smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name COc1cc2c(cc1OC)C(C)[N+](=O)C(c1cc3c(cc1[N+](=O)[O-])OCO3)N2 ZINC000101192800 208388919 /nfs/dbraw/zinc/38/89/19/208388919.db2.gz GDKDVKRXHQTXGS-SFHVURJKSA-N 1 3 387.348 2.784 1 5 GFBFHO CN(C)CCNc1cc2c(c3oc4ccccc4c(=O)c13)C[C@H]([NH3+])C(C)(C)O2 ZINC000028705801 210532772 /nfs/dbraw/zinc/53/27/72/210532772.db2.gz QAAHVLQZTQLDJE-SFHVURJKSA-N 1 3 381.476 2.961 1 5 GFBFHO