| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 23rd, 2011 | 10 | Yes |
Popular Name: 1-(5-Bromo-4-methyl-1H-pyrrol-3-yl)ethanone 1-(5-Bromo-4-methyl-1H-pyrrol-3-…
Find On: PubMed — Wikipedia — Google
CAS Number: 202286-27-9
| 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) | 1.99 | 4.01 | -10 | 1 | 2 | 0 | 33 | 202.051 | 1 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Purity | 95% | Fluorochem |
| PUBCHEM_PATENT_ID | EP0912548A1; WO1998002430A1 | IBM Patent Data |
No pre-computed analogs available. Try a structural similarity search.