Molecule

ID:127078

General Information

Structure

MolImage

Molecular Formula

C₂H₆ClO₂PS

Molecular Mass

160.559601

Exact Mass

159.95146474

Charge

0

InChI

InChI=1S/C2H6ClO2PS/c1-5-6(3,4)7-2/h1-2H3

InChIKey

NBAUXRCSDWYKRP-UHFFFAOYSA-N

Canonic Smiles

COP(=O)(SC)Cl

Isomeric Smiles

ClP(=O)(OC)SC

Calculated Properties

JChem

H Acceptors

1

H Donor

0

LogD (pH = 5.5)

1.0219822

LogD (pH = 7.4)

1.0219822

Log P

1.0219822

Molar Refractivity

33.7149

Polarizability

13.559046

Polar Surface Area

26.3

Rotatable Bonds

2

Lipinski's Rule of Five

true

Data Source

Names and Identifiers

Registration numbers

Properties

No Data Available

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Related Proteins

No Data Available

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Molecular Spectra

No Data Available

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Molecule Details

References

Bioactivity