COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL552210
Chemical Name: 2-(9-bromo-4-methoxy-6-methyl-5,6,7,8-tetrahydro[1,3]dioxolo[4,5-g]isoquinolin-5-yl)-1-(3,4-dihydroisoquinolin-2(1H)-yl)ethanone
Smiles: COc1c2C(CC(=O)N3CCc4c(C3)cccc4)N(C)CCc2c(c2c1OCO2)Br

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Molecular Weight: 473.37
Empirical Formula: C23H25BrN2O4

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.539
Rotatable bonds: 3
H-donors: 0
H-acceptors: 4
PSA: 51
Number of rings: 5

     

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