UCSF

ZINC48968987

Draw Identity 99% 90% 80% 70%

Substance Information

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

Popular Name: N-[(6-methylimidazo[1,2-a]pyridin-2-yl)methyl]-1H-triazole-4-carboxamide N-[(6-methylimidazo[1,2-a]pyridi…

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Download: MOL2 SDF SMILES Flexibase

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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) 0.62 2.86 -12.92 2 7 0 88 256.269 3 ↓
Hi High (pH 8-9.5) 0.62 2.78 -43.54 1 7 -1 86 255.261 3 ↓
Mid Mid (pH 6-8) 0.62 3.25 -32.01 3 7 1 89 257.277 3 ↓
Mid Mid (pH 6-8) 0.62 3.23 -43.47 2 7 0 88 256.269 3 ↓

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

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