| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 7th, 2010 | 20 | Yes |
Popular Name: 4-[[(1-ethylimidazol-2-yl)methyl-methyl-amino]methyl]benzoic 4-[[(1-ethylimidazol-2-yl)methyl…
| 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) | 1.59 | 7.25 | -55.82 | 0 | 5 | -1 | 61 | 272.328 | 6 | ↓ |
| Mid Mid (pH 6-8) | 1.59 | 8.41 | -70.23 | 1 | 5 | 0 | 62 | 273.336 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 1.59 | 9.56 | -79.28 | 1 | 5 | 0 | 62 | 273.336 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
