COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL314136
Chemical Name: methylN-{[1-oxo-2-(3,4,5-trimethoxyphenyl)-1,2-dihydroisoquinolin-4-yl]carbonyl}-beta-alaninate
Smiles: COC(=O)CCNC(=O)c1cn(c2cc(OC)c(c(c2)OC)OC)c(=O)c2c1cccc2

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Molecular Weight: 440.45
Empirical Formula: C23H24N2O7

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 1.825
Rotatable bonds: 7
H-donors: 1
H-acceptors: 7
PSA: 103
Number of rings: 3

     

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