COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK312239
Chemical Name: methyl4-(3-nitrophenyl)-2,4-dioxobutanoate
Smiles: COC(=O)C(=O)CC(=O)c1cccc(c1)[N+](=O)[O-]

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Molecular Weight: 251.2
Empirical Formula: C11H9NO6

Physical State: Dry powder
Available Amount: 5069 mg

Lipinsky:
logP: 0.82
Rotatable bonds: 5
H-donors: 0
H-acceptors: 6
PSA: 106
Number of rings: 1

     

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