COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL532276
Chemical Name: N-({[(2Z)-2-(3-methoxybenzylidene)-3-oxo-2,3-dihydro-1-benzofuran-6-yl]oxy}acetyl)-L-asparticacid
Smiles: COc1cccc(c1)/C=C/1\Oc2c(C1=O)ccc(c2)OCC(=O)N[C@H](C(=O)O)CC(=O)O

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Molecular Weight: 441.39
Empirical Formula: C22H19NO9

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 2.914
Rotatable bonds: 10
H-donors: 3
H-acceptors: 9
PSA: 148
Number of rings: 3

     

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