In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 16th, 2009 | 15 | Yes |
Popular Name: 4,7-Dihydroxyquinoline-3-carboxylic acid 4,7-Dihydroxyquinoline-3-carboxy…
Find On: PubMed — Wikipedia — Google
CAS Number: 63463-27-4
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) | -0.30 | 2.97 | -66.34 | 2 | 5 | -1 | 93 | 204.161 | 1 | ↓ |
Hi High (pH 8-9.5) | 0.81 | 3.21 | -110.43 | 1 | 5 | -2 | 96 | 203.153 | 1 | ↓ |
Hi High (pH 8-9.5) | 1.00 | 0.68 | -91.17 | 1 | 5 | -2 | 96 | 203.153 | 1 | ↓ |
Lo Low (pH 4.5-6) | 1.00 | 1.1 | -39.4 | 3 | 5 | 0 | 95 | 205.169 | 1 | ↓ |