| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 18th, 2008 | 32 | No |
None
| 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) | 1.04 | 6.11 | -58.32 | 2 | 12 | 1 | 175 | 476.472 | 5 | ↓ |
| Hi High (pH 8-9.5) | 1.04 | 6.14 | -29.71 | 1 | 12 | 0 | 173 | 475.464 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 1.04 | 6.12 | -113.27 | 3 | 12 | 2 | 176 | 477.48 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
![5-imino-6-methylene-[1,2,4]thiadiazolo[4,5-a]pyrimidin-7-one](http://zinc12.docking.org/img/rings/24044.gif)
![5-imino-6-[(5-phenyl-2-furyl)methylene]-[1,2,4]thiadiazolo[4,5-a]pyrimidin-7-one](http://zinc12.docking.org/img/rings/68754.gif)