COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL343652
Chemical Name: [1-(3,4-dimethoxyphenyl)-4a-hydroxyoctahydroisoquinolin-2(1H)-yl]acetonitrile
Smiles: N#CCN1CCC2(C(C1c1ccc(c(c1)OC)OC)CCCC2)O

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Molecular Weight: 330.43
Empirical Formula: C19H26N2O3

Physical State: Dry powder
Available Amount: 308 mg

Lipinsky:
logP: 1.893
Rotatable bonds: 5
H-donors: 1
H-acceptors: 3
PSA: 65
Number of rings: 3

     

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