| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 16th, 2008 | 14 | Yes |
Popular Name: 3,4-Dihydroxy-1-methylquinolin-2(1H)-one 3,4-Dihydroxy-1-methylquinolin-2…
Find On: PubMed — Wikipedia — Google
CAS Number: 41878-54-0
| 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) | 0.55 | 2.5 | -50.21 | 1 | 4 | -1 | 65 | 190.178 | 0 | ↓ |
| Lo Low (pH 4.5-6) | 1.40 | 2.55 | -55.13 | 1 | 4 | -1 | 65 | 190.178 | 0 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| ALOGPS_SOLUBILITY | 1.36e+01 g/l | DrugBank-experimental |
