Molecule

ID:107850

General Information
Structure
MolImage
Molecular Formula
C₃₀H₆₂
Molecular Mass
422.81328
Exact Mass
422.48515198
Charge
0
InChI
InChI=1S/C30H62/c1-25(2)15-11-19-29(7)23-13-21-27(5)17-9-10-18-28(6)22-14-24-30(8)20-12-16-26(3)4/h25-30H,9-24H2,1-8H3
InChIKey
PRAKJMSDJKAYCZ-UHFFFAOYSA-N
Canonic Smiles
CC(CCCC(CCCC(C)C)C)CCCCC(CCCC(CCCC(C)C)C)C
Isomeric Smiles
CC(C)CCCC(C)CCCC(C)CCCCC(C)CCCC(C)CCCC(C)C
Calculated Properties
JChem
H Acceptors
0
H Donor
0
LogD (pH = 5.5)
12.855489
LogD (pH = 7.4)
12.855489
Log P
12.855489
Molar Refractivity
139.5178
Polarizability
56.156876
Polar Surface Area
0.0
Rotatable Bonds
21
Lipinski's Rule of Five
false
Data Source
Names and Identifiers
Registration numbers
Properties
Related Proteins
No Data Available
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Molecular Spectra
No Data Available
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Molecule Details
References
Bioactivity
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