COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK039936
Chemical Name: 2-(ethylsulfanyl)ethyl4-(2-fluorophenyl)-7-(2-methoxyphenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Smiles: CCSCCOC(=O)C1=C(C)NC2=C(C1c1ccccc1F)C(=O)CC(C2)c1ccccc1OC

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Molecular Weight: 495.61
Empirical Formula: C28H30FNO4S

Physical State: Dry powder
Available Amount: 250 mg

Lipinsky:
logP: 4.67
Rotatable bonds: 9
H-donors: 1
H-acceptors: 4
PSA: 89
Number of rings: 4

     

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