COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK280138
Chemical Name: ethyl2-(acetylamino)-6-formyl-7-(phenylsulfanyl)-4,5-dihydro-1-benzothiophene-3-carboxylate
Smiles: CCOC(=O)c1c(NC(=O)C)sc2c1CCC(=C2Sc1ccccc1)C=O

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Molecular Weight: 401.51
Empirical Formula: C20H19NO4S2

Physical State: Dry powder
Available Amount: 4359 mg

Lipinsky:
logP: 5.621
Rotatable bonds: 5
H-donors: 1
H-acceptors: 4
PSA: 126
Number of rings: 3

     

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