PDB ligand accession: H21
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: KAUVVMPQUJSRIS-UHFFFAOYSA-N
SMILES: c1cc(c(cc1N2C=CC=CC2=O)F)NC(=O)Cn3cnc(n3)NC(=O)c4ccc(s4)Cl
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Benzenoids
- Class: Benzene and substituted derivatives
- Subclass: Anilides
- Class: Benzene and substituted derivatives
- Superclass: Benzenoids
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
2VVV | Download | Experimental | e2vvvA1 | cradle loop barrel | LigPlot |