COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK897897
Chemical Name: 3-[(4-fluoro-2-nitrophenyl)amino]-5,5-dimethylcyclohex-2-en-1-one
Smiles: O=C1C=C(Nc2ccc(cc2[N+](=O)[O-])F)CC(C1)(C)C

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Molecular Weight: 278.28
Empirical Formula: C14H15FN2O3

Physical State: Dry powder
Available Amount: 1501 mg

Lipinsky:
logP: 3.181
Rotatable bonds: 0
H-donors: 1
H-acceptors: 3
PSA: 74
Number of rings: 2

     

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