smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name CC(=O)N[C@@H](C=O)[C@@H](O)[C@H](O)[C@H](O)CO[P@@](=O)([O-])O ZINC000005167283 373367710 /nfs/dbraw/zinc/36/77/10/373367710.db2.gz QDSLHWJDSQGPEE-LXGUWJNJSA-N -1 2 301.188 -3.118 10 30 in-vitro DAEELM CC(=O)N[C@@H](C=O)[C@@H](O)[C@H](O)[C@H](O)CO[P@](=O)([O-])O ZINC000005167283 373367723 /nfs/dbraw/zinc/36/77/23/373367723.db2.gz QDSLHWJDSQGPEE-LXGUWJNJSA-N -1 2 301.188 -3.118 10 30 in-vitro DAEELM