Molecule

ID:24502

General Information
Structure
MolImage
Molecular Formula
C₈H₂₀N₂
Molecular Mass
144.2578
Exact Mass
144.16264865
Charge
0
InChI
InChI=1S/C8H20N2/c1-4-8(2)10-7-5-6-9-3/h8-10H,4-7H2,1-3H3
InChIKey
DTFURJXCALEPFG-UHFFFAOYSA-N
Canonic Smiles
CNCCCNC(CC)C
Isomeric Smiles
N(CCCNC)C(CC)C
Calculated Properties
JChem
H Acceptors
2
H Donor
2
LogD (pH = 5.5)
-5.3440084
LogD (pH = 7.4)
-3.5546987
Log P
0.7985832
Molar Refractivity
45.9746
Polarizability
18.552586
Polar Surface Area
24.06
Rotatable Bonds
6
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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