| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 29th, 2010 | 15 | Yes |
Popular Name: (2S)-1-amino-3-[(3-bromophenyl)methyl-methyl-amino]propan-2-ol (2S)-1-amino-3-[(3-bromophenyl)m…
| 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) | 0.69 | 0.34 | -44.77 | 4 | 3 | 1 | 51 | 274.182 | 5 | ↓ |
| Hi High (pH 8-9.5) | 0.69 | -0.11 | -4.8 | 3 | 3 | 0 | 49 | 273.174 | 5 | ↓ |
| Mid Mid (pH 6-8) | 0.69 | 3.23 | -49.93 | 4 | 3 | 1 | 55 | 274.182 | 5 | ↓ |
