| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 10th, 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) | 1.16 | 5.93 | -57.4 | 4 | 7 | 1 | 87 | 351.434 | 1 | ↓ |
| Hi High (pH 8-9.5) | 1.16 | 4.58 | -11.29 | 3 | 7 | 0 | 82 | 350.426 | 1 | ↓ |
| Mid Mid (pH 6-8) | 1.16 | 4.99 | -37.88 | 4 | 7 | 1 | 83 | 351.434 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
![5,6,7,8-tetrahydropyrido[3,4-d]pyrimidine](http://zinc12.docking.org/img/rings/25634.gif)
![Spiro[1,4-dihydroquinoxaline-3,4'-piperidine]-2-one](http://zinc12.docking.org/img/rings/386563.gif)
![1'-(5,6,7,8-tetrahydropyrido[3,4-d]pyrimidin-4-yl)spiro[1,4-dihydroquinoxaline-3,4'-piperidine]-2-one](http://zinc12.docking.org/img/rings/530057.gif)