COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL547353
Chemical Name: [(1R,4aS,8aS)-1-(2,4-dimethoxyphenyl)-4a-hydroxyoctahydroisoquinolin-2(1H)-yl]acetonitrile
Smiles: N#CCN1CC[C@@]2([C@H]([C@@H]1c1ccc(cc1OC)OC)CCCC2)O

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Molecular Weight: 330.43
Empirical Formula: C19H26N2O3

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 1.867
Rotatable bonds: 3
H-donors: 1
H-acceptors: 3
PSA: 65
Number of rings: 3

     

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