| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 14th, 2010 | 24 | Yes |
Popular Name: 6-[[ethyl-[(4-methoxyphenyl)methyl]amino]methyl]-1-methyl-5H-pyrazolo[3,4-d]pyrimidin-4-one 6-[[ethyl-[(4-methoxyphenyl)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) | 1.27 | 5.44 | -13.39 | 1 | 7 | 0 | 76 | 327.388 | 6 | ↓ |
| Mid Mid (pH 6-8) | 1.27 | 7.6 | -56.72 | 2 | 7 | 1 | 77 | 328.396 | 6 | ↓ |
| Mid Mid (pH 6-8) | 1.73 | 4.95 | -45.1 | 1 | 7 | 0 | 80 | 327.388 | 6 | ↓ |
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-[(benzylamino)methyl]-1,5-dihydropyrazolo[3,4-d]pyrimidin-4-one](http://zinc12.docking.org/img/rings/25038.gif)