COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK806010
Chemical Name: 2-butanoyl-3-[(4-methoxyphenyl)amino]-5,5-dimethylcyclohex-2-en-1-one
Smiles: CCCC(=O)C1=C(Nc2ccc(cc2)OC)CC(CC1=O)(C)C

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Molecular Weight: 315.41
Empirical Formula: C19H25NO3

Physical State: Dry powder
Available Amount: 190 mg

Lipinsky:
logP: 3.136
Rotatable bonds: 3
H-donors: 1
H-acceptors: 3
PSA: 55
Number of rings: 2

     

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