COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK782741
Chemical Name: ethyl4-(3-nitrophenyl)-2,5-dioxo-7-(thiophen-2-yl)-1,2,3,4,5,6,7,8-octahydroquinoline-6-carboxylate
Smiles: CCOC(=O)C1C(CC2=C(C1=O)C(CC(=O)N2)c1cccc(c1)[N+](=O)[O-])c1cccs1

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Molecular Weight: 440.48
Empirical Formula: C22H20N2O6S

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 3.768
Rotatable bonds: 5
H-donors: 1
H-acceptors: 6
PSA: 146
Number of rings: 4

     

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