smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name CCCCCCC(C)(C)c1cc([O-])c2c(c1)oc(=O)c1ccc(OC)cc12 ZINC000001550866 210360102 /nfs/dbraw/zinc/36/01/02/210360102.db2.gz ZAIKPEWFCSQNQB-UHFFFAOYSA-N -1 1 368.473 5.908 1 5 in-vivo FKBFMM CCCCCCC(C)(C)c1cc([O-])c2c(c1)oc(=O)c1ccc(O)cc12 ZINC000001550867 204012066 /nfs/dbraw/zinc/01/20/66/204012066.db2.gz BWKBVEVEQOCSCF-UHFFFAOYSA-N -1 1 354.446 5.605 1 5 in-vivo FKBFMM