| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 14th, 2008 | 29 | Yes |
Popular Name: propyl propyl
| 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) | 6.51 | 12.06 | -17.4 | 1 | 5 | 0 | 72 | 428.579 | 7 | ↓ |
| Hi High (pH 8-9.5) | 6.97 | 10.7 | -48.24 | 0 | 5 | -1 | 75 | 427.571 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
![5,6,7,8-tetrahydro-1H-benzothiopheno[2,3-d]pyrimidin-4-one](http://zinc12.docking.org/img/rings/18273.gif)
![2-(benzylthio)-5,6,7,8-tetrahydro-1H-benzothiopheno[2,3-d]pyrimidin-4-one](http://zinc12.docking.org/img/rings/36271.gif)