CHEMBL5770083
| SMILES | COc1cc(C(=O)N[C@H](C)C(=O)N2[C@H](c3cccc(Cl)c3)CC[C@@H]2C(C)(C)C#N)cc(C)c1Oc1cc(C)n[nH]c1=O |
| InChIKey | SZNWIGQWZUMRAV-FRPAHBMMSA-N |
Chemical properties
| Hydrogen bond acceptors | 7 |
| Hydrogen bond donors | 2 |
| Rotatable bonds | 8 |
| Molecular weight (Da) | 591.2 |
Drug properties
| Molecular type | Small molecule |
| Physiological/Surrogate | Surrogate |
| Approved drug | No |
Database connections
Bioactivities
| Receptor | Activity | Source | |||||||
|---|---|---|---|---|---|---|---|---|---|
| GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
| calcitonin-like | CALRL | Human | Calcitonin | B1 | pKi | 10.15 | 10.15 | 10.15 | ChEMBL |
| Receptor | Activity | Source | |||||||
|---|---|---|---|---|---|---|---|---|---|
| GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
| calcitonin-like | CALRL | Human | Calcitonin | B1 | pIC50 | 10.7 | 10.7 | 10.7 | ChEMBL |