Molecule

ID:29475

General Information
Structure
MolImage
Molecular Formula
C₂₄H₃₅NO₂
Molecular Mass
369.5402
Exact Mass
369.26677937
Charge
0
InChI
InChI=1S/C24H35NO2/c1-6-24(4,5)20-10-12-22(13-11-20)27-17-15-25-21-8-7-9-23(18-21)26-16-14-19(2)3/h7-13,18-19,25H,6,14-17H2,1-5H3
InChIKey
ZHRHSZAHEOWCKC-UHFFFAOYSA-N
Canonic Smiles
CCC(c1ccc(cc1)OCCNc1cccc(c1)OCCC(C)C)(C)C
Isomeric Smiles
C(c1ccc(cc1)OCCNc1cc(OCCC(C)C)ccc1)(CC)(C)C
Calculated Properties
JChem
H Acceptors
3
H Donor
1
LogD (pH = 5.5)
6.525993
LogD (pH = 7.4)
6.532857
Log P
6.532945
Molar Refractivity
114.9563
Polarizability
44.476807
Polar Surface Area
30.49
Rotatable Bonds
11
Lipinski's Rule of Five
false
Data Source
Names and Identifiers
Registration numbers
Properties
Related Proteins
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Molecular Spectra
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Molecule Details
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References
Bioactivity
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