Molecule

ID:111136

General Information

Structure

MolImage

Molecular Formula

C₄KN₄Rh

Molecular Mass

246.0734

Exact Mass

245.8815067

Charge

0

InChI

InChI=1S/4CN.K.Rh/c4*1-2;;/q4*-1;+1;+3

InChIKey

KOCYIAPIOBMTLG-UHFFFAOYSA-N

Canonic Smiles

N#[C-].N#[C-].N#[C-].N#[C-].[K+].[Rh+3]

Isomeric Smiles

[K+].[Rh+3].[C-]#N.[C-]#N.[C-]#N.[C-]#N

Calculated Properties

JChem

Acid pKa

9.5

H Acceptors

1

H Donor

0

LogD (pH = 5.5)

-0.34610683

LogD (pH = 7.4)

-0.33904728

Log P

-0.34619832

Molar Refractivity

15.8149

Polarizability

2.6105857

Polar Surface Area

23.79

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

References

Bioactivity