| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 2nd, 2006 | 25 | No |
Popular Name: 4-[1-(3-hydroxypropylamino)ethylidene]-2,5-diphenyl-pyrazol-3-one 4-[1-(3-hydroxypropylamino)ethyl…
| 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) | 2.57 | 6.3 | -19.83 | 2 | 5 | 0 | 67 | 335.407 | 6 | ↓ |
| Mid Mid (pH 6-8) | 3.05 | -3.31 | -36.77 | 2 | 5 | 1 | 66 | 336.415 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
