| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 10th, 2009 | 23 | Yes |
Popular Name: (3S)-3-benzyl-1-propyl-3,4-dihydro-1,4-benzodiazepine-2,5-dione (3S)-3-benzyl-1-propyl-3,4-dihyd…
None
| 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) | 3.04 | 7.89 | -10.96 | 1 | 4 | 0 | 49 | 308.381 | 4 | ↓ |
| Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| MC5R-1-E | Melanocortin Receptor 5 (cluster #1 Of 1), Eukaryotic | Eukaryotes | 3267 | 0.33 | Functional ≤ 10μM |
| MSHR-1-E | Melanocortin Receptor 1 (cluster #1 Of 1), Eukaryotic | Eukaryotes | 6900 | 0.31 | Functional ≤ 10μM |
| Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| MSHR_MOUSE | Q01727 | Melanocortin Receptor 1, Mouse | 6900 | 0.31 | Functional ≤ 10μM |
| MC5R_MOUSE | P41149 | Melanocortin Receptor 5, Mouse | 3267 | 0.33 | Functional ≤ 10μM |
| Description | Species |
|---|---|
| G alpha (s) signalling events | |
| Peptide ligand-binding receptors |
