smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name C[NH+](C)Cc1csc(C[N@H+]2CCC[C@@H]2c2ccco2)c1 ZINC000218224151 570308539 /nfs/dbraw/zinc/30/85/39/570308539.db2.gz YPKGGCPOZSMYSQ-OAHLLOKOSA-N 2 1 290.432 3.740 50 70 CHIAMP C[NH+](C)Cc1csc(C[N@H+]2CCC[C@H]2c2ccco2)c1 ZINC000218224208 570308479 /nfs/dbraw/zinc/30/84/79/570308479.db2.gz YPKGGCPOZSMYSQ-HNNXBMFYSA-N 2 1 290.432 3.740 50 70 CHIAMP