COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK559657
Chemical Name: 2-[(5Z)-4-oxo-5-(pyridinium-3-ylmethylidene)-2-thioxo-1,3-thiazolidin-3-yl]-3-phenylpropanoate
Smiles: [O-]C(=O)C(N1C(=S)S/C(=C\c2ccc[nH+]c2)/C1=O)Cc1ccccc1

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Molecular Weight: 370.45
Empirical Formula: C18H14N2O3S2

Physical State: Dry powder
Available Amount: 310 mg

Lipinsky:
logP: 2.643
Rotatable bonds: 3
H-donors: 1
H-acceptors: 3
PSA: 131
Number of rings: 3

     

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