COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL523585
Chemical Name: 5-bromo-N-[(4-hydroxy-6-methyl-5-oxo-5,6,7,8-tetrahydro[1,3]dioxolo[4,5-g]isoquinolin-9-yl)methyl]pyridine-3-carboxamide
Smiles: Brc1cncc(c1)C(=O)NCc1c2OCOc2c(c2c1CCN(C2=O)C)O

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Molecular Weight: 434.25
Empirical Formula: C18H16BrN3O5

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 1.482
Rotatable bonds: 4
H-donors: 2
H-acceptors: 5
PSA: 100
Number of rings: 4

     

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