Molecule

ID:107301

General Information
Structure
MolImage
Molecular Formula
C₃H₈N₂O
Molecular Mass
88.10842
Exact Mass
88.06366289
Charge
0
InChI
InChI=1S/C3H8N2O/c1-5(2)3(4)6/h1-2H3,(H2,4,6)
InChIKey
YBBLOADPFWKNGS-UHFFFAOYSA-N
Canonic Smiles
CN(C(=O)N)C
Isomeric Smiles
CN(C)C(=O)N
Calculated Properties
JChem
Acid pKa
16.302582
H Acceptors
1
H Donor
1
LogD (pH = 5.5)
-0.91648173
LogD (pH = 7.4)
-0.91648173
Log P
-0.91648173
Molar Refractivity
22.936
Polarizability
8.642821
Polar Surface Area
46.33
Rotatable Bonds
0
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
References
Bioactivity
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