COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK333905
Chemical Name: (4R,7S)-3-hydroxy-7-(thiophen-2-yl)-4-[2-(trifluoromethyl)phenyl]-1,4,6,7,8,9-hexahydro-5H-pyrazolo[3,4-b]quinolin-5-one
Smiles: O=C1C[C@H](CC2=C1[C@@H](c1c(N2)[nH]nc1O)c1ccccc1C(F)(F)F)c1cccs1

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Molecular Weight: 431.44
Empirical Formula: C21H16F3N3O2S

Physical State: Dry powder
Available Amount: 260 mg

Lipinsky:
logP: 4.006
Rotatable bonds: 1
H-donors: 3
H-acceptors: 2
PSA: 106
Number of rings: 5

     

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