Ligand Data
Ligand
| Name | CHEMBL3735910 |
| SMILES | CCCc1nc2c(C)cc(C(=O)N[C@@H](C)c3ccccc3)cc2n1Cc1ccc(-c2ccccc2-c2nnn[nH]2)cc1 |
| InChIKey | JBQLJPNVSMAEBZ-QHCPKHFHSA-N |
| Type | small-molecule |
| External Links |
Structure
Properties
| Hydrogen bond acceptors | 6 |
| Hydrogen bond donors | 2 |
| Rotatable bonds | 9 |
| Molecular weight | 555.3 |
Bioactivity
| Receptor | Affinity (nM) | Potency (nM) | ||||||||
|---|---|---|---|---|---|---|---|---|---|---|
| GTP | Uniprot | Species | Family | Class | Min | Avg | Max | Min | Avg | Max |
| AT1 | AGTR1 | Human | Angiotensin | A (Rhodopsin) | 1534 | 1534 | 1534 | |||