COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL512366
Chemical Name: 9-bromo-4-methoxy-6-methyl-7,8-dihydro[1,3]dioxolo[4,5-g]isoquinolin-5(6H)-one
Smiles: COc1c2C(=O)N(C)CCc2c(c2c1OCO2)Br

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Molecular Weight: 314.14
Empirical Formula: C12H12BrNO4

Physical State: Dry powder
Available Amount: 1004 mg

Lipinsky:
logP: 2.066
Rotatable bonds: 1
H-donors: 0
H-acceptors: 4
PSA: 48
Number of rings: 3

     

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