| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 6th, 2008 | 32 | No |
| 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) | 0.40 | 7.09 | -48.58 | 2 | 8 | 1 | 77 | 460.624 | 8 | ↓ |
| Hi High (pH 8-9.5) | 0.40 | 4.78 | -16.19 | 1 | 8 | 0 | 76 | 459.616 | 8 | ↓ |
| Mid Mid (pH 6-8) | 0.40 | 7.09 | -53.3 | 2 | 8 | 1 | 77 | 460.624 | 8 | ↓ |
![3,6,7,8a-tetrahydro-1H-thiazolo[3,4-a]pyrazine-5,8-quinone](http://zinc12.docking.org/img/rings/85413.gif)
![4-[(5,8-diketo-1,3,6,8a-tetrahydrothiazolo[3,4-a]pyrazin-7-yl)methyl]-N-(3-piperazinopropyl)benzamide](http://zinc12.docking.org/img/rings/85488.gif)
