COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL427588
Chemical Name: [(5E)-5-(3-methoxy-4-{[(4-methylphenyl)carbonyl]oxy}benzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]aceticacid
Smiles: COc1cc(ccc1OC(=O)c1ccc(cc1)C)/C=C\1/SC(=S)N(C1=O)CC(=O)O

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Molecular Weight: 443.5
Empirical Formula: C21H17NO6S2

Physical State: Dry powder
Available Amount: 112 mg

Lipinsky:
logP: 3.495
Rotatable bonds: 7
H-donors: 1
H-acceptors: 6
PSA: 150
Number of rings: 3

     

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