Molecule

ID:64040

General Information
Structure
MolImage
Molecular Formula
C₄H₁₀N₂
Molecular Mass
86.1356
Exact Mass
86.08439833
Charge
0
InChI
InChI=1S/C4H10N2/c1-5-4-2-6-3-4/h4-6H,2-3H2,1H3
InChIKey
NQPTWMKTGPWPMX-UHFFFAOYSA-N
Canonic Smiles
CNC1CNC1
Isomeric Smiles
C1C(NC)CN1
Calculated Properties
JChem
H Acceptors
2
H Donor
2
LogD (pH = 5.5)
-3.8723295
LogD (pH = 7.4)
-2.563063
Log P
-0.6690398
Molar Refractivity
25.119
Polarizability
10.427217
Polar Surface Area
24.06
Rotatable Bonds
1
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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