PDB ligand accession: 4BH
DrugBank: DB07100
PubChem:
ChEMBL:
InChI Key: RFPHEBUOQYYPDO-UHFFFAOYSA-N
SMILES: c1c(c(cc(c1Cl)O)O)c2c(cn[nH]2)N3CCNCC3
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 |
---|---|---|---|---|---|
2CCS | Download | Experimental | e2ccsA1 | ATPase domain of HSP90 chaperone/DNA topoisomerase II/histidine kinase-like | LigPlot |