Molecule

ID:34121

General Information
Structure
MolImage
Molecular Formula
C₁₀H₂₃N₃
Molecular Mass
185.30972
Exact Mass
185.18919775
Charge
0
InChI
InChI=1S/C10H23N3/c1-2-5-12-7-9-13(10-8-12)6-3-4-11/h2-11H2,1H3
InChIKey
DJOXCABHIQUIJR-UHFFFAOYSA-N
Canonic Smiles
CCCN1CCN(CC1)CCCN
Isomeric Smiles
N1(CCN(CC1)CCC)CCCN
Calculated Properties
JChem
H Acceptors
3
H Donor
1
LogD (pH = 5.5)
-5.9288616
LogD (pH = 7.4)
-3.8108654
Log P
0.17959532
Molar Refractivity
58.126
Polarizability
23.024387
Polar Surface Area
32.5
Rotatable Bonds
5
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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