COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK565805
Chemical Name: 4-[4-(benzyloxy)phenyl]-5-hydroxy-2-(methylsulfanyl)-4,6,7,8-tetrahydroquinoline-3-carbonitrile
Smiles: CSC1=C(C#N)C(C2=C(CCCC2=N1)O)c1ccc(cc1)OCc1ccccc1

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Molecular Weight: 402.52
Empirical Formula: C24H22N2O2S

Physical State: Dry powder
Available Amount: 315 mg

Lipinsky:
logP: 4.935
Rotatable bonds: 3
H-donors: 1
H-acceptors: 2
PSA: 90
Number of rings: 4

     

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