PDB ligand accession: RHQ
DrugBank: DB03825
PubChem:
ChEMBL: n/a
InChI Key: IWWWBRIIGAXLCJ-KRUMMXJUSA-O
SMILES: CCNc1cc2c(cc1C)C(=C3C=C(C(=[NH+]CC)C=C3O2)C)c4ccccc4C(=O)OCC
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Benzopyrans
- Subclass: 1-benzopyrans
- Class: Benzopyrans
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
3VVZ | Download | Experimental | e3vvzA1 e3vvzA2 e3vvzB1 e3vvzB2 e3vvzC1 e3vvzC2 e3vvzD1 e3vvzD2 | HTH Tetracyclin repressor-like, C-terminal domain Tetracyclin repressor-like, C-terminal domain HTH HTH Tetracyclin repressor-like, C-terminal domain Tetracyclin repressor-like, C-terminal domain HTH | LigPlot |