COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK602401
Chemical Name: 1-butyl-3-{[2-(2-hydroxyethoxy)ethyl]amino}-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile
Smiles: CCCCc1nc(NCCOCCO)c(c2c1CCCC2)C#N

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Molecular Weight: 317.43
Empirical Formula: C18H27N3O2

Physical State: Dry powder
Available Amount: 330 mg

Lipinsky:
logP: 3.806
Rotatable bonds: 9
H-donors: 2
H-acceptors: 2
PSA: 78
Number of rings: 2

     

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