PDB ligand accession: X2N
DrugBank: DB01263
PubChem:
ChEMBL:
InChI Key: RAGOYPUPXAKGKH-XAKZXMRKSA-N
SMILES: CCC(C(C)O)N1C(=O)N(C=N1)c2ccc(cc2)N3CCN(CC3)c4ccc(cc4)OCC5CC(OC5)(Cn6cncn6)c7ccc(cc7F)F
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Diazinanes
- Subclass: Piperazines
- Class: Diazinanes
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
2X2N | Download | Experimental | e2x2nA1 e2x2nB1 e2x2nC1 e2x2nD1 | Cytochrome P450 Cytochrome P450 Cytochrome P450 Cytochrome P450 | LigPlot |