| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| June 27th, 2008 | 17 | No |
Popular Name: 2-Bromophenanthrene-9,10-dione 2-Bromophenanthrene-9,10-dione
Find On: PubMed — Wikipedia — Google
CAS Number: 53622-33-6
| 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) | 3.56 | 8.2 | -10.88 | 0 | 2 | 0 | 34 | 287.112 | 0 | ↓ |
| Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| PTPRC-3-E | Leukocyte Common Antigen (cluster #3 Of 3), Eukaryotic | Eukaryotes | 400 | 0.53 | Binding ≤ 10μM |
| Z81338-1-O | T-cells (cluster #1 Of 3), Other | Other | 600 | 0.51 | Functional ≤ 10μM |
| Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| PTPRC_HUMAN | P08575 | Leukocyte Common Antigen, Human | 400 | 0.53 | Binding ≤ 1μM |
| PTPRC_HUMAN | P08575 | Leukocyte Common Antigen, Human | 400 | 0.53 | Binding ≤ 10μM |
| Z81338 | Z81338 | T-cells | 600 | 0.51 | Functional ≤ 10μM |
| Description | Species |
|---|---|
| Other semaphorin interactions | |
| Phosphorylation of CD3 and TCR zeta chains |
No pre-computed analogs available. Try a structural similarity search.