| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 26th, 2005 | 33 | Yes |
Popular Name: N-[6-(2-hydroxyethoxy)-5-(3-methoxyphenoxy)-pyrimidin-4-yl]-4-tert-butyl-benzenesulfonamide N-[6-(2-hydroxyethoxy)-5-(3-meth…
| 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) | 4.09 | 4.92 | -55.34 | 1 | 9 | -1 | 122 | 472.543 | 10 | ↓ |
| Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| EDNRA-3-E | Endothelin Receptor ET-A (cluster #3 Of 3), Eukaryotic | Eukaryotes | 160 | 0.29 | Binding ≤ 10μM |
| EDNRB-1-E | Endothelin B Receptor (cluster #1 Of 1), Eukaryotic | Eukaryotes | 1100 | 0.25 | Binding ≤ 10μM |
| Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| EDNRA_PIG | Q29010 | Endothelin Receptor ET-A, Pig | 160 | 0.29 | Binding ≤ 1μM |
| EDNRA_RAT | P26684 | Endothelin Receptor ET-A, Rat | 230 | 0.28 | Binding ≤ 1μM |
| EDNRA_PIG | Q29010 | Endothelin Receptor ET-A, Pig | 160 | 0.29 | Binding ≤ 10μM |
| EDNRA_RAT | P26684 | Endothelin Receptor ET-A, Rat | 230 | 0.28 | Binding ≤ 10μM |
| EDNRB_HUMAN | P24530 | Endothelin Receptor ET-B, Human | 1100 | 0.25 | Binding ≤ 10μM |
| Description | Species |
|---|---|
| G alpha (q) signalling events | |
| Peptide ligand-binding receptors |
