COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL574167
Chemical Name: ethyl6-(3-nitrophenyl)-2-oxo-4-phenylcyclohex-3-ene-1-carboxylate
Smiles: CCOC(=O)C1C(=O)C=C(CC1c1cccc(c1)[N+](=O)[O-])c1ccccc1

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Molecular Weight: 365.39
Empirical Formula: C21H19NO5

Physical State: Dry powder
Available Amount: 14 mg

Lipinsky:
logP: 4.38
Rotatable bonds: 4
H-donors: 0
H-acceptors: 5
PSA: 89
Number of rings: 3

     

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