smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name Cc1cc(C2C(=O)c3ccccc3C2=O)c(C)c2ccccc12 ZINC000138050366 563924447 /nfs/dbraw/zinc/92/44/47/563924447.db2.gz UCVBZEDBISQSNO-UHFFFAOYSA-N 0 2 300.357 4.619 50 10 DJCALN Cc1cc(C2C(=O)c3ccccc3C2=O)c2ccccc2c1C ZINC000101010812 563962071 /nfs/dbraw/zinc/96/20/71/563962071.db2.gz JUMVBKITDSHBRI-UHFFFAOYSA-N 0 2 300.357 4.619 50 10 DJCALN