smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name CN(C)C=CC=CC=CC1=[N+](C)c2ccccc2C1(C)C ZINC000015961432 566930814 /nfs/dbraw/zinc/93/08/14/566930814.db2.gz BKLFNFFYHHGTTQ-UHFFFAOYSA-N 1 3 281.423 3.753 50 30 CHEAHO CN(C)C=CC=CC=C1CC[n+]2c3ccccc3sc21 ZINC000223494226 570371471 /nfs/dbraw/zinc/37/14/71/570371471.db2.gz IIVICQVIIULVNC-UHFFFAOYSA-N 1 3 283.420 3.669 50 30 CHEAHO