| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 2nd, 2009 | 19 | Yes |
Popular Name: 4-{2-hydroxy-3-[(pentan-2-yl)amino]propoxy}benzonitrile 4-{2-hydroxy-3-[(pentan-2-yl)ami…
| 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) | 2.66 | 5.12 | -47.58 | 3 | 4 | 1 | 70 | 263.361 | 8 | ↓ |
| Hi High (pH 8-9.5) | 2.66 | 4.1 | -7.46 | 2 | 4 | 0 | 65 | 262.353 | 8 | ↓ |
