Molecule
ID:82024
General Information
Molecular Formula
C₁₀H₁₄O
Molecular Mass
150.21756
Exact Mass
150.10446507
Charge
0
InChI
InChI=1S/C10H14O/c1-9-4-3-7-6(8(9)11)5-10(7,9)2/h6-7H,3-5H2,1-2H3
InChIKey
GKZKZITYBMINAL-UHFFFAOYSA-N
Canonic Smiles
O=C1C2CC3(C1(C)CCC23)C
Isomeric Smiles
O=C1C2(C3(C(C1C3)CC2)C)C
Calculated Properties
JChem
H Acceptors
1
H Donor
0
LogD (pH = 5.5)
2.1876774
LogD (pH = 7.4)
2.1876774
Log P
2.1876774
Molar Refractivity
42.6633
Polarizability
17.032516
Polar Surface Area
17.07
Rotatable Bonds
0
Lipinski's Rule of Five
true
Data Source
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Names and Identifiers
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Registration numbers
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Properties
No Data Available
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Related Proteins
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Molecular Spectra
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Molecule Details
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References
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Bioactivity
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