| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 23rd, 2009 | 21 | Yes |
Popular Name: 5,6-dimethyl-2-[[(1-methyl-4-piperidyl)amino]methyl]-1H-thieno[2,3-d]pyrimidin-4-one 5,6-dimethyl-2-[[(1-methyl-4-pip…
None
| 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) | 1.43 | 5.02 | -51.29 | 3 | 5 | 1 | 62 | 307.443 | 3 | ↓ |
| Hi High (pH 8-9.5) | 1.88 | 1.84 | -44.98 | 2 | 5 | 0 | 69 | 306.435 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 1.43 | 6.21 | -124.37 | 4 | 5 | 2 | 67 | 308.451 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
![1H-thieno[2,3-d]pyrimidin-4-one](http://zinc12.docking.org/img/rings/13361.gif)
![2-[(4-piperidylamino)methyl]-1H-thieno[2,3-d]pyrimidin-4-one](http://zinc12.docking.org/img/rings/553439.gif)