COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK524150
Chemical Name: [4a-hydroxy-1-(3,4,5-trimethoxyphenyl)octahydroisoquinolin-2(1H)-yl]acetonitrile
Smiles: N#CCN1CCC2(C(C1c1cc(OC)c(c(c1)OC)OC)CCCC2)O

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Molecular Weight: 360.45
Empirical Formula: C20H28N2O4

Physical State: Dry powder
Available Amount: 32 mg

Lipinsky:
logP: 1.595
Rotatable bonds: 4
H-donors: 1
H-acceptors: 4
PSA: 74
Number of rings: 3

     

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