COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL521563
Chemical Name: 2-[(6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl)methyl]-5-[2-(3,4-dimethoxyphenyl)-2-oxoethoxy]-4H-pyran-4-one
Smiles: COc1cc(ccc1OC)C(=O)COc1coc(cc1=O)CN1CCc2c(C1)cc(c(c2)OC)OC

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Molecular Weight: 495.53
Empirical Formula: C27H29NO8

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.777
Rotatable bonds: 10
H-donors: 0
H-acceptors: 8
PSA: 92
Number of rings: 4

     

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