smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name O=C(C=P(c1ccccc1)(c1ccccc1)c1ccccc1)c1ccccc1-c1ccccc1C(=O)C=P(c1ccccc1)(c1ccccc1)c1ccccc1 ZINC000095548594 562759287 /nfs/dbraw/zinc/75/92/87/562759287.db2.gz HMLIJGSRQAHTFN-UHFFFAOYSA-N 0 2 758.838 9.312 40 70 KKIBLN