COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL428711
Chemical Name: [(5Z)-5-(4-{2-[(3-chlorophenyl)amino]-2-oxoethoxy}-3-ethoxybenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]aceticacid
Smiles: CCOc1cc(ccc1OCC(=O)Nc1cccc(c1)Cl)/C=C/1\SC(=S)N(C1=O)CC(=O)O

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Molecular Weight: 506.99
Empirical Formula: C22H19ClN2O6S2

Physical State: Dry powder
Available Amount: 133 mg

Lipinsky:
logP: 3.352
Rotatable bonds: 9
H-donors: 2
H-acceptors: 6
PSA: 162
Number of rings: 3

     

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