| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 26th, 2005 | 24 | Yes |
Popular Name: 6-methoxy-1-(2-methoxyphenyl)-4-methyl-2,3-dihydro-1H-pyrrolo[3,2-c]quinoline 6-methoxy-1-(2-methoxyphenyl)-4-…
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CAS Number: 122456-44-4
| 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) | 4.40 | 8.96 | -22.49 | 1 | 4 | 1 | 36 | 321.4 | 3 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| melting_point | 169 - 170 | KeyOrganics |
| 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 | 1600 | 0.34 | Binding ≤ 10μM |
| Z50590-1-O | Sus Scrofa (cluster #1 Of 1), Other | Other | 230 | 0.39 | Functional ≤ 10μM |
| Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| ATP4A_PIG | P19156 | Potassium-transporting ATPase Alpha Chain 1, Pig | 1600 | 0.34 | Binding ≤ 10μM |
| Z50590 | Z50590 | Sus Scrofa | 230 | 0.39 | Functional ≤ 10μM |
