| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 20th, 2010 | 25 | Yes |
Popular Name: 3-propyl-2-(4-pyridylmethylamino)-5,6,7,8-tetrahydrobenzothiopheno[2,3-d]pyrimidin-4-one 3-propyl-2-(4-pyridylmethylamino…
| 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) | 3.15 | 11.4 | -12.08 | 1 | 5 | 0 | 60 | 354.479 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 3.15 | 11.86 | -49.24 | 2 | 5 | 1 | 61 | 355.487 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
![5,6,7,8-tetrahydro-3H-benzothiopheno[2,3-d]pyrimidin-4-one](http://zinc12.docking.org/img/rings/3359.gif)
![2-(4-pyridylmethylamino)-5,6,7,8-tetrahydro-3H-benzothiopheno[2,3-d]pyrimidin-4-one](http://zinc12.docking.org/img/rings/539126.gif)