smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name COc1ccc2ccc(O)c(C[N@@H+]3CC=C(c4ccccc4)CC3)c2c1 ZINC000003335418 210010215 /nfs/dbraw/zinc/01/02/15/210010215.db2.gz UGYXHOTZDBRRKS-UHFFFAOYSA-N 1 1 345.442 4.843 20 10 EJCDMO