| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 20th, 2009 | 20 | Yes |
Popular Name: (1S)-1-[4-(aminomethyl)phenyl]-2-[methyl-(1-methyl-4-piperidyl)amino]ethanol (1S)-1-[4-(aminomethyl)phenyl]-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) | 0.76 | 3.13 | -88.21 | 5 | 4 | 2 | 56 | 279.428 | 5 | ↓ |
| Hi High (pH 8-9.5) | 0.76 | 2.73 | -35.77 | 4 | 4 | 1 | 54 | 278.42 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 0.76 | 5.41 | -165.91 | 6 | 4 | 3 | 57 | 280.436 | 5 | ↓ |
