COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK923355
Chemical Name: ethyl2-{[(2Z)-2-(3-nitrobenzylidene)-3-oxo-2,3-dihydro-1-benzofuran-6-yl]oxy}propanoate
Smiles: CCOC(=O)C(Oc1ccc2c(c1)O/C(=C\c1cccc(c1)[N+](=O)[O-])/C2=O)C

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Molecular Weight: 383.36
Empirical Formula: C20H17NO7

Physical State: Dry powder
Available Amount: 406 mg

Lipinsky:
logP: 3.498
Rotatable bonds: 6
H-donors: 0
H-acceptors: 7
PSA: 107
Number of rings: 3

     

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