| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 7th, 2010 | 15 | Yes |
Popular Name: 5-(1H-imidazol-5-ylmethylamino)-1-methyl-pyridin-2-one 5-(1H-imidazol-5-ylmethylamino)-…
| 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) | 0.08 | 3.91 | -49.09 | 3 | 5 | 1 | 64 | 205.241 | 3 | ↓ |
| Mid Mid (pH 6-8) | 0.08 | 3.93 | -49.1 | 3 | 5 | 1 | 64 | 205.241 | 3 | ↓ |
| Mid Mid (pH 6-8) | 0.08 | 3.45 | -14.16 | 2 | 5 | 0 | 63 | 204.233 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
