COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL005627
Chemical Name: [3-amino-6-(1,3-benzodioxol-5-yl)-4-(trifluoromethyl)thieno[2,3-b]pyridin-2-yl](3,4-dihydroisoquinolin-2(1H)-yl)methanone
Smiles: O=C(c1sc2c(c1N)c(cc(n2)c1ccc2c(c1)OCO2)C(F)(F)F)N1CCc2c(C1)cccc2

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Molecular Weight: 497.5
Empirical Formula: C25H18F3N3O3S

Physical State: Dry powder
Available Amount: 305 mg

Lipinsky:
logP: 5.569
Rotatable bonds: 2
H-donors: 2
H-acceptors: 3
PSA: 105
Number of rings: 6

     

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