In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 8th, 2004 | 14 | Yes |
Popular Name: 8-Hydroxyquinoline-4-carboxylic acid 8-Hydroxyquinoline-4-carboxylic …
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CAS Number: 55698-67-4
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) | 1.48 | 2.53 | -46.52 | 1 | 4 | -1 | 73 | 188.162 | 1 | ↓ |
Hi High (pH 8-9.5) | 1.48 | 3.3 | -102.43 | 0 | 4 | -2 | 76 | 187.154 | 1 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
PUBCHEM_PATENT_ID | US3956420; WO2000001692A1 | IBM Patent Data |