COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK045944
Chemical Name: 4-methoxybenzyl4-[4-(2-hydroxyethoxy)-3-methoxyphenyl]-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Smiles: OCCOc1ccc(cc1OC)C1C(=C(C)NC2=C1C(=O)CC(C2)(C)C)C(=O)OCc1ccc(cc1)OC

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Molecular Weight: 521.61
Empirical Formula: C30H35NO7

Physical State: Dry powder
Available Amount: 204 mg

Lipinsky:
logP: 2.831
Rotatable bonds: 9
H-donors: 2
H-acceptors: 7
PSA: 103
Number of rings: 4

     

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