COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK748792
Chemical Name: 6-amino-8-[2-(trifluoromethyl)phenyl]-8,8a-dihydro-1H-isothiochromene-5,7,7(3H)-tricarbonitrile
Smiles: N#CC1=C(N)C(C(C2C1=CCSC2)c1ccccc1C(F)(F)F)(C#N)C#N

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Molecular Weight: 386.4
Empirical Formula: C19H13F3N4S

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 3.565
Rotatable bonds: 1
H-donors: 2
H-acceptors: 0
PSA: 122
Number of rings: 3

     

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