COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL410085
Chemical Name: 1-(2,2-dimethyltetrahydro-2H-pyran-4-yl)-4-[1-(1,1-dioxidotetrahydrothiophen-3-yl)-3,5-dimethyl-1H-pyrazol-4-yl]-6-methyl-1,4-dihydropyrazolo[3,4-d][1,3]thiazin-3(2H)-one
Smiles: CC1=Nc2c(C(S1)c1c(C)nn(c1C)C1CCS(=O)(=O)C1)c(=O)[nH]n2C1CCOC(C1)(C)C

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Molecular Weight: 493.65
Empirical Formula: C22H31N5O4S2

Physical State: Dry powder
Available Amount: 308 mg

Lipinsky:
logP: 0.656
Rotatable bonds: 3
H-donors: 1
H-acceptors: 4
PSA: 139
Number of rings: 5

     

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