| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 11th, 2010 | 23 | No |
Popular Name: 1-[4-[3-amino-4-hydroxy-3-(hydroxymethyl)butyl]phenyl]octan-1-one 1-[4-[3-amino-4-hydroxy-3-(hydro…
| 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) | 3.82 | 4.07 | -52.33 | 5 | 4 | 1 | 85 | 322.469 | 12 | ↓ |
| Hi High (pH 8-9.5) | 3.82 | 3.77 | -9.95 | 4 | 4 | 0 | 84 | 321.461 | 12 | ↓ |
