COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: BBL000809
Chemical Name: ethyl2- {[3- (acetylsulfanyl)propanoyl]amino}- 4,5,6,7- tetrahydro- 1- benzothiophene- 3- carboxylate
Smiles: CCOC(=O)c1c(NC(=O)CCSC(=O)C)sc2c1CCCC2

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Molecular Weight: 355.48
Empirical Formula: C16H21NO4S2

Physical State: Dry powder
Available Amount: 5540 mg

Lipinsky:
logP: 4.667
Rotatable bonds: 7
H-donors: 1
H-acceptors: 4
PSA: 126
Number of rings: 2

     

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