COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK809205
Chemical Name: (5E)-5-(4-chlorobenzylidene)-3-[2-(3,4-dimethoxyphenyl)ethyl]-2-thioxo-1,3-thiazolidin-4-one
Smiles: COc1cc(CCN2C(=S)S/C(=C/c3ccc(cc3)Cl)/C2=O)ccc1OC

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Molecular Weight: 419.95
Empirical Formula: C20H18ClNO3S2

Physical State: Dry powder
Available Amount: 88 mg

Lipinsky:
logP: 4.322
Rotatable bonds: 5
H-donors: 0
H-acceptors: 3
PSA: 96
Number of rings: 3

     

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