PDB ligand accession: 2GY
DrugBank: n/a
PubChem: n/a
ChEMBL:
InChI Key: QTAONPFQLNZKSD-XJABCFGWSA-N
SMILES: CC1(C(N(C(=O)O1)C2CCC(CC2)c3cc(c(nc3)N)c4ncccn4)c5ccccc5)C
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Diazines
- Subclass: Pyrimidines and pyrimidine derivatives
- Class: Diazines
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
4N4V | Download | Experimental | e4n4vA1 e4n4vB1 | ADP-ribosylation ADP-ribosylation | LigPlot |