Molecule

ID:67013

General Information
Structure
MolImage
Molecular Formula
C₃H₃ClN₂S
Molecular Mass
134.58732
Exact Mass
133.97054679
Charge
0
InChI
InChI=1S/C3H3ClN2S/c1-2-5-3(4)7-6-2/h1H3
InChIKey
ILTLLMVRPBXCSX-UHFFFAOYSA-N
Canonic Smiles
Cc1nsc(n1)Cl
Isomeric Smiles
s1nc(nc1Cl)C
Calculated Properties
JChem
H Acceptors
2
H Donor
0
LogD (pH = 5.5)
1.6115328
LogD (pH = 7.4)
1.6115378
Log P
1.6115379
Molar Refractivity
30.73
Polarizability
11.167792
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
Click here to submit data
Molecular Spectra
No Data Available
Click here to submit data
Molecule Details
暂无数据
点击上传数据
References
Bioactivity
Navigation