COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK995685
Chemical Name: ethyl(7E)-2-(acetylamino)-7-[(acetyloxy)imino]-6-(phenylsulfanyl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Smiles: CCOC(=O)c1c(NC(=O)C)sc2c1CCC(/C/2=N\OC(=O)C)Sc1ccccc1

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Molecular Weight: 446.55
Empirical Formula: C21H22N2O5S2

Physical State: Dry powder
Available Amount: 211 mg

Lipinsky:
logP: 4.295
Rotatable bonds: 6
H-donors: 1
H-acceptors: 5
PSA: 147
Number of rings: 3

     

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