| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| June 21st, 2008 | 23 | No |
Popular Name: (4E)-2-(1,3-benzothiazol-2-yl)-4-[1-(3-hydroxypropylamino)ethylidene]-5-methyl-pyrazol-3-one (4E)-2-(1,3-benzothiazol-2-yl)-4…
| 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) | 2.10 | 4.59 | -26.27 | 2 | 6 | 0 | 80 | 330.413 | 5 | ↓ |
| Mid Mid (pH 6-8) | 2.39 | 3.92 | -46.81 | 2 | 6 | 1 | 80 | 331.421 | 5 | ↓ |
