COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK158390
Chemical Name: 2-{[(3-methylbutyl)amino]methylidene}-5-phenylcyclohexane-1,3-dione
Smiles: CC(CCN/C=C/1\C(=O)CC(CC1=O)c1ccccc1)C

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Molecular Weight: 285.39
Empirical Formula: C18H23NO2

Physical State: Dry powder
Available Amount: 48 mg

Lipinsky:
logP: 2.936
Rotatable bonds: 3
H-donors: 1
H-acceptors: 2
PSA: 46
Number of rings: 2

     

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