COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK780597
Chemical Name: ethyl4-(3-bromophenyl)-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)Br)c1cccs1

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Molecular Weight: 474.38
Empirical Formula: C22H20BrNO4S

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 4.81
Rotatable bonds: 5
H-donors: 1
H-acceptors: 4
PSA: 100
Number of rings: 4

     

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