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54V
FEATURES
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NAMES
  • 54V
SMILES
COC(=O)c1ccc(CN2CCN(C)CC2)cc1
InChI
InChI=1S/C14H20N2O2/c1-15-7-9-16(10-8-15)11-12-3-5-13(6-4-12)14(17)18-2/h3-6H,7-11H2,1-2H3
MOLECULAR FORMULA
C14H20N2O2
CROSS REFERENCES
  • UniChem: 19205159
  • canSAR: 1998322
  • PDBe (Protein Data Bank Europe): 54V
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54V

Compound Synopsis

OVERVIEW
PROPERTIES
Molecular weight 248.15
AlogP 1.22
HBond donors 0
HBond acceptors 4
Atoms 38
Contains toxicophore No
Contains PAINS No
Commercially available Yes
Property color indications are based on Lipinski's Ro5.
PROTEIN TARGETS
No information about proteins targeted by 54V.