PDB ligand accession: T15
DrugBank: n/a
PubChem:
ChEMBL: n/a
InChI Key: JIBFIIUWYBXSQB-UHFFFAOYSA-N
SMILES: Cc1c(n(cn1)CC(=O)NC(C)(C)C)CNC(=O)CN2C(=CC=C(C2=O)NS(=O)(=O)Cc3ccccc3)C
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Pyridines and derivatives
- Subclass: Hydropyridines
- Class: Pyridines and derivatives
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
3C1K | Download | Experimental | e3c1kA1 | cradle loop barrel | LigPlot |