Molecule

ID:63321

General Information
Structure
MolImage
Molecular Formula
C₄H₁₀ClNS
Molecular Mass
139.6469
Exact Mass
139.02224801
Charge
0
InChI
InChI=1S/C4H9NS.ClH/c1-6-4-2-5-3-4;/h4-5H,2-3H2,1H3;1H
InChIKey
PKQXOKYPKFJWAP-UHFFFAOYSA-N
Canonic Smiles
CSC1CNC1.Cl
Isomeric Smiles
Cl.CSC1CNC1
Calculated Properties
JChem
H Acceptors
1
H Donor
1
LogD (pH = 5.5)
-2.8423245
LogD (pH = 7.4)
-1.8501368
Log P
0.3475578
Molar Refractivity
29.5479
Polarizability
11.959459
Polar Surface Area
12.03
Rotatable Bonds
1
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