In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 21st, 2013 | 30 | No |
Popular Name: 1H-Pyrazole-5-carbaldehyde 1H-Pyrazole-5-carbaldehyde
Find On: PubMed — Wikipedia — Google
CAS Numbers: 3920-50-1 , 948552-36-1 , [3920-50-1] , [948552-36-1]
None
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) | 0.35 | 0.69 | -7.83 | 1 | 3 | 0 | 46 | 96.089 | 1 | ↓ |
Hi High (pH 8-9.5) | 4.24 | 9.93 | -11.81 | 1 | 6 | 0 | 74 | 408.498 | 9 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
Purity | 95% | Fluorochem |
Purity | 97% | Fluorochem |
No pre-computed analogs available. Try a structural similarity search.