Ligand Data
Ligand
| Name | CHEMBL3121728 |
| SMILES | CN1C2=C(C(=O)N(C1=O)C)NC(=N2)C3=CC=C(C=C3)OCCCN4CCN(CC4)CC5=CC=CC=C5Cl |
| InChIKey | ACDUFNNGCHAONI-UHFFFAOYSA-N |
| Type | small molecule |
| External Links |
Structure
Properties
| Hydrogen bond acceptors | 6 |
| Hydrogen bond donors | 1 |
| Rotatable bonds | 8 |
| Molecular weight | 523.0 |
Bioactivity
| Receptor | Affinity (nM) | Potency (nM) | ||||||||
|---|---|---|---|---|---|---|---|---|---|---|
| GTP | Uniprot | Species | Family | Class | Min | Avg | Max | Min | Avg | Max |