| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 1st, 2008 | 34 | Yes |
| 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) | 5.34 | 12.19 | -49.94 | 2 | 4 | 1 | 45 | 471.612 | 4 | ↓ |
| Hi High (pH 8-9.5) | 5.34 | 9.79 | -13.44 | 1 | 4 | 0 | 44 | 470.604 | 4 | ↓ |
| Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| MC4R-1-E | Melanocortin Receptor 4 (cluster #1 Of 1), Eukaryotic | Eukaryotes | 27 | 0.31 | Binding ≤ 10μM |
| MC3R-1-E | Melanocortin Receptor 3 (cluster #1 Of 1), Eukaryotic | Eukaryotes | 1160 | 0.24 | Functional ≤ 10μM |
| MC4R-1-E | Melanocortin Receptor 4 (cluster #1 Of 1), Eukaryotic | Eukaryotes | 12 | 0.33 | Functional ≤ 10μM |
| MC5R-1-E | Melanocortin Receptor 5 (cluster #1 Of 1), Eukaryotic | Eukaryotes | 1980 | 0.23 | Functional ≤ 10μM |
| MSHR-1-E | Melanocortin Receptor 1 (cluster #1 Of 1), Eukaryotic | Eukaryotes | 1020 | 0.25 | Functional ≤ 10μM |
| Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| MC4R_HUMAN | P32245 | Melanocortin Receptor 4, Human | 27 | 0.31 | Binding ≤ 1μM |
| MC4R_HUMAN | P32245 | Melanocortin Receptor 4, Human | 27 | 0.31 | Binding ≤ 10μM |
| MSHR_HUMAN | Q01726 | Melanocortin Receptor 1, Human | 1020 | 0.25 | Functional ≤ 10μM |
| MC3R_HUMAN | P41968 | Melanocortin Receptor 3, Human | 1160 | 0.24 | Functional ≤ 10μM |
| MC4R_HUMAN | P32245 | Melanocortin Receptor 4, Human | 12 | 0.33 | Functional ≤ 10μM |
| MC5R_HUMAN | P33032 | Melanocortin Receptor 5, Human | 1980 | 0.23 | Functional ≤ 10μM |
| Description | Species |
|---|---|
| G alpha (s) signalling events | |
| Peptide ligand-binding receptors |
