| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 5th, 2011 | 26 | Yes |
| 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) | 1.45 | 8.53 | -56.77 | 2 | 6 | 1 | 77 | 372.518 | 5 | ↓ |
| Mid Mid (pH 6-8) | 1.45 | 8.55 | -58.54 | 2 | 6 | 1 | 77 | 372.518 | 5 | ↓ |
| Mid Mid (pH 6-8) | 1.45 | 6.29 | -15.72 | 1 | 6 | 0 | 76 | 371.51 | 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-(piperazinomethyl)-5,6,7,8-tetrahydro-3H-benzothiopheno[2,3-d]pyrimidin-4-one](http://zinc12.docking.org/img/rings/23457.gif)