| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 16th, 2009 | 17 | Yes |
Popular Name: [1-[(3,5-dimethylisoxazol-4-yl)methyl]-3,5-dimethyl-pyrazol-4-yl]methanamine [1-[(3,5-dimethylisoxazol-4-yl)m…
| 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) | 0.39 | 3.33 | -51.54 | 3 | 5 | 1 | 72 | 235.311 | 3 | ↓ |
| Hi High (pH 8-9.5) | 0.39 | 2.93 | -11.1 | 2 | 5 | 0 | 70 | 234.303 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
