Molecule

ID:108028

General Information
Structure
MolImage
Molecular Formula
C₂₄H₄₁NO₂
Molecular Mass
375.58784
Exact Mass
375.31372956
Charge
0
InChI
InChI=1S/C24H41NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-24(27)25-22-18-20-23(26)21-19-22/h18-21,26H,2-17H2,1H3,(H,25,27)
InChIKey
YASWBJXTHOXPGK-UHFFFAOYSA-N
Canonic Smiles
CCCCCCCCCCCCCCCCCC(=O)Nc1ccc(cc1)O
Isomeric Smiles
CCCCCCCCCCCCCCCCCC(=O)Nc1ccc(O)cc1
Calculated Properties
JChem
Acid pKa
9.461598
H Acceptors
2
H Donor
2
LogD (pH = 5.5)
8.276409
LogD (pH = 7.4)
8.272726
Log P
8.276457
Molar Refractivity
116.5438
Polarizability
45.30528
Polar Surface Area
49.33
Rotatable Bonds
17
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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