PDB ligand accession: U7S
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: BGJMKHPWCFXMOW-UHFFFAOYSA-N
SMILES: Cc1c(sc(c1Br)C(=C)F)CNCCCNC2=CC(=O)c3ccccc3N2
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Quinolines and derivatives
- Subclass: Aminoquinolines and derivatives
- Class: Quinolines and derivatives
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
6WQS | Download | Experimental | e6wqsA1 | HUP domain-like | LigPlot |