UCSF

ZINC67981925

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
September 19th, 2011 23 Yes

Popular Name: 3-(3,4-difluorophenyl)-5-(4-piperidyl)-6,7-dihydro-4H-isoxazolo[4,5-c]pyridine 3-(3,4-difluorophenyl)-5-(4-pipe…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 2.19 6.05 -46.7 2 4 1 46 320.363 2 ↓
Lo Low (pH 4.5-6) 2.19 8.25 -129.06 3 4 2 47 321.371 2 ↓

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Analogs ( Draw Identity 99% 90% 80% 70% )

No pre-computed analogs available. Try a structural similarity search.