| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 11th, 2010 | 18 | Yes |
Popular Name: 2-methyl-N-[[5-[(4-methylpyrazol-1-yl)methyl]isoxazol-3-yl]methyl]propan-2-amine 2-methyl-N-[[5-[(4-methylpyrazol…
| 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) | 2.06 | 5.63 | -39.82 | 2 | 5 | 1 | 60 | 249.338 | 5 | ↓ |
| Hi High (pH 8-9.5) | 2.06 | 4.39 | -9.59 | 1 | 5 | 0 | 56 | 248.33 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
