COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL516378
Chemical Name: N-({[(2Z)-3-oxo-2-(3,4,5-trimethoxybenzylidene)-2,3-dihydro-1-benzofuran-6-yl]oxy}acetyl)-beta-alanine
Smiles: COc1cc(/C=C/2\Oc3c(C2=O)ccc(c3)OCC(=O)NCCC(=O)O)cc(c1OC)OC

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Molecular Weight: 457.44
Empirical Formula: C23H23NO9

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 1.724
Rotatable bonds: 9
H-donors: 2
H-acceptors: 9
PSA: 129
Number of rings: 3

     

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