Molecule

ID:109499

General Information
Structure
MolImage
Molecular Formula
C₃H₆BrCl
Molecular Mass
157.43674
Exact Mass
155.93413987
Charge
0
InChI
InChI=1S/C3H6BrCl/c4-2-1-3-5/h1-3H2
InChIKey
MFESCIUQSIBMSM-UHFFFAOYSA-N
Canonic Smiles
ClCCCBr
Isomeric Smiles
ClCCCBr
Calculated Properties
JChem
H Acceptors
0
H Donor
0
LogD (pH = 5.5)
1.7459596
LogD (pH = 7.4)
1.7459596
Log P
1.7459596
Molar Refractivity
28.5045
Polarizability
11.027107
Polar Surface Area
0.0
Rotatable Bonds
2
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
No Data Available
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Molecular Spectra
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Molecule Details
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References
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Bioactivity
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