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)CCNc1ccc2c3c(nn2CCN(C)C)-c2cnccc2C(=O)c31 ZINC000000598899 206308141 /nfs/dbraw/zinc/30/81/41/206308141.db2.gz ZRGAQZSTZSDJOZ-UHFFFAOYSA-N 0 3 378.480 2.178 1 10 GECFHN