| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 24th, 2010 | 16 | Yes |
Popular Name: [(3R)-1-[(2S)-2-(1-piperidyl)propyl]pyrrolidin-3-yl]methanamine [(3R)-1-[(2S)-2-(1-piperidyl)pro…
| 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) | 0.92 | 4.3 | -85.34 | 4 | 3 | 2 | 35 | 227.396 | 4 | ↓ |
| Hi High (pH 8-9.5) | 0.92 | 1.81 | -41.94 | 3 | 3 | 1 | 34 | 226.388 | 4 | ↓ |
| Mid Mid (pH 6-8) | 0.92 | 5.95 | -107.53 | 4 | 3 | 2 | 35 | 227.396 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 0.92 | 6.33 | -194.16 | 5 | 3 | 3 | 37 | 228.404 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
