PDB ligand accession: 78H
DrugBank: n/a
PubChem: 170;5280384;135398662;
ChEMBL:
InChI Key: WBFYVDCHGVNRBH-UHFFFAOYSA-N
SMILES: c1cc(ccc1C(=O)O)NCC2=NC3=C(NC2)N=C(NC3=O)N
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Pteridines and derivatives
- Subclass: Pterins and derivatives
- Class: Pteridines and derivatives
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
7S2K | Download | Experimental | e7s2kA1 e7s2kB1 | TIM beta/alpha-barrel TIM beta/alpha-barrel | LigPlot |