| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 3rd, 2010 | 21 | Yes |
Popular Name: 6-[[cyclohexylmethyl(methyl)amino]methyl]-1-methyl-5H-pyrazolo[3,4-d]pyrimidin-4-one 6-[[cyclohexylmethyl(methyl)amin…
| 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) | 2.19 | 5.38 | -46.35 | 1 | 6 | 0 | 71 | 289.383 | 4 | ↓ |
| Mid Mid (pH 6-8) | 1.73 | 6.28 | -10.4 | 1 | 6 | 0 | 67 | 289.383 | 4 | ↓ |
| Mid Mid (pH 6-8) | 1.73 | 8.16 | -56.57 | 2 | 6 | 1 | 68 | 290.391 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
![1H-pyrazolo[3,4-d]pyrimidine](http://zinc12.docking.org/img/rings/1523.gif)
![Cyclohexylmethyl(1H-pyrazolo[3,4-d]pyrimidin-6-ylmethyl)amine](http://zinc12.docking.org/img/rings/29383.gif)