Molecule

ID:91288

General Information
Structure
MolImage
Molecular Formula
C₁₀H₂₃N₃
Molecular Mass
185.30972
Exact Mass
185.18919775
Charge
0
InChI
InChI=1S/C10H23N3/c1-3-12(4-2)9-10-13-7-5-11-6-8-13/h11H,3-10H2,1-2H3
InChIKey
PVYBFVZRZWESQN-UHFFFAOYSA-N
Canonic Smiles
CCN(CCN1CCNCC1)CC
Isomeric Smiles
N1(CCN(CC)CC)CCNCC1
Calculated Properties
JChem
H Acceptors
3
H Donor
1
LogD (pH = 5.5)
-6.1299286
LogD (pH = 7.4)
-3.6558325
Log P
0.38650155
Molar Refractivity
58.2598
Polarizability
23.024387
Polar Surface Area
18.51
Rotatable Bonds
5
Lipinski's Rule of Five
true
Data Source
Names and Identifiers
Registration numbers
Properties
Related Proteins
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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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