| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 19th, 2009 | 19 | Yes |
Popular Name: 4-[(1S)-2-amino-1-(4-methyl-1-piperidyl)ethyl]-2-methoxy-phenol 4-[(1S)-2-amino-1-(4-methyl-1-pi…
| 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) | 1.22 | 4.19 | -132.17 | 5 | 4 | 2 | 62 | 266.385 | 4 | ↓ |
| Hi High (pH 8-9.5) | 1.22 | 4.99 | -142.4 | 4 | 4 | 1 | 64 | 265.377 | 4 | ↓ |
| Hi High (pH 8-9.5) | 1.22 | 3.85 | -34.9 | 4 | 4 | 1 | 60 | 265.377 | 4 | ↓ |
| Hi High (pH 8-9.5) | 1.22 | 2.38 | -53.34 | 4 | 4 | 1 | 60 | 265.377 | 4 | ↓ |
