smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name CCOc1ccc([C@H](Nc2cccc[nH+]2)c2ccc3ccc(C)nc3c2O)cc1 ZINC000002502828 209368739 /nfs/dbraw/zinc/36/87/39/209368739.db2.gz IPCYHANDABLLHX-QFIPXVFZSA-N -1 2 385.467 5.244 50 10 GKCALM Cc1ccc2ccc([C@H](Nc3cccc[nH+]3)c3cccc(Cl)c3)c(O)c2n1 ZINC000002502830 209368455 /nfs/dbraw/zinc/36/84/55/209368455.db2.gz AQPFIEMLHIVYAM-HXUWFJFHSA-N -1 2 375.859 5.499 50 10 GKCALM