smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name CCCC/C=C/c1c(O)cc2c(c1O)C(=O)c1c(O)cc(O)cc1C2=O ZINC000013374856 210180794 /nfs/dbraw/zinc/18/07/94/210180794.db2.gz RTXQNGWQTJTHCK-AATRIKPKSA-N -2 2 354.358 3.488 1 10 FGCFLL