COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK740672
Chemical Name: methyl(2E)-[(2Z)-2-(1-cyano-2-{[2-(3,4-dimethoxyphenyl)ethyl]amino}-2-oxoethylidene)-4-oxo-3-phenyl-1,3-thiazolidin-5-ylidene]ethanoate
Smiles: COC(=O)/C=c\1/s/c(=C(\C(=O)NCCc2ccc(c(c2)OC)OC)/C#N)/n(c1=O)c1ccccc1

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Molecular Weight: 493.54
Empirical Formula: C25H23N3O6S

Physical State: Dry powder
Available Amount: 350 mg

Lipinsky:
logP: 1.668
Rotatable bonds: 8
H-donors: 1
H-acceptors: 6
PSA: 143
Number of rings: 3

     

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