COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK923802
Chemical Name: (2Z)-2-(2,5-dimethoxybenzylidene)-3-oxo-2,3-dihydro-1-benzofuran-6-yl3-nitrobenzoate
Smiles: COc1ccc(c(c1)/C=C/1\Oc2c(C1=O)ccc(c2)OC(=O)c1cccc(c1)[N+](=O)[O-])OC

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Molecular Weight: 447.4
Empirical Formula: C24H17NO8

Physical State: Dry powder
Available Amount: 400 mg

Lipinsky:
logP: 4.841
Rotatable bonds: 6
H-donors: 0
H-acceptors: 8
PSA: 116
Number of rings: 4

     

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