| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 16th, 2004 | 26 | No |
Popular Name: BRD-A15457190-001-01-0 BRD-A15457190-001-01-0
Find On: PubMed — Wikipedia — Google
CAS Number: 865658-70-4
4-(1,3-benzodioxol-5-yl)-3,7,7-trimethyl-2,4,6,7,8,9-hexahydro-5H-pyrazolo[3,4-b]quinolin-5-one
| 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) | 3.06 | 7.68 | -13.66 | 2 | 6 | 0 | 76 | 351.406 | 1 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| melting_point | 291 - 293 | KeyOrganics |
No pre-computed analogs available. Try a structural similarity search.
![2,4,6,7,8,9-hexahydropyrazolo[3,4-b]quinolin-5-one](http://zinc12.docking.org/img/rings/2091.gif)
![4-(1,3-benzodioxol-5-yl)-2,4,6,7,8,9-hexahydropyrazolo[3,4-b]quinolin-5-one](http://zinc12.docking.org/img/rings/228926.gif)