COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK576029
Chemical Name: dimethyl5-({(Z)-2-[4-(1,3-benzodioxol-5-yl)-1,3-thiazol-2-yl]-2-cyanoethenyl}amino)-3-methylthiophene-2,4-dicarboxylate
Smiles: N#C/C(=C/Nc1sc(c(c1C(=O)OC)C)C(=O)OC)/c1scc(n1)c1ccc2c(c1)OCO2

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Molecular Weight: 483.53
Empirical Formula: C22H17N3O6S2

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 6.612
Rotatable bonds: 6
H-donors: 1
H-acceptors: 6
PSA: 176
Number of rings: 4

     

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