COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK060727
Chemical Name: 2-(propan-2-yloxy)ethyl4-(4-ethoxyphenyl)-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Smiles: CCOc1ccc(cc1)C1C(=C(C)NC2=C1C(=O)CC(C2)(C)C)C(=O)OCCOC(C)C

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Molecular Weight: 441.57
Empirical Formula: C26H35NO5

Physical State: Dry powder
Available Amount: 200 mg

Lipinsky:
logP: 3.698
Rotatable bonds: 7
H-donors: 1
H-acceptors: 5
PSA: 73
Number of rings: 3

     

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