COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK543018
Chemical Name: (4S,4aR)-2-amino-6-tert-butyl-4-(3,4-difluorophenyl)-4a,5,6,7-tetrahydronaphthalene-1,3,3(4H)-tricarbonitrile
Smiles: N#CC1=C(N)C([C@@H]([C@@H]2C1=CCC(C2)C(C)(C)C)c1ccc(c(c1)F)F)(C#N)C#N

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Molecular Weight: 392.45
Empirical Formula: C23H22F2N4

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 5.169
Rotatable bonds: 0
H-donors: 2
H-acceptors: 0
PSA: 97
Number of rings: 3

     

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