COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK020850
Chemical Name: 2-(ethylsulfanyl)ethyl7-(2-chlorophenyl)-2-methyl-4-(5-methylthiophen-2-yl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Smiles: CCSCCOC(=O)C1=C(C)NC2=C(C1c1ccc(s1)C)C(=O)CC(C2)c1ccccc1Cl

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Molecular Weight: 502.1
Empirical Formula: C26H28ClNO3S2

Physical State: Dry powder
Available Amount: 254 mg

Lipinsky:
logP: 5.436
Rotatable bonds: 8
H-donors: 1
H-acceptors: 3
PSA: 108
Number of rings: 4

     

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