PDB ligand accession: TB9
DrugBank: DB08598
PubChem: 64995;3000237;
ChEMBL:
InChI Key: RCSLUNOLLUVOOG-NSHDSACASA-N
SMILES: CC1CN2c3c(cc(cc3NC2=S)Cl)CN1CC=C(C)C
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Benzodiazepines
- Subclass: 1,4-benzodiazepines
- Class: Benzodiazepines
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
1REV | Download | Experimental | e1revA5 e1revA7 e1revB2 | Ribonuclease H-like Alpha-beta plaits Alpha-beta plaits | LigPlot |