UCSF

ZINC40771970

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
April 12th, 2010 21 Yes

Popular Name: N-[(2-methylimidazo[1,2-a]pyridin-3-yl)methyl]-2-(4-methyl-1-piperidyl)ethanamine N-[(2-methylimidazo[1,2-a]pyridi…

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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) 2.50 9.1 -77.48 3 4 2 35 288.439 5 ↓
Mid Mid (pH 6-8) 2.50 8.66 -43.72 2 4 1 34 287.431 5 ↓
Lo Low (pH 4.5-6) 2.50 10.02 -133.42 3 4 2 38 288.439 5 ↓

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

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