| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 6th, 2004 | 20 | Yes |
Popular Name: N 20C hydrochloride N 20C hydrochloride
Find On: PubMed — Wikipedia — Google
CAS Numbers: 76991-05-4; 928313-94-4 , 928313-94-4
| 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) | 1.94 | 6.12 | -45.36 | 4 | 3 | 1 | 60 | 269.368 | 7 | ↓ |
| Hi High (pH 8-9.5) | 1.94 | 4.76 | -9.34 | 3 | 3 | 0 | 55 | 268.36 | 7 | ↓ |
| Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| Z50425-7-O | Plasmodium Falciparum (cluster #7 Of 22), Other | Other | 2512 | 0.39 | Functional ≤ 10μM |
| Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| Z50425 | Z50425 | Plasmodium Falciparum | 1584.89319 | 0.41 | Functional ≤ 10μM |
No pre-computed analogs available. Try a structural similarity search.