COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL563404
Chemical Name: methyl(5Z)-5-[1-(heptylamino)propylidene]-2,2-dimethyl-4,6-dioxocyclohexanecarboxylate
Smiles: CCCCCCCN/C(=C\1/C(=O)CC(C(C1=O)C(=O)OC)(C)C)/CC

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Molecular Weight: 351.49
Empirical Formula: C20H33NO4

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.831
Rotatable bonds: 9
H-donors: 1
H-acceptors: 4
PSA: 72
Number of rings: 1

     

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