| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 11th, 2007 | 44 | No |
Popular Name: bq-123 bq-123
| 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) | 0.53 | -8.03 | -58.4 | 5 | 13 | -1 | 192 | 609.704 | 7 | ↓ |
| Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| EDNRA-1-E | Endothelin Receptor ET-A (cluster #1 Of 3), Eukaryotic | Eukaryotes | 22 | 0.24 | Binding ≤ 10μM |
| Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| EDNRA_PIG | Q29010 | Endothelin Receptor ET-A, Pig | 22 | 0.24 | Binding ≤ 1μM |
| EDNRA_PIG | Q29010 | Endothelin Receptor ET-A, Pig | 22 | 0.24 | Binding ≤ 10μM |
