| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 19th, 2008 | 21 | Yes |
Popular Name: (2S)-2-[(2,4-dioxo1H-pyrimidine-5-carbonyl)amino]-3-(1H-imidazol-4-yl)propanoic (2S)-2-[(2,4-dioxo1H-pyrimidine-…
| 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) | -3.91 | 1.07 | -64.2 | 5 | 10 | 0 | 165 | 293.239 | 5 | ↓ |
| Hi High (pH 8-9.5) | -3.46 | -1.42 | -99.46 | 3 | 10 | -2 | 167 | 291.223 | 5 | ↓ |
| Hi High (pH 8-9.5) | -3.46 | -1.4 | -105.52 | 3 | 10 | -2 | 167 | 291.223 | 5 | ↓ |
| Mid Mid (pH 6-8) | -3.91 | 0.5 | -64.52 | 4 | 10 | -1 | 164 | 292.231 | 5 | ↓ |
| Mid Mid (pH 6-8) | -3.91 | 0.48 | -57.56 | 4 | 10 | -1 | 164 | 292.231 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
![N-[2-(1H-imidazol-5-yl)ethyl]-2,4-diketo-1H-pyrimidine-5-carboxamide](http://zinc12.docking.org/img/rings/71100.gif)