COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK560276
Chemical Name: 2-[(5Z)-4-oxo-5-(pyridinium-4-ylmethylidene)-2-thioxo-1,3-thiazolidin-3-yl]propanoate
Smiles: CC(N1C(=S)S/C(=C\c2cc[nH+]cc2)/C1=O)C(=O)[O-]

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Molecular Weight: 294.36
Empirical Formula: C12H10N2O3S2

Physical State: Dry powder
Available Amount: 306 mg

Lipinsky:
logP: 0.531
Rotatable bonds: 1
H-donors: 1
H-acceptors: 3
PSA: 131
Number of rings: 2

     

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