| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 2nd, 2010 | 16 | Yes |
Popular Name: [(2R)-1-[(3R)-1-isopropylpyrrolidin-3-yl]-2-piperidyl]methanamine [(2R)-1-[(3R)-1-isopropylpyrroli…
| 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) | 0.86 | 3.61 | -95.08 | 4 | 3 | 2 | 35 | 227.396 | 3 | ↓ |
| Hi High (pH 8-9.5) | 0.86 | 5.63 | -99.44 | 4 | 3 | 2 | 35 | 227.396 | 3 | ↓ |
| Hi High (pH 8-9.5) | 0.86 | 1.18 | -44.13 | 3 | 3 | 1 | 34 | 226.388 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 0.86 | 5.69 | -204.61 | 5 | 3 | 3 | 37 | 228.404 | 3 | ↓ |
