COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK586766
Chemical Name: 2-(ethylsulfanyl)-5-hydroxy-4-[4-(propan-2-yl)phenyl]-4,6,7,8-tetrahydroquinoline-3-carbonitrile
Smiles: CCSC1=C(C#N)C(C2=C(CCCC2=N1)O)c1ccc(cc1)C(C)C

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Molecular Weight: 352.5
Empirical Formula: C21H24N2OS

Physical State: Dry powder
Available Amount: 228 mg

Lipinsky:
logP: 5.234
Rotatable bonds: 3
H-donors: 1
H-acceptors: 1
PSA: 81
Number of rings: 3

     

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