COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK032209
Chemical Name: 2-{[(4-nitrophenyl)amino]methylidene}-5-phenylcyclohexane-1,3-dione
Smiles: O=C1CC(CC(=O)/C/1=C\Nc1ccc(cc1)[N+](=O)[O-])c1ccccc1

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Molecular Weight: 336.35
Empirical Formula: C19H16N2O4

Physical State: Dry powder
Available Amount: 93 mg

Lipinsky:
logP: 2.798
Rotatable bonds: 0
H-donors: 1
H-acceptors: 4
PSA: 91
Number of rings: 3

     

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