Molecule

ID:28810

General Information
Structure
MolImage
Molecular Formula
C₁₅H₂₆N₂O₂
Molecular Mass
266.37914
Exact Mass
266.19942808
Charge
0
InChI
InChI=1S/C15H26N2O2/c1-4-17(5-2)12-10-16-11-13-19-15-9-7-6-8-14(15)18-3/h6-9,16H,4-5,10-13H2,1-3H3
InChIKey
FHGJSDJNYYJZHA-UHFFFAOYSA-N
Canonic Smiles
CCN(CCNCCOc1ccccc1OC)CC
Isomeric Smiles
c1(c(OCCNCCN(CC)CC)cccc1)OC
Calculated Properties
JChem
H Acceptors
4
H Donor
1
LogD (pH = 5.5)
-1.4715675
LogD (pH = 7.4)
-0.02885835
Log P
2.0257604
Molar Refractivity
79.2251
Polarizability
31.318611
Polar Surface Area
33.73
Rotatable Bonds
10
Lipinski's Rule of Five
true
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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