Molecule

ID:29637

General Information
Structure
MolImage
Molecular Formula
C₂₄H₃₃NO₂
Molecular Mass
367.52432
Exact Mass
367.2511293
Charge
0
InChI
InChI=1S/C24H33NO2/c1-2-16-26-24-10-6-9-21(18-24)19-25-22-11-13-23(14-12-22)27-17-15-20-7-4-3-5-8-20/h6,9-14,18,20,25H,2-5,7-8,15-17,19H2,1H3
InChIKey
NWNIIMIVUUMDLJ-UHFFFAOYSA-N
Canonic Smiles
CCCOc1cccc(c1)CNc1ccc(cc1)OCCC1CCCCC1
Isomeric Smiles
N(c1ccc(cc1)OCCC1CCCCC1)Cc1cc(OCCC)ccc1
Calculated Properties
JChem
H Acceptors
3
H Donor
1
LogD (pH = 5.5)
6.1096907
LogD (pH = 7.4)
6.213878
Log P
6.215383
Molar Refractivity
113.4864
Polarizability
43.815475
Polar Surface Area
30.49
Rotatable Bonds
10
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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