| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 2nd, 2005 | 22 | Yes |
Popular Name: 4-[(2-hydroxyethyl-propyl-amino)methyl]-1,5-dimethyl-2-phenyl-pyrazol-3-one 4-[(2-hydroxyethyl-propyl-amino)…
| 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) | 1.38 | 6.56 | -37.34 | 2 | 5 | 1 | 52 | 304.414 | 7 | ↓ |
| Mid Mid (pH 6-8) | 1.38 | 4.5 | -18.46 | 1 | 5 | 0 | 50 | 303.406 | 7 | ↓ |
