COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK403035
Chemical Name: benzyl4-(3-ethoxy-4-hydroxy-5-nitrophenyl)-2-methyl-5-oxo-7-(thiophen-2-yl)-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Smiles: CCOc1cc(cc(c1O)[N+](=O)[O-])C1C(=C(C)NC2=C1C(=O)CC(C2)c1cccs1)C(=O)OCc1ccccc1

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Molecular Weight: 560.63
Empirical Formula: C30H28N2O7S

Physical State: Dry powder
Available Amount: 150 mg

Lipinsky:
logP: 4.493
Rotatable bonds: 8
H-donors: 2
H-acceptors: 7
PSA: 158
Number of rings: 5

     

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