COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK388824
Chemical Name: 2-(4-nitrophenyl)-2-oxoethyl3-(3,4-dicyanophenoxy)benzoate
Smiles: N#Cc1ccc(cc1C#N)Oc1cccc(c1)C(=O)OCC(=O)c1ccc(cc1)[N+](=O)[O-]

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Molecular Weight: 427.37
Empirical Formula: C23H13N3O6

Physical State: Dry powder
Available Amount: 168 mg

Lipinsky:
logP: 4.881
Rotatable bonds: 6
H-donors: 0
H-acceptors: 6
PSA: 146
Number of rings: 3

     

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