PDB ligand accession: PK2
DrugBank: n/a
PubChem: 44199329;135566446;
ChEMBL: n/a
InChI Key: ZKRVOXSNLYAMLM-UHFFFAOYSA-N
SMILES: CNc1[nH]c2cc3c(c(c2n1)CCNCC4CCCCC4)N=C(NC3=O)N
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Diazanaphthalenes
- Subclass: Benzodiazines
- Class: Diazanaphthalenes
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
5I02 | Download | Experimental | e5i02A1 | TIM beta/alpha-barrel | LigPlot |
3EOS | Download | Experimental | e3eosA1 | TIM beta/alpha-barrel | LigPlot |