Molecule

ID:111038

General Information
Structure
MolImage
Molecular Formula
C₃CoKN₃S₃
Molecular Mass
272.2787
Exact Mass
271.8223367
Charge
0
InChI
InChI=1S/3CHNS.Co.K/c3*2-1-3;;/h3*3H;;/q;;;+2;+1/p-3
InChIKey
XBYVWPVKAUQWLK-UHFFFAOYSA-K
Canonic Smiles
[S-]C#N.[S-]C#N.[S-]C#N.[K+].[Co+2]
Isomeric Smiles
[K+].[Co+2].[S-]C#N.[S-]C#N.[S-]C#N
Calculated Properties
JChem
Acid pKa
0.49709612
H Acceptors
1
H Donor
0
LogD (pH = 5.5)
-0.6371734
LogD (pH = 7.4)
-0.63722837
Log P
0.5057529
Molar Refractivity
16.0894
Polarizability
5.888356
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
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