| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 5th, 2010 | 27 | No |
Popular Name: N-butyl-2-[[4-imino-3-methyl-5-(o-tolyl)-1H-pyrazolo[3,4-d]pyrimidin-6-yl]sulfanyl]acetamide N-butyl-2-[[4-imino-3-methyl-5-(…
| 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) | -0.26 | 8.95 | -31.97 | 4 | 7 | 1 | 101 | 385.517 | 7 | ↓ |
| Mid Mid (pH 6-8) | 2.00 | 8.9 | -12.79 | 3 | 7 | 0 | 99 | 384.509 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
![2H-pyrazolo[3,4-d]pyrimidine](http://zinc12.docking.org/img/rings/3780.gif)
![5-phenyl-2H-pyrazolo[3,4-d]pyrimidin-5-ium](http://zinc12.docking.org/img/rings/581529.gif)