Molecule

ID:29648

General Information
Structure
MolImage
Molecular Formula
C₂₄H₃₅NO₂
Molecular Mass
369.5402
Exact Mass
369.26677937
Charge
0
InChI
InChI=1S/C24H35NO2/c1-4-6-7-8-9-17-26-24-12-10-11-22(18-24)25-19-20(3)27-23-15-13-21(5-2)14-16-23/h10-16,18,20,25H,4-9,17,19H2,1-3H3
InChIKey
WYAJAXGZZAWWLQ-UHFFFAOYSA-N
Canonic Smiles
CCCCCCCOc1cccc(c1)NCC(Oc1ccc(cc1)CC)C
Isomeric Smiles
N(c1cc(OCCCCCCC)ccc1)CC(Oc1ccc(cc1)CC)C
Calculated Properties
JChem
H Acceptors
3
H Donor
1
LogD (pH = 5.5)
6.9572887
LogD (pH = 7.4)
6.96448
Log P
6.9645724
Molar Refractivity
115.0048
Polarizability
44.478493
Polar Surface Area
30.49
Rotatable Bonds
13
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
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References
Bioactivity
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