COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK352636
Chemical Name: 3-thioxo-1-(trifluoromethyl)-2,3,5,6,7,8-hexahydroisoquinoline-4-carbonitrile
Smiles: N#Cc1c(=S)[nH]c(c2c1CCCC2)C(F)(F)F

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Molecular Weight: 258.27
Empirical Formula: C11H9F3N2S

Physical State: Dry powder
Available Amount: 104 mg

Lipinsky:
logP: 2.782
Rotatable bonds: 0
H-donors: 1
H-acceptors: 0
PSA: 67
Number of rings: 2

     

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