COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK604635
Chemical Name: 1-butyl-3-[(tetrahydrofuran-2-ylmethyl)amino]-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile
Smiles: CCCCc1nc(NCC2CCCO2)c(c2c1CCCC2)C#N

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Molecular Weight: 313.44
Empirical Formula: C19H27N3O

Physical State: Dry powder
Available Amount: 115 mg

Lipinsky:
logP: 4.76
Rotatable bonds: 5
H-donors: 1
H-acceptors: 1
PSA: 57
Number of rings: 3

     

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