| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 24th, 2009 | 20 | Yes |
Popular Name: (1S)-1-(benzofuran-2-yl)-2-[(3S)-3-ethyl-1-piperidyl]ethanamine (1S)-1-(benzofuran-2-yl)-2-[(3S)…
| 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) | 1.67 | 8.12 | -38.63 | 3 | 3 | 1 | 44 | 273.4 | 4 | ↓ |
| Mid Mid (pH 6-8) | 1.67 | 8.45 | -129.33 | 4 | 3 | 2 | 45 | 274.408 | 4 | ↓ |
| Mid Mid (pH 6-8) | 1.67 | 6.53 | -41.23 | 3 | 3 | 1 | 44 | 273.4 | 4 | ↓ |
