COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL410634
Chemical Name: 5-[1-(2,2-dimethyltetrahydro-2H-pyran-4-yl)-3-hydroxy-6-methyl-1,4-dihydropyrazolo[3,4-d][1,3]thiazin-4-yl]-1,3-dimethyl-1,3-dihydro-2H-benzimidazol-2-one
Smiles: CC1=Nc2c(C(S1)c1ccc3c(c1)n(C)c(=O)n3C)c(nn2C1CCOC(C1)(C)C)O

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Molecular Weight: 441.55
Empirical Formula: C22H27N5O3S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 0.961
Rotatable bonds: 3
H-donors: 1
H-acceptors: 3
PSA: 108
Number of rings: 5

     

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