COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK009444
Chemical Name: 2-(ethylsulfanyl)ethyl4-[4-(acetyloxy)-3-methoxyphenyl]-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Smiles: CCSCCOC(=O)C1=C(C)NC2=C(C1c1ccc(c(c1)OC)OC(=O)C)C(=O)CCC2

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Molecular Weight: 459.56
Empirical Formula: C24H29NO6S

Physical State: Dry powder
Available Amount: 198 mg

Lipinsky:
logP: 2.2
Rotatable bonds: 10
H-donors: 1
H-acceptors: 6
PSA: 116
Number of rings: 3

     

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