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Omarigliptin
FEATURES
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NAMES
  • MK-3102
  • Omarigliptin
SMILES
CS(=O)(=O)n1cc2c(n1)CN([C@H]1CO[C@H](c3cc(F)ccc3F)[C@@H](N)C1)C2
InChI
InChI=1S/C17H20F2N4O3S/c1-27(24,25)23-7-10-6-22(8-16(10)21-23)12-5-15(20)17(26-9-12)13-4-11(18)2-3-14(13)19/h2-4,7,12,15,17H,5-6,8-9,20H2,1H3/t12-,15+,17-/m1/s1
MOLECULAR FORMULA
C17H20F2N4O3S
CROSS REFERENCES
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Omarigliptin

Compound Synopsis

OVERVIEW
PROPERTIES
Molecular weight 398.12
AlogP 1.14
HBond donors 2
HBond acceptors 7
Atoms 47
Contains toxicophore No
Contains PAINS No
Commercially available Unknown
Property color indications are based on Lipinski's Ro5.
PROTEIN TARGETS
No information about proteins targeted by Omarigliptin.