| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 31st, 2011 | 24 | Yes |
Popular Name: (3S)-1-[(2-phenyltriazol-4-yl)methyl]-3-(1,2,4-triazol-1-ylmethyl)piperidine (3S)-1-[(2-phenyltriazol-4-yl)me…
| 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) | 1.09 | 11.18 | -51 | 1 | 7 | 1 | 66 | 324.412 | 5 | ↓ |
| Hi High (pH 8-9.5) | 1.09 | 8.96 | -14.77 | 0 | 7 | 0 | 65 | 323.404 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
![1-[(2-phenyltriazol-4-yl)methyl]-3-(1,2,4-triazol-1-ylmethyl)piperidine](http://zinc12.docking.org/img/rings/497586.gif)