COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL563389
Chemical Name: methyl(5E)-2,2-dimethyl-4,6-dioxo-5-[1-(prop-2-en-1-ylamino)butylidene]cyclohexanecarboxylate
Smiles: C=CCN/C(=C/1\C(=O)CC(C(C1=O)C(=O)OC)(C)C)/CCC

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Molecular Weight: 307.39
Empirical Formula: C17H25NO4

Physical State: Dry powder
Available Amount: 299 mg

Lipinsky:
logP: 3.079
Rotatable bonds: 6
H-donors: 1
H-acceptors: 4
PSA: 72
Number of rings: 1

     

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