COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: BBL000754
Chemical Name: ethyl2- (formylamino)- 7- oxo- 4,5,6,7- tetrahydro- 1- benzothiophene- 3- carboxylate
Smiles: O=CNc1sc2c(c1C(=O)OCC)CCCC2=O

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

Molecular Weight: 267.31
Empirical Formula: C12H13NO4S

Physical State: Dry powder
Available Amount: 4894 mg

Lipinsky:
logP: 3.396
Rotatable bonds: 3
H-donors: 1
H-acceptors: 4
PSA: 100
Number of rings: 2

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