UCSF

ZINC53654531

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 24th, 2010 21 Yes

Popular Name: N-[[(3R)-1-(imidazo[1,2-a]pyridin-2-ylmethyl)-3-piperidyl]methyl]propan-1-amine N-[[(3R)-1-(imidazo[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) 2.43 8.73 -77.06 3 4 2 38 288.439 6 ↓
Hi High (pH 8-9.5) 2.43 7.98 -44.34 2 4 1 37 287.431 6 ↓
Lo Low (pH 4.5-6) 2.43 10.18 -101.83 3 4 2 38 288.439 6 ↓

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

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