| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 11th, 2008 | 33 | No |
| 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) | -0.36 | -9.64 | -32.53 | 8 | 12 | 0 | 211 | 464.379 | 4 | ↓ |
| Hi High (pH 8-9.5) | -0.36 | -8.63 | -77.4 | 7 | 12 | -1 | 213 | 463.371 | 4 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| M.P. | 213 C (d) | Indofine |
| MP | 213o C, dec | Indofine |
| SOLUBILITY | Store in Dry dark place | Indofine |
| APPEARANCE | Yellow powder | Indofine |
| Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| ADA2C-1-E | Alpha-2c Adrenergic Receptor (cluster #1 Of 4), Eukaryotic | Eukaryotes | 4 | 0.36 | Binding ≤ 10μM |
| NOX4-1-E | NADPH Oxidase 4 (cluster #1 Of 1), Eukaryotic | Eukaryotes | 830 | 0.26 | Binding ≤ 10μM |
| Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| ADA2C_HUMAN | P18825 | Alpha-2c Adrenergic Receptor, Human | 4 | 0.36 | Binding ≤ 1μM |
| NOX4_HUMAN | Q9NPH5 | NADPH Oxidase 4, Human | 830 | 0.26 | Binding ≤ 1μM |
| ADA2C_HUMAN | P18825 | Alpha-2c Adrenergic Receptor, Human | 4 | 0.36 | Binding ≤ 10μM |
| NOX4_HUMAN | Q9NPH5 | NADPH Oxidase 4, Human | 830 | 0.26 | Binding ≤ 10μM |
| Description | Species |
|---|---|
| Adrenaline signalling through Alpha-2 adrenergic receptor | |
| Adrenaline,noradrenaline inhibits insulin secretion | |
| Adrenoceptors | |
| G alpha (i) signalling events | |
| G alpha (z) signalling events |
