UCSF

ZINC67947178

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
September 17th, 2011 22 Yes

Popular Name: 5-(2-methylpyrimidin-4-yl)-3-phenyl-6,7-dihydro-4H-isoxazolo[4,5-c]pyridine 5-(2-methylpyrimidin-4-yl)-3-phe…

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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) 2.09 8.81 -10.71 0 5 0 55 292.342 2 ↓
Mid Mid (pH 6-8) 2.09 9.25 -41.15 1 5 1 56 293.35 2 ↓

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

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