PDB ligand accession: 2GU
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: CPSBEKUNRLHZKJ-UHFFFAOYSA-N
SMILES: CC1(CC(=O)Nc2c1ccc(c2)NC(=O)c3cc(ccc3F)c4ccc5c(c4)cnc(n5)N)C
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Diazanaphthalenes
- Subclass: Benzodiazines
- Class: Diazanaphthalenes
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
4N3R | Download | Experimental | e4n3rA1 e4n3rB1 | ADP-ribosylation ADP-ribosylation | LigPlot |