Molecule

ID:51103

General Information
Structure
MolImage
Molecular Formula
C₁₀H₉AgN₄O₂S
Molecular Mass
357.13726
Exact Mass
355.94971855
Charge
0
InChI
InChI=1S/C10H9N4O2S.Ag/c11-8-2-4-9(5-3-8)17(15,16)14-10-12-6-1-7-13-10;/h1-7H,11H2;/q-1;+1
InChIKey
UEJSSZHHYBHCEL-UHFFFAOYSA-N
Canonic Smiles
[Ag]N(S(=O)(=O)c1ccc(cc1)N)c1ncccn1
Isomeric Smiles
S(=O)(=O)(N(c1ncccn1)[Ag])c1ccc(N)cc1
Calculated Properties
JChem
H Acceptors
5
H Donor
1
LogD (pH = 5.5)
0.57776153
LogD (pH = 7.4)
0.57789826
Log P
0.5779
Molar Refractivity
63.4009
Polarizability
28.944445
Polar Surface Area
89.18
Rotatable Bonds
2
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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