PDB ligand accession: 0V2
DrugBank: n/a
PubChem: n/a
ChEMBL: n/a
InChI Key: MEAOCIHCGKYHPF-AFARHQOCSA-N
SMILES: CNc1[nH]c2cc3c(c(c2n1)CCNCC4CCC(CC4)C#Cc5ccc(cc5)c6ccccc6)N=C(NC3=O)N
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Benzenoids
- Class: Benzene and substituted derivatives
- Subclass: Biphenyls and derivatives
- Class: Benzene and substituted derivatives
- Superclass: Benzenoids
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
4FR1 | Download | Experimental | e4fr1A1 | TIM beta/alpha-barrel | LigPlot |