COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK363666
Chemical Name: 2-(ethylsulfanyl)ethyl4-(2-methoxyphenyl)-2-methyl-5-oxo-7-phenyl-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Smiles: CCSCCOC(=O)C1=C(C)NC2=C(C1c1ccccc1OC)C(=O)CC(C2)c1ccccc1

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Molecular Weight: 477.62
Empirical Formula: C28H31NO4S

Physical State: Dry powder
Available Amount: 139 mg

Lipinsky:
logP: 4.618
Rotatable bonds: 8
H-donors: 1
H-acceptors: 4
PSA: 89
Number of rings: 4

     

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