UCSF

ZINC70193731

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 6th, 2011 20 Yes

Popular Name: 2-[(2S)-1-(imidazo[1,2-a]pyridin-2-ylmethyl)-2-piperidyl]-N-methyl-ethanamine 2-[(2S)-1-(imidazo[1,2-a]pyridin…

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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) 2.29 8.2 -88.69 3 4 2 38 274.412 5 ↓
Hi High (pH 8-9.5) 2.29 7.43 -38.25 2 4 1 37 273.404 5 ↓
Lo Low (pH 4.5-6) 2.29 9.03 -100.48 3 4 2 38 274.412 5 ↓

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

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