COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL325902
Chemical Name: 2-[4-(6-amino-5,7,7-tricyano-1,2,3,7,8,8a-hexahydroisoquinolin-8-yl)phenoxy]acetamide
Smiles: N#CC1=C(N)C(C(C2C1=CCNC2)c1ccc(cc1)OCC(=O)N)(C#N)C#N

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Molecular Weight: 374.4
Empirical Formula: C20H18N6O2

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 1.034
Rotatable bonds: 2
H-donors: 5
H-acceptors: 2
PSA: 161
Number of rings: 3

     

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