smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name N#[N+]C1c2ccccc2-c2ccccc21 ZINC000086864078 171133353 /nfs/dbraw/zinc/13/33/53/171133353.db2.gz DBIHFIIFJOAXFD-UHFFFAOYSA-N 1 0 193.229 3.609 2 0 AHAFRO CC1(C)CC=CC(=[NH+]c2ccccc2)C1 ZINC000205468451 344373752 /nfs/dbraw/zinc/37/37/52/344373752.db2.gz FYCQCJFBFQYHPT-UHFFFAOYSA-N 1 0 199.297 3.969 2 0 AHAFRO