COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL360930
Chemical Name: 3-(ethylsulfanyl)-1-(4-methylphenyl)-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile
Smiles: CCSc1nc(c2ccc(cc2)C)c2c(c1C#N)CCCC2

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Molecular Weight: 308.45
Empirical Formula: C19H20N2S

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 6.152
Rotatable bonds: 2
H-donors: 0
H-acceptors: 0
PSA: 61
Number of rings: 3

     

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