| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 2nd, 2009 | 17 | Yes |
Popular Name: 4-{2-hydroxy-3-[(2-hydroxyethyl)amino]propoxy}benzonitrile 4-{2-hydroxy-3-[(2-hydroxyethyl)…
| 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) | -0.09 | -0.26 | -47.86 | 4 | 5 | 1 | 90 | 237.279 | 7 | ↓ |
| Hi High (pH 8-9.5) | -0.09 | -1.68 | -10.5 | 3 | 5 | 0 | 86 | 236.271 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.