| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 5th, 2005 | 16 | No |
Popular Name: 4-(2,5-dioxo-2,5-dihydro-1h-pyrrol-1-yl)benzoic acid 4-(2,5-dioxo-2,5-dihydro-1h-pyrr…
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CAS Numbers: 17057-04-4 , [17057-04-4]
4-(2,5-Dioxo-2,5-dihydro-1H-pyrrol-1-yl)-benzoic acid
4-(2,5-dioxo-2,5-dihydro-1h-pyrrol-1-yl)-benzoicacid
4-(2,5-Dioxo-2,5-dihydro-pyrrol-1-yl)-benzoic acid
4-(2,5-Dioxo-2,5-dihydropyrrol-1-yl)-benzoic acid
| 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) | 0.97 | 4.48 | -55.39 | 0 | 5 | -1 | 79 | 216.172 | 2 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| MP | 164 - 166 | Enamine Building Blocks |
| MP | 164...166 | Enamine Building Blocks |
| MP | 229 - 231 | Enamine Building Blocks |
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
| Purity | 96% | Fluorochem |
| Warnings | IRRITANT | Matrix Scientific |
No pre-computed analogs available. Try a structural similarity search.