| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 20th, 2011 | 19 | Yes |
Popular Name: [6-[(3R)-3-(1-piperidyl)pyrrolidin-1-yl]-2-pyridyl]methanamine [6-[(3R)-3-(1-piperidyl)pyrrolid…
| 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) | 1.45 | 6.45 | -87.79 | 4 | 4 | 2 | 48 | 262.401 | 3 | ↓ |
| Hi High (pH 8-9.5) | 1.45 | 4.3 | -42.06 | 3 | 4 | 1 | 47 | 261.393 | 3 | ↓ |
| Hi High (pH 8-9.5) | 1.45 | 3.89 | -4.5 | 2 | 4 | 0 | 45 | 260.385 | 3 | ↓ |
| Hi High (pH 8-9.5) | 1.45 | 4.28 | -23.94 | 3 | 4 | 1 | 47 | 261.393 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 1.45 | 6.43 | -82.61 | 4 | 4 | 2 | 48 | 262.401 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
