COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL521263
Chemical Name: methyl4-{[({6-[(6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl)methyl]-4-oxo-4H-pyran-3-yl}oxy)acetyl]amino}benzoate
Smiles: COC(=O)c1ccc(cc1)NC(=O)COc1coc(cc1=O)CN1CCc2c(C1)cc(c(c2)OC)OC

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Molecular Weight: 508.53
Empirical Formula: C27H28N2O8

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.878
Rotatable bonds: 8
H-donors: 1
H-acceptors: 8
PSA: 112
Number of rings: 4

     

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