| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 2nd, 2009 | 19 | Yes |
Popular Name: 4-{2-hydroxy-3-[(1-hydroxybutan-2-yl)amino]propoxy}benzonitrile 4-{2-hydroxy-3-[(1-hydroxybutan-…
| 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) | 1.12 | 1.19 | -47.04 | 4 | 5 | 1 | 90 | 265.333 | 8 | ↓ |
| Hi High (pH 8-9.5) | 1.12 | 0.17 | -9.73 | 3 | 5 | 0 | 86 | 264.325 | 8 | ↓ |
