| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 8th, 2010 | 17 | Yes |
Popular Name: 1-[(2S)-2-[(4-methyl-1H-imidazol-5-yl)methylamino]propyl]pyrrolidin-2-one 1-[(2S)-2-[(4-methyl-1H-imidazol…
| 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) | 0.03 | 5.44 | -41.1 | 3 | 5 | 1 | 66 | 237.327 | 5 | ↓ |
| Hi High (pH 8-9.5) | 0.03 | 4.43 | -12.76 | 2 | 5 | 0 | 61 | 236.319 | 5 | ↓ |
| Mid Mid (pH 6-8) | 0.03 | 5.88 | -108.67 | 4 | 5 | 2 | 67 | 238.335 | 5 | ↓ |
| Mid Mid (pH 6-8) | 0.03 | 4.88 | -41.07 | 3 | 5 | 1 | 62 | 237.327 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
![1-[2-(1H-imidazol-4-ylmethylamino)ethyl]-2-pyrrolidone](http://zinc12.docking.org/img/rings/152811.gif)