COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL400364
Chemical Name: (5Z)-3-[2-(3,4-dimethoxyphenyl)ethyl]-5-[(1-ethyl-3-methyl-1H-pyrazol-4-yl)methylidene]-2-thioxo-1,3-thiazolidin-4-one
Smiles: COc1cc(CCN2C(=S)S/C(=C\c3cn(nc3C)CC)/C2=O)ccc1OC

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Molecular Weight: 417.55
Empirical Formula: C20H23N3O3S2

Physical State: Dry powder
Available Amount: 53 mg

Lipinsky:
logP: 2.738
Rotatable bonds: 7
H-donors: 0
H-acceptors: 3
PSA: 113
Number of rings: 3

     

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