| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 15th, 2011 | 19 | Yes |
Popular Name: (1S)-1-[3-bromo-4-[(6-methyl-3-pyridyl)oxy]phenyl]-N-methyl-ethanamine (1S)-1-[3-bromo-4-[(6-methyl-3-p…
| 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) | 3.53 | 7.36 | -43.98 | 2 | 3 | 1 | 39 | 322.226 | 4 | ↓ |
| Hi High (pH 8-9.5) | 3.53 | 6.18 | -4.96 | 1 | 3 | 0 | 34 | 321.218 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
