| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 18th, 2008 | 20 | Yes |
Popular Name: 4-[(1R)-1-[(1-isopropyl-4-piperidyl)amino]ethyl]benzene-1,3-diol 4-[(1R)-1-[(1-isopropyl-4-piperi…
| 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) | 2.58 | 2.86 | -36.23 | 4 | 4 | 1 | 57 | 279.404 | 4 | ↓ |
| Hi High (pH 8-9.5) | 2.59 | 2.2 | -45.33 | 3 | 4 | 0 | 63 | 278.396 | 4 | ↓ |
| Mid Mid (pH 6-8) | 2.59 | 1.41 | -41.56 | 4 | 4 | 1 | 60 | 279.404 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 2.59 | 3.72 | -110.29 | 5 | 4 | 2 | 61 | 280.412 | 4 | ↓ |
