| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 7th, 2010 | 16 | Yes |
Popular Name: 3,4-Dimethyl-2-(1H-pyrazol-1-yl)benzoic acid 3,4-Dimethyl-2-(1H-pyrazol-1-yl)…
Find On: PubMed — Wikipedia — Google
CAS Numbers: 1214622-51-1 , N/A
| 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) | 2.41 | 8.05 | -56.18 | 0 | 4 | -1 | 58 | 215.232 | 2 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Warnings | IRRITANT | Matrix Scientific |
No pre-computed analogs available. Try a structural similarity search.
