COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL159862
Chemical Name: 1-cyclooctyl-6-hydroxy-4-(3,4,5-trimethoxyphenyl)-1,2,4,5-tetrahydro-3H-pyrazolo[3,4-b]pyridin-3-one
Smiles: COc1cc(cc(c1OC)OC)C1CC(=Nc2c1c(=O)[nH]n2C1CCCCCCC1)O

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Molecular Weight: 429.52
Empirical Formula: C23H31N3O5

Physical State: Dry powder
Available Amount: 310 mg

Lipinsky:
logP: 3.419
Rotatable bonds: 4
H-donors: 2
H-acceptors: 5
PSA: 92
Number of rings: 4

     

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