COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL095884
Chemical Name: ethyl3-{[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]sulfonyl}-1-benzothiophene-2-carboxylate
Smiles: CCOC(=O)c1sc2c(c1S(=O)(=O)N1CCN(CC1)Cc1ccc3c(c1)OCO3)cccc2

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Molecular Weight: 488.59
Empirical Formula: C23H24N2O6S2

Physical State: Dry powder
Available Amount: 24 mg

Lipinsky:
logP: 5.524
Rotatable bonds: 5
H-donors: 0
H-acceptors: 6
PSA: 122
Number of rings: 5

     

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