| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 17th, 2004 | 24 | Yes |
Popular Name: 4-anilino-8-methoxy-quinoline-3-carboxylic-acid-ethyl-ester 4-anilino-8-methoxy-quinoline-3-…
| 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) | 4.36 | 8.65 | -9.96 | 1 | 5 | 0 | 60 | 322.364 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 4.36 | 9.14 | -31.09 | 2 | 5 | 1 | 62 | 323.372 | 6 | ↓ |
| Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| ATP4A-1-E | Potassium-transporting ATPase Alpha Chain 1 (cluster #1 Of 1), Eukaryotic | Eukaryotes | 3540 | 0.32 | Binding ≤ 10μM |
| ATP4B-1-E | Potassium-transporting ATPase Beta Chain (cluster #1 Of 1), Eukaryotic | Eukaryotes | 3540 | 0.32 | Binding ≤ 10μM |
| Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| ATP4A_PIG | P19156 | Potassium-transporting ATPase Alpha Chain 1, Pig | 3540 | 0.32 | Binding ≤ 10μM |
| ATP4B_PIG | P18434 | Potassium-transporting ATPase Beta Chain, Pig | 3540 | 0.32 | Binding ≤ 10μM |
| Description | Species |
|---|---|
| Ion transport by P-type ATPases |
