| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 19th, 2009 | 18 | Yes |
Popular Name: 3-[(1R)-2-amino-1-[(2R)-2-ethyl-1-piperidyl]ethyl]phenol 3-[(1R)-2-amino-1-[(2R)-2-ethyl-…
| 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) | 2.00 | 1.71 | -46.44 | 4 | 3 | 1 | 51 | 249.378 | 4 | ↓ |
| Hi High (pH 8-9.5) | 2.00 | 4.33 | -49.71 | 3 | 3 | 0 | 54 | 248.37 | 4 | ↓ |
| Hi High (pH 8-9.5) | 2.00 | 4.61 | -136.28 | 4 | 3 | 1 | 55 | 249.378 | 4 | ↓ |
| Hi High (pH 8-9.5) | 2.00 | 3.55 | -33.3 | 4 | 3 | 1 | 51 | 249.378 | 4 | ↓ |
