Molecule

ID:16183

General Information
Structure
MolImage
Molecular Formula
C₆H₁₀BrNO
Molecular Mass
192.0537
Exact Mass
190.99457595
Charge
0
InChI
InChI=1S/C6H10BrNO/c7-5-6(9)8-3-1-2-4-8/h1-5H2
InChIKey
SPHXSIXITGVYAA-UHFFFAOYSA-N
Canonic Smiles
BrCC(=O)N1CCCC1
Isomeric Smiles
N1(C(=O)CBr)CCCC1
Calculated Properties
JChem
H Acceptors
1
H Donor
0
LogD (pH = 5.5)
0.5457004
LogD (pH = 7.4)
0.5457004
Log P
0.5457004
Molar Refractivity
39.537
Polarizability
15.128572
Polar Surface Area
20.31
Rotatable Bonds
1
Lipinski's Rule of Five
true
Data Source
Names and Identifiers
Registration numbers
Properties
Related Proteins
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Molecular Spectra
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Molecule Details
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References
Bioactivity
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