COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK406639
Chemical Name: methyl4-(3-bromo-5-ethoxy-4-hydroxyphenyl)-7-methyl-2,5-dioxo-1,2,3,4,5,6,7,8-octahydroquinoline-6-carboxylate
Smiles: CCOc1cc(cc(c1O)Br)C1CC(=O)NC2=C1C(=O)C(C(C2)C)C(=O)OC

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Molecular Weight: 452.3
Empirical Formula: C20H22BrNO6

Physical State: Dry powder
Available Amount: 209 mg

Lipinsky:
logP: 3.114
Rotatable bonds: 6
H-donors: 2
H-acceptors: 6
PSA: 101
Number of rings: 3

     

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