smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name COc1ccc(CCOc2cccc([C@@H]3CC(=O)Oc4cc(O)c5c(=O)cc(-c6ccc(OC)c(O)c6)oc5c43)c2)cc1 ZINC000218060078 571603234 /nfs/dbraw/zinc/60/32/34/571603234.db2.gz XFLWUZUZXDVUCQ-DEOSSOPVSA-N 0 2 580.589 5.951 50 70 biogenic KKIALN COc1ccc(CCOc2cccc([C@H]3CC(=O)Oc4cc(O)c5c(=O)cc(-c6ccc(OC)c(O)c6)oc5c43)c2)cc1 ZINC000218060153 571603265 /nfs/dbraw/zinc/60/32/65/571603265.db2.gz XFLWUZUZXDVUCQ-XMMPIXPASA-N 0 2 580.589 5.951 50 70 biogenic KKIALN