smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name CCCc1nc2ccc(C)cn2c1Nc1c(C)cccc1C ZINC000000320505 567926903 /nfs/dbraw/zinc/92/69/03/567926903.db2.gz UUENAGOIQUHYMH-UHFFFAOYSA-N 0 1 293.414 4.956 10 0 CJAEMN CCCCOc1ccc(CN2CCCCC2)cc1Cl ZINC000003097377 567851147 /nfs/dbraw/zinc/85/11/47/567851147.db2.gz VPGXBBPXALWGPE-UHFFFAOYSA-N 0 1 281.827 4.505 10 0 CJAEMN CCCCCCSc1nc2ccc(OCC)cc2[nH]1 ZINC000005645730 170123686 /nfs/dbraw/zinc/12/36/86/170123686.db2.gz MTQTUPSHOVZFKS-UHFFFAOYSA-N 0 1 278.421 4.634 10 0 CJAEMN Cc1ccc2nc(COc3cccc4ccccc43)[nH]c2c1 ZINC000005818395 170143564 /nfs/dbraw/zinc/14/35/64/170143564.db2.gz PUHWCMFDNKSPKO-UHFFFAOYSA-N 0 1 288.350 4.604 10 0 CJAEMN Cc1ccc2nc(Cc3cccc4ccccc43)[nH]c2c1 ZINC000005818402 170143757 /nfs/dbraw/zinc/14/37/57/170143757.db2.gz NFWTUIHQPSOQRU-UHFFFAOYSA-N 0 1 272.351 4.615 10 0 CJAEMN CC(C)CNc1cc(-c2ccccc2)nc2ccccc21 ZINC000005962691 170163547 /nfs/dbraw/zinc/16/35/47/170163547.db2.gz IPLMTXFVEDFDHS-UHFFFAOYSA-N 0 1 276.383 4.970 10 0 CJAEMN Cc1ccc(-c2cc(-c3c[nH]c4ccccc34)n[nH]2)cc1 ZINC000006732591 170236027 /nfs/dbraw/zinc/23/60/27/170236027.db2.gz XJUJNQLHZRQSNB-UHFFFAOYSA-N 0 1 273.339 4.533 10 0 CJAEMN CCOc1ccc2nc(-c3ccc(C(C)C)cc3)[nH]c2c1 ZINC000006952792 170258716 /nfs/dbraw/zinc/25/87/16/170258716.db2.gz HQEHJRANQJDHRC-UHFFFAOYSA-N 0 1 280.371 4.752 10 0 CJAEMN C[C@@H](NCc1ccccc1Cl)c1ccc(Cl)cc1 ZINC000019908205 170920186 /nfs/dbraw/zinc/92/01/86/170920186.db2.gz WGXOSZWGTGAOPR-LLVKDONJSA-N 0 1 280.198 4.844 10 0 CJAEMN C[C@@H](N[C@@H]1CCOc2ccccc21)c1ccc(Cl)cc1 ZINC000020122007 171001926 /nfs/dbraw/zinc/00/19/26/171001926.db2.gz BEANGJCCKHOXKD-MLGOLLRUSA-N 0 1 287.790 4.514 10 0 CJAEMN C[C@H](N[C@@H]1CCOc2ccccc21)c1ccc(Cl)cc1 ZINC000020122008 171002144 /nfs/dbraw/zinc/00/21/44/171002144.db2.gz BEANGJCCKHOXKD-BLLLJJGKSA-N 0 1 287.790 4.514 10 0 CJAEMN C[C@@H](N[C@H]1CCOc2ccccc21)c1ccc(Cl)cc1 ZINC000020122009 171001869 /nfs/dbraw/zinc/00/18/69/171001869.db2.gz BEANGJCCKHOXKD-WBMJQRKESA-N 0 1 287.790 4.514 10 0 CJAEMN C[C@H](N[C@H]1CCOc2ccccc21)c1ccc(Cl)cc1 ZINC000020122010 171002162 /nfs/dbraw/zinc/00/21/62/171002162.db2.gz BEANGJCCKHOXKD-LRDDRELGSA-N 0 1 287.790 4.514 10 0 CJAEMN CCCC[C@@H](N[C@@H](C)c1ccccn1)c1ccc(F)cc1 ZINC000020123919 171005869 /nfs/dbraw/zinc/00/58/69/171005869.db2.gz AOTISYRZQRJSHV-KBXCAEBGSA-N 0 1 286.394 4.803 10 0 CJAEMN CCCC[C@H](N[C@@H](C)c1ccccn1)c1ccc(F)cc1 ZINC000020123920 171005561 /nfs/dbraw/zinc/00/55/61/171005561.db2.gz AOTISYRZQRJSHV-KSSFIOAISA-N 0 1 286.394 4.803 10 0 CJAEMN CCCC[C@@H](N[C@H](C)c1ccccn1)c1ccc(F)cc1 ZINC000020123921 171005322 /nfs/dbraw/zinc/00/53/22/171005322.db2.gz AOTISYRZQRJSHV-RDTXWAMCSA-N 0 1 286.394 4.803 10 0 CJAEMN CCCC[C@H](N[C@H](C)c1ccccn1)c1ccc(F)cc1 ZINC000020123922 171005693 /nfs/dbraw/zinc/00/56/93/171005693.db2.gz AOTISYRZQRJSHV-KDOFPFPSSA-N 0 1 286.394 4.803 10 0 CJAEMN C[C@@H](N[C@@H]1CCOc2ccccc21)c1ccccc1Cl ZINC000020124112 171005790 /nfs/dbraw/zinc/00/57/90/171005790.db2.gz WMODAIGHGPAQDH-MLGOLLRUSA-N 0 1 287.790 4.514 10 0 CJAEMN C[C@H](N[C@@H]1CCOc2ccccc21)c1ccccc1Cl ZINC000020124113 171005488 /nfs/dbraw/zinc/00/54/88/171005488.db2.gz WMODAIGHGPAQDH-BLLLJJGKSA-N 0 1 287.790 4.514 10 0 CJAEMN C[C@@H](N[C@H]1CCOc2ccccc21)c1ccccc1Cl ZINC000020124114 171005887 /nfs/dbraw/zinc/00/58/87/171005887.db2.gz WMODAIGHGPAQDH-WBMJQRKESA-N 0 1 287.790 4.514 10 0 CJAEMN C[C@H](N[C@H]1CCOc2ccccc21)c1ccccc1Cl ZINC000020124115 171005607 /nfs/dbraw/zinc/00/56/07/171005607.db2.gz WMODAIGHGPAQDH-LRDDRELGSA-N 0 1 287.790 4.514 10 0 CJAEMN COc1ccccc1[C@@H](C)N[C@@H](C)c1cccc(Cl)c1 ZINC000020124210 171006562 /nfs/dbraw/zinc/00/65/62/171006562.db2.gz UJOSFOGOPSOBBC-QWHCGFSZSA-N 0 1 289.806 4.760 10 0 CJAEMN COc1ccccc1[C@H](C)N[C@@H](C)c1cccc(Cl)c1 ZINC000020124211 171006401 /nfs/dbraw/zinc/00/64/01/171006401.db2.gz UJOSFOGOPSOBBC-STQMWFEESA-N 0 1 289.806 4.760 10 0 CJAEMN Cc1ccc([C@H](C)N[C@@H](C)c2cccc(Cl)c2)o1 ZINC000020124261 171006014 /nfs/dbraw/zinc/00/60/14/171006014.db2.gz UEOVMVVABLBNPE-RYUDHWBXSA-N 0 1 263.768 4.653 10 0 CJAEMN Cc1ccc([C@@H](C)N[C@@H](C)c2cccc(Cl)c2)o1 ZINC000020124263 171006660 /nfs/dbraw/zinc/00/66/60/171006660.db2.gz UEOVMVVABLBNPE-NWDGAFQWSA-N 0 1 263.768 4.653 10 0 CJAEMN C[C@@H](N[C@@H]1CCOc2ccccc21)c1cccc(Cl)c1 ZINC000020124302 171006527 /nfs/dbraw/zinc/00/65/27/171006527.db2.gz FRRNVVPYMQYRSS-MLGOLLRUSA-N 0 1 287.790 4.514 10 0 CJAEMN C[C@H](N[C@@H]1CCOc2ccccc21)c1cccc(Cl)c1 ZINC000020124303 171006294 /nfs/dbraw/zinc/00/62/94/171006294.db2.gz FRRNVVPYMQYRSS-BLLLJJGKSA-N 0 1 287.790 4.514 10 0 CJAEMN C[C@@H](N[C@H]1CCOc2ccccc21)c1cccc(Cl)c1 ZINC000020124304 171006177 /nfs/dbraw/zinc/00/61/77/171006177.db2.gz FRRNVVPYMQYRSS-WBMJQRKESA-N 0 1 287.790 4.514 10 0 CJAEMN C[C@H](N[C@H]1CCOc2ccccc21)c1cccc(Cl)c1 ZINC000020124305 171006425 /nfs/dbraw/zinc/00/64/25/171006425.db2.gz FRRNVVPYMQYRSS-LRDDRELGSA-N 0 1 287.790 4.514 10 0 CJAEMN C[C@@H](N[C@@H](C)c1ccco1)c1ccc(Cl)c(Cl)c1 ZINC000020126064 171009823 /nfs/dbraw/zinc/00/98/23/171009823.db2.gz JDHHLYCOUQUMMJ-ZJUUUORDSA-N 0 1 284.186 4.998 10 0 CJAEMN C[C@H](N[C@@H](C)c1ccc(Cl)c(Cl)c1)c1ccco1 ZINC000020126065 171009460 /nfs/dbraw/zinc/00/94/60/171009460.db2.gz JDHHLYCOUQUMMJ-UWVGGRQHSA-N 0 1 284.186 4.998 10 0 CJAEMN C[C@@H](N[C@H](C)c1ccc(Cl)c(Cl)c1)c1ccco1 ZINC000020126066 171009919 /nfs/dbraw/zinc/00/99/19/171009919.db2.gz JDHHLYCOUQUMMJ-NXEZZACHSA-N 0 1 284.186 4.998 10 0 CJAEMN C[C@@H](N[C@@H](C)c1ccc(Cl)c(Cl)c1)c1ccco1 ZINC000020126067 171009966 /nfs/dbraw/zinc/00/99/66/171009966.db2.gz JDHHLYCOUQUMMJ-VHSXEESVSA-N 0 1 284.186 4.998 10 0 CJAEMN C[C@@H](NCc1cccc(O)c1)c1ccc(Cl)c(Cl)c1 ZINC000020126072 171009394 /nfs/dbraw/zinc/00/93/94/171009394.db2.gz TTZGXJSGDOUORC-SNVBAGLBSA-N 0 1 296.197 4.550 10 0 CJAEMN C[C@H](NCc1cccc(O)c1)c1ccc(Cl)c(Cl)c1 ZINC000020126073 171009444 /nfs/dbraw/zinc/00/94/44/171009444.db2.gz TTZGXJSGDOUORC-JTQLQIEISA-N 0 1 296.197 4.550 10 0 CJAEMN CC[C@@H](NCc1nc2ccccc2s1)c1ccccc1 ZINC000020136093 171023644 /nfs/dbraw/zinc/02/36/44/171023644.db2.gz LMFMBJFWAFQBNZ-CQSZACIVSA-N 0 1 282.412 4.537 10 0 CJAEMN CC[C@H](NCc1nc2ccccc2s1)c1ccccc1 ZINC000020136097 171023874 /nfs/dbraw/zinc/02/38/74/171023874.db2.gz LMFMBJFWAFQBNZ-AWEZNQCLSA-N 0 1 282.412 4.537 10 0 CJAEMN Cc1ccc([C@@H](C)NCc2nc3ccccc3s2)c(C)c1 ZINC000020136233 262193433 /nfs/dbraw/zinc/19/34/33/262193433.db2.gz AIEZMWKYULMBMC-CQSZACIVSA-N 0 1 296.439 4.764 10 0 CJAEMN Cc1ccc([C@H](C)NCc2nc3ccccc3s2)c(C)c1 ZINC000020136237 262230781 /nfs/dbraw/zinc/23/07/81/262230781.db2.gz AIEZMWKYULMBMC-AWEZNQCLSA-N 0 1 296.439 4.764 10 0 CJAEMN Cc1ccc(C)c([C@@H](C)NCc2nc3ccccc3s2)c1 ZINC000020136241 171023981 /nfs/dbraw/zinc/02/39/81/171023981.db2.gz IKXSMSAFNOYGAF-CQSZACIVSA-N 0 1 296.439 4.764 10 0 CJAEMN Cc1ccc(C)c([C@H](C)NCc2nc3ccccc3s2)c1 ZINC000020136244 171024191 /nfs/dbraw/zinc/02/41/91/171024191.db2.gz IKXSMSAFNOYGAF-AWEZNQCLSA-N 0 1 296.439 4.764 10 0 CJAEMN Cc1ccc([C@@H](C)NCc2nc3ccccc3s2)cc1C ZINC000020136311 262230856 /nfs/dbraw/zinc/23/08/56/262230856.db2.gz XYKLDPPWPITOCA-CQSZACIVSA-N 0 1 296.439 4.764 10 0 CJAEMN Cc1ccc([C@H](C)NCc2nc3ccccc3s2)cc1C ZINC000020136315 262230967 /nfs/dbraw/zinc/23/09/67/262230967.db2.gz XYKLDPPWPITOCA-AWEZNQCLSA-N 0 1 296.439 4.764 10 0 CJAEMN CCc1ccc([C@@H](C)NCc2nc3ccccc3s2)cc1 ZINC000020136319 262193571 /nfs/dbraw/zinc/19/35/71/262193571.db2.gz TUXLTEOQZRKJKY-CYBMUJFWSA-N 0 1 296.439 4.710 10 0 CJAEMN CCc1ccc([C@H](C)NCc2nc3ccccc3s2)cc1 ZINC000020136321 262230784 /nfs/dbraw/zinc/23/07/84/262230784.db2.gz TUXLTEOQZRKJKY-ZDUSSCGKSA-N 0 1 296.439 4.710 10 0 CJAEMN CCOc1ccccc1[C@@H](C)N[C@@H](C)c1cccc(F)c1 ZINC000020147964 262194383 /nfs/dbraw/zinc/19/43/83/262194383.db2.gz RAHISEKUDBPRQG-UONOGXRCSA-N 0 1 287.378 4.636 10 0 CJAEMN CCOc1ccccc1[C@H](C)N[C@@H](C)c1cccc(F)c1 ZINC000020147965 171035513 /nfs/dbraw/zinc/03/55/13/171035513.db2.gz RAHISEKUDBPRQG-KBPBESRZSA-N 0 1 287.378 4.636 10 0 CJAEMN CCOc1ccccc1[C@@H](C)N[C@H](C)c1cccc(F)c1 ZINC000020147966 171035267 /nfs/dbraw/zinc/03/52/67/171035267.db2.gz RAHISEKUDBPRQG-ZIAGYGMSSA-N 0 1 287.378 4.636 10 0 CJAEMN CCOc1ccccc1[C@H](C)N[C@H](C)c1cccc(F)c1 ZINC000020147967 262194369 /nfs/dbraw/zinc/19/43/69/262194369.db2.gz RAHISEKUDBPRQG-KGLIPLIRSA-N 0 1 287.378 4.636 10 0 CJAEMN C[C@@H](N[C@@H](C)c1cc(F)ccc1F)c1cccc(F)c1 ZINC000020147968 171035121 /nfs/dbraw/zinc/03/51/21/171035121.db2.gz LWDXSIJXGDINQK-MNOVXSKESA-N 0 1 279.305 4.516 10 0 CJAEMN C[C@H](N[C@@H](C)c1cc(F)ccc1F)c1cccc(F)c1 ZINC000020147969 171035479 /nfs/dbraw/zinc/03/54/79/171035479.db2.gz LWDXSIJXGDINQK-QWRGUYRKSA-N 0 1 279.305 4.516 10 0 CJAEMN C[C@@H](N[C@H](C)c1cc(F)ccc1F)c1cccc(F)c1 ZINC000020147970 171035340 /nfs/dbraw/zinc/03/53/40/171035340.db2.gz LWDXSIJXGDINQK-GHMZBOCLSA-N 0 1 279.305 4.516 10 0 CJAEMN C[C@@H](N[C@@H](C)c1cccc(F)c1)c1cc(F)ccc1F ZINC000020147971 171035604 /nfs/dbraw/zinc/03/56/04/171035604.db2.gz LWDXSIJXGDINQK-WDEREUQCSA-N 0 1 279.305 4.516 10 0 CJAEMN CC(C)c1ccc([C@@H](N)c2cc3ccccc3o2)cc1 ZINC000020369025 171167035 /nfs/dbraw/zinc/16/70/35/171167035.db2.gz GLZQCKIEEWUKTP-GOSISDBHSA-N 0 1 265.356 4.604 10 0 CJAEMN CC(C)c1ccc([C@H](N)c2cc3ccccc3o2)cc1 ZINC000020369028 171166920 /nfs/dbraw/zinc/16/69/20/171166920.db2.gz GLZQCKIEEWUKTP-SFHVURJKSA-N 0 1 265.356 4.604 10 0 CJAEMN CC(C)(C)c1ccc([C@@H](N)c2cc3ccccc3o2)cc1 ZINC000020369076 171166748 /nfs/dbraw/zinc/16/67/48/171166748.db2.gz AMPJAMGNOSJNJU-GOSISDBHSA-N 0 1 279.383 4.778 10 0 CJAEMN CC(C)(C)c1ccc([C@H](N)c2cc3ccccc3o2)cc1 ZINC000020369079 171166982 /nfs/dbraw/zinc/16/69/82/171166982.db2.gz AMPJAMGNOSJNJU-SFHVURJKSA-N 0 1 279.383 4.778 10 0 CJAEMN N[C@@H](c1cc2ccccc2o1)C12CC3CC(CC(C3)C1)C2 ZINC000020369135 171167092 /nfs/dbraw/zinc/16/70/92/171167092.db2.gz VYXZVIAUQLRITG-VLZNNYHMSA-N 0 1 281.399 4.649 10 0 CJAEMN N[C@H](c1cc2ccccc2o1)C12CC3CC(CC(C3)C1)C2 ZINC000020369139 171166808 /nfs/dbraw/zinc/16/68/08/171166808.db2.gz VYXZVIAUQLRITG-HPXCNGPASA-N 0 1 281.399 4.649 10 0 CJAEMN N[C@@H](c1cc2ccccc2o1)c1cccc2ccccc21 ZINC000020369333 171166826 /nfs/dbraw/zinc/16/68/26/171166826.db2.gz PNHJFIGCVQYISY-LJQANCHMSA-N 0 1 273.335 4.634 10 0 CJAEMN N[C@H](c1cc2ccccc2o1)c1cccc2ccccc21 ZINC000020369336 171166926 /nfs/dbraw/zinc/16/69/26/171166926.db2.gz PNHJFIGCVQYISY-IBGZPJMESA-N 0 1 273.335 4.634 10 0 CJAEMN N[C@H](c1ccc(Cl)s1)c1ccc(Cl)c(Cl)c1 ZINC000020375076 171169983 /nfs/dbraw/zinc/16/99/83/171169983.db2.gz PIDFVMIUGUIPLC-NSHDSACASA-N 0 1 292.618 4.756 10 0 CJAEMN N[C@@H](c1ccc(Cl)s1)c1ccc(Cl)c(Cl)c1 ZINC000020375079 171170010 /nfs/dbraw/zinc/17/00/10/171170010.db2.gz PIDFVMIUGUIPLC-LLVKDONJSA-N 0 1 292.618 4.756 10 0 CJAEMN N[C@@H](c1ccc(Cl)s1)c1ccc(Cl)cc1Cl ZINC000020375090 171170419 /nfs/dbraw/zinc/17/04/19/171170419.db2.gz JJKRUDQURKZINX-LLVKDONJSA-N 0 1 292.618 4.756 10 0 CJAEMN N[C@H](c1ccc(Cl)s1)c1ccc(Cl)cc1Cl ZINC000020375093 171170376 /nfs/dbraw/zinc/17/03/76/171170376.db2.gz JJKRUDQURKZINX-NSHDSACASA-N 0 1 292.618 4.756 10 0 CJAEMN N[C@H](c1ccc(Cl)s1)c1cc(Cl)cc(Cl)c1 ZINC000020375161 171170557 /nfs/dbraw/zinc/17/05/57/171170557.db2.gz IMNCWYWKKONHEG-NSHDSACASA-N 0 1 292.618 4.756 10 0 CJAEMN N[C@@H](c1ccc(Cl)s1)c1cc(Cl)cc(Cl)c1 ZINC000020375164 171170626 /nfs/dbraw/zinc/17/06/26/171170626.db2.gz IMNCWYWKKONHEG-LLVKDONJSA-N 0 1 292.618 4.756 10 0 CJAEMN N[C@@H](c1ccc(Cl)s1)c1cccc(Cl)c1Cl ZINC000020375216 171169989 /nfs/dbraw/zinc/16/99/89/171169989.db2.gz ACWJOCYKGSEQHN-LLVKDONJSA-N 0 1 292.618 4.756 10 0 CJAEMN N[C@H](c1ccc(Cl)s1)c1cccc(Cl)c1Cl ZINC000020375220 171170609 /nfs/dbraw/zinc/17/06/09/171170609.db2.gz ACWJOCYKGSEQHN-NSHDSACASA-N 0 1 292.618 4.756 10 0 CJAEMN N[C@@H](c1ccc(Cl)s1)c1c(Cl)cccc1Cl ZINC000020375224 171170643 /nfs/dbraw/zinc/17/06/43/171170643.db2.gz XQDWZLVGIGWXPE-NSHDSACASA-N 0 1 292.618 4.756 10 0 CJAEMN N[C@H](c1ccc(Cl)s1)c1c(Cl)cccc1Cl ZINC000020375228 171170619 /nfs/dbraw/zinc/17/06/19/171170619.db2.gz XQDWZLVGIGWXPE-LLVKDONJSA-N 0 1 292.618 4.756 10 0 CJAEMN N[C@@H](c1ccc(Cl)s1)c1cc(Cl)ccc1Cl ZINC000020375255 171170553 /nfs/dbraw/zinc/17/05/53/171170553.db2.gz RBGHQYSLURVJRE-LLVKDONJSA-N 0 1 292.618 4.756 10 0 CJAEMN N[C@H](c1ccc(Cl)s1)c1cc(Cl)ccc1Cl ZINC000020375259 171170352 /nfs/dbraw/zinc/17/03/52/171170352.db2.gz RBGHQYSLURVJRE-NSHDSACASA-N 0 1 292.618 4.756 10 0 CJAEMN CC(C)c1ccc2oc([C@@H](N)c3ccccc3)cc2c1 ZINC000020389522 171178271 /nfs/dbraw/zinc/17/82/71/171178271.db2.gz KEAOMUDLIYZVRP-SFHVURJKSA-N 0 1 265.356 4.604 10 0 CJAEMN CC(C)c1ccc2oc([C@H](N)c3ccccc3)cc2c1 ZINC000020389527 171178262 /nfs/dbraw/zinc/17/82/62/171178262.db2.gz KEAOMUDLIYZVRP-GOSISDBHSA-N 0 1 265.356 4.604 10 0 CJAEMN Cc1ccc([C@H](N)c2cc3cc(C(C)C)ccc3o2)cc1 ZINC000020389532 171178112 /nfs/dbraw/zinc/17/81/12/171178112.db2.gz NIUYUNWCZGZLJJ-IBGZPJMESA-N 0 1 279.383 4.913 10 0 CJAEMN Cc1ccc([C@@H](N)c2cc3cc(C(C)C)ccc3o2)cc1 ZINC000020389537 171178382 /nfs/dbraw/zinc/17/83/82/171178382.db2.gz NIUYUNWCZGZLJJ-LJQANCHMSA-N 0 1 279.383 4.913 10 0 CJAEMN C[C@@H](NCc1cccc(F)c1)c1cc(Cl)ccc1Cl ZINC000020473404 171217636 /nfs/dbraw/zinc/21/76/36/171217636.db2.gz ZIRDLKNOWAERBN-SNVBAGLBSA-N 0 1 298.188 4.983 10 0 CJAEMN C[C@H](NCc1cccc(F)c1)c1cc(Cl)ccc1Cl ZINC000020473405 171217700 /nfs/dbraw/zinc/21/77/00/171217700.db2.gz ZIRDLKNOWAERBN-JTQLQIEISA-N 0 1 298.188 4.983 10 0 CJAEMN Cc1ccc([C@@H](C)NCc2ccccc2Cl)cc1C ZINC000020545941 262249106 /nfs/dbraw/zinc/24/91/06/262249106.db2.gz QSCAMALGHKFVHZ-CQSZACIVSA-N 0 1 273.807 4.808 10 0 CJAEMN Cc1ccc(C)c([C@@H](C)NCc2ccccc2Cl)c1 ZINC000020546658 171244168 /nfs/dbraw/zinc/24/41/68/171244168.db2.gz YEUAENGQLARZDG-CQSZACIVSA-N 0 1 273.807 4.808 10 0 CJAEMN Cc1ccc(C)c([C@H](C)NCc2ccccc2Cl)c1 ZINC000020546659 171244008 /nfs/dbraw/zinc/24/40/08/171244008.db2.gz YEUAENGQLARZDG-AWEZNQCLSA-N 0 1 273.807 4.808 10 0 CJAEMN C[C@@H](NCc1cccc(Cl)c1Cl)c1ccc(F)cc1 ZINC000020548299 171245504 /nfs/dbraw/zinc/24/55/04/171245504.db2.gz PIUTWWYQNNEDOO-SNVBAGLBSA-N 0 1 298.188 4.983 10 0 CJAEMN C[C@H](NCc1cccc(Cl)c1Cl)c1ccc(F)cc1 ZINC000020548300 171245398 /nfs/dbraw/zinc/24/53/98/171245398.db2.gz PIUTWWYQNNEDOO-JTQLQIEISA-N 0 1 298.188 4.983 10 0 CJAEMN C[C@@H](NCc1ccccc1F)c1ccc(C(C)(C)C)cc1 ZINC000020559825 171251606 /nfs/dbraw/zinc/25/16/06/171251606.db2.gz ILIYRXPKKUHMBK-CQSZACIVSA-N 0 1 285.406 4.974 10 0 CJAEMN C[C@H](NCc1ccccc1F)c1ccc(C(C)(C)C)cc1 ZINC000020559827 171251322 /nfs/dbraw/zinc/25/13/22/171251322.db2.gz ILIYRXPKKUHMBK-AWEZNQCLSA-N 0 1 285.406 4.974 10 0 CJAEMN CCc1ccc(CN[C@@H](C)c2ccccc2Cl)cc1 ZINC000020561444 171251793 /nfs/dbraw/zinc/25/17/93/171251793.db2.gz HDVNACVCHUPNAO-ZDUSSCGKSA-N 0 1 273.807 4.753 10 0 CJAEMN CCc1ccc(CN[C@H](C)c2ccccc2Cl)cc1 ZINC000020561447 171251766 /nfs/dbraw/zinc/25/17/66/171251766.db2.gz HDVNACVCHUPNAO-CYBMUJFWSA-N 0 1 273.807 4.753 10 0 CJAEMN C[C@H]1C[C@@H]1c1ccc(CN[C@@H]2CCCc3ccccc32)o1 ZINC000020564791 171253705 /nfs/dbraw/zinc/25/37/05/171253705.db2.gz DWRSGNWJNHTMGA-DOPJRALCSA-N 0 1 281.399 4.570 10 0 CJAEMN C[C@H]1C[C@H]1c1ccc(CN[C@@H]2CCCc3ccccc32)o1 ZINC000020564795 171253589 /nfs/dbraw/zinc/25/35/89/171253589.db2.gz DWRSGNWJNHTMGA-MORSLUCNSA-N 0 1 281.399 4.570 10 0 CJAEMN CC(C)(C)c1nc2ccc(NCc3cccs3)cc2[nH]1 ZINC000020567113 171255083 /nfs/dbraw/zinc/25/50/83/171255083.db2.gz JYDKGLOTAFUSDC-UHFFFAOYSA-N 0 1 285.416 4.534 10 0 CJAEMN Cc1ccc(C)c([C@@H](N)c2cc3cc(Cl)ccc3o2)c1 ZINC000020592820 171262162 /nfs/dbraw/zinc/26/21/62/171262162.db2.gz IQRIJHWSWAQIIT-QGZVFWFLSA-N 0 1 285.774 4.751 10 0 CJAEMN Cc1ccc(C)c([C@H](N)c2cc3cc(Cl)ccc3o2)c1 ZINC000020592821 171262104 /nfs/dbraw/zinc/26/21/04/171262104.db2.gz IQRIJHWSWAQIIT-KRWDZBQOSA-N 0 1 285.774 4.751 10 0 CJAEMN Cc1ccc([C@@H](N)c2cc3cc(Cl)ccc3o2)c(C)c1 ZINC000020592826 171262074 /nfs/dbraw/zinc/26/20/74/171262074.db2.gz GDANNDKHRMXQOJ-QGZVFWFLSA-N 0 1 285.774 4.751 10 0 CJAEMN Cc1ccc([C@H](N)c2cc3cc(Cl)ccc3o2)c(C)c1 ZINC000020592827 171262045 /nfs/dbraw/zinc/26/20/45/171262045.db2.gz GDANNDKHRMXQOJ-KRWDZBQOSA-N 0 1 285.774 4.751 10 0 CJAEMN CCc1ccc([C@@H](N)c2cc3cc(Cl)ccc3o2)cc1 ZINC000020592830 171262709 /nfs/dbraw/zinc/26/27/09/171262709.db2.gz QFESUWNODPIGSI-QGZVFWFLSA-N 0 1 285.774 4.697 10 0 CJAEMN CCc1ccc([C@H](N)c2cc3cc(Cl)ccc3o2)cc1 ZINC000020592831 171262517 /nfs/dbraw/zinc/26/25/17/171262517.db2.gz QFESUWNODPIGSI-KRWDZBQOSA-N 0 1 285.774 4.697 10 0 CJAEMN Cc1ccc([C@@H](N)c2cc3cc(Cl)ccc3o2)cc1C ZINC000020592842 171262412 /nfs/dbraw/zinc/26/24/12/171262412.db2.gz KVEPMLSIRXZQHX-QGZVFWFLSA-N 0 1 285.774 4.751 10 0 CJAEMN Cc1ccc([C@H](N)c2cc3cc(Cl)ccc3o2)cc1C ZINC000020592843 171262597 /nfs/dbraw/zinc/26/25/97/171262597.db2.gz KVEPMLSIRXZQHX-KRWDZBQOSA-N 0 1 285.774 4.751 10 0 CJAEMN Cc1c2ccccc2oc1[C@H](N)c1ccc(C(C)C)cc1 ZINC000020592876 171262480 /nfs/dbraw/zinc/26/24/80/171262480.db2.gz GJQNZGHWMWABSJ-GOSISDBHSA-N 0 1 279.383 4.913 10 0 CJAEMN Cc1c2ccccc2oc1[C@@H](N)c1ccc(C(C)C)cc1 ZINC000020592877 171262679 /nfs/dbraw/zinc/26/26/79/171262679.db2.gz GJQNZGHWMWABSJ-SFHVURJKSA-N 0 1 279.383 4.913 10 0 CJAEMN Cc1c2cc(Br)ccc2oc1[C@@H](N)C(C)(C)C ZINC000020593040 171262399 /nfs/dbraw/zinc/26/23/99/171262399.db2.gz FQNRQRXFBWKRQN-CYBMUJFWSA-N 0 1 296.208 4.550 10 0 CJAEMN Cc1c2cc(Br)ccc2oc1[C@H](N)C(C)(C)C ZINC000020593041 171262462 /nfs/dbraw/zinc/26/24/62/171262462.db2.gz FQNRQRXFBWKRQN-ZDUSSCGKSA-N 0 1 296.208 4.550 10 0 CJAEMN CC(C)(C)[C@@H](N)c1cc2cc(Cl)cc(Cl)c2o1 ZINC000020593114 171262456 /nfs/dbraw/zinc/26/24/56/171262456.db2.gz HUYQGPHTKWYGPR-LBPRGKRZSA-N 0 1 272.175 4.786 10 0 CJAEMN CC(C)(C)[C@H](N)c1cc2cc(Cl)cc(Cl)c2o1 ZINC000020593115 171262506 /nfs/dbraw/zinc/26/25/06/171262506.db2.gz HUYQGPHTKWYGPR-GFCCVEGCSA-N 0 1 272.175 4.786 10 0 CJAEMN N[C@@H](c1csc2ccccc21)c1c(F)cccc1Cl ZINC000020596409 171265243 /nfs/dbraw/zinc/26/52/43/171265243.db2.gz VQDAZLNIMPHQOI-HNNXBMFYSA-N 0 1 291.778 4.742 10 0 CJAEMN N[C@H](c1csc2ccccc21)c1c(F)cccc1Cl ZINC000020596410 171265224 /nfs/dbraw/zinc/26/52/24/171265224.db2.gz VQDAZLNIMPHQOI-OAHLLOKOSA-N 0 1 291.778 4.742 10 0 CJAEMN COc1ccc(Cl)cc1-c1nc2ccc(Cl)cc2[nH]1 ZINC000021005461 171284919 /nfs/dbraw/zinc/28/49/19/171284919.db2.gz YZODSEAIMRMKPD-UHFFFAOYSA-N 0 1 293.153 4.545 10 0 CJAEMN Cc1ccc([C@@H](C)NCc2ccccc2Cl)c(C)c1 ZINC000021012651 171288045 /nfs/dbraw/zinc/28/80/45/171288045.db2.gz FHHLNKIXMRHORQ-CQSZACIVSA-N 0 1 273.807 4.808 10 0 CJAEMN Cc1ccc([C@H](C)NCc2ccccc2Cl)c(C)c1 ZINC000021012652 171287872 /nfs/dbraw/zinc/28/78/72/171287872.db2.gz FHHLNKIXMRHORQ-AWEZNQCLSA-N 0 1 273.807 4.808 10 0 CJAEMN C[C@@H](NCc1ccccc1F)c1ccc2c(c1)CCCC2 ZINC000021013025 171288479 /nfs/dbraw/zinc/28/84/79/171288479.db2.gz XNDIHELWLYLZMU-CQSZACIVSA-N 0 1 283.390 4.555 10 0 CJAEMN C[C@H](NCc1ccccc1F)c1ccc2c(c1)CCCC2 ZINC000021013026 171288535 /nfs/dbraw/zinc/28/85/35/171288535.db2.gz XNDIHELWLYLZMU-AWEZNQCLSA-N 0 1 283.390 4.555 10 0 CJAEMN CCc1ccc([C@@H](C)NCc2ccccc2Cl)cc1 ZINC000021040450 171293491 /nfs/dbraw/zinc/29/34/91/171293491.db2.gz WYTSOKVXZMQDOO-CYBMUJFWSA-N 0 1 273.807 4.753 10 0 CJAEMN CCc1ccc([C@H](C)NCc2ccccc2Cl)cc1 ZINC000021040456 171293505 /nfs/dbraw/zinc/29/35/05/171293505.db2.gz WYTSOKVXZMQDOO-ZDUSSCGKSA-N 0 1 273.807 4.753 10 0 CJAEMN C[C@@H](NCc1ccc(F)cc1)c1ccc(Cl)cc1Cl ZINC000021048145 171294358 /nfs/dbraw/zinc/29/43/58/171294358.db2.gz DKXBWWHDCPQAMD-SNVBAGLBSA-N 0 1 298.188 4.983 10 0 CJAEMN C[C@H](NCc1ccc(F)cc1)c1ccc(Cl)cc1Cl ZINC000021048150 171294478 /nfs/dbraw/zinc/29/44/78/171294478.db2.gz DKXBWWHDCPQAMD-JTQLQIEISA-N 0 1 298.188 4.983 10 0 CJAEMN Cc1ccc(CN[C@H](C)c2ccccc2Cl)c(C)c1 ZINC000021049234 171294870 /nfs/dbraw/zinc/29/48/70/171294870.db2.gz WGBMSHQSKUNZJS-CQSZACIVSA-N 0 1 273.807 4.808 10 0 CJAEMN Cc1ccc(CN[C@@H](C)c2ccccc2Cl)c(C)c1 ZINC000021049240 171294902 /nfs/dbraw/zinc/29/49/02/171294902.db2.gz WGBMSHQSKUNZJS-AWEZNQCLSA-N 0 1 273.807 4.808 10 0 CJAEMN C[C@@H](NCc1cccc(F)c1)c1ccc(Cl)cc1Cl ZINC000021507206 171308457 /nfs/dbraw/zinc/30/84/57/171308457.db2.gz YNNALYWYDSLMNQ-SNVBAGLBSA-N 0 1 298.188 4.983 10 0 CJAEMN C[C@H](NCc1cccc(F)c1)c1ccc(Cl)cc1Cl ZINC000021507208 171308407 /nfs/dbraw/zinc/30/84/07/171308407.db2.gz YNNALYWYDSLMNQ-JTQLQIEISA-N 0 1 298.188 4.983 10 0 CJAEMN Cc1ccccc1[C@@H](C)N[C@@H](C)c1cc(F)ccc1F ZINC000021509460 171309770 /nfs/dbraw/zinc/30/97/70/171309770.db2.gz YVNSFOGDMZSZDU-OLZOCXBDSA-N 0 1 275.342 4.685 10 0 CJAEMN Cc1ccccc1[C@H](C)N[C@@H](C)c1cc(F)ccc1F ZINC000021509461 171309563 /nfs/dbraw/zinc/30/95/63/171309563.db2.gz YVNSFOGDMZSZDU-STQMWFEESA-N 0 1 275.342 4.685 10 0 CJAEMN Cc1ccccc1[C@@H](C)N[C@H](C)c1cc(F)ccc1F ZINC000021509463 171309716 /nfs/dbraw/zinc/30/97/16/171309716.db2.gz YVNSFOGDMZSZDU-CHWSQXEVSA-N 0 1 275.342 4.685 10 0 CJAEMN Cc1ccccc1[C@H](C)N[C@H](C)c1cc(F)ccc1F ZINC000021509465 171309697 /nfs/dbraw/zinc/30/96/97/171309697.db2.gz YVNSFOGDMZSZDU-QWHCGFSZSA-N 0 1 275.342 4.685 10 0 CJAEMN C[C@@H](NCc1ccc(F)cc1)c1cc(Cl)ccc1Cl ZINC000021511750 171310408 /nfs/dbraw/zinc/31/04/08/171310408.db2.gz QWPBXWHXUZFPQR-SNVBAGLBSA-N 0 1 298.188 4.983 10 0 CJAEMN C[C@H](NCc1ccc(F)cc1)c1cc(Cl)ccc1Cl ZINC000021511752 171310668 /nfs/dbraw/zinc/31/06/68/171310668.db2.gz QWPBXWHXUZFPQR-JTQLQIEISA-N 0 1 298.188 4.983 10 0 CJAEMN C[C@@H](NCc1ccc(Cl)cc1Cl)c1ccc(F)cc1 ZINC000021514888 171311851 /nfs/dbraw/zinc/31/18/51/171311851.db2.gz BAXCJZQBDQQXLJ-SNVBAGLBSA-N 0 1 298.188 4.983 10 0 CJAEMN C[C@H](NCc1ccc(Cl)cc1Cl)c1ccc(F)cc1 ZINC000021514890 171312041 /nfs/dbraw/zinc/31/20/41/171312041.db2.gz BAXCJZQBDQQXLJ-JTQLQIEISA-N 0 1 298.188 4.983 10 0 CJAEMN C[C@@H](NCc1ccc(Cl)cc1Cl)c1cccc(F)c1 ZINC000021516544 171312756 /nfs/dbraw/zinc/31/27/56/171312756.db2.gz VNNLAPDJQFQISV-SNVBAGLBSA-N 0 1 298.188 4.983 10 0 CJAEMN C[C@H](NCc1ccc(Cl)cc1Cl)c1cccc(F)c1 ZINC000021516545 171312989 /nfs/dbraw/zinc/31/29/89/171312989.db2.gz VNNLAPDJQFQISV-JTQLQIEISA-N 0 1 298.188 4.983 10 0 CJAEMN CC(C)c1ccc([C@@H](C)NCc2ccccc2F)cc1 ZINC000021801808 171326160 /nfs/dbraw/zinc/32/61/60/171326160.db2.gz VXRVEBAHLFMZOM-CQSZACIVSA-N 0 1 271.379 4.800 10 0 CJAEMN CC(C)c1ccc([C@H](C)NCc2ccccc2F)cc1 ZINC000021801811 171326073 /nfs/dbraw/zinc/32/60/73/171326073.db2.gz VXRVEBAHLFMZOM-AWEZNQCLSA-N 0 1 271.379 4.800 10 0 CJAEMN CC(C)(C)c1nc2ccc(NCC3CCCCC3)cc2[nH]1 ZINC000021820112 171334479 /nfs/dbraw/zinc/33/44/79/171334479.db2.gz MMGBOHPGAMCVHX-UHFFFAOYSA-N 0 1 285.435 4.853 10 0 CJAEMN CC(C)(C)c1nc2cc(NCC3CCCCC3)ccc2[nH]1 ZINC000021820112 171334477 /nfs/dbraw/zinc/33/44/77/171334477.db2.gz MMGBOHPGAMCVHX-UHFFFAOYSA-N 0 1 285.435 4.853 10 0 CJAEMN CC(C)c1ccc([C@@H](C)NCc2ccc(F)cc2F)cc1 ZINC000034992150 171918436 /nfs/dbraw/zinc/91/84/36/171918436.db2.gz JZFISUQISCYVGS-CYBMUJFWSA-N 0 1 289.369 4.939 10 0 CJAEMN CC(C)c1ccc(CN[C@@H](C)c2ccc(F)cc2F)cc1 ZINC000034993085 171920938 /nfs/dbraw/zinc/92/09/38/171920938.db2.gz NLGMFLDXVOVYAR-ZDUSSCGKSA-N 0 1 289.369 4.939 10 0 CJAEMN Cc1cc(C)c(CN[C@@H](C)c2ccc(F)cc2F)cc1C ZINC000034993129 328838051 /nfs/dbraw/zinc/83/80/51/328838051.db2.gz DFJZJIFECWWGIZ-AWEZNQCLSA-N 0 1 289.369 4.741 10 0 CJAEMN CC(C)C[C@@H](NCc1c(F)cccc1F)c1ccccc1 ZINC000034993435 171920754 /nfs/dbraw/zinc/92/07/54/171920754.db2.gz SHGASAVCSHNZCJ-GOSISDBHSA-N 0 1 289.369 4.842 10 0 CJAEMN Cc1cccc(CN[C@@H](c2cccs2)c2ccccc2)c1 ZINC000035012211 171929723 /nfs/dbraw/zinc/92/97/23/171929723.db2.gz VBXKQFIAULKTSG-LJQANCHMSA-N 0 1 293.435 4.936 10 0 CJAEMN CCc1oc2ccccc2c1CN[C@@H](C)c1ccc(C)o1 ZINC000035017927 171935115 /nfs/dbraw/zinc/93/51/15/171935115.db2.gz HKXDLNITAKRJRS-ZDUSSCGKSA-N 0 1 283.371 4.747 10 0 CJAEMN N[C@@H](c1ccc(Cl)s1)c1cc2c(s1)CCCCC2 ZINC000035081699 519109589 /nfs/dbraw/zinc/10/95/89/519109589.db2.gz FYMGKTNCPVDGHF-AWEZNQCLSA-N 0 1 297.876 4.780 10 0 CJAEMN C[C@H](NCc1ccc(-c2ccccc2)cc1)c1ccco1 ZINC000035136921 172003803 /nfs/dbraw/zinc/00/38/03/172003803.db2.gz GFJMQIMHUXHLFD-HNNXBMFYSA-N 0 1 277.367 4.797 10 0 CJAEMN C[C@@H](NCc1ccc(-c2ccccc2)cc1)c1ccco1 ZINC000035136923 172003633 /nfs/dbraw/zinc/00/36/33/172003633.db2.gz GFJMQIMHUXHLFD-OAHLLOKOSA-N 0 1 277.367 4.797 10 0 CJAEMN COc1ccc(C)cc1CN[C@@H](C)c1cccc(Cl)c1 ZINC000035162023 330242963 /nfs/dbraw/zinc/24/29/63/330242963.db2.gz AYXRODPWVRFJRW-ZDUSSCGKSA-N 0 1 289.806 4.508 10 0 CJAEMN COc1ccc(C)cc1CN[C@@H](C)c1ccc(Cl)cc1 ZINC000035162047 172021983 /nfs/dbraw/zinc/02/19/83/172021983.db2.gz ZXRMLXOBRLACHC-ZDUSSCGKSA-N 0 1 289.806 4.508 10 0 CJAEMN COc1ccc(C)cc1CN[C@H](C)c1ccc(Cl)cc1 ZINC000035162048 172022130 /nfs/dbraw/zinc/02/21/30/172022130.db2.gz ZXRMLXOBRLACHC-CYBMUJFWSA-N 0 1 289.806 4.508 10 0 CJAEMN Fc1ccc(CN[C@H]2CCCc3ccccc32)c(Cl)c1 ZINC000035180085 172033310 /nfs/dbraw/zinc/03/33/10/172033310.db2.gz KMKNTVOIYKRVJD-KRWDZBQOSA-N 0 1 289.781 4.646 10 0 CJAEMN Fc1ccc(CN[C@@H]2CCCc3ccccc32)c(Cl)c1 ZINC000035180086 172033623 /nfs/dbraw/zinc/03/36/23/172033623.db2.gz KMKNTVOIYKRVJD-QGZVFWFLSA-N 0 1 289.781 4.646 10 0 CJAEMN Cc1cc(Nc2ccc(F)c(Cl)c2)c2ccccc2n1 ZINC000035206359 172049908 /nfs/dbraw/zinc/04/99/08/172049908.db2.gz QUSCVBVEPNMKFD-UHFFFAOYSA-N 0 1 286.737 4.501 10 0 CJAEMN C[C@H](NCc1ccc(F)c(F)c1)c1ccc(Cl)s1 ZINC000035253390 172083074 /nfs/dbraw/zinc/08/30/74/172083074.db2.gz WCDWWLCAZVCKIA-QMMMGPOBSA-N 0 1 287.762 4.531 10 0 CJAEMN C[C@@H](NCc1ccc(F)c(F)c1)c1ccc(Cl)s1 ZINC000035253392 172083343 /nfs/dbraw/zinc/08/33/43/172083343.db2.gz WCDWWLCAZVCKIA-MRVPVSSYSA-N 0 1 287.762 4.531 10 0 CJAEMN C[C@H](NCc1ccc(F)cc1F)c1ccc(Cl)s1 ZINC000035253459 172083350 /nfs/dbraw/zinc/08/33/50/172083350.db2.gz WWYMYXFDTOOMGW-QMMMGPOBSA-N 0 1 287.762 4.531 10 0 CJAEMN C[C@@H](NCc1ccc(F)cc1F)c1ccc(Cl)s1 ZINC000035253460 172083602 /nfs/dbraw/zinc/08/36/02/172083602.db2.gz WWYMYXFDTOOMGW-MRVPVSSYSA-N 0 1 287.762 4.531 10 0 CJAEMN COc1ccccc1[C@H](C)N[C@@H](C)c1ccc(Cl)s1 ZINC000035286020 330245626 /nfs/dbraw/zinc/24/56/26/330245626.db2.gz CNLRNIYXNKLWCR-QWRGUYRKSA-N 0 1 295.835 4.822 10 0 CJAEMN COc1ccccc1[C@@H](C)N[C@@H](C)c1ccc(Cl)s1 ZINC000035286022 330245514 /nfs/dbraw/zinc/24/55/14/330245514.db2.gz CNLRNIYXNKLWCR-MNOVXSKESA-N 0 1 295.835 4.822 10 0 CJAEMN COc1ccccc1[C@H](C)N[C@H](C)c1ccc(Cl)s1 ZINC000035286023 330245487 /nfs/dbraw/zinc/24/54/87/330245487.db2.gz CNLRNIYXNKLWCR-WDEREUQCSA-N 0 1 295.835 4.822 10 0 CJAEMN COc1ccccc1[C@@H](C)N[C@H](C)c1ccc(Cl)s1 ZINC000035286025 330245733 /nfs/dbraw/zinc/24/57/33/330245733.db2.gz CNLRNIYXNKLWCR-GHMZBOCLSA-N 0 1 295.835 4.822 10 0 CJAEMN CCCC[C@H](N)c1nc2cc(C(F)(F)F)ccc2s1 ZINC000035411282 172182695 /nfs/dbraw/zinc/18/26/95/172182695.db2.gz ZFZVJEAKCJCCIB-VIFPVBQESA-N 0 1 288.338 4.505 10 0 CJAEMN CCCC[C@@H](N)c1nc2cc(C(F)(F)F)ccc2s1 ZINC000035411283 172182766 /nfs/dbraw/zinc/18/27/66/172182766.db2.gz ZFZVJEAKCJCCIB-SECBINFHSA-N 0 1 288.338 4.505 10 0 CJAEMN CN[C@@H](c1ccc(C)c(C)c1)c1c(Cl)cccc1Cl ZINC000035457873 172207298 /nfs/dbraw/zinc/20/72/98/172207298.db2.gz MBAXYFNZMVQBBB-INIZCTEOSA-N 0 1 294.225 4.919 10 0 CJAEMN CN[C@H](c1ccc(C)c(C)c1)c1c(Cl)cccc1Cl ZINC000035457877 172207378 /nfs/dbraw/zinc/20/73/78/172207378.db2.gz MBAXYFNZMVQBBB-MRXNPFEDSA-N 0 1 294.225 4.919 10 0 CJAEMN CN[C@@H](c1ccc(C)s1)c1c(Cl)cccc1Cl ZINC000035459374 172208149 /nfs/dbraw/zinc/20/81/49/172208149.db2.gz ZRXPMWVRZDBQCQ-ZDUSSCGKSA-N 0 1 286.227 4.672 10 0 CJAEMN CN[C@H](c1ccc(C)s1)c1c(Cl)cccc1Cl ZINC000035459376 172208432 /nfs/dbraw/zinc/20/84/32/172208432.db2.gz ZRXPMWVRZDBQCQ-CYBMUJFWSA-N 0 1 286.227 4.672 10 0 CJAEMN CN[C@@H](c1ccc(C)cc1)c1ccc(Cl)cc1Cl ZINC000035466099 172214013 /nfs/dbraw/zinc/21/40/13/172214013.db2.gz VRTGHCBQEXXGOU-HNNXBMFYSA-N 0 1 280.198 4.611 10 0 CJAEMN CN[C@H](c1ccc(C)cc1)c1ccc(Cl)cc1Cl ZINC000035466101 172213819 /nfs/dbraw/zinc/21/38/19/172213819.db2.gz VRTGHCBQEXXGOU-OAHLLOKOSA-N 0 1 280.198 4.611 10 0 CJAEMN CN[C@@H](c1ccc(C)cc1)c1cccc(Cl)c1Cl ZINC000035466350 172214071 /nfs/dbraw/zinc/21/40/71/172214071.db2.gz RLYWZBCWTBFHSC-HNNXBMFYSA-N 0 1 280.198 4.611 10 0 CJAEMN CN[C@H](c1ccc(C)cc1)c1cccc(Cl)c1Cl ZINC000035466351 172214020 /nfs/dbraw/zinc/21/40/20/172214020.db2.gz RLYWZBCWTBFHSC-OAHLLOKOSA-N 0 1 280.198 4.611 10 0 CJAEMN CN[C@@H](c1ccc(C)cc1)c1c(Cl)cccc1Cl ZINC000035466354 172213881 /nfs/dbraw/zinc/21/38/81/172213881.db2.gz WICWIJWYBJWJAT-HNNXBMFYSA-N 0 1 280.198 4.611 10 0 CJAEMN CN[C@H](c1ccc(C)cc1)c1c(Cl)cccc1Cl ZINC000035466355 172213490 /nfs/dbraw/zinc/21/34/90/172213490.db2.gz WICWIJWYBJWJAT-OAHLLOKOSA-N 0 1 280.198 4.611 10 0 CJAEMN CN[C@@H](c1ccc(C)cc1)c1cc(Cl)ccc1Cl ZINC000035466364 172213794 /nfs/dbraw/zinc/21/37/94/172213794.db2.gz RVGVIFIPWKUCBE-HNNXBMFYSA-N 0 1 280.198 4.611 10 0 CJAEMN CN[C@H](c1ccc(C)cc1)c1cc(Cl)ccc1Cl ZINC000035466365 172213474 /nfs/dbraw/zinc/21/34/74/172213474.db2.gz RVGVIFIPWKUCBE-OAHLLOKOSA-N 0 1 280.198 4.611 10 0 CJAEMN CN[C@@H](c1ccc(C)cc1C)c1c(Cl)cccc1Cl ZINC000035468300 172217556 /nfs/dbraw/zinc/21/75/56/172217556.db2.gz MNBDLQFZUOHICD-INIZCTEOSA-N 0 1 294.225 4.919 10 0 CJAEMN CN[C@H](c1ccc(C)cc1C)c1c(Cl)cccc1Cl ZINC000035468301 172217272 /nfs/dbraw/zinc/21/72/72/172217272.db2.gz MNBDLQFZUOHICD-MRXNPFEDSA-N 0 1 294.225 4.919 10 0 CJAEMN CCc1ccc([C@H](NC)c2ccc(Cl)cc2Cl)cc1 ZINC000035494948 172228184 /nfs/dbraw/zinc/22/81/84/172228184.db2.gz FJGGIVDXGDJYQS-INIZCTEOSA-N 0 1 294.225 4.865 10 0 CJAEMN CCc1ccc([C@@H](NC)c2ccc(Cl)cc2Cl)cc1 ZINC000035494951 172227780 /nfs/dbraw/zinc/22/77/80/172227780.db2.gz FJGGIVDXGDJYQS-MRXNPFEDSA-N 0 1 294.225 4.865 10 0 CJAEMN CN[C@@H](c1ccc(Cl)s1)c1cc(Cl)ccc1F ZINC000035498149 172231589 /nfs/dbraw/zinc/23/15/89/172231589.db2.gz FXZHLVUSOROUKM-GFCCVEGCSA-N 0 1 290.190 4.503 10 0 CJAEMN CN[C@H](c1ccc(Cl)s1)c1cc(Cl)ccc1F ZINC000035498153 172231520 /nfs/dbraw/zinc/23/15/20/172231520.db2.gz FXZHLVUSOROUKM-LBPRGKRZSA-N 0 1 290.190 4.503 10 0 CJAEMN CN[C@H](c1ccc(Cl)s1)c1ccc(Cl)cc1F ZINC000035498159 172231641 /nfs/dbraw/zinc/23/16/41/172231641.db2.gz RFIUDYKOJQHWRI-LBPRGKRZSA-N 0 1 290.190 4.503 10 0 CJAEMN CN[C@@H](c1ccc(Cl)s1)c1ccc(Cl)cc1F ZINC000035498161 172231351 /nfs/dbraw/zinc/23/13/51/172231351.db2.gz RFIUDYKOJQHWRI-GFCCVEGCSA-N 0 1 290.190 4.503 10 0 CJAEMN CN[C@H](c1ccc(Cl)s1)c1ccc(F)cc1Cl ZINC000035498297 172232465 /nfs/dbraw/zinc/23/24/65/172232465.db2.gz CCTBQUUOIPDTSI-LBPRGKRZSA-N 0 1 290.190 4.503 10 0 CJAEMN CN[C@@H](c1ccc(Cl)s1)c1ccc(F)cc1Cl ZINC000035498298 172232138 /nfs/dbraw/zinc/23/21/38/172232138.db2.gz CCTBQUUOIPDTSI-GFCCVEGCSA-N 0 1 290.190 4.503 10 0 CJAEMN CN[C@@H](c1cc(C)oc1C)c1ccc(Cl)c(Cl)c1 ZINC000035501444 172235899 /nfs/dbraw/zinc/23/58/99/172235899.db2.gz GWPBZNWLNIMCHB-CQSZACIVSA-N 0 1 284.186 4.512 10 0 CJAEMN CN[C@H](c1cc(C)oc1C)c1ccc(Cl)c(Cl)c1 ZINC000035501445 172235833 /nfs/dbraw/zinc/23/58/33/172235833.db2.gz GWPBZNWLNIMCHB-AWEZNQCLSA-N 0 1 284.186 4.512 10 0 CJAEMN CN[C@@H](c1cc(C)oc1C)c1cc(Cl)ccc1Cl ZINC000035501809 172236667 /nfs/dbraw/zinc/23/66/67/172236667.db2.gz ZYZAJTBZSBKIDR-AWEZNQCLSA-N 0 1 284.186 4.512 10 0 CJAEMN CN[C@H](c1cc(C)oc1C)c1cc(Cl)ccc1Cl ZINC000035501810 172236597 /nfs/dbraw/zinc/23/65/97/172236597.db2.gz ZYZAJTBZSBKIDR-CQSZACIVSA-N 0 1 284.186 4.512 10 0 CJAEMN CN[C@@H](c1cccc(C)c1)c1cc(Cl)ccc1Cl ZINC000035501973 172236526 /nfs/dbraw/zinc/23/65/26/172236526.db2.gz VABVCYKTWZAVIE-HNNXBMFYSA-N 0 1 280.198 4.611 10 0 CJAEMN CN[C@H](c1cccc(C)c1)c1cc(Cl)ccc1Cl ZINC000035501974 172236923 /nfs/dbraw/zinc/23/69/23/172236923.db2.gz VABVCYKTWZAVIE-OAHLLOKOSA-N 0 1 280.198 4.611 10 0 CJAEMN CN[C@@H](c1cccc(C)c1C)c1cc(Cl)ccc1Cl ZINC000035501975 172236676 /nfs/dbraw/zinc/23/66/76/172236676.db2.gz GTJNNBTYTIZWHT-INIZCTEOSA-N 0 1 294.225 4.919 10 0 CJAEMN CN[C@H](c1cccc(C)c1C)c1cc(Cl)ccc1Cl ZINC000035501976 172236726 /nfs/dbraw/zinc/23/67/26/172236726.db2.gz GTJNNBTYTIZWHT-MRXNPFEDSA-N 0 1 294.225 4.919 10 0 CJAEMN CN[C@@H](c1ccccc1C)c1cc(Cl)ccc1Cl ZINC000035501993 172236567 /nfs/dbraw/zinc/23/65/67/172236567.db2.gz VLFNEZZBPKTIOG-HNNXBMFYSA-N 0 1 280.198 4.611 10 0 CJAEMN CN[C@H](c1ccccc1C)c1cc(Cl)ccc1Cl ZINC000035501994 172236243 /nfs/dbraw/zinc/23/62/43/172236243.db2.gz VLFNEZZBPKTIOG-OAHLLOKOSA-N 0 1 280.198 4.611 10 0 CJAEMN CN[C@H](c1cc(Cl)sc1Cl)c1sccc1C ZINC000035502046 172236826 /nfs/dbraw/zinc/23/68/26/172236826.db2.gz NZPVECCRYDCETQ-SECBINFHSA-N 0 1 292.256 4.734 10 0 CJAEMN CN[C@@H](c1cc(Cl)sc1Cl)c1sccc1C ZINC000035502047 172236311 /nfs/dbraw/zinc/23/63/11/172236311.db2.gz NZPVECCRYDCETQ-VIFPVBQESA-N 0 1 292.256 4.734 10 0 CJAEMN CN[C@@H](c1ccc(C)s1)c1cc(Cl)sc1Cl ZINC000035502048 172236850 /nfs/dbraw/zinc/23/68/50/172236850.db2.gz WCWWIZYPWPAOMZ-SNVBAGLBSA-N 0 1 292.256 4.734 10 0 CJAEMN CN[C@H](c1ccc(C)s1)c1cc(Cl)sc1Cl ZINC000035502049 172236709 /nfs/dbraw/zinc/23/67/09/172236709.db2.gz WCWWIZYPWPAOMZ-JTQLQIEISA-N 0 1 292.256 4.734 10 0 CJAEMN CN[C@H](c1cc(Cl)sc1Cl)c1cccc(C)c1 ZINC000035502265 172237899 /nfs/dbraw/zinc/23/78/99/172237899.db2.gz XMVBBVMBJPGJEO-LBPRGKRZSA-N 0 1 286.227 4.672 10 0 CJAEMN CN[C@@H](c1cc(Cl)sc1Cl)c1cccc(C)c1 ZINC000035502266 172237696 /nfs/dbraw/zinc/23/76/96/172237696.db2.gz XMVBBVMBJPGJEO-GFCCVEGCSA-N 0 1 286.227 4.672 10 0 CJAEMN CN[C@H](c1cc(Cl)sc1Cl)c1ccccc1C ZINC000035502327 172237543 /nfs/dbraw/zinc/23/75/43/172237543.db2.gz HZEDTIPREZZMIR-LBPRGKRZSA-N 0 1 286.227 4.672 10 0 CJAEMN CN[C@@H](c1cc(Cl)sc1Cl)c1ccccc1C ZINC000035502328 172237475 /nfs/dbraw/zinc/23/74/75/172237475.db2.gz HZEDTIPREZZMIR-GFCCVEGCSA-N 0 1 286.227 4.672 10 0 CJAEMN CN[C@H](c1cc(Cl)sc1Cl)c1ccc(C)cc1 ZINC000035502369 172237548 /nfs/dbraw/zinc/23/75/48/172237548.db2.gz WNQANOYAEVHOCX-LBPRGKRZSA-N 0 1 286.227 4.672 10 0 CJAEMN CN[C@@H](c1cc(Cl)sc1Cl)c1ccc(C)cc1 ZINC000035502371 172237441 /nfs/dbraw/zinc/23/74/41/172237441.db2.gz WNQANOYAEVHOCX-GFCCVEGCSA-N 0 1 286.227 4.672 10 0 CJAEMN CCN[C@@H](c1ccc(C)s1)c1c(F)cccc1Cl ZINC000035510438 172242111 /nfs/dbraw/zinc/24/21/11/172242111.db2.gz UZOWPXNVRGWFRW-AWEZNQCLSA-N 0 1 283.799 4.548 10 0 CJAEMN CCN[C@H](c1ccc(C)s1)c1c(F)cccc1Cl ZINC000035510440 172242700 /nfs/dbraw/zinc/24/27/00/172242700.db2.gz UZOWPXNVRGWFRW-CQSZACIVSA-N 0 1 283.799 4.548 10 0 CJAEMN CCN[C@@H](c1ccc(Cl)cc1)c1ccccc1Cl ZINC000035540195 172246397 /nfs/dbraw/zinc/24/63/97/172246397.db2.gz FZOFZXRIRJYYBB-HNNXBMFYSA-N 0 1 280.198 4.692 10 0 CJAEMN CCN[C@H](c1ccc(Cl)cc1)c1ccccc1Cl ZINC000035540196 172246236 /nfs/dbraw/zinc/24/62/36/172246236.db2.gz FZOFZXRIRJYYBB-OAHLLOKOSA-N 0 1 280.198 4.692 10 0 CJAEMN CCN[C@@H](c1ccc(Cl)cc1)c1ccc(F)cc1Cl ZINC000035540298 172246271 /nfs/dbraw/zinc/24/62/71/172246271.db2.gz NMSINMUCYDKQBD-HNNXBMFYSA-N 0 1 298.188 4.831 10 0 CJAEMN CCN[C@H](c1ccc(Cl)cc1)c1ccc(F)cc1Cl ZINC000035540299 172245915 /nfs/dbraw/zinc/24/59/15/172245915.db2.gz NMSINMUCYDKQBD-OAHLLOKOSA-N 0 1 298.188 4.831 10 0 CJAEMN CCN[C@@H](c1ccccc1)c1ccc(Cl)cc1Cl ZINC000035540469 172247288 /nfs/dbraw/zinc/24/72/88/172247288.db2.gz KDDIRHVSUZRBCX-HNNXBMFYSA-N 0 1 280.198 4.692 10 0 CJAEMN CCN[C@H](c1ccccc1)c1ccc(Cl)cc1Cl ZINC000035540470 172247066 /nfs/dbraw/zinc/24/70/66/172247066.db2.gz KDDIRHVSUZRBCX-OAHLLOKOSA-N 0 1 280.198 4.692 10 0 CJAEMN CCN[C@@H](c1ccccc1)c1cccc(Cl)c1Cl ZINC000035540680 172246968 /nfs/dbraw/zinc/24/69/68/172246968.db2.gz UPIPZXVGUMQKBW-HNNXBMFYSA-N 0 1 280.198 4.692 10 0 CJAEMN CCN[C@H](c1ccccc1)c1cccc(Cl)c1Cl ZINC000035540681 172247260 /nfs/dbraw/zinc/24/72/60/172247260.db2.gz UPIPZXVGUMQKBW-OAHLLOKOSA-N 0 1 280.198 4.692 10 0 CJAEMN CCN[C@@H](c1ccccc1)c1c(Cl)cccc1Cl ZINC000035540684 172247211 /nfs/dbraw/zinc/24/72/11/172247211.db2.gz WOABLLJHHQKSRH-HNNXBMFYSA-N 0 1 280.198 4.692 10 0 CJAEMN CCN[C@H](c1ccccc1)c1c(Cl)cccc1Cl ZINC000035540685 172247170 /nfs/dbraw/zinc/24/71/70/172247170.db2.gz WOABLLJHHQKSRH-OAHLLOKOSA-N 0 1 280.198 4.692 10 0 CJAEMN CCN[C@@H](c1ccccc1)c1cc(Cl)ccc1Cl ZINC000035540696 172247202 /nfs/dbraw/zinc/24/72/02/172247202.db2.gz YYZNBWXDIVOHSB-HNNXBMFYSA-N 0 1 280.198 4.692 10 0 CJAEMN CCN[C@H](c1ccccc1)c1cc(Cl)ccc1Cl ZINC000035540697 172247315 /nfs/dbraw/zinc/24/73/15/172247315.db2.gz YYZNBWXDIVOHSB-OAHLLOKOSA-N 0 1 280.198 4.692 10 0 CJAEMN CCN[C@H](c1cccs1)c1cccc(Cl)c1Cl ZINC000035545704 172253848 /nfs/dbraw/zinc/25/38/48/172253848.db2.gz SBPLPARKGBEQFV-ZDUSSCGKSA-N 0 1 286.227 4.754 10 0 CJAEMN CCN[C@@H](c1cccs1)c1cccc(Cl)c1Cl ZINC000035545706 172253589 /nfs/dbraw/zinc/25/35/89/172253589.db2.gz SBPLPARKGBEQFV-CYBMUJFWSA-N 0 1 286.227 4.754 10 0 CJAEMN CCN[C@@H](c1cccs1)c1c(Cl)cccc1Cl ZINC000035545712 172253337 /nfs/dbraw/zinc/25/33/37/172253337.db2.gz BHPMUFJXKLSFEZ-ZDUSSCGKSA-N 0 1 286.227 4.754 10 0 CJAEMN CCN[C@H](c1cccs1)c1c(Cl)cccc1Cl ZINC000035545714 172253449 /nfs/dbraw/zinc/25/34/49/172253449.db2.gz BHPMUFJXKLSFEZ-CYBMUJFWSA-N 0 1 286.227 4.754 10 0 CJAEMN CCN[C@@H](c1cccs1)c1cc(Cl)ccc1Cl ZINC000035545729 172253827 /nfs/dbraw/zinc/25/38/27/172253827.db2.gz PDKICVBXCZKESI-CYBMUJFWSA-N 0 1 286.227 4.754 10 0 CJAEMN CCN[C@H](c1cccs1)c1cc(Cl)ccc1Cl ZINC000035545731 172253594 /nfs/dbraw/zinc/25/35/94/172253594.db2.gz PDKICVBXCZKESI-ZDUSSCGKSA-N 0 1 286.227 4.754 10 0 CJAEMN CCN[C@H](c1cc(C)sc1C)c1ccc(Cl)cc1F ZINC000035552247 172259084 /nfs/dbraw/zinc/25/90/84/172259084.db2.gz DBHHWRDMWMEFDA-HNNXBMFYSA-N 0 1 297.826 4.856 10 0 CJAEMN CCN[C@@H](c1cc(C)sc1C)c1ccc(Cl)cc1F ZINC000035552250 172259233 /nfs/dbraw/zinc/25/92/33/172259233.db2.gz DBHHWRDMWMEFDA-OAHLLOKOSA-N 0 1 297.826 4.856 10 0 CJAEMN CCN[C@H](c1ccc(Cl)s1)c1ccccc1Cl ZINC000035552960 172260196 /nfs/dbraw/zinc/26/01/96/172260196.db2.gz YOBZFHRPLOKXHW-ZDUSSCGKSA-N 0 1 286.227 4.754 10 0 CJAEMN CCN[C@@H](c1ccc(Cl)s1)c1ccccc1Cl ZINC000035552964 172260109 /nfs/dbraw/zinc/26/01/09/172260109.db2.gz YOBZFHRPLOKXHW-CYBMUJFWSA-N 0 1 286.227 4.754 10 0 CJAEMN CCN[C@H](c1ccc(C)o1)c1ccc(Cl)c(Cl)c1 ZINC000035557871 172263631 /nfs/dbraw/zinc/26/36/31/172263631.db2.gz PPLWMRPSWOSQHP-AWEZNQCLSA-N 0 1 284.186 4.594 10 0 CJAEMN CCN[C@@H](c1ccc(C)o1)c1ccc(Cl)c(Cl)c1 ZINC000035557873 172263271 /nfs/dbraw/zinc/26/32/71/172263271.db2.gz PPLWMRPSWOSQHP-CQSZACIVSA-N 0 1 284.186 4.594 10 0 CJAEMN CCN[C@H](c1occc1C)c1ccc(Cl)c(Cl)c1 ZINC000035557904 172263299 /nfs/dbraw/zinc/26/32/99/172263299.db2.gz VJHMVVHTTMGYNQ-ZDUSSCGKSA-N 0 1 284.186 4.594 10 0 CJAEMN CCN[C@@H](c1occc1C)c1ccc(Cl)c(Cl)c1 ZINC000035557907 172263361 /nfs/dbraw/zinc/26/33/61/172263361.db2.gz VJHMVVHTTMGYNQ-CYBMUJFWSA-N 0 1 284.186 4.594 10 0 CJAEMN CCN[C@H](c1ccoc1C)c1ccc(Cl)c(Cl)c1 ZINC000035557927 172263742 /nfs/dbraw/zinc/26/37/42/172263742.db2.gz ICYZVZSVVUUHAY-AWEZNQCLSA-N 0 1 284.186 4.594 10 0 CJAEMN CCN[C@@H](c1ccoc1C)c1ccc(Cl)c(Cl)c1 ZINC000035557929 172263282 /nfs/dbraw/zinc/26/32/82/172263282.db2.gz ICYZVZSVVUUHAY-CQSZACIVSA-N 0 1 284.186 4.594 10 0 CJAEMN CCN[C@@H](c1ccc(Cl)c(Cl)c1)c1ccccc1F ZINC000035558222 172263672 /nfs/dbraw/zinc/26/36/72/172263672.db2.gz PFRLOCSZBDGVFQ-HNNXBMFYSA-N 0 1 298.188 4.831 10 0 CJAEMN CCN[C@H](c1ccc(Cl)c(Cl)c1)c1ccccc1F ZINC000035558224 172263162 /nfs/dbraw/zinc/26/31/62/172263162.db2.gz PFRLOCSZBDGVFQ-OAHLLOKOSA-N 0 1 298.188 4.831 10 0 CJAEMN CCN[C@@H](c1ccsc1)c1cc(Cl)ccc1Cl ZINC000035558634 172264833 /nfs/dbraw/zinc/26/48/33/172264833.db2.gz AYSHQNRJQGYLCU-ZDUSSCGKSA-N 0 1 286.227 4.754 10 0 CJAEMN CCN[C@H](c1ccsc1)c1cc(Cl)ccc1Cl ZINC000035558637 172264359 /nfs/dbraw/zinc/26/43/59/172264359.db2.gz AYSHQNRJQGYLCU-CYBMUJFWSA-N 0 1 286.227 4.754 10 0 CJAEMN CCN[C@@H](c1cc(C)oc1C)c1cc(Cl)ccc1Cl ZINC000035558665 172264294 /nfs/dbraw/zinc/26/42/94/172264294.db2.gz OUYDHZCMMAOPEX-HNNXBMFYSA-N 0 1 298.213 4.902 10 0 CJAEMN CCN[C@H](c1cc(C)oc1C)c1cc(Cl)ccc1Cl ZINC000035558668 172264091 /nfs/dbraw/zinc/26/40/91/172264091.db2.gz OUYDHZCMMAOPEX-OAHLLOKOSA-N 0 1 298.213 4.902 10 0 CJAEMN CCN[C@@H](c1ccoc1C)c1cc(Cl)ccc1Cl ZINC000035558681 172264213 /nfs/dbraw/zinc/26/42/13/172264213.db2.gz GBRZSBUCEIAFEO-AWEZNQCLSA-N 0 1 284.186 4.594 10 0 CJAEMN CCN[C@H](c1ccoc1C)c1cc(Cl)ccc1Cl ZINC000035558683 172264668 /nfs/dbraw/zinc/26/46/68/172264668.db2.gz GBRZSBUCEIAFEO-CQSZACIVSA-N 0 1 284.186 4.594 10 0 CJAEMN CCN[C@@H](CC(F)(F)F)c1cc(Cl)ccc1Cl ZINC000035559104 172264081 /nfs/dbraw/zinc/26/40/81/172264081.db2.gz ZPXJTGMQDDVOOI-JTQLQIEISA-N 0 1 286.124 4.596 10 0 CJAEMN CCN[C@H](CC(F)(F)F)c1cc(Cl)ccc1Cl ZINC000035559107 172264464 /nfs/dbraw/zinc/26/44/64/172264464.db2.gz ZPXJTGMQDDVOOI-SNVBAGLBSA-N 0 1 286.124 4.596 10 0 CJAEMN CCN[C@@H](c1ccsc1)c1cc(Cl)sc1Cl ZINC000035559194 172264306 /nfs/dbraw/zinc/26/43/06/172264306.db2.gz GEABFCZTIZDCDS-JTQLQIEISA-N 0 1 292.256 4.815 10 0 CJAEMN CCN[C@H](c1ccsc1)c1cc(Cl)sc1Cl ZINC000035559197 172264694 /nfs/dbraw/zinc/26/46/94/172264694.db2.gz GEABFCZTIZDCDS-SNVBAGLBSA-N 0 1 292.256 4.815 10 0 CJAEMN CCN[C@@H](c1cccs1)c1cc(Cl)sc1Cl ZINC000035559253 172264231 /nfs/dbraw/zinc/26/42/31/172264231.db2.gz IXQZJTJULWWEDE-SNVBAGLBSA-N 0 1 292.256 4.815 10 0 CJAEMN CCN[C@H](c1cccs1)c1cc(Cl)sc1Cl ZINC000035559256 172264733 /nfs/dbraw/zinc/26/47/33/172264733.db2.gz IXQZJTJULWWEDE-JTQLQIEISA-N 0 1 292.256 4.815 10 0 CJAEMN CCN[C@H](c1cc(Cl)sc1Cl)c1ccccc1 ZINC000035559326 172264289 /nfs/dbraw/zinc/26/42/89/172264289.db2.gz GKTCWJFPDXIHNF-LBPRGKRZSA-N 0 1 286.227 4.754 10 0 CJAEMN CCN[C@@H](c1cc(Cl)sc1Cl)c1ccccc1 ZINC000035559329 172264658 /nfs/dbraw/zinc/26/46/58/172264658.db2.gz GKTCWJFPDXIHNF-GFCCVEGCSA-N 0 1 286.227 4.754 10 0 CJAEMN CCN[C@@H](CC(F)(F)F)c1cc(Cl)sc1Cl ZINC000035559854 172264429 /nfs/dbraw/zinc/26/44/29/172264429.db2.gz PWEKSOIPEASHSJ-LURJTMIESA-N 0 1 292.153 4.658 10 0 CJAEMN CCN[C@H](CC(F)(F)F)c1cc(Cl)sc1Cl ZINC000035559857 172264806 /nfs/dbraw/zinc/26/48/06/172264806.db2.gz PWEKSOIPEASHSJ-ZCFIWIBFSA-N 0 1 292.153 4.658 10 0 CJAEMN CCCN[C@@H](c1cccs1)c1c(F)cccc1Cl ZINC000035581335 172278026 /nfs/dbraw/zinc/27/80/26/172278026.db2.gz OMMNTUSZINYQLU-AWEZNQCLSA-N 0 1 283.799 4.630 10 0 CJAEMN CCCN[C@H](c1cccs1)c1c(F)cccc1Cl ZINC000035581336 172277995 /nfs/dbraw/zinc/27/79/95/172277995.db2.gz OMMNTUSZINYQLU-CQSZACIVSA-N 0 1 283.799 4.630 10 0 CJAEMN CCCN[C@H](c1ccc(C)o1)c1ccc(Cl)c(Cl)c1 ZINC000035584793 172283848 /nfs/dbraw/zinc/28/38/48/172283848.db2.gz FLJYIMKOPWSRAW-HNNXBMFYSA-N 0 1 298.213 4.984 10 0 CJAEMN CCCN[C@@H](c1ccc(C)o1)c1ccc(Cl)c(Cl)c1 ZINC000035584794 172283943 /nfs/dbraw/zinc/28/39/43/172283943.db2.gz FLJYIMKOPWSRAW-OAHLLOKOSA-N 0 1 298.213 4.984 10 0 CJAEMN CCCN[C@H](c1ccco1)c1ccc(Cl)c(Cl)c1 ZINC000035584797 172284062 /nfs/dbraw/zinc/28/40/62/172284062.db2.gz VRJCDJNTLWTPNR-AWEZNQCLSA-N 0 1 284.186 4.675 10 0 CJAEMN CCCN[C@@H](c1ccco1)c1ccc(Cl)c(Cl)c1 ZINC000035584798 172284014 /nfs/dbraw/zinc/28/40/14/172284014.db2.gz VRJCDJNTLWTPNR-CQSZACIVSA-N 0 1 284.186 4.675 10 0 CJAEMN CCCN[C@H](c1occc1C)c1ccc(Cl)c(Cl)c1 ZINC000035584805 172284382 /nfs/dbraw/zinc/28/43/82/172284382.db2.gz CVEAHQLSHCBTHT-AWEZNQCLSA-N 0 1 298.213 4.984 10 0 CJAEMN CCCN[C@@H](c1occc1C)c1ccc(Cl)c(Cl)c1 ZINC000035584806 172284072 /nfs/dbraw/zinc/28/40/72/172284072.db2.gz CVEAHQLSHCBTHT-CQSZACIVSA-N 0 1 298.213 4.984 10 0 CJAEMN CCCN[C@@H](c1ccoc1)c1cc(Cl)ccc1Cl ZINC000035585024 172284932 /nfs/dbraw/zinc/28/49/32/172284932.db2.gz ACZUDVMKLOIRKE-AWEZNQCLSA-N 0 1 284.186 4.675 10 0 CJAEMN CCCN[C@H](c1ccoc1)c1cc(Cl)ccc1Cl ZINC000035585025 172284768 /nfs/dbraw/zinc/28/47/68/172284768.db2.gz ACZUDVMKLOIRKE-CQSZACIVSA-N 0 1 284.186 4.675 10 0 CJAEMN Cc1c2cc(C)ccc2oc1[C@H](N)c1cc(C)ccc1C ZINC000035630492 172311584 /nfs/dbraw/zinc/31/15/84/172311584.db2.gz ZCLGJTCNONSKMD-GOSISDBHSA-N 0 1 279.383 4.715 10 0 CJAEMN Cc1c2cc(C)ccc2oc1[C@@H](N)c1cc(C)ccc1C ZINC000035630493 172311468 /nfs/dbraw/zinc/31/14/68/172311468.db2.gz ZCLGJTCNONSKMD-SFHVURJKSA-N 0 1 279.383 4.715 10 0 CJAEMN Cc1c2cc(C)ccc2oc1[C@@H](N)c1ccc(C)cc1C ZINC000035630496 172311331 /nfs/dbraw/zinc/31/13/31/172311331.db2.gz QOLHYAHHSCMZGR-SFHVURJKSA-N 0 1 279.383 4.715 10 0 CJAEMN Cc1c2cc(C)ccc2oc1[C@H](N)c1ccc(C)cc1C ZINC000035630497 172311814 /nfs/dbraw/zinc/31/18/14/172311814.db2.gz QOLHYAHHSCMZGR-GOSISDBHSA-N 0 1 279.383 4.715 10 0 CJAEMN CCc1ccc([C@H](N)c2oc3ccc(C)cc3c2C)cc1 ZINC000035630500 172311820 /nfs/dbraw/zinc/31/18/20/172311820.db2.gz BMUBRGTUGULLBE-SFHVURJKSA-N 0 1 279.383 4.660 10 0 CJAEMN CCc1ccc([C@@H](N)c2oc3ccc(C)cc3c2C)cc1 ZINC000035630501 172311510 /nfs/dbraw/zinc/31/15/10/172311510.db2.gz BMUBRGTUGULLBE-GOSISDBHSA-N 0 1 279.383 4.660 10 0 CJAEMN Cc1c2cc(C)ccc2oc1[C@H](N)c1ccc(C)c(C)c1 ZINC000035630508 172311308 /nfs/dbraw/zinc/31/13/08/172311308.db2.gz WQXKODHBJFNAEO-GOSISDBHSA-N 0 1 279.383 4.715 10 0 CJAEMN Cc1c2cc(C)ccc2oc1[C@@H](N)c1ccc(C)c(C)c1 ZINC000035630509 172311371 /nfs/dbraw/zinc/31/13/71/172311371.db2.gz WQXKODHBJFNAEO-SFHVURJKSA-N 0 1 279.383 4.715 10 0 CJAEMN Cc1c2cc(C)ccc2oc1[C@H](N)c1ccc(Cl)cc1 ZINC000035630544 172312358 /nfs/dbraw/zinc/31/23/58/172312358.db2.gz BDPJMELUVVFGFI-MRXNPFEDSA-N 0 1 285.774 4.751 10 0 CJAEMN Cc1c2cc(C)ccc2oc1[C@@H](N)c1ccc(Cl)cc1 ZINC000035630545 172312055 /nfs/dbraw/zinc/31/20/55/172312055.db2.gz BDPJMELUVVFGFI-INIZCTEOSA-N 0 1 285.774 4.751 10 0 CJAEMN CCc1ccc([C@@H](CC)N[C@@H](C)c2ccco2)cc1 ZINC000035738468 172391305 /nfs/dbraw/zinc/39/13/05/172391305.db2.gz PGNOSBQVIALARC-XJKSGUPXSA-N 0 1 257.377 4.644 10 0 CJAEMN CCc1ccc([C@H](CC)N[C@@H](C)c2ccco2)cc1 ZINC000035738469 172391492 /nfs/dbraw/zinc/39/14/92/172391492.db2.gz PGNOSBQVIALARC-BBRMVZONSA-N 0 1 257.377 4.644 10 0 CJAEMN CCc1ccc([C@@H](CC)N[C@H](C)c2ccco2)cc1 ZINC000035738470 172391755 /nfs/dbraw/zinc/39/17/55/172391755.db2.gz PGNOSBQVIALARC-CZUORRHYSA-N 0 1 257.377 4.644 10 0 CJAEMN Cc1cc(C)c([C@@H](C)N[C@@H](C)c2ccco2)cc1C ZINC000035738666 172392359 /nfs/dbraw/zinc/39/23/59/172392359.db2.gz HUFFDXKHLNEMDC-CABCVRRESA-N 0 1 257.377 4.617 10 0 CJAEMN Cc1cc(C)c([C@H](C)N[C@@H](C)c2ccco2)cc1C ZINC000035738667 172392647 /nfs/dbraw/zinc/39/26/47/172392647.db2.gz HUFFDXKHLNEMDC-GJZGRUSLSA-N 0 1 257.377 4.617 10 0 CJAEMN Cc1cc(C)c([C@@H](C)N[C@H](C)c2ccco2)cc1C ZINC000035738668 172392502 /nfs/dbraw/zinc/39/25/02/172392502.db2.gz HUFFDXKHLNEMDC-HUUCEWRRSA-N 0 1 257.377 4.617 10 0 CJAEMN Cc1cc(C)c([C@H](C)N[C@H](C)c2ccco2)cc1C ZINC000035738669 172392848 /nfs/dbraw/zinc/39/28/48/172392848.db2.gz HUFFDXKHLNEMDC-LSDHHAIUSA-N 0 1 257.377 4.617 10 0 CJAEMN CC(C)COc1ccc([C@@H](C)N[C@@H](C)c2ccco2)cc1 ZINC000035738696 330250028 /nfs/dbraw/zinc/25/00/28/330250028.db2.gz XZYCVTDTNZPJCB-CABCVRRESA-N 0 1 287.403 4.726 10 0 CJAEMN CC(C)COc1ccc([C@H](C)N[C@@H](C)c2ccco2)cc1 ZINC000035738697 330250193 /nfs/dbraw/zinc/25/01/93/330250193.db2.gz XZYCVTDTNZPJCB-GJZGRUSLSA-N 0 1 287.403 4.726 10 0 CJAEMN CC(C)COc1ccc([C@@H](C)N[C@H](C)c2ccco2)cc1 ZINC000035738698 330250236 /nfs/dbraw/zinc/25/02/36/330250236.db2.gz XZYCVTDTNZPJCB-HUUCEWRRSA-N 0 1 287.403 4.726 10 0 CJAEMN CC(C)COc1ccc([C@H](C)N[C@H](C)c2ccco2)cc1 ZINC000035738699 330250087 /nfs/dbraw/zinc/25/00/87/330250087.db2.gz XZYCVTDTNZPJCB-LSDHHAIUSA-N 0 1 287.403 4.726 10 0 CJAEMN C[C@@H](N[C@@H](C)c1ccco1)c1ccc(OC(F)(F)F)cc1 ZINC000035738709 172392310 /nfs/dbraw/zinc/39/23/10/172392310.db2.gz SQEBNFHCSCADGU-MNOVXSKESA-N 0 1 299.292 4.590 10 0 CJAEMN C[C@@H](N[C@H](C)c1ccc(OC(F)(F)F)cc1)c1ccco1 ZINC000035738711 330250103 /nfs/dbraw/zinc/25/01/03/330250103.db2.gz SQEBNFHCSCADGU-GHMZBOCLSA-N 0 1 299.292 4.590 10 0 CJAEMN CC(C)c1ccc([C@@H](C)N[C@@H](C)c2ccco2)cc1 ZINC000035738736 172392738 /nfs/dbraw/zinc/39/27/38/172392738.db2.gz CGYCPMXDTZTZNP-KGLIPLIRSA-N 0 1 257.377 4.815 10 0 CJAEMN CC(C)c1ccc([C@H](C)N[C@@H](C)c2ccco2)cc1 ZINC000035738737 172392708 /nfs/dbraw/zinc/39/27/08/172392708.db2.gz CGYCPMXDTZTZNP-KBPBESRZSA-N 0 1 257.377 4.815 10 0 CJAEMN CC(C)c1ccc([C@@H](C)N[C@H](C)c2ccco2)cc1 ZINC000035738738 172392467 /nfs/dbraw/zinc/39/24/67/172392467.db2.gz CGYCPMXDTZTZNP-ZIAGYGMSSA-N 0 1 257.377 4.815 10 0 CJAEMN CC(C)c1ccc([C@H](C)N[C@H](C)c2ccco2)cc1 ZINC000035738739 172392400 /nfs/dbraw/zinc/39/24/00/172392400.db2.gz CGYCPMXDTZTZNP-UONOGXRCSA-N 0 1 257.377 4.815 10 0 CJAEMN CCCc1ccc([C@H](C)N[C@@H](C)c2ccco2)cc1 ZINC000035738811 172392711 /nfs/dbraw/zinc/39/27/11/172392711.db2.gz YQIBFGAJMGVKNU-KBPBESRZSA-N 0 1 257.377 4.644 10 0 CJAEMN CCCc1ccc([C@@H](C)N[C@H](C)c2ccco2)cc1 ZINC000035738812 172392749 /nfs/dbraw/zinc/39/27/49/172392749.db2.gz YQIBFGAJMGVKNU-ZIAGYGMSSA-N 0 1 257.377 4.644 10 0 CJAEMN Cc1cc(C)c([C@@H](C)N[C@@H](C)c2ccco2)c(C)c1 ZINC000035738876 172392339 /nfs/dbraw/zinc/39/23/39/172392339.db2.gz OTDSDECQQCYKNQ-LSDHHAIUSA-N 0 1 257.377 4.617 10 0 CJAEMN Cc1cc(C)c([C@H](C)N[C@@H](C)c2ccco2)c(C)c1 ZINC000035738877 172392410 /nfs/dbraw/zinc/39/24/10/172392410.db2.gz OTDSDECQQCYKNQ-GJZGRUSLSA-N 0 1 257.377 4.617 10 0 CJAEMN Cc1cc(C)c([C@@H](C)N[C@H](C)c2ccco2)c(C)c1 ZINC000035738878 172392652 /nfs/dbraw/zinc/39/26/52/172392652.db2.gz OTDSDECQQCYKNQ-HUUCEWRRSA-N 0 1 257.377 4.617 10 0 CJAEMN Cc1cc(C)c([C@H](C)N[C@H](C)c2ccco2)c(C)c1 ZINC000035738879 172392767 /nfs/dbraw/zinc/39/27/67/172392767.db2.gz OTDSDECQQCYKNQ-CABCVRRESA-N 0 1 257.377 4.617 10 0 CJAEMN CC(C)Cc1ccc([C@@H](C)N[C@@H](C)c2ccco2)cc1 ZINC000035738888 172392518 /nfs/dbraw/zinc/39/25/18/172392518.db2.gz YDGSMFVFENNISB-CABCVRRESA-N 0 1 271.404 4.890 10 0 CJAEMN CC(C)Cc1ccc([C@H](C)N[C@@H](C)c2ccco2)cc1 ZINC000035738889 172392621 /nfs/dbraw/zinc/39/26/21/172392621.db2.gz YDGSMFVFENNISB-GJZGRUSLSA-N 0 1 271.404 4.890 10 0 CJAEMN CC(C)Cc1ccc([C@@H](C)N[C@H](C)c2ccco2)cc1 ZINC000035738890 172392592 /nfs/dbraw/zinc/39/25/92/172392592.db2.gz YDGSMFVFENNISB-HUUCEWRRSA-N 0 1 271.404 4.890 10 0 CJAEMN CC(C)Cc1ccc([C@H](C)N[C@H](C)c2ccco2)cc1 ZINC000035738891 330250051 /nfs/dbraw/zinc/25/00/51/330250051.db2.gz YDGSMFVFENNISB-LSDHHAIUSA-N 0 1 271.404 4.890 10 0 CJAEMN C[C@H](N[C@@H](C)c1ccc(C(C)(C)C)cc1)c1ccco1 ZINC000035738928 172392446 /nfs/dbraw/zinc/39/24/46/172392446.db2.gz KFQYSLKTKJKIFM-KBPBESRZSA-N 0 1 271.404 4.989 10 0 CJAEMN C[C@@H](N[C@H](C)c1ccc(C(C)(C)C)cc1)c1ccco1 ZINC000035738931 330250140 /nfs/dbraw/zinc/25/01/40/330250140.db2.gz KFQYSLKTKJKIFM-ZIAGYGMSSA-N 0 1 271.404 4.989 10 0 CJAEMN C[C@H](N[C@@H](C)c1ccc2ccccc2c1)c1ccco1 ZINC000035739003 330250215 /nfs/dbraw/zinc/25/02/15/330250215.db2.gz GYPVCRZUHKSTCS-KBPBESRZSA-N 0 1 265.356 4.845 10 0 CJAEMN 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/nfs/dbraw/zinc/88/59/01/326885901.db2.gz IHBJDFFHYXFUPH-CABCVRRESA-N 0 1 257.377 4.617 10 0 CJAEMN Cc1ccc([C@@H](C)N[C@H](C)c2cc(C)ccc2C)o1 ZINC000036960013 326885861 /nfs/dbraw/zinc/88/58/61/326885861.db2.gz IHBJDFFHYXFUPH-HUUCEWRRSA-N 0 1 257.377 4.617 10 0 CJAEMN CCCOc1ccc([C@H](C)N[C@@H](C)c2ccc(C)o2)cc1 ZINC000036960068 326888496 /nfs/dbraw/zinc/88/84/96/326888496.db2.gz HJWSSTLWEHNXBS-GJZGRUSLSA-N 0 1 287.403 4.789 10 0 CJAEMN CCCOc1ccc([C@@H](C)N[C@H](C)c2ccc(C)o2)cc1 ZINC000036960069 326888408 /nfs/dbraw/zinc/88/84/08/326888408.db2.gz HJWSSTLWEHNXBS-HUUCEWRRSA-N 0 1 287.403 4.789 10 0 CJAEMN Cc1ccc([C@H](C)N[C@H](C)c2ccc(C)c(C)c2)o1 ZINC000036960079 326888466 /nfs/dbraw/zinc/88/84/66/326888466.db2.gz RLQAUOBYWBMFCU-CABCVRRESA-N 0 1 257.377 4.617 10 0 CJAEMN Cc1ccc([C@@H](C)N[C@H](C)c2ccc(C)c(C)c2)o1 ZINC000036960081 326888652 /nfs/dbraw/zinc/88/86/52/326888652.db2.gz RLQAUOBYWBMFCU-HUUCEWRRSA-N 0 1 257.377 4.617 10 0 CJAEMN Cc1ccc([C@@H](C)N[C@@H](C)c2ccc(C)c(C)c2)o1 ZINC000036960082 326888625 /nfs/dbraw/zinc/88/86/25/326888625.db2.gz RLQAUOBYWBMFCU-LSDHHAIUSA-N 0 1 257.377 4.617 10 0 CJAEMN CC[C@H](N[C@@H](C)c1ccc(C)o1)c1ccc(F)cc1 ZINC000036960411 260057633 /nfs/dbraw/zinc/05/76/33/260057633.db2.gz PYZTWSCPIAPTMP-WFASDCNBSA-N 0 1 261.340 4.529 10 0 CJAEMN CC[C@@H](N[C@@H](C)c1ccc(C)o1)c1ccc(F)cc1 ZINC000036960413 260057926 /nfs/dbraw/zinc/05/79/26/260057926.db2.gz PYZTWSCPIAPTMP-SWLSCSKDSA-N 0 1 261.340 4.529 10 0 CJAEMN CC[C@H](N[C@H](C)c1ccc(C)o1)c1ccc(F)cc1 ZINC000036960415 260057915 /nfs/dbraw/zinc/05/79/15/260057915.db2.gz PYZTWSCPIAPTMP-DOMZBBRYSA-N 0 1 261.340 4.529 10 0 CJAEMN CC[C@@H](N[C@H](C)c1ccc(C)o1)c1ccc(F)cc1 ZINC000036960417 260057650 /nfs/dbraw/zinc/05/76/50/260057650.db2.gz PYZTWSCPIAPTMP-IUODEOHRSA-N 0 1 261.340 4.529 10 0 CJAEMN C[C@H](N[C@@H](C)c1cccc(O)c1)c1ccc(Cl)s1 ZINC000036992343 328639125 /nfs/dbraw/zinc/63/91/25/328639125.db2.gz DVATWAFRIGVOOP-UWVGGRQHSA-N 0 1 281.808 4.519 10 0 CJAEMN 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CJAEMN C[C@H](NCc1ccc(Cl)cc1)c1ccc(F)cc1Cl ZINC000037243235 333522609 /nfs/dbraw/zinc/52/26/09/333522609.db2.gz HMKATLLXFACOHN-JTQLQIEISA-N 0 1 298.188 4.983 10 0 CJAEMN Cc1cccc([C@@H](C)N[C@@H](C)c2cc(F)ccc2F)c1 ZINC000037272385 333528107 /nfs/dbraw/zinc/52/81/07/333528107.db2.gz FFVMTKGWBAOYGL-OLZOCXBDSA-N 0 1 275.342 4.685 10 0 CJAEMN Cc1cccc([C@H](C)N[C@@H](C)c2cc(F)ccc2F)c1 ZINC000037272387 333528113 /nfs/dbraw/zinc/52/81/13/333528113.db2.gz FFVMTKGWBAOYGL-STQMWFEESA-N 0 1 275.342 4.685 10 0 CJAEMN Cc1cccc([C@H](C)N[C@H](C)c2cc(F)ccc2F)c1 ZINC000037272391 333528095 /nfs/dbraw/zinc/52/80/95/333528095.db2.gz FFVMTKGWBAOYGL-QWHCGFSZSA-N 0 1 275.342 4.685 10 0 CJAEMN CC(C)Cc1ccc([C@@H](C)NCc2ccc(Cl)o2)cc1 ZINC000037487149 333533406 /nfs/dbraw/zinc/53/34/06/333533406.db2.gz YRVKAVYKEZZQRL-CYBMUJFWSA-N 0 1 291.822 4.982 10 0 CJAEMN Cc1ccc([C@@H](C)N[C@H](C)c2cc(F)ccc2F)c(C)c1 ZINC000037507803 333534248 /nfs/dbraw/zinc/53/42/48/333534248.db2.gz LJFVRWRQTVIJQO-ZIAGYGMSSA-N 0 1 289.369 4.993 10 0 CJAEMN Cc1ccc([C@H](C)N[C@H](C)c2cc(F)ccc2F)c(C)c1 ZINC000037507804 333534474 /nfs/dbraw/zinc/53/44/74/333534474.db2.gz LJFVRWRQTVIJQO-UONOGXRCSA-N 0 1 289.369 4.993 10 0 CJAEMN Cc1ccc([C@@H](C)N[C@H](C)c2ccc(F)cc2F)c(C)c1 ZINC000037508053 333534430 /nfs/dbraw/zinc/53/44/30/333534430.db2.gz GEAOZILYVKDUDI-ZIAGYGMSSA-N 0 1 289.369 4.993 10 0 CJAEMN Cc1ccc([C@H](C)N[C@H](C)c2ccc(F)cc2F)c(C)c1 ZINC000037508054 333534489 /nfs/dbraw/zinc/53/44/89/333534489.db2.gz GEAOZILYVKDUDI-UONOGXRCSA-N 0 1 289.369 4.993 10 0 CJAEMN Cc1ccc([C@@H](C)N[C@@H](C)c2ccc(C)cc2C)o1 ZINC000037508174 333534386 /nfs/dbraw/zinc/53/43/86/333534386.db2.gz JSDRUXLSITWYBK-LSDHHAIUSA-N 0 1 257.377 4.617 10 0 CJAEMN C[C@H](NCc1cc(-c2ccccc2)cs1)c1ccco1 ZINC000038030791 174022777 /nfs/dbraw/zinc/02/27/77/174022777.db2.gz JEKUACADBLMJTM-ZDUSSCGKSA-N 0 1 283.396 4.859 10 0 CJAEMN C[C@@H](NCc1cc(-c2ccccc2)cs1)c1ccco1 ZINC000038030792 174023897 /nfs/dbraw/zinc/02/38/97/174023897.db2.gz JEKUACADBLMJTM-CYBMUJFWSA-N 0 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CC(C)(C)c1ccc2oc([C@@H](N)C3CCCCC3)nc2c1 ZINC000038037079 174036673 /nfs/dbraw/zinc/03/66/73/174036673.db2.gz UZCZSPLUPPSBKS-INIZCTEOSA-N 0 1 286.419 4.705 10 0 CJAEMN CCC[C@H](NCc1nc(C)cs1)c1ccc(Cl)cc1 ZINC000038090853 174104807 /nfs/dbraw/zinc/10/48/07/174104807.db2.gz FYQVOOBRDIEHKN-AWEZNQCLSA-N 0 1 294.851 4.736 10 0 CJAEMN CCC[C@@H](NCc1nc(C)cs1)c1ccc(Cl)cc1 ZINC000038090854 174104788 /nfs/dbraw/zinc/10/47/88/174104788.db2.gz FYQVOOBRDIEHKN-CQSZACIVSA-N 0 1 294.851 4.736 10 0 CJAEMN Cc1ccc2nc(-c3ccccc3-c3ccccn3)[nH]c2c1 ZINC000038352503 174141097 /nfs/dbraw/zinc/14/10/97/174141097.db2.gz VIBLMFDSXXNFCT-UHFFFAOYSA-N 0 1 285.350 4.600 10 0 CJAEMN Clc1ccc(Nc2nc3ccc(Cl)cc3[nH]2)cc1 ZINC000038921812 174159538 /nfs/dbraw/zinc/15/95/38/174159538.db2.gz NXPJSIQURRPXSH-UHFFFAOYSA-N 0 1 278.142 4.613 10 0 CJAEMN Cc1cc(Nc2cccc(C)c2C)c2ccccc2n1 ZINC000040400769 174253205 /nfs/dbraw/zinc/25/32/05/174253205.db2.gz AELRXWVREOLLRB-UHFFFAOYSA-N 0 1 262.356 4.904 10 0 CJAEMN 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CCc1ccc([C@@H](C)N[C@@H](C)c2ccc(C)o2)s1 ZINC000041203793 328030174 /nfs/dbraw/zinc/03/01/74/328030174.db2.gz PFEROHSSMPUJTF-NWDGAFQWSA-N 0 1 263.406 4.624 10 0 CJAEMN CCc1ccc([C@H](C)N[C@@H](C)c2ccc(C)o2)s1 ZINC000041203796 328029959 /nfs/dbraw/zinc/02/99/59/328029959.db2.gz PFEROHSSMPUJTF-RYUDHWBXSA-N 0 1 263.406 4.624 10 0 CJAEMN CCc1ccc([C@@H](C)N[C@H](C)c2ccc(C)o2)s1 ZINC000041203799 328029952 /nfs/dbraw/zinc/02/99/52/328029952.db2.gz PFEROHSSMPUJTF-VXGBXAGGSA-N 0 1 263.406 4.624 10 0 CJAEMN CCc1ccc([C@H](C)N[C@H](C)c2ccc(C)o2)s1 ZINC000041203802 328030135 /nfs/dbraw/zinc/03/01/35/328030135.db2.gz PFEROHSSMPUJTF-NEPJUHHUSA-N 0 1 263.406 4.624 10 0 CJAEMN Cc1ccccc1[C@@H](C)NCc1ccc(F)cc1Cl ZINC000042313640 328765392 /nfs/dbraw/zinc/76/53/92/328765392.db2.gz AWPXEFFUWILONK-GFCCVEGCSA-N 0 1 277.770 4.638 10 0 CJAEMN C[C@@H](NCc1ccc(Cl)c(F)c1)c1ccccc1Cl ZINC000043388457 328789391 /nfs/dbraw/zinc/78/93/91/328789391.db2.gz VKEYNJMPQWUAID-SNVBAGLBSA-N 0 1 298.188 4.983 10 0 CJAEMN 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CCc1ccccc1Nc1nc2ccc(Cl)cc2[nH]1 ZINC000045918839 175386231 /nfs/dbraw/zinc/38/62/31/175386231.db2.gz XDGWZBLRWWAKIL-UHFFFAOYSA-N 0 1 271.751 4.522 10 0 CJAEMN Fc1cccc(F)c1-c1nc2ccc(C(F)(F)F)cc2[nH]1 ZINC000049110289 526392898 /nfs/dbraw/zinc/39/28/98/526392898.db2.gz DEOOSNIGWNBSCQ-UHFFFAOYSA-N 0 1 298.214 4.527 10 0 CJAEMN CC[C@H](N[C@@H](C)c1nc(C)sc1C)c1cccs1 ZINC000049529298 522702298 /nfs/dbraw/zinc/70/22/98/522702298.db2.gz FJUOBTBIUUVDEC-CABZTGNLSA-N 0 1 280.462 4.623 10 0 CJAEMN CC[C@@H](N[C@@H](C)c1nc(C)sc1C)c1cccs1 ZINC000049529299 522917069 /nfs/dbraw/zinc/91/70/69/522917069.db2.gz FJUOBTBIUUVDEC-JOYOIKCWSA-N 0 1 280.462 4.623 10 0 CJAEMN CC[C@H](N[C@H](C)c1nc(C)sc1C)c1cccs1 ZINC000049529300 522744817 /nfs/dbraw/zinc/74/48/17/522744817.db2.gz FJUOBTBIUUVDEC-SKDRFNHKSA-N 0 1 280.462 4.623 10 0 CJAEMN CC[C@@H](N[C@H](C)c1nc(C)sc1C)c1cccs1 ZINC000049529301 522940039 /nfs/dbraw/zinc/94/00/39/522940039.db2.gz FJUOBTBIUUVDEC-BXKDBHETSA-N 0 1 280.462 4.623 10 0 CJAEMN 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WDFTURLEMASSMX-SWLSCSKDSA-N 0 1 261.340 4.529 10 0 CJAEMN CC[C@H](N[C@H](C)c1ccc(C)o1)c1cccc(F)c1 ZINC000166470272 331307299 /nfs/dbraw/zinc/30/72/99/331307299.db2.gz WDFTURLEMASSMX-DOMZBBRYSA-N 0 1 261.340 4.529 10 0 CJAEMN CC[C@@H](N[C@H](C)c1ccc(C)o1)c1cccc(F)c1 ZINC000166470387 331307326 /nfs/dbraw/zinc/30/73/26/331307326.db2.gz WDFTURLEMASSMX-IUODEOHRSA-N 0 1 261.340 4.529 10 0 CJAEMN CC(C)c1ccc([C@@H](C)NCc2ccncc2Cl)cc1 ZINC000174809877 333007806 /nfs/dbraw/zinc/00/78/06/333007806.db2.gz ZNVCXVURZNJCIE-CYBMUJFWSA-N 0 1 288.822 4.709 10 0 CJAEMN CC(C)c1ccc([C@H](C)NCc2ccncc2Cl)cc1 ZINC000174809885 333007702 /nfs/dbraw/zinc/00/77/02/333007702.db2.gz ZNVCXVURZNJCIE-ZDUSSCGKSA-N 0 1 288.822 4.709 10 0 CJAEMN Cc1nc(CN[C@@H](C)c2ccc(C(C)C)cc2)sc1C ZINC000177690365 333061746 /nfs/dbraw/zinc/06/17/46/333061746.db2.gz GECJYOWWFLIKHZ-ZDUSSCGKSA-N 0 1 288.460 4.734 10 0 CJAEMN Cc1nc(CN[C@H](C)c2ccc(C(C)C)cc2)sc1C ZINC000177690374 333061773 /nfs/dbraw/zinc/06/17/73/333061773.db2.gz GECJYOWWFLIKHZ-CYBMUJFWSA-N 0 1 288.460 4.734 10 0 CJAEMN CC1(C)C[C@H](N[C@@H]2CCCc3occc32)c2ccccc2O1 ZINC000178000624 261373769 /nfs/dbraw/zinc/37/37/69/261373769.db2.gz DXLLPSZZXNLDCY-CVEARBPZSA-N 0 1 297.398 4.549 10 0 CJAEMN CC1(C)C[C@@H](N[C@@H]2CCCc3occc32)c2ccccc2O1 ZINC000178000633 261373729 /nfs/dbraw/zinc/37/37/29/261373729.db2.gz DXLLPSZZXNLDCY-HZPDHXFCSA-N 0 1 297.398 4.549 10 0 CJAEMN CC1(C)C[C@H](N[C@H]2CCCc3occc32)c2ccccc2O1 ZINC000178000644 261374082 /nfs/dbraw/zinc/37/40/82/261374082.db2.gz DXLLPSZZXNLDCY-HOTGVXAUSA-N 0 1 297.398 4.549 10 0 CJAEMN CC1(C)C[C@@H](N[C@H]2CCCc3occc32)c2ccccc2O1 ZINC000178000655 261373940 /nfs/dbraw/zinc/37/39/40/261373940.db2.gz DXLLPSZZXNLDCY-JKSUJKDBSA-N 0 1 297.398 4.549 10 0 CJAEMN c1cc(CN[C@@H]2CC3(CCCC3)Oc3ccccc32)cs1 ZINC000178025919 329191769 /nfs/dbraw/zinc/19/17/69/329191769.db2.gz CPZNWUGLXBEKNY-MRXNPFEDSA-N 0 1 299.439 4.674 10 0 CJAEMN c1cc(CN[C@H]2CC3(CCCC3)Oc3ccccc32)cs1 ZINC000178025928 329191717 /nfs/dbraw/zinc/19/17/17/329191717.db2.gz CPZNWUGLXBEKNY-INIZCTEOSA-N 0 1 299.439 4.674 10 0 CJAEMN COc1ccc(Cl)cc1[C@H](C)N[C@@H](C)c1cccs1 ZINC000178177758 333069082 /nfs/dbraw/zinc/06/90/82/333069082.db2.gz REEWAOLQXLIRKN-QWRGUYRKSA-N 0 1 295.835 4.822 10 0 CJAEMN COc1ccc(Cl)cc1[C@H](C)N[C@H](C)c1cccs1 ZINC000178177770 333069102 /nfs/dbraw/zinc/06/91/02/333069102.db2.gz REEWAOLQXLIRKN-WDEREUQCSA-N 0 1 295.835 4.822 10 0 CJAEMN COc1ccc(Cl)cc1[C@@H](C)N[C@@H](C)c1cccs1 ZINC000178177778 333069077 /nfs/dbraw/zinc/06/90/77/333069077.db2.gz REEWAOLQXLIRKN-MNOVXSKESA-N 0 1 295.835 4.822 10 0 CJAEMN COc1ccc(Cl)cc1[C@@H](C)N[C@H](C)c1cccs1 ZINC000178177790 333069136 /nfs/dbraw/zinc/06/91/36/333069136.db2.gz REEWAOLQXLIRKN-GHMZBOCLSA-N 0 1 295.835 4.822 10 0 CJAEMN C[C@H](N[C@@H](c1ccccc1)c1cccnc1)c1ccccc1 ZINC000178607902 329201297 /nfs/dbraw/zinc/20/12/97/329201297.db2.gz NRFZKOGUEFHGFS-JXFKEZNVSA-N 0 1 288.394 4.522 10 0 CJAEMN C[C@@H](N[C@@H](c1ccccc1)c1cccnc1)c1ccccc1 ZINC000178607910 329201448 /nfs/dbraw/zinc/20/14/48/329201448.db2.gz NRFZKOGUEFHGFS-UZLBHIALSA-N 0 1 288.394 4.522 10 0 CJAEMN C[C@H](N[C@H](c1ccccc1)c1cccnc1)c1ccccc1 ZINC000178607921 329201457 /nfs/dbraw/zinc/20/14/57/329201457.db2.gz NRFZKOGUEFHGFS-OXJNMPFZSA-N 0 1 288.394 4.522 10 0 CJAEMN C[C@@H](N[C@H](c1ccccc1)c1cccnc1)c1ccccc1 ZINC000178607930 329201392 /nfs/dbraw/zinc/20/13/92/329201392.db2.gz NRFZKOGUEFHGFS-OXQOHEQNSA-N 0 1 288.394 4.522 10 0 CJAEMN C[C@H](N[C@@H](c1ccccc1)c1cccnc1)c1cccs1 ZINC000178608044 329201424 /nfs/dbraw/zinc/20/14/24/329201424.db2.gz QFUIHAVOMMWEBP-KSSFIOAISA-N 0 1 294.423 4.583 10 0 CJAEMN C[C@@H](N[C@@H](c1ccccc1)c1cccnc1)c1cccs1 ZINC000178608049 329201365 /nfs/dbraw/zinc/20/13/65/329201365.db2.gz QFUIHAVOMMWEBP-KDOFPFPSSA-N 0 1 294.423 4.583 10 0 CJAEMN C[C@H](N[C@H](c1ccccc1)c1cccnc1)c1cccs1 ZINC000178608061 329201305 /nfs/dbraw/zinc/20/13/05/329201305.db2.gz QFUIHAVOMMWEBP-KBXCAEBGSA-N 0 1 294.423 4.583 10 0 CJAEMN C[C@@H](N[C@H](c1ccccc1)c1cccnc1)c1cccs1 ZINC000178608076 329201328 /nfs/dbraw/zinc/20/13/28/329201328.db2.gz QFUIHAVOMMWEBP-RDTXWAMCSA-N 0 1 294.423 4.583 10 0 CJAEMN C[C@H](NCc1ccc(Oc2ccccc2)o1)c1cccs1 ZINC000180759196 260110996 /nfs/dbraw/zinc/11/09/96/260110996.db2.gz IUFAXCUNOJZESU-ZDUSSCGKSA-N 0 1 299.395 4.984 10 0 CJAEMN C[C@@H](NCc1ccc(Oc2ccccc2)o1)c1cccs1 ZINC000180759212 260111003 /nfs/dbraw/zinc/11/10/03/260111003.db2.gz IUFAXCUNOJZESU-CYBMUJFWSA-N 0 1 299.395 4.984 10 0 CJAEMN C[C@H](N[C@@H]1CC2(CCCC2)Oc2ccccc21)c1ccoc1 ZINC000181369890 335759183 /nfs/dbraw/zinc/75/91/83/335759183.db2.gz NBCCEHCNEGALEN-WMLDXEAASA-N 0 1 297.398 4.767 10 0 CJAEMN C[C@@H](N[C@@H]1CC2(CCCC2)Oc2ccccc21)c1ccoc1 ZINC000181369909 335759108 /nfs/dbraw/zinc/75/91/08/335759108.db2.gz NBCCEHCNEGALEN-RHSMWYFYSA-N 0 1 297.398 4.767 10 0 CJAEMN C[C@H](N[C@H]1CC2(CCCC2)Oc2ccccc21)c1ccoc1 ZINC000181369933 335759169 /nfs/dbraw/zinc/75/91/69/335759169.db2.gz NBCCEHCNEGALEN-YOEHRIQHSA-N 0 1 297.398 4.767 10 0 CJAEMN Cc1cncc([C@@H](C)N[C@@H](C)c2ccc(Cl)s2)c1 ZINC000184267634 333126223 /nfs/dbraw/zinc/12/62/23/333126223.db2.gz KCOHHBBKTNDGHZ-MNOVXSKESA-N 0 1 280.824 4.517 10 0 CJAEMN Cc1cncc([C@H](C)N[C@@H](C)c2ccc(Cl)s2)c1 ZINC000184267653 333126267 /nfs/dbraw/zinc/12/62/67/333126267.db2.gz KCOHHBBKTNDGHZ-QWRGUYRKSA-N 0 1 280.824 4.517 10 0 CJAEMN Cc1cncc([C@@H](C)N[C@H](C)c2ccc(Cl)s2)c1 ZINC000184267668 333126257 /nfs/dbraw/zinc/12/62/57/333126257.db2.gz KCOHHBBKTNDGHZ-GHMZBOCLSA-N 0 1 280.824 4.517 10 0 CJAEMN Cc1cncc([C@H](C)N[C@H](C)c2ccc(Cl)s2)c1 ZINC000184267686 333126218 /nfs/dbraw/zinc/12/62/18/333126218.db2.gz KCOHHBBKTNDGHZ-WDEREUQCSA-N 0 1 280.824 4.517 10 0 CJAEMN Cc1cncc([C@@H](C)N[C@@H](C)c2ccc(F)c(Cl)c2)c1 ZINC000184297332 333126869 /nfs/dbraw/zinc/12/68/69/333126869.db2.gz AGZFHEACJFYYLV-NWDGAFQWSA-N 0 1 292.785 4.594 10 0 CJAEMN Cc1cncc([C@H](C)N[C@H](C)c2ccc(F)c(Cl)c2)c1 ZINC000184297390 333126858 /nfs/dbraw/zinc/12/68/58/333126858.db2.gz AGZFHEACJFYYLV-NEPJUHHUSA-N 0 1 292.785 4.594 10 0 CJAEMN C[C@H](N[C@@H](C)c1cccc(Cl)c1F)c1cccs1 ZINC000184640525 333130837 /nfs/dbraw/zinc/13/08/37/333130837.db2.gz CDPKJVVJNQZAJK-UWVGGRQHSA-N 0 1 283.799 4.952 10 0 CJAEMN C[C@@H](N[C@@H](C)c1cccs1)c1cccc(Cl)c1F ZINC000184640547 333130900 /nfs/dbraw/zinc/13/09/00/333130900.db2.gz CDPKJVVJNQZAJK-ZJUUUORDSA-N 0 1 283.799 4.952 10 0 CJAEMN C[C@@H](N[C@@H](C)c1cccc(Cl)c1F)c1cccs1 ZINC000184640566 333130984 /nfs/dbraw/zinc/13/09/84/333130984.db2.gz CDPKJVVJNQZAJK-VHSXEESVSA-N 0 1 283.799 4.952 10 0 CJAEMN C[C@@H](N[C@H](C)c1cccc(Cl)c1F)c1cccs1 ZINC000184640585 333130954 /nfs/dbraw/zinc/13/09/54/333130954.db2.gz CDPKJVVJNQZAJK-NXEZZACHSA-N 0 1 283.799 4.952 10 0 CJAEMN COc1ccsc1[C@H](C)N[C@@H](C)c1ccc(C)c(F)c1 ZINC000186192707 260041238 /nfs/dbraw/zinc/04/12/38/260041238.db2.gz YXJXRRNTHQIVJP-RYUDHWBXSA-N 0 1 293.407 4.616 10 0 CJAEMN COc1ccsc1[C@@H](C)N[C@@H](C)c1ccc(C)c(F)c1 ZINC000186192744 333156379 /nfs/dbraw/zinc/15/63/79/333156379.db2.gz YXJXRRNTHQIVJP-NWDGAFQWSA-N 0 1 293.407 4.616 10 0 CJAEMN C/C(=C\c1ccccc1)CN1CCC[C@H]1c1csc(C)n1 ZINC000189919195 264338868 /nfs/dbraw/zinc/33/88/68/264338868.db2.gz MPTNUQCECUXDLQ-BJRSVTDJSA-N 0 1 298.455 4.692 10 0 CJAEMN C[C@@H](N[C@@H]1CCOc2ccccc21)c1csc(Cl)c1 ZINC000191122376 533526509 /nfs/dbraw/zinc/52/65/09/533526509.db2.gz VBOSYHDBCWNBNQ-ZWNOBZJWSA-N 0 1 293.819 4.576 10 0 CJAEMN CCC(C)(C)C1CCC(N[C@@H](C)c2ncc(C)o2)CC1 ZINC000220895685 333170185 /nfs/dbraw/zinc/17/01/85/333170185.db2.gz SYNAKPQYPDVKOU-NFOMZHRRSA-N 0 1 278.440 4.629 10 0 CJAEMN Cc1ccc(F)c(CN[C@@H](C)c2cccc(Cl)c2)c1 ZINC000227280859 333279234 /nfs/dbraw/zinc/27/92/34/333279234.db2.gz IDBTXGHEIWATAT-LBPRGKRZSA-N 0 1 277.770 4.638 10 0 CJAEMN Cc1ccc(F)c(CN[C@@H](C)c2ccc(Cl)cc2)c1 ZINC000227280894 333279266 /nfs/dbraw/zinc/27/92/66/333279266.db2.gz WMVJMIAPLINAPC-LBPRGKRZSA-N 0 1 277.770 4.638 10 0 CJAEMN Cc1ccc(F)c(CN[C@H](C)c2ccc(Cl)cc2)c1 ZINC000227280900 333279288 /nfs/dbraw/zinc/27/92/88/333279288.db2.gz WMVJMIAPLINAPC-GFCCVEGCSA-N 0 1 277.770 4.638 10 0 CJAEMN CCc1ccc([C@@H](C)NCc2cc(C)ccc2F)cc1 ZINC000227280940 333279464 /nfs/dbraw/zinc/27/94/64/333279464.db2.gz ZUICKPCMBBTLPI-CQSZACIVSA-N 0 1 271.379 4.547 10 0 CJAEMN CCc1ccc([C@H](C)NCc2cc(C)ccc2F)cc1 ZINC000227280943 333279355 /nfs/dbraw/zinc/27/93/55/333279355.db2.gz ZUICKPCMBBTLPI-AWEZNQCLSA-N 0 1 271.379 4.547 10 0 CJAEMN Cc1ccc(F)c(CN[C@@H](C)c2ccc(Cl)s2)c1 ZINC000227282839 333279360 /nfs/dbraw/zinc/27/93/60/333279360.db2.gz XGZMYSLGTDURSY-JTQLQIEISA-N 0 1 283.799 4.700 10 0 CJAEMN Cc1ccc(F)c(CN[C@H](C)c2ccc(Cl)s2)c1 ZINC000227282843 333279249 /nfs/dbraw/zinc/27/92/49/333279249.db2.gz XGZMYSLGTDURSY-SNVBAGLBSA-N 0 1 283.799 4.700 10 0 CJAEMN CCc1ccc(CN[C@@H](C)c2ccc(F)cc2Cl)cc1 ZINC000227659665 333287237 /nfs/dbraw/zinc/28/72/37/333287237.db2.gz JYYDTLYYAPGQIB-LBPRGKRZSA-N 0 1 291.797 4.892 10 0 CJAEMN CCc1ccc(CN[C@H](C)c2ccc(F)cc2Cl)cc1 ZINC000227659671 333287137 /nfs/dbraw/zinc/28/71/37/333287137.db2.gz JYYDTLYYAPGQIB-GFCCVEGCSA-N 0 1 291.797 4.892 10 0 CJAEMN COc1ccccc1[C@@H](C)N[C@@H](C)c1csc(Cl)c1 ZINC000230407102 333317616 /nfs/dbraw/zinc/31/76/16/333317616.db2.gz OGYLQKLSYFSOHR-WDEREUQCSA-N 0 1 295.835 4.822 10 0 CJAEMN COc1ccccc1[C@H](C)N[C@@H](C)c1csc(Cl)c1 ZINC000230407105 333317556 /nfs/dbraw/zinc/31/75/56/333317556.db2.gz OGYLQKLSYFSOHR-QWRGUYRKSA-N 0 1 295.835 4.822 10 0 CJAEMN COc1ccccc1[C@@H](C)N[C@H](C)c1csc(Cl)c1 ZINC000230407108 333317507 /nfs/dbraw/zinc/31/75/07/333317507.db2.gz OGYLQKLSYFSOHR-GHMZBOCLSA-N 0 1 295.835 4.822 10 0 CJAEMN COc1ccccc1[C@H](C)N[C@H](C)c1csc(Cl)c1 ZINC000230407110 333317524 /nfs/dbraw/zinc/31/75/24/333317524.db2.gz OGYLQKLSYFSOHR-MNOVXSKESA-N 0 1 295.835 4.822 10 0 CJAEMN COc1ccccc1[C@@H](C)NCc1ccc(C)c(Cl)c1 ZINC000234886004 333362732 /nfs/dbraw/zinc/36/27/32/333362732.db2.gz OTWYBWRGYUUUON-CYBMUJFWSA-N 0 1 289.806 4.508 10 0 CJAEMN COc1ccccc1[C@H](C)NCc1ccc(C)c(Cl)c1 ZINC000234900832 333362962 /nfs/dbraw/zinc/36/29/62/333362962.db2.gz OTWYBWRGYUUUON-ZDUSSCGKSA-N 0 1 289.806 4.508 10 0 CJAEMN CCCCC[N@@H+](Cc1cccc(C(=O)[O-])c1)[C@@H](C)CCC ZINC000263374740 330053067 /nfs/dbraw/zinc/05/30/67/330053067.db2.gz BPRHXQQPFRRKLJ-HNNXBMFYSA-N 0 1 291.435 4.566 10 0 CJAEMN CCCCC[N@@H+](Cc1cccc(C(=O)[O-])c1)[C@H](C)CCC ZINC000263374744 330053119 /nfs/dbraw/zinc/05/31/19/330053119.db2.gz BPRHXQQPFRRKLJ-OAHLLOKOSA-N 0 1 291.435 4.566 10 0 CJAEMN C[C@H](N[C@@H](C)c1ccc(Cl)cn1)c1cccc(Cl)c1 ZINC000274947767 525530307 /nfs/dbraw/zinc/53/03/07/525530307.db2.gz USPNNEKJVBIKGN-QWRGUYRKSA-N 0 1 295.213 4.800 10 0 CJAEMN C[C@@H](N[C@@H](C)c1cccc(Cl)c1)c1ccc(Cl)cn1 ZINC000274947769 525611508 /nfs/dbraw/zinc/61/15/08/525611508.db2.gz USPNNEKJVBIKGN-WDEREUQCSA-N 0 1 295.213 4.800 10 0 CJAEMN C[C@@H](NCc1sccc1Cl)c1ccc(Cl)cc1 ZINC000306074489 260114481 /nfs/dbraw/zinc/11/44/81/260114481.db2.gz FEIOTDXRVRWPAT-SECBINFHSA-N 0 1 286.227 4.906 10 0 CJAEMN C[C@H](NCc1sccc1Cl)c1ccc(Cl)cc1 ZINC000306074496 260114453 /nfs/dbraw/zinc/11/44/53/260114453.db2.gz FEIOTDXRVRWPAT-VIFPVBQESA-N 0 1 286.227 4.906 10 0 CJAEMN C[C@@H](NCc1csc(Cl)c1Cl)c1cccs1 ZINC000309919653 333051343 /nfs/dbraw/zinc/05/13/43/333051343.db2.gz RGHZMZLKTIHQKR-SSDOTTSWSA-N 0 1 292.256 4.967 10 0 CJAEMN Cc1cccc([C@H](C)NCc2sccc2Cl)c1 ZINC000310276796 333056302 /nfs/dbraw/zinc/05/63/02/333056302.db2.gz FZGLNSWTBAVECN-NSHDSACASA-N 0 1 265.809 4.561 10 0 CJAEMN Cc1ccc([C@H](C)NCc2sccc2Cl)cc1F ZINC000310610068 333060318 /nfs/dbraw/zinc/06/03/18/333060318.db2.gz AMYZZMQRHUCFOS-JTQLQIEISA-N 0 1 283.799 4.700 10 0 CJAEMN Cc1ccc([C@@H](C)NCc2sccc2Cl)cc1F ZINC000310610070 260222007 /nfs/dbraw/zinc/22/20/07/260222007.db2.gz AMYZZMQRHUCFOS-SNVBAGLBSA-N 0 1 283.799 4.700 10 0 CJAEMN CCc1ccc([C@@H](C)NCc2sccc2Cl)cc1 ZINC000310676470 333060760 /nfs/dbraw/zinc/06/07/60/333060760.db2.gz KEDWLJLZJLUYMQ-LLVKDONJSA-N 0 1 279.836 4.815 10 0 CJAEMN CCc1ccc([C@H](C)NCc2sccc2Cl)cc1 ZINC000310676476 333060830 /nfs/dbraw/zinc/06/08/30/333060830.db2.gz KEDWLJLZJLUYMQ-NSHDSACASA-N 0 1 279.836 4.815 10 0 CJAEMN Cc1ccc([C@@H](C)NCc2ccsc2Cl)c(C)c1 ZINC000312560500 260149350 /nfs/dbraw/zinc/14/93/50/260149350.db2.gz SEQVLIZZFYUDCT-GFCCVEGCSA-N 0 1 279.836 4.869 10 0 CJAEMN Cc1ccc([C@H](C)NCc2ccsc2Cl)c(C)c1 ZINC000312560502 260149570 /nfs/dbraw/zinc/14/95/70/260149570.db2.gz SEQVLIZZFYUDCT-LBPRGKRZSA-N 0 1 279.836 4.869 10 0 CJAEMN CCc1ccc([C@@H](C)NCc2ccsc2Cl)cc1 ZINC000312561351 260149391 /nfs/dbraw/zinc/14/93/91/260149391.db2.gz TYRDMTZWJXUVDV-LLVKDONJSA-N 0 1 279.836 4.815 10 0 CJAEMN CCc1ccc([C@H](C)NCc2ccsc2Cl)cc1 ZINC000312561352 260149476 /nfs/dbraw/zinc/14/94/76/260149476.db2.gz TYRDMTZWJXUVDV-NSHDSACASA-N 0 1 279.836 4.815 10 0 CJAEMN C[C@@H](NCc1ccsc1Cl)c1ccc(Cl)cc1 ZINC000312563411 260149822 /nfs/dbraw/zinc/14/98/22/260149822.db2.gz WJQWSISIHDLXOA-SECBINFHSA-N 0 1 286.227 4.906 10 0 CJAEMN C[C@H](NCc1ccsc1Cl)c1ccc(Cl)cc1 ZINC000312563414 260150070 /nfs/dbraw/zinc/15/00/70/260150070.db2.gz WJQWSISIHDLXOA-VIFPVBQESA-N 0 1 286.227 4.906 10 0 CJAEMN Cc1ccccc1[C@@H](C)NCc1ccsc1Cl ZINC000312582882 260158396 /nfs/dbraw/zinc/15/83/96/260158396.db2.gz NMIVRGATZRJPIS-LLVKDONJSA-N 0 1 265.809 4.561 10 0 CJAEMN Cc1ccccc1[C@H](C)NCc1ccsc1Cl ZINC000312582883 260158372 /nfs/dbraw/zinc/15/83/72/260158372.db2.gz NMIVRGATZRJPIS-NSHDSACASA-N 0 1 265.809 4.561 10 0 CJAEMN Cc1cccc([C@@H](C)NCc2ccsc2Cl)c1 ZINC000312588385 260162760 /nfs/dbraw/zinc/16/27/60/260162760.db2.gz UIOBKJBPIONDOW-LLVKDONJSA-N 0 1 265.809 4.561 10 0 CJAEMN Cc1cccc([C@H](C)NCc2ccsc2Cl)c1 ZINC000312588388 260162560 /nfs/dbraw/zinc/16/25/60/260162560.db2.gz UIOBKJBPIONDOW-NSHDSACASA-N 0 1 265.809 4.561 10 0 CJAEMN Cc1ccc([C@@H](C)NCc2ccsc2Cl)cc1C ZINC000312750827 326960386 /nfs/dbraw/zinc/96/03/86/326960386.db2.gz HLIACFVFPXGJGN-GFCCVEGCSA-N 0 1 279.836 4.869 10 0 CJAEMN Clc1sccc1CN[C@H]1CCc2cc(Cl)ccc21 ZINC000312765735 260198658 /nfs/dbraw/zinc/19/86/58/260198658.db2.gz YYPFTYKMEUZFFW-ZDUSSCGKSA-N 0 1 298.238 4.832 10 0 CJAEMN Cc1ccc([C@H](C)NCc2cccc(O)c2Cl)c(C)c1 ZINC000328505342 333534145 /nfs/dbraw/zinc/53/41/45/333534145.db2.gz ZKSNTWLBSPWBQO-ZDUSSCGKSA-N 0 1 289.806 4.513 10 0 CJAEMN C[C@H](NCc1csc(Cl)c1Cl)c1cccs1 ZINC000381401829 336061478 /nfs/dbraw/zinc/06/14/78/336061478.db2.gz RGHZMZLKTIHQKR-ZETCQYMHSA-N 0 1 292.256 4.967 10 0 CJAEMN Cc1cccc([C@@H](C)NCc2sccc2Cl)c1 ZINC000383934680 336119507 /nfs/dbraw/zinc/11/95/07/336119507.db2.gz FZGLNSWTBAVECN-LLVKDONJSA-N 0 1 265.809 4.561 10 0 CJAEMN C[C@H](NCc1sccc1Cl)c1cccc(Cl)c1 ZINC000384015708 336121359 /nfs/dbraw/zinc/12/13/59/336121359.db2.gz QLIUYJSMARYOHN-VIFPVBQESA-N 0 1 286.227 4.906 10 0 CJAEMN Cc1ccc([C@H](C)N[C@H](C)c2ccc(Cl)cn2)cc1F ZINC000480204681 331763034 /nfs/dbraw/zinc/76/30/34/331763034.db2.gz TVMBEWVEBODSKQ-NWDGAFQWSA-N 0 1 292.785 4.594 10 0 CJAEMN CCc1ccc([C@@H](C)N[C@@H](C)c2ccc(Cl)cn2)cc1 ZINC000480333284 331768559 /nfs/dbraw/zinc/76/85/59/331768559.db2.gz LOOQWWOJJFMHBI-OLZOCXBDSA-N 0 1 288.822 4.709 10 0 CJAEMN CCc1ccc([C@H](C)N[C@H](C)c2ccc(Cl)cn2)cc1 ZINC000480333285 331768615 /nfs/dbraw/zinc/76/86/15/331768615.db2.gz LOOQWWOJJFMHBI-QWHCGFSZSA-N 0 1 288.822 4.709 10 0 CJAEMN CCc1ccc([C@H](C)N[C@@H](C)c2ccc(Cl)cn2)cc1 ZINC000480333286 331768580 /nfs/dbraw/zinc/76/85/80/331768580.db2.gz LOOQWWOJJFMHBI-STQMWFEESA-N 0 1 288.822 4.709 10 0 CJAEMN