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53Q
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NAMES
  • 53Q
SMILES
COc1ccc(/C(=C(/Cl)c2ccccc2)c2ccccc2)cc1
InChI
InChI=1S/C21H17ClO/c1-23-19-14-12-17(13-15-19)20(16-8-4-2-5-9-16)21(22)18-10-6-3-7-11-18/h2-15H,1H3/b21-20+
MOLECULAR FORMULA
C21H17ClO
CROSS REFERENCES
  • UniChem: 8861384
  • canSAR: 1991458
  • PDBe (Protein Data Bank Europe): 53Q
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53Q

Compound Synopsis

OVERVIEW
PROPERTIES
Molecular weight 320.10
AlogP 5.85
HBond donors 0
HBond acceptors 1
Atoms 40
Contains toxicophore Yes
Contains PAINS No
Commercially available Unknown
Property color indications are based on Lipinski's Ro5.
PROTEIN TARGETS
No information about proteins targeted by 53Q.