| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 2nd, 2006 | 29 | No |
Popular Name: 2-benzothiazol-2-yl-4-[1-(2-hydroxyethylamino)ethylidene]-5-(4-methoxyphenyl)-pyrazol-3-one 2-benzothiazol-2-yl-4-[1-(2-hydr…
| 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) | 3.33 | 5.71 | -27.25 | 2 | 7 | 0 | 89 | 408.483 | 6 | ↓ |
| Mid Mid (pH 6-8) | 3.39 | -4.96 | -41.62 | 2 | 7 | 1 | 88 | 409.491 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
