| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 11th, 2010 | 20 | Yes |
Popular Name: [3-[(3,4,5-trimethylpyrazol-1-yl)methyl]benzofuran-2-yl]methanamine [3-[(3,4,5-trimethylpyrazol-1-yl…
| 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) | 2.48 | 6.32 | -46.02 | 3 | 4 | 1 | 59 | 270.356 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 2.48 | 6.19 | -104.94 | 4 | 4 | 2 | 60 | 271.364 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
