UCSF

ZINC48966885

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
September 21st, 2010 19 Yes

Popular Name: 2-[(3S)-3-hydroxy-1-piperidyl]imidazo[1,2-a]pyridine-3-carboxylic 2-[(3S)-3-hydroxy-1-piperidyl]im…

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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) 1.10 4.33 -63.06 1 6 -1 81 260.273 2 ↓
Mid Mid (pH 6-8) 1.10 5.35 -33.43 2 6 0 82 261.281 2 ↓
Lo Low (pH 4.5-6) 1.10 4.79 -49.41 2 6 0 82 261.281 2 ↓

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Rings

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

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