PDB ligand accession: 8RD
DrugBank: n/a
PubChem:
ChEMBL: n/a
InChI Key: NIWAAHIPMDGEGU-UHFFFAOYSA-N
SMILES: Cc1c(c(nn1C)C(=O)N2CCOCC2)CCOc3cc(ccc3c4ccc5nnc(n5c4)CNC)F
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Pyridines and derivatives
- Subclass: Phenylpyridines
- Class: Pyridines and derivatives
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
5V0X | Download | Experimental | e5v0xA1 e5v0xA2 e5v0xB1 e5v0xB2 e5v0xC1 e5v0xC2 | Nat/Ivy Nat/Ivy Nat/Ivy Nat/Ivy Nat/Ivy Nat/Ivy | LigPlot |