| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 30th, 2011 | 19 | Yes |
Popular Name: (2S)-2-[(3,5-dimethyl-1,2,4-triazol-1-yl)methyl]-1-(3-methylbut-2-enyl)piperidine (2S)-2-[(3,5-dimethyl-1,2,4-tria…
| 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 | 9.47 | -39.95 | 1 | 4 | 1 | 35 | 263.409 | 4 | ↓ |
| Hi High (pH 8-9.5) | 2.24 | 7.24 | -7.06 | 0 | 4 | 0 | 34 | 262.401 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
