Molecule

ID:29289

General Information
Structure
MolImage
Molecular Formula
C₂₄H₃₅NO₂
Molecular Mass
369.5402
Exact Mass
369.26677937
Charge
0
InChI
InChI=1S/C24H35NO2/c1-5-8-17-26-22-15-13-20(14-16-22)25-18-21(7-3)27-24-12-10-9-11-23(24)19(4)6-2/h9-16,19,21,25H,5-8,17-18H2,1-4H3
InChIKey
DPFUSPDWPMMWPV-UHFFFAOYSA-N
Canonic Smiles
CCCCOc1ccc(cc1)NCC(Oc1ccccc1C(CC)C)CC
Isomeric Smiles
c1(c(C(CC)C)cccc1)OC(CNc1ccc(cc1)OCCCC)CC
Calculated Properties
JChem
H Acceptors
3
H Donor
1
LogD (pH = 5.5)
6.6976776
LogD (pH = 7.4)
6.882034
Log P
6.8849764
Molar Refractivity
114.8754
Polarizability
44.477837
Polar Surface Area
30.49
Rotatable Bonds
12
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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