| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 24th, 2010 | 18 | Yes |
Popular Name: N-[[(2S)-1-[2-(2-methylimidazol-1-yl)ethyl]pyrrolidin-2-yl]methyl]propan-2-amine N-[[(2S)-1-[2-(2-methylimidazol-…
| 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) | 0.96 | 7.14 | -86.4 | 3 | 4 | 2 | 39 | 252.406 | 6 | ↓ |
| Hi High (pH 8-9.5) | 0.96 | 6.66 | -43.29 | 2 | 4 | 1 | 38 | 251.398 | 6 | ↓ |
| Mid Mid (pH 6-8) | 0.96 | 8.48 | -128.58 | 3 | 4 | 2 | 39 | 252.406 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 0.96 | 8.94 | -197.18 | 4 | 4 | 3 | 40 | 253.414 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
