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)=CCc1c(O)cc(O)c2c(=O)c3c4c(ccc3oc12)O[C@H](C(C)(C)O)C4 ZINC000013412036 291131172 /nfs/dbraw/zinc/13/11/72/291131172.db2.gz CIFXWYICBJRMRC-SFHVURJKSA-N -1 2 396.439 3.941 1 5 biogenic,in-vitro GHBFLM