COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL232798
Chemical Name: methyl3-butanoyl-6,6-dimethyl-2-oxo-4-(piperidin-1-yl)cyclohex-3-ene-1-carboxylate
Smiles: CCCC(=O)C1=C(CC(C(C1=O)C(=O)OC)(C)C)N1CCCCC1

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Molecular Weight: 335.44
Empirical Formula: C19H29NO4

Physical State: Dry powder
Available Amount: 308 mg

Lipinsky:
logP: 3.538
Rotatable bonds: 5
H-donors: 0
H-acceptors: 4
PSA: 63
Number of rings: 2

     

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