COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL562777
Chemical Name: 4-(1,3-benzodioxol-5-yl)-1-(4-methoxy-6-methyl-5,6,7,8-tetrahydro[1,3]dioxolo[4,5-g]isoquinolin-5-yl)butan-2-ol
Smiles: COc1c2c(CCN(C2CC(CCc2ccc3c(c2)OCO3)O)C)cc2c1OCO2

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Molecular Weight: 413.47
Empirical Formula: C23H27NO6

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 3.785
Rotatable bonds: 7
H-donors: 1
H-acceptors: 6
PSA: 69
Number of rings: 5

     

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