COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK038833
Chemical Name: 1-ethyl-3-(ethylsulfanyl)-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile
Smiles: CCSc1nc(CC)c2c(c1C#N)CCCC2

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Molecular Weight: 246.38
Empirical Formula: C14H18N2S

Physical State: Dry powder
Available Amount: 458 mg

Lipinsky:
logP: 4.898
Rotatable bonds: 3
H-donors: 0
H-acceptors: 0
PSA: 61
Number of rings: 2

     

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