| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 10th, 2009 | 28 | Yes |
Popular Name: 6-(2-diethylaminoethyl)-3-[4-(trifluoromethoxy)phenyl]triazolo[4,5-d]pyrimidin-7-one 6-(2-diethylaminoethyl)-3-[4-(tr…
| 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) | 3.23 | 9.43 | -57.03 | 1 | 8 | 1 | 79 | 397.381 | 8 | ↓ |
| Hi High (pH 8-9.5) | 3.23 | 7.31 | -16.54 | 0 | 8 | 0 | 78 | 396.373 | 8 | ↓ |
![3,6-dihydrotriazolo[4,5-d]pyrimidin-7-one](http://zinc12.docking.org/img/rings/75972.gif)
![3-phenyl-6H-triazolo[4,5-d]pyrimidin-7-one](http://zinc12.docking.org/img/rings/81787.gif)
