COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK072331
Chemical Name: 2-(ethylsulfanyl)ethyl2-methyl-4-(naphthalen-1-yl)-5-oxo-7-phenyl-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Smiles: CCSCCOC(=O)C1=C(C)NC2=C(C1c1cccc3c1cccc3)C(=O)CC(C2)c1ccccc1

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Molecular Weight: 497.66
Empirical Formula: C31H31NO3S

Physical State: Dry powder
Available Amount: 319 mg

Lipinsky:
logP: 5.934
Rotatable bonds: 7
H-donors: 1
H-acceptors: 3
PSA: 80
Number of rings: 5

     

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