COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK207188
Chemical Name: 5-(4-methoxyphenyl)-3-[(4-nitrophenyl)amino]cyclohex-2-en-1-one
Smiles: COc1ccc(cc1)C1CC(=O)C=C(C1)Nc1ccc(cc1)[N+](=O)[O-]

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Molecular Weight: 338.36
Empirical Formula: C19H18N2O4

Physical State: Dry powder
Available Amount: 121 mg

Lipinsky:
logP: 3.588
Rotatable bonds: 0
H-donors: 1
H-acceptors: 4
PSA: 84
Number of rings: 3

     

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