Inhibitor Report for: 6Z8
| 6Z8 | Type | Purine |
|---|
| | Piperidine |
| | Gliptin |
| | Peptide |
| Other_Name | 8-[(3~{R})-3-azanylpiperidin-1-yl]-7-[(2-bromophenyl)methyl]-1,3-dimethyl-purine-2,6-dione |
| | SCHEMBL4668963 |
| Chemical_Nomenclature | 8-[(3R)-3-aminopiperidin-1-yl]-7-[(2-bromophenyl)methyl]-1,3-dimethylpurine-2,6-dione |
| Formula | C19H23BrN6O2 |
| MW | 447.33 |
|  |
| Paper | Schnapp_2016_J.Med.Chem_59_7466 |
| Structure | 5LLS |
| Comment | inhibitor related to Linagliptin |
| Gene_locus | pig-dpp4 |
| CID | 59990713 |
| Family | DPP4N_Peptidase_S9 |
| InChIKey | CADOMWLQFMIXFQ-CYBMUJFWSA-N |
| CanonicalSMILES | CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)N3CCCC(C3)N)CC4=CC=CC=C4Br |
| InChI | InChI=1S/C19H23BrN6O2/c1-23-16-15(17(27)24(2)19(23)28)26(10-12-6-3-4-8-14(12)20)18(22-16)25-9-5-7-13(21)11-25/h3-4,6,8,13H,5,7,9-11,21H2,1-2H3/t13-/m1/s1 |
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