UCSF

ZINC42136978

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Substance Information

In ZINC since Heavy atoms Benign functionality
April 25th, 2010 20 Yes

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

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Annotations

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Vendors

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) 1.48 5.99 -34.3 2 6 0 82 275.308 3 ↓
Mid Mid (pH 6-8) 1.48 4.99 -60.54 1 6 -1 81 274.3 3 ↓
Lo Low (pH 4.5-6) 1.48 5.45 -45.8 2 6 0 82 275.308 3 ↓

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

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