COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL434179
Chemical Name: 1-cycloheptyl-4-(6,7-dimethoxy-1,3-benzodioxol-5-yl)-6-methyl-1,4-dihydropyrazolo[3,4-d][1,3]thiazin-3(2H)-one
Smiles: COc1c(cc2c(c1OC)OCO2)C1SC(=Nc2c1c(=O)[nH]n2C1CCCCCC1)C

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Molecular Weight: 445.54
Empirical Formula: C22H27N3O5S

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 4.179
Rotatable bonds: 4
H-donors: 1
H-acceptors: 5
PSA: 106
Number of rings: 5

     

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