COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK532716
Chemical Name: 2-(dimethylamino)ethyl3-[(5E)-4-oxo-2-thioxo-5-(3,4,5-trimethoxybenzylidene)-1,3-thiazolidin-3-yl]propanoate
Smiles: COc1cc(/C=C\2/SC(=S)N(C2=O)CCC(=O)OCCN(C)C)cc(c1OC)OC

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Saltdata: HCl
Molecular Weight: 454.57
Empirical Formula: C20H26N2O6S2

Physical State: Dry powder
Available Amount: 350 mg

Lipinsky:
logP: 1.88
Rotatable bonds: 8
H-donors: 0
H-acceptors: 6
PSA: 134
Number of rings: 2

     

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