COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK718737
Chemical Name: (2Z)-2-[(2-methyl-2H-chromen-3-yl)methylidene]-6-[(4-nitrobenzyl)oxy]-1-benzofuran-3(2H)-one
Smiles: CC1Oc2ccccc2C=C1/C=C/1\Oc2c(C1=O)ccc(c2)OCc1ccc(cc1)[N+](=O)[O-]

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Molecular Weight: 441.44
Empirical Formula: C26H19NO6

Physical State: Dry powder
Available Amount: 358 mg

Lipinsky:
logP: 5.358
Rotatable bonds: 3
H-donors: 0
H-acceptors: 6
PSA: 90
Number of rings: 5

     

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