| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| June 8th, 2011 | 21 | No |
Popular Name: 1-[(3S)-1,3-dimethyl-2,3-dihydropyrazolo[3,4-b]pyridin-5-yl]-3-(4H-pyrazol-3-ylmethyl)urea 1-[(3S)-1,3-dimethyl-2,3-dihydro…
| 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) | 0.61 | 1.6 | -15.87 | 3 | 8 | 0 | 94 | 287.327 | 3 | ↓ |
| Mid Mid (pH 6-8) | 0.61 | 2.07 | -37.75 | 4 | 8 | 1 | 95 | 288.335 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
![2,3-dihydro-1H-pyrazolo[3,4-b]pyridine](http://zinc12.docking.org/img/rings/357360.gif)
![1-(2,3-dihydro-1H-pyrazolo[3,4-b]pyridin-5-yl)-3-(4H-pyrazol-3-ylmethyl)urea](http://zinc12.docking.org/img/rings/357359.gif)