anagliptin

Structure Molecule image
Relationships Total Number of functionally related protein(s) : 93
Total Number of Articles : 65
PubChem 44513473
Molecular Formula

C19H25N7O2

SMILES

CC1=NN2C=C(C=NC2=C1)C(=O)NCC(C)(C)NCC(=O)N3CCC[C@H]3C#N

InChI

InChI=1S/C19H25N7O2/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)/t15-/m0/s1

synonyms
  • Anagliptin
  • 739366-20-2
  • suiny
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Properties
Property Value
MW 383.4 g/mol
HBD 2
HBA 6
Rotatable Bond Count 6
Exact Mass 383.20697307 g/mol
Monoisotopic Mass 383.20697307 g/mol
Heavy Atom Count 28
Isotope Atom Count 0
Atom Stereo Count 1
Covalent Unit Count 1
Complexity 643
xlogp 0
Topological Polar Surface Area 115