COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK003298
Chemical Name: 2-ethoxyethyl4-[4-(benzyloxy)-3-methoxyphenyl]-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Smiles: CCOCCOC(=O)C1=C(C)NC2=C(C1c1ccc(c(c1)OC)OCc1ccccc1)C(=O)CC(C2)(C)C

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Molecular Weight: 519.64
Empirical Formula: C31H37NO6

Physical State: Dry powder
Available Amount: 798 mg

Lipinsky:
logP: 4.297
Rotatable bonds: 10
H-donors: 1
H-acceptors: 6
PSA: 83
Number of rings: 4

     

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