PDB ligand accession: B8J
DrugBank: n/a
PubChem:
ChEMBL: n/a
InChI Key: MHNXUUQVKHVSPU-UHFFFAOYSA-N
SMILES: CN1c2ccccc2N(C1=O)C3CCN(CC3)CCCn4c5c(c(n4)c6ccc(cc6)C(F)(F)F)CN(CC5)C(=O)c7cnc[nH]7
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Azoles
- Subclass: Pyrazoles
- Class: Azoles
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
5QBU | Download | Experimental | e5qbuA1 e5qbuB1 | Cysteine proteinases-like Cysteine proteinases-like | LigPlot |