COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK757375
Chemical Name: 6-amino-2-propyl-8-[2-(trifluoromethyl)phenyl]-2,3,8,8a-tetrahydroisoquinoline-5,7,7(1H)-tricarbonitrile
Smiles: CCCN1CC=C2C(C1)C(c1ccccc1C(F)(F)F)C(C(=C2C#N)N)(C#N)C#N

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Molecular Weight: 411.43
Empirical Formula: C22H20F3N5

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 3.987
Rotatable bonds: 3
H-donors: 2
H-acceptors: 0
PSA: 100
Number of rings: 3

     

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