COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL514873
Chemical Name: (2Z)-1-(5,6-dihydro-1,4-dioxin-2-yl)-2-(6,7-dimethoxy-3,4-dihydroisoquinolin-1(2H)-ylidene)ethanone
Smiles: COc1cc2/C(=C/C(=O)C3=COCCO3)/NCCc2cc1OC

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Molecular Weight: 317.34
Empirical Formula: C17H19NO5

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 1.912
Rotatable bonds: 4
H-donors: 1
H-acceptors: 5
PSA: 66
Number of rings: 3

     

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