COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK011204
Chemical Name: 3-{4-[(6,7-dimethoxy-2-methyl-1,2,3,4-tetrahydroisoquinolin-1-yl)methyl]phenoxy}propanenitrile
Smiles: N#CCCOc1ccc(cc1)CC1N(C)CCc2c1cc(OC)c(c2)OC

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Molecular Weight: 366.46
Empirical Formula: C22H26N2O3

Physical State: Dry powder
Available Amount: 462 mg

Lipinsky:
logP: 3.261
Rotatable bonds: 5
H-donors: 0
H-acceptors: 3
PSA: 54
Number of rings: 3

     

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