COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL562592
Chemical Name: methyl(5E)-2,2-dimethyl-4,6-dioxo-5-{1-[(2-phenylethyl)amino]propylidene}cyclohexanecarboxylate
Smiles: COC(=O)C1C(=O)/C(=C(/NCCc2ccccc2)\CC)/C(=O)CC1(C)C

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Molecular Weight: 357.45
Empirical Formula: C21H27NO4

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.835
Rotatable bonds: 5
H-donors: 1
H-acceptors: 4
PSA: 72
Number of rings: 2

     

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