COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL517747
Chemical Name: (3E)-3-[2-(1,3-benzodioxol-5-yl)-9,10-dimethoxy-6,7-dihydro-4H-pyrido[2,1-a]isoquinolin-4-ylidene]-6-methyl-2H-pyran-2,4(3H)-dione
Smiles: COc1cc2CCn3c(c2cc1OC)cc(c/c/3=C/1\C(=O)OC(=CC1=O)C)c1ccc2c(c1)OCO2

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Molecular Weight: 485.49
Empirical Formula: C28H23NO7

Physical State: Dry powder
Available Amount: 57 mg

Lipinsky:
logP: 3.695
Rotatable bonds: 3
H-donors: 0
H-acceptors: 7
PSA: 83
Number of rings: 6

     

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