COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK402813
Chemical Name: 2-(ethylsulfanyl)ethyl4-(4-hydroxy-3-methoxyphenyl)-2-methyl-5-oxo-7-(thiophen-2-yl)-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Smiles: CCSCCOC(=O)C1=C(C)NC2=C(C1c1ccc(c(c1)OC)O)C(=O)CC(C2)c1cccs1

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Molecular Weight: 499.65
Empirical Formula: C26H29NO5S2

Physical State: Dry powder
Available Amount: 150 mg

Lipinsky:
logP: 3.349
Rotatable bonds: 10
H-donors: 2
H-acceptors: 5
PSA: 138
Number of rings: 4

     

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