smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name Cn1[nH+]c(N)c2cn([C@@H]3O[C@H](CO[P@](=O)([O-])O)[C@@H](O)[C@H]3O)c3ncnc1c23 ZINC000003916663 557503395 /nfs/dbraw/zinc/50/33/95/557503395.db2.gz URLYINUFLXOMHP-HTVVRFAVSA-N 0 2 400.288 -1.371 50 0 investigational HAAALN Cn1[nH+]c(N)c2cn([C@@H]3O[C@H](CO[P@@](=O)([O-])O)[C@@H](O)[C@H]3O)c3ncnc1c23 ZINC000003916663 557503391 /nfs/dbraw/zinc/50/33/91/557503391.db2.gz URLYINUFLXOMHP-HTVVRFAVSA-N 0 2 400.288 -1.371 50 0 investigational HAAALN COC(=O)c1cnc(NCCc2n[nH]c(=O)[nH]2)c(S(=O)(=O)N2CCOCC2)c1 ZINC000072307655 559157715 /nfs/dbraw/zinc/15/77/15/559157715.db2.gz XEFWVECLJFHFKD-UHFFFAOYSA-N 0 2 412.428 -1.045 50 0 HAAALN