Molecule

ID:8034

General Information
Structure
Molecular Formula
C₄Br₄S
Molecular Mass
399.7238
Exact Mass
395.645419
Charge
0
InChI
InChI=1S/C4Br4S/c5-1-2(6)4(8)9-3(1)7
InChIKey
AVPWUAFYDNQGNZ-UHFFFAOYSA-N
Canonic Smiles
Brc1sc(c(c1Br)Br)Br
Isomeric Smiles
c1(c(c(sc1Br)Br)Br)Br
Calculated Properties
JChem
H Acceptors
0
H Donor
0
LogD (pH = 5.5)
5.1606903
LogD (pH = 7.4)
5.1606903
Log P
5.1606903
Molar Refractivity
51.9748
Polarizability
21.734882
Polar Surface Area
0.0
Rotatable Bonds
0
Lipinski's Rule of Five
false
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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