| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 20th, 2009 | 18 | Yes |
Popular Name: 2-[(4-amino-1-piperidyl)methyl]-4-bromo-6-methoxy-phenol 2-[(4-amino-1-piperidyl)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) | 1.31 | 1.13 | -44.17 | 4 | 4 | 1 | 60 | 316.219 | 3 | ↓ |
| Hi High (pH 8-9.5) | 1.31 | 4.12 | -28.52 | 3 | 4 | 0 | 63 | 315.211 | 3 | ↓ |
| Mid Mid (pH 6-8) | 1.31 | 3.85 | -118.55 | 5 | 4 | 2 | 62 | 317.227 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
