COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL508890
Chemical Name: 6-(butan-2-ylcarbamoyl)cyclohex-3-ene-1-carboxylicacid
Smiles: CC(NC(=O)C1CC=CCC1C(=O)O)CC

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Molecular Weight: 225.29
Empirical Formula: C12H19NO3

Physical State: Dry powder
Available Amount: 1000 mg

Lipinsky:
logP: 1.143
Rotatable bonds: 5
H-donors: 2
H-acceptors: 3
PSA: 66
Number of rings: 1

     

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