Molecule

ID:30778

General Information
Structure
MolImage
Molecular Formula
C₅H₁₀N₄
Molecular Mass
126.1597
Exact Mass
126.09054634
Charge
0
InChI
InChI=1S/C5H10N4/c6-2-1-3-9-5-7-4-8-9/h4-5H,1-3,6H2
InChIKey
IXXJEYNOJZNYBD-UHFFFAOYSA-N
Canonic Smiles
NCCCn1cncn1
Isomeric Smiles
n1cnn(c1)CCCN
Calculated Properties
JChem
H Acceptors
3
H Donor
1
LogD (pH = 5.5)
-4.048554
LogD (pH = 7.4)
-3.6873164
Log P
-1.0224378
Molar Refractivity
46.9507
Polarizability
13.234074
Polar Surface Area
56.73
Rotatable Bonds
3
Lipinski's Rule of Five
true
Data Source
Names and Identifiers
Registration numbers
Properties
Related Proteins
No Data Available
Click here to submit data
Molecular Spectra
No Data Available
Click here to submit data
Molecule Details
暂无数据
点击上传数据
References
Bioactivity
Navigation