COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK552894
Chemical Name: 2-(diethylamino)ethyl4-({(Z)-2-[4-(1,3-benzodioxol-5-yl)-1,3-thiazol-2-yl]-2-cyanoethenyl}amino)benzoate
Smiles: CCN(CCOC(=O)c1ccc(cc1)N/C=C(\c1scc(n1)c1ccc2c(c1)OCO2)/C#N)CC

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Molecular Weight: 490.58
Empirical Formula: C26H26N4O4S

Physical State: Dry powder
Available Amount: 373 mg

Lipinsky:
logP: 5.574
Rotatable bonds: 7
H-donors: 1
H-acceptors: 4
PSA: 124
Number of rings: 4

     

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