COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL158838
Chemical Name: 4-[1-(1,1-dioxidotetrahydrothiophen-3-yl)-6-hydroxy-3-methyl-4,5-dihydro-1H-pyrazolo[3,4-b]pyridin-4-yl]benzoicacid
Smiles: OC1=Nc2c(C(C1)c1ccc(cc1)C(=O)O)c(nn2C1CCS(=O)(=O)C1)C

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Molecular Weight: 389.43
Empirical Formula: C18H19N3O5S

Physical State: Dry powder
Available Amount: 314 mg

Lipinsky:
logP: -0.546
Rotatable bonds: 3
H-donors: 2
H-acceptors: 5
PSA: 130
Number of rings: 4

     

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