| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 9th, 2011 | 28 | Yes |
Popular Name: [4-[2-(1,2,4-triazol-1-yl)ethyl]piperazin-1-yl]methylBLAHone [4-[2-(1,2,4-triazol-1-yl)ethyl]…
| 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) | 1.26 | 8.46 | -17.13 | 0 | 7 | 0 | 59 | 378.48 | 5 | ↓ |
| Mid Mid (pH 6-8) | 1.26 | 10.71 | -55.64 | 1 | 7 | 1 | 60 | 379.488 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
![[4-[2-(1,2,4-triazol-1-yl)ethyl]piperazino]methylBLAHone](http://zinc12.docking.org/img/rings/521110.gif)