In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 5th, 2005 | 18 | Yes |
Popular Name: 4-(5-oxo-3-propyl-2,5-dihydro-1H-pyrazol-1-yl)benzoic acid 4-(5-oxo-3-propyl-2,5-dihydro-1H…
Find On: PubMed — Wikipedia — Google
CAS Number: 700849-61-2
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) | 2.32 | -0.36 | -56.42 | 1 | 5 | -1 | 77 | 245.258 | 4 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
Purity | 95% | Fluorochem |
No pre-computed analogs available. Try a structural similarity search.