PDB ligand accession: QN7
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: RECVUKARQVUVBY-XMMPIXPASA-N
SMILES: COc1cccc(c1F)c2cccc(c2)C3(C4=NCC(CN4C(=N3)N)(F)F)c5ccncc5
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Benzenoids
- Class: Benzene and substituted derivatives
- Subclass: Biphenyls and derivatives
- Class: Benzene and substituted derivatives
- Superclass: Benzenoids
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
4ACU | Download | Experimental | e4acuA2 | cradle loop barrel | LigPlot |