Molecule

ID:61869

General Information
Structure
MolImage
Molecular Formula
C₂Br₂N₂S
Molecular Mass
243.9078
Exact Mass
241.81489301
Charge
0
InChI
InChI=1S/C2Br2N2S/c3-1-5-6-2(4)7-1
InChIKey
MNHUBBRVPVSVCM-UHFFFAOYSA-N
Canonic Smiles
Brc1nnc(s1)Br
Isomeric Smiles
s1c(nnc1Br)Br
Calculated Properties
JChem
H Acceptors
2
H Donor
0
LogD (pH = 5.5)
1.8764261
LogD (pH = 7.4)
1.8764261
Log P
1.8764261
Molar Refractivity
36.6388
Polarizability
13.912855
Polar Surface Area
25.78
Rotatable Bonds
0
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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