| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 2nd, 2006 | 25 | No |
Popular Name: 2-benzothiazol-2-yl-4-[1-(2-methoxyethylamino)ethylidene]-5-propyl-pyrazol-3-one 2-benzothiazol-2-yl-4-[1-(2-meth…
| 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) | 3.52 | 7.83 | -24.13 | 1 | 6 | 0 | 69 | 358.467 | 7 | ↓ |
| Mid Mid (pH 6-8) | 3.79 | -2.52 | -48.32 | 1 | 6 | 1 | 68 | 359.475 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
