| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 13th, 2008 | 20 | No |
Popular Name: 4-[[3-[(2S)-2-methyl-1-piperidyl]propylamino]methyl]benzene-1,2-diol 4-[[3-[(2S)-2-methyl-1-piperidyl…
| 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) | 2.07 | 3.39 | -37.17 | 4 | 4 | 1 | 57 | 279.404 | 6 | ↓ |
| Hi High (pH 8-9.5) | 2.07 | 3.31 | -74.46 | 3 | 4 | 0 | 63 | 278.396 | 6 | ↓ |
| Mid Mid (pH 6-8) | 2.07 | 2.51 | -50.43 | 4 | 4 | 1 | 60 | 279.404 | 6 | ↓ |
