Molecule

ID:58516

General Information
Structure
MolImage
Molecular Formula
C₁₀H₁₆O
Molecular Mass
152.23344
Exact Mass
152.12011513
Charge
0
InChI
InChI=1S/C10H16O/c11-10-8-2-6-1-7(4-8)5-9(10)3-6/h6-11H,1-5H2
InChIKey
FOWDOWQYRZXQDP-UHFFFAOYSA-N
Canonic Smiles
OC1C2CC3CC1CC(C2)C3
Isomeric Smiles
C1C2CC3CC1CC(C2)C3O
Calculated Properties
JChem
Acid pKa
19.289677
H Acceptors
1
H Donor
1
LogD (pH = 5.5)
1.6572254
LogD (pH = 7.4)
1.6572255
Log P
1.6572255
Molar Refractivity
43.7115
Polarizability
17.579895
Polar Surface Area
20.23
Rotatable Bonds
0
Lipinski's Rule of Five
true
Data Source
Names and Identifiers
Registration numbers
Properties
Related Proteins
No Data Available
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Molecular Spectra
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Molecule Details
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References
Bioactivity
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