COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: BBL000721
Chemical Name: ethyl2- [(3- bromopropanoyl)amino]- 4,5,6,7- tetrahydro- 1- benzothiophene- 3- carboxylate
Smiles: BrCCC(=O)Nc1sc2c(c1C(=O)OCC)CCCC2

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Molecular Weight: 360.27
Empirical Formula: C14H18BrNO3S

Physical State: Dry powder
Available Amount: 21766 mg

Lipinsky:
logP: 4.828
Rotatable bonds: 5
H-donors: 1
H-acceptors: 3
PSA: 83
Number of rings: 2

     

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