Molecule

ID:104635

General Information
Structure
MolImage
Molecular Formula
C₁₈H₃₅ClO
Molecular Mass
302.9229
Exact Mass
302.23764342
Charge
0
InChI
InChI=1S/C18H35ClO/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h2-17H2,1H3
InChIKey
WTBAHSZERDXKKZ-UHFFFAOYSA-N
Canonic Smiles
CCCCCCCCCCCCCCCCCC(=O)Cl
Isomeric Smiles
CCCCCCCCCCCCCCCCCC(=O)Cl
Calculated Properties
JChem
H Acceptors
1
H Donor
0
LogD (pH = 5.5)
7.67905
LogD (pH = 7.4)
7.67905
Log P
7.67905
Molar Refractivity
90.1441
Polarizability
35.813942
Polar Surface Area
17.07
Rotatable Bonds
16
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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