COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK606787
Chemical Name: 3-[ethyl(2-hydroxyethyl)amino]-1-phenyl-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile
Smiles: OCCN(c1nc(c2ccccc2)c2c(c1C#N)CCCC2)CC

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Molecular Weight: 321.42
Empirical Formula: C20H23N3O

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.632
Rotatable bonds: 4
H-donors: 1
H-acceptors: 1
PSA: 60
Number of rings: 3

     

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