COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: BBL030033
Chemical Name: 1-(4-methoxy-6-methyl-5,6,7,8-tetrahydro[1,3]dioxolo[4,5-g]isoquinolin-5-yl)pentane-2,4-dione
Smiles: COc1c2c(CCN(C2CC(=O)CC(=O)C)C)cc2c1OCO2

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Molecular Weight: 319.36
Empirical Formula: C17H21NO5

Physical State: Dry powder
Available Amount: 1000 mg

Lipinsky:
logP: 2.491
Rotatable bonds: 5
H-donors: 0
H-acceptors: 5
PSA: 65
Number of rings: 3

     

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