In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 6th, 2009 | 12 | Yes |
Popular Name: 1-(1H-Indazol-7-yl)ethanone 1-(1H-Indazol-7-yl)ethanone
Find On: PubMed — Wikipedia — Google
CAS Numbers: 1159511-22-4 , [1159511-22-4]
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) | 1.48 | 3.78 | -11.54 | 1 | 3 | 0 | 46 | 160.176 | 1 | ↓ |
Ref Reference (pH 7) | 1.48 | 3.7 | -18.23 | 1 | 3 | 0 | 46 | 160.176 | 1 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
Purity | 95% | Fluorochem |
Purity | >95% | Matrix Scientific |
Warnings | IRRITANT | Matrix Scientific |
No pre-computed analogs available. Try a structural similarity search.