COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: BBL000040
Chemical Name: ethyl2- [(chloroacetyl)amino]- 4,5,6,7- tetrahydro- 1- benzothiophene- 3- carboxylate
Smiles: CCOC(=O)c1c(NC(=O)CCl)sc2c1CCCC2

Download SD file Download MOL file View 3D-structure Show MSDS

Molecular Weight: 301.79
Empirical Formula: C13H16ClNO3S

Physical State: Dry powder
Available Amount: 17217 mg

Lipinsky:
logP: 4.396
Rotatable bonds: 4
H-donors: 1
H-acceptors: 3
PSA: 83
Number of rings: 2

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