can
SAR
Black
canSAR184667
FEATURES
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NAMES
SMILES
COc1cc2c(cc1O)CN(C(C)=O)CC2
InChI
InChI=1S/C12H15NO3/c1-8(14)13-4-3-9-6-12(16-2)11(15)5-10(9)7-13/h5-6,15H,3-4,7H2,1-2H3
MOLECULAR FORMULA
C12H15NO3
CROSS REFERENCES
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canSAR184667
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Compound Synopsis
OVERVIEW
PROPERTIES
Molecular weight
221.11
AlogP
1.31
HBond donors
1
HBond acceptors
4
Atoms
31
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 canSAR184667.