| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 25th, 2008 | 12 | Yes |
Popular Name: 5-Azaindole-2-carboxylic acid 5-Azaindole-2-carboxylic acid
Find On: PubMed — Wikipedia — Google
CAS Number: 800401-65-4
| 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) | 0.88 | 2.24 | -44.5 | 1 | 4 | -1 | 69 | 161.14 | 1 | ↓ |
| Lo Low (pH 4.5-6) | 0.88 | 2.52 | -58.79 | 2 | 4 | 0 | 70 | 162.148 | 1 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Purity | 95% | Fluorochem |
| Purity | 95+% | Matrix Scientific |
| PUBCHEM_PATENT_ID | EP0507861A1; EP0507861B1; US5489593; US5563142; WO1991009849A1 | IBM Patent Data |
| Warnings | IRRITANT | Matrix Scientific |
No pre-computed analogs available. Try a structural similarity search.