COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK898902
Chemical Name: ethyl2-({(Z)-2-cyano-2-[4-(3,4-dimethoxyphenyl)-1,3-thiazol-2-yl]ethenyl}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Smiles: CCOC(=O)c1c(N/C=C(\c2scc(n2)c2ccc(c(c2)OC)OC)/C#N)sc2c1CCCC2

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Molecular Weight: 495.62
Empirical Formula: C25H25N3O4S2

Physical State: Dry powder
Available Amount: 100 mg

Lipinsky:
logP: 7.467
Rotatable bonds: 7
H-donors: 1
H-acceptors: 4
PSA: 149
Number of rings: 4

     

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