| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 10th, 2010 | 18 | Yes |
Popular Name: 2-[4-[(1R)-2-amino-1-(5-bromo-2-thienyl)ethyl]piperazin-1-yl]ethanol 2-[4-[(1R)-2-amino-1-(5-bromo-2-…
| 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) | 0.82 | -1.25 | -48.87 | 4 | 4 | 1 | 54 | 335.291 | 5 | ↓ |
| Hi High (pH 8-9.5) | 0.82 | -1.62 | -4.56 | 3 | 4 | 0 | 53 | 334.283 | 5 | ↓ |
| Mid Mid (pH 6-8) | 0.82 | 1.08 | -100.68 | 5 | 4 | 2 | 56 | 336.299 | 5 | ↓ |
