| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 14th, 2011 | 27 | Yes |
Popular Name: 3-phenethyl-7-(9H-purin-6-yl)-5,6,8,9-tetrahydro-[1,2,4]triazolo[3,4-g][1,4]diazepine 3-phenethyl-7-(9H-purin-6-yl)-5,…
| 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) | 2.24 | 12.59 | -16.41 | 1 | 8 | 0 | 88 | 360.425 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
![6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[3,4-g][1,4]diazepine](http://zinc12.docking.org/img/rings/1805.gif)
![3-phenethyl-7-(9H-purin-6-yl)-5,6,8,9-tetrahydro-[1,2,4]triazolo[3,4-g][1,4]diazepine](http://zinc12.docking.org/img/rings/584854.gif)