| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| June 20th, 2008 | 20 | Yes |
Popular Name: 4-Hydroxy-6,7-dimethoxy-quinoline-3-carboxylic acid ethyl ester 4-Hydroxy-6,7-dimethoxy-quinolin…
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CAS Number: 13436-14-1
| 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) | 0.47 | 6.05 | -28.97 | 1 | 6 | 0 | 78 | 277.276 | 5 | ↓ |
| Hi High (pH 8-9.5) | 1.77 | 5.63 | -42.04 | 0 | 6 | -1 | 81 | 276.268 | 5 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| PUBCHEM_PATENT_ID | EP0343574A1; EP0343574B1; US5081121 | IBM Patent Data |
