smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name O=c1c(O)c(-c2ccc(O)cc2)oc2cc(O)cc(OCCC3(O)CCCC3)c12 ZINC000085569502 291134645 /nfs/dbraw/zinc/13/46/45/291134645.db2.gz WAKPNAAVRSQKFR-UHFFFAOYSA-N -2 2 398.411 3.651 1 0 biogenic,in-vitro GHAFLL O=c1c(O)c(-c2ccc(O)cc2)oc2cc(O)cc(OCc3cccc(O)c3)c21 ZINC000085569519 291134617 /nfs/dbraw/zinc/13/46/17/291134617.db2.gz CLSJRFXYTOUZCO-UHFFFAOYSA-N -2 2 392.363 3.861 1 0 biogenic,in-vitro GHAFLL