smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name N#CC(=Cc1coc2ccccc12)C(=O)c1cccc(-c2nnn[n-]2)c1 ZINC000826379664 1429388415 /nfs/dbraw/zinc/38/84/15/1429388415.db2.gz YKCSCDSTTDHHQU-NTEUORMPSA-N -1 1 341.330 3.403 20 50 EGGDMM CC(=NNC(=O)c1cccc(-c2nnn[n-]2)c1)c1ccc(C(C)C)cc1 ZINC000735447715 1426548725 /nfs/dbraw/zinc/54/87/25/1426548725.db2.gz LQPNZCHFXLWZEU-UHFFFAOYSA-N -1 1 348.410 3.144 20 50 EGGDMM CCOc1cccc(C=C(C#N)C(=O)c2cccc(-c3nnn[n-]3)c2)c1 ZINC000825649103 1429840359 /nfs/dbraw/zinc/84/03/59/1429840359.db2.gz LEBKDLXDDIVREJ-SXGWCWSVSA-N -1 1 345.362 3.055 20 50 EGGDMM Cc1[nH]c2ccccc2c1C(=O)C(C#N)=Cc1ccc(-c2nnn[n-]2)o1 ZINC000822009955 945916749 /nfs/dbraw/zinc/91/67/49/945916749.db2.gz IBTNKAHMWXIUAM-DHZHZOJOSA-N -1 1 344.334 3.039 20 50 EGGDMM Cc1[nH]c2ccccc2c1C(=O)C(C#N)=Cc1ccc(-c2nn[n-]n2)o1 ZINC000822009955 945916758 /nfs/dbraw/zinc/91/67/58/945916758.db2.gz IBTNKAHMWXIUAM-DHZHZOJOSA-N -1 1 344.334 3.039 20 50 EGGDMM CC(C)(C)[Si](C)(C)O[C@H]1CCN(Cc2cncc(C(=O)[O-])c2)C1 ZINC001590451289 990012019 /nfs/dbraw/zinc/01/20/19/990012019.db2.gz IDPJLYQZMHQJFJ-HNNXBMFYSA-N -1 1 336.508 3.376 20 50 EGGDMM Cc1cccc2[nH]c(C(C#N)=Cc3ccc(-c4nnn[n-]4)s3)nc21 ZINC000822333128 1425904000 /nfs/dbraw/zinc/90/40/00/1425904000.db2.gz XREFMBKHQDEQIS-YFHOEESVSA-N -1 1 333.380 3.177 20 50 EGGDMM Cc1cccc2nc(C(C#N)=Cc3ccc(-c4nn[n-]n4)s3)[nH]c21 ZINC000822333128 1425904002 /nfs/dbraw/zinc/90/40/02/1425904002.db2.gz XREFMBKHQDEQIS-YFHOEESVSA-N -1 1 333.380 3.177 20 50 EGGDMM Cc1cccc2nc(C(C#N)=Cc3ccc(-c4nnn[n-]4)s3)[nH]c21 ZINC000822333128 1425904005 /nfs/dbraw/zinc/90/40/05/1425904005.db2.gz XREFMBKHQDEQIS-YFHOEESVSA-N -1 1 333.380 3.177 20 50 EGGDMM CC(C)c1cccc(NC(=O)NNc2cccc(-c3nnn[n-]3)c2)c1 ZINC000824347542 1441944477 /nfs/dbraw/zinc/94/44/77/1441944477.db2.gz CRVGWTOKAOVUQK-UHFFFAOYSA-N -1 1 337.387 3.139 20 50 EGGDMM N#CC(=Cc1ccccc1Cl)C(=O)c1cccc(-c2nnn[n-]2)c1 ZINC000826379043 1443959336 /nfs/dbraw/zinc/95/93/36/1443959336.db2.gz HWHGNKNPELPNMQ-RIYZIHGNSA-N -1 1 335.754 3.310 20 50 EGGDMM N#CC(=Cc1ccc(-c2nn[n-]n2)s1)c1nc(-c2ccccc2)no1 ZINC000822795853 1447081996 /nfs/dbraw/zinc/08/19/96/1447081996.db2.gz ILESCHJSCVNIJH-DHZHZOJOSA-N -1 1 347.363 3.042 20 50 EGGDMM CCCCCC[C@H](C)C(=O)NNc1oc(C(C)C)nc1-c1nn[n-]n1 ZINC000736447144 944823513 /nfs/dbraw/zinc/82/35/13/944823513.db2.gz RCRPQGITAQBSOR-NSHDSACASA-N -1 1 349.439 3.028 20 50 EGGDMM Cc1ccc(C(=O)C(C#N)=Cc2cc(-c3nnn[n-]3)cs2)s1 ZINC000822225175 1423404630 /nfs/dbraw/zinc/40/46/30/1423404630.db2.gz RDMXGQIYGWQJKF-WTKPLQERSA-N -1 1 327.394 3.088 20 50 EGGDMM Cc1ccc(F)cc1C=C(C#N)C(=O)c1cccc(-c2nnn[n-]2)c1 ZINC000826289506 1442361211 /nfs/dbraw/zinc/36/12/11/1442361211.db2.gz CVPFFUVZVDMKSD-NVNXTCNLSA-N -1 1 333.326 3.104 20 50 EGGDMM CC(C)CC[C@H]1CCCC1=NNC(=O)c1cccc(-c2nnn[n-]2)c1 ZINC000735798052 1446642002 /nfs/dbraw/zinc/64/20/02/1446642002.db2.gz URWLCVXORHUARA-CYBMUJFWSA-N -1 1 340.431 3.189 20 50 EGGDMM N#CC(=Cc1cc(-c2nn[n-]n2)cs1)c1nc(-c2ccccc2)no1 ZINC000822796714 1443625910 /nfs/dbraw/zinc/62/59/10/1443625910.db2.gz WTFOCHCJKPPUSJ-WDZFZDKYSA-N -1 1 347.363 3.042 20 50 EGGDMM N#CC(=CC=Cc1ccc(F)cc1)C(=O)c1cccc(-c2nnn[n-]2)c1 ZINC000826379160 1429135230 /nfs/dbraw/zinc/13/52/30/1429135230.db2.gz KQLLCIXFLCHMPH-LIPBFZAISA-N -1 1 345.337 3.352 20 50 EGGDMM CCC(=CC(=O)NNc1cccc(-c2nnn[n-]2)c1)c1ccc(C)cc1 ZINC000825027979 1425254842 /nfs/dbraw/zinc/25/48/42/1425254842.db2.gz BATQPHYLIRARKZ-WYMLVPIESA-N -1 1 348.410 3.112 20 50 EGGDMM CCc1ccc(C=C(C#N)C(=O)c2cccc(-c3nnn[n-]3)c2)cc1 ZINC000825704837 1426888572 /nfs/dbraw/zinc/88/85/72/1426888572.db2.gz OAXDVPCTESYEDO-YVLHZVERSA-N -1 1 329.363 3.219 20 50 EGGDMM Cc1cc(C(C#N)=Cc2ccc(-c3nnn[n-]3)s2)ccc1[N+](=O)[O-] ZINC000826261764 1446632884 /nfs/dbraw/zinc/63/28/84/1446632884.db2.gz RBAMAVFUWUXGEU-XFFZJAGNSA-N -1 1 338.352 3.209 20 50 EGGDMM CC(C)(C)[Si](C)(C)O[C@@H]1CCN(Cc2cncc(C(=O)[O-])c2)C1 ZINC001590451292 990011901 /nfs/dbraw/zinc/01/19/01/990011901.db2.gz IDPJLYQZMHQJFJ-OAHLLOKOSA-N -1 1 336.508 3.376 20 50 EGGDMM Cc1cccc(C(=O)C(C#N)=Cc2cccc(-c3nnn[n-]3)c2)c1C ZINC000737382622 1427115104 /nfs/dbraw/zinc/11/51/04/1427115104.db2.gz ZFUQQHPYZJXPHT-MHWRWJLKSA-N -1 1 329.363 3.273 20 50 EGGDMM Cc1cccc(C)c1C=C(C#N)C(=O)c1cccc(-c2nnn[n-]2)c1 ZINC000826296743 1429951658 /nfs/dbraw/zinc/95/16/58/1429951658.db2.gz HUZWJQRCCOZVBV-YBEGLDIGSA-N -1 1 329.363 3.273 20 50 EGGDMM Cc1cc(F)ccc1C=C(C#N)C(=O)c1cccc(-c2nnn[n-]2)c1 ZINC000826268818 1441886216 /nfs/dbraw/zinc/88/62/16/1441886216.db2.gz OUEZAPAZPAYYAG-NVNXTCNLSA-N -1 1 333.326 3.104 20 50 EGGDMM Cc1ccc2c(C(=O)C(C#N)=Cc3ccc(-c4nnn[n-]4)o3)c[nH]c2c1 ZINC000822274666 946041008 /nfs/dbraw/zinc/04/10/08/946041008.db2.gz FCIMUYAVFSXMPU-XFFZJAGNSA-N -1 1 344.334 3.039 20 50 EGGDMM Cc1ccc2c(C(=O)C(C#N)=Cc3ccc(-c4nn[n-]n4)o3)c[nH]c2c1 ZINC000822274666 946041025 /nfs/dbraw/zinc/04/10/25/946041025.db2.gz FCIMUYAVFSXMPU-XFFZJAGNSA-N -1 1 344.334 3.039 20 50 EGGDMM N#CC(=Cc1ccc(-c2nnn[n-]2)o1)c1nc2cc(F)ccc2s1 ZINC000822796737 946187898 /nfs/dbraw/zinc/18/78/98/946187898.db2.gz XFCZZOGSLQKWSP-VMPITWQZSA-N -1 1 338.327 3.273 20 50 EGGDMM N#CC(=Cc1ccc(-c2nn[n-]n2)o1)c1nc2cc(F)ccc2s1 ZINC000822796737 946187903 /nfs/dbraw/zinc/18/79/03/946187903.db2.gz XFCZZOGSLQKWSP-VMPITWQZSA-N -1 1 338.327 3.273 20 50 EGGDMM Cc1cc(C)cc(C(=O)C(C#N)=Cc2ccc(-c3nnn[n-]3)s2)c1 ZINC000822196557 1425348896 /nfs/dbraw/zinc/34/88/96/1425348896.db2.gz NJFCPLYRUAPDJE-MDWZMJQESA-N -1 1 335.392 3.335 20 50 EGGDMM O=C(CCCC1CCCCC1)NNc1ccc(-c2nnn[n-]2)cc1 ZINC000826406354 1443648555 /nfs/dbraw/zinc/64/85/55/1443648555.db2.gz STSUKRAEZBPFGC-UHFFFAOYSA-N -1 1 328.420 3.060 20 50 EGGDMM Cc1cc(C(C#N)=Cc2ccc(-c3nnn[n-]3)cc2)ccc1[N+](=O)[O-] ZINC000826261508 1446124942 /nfs/dbraw/zinc/12/49/42/1446124942.db2.gz IINQOIYAAWEVBY-DHDCSXOGSA-N -1 1 332.323 3.148 20 50 EGGDMM Cc1cc(C)cc(C(=O)C(C#N)=Cc2ccc(F)c(-c3nnn[n-]3)c2)c1 ZINC000826264606 1425622616 /nfs/dbraw/zinc/62/26/16/1425622616.db2.gz UCBHTHRDEZPONV-OVCLIPMQSA-N -1 1 347.353 3.413 20 50 EGGDMM Cc1ccc(C=C(C#N)C(=O)c2cccc(-c3nnn[n-]3)c2)cc1C ZINC000826286367 1425954289 /nfs/dbraw/zinc/95/42/89/1425954289.db2.gz ZKELOYQBMALIER-MFOYZWKCSA-N -1 1 329.363 3.273 20 50 EGGDMM CCC[C@H](C=NNC(=O)c1cccc(-c2nnn[n-]2)c1)c1ccccc1 ZINC000825232336 1443355960 /nfs/dbraw/zinc/35/59/60/1443355960.db2.gz GKBIDVPLWQZAIX-QGZVFWFLSA-N -1 1 348.410 3.166 20 50 EGGDMM N#CC(=Cc1ccccc1-c1nnn[n-]1)C(=O)c1c[nH]c2ccccc21 ZINC000826379119 1443581175 /nfs/dbraw/zinc/58/11/75/1443581175.db2.gz JIFPHSHBKGEITF-UKTHLTGXSA-N -1 1 340.346 3.138 20 50 EGGDMM Cc1cccc(C(=O)C(C#N)=Cc2ccc(-c3nnn[n-]3)cc2)c1C ZINC000737380505 1425890997 /nfs/dbraw/zinc/89/09/97/1425890997.db2.gz BLWVXXWPISCXKG-MHWRWJLKSA-N -1 1 329.363 3.273 20 50 EGGDMM CC(C)(C)C1CCC(=NNC(=O)c2cccc(-c3nnn[n-]3)c2)CC1 ZINC000735598347 1443955413 /nfs/dbraw/zinc/95/54/13/1443955413.db2.gz YQBDLFFQJAEWHE-UHFFFAOYSA-N -1 1 340.431 3.189 20 50 EGGDMM N#CC(=Cc1ccc(-c2nnn[n-]2)o1)c1nc2cc(F)ccc2s1 ZINC000822796738 946187190 /nfs/dbraw/zinc/18/71/90/946187190.db2.gz XFCZZOGSLQKWSP-YVMONPNESA-N -1 1 338.327 3.273 20 50 EGGDMM N#CC(=Cc1ccc(-c2nn[n-]n2)o1)c1nc2cc(F)ccc2s1 ZINC000822796738 946187198 /nfs/dbraw/zinc/18/71/98/946187198.db2.gz XFCZZOGSLQKWSP-YVMONPNESA-N -1 1 338.327 3.273 20 50 EGGDMM C=C(CBr)CN(CCC(=O)[O-])Cc1ccc(F)c(F)c1 ZINC001588605937 983695641 /nfs/dbraw/zinc/69/56/41/983695641.db2.gz RNIPPCONMHLTBA-UHFFFAOYSA-N -1 1 348.187 3.193 20 50 EGGDMM COC1([C@@H](C(=O)[O-])N2CC[C@H](O[Si](C)(C)C(C)(C)C)C2)CCC1 ZINC001599083667 997054712 /nfs/dbraw/zinc/05/47/12/997054712.db2.gz XNFADKFFJFHJSE-UONOGXRCSA-N -1 1 343.540 3.105 20 50 EGGDMM N#CC(C#N)=CNc1ccc(Oc2ccccc2-c2nnn[n-]2)c(F)c1 ZINC000822801897 1443248908 /nfs/dbraw/zinc/24/89/08/1443248908.db2.gz QLEIYGUTQRFXQM-UHFFFAOYSA-N -1 1 347.313 3.141 20 50 EGGDMM N#CC(=Cc1ccc(Cl)s1)C(=O)c1cccc(-c2nnn[n-]2)c1 ZINC000826379177 1447023331 /nfs/dbraw/zinc/02/33/31/1447023331.db2.gz KZXYYGQKHDPNRX-XFFZJAGNSA-N -1 1 341.783 3.371 20 50 EGGDMM CCCc1ccc(C(=O)C(C#N)=Cc2ccc(-c3nnn[n-]3)o2)cc1 ZINC000821139451 945640729 /nfs/dbraw/zinc/64/07/29/945640729.db2.gz ZRIHWOFDCGUPEA-GXDHUFHOSA-N -1 1 333.351 3.202 20 50 EGGDMM CCCc1ccc(C(=O)C(C#N)=Cc2ccc(-c3nn[n-]n3)o2)cc1 ZINC000821139451 945640733 /nfs/dbraw/zinc/64/07/33/945640733.db2.gz ZRIHWOFDCGUPEA-GXDHUFHOSA-N -1 1 333.351 3.202 20 50 EGGDMM Cc1ccc2c(C(=O)C(C#N)=Cc3ccc(-c4nnn[n-]4)o3)c[nH]c2c1 ZINC000822274667 946038981 /nfs/dbraw/zinc/03/89/81/946038981.db2.gz FCIMUYAVFSXMPU-YRNVUSSQSA-N -1 1 344.334 3.039 20 50 EGGDMM Cc1ccc2c(C(=O)C(C#N)=Cc3ccc(-c4nn[n-]n4)o3)c[nH]c2c1 ZINC000822274667 946038994 /nfs/dbraw/zinc/03/89/94/946038994.db2.gz FCIMUYAVFSXMPU-YRNVUSSQSA-N -1 1 344.334 3.039 20 50 EGGDMM CC[C@@H](C)c1ccc(C(=O)NNc2cccc(-c3nnn[n-]3)c2)cc1 ZINC000825076115 1425025599 /nfs/dbraw/zinc/02/55/99/1425025599.db2.gz TTYIEUTXMDOJQF-GFCCVEGCSA-N -1 1 336.399 3.137 20 50 EGGDMM CC(=NNC(=O)c1ccc(-c2nnn[n-]2)cc1)[C@@H](C)C1CCCCC1 ZINC000819773188 1425705989 /nfs/dbraw/zinc/70/59/89/1425705989.db2.gz RLRWDEAOIHFDHR-GFCCVEGCSA-N -1 1 340.431 3.189 20 50 EGGDMM CC(C)[C@H]1CCC(=NNC(=O)c2cccc(-c3nnn[n-]3)c2)C[C@@H]1C ZINC000824216695 1442229420 /nfs/dbraw/zinc/22/94/20/1442229420.db2.gz VHDYAWOISMLMSW-BLLLJJGKSA-N -1 1 340.431 3.045 20 50 EGGDMM CC(C)(C)[Si](C)(C)O[C@@H]1CCN(Cc2cccc(C(=O)[O-])n2)C1 ZINC001590452162 990017570 /nfs/dbraw/zinc/01/75/70/990017570.db2.gz ZLGYNPCJXPQDLS-CQSZACIVSA-N -1 1 336.508 3.376 20 50 EGGDMM CC(C)(C)[Si](C)(C)OC[C@@H]1CCCN1Cc1cc(C(=O)[O-])no1 ZINC001590452099 990017878 /nfs/dbraw/zinc/01/78/78/990017878.db2.gz XJVGEHJTIANRGJ-LBPRGKRZSA-N -1 1 340.496 3.359 20 50 EGGDMM Cc1ccc(C)c(C=C(C#N)C(=O)c2cccc(-c3nnn[n-]3)c2)c1 ZINC000826285360 1425034738 /nfs/dbraw/zinc/03/47/38/1425034738.db2.gz XMIXZWKZDIECIX-YVLHZVERSA-N -1 1 329.363 3.273 20 50 EGGDMM Cc1cccc(C(=O)C(C#N)=Cc2cc(-c3nn[n-]n3)cs2)c1C ZINC000822284561 1426718322 /nfs/dbraw/zinc/71/83/22/1426718322.db2.gz VCJBIGMHPNXJPM-SDQBBNPISA-N -1 1 335.392 3.335 20 50 EGGDMM CC[C@H](C)c1ccc(C(=O)NNc2cccc(-c3nnn[n-]3)c2)cc1 ZINC000825076116 1426796027 /nfs/dbraw/zinc/79/60/27/1426796027.db2.gz TTYIEUTXMDOJQF-LBPRGKRZSA-N -1 1 336.399 3.137 20 50 EGGDMM Cc1cccc(C)c1NC(=O)C(C#N)=Cc1ccccc1-c1nnn[n-]1 ZINC000826297006 1430111832 /nfs/dbraw/zinc/11/18/32/1430111832.db2.gz RMMNAWWPKDEDBZ-GDNBJRDFSA-N -1 1 344.378 3.029 20 50 EGGDMM Cc1cc(C)cc(C(=O)C(C#N)=Cc2ccc(-c3nnn[n-]3)s2)c1 ZINC000822196556 1442072185 /nfs/dbraw/zinc/07/21/85/1442072185.db2.gz NJFCPLYRUAPDJE-JYRVWZFOSA-N -1 1 335.392 3.335 20 50 EGGDMM CC(C)(C)[Si](C)(C)OC[C@H]1CCCN1Cc1cc(C(=O)[O-])no1 ZINC001590452097 990017928 /nfs/dbraw/zinc/01/79/28/990017928.db2.gz XJVGEHJTIANRGJ-GFCCVEGCSA-N -1 1 340.496 3.359 20 50 EGGDMM CC(C)C(=NNC(=O)c1ccc(-c2nnn[n-]2)cc1)C1CCCCC1 ZINC000735684454 1427340525 /nfs/dbraw/zinc/34/05/25/1427340525.db2.gz NNYKOXIMNZIQPK-UHFFFAOYSA-N -1 1 340.431 3.189 20 50 EGGDMM Cc1cccc(C(=O)C(C#N)=Cc2ccc(-c3nnn[n-]3)cc2F)c1C ZINC000822284301 1443631633 /nfs/dbraw/zinc/63/16/33/1443631633.db2.gz NXWJNEBGHHFZRL-NVNXTCNLSA-N -1 1 347.353 3.413 20 50 EGGDMM N#CC(=Cc1cccc(-c2nnn[n-]2)c1)C(=O)c1ccc(Cl)s1 ZINC000826379209 1427997126 /nfs/dbraw/zinc/99/71/26/1427997126.db2.gz LVBJVLDHOLHLNA-XFFZJAGNSA-N -1 1 341.783 3.371 20 50 EGGDMM Cc1cc(C(C#N)=Cc2ccc(-c3nnn[n-]3)cc2)ccc1[N+](=O)[O-] ZINC000826261509 1427124466 /nfs/dbraw/zinc/12/44/66/1427124466.db2.gz IINQOIYAAWEVBY-OQLLNIDSSA-N -1 1 332.323 3.148 20 50 EGGDMM N#CC(=Cc1cc(-c2nn[n-]n2)cs1)C(=O)c1cc2ccccc2o1 ZINC000822796031 1442376243 /nfs/dbraw/zinc/37/62/43/1442376243.db2.gz KNXFKJDEIWWYKD-WZUFQYTHSA-N -1 1 347.359 3.464 20 50 EGGDMM CC(C)[C@@H]1CCC(=NNC(=O)c2ccc(-c3nnn[n-]3)cc2)C[C@H]1C ZINC000824213975 1443680289 /nfs/dbraw/zinc/68/02/89/1443680289.db2.gz DLOUCMKSEIOGAU-WBMJQRKESA-N -1 1 340.431 3.045 20 50 EGGDMM Cc1ccsc1C(=O)C(C#N)=Cc1ccc(F)c(-c2nnn[n-]2)c1 ZINC000826315382 1446455334 /nfs/dbraw/zinc/45/53/34/1446455334.db2.gz IASGAESLXICAGR-IZZDOVSWSA-N -1 1 339.355 3.166 20 50 EGGDMM Cc1cc(C)cc(C(=O)C(C#N)=Cc2ccc(F)c(-c3nnn[n-]3)c2)c1 ZINC000826264605 1446771289 /nfs/dbraw/zinc/77/12/89/1446771289.db2.gz UCBHTHRDEZPONV-NVNXTCNLSA-N -1 1 347.353 3.413 20 50 EGGDMM Cc1cc(C(C#N)=Cc2cccc(-c3nnn[n-]3)c2)ccc1[N+](=O)[O-] ZINC000826261503 1446250244 /nfs/dbraw/zinc/25/02/44/1446250244.db2.gz IEOBUWNUVFOUIN-DHDCSXOGSA-N -1 1 332.323 3.148 20 50 EGGDMM Cc1cccc2[nH]c(C(C#N)=Cc3ccc(-c4nnn[n-]4)cc3F)nc21 ZINC000822332730 1424988524 /nfs/dbraw/zinc/98/85/24/1424988524.db2.gz RSPGTDFSCSSSOK-QPEQYQDCSA-N -1 1 345.341 3.255 20 50 EGGDMM Cc1cccc2nc(C(C#N)=Cc3ccc(-c4nn[n-]n4)cc3F)[nH]c21 ZINC000822332730 1424988529 /nfs/dbraw/zinc/98/85/29/1424988529.db2.gz RSPGTDFSCSSSOK-QPEQYQDCSA-N -1 1 345.341 3.255 20 50 EGGDMM Cc1cccc2nc(C(C#N)=Cc3ccc(-c4nnn[n-]4)cc3F)[nH]c21 ZINC000822332730 1424988533 /nfs/dbraw/zinc/98/85/33/1424988533.db2.gz RSPGTDFSCSSSOK-QPEQYQDCSA-N -1 1 345.341 3.255 20 50 EGGDMM CN(Cc1cccc(-c2nnn[n-]2)c1)C(=CC#N)c1ccc(F)cc1 ZINC000821612391 1425796597 /nfs/dbraw/zinc/79/65/97/1425796597.db2.gz TZEMAPJEPBCYCS-MFOYZWKCSA-N -1 1 334.358 3.002 20 50 EGGDMM N#CC(=Cc1cc2ccccc2o1)C(=O)c1cccc(-c2nnn[n-]2)c1 ZINC000826379728 1430225931 /nfs/dbraw/zinc/22/59/31/1430225931.db2.gz ZUFGRCVDQOBDIJ-XNTDXEJSSA-N -1 1 341.330 3.403 20 50 EGGDMM CCCCCC[C@H](CC)C(=O)NNc1cccc(-c2nnn[n-]2)c1 ZINC000825271941 1446739310 /nfs/dbraw/zinc/73/93/10/1446739310.db2.gz RISFEEIRSLQUSQ-ZDUSSCGKSA-N -1 1 330.436 3.306 20 50 EGGDMM Cc1cccc(C(=O)C(C#N)=Cc2ccc(-c3nn[n-]n3)s2)c1C ZINC000822284355 946044909 /nfs/dbraw/zinc/04/49/09/946044909.db2.gz PTYDIYMPOLXXSE-WQLSENKSSA-N -1 1 335.392 3.335 20 50 EGGDMM CCCCC[C@H](CC)C(=O)NNc1oc(C(C)C)nc1-c1nn[n-]n1 ZINC000825265788 608583912 /nfs/dbraw/zinc/58/39/12/608583912.db2.gz BAGVZIBTWIVLMA-NSHDSACASA-N -1 1 349.439 3.028 20 50 EGGDMM N#CC(=Cc1cc(-c2nn[n-]n2)cs1)C(=O)c1c[nH]c2ccccc21 ZINC000822795729 1441803615 /nfs/dbraw/zinc/80/36/15/1441803615.db2.gz GGHJEYICVGXMHA-YHYXMXQVSA-N -1 1 346.375 3.199 20 50 EGGDMM Cc1cccc(C(=O)C(C#N)=Cc2ccc(-c3nnn[n-]3)s2)c1C ZINC000822284356 1443297880 /nfs/dbraw/zinc/29/78/80/1443297880.db2.gz PTYDIYMPOLXXSE-XYOKQWHBSA-N -1 1 335.392 3.335 20 50 EGGDMM CC(C)CC(=NNC(=O)c1cccc(-c2nnn[n-]2)c1)c1ccccc1 ZINC000735759251 1446767099 /nfs/dbraw/zinc/76/70/99/1446767099.db2.gz QNQHFDUGNKIZAT-UHFFFAOYSA-N -1 1 348.410 3.047 20 50 EGGDMM Cc1ccc(F)cc1C=C(C#N)C(=O)c1cccc(-c2nnn[n-]2)c1 ZINC000826289507 1446939275 /nfs/dbraw/zinc/93/92/75/1446939275.db2.gz CVPFFUVZVDMKSD-OVCLIPMQSA-N -1 1 333.326 3.104 20 50 EGGDMM N#CC(=Cc1ccc(-c2nn[n-]n2)s1)C(=O)c1cc2ccccc2o1 ZINC000822795438 946173919 /nfs/dbraw/zinc/17/39/19/946173919.db2.gz ASZOCXJFCFADKZ-XFFZJAGNSA-N -1 1 347.359 3.464 20 50 EGGDMM CCCCC[C@@H](CC)C(=O)NNc1oc(C(C)C)nc1-c1nn[n-]n1 ZINC000825265778 608583650 /nfs/dbraw/zinc/58/36/50/608583650.db2.gz BAGVZIBTWIVLMA-LLVKDONJSA-N -1 1 349.439 3.028 20 50 EGGDMM COc1ccc(C=C(C#N)c2nc(C)c(C)s2)cc1-c1nnn[n-]1 ZINC000737076770 1428990601 /nfs/dbraw/zinc/99/06/01/1428990601.db2.gz PCHYYHHWHQELPM-WUXMJOGZSA-N -1 1 338.396 3.013 20 50 EGGDMM Cc1cccc2[nH]c(C(C#N)=Cc3ccccc3-c3nnn[n-]3)nc21 ZINC000826304278 1429247973 /nfs/dbraw/zinc/24/79/73/1429247973.db2.gz FOFJPCKCNKUIAM-LCYFTJDESA-N -1 1 327.351 3.116 20 50 EGGDMM Cc1cccc2nc(C(C#N)=Cc3ccccc3-c3nn[n-]n3)[nH]c21 ZINC000826304278 1429247979 /nfs/dbraw/zinc/24/79/79/1429247979.db2.gz FOFJPCKCNKUIAM-LCYFTJDESA-N -1 1 327.351 3.116 20 50 EGGDMM Cc1cccc2nc(C(C#N)=Cc3ccccc3-c3nnn[n-]3)[nH]c21 ZINC000826304278 1429247986 /nfs/dbraw/zinc/24/79/86/1429247986.db2.gz FOFJPCKCNKUIAM-LCYFTJDESA-N -1 1 327.351 3.116 20 50 EGGDMM Cc1ccsc1C(=O)C(C#N)=Cc1ccc(-c2nnn[n-]2)cc1F ZINC000822378592 1424985656 /nfs/dbraw/zinc/98/56/56/1424985656.db2.gz BUYIINMBWUBUSE-WUXMJOGZSA-N -1 1 339.355 3.166 20 50 EGGDMM N#CC(=CC=Cc1ccc(F)cc1)C(=O)c1cccc(-c2nnn[n-]2)c1 ZINC000826379161 1442048571 /nfs/dbraw/zinc/04/85/71/1442048571.db2.gz KQLLCIXFLCHMPH-PPFNYLEDSA-N -1 1 345.337 3.352 20 50 EGGDMM Cc1cccc(C(=O)C(C#N)=Cc2cc(-c3nn[n-]n3)cs2)c1C ZINC000822284562 1441506081 /nfs/dbraw/zinc/50/60/81/1441506081.db2.gz VCJBIGMHPNXJPM-WUXMJOGZSA-N -1 1 335.392 3.335 20 50 EGGDMM CCC(=CC(=O)NNc1ccc(-c2nnn[n-]2)cc1)c1ccc(C)cc1 ZINC000825029440 1442445457 /nfs/dbraw/zinc/44/54/57/1442445457.db2.gz SKGPGTAZVOFRFI-OWBHPGMISA-N -1 1 348.410 3.112 20 50 EGGDMM Cc1cc(C=C(C#N)C(=O)c2cccc(-c3nnn[n-]3)c2)ccc1F ZINC000826266275 1425691833 /nfs/dbraw/zinc/69/18/33/1425691833.db2.gz JKOLBWRLFDEKHK-NVNXTCNLSA-N -1 1 333.326 3.104 20 50 EGGDMM Cc1[nH]c2ccccc2c1C(=O)C(C#N)=Cc1ccc(-c2nnn[n-]2)o1 ZINC000822009956 945920232 /nfs/dbraw/zinc/92/02/32/945920232.db2.gz IBTNKAHMWXIUAM-FLIBITNWSA-N -1 1 344.334 3.039 20 50 EGGDMM Cc1[nH]c2ccccc2c1C(=O)C(C#N)=Cc1ccc(-c2nn[n-]n2)o1 ZINC000822009956 945920240 /nfs/dbraw/zinc/92/02/40/945920240.db2.gz IBTNKAHMWXIUAM-FLIBITNWSA-N -1 1 344.334 3.039 20 50 EGGDMM CC(C)(C)[Si](C)(C)O[C@H]1CCN(Cc2ccc(C(=O)[O-])cn2)C1 ZINC001590452164 990017643 /nfs/dbraw/zinc/01/76/43/990017643.db2.gz ZOARWESXPIFFDX-HNNXBMFYSA-N -1 1 336.508 3.376 20 50 EGGDMM N#CC(=Cc1ccc(-c2nnn[n-]2)cc1F)C(=O)C1CCCCC1 ZINC000822795463 1429572233 /nfs/dbraw/zinc/57/22/33/1429572233.db2.gz BFDPZZRVRBWALR-ZSOIEALJSA-N -1 1 325.347 3.062 20 50 EGGDMM N#CC(=Cc1ccc(-c2nnn[n-]2)o1)C(=O)c1ccc(Cl)cc1F ZINC000826379318 608288820 /nfs/dbraw/zinc/28/88/20/608288820.db2.gz OPZRYECLHYIJIM-VMPITWQZSA-N -1 1 343.705 3.042 20 50 EGGDMM N#CC(=Cc1ccc(-c2nn[n-]n2)o1)C(=O)c1ccc(Cl)cc1F ZINC000826379318 608288822 /nfs/dbraw/zinc/28/88/22/608288822.db2.gz OPZRYECLHYIJIM-VMPITWQZSA-N -1 1 343.705 3.042 20 50 EGGDMM CC(C)[C@H]1CC[C@H](C)CC1=NNC(=O)c1cccc(-c2nnn[n-]2)c1 ZINC000736237052 1442261094 /nfs/dbraw/zinc/26/10/94/1442261094.db2.gz OFJRZNFWMRCMKA-SWLSCSKDSA-N -1 1 340.431 3.045 20 50 EGGDMM N#CC(=Cc1ccc(-c2nn[n-]n2)s1)C(=O)c1c[nH]c2ccccc21 ZINC000822796274 946181679 /nfs/dbraw/zinc/18/16/79/946181679.db2.gz ONXCETXOGITUJU-YFHOEESVSA-N -1 1 346.375 3.199 20 50 EGGDMM Cc1cccc(C)c1NC(=O)C(C#N)=Cc1ccccc1-c1nnn[n-]1 ZINC000826297007 1426988794 /nfs/dbraw/zinc/98/87/94/1426988794.db2.gz RMMNAWWPKDEDBZ-XNTDXEJSSA-N -1 1 344.378 3.029 20 50 EGGDMM Cc1ccsc1C(=O)C(C#N)=Cc1ccc(F)c(-c2nnn[n-]2)c1 ZINC000826315383 1427433787 /nfs/dbraw/zinc/43/37/87/1427433787.db2.gz IASGAESLXICAGR-WDZFZDKYSA-N -1 1 339.355 3.166 20 50 EGGDMM CC(C)[C@@H]1CCC(=NNC(=O)c2cccc(-c3nnn[n-]3)c2)C[C@@H]1C ZINC000824216696 1425895363 /nfs/dbraw/zinc/89/53/63/1425895363.db2.gz VHDYAWOISMLMSW-LRDDRELGSA-N -1 1 340.431 3.045 20 50 EGGDMM Cc1cc(C(C#N)=Cc2ccc(-c3nn[n-]n3)s2)ccc1[N+](=O)[O-] ZINC000826261765 608386682 /nfs/dbraw/zinc/38/66/82/608386682.db2.gz RBAMAVFUWUXGEU-YRNVUSSQSA-N -1 1 338.352 3.209 20 50 EGGDMM Cc1cccc2[nH]c(C(C#N)=Cc3ccc(-c4nnn[n-]4)s3)nc21 ZINC000822333127 1425443357 /nfs/dbraw/zinc/44/33/57/1425443357.db2.gz XREFMBKHQDEQIS-JXMROGBWSA-N -1 1 333.380 3.177 20 50 EGGDMM Cc1cccc2nc(C(C#N)=Cc3ccc(-c4nn[n-]n4)s3)[nH]c21 ZINC000822333127 1425443360 /nfs/dbraw/zinc/44/33/60/1425443360.db2.gz XREFMBKHQDEQIS-JXMROGBWSA-N -1 1 333.380 3.177 20 50 EGGDMM Cc1cccc2nc(C(C#N)=Cc3ccc(-c4nnn[n-]4)s3)[nH]c21 ZINC000822333127 1425443362 /nfs/dbraw/zinc/44/33/62/1425443362.db2.gz XREFMBKHQDEQIS-JXMROGBWSA-N -1 1 333.380 3.177 20 50 EGGDMM Cc1ccc(C=C(C#N)C(=O)c2cccc(-c3nnn[n-]3)c2)c(C)c1 ZINC000826286187 1427089337 /nfs/dbraw/zinc/08/93/37/1427089337.db2.gz UXXBWAKUFQTMKF-MFOYZWKCSA-N -1 1 329.363 3.273 20 50 EGGDMM Cc1cccc(C)c1C=C(C#N)C(=O)c1cccc(-c2nnn[n-]2)c1 ZINC000826296742 1427202288 /nfs/dbraw/zinc/20/22/88/1427202288.db2.gz HUZWJQRCCOZVBV-MHWRWJLKSA-N -1 1 329.363 3.273 20 50 EGGDMM CCCCCC(C)(C)C(=O)NNc1oc(C(C)C)nc1-c1nnn[n-]1 ZINC000821042949 1443309334 /nfs/dbraw/zinc/30/93/34/1443309334.db2.gz JLNDVZJQJLMTDJ-UHFFFAOYSA-N -1 1 349.439 3.028 20 50 EGGDMM CCC[C@@H](CC1CCCC1)C(=O)NNc1cccc(-c2nnn[n-]2)c1 ZINC000825242334 1447174090 /nfs/dbraw/zinc/17/40/90/1447174090.db2.gz OHKYZAUYURCTJT-HNNXBMFYSA-N -1 1 342.447 3.306 20 50 EGGDMM CC(C)CCCCCC(=O)NNc1oc(C(C)C)nc1-c1nn[n-]n1 ZINC000820072960 945345005 /nfs/dbraw/zinc/34/50/05/945345005.db2.gz OYQYEHQJJOYJQH-UHFFFAOYSA-N -1 1 349.439 3.028 20 50 EGGDMM CC(C)[C@@H]1CC[C@@H](C)CC1=NNC(=O)c1cccc(-c2nnn[n-]2)c1 ZINC000736237050 1441534275 /nfs/dbraw/zinc/53/42/75/1441534275.db2.gz OFJRZNFWMRCMKA-DOMZBBRYSA-N -1 1 340.431 3.045 20 50 EGGDMM CC(C)CC[C@@H]1CCCC1=NNC(=O)c1ccc(-c2nnn[n-]2)cc1 ZINC000735798107 1443112003 /nfs/dbraw/zinc/11/20/03/1443112003.db2.gz UZQDFFZHXIRSHY-ZDUSSCGKSA-N -1 1 340.431 3.189 20 50 EGGDMM N#CC(=Cc1cccc(-c2nnn[n-]2)c1)C(=O)c1ccc(Cl)s1 ZINC000826379210 1424508408 /nfs/dbraw/zinc/50/84/08/1424508408.db2.gz LVBJVLDHOLHLNA-YRNVUSSQSA-N -1 1 341.783 3.371 20 50 EGGDMM CC[C@H](CC1CCCCC1)C(=O)NNc1ccc(-c2nnn[n-]2)cc1 ZINC000825115040 1441506523 /nfs/dbraw/zinc/50/65/23/1441506523.db2.gz SWCWWWHPTHSUAZ-CQSZACIVSA-N -1 1 342.447 3.306 20 50 EGGDMM N#CC(=Cc1ccc(-c2nn[n-]n2)s1)c1nc(-c2ccccc2)no1 ZINC000822795854 1446905780 /nfs/dbraw/zinc/90/57/80/1446905780.db2.gz ILESCHJSCVNIJH-FLIBITNWSA-N -1 1 347.363 3.042 20 50 EGGDMM CC(C)(C)[Si](C)(C)O[C@H]1CCCN(Cc2oncc2C(=O)[O-])C1 ZINC001590451507 990014422 /nfs/dbraw/zinc/01/44/22/990014422.db2.gz MKHGGZXINPULEX-LBPRGKRZSA-N -1 1 340.496 3.359 20 50 EGGDMM CN(Cc1ccc(-c2nnn[n-]2)cc1)C(=CC#N)c1ccc(F)cc1 ZINC000821608643 1430192261 /nfs/dbraw/zinc/19/22/61/1430192261.db2.gz ORSZNRRNKAPYHR-YVLHZVERSA-N -1 1 334.358 3.002 20 50 EGGDMM CC(=NNC(=O)c1ccc(O)c(Cl)c1)[C@@H](C)CCCCC(=O)[O-] ZINC000814849732 978892263 /nfs/dbraw/zinc/89/22/63/978892263.db2.gz IBDLLZVPBBVJDL-JTQLQIEISA-N -1 1 340.807 3.432 20 50 EGGDMM O=C(NNc1ccc(-c2nnn[n-]2)cc1)Nc1cccc2ccccc21 ZINC000826446316 1441610460 /nfs/dbraw/zinc/61/04/60/1441610460.db2.gz HGWUBNPHLWGRBK-UHFFFAOYSA-N -1 1 345.366 3.169 20 50 EGGDMM CC(=NNC(=O)CCC1CCCCC1)c1ccc(-c2nnn[n-]2)s1 ZINC000823948793 1446824689 /nfs/dbraw/zinc/82/46/89/1446824689.db2.gz YLRKEAWFBKCVDS-UHFFFAOYSA-N -1 1 346.460 3.129 20 50 EGGDMM CCCCC[C@@H](C)CC(=O)NNc1oc(C(C)C)nc1-c1nnn[n-]1 ZINC000821050661 1441533069 /nfs/dbraw/zinc/53/30/69/1441533069.db2.gz SSGXHTHAMLXCLF-LLVKDONJSA-N -1 1 349.439 3.028 20 50 EGGDMM Cc1cc(C(C#N)=Cc2cc(-c3nn[n-]n3)cs2)ccc1[N+](=O)[O-] ZINC000826261827 1446225209 /nfs/dbraw/zinc/22/52/09/1446225209.db2.gz UHQMCFWEMZOBQS-VZUCSPMQSA-N -1 1 338.352 3.209 20 50 EGGDMM N#CC(=Cc1ccccc1-c1nnn[n-]1)C(=O)c1c[nH]c2ccccc21 ZINC000826379118 1424893478 /nfs/dbraw/zinc/89/34/78/1424893478.db2.gz JIFPHSHBKGEITF-LCYFTJDESA-N -1 1 340.346 3.138 20 50 EGGDMM Cc1ccc(C(=O)C(C#N)=Cc2ccc(-c3nnn[n-]3)s2)s1 ZINC000822224906 1444011268 /nfs/dbraw/zinc/01/12/68/1444011268.db2.gz FPWOATTZMHUMTH-TWGQIWQCSA-N -1 1 327.394 3.088 20 50 EGGDMM N#CC(=Cc1ccc(-c2nn[n-]n2)s1)C(=O)c1c[nH]c2ccccc21 ZINC000822796273 946181556 /nfs/dbraw/zinc/18/15/56/946181556.db2.gz ONXCETXOGITUJU-JXMROGBWSA-N -1 1 346.375 3.199 20 50 EGGDMM Cc1nc(C(C#N)=Cc2ccc(F)c(-c3nnn[n-]3)c2)sc1C ZINC000826323436 1428036373 /nfs/dbraw/zinc/03/63/73/1428036373.db2.gz DOPQHFIZUJGEOB-VZUCSPMQSA-N -1 1 326.360 3.143 20 50 EGGDMM Cc1ccc(C=C(C#N)C(=O)c2cccc(-c3nnn[n-]3)c2)cc1C ZINC000826286368 1442284012 /nfs/dbraw/zinc/28/40/12/1442284012.db2.gz ZKELOYQBMALIER-RQZCQDPDSA-N -1 1 329.363 3.273 20 50 EGGDMM Cc1ccsc1C(=O)C(C#N)=Cc1cc(-c2nn[n-]n2)cs1 ZINC000822379928 1424852103 /nfs/dbraw/zinc/85/21/03/1424852103.db2.gz WBCCTDLENBQWSU-RUDMXATFSA-N -1 1 327.394 3.088 20 50 EGGDMM N#CC(=Cc1cc(-c2nn[n-]n2)cs1)C(=O)c1c[nH]c2ccccc21 ZINC000822795721 1427304713 /nfs/dbraw/zinc/30/47/13/1427304713.db2.gz GGHJEYICVGXMHA-BJMVGYQFSA-N -1 1 346.375 3.199 20 50 EGGDMM Cc1ccc(F)c(C=C(C#N)C(=O)c2cccc(-c3nnn[n-]3)c2)c1 ZINC000826289311 1423504169 /nfs/dbraw/zinc/50/41/69/1423504169.db2.gz VCHZVJFSWAJQKP-DHDCSXOGSA-N -1 1 333.326 3.104 20 50 EGGDMM CCCC[C@@H](CC)CC(=O)NNc1oc(C(C)C)nc1-c1nnn[n-]1 ZINC000736437239 1426234580 /nfs/dbraw/zinc/23/45/80/1426234580.db2.gz HWWMSXMHGQSZRG-LLVKDONJSA-N -1 1 349.439 3.028 20 50 EGGDMM Cc1nc(C(C#N)=Cc2ccc(F)c(-c3nnn[n-]3)c2)sc1C ZINC000826323437 1442299933 /nfs/dbraw/zinc/29/99/33/1442299933.db2.gz DOPQHFIZUJGEOB-WZUFQYTHSA-N -1 1 326.360 3.143 20 50 EGGDMM CC1(C)CC(=NNC(=O)c2ccc(-c3nnn[n-]3)cc2)CC(C)(C)C1 ZINC000824790739 1446188364 /nfs/dbraw/zinc/18/83/64/1446188364.db2.gz PSXKKTSCBDBTCN-UHFFFAOYSA-N -1 1 340.431 3.189 20 50 EGGDMM Cc1ccsc1C(=O)C(C#N)=Cc1ccc(-c2nn[n-]n2)s1 ZINC000822378679 946073740 /nfs/dbraw/zinc/07/37/40/946073740.db2.gz DCNUNJPKHBRZSF-RMKNXTFCSA-N -1 1 327.394 3.088 20 50 EGGDMM CC(=NNC(=O)c1ccc(O)c(Cl)c1)[C@H](C)CCCCC(=O)[O-] ZINC000814849733 978892612 /nfs/dbraw/zinc/89/26/12/978892612.db2.gz IBDLLZVPBBVJDL-SNVBAGLBSA-N -1 1 340.807 3.432 20 50 EGGDMM N#CC(=Cc1cc(-c2nn[n-]n2)cs1)c1nc(-c2ccccc2)no1 ZINC000822796713 1443965250 /nfs/dbraw/zinc/96/52/50/1443965250.db2.gz WTFOCHCJKPPUSJ-IZZDOVSWSA-N -1 1 347.363 3.042 20 50 EGGDMM C[C@@H](NC=C(C#N)C#N)c1ccc(-c2cccc(-c3nnn[n-]3)c2)cc1 ZINC000824554151 1446996013 /nfs/dbraw/zinc/99/60/13/1446996013.db2.gz NERTUMDARXEJOH-CYBMUJFWSA-N -1 1 341.378 3.115 20 50 EGGDMM COC1([C@@H](C(=O)[O-])N2CC[C@@H](O[Si](C)(C)C(C)(C)C)C2)CCC1 ZINC001599083668 997054255 /nfs/dbraw/zinc/05/42/55/997054255.db2.gz XNFADKFFJFHJSE-ZIAGYGMSSA-N -1 1 343.540 3.105 20 50 EGGDMM N#CC(=Cc1ccc(Cl)s1)C(=O)c1cccc(-c2nnn[n-]2)c1 ZINC000826379178 1443803975 /nfs/dbraw/zinc/80/39/75/1443803975.db2.gz KZXYYGQKHDPNRX-YRNVUSSQSA-N -1 1 341.783 3.371 20 50 EGGDMM CC(C)(C)[Si](C)(C)O[C@H]1CCN(Cc2cccc(C(=O)[O-])n2)C1 ZINC001590452161 990017319 /nfs/dbraw/zinc/01/73/19/990017319.db2.gz ZLGYNPCJXPQDLS-AWEZNQCLSA-N -1 1 336.508 3.376 20 50 EGGDMM CCCCC[C@@H](C(=O)NNc1cccc(-c2nnn[n-]2)c1)C(C)C ZINC000825266866 1429580956 /nfs/dbraw/zinc/58/09/56/1429580956.db2.gz HVQFBQYACWGHMU-OAHLLOKOSA-N -1 1 330.436 3.162 20 50 EGGDMM CC(C)[C@@H]1CCC(=NNC(=O)c2cccc(-c3nnn[n-]3)c2)C[C@H]1C ZINC000824216698 1442092965 /nfs/dbraw/zinc/09/29/65/1442092965.db2.gz VHDYAWOISMLMSW-WBMJQRKESA-N -1 1 340.431 3.045 20 50 EGGDMM CCCCCC[C@@H](CC)C(=O)NNc1ccc(-c2nnn[n-]2)cc1 ZINC000825271824 1446553344 /nfs/dbraw/zinc/55/33/44/1446553344.db2.gz ORIDNDUZVXFYFO-CYBMUJFWSA-N -1 1 330.436 3.306 20 50 EGGDMM O=C([O-])C1(C(=O)NNc2ncc(Cl)cc2Cl)CCCCCC1 ZINC001594868098 954323785 /nfs/dbraw/zinc/32/37/85/954323785.db2.gz YNIDKACAWZQMJC-UHFFFAOYSA-N -1 1 346.214 3.257 20 50 EGGDMM COC1([C@H](C(=O)[O-])N2CC[C@@H](O[Si](C)(C)C(C)(C)C)C2)CCC1 ZINC001599083666 997054796 /nfs/dbraw/zinc/05/47/96/997054796.db2.gz XNFADKFFJFHJSE-KGLIPLIRSA-N -1 1 343.540 3.105 20 50 EGGDMM N#CC(=Cc1cc(-c2nnn[n-]2)cs1)C(=O)c1ccc(Cl)s1 ZINC000826379477 1429291227 /nfs/dbraw/zinc/29/12/27/1429291227.db2.gz SOLDWUMOHCBKOZ-XVNBXDOJSA-N -1 1 347.812 3.433 20 50 EGGDMM CC(C)=CCC[C@H](C)CC=NNC(=O)c1cccc(-c2nnn[n-]2)c1 ZINC000735679183 1425935596 /nfs/dbraw/zinc/93/55/96/1425935596.db2.gz FAJJQJYZKXMBFM-AWEZNQCLSA-N -1 1 340.431 3.355 20 50 EGGDMM COC1([C@H](C(=O)[O-])N2CC[C@H](O[Si](C)(C)C(C)(C)C)C2)CCC1 ZINC001599083665 997054744 /nfs/dbraw/zinc/05/47/44/997054744.db2.gz XNFADKFFJFHJSE-KBPBESRZSA-N -1 1 343.540 3.105 20 50 EGGDMM Cc1cccc(C=C(C#N)C(=O)c2cccc(-c3nnn[n-]3)c2)c1C ZINC000826297999 1425268735 /nfs/dbraw/zinc/26/87/35/1425268735.db2.gz YYWZHVSZZINLHI-RQZCQDPDSA-N -1 1 329.363 3.273 20 50 EGGDMM N#CC(=Cc1ccc(-c2nnn[n-]2)cc1)C(=O)c1ccc(Cl)s1 ZINC000826379412 1425795230 /nfs/dbraw/zinc/79/52/30/1425795230.db2.gz QWGKWYFBZXSIQS-XFFZJAGNSA-N -1 1 341.783 3.371 20 50 EGGDMM N#CC(=Cc1ccc(-c2nnn[n-]2)s1)C(=O)c1ccc(Cl)s1 ZINC000826378959 1426045028 /nfs/dbraw/zinc/04/50/28/1426045028.db2.gz FWBDJUQGIUBHHK-FNORWQNLSA-N -1 1 347.812 3.433 20 50 EGGDMM N#CC(=Cc1ccc(-c2nnn[n-]2)s1)C(=O)c1cccc(Cl)c1 ZINC000822796255 1429266175 /nfs/dbraw/zinc/26/61/75/1429266175.db2.gz NSCZSTQIIJPPNZ-JXMROGBWSA-N -1 1 341.783 3.371 20 50 EGGDMM Cc1nc(C(C#N)=Cc2ccc(-c3nnn[n-]3)cc2F)sc1C ZINC000822424233 1426506086 /nfs/dbraw/zinc/50/60/86/1426506086.db2.gz URERZUHJEQAVCP-XGICHPGQSA-N -1 1 326.360 3.143 20 50 EGGDMM CCCCC[C@H](C)CC(=O)NNc1oc(C(C)C)nc1-c1nnn[n-]1 ZINC000821050664 1443232549 /nfs/dbraw/zinc/23/25/49/1443232549.db2.gz SSGXHTHAMLXCLF-NSHDSACASA-N -1 1 349.439 3.028 20 50 EGGDMM CC(=NNC(=O)c1ccc(-c2nnn[n-]2)cc1)[C@H](C)C1CCCCC1 ZINC000819773189 1425231574 /nfs/dbraw/zinc/23/15/74/1425231574.db2.gz RLRWDEAOIHFDHR-LBPRGKRZSA-N -1 1 340.431 3.189 20 50 EGGDMM CCC(=CC(=O)NNc1ccc(-c2nnn[n-]2)cc1)c1ccc(C)cc1 ZINC000825029441 1441527171 /nfs/dbraw/zinc/52/71/71/1441527171.db2.gz SKGPGTAZVOFRFI-WYMLVPIESA-N -1 1 348.410 3.112 20 50 EGGDMM CC(C)[C@H]1CCC(=NNC(=O)c2ccc(-c3nnn[n-]3)cc2)C[C@@H]1C ZINC000824213966 1442404132 /nfs/dbraw/zinc/40/41/32/1442404132.db2.gz DLOUCMKSEIOGAU-BLLLJJGKSA-N -1 1 340.431 3.045 20 50 EGGDMM N#CC(=Cc1ccc(-c2nnn[n-]2)s1)C(=O)c1cccc(Cl)c1 ZINC000822796256 1424969575 /nfs/dbraw/zinc/96/95/75/1424969575.db2.gz NSCZSTQIIJPPNZ-YFHOEESVSA-N -1 1 341.783 3.371 20 50 EGGDMM CCc1ccc(C=C(C#N)C(=O)c2cccc(-c3nnn[n-]3)c2)cc1 ZINC000825704836 1441420088 /nfs/dbraw/zinc/42/00/88/1441420088.db2.gz OAXDVPCTESYEDO-LICLKQGHSA-N -1 1 329.363 3.219 20 50 EGGDMM Cc1cc(C)cc(C(=O)C(C#N)=Cc2ccccc2-c2nnn[n-]2)c1 ZINC000826264424 1426023766 /nfs/dbraw/zinc/02/37/66/1426023766.db2.gz NZBJTHGJRUFDRD-YBEGLDIGSA-N -1 1 329.363 3.273 20 50 EGGDMM CCCC[C@H](CC)CC(=O)NNc1oc(C(C)C)nc1-c1nn[n-]n1 ZINC000736437241 944821514 /nfs/dbraw/zinc/82/15/14/944821514.db2.gz HWWMSXMHGQSZRG-NSHDSACASA-N -1 1 349.439 3.028 20 50 EGGDMM N#CC(=Cc1ccc(Cl)cc1)C(=O)c1cccc(-c2nnn[n-]2)c1 ZINC000826379603 1426789626 /nfs/dbraw/zinc/78/96/26/1426789626.db2.gz WRZUCOFPKIRXLO-RIYZIHGNSA-N -1 1 335.754 3.310 20 50 EGGDMM CCOc1ccccc1C=C(C#N)C(=O)c1cccc(-c2nnn[n-]2)c1 ZINC000825654177 1441764005 /nfs/dbraw/zinc/76/40/05/1441764005.db2.gz QOXLJFPHUGPSND-MHWRWJLKSA-N -1 1 345.362 3.055 20 50 EGGDMM CC(C)(C)[Si](C)(C)OCc1ccc(COCc2nnn[n-]2)cc1 ZINC001119539241 1443296333 /nfs/dbraw/zinc/29/63/33/1443296333.db2.gz AWIKYEOSBMEKFL-UHFFFAOYSA-N -1 1 334.496 3.438 20 50 EGGDMM N#CC(=Cc1ccc(Cl)cc1)C(=O)c1cccc(-c2nnn[n-]2)c1 ZINC000826379604 1425922607 /nfs/dbraw/zinc/92/26/07/1425922607.db2.gz WRZUCOFPKIRXLO-ZSOIEALJSA-N -1 1 335.754 3.310 20 50 EGGDMM N#CC(=Cc1ccc(-c2nnn[n-]2)o1)C(=O)c1ccc(F)c(Cl)c1 ZINC000826378866 1426498872 /nfs/dbraw/zinc/49/88/72/1426498872.db2.gz CFQOTUYNHUSOSP-WEVVVXLNSA-N -1 1 343.705 3.042 20 50 EGGDMM Cc1cc(C)cc(C(=O)C(C#N)=Cc2ccccc2-c2nnn[n-]2)c1 ZINC000826264423 1429895938 /nfs/dbraw/zinc/89/59/38/1429895938.db2.gz NZBJTHGJRUFDRD-MHWRWJLKSA-N -1 1 329.363 3.273 20 50 EGGDMM CCc1ccc(C=C(C#N)C(=O)c2cccc(-c3nnn[n-]3)c2)s1 ZINC000825704862 1442226278 /nfs/dbraw/zinc/22/62/78/1442226278.db2.gz OPTQCVDWWSDCQD-UKTHLTGXSA-N -1 1 335.392 3.280 20 50 EGGDMM CC[C@H](CC1CCCCC1)C(=O)NNc1cccc(-c2nnn[n-]2)c1 ZINC000825113785 1446711723 /nfs/dbraw/zinc/71/17/23/1446711723.db2.gz GCGZHASXOHLDAC-CQSZACIVSA-N -1 1 342.447 3.306 20 50 EGGDMM Cc1cccc2[nH]c(C(C#N)=Cc3cc(-c4nn[n-]n4)cs3)nc21 ZINC000822331325 1428924458 /nfs/dbraw/zinc/92/44/58/1428924458.db2.gz DNCJIABHZYHSCQ-BJMVGYQFSA-N -1 1 333.380 3.177 20 50 EGGDMM Cc1cccc2nc(C(C#N)=Cc3cc(-c4nnn[n-]4)cs3)[nH]c21 ZINC000822331325 1428924461 /nfs/dbraw/zinc/92/44/61/1428924461.db2.gz DNCJIABHZYHSCQ-BJMVGYQFSA-N -1 1 333.380 3.177 20 50 EGGDMM Cc1cccc2nc(C(C#N)=Cc3cc(-c4nn[n-]n4)cs3)[nH]c21 ZINC000822331325 1428924464 /nfs/dbraw/zinc/92/44/64/1428924464.db2.gz DNCJIABHZYHSCQ-BJMVGYQFSA-N -1 1 333.380 3.177 20 50 EGGDMM Cc1cccc2[nH]c(C(C#N)=Cc3cccc(-c4nnn[n-]4)c3)nc21 ZINC000737404716 1425129796 /nfs/dbraw/zinc/12/97/96/1425129796.db2.gz DNRUJPJRMWFMPU-NTEUORMPSA-N -1 1 327.351 3.116 20 50 EGGDMM Cc1cccc2nc(C(C#N)=Cc3cccc(-c4nn[n-]n4)c3)[nH]c21 ZINC000737404716 1425129808 /nfs/dbraw/zinc/12/98/08/1425129808.db2.gz DNRUJPJRMWFMPU-NTEUORMPSA-N -1 1 327.351 3.116 20 50 EGGDMM Cc1cccc2nc(C(C#N)=Cc3cccc(-c4nnn[n-]4)c3)[nH]c21 ZINC000737404716 1425129817 /nfs/dbraw/zinc/12/98/17/1425129817.db2.gz DNRUJPJRMWFMPU-NTEUORMPSA-N -1 1 327.351 3.116 20 50 EGGDMM Cc1cccc2[nH]c(C(C#N)=Cc3ccc(F)c(-c4nnn[n-]4)c3)nc21 ZINC000826304713 1430109355 /nfs/dbraw/zinc/10/93/55/1430109355.db2.gz VOZIGIKIPXPGEJ-KPKJPENVSA-N -1 1 345.341 3.255 20 50 EGGDMM Cc1cccc2nc(C(C#N)=Cc3ccc(F)c(-c4nn[n-]n4)c3)[nH]c21 ZINC000826304713 1430109362 /nfs/dbraw/zinc/10/93/62/1430109362.db2.gz VOZIGIKIPXPGEJ-KPKJPENVSA-N -1 1 345.341 3.255 20 50 EGGDMM Cc1cccc2nc(C(C#N)=Cc3ccc(F)c(-c4nnn[n-]4)c3)[nH]c21 ZINC000826304713 1430109366 /nfs/dbraw/zinc/10/93/66/1430109366.db2.gz VOZIGIKIPXPGEJ-KPKJPENVSA-N -1 1 345.341 3.255 20 50 EGGDMM CC(C)(C)[Si](C)(C)O[C@@H]1CCCN(Cc2oncc2C(=O)[O-])C1 ZINC001590451506 990014490 /nfs/dbraw/zinc/01/44/90/990014490.db2.gz MKHGGZXINPULEX-GFCCVEGCSA-N -1 1 340.496 3.359 20 50 EGGDMM N#CC(=Cc1ccc(-c2nnn[n-]2)o1)C(=O)c1ccc(F)c(Cl)c1 ZINC000826378865 608288671 /nfs/dbraw/zinc/28/86/71/608288671.db2.gz CFQOTUYNHUSOSP-UITAMQMPSA-N -1 1 343.705 3.042 20 50 EGGDMM N#CC(=Cc1ccc(-c2nn[n-]n2)o1)C(=O)c1ccc(F)c(Cl)c1 ZINC000826378865 608288673 /nfs/dbraw/zinc/28/86/73/608288673.db2.gz CFQOTUYNHUSOSP-UITAMQMPSA-N -1 1 343.705 3.042 20 50 EGGDMM Cc1ccsc1C(=O)C(C#N)=Cc1cc(-c2nn[n-]n2)cs1 ZINC000822379929 1424736625 /nfs/dbraw/zinc/73/66/25/1424736625.db2.gz WBCCTDLENBQWSU-WTKPLQERSA-N -1 1 327.394 3.088 20 50 EGGDMM CCCc1ccc(C(=O)C(C#N)=Cc2ccc(-c3nnn[n-]3)o2)cc1 ZINC000821139452 1446317757 /nfs/dbraw/zinc/31/77/57/1446317757.db2.gz ZRIHWOFDCGUPEA-UVTDQMKNSA-N -1 1 333.351 3.202 20 50 EGGDMM N#CC(=Cc1ccc(-c2nnn[n-]2)o1)C(=O)c1ccc(Cl)cc1F ZINC000826379319 608288711 /nfs/dbraw/zinc/28/87/11/608288711.db2.gz OPZRYECLHYIJIM-YVMONPNESA-N -1 1 343.705 3.042 20 50 EGGDMM N#CC(=Cc1ccc(-c2nn[n-]n2)o1)C(=O)c1ccc(Cl)cc1F ZINC000826379319 608288713 /nfs/dbraw/zinc/28/87/13/608288713.db2.gz OPZRYECLHYIJIM-YVMONPNESA-N -1 1 343.705 3.042 20 50 EGGDMM Cc1cc(C)cc(C=C(C#N)C(=O)c2cccc(-c3nnn[n-]3)c2)c1 ZINC000826264361 1429122196 /nfs/dbraw/zinc/12/21/96/1429122196.db2.gz LPPVMLVCKKANJH-RQZCQDPDSA-N -1 1 329.363 3.273 20 50 EGGDMM CCOc1ccc(C=C(C#N)C(=O)c2cccc(-c3nnn[n-]3)c2)cc1 ZINC000825638467 1425566909 /nfs/dbraw/zinc/56/69/09/1425566909.db2.gz LLROBLJDDYPWJX-YBEGLDIGSA-N -1 1 345.362 3.055 20 50 EGGDMM Cc1cccc(C(=O)C(C#N)=Cc2ccccc2-c2nnn[n-]2)c1C ZINC000826295702 1426044323 /nfs/dbraw/zinc/04/43/23/1426044323.db2.gz UJIWFFYDWXXXIW-XNTDXEJSSA-N -1 1 329.363 3.273 20 50 EGGDMM N#CC(=Cc1cc2ccccc2o1)C(=O)c1cccc(-c2nnn[n-]2)c1 ZINC000826379727 1428090330 /nfs/dbraw/zinc/09/03/30/1428090330.db2.gz ZUFGRCVDQOBDIJ-GDNBJRDFSA-N -1 1 341.330 3.403 20 50 EGGDMM N#CC(=Cc1cc(-c2nnn[n-]2)cs1)C(=O)c1cccc(Cl)c1 ZINC000822796026 1443490540 /nfs/dbraw/zinc/49/05/40/1443490540.db2.gz KNLVBFDYRUQISM-BJMVGYQFSA-N -1 1 341.783 3.371 20 50 EGGDMM Cc1ccc(NC(=O)NNc2ccc(-c3nnn[n-]3)c(Cl)c2)s1 ZINC000826290914 1443602675 /nfs/dbraw/zinc/60/26/75/1443602675.db2.gz GRDWWULWKQMOLD-UHFFFAOYSA-N -1 1 349.807 3.039 20 50 EGGDMM Cc1ccc(C(=O)C(C#N)=Cc2ccc(-c3nnn[n-]3)cc2F)s1 ZINC000822225194 1443783349 /nfs/dbraw/zinc/78/33/49/1443783349.db2.gz RQYNANXIVZCKLS-SDQBBNPISA-N -1 1 339.355 3.166 20 50 EGGDMM Cc1ccc(C(=O)C(C#N)=Cc2ccc(-c3nnn[n-]3)cc2F)s1 ZINC000822225195 1446179949 /nfs/dbraw/zinc/17/99/49/1446179949.db2.gz RQYNANXIVZCKLS-WUXMJOGZSA-N -1 1 339.355 3.166 20 50 EGGDMM Cc1ccc(C(=O)C(C#N)=Cc2ccc(-c3nnn[n-]3)s2)s1 ZINC000822224905 1446801483 /nfs/dbraw/zinc/80/14/83/1446801483.db2.gz FPWOATTZMHUMTH-RMKNXTFCSA-N -1 1 327.394 3.088 20 50 EGGDMM CCCCCCCC(C)=NNC(=O)c1cccc(-c2nnn[n-]2)c1 ZINC000736446150 1424195584 /nfs/dbraw/zinc/19/55/84/1424195584.db2.gz NOJJLAKTSHGLRJ-UHFFFAOYSA-N -1 1 328.420 3.333 20 50 EGGDMM CCCCCC[C@@H](C)C(=O)NNc1oc(C(C)C)nc1-c1nnn[n-]1 ZINC000736447143 1426537651 /nfs/dbraw/zinc/53/76/51/1426537651.db2.gz RCRPQGITAQBSOR-LLVKDONJSA-N -1 1 349.439 3.028 20 50 EGGDMM CCOc1ccc(C=C(C#N)C(=O)c2cccc(-c3nnn[n-]3)c2)cc1 ZINC000825638457 1443389368 /nfs/dbraw/zinc/38/93/68/1443389368.db2.gz LLROBLJDDYPWJX-MHWRWJLKSA-N -1 1 345.362 3.055 20 50 EGGDMM CCCC(=NNC(=O)c1cccc(-c2nnn[n-]2)c1)C1CCCCC1 ZINC000736408199 1443398181 /nfs/dbraw/zinc/39/81/81/1443398181.db2.gz DFYHHESWJPSYCS-UHFFFAOYSA-N -1 1 340.431 3.333 20 50 EGGDMM N#CC(=Cc1ccccc1Cl)C(=O)c1cccc(-c2nnn[n-]2)c1 ZINC000826379044 1443978517 /nfs/dbraw/zinc/97/85/17/1443978517.db2.gz HWHGNKNPELPNMQ-ZSOIEALJSA-N -1 1 335.754 3.310 20 50 EGGDMM Cc1cc(C)cc(C(=O)C(C#N)=Cc2cc(-c3nn[n-]n3)cs2)c1 ZINC000822196754 1429377257 /nfs/dbraw/zinc/37/72/57/1429377257.db2.gz VZNUIEJLCHVTMX-AWNIVKPZSA-N -1 1 335.392 3.335 20 50 EGGDMM Cc1cccc(C(=O)C(C#N)=Cc2ccc(-c3nnn[n-]3)cc2)c1C ZINC000737380506 1426300357 /nfs/dbraw/zinc/30/03/57/1426300357.db2.gz BLWVXXWPISCXKG-YBEGLDIGSA-N -1 1 329.363 3.273 20 50 EGGDMM CSc1ccc(C=C(C#N)C(=O)c2cccc(-c3nnn[n-]3)c2)cc1 ZINC000826230312 1426799800 /nfs/dbraw/zinc/79/98/00/1426799800.db2.gz NIECYTZHWHDMNK-OQLLNIDSSA-N -1 1 347.403 3.378 20 50 EGGDMM CC(CC(C)(C)CC(=O)[O-])=NNC(=O)c1ccc(O)c(Cl)c1 ZINC001592445035 978108032 /nfs/dbraw/zinc/10/80/32/978108032.db2.gz VNAFFHZSIFZIDB-UHFFFAOYSA-N -1 1 326.780 3.042 20 50 EGGDMM CC(C)(C)[Si](C)(C)O[C@@H]1CCN(Cc2ccc(C(=O)[O-])cn2)C1 ZINC001590452165 990017800 /nfs/dbraw/zinc/01/78/00/990017800.db2.gz ZOARWESXPIFFDX-OAHLLOKOSA-N -1 1 336.508 3.376 20 50 EGGDMM CCC[C@H](CC1CCCC1)C(=O)NNc1ccc(-c2nnn[n-]2)cc1 ZINC000825242604 1429605694 /nfs/dbraw/zinc/60/56/94/1429605694.db2.gz WHJRXVHUWUJHPD-OAHLLOKOSA-N -1 1 342.447 3.306 20 50 EGGDMM Cc1ccc(C=C(C#N)C(=O)c2cccc(-c3nnn[n-]3)c2)cc1F ZINC000826285987 1424788128 /nfs/dbraw/zinc/78/81/28/1424788128.db2.gz PNDPICHRCCCSLZ-VIZOYTHASA-N -1 1 333.326 3.104 20 50 EGGDMM N#CC(=Cc1ccc(-c2nnn[n-]2)s1)C(=O)c1cc2ccccc2o1 ZINC000822795439 1425071148 /nfs/dbraw/zinc/07/11/48/1425071148.db2.gz ASZOCXJFCFADKZ-YRNVUSSQSA-N -1 1 347.359 3.464 20 50 EGGDMM CCCCC[C@H](C(=O)NNc1cccc(-c2nnn[n-]2)c1)C(C)C ZINC000825266864 1430134690 /nfs/dbraw/zinc/13/46/90/1430134690.db2.gz HVQFBQYACWGHMU-HNNXBMFYSA-N -1 1 330.436 3.162 20 50 EGGDMM CC(C)=CCCC(C)=CC=NNC(=O)c1cccc(-c2nnn[n-]2)c1 ZINC000735679868 1441424802 /nfs/dbraw/zinc/42/48/02/1441424802.db2.gz QEJKGYQNIRCFPJ-IOQKDPEHSA-N -1 1 338.415 3.275 20 50 EGGDMM CC(=NNC(=O)c1cccc(-c2nnn[n-]2)c1)[C@@H](C)C1CCCCC1 ZINC000819772630 1441559612 /nfs/dbraw/zinc/55/96/12/1441559612.db2.gz HSCAUDVUCVGLMA-GFCCVEGCSA-N -1 1 340.431 3.189 20 50 EGGDMM N#CC(=Cc1cc(-c2nn[n-]n2)cs1)C(=O)c1cc2ccccc2o1 ZINC000822796030 1443218807 /nfs/dbraw/zinc/21/88/07/1443218807.db2.gz KNXFKJDEIWWYKD-VZUCSPMQSA-N -1 1 347.359 3.464 20 50 EGGDMM COc1ccc(C=C(C#N)c2nc(C)c(C)s2)cc1-c1nnn[n-]1 ZINC000737076769 1443420025 /nfs/dbraw/zinc/42/00/25/1443420025.db2.gz PCHYYHHWHQELPM-SDQBBNPISA-N -1 1 338.396 3.013 20 50 EGGDMM N#CC(C#N)=CNc1ccc(Oc2cccc(-c3nnn[n-]3)c2)cc1 ZINC000737672945 1447151486 /nfs/dbraw/zinc/15/14/86/1447151486.db2.gz SKJVXGCCCPPJND-UHFFFAOYSA-N -1 1 329.323 3.002 20 50 EGGDMM Cc1ccsc1C(=O)C(C#N)=Cc1ccc(-c2nn[n-]n2)s1 ZINC000822378687 946075179 /nfs/dbraw/zinc/07/51/79/946075179.db2.gz DCNUNJPKHBRZSF-TWGQIWQCSA-N -1 1 327.394 3.088 20 50 EGGDMM CC(C)[C@H]1CCC(=NNC(=O)c2ccc(-c3nnn[n-]3)cc2)C[C@H]1C ZINC000824213972 1425762379 /nfs/dbraw/zinc/76/23/79/1425762379.db2.gz DLOUCMKSEIOGAU-MLGOLLRUSA-N -1 1 340.431 3.045 20 50 EGGDMM CC(C[C@H](C)CC(C)C)=NNC(=O)c1cccc(-c2nnn[n-]2)c1 ZINC000824391785 1429177040 /nfs/dbraw/zinc/17/70/40/1429177040.db2.gz KPJRPIZNFPAYDN-GFCCVEGCSA-N -1 1 328.420 3.045 20 50 EGGDMM Cc1ccc(NC(=O)C(C#N)=Cc2ccccc2-c2nnn[n-]2)c(C)c1 ZINC000826290326 1423265392 /nfs/dbraw/zinc/26/53/92/1423265392.db2.gz JPZXVXVFRJQVNI-XNTDXEJSSA-N -1 1 344.378 3.029 20 50 EGGDMM N#CC(=Cc1cscc1Cl)C(=O)c1cccc(-c2nnn[n-]2)c1 ZINC000826379138 1441462979 /nfs/dbraw/zinc/46/29/79/1441462979.db2.gz JYTHQVNXODZVMP-WZUFQYTHSA-N -1 1 341.783 3.371 20 50 EGGDMM CC(CCC1CCCCC1)=NNC(=O)c1ccc(-c2nnn[n-]2)cc1 ZINC000735983919 1443085962 /nfs/dbraw/zinc/08/59/62/1443085962.db2.gz ACZQDPGFCJPLHW-UHFFFAOYSA-N -1 1 340.431 3.333 20 50 EGGDMM N#CC(=Cc1cccc(Cl)c1)C(=O)c1cccc(-c2nnn[n-]2)c1 ZINC000826379378 1443362613 /nfs/dbraw/zinc/36/26/13/1443362613.db2.gz QJXOTBXZZRLGQG-AUWJEWJLSA-N -1 1 335.754 3.310 20 50 EGGDMM N#CC(=Cc1ccc(-c2nn[n-]n2)s1)C(=O)c1ccc(Cl)s1 ZINC000826378958 948172280 /nfs/dbraw/zinc/17/22/80/948172280.db2.gz FWBDJUQGIUBHHK-ALCCZGGFSA-N -1 1 347.812 3.433 20 50 EGGDMM