COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: BBL000819
Chemical Name: ethyl2- {[(4- chlorophenyl)carbonyl]amino}- 7- oxo- 4,5,6,7- tetrahydro- 1- benzothiophene- 3- carboxylate
Smiles: CCOC(=O)c1c(NC(=O)c2ccc(cc2)Cl)sc2c1CCCC2=O

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Molecular Weight: 377.85
Empirical Formula: C18H16ClNO4S

Physical State: Dry powder
Available Amount: 6653 mg

Lipinsky:
logP: 5.314
Rotatable bonds: 3
H-donors: 1
H-acceptors: 4
PSA: 100
Number of rings: 3

     

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