COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK812801
Chemical Name: (5Z)-3-[2-(3,4-dimethoxyphenyl)ethyl]-5-{[3-(4-ethoxy-3-fluorophenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-2-thioxo-1,3-thiazolidin-4-one
Smiles: CCOc1ccc(cc1F)c1nn(cc1/C=C/1\SC(=S)N(C1=O)CCc1ccc(c(c1)OC)OC)c1ccccc1

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Molecular Weight: 589.71
Empirical Formula: C31H28FN3O4S2

Physical State: Dry powder
Available Amount: 104 mg

Lipinsky:
logP: 6.172
Rotatable bonds: 9
H-donors: 0
H-acceptors: 4
PSA: 123
Number of rings: 5

     

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