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@H]1Cc3ccc(O)c(O)c3C[N@@H+]1CC2 ZINC000013484850 201056847 /nfs/dbraw/zinc/05/68/47/201056847.db2.gz SUHDGQSJNMIRRN-OAHLLOKOSA-N -1 2 327.380 2.771 1 10 EFCFLM