COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK606983
Chemical Name: 1-{[1-(1,3-benzodioxol-5-yl)-5,5-dioxido-3a,4,6,6a-tetrahydro-1H-thieno[3,4-d]imidazol-2-yl]sulfanyl}-3,3-dimethylbutan-2-one
Smiles: O=C(C(C)(C)C)CSC1=NC2C(N1c1ccc3c(c1)OCO3)CS(=O)(=O)C2

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Molecular Weight: 410.52
Empirical Formula: C18H22N2O5S2

Physical State: Dry powder
Available Amount: 306 mg

Lipinsky:
logP: 1.682
Rotatable bonds: 3
H-donors: 0
H-acceptors: 5
PSA: 118
Number of rings: 4

     

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