Molecule

ID:7825

General Information
Structure
MolImage
Molecular Formula
C₄HBr₃S
Molecular Mass
320.82774
Exact Mass
317.73490703
Charge
0
InChI
InChI=1S/C4HBr3S/c5-2-1-8-4(7)3(2)6/h1H
InChIKey
ZDXQFDMBZUQHOM-UHFFFAOYSA-N
Canonic Smiles
Brc1c(Br)csc1Br
Isomeric Smiles
c1(c(csc1Br)Br)Br
Calculated Properties
JChem
H Acceptors
0
H Donor
0
LogD (pH = 5.5)
4.2259417
LogD (pH = 7.4)
4.2259417
Log P
4.2259417
Molar Refractivity
45.1921
Polarizability
18.419016
Polar Surface Area
0.0
Rotatable Bonds
0
Lipinski's Rule of Five
true
Data Source
Names and Identifiers
Registration numbers
Properties
Related Proteins
No Data Available
Click here to submit data
Molecular Spectra
No Data Available
Click here to submit data
Molecule Details
References
Bioactivity
Navigation