smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name CC(C)/C(=N\[O-])c1ccc(Cl)cc1 34110396 351434468 /nfs/dbraw/zinc/43/44/68/351434468.db2.gz YPYQUASGLKSKJS-ZRDIBKRKSA-N -1 1 197.665 3.174 50 30 AGEAMM