| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 19th, 2011 | 17 | No |
Popular Name: 6-[[(3S)-1,1-dioxothian-3-yl]amino]-2H-1,2,4-triazine-3,5-dione 6-[[(3S)-1,1-dioxothian-3-yl]ami…
| 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) | -1.44 | -3.25 | -16.85 | 3 | 8 | 0 | 125 | 260.275 | 2 | ↓ |
| Hi High (pH 8-9.5) | -0.98 | -4.92 | -48.75 | 2 | 8 | -1 | 128 | 259.267 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
![6-[(1,1-diketothian-3-yl)amino]-2H-1,2,4-triazine-3,5-quinone](http://zinc12.docking.org/img/rings/290306.gif)