| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 17th, 2011 | 20 | Yes |
Popular Name: (2S,4R)-4-(dimethylamino)-1-[(1-propylimidazol-2-yl)methyl]pyrrolidine-2-carboxylic (2S,4R)-4-(dimethylamino)-1-[(1-…
| 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) | -1.29 | 6.91 | -26.69 | 1 | 6 | 0 | 66 | 280.372 | 6 | ↓ |
| Hi High (pH 8-9.5) | -1.29 | 4.92 | -47 | 0 | 6 | -1 | 64 | 279.364 | 6 | ↓ |
| Hi High (pH 8-9.5) | -1.29 | 5.79 | -50.04 | 1 | 6 | 0 | 66 | 280.372 | 6 | ↓ |
| Mid Mid (pH 6-8) | -1.29 | 8.18 | -81.52 | 2 | 6 | 1 | 67 | 281.38 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
