smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name Cc1ccccc1/N=N/c1ccc(N=N)c(C)c1 ZINC000004528750 342748534 /nfs/dbraw/zinc/74/85/34/342748534.db2.gz HTNYEEQAJRHDAR-JDXAHXBESA-N 0 0 238.294 5.381 50 10 BKCARN Cc1ccc(/N=N/c2ccc(C)cc2C)c(C)c1 ZINC000005765295 178360083 /nfs/dbraw/zinc/36/00/83/178360083.db2.gz CYYXARGGNXTAAM-ISLYRVAYSA-N 0 0 238.334 5.336 50 10 BKCARN Cc1ccc(/N=N/c2c[nH]c3ccccc23)c(C)c1 ZINC000018191568 178359091 /nfs/dbraw/zinc/35/90/91/178359091.db2.gz LKHQLVOPQYCJEJ-VHEBQXMUSA-N 0 0 249.317 5.200 50 10 BKCARN c1ccc(N=Nc2cccc3ccccc32)cc1 ZINC000254628722 388667483 /nfs/dbraw/zinc/66/74/83/388667483.db2.gz FDWBUGCBGXWJLC-UHFFFAOYSA-N 0 0 232.286 5.255 50 10 BKCARN