Molecule

ID:74398

General Information
Structure
MolImage
Molecular Formula
C₂H₇Cl₂N
Molecular Mass
115.98968
Exact Mass
114.99555459
Charge
0
InChI
InChI=1S/C2H6ClN.ClH/c3-1-2-4;/h1-2,4H2;1H
InChIKey
ONRREFWJTRBDRA-UHFFFAOYSA-N
Canonic Smiles
NCCCl.Cl
Isomeric Smiles
NCCCl.Cl
Calculated Properties
JChem
H Acceptors
1
H Donor
1
LogD (pH = 5.5)
-2.8812065
LogD (pH = 7.4)
-1.6124485
Log P
0.03903098
Molar Refractivity
19.2621
Polarizability
7.7792172
Polar Surface Area
26.02
Rotatable Bonds
1
Lipinski's Rule of Five
true
Data Source
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Names and Identifiers
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Registration numbers
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Properties
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Related Proteins
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Molecular Spectra
No Data Available
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Molecule Details
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References
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Bioactivity
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