| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 15th, 2010 | 19 | Yes |
Popular Name: [(2S)-1-[(4-propoxyphenyl)methyl]-2-piperidyl]methanamine [(2S)-1-[(4-propoxyphenyl)methyl…
| 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) | 2.38 | 7.49 | -125.75 | 4 | 3 | 2 | 41 | 264.413 | 6 | ↓ |
| Mid Mid (pH 6-8) | 2.38 | 7.03 | -31.28 | 3 | 3 | 1 | 40 | 263.405 | 6 | ↓ |
| Mid Mid (pH 6-8) | 2.38 | 5.63 | -46.31 | 3 | 3 | 1 | 40 | 263.405 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
