| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 23rd, 2008 | 12 | Yes |
Popular Name: 1H-pyrrolo[2,3-b]pyridine-3-carboxylic acid 1H-pyrrolo[2,3-b]pyridine-3-carb…
Find On: PubMed — Wikipedia — Google
CAS Numbers: 156270-06-3 , [156270-06-3]
"7-Azaindole-3-carboxylic acid, 97%"
1H-PYRROLO[2,3-B]PYRIDINE-3-CARBOXYLICACID
| 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) | 0.76 | 3.38 | -52.52 | 1 | 4 | -1 | 69 | 161.14 | 1 | ↓ |
| Lo Low (pH 4.5-6) | 0.76 | 3.63 | -60.05 | 2 | 4 | 0 | 70 | 162.148 | 1 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Melting_Point | 205-209? | Alfa-Aesar |
| Melting_Point | 205-209° | Alfa-Aesar |
| MP | 213 - 215 | Enamine Building Blocks |
| MP | 213...215 | Enamine Building Blocks |
| melting_point | 254 - 256 | KeyOrganics |
| MP | 254-256° | Matrix Scientific |
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
| Purity | 97% | Fluorochem |
| Purity | >95% | Matrix Scientific |
| Warnings | IRRITANT | Matrix Scientific |
| PUBCHEM_PATENT_ID | WO2000021951A1 | IBM Patent Data |
