COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL407551
Chemical Name: 3-{4-[1-(2,2-dimethyltetrahydro-2H-pyran-4-yl)-3-hydroxy-6-methyl-1,4-dihydropyrazolo[3,4-d][1,3]thiazin-4-yl]-3,5-dimethyl-1H-pyrazol-1-yl}propanoicacid
Smiles: OC(=O)CCn1nc(c(c1C)C1SC(=Nc2c1c(O)nn2C1CCOC(C1)(C)C)C)C

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Molecular Weight: 447.56
Empirical Formula: C21H29N5O4S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 0.394
Rotatable bonds: 7
H-donors: 2
H-acceptors: 4
PSA: 140
Number of rings: 4

     

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