UCSF

ZINC52543833

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 10th, 2010 18 Yes

Popular Name: N-[[5-[[(1S,4R)-5-azabicyclo[2.2.1]heptan-5-yl]methyl]isoxazol-3-yl]methyl]propan-2-amine N-[[5-[[(1S,4R)-5-azabicyclo[2.2…

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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) 1.83 6.88 -92.86 3 4 2 47 251.374 5 ↓
Hi High (pH 8-9.5) 1.83 5.68 -36.96 2 4 1 42 250.366 5 ↓

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Rings

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

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