PDB ligand accession: 2RL
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: RNHWXYKRVZUXGO-UHFFFAOYSA-N
SMILES: COc1cc2c(ccnc2cc1OC)Oc3ccc4c(c3)OCCN4C(=O)Nc5ccc(cc5)Cl
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organic oxygen compounds
- Class: Organooxygen compounds
- Subclass: Ethers
- Class: Organooxygen compounds
- Superclass: Organic oxygen compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
2RL5 | Download | Experimental | e2rl5A1 | Protein kinase/SAICAR synthase/ATP-grasp | LigPlot |