| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 18th, 2008 | 16 | Yes |
Popular Name: 4-[(1S)-1-[[(1S)-1-(hydroxymethyl)propyl]amino]ethyl]benzene-1,3-diol 4-[(1S)-1-[[(1S)-1-(hydroxymethy…
| 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) | 1.73 | -1.65 | -37.92 | 5 | 4 | 1 | 77 | 226.296 | 5 | ↓ |
| Hi High (pH 8-9.5) | 1.73 | -0.86 | -43.49 | 4 | 4 | 0 | 80 | 225.288 | 5 | ↓ |
