COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK068812
Chemical Name: 3-(butylsulfanyl)-1-phenyl-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile
Smiles: CCCCSc1nc(c2ccccc2)c2c(c1C#N)CCCC2

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Molecular Weight: 322.47
Empirical Formula: C20H22N2S

Physical State: Dry powder
Available Amount: 336 mg

Lipinsky:
logP: 6.755
Rotatable bonds: 4
H-donors: 0
H-acceptors: 0
PSA: 61
Number of rings: 3

     

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