COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK333250
Chemical Name: 3-hydroxy-7,7-dimethyl-4-[4-(prop-2-en-1-yloxy)phenyl]-1,4,6,7,8,9-hexahydro-5H-pyrazolo[3,4-b]quinolin-5-one
Smiles: C=CCOc1ccc(cc1)C1C2=C(Nc3c1c(O)n[nH]3)CC(CC2=O)(C)C

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Molecular Weight: 365.43
Empirical Formula: C21H23N3O3

Physical State: Dry powder
Available Amount: 667 mg

Lipinsky:
logP: 3.845
Rotatable bonds: 3
H-donors: 3
H-acceptors: 3
PSA: 87
Number of rings: 4

     

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