| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 11th, 2010 | 17 | Yes |
Popular Name: 1-[1-[2-(3,5-dimethylpyrazol-1-yl)ethyl]triazol-4-yl]-N-methyl-methanamine 1-[1-[2-(3,5-dimethylpyrazol-1-y…
| 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) | 0.17 | 3.79 | -48.83 | 2 | 6 | 1 | 65 | 235.315 | 5 | ↓ |
| Hi High (pH 8-9.5) | 0.17 | 2.34 | -13.69 | 1 | 6 | 0 | 61 | 234.307 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 0.17 | 3.93 | -85.14 | 3 | 6 | 2 | 66 | 236.323 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
