COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK407480
Chemical Name: 3-ethyl6-methyl4-(2-butoxyphenyl)-2,7-dimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3,6-dicarboxylate
Smiles: CCCCOc1ccccc1C1C(=C(C)NC2=C1C(=O)C(C(C2)C)C(=O)OC)C(=O)OCC

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Molecular Weight: 455.55
Empirical Formula: C26H33NO6

Physical State: Dry powder
Available Amount: 150 mg

Lipinsky:
logP: 4.164
Rotatable bonds: 10
H-donors: 1
H-acceptors: 6
PSA: 90
Number of rings: 3

     

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