smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name CC1(C)[C@@H]2CC[C@@]3(C)Oc4cc(O)c(-c5cc(=O)c6c(O)cc(O)cc6o5)cc4[C@@H]1[C@@H]23 ZINC000095912676 291273951 /nfs/dbraw/zinc/27/39/51/291273951.db2.gz WRBXVJKFKHACHK-VGSGKQCPSA-N -2 2 420.461 4.878 1 0 biogenic,in-vitro HJAFLL