COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK069086
Chemical Name: 3-[(2,5-dimethoxyphenyl)amino]-5,5-dimethylcyclohex-2-en-1-one
Smiles: COc1ccc(cc1NC1=CC(=O)CC(C1)(C)C)OC

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Molecular Weight: 275.35
Empirical Formula: C16H21NO3

Physical State: Dry powder
Available Amount: 97 mg

Lipinsky:
logP: 2.79
Rotatable bonds: 2
H-donors: 1
H-acceptors: 3
PSA: 47
Number of rings: 2

     

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