smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name CCCCCCCCC[C@H](CCCCCCCC(=O)[O-])OS(=O)(=O)[O-] ZINC000100062662 520030864 /nfs/dbraw/zinc/03/08/64/520030864.db2.gz FISKBOUWERTLRE-QGZVFWFLSA-N -2 0 380.547 5.130 10 30 GKEERL CCCCCCCCC[C@@H](CCCCCCCC(=O)[O-])OS(=O)(=O)[O-] ZINC000100062660 520028826 /nfs/dbraw/zinc/02/88/26/520028826.db2.gz FISKBOUWERTLRE-KRWDZBQOSA-N -2 0 380.547 5.130 10 30 GKEERL