Molecule

ID:85757

General Information
Structure
MolImage
Molecular Formula
C₆H₁₀Cl₂N₂
Molecular Mass
181.063
Exact Mass
180.02210369
Charge
0
InChI
InChI=1S/C6H8N2.2ClH/c7-5-2-1-3-6(8)4-5;;/h1-4H,7-8H2;2*1H
InChIKey
SVTOYMIYCMHPIV-UHFFFAOYSA-N
Canonic Smiles
Nc1cccc(c1)N.Cl.Cl
Isomeric Smiles
Nc1cccc(c1)N.Cl.Cl
Calculated Properties
JChem
H Acceptors
2
H Donor
2
LogD (pH = 5.5)
0.026369793
LogD (pH = 7.4)
0.31023648
Log P
0.3153939
Molar Refractivity
35.4588
Polarizability
12.615376
Polar Surface Area
52.04
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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