| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 20th, 2009 | 20 | Yes |
Popular Name: 4-[(1R)-2-amino-1-[(2S)-2-ethyl-1-piperidyl]ethyl]-2-methoxy-phenol 4-[(1R)-2-amino-1-[(2S)-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) | 1.84 | 2.81 | -51.94 | 4 | 4 | 1 | 60 | 279.404 | 5 | ↓ |
| Hi High (pH 8-9.5) | 1.84 | 5.31 | -53.3 | 3 | 4 | 0 | 63 | 278.396 | 5 | ↓ |
| Hi High (pH 8-9.5) | 1.84 | 5.42 | -135.49 | 4 | 4 | 1 | 64 | 279.404 | 5 | ↓ |
| Hi High (pH 8-9.5) | 1.84 | 4.52 | -31.31 | 4 | 4 | 1 | 60 | 279.404 | 5 | ↓ |
