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LL8
FEATURES
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NAMES
  • 3NK
  • LL8
SMILES
COc1ccc2cc(C(=O)CC(C)=O)ccc2c1
InChI
InChI=1S/C15H14O3/c1-10(16)7-15(17)13-4-3-12-9-14(18-2)6-5-11(12)8-13/h3-6,8-9H,7H2,1-2H3
MOLECULAR FORMULA
C15H14O3
CROSS REFERENCES
  • UniChem: 21819897
  • canSAR: 962956
  • PDBe (Protein Data Bank Europe): LL8
  • PDBe (Protein Data Bank Europe): 3NK
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LL8

Compound Synopsis

OVERVIEW
PROPERTIES
Molecular weight 242.09
AlogP 3.01
HBond donors 0
HBond acceptors 3
Atoms 32
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 LL8.