COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK402906
Chemical Name: 2-ethoxyethyl4-(3-ethoxy-4-hydroxy-5-nitrophenyl)-2-methyl-5-oxo-7-(thiophen-2-yl)-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Smiles: CCOCCOC(=O)C1=C(C)NC2=C(C1c1cc(OCC)c(c(c1)[N+](=O)[O-])O)C(=O)CC(C2)c1cccs1

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Molecular Weight: 542.61
Empirical Formula: C27H30N2O8S

Physical State: Dry powder
Available Amount: 150 mg

Lipinsky:
logP: 3.245
Rotatable bonds: 11
H-donors: 2
H-acceptors: 8
PSA: 168
Number of rings: 4

     

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