COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK034663
Chemical Name: 4-methoxybenzyl4-(2-ethoxyphenyl)-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Smiles: CCOc1ccccc1C1C(=C(C)NC2=C1C(=O)CC(C2)(C)C)C(=O)OCc1ccc(cc1)OC

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Molecular Weight: 475.58
Empirical Formula: C29H33NO5

Physical State: Dry powder
Available Amount: 200 mg

Lipinsky:
logP: 4.515
Rotatable bonds: 6
H-donors: 1
H-acceptors: 5
PSA: 73
Number of rings: 4

     

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