COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK362802
Chemical Name: 2-[4-(2,4-dinitrophenoxy)-3-methoxybenzylidene]-1H-indene-1,3(2H)-dione
Smiles: COc1cc(ccc1Oc1ccc(cc1[N+](=O)[O-])[N+](=O)[O-])/C=C/1\C(=O)c2c(C1=O)cccc2

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Molecular Weight: 446.37
Empirical Formula: C23H14N2O8

Physical State: Dry powder
Available Amount: 343 mg

Lipinsky:
logP: 3.765
Rotatable bonds: 4
H-donors: 0
H-acceptors: 8
PSA: 144
Number of rings: 4

     

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