smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name CC(=NNC(=O)c1ccc(C)cc1[O-])[C@H](C)CCCCC(=O)[O-] ZINC000814810525 978887553 /nfs/dbraw/zinc/88/75/53/978887553.db2.gz AWISEBWAXWGNGI-GFCCVEGCSA-N -2 3 320.389 3.087 20 50 DGGDHL CC(=NNC(=O)c1ccc(C)cc1[O-])[C@@H](C)CCCCC(=O)[O-] ZINC000814810527 978887354 /nfs/dbraw/zinc/88/73/54/978887354.db2.gz AWISEBWAXWGNGI-LBPRGKRZSA-N -2 3 320.389 3.087 20 50 DGGDHL