COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK405018
Chemical Name: 3-(2-ethoxyethyl)6-methyl2,7-dimethyl-4-(4-methyl-3-nitrophenyl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3,6-dicarboxylate
Smiles: CCOCCOC(=O)C1=C(C)NC2=C(C1c1ccc(c(c1)[N+](=O)[O-])C)C(=O)C(C(C2)C)C(=O)OC

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Molecular Weight: 486.52
Empirical Formula: C25H30N2O8

Physical State: Dry powder
Available Amount: 161 mg

Lipinsky:
logP: 2.542
Rotatable bonds: 9
H-donors: 1
H-acceptors: 8
PSA: 136
Number of rings: 3

     

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