COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK085717
Chemical Name: 2-[({2-[4-(2-methylpropanoyl)piperazin-1-yl]ethyl}amino)methylidene]-5-phenylcyclohexane-1,3-dione
Smiles: O=C(N1CCN(CC1)CCN/C=C/1\C(=O)CC(CC1=O)c1ccccc1)C(C)C

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Molecular Weight: 397.52
Empirical Formula: C23H31N3O3

Physical State: Dry powder
Available Amount: 120 mg

Lipinsky:
logP: 1.582
Rotatable bonds: 3
H-donors: 1
H-acceptors: 3
PSA: 69
Number of rings: 3

     

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