COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL342777
Chemical Name: {1-[4-(diethylamino)phenyl]-4a-hydroxyoctahydroisoquinolin-2(1H)-yl}acetonitrile
Smiles: N#CCN1CCC2(C(C1c1ccc(cc1)N(CC)CC)CCCC2)O

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Molecular Weight: 341.5
Empirical Formula: C21H31N3O

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 3.327
Rotatable bonds: 4
H-donors: 1
H-acceptors: 1
PSA: 50
Number of rings: 3

     

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