COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK280151
Chemical Name: ethyl2-(acetylamino)-6-bromo-7-[3-(tert-butylamino)-2-hydroxypropoxy]-1-benzothiophene-3-carboxylate
Smiles: CCOC(=O)c1c(NC(=O)C)sc2c1ccc(c2OCC(CNC(C)(C)C)O)Br

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Molecular Weight: 487.41
Empirical Formula: C20H27BrN2O5S

Physical State: Dry powder
Available Amount: 2289 mg

Lipinsky:
logP: 5.745
Rotatable bonds: 9
H-donors: 3
H-acceptors: 5
PSA: 125
Number of rings: 2

     

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