PDB ligand accession: 6EB
DrugBank: n/a
PubChem: 118871298;136959977;
ChEMBL:
InChI Key: GVIVKUKLHYWHES-UHFFFAOYSA-N
SMILES: Cn1cc(nc1)c2c3c(ccn2)c(nc(n3)OCCCC(F)(F)F)O
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Pyridopyrimidines
- Subclass: Pyrido[3,4-d]pyrimidines
- Class: Pyridopyrimidines
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
5IVF | Download | Experimental | e5ivfA1 | jelly-roll | LigPlot |