COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL169979
Chemical Name: ethyl2-{[(4-methoxy-3-nitrophenyl)carbonyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Smiles: CCOC(=O)c1c(NC(=O)c2ccc(c(c2)[N+](=O)[O-])OC)sc2c1CCCC2

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Molecular Weight: 404.44
Empirical Formula: C19H20N2O6S

Physical State: Dry powder
Available Amount: 50 mg

Lipinsky:
logP: 6.14
Rotatable bonds: 5
H-donors: 1
H-acceptors: 6
PSA: 138
Number of rings: 3

     

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