| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 3rd, 2010 | 22 | Yes |
Popular Name: 6-(3,4-dihydro-2H-quinolin-1-ylmethyl)-1-methyl-5H-pyrazolo[3,4-d]pyrimidin-4-one 6-(3,4-dihydro-2H-quinolin-1-ylm…
| 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) | 1.65 | 7.41 | -13.41 | 1 | 6 | 0 | 67 | 295.346 | 2 | ↓ |
| Hi High (pH 8-9.5) | 2.11 | 5.2 | -45.12 | 0 | 6 | -1 | 70 | 294.338 | 2 | ↓ |
| Lo Low (pH 4.5-6) | 1.65 | 8.01 | -47.12 | 2 | 6 | 1 | 68 | 296.354 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
![1,5-dihydropyrazolo[3,4-d]pyrimidin-4-one](http://zinc12.docking.org/img/rings/1171.gif)
![6-(3,4-dihydro-2H-quinolin-1-ylmethyl)-1,5-dihydropyrazolo[3,4-d]pyrimidin-4-one](http://zinc12.docking.org/img/rings/24987.gif)