COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL543647
Chemical Name: methyl3-(6-{[6,7-dimethoxy-1-(3,4,5-trimethoxyphenyl)-3,4-dihydroisoquinolin-2(1H)-yl]methyl}-3-hydroxy-4-oxo-4H-pyran-2-yl)-3-(4-oxo-4H-chromen-3-yl)propanoate
Smiles: COC(=O)CC(c1coc2c(c1=O)cccc2)c1oc(CN2CCc3c(C2c2cc(OC)c(c(c2)OC)OC)cc(c(c3)OC)OC)cc(=O)c1O

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Molecular Weight: 713.74
Empirical Formula: C39H39NO12

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 5.002
Rotatable bonds: 12
H-donors: 1
H-acceptors: 12
PSA: 148
Number of rings: 6

     

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