UCSF

ZINC69942639

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 1st, 2011 16 Yes

Popular Name: 4-methyl-3-(1-propylimidazol-2-yl)pyridin-2-amine 4-methyl-3-(1-propylimidazol-2-y…

Find On: PubMed — Wikipedia — Google

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) 1.90 5.79 -7.73 2 4 0 57 216.288 3 ↓
Mid Mid (pH 6-8) 1.90 6.25 -35 3 4 1 58 217.296 3 ↓
Mid Mid (pH 6-8) 1.90 6.23 -28.65 3 4 1 58 217.296 3 ↓
Lo Low (pH 4.5-6) 1.90 6.69 -83.2 4 4 2 59 218.304 3 ↓

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

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