COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL034023
Chemical Name: 2-{[(2Z)-3-oxo-2-(3,4,5-trimethoxybenzylidene)-2,3-dihydro-1-benzofuran-6-yl]oxy}propanoicacid
Smiles: COc1cc(/C=C/2\Oc3c(C2=O)ccc(c3)OC(C(=O)O)C)cc(c1OC)OC

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Molecular Weight: 400.39
Empirical Formula: C21H20O8

Physical State: Dry powder
Available Amount: 399 mg

Lipinsky:
logP: 2.587
Rotatable bonds: 6
H-donors: 1
H-acceptors: 8
PSA: 100
Number of rings: 3

     

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