Molecule

ID:68305

General Information
Structure
MolImage
Molecular Formula
C₆H₂Cl₂N₂S
Molecular Mass
205.06448
Exact Mass
203.93157443
Charge
0
InChI
InChI=1S/C6H2Cl2N2S/c7-3-1-9-2-4-5(3)10-6(8)11-4/h1-2H
InChIKey
GIABXDLWFMADBA-UHFFFAOYSA-N
Canonic Smiles
Clc1nc2c(s1)cncc2Cl
Isomeric Smiles
c1c2c(c(cn1)Cl)nc(s2)Cl
Calculated Properties
JChem
H Acceptors
2
H Donor
0
LogD (pH = 5.5)
2.4138398
LogD (pH = 7.4)
2.4138582
Log P
2.4138584
Molar Refractivity
44.8025
Polarizability
18.692448
Polar Surface Area
25.78
Rotatable Bonds
0
Lipinski's Rule of Five
true
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
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References
Bioactivity
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