smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name Nc1[nH][n-]c(=O)c1N=Nc1ccc(S(=O)(=O)Nc2nccs2)cc1 ZINC000100789915 209216923 /nfs/dbraw/zinc/21/69/23/209216923.db2.gz BPVQLIWDRZKNJN-FZQCLQRZSA-N -1 2 365.400 0.798 1 10 FCCFLM Cc1cn([C@H]2C[C@H](CN=[N+]=[N-])[C@@H](CO[P@@](=O)([O-])O)O2)c(=O)[nH]c1=O ZINC000013525781 220070942 /nfs/dbraw/zinc/07/09/42/220070942.db2.gz RBJFKTLXEOJJBT-IWSPIJDZSA-N -1 2 361.251 0.168 1 10 FCCFLM Cc1cn([C@H]2C[C@H](CN=[N+]=[N-])[C@@H](CO[P@](=O)([O-])O)O2)c(=O)[nH]c1=O ZINC000013525781 220070945 /nfs/dbraw/zinc/07/09/45/220070945.db2.gz RBJFKTLXEOJJBT-IWSPIJDZSA-N -1 2 361.251 0.168 1 10 FCCFLM