COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL550355
Chemical Name: methyl3-[6-(3,4-dihydroisoquinolin-2(1H)-ylmethyl)-3-hydroxy-4-oxo-4H-pyran-2-yl]-3-(2-hydroxyquinolin-3-yl)propanoate
Smiles: COC(=O)CC(c1cc2ccccc2nc1O)c1oc(CN2CCc3c(C2)cccc3)cc(=O)c1O

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Molecular Weight: 486.52
Empirical Formula: C28H26N2O6

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.3
Rotatable bonds: 9
H-donors: 2
H-acceptors: 6
PSA: 109
Number of rings: 5

     

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