| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 25th, 2009 | 23 | Yes |
Popular Name: (2S)-2-(4-fluorophenyl)-2-(1-piperidyl)-N-(4-pyridylmethyl)ethanamine (2S)-2-(4-fluorophenyl)-2-(1-pip…
| 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) | 2.89 | 7.08 | -5.09 | 1 | 3 | 0 | 28 | 313.42 | 6 | ↓ |
| Mid Mid (pH 6-8) | 2.89 | 8.97 | -44.21 | 2 | 3 | 1 | 29 | 314.428 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 2.89 | 9.38 | -89.69 | 3 | 3 | 2 | 31 | 315.436 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 2.89 | 8.37 | -51.55 | 2 | 3 | 1 | 33 | 314.428 | 6 | ↓ |
