| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 24th, 2009 | 22 | Yes |
Popular Name: (2S)-2-(p-tolyl)-N-(2-pyridylmethyl)-2-pyrrolidin-1-yl-ethanamine (2S)-2-(p-tolyl)-N-(2-pyridylmet…
| 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) | 2.79 | 8.85 | -34.51 | 2 | 3 | 1 | 29 | 296.438 | 6 | ↓ |
| Mid Mid (pH 6-8) | 2.79 | 6.31 | -4.22 | 1 | 3 | 0 | 28 | 295.43 | 6 | ↓ |
| Mid Mid (pH 6-8) | 2.79 | 7.69 | -39.38 | 2 | 3 | 1 | 33 | 296.438 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 2.79 | 8.83 | -94.18 | 3 | 3 | 2 | 31 | 297.446 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 2.79 | 10.14 | -114.43 | 3 | 3 | 2 | 34 | 297.446 | 6 | ↓ |
