COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL564945
Chemical Name: (5S)-4-methoxy-6-methyl-5-(phenylethynyl)-5,6,7,8-tetrahydro[1,3]dioxolo[4,5-g]isoquinoline
Smiles: COc1c2c(CCN([C@H]2C#Cc2ccccc2)C)cc2c1OCO2

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Molecular Weight: 321.38
Empirical Formula: C20H19NO3

Physical State: Liquid
Available Amount: 78 mg

Lipinsky:
logP: 4.839
Rotatable bonds: 1
H-donors: 0
H-acceptors: 3
PSA: 30
Number of rings: 4

     

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