COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: BBL000748
Chemical Name: ethyl2- {[(3- iodophenyl)carbonyl]amino}- 4,5,6,7- tetrahydro- 1- benzothiophene- 3- carboxylate
Smiles: CCOC(=O)c1c(NC(=O)c2cccc(c2)I)sc2c1CCCC2

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

Molecular Weight: 455.32
Empirical Formula: C18H18INO3S

Physical State: Dry powder
Available Amount: 13528 mg

Lipinsky:
logP: 7.48
Rotatable bonds: 4
H-donors: 1
H-acceptors: 3
PSA: 83
Number of rings: 3

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