COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK526042
Chemical Name: 2-{4-[(1S,8aR)-3-amino-7-tert-butyl-2,2,4-tricyano-1,2,6,7,8,8a-hexahydronaphthalen-1-yl]phenoxy}acetamide
Smiles: N#CC1=C(N)C([C@@H]([C@@H]2C1=CCC(C2)C(C)(C)C)c1ccc(cc1)OCC(=O)N)(C#N)C#N

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Molecular Weight: 429.52
Empirical Formula: C25H27N5O2

Physical State: Dry powder
Available Amount: 311 mg

Lipinsky:
logP: 3.696
Rotatable bonds: 2
H-donors: 4
H-acceptors: 2
PSA: 149
Number of rings: 3

     

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