COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL527970
Chemical Name: 2-(9-bromo-4-methoxy-6-methyl-5,6,7,8-tetrahydro[1,3]dioxolo[4,5-g]isoquinolin-5-yl)-1-(3-methoxyphenyl)ethanone
Smiles: COc1c2C(CC(=O)c3cccc(c3)OC)N(C)CCc2c(c2c1OCO2)Br

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Saltdata: HBr
Molecular Weight: 448.31
Empirical Formula: C21H22BrNO5

Physical State: Dry powder
Available Amount: 60 mg

Lipinsky:
logP: 4.707
Rotatable bonds: 5
H-donors: 0
H-acceptors: 5
PSA: 57
Number of rings: 4

     

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