| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 14th, 2010 | 21 | Yes |
Popular Name: [3-[(1S,2S)-2-amino-1-(4-bromophenyl)butoxy]phenyl]methanol [3-[(1S,2S)-2-amino-1-(4-bromoph…
| 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) | 3.44 | 5.33 | -46.06 | 4 | 3 | 1 | 57 | 351.264 | 6 | ↓ |
| Hi High (pH 8-9.5) | 3.44 | 5.1 | -4.95 | 3 | 3 | 0 | 55 | 350.256 | 6 | ↓ |
