| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 11th, 2010 | 19 | Yes |
Popular Name: 2-[4-[(1R,2S)-2-amino-1-(4-bromo-2-thienyl)propyl]piperazin-1-yl]ethanol 2-[4-[(1R,2S)-2-amino-1-(4-bromo…
| 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) | 1.03 | -0.31 | -44.56 | 4 | 4 | 1 | 54 | 349.318 | 5 | ↓ |
| Hi High (pH 8-9.5) | 1.03 | -0.65 | -3.94 | 3 | 4 | 0 | 53 | 348.31 | 5 | ↓ |
| Mid Mid (pH 6-8) | 1.03 | 2.03 | -96.87 | 5 | 4 | 2 | 56 | 350.326 | 5 | ↓ |
