COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK407420
Chemical Name: 3-ethyl6-methyl4-[4-(acetyloxy)-3-ethoxyphenyl]-2,7-dimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3,6-dicarboxylate
Smiles: CCOC(=O)C1=C(C)NC2=C(C1c1ccc(c(c1)OCC)OC(=O)C)C(=O)C(C(C2)C)C(=O)OC

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Molecular Weight: 485.53
Empirical Formula: C26H31NO8

Physical State: Dry powder
Available Amount: 150 mg

Lipinsky:
logP: 2.348
Rotatable bonds: 10
H-donors: 1
H-acceptors: 8
PSA: 117
Number of rings: 3

     

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