COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK923755
Chemical Name: (2Z)-2-(3-nitrobenzylidene)-3-oxo-2,3-dihydro-1-benzofuran-6-yl2,6-dimethoxybenzoate
Smiles: COc1cccc(c1C(=O)Oc1ccc2c(c1)O/C(=C\c1cccc(c1)[N+](=O)[O-])/C2=O)OC

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Molecular Weight: 447.4
Empirical Formula: C24H17NO8

Physical State: Dry powder
Available Amount: 398 mg

Lipinsky:
logP: 4.141
Rotatable bonds: 5
H-donors: 0
H-acceptors: 8
PSA: 116
Number of rings: 4

     

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