| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 7th, 2008 | 14 | Yes |
Popular Name: 4-(2-AMINOETHYL)AMINOQUINOLINE 4-(2-AMINOETHYL)AMINOQUINOLINE
Find On: PubMed — Wikipedia — Google
CAS Number: 259731-83-4
| 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) | 0.84 | 2.33 | -95.54 | 5 | 3 | 2 | 54 | 189.262 | 3 | ↓ |
| Hi High (pH 8-9.5) | 0.84 | 1.91 | -57.9 | 4 | 3 | 1 | 53 | 188.254 | 3 | ↓ |
| Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| Z50425-3-O | Plasmodium Falciparum (cluster #3 Of 22), Other | Other | 4700 | 0.53 | Functional ≤ 10μM |
| Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| Z50425 | Z50425 | Plasmodium Falciparum | 4700 | 0.53 | Functional ≤ 10μM |
