COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL231774
Chemical Name: 2-[(5Z)-4-oxo-5-(pyridin-4-ylmethylidene)-2-thioxo-1,3-thiazolidin-3-yl]butanoicacid
Smiles: CCC(N1C(=S)S/C(=C\c2ccncc2)/C1=O)C(=O)O

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Molecular Weight: 308.38
Empirical Formula: C13H12N2O3S2

Physical State: Dry powder
Available Amount: 302 mg

Lipinsky:
logP: 1.062
Rotatable bonds: 4
H-donors: 1
H-acceptors: 3
PSA: 127
Number of rings: 2

     

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