smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name O=c1cc(Cc2c3ccccc3nc3ccccc32)c2ccc([O-])cc2o1 ZINC000064527820 212039047 /nfs/dbraw/zinc/03/90/47/212039047.db2.gz GFPNKXNBLCXNBK-UHFFFAOYSA-N -1 1 353.377 4.791 1 5 FJBFMM COc1c(O)cc2oc3cc4occc4c(=O)c-3c([O-])c2c1CC=C(C)C ZINC000095099106 291084644 /nfs/dbraw/zinc/08/46/44/291084644.db2.gz WEELWZNBAZIZRK-UHFFFAOYSA-N -1 1 366.369 4.621 1 5 biogenic,in-vitro FJBFMM