COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK335449
Chemical Name: 2-{3-methyl-5-oxo-7-(thiophen-2-yl)-4-[2-(trifluoromethyl)phenyl]-4,5,6,7,8,9-hexahydro-1H-pyrazolo[3,4-b]quinolin-1-yl}benzoicacid
Smiles: O=C1CC(CC2=C1C(c1c(N2)n(nc1C)c1ccccc1C(=O)O)c1ccccc1C(F)(F)F)c1cccs1

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Molecular Weight: 549.57
Empirical Formula: C29H22F3N3O3S

Physical State: Dry powder
Available Amount: 144 mg

Lipinsky:
logP: 6.043
Rotatable bonds: 4
H-donors: 2
H-acceptors: 3
PSA: 112
Number of rings: 6

     

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