PDB ligand accession: PS8
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: HOIAFTVGAXSASA-UHFFFAOYSA-N
SMILES: Cc1c(c(n(n1)C)C)NS(=O)(=O)c2c(cc(cc2Cl)c3ccc(nc3)N4CCNCC4)Cl
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 |
---|---|---|---|---|---|
4A33 | Download | Experimental | e4a33A1 e4a33A2 | Nat/Ivy Nat/Ivy | LigPlot |