| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 19th, 2010 | 20 | 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) | 1.99 | 6 | -47.32 | 3 | 5 | 1 | 68 | 338.229 | 4 | ↓ |
| Hi High (pH 8-9.5) | 1.99 | 5.56 | -51.89 | 1 | 5 | -1 | 66 | 336.213 | 4 | ↓ |
| Hi High (pH 8-9.5) | 1.99 | 6.75 | -36.19 | 2 | 5 | 0 | 70 | 337.221 | 4 | ↓ |
| Hi High (pH 8-9.5) | 1.99 | 4.8 | -16.55 | 2 | 5 | 0 | 63 | 337.221 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
![6,7-dihydro-5H-pyrrolo[2,1-c][1,2,4]triazole](http://zinc12.docking.org/img/rings/3616.gif)
![Benzyl(6,7-dihydro-5H-pyrrolo[2,1-c][1,2,4]triazol-3-ylmethyl)amine](http://zinc12.docking.org/img/rings/266117.gif)