| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 6th, 2004 | 31 | Yes |
Popular Name: MRE-269 MRE-269
Find On: PubMed — Wikipedia — Google
CAS Numbers: 475085-57-5 , [475085-57-5]
| 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) | 4.25 | 0.46 | -52.27 | 0 | 6 | -1 | 78 | 418.517 | 11 | ↓ |
| Hi High (pH 8-9.5) | 7.27 | 15.48 | -7.78 | 0 | 3 | 0 | 36 | 414.545 | 3 | ↓ |
| Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| Z102352-1-O | Plasma (cluster #1 Of 3), Other | Other | 200 | 0.30 | Functional ≤ 10μM |
| Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| Z102352 | Z102352 | Plasma | 200 | 0.30 | Functional ≤ 10μM |
No pre-computed analogs available. Try a structural similarity search.