COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL038108
Chemical Name: 4-{[(5Z)-4-oxo-5-(pyridinium-3-ylmethylidene)-2-thioxo-1,3-thiazolidin-3-yl]carbamoyl}phenolate
Smiles: [O-]c1ccc(cc1)C(=O)NN1C(=S)S/C(=C\c2ccc[nH+]c2)/C1=O

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Molecular Weight: 357.41
Empirical Formula: C16H11N3O3S2

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 2.286
Rotatable bonds: 2
H-donors: 2
H-acceptors: 3
PSA: 144
Number of rings: 3

     

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