COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK158510
Chemical Name: 2-{[(2-methoxy-4-nitrophenyl)amino]methylidene}-5-phenylcyclohexane-1,3-dione
Smiles: COc1cc(ccc1N/C=C/1\C(=O)CC(CC1=O)c1ccccc1)[N+](=O)[O-]

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Molecular Weight: 366.37
Empirical Formula: C20H18N2O5

Physical State: Dry powder
Available Amount: 158 mg

Lipinsky:
logP: 3
Rotatable bonds: 1
H-donors: 1
H-acceptors: 5
PSA: 101
Number of rings: 3

     

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