COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK280129
Chemical Name: ethyl6-bromo-7-ethoxy-2-{[(4-nitrophenyl)carbonyl]amino}-1-benzothiophene-3-carboxylate
Smiles: CCOC(=O)c1c(NC(=O)c2ccc(cc2)[N+](=O)[O-])sc2c1ccc(c2OCC)Br

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Molecular Weight: 493.33
Empirical Formula: C20H17BrN2O6S

Available Amount: 0 mg

Lipinsky:
logP: 8.16
Rotatable bonds: 5
H-donors: 1
H-acceptors: 6
PSA: 138
Number of rings: 3

     

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