Molecule

ID:110536

General Information

Structure

MolImage

Molecular Formula

MoS₃

Molecular Mass

192.155

Exact Mass

193.821621

Charge

0

InChI

InChI=1S/Mo.3S/q+6;3*-2

InChIKey

XYBZEHZFCCFXPF-UHFFFAOYSA-N

Canonic Smiles

[SH2-2].[SH2-2].[SH2-2].[Mo+6]

Isomeric Smiles

[SH2-2].[SH2-2].[SH2-2].[Mo+6]

Calculated Properties

JChem

H Acceptors

0

H Donor

1

LogD (pH = 5.5)

-0.69215196

LogD (pH = 7.4)

-0.85428166

Log P

-0.6895

Molar Refractivity

7.3558

Polarizability

2.9659069

Polar Surface Area

0.0

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

No Data Available

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Molecule Details

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References

Bioactivity