COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK333266
Chemical Name: 4-(5-bromo-2-hydroxyphenyl)-3-hydroxy-7,7-dimethyl-1,4,6,7,8,9-hexahydro-5H-pyrazolo[3,4-b]quinolin-5-one
Smiles: Brc1ccc(c(c1)C1C2=C(Nc3c1c(O)n[nH]3)CC(CC2=O)(C)C)O

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Molecular Weight: 404.26
Empirical Formula: C18H18BrN3O3

Physical State: Dry powder
Available Amount: 321 mg

Lipinsky:
logP: 3.396
Rotatable bonds: 3
H-donors: 4
H-acceptors: 3
PSA: 98
Number of rings: 4

     

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