| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 18th, 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) | 0.06 | 5.3 | -70.84 | 3 | 8 | 1 | 95 | 358.422 | 3 | ↓ |
| Hi High (pH 8-9.5) | 0.06 | 3.95 | -18.02 | 2 | 8 | 0 | 90 | 357.414 | 3 | ↓ |
| Mid Mid (pH 6-8) | 0.06 | 5.76 | -105.84 | 4 | 8 | 2 | 96 | 359.43 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
![5,6,7,8-tetrahydroimidazo[1,2-a]pyridine](http://zinc12.docking.org/img/rings/5447.gif)
![2,3,4,5-tetrahydro-1H-pyrido[2,1-g][1,4]diazepin-7-one](http://zinc12.docking.org/img/rings/22391.gif)
![7-keto-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-3-yl)-2,3,4,5-tetrahydro-1H-pyrido[2,1-g][1,4]diazepine-10-carboxamide](http://zinc12.docking.org/img/rings/609888.gif)