COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL565659
Chemical Name: (2E)-1-(6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl)-3-(5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl)prop-2-en-1-one
Smiles: CCOc1cc2CC(Oc2cc1/C=C/C(=O)N1CCc2c(C1)cc(c(c2)OC)OC)C

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Molecular Weight: 423.51
Empirical Formula: C25H29NO5

Physical State: Liquid
Available Amount: 55 mg

Lipinsky:
logP: 4.422
Rotatable bonds: 6
H-donors: 0
H-acceptors: 5
PSA: 57
Number of rings: 4

     

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