COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL023356
Chemical Name: 2-(4-methoxy-6-methyl-5,6,7,8-tetrahydro[1,3]dioxolo[4,5-g]isoquinolin-5-yl)-1-{3-[(E)-2-(pyridin-2-yl)ethenyl]phenyl}ethanone
Smiles: COc1c2c(CCN(C2CC(=O)c2cccc(c2)/C=C/c2ccccn2)C)cc2c1OCO2

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Molecular Weight: 442.51
Empirical Formula: C27H26N2O4

Physical State: Dry powder
Available Amount: 350 mg

Lipinsky:
logP: 4.79
Rotatable bonds: 6
H-donors: 0
H-acceptors: 4
PSA: 60
Number of rings: 5

     

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