| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 4th, 2011 | 29 | No |
Popular Name: 2-[(E)-[(1,1-dioxo-1,2-benzothiazol-3-yl)-[2-(4-pyridyl)ethyl]hydrazono]methyl]phenol 2-[(E)-[(1,1-dioxo-1,2-benzothia…
None
| 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) | 2.17 | 5.62 | -21.88 | 1 | 7 | 0 | 95 | 406.467 | 6 | ↓ |
| Hi High (pH 8-9.5) | 2.17 | 6.38 | -60.65 | 0 | 7 | -1 | 98 | 405.459 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 2.17 | 6.07 | -62.84 | 2 | 7 | 1 | 96 | 407.475 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
![(benzalamino)-(1,1-diketo-1,2-benzothiazol-3-yl)-[2-(4-pyridyl)ethyl]amine](http://zinc12.docking.org/img/rings/195242.gif)