COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL323103
Chemical Name: 4-(4-amino-2,2,3-tricyano-1,2,6,7,8,8a-hexahydronaphthalen-1-yl)phenyltrifluoroacetate
Smiles: N#CC1=C(N)C2=CCCCC2C(C1(C#N)C#N)c1ccc(cc1)OC(=O)C(F)(F)F

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Molecular Weight: 412.37
Empirical Formula: C21H15F3N4O2

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 4.334
Rotatable bonds: 1
H-donors: 2
H-acceptors: 2
PSA: 123
Number of rings: 3

     

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