COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK075091
Chemical Name: 3-[(furan-2-ylmethyl)amino]-5,5-dimethylcyclohex-2-en-1-one
Smiles: O=C1C=C(NCc2ccco2)CC(C1)(C)C

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Molecular Weight: 219.28
Empirical Formula: C13H17NO2

Physical State: Dry powder
Available Amount: 110 mg

Lipinsky:
logP: 2.229
Rotatable bonds: 2
H-donors: 1
H-acceptors: 2
PSA: 42
Number of rings: 2

     

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