UCSF

ZINC69843050

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 30th, 2011 16 Yes

Popular Name: (1R,5S)-3-(4-amino-3-pyridyl)-8-azabicyclo[3.2.1]octan-3-ol (1R,5S)-3-(4-amino-3-pyridyl)-8-…

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Download: MOL2 SDF SMILES Flexibase

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) 0.07 -1.84 -31.37 6 4 0 77 221.304 1 ↓
Hi High (pH 8-9.5) 0.07 -2.81 -42.47 5 4 0 76 220.296 1 ↓

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Rings

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

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