anagliptin Report issue

Small molecule Experimental
AACT ChEMBL DrugBank Drug Central KEGG MeSH PubChem

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Chemistry

Mol. Mass

419.92

ALogP

0.65

Rule of 5

Yes

Rule of 3

No
Details
  • SMILES: Cc1cc2ncc(C(=O)NCC(C)(C)NCC(=O)N3CCC[C@H]3C#N)cn2n1.Cl
  • InChIKey: SRIIFFBJIKZICS-RSAXXLAASA-N
    InChI=1S/C19H25N7O2.ClH/c1-13-7-16-21-9-14(11-26(16)24-13)18(28)22-12-19(2,3)23-10-17(27)25-6-4-5-15(25)8-20;/h7,9,11,15,23H,4-6,10,12H2,1-3H3,(H,22,28);1H/t15-;/m0./s1
  • Chirality: Single Stereoisomer
  • Inorganic: No
  • Polymer: No

Sources

CHEMBL1929387   ChEMBL
anagliptin hydrochloride

CHEMBL1929396   ChEMBL
anagliptin

Anagliptin   Wikipedia

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