COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK803920
Chemical Name: diethyl5-({(Z)-2-[4-(1,3-benzodioxol-5-yl)-1,3-thiazol-2-yl]-2-cyanoethenyl}amino)-3-methylthiophene-2,4-dicarboxylate
Smiles: CCOC(=O)c1c(N/C=C(\c2scc(n2)c2ccc3c(c2)OCO3)/C#N)sc(c1C)C(=O)OCC

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Molecular Weight: 511.58
Empirical Formula: C24H21N3O6S2

Physical State: Dry powder
Available Amount: 100 mg

Lipinsky:
logP: 7.674
Rotatable bonds: 8
H-donors: 1
H-acceptors: 6
PSA: 176
Number of rings: 4

     

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