| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 23rd, 2004 | 16 | No |
Popular Name: 4-benzoyl-1-methyl-1H-pyrrole-2-carbaldehyde 4-benzoyl-1-methyl-1H-pyrrole-2-…
Find On: PubMed — Wikipedia — Google
CAS Numbers: 128843-58-3 , [128843-58-3]
| 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) | 2.33 | 6.91 | -11.88 | 0 | 3 | 0 | 39 | 213.236 | 3 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| melting_point | 112 - 114 | KeyOrganics |
| MP | 112-114° | Matrix Scientific |
| Purity | >95% | Matrix Scientific |
| Warnings | IRRITANT | Matrix Scientific |
No pre-computed analogs available. Try a structural similarity search.