COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL530432
Chemical Name: N-({[(2Z)-2-(3,4-dimethoxybenzylidene)-3-oxo-2,3-dihydro-1-benzofuran-6-yl]oxy}acetyl)-D-alanine
Smiles: COc1cc(ccc1OC)/C=C/1\Oc2c(C1=O)ccc(c2)OCC(=O)N[C@@H](C(=O)O)C

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Molecular Weight: 427.41
Empirical Formula: C22H21NO8

Physical State: Dry powder
Available Amount: 305 mg

Lipinsky:
logP: 2.755
Rotatable bonds: 9
H-donors: 2
H-acceptors: 8
PSA: 120
Number of rings: 3

     

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