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5UY
FEATURES
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NAMES
  • 5UY
SMILES
COC(=O)c1cnc(Nc2cnc(C#N)cn2)cc1NCC1CNCCO1
InChI
InChI=1S/C17H19N7O3/c1-26-17(25)13-9-23-15(24-16-10-20-11(5-18)6-22-16)4-14(13)21-8-12-7-19-2-3-27-12/h4,6,9-10,12,19H,2-3,7-8H2,1H3,(H2,21,22,23,24)/t12-/m1/s1
MOLECULAR FORMULA
C17H19N7O3
CROSS REFERENCES
  • UniChem: 103985522
  • canSAR: 1834378
  • PDBe (Protein Data Bank Europe): 5UY
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5UY

Compound Synopsis

OVERVIEW
PROPERTIES
Molecular weight 369.15
AlogP 0.67
HBond donors 3
HBond acceptors 10
Atoms 46
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 5UY.