COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK924381
Chemical Name: (2Z)-3-oxo-2-(3,4,5-trimethoxybenzylidene)-2,3-dihydro-1-benzofuran-6-yl4-nitrobenzoate
Smiles: COc1cc(/C=C/2\Oc3c(C2=O)ccc(c3)OC(=O)c2ccc(cc2)[N+](=O)[O-])cc(c1OC)OC

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Molecular Weight: 477.43
Empirical Formula: C25H19NO9

Physical State: Dry powder
Available Amount: 400 mg

Lipinsky:
logP: 4.449
Rotatable bonds: 4
H-donors: 0
H-acceptors: 9
PSA: 126
Number of rings: 4

     

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