UCSF

ZINC69942666

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 1st, 2011 15 Yes

Popular Name: 3-(1-ethylimidazol-2-yl)-4-methyl-pyridin-2-amine 3-(1-ethylimidazol-2-yl)-4-methy…

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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) 1.40 5.05 -7.92 2 4 0 57 202.261 2 ↓
Mid Mid (pH 6-8) 1.40 5.52 -35.13 3 4 1 58 203.269 2 ↓
Mid Mid (pH 6-8) 1.40 5.49 -28.57 3 4 1 58 203.269 2 ↓
Lo Low (pH 4.5-6) 1.40 5.96 -82.68 4 4 2 59 204.277 2 ↓

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

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