| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 11th, 2010 | 20 | Yes |
Popular Name: [2-[(4-chloro-3,5-dimethyl-pyrazol-1-yl)methyl]benzofuran-3-yl]methanamine [2-[(4-chloro-3,5-dimethyl-pyraz…
| 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) | 2.71 | 6.22 | -49.46 | 3 | 4 | 1 | 59 | 290.774 | 3 | ↓ |
| Hi High (pH 8-9.5) | 2.71 | 5.82 | -7.39 | 2 | 4 | 0 | 57 | 289.766 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
