJMQRHW-GJZGRUSLSA-N 0 0 311.425 5.067 20 0 DKADRN CC[C@@H](C)Oc1cccc(N[C@H](C)c2ccc3c(c2)COC3)c1 ZINC000551241966 341335172 /nfs/dbraw/zinc/33/51/72/341335172.db2.gz XPRLPERQJMQRHW-HUUCEWRRSA-N 0 0 311.425 5.067 20 0 DKADRN CC[C@H](C)Oc1cccc(N[C@H](C)c2ccc3c(c2)COC3)c1 ZINC000551241967 341335248 /nfs/dbraw/zinc/33/52/48/341335248.db2.gz XPRLPERQJMQRHW-LSDHHAIUSA-N 0 0 311.425 5.067 20 0 DKADRN Clc1ccc(-c2nc(-c3ccncc3Cl)cs2)s1 ZINC000551244994 341335413 /nfs/dbraw/zinc/33/54/13/341335413.db2.gz OUDWSWABQVOIPN-UHFFFAOYSA-N 0 0 313.234 5.240 20 0 DKADRN Cc1cc([C@@H](C)N[C@@H](CCC(C)C)c2ccc(Cl)cc2)no1 ZINC000551268135 341336446 /nfs/dbraw/zinc/33/64/46/341336446.db2.gz ORLFBVKWWCTZSZ-PBHICJAKSA-N 0 0 320.864 5.465 20 0 DKADRN Cc1cc([C@@H](C)N[C@H](CCC(C)C)c2ccc(Cl)cc2)no1 ZINC000551268136 341336418 /nfs/dbraw/zinc/33/64/18/341336418.db2.gz ORLFBVKWWCTZSZ-RHSMWYFYSA-N 0 0 320.864 5.465 20 0 DKADRN Cc1cc([C@H](C)N[C@H](CCC(C)C)c2ccc(Cl)cc2)no1 ZINC000551268137 341336369 /nfs/dbraw/zinc/33/63/69/341336369.db2.gz ORLFBVKWWCTZSZ-WMLDXEAASA-N 0 0 320.864 5.465 20 0 DKADRN Cc1cc([C@H](C)N[C@@H](CCC(C)C)c2ccc(Cl)cc2)no1 ZINC000551268138 341336387 /nfs/dbraw/zinc/33/63/87/341336387.db2.gz ORLFBVKWWCTZSZ-YOEHRIQHSA-N 0 0 320.864 5.465 20 0 DKADRN Cc1ccc([C@H](Nc2ccc([C@@H]3CCOC3)cc2)C2CC2)cc1 ZINC000551274134 341336687 /nfs/dbraw/zinc/33/66/87/341336687.db2.gz LADYHBPSHZWCAP-CTNGQTDRSA-N 0 0 307.437 5.062 20 0 DKADRN Cc1ccc([C@H](Nc2ccc([C@H]3CCOC3)cc2)C2CC2)cc1 ZINC000551274136 341336714 /nfs/dbraw/zinc/33/67/14/341336714.db2.gz LADYHBPSHZWCAP-FPOVZHCZSA-N 0 0 307.437 5.062 20 0 DKADRN Cc1ccc([C@@H](Nc2ccc([C@H]3CCOC3)cc2)C2CC2)cc1 ZINC000551274137 341336624 /nfs/dbraw/zinc/33/66/24/341336624.db2.gz LADYHBPSHZWCAP-PZJWPPBQSA-N 0 0 307.437 5.062 20 0 DKADRN Cc1ccc([C@@H](Nc2ccc([C@@H]3CCOC3)cc2)C2CC2)cc1 ZINC000551274138 341336606 /nfs/dbraw/zinc/33/66/06/341336606.db2.gz LADYHBPSHZWCAP-TZIWHRDSSA-N 0 0 307.437 5.062 20 0 DKADRN c1ccc([C@H](CC2CC2)Nc2ccc([C@@H]3CCOC3)cc2)cc1 ZINC000551274156 341336639 /nfs/dbraw/zinc/33/66/39/341336639.db2.gz LLXHANWNSHDANR-CTNGQTDRSA-N 0 0 307.437 5.144 20 0 DKADRN c1ccc([C@H](CC2CC2)Nc2ccc([C@H]3CCOC3)cc2)cc1 ZINC000551274160 341336713 /nfs/dbraw/zinc/33/67/13/341336713.db2.gz LLXHANWNSHDANR-FPOVZHCZSA-N 0 0 307.437 5.144 20 0 DKADRN c1ccc([C@@H](CC2CC2)Nc2ccc([C@H]3CCOC3)cc2)cc1 ZINC000551274161 341336671 /nfs/dbraw/zinc/33/66/71/341336671.db2.gz LLXHANWNSHDANR-PZJWPPBQSA-N 0 0 307.437 5.144 20 0 DKADRN c1ccc([C@@H](CC2CC2)Nc2ccc([C@@H]3CCOC3)cc2)cc1 ZINC000551274162 341336653 /nfs/dbraw/zinc/33/66/53/341336653.db2.gz LLXHANWNSHDANR-TZIWHRDSSA-N 0 0 307.437 5.144 20 0 DKADRN Cc1ccc2cc([C@@H](C)Nc3ccc([C@@H]4CCOC4)cc3)oc2c1 ZINC000551274472 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CCN(C(=O)c1cc2sccc2s1)c1ccccc1Cl ZINC000551891934 341354158 /nfs/dbraw/zinc/35/41/58/341354158.db2.gz ONSNPAVQCZCWLF-UHFFFAOYSA-N 0 0 321.854 5.283 20 0 DKADRN Cc1ncsc1CCNc1ccc2oc3ccccc3c2c1 ZINC000551929686 341355354 /nfs/dbraw/zinc/35/53/54/341355354.db2.gz OTZHZTHBPYIEQI-UHFFFAOYSA-N 0 0 308.406 5.006 20 0 DKADRN CCN(Cc1nc(C)cs1)C(c1ccccc1)c1ccccc1 ZINC000551985390 341357161 /nfs/dbraw/zinc/35/71/61/341357161.db2.gz CJSNQNSEFDORGE-UHFFFAOYSA-N 0 0 322.477 5.063 20 0 DKADRN Cc1cccc(C(C)C)c1NC(=O)[C@@H]1CC[C@@H](C(F)(F)F)C1 ZINC000552053012 341365362 /nfs/dbraw/zinc/36/53/62/341365362.db2.gz OKYGJBLYCVCBTP-CHWSQXEVSA-N 0 0 313.363 5.036 20 0 DKADRN Cc1cccc(C(C)C)c1NC(=O)[C@@H]1CC[C@H](C(F)(F)F)C1 ZINC000552053013 341365373 /nfs/dbraw/zinc/36/53/73/341365373.db2.gz OKYGJBLYCVCBTP-OLZOCXBDSA-N 0 0 313.363 5.036 20 0 DKADRN Cc1cccc(C(C)C)c1NC(=O)[C@H]1CC[C@@H](C(F)(F)F)C1 ZINC000552053014 341365378 /nfs/dbraw/zinc/36/53/78/341365378.db2.gz OKYGJBLYCVCBTP-QWHCGFSZSA-N 0 0 313.363 5.036 20 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305.462 5.075 20 0 DKADRN CC[C@@H](C)CCC(=O)Nc1cccc(COC(C)(C)C)c1C ZINC000552065940 341366843 /nfs/dbraw/zinc/36/68/43/341366843.db2.gz UBMSBRHSPFOXSE-CQSZACIVSA-N 0 0 305.462 5.075 20 0 DKADRN CC(C)CC[C@@H](Nc1cnn([C@@H](C)C2CC2)c1)c1ccoc1 ZINC000552065959 341366900 /nfs/dbraw/zinc/36/69/00/341366900.db2.gz UPPRWYDBOJGZFR-KBXCAEBGSA-N 0 0 301.434 5.037 20 0 DKADRN CC(C)CC[C@H](Nc1cnn([C@H](C)C2CC2)c1)c1ccoc1 ZINC000552065960 341366803 /nfs/dbraw/zinc/36/68/03/341366803.db2.gz UPPRWYDBOJGZFR-KDOFPFPSSA-N 0 0 301.434 5.037 20 0 DKADRN CC(C)CC[C@H](Nc1cnn([C@@H](C)C2CC2)c1)c1ccoc1 ZINC000552065961 341366771 /nfs/dbraw/zinc/36/67/71/341366771.db2.gz UPPRWYDBOJGZFR-KSSFIOAISA-N 0 0 301.434 5.037 20 0 DKADRN CC(C)CC[C@@H](Nc1cnn([C@H](C)C2CC2)c1)c1ccoc1 ZINC000552065962 341366863 /nfs/dbraw/zinc/36/68/63/341366863.db2.gz UPPRWYDBOJGZFR-RDTXWAMCSA-N 0 0 301.434 5.037 20 0 DKADRN C[C@H](Nc1cccc(CSC2CCCCC2)c1)c1ncc[nH]1 ZINC000552066027 341366821 /nfs/dbraw/zinc/36/68/21/341366821.db2.gz WITVPVZLZXGJJA-AWEZNQCLSA-N 0 0 315.486 5.149 20 0 DKADRN C[C@@H](Nc1cccc(CSC2CCCCC2)c1)c1ncc[nH]1 ZINC000552066028 341366786 /nfs/dbraw/zinc/36/67/86/341366786.db2.gz WITVPVZLZXGJJA-CQSZACIVSA-N 0 0 315.486 5.149 20 0 DKADRN Cc1cc(SC2CCCCC2)ccc1N[C@@H](C)c1ncc[nH]1 ZINC000552066352 341366769 /nfs/dbraw/zinc/36/67/69/341366769.db2.gz GMLBEBUSVHPFAZ-AWEZNQCLSA-N 0 0 315.486 5.316 20 0 DKADRN Cc1cc(SC2CCCCC2)ccc1N[C@H](C)c1ncc[nH]1 ZINC000552066353 341366870 /nfs/dbraw/zinc/36/68/70/341366870.db2.gz GMLBEBUSVHPFAZ-CQSZACIVSA-N 0 0 315.486 5.316 20 0 DKADRN Cc1ccnc([C@H](C)N[C@H](C)c2cc(Cl)ccc2Cl)c1 ZINC000552067038 341366961 /nfs/dbraw/zinc/36/69/61/341366961.db2.gz ZBNZLUYLEAVJKY-NEPJUHHUSA-N 0 0 309.240 5.109 20 0 DKADRN Cc1ccnc([C@@H](C)N[C@H](C)c2cc(Cl)ccc2Cl)c1 ZINC000552067039 341367047 /nfs/dbraw/zinc/36/70/47/341367047.db2.gz ZBNZLUYLEAVJKY-VXGBXAGGSA-N 0 0 309.240 5.109 20 0 DKADRN Cc1ccnc([C@H](C)Nc2ccccc2Cc2ccccc2)c1 ZINC000552070595 341367332 /nfs/dbraw/zinc/36/73/32/341367332.db2.gz YKKSEELXQQRXCA-KRWDZBQOSA-N 0 0 302.421 5.154 20 0 DKADRN Cc1ccnc([C@@H](C)Nc2ccccc2Cc2ccccc2)c1 ZINC000552070596 341367278 /nfs/dbraw/zinc/36/72/78/341367278.db2.gz YKKSEELXQQRXCA-QGZVFWFLSA-N 0 0 302.421 5.154 20 0 DKADRN Cc1ccc(SCc2ccc(OCc3cccnc3)cc2)cc1 ZINC000552082530 341368118 /nfs/dbraw/zinc/36/81/18/341368118.db2.gz VEMDZNBRRSSTJK-UHFFFAOYSA-N 0 0 321.445 5.261 20 0 DKADRN CSc1cccc(F)c1CN[C@H](C)c1cc2ccccc2o1 ZINC000552090920 341369097 /nfs/dbraw/zinc/36/90/97/341369097.db2.gz XHYFGJOKXXQDGD-GFCCVEGCSA-N 0 0 315.413 5.145 20 0 DKADRN CSc1cccc(F)c1CN[C@@H](C)c1cc2ccccc2o1 ZINC000552090921 341369045 /nfs/dbraw/zinc/36/90/45/341369045.db2.gz XHYFGJOKXXQDGD-LBPRGKRZSA-N 0 0 315.413 5.145 20 0 DKADRN O=C(Nc1cccc(C(F)F)c1Cl)c1sccc1Cl ZINC000552162086 341374737 /nfs/dbraw/zinc/37/47/37/341374737.db2.gz FBPVQPCALJXFPT-UHFFFAOYSA-N 0 0 322.163 5.245 20 0 DKADRN O=C(Nc1cc(Cl)c(F)c(Cl)c1)c1sccc1Cl ZINC000552202089 341378057 /nfs/dbraw/zinc/37/80/57/341378057.db2.gz HHGCXVKIHUKEFB-UHFFFAOYSA-N 0 0 324.591 5.100 20 0 DKADRN Cc1ncsc1CNc1cccc(Cl)c1SC(C)C ZINC000552203360 341378175 /nfs/dbraw/zinc/37/81/75/341378175.db2.gz JTNIFBSBEWWCCC-UHFFFAOYSA-N 0 0 312.891 5.218 20 0 DKADRN CC(C)(C)Oc1ccccc1NCc1cnc2ccccc2c1 ZINC000552219937 341379107 /nfs/dbraw/zinc/37/91/07/341379107.db2.gz FJDCVYZNCAHLDU-UHFFFAOYSA-N 0 0 306.409 5.024 20 0 DKADRN CC[C@@H](C)Oc1cccc(NC(=O)c2sccc2C2CC2)c1 ZINC000552224456 341379525 /nfs/dbraw/zinc/37/95/25/341379525.db2.gz FSSARIQJNRIPQC-GFCCVEGCSA-N 0 0 315.438 5.055 20 0 DKADRN CC[C@H](C)Oc1cccc(NC(=O)c2sccc2C2CC2)c1 ZINC000552224457 341379396 /nfs/dbraw/zinc/37/93/96/341379396.db2.gz FSSARIQJNRIPQC-LBPRGKRZSA-N 0 0 315.438 5.055 20 0 DKADRN CC(C)CC[C@H](NCc1cc(-c2ccccc2)on1)c1ccoc1 ZINC000552246103 341381008 /nfs/dbraw/zinc/38/10/08/341381008.db2.gz IOKVPWIBQRKHPN-IBGZPJMESA-N 0 0 324.424 5.202 20 0 DKADRN CC(C)CC[C@@H](NCc1cc(-c2ccccc2)on1)c1ccoc1 ZINC000552246104 341381026 /nfs/dbraw/zinc/38/10/26/341381026.db2.gz IOKVPWIBQRKHPN-LJQANCHMSA-N 0 0 324.424 5.202 20 0 DKADRN CC[C@H](Nc1cccc2c1OCC[C@@H]2OC)c1cccc(C)c1 ZINC000552264043 341382317 /nfs/dbraw/zinc/38/23/17/341382317.db2.gz WAYVWOWRQRSFJQ-HKUYNNGSSA-N 0 0 311.425 5.028 20 0 DKADRN CC[C@@H](Nc1cccc2c1OCC[C@H]2OC)c1cccc(C)c1 ZINC000552264044 341382244 /nfs/dbraw/zinc/38/22/44/341382244.db2.gz WAYVWOWRQRSFJQ-IEBWSBKVSA-N 0 0 311.425 5.028 20 0 DKADRN CC[C@@H](Nc1cccc2c1OCC[C@@H]2OC)c1cccc(C)c1 ZINC000552264045 341382281 /nfs/dbraw/zinc/38/22/81/341382281.db2.gz WAYVWOWRQRSFJQ-MJGOQNOKSA-N 0 0 311.425 5.028 20 0 DKADRN CC[C@H](Nc1cccc2c1OCC[C@H]2OC)c1cccc(C)c1 ZINC000552264046 341382236 /nfs/dbraw/zinc/38/22/36/341382236.db2.gz WAYVWOWRQRSFJQ-PKOBYXMFSA-N 0 0 311.425 5.028 20 0 DKADRN Cc1ccnc([C@@H](C)NC2(c3ccc(Cl)c(Cl)c3)CC2)c1 ZINC000552265035 341382356 /nfs/dbraw/zinc/38/23/56/341382356.db2.gz HINNLZSSIQSSPB-GFCCVEGCSA-N 0 0 321.251 5.037 20 0 DKADRN Cc1ccnc([C@H](C)NC2(c3ccc(Cl)c(Cl)c3)CC2)c1 ZINC000552265036 341382393 /nfs/dbraw/zinc/38/23/93/341382393.db2.gz HINNLZSSIQSSPB-LBPRGKRZSA-N 0 0 321.251 5.037 20 0 DKADRN Clc1cnc(CNCc2ccc(C3CCCCC3)cc2)s1 ZINC000552273571 341382813 /nfs/dbraw/zinc/38/28/13/341382813.db2.gz MOMZZJZZIDMLSW-UHFFFAOYSA-N 0 0 320.889 5.134 20 0 DKADRN Cc1ccnc([C@@H](C)[NH2+][C@@H](Cc2ccccc2)c2cccs2)c1 ZINC000552275465 341383092 /nfs/dbraw/zinc/38/30/92/341383092.db2.gz WQILFHKBSHMEKU-APWZRJJASA-N 0 0 322.477 5.086 20 0 DKADRN Cc1ccnc([C@H](C)[NH2+][C@@H](Cc2ccccc2)c2cccs2)c1 ZINC000552275466 341383157 /nfs/dbraw/zinc/38/31/57/341383157.db2.gz WQILFHKBSHMEKU-LPHOPBHVSA-N 0 0 322.477 5.086 20 0 DKADRN Cc1ccnc([C@H](C)[NH2+][C@H](Cc2ccccc2)c2cccs2)c1 ZINC000552275467 341383131 /nfs/dbraw/zinc/38/31/31/341383131.db2.gz WQILFHKBSHMEKU-QFBILLFUSA-N 0 0 322.477 5.086 20 0 DKADRN Cc1ccnc([C@@H](C)[NH2+][C@H](Cc2ccccc2)c2cccs2)c1 ZINC000552275468 341383199 /nfs/dbraw/zinc/38/31/99/341383199.db2.gz WQILFHKBSHMEKU-VQIMIIECSA-N 0 0 322.477 5.086 20 0 DKADRN Cc1ccnc([C@@H](C)Nc2ccc3oc(C(C)(C)C)nc3c2)c1 ZINC000552276217 341383354 /nfs/dbraw/zinc/38/33/54/341383354.db2.gz PAMFDUTXTNAIBJ-CYBMUJFWSA-N 0 0 309.413 5.002 20 0 DKADRN Cc1ccnc([C@H](C)Nc2ccc3oc(C(C)(C)C)nc3c2)c1 ZINC000552276218 341383403 /nfs/dbraw/zinc/38/34/03/341383403.db2.gz PAMFDUTXTNAIBJ-ZDUSSCGKSA-N 0 0 309.413 5.002 20 0 DKADRN Cc1ccnc([C@H](C)Nc2cccc(COC(C)(C)C)c2C)c1 ZINC000552281803 341383769 /nfs/dbraw/zinc/38/37/69/341383769.db2.gz KGWKXUBOLWIZRT-INIZCTEOSA-N 0 0 312.457 5.187 20 0 DKADRN Cc1ccnc([C@@H](C)Nc2cccc(COC(C)(C)C)c2C)c1 ZINC000552281804 341383818 /nfs/dbraw/zinc/38/38/18/341383818.db2.gz KGWKXUBOLWIZRT-MRXNPFEDSA-N 0 0 312.457 5.187 20 0 DKADRN CSCc1cccc(N[C@H](c2ncc[nH]2)C2CCCCC2)c1 ZINC000552282172 341383855 /nfs/dbraw/zinc/38/38/55/341383855.db2.gz YLNUTVMCLJLXCU-KRWDZBQOSA-N 0 0 315.486 5.006 20 0 DKADRN CSCc1cccc(N[C@@H](c2ncc[nH]2)C2CCCCC2)c1 ZINC000552282173 341383781 /nfs/dbraw/zinc/38/37/81/341383781.db2.gz YLNUTVMCLJLXCU-QGZVFWFLSA-N 0 0 315.486 5.006 20 0 DKADRN Cc1ccnc([C@H](C)Nc2cccc(COC3CCCCC3)c2)c1 ZINC000552285713 341384311 /nfs/dbraw/zinc/38/43/11/341384311.db2.gz ZORMNWJNYWSQLZ-KRWDZBQOSA-N 0 0 324.468 5.412 20 0 DKADRN Cc1ccnc([C@@H](C)Nc2cccc(COC3CCCCC3)c2)c1 ZINC000552285714 341384349 /nfs/dbraw/zinc/38/43/49/341384349.db2.gz ZORMNWJNYWSQLZ-QGZVFWFLSA-N 0 0 324.468 5.412 20 0 DKADRN CCCn1ccc2ccc(NC(=O)c3sccc3Cl)cc21 ZINC000552286588 341384369 /nfs/dbraw/zinc/38/43/69/341384369.db2.gz UFHRJFWASXQQFZ-UHFFFAOYSA-N 0 0 318.829 5.019 20 0 DKADRN CCN(C(=O)Nc1cc(Cl)ccc1SC(C)C)C(C)C ZINC000552305158 341385349 /nfs/dbraw/zinc/38/53/49/341385349.db2.gz YNUFSXYOARKNBT-UHFFFAOYSA-N 0 0 314.882 5.103 20 0 DKADRN CC(C)Sc1ccccc1NC(=O)c1sccc1Cl ZINC000552349105 341388394 /nfs/dbraw/zinc/38/83/94/341388394.db2.gz XEBZZVRVAYVMPF-UHFFFAOYSA-N 0 0 311.859 5.154 20 0 DKADRN Cc1oc(C(C)C)cc1C(=O)Nc1cccnc1-c1ccccc1 ZINC000552377940 341389956 /nfs/dbraw/zinc/38/99/56/341389956.db2.gz DUESLLHLVAITDM-UHFFFAOYSA-N 0 0 320.392 5.026 20 0 DKADRN Cc1coc(C)c1C(=O)Nc1c(C)cc(Cl)c2ccccc21 ZINC000552427709 341393238 /nfs/dbraw/zinc/39/32/38/341393238.db2.gz PDHJBXKDFFONAC-UHFFFAOYSA-N 0 0 313.784 5.264 20 0 DKADRN CCC(C)(C)OCc1cccc(NCc2ncc(C)s2)c1C ZINC000552461231 341394674 /nfs/dbraw/zinc/39/46/74/341394674.db2.gz AUZWCWBPCOIZGM-UHFFFAOYSA-N 0 0 318.486 5.077 20 0 DKADRN Cc1cnc(CNc2cccc(Cl)c2SC(C)C)s1 ZINC000552461689 341394592 /nfs/dbraw/zinc/39/45/92/341394592.db2.gz MWUAESIYYIGWHP-UHFFFAOYSA-N 0 0 312.891 5.218 20 0 DKADRN Cc1oc(C(C)C)cc1C(=O)Nc1cccc(C(C)(F)F)c1 ZINC000552491551 341396170 /nfs/dbraw/zinc/39/61/70/341396170.db2.gz RXLGTHYURYCSJW-UHFFFAOYSA-N 0 0 307.340 5.075 20 0 DKADRN Cc1oc(C(C)C)cc1C(=O)Nc1cnccc1-c1ccccc1 ZINC000552533215 341397692 /nfs/dbraw/zinc/39/76/92/341397692.db2.gz BIDVZIPHRRVWMD-UHFFFAOYSA-N 0 0 320.392 5.026 20 0 DKADRN Cc1csc(CNc2cccc(CSC(C)C)c2C)n1 ZINC000552536233 341397937 /nfs/dbraw/zinc/39/79/37/341397937.db2.gz VKFWYNCQEDCMFE-UHFFFAOYSA-N 0 0 306.500 5.014 20 0 DKADRN Cc1ccc(-c2ccc(C)c(NC(=O)c3cc[nH]c3C(C)C)c2)o1 ZINC000552553180 341398482 /nfs/dbraw/zinc/39/84/82/341398482.db2.gz DWLZUTJMJYMUOO-UHFFFAOYSA-N 0 0 322.408 5.267 20 0 DKADRN CC[C@@H](C)Sc1ccc(NCc2scnc2C)c(C)c1 ZINC000552554514 341398517 /nfs/dbraw/zinc/39/85/17/341398517.db2.gz HTBQHICFHRXOQV-GFCCVEGCSA-N 0 0 306.500 5.263 20 0 DKADRN CC[C@H](C)Sc1ccc(NCc2scnc2C)c(C)c1 ZINC000552554517 341398522 /nfs/dbraw/zinc/39/85/22/341398522.db2.gz HTBQHICFHRXOQV-LBPRGKRZSA-N 0 0 306.500 5.263 20 0 DKADRN O=C(Nc1cc(Cl)c(Cl)cc1F)c1sccc1Cl ZINC000552562399 341398855 /nfs/dbraw/zinc/39/88/55/341398855.db2.gz GZKYOVHKJOQUNL-UHFFFAOYSA-N 0 0 324.591 5.100 20 0 DKADRN Cc1nc([C@H](C)N[C@H](c2ccc(Cl)cc2)[C@H]2C[C@@H]2C)cs1 ZINC000552569139 341399193 /nfs/dbraw/zinc/39/91/93/341399193.db2.gz FNLFMONPOMDADU-NGAQBULDSA-N 0 0 320.889 5.153 20 0 DKADRN Cc1nc([C@H](C)N[C@H](c2ccc(Cl)cc2)[C@@H]2C[C@@H]2C)cs1 ZINC000552569140 341399196 /nfs/dbraw/zinc/39/91/96/341399196.db2.gz FNLFMONPOMDADU-PNCBDVDHSA-N 0 0 320.889 5.153 20 0 DKADRN Cc1nc([C@H](C)N[C@H](c2ccc(Cl)cc2)[C@H]2C[C@H]2C)cs1 ZINC000552569141 341399184 /nfs/dbraw/zinc/39/91/84/341399184.db2.gz FNLFMONPOMDADU-PPKUODPHSA-N 0 0 320.889 5.153 20 0 DKADRN Cc1nc([C@H](C)N[C@H](c2ccc(Cl)cc2)[C@@H]2C[C@H]2C)cs1 ZINC000552569142 341399165 /nfs/dbraw/zinc/39/91/65/341399165.db2.gz FNLFMONPOMDADU-VODVUFLWSA-N 0 0 320.889 5.153 20 0 DKADRN Cc1c(NC(=O)c2ccc(C(C)C)cc2)cccc1-c1ncco1 ZINC000552574609 341399318 /nfs/dbraw/zinc/39/93/18/341399318.db2.gz KPFIGQJSEGXFIS-UHFFFAOYSA-N 0 0 320.392 5.026 20 0 DKADRN CCCC[C@H](CC)CC(=O)Nc1cccc(-c2ncco2)c1C ZINC000552574957 341399349 /nfs/dbraw/zinc/39/93/49/341399349.db2.gz UATFSLQIGWWHNH-HNNXBMFYSA-N 0 0 314.429 5.195 20 0 DKADRN CCCC[C@@H](CC)CC(=O)Nc1cccc(-c2ncco2)c1C ZINC000552574959 341399337 /nfs/dbraw/zinc/39/93/37/341399337.db2.gz UATFSLQIGWWHNH-OAHLLOKOSA-N 0 0 314.429 5.195 20 0 DKADRN Cc1cnc([C@H](C)Sc2nc(C)c(C)n2C2CCCCC2)o1 ZINC000552662698 341401785 /nfs/dbraw/zinc/40/17/85/341401785.db2.gz RSSMXJAMCCWQEQ-AWEZNQCLSA-N 0 0 319.474 5.155 20 0 DKADRN O=C(CC1=CCCCC1)Nc1ccc2nc(C(F)F)sc2c1 ZINC000552725392 341402902 /nfs/dbraw/zinc/40/29/02/341402902.db2.gz OVIOVAIYKJEKMX-UHFFFAOYSA-N 0 0 322.380 5.063 20 0 DKADRN Cc1csc2[nH]c(-c3ccc(-c4ccccc4)cc3)nc(=O)c12 ZINC000552793927 341404525 /nfs/dbraw/zinc/40/45/25/341404525.db2.gz IWTZPOIHCVNBKE-UHFFFAOYSA-N 0 0 318.401 5.039 20 0 DKADRN CC[C@H](C)Sc1ccc(NCc2ncc(C)s2)c(C)c1 ZINC000552805890 341404865 /nfs/dbraw/zinc/40/48/65/341404865.db2.gz SNGZSXSAFUNGHK-LBPRGKRZSA-N 0 0 306.500 5.263 20 0 DKADRN Cc1ccccc1N(C(=O)Cc1cccc2ccccc21)C(C)C ZINC000552810117 341404876 /nfs/dbraw/zinc/40/48/76/341404876.db2.gz MFDWSXIGRRYZAR-UHFFFAOYSA-N 0 0 317.432 5.132 20 0 DKADRN Cc1cc(C)c(NC(=O)NCc2cc3ccccc3s2)c(C)c1 ZINC000552959836 341410611 /nfs/dbraw/zinc/41/06/11/341410611.db2.gz RZGNCRXXPNEDNV-UHFFFAOYSA-N 0 0 324.449 5.148 20 0 DKADRN Clc1ccc(SCc2csc(-c3ccoc3)n2)cc1 ZINC000552963894 341410802 /nfs/dbraw/zinc/41/08/02/341410802.db2.gz ANYLMTQOVPYSRY-UHFFFAOYSA-N 0 0 307.827 5.349 20 0 DKADRN CCCC[C@@H](CCC)Sc1nnc(Cc2cccc(F)c2)o1 ZINC000553032502 341413626 /nfs/dbraw/zinc/41/36/26/341413626.db2.gz HCPFWMFJFZXPDS-OAHLLOKOSA-N 0 0 322.449 5.251 20 0 DKADRN Cc1cccc(C)c1NC(=O)c1coc2ccc(C(C)C)cc12 ZINC000553036648 341413775 /nfs/dbraw/zinc/41/37/75/341413775.db2.gz CXELNRQYYXPQDW-UHFFFAOYSA-N 0 0 307.393 5.425 20 0 DKADRN CC(C)c1ccc2occ(C(=O)Nc3c(F)cccc3F)c2c1 ZINC000553191227 341419434 /nfs/dbraw/zinc/41/94/34/341419434.db2.gz HTGRNUHBMWRZGI-UHFFFAOYSA-N 0 0 315.319 5.087 20 0 DKADRN COc1cccc(C)c1NC(=O)c1coc2ccc(C(C)C)cc12 ZINC000553205309 341419926 /nfs/dbraw/zinc/41/99/26/341419926.db2.gz ALCVXQKMPHSYRR-UHFFFAOYSA-N 0 0 323.392 5.126 20 0 DKADRN Cc1cccc(OC(F)F)c1NC(=O)CCCCC(C)(C)C ZINC000553237245 341421374 /nfs/dbraw/zinc/42/13/74/341421374.db2.gz SMJHSXVABYJDNP-UHFFFAOYSA-N 0 0 313.388 5.141 20 0 DKADRN O=C(Nc1ccc2nc(C(F)F)sc2c1)C1=CCCCCC1 ZINC000553303942 341424411 /nfs/dbraw/zinc/42/44/11/341424411.db2.gz UDOPCKWIGTZWFQ-UHFFFAOYSA-N 0 0 322.380 5.063 20 0 DKADRN C[C@@H](Sc1nc(C(F)(F)F)ns1)c1ccc(Cl)cc1 ZINC000553339708 341426364 /nfs/dbraw/zinc/42/63/64/341426364.db2.gz OZUNMUSHBNPSGV-ZCFIWIBFSA-N 0 0 324.780 5.064 20 0 DKADRN Cc1ccc(-c2ncco2)cc1NC(=O)CCCCC(C)(C)C ZINC000553434636 341428849 /nfs/dbraw/zinc/42/88/49/341428849.db2.gz LNKAEFZVRLJLTP-UHFFFAOYSA-N 0 0 314.429 5.195 20 0 DKADRN CSc1ccc(OCc2csc(-c3ccc(C)o3)n2)cc1 ZINC000553488060 341430335 /nfs/dbraw/zinc/43/03/35/341430335.db2.gz QZZSVIYGUVIJGE-UHFFFAOYSA-N 0 0 317.435 5.012 20 0 DKADRN FC(F)(F)[C@@H](NCc1ccc2ccccc2c1)c1ccccc1 ZINC000553498189 341430482 /nfs/dbraw/zinc/43/04/82/341430482.db2.gz KWWKXNXSUXXZAC-SFHVURJKSA-N 0 0 315.338 5.233 20 0 DKADRN Cc1c2ccccc2sc1-c1csc(C2CCOCC2)n1 ZINC000553521258 341431085 /nfs/dbraw/zinc/43/10/85/341431085.db2.gz WSXOQJDPDHDLIZ-UHFFFAOYSA-N 0 0 315.463 5.227 20 0 DKADRN C[C@@H](CCC(=O)N1C[C@H](C)C[C@H]1c1ccccc1)c1ccccc1 ZINC000553675247 341433782 /nfs/dbraw/zinc/43/37/82/341433782.db2.gz VYRNAWQNSDPCNZ-LQWHRVPQSA-N 0 0 321.464 5.180 20 0 DKADRN C[C@@H](CCC(=O)N1C[C@H](C)C[C@@H]1c1ccccc1)c1ccccc1 ZINC000553675248 341433769 /nfs/dbraw/zinc/43/37/69/341433769.db2.gz VYRNAWQNSDPCNZ-LVCYWYKZSA-N 0 0 321.464 5.180 20 0 DKADRN CC(C)CN(C(=O)c1cc2cc(F)ccc2s1)C1CCCC1 ZINC000553779259 341435791 /nfs/dbraw/zinc/43/57/91/341435791.db2.gz UEBCGBJZCIYQND-UHFFFAOYSA-N 0 0 319.445 5.081 20 0 DKADRN COc1ccc2cc([C@@H](C)[S@@](=O)CCCC(C)C)ccc2c1 ZINC000553785770 341435957 /nfs/dbraw/zinc/43/59/57/341435957.db2.gz JJTDCDJZGRTWOT-QRQCRPRQSA-N 0 0 318.482 5.094 20 0 DKADRN CCCCN(C(=O)c1cc(C2CC2)nc2ccccc21)[C@H](C)CC ZINC000553818141 341436404 /nfs/dbraw/zinc/43/64/04/341436404.db2.gz BRYBQXQIYVPLMD-OAHLLOKOSA-N 0 0 324.468 5.153 20 0 DKADRN FC(F)(F)[C@H](NCc1csc2ccccc12)c1ccccc1 ZINC000553833973 341436713 /nfs/dbraw/zinc/43/67/13/341436713.db2.gz CFKYFENMGVZFKN-MRXNPFEDSA-N 0 0 321.367 5.295 20 0 DKADRN Cc1cc(C)n(CCSC(c2ccccc2)c2ccccc2)n1 ZINC000553856416 341437206 /nfs/dbraw/zinc/43/72/06/341437206.db2.gz PLQHYFGKLLHATI-UHFFFAOYSA-N 0 0 322.477 5.023 20 0 DKADRN Cc1ccc([C@@H](C)NC2(c3c(Cl)cccc3Cl)CC2)o1 ZINC000553912683 341438402 /nfs/dbraw/zinc/43/84/02/341438402.db2.gz FPTYGJYTSCQGAT-LLVKDONJSA-N 0 0 310.224 5.235 20 0 DKADRN CSc1ccc(C)c(N[C@@H](C)c2ccc3ccccc3n2)c1 ZINC000553933044 341438741 /nfs/dbraw/zinc/43/87/41/341438741.db2.gz IVWYWFVRGGJCMK-AWEZNQCLSA-N 0 0 308.450 5.438 20 0 DKADRN CSc1ccc(C)c(N[C@H](C)c2ccc3ccccc3n2)c1 ZINC000553933054 341438791 /nfs/dbraw/zinc/43/87/91/341438791.db2.gz IVWYWFVRGGJCMK-CQSZACIVSA-N 0 0 308.450 5.438 20 0 DKADRN COc1cccc(SCc2ccccc2Oc2cccnc2)c1 ZINC000553965816 341439325 /nfs/dbraw/zinc/43/93/25/341439325.db2.gz IOBXSENWWCZJDM-UHFFFAOYSA-N 0 0 323.417 5.175 20 0 DKADRN c1cc(-c2noc(-c3cc4c(ccc5ccccc45)[nH]3)n2)cs1 ZINC000554024616 341440877 /nfs/dbraw/zinc/44/08/77/341440877.db2.gz GEONBDAYOXELFE-UHFFFAOYSA-N 0 0 317.373 5.100 20 0 DKADRN Cc1ccc(C)c(NC(=O)N2C[C@@H](C)CC[C@H]2c2ccccc2)c1 ZINC000554036847 341441260 /nfs/dbraw/zinc/44/12/60/341441260.db2.gz WSAKMYGUQSSFSP-JXFKEZNVSA-N 0 0 322.452 5.309 20 0 DKADRN Cc1ccc(C)c(NC(=O)N2C[C@@H](C)CC[C@@H]2c2ccccc2)c1 ZINC000554036848 341441259 /nfs/dbraw/zinc/44/12/59/341441259.db2.gz WSAKMYGUQSSFSP-OXJNMPFZSA-N 0 0 322.452 5.309 20 0 DKADRN Cc1ccc(C)c(NC(=O)N2C[C@H](C)CC[C@@H]2c2ccccc2)c1 ZINC000554036849 341441275 /nfs/dbraw/zinc/44/12/75/341441275.db2.gz WSAKMYGUQSSFSP-OXQOHEQNSA-N 0 0 322.452 5.309 20 0 DKADRN Cc1ccc(C)c(NC(=O)N2C[C@H](C)CC[C@H]2c2ccccc2)c1 ZINC000554036850 341441286 /nfs/dbraw/zinc/44/12/86/341441286.db2.gz WSAKMYGUQSSFSP-UZLBHIALSA-N 0 0 322.452 5.309 20 0 DKADRN CC1(C)CN(C(=O)Nc2ccc(Cl)cc2)[C@H]1c1cccs1 ZINC000554059116 341441955 /nfs/dbraw/zinc/44/19/55/341441955.db2.gz HFXNQTPACQKPCP-AWEZNQCLSA-N 0 0 320.845 5.017 20 0 DKADRN CCc1cccc(C)c1NC(=O)N([C@H](C)c1ccccc1)C1CC1 ZINC000554060472 341442041 /nfs/dbraw/zinc/44/20/41/341442041.db2.gz BXEDDGGYENPAQL-MRXNPFEDSA-N 0 0 322.452 5.315 20 0 DKADRN CC(C)c1cccc(C(C)C)c1NC(=O)N[C@@H]1CCC1(C)C ZINC000554063074 341442178 /nfs/dbraw/zinc/44/21/78/341442178.db2.gz ZSEIFILDEHGVDM-MRXNPFEDSA-N 0 0 302.462 5.244 20 0 DKADRN COc1cc(C)c(NC(=O)c2cccc3ccccc32)c(C)c1C ZINC000554079918 341443014 /nfs/dbraw/zinc/44/30/14/341443014.db2.gz LMTDDFRYVJWMNI-UHFFFAOYSA-N 0 0 319.404 5.026 20 0 DKADRN C/C=C/c1ccc(N[C@@H](C)c2ncc(Br)s2)cc1 ZINC000554087139 341443417 /nfs/dbraw/zinc/44/34/17/341443417.db2.gz UJLKBSVMZLGJNV-FSIBCCDJSA-N 0 0 323.259 5.112 20 0 DKADRN C/C=C/c1ccc(N[C@H](C)c2ncc(Br)s2)cc1 ZINC000554087142 332137458 /nfs/dbraw/zinc/13/74/58/332137458.db2.gz UJLKBSVMZLGJNV-HMDXOVGESA-N 0 0 323.259 5.112 20 0 DKADRN C/C=C\c1ccc(N[C@H](C)c2ncc(Br)s2)cc1 ZINC000554087145 332137596 /nfs/dbraw/zinc/13/75/96/332137596.db2.gz UJLKBSVMZLGJNV-UMBAGQNISA-N 0 0 323.259 5.112 20 0 DKADRN C/C=C\c1ccc(N[C@@H](C)c2ncc(Br)s2)cc1 ZINC000554087150 332137490 /nfs/dbraw/zinc/13/74/90/332137490.db2.gz UJLKBSVMZLGJNV-XOULXFPDSA-N 0 0 323.259 5.112 20 0 DKADRN C/C=C/c1ccc(N[C@@H](c2ccc(F)cc2)c2ccccn2)cc1 ZINC000554087629 341443457 /nfs/dbraw/zinc/44/34/57/341443457.db2.gz YMMLDKMZVPNNQX-RHRNASEZSA-N 0 0 318.395 5.455 20 0 DKADRN C/C=C\c1ccc(N[C@@H](c2ccc(F)cc2)c2ccccn2)cc1 ZINC000554087630 341443381 /nfs/dbraw/zinc/44/33/81/341443381.db2.gz YMMLDKMZVPNNQX-RYRPJRTCSA-N 0 0 318.395 5.455 20 0 DKADRN C/C=C/c1ccc(N[C@H](c2ccc(F)cc2)c2ccccn2)cc1 ZINC000554087631 341443390 /nfs/dbraw/zinc/44/33/90/341443390.db2.gz YMMLDKMZVPNNQX-XGLIRFAXSA-N 0 0 318.395 5.455 20 0 DKADRN Cc1csc(-c2cccc(N[C@H](C)c3csc(C)n3)c2)n1 ZINC000554111922 341444547 /nfs/dbraw/zinc/44/45/47/341444547.db2.gz CYILEVBALYCDOG-LLVKDONJSA-N 0 0 315.467 5.057 20 0 DKADRN Cc1csc(-c2cccc(N[C@@H](C)c3csc(C)n3)c2)n1 ZINC000554111923 341444504 /nfs/dbraw/zinc/44/45/04/341444504.db2.gz CYILEVBALYCDOG-NSHDSACASA-N 0 0 315.467 5.057 20 0 DKADRN C[C@@H](Nc1ccc2nc(C(C)(C)C)sc2c1)c1ccncc1 ZINC000554115114 341444814 /nfs/dbraw/zinc/44/48/14/341444814.db2.gz QLXQPBQJMUMWOO-GFCCVEGCSA-N 0 0 311.454 5.162 20 0 DKADRN C[C@H](Nc1ccc2nc(C(C)(C)C)sc2c1)c1ccncc1 ZINC000554115115 341444726 /nfs/dbraw/zinc/44/47/26/341444726.db2.gz QLXQPBQJMUMWOO-LBPRGKRZSA-N 0 0 311.454 5.162 20 0 DKADRN C[C@@H](Nc1ccccc1COCc1ccccc1)c1ccsc1 ZINC000554132673 341445269 /nfs/dbraw/zinc/44/52/69/341445269.db2.gz SPODSZZLWYEAPF-MRXNPFEDSA-N 0 0 323.461 5.638 20 0 DKADRN CCCc1ccccc1NC(=O)N([C@@H](C)c1ccccc1)C1CC1 ZINC000554133152 341445235 /nfs/dbraw/zinc/44/52/35/341445235.db2.gz UPPWVTNPBOQICY-INIZCTEOSA-N 0 0 322.452 5.397 20 0 DKADRN CC(C)COc1cccc(N[C@H](C)c2nc3ccccc3o2)c1 ZINC000554191658 341446542 /nfs/dbraw/zinc/44/65/42/341446542.db2.gz LSRAFANHIIGYGA-CQSZACIVSA-N 0 0 310.397 5.036 20 0 DKADRN FC(F)(F)CCc1cccc(N[C@@H]2CCc3ccccc32)c1 ZINC000554268407 341448144 /nfs/dbraw/zinc/44/81/44/341448144.db2.gz MYYFMOSYNIJZAS-QGZVFWFLSA-N 0 0 305.343 5.281 20 0 DKADRN Cc1cc(C)c(NC(=O)N2C[C@H](C)C[C@H]2c2ccccc2)c(C)c1 ZINC000554353009 341450877 /nfs/dbraw/zinc/45/08/77/341450877.db2.gz XXFANRMTUNVKMB-BEFAXECRSA-N 0 0 322.452 5.227 20 0 DKADRN Cc1cc(C)c(NC(=O)N2C[C@@H](C)C[C@H]2c2ccccc2)c(C)c1 ZINC000554353018 341450880 /nfs/dbraw/zinc/45/08/80/341450880.db2.gz XXFANRMTUNVKMB-KXBFYZLASA-N 0 0 322.452 5.227 20 0 DKADRN CCc1cccc(C)c1NC(=O)N1C[C@H](C)C[C@H]1c1ccccc1 ZINC000554355146 341451015 /nfs/dbraw/zinc/45/10/15/341451015.db2.gz BNNPKMVNUOLKCM-BEFAXECRSA-N 0 0 322.452 5.172 20 0 DKADRN CCc1cccc(C)c1NC(=O)N1C[C@@H](C)C[C@H]1c1ccccc1 ZINC000554355149 341451013 /nfs/dbraw/zinc/45/10/13/341451013.db2.gz BNNPKMVNUOLKCM-KXBFYZLASA-N 0 0 322.452 5.172 20 0 DKADRN CCCC(=O)Nc1cccc(N[C@@H](C)c2cc3ccccc3o2)c1 ZINC000554370571 341451740 /nfs/dbraw/zinc/45/17/40/341451740.db2.gz UYMWAFXOUGMKMZ-AWEZNQCLSA-N 0 0 322.408 5.345 20 0 DKADRN CCCC(=O)Nc1cccc(N[C@H](C)c2cc3ccccc3o2)c1 ZINC000554370572 341451803 /nfs/dbraw/zinc/45/18/03/341451803.db2.gz UYMWAFXOUGMKMZ-CQSZACIVSA-N 0 0 322.408 5.345 20 0 DKADRN C/C=C\c1ccc(N[C@H](C)c2cc3c(C)nn(C)c3s2)cc1 ZINC000554370829 341451815 /nfs/dbraw/zinc/45/18/15/341451815.db2.gz AANYBVKSMQSFQQ-CFHLNLSMSA-N 0 0 311.454 5.149 20 0 DKADRN C/C=C/c1ccc(N[C@@H](C)c2cc3c(C)nn(C)c3s2)cc1 ZINC000554370830 341451821 /nfs/dbraw/zinc/45/18/21/341451821.db2.gz AANYBVKSMQSFQQ-GFUIURDCSA-N 0 0 311.454 5.149 20 0 DKADRN C/C=C/c1ccc(N[C@H](C)c2cc3c(C)nn(C)c3s2)cc1 ZINC000554370832 341451738 /nfs/dbraw/zinc/45/17/38/341451738.db2.gz AANYBVKSMQSFQQ-URWSZGRFSA-N 0 0 311.454 5.149 20 0 DKADRN C/C=C/c1ccc(N[C@@H](C)c2nc(C(F)(F)F)cs2)cc1 ZINC000554374232 341452243 /nfs/dbraw/zinc/45/22/43/341452243.db2.gz RMSGZBGEGUTGQI-FSIBCCDJSA-N 0 0 312.360 5.368 20 0 DKADRN C/C=C\c1ccc(N[C@H](C)c2nc(C(F)(F)F)cs2)cc1 ZINC000554374240 341452250 /nfs/dbraw/zinc/45/22/50/341452250.db2.gz RMSGZBGEGUTGQI-UMBAGQNISA-N 0 0 312.360 5.368 20 0 DKADRN CC[C@@H](C)Sc1ccc(N[C@@H](C)c2ccncc2)c(C)c1 ZINC000554386656 341452932 /nfs/dbraw/zinc/45/29/32/341452932.db2.gz NIISLNVPQHQOSD-CABCVRRESA-N 0 0 300.471 5.454 20 0 DKADRN CC[C@H](C)Sc1ccc(N[C@@H](C)c2ccncc2)c(C)c1 ZINC000554386657 341452871 /nfs/dbraw/zinc/45/28/71/341452871.db2.gz NIISLNVPQHQOSD-GJZGRUSLSA-N 0 0 300.471 5.454 20 0 DKADRN CC[C@H](C)Sc1ccc(N[C@H](C)c2ccncc2)c(C)c1 ZINC000554386659 341452889 /nfs/dbraw/zinc/45/28/89/341452889.db2.gz NIISLNVPQHQOSD-LSDHHAIUSA-N 0 0 300.471 5.454 20 0 DKADRN Cc1nc([C@H](C)Nc2cccc(N3CCCCCC3)c2)cs1 ZINC000554397447 341453367 /nfs/dbraw/zinc/45/33/67/341453367.db2.gz NSWWIFSEBHIQIG-AWEZNQCLSA-N 0 0 315.486 5.005 20 0 DKADRN CC[C@H](C)[C@@H](C)Nc1cccc(C[S@](=O)C2CCCCC2)c1 ZINC000554406438 341453805 /nfs/dbraw/zinc/45/38/05/341453805.db2.gz QNSQLVJXYZCJQI-DMPWYTOCSA-N 0 0 321.530 5.115 20 0 DKADRN CC[C@H](C)[C@H](C)Nc1cccc(C[S@@](=O)C2CCCCC2)c1 ZINC000554406439 341453779 /nfs/dbraw/zinc/45/37/79/341453779.db2.gz QNSQLVJXYZCJQI-PONJGIIJSA-N 0 0 321.530 5.115 20 0 DKADRN CC[C@H](C)[C@@H](C)Nc1cccc(C[S@@](=O)C2CCCCC2)c1 ZINC000554406441 341453806 /nfs/dbraw/zinc/45/38/06/341453806.db2.gz QNSQLVJXYZCJQI-WJONJSRFSA-N 0 0 321.530 5.115 20 0 DKADRN Cc1cccc(COc2cccc(N[C@@H](C)c3nccs3)c2)c1 ZINC000554406549 341453784 /nfs/dbraw/zinc/45/37/84/341453784.db2.gz QLEMAVPBXJQJKS-HNNXBMFYSA-N 0 0 324.449 5.204 20 0 DKADRN C/C=C/c1ccc(NC(=O)N2CCc3cccc(F)c3[C@@H]2C)cc1 ZINC000554498081 341455714 /nfs/dbraw/zinc/45/57/14/341455714.db2.gz XISLRWNXKYRAOJ-KQIUPUNMSA-N 0 0 324.399 5.010 20 0 DKADRN C/C=C\c1ccc(NC(=O)N2CCc3cccc(F)c3[C@@H]2C)cc1 ZINC000554498083 341455635 /nfs/dbraw/zinc/45/56/35/341455635.db2.gz XISLRWNXKYRAOJ-MFBWXBCUSA-N 0 0 324.399 5.010 20 0 DKADRN CSCc1cccc(N[C@@H](C)c2cnn(C3CCCC3)c2)c1 ZINC000554558769 341457937 /nfs/dbraw/zinc/45/79/37/341457937.db2.gz WAPPLGQWSSJEIR-AWEZNQCLSA-N 0 0 315.486 5.034 20 0 DKADRN Cc1cnc(CSCc2sc3ccccc3c2Cl)nc1 ZINC000554705830 341461628 /nfs/dbraw/zinc/46/16/28/341461628.db2.gz CALJWPFYEIDONR-UHFFFAOYSA-N 0 0 320.870 5.087 20 0 DKADRN c1sc(C2CCCCC2)nc1CSCc1cccnc1 ZINC000554710648 341461770 /nfs/dbraw/zinc/46/17/70/341461770.db2.gz UTGSXVZAORIGHW-UHFFFAOYSA-N 0 0 304.484 5.019 20 0 DKADRN CC[C@H](C)c1ccccc1NC(=O)[C@@H](C)SC[C@@H](F)CC ZINC000554715115 341461873 /nfs/dbraw/zinc/46/18/73/341461873.db2.gz IVKLBVDXQLNVQT-MJBXVCDLSA-N 0 0 311.466 5.008 20 0 DKADRN Cc1ccc([C@@H]2CCCCCN2C(=O)CC2(C)CCCC2)o1 ZINC000554720398 341462107 /nfs/dbraw/zinc/46/21/07/341462107.db2.gz QUHACTFIDCUKPW-INIZCTEOSA-N 0 0 303.446 5.002 20 0 DKADRN Cc1ccc(NC(=O)C(C)C)cc1N[C@H]1C[C@@H](C)c2ccccc21 ZINC000554737881 341462741 /nfs/dbraw/zinc/46/27/41/341462741.db2.gz LSTXTGUKAPFEJX-QRWLVFNGSA-N 0 0 322.452 5.250 20 0 DKADRN Cc1ccc(NC(=O)C(C)C)cc1N[C@H]1C[C@H](C)c2ccccc21 ZINC000554737882 341462684 /nfs/dbraw/zinc/46/26/84/341462684.db2.gz LSTXTGUKAPFEJX-YWZLYKJASA-N 0 0 322.452 5.250 20 0 DKADRN CCC(CC)N(CC)C(=O)Nc1ccc(-c2ccco2)cc1F ZINC000554759477 341463304 /nfs/dbraw/zinc/46/33/04/341463304.db2.gz NQDZEEMUERQLOH-UHFFFAOYSA-N 0 0 318.392 5.128 20 0 DKADRN CCC1(C(=O)Nc2cc(C(F)F)ccc2Cl)CCCC1 ZINC000554779669 341463604 /nfs/dbraw/zinc/46/36/04/341463604.db2.gz LDYLYQYDQZNCCH-UHFFFAOYSA-N 0 0 301.764 5.187 20 0 DKADRN Fc1ccc2c(c1)[C@@H](Nc1ccc(Oc3cccnc3)cc1)CC2 ZINC000554779906 341463657 /nfs/dbraw/zinc/46/36/57/341463657.db2.gz GQJDYICBODLJLU-FQEVSTJZSA-N 0 0 320.367 5.112 20 0 DKADRN C[C@H](CC(C)(C)C)C(=O)Nc1cc(C(F)F)ccc1Cl ZINC000554780473 341463622 /nfs/dbraw/zinc/46/36/22/341463622.db2.gz YKSBXPPUYILPCP-SECBINFHSA-N 0 0 303.780 5.288 20 0 DKADRN C[C@@H](CC(C)(C)C)C(=O)Nc1cc(C(F)F)ccc1Cl ZINC000554780475 341463514 /nfs/dbraw/zinc/46/35/14/341463514.db2.gz YKSBXPPUYILPCP-VIFPVBQESA-N 0 0 303.780 5.288 20 0 DKADRN CC(C)c1ccc(-c2noc([C@H](C)OCc3ccccc3)n2)cc1 ZINC000554786392 341463803 /nfs/dbraw/zinc/46/38/03/341463803.db2.gz HORSHQZXUVXETJ-HNNXBMFYSA-N 0 0 322.408 5.138 20 0 DKADRN C[C@H](Oc1ccc2ccccc2c1)c1nc(C2CCCC2)no1 ZINC000554793408 341464209 /nfs/dbraw/zinc/46/42/09/341464209.db2.gz YHQQBNFELZYKRN-ZDUSSCGKSA-N 0 0 308.381 5.020 20 0 DKADRN CC(C)c1scnc1NC(=O)[C@H](C)c1ccc2ccccc2c1 ZINC000554808106 341464802 /nfs/dbraw/zinc/46/48/02/341464802.db2.gz DJTFLOAXNVCBSC-CYBMUJFWSA-N 0 0 324.449 5.162 20 0 DKADRN CC(C)c1scnc1NC(=O)[C@@H](C)c1ccc2ccccc2c1 ZINC000554808109 341464781 /nfs/dbraw/zinc/46/47/81/341464781.db2.gz DJTFLOAXNVCBSC-ZDUSSCGKSA-N 0 0 324.449 5.162 20 0 DKADRN CC1=C(c2ccco2)CN(C(=O)Nc2ccc(C(C)C)cc2)CC1 ZINC000554835717 341465779 /nfs/dbraw/zinc/46/57/79/341465779.db2.gz WPDIAFQEELLREF-UHFFFAOYSA-N 0 0 324.424 5.114 20 0 DKADRN C[C@@H](Sc1ccccn1)c1nc(C2CCC(C)(C)CC2)no1 ZINC000554845034 341466324 /nfs/dbraw/zinc/46/63/24/341466324.db2.gz ASBOIGMUEKWDFZ-GFCCVEGCSA-N 0 0 317.458 5.002 20 0 DKADRN C[C@H](Sc1ccccn1)c1nc(C2CCC(C)(C)CC2)no1 ZINC000554845038 341466260 /nfs/dbraw/zinc/46/62/60/341466260.db2.gz ASBOIGMUEKWDFZ-LBPRGKRZSA-N 0 0 317.458 5.002 20 0 DKADRN CSc1ccc(C)c(NC(=O)N(C)[C@H](C)C2CCCCC2)c1 ZINC000554868622 341467494 /nfs/dbraw/zinc/46/74/94/341467494.db2.gz IPSBTMXPQJLJEV-CQSZACIVSA-N 0 0 320.502 5.149 20 0 DKADRN Cc1ccc([C@H](C)N(C)C(=O)Nc2c(F)cccc2Cl)cc1 ZINC000554869321 341467384 /nfs/dbraw/zinc/46/73/84/341467384.db2.gz PMZNSNMPBPHNCL-LBPRGKRZSA-N 0 0 320.795 5.012 20 0 DKADRN Cc1cccc(NC(=O)c2cc(Cl)c(F)cc2Cl)c1C ZINC000554934099 341469780 /nfs/dbraw/zinc/46/97/80/341469780.db2.gz UBTHJTSEFSMJLP-UHFFFAOYSA-N 0 0 312.171 5.002 20 0 DKADRN CSc1ccc(NCc2cscc2C(F)(F)F)cc1 ZINC000554977228 341471084 /nfs/dbraw/zinc/47/10/84/341471084.db2.gz LYMDLUJQRZZGTC-UHFFFAOYSA-N 0 0 303.374 5.101 20 0 DKADRN CCCC[C@H](C)N(C)C(=O)Nc1cc(C(F)F)ccc1Cl ZINC000554988501 341471871 /nfs/dbraw/zinc/47/18/71/341471871.db2.gz LZNZQISZBZCDDC-JTQLQIEISA-N 0 0 318.795 5.320 20 0 DKADRN CCSCc1cccc(N[C@H](C)c2nccc3ccccc32)c1 ZINC000554998543 341472203 /nfs/dbraw/zinc/47/22/03/341472203.db2.gz PZVINGWGYZIFNT-OAHLLOKOSA-N 0 0 322.477 5.661 20 0 DKADRN Cc1ccc(C)c(NC(=O)Nc2ccc(-c3ccccn3)cc2)c1 ZINC000555012686 341472966 /nfs/dbraw/zinc/47/29/66/341472966.db2.gz CNJHXPYMJYYJDN-UHFFFAOYSA-N 0 0 317.392 5.009 20 0 DKADRN Cc1cccc([C@H](NCc2sccc2Cl)C(F)(F)F)c1 ZINC000555051165 341473406 /nfs/dbraw/zinc/47/34/06/341473406.db2.gz BUMFUUHAALBGBD-ZDUSSCGKSA-N 0 0 319.779 5.103 20 0 DKADRN C[C@@H](Sc1cc(F)ccc1F)c1ncc(-c2ccccc2)o1 ZINC000555071586 341474288 /nfs/dbraw/zinc/47/42/88/341474288.db2.gz TYSWKFFYFFXCAL-LLVKDONJSA-N 0 0 317.360 5.473 20 0 DKADRN Cc1nc(C(C)C)sc1[C@@H](C)N(C)C(=O)C1(C)CCCCC1 ZINC000555344473 341480647 /nfs/dbraw/zinc/48/06/47/341480647.db2.gz DMDZNAMNOZUHBK-CQSZACIVSA-N 0 0 322.518 5.065 20 0 DKADRN Clc1cccc(Cl)c1CN[C@H](c1cccnc1)C1CCC1 ZINC000555418025 518194611 /nfs/dbraw/zinc/19/46/11/518194611.db2.gz CWKMWJUJWNCIGJ-KRWDZBQOSA-N 0 0 321.251 5.019 20 0 DKADRN Clc1cccc(Cl)c1CN[C@@H](c1cccnc1)C1CCC1 ZINC000555418026 341482178 /nfs/dbraw/zinc/48/21/78/341482178.db2.gz CWKMWJUJWNCIGJ-QGZVFWFLSA-N 0 0 321.251 5.019 20 0 DKADRN C[C@H](Nc1ccccc1NC(=O)[C@@H]1CC=CCC1)c1ccccc1 ZINC000555525408 341484124 /nfs/dbraw/zinc/48/41/24/341484124.db2.gz WYHSGSRTTOLEFF-FUHWJXTLSA-N 0 0 320.436 5.155 20 0 DKADRN C[C@@H](Nc1ccccc1NC(=O)C[C@H]1C=CCC1)c1ccccc1 ZINC000555526292 341484263 /nfs/dbraw/zinc/48/42/63/341484263.db2.gz YJZFNCYEYLUFPR-SJORKVTESA-N 0 0 320.436 5.155 20 0 DKADRN CCC[C@@H](C)C(=O)Nc1ccccc1N[C@H](C)c1ccccc1 ZINC000555526309 341484211 /nfs/dbraw/zinc/48/42/11/341484211.db2.gz YZFDWRDXGUBVBC-HZPDHXFCSA-N 0 0 310.441 5.234 20 0 DKADRN CCC[C@H](C)C(=O)Nc1ccccc1N[C@H](C)c1ccccc1 ZINC000555526310 341484196 /nfs/dbraw/zinc/48/41/96/341484196.db2.gz YZFDWRDXGUBVBC-JKSUJKDBSA-N 0 0 310.441 5.234 20 0 DKADRN Cc1nocc1CNc1cccc(CSCc2ccccc2)c1 ZINC000555563455 341485407 /nfs/dbraw/zinc/48/54/07/341485407.db2.gz BWLPAQFDNUKYPN-UHFFFAOYSA-N 0 0 324.449 5.029 20 0 DKADRN c1c2ccccc2sc1CNc1ccc([C@H]2CCOC2)cc1 ZINC000555627346 341487583 /nfs/dbraw/zinc/48/75/83/341487583.db2.gz GCTIHOCNNYARRR-INIZCTEOSA-N 0 0 309.434 5.017 20 0 DKADRN c1sc2ccccc2c1CNc1ccc([C@H]2CCOC2)cc1 ZINC000555628940 341487677 /nfs/dbraw/zinc/48/76/77/341487677.db2.gz SRGDHUMQSMKVHJ-HNNXBMFYSA-N 0 0 309.434 5.017 20 0 DKADRN CC[C@@H](C)Sc1ccc(NC(=O)[C@H](C)C(C)(F)F)c(C)c1 ZINC000555635168 341487741 /nfs/dbraw/zinc/48/77/41/341487741.db2.gz QZHRKCYSPYZIJS-NEPJUHHUSA-N 0 0 315.429 5.115 20 0 DKADRN CC[C@H](C)Sc1ccc(NC(=O)[C@H](C)C(C)(F)F)c(C)c1 ZINC000555635170 341487692 /nfs/dbraw/zinc/48/76/92/341487692.db2.gz QZHRKCYSPYZIJS-RYUDHWBXSA-N 0 0 315.429 5.115 20 0 DKADRN CC1(CC(=O)N(c2nc3ccccc3s2)c2ccccc2)CC1 ZINC000555642013 341487856 /nfs/dbraw/zinc/48/78/56/341487856.db2.gz FATPWEZHOAXBTF-UHFFFAOYSA-N 0 0 322.433 5.151 20 0 DKADRN CC(C)c1ccoc1C(=O)Nc1cccc(-c2cccs2)c1 ZINC000555797993 341490378 /nfs/dbraw/zinc/49/03/78/341490378.db2.gz NLNJJVAAGAZNFG-UHFFFAOYSA-N 0 0 311.406 5.384 20 0 DKADRN CSc1cccc(NC(=O)N(C)c2cccc3ccccc32)c1 ZINC000555842062 341490683 /nfs/dbraw/zinc/49/06/83/341490683.db2.gz DVRDEKFUBPWYRN-UHFFFAOYSA-N 0 0 322.433 5.230 20 0 DKADRN CC1(C)CC(CC(=O)N2CCCC[C@@H]2c2cc3ccccc3[nH]2)C1 ZINC000555958848 341491997 /nfs/dbraw/zinc/49/19/97/341491997.db2.gz OZFMQHXBJARMPB-LJQANCHMSA-N 0 0 324.468 5.048 20 0 DKADRN Cc1nc(CNc2ccc3oc4ccccc4c3c2)sc1C ZINC000556056355 341492930 /nfs/dbraw/zinc/49/29/30/341492930.db2.gz LYXQGAVEJOSMLY-UHFFFAOYSA-N 0 0 308.406 5.271 20 0 DKADRN CC(C)C(=O)Nc1ccc(N[C@@H](C)c2cccc(C3CC3)c2)cc1 ZINC000556142657 341495481 /nfs/dbraw/zinc/49/54/81/341495481.db2.gz QAPHIGVMWRZDSQ-HNNXBMFYSA-N 0 0 322.452 5.332 20 0 DKADRN Cc1cc([C@@H](C)N[C@H](c2ccc(Cl)cc2)C2CCCC2)no1 ZINC000556232393 341498265 /nfs/dbraw/zinc/49/82/65/341498265.db2.gz FDRGLTPUCDNZIN-ACJLOTCBSA-N 0 0 318.848 5.219 20 0 DKADRN Cc1cc([C@@H](C)N[C@@H](c2ccc(Cl)cc2)C2CCCC2)no1 ZINC000556232402 341498315 /nfs/dbraw/zinc/49/83/15/341498315.db2.gz FDRGLTPUCDNZIN-FZKQIMNGSA-N 0 0 318.848 5.219 20 0 DKADRN Cc1cc([C@@H](C)N[C@H](c2ccc(C(C)C)cc2)C(C)C)no1 ZINC000556233561 332267161 /nfs/dbraw/zinc/26/71/61/332267161.db2.gz JQAPPXIUFNJBLN-BEFAXECRSA-N 0 0 300.446 5.154 20 0 DKADRN Cc1cc([C@@H](C)N[C@@H](c2ccc(C(C)C)cc2)C(C)C)no1 ZINC000556233562 332267238 /nfs/dbraw/zinc/26/72/38/332267238.db2.gz 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CCCC(CCC)SCc1nc2cc(Cl)ccc2c(=O)[nH]1 ZINC000558218364 331884491 /nfs/dbraw/zinc/88/44/91/331884491.db2.gz VQJFYFSZHXSNCT-UHFFFAOYSA-N 0 0 324.877 5.191 20 0 DKADRN CC(C)c1cccc(C(C)C)c1NC(=O)NCCC1(F)CCC1 ZINC000558229341 331885341 /nfs/dbraw/zinc/88/53/41/331885341.db2.gz XPPRPIODACYZIG-UHFFFAOYSA-N 0 0 320.452 5.337 20 0 DKADRN CC(C)SCCNC(=O)Nc1c(C(C)C)cccc1C(C)C ZINC000558232284 331886267 /nfs/dbraw/zinc/88/62/67/331886267.db2.gz SDNVIEPLOPTABO-UHFFFAOYSA-N 0 0 322.518 5.197 20 0 DKADRN CN(C(=O)Nc1ccc(C(C)(C)C)cc1)C1CCC(F)(F)CC1 ZINC000558244304 331887075 /nfs/dbraw/zinc/88/70/75/331887075.db2.gz UMZZUPMZYJIBBN-UHFFFAOYSA-N 0 0 324.415 5.026 20 0 DKADRN Cc1ncc(-c2ccc(N[C@H](C)c3cc4ccccc4o3)cc2)o1 ZINC000558250209 331887589 /nfs/dbraw/zinc/88/75/89/331887589.db2.gz XJMAQVADRHPEIB-CYBMUJFWSA-N 0 0 318.376 5.569 20 0 DKADRN Cc1ncc(-c2ccc(N[C@@H](C)c3cc4ccccc4o3)cc2)o1 ZINC000558250217 331887664 /nfs/dbraw/zinc/88/76/64/331887664.db2.gz XJMAQVADRHPEIB-ZDUSSCGKSA-N 0 0 318.376 5.569 20 0 DKADRN O=C(Nc1cccc(-c2cccs2)c1)c1cc[nH]c1C1CCC1 ZINC000558251090 331887742 /nfs/dbraw/zinc/88/77/42/331887742.db2.gz SGTYKXHEAGAWPN-UHFFFAOYSA-N 0 0 322.433 5.263 20 0 DKADRN C[C@@H]1CCC[C@@H]1CC(=O)Nc1cc(C(F)F)ccc1Cl ZINC000558252854 331888356 /nfs/dbraw/zinc/88/83/56/331888356.db2.gz LIGFJGYHOUIGMD-NXEZZACHSA-N 0 0 301.764 5.042 20 0 DKADRN C[C@H]1CCC[C@H]1CC(=O)Nc1cc(C(F)F)ccc1Cl ZINC000558252855 331888344 /nfs/dbraw/zinc/88/83/44/331888344.db2.gz LIGFJGYHOUIGMD-UWVGGRQHSA-N 0 0 301.764 5.042 20 0 DKADRN C[C@H]1CCC[C@@H]1CC(=O)Nc1cc(C(F)F)ccc1Cl ZINC000558252857 331888454 /nfs/dbraw/zinc/88/84/54/331888454.db2.gz LIGFJGYHOUIGMD-VHSXEESVSA-N 0 0 301.764 5.042 20 0 DKADRN C[C@@H]1CCC[C@H]1CC(=O)Nc1cc(C(F)F)ccc1Cl ZINC000558252859 331888394 /nfs/dbraw/zinc/88/83/94/331888394.db2.gz LIGFJGYHOUIGMD-ZJUUUORDSA-N 0 0 301.764 5.042 20 0 DKADRN C[C@H]1CC[C@H](CC(=O)Nc2cc(C(F)F)ccc2Cl)C1 ZINC000558253317 331888386 /nfs/dbraw/zinc/88/83/86/331888386.db2.gz OFMQVSYSSVLPHY-UWVGGRQHSA-N 0 0 301.764 5.042 20 0 DKADRN C/C=C/c1ccc(N[C@@H](C)c2ccc3c(c2)C(C)(C)C(=O)N3)cc1 ZINC000558256938 331889584 /nfs/dbraw/zinc/88/95/84/331889584.db2.gz JFBSCGLYFUKXFY-GJBLVYBDSA-N 0 0 320.436 5.123 20 0 DKADRN O=C(Nc1cccc(F)c1Cl)c1cc2sccc2s1 ZINC000558262719 331890328 /nfs/dbraw/zinc/89/03/28/331890328.db2.gz GJCZDUSZRYUKGL-UHFFFAOYSA-N 0 0 311.790 5.008 20 0 DKADRN CC(C)Sc1ccc(C(=O)Nc2cccc(F)c2Cl)cc1 ZINC000558263019 331890413 /nfs/dbraw/zinc/89/04/13/331890413.db2.gz AISTYPDAOIHEAK-UHFFFAOYSA-N 0 0 323.820 5.232 20 0 DKADRN CCSc1ccc(Cl)cc1N[C@H](C)c1csc(C)n1 ZINC000558275903 331891715 /nfs/dbraw/zinc/89/17/15/331891715.db2.gz SDYRFLQXLXJIQF-SECBINFHSA-N 0 0 312.891 5.390 20 0 DKADRN CC(C)c1ccc(-c2nc(CCC(F)(F)F)no2)cc1Cl ZINC000558296632 331894360 /nfs/dbraw/zinc/89/43/60/331894360.db2.gz UEDILCFPYFSGQL-UHFFFAOYSA-N 0 0 318.726 5.008 20 0 DKADRN CC(C)c1ccccc1N(C)C(=O)c1cccc(C(F)F)c1 ZINC000558339471 331897527 /nfs/dbraw/zinc/89/75/27/331897527.db2.gz GSATWKYCIGAKLN-UHFFFAOYSA-N 0 0 303.352 5.024 20 0 DKADRN Cc1oc2ccccc2c1-c1nc([C@H](C)c2cccs2)no1 ZINC000558341600 331898036 /nfs/dbraw/zinc/89/80/36/331898036.db2.gz ACSDJMSHRAOWBV-SNVBAGLBSA-N 0 0 310.378 5.005 20 0 DKADRN C[C@@H](NCc1cc(C(C)(C)C)on1)c1cc2ccccc2s1 ZINC000558459288 331909037 /nfs/dbraw/zinc/90/90/37/331909037.db2.gz CEMGQHNJERHQNQ-GFCCVEGCSA-N 0 0 314.454 5.038 20 0 DKADRN C[C@H](NCc1cc(C(C)(C)C)on1)c1cc2ccccc2s1 ZINC000558459289 331909042 /nfs/dbraw/zinc/90/90/42/331909042.db2.gz CEMGQHNJERHQNQ-LBPRGKRZSA-N 0 0 314.454 5.038 20 0 DKADRN CCCC[C@H](C)N(C)C(=O)Nc1ccc(Cl)cc1Cl ZINC000558475375 331910900 /nfs/dbraw/zinc/91/09/00/331910900.db2.gz GUAWLCVBUMPMLB-JTQLQIEISA-N 0 0 303.233 5.036 20 0 DKADRN Clc1cccc(Cl)c1[C@H](NCc1ccsc1)C1CC1 ZINC000558480437 331911687 /nfs/dbraw/zinc/91/16/87/331911687.db2.gz UCVMGRIMTWQHJM-OAHLLOKOSA-N 0 0 312.265 5.296 20 0 DKADRN CC(C)Oc1ccc(Cl)cc1NCc1csc(C2CC2)n1 ZINC000558493030 331912879 /nfs/dbraw/zinc/91/28/79/331912879.db2.gz IVORELBPOHBGQC-UHFFFAOYSA-N 0 0 322.861 5.073 20 0 DKADRN COC[C@H](Nc1ccc(CSC)cc1)c1cccc(Cl)c1 ZINC000558505331 331914278 /nfs/dbraw/zinc/91/42/78/331914278.db2.gz DVEDRXDULDDZIF-KRWDZBQOSA-N 0 0 321.873 5.003 20 0 DKADRN C[C@@H](Nc1cccc(OC(F)F)c1)c1nccc2ccccc21 ZINC000558505901 331914128 /nfs/dbraw/zinc/91/41/28/331914128.db2.gz REVDVRQEFJGGCH-GFCCVEGCSA-N 0 0 314.335 5.009 20 0 DKADRN C[C@H](Nc1cccc(OC(F)F)c1)c1nccc2ccccc21 ZINC000558505903 331914195 /nfs/dbraw/zinc/91/41/95/331914195.db2.gz REVDVRQEFJGGCH-LBPRGKRZSA-N 0 0 314.335 5.009 20 0 DKADRN CO[C@H](C)c1cccc(N[C@H](C)c2nccc3ccccc32)c1 ZINC000558506191 331914386 /nfs/dbraw/zinc/91/43/86/331914386.db2.gz VNZLLOBOOXKZBV-HUUCEWRRSA-N 0 0 306.409 5.115 20 0 DKADRN CO[C@H](C)c1cccc(N[C@@H](C)c2nccc3ccccc32)c1 ZINC000558506192 331914548 /nfs/dbraw/zinc/91/45/48/331914548.db2.gz VNZLLOBOOXKZBV-LSDHHAIUSA-N 0 0 306.409 5.115 20 0 DKADRN CC[C@H](Nc1ccccc1)C(=O)Nc1ccccc1CCC(C)C ZINC000558539372 331919913 /nfs/dbraw/zinc/91/99/13/331919913.db2.gz UELDNXJYWTVBHP-IBGZPJMESA-N 0 0 324.468 5.104 20 0 DKADRN Cc1ncsc1CSCc1csc(-c2ccsc2)n1 ZINC000558596744 331926984 /nfs/dbraw/zinc/92/69/84/331926984.db2.gz KJQVZTFZLAFOJM-UHFFFAOYSA-N 0 0 324.521 5.070 20 0 DKADRN Cc1ncsc1CSCc1c(Cl)ccc2cccnc21 ZINC000558597037 331926829 /nfs/dbraw/zinc/92/68/29/331926829.db2.gz VSMWHIBVFOXSBP-UHFFFAOYSA-N 0 0 320.870 5.087 20 0 DKADRN Clc1cccc(-c2nc([C@@H]3CCCCS3)no2)c1Cl ZINC000558599392 331927022 /nfs/dbraw/zinc/92/70/22/331927022.db2.gz OAFCCGVBCPRSLK-JTQLQIEISA-N 0 0 315.225 5.002 20 0 DKADRN CCc1cnc(CN[C@H](c2ccc(C(C)(C)C)cc2)C(C)C)o1 ZINC000558744151 331940239 /nfs/dbraw/zinc/94/02/39/331940239.db2.gz KWVRLJCJNDATCC-IBGZPJMESA-N 0 0 314.473 5.021 20 0 DKADRN CCc1cnc(CN[C@@H](c2ccc(C(C)(C)C)cc2)C(C)C)o1 ZINC000558744153 331940259 /nfs/dbraw/zinc/94/02/59/331940259.db2.gz KWVRLJCJNDATCC-LJQANCHMSA-N 0 0 314.473 5.021 20 0 DKADRN CSc1cccc(C)c1NC(=O)N(C)[C@@H](C)C1CCCCC1 ZINC000558782002 331942478 /nfs/dbraw/zinc/94/24/78/331942478.db2.gz DZODFQJGNBJCPU-AWEZNQCLSA-N 0 0 320.502 5.149 20 0 DKADRN CSc1cccc(C)c1NC(=O)N(C)[C@H](C)C1CCCCC1 ZINC000558782005 331942493 /nfs/dbraw/zinc/94/24/93/331942493.db2.gz DZODFQJGNBJCPU-CQSZACIVSA-N 0 0 320.502 5.149 20 0 DKADRN O=C(Nc1ccc(F)cc1Cl)c1cc(F)c2ccccc2c1 ZINC000558783703 331942822 /nfs/dbraw/zinc/94/28/22/331942822.db2.gz BBODUMZCTFEBCH-UHFFFAOYSA-N 0 0 317.722 5.024 20 0 DKADRN Cc1nc(C(C)C)ccc1CSc1ccc(N)cc1Cl ZINC000558845455 331950134 /nfs/dbraw/zinc/95/01/34/331950134.db2.gz WEWVPWDLIRCABS-UHFFFAOYSA-N 0 0 306.862 5.041 20 0 DKADRN FC(F)(F)C[C@H](NCc1sccc1Cl)c1ccccc1 ZINC000558850620 331951839 /nfs/dbraw/zinc/95/18/39/331951839.db2.gz IZYWQMQFQMRPDW-LBPRGKRZSA-N 0 0 319.779 5.185 20 0 DKADRN Cc1oc(-c2ccsc2)nc1CSc1ccccc1C ZINC000559013771 331966049 /nfs/dbraw/zinc/96/60/49/331966049.db2.gz XEIWBSZVWWXJLP-UHFFFAOYSA-N 0 0 301.436 5.312 20 0 DKADRN CCCCN(C(=O)Nc1cccc(SC)c1)C1CCCCC1 ZINC000559074487 331971530 /nfs/dbraw/zinc/97/15/30/331971530.db2.gz GXDUDENFDHCVBU-UHFFFAOYSA-N 0 0 320.502 5.375 20 0 DKADRN Cc1cc(C)c(NC(=O)c2cc(F)c3ccccc3c2)c(C)c1 ZINC000559145074 331981671 /nfs/dbraw/zinc/98/16/71/331981671.db2.gz BUGBPWYPFXPZSW-UHFFFAOYSA-N 0 0 307.368 5.156 20 0 DKADRN CCCN(C(=O)[C@@H](C)C(C)(F)F)[C@H](C)c1cc2ccccc2o1 ZINC000559157912 331983626 /nfs/dbraw/zinc/98/36/26/331983626.db2.gz SNYVWMCVEAMILG-CHWSQXEVSA-N 0 0 323.383 5.024 20 0 DKADRN CO[C@H](CS[C@@H](C)c1ncc(C(C)(C)C)o1)c1ccccc1 ZINC000559159768 331984160 /nfs/dbraw/zinc/98/41/60/331984160.db2.gz FABUVZYDFWSRLW-DZGCQCFKSA-N 0 0 319.470 5.154 20 0 DKADRN CO[C@@H](CS[C@H](C)c1ncc(C(C)(C)C)o1)c1ccccc1 ZINC000559159774 331984181 /nfs/dbraw/zinc/98/41/81/331984181.db2.gz FABUVZYDFWSRLW-HIFRSBDPSA-N 0 0 319.470 5.154 20 0 DKADRN CC(C)(CC(=O)N1CCC[C@H]1c1cccc2ccccc21)C1CC1 ZINC000559183228 331985656 /nfs/dbraw/zinc/98/56/56/331985656.db2.gz AFCCLPIRYPKTRY-FQEVSTJZSA-N 0 0 321.464 5.330 20 0 DKADRN CC(C)(CC(=O)N1CCC[C@@H]1c1cccc2ccccc21)C1CC1 ZINC000559183229 331985576 /nfs/dbraw/zinc/98/55/76/331985576.db2.gz AFCCLPIRYPKTRY-HXUWFJFHSA-N 0 0 321.464 5.330 20 0 DKADRN CC(C)c1ccc(NCc2conc2Cc2ccccc2)cc1 ZINC000559244329 332001053 /nfs/dbraw/zinc/00/10/53/332001053.db2.gz NMDMAVVUJOECAF-UHFFFAOYSA-N 0 0 306.409 5.001 20 0 DKADRN CC(C)CCC(=O)Nc1ccccc1N[C@@H](C)c1ccccc1 ZINC000559251001 332005486 /nfs/dbraw/zinc/00/54/86/332005486.db2.gz ZYAUKVWHMLDZMZ-INIZCTEOSA-N 0 0 310.441 5.234 20 0 DKADRN CC(C)CCC(=O)Nc1ccccc1N[C@H](C)c1ccccc1 ZINC000559251003 332005508 /nfs/dbraw/zinc/00/55/08/332005508.db2.gz ZYAUKVWHMLDZMZ-MRXNPFEDSA-N 0 0 310.441 5.234 20 0 DKADRN C[C@H](Nc1ccccc1NC(=O)CCC1CCC1)c1ccccc1 ZINC000559251188 332005526 /nfs/dbraw/zinc/00/55/26/332005526.db2.gz GWBVMSGSJNWFJP-INIZCTEOSA-N 0 0 322.452 5.379 20 0 DKADRN C[C@@H](Nc1ccccc1NC(=O)CCC1CCC1)c1ccccc1 ZINC000559251190 332005666 /nfs/dbraw/zinc/00/56/66/332005666.db2.gz GWBVMSGSJNWFJP-MRXNPFEDSA-N 0 0 322.452 5.379 20 0 DKADRN CSCc1cnc(CNc2ccccc2SC(C)C)s1 ZINC000559282487 332014908 /nfs/dbraw/zinc/01/49/08/332014908.db2.gz WKHYYQZGTFJVGQ-UHFFFAOYSA-N 0 0 324.540 5.119 20 0 DKADRN Cc1cc(NCc2conc2Cc2ccccc2)ccc1C1CC1 ZINC000559294606 332018297 /nfs/dbraw/zinc/01/82/97/332018297.db2.gz RRWKIHXFHDOCJV-UHFFFAOYSA-N 0 0 318.420 5.063 20 0 DKADRN C[C@H]1CN(C(=O)c2sccc2-c2ccccc2)c2ccccc21 ZINC000559301629 332020956 /nfs/dbraw/zinc/02/09/56/332020956.db2.gz FHOGAAAXLMXOHD-AWEZNQCLSA-N 0 0 319.429 5.179 20 0 DKADRN Cc1cc(Cl)cc(CNc2cccc(-c3ncco3)c2C)c1 ZINC000559303469 332021429 /nfs/dbraw/zinc/02/14/29/332021429.db2.gz VMQYNRYCYITDIY-UHFFFAOYSA-N 0 0 312.800 5.224 20 0 DKADRN CCSc1cccc(C[NH2+]Cc2ccc(C(C)(F)F)cc2)c1 ZINC000559310053 332022718 /nfs/dbraw/zinc/02/27/18/332022718.db2.gz IEXPRKSACMWBGH-UHFFFAOYSA-N 0 0 321.436 5.200 20 0 DKADRN CC[C@@H](C)Oc1cccc(NCc2cnc(C(C)C)s2)c1 ZINC000559312096 332022901 /nfs/dbraw/zinc/02/29/01/332022901.db2.gz CLNVXLAVXFGVCP-CYBMUJFWSA-N 0 0 304.459 5.056 20 0 DKADRN CC[C@H](C)Oc1cccc(NCc2cnc(C(C)C)s2)c1 ZINC000559312098 332022852 /nfs/dbraw/zinc/02/28/52/332022852.db2.gz CLNVXLAVXFGVCP-ZDUSSCGKSA-N 0 0 304.459 5.056 20 0 DKADRN CC[C@H](C)Oc1cccc(NCc2coc(-c3ccccc3)n2)c1 ZINC000559313129 332023892 /nfs/dbraw/zinc/02/38/92/332023892.db2.gz RCNZGMDKTYSHOL-HNNXBMFYSA-N 0 0 322.408 5.131 20 0 DKADRN CC[C@@H](C)Oc1cccc(NCc2coc(-c3ccccc3)n2)c1 ZINC000559313131 332023986 /nfs/dbraw/zinc/02/39/86/332023986.db2.gz RCNZGMDKTYSHOL-OAHLLOKOSA-N 0 0 322.408 5.131 20 0 DKADRN C[C@H](NCc1cnc(C2CCCC2)s1)c1ccccc1Cl ZINC000559339314 332029983 /nfs/dbraw/zinc/02/99/83/332029983.db2.gz INOPZYUSNDVWEU-LBPRGKRZSA-N 0 0 320.889 5.305 20 0 DKADRN Clc1ccc(Cl)c(CNc2ccc([C@@H]3CCOC3)cc2)c1 ZINC000559340805 332029691 /nfs/dbraw/zinc/02/96/91/332029691.db2.gz FXBCKVXREDMRFI-CYBMUJFWSA-N 0 0 322.235 5.109 20 0 DKADRN Clc1ccc(Cl)c(CNc2ccc([C@H]3CCOC3)cc2)c1 ZINC000559340806 332029680 /nfs/dbraw/zinc/02/96/80/332029680.db2.gz FXBCKVXREDMRFI-ZDUSSCGKSA-N 0 0 322.235 5.109 20 0 DKADRN Clc1cccc(Cl)c1CNc1ccc([C@@H]2CCOC2)cc1 ZINC000559344230 332032133 /nfs/dbraw/zinc/03/21/33/332032133.db2.gz DNAYFXDBRGHCNK-CYBMUJFWSA-N 0 0 322.235 5.109 20 0 DKADRN Clc1cccc(Cl)c1CNc1ccc([C@H]2CCOC2)cc1 ZINC000559344231 332032245 /nfs/dbraw/zinc/03/22/45/332032245.db2.gz DNAYFXDBRGHCNK-ZDUSSCGKSA-N 0 0 322.235 5.109 20 0 DKADRN Cc1cc(-c2ccccc2)ccc1NC(=O)N1CC(C)=C[C@H](C)C1 ZINC000559368103 332135233 /nfs/dbraw/zinc/13/52/33/332135233.db2.gz WAVGHSAEDYEKFB-HNNXBMFYSA-N 0 0 320.436 5.092 20 0 DKADRN Cc1cc(-c2ccccc2)ccc1NC(=O)N1CC(C)=C[C@@H](C)C1 ZINC000559368106 332135216 /nfs/dbraw/zinc/13/52/16/332135216.db2.gz WAVGHSAEDYEKFB-OAHLLOKOSA-N 0 0 320.436 5.092 20 0 DKADRN CCC(C)(C)CCSCC(=O)Nc1c(C)cccc1Cl ZINC000559463271 332261886 /nfs/dbraw/zinc/26/18/86/332261886.db2.gz IAYWBNJNCUCIAJ-UHFFFAOYSA-N 0 0 313.894 5.146 20 0 DKADRN CCCOc1ccc(NC(=O)c2occc2C(C)C)cc1Cl ZINC000559494592 332264939 /nfs/dbraw/zinc/26/49/39/332264939.db2.gz XFOGCMPGJSHHKD-UHFFFAOYSA-N 0 0 321.804 5.098 20 0 DKADRN CC[C@@H](C)Sc1ccc(NC(=O)c2c(C)coc2C)c(C)c1 ZINC000559497274 332265315 /nfs/dbraw/zinc/26/53/15/332265315.db2.gz DHRCURCTASFPOD-CYBMUJFWSA-N 0 0 317.454 5.348 20 0 DKADRN CC[C@H](C)Sc1ccc(NC(=O)c2c(C)coc2C)c(C)c1 ZINC000559497275 332265231 /nfs/dbraw/zinc/26/52/31/332265231.db2.gz DHRCURCTASFPOD-ZDUSSCGKSA-N 0 0 317.454 5.348 20 0 DKADRN CCCn1ccc2cc(NC(=O)c3occc3C(C)C)ccc21 ZINC000559500695 332265245 /nfs/dbraw/zinc/26/52/45/332265245.db2.gz DJTKSNIROVUMBT-UHFFFAOYSA-N 0 0 310.397 5.020 20 0 DKADRN CCCCCN(C(=O)NCc1cc2ccccc2s1)C(C)C ZINC000559515253 332267976 /nfs/dbraw/zinc/26/79/76/332267976.db2.gz ODFGAIJXUZVCHO-UHFFFAOYSA-N 0 0 318.486 5.012 20 0 DKADRN Cc1coc(C)c1C(=O)Nc1cccc(Cl)c1SC(C)C ZINC000559552162 332270727 /nfs/dbraw/zinc/27/07/27/332270727.db2.gz QZRNUEVWBQFEGN-UHFFFAOYSA-N 0 0 323.845 5.303 20 0 DKADRN CCSc1ccc([C@@H](C)NC(=O)c2occc2C(C)C)cc1 ZINC000559563476 332271477 /nfs/dbraw/zinc/27/14/77/332271477.db2.gz OBYSDTDZEQGYME-CYBMUJFWSA-N 0 0 317.454 5.006 20 0 DKADRN CCSc1ccc([C@H](C)NC(=O)c2occc2C(C)C)cc1 ZINC000559563477 332271493 /nfs/dbraw/zinc/27/14/93/332271493.db2.gz OBYSDTDZEQGYME-ZDUSSCGKSA-N 0 0 317.454 5.006 20 0 DKADRN Cc1coc(C)c1C(=O)Nc1ccccc1Nc1ccc(F)cc1 ZINC000559621027 332274427 /nfs/dbraw/zinc/27/44/27/332274427.db2.gz WFQTWSDYAVZQQC-UHFFFAOYSA-N 0 0 324.355 5.031 20 0 DKADRN C[C@@H](Sc1ccccc1)c1nnc(-c2ccccc2F)s1 ZINC000559626161 332275144 /nfs/dbraw/zinc/27/51/44/332275144.db2.gz QTSVYUYZJDFMMT-LLVKDONJSA-N 0 0 316.426 5.198 20 0 DKADRN C[C@H](Sc1ccccc1)c1nnc(-c2ccccc2F)s1 ZINC000559626179 332274977 /nfs/dbraw/zinc/27/49/77/332274977.db2.gz QTSVYUYZJDFMMT-NSHDSACASA-N 0 0 316.426 5.198 20 0 DKADRN Cc1nc([C@H](C)N[C@H](C)c2ccc(F)c3ccccc32)cs1 ZINC000559751101 332278996 /nfs/dbraw/zinc/27/89/96/332278996.db2.gz DAMILTNXXFCRLO-NEPJUHHUSA-N 0 0 314.429 5.156 20 0 DKADRN Cc1nc([C@@H](C)N[C@@H](C)c2ccc(F)c3ccccc32)cs1 ZINC000559751103 332279042 /nfs/dbraw/zinc/27/90/42/332279042.db2.gz DAMILTNXXFCRLO-NWDGAFQWSA-N 0 0 314.429 5.156 20 0 DKADRN Cc1nc([C@H](C)N[C@@H](C)c2ccc(F)c3ccccc32)cs1 ZINC000559751105 332279064 /nfs/dbraw/zinc/27/90/64/332279064.db2.gz DAMILTNXXFCRLO-RYUDHWBXSA-N 0 0 314.429 5.156 20 0 DKADRN Cc1nc([C@@H](C)N[C@H](C)c2ccc(F)c3ccccc32)cs1 ZINC000559751107 332279015 /nfs/dbraw/zinc/27/90/15/332279015.db2.gz DAMILTNXXFCRLO-VXGBXAGGSA-N 0 0 314.429 5.156 20 0 DKADRN C[C@@H](NCc1csc(C(C)(C)C)n1)c1cccc(C2CC2)c1 ZINC000559753016 332279322 /nfs/dbraw/zinc/27/93/22/332279322.db2.gz JHWUZYXYNJPEHA-CYBMUJFWSA-N 0 0 314.498 5.169 20 0 DKADRN C[C@H](NCc1csc(C(C)(C)C)n1)c1cccc(C2CC2)c1 ZINC000559753017 332279274 /nfs/dbraw/zinc/27/92/74/332279274.db2.gz JHWUZYXYNJPEHA-ZDUSSCGKSA-N 0 0 314.498 5.169 20 0 DKADRN CC(=O)Nc1cccc(N[C@H](C)c2ccc(F)c3ccccc32)c1 ZINC000559808464 332282962 /nfs/dbraw/zinc/28/29/62/332282962.db2.gz LEVXIYMEFJQAJD-CYBMUJFWSA-N 0 0 322.383 5.110 20 0 DKADRN CC(=O)Nc1cccc(N[C@@H](C)c2ccc(F)c3ccccc32)c1 ZINC000559808467 332283086 /nfs/dbraw/zinc/28/30/86/332283086.db2.gz LEVXIYMEFJQAJD-ZDUSSCGKSA-N 0 0 322.383 5.110 20 0 DKADRN C[C@H](Nc1cccc(NC(=O)C2CC2)c1)c1cccc(C2CC2)c1 ZINC000559814708 332283325 /nfs/dbraw/zinc/28/33/25/332283325.db2.gz IPRMGUSEAJMEOS-AWEZNQCLSA-N 0 0 320.436 5.086 20 0 DKADRN C[C@@H](Nc1cccc(NC(=O)C2CC2)c1)c1cccc(C2CC2)c1 ZINC000559814709 332283355 /nfs/dbraw/zinc/28/33/55/332283355.db2.gz IPRMGUSEAJMEOS-CQSZACIVSA-N 0 0 320.436 5.086 20 0 DKADRN CO[C@@H]1CCOc2c(N[C@H](C)c3cccc(C4CC4)c3)cccc21 ZINC000559842824 332284506 /nfs/dbraw/zinc/28/45/06/332284506.db2.gz JQZRSZMBIBXMGJ-JLTOFOAXSA-N 0 0 323.436 5.207 20 0 DKADRN CO[C@@H]1CCOc2c(N[C@@H](C)c3cccc(C4CC4)c3)cccc21 ZINC000559842825 332284544 /nfs/dbraw/zinc/28/45/44/332284544.db2.gz JQZRSZMBIBXMGJ-VBKZILBWSA-N 0 0 323.436 5.207 20 0 DKADRN CO[C@H]1CCOc2c(N[C@H](C)c3cccc(C4CC4)c3)cccc21 ZINC000559842826 332284616 /nfs/dbraw/zinc/28/46/16/332284616.db2.gz JQZRSZMBIBXMGJ-VLIAUNLRSA-N 0 0 323.436 5.207 20 0 DKADRN CO[C@H]1CCOc2c(N[C@@H](C)c3cccc(C4CC4)c3)cccc21 ZINC000559842827 332284526 /nfs/dbraw/zinc/28/45/26/332284526.db2.gz JQZRSZMBIBXMGJ-XOBRGWDASA-N 0 0 323.436 5.207 20 0 DKADRN C[C@@H](NCc1ccc(C2CCCCC2)cc1)c1nccs1 ZINC000559857661 332285985 /nfs/dbraw/zinc/28/59/85/332285985.db2.gz HTGJTMNYGYCWHU-CQSZACIVSA-N 0 0 300.471 5.042 20 0 DKADRN Cc1nc([C@H](C)NCc2ccc(C3CCCCC3)cc2)cs1 ZINC000559871179 332287425 /nfs/dbraw/zinc/28/74/25/332287425.db2.gz KWFBFWWAGPNQHS-AWEZNQCLSA-N 0 0 314.498 5.350 20 0 DKADRN Cc1nc([C@@H](C)NCc2ccc(C3CCCCC3)cc2)cs1 ZINC000559871181 332287536 /nfs/dbraw/zinc/28/75/36/332287536.db2.gz KWFBFWWAGPNQHS-CQSZACIVSA-N 0 0 314.498 5.350 20 0 DKADRN Cc1cccc(-c2cccc(C[NH2+][C@@H](C)c3ccncc3F)c2)c1 ZINC000559895535 332290733 /nfs/dbraw/zinc/29/07/33/332290733.db2.gz RIOSKKJNXSJRNB-INIZCTEOSA-N 0 0 320.411 5.047 20 0 DKADRN Cc1cccc(-c2cccc(C[NH2+][C@H](C)c3ccncc3F)c2)c1 ZINC000559895542 332290749 /nfs/dbraw/zinc/29/07/49/332290749.db2.gz RIOSKKJNXSJRNB-MRXNPFEDSA-N 0 0 320.411 5.047 20 0 DKADRN Cc1cc([C@H](C)N[C@H](c2ccc(CC(C)C)cc2)C(C)C)no1 ZINC000559896879 332291041 /nfs/dbraw/zinc/29/10/41/332291041.db2.gz YIYWVAMXHLZJHZ-JXFKEZNVSA-N 0 0 314.473 5.229 20 0 DKADRN Cc1cc([C@H](C)N[C@@H](c2ccc(CC(C)C)cc2)C(C)C)no1 ZINC000559896888 332291049 /nfs/dbraw/zinc/29/10/49/332291049.db2.gz YIYWVAMXHLZJHZ-OXJNMPFZSA-N 0 0 314.473 5.229 20 0 DKADRN Cc1cc([C@@H](C)N[C@@H](c2ccc(CC(C)C)cc2)C(C)C)no1 ZINC000559896889 332291087 /nfs/dbraw/zinc/29/10/87/332291087.db2.gz YIYWVAMXHLZJHZ-OXQOHEQNSA-N 0 0 314.473 5.229 20 0 DKADRN Cc1cc([C@@H](C)N[C@H](c2ccc(CC(C)C)cc2)C(C)C)no1 ZINC000559896890 332291121 /nfs/dbraw/zinc/29/11/21/332291121.db2.gz YIYWVAMXHLZJHZ-UZLBHIALSA-N 0 0 314.473 5.229 20 0 DKADRN C[C@H](Nc1ccc([C@H]2CCOC2)cc1)c1cccc(Cl)c1 ZINC000559897741 332291076 /nfs/dbraw/zinc/29/10/76/332291076.db2.gz PJLHTIPWDICEJT-BBRMVZONSA-N 0 0 301.817 5.017 20 0 DKADRN C[C@@H](Nc1ccc([C@H]2CCOC2)cc1)c1cccc(Cl)c1 ZINC000559897742 332291101 /nfs/dbraw/zinc/29/11/01/332291101.db2.gz PJLHTIPWDICEJT-CJNGLKHVSA-N 0 0 301.817 5.017 20 0 DKADRN C[C@@H](Nc1ccc([C@@H]2CCOC2)cc1)c1cccc(Cl)c1 ZINC000559897743 332291108 /nfs/dbraw/zinc/29/11/08/332291108.db2.gz PJLHTIPWDICEJT-CZUORRHYSA-N 0 0 301.817 5.017 20 0 DKADRN C[C@H](Nc1ccc([C@@H]2CCOC2)cc1)c1cccc(Cl)c1 ZINC000559897744 332291080 /nfs/dbraw/zinc/29/10/80/332291080.db2.gz PJLHTIPWDICEJT-XJKSGUPXSA-N 0 0 301.817 5.017 20 0 DKADRN C[C@@H](Nc1ccc([C@@H]2CCOC2)cc1)c1cccc(C2CC2)c1 ZINC000559898272 332291354 /nfs/dbraw/zinc/29/13/54/332291354.db2.gz YENZWPLUEWFDIP-FOIQADDNSA-N 0 0 307.437 5.241 20 0 DKADRN C[C@H](Nc1ccc([C@@H]2CCOC2)cc1)c1cccc(C2CC2)c1 ZINC000559898273 332291377 /nfs/dbraw/zinc/29/13/77/332291377.db2.gz YENZWPLUEWFDIP-MGPUTAFESA-N 0 0 307.437 5.241 20 0 DKADRN C[C@@H](Nc1ccc([C@H]2CCOC2)cc1)c1cccc(C2CC2)c1 ZINC000559898274 332291257 /nfs/dbraw/zinc/29/12/57/332291257.db2.gz YENZWPLUEWFDIP-QRWLVFNGSA-N 0 0 307.437 5.241 20 0 DKADRN C[C@H](Nc1ccc([C@H]2CCOC2)cc1)c1cccc(C2CC2)c1 ZINC000559898275 332291357 /nfs/dbraw/zinc/29/13/57/332291357.db2.gz 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/nfs/dbraw/zinc/29/18/91/332291891.db2.gz UNVSDAVIKMLTIZ-HIFRSBDPSA-N 0 0 301.817 5.017 20 0 DKADRN C[C@@H](Nc1ccc([C@@H]2CCOC2)cc1)c1ccccc1Cl ZINC000559900534 332291768 /nfs/dbraw/zinc/29/17/68/332291768.db2.gz UNVSDAVIKMLTIZ-UKRRQHHQSA-N 0 0 301.817 5.017 20 0 DKADRN C[C@H](Nc1ccc([C@H]2CCOC2)cc1)c1ccccc1Cl ZINC000559900535 332291865 /nfs/dbraw/zinc/29/18/65/332291865.db2.gz UNVSDAVIKMLTIZ-ZFWWWQNUSA-N 0 0 301.817 5.017 20 0 DKADRN Cc1cc([C@@H](C)N[C@H](CC(C)C)c2ccc(Cl)cc2)no1 ZINC000559904237 332292170 /nfs/dbraw/zinc/29/21/70/332292170.db2.gz OXWGCNSKHLZVQH-CXAGYDPISA-N 0 0 306.837 5.074 20 0 DKADRN Cc1cc([C@@H](C)N[C@@H](CC(C)C)c2ccc(Cl)cc2)no1 ZINC000559904238 332292025 /nfs/dbraw/zinc/29/20/25/332292025.db2.gz OXWGCNSKHLZVQH-DYVFJYSZSA-N 0 0 306.837 5.074 20 0 DKADRN Cc1cc([C@H](C)N[C@@H](CC(C)C)c2ccc(Cl)cc2)no1 ZINC000559904240 332292121 /nfs/dbraw/zinc/29/21/21/332292121.db2.gz OXWGCNSKHLZVQH-GUYCJALGSA-N 0 0 306.837 5.074 20 0 DKADRN Cc1cc([C@H](C)N[C@H](CC(C)C)c2ccc(Cl)cc2)no1 ZINC000559904242 332292203 /nfs/dbraw/zinc/29/22/03/332292203.db2.gz OXWGCNSKHLZVQH-SUMWQHHRSA-N 0 0 306.837 5.074 20 0 DKADRN CCSc1ccc(Cl)cc1N[C@@H](C)c1ccncc1F ZINC000559910304 332292928 /nfs/dbraw/zinc/29/29/28/332292928.db2.gz CHFJKIULLKXBHY-JTQLQIEISA-N 0 0 310.825 5.159 20 0 DKADRN CCSc1ccc(Cl)cc1N[C@H](C)c1ccncc1F ZINC000559910305 332293180 /nfs/dbraw/zinc/29/31/80/332293180.db2.gz CHFJKIULLKXBHY-SNVBAGLBSA-N 0 0 310.825 5.159 20 0 DKADRN CC[C@H](C)Sc1ccc(N[C@@H](C)c2cc(C)on2)c(C)c1 ZINC000559911001 332293334 /nfs/dbraw/zinc/29/33/34/332293334.db2.gz IDOBUROQSYOIGS-KBPBESRZSA-N 0 0 304.459 5.355 20 0 DKADRN CC[C@@H](C)Sc1ccc(N[C@@H](C)c2cc(C)on2)c(C)c1 ZINC000559911002 332293204 /nfs/dbraw/zinc/29/32/04/332293204.db2.gz IDOBUROQSYOIGS-KGLIPLIRSA-N 0 0 304.459 5.355 20 0 DKADRN CC[C@H](C)Sc1ccc(N[C@H](C)c2cc(C)on2)c(C)c1 ZINC000559911003 332293340 /nfs/dbraw/zinc/29/33/40/332293340.db2.gz IDOBUROQSYOIGS-UONOGXRCSA-N 0 0 304.459 5.355 20 0 DKADRN CC[C@@H](C)Sc1ccc(N[C@H](C)c2cc(C)on2)c(C)c1 ZINC000559911004 332293208 /nfs/dbraw/zinc/29/32/08/332293208.db2.gz IDOBUROQSYOIGS-ZIAGYGMSSA-N 0 0 304.459 5.355 20 0 DKADRN Cc1cc([C@@H](C)NCc2sc3ccc(Cl)cc3c2C)no1 ZINC000559916629 332292718 /nfs/dbraw/zinc/29/27/18/332292718.db2.gz UWZLYDNGHAJXGJ-LLVKDONJSA-N 0 0 320.845 5.010 20 0 DKADRN Cc1cc([C@H](C)NCc2sc3ccc(Cl)cc3c2C)no1 ZINC000559916632 332292782 /nfs/dbraw/zinc/29/27/82/332292782.db2.gz UWZLYDNGHAJXGJ-NSHDSACASA-N 0 0 320.845 5.010 20 0 DKADRN CC(C)Oc1cccc([C@@H](N[C@@H](C)c2ccccc2)C(F)F)c1 ZINC000559918886 332293105 /nfs/dbraw/zinc/29/31/05/332293105.db2.gz JNWCKRFFTFJCGB-KBXCAEBGSA-N 0 0 319.395 5.131 20 0 DKADRN CC(C)Oc1cccc([C@H](N[C@@H](C)c2ccccc2)C(F)F)c1 ZINC000559918895 332293081 /nfs/dbraw/zinc/29/30/81/332293081.db2.gz JNWCKRFFTFJCGB-KSSFIOAISA-N 0 0 319.395 5.131 20 0 DKADRN C[C@H](Nc1cccc(CSCc2ccccc2)c1)c1cn[nH]c1 ZINC000559921007 332293922 /nfs/dbraw/zinc/29/39/22/332293922.db2.gz 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XJPUEAXLQLACEF-UHFFFAOYSA-N 0 0 319.404 5.246 20 0 DKADRN Cc1cccnc1C[NH2+]Cc1ccc(-c2ccc(Cl)cc2)cc1 ZINC000560050351 332306540 /nfs/dbraw/zinc/30/65/40/332306540.db2.gz KVRVWHBNGHIHEN-UHFFFAOYSA-N 0 0 322.839 5.000 20 0 DKADRN CC(C)c1cnc(CNC2(c3ccc(Cl)cc3)CCC2)s1 ZINC000560064890 332307639 /nfs/dbraw/zinc/30/76/39/332307639.db2.gz HSKKMNFGGLGAIV-UHFFFAOYSA-N 0 0 320.889 5.089 20 0 DKADRN CC[C@H](C)Sc1ccc(NCc2cnn(C(C)C)c2)c(C)c1 ZINC000560078427 332308928 /nfs/dbraw/zinc/30/89/28/332308928.db2.gz OQZMCWCXAPADSQ-HNNXBMFYSA-N 0 0 317.502 5.275 20 0 DKADRN CC[C@@H](C)Sc1ccc(NCc2cnn(C(C)C)c2)c(C)c1 ZINC000560078430 332308822 /nfs/dbraw/zinc/30/88/22/332308822.db2.gz OQZMCWCXAPADSQ-OAHLLOKOSA-N 0 0 317.502 5.275 20 0 DKADRN Cc1cc(Cl)c(NC(=O)c2occc2C(C)C)cc1Cl ZINC000560088506 332310254 /nfs/dbraw/zinc/31/02/54/332310254.db2.gz MRKRPXFNIIVUEO-UHFFFAOYSA-N 0 0 312.196 5.271 20 0 DKADRN CC(C)c1ccoc1C(=O)Nc1ccc(-c2ccco2)cc1F ZINC000560099418 332311014 /nfs/dbraw/zinc/31/10/14/332311014.db2.gz 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/nfs/dbraw/zinc/32/27/10/332322710.db2.gz WICJDOWJIOXQGK-LBPRGKRZSA-N 0 0 312.800 5.070 20 0 DKADRN CCOc1cc(N[C@@H](C)c2ccc3ccccc3n2)ccc1C ZINC000560267388 332325687 /nfs/dbraw/zinc/32/56/87/332325687.db2.gz BWPSCRTXXHWYAZ-HNNXBMFYSA-N 0 0 306.409 5.115 20 0 DKADRN CCOc1cc(N[C@H](C)c2ccc3ccccc3n2)ccc1C ZINC000560267393 332325714 /nfs/dbraw/zinc/32/57/14/332325714.db2.gz BWPSCRTXXHWYAZ-OAHLLOKOSA-N 0 0 306.409 5.115 20 0 DKADRN CCc1c2cc(C)ccc2oc1[C@@H](C)NCc1cnc(C2CC2)o1 ZINC000560346900 332332587 /nfs/dbraw/zinc/33/25/87/332332587.db2.gz VYLKSENZRYFCKN-CYBMUJFWSA-N 0 0 324.424 5.020 20 0 DKADRN CCc1c2cc(C)ccc2oc1[C@H](C)NCc1cnc(C2CC2)o1 ZINC000560346901 332332609 /nfs/dbraw/zinc/33/26/09/332332609.db2.gz VYLKSENZRYFCKN-ZDUSSCGKSA-N 0 0 324.424 5.020 20 0 DKADRN C[C@@H](N[C@@H](C)c1cscn1)c1ccc(-c2ccccc2)cc1 ZINC000560422436 332337838 /nfs/dbraw/zinc/33/78/38/332337838.db2.gz JDKVUMAITMRTTJ-CABCVRRESA-N 0 0 308.450 5.222 20 0 DKADRN C[C@H](N[C@@H](C)c1ccc(-c2ccccc2)cc1)c1cscn1 ZINC000560422437 332337832 /nfs/dbraw/zinc/33/78/32/332337832.db2.gz JDKVUMAITMRTTJ-GJZGRUSLSA-N 0 0 308.450 5.222 20 0 DKADRN C[C@@H](N[C@H](C)c1ccc(-c2ccccc2)cc1)c1cscn1 ZINC000560422438 332338076 /nfs/dbraw/zinc/33/80/76/332338076.db2.gz JDKVUMAITMRTTJ-HUUCEWRRSA-N 0 0 308.450 5.222 20 0 DKADRN C[C@@H](N[C@@H](C)c1ccc(-c2ccccc2)cc1)c1cscn1 ZINC000560422439 332337865 /nfs/dbraw/zinc/33/78/65/332337865.db2.gz JDKVUMAITMRTTJ-LSDHHAIUSA-N 0 0 308.450 5.222 20 0 DKADRN C[C@@H](N[C@H](C)c1ccc(-c2cccs2)cc1)c1cscn1 ZINC000560422538 332338166 /nfs/dbraw/zinc/33/81/66/332338166.db2.gz ZHDPKXVCWIMDQS-CHWSQXEVSA-N 0 0 314.479 5.283 20 0 DKADRN C[C@@H](N[C@@H](C)c1cscn1)c1ccc(-c2cccs2)cc1 ZINC000560422539 332338284 /nfs/dbraw/zinc/33/82/84/332338284.db2.gz ZHDPKXVCWIMDQS-OLZOCXBDSA-N 0 0 314.479 5.283 20 0 DKADRN C[C@@H](N[C@@H](C)c1ccc(-c2cccs2)cc1)c1cscn1 ZINC000560422540 332338303 /nfs/dbraw/zinc/33/83/03/332338303.db2.gz ZHDPKXVCWIMDQS-QWHCGFSZSA-N 0 0 314.479 5.283 20 0 DKADRN C[C@H](N[C@@H](C)c1ccc(-c2cccs2)cc1)c1cscn1 ZINC000560422541 332338323 /nfs/dbraw/zinc/33/83/23/332338323.db2.gz ZHDPKXVCWIMDQS-STQMWFEESA-N 0 0 314.479 5.283 20 0 DKADRN CC[C@@H](N[C@H](c1nccs1)c1ccccc1)c1cccc(C)c1 ZINC000560527130 332351354 /nfs/dbraw/zinc/35/13/54/332351354.db2.gz AJKSTTSOXXEXOL-MOPGFXCFSA-N 0 0 322.477 5.282 20 0 DKADRN CC[C@H](N[C@H](c1nccs1)c1ccccc1)c1cccc(C)c1 ZINC000560527131 332351777 /nfs/dbraw/zinc/35/17/77/332351777.db2.gz AJKSTTSOXXEXOL-OALUTQOASA-N 0 0 322.477 5.282 20 0 DKADRN CC[C@H](N[C@@H](c1nccs1)c1ccccc1)c1cccc(C)c1 ZINC000560527132 332351748 /nfs/dbraw/zinc/35/17/48/332351748.db2.gz AJKSTTSOXXEXOL-RBUKOAKNSA-N 0 0 322.477 5.282 20 0 DKADRN CC[C@@H](N[C@@H](c1nccs1)c1ccccc1)c1cccc(C)c1 ZINC000560527133 332351566 /nfs/dbraw/zinc/35/15/66/332351566.db2.gz AJKSTTSOXXEXOL-RTBURBONSA-N 0 0 322.477 5.282 20 0 DKADRN Cc1cccc(C(C)C)c1NC(=O)c1ccc2c(c1)CCC=C2 ZINC000560535403 332354276 /nfs/dbraw/zinc/35/42/76/332354276.db2.gz KHVRCYJENNEXBH-UHFFFAOYSA-N 0 0 305.421 5.330 20 0 DKADRN Cc1ccnc([C@@H](C)N[C@@H](CC(F)(F)F)c2ccccc2C)c1 ZINC000560535639 332354289 /nfs/dbraw/zinc/35/42/89/332354289.db2.gz CJBBAXZARUTMIW-PBHICJAKSA-N 0 0 322.374 5.043 20 0 DKADRN Cc1ccnc([C@@H](C)N[C@H](CC(F)(F)F)c2ccccc2C)c1 ZINC000560535643 332354283 /nfs/dbraw/zinc/35/42/83/332354283.db2.gz CJBBAXZARUTMIW-RHSMWYFYSA-N 0 0 322.374 5.043 20 0 DKADRN Cc1ccnc([C@H](C)N[C@H](CC(F)(F)F)c2ccccc2C)c1 ZINC000560535645 332354177 /nfs/dbraw/zinc/35/41/77/332354177.db2.gz CJBBAXZARUTMIW-WMLDXEAASA-N 0 0 322.374 5.043 20 0 DKADRN Cc1ccnc([C@H](C)N[C@@H](CC(F)(F)F)c2ccccc2C)c1 ZINC000560535646 332354153 /nfs/dbraw/zinc/35/41/53/332354153.db2.gz CJBBAXZARUTMIW-YOEHRIQHSA-N 0 0 322.374 5.043 20 0 DKADRN Cc1nc2cc(Cl)c(N[C@@H](C)c3cc(C)ccn3)cc2s1 ZINC000560538276 332355014 /nfs/dbraw/zinc/35/50/14/332355014.db2.gz XSFDIPUCABUMKQ-JTQLQIEISA-N 0 0 317.845 5.135 20 0 DKADRN Cc1nc2cc(Cl)c(N[C@H](C)c3cc(C)ccn3)cc2s1 ZINC000560538383 332354971 /nfs/dbraw/zinc/35/49/71/332354971.db2.gz 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/nfs/dbraw/zinc/35/84/37/332358437.db2.gz FZDDSDSVEXQDDY-ZWKOTPCHSA-N 0 0 323.484 5.250 20 0 DKADRN Cc1ccnc([C@H](C)Nc2ccc(-c3cnc(C4CC4)o3)cc2)c1 ZINC000560550581 332358457 /nfs/dbraw/zinc/35/84/57/332358457.db2.gz YHRRNMBYBCCFJW-AWEZNQCLSA-N 0 0 319.408 5.096 20 0 DKADRN Cc1ccnc([C@@H](C)Nc2ccc(-c3cnc(C4CC4)o3)cc2)c1 ZINC000560550582 332358234 /nfs/dbraw/zinc/35/82/34/332358234.db2.gz YHRRNMBYBCCFJW-CQSZACIVSA-N 0 0 319.408 5.096 20 0 DKADRN CCC(C)(C)OCc1ccccc1N[C@@H](C)c1cc(C)ccn1 ZINC000560550675 332358688 /nfs/dbraw/zinc/35/86/88/332358688.db2.gz WCJXXMXUOCLPGA-INIZCTEOSA-N 0 0 312.457 5.268 20 0 DKADRN CCC(C)(C)OCc1ccccc1N[C@H](C)c1cc(C)ccn1 ZINC000560550677 332358680 /nfs/dbraw/zinc/35/86/80/332358680.db2.gz WCJXXMXUOCLPGA-MRXNPFEDSA-N 0 0 312.457 5.268 20 0 DKADRN CC[C@H](Nc1ccc(C)c(C(=O)NC(C)C)c1)c1cccc(C)c1 ZINC000560552910 332358784 /nfs/dbraw/zinc/35/87/84/332358784.db2.gz VXTLARXJSNGPFC-FQEVSTJZSA-N 0 0 324.468 5.005 20 0 DKADRN CC[C@@H](Nc1ccc(C)c(C(=O)NC(C)C)c1)c1cccc(C)c1 ZINC000560552912 332358951 /nfs/dbraw/zinc/35/89/51/332358951.db2.gz VXTLARXJSNGPFC-HXUWFJFHSA-N 0 0 324.468 5.005 20 0 DKADRN Cc1ccnc([C@H](C)Nc2ccc(COC3CCCC3)cc2)c1 ZINC000560553212 332358928 /nfs/dbraw/zinc/35/89/28/332358928.db2.gz NAOPTOGZBZMIRN-INIZCTEOSA-N 0 0 310.441 5.022 20 0 DKADRN Cc1ccnc([C@@H](C)Nc2ccc(COC3CCCC3)cc2)c1 ZINC000560553213 332358903 /nfs/dbraw/zinc/35/89/03/332358903.db2.gz NAOPTOGZBZMIRN-MRXNPFEDSA-N 0 0 310.441 5.022 20 0 DKADRN c1ccc(CSCc2ccc(OCc3ccccn3)cc2)cc1 ZINC000560566608 332360239 /nfs/dbraw/zinc/36/02/39/332360239.db2.gz VEIYYWWXGZNOCF-UHFFFAOYSA-N 0 0 321.445 5.094 20 0 DKADRN Clc1ccc([C@@H]2CCN2Cc2cnc(C3CCC3)s2)cc1 ZINC000560586668 332365655 /nfs/dbraw/zinc/36/56/55/332365655.db2.gz JUKNAFWWHJCKED-INIZCTEOSA-N 0 0 318.873 5.011 20 0 DKADRN Clc1ccc([C@H]2CCN2Cc2cnc(C3CCC3)s2)cc1 ZINC000560586680 332365791 /nfs/dbraw/zinc/36/57/91/332365791.db2.gz JUKNAFWWHJCKED-MRXNPFEDSA-N 0 0 318.873 5.011 20 0 DKADRN CCOc1cc(Cl)ccc1NC(=O)c1cc(C(C)C)oc1C ZINC000560589150 332366221 /nfs/dbraw/zinc/36/62/21/332366221.db2.gz ZARDYZWHZYVZOT-UHFFFAOYSA-N 0 0 321.804 5.016 20 0 DKADRN CCc1ccc(N[C@@H](C)c2nnc(-c3ccc(C)cc3)o2)cc1C ZINC000560601555 332367870 /nfs/dbraw/zinc/36/78/70/332367870.db2.gz RXHINSJGAKIQCW-HNNXBMFYSA-N 0 0 321.424 5.089 20 0 DKADRN CCc1ccc(N[C@H](C)c2nnc(-c3ccc(C)cc3)o2)cc1C ZINC000560601556 332367807 /nfs/dbraw/zinc/36/78/07/332367807.db2.gz RXHINSJGAKIQCW-OAHLLOKOSA-N 0 0 321.424 5.089 20 0 DKADRN CC1(C)CC(C(=O)Nc2ccccc2-c2c(F)cccc2F)C1 ZINC000560637830 332371763 /nfs/dbraw/zinc/37/17/63/332371763.db2.gz HWAHAGABMIXHFD-UHFFFAOYSA-N 0 0 315.363 5.007 20 0 DKADRN CC[C@H](C)CCC(=O)Nc1ccccc1COC(C)(C)CC ZINC000560640584 332372154 /nfs/dbraw/zinc/37/21/54/332372154.db2.gz KNAFTDPKHIOPIR-HNNXBMFYSA-N 0 0 305.462 5.157 20 0 DKADRN CC[C@@H](C)CCC(=O)Nc1ccccc1COC(C)(C)CC ZINC000560640587 332371998 /nfs/dbraw/zinc/37/19/98/332371998.db2.gz KNAFTDPKHIOPIR-OAHLLOKOSA-N 0 0 305.462 5.157 20 0 DKADRN Cc1oc2ccc(NC(=O)c3sccc3Cl)cc2c1C ZINC000560647366 332372644 /nfs/dbraw/zinc/37/26/44/332372644.db2.gz WIPQTYUUYFMUGK-UHFFFAOYSA-N 0 0 305.786 5.017 20 0 DKADRN Cc1ncsc1CNc1cccc(CSC(C)C)c1C ZINC000560689871 332378225 /nfs/dbraw/zinc/37/82/25/332378225.db2.gz VKHSTTCIKQPOQK-UHFFFAOYSA-N 0 0 306.500 5.014 20 0 DKADRN Cc1ccc(-c2ccc(C)c(NC(=O)c3c(C)coc3C)c2)o1 ZINC000560696931 332378527 /nfs/dbraw/zinc/37/85/27/332378527.db2.gz ZLNHKQSIBZXGHQ-UHFFFAOYSA-N 0 0 309.365 5.026 20 0 DKADRN Cc1cnc([C@@H](C)SCc2ccc(Cl)c3cccnc23)o1 ZINC000560742260 332383325 /nfs/dbraw/zinc/38/33/25/332383325.db2.gz RNPDNLZWDMNTTI-LLVKDONJSA-N 0 0 318.829 5.179 20 0 DKADRN Cc1cnc([C@H](C)SCc2ccc(Cl)c3cccnc23)o1 ZINC000560742261 332383233 /nfs/dbraw/zinc/38/32/33/332383233.db2.gz RNPDNLZWDMNTTI-NSHDSACASA-N 0 0 318.829 5.179 20 0 DKADRN CC(C)c1ccccc1N(C)C(=O)c1ccc(C(C)(F)F)cc1 ZINC000560749379 332384059 /nfs/dbraw/zinc/38/40/59/332384059.db2.gz ASFCWFFRORAHGY-UHFFFAOYSA-N 0 0 317.379 5.198 20 0 DKADRN CN(C(=O)c1sccc1C1CC1)c1cccc2ccccc21 ZINC000560770712 332385806 /nfs/dbraw/zinc/38/58/06/332385806.db2.gz FSJWWECRDNBYGK-UHFFFAOYSA-N 0 0 307.418 5.055 20 0 DKADRN Cc1ccc(-c2ncco2)cc1NCc1cccc(F)c1Cl ZINC000560837182 332389407 /nfs/dbraw/zinc/38/94/07/332389407.db2.gz PQIIEYOICIAJLV-UHFFFAOYSA-N 0 0 316.763 5.055 20 0 DKADRN Cc1nc([C@H](C)N[C@H](CC(C)(C)C)c2ccc(F)cc2)cs1 ZINC000560901588 332393372 /nfs/dbraw/zinc/39/33/72/332393372.db2.gz ROQZFOIBOPPCEK-BLLLJJGKSA-N 0 0 320.477 5.419 20 0 DKADRN Cc1nc([C@H](C)N[C@@H](CC(C)(C)C)c2ccc(F)cc2)cs1 ZINC000560901589 332393411 /nfs/dbraw/zinc/39/34/11/332393411.db2.gz ROQZFOIBOPPCEK-LRDDRELGSA-N 0 0 320.477 5.419 20 0 DKADRN Cc1nc([C@@H](C)N[C@H](CC(C)(C)C)c2ccc(F)cc2)cs1 ZINC000560901590 332393518 /nfs/dbraw/zinc/39/35/18/332393518.db2.gz ROQZFOIBOPPCEK-MLGOLLRUSA-N 0 0 320.477 5.419 20 0 DKADRN Cc1nc([C@@H](C)N[C@@H](CC(C)(C)C)c2ccc(F)cc2)cs1 ZINC000560901591 332393404 /nfs/dbraw/zinc/39/34/04/332393404.db2.gz ROQZFOIBOPPCEK-WBMJQRKESA-N 0 0 320.477 5.419 20 0 DKADRN Cc1nc([C@@H](C)N[C@H]2CCCc3ccc(C(C)C)cc32)cs1 ZINC000560910737 332394328 /nfs/dbraw/zinc/39/43/28/332394328.db2.gz OPFVYXYABAWLGT-ACJLOTCBSA-N 0 0 314.498 5.303 20 0 DKADRN Cc1nc([C@@H](C)N[C@@H]2CCCc3ccc(C(C)C)cc32)cs1 ZINC000560910739 332394335 /nfs/dbraw/zinc/39/43/35/332394335.db2.gz OPFVYXYABAWLGT-FZKQIMNGSA-N 0 0 314.498 5.303 20 0 DKADRN Cc1nc([C@H](C)N[C@@H]2CCCc3ccc(C(C)C)cc32)cs1 ZINC000560910740 332394296 /nfs/dbraw/zinc/39/42/96/332394296.db2.gz OPFVYXYABAWLGT-SCLBCKFNSA-N 0 0 314.498 5.303 20 0 DKADRN Cc1nc([C@H](C)N[C@H]2CCCc3ccc(C(C)C)cc32)cs1 ZINC000560910743 332394229 /nfs/dbraw/zinc/39/42/29/332394229.db2.gz OPFVYXYABAWLGT-UGSOOPFHSA-N 0 0 314.498 5.303 20 0 DKADRN FC(F)(F)c1cccc(CSCc2nc3ccccc3[nH]2)c1 ZINC000560966302 332397784 /nfs/dbraw/zinc/39/77/84/332397784.db2.gz PNRDMYGCARHFQN-UHFFFAOYSA-N 0 0 322.355 5.015 20 0 DKADRN Cc1c(NC(=O)[C@H](C)CCC(C)(C)C)cccc1-c1ncco1 ZINC000560990037 332399132 /nfs/dbraw/zinc/39/91/32/332399132.db2.gz VBVMQILZUPQYRL-CYBMUJFWSA-N 0 0 314.429 5.051 20 0 DKADRN Cc1c(NC(=O)[C@@H](C)CCC(C)(C)C)cccc1-c1ncco1 ZINC000560990038 332399172 /nfs/dbraw/zinc/39/91/72/332399172.db2.gz VBVMQILZUPQYRL-ZDUSSCGKSA-N 0 0 314.429 5.051 20 0 DKADRN CCC(CC)SCc1ccc(OCc2cccnc2)cc1 ZINC000561043531 332404018 /nfs/dbraw/zinc/40/40/18/332404018.db2.gz AGNPJAAHXJSLEU-UHFFFAOYSA-N 0 0 301.455 5.082 20 0 DKADRN Clc1ccc(CNc2ccc([C@H]3CCOC3)cc2)cc1Cl ZINC000561056324 332405143 /nfs/dbraw/zinc/40/51/43/332405143.db2.gz FGEWVQUWXXZERM-AWEZNQCLSA-N 0 0 322.235 5.109 20 0 DKADRN Cc1cc(NC(=O)C(C)(C)C(C)(C)C)ccc1-c1ccncc1 ZINC000561088626 332409619 /nfs/dbraw/zinc/40/96/19/332409619.db2.gz AVQAVYNCNXMSPR-UHFFFAOYSA-N 0 0 310.441 5.068 20 0 DKADRN C[C@@H](CCC(C)(C)C)C(=O)N1CC[C@H]1c1ccc(Cl)cc1 ZINC000561148131 332416765 /nfs/dbraw/zinc/41/67/65/332416765.db2.gz YSOZARIDZXWRRB-BBRMVZONSA-N 0 0 307.865 5.076 20 0 DKADRN C[C@H](CCC(C)(C)C)C(=O)N1CC[C@H]1c1ccc(Cl)cc1 ZINC000561148155 332416755 /nfs/dbraw/zinc/41/67/55/332416755.db2.gz YSOZARIDZXWRRB-CJNGLKHVSA-N 0 0 307.865 5.076 20 0 DKADRN C[C@@H](CCC(C)(C)C)C(=O)N1CC[C@@H]1c1ccc(Cl)cc1 ZINC000561148161 332416746 /nfs/dbraw/zinc/41/67/46/332416746.db2.gz YSOZARIDZXWRRB-XJKSGUPXSA-N 0 0 307.865 5.076 20 0 DKADRN C[C@H](c1ccc(Cl)cc1)[S@](=O)[C@@H]1CCCc2ccccc21 ZINC000561157475 332417600 /nfs/dbraw/zinc/41/76/00/332417600.db2.gz OGLDHZAEMDEMFO-GIWSNZPPSA-N 0 0 318.869 5.227 20 0 DKADRN C[C@H](c1ccc(Cl)cc1)[S@@](=O)[C@H]1CCCc2ccccc21 ZINC000561157476 332417681 /nfs/dbraw/zinc/41/76/81/332417681.db2.gz OGLDHZAEMDEMFO-LZHZSBQWSA-N 0 0 318.869 5.227 20 0 DKADRN C[C@H](c1ccc(Cl)cc1)[S@](=O)[C@H]1CCCc2ccccc21 ZINC000561157477 332417692 /nfs/dbraw/zinc/41/76/92/332417692.db2.gz OGLDHZAEMDEMFO-MPKWNAGQSA-N 0 0 318.869 5.227 20 0 DKADRN Clc1cccc(-c2csc(C3CCOCC3)n2)c1Cl ZINC000561290686 332434470 /nfs/dbraw/zinc/43/44/70/332434470.db2.gz DLGQEYHDWBSIBT-UHFFFAOYSA-N 0 0 314.237 5.011 20 0 DKADRN FC(F)(F)c1ccc(Oc2cnc3ccc(Cl)cc3c2)nc1 ZINC000561322279 332437162 /nfs/dbraw/zinc/43/71/62/332437162.db2.gz ZZQVFUMTQKWODN-UHFFFAOYSA-N 0 0 324.689 5.094 20 0 DKADRN CC[C@@H]1CC[C@@H](C)N1C(=O)Nc1cc(C(F)F)ccc1Cl ZINC000561327167 332438032 /nfs/dbraw/zinc/43/80/32/332438032.db2.gz OBZPHFYVVYPYPK-MWLCHTKSSA-N 0 0 316.779 5.072 20 0 DKADRN CSc1ccc(C)c(NC(=O)Nc2cc(Cl)ccc2F)c1 ZINC000561359926 332441182 /nfs/dbraw/zinc/44/11/82/332441182.db2.gz HNTHJPSXDLUNAB-UHFFFAOYSA-N 0 0 324.808 5.153 20 0 DKADRN Fc1cccc(-c2nc(-c3ccnc(C(F)(F)F)c3)cs2)c1 ZINC000561391358 332445438 /nfs/dbraw/zinc/44/54/38/332445438.db2.gz YFLFJHVBSYBCJT-UHFFFAOYSA-N 0 0 324.302 5.030 20 0 DKADRN Cc1ccc(/C=C\CC(=O)N2C[C@H](C)C[C@@H]2c2ccccc2)cc1 ZINC000561419786 332449251 /nfs/dbraw/zinc/44/92/51/332449251.db2.gz RBSGTYFKJTVHJT-BGNPZWQASA-N 0 0 319.448 5.008 20 0 DKADRN Cc1ccc(/C=C/CC(=O)N2C[C@H](C)C[C@@H]2c2ccccc2)cc1 ZINC000561419787 332449258 /nfs/dbraw/zinc/44/92/58/332449258.db2.gz RBSGTYFKJTVHJT-DYWSFYFFSA-N 0 0 319.448 5.008 20 0 DKADRN CSc1ccccc1C(=O)Nc1ccccc1CCC(C)C ZINC000561449976 332451622 /nfs/dbraw/zinc/45/16/22/332451622.db2.gz RCOHPMAFSJSFAS-UHFFFAOYSA-N 0 0 313.466 5.249 20 0 DKADRN CC(C)c1cccc(C(C)C)c1NC(=O)c1cc2ccccn2c1 ZINC000561562127 332463822 /nfs/dbraw/zinc/46/38/22/332463822.db2.gz LVGVTWYLXCEMSD-UHFFFAOYSA-N 0 0 320.436 5.438 20 0 DKADRN Cc1ccccc1NC(=O)N[C@@H](C)c1ccc(F)c2ccccc21 ZINC000561591045 332467162 /nfs/dbraw/zinc/46/71/62/332467162.db2.gz PGZXDRDGDSRPBM-AWEZNQCLSA-N 0 0 322.383 5.170 20 0 DKADRN Cc1ccccc1NC(=O)N[C@H](C)c1ccc(F)c2ccccc21 ZINC000561591046 332467225 /nfs/dbraw/zinc/46/72/25/332467225.db2.gz PGZXDRDGDSRPBM-CQSZACIVSA-N 0 0 322.383 5.170 20 0 DKADRN Cc1cccc(F)c1NC(=O)c1cccc(Oc2ccccc2)c1 ZINC000561612194 332470003 /nfs/dbraw/zinc/47/00/03/332470003.db2.gz HDJNYDQVIHLDFF-UHFFFAOYSA-N 0 0 321.351 5.179 20 0 DKADRN c1ccc2cc(SCc3nc(C4CCCC4)no3)ccc2c1 ZINC000561645546 332473467 /nfs/dbraw/zinc/47/34/67/332473467.db2.gz MXLPRZSPLRAAGA-UHFFFAOYSA-N 0 0 310.422 5.173 20 0 DKADRN c1ccc(-c2noc([C@@H]3C[C@H]3c3cccc4ccccc43)n2)cc1 ZINC000561695305 332480669 /nfs/dbraw/zinc/48/06/69/332480669.db2.gz FQQKWPMZJGPUSF-RBUKOAKNSA-N 0 0 312.372 5.161 20 0 DKADRN COc1cc(C)c(NC(=O)CC/C=C\c2ccccc2)c(C)c1C ZINC000561710340 332484912 /nfs/dbraw/zinc/48/49/12/332484912.db2.gz DFHANUZCKNPTQM-WQLSENKSSA-N 0 0 323.436 5.053 20 0 DKADRN CC(C)=CCSCCCC(=O)Nc1c(C)cc(C)cc1C ZINC000561733915 332488574 /nfs/dbraw/zinc/48/85/74/332488574.db2.gz HMHPMHFMBAQSEI-UHFFFAOYSA-N 0 0 305.487 5.030 20 0 DKADRN CCc1nnc([C@H](C)SCc2ccc(C3CCCC3)cc2)o1 ZINC000561738910 332488455 /nfs/dbraw/zinc/48/84/55/332488455.db2.gz SGWYLCZLTKKNPI-ZDUSSCGKSA-N 0 0 316.470 5.284 20 0 DKADRN CC(C)OCc1cccc(N[C@@H](C)c2cc3ccccc3o2)c1 ZINC000561807695 332500021 /nfs/dbraw/zinc/50/00/21/332500021.db2.gz JYWDVGYFEDVFKA-HNNXBMFYSA-N 0 0 309.409 5.531 20 0 DKADRN CC(C)OCc1cccc(N[C@H](C)c2cc3ccccc3o2)c1 ZINC000561807697 332500162 /nfs/dbraw/zinc/50/01/62/332500162.db2.gz JYWDVGYFEDVFKA-OAHLLOKOSA-N 0 0 309.409 5.531 20 0 DKADRN Cc1cccc(CSCc2ccc(Cl)c3cccnc23)n1 ZINC000561807707 332500080 /nfs/dbraw/zinc/50/00/80/332500080.db2.gz KAXYFZKHICEELJ-UHFFFAOYSA-N 0 0 314.841 5.025 20 0 DKADRN Cc1oc(C(C)C)cc1C(=O)Nc1cc(C)c(F)cc1Cl ZINC000561814158 332501317 /nfs/dbraw/zinc/50/13/17/332501317.db2.gz XDNJZPPRFFRFEG-UHFFFAOYSA-N 0 0 309.768 5.065 20 0 DKADRN C[C@@H]1CCC[C@@H](C(=O)Nc2cc(Cl)ccc2C(F)(F)F)C1 ZINC000561823259 332502800 /nfs/dbraw/zinc/50/28/00/332502800.db2.gz ABGFWBGWUPOKAH-NXEZZACHSA-N 0 0 319.754 5.124 20 0 DKADRN C[C@H]1CCC[C@H](C(=O)Nc2cc(Cl)ccc2C(F)(F)F)C1 ZINC000561823260 332502713 /nfs/dbraw/zinc/50/27/13/332502713.db2.gz ABGFWBGWUPOKAH-UWVGGRQHSA-N 0 0 319.754 5.124 20 0 DKADRN C[C@H]1CCC[C@@H](C(=O)Nc2cc(Cl)ccc2C(F)(F)F)C1 ZINC000561823261 332502660 /nfs/dbraw/zinc/50/26/60/332502660.db2.gz ABGFWBGWUPOKAH-VHSXEESVSA-N 0 0 319.754 5.124 20 0 DKADRN CC1(C)CCC[C@@H]1C(=O)Nc1cc(Cl)ccc1C(F)(F)F ZINC000561824452 332501952 /nfs/dbraw/zinc/50/19/52/332501952.db2.gz QEXSICGOKOXPKF-LLVKDONJSA-N 0 0 319.754 5.124 20 0 DKADRN CC1(C)CCC[C@H]1C(=O)Nc1cc(Cl)ccc1C(F)(F)F ZINC000561824453 332502077 /nfs/dbraw/zinc/50/20/77/332502077.db2.gz QEXSICGOKOXPKF-NSHDSACASA-N 0 0 319.754 5.124 20 0 DKADRN O=C(CC1=CCCCC1)Nc1cc(Cl)ccc1C(F)(F)F ZINC000561825219 332502137 /nfs/dbraw/zinc/50/21/37/332502137.db2.gz SQLDOYCERUVPOK-UHFFFAOYSA-N 0 0 317.738 5.188 20 0 DKADRN CCCC[C@H](CC)C(=O)Nc1cc(C(F)F)ccc1Cl ZINC000561842625 332505300 /nfs/dbraw/zinc/50/53/00/332505300.db2.gz MBAZYWUNNMPONN-JTQLQIEISA-N 0 0 303.780 5.433 20 0 DKADRN C/C=C/c1ccc(NCc2ncc(-c3cccc(F)c3)o2)cc1 ZINC000561850908 332506006 /nfs/dbraw/zinc/50/60/06/332506006.db2.gz GEOVRNSKOMEUFW-DUXPYHPUSA-N 0 0 308.356 5.126 20 0 DKADRN C/C=C\c1ccc(NCc2ncc(-c3cccc(F)c3)o2)cc1 ZINC000561850911 332506101 /nfs/dbraw/zinc/50/61/01/332506101.db2.gz GEOVRNSKOMEUFW-RQOWECAXSA-N 0 0 308.356 5.126 20 0 DKADRN C[C@@H](Oc1cccc2ccccc21)c1nc(C2CCCC2)no1 ZINC000561867689 332509172 /nfs/dbraw/zinc/50/91/72/332509172.db2.gz DYLAPPKUOFBYAE-CYBMUJFWSA-N 0 0 308.381 5.020 20 0 DKADRN Cc1ccc(C)c(CNc2ccc(C)c(NC(=O)C(C)(C)C)c2)c1 ZINC000562009642 332530732 /nfs/dbraw/zinc/53/07/32/332530732.db2.gz CSALDWNVJBOROD-UHFFFAOYSA-N 0 0 324.468 5.209 20 0 DKADRN Cc1cccc(C)c1NC(=O)N1C[C@H](C)CC[C@@H]1c1ccccc1 ZINC000562019980 332532322 /nfs/dbraw/zinc/53/23/22/332532322.db2.gz QMGBEQAQHDVHGL-DNVCBOLYSA-N 0 0 322.452 5.309 20 0 DKADRN Cc1cccc(C)c1NC(=O)N1C[C@@H](C)CC[C@@H]1c1ccccc1 ZINC000562019983 332532250 /nfs/dbraw/zinc/53/22/50/332532250.db2.gz QMGBEQAQHDVHGL-HNAYVOBHSA-N 0 0 322.452 5.309 20 0 DKADRN C/C=C\c1ccc(N[C@H](C[C@@H]2CCOC2)c2ccccc2)cc1 ZINC000562054555 332538035 /nfs/dbraw/zinc/53/80/35/332538035.db2.gz BIBXXZRRZDFUMW-JWDWQRTRSA-N 0 0 307.437 5.300 20 0 DKADRN C/C=C/c1ccc(N[C@H](C[C@H]2CCOC2)c2ccccc2)cc1 ZINC000562054557 332537913 /nfs/dbraw/zinc/53/79/13/332537913.db2.gz BIBXXZRRZDFUMW-XKTFLECKSA-N 0 0 307.437 5.300 20 0 DKADRN C/C=C/c1ccc(N[C@H](c2ccc(F)cc2)c2cccnc2)cc1 ZINC000562056614 332538399 /nfs/dbraw/zinc/53/83/99/332538399.db2.gz SNMMHRAMFFXGQE-ZZNNXKBLSA-N 0 0 318.395 5.455 20 0 DKADRN C/C=C\c1ccc(N[C@@H](C)CC(=O)Nc2ccccc2CC)cc1 ZINC000562062398 332539148 /nfs/dbraw/zinc/53/91/48/332539148.db2.gz SPINPKYUZZYJMS-FAOGRTBUSA-N 0 0 322.452 5.111 20 0 DKADRN C/C=C/c1ccc(N[C@H](C)CC(=O)Nc2ccccc2CC)cc1 ZINC000562062399 332539203 /nfs/dbraw/zinc/53/92/03/332539203.db2.gz SPINPKYUZZYJMS-KZJSRBBCSA-N 0 0 322.452 5.111 20 0 DKADRN C/C=C\c1ccc(N[C@H](C)CC(=O)Nc2ccccc2CC)cc1 ZINC000562062400 332539127 /nfs/dbraw/zinc/53/91/27/332539127.db2.gz SPINPKYUZZYJMS-LWAXHKBTSA-N 0 0 322.452 5.111 20 0 DKADRN C/C=C/c1ccc(N[C@@H](C)CC(=O)Nc2ccccc2CC)cc1 ZINC000562062401 332539220 /nfs/dbraw/zinc/53/92/20/332539220.db2.gz SPINPKYUZZYJMS-YCOJEUHLSA-N 0 0 322.452 5.111 20 0 DKADRN CC[C@H]1CCCCCN1C(=O)Nc1c(C)cccc1C(C)C ZINC000562070915 332541874 /nfs/dbraw/zinc/54/18/74/332541874.db2.gz VZAQXJBNTFMKOD-INIZCTEOSA-N 0 0 302.462 5.305 20 0 DKADRN Clc1ccc(Oc2ccc(NCc3cscn3)cc2)cc1 ZINC000562083275 332544285 /nfs/dbraw/zinc/54/42/85/332544285.db2.gz JNZYWEPYVHHEKK-UHFFFAOYSA-N 0 0 316.813 5.201 20 0 DKADRN Cc1cc([C@H](C)N[C@@H](CC(C)(C)C)c2ccc(Cl)cc2)no1 ZINC000562089916 332544883 /nfs/dbraw/zinc/54/48/83/332544883.db2.gz JFUMZZDFQLMYFQ-GUYCJALGSA-N 0 0 320.864 5.465 20 0 DKADRN Cc1cc([C@H](C)N[C@H](CC(C)(C)C)c2ccc(Cl)cc2)no1 ZINC000562089917 518187928 /nfs/dbraw/zinc/18/79/28/518187928.db2.gz JFUMZZDFQLMYFQ-SUMWQHHRSA-N 0 0 320.864 5.465 20 0 DKADRN COC[C@@H](Nc1cccc(CSC)c1)c1cccc(Cl)c1 ZINC000562096623 332546100 /nfs/dbraw/zinc/54/61/00/332546100.db2.gz GUEIVHRXGATZPT-QGZVFWFLSA-N 0 0 321.873 5.003 20 0 DKADRN CC(C)Oc1cc(F)ccc1N[C@@H](C)c1nccc2ccccc21 ZINC000562098221 332546202 /nfs/dbraw/zinc/54/62/02/332546202.db2.gz VEANWOZVCZKPHI-AWEZNQCLSA-N 0 0 324.399 5.334 20 0 DKADRN Cc1ccccc1COc1cccc(N[C@@H](C)c2nccs2)c1 ZINC000562110683 332548168 /nfs/dbraw/zinc/54/81/68/332548168.db2.gz CUTOQHAIIYXTBO-HNNXBMFYSA-N 0 0 324.449 5.204 20 0 DKADRN Cc1ccccc1COc1cccc(N[C@H](C)c2nccs2)c1 ZINC000562110687 332548116 /nfs/dbraw/zinc/54/81/16/332548116.db2.gz CUTOQHAIIYXTBO-OAHLLOKOSA-N 0 0 324.449 5.204 20 0 DKADRN C[C@@H]1C[C@@H](C(C)(C)C)CCN1C(=O)Nc1cccc(C(F)F)c1 ZINC000562137628 332552165 /nfs/dbraw/zinc/55/21/65/332552165.db2.gz PVFLOTMAIVKFSR-OCCSQVGLSA-N 0 0 324.415 5.303 20 0 DKADRN C[C@@H]1C[C@H](C(C)(C)C)CCN1C(=O)Nc1cccc(C(F)F)c1 ZINC000562137629 332552192 /nfs/dbraw/zinc/55/21/92/332552192.db2.gz PVFLOTMAIVKFSR-TZMCWYRMSA-N 0 0 324.415 5.303 20 0 DKADRN C/C=C/c1ccc(NC(=O)Nc2cccc([C@@H](C)OC)c2)cc1 ZINC000562185898 332557541 /nfs/dbraw/zinc/55/75/41/332557541.db2.gz CJZCKXZUBHKTRR-YVARQFDVSA-N 0 0 310.397 5.071 20 0 DKADRN CC[C@H](C)Oc1cccc(NC(=O)N(CC)C2CCCCC2)c1 ZINC000562193148 332557785 /nfs/dbraw/zinc/55/77/85/332557785.db2.gz ZAPAVKGYEKUAIF-HNNXBMFYSA-N 0 0 318.461 5.050 20 0 DKADRN CC[C@@H](C)Oc1cccc(NC(=O)N(CC)C2CCCCC2)c1 ZINC000562193156 332557787 /nfs/dbraw/zinc/55/77/87/332557787.db2.gz ZAPAVKGYEKUAIF-OAHLLOKOSA-N 0 0 318.461 5.050 20 0 DKADRN Cc1ncsc1CNc1ccccc1Sc1ccccc1 ZINC000562232270 332561725 /nfs/dbraw/zinc/56/17/25/332561725.db2.gz JRRIHYGOYPVPJO-UHFFFAOYSA-N 0 0 312.463 5.215 20 0 DKADRN CC[C@H]1CCCCN1C(=O)Nc1ccccc1CCC(C)C ZINC000562232777 332561736 /nfs/dbraw/zinc/56/17/36/332561736.db2.gz ATEDTVYJDIYUFY-KRWDZBQOSA-N 0 0 302.462 5.072 20 0 DKADRN CN(C(=O)c1ccc(C2CCCC2)cc1)c1ccc2cc[nH]c2c1 ZINC000562247725 332563612 /nfs/dbraw/zinc/56/36/12/332563612.db2.gz FOQYPOOMKRLLIE-UHFFFAOYSA-N 0 0 318.420 5.102 20 0 DKADRN Cc1cc(-c2ccccc2)ccc1NC(=O)N1CCC2(CCC2)C1 ZINC000562297222 332570602 /nfs/dbraw/zinc/57/06/02/332570602.db2.gz BVXVFJOTKYSCFS-UHFFFAOYSA-N 0 0 320.436 5.070 20 0 DKADRN C[C@H](Nc1ccc(C2CCC2)cc1)c1ccc2c(c1)CCC(=O)N2 ZINC000562338425 332580779 /nfs/dbraw/zinc/58/07/79/332580779.db2.gz KKPLGBGRAARNBC-AWEZNQCLSA-N 0 0 320.436 5.012 20 0 DKADRN C[C@H](Nc1ccc(C(C)(C)C(F)(F)F)cc1)c1cscn1 ZINC000562368318 332584845 /nfs/dbraw/zinc/58/48/45/332584845.db2.gz HNUFXDMYLOTHOD-JTQLQIEISA-N 0 0 314.376 5.156 20 0 DKADRN C[C@@H](Nc1ccc(C(C)(C)C(F)(F)F)cc1)c1cscn1 ZINC000562368319 332584735 /nfs/dbraw/zinc/58/47/35/332584735.db2.gz HNUFXDMYLOTHOD-SNVBAGLBSA-N 0 0 314.376 5.156 20 0 DKADRN Cc1ccccc1-c1cnc(CNc2c(F)cccc2Cl)o1 ZINC000562425930 332591795 /nfs/dbraw/zinc/59/17/95/332591795.db2.gz QBSBRDVLJXWKAN-UHFFFAOYSA-N 0 0 316.763 5.055 20 0 DKADRN c1cc2cccc(NCc3nc(C4CCCCC4)cs3)c2[nH]1 ZINC000562436341 332593830 /nfs/dbraw/zinc/59/38/30/332593830.db2.gz AUSJKVXSQMUCRZ-UHFFFAOYSA-N 0 0 311.454 5.284 20 0 DKADRN CCc1cc(C)cc(CC)c1NC(=O)Nc1cccc2cc[nH]c21 ZINC000562456906 332594872 /nfs/dbraw/zinc/59/48/72/332594872.db2.gz RCANDDAGMRIAJI-UHFFFAOYSA-N 0 0 321.424 5.245 20 0 DKADRN CCc1cnc(CSCc2nc(C3CCCCC3)cs2)o1 ZINC000562467898 332595890 /nfs/dbraw/zinc/59/58/90/332595890.db2.gz MUPRTUFHURCFOR-UHFFFAOYSA-N 0 0 322.499 5.175 20 0 DKADRN CC(C)c1cccc(NCc2conc2Cc2ccccc2)c1 ZINC000562768660 332624680 /nfs/dbraw/zinc/62/46/80/332624680.db2.gz IPCQGVRKZCMWQE-UHFFFAOYSA-N 0 0 306.409 5.001 20 0 DKADRN C[C@H]1CCCN(C(=O)Nc2ccc3oc4ccccc4c3c2)CC1 ZINC000562862784 332633810 /nfs/dbraw/zinc/63/38/10/332633810.db2.gz WJGMCVUOJRBZIX-AWEZNQCLSA-N 0 0 322.408 5.240 20 0 DKADRN CCCN(C(=O)Nc1cc(Cl)ccc1C(F)(F)F)C(C)C ZINC000563356432 333595413 /nfs/dbraw/zinc/59/54/13/333595413.db2.gz OIGOTUVIKJZNMT-UHFFFAOYSA-N 0 0 322.758 5.011 20 0 DKADRN CCCCCOc1ccc([C@@H](C)N[C@@H](C)c2cscn2)cc1 ZINC000563445168 333608121 /nfs/dbraw/zinc/60/81/21/333608121.db2.gz YYWRDKVSUIVBKT-CABCVRRESA-N 0 0 318.486 5.124 20 0 DKADRN CCCCCOc1ccc([C@H](C)N[C@@H](C)c2cscn2)cc1 ZINC000563445172 333608182 /nfs/dbraw/zinc/60/81/82/333608182.db2.gz YYWRDKVSUIVBKT-GJZGRUSLSA-N 0 0 318.486 5.124 20 0 DKADRN Cc1ccc(Cl)cc1N(C)C(=O)c1ccc(C(C)(F)F)cc1 ZINC000563471940 333609857 /nfs/dbraw/zinc/60/98/57/333609857.db2.gz LACWBRVSJONMIH-UHFFFAOYSA-N 0 0 323.770 5.037 20 0 DKADRN Cc1ccc(Cl)cc1N(C)C(=O)c1cccc2ccccc21 ZINC000563760351 334996309 /nfs/dbraw/zinc/99/63/09/334996309.db2.gz NWGBUXJNWDEXNV-UHFFFAOYSA-N 0 0 309.796 5.078 20 0 DKADRN CC1(C)CN(C(=O)CCC2CCCCC2)[C@@H]1c1cccs1 ZINC000563763745 334998897 /nfs/dbraw/zinc/99/88/97/334998897.db2.gz NGPUFASKQOIJII-QGZVFWFLSA-N 0 0 305.487 5.018 20 0 DKADRN C[C@H](N[C@@H](c1c(Cl)cccc1Cl)C1CC1)c1ccccn1 ZINC000563782321 335006823 /nfs/dbraw/zinc/00/68/23/335006823.db2.gz XEMKKOPYXLKWAT-APPDUMDISA-N 0 0 321.251 5.190 20 0 DKADRN C[C@@H](N[C@H](c1c(Cl)cccc1Cl)C1CC1)c1ccccn1 ZINC000563782322 335006857 /nfs/dbraw/zinc/00/68/57/335006857.db2.gz XEMKKOPYXLKWAT-DIFFPNOSSA-N 0 0 321.251 5.190 20 0 DKADRN C[C@H](N[C@H](c1c(Cl)cccc1Cl)C1CC1)c1ccccn1 ZINC000563782323 335006855 /nfs/dbraw/zinc/00/68/55/335006855.db2.gz XEMKKOPYXLKWAT-GTNSWQLSSA-N 0 0 321.251 5.190 20 0 DKADRN C[C@@H](N[C@@H](c1c(Cl)cccc1Cl)C1CC1)c1ccccn1 ZINC000563782324 335006809 /nfs/dbraw/zinc/00/68/09/335006809.db2.gz XEMKKOPYXLKWAT-PIGZYNQJSA-N 0 0 321.251 5.190 20 0 DKADRN Cc1ncsc1CS[C@@H](C)c1ccc(OC(F)F)cc1 ZINC000563790675 335014649 /nfs/dbraw/zinc/01/46/49/335014649.db2.gz LUPKFMFSINQNDL-JTQLQIEISA-N 0 0 315.410 5.047 20 0 DKADRN Cc1ncsc1CS[C@H](C)c1ccc(OC(F)F)cc1 ZINC000563790676 335014643 /nfs/dbraw/zinc/01/46/43/335014643.db2.gz LUPKFMFSINQNDL-SNVBAGLBSA-N 0 0 315.410 5.047 20 0 DKADRN Cc1ccnc([C@H](C)Nc2ccc3nc(C(F)F)sc3c2)c1 ZINC000563802170 335020304 /nfs/dbraw/zinc/02/03/04/335020304.db2.gz OUTXBZIAHKKNCD-JTQLQIEISA-N 0 0 319.380 5.110 20 0 DKADRN Cc1ccnc([C@@H](C)Nc2ccc3nc(C(F)F)sc3c2)c1 ZINC000563802171 335020326 /nfs/dbraw/zinc/02/03/26/335020326.db2.gz OUTXBZIAHKKNCD-SNVBAGLBSA-N 0 0 319.380 5.110 20 0 DKADRN CC(C)O[C@@H](CSCc1ccc(Cl)cn1)c1ccccc1 ZINC000563803184 335020381 /nfs/dbraw/zinc/02/03/81/335020381.db2.gz VGJUPSWOZOOMHE-KRWDZBQOSA-N 0 0 321.873 5.135 20 0 DKADRN CC(C)O[C@H](CSCc1ccc(Cl)cn1)c1ccccc1 ZINC000563803185 335020482 /nfs/dbraw/zinc/02/04/82/335020482.db2.gz VGJUPSWOZOOMHE-QGZVFWFLSA-N 0 0 321.873 5.135 20 0 DKADRN CC(C)c1ccoc1C(=O)Nc1ccccc1-c1ccccc1 ZINC000563825534 335033193 /nfs/dbraw/zinc/03/31/93/335033193.db2.gz BXUMNQCCKJZRPC-UHFFFAOYSA-N 0 0 305.377 5.322 20 0 DKADRN CC(C)Sc1ccccc1NC1CCC2(CCCO2)CC1 ZINC000563848718 335056929 /nfs/dbraw/zinc/05/69/29/335056929.db2.gz BAWJKVWEXUSTTD-UHFFFAOYSA-N 0 0 305.487 5.091 20 0 DKADRN CC(C)n1ncnc1CS[C@@H](C)c1cccc2ccccc21 ZINC000563854703 335057884 /nfs/dbraw/zinc/05/78/84/335057884.db2.gz JXGZNUILEJUIEU-AWEZNQCLSA-N 0 0 311.454 5.007 20 0 DKADRN CC(C)n1ncnc1CS[C@H](C)c1cccc2ccccc21 ZINC000563854704 335057959 /nfs/dbraw/zinc/05/79/59/335057959.db2.gz JXGZNUILEJUIEU-CQSZACIVSA-N 0 0 311.454 5.007 20 0 DKADRN CC(C)(C)c1ccccc1NC(=O)N1CCC(C)(C2CC2)CC1 ZINC000563877759 335096492 /nfs/dbraw/zinc/09/64/92/335096492.db2.gz JIVMFUXJVBXZIG-UHFFFAOYSA-N 0 0 314.473 5.028 20 0 DKADRN CC(C)(C)CCC(=O)Nc1cc(Cl)ccc1C(F)(F)F ZINC000563914112 336383215 /nfs/dbraw/zinc/38/32/15/336383215.db2.gz LTDUSCFIKGKYIQ-UHFFFAOYSA-N 0 0 307.743 5.124 20 0 DKADRN Cc1ncc(-c2ccccc2)cc1NCc1scnc1C1CC1 ZINC000563924462 336383954 /nfs/dbraw/zinc/38/39/54/336383954.db2.gz LNGMRDFEBAPAJA-UHFFFAOYSA-N 0 0 321.449 5.003 20 0 DKADRN CCSc1ccccc1C(=O)Nc1cc(C)c(F)cc1Cl ZINC000564000545 336395060 /nfs/dbraw/zinc/39/50/60/336395060.db2.gz ZBYIUDNPQUMQJC-UHFFFAOYSA-N 0 0 323.820 5.152 20 0 DKADRN CC(C)c1ccccc1N(C)C(=O)c1ccccc1C(F)(F)F ZINC000564002095 336395261 /nfs/dbraw/zinc/39/52/61/336395261.db2.gz JQRLMFMVCWDEJV-UHFFFAOYSA-N 0 0 321.342 5.105 20 0 DKADRN C[C@@H](N[C@H](c1c(Cl)cccc1Cl)C1CC1)c1ccoc1 ZINC000564007587 336401568 /nfs/dbraw/zinc/40/15/68/336401568.db2.gz JCZPOLVGIKAFNC-HWPZZCPQSA-N 0 0 310.224 5.388 20 0 DKADRN C[C@H](N[C@@H](c1c(Cl)cccc1Cl)C1CC1)c1ccoc1 ZINC000564007594 336401604 /nfs/dbraw/zinc/40/16/04/336401604.db2.gz JCZPOLVGIKAFNC-MGPLVRAMSA-N 0 0 310.224 5.388 20 0 DKADRN C[C@H](SCc1csc(C2CCCCC2)n1)c1cccnc1 ZINC000564103150 337454866 /nfs/dbraw/zinc/45/48/66/337454866.db2.gz SNJGNAPADPYHAV-ZDUSSCGKSA-N 0 0 318.511 5.580 20 0 DKADRN Cc1cc(C(=O)Nc2cc(F)ccc2Cl)c(C)cc1Cl ZINC000564142869 337858174 /nfs/dbraw/zinc/85/81/74/337858174.db2.gz UIJRGOOVLZEFBN-UHFFFAOYSA-N 0 0 312.171 5.002 20 0 DKADRN CCc1ccccc1C(=O)Nc1cc(C(F)F)ccc1Cl ZINC000564192934 340607446 /nfs/dbraw/zinc/60/74/46/340607446.db2.gz HYUDTODSDVGVME-UHFFFAOYSA-N 0 0 309.743 5.092 20 0 DKADRN O=C(Nc1cccc(F)c1Cl)c1cc(Cl)ccc1Cl ZINC000564201144 340808196 /nfs/dbraw/zinc/80/81/96/340808196.db2.gz JPXWZSURDAROOH-UHFFFAOYSA-N 0 0 318.562 5.038 20 0 DKADRN FC(F)(F)c1csc(Oc2cncc(-c3ccccc3)c2)n1 ZINC000564262419 341026489 /nfs/dbraw/zinc/02/64/89/341026489.db2.gz SZDZSQGXDMAXKY-UHFFFAOYSA-N 0 0 322.311 5.016 20 0 DKADRN c1csc(Cc2noc(-c3sccc3-c3ccccc3)n2)c1 ZINC000564262479 341026550 /nfs/dbraw/zinc/02/65/50/341026550.db2.gz YFBNWFRSJYVMGN-UHFFFAOYSA-N 0 0 324.430 5.117 20 0 DKADRN CCSCc1cccc(N[C@H]2CCCNc3ccccc32)c1 ZINC000564299116 341152346 /nfs/dbraw/zinc/15/23/46/341152346.db2.gz RKJFWLBAEXKNNL-IBGZPJMESA-N 0 0 312.482 5.299 20 0 DKADRN CCSCc1cccc(N[C@@H]2CCCNc3ccccc32)c1 ZINC000564299126 341152436 /nfs/dbraw/zinc/15/24/36/341152436.db2.gz RKJFWLBAEXKNNL-LJQANCHMSA-N 0 0 312.482 5.299 20 0 DKADRN CC[C@@H](CC(=O)Nc1cccc(C(F)F)c1Cl)C(C)C ZINC000564299473 341153011 /nfs/dbraw/zinc/15/30/11/341153011.db2.gz MSXNCFGJXWLOAC-JTQLQIEISA-N 0 0 303.780 5.288 20 0 DKADRN CC[C@H](CC(=O)Nc1cccc(C(F)F)c1Cl)C(C)C ZINC000564299477 341152961 /nfs/dbraw/zinc/15/29/61/341152961.db2.gz MSXNCFGJXWLOAC-SNVBAGLBSA-N 0 0 303.780 5.288 20 0 DKADRN CCC[C@H]1CCCCN1C(=O)Nc1ccccc1C(C)(C)C ZINC000564312195 341189908 /nfs/dbraw/zinc/18/99/08/341189908.db2.gz AFSUNHAHWVFFPZ-HNNXBMFYSA-N 0 0 302.462 5.171 20 0 DKADRN CCC[C@@H]1CCCCN1C(=O)Nc1ccccc1C(C)(C)C ZINC000564312196 341189862 /nfs/dbraw/zinc/18/98/62/341189862.db2.gz AFSUNHAHWVFFPZ-OAHLLOKOSA-N 0 0 302.462 5.171 20 0 DKADRN CC[C@H](CC(=O)N1CCC2(CCCC2)CC1)c1ccc(C)cc1 ZINC000564312609 341191931 /nfs/dbraw/zinc/19/19/31/341191931.db2.gz PVPVHICWAGTNHC-GOSISDBHSA-N 0 0 313.485 5.062 20 0 DKADRN CC[C@@H](CC(=O)N1CCC2(CCCC2)CC1)c1ccc(C)cc1 ZINC000564312610 341191873 /nfs/dbraw/zinc/19/18/73/341191873.db2.gz PVPVHICWAGTNHC-SFHVURJKSA-N 0 0 313.485 5.062 20 0 DKADRN CC[C@H](c1ccncc1)N(C)Cc1csc(Cl)c1Cl ZINC000564324950 341222241 /nfs/dbraw/zinc/22/22/41/341222241.db2.gz JYEXTKSSVPXKIP-GFCCVEGCSA-N 0 0 315.269 5.033 20 0 DKADRN CC[C@@H](c1ccncc1)N(C)Cc1csc(Cl)c1Cl ZINC000564324955 341222246 /nfs/dbraw/zinc/22/22/46/341222246.db2.gz JYEXTKSSVPXKIP-LBPRGKRZSA-N 0 0 315.269 5.033 20 0 DKADRN CC[C@@H](C)Sc1ccc(N[C@H](CC)c2ccn(C)n2)c(C)c1 ZINC000564355001 341271963 /nfs/dbraw/zinc/27/19/63/341271963.db2.gz IMQFMMBGOHJRPA-GDBMZVCRSA-N 0 0 317.502 5.182 20 0 DKADRN CC[C@@H](Nc1ccc(S[C@@H](C)CC)cc1C)c1ccn(C)n1 ZINC000564355012 341272115 /nfs/dbraw/zinc/27/21/15/341272115.db2.gz IMQFMMBGOHJRPA-GOEBONIOSA-N 0 0 317.502 5.182 20 0 DKADRN CC[C@H](C)Sc1ccc(N[C@@H](CC)c2ccn(C)n2)c(C)c1 ZINC000564355015 341272025 /nfs/dbraw/zinc/27/20/25/341272025.db2.gz IMQFMMBGOHJRPA-HOCLYGCPSA-N 0 0 317.502 5.182 20 0 DKADRN CC[C@@H](C)Sc1ccc(N[C@@H](CC)c2ccn(C)n2)c(C)c1 ZINC000564355017 341272005 /nfs/dbraw/zinc/27/20/05/341272005.db2.gz IMQFMMBGOHJRPA-ZBFHGGJFSA-N 0 0 317.502 5.182 20 0 DKADRN Cc1ccc(Cl)cc1N(C)C(=O)c1cc2sccc2s1 ZINC000564360528 341282595 /nfs/dbraw/zinc/28/25/95/341282595.db2.gz AQCULLFPGVRLHE-UHFFFAOYSA-N 0 0 321.854 5.201 20 0 DKADRN FC(F)c1cccc(NCc2cnc3ccccc3c2)c1Cl ZINC000564372038 341317856 /nfs/dbraw/zinc/31/78/56/341317856.db2.gz QGXKLQBAMNQFEL-UHFFFAOYSA-N 0 0 318.754 5.438 20 0 DKADRN CCCC[C@H](C)N(C)C(=O)Nc1c(C(C)C)cccc1C(C)C ZINC000564382716 341350574 /nfs/dbraw/zinc/35/05/74/341350574.db2.gz YVMSBNSNZUEUEH-INIZCTEOSA-N 0 0 318.505 5.976 20 0 DKADRN CCCC[C@@H](C)N(C)C(=O)Nc1c(C(C)C)cccc1C(C)C ZINC000564382733 341350830 /nfs/dbraw/zinc/35/08/30/341350830.db2.gz YVMSBNSNZUEUEH-MRXNPFEDSA-N 0 0 318.505 5.976 20 0 DKADRN Cc1cccc([C@@H](NCc2cc(C(C)(C)C)on2)C(C)(C)C)c1 ZINC000564391342 341391164 /nfs/dbraw/zinc/39/11/64/341391164.db2.gz XMOWSCQNQSRULP-GOSISDBHSA-N 0 0 314.473 5.158 20 0 DKADRN Cc1cccc([C@H](NCc2cc(C(C)(C)C)on2)C(C)(C)C)c1 ZINC000564391343 341391079 /nfs/dbraw/zinc/39/10/79/341391079.db2.gz 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DKADRN Cc1cc(CNc2ccccc2Oc2c(C)cccc2C)on1 ZINC000570612891 332780600 /nfs/dbraw/zinc/78/06/00/332780600.db2.gz ZYXHQJFZJFZFMW-UHFFFAOYSA-N 0 0 308.381 5.004 20 0 DKADRN Cc1nc(-c2cccc(N[C@H]3C[C@H](C)c4ccccc43)c2)oc1C ZINC000570638124 332789854 /nfs/dbraw/zinc/78/98/54/332789854.db2.gz LHYWSPVRFPSCGY-RBZFPXEDSA-N 0 0 318.420 5.619 20 0 DKADRN Cc1nc(-c2cccc(N[C@@H]3C[C@H](C)c4ccccc43)c2)oc1C ZINC000570638125 332789621 /nfs/dbraw/zinc/78/96/21/332789621.db2.gz LHYWSPVRFPSCGY-RNODOKPDSA-N 0 0 318.420 5.619 20 0 DKADRN Cc1nc(-c2cccc(N[C@@H]3C[C@@H](C)c4ccccc43)c2)oc1C ZINC000570638127 332789664 /nfs/dbraw/zinc/78/96/64/332789664.db2.gz LHYWSPVRFPSCGY-ZUOKHONESA-N 0 0 318.420 5.619 20 0 DKADRN Cc1ccnc([C@H](C)Nc2cccc(Cl)c2OC(C)C)c1 ZINC000570645448 332791271 /nfs/dbraw/zinc/79/12/71/332791271.db2.gz DODUTWSYMQNJBI-ZDUSSCGKSA-N 0 0 304.821 5.004 20 0 DKADRN C[C@@H](Oc1cccc2ccccc21)c1nc(-c2ccsc2)no1 ZINC000570724936 332806372 /nfs/dbraw/zinc/80/63/72/332806372.db2.gz GCHOGLHCIYGUJK-GFCCVEGCSA-N 0 0 322.389 5.091 20 0 DKADRN C[C@H](Oc1cccc2ccccc21)c1nc(-c2ccsc2)no1 ZINC000570724937 332806318 /nfs/dbraw/zinc/80/63/18/332806318.db2.gz GCHOGLHCIYGUJK-LBPRGKRZSA-N 0 0 322.389 5.091 20 0 DKADRN Cc1ncc(-c2ccccc2)cc1NC(=O)c1occc1C(C)C ZINC000570744135 332809591 /nfs/dbraw/zinc/80/95/91/332809591.db2.gz CYLQRGUMNLZAIW-UHFFFAOYSA-N 0 0 320.392 5.026 20 0 DKADRN CCC(CC)N(CC)C(=O)Nc1c(C(C)C)cccc1C(C)C ZINC000570758399 332811336 /nfs/dbraw/zinc/81/13/36/332811336.db2.gz RISSEOAWHHRCPX-UHFFFAOYSA-N 0 0 318.505 5.976 20 0 DKADRN C[C@H](CC(=O)Nc1cc(C(F)F)ccc1Cl)c1ccccc1 ZINC000570758671 332811503 /nfs/dbraw/zinc/81/15/03/332811503.db2.gz QYYXIWBHKQUEJO-LLVKDONJSA-N 0 0 323.770 5.410 20 0 DKADRN C[C@@H](CC(=O)Nc1cc(C(F)F)ccc1Cl)c1ccccc1 ZINC000570758676 332811385 /nfs/dbraw/zinc/81/13/85/332811385.db2.gz QYYXIWBHKQUEJO-NSHDSACASA-N 0 0 323.770 5.410 20 0 DKADRN CC(C)C[C@@H]1CCCCCN1C(=O)Nc1ncsc1C(C)C ZINC000570883525 332833922 /nfs/dbraw/zinc/83/39/22/332833922.db2.gz VFPPVKGTVMCUAB-AWEZNQCLSA-N 0 0 323.506 5.089 20 0 DKADRN CC(C)C[C@H]1CCCCCN1C(=O)Nc1ncsc1C(C)C ZINC000570883528 332833919 /nfs/dbraw/zinc/83/39/19/332833919.db2.gz VFPPVKGTVMCUAB-CQSZACIVSA-N 0 0 323.506 5.089 20 0 DKADRN Cc1nc(C(C)C)sc1-c1nc(-c2occc2C(C)C)no1 ZINC000570901277 332838720 /nfs/dbraw/zinc/83/87/20/332838720.db2.gz SHSDKKRGKWXLOL-UHFFFAOYSA-N 0 0 317.414 5.008 20 0 DKADRN CC1(CC(=O)Nc2cccc(C(F)F)c2Cl)CCCC1 ZINC000571001279 333477026 /nfs/dbraw/zinc/47/70/26/333477026.db2.gz UEKPRGQWPOEIHV-UHFFFAOYSA-N 0 0 301.764 5.187 20 0 DKADRN CCC[C@H](NC(=O)Nc1c(F)cccc1Cl)c1ccccc1 ZINC000571027634 333482481 /nfs/dbraw/zinc/48/24/81/333482481.db2.gz AAADVPZCRKEBFM-HNNXBMFYSA-N 0 0 320.795 5.142 20 0 DKADRN Cc1cncc([C@@H](C)Nc2cc(Cl)ccc2OC(C)C)c1 ZINC000571092442 333659175 /nfs/dbraw/zinc/65/91/75/333659175.db2.gz PBGNFMMKVLLKNS-CYBMUJFWSA-N 0 0 304.821 5.004 20 0 DKADRN Cc1cncc([C@H](C)Nc2cc(Cl)ccc2OC(C)C)c1 ZINC000571092443 333659320 /nfs/dbraw/zinc/65/93/20/333659320.db2.gz PBGNFMMKVLLKNS-ZDUSSCGKSA-N 0 0 304.821 5.004 20 0 DKADRN C[C@H](Nc1ccc(F)c(C2CC2)c1)c1nccc2ccccc21 ZINC000571097126 333660146 /nfs/dbraw/zinc/66/01/46/333660146.db2.gz YFPDRKIHTRCUCN-ZDUSSCGKSA-N 0 0 306.384 5.424 20 0 DKADRN CCC(CC)[C@@H](C)C(=O)Nc1cc(C(F)F)ccc1Cl ZINC000571231059 333686486 /nfs/dbraw/zinc/68/64/86/333686486.db2.gz BCRDFXAJMNMQFF-SECBINFHSA-N 0 0 303.780 5.288 20 0 DKADRN CCC(CC)[C@H](C)C(=O)Nc1cc(C(F)F)ccc1Cl ZINC000571231060 333686663 /nfs/dbraw/zinc/68/66/63/333686663.db2.gz BCRDFXAJMNMQFF-VIFPVBQESA-N 0 0 303.780 5.288 20 0 DKADRN Cc1ccc2c(C(=O)Nc3ncsc3C(C)C)csc2c1 ZINC000571243405 333689351 /nfs/dbraw/zinc/68/93/51/333689351.db2.gz JZVFEOZVCSNFSI-UHFFFAOYSA-N 0 0 316.451 5.042 20 0 DKADRN O=C(Nc1cccc(F)c1Cl)c1cc2cc(Cl)ccc2o1 ZINC000571243550 333689479 /nfs/dbraw/zinc/68/94/79/333689479.db2.gz LEXAXDCHKORBIC-UHFFFAOYSA-N 0 0 324.138 5.131 20 0 DKADRN C[C@@H](Nc1ccc(F)c(Cl)c1)c1nccc2ccccc21 ZINC000571486508 333793877 /nfs/dbraw/zinc/79/38/77/333793877.db2.gz IJULZDYUTQTBEY-LLVKDONJSA-N 0 0 300.764 5.200 20 0 DKADRN C[C@H](Nc1ccc(F)c(Cl)c1)c1nccc2ccccc21 ZINC000571486509 333793869 /nfs/dbraw/zinc/79/38/69/333793869.db2.gz IJULZDYUTQTBEY-NSHDSACASA-N 0 0 300.764 5.200 20 0 DKADRN C[C@H]1CN(C(=O)Nc2ccccc2C(C)(C)C)c2ccccc21 ZINC000571510584 333807556 /nfs/dbraw/zinc/80/75/56/333807556.db2.gz BZSQNZTVMQECEP-AWEZNQCLSA-N 0 0 308.425 5.140 20 0 DKADRN CCc1ccccc1NC(=O)CCSc1cccc(Cl)c1 ZINC000571532581 333814372 /nfs/dbraw/zinc/81/43/72/333814372.db2.gz SKCYOSSBZBYVLB-UHFFFAOYSA-N 0 0 319.857 5.023 20 0 DKADRN CC[C@@H](Nc1ccc([C@@H]2CCOC2)cc1)c1cc(F)ccc1F ZINC000571543445 333815052 /nfs/dbraw/zinc/81/50/52/333815052.db2.gz IDLLQQMRYJJAHF-AUUYWEPGSA-N 0 0 317.379 5.032 20 0 DKADRN CC[C@@H](Nc1ccc([C@H]2CCOC2)cc1)c1cc(F)ccc1F ZINC000571543446 333814928 /nfs/dbraw/zinc/81/49/28/333814928.db2.gz IDLLQQMRYJJAHF-IFXJQAMLSA-N 0 0 317.379 5.032 20 0 DKADRN CC[C@H](Nc1ccc([C@@H]2CCOC2)cc1)c1cc(F)ccc1F ZINC000571543447 333815044 /nfs/dbraw/zinc/81/50/44/333815044.db2.gz IDLLQQMRYJJAHF-KUHUBIRLSA-N 0 0 317.379 5.032 20 0 DKADRN Cc1c2ccccc2oc1C(=O)Nc1cc(C)c(F)cc1Cl ZINC000571561825 333816261 /nfs/dbraw/zinc/81/62/61/333816261.db2.gz QAIAVYRYFOWCRK-UHFFFAOYSA-N 0 0 317.747 5.094 20 0 DKADRN Cc1nc(-c2ccccc2NC(=O)CC2(C)CCCC2)cs1 ZINC000571562098 333816201 /nfs/dbraw/zinc/81/62/01/333816201.db2.gz SQHNRYIZYAHBBQ-UHFFFAOYSA-N 0 0 314.454 5.027 20 0 DKADRN O=C(Nc1ccc(CNc2ccccc2)cc1)C1=CCCCCC1 ZINC000571606217 333820660 /nfs/dbraw/zinc/82/06/60/333820660.db2.gz FJNAMOSTMKMNSD-UHFFFAOYSA-N 0 0 320.436 5.128 20 0 DKADRN CC(C)c1cccc(N(C)C(=O)Nc2ccccc2C(F)F)c1 ZINC000571654922 334072139 /nfs/dbraw/zinc/07/21/39/334072139.db2.gz YLGWSZVVUQRDPE-UHFFFAOYSA-N 0 0 318.367 5.416 20 0 DKADRN C[C@H](NCc1coc(-c2cccs2)n1)c1cccc(C2CC2)c1 ZINC000571706062 337572404 /nfs/dbraw/zinc/57/24/04/337572404.db2.gz OVYYPGMPLLFBSX-ZDUSSCGKSA-N 0 0 324.449 5.131 20 0 DKADRN C/C=C\c1ccc(NC(=O)c2c[nH]cc2-c2ccccc2F)cc1 ZINC000571713172 337571174 /nfs/dbraw/zinc/57/11/74/337571174.db2.gz BNJDBAOTZXVVOW-DJWKRKHSSA-N 0 0 320.367 5.106 20 0 DKADRN CCCc1cccc(C(C)C)c1NC(=O)N(CCC)C(C)C ZINC000571774338 337575732 /nfs/dbraw/zinc/57/57/32/337575732.db2.gz NOGLITXUMSJXGG-UHFFFAOYSA-N 0 0 304.478 5.415 20 0 DKADRN CCC(CC)CC(=O)Nc1cc(Cl)ccc1C(F)(F)F ZINC000571800183 337577350 /nfs/dbraw/zinc/57/73/50/337577350.db2.gz SOTWASVHOSMUKT-UHFFFAOYSA-N 0 0 307.743 5.124 20 0 DKADRN F[C@H](CC1CCCCC1)c1nc(CSCc2ccco2)no1 ZINC000571801388 337577313 /nfs/dbraw/zinc/57/73/13/337577313.db2.gz KMAGCTVSVQLWES-CQSZACIVSA-N 0 0 324.421 5.077 20 0 DKADRN CSc1cccc(NCc2cscc2C(F)(F)F)c1 ZINC000571812261 337577880 /nfs/dbraw/zinc/57/78/80/337577880.db2.gz IHHICUSAXIXKKE-UHFFFAOYSA-N 0 0 303.374 5.101 20 0 DKADRN CCc1nc([C@@H](C)N[C@@H]2CCC(C)(C)c3ccccc32)cs1 ZINC000571841471 337578849 /nfs/dbraw/zinc/57/88/49/337578849.db2.gz JBNSEZNETAODCY-CZUORRHYSA-N 0 0 314.498 5.169 20 0 DKADRN CCc1nc([C@H](C)N[C@@H]2CCC(C)(C)c3ccccc32)cs1 ZINC000571841472 337578794 /nfs/dbraw/zinc/57/87/94/337578794.db2.gz JBNSEZNETAODCY-XJKSGUPXSA-N 0 0 314.498 5.169 20 0 DKADRN FC(F)(F)[C@@H](NCc1cc2ccccc2s1)c1ccccc1 ZINC000571901679 337581510 /nfs/dbraw/zinc/58/15/10/337581510.db2.gz CYGCXHRTCCIMRF-INIZCTEOSA-N 0 0 321.367 5.295 20 0 DKADRN C[C@@H](Nc1ccc([C@@H]2CCOC2)cc1)c1cc2ccccc2o1 ZINC000571902044 337581592 /nfs/dbraw/zinc/58/15/92/337581592.db2.gz HEYXSGSASTWJDP-RHSMWYFYSA-N 0 0 307.393 5.110 20 0 DKADRN C[C@H](Nc1ccc([C@@H]2CCOC2)cc1)c1cc2ccccc2o1 ZINC000571902046 337581560 /nfs/dbraw/zinc/58/15/60/337581560.db2.gz HEYXSGSASTWJDP-WMLDXEAASA-N 0 0 307.393 5.110 20 0 DKADRN Clc1ccc(-c2csc(C3CCOCC3)n2)cc1Cl ZINC000572026138 337587249 /nfs/dbraw/zinc/58/72/49/337587249.db2.gz VXXYTFPVJMXPKN-UHFFFAOYSA-N 0 0 314.237 5.011 20 0 DKADRN O=C(Nc1cccc(-c2ccccc2)c1)c1cc[nH]c1C1CCC1 ZINC000572027584 337587245 /nfs/dbraw/zinc/58/72/45/337587245.db2.gz NJDLNHALTHHRKK-UHFFFAOYSA-N 0 0 316.404 5.202 20 0 DKADRN Cc1ccc(C(=O)Nc2cc(C)c(F)cc2Cl)c(Cl)c1 ZINC000572076994 337589555 /nfs/dbraw/zinc/58/95/55/337589555.db2.gz QXRZYNXKVYWIOZ-UHFFFAOYSA-N 0 0 312.171 5.002 20 0 DKADRN Clc1ccc(Oc2ccc(NCc3cccnc3)cc2)cc1 ZINC000572083924 337589687 /nfs/dbraw/zinc/58/96/87/337589687.db2.gz WBXJOOVKMMVIFJ-UHFFFAOYSA-N 0 0 310.784 5.139 20 0 DKADRN Cc1ccc(Cl)c(NC(=O)c2ccc3nccc(C)c3c2)c1C ZINC000572158970 337594305 /nfs/dbraw/zinc/59/43/05/337594305.db2.gz QAGYUSIBLMYHOZ-UHFFFAOYSA-N 0 0 324.811 5.066 20 0 DKADRN Cc1oc(-c2cccs2)nc1CS[C@H](C)c1cccnc1 ZINC000572230877 337599190 /nfs/dbraw/zinc/59/91/90/337599190.db2.gz RZLCNKXDRUTKQR-GFCCVEGCSA-N 0 0 316.451 5.101 20 0 DKADRN CSCc1ccc(N[C@H](C)c2nccc3ccccc32)cc1 ZINC000572327562 337608842 /nfs/dbraw/zinc/60/88/42/337608842.db2.gz MOZPXFIOKBETTP-CQSZACIVSA-N 0 0 308.450 5.271 20 0 DKADRN Cc1cc([C@H](C)N[C@H](C)c2nc(C(C)(C)C)cs2)c(C)o1 ZINC000572330115 337609071 /nfs/dbraw/zinc/60/90/71/337609071.db2.gz QJWJCCVKBBUCCW-NWDGAFQWSA-N 0 0 306.475 5.062 20 0 DKADRN Clc1scc(CNCc2cc3ccccc3o2)c1Cl ZINC000572342241 337612572 /nfs/dbraw/zinc/61/25/72/337612572.db2.gz DHOURGYJQKOMPN-UHFFFAOYSA-N 0 0 312.221 5.091 20 0 DKADRN CSc1cccc(NC(=O)N(C)[C@H](C)C2CCCCC2)c1C ZINC000572344747 337612045 /nfs/dbraw/zinc/61/20/45/337612045.db2.gz TUFVJMSAWAKQAO-CQSZACIVSA-N 0 0 320.502 5.149 20 0 DKADRN CC(C)c1cccc(C(C)C)c1NC(=O)N1CC(C2CCC2)C1 ZINC000572390353 337626755 /nfs/dbraw/zinc/62/67/55/337626755.db2.gz BVBGHULTVGOZCW-UHFFFAOYSA-N 0 0 314.473 5.197 20 0 DKADRN CSc1cc(NCc2cnc(C3CC3)s2)ccc1Cl ZINC000572463402 337663202 /nfs/dbraw/zinc/66/32/02/337663202.db2.gz KMKPVMSCWOZDDK-UHFFFAOYSA-N 0 0 310.875 5.008 20 0 DKADRN CC1(C)CC[C@H](C(=O)Nc2cc(Cl)ccc2C(F)(F)F)C1 ZINC000572470431 337665913 /nfs/dbraw/zinc/66/59/13/337665913.db2.gz HXNIPXNVTSSJPB-VIFPVBQESA-N 0 0 319.754 5.124 20 0 DKADRN C[C@@H](c1ccsc1)c1nc(-c2ccc(C(C)(F)F)cc2)no1 ZINC000572533710 341415902 /nfs/dbraw/zinc/41/59/02/341415902.db2.gz WBYYQRUWMRGALA-JTQLQIEISA-N 0 0 320.364 5.062 20 0 DKADRN C[C@H](c1ccsc1)c1nc(-c2ccc(C(C)(F)F)cc2)no1 ZINC000572533711 341415919 /nfs/dbraw/zinc/41/59/19/341415919.db2.gz WBYYQRUWMRGALA-SNVBAGLBSA-N 0 0 320.364 5.062 20 0 DKADRN c1cc2c(ccnc2NCc2csc(-c3ccccc3)n2)s1 ZINC000572657228 341699239 /nfs/dbraw/zinc/69/92/39/341699239.db2.gz CCPCNSHYHSOZRF-UHFFFAOYSA-N 0 0 323.446 5.032 20 0 DKADRN Cc1ccc(C)c(CC(=O)Nc2cc(C(F)F)ccc2Cl)c1 ZINC000572680049 341700098 /nfs/dbraw/zinc/70/00/98/341700098.db2.gz XGMXJJNGXCUIFK-UHFFFAOYSA-N 0 0 323.770 5.076 20 0 DKADRN CSCc1ccc(NCc2cscc2C(F)(F)F)cc1 ZINC000572746319 341702804 /nfs/dbraw/zinc/70/28/04/341702804.db2.gz NWBVWOFDTQFRSC-UHFFFAOYSA-N 0 0 317.401 5.242 20 0 DKADRN CCC(CC)N(C(=O)Nc1c(Cl)ccc(C)c1C)C1CC1 ZINC000572798637 341704381 /nfs/dbraw/zinc/70/43/81/341704381.db2.gz RUWILALQOYKVGN-UHFFFAOYSA-N 0 0 308.853 5.142 20 0 DKADRN C(=C\c1ccc2ccccc2c1)\c1nc(C2CCSCC2)no1 ZINC000572800845 341704585 /nfs/dbraw/zinc/70/45/85/341704585.db2.gz RQHUGFGBCSBTAP-VURMDHGXSA-N 0 0 322.433 5.004 20 0 DKADRN CCCC1(C(=O)Nc2cc(C(F)F)ccc2Cl)CCC1 ZINC000572881354 341707761 /nfs/dbraw/zinc/70/77/61/341707761.db2.gz KSKXYTIGXBBZPG-UHFFFAOYSA-N 0 0 301.764 5.187 20 0 DKADRN c1cc2cc(CNc3ccc(Oc4cccnc4)cc3)ccc2o1 ZINC000573010499 341713184 /nfs/dbraw/zinc/71/31/84/341713184.db2.gz DVWWWZSEIKSVRL-UHFFFAOYSA-N 0 0 316.360 5.232 20 0 DKADRN O=C(Nc1ccc2[nH]ccc2c1)c1cscc1-c1ccccc1 ZINC000573291382 341723901 /nfs/dbraw/zinc/72/39/01/341723901.db2.gz NSRJXTJXXMOHIY-UHFFFAOYSA-N 0 0 318.401 5.149 20 0 DKADRN CCc1cccc(C)c1NC(=O)N[C@H](C)c1c(C)cccc1C ZINC000573293595 341723904 /nfs/dbraw/zinc/72/39/04/341723904.db2.gz XABQAMSEEMYJAX-MRXNPFEDSA-N 0 0 310.441 5.057 20 0 DKADRN Clc1ccc(CNc2ccc(COC3CCCC3)cc2)cc1 ZINC000573352946 341725861 /nfs/dbraw/zinc/72/58/61/341725861.db2.gz NTYZZHCOIWMOHE-UHFFFAOYSA-N 0 0 315.844 5.411 20 0 DKADRN C[C@@H](NCc1coc(-c2ccccc2)n1)c1cccc(C2CC2)c1 ZINC000573467704 341729200 /nfs/dbraw/zinc/72/92/00/341729200.db2.gz RMMKXHPDCNQORB-OAHLLOKOSA-N 0 0 318.420 5.070 20 0 DKADRN Clc1cc(Cl)cc(CSc2nnc(C3CC3)s2)c1 ZINC000573500915 341730246 /nfs/dbraw/zinc/73/02/46/341730246.db2.gz VFSARDGPDFYBMS-UHFFFAOYSA-N 0 0 317.266 5.015 20 0 DKADRN Clc1ccccc1CNc1ccc(Oc2cccnc2)cc1 ZINC000573640872 341734314 /nfs/dbraw/zinc/73/43/14/341734314.db2.gz PVIBGNQFFNBWID-UHFFFAOYSA-N 0 0 310.784 5.139 20 0 DKADRN CC(C)c1ccc(C(=O)Nc2cc(C(F)F)ccc2Cl)cc1 ZINC000573642361 341734459 /nfs/dbraw/zinc/73/44/59/341734459.db2.gz LGZNOFNMPSEBIE-UHFFFAOYSA-N 0 0 323.770 5.653 20 0 DKADRN CC(C)(c1noc([C@H]2CCCCS2)n1)c1ccc(Cl)cc1 ZINC000573644707 341734426 /nfs/dbraw/zinc/73/44/26/341734426.db2.gz BESFPGZKAQDPHB-CYBMUJFWSA-N 0 0 322.861 5.007 20 0 DKADRN CCCC[C@H](C)C(=O)Nc1cc(Cl)ccc1C(F)(F)F ZINC000573837818 341740686 /nfs/dbraw/zinc/74/06/86/341740686.db2.gz BJGBCEFSWSLSGK-VIFPVBQESA-N 0 0 307.743 5.124 20 0 DKADRN CC[C@H](C)Oc1cccc(NCc2ncc(C(C)C)s2)c1 ZINC000573865740 341741703 /nfs/dbraw/zinc/74/17/03/341741703.db2.gz KBDPMBYIBDBGKF-ZDUSSCGKSA-N 0 0 304.459 5.056 20 0 DKADRN Cc1ccc(CCC(=O)Nc2ccccc2-c2ccccc2)s1 ZINC000573890249 341742426 /nfs/dbraw/zinc/74/24/26/341742426.db2.gz KIXDOKDPQJVHSI-UHFFFAOYSA-N 0 0 321.445 5.295 20 0 DKADRN CC(C)=CCC[C@@H](C)CC(=O)N1CC2(CCC2)[C@@H]1c1ccco1 ZINC000573922318 341743208 /nfs/dbraw/zinc/74/32/08/341743208.db2.gz FOZGNTQMHUJNCY-APWZRJJASA-N 0 0 315.457 5.106 20 0 DKADRN CCC(CC)(OC)c1noc([C@H](C)c2ccc3ccccc3c2)n1 ZINC000574123547 341749347 /nfs/dbraw/zinc/74/93/47/341749347.db2.gz FLPFHDQJVFLKGS-CQSZACIVSA-N 0 0 324.424 5.036 20 0 DKADRN Cc1ccccc1-c1nnc(SCc2sccc2Cl)o1 ZINC000574140221 341749866 /nfs/dbraw/zinc/74/98/66/341749866.db2.gz PQNUEBFFGSTAJF-UHFFFAOYSA-N 0 0 322.842 5.052 20 0 DKADRN CSc1ccc(CNc2ccc3nc(C4CC4)oc3c2)s1 ZINC000574265260 332337253 /nfs/dbraw/zinc/33/72/53/332337253.db2.gz AAYIYIWHOBBNDD-UHFFFAOYSA-N 0 0 316.451 5.101 20 0 DKADRN Cc1oc2ccccc2c1C(=O)N(C)c1ccccc1C(C)C ZINC000574303793 341754763 /nfs/dbraw/zinc/75/47/63/341754763.db2.gz IRQNNNJBHWIGJL-UHFFFAOYSA-N 0 0 307.393 5.141 20 0 DKADRN Cc1cc(C)cc(C(=O)Nc2cc(C(F)F)ccc2Cl)c1 ZINC000574315282 341755033 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341763610 /nfs/dbraw/zinc/76/36/10/341763610.db2.gz CRERYHCWUHODAA-JTQLQIEISA-N 0 0 309.504 5.194 20 0 DKADRN CC(C)c1cnc(N[C@H](C)c2nc(C(C)(C)C)cs2)s1 ZINC000574605262 341763539 /nfs/dbraw/zinc/76/35/39/341763539.db2.gz CRERYHCWUHODAA-SNVBAGLBSA-N 0 0 309.504 5.194 20 0 DKADRN Cc1ccc(-c2ncc(CNc3cc(C4CC4)ccn3)s2)cc1 ZINC000574679896 341765683 /nfs/dbraw/zinc/76/56/83/341765683.db2.gz ORNRALIKYISTPX-UHFFFAOYSA-N 0 0 321.449 5.003 20 0 DKADRN Cc1cc(CNc2ccc([C@@H](C)Sc3ccccc3)cc2)on1 ZINC000574733218 341767334 /nfs/dbraw/zinc/76/73/34/341767334.db2.gz VSYQEAXHNWIPSB-OAHLLOKOSA-N 0 0 324.449 5.448 20 0 DKADRN CCC(CC)N(CC)C(=O)Nc1cccc(Cl)c1Cl ZINC000574839314 341770368 /nfs/dbraw/zinc/77/03/68/341770368.db2.gz IJGDBOPSCNQSSV-UHFFFAOYSA-N 0 0 303.233 5.036 20 0 DKADRN CC1(CC(=O)Nc2cc(Cl)ccc2C(F)(F)F)CCCC1 ZINC000574839749 341770333 /nfs/dbraw/zinc/77/03/33/341770333.db2.gz IGKHIBDSGVWNFC-UHFFFAOYSA-N 0 0 319.754 5.268 20 0 DKADRN Fc1cc(-c2ccco2)ccc1NCc1cnc(C2CC2)s1 ZINC000574859510 341771078 /nfs/dbraw/zinc/77/10/78/341771078.db2.gz ZTOHUDLUOWHCFL-UHFFFAOYSA-N 0 0 314.385 5.032 20 0 DKADRN CC(C)[C@H](C)C(=O)Nc1ccccc1N[C@@H](C)c1ccccc1 ZINC000574938076 332853643 /nfs/dbraw/zinc/85/36/43/332853643.db2.gz JEBIILSBTNXWLE-HOTGVXAUSA-N 0 0 310.441 5.090 20 0 DKADRN CC(C)[C@@H](C)C(=O)Nc1ccccc1N[C@H](C)c1ccccc1 ZINC000574938077 332853626 /nfs/dbraw/zinc/85/36/26/332853626.db2.gz JEBIILSBTNXWLE-HZPDHXFCSA-N 0 0 310.441 5.090 20 0 DKADRN CC(C)[C@H](C)C(=O)Nc1ccccc1N[C@H](C)c1ccccc1 ZINC000574938078 332853551 /nfs/dbraw/zinc/85/35/51/332853551.db2.gz JEBIILSBTNXWLE-JKSUJKDBSA-N 0 0 310.441 5.090 20 0 DKADRN CCCC[C@H](C)N(C)C(=O)Nc1cc(Cl)ccc1Cl ZINC000574962601 332896212 /nfs/dbraw/zinc/89/62/12/332896212.db2.gz OHLUHACNUIRZMG-JTQLQIEISA-N 0 0 303.233 5.036 20 0 DKADRN CSc1cccc(F)c1CN[C@H](C)c1csc(Cl)c1 ZINC000575010591 341670718 /nfs/dbraw/zinc/67/07/18/341670718.db2.gz YRUDCDNEESRXNA-SECBINFHSA-N 0 0 315.866 5.113 20 0 DKADRN CSc1cccc(F)c1CN[C@@H](C)c1csc(Cl)c1 ZINC000575010592 341670708 /nfs/dbraw/zinc/67/07/08/341670708.db2.gz YRUDCDNEESRXNA-VIFPVBQESA-N 0 0 315.866 5.113 20 0 DKADRN CCOc1ccc(NC(=O)c2cscc2-c2ccccc2)cc1 ZINC000575096994 341777103 /nfs/dbraw/zinc/77/71/03/341777103.db2.gz MWFBJZLFWPTYEO-UHFFFAOYSA-N 0 0 323.417 5.066 20 0 DKADRN FC(F)c1cccc(N[C@H]2CCCNc3ccccc32)c1Cl ZINC000575368123 341795240 /nfs/dbraw/zinc/79/52/40/341795240.db2.gz VAAJCZXKVPXXNG-AWEZNQCLSA-N 0 0 322.786 5.637 20 0 DKADRN FC(F)c1cccc(N[C@@H]2CCCNc3ccccc32)c1Cl ZINC000575368124 341795284 /nfs/dbraw/zinc/79/52/84/341795284.db2.gz VAAJCZXKVPXXNG-CQSZACIVSA-N 0 0 322.786 5.637 20 0 DKADRN CCCc1ccccc1NC(=O)NCc1cc2ccccc2s1 ZINC000575419218 341797676 /nfs/dbraw/zinc/79/76/76/341797676.db2.gz GILIMLJHQHCPII-UHFFFAOYSA-N 0 0 324.449 5.176 20 0 DKADRN O=C(Nc1ccsc1Cl)c1cscc1-c1ccccc1 ZINC000575632301 341800675 /nfs/dbraw/zinc/80/06/75/341800675.db2.gz UXEOROITRBWNTN-UHFFFAOYSA-N 0 0 319.838 5.382 20 0 DKADRN CC(C)CCc1ccccc1NC(=O)Nc1cccc2[nH]ccc21 ZINC000575826173 341807058 /nfs/dbraw/zinc/80/70/58/341807058.db2.gz BVPRBRKSGCFRCP-UHFFFAOYSA-N 0 0 321.424 5.401 20 0 DKADRN CSc1ccc(CNCc2c(Cl)cccc2Cl)s1 ZINC000575959073 341817131 /nfs/dbraw/zinc/81/71/31/341817131.db2.gz IAYBWKZCJLTAAB-UHFFFAOYSA-N 0 0 318.294 5.067 20 0 DKADRN CSc1cccc(C)c1NC(=O)c1ccc(C)c(Cl)c1F ZINC000575982501 331790043 /nfs/dbraw/zinc/79/00/43/331790043.db2.gz HHFMFPDCGOHMQJ-UHFFFAOYSA-N 0 0 323.820 5.070 20 0 DKADRN C[C@@H](NCc1nc(C(C)(C)C)cs1)c1cccc(C2CC2)c1 ZINC000576057379 341823206 /nfs/dbraw/zinc/82/32/06/341823206.db2.gz STMSMVKJRIJPMS-CYBMUJFWSA-N 0 0 314.498 5.169 20 0 DKADRN CCC[C@@H](N[C@@H](C)c1c(F)cncc1F)c1ccc(Cl)cc1 ZINC000576059058 341823524 /nfs/dbraw/zinc/82/35/24/341823524.db2.gz BTGDXPHIQZUXHN-MEDUHNTESA-N 0 0 324.802 5.205 20 0 DKADRN Cc1nc(SCc2nc(C3CCCCC3)cs2)oc1C ZINC000576063329 341823733 /nfs/dbraw/zinc/82/37/33/341823733.db2.gz HIGDVEKHJBVPBQ-UHFFFAOYSA-N 0 0 308.472 5.088 20 0 DKADRN CC(C)[C@H](c1noc([C@@H]2CCCS2)n1)c1ccc(Cl)cc1 ZINC000576165159 341830688 /nfs/dbraw/zinc/83/06/88/341830688.db2.gz WLZOMEVOBNGOFQ-KBPBESRZSA-N 0 0 322.861 5.079 20 0 DKADRN CC(C)[C@@H](c1noc([C@H]2CCCS2)n1)c1ccc(Cl)cc1 ZINC000576165162 341830701 /nfs/dbraw/zinc/83/07/01/341830701.db2.gz WLZOMEVOBNGOFQ-ZIAGYGMSSA-N 0 0 322.861 5.079 20 0 DKADRN Cc1cccc(NC(=O)c2ccc(C(C)(F)F)cc2)c1Cl ZINC000576247035 341836027 /nfs/dbraw/zinc/83/60/27/341836027.db2.gz IRBUPRQIVVZNKY-UHFFFAOYSA-N 0 0 309.743 5.012 20 0 DKADRN CC[C@@H](C)c1ccccc1NC(=O)[C@H](C)SCC1CCC1 ZINC000576258734 341836639 /nfs/dbraw/zinc/83/66/39/341836639.db2.gz JQISJVOUOMSUMX-KGLIPLIRSA-N 0 0 305.487 5.060 20 0 DKADRN CC[C@H](C)c1ccccc1NC(=O)[C@@H](C)SCC1CCC1 ZINC000576258735 341836677 /nfs/dbraw/zinc/83/66/77/341836677.db2.gz JQISJVOUOMSUMX-UONOGXRCSA-N 0 0 305.487 5.060 20 0 DKADRN COc1c(C)ccc(N[C@H](C)c2nccc3ccccc32)c1C ZINC000576335030 341840891 /nfs/dbraw/zinc/84/08/91/341840891.db2.gz JYFNPVICCOYZGX-OAHLLOKOSA-N 0 0 306.409 5.033 20 0 DKADRN Cc1ccc(Cl)cc1N(C)C(=O)c1cccc2ccsc21 ZINC000576423355 341845645 /nfs/dbraw/zinc/84/56/45/341845645.db2.gz RGRQPLLTJWSERP-UHFFFAOYSA-N 0 0 315.825 5.140 20 0 DKADRN Cc1csc(C(=O)Nc2ccc(OC(C)C)cc2C)c1Cl ZINC000576444616 341846449 /nfs/dbraw/zinc/84/64/49/341846449.db2.gz KNCQGCBZUHPXDP-UHFFFAOYSA-N 0 0 323.845 5.058 20 0 DKADRN CC[C@@H](CC(=O)Nc1cc(F)ccc1Cl)c1ccccc1 ZINC000576486639 341848902 /nfs/dbraw/zinc/84/89/02/341848902.db2.gz MLDQKFMJULRWIS-LBPRGKRZSA-N 0 0 305.780 5.002 20 0 DKADRN CCCOc1ccccc1N[C@@H](C)c1nccc2ccccc21 ZINC000576507520 341849623 /nfs/dbraw/zinc/84/96/23/341849623.db2.gz CIAXBUCGYNNWBR-HNNXBMFYSA-N 0 0 306.409 5.197 20 0 DKADRN CCCOc1ccccc1N[C@H](C)c1nccc2ccccc21 ZINC000576507521 341849741 /nfs/dbraw/zinc/84/97/41/341849741.db2.gz CIAXBUCGYNNWBR-OAHLLOKOSA-N 0 0 306.409 5.197 20 0 DKADRN Cc1ccc2cccc(N[C@@H](C)c3nccc4ccccc43)c2n1 ZINC000576508132 341849672 /nfs/dbraw/zinc/84/96/72/341849672.db2.gz XHZZUROSIQQMDJ-HNNXBMFYSA-N 0 0 313.404 5.265 20 0 DKADRN Cc1ccc(NC(=O)C2CC2)cc1N[C@@H]1C[C@@H](C)c2ccccc21 ZINC000576546288 341851800 /nfs/dbraw/zinc/85/18/00/341851800.db2.gz OTVGRZJSKQYXTJ-JLTOFOAXSA-N 0 0 320.436 5.004 20 0 DKADRN Cc1ccc(NC(=O)C2CC2)cc1N[C@H]1C[C@@H](C)c2ccccc21 ZINC000576546291 341851762 /nfs/dbraw/zinc/85/17/62/341851762.db2.gz OTVGRZJSKQYXTJ-VLIAUNLRSA-N 0 0 320.436 5.004 20 0 DKADRN CC(C)Sc1ccc(C(=O)Nc2ncsc2C(C)C)cc1 ZINC000576550117 341851932 /nfs/dbraw/zinc/85/19/32/341851932.db2.gz UXCLGLZOIGSNTM-UHFFFAOYSA-N 0 0 320.483 5.019 20 0 DKADRN C[C@@H]1C[C@@H]1c1ccc(CNCc2csc(Cl)c2Cl)o1 ZINC000576689178 341858600 /nfs/dbraw/zinc/85/86/00/341858600.db2.gz WXHBKAVTGKYKAC-KCJUWKMLSA-N 0 0 316.253 5.061 20 0 DKADRN FC(F)c1cc(NCc2ccoc2)c2cc(Cl)ccc2n1 ZINC000576783159 341863095 /nfs/dbraw/zinc/86/30/95/341863095.db2.gz YLUIARHCDXECOX-UHFFFAOYSA-N 0 0 308.715 5.031 20 0 DKADRN O=C(C1CC2(CCC2)C1)N1CCC[C@H]1c1cccc2ccccc21 ZINC000576876781 341867476 /nfs/dbraw/zinc/86/74/76/341867476.db2.gz MQWHOWQNAKVBDC-FQEVSTJZSA-N 0 0 319.448 5.084 20 0 DKADRN 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/nfs/dbraw/zinc/39/64/19/336396419.db2.gz YELQYADDXHTBOW-SFHVURJKSA-N 0 0 314.429 5.218 20 0 DKADRN O=C(Nc1c(Cl)cc(Cl)cc1Cl)[C@@H]1C[C@H]1C1CCC1 ZINC000582363326 336942394 /nfs/dbraw/zinc/94/23/94/336942394.db2.gz RJVGHWGLKVCMHO-VHSXEESVSA-N 0 0 318.631 5.022 20 0 DKADRN Cc1cnc(CNc2ccc(-c3cccc(Cl)c3)cc2C)nc1 ZINC000582385009 336953045 /nfs/dbraw/zinc/95/30/45/336953045.db2.gz JNGWCZYQTYWWKP-UHFFFAOYSA-N 0 0 323.827 5.026 20 0 DKADRN C[C@H](N[C@@H](C)c1ccc(SC2CCCC2)cc1)c1ccon1 ZINC000582388438 336953219 /nfs/dbraw/zinc/95/32/19/336953219.db2.gz NOCMWVUPLSGNLT-KBPBESRZSA-N 0 0 316.470 5.121 20 0 DKADRN C[C@@H](N[C@@H](C)c1ccon1)c1ccc(SC2CCCC2)cc1 ZINC000582388439 336953170 /nfs/dbraw/zinc/95/31/70/336953170.db2.gz NOCMWVUPLSGNLT-KGLIPLIRSA-N 0 0 316.470 5.121 20 0 DKADRN Cc1cccc(NC(=O)[C@@H]2C[C@@H]2c2ccccc2Cl)c1Cl ZINC000582460604 337081942 /nfs/dbraw/zinc/08/19/42/337081942.db2.gz IYSAOHDZDMKFRR-CHWSQXEVSA-N 0 0 320.219 5.044 20 0 DKADRN Cc1cccc(NC(=O)[C@H]2C[C@@H]2c2ccccc2Cl)c1Cl 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CC[C@H]1CCC[C@H](NC(=O)Nc2c(C)cccc2C(C)C)C1 ZINC000582756902 337133555 /nfs/dbraw/zinc/13/35/55/337133555.db2.gz MHUKPMXRIYBMSP-HOTGVXAUSA-N 0 0 302.462 5.209 20 0 DKADRN CC[C@@H]1CCC[C@@H](NC(=O)Nc2c(C)cccc2C(C)C)C1 ZINC000582756903 337133572 /nfs/dbraw/zinc/13/35/72/337133572.db2.gz MHUKPMXRIYBMSP-HZPDHXFCSA-N 0 0 302.462 5.209 20 0 DKADRN CC[C@H]1CCC[C@@H](NC(=O)Nc2c(C)cccc2C(C)C)C1 ZINC000582756904 337133589 /nfs/dbraw/zinc/13/35/89/337133589.db2.gz MHUKPMXRIYBMSP-JKSUJKDBSA-N 0 0 302.462 5.209 20 0 DKADRN Cc1ccc(C)c(C(=O)Nc2cc(C(F)F)ccc2Cl)c1 ZINC000582811283 337183367 /nfs/dbraw/zinc/18/33/67/337183367.db2.gz WHFVICJMBVGMMH-UHFFFAOYSA-N 0 0 309.743 5.147 20 0 DKADRN Cc1ncsc1CNc1ccccc1-c1c(F)cccc1F ZINC000582817702 337197019 /nfs/dbraw/zinc/19/70/19/337197019.db2.gz DKAVZNHBQVZRKV-UHFFFAOYSA-N 0 0 316.376 5.009 20 0 DKADRN c1csc(-c2ccc(-c3nc([C@H]4CCCCS4)no3)o2)c1 ZINC000582817740 337197227 /nfs/dbraw/zinc/19/72/27/337197227.db2.gz HDSLUBHZWGWKRC-CYBMUJFWSA-N 0 0 318.423 5.016 20 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