COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK844149
Chemical Name: ethyl2-({(Z)-2-[4-(1,3-benzodioxol-5-yl)-1,3-thiazol-2-yl]-2-cyanoethenyl}amino)benzoate
Smiles: CCOC(=O)c1ccccc1N/C=C(\c1scc(n1)c1ccc2c(c1)OCO2)/C#N

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Molecular Weight: 419.46
Empirical Formula: C22H17N3O4S

Physical State: Dry powder
Available Amount: 400 mg

Lipinsky:
logP: 5.843
Rotatable bonds: 5
H-donors: 1
H-acceptors: 4
PSA: 121
Number of rings: 4

     

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